Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
600856 | 2n5k RC | 25719 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 SER 299 HN SER 299 6.675 12.289 -1.100
2 HA SER 299 HA SER 299 6.493 12.988 -3.875
3 HB2 SER 299 1HB SER 299 9.055 12.296 -3.685
4 HB3 SER 299 2HB SER 299 8.455 13.817 -3.002
5 HG SER 299 HG SER 299 8.710 13.062 -1.028
6 H GLU 300 HN GLU 300 6.881 10.040 -2.039
7 HA GLU 300 HA GLU 300 7.173 8.514 -4.535
8 HB2 GLU 300 3HB GLU 300 7.789 6.613 -2.997
9 HB3 GLU 300 2HB GLU 300 8.922 7.973 -3.017
10 HG2 GLU 300 3HG GLU 300 6.768 7.919 -0.954
11 HG3 GLU 300 2HG GLU 300 8.181 6.872 -0.764
12 HE2 GLU 300 HE GLU 300 8.710 10.293 0.617
13 H HIS 301 HN HIS 301 4.740 9.267 -4.556
14 HA HIS 301 HA HIS 301 2.901 7.844 -2.927
15 HB2 HIS 301 3HB HIS 301 2.595 9.283 -5.567
16 HB3 HIS 301 2HB HIS 301 1.237 8.549 -4.707
17 HD1 HIS 301 1HD HIS 301 0.762 11.371 -5.004
18 HD2 HIS 301 2HD HIS 301 3.210 9.982 -1.947
19 HE1 HIS 301 1HE HIS 301 0.800 13.207 -3.286
20 HE2 HIS 301 2HE HIS 301 2.296 12.359 -1.417
21 H ARG 302 HN ARG 302 4.313 7.258 -6.103
22 HA ARG 302 HA ARG 302 3.015 4.612 -6.121
23 HB2 ARG 302 3HB ARG 302 3.478 4.708 -8.632
24 HB3 ARG 302 2HB ARG 302 2.195 5.754 -8.007
25 HG2 ARG 302 3HG ARG 302 3.599 7.688 -8.121
26 HG3 ARG 302 2HG ARG 302 5.007 6.690 -8.521
27 HD2 ARG 302 3HD ARG 302 4.042 6.068 -10.647
28 HD3 ARG 302 2HD ARG 302 2.535 6.897 -10.234
29 HE ARG 302 HE ARG 302 4.724 8.695 -10.132
30 HH11 ARG 302 2HH1 ARG 302 2.649 7.000 -12.355
31 HH12 ARG 302 1HH1 ARG 302 2.821 8.176 -13.616
32 HH21 ARG 302 2HH2 ARG 302 4.959 10.250 -11.784
33 HH22 ARG 302 1HH2 ARG 302 4.136 10.024 -13.290
34 H LYS 303 HN LYS 303 5.986 6.381 -6.309
35 HA LYS 303 HA LYS 303 7.723 4.553 -7.435
36 HB2 LYS 303 3HB LYS 303 8.285 6.350 -5.064
37 HB3 LYS 303 2HB LYS 303 9.493 5.638 -6.145
38 HG2 LYS 303 3HG LYS 303 7.390 7.663 -6.917
39 HG3 LYS 303 2HG LYS 303 9.120 7.972 -6.687
40 HD2 LYS 303 3HD LYS 303 9.501 6.181 -8.490
41 HD3 LYS 303 2HD LYS 303 7.776 6.377 -8.849
42 HE2 LYS 303 3HE LYS 303 9.567 8.784 -8.701
43 HE3 LYS 303 2HE LYS 303 9.529 7.781 -10.159
44 HZ1 LYS 303 3HZ LYS 303 6.952 8.103 -9.846
45 HZ2 LYS 303 1HZ LYS 303 7.892 9.255 -10.653
46 HZ3 LYS 303 2HZ LYS 303 7.448 9.505 -9.041
47 H GLN 304 HN GLN 304 7.260 4.970 -3.920
48 HA GLN 304 HA GLN 304 8.271 2.274 -3.486
49 HB2 GLN 304 3HB GLN 304 7.789 4.673 -1.775
50 HB3 GLN 304 2HB GLN 304 7.788 3.079 -1.006
51 HG2 GLN 304 3HG GLN 304 10.055 3.678 -2.816
52 HG3 GLN 304 2HG GLN 304 9.986 4.563 -1.285
53 HE21 GLN 304 1HE2 GLN 304 9.582 3.169 0.667
54 HE22 GLN 304 2HE2 GLN 304 10.426 1.663 0.738
55 HA PRO 305 HA PRO 305 4.417 0.309 -2.769
56 HB2 PRO 305 3HB PRO 305 4.974 -1.333 -0.649
57 HB3 PRO 305 2HB PRO 305 5.590 -1.604 -2.278
58 HG2 PRO 305 3HG PRO 305 6.925 -0.292 0.067
59 HG3 PRO 305 2HG PRO 305 7.584 -1.515 -1.084
60 HD2 PRO 305 3HD PRO 305 8.161 1.132 -1.269
61 HD3 PRO 305 2HD PRO 305 8.011 0.084 -2.689
62 H CYS 306 HN CYS 306 3.013 -0.459 -0.705
63 HA CYS 306 HA CYS 306 1.840 1.799 0.361
64 HB2 CYS 306 3HB CYS 306 1.618 -1.062 0.712
65 HB3 CYS 306 2HB CYS 306 1.418 -0.236 2.258
66 HA PRO 307 HA PRO 307 4.276 3.200 3.729
67 HB2 PRO 307 3HB PRO 307 2.372 3.927 5.560
68 HB3 PRO 307 2HB PRO 307 2.686 4.823 4.074
69 HG2 PRO 307 3HG PRO 307 0.578 2.768 4.645
70 HG3 PRO 307 2HG PRO 307 0.422 4.359 3.813
71 HD2 PRO 307 3HD PRO 307 0.545 2.007 2.464
72 HD3 PRO 307 2HD PRO 307 1.232 3.512 1.829
73 H TYR 308 HN TYR 308 1.802 0.804 4.487
74 HA TYR 308 HA TYR 308 3.509 -0.175 6.682
75 HB2 TYR 308 3HB TYR 308 0.498 -0.170 6.412
76 HB3 TYR 308 2HB TYR 308 1.350 -1.155 7.603
77 HD1 TYR 308 2HD TYR 308 3.045 0.143 9.144
78 HD2 TYR 308 1HD TYR 308 -0.175 1.966 7.044
79 HE1 TYR 308 2HE TYR 308 3.102 2.037 10.713
80 HE2 TYR 308 1HE TYR 308 -0.127 3.866 8.606
81 HH TYR 308 HH TYR 308 0.775 4.706 10.456
82 H GLY 309 HN GLY 309 1.242 -1.117 4.120
83 HA2 GLY 309 2HA GLY 309 1.230 -2.975 2.760
84 HA3 GLY 309 3HA GLY 309 2.825 -3.368 3.384
85 H LYS 310 HN LYS 310 3.041 -4.834 5.037
86 HA LYS 310 HA LYS 310 0.937 -6.717 5.351
87 HB2 LYS 310 3HB LYS 310 2.478 -7.765 7.035
88 HB3 LYS 310 2HB LYS 310 3.186 -7.518 5.431
89 HG2 LYS 310 3HG LYS 310 4.464 -5.659 6.167
90 HG3 LYS 310 2HG LYS 310 3.588 -5.597 7.708
91 HD2 LYS 310 3HD LYS 310 4.493 -7.843 8.273
92 HD3 LYS 310 2HD LYS 310 5.449 -7.786 6.781
93 HE2 LYS 310 3HE LYS 310 6.394 -5.572 7.676
94 HE3 LYS 310 2HE LYS 310 5.694 -6.058 9.226
95 HZ1 LYS 310 3HZ LYS 310 7.138 -7.817 9.435
96 HZ2 LYS 310 1HZ LYS 310 8.127 -6.676 8.672
97 HZ3 LYS 310 2HZ LYS 310 7.436 -7.932 7.774
98 H LYS 311 HN LYS 311 2.142 -4.057 7.291
99 HA LYS 311 HA LYS 311 0.495 -4.742 9.567
100 HB2 LYS 311 3HB LYS 311 2.258 -2.366 8.943
101 HB3 LYS 311 2HB LYS 311 1.331 -2.526 10.443
102 HG2 LYS 311 3HG LYS 311 2.587 -4.390 11.159
103 HG3 LYS 311 2HG LYS 311 3.313 -4.599 9.555
104 HD2 LYS 311 3HD LYS 311 5.032 -3.577 10.721
105 HD3 LYS 311 2HD LYS 311 4.236 -2.196 9.946
106 HE2 LYS 311 3HE LYS 311 3.448 -3.091 12.711
107 HE3 LYS 311 2HE LYS 311 4.835 -2.025 12.446
108 HZ1 LYS 311 3HZ LYS 311 2.011 -1.449 12.248
109 HZ2 LYS 311 1HZ LYS 311 2.942 -0.813 10.986
110 HZ3 LYS 311 2HZ LYS 311 3.306 -0.415 12.590
111 H CYS 312 HN CYS 312 0.169 -2.953 6.672
112 HA CYS 312 HA CYS 312 -1.579 -0.920 7.320
113 HB2 CYS 312 3HB CYS 312 -0.545 -1.668 5.032
114 HB3 CYS 312 2HB CYS 312 -2.055 -2.568 4.861
115 H THR 313 HN THR 313 -3.765 -0.730 7.628
116 HA THR 313 HA THR 313 -5.130 -3.140 8.496
117 HB THR 313 HB THR 313 -6.885 -1.624 9.313
118 HG1 THR 313 1HG THR 313 -7.015 0.319 8.505
119 HG21 THR 313 3HG2 THR 313 -4.036 -1.299 10.063
120 HG22 THR 313 1HG2 THR 313 -5.406 -1.847 11.029
121 HG23 THR 313 2HG2 THR 313 -5.174 -0.125 10.724
122 H TYR 314 HN TYR 314 -5.299 -0.785 5.911
123 HA TYR 314 HA TYR 314 -7.849 -1.381 4.920
124 HB2 TYR 314 3HB TYR 314 -5.475 -0.607 3.218
125 HB3 TYR 314 2HB TYR 314 -7.181 -0.272 2.912
126 HD1 TYR 314 2HD TYR 314 -8.158 0.803 5.421
127 HD2 TYR 314 1HD TYR 314 -4.425 1.455 3.486
128 HE1 TYR 314 2HE TYR 314 -7.962 2.981 6.546
129 HE2 TYR 314 1HE TYR 314 -4.219 3.635 4.607
130 HH TYR 314 HH TYR 314 -6.523 5.301 5.827
131 H GLY 315 HN GLY 315 -4.690 -2.576 3.755
132 HA2 GLY 315 2HA GLY 315 -4.113 -4.626 2.873
133 HA3 GLY 315 3HA GLY 315 -5.680 -5.231 3.391
134 H ILE 316 HN ILE 316 -7.542 -4.731 2.018
135 HA ILE 316 HA ILE 316 -6.763 -4.829 -0.802
136 HB ILE 316 HB ILE 316 -9.462 -5.408 0.422
137 HG12 ILE 316 1HG1 ILE 316 -7.345 -7.358 -0.518
138 HG13 ILE 316 2HG1 ILE 316 -7.644 -6.952 1.181
139 HG21 ILE 316 1HG2 ILE 316 -9.205 -6.765 -1.980
140 HG22 ILE 316 2HG2 ILE 316 -10.151 -5.306 -1.692
141 HG23 ILE 316 3HG2 ILE 316 -8.501 -5.180 -2.299
142 HD11 ILE 316 3HD1 ILE 316 -10.135 -7.672 0.158
143 HD12 ILE 316 1HD1 ILE 316 -8.995 -8.849 -0.493
144 HD13 ILE 316 2HD1 ILE 316 -9.110 -8.603 1.250
145 H LYS 317 HN LYS 317 -8.282 -2.783 1.503
146 HA LYS 317 HA LYS 317 -9.430 -1.089 -0.598
147 HB2 LYS 317 3HB LYS 317 -10.587 0.085 1.211
148 HB3 LYS 317 2HB LYS 317 -10.907 -1.656 1.273
149 HG2 LYS 317 3HG LYS 317 -9.027 -1.783 2.995
150 HG3 LYS 317 2HG LYS 317 -9.159 -0.018 3.078
151 HD2 LYS 317 3HD LYS 317 -10.564 -0.704 4.796
152 HD3 LYS 317 2HD LYS 317 -11.685 -0.457 3.445
153 HE2 LYS 317 3HE LYS 317 -11.695 -2.842 2.959
154 HE3 LYS 317 2HE LYS 317 -10.493 -3.115 4.228
155 HZ1 LYS 317 3HZ LYS 317 -12.103 -3.254 5.721
156 HZ2 LYS 317 1HZ LYS 317 -13.255 -3.095 4.491
157 HZ3 LYS 317 2HZ LYS 317 -12.694 -1.724 5.307
158 H CYS 318 HN CYS 318 -6.560 -1.292 -0.165
159 HA CYS 318 HA CYS 318 -5.842 1.257 1.056
160 HB2 CYS 318 3HB CYS 318 -4.492 -0.782 1.506
161 HB3 CYS 318 2HB CYS 318 -4.065 -0.842 -0.205
162 H ARG 319 HN ARG 319 -4.923 2.970 -0.040
163 HA ARG 319 HA ARG 319 -5.619 3.159 -2.838
164 HB2 ARG 319 3HB ARG 319 -5.735 4.966 -0.884
165 HB3 ARG 319 2HB ARG 319 -4.099 5.319 -1.463
166 HG2 ARG 319 3HG ARG 319 -5.612 6.798 -2.569
167 HG3 ARG 319 2HG ARG 319 -5.030 5.611 -3.748
168 HD2 ARG 319 3HD ARG 319 -7.065 4.414 -3.730
169 HD3 ARG 319 2HD ARG 319 -7.602 5.219 -2.249
170 HE ARG 319 HE ARG 319 -7.314 7.236 -4.079
171 HH11 ARG 319 2HH1 ARG 319 -9.128 4.270 -3.905
172 HH12 ARG 319 1HH1 ARG 319 -10.433 4.858 -4.882
173 HH21 ARG 319 2HH2 ARG 319 -9.026 8.022 -5.367
174 HH22 ARG 319 1HH2 ARG 319 -10.373 6.991 -5.714
175 H PHE 320 HN PHE 320 -2.737 2.818 -0.894
176 HA PHE 320 HA PHE 320 -0.928 3.391 -3.059
177 HB2 PHE 320 3HB PHE 320 -0.710 2.660 -0.196
178 HB3 PHE 320 2HB PHE 320 0.625 2.136 -1.224
179 HD1 PHE 320 2HD PHE 320 -1.446 5.219 -0.820
180 HD2 PHE 320 1HD PHE 320 2.432 3.531 -1.295
181 HE1 PHE 320 2HE PHE 320 -0.458 7.470 -0.717
182 HE2 PHE 320 1HE PHE 320 3.427 5.779 -1.192
183 HZ PHE 320 HZ PHE 320 1.982 7.753 -0.904
184 H PHE 321 HN PHE 321 0.869 1.676 -3.450
185 HA PHE 321 HA PHE 321 -0.492 -0.715 -4.395
186 HB2 PHE 321 3HB PHE 321 1.169 0.762 -5.744
187 HB3 PHE 321 2HB PHE 321 2.416 -0.104 -4.845
188 HD1 PHE 321 1HD PHE 321 -0.366 -0.535 -7.228
189 HD2 PHE 321 2HD PHE 321 3.026 -2.321 -5.378
190 HE1 PHE 321 1HE PHE 321 -0.480 -2.400 -8.828
191 HE2 PHE 321 2HE PHE 321 2.918 -4.189 -6.976
192 HZ PHE 321 HZ PHE 321 1.164 -4.229 -8.705
193 H HIS 322 HN HIS 322 -0.408 -2.608 -3.389
194 HA HIS 322 HA HIS 322 1.391 -2.924 -1.115
195 HB2 HIS 322 3HB HIS 322 -1.118 -4.263 -2.044
196 HB3 HIS 322 2HB HIS 322 -0.031 -5.152 -0.973
197 HD1 HIS 322 1HD HIS 322 0.026 -4.501 1.477
198 HD2 HIS 322 2HD HIS 322 -2.289 -1.943 -0.838
199 HE1 HIS 322 1HE HIS 322 -1.212 -3.048 3.114
200 HE2 HIS 322 2HE HIS 322 -2.626 -1.483 1.700
201 HA PRO 323 HA PRO 323 4.204 -5.669 -3.064
202 HB2 PRO 323 3HB PRO 323 4.805 -7.389 -1.019
203 HB3 PRO 323 2HB PRO 323 5.359 -5.717 -1.078
204 HG2 PRO 323 3HG PRO 323 3.009 -6.891 0.368
205 HG3 PRO 323 2HG PRO 323 4.241 -5.716 0.961
206 HD2 PRO 323 3HD PRO 323 1.757 -4.959 0.167
207 HD3 PRO 323 2HD PRO 323 3.189 -3.943 -0.070
208 H GLU 324 HN GLU 324 1.518 -7.163 -1.320
209 HA GLU 324 HA GLU 324 1.699 -9.501 -3.093
210 HB2 GLU 324 3HB GLU 324 0.142 -9.189 -0.515
211 HB3 GLU 324 2HB GLU 324 0.324 -10.675 -1.460
212 HG2 GLU 324 3HG GLU 324 2.583 -10.914 -0.893
213 HG3 GLU 324 2HG GLU 324 2.698 -9.242 -0.329
214 HE2 GLU 324 HE GLU 324 1.476 -11.999 2.184
215 H ARG 325 HN ARG 325 -0.284 -6.808 -2.170
216 HA ARG 325 HA ARG 325 -2.390 -7.738 -4.009
217 HB2 ARG 325 3HB ARG 325 -2.479 -6.161 -1.466
218 HB3 ARG 325 2HB ARG 325 -3.718 -5.877 -2.698
219 HG2 ARG 325 3HG ARG 325 -3.243 -8.709 -2.057
220 HG3 ARG 325 2HG ARG 325 -3.906 -7.730 -0.739
221 HD2 ARG 325 3HD ARG 325 -5.872 -8.309 -1.730
222 HD3 ARG 325 2HD ARG 325 -5.494 -6.876 -2.697
223 HE ARG 325 HE ARG 325 -5.307 -8.233 -4.514
224 HH11 ARG 325 2HH1 ARG 325 -4.816 -10.154 -1.652
225 HH12 ARG 325 1HH1 ARG 325 -4.700 -11.650 -2.518
226 HH21 ARG 325 2HH2 ARG 325 -5.156 -10.197 -5.666
227 HH22 ARG 325 1HH2 ARG 325 -4.893 -11.673 -4.801
228 HA PRO 326 HA PRO 326 -1.707 -4.321 -6.673
229 HB2 PRO 326 3HB PRO 326 -4.253 -3.647 -7.426
230 HB3 PRO 326 2HB PRO 326 -3.433 -5.110 -7.968
231 HG2 PRO 326 3HG PRO 326 -5.398 -4.749 -5.732
232 HG3 PRO 326 2HG PRO 326 -5.336 -6.030 -6.999
233 HD2 PRO 326 3HD PRO 326 -4.460 -6.434 -4.462
234 HD3 PRO 326 2HD PRO 326 -3.708 -7.206 -5.869
235 H SER 327 HN SER 327 -4.440 -3.677 -4.471
236 HA SER 327 HA SER 327 -3.236 -1.367 -3.356
237 HB2 SER 327 1HB SER 327 -4.079 -0.712 -5.778
238 HB3 SER 327 2HB SER 327 -5.647 -0.614 -4.959
239 HG SER 327 HG SER 327 -3.489 1.063 -4.800
Start of MODEL 2
1 H1 SER 299 HN SER 299 9.111 12.790 -1.417
2 HA SER 299 HA SER 299 7.701 12.597 -3.365
3 HB2 SER 299 1HB SER 299 10.648 12.485 -4.072
4 HB3 SER 299 2HB SER 299 9.364 12.895 -5.224
5 HG SER 299 HG SER 299 8.791 14.620 -3.742
6 H GLU 300 HN GLU 300 7.731 10.002 -2.279
7 HA GLU 300 HA GLU 300 7.932 8.401 -4.740
8 HB2 GLU 300 3HB GLU 300 8.405 6.433 -3.180
9 HB3 GLU 300 2HB GLU 300 9.718 7.590 -3.445
10 HG2 GLU 300 3HG GLU 300 7.887 7.921 -1.102
11 HG3 GLU 300 2HG GLU 300 9.206 6.742 -1.050
12 HE2 GLU 300 HE GLU 300 10.206 10.226 -0.055
13 H HIS 301 HN HIS 301 5.611 9.628 -4.242
14 HA HIS 301 HA HIS 301 3.848 8.038 -2.624
15 HB2 HIS 301 3HB HIS 301 3.421 10.414 -2.875
16 HB3 HIS 301 2HB HIS 301 3.289 10.233 -4.627
17 HD1 HIS 301 1HD HIS 301 1.333 9.923 -1.515
18 HD2 HIS 301 2HD HIS 301 0.918 8.900 -5.519
19 HE1 HIS 301 1HE HIS 301 -1.105 9.391 -1.824
20 HE2 HIS 301 2HE HIS 301 -1.360 8.766 -4.271
21 H ARG 302 HN ARG 302 4.867 8.084 -5.937
22 HA ARG 302 HA ARG 302 2.976 5.899 -6.515
23 HB2 ARG 302 3HB ARG 302 2.915 6.619 -8.845
24 HB3 ARG 302 2HB ARG 302 2.381 7.921 -7.771
25 HG2 ARG 302 3HG ARG 302 4.165 9.250 -8.233
26 HG3 ARG 302 2HG ARG 302 5.246 7.874 -8.513
27 HD2 ARG 302 3HD ARG 302 4.716 9.192 -10.572
28 HD3 ARG 302 2HD ARG 302 4.307 7.474 -10.672
29 HE ARG 302 HE ARG 302 2.061 8.937 -9.793
30 HH11 ARG 302 2HH1 ARG 302 3.987 8.360 -12.635
31 HH12 ARG 302 1HH1 ARG 302 2.686 8.665 -13.737
32 HH21 ARG 302 2HH2 ARG 302 0.339 9.341 -11.234
33 HH22 ARG 302 1HH2 ARG 302 0.611 9.224 -12.939
34 H LYS 303 HN LYS 303 5.758 5.880 -5.478
35 HA LYS 303 HA LYS 303 6.960 4.257 -7.623
36 HB2 LYS 303 3HB LYS 303 8.544 5.816 -5.577
37 HB3 LYS 303 2HB LYS 303 9.140 5.021 -7.044
38 HG2 LYS 303 3HG LYS 303 7.270 7.391 -7.028
39 HG3 LYS 303 2HG LYS 303 9.030 7.486 -7.221
40 HD2 LYS 303 3HD LYS 303 8.862 6.030 -9.225
41 HD3 LYS 303 2HD LYS 303 7.098 6.065 -9.053
42 HE2 LYS 303 3HE LYS 303 7.008 8.414 -9.464
43 HE3 LYS 303 2HE LYS 303 8.767 8.555 -9.335
44 HZ1 LYS 303 3HZ LYS 303 7.153 7.741 -11.582
45 HZ2 LYS 303 1HZ LYS 303 8.496 6.750 -11.309
46 HZ3 LYS 303 2HZ LYS 303 8.705 8.412 -11.550
47 H GLN 304 HN GLN 304 7.208 4.879 -4.116
48 HA GLN 304 HA GLN 304 8.095 2.193 -3.600
49 HB2 GLN 304 3HB GLN 304 7.529 4.622 -1.949
50 HB3 GLN 304 2HB GLN 304 7.609 3.044 -1.149
51 HG2 GLN 304 3HG GLN 304 9.807 4.078 -2.929
52 HG3 GLN 304 2HG GLN 304 9.739 4.393 -1.189
53 HE21 GLN 304 1HE2 GLN 304 9.666 2.510 0.236
54 HE22 GLN 304 2HE2 GLN 304 10.513 1.080 -0.233
55 HA PRO 305 HA PRO 305 4.281 0.166 -2.842
56 HB2 PRO 305 3HB PRO 305 4.871 -1.411 -0.683
57 HB3 PRO 305 2HB PRO 305 5.494 -1.709 -2.304
58 HG2 PRO 305 3HG PRO 305 6.799 -0.314 0.008
59 HG3 PRO 305 2HG PRO 305 7.485 -1.550 -1.113
60 HD2 PRO 305 3HD PRO 305 8.004 1.103 -1.361
61 HD3 PRO 305 2HD PRO 305 7.879 0.018 -2.757
62 H CYS 306 HN CYS 306 2.913 -0.595 -0.734
63 HA CYS 306 HA CYS 306 1.673 1.657 0.264
64 HB2 CYS 306 3HB CYS 306 1.551 -1.196 0.713
65 HB3 CYS 306 2HB CYS 306 1.331 -0.325 2.232
66 HA PRO 307 HA PRO 307 4.079 3.251 3.566
67 HB2 PRO 307 3HB PRO 307 2.164 3.965 5.391
68 HB3 PRO 307 2HB PRO 307 2.433 4.825 3.876
69 HG2 PRO 307 3HG PRO 307 0.408 2.712 4.530
70 HG3 PRO 307 2HG PRO 307 0.186 4.270 3.651
71 HD2 PRO 307 3HD PRO 307 0.385 1.883 2.375
72 HD3 PRO 307 2HD PRO 307 1.010 3.391 1.686
73 H TYR 308 HN TYR 308 1.706 0.787 4.418
74 HA TYR 308 HA TYR 308 3.462 -0.056 6.630
75 HB2 TYR 308 3HB TYR 308 0.451 -0.216 6.380
76 HB3 TYR 308 2HB TYR 308 1.369 -1.072 7.621
77 HD1 TYR 308 2HD TYR 308 2.885 0.345 9.162
78 HD2 TYR 308 1HD TYR 308 -0.247 1.983 6.793
79 HE1 TYR 308 2HE TYR 308 2.832 2.330 10.614
80 HE2 TYR 308 1HE TYR 308 -0.307 3.972 8.237
81 HH TYR 308 HH TYR 308 2.086 4.812 10.310
82 H GLY 309 HN GLY 309 1.223 -1.164 4.110
83 HA2 GLY 309 2HA GLY 309 1.273 -3.063 2.811
84 HA3 GLY 309 3HA GLY 309 2.889 -3.372 3.432
85 H LYS 310 HN LYS 310 3.176 -4.768 5.137
86 HA LYS 310 HA LYS 310 1.152 -6.726 5.525
87 HB2 LYS 310 3HB LYS 310 2.749 -7.661 7.223
88 HB3 LYS 310 2HB LYS 310 3.432 -7.434 5.605
89 HG2 LYS 310 3HG LYS 310 4.638 -5.501 6.274
90 HG3 LYS 310 2HG LYS 310 3.778 -5.434 7.823
91 HD2 LYS 310 3HD LYS 310 4.906 -7.296 8.683
92 HD3 LYS 310 2HD LYS 310 5.415 -7.834 7.074
93 HE2 LYS 310 3HE LYS 310 6.767 -5.658 6.954
94 HE3 LYS 310 2HE LYS 310 6.472 -5.535 8.694
95 HZ1 LYS 310 3HZ LYS 310 8.153 -7.420 7.229
96 HZ2 LYS 310 1HZ LYS 310 7.363 -8.003 8.608
97 HZ3 LYS 310 2HZ LYS 310 8.411 -6.680 8.729
98 H LYS 311 HN LYS 311 2.271 -3.964 7.372
99 HA LYS 311 HA LYS 311 0.681 -4.641 9.689
100 HB2 LYS 311 3HB LYS 311 2.314 -2.201 8.962
101 HB3 LYS 311 2HB LYS 311 1.427 -2.370 10.486
102 HG2 LYS 311 3HG LYS 311 2.824 -4.050 11.278
103 HG3 LYS 311 2HG LYS 311 3.425 -4.435 9.656
104 HD2 LYS 311 3HD LYS 311 4.773 -2.500 9.565
105 HD3 LYS 311 2HD LYS 311 3.942 -1.771 10.951
106 HE2 LYS 311 3HE LYS 311 4.840 -3.589 12.397
107 HE3 LYS 311 2HE LYS 311 5.751 -4.185 11.002
108 HZ1 LYS 311 3HZ LYS 311 6.413 -1.554 11.104
109 HZ2 LYS 311 1HZ LYS 311 7.352 -2.829 11.702
110 HZ3 LYS 311 2HZ LYS 311 6.323 -1.977 12.739
111 H CYS 312 HN CYS 312 0.259 -2.926 6.750
112 HA CYS 312 HA CYS 312 -1.593 -0.979 7.373
113 HB2 CYS 312 3HB CYS 312 -0.520 -1.739 5.089
114 HB3 CYS 312 2HB CYS 312 -2.013 -2.665 4.935
115 H THR 313 HN THR 313 -3.906 -0.929 7.244
116 HA THR 313 HA THR 313 -5.121 -3.424 8.212
117 HB THR 313 HB THR 313 -6.988 -1.888 8.988
118 HG1 THR 313 1HG THR 313 -6.751 0.038 8.076
119 HG21 THR 313 3HG2 THR 313 -5.452 -2.748 10.604
120 HG22 THR 313 1HG2 THR 313 -5.655 -1.029 10.937
121 HG23 THR 313 2HG2 THR 313 -4.204 -1.603 10.114
122 H TYR 314 HN TYR 314 -5.426 -0.877 5.816
123 HA TYR 314 HA TYR 314 -7.949 -1.487 4.797
124 HB2 TYR 314 3HB TYR 314 -5.599 -0.549 3.141
125 HB3 TYR 314 2HB TYR 314 -7.314 -0.258 2.841
126 HD1 TYR 314 1HD TYR 314 -8.374 0.671 5.350
127 HD2 TYR 314 2HD TYR 314 -4.596 1.501 3.576
128 HE1 TYR 314 1HE TYR 314 -8.260 2.788 6.596
129 HE2 TYR 314 2HE TYR 314 -4.473 3.620 4.818
130 HH TYR 314 HH TYR 314 -6.610 4.382 7.374
131 H GLY 315 HN GLY 315 -4.778 -2.542 3.534
132 HA2 GLY 315 2HA GLY 315 -4.170 -4.531 2.540
133 HA3 GLY 315 3HA GLY 315 -5.732 -5.187 3.007
134 H ILE 316 HN ILE 316 -7.602 -4.553 1.666
135 HA ILE 316 HA ILE 316 -6.811 -4.518 -1.152
136 HB ILE 316 HB ILE 316 -9.527 -5.105 0.030
137 HG12 ILE 316 1HG1 ILE 316 -7.449 -7.045 -1.012
138 HG13 ILE 316 2HG1 ILE 316 -7.741 -6.726 0.706
139 HG21 ILE 316 1HG2 ILE 316 -8.563 -4.730 -2.667
140 HG22 ILE 316 2HG2 ILE 316 -9.268 -6.331 -2.449
141 HG23 ILE 316 3HG2 ILE 316 -10.216 -4.892 -2.074
142 HD11 ILE 316 3HD1 ILE 316 -9.120 -8.474 0.587
143 HD12 ILE 316 1HD1 ILE 316 -10.245 -7.333 -0.150
144 HD13 ILE 316 2HD1 ILE 316 -9.252 -8.377 -1.169
145 H LYS 317 HN LYS 317 -8.450 -2.628 1.247
146 HA LYS 317 HA LYS 317 -9.470 -0.771 -0.774
147 HB2 LYS 317 3HB LYS 317 -10.699 0.282 1.046
148 HB3 LYS 317 2HB LYS 317 -11.006 -1.462 1.018
149 HG2 LYS 317 3HG LYS 317 -9.218 -1.682 2.800
150 HG3 LYS 317 2HG LYS 317 -9.294 0.084 2.941
151 HD2 LYS 317 3HD LYS 317 -10.806 -0.513 4.563
152 HD3 LYS 317 2HD LYS 317 -11.880 -0.368 3.159
153 HE2 LYS 317 3HE LYS 317 -10.599 -2.983 3.958
154 HE3 LYS 317 2HE LYS 317 -12.159 -2.443 4.597
155 HZ1 LYS 317 3HZ LYS 317 -12.906 -3.579 2.813
156 HZ2 LYS 317 1HZ LYS 317 -11.477 -3.386 1.929
157 HZ3 LYS 317 2HZ LYS 317 -12.598 -2.122 2.011
158 H CYS 318 HN CYS 318 -6.591 -1.117 -0.023
159 HA CYS 318 HA CYS 318 -5.881 1.313 1.358
160 HB2 CYS 318 3HB CYS 318 -4.573 -0.845 1.475
161 HB3 CYS 318 2HB CYS 318 -4.058 -0.538 -0.185
162 H ARG 319 HN ARG 319 -4.698 3.057 0.455
163 HA ARG 319 HA ARG 319 -5.404 3.573 -2.334
164 HB2 ARG 319 3HB ARG 319 -4.658 5.298 0.006
165 HB3 ARG 319 2HB ARG 319 -4.507 5.928 -1.642
166 HG2 ARG 319 3HG ARG 319 -6.947 5.218 -1.957
167 HG3 ARG 319 2HG ARG 319 -6.986 5.078 -0.191
168 HD2 ARG 319 3HD ARG 319 -6.221 7.431 -0.010
169 HD3 ARG 319 2HD ARG 319 -6.293 7.549 -1.775
170 HE ARG 319 HE ARG 319 -8.509 7.610 0.057
171 HH11 ARG 319 2HH1 ARG 319 -7.508 6.961 -3.214
172 HH12 ARG 319 1HH1 ARG 319 -9.078 7.246 -3.889
173 HH21 ARG 319 2HH2 ARG 319 -10.581 7.987 -0.820
174 HH22 ARG 319 1HH2 ARG 319 -10.825 7.829 -2.527
175 H PHE 320 HN PHE 320 -3.184 1.797 -1.542
176 HA PHE 320 HA PHE 320 -1.128 3.059 -3.178
177 HB2 PHE 320 3HB PHE 320 -0.861 2.418 -0.301
178 HB3 PHE 320 2HB PHE 320 0.472 1.881 -1.325
179 HD1 PHE 320 2HD PHE 320 -1.469 4.866 -0.328
180 HD2 PHE 320 1HD PHE 320 2.084 3.377 -2.138
181 HE1 PHE 320 2HE PHE 320 -0.514 7.133 -0.309
182 HE2 PHE 320 1HE PHE 320 3.044 5.643 -2.123
183 HZ PHE 320 HZ PHE 320 1.745 7.524 -1.209
184 H PHE 321 HN PHE 321 0.741 1.362 -3.478
185 HA PHE 321 HA PHE 321 -0.570 -1.081 -4.378
186 HB2 PHE 321 3HB PHE 321 1.008 0.384 -5.804
187 HB3 PHE 321 2HB PHE 321 2.310 -0.358 -4.870
188 HD1 PHE 321 2HD PHE 321 -0.307 -0.968 -7.355
189 HD2 PHE 321 1HD PHE 321 2.909 -2.670 -5.145
190 HE1 PHE 321 2HE PHE 321 -0.311 -2.917 -8.856
191 HE2 PHE 321 1HE PHE 321 2.910 -4.621 -6.644
192 HZ PHE 321 HZ PHE 321 1.298 -4.747 -8.502
193 H HIS 322 HN HIS 322 -0.442 -2.929 -3.300
194 HA HIS 322 HA HIS 322 1.392 -3.139 -1.045
195 HB2 HIS 322 3HB HIS 322 -1.087 -4.574 -1.912
196 HB3 HIS 322 2HB HIS 322 0.033 -5.396 -0.823
197 HD1 HIS 322 1HD HIS 322 0.111 -4.650 1.604
198 HD2 HIS 322 2HD HIS 322 -2.335 -2.271 -0.766
199 HE1 HIS 322 1HE HIS 322 -1.160 -3.187 3.205
200 HE2 HIS 322 2HE HIS 322 -2.656 -1.732 1.758
201 HA PRO 323 HA PRO 323 4.261 -5.860 -2.947
202 HB2 PRO 323 3HB PRO 323 4.935 -7.498 -0.859
203 HB3 PRO 323 2HB PRO 323 5.440 -5.813 -0.976
204 HG2 PRO 323 3HG PRO 323 3.141 -7.008 0.534
205 HG3 PRO 323 2HG PRO 323 4.346 -5.781 1.076
206 HD2 PRO 323 3HD PRO 323 1.832 -5.119 0.292
207 HD3 PRO 323 2HD PRO 323 3.232 -4.071 0.005
208 H GLU 324 HN GLU 324 1.634 -7.369 -1.130
209 HA GLU 324 HA GLU 324 1.863 -9.758 -2.830
210 HB2 GLU 324 3HB GLU 324 0.349 -9.393 -0.233
211 HB3 GLU 324 2HB GLU 324 0.508 -10.902 -1.144
212 HG2 GLU 324 3HG GLU 324 2.800 -11.101 -0.651
213 HG3 GLU 324 2HG GLU 324 2.894 -9.428 -0.084
214 HE2 GLU 324 HE GLU 324 1.659 -10.265 3.053
215 H ARG 325 HN ARG 325 -0.185 -7.093 -1.971
216 HA ARG 325 HA ARG 325 -2.283 -8.138 -3.757
217 HB2 ARG 325 3HB ARG 325 -2.393 -6.461 -1.276
218 HB3 ARG 325 2HB ARG 325 -3.661 -6.289 -2.500
219 HG2 ARG 325 3HG ARG 325 -3.009 -9.050 -1.646
220 HG3 ARG 325 2HG ARG 325 -3.827 -8.009 -0.469
221 HD2 ARG 325 3HD ARG 325 -5.660 -8.879 -1.524
222 HD3 ARG 325 2HD ARG 325 -5.368 -7.463 -2.545
223 HE ARG 325 HE ARG 325 -4.952 -8.882 -4.274
224 HH11 ARG 325 2HH1 ARG 325 -4.415 -10.598 -1.292
225 HH12 ARG 325 1HH1 ARG 325 -4.097 -12.113 -2.069
226 HH21 ARG 325 2HH2 ARG 325 -4.535 -10.871 -5.309
227 HH22 ARG 325 1HH2 ARG 325 -4.164 -12.267 -4.355
228 HA PRO 326 HA PRO 326 -1.708 -4.797 -6.540
229 HB2 PRO 326 3HB PRO 326 -4.276 -4.234 -7.308
230 HB3 PRO 326 2HB PRO 326 -3.409 -5.687 -7.802
231 HG2 PRO 326 3HG PRO 326 -5.381 -5.314 -5.573
232 HG3 PRO 326 2HG PRO 326 -5.279 -6.635 -6.797
233 HD2 PRO 326 3HD PRO 326 -4.385 -6.924 -4.250
234 HD3 PRO 326 2HD PRO 326 -3.610 -7.717 -5.632
235 H SER 327 HN SER 327 -3.044 -2.584 -7.122
236 HA SER 327 HA SER 327 -2.369 -0.752 -5.170
237 HB2 SER 327 1HB SER 327 -3.409 0.894 -6.486
238 HB3 SER 327 2HB SER 327 -2.991 -0.374 -7.652
239 HG SER 327 HG SER 327 -5.245 0.563 -7.627
Start of MODEL 3
1 H1 SER 299 HN SER 299 5.959 12.325 -1.148
2 HA SER 299 HA SER 299 7.053 12.760 -3.632
3 HB2 SER 299 1HB SER 299 8.191 11.888 -1.000
4 HB3 SER 299 2HB SER 299 9.237 11.867 -2.431
5 HG SER 299 HG SER 299 9.343 13.876 -1.357
6 H GLU 300 HN GLU 300 6.270 9.743 -2.117
7 HA GLU 300 HA GLU 300 7.237 8.336 -4.510
8 HB2 GLU 300 3HB GLU 300 7.690 6.370 -2.903
9 HB3 GLU 300 2HB GLU 300 8.865 7.693 -2.967
10 HG2 GLU 300 3HG GLU 300 8.468 7.001 -0.674
11 HG3 GLU 300 2HG GLU 300 7.917 8.661 -0.948
12 HE2 GLU 300 HE GLU 300 5.190 5.885 -0.176
13 H HIS 301 HN HIS 301 4.657 9.222 -4.253
14 HA HIS 301 HA HIS 301 2.793 7.597 -3.028
15 HB2 HIS 301 3HB HIS 301 2.491 9.769 -4.418
16 HB3 HIS 301 2HB HIS 301 2.321 8.675 -5.794
17 HD1 HIS 301 1HD HIS 301 0.082 7.622 -6.161
18 HD2 HIS 301 2HD HIS 301 0.427 9.342 -2.395
19 HE1 HIS 301 1HE HIS 301 -2.219 7.502 -5.153
20 HE2 HIS 301 2HE HIS 301 -2.009 8.552 -2.852
21 H ARG 302 HN ARG 302 4.388 7.154 -6.156
22 HA ARG 302 HA ARG 302 3.261 4.433 -6.261
23 HB2 ARG 302 3HB ARG 302 3.757 4.589 -8.746
24 HB3 ARG 302 2HB ARG 302 2.433 5.599 -8.144
25 HG2 ARG 302 3HG ARG 302 3.638 7.571 -8.375
26 HG3 ARG 302 2HG ARG 302 5.192 6.721 -8.396
27 HD2 ARG 302 3HD ARG 302 5.145 6.522 -10.619
28 HD3 ARG 302 2HD ARG 302 3.524 5.817 -10.561
29 HE ARG 302 HE ARG 302 4.193 8.503 -11.238
30 HH11 ARG 302 2HH1 ARG 302 1.742 6.514 -9.770
31 HH12 ARG 302 1HH1 ARG 302 0.450 7.609 -10.135
32 HH21 ARG 302 2HH2 ARG 302 2.501 9.953 -11.723
33 HH22 ARG 302 1HH2 ARG 302 0.882 9.564 -11.247
34 H LYS 303 HN LYS 303 6.121 6.385 -6.321
35 HA LYS 303 HA LYS 303 7.987 4.645 -7.413
36 HB2 LYS 303 3HB LYS 303 8.177 6.760 -5.278
37 HB3 LYS 303 2HB LYS 303 9.596 5.819 -5.766
38 HG2 LYS 303 3HG LYS 303 9.940 7.244 -7.425
39 HG3 LYS 303 2HG LYS 303 8.401 6.731 -8.140
40 HD2 LYS 303 3HD LYS 303 7.194 8.445 -6.982
41 HD3 LYS 303 2HD LYS 303 8.622 8.860 -6.017
42 HE2 LYS 303 3HE LYS 303 8.820 9.010 -8.996
43 HE3 LYS 303 2HE LYS 303 7.935 10.277 -8.135
44 HZ1 LYS 303 3HZ LYS 303 9.897 10.700 -6.793
45 HZ2 LYS 303 1HZ LYS 303 10.259 10.864 -8.439
46 HZ3 LYS 303 2HZ LYS 303 10.746 9.478 -7.600
47 H GLN 304 HN GLN 304 6.758 4.832 -4.099
48 HA GLN 304 HA GLN 304 8.116 2.281 -3.531
49 HB2 GLN 304 3HB GLN 304 7.562 4.688 -1.846
50 HB3 GLN 304 2HB GLN 304 7.615 3.097 -1.069
51 HG2 GLN 304 3HG GLN 304 9.841 4.160 -2.798
52 HG3 GLN 304 2HG GLN 304 9.762 4.396 -1.048
53 HE21 GLN 304 1HE2 GLN 304 10.037 2.638 0.327
54 HE22 GLN 304 2HE2 GLN 304 10.724 1.147 -0.214
55 HA PRO 305 HA PRO 305 4.273 0.284 -2.842
56 HB2 PRO 305 3HB PRO 305 4.825 -1.337 -0.705
57 HB3 PRO 305 2HB PRO 305 5.460 -1.614 -2.326
58 HG2 PRO 305 3HG PRO 305 6.761 -0.274 0.021
59 HG3 PRO 305 2HG PRO 305 7.442 -1.497 -1.115
60 HD2 PRO 305 3HD PRO 305 7.993 1.154 -1.313
61 HD3 PRO 305 2HD PRO 305 7.867 0.094 -2.727
62 H CYS 306 HN CYS 306 2.901 -0.514 -0.735
63 HA CYS 306 HA CYS 306 1.658 1.732 0.281
64 HB2 CYS 306 3HB CYS 306 1.532 -1.127 0.703
65 HB3 CYS 306 2HB CYS 306 1.302 -0.268 2.227
66 HA PRO 307 HA PRO 307 4.052 3.283 3.614
67 HB2 PRO 307 3HB PRO 307 2.136 3.964 5.446
68 HB3 PRO 307 2HB PRO 307 2.403 4.848 3.944
69 HG2 PRO 307 3HG PRO 307 0.381 2.722 4.564
70 HG3 PRO 307 2HG PRO 307 0.158 4.292 3.707
71 HD2 PRO 307 3HD PRO 307 0.363 1.924 2.397
72 HD3 PRO 307 2HD PRO 307 0.986 3.443 1.731
73 H TYR 308 HN TYR 308 1.689 0.797 4.420
74 HA TYR 308 HA TYR 308 3.441 -0.070 6.626
75 HB2 TYR 308 3HB TYR 308 0.431 -0.224 6.362
76 HB3 TYR 308 2HB TYR 308 1.339 -1.122 7.580
77 HD1 TYR 308 2HD TYR 308 3.170 0.512 8.829
78 HD2 TYR 308 1HD TYR 308 -0.569 1.693 7.178
79 HE1 TYR 308 2HE TYR 308 3.124 2.453 10.339
80 HE2 TYR 308 1HE TYR 308 -0.625 3.639 8.682
81 HH TYR 308 HH TYR 308 1.448 3.972 11.334
82 H GLY 309 HN GLY 309 1.218 -1.152 4.082
83 HA2 GLY 309 2HA GLY 309 1.282 -3.032 2.755
84 HA3 GLY 309 3HA GLY 309 2.897 -3.340 3.375
85 H LYS 310 HN LYS 310 3.175 -4.683 5.157
86 HA LYS 310 HA LYS 310 1.184 -6.700 5.472
87 HB2 LYS 310 3HB LYS 310 2.762 -7.614 7.197
88 HB3 LYS 310 2HB LYS 310 3.479 -7.359 5.598
89 HG2 LYS 310 3HG LYS 310 4.623 -5.400 6.314
90 HG3 LYS 310 2HG LYS 310 3.730 -5.378 7.845
91 HD2 LYS 310 3HD LYS 310 4.885 -7.224 8.701
92 HD3 LYS 310 2HD LYS 310 5.442 -7.725 7.094
93 HE2 LYS 310 3HE LYS 310 6.972 -5.880 6.960
94 HE3 LYS 310 2HE LYS 310 6.302 -5.167 8.436
95 HZ1 LYS 310 3HZ LYS 310 7.023 -7.482 9.417
96 HZ2 LYS 310 1HZ LYS 310 8.118 -6.198 9.290
97 HZ3 LYS 310 2HZ LYS 310 8.125 -7.434 8.135
98 H LYS 311 HN LYS 311 2.214 -3.925 7.352
99 HA LYS 311 HA LYS 311 0.588 -4.639 9.632
100 HB2 LYS 311 3HB LYS 311 2.284 -2.249 8.925
101 HB3 LYS 311 2HB LYS 311 1.247 -2.264 10.361
102 HG2 LYS 311 3HG LYS 311 2.462 -4.018 11.364
103 HG3 LYS 311 2HG LYS 311 3.305 -4.391 9.850
104 HD2 LYS 311 3HD LYS 311 4.383 -2.142 9.952
105 HD3 LYS 311 2HD LYS 311 3.634 -1.913 11.542
106 HE2 LYS 311 3HE LYS 311 4.951 -3.537 12.556
107 HE3 LYS 311 2HE LYS 311 5.285 -4.350 11.020
108 HZ1 LYS 311 3HZ LYS 311 6.438 -2.035 10.530
109 HZ2 LYS 311 1HZ LYS 311 7.253 -3.300 11.303
110 HZ3 LYS 311 2HZ LYS 311 6.597 -2.034 12.214
111 H CYS 312 HN CYS 312 0.211 -2.890 6.698
112 HA CYS 312 HA CYS 312 -1.707 -1.000 7.298
113 HB2 CYS 312 3HB CYS 312 -0.548 -1.681 5.038
114 HB3 CYS 312 2HB CYS 312 -2.003 -2.656 4.820
115 H THR 313 HN THR 313 -3.867 -0.990 7.673
116 HA THR 313 HA THR 313 -5.092 -3.551 8.322
117 HB THR 313 HB THR 313 -7.005 -1.923 9.077
118 HG1 THR 313 1HG THR 313 -6.329 0.149 9.461
119 HG21 THR 313 3HG2 THR 313 -5.211 -1.358 11.090
120 HG22 THR 313 1HG2 THR 313 -4.520 -2.794 10.335
121 HG23 THR 313 2HG2 THR 313 -6.172 -2.830 10.951
122 H TYR 314 HN TYR 314 -5.335 -0.990 5.978
123 HA TYR 314 HA TYR 314 -7.912 -1.480 4.995
124 HB2 TYR 314 3HB TYR 314 -5.563 -0.590 3.314
125 HB3 TYR 314 2HB TYR 314 -7.272 -0.218 3.070
126 HD1 TYR 314 1HD TYR 314 -8.169 0.635 5.708
127 HD2 TYR 314 2HD TYR 314 -4.514 1.459 3.694
128 HE1 TYR 314 1HE TYR 314 -7.932 2.713 7.003
129 HE2 TYR 314 2HE TYR 314 -4.265 3.539 4.983
130 HH TYR 314 HH TYR 314 -5.017 4.637 6.869
131 H GLY 315 HN GLY 315 -4.788 -2.602 3.673
132 HA2 GLY 315 2HA GLY 315 -4.250 -4.584 2.625
133 HA3 GLY 315 3HA GLY 315 -5.818 -5.210 3.111
134 H ILE 316 HN ILE 316 -7.694 -4.542 1.814
135 HA ILE 316 HA ILE 316 -6.955 -4.444 -1.016
136 HB ILE 316 HB ILE 316 -9.676 -5.007 0.159
137 HG12 ILE 316 1HG1 ILE 316 -8.070 -6.663 0.962
138 HG13 ILE 316 2HG1 ILE 316 -9.173 -7.385 -0.221
139 HG21 ILE 316 1HG2 ILE 316 -10.269 -4.729 -1.979
140 HG22 ILE 316 2HG2 ILE 316 -8.600 -4.783 -2.543
141 HG23 ILE 316 3HG2 ILE 316 -9.484 -6.283 -2.260
142 HD11 ILE 316 3HD1 ILE 316 -6.331 -7.297 -0.263
143 HD12 ILE 316 1HD1 ILE 316 -7.436 -8.106 -1.374
144 HD13 ILE 316 2HD1 ILE 316 -6.955 -6.434 -1.668
145 H LYS 317 HN LYS 317 -8.456 -2.569 1.461
146 HA LYS 317 HA LYS 317 -9.542 -0.673 -0.491
147 HB2 LYS 317 3HB LYS 317 -10.673 0.374 1.408
148 HB3 LYS 317 2HB LYS 317 -11.033 -1.359 1.329
149 HG2 LYS 317 3HG LYS 317 -9.168 -1.676 3.035
150 HG3 LYS 317 2HG LYS 317 -9.241 0.081 3.256
151 HD2 LYS 317 3HD LYS 317 -11.847 -0.443 3.491
152 HD3 LYS 317 2HD LYS 317 -11.207 -2.013 4.008
153 HE2 LYS 317 3HE LYS 317 -11.456 -0.705 5.981
154 HE3 LYS 317 2HE LYS 317 -9.726 -0.768 5.617
155 HZ1 LYS 317 3HZ LYS 317 -11.592 1.491 5.221
156 HZ2 LYS 317 1HZ LYS 317 -10.095 1.430 4.437
157 HZ3 LYS 317 2HZ LYS 317 -10.164 1.453 6.126
158 H CYS 318 HN CYS 318 -6.667 -1.003 -0.021
159 HA CYS 318 HA CYS 318 -5.877 1.397 1.413
160 HB2 CYS 318 3HB CYS 318 -4.554 -0.682 1.614
161 HB3 CYS 318 2HB CYS 318 -4.192 -0.602 -0.111
162 H ARG 319 HN ARG 319 -4.786 3.153 0.478
163 HA ARG 319 HA ARG 319 -5.491 3.607 -2.322
164 HB2 ARG 319 3HB ARG 319 -4.786 5.392 -0.012
165 HB3 ARG 319 2HB ARG 319 -4.669 5.994 -1.672
166 HG2 ARG 319 3HG ARG 319 -7.186 4.735 -0.608
167 HG3 ARG 319 2HG ARG 319 -6.828 6.461 -0.423
168 HD2 ARG 319 3HD ARG 319 -6.719 6.767 -2.813
169 HD3 ARG 319 2HD ARG 319 -6.871 5.023 -3.071
170 HE ARG 319 HE ARG 319 -9.132 5.224 -2.837
171 HH11 ARG 319 2HH1 ARG 319 -7.606 8.050 -1.493
172 HH12 ARG 319 1HH1 ARG 319 -9.098 8.887 -1.219
173 HH21 ARG 319 2HH2 ARG 319 -11.104 6.315 -2.480
174 HH22 ARG 319 1HH2 ARG 319 -11.088 7.898 -1.780
175 H PHE 320 HN PHE 320 -3.242 1.891 -1.526
176 HA PHE 320 HA PHE 320 -1.194 3.209 -3.134
177 HB2 PHE 320 3HB PHE 320 -0.938 2.495 -0.270
178 HB3 PHE 320 2HB PHE 320 0.413 2.022 -1.301
179 HD1 PHE 320 2HD PHE 320 -1.643 4.947 -0.320
180 HD2 PHE 320 1HD PHE 320 2.031 3.563 -1.964
181 HE1 PHE 320 2HE PHE 320 -0.745 7.235 -0.228
182 HE2 PHE 320 1HE PHE 320 2.937 5.850 -1.873
183 HZ PHE 320 HZ PHE 320 1.548 7.689 -1.005
184 H PHE 321 HN PHE 321 0.678 1.563 -3.508
185 HA PHE 321 HA PHE 321 -0.591 -0.890 -4.437
186 HB2 PHE 321 3HB PHE 321 1.047 0.710 -5.756
187 HB3 PHE 321 2HB PHE 321 2.286 -0.254 -4.950
188 HD1 PHE 321 1HD PHE 321 -0.455 -0.343 -7.381
189 HD2 PHE 321 2HD PHE 321 2.675 -2.548 -5.522
190 HE1 PHE 321 1HE PHE 321 -0.683 -2.100 -9.089
191 HE2 PHE 321 2HE PHE 321 2.453 -4.308 -7.227
192 HZ PHE 321 HZ PHE 321 0.772 -4.085 -9.014
193 H HIS 322 HN HIS 322 -0.428 -2.749 -3.383
194 HA HIS 322 HA HIS 322 1.421 -2.969 -1.145
195 HB2 HIS 322 3HB HIS 322 -1.018 -4.449 -2.049
196 HB3 HIS 322 2HB HIS 322 0.125 -5.270 -0.981
197 HD1 HIS 322 1HD HIS 322 0.159 -4.606 1.465
198 HD2 HIS 322 2HD HIS 322 -2.302 -2.186 -0.847
199 HE1 HIS 322 1HE HIS 322 -1.144 -3.213 3.104
200 HE2 HIS 322 2HE HIS 322 -2.649 -1.733 1.691
201 HA PRO 323 HA PRO 323 4.365 -5.563 -3.107
202 HB2 PRO 323 3HB PRO 323 5.079 -7.236 -1.058
203 HB3 PRO 323 2HB PRO 323 5.539 -5.536 -1.132
204 HG2 PRO 323 3HG PRO 323 3.270 -6.829 0.343
205 HG3 PRO 323 2HG PRO 323 4.441 -5.585 0.916
206 HD2 PRO 323 3HD PRO 323 1.912 -4.971 0.144
207 HD3 PRO 323 2HD PRO 323 3.283 -3.879 -0.114
208 H GLU 324 HN GLU 324 1.773 -7.186 -1.339
209 HA GLU 324 HA GLU 324 2.072 -9.526 -3.095
210 HB2 GLU 324 3HB GLU 324 0.504 -9.285 -0.516
211 HB3 GLU 324 2HB GLU 324 0.782 -10.766 -1.446
212 HG2 GLU 324 3HG GLU 324 3.084 -10.805 -0.908
213 HG3 GLU 324 2HG GLU 324 3.026 -9.157 -0.268
214 HE2 GLU 324 HE GLU 324 2.622 -10.564 2.828
215 H ARG 325 HN ARG 325 -0.049 -6.938 -2.179
216 HA ARG 325 HA ARG 325 -2.110 -7.994 -4.002
217 HB2 ARG 325 3HB ARG 325 -2.281 -6.381 -1.480
218 HB3 ARG 325 2HB ARG 325 -3.550 -6.226 -2.704
219 HG2 ARG 325 3HG ARG 325 -2.783 -8.971 -1.858
220 HG3 ARG 325 2HG ARG 325 -3.711 -7.973 -0.725
221 HD2 ARG 325 3HD ARG 325 -5.408 -9.024 -1.890
222 HD3 ARG 325 2HD ARG 325 -5.227 -7.514 -2.795
223 HE ARG 325 HE ARG 325 -3.579 -9.575 -3.865
224 HH11 ARG 325 2HH1 ARG 325 -6.854 -8.397 -3.753
225 HH12 ARG 325 1HH1 ARG 325 -7.293 -9.089 -5.279
226 HH21 ARG 325 2HH2 ARG 325 -4.146 -10.491 -5.876
227 HH22 ARG 325 1HH2 ARG 325 -5.753 -10.280 -6.486
228 HA PRO 326 HA PRO 326 -1.612 -4.562 -6.690
229 HB2 PRO 326 3HB PRO 326 -4.189 -4.054 -7.462
230 HB3 PRO 326 2HB PRO 326 -3.276 -5.467 -7.989
231 HG2 PRO 326 3HG PRO 326 -5.275 -5.215 -5.768
232 HG3 PRO 326 2HG PRO 326 -5.124 -6.499 -7.026
233 HD2 PRO 326 3HD PRO 326 -4.242 -6.830 -4.480
234 HD3 PRO 326 2HD PRO 326 -3.431 -7.562 -5.877
235 H SER 327 HN SER 327 -3.001 -2.372 -7.221
236 HA SER 327 HA SER 327 -2.409 -0.588 -5.190
237 HB2 SER 327 1HB SER 327 -3.861 1.031 -6.413
238 HB3 SER 327 2HB SER 327 -2.736 0.164 -7.473
239 HG SER 327 HG SER 327 -5.518 -0.172 -7.196
Start of MODEL 4
1 H1 SER 299 HN SER 299 7.279 13.042 -1.631
2 HA SER 299 HA SER 299 8.068 11.099 -0.479
3 HB2 SER 299 1HB SER 299 6.329 10.626 1.096
4 HB3 SER 299 2HB SER 299 6.138 12.319 0.611
5 HG SER 299 HG SER 299 4.592 11.437 -0.998
6 H GLU 300 HN GLU 300 7.791 10.295 -3.169
7 HA GLU 300 HA GLU 300 7.512 8.452 -4.476
8 HB2 GLU 300 3HB GLU 300 7.730 7.202 -1.737
9 HB3 GLU 300 2HB GLU 300 7.634 6.239 -3.219
10 HG2 GLU 300 3HG GLU 300 9.914 6.361 -2.778
11 HG3 GLU 300 2HG GLU 300 9.644 7.591 -4.022
12 HE2 GLU 300 HE GLU 300 10.690 8.782 -0.392
13 H HIS 301 HN HIS 301 5.255 9.546 -4.621
14 HA HIS 301 HA HIS 301 3.021 8.390 -3.374
15 HB2 HIS 301 3HB HIS 301 3.283 10.563 -4.832
16 HB3 HIS 301 2HB HIS 301 2.843 9.482 -6.158
17 HD1 HIS 301 1HD HIS 301 0.860 7.853 -4.065
18 HD2 HIS 301 2HD HIS 301 0.757 11.847 -5.204
19 HE1 HIS 301 1HE HIS 301 -1.505 8.607 -3.660
20 HE2 HIS 301 2HE HIS 301 -1.569 11.049 -4.355
21 H ARG 302 HN ARG 302 4.637 7.643 -6.436
22 HA ARG 302 HA ARG 302 3.241 5.056 -6.445
23 HB2 ARG 302 3HB ARG 302 3.145 5.192 -8.940
24 HB3 ARG 302 2HB ARG 302 2.111 6.363 -8.107
25 HG2 ARG 302 3HG ARG 302 3.015 7.936 -9.385
26 HG3 ARG 302 2HG ARG 302 4.508 7.708 -8.460
27 HD2 ARG 302 3HD ARG 302 5.300 7.386 -10.594
28 HD3 ARG 302 2HD ARG 302 4.882 5.728 -10.141
29 HE ARG 302 HE ARG 302 3.313 5.733 -11.793
30 HH11 ARG 302 2HH1 ARG 302 4.039 9.031 -10.946
31 HH12 ARG 302 1HH1 ARG 302 3.051 9.707 -12.199
32 HH21 ARG 302 2HH2 ARG 302 2.009 6.611 -13.445
33 HH22 ARG 302 1HH2 ARG 302 1.896 8.329 -13.619
34 H LYS 303 HN LYS 303 5.936 5.930 -5.589
35 HA LYS 303 HA LYS 303 7.584 4.429 -7.512
36 HB2 LYS 303 3HB LYS 303 8.607 6.217 -5.304
37 HB3 LYS 303 2HB LYS 303 9.490 5.607 -6.712
38 HG2 LYS 303 3HG LYS 303 7.649 6.954 -8.039
39 HG3 LYS 303 2HG LYS 303 7.557 7.854 -6.515
40 HD2 LYS 303 3HD LYS 303 10.136 7.983 -6.681
41 HD3 LYS 303 2HD LYS 303 9.886 7.544 -8.380
42 HE2 LYS 303 3HE LYS 303 8.434 9.851 -7.082
43 HE3 LYS 303 2HE LYS 303 10.023 10.027 -7.843
44 HZ1 LYS 303 3HZ LYS 303 8.985 9.045 -9.889
45 HZ2 LYS 303 1HZ LYS 303 8.432 10.587 -9.466
46 HZ3 LYS 303 2HZ LYS 303 7.482 9.227 -9.137
47 H GLN 304 HN GLN 304 6.625 4.686 -4.149
48 HA GLN 304 HA GLN 304 8.036 2.158 -3.603
49 HB2 GLN 304 3HB GLN 304 7.589 4.604 -1.955
50 HB3 GLN 304 2HB GLN 304 7.623 3.038 -1.130
51 HG2 GLN 304 3HG GLN 304 9.813 4.224 -2.834
52 HG3 GLN 304 2HG GLN 304 9.810 4.042 -1.074
53 HE21 GLN 304 1HE2 GLN 304 10.196 2.051 -0.164
54 HE22 GLN 304 2HE2 GLN 304 10.778 0.702 -1.071
55 HA PRO 305 HA PRO 305 4.249 0.152 -2.674
56 HB2 PRO 305 3HB PRO 305 4.913 -1.406 -0.522
57 HB3 PRO 305 2HB PRO 305 5.473 -1.723 -2.164
58 HG2 PRO 305 3HG PRO 305 6.870 -0.311 0.084
59 HG3 PRO 305 2HG PRO 305 7.508 -1.560 -1.049
60 HD2 PRO 305 3HD PRO 305 8.028 1.089 -1.342
61 HD3 PRO 305 2HD PRO 305 7.845 -0.010 -2.721
62 H CYS 306 HN CYS 306 2.886 -0.536 -0.588
63 HA CYS 306 HA CYS 306 1.763 1.750 0.472
64 HB2 CYS 306 3HB CYS 306 1.514 -1.104 0.865
65 HB3 CYS 306 2HB CYS 306 1.346 -0.252 2.401
66 HA PRO 307 HA PRO 307 4.274 3.156 3.782
67 HB2 PRO 307 3HB PRO 307 2.415 3.913 5.646
68 HB3 PRO 307 2HB PRO 307 2.705 4.795 4.147
69 HG2 PRO 307 3HG PRO 307 0.593 2.760 4.778
70 HG3 PRO 307 2HG PRO 307 0.433 4.347 3.938
71 HD2 PRO 307 3HD PRO 307 0.508 1.983 2.605
72 HD3 PRO 307 2HD PRO 307 1.193 3.478 1.943
73 H TYR 308 HN TYR 308 1.804 0.780 4.602
74 HA TYR 308 HA TYR 308 3.544 -0.191 6.775
75 HB2 TYR 308 3HB TYR 308 0.532 -0.122 6.559
76 HB3 TYR 308 2HB TYR 308 1.368 -1.175 7.705
77 HD1 TYR 308 1HD TYR 308 3.447 0.315 8.889
78 HD2 TYR 308 2HD TYR 308 -0.374 1.710 7.643
79 HE1 TYR 308 1HE TYR 308 3.596 2.154 10.515
80 HE2 TYR 308 2HE TYR 308 -0.236 3.555 9.265
81 HH TYR 308 HH TYR 308 2.641 4.003 11.297
82 H GLY 309 HN GLY 309 1.230 -1.140 4.258
83 HA2 GLY 309 2HA GLY 309 1.158 -3.016 2.931
84 HA3 GLY 309 3HA GLY 309 2.785 -3.386 3.482
85 H LYS 310 HN LYS 310 3.090 -4.954 4.975
86 HA LYS 310 HA LYS 310 1.043 -6.827 5.436
87 HB2 LYS 310 3HB LYS 310 2.669 -7.808 7.105
88 HB3 LYS 310 2HB LYS 310 3.290 -7.603 5.460
89 HG2 LYS 310 3HG LYS 310 4.604 -5.741 6.060
90 HG3 LYS 310 2HG LYS 310 3.769 -5.568 7.614
91 HD2 LYS 310 3HD LYS 310 4.843 -7.407 8.557
92 HD3 LYS 310 2HD LYS 310 5.259 -8.087 6.974
93 HE2 LYS 310 3HE LYS 310 6.661 -5.875 6.724
94 HE3 LYS 310 2HE LYS 310 6.567 -5.874 8.491
95 HZ1 LYS 310 3HZ LYS 310 7.656 -7.951 8.603
96 HZ2 LYS 310 1HZ LYS 310 8.554 -7.012 7.518
97 HZ3 LYS 310 2HZ LYS 310 7.514 -8.213 6.938
98 H LYS 311 HN LYS 311 2.207 -4.108 7.306
99 HA LYS 311 HA LYS 311 0.644 -4.833 9.636
100 HB2 LYS 311 3HB LYS 311 2.389 -2.461 8.963
101 HB3 LYS 311 2HB LYS 311 1.460 -2.573 10.466
102 HG2 LYS 311 3HG LYS 311 2.826 -4.134 11.378
103 HG3 LYS 311 2HG LYS 311 3.202 -4.869 9.808
104 HD2 LYS 311 3HD LYS 311 5.213 -3.856 10.524
105 HD3 LYS 311 2HD LYS 311 4.535 -2.768 9.299
106 HE2 LYS 311 3HE LYS 311 5.265 -1.382 11.086
107 HE3 LYS 311 2HE LYS 311 3.500 -1.458 11.187
108 HZ1 LYS 311 3HZ LYS 311 3.578 -2.832 13.034
109 HZ2 LYS 311 1HZ LYS 311 4.855 -1.761 13.320
110 HZ3 LYS 311 2HZ LYS 311 5.172 -3.321 12.749
111 H CYS 312 HN CYS 312 0.241 -3.023 6.757
112 HA CYS 312 HA CYS 312 -1.531 -1.030 7.455
113 HB2 CYS 312 3HB CYS 312 -0.523 -1.737 5.141
114 HB3 CYS 312 2HB CYS 312 -2.020 -2.657 4.984
115 H THR 313 HN THR 313 -3.850 -0.899 7.337
116 HA THR 313 HA THR 313 -5.132 -3.361 8.301
117 HB THR 313 HB THR 313 -6.959 -1.754 9.065
118 HG1 THR 313 1HG THR 313 -6.689 0.278 8.571
119 HG21 THR 313 3HG2 THR 313 -5.998 -1.982 11.062
120 HG22 THR 313 1HG2 THR 313 -4.749 -0.811 10.644
121 HG23 THR 313 2HG2 THR 313 -4.528 -2.515 10.247
122 H TYR 314 HN TYR 314 -5.333 -0.847 5.875
123 HA TYR 314 HA TYR 314 -7.887 -1.324 4.873
124 HB2 TYR 314 3HB TYR 314 -5.477 -0.587 3.198
125 HB3 TYR 314 2HB TYR 314 -7.170 -0.209 2.870
126 HD1 TYR 314 1HD TYR 314 -8.268 0.950 5.191
127 HD2 TYR 314 2HD TYR 314 -4.294 1.331 3.720
128 HE1 TYR 314 1HE TYR 314 -8.046 3.099 6.365
129 HE2 TYR 314 2HE TYR 314 -4.060 3.482 4.892
130 HH TYR 314 HH TYR 314 -5.998 5.342 5.724
131 H GLY 315 HN GLY 315 -4.799 -2.623 3.633
132 HA2 GLY 315 2HA GLY 315 -4.325 -4.659 2.666
133 HA3 GLY 315 3HA GLY 315 -5.899 -5.221 3.208
134 H ILE 316 HN ILE 316 -7.765 -4.697 1.890
135 HA ILE 316 HA ILE 316 -7.096 -4.822 -0.935
136 HB ILE 316 HB ILE 316 -9.779 -5.054 0.435
137 HG12 ILE 316 1HG1 ILE 316 -8.027 -7.211 -0.769
138 HG13 ILE 316 2HG1 ILE 316 -8.122 -6.857 0.964
139 HG21 ILE 316 1HG2 ILE 316 -9.878 -6.307 -2.045
140 HG22 ILE 316 2HG2 ILE 316 -10.630 -4.775 -1.600
141 HG23 ILE 316 3HG2 ILE 316 -9.031 -4.788 -2.342
142 HD11 ILE 316 3HD1 ILE 316 -10.606 -7.304 0.785
143 HD12 ILE 316 1HD1 ILE 316 -10.264 -7.974 -0.810
144 HD13 ILE 316 2HD1 ILE 316 -9.534 -8.695 0.625
145 H LYS 317 HN LYS 317 -8.486 -2.611 1.362
146 HA LYS 317 HA LYS 317 -9.289 -0.776 -0.777
147 HB2 LYS 317 3HB LYS 317 -10.414 0.506 0.973
148 HB3 LYS 317 2HB LYS 317 -10.924 -1.190 1.005
149 HG2 LYS 317 3HG LYS 317 -9.131 -1.501 2.819
150 HG3 LYS 317 2HG LYS 317 -9.150 0.269 2.927
151 HD2 LYS 317 3HD LYS 317 -11.656 -1.401 3.130
152 HD3 LYS 317 2HD LYS 317 -10.668 -0.968 4.536
153 HE2 LYS 317 3HE LYS 317 -10.917 1.458 3.790
154 HE3 LYS 317 2HE LYS 317 -12.164 0.868 2.682
155 HZ1 LYS 317 3HZ LYS 317 -12.495 1.551 5.327
156 HZ2 LYS 317 1HZ LYS 317 -12.594 -0.138 5.301
157 HZ3 LYS 317 2HZ LYS 317 -13.625 0.786 4.328
158 H CYS 318 HN CYS 318 -6.489 -1.310 -0.176
159 HA CYS 318 HA CYS 318 -5.547 1.107 1.143
160 HB2 CYS 318 3HB CYS 318 -4.416 -1.026 1.594
161 HB3 CYS 318 2HB CYS 318 -4.013 -1.177 -0.117
162 H ARG 319 HN ARG 319 -5.470 2.926 0.010
163 HA ARG 319 HA ARG 319 -5.691 3.200 -2.732
164 HB2 ARG 319 3HB ARG 319 -5.747 4.941 -0.734
165 HB3 ARG 319 2HB ARG 319 -4.068 5.203 -1.231
166 HG2 ARG 319 3HG ARG 319 -4.687 5.951 -3.373
167 HG3 ARG 319 2HG ARG 319 -6.335 5.327 -3.191
168 HD2 ARG 319 3HD ARG 319 -5.174 7.544 -1.492
169 HD3 ARG 319 2HD ARG 319 -6.128 7.809 -2.959
170 HE ARG 319 HE ARG 319 -7.120 7.095 -0.376
171 HH11 ARG 319 2HH1 ARG 319 -7.711 6.818 -3.796
172 HH12 ARG 319 1HH1 ARG 319 -9.421 6.611 -3.616
173 HH21 ARG 319 2HH2 ARG 319 -9.371 6.825 -0.127
174 HH22 ARG 319 1HH2 ARG 319 -10.365 6.617 -1.528
175 H PHE 320 HN PHE 320 -2.771 2.963 -0.751
176 HA PHE 320 HA PHE 320 -0.967 3.369 -2.921
177 HB2 PHE 320 3HB PHE 320 -0.772 2.636 -0.055
178 HB3 PHE 320 2HB PHE 320 0.553 2.088 -1.083
179 HD1 PHE 320 2HD PHE 320 -1.419 5.180 -0.409
180 HD2 PHE 320 1HD PHE 320 2.350 3.478 -1.418
181 HE1 PHE 320 2HE PHE 320 -0.385 7.411 -0.302
182 HE2 PHE 320 1HE PHE 320 3.389 5.705 -1.311
183 HZ PHE 320 HZ PHE 320 2.021 7.676 -0.754
184 H PHE 321 HN PHE 321 0.761 1.626 -3.358
185 HA PHE 321 HA PHE 321 -0.665 -0.763 -4.224
186 HB2 PHE 321 3HB PHE 321 1.021 0.745 -5.601
187 HB3 PHE 321 2HB PHE 321 2.224 -0.292 -4.832
188 HD1 PHE 321 1HD PHE 321 2.034 -2.800 -5.113
189 HD2 PHE 321 2HD PHE 321 -0.168 -0.026 -7.473
190 HE1 PHE 321 1HE PHE 321 1.652 -4.546 -6.803
191 HE2 PHE 321 2HE PHE 321 -0.555 -1.767 -9.167
192 HZ PHE 321 HZ PHE 321 0.355 -4.032 -8.833
193 H HIS 322 HN HIS 322 -0.522 -2.658 -3.226
194 HA HIS 322 HA HIS 322 1.318 -2.948 -0.993
195 HB2 HIS 322 3HB HIS 322 -1.147 -4.356 -1.926
196 HB3 HIS 322 2HB HIS 322 -0.019 -5.238 -0.894
197 HD1 HIS 322 1HD HIS 322 -0.045 -4.739 1.573
198 HD2 HIS 322 2HD HIS 322 -2.278 -2.023 -0.640
199 HE1 HIS 322 1HE HIS 322 -1.281 -3.350 3.265
200 HE2 HIS 322 2HE HIS 322 -2.646 -1.688 1.913
201 HA PRO 323 HA PRO 323 4.232 -5.556 -2.981
202 HB2 PRO 323 3HB PRO 323 4.907 -7.275 -0.959
203 HB3 PRO 323 2HB PRO 323 5.395 -5.581 -0.999
204 HG2 PRO 323 3HG PRO 323 3.096 -6.864 0.439
205 HG3 PRO 323 2HG PRO 323 4.283 -5.648 1.042
206 HD2 PRO 323 3HD PRO 323 1.769 -4.981 0.266
207 HD3 PRO 323 2HD PRO 323 3.158 -3.906 0.035
208 H GLU 324 HN GLU 324 1.605 -7.168 -1.255
209 HA GLU 324 HA GLU 324 1.878 -9.482 -3.050
210 HB2 GLU 324 3HB GLU 324 0.326 -9.244 -0.461
211 HB3 GLU 324 2HB GLU 324 0.525 -10.713 -1.428
212 HG2 GLU 324 3HG GLU 324 2.939 -9.278 -0.399
213 HG3 GLU 324 2HG GLU 324 2.000 -10.326 0.673
214 HE2 GLU 324 HE GLU 324 2.872 -12.827 -2.035
215 H ARG 325 HN ARG 325 -0.207 -6.876 -2.103
216 HA ARG 325 HA ARG 325 -2.270 -7.864 -3.961
217 HB2 ARG 325 3HB ARG 325 -2.442 -6.294 -1.411
218 HB3 ARG 325 2HB ARG 325 -3.704 -6.118 -2.638
219 HG2 ARG 325 3HG ARG 325 -2.878 -8.782 -1.495
220 HG3 ARG 325 2HG ARG 325 -4.183 -7.786 -0.828
221 HD2 ARG 325 3HD ARG 325 -4.118 -8.605 -3.729
222 HD3 ARG 325 2HD ARG 325 -4.843 -9.619 -2.473
223 HE ARG 325 HE ARG 325 -6.037 -7.218 -2.097
224 HH11 ARG 325 2HH1 ARG 325 -5.606 -9.281 -4.868
225 HH12 ARG 325 1HH1 ARG 325 -7.077 -8.780 -5.633
226 HH21 ARG 325 2HH2 ARG 325 -7.977 -6.550 -3.095
227 HH22 ARG 325 1HH2 ARG 325 -8.426 -7.226 -4.624
228 HA PRO 326 HA PRO 326 -1.701 -4.383 -6.568
229 HB2 PRO 326 3HB PRO 326 -4.264 -3.828 -7.357
230 HB3 PRO 326 2HB PRO 326 -3.362 -5.239 -7.905
231 HG2 PRO 326 3HG PRO 326 -5.382 -5.013 -5.699
232 HG3 PRO 326 2HG PRO 326 -5.232 -6.270 -6.983
233 HD2 PRO 326 3HD PRO 326 -4.379 -6.668 -4.436
234 HD3 PRO 326 2HD PRO 326 -3.565 -7.377 -5.840
235 H SER 327 HN SER 327 -3.064 -2.166 -7.067
236 HA SER 327 HA SER 327 -2.470 -0.432 -4.994
237 HB2 SER 327 1HB SER 327 -2.746 0.418 -7.228
238 HB3 SER 327 2HB SER 327 -4.433 -0.125 -7.276
239 HG SER 327 HG SER 327 -4.980 1.675 -6.363
Start of MODEL 5
1 H1 SER 299 HN SER 299 6.594 12.850 -1.172
2 HA SER 299 HA SER 299 5.395 12.497 -3.172
3 HB2 SER 299 1HB SER 299 8.301 13.018 -3.856
4 HB3 SER 299 2HB SER 299 6.977 13.142 -5.028
5 HG SER 299 HG SER 299 6.124 14.834 -3.908
6 H GLU 300 HN GLU 300 6.233 9.933 -2.067
7 HA GLU 300 HA GLU 300 6.817 8.451 -4.543
8 HB2 GLU 300 3HB GLU 300 7.476 6.576 -3.032
9 HB3 GLU 300 2HB GLU 300 8.491 8.018 -2.879
10 HG2 GLU 300 3HG GLU 300 6.168 7.672 -1.035
11 HG3 GLU 300 2HG GLU 300 7.650 6.745 -0.761
12 HE2 GLU 300 HE GLU 300 7.638 10.263 0.652
13 H HIS 301 HN HIS 301 4.309 9.198 -4.540
14 HA HIS 301 HA HIS 301 2.453 7.680 -3.086
15 HB2 HIS 301 3HB HIS 301 1.908 9.739 -4.360
16 HB3 HIS 301 2HB HIS 301 2.123 8.837 -5.862
17 HD1 HIS 301 1HD HIS 301 -0.107 8.787 -2.793
18 HD2 HIS 301 2HD HIS 301 -0.101 7.550 -6.759
19 HE1 HIS 301 1HE HIS 301 -2.427 7.924 -3.232
20 HE2 HIS 301 2HE HIS 301 -2.425 7.169 -5.656
21 H ARG 302 HN ARG 302 3.970 7.107 -6.234
22 HA ARG 302 HA ARG 302 2.888 4.366 -6.167
23 HB2 ARG 302 3HB ARG 302 3.328 4.425 -8.683
24 HB3 ARG 302 2HB ARG 302 1.971 5.388 -8.079
25 HG2 ARG 302 3HG ARG 302 3.231 7.419 -8.251
26 HG3 ARG 302 2HG ARG 302 4.701 6.514 -8.651
27 HD2 ARG 302 3HD ARG 302 3.844 5.847 -10.765
28 HD3 ARG 302 2HD ARG 302 2.213 6.383 -10.336
29 HE ARG 302 HE ARG 302 3.693 8.656 -10.182
30 HH11 ARG 302 2HH1 ARG 302 3.214 6.233 -12.637
31 HH12 ARG 302 1HH1 ARG 302 3.456 7.333 -13.954
32 HH21 ARG 302 2HH2 ARG 302 4.012 10.113 -11.908
33 HH22 ARG 302 1HH2 ARG 302 3.911 9.539 -13.538
34 H LYS 303 HN LYS 303 5.708 6.359 -6.413
35 HA LYS 303 HA LYS 303 7.581 4.644 -7.503
36 HB2 LYS 303 3HB LYS 303 7.986 6.566 -5.198
37 HB3 LYS 303 2HB LYS 303 9.263 5.895 -6.226
38 HG2 LYS 303 3HG LYS 303 7.810 6.972 -8.154
39 HG3 LYS 303 2HG LYS 303 7.263 8.006 -6.823
40 HD2 LYS 303 3HD LYS 303 10.193 7.518 -7.282
41 HD3 LYS 303 2HD LYS 303 9.315 8.745 -8.212
42 HE2 LYS 303 3HE LYS 303 8.934 10.084 -6.371
43 HE3 LYS 303 2HE LYS 303 9.037 8.723 -5.243
44 HZ1 LYS 303 3HZ LYS 303 11.079 10.503 -6.074
45 HZ2 LYS 303 1HZ LYS 303 11.523 8.909 -6.428
46 HZ3 LYS 303 2HZ LYS 303 11.113 9.341 -4.845
47 H GLN 304 HN GLN 304 6.824 5.027 -4.037
48 HA GLN 304 HA GLN 304 8.129 2.452 -3.524
49 HB2 GLN 304 3HB GLN 304 7.481 4.849 -1.855
50 HB3 GLN 304 2HB GLN 304 7.630 3.272 -1.063
51 HG2 GLN 304 3HG GLN 304 9.774 4.359 -2.870
52 HG3 GLN 304 2HG GLN 304 9.702 4.737 -1.144
53 HE21 GLN 304 1HE2 GLN 304 10.039 3.095 0.371
54 HE22 GLN 304 2HE2 GLN 304 10.810 1.608 -0.056
55 HA PRO 305 HA PRO 305 4.403 0.274 -2.747
56 HB2 PRO 305 3HB PRO 305 5.073 -1.291 -0.600
57 HB3 PRO 305 2HB PRO 305 5.693 -1.556 -2.229
58 HG2 PRO 305 3HG PRO 305 6.963 -0.123 0.080
59 HG3 PRO 305 2HG PRO 305 7.687 -1.324 -1.055
60 HD2 PRO 305 3HD PRO 305 8.100 1.348 -1.292
61 HD3 PRO 305 2HD PRO 305 8.004 0.267 -2.691
62 H CYS 306 HN CYS 306 3.022 -0.513 -0.702
63 HA CYS 306 HA CYS 306 1.761 1.702 0.354
64 HB2 CYS 306 3HB CYS 306 1.642 -1.165 0.707
65 HB3 CYS 306 2HB CYS 306 1.400 -0.344 2.251
66 HA PRO 307 HA PRO 307 4.125 3.193 3.734
67 HB2 PRO 307 3HB PRO 307 2.184 3.860 5.549
68 HB3 PRO 307 2HB PRO 307 2.479 4.762 4.064
69 HG2 PRO 307 3HG PRO 307 0.439 2.638 4.625
70 HG3 PRO 307 2HG PRO 307 0.234 4.222 3.788
71 HD2 PRO 307 3HD PRO 307 0.446 1.872 2.444
72 HD3 PRO 307 2HD PRO 307 1.087 3.398 1.812
73 H TYR 308 HN TYR 308 1.716 0.730 4.495
74 HA TYR 308 HA TYR 308 3.451 -0.198 6.691
75 HB2 TYR 308 3HB TYR 308 0.440 -0.262 6.428
76 HB3 TYR 308 2HB TYR 308 1.315 -1.228 7.619
77 HD1 TYR 308 2HD TYR 308 2.664 -0.091 9.397
78 HD2 TYR 308 1HD TYR 308 0.045 2.057 6.821
79 HE1 TYR 308 2HE TYR 308 2.684 1.804 10.965
80 HE2 TYR 308 1HE TYR 308 0.058 3.957 8.383
81 HH TYR 308 HH TYR 308 0.482 4.265 10.903
82 H GLY 309 HN GLY 309 1.203 -1.204 4.137
83 HA2 GLY 309 2HA GLY 309 1.233 -3.066 2.784
84 HA3 GLY 309 3HA GLY 309 2.838 -3.419 3.408
85 H LYS 310 HN LYS 310 3.085 -4.842 5.108
86 HA LYS 310 HA LYS 310 1.043 -6.796 5.411
87 HB2 LYS 310 3HB LYS 310 2.592 -7.769 7.132
88 HB3 LYS 310 2HB LYS 310 3.319 -7.513 5.538
89 HG2 LYS 310 3HG LYS 310 3.758 -5.151 7.030
90 HG3 LYS 310 2HG LYS 310 4.167 -6.526 8.070
91 HD2 LYS 310 3HD LYS 310 5.388 -7.387 5.886
92 HD3 LYS 310 2HD LYS 310 5.397 -5.657 5.500
93 HE2 LYS 310 3HE LYS 310 6.281 -5.446 7.987
94 HE3 LYS 310 2HE LYS 310 6.779 -7.120 7.695
95 HZ1 LYS 310 3HZ LYS 310 8.235 -6.495 6.039
96 HZ2 LYS 310 1HZ LYS 310 8.392 -5.212 7.130
97 HZ3 LYS 310 2HZ LYS 310 7.453 -5.026 5.737
98 H LYS 311 HN LYS 311 2.123 -4.073 7.337
99 HA LYS 311 HA LYS 311 0.448 -4.786 9.586
100 HB2 LYS 311 3HB LYS 311 2.181 -2.384 8.986
101 HB3 LYS 311 2HB LYS 311 1.214 -2.541 10.462
102 HG2 LYS 311 3HG LYS 311 2.459 -4.464 11.167
103 HG3 LYS 311 2HG LYS 311 3.328 -4.512 9.624
104 HD2 LYS 311 3HD LYS 311 4.166 -2.170 10.181
105 HD3 LYS 311 2HD LYS 311 3.546 -2.461 11.815
106 HE2 LYS 311 3HE LYS 311 6.004 -2.970 11.454
107 HE3 LYS 311 2HE LYS 311 5.031 -4.262 12.172
108 HZ1 LYS 311 3HZ LYS 311 5.110 -5.513 10.261
109 HZ2 LYS 311 1HZ LYS 311 6.642 -4.798 10.242
110 HZ3 LYS 311 2HZ LYS 311 5.411 -4.187 9.256
111 H CYS 312 HN CYS 312 0.159 -3.007 6.677
112 HA CYS 312 HA CYS 312 -1.652 -1.015 7.278
113 HB2 CYS 312 3HB CYS 312 -0.542 -1.704 5.022
114 HB3 CYS 312 2HB CYS 312 -1.992 -2.686 4.806
115 H THR 313 HN THR 313 -3.801 -0.889 7.677
116 HA THR 313 HA THR 313 -5.156 -3.369 8.362
117 HB THR 313 HB THR 313 -6.836 -1.994 9.422
118 HG1 THR 313 1HG THR 313 -6.431 0.383 9.324
119 HG21 THR 313 3HG2 THR 313 -4.359 -2.258 10.343
120 HG22 THR 313 1HG2 THR 313 -5.569 -1.298 11.194
121 HG23 THR 313 2HG2 THR 313 -4.374 -0.503 10.168
122 H TYR 314 HN TYR 314 -5.284 -0.855 5.952
123 HA TYR 314 HA TYR 314 -7.871 -1.284 4.960
124 HB2 TYR 314 3HB TYR 314 -5.487 -0.493 3.280
125 HB3 TYR 314 2HB TYR 314 -7.182 -0.075 3.019
126 HD1 TYR 314 1HD TYR 314 -8.034 0.817 5.685
127 HD2 TYR 314 2HD TYR 314 -4.412 1.564 3.582
128 HE1 TYR 314 1HE TYR 314 -7.743 2.909 6.944
129 HE2 TYR 314 2HE TYR 314 -4.109 3.659 4.837
130 HH TYR 314 HH TYR 314 -5.407 5.262 6.081
131 H GLY 315 HN GLY 315 -4.771 -2.520 3.682
132 HA2 GLY 315 2HA GLY 315 -4.283 -4.534 2.673
133 HA3 GLY 315 3HA GLY 315 -5.872 -5.105 3.160
134 H ILE 316 HN ILE 316 -7.719 -4.407 1.836
135 HA ILE 316 HA ILE 316 -6.957 -4.383 -0.990
136 HB ILE 316 HB ILE 316 -9.670 -4.892 0.235
137 HG12 ILE 316 1HG1 ILE 316 -7.693 -6.875 -0.914
138 HG13 ILE 316 2HG1 ILE 316 -7.918 -6.587 0.820
139 HG21 ILE 316 1HG2 ILE 316 -9.722 -6.055 -2.200
140 HG22 ILE 316 2HG2 ILE 316 -10.295 -4.420 -1.875
141 HG23 ILE 316 3HG2 ILE 316 -8.676 -4.673 -2.525
142 HD11 ILE 316 3HD1 ILE 316 -9.705 -7.966 -1.109
143 HD12 ILE 316 1HD1 ILE 316 -9.246 -8.416 0.533
144 HD13 ILE 316 2HD1 ILE 316 -10.423 -7.129 0.267
145 H LYS 317 HN LYS 317 -8.424 -2.420 1.442
146 HA LYS 317 HA LYS 317 -9.437 -0.528 -0.553
147 HB2 LYS 317 3HB LYS 317 -10.557 0.583 1.313
148 HB3 LYS 317 2HB LYS 317 -10.960 -1.141 1.270
149 HG2 LYS 317 3HG LYS 317 -9.075 -1.438 2.987
150 HG3 LYS 317 2HG LYS 317 -9.188 0.318 3.194
151 HD2 LYS 317 3HD LYS 317 -11.557 -1.544 3.439
152 HD3 LYS 317 2HD LYS 317 -10.554 -1.039 4.810
153 HE2 LYS 317 3HE LYS 317 -11.049 1.377 3.976
154 HE3 LYS 317 2HE LYS 317 -12.381 0.607 3.101
155 HZ1 LYS 317 3HZ LYS 317 -12.919 1.495 5.374
156 HZ2 LYS 317 1HZ LYS 317 -11.979 0.242 6.013
157 HZ3 LYS 317 2HZ LYS 317 -13.356 -0.116 5.099
158 H CYS 318 HN CYS 318 -6.575 -0.938 -0.040
159 HA CYS 318 HA CYS 318 -5.725 1.459 1.357
160 HB2 CYS 318 3HB CYS 318 -4.460 -0.650 1.595
161 HB3 CYS 318 2HB CYS 318 -4.095 -0.610 -0.131
162 H ARG 319 HN ARG 319 -4.629 3.193 0.415
163 HA ARG 319 HA ARG 319 -5.270 3.606 -2.408
164 HB2 ARG 319 3HB ARG 319 -4.408 5.507 -0.218
165 HB3 ARG 319 2HB ARG 319 -4.655 5.991 -1.903
166 HG2 ARG 319 3HG ARG 319 -6.806 4.703 -0.229
167 HG3 ARG 319 2HG ARG 319 -6.569 6.455 -0.348
168 HD2 ARG 319 3HD ARG 319 -7.048 4.623 -2.708
169 HD3 ARG 319 2HD ARG 319 -8.298 5.578 -1.899
170 HE ARG 319 HE ARG 319 -6.157 7.244 -2.707
171 HH11 ARG 319 2HH1 ARG 319 -8.880 5.473 -3.959
172 HH12 ARG 319 1HH1 ARG 319 -9.099 6.519 -5.322
173 HH21 ARG 319 2HH2 ARG 319 -6.435 8.629 -4.497
174 HH22 ARG 319 1HH2 ARG 319 -7.707 8.313 -5.629
175 H PHE 320 HN PHE 320 -3.055 1.887 -1.549
176 HA PHE 320 HA PHE 320 -0.958 3.184 -3.113
177 HB2 PHE 320 3HB PHE 320 -0.780 2.464 -0.245
178 HB3 PHE 320 2HB PHE 320 0.591 1.974 -1.243
179 HD1 PHE 320 2HD PHE 320 -1.465 4.931 -0.350
180 HD2 PHE 320 1HD PHE 320 2.257 3.487 -1.825
181 HE1 PHE 320 2HE PHE 320 -0.540 7.208 -0.232
182 HE2 PHE 320 1HE PHE 320 3.189 5.761 -1.708
183 HZ PHE 320 HZ PHE 320 1.790 7.625 -0.913
184 H PHE 321 HN PHE 321 0.895 1.526 -3.471
185 HA PHE 321 HA PHE 321 -0.372 -0.905 -4.442
186 HB2 PHE 321 3HB PHE 321 1.234 0.587 -5.794
187 HB3 PHE 321 2HB PHE 321 2.516 -0.142 -4.826
188 HD1 PHE 321 2HD PHE 321 0.009 -0.761 -7.414
189 HD2 PHE 321 1HD PHE 321 3.157 -2.449 -5.099
190 HE1 PHE 321 2HE PHE 321 0.091 -2.691 -8.938
191 HE2 PHE 321 1HE PHE 321 3.244 -4.381 -6.620
192 HZ PHE 321 HZ PHE 321 1.710 -4.505 -8.542
193 H HIS 322 HN HIS 322 -0.273 -2.782 -3.412
194 HA HIS 322 HA HIS 322 1.489 -3.051 -1.106
195 HB2 HIS 322 3HB HIS 322 -0.958 -4.461 -2.092
196 HB3 HIS 322 2HB HIS 322 0.131 -5.320 -0.999
197 HD1 HIS 322 1HD HIS 322 0.101 -4.691 1.452
198 HD2 HIS 322 2HD HIS 322 -2.203 -2.163 -0.906
199 HE1 HIS 322 1HE HIS 322 -1.208 -3.274 3.066
200 HE2 HIS 322 2HE HIS 322 -2.615 -1.727 1.626
201 HA PRO 323 HA PRO 323 4.428 -5.710 -2.987
202 HB2 PRO 323 3HB PRO 323 5.031 -7.412 -0.927
203 HB3 PRO 323 2HB PRO 323 5.537 -5.724 -0.975
204 HG2 PRO 323 3HG PRO 323 3.189 -6.967 0.417
205 HG3 PRO 323 2HG PRO 323 4.371 -5.756 1.038
206 HD2 PRO 323 3HD PRO 323 1.886 -5.074 0.186
207 HD3 PRO 323 2HD PRO 323 3.291 -4.016 -0.019
208 H GLU 324 HN GLU 324 1.746 -7.282 -1.307
209 HA GLU 324 HA GLU 324 2.039 -9.615 -3.071
210 HB2 GLU 324 3HB GLU 324 0.432 -9.334 -0.521
211 HB3 GLU 324 2HB GLU 324 0.631 -10.815 -1.470
212 HG2 GLU 324 3HG GLU 324 3.069 -9.430 -0.458
213 HG3 GLU 324 2HG GLU 324 2.077 -10.362 0.672
214 HE2 GLU 324 HE GLU 324 4.589 -12.371 -1.333
215 H ARG 325 HN ARG 325 -0.043 -6.981 -2.204
216 HA ARG 325 HA ARG 325 -2.073 -7.973 -4.097
217 HB2 ARG 325 3HB ARG 325 -2.283 -6.361 -1.576
218 HB3 ARG 325 2HB ARG 325 -3.514 -6.188 -2.836
219 HG2 ARG 325 3HG ARG 325 -2.749 -8.836 -1.615
220 HG3 ARG 325 2HG ARG 325 -4.071 -7.816 -1.023
221 HD2 ARG 325 3HD ARG 325 -5.231 -7.977 -3.134
222 HD3 ARG 325 2HD ARG 325 -3.860 -8.835 -3.852
223 HE ARG 325 HE ARG 325 -4.587 -10.773 -2.863
224 HH11 ARG 325 2HH1 ARG 325 -6.241 -8.059 -1.445
225 HH12 ARG 325 1HH1 ARG 325 -7.363 -9.038 -0.559
226 HH21 ARG 325 2HH2 ARG 325 -6.057 -12.074 -1.703
227 HH22 ARG 325 1HH2 ARG 325 -7.257 -11.323 -0.706
228 HA PRO 326 HA PRO 326 -1.408 -4.540 -6.746
229 HB2 PRO 326 3HB PRO 326 -3.948 -3.960 -7.592
230 HB3 PRO 326 2HB PRO 326 -3.055 -5.394 -8.100
231 HG2 PRO 326 3HG PRO 326 -5.113 -5.103 -5.937
232 HG3 PRO 326 2HG PRO 326 -4.957 -6.382 -7.198
233 HD2 PRO 326 3HD PRO 326 -4.159 -6.752 -4.630
234 HD3 PRO 326 2HD PRO 326 -3.328 -7.495 -6.007
235 H SER 327 HN SER 327 -4.227 -4.002 -4.625
236 HA SER 327 HA SER 327 -3.133 -1.593 -3.558
237 HB2 SER 327 1HB SER 327 -4.042 -0.983 -5.912
238 HB3 SER 327 2HB SER 327 -5.639 -1.159 -5.165
239 HG SER 327 HG SER 327 -4.583 1.011 -5.137
Start of MODEL 6
1 H1 SER 299 HN SER 299 8.878 13.506 -4.993
2 HA SER 299 HA SER 299 8.140 12.376 -2.372
3 HB2 SER 299 1HB SER 299 6.666 14.265 -3.421
4 HB3 SER 299 2HB SER 299 6.093 12.971 -4.488
5 HG SER 299 HG SER 299 6.075 12.805 -1.656
6 H GLU 300 HN GLU 300 7.421 10.269 -2.307
7 HA GLU 300 HA GLU 300 7.664 8.756 -4.825
8 HB2 GLU 300 3HB GLU 300 8.391 6.827 -3.434
9 HB3 GLU 300 2HB GLU 300 9.510 8.199 -3.383
10 HG2 GLU 300 3HG GLU 300 7.405 7.851 -1.274
11 HG3 GLU 300 2HG GLU 300 8.943 6.977 -1.193
12 HE2 GLU 300 HE GLU 300 9.037 10.406 0.338
13 H HIS 301 HN HIS 301 5.248 9.672 -4.517
14 HA HIS 301 HA HIS 301 3.562 8.061 -2.851
15 HB2 HIS 301 3HB HIS 301 1.714 9.232 -3.868
16 HB3 HIS 301 2HB HIS 301 2.996 10.393 -3.514
17 HD1 HIS 301 1HD HIS 301 0.788 9.416 -6.163
18 HD2 HIS 301 2HD HIS 301 4.648 10.938 -5.947
19 HE1 HIS 301 1HE HIS 301 1.269 10.357 -8.446
20 HE2 HIS 301 2HE HIS 301 3.627 11.287 -8.315
21 H ARG 302 HN ARG 302 4.804 7.845 -6.074
22 HA ARG 302 HA ARG 302 3.266 5.365 -6.460
23 HB2 ARG 302 3HB ARG 302 3.214 5.871 -8.903
24 HB3 ARG 302 2HB ARG 302 2.260 6.988 -7.917
25 HG2 ARG 302 3HG ARG 302 3.297 8.644 -8.973
26 HG3 ARG 302 2HG ARG 302 4.742 8.195 -8.054
27 HD2 ARG 302 3HD ARG 302 5.535 8.148 -10.230
28 HD3 ARG 302 2HD ARG 302 5.102 6.456 -9.948
29 HE ARG 302 HE ARG 302 3.425 6.647 -11.507
30 HH11 ARG 302 2HH1 ARG 302 4.616 9.812 -10.677
31 HH12 ARG 302 1HH1 ARG 302 3.748 10.613 -11.945
32 HH21 ARG 302 2HH2 ARG 302 2.278 7.691 -13.178
33 HH22 ARG 302 1HH2 ARG 302 2.418 9.406 -13.367
34 H LYS 303 HN LYS 303 6.036 6.024 -5.510
35 HA LYS 303 HA LYS 303 7.543 4.528 -7.555
36 HB2 LYS 303 3HB LYS 303 8.644 6.391 -5.438
37 HB3 LYS 303 2HB LYS 303 9.566 5.582 -6.715
38 HG2 LYS 303 3HG LYS 303 7.337 7.508 -7.327
39 HG3 LYS 303 2HG LYS 303 9.012 8.030 -7.072
40 HD2 LYS 303 3HD LYS 303 8.441 5.825 -9.018
41 HD3 LYS 303 2HD LYS 303 8.145 7.508 -9.486
42 HE2 LYS 303 3HE LYS 303 10.319 7.337 -10.166
43 HE3 LYS 303 2HE LYS 303 10.581 7.829 -8.486
44 HZ1 LYS 303 3HZ LYS 303 11.720 5.695 -9.585
45 HZ2 LYS 303 1HZ LYS 303 10.337 4.971 -8.933
46 HZ3 LYS 303 2HZ LYS 303 11.398 5.823 -7.930
47 H GLN 304 HN GLN 304 6.662 4.765 -4.189
48 HA GLN 304 HA GLN 304 8.094 2.244 -3.667
49 HB2 GLN 304 3HB GLN 304 7.618 4.671 -1.999
50 HB3 GLN 304 2HB GLN 304 7.664 3.098 -1.187
51 HG2 GLN 304 3HG GLN 304 9.849 4.327 -2.866
52 HG3 GLN 304 2HG GLN 304 9.841 4.113 -1.110
53 HE21 GLN 304 1HE2 GLN 304 10.257 2.115 -0.235
54 HE22 GLN 304 2HE2 GLN 304 10.848 0.784 -1.166
55 HA PRO 305 HA PRO 305 4.328 0.188 -2.766
56 HB2 PRO 305 3HB PRO 305 5.005 -1.385 -0.628
57 HB3 PRO 305 2HB PRO 305 5.574 -1.678 -2.270
58 HG2 PRO 305 3HG PRO 305 6.948 -0.273 -0.005
59 HG3 PRO 305 2HG PRO 305 7.603 -1.503 -1.150
60 HD2 PRO 305 3HD PRO 305 8.094 1.154 -1.416
61 HD3 PRO 305 2HD PRO 305 7.927 0.067 -2.805
62 H CYS 306 HN CYS 306 2.959 -0.529 -0.700
63 HA CYS 306 HA CYS 306 1.815 1.736 0.382
64 HB2 CYS 306 3HB CYS 306 1.581 -1.123 0.735
65 HB3 CYS 306 2HB CYS 306 1.409 -0.299 2.285
66 HA PRO 307 HA PRO 307 4.311 3.122 3.713
67 HB2 PRO 307 3HB PRO 307 2.437 3.871 5.565
68 HB3 PRO 307 2HB PRO 307 2.742 4.761 4.074
69 HG2 PRO 307 3HG PRO 307 0.621 2.727 4.677
70 HG3 PRO 307 2HG PRO 307 0.470 4.320 3.843
71 HD2 PRO 307 3HD PRO 307 0.553 1.962 2.498
72 HD3 PRO 307 2HD PRO 307 1.246 3.459 1.850
73 H TYR 308 HN TYR 308 1.812 0.766 4.524
74 HA TYR 308 HA TYR 308 3.547 -0.236 6.686
75 HB2 TYR 308 3HB TYR 308 0.534 -0.141 6.484
76 HB3 TYR 308 2HB TYR 308 1.371 -1.184 7.636
77 HD1 TYR 308 2HD TYR 308 3.118 -0.006 9.192
78 HD2 TYR 308 1HD TYR 308 -0.013 2.025 7.149
79 HE1 TYR 308 2HE TYR 308 3.280 1.850 10.799
80 HE2 TYR 308 1HE TYR 308 0.141 3.886 8.748
81 HH TYR 308 HH TYR 308 2.180 3.701 11.592
82 H GLY 309 HN GLY 309 1.207 -1.144 4.178
83 HA2 GLY 309 2HA GLY 309 1.130 -3.006 2.825
84 HA3 GLY 309 3HA GLY 309 2.729 -3.429 3.418
85 H LYS 310 HN LYS 310 2.948 -4.902 5.062
86 HA LYS 310 HA LYS 310 0.821 -6.744 5.424
87 HB2 LYS 310 3HB LYS 310 2.367 -7.797 7.106
88 HB3 LYS 310 2HB LYS 310 3.054 -7.581 5.489
89 HG2 LYS 310 3HG LYS 310 4.388 -5.753 6.177
90 HG3 LYS 310 2HG LYS 310 3.518 -5.619 7.715
91 HD2 LYS 310 3HD LYS 310 4.483 -7.589 8.574
92 HD3 LYS 310 2HD LYS 310 5.039 -8.102 6.971
93 HE2 LYS 310 3HE LYS 310 6.978 -7.325 8.067
94 HE3 LYS 310 2HE LYS 310 6.498 -6.019 6.971
95 HZ1 LYS 310 3HZ LYS 310 5.776 -4.706 8.701
96 HZ2 LYS 310 1HZ LYS 310 7.114 -5.470 9.401
97 HZ3 LYS 310 2HZ LYS 310 5.549 -6.006 9.758
98 H LYS 311 HN LYS 311 2.077 -4.083 7.327
99 HA LYS 311 HA LYS 311 0.437 -4.730 9.623
100 HB2 LYS 311 3HB LYS 311 2.268 -2.415 8.973
101 HB3 LYS 311 2HB LYS 311 1.322 -2.507 10.467
102 HG2 LYS 311 3HG LYS 311 2.556 -4.268 11.316
103 HG3 LYS 311 2HG LYS 311 3.128 -4.762 9.712
104 HD2 LYS 311 3HD LYS 311 4.991 -3.776 10.798
105 HD3 LYS 311 2HD LYS 311 4.406 -2.584 9.625
106 HE2 LYS 311 3HE LYS 311 3.551 -1.180 11.253
107 HE3 LYS 311 2HE LYS 311 3.368 -2.498 12.421
108 HZ1 LYS 311 3HZ LYS 311 5.868 -2.577 12.479
109 HZ2 LYS 311 1HZ LYS 311 5.163 -1.200 13.163
110 HZ3 LYS 311 2HZ LYS 311 5.864 -1.116 11.627
111 H CYS 312 HN CYS 312 0.134 -2.942 6.724
112 HA CYS 312 HA CYS 312 -1.565 -0.870 7.375
113 HB2 CYS 312 3HB CYS 312 -0.564 -1.634 5.084
114 HB3 CYS 312 2HB CYS 312 -2.079 -2.524 4.925
115 H THR 313 HN THR 313 -3.785 -0.625 7.570
116 HA THR 313 HA THR 313 -5.179 -2.961 8.574
117 HB THR 313 HB THR 313 -7.020 -1.283 9.053
118 HG1 THR 313 1HG THR 313 -6.236 0.943 8.996
119 HG21 THR 313 3HG2 THR 313 -4.782 -1.924 10.467
120 HG22 THR 313 1HG2 THR 313 -6.105 -0.934 11.083
121 HG23 THR 313 2HG2 THR 313 -4.668 -0.166 10.410
122 H TYR 314 HN TYR 314 -5.489 -0.641 5.922
123 HA TYR 314 HA TYR 314 -7.942 -1.461 4.899
124 HB2 TYR 314 3HB TYR 314 -5.591 -0.565 3.222
125 HB3 TYR 314 2HB TYR 314 -7.307 -0.383 2.853
126 HD1 TYR 314 1HD TYR 314 -8.398 0.649 5.374
127 HD2 TYR 314 2HD TYR 314 -4.778 1.625 3.365
128 HE1 TYR 314 1HE TYR 314 -8.419 2.870 6.430
129 HE2 TYR 314 2HE TYR 314 -4.789 3.849 4.414
130 HH TYR 314 HH TYR 314 -6.976 4.671 6.960
131 H GLY 315 HN GLY 315 -4.698 -2.477 3.797
132 HA2 GLY 315 2HA GLY 315 -3.979 -4.507 2.978
133 HA3 GLY 315 3HA GLY 315 -5.508 -5.200 3.499
134 H ILE 316 HN ILE 316 -7.382 -4.872 2.098
135 HA ILE 316 HA ILE 316 -6.582 -5.062 -0.703
136 HB ILE 316 HB ILE 316 -9.287 -5.588 0.533
137 HG12 ILE 316 1HG1 ILE 316 -7.183 -7.582 -0.334
138 HG13 ILE 316 2HG1 ILE 316 -7.438 -7.084 1.347
139 HG21 ILE 316 1HG2 ILE 316 -9.953 -5.533 -1.596
140 HG22 ILE 316 2HG2 ILE 316 -8.297 -5.521 -2.201
141 HG23 ILE 316 3HG2 ILE 316 -9.075 -7.049 -1.789
142 HD11 ILE 316 3HD1 ILE 316 -8.774 -9.112 -0.120
143 HD12 ILE 316 1HD1 ILE 316 -8.976 -8.651 1.570
144 HD13 ILE 316 2HD1 ILE 316 -9.948 -7.872 0.322
145 H LYS 317 HN LYS 317 -8.303 -2.971 1.467
146 HA LYS 317 HA LYS 317 -9.324 -1.359 -0.755
147 HB2 LYS 317 3HB LYS 317 -10.617 -0.155 0.933
148 HB3 LYS 317 2HB LYS 317 -10.900 -1.900 1.044
149 HG2 LYS 317 3HG LYS 317 -8.961 -1.761 2.834
150 HG3 LYS 317 2HG LYS 317 -9.516 -0.081 2.938
151 HD2 LYS 317 3HD LYS 317 -10.780 -1.191 4.566
152 HD3 LYS 317 2HD LYS 317 -11.872 -1.067 3.175
153 HE2 LYS 317 3HE LYS 317 -11.409 -3.356 2.534
154 HE3 LYS 317 2HE LYS 317 -10.191 -3.488 3.810
155 HZ1 LYS 317 3HZ LYS 317 -12.344 -2.746 5.214
156 HZ2 LYS 317 1HZ LYS 317 -11.882 -4.355 4.971
157 HZ3 LYS 317 2HZ LYS 317 -13.072 -3.660 3.991
158 H CYS 318 HN CYS 318 -6.485 -1.481 -0.157
159 HA CYS 318 HA CYS 318 -5.880 1.101 1.046
160 HB2 CYS 318 3HB CYS 318 -4.487 -0.851 1.606
161 HB3 CYS 318 2HB CYS 318 -4.036 -1.011 -0.092
162 H ARG 319 HN ARG 319 -5.032 2.845 -0.031
163 HA ARG 319 HA ARG 319 -5.634 3.026 -2.831
164 HB2 ARG 319 3HB ARG 319 -5.771 4.844 -0.932
165 HB3 ARG 319 2HB ARG 319 -4.081 5.127 -1.378
166 HG2 ARG 319 3HG ARG 319 -5.298 6.677 -2.641
167 HG3 ARG 319 2HG ARG 319 -4.914 5.367 -3.770
168 HD2 ARG 319 3HD ARG 319 -7.133 4.428 -3.528
169 HD3 ARG 319 2HD ARG 319 -7.521 5.616 -2.276
170 HE ARG 319 HE ARG 319 -6.771 6.942 -4.652
171 HH11 ARG 319 2HH1 ARG 319 -9.372 5.081 -3.277
172 HH12 ARG 319 1HH1 ARG 319 -10.593 5.822 -4.258
173 HH21 ARG 319 2HH2 ARG 319 -8.370 7.925 -5.948
174 HH22 ARG 319 1HH2 ARG 319 -10.023 7.438 -5.778
175 H PHE 320 HN PHE 320 -2.707 2.896 -0.864
176 HA PHE 320 HA PHE 320 -0.909 3.333 -3.030
177 HB2 PHE 320 3HB PHE 320 -0.710 2.604 -0.166
178 HB3 PHE 320 2HB PHE 320 0.621 2.056 -1.188
179 HD1 PHE 320 2HD PHE 320 -1.373 5.148 -0.574
180 HD2 PHE 320 1HD PHE 320 2.420 3.447 -1.485
181 HE1 PHE 320 2HE PHE 320 -0.350 7.383 -0.473
182 HE2 PHE 320 1HE PHE 320 3.450 5.679 -1.384
183 HZ PHE 320 HZ PHE 320 2.064 7.651 -0.880
184 H PHE 321 HN PHE 321 0.871 1.599 -3.416
185 HA PHE 321 HA PHE 321 -0.513 -0.776 -4.369
186 HB2 PHE 321 3HB PHE 321 1.118 0.637 -5.758
187 HB3 PHE 321 2HB PHE 321 2.396 -0.112 -4.800
188 HD1 PHE 321 2HD PHE 321 -0.336 -0.828 -7.175
189 HD2 PHE 321 1HD PHE 321 3.144 -2.306 -5.223
190 HE1 PHE 321 2HE PHE 321 -0.326 -2.778 -8.677
191 HE2 PHE 321 1HE PHE 321 3.161 -4.258 -6.721
192 HZ PHE 321 HZ PHE 321 1.424 -4.496 -8.450
193 H HIS 322 HN HIS 322 -0.494 -2.641 -3.318
194 HA HIS 322 HA HIS 322 1.299 -2.991 -1.050
195 HB2 HIS 322 3HB HIS 322 -1.221 -4.294 -1.998
196 HB3 HIS 322 2HB HIS 322 -0.152 -5.204 -0.926
197 HD1 HIS 322 1HD HIS 322 -0.114 -4.583 1.528
198 HD2 HIS 322 2HD HIS 322 -2.346 -1.949 -0.782
199 HE1 HIS 322 1HE HIS 322 -1.331 -3.117 3.168
200 HE2 HIS 322 2HE HIS 322 -2.697 -1.507 1.757
201 HA PRO 323 HA PRO 323 4.096 -5.767 -2.975
202 HB2 PRO 323 3HB PRO 323 4.667 -7.488 -0.922
203 HB3 PRO 323 2HB PRO 323 5.239 -5.821 -0.983
204 HG2 PRO 323 3HG PRO 323 2.867 -6.967 0.451
205 HG3 PRO 323 2HG PRO 323 4.108 -5.802 1.049
206 HD2 PRO 323 3HD PRO 323 1.637 -5.022 0.239
207 HD3 PRO 323 2HD PRO 323 3.080 -4.022 0.007
208 H GLU 324 HN GLU 324 1.374 -7.218 -1.256
209 HA GLU 324 HA GLU 324 1.548 -9.570 -3.012
210 HB2 GLU 324 3HB GLU 324 -0.051 -9.232 -0.463
211 HB3 GLU 324 2HB GLU 324 0.155 -10.726 -1.391
212 HG2 GLU 324 3HG GLU 324 2.419 -10.933 -0.788
213 HG3 GLU 324 2HG GLU 324 2.485 -9.267 -0.194
214 HE2 GLU 324 HE GLU 324 0.613 -11.879 2.153
215 H ARG 325 HN ARG 325 -0.413 -6.849 -2.126
216 HA ARG 325 HA ARG 325 -2.503 -7.760 -3.995
217 HB2 ARG 325 3HB ARG 325 -2.621 -6.160 -1.461
218 HB3 ARG 325 2HB ARG 325 -3.853 -5.913 -2.708
219 HG2 ARG 325 3HG ARG 325 -3.286 -8.711 -1.886
220 HG3 ARG 325 2HG ARG 325 -4.156 -7.669 -0.748
221 HD2 ARG 325 3HD ARG 325 -5.738 -7.095 -2.633
222 HD3 ARG 325 2HD ARG 325 -4.946 -8.372 -3.568
223 HE ARG 325 HE ARG 325 -5.917 -9.229 -0.993
224 HH11 ARG 325 2HH1 ARG 325 -6.682 -8.780 -4.360
225 HH12 ARG 325 1HH1 ARG 325 -7.963 -9.945 -4.358
226 HH21 ARG 325 2HH2 ARG 325 -7.602 -10.765 -0.979
227 HH22 ARG 325 1HH2 ARG 325 -8.488 -11.073 -2.435
228 HA PRO 326 HA PRO 326 -1.737 -4.346 -6.641
229 HB2 PRO 326 3HB PRO 326 -4.262 -3.667 -7.456
230 HB3 PRO 326 2HB PRO 326 -3.431 -5.132 -7.979
231 HG2 PRO 326 3HG PRO 326 -5.452 -4.770 -5.792
232 HG3 PRO 326 2HG PRO 326 -5.359 -6.049 -7.059
233 HD2 PRO 326 3HD PRO 326 -4.547 -6.457 -4.501
234 HD3 PRO 326 2HD PRO 326 -3.761 -7.229 -5.889
235 H SER 327 HN SER 327 -2.975 -2.068 -7.178
236 HA SER 327 HA SER 327 -2.333 -0.365 -5.070
237 HB2 SER 327 1HB SER 327 -3.977 -0.010 -7.571
238 HB3 SER 327 2HB SER 327 -3.800 1.311 -6.403
239 HG SER 327 HG SER 327 -1.816 1.609 -7.039
Start of MODEL 7
1 H1 SER 299 HN SER 299 7.576 12.694 -1.422
2 HA SER 299 HA SER 299 7.278 13.026 -4.187
3 HB2 SER 299 1HB SER 299 9.578 12.233 -2.416
4 HB3 SER 299 2HB SER 299 9.757 12.203 -4.179
5 HG SER 299 HG SER 299 10.349 14.224 -3.598
6 H GLU 300 HN GLU 300 7.505 10.157 -2.207
7 HA GLU 300 HA GLU 300 7.593 8.459 -4.595
8 HB2 GLU 300 3HB GLU 300 8.030 6.606 -3.039
9 HB3 GLU 300 2HB GLU 300 9.207 7.915 -2.854
10 HG2 GLU 300 3HG GLU 300 6.801 7.899 -1.093
11 HG3 GLU 300 2HG GLU 300 8.113 6.757 -0.768
12 HE2 GLU 300 HE GLU 300 10.281 9.663 -0.330
13 H HIS 301 HN HIS 301 5.230 9.808 -4.320
14 HA HIS 301 HA HIS 301 3.267 8.348 -2.862
15 HB2 HIS 301 3HB HIS 301 2.989 10.720 -3.483
16 HB3 HIS 301 2HB HIS 301 2.908 10.255 -5.186
17 HD1 HIS 301 1HD HIS 301 0.925 9.991 -1.995
18 HD2 HIS 301 2HD HIS 301 0.459 9.343 -6.072
19 HE1 HIS 301 1HE HIS 301 -1.533 9.588 -2.336
20 HE2 HIS 301 2HE HIS 301 -1.820 9.192 -4.827
21 H ARG 302 HN ARG 302 4.678 8.046 -6.017
22 HA ARG 302 HA ARG 302 2.975 5.704 -6.509
23 HB2 ARG 302 3HB ARG 302 2.949 6.266 -8.928
24 HB3 ARG 302 2HB ARG 302 2.097 7.450 -7.925
25 HG2 ARG 302 3HG ARG 302 3.251 8.953 -9.121
26 HG3 ARG 302 2HG ARG 302 4.561 8.553 -7.999
27 HD2 ARG 302 3HD ARG 302 5.692 7.264 -9.538
28 HD3 ARG 302 2HD ARG 302 4.219 6.879 -10.437
29 HE ARG 302 HE ARG 302 4.767 9.637 -10.654
30 HH11 ARG 302 2HH1 ARG 302 5.927 6.542 -11.748
31 HH12 ARG 302 1HH1 ARG 302 6.587 7.165 -13.224
32 HH21 ARG 302 2HH2 ARG 302 5.631 10.469 -12.594
33 HH22 ARG 302 1HH2 ARG 302 6.419 9.399 -13.704
34 H LYS 303 HN LYS 303 5.719 6.070 -5.466
35 HA LYS 303 HA LYS 303 7.178 4.579 -7.548
36 HB2 LYS 303 3HB LYS 303 8.351 6.325 -5.369
37 HB3 LYS 303 2HB LYS 303 9.254 5.475 -6.633
38 HG2 LYS 303 3HG LYS 303 7.163 7.531 -7.299
39 HG3 LYS 303 2HG LYS 303 8.844 7.970 -6.947
40 HD2 LYS 303 3HD LYS 303 9.530 6.304 -8.734
41 HD3 LYS 303 2HD LYS 303 7.817 6.231 -9.180
42 HE2 LYS 303 3HE LYS 303 8.595 7.851 -10.634
43 HE3 LYS 303 2HE LYS 303 8.006 8.827 -9.279
44 HZ1 LYS 303 3HZ LYS 303 10.500 8.457 -8.500
45 HZ2 LYS 303 1HZ LYS 303 10.044 9.743 -9.500
46 HZ3 LYS 303 2HZ LYS 303 10.739 8.355 -10.171
47 H GLN 304 HN GLN 304 7.159 5.079 -4.014
48 HA GLN 304 HA GLN 304 8.188 2.411 -3.578
49 HB2 GLN 304 3HB GLN 304 7.598 4.791 -1.874
50 HB3 GLN 304 2HB GLN 304 7.664 3.200 -1.100
51 HG2 GLN 304 3HG GLN 304 9.865 4.492 -2.712
52 HG3 GLN 304 2HG GLN 304 9.806 4.319 -0.952
53 HE21 GLN 304 1HE2 GLN 304 10.450 2.765 -3.950
54 HE22 GLN 304 2HE2 GLN 304 11.028 1.271 -3.304
55 HA PRO 305 HA PRO 305 4.431 0.270 -2.856
56 HB2 PRO 305 3HB PRO 305 5.063 -1.337 -0.730
57 HB3 PRO 305 2HB PRO 305 5.692 -1.585 -2.359
58 HG2 PRO 305 3HG PRO 305 6.963 -0.206 -0.018
59 HG3 PRO 305 2HG PRO 305 7.680 -1.399 -1.165
60 HD2 PRO 305 3HD PRO 305 8.130 1.271 -1.357
61 HD3 PRO 305 2HD PRO 305 8.031 0.213 -2.774
62 H CYS 306 HN CYS 306 3.060 -0.556 -0.792
63 HA CYS 306 HA CYS 306 1.781 1.645 0.266
64 HB2 CYS 306 3HB CYS 306 1.694 -1.219 0.620
65 HB3 CYS 306 2HB CYS 306 1.473 -0.409 2.173
66 HA PRO 307 HA PRO 307 4.163 3.186 3.613
67 HB2 PRO 307 3HB PRO 307 2.226 3.870 5.424
68 HB3 PRO 307 2HB PRO 307 2.514 4.755 3.926
69 HG2 PRO 307 3HG PRO 307 0.478 2.633 4.520
70 HG3 PRO 307 2HG PRO 307 0.269 4.206 3.664
71 HD2 PRO 307 3HD PRO 307 0.483 1.840 2.350
72 HD3 PRO 307 2HD PRO 307 1.118 3.360 1.696
73 H TYR 308 HN TYR 308 1.752 0.736 4.422
74 HA TYR 308 HA TYR 308 3.504 -0.169 6.613
75 HB2 TYR 308 3HB TYR 308 0.490 -0.220 6.383
76 HB3 TYR 308 2HB TYR 308 1.372 -1.175 7.576
77 HD1 TYR 308 1HD TYR 308 2.696 -0.046 9.356
78 HD2 TYR 308 2HD TYR 308 0.160 2.127 6.719
79 HE1 TYR 308 1HE TYR 308 2.742 1.869 10.899
80 HE2 TYR 308 2HE TYR 308 0.199 4.047 8.254
81 HH TYR 308 HH TYR 308 0.966 3.947 11.305
82 H GLY 309 HN GLY 309 1.222 -1.200 4.100
83 HA2 GLY 309 2HA GLY 309 1.218 -3.085 2.778
84 HA3 GLY 309 3HA GLY 309 2.837 -3.427 3.371
85 H LYS 310 HN LYS 310 3.121 -4.798 5.119
86 HA LYS 310 HA LYS 310 1.098 -6.765 5.482
87 HB2 LYS 310 3HB LYS 310 2.681 -7.699 7.193
88 HB3 LYS 310 2HB LYS 310 3.379 -7.468 5.581
89 HG2 LYS 310 3HG LYS 310 4.561 -5.518 6.269
90 HG3 LYS 310 2HG LYS 310 3.704 -5.486 7.820
91 HD2 LYS 310 3HD LYS 310 5.215 -7.960 7.145
92 HD3 LYS 310 2HD LYS 310 6.149 -6.514 7.562
93 HE2 LYS 310 3HE LYS 310 5.877 -7.454 9.647
94 HE3 LYS 310 2HE LYS 310 4.477 -6.375 9.573
95 HZ1 LYS 310 3HZ LYS 310 3.083 -8.089 9.661
96 HZ2 LYS 310 1HZ LYS 310 4.409 -9.047 10.090
97 HZ3 LYS 310 2HZ LYS 310 3.918 -8.957 8.473
98 H LYS 311 HN LYS 311 2.212 -4.014 7.353
99 HA LYS 311 HA LYS 311 0.588 -4.692 9.646
100 HB2 LYS 311 3HB LYS 311 2.288 -2.295 8.945
101 HB3 LYS 311 2HB LYS 311 1.332 -2.393 10.432
102 HG2 LYS 311 3HG LYS 311 2.672 -4.004 11.371
103 HG3 LYS 311 2HG LYS 311 3.227 -4.600 9.797
104 HD2 LYS 311 3HD LYS 311 5.097 -3.495 10.680
105 HD3 LYS 311 2HD LYS 311 4.389 -2.331 9.547
106 HE2 LYS 311 3HE LYS 311 3.347 -1.105 11.336
107 HE3 LYS 311 2HE LYS 311 3.819 -2.346 12.505
108 HZ1 LYS 311 3HZ LYS 311 5.235 -0.090 11.865
109 HZ2 LYS 311 1HZ LYS 311 6.078 -1.338 11.093
110 HZ3 LYS 311 2HZ LYS 311 5.800 -1.411 12.759
111 H CYS 312 HN CYS 312 0.214 -2.961 6.711
112 HA CYS 312 HA CYS 312 -1.628 -1.000 7.321
113 HB2 CYS 312 3HB CYS 312 -0.537 -1.813 5.041
114 HB3 CYS 312 2HB CYS 312 -2.082 -2.647 4.873
115 H THR 313 HN THR 313 -3.878 -0.902 7.418
116 HA THR 313 HA THR 313 -5.145 -3.408 8.254
117 HB THR 313 HB THR 313 -5.256 -1.498 9.820
118 HG1 THR 313 1HG THR 313 -7.109 -2.335 10.380
119 HG21 THR 313 3HG2 THR 313 -6.100 0.547 9.302
120 HG22 THR 313 1HG2 THR 313 -7.268 -0.105 8.153
121 HG23 THR 313 2HG2 THR 313 -5.579 0.088 7.680
122 H TYR 314 HN TYR 314 -5.323 -0.895 5.846
123 HA TYR 314 HA TYR 314 -7.901 -1.348 4.860
124 HB2 TYR 314 3HB TYR 314 -5.517 -0.573 3.170
125 HB3 TYR 314 2HB TYR 314 -7.213 -0.169 2.895
126 HD1 TYR 314 2HD TYR 314 -8.184 0.863 5.384
127 HD2 TYR 314 1HD TYR 314 -4.353 1.386 3.607
128 HE1 TYR 314 2HE TYR 314 -7.909 2.977 6.612
129 HE2 TYR 314 1HE TYR 314 -4.067 3.501 4.831
130 HH TYR 314 HH TYR 314 -5.752 4.366 7.423
131 H GLY 315 HN GLY 315 -4.807 -2.600 3.585
132 HA2 GLY 315 2HA GLY 315 -4.323 -4.629 2.603
133 HA3 GLY 315 3HA GLY 315 -5.914 -5.190 3.096
134 H ILE 316 HN ILE 316 -7.761 -4.485 1.766
135 HA ILE 316 HA ILE 316 -7.000 -4.509 -1.061
136 HB ILE 316 HB ILE 316 -9.719 -4.969 0.169
137 HG12 ILE 316 1HG1 ILE 316 -7.754 -6.992 -0.931
138 HG13 ILE 316 2HG1 ILE 316 -7.995 -6.673 0.794
139 HG21 ILE 316 1HG2 ILE 316 -9.603 -6.190 -2.311
140 HG22 ILE 316 2HG2 ILE 316 -10.432 -4.684 -1.921
141 HG23 ILE 316 3HG2 ILE 316 -8.787 -4.647 -2.555
142 HD11 ILE 316 3HD1 ILE 316 -9.291 -8.591 -0.626
143 HD12 ILE 316 1HD1 ILE 316 -9.856 -7.896 0.892
144 HD13 ILE 316 2HD1 ILE 316 -10.464 -7.275 -0.643
145 H LYS 317 HN LYS 317 -8.473 -2.508 1.343
146 HA LYS 317 HA LYS 317 -9.451 -0.628 -0.680
147 HB2 LYS 317 3HB LYS 317 -10.574 0.514 1.168
148 HB3 LYS 317 2HB LYS 317 -10.992 -1.207 1.138
149 HG2 LYS 317 3HG LYS 317 -9.164 -1.533 2.881
150 HG3 LYS 317 2HG LYS 317 -9.178 0.232 3.046
151 HD2 LYS 317 3HD LYS 317 -10.667 -0.397 4.700
152 HD3 LYS 317 2HD LYS 317 -11.749 -0.082 3.333
153 HE2 LYS 317 3HE LYS 317 -12.527 -2.123 4.138
154 HE3 LYS 317 2HE LYS 317 -11.460 -2.592 2.807
155 HZ1 LYS 317 3HZ LYS 317 -11.110 -2.961 5.678
156 HZ2 LYS 317 1HZ LYS 317 -9.716 -2.622 4.780
157 HZ3 LYS 317 2HZ LYS 317 -10.664 -3.968 4.394
158 H CYS 318 HN CYS 318 -6.582 -1.099 -0.020
159 HA CYS 318 HA CYS 318 -5.718 1.303 1.330
160 HB2 CYS 318 3HB CYS 318 -4.492 -0.862 1.501
161 HB3 CYS 318 2HB CYS 318 -4.074 -0.718 -0.207
162 H ARG 319 HN ARG 319 -4.610 3.036 0.403
163 HA ARG 319 HA ARG 319 -5.258 3.488 -2.412
164 HB2 ARG 319 3HB ARG 319 -4.168 5.465 -0.399
165 HB3 ARG 319 2HB ARG 319 -4.896 5.826 -1.971
166 HG2 ARG 319 3HG ARG 319 -6.383 4.530 0.314
167 HG3 ARG 319 2HG ARG 319 -6.377 6.271 -0.022
168 HD2 ARG 319 3HD ARG 319 -7.227 4.191 -2.044
169 HD3 ARG 319 2HD ARG 319 -8.347 4.996 -0.937
170 HE ARG 319 HE ARG 319 -6.956 7.010 -2.219
171 HH11 ARG 319 2HH1 ARG 319 -9.079 4.398 -3.109
172 HH12 ARG 319 1HH1 ARG 319 -9.716 5.216 -4.498
173 HH21 ARG 319 2HH2 ARG 319 -7.786 8.097 -4.044
174 HH22 ARG 319 1HH2 ARG 319 -8.980 7.319 -5.028
175 H PHE 320 HN PHE 320 -3.079 1.720 -1.650
176 HA PHE 320 HA PHE 320 -0.986 2.986 -3.222
177 HB2 PHE 320 3HB PHE 320 -0.769 2.393 -0.332
178 HB3 PHE 320 2HB PHE 320 0.584 1.839 -1.320
179 HD1 PHE 320 1HD PHE 320 -1.304 4.806 -0.248
180 HD2 PHE 320 2HD PHE 320 2.133 3.357 -2.298
181 HE1 PHE 320 1HE PHE 320 -0.353 7.075 -0.253
182 HE2 PHE 320 2HE PHE 320 3.090 5.624 -2.306
183 HZ PHE 320 HZ PHE 320 1.846 7.486 -1.281
184 H PHE 321 HN PHE 321 0.882 1.312 -3.512
185 HA PHE 321 HA PHE 321 -0.384 -1.134 -4.430
186 HB2 PHE 321 3HB PHE 321 1.142 0.103 -5.924
187 HB3 PHE 321 2HB PHE 321 2.458 -0.156 -4.776
188 HD1 PHE 321 2HD PHE 321 -0.107 -2.234 -6.524
189 HD2 PHE 321 1HD PHE 321 3.943 -1.817 -5.285
190 HE1 PHE 321 2HE PHE 321 0.440 -4.374 -7.605
191 HE2 PHE 321 1HE PHE 321 4.497 -3.958 -6.366
192 HZ PHE 321 HZ PHE 321 2.744 -5.240 -7.527
193 H HIS 322 HN HIS 322 -0.311 -3.007 -3.384
194 HA HIS 322 HA HIS 322 1.398 -3.233 -1.024
195 HB2 HIS 322 3HB HIS 322 -1.105 -4.565 -1.967
196 HB3 HIS 322 2HB HIS 322 -0.051 -5.455 -0.865
197 HD1 HIS 322 1HD HIS 322 0.005 -4.746 1.575
198 HD2 HIS 322 2HD HIS 322 -2.276 -2.226 -0.814
199 HE1 HIS 322 1HE HIS 322 -1.236 -3.249 3.170
200 HE2 HIS 322 2HE HIS 322 -2.631 -1.709 1.711
201 HA PRO 323 HA PRO 323 4.243 -6.067 -2.791
202 HB2 PRO 323 3HB PRO 323 4.778 -7.711 -0.667
203 HB3 PRO 323 2HB PRO 323 5.346 -6.045 -0.775
204 HG2 PRO 323 3HG PRO 323 2.947 -7.149 0.651
205 HG3 PRO 323 2HG PRO 323 4.172 -5.959 1.232
206 HD2 PRO 323 3HD PRO 323 1.716 -5.218 0.344
207 HD3 PRO 323 2HD PRO 323 3.160 -4.221 0.106
208 H GLU 324 HN GLU 324 1.503 -7.477 -1.063
209 HA GLU 324 HA GLU 324 1.715 -9.883 -2.740
210 HB2 GLU 324 3HB GLU 324 0.071 -9.472 -0.231
211 HB3 GLU 324 2HB GLU 324 0.309 -10.995 -1.103
212 HG2 GLU 324 3HG GLU 324 2.555 -11.167 -0.444
213 HG3 GLU 324 2HG GLU 324 2.609 -9.475 0.072
214 HE2 GLU 324 HE GLU 324 2.083 -11.809 2.915
215 H ARG 325 HN ARG 325 -0.274 -7.145 -1.976
216 HA ARG 325 HA ARG 325 -2.333 -8.131 -3.840
217 HB2 ARG 325 3HB ARG 325 -2.493 -6.437 -1.371
218 HB3 ARG 325 2HB ARG 325 -3.710 -6.248 -2.642
219 HG2 ARG 325 3HG ARG 325 -3.128 -9.002 -1.679
220 HG3 ARG 325 2HG ARG 325 -4.048 -7.916 -0.625
221 HD2 ARG 325 3HD ARG 325 -5.730 -8.956 -1.841
222 HD3 ARG 325 2HD ARG 325 -5.470 -7.455 -2.740
223 HE ARG 325 HE ARG 325 -3.851 -9.569 -3.748
224 HH11 ARG 325 2HH1 ARG 325 -7.086 -8.281 -3.758
225 HH12 ARG 325 1HH1 ARG 325 -7.490 -8.958 -5.300
226 HH21 ARG 325 2HH2 ARG 325 -4.372 -10.465 -5.780
227 HH22 ARG 325 1HH2 ARG 325 -5.947 -10.202 -6.450
228 HA PRO 326 HA PRO 326 -1.545 -4.813 -6.599
229 HB2 PRO 326 3HB PRO 326 -4.062 -4.172 -7.468
230 HB3 PRO 326 2HB PRO 326 -3.221 -5.652 -7.928
231 HG2 PRO 326 3HG PRO 326 -5.269 -5.217 -5.780
232 HG3 PRO 326 2HG PRO 326 -5.157 -6.542 -6.998
233 HD2 PRO 326 3HD PRO 326 -4.375 -6.854 -4.417
234 HD3 PRO 326 2HD PRO 326 -3.570 -7.672 -5.767
235 H SER 327 HN SER 327 -2.754 -2.556 -7.233
236 HA SER 327 HA SER 327 -2.812 -1.048 -4.710
237 HB2 SER 327 1HB SER 327 -1.036 -0.480 -6.389
238 HB3 SER 327 2HB SER 327 -2.324 0.019 -7.499
239 HG SER 327 HG SER 327 -1.279 1.675 -6.060
Start of MODEL 8
1 H1 SER 299 HN SER 299 9.601 12.919 -1.598
2 HA SER 299 HA SER 299 8.155 11.045 0.155
3 HB2 SER 299 1HB SER 299 6.032 12.066 -0.778
4 HB3 SER 299 2HB SER 299 6.968 13.115 0.300
5 HG SER 299 HG SER 299 6.361 14.267 -1.542
6 H GLU 300 HN GLU 300 7.171 9.312 -0.806
7 HA GLU 300 HA GLU 300 7.636 9.002 -3.700
8 HB2 GLU 300 3HB GLU 300 7.441 6.765 -1.675
9 HB3 GLU 300 2HB GLU 300 7.963 6.653 -3.363
10 HG2 GLU 300 3HG GLU 300 10.001 6.619 -2.375
11 HG3 GLU 300 2HG GLU 300 9.796 8.369 -2.530
12 HE2 GLU 300 HE GLU 300 9.079 6.999 1.128
13 H HIS 301 HN HIS 301 5.676 9.620 -4.495
14 HA HIS 301 HA HIS 301 3.206 8.723 -3.326
15 HB2 HIS 301 3HB HIS 301 3.237 10.892 -4.364
16 HB3 HIS 301 2HB HIS 301 3.827 10.211 -5.883
17 HD1 HIS 301 1HD HIS 301 1.204 8.140 -4.438
18 HD2 HIS 301 2HD HIS 301 1.400 11.459 -6.930
19 HE1 HIS 301 1HE HIS 301 -1.050 8.284 -5.544
20 HE2 HIS 301 2HE HIS 301 -0.931 10.312 -7.067
21 H ARG 302 HN ARG 302 4.947 8.063 -6.359
22 HA ARG 302 HA ARG 302 3.544 5.484 -6.497
23 HB2 ARG 302 3HB ARG 302 3.414 5.704 -8.953
24 HB3 ARG 302 2HB ARG 302 2.476 6.946 -8.112
25 HG2 ARG 302 3HG ARG 302 3.795 8.650 -8.821
26 HG3 ARG 302 2HG ARG 302 5.254 7.643 -8.842
27 HD2 ARG 302 3HD ARG 302 4.845 6.823 -10.954
28 HD3 ARG 302 2HD ARG 302 3.095 7.040 -10.799
29 HE ARG 302 HE ARG 302 4.346 9.561 -10.803
30 HH11 ARG 302 2HH1 ARG 302 3.632 6.897 -12.927
31 HH12 ARG 302 1HH1 ARG 302 3.579 7.879 -14.353
32 HH21 ARG 302 2HH2 ARG 302 4.279 10.864 -12.674
33 HH22 ARG 302 1HH2 ARG 302 3.947 10.135 -14.208
34 H LYS 303 HN LYS 303 6.128 6.027 -5.437
35 HA LYS 303 HA LYS 303 7.828 4.671 -7.426
36 HB2 LYS 303 3HB LYS 303 8.679 6.566 -5.224
37 HB3 LYS 303 2HB LYS 303 9.768 5.731 -6.343
38 HG2 LYS 303 3HG LYS 303 8.305 6.924 -8.173
39 HG3 LYS 303 2HG LYS 303 7.945 8.030 -6.835
40 HD2 LYS 303 3HD LYS 303 10.458 8.192 -6.468
41 HD3 LYS 303 2HD LYS 303 10.628 7.376 -8.032
42 HE2 LYS 303 3HE LYS 303 10.773 9.659 -8.558
43 HE3 LYS 303 2HE LYS 303 9.108 9.210 -8.961
44 HZ1 LYS 303 3HZ LYS 303 10.093 10.972 -6.873
45 HZ2 LYS 303 1HZ LYS 303 8.802 9.969 -6.434
46 HZ3 LYS 303 2HZ LYS 303 8.643 11.027 -7.744
47 H GLN 304 HN GLN 304 6.826 4.877 -4.072
48 HA GLN 304 HA GLN 304 8.207 2.328 -3.548
49 HB2 GLN 304 3HB GLN 304 7.690 4.732 -1.854
50 HB3 GLN 304 2HB GLN 304 7.717 3.145 -1.070
51 HG2 GLN 304 3HG GLN 304 9.968 3.737 -2.893
52 HG3 GLN 304 2HG GLN 304 9.890 4.673 -1.393
53 HE21 GLN 304 1HE2 GLN 304 10.700 1.706 -2.815
54 HE22 GLN 304 2HE2 GLN 304 11.106 0.849 -1.371
55 HA PRO 305 HA PRO 305 4.397 0.293 -2.795
56 HB2 PRO 305 3HB PRO 305 4.998 -1.321 -0.666
57 HB3 PRO 305 2HB PRO 305 5.611 -1.593 -2.296
58 HG2 PRO 305 3HG PRO 305 6.932 -0.239 0.032
59 HG3 PRO 305 2HG PRO 305 7.609 -1.456 -1.114
60 HD2 PRO 305 3HD PRO 305 8.130 1.201 -1.321
61 HD3 PRO 305 2HD PRO 305 7.994 0.139 -2.733
62 H CYS 306 HN CYS 306 3.003 -0.477 -0.735
63 HA CYS 306 HA CYS 306 1.808 1.770 0.328
64 HB2 CYS 306 3HB CYS 306 1.609 -1.091 0.674
65 HB3 CYS 306 2HB CYS 306 1.408 -0.274 2.225
66 HA PRO 307 HA PRO 307 4.236 3.195 3.693
67 HB2 PRO 307 3HB PRO 307 2.325 3.929 5.512
68 HB3 PRO 307 2HB PRO 307 2.643 4.817 4.023
69 HG2 PRO 307 3HG PRO 307 0.537 2.761 4.597
70 HG3 PRO 307 2HG PRO 307 0.381 4.349 3.756
71 HD2 PRO 307 3HD PRO 307 0.513 1.989 2.420
72 HD3 PRO 307 2HD PRO 307 1.200 3.492 1.779
73 H TYR 308 HN TYR 308 1.756 0.808 4.463
74 HA TYR 308 HA TYR 308 3.463 -0.164 6.661
75 HB2 TYR 308 3HB TYR 308 0.451 -0.170 6.396
76 HB3 TYR 308 2HB TYR 308 1.314 -1.121 7.607
77 HD1 TYR 308 1HD TYR 308 3.238 0.432 8.845
78 HD2 TYR 308 2HD TYR 308 -0.475 1.767 7.254
79 HE1 TYR 308 1HE TYR 308 3.285 2.362 10.370
80 HE2 TYR 308 2HE TYR 308 -0.438 3.700 8.773
81 HH TYR 308 HH TYR 308 1.432 3.919 11.424
82 H GLY 309 HN GLY 309 1.188 -1.113 4.109
83 HA2 GLY 309 2HA GLY 309 1.159 -2.981 2.765
84 HA3 GLY 309 3HA GLY 309 2.760 -3.371 3.377
85 H LYS 310 HN LYS 310 2.992 -4.853 5.002
86 HA LYS 310 HA LYS 310 0.887 -6.720 5.358
87 HB2 LYS 310 3HB LYS 310 2.447 -7.766 7.030
88 HB3 LYS 310 2HB LYS 310 3.131 -7.532 5.413
89 HG2 LYS 310 3HG LYS 310 4.396 -5.635 6.128
90 HG3 LYS 310 2HG LYS 310 3.583 -5.635 7.705
91 HD2 LYS 310 3HD LYS 310 4.534 -7.926 8.109
92 HD3 LYS 310 2HD LYS 310 5.485 -7.714 6.627
93 HE2 LYS 310 3HE LYS 310 5.579 -5.755 8.926
94 HE3 LYS 310 2HE LYS 310 6.656 -7.153 8.802
95 HZ1 LYS 310 3HZ LYS 310 6.604 -5.665 6.374
96 HZ2 LYS 310 1HZ LYS 310 7.925 -6.095 7.340
97 HZ3 LYS 310 2HZ LYS 310 7.052 -4.686 7.678
98 H LYS 311 HN LYS 311 2.128 -4.063 7.280
99 HA LYS 311 HA LYS 311 0.511 -4.737 9.580
100 HB2 LYS 311 3HB LYS 311 2.212 -2.317 8.938
101 HB3 LYS 311 2HB LYS 311 1.372 -2.569 10.477
102 HG2 LYS 311 3HG LYS 311 2.753 -4.336 11.103
103 HG3 LYS 311 2HG LYS 311 3.304 -4.605 9.440
104 HD2 LYS 311 3HD LYS 311 4.787 -2.834 9.485
105 HD3 LYS 311 2HD LYS 311 3.883 -1.987 10.752
106 HE2 LYS 311 3HE LYS 311 5.250 -4.612 11.308
107 HE3 LYS 311 2HE LYS 311 6.131 -3.078 11.374
108 HZ1 LYS 311 3HZ LYS 311 3.619 -3.453 12.881
109 HZ2 LYS 311 1HZ LYS 311 4.852 -2.324 13.144
110 HZ3 LYS 311 2HZ LYS 311 5.104 -3.954 13.518
111 H CYS 312 HN CYS 312 0.152 -2.941 6.687
112 HA CYS 312 HA CYS 312 -1.596 -0.917 7.360
113 HB2 CYS 312 3HB CYS 312 -0.584 -1.712 5.052
114 HB3 CYS 312 2HB CYS 312 -2.141 -2.528 4.900
115 H THR 313 HN THR 313 -3.795 -0.732 7.643
116 HA THR 313 HA THR 313 -5.137 -3.132 8.566
117 HB THR 313 HB THR 313 -7.000 -1.471 9.126
118 HG1 THR 313 1HG THR 313 -6.217 0.735 9.211
119 HG21 THR 313 3HG2 THR 313 -5.238 -0.330 10.862
120 HG22 THR 313 1HG2 THR 313 -4.345 -1.761 10.350
121 HG23 THR 313 2HG2 THR 313 -5.948 -1.931 11.065
122 H TYR 314 HN TYR 314 -5.402 -0.793 5.954
123 HA TYR 314 HA TYR 314 -7.910 -1.494 4.957
124 HB2 TYR 314 3HB TYR 314 -5.543 -0.692 3.253
125 HB3 TYR 314 2HB TYR 314 -7.255 -0.423 2.917
126 HD1 TYR 314 2HD TYR 314 -8.249 0.638 5.468
127 HD2 TYR 314 1HD TYR 314 -4.622 1.455 3.398
128 HE1 TYR 314 2HE TYR 314 -8.143 2.849 6.538
129 HE2 TYR 314 1HE TYR 314 -4.506 3.668 4.465
130 HH TYR 314 HH TYR 314 -5.435 4.706 6.657
131 H GLY 315 HN GLY 315 -4.719 -2.643 3.833
132 HA2 GLY 315 2HA GLY 315 -4.094 -4.702 3.005
133 HA3 GLY 315 3HA GLY 315 -5.658 -5.324 3.513
134 H ILE 316 HN ILE 316 -7.512 -4.853 2.105
135 HA ILE 316 HA ILE 316 -6.696 -5.027 -0.698
136 HB ILE 316 HB ILE 316 -9.437 -5.526 0.458
137 HG12 ILE 316 1HG1 ILE 316 -7.221 -7.494 -0.167
138 HG13 ILE 316 2HG1 ILE 316 -7.792 -7.059 1.452
139 HG21 ILE 316 1HG2 ILE 316 -9.819 -6.735 -1.633
140 HG22 ILE 316 2HG2 ILE 316 -9.409 -5.046 -1.930
141 HG23 ILE 316 3HG2 ILE 316 -8.199 -6.304 -2.178
142 HD11 ILE 316 3HD1 ILE 316 -8.796 -9.051 -0.332
143 HD12 ILE 316 1HD1 ILE 316 -9.235 -8.725 1.345
144 HD13 ILE 316 2HD1 ILE 316 -10.064 -7.881 0.037
145 H LYS 317 HN LYS 317 -8.338 -2.950 1.525
146 HA LYS 317 HA LYS 317 -9.387 -1.288 -0.646
147 HB2 LYS 317 3HB LYS 317 -10.608 -0.083 1.098
148 HB3 LYS 317 2HB LYS 317 -10.927 -1.823 1.183
149 HG2 LYS 317 3HG LYS 317 -9.120 -1.921 2.975
150 HG3 LYS 317 2HG LYS 317 -9.234 -0.153 3.012
151 HD2 LYS 317 3HD LYS 317 -11.838 -0.712 3.209
152 HD3 LYS 317 2HD LYS 317 -11.184 -2.201 3.913
153 HE2 LYS 317 3HE LYS 317 -11.506 -0.735 5.739
154 HE3 LYS 317 2HE LYS 317 -9.768 -0.719 5.405
155 HZ1 LYS 317 3HZ LYS 317 -10.930 1.501 5.782
156 HZ2 LYS 317 1HZ LYS 317 -11.560 1.308 4.223
157 HZ3 LYS 317 2HZ LYS 317 -9.886 1.384 4.456
158 H CYS 318 HN CYS 318 -6.536 -1.473 -0.122
159 HA CYS 318 HA CYS 318 -5.852 1.083 1.096
160 HB2 CYS 318 3HB CYS 318 -4.491 -0.917 1.595
161 HB3 CYS 318 2HB CYS 318 -4.067 -1.039 -0.115
162 H ARG 319 HN ARG 319 -4.997 2.820 0.017
163 HA ARG 319 HA ARG 319 -5.655 3.040 -2.768
164 HB2 ARG 319 3HB ARG 319 -5.704 4.838 -0.832
165 HB3 ARG 319 2HB ARG 319 -4.033 5.108 -1.351
166 HG2 ARG 319 3HG ARG 319 -6.186 5.071 -3.416
167 HG3 ARG 319 2HG ARG 319 -6.003 6.495 -2.377
168 HD2 ARG 319 3HD ARG 319 -3.561 5.364 -3.673
169 HD3 ARG 319 2HD ARG 319 -4.703 6.282 -4.666
170 HE ARG 319 HE ARG 319 -2.892 7.337 -2.738
171 HH11 ARG 319 2HH1 ARG 319 -6.020 7.814 -4.188
172 HH12 ARG 319 1HH1 ARG 319 -6.038 9.522 -3.899
173 HH21 ARG 319 2HH2 ARG 319 -2.904 9.585 -2.351
174 HH22 ARG 319 1HH2 ARG 319 -4.266 10.528 -2.854
175 H PHE 320 HN PHE 320 -2.676 2.922 -0.865
176 HA PHE 320 HA PHE 320 -0.937 3.300 -3.090
177 HB2 PHE 320 3HB PHE 320 -0.656 2.621 -0.217
178 HB3 PHE 320 2HB PHE 320 0.652 2.081 -1.271
179 HD1 PHE 320 1HD PHE 320 -1.190 5.061 -0.118
180 HD2 PHE 320 2HD PHE 320 2.243 3.582 -2.152
181 HE1 PHE 320 1HE PHE 320 -0.198 7.313 -0.072
182 HE2 PHE 320 2HE PHE 320 3.242 5.830 -2.109
183 HZ PHE 320 HZ PHE 320 2.022 7.699 -1.068
184 H PHE 321 HN PHE 321 0.842 1.543 -3.449
185 HA PHE 321 HA PHE 321 -0.568 -0.837 -4.345
186 HB2 PHE 321 3HB PHE 321 1.050 0.498 -5.790
187 HB3 PHE 321 2HB PHE 321 2.341 -0.170 -4.789
188 HD1 PHE 321 2HD PHE 321 -0.572 -1.301 -6.818
189 HD2 PHE 321 1HD PHE 321 3.357 -2.138 -5.411
190 HE1 PHE 321 2HE PHE 321 -0.506 -3.325 -8.215
191 HE2 PHE 321 1HE PHE 321 3.429 -4.163 -6.807
192 HZ PHE 321 HZ PHE 321 1.495 -4.760 -8.210
193 H HIS 322 HN HIS 322 -0.464 -2.762 -3.388
194 HA HIS 322 HA HIS 322 1.298 -3.065 -1.072
195 HB2 HIS 322 3HB HIS 322 -1.252 -4.348 -1.970
196 HB3 HIS 322 2HB HIS 322 -0.186 -5.248 -0.887
197 HD1 HIS 322 1HD HIS 322 -0.097 -4.552 1.551
198 HD2 HIS 322 2HD HIS 322 -2.355 -1.978 -0.802
199 HE1 HIS 322 1HE HIS 322 -1.289 -3.035 3.165
200 HE2 HIS 322 2HE HIS 322 -2.670 -1.462 1.729
201 HA PRO 323 HA PRO 323 4.026 -5.921 -2.983
202 HB2 PRO 323 3HB PRO 323 4.590 -7.617 -0.908
203 HB3 PRO 323 2HB PRO 323 5.190 -5.963 -1.002
204 HG2 PRO 323 3HG PRO 323 2.815 -7.043 0.478
205 HG3 PRO 323 2HG PRO 323 4.083 -5.891 1.041
206 HD2 PRO 323 3HD PRO 323 1.616 -5.082 0.246
207 HD3 PRO 323 2HD PRO 323 3.074 -4.110 -0.019
208 H GLU 324 HN GLU 324 1.306 -7.303 -1.200
209 HA GLU 324 HA GLU 324 1.416 -9.683 -2.925
210 HB2 GLU 324 3HB GLU 324 -0.266 -9.356 -0.440
211 HB3 GLU 324 2HB GLU 324 0.177 -10.855 -1.272
212 HG2 GLU 324 3HG GLU 324 2.626 -10.070 -0.679
213 HG3 GLU 324 2HG GLU 324 1.772 -9.178 0.589
214 HE2 GLU 324 HE GLU 324 1.028 -12.076 2.337
215 H ARG 325 HN ARG 325 -0.487 -6.916 -2.059
216 HA ARG 325 HA ARG 325 -2.629 -7.829 -3.863
217 HB2 ARG 325 3HB ARG 325 -2.671 -6.030 -1.447
218 HB3 ARG 325 2HB ARG 325 -3.973 -5.997 -2.646
219 HG2 ARG 325 3HG ARG 325 -3.253 -8.675 -1.644
220 HG3 ARG 325 2HG ARG 325 -3.973 -7.571 -0.461
221 HD2 ARG 325 3HD ARG 325 -5.960 -7.343 -1.683
222 HD3 ARG 325 2HD ARG 325 -5.206 -7.943 -3.167
223 HE ARG 325 HE ARG 325 -6.379 -9.512 -1.071
224 HH11 ARG 325 2HH1 ARG 325 -4.044 -9.496 -3.652
225 HH12 ARG 325 1HH1 ARG 325 -4.083 -11.215 -3.874
226 HH21 ARG 325 2HH2 ARG 325 -6.439 -11.775 -1.353
227 HH22 ARG 325 1HH2 ARG 325 -5.446 -12.509 -2.566
228 HA PRO 326 HA PRO 326 -1.797 -4.546 -6.653
229 HB2 PRO 326 3HB PRO 326 -4.313 -3.882 -7.506
230 HB3 PRO 326 2HB PRO 326 -3.492 -5.374 -7.964
231 HG2 PRO 326 3HG PRO 326 -5.518 -4.905 -5.803
232 HG3 PRO 326 2HG PRO 326 -5.431 -6.238 -7.013
233 HD2 PRO 326 3HD PRO 326 -4.632 -6.545 -4.437
234 HD3 PRO 326 2HD PRO 326 -3.846 -7.379 -5.788
235 H SER 327 HN SER 327 -2.942 -2.273 -7.288
236 HA SER 327 HA SER 327 -2.321 -0.499 -5.244
237 HB2 SER 327 1HB SER 327 -2.694 -0.143 -7.831
238 HB3 SER 327 2HB SER 327 -4.336 0.282 -7.318
239 HG SER 327 HG SER 327 -3.615 2.104 -6.565
Start of MODEL 9
1 H1 SER 299 HN SER 299 8.230 13.635 -3.931
2 HA SER 299 HA SER 299 6.159 12.208 -2.580
3 HB2 SER 299 1HB SER 299 6.072 12.834 -5.522
4 HB3 SER 299 2HB SER 299 4.760 12.862 -4.330
5 HG SER 299 HG SER 299 5.324 14.822 -3.715
6 H GLU 300 HN GLU 300 6.138 10.073 -2.385
7 HA GLU 300 HA GLU 300 6.977 8.450 -4.698
8 HB2 GLU 300 3HB GLU 300 7.537 6.679 -2.935
9 HB3 GLU 300 2HB GLU 300 8.642 8.054 -3.088
10 HG2 GLU 300 3HG GLU 300 8.309 7.590 -0.764
11 HG3 GLU 300 2HG GLU 300 7.523 9.124 -1.166
12 HE2 GLU 300 HE GLU 300 5.157 6.043 -0.317
13 H HIS 301 HN HIS 301 4.344 9.384 -4.273
14 HA HIS 301 HA HIS 301 2.624 7.680 -2.925
15 HB2 HIS 301 3HB HIS 301 2.321 9.392 -5.374
16 HB3 HIS 301 2HB HIS 301 0.991 8.356 -4.852
17 HD1 HIS 301 1HD HIS 301 -0.483 10.402 -4.270
18 HD2 HIS 301 2HD HIS 301 3.050 10.173 -2.095
19 HE1 HIS 301 1HE HIS 301 -0.743 12.052 -2.390
20 HE2 HIS 301 2HE HIS 301 1.416 11.914 -1.061
21 H ARG 302 HN ARG 302 4.017 7.364 -6.154
22 HA ARG 302 HA ARG 302 2.904 4.638 -6.291
23 HB2 ARG 302 3HB ARG 302 2.997 4.807 -8.721
24 HB3 ARG 302 2HB ARG 302 2.019 6.116 -8.040
25 HG2 ARG 302 3HG ARG 302 4.906 6.641 -8.554
26 HG3 ARG 302 2HG ARG 302 3.794 6.564 -9.930
27 HD2 ARG 302 3HD ARG 302 2.898 8.183 -7.614
28 HD3 ARG 302 2HD ARG 302 4.270 8.812 -8.537
29 HE ARG 302 HE ARG 302 1.549 8.772 -9.356
30 HH11 ARG 302 2HH1 ARG 302 4.811 8.504 -10.542
31 HH12 ARG 302 1HH1 ARG 302 4.420 9.076 -12.130
32 HH21 ARG 302 2HH2 ARG 302 1.021 9.526 -11.443
33 HH22 ARG 302 1HH2 ARG 302 2.264 9.658 -12.642
34 H LYS 303 HN LYS 303 5.720 6.525 -6.115
35 HA LYS 303 HA LYS 303 7.546 4.851 -7.484
36 HB2 LYS 303 3HB LYS 303 8.078 6.713 -5.155
37 HB3 LYS 303 2HB LYS 303 9.282 6.079 -6.288
38 HG2 LYS 303 3HG LYS 303 7.704 7.231 -8.073
39 HG3 LYS 303 2HG LYS 303 7.263 8.220 -6.669
40 HD2 LYS 303 3HD LYS 303 9.591 8.818 -6.303
41 HD3 LYS 303 2HD LYS 303 10.085 7.761 -7.639
42 HE2 LYS 303 3HE LYS 303 10.070 9.953 -8.534
43 HE3 LYS 303 2HE LYS 303 8.602 9.166 -9.133
44 HZ1 LYS 303 3HZ LYS 303 8.081 11.371 -8.388
45 HZ2 LYS 303 1HZ LYS 303 8.772 11.081 -6.870
46 HZ3 LYS 303 2HZ LYS 303 7.365 10.263 -7.329
47 H GLN 304 HN GLN 304 6.793 5.157 -4.013
48 HA GLN 304 HA GLN 304 8.146 2.597 -3.548
49 HB2 GLN 304 3HB GLN 304 7.516 4.974 -1.861
50 HB3 GLN 304 2HB GLN 304 7.597 3.392 -1.068
51 HG2 GLN 304 3HG GLN 304 9.873 3.352 -2.562
52 HG3 GLN 304 2HG GLN 304 9.738 5.068 -2.150
53 HE21 GLN 304 1HE2 GLN 304 11.221 5.344 -0.616
54 HE22 GLN 304 2HE2 GLN 304 11.312 4.448 0.857
55 HA PRO 305 HA PRO 305 4.449 0.359 -2.797
56 HB2 PRO 305 3HB PRO 305 5.135 -1.223 -0.669
57 HB3 PRO 305 2HB PRO 305 5.762 -1.460 -2.301
58 HG2 PRO 305 3HG PRO 305 7.009 -0.040 0.028
59 HG3 PRO 305 2HG PRO 305 7.750 -1.218 -1.119
60 HD2 PRO 305 3HD PRO 305 8.129 1.462 -1.322
61 HD3 PRO 305 2HD PRO 305 8.050 0.398 -2.735
62 H CYS 306 HN CYS 306 3.095 -0.484 -0.742
63 HA CYS 306 HA CYS 306 1.783 1.694 0.326
64 HB2 CYS 306 3HB CYS 306 1.734 -1.173 0.663
65 HB3 CYS 306 2HB CYS 306 1.495 -0.374 2.219
66 HA PRO 307 HA PRO 307 4.136 3.241 3.691
67 HB2 PRO 307 3HB PRO 307 2.189 3.877 5.509
68 HB3 PRO 307 2HB PRO 307 2.462 4.780 4.020
69 HG2 PRO 307 3HG PRO 307 0.462 2.620 4.592
70 HG3 PRO 307 2HG PRO 307 0.227 4.198 3.751
71 HD2 PRO 307 3HD PRO 307 0.479 1.848 2.414
72 HD3 PRO 307 2HD PRO 307 1.090 3.384 1.775
73 H TYR 308 HN TYR 308 1.762 0.749 4.481
74 HA TYR 308 HA TYR 308 3.529 -0.152 6.661
75 HB2 TYR 308 3HB TYR 308 0.519 -0.181 6.436
76 HB3 TYR 308 2HB TYR 308 1.378 -1.222 7.573
77 HD1 TYR 308 2HD TYR 308 3.007 -0.071 9.227
78 HD2 TYR 308 1HD TYR 308 -0.037 1.997 7.091
79 HE1 TYR 308 2HE TYR 308 3.096 1.752 10.876
80 HE2 TYR 308 1HE TYR 308 0.044 3.825 8.734
81 HH TYR 308 HH TYR 308 1.321 3.599 11.677
82 H GLY 309 HN GLY 309 1.260 -1.190 4.140
83 HA2 GLY 309 2HA GLY 309 1.303 -3.055 2.788
84 HA3 GLY 309 3HA GLY 309 2.909 -3.401 3.413
85 H LYS 310 HN LYS 310 3.166 -4.955 4.934
86 HA LYS 310 HA LYS 310 1.097 -6.837 5.316
87 HB2 LYS 310 3HB LYS 310 2.683 -7.857 6.989
88 HB3 LYS 310 2HB LYS 310 3.347 -7.617 5.364
89 HG2 LYS 310 3HG LYS 310 4.624 -5.739 6.049
90 HG3 LYS 310 2HG LYS 310 3.784 -5.667 7.608
91 HD2 LYS 310 3HD LYS 310 4.994 -7.372 8.510
92 HD3 LYS 310 2HD LYS 310 5.160 -8.208 6.956
93 HE2 LYS 310 3HE LYS 310 7.336 -7.450 7.539
94 HE3 LYS 310 2HE LYS 310 6.746 -6.376 6.261
95 HZ1 LYS 310 3HZ LYS 310 6.325 -5.625 9.072
96 HZ2 LYS 310 1HZ LYS 310 6.486 -4.634 7.710
97 HZ3 LYS 310 2HZ LYS 310 7.847 -5.389 8.373
98 H LYS 311 HN LYS 311 2.308 -4.185 7.270
99 HA LYS 311 HA LYS 311 0.692 -4.903 9.557
100 HB2 LYS 311 3HB LYS 311 2.457 -2.536 8.919
101 HB3 LYS 311 2HB LYS 311 1.505 -2.646 10.409
102 HG2 LYS 311 3HG LYS 311 2.727 -4.508 11.189
103 HG3 LYS 311 2HG LYS 311 3.474 -4.765 9.603
104 HD2 LYS 311 3HD LYS 311 4.991 -3.072 9.871
105 HD3 LYS 311 2HD LYS 311 3.912 -2.138 10.924
106 HE2 LYS 311 3HE LYS 311 5.978 -3.184 12.010
107 HE3 LYS 311 2HE LYS 311 4.416 -3.449 12.802
108 HZ1 LYS 311 3HZ LYS 311 5.381 -5.425 10.852
109 HZ2 LYS 311 1HZ LYS 311 4.369 -5.643 12.191
110 HZ3 LYS 311 2HZ LYS 311 6.031 -5.425 12.414
111 H CYS 312 HN CYS 312 0.280 -3.141 6.670
112 HA CYS 312 HA CYS 312 -1.459 -1.107 7.337
113 HB2 CYS 312 3HB CYS 312 -0.490 -1.929 5.026
114 HB3 CYS 312 2HB CYS 312 -2.034 -2.776 4.920
115 H THR 313 HN THR 313 -3.800 -0.971 7.153
116 HA THR 313 HA THR 313 -5.104 -3.413 8.162
117 HB THR 313 HB THR 313 -6.822 -1.852 9.120
118 HG1 THR 313 1HG THR 313 -6.541 0.032 8.024
119 HG21 THR 313 3HG2 THR 313 -5.682 -1.999 11.032
120 HG22 THR 313 1HG2 THR 313 -4.482 -0.836 10.474
121 HG23 THR 313 2HG2 THR 313 -4.296 -2.547 10.090
122 H TYR 314 HN TYR 314 -5.244 -0.854 5.797
123 HA TYR 314 HA TYR 314 -7.864 -1.177 4.881
124 HB2 TYR 314 3HB TYR 314 -5.496 -0.493 3.131
125 HB3 TYR 314 2HB TYR 314 -7.179 -0.007 2.910
126 HD1 TYR 314 1HD TYR 314 -8.093 1.125 5.312
127 HD2 TYR 314 2HD TYR 314 -4.169 1.321 3.679
128 HE1 TYR 314 1HE TYR 314 -7.686 3.207 6.557
129 HE2 TYR 314 2HE TYR 314 -3.751 3.403 4.919
130 HH TYR 314 HH TYR 314 -5.063 5.244 5.920
131 H GLY 315 HN GLY 315 -4.871 -2.554 3.500
132 HA2 GLY 315 2HA GLY 315 -4.512 -4.589 2.477
133 HA3 GLY 315 3HA GLY 315 -6.109 -5.086 3.016
134 H ILE 316 HN ILE 316 -7.964 -4.301 1.755
135 HA ILE 316 HA ILE 316 -7.297 -4.308 -1.096
136 HB ILE 316 HB ILE 316 -9.979 -4.705 0.235
137 HG12 ILE 316 1HG1 ILE 316 -8.143 -6.753 -1.032
138 HG13 ILE 316 2HG1 ILE 316 -8.284 -6.486 0.714
139 HG21 ILE 316 1HG2 ILE 316 -9.139 -4.383 -2.540
140 HG22 ILE 316 2HG2 ILE 316 -10.093 -5.838 -2.259
141 HG23 ILE 316 3HG2 ILE 316 -10.743 -4.259 -1.818
142 HD11 ILE 316 3HD1 ILE 316 -9.962 -7.916 0.788
143 HD12 ILE 316 1HD1 ILE 316 -10.899 -6.865 -0.272
144 HD13 ILE 316 2HD1 ILE 316 -9.881 -8.131 -0.961
145 H LYS 317 HN LYS 317 -8.593 -2.284 1.384
146 HA LYS 317 HA LYS 317 -9.580 -0.344 -0.578
147 HB2 LYS 317 3HB LYS 317 -10.609 0.805 1.306
148 HB3 LYS 317 2HB LYS 317 -11.060 -0.908 1.307
149 HG2 LYS 317 3HG LYS 317 -9.202 -1.278 2.984
150 HG3 LYS 317 2HG LYS 317 -9.106 0.488 3.112
151 HD2 LYS 317 3HD LYS 317 -11.703 -0.997 3.487
152 HD3 LYS 317 2HD LYS 317 -10.564 -0.735 4.819
153 HE2 LYS 317 3HE LYS 317 -10.777 1.622 4.689
154 HE3 LYS 317 2HE LYS 317 -11.584 1.524 3.118
155 HZ1 LYS 317 3HZ LYS 317 -12.855 1.776 5.468
156 HZ2 LYS 317 1HZ LYS 317 -12.936 0.101 5.234
157 HZ3 LYS 317 2HZ LYS 317 -13.560 1.149 4.064
158 H CYS 318 HN CYS 318 -6.708 -0.931 -0.032
159 HA CYS 318 HA CYS 318 -5.718 1.441 1.295
160 HB2 CYS 318 3HB CYS 318 -4.618 -0.846 1.393
161 HB3 CYS 318 2HB CYS 318 -4.117 -0.579 -0.278
162 H ARG 319 HN ARG 319 -4.650 3.155 0.337
163 HA ARG 319 HA ARG 319 -5.263 3.546 -2.495
164 HB2 ARG 319 3HB ARG 319 -4.305 5.511 -0.398
165 HB3 ARG 319 2HB ARG 319 -4.762 5.918 -2.059
166 HG2 ARG 319 3HG ARG 319 -6.711 4.551 -0.237
167 HG3 ARG 319 2HG ARG 319 -6.465 6.304 -0.167
168 HD2 ARG 319 3HD ARG 319 -6.931 6.406 -2.627
169 HD3 ARG 319 2HD ARG 319 -7.345 4.688 -2.554
170 HE ARG 319 HE ARG 319 -8.920 5.823 -0.645
171 HH11 ARG 319 2HH1 ARG 319 -8.391 6.396 -4.038
172 HH12 ARG 319 1HH1 ARG 319 -10.000 6.971 -4.325
173 HH21 ARG 319 2HH2 ARG 319 -11.042 6.578 -1.010
174 HH22 ARG 319 1HH2 ARG 319 -11.506 7.074 -2.602
175 H PHE 320 HN PHE 320 -3.063 1.824 -1.587
176 HA PHE 320 HA PHE 320 -0.946 3.082 -3.153
177 HB2 PHE 320 3HB PHE 320 -0.788 2.382 -0.272
178 HB3 PHE 320 2HB PHE 320 0.596 1.920 -1.266
179 HD1 PHE 320 1HD PHE 320 -1.507 4.826 -0.333
180 HD2 PHE 320 2HD PHE 320 2.220 3.475 -1.882
181 HE1 PHE 320 1HE PHE 320 -0.628 7.122 -0.209
182 HE2 PHE 320 2HE PHE 320 3.106 5.768 -1.759
183 HZ PHE 320 HZ PHE 320 1.682 7.594 -0.922
184 H PHE 321 HN PHE 321 0.917 1.395 -3.422
185 HA PHE 321 HA PHE 321 -0.357 -1.041 -4.381
186 HB2 PHE 321 3HB PHE 321 1.165 0.273 -5.854
187 HB3 PHE 321 2HB PHE 321 2.493 -0.096 -4.751
188 HD1 PHE 321 2HD PHE 321 3.419 -2.336 -4.587
189 HD2 PHE 321 1HD PHE 321 0.293 -1.431 -7.330
190 HE1 PHE 321 2HE PHE 321 3.866 -4.439 -5.785
191 HE2 PHE 321 1HE PHE 321 0.733 -3.532 -8.531
192 HZ PHE 321 HZ PHE 321 2.522 -5.039 -7.760
193 H HIS 322 HN HIS 322 -0.256 -2.920 -3.348
194 HA HIS 322 HA HIS 322 1.470 -3.151 -1.006
195 HB2 HIS 322 3HB HIS 322 -0.994 -4.540 -1.976
196 HB3 HIS 322 2HB HIS 322 0.079 -5.406 -0.873
197 HD1 HIS 322 1HD HIS 322 0.058 -4.746 1.572
198 HD2 HIS 322 2HD HIS 322 -2.201 -2.208 -0.818
199 HE1 HIS 322 1HE HIS 322 -1.228 -3.288 3.168
200 HE2 HIS 322 2HE HIS 322 -2.609 -1.736 1.708
201 HA PRO 323 HA PRO 323 4.386 -5.885 -2.813
202 HB2 PRO 323 3HB PRO 323 4.956 -7.551 -0.715
203 HB3 PRO 323 2HB PRO 323 5.483 -5.870 -0.794
204 HG2 PRO 323 3HG PRO 323 3.112 -7.055 0.608
205 HG3 PRO 323 2HG PRO 323 4.306 -5.846 1.211
206 HD2 PRO 323 3HD PRO 323 1.834 -5.150 0.331
207 HD3 PRO 323 2HD PRO 323 3.254 -4.115 0.111
208 H GLU 324 HN GLU 324 1.673 -7.386 -1.120
209 HA GLU 324 HA GLU 324 1.949 -9.760 -2.832
210 HB2 GLU 324 3HB GLU 324 0.314 -9.410 -0.306
211 HB3 GLU 324 2HB GLU 324 0.527 -10.914 -1.216
212 HG2 GLU 324 3HG GLU 324 2.770 -11.133 -0.584
213 HG3 GLU 324 2HG GLU 324 2.866 -9.445 -0.057
214 HE2 GLU 324 HE GLU 324 1.870 -10.262 3.114
215 H ARG 325 HN ARG 325 -0.107 -7.082 -2.035
216 HA ARG 325 HA ARG 325 -2.132 -8.086 -3.926
217 HB2 ARG 325 3HB ARG 325 -2.347 -6.441 -1.429
218 HB3 ARG 325 2HB ARG 325 -3.563 -6.260 -2.703
219 HG2 ARG 325 3HG ARG 325 -2.913 -9.013 -1.778
220 HG3 ARG 325 2HG ARG 325 -3.876 -7.969 -0.721
221 HD2 ARG 325 3HD ARG 325 -4.515 -8.661 -3.598
222 HD3 ARG 325 2HD ARG 325 -5.308 -9.322 -2.161
223 HE ARG 325 HE ARG 325 -5.535 -6.551 -2.030
224 HH11 ARG 325 2HH1 ARG 325 -6.617 -9.169 -4.055
225 HH12 ARG 325 1HH1 ARG 325 -8.073 -8.365 -4.540
226 HH21 ARG 325 2HH2 ARG 325 -7.449 -5.483 -2.660
227 HH22 ARG 325 1HH2 ARG 325 -8.545 -6.268 -3.746
228 HA PRO 326 HA PRO 326 -1.412 -4.699 -6.621
229 HB2 PRO 326 3HB PRO 326 -3.939 -4.105 -7.493
230 HB3 PRO 326 2HB PRO 326 -3.060 -5.556 -7.974
231 HG2 PRO 326 3HG PRO 326 -5.129 -5.210 -5.832
232 HG3 PRO 326 2HG PRO 326 -4.978 -6.510 -7.072
233 HD2 PRO 326 3HD PRO 326 -4.202 -6.849 -4.492
234 HD3 PRO 326 2HD PRO 326 -3.371 -7.623 -5.852
235 H SER 327 HN SER 327 -2.674 -2.462 -7.221
236 HA SER 327 HA SER 327 -2.860 -1.020 -4.660
237 HB2 SER 327 1HB SER 327 -0.957 -0.405 -6.172
238 HB3 SER 327 2HB SER 327 -2.151 0.121 -7.373
239 HG SER 327 HG SER 327 -2.017 1.954 -6.346
Start of MODEL 10
1 H1 SER 299 HN SER 299 10.690 13.259 -2.853
2 HA SER 299 HA SER 299 9.982 11.050 -1.281
3 HB2 SER 299 1HB SER 299 8.965 13.443 -1.369
4 HB3 SER 299 2HB SER 299 7.925 12.775 -2.639
5 HG SER 299 HG SER 299 7.050 12.629 -0.473
6 H GLU 300 HN GLU 300 8.015 9.666 -1.697
7 HA GLU 300 HA GLU 300 7.919 8.796 -4.508
8 HB2 GLU 300 3HB GLU 300 8.210 7.132 -2.011
9 HB3 GLU 300 2HB GLU 300 7.593 6.449 -3.524
10 HG2 GLU 300 3HG GLU 300 9.850 5.915 -3.573
11 HG3 GLU 300 2HG GLU 300 9.735 7.360 -4.589
12 HE2 GLU 300 HE GLU 300 12.290 8.602 -2.655
13 H HIS 301 HN HIS 301 5.968 9.794 -4.929
14 HA HIS 301 HA HIS 301 3.702 9.563 -3.214
15 HB2 HIS 301 3HB HIS 301 3.997 10.421 -6.099
16 HB3 HIS 301 2HB HIS 301 2.460 10.458 -5.230
17 HD1 HIS 301 1HD HIS 301 1.949 12.770 -4.556
18 HD2 HIS 301 2HD HIS 301 6.003 11.933 -4.205
19 HE1 HIS 301 1HE HIS 301 2.990 14.863 -3.626
20 HE2 HIS 301 2HE HIS 301 5.468 14.351 -3.412
21 H ARG 302 HN ARG 302 4.540 8.074 -6.339
22 HA ARG 302 HA ARG 302 2.805 5.813 -5.630
23 HB2 ARG 302 3HB ARG 302 1.968 5.674 -7.915
24 HB3 ARG 302 2HB ARG 302 1.575 7.246 -7.202
25 HG2 ARG 302 3HG ARG 302 2.970 8.403 -8.590
26 HG3 ARG 302 2HG ARG 302 4.071 7.030 -8.794
27 HD2 ARG 302 3HD ARG 302 2.883 7.457 -10.873
28 HD3 ARG 302 2HD ARG 302 2.396 5.899 -10.188
29 HE ARG 302 HE ARG 302 0.666 8.043 -9.402
30 HH11 ARG 302 2HH1 ARG 302 1.371 5.745 -11.920
31 HH12 ARG 302 1HH1 ARG 302 -0.243 5.740 -12.549
32 HH21 ARG 302 2HH2 ARG 302 -1.464 8.045 -10.220
33 HH22 ARG 302 1HH2 ARG 302 -1.855 7.049 -11.581
34 H LYS 303 HN LYS 303 5.742 6.320 -5.612
35 HA LYS 303 HA LYS 303 6.646 4.411 -7.649
36 HB2 LYS 303 3HB LYS 303 8.262 6.185 -5.799
37 HB3 LYS 303 2HB LYS 303 8.910 5.168 -7.096
38 HG2 LYS 303 3HG LYS 303 7.143 6.630 -8.508
39 HG3 LYS 303 2HG LYS 303 7.572 7.786 -7.234
40 HD2 LYS 303 3HD LYS 303 9.995 7.319 -7.751
41 HD3 LYS 303 2HD LYS 303 9.433 6.405 -9.162
42 HE2 LYS 303 3HE LYS 303 8.671 9.285 -8.655
43 HE3 LYS 303 2HE LYS 303 10.094 8.805 -9.590
44 HZ1 LYS 303 3HZ LYS 303 8.785 7.860 -11.247
45 HZ2 LYS 303 1HZ LYS 303 7.952 9.278 -10.852
46 HZ3 LYS 303 2HZ LYS 303 7.405 7.788 -10.271
47 H GLN 304 HN GLN 304 6.514 4.933 -4.171
48 HA GLN 304 HA GLN 304 7.791 2.358 -3.671
49 HB2 GLN 304 3HB GLN 304 7.396 4.829 -2.177
50 HB3 GLN 304 2HB GLN 304 6.989 3.394 -1.223
51 HG2 GLN 304 3HG GLN 304 9.124 2.693 -1.085
52 HG3 GLN 304 2HG GLN 304 9.516 3.244 -2.720
53 HE21 GLN 304 1HE2 GLN 304 8.214 5.033 0.038
54 HE22 GLN 304 2HE2 GLN 304 9.511 6.170 0.139
55 HA PRO 305 HA PRO 305 4.122 0.088 -2.885
56 HB2 PRO 305 3HB PRO 305 4.821 -1.439 -0.721
57 HB3 PRO 305 2HB PRO 305 5.457 -1.703 -2.345
58 HG2 PRO 305 3HG PRO 305 6.675 -0.217 -0.041
59 HG3 PRO 305 2HG PRO 305 7.437 -1.409 -1.160
60 HD2 PRO 305 3HD PRO 305 7.782 1.271 -1.419
61 HD3 PRO 305 2HD PRO 305 7.722 0.175 -2.810
62 H CYS 306 HN CYS 306 2.834 -0.765 -0.749
63 HA CYS 306 HA CYS 306 1.436 1.402 0.236
64 HB2 CYS 306 3HB CYS 306 1.515 -1.446 0.698
65 HB3 CYS 306 2HB CYS 306 1.271 -0.593 2.223
66 HA PRO 307 HA PRO 307 3.768 3.205 3.485
67 HB2 PRO 307 3HB PRO 307 1.815 3.861 5.290
68 HB3 PRO 307 2HB PRO 307 2.042 4.697 3.754
69 HG2 PRO 307 3HG PRO 307 0.127 2.498 4.457
70 HG3 PRO 307 2HG PRO 307 -0.173 4.020 3.539
71 HD2 PRO 307 3HD PRO 307 0.153 1.617 2.321
72 HD3 PRO 307 2HD PRO 307 0.702 3.139 1.597
73 H TYR 308 HN TYR 308 1.495 0.672 4.425
74 HA TYR 308 HA TYR 308 3.314 -0.051 6.629
75 HB2 TYR 308 3HB TYR 308 0.306 -0.213 6.438
76 HB3 TYR 308 2HB TYR 308 1.218 -1.150 7.624
77 HD1 TYR 308 2HD TYR 308 3.108 0.425 8.861
78 HD2 TYR 308 1HD TYR 308 -0.635 1.714 7.303
79 HE1 TYR 308 2HE TYR 308 3.135 2.342 10.401
80 HE2 TYR 308 1HE TYR 308 -0.618 3.636 8.837
81 HH TYR 308 HH TYR 308 1.202 3.867 11.476
82 H GLY 309 HN GLY 309 1.154 -1.254 4.102
83 HA2 GLY 309 2HA GLY 309 1.211 -3.201 2.884
84 HA3 GLY 309 3HA GLY 309 2.845 -3.442 3.487
85 H LYS 310 HN LYS 310 3.182 -5.097 4.817
86 HA LYS 310 HA LYS 310 1.250 -7.000 5.398
87 HB2 LYS 310 3HB LYS 310 2.907 -7.788 7.170
88 HB3 LYS 310 2HB LYS 310 3.502 -7.688 5.506
89 HG2 LYS 310 3HG LYS 310 4.704 -5.689 5.947
90 HG3 LYS 310 2HG LYS 310 3.922 -5.504 7.526
91 HD2 LYS 310 3HD LYS 310 5.030 -7.503 8.357
92 HD3 LYS 310 2HD LYS 310 5.755 -7.777 6.764
93 HE2 LYS 310 3HE LYS 310 7.155 -5.886 6.939
94 HE3 LYS 310 2HE LYS 310 6.214 -5.231 8.289
95 HZ1 LYS 310 3HZ LYS 310 8.086 -6.107 9.301
96 HZ2 LYS 310 1HZ LYS 310 8.132 -7.472 8.302
97 HZ3 LYS 310 2HZ LYS 310 6.952 -7.344 9.507
98 H LYS 311 HN LYS 311 2.157 -4.125 7.152
99 HA LYS 311 HA LYS 311 0.616 -4.876 9.496
100 HB2 LYS 311 3HB LYS 311 2.256 -2.455 8.755
101 HB3 LYS 311 2HB LYS 311 1.254 -2.499 10.214
102 HG2 LYS 311 3HG LYS 311 2.544 -4.168 11.216
103 HG3 LYS 311 2HG LYS 311 3.298 -4.622 9.676
104 HD2 LYS 311 3HD LYS 311 4.654 -2.694 9.632
105 HD3 LYS 311 2HD LYS 311 3.687 -1.898 10.887
106 HE2 LYS 311 3HE LYS 311 4.561 -3.239 12.600
107 HE3 LYS 311 2HE LYS 311 5.144 -4.457 11.455
108 HZ1 LYS 311 3HZ LYS 311 6.276 -1.803 11.140
109 HZ2 LYS 311 1HZ LYS 311 7.025 -3.318 11.059
110 HZ3 LYS 311 2HZ LYS 311 6.707 -2.612 12.562
111 H CYS 312 HN CYS 312 0.239 -3.031 6.591
112 HA CYS 312 HA CYS 312 -1.751 -1.235 7.244
113 HB2 CYS 312 3HB CYS 312 -0.553 -1.595 5.006
114 HB3 CYS 312 2HB CYS 312 -1.780 -2.820 4.680
115 H THR 313 HN THR 313 -3.874 -1.335 7.698
116 HA THR 313 HA THR 313 -5.068 -3.999 7.944
117 HB THR 313 HB THR 313 -6.859 -2.719 9.245
118 HG1 THR 313 1HG THR 313 -4.854 -0.720 9.444
119 HG21 THR 313 3HG2 THR 313 -4.016 -3.070 10.116
120 HG22 THR 313 1HG2 THR 313 -5.448 -3.990 10.577
121 HG23 THR 313 2HG2 THR 313 -5.197 -2.367 11.220
122 H TYR 314 HN TYR 314 -5.304 -1.074 6.131
123 HA TYR 314 HA TYR 314 -7.949 -1.091 5.301
124 HB2 TYR 314 3HB TYR 314 -5.506 -0.346 3.671
125 HB3 TYR 314 2HB TYR 314 -7.167 0.126 3.308
126 HD1 TYR 314 2HD TYR 314 -8.240 0.930 5.890
127 HD2 TYR 314 1HD TYR 314 -4.382 1.619 4.235
128 HE1 TYR 314 2HE TYR 314 -8.007 2.940 7.288
129 HE2 TYR 314 1HE TYR 314 -4.136 3.630 5.630
130 HH TYR 314 HH TYR 314 -5.093 4.968 7.116
131 H GLY 315 HN GLY 315 -5.167 -2.558 3.608
132 HA2 GLY 315 2HA GLY 315 -5.074 -4.545 2.419
133 HA3 GLY 315 3HA GLY 315 -6.756 -4.834 2.835
134 H ILE 316 HN ILE 316 -8.375 -3.497 1.649
135 HA ILE 316 HA ILE 316 -7.597 -3.359 -1.170
136 HB ILE 316 HB ILE 316 -10.368 -3.272 0.026
137 HG12 ILE 316 1HG1 ILE 316 -8.869 -5.571 -1.259
138 HG13 ILE 316 2HG1 ILE 316 -9.225 -5.414 0.470
139 HG21 ILE 316 1HG2 ILE 316 -9.445 -3.677 -2.816
140 HG22 ILE 316 2HG2 ILE 316 -11.115 -3.745 -2.254
141 HG23 ILE 316 3HG2 ILE 316 -10.218 -2.229 -2.172
142 HD11 ILE 316 3HD1 ILE 316 -10.852 -6.879 -0.297
143 HD12 ILE 316 1HD1 ILE 316 -11.684 -5.326 -0.232
144 HD13 ILE 316 2HD1 ILE 316 -11.119 -5.960 -1.779
145 H LYS 317 HN LYS 317 -8.778 -1.388 1.458
146 HA LYS 317 HA LYS 317 -9.086 0.921 -0.312
147 HB2 LYS 317 3HB LYS 317 -10.062 2.051 1.635
148 HB3 LYS 317 2HB LYS 317 -10.881 0.518 1.295
149 HG2 LYS 317 3HG LYS 317 -9.452 -0.542 3.071
150 HG3 LYS 317 2HG LYS 317 -8.908 1.093 3.490
151 HD2 LYS 317 3HD LYS 317 -11.796 0.190 3.468
152 HD3 LYS 317 2HD LYS 317 -10.773 0.291 4.913
153 HE2 LYS 317 3HE LYS 317 -11.480 2.607 3.092
154 HE3 LYS 317 2HE LYS 317 -12.212 2.265 4.666
155 HZ1 LYS 317 3HZ LYS 317 -10.610 3.799 5.203
156 HZ2 LYS 317 1HZ LYS 317 -9.502 3.230 4.057
157 HZ3 LYS 317 2HZ LYS 317 -9.769 2.358 5.481
158 H CYS 318 HN CYS 318 -6.474 -0.313 0.445
159 HA CYS 318 HA CYS 318 -5.167 1.462 2.253
160 HB2 CYS 318 3HB CYS 318 -4.282 -0.754 1.947
161 HB3 CYS 318 2HB CYS 318 -4.101 -0.495 0.210
162 H ARG 319 HN ARG 319 -5.884 1.527 -1.131
163 HA ARG 319 HA ARG 319 -5.557 3.098 -2.743
164 HB2 ARG 319 3HB ARG 319 -4.583 4.927 -0.543
165 HB3 ARG 319 2HB ARG 319 -5.291 5.385 -2.100
166 HG2 ARG 319 3HG ARG 319 -7.436 4.348 -1.378
167 HG3 ARG 319 2HG ARG 319 -6.707 4.084 0.215
168 HD2 ARG 319 3HD ARG 319 -6.979 6.785 -1.121
169 HD3 ARG 319 2HD ARG 319 -8.096 6.137 0.087
170 HE ARG 319 HE ARG 319 -5.413 6.116 1.038
171 HH11 ARG 319 2HH1 ARG 319 -8.158 8.185 0.485
172 HH12 ARG 319 1HH1 ARG 319 -7.715 9.321 1.716
173 HH21 ARG 319 2HH2 ARG 319 -4.819 7.603 2.661
174 HH22 ARG 319 1HH2 ARG 319 -5.814 8.990 2.952
175 H PHE 320 HN PHE 320 -3.402 1.289 -1.910
176 HA PHE 320 HA PHE 320 -1.245 2.621 -3.317
177 HB2 PHE 320 3HB PHE 320 -1.148 1.920 -0.423
178 HB3 PHE 320 2HB PHE 320 0.293 1.581 -1.385
179 HD1 PHE 320 2HD PHE 320 1.339 3.466 -2.716
180 HD2 PHE 320 1HD PHE 320 -1.580 4.103 0.314
181 HE1 PHE 320 2HE PHE 320 2.043 5.816 -2.537
182 HE2 PHE 320 1HE PHE 320 -0.882 6.454 0.498
183 HZ PHE 320 HZ PHE 320 0.933 7.314 -0.928
184 H PHE 321 HN PHE 321 0.643 1.031 -3.607
185 HA PHE 321 HA PHE 321 -0.515 -1.512 -4.442
186 HB2 PHE 321 3HB PHE 321 1.001 0.058 -5.877
187 HB3 PHE 321 2HB PHE 321 2.322 -0.686 -4.975
188 HD1 PHE 321 2HD PHE 321 2.817 -3.071 -5.198
189 HD2 PHE 321 1HD PHE 321 -0.203 -1.194 -7.537
190 HE1 PHE 321 2HE PHE 321 2.815 -4.995 -6.731
191 HE2 PHE 321 1HE PHE 321 -0.212 -3.115 -9.073
192 HZ PHE 321 HZ PHE 321 1.300 -5.019 -8.673
193 H HIS 322 HN HIS 322 -0.254 -3.325 -3.329
194 HA HIS 322 HA HIS 322 1.539 -3.357 -1.043
195 HB2 HIS 322 3HB HIS 322 -0.745 -5.028 -1.996
196 HB3 HIS 322 2HB HIS 322 0.431 -5.770 -0.906
197 HD1 HIS 322 1HD HIS 322 0.223 -5.267 1.538
198 HD2 HIS 322 2HD HIS 322 -2.068 -2.716 -0.810
199 HE1 HIS 322 1HE HIS 322 -1.173 -3.939 3.154
200 HE2 HIS 322 2HE HIS 322 -2.573 -2.379 1.720
201 HA PRO 323 HA PRO 323 4.767 -5.735 -2.823
202 HB2 PRO 323 3HB PRO 323 5.522 -7.315 -0.717
203 HB3 PRO 323 2HB PRO 323 5.846 -5.584 -0.800
204 HG2 PRO 323 3HG PRO 323 3.625 -7.038 0.597
205 HG3 PRO 323 2HG PRO 323 4.664 -5.694 1.200
206 HD2 PRO 323 3HD PRO 323 2.131 -5.301 0.306
207 HD3 PRO 323 2HD PRO 323 3.418 -4.103 0.090
208 H GLU 324 HN GLU 324 2.242 -7.543 -1.137
209 HA GLU 324 HA GLU 324 2.807 -9.872 -2.840
210 HB2 GLU 324 3HB GLU 324 1.139 -9.708 -0.318
211 HB3 GLU 324 2HB GLU 324 1.518 -11.180 -1.226
212 HG2 GLU 324 3HG GLU 324 3.778 -11.134 -0.601
213 HG3 GLU 324 2HG GLU 324 3.673 -9.452 -0.060
214 HE2 GLU 324 HE GLU 324 3.090 -12.197 2.573
215 H ARG 325 HN ARG 325 0.444 -7.455 -2.060
216 HA ARG 325 HA ARG 325 -1.447 -8.705 -3.943
217 HB2 ARG 325 3HB ARG 325 -1.850 -7.049 -1.475
218 HB3 ARG 325 2HB ARG 325 -3.076 -7.034 -2.751
219 HG2 ARG 325 3HG ARG 325 -2.107 -9.669 -1.746
220 HG3 ARG 325 2HG ARG 325 -3.219 -8.721 -0.745
221 HD2 ARG 325 3HD ARG 325 -4.746 -8.549 -2.733
222 HD3 ARG 325 2HD ARG 325 -3.675 -9.688 -3.562
223 HE ARG 325 HE ARG 325 -4.330 -10.919 -1.201
224 HH11 ARG 325 2HH1 ARG 325 -6.083 -9.625 -3.916
225 HH12 ARG 325 1HH1 ARG 325 -7.398 -10.744 -3.768
226 HH21 ARG 325 2HH2 ARG 325 -6.056 -12.397 -0.994
227 HH22 ARG 325 1HH2 ARG 325 -7.382 -12.319 -2.104
228 HA PRO 326 HA PRO 326 -1.104 -5.305 -6.694
229 HB2 PRO 326 3HB PRO 326 -3.679 -5.017 -7.582
230 HB3 PRO 326 2HB PRO 326 -2.638 -6.366 -8.036
231 HG2 PRO 326 3HG PRO 326 -4.742 -6.221 -5.902
232 HG3 PRO 326 2HG PRO 326 -4.439 -7.517 -7.121
233 HD2 PRO 326 3HD PRO 326 -3.640 -7.722 -4.535
234 HD3 PRO 326 2HD PRO 326 -2.719 -8.419 -5.879
235 H SER 327 HN SER 327 -4.006 -4.990 -4.640
236 HA SER 327 HA SER 327 -3.179 -2.289 -3.921
237 HB2 SER 327 1HB SER 327 -4.535 -1.633 -5.704
238 HB3 SER 327 2HB SER 327 -5.679 -2.961 -5.443
239 HG SER 327 HG SER 327 -6.683 -1.837 -3.938
Start of MODEL 11
1 H1 SER 299 HN SER 299 10.033 11.604 -1.446
2 HA SER 299 HA SER 299 7.133 11.990 -1.082
3 HB2 SER 299 1HB SER 299 9.085 13.358 -2.919
4 HB3 SER 299 2HB SER 299 7.378 13.220 -3.376
5 HG SER 299 HG SER 299 6.800 14.379 -1.573
6 H GLU 300 HN GLU 300 7.218 9.574 -1.213
7 HA GLU 300 HA GLU 300 7.265 8.699 -4.027
8 HB2 GLU 300 3HB GLU 300 7.622 6.374 -3.017
9 HB3 GLU 300 2HB GLU 300 8.990 7.497 -2.981
10 HG2 GLU 300 3HG GLU 300 7.149 7.320 -0.630
11 HG3 GLU 300 2HG GLU 300 8.402 6.096 -0.877
12 HE2 GLU 300 HE GLU 300 10.772 8.921 -0.674
13 H HIS 301 HN HIS 301 5.129 9.011 -4.516
14 HA HIS 301 HA HIS 301 3.053 8.020 -2.756
15 HB2 HIS 301 3HB HIS 301 2.860 10.147 -4.102
16 HB3 HIS 301 2HB HIS 301 2.741 9.137 -5.546
17 HD1 HIS 301 1HD HIS 301 0.775 10.288 -2.613
18 HD2 HIS 301 2HD HIS 301 0.333 7.673 -5.812
19 HE1 HIS 301 1HE HIS 301 -1.675 9.725 -2.689
20 HE2 HIS 301 2HE HIS 301 -1.946 8.128 -4.644
21 H ARG 302 HN ARG 302 4.264 7.296 -6.019
22 HA ARG 302 HA ARG 302 2.902 4.688 -5.847
23 HB2 ARG 302 3HB ARG 302 2.943 4.677 -8.332
24 HB3 ARG 302 2HB ARG 302 1.973 5.990 -7.650
25 HG2 ARG 302 3HG ARG 302 3.446 7.630 -8.311
26 HG3 ARG 302 2HG ARG 302 4.819 6.510 -8.362
27 HD2 ARG 302 3HD ARG 302 2.501 6.574 -10.309
28 HD3 ARG 302 2HD ARG 302 4.139 7.170 -10.611
29 HE ARG 302 HE ARG 302 3.256 4.445 -10.695
30 HH11 ARG 302 2HH1 ARG 302 5.991 6.533 -10.168
31 HH12 ARG 302 1HH1 ARG 302 7.159 5.331 -10.606
32 HH21 ARG 302 2HH2 ARG 302 4.783 2.854 -11.275
33 HH22 ARG 302 1HH2 ARG 302 6.471 3.239 -11.237
34 H LYS 303 HN LYS 303 5.887 6.361 -6.338
35 HA LYS 303 HA LYS 303 7.459 4.488 -7.618
36 HB2 LYS 303 3HB LYS 303 8.247 6.302 -5.323
37 HB3 LYS 303 2HB LYS 303 9.372 5.499 -6.431
38 HG2 LYS 303 3HG LYS 303 7.942 6.756 -8.262
39 HG3 LYS 303 2HG LYS 303 7.596 7.833 -6.896
40 HD2 LYS 303 3HD LYS 303 10.426 7.024 -7.469
41 HD3 LYS 303 2HD LYS 303 9.657 8.297 -8.430
42 HE2 LYS 303 3HE LYS 303 9.472 9.746 -6.639
43 HE3 LYS 303 2HE LYS 303 9.478 8.430 -5.456
44 HZ1 LYS 303 3HZ LYS 303 11.869 8.070 -6.125
45 HZ2 LYS 303 1HZ LYS 303 11.547 9.484 -5.255
46 HZ3 LYS 303 2HZ LYS 303 11.785 9.557 -6.928
47 H GLN 304 HN GLN 304 6.867 4.781 -4.119
48 HA GLN 304 HA GLN 304 7.995 2.093 -3.762
49 HB2 GLN 304 3HB GLN 304 7.724 4.489 -2.002
50 HB3 GLN 304 2HB GLN 304 7.703 2.888 -1.245
51 HG2 GLN 304 3HG GLN 304 9.896 4.017 -2.984
52 HG3 GLN 304 2HG GLN 304 9.939 3.804 -1.228
53 HE21 GLN 304 1HE2 GLN 304 10.214 1.766 -0.362
54 HE22 GLN 304 2HE2 GLN 304 10.715 0.411 -1.310
55 HA PRO 305 HA PRO 305 4.129 0.258 -2.801
56 HB2 PRO 305 3HB PRO 305 4.768 -1.425 -0.736
57 HB3 PRO 305 2HB PRO 305 5.263 -1.701 -2.406
58 HG2 PRO 305 3HG PRO 305 6.799 -0.464 -0.146
59 HG3 PRO 305 2HG PRO 305 7.335 -1.696 -1.349
60 HD2 PRO 305 3HD PRO 305 7.992 0.930 -1.549
61 HD3 PRO 305 2HD PRO 305 7.710 -0.095 -2.965
62 H CYS 306 HN CYS 306 2.828 -0.473 -0.666
63 HA CYS 306 HA CYS 306 1.820 1.813 0.500
64 HB2 CYS 306 3HB CYS 306 1.493 -1.036 0.818
65 HB3 CYS 306 2HB CYS 306 1.455 -0.245 2.396
66 HA PRO 307 HA PRO 307 4.545 3.076 3.696
67 HB2 PRO 307 3HB PRO 307 2.797 3.924 5.627
68 HB3 PRO 307 2HB PRO 307 3.080 4.794 4.121
69 HG2 PRO 307 3HG PRO 307 0.887 2.874 4.824
70 HG3 PRO 307 2HG PRO 307 0.781 4.470 3.992
71 HD2 PRO 307 3HD PRO 307 0.683 2.111 2.654
72 HD3 PRO 307 2HD PRO 307 1.423 3.568 1.970
73 H TYR 308 HN TYR 308 1.954 0.872 4.647
74 HA TYR 308 HA TYR 308 3.742 -0.231 6.714
75 HB2 TYR 308 3HB TYR 308 0.751 0.135 6.686
76 HB3 TYR 308 2HB TYR 308 1.512 -1.065 7.732
77 HD1 TYR 308 2HD TYR 308 3.821 0.115 8.850
78 HD2 TYR 308 1HD TYR 308 0.125 1.999 7.907
79 HE1 TYR 308 2HE TYR 308 4.274 1.839 10.544
80 HE2 TYR 308 1HE TYR 308 0.568 3.729 9.599
81 HH TYR 308 HH TYR 308 3.423 3.570 11.684
82 H GLY 309 HN GLY 309 1.212 -0.996 4.347
83 HA2 GLY 309 2HA GLY 309 0.891 -2.868 3.052
84 HA3 GLY 309 3HA GLY 309 2.534 -3.341 3.459
85 H LYS 310 HN LYS 310 2.880 -4.891 4.977
86 HA LYS 310 HA LYS 310 0.804 -6.682 5.580
87 HB2 LYS 310 3HB LYS 310 2.477 -7.681 7.193
88 HB3 LYS 310 2HB LYS 310 3.020 -7.532 5.514
89 HG2 LYS 310 3HG LYS 310 4.406 -5.681 6.010
90 HG3 LYS 310 2HG LYS 310 3.678 -5.488 7.614
91 HD2 LYS 310 3HD LYS 310 4.983 -8.091 6.954
92 HD3 LYS 310 2HD LYS 310 6.010 -6.688 7.297
93 HE2 LYS 310 3HE LYS 310 5.293 -6.512 9.489
94 HE3 LYS 310 2HE LYS 310 3.760 -7.327 9.150
95 HZ1 LYS 310 3HZ LYS 310 5.803 -8.504 10.369
96 HZ2 LYS 310 1HZ LYS 310 6.150 -8.933 8.769
97 HZ3 LYS 310 2HZ LYS 310 4.661 -9.351 9.453
98 H LYS 311 HN LYS 311 2.134 -3.968 7.341
99 HA LYS 311 HA LYS 311 0.640 -4.606 9.748
100 HB2 LYS 311 3HB LYS 311 2.436 -2.289 9.001
101 HB3 LYS 311 2HB LYS 311 1.608 -2.427 10.561
102 HG2 LYS 311 3HG LYS 311 3.019 -4.004 11.342
103 HG3 LYS 311 2HG LYS 311 3.211 -4.762 9.751
104 HD2 LYS 311 3HD LYS 311 4.360 -2.040 10.144
105 HD3 LYS 311 2HD LYS 311 5.182 -3.415 10.902
106 HE2 LYS 311 3HE LYS 311 5.562 -4.482 8.825
107 HE3 LYS 311 2HE LYS 311 4.405 -3.427 7.998
108 HZ1 LYS 311 3HZ LYS 311 5.985 -1.936 7.613
109 HZ2 LYS 311 1HZ LYS 311 7.119 -3.066 8.163
110 HZ3 LYS 311 2HZ LYS 311 6.482 -1.919 9.231
111 H CYS 312 HN CYS 312 0.216 -2.806 6.866
112 HA CYS 312 HA CYS 312 -1.426 -0.717 7.609
113 HB2 CYS 312 3HB CYS 312 -0.545 -1.486 5.268
114 HB3 CYS 312 2HB CYS 312 -2.082 -2.349 5.179
115 H THR 313 HN THR 313 -3.765 -0.489 7.483
116 HA THR 313 HA THR 313 -5.101 -2.798 8.693
117 HB THR 313 HB THR 313 -6.853 -1.206 9.371
118 HG1 THR 313 1HG THR 313 -6.773 0.357 7.799
119 HG21 THR 313 3HG2 THR 313 -3.995 -0.698 10.087
120 HG22 THR 313 1HG2 THR 313 -5.281 -1.415 11.056
121 HG23 THR 313 2HG2 THR 313 -5.260 0.325 10.767
122 H TYR 314 HN TYR 314 -5.285 -0.623 5.947
123 HA TYR 314 HA TYR 314 -7.828 -1.403 5.009
124 HB2 TYR 314 3HB TYR 314 -5.549 -0.491 3.250
125 HB3 TYR 314 2HB TYR 314 -7.281 -0.261 2.997
126 HD1 TYR 314 2HD TYR 314 -8.435 0.981 5.156
127 HD2 TYR 314 1HD TYR 314 -4.418 1.439 3.831
128 HE1 TYR 314 2HE TYR 314 -8.332 3.181 6.250
129 HE2 TYR 314 1HE TYR 314 -4.303 3.640 4.923
130 HH TYR 314 HH TYR 314 -7.033 5.282 6.041
131 H GLY 315 HN GLY 315 -4.586 -2.359 3.850
132 HA2 GLY 315 2HA GLY 315 -3.848 -4.379 3.016
133 HA3 GLY 315 3HA GLY 315 -5.367 -5.092 3.536
134 H ILE 316 HN ILE 316 -7.264 -4.706 2.146
135 HA ILE 316 HA ILE 316 -6.461 -4.835 -0.666
136 HB ILE 316 HB ILE 316 -9.169 -5.484 0.491
137 HG12 ILE 316 1HG1 ILE 316 -6.855 -7.348 -0.099
138 HG13 ILE 316 2HG1 ILE 316 -7.425 -6.898 1.518
139 HG21 ILE 316 1HG2 ILE 316 -8.928 -4.998 -1.972
140 HG22 ILE 316 2HG2 ILE 316 -7.924 -6.443 -2.072
141 HG23 ILE 316 3HG2 ILE 316 -9.608 -6.573 -1.564
142 HD11 ILE 316 3HD1 ILE 316 -9.716 -7.828 0.507
143 HD12 ILE 316 1HD1 ILE 316 -8.571 -8.794 -0.423
144 HD13 ILE 316 2HD1 ILE 316 -8.541 -8.844 1.341
145 H LYS 317 HN LYS 317 -8.345 -2.939 1.569
146 HA LYS 317 HA LYS 317 -9.419 -1.293 -0.600
147 HB2 LYS 317 3HB LYS 317 -10.780 -0.221 1.128
148 HB3 LYS 317 2HB LYS 317 -10.978 -1.980 1.158
149 HG2 LYS 317 3HG LYS 317 -9.009 -1.753 2.960
150 HG3 LYS 317 2HG LYS 317 -9.787 -0.172 3.166
151 HD2 LYS 317 3HD LYS 317 -11.951 -1.849 3.078
152 HD3 LYS 317 2HD LYS 317 -10.736 -2.846 3.900
153 HE2 LYS 317 3HE LYS 317 -10.319 -0.696 5.327
154 HE3 LYS 317 2HE LYS 317 -11.922 -0.233 4.742
155 HZ1 LYS 317 3HZ LYS 317 -12.228 -2.818 5.572
156 HZ2 LYS 317 1HZ LYS 317 -12.714 -1.434 6.415
157 HZ3 LYS 317 2HZ LYS 317 -11.212 -2.141 6.742
158 H CYS 318 HN CYS 318 -6.566 -1.310 0.112
159 HA CYS 318 HA CYS 318 -6.072 1.205 1.443
160 HB2 CYS 318 3HB CYS 318 -4.581 -0.860 1.558
161 HB3 CYS 318 2HB CYS 318 -4.068 -0.458 -0.082
162 H ARG 319 HN ARG 319 -4.650 2.852 0.385
163 HA ARG 319 HA ARG 319 -5.673 3.399 -2.304
164 HB2 ARG 319 3HB ARG 319 -4.596 5.095 -0.078
165 HB3 ARG 319 2HB ARG 319 -4.552 5.703 -1.740
166 HG2 ARG 319 3HG ARG 319 -7.121 4.616 -0.681
167 HG3 ARG 319 2HG ARG 319 -6.580 6.223 -0.166
168 HD2 ARG 319 3HD ARG 319 -6.713 5.424 -3.073
169 HD3 ARG 319 2HD ARG 319 -8.095 6.113 -2.210
170 HE ARG 319 HE ARG 319 -6.083 7.877 -1.724
171 HH11 ARG 319 2HH1 ARG 319 -7.479 6.504 -4.602
172 HH12 ARG 319 1HH1 ARG 319 -7.145 7.893 -5.583
173 HH21 ARG 319 2HH2 ARG 319 -5.637 9.711 -3.005
174 HH22 ARG 319 1HH2 ARG 319 -6.096 9.716 -4.674
175 H PHE 320 HN PHE 320 -2.757 2.697 -0.571
176 HA PHE 320 HA PHE 320 -1.044 3.486 -2.781
177 HB2 PHE 320 3HB PHE 320 -0.684 2.760 0.048
178 HB3 PHE 320 2HB PHE 320 0.573 2.135 -1.022
179 HD1 PHE 320 2HD PHE 320 -1.317 5.345 -0.722
180 HD2 PHE 320 1HD PHE 320 2.460 3.420 -1.108
181 HE1 PHE 320 2HE PHE 320 -0.203 7.539 -0.727
182 HE2 PHE 320 1HE PHE 320 3.580 5.611 -1.112
183 HZ PHE 320 HZ PHE 320 2.248 7.674 -0.923
184 H PHE 321 HN PHE 321 0.827 1.718 -3.113
185 HA PHE 321 HA PHE 321 -0.568 -0.590 -4.214
186 HB2 PHE 321 3HB PHE 321 0.900 0.517 -5.746
187 HB3 PHE 321 2HB PHE 321 2.229 0.484 -4.586
188 HD1 PHE 321 1HD PHE 321 -0.091 -2.017 -6.110
189 HD2 PHE 321 2HD PHE 321 3.905 -0.997 -5.054
190 HE1 PHE 321 1HE PHE 321 0.696 -4.153 -7.043
191 HE2 PHE 321 2HE PHE 321 4.699 -3.131 -5.987
192 HZ PHE 321 HZ PHE 321 3.095 -4.712 -6.984
193 H HIS 322 HN HIS 322 -0.800 -2.301 -2.940
194 HA HIS 322 HA HIS 322 0.986 -2.815 -0.740
195 HB2 HIS 322 3HB HIS 322 -1.570 -3.949 -1.757
196 HB3 HIS 322 2HB HIS 322 -0.548 -5.021 -0.793
197 HD1 HIS 322 1HD HIS 322 -0.529 -4.697 1.702
198 HD2 HIS 322 2HD HIS 322 -2.450 -1.607 -0.304
199 HE1 HIS 322 1HE HIS 322 -1.616 -3.307 3.493
200 HE2 HIS 322 2HE HIS 322 -2.790 -1.418 2.268
201 HA PRO 323 HA PRO 323 3.776 -5.620 -2.637
202 HB2 PRO 323 3HB PRO 323 4.263 -7.373 -0.590
203 HB3 PRO 323 2HB PRO 323 4.870 -5.717 -0.620
204 HG2 PRO 323 3HG PRO 323 2.442 -6.829 0.748
205 HG3 PRO 323 2HG PRO 323 3.692 -5.696 1.386
206 HD2 PRO 323 3HD PRO 323 1.257 -4.858 0.526
207 HD3 PRO 323 2HD PRO 323 2.726 -3.885 0.338
208 H GLU 324 HN GLU 324 0.838 -6.861 -1.220
209 HA GLU 324 HA GLU 324 1.102 -9.337 -2.783
210 HB2 GLU 324 3HB GLU 324 -0.959 -8.779 -0.650
211 HB3 GLU 324 2HB GLU 324 -0.480 -10.344 -1.322
212 HG2 GLU 324 3HG GLU 324 1.865 -9.216 -0.267
213 HG3 GLU 324 2HG GLU 324 0.591 -8.930 0.927
214 HE2 GLU 324 HE GLU 324 2.128 -12.371 1.052
215 H ARG 325 HN ARG 325 0.058 -6.420 -3.380
216 HA ARG 325 HA ARG 325 -2.489 -7.243 -4.603
217 HB2 ARG 325 3HB ARG 325 -1.447 -4.614 -3.603
218 HB3 ARG 325 2HB ARG 325 -2.696 -4.645 -4.858
219 HG2 ARG 325 3HG ARG 325 -3.071 -6.219 -2.338
220 HG3 ARG 325 2HG ARG 325 -3.389 -4.477 -2.369
221 HD2 ARG 325 3HD ARG 325 -5.474 -5.393 -2.861
222 HD3 ARG 325 2HD ARG 325 -4.816 -4.988 -4.452
223 HE ARG 325 HE ARG 325 -4.209 -7.673 -3.673
224 HH11 ARG 325 2HH1 ARG 325 -6.658 -5.614 -5.046
225 HH12 ARG 325 1HH1 ARG 325 -7.439 -6.897 -5.908
226 HH21 ARG 325 2HH2 ARG 325 -5.228 -9.371 -4.803
227 HH22 ARG 325 1HH2 ARG 325 -6.625 -9.034 -5.768
228 HA PRO 326 HA PRO 326 -0.906 -6.810 -8.671
229 HB2 PRO 326 3HB PRO 326 -3.032 -5.716 -10.006
230 HB3 PRO 326 2HB PRO 326 -2.994 -7.385 -9.437
231 HG2 PRO 326 3HG PRO 326 -4.227 -4.966 -8.161
232 HG3 PRO 326 2HG PRO 326 -4.915 -6.621 -8.370
233 HD2 PRO 326 3HD PRO 326 -3.870 -5.755 -6.018
234 HD3 PRO 326 2HD PRO 326 -3.753 -7.440 -6.556
235 H SER 327 HN SER 327 0.049 -5.368 -10.096
236 HA SER 327 HA SER 327 0.106 -2.578 -9.183
237 HB2 SER 327 1HB SER 327 2.311 -3.297 -9.159
238 HB3 SER 327 2HB SER 327 2.087 -4.346 -10.570
239 HG SER 327 HG SER 327 2.763 -2.761 -11.752
Start of MODEL 12
1 H1 SER 299 HN SER 299 7.648 13.858 -4.063
2 HA SER 299 HA SER 299 5.505 12.479 -2.847
3 HB2 SER 299 1HB SER 299 5.566 13.157 -5.783
4 HB3 SER 299 2HB SER 299 4.196 13.194 -4.659
5 HG SER 299 HG SER 299 4.670 15.185 -4.232
6 H GLU 300 HN GLU 300 5.933 10.333 -2.504
7 HA GLU 300 HA GLU 300 6.443 8.683 -4.890
8 HB2 GLU 300 3HB GLU 300 7.107 6.923 -3.155
9 HB3 GLU 300 2HB GLU 300 8.206 8.292 -3.387
10 HG2 GLU 300 3HG GLU 300 6.119 8.430 -1.252
11 HG3 GLU 300 2HG GLU 300 7.590 7.482 -0.989
12 HE2 GLU 300 HE GLU 300 7.919 11.148 -0.186
13 H HIS 301 HN HIS 301 3.851 9.626 -4.342
14 HA HIS 301 HA HIS 301 2.274 7.787 -2.893
15 HB2 HIS 301 3HB HIS 301 0.366 8.823 -3.940
16 HB3 HIS 301 2HB HIS 301 1.541 10.079 -3.536
17 HD1 HIS 301 1HD HIS 301 -0.599 9.153 -6.194
18 HD2 HIS 301 2HD HIS 301 3.286 10.610 -5.982
19 HE1 HIS 301 1HE HIS 301 -0.118 10.119 -8.465
20 HE2 HIS 301 2HE HIS 301 2.257 11.010 -8.337
21 H ARG 302 HN ARG 302 3.621 7.727 -6.081
22 HA ARG 302 HA ARG 302 2.345 5.119 -6.529
23 HB2 ARG 302 3HB ARG 302 2.199 5.664 -8.958
24 HB3 ARG 302 2HB ARG 302 1.140 6.647 -7.938
25 HG2 ARG 302 3HG ARG 302 1.965 8.420 -8.995
26 HG3 ARG 302 2HG ARG 302 3.450 8.141 -8.070
27 HD2 ARG 302 3HD ARG 302 3.905 8.363 -10.477
28 HD3 ARG 302 2HD ARG 302 4.343 6.764 -9.858
29 HE ARG 302 HE ARG 302 1.695 6.820 -10.931
30 HH11 ARG 302 2HH1 ARG 302 5.068 6.579 -11.759
31 HH12 ARG 302 1HH1 ARG 302 4.778 5.724 -13.239
32 HH21 ARG 302 2HH2 ARG 302 1.300 5.695 -12.875
33 HH22 ARG 302 1HH2 ARG 302 2.634 5.223 -13.873
34 H LYS 303 HN LYS 303 5.007 5.978 -5.549
35 HA LYS 303 HA LYS 303 6.653 4.711 -7.642
36 HB2 LYS 303 3HB LYS 303 7.582 6.712 -5.568
37 HB3 LYS 303 2HB LYS 303 8.552 6.013 -6.874
38 HG2 LYS 303 3HG LYS 303 6.106 7.709 -7.355
39 HG3 LYS 303 2HG LYS 303 7.754 8.355 -7.263
40 HD2 LYS 303 3HD LYS 303 8.378 6.701 -9.083
41 HD3 LYS 303 2HD LYS 303 6.640 6.411 -9.274
42 HE2 LYS 303 3HE LYS 303 7.761 8.151 -10.815
43 HE3 LYS 303 2HE LYS 303 6.230 8.575 -10.032
44 HZ1 LYS 303 3HZ LYS 303 8.137 10.261 -9.975
45 HZ2 LYS 303 1HZ LYS 303 8.803 9.277 -8.770
46 HZ3 LYS 303 2HZ LYS 303 7.282 9.981 -8.542
47 H GLN 304 HN GLN 304 6.077 5.072 -4.178
48 HA GLN 304 HA GLN 304 7.752 2.712 -3.675
49 HB2 GLN 304 3HB GLN 304 6.933 5.071 -2.048
50 HB3 GLN 304 2HB GLN 304 7.189 3.537 -1.202
51 HG2 GLN 304 3HG GLN 304 9.171 5.085 -1.293
52 HG3 GLN 304 2HG GLN 304 9.448 3.429 -1.852
53 HE21 GLN 304 1HE2 GLN 304 10.048 3.062 -3.923
54 HE22 GLN 304 2HE2 GLN 304 10.344 4.310 -5.080
55 HA PRO 305 HA PRO 305 4.352 0.115 -2.717
56 HB2 PRO 305 3HB PRO 305 5.274 -1.302 -0.564
57 HB3 PRO 305 2HB PRO 305 5.872 -1.531 -2.206
58 HG2 PRO 305 3HG PRO 305 7.026 0.102 0.029
59 HG3 PRO 305 2HG PRO 305 7.857 -1.028 -1.104
60 HD2 PRO 305 3HD PRO 305 7.933 1.668 -1.409
61 HD3 PRO 305 2HD PRO 305 7.927 0.549 -2.783
62 H CYS 306 HN CYS 306 3.070 -0.746 -0.685
63 HA CYS 306 HA CYS 306 1.640 1.346 0.399
64 HB2 CYS 306 3HB CYS 306 1.742 -1.513 0.704
65 HB3 CYS 306 2HB CYS 306 1.513 -0.760 2.283
66 HA PRO 307 HA PRO 307 3.954 3.034 3.724
67 HB2 PRO 307 3HB PRO 307 1.976 3.649 5.515
68 HB3 PRO 307 2HB PRO 307 2.237 4.532 4.011
69 HG2 PRO 307 3HG PRO 307 0.291 2.330 4.611
70 HG3 PRO 307 2HG PRO 307 0.020 3.883 3.738
71 HD2 PRO 307 3HD PRO 307 0.346 1.516 2.449
72 HD3 PRO 307 2HD PRO 307 0.920 3.055 1.784
73 H TYR 308 HN TYR 308 1.622 0.515 4.570
74 HA TYR 308 HA TYR 308 3.415 -0.313 6.759
75 HB2 TYR 308 3HB TYR 308 0.404 -0.402 6.555
76 HB3 TYR 308 2HB TYR 308 1.293 -1.385 7.719
77 HD1 TYR 308 1HD TYR 308 2.591 -0.317 9.539
78 HD2 TYR 308 2HD TYR 308 0.118 1.955 6.926
79 HE1 TYR 308 1HE TYR 308 2.650 1.561 11.125
80 HE2 TYR 308 2HE TYR 308 0.171 3.839 8.504
81 HH TYR 308 HH TYR 308 1.201 3.556 11.671
82 H GLY 309 HN GLY 309 1.197 -1.412 4.227
83 HA2 GLY 309 2HA GLY 309 1.240 -3.314 2.934
84 HA3 GLY 309 3HA GLY 309 2.853 -3.623 3.557
85 H LYS 310 HN LYS 310 3.140 -5.193 5.037
86 HA LYS 310 HA LYS 310 1.133 -7.099 5.477
87 HB2 LYS 310 3HB LYS 310 2.713 -8.023 7.203
88 HB3 LYS 310 2HB LYS 310 3.414 -7.786 5.594
89 HG2 LYS 310 3HG LYS 310 3.854 -5.388 7.009
90 HG3 LYS 310 2HG LYS 310 4.260 -6.719 8.107
91 HD2 LYS 310 3HD LYS 310 6.008 -7.441 6.831
92 HD3 LYS 310 2HD LYS 310 5.241 -6.929 5.317
93 HE2 LYS 310 3HE LYS 310 6.223 -4.907 7.319
94 HE3 LYS 310 2HE LYS 310 7.317 -5.643 6.140
95 HZ1 LYS 310 3HZ LYS 310 4.834 -4.162 5.462
96 HZ2 LYS 310 1HZ LYS 310 5.929 -4.825 4.357
97 HZ3 LYS 310 2HZ LYS 310 6.403 -3.541 5.351
98 H LYS 311 HN LYS 311 2.174 -4.335 7.363
99 HA LYS 311 HA LYS 311 0.522 -5.059 9.631
100 HB2 LYS 311 3HB LYS 311 2.199 -2.617 9.016
101 HB3 LYS 311 2HB LYS 311 1.274 -2.825 10.511
102 HG2 LYS 311 3HG LYS 311 2.610 -4.635 11.224
103 HG3 LYS 311 2HG LYS 311 3.351 -4.802 9.622
104 HD2 LYS 311 3HD LYS 311 5.011 -3.716 10.833
105 HD3 LYS 311 2HD LYS 311 4.184 -2.381 10.011
106 HE2 LYS 311 3HE LYS 311 2.726 -2.276 12.166
107 HE3 LYS 311 2HE LYS 311 4.051 -3.199 12.889
108 HZ1 LYS 311 3HZ LYS 311 5.056 -0.995 11.411
109 HZ2 LYS 311 1HZ LYS 311 5.271 -1.372 13.046
110 HZ3 LYS 311 2HZ LYS 311 3.927 -0.469 12.556
111 H CYS 312 HN CYS 312 0.245 -3.222 6.735
112 HA CYS 312 HA CYS 312 -1.624 -1.292 7.360
113 HB2 CYS 312 3HB CYS 312 -0.496 -1.681 5.134
114 HB3 CYS 312 2HB CYS 312 -1.679 -2.957 4.839
115 H THR 313 HN THR 313 -3.875 -1.202 7.389
116 HA THR 313 HA THR 313 -5.192 -3.794 7.862
117 HB THR 313 HB THR 313 -6.896 -2.437 9.138
118 HG1 THR 313 1HG THR 313 -4.953 -0.417 9.363
119 HG21 THR 313 3HG2 THR 313 -5.610 -2.383 11.148
120 HG22 THR 313 1HG2 THR 313 -4.102 -2.215 10.251
121 HG23 THR 313 2HG2 THR 313 -5.005 -3.728 10.182
122 H TYR 314 HN TYR 314 -5.220 -0.897 5.984
123 HA TYR 314 HA TYR 314 -7.856 -0.805 5.104
124 HB2 TYR 314 3HB TYR 314 -5.377 -0.177 3.479
125 HB3 TYR 314 2HB TYR 314 -7.010 0.413 3.163
126 HD1 TYR 314 1HD TYR 314 -8.017 1.320 5.686
127 HD2 TYR 314 2HD TYR 314 -4.062 1.616 4.146
128 HE1 TYR 314 1HE TYR 314 -7.615 3.284 7.112
129 HE2 TYR 314 2HE TYR 314 -3.648 3.580 5.567
130 HH TYR 314 HH TYR 314 -5.348 5.438 6.676
131 H GLY 315 HN GLY 315 -5.091 -2.383 3.483
132 HA2 GLY 315 2HA GLY 315 -5.049 -4.384 2.312
133 HA3 GLY 315 3HA GLY 315 -6.756 -4.595 2.673
134 H ILE 316 HN ILE 316 -8.286 -3.263 1.411
135 HA ILE 316 HA ILE 316 -7.383 -3.119 -1.370
136 HB ILE 316 HB ILE 316 -10.190 -3.061 -0.255
137 HG12 ILE 316 1HG1 ILE 316 -8.719 -5.273 -1.708
138 HG13 ILE 316 2HG1 ILE 316 -8.979 -5.221 0.044
139 HG21 ILE 316 1HG2 ILE 316 -10.904 -3.377 -2.567
140 HG22 ILE 316 2HG2 ILE 316 -9.998 -1.877 -2.380
141 HG23 ILE 316 3HG2 ILE 316 -9.226 -3.289 -3.103
142 HD11 ILE 316 3HD1 ILE 316 -11.514 -4.889 -1.004
143 HD12 ILE 316 1HD1 ILE 316 -10.764 -6.094 -2.052
144 HD13 ILE 316 2HD1 ILE 316 -10.843 -6.364 -0.310
145 H LYS 317 HN LYS 317 -8.595 -1.143 1.228
146 HA LYS 317 HA LYS 317 -8.837 1.176 -0.543
147 HB2 LYS 317 3HB LYS 317 -9.868 2.308 1.362
148 HB3 LYS 317 2HB LYS 317 -10.677 0.768 1.027
149 HG2 LYS 317 3HG LYS 317 -8.979 -0.132 2.842
150 HG3 LYS 317 2HG LYS 317 -9.007 1.567 3.349
151 HD2 LYS 317 3HD LYS 317 -11.536 -0.011 2.887
152 HD3 LYS 317 2HD LYS 317 -10.695 0.002 4.447
153 HE2 LYS 317 3HE LYS 317 -11.690 2.463 2.989
154 HE3 LYS 317 2HE LYS 317 -12.522 1.660 4.329
155 HZ1 LYS 317 3HZ LYS 317 -10.073 3.269 4.370
156 HZ2 LYS 317 1HZ LYS 317 -10.234 2.027 5.507
157 HZ3 LYS 317 2HZ LYS 317 -11.380 3.268 5.444
158 H CYS 318 HN CYS 318 -6.267 -0.109 0.309
159 HA CYS 318 HA CYS 318 -4.992 1.663 2.143
160 HB2 CYS 318 3HB CYS 318 -4.185 -0.614 1.838
161 HB3 CYS 318 2HB CYS 318 -3.833 -0.285 0.140
162 H ARG 319 HN ARG 319 -5.601 1.710 -1.257
163 HA ARG 319 HA ARG 319 -5.191 3.256 -2.875
164 HB2 ARG 319 3HB ARG 319 -4.247 5.072 -0.650
165 HB3 ARG 319 2HB ARG 319 -4.863 5.544 -2.240
166 HG2 ARG 319 3HG ARG 319 -7.052 4.405 -1.532
167 HG3 ARG 319 2HG ARG 319 -6.380 4.467 0.106
168 HD2 ARG 319 3HD ARG 319 -6.346 6.812 0.146
169 HD3 ARG 319 2HD ARG 319 -6.480 6.919 -1.615
170 HE ARG 319 HE ARG 319 -8.784 5.668 -0.628
171 HH11 ARG 319 2HH1 ARG 319 -7.214 8.776 -0.584
172 HH12 ARG 319 1HH1 ARG 319 -8.692 9.665 -0.425
173 HH21 ARG 319 2HH2 ARG 319 -10.736 6.829 -0.419
174 HH22 ARG 319 1HH2 ARG 319 -10.694 8.557 -0.330
175 H PHE 320 HN PHE 320 -3.075 1.431 -1.835
176 HA PHE 320 HA PHE 320 -0.840 2.719 -3.199
177 HB2 PHE 320 3HB PHE 320 -0.855 1.830 -0.340
178 HB3 PHE 320 2HB PHE 320 0.621 1.616 -1.284
179 HD1 PHE 320 1HD PHE 320 1.646 3.633 -2.418
180 HD2 PHE 320 2HD PHE 320 -1.381 3.931 0.560
181 HE1 PHE 320 1HE PHE 320 2.270 5.980 -2.022
182 HE2 PHE 320 2HE PHE 320 -0.762 6.279 0.959
183 HZ PHE 320 HZ PHE 320 1.065 7.306 -0.333
184 H PHE 321 HN PHE 321 1.038 1.033 -3.354
185 HA PHE 321 HA PHE 321 -0.177 -1.419 -4.381
186 HB2 PHE 321 3HB PHE 321 1.289 -0.072 -5.866
187 HB3 PHE 321 2HB PHE 321 2.633 -0.363 -4.759
188 HD1 PHE 321 2HD PHE 321 3.600 -2.604 -4.510
189 HD2 PHE 321 1HD PHE 321 0.563 -1.784 -7.377
190 HE1 PHE 321 2HE PHE 321 4.145 -4.698 -5.681
191 HE2 PHE 321 1HE PHE 321 1.102 -3.878 -8.552
192 HZ PHE 321 HZ PHE 321 2.897 -5.337 -7.706
193 H HIS 322 HN HIS 322 -0.072 -3.254 -3.282
194 HA HIS 322 HA HIS 322 1.635 -3.437 -0.939
195 HB2 HIS 322 3HB HIS 322 -0.695 -4.968 -2.014
196 HB3 HIS 322 2HB HIS 322 0.396 -5.783 -0.889
197 HD1 HIS 322 1HD HIS 322 0.195 -5.228 1.560
198 HD2 HIS 322 2HD HIS 322 -2.033 -2.687 -0.856
199 HE1 HIS 322 1HE HIS 322 -1.222 -3.873 3.135
200 HE2 HIS 322 2HE HIS 322 -2.584 -2.320 1.659
201 HA PRO 323 HA PRO 323 4.792 -5.944 -2.669
202 HB2 PRO 323 3HB PRO 323 5.392 -7.603 -0.574
203 HB3 PRO 323 2HB PRO 323 5.809 -5.891 -0.609
204 HG2 PRO 323 3HG PRO 323 3.470 -7.253 0.683
205 HG3 PRO 323 2HG PRO 323 4.559 -5.978 1.350
206 HD2 PRO 323 3HD PRO 323 2.081 -5.432 0.385
207 HD3 PRO 323 2HD PRO 323 3.436 -4.301 0.235
208 H GLU 324 HN GLU 324 2.115 -7.642 -1.113
209 HA GLU 324 HA GLU 324 2.617 -9.968 -2.839
210 HB2 GLU 324 3HB GLU 324 0.850 -9.768 -0.388
211 HB3 GLU 324 2HB GLU 324 1.219 -11.240 -1.300
212 HG2 GLU 324 3HG GLU 324 3.406 -11.342 -0.528
213 HG3 GLU 324 2HG GLU 324 3.416 -9.635 -0.064
214 HE2 GLU 324 HE GLU 324 2.011 -10.306 3.028
215 H ARG 325 HN ARG 325 0.359 -7.442 -2.096
216 HA ARG 325 HA ARG 325 -1.510 -8.541 -4.093
217 HB2 ARG 325 3HB ARG 325 -1.951 -6.966 -1.578
218 HB3 ARG 325 2HB ARG 325 -3.122 -6.857 -2.902
219 HG2 ARG 325 3HG ARG 325 -2.262 -9.477 -1.686
220 HG3 ARG 325 2HG ARG 325 -3.649 -8.538 -1.109
221 HD2 ARG 325 3HD ARG 325 -4.574 -8.610 -3.446
222 HD3 ARG 325 2HD ARG 325 -3.265 -9.729 -3.850
223 HE ARG 325 HE ARG 325 -4.393 -11.396 -2.758
224 HH11 ARG 325 2HH1 ARG 325 -5.747 -8.318 -1.858
225 HH12 ARG 325 1HH1 ARG 325 -7.086 -9.010 -1.003
226 HH21 ARG 325 2HH2 ARG 325 -6.152 -12.319 -1.636
227 HH22 ARG 325 1HH2 ARG 325 -7.315 -11.285 -0.877
228 HA PRO 326 HA PRO 326 -0.906 -5.049 -6.679
229 HB2 PRO 326 3HB PRO 326 -3.427 -4.613 -7.660
230 HB3 PRO 326 2HB PRO 326 -2.424 -5.985 -8.128
231 HG2 PRO 326 3HG PRO 326 -4.610 -5.840 -6.081
232 HG3 PRO 326 2HG PRO 326 -4.309 -7.095 -7.339
233 HD2 PRO 326 3HD PRO 326 -3.633 -7.440 -4.733
234 HD3 PRO 326 2HD PRO 326 -2.684 -8.120 -6.067
235 H SER 327 HN SER 327 -2.301 -2.892 -7.293
236 HA SER 327 HA SER 327 -2.771 -1.547 -4.714
237 HB2 SER 327 1HB SER 327 -1.799 0.419 -5.546
238 HB3 SER 327 2HB SER 327 -0.767 -0.862 -6.207
239 HG SER 327 HG SER 327 -2.054 0.985 -7.554
Start of MODEL 13
1 H1 SER 299 HN SER 299 9.833 13.196 -3.286
2 HA SER 299 HA SER 299 7.251 12.297 -2.364
3 HB2 SER 299 1HB SER 299 8.194 13.571 -4.945
4 HB3 SER 299 2HB SER 299 6.512 13.093 -4.656
5 HG SER 299 HG SER 299 6.263 14.696 -3.278
6 H GLU 300 HN GLU 300 7.570 10.046 -2.157
7 HA GLU 300 HA GLU 300 7.737 8.612 -4.726
8 HB2 GLU 300 3HB GLU 300 8.596 6.671 -3.426
9 HB3 GLU 300 2HB GLU 300 9.671 8.078 -3.397
10 HG2 GLU 300 3HG GLU 300 7.692 7.648 -1.190
11 HG3 GLU 300 2HG GLU 300 9.227 6.768 -1.214
12 HE2 GLU 300 HE GLU 300 9.293 10.330 0.197
13 H HIS 301 HN HIS 301 5.316 9.631 -3.810
14 HA HIS 301 HA HIS 301 3.839 7.672 -2.346
15 HB2 HIS 301 3HB HIS 301 1.918 9.025 -2.751
16 HB3 HIS 301 2HB HIS 301 3.273 10.125 -2.477
17 HD1 HIS 301 1HD HIS 301 0.874 9.033 -5.105
18 HD2 HIS 301 2HD HIS 301 4.111 11.609 -4.722
19 HE1 HIS 301 1HE HIS 301 0.837 10.470 -7.168
20 HE2 HIS 301 2HE HIS 301 2.815 12.045 -6.936
21 H ARG 302 HN ARG 302 4.622 8.170 -5.684
22 HA ARG 302 HA ARG 302 2.849 5.932 -6.414
23 HB2 ARG 302 3HB ARG 302 2.762 6.847 -8.683
24 HB3 ARG 302 2HB ARG 302 2.169 8.020 -7.496
25 HG2 ARG 302 3HG ARG 302 3.878 9.470 -7.841
26 HG3 ARG 302 2HG ARG 302 5.035 8.179 -8.207
27 HD2 ARG 302 3HD ARG 302 4.492 8.111 -10.424
28 HD3 ARG 302 2HD ARG 302 2.812 8.576 -10.124
29 HE ARG 302 HE ARG 302 4.713 10.680 -9.620
30 HH11 ARG 302 2HH1 ARG 302 2.713 9.116 -12.003
31 HH12 ARG 302 1HH1 ARG 302 2.637 10.501 -13.040
32 HH21 ARG 302 2HH2 ARG 302 4.620 12.512 -10.977
33 HH22 ARG 302 1HH2 ARG 302 3.723 12.432 -12.455
34 H LYS 303 HN LYS 303 5.632 5.902 -5.397
35 HA LYS 303 HA LYS 303 6.852 4.474 -7.665
36 HB2 LYS 303 3HB LYS 303 8.290 6.179 -5.616
37 HB3 LYS 303 2HB LYS 303 9.066 5.224 -6.889
38 HG2 LYS 303 3HG LYS 303 7.030 7.270 -7.657
39 HG3 LYS 303 2HG LYS 303 8.662 7.789 -7.197
40 HD2 LYS 303 3HD LYS 303 9.093 7.473 -9.396
41 HD3 LYS 303 2HD LYS 303 9.278 5.786 -8.888
42 HE2 LYS 303 3HE LYS 303 7.321 5.121 -9.851
43 HE3 LYS 303 2HE LYS 303 6.536 6.679 -9.553
44 HZ1 LYS 303 3HZ LYS 303 7.012 7.324 -11.603
45 HZ2 LYS 303 1HZ LYS 303 7.623 5.780 -11.931
46 HZ3 LYS 303 2HZ LYS 303 8.659 7.003 -11.392
47 H GLN 304 HN GLN 304 6.974 4.898 -4.131
48 HA GLN 304 HA GLN 304 7.985 2.192 -3.808
49 HB2 GLN 304 3HB GLN 304 7.640 4.572 -2.042
50 HB3 GLN 304 2HB GLN 304 7.674 2.971 -1.287
51 HG2 GLN 304 3HG GLN 304 9.825 4.190 -3.017
52 HG3 GLN 304 2HG GLN 304 9.879 3.940 -1.267
53 HE21 GLN 304 1HE2 GLN 304 10.278 1.916 -0.448
54 HE22 GLN 304 2HE2 GLN 304 10.796 0.591 -1.426
55 HA PRO 305 HA PRO 305 4.195 0.214 -2.832
56 HB2 PRO 305 3HB PRO 305 4.902 -1.448 -0.775
57 HB3 PRO 305 2HB PRO 305 5.401 -1.703 -2.447
58 HG2 PRO 305 3HG PRO 305 6.900 -0.415 -0.191
59 HG3 PRO 305 2HG PRO 305 7.475 -1.623 -1.399
60 HD2 PRO 305 3HD PRO 305 8.035 1.025 -1.596
61 HD3 PRO 305 2HD PRO 305 7.784 -0.008 -3.013
62 H CYS 306 HN CYS 306 2.904 -0.550 -0.719
63 HA CYS 306 HA CYS 306 1.846 1.702 0.469
64 HB2 CYS 306 3HB CYS 306 1.559 -1.149 0.735
65 HB3 CYS 306 2HB CYS 306 1.523 -0.400 2.332
66 HA PRO 307 HA PRO 307 4.552 2.980 3.678
67 HB2 PRO 307 3HB PRO 307 2.780 3.830 5.587
68 HB3 PRO 307 2HB PRO 307 3.080 4.698 4.081
69 HG2 PRO 307 3HG PRO 307 0.881 2.777 4.763
70 HG3 PRO 307 2HG PRO 307 0.783 4.371 3.926
71 HD2 PRO 307 3HD PRO 307 0.703 2.009 2.592
72 HD3 PRO 307 2HD PRO 307 1.449 3.466 1.914
73 H TYR 308 HN TYR 308 1.934 0.801 4.630
74 HA TYR 308 HA TYR 308 3.713 -0.319 6.697
75 HB2 TYR 308 3HB TYR 308 0.735 0.117 6.680
76 HB3 TYR 308 2HB TYR 308 1.457 -1.122 7.709
77 HD1 TYR 308 2HD TYR 308 3.648 -0.183 9.035
78 HD2 TYR 308 1HD TYR 308 0.324 2.133 7.734
79 HE1 TYR 308 2HE TYR 308 4.154 1.500 10.754
80 HE2 TYR 308 1HE TYR 308 0.822 3.823 9.450
81 HH TYR 308 HH TYR 308 3.719 3.975 11.091
82 H GLY 309 HN GLY 309 1.165 -1.057 4.340
83 HA2 GLY 309 2HA GLY 309 0.825 -2.926 3.044
84 HA3 GLY 309 3HA GLY 309 2.452 -3.432 3.474
85 H LYS 310 HN LYS 310 2.725 -5.044 4.916
86 HA LYS 310 HA LYS 310 0.607 -6.756 5.534
87 HB2 LYS 310 3HB LYS 310 2.246 -7.782 7.180
88 HB3 LYS 310 2HB LYS 310 2.787 -7.678 5.497
89 HG2 LYS 310 3HG LYS 310 4.220 -5.847 5.961
90 HG3 LYS 310 2HG LYS 310 3.513 -5.629 7.572
91 HD2 LYS 310 3HD LYS 310 4.603 -7.462 8.463
92 HD3 LYS 310 2HD LYS 310 4.781 -8.243 6.881
93 HE2 LYS 310 3HE LYS 310 6.638 -6.999 6.308
94 HE3 LYS 310 2HE LYS 310 6.177 -5.655 7.362
95 HZ1 LYS 310 3HZ LYS 310 6.596 -7.447 9.210
96 HZ2 LYS 310 1HZ LYS 310 7.874 -6.548 8.560
97 HZ3 LYS 310 2HZ LYS 310 7.593 -8.128 8.026
98 H LYS 311 HN LYS 311 1.965 -4.060 7.292
99 HA LYS 311 HA LYS 311 0.415 -4.662 9.678
100 HB2 LYS 311 3HB LYS 311 2.356 -2.454 8.978
101 HB3 LYS 311 2HB LYS 311 1.458 -2.504 10.503
102 HG2 LYS 311 3HG LYS 311 2.598 -4.377 11.277
103 HG3 LYS 311 2HG LYS 311 3.135 -4.830 9.650
104 HD2 LYS 311 3HD LYS 311 4.596 -2.848 9.579
105 HD3 LYS 311 2HD LYS 311 4.078 -2.431 11.222
106 HE2 LYS 311 3HE LYS 311 6.105 -3.534 11.569
107 HE3 LYS 311 2HE LYS 311 4.891 -4.790 11.856
108 HZ1 LYS 311 3HZ LYS 311 5.641 -5.985 10.155
109 HZ2 LYS 311 1HZ LYS 311 6.996 -4.972 10.144
110 HZ3 LYS 311 2HZ LYS 311 5.695 -4.655 9.112
111 H CYS 312 HN CYS 312 0.120 -2.848 6.796
112 HA CYS 312 HA CYS 312 -1.426 -0.678 7.506
113 HB2 CYS 312 3HB CYS 312 -0.566 -1.283 5.205
114 HB3 CYS 312 2HB CYS 312 -1.935 -2.389 5.069
115 H THR 313 HN THR 313 -3.637 -0.298 7.724
116 HA THR 313 HA THR 313 -5.121 -2.520 8.843
117 HB THR 313 HB THR 313 -6.862 -0.761 9.319
118 HG1 THR 313 1HG THR 313 -4.842 1.080 8.535
119 HG21 THR 313 3HG2 THR 313 -4.060 -0.661 10.348
120 HG22 THR 313 1HG2 THR 313 -5.539 -1.166 11.164
121 HG23 THR 313 2HG2 THR 313 -5.220 0.548 10.897
122 H TYR 314 HN TYR 314 -5.283 -0.392 6.041
123 HA TYR 314 HA TYR 314 -7.828 -1.129 5.118
124 HB2 TYR 314 3HB TYR 314 -5.494 -0.380 3.350
125 HB3 TYR 314 2HB TYR 314 -7.213 -0.126 3.039
126 HD1 TYR 314 1HD TYR 314 -8.238 1.091 5.439
127 HD2 TYR 314 2HD TYR 314 -4.492 1.711 3.520
128 HE1 TYR 314 1HE TYR 314 -8.114 3.341 6.424
129 HE2 TYR 314 2HE TYR 314 -4.357 3.962 4.500
130 HH TYR 314 HH TYR 314 -5.248 5.362 6.031
131 H GLY 315 HN GLY 315 -4.634 -2.280 4.004
132 HA2 GLY 315 2HA GLY 315 -3.989 -4.364 3.257
133 HA3 GLY 315 3HA GLY 315 -5.534 -4.987 3.813
134 H ILE 316 HN ILE 316 -7.416 -4.607 2.414
135 HA ILE 316 HA ILE 316 -6.634 -4.876 -0.393
136 HB ILE 316 HB ILE 316 -9.318 -5.430 0.874
137 HG12 ILE 316 1HG1 ILE 316 -7.597 -6.910 1.779
138 HG13 ILE 316 2HG1 ILE 316 -8.694 -7.803 0.714
139 HG21 ILE 316 1HG2 ILE 316 -8.194 -5.858 -1.873
140 HG22 ILE 316 2HG2 ILE 316 -9.542 -6.819 -1.270
141 HG23 ILE 316 3HG2 ILE 316 -9.699 -5.068 -1.403
142 HD11 ILE 316 3HD1 ILE 316 -6.400 -8.488 0.348
143 HD12 ILE 316 1HD1 ILE 316 -7.051 -7.695 -1.087
144 HD13 ILE 316 2HD1 ILE 316 -5.947 -6.823 -0.023
145 H LYS 317 HN LYS 317 -8.279 -2.750 1.775
146 HA LYS 317 HA LYS 317 -9.413 -1.204 -0.440
147 HB2 LYS 317 3HB LYS 317 -10.640 0.034 1.271
148 HB3 LYS 317 2HB LYS 317 -10.907 -1.709 1.437
149 HG2 LYS 317 3HG LYS 317 -9.062 -1.673 3.197
150 HG3 LYS 317 2HG LYS 317 -9.240 0.090 3.163
151 HD2 LYS 317 3HD LYS 317 -11.794 -0.463 3.470
152 HD3 LYS 317 2HD LYS 317 -11.160 -1.991 4.105
153 HE2 LYS 317 3HE LYS 317 -9.803 -0.776 5.740
154 HE3 LYS 317 2HE LYS 317 -10.395 0.758 5.088
155 HZ1 LYS 317 3HZ LYS 317 -11.922 0.560 6.694
156 HZ2 LYS 317 1HZ LYS 317 -11.694 -1.106 6.873
157 HZ3 LYS 317 2HZ LYS 317 -12.689 -0.516 5.639
158 H CYS 318 HN CYS 318 -6.514 -1.352 0.280
159 HA CYS 318 HA CYS 318 -5.881 1.265 1.329
160 HB2 CYS 318 3HB CYS 318 -4.509 -0.848 1.697
161 HB3 CYS 318 2HB CYS 318 -3.976 -0.678 0.023
162 H ARG 319 HN ARG 319 -4.854 2.941 0.196
163 HA ARG 319 HA ARG 319 -5.639 3.111 -2.591
164 HB2 ARG 319 3HB ARG 319 -4.266 5.168 -0.844
165 HB3 ARG 319 2HB ARG 319 -5.012 5.458 -2.423
166 HG2 ARG 319 3HG ARG 319 -7.209 4.943 -1.530
167 HG3 ARG 319 2HG ARG 319 -6.489 4.563 0.043
168 HD2 ARG 319 3HD ARG 319 -7.522 6.856 -0.137
169 HD3 ARG 319 2HD ARG 319 -5.836 6.816 0.396
170 HE ARG 319 HE ARG 319 -5.234 7.930 -1.514
171 HH11 ARG 319 2HH1 ARG 319 -8.467 6.692 -1.875
172 HH12 ARG 319 1HH1 ARG 319 -8.765 7.537 -3.358
173 HH21 ARG 319 2HH2 ARG 319 -5.614 9.049 -3.466
174 HH22 ARG 319 1HH2 ARG 319 -7.142 8.876 -4.261
175 H PHE 320 HN PHE 320 -2.754 2.695 -0.700
176 HA PHE 320 HA PHE 320 -0.959 3.297 -2.878
177 HB2 PHE 320 3HB PHE 320 -0.722 2.585 -0.019
178 HB3 PHE 320 2HB PHE 320 0.587 1.999 -1.047
179 HD1 PHE 320 1HD PHE 320 -1.329 5.126 -0.383
180 HD2 PHE 320 2HD PHE 320 2.392 3.362 -1.458
181 HE1 PHE 320 1HE PHE 320 -0.265 7.344 -0.327
182 HE2 PHE 320 2HE PHE 320 3.462 5.577 -1.402
183 HZ PHE 320 HZ PHE 320 2.134 7.571 -0.835
184 H PHE 321 HN PHE 321 0.839 1.554 -3.252
185 HA PHE 321 HA PHE 321 -0.544 -0.790 -4.262
186 HB2 PHE 321 3HB PHE 321 0.940 0.274 -5.811
187 HB3 PHE 321 2HB PHE 321 2.261 0.261 -4.641
188 HD1 PHE 321 2HD PHE 321 -0.057 -2.251 -6.147
189 HD2 PHE 321 1HD PHE 321 3.928 -1.249 -5.038
190 HE1 PHE 321 2HE PHE 321 0.727 -4.412 -7.024
191 HE2 PHE 321 1HE PHE 321 4.719 -3.408 -5.914
192 HZ PHE 321 HZ PHE 321 3.118 -4.993 -6.909
193 H HIS 322 HN HIS 322 -0.726 -2.550 -3.059
194 HA HIS 322 HA HIS 322 1.015 -2.994 -0.793
195 HB2 HIS 322 3HB HIS 322 -1.526 -4.151 -1.817
196 HB3 HIS 322 2HB HIS 322 -0.511 -5.206 -0.827
197 HD1 HIS 322 1HD HIS 322 -0.615 -4.907 1.653
198 HD2 HIS 322 2HD HIS 322 -2.330 -1.727 -0.398
199 HE1 HIS 322 1HE HIS 322 -1.700 -3.477 3.415
200 HE2 HIS 322 2HE HIS 322 -2.747 -1.533 2.162
201 HA PRO 323 HA PRO 323 3.834 -5.816 -2.621
202 HB2 PRO 323 3HB PRO 323 4.311 -7.531 -0.539
203 HB3 PRO 323 2HB PRO 323 4.911 -5.874 -0.592
204 HG2 PRO 323 3HG PRO 323 2.477 -6.972 0.774
205 HG3 PRO 323 2HG PRO 323 3.717 -5.823 1.402
206 HD2 PRO 323 3HD PRO 323 1.286 -5.012 0.509
207 HD3 PRO 323 2HD PRO 323 2.751 -4.035 0.316
208 H GLU 324 HN GLU 324 0.890 -7.047 -1.204
209 HA GLU 324 HA GLU 324 1.178 -9.548 -2.722
210 HB2 GLU 324 3HB GLU 324 -0.902 -8.960 -0.614
211 HB3 GLU 324 2HB GLU 324 -0.416 -10.535 -1.259
212 HG2 GLU 324 3HG GLU 324 1.918 -9.381 -0.204
213 HG3 GLU 324 2HG GLU 324 0.633 -9.087 0.977
214 HE2 GLU 324 HE GLU 324 0.158 -12.636 1.278
215 H ARG 325 HN ARG 325 0.127 -6.647 -3.381
216 HA ARG 325 HA ARG 325 -2.407 -7.501 -4.608
217 HB2 ARG 325 3HB ARG 325 -1.380 -4.850 -3.652
218 HB3 ARG 325 2HB ARG 325 -2.618 -4.908 -4.916
219 HG2 ARG 325 3HG ARG 325 -3.001 -6.425 -2.359
220 HG3 ARG 325 2HG ARG 325 -3.341 -4.689 -2.446
221 HD2 ARG 325 3HD ARG 325 -4.524 -6.740 -4.328
222 HD3 ARG 325 2HD ARG 325 -5.322 -6.154 -2.861
223 HE ARG 325 HE ARG 325 -5.187 -4.820 -5.361
224 HH11 ARG 325 2HH1 ARG 325 -5.179 -4.258 -1.925
225 HH12 ARG 325 1HH1 ARG 325 -5.843 -2.664 -2.052
226 HH21 ARG 325 2HH2 ARG 325 -6.063 -2.721 -5.541
227 HH22 ARG 325 1HH2 ARG 325 -6.347 -1.790 -4.109
228 HA PRO 326 HA PRO 326 -0.793 -7.144 -8.671
229 HB2 PRO 326 3HB PRO 326 -2.911 -6.079 -10.044
230 HB3 PRO 326 2HB PRO 326 -2.875 -7.737 -9.442
231 HG2 PRO 326 3HG PRO 326 -4.123 -5.297 -8.222
232 HG3 PRO 326 2HG PRO 326 -4.804 -6.956 -8.406
233 HD2 PRO 326 3HD PRO 326 -3.780 -6.044 -6.063
234 HD3 PRO 326 2HD PRO 326 -3.655 -7.738 -6.567
235 H SER 327 HN SER 327 0.166 -5.728 -10.120
236 HA SER 327 HA SER 327 0.321 -2.952 -9.209
237 HB2 SER 327 1HB SER 327 2.353 -2.793 -10.545
238 HB3 SER 327 2HB SER 327 2.428 -4.228 -9.507
239 HG SER 327 HG SER 327 2.926 -4.317 -11.952
Start of MODEL 14
1 H1 SER 299 HN SER 299 7.620 14.082 -2.564
2 HA SER 299 HA SER 299 8.266 11.765 -1.259
3 HB2 SER 299 1HB SER 299 5.423 12.184 -2.142
4 HB3 SER 299 2HB SER 299 6.043 11.640 -0.574
5 HG SER 299 HG SER 299 5.261 14.001 -1.034
6 H GLU 300 HN GLU 300 7.144 9.593 -1.501
7 HA GLU 300 HA GLU 300 7.496 8.700 -4.273
8 HB2 GLU 300 3HB GLU 300 7.452 7.124 -1.687
9 HB3 GLU 300 2HB GLU 300 7.712 6.437 -3.297
10 HG2 GLU 300 3HG GLU 300 9.859 6.616 -2.452
11 HG3 GLU 300 2HG GLU 300 9.691 8.064 -3.452
12 HE2 GLU 300 HE GLU 300 10.848 9.703 -0.643
13 H HIS 301 HN HIS 301 5.215 9.880 -4.285
14 HA HIS 301 HA HIS 301 2.931 8.703 -3.266
15 HB2 HIS 301 3HB HIS 301 3.490 10.290 -5.754
16 HB3 HIS 301 2HB HIS 301 1.880 9.612 -5.489
17 HD1 HIS 301 1HD HIS 301 1.014 12.105 -5.342
18 HD2 HIS 301 2HD HIS 301 3.579 10.931 -2.292
19 HE1 HIS 301 1HE HIS 301 0.756 13.840 -3.540
20 HE2 HIS 301 2HE HIS 301 2.323 13.123 -1.676
21 H ARG 302 HN ARG 302 4.591 7.983 -6.325
22 HA ARG 302 HA ARG 302 3.242 5.373 -6.340
23 HB2 ARG 302 3HB ARG 302 3.115 5.522 -8.830
24 HB3 ARG 302 2HB ARG 302 2.078 6.681 -7.983
25 HG2 ARG 302 3HG ARG 302 2.958 8.278 -9.244
26 HG3 ARG 302 2HG ARG 302 4.477 8.034 -8.365
27 HD2 ARG 302 3HD ARG 302 4.810 7.913 -10.797
28 HD3 ARG 302 2HD ARG 302 5.189 6.381 -9.997
29 HE ARG 302 HE ARG 302 2.493 6.537 -10.991
30 HH11 ARG 302 2HH1 ARG 302 5.794 5.735 -11.751
31 HH12 ARG 302 1HH1 ARG 302 5.372 4.662 -13.045
32 HH21 ARG 302 2HH2 ARG 302 1.925 5.128 -12.692
33 HH22 ARG 302 1HH2 ARG 302 3.172 4.318 -13.580
34 H LYS 303 HN LYS 303 5.910 6.227 -5.467
35 HA LYS 303 HA LYS 303 7.580 4.804 -7.430
36 HB2 LYS 303 3HB LYS 303 8.434 6.696 -5.225
37 HB3 LYS 303 2HB LYS 303 9.501 5.929 -6.412
38 HG2 LYS 303 3HG LYS 303 7.259 7.514 -7.512
39 HG3 LYS 303 2HG LYS 303 8.538 8.414 -6.678
40 HD2 LYS 303 3HD LYS 303 10.224 7.277 -8.105
41 HD3 LYS 303 2HD LYS 303 8.896 6.504 -8.987
42 HE2 LYS 303 3HE LYS 303 8.013 8.888 -9.388
43 HE3 LYS 303 2HE LYS 303 9.621 9.415 -8.875
44 HZ1 LYS 303 3HZ LYS 303 8.942 8.752 -11.399
45 HZ2 LYS 303 1HZ LYS 303 9.666 7.323 -10.854
46 HZ3 LYS 303 2HZ LYS 303 10.524 8.780 -10.800
47 H GLN 304 HN GLN 304 6.609 4.968 -4.066
48 HA GLN 304 HA GLN 304 8.081 2.465 -3.564
49 HB2 GLN 304 3HB GLN 304 7.508 4.848 -1.860
50 HB3 GLN 304 2HB GLN 304 7.588 3.262 -1.078
51 HG2 GLN 304 3HG GLN 304 9.764 4.563 -2.717
52 HG3 GLN 304 2HG GLN 304 9.731 4.368 -0.959
53 HE21 GLN 304 1HE2 GLN 304 10.190 2.394 -0.054
54 HE22 GLN 304 2HE2 GLN 304 10.837 1.072 -0.957
55 HA PRO 305 HA PRO 305 4.349 0.303 -2.772
56 HB2 PRO 305 3HB PRO 305 5.024 -1.290 -0.649
57 HB3 PRO 305 2HB PRO 305 5.631 -1.541 -2.286
58 HG2 PRO 305 3HG PRO 305 6.929 -0.144 0.029
59 HG3 PRO 305 2HG PRO 305 7.635 -1.338 -1.124
60 HD2 PRO 305 3HD PRO 305 8.066 1.335 -1.334
61 HD3 PRO 305 2HD PRO 305 7.951 0.270 -2.746
62 H CYS 306 HN CYS 306 2.980 -0.497 -0.725
63 HA CYS 306 HA CYS 306 1.741 1.712 0.364
64 HB2 CYS 306 3HB CYS 306 1.601 -1.152 0.678
65 HB3 CYS 306 2HB CYS 306 1.399 -0.362 2.243
66 HA PRO 307 HA PRO 307 4.159 3.164 3.725
67 HB2 PRO 307 3HB PRO 307 2.237 3.866 5.546
68 HB3 PRO 307 2HB PRO 307 2.544 4.764 4.059
69 HG2 PRO 307 3HG PRO 307 0.465 2.678 4.628
70 HG3 PRO 307 2HG PRO 307 0.289 4.266 3.791
71 HD2 PRO 307 3HD PRO 307 0.451 1.912 2.449
72 HD3 PRO 307 2HD PRO 307 1.118 3.425 1.812
73 H TYR 308 HN TYR 308 1.696 0.759 4.509
74 HA TYR 308 HA TYR 308 3.429 -0.211 6.687
75 HB2 TYR 308 3HB TYR 308 0.422 -0.122 6.461
76 HB3 TYR 308 2HB TYR 308 1.235 -1.210 7.589
77 HD1 TYR 308 1HD TYR 308 3.365 0.270 8.760
78 HD2 TYR 308 2HD TYR 308 -0.499 1.652 7.637
79 HE1 TYR 308 1HE TYR 308 3.531 2.071 10.427
80 HE2 TYR 308 2HE TYR 308 -0.344 3.457 9.300
81 HH TYR 308 HH TYR 308 0.844 3.993 11.328
82 H GLY 309 HN GLY 309 1.126 -1.161 4.162
83 HA2 GLY 309 2HA GLY 309 1.094 -3.026 2.811
84 HA3 GLY 309 3HA GLY 309 2.694 -3.422 3.421
85 H LYS 310 HN LYS 310 2.898 -5.097 4.773
86 HA LYS 310 HA LYS 310 0.768 -6.863 5.224
87 HB2 LYS 310 3HB LYS 310 2.353 -7.963 6.859
88 HB3 LYS 310 2HB LYS 310 2.968 -7.756 5.211
89 HG2 LYS 310 3HG LYS 310 4.362 -5.947 5.843
90 HG3 LYS 310 2HG LYS 310 3.578 -5.820 7.427
91 HD2 LYS 310 3HD LYS 310 4.822 -8.432 6.731
92 HD3 LYS 310 2HD LYS 310 5.906 -7.074 7.081
93 HE2 LYS 310 3HE LYS 310 5.627 -8.008 9.184
94 HE3 LYS 310 2HE LYS 310 4.395 -6.737 9.169
95 HZ1 LYS 310 3HZ LYS 310 2.746 -8.226 9.251
96 HZ2 LYS 310 1HZ LYS 310 3.930 -9.309 9.786
97 HZ3 LYS 310 2HZ LYS 310 3.484 -9.282 8.155
98 H LYS 311 HN LYS 311 2.136 -4.302 7.197
99 HA LYS 311 HA LYS 311 0.522 -4.993 9.499
100 HB2 LYS 311 3HB LYS 311 2.341 -2.643 8.926
101 HB3 LYS 311 2HB LYS 311 1.500 -2.901 10.464
102 HG2 LYS 311 3HG LYS 311 2.724 -4.921 10.881
103 HG3 LYS 311 2HG LYS 311 3.456 -4.851 9.268
104 HD2 LYS 311 3HD LYS 311 4.513 -2.676 9.900
105 HD3 LYS 311 2HD LYS 311 3.893 -2.918 11.543
106 HE2 LYS 311 3HE LYS 311 5.301 -4.719 11.965
107 HE3 LYS 311 2HE LYS 311 5.525 -5.058 10.242
108 HZ1 LYS 311 3HZ LYS 311 7.356 -3.842 10.267
109 HZ2 LYS 311 1HZ LYS 311 7.152 -3.531 11.917
110 HZ3 LYS 311 2HZ LYS 311 6.489 -2.480 10.771
111 H CYS 312 HN CYS 312 0.117 -3.215 6.647
112 HA CYS 312 HA CYS 312 -1.443 -1.055 7.357
113 HB2 CYS 312 3HB CYS 312 -0.632 -1.896 5.027
114 HB3 CYS 312 2HB CYS 312 -2.177 -2.748 4.988
115 H THR 313 HN THR 313 -3.753 -0.742 7.344
116 HA THR 313 HA THR 313 -5.138 -2.965 8.639
117 HB THR 313 HB THR 313 -6.890 -1.226 9.147
118 HG1 THR 313 1HG THR 313 -6.677 0.512 7.943
119 HG21 THR 313 3HG2 THR 313 -4.346 -0.133 10.208
120 HG22 THR 313 1HG2 THR 313 -4.669 -1.840 10.502
121 HG23 THR 313 2HG2 THR 313 -5.812 -0.618 11.059
122 H TYR 314 HN TYR 314 -5.470 -0.774 5.885
123 HA TYR 314 HA TYR 314 -7.990 -1.736 5.026
124 HB2 TYR 314 3HB TYR 314 -5.776 -0.291 3.554
125 HB3 TYR 314 2HB TYR 314 -7.350 -0.650 2.840
126 HD1 TYR 314 1HD TYR 314 -9.332 -0.018 4.734
127 HD2 TYR 314 2HD TYR 314 -5.612 1.949 4.109
128 HE1 TYR 314 1HE TYR 314 -10.270 2.045 5.690
129 HE2 TYR 314 2HE TYR 314 -6.538 4.018 5.065
130 HH TYR 314 HH TYR 314 -8.395 4.640 6.656
131 H GLY 315 HN GLY 315 -4.729 -2.311 3.688
132 HA2 GLY 315 2HA GLY 315 -3.836 -4.237 2.771
133 HA3 GLY 315 3HA GLY 315 -5.296 -5.091 3.247
134 H ILE 316 HN ILE 316 -7.290 -4.411 1.908
135 HA ILE 316 HA ILE 316 -6.504 -4.604 -0.906
136 HB ILE 316 HB ILE 316 -9.233 -5.034 0.314
137 HG12 ILE 316 1HG1 ILE 316 -7.191 -7.093 -0.558
138 HG13 ILE 316 2HG1 ILE 316 -7.501 -6.642 1.126
139 HG21 ILE 316 1HG2 ILE 316 -9.034 -6.458 -2.050
140 HG22 ILE 316 2HG2 ILE 316 -9.898 -4.940 -1.810
141 HG23 ILE 316 3HG2 ILE 316 -8.239 -4.924 -2.407
142 HD11 ILE 316 3HD1 ILE 316 -8.854 -8.561 -0.474
143 HD12 ILE 316 1HD1 ILE 316 -9.091 -8.168 1.228
144 HD13 ILE 316 2HD1 ILE 316 -9.994 -7.297 -0.013
145 H LYS 317 HN LYS 317 -8.064 -2.492 1.348
146 HA LYS 317 HA LYS 317 -9.234 -0.825 -0.720
147 HB2 LYS 317 3HB LYS 317 -9.047 0.061 2.127
148 HB3 LYS 317 2HB LYS 317 -10.364 0.271 0.962
149 HG2 LYS 317 3HG LYS 317 -10.470 -2.387 1.209
150 HG3 LYS 317 2HG LYS 317 -9.798 -1.976 2.796
151 HD2 LYS 317 3HD LYS 317 -11.711 -0.187 2.837
152 HD3 LYS 317 2HD LYS 317 -12.441 -1.238 1.610
153 HE2 LYS 317 3HE LYS 317 -11.410 -2.428 4.165
154 HE3 LYS 317 2HE LYS 317 -12.980 -1.611 4.134
155 HZ1 LYS 317 3HZ LYS 317 -13.802 -3.533 3.424
156 HZ2 LYS 317 1HZ LYS 317 -12.268 -4.187 3.137
157 HZ3 LYS 317 2HZ LYS 317 -13.026 -3.253 1.948
158 H CYS 318 HN CYS 318 -6.313 -1.042 1.072
159 HA CYS 318 HA CYS 318 -5.436 1.566 1.235
160 HB2 CYS 318 3HB CYS 318 -4.245 -0.430 2.128
161 HB3 CYS 318 2HB CYS 318 -3.741 -0.824 0.483
162 H ARG 319 HN ARG 319 -5.467 3.066 -0.300
163 HA ARG 319 HA ARG 319 -5.673 2.680 -3.026
164 HB2 ARG 319 3HB ARG 319 -4.607 4.975 -1.392
165 HB3 ARG 319 2HB ARG 319 -4.664 5.049 -3.159
166 HG2 ARG 319 3HG ARG 319 -7.092 4.668 -3.098
167 HG3 ARG 319 2HG ARG 319 -7.020 4.645 -1.328
168 HD2 ARG 319 3HD ARG 319 -7.699 6.834 -1.885
169 HD3 ARG 319 2HD ARG 319 -5.981 6.957 -1.480
170 HE ARG 319 HE ARG 319 -6.027 6.583 -4.190
171 HH11 ARG 319 2HH1 ARG 319 -7.421 8.881 -1.977
172 HH12 ARG 319 1HH1 ARG 319 -7.410 10.184 -3.120
173 HH21 ARG 319 2HH2 ARG 319 -6.007 8.291 -5.702
174 HH22 ARG 319 1HH2 ARG 319 -6.607 9.847 -5.238
175 H PHE 320 HN PHE 320 -2.761 3.048 -1.055
176 HA PHE 320 HA PHE 320 -0.888 3.197 -3.127
177 HB2 PHE 320 3HB PHE 320 -0.822 2.478 -0.241
178 HB3 PHE 320 2HB PHE 320 0.558 1.975 -1.219
179 HD1 PHE 320 2HD PHE 320 -1.517 5.001 -0.561
180 HD2 PHE 320 1HD PHE 320 2.321 3.422 -1.506
181 HE1 PHE 320 2HE PHE 320 -0.551 7.257 -0.393
182 HE2 PHE 320 1HE PHE 320 3.293 5.676 -1.339
183 HZ PHE 320 HZ PHE 320 1.857 7.597 -0.783
184 H PHE 321 HN PHE 321 0.851 1.404 -3.394
185 HA PHE 321 HA PHE 321 -0.567 -0.973 -4.304
186 HB2 PHE 321 3HB PHE 321 0.998 0.253 -5.817
187 HB3 PHE 321 2HB PHE 321 2.322 -0.194 -4.741
188 HD1 PHE 321 2HD PHE 321 -0.387 -1.723 -6.779
189 HD2 PHE 321 1HD PHE 321 3.489 -2.161 -5.073
190 HE1 PHE 321 2HE PHE 321 -0.104 -3.852 -7.979
191 HE2 PHE 321 1HE PHE 321 3.778 -4.292 -6.271
192 HZ PHE 321 HZ PHE 321 1.980 -5.140 -7.725
193 H HIS 322 HN HIS 322 -0.442 -2.907 -3.355
194 HA HIS 322 HA HIS 322 1.264 -3.171 -0.994
195 HB2 HIS 322 3HB HIS 322 -1.251 -4.478 -1.942
196 HB3 HIS 322 2HB HIS 322 -0.197 -5.382 -0.850
197 HD1 HIS 322 1HD HIS 322 -0.231 -4.773 1.596
198 HD2 HIS 322 2HD HIS 322 -2.312 -2.063 -0.769
199 HE1 HIS 322 1HE HIS 322 -1.439 -3.264 3.206
200 HE2 HIS 322 2HE HIS 322 -2.710 -1.607 1.762
201 HA PRO 323 HA PRO 323 4.078 -5.997 -2.820
202 HB2 PRO 323 3HB PRO 323 4.614 -7.677 -0.724
203 HB3 PRO 323 2HB PRO 323 5.191 -6.014 -0.811
204 HG2 PRO 323 3HG PRO 323 2.796 -7.122 0.614
205 HG3 PRO 323 2HG PRO 323 4.032 -5.949 1.204
206 HD2 PRO 323 3HD PRO 323 1.575 -5.179 0.343
207 HD3 PRO 323 2HD PRO 323 3.026 -4.188 0.111
208 H GLU 324 HN GLU 324 1.341 -7.417 -1.092
209 HA GLU 324 HA GLU 324 1.523 -9.797 -2.809
210 HB2 GLU 324 3HB GLU 324 -0.066 -9.402 -0.262
211 HB3 GLU 324 2HB GLU 324 0.092 -10.911 -1.175
212 HG2 GLU 324 3HG GLU 324 2.499 -9.506 -0.059
213 HG3 GLU 324 2HG GLU 324 1.521 -10.605 0.926
214 HE2 GLU 324 HE GLU 324 2.789 -13.398 -0.657
215 H ARG 325 HN ARG 325 -0.442 -7.060 -1.983
216 HA ARG 325 HA ARG 325 -2.525 -8.004 -3.840
217 HB2 ARG 325 3HB ARG 325 -2.642 -6.372 -1.334
218 HB3 ARG 325 2HB ARG 325 -3.854 -6.098 -2.594
219 HG2 ARG 325 3HG ARG 325 -3.427 -8.923 -1.885
220 HG3 ARG 325 2HG ARG 325 -4.103 -7.906 -0.601
221 HD2 ARG 325 3HD ARG 325 -6.069 -8.428 -1.601
222 HD3 ARG 325 2HD ARG 325 -5.616 -7.085 -2.660
223 HE ARG 325 HE ARG 325 -5.445 -8.577 -4.370
224 HH11 ARG 325 2HH1 ARG 325 -5.074 -10.298 -1.366
225 HH12 ARG 325 1HH1 ARG 325 -4.991 -11.856 -2.119
226 HH21 ARG 325 2HH2 ARG 325 -5.338 -10.623 -5.372
227 HH22 ARG 325 1HH2 ARG 325 -5.141 -12.040 -4.397
228 HA PRO 326 HA PRO 326 -1.750 -4.655 -6.565
229 HB2 PRO 326 3HB PRO 326 -4.273 -3.965 -7.379
230 HB3 PRO 326 2HB PRO 326 -3.463 -5.451 -7.874
231 HG2 PRO 326 3HG PRO 326 -5.463 -5.016 -5.682
232 HG3 PRO 326 2HG PRO 326 -5.395 -6.326 -6.921
233 HD2 PRO 326 3HD PRO 326 -4.570 -6.687 -4.359
234 HD3 PRO 326 2HD PRO 326 -3.801 -7.496 -5.735
235 H SER 327 HN SER 327 -2.942 -2.372 -7.145
236 HA SER 327 HA SER 327 -2.912 -0.896 -4.604
237 HB2 SER 327 1HB SER 327 -2.537 1.108 -6.188
238 HB3 SER 327 2HB SER 327 -1.205 -0.042 -5.980
239 HG SER 327 HG SER 327 -2.962 0.240 -8.169
Start of MODEL 15
1 H1 SER 299 HN SER 299 7.580 13.887 -2.548
2 HA SER 299 HA SER 299 7.337 11.787 -0.512
3 HB2 SER 299 1HB SER 299 5.257 13.443 -1.966
4 HB3 SER 299 2HB SER 299 4.860 12.098 -0.882
5 HG SER 299 HG SER 299 5.578 14.642 -0.269
6 H GLU 300 HN GLU 300 7.311 9.731 -1.113
7 HA GLU 300 HA GLU 300 7.220 9.022 -3.905
8 HB2 GLU 300 3HB GLU 300 7.272 7.151 -1.532
9 HB3 GLU 300 2HB GLU 300 7.768 6.803 -3.195
10 HG2 GLU 300 3HG GLU 300 9.153 8.561 -1.180
11 HG3 GLU 300 2HG GLU 300 9.741 7.065 -1.917
12 HE2 GLU 300 HE GLU 300 10.078 10.434 -3.960
13 H HIS 301 HN HIS 301 5.150 9.455 -4.629
14 HA HIS 301 HA HIS 301 2.885 8.232 -3.271
15 HB2 HIS 301 3HB HIS 301 2.747 10.553 -4.167
16 HB3 HIS 301 2HB HIS 301 2.928 9.896 -5.796
17 HD1 HIS 301 1HD HIS 301 0.412 10.573 -3.224
18 HD2 HIS 301 2HD HIS 301 0.711 8.233 -6.644
19 HE1 HIS 301 1HE HIS 301 -1.948 9.936 -3.811
20 HE2 HIS 301 2HE HIS 301 -1.768 8.506 -5.902
21 H ARG 302 HN ARG 302 4.736 7.909 -6.243
22 HA ARG 302 HA ARG 302 3.382 5.346 -6.726
23 HB2 ARG 302 3HB ARG 302 3.401 5.750 -9.133
24 HB3 ARG 302 2HB ARG 302 2.467 6.996 -8.292
25 HG2 ARG 302 3HG ARG 302 3.939 8.661 -8.787
26 HG3 ARG 302 2HG ARG 302 5.327 7.560 -8.821
27 HD2 ARG 302 3HD ARG 302 4.886 8.347 -11.065
28 HD3 ARG 302 2HD ARG 302 4.501 6.624 -10.951
29 HE ARG 302 HE ARG 302 2.152 8.017 -10.444
30 HH11 ARG 302 2HH1 ARG 302 4.404 7.585 -13.063
31 HH12 ARG 302 1HH1 ARG 302 3.213 7.826 -14.298
32 HH21 ARG 302 2HH2 ARG 302 0.575 8.337 -12.060
33 HH22 ARG 302 1HH2 ARG 302 1.036 8.255 -13.728
34 H LYS 303 HN LYS 303 5.949 6.082 -5.475
35 HA LYS 303 HA LYS 303 7.791 4.775 -7.369
36 HB2 LYS 303 3HB LYS 303 8.596 6.457 -4.993
37 HB3 LYS 303 2HB LYS 303 9.612 5.919 -6.340
38 HG2 LYS 303 3HG LYS 303 7.338 7.897 -6.530
39 HG3 LYS 303 2HG LYS 303 9.067 8.288 -6.519
40 HD2 LYS 303 3HD LYS 303 7.756 6.508 -8.582
41 HD3 LYS 303 2HD LYS 303 8.025 8.247 -8.795
42 HE2 LYS 303 3HE LYS 303 10.041 6.026 -8.618
43 HE3 LYS 303 2HE LYS 303 9.870 7.295 -9.840
44 HZ1 LYS 303 3HZ LYS 303 10.399 8.843 -7.835
45 HZ2 LYS 303 1HZ LYS 303 11.652 8.052 -8.649
46 HZ3 LYS 303 2HZ LYS 303 11.088 7.447 -7.174
47 H GLN 304 HN GLN 304 7.085 5.089 -3.890
48 HA GLN 304 HA GLN 304 8.310 2.465 -3.443
49 HB2 GLN 304 3HB GLN 304 7.703 4.830 -1.723
50 HB3 GLN 304 2HB GLN 304 7.743 3.230 -0.964
51 HG2 GLN 304 3HG GLN 304 10.026 3.888 -2.721
52 HG3 GLN 304 2HG GLN 304 9.894 4.809 -1.217
53 HE21 GLN 304 1HE2 GLN 304 10.881 1.919 -2.631
54 HE22 GLN 304 2HE2 GLN 304 11.235 1.040 -1.187
55 HA PRO 305 HA PRO 305 4.526 0.340 -2.814
56 HB2 PRO 305 3HB PRO 305 5.109 -1.295 -0.696
57 HB3 PRO 305 2HB PRO 305 5.767 -1.529 -2.314
58 HG2 PRO 305 3HG PRO 305 7.001 -0.183 0.066
59 HG3 PRO 305 2HG PRO 305 7.733 -1.368 -1.081
60 HD2 PRO 305 3HD PRO 305 8.204 1.301 -1.233
61 HD3 PRO 305 2HD PRO 305 8.124 0.260 -2.665
62 H CYS 306 HN CYS 306 3.111 -0.499 -0.787
63 HA CYS 306 HA CYS 306 1.830 1.701 0.274
64 HB2 CYS 306 3HB CYS 306 1.703 -1.165 0.581
65 HB3 CYS 306 2HB CYS 306 1.462 -0.379 2.143
66 HA PRO 307 HA PRO 307 4.161 3.166 3.690
67 HB2 PRO 307 3HB PRO 307 2.193 3.855 5.466
68 HB3 PRO 307 2HB PRO 307 2.528 4.755 3.988
69 HG2 PRO 307 3HG PRO 307 0.451 2.656 4.507
70 HG3 PRO 307 2HG PRO 307 0.282 4.242 3.667
71 HD2 PRO 307 3HD PRO 307 0.492 1.891 2.328
72 HD3 PRO 307 2HD PRO 307 1.164 3.409 1.707
73 H TYR 308 HN TYR 308 1.694 0.746 4.418
74 HA TYR 308 HA TYR 308 3.384 -0.214 6.633
75 HB2 TYR 308 3HB TYR 308 0.376 -0.209 6.337
76 HB3 TYR 308 2HB TYR 308 1.214 -1.203 7.533
77 HD1 TYR 308 1HD TYR 308 2.456 -0.156 9.393
78 HD2 TYR 308 2HD TYR 308 0.145 2.163 6.675
79 HE1 TYR 308 1HE TYR 308 2.504 1.730 10.971
80 HE2 TYR 308 2HE TYR 308 0.188 4.057 8.245
81 HH TYR 308 HH TYR 308 0.642 3.984 11.200
82 H GLY 309 HN GLY 309 1.146 -1.177 4.055
83 HA2 GLY 309 2HA GLY 309 1.143 -3.046 2.711
84 HA3 GLY 309 3HA GLY 309 2.742 -3.421 3.336
85 H LYS 310 HN LYS 310 2.968 -4.848 5.034
86 HA LYS 310 HA LYS 310 0.906 -6.775 5.337
87 HB2 LYS 310 3HB LYS 310 2.436 -7.754 7.075
88 HB3 LYS 310 2HB LYS 310 3.169 -7.520 5.481
89 HG2 LYS 310 3HG LYS 310 4.373 -5.600 6.211
90 HG3 LYS 310 2HG LYS 310 3.481 -5.561 7.742
91 HD2 LYS 310 3HD LYS 310 4.939 -8.070 7.108
92 HD3 LYS 310 2HD LYS 310 5.916 -6.646 7.508
93 HE2 LYS 310 3HE LYS 310 5.583 -7.651 9.586
94 HE3 LYS 310 2HE LYS 310 4.339 -6.394 9.531
95 HZ1 LYS 310 3HZ LYS 310 3.858 -8.955 10.127
96 HZ2 LYS 310 1HZ LYS 310 3.522 -8.960 8.470
97 HZ3 LYS 310 2HZ LYS 310 2.696 -7.900 9.497
98 H LYS 311 HN LYS 311 2.014 -4.067 7.273
99 HA LYS 311 HA LYS 311 0.315 -4.754 9.511
100 HB2 LYS 311 3HB LYS 311 2.069 -2.366 8.911
101 HB3 LYS 311 2HB LYS 311 1.096 -2.514 10.384
102 HG2 LYS 311 3HG LYS 311 2.363 -4.297 11.204
103 HG3 LYS 311 2HG LYS 311 3.077 -4.625 9.615
104 HD2 LYS 311 3HD LYS 311 4.345 -2.554 9.706
105 HD3 LYS 311 2HD LYS 311 3.577 -2.136 11.247
106 HE2 LYS 311 3HE LYS 311 4.745 -3.751 12.436
107 HE3 LYS 311 2HE LYS 311 5.051 -4.722 10.989
108 HZ1 LYS 311 3HZ LYS 311 6.593 -3.008 10.221
109 HZ2 LYS 311 1HZ LYS 311 7.063 -3.641 11.719
110 HZ3 LYS 311 2HZ LYS 311 6.327 -2.120 11.637
111 H CYS 312 HN CYS 312 0.054 -2.982 6.595
112 HA CYS 312 HA CYS 312 -1.744 -0.974 7.179
113 HB2 CYS 312 3HB CYS 312 -0.627 -1.724 4.926
114 HB3 CYS 312 2HB CYS 312 -2.124 -2.633 4.712
115 H THR 313 HN THR 313 -3.650 -1.006 8.147
116 HA THR 313 HA THR 313 -5.091 -3.418 8.620
117 HB THR 313 HB THR 313 -6.812 -1.953 9.638
118 HG1 THR 313 1HG THR 313 -6.856 -0.022 8.734
119 HG21 THR 313 3HG2 THR 313 -4.161 -0.934 10.583
120 HG22 THR 313 1HG2 THR 313 -4.546 -2.648 10.732
121 HG23 THR 313 2HG2 THR 313 -5.564 -1.443 11.523
122 H TYR 314 HN TYR 314 -5.243 -0.921 6.212
123 HA TYR 314 HA TYR 314 -7.871 -1.253 5.309
124 HB2 TYR 314 3HB TYR 314 -5.509 -0.616 3.534
125 HB3 TYR 314 2HB TYR 314 -7.189 -0.121 3.318
126 HD1 TYR 314 1HD TYR 314 -7.895 0.856 6.006
127 HD2 TYR 314 2HD TYR 314 -4.338 1.404 3.737
128 HE1 TYR 314 1HE TYR 314 -7.459 2.958 7.208
129 HE2 TYR 314 2HE TYR 314 -3.891 3.506 4.932
130 HH TYR 314 HH TYR 314 -4.569 4.906 6.512
131 H GLY 315 HN GLY 315 -4.881 -2.666 3.955
132 HA2 GLY 315 2HA GLY 315 -4.524 -4.712 2.958
133 HA3 GLY 315 3HA GLY 315 -6.106 -5.211 3.541
134 H ILE 316 HN ILE 316 -7.988 -4.539 2.291
135 HA ILE 316 HA ILE 316 -7.367 -4.553 -0.570
136 HB ILE 316 HB ILE 316 -10.062 -4.974 0.718
137 HG12 ILE 316 1HG1 ILE 316 -8.478 -6.645 1.551
138 HG13 ILE 316 2HG1 ILE 316 -9.660 -7.381 0.455
139 HG21 ILE 316 1HG2 ILE 316 -9.041 -4.953 -2.024
140 HG22 ILE 316 2HG2 ILE 316 -10.019 -6.365 -1.627
141 HG23 ILE 316 3HG2 ILE 316 -10.685 -4.745 -1.423
142 HD11 ILE 316 3HD1 ILE 316 -8.002 -8.235 -0.723
143 HD12 ILE 316 1HD1 ILE 316 -7.479 -6.602 -1.139
144 HD13 ILE 316 2HD1 ILE 316 -6.818 -7.405 0.286
145 H LYS 317 HN LYS 317 -8.334 -2.426 1.861
146 HA LYS 317 HA LYS 317 -9.830 -0.671 0.077
147 HB2 LYS 317 3HB LYS 317 -9.079 0.159 2.842
148 HB3 LYS 317 2HB LYS 317 -10.584 0.426 1.949
149 HG2 LYS 317 3HG LYS 317 -9.697 -2.166 3.219
150 HG3 LYS 317 2HG LYS 317 -10.961 -1.072 3.809
151 HD2 LYS 317 3HD LYS 317 -11.695 -1.557 1.177
152 HD3 LYS 317 2HD LYS 317 -11.093 -3.122 1.753
153 HE2 LYS 317 3HE LYS 317 -12.701 -3.291 3.423
154 HE3 LYS 317 2HE LYS 317 -12.982 -1.543 3.450
155 HZ1 LYS 317 3HZ LYS 317 -13.924 -3.506 1.449
156 HZ2 LYS 317 1HZ LYS 317 -13.910 -1.845 1.131
157 HZ3 LYS 317 2HZ LYS 317 -14.845 -2.455 2.402
158 H CYS 318 HN CYS 318 -6.646 -1.096 1.280
159 HA CYS 318 HA CYS 318 -5.598 1.452 1.325
160 HB2 CYS 318 3HB CYS 318 -4.421 -0.712 1.889
161 HB3 CYS 318 2HB CYS 318 -4.174 -0.943 0.157
162 H ARG 319 HN ARG 319 -4.578 2.784 -0.199
163 HA ARG 319 HA ARG 319 -5.582 2.424 -2.933
164 HB2 ARG 319 3HB ARG 319 -4.864 4.789 -1.256
165 HB3 ARG 319 2HB ARG 319 -4.692 4.921 -3.013
166 HG2 ARG 319 3HG ARG 319 -7.105 4.095 -3.156
167 HG3 ARG 319 2HG ARG 319 -7.184 4.436 -1.419
168 HD2 ARG 319 3HD ARG 319 -6.205 6.519 -3.356
169 HD3 ARG 319 2HD ARG 319 -7.934 6.266 -3.077
170 HE ARG 319 HE ARG 319 -6.911 6.532 -0.573
171 HH11 ARG 319 2HH1 ARG 319 -6.767 8.452 -3.473
172 HH12 ARG 319 1HH1 ARG 319 -6.640 9.957 -2.625
173 HH21 ARG 319 2HH2 ARG 319 -6.744 8.508 0.554
174 HH22 ARG 319 1HH2 ARG 319 -6.626 9.988 -0.335
175 H PHE 320 HN PHE 320 -2.679 2.627 -1.049
176 HA PHE 320 HA PHE 320 -0.896 3.148 -3.213
177 HB2 PHE 320 3HB PHE 320 -0.677 2.483 -0.341
178 HB3 PHE 320 2HB PHE 320 0.677 1.952 -1.339
179 HD1 PHE 320 2HD PHE 320 -1.452 5.018 -1.208
180 HD2 PHE 320 1HD PHE 320 2.470 3.366 -1.273
181 HE1 PHE 320 2HE PHE 320 -0.500 7.286 -1.161
182 HE2 PHE 320 1HE PHE 320 3.429 5.632 -1.226
183 HZ PHE 320 HZ PHE 320 1.943 7.596 -1.171
184 H PHE 321 HN PHE 321 0.995 1.483 -3.515
185 HA PHE 321 HA PHE 321 -0.257 -0.935 -4.527
186 HB2 PHE 321 3HB PHE 321 1.321 0.405 -5.921
187 HB3 PHE 321 2HB PHE 321 2.612 -0.018 -4.795
188 HD1 PHE 321 1HD PHE 321 0.339 -1.334 -7.356
189 HD2 PHE 321 2HD PHE 321 3.621 -2.183 -4.783
190 HE1 PHE 321 1HE PHE 321 0.777 -3.408 -8.607
191 HE2 PHE 321 2HE PHE 321 4.066 -4.258 -6.029
192 HZ PHE 321 HZ PHE 321 2.643 -4.873 -7.944
193 H HIS 322 HN HIS 322 -0.226 -2.818 -3.501
194 HA HIS 322 HA HIS 322 1.457 -3.117 -1.136
195 HB2 HIS 322 3HB HIS 322 -1.019 -4.443 -2.165
196 HB3 HIS 322 2HB HIS 322 0.018 -5.342 -1.051
197 HD1 HIS 322 1HD HIS 322 -0.035 -4.709 1.399
198 HD2 HIS 322 2HD HIS 322 -2.199 -2.099 -1.003
199 HE1 HIS 322 1HE HIS 322 -1.320 -3.242 2.988
200 HE2 HIS 322 2HE HIS 322 -2.643 -1.647 1.520
201 HA PRO 323 HA PRO 323 4.344 -5.889 -2.932
202 HB2 PRO 323 3HB PRO 323 4.846 -7.592 -0.847
203 HB3 PRO 323 2HB PRO 323 5.409 -5.922 -0.897
204 HG2 PRO 323 3HG PRO 323 2.992 -7.075 0.453
205 HG3 PRO 323 2HG PRO 323 4.200 -5.899 1.090
206 HD2 PRO 323 3HD PRO 323 1.757 -5.141 0.180
207 HD3 PRO 323 2HD PRO 323 3.203 -4.132 -0.003
208 H GLU 324 HN GLU 324 1.571 -7.351 -1.303
209 HA GLU 324 HA GLU 324 1.826 -9.711 -3.039
210 HB2 GLU 324 3HB GLU 324 0.137 -9.367 -0.550
211 HB3 GLU 324 2HB GLU 324 0.376 -10.865 -1.463
212 HG2 GLU 324 3HG GLU 324 2.601 -11.086 -0.767
213 HG3 GLU 324 2HG GLU 324 2.678 -9.404 -0.222
214 HE2 GLU 324 HE GLU 324 1.686 -12.071 2.376
215 H ARG 325 HN ARG 325 -0.185 -6.999 -2.243
216 HA ARG 325 HA ARG 325 -2.200 -7.937 -4.179
217 HB2 ARG 325 3HB ARG 325 -2.421 -6.306 -1.671
218 HB3 ARG 325 2HB ARG 325 -3.614 -6.098 -2.963
219 HG2 ARG 325 3HG ARG 325 -3.007 -8.855 -1.984
220 HG3 ARG 325 2HG ARG 325 -4.038 -7.787 -1.016
221 HD2 ARG 325 3HD ARG 325 -4.493 -8.548 -3.911
222 HD3 ARG 325 2HD ARG 325 -5.370 -9.185 -2.512
223 HE ARG 325 HE ARG 325 -5.545 -6.360 -2.583
224 HH11 ARG 325 2HH1 ARG 325 -6.763 -9.229 -4.134
225 HH12 ARG 325 1HH1 ARG 325 -8.258 -8.495 -4.611
226 HH21 ARG 325 2HH2 ARG 325 -7.509 -5.382 -3.204
227 HH22 ARG 325 1HH2 ARG 325 -8.682 -6.305 -4.082
228 HA PRO 326 HA PRO 326 -1.359 -4.541 -6.825
229 HB2 PRO 326 3HB PRO 326 -3.856 -3.884 -7.737
230 HB3 PRO 326 2HB PRO 326 -2.999 -5.348 -8.217
231 HG2 PRO 326 3HG PRO 326 -5.100 -4.980 -6.107
232 HG3 PRO 326 2HG PRO 326 -4.954 -6.270 -7.358
233 HD2 PRO 326 3HD PRO 326 -4.231 -6.652 -4.769
234 HD3 PRO 326 2HD PRO 326 -3.392 -7.429 -6.122
235 H SER 327 HN SER 327 -2.547 -2.268 -7.423
236 HA SER 327 HA SER 327 -2.665 -0.831 -4.863
237 HB2 SER 327 1HB SER 327 -0.978 0.246 -5.976
238 HB3 SER 327 2HB SER 327 -1.636 -0.158 -7.570
239 HG SER 327 HG SER 327 -2.461 1.763 -7.589
Start of MODEL 16
1 H1 SER 299 HN SER 299 8.293 13.235 -3.902
2 HA SER 299 HA SER 299 5.722 12.381 -3.381
3 HB2 SER 299 1HB SER 299 7.048 13.226 -5.964
4 HB3 SER 299 2HB SER 299 5.317 12.860 -5.864
5 HG SER 299 HG SER 299 4.978 14.658 -4.798
6 H GLU 300 HN GLU 300 6.569 10.086 -2.802
7 HA GLU 300 HA GLU 300 6.353 8.340 -5.162
8 HB2 GLU 300 3HB GLU 300 7.335 6.580 -3.654
9 HB3 GLU 300 2HB GLU 300 8.410 7.934 -4.030
10 HG2 GLU 300 3HG GLU 300 6.761 8.015 -1.539
11 HG3 GLU 300 2HG GLU 300 8.232 7.031 -1.596
12 HE2 GLU 300 HE GLU 300 10.197 9.982 -2.023
13 H HIS 301 HN HIS 301 3.972 9.018 -4.791
14 HA HIS 301 HA HIS 301 2.586 7.724 -2.640
15 HB2 HIS 301 3HB HIS 301 1.920 9.845 -4.016
16 HB3 HIS 301 2HB HIS 301 1.235 8.673 -5.146
17 HD1 HIS 301 1HD HIS 301 1.019 9.244 -1.382
18 HD2 HIS 301 2HD HIS 301 -1.360 8.185 -4.619
19 HE1 HIS 301 1HE HIS 301 -1.299 8.961 -0.448
20 HE2 HIS 301 2HE HIS 301 -2.754 8.314 -2.427
21 H ARG 302 HN ARG 302 3.399 6.944 -5.944
22 HA ARG 302 HA ARG 302 1.991 4.373 -5.640
23 HB2 ARG 302 3HB ARG 302 1.643 4.291 -8.005
24 HB3 ARG 302 2HB ARG 302 1.093 5.874 -7.433
25 HG2 ARG 302 3HG ARG 302 3.189 6.890 -8.198
26 HG3 ARG 302 2HG ARG 302 3.719 5.307 -8.792
27 HD2 ARG 302 3HD ARG 302 1.422 6.995 -9.782
28 HD3 ARG 302 2HD ARG 302 2.860 6.465 -10.667
29 HE ARG 302 HE ARG 302 1.695 4.129 -10.020
30 HH11 ARG 302 2HH1 ARG 302 0.470 7.043 -11.478
31 HH12 ARG 302 1HH1 ARG 302 -0.738 6.224 -12.411
32 HH21 ARG 302 2HH2 ARG 302 0.109 3.038 -11.242
33 HH22 ARG 302 1HH2 ARG 302 -0.943 3.946 -12.276
34 H LYS 303 HN LYS 303 4.940 6.007 -6.518
35 HA LYS 303 HA LYS 303 6.382 4.009 -7.760
36 HB2 LYS 303 3HB LYS 303 7.423 5.993 -5.721
37 HB3 LYS 303 2HB LYS 303 8.396 5.120 -6.917
38 HG2 LYS 303 3HG LYS 303 6.134 6.824 -7.864
39 HG3 LYS 303 2HG LYS 303 7.647 7.589 -7.344
40 HD2 LYS 303 3HD LYS 303 7.672 5.299 -9.294
41 HD3 LYS 303 2HD LYS 303 7.365 6.959 -9.835
42 HE2 LYS 303 3HE LYS 303 9.492 7.702 -9.210
43 HE3 LYS 303 2HE LYS 303 9.737 6.333 -8.116
44 HZ1 LYS 303 3HZ LYS 303 10.949 6.340 -10.357
45 HZ2 LYS 303 1HZ LYS 303 9.458 5.890 -11.017
46 HZ3 LYS 303 2HZ LYS 303 10.201 4.907 -9.860
47 H GLN 304 HN GLN 304 6.835 4.785 -4.313
48 HA GLN 304 HA GLN 304 7.876 2.169 -3.777
49 HB2 GLN 304 3HB GLN 304 7.387 4.655 -2.201
50 HB3 GLN 304 2HB GLN 304 7.574 3.131 -1.321
51 HG2 GLN 304 3HG GLN 304 9.569 4.369 -3.215
52 HG3 GLN 304 2HG GLN 304 9.692 4.266 -1.454
53 HE21 GLN 304 1HE2 GLN 304 10.278 2.355 -0.492
54 HE22 GLN 304 2HE2 GLN 304 10.876 0.999 -1.379
55 HA PRO 305 HA PRO 305 4.278 -0.002 -2.524
56 HB2 PRO 305 3HB PRO 305 5.171 -1.434 -0.368
57 HB3 PRO 305 2HB PRO 305 5.639 -1.785 -2.031
58 HG2 PRO 305 3HG PRO 305 7.097 -0.210 0.064
59 HG3 PRO 305 2HG PRO 305 7.730 -1.466 -1.064
60 HD2 PRO 305 3HD PRO 305 8.076 1.193 -1.488
61 HD3 PRO 305 2HD PRO 305 7.867 0.033 -2.810
62 H CYS 306 HN CYS 306 2.959 -0.589 -0.470
63 HA CYS 306 HA CYS 306 1.910 1.707 0.643
64 HB2 CYS 306 3HB CYS 306 1.594 -1.144 0.995
65 HB3 CYS 306 2HB CYS 306 1.488 -0.321 2.551
66 HA PRO 307 HA PRO 307 4.527 3.009 3.914
67 HB2 PRO 307 3HB PRO 307 2.722 3.819 5.808
68 HB3 PRO 307 2HB PRO 307 3.022 4.699 4.310
69 HG2 PRO 307 3HG PRO 307 0.850 2.736 4.961
70 HG3 PRO 307 2HG PRO 307 0.733 4.332 4.130
71 HD2 PRO 307 3HD PRO 307 0.707 1.975 2.784
72 HD3 PRO 307 2HD PRO 307 1.435 3.448 2.121
73 H TYR 308 HN TYR 308 1.963 0.748 4.794
74 HA TYR 308 HA TYR 308 3.720 -0.322 6.905
75 HB2 TYR 308 3HB TYR 308 0.731 0.008 6.801
76 HB3 TYR 308 2HB TYR 308 1.464 -1.217 7.841
77 HD1 TYR 308 2HD TYR 308 3.631 -0.174 9.186
78 HD2 TYR 308 1HD TYR 308 0.167 1.950 7.920
79 HE1 TYR 308 2HE TYR 308 4.028 1.507 10.937
80 HE2 TYR 308 1HE TYR 308 0.556 3.637 9.667
81 HH TYR 308 HH TYR 308 1.799 3.617 12.001
82 H GLY 309 HN GLY 309 1.273 -1.137 4.469
83 HA2 GLY 309 2HA GLY 309 0.999 -3.019 3.183
84 HA3 GLY 309 3HA GLY 309 2.661 -3.429 3.580
85 H LYS 310 HN LYS 310 3.086 -4.923 5.156
86 HA LYS 310 HA LYS 310 1.133 -6.853 5.709
87 HB2 LYS 310 3HB LYS 310 2.802 -7.714 7.393
88 HB3 LYS 310 2HB LYS 310 3.419 -7.514 5.745
89 HG2 LYS 310 3HG LYS 310 4.610 -5.545 6.317
90 HG3 LYS 310 2HG LYS 310 3.797 -5.442 7.888
91 HD2 LYS 310 3HD LYS 310 5.375 -7.898 7.236
92 HD3 LYS 310 2HD LYS 310 6.230 -6.415 7.695
93 HE2 LYS 310 3HE LYS 310 5.952 -7.453 9.748
94 HE3 LYS 310 2HE LYS 310 4.557 -6.364 9.682
95 HZ1 LYS 310 3HZ LYS 310 3.137 -8.068 9.645
96 HZ2 LYS 310 1HZ LYS 310 4.435 -9.014 10.178
97 HZ3 LYS 310 2HZ LYS 310 4.052 -8.954 8.531
98 H LYS 311 HN LYS 311 2.188 -4.036 7.501
99 HA LYS 311 HA LYS 311 0.608 -4.761 9.830
100 HB2 LYS 311 3HB LYS 311 2.470 -2.500 9.152
101 HB3 LYS 311 2HB LYS 311 1.393 -2.389 10.552
102 HG2 LYS 311 3HG LYS 311 2.391 -4.330 11.562
103 HG3 LYS 311 2HG LYS 311 3.374 -4.613 10.114
104 HD2 LYS 311 3HD LYS 311 4.899 -3.551 11.479
105 HD3 LYS 311 2HD LYS 311 4.231 -2.183 10.571
106 HE2 LYS 311 3HE LYS 311 2.551 -1.931 12.486
107 HE3 LYS 311 2HE LYS 311 3.600 -3.038 13.384
108 HZ1 LYS 311 3HZ LYS 311 5.452 -1.416 12.809
109 HZ2 LYS 311 1HZ LYS 311 4.328 -0.921 13.972
110 HZ3 LYS 311 2HZ LYS 311 4.227 -0.326 12.391
111 H CYS 312 HN CYS 312 0.258 -2.974 6.929
112 HA CYS 312 HA CYS 312 -1.527 -0.975 7.580
113 HB2 CYS 312 3HB CYS 312 -0.491 -1.542 5.310
114 HB3 CYS 312 2HB CYS 312 -1.824 -2.682 5.112
115 H THR 313 HN THR 313 -3.848 -0.851 7.392
116 HA THR 313 HA THR 313 -5.160 -3.342 8.258
117 HB THR 313 HB THR 313 -6.920 -1.790 9.218
118 HG1 THR 313 1HG THR 313 -6.671 0.253 8.752
119 HG21 THR 313 3HG2 THR 313 -4.373 -1.123 10.582
120 HG22 THR 313 1HG2 THR 313 -4.741 -2.832 10.361
121 HG23 THR 313 2HG2 THR 313 -5.865 -1.794 11.237
122 H TYR 314 HN TYR 314 -5.315 -0.633 6.053
123 HA TYR 314 HA TYR 314 -7.904 -0.955 5.064
124 HB2 TYR 314 3HB TYR 314 -5.514 -0.124 3.408
125 HB3 TYR 314 2HB TYR 314 -7.202 0.336 3.171
126 HD1 TYR 314 1HD TYR 314 -8.271 1.447 5.422
127 HD2 TYR 314 2HD TYR 314 -4.174 1.547 4.279
128 HE1 TYR 314 1HE TYR 314 -7.944 3.465 6.790
129 HE2 TYR 314 2HE TYR 314 -3.835 3.564 5.644
130 HH TYR 314 HH TYR 314 -4.957 4.622 7.675
131 H GLY 315 HN GLY 315 -4.863 -2.199 3.661
132 HA2 GLY 315 2HA GLY 315 -4.450 -4.157 2.519
133 HA3 GLY 315 3HA GLY 315 -6.041 -4.719 3.009
134 H ILE 316 HN ILE 316 -7.893 -3.977 1.760
135 HA ILE 316 HA ILE 316 -7.212 -3.829 -1.072
136 HB ILE 316 HB ILE 316 -9.946 -4.146 0.165
137 HG12 ILE 316 1HG1 ILE 316 -8.506 -5.972 0.887
138 HG13 ILE 316 2HG1 ILE 316 -9.685 -6.555 -0.300
139 HG21 ILE 316 1HG2 ILE 316 -10.339 -3.526 -2.015
140 HG22 ILE 316 2HG2 ILE 316 -8.862 -4.284 -2.609
141 HG23 ILE 316 3HG2 ILE 316 -10.248 -5.281 -2.170
142 HD11 ILE 316 3HD1 ILE 316 -8.029 -7.411 -1.480
143 HD12 ILE 316 1HD1 ILE 316 -7.422 -5.781 -1.767
144 HD13 ILE 316 2HD1 ILE 316 -6.840 -6.709 -0.384
145 H LYS 317 HN LYS 317 -8.562 -1.884 1.462
146 HA LYS 317 HA LYS 317 -9.423 0.163 -0.452
147 HB2 LYS 317 3HB LYS 317 -10.500 1.251 1.451
148 HB3 LYS 317 2HB LYS 317 -11.008 -0.441 1.321
149 HG2 LYS 317 3HG LYS 317 -9.185 -0.944 3.047
150 HG3 LYS 317 2HG LYS 317 -9.165 0.806 3.328
151 HD2 LYS 317 3HD LYS 317 -10.694 0.131 4.916
152 HD3 LYS 317 2HD LYS 317 -11.757 0.507 3.549
153 HE2 LYS 317 3HE LYS 317 -10.672 -2.271 3.977
154 HE3 LYS 317 2HE LYS 317 -12.134 -1.705 4.797
155 HZ1 LYS 317 3HZ LYS 317 -13.113 -2.508 2.956
156 HZ2 LYS 317 1HZ LYS 317 -11.723 -2.369 2.001
157 HZ3 LYS 317 2HZ LYS 317 -12.688 -1.010 2.294
158 H CYS 318 HN CYS 318 -6.588 -0.513 0.223
159 HA CYS 318 HA CYS 318 -5.601 1.741 1.721
160 HB2 CYS 318 3HB CYS 318 -4.467 -0.454 1.763
161 HB3 CYS 318 2HB CYS 318 -4.099 -0.282 0.047
162 H ARG 319 HN ARG 319 -4.403 3.479 0.924
163 HA ARG 319 HA ARG 319 -5.028 4.177 -1.846
164 HB2 ARG 319 3HB ARG 319 -4.039 5.822 0.493
165 HB3 ARG 319 2HB ARG 319 -4.263 6.466 -1.142
166 HG2 ARG 319 3HG ARG 319 -6.272 7.066 -0.301
167 HG3 ARG 319 2HG ARG 319 -6.687 5.412 -0.781
168 HD2 ARG 319 3HD ARG 319 -6.575 4.600 1.403
169 HD3 ARG 319 2HD ARG 319 -5.581 5.959 1.945
170 HE ARG 319 HE ARG 319 -8.123 6.877 1.107
171 HH11 ARG 319 2HH1 ARG 319 -6.534 5.185 3.702
172 HH12 ARG 319 1HH1 ARG 319 -7.687 5.675 4.901
173 HH21 ARG 319 2HH2 ARG 319 -9.647 7.527 2.674
174 HH22 ARG 319 1HH2 ARG 319 -9.457 7.006 4.314
175 H PHE 320 HN PHE 320 -2.935 2.249 -1.204
176 HA PHE 320 HA PHE 320 -0.775 3.529 -2.679
177 HB2 PHE 320 3HB PHE 320 -0.602 2.642 0.141
178 HB3 PHE 320 2HB PHE 320 0.726 2.128 -0.903
179 HD1 PHE 320 1HD PHE 320 -1.070 5.090 0.371
180 HD2 PHE 320 2HD PHE 320 2.396 3.629 -1.621
181 HE1 PHE 320 1HE PHE 320 -0.013 7.300 0.598
182 HE2 PHE 320 2HE PHE 320 3.459 5.836 -1.396
183 HZ PHE 320 HZ PHE 320 2.255 7.675 -0.286
184 H PHE 321 HN PHE 321 1.046 1.706 -2.954
185 HA PHE 321 HA PHE 321 -0.383 -0.576 -4.099
186 HB2 PHE 321 3HB PHE 321 1.184 0.829 -5.495
187 HB3 PHE 321 2HB PHE 321 2.508 0.197 -4.515
188 HD1 PHE 321 1HD PHE 321 -0.069 -0.694 -6.977
189 HD2 PHE 321 2HD PHE 321 3.338 -2.019 -4.797
190 HE1 PHE 321 1HE PHE 321 0.094 -2.669 -8.438
191 HE2 PHE 321 2HE PHE 321 3.506 -3.994 -6.253
192 HZ PHE 321 HZ PHE 321 1.884 -4.320 -8.078
193 H HIS 322 HN HIS 322 -0.552 -2.296 -2.826
194 HA HIS 322 HA HIS 322 1.230 -2.795 -0.646
195 HB2 HIS 322 3HB HIS 322 -1.210 -4.053 -1.776
196 HB3 HIS 322 2HB HIS 322 -0.138 -5.112 -0.855
197 HD1 HIS 322 1HD HIS 322 -0.297 -5.018 1.636
198 HD2 HIS 322 2HD HIS 322 -2.150 -1.778 -0.189
199 HE1 HIS 322 1HE HIS 322 -1.474 -3.786 3.486
200 HE2 HIS 322 2HE HIS 322 -2.606 -1.805 2.371
201 HA PRO 323 HA PRO 323 4.282 -5.324 -2.527
202 HB2 PRO 323 3HB PRO 323 4.819 -7.117 -0.527
203 HB3 PRO 323 2HB PRO 323 5.305 -5.424 -0.472
204 HG2 PRO 323 3HG PRO 323 2.914 -6.757 0.755
205 HG3 PRO 323 2HG PRO 323 4.055 -5.565 1.484
206 HD2 PRO 323 3HD PRO 323 1.599 -4.868 0.559
207 HD3 PRO 323 2HD PRO 323 2.999 -3.786 0.466
208 H GLU 324 HN GLU 324 1.298 -6.692 -1.478
209 HA GLU 324 HA GLU 324 1.848 -9.183 -2.939
210 HB2 GLU 324 3HB GLU 324 -0.526 -8.661 -1.153
211 HB3 GLU 324 2HB GLU 324 0.115 -10.218 -1.697
212 HG2 GLU 324 3HG GLU 324 2.216 -8.954 -0.323
213 HG3 GLU 324 2HG GLU 324 0.759 -8.718 0.652
214 HE2 GLU 324 HE GLU 324 2.083 -12.430 0.163
215 H ARG 325 HN ARG 325 0.869 -6.322 -3.775
216 HA ARG 325 HA ARG 325 -1.710 -6.476 -4.790
217 HB2 ARG 325 3HB ARG 325 0.746 -4.954 -5.595
218 HB3 ARG 325 2HB ARG 325 -0.707 -4.874 -6.603
219 HG2 ARG 325 3HG ARG 325 -0.703 -4.238 -3.656
220 HG3 ARG 325 2HG ARG 325 -0.461 -3.029 -4.929
221 HD2 ARG 325 3HD ARG 325 -2.853 -4.851 -4.970
222 HD3 ARG 325 2HD ARG 325 -2.839 -3.380 -3.988
223 HE ARG 325 HE ARG 325 -2.047 -2.671 -6.561
224 HH11 ARG 325 2HH1 ARG 325 -4.862 -3.921 -4.940
225 HH12 ARG 325 1HH1 ARG 325 -5.982 -3.209 -6.055
226 HH21 ARG 325 2HH2 ARG 325 -3.510 -1.729 -8.036
227 HH22 ARG 325 1HH2 ARG 325 -5.211 -1.964 -7.816
228 HA PRO 326 HA PRO 326 -1.644 -9.232 -8.201
229 HB2 PRO 326 3HB PRO 326 -3.282 -7.970 -9.997
230 HB3 PRO 326 2HB PRO 326 -3.864 -8.735 -8.519
231 HG2 PRO 326 3HG PRO 326 -3.237 -5.850 -9.050
232 HG3 PRO 326 2HG PRO 326 -4.664 -6.572 -8.217
233 HD2 PRO 326 3HD PRO 326 -2.589 -5.456 -6.868
234 HD3 PRO 326 2HD PRO 326 -3.498 -6.843 -6.246
235 H SER 327 HN SER 327 -1.459 -9.191 -10.731
236 HA SER 327 HA SER 327 -0.145 -8.827 -12.551
237 HB2 SER 327 1HB SER 327 -1.183 -6.454 -12.117
238 HB3 SER 327 2HB SER 327 0.466 -6.043 -11.613
239 HG SER 327 HG SER 327 0.875 -5.835 -13.655
Start of MODEL 17
1 H1 SER 299 HN SER 299 8.795 13.758 -3.050
2 HA SER 299 HA SER 299 7.135 12.082 -1.983
3 HB2 SER 299 1HB SER 299 6.502 14.161 -3.316
4 HB3 SER 299 2HB SER 299 6.385 13.096 -4.728
5 HG SER 299 HG SER 299 4.752 11.957 -3.720
6 H GLU 300 HN GLU 300 6.904 9.956 -1.964
7 HA GLU 300 HA GLU 300 7.117 8.494 -4.515
8 HB2 GLU 300 3HB GLU 300 7.933 6.555 -3.207
9 HB3 GLU 300 2HB GLU 300 9.015 7.954 -3.119
10 HG2 GLU 300 3HG GLU 300 6.957 7.599 -0.990
11 HG3 GLU 300 2HG GLU 300 8.400 6.575 -0.977
12 HE2 GLU 300 HE GLU 300 8.802 10.002 0.603
13 H HIS 301 HN HIS 301 4.700 9.341 -4.155
14 HA HIS 301 HA HIS 301 3.051 7.799 -2.428
15 HB2 HIS 301 3HB HIS 301 2.581 10.092 -3.541
16 HB3 HIS 301 2HB HIS 301 2.061 9.135 -4.932
17 HD1 HIS 301 1HD HIS 301 0.753 10.607 -1.947
18 HD2 HIS 301 2HD HIS 301 -0.045 7.155 -4.118
19 HE1 HIS 301 1HE HIS 301 -1.543 9.876 -1.227
20 HE2 HIS 301 2HE HIS 301 -2.033 7.767 -2.554
21 H ARG 302 HN ARG 302 4.078 7.473 -5.773
22 HA ARG 302 HA ARG 302 2.650 4.898 -5.905
23 HB2 ARG 302 3HB ARG 302 2.655 5.150 -8.352
24 HB3 ARG 302 2HB ARG 302 1.808 6.482 -7.552
25 HG2 ARG 302 3HG ARG 302 4.696 6.815 -8.227
26 HG3 ARG 302 2HG ARG 302 3.480 6.941 -9.510
27 HD2 ARG 302 3HD ARG 302 2.349 8.488 -7.571
28 HD3 ARG 302 2HD ARG 302 4.073 8.764 -7.284
29 HE ARG 302 HE ARG 302 4.122 10.030 -9.175
30 HH11 ARG 302 2HH1 ARG 302 1.379 7.894 -9.348
31 HH12 ARG 302 1HH1 ARG 302 0.777 8.573 -10.824
32 HH21 ARG 302 2HH2 ARG 302 3.340 10.933 -11.118
33 HH22 ARG 302 1HH2 ARG 302 1.895 10.301 -11.830
34 H LYS 303 HN LYS 303 5.682 6.531 -6.159
35 HA LYS 303 HA LYS 303 7.179 4.656 -7.598
36 HB2 LYS 303 3HB LYS 303 8.154 6.370 -5.302
37 HB3 LYS 303 2HB LYS 303 9.137 5.674 -6.600
38 HG2 LYS 303 3HG LYS 303 7.004 7.787 -6.928
39 HG3 LYS 303 2HG LYS 303 8.758 8.043 -6.970
40 HD2 LYS 303 3HD LYS 303 8.940 6.589 -8.937
41 HD3 LYS 303 2HD LYS 303 7.188 6.324 -8.894
42 HE2 LYS 303 3HE LYS 303 7.792 8.015 -10.567
43 HE3 LYS 303 2HE LYS 303 6.796 8.697 -9.274
44 HZ1 LYS 303 3HZ LYS 303 9.755 8.910 -9.408
45 HZ2 LYS 303 1HZ LYS 303 8.748 9.635 -8.257
46 HZ3 LYS 303 2HZ LYS 303 8.676 10.127 -9.873
47 H GLN 304 HN GLN 304 6.960 5.030 -4.055
48 HA GLN 304 HA GLN 304 8.050 2.350 -3.714
49 HB2 GLN 304 3HB GLN 304 7.798 4.770 -2.060
50 HB3 GLN 304 2HB GLN 304 7.510 3.255 -1.189
51 HG2 GLN 304 3HG GLN 304 9.760 2.612 -2.547
52 HG3 GLN 304 2HG GLN 304 9.997 4.348 -2.304
53 HE21 GLN 304 1HE2 GLN 304 11.638 4.173 -0.841
54 HE22 GLN 304 2HE2 GLN 304 11.430 3.540 0.752
55 HA PRO 305 HA PRO 305 4.274 0.304 -2.831
56 HB2 PRO 305 3HB PRO 305 4.963 -1.352 -0.761
57 HB3 PRO 305 2HB PRO 305 5.504 -1.593 -2.421
58 HG2 PRO 305 3HG PRO 305 6.928 -0.286 -0.128
59 HG3 PRO 305 2HG PRO 305 7.552 -1.480 -1.326
60 HD2 PRO 305 3HD PRO 305 8.070 1.178 -1.504
61 HD3 PRO 305 2HD PRO 305 7.870 0.145 -2.929
62 H CYS 306 HN CYS 306 2.969 -0.503 -0.727
63 HA CYS 306 HA CYS 306 1.824 1.723 0.430
64 HB2 CYS 306 3HB CYS 306 1.624 -1.137 0.713
65 HB3 CYS 306 2HB CYS 306 1.529 -0.373 2.301
66 HA PRO 307 HA PRO 307 4.429 3.095 3.683
67 HB2 PRO 307 3HB PRO 307 2.601 3.875 5.569
68 HB3 PRO 307 2HB PRO 307 2.888 4.755 4.069
69 HG2 PRO 307 3HG PRO 307 0.754 2.750 4.720
70 HG3 PRO 307 2HG PRO 307 0.607 4.341 3.884
71 HD2 PRO 307 3HD PRO 307 0.634 1.979 2.545
72 HD3 PRO 307 2HD PRO 307 1.333 3.465 1.880
73 H TYR 308 HN TYR 308 1.895 0.802 4.582
74 HA TYR 308 HA TYR 308 3.678 -0.240 6.685
75 HB2 TYR 308 3HB TYR 308 0.676 0.017 6.598
76 HB3 TYR 308 2HB TYR 308 1.466 -1.141 7.672
77 HD1 TYR 308 2HD TYR 308 2.937 -0.362 9.502
78 HD2 TYR 308 1HD TYR 308 0.723 2.369 7.104
79 HE1 TYR 308 2HE TYR 308 3.287 1.394 11.187
80 HE2 TYR 308 1HE TYR 308 1.069 4.132 8.784
81 HH TYR 308 HH TYR 308 3.042 4.485 10.703
82 H GLY 309 HN GLY 309 1.220 -1.091 4.273
83 HA2 GLY 309 2HA GLY 309 0.995 -2.969 2.967
84 HA3 GLY 309 3HA GLY 309 2.636 -3.398 3.426
85 H LYS 310 HN LYS 310 2.973 -4.947 4.944
86 HA LYS 310 HA LYS 310 0.914 -6.774 5.500
87 HB2 LYS 310 3HB LYS 310 2.570 -7.762 7.130
88 HB3 LYS 310 2HB LYS 310 3.152 -7.580 5.467
89 HG2 LYS 310 3HG LYS 310 4.497 -5.719 6.020
90 HG3 LYS 310 2HG LYS 310 3.718 -5.547 7.603
91 HD2 LYS 310 3HD LYS 310 4.783 -7.441 8.480
92 HD3 LYS 310 2HD LYS 310 5.201 -8.051 6.869
93 HE2 LYS 310 3HE LYS 310 7.201 -7.193 7.896
94 HE3 LYS 310 2HE LYS 310 6.722 -6.108 6.582
95 HZ1 LYS 310 3HZ LYS 310 5.580 -5.370 9.108
96 HZ2 LYS 310 1HZ LYS 310 6.431 -4.427 7.991
97 HZ3 LYS 310 2HZ LYS 310 7.271 -5.355 9.128
98 H LYS 311 HN LYS 311 2.189 -4.058 7.305
99 HA LYS 311 HA LYS 311 0.665 -4.721 9.681
100 HB2 LYS 311 3HB LYS 311 2.380 -2.328 8.980
101 HB3 LYS 311 2HB LYS 311 1.591 -2.569 10.546
102 HG2 LYS 311 3HG LYS 311 2.947 -4.404 11.092
103 HG3 LYS 311 2HG LYS 311 3.494 -4.592 9.417
104 HD2 LYS 311 3HD LYS 311 4.909 -2.735 9.524
105 HD3 LYS 311 2HD LYS 311 4.072 -2.076 10.940
106 HE2 LYS 311 3HE LYS 311 5.575 -4.691 11.033
107 HE3 LYS 311 2HE LYS 311 6.356 -3.131 11.334
108 HZ1 LYS 311 3HZ LYS 311 5.624 -4.232 13.382
109 HZ2 LYS 311 1HZ LYS 311 4.020 -4.167 12.848
110 HZ3 LYS 311 2HZ LYS 311 4.863 -2.736 13.164
111 H CYS 312 HN CYS 312 0.235 -2.940 6.793
112 HA CYS 312 HA CYS 312 -1.454 -0.880 7.511
113 HB2 CYS 312 3HB CYS 312 -0.534 -1.667 5.180
114 HB3 CYS 312 2HB CYS 312 -2.076 -2.520 5.082
115 H THR 313 HN THR 313 -3.703 -0.655 7.681
116 HA THR 313 HA THR 313 -5.046 -3.059 8.666
117 HB THR 313 HB THR 313 -6.800 -1.390 9.444
118 HG1 THR 313 1HG THR 313 -6.193 0.354 8.099
119 HG21 THR 313 3HG2 THR 313 -4.837 -0.357 11.068
120 HG22 THR 313 1HG2 THR 313 -4.103 -1.844 10.467
121 HG23 THR 313 2HG2 THR 313 -5.655 -1.901 11.304
122 H TYR 314 HN TYR 314 -5.385 -0.515 6.250
123 HA TYR 314 HA TYR 314 -7.943 -1.012 5.331
124 HB2 TYR 314 3HB TYR 314 -5.579 -0.332 3.567
125 HB3 TYR 314 2HB TYR 314 -7.279 0.033 3.261
126 HD1 TYR 314 2HD TYR 314 -8.249 1.159 5.736
127 HD2 TYR 314 1HD TYR 314 -4.475 1.696 3.847
128 HE1 TYR 314 2HE TYR 314 -8.011 3.341 6.844
129 HE2 TYR 314 1HE TYR 314 -4.225 3.879 4.951
130 HH TYR 314 HH TYR 314 -5.074 5.050 6.928
131 H GLY 315 HN GLY 315 -4.926 -2.382 3.996
132 HA2 GLY 315 2HA GLY 315 -4.525 -4.468 3.094
133 HA3 GLY 315 3HA GLY 315 -6.119 -4.962 3.643
134 H ILE 316 HN ILE 316 -7.976 -4.170 2.333
135 HA ILE 316 HA ILE 316 -7.295 -4.389 -0.505
136 HB ILE 316 HB ILE 316 -9.988 -4.622 0.842
137 HG12 ILE 316 1HG1 ILE 316 -8.260 -6.804 -0.341
138 HG13 ILE 316 2HG1 ILE 316 -8.307 -6.419 1.388
139 HG21 ILE 316 1HG2 ILE 316 -9.156 -4.467 -1.948
140 HG22 ILE 316 2HG2 ILE 316 -10.141 -5.883 -1.590
141 HG23 ILE 316 3HG2 ILE 316 -10.754 -4.270 -1.228
142 HD11 ILE 316 3HD1 ILE 316 -10.272 -7.446 1.705
143 HD12 ILE 316 1HD1 ILE 316 -10.930 -6.893 0.165
144 HD13 ILE 316 2HD1 ILE 316 -9.853 -8.289 0.213
145 H LYS 317 HN LYS 317 -8.484 -2.148 1.821
146 HA LYS 317 HA LYS 317 -9.636 -0.364 -0.154
147 HB2 LYS 317 3HB LYS 317 -9.109 0.489 2.660
148 HB3 LYS 317 2HB LYS 317 -10.487 0.853 1.609
149 HG2 LYS 317 3HG LYS 317 -10.862 -1.782 1.879
150 HG3 LYS 317 2HG LYS 317 -10.031 -1.445 3.408
151 HD2 LYS 317 3HD LYS 317 -11.702 -0.029 4.174
152 HD3 LYS 317 2HD LYS 317 -12.297 0.302 2.538
153 HE2 LYS 317 3HE LYS 317 -13.311 -1.854 2.366
154 HE3 LYS 317 2HE LYS 317 -12.506 -2.402 3.844
155 HZ1 LYS 317 3HZ LYS 317 -14.822 -1.857 4.250
156 HZ2 LYS 317 1HZ LYS 317 -14.574 -0.275 3.702
157 HZ3 LYS 317 2HZ LYS 317 -13.809 -0.812 5.112
158 H CYS 318 HN CYS 318 -6.592 -0.946 1.260
159 HA CYS 318 HA CYS 318 -5.400 1.534 1.413
160 HB2 CYS 318 3HB CYS 318 -4.339 -0.616 2.058
161 HB3 CYS 318 2HB CYS 318 -4.120 -0.992 0.348
162 H ARG 319 HN ARG 319 -5.055 3.106 -0.000
163 HA ARG 319 HA ARG 319 -5.652 2.755 -2.781
164 HB2 ARG 319 3HB ARG 319 -5.869 4.859 -1.153
165 HB3 ARG 319 2HB ARG 319 -4.267 5.206 -1.820
166 HG2 ARG 319 3HG ARG 319 -5.544 4.706 -4.109
167 HG3 ARG 319 2HG ARG 319 -6.915 5.256 -3.132
168 HD2 ARG 319 3HD ARG 319 -5.405 7.247 -2.485
169 HD3 ARG 319 2HD ARG 319 -4.416 6.746 -3.865
170 HE ARG 319 HE ARG 319 -6.984 8.038 -3.954
171 HH11 ARG 319 2HH1 ARG 319 -4.720 6.034 -5.678
172 HH12 ARG 319 1HH1 ARG 319 -5.327 6.466 -7.241
173 HH21 ARG 319 2HH2 ARG 319 -7.793 8.616 -6.007
174 HH22 ARG 319 1HH2 ARG 319 -7.075 7.935 -7.428
175 H PHE 320 HN PHE 320 -2.771 2.842 -0.831
176 HA PHE 320 HA PHE 320 -0.924 3.319 -2.939
177 HB2 PHE 320 3HB PHE 320 -0.792 2.524 -0.089
178 HB3 PHE 320 2HB PHE 320 0.569 2.014 -1.089
179 HD1 PHE 320 2HD PHE 320 -1.476 5.077 -0.489
180 HD2 PHE 320 1HD PHE 320 2.367 3.422 -1.268
181 HE1 PHE 320 2HE PHE 320 -0.478 7.318 -0.309
182 HE2 PHE 320 1HE PHE 320 3.372 5.661 -1.088
183 HZ PHE 320 HZ PHE 320 1.949 7.613 -0.609
184 H PHE 321 HN PHE 321 0.914 1.561 -3.205
185 HA PHE 321 HA PHE 321 -0.434 -0.781 -4.300
186 HB2 PHE 321 3HB PHE 321 1.040 0.329 -5.829
187 HB3 PHE 321 2HB PHE 321 2.354 0.325 -4.651
188 HD1 PHE 321 1HD PHE 321 0.076 -2.240 -6.130
189 HD2 PHE 321 2HD PHE 321 4.057 -1.123 -5.122
190 HE1 PHE 321 1HE PHE 321 0.899 -4.379 -7.026
191 HE2 PHE 321 2HE PHE 321 4.887 -3.260 -6.016
192 HZ PHE 321 HZ PHE 321 3.307 -4.890 -6.971
193 H HIS 322 HN HIS 322 -0.616 -2.522 -3.066
194 HA HIS 322 HA HIS 322 1.132 -2.956 -0.809
195 HB2 HIS 322 3HB HIS 322 -1.381 -4.161 -1.854
196 HB3 HIS 322 2HB HIS 322 -0.354 -5.190 -0.850
197 HD1 HIS 322 1HD HIS 322 -0.351 -4.788 1.642
198 HD2 HIS 322 2HD HIS 322 -2.385 -1.843 -0.466
199 HE1 HIS 322 1HE HIS 322 -1.515 -3.398 3.384
200 HE2 HIS 322 2HE HIS 322 -2.757 -1.597 2.097
201 HA PRO 323 HA PRO 323 4.007 -5.724 -2.633
202 HB2 PRO 323 3HB PRO 323 4.504 -7.438 -0.555
203 HB3 PRO 323 2HB PRO 323 5.075 -5.771 -0.600
204 HG2 PRO 323 3HG PRO 323 2.654 -6.915 0.750
205 HG3 PRO 323 2HG PRO 323 3.871 -5.747 1.389
206 HD2 PRO 323 3HD PRO 323 1.431 -4.973 0.488
207 HD3 PRO 323 2HD PRO 323 2.881 -3.971 0.304
208 H GLU 324 HN GLU 324 1.094 -7.029 -1.205
209 HA GLU 324 HA GLU 324 1.426 -9.515 -2.736
210 HB2 GLU 324 3HB GLU 324 -0.657 -8.944 -0.624
211 HB3 GLU 324 2HB GLU 324 -0.191 -10.517 -1.290
212 HG2 GLU 324 3HG GLU 324 2.148 -9.336 -0.217
213 HG3 GLU 324 2HG GLU 324 0.855 -9.157 0.977
214 HE2 GLU 324 HE GLU 324 0.520 -12.721 1.124
215 H ARG 325 HN ARG 325 0.332 -6.632 -3.402
216 HA ARG 325 HA ARG 325 -2.180 -7.529 -4.646
217 HB2 ARG 325 3HB ARG 325 -1.203 -4.861 -3.684
218 HB3 ARG 325 2HB ARG 325 -2.427 -4.939 -4.959
219 HG2 ARG 325 3HG ARG 325 -2.728 -6.319 -2.296
220 HG3 ARG 325 2HG ARG 325 -3.314 -4.681 -2.630
221 HD2 ARG 325 3HD ARG 325 -4.886 -5.427 -4.211
222 HD3 ARG 325 2HD ARG 325 -4.087 -6.997 -4.372
223 HE ARG 325 HE ARG 325 -6.021 -6.239 -2.390
224 HH11 ARG 325 2HH1 ARG 325 -3.378 -8.382 -3.130
225 HH12 ARG 325 1HH1 ARG 325 -3.884 -9.603 -2.010
226 HH21 ARG 325 2HH2 ARG 325 -6.697 -7.839 -0.912
227 HH22 ARG 325 1HH2 ARG 325 -5.772 -9.294 -0.750
228 HA PRO 326 HA PRO 326 -0.545 -7.149 -8.700
229 HB2 PRO 326 3HB PRO 326 -2.669 -6.116 -10.087
230 HB3 PRO 326 2HB PRO 326 -2.612 -7.771 -9.484
231 HG2 PRO 326 3HG PRO 326 -3.904 -5.350 -8.275
232 HG3 PRO 326 2HG PRO 326 -4.560 -7.020 -8.461
233 HD2 PRO 326 3HD PRO 326 -3.566 -6.090 -6.112
234 HD3 PRO 326 2HD PRO 326 -3.412 -7.783 -6.614
235 H SER 327 HN SER 327 0.613 -5.743 -9.918
236 HA SER 327 HA SER 327 0.844 -3.032 -9.019
237 HB2 SER 327 1HB SER 327 2.683 -4.636 -9.975
238 HB3 SER 327 2HB SER 327 2.117 -4.037 -11.545
239 HG SER 327 HG SER 327 3.731 -2.828 -9.788
Start of MODEL 18
1 H1 SER 299 HN SER 299 8.738 13.418 -2.322
2 HA SER 299 HA SER 299 6.186 12.541 -2.526
3 HB2 SER 299 1HB SER 299 6.313 13.264 -4.994
4 HB3 SER 299 2HB SER 299 6.747 14.468 -3.767
5 HG SER 299 HG SER 299 8.416 14.595 -5.120
6 H GLU 300 HN GLU 300 6.750 10.180 -2.047
7 HA GLU 300 HA GLU 300 6.930 8.698 -4.588
8 HB2 GLU 300 3HB GLU 300 7.742 6.774 -3.160
9 HB3 GLU 300 2HB GLU 300 8.859 8.139 -3.326
10 HG2 GLU 300 3HG GLU 300 7.000 8.034 -0.988
11 HG3 GLU 300 2HG GLU 300 8.461 7.037 -1.002
12 HE2 GLU 300 HE GLU 300 8.865 10.712 0.025
13 H HIS 301 HN HIS 301 4.519 9.342 -4.396
14 HA HIS 301 HA HIS 301 2.923 7.833 -2.555
15 HB2 HIS 301 3HB HIS 301 2.105 9.288 -5.083
16 HB3 HIS 301 2HB HIS 301 1.013 8.707 -3.822
17 HD1 HIS 301 1HD HIS 301 3.335 9.806 -1.649
18 HD2 HIS 301 2HD HIS 301 1.030 11.894 -4.404
19 HE1 HIS 301 1HE HIS 301 3.263 12.174 -0.808
20 HE2 HIS 301 2HE HIS 301 1.854 13.452 -2.491
21 H ARG 302 HN ARG 302 4.020 7.432 -5.859
22 HA ARG 302 HA ARG 302 2.633 4.835 -5.958
23 HB2 ARG 302 3HB ARG 302 2.950 5.074 -8.482
24 HB3 ARG 302 2HB ARG 302 1.747 6.122 -7.717
25 HG2 ARG 302 3HG ARG 302 3.244 8.004 -7.774
26 HG3 ARG 302 2HG ARG 302 4.556 6.977 -8.376
27 HD2 ARG 302 3HD ARG 302 3.539 8.289 -10.186
28 HD3 ARG 302 2HD ARG 302 3.322 6.550 -10.425
29 HE ARG 302 HE ARG 302 1.084 7.604 -9.072
30 HH11 ARG 302 2HH1 ARG 302 2.601 7.588 -12.206
31 HH12 ARG 302 1HH1 ARG 302 1.120 7.828 -13.070
32 HH21 ARG 302 2HH2 ARG 302 -0.874 7.921 -10.199
33 HH22 ARG 302 1HH2 ARG 302 -0.857 8.018 -11.927
34 H LYS 303 HN LYS 303 5.651 6.508 -6.194
35 HA LYS 303 HA LYS 303 7.231 4.644 -7.525
36 HB2 LYS 303 3HB LYS 303 8.065 6.378 -5.189
37 HB3 LYS 303 2HB LYS 303 9.132 5.671 -6.412
38 HG2 LYS 303 3HG LYS 303 7.026 7.786 -6.876
39 HG3 LYS 303 2HG LYS 303 8.784 8.017 -6.865
40 HD2 LYS 303 3HD LYS 303 8.978 6.458 -8.783
41 HD3 LYS 303 2HD LYS 303 7.208 6.344 -8.823
42 HE2 LYS 303 3HE LYS 303 7.656 7.960 -10.441
43 HE3 LYS 303 2HE LYS 303 7.263 8.917 -9.006
44 HZ1 LYS 303 3HZ LYS 303 9.236 9.746 -10.149
45 HZ2 LYS 303 1HZ LYS 303 10.014 8.262 -9.915
46 HZ3 LYS 303 2HZ LYS 303 9.611 9.224 -8.584
47 H GLN 304 HN GLN 304 7.130 5.059 -3.982
48 HA GLN 304 HA GLN 304 8.123 2.364 -3.619
49 HB2 GLN 304 3HB GLN 304 7.634 4.728 -1.858
50 HB3 GLN 304 2HB GLN 304 7.700 3.123 -1.115
51 HG2 GLN 304 3HG GLN 304 9.890 3.836 -2.984
52 HG3 GLN 304 2HG GLN 304 9.848 4.657 -1.417
53 HE21 GLN 304 1HE2 GLN 304 11.068 2.075 -3.003
54 HE22 GLN 304 2HE2 GLN 304 11.365 1.018 -1.668
55 HA PRO 305 HA PRO 305 4.336 0.304 -2.816
56 HB2 PRO 305 3HB PRO 305 4.995 -1.356 -0.739
57 HB3 PRO 305 2HB PRO 305 5.566 -1.590 -2.389
58 HG2 PRO 305 3HG PRO 305 6.942 -0.283 -0.066
59 HG3 PRO 305 2HG PRO 305 7.593 -1.472 -1.255
60 HD2 PRO 305 3HD PRO 305 8.104 1.189 -1.417
61 HD3 PRO 305 2HD PRO 305 7.935 0.158 -2.847
62 H CYS 306 HN CYS 306 2.997 -0.514 -0.738
63 HA CYS 306 HA CYS 306 1.819 1.701 0.402
64 HB2 CYS 306 3HB CYS 306 1.637 -1.161 0.684
65 HB3 CYS 306 2HB CYS 306 1.503 -0.396 2.268
66 HA PRO 307 HA PRO 307 4.353 3.090 3.703
67 HB2 PRO 307 3HB PRO 307 2.489 3.843 5.562
68 HB3 PRO 307 2HB PRO 307 2.788 4.731 4.070
69 HG2 PRO 307 3HG PRO 307 0.668 2.701 4.681
70 HG3 PRO 307 2HG PRO 307 0.515 4.294 3.847
71 HD2 PRO 307 3HD PRO 307 0.589 1.937 2.503
72 HD3 PRO 307 2HD PRO 307 1.283 3.432 1.852
73 H TYR 308 HN TYR 308 1.833 0.762 4.552
74 HA TYR 308 HA TYR 308 3.593 -0.264 6.682
75 HB2 TYR 308 3HB TYR 308 0.590 -0.041 6.543
76 HB3 TYR 308 2HB TYR 308 1.373 -1.198 7.623
77 HD1 TYR 308 2HD TYR 308 3.210 -0.225 9.215
78 HD2 TYR 308 1HD TYR 308 0.197 2.118 7.335
79 HE1 TYR 308 2HE TYR 308 3.514 1.523 10.918
80 HE2 TYR 308 1HE TYR 308 0.493 3.873 9.032
81 HH TYR 308 HH TYR 308 2.630 3.412 11.797
82 H GLY 309 HN GLY 309 1.186 -1.137 4.225
83 HA2 GLY 309 2HA GLY 309 1.021 -3.010 2.900
84 HA3 GLY 309 3HA GLY 309 2.650 -3.431 3.409
85 H LYS 310 HN LYS 310 2.941 -5.016 4.885
86 HA LYS 310 HA LYS 310 0.862 -6.830 5.395
87 HB2 LYS 310 3HB LYS 310 2.482 -7.852 7.034
88 HB3 LYS 310 2HB LYS 310 3.099 -7.646 5.387
89 HG2 LYS 310 3HG LYS 310 4.427 -5.781 6.005
90 HG3 LYS 310 2HG LYS 310 3.635 -5.667 7.586
91 HD2 LYS 310 3HD LYS 310 4.975 -8.238 6.907
92 HD3 LYS 310 2HD LYS 310 6.003 -6.839 7.266
93 HE2 LYS 310 3HE LYS 310 3.728 -7.478 9.105
94 HE3 LYS 310 2HE LYS 310 5.207 -8.449 9.181
95 HZ1 LYS 310 3HZ LYS 310 5.681 -5.607 9.126
96 HZ2 LYS 310 1HZ LYS 310 6.334 -6.794 10.139
97 HZ3 LYS 310 2HZ LYS 310 4.819 -6.125 10.487
98 H LYS 311 HN LYS 311 2.153 -4.163 7.271
99 HA LYS 311 HA LYS 311 0.562 -4.834 9.600
100 HB2 LYS 311 3HB LYS 311 2.374 -2.496 8.966
101 HB3 LYS 311 2HB LYS 311 1.505 -2.683 10.497
102 HG2 LYS 311 3HG LYS 311 2.886 -4.305 11.261
103 HG3 LYS 311 2HG LYS 311 3.164 -4.972 9.643
104 HD2 LYS 311 3HD LYS 311 5.234 -4.049 10.253
105 HD3 LYS 311 2HD LYS 311 4.502 -2.843 9.180
106 HE2 LYS 311 3HE LYS 311 3.791 -1.508 11.075
107 HE3 LYS 311 2HE LYS 311 4.374 -2.750 12.192
108 HZ1 LYS 311 3HZ LYS 311 6.615 -2.334 11.525
109 HZ2 LYS 311 1HZ LYS 311 5.907 -0.849 11.920
110 HZ3 LYS 311 2HZ LYS 311 6.121 -1.277 10.298
111 H CYS 312 HN CYS 312 0.171 -3.084 6.715
112 HA CYS 312 HA CYS 312 -1.441 -0.951 7.393
113 HB2 CYS 312 3HB CYS 312 -0.576 -1.719 5.083
114 HB3 CYS 312 2HB CYS 312 -2.047 -2.690 5.012
115 H THR 313 HN THR 313 -3.581 -0.648 7.847
116 HA THR 313 HA THR 313 -5.030 -3.004 8.770
117 HB THR 313 HB THR 313 -6.641 -1.317 9.710
118 HG1 THR 313 1HG THR 313 -6.160 0.823 9.560
119 HG21 THR 313 3HG2 THR 313 -3.861 -1.756 10.496
120 HG22 THR 313 1HG2 THR 313 -5.335 -1.835 11.461
121 HG23 THR 313 2HG2 THR 313 -4.556 -0.280 11.165
122 H TYR 314 HN TYR 314 -5.227 -0.502 6.329
123 HA TYR 314 HA TYR 314 -7.871 -0.749 5.529
124 HB2 TYR 314 3HB TYR 314 -5.540 -0.338 3.643
125 HB3 TYR 314 2HB TYR 314 -7.202 0.216 3.434
126 HD1 TYR 314 2HD TYR 314 -7.824 1.394 6.047
127 HD2 TYR 314 1HD TYR 314 -4.261 1.618 3.734
128 HE1 TYR 314 2HE TYR 314 -7.274 3.540 7.114
129 HE2 TYR 314 1HE TYR 314 -3.699 3.764 4.796
130 HH TYR 314 HH TYR 314 -5.329 4.930 7.556
131 H GLY 315 HN GLY 315 -5.050 -2.419 4.107
132 HA2 GLY 315 2HA GLY 315 -4.878 -4.541 3.220
133 HA3 GLY 315 3HA GLY 315 -6.481 -4.884 3.856
134 H ILE 316 HN ILE 316 -8.328 -4.001 2.622
135 HA ILE 316 HA ILE 316 -7.802 -4.286 -0.244
136 HB ILE 316 HB ILE 316 -10.475 -4.271 1.156
137 HG12 ILE 316 1HG1 ILE 316 -9.084 -6.110 1.981
138 HG13 ILE 316 2HG1 ILE 316 -10.411 -6.717 0.976
139 HG21 ILE 316 1HG2 ILE 316 -10.833 -3.795 -1.107
140 HG22 ILE 316 2HG2 ILE 316 -9.579 -4.917 -1.632
141 HG23 ILE 316 3HG2 ILE 316 -11.096 -5.534 -0.980
142 HD11 ILE 316 3HD1 ILE 316 -8.969 -7.795 -0.298
143 HD12 ILE 316 1HD1 ILE 316 -8.184 -6.273 -0.715
144 HD13 ILE 316 2HD1 ILE 316 -7.639 -7.190 0.690
145 H LYS 317 HN LYS 317 -8.662 -1.942 2.106
146 HA LYS 317 HA LYS 317 -9.838 -0.107 0.189
147 HB2 LYS 317 3HB LYS 317 -9.038 0.749 2.937
148 HB3 LYS 317 2HB LYS 317 -10.467 1.190 1.988
149 HG2 LYS 317 3HG LYS 317 -11.001 -1.406 2.342
150 HG3 LYS 317 2HG LYS 317 -10.023 -1.111 3.790
151 HD2 LYS 317 3HD LYS 317 -12.069 -0.550 4.631
152 HD3 LYS 317 2HD LYS 317 -11.592 1.022 3.967
153 HE2 LYS 317 3HE LYS 317 -13.062 -0.920 2.221
154 HE3 LYS 317 2HE LYS 317 -13.950 0.014 3.435
155 HZ1 LYS 317 3HZ LYS 317 -14.054 1.539 1.817
156 HZ2 LYS 317 1HZ LYS 317 -12.748 0.890 0.957
157 HZ3 LYS 317 2HZ LYS 317 -12.469 1.920 2.269
158 H CYS 318 HN CYS 318 -6.744 -0.872 1.414
159 HA CYS 318 HA CYS 318 -5.382 1.523 1.405
160 HB2 CYS 318 3HB CYS 318 -4.447 -0.706 2.040
161 HB3 CYS 318 2HB CYS 318 -4.323 -1.095 0.324
162 H ARG 319 HN ARG 319 -4.848 2.984 -0.085
163 HA ARG 319 HA ARG 319 -5.619 2.510 -2.846
164 HB2 ARG 319 3HB ARG 319 -4.492 5.013 -1.567
165 HB3 ARG 319 2HB ARG 319 -5.253 4.892 -3.161
166 HG2 ARG 319 3HG ARG 319 -6.654 4.352 -0.542
167 HG3 ARG 319 2HG ARG 319 -6.737 5.868 -1.457
168 HD2 ARG 319 3HD ARG 319 -7.677 3.141 -2.374
169 HD3 ARG 319 2HD ARG 319 -8.686 4.529 -1.942
170 HE ARG 319 HE ARG 319 -6.991 5.347 -3.990
171 HH11 ARG 319 2HH1 ARG 319 -9.577 3.071 -3.493
172 HH12 ARG 319 1HH1 ARG 319 -10.122 3.131 -5.137
173 HH21 ARG 319 2HH2 ARG 319 -7.698 5.436 -6.157
174 HH22 ARG 319 1HH2 ARG 319 -9.052 4.477 -6.652
175 H PHE 320 HN PHE 320 -2.748 2.763 -0.912
176 HA PHE 320 HA PHE 320 -0.907 3.285 -3.003
177 HB2 PHE 320 3HB PHE 320 -0.777 2.487 -0.159
178 HB3 PHE 320 2HB PHE 320 0.596 1.981 -1.146
179 HD1 PHE 320 2HD PHE 320 -1.485 5.049 -0.690
180 HD2 PHE 320 1HD PHE 320 2.399 3.385 -1.203
181 HE1 PHE 320 2HE PHE 320 -0.503 7.297 -0.512
182 HE2 PHE 320 1HE PHE 320 3.388 5.631 -1.025
183 HZ PHE 320 HZ PHE 320 1.937 7.591 -0.679
184 H PHE 321 HN PHE 321 0.989 1.563 -3.238
185 HA PHE 321 HA PHE 321 -0.290 -0.790 -4.394
186 HB2 PHE 321 3HB PHE 321 1.194 0.373 -5.877
187 HB3 PHE 321 2HB PHE 321 2.484 0.373 -4.672
188 HD1 PHE 321 2HD PHE 321 0.275 -2.233 -6.185
189 HD2 PHE 321 1HD PHE 321 4.227 -1.013 -5.182
190 HE1 PHE 321 2HE PHE 321 1.153 -4.342 -7.096
191 HE2 PHE 321 1HE PHE 321 5.113 -3.120 -6.093
192 HZ PHE 321 HZ PHE 321 3.576 -4.789 -7.050
193 H HIS 322 HN HIS 322 -0.487 -2.522 -3.147
194 HA HIS 322 HA HIS 322 1.233 -2.958 -0.875
195 HB2 HIS 322 3HB HIS 322 -1.235 -4.202 -1.982
196 HB3 HIS 322 2HB HIS 322 -0.212 -5.214 -0.959
197 HD1 HIS 322 1HD HIS 322 -0.267 -4.818 1.535
198 HD2 HIS 322 2HD HIS 322 -2.321 -1.914 -0.612
199 HE1 HIS 322 1HE HIS 322 -1.499 -3.458 3.253
200 HE2 HIS 322 2HE HIS 322 -2.756 -1.683 1.942
201 HA PRO 323 HA PRO 323 4.190 -5.658 -2.668
202 HB2 PRO 323 3HB PRO 323 4.675 -7.384 -0.597
203 HB3 PRO 323 2HB PRO 323 5.220 -5.708 -0.615
204 HG2 PRO 323 3HG PRO 323 2.793 -6.906 0.676
205 HG3 PRO 323 2HG PRO 323 3.977 -5.724 1.350
206 HD2 PRO 323 3HD PRO 323 1.541 -4.982 0.408
207 HD3 PRO 323 2HD PRO 323 2.977 -3.955 0.263
208 H GLU 324 HN GLU 324 1.290 -7.047 -1.282
209 HA GLU 324 HA GLU 324 1.690 -9.504 -2.838
210 HB2 GLU 324 3HB GLU 324 -0.359 -8.927 -0.685
211 HB3 GLU 324 2HB GLU 324 -0.052 -10.491 -1.456
212 HG2 GLU 324 3HG GLU 324 1.866 -10.871 -0.284
213 HG3 GLU 324 2HG GLU 324 2.215 -9.147 -0.095
214 HE2 GLU 324 HE GLU 324 1.166 -9.758 3.155
215 H ARG 325 HN ARG 325 0.560 -6.638 -3.508
216 HA ARG 325 HA ARG 325 -1.910 -7.569 -4.808
217 HB2 ARG 325 3HB ARG 325 -1.002 -4.893 -3.804
218 HB3 ARG 325 2HB ARG 325 -2.199 -4.981 -5.104
219 HG2 ARG 325 3HG ARG 325 -2.527 -6.389 -2.458
220 HG3 ARG 325 2HG ARG 325 -3.137 -4.759 -2.792
221 HD2 ARG 325 3HD ARG 325 -4.651 -5.527 -4.428
222 HD3 ARG 325 2HD ARG 325 -3.833 -7.089 -4.551
223 HE ARG 325 HE ARG 325 -5.815 -6.322 -2.611
224 HH11 ARG 325 2HH1 ARG 325 -3.183 -8.485 -3.327
225 HH12 ARG 325 1HH1 ARG 325 -3.720 -9.712 -2.228
226 HH21 ARG 325 2HH2 ARG 325 -6.532 -7.928 -1.160
227 HH22 ARG 325 1HH2 ARG 325 -5.626 -9.394 -0.996
228 HA PRO 326 HA PRO 326 -0.202 -7.125 -8.824
229 HB2 PRO 326 3HB PRO 326 -2.317 -6.122 -10.246
230 HB3 PRO 326 2HB PRO 326 -2.241 -7.780 -9.655
231 HG2 PRO 326 3HG PRO 326 -3.601 -5.394 -8.453
232 HG3 PRO 326 2HG PRO 326 -4.224 -7.073 -8.666
233 HD2 PRO 326 3HD PRO 326 -3.294 -6.145 -6.290
234 HD3 PRO 326 2HD PRO 326 -3.098 -7.830 -6.802
235 H SER 327 HN SER 327 -2.147 -4.263 -7.949
236 HA SER 327 HA SER 327 0.077 -2.506 -8.437
237 HB2 SER 327 1HB SER 327 -0.700 -1.333 -10.312
238 HB3 SER 327 2HB SER 327 -1.018 -3.027 -10.727
239 HG SER 327 HG SER 327 -3.188 -2.617 -9.819
Start of MODEL 19
1 H1 SER 299 HN SER 299 7.915 13.560 -1.754
2 HA SER 299 HA SER 299 5.883 11.833 -0.787
3 HB2 SER 299 1HB SER 299 5.864 13.832 -3.069
4 HB3 SER 299 2HB SER 299 4.424 13.028 -2.422
5 HG SER 299 HG SER 299 6.186 14.679 -0.926
6 H GLU 300 HN GLU 300 6.090 9.722 -1.320
7 HA GLU 300 HA GLU 300 6.444 9.031 -4.153
8 HB2 GLU 300 3HB GLU 300 6.851 7.467 -1.604
9 HB3 GLU 300 2HB GLU 300 6.824 6.696 -3.197
10 HG2 GLU 300 3HG GLU 300 9.098 7.039 -2.625
11 HG3 GLU 300 2HG GLU 300 8.683 8.213 -3.881
12 HE2 GLU 300 HE GLU 300 9.351 9.614 -0.220
13 H HIS 301 HN HIS 301 4.298 9.446 -4.792
14 HA HIS 301 HA HIS 301 2.113 8.067 -3.503
15 HB2 HIS 301 3HB HIS 301 2.330 9.841 -5.933
16 HB3 HIS 301 2HB HIS 301 0.826 9.014 -5.516
17 HD1 HIS 301 1HD HIS 301 0.121 9.507 -2.826
18 HD2 HIS 301 2HD HIS 301 2.396 12.326 -4.860
19 HE1 HIS 301 1HE HIS 301 -0.175 11.655 -1.553
20 HE2 HIS 301 2HE HIS 301 1.216 13.379 -2.794
21 H ARG 302 HN ARG 302 4.119 7.661 -6.346
22 HA ARG 302 HA ARG 302 2.959 4.997 -6.719
23 HB2 ARG 302 3HB ARG 302 2.980 5.292 -9.175
24 HB3 ARG 302 2HB ARG 302 1.839 6.375 -8.365
25 HG2 ARG 302 3HG ARG 302 3.012 8.258 -8.884
26 HG3 ARG 302 2HG ARG 302 4.565 7.408 -8.902
27 HD2 ARG 302 3HD ARG 302 3.851 8.150 -11.157
28 HD3 ARG 302 2HD ARG 302 4.050 6.397 -11.027
29 HE ARG 302 HE ARG 302 1.357 7.220 -10.541
30 HH11 ARG 302 2HH1 ARG 302 3.688 6.522 -13.031
31 HH12 ARG 302 1HH1 ARG 302 2.494 6.110 -14.216
32 HH21 ARG 302 2HH2 ARG 302 -0.225 6.681 -12.094
33 HH22 ARG 302 1HH2 ARG 302 0.267 6.203 -13.683
34 H LYS 303 HN LYS 303 5.450 6.007 -5.545
35 HA LYS 303 HA LYS 303 7.394 4.825 -7.417
36 HB2 LYS 303 3HB LYS 303 8.060 6.626 -5.088
37 HB3 LYS 303 2HB LYS 303 9.102 6.166 -6.445
38 HG2 LYS 303 3HG LYS 303 6.672 7.956 -6.568
39 HG3 LYS 303 2HG LYS 303 8.370 8.447 -6.709
40 HD2 LYS 303 3HD LYS 303 8.382 6.685 -8.676
41 HD3 LYS 303 2HD LYS 303 6.640 7.012 -8.668
42 HE2 LYS 303 3HE LYS 303 7.157 9.457 -8.835
43 HE3 LYS 303 2HE LYS 303 8.861 9.019 -9.026
44 HZ1 LYS 303 3HZ LYS 303 7.793 9.389 -11.161
45 HZ2 LYS 303 1HZ LYS 303 6.661 8.175 -10.834
46 HZ3 LYS 303 2HZ LYS 303 8.295 7.779 -11.018
47 H GLN 304 HN GLN 304 6.302 4.938 -4.066
48 HA GLN 304 HA GLN 304 7.866 2.498 -3.538
49 HB2 GLN 304 3HB GLN 304 7.170 4.858 -1.848
50 HB3 GLN 304 2HB GLN 304 7.312 3.277 -1.063
51 HG2 GLN 304 3HG GLN 304 9.447 4.658 -2.689
52 HG3 GLN 304 2HG GLN 304 9.402 4.493 -0.929
53 HE21 GLN 304 1HE2 GLN 304 10.107 2.953 -3.919
54 HE22 GLN 304 2HE2 GLN 304 10.756 1.491 -3.266
55 HA PRO 305 HA PRO 305 4.215 0.187 -2.787
56 HB2 PRO 305 3HB PRO 305 4.929 -1.374 -0.653
57 HB3 PRO 305 2HB PRO 305 5.564 -1.603 -2.281
58 HG2 PRO 305 3HG PRO 305 6.776 -0.150 0.046
59 HG3 PRO 305 2HG PRO 305 7.544 -1.315 -1.096
60 HD2 PRO 305 3HD PRO 305 7.868 1.371 -1.307
61 HD3 PRO 305 2HD PRO 305 7.814 0.300 -2.717
62 H CYS 306 HN CYS 306 2.911 -0.698 -0.694
63 HA CYS 306 HA CYS 306 1.519 1.445 0.346
64 HB2 CYS 306 3HB CYS 306 1.575 -1.411 0.720
65 HB3 CYS 306 2HB CYS 306 1.347 -0.612 2.275
66 HA PRO 307 HA PRO 307 3.856 3.153 3.644
67 HB2 PRO 307 3HB PRO 307 1.894 3.803 5.442
68 HB3 PRO 307 2HB PRO 307 2.149 4.665 3.925
69 HG2 PRO 307 3HG PRO 307 0.196 2.482 4.566
70 HG3 PRO 307 2HG PRO 307 -0.073 4.027 3.676
71 HD2 PRO 307 3HD PRO 307 0.231 1.642 2.414
72 HD3 PRO 307 2HD PRO 307 0.807 3.170 1.725
73 H TYR 308 HN TYR 308 1.529 0.644 4.520
74 HA TYR 308 HA TYR 308 3.320 -0.157 6.720
75 HB2 TYR 308 3HB TYR 308 0.320 -0.143 6.519
76 HB3 TYR 308 2HB TYR 308 1.135 -1.270 7.606
77 HD1 TYR 308 1HD TYR 308 3.149 0.009 8.990
78 HD2 TYR 308 2HD TYR 308 -0.472 1.749 7.588
79 HE1 TYR 308 1HE TYR 308 3.324 1.752 10.717
80 HE2 TYR 308 2HE TYR 308 -0.306 3.497 9.309
81 HH TYR 308 HH TYR 308 0.790 3.751 11.574
82 H GLY 309 HN GLY 309 1.206 -1.242 4.115
83 HA2 GLY 309 2HA GLY 309 1.152 -3.199 2.917
84 HA3 GLY 309 3HA GLY 309 2.822 -3.425 3.419
85 H LYS 310 HN LYS 310 3.274 -5.054 4.759
86 HA LYS 310 HA LYS 310 1.466 -7.051 5.368
87 HB2 LYS 310 3HB LYS 310 3.148 -7.811 7.065
88 HB3 LYS 310 2HB LYS 310 3.813 -7.510 5.451
89 HG2 LYS 310 3HG LYS 310 4.042 -5.077 6.840
90 HG3 LYS 310 2HG LYS 310 4.553 -6.349 7.964
91 HD2 LYS 310 3HD LYS 310 5.866 -7.220 5.829
92 HD3 LYS 310 2HD LYS 310 5.750 -5.512 5.372
93 HE2 LYS 310 3HE LYS 310 7.614 -5.242 6.596
94 HE3 LYS 310 2HE LYS 310 6.523 -5.339 7.984
95 HZ1 LYS 310 3HZ LYS 310 8.256 -6.867 8.374
96 HZ2 LYS 310 1HZ LYS 310 8.150 -7.522 6.817
97 HZ3 LYS 310 2HZ LYS 310 6.914 -7.800 7.938
98 H LYS 311 HN LYS 311 2.299 -4.179 7.201
99 HA LYS 311 HA LYS 311 0.766 -5.003 9.513
100 HB2 LYS 311 3HB LYS 311 2.212 -2.449 8.791
101 HB3 LYS 311 2HB LYS 311 1.291 -2.648 10.292
102 HG2 LYS 311 3HG LYS 311 2.747 -4.373 11.063
103 HG3 LYS 311 2HG LYS 311 3.571 -4.441 9.494
104 HD2 LYS 311 3HD LYS 311 4.957 -3.226 11.054
105 HD3 LYS 311 2HD LYS 311 4.328 -2.104 9.835
106 HE2 LYS 311 3HE LYS 311 4.239 -1.196 12.152
107 HE3 LYS 311 2HE LYS 311 2.661 -1.283 11.358
108 HZ1 LYS 311 3HZ LYS 311 2.768 -2.084 13.730
109 HZ2 LYS 311 1HZ LYS 311 3.632 -3.421 13.159
110 HZ3 LYS 311 2HZ LYS 311 2.052 -3.145 12.624
111 H CYS 312 HN CYS 312 0.279 -3.173 6.615
112 HA CYS 312 HA CYS 312 -1.804 -1.491 7.283
113 HB2 CYS 312 3HB CYS 312 -0.565 -1.868 5.024
114 HB3 CYS 312 2HB CYS 312 -1.849 -3.035 4.707
115 H THR 313 HN THR 313 -4.049 -1.667 7.302
116 HA THR 313 HA THR 313 -5.074 -4.418 7.582
117 HB THR 313 HB THR 313 -5.055 -3.097 9.703
118 HG1 THR 313 1HG THR 313 -6.582 -4.715 9.563
119 HG21 THR 313 3HG2 THR 313 -5.747 -0.963 8.282
120 HG22 THR 313 1HG2 THR 313 -6.182 -1.128 9.982
121 HG23 THR 313 2HG2 THR 313 -7.366 -1.501 8.729
122 H TYR 314 HN TYR 314 -5.440 -1.351 6.050
123 HA TYR 314 HA TYR 314 -8.129 -1.484 5.265
124 HB2 TYR 314 3HB TYR 314 -5.704 -0.119 4.108
125 HB3 TYR 314 2HB TYR 314 -7.277 -0.014 3.314
126 HD1 TYR 314 2HD TYR 314 -9.204 0.337 5.386
127 HD2 TYR 314 1HD TYR 314 -5.250 1.892 5.168
128 HE1 TYR 314 2HE TYR 314 -9.859 2.191 6.863
129 HE2 TYR 314 1HE TYR 314 -5.893 3.751 6.646
130 HH TYR 314 HH TYR 314 -9.214 4.056 7.875
131 H GLY 315 HN GLY 315 -5.202 -2.372 3.423
132 HA2 GLY 315 2HA GLY 315 -4.892 -4.081 1.898
133 HA3 GLY 315 3HA GLY 315 -6.509 -4.656 2.274
134 H ILE 316 HN ILE 316 -8.295 -3.137 1.423
135 HA ILE 316 HA ILE 316 -7.690 -2.642 -1.398
136 HB ILE 316 HB ILE 316 -10.363 -2.827 -0.003
137 HG12 ILE 316 1HG1 ILE 316 -9.067 -4.783 -1.912
138 HG13 ILE 316 2HG1 ILE 316 -9.002 -4.947 -0.149
139 HG21 ILE 316 1HG2 ILE 316 -9.557 -2.191 -2.791
140 HG22 ILE 316 2HG2 ILE 316 -11.001 -3.173 -2.543
141 HG23 ILE 316 3HG2 ILE 316 -10.896 -1.564 -1.828
142 HD11 ILE 316 3HD1 ILE 316 -11.572 -4.840 -0.258
143 HD12 ILE 316 1HD1 ILE 316 -11.355 -5.223 -1.966
144 HD13 ILE 316 2HD1 ILE 316 -10.756 -6.331 -0.732
145 H LYS 317 HN LYS 317 -8.464 -1.002 1.532
146 HA LYS 317 HA LYS 317 -9.198 1.459 0.149
147 HB2 LYS 317 3HB LYS 317 -8.848 1.343 3.110
148 HB3 LYS 317 2HB LYS 317 -10.049 2.220 2.147
149 HG2 LYS 317 3HG LYS 317 -10.840 -0.264 1.587
150 HG3 LYS 317 2HG LYS 317 -10.098 -0.556 3.170
151 HD2 LYS 317 3HD LYS 317 -11.517 1.067 4.224
152 HD3 LYS 317 2HD LYS 317 -12.144 1.598 2.653
153 HE2 LYS 317 3HE LYS 317 -13.782 0.172 3.720
154 HE3 LYS 317 2HE LYS 317 -13.104 -0.653 2.308
155 HZ1 LYS 317 3HZ LYS 317 -11.901 -1.120 4.948
156 HZ2 LYS 317 1HZ LYS 317 -11.964 -2.142 3.601
157 HZ3 LYS 317 2HZ LYS 317 -13.346 -1.906 4.548
158 H CYS 318 HN CYS 318 -6.425 -0.075 1.258
159 HA CYS 318 HA CYS 318 -4.855 1.905 2.362
160 HB2 CYS 318 3HB CYS 318 -4.213 -0.488 2.095
161 HB3 CYS 318 2HB CYS 318 -3.927 -0.184 0.380
162 H ARG 319 HN ARG 319 -5.857 1.491 -0.949
163 HA ARG 319 HA ARG 319 -5.629 2.786 -2.803
164 HB2 ARG 319 3HB ARG 319 -5.324 4.693 -0.547
165 HB3 ARG 319 2HB ARG 319 -4.807 5.258 -2.142
166 HG2 ARG 319 3HG ARG 319 -7.535 4.102 -1.570
167 HG3 ARG 319 2HG ARG 319 -7.156 5.832 -1.559
168 HD2 ARG 319 3HD ARG 319 -6.439 4.191 -3.960
169 HD3 ARG 319 2HD ARG 319 -8.116 4.698 -3.714
170 HE ARG 319 HE ARG 319 -7.495 6.903 -4.093
171 HH11 ARG 319 2HH1 ARG 319 -4.710 4.816 -4.025
172 HH12 ARG 319 1HH1 ARG 319 -3.644 6.001 -4.705
173 HH21 ARG 319 2HH2 ARG 319 -6.102 8.471 -4.987
174 HH22 ARG 319 1HH2 ARG 319 -4.436 8.080 -5.252
175 H PHE 320 HN PHE 320 -3.288 1.340 -1.558
176 HA PHE 320 HA PHE 320 -1.222 2.649 -3.183
177 HB2 PHE 320 3HB PHE 320 -1.134 1.981 -0.296
178 HB3 PHE 320 2HB PHE 320 0.304 1.564 -1.229
179 HD1 PHE 320 2HD PHE 320 1.450 3.365 -2.581
180 HD2 PHE 320 1HD PHE 320 -1.510 4.205 0.360
181 HE1 PHE 320 2HE PHE 320 2.238 5.693 -2.458
182 HE2 PHE 320 1HE PHE 320 -0.728 6.534 0.487
183 HZ PHE 320 HZ PHE 320 1.149 7.281 -0.922
184 H PHE 321 HN PHE 321 0.705 1.089 -3.468
185 HA PHE 321 HA PHE 321 -0.405 -1.443 -4.382
186 HB2 PHE 321 3HB PHE 321 1.057 0.045 -5.827
187 HB3 PHE 321 2HB PHE 321 2.406 -0.418 -4.788
188 HD1 PHE 321 2HD PHE 321 -0.269 -1.947 -6.879
189 HD2 PHE 321 1HD PHE 321 3.671 -2.276 -5.302
190 HE1 PHE 321 2HE PHE 321 0.097 -3.973 -8.224
191 HE2 PHE 321 1HE PHE 321 4.042 -4.305 -6.645
192 HZ PHE 321 HZ PHE 321 2.254 -5.156 -8.107
193 H HIS 322 HN HIS 322 -0.238 -3.244 -3.236
194 HA HIS 322 HA HIS 322 1.489 -3.334 -0.910
195 HB2 HIS 322 3HB HIS 322 -0.803 -4.918 -1.951
196 HB3 HIS 322 2HB HIS 322 0.355 -5.772 -0.927
197 HD1 HIS 322 1HD HIS 322 0.070 -5.531 1.532
198 HD2 HIS 322 2HD HIS 322 -1.936 -2.566 -0.575
199 HE1 HIS 322 1HE HIS 322 -1.247 -4.256 3.254
200 HE2 HIS 322 2HE HIS 322 -2.473 -2.443 1.966
201 HA PRO 323 HA PRO 323 4.775 -5.688 -2.615
202 HB2 PRO 323 3HB PRO 323 5.458 -7.294 -0.505
203 HB3 PRO 323 2HB PRO 323 5.785 -5.563 -0.555
204 HG2 PRO 323 3HG PRO 323 3.519 -7.033 0.748
205 HG3 PRO 323 2HG PRO 323 4.537 -5.697 1.403
206 HD2 PRO 323 3HD PRO 323 2.035 -5.291 0.430
207 HD3 PRO 323 2HD PRO 323 3.330 -4.091 0.272
208 H GLU 324 HN GLU 324 2.196 -7.516 -1.034
209 HA GLU 324 HA GLU 324 2.814 -9.823 -2.748
210 HB2 GLU 324 3HB GLU 324 1.036 -9.715 -0.302
211 HB3 GLU 324 2HB GLU 324 1.520 -11.166 -1.194
212 HG2 GLU 324 3HG GLU 324 3.740 -11.038 -0.448
213 HG3 GLU 324 2HG GLU 324 3.537 -9.370 0.104
214 HE2 GLU 324 HE GLU 324 2.791 -10.514 3.232
215 H ARG 325 HN ARG 325 0.432 -7.413 -2.018
216 HA ARG 325 HA ARG 325 -1.380 -8.620 -4.004
217 HB2 ARG 325 3HB ARG 325 -1.908 -7.094 -1.477
218 HB3 ARG 325 2HB ARG 325 -3.084 -7.035 -2.798
219 HG2 ARG 325 3HG ARG 325 -2.087 -9.583 -1.525
220 HG3 ARG 325 2HG ARG 325 -3.587 -8.750 -1.082
221 HD2 ARG 325 3HD ARG 325 -4.381 -8.982 -3.421
222 HD3 ARG 325 2HD ARG 325 -2.909 -9.891 -3.791
223 HE ARG 325 HE ARG 325 -5.230 -10.851 -2.396
224 HH11 ARG 325 2HH1 ARG 325 -1.813 -11.281 -2.902
225 HH12 ARG 325 1HH1 ARG 325 -1.822 -12.953 -2.445
226 HH21 ARG 325 2HH2 ARG 325 -5.256 -13.051 -1.793
227 HH22 ARG 325 1HH2 ARG 325 -3.782 -13.959 -1.817
228 HA PRO 326 HA PRO 326 -0.999 -5.087 -6.575
229 HB2 PRO 326 3HB PRO 326 -3.545 -4.796 -7.542
230 HB3 PRO 326 2HB PRO 326 -2.464 -6.105 -8.021
231 HG2 PRO 326 3HG PRO 326 -4.646 -6.096 -5.963
232 HG3 PRO 326 2HG PRO 326 -4.278 -7.326 -7.229
233 HD2 PRO 326 3HD PRO 326 -3.569 -7.644 -4.628
234 HD3 PRO 326 2HD PRO 326 -2.589 -8.260 -5.969
235 H SER 327 HN SER 327 -2.528 -3.015 -7.173
236 HA SER 327 HA SER 327 -2.261 -1.231 -5.087
237 HB2 SER 327 1HB SER 327 -2.629 -0.705 -7.545
238 HB3 SER 327 2HB SER 327 -4.357 -0.964 -7.247
239 HG SER 327 HG SER 327 -3.101 1.259 -6.918
Start of MODEL 20
1 H1 SER 299 HN SER 299 10.263 12.874 -3.321
2 HA SER 299 HA SER 299 7.410 12.632 -2.701
3 HB2 SER 299 1HB SER 299 8.686 13.230 -5.384
4 HB3 SER 299 2HB SER 299 6.988 13.450 -4.926
5 HG SER 299 HG SER 299 8.140 14.863 -3.183
6 H GLU 300 HN GLU 300 7.724 10.348 -2.143
7 HA GLU 300 HA GLU 300 7.929 8.631 -4.528
8 HB2 GLU 300 3HB GLU 300 8.538 6.801 -3.005
9 HB3 GLU 300 2HB GLU 300 9.665 8.160 -2.884
10 HG2 GLU 300 3HG GLU 300 7.360 7.943 -0.985
11 HG3 GLU 300 2HG GLU 300 8.832 6.995 -0.730
12 HE2 GLU 300 HE GLU 300 8.863 10.696 0.377
13 H HIS 301 HN HIS 301 5.531 9.944 -3.967
14 HA HIS 301 HA HIS 301 3.747 8.293 -2.475
15 HB2 HIS 301 3HB HIS 301 2.003 9.728 -3.246
16 HB3 HIS 301 2HB HIS 301 3.413 10.744 -2.933
17 HD1 HIS 301 1HD HIS 301 0.909 10.201 -5.420
18 HD2 HIS 301 2HD HIS 301 4.933 11.234 -5.483
19 HE1 HIS 301 1HE HIS 301 1.305 11.225 -7.683
20 HE2 HIS 301 2HE HIS 301 3.764 11.857 -7.723
21 H ARG 302 HN ARG 302 4.888 8.326 -5.748
22 HA ARG 302 HA ARG 302 3.116 6.053 -6.348
23 HB2 ARG 302 3HB ARG 302 3.018 6.777 -8.686
24 HB3 ARG 302 2HB ARG 302 2.363 8.014 -7.601
25 HG2 ARG 302 3HG ARG 302 3.999 9.508 -8.062
26 HG3 ARG 302 2HG ARG 302 5.226 8.249 -8.284
27 HD2 ARG 302 3HD ARG 302 4.731 7.940 -10.496
28 HD3 ARG 302 2HD ARG 302 3.031 8.372 -10.272
29 HE ARG 302 HE ARG 302 4.697 10.631 -9.874
30 HH11 ARG 302 2HH1 ARG 302 3.371 8.585 -12.359
31 HH12 ARG 302 1HH1 ARG 302 3.408 9.817 -13.575
32 HH21 ARG 302 2HH2 ARG 302 4.750 12.262 -11.467
33 HH22 ARG 302 1HH2 ARG 302 4.194 11.908 -13.068
34 H LYS 303 HN LYS 303 5.884 6.201 -5.314
35 HA LYS 303 HA LYS 303 7.224 4.746 -7.499
36 HB2 LYS 303 3HB LYS 303 8.577 6.341 -5.310
37 HB3 LYS 303 2HB LYS 303 9.359 5.543 -6.684
38 HG2 LYS 303 3HG LYS 303 7.367 7.791 -6.962
39 HG3 LYS 303 2HG LYS 303 9.125 8.013 -6.909
40 HD2 LYS 303 3HD LYS 303 9.363 6.551 -8.882
41 HD3 LYS 303 2HD LYS 303 7.599 6.392 -8.949
42 HE2 LYS 303 3HE LYS 303 8.159 8.062 -10.535
43 HE3 LYS 303 2HE LYS 303 7.497 8.910 -9.130
44 HZ1 LYS 303 3HZ LYS 303 9.865 9.218 -8.395
45 HZ2 LYS 303 1HZ LYS 303 9.414 10.083 -9.777
46 HZ3 LYS 303 2HZ LYS 303 10.340 8.677 -9.925
47 H GLN 304 HN GLN 304 7.250 5.136 -3.953
48 HA GLN 304 HA GLN 304 8.233 2.434 -3.611
49 HB2 GLN 304 3HB GLN 304 7.723 4.775 -1.830
50 HB3 GLN 304 2HB GLN 304 7.755 3.161 -1.103
51 HG2 GLN 304 3HG GLN 304 9.996 3.817 -2.915
52 HG3 GLN 304 2HG GLN 304 9.926 4.704 -1.386
53 HE21 GLN 304 1HE2 GLN 304 10.915 1.889 -2.886
54 HE22 GLN 304 2HE2 GLN 304 11.259 0.947 -1.479
55 HA PRO 305 HA PRO 305 4.431 0.367 -2.907
56 HB2 PRO 305 3HB PRO 305 5.045 -1.317 -0.836
57 HB3 PRO 305 2HB PRO 305 5.650 -1.533 -2.478
58 HG2 PRO 305 3HG PRO 305 6.980 -0.255 -0.112
59 HG3 PRO 305 2HG PRO 305 7.654 -1.432 -1.301
60 HD2 PRO 305 3HD PRO 305 8.169 1.232 -1.421
61 HD3 PRO 305 2HD PRO 305 8.030 0.218 -2.867
62 H CYS 306 HN CYS 306 3.077 -0.496 -0.837
63 HA CYS 306 HA CYS 306 1.849 1.700 0.290
64 HB2 CYS 306 3HB CYS 306 1.718 -1.166 0.576
65 HB3 CYS 306 2HB CYS 306 1.545 -0.396 2.155
66 HA PRO 307 HA PRO 307 4.317 3.133 3.622
67 HB2 PRO 307 3HB PRO 307 2.419 3.837 5.467
68 HB3 PRO 307 2HB PRO 307 2.713 4.739 3.979
69 HG2 PRO 307 3HG PRO 307 0.631 2.659 4.566
70 HG3 PRO 307 2HG PRO 307 0.452 4.250 3.735
71 HD2 PRO 307 3HD PRO 307 0.590 1.899 2.384
72 HD3 PRO 307 2HD PRO 307 1.256 3.412 1.744
73 H TYR 308 HN TYR 308 1.831 0.762 4.458
74 HA TYR 308 HA TYR 308 3.606 -0.246 6.584
75 HB2 TYR 308 3HB TYR 308 0.594 -0.099 6.452
76 HB3 TYR 308 2HB TYR 308 1.425 -1.191 7.561
77 HD1 TYR 308 1HD TYR 308 3.399 0.027 8.947
78 HD2 TYR 308 2HD TYR 308 -0.046 1.939 7.342
79 HE1 TYR 308 1HE TYR 308 3.647 1.838 10.592
80 HE2 TYR 308 2HE TYR 308 0.192 3.757 8.981
81 HH TYR 308 HH TYR 308 1.200 4.252 11.047
82 H GLY 309 HN GLY 309 1.200 -1.143 4.134
83 HA2 GLY 309 2HA GLY 309 1.080 -3.007 2.788
84 HA3 GLY 309 3HA GLY 309 2.692 -3.438 3.340
85 H LYS 310 HN LYS 310 2.945 -4.864 5.038
86 HA LYS 310 HA LYS 310 0.839 -6.727 5.430
87 HB2 LYS 310 3HB LYS 310 2.406 -7.744 7.115
88 HB3 LYS 310 2HB LYS 310 3.083 -7.539 5.491
89 HG2 LYS 310 3HG LYS 310 4.380 -5.664 6.158
90 HG3 LYS 310 2HG LYS 310 3.540 -5.571 7.716
91 HD2 LYS 310 3HD LYS 310 4.671 -7.363 8.607
92 HD3 LYS 310 2HD LYS 310 4.952 -8.100 7.019
93 HE2 LYS 310 3HE LYS 310 6.482 -6.073 6.564
94 HE3 LYS 310 2HE LYS 310 6.412 -5.817 8.314
95 HZ1 LYS 310 3HZ LYS 310 8.334 -7.130 7.729
96 HZ2 LYS 310 1HZ LYS 310 7.365 -8.280 6.955
97 HZ3 LYS 310 2HZ LYS 310 7.257 -8.074 8.630
98 H LYS 311 HN LYS 311 2.103 -4.046 7.310
99 HA LYS 311 HA LYS 311 0.447 -4.675 9.604
100 HB2 LYS 311 3HB LYS 311 2.262 -2.335 8.985
101 HB3 LYS 311 2HB LYS 311 1.375 -2.528 10.504
102 HG2 LYS 311 3HG LYS 311 2.706 -4.241 11.245
103 HG3 LYS 311 2HG LYS 311 3.145 -4.743 9.602
104 HD2 LYS 311 3HD LYS 311 4.440 -2.581 9.398
105 HD3 LYS 311 2HD LYS 311 4.168 -2.358 11.135
106 HE2 LYS 311 3HE LYS 311 5.134 -4.805 11.291
107 HE3 LYS 311 2HE LYS 311 5.839 -4.386 9.724
108 HZ1 LYS 311 3HZ LYS 311 6.163 -2.408 11.828
109 HZ2 LYS 311 1HZ LYS 311 7.259 -2.923 10.646
110 HZ3 LYS 311 2HZ LYS 311 7.016 -3.852 12.039
111 H CYS 312 HN CYS 312 0.144 -2.948 6.688
112 HA CYS 312 HA CYS 312 -1.495 -0.816 7.308
113 HB2 CYS 312 3HB CYS 312 -0.543 -1.645 5.026
114 HB3 CYS 312 2HB CYS 312 -2.065 -2.530 4.909
115 H THR 313 HN THR 313 -3.659 -0.518 7.661
116 HA THR 313 HA THR 313 -5.110 -2.823 8.651
117 HB THR 313 HB THR 313 -6.824 -1.164 9.347
118 HG1 THR 313 1HG THR 313 -6.204 1.081 9.111
119 HG21 THR 313 3HG2 THR 313 -5.419 -1.457 11.115
120 HG22 THR 313 1HG2 THR 313 -5.044 0.232 10.775
121 HG23 THR 313 2HG2 THR 313 -3.981 -1.044 10.181
122 H TYR 314 HN TYR 314 -5.223 -0.615 5.938
123 HA TYR 314 HA TYR 314 -7.807 -1.162 5.010
124 HB2 TYR 314 3HB TYR 314 -5.424 -0.588 3.241
125 HB3 TYR 314 2HB TYR 314 -7.119 -0.203 2.932
126 HD1 TYR 314 1HD TYR 314 -7.978 1.019 5.454
127 HD2 TYR 314 2HD TYR 314 -4.336 1.481 3.302
128 HE1 TYR 314 1HE TYR 314 -7.681 3.250 6.447
129 HE2 TYR 314 2HE TYR 314 -4.029 3.713 4.290
130 HH TYR 314 HH TYR 314 -6.343 5.458 5.642
131 H GLY 315 HN GLY 315 -4.714 -2.553 3.883
132 HA2 GLY 315 2HA GLY 315 -4.234 -4.674 3.122
133 HA3 GLY 315 3HA GLY 315 -5.819 -5.181 3.686
134 H ILE 316 HN ILE 316 -7.674 -4.670 2.301
135 HA ILE 316 HA ILE 316 -6.931 -4.980 -0.514
136 HB ILE 316 HB ILE 316 -9.669 -5.306 0.709
137 HG12 ILE 316 1HG1 ILE 316 -8.063 -6.852 1.750
138 HG13 ILE 316 2HG1 ILE 316 -9.236 -7.710 0.736
139 HG21 ILE 316 1HG2 ILE 316 -8.469 -5.863 -1.969
140 HG22 ILE 316 2HG2 ILE 316 -9.826 -6.829 -1.393
141 HG23 ILE 316 3HG2 ILE 316 -9.998 -5.084 -1.565
142 HD11 ILE 316 3HD1 ILE 316 -7.649 -8.554 -0.561
143 HD12 ILE 316 1HD1 ILE 316 -6.864 -6.986 -0.753
144 HD13 ILE 316 2HD1 ILE 316 -6.496 -7.990 0.650
145 H LYS 317 HN LYS 317 -8.355 -2.731 1.673
146 HA LYS 317 HA LYS 317 -9.413 -1.105 -0.525
147 HB2 LYS 317 3HB LYS 317 -10.509 0.226 1.208
148 HB3 LYS 317 2HB LYS 317 -10.912 -1.490 1.374
149 HG2 LYS 317 3HG LYS 317 -9.034 -1.603 3.102
150 HG3 LYS 317 2HG LYS 317 -9.088 0.168 3.081
151 HD2 LYS 317 3HD LYS 317 -11.167 0.269 4.053
152 HD3 LYS 317 2HD LYS 317 -11.646 -1.317 3.425
153 HE2 LYS 317 3HE LYS 317 -10.035 -2.379 5.010
154 HE3 LYS 317 2HE LYS 317 -9.731 -0.775 5.690
155 HZ1 LYS 317 3HZ LYS 317 -12.192 -0.666 6.120
156 HZ2 LYS 317 1HZ LYS 317 -11.335 -1.783 7.059
157 HZ3 LYS 317 2HZ LYS 317 -12.260 -2.313 5.746
158 H CYS 318 HN CYS 318 -6.558 -1.420 -0.091
159 HA CYS 318 HA CYS 318 -5.708 1.149 0.993
160 HB2 CYS 318 3HB CYS 318 -4.445 -0.909 1.546
161 HB3 CYS 318 2HB CYS 318 -4.059 -1.109 -0.164
162 H ARG 319 HN ARG 319 -5.016 2.842 -0.193
163 HA ARG 319 HA ARG 319 -5.598 2.855 -3.004
164 HB2 ARG 319 3HB ARG 319 -5.272 5.168 -2.936
165 HB3 ARG 319 2HB ARG 319 -5.907 4.782 -1.330
166 HG2 ARG 319 3HG ARG 319 -3.616 4.804 -0.424
167 HG3 ARG 319 2HG ARG 319 -3.017 5.259 -2.028
168 HD2 ARG 319 3HD ARG 319 -4.914 6.853 -0.289
169 HD3 ARG 319 2HD ARG 319 -3.223 7.230 -0.641
170 HE ARG 319 HE ARG 319 -5.492 7.719 -2.336
171 HH11 ARG 319 2HH1 ARG 319 -2.045 7.236 -2.231
172 HH12 ARG 319 1HH1 ARG 319 -1.752 8.074 -3.719
173 HH21 ARG 319 2HH2 ARG 319 -5.118 8.824 -4.296
174 HH22 ARG 319 1HH2 ARG 319 -3.500 8.978 -4.892
175 H PHE 320 HN PHE 320 -2.737 2.646 -1.011
176 HA PHE 320 HA PHE 320 -0.897 3.130 -3.164
177 HB2 PHE 320 3HB PHE 320 -0.725 2.478 -0.277
178 HB3 PHE 320 2HB PHE 320 0.627 1.934 -1.271
179 HD1 PHE 320 1HD PHE 320 -1.258 4.907 -0.184
180 HD2 PHE 320 2HD PHE 320 2.225 3.445 -2.146
181 HE1 PHE 320 1HE PHE 320 -0.280 7.163 -0.122
182 HE2 PHE 320 2HE PHE 320 3.209 5.700 -2.086
183 HZ PHE 320 HZ PHE 320 1.956 7.563 -1.074
184 H PHE 321 HN PHE 321 0.908 1.401 -3.465
185 HA PHE 321 HA PHE 321 -0.430 -0.995 -4.411
186 HB2 PHE 321 3HB PHE 321 1.087 0.065 -5.952
187 HB3 PHE 321 2HB PHE 321 2.388 0.038 -4.759
188 HD1 PHE 321 2HD PHE 321 3.533 -2.043 -4.185
189 HD2 PHE 321 1HD PHE 321 0.545 -1.909 -7.213
190 HE1 PHE 321 2HE PHE 321 4.296 -4.225 -5.029
191 HE2 PHE 321 1HE PHE 321 1.302 -4.091 -8.061
192 HZ PHE 321 HZ PHE 321 3.180 -5.251 -6.970
193 H HIS 322 HN HIS 322 -0.385 -2.909 -3.432
194 HA HIS 322 HA HIS 322 1.282 -3.208 -1.044
195 HB2 HIS 322 3HB HIS 322 -1.270 -4.430 -2.002
196 HB3 HIS 322 2HB HIS 322 -0.254 -5.370 -0.905
197 HD1 HIS 322 1HD HIS 322 -0.229 -4.726 1.541
198 HD2 HIS 322 2HD HIS 322 -2.295 -2.015 -0.834
199 HE1 HIS 322 1HE HIS 322 -1.400 -3.183 3.145
200 HE2 HIS 322 2HE HIS 322 -2.664 -1.525 1.694
201 HA PRO 323 HA PRO 323 4.021 -6.124 -2.846
202 HB2 PRO 323 3HB PRO 323 4.525 -7.779 -0.723
203 HB3 PRO 323 2HB PRO 323 5.145 -6.133 -0.843
204 HG2 PRO 323 3HG PRO 323 2.729 -7.154 0.614
205 HG3 PRO 323 2HG PRO 323 3.998 -6.004 1.177
206 HD2 PRO 323 3HD PRO 323 1.557 -5.185 0.314
207 HD3 PRO 323 2HD PRO 323 3.032 -4.236 0.057
208 H GLU 324 HN GLU 324 1.182 -7.365 -1.182
209 HA GLU 324 HA GLU 324 1.343 -9.838 -2.766
210 HB2 GLU 324 3HB GLU 324 -0.344 -9.235 -0.324
211 HB3 GLU 324 2HB GLU 324 -0.238 -10.793 -1.160
212 HG2 GLU 324 3HG GLU 324 2.280 -9.574 -0.146
213 HG3 GLU 324 2HG GLU 324 1.155 -10.287 1.019
214 HE2 GLU 324 HE GLU 324 1.680 -13.510 -0.334
215 H ARG 325 HN ARG 325 -0.538 -6.981 -2.173
216 HA ARG 325 HA ARG 325 -2.654 -7.956 -3.966
217 HB2 ARG 325 3HB ARG 325 -2.553 -5.900 -1.795
218 HB3 ARG 325 2HB ARG 325 -3.732 -5.709 -3.102
219 HG2 ARG 325 3HG ARG 325 -3.544 -8.320 -1.655
220 HG3 ARG 325 2HG ARG 325 -4.398 -6.954 -0.920
221 HD2 ARG 325 3HD ARG 325 -4.975 -8.171 -3.632
222 HD3 ARG 325 2HD ARG 325 -5.941 -8.371 -2.163
223 HE ARG 325 HE ARG 325 -5.873 -5.682 -2.502
224 HH11 ARG 325 2HH1 ARG 325 -6.731 -8.350 -4.567
225 HH12 ARG 325 1HH1 ARG 325 -7.894 -7.443 -5.477
226 HH21 ARG 325 2HH2 ARG 325 -7.401 -4.477 -3.692
227 HH22 ARG 325 1HH2 ARG 325 -8.274 -5.240 -4.977
228 HA PRO 326 HA PRO 326 -1.354 -5.334 -7.241
229 HB2 PRO 326 3HB PRO 326 -3.756 -4.809 -8.450
230 HB3 PRO 326 2HB PRO 326 -2.947 -6.374 -8.531
231 HG2 PRO 326 3HG PRO 326 -5.149 -5.463 -6.710
232 HG3 PRO 326 2HG PRO 326 -4.995 -7.007 -7.629
233 HD2 PRO 326 3HD PRO 326 -4.453 -6.820 -4.976
234 HD3 PRO 326 2HD PRO 326 -3.573 -7.914 -6.058
235 H SER 327 HN SER 327 -2.542 -3.232 -8.424
236 HA SER 327 HA SER 327 -2.892 -0.988 -8.285
237 HB2 SER 327 1HB SER 327 -4.842 -1.931 -6.807
238 HB3 SER 327 2HB SER 327 -3.890 -1.268 -5.469
239 HG SER 327 HG SER 327 -5.563 0.088 -6.754