Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
589734 | 2mvk RC | 25273 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 THR 298 H1 THR 298 24.143 -11.339 11.537
2 H2 THR 298 H2 THR 298 23.675 -12.919 11.430
3 H3 THR 298 H3 THR 298 22.568 -11.754 11.796
4 HA THR 298 HA THR 298 24.848 -12.524 13.502
5 HB THR 298 HB THR 298 23.574 -11.099 15.191
6 HG1 THR 298 HG1 THR 298 21.948 -9.827 14.450
7 HG21 THR 298 HG21 THR 298 24.414 -8.971 14.390
8 HG22 THR 298 HG22 THR 298 24.483 -9.562 12.719
9 HG23 THR 298 HG23 THR 298 25.586 -10.232 13.951
10 H ASN 299 H ASN 299 24.026 -13.489 15.630
11 HA ASN 299 HA ASN 299 22.148 -15.605 15.019
12 HB2 ASN 299 HB2 ASN 299 24.046 -15.920 16.567
13 HB3 ASN 299 HB3 ASN 299 23.343 -14.727 17.670
14 HD21 ASN 299 HD21 ASN 299 22.467 -17.772 15.994
15 HD22 ASN 299 HD22 ASN 299 21.558 -18.413 17.340
16 H ARG 300 H ARG 300 21.942 -12.495 16.578
17 HA ARG 300 HA ARG 300 18.976 -12.813 16.672
18 HB2 ARG 300 HB2 ARG 300 20.785 -11.578 18.785
19 HB3 ARG 300 HB3 ARG 300 19.079 -11.150 18.628
20 HG2 ARG 300 HG2 ARG 300 18.651 -12.826 20.043
21 HG3 ARG 300 HG3 ARG 300 18.987 -13.920 18.690
22 HD2 ARG 300 HD2 ARG 300 21.361 -14.005 19.370
23 HD3 ARG 300 HD3 ARG 300 21.001 -12.937 20.742
24 HE ARG 300 HE ARG 300 19.250 -15.174 20.842
25 HH11 ARG 300 HH11 ARG 300 22.686 -14.504 21.314
26 HH12 ARG 300 HH12 ARG 300 22.883 -15.831 22.423
27 HH21 ARG 300 HH21 ARG 300 19.590 -16.853 22.255
28 HH22 ARG 300 HH22 ARG 300 21.167 -17.138 22.936
29 H ARG 301 H ARG 301 18.071 -11.297 15.378
30 HA ARG 301 HA ARG 301 19.753 -9.351 14.037
31 HB2 ARG 301 HB2 ARG 301 16.803 -10.001 14.060
32 HB3 ARG 301 HB3 ARG 301 17.394 -8.555 13.249
33 HG2 ARG 301 HG2 ARG 301 18.444 -11.323 12.593
34 HG3 ARG 301 HG3 ARG 301 17.048 -10.586 11.790
35 HD2 ARG 301 HD2 ARG 301 18.614 -8.565 11.343
36 HD3 ARG 301 HD3 ARG 301 19.933 -9.682 11.727
37 HE ARG 301 HE ARG 301 19.350 -11.004 9.809
38 HH11 ARG 301 HH11 ARG 301 17.427 -8.037 9.999
39 HH12 ARG 301 HH12 ARG 301 16.946 -8.153 8.330
40 HH21 ARG 301 HH21 ARG 301 18.670 -11.069 7.688
41 HH22 ARG 301 HH22 ARG 301 17.627 -9.824 7.062
42 H LYS 302 H LYS 302 17.416 -9.158 16.676
43 HA LYS 302 HA LYS 302 16.708 -7.422 18.022
44 HB2 LYS 302 HB2 LYS 302 19.339 -6.107 17.229
45 HB3 LYS 302 HB3 LYS 302 18.297 -5.593 18.546
46 HG2 LYS 302 HG2 LYS 302 19.635 -8.329 18.410
47 HG3 LYS 302 HG3 LYS 302 20.332 -6.931 19.232
48 HD2 LYS 302 HD2 LYS 302 17.618 -8.125 19.953
49 HD3 LYS 302 HD3 LYS 302 19.142 -8.552 20.748
50 HE2 LYS 302 HE2 LYS 302 19.465 -6.149 21.374
51 HE3 LYS 302 HE3 LYS 302 17.879 -5.776 20.669
52 HZ1 LYS 302 HZ1 LYS 302 17.736 -6.102 23.062
53 HZ2 LYS 302 HZ2 LYS 302 18.351 -7.626 22.945
54 HZ3 LYS 302 HZ3 LYS 302 16.876 -7.280 22.292
55 H SEP 303 H SEP 303 15.785 -7.624 15.486
56 HA SEP 303 HA SEP 303 16.157 -5.621 13.628
57 HB2 SEP 303 HB2 SEP 303 14.871 -7.934 13.612
58 HB3 SEP 303 HB3 SEP 303 13.449 -6.905 13.880
59 H GLY 304 H GLY 304 14.798 -3.918 12.796
60 HA2 GLY 304 HA2 GLY 304 13.279 -2.137 12.990
61 HA3 GLY 304 HA3 GLY 304 12.748 -2.757 14.570
62 H LYS 305 H LYS 305 14.690 -2.787 16.236
63 HA LYS 305 HA LYS 305 15.551 -0.029 16.571
64 HB2 LYS 305 HB2 LYS 305 15.217 -1.568 18.501
65 HB3 LYS 305 HB3 LYS 305 16.522 -2.593 17.910
66 HG2 LYS 305 HG2 LYS 305 17.349 -1.239 19.748
67 HG3 LYS 305 HG3 LYS 305 18.152 -0.761 18.250
68 HD2 LYS 305 HD2 LYS 305 17.651 1.241 19.473
69 HD3 LYS 305 HD3 LYS 305 16.563 1.197 18.079
70 HE2 LYS 305 HE2 LYS 305 14.737 0.348 19.535
71 HE3 LYS 305 HE3 LYS 305 15.842 0.369 20.927
72 HZ1 LYS 305 HZ1 LYS 305 16.052 2.766 20.645
73 HZ2 LYS 305 HZ2 LYS 305 14.468 2.358 20.853
74 HZ3 LYS 305 HZ3 LYS 305 15.029 2.749 19.351
75 H TYR 306 H TYR 306 17.087 -3.106 15.568
76 HA TYR 306 HA TYR 306 19.595 -1.890 14.823
77 HB2 TYR 306 HB2 TYR 306 19.575 -4.268 15.094
78 HB3 TYR 306 HB3 TYR 306 18.185 -4.451 14.011
79 HD1 TYR 306 HD1 TYR 306 21.759 -3.219 13.983
80 HD2 TYR 306 HD2 TYR 306 18.517 -4.964 11.737
81 HE1 TYR 306 HE1 TYR 306 23.254 -3.475 11.998
82 HE2 TYR 306 HE2 TYR 306 20.013 -5.177 9.758
83 HH TYR 306 HH TYR 306 22.047 -4.599 8.855
84 H LYS 307 H LYS 307 16.569 -2.640 13.003
85 HA LYS 307 HA LYS 307 17.637 -1.994 10.498
86 HB2 LYS 307 HB2 LYS 307 14.808 -1.875 11.486
87 HB3 LYS 307 HB3 LYS 307 15.240 -1.465 9.834
88 HG2 LYS 307 HG2 LYS 307 15.763 -4.150 11.174
89 HG3 LYS 307 HG3 LYS 307 14.468 -3.807 10.022
90 HD2 LYS 307 HD2 LYS 307 17.464 -3.673 9.408
91 HD3 LYS 307 HD3 LYS 307 16.387 -4.992 8.964
92 HE2 LYS 307 HE2 LYS 307 15.081 -3.496 7.519
93 HE3 LYS 307 HE3 LYS 307 16.098 -2.118 8.002
94 HZ1 LYS 307 HZ1 LYS 307 16.822 -3.035 5.910
95 HZ2 LYS 307 HZ2 LYS 307 17.082 -4.518 6.594
96 HZ3 LYS 307 HZ3 LYS 307 17.997 -3.212 7.050
97 H LYS 308 H LYS 308 16.201 0.245 12.895
98 HA LYS 308 HA LYS 308 16.245 2.446 11.058
99 HB2 LYS 308 HB2 LYS 308 15.204 2.093 13.552
100 HB3 LYS 308 HB3 LYS 308 16.624 3.096 13.909
101 HG2 LYS 308 HG2 LYS 308 15.752 4.478 11.822
102 HG3 LYS 308 HG3 LYS 308 14.205 3.722 12.236
103 HD2 LYS 308 HD2 LYS 308 14.407 4.620 14.522
104 HD3 LYS 308 HD3 LYS 308 15.962 5.364 14.075
105 HE2 LYS 308 HE2 LYS 308 14.736 6.562 12.197
106 HE3 LYS 308 HE3 LYS 308 13.216 5.997 12.915
107 HZ1 LYS 308 HZ1 LYS 308 13.802 8.232 13.623
108 HZ2 LYS 308 HZ2 LYS 308 15.240 7.725 14.228
109 HZ3 LYS 308 HZ3 LYS 308 13.824 7.221 14.932
110 H VAL 309 H VAL 309 18.837 0.891 12.824
111 HA VAL 309 HA VAL 309 20.512 3.176 13.100
112 HB VAL 309 HB VAL 309 20.733 0.611 13.974
113 HG11 VAL 309 HG11 VAL 309 22.641 -0.523 12.963
114 HG12 VAL 309 HG12 VAL 309 21.432 -0.244 11.700
115 HG13 VAL 309 HG13 VAL 309 22.876 0.794 11.795
116 HG21 VAL 309 HG21 VAL 309 22.981 1.203 14.760
117 HG22 VAL 309 HG22 VAL 309 23.050 2.544 13.589
118 HG23 VAL 309 HG23 VAL 309 21.860 2.571 14.917
119 H GLU 310 H GLU 310 19.671 1.194 10.349
120 HA GLU 310 HA GLU 310 21.915 1.790 8.696
121 HB2 GLU 310 HB2 GLU 310 19.025 1.168 7.980
122 HB3 GLU 310 HB3 GLU 310 20.392 1.089 6.857
123 HG2 GLU 310 HG2 GLU 310 21.407 -0.736 8.146
124 HG3 GLU 310 HG3 GLU 310 20.173 -0.589 9.403
125 H ILE 311 H ILE 311 18.666 3.366 8.895
126 HA ILE 311 HA ILE 311 19.540 5.481 7.089
127 HB ILE 311 HB ILE 311 17.166 4.627 7.202
128 HG12 ILE 311 HG12 ILE 311 17.421 7.609 7.684
129 HG13 ILE 311 HG13 ILE 311 17.849 6.818 6.187
130 HG21 ILE 311 HG21 ILE 311 15.656 5.427 8.892
131 HG22 ILE 311 HG22 ILE 311 16.972 4.546 9.681
132 HG23 ILE 311 HG23 ILE 311 16.952 6.324 9.703
133 HD11 ILE 311 HD11 ILE 311 15.455 6.016 5.968
134 HD12 ILE 311 HD12 ILE 311 15.053 6.959 7.425
135 HD13 ILE 311 HD13 ILE 311 15.609 7.785 5.964
136 H LYS 312 H LYS 312 19.711 4.892 10.513
137 HA LYS 312 HA LYS 312 19.980 7.640 11.361
138 HB2 LYS 312 HB2 LYS 312 19.525 5.916 12.987
139 HB3 LYS 312 HB3 LYS 312 20.982 5.045 12.527
140 HG2 LYS 312 HG2 LYS 312 21.449 7.805 13.487
141 HG3 LYS 312 HG3 LYS 312 20.823 6.658 14.691
142 HD2 LYS 312 HD2 LYS 312 22.626 5.068 14.153
143 HD3 LYS 312 HD3 LYS 312 23.248 6.167 12.919
144 HE2 LYS 312 HE2 LYS 312 23.710 7.861 14.641
145 HE3 LYS 312 HE3 LYS 312 23.136 6.724 15.892
146 HZ1 LYS 312 HZ1 LYS 312 24.855 5.166 15.104
147 HZ2 LYS 312 HZ2 LYS 312 25.537 6.576 15.629
148 HZ3 LYS 312 HZ3 LYS 312 25.398 6.265 14.011
149 H GLU 313 H GLU 313 22.313 5.174 10.235
150 HA GLU 313 HA GLU 313 24.570 6.953 10.598
151 HB2 GLU 313 HB2 GLU 313 24.126 4.238 9.933
152 HB3 GLU 313 HB3 GLU 313 25.017 4.936 8.575
153 HG2 GLU 313 HG2 GLU 313 26.541 3.992 10.270
154 HG3 GLU 313 HG3 GLU 313 26.754 5.743 10.100
155 H LEU 314 H LEU 314 22.165 6.480 8.106
156 HA LEU 314 HA LEU 314 23.620 7.965 6.064
157 HB2 LEU 314 HB2 LEU 314 21.302 6.362 6.201
158 HB3 LEU 314 HB3 LEU 314 20.720 7.966 5.781
159 HG LEU 314 HG LEU 314 21.072 6.545 3.819
160 HD11 LEU 314 HD11 LEU 314 22.332 8.093 2.439
161 HD12 LEU 314 HD12 LEU 314 23.070 8.829 3.881
162 HD13 LEU 314 HD13 LEU 314 21.323 8.988 3.594
163 HD21 LEU 314 HD21 LEU 314 23.244 5.802 3.087
164 HD22 LEU 314 HD22 LEU 314 22.960 5.196 4.732
165 HD23 LEU 314 HD23 LEU 314 24.039 6.586 4.468
166 H GLY 315 H GLY 315 22.193 8.857 8.965
167 HA2 GLY 315 HA2 GLY 315 22.360 11.089 9.709
168 HA3 GLY 315 HA3 GLY 315 22.217 11.657 8.053
169 H GLU 316 H GLU 316 19.780 9.414 9.463
170 HA GLU 316 HA GLU 316 17.648 11.213 8.858
171 HB2 GLU 316 HB2 GLU 316 16.213 9.799 10.137
172 HB3 GLU 316 HB3 GLU 316 17.366 8.794 9.294
173 HG2 GLU 316 HG2 GLU 316 17.830 7.752 11.190
174 HG3 GLU 316 HG3 GLU 316 18.590 9.226 11.779
175 H LEU 317 H LEU 317 19.881 11.215 11.478
176 HA LEU 317 HA LEU 317 18.324 12.677 13.407
177 HB2 LEU 317 HB2 LEU 317 21.342 12.617 12.983
178 HB3 LEU 317 HB3 LEU 317 20.502 13.116 14.453
179 HG LEU 317 HG LEU 317 20.426 10.301 13.333
180 HD11 LEU 317 HD11 LEU 317 22.150 9.895 15.015
181 HD12 LEU 317 HD12 LEU 317 22.108 11.618 15.481
182 HD13 LEU 317 HD13 LEU 317 22.664 11.149 13.858
183 HD21 LEU 317 HD21 LEU 317 18.549 10.720 14.785
184 HD22 LEU 317 HD22 LEU 317 19.580 11.593 15.948
185 HD23 LEU 317 HD23 LEU 317 19.760 9.831 15.728
186 H ARG 318 H ARG 318 19.974 13.506 10.472
187 HA ARG 318 HA ARG 318 19.842 16.448 11.012
188 HB2 ARG 318 HB2 ARG 318 20.894 14.929 8.602
189 HB3 ARG 318 HB3 ARG 318 21.135 16.639 8.947
190 HG2 ARG 318 HG2 ARG 318 22.632 16.098 10.779
191 HG3 ARG 318 HG3 ARG 318 22.287 14.360 10.587
192 HD2 ARG 318 HD2 ARG 318 23.104 14.491 8.234
193 HD3 ARG 318 HD3 ARG 318 23.560 16.177 8.503
194 HE ARG 318 HE ARG 318 24.916 13.764 9.483
195 HH11 ARG 318 HH11 ARG 318 24.696 17.274 9.743
196 HH12 ARG 318 HH12 ARG 318 26.282 17.417 10.456
197 HH21 ARG 318 HH21 ARG 318 26.929 14.016 10.379
198 HH22 ARG 318 HH22 ARG 318 27.524 15.597 10.807
199 H LYS 319 H LYS 319 18.021 13.953 9.927
200 HA LYS 319 HA LYS 319 16.046 13.736 8.862
201 HB2 LYS 319 HB2 LYS 319 16.256 16.572 7.818
202 HB3 LYS 319 HB3 LYS 319 14.853 15.512 7.733
203 HG2 LYS 319 HG2 LYS 319 14.723 15.474 10.193
204 HG3 LYS 319 HG3 LYS 319 16.108 16.583 10.275
205 HD2 LYS 319 HD2 LYS 319 14.821 18.222 8.893
206 HD3 LYS 319 HD3 LYS 319 13.412 17.144 8.997
207 HE2 LYS 319 HE2 LYS 319 14.878 18.433 11.333
208 HE3 LYS 319 HE3 LYS 319 13.294 18.925 10.693
209 HZ1 LYS 319 HZ1 LYS 319 13.920 16.287 11.894
210 HZ2 LYS 319 HZ2 LYS 319 12.448 16.735 11.301
211 HZ3 LYS 319 HZ3 LYS 319 13.066 17.494 12.630
212 H GLU 320 H GLU 320 18.953 13.700 7.584
213 HA GLU 320 HA GLU 320 18.301 13.683 4.743
214 HB2 GLU 320 HB2 GLU 320 20.673 13.099 6.434
215 HB3 GLU 320 HB3 GLU 320 20.524 12.114 4.977
216 HG2 GLU 320 HG2 GLU 320 21.810 13.896 4.249
217 HG3 GLU 320 HG3 GLU 320 20.181 14.330 3.713
218 HA PRO 321 HA PRO 321 16.638 9.572 5.391
219 HB2 PRO 321 HB2 PRO 321 15.146 9.267 3.185
220 HB3 PRO 321 HB3 PRO 321 14.717 10.509 4.406
221 HG2 PRO 321 HG2 PRO 321 16.217 10.833 1.807
222 HG3 PRO 321 HG3 PRO 321 14.858 11.806 2.448
223 HD2 PRO 321 HD2 PRO 321 17.545 12.483 2.694
224 HD3 PRO 321 HD3 PRO 321 16.254 13.045 3.808
225 H SER 322 H SER 322 16.770 7.387 4.443
226 HA SER 322 HA SER 322 19.045 7.093 2.527
227 HB2 SER 322 HB2 SER 322 19.059 4.759 3.222
228 HB3 SER 322 HB3 SER 322 19.068 5.798 4.661
229 HG SER 322 HG SER 322 16.899 4.365 3.527
230 H LEU 323 H LEU 323 16.071 7.852 1.925
231 HA LEU 323 HA LEU 323 15.716 6.109 -0.385
232 HB2 LEU 323 HB2 LEU 323 13.476 5.343 0.284
233 HB3 LEU 323 HB3 LEU 323 14.703 4.724 1.395
234 HG LEU 323 HG LEU 323 13.791 7.091 2.596
235 HD11 LEU 323 HD11 LEU 323 11.924 7.121 1.039
236 HD12 LEU 323 HD12 LEU 323 11.339 6.645 2.651
237 HD13 LEU 323 HD13 LEU 323 11.572 5.415 1.377
238 HD21 LEU 323 HD21 LEU 323 13.058 4.171 3.005
239 HD22 LEU 323 HD22 LEU 323 12.935 5.465 4.226
240 HD23 LEU 323 HD23 LEU 323 14.527 4.967 3.604
Start of MODEL 2
1 H1 THR 298 H1 THR 298 17.196 -16.272 12.196
2 H2 THR 298 H2 THR 298 16.058 -15.317 12.913
3 H3 THR 298 H3 THR 298 17.435 -15.715 13.730
4 HA THR 298 HA THR 298 15.358 -17.622 12.877
5 HB THR 298 HB THR 298 16.643 -19.164 14.477
6 HG1 THR 298 HG1 THR 298 18.829 -18.533 14.829
7 HG21 THR 298 HG21 THR 298 18.315 -19.799 12.848
8 HG22 THR 298 HG22 THR 298 18.241 -18.204 12.069
9 HG23 THR 298 HG23 THR 298 16.844 -19.313 11.982
10 H ASN 299 H ASN 299 16.640 -17.885 16.089
11 HA ASN 299 HA ASN 299 14.023 -17.362 17.194
12 HB2 ASN 299 HB2 ASN 299 16.689 -17.692 18.634
13 HB3 ASN 299 HB3 ASN 299 15.077 -17.872 19.340
14 HD21 ASN 299 HD21 ASN 299 14.321 -19.898 19.473
15 HD22 ASN 299 HD22 ASN 299 14.886 -21.244 18.513
16 H ARG 300 H ARG 300 16.546 -15.284 16.337
17 HA ARG 300 HA ARG 300 15.255 -13.046 17.815
18 HB2 ARG 300 HB2 ARG 300 18.222 -13.738 17.747
19 HB3 ARG 300 HB3 ARG 300 17.680 -12.063 17.859
20 HG2 ARG 300 HG2 ARG 300 18.001 -12.553 20.090
21 HG3 ARG 300 HG3 ARG 300 16.274 -12.892 19.917
22 HD2 ARG 300 HD2 ARG 300 16.821 -15.325 19.664
23 HD3 ARG 300 HD3 ARG 300 18.530 -14.944 19.880
24 HE ARG 300 HE ARG 300 18.186 -14.614 22.163
25 HH11 ARG 300 HH11 ARG 300 15.019 -15.089 20.616
26 HH12 ARG 300 HH12 ARG 300 14.229 -15.326 22.156
27 HH21 ARG 300 HH21 ARG 300 17.081 -14.930 24.059
28 HH22 ARG 300 HH22 ARG 300 15.365 -15.225 24.053
29 H ARG 301 H ARG 301 15.102 -11.236 16.457
30 HA ARG 301 HA ARG 301 15.544 -11.841 13.603
31 HB2 ARG 301 HB2 ARG 301 13.503 -10.675 15.013
32 HB3 ARG 301 HB3 ARG 301 14.305 -9.266 14.318
33 HG2 ARG 301 HG2 ARG 301 13.941 -10.052 12.076
34 HG3 ARG 301 HG3 ARG 301 13.524 -11.683 12.648
35 HD2 ARG 301 HD2 ARG 301 11.554 -10.661 13.851
36 HD3 ARG 301 HD3 ARG 301 11.899 -9.151 13.009
37 HE ARG 301 HE ARG 301 11.176 -11.720 11.658
38 HH11 ARG 301 HH11 ARG 301 11.046 -8.167 11.685
39 HH12 ARG 301 HH12 ARG 301 10.001 -8.142 10.285
40 HH21 ARG 301 HH21 ARG 301 9.886 -11.554 9.867
41 HH22 ARG 301 HH22 ARG 301 9.399 -9.993 9.269
42 H LYS 302 H LYS 302 16.974 -9.820 16.033
43 HA LYS 302 HA LYS 302 18.635 -8.240 16.025
44 HB2 LYS 302 HB2 LYS 302 19.357 -9.266 13.263
45 HB3 LYS 302 HB3 LYS 302 20.372 -8.313 14.344
46 HG2 LYS 302 HG2 LYS 302 20.210 -10.293 15.974
47 HG3 LYS 302 HG3 LYS 302 19.590 -11.213 14.584
48 HD2 LYS 302 HD2 LYS 302 22.238 -9.689 14.697
49 HD3 LYS 302 HD3 LYS 302 22.067 -11.447 14.824
50 HE2 LYS 302 HE2 LYS 302 21.151 -11.524 12.508
51 HE3 LYS 302 HE3 LYS 302 21.288 -9.759 12.390
52 HZ1 LYS 302 HZ1 LYS 302 23.158 -10.845 11.341
53 HZ2 LYS 302 HZ2 LYS 302 23.572 -11.611 12.744
54 HZ3 LYS 302 HZ3 LYS 302 23.678 -9.968 12.636
55 H SEP 303 H SEP 303 16.114 -7.324 15.173
56 HA SEP 303 HA SEP 303 16.674 -5.424 12.922
57 HB2 SEP 303 HB2 SEP 303 15.628 -7.453 12.081
58 HB3 SEP 303 HB3 SEP 303 14.353 -7.344 13.313
59 H GLY 304 H GLY 304 14.724 -3.870 12.619
60 HA2 GLY 304 HA2 GLY 304 13.033 -2.488 13.435
61 HA3 GLY 304 HA3 GLY 304 13.136 -3.281 15.019
62 H LYS 305 H LYS 305 14.949 -2.735 16.415
63 HA LYS 305 HA LYS 305 15.498 0.104 16.521
64 HB2 LYS 305 HB2 LYS 305 15.610 -1.425 18.509
65 HB3 LYS 305 HB3 LYS 305 17.013 -2.227 17.790
66 HG2 LYS 305 HG2 LYS 305 18.271 -0.087 17.888
67 HG3 LYS 305 HG3 LYS 305 16.874 0.682 18.663
68 HD2 LYS 305 HD2 LYS 305 17.051 -0.885 20.556
69 HD3 LYS 305 HD3 LYS 305 18.398 -1.717 19.755
70 HE2 LYS 305 HE2 LYS 305 19.305 -0.220 21.431
71 HE3 LYS 305 HE3 LYS 305 19.719 0.398 19.821
72 HZ1 LYS 305 HZ1 LYS 305 17.895 1.981 20.030
73 HZ2 LYS 305 HZ2 LYS 305 18.954 2.161 21.283
74 HZ3 LYS 305 HZ3 LYS 305 17.508 1.403 21.527
75 H TYR 306 H TYR 306 17.151 -2.772 15.313
76 HA TYR 306 HA TYR 306 19.533 -1.393 14.475
77 HB2 TYR 306 HB2 TYR 306 18.362 -4.061 13.636
78 HB3 TYR 306 HB3 TYR 306 19.996 -3.495 13.257
79 HD1 TYR 306 HD1 TYR 306 21.709 -3.291 15.053
80 HD2 TYR 306 HD2 TYR 306 17.776 -4.820 15.909
81 HE1 TYR 306 HE1 TYR 306 22.514 -4.166 17.252
82 HE2 TYR 306 HE2 TYR 306 18.586 -5.674 18.103
83 HH TYR 306 HH TYR 306 20.358 -5.857 19.540
84 H LYS 307 H LYS 307 16.413 -2.165 12.915
85 HA LYS 307 HA LYS 307 17.241 -1.596 10.266
86 HB2 LYS 307 HB2 LYS 307 14.544 -1.418 11.597
87 HB3 LYS 307 HB3 LYS 307 14.782 -0.991 9.902
88 HG2 LYS 307 HG2 LYS 307 15.563 -3.683 11.047
89 HG3 LYS 307 HG3 LYS 307 13.978 -3.337 10.341
90 HD2 LYS 307 HD2 LYS 307 15.056 -2.746 8.189
91 HD3 LYS 307 HD3 LYS 307 16.647 -3.082 8.896
92 HE2 LYS 307 HE2 LYS 307 16.012 -5.013 7.637
93 HE3 LYS 307 HE3 LYS 307 15.901 -5.428 9.358
94 HZ1 LYS 307 HZ1 LYS 307 13.977 -6.245 8.235
95 HZ2 LYS 307 HZ2 LYS 307 13.633 -4.769 7.575
96 HZ3 LYS 307 HZ3 LYS 307 13.486 -5.011 9.204
97 H LYS 308 H LYS 308 16.028 0.525 12.872
98 HA LYS 308 HA LYS 308 16.189 2.857 11.116
99 HB2 LYS 308 HB2 LYS 308 15.855 2.595 14.123
100 HB3 LYS 308 HB3 LYS 308 15.963 4.145 13.289
101 HG2 LYS 308 HG2 LYS 308 13.786 2.045 12.961
102 HG3 LYS 308 HG3 LYS 308 13.634 3.641 13.697
103 HD2 LYS 308 HD2 LYS 308 14.060 3.000 10.737
104 HD3 LYS 308 HD3 LYS 308 12.618 3.689 11.479
105 HE2 LYS 308 HE2 LYS 308 15.338 5.064 11.241
106 HE3 LYS 308 HE3 LYS 308 13.919 5.390 10.243
107 HZ1 LYS 308 HZ1 LYS 308 14.203 7.019 11.969
108 HZ2 LYS 308 HZ2 LYS 308 14.095 5.869 13.147
109 HZ3 LYS 308 HZ3 LYS 308 12.787 6.199 12.195
110 H VAL 309 H VAL 309 18.490 1.112 13.067
111 HA VAL 309 HA VAL 309 20.286 3.322 13.441
112 HB VAL 309 HB VAL 309 20.235 0.613 14.236
113 HG11 VAL 309 HG11 VAL 309 22.488 -0.244 13.726
114 HG12 VAL 309 HG12 VAL 309 21.554 -0.039 12.234
115 HG13 VAL 309 HG13 VAL 309 22.805 1.151 12.671
116 HG21 VAL 309 HG21 VAL 309 20.900 2.577 15.576
117 HG22 VAL 309 HG22 VAL 309 22.090 1.261 15.682
118 HG23 VAL 309 HG23 VAL 309 22.422 2.676 14.653
119 H GLU 310 H GLU 310 19.588 1.116 10.780
120 HA GLU 310 HA GLU 310 21.909 1.657 9.209
121 HB2 GLU 310 HB2 GLU 310 19.064 0.919 8.432
122 HB3 GLU 310 HB3 GLU 310 20.425 0.911 7.310
123 HG2 GLU 310 HG2 GLU 310 21.327 -1.024 8.180
124 HG3 GLU 310 HG3 GLU 310 20.781 -0.680 9.821
125 H ILE 311 H ILE 311 18.665 3.219 9.285
126 HA ILE 311 HA ILE 311 19.398 5.162 7.265
127 HB ILE 311 HB ILE 311 17.088 5.402 9.258
128 HG12 ILE 311 HG12 ILE 311 17.205 3.930 6.586
129 HG13 ILE 311 HG13 ILE 311 17.032 3.176 8.170
130 HG21 ILE 311 HG21 ILE 311 17.697 7.420 7.772
131 HG22 ILE 311 HG22 ILE 311 17.324 6.413 6.363
132 HG23 ILE 311 HG23 ILE 311 16.053 6.815 7.543
133 HD11 ILE 311 HD11 ILE 311 14.827 4.415 8.427
134 HD12 ILE 311 HD12 ILE 311 14.982 4.882 6.716
135 HD13 ILE 311 HD13 ILE 311 14.870 3.168 7.164
136 H LYS 312 H LYS 312 19.549 5.015 10.794
137 HA LYS 312 HA LYS 312 20.069 7.775 11.314
138 HB2 LYS 312 HB2 LYS 312 19.591 6.383 13.161
139 HB3 LYS 312 HB3 LYS 312 20.778 5.188 12.677
140 HG2 LYS 312 HG2 LYS 312 21.961 7.802 13.316
141 HG3 LYS 312 HG3 LYS 312 21.130 7.021 14.669
142 HD2 LYS 312 HD2 LYS 312 22.430 4.958 14.290
143 HD3 LYS 312 HD3 LYS 312 23.258 5.722 12.925
144 HE2 LYS 312 HE2 LYS 312 24.175 7.436 14.441
145 HE3 LYS 312 HE3 LYS 312 23.385 6.632 15.818
146 HZ1 LYS 312 HZ1 LYS 312 24.691 4.642 15.266
147 HZ2 LYS 312 HZ2 LYS 312 25.688 5.924 15.573
148 HZ3 LYS 312 HZ3 LYS 312 25.422 5.430 14.019
149 H GLU 313 H GLU 313 22.228 5.069 10.385
150 HA GLU 313 HA GLU 313 24.618 6.702 10.489
151 HB2 GLU 313 HB2 GLU 313 23.970 3.976 10.132
152 HB3 GLU 313 HB3 GLU 313 24.807 4.465 8.655
153 HG2 GLU 313 HG2 GLU 313 26.437 3.637 10.236
154 HG3 GLU 313 HG3 GLU 313 26.655 5.386 10.049
155 H LEU 314 H LEU 314 22.135 6.072 8.095
156 HA LEU 314 HA LEU 314 23.591 7.172 5.840
157 HB2 LEU 314 HB2 LEU 314 21.527 5.564 5.945
158 HB3 LEU 314 HB3 LEU 314 20.590 7.043 6.102
159 HG LEU 314 HG LEU 314 21.534 7.803 3.893
160 HD11 LEU 314 HD11 LEU 314 23.563 6.433 3.786
161 HD12 LEU 314 HD12 LEU 314 22.506 6.052 2.416
162 HD13 LEU 314 HD13 LEU 314 22.589 4.943 3.806
163 HD21 LEU 314 HD21 LEU 314 20.022 5.164 3.941
164 HD22 LEU 314 HD22 LEU 314 20.073 6.317 2.586
165 HD23 LEU 314 HD23 LEU 314 19.316 6.791 4.118
166 H GLY 315 H GLY 315 22.656 8.642 8.605
167 HA2 GLY 315 HA2 GLY 315 22.981 10.956 8.907
168 HA3 GLY 315 HA3 GLY 315 22.548 11.249 7.232
169 H GLU 316 H GLU 316 20.307 9.276 9.094
170 HA GLU 316 HA GLU 316 18.160 11.152 8.872
171 HB2 GLU 316 HB2 GLU 316 18.030 8.667 9.458
172 HB3 GLU 316 HB3 GLU 316 18.506 9.113 11.097
173 HG2 GLU 316 HG2 GLU 316 16.486 10.574 11.238
174 HG3 GLU 316 HG3 GLU 316 16.006 10.020 9.627
175 H LEU 317 H LEU 317 20.839 10.901 11.066
176 HA LEU 317 HA LEU 317 19.886 12.469 13.256
177 HB2 LEU 317 HB2 LEU 317 22.695 12.184 12.135
178 HB3 LEU 317 HB3 LEU 317 22.286 12.816 13.729
179 HG LEU 317 HG LEU 317 21.679 9.988 12.866
180 HD11 LEU 317 HD11 LEU 317 24.046 10.601 12.656
181 HD12 LEU 317 HD12 LEU 317 23.787 9.482 14.013
182 HD13 LEU 317 HD13 LEU 317 24.037 11.218 14.327
183 HD21 LEU 317 HD21 LEU 317 20.363 10.704 14.769
184 HD22 LEU 317 HD22 LEU 317 21.778 11.485 15.510
185 HD23 LEU 317 HD23 LEU 317 21.697 9.708 15.383
186 H ARG 318 H ARG 318 20.716 13.399 10.019
187 HA ARG 318 HA ARG 318 21.036 16.271 10.846
188 HB2 ARG 318 HB2 ARG 318 21.586 14.914 8.172
189 HB3 ARG 318 HB3 ARG 318 21.834 16.618 8.533
190 HG2 ARG 318 HG2 ARG 318 23.966 15.928 8.775
191 HG3 ARG 318 HG3 ARG 318 23.430 15.599 10.433
192 HD2 ARG 318 HD2 ARG 318 23.126 13.255 9.938
193 HD3 ARG 318 HD3 ARG 318 23.292 13.544 8.201
194 HE ARG 318 HE ARG 318 25.588 13.554 8.386
195 HH11 ARG 318 HH11 ARG 318 24.253 13.639 11.657
196 HH12 ARG 318 HH12 ARG 318 25.793 13.282 12.390
197 HH21 ARG 318 HH21 ARG 318 27.508 13.109 9.391
198 HH22 ARG 318 HH22 ARG 318 27.606 13.005 11.128
199 H LYS 319 H LYS 319 18.678 14.225 10.310
200 HA LYS 319 HA LYS 319 16.486 14.379 9.768
201 HB2 LYS 319 HB2 LYS 319 16.932 17.160 8.649
202 HB3 LYS 319 HB3 LYS 319 15.391 16.389 9.001
203 HG2 LYS 319 HG2 LYS 319 15.923 16.370 11.394
204 HG3 LYS 319 HG3 LYS 319 17.483 17.152 11.057
205 HD2 LYS 319 HD2 LYS 319 16.304 19.064 10.023
206 HD3 LYS 319 HD3 LYS 319 14.746 18.305 10.400
207 HE2 LYS 319 HE2 LYS 319 16.851 19.117 12.440
208 HE3 LYS 319 HE3 LYS 319 15.388 20.047 12.050
209 HZ1 LYS 319 HZ1 LYS 319 14.067 18.157 12.785
210 HZ2 LYS 319 HZ2 LYS 319 15.062 18.663 14.002
211 HZ3 LYS 319 HZ3 LYS 319 15.426 17.296 13.151
212 H GLU 320 H GLU 320 18.927 14.005 7.745
213 HA GLU 320 HA GLU 320 17.463 14.236 5.220
214 HB2 GLU 320 HB2 GLU 320 20.159 12.977 5.829
215 HB3 GLU 320 HB3 GLU 320 19.499 13.318 4.224
216 HG2 GLU 320 HG2 GLU 320 20.297 15.340 6.351
217 HG3 GLU 320 HG3 GLU 320 21.137 15.012 4.830
218 HA PRO 321 HA PRO 321 16.143 10.016 6.085
219 HB2 PRO 321 HB2 PRO 321 13.962 9.849 4.528
220 HB3 PRO 321 HB3 PRO 321 13.974 10.960 5.938
221 HG2 PRO 321 HG2 PRO 321 14.477 11.566 3.026
222 HG3 PRO 321 HG3 PRO 321 13.392 12.408 4.177
223 HD2 PRO 321 HD2 PRO 321 15.971 13.235 3.575
224 HD3 PRO 321 HD3 PRO 321 15.142 13.589 5.128
225 H SER 322 H SER 322 15.701 8.000 4.729
226 HA SER 322 HA SER 322 17.498 7.798 2.438
227 HB2 SER 322 HB2 SER 322 16.417 5.511 2.255
228 HB3 SER 322 HB3 SER 322 17.132 5.833 3.852
229 HG SER 322 HG SER 322 14.404 6.332 3.239
230 H LEU 323 H LEU 323 16.872 7.965 0.268
231 HA LEU 323 HA LEU 323 13.988 8.313 -0.354
232 HB2 LEU 323 HB2 LEU 323 15.129 10.542 0.115
233 HB3 LEU 323 HB3 LEU 323 16.184 10.217 -1.259
234 HG LEU 323 HG LEU 323 13.218 10.239 -1.692
235 HD11 LEU 323 HD11 LEU 323 13.307 12.679 -1.820
236 HD12 LEU 323 HD12 LEU 323 15.034 12.657 -1.377
237 HD13 LEU 323 HD13 LEU 323 13.812 12.128 -0.203
238 HD21 LEU 323 HD21 LEU 323 14.626 9.687 -3.582
239 HD22 LEU 323 HD22 LEU 323 15.702 11.057 -3.242
240 HD23 LEU 323 HD23 LEU 323 14.037 11.346 -3.815
Start of MODEL 3
1 H1 THR 298 H1 THR 298 13.199 -13.899 9.657
2 H2 THR 298 H2 THR 298 14.450 -13.206 10.478
3 H3 THR 298 H3 THR 298 14.758 -14.251 9.240
4 HA THR 298 HA THR 298 13.750 -16.074 10.478
5 HB THR 298 HB THR 298 15.766 -14.906 12.370
6 HG1 THR 298 HG1 THR 298 17.380 -15.124 10.747
7 HG21 THR 298 HG21 THR 298 15.627 -17.499 10.751
8 HG22 THR 298 HG22 THR 298 15.223 -17.321 12.479
9 HG23 THR 298 HG23 THR 298 16.891 -17.089 11.929
10 H ASN 299 H ASN 299 13.368 -16.748 12.934
11 HA ASN 299 HA ASN 299 11.320 -14.996 13.968
12 HB2 ASN 299 HB2 ASN 299 11.096 -16.585 15.776
13 HB3 ASN 299 HB3 ASN 299 11.281 -17.475 14.260
14 HD21 ASN 299 HD21 ASN 299 11.871 -18.084 17.176
15 HD22 ASN 299 HD22 ASN 299 13.510 -18.687 17.145
16 H ARG 300 H ARG 300 14.692 -15.542 14.659
17 HA ARG 300 HA ARG 300 14.728 -13.507 16.813
18 HB2 ARG 300 HB2 ARG 300 16.250 -15.575 16.739
19 HB3 ARG 300 HB3 ARG 300 17.079 -14.822 15.379
20 HG2 ARG 300 HG2 ARG 300 18.413 -14.317 17.275
21 HG3 ARG 300 HG3 ARG 300 17.528 -12.822 16.929
22 HD2 ARG 300 HD2 ARG 300 17.468 -13.166 19.319
23 HD3 ARG 300 HD3 ARG 300 15.846 -13.478 18.692
24 HE ARG 300 HE ARG 300 16.067 -15.764 19.184
25 HH11 ARG 300 HH11 ARG 300 19.088 -14.099 19.977
26 HH12 ARG 300 HH12 ARG 300 19.681 -15.444 20.913
27 HH21 ARG 300 HH21 ARG 300 16.904 -17.428 20.396
28 HH22 ARG 300 HH22 ARG 300 18.471 -17.284 21.142
29 H ARG 301 H ARG 301 13.652 -11.969 15.463
30 HA ARG 301 HA ARG 301 14.414 -11.214 12.855
31 HB2 ARG 301 HB2 ARG 301 12.879 -9.966 15.124
32 HB3 ARG 301 HB3 ARG 301 13.212 -9.003 13.693
33 HG2 ARG 301 HG2 ARG 301 11.814 -11.693 13.526
34 HG3 ARG 301 HG3 ARG 301 10.962 -10.152 13.764
35 HD2 ARG 301 HD2 ARG 301 12.225 -9.294 11.742
36 HD3 ARG 301 HD3 ARG 301 12.678 -10.966 11.411
37 HE ARG 301 HE ARG 301 9.907 -10.976 11.669
38 HH11 ARG 301 HH11 ARG 301 12.235 -9.299 9.581
39 HH12 ARG 301 HH12 ARG 301 11.073 -9.156 8.280
40 HH21 ARG 301 HH21 ARG 301 8.499 -10.747 9.948
41 HH22 ARG 301 HH22 ARG 301 9.017 -9.962 8.481
42 H LYS 302 H LYS 302 15.379 -9.623 15.897
43 HA LYS 302 HA LYS 302 16.910 -7.984 16.396
44 HB2 LYS 302 HB2 LYS 302 18.102 -8.303 13.635
45 HB3 LYS 302 HB3 LYS 302 18.857 -7.571 15.039
46 HG2 LYS 302 HG2 LYS 302 19.037 -9.774 16.115
47 HG3 LYS 302 HG3 LYS 302 18.212 -10.519 14.720
48 HD2 LYS 302 HD2 LYS 302 19.974 -9.581 13.223
49 HD3 LYS 302 HD3 LYS 302 20.832 -8.973 14.650
50 HE2 LYS 302 HE2 LYS 302 21.096 -11.279 15.479
51 HE3 LYS 302 HE3 LYS 302 20.206 -11.890 14.061
52 HZ1 LYS 302 HZ1 LYS 302 22.760 -10.370 13.960
53 HZ2 LYS 302 HZ2 LYS 302 21.935 -10.930 12.649
54 HZ3 LYS 302 HZ3 LYS 302 22.610 -11.996 13.713
55 H SEP 303 H SEP 303 14.689 -7.688 13.978
56 HA SEP 303 HA SEP 303 15.504 -5.526 12.465
57 HB2 SEP 303 HB2 SEP 303 12.604 -6.254 13.039
58 HB3 SEP 303 HB3 SEP 303 13.254 -5.479 11.580
59 H GLY 304 H GLY 304 14.961 -3.287 12.355
60 HA2 GLY 304 HA2 GLY 304 13.758 -1.360 12.934
61 HA3 GLY 304 HA3 GLY 304 13.017 -2.224 14.296
62 H LYS 305 H LYS 305 14.889 -2.994 15.947
63 HA LYS 305 HA LYS 305 15.994 -0.579 17.081
64 HB2 LYS 305 HB2 LYS 305 15.594 -2.487 18.524
65 HB3 LYS 305 HB3 LYS 305 16.601 -3.530 17.519
66 HG2 LYS 305 HG2 LYS 305 17.791 -2.984 19.567
67 HG3 LYS 305 HG3 LYS 305 18.619 -2.257 18.186
68 HD2 LYS 305 HD2 LYS 305 17.531 -0.067 18.719
69 HD3 LYS 305 HD3 LYS 305 16.801 -0.815 20.158
70 HE2 LYS 305 HE2 LYS 305 19.057 -1.336 21.026
71 HE3 LYS 305 HE3 LYS 305 19.787 -0.640 19.565
72 HZ1 LYS 305 HZ1 LYS 305 19.800 0.931 21.395
73 HZ2 LYS 305 HZ2 LYS 305 18.158 0.857 21.538
74 HZ3 LYS 305 HZ3 LYS 305 18.841 1.498 20.179
75 H TYR 306 H TYR 306 17.331 -3.232 15.109
76 HA TYR 306 HA TYR 306 19.901 -1.857 14.797
77 HB2 TYR 306 HB2 TYR 306 19.915 -4.263 14.738
78 HB3 TYR 306 HB3 TYR 306 18.630 -4.300 13.525
79 HD1 TYR 306 HD1 TYR 306 22.093 -2.809 13.930
80 HD2 TYR 306 HD2 TYR 306 19.217 -4.675 11.311
81 HE1 TYR 306 HE1 TYR 306 23.746 -2.771 12.057
82 HE2 TYR 306 HE2 TYR 306 20.874 -4.619 9.464
83 HH TYR 306 HH TYR 306 22.853 -3.636 8.751
84 H LYS 307 H LYS 307 16.998 -2.502 12.761
85 HA LYS 307 HA LYS 307 18.088 -1.390 10.439
86 HB2 LYS 307 HB2 LYS 307 15.222 -1.740 11.220
87 HB3 LYS 307 HB3 LYS 307 15.737 -1.090 9.659
88 HG2 LYS 307 HG2 LYS 307 17.171 -3.111 9.350
89 HG3 LYS 307 HG3 LYS 307 16.441 -3.816 10.796
90 HD2 LYS 307 HD2 LYS 307 14.371 -4.080 9.762
91 HD3 LYS 307 HD3 LYS 307 14.706 -2.828 8.536
92 HE2 LYS 307 HE2 LYS 307 16.234 -4.223 7.366
93 HE3 LYS 307 HE3 LYS 307 16.341 -5.367 8.720
94 HZ1 LYS 307 HZ1 LYS 307 14.954 -6.223 6.966
95 HZ2 LYS 307 HZ2 LYS 307 13.925 -4.937 7.080
96 HZ3 LYS 307 HZ3 LYS 307 14.067 -6.002 8.341
97 H LYS 308 H LYS 308 16.444 0.402 13.072
98 HA LYS 308 HA LYS 308 16.312 2.791 11.430
99 HB2 LYS 308 HB2 LYS 308 14.875 2.481 13.431
100 HB3 LYS 308 HB3 LYS 308 16.310 2.620 14.463
101 HG2 LYS 308 HG2 LYS 308 16.359 4.882 14.281
102 HG3 LYS 308 HG3 LYS 308 16.106 4.822 12.535
103 HD2 LYS 308 HD2 LYS 308 13.667 4.475 12.935
104 HD3 LYS 308 HD3 LYS 308 13.966 4.788 14.666
105 HE2 LYS 308 HE2 LYS 308 14.980 6.973 14.094
106 HE3 LYS 308 HE3 LYS 308 14.761 6.643 12.375
107 HZ1 LYS 308 HZ1 LYS 308 12.378 6.712 12.717
108 HZ2 LYS 308 HZ2 LYS 308 13.088 8.122 13.191
109 HZ3 LYS 308 HZ3 LYS 308 12.576 7.035 14.323
110 H VAL 309 H VAL 309 18.893 1.283 13.345
111 HA VAL 309 HA VAL 309 20.504 3.684 13.487
112 HB VAL 309 HB VAL 309 21.160 0.729 13.738
113 HG11 VAL 309 HG11 VAL 309 23.137 3.054 13.789
114 HG12 VAL 309 HG12 VAL 309 23.482 1.413 14.385
115 HG13 VAL 309 HG13 VAL 309 23.142 1.672 12.668
116 HG21 VAL 309 HG21 VAL 309 20.045 1.857 15.598
117 HG22 VAL 309 HG22 VAL 309 21.720 1.436 16.025
118 HG23 VAL 309 HG23 VAL 309 21.308 3.119 15.584
119 H GLU 310 H GLU 310 20.160 1.023 11.121
120 HA GLU 310 HA GLU 310 22.250 1.834 9.388
121 HB2 GLU 310 HB2 GLU 310 19.529 0.669 8.661
122 HB3 GLU 310 HB3 GLU 310 20.931 0.735 7.593
123 HG2 GLU 310 HG2 GLU 310 22.173 -0.746 9.116
124 HG3 GLU 310 HG3 GLU 310 20.780 -0.802 10.208
125 H ILE 311 H ILE 311 18.786 2.807 9.458
126 HA ILE 311 HA ILE 311 19.029 4.719 7.333
127 HB ILE 311 HB ILE 311 17.001 4.600 9.629
128 HG12 ILE 311 HG12 ILE 311 16.726 3.580 6.773
129 HG13 ILE 311 HG13 ILE 311 17.214 2.550 8.115
130 HG21 ILE 311 HG21 ILE 311 16.865 6.063 6.932
131 HG22 ILE 311 HG22 ILE 311 15.517 5.927 8.084
132 HG23 ILE 311 HG23 ILE 311 16.970 6.830 8.531
133 HD11 ILE 311 HD11 ILE 311 15.037 3.087 9.268
134 HD12 ILE 311 HD12 ILE 311 14.530 3.944 7.788
135 HD13 ILE 311 HD13 ILE 311 14.867 2.201 7.736
136 H LYS 312 H LYS 312 19.522 4.977 10.856
137 HA LYS 312 HA LYS 312 19.538 7.822 10.961
138 HB2 LYS 312 HB2 LYS 312 19.431 6.169 12.922
139 HB3 LYS 312 HB3 LYS 312 21.182 6.020 12.752
140 HG2 LYS 312 HG2 LYS 312 20.941 7.637 14.416
141 HG3 LYS 312 HG3 LYS 312 21.195 8.607 12.955
142 HD2 LYS 312 HD2 LYS 312 18.460 8.304 12.935
143 HD3 LYS 312 HD3 LYS 312 18.787 8.328 14.672
144 HE2 LYS 312 HE2 LYS 312 19.661 10.423 12.646
145 HE3 LYS 312 HE3 LYS 312 18.319 10.583 13.791
146 HZ1 LYS 312 HZ1 LYS 312 20.279 11.669 14.612
147 HZ2 LYS 312 HZ2 LYS 312 21.170 10.286 14.503
148 HZ3 LYS 312 HZ3 LYS 312 19.929 10.385 15.587
149 H GLU 313 H GLU 313 22.163 5.445 10.657
150 HA GLU 313 HA GLU 313 24.205 7.478 10.324
151 HB2 GLU 313 HB2 GLU 313 24.142 4.508 9.726
152 HB3 GLU 313 HB3 GLU 313 25.594 5.523 9.607
153 HG2 GLU 313 HG2 GLU 313 25.363 6.135 12.000
154 HG3 GLU 313 HG3 GLU 313 23.920 5.121 12.127
155 H LEU 314 H LEU 314 21.993 5.838 8.128
156 HA LEU 314 HA LEU 314 23.334 6.703 5.699
157 HB2 LEU 314 HB2 LEU 314 21.763 4.720 6.019
158 HB3 LEU 314 HB3 LEU 314 20.442 5.871 5.997
159 HG LEU 314 HG LEU 314 20.981 6.430 3.650
160 HD11 LEU 314 HD11 LEU 314 23.390 6.041 3.599
161 HD12 LEU 314 HD12 LEU 314 22.601 4.989 2.410
162 HD13 LEU 314 HD13 LEU 314 23.152 4.314 3.964
163 HD21 LEU 314 HD21 LEU 314 20.749 3.443 4.181
164 HD22 LEU 314 HD22 LEU 314 20.250 4.298 2.700
165 HD23 LEU 314 HD23 LEU 314 19.407 4.610 4.229
166 H GLY 315 H GLY 315 22.575 8.734 7.808
167 HA2 GLY 315 HA2 GLY 315 22.470 11.031 7.276
168 HA3 GLY 315 HA3 GLY 315 21.568 10.667 5.824
169 H GLU 316 H GLU 316 19.980 9.145 8.522
170 HA GLU 316 HA GLU 316 17.916 11.186 8.506
171 HB2 GLU 316 HB2 GLU 316 17.761 8.734 9.379
172 HB3 GLU 316 HB3 GLU 316 18.402 9.403 10.878
173 HG2 GLU 316 HG2 GLU 316 16.245 11.075 10.003
174 HG3 GLU 316 HG3 GLU 316 15.707 9.392 9.939
175 H LEU 317 H LEU 317 21.044 10.901 9.962
176 HA LEU 317 HA LEU 317 20.802 12.764 12.135
177 HB2 LEU 317 HB2 LEU 317 23.071 12.030 10.248
178 HB3 LEU 317 HB3 LEU 317 23.275 13.203 11.553
179 HG LEU 317 HG LEU 317 22.248 10.504 12.288
180 HD11 LEU 317 HD11 LEU 317 25.132 11.171 11.606
181 HD12 LEU 317 HD12 LEU 317 24.056 10.155 10.624
182 HD13 LEU 317 HD13 LEU 317 24.525 9.627 12.258
183 HD21 LEU 317 HD21 LEU 317 23.716 11.034 14.245
184 HD22 LEU 317 HD22 LEU 317 22.501 12.305 13.947
185 HD23 LEU 317 HD23 LEU 317 24.178 12.556 13.438
186 H ARG 318 H ARG 318 21.202 13.151 8.638
187 HA ARG 318 HA ARG 318 21.414 16.092 8.770
188 HB2 ARG 318 HB2 ARG 318 22.612 14.414 7.156
189 HB3 ARG 318 HB3 ARG 318 21.049 14.281 6.353
190 HG2 ARG 318 HG2 ARG 318 21.159 16.824 6.067
191 HG3 ARG 318 HG3 ARG 318 22.860 16.679 6.549
192 HD2 ARG 318 HD2 ARG 318 23.162 14.983 4.718
193 HD3 ARG 318 HD3 ARG 318 21.487 15.282 4.222
194 HE ARG 318 HE ARG 318 22.969 17.735 4.322
195 HH11 ARG 318 HH11 ARG 318 22.479 14.879 2.274
196 HH12 ARG 318 HH12 ARG 318 22.985 15.734 0.841
197 HH21 ARG 318 HH21 ARG 318 23.578 18.737 2.432
198 HH22 ARG 318 HH22 ARG 318 23.571 17.863 0.925
199 H LYS 319 H LYS 319 19.045 13.806 9.027
200 HA LYS 319 HA LYS 319 16.821 13.617 8.700
201 HB2 LYS 319 HB2 LYS 319 16.878 16.639 8.440
202 HB3 LYS 319 HB3 LYS 319 15.411 15.663 8.560
203 HG2 LYS 319 HG2 LYS 319 17.592 15.701 10.674
204 HG3 LYS 319 HG3 LYS 319 16.125 16.695 10.723
205 HD2 LYS 319 HD2 LYS 319 14.710 14.688 10.785
206 HD3 LYS 319 HD3 LYS 319 16.121 13.641 10.590
207 HE2 LYS 319 HE2 LYS 319 15.480 13.636 12.899
208 HE3 LYS 319 HE3 LYS 319 17.041 14.463 12.719
209 HZ1 LYS 319 HZ1 LYS 319 15.868 16.572 12.813
210 HZ2 LYS 319 HZ2 LYS 319 15.547 15.686 14.168
211 HZ3 LYS 319 HZ3 LYS 319 14.416 15.807 12.974
212 H GLU 320 H GLU 320 18.605 13.206 6.648
213 HA GLU 320 HA GLU 320 16.970 13.808 4.226
214 HB2 GLU 320 HB2 GLU 320 19.415 14.356 4.243
215 HB3 GLU 320 HB3 GLU 320 19.778 12.659 4.551
216 HG2 GLU 320 HG2 GLU 320 18.974 12.021 2.387
217 HG3 GLU 320 HG3 GLU 320 18.265 13.627 2.119
218 HA PRO 321 HA PRO 321 15.879 9.716 5.724
219 HB2 PRO 321 HB2 PRO 321 13.475 9.351 4.584
220 HB3 PRO 321 HB3 PRO 321 13.702 10.562 5.879
221 HG2 PRO 321 HG2 PRO 321 13.687 10.961 2.894
222 HG3 PRO 321 HG3 PRO 321 12.747 11.832 4.150
223 HD2 PRO 321 HD2 PRO 321 15.099 12.793 3.134
224 HD3 PRO 321 HD3 PRO 321 14.601 13.075 4.838
225 H SER 322 H SER 322 15.568 7.554 4.912
226 HA SER 322 HA SER 322 16.936 7.101 2.369
227 HB2 SER 322 HB2 SER 322 16.747 4.723 3.048
228 HB3 SER 322 HB3 SER 322 17.422 5.730 4.348
229 HG SER 322 HG SER 322 14.714 4.886 4.111
230 H LEU 323 H LEU 323 13.659 7.317 3.473
231 HA LEU 323 HA LEU 323 12.564 6.783 0.851
232 HB2 LEU 323 HB2 LEU 323 11.121 4.936 1.541
233 HB3 LEU 323 HB3 LEU 323 12.813 4.471 1.702
234 HG LEU 323 HG LEU 323 12.289 5.257 4.251
235 HD11 LEU 323 HD11 LEU 323 9.934 5.678 3.836
236 HD12 LEU 323 HD12 LEU 323 10.079 4.179 4.781
237 HD13 LEU 323 HD13 LEU 323 9.753 4.108 3.027
238 HD21 LEU 323 HD21 LEU 323 13.357 3.217 3.306
239 HD22 LEU 323 HD22 LEU 323 11.744 2.560 2.965
240 HD23 LEU 323 HD23 LEU 323 12.245 2.859 4.650
Start of MODEL 4
1 H1 THR 298 H1 THR 298 17.728 -17.525 8.793
2 H2 THR 298 H2 THR 298 17.519 -15.895 8.920
3 H3 THR 298 H3 THR 298 18.949 -16.500 8.362
4 HA THR 298 HA THR 298 19.442 -17.486 10.494
5 HB THR 298 HB THR 298 19.581 -15.317 11.822
6 HG1 THR 298 HG1 THR 298 18.591 -13.563 11.054
7 HG21 THR 298 HG21 THR 298 21.129 -14.207 10.319
8 HG22 THR 298 HG22 THR 298 20.441 -15.036 8.910
9 HG23 THR 298 HG23 THR 298 21.337 -15.962 10.145
10 H ASN 299 H ASN 299 18.846 -17.217 12.944
11 HA ASN 299 HA ASN 299 16.002 -17.970 13.153
12 HB2 ASN 299 HB2 ASN 299 16.561 -18.724 15.364
13 HB3 ASN 299 HB3 ASN 299 17.846 -19.268 14.276
14 HD21 ASN 299 HD21 ASN 299 17.736 -18.697 17.230
15 HD22 ASN 299 HD22 ASN 299 19.078 -17.611 17.501
16 H ARG 300 H ARG 300 17.723 -15.090 13.324
17 HA ARG 300 HA ARG 300 15.446 -13.712 14.574
18 HB2 ARG 300 HB2 ARG 300 17.725 -14.334 16.135
19 HB3 ARG 300 HB3 ARG 300 18.010 -12.680 15.589
20 HG2 ARG 300 HG2 ARG 300 16.927 -12.455 17.668
21 HG3 ARG 300 HG3 ARG 300 15.656 -12.140 16.472
22 HD2 ARG 300 HD2 ARG 300 14.831 -14.455 16.727
23 HD3 ARG 300 HD3 ARG 300 16.124 -14.809 17.880
24 HE ARG 300 HE ARG 300 13.685 -13.215 18.344
25 HH11 ARG 300 HH11 ARG 300 16.779 -14.283 19.689
26 HH12 ARG 300 HH12 ARG 300 16.302 -13.892 21.320
27 HH21 ARG 300 HH21 ARG 300 13.160 -12.751 20.452
28 HH22 ARG 300 HH22 ARG 300 14.298 -13.046 21.738
29 H ARG 301 H ARG 301 15.243 -11.683 13.534
30 HA ARG 301 HA ARG 301 16.945 -11.338 11.190
31 HB2 ARG 301 HB2 ARG 301 14.363 -10.843 11.581
32 HB3 ARG 301 HB3 ARG 301 14.957 -9.253 12.049
33 HG2 ARG 301 HG2 ARG 301 15.475 -8.682 9.892
34 HG3 ARG 301 HG3 ARG 301 16.120 -10.288 9.527
35 HD2 ARG 301 HD2 ARG 301 14.247 -10.086 8.122
36 HD3 ARG 301 HD3 ARG 301 13.688 -11.108 9.459
37 HE ARG 301 HE ARG 301 13.111 -8.349 10.035
38 HH11 ARG 301 HH11 ARG 301 11.979 -10.913 7.864
39 HH12 ARG 301 HH12 ARG 301 10.382 -10.225 7.763
40 HH21 ARG 301 HH21 ARG 301 11.111 -7.563 9.874
41 HH22 ARG 301 HH22 ARG 301 9.893 -8.342 8.868
42 H LYS 302 H LYS 302 17.020 -10.189 14.398
43 HA LYS 302 HA LYS 302 18.270 -8.637 15.531
44 HB2 LYS 302 HB2 LYS 302 20.088 -8.745 13.096
45 HB3 LYS 302 HB3 LYS 302 20.487 -8.031 14.656
46 HG2 LYS 302 HG2 LYS 302 20.193 -10.287 15.706
47 HG3 LYS 302 HG3 LYS 302 20.032 -10.964 14.065
48 HD2 LYS 302 HD2 LYS 302 22.234 -9.992 13.464
49 HD3 LYS 302 HD3 LYS 302 22.385 -9.328 15.100
50 HE2 LYS 302 HE2 LYS 302 22.318 -11.629 16.030
51 HE3 LYS 302 HE3 LYS 302 22.230 -12.279 14.376
52 HZ1 LYS 302 HZ1 LYS 302 24.373 -11.228 13.923
53 HZ2 LYS 302 HZ2 LYS 302 24.511 -12.255 15.207
54 HZ3 LYS 302 HZ3 LYS 302 24.450 -10.626 15.457
55 H SEP 303 H SEP 303 16.118 -7.718 13.866
56 HA SEP 303 HA SEP 303 17.024 -4.978 13.091
57 HB2 SEP 303 HB2 SEP 303 15.840 -5.125 11.093
58 HB3 SEP 303 HB3 SEP 303 16.527 -6.756 11.258
59 H GLY 304 H GLY 304 14.658 -3.795 12.473
60 HA2 GLY 304 HA2 GLY 304 12.947 -2.627 13.525
61 HA3 GLY 304 HA3 GLY 304 13.057 -3.702 14.932
62 H LYS 305 H LYS 305 15.344 -3.512 16.042
63 HA LYS 305 HA LYS 305 15.568 -0.737 16.945
64 HB2 LYS 305 HB2 LYS 305 17.216 -3.250 17.441
65 HB3 LYS 305 HB3 LYS 305 17.684 -1.680 18.094
66 HG2 LYS 305 HG2 LYS 305 15.020 -3.021 18.687
67 HG3 LYS 305 HG3 LYS 305 16.466 -3.162 19.703
68 HD2 LYS 305 HD2 LYS 305 16.502 -0.619 19.837
69 HD3 LYS 305 HD3 LYS 305 14.895 -0.630 19.088
70 HE2 LYS 305 HE2 LYS 305 15.654 -2.023 21.692
71 HE3 LYS 305 HE3 LYS 305 14.807 -0.471 21.570
72 HZ1 LYS 305 HZ1 LYS 305 13.271 -2.291 21.939
73 HZ2 LYS 305 HZ2 LYS 305 13.772 -3.061 20.569
74 HZ3 LYS 305 HZ3 LYS 305 12.985 -1.615 20.463
75 H TYR 306 H TYR 306 17.614 -2.985 15.074
76 HA TYR 306 HA TYR 306 19.563 -0.955 14.457
77 HB2 TYR 306 HB2 TYR 306 19.016 -3.729 13.381
78 HB3 TYR 306 HB3 TYR 306 20.308 -2.700 12.760
79 HD1 TYR 306 HD2 TYR 306 19.138 -4.581 15.762
80 HD2 TYR 306 HD1 TYR 306 22.325 -2.271 14.023
81 HE1 TYR 306 HE2 TYR 306 20.665 -5.304 17.598
82 HE2 TYR 306 HE1 TYR 306 23.844 -2.996 15.867
83 HH TYR 306 HH TYR 306 24.058 -4.222 17.786
84 H LYS 307 H LYS 307 16.562 -2.029 12.937
85 HA LYS 307 HA LYS 307 17.079 -1.259 10.303
86 HB2 LYS 307 HB2 LYS 307 15.051 -2.452 11.077
87 HB3 LYS 307 HB3 LYS 307 14.458 -0.963 11.809
88 HG2 LYS 307 HG2 LYS 307 13.350 -1.392 9.662
89 HG3 LYS 307 HG3 LYS 307 14.283 0.104 9.608
90 HD2 LYS 307 HD2 LYS 307 14.544 -1.128 7.510
91 HD3 LYS 307 HD3 LYS 307 16.092 -1.032 8.352
92 HE2 LYS 307 HE2 LYS 307 15.778 -3.260 7.393
93 HE3 LYS 307 HE3 LYS 307 15.811 -3.360 9.158
94 HZ1 LYS 307 HZ1 LYS 307 13.427 -3.544 9.172
95 HZ2 LYS 307 HZ2 LYS 307 14.046 -4.711 8.199
96 HZ3 LYS 307 HZ3 LYS 307 13.340 -3.367 7.527
97 H LYS 308 H LYS 308 15.957 0.816 12.999
98 HA LYS 308 HA LYS 308 16.009 3.141 11.234
99 HB2 LYS 308 HB2 LYS 308 15.751 4.381 13.524
100 HB3 LYS 308 HB3 LYS 308 14.420 3.582 12.707
101 HG2 LYS 308 HG2 LYS 308 14.969 1.540 14.260
102 HG3 LYS 308 HG3 LYS 308 15.880 2.729 15.210
103 HD2 LYS 308 HD2 LYS 308 13.698 2.713 16.161
104 HD3 LYS 308 HD3 LYS 308 13.726 4.156 15.125
105 HE2 LYS 308 HE2 LYS 308 12.682 2.698 13.280
106 HE3 LYS 308 HE3 LYS 308 12.457 1.444 14.509
107 HZ1 LYS 308 HZ1 LYS 308 10.474 2.789 14.217
108 HZ2 LYS 308 HZ2 LYS 308 11.291 4.174 14.578
109 HZ3 LYS 308 HZ3 LYS 308 11.068 3.022 15.740
110 H VAL 309 H VAL 309 18.346 1.532 13.243
111 HA VAL 309 HA VAL 309 20.117 3.814 13.458
112 HB VAL 309 HB VAL 309 20.600 0.818 13.679
113 HG11 VAL 309 HG11 VAL 309 22.878 1.409 14.529
114 HG12 VAL 309 HG12 VAL 309 22.675 1.752 12.804
115 HG13 VAL 309 HG13 VAL 309 22.618 3.084 13.984
116 HG21 VAL 309 HG21 VAL 309 20.679 3.123 15.645
117 HG22 VAL 309 HG22 VAL 309 19.375 1.918 15.508
118 HG23 VAL 309 HG23 VAL 309 20.992 1.413 16.039
119 H GLU 310 H GLU 310 19.622 1.182 11.021
120 HA GLU 310 HA GLU 310 21.802 1.953 9.350
121 HB2 GLU 310 HB2 GLU 310 19.116 0.667 8.811
122 HB3 GLU 310 HB3 GLU 310 20.145 1.178 7.473
123 HG2 GLU 310 HG2 GLU 310 20.845 -0.983 7.656
124 HG3 GLU 310 HG3 GLU 310 22.004 -0.206 8.741
125 H ILE 311 H ILE 311 18.451 3.188 9.538
126 HA ILE 311 HA ILE 311 18.631 5.109 7.424
127 HB ILE 311 HB ILE 311 16.932 5.160 9.952
128 HG12 ILE 311 HG12 ILE 311 16.244 4.174 7.157
129 HG13 ILE 311 HG13 ILE 311 16.739 3.113 8.467
130 HG21 ILE 311 HG21 ILE 311 17.111 7.377 8.634
131 HG22 ILE 311 HG22 ILE 311 16.304 6.526 7.297
132 HG23 ILE 311 HG23 ILE 311 15.488 6.718 8.857
133 HD11 ILE 311 HD11 ILE 311 14.761 4.029 9.794
134 HD12 ILE 311 HD12 ILE 311 14.216 4.726 8.254
135 HD13 ILE 311 HD13 ILE 311 14.405 2.973 8.409
136 H LYS 312 H LYS 312 19.461 5.267 10.897
137 HA LYS 312 HA LYS 312 20.084 8.084 10.860
138 HB2 LYS 312 HB2 LYS 312 19.509 6.861 12.912
139 HB3 LYS 312 HB3 LYS 312 20.973 5.894 12.772
140 HG2 LYS 312 HG2 LYS 312 21.369 8.852 12.797
141 HG3 LYS 312 HG3 LYS 312 20.768 8.135 14.300
142 HD2 LYS 312 HD2 LYS 312 22.774 7.245 14.801
143 HD3 LYS 312 HD3 LYS 312 22.955 6.557 13.180
144 HE2 LYS 312 HE2 LYS 312 23.714 8.757 12.324
145 HE3 LYS 312 HE3 LYS 312 23.572 9.433 13.961
146 HZ1 LYS 312 HZ1 LYS 312 25.369 7.195 13.167
147 HZ2 LYS 312 HZ2 LYS 312 25.241 7.814 14.685
148 HZ3 LYS 312 HZ3 LYS 312 25.846 8.746 13.463
149 H GLU 313 H GLU 313 22.203 5.154 10.720
150 HA GLU 313 HA GLU 313 24.606 6.738 10.551
151 HB2 GLU 313 HB2 GLU 313 24.128 3.901 9.580
152 HB3 GLU 313 HB3 GLU 313 25.700 4.670 9.793
153 HG2 GLU 313 HG2 GLU 313 23.716 3.952 11.971
154 HG3 GLU 313 HG3 GLU 313 25.271 3.186 11.659
155 H LEU 314 H LEU 314 22.471 5.399 7.999
156 HA LEU 314 HA LEU 314 24.261 6.146 5.844
157 HB2 LEU 314 HB2 LEU 314 22.447 4.418 5.754
158 HB3 LEU 314 HB3 LEU 314 21.256 5.708 5.811
159 HG LEU 314 HG LEU 314 21.983 6.515 3.615
160 HD11 LEU 314 HD11 LEU 314 24.351 5.952 3.617
161 HD12 LEU 314 HD12 LEU 314 23.566 5.141 2.251
162 HD13 LEU 314 HD13 LEU 314 23.977 4.213 3.713
163 HD21 LEU 314 HD21 LEU 314 21.510 3.506 3.638
164 HD22 LEU 314 HD22 LEU 314 21.159 4.630 2.302
165 HD23 LEU 314 HD23 LEU 314 20.249 4.748 3.817
166 H GLY 315 H GLY 315 22.170 7.895 7.917
167 HA2 GLY 315 HA2 GLY 315 22.022 10.207 8.064
168 HA3 GLY 315 HA3 GLY 315 22.850 10.359 6.509
169 H GLU 316 H GLU 316 20.102 8.208 6.582
170 HA GLU 316 HA GLU 316 18.673 10.015 4.774
171 HB2 GLU 316 HB2 GLU 316 17.783 7.421 6.058
172 HB3 GLU 316 HB3 GLU 316 16.908 8.297 4.802
173 HG2 GLU 316 HG2 GLU 316 19.609 6.952 4.567
174 HG3 GLU 316 HG3 GLU 316 18.092 6.426 3.827
175 H LEU 317 H LEU 317 19.001 9.542 8.113
176 HA LEU 317 HA LEU 317 16.477 10.324 9.084
177 HB2 LEU 317 HB2 LEU 317 18.887 9.648 10.165
178 HB3 LEU 317 HB3 LEU 317 18.819 11.372 10.548
179 HG LEU 317 HG LEU 317 16.508 10.880 11.547
180 HD11 LEU 317 HD11 LEU 317 17.654 8.098 11.103
181 HD12 LEU 317 HD12 LEU 317 16.060 8.712 10.614
182 HD13 LEU 317 HD13 LEU 317 16.404 8.435 12.334
183 HD21 LEU 317 HD21 LEU 317 19.024 9.626 12.682
184 HD22 LEU 317 HD22 LEU 317 17.619 10.204 13.616
185 HD23 LEU 317 HD23 LEU 317 18.631 11.358 12.709
186 H ARG 318 H ARG 318 18.828 12.242 7.396
187 HA ARG 318 HA ARG 318 17.318 14.709 8.185
188 HB2 ARG 318 HB2 ARG 318 19.287 16.011 7.625
189 HB3 ARG 318 HB3 ARG 318 19.695 14.780 8.825
190 HG2 ARG 318 HG2 ARG 318 20.642 13.374 7.010
191 HG3 ARG 318 HG3 ARG 318 20.335 14.678 5.856
192 HD2 ARG 318 HD2 ARG 318 22.101 14.835 8.321
193 HD3 ARG 318 HD3 ARG 318 22.669 14.632 6.653
194 HE ARG 318 HE ARG 318 21.036 16.949 6.763
195 HH11 ARG 318 HH11 ARG 318 24.199 15.877 7.912
196 HH12 ARG 318 HH12 ARG 318 24.842 17.497 7.946
197 HH21 ARG 318 HH21 ARG 318 21.924 18.990 6.834
198 HH22 ARG 318 HH22 ARG 318 23.577 19.225 7.334
199 H LYS 319 H LYS 319 16.868 12.550 6.052
200 HA LYS 319 HA LYS 319 16.411 14.476 3.801
201 HB2 LYS 319 HB2 LYS 319 17.521 11.645 3.667
202 HB3 LYS 319 HB3 LYS 319 16.779 12.452 2.281
203 HG2 LYS 319 HG2 LYS 319 18.481 14.212 2.358
204 HG3 LYS 319 HG3 LYS 319 19.234 13.455 3.776
205 HD2 LYS 319 HD2 LYS 319 18.812 11.732 1.363
206 HD3 LYS 319 HD3 LYS 319 20.074 12.978 1.256
207 HE2 LYS 319 HE2 LYS 319 21.230 12.089 3.174
208 HE3 LYS 319 HE3 LYS 319 19.879 11.009 3.553
209 HZ1 LYS 319 HZ1 LYS 319 20.327 9.700 1.675
210 HZ2 LYS 319 HZ2 LYS 319 21.770 9.915 2.430
211 HZ3 LYS 319 HZ3 LYS 319 21.430 10.771 1.058
212 H GLU 320 H GLU 320 15.767 11.004 4.251
213 HA GLU 320 HA GLU 320 12.835 11.566 4.425
214 HB2 GLU 320 HB2 GLU 320 14.242 9.345 2.892
215 HB3 GLU 320 HB3 GLU 320 12.490 9.484 3.131
216 HG2 GLU 320 HG2 GLU 320 12.537 11.684 1.941
217 HG3 GLU 320 HG3 GLU 320 14.266 11.461 1.640
218 HA PRO 321 HA PRO 321 14.615 9.230 7.946
219 HB2 PRO 321 HB2 PRO 321 13.197 10.352 9.989
220 HB3 PRO 321 HB3 PRO 321 14.592 11.176 9.234
221 HG2 PRO 321 HG2 PRO 321 11.671 11.526 8.643
222 HG3 PRO 321 HG3 PRO 321 12.900 12.774 9.030
223 HD2 PRO 321 HD2 PRO 321 12.214 12.215 6.483
224 HD3 PRO 321 HD3 PRO 321 13.917 12.586 6.928
225 H SER 322 H SER 322 13.964 7.502 9.099
226 HA SER 322 HA SER 322 12.712 5.760 9.818
227 HB2 SER 322 HB2 SER 322 10.428 7.742 10.015
228 HB3 SER 322 HB3 SER 322 10.616 6.219 10.911
229 HG SER 322 HG SER 322 12.044 8.634 11.151
230 H LEU 323 H LEU 323 12.893 5.782 7.093
231 HA LEU 323 HA LEU 323 10.298 4.998 5.987
232 HB2 LEU 323 HB2 LEU 323 11.732 4.388 4.002
233 HB3 LEU 323 HB3 LEU 323 11.799 6.078 4.476
234 HG LEU 323 HG LEU 323 14.024 5.520 5.620
235 HD11 LEU 323 HD11 LEU 323 13.612 3.091 3.848
236 HD12 LEU 323 HD12 LEU 323 13.982 3.107 5.583
237 HD13 LEU 323 HD13 LEU 323 15.212 3.640 4.415
238 HD21 LEU 323 HD21 LEU 323 13.633 5.327 2.620
239 HD22 LEU 323 HD22 LEU 323 15.076 5.944 3.469
240 HD23 LEU 323 HD23 LEU 323 13.528 6.817 3.580
Start of MODEL 5
1 H1 THR 298 H1 THR 298 24.588 -15.543 12.041
2 H2 THR 298 H2 THR 298 23.621 -16.307 10.941
3 H3 THR 298 H3 THR 298 23.695 -14.661 10.971
4 HA THR 298 HA THR 298 22.562 -16.393 13.065
5 HB THR 298 HB THR 298 22.416 -13.370 13.020
6 HG1 THR 298 HG1 THR 298 24.313 -13.352 14.270
7 HG21 THR 298 HG21 THR 298 21.002 -14.624 14.643
8 HG22 THR 298 HG22 THR 298 22.244 -13.660 15.461
9 HG23 THR 298 HG23 THR 298 22.463 -15.417 15.287
10 H ASN 299 H ASN 299 20.202 -16.323 13.156
11 HA ASN 299 HA ASN 299 19.060 -15.563 10.537
12 HB2 ASN 299 HB2 ASN 299 17.197 -16.932 11.110
13 HB3 ASN 299 HB3 ASN 299 18.649 -17.831 11.572
14 HD21 ASN 299 HD21 ASN 299 15.633 -17.300 12.508
15 HD22 ASN 299 HD22 ASN 299 15.815 -17.359 14.242
16 H ARG 300 H ARG 300 19.705 -13.649 12.958
17 HA ARG 300 HA ARG 300 17.387 -12.019 12.444
18 HB2 ARG 300 HB2 ARG 300 17.001 -11.389 14.694
19 HB3 ARG 300 HB3 ARG 300 16.597 -13.071 14.438
20 HG2 ARG 300 HG2 ARG 300 19.278 -12.356 15.556
21 HG3 ARG 300 HG3 ARG 300 17.837 -12.255 16.586
22 HD2 ARG 300 HD2 ARG 300 17.242 -14.552 15.871
23 HD3 ARG 300 HD3 ARG 300 18.798 -14.641 15.039
24 HE ARG 300 HE ARG 300 19.282 -13.816 17.714
25 HH11 ARG 300 HH11 ARG 300 18.197 -16.758 16.070
26 HH12 ARG 300 HH12 ARG 300 18.731 -17.777 17.386
27 HH21 ARG 300 HH21 ARG 300 19.956 -15.193 19.315
28 HH22 ARG 300 HH22 ARG 300 19.720 -16.912 19.167
29 H ARG 301 H ARG 301 17.855 -9.785 12.779
30 HA ARG 301 HA ARG 301 20.814 -9.203 12.909
31 HB2 ARG 301 HB2 ARG 301 19.165 -8.853 10.840
32 HB3 ARG 301 HB3 ARG 301 18.841 -7.343 11.694
33 HG2 ARG 301 HG2 ARG 301 21.217 -6.764 11.637
34 HG3 ARG 301 HG3 ARG 301 21.595 -8.317 10.850
35 HD2 ARG 301 HD2 ARG 301 20.210 -7.731 8.964
36 HD3 ARG 301 HD3 ARG 301 19.715 -6.231 9.766
37 HE ARG 301 HE ARG 301 22.604 -6.583 9.311
38 HH11 ARG 301 HH11 ARG 301 19.628 -5.086 8.136
39 HH12 ARG 301 HH12 ARG 301 20.492 -3.830 7.268
40 HH21 ARG 301 HH21 ARG 301 23.625 -5.006 8.105
41 HH22 ARG 301 HH22 ARG 301 22.689 -3.796 7.251
42 H LYS 302 H LYS 302 18.052 -8.988 14.705
43 HA LYS 302 HA LYS 302 17.228 -7.682 16.341
44 HB2 LYS 302 HB2 LYS 302 19.936 -6.330 16.503
45 HB3 LYS 302 HB3 LYS 302 18.605 -6.125 17.636
46 HG2 LYS 302 HG2 LYS 302 20.398 -8.524 17.237
47 HG3 LYS 302 HG3 LYS 302 20.010 -7.662 18.724
48 HD2 LYS 302 HD2 LYS 302 18.212 -9.627 17.205
49 HD3 LYS 302 HD3 LYS 302 18.978 -9.886 18.770
50 HE2 LYS 302 HE2 LYS 302 17.218 -8.981 19.863
51 HE3 LYS 302 HE3 LYS 302 17.288 -7.507 18.878
52 HZ1 LYS 302 HZ1 LYS 302 15.167 -8.579 18.500
53 HZ2 LYS 302 HZ2 LYS 302 15.863 -10.030 18.157
54 HZ3 LYS 302 HZ3 LYS 302 16.036 -8.771 17.110
55 H SEP 303 H SEP 303 16.678 -7.471 14.003
56 HA SEP 303 HA SEP 303 16.461 -5.094 12.552
57 HB2 SEP 303 HB2 SEP 303 14.270 -6.269 11.847
58 HB3 SEP 303 HB3 SEP 303 15.750 -7.223 11.670
59 H GLY 304 H GLY 304 14.653 -3.671 12.317
60 HA2 GLY 304 HA2 GLY 304 13.031 -2.196 13.133
61 HA3 GLY 304 HA3 GLY 304 12.944 -3.133 14.642
62 H LYS 305 H LYS 305 15.033 -3.057 16.002
63 HA LYS 305 HA LYS 305 15.585 -0.256 16.528
64 HB2 LYS 305 HB2 LYS 305 15.590 -2.015 18.287
65 HB3 LYS 305 HB3 LYS 305 17.049 -2.716 17.573
66 HG2 LYS 305 HG2 LYS 305 18.340 -0.735 18.067
67 HG3 LYS 305 HG3 LYS 305 16.894 0.162 18.553
68 HD2 LYS 305 HD2 LYS 305 17.842 -2.333 20.011
69 HD3 LYS 305 HD3 LYS 305 18.385 -0.697 20.431
70 HE2 LYS 305 HE2 LYS 305 15.983 -0.022 20.744
71 HE3 LYS 305 HE3 LYS 305 15.512 -1.714 20.487
72 HZ1 LYS 305 HZ1 LYS 305 15.712 -1.192 22.841
73 HZ2 LYS 305 HZ2 LYS 305 17.284 -0.733 22.658
74 HZ3 LYS 305 HZ3 LYS 305 16.852 -2.308 22.425
75 H TYR 306 H TYR 306 17.608 -2.966 15.218
76 HA TYR 306 HA TYR 306 19.766 -1.183 14.512
77 HB2 TYR 306 HB2 TYR 306 20.123 -3.618 14.671
78 HB3 TYR 306 HB3 TYR 306 19.011 -3.874 13.311
79 HD1 TYR 306 HD1 TYR 306 22.384 -2.640 14.277
80 HD2 TYR 306 HD2 TYR 306 19.647 -3.280 11.017
81 HE1 TYR 306 HE1 TYR 306 24.221 -2.219 12.623
82 HE2 TYR 306 HE2 TYR 306 21.462 -2.824 9.412
83 HH TYR 306 HH TYR 306 23.572 -2.126 9.087
84 H LYS 307 H LYS 307 16.742 -2.176 12.929
85 HA LYS 307 HA LYS 307 17.423 -1.363 10.309
86 HB2 LYS 307 HB2 LYS 307 15.368 -2.630 10.989
87 HB3 LYS 307 HB3 LYS 307 14.660 -1.102 11.523
88 HG2 LYS 307 HG2 LYS 307 15.748 -1.247 8.734
89 HG3 LYS 307 HG3 LYS 307 14.254 -2.132 9.080
90 HD2 LYS 307 HD2 LYS 307 13.190 -0.079 9.914
91 HD3 LYS 307 HD3 LYS 307 14.675 0.838 9.602
92 HE2 LYS 307 HE2 LYS 307 13.081 -0.639 7.478
93 HE3 LYS 307 HE3 LYS 307 12.940 1.089 7.823
94 HZ1 LYS 307 HZ1 LYS 307 15.315 1.298 7.261
95 HZ2 LYS 307 HZ2 LYS 307 14.399 0.783 5.990
96 HZ3 LYS 307 HZ3 LYS 307 15.354 -0.289 6.813
97 H LYS 308 H LYS 308 16.071 0.538 13.041
98 HA LYS 308 HA LYS 308 15.965 2.991 11.506
99 HB2 LYS 308 HB2 LYS 308 14.670 2.535 13.606
100 HB3 LYS 308 HB3 LYS 308 16.180 2.679 14.521
101 HG2 LYS 308 HG2 LYS 308 16.439 5.001 13.768
102 HG3 LYS 308 HG3 LYS 308 14.993 4.855 12.755
103 HD2 LYS 308 HD2 LYS 308 13.608 4.505 14.751
104 HD3 LYS 308 HD3 LYS 308 15.053 4.574 15.780
105 HE2 LYS 308 HE2 LYS 308 13.922 6.731 15.841
106 HE3 LYS 308 HE3 LYS 308 15.481 6.899 15.010
107 HZ1 LYS 308 HZ1 LYS 308 14.368 6.922 12.916
108 HZ2 LYS 308 HZ2 LYS 308 13.659 8.049 13.880
109 HZ3 LYS 308 HZ3 LYS 308 12.893 6.612 13.603
110 H VAL 309 H VAL 309 18.479 1.432 13.506
111 HA VAL 309 HA VAL 309 20.239 3.694 13.552
112 HB VAL 309 HB VAL 309 20.630 0.718 13.928
113 HG11 VAL 309 HG11 VAL 309 23.034 1.179 14.508
114 HG12 VAL 309 HG12 VAL 309 22.687 1.343 12.779
115 HG13 VAL 309 HG13 VAL 309 22.861 2.798 13.790
116 HG21 VAL 309 HG21 VAL 309 21.106 3.176 15.636
117 HG22 VAL 309 HG22 VAL 309 19.693 2.093 15.735
118 HG23 VAL 309 HG23 VAL 309 21.307 1.485 16.168
119 H GLU 310 H GLU 310 19.768 1.061 11.155
120 HA GLU 310 HA GLU 310 22.003 1.788 9.554
121 HB2 GLU 310 HB2 GLU 310 20.439 -0.259 9.433
122 HB3 GLU 310 HB3 GLU 310 19.393 0.747 8.425
123 HG2 GLU 310 HG2 GLU 310 20.851 0.685 6.645
124 HG3 GLU 310 HG3 GLU 310 22.283 0.637 7.687
125 H ILE 311 H ILE 311 18.643 3.053 9.638
126 HA ILE 311 HA ILE 311 19.004 4.901 7.441
127 HB ILE 311 HB ILE 311 17.088 5.189 9.816
128 HG12 ILE 311 HG12 ILE 311 16.542 3.916 7.104
129 HG13 ILE 311 HG13 ILE 311 16.869 2.997 8.567
130 HG21 ILE 311 HG21 ILE 311 17.437 7.251 8.342
131 HG22 ILE 311 HG22 ILE 311 16.860 6.311 6.965
132 HG23 ILE 311 HG23 ILE 311 15.778 6.653 8.339
133 HD11 ILE 311 HD11 ILE 311 14.852 4.037 9.647
134 HD12 ILE 311 HD12 ILE 311 14.482 4.828 8.094
135 HD13 ILE 311 HD13 ILE 311 14.471 3.063 8.210
136 H LYS 312 H LYS 312 19.536 5.055 10.984
137 HA LYS 312 HA LYS 312 20.092 7.841 11.139
138 HB2 LYS 312 HB2 LYS 312 19.743 6.210 13.060
139 HB3 LYS 312 HB3 LYS 312 21.419 5.709 12.829
140 HG2 LYS 312 HG2 LYS 312 21.310 8.592 13.003
141 HG3 LYS 312 HG3 LYS 312 20.406 7.892 14.351
142 HD2 LYS 312 HD2 LYS 312 22.514 7.947 15.284
143 HD3 LYS 312 HD3 LYS 312 22.551 6.328 14.563
144 HE2 LYS 312 HE2 LYS 312 23.644 7.345 12.527
145 HE3 LYS 312 HE3 LYS 312 23.736 8.885 13.397
146 HZ1 LYS 312 HZ1 LYS 312 25.086 7.716 15.076
147 HZ2 LYS 312 HZ2 LYS 312 25.784 7.640 13.577
148 HZ3 LYS 312 HZ3 LYS 312 25.005 6.324 14.176
149 H GLU 313 H GLU 313 22.308 5.055 10.606
150 HA GLU 313 HA GLU 313 24.646 6.728 10.302
151 HB2 GLU 313 HB2 GLU 313 24.149 4.034 8.985
152 HB3 GLU 313 HB3 GLU 313 25.703 4.823 9.237
153 HG2 GLU 313 HG2 GLU 313 23.938 3.431 11.237
154 HG3 GLU 313 HG3 GLU 313 25.645 3.180 10.898
155 H LEU 314 H LEU 314 22.125 5.653 8.046
156 HA LEU 314 HA LEU 314 23.435 6.702 5.683
157 HB2 LEU 314 HB2 LEU 314 21.697 4.856 5.856
158 HB3 LEU 314 HB3 LEU 314 20.496 6.111 6.099
159 HG LEU 314 HG LEU 314 20.856 6.946 3.832
160 HD11 LEU 314 HD11 LEU 314 23.228 6.505 3.488
161 HD12 LEU 314 HD12 LEU 314 22.298 5.654 2.244
162 HD13 LEU 314 HD13 LEU 314 22.963 4.751 3.625
163 HD21 LEU 314 HD21 LEU 314 19.268 5.096 4.273
164 HD22 LEU 314 HD22 LEU 314 20.551 3.918 3.914
165 HD23 LEU 314 HD23 LEU 314 19.956 5.013 2.641
166 H GLY 315 H GLY 315 22.319 8.309 8.304
167 HA2 GLY 315 HA2 GLY 315 22.430 10.664 8.373
168 HA3 GLY 315 HA3 GLY 315 21.970 10.749 6.686
169 H GLU 316 H GLU 316 20.142 9.027 9.245
170 HA GLU 316 HA GLU 316 17.699 10.417 8.659
171 HB2 GLU 316 HB2 GLU 316 18.102 8.266 10.064
172 HB3 GLU 316 HB3 GLU 316 18.462 9.354 11.399
173 HG2 GLU 316 HG2 GLU 316 16.209 10.340 11.182
174 HG3 GLU 316 HG3 GLU 316 15.866 9.232 9.840
175 H LEU 317 H LEU 317 20.495 11.109 10.668
176 HA LEU 317 HA LEU 317 19.351 13.313 12.146
177 HB2 LEU 317 HB2 LEU 317 22.262 12.707 11.492
178 HB3 LEU 317 HB3 LEU 317 21.682 13.799 12.751
179 HG LEU 317 HG LEU 317 21.199 10.814 12.737
180 HD11 LEU 317 HD11 LEU 317 23.543 11.460 12.743
181 HD12 LEU 317 HD12 LEU 317 23.060 10.849 14.350
182 HD13 LEU 317 HD13 LEU 317 23.244 12.603 14.074
183 HD21 LEU 317 HD21 LEU 317 20.801 13.032 14.773
184 HD22 LEU 317 HD22 LEU 317 20.775 11.295 15.180
185 HD23 LEU 317 HD23 LEU 317 19.554 11.964 14.079
186 H ARG 318 H ARG 318 20.691 12.948 8.955
187 HA ARG 318 HA ARG 318 21.171 15.828 8.536
188 HB2 ARG 318 HB2 ARG 318 20.981 13.593 6.480
189 HB3 ARG 318 HB3 ARG 318 21.687 15.188 6.239
190 HG2 ARG 318 HG2 ARG 318 23.561 14.637 7.702
191 HG3 ARG 318 HG3 ARG 318 22.795 13.100 8.152
192 HD2 ARG 318 HD2 ARG 318 22.799 12.604 5.597
193 HD3 ARG 318 HD3 ARG 318 24.033 13.876 5.506
194 HE ARG 318 HE ARG 318 25.135 12.399 7.409
195 HH11 ARG 318 HH11 ARG 318 23.503 11.166 4.524
196 HH12 ARG 318 HH12 ARG 318 24.416 9.686 4.536
197 HH21 ARG 318 HH21 ARG 318 26.253 10.473 7.348
198 HH22 ARG 318 HH22 ARG 318 25.923 9.295 6.112
199 H LYS 319 H LYS 319 18.588 13.820 8.867
200 HA LYS 319 HA LYS 319 16.368 13.985 8.581
201 HB2 LYS 319 HB2 LYS 319 16.806 16.646 7.197
202 HB3 LYS 319 HB3 LYS 319 15.272 16.008 7.781
203 HG2 LYS 319 HG2 LYS 319 15.720 16.515 9.964
204 HG3 LYS 319 HG3 LYS 319 17.443 16.168 9.805
205 HD2 LYS 319 HD2 LYS 319 17.588 18.306 8.381
206 HD3 LYS 319 HD3 LYS 319 15.968 18.682 9.008
207 HE2 LYS 319 HE2 LYS 319 17.573 19.766 10.438
208 HE3 LYS 319 HE3 LYS 319 16.914 18.384 11.343
209 HZ1 LYS 319 HZ1 LYS 319 18.901 17.118 10.728
210 HZ2 LYS 319 HZ2 LYS 319 19.337 18.502 11.511
211 HZ3 LYS 319 HZ3 LYS 319 19.499 18.397 9.874
212 H GLU 320 H GLU 320 18.227 12.757 6.707
213 HA GLU 320 HA GLU 320 16.678 12.865 4.180
214 HB2 GLU 320 HB2 GLU 320 19.232 12.817 4.244
215 HB3 GLU 320 HB3 GLU 320 19.107 11.169 4.867
216 HG2 GLU 320 HG2 GLU 320 19.438 10.935 2.542
217 HG3 GLU 320 HG3 GLU 320 17.708 10.640 2.795
218 HA PRO 321 HA PRO 321 14.701 9.401 6.267
219 HB2 PRO 321 HB2 PRO 321 12.423 9.182 4.835
220 HB3 PRO 321 HB3 PRO 321 12.705 10.591 5.912
221 HG2 PRO 321 HG2 PRO 321 13.114 10.365 2.932
222 HG3 PRO 321 HG3 PRO 321 12.245 11.631 3.853
223 HD2 PRO 321 HD2 PRO 321 14.851 11.888 3.012
224 HD3 PRO 321 HD3 PRO 321 14.218 12.675 4.499
225 H SER 322 H SER 322 14.247 7.144 5.825
226 HA SER 322 HA SER 322 14.538 6.223 3.032
227 HB2 SER 322 HB2 SER 322 16.215 5.108 5.310
228 HB3 SER 322 HB3 SER 322 16.167 4.500 3.644
229 HG SER 322 HG SER 322 16.646 7.137 3.598
230 H LEU 323 H LEU 323 13.643 4.099 2.762
231 HA LEU 323 HA LEU 323 11.522 3.526 4.718
232 HB2 LEU 323 HB2 LEU 323 10.524 2.203 3.062
233 HB3 LEU 323 HB3 LEU 323 11.177 3.574 2.181
234 HG LEU 323 HG LEU 323 12.476 0.840 2.266
235 HD11 LEU 323 HD11 LEU 323 10.153 0.896 1.466
236 HD12 LEU 323 HD12 LEU 323 11.299 0.533 0.152
237 HD13 LEU 323 HD13 LEU 323 10.589 2.164 0.298
238 HD21 LEU 323 HD21 LEU 323 12.864 3.329 0.566
239 HD22 LEU 323 HD22 LEU 323 13.476 1.720 0.103
240 HD23 LEU 323 HD23 LEU 323 14.076 2.499 1.579
Start of MODEL 6
1 H1 THR 298 H1 THR 298 22.709 -14.247 8.588
2 H2 THR 298 H2 THR 298 21.560 -15.002 7.675
3 H3 THR 298 H3 THR 298 21.214 -13.573 8.421
4 HA THR 298 HA THR 298 21.811 -16.111 9.806
5 HB THR 298 HB THR 298 20.729 -14.597 11.722
6 HG1 THR 298 HG1 THR 298 20.436 -12.633 10.960
7 HG21 THR 298 HG21 THR 298 23.601 -14.174 10.793
8 HG22 THR 298 HG22 THR 298 23.030 -15.542 11.787
9 HG23 THR 298 HG23 THR 298 22.963 -13.887 12.425
10 H ASN 299 H ASN 299 19.814 -16.813 11.138
11 HA ASN 299 HA ASN 299 17.521 -16.757 9.295
12 HB2 ASN 299 HB2 ASN 299 18.472 -18.822 10.524
13 HB3 ASN 299 HB3 ASN 299 17.642 -18.194 11.958
14 HD21 ASN 299 HD21 ASN 299 16.330 -20.107 11.942
15 HD22 ASN 299 HD22 ASN 299 15.010 -20.254 10.810
16 H ARG 300 H ARG 300 18.333 -14.383 10.942
17 HA ARG 300 HA ARG 300 15.656 -13.465 11.598
18 HB2 ARG 300 HB2 ARG 300 17.099 -14.582 13.744
19 HB3 ARG 300 HB3 ARG 300 17.543 -12.875 13.808
20 HG2 ARG 300 HG2 ARG 300 15.677 -12.964 15.204
21 HG3 ARG 300 HG3 ARG 300 14.982 -12.426 13.666
22 HD2 ARG 300 HD2 ARG 300 13.504 -14.106 14.426
23 HD3 ARG 300 HD3 ARG 300 14.496 -14.918 13.204
24 HE ARG 300 HE ARG 300 15.593 -15.194 15.874
25 HH11 ARG 300 HH11 ARG 300 13.187 -16.569 13.685
26 HH12 ARG 300 HH12 ARG 300 13.148 -18.089 14.539
27 HH21 ARG 300 HH21 ARG 300 15.494 -17.166 16.906
28 HH22 ARG 300 HH22 ARG 300 14.444 -18.423 16.314
29 H ARG 301 H ARG 301 15.783 -11.183 11.105
30 HA ARG 301 HA ARG 301 18.330 -10.407 9.879
31 HB2 ARG 301 HB2 ARG 301 15.699 -8.901 10.079
32 HB3 ARG 301 HB3 ARG 301 17.110 -8.410 9.128
33 HG2 ARG 301 HG2 ARG 301 16.846 -10.849 8.093
34 HG3 ARG 301 HG3 ARG 301 15.176 -10.667 8.644
35 HD2 ARG 301 HD2 ARG 301 16.653 -8.755 6.783
36 HD3 ARG 301 HD3 ARG 301 15.499 -9.998 6.274
37 HE ARG 301 HE ARG 301 14.353 -8.166 8.226
38 HH11 ARG 301 HH11 ARG 301 15.053 -8.466 4.759
39 HH12 ARG 301 HH12 ARG 301 13.805 -7.329 4.338
40 HH21 ARG 301 HH21 ARG 301 12.851 -6.761 7.626
41 HH22 ARG 301 HH22 ARG 301 12.555 -6.382 5.936
42 H LYS 302 H LYS 302 17.148 -10.154 12.995
43 HA LYS 302 HA LYS 302 17.823 -9.002 14.874
44 HB2 LYS 302 HB2 LYS 302 20.276 -8.436 13.166
45 HB3 LYS 302 HB3 LYS 302 20.145 -8.074 14.886
46 HG2 LYS 302 HG2 LYS 302 20.028 -10.379 15.477
47 HG3 LYS 302 HG3 LYS 302 19.846 -10.876 13.785
48 HD2 LYS 302 HD2 LYS 302 22.157 -11.259 14.593
49 HD3 LYS 302 HD3 LYS 302 22.103 -10.108 13.252
50 HE2 LYS 302 HE2 LYS 302 23.698 -9.342 14.937
51 HE3 LYS 302 HE3 LYS 302 22.345 -8.212 14.826
52 HZ1 LYS 302 HZ1 LYS 302 21.427 -9.210 16.835
53 HZ2 LYS 302 HZ2 LYS 302 22.946 -8.636 17.113
54 HZ3 LYS 302 HZ3 LYS 302 22.697 -10.258 16.943
55 H SEP 303 H SEP 303 16.100 -7.627 13.183
56 HA SEP 303 HA SEP 303 17.072 -4.814 13.106
57 HB2 SEP 303 HB2 SEP 303 16.210 -4.652 10.870
58 HB3 SEP 303 HB3 SEP 303 17.282 -6.063 10.962
59 H GLY 304 H GLY 304 14.825 -3.615 11.999
60 HA2 GLY 304 HA2 GLY 304 13.017 -2.461 12.925
61 HA3 GLY 304 HA3 GLY 304 12.916 -3.652 14.238
62 H LYS 305 H LYS 305 14.809 -3.634 15.798
63 HA LYS 305 HA LYS 305 15.081 -0.962 16.870
64 HB2 LYS 305 HB2 LYS 305 16.639 -3.511 17.465
65 HB3 LYS 305 HB3 LYS 305 16.797 -2.002 18.374
66 HG2 LYS 305 HG2 LYS 305 14.376 -2.137 18.973
67 HG3 LYS 305 HG3 LYS 305 14.271 -3.677 18.106
68 HD2 LYS 305 HD2 LYS 305 14.513 -4.237 20.411
69 HD3 LYS 305 HD3 LYS 305 16.073 -4.576 19.651
70 HE2 LYS 305 HE2 LYS 305 16.480 -3.494 21.780
71 HE3 LYS 305 HE3 LYS 305 16.915 -2.354 20.496
72 HZ1 LYS 305 HZ1 LYS 305 14.374 -2.322 22.032
73 HZ2 LYS 305 HZ2 LYS 305 14.773 -1.259 20.836
74 HZ3 LYS 305 HZ3 LYS 305 15.635 -1.280 22.241
75 H TYR 306 H TYR 306 17.233 -3.089 14.989
76 HA TYR 306 HA TYR 306 19.327 -1.053 14.915
77 HB2 TYR 306 HB2 TYR 306 18.978 -3.766 13.640
78 HB3 TYR 306 HB3 TYR 306 20.310 -2.689 13.205
79 HD1 TYR 306 HD2 TYR 306 18.818 -4.603 16.062
80 HD2 TYR 306 HD1 TYR 306 22.209 -2.365 14.637
81 HE1 TYR 306 HE2 TYR 306 20.152 -5.361 18.031
82 HE2 TYR 306 HE1 TYR 306 23.535 -3.136 16.604
83 HH TYR 306 HH TYR 306 23.527 -4.340 18.551
84 H LYS 307 H LYS 307 16.467 -1.752 13.028
85 HA LYS 307 HA LYS 307 17.398 -0.759 10.513
86 HB2 LYS 307 HB2 LYS 307 14.772 -1.267 11.767
87 HB3 LYS 307 HB3 LYS 307 14.767 0.017 10.564
88 HG2 LYS 307 HG2 LYS 307 15.933 -2.721 10.018
89 HG3 LYS 307 HG3 LYS 307 14.229 -2.319 9.730
90 HD2 LYS 307 HD2 LYS 307 14.912 -0.485 8.215
91 HD3 LYS 307 HD3 LYS 307 16.612 -0.912 8.464
92 HE2 LYS 307 HE2 LYS 307 14.501 -2.760 7.281
93 HE3 LYS 307 HE3 LYS 307 15.694 -1.825 6.353
94 HZ1 LYS 307 HZ1 LYS 307 16.172 -4.116 8.143
95 HZ2 LYS 307 HZ2 LYS 307 17.401 -3.052 7.762
96 HZ3 LYS 307 HZ3 LYS 307 16.640 -3.905 6.576
97 H LYS 308 H LYS 308 16.290 0.858 13.469
98 HA LYS 308 HA LYS 308 16.036 3.440 12.235
99 HB2 LYS 308 HB2 LYS 308 15.090 2.799 14.467
100 HB3 LYS 308 HB3 LYS 308 16.726 2.807 15.131
101 HG2 LYS 308 HG2 LYS 308 15.568 4.888 15.687
102 HG3 LYS 308 HG3 LYS 308 16.928 5.228 14.603
103 HD2 LYS 308 HD2 LYS 308 15.389 5.377 12.679
104 HD3 LYS 308 HD3 LYS 308 14.013 4.982 13.730
105 HE2 LYS 308 HE2 LYS 308 14.342 7.041 14.992
106 HE3 LYS 308 HE3 LYS 308 15.830 7.392 14.078
107 HZ1 LYS 308 HZ1 LYS 308 14.564 7.607 12.089
108 HZ2 LYS 308 HZ2 LYS 308 13.911 8.605 13.221
109 HZ3 LYS 308 HZ3 LYS 308 13.148 7.187 12.843
110 H VAL 309 H VAL 309 18.785 1.681 13.636
111 HA VAL 309 HA VAL 309 20.623 3.924 13.442
112 HB VAL 309 HB VAL 309 21.078 0.917 13.745
113 HG11 VAL 309 HG11 VAL 309 23.076 1.913 12.707
114 HG12 VAL 309 HG12 VAL 309 23.092 3.202 13.930
115 HG13 VAL 309 HG13 VAL 309 23.404 1.516 14.403
116 HG21 VAL 309 HG21 VAL 309 19.975 1.985 15.658
117 HG22 VAL 309 HG22 VAL 309 21.653 1.573 16.072
118 HG23 VAL 309 HG23 VAL 309 21.227 3.255 15.676
119 H GLU 310 H GLU 310 19.676 1.173 11.414
120 HA GLU 310 HA GLU 310 21.619 1.360 9.397
121 HB2 GLU 310 HB2 GLU 310 19.691 -0.294 9.836
122 HB3 GLU 310 HB3 GLU 310 18.666 0.821 8.947
123 HG2 GLU 310 HG2 GLU 310 20.012 0.501 6.942
124 HG3 GLU 310 HG3 GLU 310 21.110 -0.567 7.844
125 H ILE 311 H ILE 311 18.504 3.122 9.745
126 HA ILE 311 HA ILE 311 18.992 4.731 7.368
127 HB ILE 311 HB ILE 311 16.976 5.167 9.636
128 HG12 ILE 311 HG12 ILE 311 16.482 3.893 6.915
129 HG13 ILE 311 HG13 ILE 311 16.857 2.936 8.341
130 HG21 ILE 311 HG21 ILE 311 15.725 6.523 7.944
131 HG22 ILE 311 HG22 ILE 311 17.331 7.200 8.216
132 HG23 ILE 311 HG23 ILE 311 17.026 6.246 6.759
133 HD11 ILE 311 HD11 ILE 311 14.836 3.885 9.486
134 HD12 ILE 311 HD12 ILE 311 14.412 4.705 7.962
135 HD13 ILE 311 HD13 ILE 311 14.466 2.932 8.032
136 H LYS 312 H LYS 312 19.580 5.098 10.871
137 HA LYS 312 HA LYS 312 20.077 7.896 10.880
138 HB2 LYS 312 HB2 LYS 312 19.819 6.448 12.916
139 HB3 LYS 312 HB3 LYS 312 21.420 5.789 12.601
140 HG2 LYS 312 HG2 LYS 312 22.249 7.401 13.895
141 HG3 LYS 312 HG3 LYS 312 21.849 8.549 12.611
142 HD2 LYS 312 HD2 LYS 312 19.980 7.757 14.877
143 HD3 LYS 312 HD3 LYS 312 20.973 9.228 14.838
144 HE2 LYS 312 HE2 LYS 312 19.819 9.896 12.718
145 HE3 LYS 312 HE3 LYS 312 18.764 8.483 12.882
146 HZ1 LYS 312 HZ1 LYS 312 18.885 10.840 14.639
147 HZ2 LYS 312 HZ2 LYS 312 18.121 9.446 15.081
148 HZ3 LYS 312 HZ3 LYS 312 17.601 10.277 13.754
149 H GLU 313 H GLU 313 22.380 5.175 10.609
150 HA GLU 313 HA GLU 313 24.654 6.864 10.143
151 HB2 GLU 313 HB2 GLU 313 24.000 4.016 10.183
152 HB3 GLU 313 HB3 GLU 313 25.186 4.410 8.941
153 HG2 GLU 313 HG2 GLU 313 26.400 3.838 10.924
154 HG3 GLU 313 HG3 GLU 313 26.565 5.580 10.678
155 H LEU 314 H LEU 314 22.142 5.648 7.983
156 HA LEU 314 HA LEU 314 23.617 6.286 5.549
157 HB2 LEU 314 HB2 LEU 314 20.787 5.516 6.211
158 HB3 LEU 314 HB3 LEU 314 21.136 6.207 4.632
159 HG LEU 314 HG LEU 314 22.530 3.742 5.721
160 HD11 LEU 314 HD11 LEU 314 20.112 3.351 5.445
161 HD12 LEU 314 HD12 LEU 314 21.053 2.464 4.231
162 HD13 LEU 314 HD13 LEU 314 20.202 3.957 3.772
163 HD21 LEU 314 HD21 LEU 314 23.114 3.392 3.312
164 HD22 LEU 314 HD22 LEU 314 23.838 4.864 3.985
165 HD23 LEU 314 HD23 LEU 314 22.405 4.980 2.935
166 H GLY 315 H GLY 315 22.691 8.270 7.920
167 HA2 GLY 315 HA2 GLY 315 23.006 10.599 7.683
168 HA3 GLY 315 HA3 GLY 315 22.490 10.502 6.010
169 H GLU 316 H GLU 316 20.462 9.108 8.567
170 HA GLU 316 HA GLU 316 18.238 10.810 7.965
171 HB2 GLU 316 HB2 GLU 316 18.205 8.670 9.332
172 HB3 GLU 316 HB3 GLU 316 18.941 9.571 10.646
173 HG2 GLU 316 HG2 GLU 316 16.962 11.094 10.636
174 HG3 GLU 316 HG3 GLU 316 16.206 10.027 9.443
175 H LEU 317 H LEU 317 21.101 11.167 9.957
176 HA LEU 317 HA LEU 317 20.284 13.471 11.485
177 HB2 LEU 317 HB2 LEU 317 23.044 12.494 10.644
178 HB3 LEU 317 HB3 LEU 317 22.731 13.733 11.864
179 HG LEU 317 HG LEU 317 21.694 10.915 12.154
180 HD11 LEU 317 HD11 LEU 317 24.118 10.980 11.724
181 HD12 LEU 317 HD12 LEU 317 23.746 10.482 13.393
182 HD13 LEU 317 HD13 LEU 317 24.315 12.140 13.057
183 HD21 LEU 317 HD21 LEU 317 20.657 12.550 13.620
184 HD22 LEU 317 HD22 LEU 317 22.234 13.276 13.993
185 HD23 LEU 317 HD23 LEU 317 21.846 11.639 14.581
186 H ARG 318 H ARG 318 21.324 13.036 8.198
187 HA ARG 318 HA ARG 318 21.914 15.940 7.843
188 HB2 ARG 318 HB2 ARG 318 22.045 13.675 5.815
189 HB3 ARG 318 HB3 ARG 318 22.713 15.298 5.644
190 HG2 ARG 318 HG2 ARG 318 24.261 14.736 7.600
191 HG3 ARG 318 HG3 ARG 318 23.698 13.060 7.447
192 HD2 ARG 318 HD2 ARG 318 25.098 14.712 5.306
193 HD3 ARG 318 HD3 ARG 318 25.808 13.367 6.211
194 HE ARG 318 HE ARG 318 23.842 13.245 3.988
195 HH11 ARG 318 HH11 ARG 318 25.673 11.377 6.396
196 HH12 ARG 318 HH12 ARG 318 25.336 9.865 5.596
197 HH21 ARG 318 HH21 ARG 318 23.480 11.298 3.039
198 HH22 ARG 318 HH22 ARG 318 24.111 9.818 3.741
199 H LYS 319 H LYS 319 19.307 14.066 8.110
200 HA LYS 319 HA LYS 319 17.132 14.172 7.510
201 HB2 LYS 319 HB2 LYS 319 17.777 16.740 7.377
202 HB3 LYS 319 HB3 LYS 319 17.523 16.479 5.647
203 HG2 LYS 319 HG2 LYS 319 15.264 15.346 6.556
204 HG3 LYS 319 HG3 LYS 319 15.560 16.458 7.904
205 HD2 LYS 319 HD2 LYS 319 15.423 17.223 4.960
206 HD3 LYS 319 HD3 LYS 319 14.117 17.453 6.137
207 HE2 LYS 319 HE2 LYS 319 15.588 18.954 7.466
208 HE3 LYS 319 HE3 LYS 319 16.881 18.738 6.266
209 HZ1 LYS 319 HZ1 LYS 319 14.223 19.915 5.713
210 HZ2 LYS 319 HZ2 LYS 319 15.425 19.704 4.603
211 HZ3 LYS 319 HZ3 LYS 319 15.636 20.756 5.857
212 H GLU 320 H GLU 320 19.294 12.833 5.897
213 HA GLU 320 HA GLU 320 17.915 12.630 3.268
214 HB2 GLU 320 HB2 GLU 320 20.627 11.717 4.268
215 HB3 GLU 320 HB3 GLU 320 19.974 11.291 2.679
216 HG2 GLU 320 HG2 GLU 320 19.946 13.602 1.985
217 HG3 GLU 320 HG3 GLU 320 20.326 14.158 3.622
218 HA PRO 321 HA PRO 321 16.412 8.896 5.268
219 HB2 PRO 321 HB2 PRO 321 14.392 8.232 3.610
220 HB3 PRO 321 HB3 PRO 321 14.285 9.705 4.633
221 HG2 PRO 321 HG2 PRO 321 15.097 9.454 1.741
222 HG3 PRO 321 HG3 PRO 321 13.896 10.560 2.478
223 HD2 PRO 321 HD2 PRO 321 16.493 11.289 1.940
224 HD3 PRO 321 HD3 PRO 321 15.545 11.984 3.302
225 H SER 322 H SER 322 16.183 6.574 4.707
226 HA SER 322 HA SER 322 18.104 5.684 2.682
227 HB2 SER 322 HB2 SER 322 17.790 4.459 4.843
228 HB3 SER 322 HB3 SER 322 16.111 4.110 4.379
229 HG SER 322 HG SER 322 17.575 2.393 3.877
230 H LEU 323 H LEU 323 17.497 4.746 0.678
231 HA LEU 323 HA LEU 323 14.606 4.803 -0.042
232 HB2 LEU 323 HB2 LEU 323 16.899 6.040 -1.622
233 HB3 LEU 323 HB3 LEU 323 15.248 5.853 -2.205
234 HG LEU 323 HG LEU 323 15.981 7.588 0.159
235 HD11 LEU 323 HD11 LEU 323 15.593 8.213 -2.780
236 HD12 LEU 323 HD12 LEU 323 17.151 8.150 -1.929
237 HD13 LEU 323 HD13 LEU 323 15.950 9.388 -1.484
238 HD21 LEU 323 HD21 LEU 323 13.544 7.242 -1.616
239 HD22 LEU 323 HD22 LEU 323 13.767 8.616 -0.500
240 HD23 LEU 323 HD23 LEU 323 13.651 6.962 0.136
Start of MODEL 7
1 H1 THR 298 H1 THR 298 12.185 -7.024 10.917
2 H2 THR 298 H2 THR 298 13.177 -7.140 12.234
3 H3 THR 298 H3 THR 298 13.815 -6.919 10.729
4 HA THR 298 HA THR 298 12.334 -9.297 11.611
5 HB THR 298 HB THR 298 13.908 -8.887 9.037
6 HG1 THR 298 HG1 THR 298 12.214 -7.600 8.695
7 HG21 THR 298 HG21 THR 298 13.599 -11.248 9.695
8 HG22 THR 298 HG22 THR 298 12.591 -10.851 8.293
9 HG23 THR 298 HG23 THR 298 11.851 -10.969 9.901
10 H ASN 299 H ASN 299 13.500 -10.716 12.760
11 HA ASN 299 HA ASN 299 16.077 -10.166 13.696
12 HB2 ASN 299 HB2 ASN 299 14.639 -12.838 13.479
13 HB3 ASN 299 HB3 ASN 299 16.086 -12.543 14.453
14 HD21 ASN 299 HD21 ASN 299 15.537 -12.490 16.529
15 HD22 ASN 299 HD22 ASN 299 14.145 -11.664 17.186
16 H ARG 300 H ARG 300 15.210 -11.736 10.710
17 HA ARG 300 HA ARG 300 17.518 -13.276 10.224
18 HB2 ARG 300 HB2 ARG 300 15.314 -13.066 8.900
19 HB3 ARG 300 HB3 ARG 300 16.062 -11.692 8.078
20 HG2 ARG 300 HG2 ARG 300 17.600 -14.262 8.188
21 HG3 ARG 300 HG3 ARG 300 16.160 -14.215 7.160
22 HD2 ARG 300 HD2 ARG 300 17.085 -12.207 6.001
23 HD3 ARG 300 HD3 ARG 300 18.565 -12.365 6.973
24 HE ARG 300 HE ARG 300 17.985 -14.853 5.690
25 HH11 ARG 300 HH11 ARG 300 19.219 -11.643 4.899
26 HH12 ARG 300 HH12 ARG 300 20.109 -12.225 3.518
27 HH21 ARG 300 HH21 ARG 300 19.153 -15.523 3.924
28 HH22 ARG 300 HH22 ARG 300 20.067 -14.381 2.977
29 H ARG 301 H ARG 301 17.027 -9.765 9.840
30 HA ARG 301 HA ARG 301 19.909 -9.514 9.067
31 HB2 ARG 301 HB2 ARG 301 17.639 -7.540 8.758
32 HB3 ARG 301 HB3 ARG 301 19.287 -7.353 8.189
33 HG2 ARG 301 HG2 ARG 301 18.806 -9.471 6.756
34 HG3 ARG 301 HG3 ARG 301 17.100 -9.090 7.093
35 HD2 ARG 301 HD2 ARG 301 19.176 -7.390 5.696
36 HD3 ARG 301 HD3 ARG 301 17.629 -7.971 5.047
37 HE ARG 301 HE ARG 301 16.550 -6.473 6.835
38 HH11 ARG 301 HH11 ARG 301 19.718 -5.627 5.431
39 HH12 ARG 301 HH12 ARG 301 19.517 -3.930 5.833
40 HH21 ARG 301 HH21 ARG 301 16.410 -4.315 7.253
41 HH22 ARG 301 HH22 ARG 301 17.723 -3.211 6.809
42 H LYS 302 H LYS 302 18.342 -9.739 11.751
43 HA LYS 302 HA LYS 302 18.355 -8.858 13.850
44 HB2 LYS 302 HB2 LYS 302 20.769 -7.243 12.970
45 HB3 LYS 302 HB3 LYS 302 20.289 -7.617 14.626
46 HG2 LYS 302 HG2 LYS 302 20.681 -10.023 14.201
47 HG3 LYS 302 HG3 LYS 302 21.173 -9.645 12.536
48 HD2 LYS 302 HD2 LYS 302 22.997 -8.212 13.416
49 HD3 LYS 302 HD3 LYS 302 22.535 -8.664 15.071
50 HE2 LYS 302 HE2 LYS 302 22.976 -11.043 14.540
51 HE3 LYS 302 HE3 LYS 302 23.432 -10.591 12.885
52 HZ1 LYS 302 HZ1 LYS 302 25.374 -10.852 14.299
53 HZ2 LYS 302 HZ2 LYS 302 24.829 -9.702 15.349
54 HZ3 LYS 302 HZ3 LYS 302 25.251 -9.281 13.810
55 H SEP 303 H SEP 303 17.038 -7.394 11.531
56 HA SEP 303 HA SEP 303 17.204 -4.552 12.236
57 HB2 SEP 303 HB2 SEP 303 16.420 -4.146 10.130
58 HB3 SEP 303 HB3 SEP 303 16.993 -5.805 9.851
59 H GLY 304 H GLY 304 14.726 -3.486 11.879
60 HA2 GLY 304 HA2 GLY 304 12.861 -3.132 13.369
61 HA3 GLY 304 HA3 GLY 304 13.515 -4.379 14.459
62 H LYS 305 H LYS 305 15.181 -3.849 15.909
63 HA LYS 305 HA LYS 305 15.394 -1.098 16.694
64 HB2 LYS 305 HB2 LYS 305 17.187 -3.494 17.262
65 HB3 LYS 305 HB3 LYS 305 17.399 -1.920 18.030
66 HG2 LYS 305 HG2 LYS 305 14.851 -3.570 18.269
67 HG3 LYS 305 HG3 LYS 305 16.200 -3.656 19.412
68 HD2 LYS 305 HD2 LYS 305 15.958 -1.192 19.827
69 HD3 LYS 305 HD3 LYS 305 14.495 -1.206 18.817
70 HE2 LYS 305 HE2 LYS 305 13.464 -2.876 20.333
71 HE3 LYS 305 HE3 LYS 305 14.932 -2.884 21.328
72 HZ1 LYS 305 HZ1 LYS 305 14.533 -0.546 21.833
73 HZ2 LYS 305 HZ2 LYS 305 13.233 -1.459 22.277
74 HZ3 LYS 305 HZ3 LYS 305 13.165 -0.537 20.911
75 H TYR 306 H TYR 306 17.604 -3.233 14.849
76 HA TYR 306 HA TYR 306 19.585 -1.209 14.411
77 HB2 TYR 306 HB2 TYR 306 20.318 -3.420 14.127
78 HB3 TYR 306 HB3 TYR 306 18.919 -3.854 13.147
79 HD1 TYR 306 HD1 TYR 306 22.005 -1.696 13.037
80 HD2 TYR 306 HD2 TYR 306 19.047 -3.884 10.796
81 HE1 TYR 306 HE1 TYR 306 23.249 -1.238 10.918
82 HE2 TYR 306 HE2 TYR 306 20.293 -3.415 8.699
83 HH TYR 306 HH TYR 306 22.009 -2.270 7.733
84 H LYS 307 H LYS 307 16.494 -1.840 12.774
85 HA LYS 307 HA LYS 307 17.275 -0.762 10.262
86 HB2 LYS 307 HB2 LYS 307 15.163 -2.065 10.826
87 HB3 LYS 307 HB3 LYS 307 14.462 -0.519 11.343
88 HG2 LYS 307 HG2 LYS 307 14.765 0.411 9.129
89 HG3 LYS 307 HG3 LYS 307 15.765 -0.964 8.654
90 HD2 LYS 307 HD2 LYS 307 13.729 -2.436 9.008
91 HD3 LYS 307 HD3 LYS 307 12.784 -0.941 9.154
92 HE2 LYS 307 HE2 LYS 307 12.681 -1.733 6.847
93 HE3 LYS 307 HE3 LYS 307 13.643 -0.238 6.898
94 HZ1 LYS 307 HZ1 LYS 307 15.653 -1.570 6.810
95 HZ2 LYS 307 HZ2 LYS 307 14.677 -2.011 5.552
96 HZ3 LYS 307 HZ3 LYS 307 14.787 -2.983 6.889
97 H LYS 308 H LYS 308 16.341 0.951 13.243
98 HA LYS 308 HA LYS 308 16.055 3.456 11.814
99 HB2 LYS 308 HB2 LYS 308 15.002 3.134 14.010
100 HB3 LYS 308 HB3 LYS 308 16.583 2.909 14.760
101 HG2 LYS 308 HG2 LYS 308 15.539 5.199 15.107
102 HG3 LYS 308 HG3 LYS 308 17.183 5.197 14.467
103 HD2 LYS 308 HD2 LYS 308 15.974 6.885 13.277
104 HD3 LYS 308 HD3 LYS 308 16.246 5.559 12.156
105 HE2 LYS 308 HE2 LYS 308 13.902 4.770 12.589
106 HE3 LYS 308 HE3 LYS 308 13.656 6.228 13.584
107 HZ1 LYS 308 HZ1 LYS 308 12.938 6.729 11.376
108 HZ2 LYS 308 HZ2 LYS 308 14.314 6.133 10.691
109 HZ3 LYS 308 HZ3 LYS 308 14.379 7.523 11.569
110 H VAL 309 H VAL 309 18.733 1.727 13.425
111 HA VAL 309 HA VAL 309 20.645 3.856 13.167
112 HB VAL 309 HB VAL 309 21.034 0.829 13.346
113 HG11 VAL 309 HG11 VAL 309 23.053 1.860 12.410
114 HG12 VAL 309 HG12 VAL 309 23.054 3.080 13.704
115 HG13 VAL 309 HG13 VAL 309 23.343 1.367 14.088
116 HG21 VAL 309 HG21 VAL 309 21.568 1.348 15.724
117 HG22 VAL 309 HG22 VAL 309 21.141 3.048 15.422
118 HG23 VAL 309 HG23 VAL 309 19.898 1.776 15.302
119 H GLU 310 H GLU 310 19.616 1.187 11.074
120 HA GLU 310 HA GLU 310 21.526 1.341 9.033
121 HB2 GLU 310 HB2 GLU 310 19.677 -0.330 9.336
122 HB3 GLU 310 HB3 GLU 310 18.532 0.870 8.758
123 HG2 GLU 310 HG2 GLU 310 19.491 0.855 6.566
124 HG3 GLU 310 HG3 GLU 310 20.853 -0.139 7.119
125 H ILE 311 H ILE 311 18.568 3.310 9.476
126 HA ILE 311 HA ILE 311 19.185 4.926 7.100
127 HB ILE 311 HB ILE 311 17.035 5.232 9.259
128 HG12 ILE 311 HG12 ILE 311 16.859 4.236 6.383
129 HG13 ILE 311 HG13 ILE 311 16.920 3.179 7.794
130 HG21 ILE 311 HG21 ILE 311 17.525 7.430 8.174
131 HG22 ILE 311 HG22 ILE 311 17.332 6.692 6.570
132 HG23 ILE 311 HG23 ILE 311 15.941 6.835 7.667
133 HD11 ILE 311 HD11 ILE 311 14.632 3.330 7.101
134 HD12 ILE 311 HD12 ILE 311 14.782 4.250 8.615
135 HD13 ILE 311 HD13 ILE 311 14.688 5.103 7.050
136 H LYS 312 H LYS 312 19.629 5.121 10.611
137 HA LYS 312 HA LYS 312 19.987 7.916 10.746
138 HB2 LYS 312 HB2 LYS 312 19.489 6.508 12.672
139 HB3 LYS 312 HB3 LYS 312 21.119 5.824 12.585
140 HG2 LYS 312 HG2 LYS 312 22.100 8.013 13.012
141 HG3 LYS 312 HG3 LYS 312 20.502 8.763 13.017
142 HD2 LYS 312 HD2 LYS 312 21.406 6.601 14.957
143 HD3 LYS 312 HD3 LYS 312 21.486 8.339 15.289
144 HE2 LYS 312 HE2 LYS 312 18.958 6.732 14.746
145 HE3 LYS 312 HE3 LYS 312 19.485 7.373 16.312
146 HZ1 LYS 312 HZ1 LYS 312 19.368 9.623 15.200
147 HZ2 LYS 312 HZ2 LYS 312 17.915 8.887 15.453
148 HZ3 LYS 312 HZ3 LYS 312 18.572 8.900 13.942
149 H GLU 313 H GLU 313 22.476 5.372 10.595
150 HA GLU 313 HA GLU 313 24.600 7.339 10.599
151 HB2 GLU 313 HB2 GLU 313 24.789 4.505 9.557
152 HB3 GLU 313 HB3 GLU 313 26.085 5.534 10.176
153 HG2 GLU 313 HG2 GLU 313 23.928 4.066 11.682
154 HG3 GLU 313 HG3 GLU 313 25.671 4.023 11.935
155 H LEU 314 H LEU 314 22.437 6.098 8.249
156 HA LEU 314 HA LEU 314 24.007 6.855 5.918
157 HB2 LEU 314 HB2 LEU 314 21.534 5.446 6.480
158 HB3 LEU 314 HB3 LEU 314 21.304 6.590 5.181
159 HG LEU 314 HG LEU 314 21.846 4.383 4.321
160 HD11 LEU 314 HD11 LEU 314 24.229 6.219 3.845
161 HD12 LEU 314 HD12 LEU 314 22.631 6.453 3.107
162 HD13 LEU 314 HD13 LEU 314 23.565 4.988 2.749
163 HD21 LEU 314 HD21 LEU 314 24.542 4.636 5.717
164 HD22 LEU 314 HD22 LEU 314 24.006 3.313 4.658
165 HD23 LEU 314 HD23 LEU 314 23.214 3.568 6.227
166 H GLY 315 H GLY 315 23.325 8.847 8.080
167 HA2 GLY 315 HA2 GLY 315 23.484 11.165 7.674
168 HA3 GLY 315 HA3 GLY 315 22.648 10.972 6.152
169 H GLU 316 H GLU 316 20.792 9.468 8.637
170 HA GLU 316 HA GLU 316 18.778 11.535 8.570
171 HB2 GLU 316 HB2 GLU 316 18.554 9.088 9.372
172 HB3 GLU 316 HB3 GLU 316 19.272 9.661 10.882
173 HG2 GLU 316 HG2 GLU 316 17.392 11.308 11.063
174 HG3 GLU 316 HG3 GLU 316 16.634 10.493 9.685
175 H LEU 317 H LEU 317 21.722 11.028 10.366
176 HA LEU 317 HA LEU 317 21.350 12.811 12.567
177 HB2 LEU 317 HB2 LEU 317 23.856 12.044 11.012
178 HB3 LEU 317 HB3 LEU 317 23.857 12.872 12.571
179 HG LEU 317 HG LEU 317 22.594 10.159 12.260
180 HD11 LEU 317 HD11 LEU 317 25.481 10.857 12.871
181 HD12 LEU 317 HD12 LEU 317 24.889 10.196 11.330
182 HD13 LEU 317 HD13 LEU 317 24.771 9.221 12.816
183 HD21 LEU 317 HD21 LEU 317 23.781 11.810 14.513
184 HD22 LEU 317 HD22 LEU 317 23.317 10.096 14.685
185 HD23 LEU 317 HD23 LEU 317 22.083 11.324 14.316
186 H ARG 318 H ARG 318 21.809 13.457 9.186
187 HA ARG 318 HA ARG 318 22.346 16.352 9.788
188 HB2 ARG 318 HB2 ARG 318 22.817 14.757 7.234
189 HB3 ARG 318 HB3 ARG 318 23.157 16.471 7.447
190 HG2 ARG 318 HG2 ARG 318 24.549 14.279 9.041
191 HG3 ARG 318 HG3 ARG 318 25.162 14.947 7.524
192 HD2 ARG 318 HD2 ARG 318 26.313 16.126 9.219
193 HD3 ARG 318 HD3 ARG 318 25.075 17.247 8.622
194 HE ARG 318 HE ARG 318 24.050 15.762 10.847
195 HH11 ARG 318 HH11 ARG 318 26.317 18.385 10.186
196 HH12 ARG 318 HH12 ARG 318 26.090 19.094 11.763
197 HH21 ARG 318 HH21 ARG 318 23.789 16.707 12.794
198 HH22 ARG 318 HH22 ARG 318 24.680 18.147 13.229
199 H LYS 319 H LYS 319 19.926 14.297 9.262
200 HA LYS 319 HA LYS 319 17.811 14.376 8.431
201 HB2 LYS 319 HB2 LYS 319 18.269 17.354 8.049
202 HB3 LYS 319 HB3 LYS 319 16.730 16.534 7.895
203 HG2 LYS 319 HG2 LYS 319 18.385 16.717 10.446
204 HG3 LYS 319 HG3 LYS 319 16.971 17.699 10.061
205 HD2 LYS 319 HD2 LYS 319 17.008 14.673 10.490
206 HD3 LYS 319 HD3 LYS 319 16.369 15.884 11.604
207 HE2 LYS 319 HE2 LYS 319 15.276 15.181 8.842
208 HE3 LYS 319 HE3 LYS 319 14.527 14.813 10.404
209 HZ1 LYS 319 HZ1 LYS 319 14.269 17.202 10.762
210 HZ2 LYS 319 HZ2 LYS 319 13.520 16.746 9.364
211 HZ3 LYS 319 HZ3 LYS 319 14.967 17.533 9.304
212 H GLU 320 H GLU 320 20.214 13.964 6.818
213 HA GLU 320 HA GLU 320 18.996 14.328 4.107
214 HB2 GLU 320 HB2 GLU 320 21.931 14.324 4.940
215 HB3 GLU 320 HB3 GLU 320 21.352 14.348 3.267
216 HG2 GLU 320 HG2 GLU 320 20.366 16.547 3.588
217 HG3 GLU 320 HG3 GLU 320 20.756 16.515 5.311
218 HA PRO 321 HA PRO 321 19.780 9.949 5.473
219 HB2 PRO 321 HB2 PRO 321 17.325 8.848 5.238
220 HB3 PRO 321 HB3 PRO 321 17.728 9.910 6.627
221 HG2 PRO 321 HG2 PRO 321 16.341 10.610 4.049
222 HG3 PRO 321 HG3 PRO 321 15.800 10.911 5.732
223 HD2 PRO 321 HD2 PRO 321 17.090 12.803 4.260
224 HD3 PRO 321 HD3 PRO 321 17.327 12.650 6.035
225 H SER 322 H SER 322 19.318 7.815 4.292
226 HA SER 322 HA SER 322 20.080 8.016 1.559
227 HB2 SER 322 HB2 SER 322 20.458 6.035 3.041
228 HB3 SER 322 HB3 SER 322 18.723 5.689 2.979
229 HG SER 322 HG SER 322 18.982 5.522 0.661
230 H LEU 323 H LEU 323 18.950 7.733 -0.347
231 HA LEU 323 HA LEU 323 15.979 7.585 -0.250
232 HB2 LEU 323 HB2 LEU 323 16.713 9.983 -0.423
233 HB3 LEU 323 HB3 LEU 323 17.644 9.571 -1.863
234 HG LEU 323 HG LEU 323 14.704 9.025 -1.885
235 HD11 LEU 323 HD11 LEU 323 15.058 11.217 -0.788
236 HD12 LEU 323 HD12 LEU 323 14.297 11.380 -2.389
237 HD13 LEU 323 HD13 LEU 323 16.030 11.743 -2.177
238 HD21 LEU 323 HD21 LEU 323 15.081 9.881 -4.241
239 HD22 LEU 323 HD22 LEU 323 15.998 8.415 -3.837
240 HD23 LEU 323 HD23 LEU 323 16.819 9.989 -3.846
Start of MODEL 8
1 H1 THR 298 H1 THR 298 12.927 -13.711 22.271
2 H2 THR 298 H2 THR 298 12.563 -15.025 21.340
3 H3 THR 298 H3 THR 298 14.068 -14.358 21.271
4 HA THR 298 HA THR 298 11.578 -13.032 20.409
5 HB THR 298 HB THR 298 13.120 -11.312 19.472
6 HG1 THR 298 HG1 THR 298 15.337 -11.449 20.365
7 HG21 THR 298 HG21 THR 298 13.725 -11.724 22.430
8 HG22 THR 298 HG22 THR 298 12.187 -11.059 21.816
9 HG23 THR 298 HG23 THR 298 13.711 -10.199 21.522
10 H ASN 299 H ASN 299 11.888 -12.436 17.939
11 HA ASN 299 HA ASN 299 12.177 -14.981 16.592
12 HB2 ASN 299 HB2 ASN 299 11.378 -13.825 14.647
13 HB3 ASN 299 HB3 ASN 299 10.457 -13.250 16.043
14 HD21 ASN 299 HD21 ASN 299 10.327 -11.739 13.874
15 HD22 ASN 299 HD22 ASN 299 11.278 -10.284 14.052
16 H ARG 300 H ARG 300 14.607 -12.926 17.491
17 HA ARG 300 HA ARG 300 16.747 -12.591 16.903
18 HB2 ARG 300 HB2 ARG 300 16.472 -15.105 15.275
19 HB3 ARG 300 HB3 ARG 300 17.923 -14.369 15.956
20 HG2 ARG 300 HG2 ARG 300 16.696 -14.608 18.240
21 HG3 ARG 300 HG3 ARG 300 15.726 -15.827 17.382
22 HD2 ARG 300 HD2 ARG 300 18.747 -15.765 17.497
23 HD3 ARG 300 HD3 ARG 300 17.725 -16.726 18.587
24 HE ARG 300 HE ARG 300 17.036 -17.319 15.881
25 HH11 ARG 300 HH11 ARG 300 19.648 -17.945 18.179
26 HH12 ARG 300 HH12 ARG 300 20.094 -19.440 17.401
27 HH21 ARG 300 HH21 ARG 300 17.673 -19.232 14.942
28 HH22 ARG 300 HH22 ARG 300 18.998 -20.149 15.603
29 H ARG 301 H ARG 301 14.568 -11.606 14.891
30 HA ARG 301 HA ARG 301 15.931 -11.539 12.321
31 HB2 ARG 301 HB2 ARG 301 13.493 -11.303 12.555
32 HB3 ARG 301 HB3 ARG 301 13.709 -9.840 13.516
33 HG2 ARG 301 HG2 ARG 301 13.050 -9.132 11.366
34 HG3 ARG 301 HG3 ARG 301 14.764 -8.757 11.507
35 HD2 ARG 301 HD2 ARG 301 15.325 -10.742 10.157
36 HD3 ARG 301 HD3 ARG 301 13.586 -11.120 10.013
37 HE ARG 301 HE ARG 301 13.931 -8.410 9.250
38 HH11 ARG 301 HH11 ARG 301 14.822 -11.588 7.938
39 HH12 ARG 301 HH12 ARG 301 14.889 -10.971 6.311
40 HH21 ARG 301 HH21 ARG 301 14.078 -7.721 7.235
41 HH22 ARG 301 HH22 ARG 301 14.441 -8.808 5.905
42 H LYS 302 H LYS 302 15.894 -9.566 15.190
43 HA LYS 302 HA LYS 302 17.271 -7.948 16.015
44 HB2 LYS 302 HB2 LYS 302 18.882 -7.947 13.470
45 HB3 LYS 302 HB3 LYS 302 19.375 -7.361 15.044
46 HG2 LYS 302 HG2 LYS 302 19.634 -9.567 15.911
47 HG3 LYS 302 HG3 LYS 302 18.794 -10.301 14.537
48 HD2 LYS 302 HD2 LYS 302 21.287 -8.690 14.010
49 HD3 LYS 302 HD3 LYS 302 21.434 -10.322 14.675
50 HE2 LYS 302 HE2 LYS 302 21.612 -10.589 12.320
51 HE3 LYS 302 HE3 LYS 302 19.997 -11.165 12.750
52 HZ1 LYS 302 HZ1 LYS 302 19.064 -9.131 11.888
53 HZ2 LYS 302 HZ2 LYS 302 20.046 -9.778 10.731
54 HZ3 LYS 302 HZ3 LYS 302 20.559 -8.480 11.608
55 H SEP 303 H SEP 303 15.332 -7.568 13.404
56 HA SEP 303 HA SEP 303 16.028 -5.001 12.389
57 HB2 SEP 303 HB2 SEP 303 13.723 -6.875 12.163
58 HB3 SEP 303 HB3 SEP 303 13.414 -5.179 11.748
59 H GLY 304 H GLY 304 14.385 -3.160 12.325
60 HA2 GLY 304 HA2 GLY 304 13.120 -1.542 13.429
61 HA3 GLY 304 HA3 GLY 304 13.002 -2.598 14.854
62 H LYS 305 H LYS 305 15.037 -2.891 16.140
63 HA LYS 305 HA LYS 305 16.096 -0.302 16.821
64 HB2 LYS 305 HB2 LYS 305 15.959 -2.155 18.456
65 HB3 LYS 305 HB3 LYS 305 17.128 -3.086 17.516
66 HG2 LYS 305 HG2 LYS 305 18.266 -2.125 19.420
67 HG3 LYS 305 HG3 LYS 305 18.855 -1.328 17.956
68 HD2 LYS 305 HD2 LYS 305 17.290 0.583 18.409
69 HD3 LYS 305 HD3 LYS 305 16.817 -0.203 19.928
70 HE2 LYS 305 HE2 LYS 305 19.636 0.694 19.174
71 HE3 LYS 305 HE3 LYS 305 18.534 1.573 20.246
72 HZ1 LYS 305 HZ1 LYS 305 19.631 -1.130 20.773
73 HZ2 LYS 305 HZ2 LYS 305 18.599 -0.311 21.767
74 HZ3 LYS 305 HZ3 LYS 305 20.121 0.266 21.499
75 H TYR 306 H TYR 306 17.528 -3.114 15.080
76 HA TYR 306 HA TYR 306 19.927 -1.592 14.447
77 HB2 TYR 306 HB2 TYR 306 19.895 -4.074 14.594
78 HB3 TYR 306 HB3 TYR 306 18.839 -4.121 13.170
79 HD1 TYR 306 HD1 TYR 306 22.253 -3.127 14.354
80 HD2 TYR 306 HD2 TYR 306 19.724 -3.890 10.949
81 HE1 TYR 306 HE1 TYR 306 24.237 -3.025 12.837
82 HE2 TYR 306 HE2 TYR 306 21.709 -3.764 9.457
83 HH TYR 306 HH TYR 306 23.925 -2.977 9.343
84 H LYS 307 H LYS 307 16.821 -2.287 12.857
85 HA LYS 307 HA LYS 307 17.539 -1.489 10.260
86 HB2 LYS 307 HB2 LYS 307 15.380 -2.587 11.014
87 HB3 LYS 307 HB3 LYS 307 14.828 -0.978 11.491
88 HG2 LYS 307 HG2 LYS 307 13.926 -1.447 9.336
89 HG3 LYS 307 HG3 LYS 307 15.206 -0.243 9.090
90 HD2 LYS 307 HD2 LYS 307 16.664 -1.816 8.113
91 HD3 LYS 307 HD3 LYS 307 15.850 -3.183 8.901
92 HE2 LYS 307 HE2 LYS 307 13.799 -2.546 7.465
93 HE3 LYS 307 HE3 LYS 307 14.961 -1.624 6.475
94 HZ1 LYS 307 HZ1 LYS 307 14.687 -3.908 5.698
95 HZ2 LYS 307 HZ2 LYS 307 15.150 -4.513 7.167
96 HZ3 LYS 307 HZ3 LYS 307 16.231 -3.679 6.229
97 H LYS 308 H LYS 308 16.251 0.499 12.969
98 HA LYS 308 HA LYS 308 16.457 2.891 11.318
99 HB2 LYS 308 HB2 LYS 308 15.986 2.544 14.296
100 HB3 LYS 308 HB3 LYS 308 16.068 4.108 13.488
101 HG2 LYS 308 HG2 LYS 308 13.977 1.940 13.089
102 HG3 LYS 308 HG3 LYS 308 13.749 3.551 13.768
103 HD2 LYS 308 HD2 LYS 308 14.322 2.836 10.855
104 HD3 LYS 308 HD3 LYS 308 12.822 3.483 11.509
105 HE2 LYS 308 HE2 LYS 308 15.485 4.981 11.381
106 HE3 LYS 308 HE3 LYS 308 14.145 5.178 10.251
107 HZ1 LYS 308 HZ1 LYS 308 14.042 5.824 13.129
108 HZ2 LYS 308 HZ2 LYS 308 12.806 6.030 12.053
109 HZ3 LYS 308 HZ3 LYS 308 14.194 6.913 11.898
110 H VAL 309 H VAL 309 18.735 1.145 13.331
111 HA VAL 309 HA VAL 309 20.473 3.415 13.739
112 HB VAL 309 HB VAL 309 20.700 0.460 14.050
113 HG11 VAL 309 HG11 VAL 309 23.178 2.155 13.471
114 HG12 VAL 309 HG12 VAL 309 23.213 0.556 14.250
115 HG13 VAL 309 HG13 VAL 309 22.637 0.707 12.584
116 HG21 VAL 309 HG21 VAL 309 21.819 2.840 15.551
117 HG22 VAL 309 HG22 VAL 309 20.270 2.023 15.896
118 HG23 VAL 309 HG23 VAL 309 21.804 1.150 16.124
119 H GLU 310 H GLU 310 20.167 0.895 11.218
120 HA GLU 310 HA GLU 310 22.305 1.806 9.609
121 HB2 GLU 310 HB2 GLU 310 20.469 -0.222 9.459
122 HB3 GLU 310 HB3 GLU 310 19.843 0.864 8.217
123 HG2 GLU 310 HG2 GLU 310 21.255 -0.473 6.984
124 HG3 GLU 310 HG3 GLU 310 22.323 0.890 7.359
125 H ILE 311 H ILE 311 18.804 2.665 9.495
126 HA ILE 311 HA ILE 311 19.114 4.566 7.396
127 HB ILE 311 HB ILE 311 16.930 4.292 9.503
128 HG12 ILE 311 HG12 ILE 311 17.083 3.439 6.575
129 HG13 ILE 311 HG13 ILE 311 17.353 2.353 7.933
130 HG21 ILE 311 HG21 ILE 311 16.945 5.916 6.901
131 HG22 ILE 311 HG22 ILE 311 15.519 5.645 7.928
132 HG23 ILE 311 HG23 ILE 311 16.878 6.579 8.550
133 HD11 ILE 311 HD11 ILE 311 14.990 2.809 8.692
134 HD12 ILE 311 HD12 ILE 311 14.749 3.714 7.175
135 HD13 ILE 311 HD13 ILE 311 15.132 1.982 7.126
136 H LYS 312 H LYS 312 19.447 4.981 10.938
137 HA LYS 312 HA LYS 312 19.500 7.838 10.949
138 HB2 LYS 312 HB2 LYS 312 20.751 5.732 12.677
139 HB3 LYS 312 HB3 LYS 312 21.222 7.416 12.858
140 HG2 LYS 312 HG2 LYS 312 18.752 7.944 13.188
141 HG3 LYS 312 HG3 LYS 312 18.527 6.201 13.393
142 HD2 LYS 312 HD2 LYS 312 20.330 8.022 15.049
143 HD3 LYS 312 HD3 LYS 312 18.834 7.244 15.579
144 HE2 LYS 312 HE2 LYS 312 20.337 5.760 16.489
145 HE3 LYS 312 HE3 LYS 312 20.174 5.023 14.888
146 HZ1 LYS 312 HZ1 LYS 312 22.385 6.799 15.791
147 HZ2 LYS 312 HZ2 LYS 312 22.220 6.284 14.237
148 HZ3 LYS 312 HZ3 LYS 312 22.500 5.195 15.426
149 H GLU 313 H GLU 313 22.118 5.444 10.757
150 HA GLU 313 HA GLU 313 24.147 7.465 10.380
151 HB2 GLU 313 HB2 GLU 313 23.970 4.479 10.259
152 HB3 GLU 313 HB3 GLU 313 25.385 5.271 9.554
153 HG2 GLU 313 HG2 GLU 313 25.843 4.620 11.889
154 HG3 GLU 313 HG3 GLU 313 25.897 6.374 11.693
155 H LEU 314 H LEU 314 21.990 5.746 8.210
156 HA LEU 314 HA LEU 314 23.373 6.595 5.768
157 HB2 LEU 314 HB2 LEU 314 20.696 5.325 6.348
158 HB3 LEU 314 HB3 LEU 314 21.123 5.863 4.740
159 HG LEU 314 HG LEU 314 22.769 3.830 6.255
160 HD11 LEU 314 HD11 LEU 314 20.573 3.372 4.186
161 HD12 LEU 314 HD12 LEU 314 20.463 2.996 5.921
162 HD13 LEU 314 HD13 LEU 314 21.622 2.126 4.900
163 HD21 LEU 314 HD21 LEU 314 22.636 4.613 3.313
164 HD22 LEU 314 HD22 LEU 314 23.606 3.281 3.986
165 HD23 LEU 314 HD23 LEU 314 23.972 4.956 4.438
166 H GLY 315 H GLY 315 22.484 8.614 7.849
167 HA2 GLY 315 HA2 GLY 315 22.303 10.888 7.293
168 HA3 GLY 315 HA3 GLY 315 21.465 10.481 5.813
169 H GLU 316 H GLU 316 19.808 8.919 8.427
170 HA GLU 316 HA GLU 316 17.637 10.835 8.263
171 HB2 GLU 316 HB2 GLU 316 17.619 8.394 9.181
172 HB3 GLU 316 HB3 GLU 316 18.140 9.135 10.695
173 HG2 GLU 316 HG2 GLU 316 16.120 10.572 10.653
174 HG3 GLU 316 HG3 GLU 316 15.586 9.729 9.189
175 H LEU 317 H LEU 317 20.555 10.517 10.181
176 HA LEU 317 HA LEU 317 20.010 12.455 12.222
177 HB2 LEU 317 HB2 LEU 317 22.187 10.825 11.330
178 HB3 LEU 317 HB3 LEU 317 22.783 12.482 11.424
179 HG LEU 317 HG LEU 317 21.888 12.527 13.804
180 HD11 LEU 317 HD11 LEU 317 21.743 9.563 13.155
181 HD12 LEU 317 HD12 LEU 317 20.403 10.597 13.701
182 HD13 LEU 317 HD13 LEU 317 21.739 10.225 14.813
183 HD21 LEU 317 HD21 LEU 317 24.222 12.308 13.000
184 HD22 LEU 317 HD22 LEU 317 24.034 10.541 12.983
185 HD23 LEU 317 HD23 LEU 317 23.948 11.432 14.528
186 H ARG 318 H ARG 318 20.577 12.803 8.850
187 HA ARG 318 HA ARG 318 21.280 15.705 9.152
188 HB2 ARG 318 HB2 ARG 318 21.582 13.789 6.801
189 HB3 ARG 318 HB3 ARG 318 22.022 15.493 6.775
190 HG2 ARG 318 HG2 ARG 318 23.303 13.387 8.569
191 HG3 ARG 318 HG3 ARG 318 23.971 13.974 7.040
192 HD2 ARG 318 HD2 ARG 318 23.455 15.656 9.526
193 HD3 ARG 318 HD3 ARG 318 25.037 15.103 8.954
194 HE ARG 318 HE ARG 318 23.409 17.297 7.886
195 HH11 ARG 318 HH11 ARG 318 26.141 15.156 7.208
196 HH12 ARG 318 HH12 ARG 318 26.787 16.223 5.990
197 HH21 ARG 318 HH21 ARG 318 24.289 18.590 6.319
198 HH22 ARG 318 HH22 ARG 318 25.757 18.130 5.500
199 H LYS 319 H LYS 319 18.690 13.813 8.947
200 HA LYS 319 HA LYS 319 16.562 13.953 8.178
201 HB2 LYS 319 HB2 LYS 319 17.250 16.842 7.538
202 HB3 LYS 319 HB3 LYS 319 15.640 16.132 7.465
203 HG2 LYS 319 HG2 LYS 319 15.720 15.630 9.867
204 HG3 LYS 319 HG3 LYS 319 17.352 16.308 9.965
205 HD2 LYS 319 HD2 LYS 319 15.708 17.941 10.756
206 HD3 LYS 319 HD3 LYS 319 16.503 18.523 9.285
207 HE2 LYS 319 HE2 LYS 319 14.073 18.984 9.247
208 HE3 LYS 319 HE3 LYS 319 14.553 17.904 7.928
209 HZ1 LYS 319 HZ1 LYS 319 13.744 16.037 9.231
210 HZ2 LYS 319 HZ2 LYS 319 12.538 17.137 9.000
211 HZ3 LYS 319 HZ3 LYS 319 13.292 17.035 10.465
212 H GLU 320 H GLU 320 18.860 13.283 6.390
213 HA GLU 320 HA GLU 320 17.330 13.396 3.828
214 HB2 GLU 320 HB2 GLU 320 19.335 15.026 3.994
215 HB3 GLU 320 HB3 GLU 320 20.359 13.595 4.030
216 HG2 GLU 320 HG2 GLU 320 20.400 14.102 1.789
217 HG3 GLU 320 HG3 GLU 320 19.036 12.970 1.824
218 HA PRO 321 HA PRO 321 18.793 9.251 5.348
219 HB2 PRO 321 HB2 PRO 321 16.471 7.885 5.561
220 HB3 PRO 321 HB3 PRO 321 16.963 9.075 6.805
221 HG2 PRO 321 HG2 PRO 321 15.106 9.438 4.473
222 HG3 PRO 321 HG3 PRO 321 14.831 9.830 6.200
223 HD2 PRO 321 HD2 PRO 321 15.643 11.694 4.380
224 HD3 PRO 321 HD3 PRO 321 16.167 11.735 6.099
225 H SER 322 H SER 322 18.866 7.157 4.368
226 HA SER 322 HA SER 322 18.144 7.150 1.484
227 HB2 SER 322 HB2 SER 322 20.463 6.521 2.123
228 HB3 SER 322 HB3 SER 322 19.820 5.227 3.150
229 HG SER 322 HG SER 322 19.095 4.144 1.357
230 H LEU 323 H LEU 323 17.137 5.204 0.637
231 HA LEU 323 HA LEU 323 14.995 4.156 2.360
232 HB2 LEU 323 HB2 LEU 323 14.577 4.787 -0.018
233 HB3 LEU 323 HB3 LEU 323 15.780 3.607 -0.540
234 HG LEU 323 HG LEU 323 14.294 1.803 0.371
235 HD11 LEU 323 HD11 LEU 323 11.882 2.518 0.628
236 HD12 LEU 323 HD12 LEU 323 12.459 4.206 0.671
237 HD13 LEU 323 HD13 LEU 323 12.951 3.060 1.939
238 HD21 LEU 323 HD21 LEU 323 14.536 2.554 -1.956
239 HD22 LEU 323 HD22 LEU 323 13.235 3.739 -1.709
240 HD23 LEU 323 HD23 LEU 323 12.879 1.992 -1.617
Start of MODEL 9
1 H1 THR 298 H1 THR 298 18.191 -19.353 15.484
2 H2 THR 298 H2 THR 298 17.955 -17.727 15.333
3 H3 THR 298 H3 THR 298 17.241 -18.769 14.271
4 HA THR 298 HA THR 298 20.134 -18.308 14.556
5 HB THR 298 HB THR 298 18.701 -19.959 12.436
6 HG1 THR 298 HG1 THR 298 19.578 -21.731 13.720
7 HG21 THR 298 HG21 THR 298 20.949 -20.893 12.069
8 HG22 THR 298 HG22 THR 298 21.612 -19.850 13.349
9 HG23 THR 298 HG23 THR 298 20.974 -19.132 11.846
10 H ASN 299 H ASN 299 17.439 -18.217 12.130
11 HA ASN 299 HA ASN 299 18.844 -16.324 10.493
12 HB2 ASN 299 HB2 ASN 299 15.943 -17.248 10.402
13 HB3 ASN 299 HB3 ASN 299 16.801 -16.376 9.124
14 HD21 ASN 299 HD21 ASN 299 17.533 -17.617 7.533
15 HD22 ASN 299 HD22 ASN 299 17.968 -19.303 7.681
16 H ARG 300 H ARG 300 19.138 -14.725 12.275
17 HA ARG 300 HA ARG 300 16.919 -12.951 12.973
18 HB2 ARG 300 HB2 ARG 300 19.945 -12.730 13.026
19 HB3 ARG 300 HB3 ARG 300 18.930 -11.326 13.356
20 HG2 ARG 300 HG2 ARG 300 18.607 -13.903 14.917
21 HG3 ARG 300 HG3 ARG 300 19.792 -12.662 15.368
22 HD2 ARG 300 HD2 ARG 300 17.964 -10.973 15.464
23 HD3 ARG 300 HD3 ARG 300 16.785 -12.250 15.120
24 HE ARG 300 HE ARG 300 18.313 -13.030 17.374
25 HH11 ARG 300 HH11 ARG 300 15.913 -10.523 16.557
26 HH12 ARG 300 HH12 ARG 300 15.338 -10.464 18.205
27 HH21 ARG 300 HH21 ARG 300 17.511 -12.839 19.439
28 HH22 ARG 300 HH22 ARG 300 16.216 -11.729 19.788
29 H ARG 301 H ARG 301 16.509 -10.884 12.118
30 HA ARG 301 HA ARG 301 17.009 -10.749 9.165
31 HB2 ARG 301 HB2 ARG 301 14.897 -9.833 11.082
32 HB3 ARG 301 HB3 ARG 301 15.150 -8.862 9.652
33 HG2 ARG 301 HG2 ARG 301 13.409 -10.328 9.109
34 HG3 ARG 301 HG3 ARG 301 14.832 -10.991 8.285
35 HD2 ARG 301 HD2 ARG 301 15.072 -12.728 9.916
36 HD3 ARG 301 HD3 ARG 301 13.920 -11.940 11.018
37 HE ARG 301 HE ARG 301 12.557 -12.430 8.603
38 HH11 ARG 301 HH11 ARG 301 14.038 -14.367 11.155
39 HH12 ARG 301 HH12 ARG 301 12.888 -15.668 10.953
40 HH21 ARG 301 HH21 ARG 301 11.151 -14.136 8.386
41 HH22 ARG 301 HH22 ARG 301 11.296 -15.543 9.401
42 H LYS 302 H LYS 302 18.471 -9.452 11.826
43 HA LYS 302 HA LYS 302 19.709 -7.543 12.269
44 HB2 LYS 302 HB2 LYS 302 19.368 -6.949 9.296
45 HB3 LYS 302 HB3 LYS 302 20.291 -5.953 10.404
46 HG2 LYS 302 HG2 LYS 302 22.003 -7.491 10.606
47 HG3 LYS 302 HG3 LYS 302 20.995 -8.854 10.089
48 HD2 LYS 302 HD2 LYS 302 22.653 -8.127 8.339
49 HD3 LYS 302 HD3 LYS 302 20.972 -8.095 7.798
50 HE2 LYS 302 HE2 LYS 302 22.127 -6.120 6.955
51 HE3 LYS 302 HE3 LYS 302 20.882 -5.633 8.105
52 HZ1 LYS 302 HZ1 LYS 302 23.786 -5.769 8.662
53 HZ2 LYS 302 HZ2 LYS 302 22.630 -5.358 9.768
54 HZ3 LYS 302 HZ3 LYS 302 22.891 -4.396 8.455
55 H SEP 303 H SEP 303 17.297 -7.612 13.102
56 HA SEP 303 HA SEP 303 15.537 -5.885 11.753
57 HB2 SEP 303 HB2 SEP 303 15.056 -7.034 14.544
58 HB3 SEP 303 HB3 SEP 303 13.867 -6.795 13.256
59 H GLY 304 H GLY 304 15.165 -3.596 12.012
60 HA2 GLY 304 HA2 GLY 304 13.423 -2.549 13.137
61 HA3 GLY 304 HA3 GLY 304 13.552 -3.761 14.419
62 H LYS 305 H LYS 305 15.082 -3.446 16.135
63 HA LYS 305 HA LYS 305 15.464 -0.699 16.964
64 HB2 LYS 305 HB2 LYS 305 16.924 -1.637 18.725
65 HB3 LYS 305 HB3 LYS 305 15.386 -2.487 18.629
66 HG2 LYS 305 HG2 LYS 305 16.760 -4.304 18.865
67 HG3 LYS 305 HG3 LYS 305 16.776 -4.191 17.110
68 HD2 LYS 305 HD2 LYS 305 19.032 -4.520 17.681
69 HD3 LYS 305 HD3 LYS 305 18.940 -2.777 17.388
70 HE2 LYS 305 HE2 LYS 305 18.765 -2.376 19.829
71 HE3 LYS 305 HE3 LYS 305 18.830 -4.127 20.119
72 HZ1 LYS 305 HZ1 LYS 305 21.005 -3.103 20.402
73 HZ2 LYS 305 HZ2 LYS 305 20.988 -2.518 18.859
74 HZ3 LYS 305 HZ3 LYS 305 21.045 -4.144 19.125
75 H TYR 306 H TYR 306 17.090 -2.992 14.941
76 HA TYR 306 HA TYR 306 19.559 -1.448 14.687
77 HB2 TYR 306 HB2 TYR 306 19.530 -3.887 14.271
78 HB3 TYR 306 HB3 TYR 306 18.333 -3.661 13.006
79 HD1 TYR 306 HD1 TYR 306 21.742 -2.269 13.916
80 HD2 TYR 306 HD2 TYR 306 19.036 -3.535 10.809
81 HE1 TYR 306 HE1 TYR 306 23.510 -1.856 12.201
82 HE2 TYR 306 HE2 TYR 306 20.813 -3.130 9.112
83 HH TYR 306 HH TYR 306 23.981 -1.755 9.932
84 H LYS 307 H LYS 307 16.569 -1.960 12.704
85 HA LYS 307 HA LYS 307 17.558 -0.615 10.455
86 HB2 LYS 307 HB2 LYS 307 15.544 -2.033 10.461
87 HB3 LYS 307 HB3 LYS 307 14.640 -0.707 11.224
88 HG2 LYS 307 HG2 LYS 307 14.755 0.641 9.313
89 HG3 LYS 307 HG3 LYS 307 16.225 -0.144 8.732
90 HD2 LYS 307 HD2 LYS 307 14.885 -2.183 8.185
91 HD3 LYS 307 HD3 LYS 307 13.420 -1.281 8.634
92 HE2 LYS 307 HE2 LYS 307 13.635 -1.085 6.244
93 HE3 LYS 307 HE3 LYS 307 14.102 0.483 6.929
94 HZ1 LYS 307 HZ1 LYS 307 16.477 -0.362 6.742
95 HZ2 LYS 307 HZ2 LYS 307 15.716 -0.061 5.304
96 HZ3 LYS 307 HZ3 LYS 307 15.901 -1.608 5.841
97 H LYS 308 H LYS 308 15.995 0.788 13.334
98 HA LYS 308 HA LYS 308 15.684 3.400 12.166
99 HB2 LYS 308 HB2 LYS 308 15.426 4.236 14.415
100 HB3 LYS 308 HB3 LYS 308 14.525 2.728 14.225
101 HG2 LYS 308 HG2 LYS 308 16.295 1.508 15.417
102 HG3 LYS 308 HG3 LYS 308 17.218 3.013 15.597
103 HD2 LYS 308 HD2 LYS 308 15.292 3.998 16.831
104 HD3 LYS 308 HD3 LYS 308 14.470 2.424 16.744
105 HE2 LYS 308 HE2 LYS 308 16.337 1.377 17.977
106 HE3 LYS 308 HE3 LYS 308 17.183 2.936 18.032
107 HZ1 LYS 308 HZ1 LYS 308 14.547 2.383 19.282
108 HZ2 LYS 308 HZ2 LYS 308 15.338 3.830 19.328
109 HZ3 LYS 308 HZ3 LYS 308 15.980 2.516 20.089
110 H VAL 309 H VAL 309 18.482 1.751 13.540
111 HA VAL 309 HA VAL 309 20.152 4.166 13.575
112 HB VAL 309 HB VAL 309 20.774 1.194 13.920
113 HG11 VAL 309 HG11 VAL 309 23.039 1.958 14.668
114 HG12 VAL 309 HG12 VAL 309 22.753 2.209 12.941
115 HG13 VAL 309 HG13 VAL 309 22.654 3.583 14.059
116 HG21 VAL 309 HG21 VAL 309 21.246 1.881 16.216
117 HG22 VAL 309 HG22 VAL 309 20.796 3.557 15.791
118 HG23 VAL 309 HG23 VAL 309 19.574 2.254 15.754
119 H GLU 310 H GLU 310 19.535 1.359 11.502
120 HA GLU 310 HA GLU 310 21.659 1.593 9.704
121 HB2 GLU 310 HB2 GLU 310 19.884 -0.192 9.868
122 HB3 GLU 310 HB3 GLU 310 18.775 0.905 9.054
123 HG2 GLU 310 HG2 GLU 310 20.191 0.886 7.060
124 HG3 GLU 310 HG3 GLU 310 21.334 -0.196 7.883
125 H ILE 311 H ILE 311 18.483 3.282 9.603
126 HA ILE 311 HA ILE 311 19.152 4.750 7.197
127 HB ILE 311 HB ILE 311 17.003 5.294 9.311
128 HG12 ILE 311 HG12 ILE 311 16.748 3.952 6.587
129 HG13 ILE 311 HG13 ILE 311 16.959 3.041 8.084
130 HG21 ILE 311 HG21 ILE 311 17.462 7.301 7.878
131 HG22 ILE 311 HG22 ILE 311 17.224 6.320 6.419
132 HG23 ILE 311 HG23 ILE 311 15.870 6.628 7.534
133 HD11 ILE 311 HD11 ILE 311 14.615 3.033 7.543
134 HD12 ILE 311 HD12 ILE 311 14.838 4.071 8.970
135 HD13 ILE 311 HD13 ILE 311 14.585 4.799 7.364
136 H LYS 312 H LYS 312 19.623 5.337 10.666
137 HA LYS 312 HA LYS 312 20.240 8.134 10.364
138 HB2 LYS 312 HB2 LYS 312 20.618 6.137 12.561
139 HB3 LYS 312 HB3 LYS 312 21.332 7.753 12.678
140 HG2 LYS 312 HG2 LYS 312 19.203 8.806 12.460
141 HG3 LYS 312 HG3 LYS 312 18.438 7.273 12.025
142 HD2 LYS 312 HD2 LYS 312 18.892 6.410 14.285
143 HD3 LYS 312 HD3 LYS 312 19.619 7.971 14.727
144 HE2 LYS 312 HE2 LYS 312 17.236 7.800 15.447
145 HE3 LYS 312 HE3 LYS 312 17.499 9.120 14.287
146 HZ1 LYS 312 HZ1 LYS 312 16.501 7.910 12.578
147 HZ2 LYS 312 HZ2 LYS 312 15.515 7.633 13.864
148 HZ3 LYS 312 HZ3 LYS 312 16.583 6.466 13.373
149 H GLU 313 H GLU 313 22.289 5.235 10.692
150 HA GLU 313 HA GLU 313 24.751 6.643 10.271
151 HB2 GLU 313 HB2 GLU 313 23.799 3.862 10.215
152 HB3 GLU 313 HB3 GLU 313 25.061 4.178 9.019
153 HG2 GLU 313 HG2 GLU 313 26.295 3.520 10.860
154 HG3 GLU 313 HG3 GLU 313 26.364 5.284 10.974
155 H LEU 314 H LEU 314 22.204 5.579 8.049
156 HA LEU 314 HA LEU 314 23.777 6.208 5.659
157 HB2 LEU 314 HB2 LEU 314 21.200 4.974 6.278
158 HB3 LEU 314 HB3 LEU 314 21.102 6.032 4.900
159 HG LEU 314 HG LEU 314 21.479 3.734 4.230
160 HD11 LEU 314 HD11 LEU 314 22.411 5.631 2.866
161 HD12 LEU 314 HD12 LEU 314 23.273 4.094 2.654
162 HD13 LEU 314 HD13 LEU 314 23.981 5.377 3.660
163 HD21 LEU 314 HD21 LEU 314 22.766 2.948 6.194
164 HD22 LEU 314 HD22 LEU 314 24.166 3.900 5.655
165 HD23 LEU 314 HD23 LEU 314 23.568 2.550 4.663
166 H GLY 315 H GLY 315 23.177 8.344 7.753
167 HA2 GLY 315 HA2 GLY 315 23.443 10.618 7.190
168 HA3 GLY 315 HA3 GLY 315 22.600 10.358 5.678
169 H GLU 316 H GLU 316 20.584 9.121 8.176
170 HA GLU 316 HA GLU 316 18.746 11.322 7.897
171 HB2 GLU 316 HB2 GLU 316 18.291 8.952 8.798
172 HB3 GLU 316 HB3 GLU 316 18.969 9.529 10.311
173 HG2 GLU 316 HG2 GLU 316 17.203 11.365 10.226
174 HG3 GLU 316 HG3 GLU 316 16.415 10.360 8.996
175 H LEU 317 H LEU 317 21.443 10.666 10.060
176 HA LEU 317 HA LEU 317 20.901 12.705 12.005
177 HB2 LEU 317 HB2 LEU 317 23.550 11.507 11.092
178 HB3 LEU 317 HB3 LEU 317 23.305 12.448 12.568
179 HG LEU 317 HG LEU 317 21.878 9.842 12.060
180 HD11 LEU 317 HD11 LEU 317 23.717 8.812 13.272
181 HD12 LEU 317 HD12 LEU 317 24.519 10.398 13.432
182 HD13 LEU 317 HD13 LEU 317 24.320 9.657 11.828
183 HD21 LEU 317 HD21 LEU 317 21.866 9.898 14.590
184 HD22 LEU 317 HD22 LEU 317 20.890 11.165 13.817
185 HD23 LEU 317 HD23 LEU 317 22.491 11.564 14.481
186 H ARG 318 H ARG 318 22.377 12.724 8.824
187 HA ARG 318 HA ARG 318 23.543 15.409 9.058
188 HB2 ARG 318 HB2 ARG 318 22.931 13.667 6.638
189 HB3 ARG 318 HB3 ARG 318 23.860 15.153 6.616
190 HG2 ARG 318 HG2 ARG 318 24.791 12.902 8.360
191 HG3 ARG 318 HG3 ARG 318 25.031 12.834 6.604
192 HD2 ARG 318 HD2 ARG 318 25.907 15.296 6.909
193 HD3 ARG 318 HD3 ARG 318 26.149 14.792 8.593
194 HE ARG 318 HE ARG 318 27.880 13.390 7.908
195 HH11 ARG 318 HH11 ARG 318 26.152 14.516 5.007
196 HH12 ARG 318 HH12 ARG 318 27.395 13.907 3.947
197 HH21 ARG 318 HH21 ARG 318 29.392 12.633 6.475
198 HH22 ARG 318 HH22 ARG 318 29.181 12.852 4.759
199 H LYS 319 H LYS 319 20.669 13.857 8.003
200 HA LYS 319 HA LYS 319 18.518 14.634 7.737
201 HB2 LYS 319 HB2 LYS 319 19.639 17.429 7.344
202 HB3 LYS 319 HB3 LYS 319 17.995 16.990 6.946
203 HG2 LYS 319 HG2 LYS 319 17.921 17.972 9.122
204 HG3 LYS 319 HG3 LYS 319 17.628 16.235 9.319
205 HD2 LYS 319 HD2 LYS 319 19.999 15.937 9.969
206 HD3 LYS 319 HD3 LYS 319 20.256 17.681 9.816
207 HE2 LYS 319 HE2 LYS 319 18.656 18.062 11.626
208 HE3 LYS 319 HE3 LYS 319 18.351 16.302 11.726
209 HZ1 LYS 319 HZ1 LYS 319 20.946 17.666 12.176
210 HZ2 LYS 319 HZ2 LYS 319 20.776 16.029 12.094
211 HZ3 LYS 319 HZ3 LYS 319 20.044 16.879 13.313
212 H GLU 320 H GLU 320 20.770 13.689 6.049
213 HA GLU 320 HA GLU 320 19.361 13.940 3.420
214 HB2 GLU 320 HB2 GLU 320 22.303 13.342 3.968
215 HB3 GLU 320 HB3 GLU 320 21.531 13.335 2.381
216 HG2 GLU 320 HG2 GLU 320 22.152 15.451 2.151
217 HG3 GLU 320 HG3 GLU 320 20.982 15.882 3.407
218 HA PRO 321 HA PRO 321 19.451 9.666 5.261
219 HB2 PRO 321 HB2 PRO 321 16.825 8.978 5.196
220 HB3 PRO 321 HB3 PRO 321 17.483 10.026 6.491
221 HG2 PRO 321 HG2 PRO 321 16.082 10.821 3.952
222 HG3 PRO 321 HG3 PRO 321 15.716 11.311 5.638
223 HD2 PRO 321 HD2 PRO 321 17.205 12.866 3.986
224 HD3 PRO 321 HD3 PRO 321 17.563 12.745 5.745
225 H SER 322 H SER 322 18.976 7.563 4.286
226 HA SER 322 HA SER 322 19.165 7.606 1.393
227 HB2 SER 322 HB2 SER 322 20.242 5.876 2.835
228 HB3 SER 322 HB3 SER 322 18.636 5.281 3.292
229 HG SER 322 HG SER 322 18.293 4.876 1.014
230 H LEU 323 H LEU 323 17.639 6.802 -0.095
231 HA LEU 323 HA LEU 323 14.831 6.488 0.859
232 HB2 LEU 323 HB2 LEU 323 15.187 8.803 -0.020
233 HB3 LEU 323 HB3 LEU 323 15.823 8.123 -1.519
234 HG LEU 323 HG LEU 323 13.565 7.115 -1.935
235 HD11 LEU 323 HD11 LEU 323 12.646 7.091 0.298
236 HD12 LEU 323 HD12 LEU 323 11.704 8.260 -0.652
237 HD13 LEU 323 HD13 LEU 323 12.947 8.833 0.494
238 HD21 LEU 323 HD21 LEU 323 13.841 10.108 -1.525
239 HD22 LEU 323 HD22 LEU 323 12.748 9.299 -2.683
240 HD23 LEU 323 HD23 LEU 323 14.516 9.176 -2.880
Start of MODEL 10
1 H1 THR 298 H1 THR 298 18.667 -20.916 15.818
2 H2 THR 298 H2 THR 298 17.285 -20.019 15.879
3 H3 THR 298 H3 THR 298 17.668 -20.859 14.509
4 HA THR 298 HA THR 298 19.197 -18.602 15.616
5 HB THR 298 HB THR 298 20.484 -20.440 14.370
6 HG1 THR 298 HG1 THR 298 21.584 -18.819 13.084
7 HG21 THR 298 HG21 THR 298 20.370 -20.512 11.951
8 HG22 THR 298 HG22 THR 298 19.128 -19.246 11.911
9 HG23 THR 298 HG23 THR 298 18.750 -20.858 12.579
10 H ASN 299 H ASN 299 16.243 -19.402 14.123
11 HA ASN 299 HA ASN 299 16.298 -17.248 12.163
12 HB2 ASN 299 HB2 ASN 299 15.097 -19.406 11.746
13 HB3 ASN 299 HB3 ASN 299 13.969 -18.994 13.048
14 HD21 ASN 299 HD21 ASN 299 12.445 -19.261 11.165
15 HD22 ASN 299 HD22 ASN 299 12.131 -17.840 10.200
16 H ARG 300 H ARG 300 16.783 -15.581 13.647
17 HA ARG 300 HA ARG 300 14.246 -14.325 14.555
18 HB2 ARG 300 HB2 ARG 300 15.523 -15.400 16.539
19 HB3 ARG 300 HB3 ARG 300 16.749 -14.160 16.268
20 HG2 ARG 300 HG2 ARG 300 15.403 -13.231 17.951
21 HG3 ARG 300 HG3 ARG 300 14.787 -12.466 16.475
22 HD2 ARG 300 HD2 ARG 300 12.842 -13.121 17.660
23 HD3 ARG 300 HD3 ARG 300 13.036 -14.371 16.416
24 HE ARG 300 HE ARG 300 14.375 -15.158 18.827
25 HH11 ARG 300 HH11 ARG 300 11.106 -14.876 17.518
26 HH12 ARG 300 HH12 ARG 300 10.472 -16.087 18.599
27 HH21 ARG 300 HH21 ARG 300 13.485 -16.690 20.178
28 HH22 ARG 300 HH22 ARG 300 11.797 -17.100 20.063
29 H ARG 301 H ARG 301 14.122 -12.490 13.402
30 HA ARG 301 HA ARG 301 16.241 -11.501 11.799
31 HB2 ARG 301 HB2 ARG 301 13.486 -10.696 12.535
32 HB3 ARG 301 HB3 ARG 301 14.523 -9.378 11.998
33 HG2 ARG 301 HG2 ARG 301 14.352 -11.902 10.358
34 HG3 ARG 301 HG3 ARG 301 13.074 -10.674 10.267
35 HD2 ARG 301 HD2 ARG 301 14.797 -8.944 9.739
36 HD3 ARG 301 HD3 ARG 301 16.036 -10.208 9.735
37 HE ARG 301 HE ARG 301 15.300 -10.922 7.656
38 HH11 ARG 301 HH11 ARG 301 12.898 -8.636 8.931
39 HH12 ARG 301 HH12 ARG 301 12.054 -8.574 7.401
40 HH21 ARG 301 HH21 ARG 301 14.178 -10.735 5.752
41 HH22 ARG 301 HH22 ARG 301 12.771 -9.716 5.648
42 H LYS 302 H LYS 302 15.144 -10.378 14.975
43 HA LYS 302 HA LYS 302 16.032 -8.916 16.505
44 HB2 LYS 302 HB2 LYS 302 18.607 -9.059 14.912
45 HB3 LYS 302 HB3 LYS 302 18.432 -8.516 16.574
46 HG2 LYS 302 HG2 LYS 302 18.456 -10.621 17.416
47 HG3 LYS 302 HG3 LYS 302 17.509 -11.297 16.080
48 HD2 LYS 302 HD2 LYS 302 19.748 -12.230 15.979
49 HD3 LYS 302 HD3 LYS 302 19.513 -11.141 14.600
50 HE2 LYS 302 HE2 LYS 302 20.710 -9.330 15.885
51 HE3 LYS 302 HE3 LYS 302 21.034 -10.509 17.172
52 HZ1 LYS 302 HZ1 LYS 302 22.262 -11.830 15.546
53 HZ2 LYS 302 HZ2 LYS 302 22.895 -10.308 15.636
54 HZ3 LYS 302 HZ3 LYS 302 21.945 -10.733 14.356
55 H SEP 303 H SEP 303 14.949 -7.951 13.816
56 HA SEP 303 HA SEP 303 16.486 -5.486 13.305
57 HB2 SEP 303 HB2 SEP 303 15.842 -5.764 11.165
58 HB3 SEP 303 HB3 SEP 303 15.270 -7.366 11.658
59 H GLY 304 H GLY 304 14.727 -3.695 12.393
60 HA2 GLY 304 HA2 GLY 304 13.256 -2.027 13.101
61 HA3 GLY 304 HA3 GLY 304 12.795 -3.022 14.495
62 H LYS 305 H LYS 305 14.775 -3.440 16.010
63 HA LYS 305 HA LYS 305 15.453 -0.967 17.261
64 HB2 LYS 305 HB2 LYS 305 15.537 -2.938 18.590
65 HB3 LYS 305 HB3 LYS 305 16.520 -3.797 17.408
66 HG2 LYS 305 HG2 LYS 305 17.882 -3.338 19.338
67 HG3 LYS 305 HG3 LYS 305 18.479 -2.368 17.991
68 HD2 LYS 305 HD2 LYS 305 17.278 -0.389 18.910
69 HD3 LYS 305 HD3 LYS 305 16.756 -1.383 20.292
70 HE2 LYS 305 HE2 LYS 305 19.140 -1.835 20.841
71 HE3 LYS 305 HE3 LYS 305 19.642 -0.824 19.473
72 HZ1 LYS 305 HZ1 LYS 305 19.721 0.392 21.555
73 HZ2 LYS 305 HZ2 LYS 305 18.117 0.125 21.833
74 HZ3 LYS 305 HZ3 LYS 305 18.589 1.064 20.561
75 H TYR 306 H TYR 306 17.481 -3.139 15.258
76 HA TYR 306 HA TYR 306 19.509 -1.019 15.058
77 HB2 TYR 306 HB2 TYR 306 19.402 -3.846 13.960
78 HB3 TYR 306 HB3 TYR 306 20.781 -2.743 13.812
79 HD1 TYR 306 HD1 TYR 306 21.802 -1.798 16.020
80 HD2 TYR 306 HD2 TYR 306 19.168 -5.199 15.912
81 HE1 TYR 306 HE1 TYR 306 22.576 -2.479 18.294
82 HE2 TYR 306 HE2 TYR 306 19.945 -5.870 18.185
83 HH TYR 306 HH TYR 306 21.347 -5.392 19.939
84 H LYS 307 H LYS 307 16.871 -2.301 13.164
85 HA LYS 307 HA LYS 307 17.808 -1.637 10.583
86 HB2 LYS 307 HB2 LYS 307 15.821 -3.019 11.251
87 HB3 LYS 307 HB3 LYS 307 14.927 -1.511 11.484
88 HG2 LYS 307 HG2 LYS 307 15.104 -0.984 9.141
89 HG3 LYS 307 HG3 LYS 307 16.265 -2.311 8.891
90 HD2 LYS 307 HD2 LYS 307 14.535 -3.916 9.667
91 HD3 LYS 307 HD3 LYS 307 13.358 -2.593 9.713
92 HE2 LYS 307 HE2 LYS 307 13.563 -2.273 7.320
93 HE3 LYS 307 HE3 LYS 307 14.929 -3.417 7.245
94 HZ1 LYS 307 HZ1 LYS 307 12.204 -4.152 8.158
95 HZ2 LYS 307 HZ2 LYS 307 13.476 -5.173 7.975
96 HZ3 LYS 307 HZ3 LYS 307 12.796 -4.458 6.643
97 H LYS 308 H LYS 308 16.064 0.378 12.974
98 HA LYS 308 HA LYS 308 15.904 2.598 11.113
99 HB2 LYS 308 HB2 LYS 308 15.053 3.900 12.893
100 HB3 LYS 308 HB3 LYS 308 14.320 2.297 12.971
101 HG2 LYS 308 HG2 LYS 308 16.040 1.745 14.782
102 HG3 LYS 308 HG3 LYS 308 16.413 3.480 14.814
103 HD2 LYS 308 HD2 LYS 308 13.659 2.238 15.255
104 HD3 LYS 308 HD3 LYS 308 14.728 2.833 16.538
105 HE2 LYS 308 HE2 LYS 308 14.598 5.128 15.586
106 HE3 LYS 308 HE3 LYS 308 13.539 4.535 14.293
107 HZ1 LYS 308 HZ1 LYS 308 11.910 3.931 15.967
108 HZ2 LYS 308 HZ2 LYS 308 12.265 5.538 16.065
109 HZ3 LYS 308 HZ3 LYS 308 12.882 4.488 17.179
110 H VAL 309 H VAL 309 18.431 1.369 13.146
111 HA VAL 309 HA VAL 309 19.832 3.899 13.365
112 HB VAL 309 HB VAL 309 20.078 1.349 14.570
113 HG11 VAL 309 HG11 VAL 309 22.435 0.721 14.314
114 HG12 VAL 309 HG12 VAL 309 21.624 0.629 12.740
115 HG13 VAL 309 HG13 VAL 309 22.687 2.007 13.113
116 HG21 VAL 309 HG21 VAL 309 21.911 3.772 14.767
117 HG22 VAL 309 HG22 VAL 309 20.376 3.545 15.644
118 HG23 VAL 309 HG23 VAL 309 21.758 2.477 15.975
119 H GLU 310 H GLU 310 19.541 1.379 10.923
120 HA GLU 310 HA GLU 310 21.943 1.970 9.474
121 HB2 GLU 310 HB2 GLU 310 19.235 1.008 8.471
122 HB3 GLU 310 HB3 GLU 310 20.749 0.920 7.566
123 HG2 GLU 310 HG2 GLU 310 21.687 -0.651 9.182
124 HG3 GLU 310 HG3 GLU 310 20.286 -0.460 10.237
125 H ILE 311 H ILE 311 18.673 3.369 9.488
126 HA ILE 311 HA ILE 311 19.123 5.221 7.318
127 HB ILE 311 HB ILE 311 17.120 5.314 9.640
128 HG12 ILE 311 HG12 ILE 311 16.602 4.536 6.748
129 HG13 ILE 311 HG13 ILE 311 17.076 3.339 7.960
130 HG21 ILE 311 HG21 ILE 311 15.814 6.878 8.147
131 HG22 ILE 311 HG22 ILE 311 17.360 7.560 8.663
132 HG23 ILE 311 HG23 ILE 311 17.194 6.910 7.023
133 HD11 ILE 311 HD11 ILE 311 15.062 3.969 9.325
134 HD12 ILE 311 HD12 ILE 311 14.547 5.031 7.991
135 HD13 ILE 311 HD13 ILE 311 14.675 3.278 7.734
136 H LYS 312 H LYS 312 19.828 5.212 10.790
137 HA LYS 312 HA LYS 312 20.440 8.037 10.906
138 HB2 LYS 312 HB2 LYS 312 19.881 6.665 12.906
139 HB3 LYS 312 HB3 LYS 312 21.432 5.834 12.733
140 HG2 LYS 312 HG2 LYS 312 22.639 7.937 13.057
141 HG3 LYS 312 HG3 LYS 312 21.111 8.820 13.181
142 HD2 LYS 312 HD2 LYS 312 21.819 6.531 15.037
143 HD3 LYS 312 HD3 LYS 312 22.315 8.199 15.367
144 HE2 LYS 312 HE2 LYS 312 19.426 7.329 14.946
145 HE3 LYS 312 HE3 LYS 312 20.200 7.527 16.530
146 HZ1 LYS 312 HZ1 LYS 312 19.720 9.660 14.517
147 HZ2 LYS 312 HZ2 LYS 312 20.634 9.873 15.876
148 HZ3 LYS 312 HZ3 LYS 312 19.028 9.522 16.001
149 H GLU 313 H GLU 313 22.296 5.101 10.229
150 HA GLU 313 HA GLU 313 24.879 6.332 10.117
151 HB2 GLU 313 HB2 GLU 313 23.808 3.777 9.777
152 HB3 GLU 313 HB3 GLU 313 24.381 4.190 8.159
153 HG2 GLU 313 HG2 GLU 313 26.203 3.111 9.153
154 HG3 GLU 313 HG3 GLU 313 26.598 4.833 9.288
155 H LEU 314 H LEU 314 22.181 6.065 7.850
156 HA LEU 314 HA LEU 314 23.611 7.116 5.559
157 HB2 LEU 314 HB2 LEU 314 20.913 6.197 6.238
158 HB3 LEU 314 HB3 LEU 314 20.881 7.599 5.184
159 HG LEU 314 HG LEU 314 20.723 5.480 3.958
160 HD11 LEU 314 HD11 LEU 314 21.708 7.500 2.894
161 HD12 LEU 314 HD12 LEU 314 22.355 5.984 2.226
162 HD13 LEU 314 HD13 LEU 314 23.328 6.938 3.367
163 HD21 LEU 314 HD21 LEU 314 22.137 4.090 5.459
164 HD22 LEU 314 HD22 LEU 314 23.579 4.930 4.846
165 HD23 LEU 314 HD23 LEU 314 22.586 3.950 3.747
166 H GLY 315 H GLY 315 22.828 8.632 8.389
167 HA2 GLY 315 HA2 GLY 315 23.398 10.903 8.688
168 HA3 GLY 315 HA3 GLY 315 23.015 11.228 7.008
169 H GLU 316 H GLU 316 20.598 9.584 9.076
170 HA GLU 316 HA GLU 316 18.727 11.717 8.630
171 HB2 GLU 316 HB2 GLU 316 17.217 10.595 9.963
172 HB3 GLU 316 HB3 GLU 316 18.250 9.303 9.375
173 HG2 GLU 316 HG2 GLU 316 18.032 8.722 11.600
174 HG3 GLU 316 HG3 GLU 316 19.543 9.636 11.629
175 H LEU 317 H LEU 317 21.424 11.499 10.709
176 HA LEU 317 HA LEU 317 20.629 13.173 12.873
177 HB2 LEU 317 HB2 LEU 317 23.339 12.849 11.510
178 HB3 LEU 317 HB3 LEU 317 23.078 13.634 13.072
179 HG LEU 317 HG LEU 317 22.354 10.743 12.596
180 HD11 LEU 317 HD11 LEU 317 24.694 11.249 11.995
181 HD12 LEU 317 HD12 LEU 317 24.573 10.233 13.451
182 HD13 LEU 317 HD13 LEU 317 24.936 11.974 13.600
183 HD21 LEU 317 HD21 LEU 317 21.350 11.730 14.564
184 HD22 LEU 317 HD22 LEU 317 22.877 12.532 14.996
185 HD23 LEU 317 HD23 LEU 317 22.743 10.757 15.107
186 H ARG 318 H ARG 318 21.593 13.869 9.544
187 HA ARG 318 HA ARG 318 21.138 16.789 10.067
188 HB2 ARG 318 HB2 ARG 318 22.326 16.901 7.692
189 HB3 ARG 318 HB3 ARG 318 23.248 16.877 9.193
190 HG2 ARG 318 HG2 ARG 318 23.860 14.594 8.915
191 HG3 ARG 318 HG3 ARG 318 22.664 14.357 7.633
192 HD2 ARG 318 HD2 ARG 318 23.884 15.912 6.175
193 HD3 ARG 318 HD3 ARG 318 25.102 16.150 7.443
194 HE ARG 318 HE ARG 318 25.408 13.582 7.236
195 HH11 ARG 318 HH11 ARG 318 24.546 15.595 4.440
196 HH12 ARG 318 HH12 ARG 318 25.366 14.521 3.335
197 HH21 ARG 318 HH21 ARG 318 26.360 12.260 5.741
198 HH22 ARG 318 HH22 ARG 318 26.324 12.663 4.048
199 H LYS 319 H LYS 319 19.440 14.340 9.543
200 HA LYS 319 HA LYS 319 17.538 13.751 8.503
201 HB2 LYS 319 HB2 LYS 319 17.333 16.740 8.091
202 HB3 LYS 319 HB3 LYS 319 16.004 15.607 7.813
203 HG2 LYS 319 HG2 LYS 319 17.433 15.828 10.485
204 HG3 LYS 319 HG3 LYS 319 15.997 16.779 10.070
205 HD2 LYS 319 HD2 LYS 319 14.659 14.778 9.777
206 HD3 LYS 319 HD3 LYS 319 16.071 13.727 9.965
207 HE2 LYS 319 HE2 LYS 319 15.235 15.629 12.159
208 HE3 LYS 319 HE3 LYS 319 14.505 14.017 11.992
209 HZ1 LYS 319 HZ1 LYS 319 16.591 12.990 12.300
210 HZ2 LYS 319 HZ2 LYS 319 16.508 14.146 13.477
211 HZ3 LYS 319 HZ3 LYS 319 17.432 14.395 12.131
212 H GLU 320 H GLU 320 19.805 13.436 6.893
213 HA GLU 320 HA GLU 320 18.973 14.082 4.155
214 HB2 GLU 320 HB2 GLU 320 21.025 12.096 5.202
215 HB3 GLU 320 HB3 GLU 320 20.878 12.641 3.529
216 HG2 GLU 320 HG2 GLU 320 21.502 14.500 5.838
217 HG3 GLU 320 HG3 GLU 320 22.738 13.630 4.937
218 HA PRO 321 HA PRO 321 16.493 10.374 4.093
219 HB2 PRO 321 HB2 PRO 321 16.088 9.963 1.449
220 HB3 PRO 321 HB3 PRO 321 15.413 11.412 2.269
221 HG2 PRO 321 HG2 PRO 321 17.950 11.150 0.656
222 HG3 PRO 321 HG3 PRO 321 16.640 12.364 0.498
223 HD2 PRO 321 HD2 PRO 321 18.946 12.836 1.898
224 HD3 PRO 321 HD3 PRO 321 17.368 13.559 2.364
225 H SER 322 H SER 322 16.603 8.050 3.489
226 HA SER 322 HA SER 322 19.282 7.024 3.247
227 HB2 SER 322 HB2 SER 322 16.620 5.634 2.755
228 HB3 SER 322 HB3 SER 322 18.187 4.842 3.027
229 HG SER 322 HG SER 322 17.256 4.868 4.986
230 H LEU 323 H LEU 323 20.121 5.803 1.451
231 HA LEU 323 HA LEU 323 19.023 6.658 -1.192
232 HB2 LEU 323 HB2 LEU 323 21.904 6.049 -0.414
233 HB3 LEU 323 HB3 LEU 323 21.340 6.545 -2.008
234 HG LEU 323 HG LEU 323 21.199 8.295 0.455
235 HD11 LEU 323 HD11 LEU 323 23.158 8.111 -1.847
236 HD12 LEU 323 HD12 LEU 323 23.446 7.541 -0.189
237 HD13 LEU 323 HD13 LEU 323 23.217 9.282 -0.500
238 HD21 LEU 323 HD21 LEU 323 20.782 8.732 -2.519
239 HD22 LEU 323 HD22 LEU 323 20.979 10.056 -1.338
240 HD23 LEU 323 HD23 LEU 323 19.589 8.958 -1.217
Start of MODEL 11
1 H1 THR 298 H1 THR 298 15.483 -17.332 10.094
2 H2 THR 298 H2 THR 298 13.975 -17.626 10.698
3 H3 THR 298 H3 THR 298 14.600 -16.101 10.744
4 HA THR 298 HA THR 298 15.658 -18.416 12.229
5 HB THR 298 HB THR 298 16.921 -16.475 13.411
6 HG1 THR 298 HG1 THR 298 16.695 -14.558 12.542
7 HG21 THR 298 HG21 THR 298 18.036 -18.126 11.898
8 HG22 THR 298 HG22 THR 298 18.744 -16.499 11.791
9 HG23 THR 298 HG23 THR 298 17.656 -17.070 10.512
10 H ASN 299 H ASN 299 15.320 -18.258 14.571
11 HA ASN 299 HA ASN 299 12.621 -17.375 15.147
12 HB2 ASN 299 HB2 ASN 299 14.794 -18.433 17.005
13 HB3 ASN 299 HB3 ASN 299 13.081 -18.251 17.407
14 HD21 ASN 299 HD21 ASN 299 11.963 -20.082 17.308
15 HD22 ASN 299 HD22 ASN 299 12.310 -21.421 16.241
16 H ARG 300 H ARG 300 15.504 -15.654 15.058
17 HA ARG 300 HA ARG 300 14.322 -13.504 16.741
18 HB2 ARG 300 HB2 ARG 300 17.164 -14.599 16.909
19 HB3 ARG 300 HB3 ARG 300 16.766 -12.942 17.370
20 HG2 ARG 300 HG2 ARG 300 16.598 -13.916 19.434
21 HG3 ARG 300 HG3 ARG 300 14.931 -14.135 18.887
22 HD2 ARG 300 HD2 ARG 300 15.223 -16.310 19.422
23 HD3 ARG 300 HD3 ARG 300 16.150 -16.420 17.922
24 HE ARG 300 HE ARG 300 18.162 -16.434 19.140
25 HH11 ARG 300 HH11 ARG 300 15.438 -16.061 21.370
26 HH12 ARG 300 HH12 ARG 300 16.413 -16.459 22.760
27 HH21 ARG 300 HH21 ARG 300 19.328 -16.927 20.967
28 HH22 ARG 300 HH22 ARG 300 18.567 -16.925 22.534
29 H ARG 301 H ARG 301 14.445 -11.566 15.686
30 HA ARG 301 HA ARG 301 15.272 -11.696 12.881
31 HB2 ARG 301 HB2 ARG 301 13.103 -10.766 13.620
32 HB3 ARG 301 HB3 ARG 301 13.943 -9.498 14.508
33 HG2 ARG 301 HG2 ARG 301 13.141 -8.515 12.511
34 HG3 ARG 301 HG3 ARG 301 14.884 -8.685 12.319
35 HD2 ARG 301 HD2 ARG 301 14.601 -10.623 10.883
36 HD3 ARG 301 HD3 ARG 301 12.841 -10.608 11.163
37 HE ARG 301 HE ARG 301 13.471 -8.042 10.216
38 HH11 ARG 301 HH11 ARG 301 13.728 -11.318 8.882
39 HH12 ARG 301 HH12 ARG 301 13.577 -10.738 7.247
40 HH21 ARG 301 HH21 ARG 301 13.311 -7.406 8.180
41 HH22 ARG 301 HH22 ARG 301 13.332 -8.549 6.846
42 H LYS 302 H LYS 302 16.328 -9.824 15.737
43 HA LYS 302 HA LYS 302 18.120 -8.438 16.106
44 HB2 LYS 302 HB2 LYS 302 19.155 -10.554 14.689
45 HB3 LYS 302 HB3 LYS 302 19.678 -9.200 13.702
46 HG2 LYS 302 HG2 LYS 302 20.221 -9.473 16.706
47 HG3 LYS 302 HG3 LYS 302 21.344 -10.001 15.453
48 HD2 LYS 302 HD2 LYS 302 20.429 -7.118 15.818
49 HD3 LYS 302 HD3 LYS 302 21.923 -7.778 16.479
50 HE2 LYS 302 HE2 LYS 302 23.007 -7.731 14.458
51 HE3 LYS 302 HE3 LYS 302 21.562 -8.211 13.551
52 HZ1 LYS 302 HZ1 LYS 302 22.058 -5.480 14.605
53 HZ2 LYS 302 HZ2 LYS 302 20.726 -5.953 13.749
54 HZ3 LYS 302 HZ3 LYS 302 22.211 -5.937 13.027
55 H SEP 303 H SEP 303 15.928 -7.797 14.067
56 HA SEP 303 HA SEP 303 17.039 -5.194 13.253
57 HB2 SEP 303 HB2 SEP 303 16.657 -5.337 11.032
58 HB3 SEP 303 HB3 SEP 303 16.918 -7.065 11.332
59 H GLY 304 H GLY 304 14.826 -4.020 12.120
60 HA2 GLY 304 HA2 GLY 304 12.869 -2.964 12.823
61 HA3 GLY 304 HA3 GLY 304 12.750 -4.051 14.216
62 H LYS 305 H LYS 305 14.358 -3.706 15.990
63 HA LYS 305 HA LYS 305 14.395 -0.917 16.756
64 HB2 LYS 305 HB2 LYS 305 14.445 -2.781 18.399
65 HB3 LYS 305 HB3 LYS 305 16.055 -3.244 17.829
66 HG2 LYS 305 HG2 LYS 305 16.970 -1.084 18.574
67 HG3 LYS 305 HG3 LYS 305 15.367 -0.564 19.112
68 HD2 LYS 305 HD2 LYS 305 16.710 -3.067 20.191
69 HD3 LYS 305 HD3 LYS 305 17.006 -1.470 20.894
70 HE2 LYS 305 HE2 LYS 305 14.251 -2.754 20.636
71 HE3 LYS 305 HE3 LYS 305 15.246 -2.777 22.102
72 HZ1 LYS 305 HZ1 LYS 305 13.614 -0.997 22.170
73 HZ2 LYS 305 HZ2 LYS 305 14.217 -0.324 20.788
74 HZ3 LYS 305 HZ3 LYS 305 15.135 -0.360 22.156
75 H TYR 306 H TYR 306 16.698 -3.114 15.237
76 HA TYR 306 HA TYR 306 18.865 -1.180 15.267
77 HB2 TYR 306 HB2 TYR 306 18.495 -3.805 13.794
78 HB3 TYR 306 HB3 TYR 306 19.977 -2.846 13.779
79 HD1 TYR 306 HD2 TYR 306 17.778 -4.991 15.877
80 HD2 TYR 306 HD1 TYR 306 21.433 -2.710 15.746
81 HE1 TYR 306 HE2 TYR 306 18.523 -6.056 18.006
82 HE2 TYR 306 HE1 TYR 306 22.179 -3.809 17.864
83 HH TYR 306 HH TYR 306 20.174 -6.203 19.589
84 H LYS 307 H LYS 307 16.114 -1.737 13.182
85 HA LYS 307 HA LYS 307 17.236 -0.993 10.700
86 HB2 LYS 307 HB2 LYS 307 14.875 -1.878 11.236
87 HB3 LYS 307 HB3 LYS 307 14.454 -0.202 11.590
88 HG2 LYS 307 HG2 LYS 307 13.785 -0.666 9.335
89 HG3 LYS 307 HG3 LYS 307 15.201 0.399 9.248
90 HD2 LYS 307 HD2 LYS 307 16.359 -1.142 8.072
91 HD3 LYS 307 HD3 LYS 307 16.042 -2.381 9.304
92 HE2 LYS 307 HE2 LYS 307 13.700 -2.584 8.270
93 HE3 LYS 307 HE3 LYS 307 14.364 -1.676 6.889
94 HZ1 LYS 307 HZ1 LYS 307 14.615 -4.013 6.505
95 HZ2 LYS 307 HZ2 LYS 307 15.319 -4.276 7.973
96 HZ3 LYS 307 HZ3 LYS 307 16.123 -3.420 6.805
97 H LYS 308 H LYS 308 16.123 0.947 13.420
98 HA LYS 308 HA LYS 308 16.236 3.480 12.099
99 HB2 LYS 308 HB2 LYS 308 15.120 2.903 14.321
100 HB3 LYS 308 HB3 LYS 308 16.729 2.917 15.043
101 HG2 LYS 308 HG2 LYS 308 16.162 5.059 15.542
102 HG3 LYS 308 HG3 LYS 308 16.784 5.373 13.923
103 HD2 LYS 308 HD2 LYS 308 13.837 4.932 14.606
104 HD3 LYS 308 HD3 LYS 308 14.616 6.511 14.387
105 HE2 LYS 308 HE2 LYS 308 15.336 5.531 12.067
106 HE3 LYS 308 HE3 LYS 308 13.994 4.404 12.324
107 HZ1 LYS 308 HZ1 LYS 308 13.216 6.288 11.113
108 HZ2 LYS 308 HZ2 LYS 308 13.863 7.364 12.183
109 HZ3 LYS 308 HZ3 LYS 308 12.575 6.420 12.629
110 H VAL 309 H VAL 309 18.764 1.425 13.469
111 HA VAL 309 HA VAL 309 20.711 3.612 13.511
112 HB VAL 309 HB VAL 309 20.529 1.133 14.806
113 HG11 VAL 309 HG11 VAL 309 22.548 -0.134 14.212
114 HG12 VAL 309 HG12 VAL 309 21.456 -0.057 12.820
115 HG13 VAL 309 HG13 VAL 309 22.899 0.983 12.879
116 HG21 VAL 309 HG21 VAL 309 21.607 3.167 15.654
117 HG22 VAL 309 HG22 VAL 309 22.677 1.757 15.820
118 HG23 VAL 309 HG23 VAL 309 22.960 2.936 14.516
119 H GLU 310 H GLU 310 19.644 1.129 11.236
120 HA GLU 310 HA GLU 310 21.909 1.227 9.525
121 HB2 GLU 310 HB2 GLU 310 19.076 0.936 8.570
122 HB3 GLU 310 HB3 GLU 310 20.554 0.342 7.817
123 HG2 GLU 310 HG2 GLU 310 19.213 -0.663 10.328
124 HG3 GLU 310 HG3 GLU 310 19.396 -1.473 8.790
125 H ILE 311 H ILE 311 18.877 3.138 9.653
126 HA ILE 311 HA ILE 311 19.769 4.844 7.500
127 HB ILE 311 HB ILE 311 17.754 6.058 7.668
128 HG12 ILE 311 HG12 ILE 311 16.932 4.626 10.194
129 HG13 ILE 311 HG13 ILE 311 17.821 6.150 10.252
130 HG21 ILE 311 HG21 ILE 311 16.099 4.298 7.341
131 HG22 ILE 311 HG22 ILE 311 17.650 3.709 6.729
132 HG23 ILE 311 HG23 ILE 311 17.053 3.146 8.304
133 HD11 ILE 311 HD11 ILE 311 15.550 6.743 10.386
134 HD12 ILE 311 HD12 ILE 311 16.045 7.138 8.741
135 HD13 ILE 311 HD13 ILE 311 15.093 5.665 9.052
136 H LYS 312 H LYS 312 20.537 4.855 10.812
137 HA LYS 312 HA LYS 312 20.658 7.698 11.250
138 HB2 LYS 312 HB2 LYS 312 22.085 5.329 12.433
139 HB3 LYS 312 HB3 LYS 312 22.745 6.925 12.720
140 HG2 LYS 312 HG2 LYS 312 19.901 6.161 13.383
141 HG3 LYS 312 HG3 LYS 312 21.243 6.062 14.527
142 HD2 LYS 312 HD2 LYS 312 21.652 8.510 14.184
143 HD3 LYS 312 HD3 LYS 312 20.210 8.576 13.162
144 HE2 LYS 312 HE2 LYS 312 20.310 7.787 16.088
145 HE3 LYS 312 HE3 LYS 312 19.680 9.311 15.421
146 HZ1 LYS 312 HZ1 LYS 312 17.883 7.796 15.843
147 HZ2 LYS 312 HZ2 LYS 312 18.580 6.609 14.930
148 HZ3 LYS 312 HZ3 LYS 312 18.025 7.977 14.206
149 H GLU 313 H GLU 313 22.951 5.307 9.962
150 HA GLU 313 HA GLU 313 24.960 7.305 9.378
151 HB2 GLU 313 HB2 GLU 313 24.612 4.493 8.297
152 HB3 GLU 313 HB3 GLU 313 26.041 5.523 8.083
153 HG2 GLU 313 HG2 GLU 313 26.129 5.696 10.637
154 HG3 GLU 313 HG3 GLU 313 24.941 4.384 10.679
155 H LEU 314 H LEU 314 22.109 6.199 7.697
156 HA LEU 314 HA LEU 314 22.857 7.423 5.149
157 HB2 LEU 314 HB2 LEU 314 20.161 6.469 6.135
158 HB3 LEU 314 HB3 LEU 314 20.525 6.987 4.500
159 HG LEU 314 HG LEU 314 21.693 4.538 5.857
160 HD11 LEU 314 HD11 LEU 314 19.618 4.818 3.643
161 HD12 LEU 314 HD12 LEU 314 19.282 4.357 5.324
162 HD13 LEU 314 HD13 LEU 314 20.260 3.292 4.299
163 HD21 LEU 314 HD21 LEU 314 22.501 3.972 3.564
164 HD22 LEU 314 HD22 LEU 314 23.281 5.419 4.225
165 HD23 LEU 314 HD23 LEU 314 21.989 5.585 3.010
166 H GLY 315 H GLY 315 22.817 8.994 7.726
167 HA2 GLY 315 HA2 GLY 315 22.747 11.345 7.724
168 HA3 GLY 315 HA3 GLY 315 21.474 11.314 6.524
169 H GLU 316 H GLU 316 20.354 9.234 8.997
170 HA GLU 316 HA GLU 316 18.588 11.353 9.920
171 HB2 GLU 316 HB2 GLU 316 18.112 8.810 9.890
172 HB3 GLU 316 HB3 GLU 316 18.986 8.777 11.426
173 HG2 GLU 316 HG2 GLU 316 17.415 10.559 12.267
174 HG3 GLU 316 HG3 GLU 316 16.498 10.385 10.768
175 H LEU 317 H LEU 317 21.776 10.328 10.714
176 HA LEU 317 HA LEU 317 22.019 11.386 13.401
177 HB2 LEU 317 HB2 LEU 317 23.947 11.000 11.087
178 HB3 LEU 317 HB3 LEU 317 24.456 11.735 12.605
179 HG LEU 317 HG LEU 317 23.220 9.016 12.585
180 HD11 LEU 317 HD11 LEU 317 26.120 9.768 12.161
181 HD12 LEU 317 HD12 LEU 317 25.009 9.198 10.894
182 HD13 LEU 317 HD13 LEU 317 25.442 8.120 12.244
183 HD21 LEU 317 HD21 LEU 317 23.480 10.093 14.750
184 HD22 LEU 317 HD22 LEU 317 25.154 10.542 14.359
185 HD23 LEU 317 HD23 LEU 317 24.720 8.829 14.591
186 H ARG 318 H ARG 318 21.521 12.818 10.322
187 HA ARG 318 HA ARG 318 22.344 15.532 11.296
188 HB2 ARG 318 HB2 ARG 318 21.998 14.483 8.452
189 HB3 ARG 318 HB3 ARG 318 22.467 16.125 8.892
190 HG2 ARG 318 HG2 ARG 318 24.123 13.623 9.460
191 HG3 ARG 318 HG3 ARG 318 24.379 14.753 8.122
192 HD2 ARG 318 HD2 ARG 318 25.887 15.640 9.596
193 HD3 ARG 318 HD3 ARG 318 24.453 16.538 10.111
194 HE ARG 318 HE ARG 318 24.247 15.125 12.033
195 HH11 ARG 318 HH11 ARG 318 27.180 14.381 10.194
196 HH12 ARG 318 HH12 ARG 318 27.909 13.546 11.539
197 HH21 ARG 318 HH21 ARG 318 25.220 14.048 13.665
198 HH22 ARG 318 HH22 ARG 318 26.820 13.370 13.478
199 H LYS 319 H LYS 319 19.855 13.892 11.762
200 HA LYS 319 HA LYS 319 17.747 14.274 12.144
201 HB2 LYS 319 HB2 LYS 319 18.395 16.609 12.523
202 HB3 LYS 319 HB3 LYS 319 18.083 16.980 10.826
203 HG2 LYS 319 HG2 LYS 319 15.942 15.559 12.119
204 HG3 LYS 319 HG3 LYS 319 16.298 17.115 12.884
205 HD2 LYS 319 HD2 LYS 319 15.447 18.315 11.125
206 HD3 LYS 319 HD3 LYS 319 16.304 17.321 9.940
207 HE2 LYS 319 HE2 LYS 319 14.533 15.563 10.207
208 HE3 LYS 319 HE3 LYS 319 13.618 16.716 11.208
209 HZ1 LYS 319 HZ1 LYS 319 13.599 18.233 9.324
210 HZ2 LYS 319 HZ2 LYS 319 12.993 16.777 8.835
211 HZ3 LYS 319 HZ3 LYS 319 14.523 17.211 8.413
212 H GLU 320 H GLU 320 18.592 15.087 8.745
213 HA GLU 320 HA GLU 320 15.911 14.605 7.889
214 HB2 GLU 320 HB2 GLU 320 18.258 15.551 6.746
215 HB3 GLU 320 HB3 GLU 320 17.914 14.072 5.836
216 HG2 GLU 320 HG2 GLU 320 16.913 16.217 4.898
217 HG3 GLU 320 HG3 GLU 320 15.777 14.880 5.150
218 HA PRO 321 HA PRO 321 16.225 10.227 8.322
219 HB2 PRO 321 HB2 PRO 321 13.658 9.504 7.953
220 HB3 PRO 321 HB3 PRO 321 14.127 10.535 9.344
221 HG2 PRO 321 HG2 PRO 321 13.011 11.356 6.667
222 HG3 PRO 321 HG3 PRO 321 12.433 11.794 8.306
223 HD2 PRO 321 HD2 PRO 321 14.102 13.393 6.833
224 HD3 PRO 321 HD3 PRO 321 14.151 13.328 8.629
225 H SER 322 H SER 322 15.521 8.189 7.202
226 HA SER 322 HA SER 322 15.172 8.381 4.264
227 HB2 SER 322 HB2 SER 322 17.616 8.131 4.578
228 HB3 SER 322 HB3 SER 322 17.348 6.802 5.721
229 HG SER 322 HG SER 322 16.626 5.509 4.082
230 H LEU 323 H LEU 323 14.445 6.172 3.517
231 HA LEU 323 HA LEU 323 12.694 4.929 5.546
232 HB2 LEU 323 HB2 LEU 323 13.101 4.335 2.581
233 HB3 LEU 323 HB3 LEU 323 11.885 3.591 3.617
234 HG LEU 323 HG LEU 323 11.941 6.543 2.971
235 HD11 LEU 323 HD11 LEU 323 10.257 5.921 1.314
236 HD12 LEU 323 HD12 LEU 323 10.414 4.206 1.787
237 HD13 LEU 323 HD13 LEU 323 11.782 5.045 1.022
238 HD21 LEU 323 HD21 LEU 323 10.714 6.055 4.997
239 HD22 LEU 323 HD22 LEU 323 9.948 4.638 4.245
240 HD23 LEU 323 HD23 LEU 323 9.530 6.282 3.692
Start of MODEL 12
1 H1 THR 298 H1 THR 298 14.602 -10.658 9.622
2 H2 THR 298 H2 THR 298 16.045 -11.390 9.339
3 H3 THR 298 H3 THR 298 14.760 -11.691 8.348
4 HA THR 298 HA THR 298 13.551 -12.686 10.210
5 HB THR 298 HB THR 298 14.957 -14.768 10.281
6 HG1 THR 298 HG1 THR 298 16.904 -14.620 8.953
7 HG21 THR 298 HG21 THR 298 14.898 -13.526 7.494
8 HG22 THR 298 HG22 THR 298 13.471 -14.223 8.304
9 HG23 THR 298 HG23 THR 298 14.863 -15.252 7.912
10 H ASN 299 H ASN 299 14.355 -14.170 12.270
11 HA ASN 299 HA ASN 299 15.252 -12.151 14.156
12 HB2 ASN 299 HB2 ASN 299 13.504 -13.895 14.641
13 HB3 ASN 299 HB3 ASN 299 14.802 -15.097 14.708
14 HD21 ASN 299 HD21 ASN 299 13.884 -15.326 16.935
15 HD22 ASN 299 HD22 ASN 299 14.517 -14.274 18.175
16 H ARG 300 H ARG 300 17.337 -11.941 12.851
17 HA ARG 300 HA ARG 300 19.392 -13.359 14.461
18 HB2 ARG 300 HB2 ARG 300 19.121 -14.504 12.196
19 HB3 ARG 300 HB3 ARG 300 19.725 -13.014 11.463
20 HG2 ARG 300 HG2 ARG 300 21.593 -14.497 11.645
21 HG3 ARG 300 HG3 ARG 300 21.811 -13.277 12.913
22 HD2 ARG 300 HD2 ARG 300 20.848 -14.857 14.580
23 HD3 ARG 300 HD3 ARG 300 20.659 -16.075 13.304
24 HE ARG 300 HE ARG 300 23.366 -15.252 13.325
25 HH11 ARG 300 HH11 ARG 300 21.158 -17.017 15.444
26 HH12 ARG 300 HH12 ARG 300 22.447 -17.934 16.176
27 HH21 ARG 300 HH21 ARG 300 24.959 -16.454 14.315
28 HH22 ARG 300 HH22 ARG 300 24.556 -17.622 15.543
29 H ARG 301 H ARG 301 18.682 -10.695 12.116
30 HA ARG 301 HA ARG 301 21.018 -9.167 13.015
31 HB2 ARG 301 HB2 ARG 301 18.565 -8.256 11.508
32 HB3 ARG 301 HB3 ARG 301 20.037 -7.333 11.740
33 HG2 ARG 301 HG2 ARG 301 21.269 -9.110 10.446
34 HG3 ARG 301 HG3 ARG 301 19.680 -9.831 10.074
35 HD2 ARG 301 HD2 ARG 301 18.959 -7.542 9.274
36 HD3 ARG 301 HD3 ARG 301 20.638 -7.026 9.447
37 HE ARG 301 HE ARG 301 21.262 -8.512 7.654
38 HH11 ARG 301 HH11 ARG 301 17.733 -8.219 8.040
39 HH12 ARG 301 HH12 ARG 301 17.454 -8.767 6.405
40 HH21 ARG 301 HH21 ARG 301 20.776 -9.212 5.607
41 HH22 ARG 301 HH22 ARG 301 19.122 -9.326 5.074
42 H LYS 302 H LYS 302 18.002 -9.853 14.342
43 HA LYS 302 HA LYS 302 16.735 -8.994 16.054
44 HB2 LYS 302 HB2 LYS 302 19.202 -7.355 16.732
45 HB3 LYS 302 HB3 LYS 302 17.833 -7.678 17.800
46 HG2 LYS 302 HG2 LYS 302 18.377 -10.079 17.800
47 HG3 LYS 302 HG3 LYS 302 19.697 -9.794 16.651
48 HD2 LYS 302 HD2 LYS 302 20.803 -8.319 18.310
49 HD3 LYS 302 HD3 LYS 302 19.530 -8.731 19.485
50 HE2 LYS 302 HE2 LYS 302 20.137 -11.125 19.298
51 HE3 LYS 302 HE3 LYS 302 21.385 -10.720 18.102
52 HZ1 LYS 302 HZ1 LYS 302 22.326 -10.989 20.312
53 HZ2 LYS 302 HZ2 LYS 302 21.362 -9.801 20.924
54 HZ3 LYS 302 HZ3 LYS 302 22.520 -9.432 19.809
55 H SEP 303 H SEP 303 16.325 -8.123 13.654
56 HA SEP 303 HA SEP 303 16.781 -5.535 12.838
57 HB2 SEP 303 HB2 SEP 303 14.336 -7.160 12.047
58 HB3 SEP 303 HB3 SEP 303 15.295 -6.050 11.040
59 H GLY 304 H GLY 304 15.250 -3.770 12.311
60 HA2 GLY 304 HA2 GLY 304 13.435 -2.360 12.781
61 HA3 GLY 304 HA3 GLY 304 12.873 -3.484 14.032
62 H LYS 305 H LYS 305 14.994 -3.793 15.667
63 HA LYS 305 HA LYS 305 15.052 -1.318 17.168
64 HB2 LYS 305 HB2 LYS 305 16.920 -3.726 17.311
65 HB3 LYS 305 HB3 LYS 305 16.768 -2.469 18.544
66 HG2 LYS 305 HG2 LYS 305 14.432 -3.163 18.958
67 HG3 LYS 305 HG3 LYS 305 14.579 -4.403 17.695
68 HD2 LYS 305 HD2 LYS 305 16.488 -5.405 18.976
69 HD3 LYS 305 HD3 LYS 305 16.149 -4.264 20.293
70 HE2 LYS 305 HE2 LYS 305 14.197 -6.320 19.163
71 HE3 LYS 305 HE3 LYS 305 15.120 -6.504 20.665
72 HZ1 LYS 305 HZ1 LYS 305 13.083 -4.410 20.159
73 HZ2 LYS 305 HZ2 LYS 305 13.945 -4.581 21.556
74 HZ3 LYS 305 HZ3 LYS 305 12.873 -5.747 21.099
75 H TYR 306 H TYR 306 17.321 -3.059 15.074
76 HA TYR 306 HA TYR 306 19.253 -0.861 15.096
77 HB2 TYR 306 HB2 TYR 306 19.114 -3.531 13.668
78 HB3 TYR 306 HB3 TYR 306 20.402 -2.348 13.395
79 HD1 TYR 306 HD1 TYR 306 21.832 -1.582 15.364
80 HD2 TYR 306 HD2 TYR 306 19.216 -4.991 15.586
81 HE1 TYR 306 HE1 TYR 306 23.062 -2.401 17.375
82 HE2 TYR 306 HE2 TYR 306 20.447 -5.791 17.601
83 HH TYR 306 HH TYR 306 22.139 -5.393 19.080
84 H LYS 307 H LYS 307 16.445 -1.648 13.149
85 HA LYS 307 HA LYS 307 17.418 -0.667 10.670
86 HB2 LYS 307 HB2 LYS 307 14.651 -0.838 11.823
87 HB3 LYS 307 HB3 LYS 307 14.939 -0.044 10.273
88 HG2 LYS 307 HG2 LYS 307 15.915 -2.861 10.820
89 HG3 LYS 307 HG3 LYS 307 14.288 -2.527 10.200
90 HD2 LYS 307 HD2 LYS 307 15.256 -1.349 8.256
91 HD3 LYS 307 HD3 LYS 307 16.889 -1.668 8.856
92 HE2 LYS 307 HE2 LYS 307 14.892 -3.873 8.240
93 HE3 LYS 307 HE3 LYS 307 16.030 -3.235 7.041
94 HZ1 LYS 307 HZ1 LYS 307 17.859 -3.935 8.384
95 HZ2 LYS 307 HZ2 LYS 307 16.839 -5.242 8.228
96 HZ3 LYS 307 HZ3 LYS 307 16.883 -4.383 9.630
97 H LYS 308 H LYS 308 16.207 0.987 13.513
98 HA LYS 308 HA LYS 308 15.972 3.614 12.391
99 HB2 LYS 308 HB2 LYS 308 16.695 2.708 15.200
100 HB3 LYS 308 HB3 LYS 308 16.254 4.362 14.755
101 HG2 LYS 308 HG2 LYS 308 14.026 3.581 14.031
102 HG3 LYS 308 HG3 LYS 308 14.450 1.921 14.488
103 HD2 LYS 308 HD2 LYS 308 14.530 4.232 16.450
104 HD3 LYS 308 HD3 LYS 308 13.074 3.257 16.169
105 HE2 LYS 308 HE2 LYS 308 14.301 1.208 16.807
106 HE3 LYS 308 HE3 LYS 308 15.773 2.165 17.082
107 HZ1 LYS 308 HZ1 LYS 308 14.579 3.389 18.800
108 HZ2 LYS 308 HZ2 LYS 308 14.594 1.778 19.145
109 HZ3 LYS 308 HZ3 LYS 308 13.222 2.484 18.559
110 H VAL 309 H VAL 309 18.735 1.730 13.536
111 HA VAL 309 HA VAL 309 20.560 4.014 13.381
112 HB VAL 309 HB VAL 309 21.052 1.025 13.784
113 HG11 VAL 309 HG11 VAL 309 23.370 1.698 14.412
114 HG12 VAL 309 HG12 VAL 309 23.025 1.985 12.700
115 HG13 VAL 309 HG13 VAL 309 23.027 3.348 13.843
116 HG21 VAL 309 HG21 VAL 309 21.174 3.428 15.632
117 HG22 VAL 309 HG22 VAL 309 19.951 2.131 15.665
118 HG23 VAL 309 HG23 VAL 309 21.639 1.767 16.077
119 H GLU 310 H GLU 310 19.737 1.101 11.445
120 HA GLU 310 HA GLU 310 21.750 1.364 9.498
121 HB2 GLU 310 HB2 GLU 310 18.890 0.357 9.274
122 HB3 GLU 310 HB3 GLU 310 20.091 0.160 7.996
123 HG2 GLU 310 HG2 GLU 310 21.433 -1.309 9.337
124 HG3 GLU 310 HG3 GLU 310 20.574 -0.876 10.813
125 H ILE 311 H ILE 311 18.436 2.830 9.447
126 HA ILE 311 HA ILE 311 18.850 4.164 6.944
127 HB ILE 311 HB ILE 311 16.612 3.709 8.096
128 HG12 ILE 311 HG12 ILE 311 17.178 6.508 7.068
129 HG13 ILE 311 HG13 ILE 311 16.725 5.094 6.120
130 HG21 ILE 311 HG21 ILE 311 17.305 4.624 10.344
131 HG22 ILE 311 HG22 ILE 311 17.171 6.263 9.667
132 HG23 ILE 311 HG23 ILE 311 15.741 5.206 9.766
133 HD11 ILE 311 HD11 ILE 311 14.497 5.089 7.322
134 HD12 ILE 311 HD12 ILE 311 14.965 6.629 8.075
135 HD13 ILE 311 HD13 ILE 311 14.796 6.523 6.316
136 H LYS 312 H LYS 312 19.803 5.013 10.230
137 HA LYS 312 HA LYS 312 20.353 7.813 9.547
138 HB2 LYS 312 HB2 LYS 312 19.656 6.700 11.834
139 HB3 LYS 312 HB3 LYS 312 21.369 6.385 12.017
140 HG2 LYS 312 HG2 LYS 312 19.990 9.101 11.798
141 HG3 LYS 312 HG3 LYS 312 20.732 8.409 13.238
142 HD2 LYS 312 HD2 LYS 312 22.190 9.367 10.742
143 HD3 LYS 312 HD3 LYS 312 22.124 10.197 12.291
144 HE2 LYS 312 HE2 LYS 312 23.653 8.769 13.300
145 HE3 LYS 312 HE3 LYS 312 23.206 7.387 12.279
146 HZ1 LYS 312 HZ1 LYS 312 24.306 8.483 10.407
147 HZ2 LYS 312 HZ2 LYS 312 25.369 8.214 11.644
148 HZ3 LYS 312 HZ3 LYS 312 24.780 9.732 11.379
149 H GLU 313 H GLU 313 22.321 4.925 10.395
150 HA GLU 313 HA GLU 313 24.823 6.272 10.174
151 HB2 GLU 313 HB2 GLU 313 24.264 4.142 11.379
152 HB3 GLU 313 HB3 GLU 313 24.297 3.310 9.817
153 HG2 GLU 313 HG2 GLU 313 26.626 3.742 9.545
154 HG3 GLU 313 HG3 GLU 313 26.621 4.950 10.844
155 H LEU 314 H LEU 314 23.001 4.336 7.755
156 HA LEU 314 HA LEU 314 25.140 4.632 5.780
157 HB2 LEU 314 HB2 LEU 314 22.231 3.834 5.483
158 HB3 LEU 314 HB3 LEU 314 23.456 3.690 4.228
159 HG LEU 314 HG LEU 314 23.527 2.192 6.873
160 HD11 LEU 314 HD11 LEU 314 21.593 1.529 5.520
161 HD12 LEU 314 HD12 LEU 314 22.814 0.242 5.537
162 HD13 LEU 314 HD13 LEU 314 22.643 1.287 4.104
163 HD21 LEU 314 HD21 LEU 314 25.152 1.887 4.311
164 HD22 LEU 314 HD22 LEU 314 25.203 0.775 5.700
165 HD23 LEU 314 HD23 LEU 314 25.756 2.450 5.888
166 H GLY 315 H GLY 315 22.753 6.675 7.037
167 HA2 GLY 315 HA2 GLY 315 22.268 8.861 6.474
168 HA3 GLY 315 HA3 GLY 315 23.445 8.740 5.153
169 H GLU 316 H GLU 316 20.739 6.474 5.442
170 HA GLU 316 HA GLU 316 19.863 7.090 2.775
171 HB2 GLU 316 HB2 GLU 316 18.428 5.588 4.965
172 HB3 GLU 316 HB3 GLU 316 17.956 5.633 3.266
173 HG2 GLU 316 HG2 GLU 316 20.408 4.384 4.502
174 HG3 GLU 316 HG3 GLU 316 19.119 3.581 3.596
175 H LEU 317 H LEU 317 19.146 8.364 5.907
176 HA LEU 317 HA LEU 317 16.671 9.658 5.448
177 HB2 LEU 317 HB2 LEU 317 19.088 10.550 7.061
178 HB3 LEU 317 HB3 LEU 317 17.500 11.307 7.144
179 HG LEU 317 HG LEU 317 17.930 8.416 7.866
180 HD11 LEU 317 HD11 LEU 317 18.175 9.241 10.141
181 HD12 LEU 317 HD12 LEU 317 18.005 10.922 9.567
182 HD13 LEU 317 HD13 LEU 317 19.419 9.957 9.086
183 HD21 LEU 317 HD21 LEU 317 15.621 9.039 7.441
184 HD22 LEU 317 HD22 LEU 317 15.807 10.522 8.403
185 HD23 LEU 317 HD23 LEU 317 15.854 8.925 9.197
186 H ARG 318 H ARG 318 19.755 10.291 3.972
187 HA ARG 318 HA ARG 318 19.008 13.069 3.261
188 HB2 ARG 318 HB2 ARG 318 21.428 11.340 2.633
189 HB3 ARG 318 HB3 ARG 318 21.209 12.961 1.996
190 HG2 ARG 318 HG2 ARG 318 21.470 12.230 4.938
191 HG3 ARG 318 HG3 ARG 318 22.703 12.990 3.919
192 HD2 ARG 318 HD2 ARG 318 20.034 14.179 4.775
193 HD3 ARG 318 HD3 ARG 318 21.646 14.726 5.258
194 HE ARG 318 HE ARG 318 20.238 15.247 2.727
195 HH11 ARG 318 HH11 ARG 318 23.370 15.408 4.362
196 HH12 ARG 318 HH12 ARG 318 24.004 16.561 3.219
197 HH21 ARG 318 HH21 ARG 318 21.120 16.695 1.314
198 HH22 ARG 318 HH22 ARG 318 22.749 17.280 1.528
199 H LYS 319 H LYS 319 18.126 10.079 2.092
200 HA LYS 319 HA LYS 319 17.904 11.174 -0.697
201 HB2 LYS 319 HB2 LYS 319 18.148 8.244 0.111
202 HB3 LYS 319 HB3 LYS 319 17.999 8.873 -1.528
203 HG2 LYS 319 HG2 LYS 319 20.238 8.784 -1.626
204 HG3 LYS 319 HG3 LYS 319 20.287 10.150 -0.487
205 HD2 LYS 319 HD2 LYS 319 20.294 8.619 1.402
206 HD3 LYS 319 HD3 LYS 319 20.061 7.232 0.330
207 HE2 LYS 319 HE2 LYS 319 22.273 7.641 -0.684
208 HE3 LYS 319 HE3 LYS 319 22.525 8.998 0.440
209 HZ1 LYS 319 HZ1 LYS 319 23.512 6.883 1.238
210 HZ2 LYS 319 HZ2 LYS 319 22.020 6.180 1.292
211 HZ3 LYS 319 HZ3 LYS 319 22.374 7.448 2.284
212 H GLU 320 H GLU 320 16.514 8.252 0.780
213 HA GLU 320 HA GLU 320 13.796 9.420 0.843
214 HB2 GLU 320 HB2 GLU 320 14.633 6.994 -0.820
215 HB3 GLU 320 HB3 GLU 320 12.960 7.386 -0.412
216 HG2 GLU 320 HG2 GLU 320 13.235 9.577 -1.603
217 HG3 GLU 320 HG3 GLU 320 14.843 9.042 -2.122
218 HA PRO 321 HA PRO 321 14.017 6.875 4.374
219 HB2 PRO 321 HB2 PRO 321 11.525 5.833 4.796
220 HB3 PRO 321 HB3 PRO 321 11.883 7.579 4.990
221 HG2 PRO 321 HG2 PRO 321 10.740 6.148 2.594
222 HG3 PRO 321 HG3 PRO 321 10.101 7.589 3.455
223 HD2 PRO 321 HD2 PRO 321 11.577 7.850 1.222
224 HD3 PRO 321 HD3 PRO 321 11.791 8.987 2.599
225 H SER 322 H SER 322 14.193 4.719 5.214
226 HA SER 322 HA SER 322 13.693 2.493 3.316
227 HB2 SER 322 HB2 SER 322 16.045 3.304 2.961
228 HB3 SER 322 HB3 SER 322 16.364 3.032 4.687
229 HG SER 322 HG SER 322 15.812 1.147 2.653
230 H LEU 323 H LEU 323 13.464 0.466 4.418
231 HA LEU 323 HA LEU 323 13.701 0.307 7.320
232 HB2 LEU 323 HB2 LEU 323 11.533 1.551 6.996
233 HB3 LEU 323 HB3 LEU 323 10.961 0.238 5.974
234 HG LEU 323 HG LEU 323 11.036 -1.270 7.960
235 HD11 LEU 323 HD11 LEU 323 11.098 -0.048 10.180
236 HD12 LEU 323 HD12 LEU 323 11.742 1.365 9.297
237 HD13 LEU 323 HD13 LEU 323 12.664 -0.155 9.347
238 HD21 LEU 323 HD21 LEU 323 8.994 -0.235 8.837
239 HD22 LEU 323 HD22 LEU 323 9.099 -0.062 7.066
240 HD23 LEU 323 HD23 LEU 323 9.477 1.324 8.112
Start of MODEL 13
1 H1 THR 298 H1 THR 298 19.034 -19.598 10.105
2 H2 THR 298 H2 THR 298 18.121 -18.362 10.709
3 H3 THR 298 H3 THR 298 17.457 -19.437 9.649
4 HA THR 298 HA THR 298 19.646 -17.573 8.998
5 HB THR 298 HB THR 298 19.071 -18.304 6.631
6 HG1 THR 298 HG1 THR 298 17.281 -19.413 6.503
7 HG21 THR 298 HG21 THR 298 19.900 -20.622 8.424
8 HG22 THR 298 HG22 THR 298 20.996 -19.314 7.901
9 HG23 THR 298 HG23 THR 298 20.265 -20.401 6.703
10 H ASN 299 H ASN 299 18.570 -16.447 6.779
11 HA ASN 299 HA ASN 299 17.142 -14.921 5.956
12 HB2 ASN 299 HB2 ASN 299 15.027 -16.599 7.361
13 HB3 ASN 299 HB3 ASN 299 14.706 -15.369 6.137
14 HD21 ASN 299 HD21 ASN 299 14.192 -16.262 4.284
15 HD22 ASN 299 HD22 ASN 299 14.961 -17.663 3.580
16 H ARG 300 H ARG 300 18.079 -14.426 8.909
17 HA ARG 300 HA ARG 300 15.941 -12.518 9.698
18 HB2 ARG 300 HB2 ARG 300 18.541 -13.318 11.052
19 HB3 ARG 300 HB3 ARG 300 17.416 -12.089 11.656
20 HG2 ARG 300 HG2 ARG 300 15.641 -14.046 11.394
21 HG3 ARG 300 HG3 ARG 300 17.082 -15.073 11.548
22 HD2 ARG 300 HD2 ARG 300 17.656 -13.955 13.659
23 HD3 ARG 300 HD3 ARG 300 16.264 -12.868 13.466
24 HE ARG 300 HE ARG 300 15.304 -15.528 13.376
25 HH11 ARG 300 HH11 ARG 300 16.739 -13.354 15.762
26 HH12 ARG 300 HH12 ARG 300 15.938 -14.142 17.094
27 HH21 ARG 300 HH21 ARG 300 14.302 -16.467 15.132
28 HH22 ARG 300 HH22 ARG 300 14.590 -15.868 16.742
29 H ARG 301 H ARG 301 16.043 -10.405 9.190
30 HA ARG 301 HA ARG 301 18.205 -9.476 7.444
31 HB2 ARG 301 HB2 ARG 301 15.644 -8.281 8.463
32 HB3 ARG 301 HB3 ARG 301 16.747 -7.421 7.393
33 HG2 ARG 301 HG2 ARG 301 16.426 -9.066 5.647
34 HG3 ARG 301 HG3 ARG 301 15.333 -10.009 6.712
35 HD2 ARG 301 HD2 ARG 301 13.870 -8.169 6.956
36 HD3 ARG 301 HD3 ARG 301 15.015 -7.077 6.182
37 HE ARG 301 HE ARG 301 14.275 -9.029 4.285
38 HH11 ARG 301 HH11 ARG 301 12.846 -6.366 6.100
39 HH12 ARG 301 HH12 ARG 301 11.688 -5.997 4.831
40 HH21 ARG 301 HH21 ARG 301 12.769 -8.504 2.697
41 HH22 ARG 301 HH22 ARG 301 11.646 -7.198 2.946
42 H LYS 302 H LYS 302 18.396 -9.659 10.628
43 HA LYS 302 HA LYS 302 19.537 -8.565 12.298
44 HB2 LYS 302 HB2 LYS 302 20.399 -6.295 10.568
45 HB3 LYS 302 HB3 LYS 302 21.260 -7.064 11.878
46 HG2 LYS 302 HG2 LYS 302 22.152 -8.746 10.490
47 HG3 LYS 302 HG3 LYS 302 20.913 -8.539 9.241
48 HD2 LYS 302 HD2 LYS 302 22.921 -6.355 9.940
49 HD3 LYS 302 HD3 LYS 302 23.221 -7.558 8.672
50 HE2 LYS 302 HE2 LYS 302 21.393 -6.746 7.319
51 HE3 LYS 302 HE3 LYS 302 20.707 -5.824 8.653
52 HZ1 LYS 302 HZ1 LYS 302 21.733 -4.286 7.201
53 HZ2 LYS 302 HZ2 LYS 302 23.153 -5.131 7.145
54 HZ3 LYS 302 HZ3 LYS 302 22.693 -4.361 8.529
55 H SEP 303 H SEP 303 16.832 -7.508 11.019
56 HA SEP 303 HA SEP 303 17.045 -4.633 11.526
57 HB2 SEP 303 HB2 SEP 303 15.045 -4.506 10.064
58 HB3 SEP 303 HB3 SEP 303 16.372 -5.413 9.314
59 H GLY 304 H GLY 304 14.508 -3.769 11.830
60 HA2 GLY 304 HA2 GLY 304 12.962 -3.386 13.574
61 HA3 GLY 304 HA3 GLY 304 13.747 -4.637 14.550
62 H LYS 305 H LYS 305 15.413 -4.100 15.923
63 HA LYS 305 HA LYS 305 15.521 -1.430 16.880
64 HB2 LYS 305 HB2 LYS 305 16.160 -3.381 18.236
65 HB3 LYS 305 HB3 LYS 305 17.528 -3.703 17.168
66 HG2 LYS 305 HG2 LYS 305 18.350 -2.683 19.195
67 HG3 LYS 305 HG3 LYS 305 18.571 -1.546 17.860
68 HD2 LYS 305 HD2 LYS 305 16.514 -0.331 18.577
69 HD3 LYS 305 HD3 LYS 305 16.344 -1.463 19.938
70 HE2 LYS 305 HE2 LYS 305 18.576 -0.761 20.776
71 HE3 LYS 305 HE3 LYS 305 18.720 0.377 19.422
72 HZ1 LYS 305 HZ1 LYS 305 16.636 0.481 21.532
73 HZ2 LYS 305 HZ2 LYS 305 16.770 1.538 20.272
74 HZ3 LYS 305 HZ3 LYS 305 17.946 1.477 21.428
75 H TYR 306 H TYR 306 17.659 -3.136 14.604
76 HA TYR 306 HA TYR 306 19.422 -0.800 14.444
77 HB2 TYR 306 HB2 TYR 306 19.455 -3.440 12.961
78 HB3 TYR 306 HB3 TYR 306 20.725 -2.211 12.913
79 HD1 TYR 306 HD1 TYR 306 22.112 -1.742 14.944
80 HD2 TYR 306 HD2 TYR 306 19.220 -4.932 14.899
81 HE1 TYR 306 HE1 TYR 306 23.157 -2.734 16.985
82 HE2 TYR 306 HE2 TYR 306 20.271 -5.909 16.934
83 HH TYR 306 HH TYR 306 21.945 -5.736 18.483
84 H LYS 307 H LYS 307 16.489 -1.613 12.955
85 HA LYS 307 HA LYS 307 17.069 -0.963 10.232
86 HB2 LYS 307 HB2 LYS 307 14.883 -1.825 11.644
87 HB3 LYS 307 HB3 LYS 307 14.396 -0.178 11.241
88 HG2 LYS 307 HG2 LYS 307 14.727 -0.632 8.885
89 HG3 LYS 307 HG3 LYS 307 15.385 -2.239 9.257
90 HD2 LYS 307 HD2 LYS 307 13.219 -2.817 10.353
91 HD3 LYS 307 HD3 LYS 307 12.554 -1.269 9.790
92 HE2 LYS 307 HE2 LYS 307 12.825 -1.926 7.485
93 HE3 LYS 307 HE3 LYS 307 13.785 -3.346 7.950
94 HZ1 LYS 307 HZ1 LYS 307 11.512 -3.956 7.469
95 HZ2 LYS 307 HZ2 LYS 307 10.939 -2.950 8.647
96 HZ3 LYS 307 HZ3 LYS 307 11.870 -4.263 9.047
97 H LYS 308 H LYS 308 15.845 1.063 12.917
98 HA LYS 308 HA LYS 308 15.808 3.480 11.347
99 HB2 LYS 308 HB2 LYS 308 14.525 3.066 13.481
100 HB3 LYS 308 HB3 LYS 308 16.043 3.169 14.368
101 HG2 LYS 308 HG2 LYS 308 14.900 5.289 14.579
102 HG3 LYS 308 HG3 LYS 308 16.330 5.527 13.574
103 HD2 LYS 308 HD2 LYS 308 14.550 6.777 12.567
104 HD3 LYS 308 HD3 LYS 308 14.832 5.373 11.531
105 HE2 LYS 308 HE2 LYS 308 12.903 4.212 12.621
106 HE3 LYS 308 HE3 LYS 308 12.598 5.674 13.589
107 HZ1 LYS 308 HZ1 LYS 308 12.579 5.537 10.624
108 HZ2 LYS 308 HZ2 LYS 308 12.213 6.873 11.527
109 HZ3 LYS 308 HZ3 LYS 308 11.227 5.548 11.571
110 H VAL 309 H VAL 309 18.268 1.782 13.211
111 HA VAL 309 HA VAL 309 20.129 3.978 13.316
112 HB VAL 309 HB VAL 309 20.466 0.979 13.662
113 HG11 VAL 309 HG11 VAL 309 22.610 1.769 12.795
114 HG12 VAL 309 HG12 VAL 309 22.594 3.155 13.905
115 HG13 VAL 309 HG13 VAL 309 22.761 1.502 14.539
116 HG21 VAL 309 HG21 VAL 309 20.594 3.374 15.513
117 HG22 VAL 309 HG22 VAL 309 19.270 2.184 15.425
118 HG23 VAL 309 HG23 VAL 309 20.873 1.683 16.005
119 H GLU 310 H GLU 310 19.531 1.353 10.938
120 HA GLU 310 HA GLU 310 21.863 1.842 9.392
121 HB2 GLU 310 HB2 GLU 310 19.951 0.018 9.272
122 HB3 GLU 310 HB3 GLU 310 19.235 1.117 8.093
123 HG2 GLU 310 HG2 GLU 310 21.107 0.869 6.611
124 HG3 GLU 310 HG3 GLU 310 22.103 0.144 7.885
125 H ILE 311 H ILE 311 18.627 3.382 9.348
126 HA ILE 311 HA ILE 311 19.256 5.214 7.201
127 HB ILE 311 HB ILE 311 17.170 5.415 9.432
128 HG12 ILE 311 HG12 ILE 311 16.857 3.400 8.102
129 HG13 ILE 311 HG13 ILE 311 15.593 4.567 7.769
130 HG21 ILE 311 HG21 ILE 311 15.974 6.967 7.871
131 HG22 ILE 311 HG22 ILE 311 17.512 7.626 8.447
132 HG23 ILE 311 HG23 ILE 311 17.399 6.963 6.805
133 HD11 ILE 311 HD11 ILE 311 17.959 3.946 5.934
134 HD12 ILE 311 HD12 ILE 311 16.271 3.456 5.693
135 HD13 ILE 311 HD13 ILE 311 16.711 5.171 5.604
136 H LYS 312 H LYS 312 19.556 5.360 10.754
137 HA LYS 312 HA LYS 312 20.247 8.143 10.908
138 HB2 LYS 312 HB2 LYS 312 19.592 6.684 12.847
139 HB3 LYS 312 HB3 LYS 312 21.145 5.867 12.706
140 HG2 LYS 312 HG2 LYS 312 21.873 8.555 12.872
141 HG3 LYS 312 HG3 LYS 312 20.471 8.454 13.937
142 HD2 LYS 312 HD2 LYS 312 22.432 8.059 15.268
143 HD3 LYS 312 HD3 LYS 312 21.565 6.523 15.116
144 HE2 LYS 312 HE2 LYS 312 23.985 6.182 14.863
145 HE3 LYS 312 HE3 LYS 312 23.144 5.783 13.363
146 HZ1 LYS 312 HZ1 LYS 312 24.596 8.315 13.861
147 HZ2 LYS 312 HZ2 LYS 312 23.849 7.896 12.447
148 HZ3 LYS 312 HZ3 LYS 312 25.161 7.037 12.977
149 H GLU 313 H GLU 313 22.223 5.175 10.537
150 HA GLU 313 HA GLU 313 24.744 6.570 10.477
151 HB2 GLU 313 HB2 GLU 313 23.824 3.898 10.286
152 HB3 GLU 313 HB3 GLU 313 24.762 4.199 8.822
153 HG2 GLU 313 HG2 GLU 313 26.199 3.308 10.579
154 HG3 GLU 313 HG3 GLU 313 26.654 4.977 10.194
155 H LEU 314 H LEU 314 22.382 5.769 7.918
156 HA LEU 314 HA LEU 314 24.084 6.650 5.747
157 HB2 LEU 314 HB2 LEU 314 21.310 5.759 6.149
158 HB3 LEU 314 HB3 LEU 314 21.436 7.037 4.956
159 HG LEU 314 HG LEU 314 21.420 4.804 3.952
160 HD11 LEU 314 HD11 LEU 314 23.277 5.138 2.415
161 HD12 LEU 314 HD12 LEU 314 24.093 6.213 3.571
162 HD13 LEU 314 HD13 LEU 314 22.555 6.707 2.828
163 HD21 LEU 314 HD21 LEU 314 24.124 4.374 5.289
164 HD22 LEU 314 HD22 LEU 314 23.314 3.283 4.142
165 HD23 LEU 314 HD23 LEU 314 22.606 3.565 5.744
166 H GLY 315 H GLY 315 22.179 8.290 8.127
167 HA2 GLY 315 HA2 GLY 315 22.182 10.565 8.576
168 HA3 GLY 315 HA3 GLY 315 23.087 10.853 7.085
169 H GLU 316 H GLU 316 20.321 8.966 6.449
170 HA GLU 316 HA GLU 316 19.164 11.097 4.896
171 HB2 GLU 316 HB2 GLU 316 18.696 8.249 5.308
172 HB3 GLU 316 HB3 GLU 316 17.182 9.150 5.172
173 HG2 GLU 316 HG2 GLU 316 19.472 9.160 3.179
174 HG3 GLU 316 HG3 GLU 316 17.906 8.358 2.976
175 H LEU 317 H LEU 317 19.019 10.576 8.195
176 HA LEU 317 HA LEU 317 16.317 11.358 8.787
177 HB2 LEU 317 HB2 LEU 317 18.861 11.962 10.352
178 HB3 LEU 317 HB3 LEU 317 17.217 12.027 10.970
179 HG LEU 317 HG LEU 317 18.672 9.511 10.150
180 HD11 LEU 317 HD11 LEU 317 19.604 10.710 12.035
181 HD12 LEU 317 HD12 LEU 317 18.719 9.283 12.634
182 HD13 LEU 317 HD13 LEU 317 17.989 10.907 12.753
183 HD21 LEU 317 HD21 LEU 317 16.300 9.191 9.888
184 HD22 LEU 317 HD22 LEU 317 15.963 10.035 11.416
185 HD23 LEU 317 HD23 LEU 317 16.780 8.446 11.423
186 H ARG 318 H ARG 318 19.034 13.005 7.444
187 HA ARG 318 HA ARG 318 18.380 15.716 8.190
188 HB2 ARG 318 HB2 ARG 318 20.600 14.882 7.377
189 HB3 ARG 318 HB3 ARG 318 19.876 14.526 5.812
190 HG2 ARG 318 HG2 ARG 318 21.072 16.532 5.536
191 HG3 ARG 318 HG3 ARG 318 19.369 16.987 5.576
192 HD2 ARG 318 HD2 ARG 318 20.575 18.584 6.907
193 HD3 ARG 318 HD3 ARG 318 19.646 17.565 8.014
194 HE ARG 318 HE ARG 318 21.621 16.637 8.842
195 HH11 ARG 318 HH11 ARG 318 22.413 18.673 6.066
196 HH12 ARG 318 HH12 ARG 318 24.122 18.617 6.397
197 HH21 ARG 318 HH21 ARG 318 23.814 16.610 9.193
198 HH22 ARG 318 HH22 ARG 318 24.897 17.474 8.137
199 H LYS 319 H LYS 319 17.150 13.449 5.805
200 HA LYS 319 HA LYS 319 15.621 15.645 4.498
201 HB2 LYS 319 HB2 LYS 319 17.457 14.813 3.106
202 HB3 LYS 319 HB3 LYS 319 16.902 13.159 3.323
203 HG2 LYS 319 HG2 LYS 319 14.822 13.725 2.151
204 HG3 LYS 319 HG3 LYS 319 15.431 15.362 1.882
205 HD2 LYS 319 HD2 LYS 319 16.789 14.698 0.197
206 HD3 LYS 319 HD3 LYS 319 17.350 13.278 1.092
207 HE2 LYS 319 HE2 LYS 319 14.702 13.469 -0.400
208 HE3 LYS 319 HE3 LYS 319 16.173 12.688 -1.011
209 HZ1 LYS 319 HZ1 LYS 319 15.194 10.895 -0.089
210 HZ2 LYS 319 HZ2 LYS 319 14.293 11.755 0.982
211 HZ3 LYS 319 HZ3 LYS 319 15.884 11.429 1.316
212 H GLU 320 H GLU 320 15.385 12.074 4.026
213 HA GLU 320 HA GLU 320 12.682 12.197 5.309
214 HB2 GLU 320 HB2 GLU 320 13.397 11.145 2.564
215 HB3 GLU 320 HB3 GLU 320 11.908 10.710 3.403
216 HG2 GLU 320 HG2 GLU 320 10.882 12.617 2.822
217 HG3 GLU 320 HG3 GLU 320 12.265 13.612 3.292
218 HA PRO 321 HA PRO 321 14.760 8.451 6.668
219 HB2 PRO 321 HB2 PRO 321 13.177 7.784 8.781
220 HB3 PRO 321 HB3 PRO 321 14.459 9.027 8.889
221 HG2 PRO 321 HG2 PRO 321 11.504 9.414 8.456
222 HG3 PRO 321 HG3 PRO 321 12.589 10.244 9.617
223 HD2 PRO 321 HD2 PRO 321 11.907 11.351 7.232
224 HD3 PRO 321 HD3 PRO 321 13.542 11.579 7.946
225 H SER 322 H SER 322 14.393 6.610 5.636
226 HA SER 322 HA SER 322 11.718 6.062 4.544
227 HB2 SER 322 HB2 SER 322 13.727 5.850 3.120
228 HB3 SER 322 HB3 SER 322 14.354 4.586 4.200
229 HG SER 322 HG SER 322 12.045 3.692 3.680
230 H LEU 323 H LEU 323 13.781 4.891 7.106
231 HA LEU 323 HA LEU 323 11.741 2.883 7.876
232 HB2 LEU 323 HB2 LEU 323 14.731 2.293 7.691
233 HB3 LEU 323 HB3 LEU 323 13.497 1.212 8.319
234 HG LEU 323 HG LEU 323 13.586 2.097 5.434
235 HD11 LEU 323 HD11 LEU 323 15.665 1.009 6.291
236 HD12 LEU 323 HD12 LEU 323 14.823 0.092 5.018
237 HD13 LEU 323 HD13 LEU 323 14.687 -0.407 6.720
238 HD21 LEU 323 HD21 LEU 323 12.294 -0.113 5.272
239 HD22 LEU 323 HD22 LEU 323 11.441 1.254 6.020
240 HD23 LEU 323 HD23 LEU 323 12.139 -0.010 7.049
Start of MODEL 14
1 H1 THR 298 H1 THR 298 20.203 -18.107 9.107
2 H2 THR 298 H2 THR 298 19.111 -17.804 7.906
3 H3 THR 298 H3 THR 298 19.697 -16.563 8.817
4 HA THR 298 HA THR 298 18.020 -18.765 9.832
5 HB THR 298 HB THR 298 17.885 -17.332 11.887
6 HG1 THR 298 HG1 THR 298 19.521 -15.652 12.011
7 HG21 THR 298 HG21 THR 298 20.057 -17.842 12.791
8 HG22 THR 298 HG22 THR 298 20.788 -17.919 11.174
9 HG23 THR 298 HG23 THR 298 19.617 -19.163 11.691
10 H ASN 299 H ASN 299 16.034 -17.410 11.010
11 HA ASN 299 HA ASN 299 14.709 -16.124 8.709
12 HB2 ASN 299 HB2 ASN 299 12.703 -16.388 10.003
13 HB3 ASN 299 HB3 ASN 299 13.622 -17.892 10.155
14 HD21 ASN 299 HD21 ASN 299 11.648 -16.126 11.862
15 HD22 ASN 299 HD22 ASN 299 12.375 -16.214 13.446
16 H ARG 300 H ARG 300 16.742 -14.932 11.027
17 HA ARG 300 HA ARG 300 15.131 -12.699 11.967
18 HB2 ARG 300 HB2 ARG 300 18.068 -13.414 12.157
19 HB3 ARG 300 HB3 ARG 300 17.455 -11.853 12.716
20 HG2 ARG 300 HG2 ARG 300 16.299 -14.478 13.715
21 HG3 ARG 300 HG3 ARG 300 17.688 -13.685 14.489
22 HD2 ARG 300 HD2 ARG 300 16.364 -11.649 14.850
23 HD3 ARG 300 HD3 ARG 300 14.981 -12.381 14.028
24 HE ARG 300 HE ARG 300 15.682 -14.078 16.161
25 HH11 ARG 300 HH11 ARG 300 14.407 -10.794 15.724
26 HH12 ARG 300 HH12 ARG 300 13.485 -10.878 17.206
27 HH21 ARG 300 HH21 ARG 300 14.496 -14.074 18.050
28 HH22 ARG 300 HH22 ARG 300 13.548 -12.684 18.498
29 H ARG 301 H ARG 301 14.953 -10.740 11.293
30 HA ARG 301 HA ARG 301 15.844 -10.091 8.534
31 HB2 ARG 301 HB2 ARG 301 13.913 -8.934 10.557
32 HB3 ARG 301 HB3 ARG 301 14.369 -8.018 9.156
33 HG2 ARG 301 HG2 ARG 301 12.327 -9.001 8.549
34 HG3 ARG 301 HG3 ARG 301 13.531 -10.019 7.744
35 HD2 ARG 301 HD2 ARG 301 11.720 -11.357 8.821
36 HD3 ARG 301 HD3 ARG 301 13.313 -11.718 9.485
37 HE ARG 301 HE ARG 301 12.778 -10.628 11.518
38 HH11 ARG 301 HH11 ARG 301 9.991 -10.637 9.326
39 HH12 ARG 301 HH12 ARG 301 8.887 -10.202 10.603
40 HH21 ARG 301 HH21 ARG 301 11.345 -10.035 13.059
41 HH22 ARG 301 HH22 ARG 301 9.637 -9.897 12.686
42 H LYS 302 H LYS 302 17.343 -9.816 11.400
43 HA LYS 302 HA LYS 302 18.896 -8.401 12.377
44 HB2 LYS 302 HB2 LYS 302 18.935 -6.832 9.770
45 HB3 LYS 302 HB3 LYS 302 20.136 -6.787 11.048
46 HG2 LYS 302 HG2 LYS 302 20.861 -9.052 10.472
47 HG3 LYS 302 HG3 LYS 302 19.584 -9.150 9.229
48 HD2 LYS 302 HD2 LYS 302 20.519 -7.089 8.166
49 HD3 LYS 302 HD3 LYS 302 21.850 -7.114 9.333
50 HE2 LYS 302 HE2 LYS 302 22.587 -9.293 8.458
51 HE3 LYS 302 HE3 LYS 302 21.217 -9.304 7.319
52 HZ1 LYS 302 HZ1 LYS 302 23.236 -8.464 6.260
53 HZ2 LYS 302 HZ2 LYS 302 23.375 -7.258 7.379
54 HZ3 LYS 302 HZ3 LYS 302 22.101 -7.268 6.333
55 H SEP 303 H SEP 303 16.303 -7.981 12.947
56 HA SEP 303 HA SEP 303 15.181 -5.786 11.768
57 HB2 SEP 303 HB2 SEP 303 14.185 -6.957 14.406
58 HB3 SEP 303 HB3 SEP 303 13.209 -6.347 13.051
59 H GLY 304 H GLY 304 15.095 -3.500 12.140
60 HA2 GLY 304 HA2 GLY 304 13.394 -2.362 13.262
61 HA3 GLY 304 HA3 GLY 304 13.491 -3.529 14.592
62 H LYS 305 H LYS 305 15.186 -3.292 16.178
63 HA LYS 305 HA LYS 305 15.724 -0.528 16.885
64 HB2 LYS 305 HB2 LYS 305 17.118 -1.436 18.666
65 HB3 LYS 305 HB3 LYS 305 15.584 -2.307 18.598
66 HG2 LYS 305 HG2 LYS 305 16.705 -4.189 17.428
67 HG3 LYS 305 HG3 LYS 305 18.249 -3.316 17.530
68 HD2 LYS 305 HD2 LYS 305 18.052 -3.296 20.007
69 HD3 LYS 305 HD3 LYS 305 16.546 -4.231 19.878
70 HE2 LYS 305 HE2 LYS 305 17.785 -6.064 18.756
71 HE3 LYS 305 HE3 LYS 305 19.290 -5.128 18.897
72 HZ1 LYS 305 HZ1 LYS 305 19.050 -5.224 21.311
73 HZ2 LYS 305 HZ2 LYS 305 19.083 -6.749 20.683
74 HZ3 LYS 305 HZ3 LYS 305 17.655 -6.094 21.181
75 H TYR 306 H TYR 306 17.192 -3.017 14.953
76 HA TYR 306 HA TYR 306 19.741 -1.670 14.554
77 HB2 TYR 306 HB2 TYR 306 19.433 -4.106 14.092
78 HB3 TYR 306 HB3 TYR 306 18.209 -3.693 12.918
79 HD1 TYR 306 HD1 TYR 306 21.755 -2.536 13.613
80 HD2 TYR 306 HD2 TYR 306 18.836 -3.770 10.677
81 HE1 TYR 306 HE1 TYR 306 23.437 -2.242 11.786
82 HE2 TYR 306 HE2 TYR 306 20.521 -3.453 8.881
83 HH TYR 306 HH TYR 306 22.576 -2.571 8.346
84 H LYS 307 H LYS 307 16.674 -2.002 12.704
85 HA LYS 307 HA LYS 307 17.596 -0.719 10.395
86 HB2 LYS 307 HB2 LYS 307 14.822 -1.026 11.523
87 HB3 LYS 307 HB3 LYS 307 15.117 -0.169 10.015
88 HG2 LYS 307 HG2 LYS 307 15.840 -3.080 10.562
89 HG3 LYS 307 HG3 LYS 307 14.460 -2.514 9.616
90 HD2 LYS 307 HD2 LYS 307 17.412 -2.157 8.894
91 HD3 LYS 307 HD3 LYS 307 16.269 -3.271 8.140
92 HE2 LYS 307 HE2 LYS 307 14.891 -1.272 7.434
93 HE3 LYS 307 HE3 LYS 307 16.198 -0.227 8.027
94 HZ1 LYS 307 HZ1 LYS 307 16.365 -0.666 5.652
95 HZ2 LYS 307 HZ2 LYS 307 16.480 -2.281 5.922
96 HZ3 LYS 307 HZ3 LYS 307 17.690 -1.285 6.454
97 H LYS 308 H LYS 308 16.123 0.742 13.301
98 HA LYS 308 HA LYS 308 15.971 3.356 12.112
99 HB2 LYS 308 HB2 LYS 308 15.618 4.209 14.323
100 HB3 LYS 308 HB3 LYS 308 14.688 2.723 14.100
101 HG2 LYS 308 HG2 LYS 308 16.499 1.488 15.329
102 HG3 LYS 308 HG3 LYS 308 17.253 3.049 15.694
103 HD2 LYS 308 HD2 LYS 308 14.413 2.254 16.459
104 HD3 LYS 308 HD3 LYS 308 15.815 2.168 17.542
105 HE2 LYS 308 HE2 LYS 308 16.148 4.632 17.267
106 HE3 LYS 308 HE3 LYS 308 14.689 4.699 16.259
107 HZ1 LYS 308 HZ1 LYS 308 13.413 3.892 18.152
108 HZ2 LYS 308 HZ2 LYS 308 14.202 5.286 18.546
109 HZ3 LYS 308 HZ3 LYS 308 14.766 3.836 19.094
110 H VAL 309 H VAL 309 18.682 1.576 13.437
111 HA VAL 309 HA VAL 309 20.384 3.968 13.645
112 HB VAL 309 HB VAL 309 20.955 0.970 13.810
113 HG11 VAL 309 HG11 VAL 309 22.931 1.962 12.769
114 HG12 VAL 309 HG12 VAL 309 22.945 3.275 13.967
115 HG13 VAL 309 HG13 VAL 309 23.286 1.601 14.464
116 HG21 VAL 309 HG21 VAL 309 21.539 1.527 16.098
117 HG22 VAL 309 HG22 VAL 309 21.162 3.244 15.765
118 HG23 VAL 309 HG23 VAL 309 19.873 2.008 15.723
119 H GLU 310 H GLU 310 19.837 1.230 11.406
120 HA GLU 310 HA GLU 310 21.949 1.847 9.637
121 HB2 GLU 310 HB2 GLU 310 20.476 -0.212 9.726
122 HB3 GLU 310 HB3 GLU 310 19.239 0.709 8.866
123 HG2 GLU 310 HG2 GLU 310 20.667 0.931 6.932
124 HG3 GLU 310 HG3 GLU 310 22.054 0.271 7.821
125 H ILE 311 H ILE 311 18.504 2.976 9.548
126 HA ILE 311 HA ILE 311 19.033 4.654 7.256
127 HB ILE 311 HB ILE 311 16.808 5.551 7.557
128 HG12 ILE 311 HG12 ILE 311 16.727 4.209 10.265
129 HG13 ILE 311 HG13 ILE 311 16.936 5.937 10.003
130 HG21 ILE 311 HG21 ILE 311 17.142 3.162 6.730
131 HG22 ILE 311 HG22 ILE 311 16.664 2.614 8.349
132 HG23 ILE 311 HG23 ILE 311 15.524 3.531 7.347
133 HD11 ILE 311 HD11 ILE 311 14.698 6.002 8.873
134 HD12 ILE 311 HD12 ILE 311 14.472 4.292 9.315
135 HD13 ILE 311 HD13 ILE 311 14.629 5.525 10.583
136 H LYS 312 H LYS 312 19.657 5.071 10.648
137 HA LYS 312 HA LYS 312 19.715 7.998 10.544
138 HB2 LYS 312 HB2 LYS 312 19.339 6.765 12.678
139 HB3 LYS 312 HB3 LYS 312 20.947 6.062 12.535
140 HG2 LYS 312 HG2 LYS 312 21.888 8.419 12.604
141 HG3 LYS 312 HG3 LYS 312 20.254 8.981 12.975
142 HD2 LYS 312 HD2 LYS 312 21.328 8.767 15.079
143 HD3 LYS 312 HD3 LYS 312 20.282 7.342 14.947
144 HE2 LYS 312 HE2 LYS 312 22.444 6.638 15.815
145 HE3 LYS 312 HE3 LYS 312 22.274 6.013 14.165
146 HZ1 LYS 312 HZ1 LYS 312 24.403 6.890 14.242
147 HZ2 LYS 312 HZ2 LYS 312 23.961 8.251 15.078
148 HZ3 LYS 312 HZ3 LYS 312 23.556 8.072 13.488
149 H GLU 313 H GLU 313 22.165 5.363 10.724
150 HA GLU 313 HA GLU 313 24.411 7.095 10.339
151 HB2 GLU 313 HB2 GLU 313 23.865 4.276 10.515
152 HB3 GLU 313 HB3 GLU 313 24.968 4.559 9.166
153 HG2 GLU 313 HG2 GLU 313 26.196 4.130 11.246
154 HG3 GLU 313 HG3 GLU 313 26.502 5.767 10.640
155 H LEU 314 H LEU 314 22.298 5.518 7.913
156 HA LEU 314 HA LEU 314 24.031 6.332 5.701
157 HB2 LEU 314 HB2 LEU 314 21.391 4.990 6.034
158 HB3 LEU 314 HB3 LEU 314 21.644 5.849 4.536
159 HG LEU 314 HG LEU 314 22.087 3.449 4.348
160 HD11 LEU 314 HD11 LEU 314 24.144 3.649 3.069
161 HD12 LEU 314 HD12 LEU 314 24.574 5.149 3.920
162 HD13 LEU 314 HD13 LEU 314 23.156 5.109 2.846
163 HD21 LEU 314 HD21 LEU 314 23.054 3.027 6.589
164 HD22 LEU 314 HD22 LEU 314 24.508 3.941 6.126
165 HD23 LEU 314 HD23 LEU 314 24.094 2.432 5.282
166 H GLY 315 H GLY 315 21.961 8.058 7.721
167 HA2 GLY 315 HA2 GLY 315 21.347 10.273 7.606
168 HA3 GLY 315 HA3 GLY 315 22.203 10.402 6.064
169 H GLU 316 H GLU 316 19.681 7.981 6.438
170 HA GLU 316 HA GLU 316 18.140 9.121 4.260
171 HB2 GLU 316 HB2 GLU 316 17.308 7.072 6.324
172 HB3 GLU 316 HB3 GLU 316 16.537 7.363 4.772
173 HG2 GLU 316 HG2 GLU 316 19.302 6.234 5.260
174 HG3 GLU 316 HG3 GLU 316 17.895 5.371 4.630
175 H LEU 317 H LEU 317 18.245 9.457 7.703
176 HA LEU 317 HA LEU 317 15.659 10.612 8.133
177 HB2 LEU 317 HB2 LEU 317 18.257 11.099 9.641
178 HB3 LEU 317 HB3 LEU 317 16.644 11.546 10.190
179 HG LEU 317 HG LEU 317 17.610 8.710 9.798
180 HD11 LEU 317 HD11 LEU 317 17.123 10.509 12.190
181 HD12 LEU 317 HD12 LEU 317 18.710 10.067 11.522
182 HD13 LEU 317 HD13 LEU 317 17.675 8.812 12.252
183 HD21 LEU 317 HD21 LEU 317 15.031 9.919 10.870
184 HD22 LEU 317 HD22 LEU 317 15.525 8.226 11.146
185 HD23 LEU 317 HD23 LEU 317 15.205 8.801 9.497
186 H ARG 318 H ARG 318 18.443 11.823 6.501
187 HA ARG 318 HA ARG 318 17.354 14.613 6.655
188 HB2 ARG 318 HB2 ARG 318 20.109 13.618 5.811
189 HB3 ARG 318 HB3 ARG 318 19.584 15.305 5.803
190 HG2 ARG 318 HG2 ARG 318 19.879 13.546 8.266
191 HG3 ARG 318 HG3 ARG 318 20.971 14.848 7.756
192 HD2 ARG 318 HD2 ARG 318 19.008 16.435 7.903
193 HD3 ARG 318 HD3 ARG 318 18.070 15.113 8.630
194 HE ARG 318 HE ARG 318 20.536 15.488 10.042
195 HH11 ARG 318 HH11 ARG 318 17.343 16.942 9.665
196 HH12 ARG 318 HH12 ARG 318 17.396 17.699 11.235
197 HH21 ARG 318 HH21 ARG 318 20.536 16.481 12.038
198 HH22 ARG 318 HH22 ARG 318 19.167 17.425 12.560
199 H LYS 319 H LYS 319 16.682 12.079 5.011
200 HA LYS 319 HA LYS 319 16.347 13.552 2.441
201 HB2 LYS 319 HB2 LYS 319 17.195 10.626 2.749
202 HB3 LYS 319 HB3 LYS 319 16.718 11.403 1.228
203 HG2 LYS 319 HG2 LYS 319 18.650 13.019 1.584
204 HG3 LYS 319 HG3 LYS 319 19.192 11.964 2.897
205 HD2 LYS 319 HD2 LYS 319 18.762 11.088 0.010
206 HD3 LYS 319 HD3 LYS 319 20.330 11.531 0.696
207 HE2 LYS 319 HE2 LYS 319 18.586 9.238 1.691
208 HE3 LYS 319 HE3 LYS 319 19.934 9.061 0.569
209 HZ1 LYS 319 HZ1 LYS 319 20.178 10.067 3.343
210 HZ2 LYS 319 HZ2 LYS 319 21.426 9.837 2.287
211 HZ3 LYS 319 HZ3 LYS 319 20.563 8.539 2.834
212 H GLU 320 H GLU 320 15.293 10.357 2.313
213 HA GLU 320 HA GLU 320 12.761 10.906 3.791
214 HB2 GLU 320 HB2 GLU 320 13.140 9.494 1.111
215 HB3 GLU 320 HB3 GLU 320 11.637 9.496 2.047
216 HG2 GLU 320 HG2 GLU 320 11.522 11.966 1.829
217 HG3 GLU 320 HG3 GLU 320 13.006 11.940 0.862
218 HA PRO 321 HA PRO 321 14.499 7.361 5.697
219 HB2 PRO 321 HB2 PRO 321 12.381 6.151 6.934
220 HB3 PRO 321 HB3 PRO 321 13.060 7.715 7.493
221 HG2 PRO 321 HG2 PRO 321 10.691 7.225 5.692
222 HG3 PRO 321 HG3 PRO 321 10.792 8.243 7.166
223 HD2 PRO 321 HD2 PRO 321 11.029 9.314 4.700
224 HD3 PRO 321 HD3 PRO 321 12.042 9.905 6.065
225 H SER 322 H SER 322 14.907 5.164 5.325
226 HA SER 322 HA SER 322 13.426 4.032 3.004
227 HB2 SER 322 HB2 SER 322 15.451 2.695 2.633
228 HB3 SER 322 HB3 SER 322 15.816 4.434 2.659
229 HG SER 322 HG SER 322 17.307 3.272 3.900
230 H LEU 323 H LEU 323 13.350 1.641 2.924
231 HA LEU 323 HA LEU 323 12.314 0.599 5.488
232 HB2 LEU 323 HB2 LEU 323 11.368 -1.197 4.078
233 HB3 LEU 323 HB3 LEU 323 10.859 0.404 3.555
234 HG LEU 323 HG LEU 323 12.779 0.131 1.778
235 HD11 LEU 323 HD11 LEU 323 13.716 -1.964 2.514
236 HD12 LEU 323 HD12 LEU 323 12.796 -2.292 1.030
237 HD13 LEU 323 HD13 LEU 323 12.106 -2.706 2.624
238 HD21 LEU 323 HD21 LEU 323 10.129 -1.348 1.736
239 HD22 LEU 323 HD22 LEU 323 11.011 -0.703 0.326
240 HD23 LEU 323 HD23 LEU 323 10.330 0.407 1.542
Start of MODEL 15
1 H1 THR 298 H1 THR 298 13.143 -10.049 10.503
2 H2 THR 298 H2 THR 298 13.377 -8.952 11.706
3 H3 THR 298 H3 THR 298 14.634 -9.879 11.184
4 HA THR 298 HA THR 298 12.235 -10.828 12.610
5 HB THR 298 HB THR 298 13.292 -13.059 12.553
6 HG1 THR 298 HG1 THR 298 15.112 -13.163 10.930
7 HG21 THR 298 HG21 THR 298 13.231 -11.958 9.713
8 HG22 THR 298 HG22 THR 298 11.767 -12.351 10.654
9 HG23 THR 298 HG23 THR 298 12.931 -13.627 10.246
10 H ASN 299 H ASN 299 13.019 -12.110 14.650
11 HA ASN 299 HA ASN 299 14.414 -10.266 16.286
12 HB2 ASN 299 HB2 ASN 299 14.249 -11.907 18.038
13 HB3 ASN 299 HB3 ASN 299 12.751 -11.941 17.099
14 HD21 ASN 299 HD21 ASN 299 14.227 -13.966 18.810
15 HD22 ASN 299 HD22 ASN 299 14.321 -15.382 17.791
16 H ARG 300 H ARG 300 15.591 -12.986 14.453
17 HA ARG 300 HA ARG 300 18.144 -13.289 15.724
18 HB2 ARG 300 HB2 ARG 300 17.249 -13.778 12.858
19 HB3 ARG 300 HB3 ARG 300 18.829 -14.254 13.480
20 HG2 ARG 300 HG2 ARG 300 16.226 -15.239 14.707
21 HG3 ARG 300 HG3 ARG 300 17.032 -16.074 13.372
22 HD2 ARG 300 HD2 ARG 300 18.332 -15.495 16.068
23 HD3 ARG 300 HD3 ARG 300 17.560 -17.028 15.623
24 HE ARG 300 HE ARG 300 19.496 -16.378 13.644
25 HH11 ARG 300 HH11 ARG 300 19.382 -17.472 17.002
26 HH12 ARG 300 HH12 ARG 300 20.924 -18.277 16.886
27 HH21 ARG 300 HH21 ARG 300 21.458 -17.427 13.577
28 HH22 ARG 300 HH22 ARG 300 22.071 -18.251 14.984
29 H ARG 301 H ARG 301 16.934 -10.930 13.436
30 HA ARG 301 HA ARG 301 19.620 -9.957 12.721
31 HB2 ARG 301 HB2 ARG 301 17.451 -10.110 11.280
32 HB3 ARG 301 HB3 ARG 301 16.979 -8.635 12.088
33 HG2 ARG 301 HG2 ARG 301 18.472 -7.350 10.942
34 HG3 ARG 301 HG3 ARG 301 19.703 -8.627 10.876
35 HD2 ARG 301 HD2 ARG 301 18.629 -9.722 9.060
36 HD3 ARG 301 HD3 ARG 301 17.139 -8.797 9.267
37 HE ARG 301 HE ARG 301 19.655 -7.853 8.021
38 HH11 ARG 301 HH11 ARG 301 16.300 -7.101 8.919
39 HH12 ARG 301 HH12 ARG 301 16.249 -5.720 7.858
40 HH21 ARG 301 HH21 ARG 301 19.504 -6.054 6.724
41 HH22 ARG 301 HH22 ARG 301 18.021 -5.144 6.643
42 H LYS 302 H LYS 302 17.750 -9.647 15.415
43 HA LYS 302 HA LYS 302 17.545 -8.138 17.125
44 HB2 LYS 302 HB2 LYS 302 19.991 -6.778 15.933
45 HB3 LYS 302 HB3 LYS 302 19.377 -6.588 17.576
46 HG2 LYS 302 HG2 LYS 302 19.877 -8.960 18.049
47 HG3 LYS 302 HG3 LYS 302 20.460 -9.173 16.386
48 HD2 LYS 302 HD2 LYS 302 22.190 -7.435 16.788
49 HD3 LYS 302 HD3 LYS 302 21.653 -7.323 18.480
50 HE2 LYS 302 HE2 LYS 302 22.187 -9.722 18.803
51 HE3 LYS 302 HE3 LYS 302 22.706 -9.837 17.109
52 HZ1 LYS 302 HZ1 LYS 302 24.590 -9.531 18.591
53 HZ2 LYS 302 HZ2 LYS 302 23.971 -8.119 19.173
54 HZ3 LYS 302 HZ3 LYS 302 24.449 -8.222 17.598
55 H SEP 303 H SEP 303 16.230 -7.816 14.649
56 HA SEP 303 HA SEP 303 16.520 -5.441 13.319
57 HB2 SEP 303 HB2 SEP 303 15.302 -7.666 12.776
58 HB3 SEP 303 HB3 SEP 303 13.857 -6.830 13.387
59 H GLY 304 H GLY 304 14.622 -3.921 12.717
60 HA2 GLY 304 HA2 GLY 304 13.040 -2.313 13.325
61 HA3 GLY 304 HA3 GLY 304 12.926 -3.038 14.947
62 H LYS 305 H LYS 305 14.892 -2.746 16.370
63 HA LYS 305 HA LYS 305 15.637 0.063 16.408
64 HB2 LYS 305 HB2 LYS 305 17.096 -0.523 18.278
65 HB3 LYS 305 HB3 LYS 305 15.482 -1.207 18.487
66 HG2 LYS 305 HG2 LYS 305 16.416 -3.416 17.632
67 HG3 LYS 305 HG3 LYS 305 18.030 -2.695 17.758
68 HD2 LYS 305 HD2 LYS 305 16.037 -2.950 20.053
69 HD3 LYS 305 HD3 LYS 305 17.372 -4.072 19.746
70 HE2 LYS 305 HE2 LYS 305 18.995 -2.190 20.021
71 HE3 LYS 305 HE3 LYS 305 17.641 -1.104 20.406
72 HZ1 LYS 305 HZ1 LYS 305 18.390 -3.516 21.969
73 HZ2 LYS 305 HZ2 LYS 305 17.135 -2.506 22.320
74 HZ3 LYS 305 HZ3 LYS 305 18.687 -1.956 22.413
75 H TYR 306 H TYR 306 17.154 -2.980 15.328
76 HA TYR 306 HA TYR 306 19.589 -1.716 14.405
77 HB2 TYR 306 HB2 TYR 306 19.693 -4.066 14.713
78 HB3 TYR 306 HB3 TYR 306 18.191 -4.327 13.818
79 HD1 TYR 306 HD1 TYR 306 21.658 -2.949 13.259
80 HD2 TYR 306 HD2 TYR 306 18.278 -5.036 11.596
81 HE1 TYR 306 HE1 TYR 306 22.893 -3.266 11.123
82 HE2 TYR 306 HE2 TYR 306 19.535 -5.343 9.474
83 HH TYR 306 HH TYR 306 22.684 -3.861 8.887
84 H LYS 307 H LYS 307 16.419 -2.487 12.872
85 HA LYS 307 HA LYS 307 17.188 -1.849 10.239
86 HB2 LYS 307 HB2 LYS 307 15.038 -2.940 10.919
87 HB3 LYS 307 HB3 LYS 307 14.435 -1.350 11.408
88 HG2 LYS 307 HG2 LYS 307 15.551 -1.548 8.643
89 HG3 LYS 307 HG3 LYS 307 14.054 -2.446 8.936
90 HD2 LYS 307 HD2 LYS 307 12.865 -0.462 9.584
91 HD3 LYS 307 HD3 LYS 307 14.349 0.498 9.661
92 HE2 LYS 307 HE2 LYS 307 13.317 -0.765 7.093
93 HE3 LYS 307 HE3 LYS 307 12.906 0.881 7.604
94 HZ1 LYS 307 HZ1 LYS 307 15.270 1.429 7.564
95 HZ2 LYS 307 HZ2 LYS 307 14.779 0.890 6.085
96 HZ3 LYS 307 HZ3 LYS 307 15.659 -0.095 7.074
97 H LYS 308 H LYS 308 16.159 0.248 12.904
98 HA LYS 308 HA LYS 308 16.102 2.620 11.216
99 HB2 LYS 308 HB2 LYS 308 14.741 2.165 13.337
100 HB3 LYS 308 HB3 LYS 308 16.199 2.607 14.241
101 HG2 LYS 308 HG2 LYS 308 16.184 4.836 13.249
102 HG3 LYS 308 HG3 LYS 308 14.892 4.364 12.134
103 HD2 LYS 308 HD2 LYS 308 13.373 4.017 14.070
104 HD3 LYS 308 HD3 LYS 308 14.653 4.623 15.147
105 HE2 LYS 308 HE2 LYS 308 14.676 6.772 13.926
106 HE3 LYS 308 HE3 LYS 308 13.451 6.161 12.798
107 HZ1 LYS 308 HZ1 LYS 308 13.037 6.572 15.705
108 HZ2 LYS 308 HZ2 LYS 308 11.904 6.000 14.650
109 HZ3 LYS 308 HZ3 LYS 308 12.460 7.545 14.504
110 H VAL 309 H VAL 309 18.621 0.928 12.971
111 HA VAL 309 HA VAL 309 20.311 3.216 13.377
112 HB VAL 309 HB VAL 309 20.422 0.566 14.183
113 HG11 VAL 309 HG11 VAL 309 21.433 -0.185 12.025
114 HG12 VAL 309 HG12 VAL 309 22.776 0.955 12.271
115 HG13 VAL 309 HG13 VAL 309 22.538 -0.400 13.392
116 HG21 VAL 309 HG21 VAL 309 22.522 1.190 15.291
117 HG22 VAL 309 HG22 VAL 309 22.685 2.593 14.205
118 HG23 VAL 309 HG23 VAL 309 21.332 2.507 15.369
119 H GLU 310 H GLU 310 19.702 1.059 10.646
120 HA GLU 310 HA GLU 310 21.930 1.715 9.043
121 HB2 GLU 310 HB2 GLU 310 19.080 1.148 8.185
122 HB3 GLU 310 HB3 GLU 310 20.509 1.062 7.148
123 HG2 GLU 310 HG2 GLU 310 19.971 -0.660 9.593
124 HG3 GLU 310 HG3 GLU 310 19.771 -1.143 7.915
125 H ILE 311 H ILE 311 18.689 3.247 9.210
126 HA ILE 311 HA ILE 311 19.442 5.288 7.296
127 HB ILE 311 HB ILE 311 17.236 6.223 7.639
128 HG12 ILE 311 HG12 ILE 311 16.743 4.224 9.850
129 HG13 ILE 311 HG13 ILE 311 17.229 5.893 10.162
130 HG21 ILE 311 HG21 ILE 311 15.886 4.301 6.946
131 HG22 ILE 311 HG22 ILE 311 17.507 4.154 6.243
132 HG23 ILE 311 HG23 ILE 311 17.059 3.172 7.657
133 HD11 ILE 311 HD11 ILE 311 15.197 6.665 8.885
134 HD12 ILE 311 HD12 ILE 311 14.668 4.966 8.813
135 HD13 ILE 311 HD13 ILE 311 14.840 5.780 10.381
136 H LYS 312 H LYS 312 19.992 4.921 10.647
137 HA LYS 312 HA LYS 312 19.949 7.749 11.333
138 HB2 LYS 312 HB2 LYS 312 19.768 5.943 13.037
139 HB3 LYS 312 HB3 LYS 312 21.410 5.427 12.643
140 HG2 LYS 312 HG2 LYS 312 22.332 7.532 13.452
141 HG3 LYS 312 HG3 LYS 312 20.704 8.175 13.712
142 HD2 LYS 312 HD2 LYS 312 21.499 7.497 15.854
143 HD3 LYS 312 HD3 LYS 312 20.303 6.292 15.350
144 HE2 LYS 312 HE2 LYS 312 22.151 5.106 16.316
145 HE3 LYS 312 HE3 LYS 312 22.216 4.831 14.567
146 HZ1 LYS 312 HZ1 LYS 312 24.379 5.343 15.571
147 HZ2 LYS 312 HZ2 LYS 312 23.855 6.859 15.962
148 HZ3 LYS 312 HZ3 LYS 312 23.981 6.393 14.378
149 H GLU 313 H GLU 313 22.475 5.360 10.489
150 HA GLU 313 HA GLU 313 24.581 7.347 10.526
151 HB2 GLU 313 HB2 GLU 313 24.256 4.472 9.912
152 HB3 GLU 313 HB3 GLU 313 25.559 5.281 9.027
153 HG2 GLU 313 HG2 GLU 313 26.309 4.262 11.184
154 HG3 GLU 313 HG3 GLU 313 26.611 6.002 11.062
155 H LEU 314 H LEU 314 22.375 6.118 8.050
156 HA LEU 314 HA LEU 314 23.778 7.293 5.808
157 HB2 LEU 314 HB2 LEU 314 21.317 5.849 6.337
158 HB3 LEU 314 HB3 LEU 314 20.998 7.203 5.284
159 HG LEU 314 HG LEU 314 21.353 5.129 4.049
160 HD11 LEU 314 HD11 LEU 314 21.924 7.308 3.018
161 HD12 LEU 314 HD12 LEU 314 22.919 5.977 2.391
162 HD13 LEU 314 HD13 LEU 314 23.607 7.118 3.568
163 HD21 LEU 314 HD21 LEU 314 24.223 5.199 5.069
164 HD22 LEU 314 HD22 LEU 314 23.511 4.026 3.938
165 HD23 LEU 314 HD23 LEU 314 22.965 4.069 5.627
166 H GLY 315 H GLY 315 21.949 8.627 8.376
167 HA2 GLY 315 HA2 GLY 315 21.473 10.846 8.803
168 HA3 GLY 315 HA3 GLY 315 22.194 11.284 7.247
169 H GLU 316 H GLU 316 19.715 8.836 7.202
170 HA GLU 316 HA GLU 316 17.979 10.490 5.566
171 HB2 GLU 316 HB2 GLU 316 18.196 7.736 6.428
172 HB3 GLU 316 HB3 GLU 316 16.527 8.285 6.612
173 HG2 GLU 316 HG2 GLU 316 17.224 7.184 4.382
174 HG3 GLU 316 HG3 GLU 316 16.283 8.679 4.317
175 H LEU 317 H LEU 317 18.419 9.954 8.952
176 HA LEU 317 HA LEU 317 15.815 10.866 9.814
177 HB2 LEU 317 HB2 LEU 317 18.493 10.990 11.261
178 HB3 LEU 317 HB3 LEU 317 16.908 11.237 11.989
179 HG LEU 317 HG LEU 317 17.904 8.638 10.814
180 HD11 LEU 317 HD11 LEU 317 18.052 8.084 13.204
181 HD12 LEU 317 HD12 LEU 317 17.463 9.724 13.610
182 HD13 LEU 317 HD13 LEU 317 19.032 9.517 12.800
183 HD21 LEU 317 HD21 LEU 317 15.892 7.730 12.012
184 HD22 LEU 317 HD22 LEU 317 15.485 8.746 10.616
185 HD23 LEU 317 HD23 LEU 317 15.342 9.412 12.261
186 H ARG 318 H ARG 318 18.522 12.485 8.411
187 HA ARG 318 HA ARG 318 17.613 15.150 9.406
188 HB2 ARG 318 HB2 ARG 318 19.957 14.347 7.629
189 HB3 ARG 318 HB3 ARG 318 19.606 15.987 8.168
190 HG2 ARG 318 HG2 ARG 318 20.294 13.678 10.021
191 HG3 ARG 318 HG3 ARG 318 21.432 14.907 9.438
192 HD2 ARG 318 HD2 ARG 318 19.908 16.664 10.418
193 HD3 ARG 318 HD3 ARG 318 18.987 15.351 11.182
194 HE ARG 318 HE ARG 318 21.732 15.016 11.819
195 HH11 ARG 318 HH11 ARG 318 19.110 17.257 12.562
196 HH12 ARG 318 HH12 ARG 318 19.801 17.707 14.098
197 HH21 ARG 318 HH21 ARG 318 22.557 15.635 13.790
198 HH22 ARG 318 HH22 ARG 318 21.722 16.802 14.777
199 H LYS 319 H LYS 319 16.792 12.979 7.062
200 HA LYS 319 HA LYS 319 15.938 15.118 5.154
201 HB2 LYS 319 HB2 LYS 319 16.694 12.223 4.509
202 HB3 LYS 319 HB3 LYS 319 16.168 13.458 3.352
203 HG2 LYS 319 HG2 LYS 319 18.247 14.782 4.004
204 HG3 LYS 319 HG3 LYS 319 18.767 13.355 4.917
205 HD2 LYS 319 HD2 LYS 319 18.124 12.241 2.485
206 HD3 LYS 319 HD3 LYS 319 18.706 13.834 1.994
207 HE2 LYS 319 HE2 LYS 319 20.605 12.376 1.961
208 HE3 LYS 319 HE3 LYS 319 20.793 13.399 3.397
209 HZ1 LYS 319 HZ1 LYS 319 19.711 10.626 3.415
210 HZ2 LYS 319 HZ2 LYS 319 19.999 11.564 4.743
211 HZ3 LYS 319 HZ3 LYS 319 21.261 11.027 3.827
212 H GLU 320 H GLU 320 14.745 12.169 4.212
213 HA GLU 320 HA GLU 320 12.410 12.335 6.070
214 HB2 GLU 320 HB2 GLU 320 12.569 11.359 3.195
215 HB3 GLU 320 HB3 GLU 320 11.149 11.210 4.240
216 HG2 GLU 320 HG2 GLU 320 11.127 13.708 4.466
217 HG3 GLU 320 HG3 GLU 320 12.451 13.787 3.290
218 HA PRO 321 HA PRO 321 14.233 8.618 7.361
219 HB2 PRO 321 HB2 PRO 321 12.212 7.256 8.617
220 HB3 PRO 321 HB3 PRO 321 12.963 8.737 9.298
221 HG2 PRO 321 HG2 PRO 321 10.430 8.483 7.676
222 HG3 PRO 321 HG3 PRO 321 10.684 9.321 9.242
223 HD2 PRO 321 HD2 PRO 321 10.713 10.668 6.905
224 HD3 PRO 321 HD3 PRO 321 11.849 11.093 8.235
225 H SER 322 H SER 322 14.839 6.848 6.358
226 HA SER 322 HA SER 322 14.956 5.109 4.916
227 HB2 SER 322 HB2 SER 322 11.977 4.726 5.338
228 HB3 SER 322 HB3 SER 322 13.164 3.511 4.826
229 HG SER 322 HG SER 322 12.848 4.762 7.337
230 H LEU 323 H LEU 323 14.616 7.646 3.769
231 HA LEU 323 HA LEU 323 12.846 7.540 1.491
232 HB2 LEU 323 HB2 LEU 323 13.822 9.612 2.516
233 HB3 LEU 323 HB3 LEU 323 15.419 9.099 1.992
234 HG LEU 323 HG LEU 323 14.668 9.346 -0.369
235 HD11 LEU 323 HD11 LEU 323 12.267 9.142 -0.134
236 HD12 LEU 323 HD12 LEU 323 12.621 10.800 -0.661
237 HD13 LEU 323 HD13 LEU 323 12.220 10.475 1.042
238 HD21 LEU 323 HD21 LEU 323 15.921 10.945 1.046
239 HD22 LEU 323 HD22 LEU 323 14.381 11.699 1.527
240 HD23 LEU 323 HD23 LEU 323 14.911 11.768 -0.173
Start of MODEL 16
1 H1 THR 298 H1 THR 298 19.916 -15.157 10.290
2 H2 THR 298 H2 THR 298 21.164 -16.077 9.725
3 H3 THR 298 H3 THR 298 19.610 -16.440 9.300
4 HA THR 298 HA THR 298 20.417 -17.984 10.976
5 HB THR 298 HB THR 298 20.747 -17.012 13.290
6 HG1 THR 298 HG1 THR 298 21.178 -14.716 13.300
7 HG21 THR 298 HG21 THR 298 22.698 -17.533 11.772
8 HG22 THR 298 HG22 THR 298 23.007 -16.234 12.943
9 HG23 THR 298 HG23 THR 298 22.675 -15.828 11.248
10 H ASN 299 H ASN 299 19.016 -18.422 13.130
11 HA ASN 299 HA ASN 299 16.266 -17.901 12.251
12 HB2 ASN 299 HB2 ASN 299 17.166 -20.144 13.073
13 HB3 ASN 299 HB3 ASN 299 17.140 -19.459 14.704
14 HD21 ASN 299 HD21 ASN 299 15.589 -21.085 15.281
15 HD22 ASN 299 HD22 ASN 299 13.919 -20.912 14.803
16 H ARG 300 H ARG 300 17.481 -15.537 13.046
17 HA ARG 300 HA ARG 300 15.499 -14.531 14.920
18 HB2 ARG 300 HB2 ARG 300 18.295 -15.051 15.838
19 HB3 ARG 300 HB3 ARG 300 17.732 -13.395 16.085
20 HG2 ARG 300 HG2 ARG 300 16.613 -14.015 17.918
21 HG3 ARG 300 HG3 ARG 300 15.640 -15.145 16.963
22 HD2 ARG 300 HD2 ARG 300 17.438 -16.853 17.208
23 HD3 ARG 300 HD3 ARG 300 18.332 -15.726 18.249
24 HE ARG 300 HE ARG 300 15.681 -16.038 19.257
25 HH11 ARG 300 HH11 ARG 300 18.669 -17.908 19.020
26 HH12 ARG 300 HH12 ARG 300 18.288 -18.861 20.430
27 HH21 ARG 300 HH21 ARG 300 15.258 -17.315 21.029
28 HH22 ARG 300 HH22 ARG 300 16.396 -18.530 21.540
29 H ARG 301 H ARG 301 15.040 -12.535 13.998
30 HA ARG 301 HA ARG 301 16.732 -11.695 11.769
31 HB2 ARG 301 HB2 ARG 301 14.118 -11.636 12.060
32 HB3 ARG 301 HB3 ARG 301 14.431 -10.052 12.760
33 HG2 ARG 301 HG2 ARG 301 15.482 -9.287 10.710
34 HG3 ARG 301 HG3 ARG 301 15.459 -10.919 10.028
35 HD2 ARG 301 HD2 ARG 301 13.303 -10.769 9.381
36 HD3 ARG 301 HD3 ARG 301 12.807 -9.931 10.866
37 HE ARG 301 HE ARG 301 14.315 -8.047 9.460
38 HH11 ARG 301 HH11 ARG 301 11.351 -9.860 8.733
39 HH12 ARG 301 HH12 ARG 301 10.733 -8.579 7.727
40 HH21 ARG 301 HH21 ARG 301 13.474 -6.512 8.226
41 HH22 ARG 301 HH22 ARG 301 11.931 -6.714 7.413
42 H LYS 302 H LYS 302 16.506 -10.854 15.092
43 HA LYS 302 HA LYS 302 17.638 -9.364 16.417
44 HB2 LYS 302 HB2 LYS 302 19.400 -10.080 14.340
45 HB3 LYS 302 HB3 LYS 302 19.578 -8.338 14.492
46 HG2 LYS 302 HG2 LYS 302 19.774 -10.238 16.856
47 HG3 LYS 302 HG3 LYS 302 21.159 -9.808 15.840
48 HD2 LYS 302 HD2 LYS 302 20.741 -7.394 16.368
49 HD3 LYS 302 HD3 LYS 302 19.489 -7.906 17.519
50 HE2 LYS 302 HE2 LYS 302 21.190 -9.265 18.730
51 HE3 LYS 302 HE3 LYS 302 22.429 -8.714 17.586
52 HZ1 LYS 302 HZ1 LYS 302 20.898 -6.968 19.425
53 HZ2 LYS 302 HZ2 LYS 302 22.041 -6.448 18.354
54 HZ3 LYS 302 HZ3 LYS 302 22.473 -7.420 19.614
55 H SEP 303 H SEP 303 15.489 -8.465 14.542
56 HA SEP 303 HA SEP 303 16.399 -6.220 13.099
57 HB2 SEP 303 HB2 SEP 303 14.114 -7.996 13.185
58 HB3 SEP 303 HB3 SEP 303 13.568 -6.330 12.936
59 H GLY 304 H GLY 304 15.106 -4.161 12.749
60 HA2 GLY 304 HA2 GLY 304 13.342 -2.723 13.308
61 HA3 GLY 304 HA3 GLY 304 13.136 -3.536 14.869
62 H LYS 305 H LYS 305 15.320 -3.326 16.232
63 HA LYS 305 HA LYS 305 15.561 -0.479 16.810
64 HB2 LYS 305 HB2 LYS 305 17.227 -2.863 17.730
65 HB3 LYS 305 HB3 LYS 305 17.390 -1.221 18.365
66 HG2 LYS 305 HG2 LYS 305 14.866 -2.921 18.564
67 HG3 LYS 305 HG3 LYS 305 16.065 -2.714 19.850
68 HD2 LYS 305 HD2 LYS 305 15.616 -0.249 19.842
69 HD3 LYS 305 HD3 LYS 305 14.372 -0.501 18.605
70 HE2 LYS 305 HE2 LYS 305 13.259 -0.335 20.720
71 HE3 LYS 305 HE3 LYS 305 13.161 -2.023 20.185
72 HZ1 LYS 305 HZ1 LYS 305 15.082 -0.960 22.183
73 HZ2 LYS 305 HZ2 LYS 305 14.994 -2.532 21.692
74 HZ3 LYS 305 HZ3 LYS 305 13.740 -1.857 22.525
75 H TYR 306 H TYR 306 17.390 -2.896 15.011
76 HA TYR 306 HA TYR 306 19.543 -1.010 14.410
77 HB2 TYR 306 HB2 TYR 306 18.905 -3.830 13.499
78 HB3 TYR 306 HB3 TYR 306 20.276 -2.893 12.877
79 HD1 TYR 306 HD2 TYR 306 18.853 -4.488 15.937
80 HD2 TYR 306 HD1 TYR 306 22.257 -2.502 14.210
81 HE1 TYR 306 HE2 TYR 306 20.223 -5.105 17.917
82 HE2 TYR 306 HE1 TYR 306 23.632 -3.147 16.187
83 HH TYR 306 HH TYR 306 23.651 -4.137 18.238
84 H LYS 307 H LYS 307 16.475 -1.972 13.013
85 HA LYS 307 HA LYS 307 16.990 -1.407 10.321
86 HB2 LYS 307 HB2 LYS 307 14.895 -2.425 11.297
87 HB3 LYS 307 HB3 LYS 307 14.392 -0.796 11.739
88 HG2 LYS 307 HG2 LYS 307 13.468 -0.617 9.727
89 HG3 LYS 307 HG3 LYS 307 15.097 -0.581 9.047
90 HD2 LYS 307 HD2 LYS 307 13.863 -3.258 9.595
91 HD3 LYS 307 HD3 LYS 307 13.246 -2.314 8.244
92 HE2 LYS 307 HE2 LYS 307 14.906 -3.726 7.321
93 HE3 LYS 307 HE3 LYS 307 15.624 -2.113 7.375
94 HZ1 LYS 307 HZ1 LYS 307 16.989 -4.121 8.127
95 HZ2 LYS 307 HZ2 LYS 307 16.140 -4.047 9.541
96 HZ3 LYS 307 HZ3 LYS 307 17.072 -2.762 9.042
97 H LYS 308 H LYS 308 15.971 0.751 12.964
98 HA LYS 308 HA LYS 308 16.007 3.078 11.213
99 HB2 LYS 308 HB2 LYS 308 15.714 2.815 14.215
100 HB3 LYS 308 HB3 LYS 308 15.676 4.355 13.331
101 HG2 LYS 308 HG2 LYS 308 13.867 3.217 11.858
102 HG3 LYS 308 HG3 LYS 308 13.723 2.051 13.184
103 HD2 LYS 308 HD2 LYS 308 13.243 3.909 14.745
104 HD3 LYS 308 HD3 LYS 308 13.381 5.066 13.405
105 HE2 LYS 308 HE2 LYS 308 11.371 2.777 13.526
106 HE3 LYS 308 HE3 LYS 308 11.012 4.460 13.954
107 HZ1 LYS 308 HZ1 LYS 308 10.332 4.036 11.704
108 HZ2 LYS 308 HZ2 LYS 308 11.815 3.462 11.272
109 HZ3 LYS 308 HZ3 LYS 308 11.628 5.054 11.639
110 H VAL 309 H VAL 309 18.435 1.426 13.103
111 HA VAL 309 HA VAL 309 20.223 3.693 13.312
112 HB VAL 309 HB VAL 309 20.650 0.686 13.466
113 HG11 VAL 309 HG11 VAL 309 23.004 1.172 14.165
114 HG12 VAL 309 HG12 VAL 309 22.703 1.534 12.456
115 HG13 VAL 309 HG13 VAL 309 22.780 2.858 13.642
116 HG21 VAL 309 HG21 VAL 309 21.196 1.226 15.797
117 HG22 VAL 309 HG22 VAL 309 20.998 2.962 15.444
118 HG23 VAL 309 HG23 VAL 309 19.595 1.867 15.374
119 H GLU 310 H GLU 310 19.532 1.223 10.820
120 HA GLU 310 HA GLU 310 21.724 1.741 9.126
121 HB2 GLU 310 HB2 GLU 310 18.849 1.018 8.484
122 HB3 GLU 310 HB3 GLU 310 20.129 1.049 7.272
123 HG2 GLU 310 HG2 GLU 310 21.119 -0.869 8.046
124 HG3 GLU 310 HG3 GLU 310 20.682 -0.557 9.728
125 H ILE 311 H ILE 311 18.495 3.398 9.117
126 HA ILE 311 HA ILE 311 19.440 5.327 7.165
127 HB ILE 311 HB ILE 311 17.378 6.584 7.674
128 HG12 ILE 311 HG12 ILE 311 16.546 4.334 9.493
129 HG13 ILE 311 HG13 ILE 311 17.344 5.779 10.118
130 HG21 ILE 311 HG21 ILE 311 17.039 3.622 7.150
131 HG22 ILE 311 HG22 ILE 311 15.837 4.866 6.772
132 HG23 ILE 311 HG23 ILE 311 17.404 4.871 5.945
133 HD11 ILE 311 HD11 ILE 311 15.592 7.198 9.223
134 HD12 ILE 311 HD12 ILE 311 14.759 5.768 8.572
135 HD13 ILE 311 HD13 ILE 311 14.940 5.964 10.325
136 H LYS 312 H LYS 312 19.770 5.124 10.626
137 HA LYS 312 HA LYS 312 20.024 7.994 11.033
138 HB2 LYS 312 HB2 LYS 312 19.556 6.341 12.890
139 HB3 LYS 312 HB3 LYS 312 21.208 5.741 12.690
140 HG2 LYS 312 HG2 LYS 312 21.860 8.270 13.033
141 HG3 LYS 312 HG3 LYS 312 20.266 8.387 13.779
142 HD2 LYS 312 HD2 LYS 312 20.888 7.155 15.604
143 HD3 LYS 312 HD3 LYS 312 21.940 6.085 14.663
144 HE2 LYS 312 HE2 LYS 312 22.610 8.956 15.443
145 HE3 LYS 312 HE3 LYS 312 23.224 7.499 16.251
146 HZ1 LYS 312 HZ1 LYS 312 24.849 8.280 14.672
147 HZ2 LYS 312 HZ2 LYS 312 23.761 8.275 13.434
148 HZ3 LYS 312 HZ3 LYS 312 24.245 6.851 14.106
149 H GLU 313 H GLU 313 22.328 5.251 10.612
150 HA GLU 313 HA GLU 313 24.620 7.025 10.617
151 HB2 GLU 313 HB2 GLU 313 24.439 4.278 9.340
152 HB3 GLU 313 HB3 GLU 313 25.899 5.147 9.804
153 HG2 GLU 313 HG2 GLU 313 23.919 3.691 11.526
154 HG3 GLU 313 HG3 GLU 313 25.675 3.585 11.516
155 H LEU 314 H LEU 314 22.514 5.731 8.030
156 HA LEU 314 HA LEU 314 24.119 6.757 5.849
157 HB2 LEU 314 HB2 LEU 314 22.375 4.985 5.671
158 HB3 LEU 314 HB3 LEU 314 21.146 6.169 6.082
159 HG LEU 314 HG LEU 314 21.577 7.360 3.955
160 HD11 LEU 314 HD11 LEU 314 22.889 6.196 2.188
161 HD12 LEU 314 HD12 LEU 314 23.448 5.017 3.397
162 HD13 LEU 314 HD13 LEU 314 23.907 6.733 3.536
163 HD21 LEU 314 HD21 LEU 314 19.810 5.665 4.159
164 HD22 LEU 314 HD22 LEU 314 20.962 4.392 3.687
165 HD23 LEU 314 HD23 LEU 314 20.507 5.671 2.534
166 H GLY 315 H GLY 315 21.945 8.195 8.138
167 HA2 GLY 315 HA2 GLY 315 21.458 10.424 8.470
168 HA3 GLY 315 HA3 GLY 315 22.480 10.826 7.089
169 H GLU 316 H GLU 316 19.767 8.550 6.795
170 HA GLU 316 HA GLU 316 18.550 10.003 4.647
171 HB2 GLU 316 HB2 GLU 316 18.276 7.520 5.619
172 HB3 GLU 316 HB3 GLU 316 16.937 8.278 6.489
173 HG2 GLU 316 HG2 GLU 316 15.813 7.613 4.674
174 HG3 GLU 316 HG3 GLU 316 16.370 9.181 4.064
175 H LEU 317 H LEU 317 18.462 10.214 8.073
176 HA LEU 317 HA LEU 317 16.059 11.588 8.597
177 HB2 LEU 317 HB2 LEU 317 18.757 11.871 9.974
178 HB3 LEU 317 HB3 LEU 317 17.191 12.335 10.645
179 HG LEU 317 HG LEU 317 17.951 9.487 9.952
180 HD11 LEU 317 HD11 LEU 317 18.375 9.336 12.358
181 HD12 LEU 317 HD12 LEU 317 17.976 11.066 12.538
182 HD13 LEU 317 HD13 LEU 317 19.404 10.578 11.597
183 HD21 LEU 317 HD21 LEU 317 16.035 9.041 11.535
184 HD22 LEU 317 HD22 LEU 317 15.548 9.806 10.007
185 HD23 LEU 317 HD23 LEU 317 15.670 10.789 11.484
186 H ARG 318 H ARG 318 18.870 12.746 6.894
187 HA ARG 318 HA ARG 318 18.554 15.580 7.415
188 HB2 ARG 318 HB2 ARG 318 19.560 14.113 4.940
189 HB3 ARG 318 HB3 ARG 318 19.706 15.850 5.201
190 HG2 ARG 318 HG2 ARG 318 21.220 15.485 7.093
191 HG3 ARG 318 HG3 ARG 318 21.014 13.733 6.942
192 HD2 ARG 318 HD2 ARG 318 21.743 14.243 4.406
193 HD3 ARG 318 HD3 ARG 318 22.515 15.637 5.169
194 HE ARG 318 HE ARG 318 23.954 14.171 6.384
195 HH11 ARG 318 HH11 ARG 318 21.883 12.363 4.152
196 HH12 ARG 318 HH12 ARG 318 22.878 10.931 4.260
197 HH21 ARG 318 HH21 ARG 318 25.165 12.290 6.437
198 HH22 ARG 318 HH22 ARG 318 24.661 10.894 5.515
199 H LYS 319 H LYS 319 16.652 13.259 5.729
200 HA LYS 319 HA LYS 319 14.966 15.441 4.606
201 HB2 LYS 319 HB2 LYS 319 15.841 12.858 3.276
202 HB3 LYS 319 HB3 LYS 319 14.430 13.770 2.732
203 HG2 LYS 319 HG2 LYS 319 16.940 15.345 2.978
204 HG3 LYS 319 HG3 LYS 319 16.935 14.092 1.735
205 HD2 LYS 319 HD2 LYS 319 16.200 16.238 0.796
206 HD3 LYS 319 HD3 LYS 319 14.900 15.039 0.725
207 HE2 LYS 319 HE2 LYS 319 14.059 17.266 1.396
208 HE3 LYS 319 HE3 LYS 319 13.786 16.046 2.640
209 HZ1 LYS 319 HZ1 LYS 319 15.749 16.911 3.816
210 HZ2 LYS 319 HZ2 LYS 319 14.570 18.049 3.647
211 HZ3 LYS 319 HZ3 LYS 319 15.911 18.105 2.688
212 H GLU 320 H GLU 320 14.105 12.148 4.054
213 HA GLU 320 HA GLU 320 12.154 12.323 6.304
214 HB2 GLU 320 HB2 GLU 320 11.745 11.347 3.447
215 HB3 GLU 320 HB3 GLU 320 10.582 11.123 4.758
216 HG2 GLU 320 HG2 GLU 320 9.775 12.986 3.546
217 HG3 GLU 320 HG3 GLU 320 10.521 13.671 4.995
218 HA PRO 321 HA PRO 321 14.163 8.474 7.092
219 HB2 PRO 321 HB2 PRO 321 12.457 7.287 8.880
220 HB3 PRO 321 HB3 PRO 321 13.494 8.684 9.318
221 HG2 PRO 321 HG2 PRO 321 10.604 8.668 8.478
222 HG3 PRO 321 HG3 PRO 321 11.364 9.462 9.896
223 HD2 PRO 321 HD2 PRO 321 10.834 10.823 7.623
224 HD3 PRO 321 HD3 PRO 321 12.322 11.149 8.579
225 H SER 322 H SER 322 14.224 6.592 5.952
226 HA SER 322 HA SER 322 11.782 5.819 4.463
227 HB2 SER 322 HB2 SER 322 13.413 4.461 3.138
228 HB3 SER 322 HB3 SER 322 13.784 6.198 3.161
229 HG SER 322 HG SER 322 15.693 5.374 3.669
230 H LEU 323 H LEU 323 13.532 4.846 7.241
231 HA LEU 323 HA LEU 323 12.093 2.244 7.279
232 HB2 LEU 323 HB2 LEU 323 15.025 2.656 7.999
233 HB3 LEU 323 HB3 LEU 323 14.094 1.201 8.283
234 HG LEU 323 HG LEU 323 14.719 2.263 5.535
235 HD11 LEU 323 HD11 LEU 323 15.958 0.000 7.121
236 HD12 LEU 323 HD12 LEU 323 16.642 1.620 7.032
237 HD13 LEU 323 HD13 LEU 323 16.492 0.647 5.553
238 HD21 LEU 323 HD21 LEU 323 13.504 -0.286 6.648
239 HD22 LEU 323 HD22 LEU 323 14.122 -0.145 4.981
240 HD23 LEU 323 HD23 LEU 323 12.761 0.864 5.513
Start of MODEL 17
1 H1 THR 298 H1 THR 298 16.826 -18.395 11.712
2 H2 THR 298 H2 THR 298 15.598 -19.479 11.911
3 H3 THR 298 H3 THR 298 16.756 -19.750 10.772
4 HA THR 298 HA THR 298 16.073 -17.813 9.531
5 HB THR 298 HB THR 298 13.639 -19.544 10.051
6 HG1 THR 298 HG1 THR 298 14.779 -21.020 8.573
7 HG21 THR 298 HG21 THR 298 13.508 -17.787 8.282
8 HG22 THR 298 HG22 THR 298 13.422 -19.428 7.610
9 HG23 THR 298 HG23 THR 298 14.937 -18.503 7.494
10 H ASN 299 H ASN 299 13.751 -18.600 12.203
11 HA ASN 299 HA ASN 299 12.251 -16.168 11.827
12 HB2 ASN 299 HB2 ASN 299 11.000 -16.958 13.762
13 HB3 ASN 299 HB3 ASN 299 11.318 -18.311 12.671
14 HD21 ASN 299 HD21 ASN 299 10.797 -18.088 15.648
15 HD22 ASN 299 HD22 ASN 299 12.086 -19.020 16.367
16 H ARG 300 H ARG 300 14.951 -15.336 12.275
17 HA ARG 300 HA ARG 300 14.608 -13.879 14.874
18 HB2 ARG 300 HB2 ARG 300 17.174 -15.111 13.830
19 HB3 ARG 300 HB3 ARG 300 17.045 -13.990 15.197
20 HG2 ARG 300 HG2 ARG 300 15.272 -15.739 16.080
21 HG3 ARG 300 HG3 ARG 300 16.128 -16.852 14.994
22 HD2 ARG 300 HD2 ARG 300 18.246 -16.268 16.117
23 HD3 ARG 300 HD3 ARG 300 17.354 -15.157 17.179
24 HE ARG 300 HE ARG 300 16.173 -17.748 17.340
25 HH11 ARG 300 HH11 ARG 300 19.115 -16.097 18.397
26 HH12 ARG 300 HH12 ARG 300 19.327 -17.158 19.763
27 HH21 ARG 300 HH21 ARG 300 16.509 -19.051 19.116
28 HH22 ARG 300 HH22 ARG 300 17.879 -18.793 20.159
29 H ARG 301 H ARG 301 13.683 -12.248 13.582
30 HA ARG 301 HA ARG 301 14.827 -11.088 11.270
31 HB2 ARG 301 HB2 ARG 301 12.763 -10.398 13.303
32 HB3 ARG 301 HB3 ARG 301 13.377 -9.057 12.347
33 HG2 ARG 301 HG2 ARG 301 12.355 -11.577 11.017
34 HG3 ARG 301 HG3 ARG 301 11.269 -10.261 11.510
35 HD2 ARG 301 HD2 ARG 301 12.659 -8.667 10.202
36 HD3 ARG 301 HD3 ARG 301 13.627 -10.024 9.610
37 HE ARG 301 HE ARG 301 10.895 -10.541 9.045
38 HH11 ARG 301 HH11 ARG 301 13.440 -8.292 8.030
39 HH12 ARG 301 HH12 ARG 301 12.725 -8.092 6.445
40 HH21 ARG 301 HH21 ARG 301 10.050 -10.198 7.009
41 HH22 ARG 301 HH22 ARG 301 10.852 -9.137 5.887
42 H LYS 302 H LYS 302 15.421 -10.235 14.650
43 HA LYS 302 HA LYS 302 16.917 -8.828 15.675
44 HB2 LYS 302 HB2 LYS 302 18.197 -8.121 13.052
45 HB3 LYS 302 HB3 LYS 302 18.892 -8.025 14.647
46 HG2 LYS 302 HG2 LYS 302 19.899 -9.976 14.322
47 HG3 LYS 302 HG3 LYS 302 18.327 -10.778 14.278
48 HD2 LYS 302 HD2 LYS 302 19.775 -11.300 12.289
49 HD3 LYS 302 HD3 LYS 302 18.228 -10.592 11.838
50 HE2 LYS 302 HE2 LYS 302 20.453 -8.626 12.175
51 HE3 LYS 302 HE3 LYS 302 20.659 -9.780 10.845
52 HZ1 LYS 302 HZ1 LYS 302 19.456 -7.699 10.202
53 HZ2 LYS 302 HZ2 LYS 302 18.201 -8.121 11.192
54 HZ3 LYS 302 HZ3 LYS 302 18.576 -9.060 9.896
55 H SEP 303 H SEP 303 14.648 -7.857 13.571
56 HA SEP 303 HA SEP 303 15.634 -5.452 12.531
57 HB2 SEP 303 HB2 SEP 303 12.798 -6.556 12.630
58 HB3 SEP 303 HB3 SEP 303 13.321 -5.206 11.598
59 H GLY 304 H GLY 304 14.356 -3.358 12.467
60 HA2 GLY 304 HA2 GLY 304 13.002 -1.696 13.391
61 HA3 GLY 304 HA3 GLY 304 12.733 -2.709 14.824
62 H LYS 305 H LYS 305 14.403 -2.817 16.459
63 HA LYS 305 HA LYS 305 15.474 -0.232 17.062
64 HB2 LYS 305 HB2 LYS 305 15.001 -2.144 18.702
65 HB3 LYS 305 HB3 LYS 305 16.524 -2.865 18.167
66 HG2 LYS 305 HG2 LYS 305 17.059 -0.118 18.815
67 HG3 LYS 305 HG3 LYS 305 16.058 -0.772 20.109
68 HD2 LYS 305 HD2 LYS 305 18.298 -1.148 20.797
69 HD3 LYS 305 HD3 LYS 305 17.697 -2.722 20.266
70 HE2 LYS 305 HE2 LYS 305 19.984 -2.382 19.464
71 HE3 LYS 305 HE3 LYS 305 18.874 -2.430 18.087
72 HZ1 LYS 305 HZ1 LYS 305 20.563 -0.638 17.968
73 HZ2 LYS 305 HZ2 LYS 305 19.884 0.092 19.284
74 HZ3 LYS 305 HZ3 LYS 305 19.020 -0.064 17.880
75 H TYR 306 H TYR 306 16.889 -3.134 15.547
76 HA TYR 306 HA TYR 306 19.473 -1.746 15.277
77 HB2 TYR 306 HB2 TYR 306 19.488 -4.168 15.646
78 HB3 TYR 306 HB3 TYR 306 18.536 -4.408 14.168
79 HD1 TYR 306 HD1 TYR 306 21.847 -3.176 15.448
80 HD2 TYR 306 HD2 TYR 306 19.561 -4.383 11.997
81 HE1 TYR 306 HE1 TYR 306 23.910 -3.131 14.045
82 HE2 TYR 306 HE2 TYR 306 21.624 -4.299 10.615
83 HH TYR 306 HH TYR 306 23.786 -3.415 10.548
84 H LYS 307 H LYS 307 16.749 -2.757 13.165
85 HA LYS 307 HA LYS 307 17.895 -2.204 10.692
86 HB2 LYS 307 HB2 LYS 307 15.633 -3.209 11.232
87 HB3 LYS 307 HB3 LYS 307 15.026 -1.553 11.384
88 HG2 LYS 307 HG2 LYS 307 15.778 -1.151 9.018
89 HG3 LYS 307 HG3 LYS 307 16.213 -2.869 8.935
90 HD2 LYS 307 HD2 LYS 307 13.789 -3.344 9.665
91 HD3 LYS 307 HD3 LYS 307 13.469 -1.633 9.315
92 HE2 LYS 307 HE2 LYS 307 12.886 -2.853 7.345
93 HE3 LYS 307 HE3 LYS 307 14.448 -2.068 6.993
94 HZ1 LYS 307 HZ1 LYS 307 14.504 -4.392 6.354
95 HZ2 LYS 307 HZ2 LYS 307 14.043 -4.882 7.870
96 HZ3 LYS 307 HZ3 LYS 307 15.516 -4.182 7.643
97 H LYS 308 H LYS 308 16.434 0.136 12.934
98 HA LYS 308 HA LYS 308 16.564 2.274 11.031
99 HB2 LYS 308 HB2 LYS 308 15.770 3.684 12.609
100 HB3 LYS 308 HB3 LYS 308 15.059 2.148 13.070
101 HG2 LYS 308 HG2 LYS 308 16.343 1.985 15.025
102 HG3 LYS 308 HG3 LYS 308 17.603 3.082 14.428
103 HD2 LYS 308 HD2 LYS 308 14.765 4.024 14.906
104 HD3 LYS 308 HD3 LYS 308 15.988 4.033 16.194
105 HE2 LYS 308 HE2 LYS 308 17.402 5.562 14.959
106 HE3 LYS 308 HE3 LYS 308 16.433 5.380 13.493
107 HZ1 LYS 308 HZ1 LYS 308 14.614 6.483 14.593
108 HZ2 LYS 308 HZ2 LYS 308 15.951 7.437 14.556
109 HZ3 LYS 308 HZ3 LYS 308 15.509 6.691 15.970
110 H VAL 309 H VAL 309 19.062 0.821 12.949
111 HA VAL 309 HA VAL 309 20.603 3.171 13.392
112 HB VAL 309 HB VAL 309 20.854 0.687 14.351
113 HG11 VAL 309 HG11 VAL 309 21.608 -0.328 12.191
114 HG12 VAL 309 HG12 VAL 309 23.042 0.723 12.218
115 HG13 VAL 309 HG13 VAL 309 22.806 -0.500 13.483
116 HG21 VAL 309 HG21 VAL 309 23.071 1.283 15.191
117 HG22 VAL 309 HG22 VAL 309 23.215 2.555 13.950
118 HG23 VAL 309 HG23 VAL 309 21.973 2.684 15.223
119 H GLU 310 H GLU 310 20.436 0.977 10.530
120 HA GLU 310 HA GLU 310 22.652 2.217 9.175
121 HB2 GLU 310 HB2 GLU 310 20.180 0.723 8.241
122 HB3 GLU 310 HB3 GLU 310 21.299 1.459 7.097
123 HG2 GLU 310 HG2 GLU 310 22.058 -0.727 7.184
124 HG3 GLU 310 HG3 GLU 310 23.162 0.124 8.270
125 H ILE 311 H ILE 311 19.166 2.921 9.315
126 HA ILE 311 HA ILE 311 19.173 5.021 7.377
127 HB ILE 311 HB ILE 311 17.278 4.687 9.762
128 HG12 ILE 311 HG12 ILE 311 17.044 3.540 6.947
129 HG13 ILE 311 HG13 ILE 311 17.499 2.605 8.371
130 HG21 ILE 311 HG21 ILE 311 15.661 5.928 8.395
131 HG22 ILE 311 HG22 ILE 311 17.143 6.886 8.531
132 HG23 ILE 311 HG23 ILE 311 16.812 5.989 7.040
133 HD11 ILE 311 HD11 ILE 311 15.249 3.208 9.392
134 HD12 ILE 311 HD12 ILE 311 14.799 3.877 7.803
135 HD13 ILE 311 HD13 ILE 311 15.193 2.154 7.961
136 H LYS 312 H LYS 312 19.895 4.892 10.834
137 HA LYS 312 HA LYS 312 19.934 7.704 11.334
138 HB2 LYS 312 HB2 LYS 312 20.057 5.852 13.059
139 HB3 LYS 312 HB3 LYS 312 21.728 5.600 12.560
140 HG2 LYS 312 HG2 LYS 312 22.154 8.040 13.138
141 HG3 LYS 312 HG3 LYS 312 20.546 8.046 13.870
142 HD2 LYS 312 HD2 LYS 312 22.135 7.656 15.627
143 HD3 LYS 312 HD3 LYS 312 21.285 6.129 15.338
144 HE2 LYS 312 HE2 LYS 312 23.691 5.724 15.630
145 HE3 LYS 312 HE3 LYS 312 23.198 5.314 13.985
146 HZ1 LYS 312 HZ1 LYS 312 24.731 7.690 14.839
147 HZ2 LYS 312 HZ2 LYS 312 24.039 7.572 13.344
148 HZ3 LYS 312 HZ3 LYS 312 25.190 6.488 13.792
149 H GLU 313 H GLU 313 22.457 5.445 10.096
150 HA GLU 313 HA GLU 313 24.468 7.540 10.028
151 HB2 GLU 313 HB2 GLU 313 24.514 5.001 8.382
152 HB3 GLU 313 HB3 GLU 313 25.876 6.002 8.875
153 HG2 GLU 313 HG2 GLU 313 24.199 4.175 10.617
154 HG3 GLU 313 HG3 GLU 313 25.882 3.961 10.165
155 H LEU 314 H LEU 314 22.021 6.341 7.781
156 HA LEU 314 HA LEU 314 23.005 7.743 5.446
157 HB2 LEU 314 HB2 LEU 314 20.232 6.786 6.217
158 HB3 LEU 314 HB3 LEU 314 20.607 7.527 4.670
159 HG LEU 314 HG LEU 314 21.855 4.946 5.667
160 HD11 LEU 314 HD11 LEU 314 20.370 3.837 4.056
161 HD12 LEU 314 HD12 LEU 314 19.626 5.399 3.643
162 HD13 LEU 314 HD13 LEU 314 19.427 4.715 5.272
163 HD21 LEU 314 HD21 LEU 314 21.926 6.333 2.956
164 HD22 LEU 314 HD22 LEU 314 22.523 4.687 3.277
165 HD23 LEU 314 HD23 LEU 314 23.300 6.074 4.058
166 H GLY 315 H GLY 315 21.860 8.843 8.384
167 HA2 GLY 315 HA2 GLY 315 22.017 11.128 8.899
168 HA3 GLY 315 HA3 GLY 315 21.652 11.545 7.231
169 H GLU 316 H GLU 316 19.757 9.406 9.363
170 HA GLU 316 HA GLU 316 17.296 10.766 8.915
171 HB2 GLU 316 HB2 GLU 316 17.540 8.457 9.871
172 HB3 GLU 316 HB3 GLU 316 18.308 9.150 11.290
173 HG2 GLU 316 HG2 GLU 316 16.104 10.419 11.662
174 HG3 GLU 316 HG3 GLU 316 15.409 9.295 10.481
175 H LEU 317 H LEU 317 19.817 11.025 11.324
176 HA LEU 317 HA LEU 317 18.477 13.149 12.811
177 HB2 LEU 317 HB2 LEU 317 21.343 12.161 13.026
178 HB3 LEU 317 HB3 LEU 317 20.439 13.079 14.229
179 HG LEU 317 HG LEU 317 19.940 10.211 13.413
180 HD11 LEU 317 HD11 LEU 317 20.851 9.887 15.695
181 HD12 LEU 317 HD12 LEU 317 21.100 11.653 15.809
182 HD13 LEU 317 HD13 LEU 317 21.992 10.706 14.594
183 HD21 LEU 317 HD21 LEU 317 18.559 12.029 15.410
184 HD22 LEU 317 HD22 LEU 317 18.438 10.249 15.432
185 HD23 LEU 317 HD23 LEU 317 17.823 11.155 14.039
186 H ARG 318 H ARG 318 20.468 12.931 10.047
187 HA ARG 318 HA ARG 318 21.793 15.543 10.549
188 HB2 ARG 318 HB2 ARG 318 22.098 13.591 8.242
189 HB3 ARG 318 HB3 ARG 318 23.018 15.080 8.459
190 HG2 ARG 318 HG2 ARG 318 23.816 14.170 10.680
191 HG3 ARG 318 HG3 ARG 318 23.093 12.615 10.245
192 HD2 ARG 318 HD2 ARG 318 25.142 14.027 8.486
193 HD3 ARG 318 HD3 ARG 318 25.608 12.944 9.797
194 HE ARG 318 HE ARG 318 24.746 11.076 8.620
195 HH11 ARG 318 HH11 ARG 318 24.453 14.020 6.674
196 HH12 ARG 318 HH12 ARG 318 24.249 13.114 5.199
197 HH21 ARG 318 HH21 ARG 318 24.517 10.011 6.705
198 HH22 ARG 318 HH22 ARG 318 24.275 10.902 5.218
199 H LYS 319 H LYS 319 19.277 14.160 8.463
200 HA LYS 319 HA LYS 319 18.500 16.897 7.779
201 HB2 LYS 319 HB2 LYS 319 20.057 15.350 6.010
202 HB3 LYS 319 HB3 LYS 319 18.409 15.261 5.380
203 HG2 LYS 319 HG2 LYS 319 18.284 17.742 5.625
204 HG3 LYS 319 HG3 LYS 319 20.003 17.711 6.030
205 HD2 LYS 319 HD2 LYS 319 19.794 18.263 3.675
206 HD3 LYS 319 HD3 LYS 319 20.465 16.631 3.803
207 HE2 LYS 319 HE2 LYS 319 18.768 16.704 2.033
208 HE3 LYS 319 HE3 LYS 319 18.213 15.668 3.354
209 HZ1 LYS 319 HZ1 LYS 319 16.938 17.643 4.158
210 HZ2 LYS 319 HZ2 LYS 319 16.409 16.998 2.735
211 HZ3 LYS 319 HZ3 LYS 319 17.290 18.403 2.734
212 H GLU 320 H GLU 320 17.728 13.553 6.671
213 HA GLU 320 HA GLU 320 14.905 13.891 7.481
214 HB2 GLU 320 HB2 GLU 320 15.889 13.608 4.600
215 HB3 GLU 320 HB3 GLU 320 14.232 13.251 5.088
216 HG2 GLU 320 HG2 GLU 320 13.864 15.570 5.732
217 HG3 GLU 320 HG3 GLU 320 15.555 15.965 5.380
218 HA PRO 321 HA PRO 321 15.684 9.527 7.791
219 HB2 PRO 321 HB2 PRO 321 13.247 8.364 7.458
220 HB3 PRO 321 HB3 PRO 321 13.619 9.367 8.898
221 HG2 PRO 321 HG2 PRO 321 12.232 10.170 6.349
222 HG3 PRO 321 HG3 PRO 321 11.683 10.385 8.044
223 HD2 PRO 321 HD2 PRO 321 12.917 12.373 6.699
224 HD3 PRO 321 HD3 PRO 321 13.236 12.099 8.448
225 H SER 322 H SER 322 15.412 7.410 6.537
226 HA SER 322 HA SER 322 15.040 7.832 3.614
227 HB2 SER 322 HB2 SER 322 17.411 6.411 4.895
228 HB3 SER 322 HB3 SER 322 17.109 6.617 3.155
229 HG SER 322 HG SER 322 16.987 9.020 4.221
230 H LEU 323 H LEU 323 14.944 5.638 2.507
231 HA LEU 323 HA LEU 323 13.945 3.471 4.280
232 HB2 LEU 323 HB2 LEU 323 12.008 4.855 3.486
233 HB3 LEU 323 HB3 LEU 323 12.522 4.583 1.821
234 HG LEU 323 HG LEU 323 11.922 2.182 3.492
235 HD11 LEU 323 HD11 LEU 323 10.217 3.897 4.031
236 HD12 LEU 323 HD12 LEU 323 9.531 2.533 3.113
237 HD13 LEU 323 HD13 LEU 323 9.871 4.081 2.299
238 HD21 LEU 323 HD21 LEU 323 11.497 3.080 0.616
239 HD22 LEU 323 HD22 LEU 323 10.901 1.528 1.266
240 HD23 LEU 323 HD23 LEU 323 12.645 1.860 1.202
Start of MODEL 18
1 H1 THR 298 H1 THR 298 11.533 -17.211 9.772
2 H2 THR 298 H2 THR 298 12.471 -16.197 8.868
3 H3 THR 298 H3 THR 298 12.663 -17.828 8.737
4 HA THR 298 HA THR 298 13.456 -17.981 10.999
5 HB THR 298 HB THR 298 15.421 -16.118 10.485
6 HG1 THR 298 HG1 THR 298 15.586 -16.043 8.206
7 HG21 THR 298 HG21 THR 298 15.096 -18.808 9.083
8 HG22 THR 298 HG22 THR 298 15.742 -18.574 10.729
9 HG23 THR 298 HG23 THR 298 16.617 -17.923 9.328
10 H ASN 299 H ASN 299 13.150 -17.177 13.020
11 HA ASN 299 HA ASN 299 11.975 -14.490 13.215
12 HB2 ASN 299 HB2 ASN 299 12.417 -16.650 15.315
13 HB3 ASN 299 HB3 ASN 299 11.536 -15.139 15.564
14 HD21 ASN 299 HD21 ASN 299 9.421 -15.489 15.612
15 HD22 ASN 299 HD22 ASN 299 8.552 -16.596 14.578
16 H ARG 300 H ARG 300 15.141 -15.685 13.424
17 HA ARG 300 HA ARG 300 15.987 -13.769 15.507
18 HB2 ARG 300 HB2 ARG 300 16.989 -16.117 15.160
19 HB3 ARG 300 HB3 ARG 300 17.754 -15.473 13.708
20 HG2 ARG 300 HG2 ARG 300 19.450 -15.264 15.308
21 HG3 ARG 300 HG3 ARG 300 18.733 -13.646 15.313
22 HD2 ARG 300 HD2 ARG 300 19.003 -14.199 17.596
23 HD3 ARG 300 HD3 ARG 300 17.277 -14.461 17.277
24 HE ARG 300 HE ARG 300 18.667 -16.907 16.844
25 HH11 ARG 300 HH11 ARG 300 17.804 -14.817 19.562
26 HH12 ARG 300 HH12 ARG 300 17.811 -16.140 20.697
27 HH21 ARG 300 HH21 ARG 300 18.667 -18.538 18.363
28 HH22 ARG 300 HH22 ARG 300 18.286 -18.201 20.028
29 H ARG 301 H ARG 301 14.827 -12.156 14.017
30 HA ARG 301 HA ARG 301 15.929 -11.441 11.477
31 HB2 ARG 301 HB2 ARG 301 14.359 -9.763 13.466
32 HB3 ARG 301 HB3 ARG 301 14.612 -9.366 11.770
33 HG2 ARG 301 HG2 ARG 301 13.179 -11.895 12.667
34 HG3 ARG 301 HG3 ARG 301 12.347 -10.363 12.386
35 HD2 ARG 301 HD2 ARG 301 14.014 -11.796 10.285
36 HD3 ARG 301 HD3 ARG 301 12.253 -11.939 10.451
37 HE ARG 301 HE ARG 301 12.969 -9.159 10.312
38 HH11 ARG 301 HH11 ARG 301 12.685 -11.988 8.191
39 HH12 ARG 301 HH12 ARG 301 12.422 -10.999 6.782
40 HH21 ARG 301 HH21 ARG 301 12.688 -8.007 8.512
41 HH22 ARG 301 HH22 ARG 301 12.382 -8.773 6.963
42 H LYS 302 H LYS 302 16.717 -10.286 14.723
43 HA LYS 302 HA LYS 302 18.349 -8.872 15.535
44 HB2 LYS 302 HB2 LYS 302 19.736 -9.347 12.875
45 HB3 LYS 302 HB3 LYS 302 20.459 -8.637 14.315
46 HG2 LYS 302 HG2 LYS 302 20.449 -10.694 15.476
47 HG3 LYS 302 HG3 LYS 302 19.392 -11.457 14.272
48 HD2 LYS 302 HD2 LYS 302 21.708 -12.195 13.942
49 HD3 LYS 302 HD3 LYS 302 21.160 -11.254 12.549
50 HE2 LYS 302 HE2 LYS 302 22.711 -9.894 14.779
51 HE3 LYS 302 HE3 LYS 302 23.566 -10.850 13.562
52 HZ1 LYS 302 HZ1 LYS 302 21.847 -8.496 12.961
53 HZ2 LYS 302 HZ2 LYS 302 22.644 -9.400 11.837
54 HZ3 LYS 302 HZ3 LYS 302 23.495 -8.513 12.937
55 H SEP 303 H SEP 303 16.123 -7.746 14.058
56 HA SEP 303 HA SEP 303 17.274 -5.244 12.933
57 HB2 SEP 303 HB2 SEP 303 15.973 -5.434 10.976
58 HB3 SEP 303 HB3 SEP 303 16.747 -7.017 11.205
59 H GLY 304 H GLY 304 15.184 -3.800 12.242
60 HA2 GLY 304 HA2 GLY 304 13.190 -2.772 12.946
61 HA3 GLY 304 HA3 GLY 304 13.175 -3.774 14.408
62 H LYS 305 H LYS 305 14.974 -3.304 16.021
63 HA LYS 305 HA LYS 305 15.062 -0.430 16.543
64 HB2 LYS 305 HB2 LYS 305 16.648 -2.754 17.726
65 HB3 LYS 305 HB3 LYS 305 16.803 -1.073 18.258
66 HG2 LYS 305 HG2 LYS 305 14.354 -1.068 18.790
67 HG3 LYS 305 HG3 LYS 305 14.317 -2.808 18.435
68 HD2 LYS 305 HD2 LYS 305 16.006 -3.197 20.203
69 HD3 LYS 305 HD3 LYS 305 16.055 -1.453 20.535
70 HE2 LYS 305 HE2 LYS 305 13.622 -1.517 21.090
71 HE3 LYS 305 HE3 LYS 305 13.634 -3.275 20.848
72 HZ1 LYS 305 HZ1 LYS 305 15.234 -1.808 22.874
73 HZ2 LYS 305 HZ2 LYS 305 15.249 -3.443 22.653
74 HZ3 LYS 305 HZ3 LYS 305 13.877 -2.694 23.183
75 H TYR 306 H TYR 306 17.083 -2.861 15.024
76 HA TYR 306 HA TYR 306 19.355 -1.136 14.628
77 HB2 TYR 306 HB2 TYR 306 18.528 -3.727 13.303
78 HB3 TYR 306 HB3 TYR 306 20.077 -2.925 13.061
79 HD1 TYR 306 HD2 TYR 306 17.984 -4.773 15.532
80 HD2 TYR 306 HD1 TYR 306 21.818 -2.974 14.751
81 HE1 TYR 306 HE2 TYR 306 18.930 -5.904 17.542
82 HE2 TYR 306 HE1 TYR 306 22.754 -4.112 16.768
83 HH TYR 306 HH TYR 306 20.777 -6.227 18.853
84 H LYS 307 H LYS 307 16.335 -1.703 12.843
85 HA LYS 307 HA LYS 307 17.192 -0.769 10.300
86 HB2 LYS 307 HB2 LYS 307 14.519 -0.659 11.712
87 HB3 LYS 307 HB3 LYS 307 14.747 0.131 10.162
88 HG2 LYS 307 HG2 LYS 307 15.293 -2.811 10.602
89 HG3 LYS 307 HG3 LYS 307 13.733 -2.154 10.068
90 HD2 LYS 307 HD2 LYS 307 14.988 -0.997 8.176
91 HD3 LYS 307 HD3 LYS 307 16.398 -1.982 8.620
92 HE2 LYS 307 HE2 LYS 307 13.660 -3.016 7.786
93 HE3 LYS 307 HE3 LYS 307 15.132 -3.017 6.790
94 HZ1 LYS 307 HZ1 LYS 307 14.637 -4.559 9.267
95 HZ2 LYS 307 HZ2 LYS 307 16.131 -4.436 8.558
96 HZ3 LYS 307 HZ3 LYS 307 14.881 -5.159 7.758
97 H LYS 308 H LYS 308 16.042 0.949 13.199
98 HA LYS 308 HA LYS 308 16.121 3.522 11.892
99 HB2 LYS 308 HB2 LYS 308 16.305 3.023 14.876
100 HB3 LYS 308 HB3 LYS 308 15.739 4.476 14.055
101 HG2 LYS 308 HG2 LYS 308 14.351 1.786 14.309
102 HG3 LYS 308 HG3 LYS 308 13.799 3.349 14.903
103 HD2 LYS 308 HD2 LYS 308 13.970 2.535 11.957
104 HD3 LYS 308 HD3 LYS 308 12.509 2.531 12.935
105 HE2 LYS 308 HE2 LYS 308 12.655 4.971 13.219
106 HE3 LYS 308 HE3 LYS 308 14.150 5.001 12.249
107 HZ1 LYS 308 HZ1 LYS 308 11.933 5.415 11.049
108 HZ2 LYS 308 HZ2 LYS 308 11.693 3.782 11.170
109 HZ3 LYS 308 HZ3 LYS 308 12.982 4.359 10.343
110 H VAL 309 H VAL 309 18.522 1.511 13.431
111 HA VAL 309 HA VAL 309 20.448 3.664 13.762
112 HB VAL 309 HB VAL 309 20.372 0.738 14.243
113 HG11 VAL 309 HG11 VAL 309 22.229 0.645 12.676
114 HG12 VAL 309 HG12 VAL 309 23.008 2.054 13.434
115 HG13 VAL 309 HG13 VAL 309 22.875 0.519 14.319
116 HG21 VAL 309 HG21 VAL 309 21.669 1.422 16.219
117 HG22 VAL 309 HG22 VAL 309 21.814 3.064 15.547
118 HG23 VAL 309 HG23 VAL 309 20.217 2.425 16.008
119 H GLU 310 H GLU 310 19.748 1.153 11.289
120 HA GLU 310 HA GLU 310 21.935 1.854 9.567
121 HB2 GLU 310 HB2 GLU 310 19.224 0.566 9.136
122 HB3 GLU 310 HB3 GLU 310 20.285 0.933 7.774
123 HG2 GLU 310 HG2 GLU 310 21.353 -0.992 8.085
124 HG3 GLU 310 HG3 GLU 310 21.918 -0.414 9.655
125 H ILE 311 H ILE 311 18.549 2.996 9.794
126 HA ILE 311 HA ILE 311 18.684 4.846 7.622
127 HB ILE 311 HB ILE 311 16.853 4.240 9.879
128 HG12 ILE 311 HG12 ILE 311 15.171 4.865 8.050
129 HG13 ILE 311 HG13 ILE 311 16.559 5.101 6.988
130 HG21 ILE 311 HG21 ILE 311 16.907 7.101 8.821
131 HG22 ILE 311 HG22 ILE 311 15.566 6.379 9.734
132 HG23 ILE 311 HG23 ILE 311 17.149 6.581 10.505
133 HD11 ILE 311 HD11 ILE 311 17.213 2.702 7.371
134 HD12 ILE 311 HD12 ILE 311 15.743 2.499 8.359
135 HD13 ILE 311 HD13 ILE 311 15.612 2.881 6.632
136 H LYS 312 H LYS 312 19.677 5.098 11.018
137 HA LYS 312 HA LYS 312 20.211 7.944 10.908
138 HB2 LYS 312 HB2 LYS 312 19.804 6.740 13.010
139 HB3 LYS 312 HB3 LYS 312 21.244 5.774 12.758
140 HG2 LYS 312 HG2 LYS 312 21.629 8.732 12.783
141 HG3 LYS 312 HG3 LYS 312 21.154 7.993 14.315
142 HD2 LYS 312 HD2 LYS 312 23.562 7.085 12.668
143 HD3 LYS 312 HD3 LYS 312 23.640 8.240 14.003
144 HE2 LYS 312 HE2 LYS 312 24.059 6.427 15.279
145 HE3 LYS 312 HE3 LYS 312 22.304 6.171 15.209
146 HZ1 LYS 312 HZ1 LYS 312 23.494 4.166 14.603
147 HZ2 LYS 312 HZ2 LYS 312 24.335 4.945 13.421
148 HZ3 LYS 312 HZ3 LYS 312 22.708 4.725 13.264
149 H GLU 313 H GLU 313 22.204 4.994 10.446
150 HA GLU 313 HA GLU 313 24.685 6.401 10.136
151 HB2 GLU 313 HB2 GLU 313 23.730 3.702 9.956
152 HB3 GLU 313 HB3 GLU 313 24.662 4.050 8.497
153 HG2 GLU 313 HG2 GLU 313 26.194 3.162 10.080
154 HG3 GLU 313 HG3 GLU 313 26.513 4.904 9.991
155 H LEU 314 H LEU 314 22.192 5.424 7.750
156 HA LEU 314 HA LEU 314 23.725 6.424 5.475
157 HB2 LEU 314 HB2 LEU 314 20.778 5.820 5.876
158 HB3 LEU 314 HB3 LEU 314 21.488 6.260 4.328
159 HG LEU 314 HG LEU 314 22.281 3.783 5.894
160 HD11 LEU 314 HD11 LEU 314 20.292 4.123 3.613
161 HD12 LEU 314 HD12 LEU 314 19.911 3.679 5.296
162 HD13 LEU 314 HD13 LEU 314 20.848 2.566 4.277
163 HD21 LEU 314 HD21 LEU 314 22.758 4.633 3.006
164 HD22 LEU 314 HD22 LEU 314 23.180 3.048 3.697
165 HD23 LEU 314 HD23 LEU 314 23.985 4.514 4.289
166 H GLY 315 H GLY 315 21.732 7.791 7.940
167 HA2 GLY 315 HA2 GLY 315 21.396 10.028 8.411
168 HA3 GLY 315 HA3 GLY 315 22.261 10.447 6.929
169 H GLU 316 H GLU 316 19.513 8.235 6.854
170 HA GLU 316 HA GLU 316 18.101 9.867 4.944
171 HB2 GLU 316 HB2 GLU 316 17.025 7.661 6.739
172 HB3 GLU 316 HB3 GLU 316 16.235 8.316 5.305
173 HG2 GLU 316 HG2 GLU 316 18.826 6.757 5.397
174 HG3 GLU 316 HG3 GLU 316 17.266 6.190 4.788
175 H LEU 317 H LEU 317 18.362 9.890 8.365
176 HA LEU 317 HA LEU 317 15.941 11.162 9.147
177 HB2 LEU 317 HB2 LEU 317 18.747 11.455 10.285
178 HB3 LEU 317 HB3 LEU 317 17.265 11.962 11.087
179 HG LEU 317 HG LEU 317 17.877 9.078 10.430
180 HD11 LEU 317 HD11 LEU 317 18.309 10.771 12.913
181 HD12 LEU 317 HD12 LEU 317 19.579 10.193 11.812
182 HD13 LEU 317 HD13 LEU 317 18.632 9.023 12.767
183 HD21 LEU 317 HD21 LEU 317 15.891 10.522 12.228
184 HD22 LEU 317 HD22 LEU 317 16.198 8.765 12.287
185 HD23 LEU 317 HD23 LEU 317 15.513 9.501 10.826
186 H ARG 318 H ARG 318 18.599 12.420 7.277
187 HA ARG 318 HA ARG 318 18.103 15.224 8.037
188 HB2 ARG 318 HB2 ARG 318 19.817 13.859 5.942
189 HB3 ARG 318 HB3 ARG 318 19.513 15.589 5.870
190 HG2 ARG 318 HG2 ARG 318 21.473 15.628 7.029
191 HG3 ARG 318 HG3 ARG 318 20.336 15.564 8.380
192 HD2 ARG 318 HD2 ARG 318 21.392 13.743 9.123
193 HD3 ARG 318 HD3 ARG 318 20.854 12.871 7.693
194 HE ARG 318 HE ARG 318 23.512 14.005 8.203
195 HH11 ARG 318 HH11 ARG 318 21.418 12.563 5.724
196 HH12 ARG 318 HH12 ARG 318 22.779 12.162 4.709
197 HH21 ARG 318 HH21 ARG 318 25.165 13.432 6.847
198 HH22 ARG 318 HH22 ARG 318 24.838 12.622 5.339
199 H LYS 319 H LYS 319 16.424 12.985 6.170
200 HA LYS 319 HA LYS 319 15.003 15.188 4.752
201 HB2 LYS 319 HB2 LYS 319 16.311 12.757 3.522
202 HB3 LYS 319 HB3 LYS 319 14.816 13.397 2.835
203 HG2 LYS 319 HG2 LYS 319 15.851 15.603 2.553
204 HG3 LYS 319 HG3 LYS 319 17.379 14.962 3.177
205 HD2 LYS 319 HD2 LYS 319 17.353 15.056 0.703
206 HD3 LYS 319 HD3 LYS 319 17.548 13.402 1.297
207 HE2 LYS 319 HE2 LYS 319 15.976 13.581 -0.648
208 HE3 LYS 319 HE3 LYS 319 15.249 12.850 0.786
209 HZ1 LYS 319 HZ1 LYS 319 14.134 14.907 1.269
210 HZ2 LYS 319 HZ2 LYS 319 13.768 14.429 -0.253
211 HZ3 LYS 319 HZ3 LYS 319 14.841 15.668 -0.022
212 H GLU 320 H GLU 320 14.302 11.926 3.892
213 HA GLU 320 HA GLU 320 11.901 11.968 5.666
214 HB2 GLU 320 HB2 GLU 320 12.167 10.895 2.827
215 HB3 GLU 320 HB3 GLU 320 10.730 10.797 3.848
216 HG2 GLU 320 HG2 GLU 320 10.205 12.597 2.492
217 HG3 GLU 320 HG3 GLU 320 10.886 13.418 3.904
218 HA PRO 321 HA PRO 321 14.556 8.399 6.521
219 HB2 PRO 321 HB2 PRO 321 13.697 7.809 9.056
220 HB3 PRO 321 HB3 PRO 321 14.890 9.096 8.689
221 HG2 PRO 321 HG2 PRO 321 11.916 9.348 9.091
222 HG3 PRO 321 HG3 PRO 321 13.240 10.275 9.871
223 HD2 PRO 321 HD2 PRO 321 11.919 11.266 7.755
224 HD3 PRO 321 HD3 PRO 321 13.698 11.485 7.907
225 H SER 322 H SER 322 14.256 6.316 6.132
226 HA SER 322 HA SER 322 11.619 5.370 5.434
227 HB2 SER 322 HB2 SER 322 13.716 3.349 5.684
228 HB3 SER 322 HB3 SER 322 12.833 3.892 4.239
229 HG SER 322 HG SER 322 14.279 5.583 4.013
230 H LEU 323 H LEU 323 11.105 3.012 6.162
231 HA LEU 323 HA LEU 323 10.313 3.093 8.881
232 HB2 LEU 323 HB2 LEU 323 9.206 1.796 7.056
233 HB3 LEU 323 HB3 LEU 323 10.585 0.695 7.030
234 HG LEU 323 HG LEU 323 10.017 0.062 9.397
235 HD11 LEU 323 HD11 LEU 323 8.681 1.960 10.077
236 HD12 LEU 323 HD12 LEU 323 7.606 0.551 10.002
237 HD13 LEU 323 HD13 LEU 323 7.593 1.754 8.685
238 HD21 LEU 323 HD21 LEU 323 8.249 -1.396 8.550
239 HD22 LEU 323 HD22 LEU 323 9.508 -1.145 7.314
240 HD23 LEU 323 HD23 LEU 323 7.964 -0.275 7.191
Start of MODEL 19
1 H1 THR 298 H1 THR 298 16.213 -21.612 6.675
2 H2 THR 298 H2 THR 298 16.635 -20.649 5.401
3 H3 THR 298 H3 THR 298 17.691 -20.881 6.645
4 HA THR 298 HA THR 298 15.095 -19.499 6.864
5 HB THR 298 HB THR 298 16.116 -18.816 9.124
6 HG1 THR 298 HG1 THR 298 17.752 -20.261 9.865
7 HG21 THR 298 HG21 THR 298 15.441 -20.851 10.263
8 HG22 THR 298 HG22 THR 298 15.621 -21.806 8.778
9 HG23 THR 298 HG23 THR 298 14.334 -20.577 8.903
10 H ASN 299 H ASN 299 15.611 -17.115 7.688
11 HA ASN 299 HA ASN 299 18.102 -16.032 6.612
12 HB2 ASN 299 HB2 ASN 299 16.539 -16.162 4.623
13 HB3 ASN 299 HB3 ASN 299 15.396 -15.145 5.516
14 HD21 ASN 299 HD21 ASN 299 15.901 -13.961 3.352
15 HD22 ASN 299 HD22 ASN 299 17.164 -12.760 3.465
16 H ARG 300 H ARG 300 18.667 -14.776 8.241
17 HA ARG 300 HA ARG 300 16.620 -13.634 10.044
18 HB2 ARG 300 HB2 ARG 300 18.709 -14.762 10.915
19 HB3 ARG 300 HB3 ARG 300 19.659 -13.463 10.191
20 HG2 ARG 300 HG2 ARG 300 19.456 -12.916 12.489
21 HG3 ARG 300 HG3 ARG 300 18.327 -11.837 11.654
22 HD2 ARG 300 HD2 ARG 300 16.447 -13.324 12.249
23 HD3 ARG 300 HD3 ARG 300 17.577 -14.451 13.028
24 HE ARG 300 HE ARG 300 17.939 -11.901 14.206
25 HH11 ARG 300 HH11 ARG 300 15.454 -14.413 14.109
26 HH12 ARG 300 HH12 ARG 300 14.822 -13.973 15.672
27 HH21 ARG 300 HH21 ARG 300 17.074 -11.404 16.194
28 HH22 ARG 300 HH22 ARG 300 15.726 -12.308 16.826
29 H ARG 301 H ARG 301 15.725 -11.775 9.419
30 HA ARG 301 HA ARG 301 16.753 -10.006 7.448
31 HB2 ARG 301 HB2 ARG 301 14.416 -10.100 8.012
32 HB3 ARG 301 HB3 ARG 301 14.709 -9.688 9.679
33 HG2 ARG 301 HG2 ARG 301 13.696 -7.847 8.523
34 HG3 ARG 301 HG3 ARG 301 15.323 -7.445 9.038
35 HD2 ARG 301 HD2 ARG 301 16.162 -7.742 6.744
36 HD3 ARG 301 HD3 ARG 301 14.523 -8.187 6.204
37 HE ARG 301 HE ARG 301 14.043 -5.782 7.384
38 HH11 ARG 301 HH11 ARG 301 16.566 -6.637 5.033
39 HH12 ARG 301 HH12 ARG 301 16.624 -5.014 4.403
40 HH21 ARG 301 HH21 ARG 301 14.186 -3.812 6.557
41 HH22 ARG 301 HH22 ARG 301 15.287 -3.424 5.243
42 H LYS 302 H LYS 302 17.137 -10.051 10.922
43 HA LYS 302 HA LYS 302 18.305 -8.900 12.433
44 HB2 LYS 302 HB2 LYS 302 20.533 -8.455 12.051
45 HB3 LYS 302 HB3 LYS 302 20.148 -9.744 10.916
46 HG2 LYS 302 HG2 LYS 302 20.780 -8.494 9.152
47 HG3 LYS 302 HG3 LYS 302 19.833 -7.099 9.693
48 HD2 LYS 302 HD2 LYS 302 21.595 -6.528 11.301
49 HD3 LYS 302 HD3 LYS 302 22.581 -7.863 10.654
50 HE2 LYS 302 HE2 LYS 302 22.468 -6.829 8.395
51 HE3 LYS 302 HE3 LYS 302 21.495 -5.500 9.056
52 HZ1 LYS 302 HZ1 LYS 302 24.273 -6.130 9.867
53 HZ2 LYS 302 HZ2 LYS 302 23.359 -4.877 10.436
54 HZ3 LYS 302 HZ3 LYS 302 23.824 -4.906 8.855
55 H SEP 303 H SEP 303 16.553 -7.226 10.320
56 HA SEP 303 HA SEP 303 17.207 -4.540 11.447
57 HB2 SEP 303 HB2 SEP 303 16.681 -4.153 9.254
58 HB3 SEP 303 HB3 SEP 303 15.610 -5.543 9.138
59 H GLY 304 H GLY 304 14.693 -3.470 11.834
60 HA2 GLY 304 HA2 GLY 304 12.985 -3.728 13.604
61 HA3 GLY 304 HA3 GLY 304 14.127 -4.785 14.468
62 H LYS 305 H LYS 305 15.276 -3.833 16.028
63 HA LYS 305 HA LYS 305 15.255 -1.004 16.497
64 HB2 LYS 305 HB2 LYS 305 17.211 -3.149 17.436
65 HB3 LYS 305 HB3 LYS 305 17.163 -1.494 18.056
66 HG2 LYS 305 HG2 LYS 305 14.888 -1.858 18.930
67 HG3 LYS 305 HG3 LYS 305 14.867 -3.486 18.236
68 HD2 LYS 305 HD2 LYS 305 15.346 -3.764 20.552
69 HD3 LYS 305 HD3 LYS 305 16.869 -4.051 19.693
70 HE2 LYS 305 HE2 LYS 305 17.616 -1.749 20.251
71 HE3 LYS 305 HE3 LYS 305 16.074 -1.448 21.079
72 HZ1 LYS 305 HZ1 LYS 305 17.814 -2.071 22.646
73 HZ2 LYS 305 HZ2 LYS 305 18.070 -3.504 21.874
74 HZ3 LYS 305 HZ3 LYS 305 16.637 -3.225 22.640
75 H TYR 306 H TYR 306 17.384 -3.164 14.705
76 HA TYR 306 HA TYR 306 19.507 -1.288 14.297
77 HB2 TYR 306 HB2 TYR 306 19.617 -3.795 14.134
78 HB3 TYR 306 HB3 TYR 306 18.752 -3.676 12.599
79 HD1 TYR 306 HD1 TYR 306 21.872 -2.488 14.343
80 HD2 TYR 306 HD2 TYR 306 19.941 -3.308 10.580
81 HE1 TYR 306 HE1 TYR 306 24.021 -2.067 13.136
82 HE2 TYR 306 HE2 TYR 306 22.088 -2.884 9.401
83 HH TYR 306 HH TYR 306 24.207 -2.026 9.587
84 H LYS 307 H LYS 307 16.411 -1.748 12.588
85 HA LYS 307 HA LYS 307 17.202 -0.720 10.066
86 HB2 LYS 307 HB2 LYS 307 14.908 -1.707 10.818
87 HB3 LYS 307 HB3 LYS 307 14.522 -0.058 11.294
88 HG2 LYS 307 HG2 LYS 307 15.531 0.308 8.752
89 HG3 LYS 307 HG3 LYS 307 14.743 -1.262 8.587
90 HD2 LYS 307 HD2 LYS 307 13.347 1.153 9.801
91 HD3 LYS 307 HD3 LYS 307 13.374 0.865 8.060
92 HE2 LYS 307 HE2 LYS 307 12.250 -1.075 10.117
93 HE3 LYS 307 HE3 LYS 307 11.296 0.052 9.136
94 HZ1 LYS 307 HZ1 LYS 307 11.227 -1.988 8.028
95 HZ2 LYS 307 HZ2 LYS 307 12.827 -2.294 8.212
96 HZ3 LYS 307 HZ3 LYS 307 12.330 -1.109 7.158
97 H LYS 308 H LYS 308 16.218 0.926 13.049
98 HA LYS 308 HA LYS 308 16.191 3.534 11.792
99 HB2 LYS 308 HB2 LYS 308 16.235 2.736 14.722
100 HB3 LYS 308 HB3 LYS 308 16.017 4.389 14.112
101 HG2 LYS 308 HG2 LYS 308 14.045 3.556 12.776
102 HG3 LYS 308 HG3 LYS 308 14.186 2.008 13.628
103 HD2 LYS 308 HD2 LYS 308 13.825 3.168 15.780
104 HD3 LYS 308 HD3 LYS 308 13.697 4.718 14.911
105 HE2 LYS 308 HE2 LYS 308 11.794 3.772 13.585
106 HE3 LYS 308 HE3 LYS 308 11.877 2.296 14.565
107 HZ1 LYS 308 HZ1 LYS 308 10.185 3.809 15.375
108 HZ2 LYS 308 HZ2 LYS 308 11.288 5.016 15.593
109 HZ3 LYS 308 HZ3 LYS 308 11.368 3.648 16.514
110 H VAL 309 H VAL 309 18.715 1.537 13.109
111 HA VAL 309 HA VAL 309 20.603 3.740 13.469
112 HB VAL 309 HB VAL 309 20.913 0.706 13.311
113 HG11 VAL 309 HG11 VAL 309 23.124 2.770 13.662
114 HG12 VAL 309 HG12 VAL 309 23.300 1.020 13.916
115 HG13 VAL 309 HG13 VAL 309 22.940 1.646 12.298
116 HG21 VAL 309 HG21 VAL 309 19.970 1.632 15.373
117 HG22 VAL 309 HG22 VAL 309 21.609 1.006 15.663
118 HG23 VAL 309 HG23 VAL 309 21.344 2.762 15.494
119 H GLU 310 H GLU 310 19.758 1.362 10.909
120 HA GLU 310 HA GLU 310 21.795 2.211 9.097
121 HB2 GLU 310 HB2 GLU 310 19.037 1.026 8.608
122 HB3 GLU 310 HB3 GLU 310 20.264 1.235 7.347
123 HG2 GLU 310 HG2 GLU 310 21.781 -0.265 8.474
124 HG3 GLU 310 HG3 GLU 310 20.739 -0.337 9.895
125 H ILE 311 H ILE 311 18.388 3.272 9.494
126 HA ILE 311 HA ILE 311 18.410 5.277 7.477
127 HB ILE 311 HB ILE 311 16.824 5.003 10.080
128 HG12 ILE 311 HG12 ILE 311 15.939 4.601 7.196
129 HG13 ILE 311 HG13 ILE 311 16.597 3.295 8.178
130 HG21 ILE 311 HG21 ILE 311 15.226 6.681 9.197
131 HG22 ILE 311 HG22 ILE 311 16.825 7.404 9.407
132 HG23 ILE 311 HG23 ILE 311 16.265 6.947 7.786
133 HD11 ILE 311 HD11 ILE 311 14.736 3.592 9.811
134 HD12 ILE 311 HD12 ILE 311 14.043 4.849 8.756
135 HD13 ILE 311 HD13 ILE 311 14.171 3.180 8.177
136 H LYS 312 H LYS 312 19.564 5.390 10.853
137 HA LYS 312 HA LYS 312 19.991 8.271 10.840
138 HB2 LYS 312 HB2 LYS 312 20.860 5.968 12.576
139 HB3 LYS 312 HB3 LYS 312 21.675 7.525 12.713
140 HG2 LYS 312 HG2 LYS 312 19.605 8.625 13.310
141 HG3 LYS 312 HG3 LYS 312 18.698 7.122 13.061
142 HD2 LYS 312 HD2 LYS 312 19.085 7.400 15.435
143 HD3 LYS 312 HD3 LYS 312 20.068 6.040 14.867
144 HE2 LYS 312 HE2 LYS 312 21.374 8.741 14.858
145 HE3 LYS 312 HE3 LYS 312 21.030 8.037 16.446
146 HZ1 LYS 312 HZ1 LYS 312 22.339 6.111 15.842
147 HZ2 LYS 312 HZ2 LYS 312 23.253 7.462 15.599
148 HZ3 LYS 312 HZ3 LYS 312 22.602 6.673 14.317
149 H GLU 313 H GLU 313 22.269 5.488 10.780
150 HA GLU 313 HA GLU 313 24.506 7.257 10.382
151 HB2 GLU 313 HB2 GLU 313 24.041 4.330 10.560
152 HB3 GLU 313 HB3 GLU 313 25.539 4.858 9.791
153 HG2 GLU 313 HG2 GLU 313 25.843 4.467 12.221
154 HG3 GLU 313 HG3 GLU 313 26.179 6.139 11.755
155 H LEU 314 H LEU 314 22.519 5.489 7.962
156 HA LEU 314 HA LEU 314 24.506 6.154 5.868
157 HB2 LEU 314 HB2 LEU 314 21.776 4.887 5.859
158 HB3 LEU 314 HB3 LEU 314 22.456 5.509 4.378
159 HG LEU 314 HG LEU 314 22.710 3.104 4.545
160 HD11 LEU 314 HD11 LEU 314 25.058 2.951 3.944
161 HD12 LEU 314 HD12 LEU 314 25.411 4.492 4.757
162 HD13 LEU 314 HD13 LEU 314 24.381 4.462 3.305
163 HD21 LEU 314 HD21 LEU 314 24.557 3.564 6.916
164 HD22 LEU 314 HD22 LEU 314 24.183 2.014 6.129
165 HD23 LEU 314 HD23 LEU 314 22.914 2.889 7.008
166 H GLY 315 H GLY 315 22.042 7.672 7.627
167 HA2 GLY 315 HA2 GLY 315 21.676 9.938 7.672
168 HA3 GLY 315 HA3 GLY 315 22.580 10.116 6.175
169 H GLU 316 H GLU 316 19.741 7.959 6.277
170 HA GLU 316 HA GLU 316 18.539 9.285 4.056
171 HB2 GLU 316 HB2 GLU 316 17.558 7.384 6.160
172 HB3 GLU 316 HB3 GLU 316 16.398 8.121 5.052
173 HG2 GLU 316 HG2 GLU 316 17.117 5.930 4.249
174 HG3 GLU 316 HG3 GLU 316 17.612 7.216 3.134
175 H LEU 317 H LEU 317 18.363 9.890 7.486
176 HA LEU 317 HA LEU 317 16.055 11.535 7.589
177 HB2 LEU 317 HB2 LEU 317 18.646 11.776 9.170
178 HB3 LEU 317 HB3 LEU 317 17.088 12.466 9.627
179 HG LEU 317 HG LEU 317 17.573 9.496 9.377
180 HD11 LEU 317 HD11 LEU 317 17.928 9.596 11.782
181 HD12 LEU 317 HD12 LEU 317 17.728 11.369 11.746
182 HD13 LEU 317 HD13 LEU 317 19.109 10.612 10.915
183 HD21 LEU 317 HD21 LEU 317 15.581 9.495 10.931
184 HD22 LEU 317 HD22 LEU 317 15.230 10.085 9.293
185 HD23 LEU 317 HD23 LEU 317 15.428 11.247 10.626
186 H ARG 318 H ARG 318 19.310 12.223 6.407
187 HA ARG 318 HA ARG 318 18.466 15.062 5.954
188 HB2 ARG 318 HB2 ARG 318 20.784 15.711 6.010
189 HB3 ARG 318 HB3 ARG 318 20.411 14.820 7.480
190 HG2 ARG 318 HG2 ARG 318 21.952 13.226 7.054
191 HG3 ARG 318 HG3 ARG 318 21.474 13.087 5.355
192 HD2 ARG 318 HD2 ARG 318 23.208 15.308 6.466
193 HD3 ARG 318 HD3 ARG 318 23.806 13.863 5.617
194 HE ARG 318 HE ARG 318 21.801 15.096 4.012
195 HH11 ARG 318 HH11 ARG 318 25.124 15.751 5.046
196 HH12 ARG 318 HH12 ARG 318 25.461 16.723 3.640
197 HH21 ARG 318 HH21 ARG 318 22.299 16.325 2.273
198 HH22 ARG 318 HH22 ARG 318 23.884 17.029 2.078
199 H LYS 319 H LYS 319 18.113 12.476 4.332
200 HA LYS 319 HA LYS 319 19.152 13.603 1.743
201 HB2 LYS 319 HB2 LYS 319 19.023 10.700 2.656
202 HB3 LYS 319 HB3 LYS 319 19.227 11.170 0.966
203 HG2 LYS 319 HG2 LYS 319 21.406 11.907 1.282
204 HG3 LYS 319 HG3 LYS 319 21.164 12.214 3.009
205 HD2 LYS 319 HD2 LYS 319 22.562 10.282 2.865
206 HD3 LYS 319 HD3 LYS 319 20.966 9.732 3.369
207 HE2 LYS 319 HE2 LYS 319 20.480 9.048 1.022
208 HE3 LYS 319 HE3 LYS 319 22.160 9.479 0.602
209 HZ1 LYS 319 HZ1 LYS 319 21.214 7.378 2.473
210 HZ2 LYS 319 HZ2 LYS 319 22.766 7.933 2.535
211 HZ3 LYS 319 HZ3 LYS 319 22.200 7.197 1.165
212 H GLU 320 H GLU 320 17.353 10.693 1.683
213 HA GLU 320 HA GLU 320 14.735 12.090 1.528
214 HB2 GLU 320 HB2 GLU 320 15.889 10.054 -0.436
215 HB3 GLU 320 HB3 GLU 320 14.185 10.532 -0.380
216 HG2 GLU 320 HG2 GLU 320 14.824 12.869 -0.888
217 HG3 GLU 320 HG3 GLU 320 16.527 12.383 -0.976
218 HA PRO 321 HA PRO 321 14.308 8.830 4.412
219 HB2 PRO 321 HB2 PRO 321 11.619 8.463 4.626
220 HB3 PRO 321 HB3 PRO 321 12.420 9.970 5.176
221 HG2 PRO 321 HG2 PRO 321 11.046 9.416 2.549
222 HG3 PRO 321 HG3 PRO 321 10.782 10.774 3.690
223 HD2 PRO 321 HD2 PRO 321 12.387 11.027 1.525
224 HD3 PRO 321 HD3 PRO 321 12.794 11.820 3.088
225 H SER 322 H SER 322 13.930 6.602 4.705
226 HA SER 322 HA SER 322 12.676 5.038 2.552
227 HB2 SER 322 HB2 SER 322 15.100 5.332 1.884
228 HB3 SER 322 HB3 SER 322 15.560 4.553 3.413
229 HG SER 322 HG SER 322 15.480 3.019 1.769
230 H LEU 323 H LEU 323 12.370 2.785 3.335
231 HA LEU 323 HA LEU 323 12.727 2.393 6.262
232 HB2 LEU 323 HB2 LEU 323 10.103 2.139 4.728
233 HB3 LEU 323 HB3 LEU 323 10.374 1.516 6.350
234 HG LEU 323 HG LEU 323 10.497 4.454 5.665
235 HD11 LEU 323 HD11 LEU 323 8.364 3.347 5.133
236 HD12 LEU 323 HD12 LEU 323 8.207 4.456 6.518
237 HD13 LEU 323 HD13 LEU 323 8.295 2.693 6.783
238 HD21 LEU 323 HD21 LEU 323 10.107 4.575 8.163
239 HD22 LEU 323 HD22 LEU 323 11.688 3.914 7.697
240 HD23 LEU 323 HD23 LEU 323 10.392 2.813 8.221
Start of MODEL 20
1 H1 THR 298 H1 THR 298 15.179 -16.875 17.508
2 H2 THR 298 H2 THR 298 14.507 -18.119 16.661
3 H3 THR 298 H3 THR 298 15.409 -18.434 18.005
4 HA THR 298 HA THR 298 17.386 -17.556 16.925
5 HB THR 298 HB THR 298 16.416 -19.553 14.946
6 HG1 THR 298 HG1 THR 298 16.195 -21.142 16.621
7 HG21 THR 298 HG21 THR 298 18.355 -20.833 15.837
8 HG22 THR 298 HG22 THR 298 18.610 -19.584 17.076
9 HG23 THR 298 HG23 THR 298 18.830 -19.198 15.348
10 H ASN 299 H ASN 299 18.314 -17.345 14.612
11 HA ASN 299 HA ASN 299 18.452 -16.228 12.661
12 HB2 ASN 299 HB2 ASN 299 15.589 -17.177 12.301
13 HB3 ASN 299 HB3 ASN 299 16.645 -16.575 11.018
14 HD21 ASN 299 HD21 ASN 299 15.908 -18.811 10.260
15 HD22 ASN 299 HD22 ASN 299 17.002 -20.122 10.633
16 H ARG 300 H ARG 300 17.671 -14.512 14.872
17 HA ARG 300 HA ARG 300 15.929 -12.468 13.596
18 HB2 ARG 300 HB2 ARG 300 17.340 -12.659 16.289
19 HB3 ARG 300 HB3 ARG 300 16.501 -11.206 15.746
20 HG2 ARG 300 HG2 ARG 300 15.113 -13.900 15.980
21 HG3 ARG 300 HG3 ARG 300 15.194 -12.723 17.304
22 HD2 ARG 300 HD2 ARG 300 14.112 -11.024 15.825
23 HD3 ARG 300 HD3 ARG 300 13.934 -12.261 14.568
24 HE ARG 300 HE ARG 300 12.776 -13.254 16.954
25 HH11 ARG 300 HH11 ARG 300 12.124 -10.678 14.599
26 HH12 ARG 300 HH12 ARG 300 10.401 -10.745 14.916
27 HH21 ARG 300 HH21 ARG 300 10.576 -13.244 17.283
28 HH22 ARG 300 HH22 ARG 300 9.555 -12.153 16.389
29 H ARG 301 H ARG 301 16.753 -10.334 13.160
30 HA ARG 301 HA ARG 301 19.701 -10.362 12.495
31 HB2 ARG 301 HB2 ARG 301 17.281 -9.172 11.107
32 HB3 ARG 301 HB3 ARG 301 18.887 -8.546 10.817
33 HG2 ARG 301 HG2 ARG 301 18.419 -10.034 9.035
34 HG3 ARG 301 HG3 ARG 301 19.635 -10.810 10.050
35 HD2 ARG 301 HD2 ARG 301 17.827 -12.336 9.164
36 HD3 ARG 301 HD3 ARG 301 18.043 -12.382 10.920
37 HE ARG 301 HE ARG 301 16.058 -10.597 10.809
38 HH11 ARG 301 HH11 ARG 301 16.309 -13.596 8.930
39 HH12 ARG 301 HH12 ARG 301 14.578 -13.765 8.843
40 HH21 ARG 301 HH21 ARG 301 13.953 -10.896 10.703
41 HH22 ARG 301 HH22 ARG 301 13.246 -12.247 9.828
42 H LYS 302 H LYS 302 17.951 -9.415 14.896
43 HA LYS 302 HA LYS 302 18.081 -7.785 16.514
44 HB2 LYS 302 HB2 LYS 302 20.255 -6.366 14.940
45 HB3 LYS 302 HB3 LYS 302 19.928 -6.260 16.665
46 HG2 LYS 302 HG2 LYS 302 21.006 -8.731 15.234
47 HG3 LYS 302 HG3 LYS 302 21.983 -7.544 16.101
48 HD2 LYS 302 HD2 LYS 302 20.826 -8.098 18.208
49 HD3 LYS 302 HD3 LYS 302 19.809 -9.272 17.347
50 HE2 LYS 302 HE2 LYS 302 21.646 -10.435 18.466
51 HE3 LYS 302 HE3 LYS 302 21.823 -10.560 16.705
52 HZ1 LYS 302 HZ1 LYS 302 23.468 -8.775 16.809
53 HZ2 LYS 302 HZ2 LYS 302 23.930 -10.036 17.767
54 HZ3 LYS 302 HZ3 LYS 302 23.309 -8.668 18.447
55 H SEP 303 H SEP 303 16.442 -7.726 14.196
56 HA SEP 303 HA SEP 303 16.638 -5.333 12.663
57 HB2 SEP 303 HB2 SEP 303 14.523 -6.203 11.639
58 HB3 SEP 303 HB3 SEP 303 15.807 -7.420 11.745
59 H GLY 304 H GLY 304 15.034 -3.687 12.322
60 HA2 GLY 304 HA2 GLY 304 13.362 -2.196 12.979
61 HA3 GLY 304 HA3 GLY 304 13.038 -3.192 14.415
62 H LYS 305 H LYS 305 15.061 -3.272 15.980
63 HA LYS 305 HA LYS 305 15.532 -0.539 16.832
64 HB2 LYS 305 HB2 LYS 305 15.573 -2.508 18.389
65 HB3 LYS 305 HB3 LYS 305 17.061 -3.063 17.608
66 HG2 LYS 305 HG2 LYS 305 18.199 -0.968 18.299
67 HG3 LYS 305 HG3 LYS 305 16.708 -0.428 19.093
68 HD2 LYS 305 HD2 LYS 305 16.810 -2.360 20.623
69 HD3 LYS 305 HD3 LYS 305 18.263 -2.949 19.791
70 HE2 LYS 305 HE2 LYS 305 18.957 -1.816 21.815
71 HE3 LYS 305 HE3 LYS 305 19.453 -0.840 20.420
72 HZ1 LYS 305 HZ1 LYS 305 17.070 -0.324 22.114
73 HZ2 LYS 305 HZ2 LYS 305 17.531 0.586 20.818
74 HZ3 LYS 305 HZ3 LYS 305 18.483 0.522 22.161
75 H TYR 306 H TYR 306 17.587 -3.055 15.250
76 HA TYR 306 HA TYR 306 19.709 -1.130 14.773
77 HB2 TYR 306 HB2 TYR 306 20.199 -3.533 14.829
78 HB3 TYR 306 HB3 TYR 306 19.145 -3.794 13.427
79 HD1 TYR 306 HD1 TYR 306 22.229 -1.923 14.516
80 HD2 TYR 306 HD2 TYR 306 19.988 -3.541 11.206
81 HE1 TYR 306 HE1 TYR 306 24.104 -1.373 12.958
82 HE2 TYR 306 HE2 TYR 306 21.858 -2.980 9.670
83 HH TYR 306 HH TYR 306 23.909 -2.012 9.452
84 H LYS 307 H LYS 307 16.894 -2.318 12.879
85 HA LYS 307 HA LYS 307 17.759 -1.234 10.428
86 HB2 LYS 307 HB2 LYS 307 15.842 -2.794 10.675
87 HB3 LYS 307 HB3 LYS 307 14.859 -1.428 11.246
88 HG2 LYS 307 HG2 LYS 307 15.183 -0.250 9.149
89 HG3 LYS 307 HG3 LYS 307 16.348 -1.461 8.595
90 HD2 LYS 307 HD2 LYS 307 14.560 -3.153 8.539
91 HD3 LYS 307 HD3 LYS 307 13.392 -1.916 9.066
92 HE2 LYS 307 HE2 LYS 307 13.961 -0.543 7.086
93 HE3 LYS 307 HE3 LYS 307 15.113 -1.782 6.554
94 HZ1 LYS 307 HZ1 LYS 307 12.995 -1.945 5.418
95 HZ2 LYS 307 HZ2 LYS 307 12.188 -2.162 6.840
96 HZ3 LYS 307 HZ3 LYS 307 13.262 -3.307 6.312
97 H LYS 308 H LYS 308 15.963 0.401 13.075
98 HA LYS 308 HA LYS 308 15.690 2.790 11.436
99 HB2 LYS 308 HB2 LYS 308 15.202 2.277 14.378
100 HB3 LYS 308 HB3 LYS 308 14.949 3.852 13.589
101 HG2 LYS 308 HG2 LYS 308 13.454 2.717 11.922
102 HG3 LYS 308 HG3 LYS 308 13.597 1.225 12.856
103 HD2 LYS 308 HD2 LYS 308 12.569 2.342 14.798
104 HD3 LYS 308 HD3 LYS 308 12.423 3.840 13.840
105 HE2 LYS 308 HE2 LYS 308 11.075 2.587 12.144
106 HE3 LYS 308 HE3 LYS 308 11.160 1.143 13.166
107 HZ1 LYS 308 HZ1 LYS 308 9.883 3.708 13.923
108 HZ2 LYS 308 HZ2 LYS 308 9.964 2.368 14.882
109 HZ3 LYS 308 HZ3 LYS 308 9.091 2.329 13.483
110 H VAL 309 H VAL 309 18.210 1.507 13.457
111 HA VAL 309 HA VAL 309 19.646 4.040 13.701
112 HB VAL 309 HB VAL 309 20.134 1.170 14.392
113 HG11 VAL 309 HG11 VAL 309 22.609 1.517 14.668
114 HG12 VAL 309 HG12 VAL 309 22.097 1.427 12.976
115 HG13 VAL 309 HG13 VAL 309 22.473 3.007 13.709
116 HG21 VAL 309 HG21 VAL 309 19.474 2.875 16.027
117 HG22 VAL 309 HG22 VAL 309 21.066 2.183 16.410
118 HG23 VAL 309 HG23 VAL 309 20.958 3.795 15.657
119 H GLU 310 H GLU 310 19.537 1.258 11.507
120 HA GLU 310 HA GLU 310 21.728 1.798 9.841
121 HB2 GLU 310 HB2 GLU 310 20.146 -0.198 10.005
122 HB3 GLU 310 HB3 GLU 310 19.033 0.712 8.993
123 HG2 GLU 310 HG2 GLU 310 20.722 0.780 7.217
124 HG3 GLU 310 HG3 GLU 310 21.778 -0.233 8.225
125 H ILE 311 H ILE 311 18.492 3.243 9.882
126 HA ILE 311 HA ILE 311 18.541 4.543 7.373
127 HB ILE 311 HB ILE 311 17.296 5.524 9.993
128 HG12 ILE 311 HG12 ILE 311 15.979 4.071 7.665
129 HG13 ILE 311 HG13 ILE 311 16.524 3.276 9.138
130 HG21 ILE 311 HG21 ILE 311 15.850 6.983 8.637
131 HG22 ILE 311 HG22 ILE 311 17.537 7.359 8.265
132 HG23 ILE 311 HG23 ILE 311 16.581 6.381 7.136
133 HD11 ILE 311 HD11 ILE 311 14.188 3.613 9.417
134 HD12 ILE 311 HD12 ILE 311 14.966 4.846 10.432
135 HD13 ILE 311 HD13 ILE 311 14.276 5.294 8.851
136 H LYS 312 H LYS 312 19.868 5.483 10.528
137 HA LYS 312 HA LYS 312 20.890 8.034 9.479
138 HB2 LYS 312 HB2 LYS 312 20.056 7.668 11.844
139 HB3 LYS 312 HB3 LYS 312 21.453 6.632 12.124
140 HG2 LYS 312 HG2 LYS 312 22.460 9.092 11.073
141 HG3 LYS 312 HG3 LYS 312 21.241 9.511 12.283
142 HD2 LYS 312 HD2 LYS 312 23.285 9.372 13.484
143 HD3 LYS 312 HD3 LYS 312 22.431 7.862 13.855
144 HE2 LYS 312 HE2 LYS 312 23.772 6.705 12.101
145 HE3 LYS 312 HE3 LYS 312 24.646 8.212 11.784
146 HZ1 LYS 312 HZ1 LYS 312 24.631 6.740 14.351
147 HZ2 LYS 312 HZ2 LYS 312 25.506 8.109 14.033
148 HZ3 LYS 312 HZ3 LYS 312 25.841 6.691 13.242
149 H GLU 313 H GLU 313 22.160 4.823 10.409
150 HA GLU 313 HA GLU 313 24.901 5.551 10.259
151 HB2 GLU 313 HB2 GLU 313 23.411 3.313 10.950
152 HB3 GLU 313 HB3 GLU 313 24.361 2.758 9.570
153 HG2 GLU 313 HG2 GLU 313 25.519 2.328 11.690
154 HG3 GLU 313 HG3 GLU 313 26.426 3.476 10.689
155 H LEU 314 H LEU 314 22.837 4.111 7.651
156 HA LEU 314 HA LEU 314 25.192 4.172 5.846
157 HB2 LEU 314 HB2 LEU 314 22.251 3.613 5.294
158 HB3 LEU 314 HB3 LEU 314 23.566 3.400 4.143
159 HG LEU 314 HG LEU 314 23.200 1.809 6.705
160 HD11 LEU 314 HD11 LEU 314 21.505 1.308 4.997
161 HD12 LEU 314 HD12 LEU 314 22.640 -0.040 5.171
162 HD13 LEU 314 HD13 LEU 314 22.783 1.063 3.780
163 HD21 LEU 314 HD21 LEU 314 25.574 1.963 6.152
164 HD22 LEU 314 HD22 LEU 314 25.239 1.538 4.456
165 HD23 LEU 314 HD23 LEU 314 24.977 0.343 5.747
166 H GLY 315 H GLY 315 22.589 6.128 6.843
167 HA2 GLY 315 HA2 GLY 315 21.929 8.234 6.407
168 HA3 GLY 315 HA3 GLY 315 23.532 8.496 5.750
169 H GLU 316 H GLU 316 22.267 6.282 3.606
170 HA GLU 316 HA GLU 316 21.395 8.385 1.753
171 HB2 GLU 316 HB2 GLU 316 22.690 6.425 0.976
172 HB3 GLU 316 HB3 GLU 316 21.413 5.351 1.550
173 HG2 GLU 316 HG2 GLU 316 21.245 5.612 -0.841
174 HG3 GLU 316 HG3 GLU 316 19.844 6.333 -0.049
175 H LEU 317 H LEU 317 20.157 5.919 3.873
176 HA LEU 317 HA LEU 317 17.435 5.946 3.018
177 HB2 LEU 317 HB2 LEU 317 18.874 5.030 5.484
178 HB3 LEU 317 HB3 LEU 317 17.108 5.057 5.440
179 HG LEU 317 HG LEU 317 17.327 3.590 3.336
180 HD11 LEU 317 HD11 LEU 317 19.378 2.101 3.533
181 HD12 LEU 317 HD12 LEU 317 20.073 3.340 4.611
182 HD13 LEU 317 HD13 LEU 317 19.697 3.733 2.913
183 HD21 LEU 317 HD21 LEU 317 17.294 1.674 4.834
184 HD22 LEU 317 HD22 LEU 317 16.483 3.059 5.606
185 HD23 LEU 317 HD23 LEU 317 18.134 2.610 6.095
186 H ARG 318 H ARG 318 19.315 8.225 4.831
187 HA ARG 318 HA ARG 318 17.190 9.476 6.307
188 HB2 ARG 318 HB2 ARG 318 19.705 10.600 5.018
189 HB3 ARG 318 HB3 ARG 318 18.615 11.573 5.993
190 HG2 ARG 318 HG2 ARG 318 20.120 9.125 6.984
191 HG3 ARG 318 HG3 ARG 318 20.603 10.805 7.247
192 HD2 ARG 318 HD2 ARG 318 18.080 9.451 8.270
193 HD3 ARG 318 HD3 ARG 318 19.471 9.956 9.238
194 HE ARG 318 HE ARG 318 17.297 11.621 8.198
195 HH11 ARG 318 HH11 ARG 318 20.585 11.712 9.493
196 HH12 ARG 318 HH12 ARG 318 20.449 13.385 9.960
197 HH21 ARG 318 HH21 ARG 318 17.204 13.744 8.810
198 HH22 ARG 318 HH22 ARG 318 18.568 14.514 9.576
199 H LYS 319 H LYS 319 18.116 9.489 2.920
200 HA LYS 319 HA LYS 319 16.290 11.698 2.231
201 HB2 LYS 319 HB2 LYS 319 18.551 11.271 1.163
202 HB3 LYS 319 HB3 LYS 319 17.891 9.781 0.507
203 HG2 LYS 319 HG2 LYS 319 16.082 11.356 -0.557
204 HG3 LYS 319 HG3 LYS 319 17.289 12.620 -0.246
205 HD2 LYS 319 HD2 LYS 319 17.814 11.868 -2.432
206 HD3 LYS 319 HD3 LYS 319 18.964 10.980 -1.401
207 HE2 LYS 319 HE2 LYS 319 17.260 9.099 -1.323
208 HE3 LYS 319 HE3 LYS 319 16.330 9.972 -2.540
209 HZ1 LYS 319 HZ1 LYS 319 18.314 9.763 -3.979
210 HZ2 LYS 319 HZ2 LYS 319 17.608 8.323 -3.573
211 HZ3 LYS 319 HZ3 LYS 319 19.016 8.794 -2.830
212 H GLU 320 H GLU 320 16.581 8.152 1.768
213 HA GLU 320 HA GLU 320 13.644 8.056 1.149
214 HB2 GLU 320 HB2 GLU 320 15.949 6.634 -0.176
215 HB3 GLU 320 HB3 GLU 320 14.334 5.909 -0.142
216 HG2 GLU 320 HG2 GLU 320 13.390 7.862 -1.271
217 HG3 GLU 320 HG3 GLU 320 14.967 8.655 -1.260
218 HA PRO 321 HA PRO 321 14.646 5.615 4.856
219 HB2 PRO 321 HB2 PRO 321 12.387 6.036 6.298
220 HB3 PRO 321 HB3 PRO 321 13.648 7.300 6.122
221 HG2 PRO 321 HG2 PRO 321 11.111 6.936 4.538
222 HG3 PRO 321 HG3 PRO 321 11.702 8.398 5.395
223 HD2 PRO 321 HD2 PRO 321 12.104 8.040 2.743
224 HD3 PRO 321 HD3 PRO 321 13.348 8.819 3.782
225 H SER 322 H SER 322 13.767 3.770 5.954
226 HA SER 322 HA SER 322 11.539 2.338 4.623
227 HB2 SER 322 HB2 SER 322 13.718 1.608 3.547
228 HB3 SER 322 HB3 SER 322 14.282 1.106 5.155
229 HG SER 322 HG SER 322 12.236 0.032 3.540
230 H LEU 323 H LEU 323 10.654 0.739 6.143
231 HA LEU 323 HA LEU 323 11.477 1.284 8.961
232 HB2 LEU 323 HB2 LEU 323 9.221 1.326 9.637
233 HB3 LEU 323 HB3 LEU 323 9.322 2.382 8.238
234 HG LEU 323 HG LEU 323 8.197 -0.426 8.150
235 HD11 LEU 323 HD11 LEU 323 6.906 2.293 8.505
236 HD12 LEU 323 HD12 LEU 323 7.142 1.077 9.782
237 HD13 LEU 323 HD13 LEU 323 6.060 0.725 8.412
238 HD21 LEU 323 HD21 LEU 323 8.730 0.303 5.930
239 HD22 LEU 323 HD22 LEU 323 8.160 1.956 6.264
240 HD23 LEU 323 HD23 LEU 323 6.997 0.607 6.144