NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
549356 |
2lqo   |
18322 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 MET 1 HT1 MET 1 10.886 11.969 8.224
2 H2 MET 1 HT2 MET 1 9.782 10.994 7.448
3 H3 MET 1 HT3 MET 1 11.436 10.811 7.156
4 HA MET 1 HA MET 1 11.819 10.154 9.438
5 HB2 MET 1 HB2 MET 1 8.799 10.169 9.624
6 HB3 MET 1 HB1 MET 1 9.877 9.491 10.831
7 HG2 MET 1 HG2 MET 1 10.828 11.755 11.166
8 HG3 MET 1 HG1 MET 1 9.625 12.375 10.038
9 HE1 MET 1 HE1 MET 1 6.995 12.390 10.535
10 HE2 MET 1 HE2 MET 1 6.266 11.708 11.989
11 HE3 MET 1 HE3 MET 1 7.018 10.647 10.799
12 H VAL 2 HN VAL 2 9.759 9.211 6.797
13 HA VAL 2 HA VAL 2 9.078 7.362 5.905
14 HB VAL 2 HB VAL 2 10.708 5.606 5.381
15 HG11 VAL 2 HG11 VAL 2 11.780 8.391 5.152
16 HG12 VAL 2 HG12 VAL 2 10.702 7.559 4.030
17 HG13 VAL 2 HG13 VAL 2 12.365 7.006 4.233
18 HG21 VAL 2 HG21 VAL 2 13.052 5.747 6.161
19 HG22 VAL 2 HG22 VAL 2 11.938 5.412 7.484
20 HG23 VAL 2 HG23 VAL 2 12.590 7.036 7.273
21 H THR 3 HN THR 3 8.546 7.494 8.787
22 HA THR 3 HA THR 3 8.374 4.755 9.592
23 HB THR 3 HB THR 3 8.546 6.423 11.368
24 HG1 THR 3 HG1 THR 3 6.422 5.981 12.465
25 HG21 THR 3 HG21 THR 3 6.736 8.043 11.847
26 HG22 THR 3 HG22 THR 3 5.939 7.569 10.344
27 HG23 THR 3 HG23 THR 3 7.522 8.349 10.302
28 H ALA 4 HN ALA 4 6.350 7.106 8.029
29 HA ALA 4 HA ALA 4 4.301 5.088 7.636
30 HB1 ALA 4 HB1 ALA 4 3.014 6.899 6.547
31 HB2 ALA 4 HB2 ALA 4 4.376 7.993 6.769
32 HB3 ALA 4 HB3 ALA 4 3.512 7.368 8.173
33 H ALA 5 HN ALA 5 5.696 3.782 6.515
34 HA ALA 5 HA ALA 5 7.128 4.522 4.194
35 HB1 ALA 5 HB1 ALA 5 7.364 2.080 3.860
36 HB2 ALA 5 HB2 ALA 5 6.191 1.815 5.151
37 HB3 ALA 5 HB3 ALA 5 7.738 2.576 5.508
38 H LEU 6 HN LEU 6 4.125 2.683 4.614
39 HA LEU 6 HA LEU 6 2.980 3.951 2.343
40 HB2 LEU 6 HB2 LEU 6 2.353 1.910 1.155
41 HB3 LEU 6 HB1 LEU 6 4.086 2.078 1.221
42 HG LEU 6 HG LEU 6 2.629 0.262 3.141
43 HD11 LEU 6 HD11 LEU 6 3.181 -1.566 1.567
44 HD12 LEU 6 HD12 LEU 6 3.640 -0.332 0.375
45 HD13 LEU 6 HD13 LEU 6 1.977 -0.440 0.942
46 HD21 LEU 6 HD21 LEU 6 4.952 0.808 3.658
47 HD22 LEU 6 HD22 LEU 6 5.436 0.296 2.043
48 HD23 LEU 6 HD23 LEU 6 4.794 -0.885 3.187
49 H THR 7 HN THR 7 0.896 4.126 2.573
50 HA THR 7 HA THR 7 -0.349 2.911 4.921
51 HB THR 7 HB THR 7 -1.433 5.093 3.169
52 HG1 THR 7 HG1 THR 7 0.048 5.414 5.604
53 HG21 THR 7 HG21 THR 7 -2.709 5.686 5.205
54 HG22 THR 7 HG22 THR 7 -1.958 4.331 6.050
55 HG23 THR 7 HG23 THR 7 -3.032 4.031 4.684
56 H ILE 8 HN ILE 8 -1.658 1.298 4.560
57 HA ILE 8 HA ILE 8 -2.587 0.632 1.900
58 HB ILE 8 HB ILE 8 -2.678 -0.838 4.533
59 HG12 ILE 8 HG12 ILE 8 -1.406 -1.567 1.910
60 HG13 ILE 8 HG11 ILE 8 -0.520 -0.866 3.282
61 HG21 ILE 8 HG21 ILE 8 -3.722 -2.724 3.369
62 HG22 ILE 8 HG22 ILE 8 -3.939 -1.700 1.938
63 HG23 ILE 8 HG23 ILE 8 -4.739 -1.285 3.464
64 HD11 ILE 8 HD11 ILE 8 -1.113 -2.876 4.564
65 HD12 ILE 8 HD12 ILE 8 -0.187 -3.248 3.109
66 HD13 ILE 8 HD13 ILE 8 -1.928 -3.524 3.140
67 H TYR 9 HN TYR 9 -4.360 1.334 1.179
68 HA TYR 9 HA TYR 9 -6.597 1.887 2.976
69 HB2 TYR 9 HB2 TYR 9 -6.081 2.641 0.094
70 HB3 TYR 9 HB1 TYR 9 -7.572 2.992 0.945
71 HD1 TYR 9 HD1 TYR 9 -6.769 4.097 3.462
72 HD2 TYR 9 HD2 TYR 9 -4.933 4.569 -0.338
73 HE1 TYR 9 HE1 TYR 9 -5.888 6.267 4.175
74 HE2 TYR 9 HE2 TYR 9 -4.035 6.737 0.356
75 HH TYR 9 HH TYR 9 -4.765 8.524 2.056
76 H THR 10 HN THR 10 -8.013 0.275 3.180
77 HA THR 10 HA THR 10 -8.966 -1.143 0.893
78 HB THR 10 HB THR 10 -6.895 -2.469 1.399
79 HG1 THR 10 HG1 THR 10 -9.114 -4.015 2.238
80 HG21 THR 10 HG21 THR 10 -6.745 -1.998 3.811
81 HG22 THR 10 HG22 THR 10 -6.723 -3.731 3.490
82 HG23 THR 10 HG23 THR 10 -8.196 -2.961 4.084
83 H THR 11 HN THR 11 -10.729 -2.646 1.578
84 HA THR 11 HA THR 11 -12.005 -1.866 4.068
85 HB THR 11 HB THR 11 -13.851 -3.313 2.991
86 HG1 THR 11 HG1 THR 11 -13.612 -3.426 0.652
87 HG21 THR 11 HG21 THR 11 -13.006 -0.768 1.609
88 HG22 THR 11 HG22 THR 11 -13.983 -0.867 3.073
89 HG23 THR 11 HG23 THR 11 -14.616 -1.483 1.546
90 H SER 12 HN SER 12 -12.823 -3.643 5.376
91 HA SER 12 HA SER 12 -10.960 -5.751 5.707
92 HB2 SER 12 HB2 SER 12 -12.352 -4.651 7.531
93 HB3 SER 12 HB1 SER 12 -13.747 -5.494 6.878
94 HG SER 12 HG SER 12 -11.436 -6.562 8.072
95 H TRP 13 HN TRP 13 -13.983 -5.319 4.064
96 HA TRP 13 HA TRP 13 -14.358 -8.147 3.604
97 HB2 TRP 13 HB2 TRP 13 -16.461 -7.456 2.459
98 HB3 TRP 13 HB1 TRP 13 -16.356 -6.952 4.138
99 HD1 TRP 13 HD1 TRP 13 -16.070 -4.292 4.585
100 HE1 TRP 13 HE1 TRP 13 -16.722 -2.253 3.140
101 HE3 TRP 13 HE3 TRP 13 -16.624 -6.611 0.054
102 HZ2 TRP 13 HZ2 TRP 13 -17.376 -1.706 0.484
103 HZ3 TRP 13 HZ3 TRP 13 -17.273 -5.245 -1.885
104 HH2 TRP 13 HH2 TRP 13 -17.642 -2.836 -1.665
105 H CYS 14 HN CYS 14 -12.205 -6.338 2.273
106 HA CYS 14 HA CYS 14 -12.825 -6.715 -0.516
107 HB2 CYS 14 HB2 CYS 14 -11.373 -4.816 0.209
108 HB3 CYS 14 HB1 CYS 14 -10.190 -5.959 0.814
109 HG CYS 14 HG CYS 14 -10.821 -4.998 -2.360
110 H GLY 15 HN GLY 15 -11.557 -8.186 -1.899
111 HA2 GLY 15 HA2 GLY 15 -11.132 -10.703 -0.565
112 HA3 GLY 15 HA1 GLY 15 -11.042 -10.398 -2.296
113 H TYR 16 HN TYR 16 -9.213 -8.244 -2.123
114 HA TYR 16 HA TYR 16 -6.839 -9.861 -2.035
115 HB2 TYR 16 HB2 TYR 16 -7.300 -7.075 -2.948
116 HB3 TYR 16 HB1 TYR 16 -5.695 -7.797 -2.888
117 HD1 TYR 16 HD2 TYR 16 -5.808 -10.343 -4.018
118 HD2 TYR 16 HD1 TYR 16 -8.218 -6.987 -5.047
119 HE1 TYR 16 HE2 TYR 16 -6.194 -11.304 -6.250
120 HE2 TYR 16 HE1 TYR 16 -8.617 -7.942 -7.270
121 HH TYR 16 HH TYR 16 -7.559 -9.474 -8.777
122 H CYS 17 HN CYS 17 -8.289 -8.017 0.333
123 HA CYS 17 HA CYS 17 -6.161 -6.507 1.312
124 HB2 CYS 17 HB2 CYS 17 -7.385 -6.518 3.504
125 HB3 CYS 17 HB1 CYS 17 -8.372 -6.049 2.127
126 HG CYS 17 HG CYS 17 -9.954 -7.565 3.871
127 H LEU 18 HN LEU 18 -7.262 -9.635 2.615
128 HA LEU 18 HA LEU 18 -4.962 -9.971 4.247
129 HB2 LEU 18 HB2 LEU 18 -5.777 -12.133 4.840
130 HB3 LEU 18 HB1 LEU 18 -7.149 -11.062 4.730
131 HG LEU 18 HG LEU 18 -6.384 -13.105 2.627
132 HD11 LEU 18 HD11 LEU 18 -8.285 -14.384 3.446
133 HD12 LEU 18 HD12 LEU 18 -8.513 -13.211 4.745
134 HD13 LEU 18 HD13 LEU 18 -7.042 -14.184 4.680
135 HD21 LEU 18 HD21 LEU 18 -8.892 -11.440 2.941
136 HD22 LEU 18 HD22 LEU 18 -8.645 -12.720 1.752
137 HD23 LEU 18 HD23 LEU 18 -7.660 -11.261 1.686
138 H ARG 19 HN ARG 19 -5.533 -10.612 0.960
139 HA ARG 19 HA ARG 19 -3.682 -12.733 0.553
140 HB2 ARG 19 HB2 ARG 19 -4.417 -10.606 -1.469
141 HB3 ARG 19 HB1 ARG 19 -3.797 -12.209 -1.810
142 HG2 ARG 19 HG2 ARG 19 -6.506 -11.548 -0.672
143 HG3 ARG 19 HG1 ARG 19 -6.162 -12.049 -2.323
144 HD2 ARG 19 HD2 ARG 19 -5.403 -14.213 -1.509
145 HD3 ARG 19 HD1 ARG 19 -5.692 -13.693 0.154
146 HE ARG 19 HE ARG 19 -8.026 -13.381 -1.396
147 HH11 ARG 19 HH11 ARG 19 -6.101 -15.916 0.166
148 HH12 ARG 19 HH12 ARG 19 -7.417 -16.975 0.380
149 HH21 ARG 19 HH21 ARG 19 -9.806 -14.846 -1.158
150 HH22 ARG 19 HH22 ARG 19 -9.594 -16.361 -0.442
151 H LEU 20 HN LEU 20 -3.583 -9.252 0.101
152 HA LEU 20 HA LEU 20 -0.892 -9.088 -0.651
153 HB2 LEU 20 HB2 LEU 20 -2.521 -7.478 -1.367
154 HB3 LEU 20 HB1 LEU 20 -2.884 -7.051 0.285
155 HG LEU 20 HG LEU 20 -0.773 -6.008 0.552
156 HD11 LEU 20 HD11 LEU 20 0.652 -7.380 -0.891
157 HD12 LEU 20 HD12 LEU 20 0.775 -5.693 -1.378
158 HD13 LEU 20 HD13 LEU 20 -0.215 -6.809 -2.317
159 HD21 LEU 20 HD21 LEU 20 -1.033 -4.172 -1.058
160 HD22 LEU 20 HD22 LEU 20 -2.547 -4.652 -0.285
161 HD23 LEU 20 HD23 LEU 20 -2.201 -5.151 -1.945
162 H LYS 21 HN LYS 21 -2.537 -8.753 2.446
163 HA LYS 21 HA LYS 21 -0.529 -7.619 4.041
164 HB2 LYS 21 HB2 LYS 21 -2.430 -9.825 4.830
165 HB3 LYS 21 HB1 LYS 21 -1.523 -8.821 5.943
166 HG2 LYS 21 HG2 LYS 21 -3.579 -7.809 4.012
167 HG3 LYS 21 HG1 LYS 21 -3.900 -8.216 5.694
168 HD2 LYS 21 HD2 LYS 21 -2.345 -6.487 6.417
169 HD3 LYS 21 HD1 LYS 21 -1.969 -6.111 4.729
170 HE2 LYS 21 HE2 LYS 21 -4.125 -5.367 4.292
171 HE3 LYS 21 HE1 LYS 21 -4.760 -6.040 5.804
172 HZ1 LYS 21 HZ1 LYS 21 -3.458 -4.382 6.984
173 HZ2 LYS 21 HZ2 LYS 21 -4.589 -3.739 5.972
174 HZ3 LYS 21 HZ3 LYS 21 -2.938 -3.707 5.509
175 H THR 22 HN THR 22 -1.096 -10.972 3.205
176 HA THR 22 HA THR 22 0.938 -12.082 4.773
177 HB THR 22 HB THR 22 -0.272 -13.216 2.247
178 HG1 THR 22 HG1 THR 22 -2.075 -12.930 3.405
179 HG21 THR 22 HG21 THR 22 0.132 -15.369 3.367
180 HG22 THR 22 HG22 THR 22 0.799 -14.521 4.761
181 HG23 THR 22 HG23 THR 22 1.640 -14.463 3.212
182 H ALA 23 HN ALA 23 0.829 -10.968 1.413
183 HA ALA 23 HA ALA 23 3.366 -11.920 0.643
184 HB1 ALA 23 HB1 ALA 23 3.146 -10.404 -1.266
185 HB2 ALA 23 HB2 ALA 23 1.810 -9.576 -0.469
186 HB3 ALA 23 HB3 ALA 23 1.630 -11.257 -0.970
187 H LEU 24 HN LEU 24 2.280 -8.848 2.006
188 HA LEU 24 HA LEU 24 4.851 -7.610 1.906
189 HB2 LEU 24 HB2 LEU 24 2.552 -6.982 3.745
190 HB3 LEU 24 HB1 LEU 24 3.941 -5.964 3.490
191 HG LEU 24 HG LEU 24 1.720 -6.544 1.540
192 HD11 LEU 24 HD11 LEU 24 1.119 -4.977 3.271
193 HD12 LEU 24 HD12 LEU 24 1.403 -4.050 1.776
194 HD13 LEU 24 HD13 LEU 24 2.617 -4.100 3.031
195 HD21 LEU 24 HD21 LEU 24 2.801 -4.847 0.099
196 HD22 LEU 24 HD22 LEU 24 3.718 -6.322 0.200
197 HD23 LEU 24 HD23 LEU 24 4.221 -4.893 1.131
198 H THR 25 HN THR 25 3.150 -9.368 4.416
199 HA THR 25 HA THR 25 5.019 -8.975 6.447
200 HB THR 25 HB THR 25 3.133 -11.314 6.027
201 HG1 THR 25 HG1 THR 25 1.891 -9.515 6.118
202 HG21 THR 25 HG21 THR 25 3.235 -11.562 8.475
203 HG22 THR 25 HG22 THR 25 4.404 -10.248 8.566
204 HG23 THR 25 HG23 THR 25 4.838 -11.760 7.765
205 H ALA 26 HN ALA 26 4.841 -11.446 3.909
206 HA ALA 26 HA ALA 26 6.964 -13.052 4.865
207 HB1 ALA 26 HB1 ALA 26 6.913 -14.095 2.672
208 HB2 ALA 26 HB2 ALA 26 5.934 -12.770 2.047
209 HB3 ALA 26 HB3 ALA 26 5.274 -13.850 3.275
210 H ASN 27 HN ASN 27 6.950 -10.027 3.358
211 HA ASN 27 HA ASN 27 9.777 -10.303 2.639
212 HB2 ASN 27 HB2 ASN 27 7.631 -8.521 1.521
213 HB3 ASN 27 HB1 ASN 27 9.341 -8.157 1.305
214 HD21 ASN 27 HD21 ASN 27 6.738 -10.361 0.482
215 HD22 ASN 27 HD22 ASN 27 7.587 -11.160 -0.784
216 H ARG 28 HN ARG 28 8.112 -9.569 5.145
217 HA ARG 28 HA ARG 28 8.269 -8.336 6.981
218 HB2 ARG 28 HB2 ARG 28 11.125 -8.022 6.052
219 HB3 ARG 28 HB1 ARG 28 10.553 -7.604 7.660
220 HG2 ARG 28 HG2 ARG 28 9.869 -9.976 7.965
221 HG3 ARG 28 HG1 ARG 28 10.611 -10.340 6.407
222 HD2 ARG 28 HD2 ARG 28 12.766 -9.510 7.263
223 HD3 ARG 28 HD1 ARG 28 12.007 -9.190 8.816
224 HE ARG 28 HE ARG 28 11.676 -11.880 7.951
225 HH11 ARG 28 HH11 ARG 28 13.920 -9.686 9.569
226 HH12 ARG 28 HH12 ARG 28 14.748 -10.892 10.439
227 HH21 ARG 28 HH21 ARG 28 12.780 -13.569 9.133
228 HH22 ARG 28 HH22 ARG 28 14.070 -13.202 10.183
229 H ILE 29 HN ILE 29 7.300 -6.934 4.724
230 HA ILE 29 HA ILE 29 8.508 -4.329 4.658
231 HB ILE 29 HB ILE 29 5.836 -5.225 3.529
232 HG12 ILE 29 HG12 ILE 29 8.472 -4.910 2.062
233 HG13 ILE 29 HG11 ILE 29 7.899 -6.461 2.685
234 HG21 ILE 29 HG21 ILE 29 6.009 -3.210 2.122
235 HG22 ILE 29 HG22 ILE 29 7.552 -2.816 2.890
236 HG23 ILE 29 HG23 ILE 29 6.079 -2.773 3.838
237 HD11 ILE 29 HD11 ILE 29 5.942 -6.183 1.200
238 HD12 ILE 29 HD12 ILE 29 7.494 -6.306 0.394
239 HD13 ILE 29 HD13 ILE 29 6.708 -4.725 0.548
240 H ALA 30 HN ALA 30 8.068 -2.667 5.901
241 HA ALA 30 HA ALA 30 6.167 -2.869 8.062
242 HB1 ALA 30 HB1 ALA 30 8.093 -0.743 7.209
243 HB2 ALA 30 HB2 ALA 30 8.400 -1.973 8.441
244 HB3 ALA 30 HB3 ALA 30 7.185 -0.711 8.719
245 H TYR 31 HN TYR 31 4.129 -2.077 7.889
246 HA TYR 31 HA TYR 31 3.677 0.141 6.055
247 HB2 TYR 31 HB2 TYR 31 1.686 -0.943 5.089
248 HB3 TYR 31 HB1 TYR 31 3.172 -1.795 4.705
249 HD1 TYR 31 HD2 TYR 31 3.615 -4.004 5.695
250 HD2 TYR 31 HD1 TYR 31 -0.043 -1.969 6.434
251 HE1 TYR 31 HE2 TYR 31 2.600 -6.115 6.453
252 HE2 TYR 31 HE1 TYR 31 -1.073 -4.080 7.186
253 HH TYR 31 HH TYR 31 0.725 -6.837 7.894
254 H ASP 32 HN ASP 32 1.532 1.083 6.262
255 HA ASP 32 HA ASP 32 0.388 0.825 8.955
256 HB2 ASP 32 HB2 ASP 32 1.560 2.981 8.750
257 HB3 ASP 32 HB1 ASP 32 0.756 3.299 7.221
258 H GLU 33 HN GLU 33 -1.907 0.770 8.965
259 HA GLU 33 HA GLU 33 -3.165 0.831 6.307
260 HB2 GLU 33 HB2 GLU 33 -4.542 -1.082 6.960
261 HB3 GLU 33 HB1 GLU 33 -2.835 -1.493 6.801
262 HG2 GLU 33 HG2 GLU 33 -2.591 -1.646 9.151
263 HG3 GLU 33 HG1 GLU 33 -4.165 -0.896 9.431
264 H VAL 34 HN VAL 34 -5.176 1.677 6.243
265 HA VAL 34 HA VAL 34 -6.601 1.976 8.702
266 HB VAL 34 HB VAL 34 -5.502 4.166 8.403
267 HG11 VAL 34 HG11 VAL 34 -6.904 4.342 5.760
268 HG12 VAL 34 HG12 VAL 34 -5.161 4.165 6.018
269 HG13 VAL 34 HG13 VAL 34 -5.989 5.632 6.536
270 HG21 VAL 34 HG21 VAL 34 -7.685 4.187 9.427
271 HG22 VAL 34 HG22 VAL 34 -8.448 4.257 7.837
272 HG23 VAL 34 HG23 VAL 34 -7.489 5.618 8.407
273 H ASP 35 HN ASP 35 -8.839 1.780 8.421
274 HA ASP 35 HA ASP 35 -9.547 0.425 5.985
275 HB2 ASP 35 HB2 ASP 35 -10.454 -0.316 8.150
276 HB3 ASP 35 HB1 ASP 35 -11.250 1.240 8.349
277 H ILE 36 HN ILE 36 -10.928 1.134 4.425
278 HA ILE 36 HA ILE 36 -10.866 3.996 4.162
279 HB ILE 36 HB ILE 36 -11.526 3.765 1.868
280 HG12 ILE 36 HG12 ILE 36 -11.694 0.789 2.373
281 HG13 ILE 36 HG11 ILE 36 -13.100 1.831 2.179
282 HG21 ILE 36 HG21 ILE 36 -9.614 2.260 1.177
283 HG22 ILE 36 HG22 ILE 36 -9.420 1.901 2.887
284 HG23 ILE 36 HG23 ILE 36 -9.235 3.557 2.309
285 HD11 ILE 36 HD11 ILE 36 -12.360 2.369 -0.094
286 HD12 ILE 36 HD12 ILE 36 -12.617 0.640 0.117
287 HD13 ILE 36 HD13 ILE 36 -10.976 1.295 0.105
288 H GLU 37 HN GLU 37 -13.372 1.741 4.978
289 HA GLU 37 HA GLU 37 -15.223 3.740 4.107
290 HB2 GLU 37 HB2 GLU 37 -17.028 2.151 4.952
291 HB3 GLU 37 HB1 GLU 37 -16.114 1.695 3.528
292 HG2 GLU 37 HG2 GLU 37 -14.721 0.246 4.980
293 HG3 GLU 37 HG1 GLU 37 -15.802 0.634 6.317
294 H HIS 38 HN HIS 38 -13.525 3.085 6.805
295 HA HIS 38 HA HIS 38 -15.303 4.561 8.542
296 HB2 HIS 38 HB2 HIS 38 -13.713 2.910 9.502
297 HB3 HIS 38 HB1 HIS 38 -12.368 3.877 8.906
298 HD1 HIS 38 HD1 HIS 38 -11.616 5.851 10.375
299 HD2 HIS 38 HD2 HIS 38 -15.175 4.102 11.637
300 HE1 HIS 38 HE1 HIS 38 -12.138 6.869 12.613
301 H ASN 39 HN ASN 39 -12.237 5.140 6.846
302 HA ASN 39 HA ASN 39 -12.457 7.969 7.408
303 HB2 ASN 39 HB2 ASN 39 -10.261 6.323 6.149
304 HB3 ASN 39 HB1 ASN 39 -10.241 8.082 6.151
305 HD21 ASN 39 HD21 ASN 39 -8.373 8.056 7.333
306 HD22 ASN 39 HD22 ASN 39 -8.369 7.637 9.018
307 H ARG 40 HN ARG 40 -13.990 8.796 6.222
308 HA ARG 40 HA ARG 40 -14.787 8.065 3.661
309 HB2 ARG 40 HB2 ARG 40 -16.127 9.362 5.283
310 HB3 ARG 40 HB1 ARG 40 -15.098 10.750 4.989
311 HG2 ARG 40 HG2 ARG 40 -15.821 10.809 2.663
312 HG3 ARG 40 HG1 ARG 40 -16.841 9.395 2.945
313 HD2 ARG 40 HD2 ARG 40 -17.088 12.080 4.289
314 HD3 ARG 40 HD1 ARG 40 -18.160 11.443 3.045
315 HE ARG 40 HE ARG 40 -18.373 9.554 4.873
316 HH11 ARG 40 HH11 ARG 40 -18.440 13.077 5.310
317 HH12 ARG 40 HH12 ARG 40 -19.500 13.050 6.631
318 HH21 ARG 40 HH21 ARG 40 -19.810 9.505 6.725
319 HH22 ARG 40 HH22 ARG 40 -20.311 10.957 7.463
320 H ALA 41 HN ALA 41 -12.469 10.527 4.667
321 HA ALA 41 HA ALA 41 -12.094 11.655 2.076
322 HB1 ALA 41 HB1 ALA 41 -11.445 12.874 4.105
323 HB2 ALA 41 HB2 ALA 41 -10.068 12.663 3.017
324 HB3 ALA 41 HB3 ALA 41 -10.223 11.647 4.442
325 H ALA 42 HN ALA 42 -10.653 8.994 3.802
326 HA ALA 42 HA ALA 42 -8.560 8.573 1.914
327 HB1 ALA 42 HB1 ALA 42 -9.726 6.635 3.912
328 HB2 ALA 42 HB2 ALA 42 -8.384 7.743 4.217
329 HB3 ALA 42 HB3 ALA 42 -8.209 6.454 3.026
330 H ALA 43 HN ALA 43 -11.747 7.186 2.504
331 HA ALA 43 HA ALA 43 -11.865 5.251 0.513
332 HB1 ALA 43 HB1 ALA 43 -14.079 7.047 1.477
333 HB2 ALA 43 HB2 ALA 43 -13.564 5.545 2.241
334 HB3 ALA 43 HB3 ALA 43 -14.278 5.513 0.627
335 H GLU 44 HN GLU 44 -12.674 8.658 0.378
336 HA GLU 44 HA GLU 44 -13.542 8.742 -2.274
337 HB2 GLU 44 HB2 GLU 44 -13.784 10.504 -0.486
338 HB3 GLU 44 HB1 GLU 44 -12.105 10.932 -0.784
339 HG2 GLU 44 HG2 GLU 44 -13.549 12.420 -1.941
340 HG3 GLU 44 HG1 GLU 44 -12.670 11.429 -3.113
341 H PHE 45 HN PHE 45 -10.388 9.317 -0.814
342 HA PHE 45 HA PHE 45 -8.935 9.948 -3.112
343 HB2 PHE 45 HB2 PHE 45 -8.106 10.393 -0.861
344 HB3 PHE 45 HB1 PHE 45 -8.053 8.673 -0.523
345 HD1 PHE 45 HD2 PHE 45 -6.581 11.293 -2.679
346 HD2 PHE 45 HD1 PHE 45 -6.157 7.414 -0.984
347 HE1 PHE 45 HE2 PHE 45 -4.253 11.207 -3.470
348 HE2 PHE 45 HE1 PHE 45 -3.833 7.327 -1.765
349 HZ PHE 45 HZ PHE 45 -2.878 9.222 -3.013
350 H VAL 46 HN VAL 46 -9.118 6.817 -1.407
351 HA VAL 46 HA VAL 46 -7.635 5.400 -3.358
352 HB VAL 46 HB VAL 46 -7.746 4.491 -1.105
353 HG11 VAL 46 HG11 VAL 46 -9.730 3.483 -0.265
354 HG12 VAL 46 HG12 VAL 46 -10.648 4.110 -1.652
355 HG13 VAL 46 HG13 VAL 46 -9.911 5.231 -0.469
356 HG21 VAL 46 HG21 VAL 46 -7.552 2.965 -2.998
357 HG22 VAL 46 HG22 VAL 46 -9.297 2.628 -2.824
358 HG23 VAL 46 HG23 VAL 46 -8.175 2.231 -1.515
359 H GLY 47 HN GLY 47 -11.085 5.995 -3.060
360 HA2 GLY 47 HA2 GLY 47 -11.888 4.196 -5.075
361 HA3 GLY 47 HA1 GLY 47 -12.784 5.606 -4.526
362 H SER 48 HN SER 48 -10.473 7.350 -5.193
363 HA SER 48 HA SER 48 -11.230 7.886 -7.913
364 HB2 SER 48 HB2 SER 48 -9.130 9.232 -6.199
365 HB3 SER 48 HB1 SER 48 -9.824 9.857 -7.694
366 HG SER 48 HG SER 48 -11.105 9.462 -5.191
367 H VAL 49 HN VAL 49 -8.410 6.628 -6.222
368 HA VAL 49 HA VAL 49 -6.867 6.467 -8.707
369 HB VAL 49 HB VAL 49 -4.972 5.777 -7.275
370 HG11 VAL 49 HG11 VAL 49 -6.438 8.191 -6.287
371 HG12 VAL 49 HG12 VAL 49 -5.326 8.136 -7.669
372 HG13 VAL 49 HG13 VAL 49 -4.723 7.865 -6.024
373 HG21 VAL 49 HG21 VAL 49 -5.163 5.783 -4.856
374 HG22 VAL 49 HG22 VAL 49 -6.308 4.611 -5.545
375 HG23 VAL 49 HG23 VAL 49 -6.871 6.185 -4.990
376 H ASN 50 HN ASN 50 -9.130 4.680 -7.447
377 HA ASN 50 HA ASN 50 -7.851 2.109 -7.470
378 HB2 ASN 50 HB2 ASN 50 -10.260 3.145 -6.431
379 HB3 ASN 50 HB1 ASN 50 -10.736 1.959 -7.638
380 HD21 ASN 50 HD21 ASN 50 -7.888 1.934 -5.566
381 HD22 ASN 50 HD22 ASN 50 -8.355 0.509 -4.717
382 H GLY 51 HN GLY 51 -9.337 0.408 -8.770
383 HA2 GLY 51 HA2 GLY 51 -9.115 1.138 -11.545
384 HA3 GLY 51 HA1 GLY 51 -9.584 -0.440 -10.904
385 H GLY 52 HN GLY 52 -10.695 2.829 -11.405
386 HA2 GLY 52 HA2 GLY 52 -12.750 3.459 -12.355
387 HA3 GLY 52 HA1 GLY 52 -13.330 1.814 -12.123
388 H ASN 53 HN ASN 53 -13.358 1.229 -9.668
389 HA ASN 53 HA ASN 53 -14.443 3.449 -8.106
390 HB2 ASN 53 HB2 ASN 53 -16.446 2.175 -7.500
391 HB3 ASN 53 HB1 ASN 53 -16.387 2.402 -9.246
392 HD21 ASN 53 HD21 ASN 53 -16.041 0.602 -10.560
393 HD22 ASN 53 HD22 ASN 53 -16.165 -1.012 -9.965
394 H ARG 54 HN ARG 54 -14.941 2.627 -5.864
395 HA ARG 54 HA ARG 54 -12.636 1.565 -4.676
396 HB2 ARG 54 HB2 ARG 54 -13.957 1.630 -2.584
397 HB3 ARG 54 HB1 ARG 54 -14.135 3.105 -3.521
398 HG2 ARG 54 HG2 ARG 54 -16.281 2.052 -4.444
399 HG3 ARG 54 HG1 ARG 54 -16.120 0.886 -3.139
400 HD2 ARG 54 HD2 ARG 54 -16.275 3.857 -2.832
401 HD3 ARG 54 HD1 ARG 54 -17.622 2.745 -2.608
402 HE ARG 54 HE ARG 54 -15.992 1.800 -0.793
403 HH11 ARG 54 HH11 ARG 54 -16.520 5.201 -1.623
404 HH12 ARG 54 HH12 ARG 54 -16.340 5.784 -0.051
405 HH21 ARG 54 HH21 ARG 54 -15.776 2.580 1.398
406 HH22 ARG 54 HH22 ARG 54 -15.924 4.254 1.742
407 H THR 55 HN THR 55 -11.978 -0.459 -4.987
408 HA THR 55 HA THR 55 -13.612 -2.571 -3.982
409 HB THR 55 HB THR 55 -14.488 -2.593 -6.232
410 HG1 THR 55 HG1 THR 55 -14.004 -4.667 -6.853
411 HG21 THR 55 HG21 THR 55 -13.063 -2.975 -8.226
412 HG22 THR 55 HG22 THR 55 -11.630 -2.821 -7.205
413 HG23 THR 55 HG23 THR 55 -12.706 -1.444 -7.425
414 H VAL 56 HN VAL 56 -10.553 -1.590 -5.392
415 HA VAL 56 HA VAL 56 -9.373 -3.950 -4.158
416 HB VAL 56 HB VAL 56 -7.414 -3.506 -5.660
417 HG11 VAL 56 HG11 VAL 56 -10.058 -4.183 -6.976
418 HG12 VAL 56 HG12 VAL 56 -9.005 -5.313 -6.132
419 HG13 VAL 56 HG13 VAL 56 -8.475 -4.574 -7.641
420 HG21 VAL 56 HG21 VAL 56 -7.821 -2.242 -7.743
421 HG22 VAL 56 HG22 VAL 56 -7.874 -1.219 -6.305
422 HG23 VAL 56 HG23 VAL 56 -9.372 -1.717 -7.090
423 HA PRO 57 HA PRO 57 -7.174 -1.464 -1.283
424 HB2 PRO 57 HB2 PRO 57 -4.822 -2.895 -1.088
425 HB3 PRO 57 HB1 PRO 57 -6.321 -3.367 -0.286
426 HG2 PRO 57 HG2 PRO 57 -5.142 -4.382 -2.825
427 HG3 PRO 57 HG1 PRO 57 -5.952 -5.270 -1.524
428 HD2 PRO 57 HD2 PRO 57 -7.189 -4.647 -3.834
429 HD3 PRO 57 HD1 PRO 57 -8.061 -4.721 -2.287
430 H THR 58 HN THR 58 -5.532 0.071 -1.217
431 HA THR 58 HA THR 58 -3.824 0.229 -3.552
432 HB THR 58 HB THR 58 -5.440 2.567 -2.483
433 HG1 THR 58 HG1 THR 58 -6.089 0.559 -4.040
434 HG21 THR 58 HG21 THR 58 -4.739 3.688 -4.546
435 HG22 THR 58 HG22 THR 58 -3.720 2.324 -4.964
436 HG23 THR 58 HG23 THR 58 -3.345 3.306 -3.529
437 H VAL 59 HN VAL 59 -1.770 1.158 -2.998
438 HA VAL 59 HA VAL 59 -1.457 1.784 -0.156
439 HB VAL 59 HB VAL 59 0.957 1.237 -0.427
440 HG11 VAL 59 HG11 VAL 59 -0.996 -0.899 -1.199
441 HG12 VAL 59 HG12 VAL 59 -0.410 -0.497 0.437
442 HG13 VAL 59 HG13 VAL 59 0.678 -1.205 -0.750
443 HG21 VAL 59 HG21 VAL 59 0.143 0.306 -3.171
444 HG22 VAL 59 HG22 VAL 59 1.719 0.039 -2.413
445 HG23 VAL 59 HG23 VAL 59 1.191 1.678 -2.805
446 H LYS 60 HN LYS 60 -0.814 3.686 0.438
447 HA LYS 60 HA LYS 60 0.027 5.649 -1.600
448 HB2 LYS 60 HB2 LYS 60 -1.964 6.179 -0.130
449 HB3 LYS 60 HB1 LYS 60 -0.881 6.105 1.248
450 HG2 LYS 60 HG2 LYS 60 0.429 7.978 0.274
451 HG3 LYS 60 HG1 LYS 60 -0.751 8.082 -1.028
452 HD2 LYS 60 HD2 LYS 60 -1.299 9.753 0.615
453 HD3 LYS 60 HD1 LYS 60 -2.519 8.483 0.704
454 HE2 LYS 60 HE2 LYS 60 -1.290 7.501 2.630
455 HE3 LYS 60 HE1 LYS 60 -0.149 8.839 2.538
456 HZ1 LYS 60 HZ1 LYS 60 -3.051 9.020 3.129
457 HZ2 LYS 60 HZ2 LYS 60 -2.009 10.345 2.991
458 HZ3 LYS 60 HZ3 LYS 60 -1.796 9.230 4.235
459 H PHE 61 HN PHE 61 2.149 6.026 -1.631
460 HA PHE 61 HA PHE 61 3.801 4.855 0.438
461 HB2 PHE 61 HB2 PHE 61 4.521 6.226 -2.139
462 HB3 PHE 61 HB1 PHE 61 5.688 5.542 -1.023
463 HD1 PHE 61 HD2 PHE 61 2.950 4.779 -3.325
464 HD2 PHE 61 HD1 PHE 61 6.106 3.219 -0.948
465 HE1 PHE 61 HE2 PHE 61 2.712 2.638 -4.437
466 HE2 PHE 61 HE1 PHE 61 5.883 1.045 -2.069
467 HZ PHE 61 HZ PHE 61 4.186 0.754 -3.832
468 H ALA 62 HN ALA 62 5.737 6.025 1.086
469 HA ALA 62 HA ALA 62 5.245 8.324 2.579
470 HB1 ALA 62 HB1 ALA 62 6.973 6.695 3.115
471 HB2 ALA 62 HB2 ALA 62 7.654 8.320 3.002
472 HB3 ALA 62 HB3 ALA 62 7.881 7.174 1.683
473 H ASP 63 HN ASP 63 5.834 8.085 -0.727
474 HA ASP 63 HA ASP 63 6.958 10.767 -0.926
475 HB2 ASP 63 HB2 ASP 63 7.299 10.376 -3.253
476 HB3 ASP 63 HB1 ASP 63 7.822 8.920 -2.420
477 H GLY 64 HN GLY 64 3.927 9.264 -0.849
478 HA2 GLY 64 HA2 GLY 64 1.979 10.582 -0.725
479 HA3 GLY 64 HA1 GLY 64 2.699 11.729 -1.840
480 H SER 65 HN SER 65 3.525 9.280 -3.591
481 HA SER 65 HA SER 65 1.033 9.268 -5.041
482 HB2 SER 65 HB2 SER 65 3.636 7.904 -5.730
483 HB3 SER 65 HB1 SER 65 2.283 8.227 -6.821
484 HG SER 65 HG SER 65 4.084 9.989 -5.614
485 H THR 66 HN THR 66 0.163 7.241 -5.916
486 HA THR 66 HA THR 66 0.184 5.164 -3.865
487 HB THR 66 HB THR 66 -2.070 4.679 -5.007
488 HG1 THR 66 HG1 THR 66 -1.838 6.099 -6.778
489 HG21 THR 66 HG21 THR 66 -3.206 6.319 -3.575
490 HG22 THR 66 HG22 THR 66 -1.672 7.168 -3.339
491 HG23 THR 66 HG23 THR 66 -1.883 5.519 -2.737
492 H LEU 67 HN LEU 67 -0.260 3.041 -4.646
493 HA LEU 67 HA LEU 67 -0.168 2.602 -7.504
494 HB2 LEU 67 HB2 LEU 67 1.485 0.990 -5.503
495 HB3 LEU 67 HB1 LEU 67 1.104 0.424 -7.106
496 HG LEU 67 HG LEU 67 2.846 2.818 -6.451
497 HD11 LEU 67 HD11 LEU 67 3.885 0.608 -5.952
498 HD12 LEU 67 HD12 LEU 67 4.674 1.470 -7.262
499 HD13 LEU 67 HD13 LEU 67 3.582 0.139 -7.625
500 HD21 LEU 67 HD21 LEU 67 3.370 2.800 -8.854
501 HD22 LEU 67 HD22 LEU 67 1.684 3.177 -8.550
502 HD23 LEU 67 HD23 LEU 67 2.139 1.562 -9.106
503 H THR 68 HN THR 68 -2.006 1.768 -7.995
504 HA THR 68 HA THR 68 -3.887 0.729 -6.208
505 HB THR 68 HB THR 68 -3.662 0.165 -9.170
506 HG1 THR 68 HG1 THR 68 -5.081 2.445 -8.581
507 HG21 THR 68 HG21 THR 68 -6.128 0.332 -9.068
508 HG22 THR 68 HG22 THR 68 -6.030 0.664 -7.337
509 HG23 THR 68 HG23 THR 68 -5.535 -0.906 -7.964
510 H ASN 69 HN ASN 69 -4.364 -1.410 -5.683
511 HA ASN 69 HA ASN 69 -2.967 -3.083 -4.576
512 HB2 ASN 69 HB2 ASN 69 -5.132 -3.688 -5.038
513 HB3 ASN 69 HB1 ASN 69 -4.798 -4.080 -6.744
514 HD21 ASN 69 HD21 ASN 69 -5.382 -6.202 -6.680
515 HD22 ASN 69 HD22 ASN 69 -4.593 -7.398 -5.718
516 HA PRO 70 HA PRO 70 0.464 -4.368 -7.205
517 HB2 PRO 70 HB2 PRO 70 2.344 -3.325 -5.557
518 HB3 PRO 70 HB1 PRO 70 1.577 -2.403 -6.850
519 HG2 PRO 70 HG2 PRO 70 1.322 -2.019 -3.993
520 HG3 PRO 70 HG1 PRO 70 0.624 -1.051 -5.300
521 HD2 PRO 70 HD2 PRO 70 -0.605 -3.179 -3.666
522 HD3 PRO 70 HD1 PRO 70 -1.359 -1.865 -4.595
523 H SER 71 HN SER 71 2.126 -5.819 -6.736
524 HA SER 71 HA SER 71 1.539 -7.584 -4.514
525 HB2 SER 71 HB2 SER 71 3.672 -7.878 -6.613
526 HB3 SER 71 HB1 SER 71 2.816 -9.152 -5.730
527 HG SER 71 HG SER 71 1.843 -7.414 -7.706
528 H ALA 72 HN ALA 72 3.690 -8.488 -3.419
529 HA ALA 72 HA ALA 72 4.840 -6.379 -1.911
530 HB1 ALA 72 HB1 ALA 72 4.557 -8.646 -1.061
531 HB2 ALA 72 HB2 ALA 72 6.227 -8.103 -0.930
532 HB3 ALA 72 HB3 ALA 72 5.765 -9.235 -2.205
533 H ASP 73 HN ASP 73 6.047 -8.194 -4.652
534 HA ASP 73 HA ASP 73 8.689 -7.211 -4.646
535 HB2 ASP 73 HB2 ASP 73 6.980 -8.059 -6.987
536 HB3 ASP 73 HB1 ASP 73 8.693 -7.695 -7.108
537 H GLU 74 HN GLU 74 5.823 -6.061 -6.260
538 HA GLU 74 HA GLU 74 6.953 -3.929 -7.681
539 HB2 GLU 74 HB2 GLU 74 4.120 -4.256 -6.693
540 HB3 GLU 74 HB1 GLU 74 4.644 -3.160 -7.965
541 HG2 GLU 74 HG2 GLU 74 5.308 -5.040 -9.351
542 HG3 GLU 74 HG1 GLU 74 4.867 -6.161 -8.066
543 H VAL 75 HN VAL 75 5.418 -4.044 -4.483
544 HA VAL 75 HA VAL 75 5.764 -1.249 -4.110
545 HB VAL 75 HB VAL 75 5.274 -1.708 -1.656
546 HG11 VAL 75 HG11 VAL 75 3.546 -0.951 -3.220
547 HG12 VAL 75 HG12 VAL 75 2.874 -2.150 -2.108
548 HG13 VAL 75 HG13 VAL 75 3.316 -2.618 -3.750
549 HG21 VAL 75 HG21 VAL 75 4.558 -4.386 -2.756
550 HG22 VAL 75 HG22 VAL 75 4.233 -3.830 -1.115
551 HG23 VAL 75 HG23 VAL 75 5.906 -4.079 -1.658
552 H LYS 76 HN LYS 76 7.672 -4.041 -3.068
553 HA LYS 76 HA LYS 76 9.538 -2.733 -1.431
554 HB2 LYS 76 HB2 LYS 76 9.875 -5.067 -3.311
555 HB3 LYS 76 HB1 LYS 76 11.143 -4.512 -2.233
556 HG2 LYS 76 HG2 LYS 76 9.942 -5.153 -0.322
557 HG3 LYS 76 HG1 LYS 76 8.441 -5.320 -1.239
558 HD2 LYS 76 HD2 LYS 76 9.373 -7.512 -0.723
559 HD3 LYS 76 HD1 LYS 76 9.387 -7.215 -2.452
560 HE2 LYS 76 HE2 LYS 76 11.790 -6.579 -2.261
561 HE3 LYS 76 HE1 LYS 76 11.726 -7.037 -0.559
562 HZ1 LYS 76 HZ1 LYS 76 12.573 -8.850 -1.921
563 HZ2 LYS 76 HZ2 LYS 76 11.203 -8.804 -2.869
564 HZ3 LYS 76 HZ3 LYS 76 11.066 -9.293 -1.269
565 H ALA 77 HN ALA 77 9.425 -3.212 -4.884
566 HA ALA 77 HA ALA 77 11.902 -2.170 -5.595
567 HB1 ALA 77 HB1 ALA 77 10.483 -3.478 -7.099
568 HB2 ALA 77 HB2 ALA 77 10.978 -1.950 -7.835
569 HB3 ALA 77 HB3 ALA 77 9.349 -2.132 -7.190
570 H LYS 78 HN LYS 78 8.834 -0.537 -5.020
571 HA LYS 78 HA LYS 78 9.926 1.949 -5.989
572 HB2 LYS 78 HB2 LYS 78 7.404 1.188 -6.029
573 HB3 LYS 78 HB1 LYS 78 7.393 1.861 -4.401
574 HG2 LYS 78 HG2 LYS 78 8.544 3.908 -5.555
575 HG3 LYS 78 HG1 LYS 78 7.835 3.208 -6.999
576 HD2 LYS 78 HD2 LYS 78 5.617 3.334 -5.963
577 HD3 LYS 78 HD1 LYS 78 6.342 4.101 -4.546
578 HE2 LYS 78 HE2 LYS 78 7.338 5.788 -6.198
579 HE3 LYS 78 HE1 LYS 78 6.213 5.119 -7.354
580 HZ1 LYS 78 HZ1 LYS 78 4.382 5.739 -5.875
581 HZ2 LYS 78 HZ2 LYS 78 5.318 7.018 -6.421
582 HZ3 LYS 78 HZ3 LYS 78 5.514 6.515 -4.832
583 H LEU 79 HN LEU 79 8.868 0.585 -2.919
584 HA LEU 79 HA LEU 79 9.169 2.782 -1.269
585 HB2 LEU 79 HB2 LEU 79 7.945 0.795 -0.643
586 HB3 LEU 79 HB1 LEU 79 9.421 -0.144 -0.622
587 HG LEU 79 HG LEU 79 10.229 1.198 1.272
588 HD11 LEU 79 HD11 LEU 79 8.981 3.256 0.820
589 HD12 LEU 79 HD12 LEU 79 8.725 2.686 2.460
590 HD13 LEU 79 HD13 LEU 79 7.475 2.432 1.237
591 HD21 LEU 79 HD21 LEU 79 9.104 -0.908 1.680
592 HD22 LEU 79 HD22 LEU 79 7.537 -0.100 1.670
593 HD23 LEU 79 HD23 LEU 79 8.698 0.248 2.949
594 H VAL 80 HN VAL 80 11.563 0.351 -2.156
595 HA VAL 80 HA VAL 80 13.547 1.080 -0.304
596 HB VAL 80 HB VAL 80 13.551 -1.025 -1.650
597 HG11 VAL 80 HG11 VAL 80 12.968 -0.206 -3.817
598 HG12 VAL 80 HG12 VAL 80 14.509 -1.068 -3.880
599 HG13 VAL 80 HG13 VAL 80 14.482 0.695 -3.913
600 HG21 VAL 80 HG21 VAL 80 15.506 -0.407 -0.446
601 HG22 VAL 80 HG22 VAL 80 16.047 0.640 -1.762
602 HG23 VAL 80 HG23 VAL 80 15.999 -1.114 -1.989
603 H LYS 81 HN LYS 81 12.783 2.463 -3.458
604 HA LYS 81 HA LYS 81 15.196 4.000 -3.610
605 HB2 LYS 81 HB2 LYS 81 12.613 4.430 -5.114
606 HB3 LYS 81 HB1 LYS 81 14.193 5.059 -5.549
607 HG2 LYS 81 HG2 LYS 81 14.976 2.763 -5.939
608 HG3 LYS 81 HG1 LYS 81 13.363 2.165 -5.534
609 HD2 LYS 81 HD2 LYS 81 12.517 3.712 -7.415
610 HD3 LYS 81 HD1 LYS 81 14.203 3.871 -7.844
611 HE2 LYS 81 HE2 LYS 81 14.442 1.545 -8.268
612 HE3 LYS 81 HE1 LYS 81 12.838 1.209 -7.621
613 HZ1 LYS 81 HZ1 LYS 81 13.425 2.776 -10.071
614 HZ2 LYS 81 HZ2 LYS 81 11.898 2.487 -9.434
615 HZ3 LYS 81 HZ3 LYS 81 12.816 1.204 -10.017
616 H ILE 82 HN ILE 82 12.073 4.425 -2.251
617 HA ILE 82 HA ILE 82 12.139 7.290 -2.018
618 HB ILE 82 HB ILE 82 10.479 5.350 -0.381
619 HG12 ILE 82 HG12 ILE 82 9.751 6.705 -2.982
620 HG13 ILE 82 HG11 ILE 82 10.181 5.003 -2.815
621 HG21 ILE 82 HG21 ILE 82 10.096 8.276 -1.043
622 HG22 ILE 82 HG22 ILE 82 10.523 7.608 0.533
623 HG23 ILE 82 HG23 ILE 82 8.939 7.275 -0.170
624 HD11 ILE 82 HD11 ILE 82 7.802 6.380 -1.592
625 HD12 ILE 82 HD12 ILE 82 8.229 4.690 -1.354
626 HD13 ILE 82 HD13 ILE 82 7.778 5.266 -2.958
627 H ALA 83 HN ALA 83 12.750 4.557 0.113
628 HA ALA 83 HA ALA 83 13.297 6.222 2.374
629 HB1 ALA 83 HB1 ALA 83 13.815 3.276 2.016
630 HB2 ALA 83 HB2 ALA 83 12.341 4.003 2.673
631 HB3 ALA 83 HB3 ALA 83 13.865 4.165 3.538
632 H GLY 84 HN GLY 84 15.349 4.259 0.198
633 HA2 GLY 84 HA2 GLY 84 17.540 5.547 -0.228
634 HA3 GLY 84 HA1 GLY 84 17.641 5.415 1.544
635 H LEU 85 HN LEU 85 19.271 4.117 1.823
636 HA LEU 85 HA LEU 85 20.180 2.135 2.307
637 HB2 LEU 85 HB2 LEU 85 17.601 1.023 1.263
638 HB3 LEU 85 HB1 LEU 85 18.870 0.017 1.929
639 HG LEU 85 HG LEU 85 17.148 0.256 3.493
640 HD11 LEU 85 HD11 LEU 85 19.455 1.981 4.353
641 HD12 LEU 85 HD12 LEU 85 19.343 0.225 4.468
642 HD13 LEU 85 HD13 LEU 85 18.281 1.239 5.440
643 HD21 LEU 85 HD21 LEU 85 16.393 2.384 4.466
644 HD22 LEU 85 HD22 LEU 85 16.037 2.235 2.741
645 HD23 LEU 85 HD23 LEU 85 17.379 3.247 3.281
646 H GLU 86 HN GLU 86 18.665 1.925 -0.910
647 HA GLU 86 HA GLU 86 20.823 0.268 -1.823
648 HB2 GLU 86 HB2 GLU 86 19.701 0.266 -4.052
649 HB3 GLU 86 HB1 GLU 86 18.626 -0.197 -2.744
650 HG2 GLU 86 HG2 GLU 86 17.357 1.730 -2.920
651 HG3 GLU 86 HG1 GLU 86 18.641 2.610 -3.746
652 H HIS 87 HN HIS 87 22.433 1.731 -1.238
653 HA HIS 87 HA HIS 87 23.611 3.089 -3.407
654 HB2 HIS 87 HB2 HIS 87 23.642 5.400 -2.474
655 HB3 HIS 87 HB1 HIS 87 22.003 4.907 -2.861
656 HD1 HIS 87 HD1 HIS 87 24.247 5.657 0.147
657 HD2 HIS 87 HD2 HIS 87 20.263 4.799 -0.725
658 HE1 HIS 87 HE1 HIS 87 22.953 6.131 2.231
659 H HIS 88 HN HIS 88 25.499 4.461 -2.357
660 HA HIS 88 HA HIS 88 26.301 3.251 0.154
661 HB2 HIS 88 HB2 HIS 88 27.618 2.212 -1.726
662 HB3 HIS 88 HB1 HIS 88 28.177 3.819 -2.175
663 HD1 HIS 88 HD1 HIS 88 30.114 4.794 -0.823
664 HD2 HIS 88 HD2 HIS 88 28.625 1.257 0.733
665 HE1 HIS 88 HE1 HIS 88 31.718 4.111 0.992
Start of MODEL 2
1 H1 MET 1 HT1 MET 1 14.128 5.966 7.477
2 H2 MET 1 HT2 MET 1 13.534 4.673 8.352
3 H3 MET 1 HT3 MET 1 14.922 5.459 8.910
4 HA MET 1 HA MET 1 13.016 6.019 10.207
5 HB2 MET 1 HB2 MET 1 13.630 8.269 8.261
6 HB3 MET 1 HB1 MET 1 12.902 8.463 9.843
7 HG2 MET 1 HG2 MET 1 15.695 7.509 9.277
8 HG3 MET 1 HG1 MET 1 15.235 9.090 9.901
9 HE1 MET 1 HE1 MET 1 16.898 8.875 11.935
10 HE2 MET 1 HE2 MET 1 17.433 7.328 11.285
11 HE3 MET 1 HE3 MET 1 16.977 7.459 12.984
12 H VAL 2 HN VAL 2 11.014 7.780 9.726
13 HA VAL 2 HA VAL 2 8.997 8.125 8.831
14 HB VAL 2 HB VAL 2 10.033 6.660 6.367
15 HG11 VAL 2 HG11 VAL 2 7.568 8.362 6.649
16 HG12 VAL 2 HG12 VAL 2 7.603 6.609 6.445
17 HG13 VAL 2 HG13 VAL 2 8.173 7.660 5.149
18 HG21 VAL 2 HG21 VAL 2 10.265 8.891 5.380
19 HG22 VAL 2 HG22 VAL 2 11.276 8.709 6.815
20 HG23 VAL 2 HG23 VAL 2 9.770 9.621 6.905
21 H THR 3 HN THR 3 7.748 7.114 10.211
22 HA THR 3 HA THR 3 7.515 4.339 10.384
23 HB THR 3 HB THR 3 5.272 5.641 11.507
24 HG1 THR 3 HG1 THR 3 6.003 7.603 11.729
25 HG21 THR 3 HG21 THR 3 7.924 4.849 12.691
26 HG22 THR 3 HG22 THR 3 6.549 3.757 12.463
27 HG23 THR 3 HG23 THR 3 6.438 5.103 13.607
28 H ALA 4 HN ALA 4 5.535 6.877 8.869
29 HA ALA 4 HA ALA 4 3.792 4.811 7.825
30 HB1 ALA 4 HB1 ALA 4 2.712 6.838 8.705
31 HB2 ALA 4 HB2 ALA 4 2.386 6.644 6.981
32 HB3 ALA 4 HB3 ALA 4 3.587 7.815 7.528
33 H ALA 5 HN ALA 5 5.532 3.920 6.710
34 HA ALA 5 HA ALA 5 6.950 5.112 4.597
35 HB1 ALA 5 HB1 ALA 5 6.201 2.223 5.065
36 HB2 ALA 5 HB2 ALA 5 7.654 3.034 5.655
37 HB3 ALA 5 HB3 ALA 5 7.417 2.783 3.924
38 H LEU 6 HN LEU 6 4.094 3.047 4.603
39 HA LEU 6 HA LEU 6 2.931 4.550 2.497
40 HB2 LEU 6 HB2 LEU 6 2.353 2.624 1.085
41 HB3 LEU 6 HB1 LEU 6 4.080 2.872 1.132
42 HG LEU 6 HG LEU 6 2.730 0.770 2.833
43 HD11 LEU 6 HD11 LEU 6 2.114 0.306 0.569
44 HD12 LEU 6 HD12 LEU 6 3.376 -0.822 1.068
45 HD13 LEU 6 HD13 LEU 6 3.770 0.566 0.032
46 HD21 LEU 6 HD21 LEU 6 5.534 1.062 1.760
47 HD22 LEU 6 HD22 LEU 6 4.943 -0.257 2.775
48 HD23 LEU 6 HD23 LEU 6 5.026 1.384 3.416
49 H THR 7 HN THR 7 0.814 4.504 2.561
50 HA THR 7 HA THR 7 -0.312 3.106 4.856
51 HB THR 7 HB THR 7 -1.413 5.528 3.408
52 HG1 THR 7 HG1 THR 7 0.563 5.173 5.305
53 HG21 THR 7 HG21 THR 7 -1.979 4.344 6.139
54 HG22 THR 7 HG22 THR 7 -3.042 4.220 4.734
55 HG23 THR 7 HG23 THR 7 -2.729 5.794 5.469
56 H ILE 8 HN ILE 8 -1.629 1.552 4.470
57 HA ILE 8 HA ILE 8 -2.509 0.922 1.787
58 HB ILE 8 HB ILE 8 -2.593 -0.616 4.394
59 HG12 ILE 8 HG12 ILE 8 -1.103 -1.164 1.838
60 HG13 ILE 8 HG11 ILE 8 -0.375 -0.450 3.281
61 HG21 ILE 8 HG21 ILE 8 -3.656 -1.505 1.733
62 HG22 ILE 8 HG22 ILE 8 -4.551 -1.151 3.223
63 HG23 ILE 8 HG23 ILE 8 -3.444 -2.522 3.173
64 HD11 ILE 8 HD11 ILE 8 -1.559 -3.205 3.006
65 HD12 ILE 8 HD12 ILE 8 -0.880 -2.528 4.490
66 HD13 ILE 8 HD13 ILE 8 0.156 -2.801 3.093
67 H TYR 9 HN TYR 9 -4.360 1.513 1.070
68 HA TYR 9 HA TYR 9 -6.575 2.022 2.907
69 HB2 TYR 9 HB2 TYR 9 -6.218 2.658 -0.019
70 HB3 TYR 9 HB1 TYR 9 -7.667 3.011 0.911
71 HD1 TYR 9 HD1 TYR 9 -7.188 4.382 3.124
72 HD2 TYR 9 HD2 TYR 9 -4.697 4.344 -0.307
73 HE1 TYR 9 HE1 TYR 9 -6.263 6.530 3.800
74 HE2 TYR 9 HE2 TYR 9 -3.761 6.502 0.350
75 HH TYR 9 HH TYR 9 -4.287 7.869 3.431
76 H THR 10 HN THR 10 -7.757 0.396 3.334
77 HA THR 10 HA THR 10 -8.598 -1.351 1.202
78 HB THR 10 HB THR 10 -6.556 -2.441 2.105
79 HG1 THR 10 HG1 THR 10 -8.225 -4.181 3.249
80 HG21 THR 10 HG21 THR 10 -8.014 -2.422 4.761
81 HG22 THR 10 HG22 THR 10 -6.573 -1.482 4.370
82 HG23 THR 10 HG23 THR 10 -6.486 -3.241 4.435
83 H THR 11 HN THR 11 -10.220 -2.951 2.280
84 HA THR 11 HA THR 11 -11.716 -1.658 4.453
85 HB THR 11 HB THR 11 -13.394 -3.032 2.485
86 HG1 THR 11 HG1 THR 11 -11.503 -1.552 1.494
87 HG21 THR 11 HG21 THR 11 -13.367 -0.268 3.683
88 HG22 THR 11 HG22 THR 11 -14.248 -1.680 4.293
89 HG23 THR 11 HG23 THR 11 -14.689 -0.967 2.749
90 H SER 12 HN SER 12 -13.150 -3.296 5.503
91 HA SER 12 HA SER 12 -11.670 -5.608 6.080
92 HB2 SER 12 HB2 SER 12 -13.145 -4.427 7.696
93 HB3 SER 12 HB1 SER 12 -14.549 -4.991 6.796
94 HG SER 12 HG SER 12 -12.847 -6.999 7.447
95 H TRP 13 HN TRP 13 -13.911 -5.011 3.594
96 HA TRP 13 HA TRP 13 -14.479 -7.844 3.254
97 HB2 TRP 13 HB2 TRP 13 -16.058 -6.993 1.425
98 HB3 TRP 13 HB1 TRP 13 -16.477 -6.641 3.097
99 HD1 TRP 13 HD1 TRP 13 -16.785 -4.175 3.753
100 HE1 TRP 13 HE1 TRP 13 -16.607 -1.945 2.566
101 HE3 TRP 13 HE3 TRP 13 -14.619 -5.792 -0.596
102 HZ2 TRP 13 HZ2 TRP 13 -15.663 -0.963 0.036
103 HZ3 TRP 13 HZ3 TRP 13 -14.113 -4.137 -2.344
104 HH2 TRP 13 HH2 TRP 13 -14.627 -1.775 -2.031
105 H CYS 14 HN CYS 14 -11.989 -6.018 2.411
106 HA CYS 14 HA CYS 14 -11.879 -6.656 -0.399
107 HB2 CYS 14 HB2 CYS 14 -9.812 -5.468 1.452
108 HB3 CYS 14 HB1 CYS 14 -9.581 -5.684 -0.276
109 HG CYS 14 HG CYS 14 -12.180 -4.086 -0.458
110 H GLY 15 HN GLY 15 -11.501 -8.651 -1.020
111 HA2 GLY 15 HA2 GLY 15 -10.290 -10.636 0.585
112 HA3 GLY 15 HA1 GLY 15 -10.635 -10.775 -1.133
113 H TYR 16 HN TYR 16 -9.034 -8.355 -1.716
114 HA TYR 16 HA TYR 16 -6.532 -9.687 -1.914
115 HB2 TYR 16 HB2 TYR 16 -7.551 -7.089 -2.929
116 HB3 TYR 16 HB1 TYR 16 -5.810 -7.400 -2.977
117 HD1 TYR 16 HD2 TYR 16 -5.354 -9.904 -3.873
118 HD2 TYR 16 HD1 TYR 16 -8.665 -7.480 -4.925
119 HE1 TYR 16 HE2 TYR 16 -5.635 -11.221 -5.919
120 HE2 TYR 16 HE1 TYR 16 -8.974 -8.798 -6.989
121 HH TYR 16 HH TYR 16 -7.423 -11.775 -7.444
122 H CYS 17 HN CYS 17 -7.843 -7.957 0.558
123 HA CYS 17 HA CYS 17 -5.646 -6.399 1.421
124 HB2 CYS 17 HB2 CYS 17 -7.893 -6.008 2.274
125 HB3 CYS 17 HB1 CYS 17 -7.924 -7.604 3.004
126 HG CYS 17 HG CYS 17 -7.441 -6.468 5.232
127 H LEU 18 HN LEU 18 -6.848 -9.485 2.693
128 HA LEU 18 HA LEU 18 -4.515 -9.938 4.227
129 HB2 LEU 18 HB2 LEU 18 -5.508 -12.263 4.506
130 HB3 LEU 18 HB1 LEU 18 -6.403 -10.909 5.141
131 HG LEU 18 HG LEU 18 -7.869 -11.006 3.084
132 HD11 LEU 18 HD11 LEU 18 -6.491 -13.631 2.604
133 HD12 LEU 18 HD12 LEU 18 -6.432 -12.183 1.591
134 HD13 LEU 18 HD13 LEU 18 -7.954 -13.051 1.794
135 HD21 LEU 18 HD21 LEU 18 -8.613 -11.897 5.194
136 HD22 LEU 18 HD22 LEU 18 -7.827 -13.442 4.851
137 HD23 LEU 18 HD23 LEU 18 -9.188 -12.901 3.864
138 H ARG 19 HN ARG 19 -5.288 -10.536 1.050
139 HA ARG 19 HA ARG 19 -3.514 -12.612 0.337
140 HB2 ARG 19 HB2 ARG 19 -5.370 -11.814 -1.057
141 HB3 ARG 19 HB1 ARG 19 -4.597 -10.249 -1.191
142 HG2 ARG 19 HG2 ARG 19 -4.274 -11.433 -3.233
143 HG3 ARG 19 HG1 ARG 19 -2.725 -11.346 -2.400
144 HD2 ARG 19 HD2 ARG 19 -2.952 -13.604 -1.655
145 HD3 ARG 19 HD1 ARG 19 -4.590 -13.700 -2.311
146 HE ARG 19 HE ARG 19 -2.220 -13.265 -3.997
147 HH11 ARG 19 HH11 ARG 19 -5.193 -15.102 -3.309
148 HH12 ARG 19 HH12 ARG 19 -5.201 -15.842 -4.847
149 HH21 ARG 19 HH21 ARG 19 -2.322 -14.277 -6.088
150 HH22 ARG 19 HH22 ARG 19 -3.595 -15.334 -6.443
151 H LEU 20 HN LEU 20 -3.296 -9.101 0.485
152 HA LEU 20 HA LEU 20 -0.633 -9.083 -0.539
153 HB2 LEU 20 HB2 LEU 20 -2.275 -7.438 -1.233
154 HB3 LEU 20 HB1 LEU 20 -2.451 -6.905 0.410
155 HG LEU 20 HG LEU 20 -0.233 -6.045 0.444
156 HD11 LEU 20 HD11 LEU 20 0.948 -7.514 -1.086
157 HD12 LEU 20 HD12 LEU 20 1.092 -5.859 -1.665
158 HD13 LEU 20 HD13 LEU 20 -0.050 -6.958 -2.431
159 HD21 LEU 20 HD21 LEU 20 -1.848 -5.101 -1.906
160 HD22 LEU 20 HD22 LEU 20 -0.528 -4.204 -1.154
161 HD23 LEU 20 HD23 LEU 20 -1.987 -4.562 -0.228
162 H LYS 21 HN LYS 21 -2.204 -8.691 2.572
163 HA LYS 21 HA LYS 21 -0.231 -7.453 4.095
164 HB2 LYS 21 HB2 LYS 21 -2.081 -9.673 4.971
165 HB3 LYS 21 HB1 LYS 21 -1.145 -8.671 6.059
166 HG2 LYS 21 HG2 LYS 21 -3.294 -7.714 4.200
167 HG3 LYS 21 HG1 LYS 21 -3.480 -7.975 5.938
168 HD2 LYS 21 HD2 LYS 21 -1.638 -6.272 6.260
169 HD3 LYS 21 HD1 LYS 21 -1.759 -5.937 4.534
170 HE2 LYS 21 HE2 LYS 21 -3.066 -4.325 5.821
171 HE3 LYS 21 HE1 LYS 21 -4.105 -5.316 4.802
172 HZ1 LYS 21 HZ1 LYS 21 -4.794 -6.590 6.732
173 HZ2 LYS 21 HZ2 LYS 21 -4.904 -4.946 7.146
174 HZ3 LYS 21 HZ3 LYS 21 -3.624 -5.843 7.677
175 H THR 22 HN THR 22 -0.584 -10.899 3.447
176 HA THR 22 HA THR 22 1.547 -11.754 5.040
177 HB THR 22 HB THR 22 1.334 -13.823 3.491
178 HG1 THR 22 HG1 THR 22 -1.184 -12.874 2.792
179 HG21 THR 22 HG21 THR 22 -0.757 -14.491 4.606
180 HG22 THR 22 HG22 THR 22 -1.050 -12.811 5.056
181 HG23 THR 22 HG23 THR 22 0.331 -13.680 5.731
182 H ALA 23 HN ALA 23 1.333 -10.817 1.673
183 HA ALA 23 HA ALA 23 3.868 -11.717 0.846
184 HB1 ALA 23 HB1 ALA 23 2.070 -11.173 -0.731
185 HB2 ALA 23 HB2 ALA 23 3.547 -10.279 -1.104
186 HB3 ALA 23 HB3 ALA 23 2.203 -9.472 -0.292
187 H LEU 24 HN LEU 24 2.776 -8.661 2.217
188 HA LEU 24 HA LEU 24 5.276 -7.324 1.836
189 HB2 LEU 24 HB2 LEU 24 3.052 -6.702 3.762
190 HB3 LEU 24 HB1 LEU 24 4.408 -5.651 3.447
191 HG LEU 24 HG LEU 24 2.223 -6.388 1.501
192 HD11 LEU 24 HD11 LEU 24 1.668 -3.928 1.748
193 HD12 LEU 24 HD12 LEU 24 2.889 -3.855 3.003
194 HD13 LEU 24 HD13 LEU 24 1.466 -4.852 3.241
195 HD21 LEU 24 HD21 LEU 24 3.204 -4.544 0.119
196 HD22 LEU 24 HD22 LEU 24 4.170 -5.986 0.170
197 HD23 LEU 24 HD23 LEU 24 4.622 -4.581 1.157
198 H THR 25 HN THR 25 3.827 -8.901 4.665
199 HA THR 25 HA THR 25 5.942 -8.369 6.395
200 HB THR 25 HB THR 25 4.049 -10.738 6.423
201 HG1 THR 25 HG1 THR 25 3.757 -8.230 7.747
202 HG21 THR 25 HG21 THR 25 4.404 -10.688 8.862
203 HG22 THR 25 HG22 THR 25 5.539 -9.351 8.673
204 HG23 THR 25 HG23 THR 25 5.933 -10.939 8.019
205 H ALA 26 HN ALA 26 5.449 -10.999 4.076
206 HA ALA 26 HA ALA 26 7.714 -12.530 4.894
207 HB1 ALA 26 HB1 ALA 26 7.333 -13.830 2.867
208 HB2 ALA 26 HB2 ALA 26 6.224 -12.595 2.270
209 HB3 ALA 26 HB3 ALA 26 5.808 -13.530 3.705
210 H ASN 27 HN ASN 27 7.495 -9.629 3.225
211 HA ASN 27 HA ASN 27 10.154 -10.043 2.064
212 HB2 ASN 27 HB2 ASN 27 7.851 -8.399 1.063
213 HB3 ASN 27 HB1 ASN 27 9.502 -8.006 0.596
214 HD21 ASN 27 HD21 ASN 27 6.929 -10.337 0.330
215 HD22 ASN 27 HD22 ASN 27 7.645 -11.251 -0.953
216 H ARG 28 HN ARG 28 9.199 -9.161 4.748
217 HA ARG 28 HA ARG 28 9.680 -7.741 6.427
218 HB2 ARG 28 HB2 ARG 28 11.969 -7.016 6.715
219 HB3 ARG 28 HB1 ARG 28 12.022 -8.563 5.893
220 HG2 ARG 28 HG2 ARG 28 12.469 -7.490 3.813
221 HG3 ARG 28 HG1 ARG 28 12.220 -5.912 4.557
222 HD2 ARG 28 HD2 ARG 28 14.188 -6.353 6.019
223 HD3 ARG 28 HD1 ARG 28 14.468 -7.855 5.137
224 HE ARG 28 HE ARG 28 14.382 -5.977 3.185
225 HH11 ARG 28 HH11 ARG 28 16.337 -6.371 6.094
226 HH12 ARG 28 HH12 ARG 28 17.655 -5.452 5.550
227 HH21 ARG 28 HH21 ARG 28 16.282 -4.671 2.372
228 HH22 ARG 28 HH22 ARG 28 17.601 -4.489 3.388
229 H ILE 29 HN ILE 29 8.043 -6.610 4.462
230 HA ILE 29 HA ILE 29 8.947 -3.869 4.153
231 HB ILE 29 HB ILE 29 6.396 -5.193 3.198
232 HG12 ILE 29 HG12 ILE 29 8.908 -4.486 1.664
233 HG13 ILE 29 HG11 ILE 29 8.505 -6.104 2.216
234 HG21 ILE 29 HG21 ILE 29 6.176 -2.764 3.475
235 HG22 ILE 29 HG22 ILE 29 6.168 -3.190 1.758
236 HG23 ILE 29 HG23 ILE 29 7.623 -2.522 2.508
237 HD11 ILE 29 HD11 ILE 29 6.492 -6.028 0.798
238 HD12 ILE 29 HD12 ILE 29 7.997 -5.879 -0.093
239 HD13 ILE 29 HD13 ILE 29 7.005 -4.445 0.203
240 H ALA 30 HN ALA 30 8.313 -2.260 5.344
241 HA ALA 30 HA ALA 30 6.456 -2.640 7.551
242 HB1 ALA 30 HB1 ALA 30 8.187 -0.359 6.673
243 HB2 ALA 30 HB2 ALA 30 8.558 -1.519 7.958
244 HB3 ALA 30 HB3 ALA 30 7.217 -0.371 8.146
245 H TYR 31 HN TYR 31 4.504 -1.455 7.712
246 HA TYR 31 HA TYR 31 3.786 0.444 5.696
247 HB2 TYR 31 HB2 TYR 31 1.816 -0.812 4.860
248 HB3 TYR 31 HB1 TYR 31 3.326 -1.617 4.450
249 HD1 TYR 31 HD2 TYR 31 0.275 -1.794 6.495
250 HD2 TYR 31 HD1 TYR 31 3.903 -3.751 5.450
251 HE1 TYR 31 HE2 TYR 31 -0.553 -3.855 7.540
252 HE2 TYR 31 HE1 TYR 31 3.090 -5.821 6.502
253 HH TYR 31 HH TYR 31 -0.180 -6.116 7.683
254 H ASP 32 HN ASP 32 1.548 1.221 6.052
255 HA ASP 32 HA ASP 32 0.563 0.784 8.782
256 HB2 ASP 32 HB2 ASP 32 1.778 3.003 8.525
257 HB3 ASP 32 HB1 ASP 32 0.590 3.431 7.304
258 H GLU 33 HN GLU 33 -1.747 0.742 8.855
259 HA GLU 33 HA GLU 33 -3.074 0.922 6.225
260 HB2 GLU 33 HB2 GLU 33 -4.360 -1.081 6.743
261 HB3 GLU 33 HB1 GLU 33 -2.642 -1.442 6.769
262 HG2 GLU 33 HG2 GLU 33 -2.694 -1.332 9.219
263 HG3 GLU 33 HG1 GLU 33 -4.423 -1.008 9.142
264 H VAL 34 HN VAL 34 -5.092 1.773 6.213
265 HA VAL 34 HA VAL 34 -6.439 2.280 8.724
266 HB VAL 34 HB VAL 34 -5.159 4.372 8.142
267 HG11 VAL 34 HG11 VAL 34 -5.785 5.771 6.285
268 HG12 VAL 34 HG12 VAL 34 -6.900 4.545 5.727
269 HG13 VAL 34 HG13 VAL 34 -5.144 4.217 5.734
270 HG21 VAL 34 HG21 VAL 34 -7.020 5.976 8.262
271 HG22 VAL 34 HG22 VAL 34 -7.148 4.662 9.437
272 HG23 VAL 34 HG23 VAL 34 -8.141 4.649 7.972
273 H ASP 35 HN ASP 35 -8.763 2.257 8.428
274 HA ASP 35 HA ASP 35 -9.376 0.741 6.008
275 HB2 ASP 35 HB2 ASP 35 -10.032 -0.190 8.169
276 HB3 ASP 35 HB1 ASP 35 -10.978 1.249 8.517
277 H ILE 36 HN ILE 36 -10.817 1.343 4.521
278 HA ILE 36 HA ILE 36 -11.317 4.173 4.380
279 HB ILE 36 HB ILE 36 -11.901 3.854 2.051
280 HG12 ILE 36 HG12 ILE 36 -11.353 0.920 2.578
281 HG13 ILE 36 HG11 ILE 36 -12.939 1.610 2.257
282 HG21 ILE 36 HG21 ILE 36 -9.601 4.215 2.680
283 HG22 ILE 36 HG22 ILE 36 -9.660 3.058 1.342
284 HG23 ILE 36 HG23 ILE 36 -9.383 2.492 2.983
285 HD11 ILE 36 HD11 ILE 36 -10.603 1.494 0.367
286 HD12 ILE 36 HD12 ILE 36 -12.148 2.277 0.019
287 HD13 ILE 36 HD13 ILE 36 -12.079 0.533 0.288
288 H GLU 37 HN GLU 37 -13.219 1.656 5.512
289 HA GLU 37 HA GLU 37 -15.610 2.341 4.121
290 HB2 GLU 37 HB2 GLU 37 -15.063 0.117 5.239
291 HB3 GLU 37 HB1 GLU 37 -15.455 0.897 6.761
292 HG2 GLU 37 HG2 GLU 37 -17.356 -0.347 5.986
293 HG3 GLU 37 HG1 GLU 37 -17.706 1.379 5.883
294 H HIS 38 HN HIS 38 -14.246 3.156 7.213
295 HA HIS 38 HA HIS 38 -16.479 4.952 7.702
296 HB2 HIS 38 HB2 HIS 38 -15.578 5.294 9.967
297 HB3 HIS 38 HB1 HIS 38 -15.780 3.587 9.610
298 HD1 HIS 38 HD1 HIS 38 -13.477 5.784 11.170
299 HD2 HIS 38 HD2 HIS 38 -13.122 2.468 8.704
300 HE1 HIS 38 HE1 HIS 38 -11.141 4.932 11.481
301 H ASN 39 HN ASN 39 -13.106 5.149 6.777
302 HA ASN 39 HA ASN 39 -13.138 8.047 7.109
303 HB2 ASN 39 HB2 ASN 39 -10.966 6.288 5.939
304 HB3 ASN 39 HB1 ASN 39 -10.843 8.026 6.105
305 HD21 ASN 39 HD21 ASN 39 -10.441 5.023 7.546
306 HD22 ASN 39 HD22 ASN 39 -9.948 5.587 9.087
307 H ARG 40 HN ARG 40 -14.429 8.975 5.700
308 HA ARG 40 HA ARG 40 -14.775 7.867 3.115
309 HB2 ARG 40 HB2 ARG 40 -16.643 8.989 4.183
310 HB3 ARG 40 HB1 ARG 40 -15.754 10.511 4.158
311 HG2 ARG 40 HG2 ARG 40 -15.758 10.569 1.781
312 HG3 ARG 40 HG1 ARG 40 -16.450 8.955 1.695
313 HD2 ARG 40 HD2 ARG 40 -18.484 9.780 2.740
314 HD3 ARG 40 HD1 ARG 40 -17.775 11.397 2.830
315 HE ARG 40 HE ARG 40 -17.884 11.596 0.549
316 HH11 ARG 40 HH11 ARG 40 -19.220 8.488 1.626
317 HH12 ARG 40 HH12 ARG 40 -20.051 8.168 0.182
318 HH21 ARG 40 HH21 ARG 40 -18.998 11.119 -1.496
319 HH22 ARG 40 HH22 ARG 40 -19.880 9.672 -1.650
320 H ALA 41 HN ALA 41 -12.831 10.528 4.334
321 HA ALA 41 HA ALA 41 -12.225 11.612 1.790
322 HB1 ALA 41 HB1 ALA 41 -10.341 12.714 2.863
323 HB2 ALA 41 HB2 ALA 41 -10.497 11.671 4.271
324 HB3 ALA 41 HB3 ALA 41 -11.769 12.841 3.894
325 H ALA 42 HN ALA 42 -10.947 9.000 3.657
326 HA ALA 42 HA ALA 42 -8.739 8.506 1.921
327 HB1 ALA 42 HB1 ALA 42 -8.719 7.739 4.280
328 HB2 ALA 42 HB2 ALA 42 -8.421 6.463 3.109
329 HB3 ALA 42 HB3 ALA 42 -10.002 6.582 3.898
330 H ALA 43 HN ALA 43 -11.988 7.156 2.319
331 HA ALA 43 HA ALA 43 -11.874 5.170 0.340
332 HB1 ALA 43 HB1 ALA 43 -14.291 5.183 0.396
333 HB2 ALA 43 HB2 ALA 43 -14.284 6.752 1.201
334 HB3 ALA 43 HB3 ALA 43 -13.652 5.335 2.033
335 H GLU 44 HN GLU 44 -12.875 8.532 0.128
336 HA GLU 44 HA GLU 44 -13.670 8.596 -2.556
337 HB2 GLU 44 HB2 GLU 44 -14.013 10.379 -0.829
338 HB3 GLU 44 HB1 GLU 44 -12.312 10.779 -0.963
339 HG2 GLU 44 HG2 GLU 44 -13.618 12.344 -2.226
340 HG3 GLU 44 HG1 GLU 44 -12.660 11.353 -3.327
341 H PHE 45 HN PHE 45 -10.582 9.195 -0.991
342 HA PHE 45 HA PHE 45 -9.043 9.865 -3.211
343 HB2 PHE 45 HB2 PHE 45 -8.303 10.281 -0.913
344 HB3 PHE 45 HB1 PHE 45 -8.254 8.555 -0.605
345 HD1 PHE 45 HD1 PHE 45 -6.729 11.208 -2.686
346 HD2 PHE 45 HD2 PHE 45 -6.325 7.318 -0.992
347 HE1 PHE 45 HE1 PHE 45 -4.386 11.138 -3.417
348 HE2 PHE 45 HE2 PHE 45 -3.981 7.249 -1.729
349 HZ PHE 45 HZ PHE 45 -3.011 9.159 -2.941
350 H VAL 46 HN VAL 46 -9.220 6.730 -1.524
351 HA VAL 46 HA VAL 46 -7.672 5.354 -3.439
352 HB VAL 46 HB VAL 46 -7.841 4.431 -1.190
353 HG11 VAL 46 HG11 VAL 46 -9.991 5.079 -0.554
354 HG12 VAL 46 HG12 VAL 46 -9.870 3.290 -0.524
355 HG13 VAL 46 HG13 VAL 46 -10.708 4.099 -1.854
356 HG21 VAL 46 HG21 VAL 46 -9.285 2.548 -2.976
357 HG22 VAL 46 HG22 VAL 46 -8.195 2.152 -1.629
358 HG23 VAL 46 HG23 VAL 46 -7.572 2.910 -3.113
359 H GLY 47 HN GLY 47 -11.140 5.883 -3.245
360 HA2 GLY 47 HA2 GLY 47 -11.901 4.050 -5.236
361 HA3 GLY 47 HA1 GLY 47 -12.790 5.491 -4.753
362 H SER 48 HN SER 48 -10.780 7.365 -5.393
363 HA SER 48 HA SER 48 -11.354 7.741 -8.142
364 HB2 SER 48 HB2 SER 48 -9.409 9.230 -6.363
365 HB3 SER 48 HB1 SER 48 -10.025 9.787 -7.921
366 HG SER 48 HG SER 48 -11.497 9.334 -5.530
367 H VAL 49 HN VAL 49 -8.560 6.543 -6.385
368 HA VAL 49 HA VAL 49 -6.991 6.453 -8.853
369 HB VAL 49 HB VAL 49 -5.064 5.845 -7.424
370 HG11 VAL 49 HG11 VAL 49 -6.593 8.234 -6.458
371 HG12 VAL 49 HG12 VAL 49 -5.505 8.189 -7.856
372 HG13 VAL 49 HG13 VAL 49 -4.867 7.966 -6.219
373 HG21 VAL 49 HG21 VAL 49 -6.312 4.652 -5.675
374 HG22 VAL 49 HG22 VAL 49 -6.980 6.194 -5.134
375 HG23 VAL 49 HG23 VAL 49 -5.247 5.891 -5.000
376 H ASN 50 HN ASN 50 -9.219 4.588 -7.666
377 HA ASN 50 HA ASN 50 -7.850 2.052 -7.704
378 HB2 ASN 50 HB2 ASN 50 -10.310 2.991 -6.642
379 HB3 ASN 50 HB1 ASN 50 -10.712 1.746 -7.816
380 HD21 ASN 50 HD21 ASN 50 -7.861 1.947 -5.761
381 HD22 ASN 50 HD22 ASN 50 -8.221 0.495 -4.900
382 H GLY 51 HN GLY 51 -9.524 0.346 -9.006
383 HA2 GLY 51 HA2 GLY 51 -9.350 1.189 -11.779
384 HA3 GLY 51 HA1 GLY 51 -9.661 -0.446 -11.192
385 H GLY 52 HN GLY 52 -11.061 2.728 -11.600
386 HA2 GLY 52 HA2 GLY 52 -13.228 3.173 -12.400
387 HA3 GLY 52 HA1 GLY 52 -13.662 1.504 -12.064
388 H ASN 53 HN ASN 53 -13.428 0.996 -9.607
389 HA ASN 53 HA ASN 53 -14.348 3.207 -7.966
390 HB2 ASN 53 HB2 ASN 53 -16.296 2.031 -7.125
391 HB3 ASN 53 HB1 ASN 53 -16.449 2.200 -8.871
392 HD21 ASN 53 HD21 ASN 53 -16.309 0.323 -10.152
393 HD22 ASN 53 HD22 ASN 53 -16.450 -1.253 -9.478
394 H ARG 54 HN ARG 54 -14.457 2.589 -5.755
395 HA ARG 54 HA ARG 54 -12.237 1.350 -4.681
396 HB2 ARG 54 HB2 ARG 54 -13.688 1.261 -2.563
397 HB3 ARG 54 HB1 ARG 54 -13.398 2.836 -3.297
398 HG2 ARG 54 HG2 ARG 54 -15.605 2.771 -4.357
399 HG3 ARG 54 HG1 ARG 54 -15.863 1.161 -3.718
400 HD2 ARG 54 HD2 ARG 54 -15.303 3.464 -1.916
401 HD3 ARG 54 HD1 ARG 54 -16.924 3.147 -2.542
402 HE ARG 54 HE ARG 54 -16.196 0.773 -1.571
403 HH11 ARG 54 HH11 ARG 54 -16.089 3.996 -0.120
404 HH12 ARG 54 HH12 ARG 54 -16.577 3.494 1.431
405 HH21 ARG 54 HH21 ARG 54 -16.931 0.060 0.551
406 HH22 ARG 54 HH22 ARG 54 -17.064 1.170 1.826
407 H THR 55 HN THR 55 -11.776 -0.686 -5.306
408 HA THR 55 HA THR 55 -13.460 -2.761 -4.164
409 HB THR 55 HB THR 55 -14.227 -2.549 -6.496
410 HG1 THR 55 HG1 THR 55 -12.877 -4.884 -5.688
411 HG21 THR 55 HG21 THR 55 -12.162 -1.754 -7.543
412 HG22 THR 55 HG22 THR 55 -12.748 -3.202 -8.364
413 HG23 THR 55 HG23 THR 55 -11.391 -3.310 -7.244
414 H VAL 56 HN VAL 56 -10.330 -1.561 -4.924
415 HA VAL 56 HA VAL 56 -9.178 -3.984 -3.806
416 HB VAL 56 HB VAL 56 -7.181 -3.660 -5.354
417 HG11 VAL 56 HG11 VAL 56 -8.707 -5.534 -5.614
418 HG12 VAL 56 HG12 VAL 56 -8.197 -4.941 -7.197
419 HG13 VAL 56 HG13 VAL 56 -9.798 -4.540 -6.575
420 HG21 VAL 56 HG21 VAL 56 -9.201 -2.109 -6.945
421 HG22 VAL 56 HG22 VAL 56 -7.601 -2.615 -7.502
422 HG23 VAL 56 HG23 VAL 56 -7.749 -1.452 -6.182
423 HA PRO 57 HA PRO 57 -7.006 -1.288 -1.148
424 HB2 PRO 57 HB2 PRO 57 -4.713 -2.735 -0.731
425 HB3 PRO 57 HB1 PRO 57 -6.256 -3.102 0.048
426 HG2 PRO 57 HG2 PRO 57 -4.989 -4.371 -2.333
427 HG3 PRO 57 HG1 PRO 57 -5.889 -5.127 -1.004
428 HD2 PRO 57 HD2 PRO 57 -6.973 -4.633 -3.442
429 HD3 PRO 57 HD1 PRO 57 -7.939 -4.620 -1.943
430 H THR 58 HN THR 58 -5.713 0.377 -1.373
431 HA THR 58 HA THR 58 -3.821 0.373 -3.610
432 HB THR 58 HB THR 58 -5.422 2.729 -2.587
433 HG1 THR 58 HG1 THR 58 -6.264 0.694 -3.838
434 HG21 THR 58 HG21 THR 58 -4.769 3.800 -4.643
435 HG22 THR 58 HG22 THR 58 -3.934 2.363 -5.194
436 HG23 THR 58 HG23 THR 58 -3.299 3.286 -3.804
437 H VAL 59 HN VAL 59 -1.813 1.179 -3.083
438 HA VAL 59 HA VAL 59 -1.430 1.881 -0.276
439 HB VAL 59 HB VAL 59 1.002 1.410 -0.700
440 HG11 VAL 59 HG11 VAL 59 0.737 -1.052 -0.819
441 HG12 VAL 59 HG12 VAL 59 -0.984 -0.804 -1.185
442 HG13 VAL 59 HG13 VAL 59 -0.301 -0.260 0.355
443 HG21 VAL 59 HG21 VAL 59 1.003 1.720 -3.101
444 HG22 VAL 59 HG22 VAL 59 -0.039 0.294 -3.274
445 HG23 VAL 59 HG23 VAL 59 1.614 0.114 -2.668
446 H LYS 60 HN LYS 60 -0.858 3.832 0.273
447 HA LYS 60 HA LYS 60 0.026 5.671 -1.849
448 HB2 LYS 60 HB2 LYS 60 -2.067 6.266 -0.573
449 HB3 LYS 60 HB1 LYS 60 -1.073 6.378 0.869
450 HG2 LYS 60 HG2 LYS 60 0.270 8.149 -0.207
451 HG3 LYS 60 HG1 LYS 60 -0.783 8.074 -1.614
452 HD2 LYS 60 HD2 LYS 60 -1.525 9.903 -0.300
453 HD3 LYS 60 HD1 LYS 60 -2.700 8.611 -0.066
454 HE2 LYS 60 HE2 LYS 60 -1.538 7.998 2.039
455 HE3 LYS 60 HE1 LYS 60 -0.465 9.379 1.792
456 HZ1 LYS 60 HZ1 LYS 60 -2.430 10.829 1.906
457 HZ2 LYS 60 HZ2 LYS 60 -2.276 9.898 3.322
458 HZ3 LYS 60 HZ3 LYS 60 -3.406 9.484 2.176
459 H PHE 61 HN PHE 61 2.116 5.972 -1.799
460 HA PHE 61 HA PHE 61 3.622 5.190 0.506
461 HB2 PHE 61 HB2 PHE 61 4.385 6.155 -2.211
462 HB3 PHE 61 HB1 PHE 61 5.572 5.931 -0.933
463 HD1 PHE 61 HD1 PHE 61 3.000 4.187 -2.932
464 HD2 PHE 61 HD2 PHE 61 6.406 3.826 -0.418
465 HE1 PHE 61 HE1 PHE 61 3.161 1.823 -3.484
466 HE2 PHE 61 HE2 PHE 61 6.571 1.458 -0.972
467 HZ PHE 61 HZ PHE 61 4.974 0.449 -2.494
468 H ALA 62 HN ALA 62 5.376 6.523 1.307
469 HA ALA 62 HA ALA 62 4.507 8.994 2.292
470 HB1 ALA 62 HB1 ALA 62 7.272 7.814 2.198
471 HB2 ALA 62 HB2 ALA 62 6.083 7.586 3.485
472 HB3 ALA 62 HB3 ALA 62 6.779 9.181 3.186
473 H ASP 63 HN ASP 63 5.884 8.205 -0.705
474 HA ASP 63 HA ASP 63 6.893 10.893 -1.162
475 HB2 ASP 63 HB2 ASP 63 7.615 10.143 -3.332
476 HB3 ASP 63 HB1 ASP 63 8.090 8.924 -2.159
477 H GLY 64 HN GLY 64 3.977 9.310 -1.248
478 HA2 GLY 64 HA2 GLY 64 1.986 10.517 -1.532
479 HA3 GLY 64 HA1 GLY 64 2.788 11.532 -2.722
480 H SER 65 HN SER 65 3.889 8.929 -3.983
481 HA SER 65 HA SER 65 1.741 8.738 -5.822
482 HB2 SER 65 HB2 SER 65 4.080 8.647 -6.574
483 HB3 SER 65 HB1 SER 65 4.318 7.149 -5.686
484 HG SER 65 HG SER 65 2.631 7.635 -7.886
485 H THR 66 HN THR 66 0.453 7.032 -6.342
486 HA THR 66 HA THR 66 -0.009 5.058 -4.248
487 HB THR 66 HB THR 66 -2.305 5.168 -5.604
488 HG1 THR 66 HG1 THR 66 -1.867 7.889 -5.615
489 HG21 THR 66 HG21 THR 66 -1.454 7.135 -3.476
490 HG22 THR 66 HG22 THR 66 -2.086 5.500 -3.210
491 HG23 THR 66 HG23 THR 66 -3.122 6.746 -3.902
492 H LEU 67 HN LEU 67 -0.284 2.939 -4.871
493 HA LEU 67 HA LEU 67 -0.257 2.341 -7.759
494 HB2 LEU 67 HB2 LEU 67 0.936 0.466 -5.684
495 HB3 LEU 67 HB1 LEU 67 0.964 0.321 -7.404
496 HG LEU 67 HG LEU 67 2.541 2.337 -5.815
497 HD11 LEU 67 HD11 LEU 67 3.368 -0.140 -7.312
498 HD12 LEU 67 HD12 LEU 67 3.315 -0.000 -5.570
499 HD13 LEU 67 HD13 LEU 67 4.462 0.972 -6.504
500 HD21 LEU 67 HD21 LEU 67 2.549 1.704 -8.764
501 HD22 LEU 67 HD22 LEU 67 3.642 2.817 -7.941
502 HD23 LEU 67 HD23 LEU 67 1.917 3.178 -8.029
503 H THR 68 HN THR 68 -2.011 1.236 -8.367
504 HA THR 68 HA THR 68 -4.017 0.316 -6.607
505 HB THR 68 HB THR 68 -3.544 -0.663 -9.439
506 HG1 THR 68 HG1 THR 68 -5.079 1.520 -9.486
507 HG21 THR 68 HG21 THR 68 -6.044 0.055 -7.890
508 HG22 THR 68 HG22 THR 68 -5.454 -1.580 -8.177
509 HG23 THR 68 HG23 THR 68 -6.003 -0.590 -9.533
510 H ASN 69 HN ASN 69 -4.311 -1.813 -5.779
511 HA ASN 69 HA ASN 69 -2.698 -3.227 -4.564
512 HB2 ASN 69 HB2 ASN 69 -3.726 -5.416 -4.939
513 HB3 ASN 69 HB1 ASN 69 -4.910 -4.147 -4.775
514 HD21 ASN 69 HD21 ASN 69 -5.164 -6.817 -5.953
515 HD22 ASN 69 HD22 ASN 69 -5.669 -6.577 -7.590
516 HA PRO 70 HA PRO 70 0.727 -4.264 -7.269
517 HB2 PRO 70 HB2 PRO 70 2.589 -3.235 -5.732
518 HB3 PRO 70 HB1 PRO 70 1.512 -2.166 -6.640
519 HG2 PRO 70 HG2 PRO 70 1.487 -2.872 -3.745
520 HG3 PRO 70 HG1 PRO 70 1.128 -1.322 -4.521
521 HD2 PRO 70 HD2 PRO 70 -0.722 -3.223 -3.641
522 HD3 PRO 70 HD1 PRO 70 -1.056 -1.861 -4.732
523 H SER 71 HN SER 71 2.603 -5.527 -6.897
524 HA SER 71 HA SER 71 2.215 -7.468 -4.770
525 HB2 SER 71 HB2 SER 71 2.646 -8.231 -7.126
526 HB3 SER 71 HB1 SER 71 4.228 -7.456 -7.039
527 HG SER 71 HG SER 71 4.465 -9.598 -6.543
528 H ALA 72 HN ALA 72 4.415 -8.193 -3.768
529 HA ALA 72 HA ALA 72 5.350 -5.972 -2.272
530 HB1 ALA 72 HB1 ALA 72 6.412 -8.802 -2.364
531 HB2 ALA 72 HB2 ALA 72 5.203 -8.140 -1.240
532 HB3 ALA 72 HB3 ALA 72 6.861 -7.571 -1.185
533 H ASP 73 HN ASP 73 6.633 -7.722 -4.963
534 HA ASP 73 HA ASP 73 9.205 -6.711 -5.233
535 HB2 ASP 73 HB2 ASP 73 8.479 -8.382 -6.752
536 HB3 ASP 73 HB1 ASP 73 7.111 -7.414 -7.279
537 H GLU 74 HN GLU 74 6.195 -5.333 -6.365
538 HA GLU 74 HA GLU 74 7.276 -3.075 -7.690
539 HB2 GLU 74 HB2 GLU 74 4.509 -3.565 -6.630
540 HB3 GLU 74 HB1 GLU 74 4.955 -2.312 -7.781
541 HG2 GLU 74 HG2 GLU 74 5.618 -4.010 -9.373
542 HG3 GLU 74 HG1 GLU 74 5.198 -5.273 -8.215
543 H VAL 75 HN VAL 75 5.648 -3.479 -4.581
544 HA VAL 75 HA VAL 75 5.831 -0.766 -3.933
545 HB VAL 75 HB VAL 75 5.476 -1.525 -1.501
546 HG11 VAL 75 HG11 VAL 75 3.110 -2.039 -1.951
547 HG12 VAL 75 HG12 VAL 75 3.522 -2.444 -3.610
548 HG13 VAL 75 HG13 VAL 75 3.637 -0.779 -3.073
549 HG21 VAL 75 HG21 VAL 75 4.683 -3.773 -1.192
550 HG22 VAL 75 HG22 VAL 75 6.325 -3.827 -1.873
551 HG23 VAL 75 HG23 VAL 75 4.906 -4.080 -2.906
552 H LYS 76 HN LYS 76 8.094 -3.382 -3.326
553 HA LYS 76 HA LYS 76 9.785 -1.873 -1.662
554 HB2 LYS 76 HB2 LYS 76 10.302 -4.258 -3.391
555 HB3 LYS 76 HB1 LYS 76 11.599 -3.450 -2.520
556 HG2 LYS 76 HG2 LYS 76 10.383 -3.850 -0.412
557 HG3 LYS 76 HG1 LYS 76 9.151 -4.716 -1.332
558 HD2 LYS 76 HD2 LYS 76 10.814 -6.213 -0.240
559 HD3 LYS 76 HD1 LYS 76 10.740 -6.395 -1.992
560 HE2 LYS 76 HE2 LYS 76 12.750 -5.101 -2.269
561 HE3 LYS 76 HE1 LYS 76 12.780 -4.678 -0.557
562 HZ1 LYS 76 HZ1 LYS 76 14.339 -6.426 -1.190
563 HZ2 LYS 76 HZ2 LYS 76 13.043 -7.437 -1.617
564 HZ3 LYS 76 HZ3 LYS 76 13.242 -6.917 -0.018
565 H ALA 77 HN ALA 77 9.516 -2.113 -5.134
566 HA ALA 77 HA ALA 77 11.918 -0.900 -5.867
567 HB1 ALA 77 HB1 ALA 77 9.252 -0.754 -7.279
568 HB2 ALA 77 HB2 ALA 77 10.445 -2.041 -7.460
569 HB3 ALA 77 HB3 ALA 77 10.821 -0.403 -7.999
570 H LYS 78 HN LYS 78 8.869 0.502 -4.895
571 HA LYS 78 HA LYS 78 9.863 3.167 -5.307
572 HB2 LYS 78 HB2 LYS 78 7.278 2.124 -4.230
573 HB3 LYS 78 HB1 LYS 78 7.711 3.824 -4.097
574 HG2 LYS 78 HG2 LYS 78 7.945 3.966 -6.521
575 HG3 LYS 78 HG1 LYS 78 7.517 2.260 -6.659
576 HD2 LYS 78 HD2 LYS 78 5.627 3.741 -7.142
577 HD3 LYS 78 HD1 LYS 78 5.338 2.700 -5.743
578 HE2 LYS 78 HE2 LYS 78 4.531 4.993 -5.371
579 HE3 LYS 78 HE1 LYS 78 5.795 4.555 -4.231
580 HZ1 LYS 78 HZ1 LYS 78 7.360 5.792 -5.707
581 HZ2 LYS 78 HZ2 LYS 78 6.218 6.732 -4.960
582 HZ3 LYS 78 HZ3 LYS 78 6.031 6.334 -6.599
583 H LEU 79 HN LEU 79 9.010 1.162 -2.515
584 HA LEU 79 HA LEU 79 9.428 3.012 -0.496
585 HB2 LEU 79 HB2 LEU 79 8.315 0.868 -0.156
586 HB3 LEU 79 HB1 LEU 79 9.826 0.033 -0.425
587 HG LEU 79 HG LEU 79 10.749 1.043 1.618
588 HD11 LEU 79 HD11 LEU 79 9.272 2.199 3.170
589 HD12 LEU 79 HD12 LEU 79 7.990 2.193 1.951
590 HD13 LEU 79 HD13 LEU 79 9.480 3.094 1.667
591 HD21 LEU 79 HD21 LEU 79 8.121 -0.375 1.989
592 HD22 LEU 79 HD22 LEU 79 9.386 -0.221 3.208
593 HD23 LEU 79 HD23 LEU 79 9.691 -1.141 1.731
594 H VAL 80 HN VAL 80 11.757 0.881 -2.057
595 HA VAL 80 HA VAL 80 13.840 1.301 -0.245
596 HB VAL 80 HB VAL 80 13.679 -0.536 -1.967
597 HG11 VAL 80 HG11 VAL 80 14.643 -0.203 -4.176
598 HG12 VAL 80 HG12 VAL 80 14.714 1.535 -3.869
599 HG13 VAL 80 HG13 VAL 80 13.153 0.713 -3.937
600 HG21 VAL 80 HG21 VAL 80 15.669 -0.285 -0.685
601 HG22 VAL 80 HG22 VAL 80 16.268 0.968 -1.774
602 HG23 VAL 80 HG23 VAL 80 16.116 -0.693 -2.342
603 H LYS 81 HN LYS 81 12.728 3.187 -2.964
604 HA LYS 81 HA LYS 81 15.074 4.858 -3.047
605 HB2 LYS 81 HB2 LYS 81 12.390 5.220 -4.388
606 HB3 LYS 81 HB1 LYS 81 13.787 6.237 -4.661
607 HG2 LYS 81 HG2 LYS 81 14.980 4.231 -5.548
608 HG3 LYS 81 HG1 LYS 81 13.467 3.332 -5.396
609 HD2 LYS 81 HD2 LYS 81 12.363 4.996 -6.882
610 HD3 LYS 81 HD1 LYS 81 13.903 5.821 -7.047
611 HE2 LYS 81 HE2 LYS 81 13.494 4.423 -8.982
612 HE3 LYS 81 HE1 LYS 81 14.872 3.812 -8.071
613 HZ1 LYS 81 HZ1 LYS 81 13.413 2.046 -8.796
614 HZ2 LYS 81 HZ2 LYS 81 12.107 2.716 -7.977
615 HZ3 LYS 81 HZ3 LYS 81 13.426 2.120 -7.117
616 H ILE 82 HN ILE 82 11.963 4.905 -1.506
617 HA ILE 82 HA ILE 82 11.870 7.709 -0.932
618 HB ILE 82 HB ILE 82 10.509 5.482 0.592
619 HG12 ILE 82 HG12 ILE 82 9.454 7.102 -1.725
620 HG13 ILE 82 HG11 ILE 82 9.986 5.423 -1.826
621 HG21 ILE 82 HG21 ILE 82 8.905 7.197 1.231
622 HG22 ILE 82 HG22 ILE 82 9.837 8.411 0.355
623 HG23 ILE 82 HG23 ILE 82 10.533 7.618 1.774
624 HD11 ILE 82 HD11 ILE 82 8.245 4.810 -0.223
625 HD12 ILE 82 HD12 ILE 82 7.600 5.536 -1.695
626 HD13 ILE 82 HD13 ILE 82 7.693 6.486 -0.209
627 H ALA 83 HN ALA 83 12.485 4.887 1.094
628 HA ALA 83 HA ALA 83 13.350 6.525 3.282
629 HB1 ALA 83 HB1 ALA 83 13.413 3.536 2.931
630 HB2 ALA 83 HB2 ALA 83 12.130 4.467 3.703
631 HB3 ALA 83 HB3 ALA 83 13.736 4.393 4.438
632 H GLY 84 HN GLY 84 14.834 4.951 0.615
633 HA2 GLY 84 HA2 GLY 84 17.000 4.930 -0.116
634 HA3 GLY 84 HA1 GLY 84 17.352 6.134 1.120
635 H LEU 85 HN LEU 85 16.148 2.856 1.434
636 HA LEU 85 HA LEU 85 17.972 2.341 3.594
637 HB2 LEU 85 HB2 LEU 85 16.192 0.404 2.108
638 HB3 LEU 85 HB1 LEU 85 17.016 0.094 3.616
639 HG LEU 85 HG LEU 85 14.842 2.143 3.244
640 HD11 LEU 85 HD11 LEU 85 14.014 -0.120 2.938
641 HD12 LEU 85 HD12 LEU 85 13.425 0.565 4.455
642 HD13 LEU 85 HD13 LEU 85 14.743 -0.612 4.468
643 HD21 LEU 85 HD21 LEU 85 16.183 1.070 5.730
644 HD22 LEU 85 HD22 LEU 85 14.817 2.185 5.700
645 HD23 LEU 85 HD23 LEU 85 16.381 2.691 5.062
646 H GLU 86 HN GLU 86 17.564 1.094 0.299
647 HA GLU 86 HA GLU 86 20.344 0.231 0.406
648 HB2 GLU 86 HB2 GLU 86 18.046 -1.267 -0.856
649 HB3 GLU 86 HB1 GLU 86 19.741 -1.728 -0.935
650 HG2 GLU 86 HG2 GLU 86 19.739 -1.969 1.526
651 HG3 GLU 86 HG1 GLU 86 18.021 -1.609 1.528
652 H HIS 87 HN HIS 87 21.481 0.811 -1.272
653 HA HIS 87 HA HIS 87 20.074 1.910 -3.584
654 HB2 HIS 87 HB2 HIS 87 21.768 3.419 -2.498
655 HB3 HIS 87 HB1 HIS 87 23.004 2.210 -2.820
656 HD1 HIS 87 HD1 HIS 87 20.712 4.625 -4.694
657 HD2 HIS 87 HD2 HIS 87 24.096 2.289 -5.315
658 HE1 HIS 87 HE1 HIS 87 21.604 5.270 -6.949
659 H HIS 88 HN HIS 88 22.647 -0.201 -2.525
660 HA HIS 88 HA HIS 88 22.806 -1.587 -5.053
661 HB2 HIS 88 HB2 HIS 88 24.816 -1.203 -3.585
662 HB3 HIS 88 HB1 HIS 88 24.073 -2.208 -2.356
663 HD1 HIS 88 HD1 HIS 88 26.088 -2.355 -5.440
664 HD2 HIS 88 HD2 HIS 88 23.981 -5.002 -3.035
665 HE1 HIS 88 HE1 HIS 88 26.925 -4.646 -6.038
Start of MODEL 3
1 H1 MET 1 HT1 MET 1 13.654 7.939 6.888
2 H2 MET 1 HT2 MET 1 13.663 7.241 8.419
3 H3 MET 1 HT3 MET 1 14.663 8.534 8.094
4 HA MET 1 HA MET 1 12.802 9.120 9.444
5 HB2 MET 1 HB2 MET 1 12.010 11.076 8.101
6 HB3 MET 1 HB1 MET 1 13.748 10.906 8.186
7 HG2 MET 1 HG2 MET 1 13.167 11.595 5.977
8 HG3 MET 1 HG1 MET 1 13.708 9.927 5.896
9 HE1 MET 1 HE1 MET 1 12.154 11.413 3.535
10 HE2 MET 1 HE2 MET 1 11.017 10.158 3.042
11 HE3 MET 1 HE3 MET 1 12.682 9.732 3.435
12 H VAL 2 HN VAL 2 11.925 6.786 7.239
13 HA VAL 2 HA VAL 2 9.170 7.683 7.146
14 HB VAL 2 HB VAL 2 8.662 5.704 5.738
15 HG11 VAL 2 HG11 VAL 2 9.842 6.430 3.720
16 HG12 VAL 2 HG12 VAL 2 10.941 7.379 4.719
17 HG13 VAL 2 HG13 VAL 2 9.227 7.790 4.661
18 HG21 VAL 2 HG21 VAL 2 11.639 5.190 5.777
19 HG22 VAL 2 HG22 VAL 2 10.448 4.321 4.809
20 HG23 VAL 2 HG23 VAL 2 10.421 4.189 6.567
21 H THR 3 HN THR 3 8.500 7.871 8.871
22 HA THR 3 HA THR 3 8.198 5.806 10.744
23 HB THR 3 HB THR 3 6.356 8.146 10.405
24 HG1 THR 3 HG1 THR 3 8.100 9.308 11.514
25 HG21 THR 3 HG21 THR 3 7.854 6.909 12.636
26 HG22 THR 3 HG22 THR 3 6.156 6.570 12.224
27 HG23 THR 3 HG23 THR 3 6.642 8.194 12.801
28 H ALA 4 HN ALA 4 6.197 7.364 8.288
29 HA ALA 4 HA ALA 4 4.422 5.045 8.177
30 HB1 ALA 4 HB1 ALA 4 2.983 6.529 6.797
31 HB2 ALA 4 HB2 ALA 4 4.157 7.829 6.990
32 HB3 ALA 4 HB3 ALA 4 3.275 7.222 8.392
33 H ALA 5 HN ALA 5 4.969 3.669 6.698
34 HA ALA 5 HA ALA 5 7.041 4.381 4.748
35 HB1 ALA 5 HB1 ALA 5 5.737 1.729 5.363
36 HB2 ALA 5 HB2 ALA 5 7.270 2.297 6.020
37 HB3 ALA 5 HB3 ALA 5 7.113 1.966 4.294
38 H LEU 6 HN LEU 6 4.036 2.575 4.554
39 HA LEU 6 HA LEU 6 3.063 4.223 2.527
40 HB2 LEU 6 HB2 LEU 6 2.752 2.496 0.769
41 HB3 LEU 6 HB1 LEU 6 4.429 2.887 1.022
42 HG LEU 6 HG LEU 6 4.348 0.624 0.533
43 HD11 LEU 6 HD11 LEU 6 5.870 0.934 2.247
44 HD12 LEU 6 HD12 LEU 6 5.072 -0.626 2.465
45 HD13 LEU 6 HD13 LEU 6 4.624 0.752 3.475
46 HD21 LEU 6 HD21 LEU 6 2.054 0.211 0.702
47 HD22 LEU 6 HD22 LEU 6 2.092 0.299 2.467
48 HD23 LEU 6 HD23 LEU 6 2.914 -1.031 1.619
49 H THR 7 HN THR 7 0.980 4.225 2.435
50 HA THR 7 HA THR 7 -0.242 2.704 4.595
51 HB THR 7 HB THR 7 -1.273 5.211 3.270
52 HG1 THR 7 HG1 THR 7 0.458 4.791 5.501
53 HG21 THR 7 HG21 THR 7 -2.926 3.857 4.508
54 HG22 THR 7 HG22 THR 7 -2.611 5.381 5.332
55 HG23 THR 7 HG23 THR 7 -1.881 3.887 5.926
56 H ILE 8 HN ILE 8 -1.530 1.215 4.133
57 HA ILE 8 HA ILE 8 -2.545 0.703 1.486
58 HB ILE 8 HB ILE 8 -2.575 -0.795 4.099
59 HG12 ILE 8 HG12 ILE 8 -1.143 -1.404 1.516
60 HG13 ILE 8 HG11 ILE 8 -0.394 -0.674 2.935
61 HG21 ILE 8 HG21 ILE 8 -3.746 -1.669 1.483
62 HG22 ILE 8 HG22 ILE 8 -4.559 -1.307 3.020
63 HG23 ILE 8 HG23 ILE 8 -3.487 -2.707 2.905
64 HD11 ILE 8 HD11 ILE 8 -0.877 -2.711 4.203
65 HD12 ILE 8 HD12 ILE 8 0.109 -3.039 2.776
66 HD13 ILE 8 HD13 ILE 8 -1.614 -3.420 2.766
67 H TYR 9 HN TYR 9 -4.462 1.318 0.895
68 HA TYR 9 HA TYR 9 -6.527 1.935 2.874
69 HB2 TYR 9 HB2 TYR 9 -6.349 2.518 -0.081
70 HB3 TYR 9 HB1 TYR 9 -7.761 2.869 0.908
71 HD1 TYR 9 HD1 TYR 9 -7.166 4.274 3.094
72 HD2 TYR 9 HD2 TYR 9 -4.902 4.245 -0.499
73 HE1 TYR 9 HE1 TYR 9 -6.247 6.465 3.671
74 HE2 TYR 9 HE2 TYR 9 -3.970 6.444 0.067
75 HH TYR 9 HH TYR 9 -4.721 8.405 1.477
76 H THR 10 HN THR 10 -7.710 0.286 3.445
77 HA THR 10 HA THR 10 -9.203 -1.112 1.503
78 HB THR 10 HB THR 10 -7.041 -2.459 1.414
79 HG1 THR 10 HG1 THR 10 -8.667 -4.258 2.663
80 HG21 THR 10 HG21 THR 10 -6.344 -2.061 3.762
81 HG22 THR 10 HG22 THR 10 -6.385 -3.778 3.361
82 HG23 THR 10 HG23 THR 10 -7.689 -3.061 4.306
83 H THR 11 HN THR 11 -10.646 -2.642 2.619
84 HA THR 11 HA THR 11 -10.849 -2.408 5.457
85 HB THR 11 HB THR 11 -13.142 -1.766 3.549
86 HG1 THR 11 HG1 THR 11 -12.232 -0.430 5.853
87 HG21 THR 11 HG21 THR 11 -13.339 -2.202 6.549
88 HG22 THR 11 HG22 THR 11 -14.009 -3.280 5.323
89 HG23 THR 11 HG23 THR 11 -14.640 -1.641 5.495
90 H SER 12 HN SER 12 -12.149 -4.210 6.326
91 HA SER 12 HA SER 12 -11.304 -6.651 5.749
92 HB2 SER 12 HB2 SER 12 -13.968 -5.878 6.811
93 HB3 SER 12 HB1 SER 12 -13.008 -7.312 7.264
94 HG SER 12 HG SER 12 -11.590 -6.012 8.302
95 H TRP 13 HN TRP 13 -13.765 -5.026 3.848
96 HA TRP 13 HA TRP 13 -15.070 -7.418 2.979
97 HB2 TRP 13 HB2 TRP 13 -16.262 -5.932 1.342
98 HB3 TRP 13 HB1 TRP 13 -16.417 -5.420 3.013
99 HD1 TRP 13 HD1 TRP 13 -15.677 -3.007 3.575
100 HE1 TRP 13 HE1 TRP 13 -14.704 -1.044 2.245
101 HE3 TRP 13 HE3 TRP 13 -14.596 -5.441 -0.795
102 HZ2 TRP 13 HZ2 TRP 13 -13.623 -0.583 -0.320
103 HZ3 TRP 13 HZ3 TRP 13 -13.599 -4.159 -2.636
104 HH2 TRP 13 HH2 TRP 13 -13.122 -1.774 -2.400
105 H CYS 14 HN CYS 14 -12.160 -5.918 2.114
106 HA CYS 14 HA CYS 14 -12.309 -6.887 -0.610
107 HB2 CYS 14 HB2 CYS 14 -11.342 -4.635 -0.173
108 HB3 CYS 14 HB1 CYS 14 -10.047 -5.401 0.738
109 HG CYS 14 HG CYS 14 -10.436 -5.088 -2.572
110 H GLY 15 HN GLY 15 -11.647 -8.794 -1.138
111 HA2 GLY 15 HA2 GLY 15 -10.457 -10.593 0.717
112 HA3 GLY 15 HA1 GLY 15 -10.771 -10.912 -0.983
113 H TYR 16 HN TYR 16 -9.183 -8.604 -1.869
114 HA TYR 16 HA TYR 16 -6.683 -9.946 -1.900
115 HB2 TYR 16 HB2 TYR 16 -7.470 -7.279 -3.007
116 HB3 TYR 16 HB1 TYR 16 -5.812 -7.866 -3.081
117 HD1 TYR 16 HD2 TYR 16 -6.236 -10.740 -3.648
118 HD2 TYR 16 HD1 TYR 16 -8.186 -7.294 -5.207
119 HE1 TYR 16 HE2 TYR 16 -6.769 -11.971 -5.669
120 HE2 TYR 16 HE1 TYR 16 -8.734 -8.542 -7.261
121 HH TYR 16 HH TYR 16 -8.420 -11.890 -7.429
122 H CYS 17 HN CYS 17 -7.976 -7.912 0.359
123 HA CYS 17 HA CYS 17 -5.826 -6.417 1.250
124 HB2 CYS 17 HB2 CYS 17 -8.027 -6.095 2.183
125 HB3 CYS 17 HB1 CYS 17 -8.034 -7.736 2.822
126 HG CYS 17 HG CYS 17 -7.697 -6.089 5.007
127 H LEU 18 HN LEU 18 -6.834 -9.637 2.264
128 HA LEU 18 HA LEU 18 -4.609 -9.928 3.959
129 HB2 LEU 18 HB2 LEU 18 -5.433 -12.321 4.142
130 HB3 LEU 18 HB1 LEU 18 -6.466 -11.034 4.726
131 HG LEU 18 HG LEU 18 -7.701 -11.232 2.516
132 HD11 LEU 18 HD11 LEU 18 -7.559 -13.347 1.352
133 HD12 LEU 18 HD12 LEU 18 -6.148 -13.790 2.333
134 HD13 LEU 18 HD13 LEU 18 -6.084 -12.389 1.252
135 HD21 LEU 18 HD21 LEU 18 -8.997 -13.157 3.277
136 HD22 LEU 18 HD22 LEU 18 -8.621 -12.013 4.564
137 HD23 LEU 18 HD23 LEU 18 -7.725 -13.531 4.445
138 H ARG 19 HN ARG 19 -5.054 -10.670 0.631
139 HA ARG 19 HA ARG 19 -2.867 -12.503 0.476
140 HB2 ARG 19 HB2 ARG 19 -4.123 -10.811 -1.677
141 HB3 ARG 19 HB1 ARG 19 -2.891 -12.018 -1.986
142 HG2 ARG 19 HG2 ARG 19 -5.679 -12.516 -0.936
143 HG3 ARG 19 HG1 ARG 19 -5.053 -12.938 -2.526
144 HD2 ARG 19 HD2 ARG 19 -4.157 -14.103 0.126
145 HD3 ARG 19 HD1 ARG 19 -5.121 -14.908 -1.104
146 HE ARG 19 HE ARG 19 -2.833 -14.182 -2.396
147 HH11 ARG 19 HH11 ARG 19 -3.409 -16.097 0.545
148 HH12 ARG 19 HH12 ARG 19 -2.095 -17.145 0.273
149 HH21 ARG 19 HH21 ARG 19 -1.059 -15.664 -2.739
150 HH22 ARG 19 HH22 ARG 19 -0.766 -16.918 -1.622
151 H LEU 20 HN LEU 20 -3.288 -9.071 -0.084
152 HA LEU 20 HA LEU 20 -0.666 -8.436 -0.741
153 HB2 LEU 20 HB2 LEU 20 -2.434 -6.905 -1.169
154 HB3 LEU 20 HB1 LEU 20 -2.894 -6.861 0.518
155 HG LEU 20 HG LEU 20 -0.799 -5.743 1.044
156 HD11 LEU 20 HD11 LEU 20 0.553 -4.749 -0.786
157 HD12 LEU 20 HD12 LEU 20 -0.413 -5.635 -1.960
158 HD13 LEU 20 HD13 LEU 20 0.597 -6.507 -0.808
159 HD21 LEU 20 HD21 LEU 20 -1.429 -3.590 0.201
160 HD22 LEU 20 HD22 LEU 20 -2.879 -4.510 0.621
161 HD23 LEU 20 HD23 LEU 20 -2.390 -4.335 -1.071
162 H LYS 21 HN LYS 21 -2.327 -8.482 2.399
163 HA LYS 21 HA LYS 21 -0.263 -7.543 4.032
164 HB2 LYS 21 HB2 LYS 21 -2.259 -9.706 4.737
165 HB3 LYS 21 HB1 LYS 21 -1.305 -8.788 5.883
166 HG2 LYS 21 HG2 LYS 21 -3.463 -7.687 4.081
167 HG3 LYS 21 HG1 LYS 21 -3.604 -8.020 5.802
168 HD2 LYS 21 HD2 LYS 21 -1.867 -6.342 6.258
169 HD3 LYS 21 HD1 LYS 21 -1.766 -5.998 4.531
170 HE2 LYS 21 HE2 LYS 21 -3.151 -4.335 5.666
171 HE3 LYS 21 HE1 LYS 21 -4.102 -5.280 4.525
172 HZ1 LYS 21 HZ1 LYS 21 -3.992 -5.819 7.436
173 HZ2 LYS 21 HZ2 LYS 21 -5.082 -6.508 6.356
174 HZ3 LYS 21 HZ3 LYS 21 -5.160 -4.869 6.735
175 H THR 22 HN THR 22 -1.007 -10.872 3.093
176 HA THR 22 HA THR 22 1.035 -12.163 4.472
177 HB THR 22 HB THR 22 -0.273 -12.979 1.859
178 HG1 THR 22 HG1 THR 22 -1.918 -12.762 3.300
179 HG21 THR 22 HG21 THR 22 1.069 -14.644 4.010
180 HG22 THR 22 HG22 THR 22 1.719 -14.328 2.402
181 HG23 THR 22 HG23 THR 22 0.244 -15.278 2.586
182 H ALA 23 HN ALA 23 0.959 -10.832 1.177
183 HA ALA 23 HA ALA 23 3.482 -11.759 0.372
184 HB1 ALA 23 HB1 ALA 23 1.776 -10.993 -1.202
185 HB2 ALA 23 HB2 ALA 23 3.296 -10.131 -1.442
186 HB3 ALA 23 HB3 ALA 23 1.959 -9.345 -0.604
187 H LEU 24 HN LEU 24 2.466 -8.750 1.934
188 HA LEU 24 HA LEU 24 5.086 -7.577 1.810
189 HB2 LEU 24 HB2 LEU 24 2.796 -6.829 3.616
190 HB3 LEU 24 HB1 LEU 24 4.234 -5.881 3.369
191 HG LEU 24 HG LEU 24 1.976 -6.359 1.447
192 HD11 LEU 24 HD11 LEU 24 3.110 -3.890 2.715
193 HD12 LEU 24 HD12 LEU 24 1.593 -4.665 3.140
194 HD13 LEU 24 HD13 LEU 24 1.796 -3.904 1.549
195 HD21 LEU 24 HD21 LEU 24 3.958 -6.396 0.058
196 HD22 LEU 24 HD22 LEU 24 4.607 -4.984 0.905
197 HD23 LEU 24 HD23 LEU 24 3.172 -4.834 -0.090
198 H THR 25 HN THR 25 3.315 -9.206 4.410
199 HA THR 25 HA THR 25 5.325 -8.886 6.302
200 HB THR 25 HB THR 25 3.251 -11.091 6.045
201 HG1 THR 25 HG1 THR 25 3.304 -8.486 7.058
202 HG21 THR 25 HG21 THR 25 4.810 -10.196 8.496
203 HG22 THR 25 HG22 THR 25 5.075 -11.705 7.625
204 HG23 THR 25 HG23 THR 25 3.546 -11.424 8.460
205 H ALA 26 HN ALA 26 4.894 -11.336 3.804
206 HA ALA 26 HA ALA 26 6.908 -13.116 4.589
207 HB1 ALA 26 HB1 ALA 26 5.185 -13.618 2.906
208 HB2 ALA 26 HB2 ALA 26 6.817 -13.969 2.335
209 HB3 ALA 26 HB3 ALA 26 5.986 -12.517 1.784
210 H ASN 27 HN ASN 27 7.067 -10.161 2.698
211 HA ASN 27 HA ASN 27 9.938 -10.599 2.279
212 HB2 ASN 27 HB2 ASN 27 7.991 -8.748 0.916
213 HB3 ASN 27 HB1 ASN 27 9.730 -8.550 0.744
214 HD21 ASN 27 HD21 ASN 27 6.988 -10.596 0.042
215 HD22 ASN 27 HD22 ASN 27 7.779 -11.538 -1.171
216 H ARG 28 HN ARG 28 8.182 -9.481 4.563
217 HA ARG 28 HA ARG 28 8.539 -8.303 6.423
218 HB2 ARG 28 HB2 ARG 28 11.372 -7.976 5.424
219 HB3 ARG 28 HB1 ARG 28 10.828 -7.766 7.082
220 HG2 ARG 28 HG2 ARG 28 10.880 -10.340 5.505
221 HG3 ARG 28 HG1 ARG 28 11.924 -9.905 6.854
222 HD2 ARG 28 HD2 ARG 28 10.005 -9.903 8.359
223 HD3 ARG 28 HD1 ARG 28 8.925 -10.255 7.009
224 HE ARG 28 HE ARG 28 11.062 -12.136 7.450
225 HH11 ARG 28 HH11 ARG 28 7.638 -11.406 7.895
226 HH12 ARG 28 HH12 ARG 28 7.221 -12.989 8.411
227 HH21 ARG 28 HH21 ARG 28 10.466 -14.293 8.166
228 HH22 ARG 28 HH22 ARG 28 8.850 -14.640 8.581
229 H ILE 29 HN ILE 29 7.479 -6.857 4.196
230 HA ILE 29 HA ILE 29 8.671 -4.220 4.336
231 HB ILE 29 HB ILE 29 6.051 -5.104 3.067
232 HG12 ILE 29 HG12 ILE 29 7.210 -4.171 0.957
233 HG13 ILE 29 HG11 ILE 29 8.680 -4.234 1.912
234 HG21 ILE 29 HG21 ILE 29 5.780 -2.847 2.142
235 HG22 ILE 29 HG22 ILE 29 7.150 -2.311 3.121
236 HG23 ILE 29 HG23 ILE 29 5.685 -2.879 3.906
237 HD11 ILE 29 HD11 ILE 29 6.896 -6.543 1.281
238 HD12 ILE 29 HD12 ILE 29 8.440 -6.606 2.159
239 HD13 ILE 29 HD13 ILE 29 8.390 -6.109 0.458
240 H ALA 30 HN ALA 30 8.325 -2.785 5.837
241 HA ALA 30 HA ALA 30 6.305 -3.109 7.847
242 HB1 ALA 30 HB1 ALA 30 8.189 -0.834 7.201
243 HB2 ALA 30 HB2 ALA 30 8.467 -2.095 8.404
244 HB3 ALA 30 HB3 ALA 30 7.176 -0.913 8.642
245 H TYR 31 HN TYR 31 4.253 -2.326 7.629
246 HA TYR 31 HA TYR 31 3.798 -0.308 5.557
247 HB2 TYR 31 HB2 TYR 31 1.830 -1.492 4.734
248 HB3 TYR 31 HB1 TYR 31 3.285 -2.447 4.507
249 HD1 TYR 31 HD2 TYR 31 0.116 -2.152 6.339
250 HD2 TYR 31 HD1 TYR 31 3.539 -4.583 5.665
251 HE1 TYR 31 HE2 TYR 31 -1.031 -4.044 7.393
252 HE2 TYR 31 HE1 TYR 31 2.390 -6.496 6.719
253 HH TYR 31 HH TYR 31 0.551 -6.955 8.254
254 H ASP 32 HN ASP 32 1.771 0.700 5.660
255 HA ASP 32 HA ASP 32 0.705 0.930 8.379
256 HB2 ASP 32 HB2 ASP 32 1.271 2.940 6.218
257 HB3 ASP 32 HB1 ASP 32 0.083 3.297 7.471
258 H GLU 33 HN GLU 33 -1.582 0.922 8.457
259 HA GLU 33 HA GLU 33 -2.986 0.864 5.891
260 HB2 GLU 33 HB2 GLU 33 -4.300 -1.073 6.525
261 HB3 GLU 33 HB1 GLU 33 -2.599 -1.498 6.492
262 HG2 GLU 33 HG2 GLU 33 -2.533 -1.372 8.931
263 HG3 GLU 33 HG1 GLU 33 -4.239 -0.927 8.949
264 H VAL 34 HN VAL 34 -4.972 1.782 5.988
265 HA VAL 34 HA VAL 34 -6.060 2.367 8.596
266 HB VAL 34 HB VAL 34 -4.794 4.418 7.954
267 HG11 VAL 34 HG11 VAL 34 -6.623 4.574 5.584
268 HG12 VAL 34 HG12 VAL 34 -4.873 4.280 5.560
269 HG13 VAL 34 HG13 VAL 34 -5.504 5.824 6.114
270 HG21 VAL 34 HG21 VAL 34 -6.599 6.049 8.223
271 HG22 VAL 34 HG22 VAL 34 -6.753 4.681 9.330
272 HG23 VAL 34 HG23 VAL 34 -7.776 4.780 7.895
273 H ASP 35 HN ASP 35 -8.328 2.491 8.597
274 HA ASP 35 HA ASP 35 -9.402 0.894 6.475
275 HB2 ASP 35 HB2 ASP 35 -9.987 0.568 8.864
276 HB3 ASP 35 HB1 ASP 35 -10.760 2.146 8.867
277 H ILE 36 HN ILE 36 -10.857 1.498 4.981
278 HA ILE 36 HA ILE 36 -10.881 4.302 4.314
279 HB ILE 36 HB ILE 36 -11.961 3.583 2.193
280 HG12 ILE 36 HG12 ILE 36 -11.643 0.844 3.422
281 HG13 ILE 36 HG11 ILE 36 -13.156 1.648 3.069
282 HG21 ILE 36 HG21 ILE 36 -9.562 3.776 2.327
283 HG22 ILE 36 HG22 ILE 36 -9.977 2.351 1.356
284 HG23 ILE 36 HG23 ILE 36 -9.443 2.161 3.021
285 HD11 ILE 36 HD11 ILE 36 -11.137 0.785 1.037
286 HD12 ILE 36 HD12 ILE 36 -12.782 1.422 0.731
287 HD13 ILE 36 HD13 ILE 36 -12.541 -0.125 1.573
288 H GLU 37 HN GLU 37 -13.093 2.015 5.658
289 HA GLU 37 HA GLU 37 -15.349 3.547 4.929
290 HB2 GLU 37 HB2 GLU 37 -15.436 1.087 5.260
291 HB3 GLU 37 HB1 GLU 37 -15.084 1.316 6.962
292 HG2 GLU 37 HG2 GLU 37 -17.474 0.858 6.438
293 HG3 GLU 37 HG1 GLU 37 -17.193 2.350 7.336
294 H HIS 38 HN HIS 38 -13.099 3.339 7.472
295 HA HIS 38 HA HIS 38 -14.351 5.013 9.399
296 HB2 HIS 38 HB2 HIS 38 -12.462 3.562 10.002
297 HB3 HIS 38 HB1 HIS 38 -11.412 4.441 8.901
298 HD1 HIS 38 HD1 HIS 38 -10.028 6.274 10.004
299 HD2 HIS 38 HD2 HIS 38 -13.446 5.307 12.166
300 HE1 HIS 38 HE1 HIS 38 -9.922 7.617 12.116
301 H ASN 39 HN ASN 39 -11.975 5.668 6.828
302 HA ASN 39 HA ASN 39 -12.450 8.532 7.243
303 HB2 ASN 39 HB2 ASN 39 -10.166 7.110 5.878
304 HB3 ASN 39 HB1 ASN 39 -10.403 8.843 5.751
305 HD21 ASN 39 HD21 ASN 39 -8.181 7.411 6.825
306 HD22 ASN 39 HD22 ASN 39 -8.023 7.917 8.472
307 H ARG 40 HN ARG 40 -14.181 9.022 6.158
308 HA ARG 40 HA ARG 40 -15.203 7.844 3.850
309 HB2 ARG 40 HB2 ARG 40 -16.380 9.338 5.501
310 HB3 ARG 40 HB1 ARG 40 -15.614 10.693 4.699
311 HG2 ARG 40 HG2 ARG 40 -17.735 10.618 3.813
312 HG3 ARG 40 HG1 ARG 40 -16.740 9.864 2.572
313 HD2 ARG 40 HD2 ARG 40 -18.462 8.384 4.604
314 HD3 ARG 40 HD1 ARG 40 -18.873 8.696 2.941
315 HE ARG 40 HE ARG 40 -16.848 7.358 2.359
316 HH11 ARG 40 HH11 ARG 40 -18.580 6.731 5.406
317 HH12 ARG 40 HH12 ARG 40 -18.315 5.046 5.333
318 HH21 ARG 40 HH21 ARG 40 -16.490 5.034 2.347
319 HH22 ARG 40 HH22 ARG 40 -17.121 4.077 3.617
320 H ALA 41 HN ALA 41 -13.062 10.648 4.159
321 HA ALA 41 HA ALA 41 -13.189 11.309 1.373
322 HB1 ALA 41 HB1 ALA 41 -12.605 12.996 3.094
323 HB2 ALA 41 HB2 ALA 41 -11.393 12.877 1.821
324 HB3 ALA 41 HB3 ALA 41 -11.091 12.138 3.390
325 H ALA 42 HN ALA 42 -11.122 9.341 3.365
326 HA ALA 42 HA ALA 42 -9.129 8.877 1.394
327 HB1 ALA 42 HB1 ALA 42 -9.906 7.119 3.722
328 HB2 ALA 42 HB2 ALA 42 -8.718 8.418 3.781
329 HB3 ALA 42 HB3 ALA 42 -8.423 6.990 2.783
330 H ALA 43 HN ALA 43 -12.114 7.244 2.302
331 HA ALA 43 HA ALA 43 -11.946 5.060 0.528
332 HB1 ALA 43 HB1 ALA 43 -14.367 4.858 0.830
333 HB2 ALA 43 HB2 ALA 43 -14.398 6.460 1.571
334 HB3 ALA 43 HB3 ALA 43 -13.552 5.138 2.370
335 H GLU 44 HN GLU 44 -12.910 8.367 0.096
336 HA GLU 44 HA GLU 44 -14.067 7.967 -2.479
337 HB2 GLU 44 HB2 GLU 44 -14.513 9.912 -0.875
338 HB3 GLU 44 HB1 GLU 44 -12.962 10.556 -1.397
339 HG2 GLU 44 HG2 GLU 44 -14.715 11.607 -2.651
340 HG3 GLU 44 HG1 GLU 44 -13.776 10.546 -3.709
341 H PHE 45 HN PHE 45 -11.020 9.233 -1.233
342 HA PHE 45 HA PHE 45 -9.617 9.732 -3.541
343 HB2 PHE 45 HB2 PHE 45 -8.782 10.388 -1.372
344 HB3 PHE 45 HB1 PHE 45 -8.657 8.712 -0.867
345 HD1 PHE 45 HD1 PHE 45 -7.255 11.217 -3.215
346 HD2 PHE 45 HD2 PHE 45 -6.689 7.488 -1.234
347 HE1 PHE 45 HE1 PHE 45 -4.910 11.185 -3.950
348 HE2 PHE 45 HE2 PHE 45 -4.349 7.455 -1.960
349 HZ PHE 45 HZ PHE 45 -3.453 9.302 -3.325
350 H VAL 46 HN VAL 46 -9.533 6.683 -1.669
351 HA VAL 46 HA VAL 46 -7.935 5.340 -3.554
352 HB VAL 46 HB VAL 46 -7.991 4.461 -1.285
353 HG11 VAL 46 HG11 VAL 46 -9.873 3.293 -0.429
354 HG12 VAL 46 HG12 VAL 46 -10.825 3.764 -1.852
355 HG13 VAL 46 HG13 VAL 46 -10.248 5.008 -0.697
356 HG21 VAL 46 HG21 VAL 46 -8.281 2.133 -1.635
357 HG22 VAL 46 HG22 VAL 46 -7.615 2.876 -3.114
358 HG23 VAL 46 HG23 VAL 46 -9.325 2.448 -3.017
359 H GLY 47 HN GLY 47 -11.309 5.920 -3.465
360 HA2 GLY 47 HA2 GLY 47 -12.078 3.883 -5.321
361 HA3 GLY 47 HA1 GLY 47 -13.024 5.303 -4.886
362 H SER 48 HN SER 48 -11.116 7.254 -5.591
363 HA SER 48 HA SER 48 -11.622 7.434 -8.384
364 HB2 SER 48 HB2 SER 48 -9.913 9.178 -6.602
365 HB3 SER 48 HB1 SER 48 -10.516 9.601 -8.206
366 HG SER 48 HG SER 48 -12.558 8.796 -6.702
367 H VAL 49 HN VAL 49 -8.820 6.609 -6.421
368 HA VAL 49 HA VAL 49 -7.121 6.574 -8.800
369 HB VAL 49 HB VAL 49 -5.220 6.195 -7.297
370 HG11 VAL 49 HG11 VAL 49 -7.039 8.374 -6.360
371 HG12 VAL 49 HG12 VAL 49 -5.917 8.473 -7.723
372 HG13 VAL 49 HG13 VAL 49 -5.299 8.306 -6.067
373 HG21 VAL 49 HG21 VAL 49 -6.396 4.834 -5.603
374 HG22 VAL 49 HG22 VAL 49 -7.227 6.300 -5.066
375 HG23 VAL 49 HG23 VAL 49 -5.480 6.165 -4.879
376 H ASN 50 HN ASN 50 -9.252 4.569 -7.923
377 HA ASN 50 HA ASN 50 -7.655 2.140 -7.728
378 HB2 ASN 50 HB2 ASN 50 -10.233 2.869 -6.853
379 HB3 ASN 50 HB1 ASN 50 -10.464 1.634 -8.086
380 HD21 ASN 50 HD21 ASN 50 -7.833 2.019 -5.797
381 HD22 ASN 50 HD22 ASN 50 -8.102 0.515 -5.003
382 H GLY 51 HN GLY 51 -8.902 0.292 -9.087
383 HA2 GLY 51 HA2 GLY 51 -8.601 0.992 -11.866
384 HA3 GLY 51 HA1 GLY 51 -8.994 -0.602 -11.214
385 H GLY 52 HN GLY 52 -10.341 2.616 -11.514
386 HA2 GLY 52 HA2 GLY 52 -12.371 3.103 -12.647
387 HA3 GLY 52 HA1 GLY 52 -12.893 1.448 -12.364
388 H ASN 53 HN ASN 53 -12.877 0.974 -9.867
389 HA ASN 53 HA ASN 53 -14.060 3.157 -8.317
390 HB2 ASN 53 HB2 ASN 53 -15.940 2.060 -9.539
391 HB3 ASN 53 HB1 ASN 53 -15.445 0.512 -8.863
392 HD21 ASN 53 HD21 ASN 53 -17.313 0.177 -7.816
393 HD22 ASN 53 HD22 ASN 53 -17.851 1.087 -6.450
394 H ARG 54 HN ARG 54 -14.213 2.456 -6.018
395 HA ARG 54 HA ARG 54 -11.840 1.088 -5.285
396 HB2 ARG 54 HB2 ARG 54 -12.455 1.245 -2.937
397 HB3 ARG 54 HB1 ARG 54 -12.792 2.773 -3.712
398 HG2 ARG 54 HG2 ARG 54 -14.928 0.712 -3.204
399 HG3 ARG 54 HG1 ARG 54 -14.461 1.916 -2.006
400 HD2 ARG 54 HD2 ARG 54 -15.470 2.524 -4.780
401 HD3 ARG 54 HD1 ARG 54 -16.443 2.560 -3.312
402 HE ARG 54 HE ARG 54 -14.296 4.145 -2.783
403 HH11 ARG 54 HH11 ARG 54 -16.774 4.213 -5.335
404 HH12 ARG 54 HH12 ARG 54 -16.900 5.909 -5.321
405 HH21 ARG 54 HH21 ARG 54 -14.418 6.377 -2.841
406 HH22 ARG 54 HH22 ARG 54 -15.476 7.224 -3.879
407 H THR 55 HN THR 55 -11.430 -0.860 -5.378
408 HA THR 55 HA THR 55 -13.193 -2.838 -4.284
409 HB THR 55 HB THR 55 -14.020 -2.643 -6.617
410 HG1 THR 55 HG1 THR 55 -13.926 -4.817 -7.121
411 HG21 THR 55 HG21 THR 55 -12.616 -3.391 -8.511
412 HG22 THR 55 HG22 THR 55 -11.239 -3.524 -7.421
413 HG23 THR 55 HG23 THR 55 -11.960 -1.948 -7.737
414 H VAL 56 HN VAL 56 -10.087 -1.798 -5.489
415 HA VAL 56 HA VAL 56 -8.886 -4.151 -4.274
416 HB VAL 56 HB VAL 56 -6.898 -3.684 -5.792
417 HG11 VAL 56 HG11 VAL 56 -7.890 -4.879 -7.716
418 HG12 VAL 56 HG12 VAL 56 -9.502 -4.525 -7.094
419 HG13 VAL 56 HG13 VAL 56 -8.415 -5.568 -6.182
420 HG21 VAL 56 HG21 VAL 56 -8.946 -2.054 -7.293
421 HG22 VAL 56 HG22 VAL 56 -7.357 -2.516 -7.902
422 HG23 VAL 56 HG23 VAL 56 -7.489 -1.444 -6.507
423 HA PRO 57 HA PRO 57 -6.913 -1.511 -1.361
424 HB2 PRO 57 HB2 PRO 57 -4.512 -2.873 -1.113
425 HB3 PRO 57 HB1 PRO 57 -5.993 -3.305 -0.258
426 HG2 PRO 57 HG2 PRO 57 -4.843 -4.472 -2.758
427 HG3 PRO 57 HG1 PRO 57 -5.648 -5.292 -1.407
428 HD2 PRO 57 HD2 PRO 57 -6.884 -4.829 -3.729
429 HD3 PRO 57 HD1 PRO 57 -7.751 -4.735 -2.183
430 H THR 58 HN THR 58 -5.625 0.236 -1.436
431 HA THR 58 HA THR 58 -3.807 0.446 -3.715
432 HB THR 58 HB THR 58 -5.472 2.685 -2.504
433 HG1 THR 58 HG1 THR 58 -6.263 0.719 -3.852
434 HG21 THR 58 HG21 THR 58 -3.378 3.420 -3.664
435 HG22 THR 58 HG22 THR 58 -4.845 3.909 -4.514
436 HG23 THR 58 HG23 THR 58 -3.913 2.540 -5.104
437 H VAL 59 HN VAL 59 -1.795 1.406 -3.207
438 HA VAL 59 HA VAL 59 -1.344 1.910 -0.353
439 HB VAL 59 HB VAL 59 1.067 1.489 -0.793
440 HG11 VAL 59 HG11 VAL 59 -0.811 -0.704 -1.583
441 HG12 VAL 59 HG12 VAL 59 -0.241 -0.303 0.057
442 HG13 VAL 59 HG13 VAL 59 0.887 -0.930 -1.148
443 HG21 VAL 59 HG21 VAL 59 0.113 0.638 -3.509
444 HG22 VAL 59 HG22 VAL 59 1.752 0.414 -2.874
445 HG23 VAL 59 HG23 VAL 59 1.125 2.042 -3.156
446 H LYS 60 HN LYS 60 -0.737 3.815 0.285
447 HA LYS 60 HA LYS 60 0.142 5.777 -1.728
448 HB2 LYS 60 HB2 LYS 60 -1.945 6.324 -0.365
449 HB3 LYS 60 HB1 LYS 60 -0.912 6.316 1.052
450 HG2 LYS 60 HG2 LYS 60 0.438 8.134 0.072
451 HG3 LYS 60 HG1 LYS 60 -0.649 8.171 -1.309
452 HD2 LYS 60 HD2 LYS 60 -1.281 9.939 0.214
453 HD3 LYS 60 HD1 LYS 60 -2.530 8.692 0.235
454 HE2 LYS 60 HE2 LYS 60 -1.542 7.783 2.308
455 HE3 LYS 60 HE1 LYS 60 -0.339 9.069 2.270
456 HZ1 LYS 60 HZ1 LYS 60 -2.171 9.534 3.764
457 HZ2 LYS 60 HZ2 LYS 60 -3.273 9.496 2.484
458 HZ3 LYS 60 HZ3 LYS 60 -2.086 10.689 2.553
459 H PHE 61 HN PHE 61 2.268 5.930 -1.680
460 HA PHE 61 HA PHE 61 3.805 5.028 0.592
461 HB2 PHE 61 HB2 PHE 61 4.689 6.331 -1.972
462 HB3 PHE 61 HB1 PHE 61 5.756 5.642 -0.759
463 HD1 PHE 61 HD1 PHE 61 3.337 4.938 -3.377
464 HD2 PHE 61 HD2 PHE 61 6.010 3.248 -0.537
465 HE1 PHE 61 HE1 PHE 61 3.171 2.801 -4.513
466 HE2 PHE 61 HE2 PHE 61 5.861 1.083 -1.686
467 HZ PHE 61 HZ PHE 61 4.437 0.859 -3.691
468 H ALA 62 HN ALA 62 5.544 6.368 1.490
469 HA ALA 62 HA ALA 62 4.591 8.726 2.619
470 HB1 ALA 62 HB1 ALA 62 7.460 7.842 2.355
471 HB2 ALA 62 HB2 ALA 62 6.342 7.346 3.625
472 HB3 ALA 62 HB3 ALA 62 6.839 9.032 3.500
473 H ASP 63 HN ASP 63 6.022 8.252 -0.465
474 HA ASP 63 HA ASP 63 6.879 10.999 -0.758
475 HB2 ASP 63 HB2 ASP 63 7.639 10.439 -2.946
476 HB3 ASP 63 HB1 ASP 63 7.959 9.002 -1.989
477 H GLY 64 HN GLY 64 3.951 9.360 -0.871
478 HA2 GLY 64 HA2 GLY 64 1.917 10.530 -1.046
479 HA3 GLY 64 HA1 GLY 64 2.683 11.660 -2.154
480 H SER 65 HN SER 65 3.737 8.805 -3.253
481 HA SER 65 HA SER 65 1.879 8.888 -5.426
482 HB2 SER 65 HB2 SER 65 4.297 8.571 -5.788
483 HB3 SER 65 HB1 SER 65 4.220 7.044 -4.922
484 HG SER 65 HG SER 65 2.478 7.389 -7.062
485 H THR 66 HN THR 66 0.489 7.284 -6.086
486 HA THR 66 HA THR 66 -0.103 5.216 -4.126
487 HB THR 66 HB THR 66 -2.396 5.523 -5.531
488 HG1 THR 66 HG1 THR 66 -1.397 8.142 -5.170
489 HG21 THR 66 HG21 THR 66 -3.220 6.834 -3.634
490 HG22 THR 66 HG22 THR 66 -1.554 7.136 -3.125
491 HG23 THR 66 HG23 THR 66 -2.210 5.491 -3.099
492 H LEU 67 HN LEU 67 -0.359 3.174 -4.931
493 HA LEU 67 HA LEU 67 -0.423 2.784 -7.842
494 HB2 LEU 67 HB2 LEU 67 1.209 1.100 -5.905
495 HB3 LEU 67 HB1 LEU 67 0.920 0.699 -7.568
496 HG LEU 67 HG LEU 67 2.595 2.994 -6.543
497 HD11 LEU 67 HD11 LEU 67 3.608 0.741 -6.331
498 HD12 LEU 67 HD12 LEU 67 4.433 1.729 -7.537
499 HD13 LEU 67 HD13 LEU 67 3.311 0.480 -8.047
500 HD21 LEU 67 HD21 LEU 67 3.184 3.358 -8.896
501 HD22 LEU 67 HD22 LEU 67 1.471 3.642 -8.618
502 HD23 LEU 67 HD23 LEU 67 2.004 2.141 -9.382
503 H THR 68 HN THR 68 -1.720 1.142 -8.522
504 HA THR 68 HA THR 68 -3.822 0.322 -6.791
505 HB THR 68 HB THR 68 -3.169 -0.859 -9.490
506 HG1 THR 68 HG1 THR 68 -4.062 0.945 -10.438
507 HG21 THR 68 HG21 THR 68 -5.617 -0.856 -9.710
508 HG22 THR 68 HG22 THR 68 -5.755 -0.081 -8.128
509 HG23 THR 68 HG23 THR 68 -5.112 -1.717 -8.257
510 H ASN 69 HN ASN 69 -4.099 -1.747 -5.872
511 HA ASN 69 HA ASN 69 -2.582 -3.147 -4.521
512 HB2 ASN 69 HB2 ASN 69 -3.591 -5.363 -4.973
513 HB3 ASN 69 HB1 ASN 69 -4.751 -4.066 -4.793
514 HD21 ASN 69 HD21 ASN 69 -5.002 -6.702 -6.054
515 HD22 ASN 69 HD22 ASN 69 -5.471 -6.437 -7.685
516 HA PRO 70 HA PRO 70 0.953 -4.325 -7.016
517 HB2 PRO 70 HB2 PRO 70 2.713 -3.136 -5.307
518 HB3 PRO 70 HB1 PRO 70 1.941 -2.310 -6.658
519 HG2 PRO 70 HG2 PRO 70 1.532 -1.895 -3.823
520 HG3 PRO 70 HG1 PRO 70 0.877 -0.971 -5.184
521 HD2 PRO 70 HD2 PRO 70 -0.397 -3.038 -3.537
522 HD3 PRO 70 HD1 PRO 70 -1.101 -1.850 -4.649
523 H SER 71 HN SER 71 2.605 -5.741 -6.637
524 HA SER 71 HA SER 71 2.205 -7.527 -4.433
525 HB2 SER 71 HB2 SER 71 4.424 -7.532 -6.496
526 HB3 SER 71 HB1 SER 71 3.823 -8.894 -5.545
527 HG SER 71 HG SER 71 2.591 -7.500 -7.644
528 H ALA 72 HN ALA 72 4.433 -8.254 -3.336
529 HA ALA 72 HA ALA 72 5.159 -6.073 -1.701
530 HB1 ALA 72 HB1 ALA 72 6.443 -8.786 -1.931
531 HB2 ALA 72 HB2 ALA 72 5.082 -8.368 -0.884
532 HB3 ALA 72 HB3 ALA 72 6.663 -7.638 -0.613
533 H ASP 73 HN ASP 73 6.771 -7.692 -4.341
534 HA ASP 73 HA ASP 73 9.212 -6.270 -4.048
535 HB2 ASP 73 HB2 ASP 73 9.827 -7.173 -6.201
536 HB3 ASP 73 HB1 ASP 73 9.018 -8.427 -5.270
537 H GLU 74 HN GLU 74 6.217 -5.628 -5.676
538 HA GLU 74 HA GLU 74 7.139 -3.526 -7.345
539 HB2 GLU 74 HB2 GLU 74 4.357 -4.146 -6.346
540 HB3 GLU 74 HB1 GLU 74 4.726 -2.950 -7.579
541 HG2 GLU 74 HG2 GLU 74 5.628 -4.738 -9.006
542 HG3 GLU 74 HG1 GLU 74 5.210 -5.915 -7.766
543 H VAL 75 HN VAL 75 5.612 -3.622 -4.153
544 HA VAL 75 HA VAL 75 5.724 -0.792 -3.890
545 HB VAL 75 HB VAL 75 5.287 -1.207 -1.389
546 HG11 VAL 75 HG11 VAL 75 3.504 -0.743 -3.021
547 HG12 VAL 75 HG12 VAL 75 2.996 -1.880 -1.766
548 HG13 VAL 75 HG13 VAL 75 3.440 -2.475 -3.373
549 HG21 VAL 75 HG21 VAL 75 4.876 -3.975 -2.404
550 HG22 VAL 75 HG22 VAL 75 4.561 -3.397 -0.762
551 HG23 VAL 75 HG23 VAL 75 6.227 -3.495 -1.371
552 H LYS 76 HN LYS 76 7.903 -3.392 -2.957
553 HA LYS 76 HA LYS 76 9.605 -1.917 -1.362
554 HB2 LYS 76 HB2 LYS 76 10.168 -4.259 -3.147
555 HB3 LYS 76 HB1 LYS 76 11.448 -3.486 -2.206
556 HG2 LYS 76 HG2 LYS 76 10.136 -3.943 -0.167
557 HG3 LYS 76 HG1 LYS 76 8.942 -4.767 -1.159
558 HD2 LYS 76 HD2 LYS 76 10.282 -6.459 -0.193
559 HD3 LYS 76 HD1 LYS 76 10.785 -6.349 -1.869
560 HE2 LYS 76 HE2 LYS 76 12.236 -4.952 0.381
561 HE3 LYS 76 HE1 LYS 76 12.623 -6.599 -0.095
562 HZ1 LYS 76 HZ1 LYS 76 12.886 -4.191 -1.873
563 HZ2 LYS 76 HZ2 LYS 76 13.309 -5.764 -2.272
564 HZ3 LYS 76 HZ3 LYS 76 14.110 -4.947 -1.037
565 H ALA 77 HN ALA 77 9.381 -2.113 -4.848
566 HA ALA 77 HA ALA 77 11.766 -0.935 -5.628
567 HB1 ALA 77 HB1 ALA 77 10.664 -0.388 -7.722
568 HB2 ALA 77 HB2 ALA 77 9.087 -0.625 -6.972
569 HB3 ALA 77 HB3 ALA 77 10.170 -1.997 -7.188
570 H LYS 78 HN LYS 78 8.735 0.645 -4.684
571 HA LYS 78 HA LYS 78 9.951 3.221 -5.136
572 HB2 LYS 78 HB2 LYS 78 7.282 2.578 -3.915
573 HB3 LYS 78 HB1 LYS 78 7.879 4.198 -4.203
574 HG2 LYS 78 HG2 LYS 78 8.082 3.547 -6.625
575 HG3 LYS 78 HG1 LYS 78 7.159 2.102 -6.206
576 HD2 LYS 78 HD2 LYS 78 5.459 3.502 -6.849
577 HD3 LYS 78 HD1 LYS 78 5.549 3.842 -5.119
578 HE2 LYS 78 HE2 LYS 78 6.846 5.495 -7.297
579 HE3 LYS 78 HE1 LYS 78 5.325 5.883 -6.512
580 HZ1 LYS 78 HZ1 LYS 78 7.218 7.136 -5.739
581 HZ2 LYS 78 HZ2 LYS 78 7.975 5.790 -5.128
582 HZ3 LYS 78 HZ3 LYS 78 6.521 6.355 -4.449
583 H LEU 79 HN LEU 79 8.865 1.305 -2.386
584 HA LEU 79 HA LEU 79 9.282 3.158 -0.373
585 HB2 LEU 79 HB2 LEU 79 8.041 1.099 -0.038
586 HB3 LEU 79 HB1 LEU 79 9.498 0.157 -0.260
587 HG LEU 79 HG LEU 79 10.436 1.157 1.799
588 HD11 LEU 79 HD11 LEU 79 8.992 2.400 3.315
589 HD12 LEU 79 HD12 LEU 79 7.715 2.417 2.095
590 HD13 LEU 79 HD13 LEU 79 9.234 3.262 1.798
591 HD21 LEU 79 HD21 LEU 79 9.300 -0.988 1.910
592 HD22 LEU 79 HD22 LEU 79 7.751 -0.178 2.126
593 HD23 LEU 79 HD23 LEU 79 8.990 -0.056 3.376
594 H VAL 80 HN VAL 80 11.578 0.880 -1.799
595 HA VAL 80 HA VAL 80 13.586 1.271 0.091
596 HB VAL 80 HB VAL 80 13.519 -0.596 -1.594
597 HG11 VAL 80 HG11 VAL 80 14.565 1.423 -3.546
598 HG12 VAL 80 HG12 VAL 80 13.021 0.575 -3.614
599 HG13 VAL 80 HG13 VAL 80 14.527 -0.325 -3.794
600 HG21 VAL 80 HG21 VAL 80 15.960 -0.727 -1.947
601 HG22 VAL 80 HG22 VAL 80 15.469 -0.335 -0.305
602 HG23 VAL 80 HG23 VAL 80 16.091 0.942 -1.371
603 H LYS 81 HN LYS 81 12.834 3.017 -2.864
604 HA LYS 81 HA LYS 81 15.203 4.611 -2.812
605 HB2 LYS 81 HB2 LYS 81 12.652 5.033 -4.363
606 HB3 LYS 81 HB1 LYS 81 14.188 5.833 -4.663
607 HG2 LYS 81 HG2 LYS 81 15.184 3.603 -5.125
608 HG3 LYS 81 HG1 LYS 81 13.573 2.912 -4.959
609 HD2 LYS 81 HD2 LYS 81 12.789 4.332 -6.814
610 HD3 LYS 81 HD1 LYS 81 14.413 4.991 -6.969
611 HE2 LYS 81 HE2 LYS 81 13.626 2.104 -7.327
612 HE3 LYS 81 HE1 LYS 81 14.049 3.238 -8.610
613 HZ1 LYS 81 HZ1 LYS 81 15.862 2.273 -6.460
614 HZ2 LYS 81 HZ2 LYS 81 16.268 3.425 -7.605
615 HZ3 LYS 81 HZ3 LYS 81 15.953 1.861 -8.084
616 H ILE 82 HN ILE 82 12.134 4.816 -1.339
617 HA ILE 82 HA ILE 82 12.128 7.656 -0.986
618 HB ILE 82 HB ILE 82 10.559 5.549 0.560
619 HG12 ILE 82 HG12 ILE 82 9.736 7.226 -1.834
620 HG13 ILE 82 HG11 ILE 82 10.107 5.508 -1.866
621 HG21 ILE 82 HG21 ILE 82 9.048 7.398 1.139
622 HG22 ILE 82 HG22 ILE 82 10.117 8.533 0.317
623 HG23 ILE 82 HG23 ILE 82 10.677 7.684 1.758
624 HD11 ILE 82 HD11 ILE 82 7.742 5.898 -1.926
625 HD12 ILE 82 HD12 ILE 82 7.824 6.799 -0.410
626 HD13 ILE 82 HD13 ILE 82 8.190 5.069 -0.434
627 H ALA 83 HN ALA 83 13.263 4.902 0.817
628 HA ALA 83 HA ALA 83 14.090 6.611 3.030
629 HB1 ALA 83 HB1 ALA 83 14.245 3.614 2.756
630 HB2 ALA 83 HB2 ALA 83 12.958 4.506 3.564
631 HB3 ALA 83 HB3 ALA 83 14.598 4.543 4.212
632 H GLY 84 HN GLY 84 15.497 4.535 0.516
633 HA2 GLY 84 HA2 GLY 84 17.572 4.633 -0.420
634 HA3 GLY 84 HA1 GLY 84 18.026 5.897 0.719
635 H LEU 85 HN LEU 85 17.630 2.461 0.286
636 HA LEU 85 HA LEU 85 19.305 2.077 2.693
637 HB2 LEU 85 HB2 LEU 85 16.850 0.393 2.173
638 HB3 LEU 85 HB1 LEU 85 18.005 0.171 3.453
639 HG LEU 85 HG LEU 85 16.250 2.607 3.175
640 HD11 LEU 85 HD11 LEU 85 14.935 0.600 3.580
641 HD12 LEU 85 HD12 LEU 85 14.962 1.634 5.010
642 HD13 LEU 85 HD13 LEU 85 15.964 0.182 4.949
643 HD21 LEU 85 HD21 LEU 85 17.993 1.623 5.437
644 HD22 LEU 85 HD22 LEU 85 16.933 3.028 5.496
645 HD23 LEU 85 HD23 LEU 85 18.323 3.020 4.412
646 H GLU 86 HN GLU 86 17.781 -0.272 0.472
647 HA GLU 86 HA GLU 86 19.897 -2.085 0.732
648 HB2 GLU 86 HB2 GLU 86 17.738 -1.970 -1.362
649 HB3 GLU 86 HB1 GLU 86 18.865 -3.309 -1.204
650 HG2 GLU 86 HG2 GLU 86 18.064 -3.631 1.132
651 HG3 GLU 86 HG1 GLU 86 16.861 -2.381 0.845
652 H HIS 87 HN HIS 87 19.322 0.208 -1.811
653 HA HIS 87 HA HIS 87 22.157 0.207 -2.470
654 HB2 HIS 87 HB2 HIS 87 19.967 -0.166 -4.564
655 HB3 HIS 87 HB1 HIS 87 21.601 0.333 -4.947
656 HD1 HIS 87 HD1 HIS 87 23.467 -1.553 -4.821
657 HD2 HIS 87 HD2 HIS 87 19.577 -2.855 -4.129
658 HE1 HIS 87 HE1 HIS 87 23.515 -4.052 -5.065
659 H HIS 88 HN HIS 88 19.025 1.323 -3.500
660 HA HIS 88 HA HIS 88 19.462 3.873 -2.319
661 HB2 HIS 88 HB2 HIS 88 20.062 4.148 -4.781
662 HB3 HIS 88 HB1 HIS 88 18.474 3.511 -5.189
663 HD1 HIS 88 HD1 HIS 88 20.036 6.530 -3.477
664 HD2 HIS 88 HD2 HIS 88 16.466 5.359 -5.244
665 HE1 HIS 88 HE1 HIS 88 18.602 8.599 -3.604
Start of MODEL 4
1 H1 MET 1 HT1 MET 1 11.739 11.394 10.105
2 H2 MET 1 HT2 MET 1 13.029 10.705 10.942
3 H3 MET 1 HT3 MET 1 11.436 10.161 11.187
4 HA MET 1 HA MET 1 12.849 9.997 8.619
5 HB2 MET 1 HB2 MET 1 12.383 7.890 10.738
6 HB3 MET 1 HB1 MET 1 12.745 7.481 9.072
7 HG2 MET 1 HG2 MET 1 14.869 8.734 9.279
8 HG3 MET 1 HG1 MET 1 14.504 9.000 10.983
9 HE1 MET 1 HE1 MET 1 17.190 7.685 9.862
10 HE2 MET 1 HE2 MET 1 17.411 6.378 11.027
11 HE3 MET 1 HE3 MET 1 16.872 7.965 11.576
12 H VAL 2 HN VAL 2 11.622 7.889 7.571
13 HA VAL 2 HA VAL 2 8.905 8.832 7.242
14 HB VAL 2 HB VAL 2 10.302 6.443 5.959
15 HG11 VAL 2 HG11 VAL 2 8.505 6.531 4.305
16 HG12 VAL 2 HG12 VAL 2 7.742 7.840 5.205
17 HG13 VAL 2 HG13 VAL 2 7.875 6.237 5.927
18 HG21 VAL 2 HG21 VAL 2 9.831 9.197 4.831
19 HG22 VAL 2 HG22 VAL 2 10.551 7.834 3.969
20 HG23 VAL 2 HG23 VAL 2 11.384 8.547 5.350
21 H THR 3 HN THR 3 7.564 8.548 8.571
22 HA THR 3 HA THR 3 7.665 6.444 10.479
23 HB THR 3 HB THR 3 5.433 8.394 10.205
24 HG1 THR 3 HG1 THR 3 8.180 8.961 10.845
25 HG21 THR 3 HG21 THR 3 5.652 6.834 12.085
26 HG22 THR 3 HG22 THR 3 5.842 8.537 12.595
27 HG23 THR 3 HG23 THR 3 7.268 7.501 12.361
28 H ALA 4 HN ALA 4 5.972 7.272 7.561
29 HA ALA 4 HA ALA 4 4.509 4.761 7.718
30 HB1 ALA 4 HB1 ALA 4 2.906 6.550 8.229
31 HB2 ALA 4 HB2 ALA 4 2.565 5.833 6.653
32 HB3 ALA 4 HB3 ALA 4 3.375 7.395 6.754
33 H ALA 5 HN ALA 5 5.904 3.772 6.396
34 HA ALA 5 HA ALA 5 7.117 4.832 4.112
35 HB1 ALA 5 HB1 ALA 5 7.591 2.482 3.533
36 HB2 ALA 5 HB2 ALA 5 6.458 1.958 4.783
37 HB3 ALA 5 HB3 ALA 5 7.923 2.826 5.229
38 H LEU 6 HN LEU 6 4.327 2.663 4.356
39 HA LEU 6 HA LEU 6 3.072 4.072 2.209
40 HB2 LEU 6 HB2 LEU 6 2.438 2.075 0.966
41 HB3 LEU 6 HB1 LEU 6 4.168 2.290 0.953
42 HG LEU 6 HG LEU 6 2.853 0.366 2.863
43 HD11 LEU 6 HD11 LEU 6 3.390 -1.378 1.174
44 HD12 LEU 6 HD12 LEU 6 3.638 -0.049 0.004
45 HD13 LEU 6 HD13 LEU 6 2.069 -0.299 0.745
46 HD21 LEU 6 HD21 LEU 6 5.038 -0.736 2.744
47 HD22 LEU 6 HD22 LEU 6 5.183 0.929 3.291
48 HD23 LEU 6 HD23 LEU 6 5.611 0.509 1.633
49 H THR 7 HN THR 7 1.028 4.217 2.434
50 HA THR 7 HA THR 7 -0.155 2.918 4.756
51 HB THR 7 HB THR 7 -1.251 5.249 3.173
52 HG1 THR 7 HG1 THR 7 0.159 5.440 5.629
53 HG21 THR 7 HG21 THR 7 -2.488 5.686 5.242
54 HG22 THR 7 HG22 THR 7 -1.709 4.299 6.004
55 HG23 THR 7 HG23 THR 7 -2.820 4.053 4.655
56 H ILE 8 HN ILE 8 -1.547 1.390 4.417
57 HA ILE 8 HA ILE 8 -2.449 0.757 1.736
58 HB ILE 8 HB ILE 8 -2.509 -0.769 4.335
59 HG12 ILE 8 HG12 ILE 8 -1.324 -1.415 1.652
60 HG13 ILE 8 HG11 ILE 8 -0.405 -0.806 3.041
61 HG21 ILE 8 HG21 ILE 8 -3.606 -2.634 3.178
62 HG22 ILE 8 HG22 ILE 8 -3.896 -1.575 1.785
63 HG23 ILE 8 HG23 ILE 8 -4.613 -1.202 3.361
64 HD11 ILE 8 HD11 ILE 8 -0.113 -3.179 2.733
65 HD12 ILE 8 HD12 ILE 8 -1.858 -3.431 2.784
66 HD13 ILE 8 HD13 ILE 8 -0.999 -2.875 4.226
67 H TYR 9 HN TYR 9 -4.234 1.519 1.020
68 HA TYR 9 HA TYR 9 -6.466 2.049 2.834
69 HB2 TYR 9 HB2 TYR 9 -5.920 2.962 0.005
70 HB3 TYR 9 HB1 TYR 9 -7.416 3.272 0.874
71 HD1 TYR 9 HD2 TYR 9 -7.215 4.558 3.078
72 HD2 TYR 9 HD1 TYR 9 -4.155 4.482 0.140
73 HE1 TYR 9 HE2 TYR 9 -6.287 6.596 4.025
74 HE2 TYR 9 HE1 TYR 9 -3.196 6.535 1.083
75 HH TYR 9 HH TYR 9 -4.033 7.698 4.119
76 H THR 10 HN THR 10 -7.765 0.387 3.053
77 HA THR 10 HA THR 10 -8.952 -0.846 0.794
78 HB THR 10 HB THR 10 -6.721 -2.151 0.990
79 HG1 THR 10 HG1 THR 10 -8.580 -3.134 0.135
80 HG21 THR 10 HG21 THR 10 -6.526 -1.967 3.447
81 HG22 THR 10 HG22 THR 10 -6.437 -3.635 2.881
82 HG23 THR 10 HG23 THR 10 -7.921 -3.032 3.614
83 H THR 11 HN THR 11 -10.220 -2.865 1.886
84 HA THR 11 HA THR 11 -11.027 -2.203 4.554
85 HB THR 11 HB THR 11 -13.413 -3.030 3.392
86 HG1 THR 11 HG1 THR 11 -12.411 -2.565 1.316
87 HG21 THR 11 HG21 THR 11 -12.485 -0.210 3.947
88 HG22 THR 11 HG22 THR 11 -13.145 -1.319 5.137
89 HG23 THR 11 HG23 THR 11 -14.164 -0.727 3.822
90 H SER 12 HN SER 12 -11.990 -4.017 5.647
91 HA SER 12 HA SER 12 -10.433 -6.272 5.454
92 HB2 SER 12 HB2 SER 12 -11.660 -5.455 7.464
93 HB3 SER 12 HB1 SER 12 -13.150 -6.067 6.762
94 HG SER 12 HG SER 12 -12.649 -7.990 7.363
95 H TRP 13 HN TRP 13 -13.447 -5.669 3.811
96 HA TRP 13 HA TRP 13 -13.937 -8.425 3.214
97 HB2 TRP 13 HB2 TRP 13 -15.746 -7.565 1.721
98 HB3 TRP 13 HB1 TRP 13 -15.857 -7.020 3.388
99 HD1 TRP 13 HD1 TRP 13 -15.690 -4.462 3.835
100 HE1 TRP 13 HE1 TRP 13 -15.714 -2.385 2.327
101 HE3 TRP 13 HE3 TRP 13 -14.927 -6.714 -0.696
102 HZ2 TRP 13 HZ2 TRP 13 -15.447 -1.765 -0.408
103 HZ3 TRP 13 HZ3 TRP 13 -14.828 -5.301 -2.705
104 HH2 TRP 13 HH2 TRP 13 -15.079 -2.882 -2.565
105 H CYS 14 HN CYS 14 -11.852 -6.139 1.844
106 HA CYS 14 HA CYS 14 -12.042 -6.947 -0.883
107 HB2 CYS 14 HB2 CYS 14 -9.782 -5.556 0.571
108 HB3 CYS 14 HB1 CYS 14 -9.972 -5.656 -1.173
109 HG CYS 14 HG CYS 14 -12.009 -3.949 -1.407
110 H GLY 15 HN GLY 15 -11.394 -8.821 -1.656
111 HA2 GLY 15 HA2 GLY 15 -10.103 -10.831 -0.246
112 HA3 GLY 15 HA1 GLY 15 -10.258 -10.773 -1.993
113 H TYR 16 HN TYR 16 -8.678 -8.543 -2.539
114 HA TYR 16 HA TYR 16 -6.156 -9.797 -2.260
115 HB2 TYR 16 HB2 TYR 16 -6.950 -7.306 -3.697
116 HB3 TYR 16 HB1 TYR 16 -5.237 -7.738 -3.534
117 HD1 TYR 16 HD1 TYR 16 -5.265 -10.613 -3.961
118 HD2 TYR 16 HD2 TYR 16 -7.563 -7.598 -5.891
119 HE1 TYR 16 HE1 TYR 16 -5.518 -12.064 -5.920
120 HE2 TYR 16 HE2 TYR 16 -7.835 -9.049 -7.839
121 HH TYR 16 HH TYR 16 -7.022 -12.359 -7.743
122 H CYS 17 HN CYS 17 -7.703 -7.826 -0.133
123 HA CYS 17 HA CYS 17 -5.607 -6.197 0.838
124 HB2 CYS 17 HB2 CYS 17 -7.845 -5.738 1.555
125 HB3 CYS 17 HB1 CYS 17 -8.057 -7.374 2.162
126 HG CYS 17 HG CYS 17 -7.898 -5.407 4.211
127 H LEU 18 HN LEU 18 -6.944 -9.184 2.118
128 HA LEU 18 HA LEU 18 -4.781 -9.687 3.856
129 HB2 LEU 18 HB2 LEU 18 -5.999 -11.895 4.197
130 HB3 LEU 18 HB1 LEU 18 -6.839 -10.424 4.627
131 HG LEU 18 HG LEU 18 -7.991 -10.601 2.353
132 HD11 LEU 18 HD11 LEU 18 -6.577 -12.143 1.280
133 HD12 LEU 18 HD12 LEU 18 -8.200 -12.832 1.406
134 HD13 LEU 18 HD13 LEU 18 -6.908 -13.386 2.486
135 HD21 LEU 18 HD21 LEU 18 -9.651 -12.172 3.200
136 HD22 LEU 18 HD22 LEU 18 -9.125 -10.995 4.405
137 HD23 LEU 18 HD23 LEU 18 -8.523 -12.655 4.473
138 H ARG 19 HN ARG 19 -5.349 -10.439 0.624
139 HA ARG 19 HA ARG 19 -3.608 -12.674 0.416
140 HB2 ARG 19 HB2 ARG 19 -5.348 -12.225 -1.274
141 HB3 ARG 19 HB1 ARG 19 -4.543 -10.719 -1.673
142 HG2 ARG 19 HG2 ARG 19 -4.120 -12.404 -3.382
143 HG3 ARG 19 HG1 ARG 19 -2.634 -11.933 -2.571
144 HD2 ARG 19 HD2 ARG 19 -4.214 -14.407 -1.870
145 HD3 ARG 19 HD1 ARG 19 -2.886 -14.394 -3.028
146 HE ARG 19 HE ARG 19 -1.866 -13.272 -0.753
147 HH11 ARG 19 HH11 ARG 19 -3.240 -16.405 -1.636
148 HH12 ARG 19 HH12 ARG 19 -2.446 -17.254 -0.393
149 HH21 ARG 19 HH21 ARG 19 -0.792 -14.424 0.973
150 HH22 ARG 19 HH22 ARG 19 -1.028 -16.110 1.104
151 H LEU 20 HN LEU 20 -3.217 -9.176 0.088
152 HA LEU 20 HA LEU 20 -0.517 -9.483 -0.808
153 HB2 LEU 20 HB2 LEU 20 -1.996 -7.690 -1.648
154 HB3 LEU 20 HB1 LEU 20 -2.054 -7.016 -0.042
155 HG LEU 20 HG LEU 20 0.374 -6.683 -0.135
156 HD11 LEU 20 HD11 LEU 20 1.458 -6.610 -2.375
157 HD12 LEU 20 HD12 LEU 20 0.086 -7.532 -2.997
158 HD13 LEU 20 HD13 LEU 20 1.128 -8.218 -1.752
159 HD21 LEU 20 HD21 LEU 20 -1.100 -4.819 -0.528
160 HD22 LEU 20 HD22 LEU 20 -1.267 -5.257 -2.228
161 HD23 LEU 20 HD23 LEU 20 0.285 -4.689 -1.609
162 H LYS 21 HN LYS 21 -2.139 -9.024 2.200
163 HA LYS 21 HA LYS 21 -0.266 -7.747 3.818
164 HB2 LYS 21 HB2 LYS 21 -2.108 -10.017 4.579
165 HB3 LYS 21 HB1 LYS 21 -1.258 -8.993 5.722
166 HG2 LYS 21 HG2 LYS 21 -3.238 -7.976 3.707
167 HG3 LYS 21 HG1 LYS 21 -3.652 -8.422 5.365
168 HD2 LYS 21 HD2 LYS 21 -2.187 -6.699 6.226
169 HD3 LYS 21 HD1 LYS 21 -1.631 -6.312 4.594
170 HE2 LYS 21 HE2 LYS 21 -3.707 -5.458 3.968
171 HE3 LYS 21 HE1 LYS 21 -4.533 -6.135 5.378
172 HZ1 LYS 21 HZ1 LYS 21 -2.575 -3.891 5.334
173 HZ2 LYS 21 HZ2 LYS 21 -3.218 -4.582 6.732
174 HZ3 LYS 21 HZ3 LYS 21 -4.241 -3.823 5.651
175 H THR 22 HN THR 22 -0.435 -11.176 2.970
176 HA THR 22 HA THR 22 1.620 -11.994 4.704
177 HB THR 22 HB THR 22 1.581 -14.081 3.290
178 HG1 THR 22 HG1 THR 22 0.973 -13.455 1.292
179 HG21 THR 22 HG21 THR 22 -1.083 -12.988 4.212
180 HG22 THR 22 HG22 THR 22 0.087 -13.851 5.214
181 HG23 THR 22 HG23 THR 22 -0.741 -14.685 3.896
182 H ALA 23 HN ALA 23 1.546 -10.886 1.397
183 HA ALA 23 HA ALA 23 4.155 -11.698 0.676
184 HB1 ALA 23 HB1 ALA 23 2.398 -11.208 -0.973
185 HB2 ALA 23 HB2 ALA 23 3.862 -10.270 -1.273
186 HB3 ALA 23 HB3 ALA 23 2.464 -9.506 -0.518
187 H LEU 24 HN LEU 24 2.804 -8.668 1.846
188 HA LEU 24 HA LEU 24 5.241 -7.217 1.759
189 HB2 LEU 24 HB2 LEU 24 2.837 -6.794 3.515
190 HB3 LEU 24 HB1 LEU 24 4.136 -5.646 3.343
191 HG LEU 24 HG LEU 24 2.185 -6.454 1.175
192 HD11 LEU 24 HD11 LEU 24 2.495 -3.961 2.831
193 HD12 LEU 24 HD12 LEU 24 1.146 -5.079 2.903
194 HD13 LEU 24 HD13 LEU 24 1.413 -4.081 1.460
195 HD21 LEU 24 HD21 LEU 24 4.449 -4.456 1.171
196 HD22 LEU 24 HD22 LEU 24 3.143 -4.436 0.021
197 HD23 LEU 24 HD23 LEU 24 4.225 -5.818 0.057
198 H THR 25 HN THR 25 3.699 -9.075 4.323
199 HA THR 25 HA THR 25 5.538 -8.485 6.335
200 HB THR 25 HB THR 25 3.862 -10.976 5.957
201 HG1 THR 25 HG1 THR 25 2.349 -9.505 6.081
202 HG21 THR 25 HG21 THR 25 5.563 -11.199 7.748
203 HG22 THR 25 HG22 THR 25 3.935 -11.115 8.422
204 HG23 THR 25 HG23 THR 25 4.983 -9.700 8.475
205 H ALA 26 HN ALA 26 5.425 -11.213 4.015
206 HA ALA 26 HA ALA 26 7.707 -12.569 4.916
207 HB1 ALA 26 HB1 ALA 26 6.588 -12.449 2.116
208 HB2 ALA 26 HB2 ALA 26 6.059 -13.549 3.387
209 HB3 ALA 26 HB3 ALA 26 7.692 -13.677 2.737
210 H ASN 27 HN ASN 27 7.336 -9.825 2.830
211 HA ASN 27 HA ASN 27 10.136 -9.870 2.111
212 HB2 ASN 27 HB2 ASN 27 7.820 -8.279 1.094
213 HB3 ASN 27 HB1 ASN 27 9.472 -7.770 0.755
214 HD21 ASN 27 HD21 ASN 27 7.101 -10.259 0.287
215 HD22 ASN 27 HD22 ASN 27 7.875 -11.060 -1.024
216 H ARG 28 HN ARG 28 8.766 -9.033 4.798
217 HA ARG 28 HA ARG 28 9.375 -7.764 6.591
218 HB2 ARG 28 HB2 ARG 28 11.837 -7.241 4.922
219 HB3 ARG 28 HB1 ARG 28 11.694 -6.892 6.636
220 HG2 ARG 28 HG2 ARG 28 11.515 -9.221 7.153
221 HG3 ARG 28 HG1 ARG 28 11.444 -9.642 5.442
222 HD2 ARG 28 HD2 ARG 28 13.766 -8.341 6.852
223 HD3 ARG 28 HD1 ARG 28 13.679 -10.043 6.387
224 HE ARG 28 HE ARG 28 13.383 -8.045 4.297
225 HH11 ARG 28 HH11 ARG 28 15.585 -10.367 5.884
226 HH12 ARG 28 HH12 ARG 28 16.616 -10.447 4.530
227 HH21 ARG 28 HH21 ARG 28 14.817 -8.172 2.518
228 HH22 ARG 28 HH22 ARG 28 16.196 -9.186 2.607
229 H ILE 29 HN ILE 29 7.793 -6.526 4.521
230 HA ILE 29 HA ILE 29 8.823 -3.829 4.294
231 HB ILE 29 HB ILE 29 6.215 -4.992 3.258
232 HG12 ILE 29 HG12 ILE 29 8.789 -4.428 1.748
233 HG13 ILE 29 HG11 ILE 29 8.308 -6.028 2.304
234 HG21 ILE 29 HG21 ILE 29 7.646 -2.410 2.564
235 HG22 ILE 29 HG22 ILE 29 6.247 -2.531 3.603
236 HG23 ILE 29 HG23 ILE 29 6.101 -2.957 1.887
237 HD11 ILE 29 HD11 ILE 29 6.332 -5.845 0.843
238 HD12 ILE 29 HD12 ILE 29 7.865 -5.779 -0.005
239 HD13 ILE 29 HD13 ILE 29 6.944 -4.291 0.266
240 H ALA 30 HN ALA 30 8.214 -2.206 5.501
241 HA ALA 30 HA ALA 30 6.356 -2.646 7.685
242 HB1 ALA 30 HB1 ALA 30 8.537 -1.683 8.158
243 HB2 ALA 30 HB2 ALA 30 7.265 -0.484 8.464
244 HB3 ALA 30 HB3 ALA 30 8.221 -0.419 6.975
245 H TYR 31 HN TYR 31 4.310 -1.892 7.532
246 HA TYR 31 HA TYR 31 3.800 0.376 5.791
247 HB2 TYR 31 HB2 TYR 31 1.885 -0.750 4.729
248 HB3 TYR 31 HB1 TYR 31 3.407 -1.538 4.344
249 HD1 TYR 31 HD2 TYR 31 3.886 -3.786 5.210
250 HD2 TYR 31 HD1 TYR 31 0.189 -1.862 6.062
251 HE1 TYR 31 HE2 TYR 31 2.919 -5.947 5.889
252 HE2 TYR 31 HE1 TYR 31 -0.785 -4.019 6.734
253 HH TYR 31 HH TYR 31 1.129 -6.827 7.173
254 H ASP 32 HN ASP 32 1.653 1.266 6.109
255 HA ASP 32 HA ASP 32 0.574 0.618 8.763
256 HB2 ASP 32 HB2 ASP 32 1.717 2.834 8.781
257 HB3 ASP 32 HB1 ASP 32 0.700 3.344 7.444
258 H GLU 33 HN GLU 33 -1.552 0.254 8.812
259 HA GLU 33 HA GLU 33 -2.987 0.673 6.293
260 HB2 GLU 33 HB2 GLU 33 -4.388 -1.246 6.936
261 HB3 GLU 33 HB1 GLU 33 -2.706 -1.682 6.675
262 HG2 GLU 33 HG2 GLU 33 -2.380 -1.691 9.134
263 HG3 GLU 33 HG1 GLU 33 -4.102 -1.362 9.328
264 H VAL 34 HN VAL 34 -4.958 1.620 6.370
265 HA VAL 34 HA VAL 34 -6.031 2.301 8.975
266 HB VAL 34 HB VAL 34 -4.638 4.222 8.162
267 HG11 VAL 34 HG11 VAL 34 -5.345 5.582 6.284
268 HG12 VAL 34 HG12 VAL 34 -6.550 4.370 5.873
269 HG13 VAL 34 HG13 VAL 34 -4.819 3.967 5.807
270 HG21 VAL 34 HG21 VAL 34 -7.592 4.788 8.248
271 HG22 VAL 34 HG22 VAL 34 -6.320 5.998 8.418
272 HG23 VAL 34 HG23 VAL 34 -6.480 4.713 9.615
273 H ASP 35 HN ASP 35 -8.362 2.603 8.851
274 HA ASP 35 HA ASP 35 -9.403 0.953 6.703
275 HB2 ASP 35 HB2 ASP 35 -10.199 0.523 8.931
276 HB3 ASP 35 HB1 ASP 35 -10.693 2.200 9.125
277 H ILE 36 HN ILE 36 -10.645 1.594 5.099
278 HA ILE 36 HA ILE 36 -10.894 4.421 4.670
279 HB ILE 36 HB ILE 36 -11.571 3.929 2.387
280 HG12 ILE 36 HG12 ILE 36 -11.142 1.031 3.138
281 HG13 ILE 36 HG11 ILE 36 -12.723 1.751 2.833
282 HG21 ILE 36 HG21 ILE 36 -9.115 2.576 3.461
283 HG22 ILE 36 HG22 ILE 36 -9.256 4.221 2.823
284 HG23 ILE 36 HG23 ILE 36 -9.396 2.827 1.749
285 HD11 ILE 36 HD11 ILE 36 -11.950 0.479 0.920
286 HD12 ILE 36 HD12 ILE 36 -10.473 1.434 0.853
287 HD13 ILE 36 HD13 ILE 36 -12.029 2.194 0.516
288 H GLU 37 HN GLU 37 -12.972 1.988 5.816
289 HA GLU 37 HA GLU 37 -15.357 2.950 4.583
290 HB2 GLU 37 HB2 GLU 37 -14.798 0.603 5.620
291 HB3 GLU 37 HB1 GLU 37 -15.324 1.354 7.117
292 HG2 GLU 37 HG2 GLU 37 -17.167 0.161 6.179
293 HG3 GLU 37 HG1 GLU 37 -17.485 1.891 6.019
294 H HIS 38 HN HIS 38 -13.831 3.274 7.713
295 HA HIS 38 HA HIS 38 -15.840 4.985 8.854
296 HB2 HIS 38 HB2 HIS 38 -14.366 3.462 10.165
297 HB3 HIS 38 HB1 HIS 38 -12.987 4.451 9.727
298 HD1 HIS 38 HD1 HIS 38 -15.773 4.210 12.168
299 HD2 HIS 38 HD2 HIS 38 -12.914 6.995 11.006
300 HE1 HIS 38 HE1 HIS 38 -15.694 5.934 13.997
301 H ASN 39 HN ASN 39 -13.032 5.441 6.934
302 HA ASN 39 HA ASN 39 -12.898 8.315 7.525
303 HB2 ASN 39 HB2 ASN 39 -10.891 6.400 6.339
304 HB3 ASN 39 HB1 ASN 39 -10.663 8.143 6.317
305 HD21 ASN 39 HD21 ASN 39 -9.394 5.754 7.696
306 HD22 ASN 39 HD22 ASN 39 -9.217 6.247 9.338
307 H ARG 40 HN ARG 40 -14.469 9.115 6.251
308 HA ARG 40 HA ARG 40 -15.263 8.207 3.747
309 HB2 ARG 40 HB2 ARG 40 -16.621 9.713 5.157
310 HB3 ARG 40 HB1 ARG 40 -15.530 11.039 4.774
311 HG2 ARG 40 HG2 ARG 40 -16.117 10.793 2.388
312 HG3 ARG 40 HG1 ARG 40 -17.258 9.528 2.819
313 HD2 ARG 40 HD2 ARG 40 -18.464 11.581 2.526
314 HD3 ARG 40 HD1 ARG 40 -18.471 11.161 4.235
315 HE ARG 40 HE ARG 40 -16.382 12.819 4.111
316 HH11 ARG 40 HH11 ARG 40 -19.652 13.189 2.785
317 HH12 ARG 40 HH12 ARG 40 -19.624 14.892 2.862
318 HH21 ARG 40 HH21 ARG 40 -16.409 15.160 4.250
319 HH22 ARG 40 HH22 ARG 40 -17.790 16.012 3.722
320 H ALA 41 HN ALA 41 -12.900 10.748 4.503
321 HA ALA 41 HA ALA 41 -12.619 11.523 1.777
322 HB1 ALA 41 HB1 ALA 41 -10.782 12.925 2.535
323 HB2 ALA 41 HB2 ALA 41 -10.764 12.099 4.090
324 HB3 ALA 41 HB3 ALA 41 -12.155 13.075 3.630
325 H ALA 42 HN ALA 42 -11.033 9.223 3.843
326 HA ALA 42 HA ALA 42 -8.860 8.730 2.079
327 HB1 ALA 42 HB1 ALA 42 -10.007 6.903 4.200
328 HB2 ALA 42 HB2 ALA 42 -8.727 8.096 4.452
329 HB3 ALA 42 HB3 ALA 42 -8.455 6.722 3.380
330 H ALA 43 HN ALA 43 -12.012 7.238 2.612
331 HA ALA 43 HA ALA 43 -11.807 5.191 0.690
332 HB1 ALA 43 HB1 ALA 43 -14.275 6.654 1.615
333 HB2 ALA 43 HB2 ALA 43 -13.563 5.246 2.400
334 HB3 ALA 43 HB3 ALA 43 -14.247 5.102 0.782
335 H GLU 44 HN GLU 44 -12.781 8.524 0.483
336 HA GLU 44 HA GLU 44 -13.693 8.551 -2.173
337 HB2 GLU 44 HB2 GLU 44 -13.996 10.340 -0.430
338 HB3 GLU 44 HB1 GLU 44 -12.309 10.771 -0.660
339 HG2 GLU 44 HG2 GLU 44 -13.715 12.279 -1.877
340 HG3 GLU 44 HG1 GLU 44 -12.784 11.287 -3.005
341 H PHE 45 HN PHE 45 -10.568 9.239 -0.715
342 HA PHE 45 HA PHE 45 -9.080 9.817 -2.997
343 HB2 PHE 45 HB2 PHE 45 -8.302 10.347 -0.760
344 HB3 PHE 45 HB1 PHE 45 -8.245 8.643 -0.340
345 HD1 PHE 45 HD2 PHE 45 -6.761 11.163 -2.620
346 HD2 PHE 45 HD1 PHE 45 -6.270 7.442 -0.609
347 HE1 PHE 45 HE2 PHE 45 -4.407 11.102 -3.320
348 HE2 PHE 45 HE1 PHE 45 -3.915 7.378 -1.305
349 HZ PHE 45 HZ PHE 45 -2.981 9.210 -2.662
350 H VAL 46 HN VAL 46 -9.184 6.733 -1.192
351 HA VAL 46 HA VAL 46 -7.654 5.360 -3.117
352 HB VAL 46 HB VAL 46 -7.693 4.493 -0.866
353 HG11 VAL 46 HG11 VAL 46 -9.812 5.090 -0.112
354 HG12 VAL 46 HG12 VAL 46 -9.654 3.308 -0.061
355 HG13 VAL 46 HG13 VAL 46 -10.593 4.077 -1.352
356 HG21 VAL 46 HG21 VAL 46 -8.005 2.196 -1.190
357 HG22 VAL 46 HG22 VAL 46 -7.472 2.876 -2.747
358 HG23 VAL 46 HG23 VAL 46 -9.183 2.482 -2.458
359 H GLY 47 HN GLY 47 -11.088 5.879 -2.862
360 HA2 GLY 47 HA2 GLY 47 -11.861 3.929 -4.762
361 HA3 GLY 47 HA1 GLY 47 -12.814 5.311 -4.240
362 H SER 48 HN SER 48 -10.847 7.297 -5.027
363 HA SER 48 HA SER 48 -11.624 7.364 -7.780
364 HB2 SER 48 HB2 SER 48 -10.630 9.695 -7.689
365 HB3 SER 48 HB1 SER 48 -11.999 9.386 -6.621
366 HG SER 48 HG SER 48 -10.714 9.393 -4.911
367 H VAL 49 HN VAL 49 -8.710 6.745 -6.040
368 HA VAL 49 HA VAL 49 -7.120 7.025 -8.455
369 HB VAL 49 HB VAL 49 -5.180 6.442 -7.101
370 HG11 VAL 49 HG11 VAL 49 -7.035 8.331 -5.719
371 HG12 VAL 49 HG12 VAL 49 -5.932 8.741 -7.041
372 HG13 VAL 49 HG13 VAL 49 -5.291 8.265 -5.450
373 HG21 VAL 49 HG21 VAL 49 -5.406 5.986 -4.676
374 HG22 VAL 49 HG22 VAL 49 -6.179 4.735 -5.664
375 HG23 VAL 49 HG23 VAL 49 -7.157 5.975 -4.885
376 H ASN 50 HN ASN 50 -9.024 4.698 -7.105
377 HA ASN 50 HA ASN 50 -7.514 2.351 -7.519
378 HB2 ASN 50 HB2 ASN 50 -9.900 2.997 -6.339
379 HB3 ASN 50 HB1 ASN 50 -10.396 2.021 -7.720
380 HD21 ASN 50 HD21 ASN 50 -8.395 2.212 -5.149
381 HD22 ASN 50 HD22 ASN 50 -8.245 0.545 -4.646
382 H GLY 51 HN GLY 51 -8.357 0.641 -9.183
383 HA2 GLY 51 HA2 GLY 51 -8.708 1.900 -11.768
384 HA3 GLY 51 HA1 GLY 51 -8.456 0.184 -11.472
385 H GLY 52 HN GLY 52 -10.845 2.698 -10.831
386 HA2 GLY 52 HA2 GLY 52 -13.033 2.400 -11.969
387 HA3 GLY 52 HA1 GLY 52 -13.000 0.740 -11.380
388 H ASN 53 HN ASN 53 -13.358 0.349 -9.192
389 HA ASN 53 HA ASN 53 -14.226 2.665 -7.573
390 HB2 ASN 53 HB2 ASN 53 -15.860 1.272 -6.453
391 HB3 ASN 53 HB1 ASN 53 -16.174 1.141 -8.186
392 HD21 ASN 53 HD21 ASN 53 -15.743 -0.882 -9.192
393 HD22 ASN 53 HD22 ASN 53 -15.527 -2.316 -8.270
394 H ARG 54 HN ARG 54 -14.118 2.033 -5.252
395 HA ARG 54 HA ARG 54 -11.481 1.435 -4.384
396 HB2 ARG 54 HB2 ARG 54 -12.583 1.361 -2.123
397 HB3 ARG 54 HB1 ARG 54 -12.920 2.810 -3.071
398 HG2 ARG 54 HG2 ARG 54 -15.104 1.988 -3.673
399 HG3 ARG 54 HG1 ARG 54 -14.753 0.428 -2.953
400 HD2 ARG 54 HD2 ARG 54 -14.820 2.996 -1.436
401 HD3 ARG 54 HD1 ARG 54 -16.213 1.927 -1.665
402 HE ARG 54 HE ARG 54 -13.929 0.556 -0.650
403 HH11 ARG 54 HH11 ARG 54 -16.586 2.651 0.458
404 HH12 ARG 54 HH12 ARG 54 -16.755 1.891 1.976
405 HH21 ARG 54 HH21 ARG 54 -14.162 -0.484 1.506
406 HH22 ARG 54 HH22 ARG 54 -15.410 0.097 2.533
407 H THR 55 HN THR 55 -11.876 -0.764 -5.845
408 HA THR 55 HA THR 55 -13.004 -2.879 -4.249
409 HB THR 55 HB THR 55 -13.563 -2.785 -6.620
410 HG1 THR 55 HG1 THR 55 -11.961 -5.029 -5.951
411 HG21 THR 55 HG21 THR 55 -10.617 -3.257 -7.112
412 HG22 THR 55 HG22 THR 55 -11.538 -1.819 -7.548
413 HG23 THR 55 HG23 THR 55 -11.871 -3.357 -8.345
414 H VAL 56 HN VAL 56 -9.789 -1.752 -5.190
415 HA VAL 56 HA VAL 56 -8.768 -4.027 -3.676
416 HB VAL 56 HB VAL 56 -6.707 -3.966 -5.013
417 HG11 VAL 56 HG11 VAL 56 -8.371 -5.694 -5.400
418 HG12 VAL 56 HG12 VAL 56 -7.639 -5.242 -6.941
419 HG13 VAL 56 HG13 VAL 56 -9.245 -4.651 -6.519
420 HG21 VAL 56 HG21 VAL 56 -6.774 -2.994 -7.297
421 HG22 VAL 56 HG22 VAL 56 -6.845 -1.780 -6.023
422 HG23 VAL 56 HG23 VAL 56 -8.312 -2.234 -6.890
423 HA PRO 57 HA PRO 57 -6.449 -1.477 -0.944
424 HB2 PRO 57 HB2 PRO 57 -4.051 -2.892 -0.988
425 HB3 PRO 57 HB1 PRO 57 -5.414 -3.282 0.057
426 HG2 PRO 57 HG2 PRO 57 -4.634 -4.469 -2.562
427 HG3 PRO 57 HG1 PRO 57 -5.272 -5.270 -1.114
428 HD2 PRO 57 HD2 PRO 57 -6.840 -4.797 -3.207
429 HD3 PRO 57 HD1 PRO 57 -7.464 -4.578 -1.554
430 H THR 58 HN THR 58 -5.660 0.373 -1.481
431 HA THR 58 HA THR 58 -3.761 0.529 -3.674
432 HB THR 58 HB THR 58 -5.301 2.758 -2.321
433 HG1 THR 58 HG1 THR 58 -6.180 0.866 -3.828
434 HG21 THR 58 HG21 THR 58 -3.829 2.671 -4.963
435 HG22 THR 58 HG22 THR 58 -3.222 3.427 -3.486
436 HG23 THR 58 HG23 THR 58 -4.670 4.059 -4.267
437 H VAL 59 HN VAL 59 -1.689 1.163 -3.132
438 HA VAL 59 HA VAL 59 -1.247 1.774 -0.321
439 HB VAL 59 HB VAL 59 1.136 1.140 -0.717
440 HG11 VAL 59 HG11 VAL 59 -0.926 -0.943 -1.423
441 HG12 VAL 59 HG12 VAL 59 -0.352 -0.509 0.194
442 HG13 VAL 59 HG13 VAL 59 0.734 -1.295 -0.947
443 HG21 VAL 59 HG21 VAL 59 1.210 1.595 -3.110
444 HG22 VAL 59 HG22 VAL 59 0.136 0.218 -3.401
445 HG23 VAL 59 HG23 VAL 59 1.757 -0.046 -2.747
446 H LYS 60 HN LYS 60 -0.712 3.700 0.245
447 HA LYS 60 HA LYS 60 0.138 5.627 -1.823
448 HB2 LYS 60 HB2 LYS 60 -1.895 6.158 -0.384
449 HB3 LYS 60 HB1 LYS 60 -0.796 6.183 0.975
450 HG2 LYS 60 HG2 LYS 60 0.544 7.941 -0.254
451 HG3 LYS 60 HG1 LYS 60 -0.809 8.057 -1.374
452 HD2 LYS 60 HD2 LYS 60 -1.050 9.776 0.266
453 HD3 LYS 60 HD1 LYS 60 -2.282 8.557 0.581
454 HE2 LYS 60 HE2 LYS 60 -1.261 9.281 2.653
455 HE3 LYS 60 HE1 LYS 60 -0.862 7.593 2.363
456 HZ1 LYS 60 HZ1 LYS 60 0.893 9.945 1.921
457 HZ2 LYS 60 HZ2 LYS 60 1.372 8.367 1.555
458 HZ3 LYS 60 HZ3 LYS 60 1.061 8.807 3.138
459 H PHE 61 HN PHE 61 2.204 6.227 -1.740
460 HA PHE 61 HA PHE 61 3.767 5.374 0.551
461 HB2 PHE 61 HB2 PHE 61 4.576 6.436 -2.149
462 HB3 PHE 61 HB1 PHE 61 5.723 6.085 -0.859
463 HD1 PHE 61 HD2 PHE 61 3.069 4.538 -2.936
464 HD2 PHE 61 HD1 PHE 61 6.558 3.933 -0.582
465 HE1 PHE 61 HE2 PHE 61 3.120 2.207 -3.629
466 HE2 PHE 61 HE1 PHE 61 6.615 1.573 -1.285
467 HZ PHE 61 HZ PHE 61 4.909 0.710 -2.806
468 H ALA 62 HN ALA 62 5.677 6.981 0.965
469 HA ALA 62 HA ALA 62 4.541 9.201 2.312
470 HB1 ALA 62 HB1 ALA 62 6.513 7.998 3.138
471 HB2 ALA 62 HB2 ALA 62 6.811 9.731 2.991
472 HB3 ALA 62 HB3 ALA 62 7.451 8.619 1.779
473 H ASP 63 HN ASP 63 5.431 8.839 -0.893
474 HA ASP 63 HA ASP 63 6.116 11.621 -1.309
475 HB2 ASP 63 HB2 ASP 63 6.506 11.020 -3.623
476 HB3 ASP 63 HB1 ASP 63 7.274 9.816 -2.604
477 H GLY 64 HN GLY 64 3.396 9.768 -0.971
478 HA2 GLY 64 HA2 GLY 64 1.188 10.482 -0.984
479 HA3 GLY 64 HA1 GLY 64 1.686 11.923 -1.869
480 H SER 65 HN SER 65 2.944 9.117 -3.275
481 HA SER 65 HA SER 65 0.890 9.295 -5.304
482 HB2 SER 65 HB2 SER 65 3.229 9.645 -6.012
483 HB3 SER 65 HB1 SER 65 3.648 8.050 -5.398
484 HG SER 65 HG SER 65 2.198 8.786 -7.664
485 H THR 66 HN THR 66 0.002 7.342 -6.151
486 HA THR 66 HA THR 66 -0.027 5.179 -4.181
487 HB THR 66 HB THR 66 -2.338 4.745 -5.040
488 HG1 THR 66 HG1 THR 66 -2.125 7.364 -6.137
489 HG21 THR 66 HG21 THR 66 -3.376 6.577 -3.764
490 HG22 THR 66 HG22 THR 66 -1.818 7.418 -3.741
491 HG23 THR 66 HG23 THR 66 -1.998 5.848 -2.945
492 H LEU 67 HN LEU 67 -0.085 3.103 -4.937
493 HA LEU 67 HA LEU 67 0.041 2.719 -7.843
494 HB2 LEU 67 HB2 LEU 67 1.461 1.012 -5.753
495 HB3 LEU 67 HB1 LEU 67 1.425 0.696 -7.464
496 HG LEU 67 HG LEU 67 2.828 3.016 -6.123
497 HD11 LEU 67 HD11 LEU 67 3.995 0.626 -7.554
498 HD12 LEU 67 HD12 LEU 67 3.880 0.750 -5.814
499 HD13 LEU 67 HD13 LEU 67 4.880 1.900 -6.708
500 HD21 LEU 67 HD21 LEU 67 3.780 3.432 -8.331
501 HD22 LEU 67 HD22 LEU 67 2.027 3.646 -8.325
502 HD23 LEU 67 HD23 LEU 67 2.739 2.187 -9.021
503 H THR 68 HN THR 68 -1.637 1.547 -8.558
504 HA THR 68 HA THR 68 -3.587 0.464 -6.818
505 HB THR 68 HB THR 68 -3.168 -0.219 -9.740
506 HG1 THR 68 HG1 THR 68 -3.842 1.683 -10.252
507 HG21 THR 68 HG21 THR 68 -4.936 -1.465 -8.575
508 HG22 THR 68 HG22 THR 68 -5.640 -0.339 -9.740
509 HG23 THR 68 HG23 THR 68 -5.641 0.050 -8.017
510 H ASN 69 HN ASN 69 -3.990 -1.773 -6.450
511 HA ASN 69 HA ASN 69 -2.640 -3.473 -5.246
512 HB2 ASN 69 HB2 ASN 69 -4.795 -4.075 -6.355
513 HB3 ASN 69 HB1 ASN 69 -3.886 -4.549 -7.767
514 HD21 ASN 69 HD21 ASN 69 -4.790 -6.685 -7.545
515 HD22 ASN 69 HD22 ASN 69 -4.097 -7.774 -6.407
516 HA PRO 70 HA PRO 70 1.180 -4.196 -7.676
517 HB2 PRO 70 HB2 PRO 70 2.852 -2.983 -5.933
518 HB3 PRO 70 HB1 PRO 70 1.981 -2.112 -7.194
519 HG2 PRO 70 HG2 PRO 70 1.615 -1.936 -4.324
520 HG3 PRO 70 HG1 PRO 70 0.840 -0.979 -5.595
521 HD2 PRO 70 HD2 PRO 70 -0.172 -3.337 -4.136
522 HD3 PRO 70 HD1 PRO 70 -1.065 -2.080 -5.021
523 H SER 71 HN SER 71 2.890 -5.556 -7.289
524 HA SER 71 HA SER 71 2.437 -7.415 -5.133
525 HB2 SER 71 HB2 SER 71 4.303 -8.689 -6.280
526 HB3 SER 71 HB1 SER 71 2.884 -8.377 -7.282
527 HG SER 71 HG SER 71 3.996 -6.625 -8.201
528 H ALA 72 HN ALA 72 4.436 -8.222 -3.924
529 HA ALA 72 HA ALA 72 5.411 -6.116 -2.308
530 HB1 ALA 72 HB1 ALA 72 6.415 -8.946 -2.517
531 HB2 ALA 72 HB2 ALA 72 5.091 -8.382 -1.487
532 HB3 ALA 72 HB3 ALA 72 6.730 -7.815 -1.203
533 H ASP 73 HN ASP 73 6.843 -7.752 -5.034
534 HA ASP 73 HA ASP 73 9.458 -6.718 -4.733
535 HB2 ASP 73 HB2 ASP 73 8.905 -8.596 -6.237
536 HB3 ASP 73 HB1 ASP 73 8.000 -7.497 -7.266
537 H GLU 74 HN GLU 74 6.590 -5.520 -6.305
538 HA GLU 74 HA GLU 74 7.797 -3.318 -7.655
539 HB2 GLU 74 HB2 GLU 74 4.933 -3.789 -6.902
540 HB3 GLU 74 HB1 GLU 74 5.512 -2.574 -8.029
541 HG2 GLU 74 HG2 GLU 74 6.377 -4.359 -9.473
542 HG3 GLU 74 HG1 GLU 74 5.747 -5.544 -8.323
543 H VAL 75 HN VAL 75 5.962 -3.651 -4.670
544 HA VAL 75 HA VAL 75 6.047 -0.892 -4.153
545 HB VAL 75 HB VAL 75 5.532 -1.534 -1.732
546 HG11 VAL 75 HG11 VAL 75 3.178 -2.054 -2.319
547 HG12 VAL 75 HG12 VAL 75 3.699 -2.498 -3.942
548 HG13 VAL 75 HG13 VAL 75 3.816 -0.823 -3.415
549 HG21 VAL 75 HG21 VAL 75 4.673 -3.770 -1.366
550 HG22 VAL 75 HG22 VAL 75 6.360 -3.866 -1.910
551 HG23 VAL 75 HG23 VAL 75 5.027 -4.170 -3.038
552 H LYS 76 HN LYS 76 8.255 -3.474 -3.279
553 HA LYS 76 HA LYS 76 9.910 -1.896 -1.596
554 HB2 LYS 76 HB2 LYS 76 10.534 -4.295 -3.314
555 HB3 LYS 76 HB1 LYS 76 11.735 -3.529 -2.277
556 HG2 LYS 76 HG2 LYS 76 10.354 -4.104 -0.323
557 HG3 LYS 76 HG1 LYS 76 9.160 -4.834 -1.401
558 HD2 LYS 76 HD2 LYS 76 10.521 -6.598 -0.491
559 HD3 LYS 76 HD1 LYS 76 10.930 -6.414 -2.192
560 HE2 LYS 76 HE2 LYS 76 12.977 -6.689 -1.030
561 HE3 LYS 76 HE1 LYS 76 12.886 -4.985 -1.440
562 HZ1 LYS 76 HZ1 LYS 76 11.968 -4.702 0.950
563 HZ2 LYS 76 HZ2 LYS 76 13.580 -5.010 0.735
564 HZ3 LYS 76 HZ3 LYS 76 12.574 -6.266 1.210
565 H ALA 77 HN ALA 77 9.689 -2.247 -5.061
566 HA ALA 77 HA ALA 77 12.111 -0.984 -5.718
567 HB1 ALA 77 HB1 ALA 77 9.588 -1.155 -7.364
568 HB2 ALA 77 HB2 ALA 77 10.857 -2.378 -7.303
569 HB3 ALA 77 HB3 ALA 77 11.203 -0.782 -7.967
570 H LYS 78 HN LYS 78 8.855 0.283 -5.279
571 HA LYS 78 HA LYS 78 9.664 2.991 -5.929
572 HB2 LYS 78 HB2 LYS 78 7.321 2.136 -6.276
573 HB3 LYS 78 HB1 LYS 78 7.144 2.110 -4.521
574 HG2 LYS 78 HG2 LYS 78 7.478 4.466 -4.389
575 HG3 LYS 78 HG1 LYS 78 7.827 4.533 -6.128
576 HD2 LYS 78 HD2 LYS 78 5.584 4.003 -6.657
577 HD3 LYS 78 HD1 LYS 78 5.205 3.661 -4.963
578 HE2 LYS 78 HE2 LYS 78 4.371 5.853 -5.459
579 HE3 LYS 78 HE1 LYS 78 5.805 5.957 -4.431
580 HZ1 LYS 78 HZ1 LYS 78 5.906 7.630 -6.062
581 HZ2 LYS 78 HZ2 LYS 78 5.699 6.541 -7.341
582 HZ3 LYS 78 HZ3 LYS 78 7.124 6.523 -6.431
583 H LEU 79 HN LEU 79 9.198 1.138 -3.000
584 HA LEU 79 HA LEU 79 9.401 3.260 -1.167
585 HB2 LEU 79 HB2 LEU 79 8.429 1.116 -0.576
586 HB3 LEU 79 HB1 LEU 79 9.956 0.319 -0.855
587 HG LEU 79 HG LEU 79 10.914 1.383 1.081
588 HD11 LEU 79 HD11 LEU 79 9.533 2.745 2.598
589 HD12 LEU 79 HD12 LEU 79 8.204 2.686 1.438
590 HD13 LEU 79 HD13 LEU 79 9.705 3.513 1.020
591 HD21 LEU 79 HD21 LEU 79 9.552 0.300 2.813
592 HD22 LEU 79 HD22 LEU 79 9.759 -0.726 1.394
593 HD23 LEU 79 HD23 LEU 79 8.236 0.124 1.652
594 H VAL 80 HN VAL 80 11.889 1.243 -2.656
595 HA VAL 80 HA VAL 80 13.933 2.132 -0.894
596 HB VAL 80 HB VAL 80 14.040 -0.029 -2.139
597 HG11 VAL 80 HG11 VAL 80 14.845 -0.082 -4.463
598 HG12 VAL 80 HG12 VAL 80 14.586 1.664 -4.564
599 HG13 VAL 80 HG13 VAL 80 13.227 0.581 -4.276
600 HG21 VAL 80 HG21 VAL 80 16.061 0.824 -1.138
601 HG22 VAL 80 HG22 VAL 80 16.393 1.799 -2.569
602 HG23 VAL 80 HG23 VAL 80 16.452 0.037 -2.668
603 H LYS 81 HN LYS 81 12.518 3.487 -3.684
604 HA LYS 81 HA LYS 81 14.743 5.195 -4.331
605 HB2 LYS 81 HB2 LYS 81 11.857 5.328 -5.209
606 HB3 LYS 81 HB1 LYS 81 13.189 6.229 -5.924
607 HG2 LYS 81 HG2 LYS 81 14.233 4.147 -6.643
608 HG3 LYS 81 HG1 LYS 81 12.951 3.225 -5.871
609 HD2 LYS 81 HD2 LYS 81 12.359 3.228 -8.135
610 HD3 LYS 81 HD1 LYS 81 11.359 4.499 -7.440
611 HE2 LYS 81 HE2 LYS 81 13.965 4.920 -8.878
612 HE3 LYS 81 HE1 LYS 81 12.387 5.065 -9.640
613 HZ1 LYS 81 HZ1 LYS 81 13.194 7.220 -9.075
614 HZ2 LYS 81 HZ2 LYS 81 13.541 6.805 -7.517
615 HZ3 LYS 81 HZ3 LYS 81 11.917 6.891 -8.036
616 H ILE 82 HN ILE 82 11.897 5.337 -2.379
617 HA ILE 82 HA ILE 82 12.017 8.195 -1.953
618 HB ILE 82 HB ILE 82 10.360 6.092 -0.531
619 HG12 ILE 82 HG12 ILE 82 9.592 8.004 -2.730
620 HG13 ILE 82 HG11 ILE 82 9.958 6.298 -2.969
621 HG21 ILE 82 HG21 ILE 82 10.602 8.126 0.817
622 HG22 ILE 82 HG22 ILE 82 8.957 7.986 0.194
623 HG23 ILE 82 HG23 ILE 82 10.089 9.110 -0.555
624 HD11 ILE 82 HD11 ILE 82 7.723 7.391 -1.280
625 HD12 ILE 82 HD12 ILE 82 8.049 5.683 -1.612
626 HD13 ILE 82 HD13 ILE 82 7.564 6.764 -2.917
627 H ALA 83 HN ALA 83 12.381 5.347 0.109
628 HA ALA 83 HA ALA 83 13.644 7.053 2.126
629 HB1 ALA 83 HB1 ALA 83 13.232 5.275 3.690
630 HB2 ALA 83 HB2 ALA 83 12.725 4.224 2.371
631 HB3 ALA 83 HB3 ALA 83 11.740 5.634 2.801
632 H GLY 84 HN GLY 84 14.166 4.085 0.342
633 HA2 GLY 84 HA2 GLY 84 16.043 2.909 -0.082
634 HA3 GLY 84 HA1 GLY 84 17.041 4.268 0.521
635 H LEU 85 HN LEU 85 14.661 2.052 1.608
636 HA LEU 85 HA LEU 85 15.583 1.764 4.250
637 HB2 LEU 85 HB2 LEU 85 13.732 0.198 4.462
638 HB3 LEU 85 HB1 LEU 85 13.255 1.658 3.635
639 HG LEU 85 HG LEU 85 12.079 0.169 2.470
640 HD11 LEU 85 HD11 LEU 85 12.918 -0.463 0.322
641 HD12 LEU 85 HD12 LEU 85 14.508 0.118 0.825
642 HD13 LEU 85 HD13 LEU 85 13.133 1.224 0.781
643 HD21 LEU 85 HD21 LEU 85 12.615 -1.825 3.594
644 HD22 LEU 85 HD22 LEU 85 14.187 -1.909 2.813
645 HD23 LEU 85 HD23 LEU 85 12.718 -2.140 1.862
646 H GLU 86 HN GLU 86 16.659 0.508 1.427
647 HA GLU 86 HA GLU 86 18.548 -1.265 2.627
648 HB2 GLU 86 HB2 GLU 86 16.585 -2.138 0.475
649 HB3 GLU 86 HB1 GLU 86 18.073 -2.993 0.837
650 HG2 GLU 86 HG2 GLU 86 17.281 -3.664 2.933
651 HG3 GLU 86 HG1 GLU 86 15.916 -2.566 2.883
652 H HIS 87 HN HIS 87 20.104 -1.751 0.749
653 HA HIS 87 HA HIS 87 20.211 0.594 -0.976
654 HB2 HIS 87 HB2 HIS 87 22.179 -1.715 -0.672
655 HB3 HIS 87 HB1 HIS 87 22.440 -0.298 -1.678
656 HD1 HIS 87 HD1 HIS 87 23.515 -1.578 1.440
657 HD2 HIS 87 HD2 HIS 87 22.199 2.157 0.153
658 HE1 HIS 87 HE1 HIS 87 24.356 0.070 3.114
659 H HIS 88 HN HIS 88 20.702 -2.863 -1.418
660 HA HIS 88 HA HIS 88 18.570 -3.560 -2.914
661 HB2 HIS 88 HB2 HIS 88 19.608 -1.940 -4.664
662 HB3 HIS 88 HB1 HIS 88 20.923 -3.104 -4.793
663 HD1 HIS 88 HD1 HIS 88 20.580 -4.756 -6.670
664 HD2 HIS 88 HD2 HIS 88 16.997 -3.301 -5.153
665 HE1 HIS 88 HE1 HIS 88 18.753 -5.779 -8.078
Start of MODEL 5
1 H1 MET 1 HT1 MET 1 11.883 11.785 6.742
2 H2 MET 1 HT2 MET 1 10.620 11.250 7.753
3 H3 MET 1 HT3 MET 1 10.505 11.051 6.098
4 HA MET 1 HA MET 1 12.246 9.481 6.079
5 HB2 MET 1 HB2 MET 1 13.544 10.491 7.972
6 HB3 MET 1 HB1 MET 1 12.320 9.913 9.088
7 HG2 MET 1 HG2 MET 1 14.355 8.517 9.042
8 HG3 MET 1 HG1 MET 1 12.892 7.627 8.619
9 HE1 MET 1 HE1 MET 1 14.480 5.673 7.642
10 HE2 MET 1 HE2 MET 1 15.900 6.632 8.057
11 HE3 MET 1 HE3 MET 1 15.732 5.959 6.433
12 H VAL 2 HN VAL 2 11.777 7.246 6.540
13 HA VAL 2 HA VAL 2 9.022 6.812 6.652
14 HB VAL 2 HB VAL 2 9.583 4.335 6.600
15 HG11 VAL 2 HG11 VAL 2 10.835 6.133 4.534
16 HG12 VAL 2 HG12 VAL 2 9.147 5.622 4.580
17 HG13 VAL 2 HG13 VAL 2 10.422 4.438 4.295
18 HG21 VAL 2 HG21 VAL 2 12.411 5.392 6.365
19 HG22 VAL 2 HG22 VAL 2 11.915 3.723 6.094
20 HG23 VAL 2 HG23 VAL 2 11.782 4.431 7.703
21 H THR 3 HN THR 3 8.391 7.701 8.594
22 HA THR 3 HA THR 3 8.741 5.993 10.925
23 HB THR 3 HB THR 3 8.723 8.475 11.254
24 HG1 THR 3 HG1 THR 3 6.595 7.025 12.448
25 HG21 THR 3 HG21 THR 3 6.625 9.748 11.019
26 HG22 THR 3 HG22 THR 3 5.845 8.324 10.332
27 HG23 THR 3 HG23 THR 3 7.166 9.106 9.467
28 H ALA 4 HN ALA 4 6.780 6.511 8.270
29 HA ALA 4 HA ALA 4 5.096 4.269 8.918
30 HB1 ALA 4 HB1 ALA 4 3.126 5.491 7.944
31 HB2 ALA 4 HB2 ALA 4 4.089 6.969 7.938
32 HB3 ALA 4 HB3 ALA 4 3.670 6.198 9.466
33 H ALA 5 HN ALA 5 5.933 3.012 7.418
34 HA ALA 5 HA ALA 5 7.323 3.916 5.145
35 HB1 ALA 5 HB1 ALA 5 7.465 1.536 4.554
36 HB2 ALA 5 HB2 ALA 5 6.297 1.162 5.821
37 HB3 ALA 5 HB3 ALA 5 7.869 1.832 6.243
38 H LEU 6 HN LEU 6 4.213 2.170 5.350
39 HA LEU 6 HA LEU 6 3.309 3.592 3.034
40 HB2 LEU 6 HB2 LEU 6 2.642 1.590 1.779
41 HB3 LEU 6 HB1 LEU 6 4.370 1.705 1.941
42 HG LEU 6 HG LEU 6 2.717 -0.137 3.687
43 HD11 LEU 6 HD11 LEU 6 2.284 -0.818 1.461
44 HD12 LEU 6 HD12 LEU 6 3.486 -1.925 2.131
45 HD13 LEU 6 HD13 LEU 6 3.980 -0.644 1.019
46 HD21 LEU 6 HD21 LEU 6 4.979 0.364 4.466
47 HD22 LEU 6 HD22 LEU 6 5.627 -0.140 2.898
48 HD23 LEU 6 HD23 LEU 6 4.829 -1.315 3.949
49 H THR 7 HN THR 7 1.209 3.838 2.924
50 HA THR 7 HA THR 7 -0.364 2.967 5.240
51 HB THR 7 HB THR 7 -0.892 5.280 3.355
52 HG1 THR 7 HG1 THR 7 0.653 5.062 5.706
53 HG21 THR 7 HG21 THR 7 -1.863 4.679 6.163
54 HG22 THR 7 HG22 THR 7 -2.818 4.502 4.688
55 HG23 THR 7 HG23 THR 7 -2.284 6.102 5.207
56 H ILE 8 HN ILE 8 -1.608 1.318 4.709
57 HA ILE 8 HA ILE 8 -2.561 0.830 2.004
58 HB ILE 8 HB ILE 8 -2.652 -0.752 4.567
59 HG12 ILE 8 HG12 ILE 8 -1.483 -1.463 1.915
60 HG13 ILE 8 HG11 ILE 8 -0.517 -0.705 3.206
61 HG21 ILE 8 HG21 ILE 8 -3.955 -1.474 1.957
62 HG22 ILE 8 HG22 ILE 8 -4.726 -1.157 3.522
63 HG23 ILE 8 HG23 ILE 8 -3.682 -2.574 3.318
64 HD11 ILE 8 HD11 ILE 8 -0.167 -3.085 3.082
65 HD12 ILE 8 HD12 ILE 8 -1.902 -3.384 3.203
66 HD13 ILE 8 HD13 ILE 8 -1.024 -2.705 4.576
67 H TYR 9 HN TYR 9 -4.513 1.262 1.276
68 HA TYR 9 HA TYR 9 -6.715 1.892 3.139
69 HB2 TYR 9 HB2 TYR 9 -6.388 2.538 0.213
70 HB3 TYR 9 HB1 TYR 9 -7.780 2.933 1.195
71 HD1 TYR 9 HD1 TYR 9 -7.213 4.406 3.317
72 HD2 TYR 9 HD2 TYR 9 -4.821 4.127 -0.181
73 HE1 TYR 9 HE1 TYR 9 -6.255 6.608 3.797
74 HE2 TYR 9 HE2 TYR 9 -3.894 6.255 0.243
75 HH TYR 9 HH TYR 9 -4.262 7.938 3.227
76 H THR 10 HN THR 10 -7.684 -0.054 3.490
77 HA THR 10 HA THR 10 -9.227 -1.032 1.335
78 HB THR 10 HB THR 10 -7.046 -2.181 0.901
79 HG1 THR 10 HG1 THR 10 -9.405 -3.683 1.441
80 HG21 THR 10 HG21 THR 10 -6.363 -4.077 2.332
81 HG22 THR 10 HG22 THR 10 -7.614 -3.632 3.490
82 HG23 THR 10 HG23 THR 10 -6.269 -2.535 3.182
83 H THR 11 HN THR 11 -11.050 -2.006 2.111
84 HA THR 11 HA THR 11 -11.035 -2.672 4.920
85 HB THR 11 HB THR 11 -13.425 -2.501 3.032
86 HG1 THR 11 HG1 THR 11 -12.538 -0.645 5.014
87 HG21 THR 11 HG21 THR 11 -14.753 -2.363 5.070
88 HG22 THR 11 HG22 THR 11 -13.300 -2.478 6.052
89 HG23 THR 11 HG23 THR 11 -13.809 -3.857 5.071
90 H SER 12 HN SER 12 -11.983 -4.887 5.416
91 HA SER 12 HA SER 12 -10.604 -6.824 4.005
92 HB2 SER 12 HB2 SER 12 -12.827 -7.038 5.943
93 HB3 SER 12 HB1 SER 12 -11.674 -8.346 5.577
94 HG SER 12 HG SER 12 -11.222 -7.094 7.463
95 H TRP 13 HN TRP 13 -13.551 -5.486 2.984
96 HA TRP 13 HA TRP 13 -14.637 -7.921 1.949
97 HB2 TRP 13 HB2 TRP 13 -16.256 -6.469 0.706
98 HB3 TRP 13 HB1 TRP 13 -16.244 -6.233 2.442
99 HD1 TRP 13 HD1 TRP 13 -15.716 -3.860 3.326
100 HE1 TRP 13 HE1 TRP 13 -15.350 -1.582 2.230
101 HE3 TRP 13 HE3 TRP 13 -15.170 -5.369 -1.528
102 HZ2 TRP 13 HZ2 TRP 13 -14.887 -0.535 -0.344
103 HZ3 TRP 13 HZ3 TRP 13 -14.776 -3.666 -3.245
104 HH2 TRP 13 HH2 TRP 13 -14.639 -1.288 -2.665
105 H CYS 14 HN CYS 14 -12.179 -5.881 0.990
106 HA CYS 14 HA CYS 14 -12.342 -6.401 -1.813
107 HB2 CYS 14 HB2 CYS 14 -9.984 -5.518 -0.127
108 HB3 CYS 14 HB1 CYS 14 -10.114 -5.419 -1.881
109 HG CYS 14 HG CYS 14 -11.673 -3.361 -2.053
110 H GLY 15 HN GLY 15 -11.105 -7.993 -2.950
111 HA2 GLY 15 HA2 GLY 15 -10.742 -10.399 -1.451
112 HA3 GLY 15 HA1 GLY 15 -10.456 -10.195 -3.171
113 H TYR 16 HN TYR 16 -8.586 -8.146 -3.046
114 HA TYR 16 HA TYR 16 -6.267 -9.693 -2.473
115 HB2 TYR 16 HB2 TYR 16 -6.470 -6.884 -3.513
116 HB3 TYR 16 HB1 TYR 16 -4.965 -7.761 -3.315
117 HD1 TYR 16 HD1 TYR 16 -5.284 -10.310 -4.376
118 HD2 TYR 16 HD2 TYR 16 -7.116 -6.719 -5.699
119 HE1 TYR 16 HE1 TYR 16 -5.530 -11.262 -6.615
120 HE2 TYR 16 HE2 TYR 16 -7.377 -7.669 -7.936
121 HH TYR 16 HH TYR 16 -6.882 -10.972 -8.547
122 H CYS 17 HN CYS 17 -8.039 -7.874 -0.394
123 HA CYS 17 HA CYS 17 -6.240 -6.192 0.868
124 HB2 CYS 17 HB2 CYS 17 -7.651 -6.355 2.889
125 HB3 CYS 17 HB1 CYS 17 -8.609 -6.144 1.435
126 HG CYS 17 HG CYS 17 -9.873 -8.482 1.483
127 H LEU 18 HN LEU 18 -6.982 -9.518 1.960
128 HA LEU 18 HA LEU 18 -4.782 -9.549 3.758
129 HB2 LEU 18 HB2 LEU 18 -5.320 -11.802 4.278
130 HB3 LEU 18 HB1 LEU 18 -6.823 -10.942 4.093
131 HG LEU 18 HG LEU 18 -5.637 -12.796 2.020
132 HD11 LEU 18 HD11 LEU 18 -7.375 -14.350 2.729
133 HD12 LEU 18 HD12 LEU 18 -7.820 -13.244 4.025
134 HD13 LEU 18 HD13 LEU 18 -6.225 -13.995 4.014
135 HD21 LEU 18 HD21 LEU 18 -7.129 -11.144 1.036
136 HD22 LEU 18 HD22 LEU 18 -8.382 -11.541 2.213
137 HD23 LEU 18 HD23 LEU 18 -7.877 -12.739 1.019
138 H ARG 19 HN ARG 19 -5.156 -10.368 0.450
139 HA ARG 19 HA ARG 19 -2.955 -12.056 0.052
140 HB2 ARG 19 HB2 ARG 19 -4.628 -11.678 -1.698
141 HB3 ARG 19 HB1 ARG 19 -4.200 -9.981 -1.771
142 HG2 ARG 19 HG2 ARG 19 -3.299 -11.092 -3.693
143 HG3 ARG 19 HG1 ARG 19 -1.970 -10.623 -2.638
144 HD2 ARG 19 HD2 ARG 19 -1.851 -12.910 -1.777
145 HD3 ARG 19 HD1 ARG 19 -3.189 -13.381 -2.828
146 HE ARG 19 HE ARG 19 -0.982 -12.185 -4.216
147 HH11 ARG 19 HH11 ARG 19 -2.306 -15.258 -3.066
148 HH12 ARG 19 HH12 ARG 19 -1.381 -16.207 -4.109
149 HH21 ARG 19 HH21 ARG 19 0.281 -13.477 -5.648
150 HH22 ARG 19 HH22 ARG 19 0.135 -15.184 -5.625
151 H LEU 20 HN LEU 20 -3.310 -8.577 -0.111
152 HA LEU 20 HA LEU 20 -0.622 -7.914 -0.556
153 HB2 LEU 20 HB2 LEU 20 -2.411 -6.412 -1.124
154 HB3 LEU 20 HB1 LEU 20 -2.981 -6.383 0.525
155 HG LEU 20 HG LEU 20 -1.056 -5.134 1.208
156 HD11 LEU 20 HD11 LEU 20 0.636 -5.948 -0.334
157 HD12 LEU 20 HD12 LEU 20 0.514 -4.199 -0.516
158 HD13 LEU 20 HD13 LEU 20 -0.238 -5.270 -1.702
159 HD21 LEU 20 HD21 LEU 20 -1.540 -3.032 -0.003
160 HD22 LEU 20 HD22 LEU 20 -2.984 -3.899 0.507
161 HD23 LEU 20 HD23 LEU 20 -2.469 -3.965 -1.180
162 H LYS 21 HN LYS 21 -2.588 -8.122 2.398
163 HA LYS 21 HA LYS 21 -0.741 -7.140 4.271
164 HB2 LYS 21 HB2 LYS 21 -2.700 -9.386 4.753
165 HB3 LYS 21 HB1 LYS 21 -1.944 -8.388 5.977
166 HG2 LYS 21 HG2 LYS 21 -3.907 -7.451 3.907
167 HG3 LYS 21 HG1 LYS 21 -4.260 -7.799 5.595
168 HD2 LYS 21 HD2 LYS 21 -2.718 -5.990 6.254
169 HD3 LYS 21 HD1 LYS 21 -2.419 -5.662 4.552
170 HE2 LYS 21 HE2 LYS 21 -4.656 -5.079 4.140
171 HE3 LYS 21 HE1 LYS 21 -5.174 -5.628 5.745
172 HZ1 LYS 21 HZ1 LYS 21 -3.422 -3.289 5.174
173 HZ2 LYS 21 HZ2 LYS 21 -3.877 -3.876 6.698
174 HZ3 LYS 21 HZ3 LYS 21 -5.049 -3.262 5.673
175 H THR 22 HN THR 22 -1.406 -10.529 3.411
176 HA THR 22 HA THR 22 0.557 -11.684 4.984
177 HB THR 22 HB THR 22 -0.574 -12.762 2.386
178 HG1 THR 22 HG1 THR 22 -2.387 -12.907 3.433
179 HG21 THR 22 HG21 THR 22 -0.199 -14.954 3.444
180 HG22 THR 22 HG22 THR 22 0.471 -14.158 4.867
181 HG23 THR 22 HG23 THR 22 1.316 -14.058 3.323
182 H ALA 23 HN ALA 23 0.700 -10.524 1.626
183 HA ALA 23 HA ALA 23 3.225 -11.543 0.978
184 HB1 ALA 23 HB1 ALA 23 1.891 -9.031 -0.038
185 HB2 ALA 23 HB2 ALA 23 1.675 -10.650 -0.701
186 HB3 ALA 23 HB3 ALA 23 3.248 -9.859 -0.800
187 H LEU 24 HN LEU 24 2.278 -8.416 2.358
188 HA LEU 24 HA LEU 24 4.943 -7.401 2.510
189 HB2 LEU 24 HB2 LEU 24 2.557 -6.591 4.146
190 HB3 LEU 24 HB1 LEU 24 4.017 -5.664 3.954
191 HG LEU 24 HG LEU 24 1.882 -6.170 1.892
192 HD11 LEU 24 HD11 LEU 24 2.830 -3.723 3.318
193 HD12 LEU 24 HD12 LEU 24 1.296 -4.547 3.563
194 HD13 LEU 24 HD13 LEU 24 1.641 -3.725 2.025
195 HD21 LEU 24 HD21 LEU 24 3.145 -4.606 0.475
196 HD22 LEU 24 HD22 LEU 24 3.974 -6.130 0.688
197 HD23 LEU 24 HD23 LEU 24 4.501 -4.695 1.595
198 H THR 25 HN THR 25 2.834 -8.967 4.823
199 HA THR 25 HA THR 25 4.550 -8.703 7.016
200 HB THR 25 HB THR 25 2.513 -10.905 6.542
201 HG1 THR 25 HG1 THR 25 1.445 -8.957 6.314
202 HG21 THR 25 HG21 THR 25 3.991 -11.265 8.480
203 HG22 THR 25 HG22 THR 25 2.338 -10.917 8.995
204 HG23 THR 25 HG23 THR 25 3.575 -9.665 9.089
205 H ALA 26 HN ALA 26 4.307 -11.179 4.492
206 HA ALA 26 HA ALA 26 6.146 -13.006 5.560
207 HB1 ALA 26 HB1 ALA 26 6.246 -13.941 3.313
208 HB2 ALA 26 HB2 ALA 26 5.476 -12.495 2.666
209 HB3 ALA 26 HB3 ALA 26 4.581 -13.559 3.754
210 H ASN 27 HN ASN 27 6.582 -10.116 3.597
211 HA ASN 27 HA ASN 27 9.434 -10.694 3.287
212 HB2 ASN 27 HB2 ASN 27 7.751 -8.457 2.159
213 HB3 ASN 27 HB1 ASN 27 9.501 -8.475 2.030
214 HD21 ASN 27 HD21 ASN 27 7.284 -11.202 1.705
215 HD22 ASN 27 HD22 ASN 27 7.679 -11.540 0.058
216 H ARG 28 HN ARG 28 7.799 -9.680 5.759
217 HA ARG 28 HA ARG 28 8.113 -8.424 7.577
218 HB2 ARG 28 HB2 ARG 28 10.996 -8.592 6.703
219 HB3 ARG 28 HB1 ARG 28 10.491 -7.881 8.228
220 HG2 ARG 28 HG2 ARG 28 9.456 -10.063 8.830
221 HG3 ARG 28 HG1 ARG 28 10.145 -10.738 7.354
222 HD2 ARG 28 HD2 ARG 28 11.539 -11.202 9.322
223 HD3 ARG 28 HD1 ARG 28 12.382 -10.215 8.127
224 HE ARG 28 HE ARG 28 11.636 -8.278 9.596
225 HH11 ARG 28 HH11 ARG 28 12.518 -11.436 10.921
226 HH12 ARG 28 HH12 ARG 28 12.961 -10.799 12.443
227 HH21 ARG 28 HH21 ARG 28 12.287 -7.448 11.605
228 HH22 ARG 28 HH22 ARG 28 12.875 -8.470 12.838
229 H ILE 29 HN ILE 29 7.090 -7.044 5.632
230 HA ILE 29 HA ILE 29 8.500 -4.498 5.546
231 HB ILE 29 HB ILE 29 5.971 -5.403 4.159
232 HG12 ILE 29 HG12 ILE 29 8.697 -4.907 2.950
233 HG13 ILE 29 HG11 ILE 29 8.136 -6.514 3.426
234 HG21 ILE 29 HG21 ILE 29 6.178 -3.309 2.875
235 HG22 ILE 29 HG22 ILE 29 7.623 -2.905 3.814
236 HG23 ILE 29 HG23 ILE 29 6.069 -2.982 4.615
237 HD11 ILE 29 HD11 ILE 29 6.313 -6.233 1.797
238 HD12 ILE 29 HD12 ILE 29 7.923 -6.205 1.110
239 HD13 ILE 29 HD13 ILE 29 7.029 -4.688 1.314
240 H ALA 30 HN ALA 30 8.042 -3.121 7.071
241 HA ALA 30 HA ALA 30 5.884 -3.349 8.911
242 HB1 ALA 30 HB1 ALA 30 6.751 -1.185 9.699
243 HB2 ALA 30 HB2 ALA 30 7.804 -1.155 8.272
244 HB3 ALA 30 HB3 ALA 30 8.029 -2.399 9.505
245 H TYR 31 HN TYR 31 3.799 -2.774 8.348
246 HA TYR 31 HA TYR 31 3.559 -0.439 6.618
247 HB2 TYR 31 HB2 TYR 31 1.671 -1.461 5.434
248 HB3 TYR 31 HB1 TYR 31 3.166 -2.349 5.194
249 HD1 TYR 31 HD2 TYR 31 3.440 -4.559 6.143
250 HD2 TYR 31 HD1 TYR 31 -0.193 -2.434 6.621
251 HE1 TYR 31 HE2 TYR 31 2.313 -6.658 6.777
252 HE2 TYR 31 HE1 TYR 31 -1.352 -4.504 7.241
253 HH TYR 31 HH TYR 31 0.428 -7.436 7.864
254 H ASP 32 HN ASP 32 1.630 0.645 6.640
255 HA ASP 32 HA ASP 32 0.261 0.528 9.206
256 HB2 ASP 32 HB2 ASP 32 1.088 2.813 7.436
257 HB3 ASP 32 HB1 ASP 32 -0.140 3.021 8.687
258 H GLU 33 HN GLU 33 -1.979 0.691 9.100
259 HA GLU 33 HA GLU 33 -3.161 0.812 6.426
260 HB2 GLU 33 HB2 GLU 33 -4.662 -1.077 7.029
261 HB3 GLU 33 HB1 GLU 33 -2.980 -1.541 6.871
262 HG2 GLU 33 HG2 GLU 33 -2.731 -1.608 9.268
263 HG3 GLU 33 HG1 GLU 33 -4.383 -1.032 9.483
264 H VAL 34 HN VAL 34 -5.071 1.846 6.331
265 HA VAL 34 HA VAL 34 -6.385 2.485 8.825
266 HB VAL 34 HB VAL 34 -4.928 4.441 8.137
267 HG11 VAL 34 HG11 VAL 34 -4.991 4.234 5.752
268 HG12 VAL 34 HG12 VAL 34 -5.513 5.835 6.280
269 HG13 VAL 34 HG13 VAL 34 -6.714 4.659 5.754
270 HG21 VAL 34 HG21 VAL 34 -6.848 4.886 9.506
271 HG22 VAL 34 HG22 VAL 34 -7.882 4.937 8.073
272 HG23 VAL 34 HG23 VAL 34 -6.658 6.179 8.316
273 H ASP 35 HN ASP 35 -8.691 2.739 8.527
274 HA ASP 35 HA ASP 35 -9.463 1.092 6.276
275 HB2 ASP 35 HB2 ASP 35 -10.256 0.385 8.435
276 HB3 ASP 35 HB1 ASP 35 -10.983 1.959 8.735
277 H ILE 36 HN ILE 36 -10.940 1.594 4.772
278 HA ILE 36 HA ILE 36 -11.116 4.404 4.120
279 HB ILE 36 HB ILE 36 -12.047 3.635 1.956
280 HG12 ILE 36 HG12 ILE 36 -11.712 0.885 3.182
281 HG13 ILE 36 HG11 ILE 36 -13.231 1.651 2.766
282 HG21 ILE 36 HG21 ILE 36 -10.001 2.424 1.226
283 HG22 ILE 36 HG22 ILE 36 -9.531 2.292 2.922
284 HG23 ILE 36 HG23 ILE 36 -9.674 3.883 2.165
285 HD11 ILE 36 HD11 ILE 36 -12.579 -0.057 1.201
286 HD12 ILE 36 HD12 ILE 36 -11.090 0.812 0.835
287 HD13 ILE 36 HD13 ILE 36 -12.661 1.525 0.415
288 H GLU 37 HN GLU 37 -13.176 1.967 5.404
289 HA GLU 37 HA GLU 37 -15.583 3.195 4.605
290 HB2 GLU 37 HB2 GLU 37 -15.439 0.803 5.021
291 HB3 GLU 37 HB1 GLU 37 -14.982 1.104 6.687
292 HG2 GLU 37 HG2 GLU 37 -17.163 1.927 7.200
293 HG3 GLU 37 HG1 GLU 37 -17.632 1.865 5.499
294 H HIS 38 HN HIS 38 -13.511 3.270 7.401
295 HA HIS 38 HA HIS 38 -15.264 5.105 8.821
296 HB2 HIS 38 HB2 HIS 38 -12.607 3.905 9.572
297 HB3 HIS 38 HB1 HIS 38 -13.467 5.058 10.584
298 HD1 HIS 38 HD1 HIS 38 -13.759 1.542 9.246
299 HD2 HIS 38 HD2 HIS 38 -15.538 4.038 12.041
300 HE1 HIS 38 HE1 HIS 38 -15.243 0.065 10.666
301 H ASN 39 HN ASN 39 -13.139 5.578 6.384
302 HA ASN 39 HA ASN 39 -12.724 8.349 7.241
303 HB2 ASN 39 HB2 ASN 39 -10.618 6.646 5.891
304 HB3 ASN 39 HB1 ASN 39 -10.512 8.392 6.055
305 HD21 ASN 39 HD21 ASN 39 -10.197 5.358 7.577
306 HD22 ASN 39 HD22 ASN 39 -9.534 5.920 9.058
307 H ARG 40 HN ARG 40 -14.147 9.298 5.991
308 HA ARG 40 HA ARG 40 -14.943 8.304 3.489
309 HB2 ARG 40 HB2 ARG 40 -16.433 9.650 4.853
310 HB3 ARG 40 HB1 ARG 40 -15.380 11.046 4.654
311 HG2 ARG 40 HG2 ARG 40 -15.860 11.172 2.331
312 HG3 ARG 40 HG1 ARG 40 -16.736 9.647 2.363
313 HD2 ARG 40 HD2 ARG 40 -18.394 10.673 3.863
314 HD3 ARG 40 HD1 ARG 40 -17.529 12.204 3.756
315 HE ARG 40 HE ARG 40 -17.975 11.447 1.195
316 HH11 ARG 40 HH11 ARG 40 -20.006 12.178 3.989
317 HH12 ARG 40 HH12 ARG 40 -21.352 12.669 3.070
318 HH21 ARG 40 HH21 ARG 40 -19.816 12.106 -0.068
319 HH22 ARG 40 HH22 ARG 40 -21.254 12.594 0.694
320 H ALA 41 HN ALA 41 -12.726 10.940 4.285
321 HA ALA 41 HA ALA 41 -12.311 11.753 1.617
322 HB1 ALA 41 HB1 ALA 41 -11.707 13.173 3.517
323 HB2 ALA 41 HB2 ALA 41 -10.328 12.912 2.448
324 HB3 ALA 41 HB3 ALA 41 -10.443 12.029 3.970
325 H ALA 42 HN ALA 42 -10.921 9.242 3.563
326 HA ALA 42 HA ALA 42 -8.763 8.680 1.788
327 HB1 ALA 42 HB1 ALA 42 -9.988 6.828 3.856
328 HB2 ALA 42 HB2 ALA 42 -8.698 7.984 4.169
329 HB3 ALA 42 HB3 ALA 42 -8.432 6.650 3.044
330 H ALA 43 HN ALA 43 -12.008 7.372 2.259
331 HA ALA 43 HA ALA 43 -11.918 5.353 0.288
332 HB1 ALA 43 HB1 ALA 43 -14.353 5.389 0.398
333 HB2 ALA 43 HB2 ALA 43 -14.302 6.931 1.249
334 HB3 ALA 43 HB3 ALA 43 -13.660 5.479 2.020
335 H GLU 44 HN GLU 44 -12.758 8.727 0.182
336 HA GLU 44 HA GLU 44 -13.636 8.950 -2.469
337 HB2 GLU 44 HB2 GLU 44 -13.873 10.657 -0.661
338 HB3 GLU 44 HB1 GLU 44 -12.151 10.971 -0.771
339 HG2 GLU 44 HG2 GLU 44 -13.376 12.696 -1.908
340 HG3 GLU 44 HG1 GLU 44 -12.475 11.744 -3.084
341 H PHE 45 HN PHE 45 -10.454 9.223 -0.976
342 HA PHE 45 HA PHE 45 -8.978 9.910 -3.274
343 HB2 PHE 45 HB2 PHE 45 -8.092 10.369 -1.082
344 HB3 PHE 45 HB1 PHE 45 -8.139 8.668 -0.655
345 HD1 PHE 45 HD1 PHE 45 -6.546 11.064 -2.988
346 HD2 PHE 45 HD2 PHE 45 -6.290 7.306 -1.006
347 HE1 PHE 45 HE1 PHE 45 -4.233 10.808 -3.783
348 HE2 PHE 45 HE2 PHE 45 -3.977 7.049 -1.797
349 HZ PHE 45 HZ PHE 45 -2.949 8.801 -3.190
350 H VAL 46 HN VAL 46 -9.234 6.795 -1.566
351 HA VAL 46 HA VAL 46 -7.666 5.349 -3.401
352 HB VAL 46 HB VAL 46 -7.960 4.479 -1.150
353 HG11 VAL 46 HG11 VAL 46 -10.148 5.258 -0.718
354 HG12 VAL 46 HG12 VAL 46 -9.979 3.509 -0.423
355 HG13 VAL 46 HG13 VAL 46 -10.817 4.083 -1.881
356 HG21 VAL 46 HG21 VAL 46 -9.399 2.587 -2.928
357 HG22 VAL 46 HG22 VAL 46 -8.358 2.197 -1.539
358 HG23 VAL 46 HG23 VAL 46 -7.668 2.889 -3.025
359 H GLY 47 HN GLY 47 -10.960 6.251 -3.575
360 HA2 GLY 47 HA2 GLY 47 -11.792 4.352 -5.482
361 HA3 GLY 47 HA1 GLY 47 -12.526 5.934 -5.226
362 H SER 48 HN SER 48 -10.282 7.551 -5.878
363 HA SER 48 HA SER 48 -10.538 7.508 -8.730
364 HB2 SER 48 HB2 SER 48 -8.791 9.243 -6.986
365 HB3 SER 48 HB1 SER 48 -9.193 9.538 -8.678
366 HG SER 48 HG SER 48 -11.490 9.292 -7.681
367 H VAL 49 HN VAL 49 -8.109 6.499 -6.474
368 HA VAL 49 HA VAL 49 -6.157 6.124 -8.608
369 HB VAL 49 HB VAL 49 -4.603 5.410 -6.763
370 HG11 VAL 49 HG11 VAL 49 -6.023 8.033 -6.436
371 HG12 VAL 49 HG12 VAL 49 -4.662 7.710 -7.521
372 HG13 VAL 49 HG13 VAL 49 -4.432 7.660 -5.763
373 HG21 VAL 49 HG21 VAL 49 -6.345 4.600 -5.213
374 HG22 VAL 49 HG22 VAL 49 -6.879 6.271 -5.003
375 HG23 VAL 49 HG23 VAL 49 -5.274 5.790 -4.459
376 H ASN 50 HN ASN 50 -8.687 4.522 -7.819
377 HA ASN 50 HA ASN 50 -7.576 1.883 -7.550
378 HB2 ASN 50 HB2 ASN 50 -10.099 3.068 -7.014
379 HB3 ASN 50 HB1 ASN 50 -10.358 1.791 -8.197
380 HD21 ASN 50 HD21 ASN 50 -7.919 1.898 -5.658
381 HD22 ASN 50 HD22 ASN 50 -8.535 0.520 -4.826
382 H GLY 51 HN GLY 51 -8.639 0.184 -9.044
383 HA2 GLY 51 HA2 GLY 51 -8.186 1.029 -11.793
384 HA3 GLY 51 HA1 GLY 51 -8.253 -0.633 -11.204
385 H GLY 52 HN GLY 52 -10.121 2.143 -12.128
386 HA2 GLY 52 HA2 GLY 52 -12.159 1.871 -13.342
387 HA3 GLY 52 HA1 GLY 52 -12.453 0.399 -12.420
388 H ASN 53 HN ASN 53 -13.182 0.510 -10.335
389 HA ASN 53 HA ASN 53 -13.831 3.141 -9.219
390 HB2 ASN 53 HB2 ASN 53 -15.786 0.806 -9.364
391 HB3 ASN 53 HB1 ASN 53 -16.067 2.295 -8.508
392 HD21 ASN 53 HD21 ASN 53 -15.059 3.986 -10.922
393 HD22 ASN 53 HD22 ASN 53 -16.329 3.826 -12.033
394 H ARG 54 HN ARG 54 -14.666 2.694 -6.866
395 HA ARG 54 HA ARG 54 -12.368 1.545 -5.703
396 HB2 ARG 54 HB2 ARG 54 -13.065 2.328 -3.554
397 HB3 ARG 54 HB1 ARG 54 -13.522 3.537 -4.714
398 HG2 ARG 54 HG2 ARG 54 -15.362 1.631 -3.251
399 HG3 ARG 54 HG1 ARG 54 -15.177 3.349 -2.962
400 HD2 ARG 54 HD2 ARG 54 -17.182 3.195 -4.147
401 HD3 ARG 54 HD1 ARG 54 -16.020 3.606 -5.407
402 HE ARG 54 HE ARG 54 -16.282 0.816 -5.051
403 HH11 ARG 54 HH11 ARG 54 -17.842 3.548 -6.659
404 HH12 ARG 54 HH12 ARG 54 -18.635 2.585 -7.810
405 HH21 ARG 54 HH21 ARG 54 -17.365 -0.497 -6.616
406 HH22 ARG 54 HH22 ARG 54 -18.353 0.201 -7.793
407 H THR 55 HN THR 55 -11.991 -0.441 -5.753
408 HA THR 55 HA THR 55 -13.783 -2.256 -4.371
409 HB THR 55 HB THR 55 -14.523 -2.459 -6.699
410 HG1 THR 55 HG1 THR 55 -14.742 -4.415 -5.897
411 HG21 THR 55 HG21 THR 55 -11.661 -3.200 -7.330
412 HG22 THR 55 HG22 THR 55 -12.477 -1.727 -7.826
413 HG23 THR 55 HG23 THR 55 -13.008 -3.289 -8.465
414 H VAL 56 HN VAL 56 -10.588 -1.422 -5.491
415 HA VAL 56 HA VAL 56 -9.547 -3.807 -4.181
416 HB VAL 56 HB VAL 56 -7.457 -3.342 -5.587
417 HG11 VAL 56 HG11 VAL 56 -8.902 -5.289 -5.923
418 HG12 VAL 56 HG12 VAL 56 -8.396 -4.658 -7.487
419 HG13 VAL 56 HG13 VAL 56 -10.020 -4.328 -6.885
420 HG21 VAL 56 HG21 VAL 56 -8.085 -1.166 -6.445
421 HG22 VAL 56 HG22 VAL 56 -9.495 -1.860 -7.242
422 HG23 VAL 56 HG23 VAL 56 -7.874 -2.303 -7.774
423 HA PRO 57 HA PRO 57 -7.267 -1.467 -1.211
424 HB2 PRO 57 HB2 PRO 57 -4.908 -2.929 -1.245
425 HB3 PRO 57 HB1 PRO 57 -6.337 -3.405 -0.333
426 HG2 PRO 57 HG2 PRO 57 -5.392 -4.352 -2.987
427 HG3 PRO 57 HG1 PRO 57 -6.121 -5.264 -1.658
428 HD2 PRO 57 HD2 PRO 57 -7.567 -4.577 -3.814
429 HD3 PRO 57 HD1 PRO 57 -8.271 -4.568 -2.180
430 H THR 58 HN THR 58 -5.889 0.251 -1.268
431 HA THR 58 HA THR 58 -3.894 0.355 -3.403
432 HB THR 58 HB THR 58 -5.511 2.796 -2.550
433 HG1 THR 58 HG1 THR 58 -6.343 0.768 -3.932
434 HG21 THR 58 HG21 THR 58 -3.770 2.260 -4.970
435 HG22 THR 58 HG22 THR 58 -3.287 3.221 -3.560
436 HG23 THR 58 HG23 THR 58 -4.603 3.767 -4.597
437 H VAL 59 HN VAL 59 -2.055 1.590 -2.866
438 HA VAL 59 HA VAL 59 -1.802 1.963 0.014
439 HB VAL 59 HB VAL 59 -0.912 -0.203 -0.608
440 HG11 VAL 59 HG11 VAL 59 -0.380 0.162 -2.942
441 HG12 VAL 59 HG12 VAL 59 1.034 -0.440 -2.069
442 HG13 VAL 59 HG13 VAL 59 0.919 1.266 -2.489
443 HG21 VAL 59 HG21 VAL 59 1.108 1.862 0.021
444 HG22 VAL 59 HG22 VAL 59 1.395 0.119 0.082
445 HG23 VAL 59 HG23 VAL 59 0.178 0.855 1.162
446 H LYS 60 HN LYS 60 -0.919 3.835 0.588
447 HA LYS 60 HA LYS 60 0.539 5.450 -1.400
448 HB2 LYS 60 HB2 LYS 60 -0.763 6.131 1.194
449 HB3 LYS 60 HB1 LYS 60 0.556 7.154 0.617
450 HG2 LYS 60 HG2 LYS 60 -0.978 7.261 -1.494
451 HG3 LYS 60 HG1 LYS 60 -2.232 6.785 -0.356
452 HD2 LYS 60 HD2 LYS 60 -0.464 9.243 -0.254
453 HD3 LYS 60 HD1 LYS 60 -2.211 9.187 -0.447
454 HE2 LYS 60 HE2 LYS 60 -2.416 8.352 1.901
455 HE3 LYS 60 HE1 LYS 60 -0.661 8.404 2.027
456 HZ1 LYS 60 HZ1 LYS 60 -1.784 10.297 3.018
457 HZ2 LYS 60 HZ2 LYS 60 -2.364 10.779 1.509
458 HZ3 LYS 60 HZ3 LYS 60 -0.702 10.745 1.809
459 H PHE 61 HN PHE 61 2.630 5.730 -1.165
460 HA PHE 61 HA PHE 61 3.987 4.451 1.085
461 HB2 PHE 61 HB2 PHE 61 5.039 5.896 -1.339
462 HB3 PHE 61 HB1 PHE 61 6.044 5.143 -0.109
463 HD1 PHE 61 HD1 PHE 61 3.811 4.609 -2.916
464 HD2 PHE 61 HD2 PHE 61 6.264 2.763 0.016
465 HE1 PHE 61 HE1 PHE 61 3.727 2.533 -4.178
466 HE2 PHE 61 HE2 PHE 61 6.189 0.666 -1.225
467 HZ PHE 61 HZ PHE 61 4.928 0.540 -3.346
468 H ALA 62 HN ALA 62 5.843 5.820 2.058
469 HA ALA 62 HA ALA 62 4.956 8.332 3.023
470 HB1 ALA 62 HB1 ALA 62 7.780 7.238 2.890
471 HB2 ALA 62 HB2 ALA 62 6.638 6.959 4.202
472 HB3 ALA 62 HB3 ALA 62 7.248 8.585 3.894
473 H ASP 63 HN ASP 63 6.281 7.344 0.184
474 HA ASP 63 HA ASP 63 7.510 9.708 -0.880
475 HB2 ASP 63 HB2 ASP 63 8.005 7.404 -1.630
476 HB3 ASP 63 HB1 ASP 63 6.360 7.233 -2.192
477 H GLY 64 HN GLY 64 4.268 8.619 -0.407
478 HA2 GLY 64 HA2 GLY 64 2.347 9.880 -0.623
479 HA3 GLY 64 HA1 GLY 64 3.194 10.987 -1.690
480 H SER 65 HN SER 65 4.112 8.541 -3.231
481 HA SER 65 HA SER 65 2.021 8.595 -5.146
482 HB2 SER 65 HB2 SER 65 4.471 6.851 -4.989
483 HB3 SER 65 HB1 SER 65 3.501 7.153 -6.435
484 HG SER 65 HG SER 65 5.453 8.667 -5.255
485 H THR 66 HN THR 66 0.795 6.782 -5.900
486 HA THR 66 HA THR 66 0.330 4.740 -3.868
487 HB THR 66 HB THR 66 -1.897 4.564 -5.135
488 HG1 THR 66 HG1 THR 66 -1.829 5.824 -6.821
489 HG21 THR 66 HG21 THR 66 -1.693 5.430 -2.848
490 HG22 THR 66 HG22 THR 66 -2.915 6.289 -3.772
491 HG23 THR 66 HG23 THR 66 -1.333 7.034 -3.500
492 H LEU 67 HN LEU 67 -0.082 2.682 -4.528
493 HA LEU 67 HA LEU 67 0.041 2.049 -7.368
494 HB2 LEU 67 HB2 LEU 67 1.408 0.509 -5.138
495 HB3 LEU 67 HB1 LEU 67 1.072 -0.187 -6.704
496 HG LEU 67 HG LEU 67 2.936 2.136 -6.168
497 HD11 LEU 67 HD11 LEU 67 3.512 -0.725 -6.946
498 HD12 LEU 67 HD12 LEU 67 3.768 -0.046 -5.348
499 HD13 LEU 67 HD13 LEU 67 4.709 0.548 -6.718
500 HD21 LEU 67 HD21 LEU 67 3.622 1.791 -8.518
501 HD22 LEU 67 HD22 LEU 67 1.963 2.338 -8.387
502 HD23 LEU 67 HD23 LEU 67 2.305 0.637 -8.723
503 H THR 68 HN THR 68 -1.723 1.094 -7.971
504 HA THR 68 HA THR 68 -3.771 0.327 -6.174
505 HB THR 68 HB THR 68 -3.518 -0.521 -9.070
506 HG1 THR 68 HG1 THR 68 -4.568 2.034 -8.315
507 HG21 THR 68 HG21 THR 68 -5.484 -1.296 -7.808
508 HG22 THR 68 HG22 THR 68 -5.959 -0.138 -9.054
509 HG23 THR 68 HG23 THR 68 -5.856 0.370 -7.368
510 H ASN 69 HN ASN 69 -4.410 -1.832 -5.655
511 HA ASN 69 HA ASN 69 -3.126 -3.508 -4.403
512 HB2 ASN 69 HB2 ASN 69 -4.266 -5.542 -5.254
513 HB3 ASN 69 HB1 ASN 69 -5.318 -4.166 -4.983
514 HD21 ASN 69 HD21 ASN 69 -4.151 -6.445 -7.225
515 HD22 ASN 69 HD22 ASN 69 -5.020 -5.897 -8.612
516 HA PRO 70 HA PRO 70 0.455 -4.962 -6.676
517 HB2 PRO 70 HB2 PRO 70 2.240 -3.856 -4.981
518 HB3 PRO 70 HB1 PRO 70 1.538 -2.980 -6.341
519 HG2 PRO 70 HG2 PRO 70 1.137 -2.521 -3.508
520 HG3 PRO 70 HG1 PRO 70 0.544 -1.564 -4.870
521 HD2 PRO 70 HD2 PRO 70 -0.836 -3.612 -3.273
522 HD3 PRO 70 HD1 PRO 70 -1.500 -2.325 -4.305
523 H SER 71 HN SER 71 2.389 -6.071 -5.717
524 HA SER 71 HA SER 71 1.671 -7.621 -3.344
525 HB2 SER 71 HB2 SER 71 3.568 -8.358 -5.601
526 HB3 SER 71 HB1 SER 71 3.029 -9.413 -4.295
527 HG SER 71 HG SER 71 1.424 -8.256 -6.310
528 H ALA 72 HN ALA 72 3.932 -8.409 -2.279
529 HA ALA 72 HA ALA 72 5.109 -6.122 -1.139
530 HB1 ALA 72 HB1 ALA 72 6.249 -8.905 -1.228
531 HB2 ALA 72 HB2 ALA 72 5.032 -8.348 -0.079
532 HB3 ALA 72 HB3 ALA 72 6.643 -7.632 -0.078
533 H ASP 73 HN ASP 73 6.283 -8.247 -3.685
534 HA ASP 73 HA ASP 73 8.839 -7.238 -4.067
535 HB2 ASP 73 HB2 ASP 73 6.862 -8.265 -6.092
536 HB3 ASP 73 HB1 ASP 73 8.525 -7.866 -6.488
537 H GLU 74 HN GLU 74 5.884 -6.210 -5.646
538 HA GLU 74 HA GLU 74 6.984 -4.198 -7.242
539 HB2 GLU 74 HB2 GLU 74 4.168 -4.571 -6.265
540 HB3 GLU 74 HB1 GLU 74 4.647 -3.390 -7.471
541 HG2 GLU 74 HG2 GLU 74 4.919 -6.373 -7.700
542 HG3 GLU 74 HG1 GLU 74 3.749 -5.350 -8.536
543 H VAL 75 HN VAL 75 5.588 -4.042 -4.015
544 HA VAL 75 HA VAL 75 5.842 -1.192 -4.026
545 HB VAL 75 HB VAL 75 5.192 -1.325 -1.565
546 HG11 VAL 75 HG11 VAL 75 3.366 -2.550 -3.624
547 HG12 VAL 75 HG12 VAL 75 3.532 -0.824 -3.291
548 HG13 VAL 75 HG13 VAL 75 2.844 -1.900 -2.078
549 HG21 VAL 75 HG21 VAL 75 5.888 -3.671 -1.204
550 HG22 VAL 75 HG22 VAL 75 4.577 -4.162 -2.302
551 HG23 VAL 75 HG23 VAL 75 4.197 -3.374 -0.782
552 H LYS 76 HN LYS 76 7.763 -3.837 -2.853
553 HA LYS 76 HA LYS 76 9.518 -2.420 -1.200
554 HB2 LYS 76 HB2 LYS 76 9.945 -4.881 -2.881
555 HB3 LYS 76 HB1 LYS 76 11.202 -4.203 -1.860
556 HG2 LYS 76 HG2 LYS 76 9.903 -4.579 0.107
557 HG3 LYS 76 HG1 LYS 76 8.509 -5.069 -0.857
558 HD2 LYS 76 HD2 LYS 76 9.659 -7.016 0.084
559 HD3 LYS 76 HD1 LYS 76 9.754 -7.016 -1.672
560 HE2 LYS 76 HE2 LYS 76 12.022 -6.139 -1.554
561 HE3 LYS 76 HE1 LYS 76 11.919 -6.085 0.204
562 HZ1 LYS 76 HZ1 LYS 76 13.095 -8.013 -0.577
563 HZ2 LYS 76 HZ2 LYS 76 11.748 -8.545 -1.454
564 HZ3 LYS 76 HZ3 LYS 76 11.698 -8.468 0.233
565 H ALA 77 HN ALA 77 9.340 -2.703 -4.647
566 HA ALA 77 HA ALA 77 11.850 -1.802 -5.431
567 HB1 ALA 77 HB1 ALA 77 10.175 -2.714 -6.972
568 HB2 ALA 77 HB2 ALA 77 10.811 -1.170 -7.538
569 HB3 ALA 77 HB3 ALA 77 9.215 -1.247 -6.792
570 H LYS 78 HN LYS 78 9.004 0.037 -4.498
571 HA LYS 78 HA LYS 78 10.439 2.490 -4.893
572 HB2 LYS 78 HB2 LYS 78 7.641 1.986 -3.935
573 HB3 LYS 78 HB1 LYS 78 8.374 3.584 -3.904
574 HG2 LYS 78 HG2 LYS 78 8.785 3.415 -6.320
575 HG3 LYS 78 HG1 LYS 78 7.972 1.854 -6.329
576 HD2 LYS 78 HD2 LYS 78 6.471 3.584 -7.077
577 HD3 LYS 78 HD1 LYS 78 5.934 2.911 -5.534
578 HE2 LYS 78 HE2 LYS 78 5.658 5.336 -5.565
579 HE3 LYS 78 HE1 LYS 78 6.847 4.878 -4.360
580 HZ1 LYS 78 HZ1 LYS 78 8.608 5.581 -5.912
581 HZ2 LYS 78 HZ2 LYS 78 7.523 6.832 -5.661
582 HZ3 LYS 78 HZ3 LYS 78 7.450 5.933 -7.076
583 H LEU 79 HN LEU 79 9.258 0.568 -2.217
584 HA LEU 79 HA LEU 79 9.705 2.283 -0.092
585 HB2 LEU 79 HB2 LEU 79 8.468 0.177 0.049
586 HB3 LEU 79 HB1 LEU 79 9.963 -0.711 -0.158
587 HG LEU 79 HG LEU 79 10.777 0.204 1.982
588 HD11 LEU 79 HD11 LEU 79 9.221 1.282 3.500
589 HD12 LEU 79 HD12 LEU 79 7.992 1.319 2.233
590 HD13 LEU 79 HD13 LEU 79 9.478 2.252 2.053
591 HD21 LEU 79 HD21 LEU 79 9.338 -1.166 3.405
592 HD22 LEU 79 HD22 LEU 79 9.716 -1.983 1.888
593 HD23 LEU 79 HD23 LEU 79 8.137 -1.234 2.116
594 H VAL 80 HN VAL 80 11.975 0.055 -1.628
595 HA VAL 80 HA VAL 80 14.055 0.253 0.202
596 HB VAL 80 HB VAL 80 13.931 -1.449 -1.596
597 HG11 VAL 80 HG11 VAL 80 13.198 -0.121 -3.443
598 HG12 VAL 80 HG12 VAL 80 14.696 -0.957 -3.863
599 HG13 VAL 80 HG13 VAL 80 14.726 0.761 -3.458
600 HG21 VAL 80 HG21 VAL 80 16.497 0.116 -1.690
601 HG22 VAL 80 HG22 VAL 80 16.299 -1.567 -2.159
602 HG23 VAL 80 HG23 VAL 80 16.071 -1.093 -0.475
603 H LYS 81 HN LYS 81 13.135 2.465 -2.344
604 HA LYS 81 HA LYS 81 15.591 3.986 -2.218
605 HB2 LYS 81 HB2 LYS 81 12.948 4.755 -3.467
606 HB3 LYS 81 HB1 LYS 81 14.487 5.556 -3.710
607 HG2 LYS 81 HG2 LYS 81 15.331 3.474 -4.762
608 HG3 LYS 81 HG1 LYS 81 13.702 2.809 -4.627
609 HD2 LYS 81 HD2 LYS 81 12.844 4.746 -5.955
610 HD3 LYS 81 HD1 LYS 81 14.496 5.304 -6.112
611 HE2 LYS 81 HE2 LYS 81 13.451 2.675 -7.125
612 HE3 LYS 81 HE1 LYS 81 13.782 4.105 -8.097
613 HZ1 LYS 81 HZ1 LYS 81 15.586 2.549 -8.215
614 HZ2 LYS 81 HZ2 LYS 81 15.794 2.525 -6.570
615 HZ3 LYS 81 HZ3 LYS 81 16.129 3.940 -7.452
616 H ILE 82 HN ILE 82 12.307 4.221 -1.097
617 HA ILE 82 HA ILE 82 12.294 6.862 -0.117
618 HB ILE 82 HB ILE 82 10.669 4.532 0.931
619 HG12 ILE 82 HG12 ILE 82 10.005 6.428 -1.330
620 HG13 ILE 82 HG11 ILE 82 10.524 4.759 -1.529
621 HG21 ILE 82 HG21 ILE 82 10.120 7.509 0.933
622 HG22 ILE 82 HG22 ILE 82 10.545 6.526 2.337
623 HG23 ILE 82 HG23 ILE 82 9.012 6.255 1.500
624 HD11 ILE 82 HD11 ILE 82 8.542 3.995 -0.363
625 HD12 ILE 82 HD12 ILE 82 8.128 4.991 -1.758
626 HD13 ILE 82 HD13 ILE 82 8.042 5.668 -0.131
627 H ALA 83 HN ALA 83 13.341 3.862 1.282
628 HA ALA 83 HA ALA 83 13.531 4.744 3.962
629 HB1 ALA 83 HB1 ALA 83 14.781 2.699 4.367
630 HB2 ALA 83 HB2 ALA 83 14.987 2.463 2.633
631 HB3 ALA 83 HB3 ALA 83 13.378 2.373 3.349
632 H GLY 84 HN GLY 84 15.294 5.743 1.352
633 HA2 GLY 84 HA2 GLY 84 17.019 7.292 1.386
634 HA3 GLY 84 HA1 GLY 84 17.345 6.868 3.064
635 H LEU 85 HN LEU 85 17.011 4.606 0.436
636 HA LEU 85 HA LEU 85 19.864 3.947 0.672
637 HB2 LEU 85 HB2 LEU 85 17.578 2.018 0.442
638 HB3 LEU 85 HB1 LEU 85 19.278 1.596 0.566
639 HG LEU 85 HG LEU 85 17.511 2.756 2.726
640 HD11 LEU 85 HD11 LEU 85 17.838 0.568 3.782
641 HD12 LEU 85 HD12 LEU 85 18.725 0.027 2.359
642 HD13 LEU 85 HD13 LEU 85 17.018 0.446 2.226
643 HD21 LEU 85 HD21 LEU 85 19.404 2.344 4.219
644 HD22 LEU 85 HD22 LEU 85 19.786 3.552 2.992
645 HD23 LEU 85 HD23 LEU 85 20.396 1.901 2.830
646 H GLU 86 HN GLU 86 20.470 2.550 -1.162
647 HA GLU 86 HA GLU 86 20.621 1.831 -3.258
648 HB2 GLU 86 HB2 GLU 86 18.426 0.852 -2.933
649 HB3 GLU 86 HB1 GLU 86 17.657 2.356 -3.412
650 HG2 GLU 86 HG2 GLU 86 18.596 2.125 -5.649
651 HG3 GLU 86 HG1 GLU 86 19.379 0.623 -5.166
652 H HIS 87 HN HIS 87 21.721 2.824 -4.695
653 HA HIS 87 HA HIS 87 20.857 5.432 -5.716
654 HB2 HIS 87 HB2 HIS 87 23.449 3.897 -6.173
655 HB3 HIS 87 HB1 HIS 87 23.082 5.457 -6.880
656 HD1 HIS 87 HD1 HIS 87 23.750 7.513 -5.480
657 HD2 HIS 87 HD2 HIS 87 23.840 3.955 -3.321
658 HE1 HIS 87 HE1 HIS 87 24.887 8.040 -3.329
659 H HIS 88 HN HIS 88 19.175 4.850 -7.087
660 HA HIS 88 HA HIS 88 19.951 3.478 -9.491
661 HB2 HIS 88 HB2 HIS 88 19.147 1.655 -8.013
662 HB3 HIS 88 HB1 HIS 88 17.634 2.514 -7.785
663 HD1 HIS 88 HD1 HIS 88 19.455 0.330 -10.232
664 HD2 HIS 88 HD2 HIS 88 15.824 2.324 -9.927
665 HE1 HIS 88 HE1 HIS 88 17.979 -0.611 -12.029
Start of MODEL 6
1 H1 MET 1 HT1 MET 1 15.017 4.992 8.708
2 H2 MET 1 HT2 MET 1 13.415 4.612 8.264
3 H3 MET 1 HT3 MET 1 13.706 5.443 9.672
4 HA MET 1 HA MET 1 14.446 7.344 8.587
5 HB2 MET 1 HB2 MET 1 14.011 5.775 6.041
6 HB3 MET 1 HB1 MET 1 14.182 7.520 6.086
7 HG2 MET 1 HG2 MET 1 16.224 5.476 6.888
8 HG3 MET 1 HG1 MET 1 16.250 6.533 5.486
9 HE1 MET 1 HE1 MET 1 16.781 10.073 7.042
10 HE2 MET 1 HE2 MET 1 15.242 9.325 6.630
11 HE3 MET 1 HE3 MET 1 16.630 9.133 5.555
12 H VAL 2 HN VAL 2 11.923 5.561 6.770
13 HA VAL 2 HA VAL 2 10.178 7.826 7.317
14 HB VAL 2 HB VAL 2 8.599 6.783 5.708
15 HG11 VAL 2 HG11 VAL 2 10.188 8.426 4.904
16 HG12 VAL 2 HG12 VAL 2 9.926 7.190 3.675
17 HG13 VAL 2 HG13 VAL 2 11.396 7.167 4.649
18 HG21 VAL 2 HG21 VAL 2 9.326 4.905 4.303
19 HG22 VAL 2 HG22 VAL 2 9.245 4.428 5.999
20 HG23 VAL 2 HG23 VAL 2 10.805 4.764 5.250
21 H THR 3 HN THR 3 8.966 8.050 8.756
22 HA THR 3 HA THR 3 8.402 6.101 10.664
23 HB THR 3 HB THR 3 6.758 8.565 10.322
24 HG1 THR 3 HG1 THR 3 8.615 9.809 10.913
25 HG21 THR 3 HG21 THR 3 6.681 7.159 12.336
26 HG22 THR 3 HG22 THR 3 7.353 8.773 12.683
27 HG23 THR 3 HG23 THR 3 8.429 7.375 12.488
28 H ALA 4 HN ALA 4 6.910 7.165 7.736
29 HA ALA 4 HA ALA 4 4.750 5.224 8.057
30 HB1 ALA 4 HB1 ALA 4 3.321 6.730 6.697
31 HB2 ALA 4 HB2 ALA 4 4.596 7.948 6.736
32 HB3 ALA 4 HB3 ALA 4 3.776 7.483 8.225
33 H ALA 5 HN ALA 5 5.318 3.677 6.713
34 HA ALA 5 HA ALA 5 7.103 4.223 4.514
35 HB1 ALA 5 HB1 ALA 5 7.072 1.780 4.193
36 HB2 ALA 5 HB2 ALA 5 5.823 1.654 5.433
37 HB3 ALA 5 HB3 ALA 5 7.429 2.235 5.859
38 H LEU 6 HN LEU 6 3.950 2.610 4.751
39 HA LEU 6 HA LEU 6 2.983 4.031 2.477
40 HB2 LEU 6 HB2 LEU 6 2.360 2.074 1.154
41 HB3 LEU 6 HB1 LEU 6 4.087 2.157 1.346
42 HG LEU 6 HG LEU 6 2.445 0.341 3.109
43 HD11 LEU 6 HD11 LEU 6 1.852 -0.261 0.876
44 HD12 LEU 6 HD12 LEU 6 3.013 -1.453 1.474
45 HD13 LEU 6 HD13 LEU 6 3.527 -0.170 0.364
46 HD21 LEU 6 HD21 LEU 6 5.304 0.263 2.144
47 HD22 LEU 6 HD22 LEU 6 4.541 -0.917 3.208
48 HD23 LEU 6 HD23 LEU 6 4.765 0.744 3.751
49 H THR 7 HN THR 7 0.832 4.119 2.450
50 HA THR 7 HA THR 7 -0.527 3.032 4.802
51 HB THR 7 HB THR 7 -1.601 5.072 2.856
52 HG1 THR 7 HG1 THR 7 -0.564 5.966 5.278
53 HG21 THR 7 HG21 THR 7 -3.005 5.687 4.760
54 HG22 THR 7 HG22 THR 7 -2.187 4.487 5.762
55 HG23 THR 7 HG23 THR 7 -3.176 3.970 4.397
56 H ILE 8 HN ILE 8 -1.815 1.389 4.501
57 HA ILE 8 HA ILE 8 -2.621 0.545 1.852
58 HB ILE 8 HB ILE 8 -2.719 -0.764 4.569
59 HG12 ILE 8 HG12 ILE 8 -1.264 -1.511 2.033
60 HG13 ILE 8 HG11 ILE 8 -0.527 -0.744 3.446
61 HG21 ILE 8 HG21 ILE 8 -3.845 -1.863 1.998
62 HG22 ILE 8 HG22 ILE 8 -4.720 -1.403 3.468
63 HG23 ILE 8 HG23 ILE 8 -3.616 -2.776 3.499
64 HD11 ILE 8 HD11 ILE 8 -1.759 -3.483 3.289
65 HD12 ILE 8 HD12 ILE 8 -1.018 -2.754 4.727
66 HD13 ILE 8 HD13 ILE 8 -0.039 -3.110 3.312
67 H TYR 9 HN TYR 9 -4.374 1.409 1.073
68 HA TYR 9 HA TYR 9 -6.636 1.966 2.842
69 HB2 TYR 9 HB2 TYR 9 -6.168 2.683 -0.051
70 HB3 TYR 9 HB1 TYR 9 -7.621 3.067 0.856
71 HD1 TYR 9 HD1 TYR 9 -7.357 4.507 2.924
72 HD2 TYR 9 HD2 TYR 9 -4.365 4.117 -0.047
73 HE1 TYR 9 HE1 TYR 9 -6.356 6.589 3.688
74 HE2 TYR 9 HE2 TYR 9 -3.351 6.206 0.697
75 HH TYR 9 HH TYR 9 -4.302 7.765 3.611
76 H THR 10 HN THR 10 -7.973 0.380 3.122
77 HA THR 10 HA THR 10 -9.168 -0.872 0.896
78 HB THR 10 HB THR 10 -7.112 -2.246 1.088
79 HG1 THR 10 HG1 THR 10 -9.471 -3.617 1.949
80 HG21 THR 10 HG21 THR 10 -6.734 -3.682 3.052
81 HG22 THR 10 HG22 THR 10 -8.123 -2.947 3.850
82 HG23 THR 10 HG23 THR 10 -6.698 -1.973 3.507
83 H THR 11 HN THR 11 -11.103 -1.756 1.500
84 HA THR 11 HA THR 11 -11.998 -1.393 4.208
85 HB THR 11 HB THR 11 -13.861 -2.744 2.603
86 HG1 THR 11 HG1 THR 11 -13.139 -2.291 0.631
87 HG21 THR 11 HG21 THR 11 -14.380 -0.958 4.170
88 HG22 THR 11 HG22 THR 11 -15.007 -0.549 2.569
89 HG23 THR 11 HG23 THR 11 -13.513 0.194 3.161
90 H SER 12 HN SER 12 -12.732 -3.180 5.417
91 HA SER 12 HA SER 12 -11.027 -5.407 5.246
92 HB2 SER 12 HB2 SER 12 -13.521 -5.004 6.880
93 HB3 SER 12 HB1 SER 12 -12.301 -6.247 7.166
94 HG SER 12 HG SER 12 -11.679 -3.465 7.096
95 H TRP 13 HN TRP 13 -14.089 -4.767 3.830
96 HA TRP 13 HA TRP 13 -14.642 -7.540 3.398
97 HB2 TRP 13 HB2 TRP 13 -16.616 -6.693 2.027
98 HB3 TRP 13 HB1 TRP 13 -16.619 -6.371 3.749
99 HD1 TRP 13 HD1 TRP 13 -16.782 -3.917 4.502
100 HE1 TRP 13 HE1 TRP 13 -17.089 -1.682 3.313
101 HE3 TRP 13 HE3 TRP 13 -15.838 -5.453 -0.283
102 HZ2 TRP 13 HZ2 TRP 13 -16.935 -0.679 0.648
103 HZ3 TRP 13 HZ3 TRP 13 -15.935 -3.791 -2.095
104 HH2 TRP 13 HH2 TRP 13 -16.472 -1.454 -1.639
105 H CYS 14 HN CYS 14 -12.463 -5.676 1.974
106 HA CYS 14 HA CYS 14 -12.877 -6.498 -0.745
107 HB2 CYS 14 HB2 CYS 14 -10.492 -5.315 0.685
108 HB3 CYS 14 HB1 CYS 14 -10.525 -5.640 -1.043
109 HG CYS 14 HG CYS 14 -11.681 -3.556 -1.762
110 H GLY 15 HN GLY 15 -11.614 -8.076 -1.849
111 HA2 GLY 15 HA2 GLY 15 -11.159 -10.406 -0.220
112 HA3 GLY 15 HA1 GLY 15 -11.055 -10.302 -1.969
113 H TYR 16 HN TYR 16 -9.143 -8.151 -1.987
114 HA TYR 16 HA TYR 16 -6.813 -9.807 -1.715
115 HB2 TYR 16 HB2 TYR 16 -7.150 -7.024 -2.744
116 HB3 TYR 16 HB1 TYR 16 -5.585 -7.826 -2.667
117 HD1 TYR 16 HD1 TYR 16 -5.734 -10.315 -3.782
118 HD2 TYR 16 HD2 TYR 16 -8.130 -6.965 -4.781
119 HE1 TYR 16 HE1 TYR 16 -6.110 -11.264 -6.010
120 HE2 TYR 16 HE2 TYR 16 -8.537 -7.905 -7.009
121 HH TYR 16 HH TYR 16 -7.729 -11.107 -7.770
122 H CYS 17 HN CYS 17 -8.333 -7.851 0.456
123 HA CYS 17 HA CYS 17 -6.336 -6.204 1.468
124 HB2 CYS 17 HB2 CYS 17 -7.663 -6.094 3.549
125 HB3 CYS 17 HB1 CYS 17 -8.670 -5.920 2.121
126 HG CYS 17 HG CYS 17 -10.198 -8.029 2.495
127 H LEU 18 HN LEU 18 -7.211 -9.445 2.636
128 HA LEU 18 HA LEU 18 -4.836 -9.512 4.247
129 HB2 LEU 18 HB2 LEU 18 -5.537 -11.689 5.063
130 HB3 LEU 18 HB1 LEU 18 -6.830 -10.533 5.173
131 HG LEU 18 HG LEU 18 -7.749 -12.619 4.674
132 HD11 LEU 18 HD11 LEU 18 -7.851 -11.057 2.127
133 HD12 LEU 18 HD12 LEU 18 -8.879 -10.860 3.545
134 HD13 LEU 18 HD13 LEU 18 -8.965 -12.343 2.596
135 HD21 LEU 18 HD21 LEU 18 -5.867 -12.897 2.337
136 HD22 LEU 18 HD22 LEU 18 -7.195 -13.998 2.679
137 HD23 LEU 18 HD23 LEU 18 -5.861 -13.845 3.822
138 H ARG 19 HN ARG 19 -5.692 -10.409 1.126
139 HA ARG 19 HA ARG 19 -3.952 -12.591 0.659
140 HB2 ARG 19 HB2 ARG 19 -5.877 -11.888 -0.801
141 HB3 ARG 19 HB1 ARG 19 -4.898 -10.535 -1.340
142 HG2 ARG 19 HG2 ARG 19 -4.797 -12.243 -3.009
143 HG3 ARG 19 HG1 ARG 19 -3.225 -12.168 -2.211
144 HD2 ARG 19 HD2 ARG 19 -3.963 -14.484 -2.552
145 HD3 ARG 19 HD1 ARG 19 -3.817 -14.098 -0.835
146 HE ARG 19 HE ARG 19 -6.437 -13.632 -1.828
147 HH11 ARG 19 HH11 ARG 19 -4.324 -16.247 -0.725
148 HH12 ARG 19 HH12 ARG 19 -5.602 -17.246 -0.212
149 HH21 ARG 19 HH21 ARG 19 -8.192 -15.005 -1.100
150 HH22 ARG 19 HH22 ARG 19 -7.842 -16.516 -0.408
151 H LEU 20 HN LEU 20 -3.621 -9.090 0.268
152 HA LEU 20 HA LEU 20 -1.036 -9.292 -0.861
153 HB2 LEU 20 HB2 LEU 20 -2.662 -7.348 -1.161
154 HB3 LEU 20 HB1 LEU 20 -2.244 -6.878 0.460
155 HG LEU 20 HG LEU 20 0.132 -6.687 -0.228
156 HD11 LEU 20 HD11 LEU 20 -0.944 -7.110 -2.986
157 HD12 LEU 20 HD12 LEU 20 0.324 -8.035 -2.146
158 HD13 LEU 20 HD13 LEU 20 0.603 -6.374 -2.614
159 HD21 LEU 20 HD21 LEU 20 -0.124 -4.533 -1.395
160 HD22 LEU 20 HD22 LEU 20 -1.220 -4.687 -0.021
161 HD23 LEU 20 HD23 LEU 20 -1.829 -4.899 -1.667
162 H LYS 21 HN LYS 21 -2.269 -9.265 2.340
163 HA LYS 21 HA LYS 21 -0.065 -8.196 3.740
164 HB2 LYS 21 HB2 LYS 21 -2.065 -10.234 4.702
165 HB3 LYS 21 HB1 LYS 21 -0.898 -9.389 5.705
166 HG2 LYS 21 HG2 LYS 21 -3.203 -8.175 4.220
167 HG3 LYS 21 HG1 LYS 21 -3.064 -8.432 5.963
168 HD2 LYS 21 HD2 LYS 21 -0.978 -6.962 5.803
169 HD3 LYS 21 HD1 LYS 21 -1.583 -6.513 4.206
170 HE2 LYS 21 HE2 LYS 21 -3.010 -6.197 6.829
171 HE3 LYS 21 HE1 LYS 21 -2.311 -4.909 5.866
172 HZ1 LYS 21 HZ1 LYS 21 -3.986 -5.394 4.134
173 HZ2 LYS 21 HZ2 LYS 21 -4.685 -5.038 5.642
174 HZ3 LYS 21 HZ3 LYS 21 -4.622 -6.616 5.118
175 H THR 22 HN THR 22 -0.807 -11.442 2.592
176 HA THR 22 HA THR 22 1.045 -12.936 3.965
177 HB THR 22 HB THR 22 0.432 -13.310 1.044
178 HG1 THR 22 HG1 THR 22 -1.261 -13.679 3.313
179 HG21 THR 22 HG21 THR 22 0.698 -15.229 3.374
180 HG22 THR 22 HG22 THR 22 1.924 -14.939 2.143
181 HG23 THR 22 HG23 THR 22 0.391 -15.688 1.699
182 H ALA 23 HN ALA 23 1.375 -11.153 0.921
183 HA ALA 23 HA ALA 23 4.057 -11.927 0.440
184 HB1 ALA 23 HB1 ALA 23 3.980 -10.330 -1.395
185 HB2 ALA 23 HB2 ALA 23 2.516 -9.612 -0.731
186 HB3 ALA 23 HB3 ALA 23 2.484 -11.264 -1.344
187 H LEU 24 HN LEU 24 2.547 -9.087 1.875
188 HA LEU 24 HA LEU 24 4.941 -7.580 2.163
189 HB2 LEU 24 HB2 LEU 24 2.384 -7.426 3.733
190 HB3 LEU 24 HB1 LEU 24 3.672 -6.252 3.847
191 HG LEU 24 HG LEU 24 1.936 -6.763 1.419
192 HD11 LEU 24 HD11 LEU 24 0.703 -5.723 3.216
193 HD12 LEU 24 HD12 LEU 24 1.051 -4.496 1.980
194 HD13 LEU 24 HD13 LEU 24 1.994 -4.560 3.455
195 HD21 LEU 24 HD21 LEU 24 4.116 -4.727 1.926
196 HD22 LEU 24 HD22 LEU 24 2.938 -4.598 0.647
197 HD23 LEU 24 HD23 LEU 24 4.077 -5.930 0.625
198 H THR 25 HN THR 25 3.245 -9.745 4.361
199 HA THR 25 HA THR 25 4.912 -9.256 6.584
200 HB THR 25 HB THR 25 3.246 -11.725 6.019
201 HG1 THR 25 HG1 THR 25 1.899 -10.036 5.864
202 HG21 THR 25 HG21 THR 25 3.099 -11.870 8.482
203 HG22 THR 25 HG22 THR 25 4.131 -10.449 8.627
204 HG23 THR 25 HG23 THR 25 4.780 -11.940 7.949
205 H ALA 26 HN ALA 26 4.990 -11.673 3.995
206 HA ALA 26 HA ALA 26 7.084 -13.270 4.936
207 HB1 ALA 26 HB1 ALA 26 5.641 -13.904 3.065
208 HB2 ALA 26 HB2 ALA 26 7.345 -13.971 2.603
209 HB3 ALA 26 HB3 ALA 26 6.346 -12.618 2.086
210 H ASN 27 HN ASN 27 7.112 -10.137 3.579
211 HA ASN 27 HA ASN 27 10.033 -10.208 3.270
212 HB2 ASN 27 HB2 ASN 27 7.952 -8.412 2.057
213 HB3 ASN 27 HB1 ASN 27 9.670 -8.020 2.024
214 HD21 ASN 27 HD21 ASN 27 7.188 -10.173 0.834
215 HD22 ASN 27 HD22 ASN 27 8.141 -10.857 -0.422
216 H ARG 28 HN ARG 28 7.934 -9.612 5.559
217 HA ARG 28 HA ARG 28 7.679 -8.313 7.356
218 HB2 ARG 28 HB2 ARG 28 10.695 -8.318 7.135
219 HB3 ARG 28 HB1 ARG 28 9.833 -7.726 8.547
220 HG2 ARG 28 HG2 ARG 28 9.638 -10.528 7.458
221 HG3 ARG 28 HG1 ARG 28 10.639 -10.043 8.829
222 HD2 ARG 28 HD2 ARG 28 8.655 -9.369 10.070
223 HD3 ARG 28 HD1 ARG 28 7.634 -9.731 8.682
224 HE ARG 28 HE ARG 28 9.045 -12.026 9.360
225 HH11 ARG 28 HH11 ARG 28 6.510 -9.980 10.778
226 HH12 ARG 28 HH12 ARG 28 5.714 -11.296 11.533
227 HH21 ARG 28 HH21 ARG 28 7.916 -13.779 10.403
228 HH22 ARG 28 HH22 ARG 28 6.511 -13.465 11.329
229 H ILE 29 HN ILE 29 7.035 -6.903 5.264
230 HA ILE 29 HA ILE 29 8.411 -4.359 5.232
231 HB ILE 29 HB ILE 29 5.831 -5.185 3.857
232 HG12 ILE 29 HG12 ILE 29 8.600 -4.958 2.641
233 HG13 ILE 29 HG11 ILE 29 7.920 -6.487 3.205
234 HG21 ILE 29 HG21 ILE 29 6.177 -3.188 2.469
235 HG22 ILE 29 HG22 ILE 29 7.665 -2.834 3.354
236 HG23 ILE 29 HG23 ILE 29 6.125 -2.739 4.183
237 HD11 ILE 29 HD11 ILE 29 6.120 -6.154 1.538
238 HD12 ILE 29 HD12 ILE 29 7.738 -6.316 0.880
239 HD13 ILE 29 HD13 ILE 29 6.980 -4.715 0.969
240 H ALA 30 HN ALA 30 7.920 -2.710 6.474
241 HA ALA 30 HA ALA 30 5.702 -2.838 8.306
242 HB1 ALA 30 HB1 ALA 30 7.861 -1.906 9.006
243 HB2 ALA 30 HB2 ALA 30 6.577 -0.688 9.110
244 HB3 ALA 30 HB3 ALA 30 7.708 -0.675 7.752
245 H TYR 31 HN TYR 31 3.804 -1.763 8.104
246 HA TYR 31 HA TYR 31 3.455 0.226 6.034
247 HB2 TYR 31 HB2 TYR 31 1.436 -1.010 5.146
248 HB3 TYR 31 HB1 TYR 31 2.978 -1.754 4.750
249 HD1 TYR 31 HD1 TYR 31 -0.009 -2.035 6.927
250 HD2 TYR 31 HD2 TYR 31 3.485 -3.966 5.479
251 HE1 TYR 31 HE1 TYR 31 -0.804 -4.170 7.850
252 HE2 TYR 31 HE2 TYR 31 2.698 -6.102 6.406
253 HH TYR 31 HH TYR 31 1.213 -6.878 8.138
254 H ASP 32 HN ASP 32 1.265 1.203 6.197
255 HA ASP 32 HA ASP 32 0.187 1.044 8.934
256 HB2 ASP 32 HB2 ASP 32 1.319 3.210 8.520
257 HB3 ASP 32 HB1 ASP 32 0.348 3.440 7.074
258 H GLU 33 HN GLU 33 -2.059 0.872 9.084
259 HA GLU 33 HA GLU 33 -3.478 0.621 6.503
260 HB2 GLU 33 HB2 GLU 33 -3.868 -0.945 9.035
261 HB3 GLU 33 HB1 GLU 33 -4.906 -1.037 7.624
262 HG2 GLU 33 HG2 GLU 33 -3.020 -1.888 6.325
263 HG3 GLU 33 HG1 GLU 33 -2.011 -1.806 7.776
264 H VAL 34 HN VAL 34 -5.288 1.785 6.304
265 HA VAL 34 HA VAL 34 -6.789 2.411 8.671
266 HB VAL 34 HB VAL 34 -5.477 4.490 8.202
267 HG11 VAL 34 HG11 VAL 34 -5.849 5.833 6.236
268 HG12 VAL 34 HG12 VAL 34 -6.852 4.563 5.547
269 HG13 VAL 34 HG13 VAL 34 -5.129 4.273 5.833
270 HG21 VAL 34 HG21 VAL 34 -7.347 6.066 8.123
271 HG22 VAL 34 HG22 VAL 34 -7.654 4.717 9.217
272 HG23 VAL 34 HG23 VAL 34 -8.415 4.755 7.625
273 H ASP 35 HN ASP 35 -8.891 1.907 8.378
274 HA ASP 35 HA ASP 35 -9.550 0.737 5.816
275 HB2 ASP 35 HB2 ASP 35 -10.166 -0.179 8.124
276 HB3 ASP 35 HB1 ASP 35 -11.381 1.088 8.193
277 H ILE 36 HN ILE 36 -11.085 1.478 4.435
278 HA ILE 36 HA ILE 36 -11.484 4.335 4.531
279 HB ILE 36 HB ILE 36 -12.168 4.208 2.199
280 HG12 ILE 36 HG12 ILE 36 -11.718 1.233 2.472
281 HG13 ILE 36 HG11 ILE 36 -13.308 2.008 2.381
282 HG21 ILE 36 HG21 ILE 36 -9.684 2.633 2.877
283 HG22 ILE 36 HG22 ILE 36 -9.810 4.388 2.747
284 HG23 ILE 36 HG23 ILE 36 -10.015 3.381 1.319
285 HD11 ILE 36 HD11 ILE 36 -12.692 1.030 0.286
286 HD12 ILE 36 HD12 ILE 36 -11.191 1.956 0.253
287 HD13 ILE 36 HD13 ILE 36 -12.756 2.787 0.143
288 H GLU 37 HN GLU 37 -13.345 1.722 5.486
289 HA GLU 37 HA GLU 37 -15.893 2.449 4.581
290 HB2 GLU 37 HB2 GLU 37 -15.256 0.288 5.679
291 HB3 GLU 37 HB1 GLU 37 -15.194 1.136 7.212
292 HG2 GLU 37 HG2 GLU 37 -17.270 0.001 7.110
293 HG3 GLU 37 HG1 GLU 37 -17.599 1.715 6.894
294 H HIS 38 HN HIS 38 -14.112 3.324 7.480
295 HA HIS 38 HA HIS 38 -16.198 5.217 8.222
296 HB2 HIS 38 HB2 HIS 38 -13.698 4.331 9.666
297 HB3 HIS 38 HB1 HIS 38 -14.700 5.650 10.242
298 HD1 HIS 38 HD1 HIS 38 -16.293 4.888 12.028
299 HD2 HIS 38 HD2 HIS 38 -15.474 1.872 9.287
300 HE1 HIS 38 HE1 HIS 38 -17.548 2.871 12.823
301 H ASN 39 HN ASN 39 -13.034 5.190 6.826
302 HA ASN 39 HA ASN 39 -12.907 8.094 7.016
303 HB2 ASN 39 HB2 ASN 39 -10.806 6.086 6.165
304 HB3 ASN 39 HB1 ASN 39 -10.623 7.810 5.900
305 HD21 ASN 39 HD21 ASN 39 -8.918 8.027 7.181
306 HD22 ASN 39 HD22 ASN 39 -8.954 7.788 8.888
307 H ARG 40 HN ARG 40 -14.357 8.817 5.627
308 HA ARG 40 HA ARG 40 -14.639 7.592 3.075
309 HB2 ARG 40 HB2 ARG 40 -16.601 8.394 4.281
310 HB3 ARG 40 HB1 ARG 40 -16.001 10.039 4.182
311 HG2 ARG 40 HG2 ARG 40 -16.426 10.188 1.902
312 HG3 ARG 40 HG1 ARG 40 -16.524 8.435 1.709
313 HD2 ARG 40 HD2 ARG 40 -18.461 10.130 3.269
314 HD3 ARG 40 HD1 ARG 40 -18.739 9.500 1.642
315 HE ARG 40 HE ARG 40 -18.163 7.283 2.969
316 HH11 ARG 40 HH11 ARG 40 -20.385 9.889 3.847
317 HH12 ARG 40 HH12 ARG 40 -21.468 8.889 4.696
318 HH21 ARG 40 HH21 ARG 40 -19.632 5.908 4.147
319 HH22 ARG 40 HH22 ARG 40 -21.031 6.558 4.848
320 H ALA 41 HN ALA 41 -12.880 10.349 4.268
321 HA ALA 41 HA ALA 41 -12.498 11.523 1.700
322 HB1 ALA 41 HB1 ALA 41 -10.625 12.718 2.687
323 HB2 ALA 41 HB2 ALA 41 -10.659 11.678 4.102
324 HB3 ALA 41 HB3 ALA 41 -12.008 12.781 3.782
325 H ALA 42 HN ALA 42 -10.979 9.010 3.524
326 HA ALA 42 HA ALA 42 -8.833 8.570 1.713
327 HB1 ALA 42 HB1 ALA 42 -8.506 6.472 2.879
328 HB2 ALA 42 HB2 ALA 42 -10.042 6.679 3.732
329 HB3 ALA 42 HB3 ALA 42 -8.699 7.792 4.027
330 H ALA 43 HN ALA 43 -12.053 7.200 2.164
331 HA ALA 43 HA ALA 43 -11.984 5.235 0.159
332 HB1 ALA 43 HB1 ALA 43 -14.411 5.302 0.203
333 HB2 ALA 43 HB2 ALA 43 -14.368 6.876 0.988
334 HB3 ALA 43 HB3 ALA 43 -13.799 5.449 1.857
335 H GLU 44 HN GLU 44 -12.777 8.633 0.033
336 HA GLU 44 HA GLU 44 -13.510 8.917 -2.641
337 HB2 GLU 44 HB2 GLU 44 -13.734 10.661 -0.898
338 HB3 GLU 44 HB1 GLU 44 -11.988 10.806 -0.823
339 HG2 GLU 44 HG2 GLU 44 -12.855 12.645 -2.054
340 HG3 GLU 44 HG1 GLU 44 -12.018 11.584 -3.180
341 H PHE 45 HN PHE 45 -10.416 9.337 -1.041
342 HA PHE 45 HA PHE 45 -8.780 9.856 -3.201
343 HB2 PHE 45 HB2 PHE 45 -8.164 10.232 -0.846
344 HB3 PHE 45 HB1 PHE 45 -8.116 8.497 -0.590
345 HD1 PHE 45 HD2 PHE 45 -6.520 11.241 -2.471
346 HD2 PHE 45 HD1 PHE 45 -6.196 7.247 -1.037
347 HE1 PHE 45 HE2 PHE 45 -4.160 11.194 -3.146
348 HE2 PHE 45 HE1 PHE 45 -3.836 7.200 -1.709
349 HZ PHE 45 HZ PHE 45 -2.815 9.173 -2.762
350 H VAL 46 HN VAL 46 -9.169 6.711 -1.542
351 HA VAL 46 HA VAL 46 -7.592 5.326 -3.451
352 HB VAL 46 HB VAL 46 -7.781 4.402 -1.212
353 HG11 VAL 46 HG11 VAL 46 -9.759 3.243 -0.568
354 HG12 VAL 46 HG12 VAL 46 -10.653 4.061 -1.876
355 HG13 VAL 46 HG13 VAL 46 -9.905 5.004 -0.537
356 HG21 VAL 46 HG21 VAL 46 -7.437 2.876 -3.081
357 HG22 VAL 46 HG22 VAL 46 -9.183 2.513 -3.030
358 HG23 VAL 46 HG23 VAL 46 -8.150 2.138 -1.645
359 H GLY 47 HN GLY 47 -11.010 6.005 -3.365
360 HA2 GLY 47 HA2 GLY 47 -11.754 4.154 -5.375
361 HA3 GLY 47 HA1 GLY 47 -12.649 5.598 -4.916
362 H SER 48 HN SER 48 -10.388 7.371 -5.515
363 HA SER 48 HA SER 48 -10.922 7.626 -8.312
364 HB2 SER 48 HB2 SER 48 -9.523 9.724 -8.100
365 HB3 SER 48 HB1 SER 48 -10.966 9.655 -7.087
366 HG SER 48 HG SER 48 -8.777 8.643 -5.776
367 H VAL 49 HN VAL 49 -8.392 6.261 -6.448
368 HA VAL 49 HA VAL 49 -6.593 6.273 -8.777
369 HB VAL 49 HB VAL 49 -4.770 5.710 -7.168
370 HG11 VAL 49 HG11 VAL 49 -5.161 8.048 -7.722
371 HG12 VAL 49 HG12 VAL 49 -4.674 7.882 -6.020
372 HG13 VAL 49 HG13 VAL 49 -6.368 8.142 -6.434
373 HG21 VAL 49 HG21 VAL 49 -6.857 6.191 -5.070
374 HG22 VAL 49 HG22 VAL 49 -5.149 5.839 -4.776
375 HG23 VAL 49 HG23 VAL 49 -6.211 4.610 -5.491
376 H ASN 50 HN ASN 50 -8.923 4.500 -7.863
377 HA ASN 50 HA ASN 50 -7.584 1.921 -7.636
378 HB2 ASN 50 HB2 ASN 50 -10.022 2.940 -6.647
379 HB3 ASN 50 HB1 ASN 50 -10.458 1.720 -7.840
380 HD21 ASN 50 HD21 ASN 50 -7.686 1.860 -5.705
381 HD22 ASN 50 HD22 ASN 50 -8.078 0.410 -4.862
382 H GLY 51 HN GLY 51 -9.208 0.201 -8.901
383 HA2 GLY 51 HA2 GLY 51 -8.940 0.908 -11.693
384 HA3 GLY 51 HA1 GLY 51 -9.339 -0.684 -11.042
385 H GLY 52 HN GLY 52 -10.632 2.581 -11.314
386 HA2 GLY 52 HA2 GLY 52 -12.695 3.174 -12.227
387 HA3 GLY 52 HA1 GLY 52 -13.165 1.480 -12.191
388 H ASN 53 HN ASN 53 -13.326 0.611 -9.889
389 HA ASN 53 HA ASN 53 -14.858 2.535 -8.239
390 HB2 ASN 53 HB2 ASN 53 -16.178 0.723 -9.521
391 HB3 ASN 53 HB1 ASN 53 -15.373 -0.449 -8.491
392 HD21 ASN 53 HD21 ASN 53 -18.177 0.016 -8.752
393 HD22 ASN 53 HD22 ASN 53 -18.779 0.479 -7.212
394 H ARG 54 HN ARG 54 -14.606 2.142 -5.936
395 HA ARG 54 HA ARG 54 -12.004 1.168 -5.315
396 HB2 ARG 54 HB2 ARG 54 -12.268 1.943 -3.079
397 HB3 ARG 54 HB1 ARG 54 -13.192 3.078 -4.029
398 HG2 ARG 54 HG2 ARG 54 -14.337 0.808 -2.392
399 HG3 ARG 54 HG1 ARG 54 -14.271 2.494 -1.898
400 HD2 ARG 54 HD2 ARG 54 -15.804 3.106 -3.649
401 HD3 ARG 54 HD1 ARG 54 -15.759 1.465 -4.311
402 HE ARG 54 HE ARG 54 -16.744 1.984 -1.584
403 HH11 ARG 54 HH11 ARG 54 -17.377 0.792 -4.862
404 HH12 ARG 54 HH12 ARG 54 -18.779 -0.050 -4.434
405 HH21 ARG 54 HH21 ARG 54 -18.645 0.829 -1.008
406 HH22 ARG 54 HH22 ARG 54 -19.509 -0.075 -2.171
407 H THR 55 HN THR 55 -11.459 -0.776 -5.141
408 HA THR 55 HA THR 55 -13.046 -2.714 -3.714
409 HB THR 55 HB THR 55 -14.072 -2.832 -5.942
410 HG1 THR 55 HG1 THR 55 -14.166 -4.909 -5.957
411 HG21 THR 55 HG21 THR 55 -11.303 -3.478 -6.963
412 HG22 THR 55 HG22 THR 55 -12.218 -2.020 -7.311
413 HG23 THR 55 HG23 THR 55 -12.778 -3.582 -7.925
414 H VAL 56 HN VAL 56 -10.078 -1.784 -5.353
415 HA VAL 56 HA VAL 56 -8.766 -4.064 -4.107
416 HB VAL 56 HB VAL 56 -6.847 -3.628 -5.683
417 HG11 VAL 56 HG11 VAL 56 -8.486 -5.412 -6.105
418 HG12 VAL 56 HG12 VAL 56 -7.904 -4.706 -7.607
419 HG13 VAL 56 HG13 VAL 56 -9.498 -4.274 -6.995
420 HG21 VAL 56 HG21 VAL 56 -8.845 -1.835 -7.064
421 HG22 VAL 56 HG22 VAL 56 -7.292 -2.338 -7.729
422 HG23 VAL 56 HG23 VAL 56 -7.348 -1.323 -6.286
423 HA PRO 57 HA PRO 57 -6.765 -1.475 -1.211
424 HB2 PRO 57 HB2 PRO 57 -4.400 -2.875 -0.924
425 HB3 PRO 57 HB1 PRO 57 -5.909 -3.328 -0.131
426 HG2 PRO 57 HG2 PRO 57 -4.666 -4.431 -2.603
427 HG3 PRO 57 HG1 PRO 57 -5.537 -5.272 -1.309
428 HD2 PRO 57 HD2 PRO 57 -6.661 -4.682 -3.701
429 HD3 PRO 57 HD1 PRO 57 -7.607 -4.738 -2.191
430 H THR 58 HN THR 58 -5.660 0.345 -1.457
431 HA THR 58 HA THR 58 -3.671 0.411 -3.602
432 HB THR 58 HB THR 58 -5.282 2.777 -2.599
433 HG1 THR 58 HG1 THR 58 -6.197 0.798 -3.820
434 HG21 THR 58 HG21 THR 58 -3.644 2.340 -5.103
435 HG22 THR 58 HG22 THR 58 -3.157 3.340 -3.720
436 HG23 THR 58 HG23 THR 58 -4.556 3.786 -4.702
437 H VAL 59 HN VAL 59 -1.676 1.258 -3.064
438 HA VAL 59 HA VAL 59 -1.346 1.867 -0.234
439 HB VAL 59 HB VAL 59 1.028 1.235 -0.503
440 HG11 VAL 59 HG11 VAL 59 0.685 -1.193 -0.845
441 HG12 VAL 59 HG12 VAL 59 -0.963 -0.846 -1.392
442 HG13 VAL 59 HG13 VAL 59 -0.472 -0.461 0.260
443 HG21 VAL 59 HG21 VAL 59 1.349 1.746 -2.860
444 HG22 VAL 59 HG22 VAL 59 0.236 0.461 -3.314
445 HG23 VAL 59 HG23 VAL 59 1.772 0.064 -2.542
446 H LYS 60 HN LYS 60 -0.768 3.796 0.349
447 HA LYS 60 HA LYS 60 0.254 5.674 -1.692
448 HB2 LYS 60 HB2 LYS 60 -1.816 6.392 -0.326
449 HB3 LYS 60 HB1 LYS 60 -0.763 6.383 1.081
450 HG2 LYS 60 HG2 LYS 60 0.572 8.144 0.138
451 HG3 LYS 60 HG1 LYS 60 -0.322 8.065 -1.370
452 HD2 LYS 60 HD2 LYS 60 -1.272 9.909 -0.320
453 HD3 LYS 60 HD1 LYS 60 -2.394 8.623 0.082
454 HE2 LYS 60 HE2 LYS 60 -0.210 9.671 1.885
455 HE3 LYS 60 HE1 LYS 60 -1.901 10.144 1.965
456 HZ1 LYS 60 HZ1 LYS 60 -0.771 7.460 2.546
457 HZ2 LYS 60 HZ2 LYS 60 -2.449 7.853 2.571
458 HZ3 LYS 60 HZ3 LYS 60 -1.389 8.570 3.637
459 H PHE 61 HN PHE 61 2.360 5.992 -1.620
460 HA PHE 61 HA PHE 61 3.860 4.886 0.588
461 HB2 PHE 61 HB2 PHE 61 4.782 6.274 -1.928
462 HB3 PHE 61 HB1 PHE 61 5.848 5.542 -0.738
463 HD1 PHE 61 HD1 PHE 61 3.196 4.851 -3.180
464 HD2 PHE 61 HD2 PHE 61 6.280 3.236 -0.748
465 HE1 PHE 61 HE1 PHE 61 2.963 2.736 -4.332
466 HE2 PHE 61 HE2 PHE 61 6.068 1.078 -1.903
467 HZ PHE 61 HZ PHE 61 4.410 0.820 -3.714
468 H ALA 62 HN ALA 62 5.783 6.219 1.340
469 HA ALA 62 HA ALA 62 4.946 8.436 2.780
470 HB1 ALA 62 HB1 ALA 62 6.906 7.080 3.357
471 HB2 ALA 62 HB2 ALA 62 7.302 8.794 3.288
472 HB3 ALA 62 HB3 ALA 62 7.757 7.732 1.959
473 H ASP 63 HN ASP 63 6.170 8.237 -0.478
474 HA ASP 63 HA ASP 63 6.835 11.016 -0.682
475 HB2 ASP 63 HB2 ASP 63 7.318 10.608 -2.987
476 HB3 ASP 63 HB1 ASP 63 7.854 9.188 -2.108
477 H GLY 64 HN GLY 64 3.929 9.265 -0.771
478 HA2 GLY 64 HA2 GLY 64 1.883 10.459 -0.604
479 HA3 GLY 64 HA1 GLY 64 2.555 11.685 -1.664
480 H SER 65 HN SER 65 3.553 9.376 -3.463
481 HA SER 65 HA SER 65 1.153 9.388 -5.058
482 HB2 SER 65 HB2 SER 65 3.777 8.010 -5.625
483 HB3 SER 65 HB1 SER 65 2.532 8.465 -6.795
484 HG SER 65 HG SER 65 4.414 9.972 -5.451
485 H THR 66 HN THR 66 0.250 7.381 -6.001
486 HA THR 66 HA THR 66 0.345 5.200 -4.051
487 HB THR 66 HB THR 66 -1.900 4.616 -4.916
488 HG1 THR 66 HG1 THR 66 -1.999 7.193 -6.074
489 HG21 THR 66 HG21 THR 66 -1.675 5.887 -2.873
490 HG22 THR 66 HG22 THR 66 -3.105 6.405 -3.766
491 HG23 THR 66 HG23 THR 66 -1.637 7.398 -3.785
492 H LEU 67 HN LEU 67 -0.000 3.116 -4.874
493 HA LEU 67 HA LEU 67 0.168 2.714 -7.747
494 HB2 LEU 67 HB2 LEU 67 1.702 1.157 -5.632
495 HB3 LEU 67 HB1 LEU 67 1.489 0.583 -7.271
496 HG LEU 67 HG LEU 67 3.072 3.026 -6.413
497 HD11 LEU 67 HD11 LEU 67 4.147 0.801 -5.928
498 HD12 LEU 67 HD12 LEU 67 5.029 1.789 -7.075
499 HD13 LEU 67 HD13 LEU 67 4.044 0.446 -7.653
500 HD21 LEU 67 HD21 LEU 67 3.791 3.095 -8.778
501 HD22 LEU 67 HD22 LEU 67 2.085 3.451 -8.573
502 HD23 LEU 67 HD23 LEU 67 2.588 1.862 -9.158
503 H THR 68 HN THR 68 -1.621 1.666 -8.362
504 HA THR 68 HA THR 68 -3.535 0.668 -6.564
505 HB THR 68 HB THR 68 -3.198 -0.031 -9.509
506 HG1 THR 68 HG1 THR 68 -4.674 2.199 -8.433
507 HG21 THR 68 HG21 THR 68 -5.648 0.179 -7.741
508 HG22 THR 68 HG22 THR 68 -4.928 -1.322 -8.321
509 HG23 THR 68 HG23 THR 68 -5.655 -0.190 -9.463
510 H ASN 69 HN ASN 69 -3.914 -1.456 -5.850
511 HA ASN 69 HA ASN 69 -2.353 -2.928 -4.655
512 HB2 ASN 69 HB2 ASN 69 -3.476 -5.102 -5.093
513 HB3 ASN 69 HB1 ASN 69 -4.570 -3.762 -4.815
514 HD21 ASN 69 HD21 ASN 69 -5.086 -6.328 -6.097
515 HD22 ASN 69 HD22 ASN 69 -5.634 -5.958 -7.695
516 HA PRO 70 HA PRO 70 1.079 -4.405 -7.175
517 HB2 PRO 70 HB2 PRO 70 2.943 -3.064 -5.845
518 HB3 PRO 70 HB1 PRO 70 1.935 -2.245 -7.047
519 HG2 PRO 70 HG2 PRO 70 1.864 -2.053 -4.090
520 HG3 PRO 70 HG1 PRO 70 1.344 -0.872 -5.307
521 HD2 PRO 70 HD2 PRO 70 -0.252 -2.747 -3.811
522 HD3 PRO 70 HD1 PRO 70 -0.780 -1.569 -5.030
523 H SER 71 HN SER 71 2.485 -6.045 -6.658
524 HA SER 71 HA SER 71 1.954 -7.355 -4.165
525 HB2 SER 71 HB2 SER 71 2.257 -8.582 -6.343
526 HB3 SER 71 HB1 SER 71 3.958 -8.130 -6.299
527 HG SER 71 HG SER 71 2.848 -10.221 -5.204
528 H ALA 72 HN ALA 72 4.054 -8.370 -3.128
529 HA ALA 72 HA ALA 72 5.190 -6.336 -1.552
530 HB1 ALA 72 HB1 ALA 72 4.989 -8.622 -0.789
531 HB2 ALA 72 HB2 ALA 72 6.649 -8.047 -0.647
532 HB3 ALA 72 HB3 ALA 72 6.199 -9.131 -1.964
533 H ASP 73 HN ASP 73 6.594 -8.137 -4.230
534 HA ASP 73 HA ASP 73 9.159 -7.009 -4.080
535 HB2 ASP 73 HB2 ASP 73 8.771 -8.974 -5.420
536 HB3 ASP 73 HB1 ASP 73 7.664 -8.081 -6.462
537 H GLU 74 HN GLU 74 6.292 -5.936 -5.763
538 HA GLU 74 HA GLU 74 7.518 -3.833 -7.213
539 HB2 GLU 74 HB2 GLU 74 4.642 -4.274 -6.442
540 HB3 GLU 74 HB1 GLU 74 5.196 -3.067 -7.597
541 HG2 GLU 74 HG2 GLU 74 6.009 -4.803 -9.064
542 HG3 GLU 74 HG1 GLU 74 5.578 -6.037 -7.880
543 H VAL 75 HN VAL 75 5.760 -3.976 -4.131
544 HA VAL 75 HA VAL 75 6.026 -1.189 -3.729
545 HB VAL 75 HB VAL 75 5.525 -1.685 -1.261
546 HG11 VAL 75 HG11 VAL 75 3.131 -2.101 -1.754
547 HG12 VAL 75 HG12 VAL 75 3.605 -2.570 -3.390
548 HG13 VAL 75 HG13 VAL 75 3.829 -0.900 -2.849
549 HG21 VAL 75 HG21 VAL 75 6.135 -4.074 -1.276
550 HG22 VAL 75 HG22 VAL 75 4.800 -4.355 -2.412
551 HG23 VAL 75 HG23 VAL 75 4.459 -3.826 -0.773
552 H LYS 76 HN LYS 76 7.978 -3.912 -2.679
553 HA LYS 76 HA LYS 76 9.766 -2.543 -1.026
554 HB2 LYS 76 HB2 LYS 76 10.252 -4.897 -2.850
555 HB3 LYS 76 HB1 LYS 76 11.443 -4.287 -1.711
556 HG2 LYS 76 HG2 LYS 76 10.045 -4.847 0.143
557 HG3 LYS 76 HG1 LYS 76 8.711 -5.259 -0.934
558 HD2 LYS 76 HD2 LYS 76 9.762 -7.292 -0.159
559 HD3 LYS 76 HD1 LYS 76 10.075 -7.090 -1.875
560 HE2 LYS 76 HE2 LYS 76 12.312 -6.213 -1.348
561 HE3 LYS 76 HE1 LYS 76 11.985 -6.445 0.369
562 HZ1 LYS 76 HZ1 LYS 76 11.667 -8.848 -0.144
563 HZ2 LYS 76 HZ2 LYS 76 13.228 -8.282 -0.398
564 HZ3 LYS 76 HZ3 LYS 76 12.205 -8.541 -1.720
565 H ALA 77 HN ALA 77 9.785 -2.999 -4.513
566 HA ALA 77 HA ALA 77 12.277 -1.920 -5.098
567 HB1 ALA 77 HB1 ALA 77 9.818 -1.838 -6.825
568 HB2 ALA 77 HB2 ALA 77 10.925 -3.205 -6.687
569 HB3 ALA 77 HB3 ALA 77 11.486 -1.678 -7.370
570 H LYS 78 HN LYS 78 9.195 -0.268 -4.636
571 HA LYS 78 HA LYS 78 10.396 2.246 -5.456
572 HB2 LYS 78 HB2 LYS 78 7.834 1.506 -5.594
573 HB3 LYS 78 HB1 LYS 78 7.796 2.210 -3.980
574 HG2 LYS 78 HG2 LYS 78 9.040 4.214 -5.210
575 HG3 LYS 78 HG1 LYS 78 8.244 3.475 -6.601
576 HD2 LYS 78 HD2 LYS 78 6.083 3.721 -5.537
577 HD3 LYS 78 HD1 LYS 78 6.850 4.463 -4.128
578 HE2 LYS 78 HE2 LYS 78 7.812 6.202 -5.714
579 HE3 LYS 78 HE1 LYS 78 6.783 5.503 -6.946
580 HZ1 LYS 78 HZ1 LYS 78 5.870 6.809 -4.438
581 HZ2 LYS 78 HZ2 LYS 78 4.854 6.024 -5.547
582 HZ3 LYS 78 HZ3 LYS 78 5.726 7.383 -6.013
583 H LEU 79 HN LEU 79 9.215 0.722 -2.520
584 HA LEU 79 HA LEU 79 9.540 2.816 -0.714
585 HB2 LEU 79 HB2 LEU 79 8.168 0.834 -0.355
586 HB3 LEU 79 HB1 LEU 79 9.600 -0.161 -0.279
587 HG LEU 79 HG LEU 79 10.270 0.994 1.788
588 HD11 LEU 79 HD11 LEU 79 7.561 2.314 1.580
589 HD12 LEU 79 HD12 LEU 79 9.113 3.130 1.401
590 HD13 LEU 79 HD13 LEU 79 8.667 2.423 2.950
591 HD21 LEU 79 HD21 LEU 79 8.550 -0.026 3.207
592 HD22 LEU 79 HD22 LEU 79 9.058 -1.087 1.893
593 HD23 LEU 79 HD23 LEU 79 7.521 -0.230 1.790
594 H VAL 80 HN VAL 80 11.811 0.356 -1.790
595 HA VAL 80 HA VAL 80 13.762 0.696 0.209
596 HB VAL 80 HB VAL 80 13.540 -1.228 -1.408
597 HG11 VAL 80 HG11 VAL 80 14.702 -1.170 -3.537
598 HG12 VAL 80 HG12 VAL 80 14.932 0.566 -3.347
599 HG13 VAL 80 HG13 VAL 80 13.303 -0.095 -3.485
600 HG21 VAL 80 HG21 VAL 80 16.268 -0.014 -1.078
601 HG22 VAL 80 HG22 VAL 80 15.947 -1.669 -1.589
602 HG23 VAL 80 HG23 VAL 80 15.437 -1.147 0.011
603 H LYS 81 HN LYS 81 13.130 2.464 -2.727
604 HA LYS 81 HA LYS 81 15.616 3.903 -2.623
605 HB2 LYS 81 HB2 LYS 81 13.170 4.392 -4.331
606 HB3 LYS 81 HB1 LYS 81 14.742 5.150 -4.546
607 HG2 LYS 81 HG2 LYS 81 15.728 2.939 -4.990
608 HG3 LYS 81 HG1 LYS 81 14.127 2.215 -4.829
609 HD2 LYS 81 HD2 LYS 81 13.348 3.639 -6.704
610 HD3 LYS 81 HD1 LYS 81 14.995 4.240 -6.891
611 HE2 LYS 81 HE2 LYS 81 14.126 1.361 -7.160
612 HE3 LYS 81 HE1 LYS 81 14.496 2.443 -8.495
613 HZ1 LYS 81 HZ1 LYS 81 16.425 1.545 -6.407
614 HZ2 LYS 81 HZ2 LYS 81 16.836 2.517 -7.706
615 HZ3 LYS 81 HZ3 LYS 81 16.318 0.960 -7.958
616 H ILE 82 HN ILE 82 12.286 4.406 -1.688
617 HA ILE 82 HA ILE 82 12.457 7.183 -1.096
618 HB ILE 82 HB ILE 82 10.636 5.129 0.189
619 HG12 ILE 82 HG12 ILE 82 10.117 6.855 -2.248
620 HG13 ILE 82 HG11 ILE 82 10.431 5.122 -2.273
621 HG21 ILE 82 HG21 ILE 82 10.684 7.223 1.431
622 HG22 ILE 82 HG22 ILE 82 9.133 7.041 0.606
623 HG23 ILE 82 HG23 ILE 82 10.356 8.129 -0.049
624 HD11 ILE 82 HD11 ILE 82 8.059 5.581 -2.502
625 HD12 ILE 82 HD12 ILE 82 8.078 6.481 -0.987
626 HD13 ILE 82 HD13 ILE 82 8.388 4.747 -0.983
627 H ALA 83 HN ALA 83 12.919 4.259 0.832
628 HA ALA 83 HA ALA 83 13.508 5.670 3.250
629 HB1 ALA 83 HB1 ALA 83 12.652 3.395 3.323
630 HB2 ALA 83 HB2 ALA 83 14.231 3.482 4.109
631 HB3 ALA 83 HB3 ALA 83 14.092 2.811 2.484
632 H GLY 84 HN GLY 84 15.261 4.839 0.459
633 HA2 GLY 84 HA2 GLY 84 17.376 5.399 -0.210
634 HA3 GLY 84 HA1 GLY 84 17.512 6.355 1.257
635 H LEU 85 HN LEU 85 16.846 2.932 1.128
636 HA LEU 85 HA LEU 85 19.185 2.525 2.794
637 HB2 LEU 85 HB2 LEU 85 17.054 0.562 1.956
638 HB3 LEU 85 HB1 LEU 85 18.332 0.238 3.110
639 HG LEU 85 HG LEU 85 16.128 2.267 3.461
640 HD11 LEU 85 HD11 LEU 85 15.257 0.734 5.133
641 HD12 LEU 85 HD12 LEU 85 16.527 -0.423 4.746
642 HD13 LEU 85 HD13 LEU 85 15.299 -0.021 3.543
643 HD21 LEU 85 HD21 LEU 85 18.278 1.322 5.352
644 HD22 LEU 85 HD22 LEU 85 16.946 2.400 5.769
645 HD23 LEU 85 HD23 LEU 85 18.170 2.920 4.616
646 H GLU 86 HN GLU 86 18.501 2.555 -0.390
647 HA GLU 86 HA GLU 86 20.947 1.107 -0.959
648 HB2 GLU 86 HB2 GLU 86 20.029 0.452 -3.161
649 HB3 GLU 86 HB1 GLU 86 19.070 -0.210 -1.849
650 HG2 GLU 86 HG2 GLU 86 17.320 1.356 -2.225
651 HG3 GLU 86 HG1 GLU 86 18.318 2.274 -3.347
652 H HIS 87 HN HIS 87 21.758 2.022 -3.228
653 HA HIS 87 HA HIS 87 21.948 4.852 -2.834
654 HB2 HIS 87 HB2 HIS 87 23.024 3.142 -5.106
655 HB3 HIS 87 HB1 HIS 87 23.380 4.848 -4.891
656 HD1 HIS 87 HD1 HIS 87 25.079 1.852 -4.473
657 HD2 HIS 87 HD2 HIS 87 24.361 5.046 -1.912
658 HE1 HIS 87 HE1 HIS 87 26.879 1.759 -2.732
659 H HIS 88 HN HIS 88 21.053 3.069 -5.781
660 HA HIS 88 HA HIS 88 18.519 3.974 -6.132
661 HB2 HIS 88 HB2 HIS 88 19.576 6.273 -6.338
662 HB3 HIS 88 HB1 HIS 88 20.428 5.694 -7.767
663 HD1 HIS 88 HD1 HIS 88 19.225 6.299 -9.887
664 HD2 HIS 88 HD2 HIS 88 16.650 5.837 -6.674
665 HE1 HIS 88 HE1 HIS 88 16.916 6.761 -10.777
Start of MODEL 7
1 H1 MET 1 HT1 MET 1 12.793 8.348 9.610
2 H2 MET 1 HT2 MET 1 14.228 9.073 9.113
3 H3 MET 1 HT3 MET 1 13.306 8.213 8.014
4 HA MET 1 HA MET 1 12.516 10.704 9.405
5 HB2 MET 1 HB2 MET 1 12.756 11.855 7.326
6 HB3 MET 1 HB1 MET 1 14.244 10.971 7.583
7 HG2 MET 1 HG2 MET 1 13.495 9.255 5.979
8 HG3 MET 1 HG1 MET 1 11.995 10.145 5.757
9 HE1 MET 1 HE1 MET 1 12.376 10.121 3.133
10 HE2 MET 1 HE2 MET 1 13.884 9.234 3.348
11 HE3 MET 1 HE3 MET 1 13.850 10.687 2.351
12 H VAL 2 HN VAL 2 11.238 7.778 8.548
13 HA VAL 2 HA VAL 2 8.801 9.075 7.604
14 HB VAL 2 HB VAL 2 8.220 7.084 6.285
15 HG11 VAL 2 HG11 VAL 2 9.727 7.430 4.394
16 HG12 VAL 2 HG12 VAL 2 10.848 8.286 5.450
17 HG13 VAL 2 HG13 VAL 2 9.248 8.958 5.136
18 HG21 VAL 2 HG21 VAL 2 9.585 5.418 7.473
19 HG22 VAL 2 HG22 VAL 2 11.046 6.147 6.797
20 HG23 VAL 2 HG23 VAL 2 9.874 5.376 5.733
21 H THR 3 HN THR 3 7.270 9.057 8.553
22 HA THR 3 HA THR 3 6.965 7.501 10.942
23 HB THR 3 HB THR 3 5.085 9.535 9.754
24 HG1 THR 3 HG1 THR 3 7.574 9.844 11.060
25 HG21 THR 3 HG21 THR 3 4.450 8.309 11.754
26 HG22 THR 3 HG22 THR 3 4.754 10.035 12.108
27 HG23 THR 3 HG23 THR 3 5.981 8.805 12.488
28 H ALA 4 HN ALA 4 6.058 7.581 7.651
29 HA ALA 4 HA ALA 4 4.318 5.284 7.992
30 HB1 ALA 4 HB1 ALA 4 2.848 7.230 7.593
31 HB2 ALA 4 HB2 ALA 4 2.881 6.172 6.183
32 HB3 ALA 4 HB3 ALA 4 3.816 7.667 6.185
33 H ALA 5 HN ALA 5 4.729 3.810 6.415
34 HA ALA 5 HA ALA 5 7.063 4.384 4.708
35 HB1 ALA 5 HB1 ALA 5 7.219 2.385 6.107
36 HB2 ALA 5 HB2 ALA 5 7.147 1.923 4.401
37 HB3 ALA 5 HB3 ALA 5 5.717 1.773 5.418
38 H LEU 6 HN LEU 6 4.049 2.598 4.491
39 HA LEU 6 HA LEU 6 3.118 4.192 2.443
40 HB2 LEU 6 HB2 LEU 6 2.722 2.444 0.684
41 HB3 LEU 6 HB1 LEU 6 4.395 2.894 0.854
42 HG LEU 6 HG LEU 6 4.296 0.631 0.319
43 HD11 LEU 6 HD11 LEU 6 4.864 0.754 3.230
44 HD12 LEU 6 HD12 LEU 6 5.981 1.012 1.890
45 HD13 LEU 6 HD13 LEU 6 5.279 -0.584 2.159
46 HD21 LEU 6 HD21 LEU 6 2.307 0.218 2.515
47 HD22 LEU 6 HD22 LEU 6 3.059 -1.066 1.544
48 HD23 LEU 6 HD23 LEU 6 2.038 0.153 0.767
49 H THR 7 HN THR 7 1.084 4.278 2.302
50 HA THR 7 HA THR 7 -0.256 2.881 4.478
51 HB THR 7 HB THR 7 -1.119 5.369 3.002
52 HG1 THR 7 HG1 THR 7 0.818 4.911 4.917
53 HG21 THR 7 HG21 THR 7 -2.870 4.214 4.301
54 HG22 THR 7 HG22 THR 7 -2.439 5.757 5.039
55 HG23 THR 7 HG23 THR 7 -1.831 4.251 5.728
56 H ILE 8 HN ILE 8 -1.476 1.339 3.958
57 HA ILE 8 HA ILE 8 -2.501 0.896 1.287
58 HB ILE 8 HB ILE 8 -2.544 -0.761 3.816
59 HG12 ILE 8 HG12 ILE 8 -1.069 -1.279 1.259
60 HG13 ILE 8 HG11 ILE 8 -0.324 -0.503 2.663
61 HG21 ILE 8 HG21 ILE 8 -4.461 -1.288 2.720
62 HG22 ILE 8 HG22 ILE 8 -3.314 -2.608 2.387
63 HG23 ILE 8 HG23 ILE 8 -3.678 -1.398 1.138
64 HD11 ILE 8 HD11 ILE 8 0.231 -2.850 2.545
65 HD12 ILE 8 HD12 ILE 8 -1.480 -3.280 2.511
66 HD13 ILE 8 HD13 ILE 8 -0.783 -2.543 3.955
67 H TYR 9 HN TYR 9 -4.406 1.647 0.778
68 HA TYR 9 HA TYR 9 -6.479 1.970 2.844
69 HB2 TYR 9 HB2 TYR 9 -6.374 3.020 0.023
70 HB3 TYR 9 HB1 TYR 9 -7.664 3.317 1.178
71 HD1 TYR 9 HD1 TYR 9 -6.837 4.422 3.440
72 HD2 TYR 9 HD2 TYR 9 -4.786 4.610 -0.272
73 HE1 TYR 9 HE1 TYR 9 -5.696 6.438 4.194
74 HE2 TYR 9 HE2 TYR 9 -3.639 6.624 0.441
75 HH TYR 9 HH TYR 9 -3.705 7.732 3.707
76 H THR 10 HN THR 10 -7.985 0.531 2.987
77 HA THR 10 HA THR 10 -9.070 -0.729 0.696
78 HB THR 10 HB THR 10 -7.025 -2.054 0.927
79 HG1 THR 10 HG1 THR 10 -9.006 -3.766 1.966
80 HG21 THR 10 HG21 THR 10 -7.977 -2.654 3.729
81 HG22 THR 10 HG22 THR 10 -6.570 -1.687 3.300
82 HG23 THR 10 HG23 THR 10 -6.596 -3.417 2.941
83 H THR 11 HN THR 11 -10.682 -2.380 1.461
84 HA THR 11 HA THR 11 -11.872 -1.661 4.029
85 HB THR 11 HB THR 11 -13.836 -2.870 2.935
86 HG1 THR 11 HG1 THR 11 -13.600 -2.596 0.523
87 HG21 THR 11 HG21 THR 11 -12.846 -0.313 1.707
88 HG22 THR 11 HG22 THR 11 -13.793 -0.444 3.193
89 HG23 THR 11 HG23 THR 11 -14.510 -0.888 1.640
90 H SER 12 HN SER 12 -12.706 -3.468 5.213
91 HA SER 12 HA SER 12 -10.935 -5.669 5.166
92 HB2 SER 12 HB2 SER 12 -13.406 -5.160 6.827
93 HB3 SER 12 HB1 SER 12 -12.207 -6.418 7.131
94 HG SER 12 HG SER 12 -11.513 -3.641 6.983
95 H TRP 13 HN TRP 13 -13.839 -5.001 3.531
96 HA TRP 13 HA TRP 13 -14.555 -7.784 3.263
97 HB2 TRP 13 HB2 TRP 13 -16.402 -6.948 1.730
98 HB3 TRP 13 HB1 TRP 13 -16.483 -6.428 3.399
99 HD1 TRP 13 HD1 TRP 13 -16.694 -3.884 3.822
100 HE1 TRP 13 HE1 TRP 13 -16.777 -1.788 2.329
101 HE3 TRP 13 HE3 TRP 13 -15.282 -5.967 -0.662
102 HZ2 TRP 13 HZ2 TRP 13 -16.309 -1.089 -0.344
103 HZ3 TRP 13 HZ3 TRP 13 -15.126 -4.487 -2.634
104 HH2 TRP 13 HH2 TRP 13 -15.628 -2.086 -2.465
105 H CYS 14 HN CYS 14 -12.237 -6.008 1.918
106 HA CYS 14 HA CYS 14 -12.517 -6.956 -0.788
107 HB2 CYS 14 HB2 CYS 14 -11.528 -4.744 -0.388
108 HB3 CYS 14 HB1 CYS 14 -10.270 -5.462 0.601
109 HG CYS 14 HG CYS 14 -10.487 -5.172 -2.718
110 H GLY 15 HN GLY 15 -11.599 -8.756 -1.606
111 HA2 GLY 15 HA2 GLY 15 -10.414 -10.668 0.179
112 HA3 GLY 15 HA1 GLY 15 -10.692 -10.869 -1.550
113 H TYR 16 HN TYR 16 -9.324 -8.415 -2.218
114 HA TYR 16 HA TYR 16 -6.681 -9.448 -2.394
115 HB2 TYR 16 HB2 TYR 16 -7.928 -6.878 -3.208
116 HB3 TYR 16 HB1 TYR 16 -6.180 -7.044 -3.248
117 HD1 TYR 16 HD2 TYR 16 -5.492 -9.432 -4.407
118 HD2 TYR 16 HD1 TYR 16 -8.997 -7.157 -5.187
119 HE1 TYR 16 HE2 TYR 16 -5.655 -10.449 -6.652
120 HE2 TYR 16 HE1 TYR 16 -9.172 -8.168 -7.418
121 HH TYR 16 HH TYR 16 -7.533 -9.170 -9.025
122 H CYS 17 HN CYS 17 -8.262 -7.547 -0.084
123 HA CYS 17 HA CYS 17 -6.158 -6.071 1.000
124 HB2 CYS 17 HB2 CYS 17 -8.423 -5.632 1.694
125 HB3 CYS 17 HB1 CYS 17 -8.597 -7.267 2.323
126 HG CYS 17 HG CYS 17 -8.252 -6.369 4.669
127 H LEU 18 HN LEU 18 -7.433 -9.131 2.134
128 HA LEU 18 HA LEU 18 -5.317 -9.586 3.909
129 HB2 LEU 18 HB2 LEU 18 -6.295 -11.892 4.033
130 HB3 LEU 18 HB1 LEU 18 -7.373 -10.574 4.424
131 HG LEU 18 HG LEU 18 -8.132 -10.798 1.942
132 HD11 LEU 18 HD11 LEU 18 -7.012 -13.542 2.358
133 HD12 LEU 18 HD12 LEU 18 -6.494 -12.308 1.197
134 HD13 LEU 18 HD13 LEU 18 -8.095 -13.033 1.049
135 HD21 LEU 18 HD21 LEU 18 -9.567 -11.156 3.815
136 HD22 LEU 18 HD22 LEU 18 -8.931 -12.791 4.038
137 HD23 LEU 18 HD23 LEU 18 -9.859 -12.386 2.585
138 H ARG 19 HN ARG 19 -5.773 -10.318 0.575
139 HA ARG 19 HA ARG 19 -3.829 -12.302 0.153
140 HB2 ARG 19 HB2 ARG 19 -5.576 -11.442 -1.479
141 HB3 ARG 19 HB1 ARG 19 -4.515 -10.070 -1.753
142 HG2 ARG 19 HG2 ARG 19 -4.133 -11.622 -3.507
143 HG3 ARG 19 HG1 ARG 19 -2.734 -11.709 -2.430
144 HD2 ARG 19 HD2 ARG 19 -3.468 -13.953 -3.074
145 HD3 ARG 19 HD1 ARG 19 -3.695 -13.688 -1.344
146 HE ARG 19 HE ARG 19 -5.980 -13.067 -2.967
147 HH11 ARG 19 HH11 ARG 19 -4.389 -15.662 -1.159
148 HH12 ARG 19 HH12 ARG 19 -5.821 -16.552 -0.924
149 HH21 ARG 19 HH21 ARG 19 -7.899 -14.282 -2.682
150 HH22 ARG 19 HH22 ARG 19 -7.889 -15.748 -1.812
151 H LEU 20 HN LEU 20 -3.717 -8.793 -0.100
152 HA LEU 20 HA LEU 20 -0.997 -8.604 -0.718
153 HB2 LEU 20 HB2 LEU 20 -2.551 -6.902 -1.372
154 HB3 LEU 20 HB1 LEU 20 -3.008 -6.617 0.290
155 HG LEU 20 HG LEU 20 -0.788 -5.793 0.755
156 HD11 LEU 20 HD11 LEU 20 0.708 -5.161 -1.146
157 HD12 LEU 20 HD12 LEU 20 -0.350 -6.057 -2.233
158 HD13 LEU 20 HD13 LEU 20 0.532 -6.902 -0.961
159 HD21 LEU 20 HD21 LEU 20 -2.612 -4.287 0.190
160 HD22 LEU 20 HD22 LEU 20 -2.119 -4.353 -1.516
161 HD23 LEU 20 HD23 LEU 20 -1.039 -3.666 -0.299
162 H LYS 21 HN LYS 21 -2.822 -8.348 2.308
163 HA LYS 21 HA LYS 21 -0.789 -7.412 3.992
164 HB2 LYS 21 HB2 LYS 21 -2.937 -9.403 4.750
165 HB3 LYS 21 HB1 LYS 21 -1.980 -8.452 5.867
166 HG2 LYS 21 HG2 LYS 21 -3.999 -7.392 3.907
167 HG3 LYS 21 HG1 LYS 21 -4.227 -7.600 5.641
168 HD2 LYS 21 HD2 LYS 21 -2.495 -5.922 6.068
169 HD3 LYS 21 HD1 LYS 21 -2.250 -5.740 4.330
170 HE2 LYS 21 HE2 LYS 21 -3.691 -3.964 5.200
171 HE3 LYS 21 HE1 LYS 21 -4.565 -5.006 4.064
172 HZ1 LYS 21 HZ1 LYS 21 -4.764 -4.957 7.027
173 HZ2 LYS 21 HZ2 LYS 21 -5.481 -6.157 6.079
174 HZ3 LYS 21 HZ3 LYS 21 -5.960 -4.555 5.915
175 H THR 22 HN THR 22 -1.649 -10.751 3.121
176 HA THR 22 HA THR 22 0.224 -12.069 4.707
177 HB THR 22 HB THR 22 -0.891 -12.915 2.017
178 HG1 THR 22 HG1 THR 22 -2.017 -12.599 4.466
179 HG21 THR 22 HG21 THR 22 0.240 -14.549 4.301
180 HG22 THR 22 HG22 THR 22 1.018 -14.292 2.739
181 HG23 THR 22 HG23 THR 22 -0.490 -15.203 2.834
182 H ALA 23 HN ALA 23 0.472 -10.887 1.366
183 HA ALA 23 HA ALA 23 2.988 -11.961 0.779
184 HB1 ALA 23 HB1 ALA 23 3.024 -10.402 -1.100
185 HB2 ALA 23 HB2 ALA 23 1.686 -9.496 -0.381
186 HB3 ALA 23 HB3 ALA 23 1.438 -11.151 -0.931
187 H LEU 24 HN LEU 24 2.080 -8.845 2.164
188 HA LEU 24 HA LEU 24 4.794 -7.874 2.230
189 HB2 LEU 24 HB2 LEU 24 2.436 -6.930 3.806
190 HB3 LEU 24 HB1 LEU 24 3.934 -6.057 3.597
191 HG LEU 24 HG LEU 24 1.784 -6.542 1.532
192 HD11 LEU 24 HD11 LEU 24 1.330 -4.739 3.083
193 HD12 LEU 24 HD12 LEU 24 1.765 -4.046 1.500
194 HD13 LEU 24 HD13 LEU 24 2.932 -4.090 2.801
195 HD21 LEU 24 HD21 LEU 24 4.495 -5.267 1.132
196 HD22 LEU 24 HD22 LEU 24 3.146 -5.150 0.023
197 HD23 LEU 24 HD23 LEU 24 3.884 -6.711 0.305
198 H THR 25 HN THR 25 2.700 -9.472 4.501
199 HA THR 25 HA THR 25 4.317 -9.153 6.776
200 HB THR 25 HB THR 25 2.341 -11.344 6.090
201 HG1 THR 25 HG1 THR 25 1.371 -9.355 6.087
202 HG21 THR 25 HG21 THR 25 3.794 -12.012 7.973
203 HG22 THR 25 HG22 THR 25 2.148 -11.705 8.525
204 HG23 THR 25 HG23 THR 25 3.410 -10.508 8.808
205 H ALA 26 HN ALA 26 4.230 -11.677 4.283
206 HA ALA 26 HA ALA 26 6.131 -13.389 5.467
207 HB1 ALA 26 HB1 ALA 26 4.558 -14.112 3.730
208 HB2 ALA 26 HB2 ALA 26 6.227 -14.492 3.304
209 HB3 ALA 26 HB3 ALA 26 5.413 -13.119 2.550
210 H ASN 27 HN ASN 27 6.458 -10.594 3.414
211 HA ASN 27 HA ASN 27 9.304 -11.127 3.065
212 HB2 ASN 27 HB2 ASN 27 7.485 -9.089 1.810
213 HB3 ASN 27 HB1 ASN 27 9.236 -8.998 1.653
214 HD21 ASN 27 HD21 ASN 27 6.349 -10.742 0.749
215 HD22 ASN 27 HD22 ASN 27 7.095 -11.704 -0.461
216 H ARG 28 HN ARG 28 7.526 -9.765 5.408
217 HA ARG 28 HA ARG 28 7.827 -8.270 7.064
218 HB2 ARG 28 HB2 ARG 28 10.670 -8.995 6.467
219 HB3 ARG 28 HB1 ARG 28 10.288 -7.802 7.697
220 HG2 ARG 28 HG2 ARG 28 8.973 -9.475 8.898
221 HG3 ARG 28 HG1 ARG 28 9.378 -10.673 7.662
222 HD2 ARG 28 HD2 ARG 28 11.681 -10.527 8.161
223 HD3 ARG 28 HD1 ARG 28 11.434 -9.132 9.207
224 HE ARG 28 HE ARG 28 9.946 -11.195 10.255
225 HH11 ARG 28 HH11 ARG 28 13.361 -10.571 9.545
226 HH12 ARG 28 HH12 ARG 28 13.960 -11.399 10.902
227 HH21 ARG 28 HH21 ARG 28 10.786 -12.357 12.146
228 HH22 ARG 28 HH22 ARG 28 12.463 -12.439 12.408
229 H ILE 29 HN ILE 29 7.032 -7.032 5.039
230 HA ILE 29 HA ILE 29 8.778 -4.784 4.457
231 HB ILE 29 HB ILE 29 6.026 -5.558 3.411
232 HG12 ILE 29 HG12 ILE 29 8.721 -5.609 2.047
233 HG13 ILE 29 HG11 ILE 29 7.953 -7.015 2.771
234 HG21 ILE 29 HG21 ILE 29 7.843 -3.321 2.491
235 HG22 ILE 29 HG22 ILE 29 6.329 -3.113 3.364
236 HG23 ILE 29 HG23 ILE 29 6.319 -3.790 1.732
237 HD11 ILE 29 HD11 ILE 29 6.136 -6.791 1.148
238 HD12 ILE 29 HD12 ILE 29 7.710 -7.015 0.404
239 HD13 ILE 29 HD13 ILE 29 6.967 -5.409 0.426
240 H ALA 30 HN ALA 30 8.351 -2.740 5.240
241 HA ALA 30 HA ALA 30 6.618 -2.603 7.545
242 HB1 ALA 30 HB1 ALA 30 8.327 -0.499 6.213
243 HB2 ALA 30 HB2 ALA 30 8.802 -1.494 7.590
244 HB3 ALA 30 HB3 ALA 30 7.503 -0.311 7.760
245 H TYR 31 HN TYR 31 4.500 -2.235 7.268
246 HA TYR 31 HA TYR 31 3.704 -0.328 5.197
247 HB2 TYR 31 HB2 TYR 31 1.775 -1.740 4.593
248 HB3 TYR 31 HB1 TYR 31 3.308 -2.518 4.221
249 HD1 TYR 31 HD1 TYR 31 4.069 -4.431 5.599
250 HD2 TYR 31 HD2 TYR 31 0.229 -2.696 6.160
251 HE1 TYR 31 HE1 TYR 31 3.365 -6.420 6.834
252 HE2 TYR 31 HE2 TYR 31 -0.493 -4.688 7.406
253 HH TYR 31 HH TYR 31 0.105 -7.001 7.654
254 H ASP 32 HN ASP 32 1.816 0.721 5.492
255 HA ASP 32 HA ASP 32 0.865 0.846 8.256
256 HB2 ASP 32 HB2 ASP 32 1.214 2.893 6.090
257 HB3 ASP 32 HB1 ASP 32 0.202 3.220 7.500
258 H GLU 33 HN GLU 33 -1.134 0.010 8.403
259 HA GLU 33 HA GLU 33 -2.831 0.183 6.007
260 HB2 GLU 33 HB2 GLU 33 -3.975 -1.844 6.777
261 HB3 GLU 33 HB1 GLU 33 -2.268 -2.133 6.500
262 HG2 GLU 33 HG2 GLU 33 -1.862 -2.033 8.909
263 HG3 GLU 33 HG1 GLU 33 -3.577 -1.721 9.180
264 H VAL 34 HN VAL 34 -4.649 1.218 6.104
265 HA VAL 34 HA VAL 34 -5.938 1.547 8.650
266 HB VAL 34 HB VAL 34 -4.693 3.703 8.334
267 HG11 VAL 34 HG11 VAL 34 -4.469 3.666 5.919
268 HG12 VAL 34 HG12 VAL 34 -5.055 5.193 6.565
269 HG13 VAL 34 HG13 VAL 34 -6.189 4.100 5.787
270 HG21 VAL 34 HG21 VAL 34 -7.655 3.958 7.903
271 HG22 VAL 34 HG22 VAL 34 -6.593 5.269 8.388
272 HG23 VAL 34 HG23 VAL 34 -6.805 3.877 9.449
273 H ASP 35 HN ASP 35 -8.094 1.249 8.472
274 HA ASP 35 HA ASP 35 -8.944 0.318 5.854
275 HB2 ASP 35 HB2 ASP 35 -9.390 -1.089 7.819
276 HB3 ASP 35 HB1 ASP 35 -10.286 0.210 8.581
277 H ILE 36 HN ILE 36 -10.640 1.243 4.745
278 HA ILE 36 HA ILE 36 -10.812 4.082 5.233
279 HB ILE 36 HB ILE 36 -11.858 4.279 3.033
280 HG12 ILE 36 HG12 ILE 36 -11.444 1.294 2.919
281 HG13 ILE 36 HG11 ILE 36 -13.008 2.085 3.052
282 HG21 ILE 36 HG21 ILE 36 -9.442 4.398 3.307
283 HG22 ILE 36 HG22 ILE 36 -9.867 3.646 1.772
284 HG23 ILE 36 HG23 ILE 36 -9.322 2.647 3.121
285 HD11 ILE 36 HD11 ILE 36 -12.609 1.382 0.761
286 HD12 ILE 36 HD12 ILE 36 -11.079 2.241 0.739
287 HD13 ILE 36 HD13 ILE 36 -12.598 3.141 0.849
288 H GLU 37 HN GLU 37 -12.852 1.592 6.175
289 HA GLU 37 HA GLU 37 -15.307 2.715 5.443
290 HB2 GLU 37 HB2 GLU 37 -14.582 0.767 7.585
291 HB3 GLU 37 HB1 GLU 37 -16.258 1.242 7.267
292 HG2 GLU 37 HG2 GLU 37 -14.361 -0.064 5.328
293 HG3 GLU 37 HG1 GLU 37 -15.686 -0.850 6.190
294 H HIS 38 HN HIS 38 -13.239 3.509 8.077
295 HA HIS 38 HA HIS 38 -15.344 5.222 9.169
296 HB2 HIS 38 HB2 HIS 38 -12.671 4.438 10.359
297 HB3 HIS 38 HB1 HIS 38 -13.798 5.563 11.114
298 HD1 HIS 38 HD1 HIS 38 -13.161 1.932 10.624
299 HD2 HIS 38 HD2 HIS 38 -16.211 4.372 12.034
300 HE1 HIS 38 HE1 HIS 38 -14.761 0.413 11.830
301 H ASN 39 HN ASN 39 -13.059 5.428 6.895
302 HA ASN 39 HA ASN 39 -12.729 8.303 7.339
303 HB2 ASN 39 HB2 ASN 39 -10.629 6.427 6.193
304 HB3 ASN 39 HB1 ASN 39 -10.532 8.173 6.073
305 HD21 ASN 39 HD21 ASN 39 -8.665 6.381 7.293
306 HD22 ASN 39 HD22 ASN 39 -8.533 6.840 8.946
307 H ARG 40 HN ARG 40 -14.401 8.837 6.081
308 HA ARG 40 HA ARG 40 -15.044 7.447 3.687
309 HB2 ARG 40 HB2 ARG 40 -16.674 8.591 5.223
310 HB3 ARG 40 HB1 ARG 40 -16.123 10.122 4.565
311 HG2 ARG 40 HG2 ARG 40 -16.894 9.467 2.347
312 HG3 ARG 40 HG1 ARG 40 -17.405 7.901 2.980
313 HD2 ARG 40 HD2 ARG 40 -18.921 9.100 4.547
314 HD3 ARG 40 HD1 ARG 40 -18.481 10.606 3.747
315 HE ARG 40 HE ARG 40 -19.408 8.650 1.913
316 HH11 ARG 40 HH11 ARG 40 -20.561 11.063 4.248
317 HH12 ARG 40 HH12 ARG 40 -22.104 11.182 3.543
318 HH21 ARG 40 HH21 ARG 40 -21.527 8.859 0.951
319 HH22 ARG 40 HH22 ARG 40 -22.656 9.941 1.631
320 H ALA 41 HN ALA 41 -13.204 10.346 4.344
321 HA ALA 41 HA ALA 41 -13.181 11.276 1.628
322 HB1 ALA 41 HB1 ALA 41 -11.425 12.796 2.347
323 HB2 ALA 41 HB2 ALA 41 -11.240 11.906 3.854
324 HB3 ALA 41 HB3 ALA 41 -12.730 12.799 3.540
325 H ALA 42 HN ALA 42 -11.146 9.265 3.639
326 HA ALA 42 HA ALA 42 -9.096 8.915 1.717
327 HB1 ALA 42 HB1 ALA 42 -8.742 8.432 4.108
328 HB2 ALA 42 HB2 ALA 42 -8.342 7.054 3.087
329 HB3 ALA 42 HB3 ALA 42 -9.861 7.070 3.987
330 H ALA 43 HN ALA 43 -12.092 7.242 2.439
331 HA ALA 43 HA ALA 43 -11.837 5.072 0.687
332 HB1 ALA 43 HB1 ALA 43 -14.274 4.909 0.797
333 HB2 ALA 43 HB2 ALA 43 -14.364 6.538 1.459
334 HB3 ALA 43 HB3 ALA 43 -13.612 5.248 2.399
335 H GLU 44 HN GLU 44 -13.079 8.316 0.193
336 HA GLU 44 HA GLU 44 -13.836 8.034 -2.499
337 HB2 GLU 44 HB2 GLU 44 -14.467 9.923 -0.969
338 HB3 GLU 44 HB1 GLU 44 -12.822 10.521 -1.096
339 HG2 GLU 44 HG2 GLU 44 -14.215 11.795 -2.542
340 HG3 GLU 44 HG1 GLU 44 -13.157 10.786 -3.531
341 H PHE 45 HN PHE 45 -10.848 9.144 -0.955
342 HA PHE 45 HA PHE 45 -9.301 9.760 -3.171
343 HB2 PHE 45 HB2 PHE 45 -8.597 10.304 -0.887
344 HB3 PHE 45 HB1 PHE 45 -8.427 8.596 -0.521
345 HD1 PHE 45 HD1 PHE 45 -7.006 11.370 -2.493
346 HD2 PHE 45 HD2 PHE 45 -6.422 7.394 -1.060
347 HE1 PHE 45 HE1 PHE 45 -4.642 11.455 -3.188
348 HE2 PHE 45 HE2 PHE 45 -4.079 7.487 -1.748
349 HZ PHE 45 HZ PHE 45 -3.181 9.506 -2.813
350 H VAL 46 HN VAL 46 -9.250 6.675 -1.381
351 HA VAL 46 HA VAL 46 -7.602 5.379 -3.269
352 HB VAL 46 HB VAL 46 -7.627 4.470 -1.044
353 HG11 VAL 46 HG11 VAL 46 -9.812 5.059 -0.349
354 HG12 VAL 46 HG12 VAL 46 -9.495 3.316 -0.156
355 HG13 VAL 46 HG13 VAL 46 -10.511 3.887 -1.498
356 HG21 VAL 46 HG21 VAL 46 -9.087 2.464 -2.665
357 HG22 VAL 46 HG22 VAL 46 -7.868 2.170 -1.400
358 HG23 VAL 46 HG23 VAL 46 -7.413 2.914 -2.953
359 H GLY 47 HN GLY 47 -11.033 5.727 -3.179
360 HA2 GLY 47 HA2 GLY 47 -11.603 3.782 -5.180
361 HA3 GLY 47 HA1 GLY 47 -12.641 5.112 -4.740
362 H SER 48 HN SER 48 -10.501 7.101 -5.276
363 HA SER 48 HA SER 48 -11.102 7.518 -8.050
364 HB2 SER 48 HB2 SER 48 -9.328 9.105 -6.184
365 HB3 SER 48 HB1 SER 48 -9.934 9.648 -7.748
366 HG SER 48 HG SER 48 -11.608 8.889 -5.572
367 H VAL 49 HN VAL 49 -8.423 6.347 -6.201
368 HA VAL 49 HA VAL 49 -6.687 6.349 -8.562
369 HB VAL 49 HB VAL 49 -4.855 5.730 -6.936
370 HG11 VAL 49 HG11 VAL 49 -6.408 8.225 -6.306
371 HG12 VAL 49 HG12 VAL 49 -5.227 8.050 -7.610
372 HG13 VAL 49 HG13 VAL 49 -4.706 7.956 -5.920
373 HG21 VAL 49 HG21 VAL 49 -6.324 4.737 -5.213
374 HG22 VAL 49 HG22 VAL 49 -6.965 6.351 -4.894
375 HG23 VAL 49 HG23 VAL 49 -5.274 6.002 -4.552
376 H ASN 50 HN ASN 50 -8.972 4.542 -7.706
377 HA ASN 50 HA ASN 50 -7.642 1.990 -7.492
378 HB2 ASN 50 HB2 ASN 50 -10.203 2.978 -6.737
379 HB3 ASN 50 HB1 ASN 50 -10.467 1.686 -7.902
380 HD21 ASN 50 HD21 ASN 50 -7.834 1.966 -5.573
381 HD22 ASN 50 HD22 ASN 50 -8.289 0.536 -4.712
382 H GLY 51 HN GLY 51 -9.107 0.280 -8.902
383 HA2 GLY 51 HA2 GLY 51 -8.859 1.140 -11.681
384 HA3 GLY 51 HA1 GLY 51 -8.919 -0.531 -11.107
385 H GLY 52 HN GLY 52 -10.801 2.400 -11.457
386 HA2 GLY 52 HA2 GLY 52 -13.001 2.335 -12.402
387 HA3 GLY 52 HA1 GLY 52 -13.226 0.757 -11.648
388 H ASN 53 HN ASN 53 -13.596 0.619 -9.460
389 HA ASN 53 HA ASN 53 -14.070 3.060 -7.936
390 HB2 ASN 53 HB2 ASN 53 -16.095 0.850 -8.383
391 HB3 ASN 53 HB1 ASN 53 -16.192 1.981 -7.045
392 HD21 ASN 53 HD21 ASN 53 -17.980 1.442 -9.226
393 HD22 ASN 53 HD22 ASN 53 -18.264 2.932 -10.053
394 H ARG 54 HN ARG 54 -14.902 1.985 -5.594
395 HA ARG 54 HA ARG 54 -12.632 0.822 -4.461
396 HB2 ARG 54 HB2 ARG 54 -15.323 1.350 -3.620
397 HB3 ARG 54 HB1 ARG 54 -14.671 -0.094 -2.829
398 HG2 ARG 54 HG2 ARG 54 -14.258 1.700 -1.389
399 HG3 ARG 54 HG1 ARG 54 -12.731 1.398 -2.224
400 HD2 ARG 54 HD2 ARG 54 -13.276 3.808 -2.090
401 HD3 ARG 54 HD1 ARG 54 -13.150 3.179 -3.744
402 HE ARG 54 HE ARG 54 -15.799 2.998 -2.953
403 HH11 ARG 54 HH11 ARG 54 -13.600 5.719 -3.258
404 HH12 ARG 54 HH12 ARG 54 -14.624 6.668 -4.233
405 HH21 ARG 54 HH21 ARG 54 -17.267 4.284 -4.229
406 HH22 ARG 54 HH22 ARG 54 -16.826 5.846 -4.741
407 H THR 55 HN THR 55 -11.806 -1.012 -5.038
408 HA THR 55 HA THR 55 -13.309 -3.326 -4.431
409 HB THR 55 HB THR 55 -14.013 -3.085 -6.747
410 HG1 THR 55 HG1 THR 55 -12.918 -5.085 -7.616
411 HG21 THR 55 HG21 THR 55 -12.428 -3.186 -8.631
412 HG22 THR 55 HG22 THR 55 -11.081 -3.158 -7.496
413 HG23 THR 55 HG23 THR 55 -12.149 -1.762 -7.628
414 H VAL 56 HN VAL 56 -10.284 -1.806 -5.348
415 HA VAL 56 HA VAL 56 -8.890 -4.099 -4.227
416 HB VAL 56 HB VAL 56 -6.973 -3.440 -5.761
417 HG11 VAL 56 HG11 VAL 56 -7.920 -4.652 -7.715
418 HG12 VAL 56 HG12 VAL 56 -9.527 -4.494 -7.003
419 HG13 VAL 56 HG13 VAL 56 -8.288 -5.443 -6.187
420 HG21 VAL 56 HG21 VAL 56 -7.768 -1.245 -6.411
421 HG22 VAL 56 HG22 VAL 56 -9.172 -1.968 -7.195
422 HG23 VAL 56 HG23 VAL 56 -7.552 -2.271 -7.829
423 HA PRO 57 HA PRO 57 -6.947 -1.253 -1.430
424 HB2 PRO 57 HB2 PRO 57 -4.489 -2.492 -1.224
425 HB3 PRO 57 HB1 PRO 57 -5.921 -3.019 -0.340
426 HG2 PRO 57 HG2 PRO 57 -4.772 -4.087 -2.878
427 HG3 PRO 57 HG1 PRO 57 -5.450 -4.971 -1.492
428 HD2 PRO 57 HD2 PRO 57 -6.803 -4.597 -3.761
429 HD3 PRO 57 HD1 PRO 57 -7.622 -4.579 -2.181
430 H THR 58 HN THR 58 -5.390 0.391 -1.444
431 HA THR 58 HA THR 58 -3.668 0.559 -3.792
432 HB THR 58 HB THR 58 -5.234 2.895 -2.656
433 HG1 THR 58 HG1 THR 58 -5.981 0.904 -4.201
434 HG21 THR 58 HG21 THR 58 -4.514 4.081 -4.632
435 HG22 THR 58 HG22 THR 58 -3.717 2.654 -5.257
436 HG23 THR 58 HG23 THR 58 -3.080 3.461 -3.806
437 H VAL 59 HN VAL 59 -1.642 1.449 -3.296
438 HA VAL 59 HA VAL 59 -1.208 2.004 -0.455
439 HB VAL 59 HB VAL 59 1.196 1.542 -0.873
440 HG11 VAL 59 HG11 VAL 59 -0.709 -0.623 -1.644
441 HG12 VAL 59 HG12 VAL 59 -0.127 -0.200 -0.012
442 HG13 VAL 59 HG13 VAL 59 0.986 -0.879 -1.206
443 HG21 VAL 59 HG21 VAL 59 1.309 2.070 -3.228
444 HG22 VAL 59 HG22 VAL 59 0.254 0.703 -3.599
445 HG23 VAL 59 HG23 VAL 59 1.871 0.420 -2.944
446 H LYS 60 HN LYS 60 -0.588 3.905 0.150
447 HA LYS 60 HA LYS 60 0.383 5.806 -1.876
448 HB2 LYS 60 HB2 LYS 60 -1.712 6.404 -0.450
449 HB3 LYS 60 HB1 LYS 60 -0.600 6.428 0.892
450 HG2 LYS 60 HG2 LYS 60 0.724 8.185 -0.158
451 HG3 LYS 60 HG1 LYS 60 -0.377 8.203 -1.532
452 HD2 LYS 60 HD2 LYS 60 -0.934 10.014 -0.042
453 HD3 LYS 60 HD1 LYS 60 -2.217 8.804 0.015
454 HE2 LYS 60 HE2 LYS 60 -1.296 7.894 2.078
455 HE3 LYS 60 HE1 LYS 60 0.033 9.051 2.003
456 HZ1 LYS 60 HZ1 LYS 60 -1.553 10.826 2.260
457 HZ2 LYS 60 HZ2 LYS 60 -1.715 9.707 3.535
458 HZ3 LYS 60 HZ3 LYS 60 -2.834 9.723 2.281
459 H PHE 61 HN PHE 61 2.525 5.840 -1.796
460 HA PHE 61 HA PHE 61 3.949 4.890 0.533
461 HB2 PHE 61 HB2 PHE 61 4.980 6.095 -2.025
462 HB3 PHE 61 HB1 PHE 61 5.978 5.405 -0.756
463 HD1 PHE 61 HD1 PHE 61 3.545 4.697 -3.379
464 HD2 PHE 61 HD2 PHE 61 6.238 3.023 -0.540
465 HE1 PHE 61 HE1 PHE 61 3.356 2.546 -4.485
466 HE2 PHE 61 HE2 PHE 61 6.057 0.847 -1.655
467 HZ PHE 61 HZ PHE 61 4.611 0.606 -3.647
468 H ALA 62 HN ALA 62 5.720 6.122 1.480
469 HA ALA 62 HA ALA 62 4.840 8.593 2.478
470 HB1 ALA 62 HB1 ALA 62 6.989 8.743 3.581
471 HB2 ALA 62 HB2 ALA 62 7.636 7.482 2.534
472 HB3 ALA 62 HB3 ALA 62 6.364 7.096 3.693
473 H ASP 63 HN ASP 63 6.326 7.874 -0.464
474 HA ASP 63 HA ASP 63 7.514 10.490 -0.778
475 HB2 ASP 63 HB2 ASP 63 8.278 9.820 -2.903
476 HB3 ASP 63 HB1 ASP 63 8.417 8.367 -1.927
477 H GLY 64 HN GLY 64 4.454 9.177 -0.913
478 HA2 GLY 64 HA2 GLY 64 2.565 10.544 -1.087
479 HA3 GLY 64 HA1 GLY 64 3.466 11.627 -2.134
480 H SER 65 HN SER 65 4.110 8.609 -3.272
481 HA SER 65 HA SER 65 2.177 9.062 -5.378
482 HB2 SER 65 HB2 SER 65 4.627 8.699 -5.860
483 HB3 SER 65 HB1 SER 65 4.419 7.037 -5.316
484 HG SER 65 HG SER 65 3.407 8.366 -7.527
485 H THR 66 HN THR 66 0.671 7.540 -6.056
486 HA THR 66 HA THR 66 0.106 5.365 -4.185
487 HB THR 66 HB THR 66 -2.168 5.641 -5.509
488 HG1 THR 66 HG1 THR 66 -2.064 7.309 -6.713
489 HG21 THR 66 HG21 THR 66 -1.983 5.777 -3.113
490 HG22 THR 66 HG22 THR 66 -2.976 7.109 -3.705
491 HG23 THR 66 HG23 THR 66 -1.299 7.406 -3.225
492 H LEU 67 HN LEU 67 -0.175 3.352 -4.957
493 HA LEU 67 HA LEU 67 -0.449 2.931 -7.847
494 HB2 LEU 67 HB2 LEU 67 1.317 1.273 -6.013
495 HB3 LEU 67 HB1 LEU 67 0.856 0.795 -7.622
496 HG LEU 67 HG LEU 67 2.644 3.123 -6.891
497 HD11 LEU 67 HD11 LEU 67 4.386 1.788 -7.951
498 HD12 LEU 67 HD12 LEU 67 3.220 0.517 -8.283
499 HD13 LEU 67 HD13 LEU 67 3.664 0.872 -6.623
500 HD21 LEU 67 HD21 LEU 67 1.350 3.648 -8.907
501 HD22 LEU 67 HD22 LEU 67 1.791 2.087 -9.599
502 HD23 LEU 67 HD23 LEU 67 3.032 3.304 -9.318
503 H THR 68 HN THR 68 -2.033 1.603 -8.375
504 HA THR 68 HA THR 68 -3.873 0.664 -6.430
505 HB THR 68 HB THR 68 -3.630 -0.146 -9.338
506 HG1 THR 68 HG1 THR 68 -4.883 2.254 -8.322
507 HG21 THR 68 HG21 THR 68 -6.088 -0.224 -9.223
508 HG22 THR 68 HG22 THR 68 -6.020 0.279 -7.535
509 HG23 THR 68 HG23 THR 68 -5.362 -1.284 -8.016
510 H ASN 69 HN ASN 69 -4.125 -1.489 -5.694
511 HA ASN 69 HA ASN 69 -2.508 -2.945 -4.549
512 HB2 ASN 69 HB2 ASN 69 -4.718 -3.791 -4.947
513 HB3 ASN 69 HB1 ASN 69 -4.234 -4.427 -6.533
514 HD21 ASN 69 HD21 ASN 69 -4.613 -6.590 -6.026
515 HD22 ASN 69 HD22 ASN 69 -3.667 -7.437 -4.853
516 HA PRO 70 HA PRO 70 0.930 -4.064 -7.260
517 HB2 PRO 70 HB2 PRO 70 2.783 -2.941 -5.689
518 HB3 PRO 70 HB1 PRO 70 1.847 -2.004 -6.855
519 HG2 PRO 70 HG2 PRO 70 1.700 -1.978 -3.925
520 HG3 PRO 70 HG1 PRO 70 1.065 -0.807 -5.091
521 HD2 PRO 70 HD2 PRO 70 -0.328 -2.950 -3.688
522 HD3 PRO 70 HD1 PRO 70 -0.977 -1.646 -4.701
523 H SER 71 HN SER 71 2.424 -5.618 -7.043
524 HA SER 71 HA SER 71 2.062 -7.494 -4.958
525 HB2 SER 71 HB2 SER 71 2.606 -8.188 -7.237
526 HB3 SER 71 HB1 SER 71 4.129 -7.310 -7.167
527 HG SER 71 HG SER 71 4.938 -9.012 -6.435
528 H ALA 72 HN ALA 72 3.908 -8.339 -3.666
529 HA ALA 72 HA ALA 72 4.962 -6.374 -1.929
530 HB1 ALA 72 HB1 ALA 72 4.492 -8.660 -1.221
531 HB2 ALA 72 HB2 ALA 72 6.163 -8.215 -0.871
532 HB3 ALA 72 HB3 ALA 72 5.798 -9.258 -2.247
533 H ASP 73 HN ASP 73 6.422 -8.036 -4.645
534 HA ASP 73 HA ASP 73 9.016 -6.965 -4.133
535 HB2 ASP 73 HB2 ASP 73 9.632 -7.816 -6.356
536 HB3 ASP 73 HB1 ASP 73 8.759 -9.033 -5.438
537 H GLU 74 HN GLU 74 6.208 -5.831 -5.719
538 HA GLU 74 HA GLU 74 7.446 -3.782 -7.298
539 HB2 GLU 74 HB2 GLU 74 4.585 -4.235 -6.460
540 HB3 GLU 74 HB1 GLU 74 5.106 -2.989 -7.584
541 HG2 GLU 74 HG2 GLU 74 5.604 -5.918 -8.018
542 HG3 GLU 74 HG1 GLU 74 4.172 -5.078 -8.612
543 H VAL 75 HN VAL 75 5.624 -3.868 -4.253
544 HA VAL 75 HA VAL 75 5.874 -1.102 -3.780
545 HB VAL 75 HB VAL 75 5.411 -1.714 -1.286
546 HG11 VAL 75 HG11 VAL 75 3.678 -0.947 -2.843
547 HG12 VAL 75 HG12 VAL 75 3.075 -2.230 -1.788
548 HG13 VAL 75 HG13 VAL 75 3.543 -2.600 -3.454
549 HG21 VAL 75 HG21 VAL 75 4.814 -4.320 -2.602
550 HG22 VAL 75 HG22 VAL 75 4.532 -3.915 -0.908
551 HG23 VAL 75 HG23 VAL 75 6.192 -4.066 -1.529
552 H LYS 76 HN LYS 76 7.951 -3.781 -2.916
553 HA LYS 76 HA LYS 76 9.735 -2.375 -1.275
554 HB2 LYS 76 HB2 LYS 76 10.134 -4.759 -3.057
555 HB3 LYS 76 HB1 LYS 76 11.450 -4.087 -2.095
556 HG2 LYS 76 HG2 LYS 76 10.160 -4.552 -0.060
557 HG3 LYS 76 HG1 LYS 76 8.845 -5.192 -1.043
558 HD2 LYS 76 HD2 LYS 76 10.164 -7.027 -0.165
559 HD3 LYS 76 HD1 LYS 76 10.378 -6.937 -1.910
560 HE2 LYS 76 HE2 LYS 76 12.515 -7.354 -0.909
561 HE3 LYS 76 HE1 LYS 76 12.521 -5.704 -1.512
562 HZ1 LYS 76 HZ1 LYS 76 12.196 -6.574 1.308
563 HZ2 LYS 76 HZ2 LYS 76 12.021 -4.982 0.821
564 HZ3 LYS 76 HZ3 LYS 76 13.509 -5.750 0.657
565 H ALA 77 HN ALA 77 9.479 -2.526 -4.768
566 HA ALA 77 HA ALA 77 11.982 -1.489 -5.428
567 HB1 ALA 77 HB1 ALA 77 11.026 -0.960 -7.600
568 HB2 ALA 77 HB2 ALA 77 9.399 -1.153 -6.948
569 HB3 ALA 77 HB3 ALA 77 10.475 -2.544 -7.055
570 H LYS 78 HN LYS 78 8.989 0.194 -4.596
571 HA LYS 78 HA LYS 78 10.282 2.716 -5.062
572 HB2 LYS 78 HB2 LYS 78 7.597 2.173 -3.828
573 HB3 LYS 78 HB1 LYS 78 8.232 3.779 -4.128
574 HG2 LYS 78 HG2 LYS 78 8.380 3.167 -6.548
575 HG3 LYS 78 HG1 LYS 78 7.516 1.681 -6.151
576 HD2 LYS 78 HD2 LYS 78 5.731 2.975 -6.687
577 HD3 LYS 78 HD1 LYS 78 5.895 3.387 -4.979
578 HE2 LYS 78 HE2 LYS 78 6.984 4.996 -7.292
579 HE3 LYS 78 HE1 LYS 78 5.511 5.366 -6.411
580 HZ1 LYS 78 HZ1 LYS 78 7.414 6.713 -5.828
581 HZ2 LYS 78 HZ2 LYS 78 8.258 5.409 -5.232
582 HZ3 LYS 78 HZ3 LYS 78 6.836 5.952 -4.465
583 H LEU 79 HN LEU 79 9.231 0.820 -2.319
584 HA LEU 79 HA LEU 79 9.678 2.651 -0.261
585 HB2 LEU 79 HB2 LEU 79 8.286 0.659 -0.086
586 HB3 LEU 79 HB1 LEU 79 9.697 -0.358 -0.238
587 HG LEU 79 HG LEU 79 10.518 0.495 1.921
588 HD11 LEU 79 HD11 LEU 79 9.445 2.655 1.984
589 HD12 LEU 79 HD12 LEU 79 8.988 1.709 3.394
590 HD13 LEU 79 HD13 LEU 79 7.856 1.897 2.052
591 HD21 LEU 79 HD21 LEU 79 7.758 -0.694 1.952
592 HD22 LEU 79 HD22 LEU 79 8.885 -0.696 3.304
593 HD23 LEU 79 HD23 LEU 79 9.281 -1.574 1.826
594 H VAL 80 HN VAL 80 11.876 0.405 -1.837
595 HA VAL 80 HA VAL 80 13.935 0.451 0.060
596 HB VAL 80 HB VAL 80 13.672 -1.191 -1.829
597 HG11 VAL 80 HG11 VAL 80 13.213 0.212 -3.668
598 HG12 VAL 80 HG12 VAL 80 14.669 -0.719 -4.016
599 HG13 VAL 80 HG13 VAL 80 14.792 0.982 -3.553
600 HG21 VAL 80 HG21 VAL 80 15.699 -1.272 -0.594
601 HG22 VAL 80 HG22 VAL 80 16.368 0.085 -1.521
602 HG23 VAL 80 HG23 VAL 80 16.096 -1.465 -2.304
603 H LYS 81 HN LYS 81 13.081 2.673 -2.484
604 HA LYS 81 HA LYS 81 15.531 4.180 -2.389
605 HB2 LYS 81 HB2 LYS 81 12.848 5.036 -3.478
606 HB3 LYS 81 HB1 LYS 81 14.392 5.801 -3.791
607 HG2 LYS 81 HG2 LYS 81 15.118 3.788 -4.989
608 HG3 LYS 81 HG1 LYS 81 13.530 3.071 -4.699
609 HD2 LYS 81 HD2 LYS 81 12.546 5.149 -5.857
610 HD3 LYS 81 HD1 LYS 81 14.192 5.526 -6.274
611 HE2 LYS 81 HE2 LYS 81 13.007 2.874 -6.978
612 HE3 LYS 81 HE1 LYS 81 12.876 4.271 -8.042
613 HZ1 LYS 81 HZ1 LYS 81 15.227 4.373 -8.216
614 HZ2 LYS 81 HZ2 LYS 81 14.788 2.763 -8.504
615 HZ3 LYS 81 HZ3 LYS 81 15.464 3.199 -7.041
616 H ILE 82 HN ILE 82 12.236 4.535 -1.257
617 HA ILE 82 HA ILE 82 12.351 7.104 -0.175
618 HB ILE 82 HB ILE 82 10.649 4.785 0.728
619 HG12 ILE 82 HG12 ILE 82 10.078 6.902 -1.372
620 HG13 ILE 82 HG11 ILE 82 10.449 5.209 -1.676
621 HG21 ILE 82 HG21 ILE 82 10.606 6.622 2.344
622 HG22 ILE 82 HG22 ILE 82 9.061 6.487 1.506
623 HG23 ILE 82 HG23 ILE 82 10.196 7.762 1.058
624 HD11 ILE 82 HD11 ILE 82 8.392 4.552 -0.563
625 HD12 ILE 82 HD12 ILE 82 8.096 5.645 -1.914
626 HD13 ILE 82 HD13 ILE 82 8.021 6.252 -0.256
627 H ALA 83 HN ALA 83 13.062 3.984 1.331
628 HA ALA 83 HA ALA 83 13.478 5.015 3.944
629 HB1 ALA 83 HB1 ALA 83 14.508 2.852 4.429
630 HB2 ALA 83 HB2 ALA 83 14.529 2.471 2.707
631 HB3 ALA 83 HB3 ALA 83 12.992 2.664 3.552
632 H GLY 84 HN GLY 84 15.416 5.112 1.127
633 HA2 GLY 84 HA2 GLY 84 17.453 6.194 0.828
634 HA3 GLY 84 HA1 GLY 84 17.550 6.405 2.575
635 H LEU 85 HN LEU 85 16.912 3.348 1.179
636 HA LEU 85 HA LEU 85 19.475 2.394 2.193
637 HB2 LEU 85 HB2 LEU 85 16.960 0.921 1.449
638 HB3 LEU 85 HB1 LEU 85 18.441 0.123 1.978
639 HG LEU 85 HG LEU 85 16.711 1.990 3.612
640 HD11 LEU 85 HD11 LEU 85 15.630 -0.148 3.174
641 HD12 LEU 85 HD12 LEU 85 16.121 -0.018 4.863
642 HD13 LEU 85 HD13 LEU 85 17.066 -1.000 3.744
643 HD21 LEU 85 HD21 LEU 85 19.053 2.106 4.280
644 HD22 LEU 85 HD22 LEU 85 19.123 0.348 4.386
645 HD23 LEU 85 HD23 LEU 85 18.102 1.259 5.499
646 H GLU 86 HN GLU 86 17.477 2.493 -0.731
647 HA GLU 86 HA GLU 86 19.349 1.034 -2.300
648 HB2 GLU 86 HB2 GLU 86 16.969 1.239 -3.016
649 HB3 GLU 86 HB1 GLU 86 17.208 2.964 -3.254
650 HG2 GLU 86 HG2 GLU 86 18.956 2.436 -4.942
651 HG3 GLU 86 HG1 GLU 86 18.555 0.732 -4.762
652 H HIS 87 HN HIS 87 21.244 1.708 -2.623
653 HA HIS 87 HA HIS 87 21.672 4.496 -3.462
654 HB2 HIS 87 HB2 HIS 87 23.709 2.550 -2.290
655 HB3 HIS 87 HB1 HIS 87 24.053 4.194 -2.800
656 HD1 HIS 87 HD1 HIS 87 23.531 2.377 0.211
657 HD2 HIS 87 HD2 HIS 87 22.223 6.056 -1.214
658 HE1 HIS 87 HE1 HIS 87 22.839 3.699 2.224
659 H HIS 88 HN HIS 88 23.047 1.273 -3.764
660 HA HIS 88 HA HIS 88 22.447 0.716 -6.363
661 HB2 HIS 88 HB2 HIS 88 24.028 2.597 -6.942
662 HB3 HIS 88 HB1 HIS 88 25.306 1.743 -6.096
663 HD1 HIS 88 HD1 HIS 88 23.178 1.506 -9.219
664 HD2 HIS 88 HD2 HIS 88 26.539 -0.263 -7.526
665 HE1 HIS 88 HE1 HIS 88 24.209 0.077 -11.027
Start of MODEL 8
1 H1 MET 1 HT1 MET 1 9.792 12.726 4.246
2 H2 MET 1 HT2 MET 1 11.241 11.876 4.166
3 H3 MET 1 HT3 MET 1 11.253 13.506 4.592
4 HA MET 1 HA MET 1 11.565 12.116 6.525
5 HB2 MET 1 HB2 MET 1 10.117 14.277 6.542
6 HB3 MET 1 HB1 MET 1 8.738 13.199 6.564
7 HG2 MET 1 HG2 MET 1 10.900 13.278 8.661
8 HG3 MET 1 HG1 MET 1 9.352 14.100 8.786
9 HE1 MET 1 HE1 MET 1 9.042 11.249 11.428
10 HE2 MET 1 HE2 MET 1 8.893 12.980 11.128
11 HE3 MET 1 HE3 MET 1 10.476 12.206 11.049
12 H VAL 2 HN VAL 2 11.494 9.935 6.758
13 HA VAL 2 HA VAL 2 9.158 8.621 5.752
14 HB VAL 2 HB VAL 2 11.272 7.617 5.099
15 HG11 VAL 2 HG11 VAL 2 12.730 6.425 6.675
16 HG12 VAL 2 HG12 VAL 2 11.821 7.144 8.010
17 HG13 VAL 2 HG13 VAL 2 12.716 8.173 6.890
18 HG21 VAL 2 HG21 VAL 2 9.398 6.108 5.239
19 HG22 VAL 2 HG22 VAL 2 9.711 5.818 6.947
20 HG23 VAL 2 HG23 VAL 2 10.864 5.259 5.733
21 H THR 3 HN THR 3 7.789 9.507 7.166
22 HA THR 3 HA THR 3 7.785 8.668 9.932
23 HB THR 3 HB THR 3 6.962 10.908 9.418
24 HG1 THR 3 HG1 THR 3 5.807 9.360 10.972
25 HG21 THR 3 HG21 THR 3 6.167 10.572 7.136
26 HG22 THR 3 HG22 THR 3 4.890 11.287 8.118
27 HG23 THR 3 HG23 THR 3 4.838 9.569 7.722
28 H ALA 4 HN ALA 4 6.634 7.592 6.936
29 HA ALA 4 HA ALA 4 5.462 5.257 8.138
30 HB1 ALA 4 HB1 ALA 4 4.081 6.965 6.050
31 HB2 ALA 4 HB2 ALA 4 3.529 6.729 7.706
32 HB3 ALA 4 HB3 ALA 4 3.541 5.371 6.578
33 H ALA 5 HN ALA 5 5.773 3.517 6.705
34 HA ALA 5 HA ALA 5 7.741 3.996 4.653
35 HB1 ALA 5 HB1 ALA 5 6.293 1.462 5.492
36 HB2 ALA 5 HB2 ALA 5 7.908 1.955 6.001
37 HB3 ALA 5 HB3 ALA 5 7.600 1.529 4.320
38 H LEU 6 HN LEU 6 4.623 2.336 4.700
39 HA LEU 6 HA LEU 6 3.604 3.934 2.685
40 HB2 LEU 6 HB2 LEU 6 3.156 2.151 0.985
41 HB3 LEU 6 HB1 LEU 6 4.825 2.608 1.123
42 HG LEU 6 HG LEU 6 4.778 0.312 0.661
43 HD11 LEU 6 HD11 LEU 6 5.779 -0.846 2.502
44 HD12 LEU 6 HD12 LEU 6 5.321 0.475 3.573
45 HD13 LEU 6 HD13 LEU 6 6.442 0.769 2.245
46 HD21 LEU 6 HD21 LEU 6 3.553 -1.354 1.967
47 HD22 LEU 6 HD22 LEU 6 2.561 -0.186 1.082
48 HD23 LEU 6 HD23 LEU 6 2.764 -0.007 2.828
49 H THR 7 HN THR 7 1.466 4.001 2.636
50 HA THR 7 HA THR 7 0.234 2.539 4.832
51 HB THR 7 HB THR 7 -0.631 5.149 3.567
52 HG1 THR 7 HG1 THR 7 1.072 4.500 5.731
53 HG21 THR 7 HG21 THR 7 -2.396 3.935 4.809
54 HG22 THR 7 HG22 THR 7 -1.911 5.405 5.655
55 HG23 THR 7 HG23 THR 7 -1.329 3.837 6.211
56 H ILE 8 HN ILE 8 -1.237 1.145 4.368
57 HA ILE 8 HA ILE 8 -2.254 0.813 1.670
58 HB ILE 8 HB ILE 8 -2.265 -0.921 4.133
59 HG12 ILE 8 HG12 ILE 8 -0.899 -1.275 1.462
60 HG13 ILE 8 HG11 ILE 8 -0.116 -0.727 2.939
61 HG21 ILE 8 HG21 ILE 8 -3.527 -1.524 1.477
62 HG22 ILE 8 HG22 ILE 8 -4.301 -1.335 3.064
63 HG23 ILE 8 HG23 ILE 8 -3.230 -2.706 2.767
64 HD11 ILE 8 HD11 ILE 8 -1.384 -3.422 2.505
65 HD12 ILE 8 HD12 ILE 8 -0.592 -2.877 3.984
66 HD13 ILE 8 HD13 ILE 8 0.342 -3.061 2.498
67 H TYR 9 HN TYR 9 -4.260 1.329 1.113
68 HA TYR 9 HA TYR 9 -6.273 1.858 3.185
69 HB2 TYR 9 HB2 TYR 9 -6.141 2.696 0.281
70 HB3 TYR 9 HB1 TYR 9 -7.505 3.002 1.339
71 HD1 TYR 9 HD1 TYR 9 -6.866 4.291 3.564
72 HD2 TYR 9 HD2 TYR 9 -4.594 4.362 -0.017
73 HE1 TYR 9 HE1 TYR 9 -5.872 6.422 4.248
74 HE2 TYR 9 HE2 TYR 9 -3.594 6.502 0.676
75 HH TYR 9 HH TYR 9 -3.984 7.773 3.833
76 H THR 10 HN THR 10 -7.690 0.265 3.519
77 HA THR 10 HA THR 10 -8.953 -1.020 1.332
78 HB THR 10 HB THR 10 -6.819 -2.324 1.456
79 HG1 THR 10 HG1 THR 10 -9.032 -3.886 2.352
80 HG21 THR 10 HG21 THR 10 -6.395 -3.803 3.385
81 HG22 THR 10 HG22 THR 10 -7.765 -3.079 4.231
82 HG23 THR 10 HG23 THR 10 -6.349 -2.100 3.845
83 H THR 11 HN THR 11 -10.708 -2.408 2.105
84 HA THR 11 HA THR 11 -11.356 -2.069 4.930
85 HB THR 11 HB THR 11 -13.658 -2.805 3.518
86 HG1 THR 11 HG1 THR 11 -13.576 -1.821 1.661
87 HG21 THR 11 HG21 THR 11 -14.446 -0.568 4.151
88 HG22 THR 11 HG22 THR 11 -12.788 -0.084 4.508
89 HG23 THR 11 HG23 THR 11 -13.570 -1.336 5.473
90 H SER 12 HN SER 12 -13.038 -3.992 5.496
91 HA SER 12 HA SER 12 -11.493 -6.365 5.152
92 HB2 SER 12 HB2 SER 12 -12.577 -5.837 7.310
93 HB3 SER 12 HB1 SER 12 -14.155 -5.946 6.550
94 HG SER 12 HG SER 12 -13.088 -8.200 5.940
95 H TRP 13 HN TRP 13 -14.224 -4.981 3.579
96 HA TRP 13 HA TRP 13 -15.176 -7.477 2.556
97 HB2 TRP 13 HB2 TRP 13 -16.680 -6.111 1.104
98 HB3 TRP 13 HB1 TRP 13 -16.809 -5.717 2.809
99 HD1 TRP 13 HD1 TRP 13 -16.234 -3.251 3.522
100 HE1 TRP 13 HE1 TRP 13 -15.709 -1.101 2.213
101 HE3 TRP 13 HE3 TRP 13 -15.525 -5.270 -1.112
102 HZ2 TRP 13 HZ2 TRP 13 -15.109 -0.354 -0.427
103 HZ3 TRP 13 HZ3 TRP 13 -15.005 -3.781 -2.968
104 HH2 TRP 13 HH2 TRP 13 -14.788 -1.363 -2.638
105 H CYS 14 HN CYS 14 -12.600 -5.471 1.722
106 HA CYS 14 HA CYS 14 -12.546 -6.018 -1.079
107 HB2 CYS 14 HB2 CYS 14 -10.344 -5.096 0.773
108 HB3 CYS 14 HB1 CYS 14 -10.306 -5.036 -0.984
109 HG CYS 14 HG CYS 14 -11.948 -3.005 -1.324
110 H GLY 15 HN GLY 15 -12.264 -8.073 -1.755
111 HA2 GLY 15 HA2 GLY 15 -11.311 -10.206 -0.196
112 HA3 GLY 15 HA1 GLY 15 -11.490 -10.225 -1.937
113 H TYR 16 HN TYR 16 -9.560 -7.950 -2.051
114 HA TYR 16 HA TYR 16 -7.203 -9.585 -2.267
115 HB2 TYR 16 HB2 TYR 16 -7.764 -6.757 -2.970
116 HB3 TYR 16 HB1 TYR 16 -6.157 -7.460 -3.151
117 HD1 TYR 16 HD1 TYR 16 -5.975 -9.505 -4.668
118 HD2 TYR 16 HD2 TYR 16 -9.354 -6.928 -4.640
119 HE1 TYR 16 HE1 TYR 16 -6.596 -10.300 -6.913
120 HE2 TYR 16 HE2 TYR 16 -9.990 -7.721 -6.868
121 HH TYR 16 HH TYR 16 -8.603 -10.446 -8.309
122 H CYS 17 HN CYS 17 -8.457 -7.856 0.318
123 HA CYS 17 HA CYS 17 -6.293 -6.372 1.217
124 HB2 CYS 17 HB2 CYS 17 -7.307 -6.542 3.489
125 HB3 CYS 17 HB1 CYS 17 -8.452 -6.058 2.247
126 HG CYS 17 HG CYS 17 -9.934 -8.234 2.238
127 H LEU 18 HN LEU 18 -7.151 -9.654 2.331
128 HA LEU 18 HA LEU 18 -4.683 -9.959 3.701
129 HB2 LEU 18 HB2 LEU 18 -5.300 -12.224 4.178
130 HB3 LEU 18 HB1 LEU 18 -6.725 -11.234 4.334
131 HG LEU 18 HG LEU 18 -6.117 -13.038 1.984
132 HD11 LEU 18 HD11 LEU 18 -7.964 -13.436 4.322
133 HD12 LEU 18 HD12 LEU 18 -6.478 -14.326 3.988
134 HD13 LEU 18 HD13 LEU 18 -7.865 -14.482 2.906
135 HD21 LEU 18 HD21 LEU 18 -7.568 -11.211 1.340
136 HD22 LEU 18 HD22 LEU 18 -8.628 -11.525 2.716
137 HD23 LEU 18 HD23 LEU 18 -8.495 -12.712 1.412
138 H ARG 19 HN ARG 19 -5.663 -10.519 0.469
139 HA ARG 19 HA ARG 19 -3.713 -12.312 -0.381
140 HB2 ARG 19 HB2 ARG 19 -5.592 -11.723 -1.811
141 HB3 ARG 19 HB1 ARG 19 -5.023 -10.067 -1.914
142 HG2 ARG 19 HG2 ARG 19 -4.502 -11.175 -3.967
143 HG3 ARG 19 HG1 ARG 19 -2.997 -10.875 -3.104
144 HD2 ARG 19 HD2 ARG 19 -4.482 -13.501 -3.121
145 HD3 ARG 19 HD1 ARG 19 -3.135 -13.125 -4.191
146 HE ARG 19 HE ARG 19 -2.066 -12.740 -1.765
147 HH11 ARG 19 HH11 ARG 19 -3.936 -15.439 -3.095
148 HH12 ARG 19 HH12 ARG 19 -3.206 -16.634 -2.135
149 HH21 ARG 19 HH21 ARG 19 -1.086 -14.389 -0.382
150 HH22 ARG 19 HH22 ARG 19 -1.542 -16.024 -0.555
151 H LEU 20 HN LEU 20 -3.712 -8.777 -0.370
152 HA LEU 20 HA LEU 20 -1.078 -8.525 -1.317
153 HB2 LEU 20 HB2 LEU 20 -2.633 -6.717 -1.583
154 HB3 LEU 20 HB1 LEU 20 -2.895 -6.619 0.143
155 HG LEU 20 HG LEU 20 -0.642 -5.823 0.456
156 HD11 LEU 20 HD11 LEU 20 0.731 -5.094 -1.480
157 HD12 LEU 20 HD12 LEU 20 -0.433 -5.853 -2.565
158 HD13 LEU 20 HD13 LEU 20 0.503 -6.839 -1.441
159 HD21 LEU 20 HD21 LEU 20 -0.935 -3.589 -0.499
160 HD22 LEU 20 HD22 LEU 20 -2.444 -4.215 0.166
161 HD23 LEU 20 HD23 LEU 20 -2.170 -4.220 -1.580
162 H LYS 21 HN LYS 21 -2.447 -8.651 1.935
163 HA LYS 21 HA LYS 21 -0.241 -7.828 3.444
164 HB2 LYS 21 HB2 LYS 21 -2.220 -9.963 4.254
165 HB3 LYS 21 HB1 LYS 21 -1.171 -9.065 5.332
166 HG2 LYS 21 HG2 LYS 21 -3.435 -7.944 3.703
167 HG3 LYS 21 HG1 LYS 21 -3.463 -8.256 5.434
168 HD2 LYS 21 HD2 LYS 21 -1.684 -6.571 5.720
169 HD3 LYS 21 HD1 LYS 21 -1.721 -6.265 3.982
170 HE2 LYS 21 HE2 LYS 21 -3.054 -4.588 5.087
171 HE3 LYS 21 HE1 LYS 21 -4.122 -5.666 4.183
172 HZ1 LYS 21 HZ1 LYS 21 -5.107 -5.312 6.302
173 HZ2 LYS 21 HZ2 LYS 21 -3.671 -5.476 7.079
174 HZ3 LYS 21 HZ3 LYS 21 -4.420 -6.858 6.445
175 H THR 22 HN THR 22 -1.075 -11.096 2.350
176 HA THR 22 HA THR 22 0.926 -12.479 3.674
177 HB THR 22 HB THR 22 0.692 -14.252 1.912
178 HG1 THR 22 HG1 THR 22 -0.702 -12.178 0.602
179 HG21 THR 22 HG21 THR 22 -1.647 -14.770 2.420
180 HG22 THR 22 HG22 THR 22 -1.896 -13.117 2.981
181 HG23 THR 22 HG23 THR 22 -0.808 -14.190 3.859
182 H ALA 23 HN ALA 23 1.148 -10.818 0.584
183 HA ALA 23 HA ALA 23 3.681 -11.888 -0.122
184 HB1 ALA 23 HB1 ALA 23 2.134 -10.982 -1.791
185 HB2 ALA 23 HB2 ALA 23 3.696 -10.172 -1.864
186 HB3 ALA 23 HB3 ALA 23 2.321 -9.374 -1.097
187 H LEU 24 HN LEU 24 2.597 -9.046 1.615
188 HA LEU 24 HA LEU 24 5.198 -7.847 1.735
189 HB2 LEU 24 HB2 LEU 24 2.814 -7.309 3.491
190 HB3 LEU 24 HB1 LEU 24 4.230 -6.306 3.359
191 HG LEU 24 HG LEU 24 2.084 -6.724 1.294
192 HD11 LEU 24 HD11 LEU 24 1.809 -4.265 1.618
193 HD12 LEU 24 HD12 LEU 24 2.999 -4.361 2.901
194 HD13 LEU 24 HD13 LEU 24 1.470 -5.211 3.074
195 HD21 LEU 24 HD21 LEU 24 4.644 -5.137 1.050
196 HD22 LEU 24 HD22 LEU 24 3.251 -4.991 -0.003
197 HD23 LEU 24 HD23 LEU 24 4.136 -6.497 0.028
198 H THR 25 HN THR 25 3.288 -9.793 3.957
199 HA THR 25 HA THR 25 5.134 -9.722 6.050
200 HB THR 25 HB THR 25 3.094 -11.858 5.351
201 HG1 THR 25 HG1 THR 25 1.669 -10.543 6.188
202 HG21 THR 25 HG21 THR 25 4.379 -11.169 8.016
203 HG22 THR 25 HG22 THR 25 4.729 -12.609 7.062
204 HG23 THR 25 HG23 THR 25 3.122 -12.380 7.760
205 H ALA 26 HN ALA 26 4.949 -11.724 3.163
206 HA ALA 26 HA ALA 26 6.833 -13.694 3.864
207 HB1 ALA 26 HB1 ALA 26 5.296 -13.905 1.963
208 HB2 ALA 26 HB2 ALA 26 6.971 -14.153 1.468
209 HB3 ALA 26 HB3 ALA 26 6.169 -12.621 1.123
210 H ASN 27 HN ASN 27 7.214 -10.437 2.763
211 HA ASN 27 HA ASN 27 10.132 -10.787 2.485
212 HB2 ASN 27 HB2 ASN 27 8.232 -8.738 1.400
213 HB3 ASN 27 HB1 ASN 27 9.957 -8.413 1.497
214 HD21 ASN 27 HD21 ASN 27 7.470 -10.331 -0.033
215 HD22 ASN 27 HD22 ASN 27 8.470 -10.873 -1.336
216 H ARG 28 HN ARG 28 8.066 -10.149 4.782
217 HA ARG 28 HA ARG 28 7.756 -8.788 6.512
218 HB2 ARG 28 HB2 ARG 28 10.736 -9.128 6.641
219 HB3 ARG 28 HB1 ARG 28 9.820 -8.321 7.902
220 HG2 ARG 28 HG2 ARG 28 8.444 -10.437 8.059
221 HG3 ARG 28 HG1 ARG 28 9.680 -11.191 7.045
222 HD2 ARG 28 HD2 ARG 28 10.147 -11.594 9.388
223 HD3 ARG 28 HD1 ARG 28 11.382 -10.547 8.678
224 HE ARG 28 HE ARG 28 9.609 -8.791 9.710
225 HH11 ARG 28 HH11 ARG 28 11.375 -11.514 11.146
226 HH12 ARG 28 HH12 ARG 28 11.336 -10.847 12.716
227 HH21 ARG 28 HH21 ARG 28 9.626 -7.893 11.850
228 HH22 ARG 28 HH22 ARG 28 10.343 -8.760 13.123
229 H ILE 29 HN ILE 29 7.173 -7.315 4.754
230 HA ILE 29 HA ILE 29 8.812 -4.937 4.686
231 HB ILE 29 HB ILE 29 6.148 -5.523 3.352
232 HG12 ILE 29 HG12 ILE 29 8.919 -5.449 2.140
233 HG13 ILE 29 HG11 ILE 29 8.127 -6.935 2.657
234 HG21 ILE 29 HG21 ILE 29 6.626 -3.520 2.000
235 HG22 ILE 29 HG22 ILE 29 8.127 -3.274 2.897
236 HG23 ILE 29 HG23 ILE 29 6.585 -3.103 3.722
237 HD11 ILE 29 HD11 ILE 29 6.366 -6.464 0.997
238 HD12 ILE 29 HD12 ILE 29 7.978 -6.676 0.330
239 HD13 ILE 29 HD13 ILE 29 7.295 -5.048 0.472
240 H ALA 30 HN ALA 30 8.474 -3.311 5.971
241 HA ALA 30 HA ALA 30 6.431 -3.392 7.962
242 HB1 ALA 30 HB1 ALA 30 8.448 -1.293 7.247
243 HB2 ALA 30 HB2 ALA 30 8.639 -2.550 8.480
244 HB3 ALA 30 HB3 ALA 30 7.426 -1.276 8.687
245 H TYR 31 HN TYR 31 4.453 -2.946 7.329
246 HA TYR 31 HA TYR 31 4.072 -0.638 5.573
247 HB2 TYR 31 HB2 TYR 31 1.905 -1.703 4.919
248 HB3 TYR 31 HB1 TYR 31 3.327 -2.608 4.386
249 HD1 TYR 31 HD1 TYR 31 3.828 -4.744 5.478
250 HD2 TYR 31 HD2 TYR 31 0.342 -2.555 6.444
251 HE1 TYR 31 HE1 TYR 31 2.858 -6.774 6.506
252 HE2 TYR 31 HE2 TYR 31 -0.650 -4.546 7.479
253 HH TYR 31 HH TYR 31 1.200 -7.385 8.122
254 H ASP 32 HN ASP 32 1.776 0.229 5.881
255 HA ASP 32 HA ASP 32 0.849 0.002 8.625
256 HB2 ASP 32 HB2 ASP 32 2.307 2.037 8.465
257 HB3 ASP 32 HB1 ASP 32 1.280 2.636 7.167
258 H GLU 33 HN GLU 33 -1.399 0.142 8.673
259 HA GLU 33 HA GLU 33 -2.697 0.536 6.080
260 HB2 GLU 33 HB2 GLU 33 -4.147 -1.426 6.589
261 HB3 GLU 33 HB1 GLU 33 -2.466 -1.841 6.319
262 HG2 GLU 33 HG2 GLU 33 -2.124 -2.057 8.721
263 HG3 GLU 33 HG1 GLU 33 -3.808 -1.616 9.003
264 H VAL 34 HN VAL 34 -4.663 1.513 6.195
265 HA VAL 34 HA VAL 34 -5.780 1.955 8.819
266 HB VAL 34 HB VAL 34 -4.346 3.940 8.345
267 HG11 VAL 34 HG11 VAL 34 -4.925 5.543 6.626
268 HG12 VAL 34 HG12 VAL 34 -6.132 4.429 5.995
269 HG13 VAL 34 HG13 VAL 34 -4.413 3.997 5.950
270 HG21 VAL 34 HG21 VAL 34 -6.009 5.680 8.777
271 HG22 VAL 34 HG22 VAL 34 -6.300 4.231 9.739
272 HG23 VAL 34 HG23 VAL 34 -7.287 4.557 8.315
273 H ASP 35 HN ASP 35 -7.999 2.199 8.812
274 HA ASP 35 HA ASP 35 -9.268 0.906 6.606
275 HB2 ASP 35 HB2 ASP 35 -10.096 0.319 8.722
276 HB3 ASP 35 HB1 ASP 35 -10.202 1.999 9.237
277 H ILE 36 HN ILE 36 -10.602 1.689 5.163
278 HA ILE 36 HA ILE 36 -10.564 4.526 4.677
279 HB ILE 36 HB ILE 36 -11.494 4.036 2.482
280 HG12 ILE 36 HG12 ILE 36 -11.470 1.133 3.352
281 HG13 ILE 36 HG11 ILE 36 -12.931 2.102 3.158
282 HG21 ILE 36 HG21 ILE 36 -9.196 2.342 3.413
283 HG22 ILE 36 HG22 ILE 36 -9.123 3.945 2.665
284 HG23 ILE 36 HG23 ILE 36 -9.625 2.530 1.729
285 HD11 ILE 36 HD11 ILE 36 -10.974 1.395 0.977
286 HD12 ILE 36 HD12 ILE 36 -12.455 2.335 0.774
287 HD13 ILE 36 HD13 ILE 36 -12.541 0.638 1.253
288 H GLU 37 HN GLU 37 -12.783 2.302 6.032
289 HA GLU 37 HA GLU 37 -15.133 3.510 4.967
290 HB2 GLU 37 HB2 GLU 37 -14.952 1.129 5.514
291 HB3 GLU 37 HB1 GLU 37 -14.777 1.547 7.206
292 HG2 GLU 37 HG2 GLU 37 -17.013 2.368 7.297
293 HG3 GLU 37 HG1 GLU 37 -17.199 2.171 5.551
294 H HIS 38 HN HIS 38 -13.431 3.657 8.033
295 HA HIS 38 HA HIS 38 -15.380 5.536 9.045
296 HB2 HIS 38 HB2 HIS 38 -12.882 4.377 10.277
297 HB3 HIS 38 HB1 HIS 38 -13.906 5.551 11.092
298 HD1 HIS 38 HD1 HIS 38 -15.783 4.553 12.477
299 HD2 HIS 38 HD2 HIS 38 -14.376 1.934 9.580
300 HE1 HIS 38 HE1 HIS 38 -16.973 2.400 12.847
301 H ASN 39 HN ASN 39 -13.078 5.888 6.895
302 HA ASN 39 HA ASN 39 -12.386 8.614 7.751
303 HB2 ASN 39 HB2 ASN 39 -10.560 6.560 6.490
304 HB3 ASN 39 HB1 ASN 39 -10.177 8.275 6.558
305 HD21 ASN 39 HD21 ASN 39 -8.978 5.808 7.756
306 HD22 ASN 39 HD22 ASN 39 -8.803 6.178 9.428
307 H ARG 40 HN ARG 40 -13.942 9.552 6.454
308 HA ARG 40 HA ARG 40 -14.785 8.909 3.932
309 HB2 ARG 40 HB2 ARG 40 -15.911 10.690 5.073
310 HB3 ARG 40 HB1 ARG 40 -14.449 11.676 5.089
311 HG2 ARG 40 HG2 ARG 40 -14.505 11.654 2.586
312 HG3 ARG 40 HG1 ARG 40 -16.090 10.907 2.691
313 HD2 ARG 40 HD2 ARG 40 -17.029 12.823 3.652
314 HD3 ARG 40 HD1 ARG 40 -15.441 13.520 4.017
315 HE ARG 40 HE ARG 40 -15.637 13.062 1.258
316 HH11 ARG 40 HH11 ARG 40 -17.088 15.232 3.627
317 HH12 ARG 40 HH12 ARG 40 -17.144 16.554 2.568
318 HH21 ARG 40 HH21 ARG 40 -15.699 14.785 -0.152
319 HH22 ARG 40 HH22 ARG 40 -16.331 16.305 0.312
320 H ALA 41 HN ALA 41 -12.130 11.169 4.613
321 HA ALA 41 HA ALA 41 -11.604 11.835 1.932
322 HB1 ALA 41 HB1 ALA 41 -9.694 11.926 4.268
323 HB2 ALA 41 HB2 ALA 41 -10.834 13.196 3.831
324 HB3 ALA 41 HB3 ALA 41 -9.516 12.786 2.740
325 H ALA 42 HN ALA 42 -10.415 9.261 3.943
326 HA ALA 42 HA ALA 42 -8.374 8.482 2.136
327 HB1 ALA 42 HB1 ALA 42 -8.187 6.464 3.391
328 HB2 ALA 42 HB2 ALA 42 -9.715 6.769 4.232
329 HB3 ALA 42 HB3 ALA 42 -8.316 7.819 4.512
330 H ALA 43 HN ALA 43 -11.678 7.335 2.721
331 HA ALA 43 HA ALA 43 -11.659 5.315 0.719
332 HB1 ALA 43 HB1 ALA 43 -14.074 5.280 0.967
333 HB2 ALA 43 HB2 ALA 43 -14.020 6.813 1.834
334 HB3 ALA 43 HB3 ALA 43 -13.301 5.367 2.550
335 H GLU 44 HN GLU 44 -12.538 8.677 0.709
336 HA GLU 44 HA GLU 44 -13.634 8.824 -1.876
337 HB2 GLU 44 HB2 GLU 44 -13.939 10.505 -0.060
338 HB3 GLU 44 HB1 GLU 44 -12.250 10.940 -0.204
339 HG2 GLU 44 HG2 GLU 44 -12.592 11.855 -2.346
340 HG3 GLU 44 HG1 GLU 44 -14.259 11.258 -2.419
341 H PHE 45 HN PHE 45 -10.402 9.110 -0.588
342 HA PHE 45 HA PHE 45 -9.076 9.847 -2.967
343 HB2 PHE 45 HB2 PHE 45 -8.169 10.299 -0.764
344 HB3 PHE 45 HB1 PHE 45 -8.122 8.586 -0.400
345 HD1 PHE 45 HD1 PHE 45 -6.756 11.102 -2.757
346 HD2 PHE 45 HD2 PHE 45 -6.158 7.412 -0.709
347 HE1 PHE 45 HE1 PHE 45 -4.424 11.055 -3.532
348 HE2 PHE 45 HE2 PHE 45 -3.824 7.374 -1.484
349 HZ PHE 45 HZ PHE 45 -2.961 9.190 -2.892
350 H VAL 46 HN VAL 46 -9.090 6.752 -1.191
351 HA VAL 46 HA VAL 46 -7.696 5.316 -3.140
352 HB VAL 46 HB VAL 46 -7.704 4.451 -0.889
353 HG11 VAL 46 HG11 VAL 46 -10.643 4.119 -1.246
354 HG12 VAL 46 HG12 VAL 46 -9.767 5.187 -0.103
355 HG13 VAL 46 HG13 VAL 46 -9.663 3.423 0.047
356 HG21 VAL 46 HG21 VAL 46 -8.103 2.174 -1.190
357 HG22 VAL 46 HG22 VAL 46 -7.697 2.818 -2.814
358 HG23 VAL 46 HG23 VAL 46 -9.373 2.506 -2.361
359 H GLY 47 HN GLY 47 -11.154 5.807 -2.831
360 HA2 GLY 47 HA2 GLY 47 -11.904 3.829 -4.722
361 HA3 GLY 47 HA1 GLY 47 -12.893 5.181 -4.205
362 H SER 48 HN SER 48 -10.726 7.078 -5.064
363 HA SER 48 HA SER 48 -11.642 7.324 -7.774
364 HB2 SER 48 HB2 SER 48 -9.769 9.034 -6.134
365 HB3 SER 48 HB1 SER 48 -10.465 9.488 -7.689
366 HG SER 48 HG SER 48 -11.602 9.395 -5.168
367 H VAL 49 HN VAL 49 -8.776 6.321 -6.092
368 HA VAL 49 HA VAL 49 -7.179 6.312 -8.550
369 HB VAL 49 HB VAL 49 -5.240 5.857 -7.074
370 HG11 VAL 49 HG11 VAL 49 -5.218 7.984 -5.895
371 HG12 VAL 49 HG12 VAL 49 -6.960 8.128 -6.151
372 HG13 VAL 49 HG13 VAL 49 -5.860 8.158 -7.536
373 HG21 VAL 49 HG21 VAL 49 -5.476 5.871 -4.662
374 HG22 VAL 49 HG22 VAL 49 -6.512 4.593 -5.341
375 HG23 VAL 49 HG23 VAL 49 -7.206 6.130 -4.836
376 H ASN 50 HN ASN 50 -9.341 4.366 -7.556
377 HA ASN 50 HA ASN 50 -7.932 1.866 -7.278
378 HB2 ASN 50 HB2 ASN 50 -10.592 2.791 -6.790
379 HB3 ASN 50 HB1 ASN 50 -10.687 1.441 -7.916
380 HD21 ASN 50 HD21 ASN 50 -8.318 1.944 -5.394
381 HD22 ASN 50 HD22 ASN 50 -8.758 0.530 -4.503
382 H GLY 51 HN GLY 51 -8.783 -0.004 -8.715
383 HA2 GLY 51 HA2 GLY 51 -8.307 0.761 -11.480
384 HA3 GLY 51 HA1 GLY 51 -8.344 -0.882 -10.838
385 H GLY 52 HN GLY 52 -10.484 1.891 -11.176
386 HA2 GLY 52 HA2 GLY 52 -12.491 1.639 -12.558
387 HA3 GLY 52 HA1 GLY 52 -12.658 0.034 -11.843
388 H ASN 53 HN ASN 53 -14.143 -0.050 -10.338
389 HA ASN 53 HA ASN 53 -14.658 2.335 -8.748
390 HB2 ASN 53 HB2 ASN 53 -16.642 1.216 -7.886
391 HB3 ASN 53 HB1 ASN 53 -16.649 1.102 -9.641
392 HD21 ASN 53 HD21 ASN 53 -16.537 -0.649 -6.643
393 HD22 ASN 53 HD22 ASN 53 -16.631 -2.216 -7.340
394 H ARG 54 HN ARG 54 -14.881 2.061 -6.446
395 HA ARG 54 HA ARG 54 -12.656 1.066 -5.160
396 HB2 ARG 54 HB2 ARG 54 -14.023 1.361 -3.056
397 HB3 ARG 54 HB1 ARG 54 -13.999 2.762 -4.120
398 HG2 ARG 54 HG2 ARG 54 -16.215 1.921 -5.036
399 HG3 ARG 54 HG1 ARG 54 -16.237 0.804 -3.677
400 HD2 ARG 54 HD2 ARG 54 -16.043 3.799 -3.473
401 HD3 ARG 54 HD1 ARG 54 -17.522 2.867 -3.299
402 HE ARG 54 HE ARG 54 -15.938 1.768 -1.426
403 HH11 ARG 54 HH11 ARG 54 -16.777 5.159 -2.110
404 HH12 ARG 54 HH12 ARG 54 -16.714 5.671 -0.501
405 HH21 ARG 54 HH21 ARG 54 -15.857 2.492 0.857
406 HH22 ARG 54 HH22 ARG 54 -16.182 4.122 1.221
407 H THR 55 HN THR 55 -12.005 -0.901 -5.141
408 HA THR 55 HA THR 55 -13.552 -3.007 -3.978
409 HB THR 55 HB THR 55 -14.468 -3.141 -6.246
410 HG1 THR 55 HG1 THR 55 -13.013 -5.160 -5.111
411 HG21 THR 55 HG21 THR 55 -12.633 -2.117 -7.488
412 HG22 THR 55 HG22 THR 55 -12.992 -3.705 -8.187
413 HG23 THR 55 HG23 THR 55 -11.593 -3.482 -7.129
414 H VAL 56 HN VAL 56 -10.573 -1.795 -5.314
415 HA VAL 56 HA VAL 56 -9.205 -4.105 -4.179
416 HB VAL 56 HB VAL 56 -7.265 -3.450 -5.690
417 HG11 VAL 56 HG11 VAL 56 -9.821 -4.395 -6.998
418 HG12 VAL 56 HG12 VAL 56 -8.626 -5.405 -6.179
419 HG13 VAL 56 HG13 VAL 56 -8.204 -4.577 -7.677
420 HG21 VAL 56 HG21 VAL 56 -7.990 -1.222 -6.294
421 HG22 VAL 56 HG22 VAL 56 -9.418 -1.889 -7.086
422 HG23 VAL 56 HG23 VAL 56 -7.810 -2.226 -7.738
423 HA PRO 57 HA PRO 57 -7.232 -1.406 -1.353
424 HB2 PRO 57 HB2 PRO 57 -4.858 -2.698 -0.975
425 HB3 PRO 57 HB1 PRO 57 -6.378 -3.286 -0.294
426 HG2 PRO 57 HG2 PRO 57 -4.944 -4.182 -2.753
427 HG3 PRO 57 HG1 PRO 57 -5.766 -5.152 -1.511
428 HD2 PRO 57 HD2 PRO 57 -6.857 -4.534 -3.918
429 HD3 PRO 57 HD1 PRO 57 -7.835 -4.789 -2.448
430 H THR 58 HN THR 58 -5.709 0.217 -1.318
431 HA THR 58 HA THR 58 -3.880 0.411 -3.602
432 HB THR 58 HB THR 58 -5.523 2.693 -2.514
433 HG1 THR 58 HG1 THR 58 -6.291 0.715 -4.049
434 HG21 THR 58 HG21 THR 58 -3.384 3.308 -3.614
435 HG22 THR 58 HG22 THR 58 -4.800 3.878 -4.490
436 HG23 THR 58 HG23 THR 58 -3.927 2.465 -5.080
437 H VAL 59 HN VAL 59 -1.990 1.152 -3.151
438 HA VAL 59 HA VAL 59 -1.521 1.613 -0.337
439 HB VAL 59 HB VAL 59 -0.442 -0.361 -1.255
440 HG11 VAL 59 HG11 VAL 59 0.953 1.525 -3.110
441 HG12 VAL 59 HG12 VAL 59 -0.205 0.258 -3.548
442 HG13 VAL 59 HG13 VAL 59 1.375 -0.175 -2.878
443 HG21 VAL 59 HG21 VAL 59 1.833 0.147 -0.661
444 HG22 VAL 59 HG22 VAL 59 0.608 0.711 0.505
445 HG23 VAL 59 HG23 VAL 59 1.399 1.869 -0.592
446 H LYS 60 HN LYS 60 -0.789 3.469 0.308
447 HA LYS 60 HA LYS 60 -0.082 5.511 -1.680
448 HB2 LYS 60 HB2 LYS 60 -2.227 5.604 -0.259
449 HB3 LYS 60 HB1 LYS 60 -1.181 5.899 1.099
450 HG2 LYS 60 HG2 LYS 60 -1.222 7.690 -1.327
451 HG3 LYS 60 HG1 LYS 60 -2.285 7.941 0.045
452 HD2 LYS 60 HD2 LYS 60 0.719 7.919 0.141
453 HD3 LYS 60 HD1 LYS 60 -0.315 9.354 0.053
454 HE2 LYS 60 HE2 LYS 60 -0.343 7.329 2.308
455 HE3 LYS 60 HE1 LYS 60 0.486 8.876 2.352
456 HZ1 LYS 60 HZ1 LYS 60 -1.685 9.966 2.039
457 HZ2 LYS 60 HZ2 LYS 60 -1.581 9.098 3.459
458 HZ3 LYS 60 HZ3 LYS 60 -2.484 8.480 2.185
459 H PHE 61 HN PHE 61 2.050 5.784 -1.605
460 HA PHE 61 HA PHE 61 3.552 4.899 0.688
461 HB2 PHE 61 HB2 PHE 61 4.441 6.079 -1.929
462 HB3 PHE 61 HB1 PHE 61 5.541 5.574 -0.654
463 HD1 PHE 61 HD1 PHE 61 2.916 4.354 -2.951
464 HD2 PHE 61 HD2 PHE 61 6.218 3.328 -0.471
465 HE1 PHE 61 HE1 PHE 61 2.938 2.115 -3.897
466 HE2 PHE 61 HE2 PHE 61 6.249 1.099 -1.429
467 HZ PHE 61 HZ PHE 61 4.634 0.480 -3.139
468 H ALA 62 HN ALA 62 5.442 6.321 1.389
469 HA ALA 62 HA ALA 62 4.419 8.604 2.647
470 HB1 ALA 62 HB1 ALA 62 7.304 7.832 2.259
471 HB2 ALA 62 HB2 ALA 62 6.255 7.256 3.555
472 HB3 ALA 62 HB3 ALA 62 6.676 8.968 3.452
473 H ASP 63 HN ASP 63 5.683 8.245 -0.513
474 HA ASP 63 HA ASP 63 6.508 11.016 -0.734
475 HB2 ASP 63 HB2 ASP 63 7.192 10.524 -2.967
476 HB3 ASP 63 HB1 ASP 63 7.630 9.117 -2.014
477 H GLY 64 HN GLY 64 3.621 9.284 -0.906
478 HA2 GLY 64 HA2 GLY 64 1.578 10.524 -0.983
479 HA3 GLY 64 HA1 GLY 64 2.336 11.626 -2.118
480 H SER 65 HN SER 65 3.404 9.030 -3.474
481 HA SER 65 HA SER 65 1.226 8.997 -5.341
482 HB2 SER 65 HB2 SER 65 3.813 7.465 -5.400
483 HB3 SER 65 HB1 SER 65 2.684 7.669 -6.744
484 HG SER 65 HG SER 65 4.447 9.444 -5.548
485 H THR 66 HN THR 66 0.068 7.218 -6.040
486 HA THR 66 HA THR 66 -0.142 5.052 -4.105
487 HB THR 66 HB THR 66 -2.486 4.935 -5.181
488 HG1 THR 66 HG1 THR 66 -2.283 6.419 -6.806
489 HG21 THR 66 HG21 THR 66 -1.693 7.192 -3.359
490 HG22 THR 66 HG22 THR 66 -2.068 5.531 -2.877
491 HG23 THR 66 HG23 THR 66 -3.328 6.559 -3.565
492 H LEU 67 HN LEU 67 -0.213 3.020 -4.848
493 HA LEU 67 HA LEU 67 -0.349 2.623 -7.744
494 HB2 LEU 67 HB2 LEU 67 1.261 0.886 -5.806
495 HB3 LEU 67 HB1 LEU 67 1.063 0.594 -7.507
496 HG LEU 67 HG LEU 67 2.589 2.909 -6.294
497 HD11 LEU 67 HD11 LEU 67 4.575 1.805 -7.133
498 HD12 LEU 67 HD12 LEU 67 3.598 0.524 -7.835
499 HD13 LEU 67 HD13 LEU 67 3.707 0.671 -6.089
500 HD21 LEU 67 HD21 LEU 67 2.238 2.102 -9.183
501 HD22 LEU 67 HD22 LEU 67 3.315 3.363 -8.588
502 HD23 LEU 67 HD23 LEU 67 1.568 3.545 -8.416
503 H THR 68 HN THR 68 -1.985 1.349 -8.347
504 HA THR 68 HA THR 68 -3.885 0.433 -6.438
505 HB THR 68 HB THR 68 -3.647 -0.183 -9.410
506 HG1 THR 68 HG1 THR 68 -5.191 1.928 -8.275
507 HG21 THR 68 HG21 THR 68 -6.053 -0.044 -7.574
508 HG22 THR 68 HG22 THR 68 -5.323 -1.528 -8.179
509 HG23 THR 68 HG23 THR 68 -6.092 -0.406 -9.301
510 H ASN 69 HN ASN 69 -4.282 -1.757 -5.812
511 HA ASN 69 HA ASN 69 -2.760 -3.317 -4.657
512 HB2 ASN 69 HB2 ASN 69 -4.990 -4.107 -5.184
513 HB3 ASN 69 HB1 ASN 69 -4.439 -4.701 -6.758
514 HD21 ASN 69 HD21 ASN 69 -4.803 -6.896 -6.388
515 HD22 ASN 69 HD22 ASN 69 -3.929 -7.776 -5.197
516 HA PRO 70 HA PRO 70 0.715 -4.421 -7.356
517 HB2 PRO 70 HB2 PRO 70 2.498 -3.487 -5.445
518 HB3 PRO 70 HB1 PRO 70 1.960 -2.593 -6.865
519 HG2 PRO 70 HG2 PRO 70 1.437 -1.937 -4.176
520 HG3 PRO 70 HG1 PRO 70 0.691 -1.214 -5.604
521 HD2 PRO 70 HD2 PRO 70 -0.384 -3.339 -3.792
522 HD3 PRO 70 HD1 PRO 70 -1.216 -2.072 -4.723
523 H SER 71 HN SER 71 2.834 -5.478 -6.463
524 HA SER 71 HA SER 71 2.028 -7.371 -4.431
525 HB2 SER 71 HB2 SER 71 3.812 -7.816 -6.837
526 HB3 SER 71 HB1 SER 71 3.359 -9.049 -5.645
527 HG SER 71 HG SER 71 1.218 -7.749 -6.551
528 H ALA 72 HN ALA 72 4.306 -8.412 -3.583
529 HA ALA 72 HA ALA 72 5.262 -6.343 -1.942
530 HB1 ALA 72 HB1 ALA 72 5.119 -8.650 -1.251
531 HB2 ALA 72 HB2 ALA 72 6.727 -7.976 -0.992
532 HB3 ALA 72 HB3 ALA 72 6.437 -9.071 -2.346
533 H ASP 73 HN ASP 73 6.829 -7.860 -4.755
534 HA ASP 73 HA ASP 73 9.302 -6.548 -4.223
535 HB2 ASP 73 HB2 ASP 73 9.076 -8.594 -5.668
536 HB3 ASP 73 HB1 ASP 73 8.344 -7.559 -6.893
537 H GLU 74 HN GLU 74 6.518 -5.763 -6.166
538 HA GLU 74 HA GLU 74 7.487 -3.496 -7.503
539 HB2 GLU 74 HB2 GLU 74 4.686 -4.266 -6.670
540 HB3 GLU 74 HB1 GLU 74 5.038 -2.865 -7.654
541 HG2 GLU 74 HG2 GLU 74 4.251 -4.797 -8.958
542 HG3 GLU 74 HG1 GLU 74 5.859 -4.269 -9.445
543 H VAL 75 HN VAL 75 5.780 -3.809 -4.418
544 HA VAL 75 HA VAL 75 5.864 -1.006 -4.007
545 HB VAL 75 HB VAL 75 5.196 -1.550 -1.558
546 HG11 VAL 75 HG11 VAL 75 3.465 -2.718 -3.717
547 HG12 VAL 75 HG12 VAL 75 3.579 -0.993 -3.428
548 HG13 VAL 75 HG13 VAL 75 2.930 -2.057 -2.174
549 HG21 VAL 75 HG21 VAL 75 4.785 -4.227 -2.788
550 HG22 VAL 75 HG22 VAL 75 4.383 -3.757 -1.137
551 HG23 VAL 75 HG23 VAL 75 6.086 -3.884 -1.639
552 H LYS 76 HN LYS 76 7.976 -3.623 -3.034
553 HA LYS 76 HA LYS 76 9.673 -2.181 -1.307
554 HB2 LYS 76 HB2 LYS 76 10.280 -4.435 -3.216
555 HB3 LYS 76 HB1 LYS 76 11.459 -3.787 -2.082
556 HG2 LYS 76 HG2 LYS 76 10.118 -4.551 -0.221
557 HG3 LYS 76 HG1 LYS 76 8.825 -5.030 -1.317
558 HD2 LYS 76 HD2 LYS 76 10.082 -6.993 -0.655
559 HD3 LYS 76 HD1 LYS 76 10.346 -6.670 -2.366
560 HE2 LYS 76 HE2 LYS 76 12.486 -5.522 -1.721
561 HE3 LYS 76 HE1 LYS 76 12.208 -6.083 -0.074
562 HZ1 LYS 76 HZ1 LYS 76 12.229 -8.389 -0.950
563 HZ2 LYS 76 HZ2 LYS 76 13.671 -7.568 -1.240
564 HZ3 LYS 76 HZ3 LYS 76 12.560 -7.758 -2.482
565 H ALA 77 HN ALA 77 9.614 -2.539 -4.800
566 HA ALA 77 HA ALA 77 12.011 -1.292 -5.463
567 HB1 ALA 77 HB1 ALA 77 11.070 -1.057 -7.687
568 HB2 ALA 77 HB2 ALA 77 9.455 -1.363 -7.046
569 HB3 ALA 77 HB3 ALA 77 10.670 -2.637 -7.007
570 H LYS 78 HN LYS 78 8.870 0.046 -4.787
571 HA LYS 78 HA LYS 78 9.712 2.677 -5.614
572 HB2 LYS 78 HB2 LYS 78 7.285 1.639 -5.649
573 HB3 LYS 78 HB1 LYS 78 7.244 2.199 -3.981
574 HG2 LYS 78 HG2 LYS 78 7.897 4.479 -4.853
575 HG3 LYS 78 HG1 LYS 78 7.630 3.802 -6.466
576 HD2 LYS 78 HD2 LYS 78 5.320 3.273 -5.833
577 HD3 LYS 78 HD1 LYS 78 5.593 4.085 -4.289
578 HE2 LYS 78 HE2 LYS 78 5.826 5.324 -7.020
579 HE3 LYS 78 HE1 LYS 78 4.509 5.575 -5.876
580 HZ1 LYS 78 HZ1 LYS 78 6.167 7.375 -5.909
581 HZ2 LYS 78 HZ2 LYS 78 7.347 6.327 -5.377
582 HZ3 LYS 78 HZ3 LYS 78 6.040 6.709 -4.381
583 H LEU 79 HN LEU 79 8.907 0.989 -2.612
584 HA LEU 79 HA LEU 79 9.233 2.992 -0.743
585 HB2 LEU 79 HB2 LEU 79 8.203 0.910 -0.197
586 HB3 LEU 79 HB1 LEU 79 9.663 0.024 -0.567
587 HG LEU 79 HG LEU 79 10.758 1.066 1.367
588 HD11 LEU 79 HD11 LEU 79 9.485 3.122 1.533
589 HD12 LEU 79 HD12 LEU 79 9.396 2.236 3.053
590 HD13 LEU 79 HD13 LEU 79 8.028 2.216 1.939
591 HD21 LEU 79 HD21 LEU 79 9.539 -0.212 3.084
592 HD22 LEU 79 HD22 LEU 79 9.770 -1.118 1.593
593 HD23 LEU 79 HD23 LEU 79 8.198 -0.410 1.954
594 H VAL 80 HN VAL 80 11.682 0.799 -2.064
595 HA VAL 80 HA VAL 80 13.722 1.437 -0.290
596 HB VAL 80 HB VAL 80 13.783 -0.517 -1.797
597 HG11 VAL 80 HG11 VAL 80 14.403 1.446 -3.982
598 HG12 VAL 80 HG12 VAL 80 12.959 0.444 -3.838
599 HG13 VAL 80 HG13 VAL 80 14.532 -0.308 -4.104
600 HG21 VAL 80 HG21 VAL 80 16.168 1.298 -2.063
601 HG22 VAL 80 HG22 VAL 80 16.167 -0.447 -2.341
602 HG23 VAL 80 HG23 VAL 80 15.818 0.192 -0.735
603 H LYS 81 HN LYS 81 12.615 3.140 -3.107
604 HA LYS 81 HA LYS 81 14.954 4.807 -3.295
605 HB2 LYS 81 HB2 LYS 81 12.272 5.131 -4.651
606 HB3 LYS 81 HB1 LYS 81 13.752 5.971 -5.074
607 HG2 LYS 81 HG2 LYS 81 14.758 3.735 -5.625
608 HG3 LYS 81 HG1 LYS 81 13.154 3.033 -5.391
609 HD2 LYS 81 HD2 LYS 81 12.259 4.518 -7.130
610 HD3 LYS 81 HD1 LYS 81 13.863 5.204 -7.366
611 HE2 LYS 81 HE2 LYS 81 13.640 3.624 -9.088
612 HE3 LYS 81 HE1 LYS 81 14.623 2.822 -7.872
613 HZ1 LYS 81 HZ1 LYS 81 11.732 2.388 -8.406
614 HZ2 LYS 81 HZ2 LYS 81 12.536 1.695 -7.107
615 HZ3 LYS 81 HZ3 LYS 81 12.986 1.317 -8.683
616 H ILE 82 HN ILE 82 12.044 4.813 -1.556
617 HA ILE 82 HA ILE 82 11.921 7.681 -1.151
618 HB ILE 82 HB ILE 82 10.304 5.466 0.149
619 HG12 ILE 82 HG12 ILE 82 9.590 7.262 -2.188
620 HG13 ILE 82 HG11 ILE 82 10.057 5.571 -2.316
621 HG21 ILE 82 HG21 ILE 82 8.712 7.261 0.710
622 HG22 ILE 82 HG22 ILE 82 9.824 8.455 0.038
623 HG23 ILE 82 HG23 ILE 82 10.283 7.527 1.465
624 HD11 ILE 82 HD11 ILE 82 7.659 5.847 -2.485
625 HD12 ILE 82 HD12 ILE 82 7.624 6.636 -0.909
626 HD13 ILE 82 HD13 ILE 82 8.079 4.937 -1.033
627 H ALA 83 HN ALA 83 12.642 4.785 0.747
628 HA ALA 83 HA ALA 83 13.362 6.439 3.030
629 HB1 ALA 83 HB1 ALA 83 11.989 4.438 3.392
630 HB2 ALA 83 HB2 ALA 83 13.497 4.398 4.304
631 HB3 ALA 83 HB3 ALA 83 13.338 3.437 2.836
632 H GLY 84 HN GLY 84 14.976 4.630 0.521
633 HA2 GLY 84 HA2 GLY 84 17.192 4.521 0.004
634 HA3 GLY 84 HA1 GLY 84 17.498 5.696 1.279
635 H LEU 85 HN LEU 85 16.162 2.426 1.314
636 HA LEU 85 HA LEU 85 17.821 1.769 3.605
637 HB2 LEU 85 HB2 LEU 85 16.012 -0.142 2.070
638 HB3 LEU 85 HB1 LEU 85 16.698 -0.357 3.651
639 HG LEU 85 HG LEU 85 14.673 1.762 3.010
640 HD11 LEU 85 HD11 LEU 85 13.751 -0.451 2.668
641 HD12 LEU 85 HD12 LEU 85 13.062 0.297 4.116
642 HD13 LEU 85 HD13 LEU 85 14.302 -0.952 4.267
643 HD21 LEU 85 HD21 LEU 85 15.719 0.680 5.633
644 HD22 LEU 85 HD22 LEU 85 14.433 1.875 5.450
645 HD23 LEU 85 HD23 LEU 85 16.078 2.267 4.948
646 H GLU 86 HN GLU 86 17.279 -0.031 0.562
647 HA GLU 86 HA GLU 86 20.063 -0.791 0.651
648 HB2 GLU 86 HB2 GLU 86 18.113 -2.402 0.060
649 HB3 GLU 86 HB1 GLU 86 18.058 -1.577 -1.484
650 HG2 GLU 86 HG2 GLU 86 20.500 -2.994 -0.417
651 HG3 GLU 86 HG1 GLU 86 19.310 -3.755 -1.459
652 H HIS 87 HN HIS 87 20.816 1.238 0.418
653 HA HIS 87 HA HIS 87 21.028 2.160 -2.340
654 HB2 HIS 87 HB2 HIS 87 19.356 3.578 -0.972
655 HB3 HIS 87 HB1 HIS 87 20.729 4.043 0.022
656 HD1 HIS 87 HD1 HIS 87 18.794 5.325 -2.612
657 HD2 HIS 87 HD2 HIS 87 22.868 5.197 -1.852
658 HE1 HIS 87 HE1 HIS 87 19.821 7.105 -4.049
659 H HIS 88 HN HIS 88 23.012 1.261 -2.421
660 HA HIS 88 HA HIS 88 24.970 2.065 -0.409
661 HB2 HIS 88 HB2 HIS 88 24.864 -0.475 -2.060
662 HB3 HIS 88 HB1 HIS 88 26.166 -0.035 -0.963
663 HD1 HIS 88 HD1 HIS 88 22.617 -1.343 -0.974
664 HD2 HIS 88 HD2 HIS 88 25.622 -0.381 1.748
665 HE1 HIS 88 HE1 HIS 88 21.886 -2.277 1.241
Start of MODEL 9
1 H1 MET 1 HT1 MET 1 8.756 13.885 4.280
2 H2 MET 1 HT2 MET 1 9.925 12.815 3.733
3 H3 MET 1 HT3 MET 1 10.388 14.353 4.288
4 HA MET 1 HA MET 1 10.844 12.612 5.886
5 HB2 MET 1 HB2 MET 1 10.239 14.811 6.804
6 HB3 MET 1 HB1 MET 1 8.531 14.421 6.672
7 HG2 MET 1 HG2 MET 1 8.809 12.653 8.348
8 HG3 MET 1 HG1 MET 1 10.519 13.042 8.469
9 HE1 MET 1 HE1 MET 1 7.149 15.907 9.829
10 HE2 MET 1 HE2 MET 1 6.850 14.304 9.151
11 HE3 MET 1 HE3 MET 1 7.486 15.586 8.128
12 H VAL 2 HN VAL 2 10.293 10.632 6.557
13 HA VAL 2 HA VAL 2 7.765 9.623 5.647
14 HB VAL 2 HB VAL 2 8.533 7.389 6.451
15 HG11 VAL 2 HG11 VAL 2 10.352 7.088 4.843
16 HG12 VAL 2 HG12 VAL 2 10.558 8.835 4.759
17 HG13 VAL 2 HG13 VAL 2 9.063 8.098 4.183
18 HG21 VAL 2 HG21 VAL 2 10.809 7.062 7.263
19 HG22 VAL 2 HG22 VAL 2 9.930 8.141 8.345
20 HG23 VAL 2 HG23 VAL 2 11.099 8.798 7.201
21 H THR 3 HN THR 3 6.028 9.988 6.766
22 HA THR 3 HA THR 3 6.206 9.952 9.686
23 HB THR 3 HB THR 3 5.071 11.931 8.501
24 HG1 THR 3 HG1 THR 3 4.647 11.403 10.671
25 HG21 THR 3 HG21 THR 3 2.763 11.639 7.706
26 HG22 THR 3 HG22 THR 3 2.875 9.907 8.007
27 HG23 THR 3 HG23 THR 3 3.870 10.644 6.758
28 H ALA 4 HN ALA 4 5.273 8.241 6.969
29 HA ALA 4 HA ALA 4 4.472 5.943 8.479
30 HB1 ALA 4 HB1 ALA 4 2.318 6.944 7.813
31 HB2 ALA 4 HB2 ALA 4 2.638 5.511 6.839
32 HB3 ALA 4 HB3 ALA 4 2.898 7.114 6.156
33 H ALA 5 HN ALA 5 4.799 4.057 6.987
34 HA ALA 5 HA ALA 5 7.051 4.627 5.194
35 HB1 ALA 5 HB1 ALA 5 5.821 1.992 6.053
36 HB2 ALA 5 HB2 ALA 5 7.236 2.749 6.775
37 HB3 ALA 5 HB3 ALA 5 7.301 2.173 5.106
38 H LEU 6 HN LEU 6 4.156 2.660 5.013
39 HA LEU 6 HA LEU 6 3.322 3.930 2.617
40 HB2 LEU 6 HB2 LEU 6 3.034 1.850 1.332
41 HB3 LEU 6 HB1 LEU 6 4.717 2.204 1.603
42 HG LEU 6 HG LEU 6 3.215 0.147 3.247
43 HD11 LEU 6 HD11 LEU 6 4.212 -1.529 1.776
44 HD12 LEU 6 HD12 LEU 6 4.834 -0.229 0.742
45 HD13 LEU 6 HD13 LEU 6 3.093 -0.472 0.915
46 HD21 LEU 6 HD21 LEU 6 5.333 0.980 4.171
47 HD22 LEU 6 HD22 LEU 6 6.147 0.551 2.669
48 HD23 LEU 6 HD23 LEU 6 5.452 -0.711 3.686
49 H THR 7 HN THR 7 1.213 4.003 2.577
50 HA THR 7 HA THR 7 -0.140 2.812 4.878
51 HB THR 7 HB THR 7 -0.956 5.174 3.186
52 HG1 THR 7 HG1 THR 7 0.978 4.885 4.966
53 HG21 THR 7 HG21 THR 7 -2.801 4.103 4.426
54 HG22 THR 7 HG22 THR 7 -2.425 5.688 5.099
55 HG23 THR 7 HG23 THR 7 -1.869 4.226 5.916
56 H ILE 8 HN ILE 8 -1.381 1.190 4.485
57 HA ILE 8 HA ILE 8 -2.438 0.550 1.867
58 HB ILE 8 HB ILE 8 -2.323 -0.893 4.504
59 HG12 ILE 8 HG12 ILE 8 -1.213 -1.597 1.793
60 HG13 ILE 8 HG11 ILE 8 -0.284 -0.899 3.126
61 HG21 ILE 8 HG21 ILE 8 -3.418 -2.834 3.475
62 HG22 ILE 8 HG22 ILE 8 -3.818 -1.833 2.066
63 HG23 ILE 8 HG23 ILE 8 -4.457 -1.423 3.665
64 HD11 ILE 8 HD11 ILE 8 -1.634 -3.591 3.070
65 HD12 ILE 8 HD12 ILE 8 -0.695 -2.934 4.414
66 HD13 ILE 8 HD13 ILE 8 0.088 -3.276 2.867
67 H TYR 9 HN TYR 9 -4.428 0.902 1.252
68 HA TYR 9 HA TYR 9 -6.521 1.638 3.207
69 HB2 TYR 9 HB2 TYR 9 -6.274 2.309 0.267
70 HB3 TYR 9 HB1 TYR 9 -7.606 2.770 1.310
71 HD1 TYR 9 HD2 TYR 9 -7.199 4.366 3.139
72 HD2 TYR 9 HD1 TYR 9 -4.284 3.569 0.174
73 HE1 TYR 9 HE2 TYR 9 -6.054 6.441 3.739
74 HE2 TYR 9 HE1 TYR 9 -3.116 5.631 0.755
75 HH TYR 9 HH TYR 9 -3.955 7.485 3.547
76 H THR 10 HN THR 10 -7.712 -0.213 3.592
77 HA THR 10 HA THR 10 -9.139 -1.269 1.392
78 HB THR 10 HB THR 10 -6.930 -2.436 1.206
79 HG1 THR 10 HG1 THR 10 -8.862 -3.396 0.398
80 HG21 THR 10 HG21 THR 10 -7.786 -3.770 3.784
81 HG22 THR 10 HG22 THR 10 -6.392 -2.710 3.576
82 HG23 THR 10 HG23 THR 10 -6.427 -4.286 2.784
83 H THR 11 HN THR 11 -10.284 -3.419 2.281
84 HA THR 11 HA THR 11 -10.854 -3.430 5.054
85 HB THR 11 HB THR 11 -13.135 -2.968 3.075
86 HG1 THR 11 HG1 THR 11 -11.541 -1.272 4.467
87 HG21 THR 11 HG21 THR 11 -13.754 -4.319 5.045
88 HG22 THR 11 HG22 THR 11 -14.532 -2.736 5.080
89 HG23 THR 11 HG23 THR 11 -13.130 -3.050 6.103
90 H SER 12 HN SER 12 -11.950 -5.478 5.552
91 HA SER 12 HA SER 12 -11.025 -7.700 4.397
92 HB2 SER 12 HB2 SER 12 -13.600 -7.329 5.862
93 HB3 SER 12 HB1 SER 12 -12.691 -8.850 5.746
94 HG SER 12 HG SER 12 -11.582 -8.156 7.377
95 H TRP 13 HN TRP 13 -13.678 -5.871 3.019
96 HA TRP 13 HA TRP 13 -14.834 -8.153 1.731
97 HB2 TRP 13 HB2 TRP 13 -16.257 -6.555 0.504
98 HB3 TRP 13 HB1 TRP 13 -16.296 -6.298 2.241
99 HD1 TRP 13 HD1 TRP 13 -15.260 -4.028 3.155
100 HE1 TRP 13 HE1 TRP 13 -14.726 -1.792 2.020
101 HE3 TRP 13 HE3 TRP 13 -15.438 -5.532 -1.717
102 HZ2 TRP 13 HZ2 TRP 13 -14.425 -0.787 -0.585
103 HZ3 TRP 13 HZ3 TRP 13 -15.026 -3.866 -3.470
104 HH2 TRP 13 HH2 TRP 13 -14.533 -1.532 -2.906
105 H CYS 14 HN CYS 14 -12.178 -6.148 1.003
106 HA CYS 14 HA CYS 14 -12.286 -6.538 -1.833
107 HB2 CYS 14 HB2 CYS 14 -9.914 -5.841 -0.074
108 HB3 CYS 14 HB1 CYS 14 -9.979 -5.699 -1.823
109 HG CYS 14 HG CYS 14 -11.708 -3.646 -1.916
110 H GLY 15 HN GLY 15 -11.261 -8.178 -3.025
111 HA2 GLY 15 HA2 GLY 15 -10.841 -10.655 -1.715
112 HA3 GLY 15 HA1 GLY 15 -10.463 -10.305 -3.395
113 H TYR 16 HN TYR 16 -8.586 -8.431 -3.248
114 HA TYR 16 HA TYR 16 -6.313 -9.949 -2.528
115 HB2 TYR 16 HB2 TYR 16 -6.557 -7.192 -3.668
116 HB3 TYR 16 HB1 TYR 16 -5.006 -7.899 -3.258
117 HD1 TYR 16 HD1 TYR 16 -5.022 -10.554 -4.257
118 HD2 TYR 16 HD2 TYR 16 -6.885 -7.117 -5.943
119 HE1 TYR 16 HE1 TYR 16 -4.868 -11.563 -6.490
120 HE2 TYR 16 HE2 TYR 16 -6.762 -8.131 -8.164
121 HH TYR 16 HH TYR 16 -5.421 -9.754 -9.313
122 H CYS 17 HN CYS 17 -8.153 -8.121 -0.480
123 HA CYS 17 HA CYS 17 -6.442 -6.353 0.853
124 HB2 CYS 17 HB2 CYS 17 -7.850 -6.621 2.854
125 HB3 CYS 17 HB1 CYS 17 -8.818 -6.398 1.410
126 HG CYS 17 HG CYS 17 -10.064 -8.691 1.450
127 H LEU 18 HN LEU 18 -7.030 -9.649 1.950
128 HA LEU 18 HA LEU 18 -4.909 -9.418 3.851
129 HB2 LEU 18 HB2 LEU 18 -7.158 -10.867 3.756
130 HB3 LEU 18 HB1 LEU 18 -6.063 -12.054 3.099
131 HG LEU 18 HG LEU 18 -6.452 -12.338 5.516
132 HD11 LEU 18 HD11 LEU 18 -4.384 -13.157 4.594
133 HD12 LEU 18 HD12 LEU 18 -4.107 -12.519 6.222
134 HD13 LEU 18 HD13 LEU 18 -3.641 -11.578 4.801
135 HD21 LEU 18 HD21 LEU 18 -6.774 -9.990 6.085
136 HD22 LEU 18 HD22 LEU 18 -5.073 -9.669 5.784
137 HD23 LEU 18 HD23 LEU 18 -5.545 -10.730 7.110
138 H ARG 19 HN ARG 19 -5.261 -10.539 0.634
139 HA ARG 19 HA ARG 19 -3.058 -12.249 0.420
140 HB2 ARG 19 HB2 ARG 19 -4.861 -12.059 -1.274
141 HB3 ARG 19 HB1 ARG 19 -4.283 -10.457 -1.687
142 HG2 ARG 19 HG2 ARG 19 -3.582 -12.062 -3.344
143 HG3 ARG 19 HG1 ARG 19 -2.182 -11.424 -2.487
144 HD2 ARG 19 HD2 ARG 19 -2.074 -13.429 -1.120
145 HD3 ARG 19 HD1 ARG 19 -3.535 -14.056 -1.886
146 HE ARG 19 HE ARG 19 -1.735 -13.516 -3.897
147 HH11 ARG 19 HH11 ARG 19 -1.936 -15.765 -1.122
148 HH12 ARG 19 HH12 ARG 19 -0.917 -16.919 -1.852
149 HH21 ARG 19 HH21 ARG 19 -0.419 -15.197 -4.866
150 HH22 ARG 19 HH22 ARG 19 -0.065 -16.622 -3.971
151 H LEU 20 HN LEU 20 -3.417 -8.782 -0.089
152 HA LEU 20 HA LEU 20 -0.730 -8.242 -0.743
153 HB2 LEU 20 HB2 LEU 20 -2.507 -6.702 -1.326
154 HB3 LEU 20 HB1 LEU 20 -2.934 -6.490 0.355
155 HG LEU 20 HG LEU 20 -0.823 -5.339 0.751
156 HD11 LEU 20 HD11 LEU 20 0.586 -6.360 -0.958
157 HD12 LEU 20 HD12 LEU 20 0.575 -4.611 -1.161
158 HD13 LEU 20 HD13 LEU 20 -0.392 -5.625 -2.227
159 HD21 LEU 20 HD21 LEU 20 -2.441 -4.202 -1.520
160 HD22 LEU 20 HD22 LEU 20 -1.343 -3.283 -0.491
161 HD23 LEU 20 HD23 LEU 20 -2.782 -4.032 0.203
162 H LYS 21 HN LYS 21 -2.527 -8.248 2.293
163 HA LYS 21 HA LYS 21 -0.576 -7.182 4.024
164 HB2 LYS 21 HB2 LYS 21 -2.500 -9.396 4.647
165 HB3 LYS 21 HB1 LYS 21 -1.778 -8.395 5.860
166 HG2 LYS 21 HG2 LYS 21 -3.882 -7.694 3.790
167 HG3 LYS 21 HG1 LYS 21 -4.081 -7.747 5.536
168 HD2 LYS 21 HD2 LYS 21 -2.273 -5.750 4.184
169 HD3 LYS 21 HD1 LYS 21 -3.998 -5.471 4.332
170 HE2 LYS 21 HE2 LYS 21 -1.978 -5.726 6.589
171 HE3 LYS 21 HE1 LYS 21 -2.889 -4.338 6.055
172 HZ1 LYS 21 HZ1 LYS 21 -4.088 -6.755 7.283
173 HZ2 LYS 21 HZ2 LYS 21 -4.938 -5.423 6.712
174 HZ3 LYS 21 HZ3 LYS 21 -3.906 -5.257 8.025
175 H THR 22 HN THR 22 -1.293 -10.557 3.185
176 HA THR 22 HA THR 22 0.760 -11.763 4.626
177 HB THR 22 HB THR 22 -0.620 -12.716 2.107
178 HG1 THR 22 HG1 THR 22 -2.220 -13.142 3.343
179 HG21 THR 22 HG21 THR 22 -0.022 -14.977 2.896
180 HG22 THR 22 HG22 THR 22 0.870 -14.267 4.245
181 HG23 THR 22 HG23 THR 22 1.418 -14.007 2.588
182 H ALA 23 HN ALA 23 0.653 -10.689 1.237
183 HA ALA 23 HA ALA 23 3.108 -11.698 0.427
184 HB1 ALA 23 HB1 ALA 23 1.421 -10.807 -1.111
185 HB2 ALA 23 HB2 ALA 23 2.999 -10.073 -1.394
186 HB3 ALA 23 HB3 ALA 23 1.746 -9.178 -0.526
187 H LEU 24 HN LEU 24 2.335 -8.576 1.891
188 HA LEU 24 HA LEU 24 5.046 -7.668 1.782
189 HB2 LEU 24 HB2 LEU 24 2.804 -6.697 3.522
190 HB3 LEU 24 HB1 LEU 24 4.292 -5.835 3.247
191 HG LEU 24 HG LEU 24 2.048 -6.303 1.289
192 HD11 LEU 24 HD11 LEU 24 1.670 -4.546 2.916
193 HD12 LEU 24 HD12 LEU 24 1.935 -3.832 1.312
194 HD13 LEU 24 HD13 LEU 24 3.216 -3.819 2.513
195 HD21 LEU 24 HD21 LEU 24 4.081 -6.431 -0.023
196 HD22 LEU 24 HD22 LEU 24 4.722 -4.995 0.786
197 HD23 LEU 24 HD23 LEU 24 3.316 -4.867 -0.261
198 H THR 25 HN THR 25 3.112 -9.144 4.291
199 HA THR 25 HA THR 25 5.025 -8.913 6.328
200 HB THR 25 HB THR 25 2.838 -10.979 5.983
201 HG1 THR 25 HG1 THR 25 1.824 -9.072 5.991
202 HG21 THR 25 HG21 THR 25 4.230 -9.985 8.493
203 HG22 THR 25 HG22 THR 25 4.452 -11.576 7.770
204 HG23 THR 25 HG23 THR 25 2.888 -11.130 8.449
205 H ALA 26 HN ALA 26 4.504 -11.427 3.881
206 HA ALA 26 HA ALA 26 6.386 -13.279 4.907
207 HB1 ALA 26 HB1 ALA 26 6.186 -14.398 2.753
208 HB2 ALA 26 HB2 ALA 26 5.384 -12.980 2.079
209 HB3 ALA 26 HB3 ALA 26 4.596 -13.917 3.350
210 H ASN 27 HN ASN 27 6.689 -10.502 2.853
211 HA ASN 27 HA ASN 27 9.490 -11.160 2.252
212 HB2 ASN 27 HB2 ASN 27 7.591 -9.164 1.011
213 HB3 ASN 27 HB1 ASN 27 9.318 -9.174 0.664
214 HD21 ASN 27 HD21 ASN 27 6.309 -10.862 0.267
215 HD22 ASN 27 HD22 ASN 27 6.841 -11.978 -0.926
216 H ARG 28 HN ARG 28 8.365 -10.223 4.794
217 HA ARG 28 HA ARG 28 8.556 -8.717 6.399
218 HB2 ARG 28 HB2 ARG 28 10.895 -8.164 7.109
219 HB3 ARG 28 HB1 ARG 28 10.557 -9.868 6.887
220 HG2 ARG 28 HG2 ARG 28 11.745 -9.920 4.858
221 HG3 ARG 28 HG1 ARG 28 11.866 -8.161 4.819
222 HD2 ARG 28 HD2 ARG 28 13.992 -9.262 5.546
223 HD3 ARG 28 HD1 ARG 28 13.325 -8.164 6.747
224 HE ARG 28 HE ARG 28 12.352 -10.724 7.251
225 HH11 ARG 28 HH11 ARG 28 15.487 -9.041 7.339
226 HH12 ARG 28 HH12 ARG 28 16.047 -9.926 8.677
227 HH21 ARG 28 HH21 ARG 28 13.183 -11.926 9.084
228 HH22 ARG 28 HH22 ARG 28 14.756 -11.603 9.651
229 H ILE 29 HN ILE 29 7.325 -7.291 4.984
230 HA ILE 29 HA ILE 29 8.786 -4.783 4.695
231 HB ILE 29 HB ILE 29 6.213 -5.668 3.375
232 HG12 ILE 29 HG12 ILE 29 8.870 -5.126 2.026
233 HG13 ILE 29 HG11 ILE 29 8.423 -6.737 2.594
234 HG21 ILE 29 HG21 ILE 29 6.388 -3.536 2.121
235 HG22 ILE 29 HG22 ILE 29 7.866 -3.159 3.021
236 HG23 ILE 29 HG23 ILE 29 6.343 -3.241 3.870
237 HD11 ILE 29 HD11 ILE 29 7.053 -5.063 0.504
238 HD12 ILE 29 HD12 ILE 29 6.520 -6.655 1.068
239 HD13 ILE 29 HD13 ILE 29 8.067 -6.491 0.257
240 H ALA 30 HN ALA 30 8.400 -3.436 6.223
241 HA ALA 30 HA ALA 30 6.248 -3.667 8.102
242 HB1 ALA 30 HB1 ALA 30 7.275 -1.625 9.020
243 HB2 ALA 30 HB2 ALA 30 8.318 -1.589 7.585
244 HB3 ALA 30 HB3 ALA 30 8.469 -2.915 8.744
245 H TYR 31 HN TYR 31 4.304 -2.651 7.892
246 HA TYR 31 HA TYR 31 4.147 -0.323 6.136
247 HB2 TYR 31 HB2 TYR 31 2.147 -1.212 5.001
248 HB3 TYR 31 HB1 TYR 31 3.594 -2.142 4.647
249 HD1 TYR 31 HD1 TYR 31 0.442 -2.136 6.568
250 HD2 TYR 31 HD2 TYR 31 3.711 -4.447 5.173
251 HE1 TYR 31 HE1 TYR 31 -0.750 -4.177 7.202
252 HE2 TYR 31 HE2 TYR 31 2.526 -6.513 5.802
253 HH TYR 31 HH TYR 31 0.743 -7.184 7.396
254 H ASP 32 HN ASP 32 2.030 0.642 6.127
255 HA ASP 32 HA ASP 32 0.889 0.676 8.818
256 HB2 ASP 32 HB2 ASP 32 1.492 2.858 6.840
257 HB3 ASP 32 HB1 ASP 32 0.411 3.122 8.219
258 H GLU 33 HN GLU 33 -1.344 0.650 8.825
259 HA GLU 33 HA GLU 33 -2.679 0.836 6.253
260 HB2 GLU 33 HB2 GLU 33 -4.230 -1.043 7.126
261 HB3 GLU 33 HB1 GLU 33 -2.692 -1.487 6.413
262 HG2 GLU 33 HG2 GLU 33 -3.074 -2.864 8.313
263 HG3 GLU 33 HG1 GLU 33 -1.786 -1.743 8.710
264 H VAL 34 HN VAL 34 -4.741 1.680 6.303
265 HA VAL 34 HA VAL 34 -5.750 2.442 8.908
266 HB VAL 34 HB VAL 34 -4.429 4.390 8.050
267 HG11 VAL 34 HG11 VAL 34 -6.404 4.445 5.802
268 HG12 VAL 34 HG12 VAL 34 -4.674 4.091 5.691
269 HG13 VAL 34 HG13 VAL 34 -5.221 5.698 6.164
270 HG21 VAL 34 HG21 VAL 34 -6.267 4.869 9.540
271 HG22 VAL 34 HG22 VAL 34 -7.395 4.845 8.183
272 HG23 VAL 34 HG23 VAL 34 -6.181 6.113 8.284
273 H ASP 35 HN ASP 35 -8.007 2.679 8.920
274 HA ASP 35 HA ASP 35 -9.269 1.021 6.967
275 HB2 ASP 35 HB2 ASP 35 -10.004 0.835 9.201
276 HB3 ASP 35 HB1 ASP 35 -10.289 2.566 9.331
277 H ILE 36 HN ILE 36 -10.615 1.545 5.399
278 HA ILE 36 HA ILE 36 -10.801 4.300 4.566
279 HB ILE 36 HB ILE 36 -11.790 3.431 2.481
280 HG12 ILE 36 HG12 ILE 36 -11.367 0.728 3.782
281 HG13 ILE 36 HG11 ILE 36 -12.924 1.450 3.399
282 HG21 ILE 36 HG21 ILE 36 -9.233 2.155 3.426
283 HG22 ILE 36 HG22 ILE 36 -9.406 3.704 2.585
284 HG23 ILE 36 HG23 ILE 36 -9.754 2.188 1.750
285 HD11 ILE 36 HD11 ILE 36 -12.282 -0.289 1.834
286 HD12 ILE 36 HD12 ILE 36 -10.827 0.605 1.410
287 HD13 ILE 36 HD13 ILE 36 -12.416 1.271 1.012
288 H GLU 37 HN GLU 37 -12.799 1.944 6.091
289 HA GLU 37 HA GLU 37 -15.310 2.739 5.159
290 HB2 GLU 37 HB2 GLU 37 -14.204 0.800 6.892
291 HB3 GLU 37 HB1 GLU 37 -15.474 1.637 7.772
292 HG2 GLU 37 HG2 GLU 37 -15.879 0.506 5.036
293 HG3 GLU 37 HG1 GLU 37 -16.143 -0.434 6.501
294 H HIS 38 HN HIS 38 -13.751 3.453 8.269
295 HA HIS 38 HA HIS 38 -15.778 5.520 8.658
296 HB2 HIS 38 HB2 HIS 38 -13.771 4.320 10.545
297 HB3 HIS 38 HB1 HIS 38 -14.718 5.742 10.970
298 HD1 HIS 38 HD1 HIS 38 -16.819 5.204 12.194
299 HD2 HIS 38 HD2 HIS 38 -15.598 2.069 9.762
300 HE1 HIS 38 HE1 HIS 38 -18.468 3.339 12.583
301 H ASN 39 HN ASN 39 -13.362 5.640 6.855
302 HA ASN 39 HA ASN 39 -12.532 8.334 7.662
303 HB2 ASN 39 HB2 ASN 39 -10.743 6.134 6.620
304 HB3 ASN 39 HB1 ASN 39 -10.308 7.830 6.544
305 HD21 ASN 39 HD21 ASN 39 -9.358 5.413 7.996
306 HD22 ASN 39 HD22 ASN 39 -9.187 5.929 9.646
307 H ARG 40 HN ARG 40 -13.956 9.252 6.279
308 HA ARG 40 HA ARG 40 -14.512 8.451 3.679
309 HB2 ARG 40 HB2 ARG 40 -15.952 10.056 4.753
310 HB3 ARG 40 HB1 ARG 40 -14.642 11.232 4.852
311 HG2 ARG 40 HG2 ARG 40 -14.523 11.216 2.369
312 HG3 ARG 40 HG1 ARG 40 -15.941 10.181 2.353
313 HD2 ARG 40 HD2 ARG 40 -17.299 11.890 3.263
314 HD3 ARG 40 HD1 ARG 40 -15.893 12.891 3.650
315 HE ARG 40 HE ARG 40 -15.745 12.440 0.954
316 HH11 ARG 40 HH11 ARG 40 -18.138 13.996 3.076
317 HH12 ARG 40 HH12 ARG 40 -18.652 15.066 1.864
318 HH21 ARG 40 HH21 ARG 40 -16.373 13.871 -0.592
319 HH22 ARG 40 HH22 ARG 40 -17.618 15.017 -0.305
320 H ALA 41 HN ALA 41 -12.124 10.803 4.819
321 HA ALA 41 HA ALA 41 -11.209 11.613 2.269
322 HB1 ALA 41 HB1 ALA 41 -10.737 12.862 4.332
323 HB2 ALA 41 HB2 ALA 41 -9.257 12.486 3.443
324 HB3 ALA 41 HB3 ALA 41 -9.688 11.553 4.877
325 H ALA 42 HN ALA 42 -10.589 8.754 4.055
326 HA ALA 42 HA ALA 42 -8.311 8.084 2.404
327 HB1 ALA 42 HB1 ALA 42 -9.748 6.388 4.445
328 HB2 ALA 42 HB2 ALA 42 -8.311 7.385 4.745
329 HB3 ALA 42 HB3 ALA 42 -8.226 6.028 3.620
330 H ALA 43 HN ALA 43 -11.646 6.970 2.904
331 HA ALA 43 HA ALA 43 -11.692 4.979 0.915
332 HB1 ALA 43 HB1 ALA 43 -14.119 5.132 1.049
333 HB2 ALA 43 HB2 ALA 43 -13.986 6.669 1.901
334 HB3 ALA 43 HB3 ALA 43 -13.406 5.190 2.664
335 H GLU 44 HN GLU 44 -12.544 8.365 0.806
336 HA GLU 44 HA GLU 44 -13.439 8.513 -1.842
337 HB2 GLU 44 HB2 GLU 44 -13.925 10.183 -0.142
338 HB3 GLU 44 HB1 GLU 44 -12.225 10.562 0.004
339 HG2 GLU 44 HG2 GLU 44 -12.151 11.617 -1.993
340 HG3 GLU 44 HG1 GLU 44 -13.713 10.973 -2.569
341 H PHE 45 HN PHE 45 -10.312 8.835 -0.366
342 HA PHE 45 HA PHE 45 -8.873 9.653 -2.646
343 HB2 PHE 45 HB2 PHE 45 -7.988 9.987 -0.421
344 HB3 PHE 45 HB1 PHE 45 -8.030 8.260 -0.104
345 HD1 PHE 45 HD1 PHE 45 -6.480 10.790 -2.315
346 HD2 PHE 45 HD2 PHE 45 -6.151 6.978 -0.460
347 HE1 PHE 45 HE1 PHE 45 -4.152 10.628 -3.083
348 HE2 PHE 45 HE2 PHE 45 -3.833 6.805 -1.228
349 HZ PHE 45 HZ PHE 45 -2.825 8.637 -2.540
350 H VAL 46 HN VAL 46 -9.026 6.464 -1.033
351 HA VAL 46 HA VAL 46 -7.628 5.115 -3.043
352 HB VAL 46 HB VAL 46 -7.737 4.118 -0.827
353 HG11 VAL 46 HG11 VAL 46 -9.887 4.857 -0.156
354 HG12 VAL 46 HG12 VAL 46 -9.708 3.090 -0.003
355 HG13 VAL 46 HG13 VAL 46 -10.638 3.773 -1.356
356 HG21 VAL 46 HG21 VAL 46 -9.291 2.346 -2.645
357 HG22 VAL 46 HG22 VAL 46 -8.267 1.853 -1.284
358 HG23 VAL 46 HG23 VAL 46 -7.545 2.587 -2.728
359 H GLY 47 HN GLY 47 -11.044 5.747 -2.705
360 HA2 GLY 47 HA2 GLY 47 -11.906 3.994 -4.752
361 HA3 GLY 47 HA1 GLY 47 -12.806 5.372 -4.125
362 H SER 48 HN SER 48 -10.573 7.211 -4.837
363 HA SER 48 HA SER 48 -11.439 7.631 -7.551
364 HB2 SER 48 HB2 SER 48 -9.609 9.280 -5.796
365 HB3 SER 48 HB1 SER 48 -10.256 9.770 -7.365
366 HG SER 48 HG SER 48 -11.629 9.307 -4.943
367 H VAL 49 HN VAL 49 -8.561 6.582 -5.885
368 HA VAL 49 HA VAL 49 -6.982 6.694 -8.343
369 HB VAL 49 HB VAL 49 -5.056 6.090 -6.941
370 HG11 VAL 49 HG11 VAL 49 -5.012 8.060 -5.495
371 HG12 VAL 49 HG12 VAL 49 -6.754 8.236 -5.725
372 HG13 VAL 49 HG13 VAL 49 -5.658 8.439 -7.101
373 HG21 VAL 49 HG21 VAL 49 -5.267 5.832 -4.520
374 HG22 VAL 49 HG22 VAL 49 -6.253 4.617 -5.349
375 HG23 VAL 49 HG23 VAL 49 -7.008 6.053 -4.660
376 H ASN 50 HN ASN 50 -9.179 4.713 -7.423
377 HA ASN 50 HA ASN 50 -7.748 2.200 -7.382
378 HB2 ASN 50 HB2 ASN 50 -10.257 3.053 -6.461
379 HB3 ASN 50 HB1 ASN 50 -10.593 1.887 -7.739
380 HD21 ASN 50 HD21 ASN 50 -7.884 1.948 -5.463
381 HD22 ASN 50 HD22 ASN 50 -8.310 0.439 -4.738
382 H GLY 51 HN GLY 51 -8.835 0.401 -8.801
383 HA2 GLY 51 HA2 GLY 51 -8.580 1.220 -11.558
384 HA3 GLY 51 HA1 GLY 51 -8.746 -0.416 -10.936
385 H GLY 52 HN GLY 52 -10.470 2.487 -11.758
386 HA2 GLY 52 HA2 GLY 52 -12.529 2.450 -12.930
387 HA3 GLY 52 HA1 GLY 52 -12.845 0.854 -12.251
388 H ASN 53 HN ASN 53 -13.120 0.800 -9.867
389 HA ASN 53 HA ASN 53 -14.100 3.240 -8.647
390 HB2 ASN 53 HB2 ASN 53 -16.218 2.329 -7.995
391 HB3 ASN 53 HB1 ASN 53 -16.100 2.166 -9.735
392 HD21 ASN 53 HD21 ASN 53 -17.676 0.803 -7.735
393 HD22 ASN 53 HD22 ASN 53 -17.385 -0.892 -7.952
394 H ARG 54 HN ARG 54 -14.676 2.661 -6.281
395 HA ARG 54 HA ARG 54 -12.400 1.472 -5.161
396 HB2 ARG 54 HB2 ARG 54 -13.425 1.705 -2.938
397 HB3 ARG 54 HB1 ARG 54 -13.655 3.161 -3.870
398 HG2 ARG 54 HG2 ARG 54 -15.795 1.065 -3.500
399 HG3 ARG 54 HG1 ARG 54 -15.594 2.445 -2.432
400 HD2 ARG 54 HD2 ARG 54 -16.183 2.566 -5.398
401 HD3 ARG 54 HD1 ARG 54 -17.354 2.812 -4.108
402 HE ARG 54 HE ARG 54 -15.644 4.678 -3.470
403 HH11 ARG 54 HH11 ARG 54 -16.963 3.897 -6.669
404 HH12 ARG 54 HH12 ARG 54 -16.716 5.438 -7.323
405 HH21 ARG 54 HH21 ARG 54 -15.360 6.824 -4.339
406 HH22 ARG 54 HH22 ARG 54 -15.782 7.177 -5.944
407 H THR 55 HN THR 55 -11.856 -0.499 -5.334
408 HA THR 55 HA THR 55 -13.634 -2.570 -4.395
409 HB THR 55 HB THR 55 -14.183 -2.545 -6.754
410 HG1 THR 55 HG1 THR 55 -13.779 -4.626 -5.590
411 HG21 THR 55 HG21 THR 55 -12.181 -1.504 -7.677
412 HG22 THR 55 HG22 THR 55 -12.499 -3.039 -8.495
413 HG23 THR 55 HG23 THR 55 -11.231 -2.934 -7.276
414 H VAL 56 HN VAL 56 -10.371 -1.563 -5.315
415 HA VAL 56 HA VAL 56 -9.388 -3.934 -3.923
416 HB VAL 56 HB VAL 56 -7.296 -3.679 -5.299
417 HG11 VAL 56 HG11 VAL 56 -9.853 -4.423 -6.751
418 HG12 VAL 56 HG12 VAL 56 -8.954 -5.456 -5.647
419 HG13 VAL 56 HG13 VAL 56 -8.229 -4.974 -7.175
420 HG21 VAL 56 HG21 VAL 56 -9.111 -2.012 -7.043
421 HG22 VAL 56 HG22 VAL 56 -7.517 -2.606 -7.506
422 HG23 VAL 56 HG23 VAL 56 -7.677 -1.446 -6.190
423 HA PRO 57 HA PRO 57 -7.025 -1.556 -1.046
424 HB2 PRO 57 HB2 PRO 57 -4.674 -3.042 -1.144
425 HB3 PRO 57 HB1 PRO 57 -6.059 -3.454 -0.140
426 HG2 PRO 57 HG2 PRO 57 -5.275 -4.508 -2.812
427 HG3 PRO 57 HG1 PRO 57 -5.939 -5.375 -1.417
428 HD2 PRO 57 HD2 PRO 57 -7.485 -4.772 -3.489
429 HD3 PRO 57 HD1 PRO 57 -8.104 -4.624 -1.829
430 H THR 58 HN THR 58 -5.741 0.185 -1.228
431 HA THR 58 HA THR 58 -3.830 0.279 -3.451
432 HB THR 58 HB THR 58 -5.360 2.688 -2.379
433 HG1 THR 58 HG1 THR 58 -6.293 0.746 -3.757
434 HG21 THR 58 HG21 THR 58 -4.594 3.769 -4.414
435 HG22 THR 58 HG22 THR 58 -3.801 2.295 -4.945
436 HG23 THR 58 HG23 THR 58 -3.197 3.163 -3.518
437 H VAL 59 HN VAL 59 -1.926 1.335 -2.991
438 HA VAL 59 HA VAL 59 -1.492 1.726 -0.142
439 HB VAL 59 HB VAL 59 -0.633 -0.412 -0.974
440 HG11 VAL 59 HG11 VAL 59 -0.127 0.105 -3.243
441 HG12 VAL 59 HG12 VAL 59 1.317 -0.513 -2.431
442 HG13 VAL 59 HG13 VAL 59 1.147 1.218 -2.742
443 HG21 VAL 59 HG21 VAL 59 1.446 1.554 -0.203
444 HG22 VAL 59 HG22 VAL 59 1.555 -0.228 -0.107
445 HG23 VAL 59 HG23 VAL 59 0.363 0.651 0.879
446 H LYS 60 HN LYS 60 -0.639 3.579 0.398
447 HA LYS 60 HA LYS 60 0.365 5.395 -1.713
448 HB2 LYS 60 HB2 LYS 60 -1.660 6.124 -0.384
449 HB3 LYS 60 HB1 LYS 60 -0.651 6.071 1.043
450 HG2 LYS 60 HG2 LYS 60 0.808 7.809 0.061
451 HG3 LYS 60 HG1 LYS 60 -0.272 7.896 -1.330
452 HD2 LYS 60 HD2 LYS 60 -0.821 9.695 0.182
453 HD3 LYS 60 HD1 LYS 60 -2.125 8.509 0.230
454 HE2 LYS 60 HE2 LYS 60 -1.134 7.559 2.299
455 HE3 LYS 60 HE1 LYS 60 0.113 8.803 2.218
456 HZ1 LYS 60 HZ1 LYS 60 -1.581 10.483 2.512
457 HZ2 LYS 60 HZ2 LYS 60 -1.651 9.358 3.762
458 HZ3 LYS 60 HZ3 LYS 60 -2.800 9.305 2.536
459 H PHE 61 HN PHE 61 2.441 5.964 -1.576
460 HA PHE 61 HA PHE 61 3.960 5.020 0.724
461 HB2 PHE 61 HB2 PHE 61 4.808 6.017 -1.979
462 HB3 PHE 61 HB1 PHE 61 5.934 5.613 -0.688
463 HD1 PHE 61 HD2 PHE 61 3.422 4.270 -3.006
464 HD2 PHE 61 HD1 PHE 61 6.423 3.379 -0.127
465 HE1 PHE 61 HE2 PHE 61 3.375 1.931 -3.690
466 HE2 PHE 61 HE1 PHE 61 6.385 1.024 -0.824
467 HZ PHE 61 HZ PHE 61 4.857 0.306 -2.607
468 H ALA 62 HN ALA 62 5.749 6.394 1.482
469 HA ALA 62 HA ALA 62 4.793 8.771 2.591
470 HB1 ALA 62 HB1 ALA 62 6.484 7.363 3.630
471 HB2 ALA 62 HB2 ALA 62 7.036 9.035 3.481
472 HB3 ALA 62 HB3 ALA 62 7.628 7.808 2.364
473 H ASP 63 HN ASP 63 6.254 8.265 -0.488
474 HA ASP 63 HA ASP 63 7.063 11.041 -0.705
475 HB2 ASP 63 HB2 ASP 63 7.873 10.540 -2.930
476 HB3 ASP 63 HB1 ASP 63 8.412 9.268 -1.851
477 H GLY 64 HN GLY 64 4.227 9.411 -0.858
478 HA2 GLY 64 HA2 GLY 64 2.181 10.435 -1.167
479 HA3 GLY 64 HA1 GLY 64 2.969 11.703 -2.093
480 H SER 65 HN SER 65 3.716 8.469 -3.048
481 HA SER 65 HA SER 65 1.869 8.830 -5.269
482 HB2 SER 65 HB2 SER 65 3.372 7.205 -6.484
483 HB3 SER 65 HB1 SER 65 4.124 8.744 -6.071
484 HG SER 65 HG SER 65 5.345 7.809 -4.604
485 H THR 66 HN THR 66 0.617 7.050 -6.010
486 HA THR 66 HA THR 66 0.236 4.969 -3.995
487 HB THR 66 HB THR 66 -2.018 4.811 -5.238
488 HG1 THR 66 HG1 THR 66 -2.173 7.458 -5.704
489 HG21 THR 66 HG21 THR 66 -1.870 5.461 -2.949
490 HG22 THR 66 HG22 THR 66 -3.011 6.525 -3.765
491 HG23 THR 66 HG23 THR 66 -1.376 7.101 -3.386
492 H LEU 67 HN LEU 67 -0.162 2.907 -4.742
493 HA LEU 67 HA LEU 67 -0.039 2.468 -7.627
494 HB2 LEU 67 HB2 LEU 67 1.254 0.728 -5.510
495 HB3 LEU 67 HB1 LEU 67 1.035 0.254 -7.177
496 HG LEU 67 HG LEU 67 2.872 2.402 -6.117
497 HD11 LEU 67 HD11 LEU 67 3.638 0.105 -5.743
498 HD12 LEU 67 HD12 LEU 67 4.621 0.911 -6.966
499 HD13 LEU 67 HD13 LEU 67 3.393 -0.248 -7.451
500 HD21 LEU 67 HD21 LEU 67 2.364 1.513 -8.960
501 HD22 LEU 67 HD22 LEU 67 3.660 2.583 -8.445
502 HD23 LEU 67 HD23 LEU 67 1.987 3.101 -8.287
503 H THR 68 HN THR 68 -1.798 1.480 -8.303
504 HA THR 68 HA THR 68 -3.806 0.565 -6.539
505 HB THR 68 HB THR 68 -3.456 -0.135 -9.470
506 HG1 THR 68 HG1 THR 68 -3.890 2.322 -8.212
507 HG21 THR 68 HG21 THR 68 -5.899 0.382 -7.753
508 HG22 THR 68 HG22 THR 68 -5.340 -1.204 -8.284
509 HG23 THR 68 HG23 THR 68 -5.919 -0.034 -9.467
510 H ASN 69 HN ASN 69 -4.183 -1.554 -5.851
511 HA ASN 69 HA ASN 69 -2.662 -3.127 -4.732
512 HB2 ASN 69 HB2 ASN 69 -4.874 -3.862 -4.954
513 HB3 ASN 69 HB1 ASN 69 -4.645 -4.332 -6.648
514 HD21 ASN 69 HD21 ASN 69 -3.819 -6.328 -7.069
515 HD22 ASN 69 HD22 ASN 69 -3.355 -7.476 -5.864
516 HA PRO 70 HA PRO 70 0.666 -4.605 -7.381
517 HB2 PRO 70 HB2 PRO 70 2.577 -3.530 -5.797
518 HB3 PRO 70 HB1 PRO 70 1.790 -2.640 -7.102
519 HG2 PRO 70 HG2 PRO 70 1.606 -2.139 -4.268
520 HG3 PRO 70 HG1 PRO 70 0.842 -1.257 -5.593
521 HD2 PRO 70 HD2 PRO 70 -0.290 -3.357 -3.838
522 HD3 PRO 70 HD1 PRO 70 -1.081 -2.048 -4.746
523 H SER 71 HN SER 71 2.547 -5.891 -6.796
524 HA SER 71 HA SER 71 1.964 -7.635 -4.562
525 HB2 SER 71 HB2 SER 71 3.973 -7.881 -6.797
526 HB3 SER 71 HB1 SER 71 3.465 -9.176 -5.696
527 HG SER 71 HG SER 71 2.124 -7.896 -7.782
528 H ALA 72 HN ALA 72 4.003 -8.464 -3.441
529 HA ALA 72 HA ALA 72 5.101 -6.436 -1.857
530 HB1 ALA 72 HB1 ALA 72 6.152 -9.219 -2.227
531 HB2 ALA 72 HB2 ALA 72 4.824 -8.743 -1.153
532 HB3 ALA 72 HB3 ALA 72 6.450 -8.135 -0.868
533 H ASP 73 HN ASP 73 6.711 -7.967 -4.667
534 HA ASP 73 HA ASP 73 9.059 -6.493 -3.892
535 HB2 ASP 73 HB2 ASP 73 9.345 -8.720 -4.954
536 HB3 ASP 73 HB1 ASP 73 8.670 -8.073 -6.446
537 H GLU 74 HN GLU 74 6.440 -6.036 -6.034
538 HA GLU 74 HA GLU 74 7.494 -4.005 -7.684
539 HB2 GLU 74 HB2 GLU 74 4.654 -4.334 -6.705
540 HB3 GLU 74 HB1 GLU 74 5.162 -3.347 -8.067
541 HG2 GLU 74 HG2 GLU 74 5.941 -5.366 -9.211
542 HG3 GLU 74 HG1 GLU 74 5.366 -6.337 -7.855
543 H VAL 75 HN VAL 75 5.910 -3.931 -4.558
544 HA VAL 75 HA VAL 75 6.137 -1.095 -4.373
545 HB VAL 75 HB VAL 75 5.401 -1.444 -1.936
546 HG11 VAL 75 HG11 VAL 75 3.100 -1.914 -2.594
547 HG12 VAL 75 HG12 VAL 75 3.674 -2.604 -4.107
548 HG13 VAL 75 HG13 VAL 75 3.848 -0.874 -3.818
549 HG21 VAL 75 HG21 VAL 75 6.120 -3.806 -1.786
550 HG22 VAL 75 HG22 VAL 75 4.840 -4.192 -2.966
551 HG23 VAL 75 HG23 VAL 75 4.414 -3.550 -1.391
552 H LYS 76 HN LYS 76 8.048 -3.792 -3.304
553 HA LYS 76 HA LYS 76 9.792 -2.536 -1.515
554 HB2 LYS 76 HB2 LYS 76 10.140 -4.825 -3.421
555 HB3 LYS 76 HB1 LYS 76 11.508 -4.217 -2.501
556 HG2 LYS 76 HG2 LYS 76 10.429 -4.776 -0.439
557 HG3 LYS 76 HG1 LYS 76 8.945 -5.184 -1.289
558 HD2 LYS 76 HD2 LYS 76 10.132 -7.211 -0.601
559 HD3 LYS 76 HD1 LYS 76 10.066 -7.118 -2.344
560 HE2 LYS 76 HE2 LYS 76 12.474 -6.266 -0.725
561 HE3 LYS 76 HE1 LYS 76 12.252 -7.905 -1.306
562 HZ1 LYS 76 HZ1 LYS 76 12.204 -6.921 -3.627
563 HZ2 LYS 76 HZ2 LYS 76 13.651 -6.805 -2.784
564 HZ3 LYS 76 HZ3 LYS 76 12.696 -5.446 -2.932
565 H ALA 77 HN ALA 77 9.834 -2.661 -5.025
566 HA ALA 77 HA ALA 77 12.292 -1.511 -5.553
567 HB1 ALA 77 HB1 ALA 77 11.407 -0.953 -7.740
568 HB2 ALA 77 HB2 ALA 77 9.758 -1.157 -7.148
569 HB3 ALA 77 HB3 ALA 77 10.832 -2.546 -7.249
570 H LYS 78 HN LYS 78 9.286 0.050 -4.715
571 HA LYS 78 HA LYS 78 10.378 2.684 -5.154
572 HB2 LYS 78 HB2 LYS 78 7.748 1.745 -4.059
573 HB3 LYS 78 HB1 LYS 78 8.206 3.445 -4.093
574 HG2 LYS 78 HG2 LYS 78 8.360 3.422 -6.483
575 HG3 LYS 78 HG1 LYS 78 8.142 1.674 -6.519
576 HD2 LYS 78 HD2 LYS 78 6.074 2.742 -7.135
577 HD3 LYS 78 HD1 LYS 78 5.922 1.961 -5.557
578 HE2 LYS 78 HE2 LYS 78 4.800 4.109 -5.557
579 HE3 LYS 78 HE1 LYS 78 6.192 4.148 -4.471
580 HZ1 LYS 78 HZ1 LYS 78 7.406 5.383 -6.140
581 HZ2 LYS 78 HZ2 LYS 78 5.940 6.136 -5.811
582 HZ3 LYS 78 HZ3 LYS 78 6.119 5.261 -7.229
583 H LEU 79 HN LEU 79 9.341 0.751 -2.405
584 HA LEU 79 HA LEU 79 9.737 2.593 -0.368
585 HB2 LEU 79 HB2 LEU 79 8.438 0.549 -0.141
586 HB3 LEU 79 HB1 LEU 79 9.893 -0.411 -0.274
587 HG LEU 79 HG LEU 79 10.692 0.505 1.855
588 HD11 LEU 79 HD11 LEU 79 9.573 2.675 1.821
589 HD12 LEU 79 HD12 LEU 79 9.164 1.791 3.289
590 HD13 LEU 79 HD13 LEU 79 8.004 1.883 1.964
591 HD21 LEU 79 HD21 LEU 79 7.928 -0.688 1.971
592 HD22 LEU 79 HD22 LEU 79 9.094 -0.658 3.293
593 HD23 LEU 79 HD23 LEU 79 9.446 -1.572 1.828
594 H VAL 80 HN VAL 80 12.062 0.343 -1.801
595 HA VAL 80 HA VAL 80 14.071 0.668 0.167
596 HB VAL 80 HB VAL 80 13.948 -1.200 -1.507
597 HG11 VAL 80 HG11 VAL 80 15.005 -0.958 -3.697
598 HG12 VAL 80 HG12 VAL 80 15.082 0.788 -3.448
599 HG13 VAL 80 HG13 VAL 80 13.519 -0.023 -3.536
600 HG21 VAL 80 HG21 VAL 80 16.408 -1.431 -1.795
601 HG22 VAL 80 HG22 VAL 80 15.899 -0.997 -0.170
602 HG23 VAL 80 HG23 VAL 80 16.589 0.232 -1.227
603 H LYS 81 HN LYS 81 13.236 2.572 -2.631
604 HA LYS 81 HA LYS 81 15.651 4.143 -2.525
605 HB2 LYS 81 HB2 LYS 81 13.092 4.578 -4.072
606 HB3 LYS 81 HB1 LYS 81 14.542 5.548 -4.242
607 HG2 LYS 81 HG2 LYS 81 15.754 3.549 -5.022
608 HG3 LYS 81 HG1 LYS 81 14.253 2.627 -4.909
609 HD2 LYS 81 HD2 LYS 81 13.203 4.192 -6.518
610 HD3 LYS 81 HD1 LYS 81 14.728 5.052 -6.637
611 HE2 LYS 81 HE2 LYS 81 14.333 2.154 -7.353
612 HE3 LYS 81 HE1 LYS 81 14.350 3.476 -8.512
613 HZ1 LYS 81 HZ1 LYS 81 16.486 2.483 -8.474
614 HZ2 LYS 81 HZ2 LYS 81 16.562 2.472 -6.826
615 HZ3 LYS 81 HZ3 LYS 81 16.679 3.951 -7.661
616 H ILE 82 HN ILE 82 12.259 4.536 -1.669
617 HA ILE 82 HA ILE 82 12.224 7.214 -0.860
618 HB ILE 82 HB ILE 82 10.656 4.945 0.390
619 HG12 ILE 82 HG12 ILE 82 9.869 6.764 -1.888
620 HG13 ILE 82 HG11 ILE 82 10.415 5.100 -2.078
621 HG21 ILE 82 HG21 ILE 82 9.009 6.686 0.970
622 HG22 ILE 82 HG22 ILE 82 10.094 7.919 0.324
623 HG23 ILE 82 HG23 ILE 82 10.571 6.979 1.739
624 HD11 ILE 82 HD11 ILE 82 7.983 6.000 -0.582
625 HD12 ILE 82 HD12 ILE 82 8.513 4.329 -0.769
626 HD13 ILE 82 HD13 ILE 82 7.995 5.255 -2.178
627 H ALA 83 HN ALA 83 12.677 4.320 1.135
628 HA ALA 83 HA ALA 83 13.201 5.769 3.509
629 HB1 ALA 83 HB1 ALA 83 13.839 2.913 2.803
630 HB2 ALA 83 HB2 ALA 83 12.358 3.498 3.583
631 HB3 ALA 83 HB3 ALA 83 13.901 3.602 4.424
632 H GLY 84 HN GLY 84 15.168 4.524 0.923
633 HA2 GLY 84 HA2 GLY 84 17.280 5.205 0.330
634 HA3 GLY 84 HA1 GLY 84 17.379 6.126 1.829
635 H LEU 85 HN LEU 85 16.472 2.804 1.755
636 HA LEU 85 HA LEU 85 18.782 2.113 3.392
637 HB2 LEU 85 HB2 LEU 85 16.546 0.350 2.391
638 HB3 LEU 85 HB1 LEU 85 17.693 -0.020 3.660
639 HG LEU 85 HG LEU 85 15.530 2.064 3.805
640 HD11 LEU 85 HD11 LEU 85 14.697 -0.211 3.683
641 HD12 LEU 85 HD12 LEU 85 14.414 0.484 5.284
642 HD13 LEU 85 HD13 LEU 85 15.724 -0.678 5.037
643 HD21 LEU 85 HD21 LEU 85 16.095 2.115 6.201
644 HD22 LEU 85 HD22 LEU 85 17.454 2.621 5.199
645 HD23 LEU 85 HD23 LEU 85 17.434 1.004 5.901
646 H GLU 86 HN GLU 86 20.574 1.341 2.423
647 HA GLU 86 HA GLU 86 21.998 0.506 0.898
648 HB2 GLU 86 HB2 GLU 86 19.540 -0.943 -0.098
649 HB3 GLU 86 HB1 GLU 86 21.188 -1.330 -0.587
650 HG2 GLU 86 HG2 GLU 86 21.723 -1.951 1.702
651 HG3 GLU 86 HG1 GLU 86 20.090 -1.519 2.210
652 H HIS 87 HN HIS 87 21.907 0.053 -1.790
653 HA HIS 87 HA HIS 87 20.609 2.411 -2.918
654 HB2 HIS 87 HB2 HIS 87 23.429 1.473 -3.465
655 HB3 HIS 87 HB1 HIS 87 22.588 2.657 -4.456
656 HD1 HIS 87 HD1 HIS 87 24.841 2.442 -1.651
657 HD2 HIS 87 HD2 HIS 87 21.792 5.006 -2.832
658 HE1 HIS 87 HE1 HIS 87 25.204 4.589 -0.389
659 H HIS 88 HN HIS 88 19.011 1.434 -3.948
660 HA HIS 88 HA HIS 88 19.791 -0.435 -6.035
661 HB2 HIS 88 HB2 HIS 88 17.392 -0.705 -4.191
662 HB3 HIS 88 HB1 HIS 88 17.590 -1.628 -5.675
663 HD1 HIS 88 HD1 HIS 88 18.751 -1.474 -2.122
664 HD2 HIS 88 HD2 HIS 88 19.578 -3.626 -5.582
665 HE1 HIS 88 HE1 HIS 88 20.129 -3.465 -1.400
Start of MODEL 10
1 H1 MET 1 HT1 MET 1 16.351 7.221 6.746
2 H2 MET 1 HT2 MET 1 16.046 6.322 5.351
3 H3 MET 1 HT3 MET 1 17.116 5.734 6.510
4 HA MET 1 HA MET 1 14.974 4.620 6.598
5 HB2 MET 1 HB2 MET 1 16.360 4.832 8.642
6 HB3 MET 1 HB1 MET 1 15.604 6.377 8.993
7 HG2 MET 1 HG2 MET 1 13.457 5.258 9.300
8 HG3 MET 1 HG1 MET 1 14.213 3.710 8.920
9 HE1 MET 1 HE1 MET 1 12.494 4.272 11.554
10 HE2 MET 1 HE2 MET 1 13.478 3.431 12.752
11 HE3 MET 1 HE3 MET 1 13.219 2.714 11.164
12 H VAL 2 HN VAL 2 12.687 4.775 6.858
13 HA VAL 2 HA VAL 2 11.668 7.514 6.793
14 HB VAL 2 HB VAL 2 11.601 6.423 4.522
15 HG11 VAL 2 HG11 VAL 2 11.225 4.135 5.119
16 HG12 VAL 2 HG12 VAL 2 9.927 4.697 4.063
17 HG13 VAL 2 HG13 VAL 2 9.647 4.537 5.798
18 HG21 VAL 2 HG21 VAL 2 10.085 8.231 5.046
19 HG22 VAL 2 HG22 VAL 2 8.936 7.095 5.752
20 HG23 VAL 2 HG23 VAL 2 9.280 7.044 4.023
21 H THR 3 HN THR 3 10.182 8.083 7.987
22 HA THR 3 HA THR 3 9.599 6.643 10.286
23 HB THR 3 HB THR 3 7.971 8.962 9.398
24 HG1 THR 3 HG1 THR 3 10.797 8.950 9.894
25 HG21 THR 3 HG21 THR 3 8.543 9.684 11.641
26 HG22 THR 3 HG22 THR 3 9.692 8.342 11.752
27 HG23 THR 3 HG23 THR 3 7.952 8.005 11.689
28 H ALA 4 HN ALA 4 7.653 7.507 7.430
29 HA ALA 4 HA ALA 4 5.710 5.460 8.197
30 HB1 ALA 4 HB1 ALA 4 4.694 7.695 8.312
31 HB2 ALA 4 HB2 ALA 4 4.031 6.790 6.951
32 HB3 ALA 4 HB3 ALA 4 5.244 8.038 6.671
33 H ALA 5 HN ALA 5 5.922 3.811 6.889
34 HA ALA 5 HA ALA 5 7.572 4.060 4.556
35 HB1 ALA 5 HB1 ALA 5 7.347 1.611 4.453
36 HB2 ALA 5 HB2 ALA 5 6.186 1.682 5.784
37 HB3 ALA 5 HB3 ALA 5 7.850 2.187 6.039
38 H LEU 6 HN LEU 6 4.334 2.649 5.059
39 HA LEU 6 HA LEU 6 3.385 3.890 2.661
40 HB2 LEU 6 HB2 LEU 6 2.679 1.816 1.554
41 HB3 LEU 6 HB1 LEU 6 4.415 1.936 1.665
42 HG LEU 6 HG LEU 6 2.844 0.239 3.622
43 HD11 LEU 6 HD11 LEU 6 3.454 -1.678 2.183
44 HD12 LEU 6 HD12 LEU 6 3.870 -0.513 0.907
45 HD13 LEU 6 HD13 LEU 6 2.217 -0.621 1.523
46 HD21 LEU 6 HD21 LEU 6 5.677 0.127 2.613
47 HD22 LEU 6 HD22 LEU 6 4.954 -0.960 3.798
48 HD23 LEU 6 HD23 LEU 6 5.159 0.753 4.176
49 H THR 7 HN THR 7 1.253 4.143 2.655
50 HA THR 7 HA THR 7 -0.223 3.140 4.973
51 HB THR 7 HB THR 7 -0.885 5.450 3.127
52 HG1 THR 7 HG1 THR 7 -0.039 5.749 5.812
53 HG21 THR 7 HG21 THR 7 -2.823 4.438 4.251
54 HG22 THR 7 HG22 THR 7 -2.496 6.050 4.876
55 HG23 THR 7 HG23 THR 7 -2.021 4.629 5.810
56 H ILE 8 HN ILE 8 -1.720 1.698 4.601
57 HA ILE 8 HA ILE 8 -2.403 1.016 1.839
58 HB ILE 8 HB ILE 8 -2.457 -0.596 4.380
59 HG12 ILE 8 HG12 ILE 8 -0.763 -0.912 1.915
60 HG13 ILE 8 HG11 ILE 8 -0.219 -0.166 3.418
61 HG21 ILE 8 HG21 ILE 8 -2.959 -2.509 2.861
62 HG22 ILE 8 HG22 ILE 8 -3.389 -1.297 1.630
63 HG23 ILE 8 HG23 ILE 8 -4.225 -1.330 3.198
64 HD11 ILE 8 HD11 ILE 8 0.543 -2.439 3.242
65 HD12 ILE 8 HD12 ILE 8 -1.118 -3.009 3.051
66 HD13 ILE 8 HD13 ILE 8 -0.599 -2.284 4.573
67 H TYR 9 HN TYR 9 -4.437 1.113 1.148
68 HA TYR 9 HA TYR 9 -6.628 1.711 3.038
69 HB2 TYR 9 HB2 TYR 9 -6.323 2.410 0.108
70 HB3 TYR 9 HB1 TYR 9 -7.690 2.843 1.136
71 HD1 TYR 9 HD2 TYR 9 -7.063 4.221 3.265
72 HD2 TYR 9 HD1 TYR 9 -4.613 3.887 -0.182
73 HE1 TYR 9 HE2 TYR 9 -5.895 6.247 3.931
74 HE2 TYR 9 HE1 TYR 9 -3.419 5.909 0.450
75 HH TYR 9 HH TYR 9 -3.653 7.293 3.532
76 H THR 10 HN THR 10 -7.948 -0.005 3.337
77 HA THR 10 HA THR 10 -8.356 -1.800 1.043
78 HB THR 10 HB THR 10 -8.513 -3.657 2.685
79 HG1 THR 10 HG1 THR 10 -8.535 -3.178 4.683
80 HG21 THR 10 HG21 THR 10 -6.446 -3.481 1.478
81 HG22 THR 10 HG22 THR 10 -6.039 -3.816 3.162
82 HG23 THR 10 HG23 THR 10 -5.899 -2.177 2.521
83 H THR 11 HN THR 11 -10.362 -2.918 0.986
84 HA THR 11 HA THR 11 -12.570 -1.817 2.584
85 HB THR 11 HB THR 11 -13.943 -3.126 0.944
86 HG1 THR 11 HG1 THR 11 -12.516 -3.509 -1.053
87 HG21 THR 11 HG21 THR 11 -13.508 -0.722 0.556
88 HG22 THR 11 HG22 THR 11 -13.686 -1.633 -0.941
89 HG23 THR 11 HG23 THR 11 -12.076 -1.165 -0.389
90 H SER 12 HN SER 12 -14.104 -3.407 3.373
91 HA SER 12 HA SER 12 -12.718 -5.495 4.755
92 HB2 SER 12 HB2 SER 12 -15.666 -4.927 4.558
93 HB3 SER 12 HB1 SER 12 -14.846 -5.848 5.826
94 HG SER 12 HG SER 12 -13.713 -3.919 6.356
95 H TRP 13 HN TRP 13 -14.401 -5.221 1.799
96 HA TRP 13 HA TRP 13 -15.110 -8.048 1.726
97 HB2 TRP 13 HB2 TRP 13 -16.552 -7.323 -0.247
98 HB3 TRP 13 HB1 TRP 13 -17.020 -6.787 1.360
99 HD1 TRP 13 HD1 TRP 13 -16.533 -4.168 1.949
100 HE1 TRP 13 HE1 TRP 13 -16.425 -2.120 0.462
101 HE3 TRP 13 HE3 TRP 13 -15.918 -6.515 -2.544
102 HZ2 TRP 13 HZ2 TRP 13 -16.142 -1.542 -2.314
103 HZ3 TRP 13 HZ3 TRP 13 -15.745 -5.138 -4.575
104 HH2 TRP 13 HH2 TRP 13 -15.861 -2.704 -4.462
105 H CYS 14 HN CYS 14 -12.630 -6.136 0.431
106 HA CYS 14 HA CYS 14 -12.509 -7.652 -2.024
107 HB2 CYS 14 HB2 CYS 14 -11.780 -5.329 -2.109
108 HB3 CYS 14 HB1 CYS 14 -10.586 -5.625 -0.855
109 HG CYS 14 HG CYS 14 -10.583 -6.637 -4.076
110 H GLY 15 HN GLY 15 -11.065 -9.233 -2.522
111 HA2 GLY 15 HA2 GLY 15 -10.081 -10.778 -0.304
112 HA3 GLY 15 HA1 GLY 15 -10.034 -11.230 -2.000
113 H TYR 16 HN TYR 16 -8.718 -8.488 -2.482
114 HA TYR 16 HA TYR 16 -6.070 -9.544 -2.125
115 HB2 TYR 16 HB2 TYR 16 -7.026 -7.029 -3.453
116 HB3 TYR 16 HB1 TYR 16 -5.311 -7.366 -3.229
117 HD1 TYR 16 HD2 TYR 16 -4.958 -10.102 -3.877
118 HD2 TYR 16 HD1 TYR 16 -7.624 -7.305 -5.640
119 HE1 TYR 16 HE2 TYR 16 -4.954 -11.417 -5.943
120 HE2 TYR 16 HE1 TYR 16 -7.639 -8.616 -7.711
121 HH TYR 16 HH TYR 16 -6.112 -10.238 -8.844
122 H CYS 17 HN CYS 17 -8.089 -7.609 -0.297
123 HA CYS 17 HA CYS 17 -6.331 -5.816 0.922
124 HB2 CYS 17 HB2 CYS 17 -8.739 -7.201 2.087
125 HB3 CYS 17 HB1 CYS 17 -7.939 -5.798 2.783
126 HG CYS 17 HG CYS 17 -10.300 -5.035 1.611
127 H LEU 18 HN LEU 18 -7.408 -8.973 2.167
128 HA LEU 18 HA LEU 18 -5.427 -8.910 4.214
129 HB2 LEU 18 HB2 LEU 18 -6.237 -11.038 4.963
130 HB3 LEU 18 HB1 LEU 18 -7.608 -10.045 4.553
131 HG LEU 18 HG LEU 18 -6.545 -12.284 2.820
132 HD11 LEU 18 HD11 LEU 18 -8.899 -12.219 4.690
133 HD12 LEU 18 HD12 LEU 18 -7.403 -13.132 4.911
134 HD13 LEU 18 HD13 LEU 18 -8.493 -13.533 3.584
135 HD21 LEU 18 HD21 LEU 18 -9.090 -10.663 2.661
136 HD22 LEU 18 HD22 LEU 18 -8.726 -12.102 1.704
137 HD23 LEU 18 HD23 LEU 18 -7.740 -10.656 1.517
138 H ARG 19 HN ARG 19 -5.600 -10.115 1.010
139 HA ARG 19 HA ARG 19 -3.547 -11.988 1.159
140 HB2 ARG 19 HB2 ARG 19 -5.089 -11.941 -0.729
141 HB3 ARG 19 HB1 ARG 19 -4.494 -10.352 -1.186
142 HG2 ARG 19 HG2 ARG 19 -3.654 -12.155 -2.617
143 HG3 ARG 19 HG1 ARG 19 -2.367 -11.255 -1.820
144 HD2 ARG 19 HD2 ARG 19 -1.902 -13.660 -1.755
145 HD3 ARG 19 HD1 ARG 19 -2.154 -13.029 -0.132
146 HE ARG 19 HE ARG 19 -4.244 -14.425 -1.648
147 HH11 ARG 19 HH11 ARG 19 -2.535 -13.917 1.471
148 HH12 ARG 19 HH12 ARG 19 -3.285 -15.224 2.235
149 HH21 ARG 19 HH21 ARG 19 -5.264 -16.247 -0.511
150 HH22 ARG 19 HH22 ARG 19 -4.885 -16.545 1.105
151 H LEU 20 HN LEU 20 -3.597 -8.546 0.381
152 HA LEU 20 HA LEU 20 -0.900 -8.191 -0.218
153 HB2 LEU 20 HB2 LEU 20 -2.606 -6.573 -0.802
154 HB3 LEU 20 HB1 LEU 20 -2.983 -6.299 0.880
155 HG LEU 20 HG LEU 20 -0.820 -5.265 1.207
156 HD11 LEU 20 HD11 LEU 20 0.566 -4.644 -0.766
157 HD12 LEU 20 HD12 LEU 20 -0.461 -5.663 -1.776
158 HD13 LEU 20 HD13 LEU 20 0.513 -6.383 -0.495
159 HD21 LEU 20 HD21 LEU 20 -2.718 -3.873 0.665
160 HD22 LEU 20 HD22 LEU 20 -2.420 -4.090 -1.057
161 HD23 LEU 20 HD23 LEU 20 -1.259 -3.205 -0.069
162 H LYS 21 HN LYS 21 -2.675 -8.092 2.817
163 HA LYS 21 HA LYS 21 -0.646 -7.169 4.537
164 HB2 LYS 21 HB2 LYS 21 -2.803 -9.191 5.209
165 HB3 LYS 21 HB1 LYS 21 -1.876 -8.253 6.368
166 HG2 LYS 21 HG2 LYS 21 -3.850 -7.168 4.365
167 HG3 LYS 21 HG1 LYS 21 -4.130 -7.381 6.091
168 HD2 LYS 21 HD2 LYS 21 -2.332 -5.750 6.555
169 HD3 LYS 21 HD1 LYS 21 -2.097 -5.547 4.822
170 HE2 LYS 21 HE2 LYS 21 -3.469 -3.748 5.704
171 HE3 LYS 21 HE1 LYS 21 -4.402 -4.766 4.591
172 HZ1 LYS 21 HZ1 LYS 21 -5.366 -5.854 6.605
173 HZ2 LYS 21 HZ2 LYS 21 -5.698 -4.216 6.477
174 HZ3 LYS 21 HZ3 LYS 21 -4.544 -4.712 7.559
175 H THR 22 HN THR 22 -1.486 -10.464 3.528
176 HA THR 22 HA THR 22 0.341 -11.922 5.018
177 HB THR 22 HB THR 22 -0.638 -12.503 2.210
178 HG1 THR 22 HG1 THR 22 -1.774 -13.182 4.722
179 HG21 THR 22 HG21 THR 22 0.267 -14.350 4.424
180 HG22 THR 22 HG22 THR 22 1.174 -13.988 2.956
181 HG23 THR 22 HG23 THR 22 -0.357 -14.861 2.856
182 H ALA 23 HN ALA 23 0.650 -10.541 1.764
183 HA ALA 23 HA ALA 23 3.185 -11.605 1.191
184 HB1 ALA 23 HB1 ALA 23 1.613 -10.831 -0.523
185 HB2 ALA 23 HB2 ALA 23 3.196 -10.082 -0.713
186 HB3 ALA 23 HB3 ALA 23 1.863 -9.169 -0.000
187 H LEU 24 HN LEU 24 2.213 -8.474 2.514
188 HA LEU 24 HA LEU 24 4.878 -7.453 2.528
189 HB2 LEU 24 HB2 LEU 24 2.539 -6.561 4.175
190 HB3 LEU 24 HB1 LEU 24 4.020 -5.664 3.981
191 HG LEU 24 HG LEU 24 1.842 -6.136 1.965
192 HD11 LEU 24 HD11 LEU 24 3.022 -3.708 3.264
193 HD12 LEU 24 HD12 LEU 24 1.429 -4.388 3.567
194 HD13 LEU 24 HD13 LEU 24 1.815 -3.660 1.994
195 HD21 LEU 24 HD21 LEU 24 3.148 -4.717 0.431
196 HD22 LEU 24 HD22 LEU 24 3.873 -6.277 0.675
197 HD23 LEU 24 HD23 LEU 24 4.541 -4.846 1.493
198 H THR 25 HN THR 25 2.917 -9.019 4.963
199 HA THR 25 HA THR 25 4.743 -8.628 7.061
200 HB THR 25 HB THR 25 2.667 -10.809 6.707
201 HG1 THR 25 HG1 THR 25 1.638 -8.868 6.611
202 HG21 THR 25 HG21 THR 25 2.670 -10.908 9.171
203 HG22 THR 25 HG22 THR 25 3.960 -9.705 9.218
204 HG23 THR 25 HG23 THR 25 4.265 -11.297 8.525
205 H ALA 26 HN ALA 26 4.472 -11.113 4.571
206 HA ALA 26 HA ALA 26 6.322 -12.961 5.585
207 HB1 ALA 26 HB1 ALA 26 6.447 -13.811 3.302
208 HB2 ALA 26 HB2 ALA 26 5.674 -12.343 2.702
209 HB3 ALA 26 HB3 ALA 26 4.774 -13.451 3.737
210 H ASN 27 HN ASN 27 6.704 -9.990 3.875
211 HA ASN 27 HA ASN 27 9.568 -10.449 3.532
212 HB2 ASN 27 HB2 ASN 27 7.674 -8.475 2.315
213 HB3 ASN 27 HB1 ASN 27 9.413 -8.202 2.277
214 HD21 ASN 27 HD21 ASN 27 6.807 -10.282 1.169
215 HD22 ASN 27 HD22 ASN 27 7.735 -11.027 -0.076
216 H ARG 28 HN ARG 28 7.867 -9.557 6.010
217 HA ARG 28 HA ARG 28 8.254 -8.453 7.948
218 HB2 ARG 28 HB2 ARG 28 11.006 -7.971 6.789
219 HB3 ARG 28 HB1 ARG 28 10.556 -7.676 8.455
220 HG2 ARG 28 HG2 ARG 28 10.171 -10.054 8.791
221 HG3 ARG 28 HG1 ARG 28 10.545 -10.363 7.091
222 HD2 ARG 28 HD2 ARG 28 12.422 -9.206 9.158
223 HD3 ARG 28 HD1 ARG 28 12.486 -10.840 8.497
224 HE ARG 28 HE ARG 28 12.753 -9.592 6.277
225 HH11 ARG 28 HH11 ARG 28 14.237 -8.578 9.369
226 HH12 ARG 28 HH12 ARG 28 15.492 -7.709 8.608
227 HH21 ARG 28 HH21 ARG 28 14.536 -8.356 5.304
228 HH22 ARG 28 HH22 ARG 28 15.662 -7.577 6.312
229 H ILE 29 HN ILE 29 7.361 -7.007 5.477
230 HA ILE 29 HA ILE 29 8.473 -4.372 5.568
231 HB ILE 29 HB ILE 29 5.927 -5.352 4.256
232 HG12 ILE 29 HG12 ILE 29 8.591 -4.840 2.911
233 HG13 ILE 29 HG11 ILE 29 8.099 -6.445 3.477
234 HG21 ILE 29 HG21 ILE 29 6.069 -3.298 2.897
235 HG22 ILE 29 HG22 ILE 29 7.526 -2.832 3.781
236 HG23 ILE 29 HG23 ILE 29 5.993 -2.911 4.625
237 HD11 ILE 29 HD11 ILE 29 7.790 -6.175 1.147
238 HD12 ILE 29 HD12 ILE 29 6.831 -4.709 1.385
239 HD13 ILE 29 HD13 ILE 29 6.214 -6.278 1.915
240 H ALA 30 HN ALA 30 7.887 -2.756 6.817
241 HA ALA 30 HA ALA 30 5.723 -3.018 8.712
242 HB1 ALA 30 HB1 ALA 30 7.720 -0.852 8.183
243 HB2 ALA 30 HB2 ALA 30 7.901 -2.131 9.386
244 HB3 ALA 30 HB3 ALA 30 6.633 -0.899 9.573
245 H TYR 31 HN TYR 31 3.892 -1.633 8.674
246 HA TYR 31 HA TYR 31 3.685 0.296 6.564
247 HB2 TYR 31 HB2 TYR 31 1.643 -0.736 5.550
248 HB3 TYR 31 HB1 TYR 31 3.116 -1.643 5.262
249 HD1 TYR 31 HD1 TYR 31 -0.084 -1.610 7.111
250 HD2 TYR 31 HD2 TYR 31 3.378 -3.884 6.125
251 HE1 TYR 31 HE1 TYR 31 -1.182 -3.642 7.955
252 HE2 TYR 31 HE2 TYR 31 2.288 -5.916 6.972
253 HH TYR 31 HH TYR 31 0.509 -6.509 8.545
254 H ASP 32 HN ASP 32 1.420 1.219 6.475
255 HA ASP 32 HA ASP 32 0.239 1.388 9.165
256 HB2 ASP 32 HB2 ASP 32 1.399 3.491 8.417
257 HB3 ASP 32 HB1 ASP 32 0.359 3.531 7.006
258 H GLU 33 HN GLU 33 -1.768 0.582 9.149
259 HA GLU 33 HA GLU 33 -3.117 0.355 6.542
260 HB2 GLU 33 HB2 GLU 33 -4.169 -1.687 7.416
261 HB3 GLU 33 HB1 GLU 33 -2.422 -1.824 7.366
262 HG2 GLU 33 HG2 GLU 33 -2.326 -1.425 9.772
263 HG3 GLU 33 HG1 GLU 33 -4.078 -1.266 9.822
264 H VAL 34 HN VAL 34 -4.937 1.458 6.359
265 HA VAL 34 HA VAL 34 -6.514 1.914 8.753
266 HB VAL 34 HB VAL 34 -5.062 3.920 8.299
267 HG11 VAL 34 HG11 VAL 34 -5.473 5.397 6.458
268 HG12 VAL 34 HG12 VAL 34 -6.644 4.277 5.801
269 HG13 VAL 34 HG13 VAL 34 -4.922 3.813 5.894
270 HG21 VAL 34 HG21 VAL 34 -7.098 4.288 9.492
271 HG22 VAL 34 HG22 VAL 34 -7.998 4.375 7.971
272 HG23 VAL 34 HG23 VAL 34 -6.826 5.625 8.364
273 H ASP 35 HN ASP 35 -8.782 1.804 8.312
274 HA ASP 35 HA ASP 35 -9.193 0.720 5.637
275 HB2 ASP 35 HB2 ASP 35 -11.276 -0.263 6.367
276 HB3 ASP 35 HB1 ASP 35 -10.030 -0.663 7.536
277 H ILE 36 HN ILE 36 -10.587 1.405 4.246
278 HA ILE 36 HA ILE 36 -11.267 4.202 4.404
279 HB ILE 36 HB ILE 36 -11.853 3.983 2.055
280 HG12 ILE 36 HG12 ILE 36 -11.156 1.097 2.501
281 HG13 ILE 36 HG11 ILE 36 -12.781 1.720 2.174
282 HG21 ILE 36 HG21 ILE 36 -9.250 2.649 2.795
283 HG22 ILE 36 HG22 ILE 36 -9.545 4.386 2.769
284 HG23 ILE 36 HG23 ILE 36 -9.605 3.465 1.269
285 HD11 ILE 36 HD11 ILE 36 -10.410 1.576 0.349
286 HD12 ILE 36 HD12 ILE 36 -11.878 2.495 -0.025
287 HD13 ILE 36 HD13 ILE 36 -11.962 0.747 0.192
288 H GLU 37 HN GLU 37 -12.725 1.509 5.420
289 HA GLU 37 HA GLU 37 -15.291 1.952 4.326
290 HB2 GLU 37 HB2 GLU 37 -14.567 0.189 6.700
291 HB3 GLU 37 HB1 GLU 37 -15.989 0.081 5.657
292 HG2 GLU 37 HG2 GLU 37 -13.201 -0.313 4.638
293 HG3 GLU 37 HG1 GLU 37 -14.211 -1.625 5.231
294 H HIS 38 HN HIS 38 -13.597 2.558 7.351
295 HA HIS 38 HA HIS 38 -15.756 4.194 8.365
296 HB2 HIS 38 HB2 HIS 38 -14.426 2.964 10.015
297 HB3 HIS 38 HB1 HIS 38 -12.950 3.719 9.427
298 HD1 HIS 38 HD1 HIS 38 -12.183 5.349 11.179
299 HD2 HIS 38 HD2 HIS 38 -16.309 5.349 10.744
300 HE1 HIS 38 HE1 HIS 38 -13.044 7.169 12.688
301 H ASN 39 HN ASN 39 -12.554 4.688 6.944
302 HA ASN 39 HA ASN 39 -12.906 7.562 7.158
303 HB2 ASN 39 HB2 ASN 39 -10.622 6.002 5.930
304 HB3 ASN 39 HB1 ASN 39 -10.674 7.748 6.064
305 HD21 ASN 39 HD21 ASN 39 -10.184 4.762 7.644
306 HD22 ASN 39 HD22 ASN 39 -9.617 5.446 9.121
307 H ARG 40 HN ARG 40 -14.428 8.230 5.856
308 HA ARG 40 HA ARG 40 -14.823 7.109 3.279
309 HB2 ARG 40 HB2 ARG 40 -16.684 8.016 4.625
310 HB3 ARG 40 HB1 ARG 40 -16.003 9.623 4.451
311 HG2 ARG 40 HG2 ARG 40 -16.318 9.522 2.057
312 HG3 ARG 40 HG1 ARG 40 -16.984 7.895 2.207
313 HD2 ARG 40 HD2 ARG 40 -18.804 8.774 3.581
314 HD3 ARG 40 HD1 ARG 40 -18.138 10.401 3.413
315 HE ARG 40 HE ARG 40 -18.387 9.550 0.877
316 HH11 ARG 40 HH11 ARG 40 -20.700 9.934 3.548
317 HH12 ARG 40 HH12 ARG 40 -22.051 10.076 2.524
318 HH21 ARG 40 HH21 ARG 40 -20.210 9.754 -0.487
319 HH22 ARG 40 HH22 ARG 40 -21.770 9.998 0.153
320 H ALA 41 HN ALA 41 -13.036 9.859 4.488
321 HA ALA 41 HA ALA 41 -12.677 11.122 1.944
322 HB1 ALA 41 HB1 ALA 41 -10.929 11.271 4.400
323 HB2 ALA 41 HB2 ALA 41 -12.260 12.376 4.010
324 HB3 ALA 41 HB3 ALA 41 -10.821 12.291 2.976
325 H ALA 42 HN ALA 42 -11.007 8.700 3.786
326 HA ALA 42 HA ALA 42 -8.830 8.455 1.989
327 HB1 ALA 42 HB1 ALA 42 -9.866 6.389 3.954
328 HB2 ALA 42 HB2 ALA 42 -8.686 7.639 4.322
329 HB3 ALA 42 HB3 ALA 42 -8.299 6.385 3.140
330 H ALA 43 HN ALA 43 -11.975 6.906 2.308
331 HA ALA 43 HA ALA 43 -11.749 4.977 0.278
332 HB1 ALA 43 HB1 ALA 43 -13.608 5.044 1.916
333 HB2 ALA 43 HB2 ALA 43 -14.176 4.949 0.249
334 HB3 ALA 43 HB3 ALA 43 -14.224 6.484 1.109
335 H GLU 44 HN GLU 44 -12.785 8.321 0.182
336 HA GLU 44 HA GLU 44 -13.487 8.459 -2.517
337 HB2 GLU 44 HB2 GLU 44 -13.950 10.149 -0.709
338 HB3 GLU 44 HB1 GLU 44 -12.271 10.648 -0.823
339 HG2 GLU 44 HG2 GLU 44 -13.683 12.167 -2.048
340 HG3 GLU 44 HG1 GLU 44 -12.627 11.279 -3.148
341 H PHE 45 HN PHE 45 -10.461 9.093 -0.824
342 HA PHE 45 HA PHE 45 -8.809 9.838 -2.923
343 HB2 PHE 45 HB2 PHE 45 -8.145 10.053 -0.565
344 HB3 PHE 45 HB1 PHE 45 -8.149 8.310 -0.403
345 HD1 PHE 45 HD2 PHE 45 -6.424 11.082 -2.124
346 HD2 PHE 45 HD1 PHE 45 -6.254 6.990 -0.946
347 HE1 PHE 45 HE2 PHE 45 -4.073 10.971 -2.825
348 HE2 PHE 45 HE1 PHE 45 -3.913 6.886 -1.650
349 HZ PHE 45 HZ PHE 45 -2.820 8.871 -2.593
350 H VAL 46 HN VAL 46 -9.051 6.606 -1.459
351 HA VAL 46 HA VAL 46 -7.458 5.322 -3.407
352 HB VAL 46 HB VAL 46 -7.639 4.291 -1.236
353 HG11 VAL 46 HG11 VAL 46 -9.700 4.971 -0.493
354 HG12 VAL 46 HG12 VAL 46 -9.745 3.183 -0.639
355 HG13 VAL 46 HG13 VAL 46 -10.520 4.204 -1.860
356 HG21 VAL 46 HG21 VAL 46 -7.460 2.802 -3.199
357 HG22 VAL 46 HG22 VAL 46 -9.203 2.505 -3.021
358 HG23 VAL 46 HG23 VAL 46 -8.087 2.063 -1.723
359 H GLY 47 HN GLY 47 -10.919 5.874 -3.330
360 HA2 GLY 47 HA2 GLY 47 -11.563 4.147 -5.461
361 HA3 GLY 47 HA1 GLY 47 -12.501 5.537 -4.937
362 H SER 48 HN SER 48 -10.403 7.468 -5.410
363 HA SER 48 HA SER 48 -10.860 7.805 -8.219
364 HB2 SER 48 HB2 SER 48 -9.692 9.997 -7.901
365 HB3 SER 48 HB1 SER 48 -11.084 9.753 -6.853
366 HG SER 48 HG SER 48 -8.940 8.836 -5.542
367 H VAL 49 HN VAL 49 -8.433 6.299 -6.468
368 HA VAL 49 HA VAL 49 -6.570 6.524 -8.738
369 HB VAL 49 HB VAL 49 -4.742 5.869 -7.172
370 HG11 VAL 49 HG11 VAL 49 -6.320 8.255 -6.285
371 HG12 VAL 49 HG12 VAL 49 -5.112 8.223 -7.583
372 HG13 VAL 49 HG13 VAL 49 -4.625 7.958 -5.900
373 HG21 VAL 49 HG21 VAL 49 -5.096 5.851 -4.772
374 HG22 VAL 49 HG22 VAL 49 -6.184 4.672 -5.541
375 HG23 VAL 49 HG23 VAL 49 -6.794 6.240 -5.024
376 H ASN 50 HN ASN 50 -8.906 4.780 -8.027
377 HA ASN 50 HA ASN 50 -7.672 2.160 -7.780
378 HB2 ASN 50 HB2 ASN 50 -10.015 3.269 -6.741
379 HB3 ASN 50 HB1 ASN 50 -10.575 2.146 -7.973
380 HD21 ASN 50 HD21 ASN 50 -7.780 1.994 -5.853
381 HD22 ASN 50 HD22 ASN 50 -8.280 0.538 -5.067
382 H GLY 51 HN GLY 51 -9.430 0.530 -9.067
383 HA2 GLY 51 HA2 GLY 51 -9.221 1.261 -11.869
384 HA3 GLY 51 HA1 GLY 51 -9.703 -0.310 -11.225
385 H GLY 52 HN GLY 52 -10.794 3.051 -11.379
386 HA2 GLY 52 HA2 GLY 52 -12.918 3.692 -12.238
387 HA3 GLY 52 HA1 GLY 52 -13.521 2.085 -11.829
388 H ASN 53 HN ASN 53 -14.313 1.698 -9.825
389 HA ASN 53 HA ASN 53 -14.443 3.980 -7.964
390 HB2 ASN 53 HB2 ASN 53 -16.611 2.887 -8.873
391 HB3 ASN 53 HB1 ASN 53 -16.169 1.471 -7.934
392 HD21 ASN 53 HD21 ASN 53 -17.385 4.678 -7.854
393 HD22 ASN 53 HD22 ASN 53 -17.826 4.720 -6.192
394 H ARG 54 HN ARG 54 -14.560 2.920 -5.534
395 HA ARG 54 HA ARG 54 -12.103 1.445 -5.492
396 HB2 ARG 54 HB2 ARG 54 -11.950 1.631 -3.120
397 HB3 ARG 54 HB1 ARG 54 -12.451 3.197 -3.754
398 HG2 ARG 54 HG2 ARG 54 -14.244 1.191 -2.388
399 HG3 ARG 54 HG1 ARG 54 -13.489 2.571 -1.600
400 HD2 ARG 54 HD2 ARG 54 -14.695 4.049 -3.150
401 HD3 ARG 54 HD1 ARG 54 -15.503 2.630 -3.829
402 HE ARG 54 HE ARG 54 -15.687 3.040 -0.973
403 HH11 ARG 54 HH11 ARG 54 -17.291 3.163 -4.123
404 HH12 ARG 54 HH12 ARG 54 -18.828 3.489 -3.491
405 HH21 ARG 54 HH21 ARG 54 -17.850 3.491 -0.096
406 HH22 ARG 54 HH22 ARG 54 -19.146 3.694 -1.175
407 H THR 55 HN THR 55 -11.966 -0.458 -5.827
408 HA THR 55 HA THR 55 -13.821 -2.349 -4.576
409 HB THR 55 HB THR 55 -14.487 -2.138 -6.926
410 HG1 THR 55 HG1 THR 55 -13.464 -4.498 -5.910
411 HG21 THR 55 HG21 THR 55 -11.659 -2.980 -7.607
412 HG22 THR 55 HG22 THR 55 -12.347 -1.378 -7.864
413 HG23 THR 55 HG23 THR 55 -12.976 -2.757 -8.760
414 H VAL 56 HN VAL 56 -10.632 -1.379 -5.286
415 HA VAL 56 HA VAL 56 -9.599 -3.828 -4.131
416 HB VAL 56 HB VAL 56 -7.530 -3.398 -5.612
417 HG11 VAL 56 HG11 VAL 56 -10.105 -4.459 -6.851
418 HG12 VAL 56 HG12 VAL 56 -8.986 -5.388 -5.853
419 HG13 VAL 56 HG13 VAL 56 -8.481 -4.811 -7.439
420 HG21 VAL 56 HG21 VAL 56 -8.022 -2.465 -7.843
421 HG22 VAL 56 HG22 VAL 56 -8.203 -1.268 -6.557
422 HG23 VAL 56 HG23 VAL 56 -9.628 -2.006 -7.281
423 HA PRO 57 HA PRO 57 -7.423 -1.113 -1.483
424 HB2 PRO 57 HB2 PRO 57 -5.108 -2.494 -1.070
425 HB3 PRO 57 HB1 PRO 57 -6.660 -2.904 -0.323
426 HG2 PRO 57 HG2 PRO 57 -5.331 -4.123 -2.695
427 HG3 PRO 57 HG1 PRO 57 -6.190 -4.917 -1.366
428 HD2 PRO 57 HD2 PRO 57 -7.342 -4.476 -3.774
429 HD3 PRO 57 HD1 PRO 57 -8.264 -4.463 -2.256
430 H THR 58 HN THR 58 -5.679 0.314 -1.417
431 HA THR 58 HA THR 58 -3.810 0.305 -3.627
432 HB THR 58 HB THR 58 -5.329 2.792 -2.794
433 HG1 THR 58 HG1 THR 58 -6.051 0.755 -4.353
434 HG21 THR 58 HG21 THR 58 -4.496 3.706 -4.901
435 HG22 THR 58 HG22 THR 58 -3.551 2.242 -5.168
436 HG23 THR 58 HG23 THR 58 -3.199 3.302 -3.773
437 H VAL 59 HN VAL 59 -1.936 1.385 -3.078
438 HA VAL 59 HA VAL 59 -1.714 1.894 -0.228
439 HB VAL 59 HB VAL 59 -0.711 -0.233 -0.825
440 HG11 VAL 59 HG11 VAL 59 1.195 -0.384 -2.341
441 HG12 VAL 59 HG12 VAL 59 0.975 1.315 -2.768
442 HG13 VAL 59 HG13 VAL 59 -0.281 0.131 -3.166
443 HG21 VAL 59 HG21 VAL 59 1.566 0.195 -0.126
444 HG22 VAL 59 HG22 VAL 59 0.311 0.983 0.870
445 HG23 VAL 59 HG23 VAL 59 1.238 1.931 -0.323
446 H LYS 60 HN LYS 60 -0.674 3.725 0.345
447 HA LYS 60 HA LYS 60 0.410 5.399 -1.823
448 HB2 LYS 60 HB2 LYS 60 -1.623 6.337 -0.558
449 HB3 LYS 60 HB1 LYS 60 -0.588 6.369 0.856
450 HG2 LYS 60 HG2 LYS 60 0.969 7.865 -0.261
451 HG3 LYS 60 HG1 LYS 60 -0.029 7.849 -1.705
452 HD2 LYS 60 HD2 LYS 60 -0.474 9.871 -0.525
453 HD3 LYS 60 HD1 LYS 60 -1.878 8.830 -0.341
454 HE2 LYS 60 HE2 LYS 60 -1.215 8.232 1.895
455 HE3 LYS 60 HE1 LYS 60 0.309 9.106 1.715
456 HZ1 LYS 60 HZ1 LYS 60 -0.913 11.159 1.535
457 HZ2 LYS 60 HZ2 LYS 60 -1.357 10.394 2.956
458 HZ3 LYS 60 HZ3 LYS 60 -2.388 10.374 1.636
459 H PHE 61 HN PHE 61 2.487 5.807 -1.687
460 HA PHE 61 HA PHE 61 3.992 4.840 0.601
461 HB2 PHE 61 HB2 PHE 61 4.874 6.112 -1.982
462 HB3 PHE 61 HB1 PHE 61 5.965 5.537 -0.730
463 HD1 PHE 61 HD2 PHE 61 3.657 4.611 -3.375
464 HD2 PHE 61 HD1 PHE 61 6.304 3.183 -0.367
465 HE1 PHE 61 HE2 PHE 61 3.645 2.416 -4.417
466 HE2 PHE 61 HE1 PHE 61 6.301 0.973 -1.406
467 HZ PHE 61 HZ PHE 61 4.987 0.581 -3.440
468 H ALA 62 HN ALA 62 5.766 6.244 1.419
469 HA ALA 62 HA ALA 62 4.829 8.595 2.588
470 HB1 ALA 62 HB1 ALA 62 7.121 8.967 3.284
471 HB2 ALA 62 HB2 ALA 62 7.682 7.776 2.112
472 HB3 ALA 62 HB3 ALA 62 6.677 7.271 3.469
473 H ASP 63 HN ASP 63 6.400 8.059 -0.466
474 HA ASP 63 HA ASP 63 7.163 10.786 -0.850
475 HB2 ASP 63 HB2 ASP 63 7.853 10.174 -3.072
476 HB3 ASP 63 HB1 ASP 63 8.315 8.864 -1.999
477 H GLY 64 HN GLY 64 4.237 9.096 -1.111
478 HA2 GLY 64 HA2 GLY 64 2.244 10.409 -1.295
479 HA3 GLY 64 HA1 GLY 64 3.061 11.398 -2.492
480 H SER 65 HN SER 65 4.073 8.685 -3.679
481 HA SER 65 HA SER 65 1.977 8.579 -5.602
482 HB2 SER 65 HB2 SER 65 3.371 6.798 -6.670
483 HB3 SER 65 HB1 SER 65 4.229 8.311 -6.376
484 HG SER 65 HG SER 65 5.250 7.434 -4.686
485 H THR 66 HN THR 66 0.745 6.783 -6.258
486 HA THR 66 HA THR 66 0.228 4.841 -4.140
487 HB THR 66 HB THR 66 -2.054 4.708 -5.295
488 HG1 THR 66 HG1 THR 66 -2.332 5.917 -6.895
489 HG21 THR 66 HG21 THR 66 -1.813 5.613 -3.092
490 HG22 THR 66 HG22 THR 66 -2.949 6.608 -3.997
491 HG23 THR 66 HG23 THR 66 -1.291 7.176 -3.731
492 H LEU 67 HN LEU 67 -0.225 2.751 -4.768
493 HA LEU 67 HA LEU 67 -0.147 2.111 -7.628
494 HB2 LEU 67 HB2 LEU 67 1.204 0.492 -5.432
495 HB3 LEU 67 HB1 LEU 67 0.888 -0.111 -7.034
496 HG LEU 67 HG LEU 67 2.791 2.130 -6.330
497 HD11 LEU 67 HD11 LEU 67 3.544 -0.132 -5.644
498 HD12 LEU 67 HD12 LEU 67 4.518 0.524 -6.962
499 HD13 LEU 67 HD13 LEU 67 3.286 -0.687 -7.296
500 HD21 LEU 67 HD21 LEU 67 3.494 1.929 -8.683
501 HD22 LEU 67 HD22 LEU 67 1.838 2.494 -8.528
502 HD23 LEU 67 HD23 LEU 67 2.159 0.814 -8.975
503 H THR 68 HN THR 68 -1.991 1.206 -8.194
504 HA THR 68 HA THR 68 -3.957 0.386 -6.356
505 HB THR 68 HB THR 68 -3.682 -0.425 -9.277
506 HG1 THR 68 HG1 THR 68 -4.772 1.983 -8.140
507 HG21 THR 68 HG21 THR 68 -6.108 0.047 -7.522
508 HG22 THR 68 HG22 THR 68 -5.497 -1.532 -8.015
509 HG23 THR 68 HG23 THR 68 -6.139 -0.421 -9.224
510 H ASN 69 HN ASN 69 -4.464 -1.705 -5.625
511 HA ASN 69 HA ASN 69 -3.036 -3.260 -4.367
512 HB2 ASN 69 HB2 ASN 69 -4.295 -5.303 -4.809
513 HB3 ASN 69 HB1 ASN 69 -5.325 -3.885 -4.772
514 HD21 ASN 69 HD21 ASN 69 -4.399 -6.626 -6.507
515 HD22 ASN 69 HD22 ASN 69 -5.278 -6.302 -7.963
516 HA PRO 70 HA PRO 70 0.366 -4.849 -6.840
517 HB2 PRO 70 HB2 PRO 70 2.267 -3.836 -5.313
518 HB3 PRO 70 HB1 PRO 70 1.362 -2.799 -6.423
519 HG2 PRO 70 HG2 PRO 70 1.246 -2.948 -3.477
520 HG3 PRO 70 HG1 PRO 70 0.807 -1.612 -4.550
521 HD2 PRO 70 HD2 PRO 70 -0.909 -3.571 -3.320
522 HD3 PRO 70 HD1 PRO 70 -1.348 -2.185 -4.344
523 H SER 71 HN SER 71 2.436 -5.889 -5.829
524 HA SER 71 HA SER 71 1.643 -7.525 -3.567
525 HB2 SER 71 HB2 SER 71 1.793 -8.864 -5.611
526 HB3 SER 71 HB1 SER 71 3.401 -8.252 -5.944
527 HG SER 71 HG SER 71 4.162 -9.713 -4.698
528 H ALA 72 HN ALA 72 3.799 -8.421 -2.547
529 HA ALA 72 HA ALA 72 4.929 -6.293 -1.077
530 HB1 ALA 72 HB1 ALA 72 6.397 -7.930 -0.132
531 HB2 ALA 72 HB2 ALA 72 5.995 -9.081 -1.414
532 HB3 ALA 72 HB3 ALA 72 4.760 -8.556 -0.263
533 H ASP 73 HN ASP 73 6.485 -8.099 -3.729
534 HA ASP 73 HA ASP 73 8.823 -6.531 -3.305
535 HB2 ASP 73 HB2 ASP 73 8.234 -8.559 -5.470
536 HB3 ASP 73 HB1 ASP 73 9.729 -7.635 -5.404
537 H GLU 74 HN GLU 74 6.143 -6.230 -5.425
538 HA GLU 74 HA GLU 74 7.128 -4.235 -7.145
539 HB2 GLU 74 HB2 GLU 74 4.359 -4.655 -6.028
540 HB3 GLU 74 HB1 GLU 74 4.734 -3.431 -7.229
541 HG2 GLU 74 HG2 GLU 74 5.065 -6.398 -7.569
542 HG3 GLU 74 HG1 GLU 74 3.762 -5.398 -8.215
543 H VAL 75 HN VAL 75 5.658 -4.026 -3.962
544 HA VAL 75 HA VAL 75 5.999 -1.199 -3.972
545 HB VAL 75 HB VAL 75 5.154 -1.289 -1.572
546 HG11 VAL 75 HG11 VAL 75 3.462 -2.456 -3.780
547 HG12 VAL 75 HG12 VAL 75 3.657 -0.734 -3.456
548 HG13 VAL 75 HG13 VAL 75 2.830 -1.773 -2.298
549 HG21 VAL 75 HG21 VAL 75 4.455 -4.094 -2.365
550 HG22 VAL 75 HG22 VAL 75 3.978 -3.291 -0.874
551 HG23 VAL 75 HG23 VAL 75 5.683 -3.690 -1.163
552 H LYS 76 HN LYS 76 7.752 -3.899 -2.672
553 HA LYS 76 HA LYS 76 9.513 -2.527 -0.969
554 HB2 LYS 76 HB2 LYS 76 9.952 -4.984 -2.667
555 HB3 LYS 76 HB1 LYS 76 11.185 -4.343 -1.600
556 HG2 LYS 76 HG2 LYS 76 9.916 -4.808 0.329
557 HG3 LYS 76 HG1 LYS 76 8.455 -5.089 -0.620
558 HD2 LYS 76 HD2 LYS 76 9.374 -7.203 0.158
559 HD3 LYS 76 HD1 LYS 76 9.490 -7.117 -1.586
560 HE2 LYS 76 HE2 LYS 76 11.884 -6.368 -1.255
561 HE3 LYS 76 HE1 LYS 76 11.674 -6.779 0.448
562 HZ1 LYS 76 HZ1 LYS 76 11.083 -9.057 -0.229
563 HZ2 LYS 76 HZ2 LYS 76 12.624 -8.632 -0.745
564 HZ3 LYS 76 HZ3 LYS 76 11.352 -8.638 -1.846
565 H ALA 77 HN ALA 77 9.585 -3.071 -4.445
566 HA ALA 77 HA ALA 77 12.055 -2.047 -5.092
567 HB1 ALA 77 HB1 ALA 77 9.515 -1.778 -6.697
568 HB2 ALA 77 HB2 ALA 77 10.564 -3.193 -6.669
569 HB3 ALA 77 HB3 ALA 77 11.161 -1.669 -7.320
570 H LYS 78 HN LYS 78 9.074 -0.289 -4.456
571 HA LYS 78 HA LYS 78 10.387 2.214 -5.043
572 HB2 LYS 78 HB2 LYS 78 7.661 1.657 -3.941
573 HB3 LYS 78 HB1 LYS 78 8.295 3.280 -4.160
574 HG2 LYS 78 HG2 LYS 78 8.648 2.678 -6.580
575 HG3 LYS 78 HG1 LYS 78 7.723 1.217 -6.252
576 HD2 LYS 78 HD2 LYS 78 6.154 2.717 -7.109
577 HD3 LYS 78 HD1 LYS 78 5.922 2.754 -5.360
578 HE2 LYS 78 HE2 LYS 78 7.506 4.814 -6.924
579 HE3 LYS 78 HE1 LYS 78 5.828 5.015 -6.461
580 HZ1 LYS 78 HZ1 LYS 78 6.602 4.910 -4.083
581 HZ2 LYS 78 HZ2 LYS 78 7.130 6.196 -4.947
582 HZ3 LYS 78 HZ3 LYS 78 8.205 4.952 -4.657
583 H LEU 79 HN LEU 79 9.167 0.545 -2.214
584 HA LEU 79 HA LEU 79 9.622 2.496 -0.308
585 HB2 LEU 79 HB2 LEU 79 8.256 0.534 0.060
586 HB3 LEU 79 HB1 LEU 79 9.665 -0.497 -0.034
587 HG LEU 79 HG LEU 79 10.538 0.498 2.008
588 HD11 LEU 79 HD11 LEU 79 7.925 2.009 2.086
589 HD12 LEU 79 HD12 LEU 79 9.526 2.711 1.838
590 HD13 LEU 79 HD13 LEU 79 9.126 1.955 3.376
591 HD21 LEU 79 HD21 LEU 79 8.889 -0.476 3.543
592 HD22 LEU 79 HD22 LEU 79 9.217 -1.509 2.153
593 HD23 LEU 79 HD23 LEU 79 7.729 -0.566 2.216
594 H VAL 80 HN VAL 80 11.840 0.007 -1.495
595 HA VAL 80 HA VAL 80 13.889 0.422 0.382
596 HB VAL 80 HB VAL 80 13.650 -1.575 -1.144
597 HG11 VAL 80 HG11 VAL 80 13.197 -0.510 -3.251
598 HG12 VAL 80 HG12 VAL 80 14.619 -1.543 -3.382
599 HG13 VAL 80 HG13 VAL 80 14.810 0.207 -3.259
600 HG21 VAL 80 HG21 VAL 80 16.347 -0.281 -1.292
601 HG22 VAL 80 HG22 VAL 80 16.002 -2.005 -1.442
602 HG23 VAL 80 HG23 VAL 80 15.722 -1.184 0.099
603 H LYS 81 HN LYS 81 13.064 2.051 -2.584
604 HA LYS 81 HA LYS 81 15.498 3.565 -2.695
605 HB2 LYS 81 HB2 LYS 81 12.984 3.833 -4.342
606 HB3 LYS 81 HB1 LYS 81 14.530 4.608 -4.674
607 HG2 LYS 81 HG2 LYS 81 15.542 2.339 -4.847
608 HG3 LYS 81 HG1 LYS 81 13.922 1.669 -4.698
609 HD2 LYS 81 HD2 LYS 81 13.288 2.939 -6.765
610 HD3 LYS 81 HD1 LYS 81 14.971 3.441 -6.888
611 HE2 LYS 81 HE2 LYS 81 15.686 1.133 -7.006
612 HE3 LYS 81 HE1 LYS 81 14.022 0.590 -6.842
613 HZ1 LYS 81 HZ1 LYS 81 13.483 1.637 -8.909
614 HZ2 LYS 81 HZ2 LYS 81 14.740 0.556 -9.142
615 HZ3 LYS 81 HZ3 LYS 81 15.050 2.225 -9.098
616 H ILE 82 HN ILE 82 12.474 3.893 -1.222
617 HA ILE 82 HA ILE 82 12.543 6.794 -1.024
618 HB ILE 82 HB ILE 82 10.734 4.794 0.371
619 HG12 ILE 82 HG12 ILE 82 10.164 6.546 -2.026
620 HG13 ILE 82 HG11 ILE 82 10.518 4.825 -2.098
621 HG21 ILE 82 HG21 ILE 82 10.854 6.896 1.613
622 HG22 ILE 82 HG22 ILE 82 9.274 6.722 0.852
623 HG23 ILE 82 HG23 ILE 82 10.474 7.800 0.146
624 HD11 ILE 82 HD11 ILE 82 8.170 6.086 -0.712
625 HD12 ILE 82 HD12 ILE 82 8.520 4.357 -0.802
626 HD13 ILE 82 HD13 ILE 82 8.137 5.256 -2.267
627 H ALA 83 HN ALA 83 12.962 3.997 1.085
628 HA ALA 83 HA ALA 83 13.403 5.454 3.467
629 HB1 ALA 83 HB1 ALA 83 12.692 3.134 3.484
630 HB2 ALA 83 HB2 ALA 83 14.175 3.351 4.412
631 HB3 ALA 83 HB3 ALA 83 14.240 2.640 2.796
632 H GLY 84 HN GLY 84 15.502 4.585 0.879
633 HA2 GLY 84 HA2 GLY 84 17.512 6.283 1.110
634 HA3 GLY 84 HA1 GLY 84 17.835 5.187 2.466
635 H LEU 85 HN LEU 85 19.409 4.045 1.963
636 HA LEU 85 HA LEU 85 20.722 2.515 1.033
637 HB2 LEU 85 HB2 LEU 85 18.041 1.286 0.687
638 HB3 LEU 85 HB1 LEU 85 19.548 0.378 0.531
639 HG LEU 85 HG LEU 85 18.656 -0.141 2.605
640 HD11 LEU 85 HD11 LEU 85 21.008 0.279 2.767
641 HD12 LEU 85 HD12 LEU 85 20.206 0.721 4.273
642 HD13 LEU 85 HD13 LEU 85 20.708 1.977 3.141
643 HD21 LEU 85 HD21 LEU 85 18.161 2.779 3.142
644 HD22 LEU 85 HD22 LEU 85 17.905 1.476 4.305
645 HD23 LEU 85 HD23 LEU 85 16.945 1.540 2.828
646 H GLU 86 HN GLU 86 18.126 1.809 -1.289
647 HA GLU 86 HA GLU 86 20.204 1.816 -3.352
648 HB2 GLU 86 HB2 GLU 86 18.982 -0.297 -2.948
649 HB3 GLU 86 HB1 GLU 86 17.480 0.512 -3.362
650 HG2 GLU 86 HG2 GLU 86 18.305 0.900 -5.633
651 HG3 GLU 86 HG1 GLU 86 19.818 0.098 -5.221
652 H HIS 87 HN HIS 87 20.265 3.629 -4.384
653 HA HIS 87 HA HIS 87 18.599 4.598 -6.293
654 HB2 HIS 87 HB2 HIS 87 17.003 5.130 -4.274
655 HB3 HIS 87 HB1 HIS 87 18.186 6.360 -3.854
656 HD1 HIS 87 HD1 HIS 87 18.556 8.286 -5.896
657 HD2 HIS 87 HD2 HIS 87 15.147 5.890 -6.041
658 HE1 HIS 87 HE1 HIS 87 16.936 9.440 -7.414
659 H HIS 88 HN HIS 88 20.349 5.530 -3.488
660 HA HIS 88 HA HIS 88 21.892 7.464 -4.986
661 HB2 HIS 88 HB2 HIS 88 21.543 7.063 -2.006
662 HB3 HIS 88 HB1 HIS 88 22.622 8.260 -2.723
663 HD1 HIS 88 HD1 HIS 88 18.997 7.646 -1.923
664 HD2 HIS 88 HD2 HIS 88 21.329 10.407 -3.979
665 HE1 HIS 88 HE1 HIS 88 17.519 9.591 -2.380
Start of MODEL 11
1 H1 MET 1 HT1 MET 1 14.089 9.202 6.121
2 H2 MET 1 HT2 MET 1 13.438 8.764 4.664
3 H3 MET 1 HT3 MET 1 14.882 8.080 5.146
4 HA MET 1 HA MET 1 13.134 6.483 5.410
5 HB2 MET 1 HB2 MET 1 14.932 6.617 7.166
6 HB3 MET 1 HB1 MET 1 13.864 7.619 8.127
7 HG2 MET 1 HG2 MET 1 13.838 5.353 8.942
8 HG3 MET 1 HG1 MET 1 12.261 5.785 8.285
9 HE1 MET 1 HE1 MET 1 15.309 3.044 6.125
10 HE2 MET 1 HE2 MET 1 15.599 3.788 7.698
11 HE3 MET 1 HE3 MET 1 15.530 4.787 6.246
12 H VAL 2 HN VAL 2 12.355 9.694 6.493
13 HA VAL 2 HA VAL 2 10.541 10.802 6.806
14 HB VAL 2 HB VAL 2 8.954 8.458 5.698
15 HG11 VAL 2 HG11 VAL 2 8.295 11.385 5.919
16 HG12 VAL 2 HG12 VAL 2 7.489 10.033 6.733
17 HG13 VAL 2 HG13 VAL 2 7.353 10.224 4.992
18 HG21 VAL 2 HG21 VAL 2 10.212 10.768 4.205
19 HG22 VAL 2 HG22 VAL 2 9.120 9.570 3.505
20 HG23 VAL 2 HG23 VAL 2 10.696 9.073 4.114
21 H THR 3 HN THR 3 8.784 7.828 7.434
22 HA THR 3 HA THR 3 9.067 7.475 10.087
23 HB THR 3 HB THR 3 8.333 9.773 10.591
24 HG1 THR 3 HG1 THR 3 6.123 9.092 11.601
25 HG21 THR 3 HG21 THR 3 6.036 10.574 10.061
26 HG22 THR 3 HG22 THR 3 5.794 9.146 9.054
27 HG23 THR 3 HG23 THR 3 7.028 10.336 8.628
28 H ALA 4 HN ALA 4 6.637 7.886 7.594
29 HA ALA 4 HA ALA 4 5.523 5.265 8.243
30 HB1 ALA 4 HB1 ALA 4 3.635 5.978 6.814
31 HB2 ALA 4 HB2 ALA 4 4.444 7.520 6.534
32 HB3 ALA 4 HB3 ALA 4 3.887 7.099 8.154
33 H ALA 5 HN ALA 5 5.149 3.900 6.335
34 HA ALA 5 HA ALA 5 7.329 4.377 4.402
35 HB1 ALA 5 HB1 ALA 5 7.575 2.319 5.685
36 HB2 ALA 5 HB2 ALA 5 7.246 1.937 3.993
37 HB3 ALA 5 HB3 ALA 5 5.967 1.796 5.194
38 H LEU 6 HN LEU 6 4.231 2.688 4.482
39 HA LEU 6 HA LEU 6 3.120 4.288 2.512
40 HB2 LEU 6 HB2 LEU 6 2.718 2.587 0.747
41 HB3 LEU 6 HB1 LEU 6 4.400 3.012 0.888
42 HG LEU 6 HG LEU 6 4.327 0.761 0.345
43 HD11 LEU 6 HD11 LEU 6 5.195 -0.539 2.185
44 HD12 LEU 6 HD12 LEU 6 4.813 0.810 3.266
45 HD13 LEU 6 HD13 LEU 6 5.963 1.030 1.953
46 HD21 LEU 6 HD21 LEU 6 2.221 0.312 2.426
47 HD22 LEU 6 HD22 LEU 6 3.013 -0.954 1.465
48 HD23 LEU 6 HD23 LEU 6 2.048 0.291 0.665
49 H THR 7 HN THR 7 1.050 4.275 2.571
50 HA THR 7 HA THR 7 -0.027 2.617 4.707
51 HB THR 7 HB THR 7 -1.162 5.184 3.593
52 HG1 THR 7 HG1 THR 7 0.902 4.617 5.378
53 HG21 THR 7 HG21 THR 7 -1.587 3.707 6.206
54 HG22 THR 7 HG22 THR 7 -2.730 3.754 4.863
55 HG23 THR 7 HG23 THR 7 -2.352 5.230 5.752
56 H ILE 8 HN ILE 8 -1.437 1.204 4.319
57 HA ILE 8 HA ILE 8 -2.476 0.688 1.676
58 HB ILE 8 HB ILE 8 -2.459 -0.812 4.287
59 HG12 ILE 8 HG12 ILE 8 -1.224 -1.492 1.627
60 HG13 ILE 8 HG11 ILE 8 -0.348 -0.812 3.005
61 HG21 ILE 8 HG21 ILE 8 -3.847 -1.677 1.777
62 HG22 ILE 8 HG22 ILE 8 -4.530 -1.278 3.368
63 HG23 ILE 8 HG23 ILE 8 -3.508 -2.703 3.190
64 HD11 ILE 8 HD11 ILE 8 -0.882 -2.852 4.273
65 HD12 ILE 8 HD12 ILE 8 0.020 -3.189 2.794
66 HD13 ILE 8 HD13 ILE 8 -1.717 -3.491 2.855
67 H TYR 9 HN TYR 9 -4.342 1.378 1.056
68 HA TYR 9 HA TYR 9 -6.464 1.928 3.001
69 HB2 TYR 9 HB2 TYR 9 -6.204 2.619 0.081
70 HB3 TYR 9 HB1 TYR 9 -7.600 2.991 1.075
71 HD1 TYR 9 HD2 TYR 9 -6.564 4.129 3.467
72 HD2 TYR 9 HD1 TYR 9 -5.099 4.484 -0.497
73 HE1 TYR 9 HE2 TYR 9 -5.565 6.281 4.043
74 HE2 TYR 9 HE1 TYR 9 -4.101 6.627 0.059
75 HH TYR 9 HH TYR 9 -4.582 8.445 1.777
76 H THR 10 HN THR 10 -7.769 0.267 3.325
77 HA THR 10 HA THR 10 -8.980 -1.013 1.104
78 HB THR 10 HB THR 10 -6.804 -2.273 1.290
79 HG1 THR 10 HG1 THR 10 -8.970 -3.955 2.059
80 HG21 THR 10 HG21 THR 10 -7.901 -3.141 3.974
81 HG22 THR 10 HG22 THR 10 -6.484 -2.126 3.720
82 HG23 THR 10 HG23 THR 10 -6.469 -3.811 3.188
83 H THR 11 HN THR 11 -10.531 -2.610 1.897
84 HA THR 11 HA THR 11 -11.305 -2.287 4.675
85 HB THR 11 HB THR 11 -13.543 -3.108 3.543
86 HG1 THR 11 HG1 THR 11 -13.641 -1.858 1.487
87 HG21 THR 11 HG21 THR 11 -14.261 -0.754 3.402
88 HG22 THR 11 HG22 THR 11 -12.566 -0.257 3.479
89 HG23 THR 11 HG23 THR 11 -13.311 -1.073 4.854
90 H SER 12 HN SER 12 -12.337 -4.333 5.468
91 HA SER 12 HA SER 12 -10.816 -6.569 4.637
92 HB2 SER 12 HB2 SER 12 -13.057 -6.311 6.638
93 HB3 SER 12 HB1 SER 12 -12.024 -7.730 6.464
94 HG SER 12 HG SER 12 -10.556 -5.485 6.620
95 H TRP 13 HN TRP 13 -13.682 -5.255 3.467
96 HA TRP 13 HA TRP 13 -14.640 -7.798 2.523
97 HB2 TRP 13 HB2 TRP 13 -16.392 -6.449 1.266
98 HB3 TRP 13 HB1 TRP 13 -16.482 -6.437 3.010
99 HD1 TRP 13 HD1 TRP 13 -16.400 -4.152 4.179
100 HE1 TRP 13 HE1 TRP 13 -16.349 -1.755 3.427
101 HE3 TRP 13 HE3 TRP 13 -15.360 -4.954 -0.752
102 HZ2 TRP 13 HZ2 TRP 13 -15.930 -0.312 0.965
103 HZ3 TRP 13 HZ3 TRP 13 -15.161 -3.009 -2.249
104 HH2 TRP 13 HH2 TRP 13 -15.443 -0.736 -1.406
105 H CYS 14 HN CYS 14 -12.240 -5.843 1.501
106 HA CYS 14 HA CYS 14 -12.622 -6.257 -1.323
107 HB2 CYS 14 HB2 CYS 14 -10.177 -5.383 0.261
108 HB3 CYS 14 HB1 CYS 14 -10.273 -5.409 -1.494
109 HG CYS 14 HG CYS 14 -12.231 -3.393 0.520
110 H GLY 15 HN GLY 15 -11.514 -7.834 -2.591
111 HA2 GLY 15 HA2 GLY 15 -11.242 -10.345 -1.295
112 HA3 GLY 15 HA1 GLY 15 -10.892 -10.004 -2.982
113 H TYR 16 HN TYR 16 -8.899 -8.121 -2.636
114 HA TYR 16 HA TYR 16 -6.731 -9.919 -2.058
115 HB2 TYR 16 HB2 TYR 16 -6.695 -7.137 -3.170
116 HB3 TYR 16 HB1 TYR 16 -5.244 -8.070 -2.852
117 HD1 TYR 16 HD2 TYR 16 -5.211 -10.458 -3.965
118 HD2 TYR 16 HD1 TYR 16 -7.617 -7.211 -5.267
119 HE1 TYR 16 HE2 TYR 16 -5.365 -11.473 -6.209
120 HE2 TYR 16 HE1 TYR 16 -7.774 -8.208 -7.500
121 HH TYR 16 HH TYR 16 -6.882 -11.376 -8.141
122 H CYS 17 HN CYS 17 -8.382 -7.937 -0.009
123 HA CYS 17 HA CYS 17 -6.497 -6.292 1.176
124 HB2 CYS 17 HB2 CYS 17 -7.900 -6.299 3.211
125 HB3 CYS 17 HB1 CYS 17 -8.839 -6.083 1.744
126 HG CYS 17 HG CYS 17 -10.210 -8.338 1.840
127 H LEU 18 HN LEU 18 -7.416 -9.458 2.546
128 HA LEU 18 HA LEU 18 -5.261 -9.421 4.370
129 HB2 LEU 18 HB2 LEU 18 -5.880 -11.692 5.019
130 HB3 LEU 18 HB1 LEU 18 -7.262 -10.638 4.958
131 HG LEU 18 HG LEU 18 -7.957 -12.746 4.256
132 HD11 LEU 18 HD11 LEU 18 -8.774 -12.526 1.995
133 HD12 LEU 18 HD12 LEU 18 -7.700 -11.151 1.751
134 HD13 LEU 18 HD13 LEU 18 -8.990 -11.062 2.955
135 HD21 LEU 18 HD21 LEU 18 -5.891 -13.849 3.760
136 HD22 LEU 18 HD22 LEU 18 -5.667 -12.871 2.313
137 HD23 LEU 18 HD23 LEU 18 -6.983 -14.042 2.386
138 H ARG 19 HN ARG 19 -5.601 -10.583 1.212
139 HA ARG 19 HA ARG 19 -3.479 -12.391 0.977
140 HB2 ARG 19 HB2 ARG 19 -5.177 -12.182 -0.739
141 HB3 ARG 19 HB1 ARG 19 -4.744 -10.506 -1.017
142 HG2 ARG 19 HG2 ARG 19 -3.926 -11.911 -2.801
143 HG3 ARG 19 HG1 ARG 19 -2.580 -11.213 -1.900
144 HD2 ARG 19 HD2 ARG 19 -2.363 -13.307 -0.654
145 HD3 ARG 19 HD1 ARG 19 -3.663 -14.013 -1.621
146 HE ARG 19 HE ARG 19 -2.061 -13.306 -3.531
147 HH11 ARG 19 HH11 ARG 19 -1.208 -14.804 -0.418
148 HH12 ARG 19 HH12 ARG 19 0.182 -15.577 -0.997
149 HH21 ARG 19 HH21 ARG 19 -0.101 -14.360 -4.334
150 HH22 ARG 19 HH22 ARG 19 0.848 -15.295 -3.278
151 H LEU 20 HN LEU 20 -3.660 -8.926 0.471
152 HA LEU 20 HA LEU 20 -0.958 -8.602 -0.248
153 HB2 LEU 20 HB2 LEU 20 -2.676 -7.085 -0.986
154 HB3 LEU 20 HB1 LEU 20 -3.055 -6.653 0.663
155 HG LEU 20 HG LEU 20 -0.885 -5.575 0.886
156 HD11 LEU 20 HD11 LEU 20 -0.545 -6.271 -2.039
157 HD12 LEU 20 HD12 LEU 20 0.461 -6.839 -0.703
158 HD13 LEU 20 HD13 LEU 20 0.472 -5.140 -1.157
159 HD21 LEU 20 HD21 LEU 20 -2.820 -4.293 0.213
160 HD22 LEU 20 HD22 LEU 20 -2.483 -4.656 -1.486
161 HD23 LEU 20 HD23 LEU 20 -1.346 -3.686 -0.544
162 H LYS 21 HN LYS 21 -2.693 -8.422 2.801
163 HA LYS 21 HA LYS 21 -0.710 -7.145 4.383
164 HB2 LYS 21 HB2 LYS 21 -2.514 -9.335 5.356
165 HB3 LYS 21 HB1 LYS 21 -1.878 -8.062 6.350
166 HG2 LYS 21 HG2 LYS 21 -4.001 -7.939 4.218
167 HG3 LYS 21 HG1 LYS 21 -4.252 -7.697 5.947
168 HD2 LYS 21 HD2 LYS 21 -2.660 -5.854 4.154
169 HD3 LYS 21 HD1 LYS 21 -4.391 -5.690 4.387
170 HE2 LYS 21 HE2 LYS 21 -2.186 -5.281 6.392
171 HE3 LYS 21 HE1 LYS 21 -3.380 -4.170 5.786
172 HZ1 LYS 21 HZ1 LYS 21 -3.972 -6.469 7.573
173 HZ2 LYS 21 HZ2 LYS 21 -5.147 -5.471 6.896
174 HZ3 LYS 21 HZ3 LYS 21 -4.023 -4.835 7.963
175 H THR 22 HN THR 22 -1.433 -10.549 3.760
176 HA THR 22 HA THR 22 0.672 -11.646 5.231
177 HB THR 22 HB THR 22 -0.768 -12.805 2.832
178 HG1 THR 22 HG1 THR 22 -2.389 -13.169 4.133
179 HG21 THR 22 HG21 THR 22 0.629 -14.143 5.164
180 HG22 THR 22 HG22 THR 22 1.241 -14.069 3.511
181 HG23 THR 22 HG23 THR 22 -0.230 -14.974 3.865
182 H ALA 23 HN ALA 23 0.383 -10.755 1.790
183 HA ALA 23 HA ALA 23 2.782 -11.819 0.869
184 HB1 ALA 23 HB1 ALA 23 2.587 -10.271 -1.006
185 HB2 ALA 23 HB2 ALA 23 1.395 -9.325 -0.114
186 HB3 ALA 23 HB3 ALA 23 1.015 -10.973 -0.615
187 H LEU 24 HN LEU 24 2.148 -8.591 2.191
188 HA LEU 24 HA LEU 24 4.877 -7.734 1.901
189 HB2 LEU 24 HB2 LEU 24 2.734 -6.647 3.690
190 HB3 LEU 24 HB1 LEU 24 4.235 -5.838 3.315
191 HG LEU 24 HG LEU 24 1.927 -6.337 1.431
192 HD11 LEU 24 HD11 LEU 24 1.783 -3.886 1.407
193 HD12 LEU 24 HD12 LEU 24 3.119 -3.819 2.547
194 HD13 LEU 24 HD13 LEU 24 1.591 -4.541 3.041
195 HD21 LEU 24 HD21 LEU 24 3.941 -6.496 0.088
196 HD22 LEU 24 HD22 LEU 24 4.607 -5.063 0.875
197 HD23 LEU 24 HD23 LEU 24 3.197 -4.923 -0.162
198 H THR 25 HN THR 25 3.065 -9.163 4.518
199 HA THR 25 HA THR 25 5.078 -8.807 6.451
200 HB THR 25 HB THR 25 2.864 -10.863 6.295
201 HG1 THR 25 HG1 THR 25 1.913 -8.921 6.462
202 HG21 THR 25 HG21 THR 25 3.159 -11.098 8.727
203 HG22 THR 25 HG22 THR 25 4.534 -9.997 8.666
204 HG23 THR 25 HG23 THR 25 4.624 -11.566 7.864
205 H ALA 26 HN ALA 26 4.340 -11.496 4.245
206 HA ALA 26 HA ALA 26 6.309 -13.281 5.121
207 HB1 ALA 26 HB1 ALA 26 5.124 -13.002 2.358
208 HB2 ALA 26 HB2 ALA 26 4.419 -13.919 3.685
209 HB3 ALA 26 HB3 ALA 26 5.956 -14.424 2.990
210 H ASN 27 HN ASN 27 6.431 -10.617 2.865
211 HA ASN 27 HA ASN 27 9.178 -11.262 2.147
212 HB2 ASN 27 HB2 ASN 27 7.263 -9.201 1.094
213 HB3 ASN 27 HB1 ASN 27 8.975 -9.170 0.689
214 HD21 ASN 27 HD21 ASN 27 5.959 -10.820 0.246
215 HD22 ASN 27 HD22 ASN 27 6.505 -11.830 -1.047
216 H ARG 28 HN ARG 28 7.930 -9.980 4.709
217 HA ARG 28 HA ARG 28 8.556 -8.617 6.360
218 HB2 ARG 28 HB2 ARG 28 11.319 -8.987 5.190
219 HB3 ARG 28 HB1 ARG 28 10.961 -8.433 6.822
220 HG2 ARG 28 HG2 ARG 28 9.860 -10.569 7.294
221 HG3 ARG 28 HG1 ARG 28 10.264 -11.121 5.671
222 HD2 ARG 28 HD2 ARG 28 12.649 -10.875 6.208
223 HD3 ARG 28 HD1 ARG 28 12.212 -10.363 7.841
224 HE ARG 28 HE ARG 28 11.241 -12.921 6.868
225 HH11 ARG 28 HH11 ARG 28 13.576 -11.232 8.957
226 HH12 ARG 28 HH12 ARG 28 13.816 -12.567 9.975
227 HH21 ARG 28 HH21 ARG 28 11.650 -14.754 8.226
228 HH22 ARG 28 HH22 ARG 28 12.722 -14.618 9.540
229 H ILE 29 HN ILE 29 7.337 -7.076 4.945
230 HA ILE 29 HA ILE 29 9.016 -4.760 4.285
231 HB ILE 29 HB ILE 29 6.301 -5.555 3.194
232 HG12 ILE 29 HG12 ILE 29 8.985 -5.429 1.821
233 HG13 ILE 29 HG11 ILE 29 8.244 -6.908 2.417
234 HG21 ILE 29 HG21 ILE 29 6.565 -3.642 1.660
235 HG22 ILE 29 HG22 ILE 29 8.069 -3.205 2.469
236 HG23 ILE 29 HG23 ILE 29 6.543 -3.109 3.343
237 HD11 ILE 29 HD11 ILE 29 7.157 -5.110 0.269
238 HD12 ILE 29 HD12 ILE 29 6.405 -6.594 0.869
239 HD13 ILE 29 HD13 ILE 29 7.964 -6.666 0.048
240 H ALA 30 HN ALA 30 8.637 -2.951 5.378
241 HA ALA 30 HA ALA 30 6.775 -2.916 7.549
242 HB1 ALA 30 HB1 ALA 30 8.976 -1.856 7.730
243 HB2 ALA 30 HB2 ALA 30 7.689 -0.668 7.955
244 HB3 ALA 30 HB3 ALA 30 8.554 -0.756 6.417
245 H TYR 31 HN TYR 31 4.722 -2.164 7.437
246 HA TYR 31 HA TYR 31 3.995 -0.273 5.345
247 HB2 TYR 31 HB2 TYR 31 2.064 -1.580 4.625
248 HB3 TYR 31 HB1 TYR 31 3.549 -2.465 4.321
249 HD1 TYR 31 HD2 TYR 31 4.083 -4.473 5.729
250 HD2 TYR 31 HD1 TYR 31 0.365 -2.431 6.070
251 HE1 TYR 31 HE2 TYR 31 3.108 -6.438 6.851
252 HE2 TYR 31 HE1 TYR 31 -0.617 -4.403 7.175
253 HH TYR 31 HH TYR 31 1.278 -7.015 8.300
254 H ASP 32 HN ASP 32 1.954 0.638 5.616
255 HA ASP 32 HA ASP 32 1.141 0.779 8.423
256 HB2 ASP 32 HB2 ASP 32 1.421 2.910 6.309
257 HB3 ASP 32 HB1 ASP 32 0.641 3.211 7.873
258 H GLU 33 HN GLU 33 -1.155 0.823 8.671
259 HA GLU 33 HA GLU 33 -2.720 0.745 6.175
260 HB2 GLU 33 HB2 GLU 33 -3.991 -1.179 6.948
261 HB3 GLU 33 HB1 GLU 33 -2.292 -1.573 6.763
262 HG2 GLU 33 HG2 GLU 33 -1.974 -1.463 9.160
263 HG3 GLU 33 HG1 GLU 33 -3.652 -0.966 9.382
264 H VAL 34 HN VAL 34 -4.672 1.697 6.258
265 HA VAL 34 HA VAL 34 -5.901 2.179 8.819
266 HB VAL 34 HB VAL 34 -4.630 4.282 8.176
267 HG11 VAL 34 HG11 VAL 34 -5.398 5.692 6.377
268 HG12 VAL 34 HG12 VAL 34 -6.544 4.456 5.888
269 HG13 VAL 34 HG13 VAL 34 -4.801 4.145 5.766
270 HG21 VAL 34 HG21 VAL 34 -7.621 4.539 8.232
271 HG22 VAL 34 HG22 VAL 34 -6.492 5.866 8.459
272 HG23 VAL 34 HG23 VAL 34 -6.529 4.535 9.622
273 H ASP 35 HN ASP 35 -8.261 2.145 8.583
274 HA ASP 35 HA ASP 35 -8.901 0.925 6.018
275 HB2 ASP 35 HB2 ASP 35 -10.797 -0.087 6.938
276 HB3 ASP 35 HB1 ASP 35 -9.654 -0.113 8.272
277 H ILE 36 HN ILE 36 -10.425 1.548 4.711
278 HA ILE 36 HA ILE 36 -10.871 4.394 4.589
279 HB ILE 36 HB ILE 36 -11.720 3.931 2.333
280 HG12 ILE 36 HG12 ILE 36 -11.084 1.059 3.031
281 HG13 ILE 36 HG11 ILE 36 -12.710 1.721 2.866
282 HG21 ILE 36 HG21 ILE 36 -9.566 3.064 1.474
283 HG22 ILE 36 HG22 ILE 36 -9.119 2.630 3.122
284 HG23 ILE 36 HG23 ILE 36 -9.364 4.323 2.691
285 HD11 ILE 36 HD11 ILE 36 -10.644 1.476 0.696
286 HD12 ILE 36 HD12 ILE 36 -12.281 2.132 0.507
287 HD13 ILE 36 HD13 ILE 36 -12.045 0.433 0.947
288 H GLU 37 HN GLU 37 -12.629 2.012 6.087
289 HA GLU 37 HA GLU 37 -15.130 2.880 4.949
290 HB2 GLU 37 HB2 GLU 37 -14.647 0.476 5.350
291 HB3 GLU 37 HB1 GLU 37 -14.636 0.800 7.072
292 HG2 GLU 37 HG2 GLU 37 -16.929 1.207 7.124
293 HG3 GLU 37 HG1 GLU 37 -17.016 1.432 5.376
294 H HIS 38 HN HIS 38 -13.345 2.942 7.929
295 HA HIS 38 HA HIS 38 -15.251 4.580 9.306
296 HB2 HIS 38 HB2 HIS 38 -13.725 3.152 10.569
297 HB3 HIS 38 HB1 HIS 38 -12.339 3.968 9.865
298 HD1 HIS 38 HD1 HIS 38 -11.278 5.496 11.568
299 HD2 HIS 38 HD2 HIS 38 -15.418 5.292 11.969
300 HE1 HIS 38 HE1 HIS 38 -11.879 7.032 13.459
301 H ASN 39 HN ASN 39 -12.477 5.126 7.271
302 HA ASN 39 HA ASN 39 -12.605 8.032 7.746
303 HB2 ASN 39 HB2 ASN 39 -10.483 6.405 6.348
304 HB3 ASN 39 HB1 ASN 39 -10.459 8.152 6.520
305 HD21 ASN 39 HD21 ASN 39 -9.905 5.118 7.998
306 HD22 ASN 39 HD22 ASN 39 -9.273 5.742 9.471
307 H ARG 40 HN ARG 40 -14.163 8.845 6.399
308 HA ARG 40 HA ARG 40 -14.575 7.778 3.823
309 HB2 ARG 40 HB2 ARG 40 -16.399 9.029 4.863
310 HB3 ARG 40 HB1 ARG 40 -15.435 10.509 4.816
311 HG2 ARG 40 HG2 ARG 40 -15.343 10.381 2.377
312 HG3 ARG 40 HG1 ARG 40 -16.306 8.916 2.419
313 HD2 ARG 40 HD2 ARG 40 -18.178 10.142 3.289
314 HD3 ARG 40 HD1 ARG 40 -17.206 11.624 3.373
315 HE ARG 40 HE ARG 40 -16.897 11.106 0.850
316 HH11 ARG 40 HH11 ARG 40 -19.931 10.815 2.644
317 HH12 ARG 40 HH12 ARG 40 -20.899 11.060 1.262
318 HH21 ARG 40 HH21 ARG 40 -18.138 11.394 -0.928
319 HH22 ARG 40 HH22 ARG 40 -19.864 11.380 -0.872
320 H ALA 41 HN ALA 41 -12.507 10.414 4.951
321 HA ALA 41 HA ALA 41 -11.946 11.484 2.413
322 HB1 ALA 41 HB1 ALA 41 -10.116 11.422 4.811
323 HB2 ALA 41 HB2 ALA 41 -11.348 12.649 4.495
324 HB3 ALA 41 HB3 ALA 41 -9.965 12.474 3.406
325 H ALA 42 HN ALA 42 -10.658 8.728 4.087
326 HA ALA 42 HA ALA 42 -8.550 8.338 2.200
327 HB1 ALA 42 HB1 ALA 42 -9.670 6.320 4.177
328 HB2 ALA 42 HB2 ALA 42 -8.382 7.467 4.514
329 HB3 ALA 42 HB3 ALA 42 -8.154 6.234 3.267
330 H ALA 43 HN ALA 43 -11.806 7.052 2.667
331 HA ALA 43 HA ALA 43 -11.793 5.122 0.600
332 HB1 ALA 43 HB1 ALA 43 -14.205 5.143 0.803
333 HB2 ALA 43 HB2 ALA 43 -14.136 6.667 1.685
334 HB3 ALA 43 HB3 ALA 43 -13.474 5.202 2.409
335 H GLU 44 HN GLU 44 -12.806 8.475 0.698
336 HA GLU 44 HA GLU 44 -13.893 8.727 -1.844
337 HB2 GLU 44 HB2 GLU 44 -13.879 10.347 0.194
338 HB3 GLU 44 HB1 GLU 44 -12.363 10.927 -0.467
339 HG2 GLU 44 HG2 GLU 44 -14.096 12.388 -1.190
340 HG3 GLU 44 HG1 GLU 44 -13.556 11.453 -2.586
341 H PHE 45 HN PHE 45 -10.667 9.009 -0.618
342 HA PHE 45 HA PHE 45 -9.367 9.887 -2.962
343 HB2 PHE 45 HB2 PHE 45 -8.457 10.270 -0.729
344 HB3 PHE 45 HB1 PHE 45 -8.364 8.541 -0.460
345 HD1 PHE 45 HD2 PHE 45 -7.056 11.223 -2.659
346 HD2 PHE 45 HD1 PHE 45 -6.436 7.380 -0.935
347 HE1 PHE 45 HE2 PHE 45 -4.761 11.202 -3.545
348 HE2 PHE 45 HE1 PHE 45 -4.144 7.360 -1.825
349 HZ PHE 45 HZ PHE 45 -3.305 9.271 -3.125
350 H VAL 46 HN VAL 46 -9.283 6.708 -1.315
351 HA VAL 46 HA VAL 46 -7.823 5.361 -3.308
352 HB VAL 46 HB VAL 46 -7.915 4.436 -1.059
353 HG11 VAL 46 HG11 VAL 46 -9.913 3.231 -0.373
354 HG12 VAL 46 HG12 VAL 46 -10.806 4.095 -1.652
355 HG13 VAL 46 HG13 VAL 46 -10.013 4.995 -0.324
356 HG21 VAL 46 HG21 VAL 46 -7.639 2.911 -2.983
357 HG22 VAL 46 HG22 VAL 46 -9.365 2.507 -2.790
358 HG23 VAL 46 HG23 VAL 46 -8.220 2.170 -1.487
359 H GLY 47 HN GLY 47 -11.292 5.779 -3.046
360 HA2 GLY 47 HA2 GLY 47 -11.933 3.872 -4.995
361 HA3 GLY 47 HA1 GLY 47 -12.961 5.227 -4.526
362 H SER 48 HN SER 48 -10.740 7.078 -5.272
363 HA SER 48 HA SER 48 -11.586 7.413 -8.010
364 HB2 SER 48 HB2 SER 48 -9.729 9.098 -6.335
365 HB3 SER 48 HB1 SER 48 -10.527 9.572 -7.836
366 HG SER 48 HG SER 48 -11.594 9.263 -5.254
367 H VAL 49 HN VAL 49 -8.813 6.261 -6.292
368 HA VAL 49 HA VAL 49 -7.152 6.356 -8.709
369 HB VAL 49 HB VAL 49 -5.234 5.867 -7.195
370 HG11 VAL 49 HG11 VAL 49 -6.933 8.187 -6.338
371 HG12 VAL 49 HG12 VAL 49 -5.818 8.176 -7.712
372 HG13 VAL 49 HG13 VAL 49 -5.197 8.032 -6.058
373 HG21 VAL 49 HG21 VAL 49 -7.255 6.197 -5.003
374 HG22 VAL 49 HG22 VAL 49 -5.518 5.947 -4.781
375 HG23 VAL 49 HG23 VAL 49 -6.529 4.663 -5.467
376 H ASN 50 HN ASN 50 -9.325 4.463 -7.739
377 HA ASN 50 HA ASN 50 -7.904 1.969 -7.522
378 HB2 ASN 50 HB2 ASN 50 -10.477 2.890 -6.788
379 HB3 ASN 50 HB1 ASN 50 -10.716 1.591 -7.955
380 HD21 ASN 50 HD21 ASN 50 -8.109 1.918 -5.630
381 HD22 ASN 50 HD22 ASN 50 -8.516 0.497 -4.748
382 H GLY 51 HN GLY 51 -8.623 0.143 -8.977
383 HA2 GLY 51 HA2 GLY 51 -8.408 0.970 -11.729
384 HA3 GLY 51 HA1 GLY 51 -8.426 -0.682 -11.119
385 H GLY 52 HN GLY 52 -10.365 2.028 -12.047
386 HA2 GLY 52 HA2 GLY 52 -12.463 2.035 -13.014
387 HA3 GLY 52 HA1 GLY 52 -12.567 0.298 -12.746
388 H ASN 53 HN ASN 53 -13.499 -0.460 -10.969
389 HA ASN 53 HA ASN 53 -15.172 1.345 -9.438
390 HB2 ASN 53 HB2 ASN 53 -16.089 -0.783 -10.297
391 HB3 ASN 53 HB1 ASN 53 -14.907 -1.668 -9.348
392 HD21 ASN 53 HD21 ASN 53 -16.404 -2.742 -8.204
393 HD22 ASN 53 HD22 ASN 53 -17.427 -2.036 -7.004
394 H ARG 54 HN ARG 54 -15.049 1.550 -7.205
395 HA ARG 54 HA ARG 54 -12.526 1.064 -5.978
396 HB2 ARG 54 HB2 ARG 54 -13.477 2.076 -3.919
397 HB3 ARG 54 HB1 ARG 54 -13.781 3.064 -5.328
398 HG2 ARG 54 HG2 ARG 54 -15.830 1.315 -3.956
399 HG3 ARG 54 HG1 ARG 54 -15.649 3.050 -3.725
400 HD2 ARG 54 HD2 ARG 54 -16.558 1.572 -6.194
401 HD3 ARG 54 HD1 ARG 54 -17.455 2.724 -5.223
402 HE ARG 54 HE ARG 54 -15.378 4.214 -6.068
403 HH11 ARG 54 HH11 ARG 54 -17.658 2.186 -7.906
404 HH12 ARG 54 HH12 ARG 54 -17.665 3.204 -9.267
405 HH21 ARG 54 HH21 ARG 54 -15.331 5.558 -7.990
406 HH22 ARG 54 HH22 ARG 54 -16.298 5.160 -9.324
407 H THR 55 HN THR 55 -11.937 -0.848 -5.600
408 HA THR 55 HA THR 55 -13.551 -2.719 -4.060
409 HB THR 55 HB THR 55 -14.434 -2.967 -6.336
410 HG1 THR 55 HG1 THR 55 -13.060 -5.006 -5.057
411 HG21 THR 55 HG21 THR 55 -11.609 -3.707 -7.118
412 HG22 THR 55 HG22 THR 55 -12.390 -2.207 -7.511
413 HG23 THR 55 HG23 THR 55 -13.014 -3.722 -8.195
414 H VAL 56 HN VAL 56 -10.480 -1.538 -5.063
415 HA VAL 56 HA VAL 56 -9.222 -3.930 -4.004
416 HB VAL 56 HB VAL 56 -7.244 -3.441 -5.557
417 HG11 VAL 56 HG11 VAL 56 -8.233 -4.707 -7.427
418 HG12 VAL 56 HG12 VAL 56 -9.832 -4.452 -6.730
419 HG13 VAL 56 HG13 VAL 56 -8.626 -5.392 -5.856
420 HG21 VAL 56 HG21 VAL 56 -9.376 -1.945 -7.062
421 HG22 VAL 56 HG22 VAL 56 -7.789 -2.377 -7.700
422 HG23 VAL 56 HG23 VAL 56 -7.922 -1.253 -6.345
423 HA PRO 57 HA PRO 57 -6.993 -1.412 -1.150
424 HB2 PRO 57 HB2 PRO 57 -4.625 -2.879 -1.156
425 HB3 PRO 57 HB1 PRO 57 -6.041 -3.285 -0.190
426 HG2 PRO 57 HG2 PRO 57 -5.184 -4.381 -2.829
427 HG3 PRO 57 HG1 PRO 57 -5.858 -5.231 -1.424
428 HD2 PRO 57 HD2 PRO 57 -7.365 -4.669 -3.546
429 HD3 PRO 57 HD1 PRO 57 -8.030 -4.531 -1.901
430 H THR 58 HN THR 58 -5.682 0.322 -1.321
431 HA THR 58 HA THR 58 -3.857 0.470 -3.614
432 HB THR 58 HB THR 58 -5.474 2.798 -2.525
433 HG1 THR 58 HG1 THR 58 -6.448 0.851 -3.763
434 HG21 THR 58 HG21 THR 58 -3.917 2.461 -5.101
435 HG22 THR 58 HG22 THR 58 -3.411 3.441 -3.703
436 HG23 THR 58 HG23 THR 58 -4.854 3.872 -4.624
437 H VAL 59 HN VAL 59 -1.856 1.345 -3.097
438 HA VAL 59 HA VAL 59 -1.449 1.908 -0.252
439 HB VAL 59 HB VAL 59 0.968 1.520 -0.670
440 HG11 VAL 59 HG11 VAL 59 0.842 -0.895 -1.088
441 HG12 VAL 59 HG12 VAL 59 -0.863 -0.682 -1.538
442 HG13 VAL 59 HG13 VAL 59 -0.316 -0.326 0.114
443 HG21 VAL 59 HG21 VAL 59 0.072 0.713 -3.417
444 HG22 VAL 59 HG22 VAL 59 1.704 0.502 -2.760
445 HG23 VAL 59 HG23 VAL 59 1.053 2.126 -3.018
446 H LYS 60 HN LYS 60 -0.844 3.842 0.400
447 HA LYS 60 HA LYS 60 -0.024 5.781 -1.657
448 HB2 LYS 60 HB2 LYS 60 -2.092 6.388 -0.222
449 HB3 LYS 60 HB1 LYS 60 -0.983 6.461 1.133
450 HG2 LYS 60 HG2 LYS 60 0.291 8.209 0.014
451 HG3 LYS 60 HG1 LYS 60 -0.789 8.118 -1.363
452 HD2 LYS 60 HD2 LYS 60 -1.572 9.972 -0.170
453 HD3 LYS 60 HD1 LYS 60 -2.666 8.678 0.305
454 HE2 LYS 60 HE2 LYS 60 -0.266 9.552 1.902
455 HE3 LYS 60 HE1 LYS 60 -1.901 10.171 2.159
456 HZ1 LYS 60 HZ1 LYS 60 -2.546 7.850 2.720
457 HZ2 LYS 60 HZ2 LYS 60 -1.427 8.530 3.742
458 HZ3 LYS 60 HZ3 LYS 60 -0.893 7.411 2.631
459 H PHE 61 HN PHE 61 2.062 5.982 -1.687
460 HA PHE 61 HA PHE 61 3.692 5.141 0.539
461 HB2 PHE 61 HB2 PHE 61 4.479 6.420 -2.075
462 HB3 PHE 61 HB1 PHE 61 5.578 5.739 -0.890
463 HD1 PHE 61 HD2 PHE 61 3.078 5.003 -3.430
464 HD2 PHE 61 HD1 PHE 61 5.935 3.337 -0.746
465 HE1 PHE 61 HE2 PHE 61 2.927 2.876 -4.596
466 HE2 PHE 61 HE1 PHE 61 5.793 1.199 -1.922
467 HZ PHE 61 HZ PHE 61 4.288 0.958 -3.860
468 H ALA 62 HN ALA 62 5.325 6.498 1.455
469 HA ALA 62 HA ALA 62 4.289 8.870 2.496
470 HB1 ALA 62 HB1 ALA 62 5.911 7.438 3.645
471 HB2 ALA 62 HB2 ALA 62 6.411 9.127 3.592
472 HB3 ALA 62 HB3 ALA 62 7.156 7.955 2.503
473 H ASP 63 HN ASP 63 5.814 8.399 -0.512
474 HA ASP 63 HA ASP 63 6.882 11.089 -0.660
475 HB2 ASP 63 HB2 ASP 63 7.699 10.526 -2.858
476 HB3 ASP 63 HB1 ASP 63 8.047 9.166 -1.806
477 H GLY 64 HN GLY 64 3.929 9.572 -1.107
478 HA2 GLY 64 HA2 GLY 64 1.971 10.913 -1.390
479 HA3 GLY 64 HA1 GLY 64 2.908 12.008 -2.389
480 H SER 65 HN SER 65 3.411 8.698 -3.074
481 HA SER 65 HA SER 65 1.718 9.021 -5.447
482 HB2 SER 65 HB2 SER 65 3.130 7.242 -6.439
483 HB3 SER 65 HB1 SER 65 4.069 8.650 -5.942
484 HG SER 65 HG SER 65 4.679 7.530 -4.066
485 H THR 66 HN THR 66 0.478 7.154 -6.196
486 HA THR 66 HA THR 66 -0.030 5.175 -4.114
487 HB THR 66 HB THR 66 -2.387 5.096 -5.157
488 HG1 THR 66 HG1 THR 66 -1.514 7.649 -5.963
489 HG21 THR 66 HG21 THR 66 -2.022 5.747 -2.861
490 HG22 THR 66 HG22 THR 66 -3.245 6.768 -3.598
491 HG23 THR 66 HG23 THR 66 -1.602 7.392 -3.358
492 H LEU 67 HN LEU 67 -0.271 3.139 -4.819
493 HA LEU 67 HA LEU 67 -0.459 2.700 -7.704
494 HB2 LEU 67 HB2 LEU 67 1.227 1.054 -5.780
495 HB3 LEU 67 HB1 LEU 67 0.859 0.593 -7.417
496 HG LEU 67 HG LEU 67 2.562 2.940 -6.577
497 HD11 LEU 67 HD11 LEU 67 4.396 1.637 -7.515
498 HD12 LEU 67 HD12 LEU 67 3.281 0.340 -7.923
499 HD13 LEU 67 HD13 LEU 67 3.604 0.711 -6.235
500 HD21 LEU 67 HD21 LEU 67 3.096 3.119 -8.967
501 HD22 LEU 67 HD22 LEU 67 1.400 3.449 -8.647
502 HD23 LEU 67 HD23 LEU 67 1.884 1.889 -9.329
503 H THR 68 HN THR 68 -2.163 1.549 -8.227
504 HA THR 68 HA THR 68 -3.978 0.564 -6.330
505 HB THR 68 HB THR 68 -3.746 -0.228 -9.248
506 HG1 THR 68 HG1 THR 68 -5.000 2.178 -8.267
507 HG21 THR 68 HG21 THR 68 -5.530 -1.305 -7.926
508 HG22 THR 68 HG22 THR 68 -6.204 -0.211 -9.133
509 HG23 THR 68 HG23 THR 68 -6.121 0.284 -7.442
510 H ASN 69 HN ASN 69 -4.374 -1.655 -5.765
511 HA ASN 69 HA ASN 69 -2.875 -3.210 -4.601
512 HB2 ASN 69 HB2 ASN 69 -3.827 -5.362 -5.412
513 HB3 ASN 69 HB1 ASN 69 -5.012 -4.130 -5.046
514 HD21 ASN 69 HD21 ASN 69 -5.166 -6.537 -6.756
515 HD22 ASN 69 HD22 ASN 69 -5.630 -5.983 -8.320
516 HA PRO 70 HA PRO 70 0.710 -4.168 -7.147
517 HB2 PRO 70 HB2 PRO 70 2.454 -3.051 -5.385
518 HB3 PRO 70 HB1 PRO 70 1.677 -2.156 -6.691
519 HG2 PRO 70 HG2 PRO 70 1.285 -1.859 -3.844
520 HG3 PRO 70 HG1 PRO 70 0.566 -0.915 -5.159
521 HD2 PRO 70 HD2 PRO 70 -0.561 -3.144 -3.599
522 HD3 PRO 70 HD1 PRO 70 -1.375 -1.883 -4.552
523 H SER 71 HN SER 71 2.391 -5.614 -6.790
524 HA SER 71 HA SER 71 1.960 -7.474 -4.671
525 HB2 SER 71 HB2 SER 71 3.948 -8.555 -5.877
526 HB3 SER 71 HB1 SER 71 2.461 -8.370 -6.820
527 HG SER 71 HG SER 71 4.787 -7.505 -7.538
528 H ALA 72 HN ALA 72 3.970 -8.212 -3.473
529 HA ALA 72 HA ALA 72 5.029 -6.115 -1.944
530 HB1 ALA 72 HB1 ALA 72 6.074 -8.936 -2.247
531 HB2 ALA 72 HB2 ALA 72 4.809 -8.416 -1.132
532 HB3 ALA 72 HB3 ALA 72 6.456 -7.817 -0.940
533 H ASP 73 HN ASP 73 6.285 -7.823 -4.693
534 HA ASP 73 HA ASP 73 8.830 -6.566 -4.676
535 HB2 ASP 73 HB2 ASP 73 9.014 -7.413 -7.052
536 HB3 ASP 73 HB1 ASP 73 8.745 -8.635 -5.818
537 H GLU 74 HN GLU 74 5.755 -5.538 -5.931
538 HA GLU 74 HA GLU 74 6.907 -3.498 -7.609
539 HB2 GLU 74 HB2 GLU 74 4.075 -4.029 -6.737
540 HB3 GLU 74 HB1 GLU 74 4.512 -2.594 -7.649
541 HG2 GLU 74 HG2 GLU 74 4.873 -5.445 -8.541
542 HG3 GLU 74 HG1 GLU 74 3.614 -4.337 -9.080
543 H VAL 75 HN VAL 75 5.370 -3.570 -4.434
544 HA VAL 75 HA VAL 75 5.527 -0.788 -4.086
545 HB VAL 75 HB VAL 75 5.259 -1.292 -1.560
546 HG11 VAL 75 HG11 VAL 75 2.924 -1.937 -1.845
547 HG12 VAL 75 HG12 VAL 75 3.273 -2.473 -3.482
548 HG13 VAL 75 HG13 VAL 75 3.380 -0.756 -3.079
549 HG21 VAL 75 HG21 VAL 75 4.780 -4.018 -2.672
550 HG22 VAL 75 HG22 VAL 75 4.566 -3.524 -0.989
551 HG23 VAL 75 HG23 VAL 75 6.192 -3.590 -1.703
552 H LYS 76 HN LYS 76 7.800 -3.325 -3.203
553 HA LYS 76 HA LYS 76 9.560 -1.769 -1.701
554 HB2 LYS 76 HB2 LYS 76 10.018 -4.230 -3.354
555 HB3 LYS 76 HB1 LYS 76 11.338 -3.443 -2.493
556 HG2 LYS 76 HG2 LYS 76 10.161 -3.797 -0.382
557 HG3 LYS 76 HG1 LYS 76 8.822 -4.542 -1.251
558 HD2 LYS 76 HD2 LYS 76 10.250 -6.261 -0.283
559 HD3 LYS 76 HD1 LYS 76 10.335 -6.320 -2.039
560 HE2 LYS 76 HE2 LYS 76 12.555 -6.614 -1.072
561 HE3 LYS 76 HE1 LYS 76 12.479 -5.097 -1.961
562 HZ1 LYS 76 HZ1 LYS 76 12.246 -5.353 0.992
563 HZ2 LYS 76 HZ2 LYS 76 12.299 -3.906 0.139
564 HZ3 LYS 76 HZ3 LYS 76 13.628 -4.918 0.167
565 H ALA 77 HN ALA 77 9.232 -2.070 -5.145
566 HA ALA 77 HA ALA 77 11.682 -1.020 -5.965
567 HB1 ALA 77 HB1 ALA 77 9.030 -0.831 -7.376
568 HB2 ALA 77 HB2 ALA 77 10.144 -2.193 -7.459
569 HB3 ALA 77 HB3 ALA 77 10.615 -0.627 -8.121
570 H LYS 78 HN LYS 78 8.692 0.656 -5.098
571 HA LYS 78 HA LYS 78 9.998 3.188 -5.603
572 HB2 LYS 78 HB2 LYS 78 7.260 2.633 -4.486
573 HB3 LYS 78 HB1 LYS 78 7.919 4.251 -4.666
574 HG2 LYS 78 HG2 LYS 78 8.237 3.718 -7.110
575 HG3 LYS 78 HG1 LYS 78 7.298 2.261 -6.817
576 HD2 LYS 78 HD2 LYS 78 5.711 3.752 -7.601
577 HD3 LYS 78 HD1 LYS 78 5.543 3.844 -5.846
578 HE2 LYS 78 HE2 LYS 78 7.134 5.822 -7.508
579 HE3 LYS 78 HE1 LYS 78 5.460 6.071 -7.038
580 HZ1 LYS 78 HZ1 LYS 78 6.928 7.263 -5.563
581 HZ2 LYS 78 HZ2 LYS 78 7.815 5.909 -5.208
582 HZ3 LYS 78 HZ3 LYS 78 6.175 6.041 -4.718
583 H LEU 79 HN LEU 79 8.941 1.281 -2.893
584 HA LEU 79 HA LEU 79 9.259 3.036 -0.796
585 HB2 LEU 79 HB2 LEU 79 8.098 0.943 -0.603
586 HB3 LEU 79 HB1 LEU 79 9.577 0.057 -0.911
587 HG LEU 79 HG LEU 79 10.475 0.773 1.203
588 HD11 LEU 79 HD11 LEU 79 7.796 2.118 1.626
589 HD12 LEU 79 HD12 LEU 79 9.357 2.926 1.455
590 HD13 LEU 79 HD13 LEU 79 9.040 1.915 2.859
591 HD21 LEU 79 HD21 LEU 79 8.978 -0.524 2.661
592 HD22 LEU 79 HD22 LEU 79 9.259 -1.305 1.106
593 HD23 LEU 79 HD23 LEU 79 7.739 -0.464 1.408
594 H VAL 80 HN VAL 80 11.721 0.960 -2.277
595 HA VAL 80 HA VAL 80 13.758 1.281 -0.413
596 HB VAL 80 HB VAL 80 13.881 -0.369 -2.232
597 HG11 VAL 80 HG11 VAL 80 14.488 0.241 -4.523
598 HG12 VAL 80 HG12 VAL 80 14.321 1.944 -4.098
599 HG13 VAL 80 HG13 VAL 80 12.911 0.882 -4.053
600 HG21 VAL 80 HG21 VAL 80 16.233 -0.107 -2.892
601 HG22 VAL 80 HG22 VAL 80 15.982 0.253 -1.185
602 HG23 VAL 80 HG23 VAL 80 16.190 1.566 -2.340
603 H LYS 81 HN LYS 81 12.797 3.417 -3.013
604 HA LYS 81 HA LYS 81 15.081 5.157 -2.771
605 HB2 LYS 81 HB2 LYS 81 12.467 5.515 -4.218
606 HB3 LYS 81 HB1 LYS 81 13.846 6.591 -4.335
607 HG2 LYS 81 HG2 LYS 81 15.160 4.749 -5.285
608 HG3 LYS 81 HG1 LYS 81 13.723 3.720 -5.219
609 HD2 LYS 81 HD2 LYS 81 12.543 5.294 -6.695
610 HD3 LYS 81 HD1 LYS 81 13.982 6.303 -6.752
611 HE2 LYS 81 HE2 LYS 81 13.805 3.456 -7.709
612 HE3 LYS 81 HE1 LYS 81 13.785 4.892 -8.732
613 HZ1 LYS 81 HZ1 LYS 81 16.026 4.053 -6.975
614 HZ2 LYS 81 HZ2 LYS 81 16.003 5.432 -7.946
615 HZ3 LYS 81 HZ3 LYS 81 15.969 3.909 -8.651
616 H ILE 82 HN ILE 82 11.872 4.979 -1.545
617 HA ILE 82 HA ILE 82 11.633 7.724 -0.774
618 HB ILE 82 HB ILE 82 10.036 5.326 0.126
619 HG12 ILE 82 HG12 ILE 82 9.476 7.303 -2.108
620 HG13 ILE 82 HG11 ILE 82 9.996 5.630 -2.308
621 HG21 ILE 82 HG21 ILE 82 8.283 6.975 0.697
622 HG22 ILE 82 HG22 ILE 82 9.384 8.283 0.266
623 HG23 ILE 82 HG23 ILE 82 9.758 7.233 1.634
624 HD11 ILE 82 HD11 ILE 82 7.942 4.863 -1.302
625 HD12 ILE 82 HD12 ILE 82 7.636 5.896 -2.703
626 HD13 ILE 82 HD13 ILE 82 7.440 6.538 -1.069
627 H ALA 83 HN ALA 83 12.081 4.700 1.021
628 HA ALA 83 HA ALA 83 12.418 6.167 3.469
629 HB1 ALA 83 HB1 ALA 83 12.660 4.020 4.536
630 HB2 ALA 83 HB2 ALA 83 12.785 3.233 2.964
631 HB3 ALA 83 HB3 ALA 83 11.269 4.028 3.450
632 H GLY 84 HN GLY 84 14.483 4.506 1.188
633 HA2 GLY 84 HA2 GLY 84 16.704 4.545 0.914
634 HA3 GLY 84 HA1 GLY 84 16.904 5.747 2.250
635 H LEU 85 HN LEU 85 16.466 2.652 1.098
636 HA LEU 85 HA LEU 85 17.791 1.517 3.392
637 HB2 LEU 85 HB2 LEU 85 15.524 1.002 3.726
638 HB3 LEU 85 HB1 LEU 85 15.248 0.735 2.012
639 HG LEU 85 HG LEU 85 16.805 -1.003 2.129
640 HD11 LEU 85 HD11 LEU 85 17.087 -2.222 4.392
641 HD12 LEU 85 HD12 LEU 85 16.383 -0.792 5.144
642 HD13 LEU 85 HD13 LEU 85 17.913 -0.668 4.275
643 HD21 LEU 85 HD21 LEU 85 14.215 -1.359 3.612
644 HD22 LEU 85 HD22 LEU 85 15.161 -2.717 2.997
645 HD23 LEU 85 HD23 LEU 85 14.510 -1.520 1.882
646 H GLU 86 HN GLU 86 19.529 0.505 2.654
647 HA GLU 86 HA GLU 86 21.040 -0.487 1.391
648 HB2 GLU 86 HB2 GLU 86 18.649 -1.622 -0.045
649 HB3 GLU 86 HB1 GLU 86 20.301 -2.169 -0.307
650 HG2 GLU 86 HG2 GLU 86 18.736 -2.323 2.262
651 HG3 GLU 86 HG1 GLU 86 19.157 -3.668 1.200
652 H HIS 87 HN HIS 87 21.887 1.390 0.698
653 HA HIS 87 HA HIS 87 21.143 2.356 -1.977
654 HB2 HIS 87 HB2 HIS 87 23.137 3.532 -0.006
655 HB3 HIS 87 HB1 HIS 87 22.565 4.293 -1.479
656 HD1 HIS 87 HD1 HIS 87 20.427 5.790 -1.224
657 HD2 HIS 87 HD2 HIS 87 21.240 3.418 2.107
658 HE1 HIS 87 HE1 HIS 87 18.926 6.595 0.593
659 H HIS 88 HN HIS 88 22.834 2.416 -3.601
660 HA HIS 88 HA HIS 88 24.884 0.436 -2.999
661 HB2 HIS 88 HB2 HIS 88 23.886 1.476 -5.663
662 HB3 HIS 88 HB1 HIS 88 25.234 0.357 -5.493
663 HD1 HIS 88 HD1 HIS 88 24.631 -2.113 -4.716
664 HD2 HIS 88 HD2 HIS 88 21.364 0.381 -5.354
665 HE1 HIS 88 HE1 HIS 88 22.616 -3.615 -4.845
Start of MODEL 12
1 H1 MET 1 HT1 MET 1 14.591 7.445 9.487
2 H2 MET 1 HT2 MET 1 14.847 7.492 7.831
3 H3 MET 1 HT3 MET 1 15.726 6.405 8.786
4 HA MET 1 HA MET 1 13.938 5.320 7.562
5 HB2 MET 1 HB2 MET 1 14.597 4.351 9.704
6 HB3 MET 1 HB1 MET 1 13.568 5.472 10.574
7 HG2 MET 1 HG2 MET 1 12.606 3.218 10.453
8 HG3 MET 1 HG1 MET 1 11.595 4.419 9.652
9 HE1 MET 1 HE1 MET 1 10.236 2.456 8.468
10 HE2 MET 1 HE2 MET 1 11.263 1.269 9.269
11 HE3 MET 1 HE3 MET 1 10.999 1.172 7.529
12 H VAL 2 HN VAL 2 11.746 5.226 7.006
13 HA VAL 2 HA VAL 2 10.365 7.734 7.469
14 HB VAL 2 HB VAL 2 9.627 5.454 5.602
15 HG11 VAL 2 HG11 VAL 2 8.613 8.287 5.754
16 HG12 VAL 2 HG12 VAL 2 7.728 6.835 6.224
17 HG13 VAL 2 HG13 VAL 2 8.164 7.096 4.534
18 HG21 VAL 2 HG21 VAL 2 10.492 6.868 3.791
19 HG22 VAL 2 HG22 VAL 2 11.761 6.450 4.942
20 HG23 VAL 2 HG23 VAL 2 11.033 8.055 4.978
21 H THR 3 HN THR 3 8.748 7.830 8.915
22 HA THR 3 HA THR 3 8.179 5.511 10.448
23 HB THR 3 HB THR 3 8.377 7.748 11.506
24 HG1 THR 3 HG1 THR 3 7.012 5.980 12.356
25 HG21 THR 3 HG21 THR 3 6.523 9.367 11.368
26 HG22 THR 3 HG22 THR 3 5.728 8.344 10.175
27 HG23 THR 3 HG23 THR 3 7.266 9.112 9.789
28 H ALA 4 HN ALA 4 6.263 7.391 8.092
29 HA ALA 4 HA ALA 4 4.405 5.138 8.118
30 HB1 ALA 4 HB1 ALA 4 2.689 6.611 7.183
31 HB2 ALA 4 HB2 ALA 4 3.825 7.951 7.153
32 HB3 ALA 4 HB3 ALA 4 3.295 7.282 8.699
33 H ALA 5 HN ALA 5 5.855 4.034 6.922
34 HA ALA 5 HA ALA 5 7.090 4.819 4.551
35 HB1 ALA 5 HB1 ALA 5 7.456 2.415 4.214
36 HB2 ALA 5 HB2 ALA 5 6.320 2.065 5.515
37 HB3 ALA 5 HB3 ALA 5 7.822 2.919 5.863
38 H LEU 6 HN LEU 6 4.298 2.647 4.904
39 HA LEU 6 HA LEU 6 3.064 3.845 2.628
40 HB2 LEU 6 HB2 LEU 6 2.635 1.741 1.464
41 HB3 LEU 6 HB1 LEU 6 4.345 2.085 1.510
42 HG LEU 6 HG LEU 6 3.009 0.094 3.370
43 HD11 LEU 6 HD11 LEU 6 3.891 -1.630 1.888
44 HD12 LEU 6 HD12 LEU 6 4.405 -0.361 0.770
45 HD13 LEU 6 HD13 LEU 6 2.680 -0.618 1.091
46 HD21 LEU 6 HD21 LEU 6 5.190 0.934 4.096
47 HD22 LEU 6 HD22 LEU 6 5.880 0.478 2.540
48 HD23 LEU 6 HD23 LEU 6 5.272 -0.766 3.634
49 H THR 7 HN THR 7 1.014 3.946 2.802
50 HA THR 7 HA THR 7 -0.192 2.507 5.030
51 HB THR 7 HB THR 7 -1.011 5.147 3.789
52 HG1 THR 7 HG1 THR 7 0.623 4.380 5.915
53 HG21 THR 7 HG21 THR 7 -2.875 3.863 4.791
54 HG22 THR 7 HG22 THR 7 -2.508 5.311 5.726
55 HG23 THR 7 HG23 THR 7 -1.959 3.730 6.293
56 H ILE 8 HN ILE 8 -1.576 1.070 4.491
57 HA ILE 8 HA ILE 8 -2.521 0.828 1.764
58 HB ILE 8 HB ILE 8 -2.678 -1.024 4.151
59 HG12 ILE 8 HG12 ILE 8 -1.137 -1.304 1.580
60 HG13 ILE 8 HG11 ILE 8 -0.439 -0.725 3.094
61 HG21 ILE 8 HG21 ILE 8 -4.591 -1.371 2.949
62 HG22 ILE 8 HG22 ILE 8 -3.489 -2.713 2.550
63 HG23 ILE 8 HG23 ILE 8 -3.757 -1.393 1.394
64 HD11 ILE 8 HD11 ILE 8 -0.952 -2.858 4.139
65 HD12 ILE 8 HD12 ILE 8 0.046 -3.060 2.693
66 HD13 ILE 8 HD13 ILE 8 -1.678 -3.421 2.632
67 H TYR 9 HN TYR 9 -4.431 1.536 1.210
68 HA TYR 9 HA TYR 9 -6.512 1.946 3.244
69 HB2 TYR 9 HB2 TYR 9 -6.262 2.981 0.438
70 HB3 TYR 9 HB1 TYR 9 -7.594 3.361 1.524
71 HD1 TYR 9 HD2 TYR 9 -6.308 4.105 3.977
72 HD2 TYR 9 HD1 TYR 9 -5.105 4.825 -0.001
73 HE1 TYR 9 HE2 TYR 9 -5.038 6.051 4.762
74 HE2 TYR 9 HE1 TYR 9 -3.769 6.816 0.755
75 HH TYR 9 HH TYR 9 -3.833 8.403 2.667
76 H THR 10 HN THR 10 -7.999 0.416 3.335
77 HA THR 10 HA THR 10 -9.117 -0.709 0.978
78 HB THR 10 HB THR 10 -7.029 -2.045 1.120
79 HG1 THR 10 HG1 THR 10 -9.137 -3.745 1.949
80 HG21 THR 10 HG21 THR 10 -8.044 -2.881 3.835
81 HG22 THR 10 HG22 THR 10 -6.643 -1.862 3.535
82 HG23 THR 10 HG23 THR 10 -6.633 -3.553 3.016
83 H THR 11 HN THR 11 -10.865 -2.181 1.551
84 HA THR 11 HA THR 11 -11.792 -1.943 4.307
85 HB THR 11 HB THR 11 -13.894 -2.908 2.797
86 HG1 THR 11 HG1 THR 11 -12.987 -2.485 0.818
87 HG21 THR 11 HG21 THR 11 -14.063 -1.177 4.520
88 HG22 THR 11 HG22 THR 11 -14.843 -0.636 3.031
89 HG23 THR 11 HG23 THR 11 -13.241 -0.035 3.465
90 H SER 12 HN SER 12 -12.987 -3.934 5.048
91 HA SER 12 HA SER 12 -11.235 -6.131 4.756
92 HB2 SER 12 HB2 SER 12 -13.868 -5.870 6.181
93 HB3 SER 12 HB1 SER 12 -12.750 -7.230 6.375
94 HG SER 12 HG SER 12 -11.896 -4.564 6.748
95 H TRP 13 HN TRP 13 -14.099 -5.248 3.078
96 HA TRP 13 HA TRP 13 -14.657 -7.953 2.252
97 HB2 TRP 13 HB2 TRP 13 -16.408 -6.902 0.772
98 HB3 TRP 13 HB1 TRP 13 -16.606 -6.620 2.493
99 HD1 TRP 13 HD1 TRP 13 -16.488 -4.167 3.337
100 HE1 TRP 13 HE1 TRP 13 -16.520 -1.904 2.181
101 HE3 TRP 13 HE3 TRP 13 -15.529 -5.708 -1.439
102 HZ2 TRP 13 HZ2 TRP 13 -16.177 -0.867 -0.437
103 HZ3 TRP 13 HZ3 TRP 13 -15.398 -4.010 -3.215
104 HH2 TRP 13 HH2 TRP 13 -15.717 -1.640 -2.723
105 H CYS 14 HN CYS 14 -12.319 -5.903 1.386
106 HA CYS 14 HA CYS 14 -12.347 -6.354 -1.449
107 HB2 CYS 14 HB2 CYS 14 -10.204 -5.281 0.394
108 HB3 CYS 14 HB1 CYS 14 -10.155 -5.231 -1.366
109 HG CYS 14 HG CYS 14 -11.830 -3.353 -1.763
110 H GLY 15 HN GLY 15 -11.580 -8.129 -2.408
111 HA2 GLY 15 HA2 GLY 15 -10.828 -10.394 -0.915
112 HA3 GLY 15 HA1 GLY 15 -10.756 -10.242 -2.659
113 H TYR 16 HN TYR 16 -8.885 -8.047 -2.665
114 HA TYR 16 HA TYR 16 -6.566 -9.683 -2.266
115 HB2 TYR 16 HB2 TYR 16 -6.790 -6.951 -3.471
116 HB3 TYR 16 HB1 TYR 16 -5.281 -7.830 -3.297
117 HD1 TYR 16 HD1 TYR 16 -5.960 -10.530 -4.106
118 HD2 TYR 16 HD2 TYR 16 -7.285 -6.831 -5.718
119 HE1 TYR 16 HE1 TYR 16 -6.380 -11.627 -6.262
120 HE2 TYR 16 HE2 TYR 16 -7.733 -7.917 -7.862
121 HH TYR 16 HH TYR 16 -7.761 -11.296 -8.196
122 H CYS 17 HN CYS 17 -8.167 -7.676 -0.242
123 HA CYS 17 HA CYS 17 -6.246 -6.082 0.971
124 HB2 CYS 17 HB2 CYS 17 -8.547 -5.829 1.578
125 HB3 CYS 17 HB1 CYS 17 -8.633 -7.476 2.189
126 HG CYS 17 HG CYS 17 -7.878 -6.942 4.617
127 H LEU 18 HN LEU 18 -7.223 -9.361 2.085
128 HA LEU 18 HA LEU 18 -5.094 -9.470 3.955
129 HB2 LEU 18 HB2 LEU 18 -5.737 -11.685 4.481
130 HB3 LEU 18 HB1 LEU 18 -7.207 -10.798 4.172
131 HG LEU 18 HG LEU 18 -5.921 -12.755 2.255
132 HD11 LEU 18 HD11 LEU 18 -6.749 -13.830 4.256
133 HD12 LEU 18 HD12 LEU 18 -7.754 -14.214 2.859
134 HD13 LEU 18 HD13 LEU 18 -8.313 -13.041 4.052
135 HD21 LEU 18 HD21 LEU 18 -8.649 -11.476 2.184
136 HD22 LEU 18 HD22 LEU 18 -7.992 -12.637 1.026
137 HD23 LEU 18 HD23 LEU 18 -7.288 -11.028 1.155
138 H ARG 19 HN ARG 19 -5.268 -10.149 0.631
139 HA ARG 19 HA ARG 19 -3.110 -12.007 0.421
140 HB2 ARG 19 HB2 ARG 19 -4.083 -10.036 -1.665
141 HB3 ARG 19 HB1 ARG 19 -3.138 -11.486 -1.966
142 HG2 ARG 19 HG2 ARG 19 -5.971 -11.391 -0.944
143 HG3 ARG 19 HG1 ARG 19 -5.467 -11.798 -2.584
144 HD2 ARG 19 HD2 ARG 19 -4.329 -13.761 -1.785
145 HD3 ARG 19 HD1 ARG 19 -4.695 -13.331 -0.113
146 HE ARG 19 HE ARG 19 -7.106 -13.420 -1.391
147 HH11 ARG 19 HH11 ARG 19 -4.484 -15.752 -0.933
148 HH12 ARG 19 HH12 ARG 19 -5.516 -17.095 -0.850
149 HH21 ARG 19 HH21 ARG 19 -8.510 -15.257 -1.270
150 HH22 ARG 19 HH22 ARG 19 -7.867 -16.818 -1.035
151 H LEU 20 HN LEU 20 -3.434 -8.528 -0.031
152 HA LEU 20 HA LEU 20 -0.735 -7.975 -0.471
153 HB2 LEU 20 HB2 LEU 20 -2.471 -6.432 -1.108
154 HB3 LEU 20 HB1 LEU 20 -3.010 -6.277 0.544
155 HG LEU 20 HG LEU 20 -1.019 -5.033 1.124
156 HD11 LEU 20 HD11 LEU 20 0.595 -4.338 -0.596
157 HD12 LEU 20 HD12 LEU 20 -0.207 -5.379 -1.770
158 HD13 LEU 20 HD13 LEU 20 0.607 -6.083 -0.370
159 HD21 LEU 20 HD21 LEU 20 -1.419 -3.032 -0.227
160 HD22 LEU 20 HD22 LEU 20 -2.923 -3.807 0.266
161 HD23 LEU 20 HD23 LEU 20 -2.329 -4.002 -1.384
162 H LYS 21 HN LYS 21 -2.658 -8.095 2.484
163 HA LYS 21 HA LYS 21 -0.748 -7.107 4.309
164 HB2 LYS 21 HB2 LYS 21 -2.765 -9.288 4.868
165 HB3 LYS 21 HB1 LYS 21 -1.951 -8.300 6.062
166 HG2 LYS 21 HG2 LYS 21 -4.023 -7.419 4.066
167 HG3 LYS 21 HG1 LYS 21 -4.222 -7.575 5.810
168 HD2 LYS 21 HD2 LYS 21 -2.496 -5.780 6.078
169 HD3 LYS 21 HD1 LYS 21 -2.507 -5.596 4.324
170 HE2 LYS 21 HE2 LYS 21 -3.961 -3.944 5.352
171 HE3 LYS 21 HE1 LYS 21 -4.911 -5.093 4.390
172 HZ1 LYS 21 HZ1 LYS 21 -4.553 -5.118 7.326
173 HZ2 LYS 21 HZ2 LYS 21 -5.497 -6.233 6.477
174 HZ3 LYS 21 HZ3 LYS 21 -5.947 -4.623 6.524
175 H THR 22 HN THR 22 -1.451 -10.465 3.359
176 HA THR 22 HA THR 22 0.572 -11.515 4.981
177 HB THR 22 HB THR 22 0.200 -13.637 3.566
178 HG1 THR 22 HG1 THR 22 -2.102 -12.238 2.716
179 HG21 THR 22 HG21 THR 22 -0.821 -13.260 5.774
180 HG22 THR 22 HG22 THR 22 -1.931 -14.089 4.688
181 HG23 THR 22 HG23 THR 22 -2.132 -12.366 5.004
182 H ALA 23 HN ALA 23 0.532 -10.455 1.668
183 HA ALA 23 HA ALA 23 2.984 -11.576 0.876
184 HB1 ALA 23 HB1 ALA 23 2.932 -9.922 -0.936
185 HB2 ALA 23 HB2 ALA 23 1.633 -9.057 -0.105
186 HB3 ALA 23 HB3 ALA 23 1.357 -10.683 -0.716
187 H LEU 24 HN LEU 24 2.167 -8.448 2.336
188 HA LEU 24 HA LEU 24 4.872 -7.511 2.281
189 HB2 LEU 24 HB2 LEU 24 2.609 -6.513 3.995
190 HB3 LEU 24 HB1 LEU 24 4.111 -5.684 3.710
191 HG LEU 24 HG LEU 24 1.846 -6.114 1.777
192 HD11 LEU 24 HD11 LEU 24 1.487 -4.380 3.384
193 HD12 LEU 24 HD12 LEU 24 1.827 -3.647 1.797
194 HD13 LEU 24 HD13 LEU 24 3.069 -3.693 3.040
195 HD21 LEU 24 HD21 LEU 24 4.529 -4.832 1.259
196 HD22 LEU 24 HD22 LEU 24 3.119 -4.721 0.216
197 HD23 LEU 24 HD23 LEU 24 3.885 -6.276 0.457
198 H THR 25 HN THR 25 2.891 -9.036 4.767
199 HA THR 25 HA THR 25 4.777 -8.658 6.804
200 HB THR 25 HB THR 25 2.284 -9.321 7.076
201 HG1 THR 25 HG1 THR 25 3.499 -9.238 8.887
202 HG21 THR 25 HG21 THR 25 3.421 -12.110 6.837
203 HG22 THR 25 HG22 THR 25 2.427 -11.338 5.623
204 HG23 THR 25 HG23 THR 25 1.747 -11.687 7.222
205 H ALA 26 HN ALA 26 4.560 -11.051 4.266
206 HA ALA 26 HA ALA 26 6.426 -12.899 5.404
207 HB1 ALA 26 HB1 ALA 26 4.744 -13.617 3.782
208 HB2 ALA 26 HB2 ALA 26 6.376 -13.970 3.209
209 HB3 ALA 26 HB3 ALA 26 5.491 -12.594 2.556
210 H ASN 27 HN ASN 27 6.617 -10.110 3.351
211 HA ASN 27 HA ASN 27 9.397 -10.669 2.712
212 HB2 ASN 27 HB2 ASN 27 7.423 -8.718 1.611
213 HB3 ASN 27 HB1 ASN 27 9.148 -8.429 1.404
214 HD21 ASN 27 HD21 ASN 27 6.492 -10.583 0.643
215 HD22 ASN 27 HD22 ASN 27 7.307 -11.399 -0.635
216 H ARG 28 HN ARG 28 8.131 -9.674 5.296
217 HA ARG 28 HA ARG 28 8.847 -8.591 7.166
218 HB2 ARG 28 HB2 ARG 28 11.478 -8.077 5.760
219 HB3 ARG 28 HB1 ARG 28 11.195 -8.228 7.484
220 HG2 ARG 28 HG2 ARG 28 11.109 -10.429 5.429
221 HG3 ARG 28 HG1 ARG 28 12.330 -10.171 6.668
222 HD2 ARG 28 HD2 ARG 28 10.724 -10.673 8.398
223 HD3 ARG 28 HD1 ARG 28 9.429 -10.798 7.202
224 HE ARG 28 HE ARG 28 11.656 -12.521 6.711
225 HH11 ARG 28 HH11 ARG 28 8.561 -12.286 8.447
226 HH12 ARG 28 HH12 ARG 28 8.281 -13.962 8.469
227 HH21 ARG 28 HH21 ARG 28 11.261 -14.818 6.736
228 HH22 ARG 28 HH22 ARG 28 9.876 -15.439 7.507
229 H ILE 29 HN ILE 29 7.490 -7.117 5.155
230 HA ILE 29 HA ILE 29 8.807 -4.552 4.942
231 HB ILE 29 HB ILE 29 6.116 -5.495 3.924
232 HG12 ILE 29 HG12 ILE 29 8.701 -5.037 2.414
233 HG13 ILE 29 HG11 ILE 29 8.117 -6.621 2.926
234 HG21 ILE 29 HG21 ILE 29 7.648 -2.976 3.276
235 HG22 ILE 29 HG22 ILE 29 6.219 -3.046 4.288
236 HG23 ILE 29 HG23 ILE 29 6.101 -3.448 2.564
237 HD11 ILE 29 HD11 ILE 29 7.700 -6.241 0.623
238 HD12 ILE 29 HD12 ILE 29 6.853 -4.731 0.969
239 HD13 ILE 29 HD13 ILE 29 6.165 -6.278 1.482
240 H ALA 30 HN ALA 30 8.360 -2.845 6.147
241 HA ALA 30 HA ALA 30 6.447 -3.032 8.327
242 HB1 ALA 30 HB1 ALA 30 7.486 -0.907 9.016
243 HB2 ALA 30 HB2 ALA 30 8.445 -0.945 7.528
244 HB3 ALA 30 HB3 ALA 30 8.682 -2.189 8.759
245 H TYR 31 HN TYR 31 4.461 -2.138 8.122
246 HA TYR 31 HA TYR 31 4.064 0.029 6.237
247 HB2 TYR 31 HB2 TYR 31 2.165 -1.119 5.134
248 HB3 TYR 31 HB1 TYR 31 3.700 -1.926 4.841
249 HD1 TYR 31 HD1 TYR 31 4.188 -4.056 5.937
250 HD2 TYR 31 HD2 TYR 31 0.395 -2.214 6.338
251 HE1 TYR 31 HE1 TYR 31 3.248 -6.193 6.739
252 HE2 TYR 31 HE2 TYR 31 -0.569 -4.337 7.142
253 HH TYR 31 HH TYR 31 1.414 -6.948 8.055
254 H ASP 32 HN ASP 32 1.656 0.642 6.258
255 HA ASP 32 HA ASP 32 0.514 0.307 8.929
256 HB2 ASP 32 HB2 ASP 32 1.580 2.561 8.677
257 HB3 ASP 32 HB1 ASP 32 0.549 2.851 7.280
258 H GLU 33 HN GLU 33 -1.722 0.095 8.902
259 HA GLU 33 HA GLU 33 -3.061 0.069 6.277
260 HB2 GLU 33 HB2 GLU 33 -4.325 -1.952 7.199
261 HB3 GLU 33 HB1 GLU 33 -2.684 -2.232 6.642
262 HG2 GLU 33 HG2 GLU 33 -1.861 -2.467 8.815
263 HG3 GLU 33 HG1 GLU 33 -3.263 -1.678 9.522
264 H VAL 34 HN VAL 34 -4.865 1.231 6.274
265 HA VAL 34 HA VAL 34 -6.327 1.427 8.742
266 HB VAL 34 HB VAL 34 -4.868 3.433 8.680
267 HG11 VAL 34 HG11 VAL 34 -4.630 3.732 6.309
268 HG12 VAL 34 HG12 VAL 34 -5.176 5.204 7.108
269 HG13 VAL 34 HG13 VAL 34 -6.326 4.232 6.197
270 HG21 VAL 34 HG21 VAL 34 -6.967 3.634 9.842
271 HG22 VAL 34 HG22 VAL 34 -7.778 4.042 8.320
272 HG23 VAL 34 HG23 VAL 34 -6.588 5.147 9.001
273 H ASP 35 HN ASP 35 -8.436 1.403 8.498
274 HA ASP 35 HA ASP 35 -9.535 0.381 6.098
275 HB2 ASP 35 HB2 ASP 35 -10.510 -0.399 8.039
276 HB3 ASP 35 HB1 ASP 35 -10.575 1.198 8.765
277 H ILE 36 HN ILE 36 -10.814 1.233 4.562
278 HA ILE 36 HA ILE 36 -10.870 4.115 4.339
279 HB ILE 36 HB ILE 36 -11.835 3.845 2.093
280 HG12 ILE 36 HG12 ILE 36 -11.468 0.878 2.552
281 HG13 ILE 36 HG11 ILE 36 -13.017 1.722 2.477
282 HG21 ILE 36 HG21 ILE 36 -9.479 4.045 2.369
283 HG22 ILE 36 HG22 ILE 36 -9.839 2.929 1.049
284 HG23 ILE 36 HG23 ILE 36 -9.326 2.306 2.618
285 HD11 ILE 36 HD11 ILE 36 -11.026 1.498 0.232
286 HD12 ILE 36 HD12 ILE 36 -12.598 2.307 0.168
287 HD13 ILE 36 HD13 ILE 36 -12.513 0.562 0.407
288 H GLU 37 HN GLU 37 -13.074 1.756 5.437
289 HA GLU 37 HA GLU 37 -15.422 3.069 4.577
290 HB2 GLU 37 HB2 GLU 37 -15.416 0.706 5.260
291 HB3 GLU 37 HB1 GLU 37 -14.998 1.181 6.895
292 HG2 GLU 37 HG2 GLU 37 -17.362 0.597 6.711
293 HG3 GLU 37 HG1 GLU 37 -17.157 2.296 7.132
294 H HIS 38 HN HIS 38 -13.579 3.110 7.592
295 HA HIS 38 HA HIS 38 -15.232 5.108 8.776
296 HB2 HIS 38 HB2 HIS 38 -13.752 3.534 10.068
297 HB3 HIS 38 HB1 HIS 38 -12.366 4.462 9.511
298 HD1 HIS 38 HD1 HIS 38 -11.749 6.518 10.949
299 HD2 HIS 38 HD2 HIS 38 -15.557 5.037 11.728
300 HE1 HIS 38 HE1 HIS 38 -12.600 7.783 12.930
301 H ASN 39 HN ASN 39 -12.320 5.231 6.810
302 HA ASN 39 HA ASN 39 -12.170 8.118 7.182
303 HB2 ASN 39 HB2 ASN 39 -10.319 6.279 5.656
304 HB3 ASN 39 HB1 ASN 39 -10.112 8.023 5.764
305 HD21 ASN 39 HD21 ASN 39 -9.795 4.994 7.354
306 HD22 ASN 39 HD22 ASN 39 -8.981 5.594 8.746
307 H ARG 40 HN ARG 40 -13.819 8.937 6.173
308 HA ARG 40 HA ARG 40 -14.974 8.222 3.746
309 HB2 ARG 40 HB2 ARG 40 -16.053 9.677 5.399
310 HB3 ARG 40 HB1 ARG 40 -14.878 10.934 5.072
311 HG2 ARG 40 HG2 ARG 40 -15.737 11.173 2.804
312 HG3 ARG 40 HG1 ARG 40 -16.886 9.866 3.096
313 HD2 ARG 40 HD2 ARG 40 -16.787 12.477 4.614
314 HD3 ARG 40 HD1 ARG 40 -17.927 12.092 3.326
315 HE ARG 40 HE ARG 40 -18.303 10.073 5.072
316 HH11 ARG 40 HH11 ARG 40 -18.400 13.600 5.479
317 HH12 ARG 40 HH12 ARG 40 -19.462 13.555 6.796
318 HH21 ARG 40 HH21 ARG 40 -19.748 10.014 6.846
319 HH22 ARG 40 HH22 ARG 40 -20.241 11.436 7.635
320 H ALA 41 HN ALA 41 -12.446 10.621 4.357
321 HA ALA 41 HA ALA 41 -12.282 11.470 1.618
322 HB1 ALA 41 HB1 ALA 41 -10.271 11.841 3.842
323 HB2 ALA 41 HB2 ALA 41 -11.618 12.926 3.502
324 HB3 ALA 41 HB3 ALA 41 -10.325 12.724 2.318
325 H ALA 42 HN ALA 42 -10.657 9.013 3.514
326 HA ALA 42 HA ALA 42 -8.580 8.539 1.626
327 HB1 ALA 42 HB1 ALA 42 -8.164 6.461 2.823
328 HB2 ALA 42 HB2 ALA 42 -9.712 6.604 3.644
329 HB3 ALA 42 HB3 ALA 42 -8.434 7.765 3.980
330 H ALA 43 HN ALA 43 -11.748 7.103 2.160
331 HA ALA 43 HA ALA 43 -11.598 5.149 0.121
332 HB1 ALA 43 HB1 ALA 43 -14.011 5.012 0.307
333 HB2 ALA 43 HB2 ALA 43 -14.060 6.556 1.149
334 HB3 ALA 43 HB3 ALA 43 -13.325 5.161 1.926
335 H GLU 44 HN GLU 44 -12.730 8.471 0.155
336 HA GLU 44 HA GLU 44 -13.609 8.552 -2.517
337 HB2 GLU 44 HB2 GLU 44 -14.357 10.173 -0.878
338 HB3 GLU 44 HB1 GLU 44 -12.714 10.740 -0.640
339 HG2 GLU 44 HG2 GLU 44 -12.634 11.674 -2.771
340 HG3 GLU 44 HG1 GLU 44 -14.189 10.959 -3.249
341 H PHE 45 HN PHE 45 -10.536 9.390 -0.993
342 HA PHE 45 HA PHE 45 -9.188 10.273 -3.279
343 HB2 PHE 45 HB2 PHE 45 -8.245 10.715 -1.096
344 HB3 PHE 45 HB1 PHE 45 -8.140 8.998 -0.739
345 HD1 PHE 45 HD1 PHE 45 -6.969 11.345 -3.400
346 HD2 PHE 45 HD2 PHE 45 -6.005 8.073 -0.848
347 HE1 PHE 45 HE1 PHE 45 -4.690 11.297 -4.292
348 HE2 PHE 45 HE2 PHE 45 -3.743 8.032 -1.740
349 HZ PHE 45 HZ PHE 45 -3.070 9.632 -3.465
350 H VAL 46 HN VAL 46 -9.222 7.009 -1.795
351 HA VAL 46 HA VAL 46 -7.649 6.053 -3.904
352 HB VAL 46 HB VAL 46 -7.904 3.829 -3.171
353 HG11 VAL 46 HG11 VAL 46 -7.208 3.983 -0.898
354 HG12 VAL 46 HG12 VAL 46 -7.710 5.669 -0.869
355 HG13 VAL 46 HG13 VAL 46 -6.406 5.139 -1.972
356 HG21 VAL 46 HG21 VAL 46 -10.133 4.779 -1.412
357 HG22 VAL 46 HG22 VAL 46 -9.250 3.257 -1.237
358 HG23 VAL 46 HG23 VAL 46 -10.167 3.570 -2.736
359 H GLY 47 HN GLY 47 -10.976 6.573 -3.668
360 HA2 GLY 47 HA2 GLY 47 -11.898 4.740 -5.595
361 HA3 GLY 47 HA1 GLY 47 -12.660 6.276 -5.201
362 H SER 48 HN SER 48 -10.094 7.673 -5.908
363 HA SER 48 HA SER 48 -10.737 8.026 -8.705
364 HB2 SER 48 HB2 SER 48 -8.636 9.391 -7.019
365 HB3 SER 48 HB1 SER 48 -9.256 9.932 -8.579
366 HG SER 48 HG SER 48 -10.955 9.565 -6.337
367 H VAL 49 HN VAL 49 -8.411 6.332 -6.806
368 HA VAL 49 HA VAL 49 -6.635 5.992 -9.131
369 HB VAL 49 HB VAL 49 -4.788 5.547 -7.533
370 HG11 VAL 49 HG11 VAL 49 -6.265 8.088 -6.943
371 HG12 VAL 49 HG12 VAL 49 -5.190 7.841 -8.324
372 HG13 VAL 49 HG13 VAL 49 -4.544 7.817 -6.671
373 HG21 VAL 49 HG21 VAL 49 -5.077 5.928 -5.156
374 HG22 VAL 49 HG22 VAL 49 -6.251 4.697 -5.681
375 HG23 VAL 49 HG23 VAL 49 -6.747 6.378 -5.458
376 H ASN 50 HN ASN 50 -9.035 4.521 -8.075
377 HA ASN 50 HA ASN 50 -7.922 2.113 -7.054
378 HB2 ASN 50 HB2 ASN 50 -10.184 3.397 -6.471
379 HB3 ASN 50 HB1 ASN 50 -10.804 2.157 -7.573
380 HD21 ASN 50 HD21 ASN 50 -8.744 2.652 -4.899
381 HD22 ASN 50 HD22 ASN 50 -8.929 1.124 -4.116
382 H GLY 51 HN GLY 51 -9.594 0.149 -8.053
383 HA2 GLY 51 HA2 GLY 51 -8.907 0.018 -10.877
384 HA3 GLY 51 HA1 GLY 51 -9.536 -1.302 -9.889
385 H GLY 52 HN GLY 52 -10.504 1.904 -11.009
386 HA2 GLY 52 HA2 GLY 52 -12.397 2.392 -12.323
387 HA3 GLY 52 HA1 GLY 52 -13.040 0.799 -11.939
388 H ASN 53 HN ASN 53 -13.607 0.440 -9.713
389 HA ASN 53 HA ASN 53 -14.836 2.807 -8.432
390 HB2 ASN 53 HB2 ASN 53 -15.623 -0.124 -8.446
391 HB3 ASN 53 HB1 ASN 53 -16.244 0.999 -7.250
392 HD21 ASN 53 HD21 ASN 53 -18.361 0.521 -8.010
393 HD22 ASN 53 HD22 ASN 53 -18.917 1.229 -9.486
394 H ARG 54 HN ARG 54 -14.790 2.687 -6.023
395 HA ARG 54 HA ARG 54 -12.222 1.796 -5.163
396 HB2 ARG 54 HB2 ARG 54 -12.705 2.682 -2.939
397 HB3 ARG 54 HB1 ARG 54 -13.248 3.841 -4.125
398 HG2 ARG 54 HG2 ARG 54 -15.054 1.950 -2.606
399 HG3 ARG 54 HG1 ARG 54 -14.737 3.616 -2.146
400 HD2 ARG 54 HD2 ARG 54 -15.750 4.363 -4.268
401 HD3 ARG 54 HD1 ARG 54 -16.063 2.683 -4.696
402 HE ARG 54 HE ARG 54 -17.231 2.874 -2.320
403 HH11 ARG 54 HH11 ARG 54 -17.531 5.025 -5.148
404 HH12 ARG 54 HH12 ARG 54 -19.170 5.362 -4.867
405 HH21 ARG 54 HH21 ARG 54 -19.489 3.414 -1.944
406 HH22 ARG 54 HH22 ARG 54 -20.302 4.431 -3.037
407 H THR 55 HN THR 55 -11.853 -0.250 -5.154
408 HA THR 55 HA THR 55 -13.491 -1.960 -3.471
409 HB THR 55 HB THR 55 -14.594 -2.045 -5.657
410 HG1 THR 55 HG1 THR 55 -13.353 -4.308 -4.578
411 HG21 THR 55 HG21 THR 55 -12.654 -1.521 -7.063
412 HG22 THR 55 HG22 THR 55 -13.452 -2.991 -7.626
413 HG23 THR 55 HG23 THR 55 -11.952 -3.090 -6.693
414 H VAL 56 HN VAL 56 -10.430 -1.246 -4.958
415 HA VAL 56 HA VAL 56 -9.408 -3.680 -3.745
416 HB VAL 56 HB VAL 56 -7.414 -3.461 -5.298
417 HG11 VAL 56 HG11 VAL 56 -10.116 -4.024 -6.550
418 HG12 VAL 56 HG12 VAL 56 -9.108 -5.182 -5.681
419 HG13 VAL 56 HG13 VAL 56 -8.569 -4.529 -7.222
420 HG21 VAL 56 HG21 VAL 56 -7.774 -2.276 -7.418
421 HG22 VAL 56 HG22 VAL 56 -7.732 -1.194 -6.027
422 HG23 VAL 56 HG23 VAL 56 -9.275 -1.615 -6.771
423 HA PRO 57 HA PRO 57 -6.956 -1.413 -0.898
424 HB2 PRO 57 HB2 PRO 57 -4.654 -2.987 -1.097
425 HB3 PRO 57 HB1 PRO 57 -6.004 -3.314 -0.014
426 HG2 PRO 57 HG2 PRO 57 -5.392 -4.478 -2.682
427 HG3 PRO 57 HG1 PRO 57 -6.092 -5.251 -1.251
428 HD2 PRO 57 HD2 PRO 57 -7.627 -4.545 -3.336
429 HD3 PRO 57 HD1 PRO 57 -8.207 -4.374 -1.657
430 H THR 58 HN THR 58 -5.930 0.387 -1.249
431 HA THR 58 HA THR 58 -4.031 0.560 -3.499
432 HB THR 58 HB THR 58 -5.496 2.811 -2.153
433 HG1 THR 58 HG1 THR 58 -6.625 1.025 -3.568
434 HG21 THR 58 HG21 THR 58 -4.872 4.105 -4.104
435 HG22 THR 58 HG22 THR 58 -4.112 2.693 -4.842
436 HG23 THR 58 HG23 THR 58 -3.433 3.404 -3.372
437 H VAL 59 HN VAL 59 -2.084 1.155 -3.066
438 HA VAL 59 HA VAL 59 -1.535 1.542 -0.257
439 HB VAL 59 HB VAL 59 -0.518 -0.429 -1.308
440 HG11 VAL 59 HG11 VAL 59 -0.243 0.317 -3.556
441 HG12 VAL 59 HG12 VAL 59 1.324 -0.190 -2.900
442 HG13 VAL 59 HG13 VAL 59 0.940 1.527 -3.047
443 HG21 VAL 59 HG21 VAL 59 0.517 0.540 0.540
444 HG22 VAL 59 HG22 VAL 59 1.347 1.716 -0.500
445 HG23 VAL 59 HG23 VAL 59 1.765 -0.015 -0.600
446 H LYS 60 HN LYS 60 -0.861 3.406 0.423
447 HA LYS 60 HA LYS 60 -0.091 5.443 -1.548
448 HB2 LYS 60 HB2 LYS 60 -2.237 5.572 -0.063
449 HB3 LYS 60 HB1 LYS 60 -1.130 5.940 1.238
450 HG2 LYS 60 HG2 LYS 60 -1.396 7.566 -1.296
451 HG3 LYS 60 HG1 LYS 60 -2.226 7.933 0.202
452 HD2 LYS 60 HD2 LYS 60 0.752 7.852 -0.172
453 HD3 LYS 60 HD1 LYS 60 -0.281 9.294 -0.185
454 HE2 LYS 60 HE2 LYS 60 -0.913 8.889 2.126
455 HE3 LYS 60 HE1 LYS 60 0.049 7.409 2.153
456 HZ1 LYS 60 HZ1 LYS 60 1.232 9.241 3.196
457 HZ2 LYS 60 HZ2 LYS 60 1.098 10.164 1.801
458 HZ3 LYS 60 HZ3 LYS 60 2.025 8.745 1.789
459 H PHE 61 HN PHE 61 2.035 5.668 -1.498
460 HA PHE 61 HA PHE 61 3.640 4.819 0.757
461 HB2 PHE 61 HB2 PHE 61 4.405 6.091 -1.856
462 HB3 PHE 61 HB1 PHE 61 5.550 5.539 -0.650
463 HD1 PHE 61 HD1 PHE 61 3.132 4.552 -3.196
464 HD2 PHE 61 HD2 PHE 61 6.014 3.171 -0.366
465 HE1 PHE 61 HE1 PHE 61 3.147 2.372 -4.275
466 HE2 PHE 61 HE2 PHE 61 6.026 0.984 -1.451
467 HZ PHE 61 HZ PHE 61 4.604 0.579 -3.414
468 H ALA 62 HN ALA 62 5.403 6.253 1.563
469 HA ALA 62 HA ALA 62 4.551 8.849 2.361
470 HB1 ALA 62 HB1 ALA 62 7.330 7.673 2.296
471 HB2 ALA 62 HB2 ALA 62 6.189 7.546 3.634
472 HB3 ALA 62 HB3 ALA 62 6.853 9.119 3.184
473 H ASP 63 HN ASP 63 5.915 7.597 -0.388
474 HA ASP 63 HA ASP 63 7.113 9.881 -1.610
475 HB2 ASP 63 HB2 ASP 63 7.735 7.698 -2.350
476 HB3 ASP 63 HB1 ASP 63 6.069 7.227 -2.594
477 H GLY 64 HN GLY 64 3.910 8.841 -1.051
478 HA2 GLY 64 HA2 GLY 64 1.991 10.119 -1.241
479 HA3 GLY 64 HA1 GLY 64 2.829 11.205 -2.337
480 H SER 65 HN SER 65 3.670 8.771 -3.923
481 HA SER 65 HA SER 65 1.497 8.790 -5.741
482 HB2 SER 65 HB2 SER 65 3.845 6.894 -5.699
483 HB3 SER 65 HB1 SER 65 2.880 7.404 -7.087
484 HG SER 65 HG SER 65 4.991 8.592 -5.872
485 H THR 66 HN THR 66 0.219 6.977 -6.367
486 HA THR 66 HA THR 66 -0.109 4.962 -4.274
487 HB THR 66 HB THR 66 -2.512 4.958 -5.276
488 HG1 THR 66 HG1 THR 66 -1.956 7.687 -5.740
489 HG21 THR 66 HG21 THR 66 -3.224 6.686 -3.658
490 HG22 THR 66 HG22 THR 66 -1.538 7.182 -3.466
491 HG23 THR 66 HG23 THR 66 -2.060 5.564 -2.974
492 H LEU 67 HN LEU 67 -0.367 2.882 -4.947
493 HA LEU 67 HA LEU 67 -0.572 2.414 -7.826
494 HB2 LEU 67 HB2 LEU 67 1.085 0.812 -5.849
495 HB3 LEU 67 HB1 LEU 67 0.686 0.253 -7.455
496 HG LEU 67 HG LEU 67 2.402 2.659 -6.810
497 HD11 LEU 67 HD11 LEU 67 3.443 0.470 -6.249
498 HD12 LEU 67 HD12 LEU 67 4.252 1.294 -7.574
499 HD13 LEU 67 HD13 LEU 67 3.164 -0.048 -7.912
500 HD21 LEU 67 HD21 LEU 67 1.736 1.322 -9.439
501 HD22 LEU 67 HD22 LEU 67 2.945 2.577 -9.207
502 HD23 LEU 67 HD23 LEU 67 1.247 2.948 -8.946
503 H THR 68 HN THR 68 -2.172 1.132 -8.417
504 HA THR 68 HA THR 68 -4.062 0.249 -6.501
505 HB THR 68 HB THR 68 -3.857 -0.525 -9.431
506 HG1 THR 68 HG1 THR 68 -5.201 1.780 -8.356
507 HG21 THR 68 HG21 THR 68 -5.575 -1.703 -8.108
508 HG22 THR 68 HG22 THR 68 -6.311 -0.606 -9.279
509 HG23 THR 68 HG23 THR 68 -6.227 -0.153 -7.580
510 H ASN 69 HN ASN 69 -4.442 -1.856 -5.798
511 HA ASN 69 HA ASN 69 -2.899 -3.317 -4.592
512 HB2 ASN 69 HB2 ASN 69 -5.075 -4.196 -4.771
513 HB3 ASN 69 HB1 ASN 69 -4.839 -4.649 -6.458
514 HD21 ASN 69 HD21 ASN 69 -4.114 -6.624 -6.891
515 HD22 ASN 69 HD22 ASN 69 -3.522 -7.782 -5.767
516 HA PRO 70 HA PRO 70 0.530 -4.886 -6.984
517 HB2 PRO 70 HB2 PRO 70 2.349 -3.559 -5.433
518 HB3 PRO 70 HB1 PRO 70 1.679 -2.908 -6.924
519 HG2 PRO 70 HG2 PRO 70 1.289 -1.922 -4.267
520 HG3 PRO 70 HG1 PRO 70 0.560 -1.318 -5.764
521 HD2 PRO 70 HD2 PRO 70 -0.596 -3.133 -3.704
522 HD3 PRO 70 HD1 PRO 70 -1.386 -2.022 -4.842
523 H SER 71 HN SER 71 1.900 -6.519 -6.325
524 HA SER 71 HA SER 71 1.435 -7.480 -3.657
525 HB2 SER 71 HB2 SER 71 3.063 -8.644 -5.930
526 HB3 SER 71 HB1 SER 71 2.703 -9.461 -4.404
527 HG SER 71 HG SER 71 0.421 -8.619 -5.207
528 H ALA 72 HN ALA 72 3.566 -8.429 -2.591
529 HA ALA 72 HA ALA 72 4.836 -6.289 -1.382
530 HB1 ALA 72 HB1 ALA 72 4.678 -8.543 -0.460
531 HB2 ALA 72 HB2 ALA 72 6.324 -7.905 -0.425
532 HB3 ALA 72 HB3 ALA 72 5.866 -9.093 -1.641
533 H ASP 73 HN ASP 73 6.074 -8.271 -4.020
534 HA ASP 73 HA ASP 73 8.607 -6.964 -3.939
535 HB2 ASP 73 HB2 ASP 73 7.465 -8.808 -6.032
536 HB3 ASP 73 HB1 ASP 73 9.110 -8.184 -6.050
537 H GLU 74 HN GLU 74 5.706 -6.079 -5.377
538 HA GLU 74 HA GLU 74 6.982 -4.419 -7.369
539 HB2 GLU 74 HB2 GLU 74 4.110 -4.476 -6.451
540 HB3 GLU 74 HB1 GLU 74 4.721 -3.647 -7.879
541 HG2 GLU 74 HG2 GLU 74 4.639 -6.611 -7.396
542 HG3 GLU 74 HG1 GLU 74 3.680 -5.683 -8.553
543 H VAL 75 HN VAL 75 5.457 -4.063 -4.253
544 HA VAL 75 HA VAL 75 5.826 -1.236 -4.297
545 HB VAL 75 HB VAL 75 5.146 -1.305 -1.873
546 HG11 VAL 75 HG11 VAL 75 3.318 -2.694 -3.811
547 HG12 VAL 75 HG12 VAL 75 3.542 -0.954 -3.752
548 HG13 VAL 75 HG13 VAL 75 2.810 -1.803 -2.379
549 HG21 VAL 75 HG21 VAL 75 4.556 -4.170 -2.509
550 HG22 VAL 75 HG22 VAL 75 4.136 -3.339 -1.014
551 HG23 VAL 75 HG23 VAL 75 5.838 -3.640 -1.417
552 H LYS 76 HN LYS 76 7.629 -3.945 -3.058
553 HA LYS 76 HA LYS 76 9.467 -2.706 -1.393
554 HB2 LYS 76 HB2 LYS 76 9.735 -5.060 -3.256
555 HB3 LYS 76 HB1 LYS 76 11.098 -4.505 -2.297
556 HG2 LYS 76 HG2 LYS 76 10.009 -5.046 -0.261
557 HG3 LYS 76 HG1 LYS 76 8.455 -5.186 -1.068
558 HD2 LYS 76 HD2 LYS 76 9.383 -7.374 -0.453
559 HD3 LYS 76 HD1 LYS 76 9.153 -7.247 -2.177
560 HE2 LYS 76 HE2 LYS 76 11.647 -6.685 -2.321
561 HE3 LYS 76 HE1 LYS 76 11.699 -7.073 -0.608
562 HZ1 LYS 76 HZ1 LYS 76 10.956 -9.314 -1.075
563 HZ2 LYS 76 HZ2 LYS 76 12.321 -8.983 -1.984
564 HZ3 LYS 76 HZ3 LYS 76 10.799 -8.974 -2.718
565 H ALA 77 HN ALA 77 9.413 -2.914 -4.880
566 HA ALA 77 HA ALA 77 11.900 -1.901 -5.512
567 HB1 ALA 77 HB1 ALA 77 9.334 -1.520 -7.043
568 HB2 ALA 77 HB2 ALA 77 10.352 -2.949 -7.115
569 HB3 ALA 77 HB3 ALA 77 10.964 -1.401 -7.705
570 H LYS 78 HN LYS 78 8.939 -0.145 -4.738
571 HA LYS 78 HA LYS 78 10.240 2.389 -5.232
572 HB2 LYS 78 HB2 LYS 78 7.506 1.726 -4.184
573 HB3 LYS 78 HB1 LYS 78 8.144 3.362 -4.198
574 HG2 LYS 78 HG2 LYS 78 8.408 3.225 -6.635
575 HG3 LYS 78 HG1 LYS 78 7.733 1.594 -6.599
576 HD2 LYS 78 HD2 LYS 78 6.025 3.172 -7.222
577 HD3 LYS 78 HD1 LYS 78 5.690 2.461 -5.638
578 HE2 LYS 78 HE2 LYS 78 5.169 4.842 -5.609
579 HE3 LYS 78 HE1 LYS 78 6.532 4.526 -4.553
580 HZ1 LYS 78 HZ1 LYS 78 6.827 6.513 -5.892
581 HZ2 LYS 78 HZ2 LYS 78 6.702 5.619 -7.314
582 HZ3 LYS 78 HZ3 LYS 78 8.015 5.390 -6.302
583 H LEU 79 HN LEU 79 9.077 0.538 -2.483
584 HA LEU 79 HA LEU 79 9.467 2.434 -0.481
585 HB2 LEU 79 HB2 LEU 79 8.111 0.457 -0.177
586 HB3 LEU 79 HB1 LEU 79 9.528 -0.567 -0.308
587 HG LEU 79 HG LEU 79 10.417 0.493 1.749
588 HD11 LEU 79 HD11 LEU 79 8.954 1.738 3.182
589 HD12 LEU 79 HD12 LEU 79 7.693 1.744 1.943
590 HD13 LEU 79 HD13 LEU 79 9.218 2.589 1.664
591 HD21 LEU 79 HD21 LEU 79 8.931 -0.697 3.284
592 HD22 LEU 79 HD22 LEU 79 9.292 -1.649 1.843
593 HD23 LEU 79 HD23 LEU 79 7.731 -0.840 1.998
594 H VAL 80 HN VAL 80 11.718 0.023 -1.762
595 HA VAL 80 HA VAL 80 13.692 0.344 0.207
596 HB VAL 80 HB VAL 80 13.529 -1.570 -1.420
597 HG11 VAL 80 HG11 VAL 80 13.127 -0.409 -3.474
598 HG12 VAL 80 HG12 VAL 80 14.567 -1.418 -3.619
599 HG13 VAL 80 HG13 VAL 80 14.728 0.323 -3.406
600 HG21 VAL 80 HG21 VAL 80 16.219 -0.238 -1.349
601 HG22 VAL 80 HG22 VAL 80 15.918 -1.940 -1.694
602 HG23 VAL 80 HG23 VAL 80 15.547 -1.291 -0.097
603 H LYS 81 HN LYS 81 12.906 2.163 -2.606
604 HA LYS 81 HA LYS 81 15.341 3.695 -2.729
605 HB2 LYS 81 HB2 LYS 81 12.674 4.142 -4.057
606 HB3 LYS 81 HB1 LYS 81 14.193 4.912 -4.487
607 HG2 LYS 81 HG2 LYS 81 14.019 1.946 -4.557
608 HG3 LYS 81 HG1 LYS 81 13.240 2.863 -5.832
609 HD2 LYS 81 HD2 LYS 81 15.472 2.138 -6.467
610 HD3 LYS 81 HD1 LYS 81 15.353 3.890 -6.415
611 HE2 LYS 81 HE2 LYS 81 16.571 3.897 -4.298
612 HE3 LYS 81 HE1 LYS 81 16.625 2.128 -4.299
613 HZ1 LYS 81 HZ1 LYS 81 17.884 2.245 -6.363
614 HZ2 LYS 81 HZ2 LYS 81 18.712 3.019 -5.158
615 HZ3 LYS 81 HZ3 LYS 81 17.889 3.910 -6.331
616 H ILE 82 HN ILE 82 12.001 4.160 -1.701
617 HA ILE 82 HA ILE 82 12.078 6.886 -1.044
618 HB ILE 82 HB ILE 82 10.408 4.708 0.258
619 HG12 ILE 82 HG12 ILE 82 9.712 6.536 -2.046
620 HG13 ILE 82 HG11 ILE 82 10.193 4.853 -2.213
621 HG21 ILE 82 HG21 ILE 82 9.950 7.700 0.156
622 HG22 ILE 82 HG22 ILE 82 10.414 6.775 1.581
623 HG23 ILE 82 HG23 ILE 82 8.837 6.510 0.835
624 HD11 ILE 82 HD11 ILE 82 8.226 4.166 -0.946
625 HD12 ILE 82 HD12 ILE 82 7.785 5.116 -2.363
626 HD13 ILE 82 HD13 ILE 82 7.760 5.855 -0.763
627 H ALA 83 HN ALA 83 13.018 4.055 0.768
628 HA ALA 83 HA ALA 83 13.369 5.315 3.273
629 HB1 ALA 83 HB1 ALA 83 14.590 3.307 3.907
630 HB2 ALA 83 HB2 ALA 83 14.695 2.819 2.216
631 HB3 ALA 83 HB3 ALA 83 13.125 2.891 3.019
632 H GLY 84 HN GLY 84 15.211 5.520 0.404
633 HA2 GLY 84 HA2 GLY 84 17.028 6.945 0.076
634 HA3 GLY 84 HA1 GLY 84 17.299 6.982 1.813
635 H LEU 85 HN LEU 85 16.774 3.908 0.914
636 HA LEU 85 HA LEU 85 19.582 3.238 1.190
637 HB2 LEU 85 HB2 LEU 85 17.126 1.510 1.065
638 HB3 LEU 85 HB1 LEU 85 18.748 0.947 1.453
639 HG LEU 85 HG LEU 85 17.043 2.808 3.106
640 HD11 LEU 85 HD11 LEU 85 17.824 -0.070 3.529
641 HD12 LEU 85 HD12 LEU 85 16.220 0.535 3.123
642 HD13 LEU 85 HD13 LEU 85 16.945 0.939 4.676
643 HD21 LEU 85 HD21 LEU 85 19.761 1.622 3.687
644 HD22 LEU 85 HD22 LEU 85 18.785 2.574 4.808
645 HD23 LEU 85 HD23 LEU 85 19.425 3.319 3.345
646 H GLU 86 HN GLU 86 20.466 1.555 -0.255
647 HA GLU 86 HA GLU 86 21.166 0.919 -2.315
648 HB2 GLU 86 HB2 GLU 86 18.208 1.030 -2.937
649 HB3 GLU 86 HB1 GLU 86 19.417 0.284 -3.967
650 HG2 GLU 86 HG2 GLU 86 18.660 -0.563 -1.186
651 HG3 GLU 86 HG1 GLU 86 18.266 -1.395 -2.689
652 H HIS 87 HN HIS 87 20.791 3.831 -1.733
653 HA HIS 87 HA HIS 87 21.042 4.696 -4.505
654 HB2 HIS 87 HB2 HIS 87 18.866 5.503 -3.502
655 HB3 HIS 87 HB1 HIS 87 19.814 6.390 -2.308
656 HD1 HIS 87 HD1 HIS 87 20.780 8.649 -3.049
657 HD2 HIS 87 HD2 HIS 87 19.112 6.464 -6.160
658 HE1 HIS 87 HE1 HIS 87 20.763 10.178 -5.049
659 H HIS 88 HN HIS 88 23.141 4.773 -4.610
660 HA HIS 88 HA HIS 88 24.605 6.379 -2.662
661 HB2 HIS 88 HB2 HIS 88 25.563 3.800 -3.957
662 HB3 HIS 88 HB1 HIS 88 26.456 4.776 -2.798
663 HD1 HIS 88 HD1 HIS 88 23.909 2.074 -3.007
664 HD2 HIS 88 HD2 HIS 88 25.407 4.680 -0.129
665 HE1 HIS 88 HE1 HIS 88 23.067 1.244 -0.803
Start of MODEL 13
1 H1 MET 1 HT1 MET 1 11.829 11.518 5.709
2 H2 MET 1 HT2 MET 1 10.473 11.093 6.648
3 H3 MET 1 HT3 MET 1 10.579 10.602 5.044
4 HA MET 1 HA MET 1 12.386 9.186 5.498
5 HB2 MET 1 HB2 MET 1 11.941 10.051 8.370
6 HB3 MET 1 HB1 MET 1 12.978 8.729 7.871
7 HG2 MET 1 HG2 MET 1 14.435 10.306 6.718
8 HG3 MET 1 HG1 MET 1 13.378 11.633 7.192
9 HE1 MET 1 HE1 MET 1 12.998 12.400 9.717
10 HE2 MET 1 HE2 MET 1 13.791 11.648 11.099
11 HE3 MET 1 HE3 MET 1 12.571 10.757 10.205
12 H VAL 2 HN VAL 2 11.916 7.191 7.378
13 HA VAL 2 HA VAL 2 9.295 6.480 6.429
14 HB VAL 2 HB VAL 2 11.345 4.751 7.855
15 HG11 VAL 2 HG11 VAL 2 8.839 3.979 6.359
16 HG12 VAL 2 HG12 VAL 2 9.083 3.880 8.105
17 HG13 VAL 2 HG13 VAL 2 10.027 2.856 7.021
18 HG21 VAL 2 HG21 VAL 2 10.721 4.972 4.906
19 HG22 VAL 2 HG22 VAL 2 11.826 3.809 5.637
20 HG23 VAL 2 HG23 VAL 2 12.189 5.531 5.705
21 H THR 3 HN THR 3 8.207 7.932 7.805
22 HA THR 3 HA THR 3 7.998 7.043 10.576
23 HB THR 3 HB THR 3 7.932 9.505 10.181
24 HG1 THR 3 HG1 THR 3 6.595 8.348 11.817
25 HG21 THR 3 HG21 THR 3 5.374 8.952 8.662
26 HG22 THR 3 HG22 THR 3 6.884 9.534 7.960
27 HG23 THR 3 HG23 THR 3 5.983 10.552 9.083
28 H ALA 4 HN ALA 4 6.638 6.754 7.534
29 HA ALA 4 HA ALA 4 4.904 4.639 8.360
30 HB1 ALA 4 HB1 ALA 4 3.209 5.454 6.708
31 HB2 ALA 4 HB2 ALA 4 4.122 6.956 6.557
32 HB3 ALA 4 HB3 ALA 4 3.361 6.538 8.090
33 H ALA 5 HN ALA 5 5.000 3.113 6.696
34 HA ALA 5 HA ALA 5 7.238 3.627 4.858
35 HB1 ALA 5 HB1 ALA 5 7.388 1.586 6.177
36 HB2 ALA 5 HB2 ALA 5 7.218 1.177 4.466
37 HB3 ALA 5 HB3 ALA 5 5.835 1.044 5.553
38 H LEU 6 HN LEU 6 4.020 2.235 4.815
39 HA LEU 6 HA LEU 6 3.366 3.691 2.476
40 HB2 LEU 6 HB2 LEU 6 2.505 1.749 1.229
41 HB3 LEU 6 HB1 LEU 6 4.243 1.688 1.394
42 HG LEU 6 HG LEU 6 2.490 0.102 3.264
43 HD11 LEU 6 HD11 LEU 6 3.413 -0.655 0.512
44 HD12 LEU 6 HD12 LEU 6 1.741 -0.499 1.057
45 HD13 LEU 6 HD13 LEU 6 2.764 -1.788 1.697
46 HD21 LEU 6 HD21 LEU 6 5.273 -0.311 2.167
47 HD22 LEU 6 HD22 LEU 6 4.453 -1.351 3.332
48 HD23 LEU 6 HD23 LEU 6 4.879 0.303 3.771
49 H THR 7 HN THR 7 1.306 4.165 2.472
50 HA THR 7 HA THR 7 -0.229 3.192 4.743
51 HB THR 7 HB THR 7 -0.668 5.620 2.973
52 HG1 THR 7 HG1 THR 7 0.863 5.099 5.224
53 HG21 THR 7 HG21 THR 7 -2.707 4.812 4.119
54 HG22 THR 7 HG22 THR 7 -2.168 6.355 4.784
55 HG23 THR 7 HG23 THR 7 -1.850 4.856 5.660
56 H ILE 8 HN ILE 8 -1.435 1.595 4.240
57 HA ILE 8 HA ILE 8 -2.290 1.022 1.535
58 HB ILE 8 HB ILE 8 -2.475 -0.500 4.135
59 HG12 ILE 8 HG12 ILE 8 -0.883 -1.116 1.666
60 HG13 ILE 8 HG11 ILE 8 -0.208 -0.325 3.099
61 HG21 ILE 8 HG21 ILE 8 -4.344 -1.096 2.992
62 HG22 ILE 8 HG22 ILE 8 -3.183 -2.429 2.764
63 HG23 ILE 8 HG23 ILE 8 -3.506 -1.285 1.449
64 HD11 ILE 8 HD11 ILE 8 0.335 -2.679 3.042
65 HD12 ILE 8 HD12 ILE 8 -1.379 -3.091 2.917
66 HD13 ILE 8 HD13 ILE 8 -0.757 -2.344 4.387
67 H TYR 9 HN TYR 9 -4.247 1.405 0.790
68 HA TYR 9 HA TYR 9 -6.426 2.039 2.664
69 HB2 TYR 9 HB2 TYR 9 -6.108 2.780 -0.243
70 HB3 TYR 9 HB1 TYR 9 -7.477 3.195 0.772
71 HD1 TYR 9 HD1 TYR 9 -6.909 4.604 2.889
72 HD2 TYR 9 HD2 TYR 9 -4.387 4.256 -0.501
73 HE1 TYR 9 HE1 TYR 9 -5.819 6.706 3.497
74 HE2 TYR 9 HE2 TYR 9 -3.288 6.348 0.087
75 HH TYR 9 HH TYR 9 -3.860 8.423 1.393
76 H THR 10 HN THR 10 -7.470 0.117 2.982
77 HA THR 10 HA THR 10 -9.131 -0.763 0.907
78 HB THR 10 HB THR 10 -7.120 -2.112 0.292
79 HG1 THR 10 HG1 THR 10 -8.596 -3.469 -0.263
80 HG21 THR 10 HG21 THR 10 -6.244 -3.833 1.788
81 HG22 THR 10 HG22 THR 10 -7.362 -3.305 3.041
82 HG23 THR 10 HG23 THR 10 -6.070 -2.228 2.510
83 H THR 11 HN THR 11 -10.108 -3.084 2.081
84 HA THR 11 HA THR 11 -10.347 -2.590 4.880
85 HB THR 11 HB THR 11 -12.943 -2.864 3.352
86 HG1 THR 11 HG1 THR 11 -11.266 -0.725 3.717
87 HG21 THR 11 HG21 THR 11 -12.282 -1.756 6.089
88 HG22 THR 11 HG22 THR 11 -12.997 -3.336 5.757
89 HG23 THR 11 HG23 THR 11 -13.896 -1.867 5.390
90 H SER 12 HN SER 12 -11.633 -4.509 5.852
91 HA SER 12 HA SER 12 -10.595 -6.931 5.121
92 HB2 SER 12 HB2 SER 12 -11.450 -6.278 7.327
93 HB3 SER 12 HB1 SER 12 -13.090 -6.400 6.714
94 HG SER 12 HG SER 12 -11.317 -8.580 6.534
95 H TRP 13 HN TRP 13 -13.413 -5.430 3.728
96 HA TRP 13 HA TRP 13 -14.559 -7.923 2.842
97 HB2 TRP 13 HB2 TRP 13 -16.146 -6.423 1.532
98 HB3 TRP 13 HB1 TRP 13 -16.189 -6.301 3.284
99 HD1 TRP 13 HD1 TRP 13 -15.695 -4.002 4.319
100 HE1 TRP 13 HE1 TRP 13 -15.247 -1.678 3.431
101 HE3 TRP 13 HE3 TRP 13 -14.953 -5.203 -0.595
102 HZ2 TRP 13 HZ2 TRP 13 -14.646 -0.461 0.906
103 HZ3 TRP 13 HZ3 TRP 13 -14.450 -3.392 -2.185
104 HH2 TRP 13 HH2 TRP 13 -14.301 -1.072 -1.447
105 H CYS 14 HN CYS 14 -11.941 -6.337 1.773
106 HA CYS 14 HA CYS 14 -12.435 -6.813 -1.060
107 HB2 CYS 14 HB2 CYS 14 -11.458 -4.658 -0.471
108 HB3 CYS 14 HB1 CYS 14 -10.159 -5.451 0.400
109 HG CYS 14 HG CYS 14 -10.604 -5.250 -2.992
110 H GLY 15 HN GLY 15 -11.601 -8.539 -2.084
111 HA2 GLY 15 HA2 GLY 15 -10.508 -10.715 -0.631
112 HA3 GLY 15 HA1 GLY 15 -10.645 -10.604 -2.379
113 H TYR 16 HN TYR 16 -9.085 -8.203 -2.566
114 HA TYR 16 HA TYR 16 -6.504 -9.440 -2.447
115 HB2 TYR 16 HB2 TYR 16 -7.471 -6.861 -3.525
116 HB3 TYR 16 HB1 TYR 16 -5.734 -7.129 -3.349
117 HD1 TYR 16 HD2 TYR 16 -4.998 -9.513 -4.383
118 HD2 TYR 16 HD1 TYR 16 -8.406 -7.261 -5.547
119 HE1 TYR 16 HE2 TYR 16 -4.985 -10.635 -6.573
120 HE2 TYR 16 HE1 TYR 16 -8.409 -8.375 -7.728
121 HH TYR 16 HH TYR 16 -6.816 -9.543 -9.218
122 H CYS 17 HN CYS 17 -8.239 -7.745 -0.169
123 HA CYS 17 HA CYS 17 -6.228 -6.110 0.944
124 HB2 CYS 17 HB2 CYS 17 -8.488 -5.707 1.599
125 HB3 CYS 17 HB1 CYS 17 -8.690 -7.354 2.182
126 HG CYS 17 HG CYS 17 -8.013 -4.762 3.930
127 H LEU 18 HN LEU 18 -7.464 -9.277 2.108
128 HA LEU 18 HA LEU 18 -5.308 -9.590 3.905
129 HB2 LEU 18 HB2 LEU 18 -6.100 -11.759 4.418
130 HB3 LEU 18 HB1 LEU 18 -7.508 -10.754 4.187
131 HG LEU 18 HG LEU 18 -6.457 -12.747 2.161
132 HD11 LEU 18 HD11 LEU 18 -7.214 -13.839 4.183
133 HD12 LEU 18 HD12 LEU 18 -8.325 -14.121 2.842
134 HD13 LEU 18 HD13 LEU 18 -8.739 -12.955 4.099
135 HD21 LEU 18 HD21 LEU 18 -9.106 -11.315 2.301
136 HD22 LEU 18 HD22 LEU 18 -8.601 -12.488 1.082
137 HD23 LEU 18 HD23 LEU 18 -7.791 -10.927 1.189
138 H ARG 19 HN ARG 19 -5.754 -10.440 0.594
139 HA ARG 19 HA ARG 19 -3.684 -12.310 0.279
140 HB2 ARG 19 HB2 ARG 19 -5.453 -11.833 -1.415
141 HB3 ARG 19 HB1 ARG 19 -4.691 -10.287 -1.731
142 HG2 ARG 19 HG2 ARG 19 -4.114 -11.874 -3.471
143 HG3 ARG 19 HG1 ARG 19 -2.679 -11.441 -2.544
144 HD2 ARG 19 HD2 ARG 19 -2.831 -13.522 -1.292
145 HD3 ARG 19 HD1 ARG 19 -4.313 -13.952 -2.137
146 HE ARG 19 HE ARG 19 -2.554 -13.587 -4.136
147 HH11 ARG 19 HH11 ARG 19 -2.428 -15.620 -1.227
148 HH12 ARG 19 HH12 ARG 19 -1.460 -16.819 -1.954
149 HH21 ARG 19 HH21 ARG 19 -1.247 -15.252 -5.108
150 HH22 ARG 19 HH22 ARG 19 -0.773 -16.602 -4.182
151 H LEU 20 HN LEU 20 -3.776 -8.803 0.168
152 HA LEU 20 HA LEU 20 -1.040 -8.437 -0.505
153 HB2 LEU 20 HB2 LEU 20 -2.619 -6.767 -1.108
154 HB3 LEU 20 HB1 LEU 20 -3.199 -6.632 0.536
155 HG LEU 20 HG LEU 20 -1.031 -5.715 1.188
156 HD11 LEU 20 HD11 LEU 20 0.377 -6.609 -0.588
157 HD12 LEU 20 HD12 LEU 20 0.492 -4.851 -0.568
158 HD13 LEU 20 HD13 LEU 20 -0.490 -5.654 -1.790
159 HD21 LEU 20 HD21 LEU 20 -2.453 -4.206 -0.984
160 HD22 LEU 20 HD22 LEU 20 -1.432 -3.515 0.294
161 HD23 LEU 20 HD23 LEU 20 -2.948 -4.312 0.706
162 H LYS 21 HN LYS 21 -2.942 -8.200 2.494
163 HA LYS 21 HA LYS 21 -0.988 -7.260 4.234
164 HB2 LYS 21 HB2 LYS 21 -3.146 -9.274 4.910
165 HB3 LYS 21 HB1 LYS 21 -2.218 -8.356 6.077
166 HG2 LYS 21 HG2 LYS 21 -4.186 -7.251 4.084
167 HG3 LYS 21 HG1 LYS 21 -4.434 -7.429 5.817
168 HD2 LYS 21 HD2 LYS 21 -2.550 -5.847 6.192
169 HD3 LYS 21 HD1 LYS 21 -2.448 -5.618 4.446
170 HE2 LYS 21 HE2 LYS 21 -3.726 -3.824 5.389
171 HE3 LYS 21 HE1 LYS 21 -4.806 -4.859 4.444
172 HZ1 LYS 21 HZ1 LYS 21 -4.500 -4.778 7.388
173 HZ2 LYS 21 HZ2 LYS 21 -5.497 -5.894 6.599
174 HZ3 LYS 21 HZ3 LYS 21 -5.836 -4.255 6.515
175 H THR 22 HN THR 22 -1.747 -10.607 3.436
176 HA THR 22 HA THR 22 0.205 -11.697 5.147
177 HB THR 22 HB THR 22 -0.203 -13.812 3.753
178 HG1 THR 22 HG1 THR 22 -2.389 -12.328 2.729
179 HG21 THR 22 HG21 THR 22 -2.557 -12.389 5.011
180 HG22 THR 22 HG22 THR 22 -1.365 -13.372 5.867
181 HG23 THR 22 HG23 THR 22 -2.456 -14.119 4.696
182 H ALA 23 HN ALA 23 0.257 -10.783 1.756
183 HA ALA 23 HA ALA 23 2.683 -11.969 0.997
184 HB1 ALA 23 HB1 ALA 23 1.094 -11.010 -0.616
185 HB2 ALA 23 HB2 ALA 23 2.710 -10.342 -0.823
186 HB3 ALA 23 HB3 ALA 23 1.464 -9.398 -0.009
187 H LEU 24 HN LEU 24 1.986 -8.769 2.290
188 HA LEU 24 HA LEU 24 4.726 -7.932 2.323
189 HB2 LEU 24 HB2 LEU 24 2.427 -6.862 3.944
190 HB3 LEU 24 HB1 LEU 24 3.957 -6.062 3.705
191 HG LEU 24 HG LEU 24 1.792 -6.504 1.652
192 HD11 LEU 24 HD11 LEU 24 1.333 -4.740 3.250
193 HD12 LEU 24 HD12 LEU 24 1.717 -4.034 1.668
194 HD13 LEU 24 HD13 LEU 24 2.917 -4.044 2.950
195 HD21 LEU 24 HD21 LEU 24 3.186 -5.089 0.175
196 HD22 LEU 24 HD22 LEU 24 3.865 -6.667 0.456
197 HD23 LEU 24 HD23 LEU 24 4.522 -5.253 1.309
198 H THR 25 HN THR 25 2.594 -9.302 4.740
199 HA THR 25 HA THR 25 4.348 -9.025 6.897
200 HB THR 25 HB THR 25 2.144 -11.069 6.489
201 HG1 THR 25 HG1 THR 25 1.254 -9.038 6.392
202 HG21 THR 25 HG21 THR 25 2.066 -11.171 8.944
203 HG22 THR 25 HG22 THR 25 3.433 -10.060 9.035
204 HG23 THR 25 HG23 THR 25 3.650 -11.671 8.346
205 H ALA 26 HN ALA 26 3.945 -11.688 4.563
206 HA ALA 26 HA ALA 26 5.798 -13.463 5.767
207 HB1 ALA 26 HB1 ALA 26 5.725 -14.662 3.627
208 HB2 ALA 26 HB2 ALA 26 4.913 -13.283 2.886
209 HB3 ALA 26 HB3 ALA 26 4.104 -14.202 4.155
210 H ASN 27 HN ASN 27 6.140 -10.761 3.638
211 HA ASN 27 HA ASN 27 8.942 -11.357 3.125
212 HB2 ASN 27 HB2 ASN 27 7.030 -9.351 2.023
213 HB3 ASN 27 HB1 ASN 27 8.754 -9.034 1.906
214 HD21 ASN 27 HD21 ASN 27 6.123 -11.030 0.821
215 HD22 ASN 27 HD22 ASN 27 7.027 -11.789 -0.452
216 H ARG 28 HN ARG 28 7.391 -10.231 5.633
217 HA ARG 28 HA ARG 28 7.899 -9.082 7.509
218 HB2 ARG 28 HB2 ARG 28 10.708 -9.084 6.402
219 HB3 ARG 28 HB1 ARG 28 10.265 -8.698 8.055
220 HG2 ARG 28 HG2 ARG 28 9.371 -11.013 8.285
221 HG3 ARG 28 HG1 ARG 28 10.002 -11.349 6.673
222 HD2 ARG 28 HD2 ARG 28 11.571 -12.075 8.386
223 HD3 ARG 28 HD1 ARG 28 12.240 -10.776 7.397
224 HE ARG 28 HE ARG 28 10.963 -10.106 9.931
225 HH11 ARG 28 HH11 ARG 28 13.932 -10.382 8.017
226 HH12 ARG 28 HH12 ARG 28 14.924 -9.613 9.167
227 HH21 ARG 28 HH21 ARG 28 12.359 -8.962 11.503
228 HH22 ARG 28 HH22 ARG 28 14.006 -8.745 11.123
229 H ILE 29 HN ILE 29 7.074 -7.632 5.178
230 HA ILE 29 HA ILE 29 8.592 -5.184 5.140
231 HB ILE 29 HB ILE 29 5.958 -5.890 3.830
232 HG12 ILE 29 HG12 ILE 29 8.727 -5.740 2.638
233 HG13 ILE 29 HG11 ILE 29 7.928 -7.234 3.110
234 HG21 ILE 29 HG21 ILE 29 6.348 -3.901 2.422
235 HG22 ILE 29 HG22 ILE 29 7.811 -3.544 3.342
236 HG23 ILE 29 HG23 ILE 29 6.238 -3.456 4.127
237 HD11 ILE 29 HD11 ILE 29 7.024 -5.304 0.993
238 HD12 ILE 29 HD12 ILE 29 6.179 -6.779 1.480
239 HD13 ILE 29 HD13 ILE 29 7.772 -6.886 0.746
240 H ALA 30 HN ALA 30 8.176 -3.465 6.322
241 HA ALA 30 HA ALA 30 6.093 -3.512 8.291
242 HB1 ALA 30 HB1 ALA 30 7.020 -1.323 8.946
243 HB2 ALA 30 HB2 ALA 30 8.046 -1.351 7.511
244 HB3 ALA 30 HB3 ALA 30 8.290 -2.543 8.789
245 H TYR 31 HN TYR 31 4.108 -2.574 8.068
246 HA TYR 31 HA TYR 31 3.773 -0.578 5.993
247 HB2 TYR 31 HB2 TYR 31 1.745 -1.648 5.095
248 HB3 TYR 31 HB1 TYR 31 3.186 -2.602 4.810
249 HD1 TYR 31 HD1 TYR 31 0.010 -2.412 6.650
250 HD2 TYR 31 HD2 TYR 31 3.439 -4.791 5.817
251 HE1 TYR 31 HE1 TYR 31 -1.140 -4.372 7.550
252 HE2 TYR 31 HE2 TYR 31 2.296 -6.764 6.728
253 HH TYR 31 HH TYR 31 0.517 -7.353 8.132
254 H ASP 32 HN ASP 32 1.681 0.442 6.018
255 HA ASP 32 HA ASP 32 0.679 0.713 8.747
256 HB2 ASP 32 HB2 ASP 32 1.407 2.798 6.701
257 HB3 ASP 32 HB1 ASP 32 0.426 3.182 8.119
258 H GLU 33 HN GLU 33 -1.457 0.353 8.770
259 HA GLU 33 HA GLU 33 -2.942 0.628 6.242
260 HB2 GLU 33 HB2 GLU 33 -4.476 -1.122 7.151
261 HB3 GLU 33 HB1 GLU 33 -2.859 -1.698 6.795
262 HG2 GLU 33 HG2 GLU 33 -2.294 -1.660 9.145
263 HG3 GLU 33 HG1 GLU 33 -3.862 -0.961 9.538
264 H VAL 34 HN VAL 34 -4.534 2.016 6.204
265 HA VAL 34 HA VAL 34 -5.847 2.687 8.714
266 HB VAL 34 HB VAL 34 -4.450 4.638 7.865
267 HG11 VAL 34 HG11 VAL 34 -5.155 5.882 5.892
268 HG12 VAL 34 HG12 VAL 34 -6.292 4.599 5.502
269 HG13 VAL 34 HG13 VAL 34 -4.557 4.271 5.491
270 HG21 VAL 34 HG21 VAL 34 -7.429 5.074 7.825
271 HG22 VAL 34 HG22 VAL 34 -6.224 6.348 7.960
272 HG23 VAL 34 HG23 VAL 34 -6.368 5.140 9.236
273 H ASP 35 HN ASP 35 -8.129 2.659 8.513
274 HA ASP 35 HA ASP 35 -8.860 1.202 6.111
275 HB2 ASP 35 HB2 ASP 35 -10.878 0.543 7.229
276 HB3 ASP 35 HB1 ASP 35 -9.537 0.317 8.343
277 H ILE 36 HN ILE 36 -10.257 1.787 4.707
278 HA ILE 36 HA ILE 36 -11.002 4.566 4.417
279 HB ILE 36 HB ILE 36 -11.817 3.825 2.191
280 HG12 ILE 36 HG12 ILE 36 -10.913 1.113 3.176
281 HG13 ILE 36 HG11 ILE 36 -12.575 1.604 2.924
282 HG21 ILE 36 HG21 ILE 36 -9.480 4.478 2.476
283 HG22 ILE 36 HG22 ILE 36 -9.594 3.125 1.341
284 HG23 ILE 36 HG23 ILE 36 -9.076 2.845 3.000
285 HD11 ILE 36 HD11 ILE 36 -12.202 1.711 0.549
286 HD12 ILE 36 HD12 ILE 36 -11.695 0.145 1.238
287 HD13 ILE 36 HD13 ILE 36 -10.478 1.345 0.798
288 H GLU 37 HN GLU 37 -12.296 2.280 6.230
289 HA GLU 37 HA GLU 37 -14.949 2.318 5.193
290 HB2 GLU 37 HB2 GLU 37 -13.765 0.338 6.308
291 HB3 GLU 37 HB1 GLU 37 -14.104 1.151 7.830
292 HG2 GLU 37 HG2 GLU 37 -15.776 -0.513 7.371
293 HG3 GLU 37 HG1 GLU 37 -16.490 1.102 7.310
294 H HIS 38 HN HIS 38 -13.196 3.345 8.058
295 HA HIS 38 HA HIS 38 -15.300 5.060 9.069
296 HB2 HIS 38 HB2 HIS 38 -13.808 3.912 10.619
297 HB3 HIS 38 HB1 HIS 38 -12.401 4.611 9.838
298 HD1 HIS 38 HD1 HIS 38 -11.725 7.016 10.576
299 HD2 HIS 38 HD2 HIS 38 -15.200 5.588 12.362
300 HE1 HIS 38 HE1 HIS 38 -12.232 8.586 12.478
301 H ASN 39 HN ASN 39 -12.352 5.261 7.230
302 HA ASN 39 HA ASN 39 -12.492 8.152 7.217
303 HB2 ASN 39 HB2 ASN 39 -10.306 6.273 6.276
304 HB3 ASN 39 HB1 ASN 39 -10.267 8.010 6.004
305 HD21 ASN 39 HD21 ASN 39 -8.389 8.169 7.164
306 HD22 ASN 39 HD22 ASN 39 -8.359 8.042 8.878
307 H ARG 40 HN ARG 40 -14.118 8.648 5.904
308 HA ARG 40 HA ARG 40 -14.576 7.328 3.420
309 HB2 ARG 40 HB2 ARG 40 -16.373 8.404 4.789
310 HB3 ARG 40 HB1 ARG 40 -15.713 9.970 4.334
311 HG2 ARG 40 HG2 ARG 40 -16.132 9.414 1.957
312 HG3 ARG 40 HG1 ARG 40 -16.883 7.909 2.477
313 HD2 ARG 40 HD2 ARG 40 -18.596 9.552 2.058
314 HD3 ARG 40 HD1 ARG 40 -18.514 9.202 3.785
315 HE ARG 40 HE ARG 40 -16.963 11.470 2.908
316 HH11 ARG 40 HH11 ARG 40 -20.078 10.383 4.167
317 HH12 ARG 40 HH12 ARG 40 -20.544 11.913 4.743
318 HH21 ARG 40 HH21 ARG 40 -17.626 13.611 3.711
319 HH22 ARG 40 HH22 ARG 40 -19.144 13.752 4.478
320 H ALA 41 HN ALA 41 -12.776 10.146 4.403
321 HA ALA 41 HA ALA 41 -12.504 11.303 1.820
322 HB1 ALA 41 HB1 ALA 41 -10.628 11.496 4.178
323 HB2 ALA 41 HB2 ALA 41 -11.991 12.579 3.864
324 HB3 ALA 41 HB3 ALA 41 -10.615 12.526 2.754
325 H ALA 42 HN ALA 42 -10.832 8.855 3.612
326 HA ALA 42 HA ALA 42 -8.719 8.540 1.738
327 HB1 ALA 42 HB1 ALA 42 -8.497 7.782 4.067
328 HB2 ALA 42 HB2 ALA 42 -8.198 6.492 2.905
329 HB3 ALA 42 HB3 ALA 42 -9.738 6.557 3.774
330 H ALA 43 HN ALA 43 -11.857 7.031 2.263
331 HA ALA 43 HA ALA 43 -11.754 5.051 0.270
332 HB1 ALA 43 HB1 ALA 43 -13.493 5.128 2.000
333 HB2 ALA 43 HB2 ALA 43 -14.201 5.090 0.380
334 HB3 ALA 43 HB3 ALA 43 -14.135 6.602 1.277
335 H GLU 44 HN GLU 44 -12.739 8.402 0.172
336 HA GLU 44 HA GLU 44 -13.584 8.574 -2.495
337 HB2 GLU 44 HB2 GLU 44 -13.967 10.277 -0.703
338 HB3 GLU 44 HB1 GLU 44 -12.264 10.681 -0.756
339 HG2 GLU 44 HG2 GLU 44 -13.602 12.328 -1.928
340 HG3 GLU 44 HG1 GLU 44 -12.518 11.491 -3.035
341 H PHE 45 HN PHE 45 -10.469 9.195 -0.964
342 HA PHE 45 HA PHE 45 -8.967 9.874 -3.208
343 HB2 PHE 45 HB2 PHE 45 -8.214 10.298 -0.914
344 HB3 PHE 45 HB1 PHE 45 -8.109 8.573 -0.617
345 HD1 PHE 45 HD1 PHE 45 -6.650 11.326 -2.607
346 HD2 PHE 45 HD2 PHE 45 -6.155 7.363 -1.119
347 HE1 PHE 45 HE1 PHE 45 -4.298 11.348 -3.331
348 HE2 PHE 45 HE2 PHE 45 -3.807 7.389 -1.840
349 HZ PHE 45 HZ PHE 45 -2.877 9.378 -2.948
350 H VAL 46 HN VAL 46 -9.120 6.703 -1.554
351 HA VAL 46 HA VAL 46 -7.534 5.413 -3.506
352 HB VAL 46 HB VAL 46 -7.612 4.451 -1.278
353 HG11 VAL 46 HG11 VAL 46 -9.555 3.185 -0.589
354 HG12 VAL 46 HG12 VAL 46 -10.495 4.030 -1.852
355 HG13 VAL 46 HG13 VAL 46 -9.736 4.942 -0.511
356 HG21 VAL 46 HG21 VAL 46 -8.990 2.546 -3.086
357 HG22 VAL 46 HG22 VAL 46 -7.880 2.166 -1.745
358 HG23 VAL 46 HG23 VAL 46 -7.295 3.002 -3.203
359 H GLY 47 HN GLY 47 -10.990 5.880 -3.290
360 HA2 GLY 47 HA2 GLY 47 -11.706 4.081 -5.348
361 HA3 GLY 47 HA1 GLY 47 -12.633 5.482 -4.821
362 H SER 48 HN SER 48 -10.386 7.302 -5.381
363 HA SER 48 HA SER 48 -11.008 7.833 -8.114
364 HB2 SER 48 HB2 SER 48 -10.715 9.645 -6.433
365 HB3 SER 48 HB1 SER 48 -9.021 9.193 -6.264
366 HG SER 48 HG SER 48 -10.361 10.236 -8.503
367 H VAL 49 HN VAL 49 -8.163 6.780 -6.327
368 HA VAL 49 HA VAL 49 -6.572 6.648 -8.747
369 HB VAL 49 HB VAL 49 -4.711 5.955 -7.251
370 HG11 VAL 49 HG11 VAL 49 -4.548 8.068 -6.047
371 HG12 VAL 49 HG12 VAL 49 -6.273 8.341 -6.347
372 HG13 VAL 49 HG13 VAL 49 -5.136 8.303 -7.703
373 HG21 VAL 49 HG21 VAL 49 -5.022 5.986 -4.840
374 HG22 VAL 49 HG22 VAL 49 -6.106 4.781 -5.572
375 HG23 VAL 49 HG23 VAL 49 -6.728 6.351 -5.066
376 H ASN 50 HN ASN 50 -8.780 4.680 -7.579
377 HA ASN 50 HA ASN 50 -7.422 2.150 -7.751
378 HB2 ASN 50 HB2 ASN 50 -9.945 3.065 -6.798
379 HB3 ASN 50 HB1 ASN 50 -10.262 1.861 -8.039
380 HD21 ASN 50 HD21 ASN 50 -7.556 2.014 -5.814
381 HD22 ASN 50 HD22 ASN 50 -7.960 0.546 -5.001
382 H GLY 51 HN GLY 51 -8.987 0.530 -9.201
383 HA2 GLY 51 HA2 GLY 51 -8.697 1.497 -11.922
384 HA3 GLY 51 HA1 GLY 51 -9.028 -0.158 -11.415
385 H GLY 52 HN GLY 52 -10.544 3.049 -11.163
386 HA2 GLY 52 HA2 GLY 52 -12.639 3.417 -12.338
387 HA3 GLY 52 HA1 GLY 52 -13.074 1.762 -11.923
388 H ASN 53 HN ASN 53 -13.188 1.302 -9.569
389 HA ASN 53 HA ASN 53 -14.109 3.582 -7.953
390 HB2 ASN 53 HB2 ASN 53 -16.030 2.255 -9.142
391 HB3 ASN 53 HB1 ASN 53 -15.579 0.922 -8.096
392 HD21 ASN 53 HD21 ASN 53 -18.095 2.277 -8.266
393 HD22 ASN 53 HD22 ASN 53 -18.417 2.945 -6.711
394 H ARG 54 HN ARG 54 -14.293 2.598 -5.575
395 HA ARG 54 HA ARG 54 -11.774 1.294 -5.200
396 HB2 ARG 54 HB2 ARG 54 -12.026 1.456 -2.792
397 HB3 ARG 54 HB1 ARG 54 -12.505 2.980 -3.519
398 HG2 ARG 54 HG2 ARG 54 -14.486 0.902 -2.620
399 HG3 ARG 54 HG1 ARG 54 -13.841 2.126 -1.536
400 HD2 ARG 54 HD2 ARG 54 -14.776 3.875 -2.960
401 HD3 ARG 54 HD1 ARG 54 -15.383 2.648 -4.079
402 HE ARG 54 HE ARG 54 -16.457 1.868 -1.775
403 HH11 ARG 54 HH11 ARG 54 -16.418 5.119 -3.215
404 HH12 ARG 54 HH12 ARG 54 -17.933 5.563 -2.590
405 HH21 ARG 54 HH21 ARG 54 -18.522 2.476 -0.922
406 HH22 ARG 54 HH22 ARG 54 -19.180 3.999 -1.274
407 H THR 55 HN THR 55 -11.476 -0.616 -5.630
408 HA THR 55 HA THR 55 -13.266 -2.696 -4.615
409 HB THR 55 HB THR 55 -13.927 -2.320 -6.940
410 HG1 THR 55 HG1 THR 55 -13.399 -4.585 -6.000
411 HG21 THR 55 HG21 THR 55 -11.041 -2.852 -7.668
412 HG22 THR 55 HG22 THR 55 -11.892 -1.316 -7.822
413 HG23 THR 55 HG23 THR 55 -12.368 -2.693 -8.821
414 H VAL 56 HN VAL 56 -10.085 -1.545 -5.392
415 HA VAL 56 HA VAL 56 -8.928 -3.994 -4.326
416 HB VAL 56 HB VAL 56 -6.923 -3.502 -5.831
417 HG11 VAL 56 HG11 VAL 56 -7.915 -4.652 -7.793
418 HG12 VAL 56 HG12 VAL 56 -9.525 -4.308 -7.159
419 HG13 VAL 56 HG13 VAL 56 -8.442 -5.378 -6.277
420 HG21 VAL 56 HG21 VAL 56 -7.511 -1.252 -6.493
421 HG22 VAL 56 HG22 VAL 56 -8.961 -1.851 -7.304
422 HG23 VAL 56 HG23 VAL 56 -7.364 -2.298 -7.910
423 HA PRO 57 HA PRO 57 -6.734 -1.358 -1.539
424 HB2 PRO 57 HB2 PRO 57 -4.343 -2.663 -1.329
425 HB3 PRO 57 HB1 PRO 57 -5.806 -3.253 -0.543
426 HG2 PRO 57 HG2 PRO 57 -4.561 -4.121 -3.108
427 HG3 PRO 57 HG1 PRO 57 -5.285 -5.105 -1.820
428 HD2 PRO 57 HD2 PRO 57 -6.579 -4.512 -4.108
429 HD3 PRO 57 HD1 PRO 57 -7.440 -4.697 -2.559
430 H THR 58 HN THR 58 -5.395 0.353 -1.626
431 HA THR 58 HA THR 58 -3.561 0.487 -3.873
432 HB THR 58 HB THR 58 -5.142 2.815 -2.735
433 HG1 THR 58 HG1 THR 58 -5.790 0.829 -4.346
434 HG21 THR 58 HG21 THR 58 -3.495 2.551 -5.254
435 HG22 THR 58 HG22 THR 58 -3.013 3.460 -3.810
436 HG23 THR 58 HG23 THR 58 -4.415 3.966 -4.763
437 H VAL 59 HN VAL 59 -1.562 1.451 -3.311
438 HA VAL 59 HA VAL 59 -1.202 1.951 -0.445
439 HB VAL 59 HB VAL 59 1.184 1.381 -0.756
440 HG11 VAL 59 HG11 VAL 59 0.924 -1.004 -1.119
441 HG12 VAL 59 HG12 VAL 59 -0.709 -0.709 -1.749
442 HG13 VAL 59 HG13 VAL 59 -0.321 -0.330 -0.058
443 HG21 VAL 59 HG21 VAL 59 0.380 0.630 -3.558
444 HG22 VAL 59 HG22 VAL 59 1.960 0.328 -2.820
445 HG23 VAL 59 HG23 VAL 59 1.422 1.984 -3.115
446 H LYS 60 HN LYS 60 -0.534 3.881 0.170
447 HA LYS 60 HA LYS 60 0.584 5.671 -1.886
448 HB2 LYS 60 HB2 LYS 60 -1.460 6.507 -0.601
449 HB3 LYS 60 HB1 LYS 60 -0.460 6.454 0.842
450 HG2 LYS 60 HG2 LYS 60 1.158 7.982 -0.366
451 HG3 LYS 60 HG1 LYS 60 -0.088 8.193 -1.588
452 HD2 LYS 60 HD2 LYS 60 -0.282 10.024 -0.105
453 HD3 LYS 60 HD1 LYS 60 -1.618 8.941 0.282
454 HE2 LYS 60 HE2 LYS 60 -0.607 9.741 2.320
455 HE3 LYS 60 HE1 LYS 60 -0.292 8.021 2.166
456 HZ1 LYS 60 HZ1 LYS 60 1.994 8.592 1.370
457 HZ2 LYS 60 HZ2 LYS 60 1.676 9.205 2.890
458 HZ3 LYS 60 HZ3 LYS 60 1.633 10.229 1.587
459 H PHE 61 HN PHE 61 2.713 5.784 -1.715
460 HA PHE 61 HA PHE 61 3.986 4.778 0.658
461 HB2 PHE 61 HB2 PHE 61 5.157 6.023 -1.821
462 HB3 PHE 61 HB1 PHE 61 6.095 5.320 -0.515
463 HD1 PHE 61 HD2 PHE 61 3.783 4.629 -3.258
464 HD2 PHE 61 HD1 PHE 61 6.355 2.949 -0.311
465 HE1 PHE 61 HE2 PHE 61 3.650 2.479 -4.382
466 HE2 PHE 61 HE1 PHE 61 6.234 0.780 -1.442
467 HZ PHE 61 HZ PHE 61 4.885 0.538 -3.488
468 H ALA 62 HN ALA 62 5.985 6.193 1.374
469 HA ALA 62 HA ALA 62 4.935 8.492 2.633
470 HB1 ALA 62 HB1 ALA 62 7.179 8.802 3.531
471 HB2 ALA 62 HB2 ALA 62 7.816 7.635 2.375
472 HB3 ALA 62 HB3 ALA 62 6.702 7.106 3.637
473 H ASP 63 HN ASP 63 6.112 8.053 -0.479
474 HA ASP 63 HA ASP 63 7.113 10.747 -0.793
475 HB2 ASP 63 HB2 ASP 63 7.644 10.109 -3.089
476 HB3 ASP 63 HB1 ASP 63 8.220 8.855 -2.003
477 H GLY 64 HN GLY 64 4.215 9.021 -1.044
478 HA2 GLY 64 HA2 GLY 64 2.122 10.177 -1.137
479 HA3 GLY 64 HA1 GLY 64 2.887 11.406 -2.131
480 H SER 65 HN SER 65 3.971 8.515 -3.312
481 HA SER 65 HA SER 65 2.178 8.775 -5.544
482 HB2 SER 65 HB2 SER 65 4.662 8.494 -5.786
483 HB3 SER 65 HB1 SER 65 4.485 6.865 -5.147
484 HG SER 65 HG SER 65 3.223 7.906 -7.441
485 H THR 66 HN THR 66 0.793 7.155 -6.267
486 HA THR 66 HA THR 66 0.179 5.066 -4.314
487 HB THR 66 HB THR 66 -2.111 5.274 -5.578
488 HG1 THR 66 HG1 THR 66 -2.073 6.877 -6.950
489 HG21 THR 66 HG21 THR 66 -1.174 7.269 -3.510
490 HG22 THR 66 HG22 THR 66 -1.855 5.656 -3.206
491 HG23 THR 66 HG23 THR 66 -2.859 6.922 -3.901
492 H LEU 67 HN LEU 67 -0.075 3.038 -5.045
493 HA LEU 67 HA LEU 67 -0.159 2.553 -7.938
494 HB2 LEU 67 HB2 LEU 67 1.406 0.856 -5.957
495 HB3 LEU 67 HB1 LEU 67 1.168 0.489 -7.639
496 HG LEU 67 HG LEU 67 2.831 2.743 -6.515
497 HD11 LEU 67 HD11 LEU 67 3.604 0.261 -8.037
498 HD12 LEU 67 HD12 LEU 67 3.803 0.469 -6.310
499 HD13 LEU 67 HD13 LEU 67 4.708 1.491 -7.433
500 HD21 LEU 67 HD21 LEU 67 1.780 3.427 -8.620
501 HD22 LEU 67 HD22 LEU 67 2.356 1.946 -9.390
502 HD23 LEU 67 HD23 LEU 67 3.510 3.156 -8.835
503 H THR 68 HN THR 68 -1.540 0.957 -8.542
504 HA THR 68 HA THR 68 -3.615 0.235 -6.704
505 HB THR 68 HB THR 68 -3.155 -0.690 -9.558
506 HG1 THR 68 HG1 THR 68 -3.562 1.759 -8.497
507 HG21 THR 68 HG21 THR 68 -5.607 -0.761 -9.606
508 HG22 THR 68 HG22 THR 68 -5.663 -0.190 -7.937
509 HG23 THR 68 HG23 THR 68 -4.991 -1.780 -8.302
510 H ASN 69 HN ASN 69 -4.069 -1.959 -6.079
511 HA ASN 69 HA ASN 69 -2.687 -3.468 -4.711
512 HB2 ASN 69 HB2 ASN 69 -3.576 -5.653 -5.471
513 HB3 ASN 69 HB1 ASN 69 -4.790 -4.410 -5.275
514 HD21 ASN 69 HD21 ASN 69 -4.848 -6.907 -6.820
515 HD22 ASN 69 HD22 ASN 69 -5.176 -6.454 -8.455
516 HA PRO 70 HA PRO 70 1.055 -4.661 -6.861
517 HB2 PRO 70 HB2 PRO 70 2.709 -3.270 -5.262
518 HB3 PRO 70 HB1 PRO 70 1.892 -2.540 -6.644
519 HG2 PRO 70 HG2 PRO 70 1.447 -2.059 -3.796
520 HG3 PRO 70 HG1 PRO 70 0.818 -1.150 -5.186
521 HD2 PRO 70 HD2 PRO 70 -0.460 -3.225 -3.559
522 HD3 PRO 70 HD1 PRO 70 -1.182 -2.069 -4.702
523 H SER 71 HN SER 71 2.177 -6.406 -6.358
524 HA SER 71 HA SER 71 1.800 -7.686 -3.876
525 HB2 SER 71 HB2 SER 71 2.098 -8.926 -6.008
526 HB3 SER 71 HB1 SER 71 3.752 -8.330 -6.112
527 HG SER 71 HG SER 71 4.082 -10.153 -5.181
528 H ALA 72 HN ALA 72 3.949 -8.611 -2.888
529 HA ALA 72 HA ALA 72 4.940 -6.550 -1.295
530 HB1 ALA 72 HB1 ALA 72 4.757 -8.863 -0.586
531 HB2 ALA 72 HB2 ALA 72 6.370 -8.210 -0.310
532 HB3 ALA 72 HB3 ALA 72 6.082 -9.301 -1.668
533 H ASP 73 HN ASP 73 6.583 -8.219 -3.961
534 HA ASP 73 HA ASP 73 8.923 -6.631 -3.482
535 HB2 ASP 73 HB2 ASP 73 8.295 -8.523 -5.726
536 HB3 ASP 73 HB1 ASP 73 9.813 -7.639 -5.603
537 H GLU 74 HN GLU 74 6.123 -6.156 -5.236
538 HA GLU 74 HA GLU 74 7.143 -4.329 -7.180
539 HB2 GLU 74 HB2 GLU 74 4.351 -4.498 -6.026
540 HB3 GLU 74 HB1 GLU 74 4.811 -3.734 -7.541
541 HG2 GLU 74 HG2 GLU 74 5.021 -6.672 -6.943
542 HG3 GLU 74 HG1 GLU 74 3.708 -5.905 -7.832
543 H VAL 75 HN VAL 75 5.614 -4.061 -3.999
544 HA VAL 75 HA VAL 75 5.921 -1.234 -3.949
545 HB VAL 75 HB VAL 75 5.389 -1.391 -1.497
546 HG11 VAL 75 HG11 VAL 75 3.637 -0.968 -3.186
547 HG12 VAL 75 HG12 VAL 75 3.007 -1.973 -1.877
548 HG13 VAL 75 HG13 VAL 75 3.461 -2.708 -3.411
549 HG21 VAL 75 HG21 VAL 75 6.115 -3.693 -1.093
550 HG22 VAL 75 HG22 VAL 75 4.830 -4.257 -2.176
551 HG23 VAL 75 HG23 VAL 75 4.415 -3.470 -0.661
552 H LYS 76 HN LYS 76 7.822 -3.905 -2.746
553 HA LYS 76 HA LYS 76 9.658 -2.543 -1.157
554 HB2 LYS 76 HB2 LYS 76 9.976 -4.981 -2.892
555 HB3 LYS 76 HB1 LYS 76 11.287 -4.358 -1.901
556 HG2 LYS 76 HG2 LYS 76 10.097 -4.801 0.106
557 HG3 LYS 76 HG1 LYS 76 8.605 -5.104 -0.778
558 HD2 LYS 76 HD2 LYS 76 9.657 -7.184 0.014
559 HD3 LYS 76 HD1 LYS 76 9.570 -7.147 -1.740
560 HE2 LYS 76 HE2 LYS 76 11.942 -6.389 -1.749
561 HE3 LYS 76 HE1 LYS 76 11.950 -6.598 0.004
562 HZ1 LYS 76 HZ1 LYS 76 12.858 -8.496 -1.096
563 HZ2 LYS 76 HZ2 LYS 76 11.433 -8.718 -2.001
564 HZ3 LYS 76 HZ3 LYS 76 11.425 -8.914 -0.306
565 H ALA 77 HN ALA 77 9.508 -2.879 -4.634
566 HA ALA 77 HA ALA 77 11.995 -1.908 -5.357
567 HB1 ALA 77 HB1 ALA 77 9.384 -1.479 -6.804
568 HB2 ALA 77 HB2 ALA 77 10.402 -2.917 -6.924
569 HB3 ALA 77 HB3 ALA 77 10.997 -1.362 -7.505
570 H LYS 78 HN LYS 78 9.068 -0.092 -4.570
571 HA LYS 78 HA LYS 78 10.475 2.384 -5.029
572 HB2 LYS 78 HB2 LYS 78 7.658 1.791 -4.215
573 HB3 LYS 78 HB1 LYS 78 8.318 3.406 -4.003
574 HG2 LYS 78 HG2 LYS 78 8.865 3.481 -6.405
575 HG3 LYS 78 HG1 LYS 78 8.151 1.881 -6.598
576 HD2 LYS 78 HD2 LYS 78 6.622 3.646 -7.293
577 HD3 LYS 78 HD1 LYS 78 5.996 2.731 -5.919
578 HE2 LYS 78 HE2 LYS 78 5.560 5.133 -5.658
579 HE3 LYS 78 HE1 LYS 78 6.632 4.555 -4.397
580 HZ1 LYS 78 HZ1 LYS 78 7.342 6.668 -5.229
581 HZ2 LYS 78 HZ2 LYS 78 7.437 6.115 -6.809
582 HZ3 LYS 78 HZ3 LYS 78 8.501 5.518 -5.632
583 H LEU 79 HN LEU 79 9.361 0.510 -2.310
584 HA LEU 79 HA LEU 79 9.804 2.374 -0.277
585 HB2 LEU 79 HB2 LEU 79 8.474 0.306 -0.043
586 HB3 LEU 79 HB1 LEU 79 9.947 -0.633 -0.128
587 HG LEU 79 HG LEU 79 10.704 0.390 1.996
588 HD11 LEU 79 HD11 LEU 79 7.974 1.660 2.018
589 HD12 LEU 79 HD12 LEU 79 9.517 2.501 1.875
590 HD13 LEU 79 HD13 LEU 79 9.117 1.643 3.359
591 HD21 LEU 79 HD21 LEU 79 9.147 -0.800 3.447
592 HD22 LEU 79 HD22 LEU 79 9.507 -1.752 2.005
593 HD23 LEU 79 HD23 LEU 79 7.976 -0.888 2.136
594 H VAL 80 HN VAL 80 12.026 0.030 -1.750
595 HA VAL 80 HA VAL 80 14.129 0.341 0.084
596 HB VAL 80 HB VAL 80 13.961 -1.515 -1.591
597 HG11 VAL 80 HG11 VAL 80 14.785 -1.231 -3.871
598 HG12 VAL 80 HG12 VAL 80 14.873 0.510 -3.608
599 HG13 VAL 80 HG13 VAL 80 13.311 -0.312 -3.563
600 HG21 VAL 80 HG21 VAL 80 16.357 -1.666 -2.142
601 HG22 VAL 80 HG22 VAL 80 16.042 -1.233 -0.468
602 HG23 VAL 80 HG23 VAL 80 16.546 0.013 -1.636
603 H LYS 81 HN LYS 81 13.160 2.234 -2.658
604 HA LYS 81 HA LYS 81 15.543 3.841 -2.654
605 HB2 LYS 81 HB2 LYS 81 12.971 4.132 -4.214
606 HB3 LYS 81 HB1 LYS 81 14.390 5.155 -4.425
607 HG2 LYS 81 HG2 LYS 81 15.714 3.216 -5.081
608 HG3 LYS 81 HG1 LYS 81 14.329 2.172 -4.811
609 HD2 LYS 81 HD2 LYS 81 14.496 2.494 -7.156
610 HD3 LYS 81 HD1 LYS 81 13.130 3.451 -6.605
611 HE2 LYS 81 HE2 LYS 81 15.881 4.596 -7.092
612 HE3 LYS 81 HE1 LYS 81 14.638 4.527 -8.331
613 HZ1 LYS 81 HZ1 LYS 81 13.235 5.878 -6.736
614 HZ2 LYS 81 HZ2 LYS 81 14.534 6.632 -7.444
615 HZ3 LYS 81 HZ3 LYS 81 14.655 6.201 -5.853
616 H ILE 82 HN ILE 82 12.326 4.056 -1.342
617 HA ILE 82 HA ILE 82 12.496 6.818 -0.636
618 HB ILE 82 HB ILE 82 10.769 4.621 0.541
619 HG12 ILE 82 HG12 ILE 82 10.143 6.741 -1.519
620 HG13 ILE 82 HG11 ILE 82 10.423 5.033 -1.844
621 HG21 ILE 82 HG21 ILE 82 10.965 6.503 2.114
622 HG22 ILE 82 HG22 ILE 82 9.344 6.423 1.425
623 HG23 ILE 82 HG23 ILE 82 10.492 7.625 0.836
624 HD11 ILE 82 HD11 ILE 82 8.066 5.576 -1.875
625 HD12 ILE 82 HD12 ILE 82 8.177 6.177 -0.220
626 HD13 ILE 82 HD13 ILE 82 8.443 4.465 -0.558
627 H ALA 83 HN ALA 83 13.328 3.826 0.967
628 HA ALA 83 HA ALA 83 14.100 5.009 3.437
629 HB1 ALA 83 HB1 ALA 83 15.154 2.848 3.912
630 HB2 ALA 83 HB2 ALA 83 14.962 2.377 2.224
631 HB3 ALA 83 HB3 ALA 83 13.539 2.623 3.237
632 H GLY 84 HN GLY 84 15.511 4.849 0.352
633 HA2 GLY 84 HA2 GLY 84 17.374 5.843 -0.500
634 HA3 GLY 84 HA1 GLY 84 17.705 6.489 1.098
635 H LEU 85 HN LEU 85 17.277 3.128 0.817
636 HA LEU 85 HA LEU 85 19.978 2.756 1.734
637 HB2 LEU 85 HB2 LEU 85 17.793 0.748 1.238
638 HB3 LEU 85 HB1 LEU 85 19.361 0.354 1.917
639 HG LEU 85 HG LEU 85 17.285 2.152 3.179
640 HD11 LEU 85 HD11 LEU 85 16.600 -0.183 3.162
641 HD12 LEU 85 HD12 LEU 85 17.024 0.336 4.793
642 HD13 LEU 85 HD13 LEU 85 18.150 -0.651 3.862
643 HD21 LEU 85 HD21 LEU 85 18.724 2.057 5.158
644 HD22 LEU 85 HD22 LEU 85 19.565 2.796 3.798
645 HD23 LEU 85 HD23 LEU 85 19.917 1.129 4.250
646 H GLU 86 HN GLU 86 18.147 1.919 -1.166
647 HA GLU 86 HA GLU 86 20.590 0.848 -2.348
648 HB2 GLU 86 HB2 GLU 86 18.471 -0.309 -2.852
649 HB3 GLU 86 HB1 GLU 86 17.822 1.165 -3.548
650 HG2 GLU 86 HG2 GLU 86 19.442 1.091 -5.339
651 HG3 GLU 86 HG1 GLU 86 20.224 -0.307 -4.609
652 H HIS 87 HN HIS 87 18.306 3.491 -2.832
653 HA HIS 87 HA HIS 87 20.251 5.338 -3.639
654 HB2 HIS 87 HB2 HIS 87 19.915 3.850 -5.747
655 HB3 HIS 87 HB1 HIS 87 18.275 4.471 -5.787
656 HD1 HIS 87 HD1 HIS 87 21.770 5.350 -6.658
657 HD2 HIS 87 HD2 HIS 87 18.067 7.207 -6.486
658 HE1 HIS 87 HE1 HIS 87 22.022 7.522 -7.918
659 H HIS 88 HN HIS 88 18.935 7.369 -4.239
660 HA HIS 88 HA HIS 88 16.514 7.402 -2.617
661 HB2 HIS 88 HB2 HIS 88 18.155 9.708 -3.710
662 HB3 HIS 88 HB1 HIS 88 16.783 9.846 -2.623
663 HD1 HIS 88 HD1 HIS 88 20.418 9.587 -2.604
664 HD2 HIS 88 HD2 HIS 88 17.307 8.623 -0.021
665 HE1 HIS 88 HE1 HIS 88 21.466 9.303 -0.324
Start of MODEL 14
1 H1 MET 1 HT1 MET 1 11.802 11.324 7.226
2 H2 MET 1 HT2 MET 1 10.551 12.380 7.571
3 H3 MET 1 HT3 MET 1 11.928 12.939 6.776
4 HA MET 1 HA MET 1 10.089 12.725 5.262
5 HB2 MET 1 HB2 MET 1 12.301 12.401 4.342
6 HB3 MET 1 HB1 MET 1 12.318 10.724 4.870
7 HG2 MET 1 HG2 MET 1 10.451 10.245 3.337
8 HG3 MET 1 HG1 MET 1 10.508 11.913 2.776
9 HE1 MET 1 HE1 MET 1 13.920 12.098 0.926
10 HE2 MET 1 HE2 MET 1 13.572 12.574 2.588
11 HE3 MET 1 HE3 MET 1 12.407 12.921 1.309
12 H VAL 2 HN VAL 2 10.956 9.584 6.754
13 HA VAL 2 HA VAL 2 8.277 8.668 6.053
14 HB VAL 2 HB VAL 2 9.849 7.527 4.555
15 HG11 VAL 2 HG11 VAL 2 11.910 7.774 5.790
16 HG12 VAL 2 HG12 VAL 2 11.642 6.078 5.396
17 HG13 VAL 2 HG13 VAL 2 11.333 6.663 7.032
18 HG21 VAL 2 HG21 VAL 2 7.977 6.211 5.370
19 HG22 VAL 2 HG22 VAL 2 8.914 5.715 6.779
20 HG23 VAL 2 HG23 VAL 2 9.398 5.186 5.167
21 H THR 3 HN THR 3 7.095 8.585 7.465
22 HA THR 3 HA THR 3 8.002 7.917 10.140
23 HB THR 3 HB THR 3 5.223 8.755 9.383
24 HG1 THR 3 HG1 THR 3 7.593 10.105 8.988
25 HG21 THR 3 HG21 THR 3 7.152 9.413 11.518
26 HG22 THR 3 HG22 THR 3 5.894 8.162 11.646
27 HG23 THR 3 HG23 THR 3 5.445 9.890 11.509
28 H ALA 4 HN ALA 4 5.679 7.161 7.610
29 HA ALA 4 HA ALA 4 5.482 4.404 8.528
30 HB1 ALA 4 HB1 ALA 4 3.351 5.550 9.014
31 HB2 ALA 4 HB2 ALA 4 3.144 4.427 7.668
32 HB3 ALA 4 HB3 ALA 4 3.294 6.155 7.358
33 H ALA 5 HN ALA 5 6.005 3.049 6.912
34 HA ALA 5 HA ALA 5 7.327 4.011 4.646
35 HB1 ALA 5 HB1 ALA 5 6.256 1.267 5.264
36 HB2 ALA 5 HB2 ALA 5 7.874 1.875 5.624
37 HB3 ALA 5 HB3 ALA 5 7.363 1.626 3.951
38 H LEU 6 HN LEU 6 4.215 2.291 4.834
39 HA LEU 6 HA LEU 6 3.183 3.873 2.683
40 HB2 LEU 6 HB2 LEU 6 2.438 1.970 1.332
41 HB3 LEU 6 HB1 LEU 6 4.177 2.010 1.429
42 HG LEU 6 HG LEU 6 2.553 0.157 3.184
43 HD11 LEU 6 HD11 LEU 6 3.629 -0.339 0.426
44 HD12 LEU 6 HD12 LEU 6 1.933 -0.322 0.912
45 HD13 LEU 6 HD13 LEU 6 3.010 -1.585 1.512
46 HD21 LEU 6 HD21 LEU 6 4.889 0.498 3.801
47 HD22 LEU 6 HD22 LEU 6 5.396 0.070 2.170
48 HD23 LEU 6 HD23 LEU 6 4.627 -1.139 3.205
49 H THR 7 HN THR 7 1.067 4.146 2.878
50 HA THR 7 HA THR 7 -0.250 2.806 5.122
51 HB THR 7 HB THR 7 -1.130 5.304 3.647
52 HG1 THR 7 HG1 THR 7 0.924 4.908 5.249
53 HG21 THR 7 HG21 THR 7 -2.474 5.675 5.677
54 HG22 THR 7 HG22 THR 7 -1.836 4.185 6.376
55 HG23 THR 7 HG23 THR 7 -2.875 4.116 4.953
56 H ILE 8 HN ILE 8 -1.596 1.272 4.614
57 HA ILE 8 HA ILE 8 -2.446 0.853 1.879
58 HB ILE 8 HB ILE 8 -2.686 -0.847 4.370
59 HG12 ILE 8 HG12 ILE 8 -1.034 -1.286 1.895
60 HG13 ILE 8 HG11 ILE 8 -0.394 -0.615 3.399
61 HG21 ILE 8 HG21 ILE 8 -3.606 -1.469 1.595
62 HG22 ILE 8 HG22 ILE 8 -4.555 -1.302 3.091
63 HG23 ILE 8 HG23 ILE 8 -3.429 -2.647 2.907
64 HD11 ILE 8 HD11 ILE 8 0.128 -2.963 3.180
65 HD12 ILE 8 HD12 ILE 8 -1.584 -3.351 3.001
66 HD13 ILE 8 HD13 ILE 8 -0.977 -2.707 4.528
67 H TYR 9 HN TYR 9 -4.286 1.546 1.165
68 HA TYR 9 HA TYR 9 -6.527 1.944 3.015
69 HB2 TYR 9 HB2 TYR 9 -6.146 2.847 0.166
70 HB3 TYR 9 HB1 TYR 9 -7.579 3.149 1.136
71 HD1 TYR 9 HD2 TYR 9 -6.861 4.255 3.544
72 HD2 TYR 9 HD1 TYR 9 -4.783 4.605 -0.142
73 HE1 TYR 9 HE2 TYR 9 -5.871 6.331 4.329
74 HE2 TYR 9 HE1 TYR 9 -3.780 6.683 0.602
75 HH TYR 9 HH TYR 9 -3.862 7.717 3.835
76 H THR 10 HN THR 10 -7.984 0.464 3.122
77 HA THR 10 HA THR 10 -8.905 -0.926 0.828
78 HB THR 10 HB THR 10 -6.852 -2.241 1.295
79 HG1 THR 10 HG1 THR 10 -8.885 -3.934 2.216
80 HG21 THR 10 HG21 THR 10 -6.615 -3.512 3.386
81 HG22 THR 10 HG22 THR 10 -8.074 -2.748 4.012
82 HG23 THR 10 HG23 THR 10 -6.637 -1.775 3.704
83 H THR 11 HN THR 11 -10.566 -2.533 1.584
84 HA THR 11 HA THR 11 -11.878 -1.635 4.008
85 HB THR 11 HB THR 11 -13.786 -2.966 2.884
86 HG1 THR 11 HG1 THR 11 -13.430 -2.896 0.502
87 HG21 THR 11 HG21 THR 11 -13.755 -0.507 2.995
88 HG22 THR 11 HG22 THR 11 -14.402 -1.066 1.450
89 HG23 THR 11 HG23 THR 11 -12.744 -0.468 1.554
90 H SER 12 HN SER 12 -12.469 -3.267 5.503
91 HA SER 12 HA SER 12 -10.809 -5.531 5.609
92 HB2 SER 12 HB2 SER 12 -11.756 -4.449 7.634
93 HB3 SER 12 HB1 SER 12 -13.359 -5.012 7.172
94 HG SER 12 HG SER 12 -12.564 -7.150 7.347
95 H TRP 13 HN TRP 13 -13.812 -4.995 4.046
96 HA TRP 13 HA TRP 13 -14.380 -7.821 3.827
97 HB2 TRP 13 HB2 TRP 13 -16.361 -7.101 2.440
98 HB3 TRP 13 HB1 TRP 13 -16.346 -6.505 4.089
99 HD1 TRP 13 HD1 TRP 13 -16.361 -3.920 4.430
100 HE1 TRP 13 HE1 TRP 13 -16.621 -1.910 2.871
101 HE3 TRP 13 HE3 TRP 13 -15.672 -6.284 -0.059
102 HZ2 TRP 13 HZ2 TRP 13 -16.540 -1.383 0.098
103 HZ3 TRP 13 HZ3 TRP 13 -15.778 -4.945 -2.110
104 HH2 TRP 13 HH2 TRP 13 -16.201 -2.552 -2.034
105 H CYS 14 HN CYS 14 -12.141 -6.078 2.390
106 HA CYS 14 HA CYS 14 -12.613 -6.954 -0.324
107 HB2 CYS 14 HB2 CYS 14 -11.536 -4.758 0.049
108 HB3 CYS 14 HB1 CYS 14 -10.213 -5.537 0.898
109 HG CYS 14 HG CYS 14 -10.658 -5.048 -2.346
110 H GLY 15 HN GLY 15 -11.792 -8.753 -1.201
111 HA2 GLY 15 HA2 GLY 15 -10.541 -10.690 0.471
112 HA3 GLY 15 HA1 GLY 15 -10.865 -10.849 -1.251
113 H TYR 16 HN TYR 16 -9.469 -8.415 -1.959
114 HA TYR 16 HA TYR 16 -6.871 -9.500 -2.254
115 HB2 TYR 16 HB2 TYR 16 -8.003 -6.818 -2.903
116 HB3 TYR 16 HB1 TYR 16 -6.285 -7.142 -3.090
117 HD1 TYR 16 HD2 TYR 16 -5.758 -9.318 -4.460
118 HD2 TYR 16 HD1 TYR 16 -9.384 -7.113 -4.700
119 HE1 TYR 16 HE2 TYR 16 -6.174 -10.252 -6.705
120 HE2 TYR 16 HE1 TYR 16 -9.818 -8.039 -6.929
121 HH TYR 16 HH TYR 16 -8.593 -8.995 -8.771
122 H CYS 17 HN CYS 17 -8.274 -7.711 0.231
123 HA CYS 17 HA CYS 17 -6.116 -6.278 1.232
124 HB2 CYS 17 HB2 CYS 17 -8.392 -5.964 2.065
125 HB3 CYS 17 HB1 CYS 17 -8.398 -7.592 2.730
126 HG CYS 17 HG CYS 17 -7.545 -6.922 5.027
127 H LEU 18 HN LEU 18 -7.186 -9.509 2.142
128 HA LEU 18 HA LEU 18 -4.876 -9.914 3.726
129 HB2 LEU 18 HB2 LEU 18 -5.733 -12.294 3.889
130 HB3 LEU 18 HB1 LEU 18 -6.754 -11.021 4.516
131 HG LEU 18 HG LEU 18 -8.033 -11.160 2.327
132 HD11 LEU 18 HD11 LEU 18 -6.441 -12.298 1.018
133 HD12 LEU 18 HD12 LEU 18 -7.928 -13.249 1.107
134 HD13 LEU 18 HD13 LEU 18 -6.504 -13.726 2.053
135 HD21 LEU 18 HD21 LEU 18 -8.909 -11.990 4.394
136 HD22 LEU 18 HD22 LEU 18 -8.036 -13.511 4.192
137 HD23 LEU 18 HD23 LEU 18 -9.339 -13.078 3.074
138 H ARG 19 HN ARG 19 -5.496 -10.351 0.418
139 HA ARG 19 HA ARG 19 -3.524 -12.306 -0.219
140 HB2 ARG 19 HB2 ARG 19 -4.460 -9.993 -1.934
141 HB3 ARG 19 HB1 ARG 19 -3.620 -11.425 -2.503
142 HG2 ARG 19 HG2 ARG 19 -6.378 -11.352 -1.298
143 HG3 ARG 19 HG1 ARG 19 -5.998 -11.509 -3.013
144 HD2 ARG 19 HD2 ARG 19 -4.945 -13.648 -2.607
145 HD3 ARG 19 HD1 ARG 19 -5.182 -13.466 -0.868
146 HE ARG 19 HE ARG 19 -7.608 -13.240 -2.320
147 HH11 ARG 19 HH11 ARG 19 -5.349 -15.660 -0.947
148 HH12 ARG 19 HH12 ARG 19 -6.541 -16.858 -0.837
149 HH21 ARG 19 HH21 ARG 19 -9.220 -14.946 -2.090
150 HH22 ARG 19 HH22 ARG 19 -8.750 -16.447 -1.458
151 H LEU 20 HN LEU 20 -3.577 -8.815 -0.267
152 HA LEU 20 HA LEU 20 -0.904 -8.359 -0.865
153 HB2 LEU 20 HB2 LEU 20 -2.549 -6.696 -1.221
154 HB3 LEU 20 HB1 LEU 20 -3.041 -6.735 0.457
155 HG LEU 20 HG LEU 20 -0.888 -5.815 1.088
156 HD11 LEU 20 HD11 LEU 20 0.477 -6.514 -0.830
157 HD12 LEU 20 HD12 LEU 20 0.561 -4.773 -0.643
158 HD13 LEU 20 HD13 LEU 20 -0.461 -5.471 -1.896
159 HD21 LEU 20 HD21 LEU 20 -1.379 -3.568 0.412
160 HD22 LEU 20 HD22 LEU 20 -2.871 -4.440 0.784
161 HD23 LEU 20 HD23 LEU 20 -2.410 -4.153 -0.897
162 H LYS 21 HN LYS 21 -2.605 -8.626 2.245
163 HA LYS 21 HA LYS 21 -0.471 -7.846 3.914
164 HB2 LYS 21 HB2 LYS 21 -2.565 -9.915 4.612
165 HB3 LYS 21 HB1 LYS 21 -1.581 -9.014 5.750
166 HG2 LYS 21 HG2 LYS 21 -3.755 -7.931 3.973
167 HG3 LYS 21 HG1 LYS 21 -3.819 -8.165 5.714
168 HD2 LYS 21 HD2 LYS 21 -2.072 -6.454 6.000
169 HD3 LYS 21 HD1 LYS 21 -2.004 -6.250 4.252
170 HE2 LYS 21 HE2 LYS 21 -3.379 -4.517 5.298
171 HE3 LYS 21 HE1 LYS 21 -4.330 -5.533 4.206
172 HZ1 LYS 21 HZ1 LYS 21 -5.572 -5.174 6.209
173 HZ2 LYS 21 HZ2 LYS 21 -4.289 -5.562 7.168
174 HZ3 LYS 21 HZ3 LYS 21 -5.054 -6.779 6.258
175 H THR 22 HN THR 22 -1.345 -10.988 2.600
176 HA THR 22 HA THR 22 0.571 -12.561 3.899
177 HB THR 22 HB THR 22 -0.593 -12.898 1.118
178 HG1 THR 22 HG1 THR 22 -2.155 -12.826 2.859
179 HG21 THR 22 HG21 THR 22 0.733 -14.938 2.933
180 HG22 THR 22 HG22 THR 22 1.380 -14.318 1.416
181 HG23 THR 22 HG23 THR 22 -0.086 -15.302 1.413
182 H ALA 23 HN ALA 23 0.698 -10.762 0.857
183 HA ALA 23 HA ALA 23 3.245 -11.605 0.031
184 HB1 ALA 23 HB1 ALA 23 3.126 -9.777 -1.567
185 HB2 ALA 23 HB2 ALA 23 1.810 -9.041 -0.655
186 HB3 ALA 23 HB3 ALA 23 1.563 -10.589 -1.456
187 H LEU 24 HN LEU 24 2.235 -8.649 1.720
188 HA LEU 24 HA LEU 24 4.876 -7.576 1.831
189 HB2 LEU 24 HB2 LEU 24 2.562 -6.933 3.621
190 HB3 LEU 24 HB1 LEU 24 4.015 -5.984 3.474
191 HG LEU 24 HG LEU 24 1.845 -6.314 1.409
192 HD11 LEU 24 HD11 LEU 24 2.871 -3.956 2.962
193 HD12 LEU 24 HD12 LEU 24 1.346 -4.773 3.240
194 HD13 LEU 24 HD13 LEU 24 1.622 -3.870 1.733
195 HD21 LEU 24 HD21 LEU 24 4.485 -4.861 1.168
196 HD22 LEU 24 HD22 LEU 24 3.102 -4.609 0.128
197 HD23 LEU 24 HD23 LEU 24 3.884 -6.171 0.126
198 H THR 25 HN THR 25 3.025 -9.378 4.246
199 HA THR 25 HA THR 25 4.963 -9.157 6.241
200 HB THR 25 HB THR 25 2.917 -11.352 5.818
201 HG1 THR 25 HG1 THR 25 1.556 -9.824 6.207
202 HG21 THR 25 HG21 THR 25 4.275 -10.356 8.341
203 HG22 THR 25 HG22 THR 25 4.601 -11.899 7.549
204 HG23 THR 25 HG23 THR 25 3.022 -11.594 8.277
205 H ALA 26 HN ALA 26 4.579 -11.418 3.570
206 HA ALA 26 HA ALA 26 6.533 -13.306 4.322
207 HB1 ALA 26 HB1 ALA 26 5.615 -12.515 1.561
208 HB2 ALA 26 HB2 ALA 26 4.873 -13.749 2.580
209 HB3 ALA 26 HB3 ALA 26 6.511 -13.977 1.963
210 H ASN 27 HN ASN 27 6.780 -10.136 2.947
211 HA ASN 27 HA ASN 27 9.640 -10.573 2.446
212 HB2 ASN 27 HB2 ASN 27 7.806 -8.401 1.426
213 HB3 ASN 27 HB1 ASN 27 9.553 -8.287 1.306
214 HD21 ASN 27 HD21 ASN 27 7.494 -11.119 0.813
215 HD22 ASN 27 HD22 ASN 27 7.916 -11.382 -0.835
216 H ARG 28 HN ARG 28 7.910 -9.887 4.957
217 HA ARG 28 HA ARG 28 8.136 -8.780 6.908
218 HB2 ARG 28 HB2 ARG 28 11.013 -8.668 5.994
219 HB3 ARG 28 HB1 ARG 28 10.482 -8.267 7.619
220 HG2 ARG 28 HG2 ARG 28 9.701 -10.551 7.938
221 HG3 ARG 28 HG1 ARG 28 10.178 -10.953 6.288
222 HD2 ARG 28 HD2 ARG 28 11.869 -11.680 7.894
223 HD3 ARG 28 HD1 ARG 28 12.494 -10.433 6.818
224 HE ARG 28 HE ARG 28 11.446 -9.580 9.391
225 HH11 ARG 28 HH11 ARG 28 14.318 -10.276 7.433
226 HH12 ARG 28 HH12 ARG 28 15.378 -9.396 8.438
227 HH21 ARG 28 HH21 ARG 28 12.956 -8.399 10.797
228 HH22 ARG 28 HH22 ARG 28 14.593 -8.337 10.370
229 H ILE 29 HN ILE 29 7.177 -7.185 4.900
230 HA ILE 29 HA ILE 29 8.653 -4.701 4.876
231 HB ILE 29 HB ILE 29 5.997 -5.442 3.604
232 HG12 ILE 29 HG12 ILE 29 8.747 -5.131 2.389
233 HG13 ILE 29 HG11 ILE 29 7.984 -6.666 2.778
234 HG21 ILE 29 HG21 ILE 29 7.711 -2.984 3.159
235 HG22 ILE 29 HG22 ILE 29 6.158 -3.006 3.990
236 HG23 ILE 29 HG23 ILE 29 6.243 -3.394 2.270
237 HD11 ILE 29 HD11 ILE 29 7.046 -4.651 0.753
238 HD12 ILE 29 HD12 ILE 29 6.238 -6.173 1.148
239 HD13 ILE 29 HD13 ILE 29 7.845 -6.196 0.437
240 H ALA 30 HN ALA 30 8.157 -2.867 5.941
241 HA ALA 30 HA ALA 30 6.330 -3.034 8.161
242 HB1 ALA 30 HB1 ALA 30 8.516 -1.981 8.469
243 HB2 ALA 30 HB2 ALA 30 7.230 -0.791 8.693
244 HB3 ALA 30 HB3 ALA 30 8.147 -0.824 7.191
245 H TYR 31 HN TYR 31 4.224 -2.431 7.938
246 HA TYR 31 HA TYR 31 3.652 -0.332 6.027
247 HB2 TYR 31 HB2 TYR 31 1.729 -1.563 5.097
248 HB3 TYR 31 HB1 TYR 31 3.241 -2.393 4.789
249 HD1 TYR 31 HD2 TYR 31 0.089 -2.490 6.700
250 HD2 TYR 31 HD1 TYR 31 3.652 -4.587 5.712
251 HE1 TYR 31 HE2 TYR 31 -0.900 -4.552 7.594
252 HE2 TYR 31 HE1 TYR 31 2.675 -6.675 6.605
253 HH TYR 31 HH TYR 31 0.984 -7.416 8.069
254 H ASP 32 HN ASP 32 1.368 0.418 6.257
255 HA ASP 32 HA ASP 32 0.320 0.088 8.968
256 HB2 ASP 32 HB2 ASP 32 1.610 2.246 8.797
257 HB3 ASP 32 HB1 ASP 32 0.566 2.713 7.464
258 H GLU 33 HN GLU 33 -1.981 0.137 8.970
259 HA GLU 33 HA GLU 33 -3.240 0.427 6.354
260 HB2 GLU 33 HB2 GLU 33 -4.564 -1.617 6.777
261 HB3 GLU 33 HB1 GLU 33 -2.852 -1.951 6.603
262 HG2 GLU 33 HG2 GLU 33 -2.631 -2.180 9.016
263 HG3 GLU 33 HG1 GLU 33 -4.332 -1.780 9.221
264 H VAL 34 HN VAL 34 -5.161 1.356 6.380
265 HA VAL 34 HA VAL 34 -6.562 1.679 8.891
266 HB VAL 34 HB VAL 34 -5.205 3.761 8.574
267 HG11 VAL 34 HG11 VAL 34 -6.732 4.157 6.030
268 HG12 VAL 34 HG12 VAL 34 -5.005 3.773 6.157
269 HG13 VAL 34 HG13 VAL 34 -5.621 5.309 6.764
270 HG21 VAL 34 HG21 VAL 34 -8.153 4.165 8.174
271 HG22 VAL 34 HG22 VAL 34 -7.019 5.417 8.653
272 HG23 VAL 34 HG23 VAL 34 -7.303 4.031 9.721
273 H ASP 35 HN ASP 35 -8.875 1.764 8.530
274 HA ASP 35 HA ASP 35 -9.457 0.604 5.918
275 HB2 ASP 35 HB2 ASP 35 -10.308 -0.365 8.149
276 HB3 ASP 35 HB1 ASP 35 -11.449 0.972 8.146
277 H ILE 36 HN ILE 36 -10.839 1.451 4.505
278 HA ILE 36 HA ILE 36 -11.131 4.314 4.648
279 HB ILE 36 HB ILE 36 -11.790 4.225 2.314
280 HG12 ILE 36 HG12 ILE 36 -11.473 1.225 2.574
281 HG13 ILE 36 HG11 ILE 36 -13.021 2.051 2.463
282 HG21 ILE 36 HG21 ILE 36 -9.380 2.561 3.028
283 HG22 ILE 36 HG22 ILE 36 -9.438 4.318 2.881
284 HG23 ILE 36 HG23 ILE 36 -9.664 3.302 1.459
285 HD11 ILE 36 HD11 ILE 36 -12.366 2.883 0.245
286 HD12 ILE 36 HD12 ILE 36 -12.458 1.130 0.342
287 HD13 ILE 36 HD13 ILE 36 -10.880 1.925 0.357
288 H GLU 37 HN GLU 37 -13.068 1.738 5.529
289 HA GLU 37 HA GLU 37 -15.541 2.747 4.652
290 HB2 GLU 37 HB2 GLU 37 -14.792 0.428 5.684
291 HB3 GLU 37 HB1 GLU 37 -15.358 1.178 7.172
292 HG2 GLU 37 HG2 GLU 37 -17.137 -0.103 6.223
293 HG3 GLU 37 HG1 GLU 37 -17.521 1.618 6.067
294 H HIS 38 HN HIS 38 -13.465 3.266 7.341
295 HA HIS 38 HA HIS 38 -15.414 4.797 8.869
296 HB2 HIS 38 HB2 HIS 38 -12.490 4.293 9.492
297 HB3 HIS 38 HB1 HIS 38 -13.713 4.904 10.598
298 HD1 HIS 38 HD1 HIS 38 -11.939 1.905 10.036
299 HD2 HIS 38 HD2 HIS 38 -15.958 2.784 10.685
300 HE1 HIS 38 HE1 HIS 38 -13.019 -0.242 10.768
301 H ASN 39 HN ASN 39 -13.106 5.329 6.466
302 HA ASN 39 HA ASN 39 -12.994 8.201 7.093
303 HB2 ASN 39 HB2 ASN 39 -10.765 6.570 5.853
304 HB3 ASN 39 HB1 ASN 39 -10.751 8.312 6.066
305 HD21 ASN 39 HD21 ASN 39 -10.306 5.219 7.557
306 HD22 ASN 39 HD22 ASN 39 -9.766 5.829 9.069
307 H ARG 40 HN ARG 40 -14.575 8.798 5.685
308 HA ARG 40 HA ARG 40 -14.864 7.661 3.122
309 HB2 ARG 40 HB2 ARG 40 -16.754 8.743 4.278
310 HB3 ARG 40 HB1 ARG 40 -15.961 10.305 4.100
311 HG2 ARG 40 HG2 ARG 40 -16.083 10.133 1.694
312 HG3 ARG 40 HG1 ARG 40 -16.799 8.532 1.817
313 HD2 ARG 40 HD2 ARG 40 -18.715 9.555 3.014
314 HD3 ARG 40 HD1 ARG 40 -17.992 11.144 2.729
315 HE ARG 40 HE ARG 40 -18.150 9.810 0.305
316 HH11 ARG 40 HH11 ARG 40 -20.356 11.227 2.664
317 HH12 ARG 40 HH12 ARG 40 -21.569 11.601 1.543
318 HH21 ARG 40 HH21 ARG 40 -19.809 10.244 -1.254
319 HH22 ARG 40 HH22 ARG 40 -21.249 11.014 -0.784
320 H ALA 41 HN ALA 41 -13.128 10.487 4.271
321 HA ALA 41 HA ALA 41 -12.544 11.595 1.750
322 HB1 ALA 41 HB1 ALA 41 -10.683 12.711 2.852
323 HB2 ALA 41 HB2 ALA 41 -10.901 11.695 4.277
324 HB3 ALA 41 HB3 ALA 41 -12.160 12.850 3.811
325 H ALA 42 HN ALA 42 -10.876 9.209 3.722
326 HA ALA 42 HA ALA 42 -8.718 8.817 1.938
327 HB1 ALA 42 HB1 ALA 42 -8.613 8.113 4.313
328 HB2 ALA 42 HB2 ALA 42 -8.241 6.796 3.206
329 HB3 ALA 42 HB3 ALA 42 -9.821 6.871 3.982
330 H ALA 43 HN ALA 43 -11.871 7.318 2.319
331 HA ALA 43 HA ALA 43 -11.603 5.283 0.401
332 HB1 ALA 43 HB1 ALA 43 -14.028 5.178 0.411
333 HB2 ALA 43 HB2 ALA 43 -14.110 6.752 1.198
334 HB3 ALA 43 HB3 ALA 43 -13.439 5.375 2.063
335 H GLU 44 HN GLU 44 -12.726 8.607 0.140
336 HA GLU 44 HA GLU 44 -13.448 8.611 -2.572
337 HB2 GLU 44 HB2 GLU 44 -13.893 10.397 -0.821
338 HB3 GLU 44 HB1 GLU 44 -12.225 10.906 -1.036
339 HG2 GLU 44 HG2 GLU 44 -13.555 12.359 -2.337
340 HG3 GLU 44 HG1 GLU 44 -12.758 11.261 -3.462
341 H PHE 45 HN PHE 45 -10.437 9.174 -0.892
342 HA PHE 45 HA PHE 45 -8.836 9.958 -3.048
343 HB2 PHE 45 HB2 PHE 45 -8.179 10.286 -0.686
344 HB3 PHE 45 HB1 PHE 45 -8.106 8.551 -0.480
345 HD1 PHE 45 HD1 PHE 45 -6.575 11.282 -2.456
346 HD2 PHE 45 HD2 PHE 45 -6.139 7.377 -0.821
347 HE1 PHE 45 HE1 PHE 45 -4.211 11.250 -3.143
348 HE2 PHE 45 HE2 PHE 45 -3.799 7.356 -1.491
349 HZ PHE 45 HZ PHE 45 -2.825 9.278 -2.649
350 H VAL 46 HN VAL 46 -9.030 6.795 -1.432
351 HA VAL 46 HA VAL 46 -7.454 5.434 -3.341
352 HB VAL 46 HB VAL 46 -7.626 4.535 -1.098
353 HG11 VAL 46 HG11 VAL 46 -9.633 3.388 -0.424
354 HG12 VAL 46 HG12 VAL 46 -10.506 4.217 -1.735
355 HG13 VAL 46 HG13 VAL 46 -9.733 5.151 -0.415
356 HG21 VAL 46 HG21 VAL 46 -9.071 2.627 -2.834
357 HG22 VAL 46 HG22 VAL 46 -7.927 2.271 -1.514
358 HG23 VAL 46 HG23 VAL 46 -7.372 3.035 -3.031
359 H GLY 47 HN GLY 47 -10.875 6.053 -3.279
360 HA2 GLY 47 HA2 GLY 47 -11.648 4.176 -5.222
361 HA3 GLY 47 HA1 GLY 47 -12.494 5.677 -4.858
362 H SER 48 HN SER 48 -10.323 7.439 -5.559
363 HA SER 48 HA SER 48 -10.785 7.428 -8.393
364 HB2 SER 48 HB2 SER 48 -9.542 9.639 -8.281
365 HB3 SER 48 HB1 SER 48 -11.043 9.539 -7.361
366 HG SER 48 HG SER 48 -8.653 8.877 -6.018
367 H VAL 49 HN VAL 49 -8.353 6.198 -6.421
368 HA VAL 49 HA VAL 49 -6.443 6.245 -8.659
369 HB VAL 49 HB VAL 49 -4.655 5.717 -6.973
370 HG11 VAL 49 HG11 VAL 49 -5.020 8.030 -7.628
371 HG12 VAL 49 HG12 VAL 49 -4.589 7.935 -5.908
372 HG13 VAL 49 HG13 VAL 49 -6.269 8.182 -6.389
373 HG21 VAL 49 HG21 VAL 49 -5.112 5.943 -4.604
374 HG22 VAL 49 HG22 VAL 49 -6.164 4.686 -5.295
375 HG23 VAL 49 HG23 VAL 49 -6.796 6.299 -4.967
376 H ASN 50 HN ASN 50 -8.763 4.526 -7.825
377 HA ASN 50 HA ASN 50 -7.499 1.960 -7.479
378 HB2 ASN 50 HB2 ASN 50 -10.009 3.031 -6.737
379 HB3 ASN 50 HB1 ASN 50 -10.341 1.743 -7.888
380 HD21 ASN 50 HD21 ASN 50 -7.673 1.933 -5.578
381 HD22 ASN 50 HD22 ASN 50 -8.182 0.542 -4.694
382 H GLY 51 HN GLY 51 -9.118 0.260 -8.836
383 HA2 GLY 51 HA2 GLY 51 -8.529 0.958 -11.610
384 HA3 GLY 51 HA1 GLY 51 -8.714 -0.672 -10.968
385 H GLY 52 HN GLY 52 -10.670 2.317 -11.057
386 HA2 GLY 52 HA2 GLY 52 -12.530 2.362 -12.627
387 HA3 GLY 52 HA1 GLY 52 -12.827 0.682 -12.209
388 H ASN 53 HN ASN 53 -12.872 0.562 -9.607
389 HA ASN 53 HA ASN 53 -14.643 2.636 -8.548
390 HB2 ASN 53 HB2 ASN 53 -15.934 0.714 -9.750
391 HB3 ASN 53 HB1 ASN 53 -15.357 -0.299 -8.444
392 HD21 ASN 53 HD21 ASN 53 -17.558 2.150 -9.372
393 HD22 ASN 53 HD22 ASN 53 -18.481 2.191 -7.916
394 H ARG 54 HN ARG 54 -14.909 2.079 -6.102
395 HA ARG 54 HA ARG 54 -12.346 1.298 -5.128
396 HB2 ARG 54 HB2 ARG 54 -13.138 1.732 -2.842
397 HB3 ARG 54 HB1 ARG 54 -13.605 3.048 -3.891
398 HG2 ARG 54 HG2 ARG 54 -15.485 0.847 -3.001
399 HG3 ARG 54 HG1 ARG 54 -15.304 2.378 -2.158
400 HD2 ARG 54 HD2 ARG 54 -16.266 1.996 -5.002
401 HD3 ARG 54 HD1 ARG 54 -17.262 2.393 -3.607
402 HE ARG 54 HE ARG 54 -15.455 4.366 -3.592
403 HH11 ARG 54 HH11 ARG 54 -17.676 3.206 -6.107
404 HH12 ARG 54 HH12 ARG 54 -17.724 4.700 -6.910
405 HH21 ARG 54 HH21 ARG 54 -15.577 6.387 -4.678
406 HH22 ARG 54 HH22 ARG 54 -16.504 6.539 -6.099
407 H THR 55 HN THR 55 -11.732 -0.661 -5.281
408 HA THR 55 HA THR 55 -13.351 -2.762 -4.100
409 HB THR 55 HB THR 55 -14.078 -2.753 -6.424
410 HG1 THR 55 HG1 THR 55 -13.877 -4.728 -5.396
411 HG21 THR 55 HG21 THR 55 -12.140 -1.753 -7.511
412 HG22 THR 55 HG22 THR 55 -12.536 -3.289 -8.282
413 HG23 THR 55 HG23 THR 55 -11.177 -3.186 -7.160
414 H VAL 56 HN VAL 56 -10.218 -1.645 -5.284
415 HA VAL 56 HA VAL 56 -9.003 -3.963 -3.993
416 HB VAL 56 HB VAL 56 -7.009 -3.508 -5.490
417 HG11 VAL 56 HG11 VAL 56 -8.485 -5.424 -5.838
418 HG12 VAL 56 HG12 VAL 56 -7.981 -4.772 -7.395
419 HG13 VAL 56 HG13 VAL 56 -9.596 -4.425 -6.771
420 HG21 VAL 56 HG21 VAL 56 -9.064 -1.980 -7.056
421 HG22 VAL 56 HG22 VAL 56 -7.464 -2.439 -7.642
422 HG23 VAL 56 HG23 VAL 56 -7.621 -1.305 -6.287
423 HA PRO 57 HA PRO 57 -6.867 -1.359 -1.186
424 HB2 PRO 57 HB2 PRO 57 -4.485 -2.729 -0.996
425 HB3 PRO 57 HB1 PRO 57 -5.957 -3.219 -0.154
426 HG2 PRO 57 HG2 PRO 57 -4.811 -4.244 -2.709
427 HG3 PRO 57 HG1 PRO 57 -5.556 -5.142 -1.375
428 HD2 PRO 57 HD2 PRO 57 -6.875 -4.602 -3.638
429 HD3 PRO 57 HD1 PRO 57 -7.710 -4.618 -2.065
430 H THR 58 HN THR 58 -5.423 0.290 -1.234
431 HA THR 58 HA THR 58 -3.590 0.406 -3.489
432 HB THR 58 HB THR 58 -5.256 2.720 -2.485
433 HG1 THR 58 HG1 THR 58 -5.984 0.721 -3.921
434 HG21 THR 58 HG21 THR 58 -4.508 3.865 -4.496
435 HG22 THR 58 HG22 THR 58 -3.556 2.469 -4.972
436 HG23 THR 58 HG23 THR 58 -3.116 3.398 -3.517
437 H VAL 59 HN VAL 59 -1.592 1.358 -2.889
438 HA VAL 59 HA VAL 59 -1.320 1.888 -0.019
439 HB VAL 59 HB VAL 59 1.073 1.368 -0.280
440 HG11 VAL 59 HG11 VAL 59 0.836 -1.017 -0.778
441 HG12 VAL 59 HG12 VAL 59 -0.816 -0.681 -1.351
442 HG13 VAL 59 HG13 VAL 59 -0.370 -0.378 0.347
443 HG21 VAL 59 HG21 VAL 59 1.908 0.354 -2.329
444 HG22 VAL 59 HG22 VAL 59 1.364 2.015 -2.604
445 HG23 VAL 59 HG23 VAL 59 0.352 0.654 -3.106
446 H LYS 60 HN LYS 60 -0.721 3.825 0.661
447 HA LYS 60 HA LYS 60 0.237 5.750 -1.350
448 HB2 LYS 60 HB2 LYS 60 -1.819 6.302 0.156
449 HB3 LYS 60 HB1 LYS 60 -0.644 6.434 1.452
450 HG2 LYS 60 HG2 LYS 60 0.571 8.166 0.160
451 HG3 LYS 60 HG1 LYS 60 -0.683 8.090 -1.072
452 HD2 LYS 60 HD2 LYS 60 -1.220 9.946 0.284
453 HD3 LYS 60 HD1 LYS 60 -2.330 8.667 0.774
454 HE2 LYS 60 HE2 LYS 60 -0.804 8.137 2.666
455 HE3 LYS 60 HE1 LYS 60 0.206 9.494 2.150
456 HZ1 LYS 60 HZ1 LYS 60 -2.612 9.687 3.107
457 HZ2 LYS 60 HZ2 LYS 60 -1.687 10.976 2.550
458 HZ3 LYS 60 HZ3 LYS 60 -1.237 10.185 3.939
459 H PHE 61 HN PHE 61 2.322 5.982 -1.343
460 HA PHE 61 HA PHE 61 3.941 4.920 0.803
461 HB2 PHE 61 HB2 PHE 61 4.656 6.285 -1.790
462 HB3 PHE 61 HB1 PHE 61 5.830 5.654 -0.638
463 HD1 PHE 61 HD1 PHE 61 3.153 4.787 -2.975
464 HD2 PHE 61 HD2 PHE 61 6.345 3.351 -0.570
465 HE1 PHE 61 HE1 PHE 61 3.013 2.652 -4.096
466 HE2 PHE 61 HE2 PHE 61 6.227 1.177 -1.703
467 HZ PHE 61 HZ PHE 61 4.565 0.820 -3.487
468 H ALA 62 HN ALA 62 5.611 6.147 1.810
469 HA ALA 62 HA ALA 62 4.921 8.766 2.650
470 HB1 ALA 62 HB1 ALA 62 7.119 8.770 3.751
471 HB2 ALA 62 HB2 ALA 62 7.566 7.322 2.847
472 HB3 ALA 62 HB3 ALA 62 6.265 7.251 4.033
473 H ASP 63 HN ASP 63 6.273 7.595 -0.120
474 HA ASP 63 HA ASP 63 7.895 9.839 -0.934
475 HB2 ASP 63 HB2 ASP 63 8.200 7.472 -1.794
476 HB3 ASP 63 HB1 ASP 63 6.683 7.635 -2.647
477 H GLY 64 HN GLY 64 4.582 9.150 -0.722
478 HA2 GLY 64 HA2 GLY 64 3.087 10.938 -0.679
479 HA3 GLY 64 HA1 GLY 64 3.995 11.728 -1.963
480 H SER 65 HN SER 65 3.885 8.972 -3.426
481 HA SER 65 HA SER 65 1.192 9.512 -4.455
482 HB2 SER 65 HB2 SER 65 3.358 7.966 -5.845
483 HB3 SER 65 HB1 SER 65 1.917 8.681 -6.559
484 HG SER 65 HG SER 65 2.746 10.678 -6.324
485 H THR 66 HN THR 66 0.239 7.465 -5.594
486 HA THR 66 HA THR 66 0.302 5.285 -3.657
487 HB THR 66 HB THR 66 -1.996 4.883 -4.731
488 HG1 THR 66 HG1 THR 66 -2.272 6.222 -6.336
489 HG21 THR 66 HG21 THR 66 -1.720 5.658 -2.448
490 HG22 THR 66 HG22 THR 66 -3.058 6.505 -3.233
491 HG23 THR 66 HG23 THR 66 -1.502 7.315 -3.021
492 H LEU 67 HN LEU 67 -0.018 3.186 -4.483
493 HA LEU 67 HA LEU 67 0.049 2.811 -7.377
494 HB2 LEU 67 HB2 LEU 67 1.670 1.159 -5.387
495 HB3 LEU 67 HB1 LEU 67 1.406 0.702 -7.049
496 HG LEU 67 HG LEU 67 3.043 3.055 -6.067
497 HD11 LEU 67 HD11 LEU 67 4.954 1.834 -6.888
498 HD12 LEU 67 HD12 LEU 67 3.920 0.575 -7.538
499 HD13 LEU 67 HD13 LEU 67 4.075 0.755 -5.800
500 HD21 LEU 67 HD21 LEU 67 1.962 3.618 -8.171
501 HD22 LEU 67 HD22 LEU 67 2.516 2.101 -8.880
502 HD23 LEU 67 HD23 LEU 67 3.685 3.335 -8.410
503 H THR 68 HN THR 68 -1.624 1.627 -8.005
504 HA THR 68 HA THR 68 -3.560 0.659 -6.186
505 HB THR 68 HB THR 68 -3.269 -0.123 -9.095
506 HG1 THR 68 HG1 THR 68 -4.569 2.300 -8.327
507 HG21 THR 68 HG21 THR 68 -5.730 0.033 -9.057
508 HG22 THR 68 HG22 THR 68 -5.672 0.530 -7.366
509 HG23 THR 68 HG23 THR 68 -5.156 -1.090 -7.824
510 H ASN 69 HN ASN 69 -4.002 -1.539 -5.598
511 HA ASN 69 HA ASN 69 -2.526 -3.076 -4.369
512 HB2 ASN 69 HB2 ASN 69 -4.697 -3.893 -4.924
513 HB3 ASN 69 HB1 ASN 69 -4.173 -4.389 -6.541
514 HD21 ASN 69 HD21 ASN 69 -4.776 -6.576 -6.154
515 HD22 ASN 69 HD22 ASN 69 -3.877 -7.574 -5.072
516 HA PRO 70 HA PRO 70 1.080 -4.110 -6.851
517 HB2 PRO 70 HB2 PRO 70 2.819 -2.841 -5.253
518 HB3 PRO 70 HB1 PRO 70 1.908 -2.000 -6.508
519 HG2 PRO 70 HG2 PRO 70 1.633 -1.815 -3.601
520 HG3 PRO 70 HG1 PRO 70 0.967 -0.753 -4.857
521 HD2 PRO 70 HD2 PRO 70 -0.315 -2.920 -3.377
522 HD3 PRO 70 HD1 PRO 70 -1.034 -1.690 -4.435
523 H SER 71 HN SER 71 2.248 -5.891 -6.527
524 HA SER 71 HA SER 71 1.910 -7.318 -4.099
525 HB2 SER 71 HB2 SER 71 2.081 -8.441 -6.327
526 HB3 SER 71 HB1 SER 71 3.772 -7.963 -6.413
527 HG SER 71 HG SER 71 2.519 -9.905 -4.863
528 H ALA 72 HN ALA 72 4.057 -8.376 -3.208
529 HA ALA 72 HA ALA 72 5.110 -6.363 -1.584
530 HB1 ALA 72 HB1 ALA 72 4.824 -8.639 -0.866
531 HB2 ALA 72 HB2 ALA 72 6.471 -8.070 -0.590
532 HB3 ALA 72 HB3 ALA 72 6.123 -9.161 -1.937
533 H ASP 73 HN ASP 73 6.698 -7.951 -4.380
534 HA ASP 73 HA ASP 73 9.080 -6.453 -3.702
535 HB2 ASP 73 HB2 ASP 73 9.030 -8.789 -4.869
536 HB3 ASP 73 HB1 ASP 73 8.739 -7.863 -6.337
537 H GLU 74 HN GLU 74 6.287 -5.964 -5.482
538 HA GLU 74 HA GLU 74 7.226 -4.015 -7.342
539 HB2 GLU 74 HB2 GLU 74 4.434 -4.338 -6.230
540 HB3 GLU 74 HB1 GLU 74 4.875 -3.432 -7.667
541 HG2 GLU 74 HG2 GLU 74 4.977 -6.398 -7.250
542 HG3 GLU 74 HG1 GLU 74 3.935 -5.499 -8.353
543 H VAL 75 HN VAL 75 5.692 -3.879 -4.160
544 HA VAL 75 HA VAL 75 5.870 -1.063 -4.018
545 HB VAL 75 HB VAL 75 5.624 -1.358 -1.500
546 HG11 VAL 75 HG11 VAL 75 3.556 -2.619 -3.285
547 HG12 VAL 75 HG12 VAL 75 3.719 -0.887 -2.995
548 HG13 VAL 75 HG13 VAL 75 3.243 -1.969 -1.680
549 HG21 VAL 75 HG21 VAL 75 4.808 -3.493 -0.709
550 HG22 VAL 75 HG22 VAL 75 6.445 -3.667 -1.377
551 HG23 VAL 75 HG23 VAL 75 5.025 -4.160 -2.317
552 H LYS 76 HN LYS 76 7.977 -3.650 -2.922
553 HA LYS 76 HA LYS 76 9.881 -2.185 -1.517
554 HB2 LYS 76 HB2 LYS 76 10.096 -4.626 -3.234
555 HB3 LYS 76 HB1 LYS 76 11.513 -3.941 -2.433
556 HG2 LYS 76 HG2 LYS 76 10.569 -4.388 -0.282
557 HG3 LYS 76 HG1 LYS 76 9.006 -4.781 -0.994
558 HD2 LYS 76 HD2 LYS 76 10.255 -6.790 -0.306
559 HD3 LYS 76 HD1 LYS 76 9.942 -6.786 -2.033
560 HE2 LYS 76 HE2 LYS 76 12.274 -5.839 -2.308
561 HE3 LYS 76 HE1 LYS 76 12.523 -6.194 -0.599
562 HZ1 LYS 76 HZ1 LYS 76 11.873 -8.131 -2.744
563 HZ2 LYS 76 HZ2 LYS 76 12.028 -8.539 -1.097
564 HZ3 LYS 76 HZ3 LYS 76 13.348 -7.955 -1.953
565 H ALA 77 HN ALA 77 9.555 -2.585 -4.979
566 HA ALA 77 HA ALA 77 11.953 -1.355 -5.726
567 HB1 ALA 77 HB1 ALA 77 9.357 -1.410 -7.262
568 HB2 ALA 77 HB2 ALA 77 10.566 -2.689 -7.255
569 HB3 ALA 77 HB3 ALA 77 10.960 -1.105 -7.930
570 H LYS 78 HN LYS 78 8.800 0.054 -4.977
571 HA LYS 78 HA LYS 78 9.793 2.689 -5.692
572 HB2 LYS 78 HB2 LYS 78 7.321 1.833 -5.992
573 HB3 LYS 78 HB1 LYS 78 7.190 2.236 -4.280
574 HG2 LYS 78 HG2 LYS 78 7.711 4.530 -4.686
575 HG3 LYS 78 HG1 LYS 78 8.099 4.151 -6.372
576 HD2 LYS 78 HD2 LYS 78 5.801 3.631 -6.823
577 HD3 LYS 78 HD1 LYS 78 5.367 3.946 -5.131
578 HE2 LYS 78 HE2 LYS 78 6.081 6.215 -5.348
579 HE3 LYS 78 HE1 LYS 78 6.653 5.927 -6.985
580 HZ1 LYS 78 HZ1 LYS 78 4.539 7.059 -6.942
581 HZ2 LYS 78 HZ2 LYS 78 3.776 5.756 -6.170
582 HZ3 LYS 78 HZ3 LYS 78 4.414 5.600 -7.720
583 H LEU 79 HN LEU 79 9.143 0.804 -2.893
584 HA LEU 79 HA LEU 79 9.252 2.753 -0.868
585 HB2 LEU 79 HB2 LEU 79 8.188 0.584 -0.615
586 HB3 LEU 79 HB1 LEU 79 9.723 -0.216 -0.826
587 HG LEU 79 HG LEU 79 10.500 0.756 1.291
588 HD11 LEU 79 HD11 LEU 79 8.946 1.812 2.794
589 HD12 LEU 79 HD12 LEU 79 7.650 1.679 1.604
590 HD13 LEU 79 HD13 LEU 79 9.025 2.734 1.294
591 HD21 LEU 79 HD21 LEU 79 9.121 -0.656 2.743
592 HD22 LEU 79 HD22 LEU 79 9.567 -1.477 1.247
593 HD23 LEU 79 HD23 LEU 79 7.941 -0.824 1.443
594 H VAL 80 HN VAL 80 11.738 0.779 -2.368
595 HA VAL 80 HA VAL 80 13.771 1.106 -0.506
596 HB VAL 80 HB VAL 80 13.871 -0.538 -2.322
597 HG11 VAL 80 HG11 VAL 80 14.543 0.088 -4.593
598 HG12 VAL 80 HG12 VAL 80 14.311 1.790 -4.170
599 HG13 VAL 80 HG13 VAL 80 12.944 0.671 -4.134
600 HG21 VAL 80 HG21 VAL 80 16.232 -0.250 -2.983
601 HG22 VAL 80 HG22 VAL 80 15.929 -0.042 -1.262
602 HG23 VAL 80 HG23 VAL 80 16.194 1.375 -2.289
603 H LYS 81 HN LYS 81 12.631 3.297 -2.928
604 HA LYS 81 HA LYS 81 14.892 5.051 -3.029
605 HB2 LYS 81 HB2 LYS 81 12.011 5.741 -3.588
606 HB3 LYS 81 HB1 LYS 81 13.432 6.577 -4.198
607 HG2 LYS 81 HG2 LYS 81 13.991 4.532 -5.494
608 HG3 LYS 81 HG1 LYS 81 12.486 3.815 -4.928
609 HD2 LYS 81 HD2 LYS 81 12.764 6.286 -6.670
610 HD3 LYS 81 HD1 LYS 81 12.233 4.705 -7.193
611 HE2 LYS 81 HE2 LYS 81 10.234 5.916 -6.998
612 HE3 LYS 81 HE1 LYS 81 10.305 4.998 -5.500
613 HZ1 LYS 81 HZ1 LYS 81 11.108 7.830 -5.820
614 HZ2 LYS 81 HZ2 LYS 81 11.098 7.031 -4.359
615 HZ3 LYS 81 HZ3 LYS 81 9.650 7.363 -5.153
616 H ILE 82 HN ILE 82 12.233 4.636 -0.901
617 HA ILE 82 HA ILE 82 12.274 7.317 0.173
618 HB ILE 82 HB ILE 82 10.817 4.891 1.211
619 HG12 ILE 82 HG12 ILE 82 9.829 6.934 -0.783
620 HG13 ILE 82 HG11 ILE 82 10.344 5.309 -1.207
621 HG21 ILE 82 HG21 ILE 82 10.244 7.854 1.480
622 HG22 ILE 82 HG22 ILE 82 10.927 6.819 2.731
623 HG23 ILE 82 HG23 ILE 82 9.278 6.541 2.162
624 HD11 ILE 82 HD11 ILE 82 8.520 4.413 0.221
625 HD12 ILE 82 HD12 ILE 82 7.963 5.360 -1.141
626 HD13 ILE 82 HD13 ILE 82 7.964 6.069 0.484
627 H ALA 83 HN ALA 83 12.904 4.030 1.324
628 HA ALA 83 HA ALA 83 13.796 4.846 3.888
629 HB1 ALA 83 HB1 ALA 83 14.246 2.226 2.475
630 HB2 ALA 83 HB2 ALA 83 12.865 2.639 3.504
631 HB3 ALA 83 HB3 ALA 83 14.479 2.530 4.198
632 H GLY 84 HN GLY 84 15.516 3.996 0.902
633 HA2 GLY 84 HA2 GLY 84 17.644 4.645 0.288
634 HA3 GLY 84 HA1 GLY 84 17.822 5.425 1.857
635 H LEU 85 HN LEU 85 17.515 2.212 0.471
636 HA LEU 85 HA LEU 85 19.459 1.310 2.483
637 HB2 LEU 85 HB2 LEU 85 17.234 -0.368 1.290
638 HB3 LEU 85 HB1 LEU 85 18.415 -0.884 2.462
639 HG LEU 85 HG LEU 85 16.377 1.262 2.999
640 HD11 LEU 85 HD11 LEU 85 16.341 -1.660 3.744
641 HD12 LEU 85 HD12 LEU 85 15.293 -0.875 2.562
642 HD13 LEU 85 HD13 LEU 85 15.175 -0.441 4.269
643 HD21 LEU 85 HD21 LEU 85 16.979 0.839 5.344
644 HD22 LEU 85 HD22 LEU 85 18.357 1.409 4.403
645 HD23 LEU 85 HD23 LEU 85 18.217 -0.301 4.814
646 H GLU 86 HN GLU 86 18.068 -0.064 -0.458
647 HA GLU 86 HA GLU 86 20.676 -0.960 -1.330
648 HB2 GLU 86 HB2 GLU 86 17.908 -1.300 -2.499
649 HB3 GLU 86 HB1 GLU 86 19.367 -2.036 -3.140
650 HG2 GLU 86 HG2 GLU 86 18.344 -2.531 -0.359
651 HG3 GLU 86 HG1 GLU 86 17.919 -3.529 -1.747
652 H HIS 87 HN HIS 87 21.839 0.066 -2.776
653 HA HIS 87 HA HIS 87 22.536 1.248 -4.535
654 HB2 HIS 87 HB2 HIS 87 19.616 1.604 -5.246
655 HB3 HIS 87 HB1 HIS 87 20.950 2.158 -6.244
656 HD1 HIS 87 HD1 HIS 87 18.693 -0.599 -5.969
657 HD2 HIS 87 HD2 HIS 87 22.719 -0.174 -6.918
658 HE1 HIS 87 HE1 HIS 87 19.352 -2.704 -7.168
659 H HIS 88 HN HIS 88 19.850 2.897 -2.970
660 HA HIS 88 HA HIS 88 21.484 5.276 -2.794
661 HB2 HIS 88 HB2 HIS 88 19.433 6.643 -3.614
662 HB3 HIS 88 HB1 HIS 88 20.458 5.868 -4.811
663 HD1 HIS 88 HD1 HIS 88 17.380 4.796 -2.882
664 HD2 HIS 88 HD2 HIS 88 18.963 4.696 -6.692
665 HE1 HIS 88 HE1 HIS 88 15.647 3.604 -4.333
Start of MODEL 15
1 H1 MET 1 HT1 MET 1 14.023 12.246 6.408
2 H2 MET 1 HT2 MET 1 15.109 12.668 7.631
3 H3 MET 1 HT3 MET 1 13.535 13.300 7.616
4 HA MET 1 HA MET 1 14.168 10.457 7.919
5 HB2 MET 1 HB2 MET 1 13.237 12.529 9.915
6 HB3 MET 1 HB1 MET 1 13.158 10.800 10.205
7 HG2 MET 1 HG2 MET 1 15.672 12.374 9.686
8 HG3 MET 1 HG1 MET 1 15.096 11.839 11.264
9 HE1 MET 1 HE1 MET 1 13.966 8.913 10.673
10 HE2 MET 1 HE2 MET 1 14.983 9.337 12.047
11 HE3 MET 1 HE3 MET 1 15.403 7.957 11.033
12 H VAL 2 HN VAL 2 12.382 9.129 7.954
13 HA VAL 2 HA VAL 2 9.830 10.434 7.424
14 HB VAL 2 HB VAL 2 10.902 9.566 5.326
15 HG11 VAL 2 HG11 VAL 2 10.567 6.857 6.560
16 HG12 VAL 2 HG12 VAL 2 12.081 7.657 6.133
17 HG13 VAL 2 HG13 VAL 2 10.951 7.167 4.867
18 HG21 VAL 2 HG21 VAL 2 8.517 9.829 5.399
19 HG22 VAL 2 HG22 VAL 2 8.335 8.222 6.110
20 HG23 VAL 2 HG23 VAL 2 8.941 8.397 4.462
21 H THR 3 HN THR 3 7.989 9.313 8.303
22 HA THR 3 HA THR 3 8.828 7.309 10.276
23 HB THR 3 HB THR 3 8.211 9.510 11.264
24 HG1 THR 3 HG1 THR 3 6.606 7.259 11.902
25 HG21 THR 3 HG21 THR 3 5.444 8.877 10.222
26 HG22 THR 3 HG22 THR 3 6.468 10.229 9.728
27 HG23 THR 3 HG23 THR 3 5.826 10.164 11.369
28 H ALA 4 HN ALA 4 7.202 7.564 7.473
29 HA ALA 4 HA ALA 4 5.538 5.275 8.157
30 HB1 ALA 4 HB1 ALA 4 4.752 7.558 6.334
31 HB2 ALA 4 HB2 ALA 4 4.068 7.233 7.927
32 HB3 ALA 4 HB3 ALA 4 3.815 6.090 6.607
33 H ALA 5 HN ALA 5 5.407 3.754 6.511
34 HA ALA 5 HA ALA 5 7.469 4.022 4.452
35 HB1 ALA 5 HB1 ALA 5 7.262 1.565 4.248
36 HB2 ALA 5 HB2 ALA 5 5.975 1.577 5.447
37 HB3 ALA 5 HB3 ALA 5 7.611 2.040 5.908
38 H LEU 6 HN LEU 6 4.266 2.495 4.739
39 HA LEU 6 HA LEU 6 3.136 4.046 2.734
40 HB2 LEU 6 HB2 LEU 6 2.652 2.310 1.039
41 HB3 LEU 6 HB1 LEU 6 4.361 2.646 1.148
42 HG LEU 6 HG LEU 6 4.194 0.393 0.717
43 HD11 LEU 6 HD11 LEU 6 4.938 -0.892 2.593
44 HD12 LEU 6 HD12 LEU 6 4.556 0.467 3.651
45 HD13 LEU 6 HD13 LEU 6 5.779 0.644 2.396
46 HD21 LEU 6 HD21 LEU 6 2.713 -1.186 1.895
47 HD22 LEU 6 HD22 LEU 6 1.937 0.046 0.901
48 HD23 LEU 6 HD23 LEU 6 1.936 0.226 2.660
49 H THR 7 HN THR 7 0.940 3.766 2.523
50 HA THR 7 HA THR 7 -0.188 2.271 4.775
51 HB THR 7 HB THR 7 -1.155 4.917 3.661
52 HG1 THR 7 HG1 THR 7 0.536 4.190 5.813
53 HG21 THR 7 HG21 THR 7 -2.516 4.981 5.727
54 HG22 THR 7 HG22 THR 7 -1.906 3.389 6.178
55 HG23 THR 7 HG23 THR 7 -2.922 3.572 4.748
56 H ILE 8 HN ILE 8 -1.810 0.995 4.370
57 HA ILE 8 HA ILE 8 -2.674 0.566 1.630
58 HB ILE 8 HB ILE 8 -2.891 -1.053 4.160
59 HG12 ILE 8 HG12 ILE 8 -1.454 -1.603 1.565
60 HG13 ILE 8 HG11 ILE 8 -0.695 -1.069 3.064
61 HG21 ILE 8 HG21 ILE 8 -4.900 -1.421 3.078
62 HG22 ILE 8 HG22 ILE 8 -3.893 -2.857 2.806
63 HG23 ILE 8 HG23 ILE 8 -4.137 -1.676 1.506
64 HD11 ILE 8 HD11 ILE 8 -0.391 -3.444 2.711
65 HD12 ILE 8 HD12 ILE 8 -2.138 -3.675 2.624
66 HD13 ILE 8 HD13 ILE 8 -1.391 -3.156 4.135
67 H TYR 9 HN TYR 9 -4.544 1.192 0.912
68 HA TYR 9 HA TYR 9 -6.756 1.748 2.776
69 HB2 TYR 9 HB2 TYR 9 -6.346 2.648 -0.079
70 HB3 TYR 9 HB1 TYR 9 -7.762 2.988 0.896
71 HD1 TYR 9 HD1 TYR 9 -7.187 4.156 3.208
72 HD2 TYR 9 HD2 TYR 9 -4.771 4.269 -0.270
73 HE1 TYR 9 HE1 TYR 9 -6.190 6.225 4.003
74 HE2 TYR 9 HE2 TYR 9 -3.750 6.336 0.492
75 HH TYR 9 HH TYR 9 -4.114 7.511 3.676
76 H THR 10 HN THR 10 -8.198 0.183 2.893
77 HA THR 10 HA THR 10 -9.315 -0.919 0.555
78 HB THR 10 HB THR 10 -7.245 -2.323 0.744
79 HG1 THR 10 HG1 THR 10 -8.525 -3.717 -0.127
80 HG21 THR 10 HG21 THR 10 -7.019 -3.917 2.608
81 HG22 THR 10 HG22 THR 10 -8.419 -3.182 3.391
82 HG23 THR 10 HG23 THR 10 -6.943 -2.244 3.163
83 H THR 11 HN THR 11 -10.646 -3.041 1.623
84 HA THR 11 HA THR 11 -12.072 -1.950 3.936
85 HB THR 11 HB THR 11 -14.090 -3.098 2.959
86 HG1 THR 11 HG1 THR 11 -13.850 -3.374 0.584
87 HG21 THR 11 HG21 THR 11 -12.866 -0.947 1.235
88 HG22 THR 11 HG22 THR 11 -13.816 -0.682 2.702
89 HG23 THR 11 HG23 THR 11 -14.574 -1.391 1.277
90 H SER 12 HN SER 12 -13.164 -3.748 5.169
91 HA SER 12 HA SER 12 -11.381 -5.961 5.428
92 HB2 SER 12 HB2 SER 12 -13.949 -5.290 6.846
93 HB3 SER 12 HB1 SER 12 -12.876 -6.623 7.294
94 HG SER 12 HG SER 12 -12.191 -3.865 7.202
95 H TRP 13 HN TRP 13 -13.981 -5.444 3.383
96 HA TRP 13 HA TRP 13 -14.593 -8.298 3.279
97 HB2 TRP 13 HB2 TRP 13 -16.512 -7.588 1.771
98 HB3 TRP 13 HB1 TRP 13 -16.624 -7.094 3.451
99 HD1 TRP 13 HD1 TRP 13 -16.649 -4.551 3.973
100 HE1 TRP 13 HE1 TRP 13 -16.916 -2.460 2.585
101 HE3 TRP 13 HE3 TRP 13 -15.813 -6.596 -0.639
102 HZ2 TRP 13 HZ2 TRP 13 -16.769 -1.721 -0.175
103 HZ3 TRP 13 HZ3 TRP 13 -15.887 -5.115 -2.607
104 HH2 TRP 13 HH2 TRP 13 -16.355 -2.729 -2.375
105 H CYS 14 HN CYS 14 -12.435 -6.367 2.002
106 HA CYS 14 HA CYS 14 -12.662 -7.123 -0.768
107 HB2 CYS 14 HB2 CYS 14 -11.744 -4.922 -0.092
108 HB3 CYS 14 HB1 CYS 14 -10.440 -5.736 0.753
109 HG CYS 14 HG CYS 14 -10.740 -4.919 -2.436
110 H GLY 15 HN GLY 15 -12.016 -9.089 -1.445
111 HA2 GLY 15 HA2 GLY 15 -10.757 -10.949 0.246
112 HA3 GLY 15 HA1 GLY 15 -11.017 -11.151 -1.476
113 H TYR 16 HN TYR 16 -9.458 -8.630 -1.970
114 HA TYR 16 HA TYR 16 -6.885 -9.899 -1.958
115 HB2 TYR 16 HB2 TYR 16 -7.703 -7.206 -3.036
116 HB3 TYR 16 HB1 TYR 16 -6.058 -7.818 -3.077
117 HD1 TYR 16 HD1 TYR 16 -6.694 -10.704 -3.819
118 HD2 TYR 16 HD2 TYR 16 -8.168 -7.005 -5.309
119 HE1 TYR 16 HE1 TYR 16 -7.167 -11.764 -5.984
120 HE2 TYR 16 HE2 TYR 16 -8.661 -8.067 -7.470
121 HH TYR 16 HH TYR 16 -8.598 -11.452 -7.894
122 H CYS 17 HN CYS 17 -8.499 -7.993 0.289
123 HA CYS 17 HA CYS 17 -6.439 -6.330 1.231
124 HB2 CYS 17 HB2 CYS 17 -8.677 -5.940 2.011
125 HB3 CYS 17 HB1 CYS 17 -8.800 -7.571 2.659
126 HG CYS 17 HG CYS 17 -8.453 -5.232 4.514
127 H LEU 18 HN LEU 18 -7.585 -9.398 2.614
128 HA LEU 18 HA LEU 18 -5.308 -9.661 4.222
129 HB2 LEU 18 HB2 LEU 18 -6.098 -11.929 4.814
130 HB3 LEU 18 HB1 LEU 18 -7.300 -10.695 5.031
131 HG LEU 18 HG LEU 18 -8.349 -12.672 4.333
132 HD11 LEU 18 HD11 LEU 18 -9.369 -10.728 3.413
133 HD12 LEU 18 HD12 LEU 18 -9.555 -12.105 2.335
134 HD13 LEU 18 HD13 LEU 18 -8.370 -10.858 1.961
135 HD21 LEU 18 HD21 LEU 18 -6.548 -13.899 3.330
136 HD22 LEU 18 HD22 LEU 18 -6.511 -12.794 1.955
137 HD23 LEU 18 HD23 LEU 18 -7.908 -13.844 2.204
138 H ARG 19 HN ARG 19 -5.988 -10.628 1.045
139 HA ARG 19 HA ARG 19 -4.013 -12.593 0.667
140 HB2 ARG 19 HB2 ARG 19 -5.894 -12.018 -0.907
141 HB3 ARG 19 HB1 ARG 19 -4.998 -10.575 -1.350
142 HG2 ARG 19 HG2 ARG 19 -4.715 -12.296 -3.015
143 HG3 ARG 19 HG1 ARG 19 -3.180 -11.972 -2.208
144 HD2 ARG 19 HD2 ARG 19 -3.433 -13.917 -0.831
145 HD3 ARG 19 HD1 ARG 19 -5.046 -14.229 -1.472
146 HE ARG 19 HE ARG 19 -3.621 -14.363 -3.680
147 HH11 ARG 19 HH11 ARG 19 -2.858 -15.680 -0.482
148 HH12 ARG 19 HH12 ARG 19 -1.975 -17.002 -1.081
149 HH21 ARG 19 HH21 ARG 19 -2.413 -16.168 -4.503
150 HH22 ARG 19 HH22 ARG 19 -1.719 -17.301 -3.436
151 H LEU 20 HN LEU 20 -3.983 -9.077 0.269
152 HA LEU 20 HA LEU 20 -1.277 -8.926 -0.496
153 HB2 LEU 20 HB2 LEU 20 -2.847 -7.225 -1.160
154 HB3 LEU 20 HB1 LEU 20 -3.226 -6.871 0.509
155 HG LEU 20 HG LEU 20 -1.006 -6.012 0.852
156 HD11 LEU 20 HD11 LEU 20 0.283 -7.254 -0.802
157 HD12 LEU 20 HD12 LEU 20 0.465 -5.530 -1.107
158 HD13 LEU 20 HD13 LEU 20 -0.617 -6.490 -2.111
159 HD21 LEU 20 HD21 LEU 20 -2.432 -4.761 -1.473
160 HD22 LEU 20 HD22 LEU 20 -1.242 -3.972 -0.433
161 HD23 LEU 20 HD23 LEU 20 -2.786 -4.507 0.241
162 H LYS 21 HN LYS 21 -2.999 -8.605 2.577
163 HA LYS 21 HA LYS 21 -0.914 -7.682 4.214
164 HB2 LYS 21 HB2 LYS 21 -3.026 -9.706 4.972
165 HB3 LYS 21 HB1 LYS 21 -2.071 -8.766 6.104
166 HG2 LYS 21 HG2 LYS 21 -4.118 -7.703 4.170
167 HG3 LYS 21 HG1 LYS 21 -4.361 -7.947 5.895
168 HD2 LYS 21 HD2 LYS 21 -2.564 -6.287 6.315
169 HD3 LYS 21 HD1 LYS 21 -2.466 -6.010 4.574
170 HE2 LYS 21 HE2 LYS 21 -3.869 -4.313 5.594
171 HE3 LYS 21 HE1 LYS 21 -4.842 -5.357 4.556
172 HZ1 LYS 21 HZ1 LYS 21 -4.660 -5.441 7.512
173 HZ2 LYS 21 HZ2 LYS 21 -5.559 -6.554 6.591
174 HZ3 LYS 21 HZ3 LYS 21 -5.984 -4.937 6.609
175 H THR 22 HN THR 22 -1.804 -10.966 3.264
176 HA THR 22 HA THR 22 0.104 -12.444 4.637
177 HB THR 22 HB THR 22 -1.023 -12.953 1.862
178 HG1 THR 22 HG1 THR 22 -2.348 -12.778 4.089
179 HG21 THR 22 HG21 THR 22 0.102 -14.902 3.883
180 HG22 THR 22 HG22 THR 22 0.910 -14.390 2.402
181 HG23 THR 22 HG23 THR 22 -0.585 -15.320 2.313
182 H ALA 23 HN ALA 23 0.234 -11.095 1.358
183 HA ALA 23 HA ALA 23 2.752 -12.012 0.619
184 HB1 ALA 23 HB1 ALA 23 1.097 -11.130 -0.963
185 HB2 ALA 23 HB2 ALA 23 2.669 -10.358 -1.162
186 HB3 ALA 23 HB3 ALA 23 1.364 -9.509 -0.329
187 H LEU 24 HN LEU 24 1.854 -8.908 2.087
188 HA LEU 24 HA LEU 24 4.542 -7.911 2.063
189 HB2 LEU 24 HB2 LEU 24 2.253 -7.051 3.791
190 HB3 LEU 24 HB1 LEU 24 3.738 -6.163 3.565
191 HG LEU 24 HG LEU 24 1.530 -6.583 1.552
192 HD11 LEU 24 HD11 LEU 24 1.416 -4.104 1.662
193 HD12 LEU 24 HD12 LEU 24 2.674 -4.150 2.886
194 HD13 LEU 24 HD13 LEU 24 1.112 -4.874 3.228
195 HD21 LEU 24 HD21 LEU 24 4.226 -5.277 1.147
196 HD22 LEU 24 HD22 LEU 24 2.845 -5.061 0.098
197 HD23 LEU 24 HD23 LEU 24 3.562 -6.650 0.236
198 H THR 25 HN THR 25 2.666 -9.638 4.444
199 HA THR 25 HA THR 25 4.595 -9.256 6.485
200 HB THR 25 HB THR 25 2.415 -11.353 6.258
201 HG1 THR 25 HG1 THR 25 1.486 -9.355 6.272
202 HG21 THR 25 HG21 THR 25 2.612 -11.523 8.707
203 HG22 THR 25 HG22 THR 25 3.921 -10.343 8.684
204 HG23 THR 25 HG23 THR 25 4.151 -11.923 7.941
205 H ALA 26 HN ALA 26 4.023 -11.815 4.093
206 HA ALA 26 HA ALA 26 6.017 -13.585 5.050
207 HB1 ALA 26 HB1 ALA 26 5.764 -14.728 2.909
208 HB2 ALA 26 HB2 ALA 26 4.875 -13.347 2.266
209 HB3 ALA 26 HB3 ALA 26 4.189 -14.304 3.579
210 H ASN 27 HN ASN 27 6.177 -10.704 3.223
211 HA ASN 27 HA ASN 27 8.952 -11.271 2.461
212 HB2 ASN 27 HB2 ASN 27 6.951 -9.339 1.333
213 HB3 ASN 27 HB1 ASN 27 8.675 -9.127 1.057
214 HD21 ASN 27 HD21 ASN 27 5.886 -11.069 0.394
215 HD22 ASN 27 HD22 ASN 27 6.584 -11.971 -0.905
216 H ARG 28 HN ARG 28 7.682 -10.275 5.081
217 HA ARG 28 HA ARG 28 7.989 -8.757 6.676
218 HB2 ARG 28 HB2 ARG 28 10.379 -8.432 7.378
219 HB3 ARG 28 HB1 ARG 28 9.922 -10.104 7.106
220 HG2 ARG 28 HG2 ARG 28 10.971 -10.075 4.960
221 HG3 ARG 28 HG1 ARG 28 11.370 -8.372 5.158
222 HD2 ARG 28 HD2 ARG 28 12.829 -8.929 7.040
223 HD3 ARG 28 HD1 ARG 28 12.415 -10.638 6.861
224 HE ARG 28 HE ARG 28 13.269 -10.219 4.473
225 HH11 ARG 28 HH11 ARG 28 14.717 -8.921 7.440
226 HH12 ARG 28 HH12 ARG 28 16.298 -8.834 6.822
227 HH21 ARG 28 HH21 ARG 28 15.439 -10.061 3.586
228 HH22 ARG 28 HH22 ARG 28 16.723 -9.516 4.556
229 H ILE 29 HN ILE 29 6.884 -7.287 5.132
230 HA ILE 29 HA ILE 29 8.525 -4.897 4.657
231 HB ILE 29 HB ILE 29 5.831 -5.636 3.462
232 HG12 ILE 29 HG12 ILE 29 8.552 -5.623 2.146
233 HG13 ILE 29 HG11 ILE 29 7.746 -7.072 2.731
234 HG21 ILE 29 HG21 ILE 29 6.198 -3.207 3.640
235 HG22 ILE 29 HG22 ILE 29 6.231 -3.726 1.951
236 HG23 ILE 29 HG23 ILE 29 7.737 -3.377 2.800
237 HD11 ILE 29 HD11 ILE 29 5.937 -6.687 1.145
238 HD12 ILE 29 HD12 ILE 29 7.503 -6.825 0.351
239 HD13 ILE 29 HD13 ILE 29 6.759 -5.235 0.566
240 H ALA 30 HN ALA 30 7.984 -3.074 5.715
241 HA ALA 30 HA ALA 30 6.042 -3.277 7.842
242 HB1 ALA 30 HB1 ALA 30 7.908 -1.076 7.007
243 HB2 ALA 30 HB2 ALA 30 8.218 -2.265 8.277
244 HB3 ALA 30 HB3 ALA 30 6.927 -1.071 8.472
245 H TYR 31 HN TYR 31 4.051 -2.322 7.779
246 HA TYR 31 HA TYR 31 3.484 -0.335 5.767
247 HB2 TYR 31 HB2 TYR 31 1.555 -1.571 4.881
248 HB3 TYR 31 HB1 TYR 31 3.075 -2.389 4.509
249 HD1 TYR 31 HD1 TYR 31 3.607 -4.492 5.807
250 HD2 TYR 31 HD2 TYR 31 -0.171 -2.576 6.055
251 HE1 TYR 31 HE1 TYR 31 2.609 -6.580 6.683
252 HE2 TYR 31 HE2 TYR 31 -1.175 -4.626 6.935
253 HH TYR 31 HH TYR 31 0.642 -7.215 8.055
254 H ASP 32 HN ASP 32 1.455 0.664 6.132
255 HA ASP 32 HA ASP 32 0.272 0.143 8.769
256 HB2 ASP 32 HB2 ASP 32 1.530 2.293 8.720
257 HB3 ASP 32 HB1 ASP 32 0.560 2.816 7.349
258 H GLU 33 HN GLU 33 -2.023 0.184 8.810
259 HA GLU 33 HA GLU 33 -3.301 0.321 6.167
260 HB2 GLU 33 HB2 GLU 33 -4.702 -1.607 6.873
261 HB3 GLU 33 HB1 GLU 33 -3.007 -2.013 6.662
262 HG2 GLU 33 HG2 GLU 33 -2.671 -1.990 9.058
263 HG3 GLU 33 HG1 GLU 33 -4.332 -1.459 9.298
264 H VAL 34 HN VAL 34 -5.190 1.361 6.119
265 HA VAL 34 HA VAL 34 -6.642 1.787 8.581
266 HB VAL 34 HB VAL 34 -5.273 3.846 8.209
267 HG11 VAL 34 HG11 VAL 34 -6.750 4.131 5.624
268 HG12 VAL 34 HG12 VAL 34 -5.019 3.810 5.829
269 HG13 VAL 34 HG13 VAL 34 -5.705 5.347 6.352
270 HG21 VAL 34 HG21 VAL 34 -7.323 4.192 9.356
271 HG22 VAL 34 HG22 VAL 34 -8.216 4.145 7.843
272 HG23 VAL 34 HG23 VAL 34 -7.151 5.522 8.188
273 H ASP 35 HN ASP 35 -8.927 1.811 8.178
274 HA ASP 35 HA ASP 35 -9.441 0.742 5.516
275 HB2 ASP 35 HB2 ASP 35 -11.469 -0.239 6.309
276 HB3 ASP 35 HB1 ASP 35 -10.222 -0.604 7.491
277 H ILE 36 HN ILE 36 -10.983 1.451 4.234
278 HA ILE 36 HA ILE 36 -11.338 4.306 4.363
279 HB ILE 36 HB ILE 36 -12.146 4.124 2.079
280 HG12 ILE 36 HG12 ILE 36 -11.759 1.137 2.412
281 HG13 ILE 36 HG11 ILE 36 -13.327 1.930 2.415
282 HG21 ILE 36 HG21 ILE 36 -9.694 2.470 2.673
283 HG22 ILE 36 HG22 ILE 36 -9.754 4.228 2.548
284 HG23 ILE 36 HG23 ILE 36 -10.062 3.231 1.127
285 HD11 ILE 36 HD11 ILE 36 -11.369 1.854 0.136
286 HD12 ILE 36 HD12 ILE 36 -12.939 2.680 0.138
287 HD13 ILE 36 HD13 ILE 36 -12.864 0.922 0.291
288 H GLU 37 HN GLU 37 -13.137 1.897 5.663
289 HA GLU 37 HA GLU 37 -15.631 2.994 4.765
290 HB2 GLU 37 HB2 GLU 37 -15.153 0.767 6.763
291 HB3 GLU 37 HB1 GLU 37 -16.706 1.197 6.046
292 HG2 GLU 37 HG2 GLU 37 -15.655 0.753 3.808
293 HG3 GLU 37 HG1 GLU 37 -14.300 0.057 4.686
294 H HIS 38 HN HIS 38 -13.652 2.722 7.625
295 HA HIS 38 HA HIS 38 -15.234 4.478 9.208
296 HB2 HIS 38 HB2 HIS 38 -13.748 2.861 10.271
297 HB3 HIS 38 HB1 HIS 38 -12.361 3.532 9.437
298 HD1 HIS 38 HD1 HIS 38 -14.595 4.138 12.415
299 HD2 HIS 38 HD2 HIS 38 -11.255 5.796 10.589
300 HE1 HIS 38 HE1 HIS 38 -13.644 5.785 14.061
301 H ASN 39 HN ASN 39 -12.558 4.826 6.976
302 HA ASN 39 HA ASN 39 -12.435 7.722 7.507
303 HB2 ASN 39 HB2 ASN 39 -10.348 6.347 7.679
304 HB3 ASN 39 HB1 ASN 39 -10.480 6.003 5.967
305 HD21 ASN 39 HD21 ASN 39 -8.362 7.212 7.392
306 HD22 ASN 39 HD22 ASN 39 -8.075 8.766 6.732
307 H ARG 40 HN ARG 40 -13.989 8.649 6.239
308 HA ARG 40 HA ARG 40 -14.711 7.688 3.672
309 HB2 ARG 40 HB2 ARG 40 -16.340 8.852 5.010
310 HB3 ARG 40 HB1 ARG 40 -15.350 10.301 5.053
311 HG2 ARG 40 HG2 ARG 40 -15.654 10.574 2.642
312 HG3 ARG 40 HG1 ARG 40 -16.640 9.115 2.602
313 HD2 ARG 40 HD2 ARG 40 -18.288 10.147 4.022
314 HD3 ARG 40 HD1 ARG 40 -17.280 11.584 4.205
315 HE ARG 40 HE ARG 40 -17.603 11.277 1.516
316 HH11 ARG 40 HH11 ARG 40 -19.825 11.778 4.227
317 HH12 ARG 40 HH12 ARG 40 -20.995 12.570 3.254
318 HH21 ARG 40 HH21 ARG 40 -19.193 12.359 0.254
319 HH22 ARG 40 HH22 ARG 40 -20.633 12.903 0.993
320 H ALA 41 HN ALA 41 -12.476 10.128 4.762
321 HA ALA 41 HA ALA 41 -12.055 11.455 2.295
322 HB1 ALA 41 HB1 ALA 41 -10.111 11.038 4.573
323 HB2 ALA 41 HB2 ALA 41 -11.271 12.355 4.461
324 HB3 ALA 41 HB3 ALA 41 -9.952 12.238 3.293
325 H ALA 42 HN ALA 42 -10.590 8.692 3.829
326 HA ALA 42 HA ALA 42 -8.691 8.151 1.834
327 HB1 ALA 42 HB1 ALA 42 -8.481 5.985 2.833
328 HB2 ALA 42 HB2 ALA 42 -9.994 6.211 3.719
329 HB3 ALA 42 HB3 ALA 42 -8.585 7.212 4.096
330 H ALA 43 HN ALA 43 -12.009 7.026 2.344
331 HA ALA 43 HA ALA 43 -12.191 5.197 0.221
332 HB1 ALA 43 HB1 ALA 43 -14.376 6.979 1.291
333 HB2 ALA 43 HB2 ALA 43 -13.905 5.427 1.982
334 HB3 ALA 43 HB3 ALA 43 -14.602 5.498 0.364
335 H GLU 44 HN GLU 44 -12.602 8.654 0.300
336 HA GLU 44 HA GLU 44 -13.443 8.994 -2.387
337 HB2 GLU 44 HB2 GLU 44 -13.730 10.640 -0.517
338 HB3 GLU 44 HB1 GLU 44 -12.001 10.933 -0.567
339 HG2 GLU 44 HG2 GLU 44 -13.148 12.684 -1.708
340 HG3 GLU 44 HG1 GLU 44 -12.235 11.733 -2.879
341 H PHE 45 HN PHE 45 -10.344 9.185 -0.709
342 HA PHE 45 HA PHE 45 -8.747 9.930 -2.879
343 HB2 PHE 45 HB2 PHE 45 -8.013 10.186 -0.569
344 HB3 PHE 45 HB1 PHE 45 -8.015 8.441 -0.355
345 HD1 PHE 45 HD1 PHE 45 -6.391 11.221 -2.146
346 HD2 PHE 45 HD2 PHE 45 -6.161 7.135 -0.980
347 HE1 PHE 45 HE1 PHE 45 -4.053 11.135 -2.895
348 HE2 PHE 45 HE2 PHE 45 -3.835 7.056 -1.725
349 HZ PHE 45 HZ PHE 45 -2.776 9.049 -2.680
350 H VAL 46 HN VAL 46 -9.155 6.686 -1.449
351 HA VAL 46 HA VAL 46 -7.604 5.393 -3.479
352 HB VAL 46 HB VAL 46 -7.809 4.363 -1.276
353 HG11 VAL 46 HG11 VAL 46 -10.686 4.041 -2.014
354 HG12 VAL 46 HG12 VAL 46 -9.983 4.876 -0.582
355 HG13 VAL 46 HG13 VAL 46 -9.832 3.112 -0.788
356 HG21 VAL 46 HG21 VAL 46 -9.162 2.636 -3.248
357 HG22 VAL 46 HG22 VAL 46 -8.104 2.144 -1.892
358 HG23 VAL 46 HG23 VAL 46 -7.454 3.076 -3.275
359 H GLY 47 HN GLY 47 -10.927 6.284 -3.337
360 HA2 GLY 47 HA2 GLY 47 -11.774 4.630 -5.505
361 HA3 GLY 47 HA1 GLY 47 -12.594 6.079 -4.932
362 H SER 48 HN SER 48 -9.933 7.525 -5.314
363 HA SER 48 HA SER 48 -10.461 8.373 -8.008
364 HB2 SER 48 HB2 SER 48 -10.047 10.013 -6.181
365 HB3 SER 48 HB1 SER 48 -8.426 9.363 -5.990
366 HG SER 48 HG SER 48 -7.893 10.770 -7.425
367 H VAL 49 HN VAL 49 -8.231 6.300 -6.365
368 HA VAL 49 HA VAL 49 -6.392 6.295 -8.678
369 HB VAL 49 HB VAL 49 -4.665 5.433 -7.060
370 HG11 VAL 49 HG11 VAL 49 -4.719 7.788 -7.646
371 HG12 VAL 49 HG12 VAL 49 -4.355 7.595 -5.916
372 HG13 VAL 49 HG13 VAL 49 -5.972 8.059 -6.431
373 HG21 VAL 49 HG21 VAL 49 -6.256 4.561 -5.382
374 HG22 VAL 49 HG22 VAL 49 -6.706 6.230 -5.012
375 HG23 VAL 49 HG23 VAL 49 -5.068 5.673 -4.687
376 H ASN 50 HN ASN 50 -8.861 4.605 -7.877
377 HA ASN 50 HA ASN 50 -7.608 1.990 -7.670
378 HB2 ASN 50 HB2 ASN 50 -10.044 3.052 -6.702
379 HB3 ASN 50 HB1 ASN 50 -10.471 1.820 -7.878
380 HD21 ASN 50 HD21 ASN 50 -7.625 1.813 -5.794
381 HD22 ASN 50 HD22 ASN 50 -8.117 0.444 -4.897
382 H GLY 51 HN GLY 51 -8.591 0.206 -8.978
383 HA2 GLY 51 HA2 GLY 51 -8.540 0.918 -11.761
384 HA3 GLY 51 HA1 GLY 51 -8.706 -0.706 -11.091
385 H GLY 52 HN GLY 52 -10.387 2.276 -11.695
386 HA2 GLY 52 HA2 GLY 52 -12.556 2.247 -12.756
387 HA3 GLY 52 HA1 GLY 52 -12.887 0.745 -11.892
388 H ASN 53 HN ASN 53 -13.135 0.839 -9.598
389 HA ASN 53 HA ASN 53 -13.683 3.436 -8.424
390 HB2 ASN 53 HB2 ASN 53 -15.787 2.444 -9.594
391 HB3 ASN 53 HB1 ASN 53 -15.752 1.213 -8.338
392 HD21 ASN 53 HD21 ASN 53 -17.748 3.191 -8.977
393 HD22 ASN 53 HD22 ASN 53 -17.988 4.123 -7.549
394 H ARG 54 HN ARG 54 -14.322 2.799 -5.945
395 HA ARG 54 HA ARG 54 -12.016 1.380 -5.092
396 HB2 ARG 54 HB2 ARG 54 -12.634 1.709 -2.769
397 HB3 ARG 54 HB1 ARG 54 -12.937 3.189 -3.644
398 HG2 ARG 54 HG2 ARG 54 -15.148 1.237 -3.051
399 HG3 ARG 54 HG1 ARG 54 -14.629 2.425 -1.862
400 HD2 ARG 54 HD2 ARG 54 -15.628 3.035 -4.643
401 HD3 ARG 54 HD1 ARG 54 -16.578 3.164 -3.162
402 HE ARG 54 HE ARG 54 -14.268 4.661 -2.822
403 HH11 ARG 54 HH11 ARG 54 -17.171 4.795 -4.846
404 HH12 ARG 54 HH12 ARG 54 -17.206 6.495 -4.931
405 HH21 ARG 54 HH21 ARG 54 -14.316 6.980 -2.927
406 HH22 ARG 54 HH22 ARG 54 -15.543 7.778 -3.780
407 H THR 55 HN THR 55 -11.636 -0.563 -4.893
408 HA THR 55 HA THR 55 -13.418 -2.465 -3.764
409 HB THR 55 HB THR 55 -14.405 -2.390 -6.012
410 HG1 THR 55 HG1 THR 55 -12.937 -4.800 -5.608
411 HG21 THR 55 HG21 THR 55 -13.110 -3.171 -7.998
412 HG22 THR 55 HG22 THR 55 -11.660 -3.210 -6.996
413 HG23 THR 55 HG23 THR 55 -12.461 -1.678 -7.315
414 H VAL 56 HN VAL 56 -10.350 -1.596 -5.218
415 HA VAL 56 HA VAL 56 -9.223 -4.018 -4.059
416 HB VAL 56 HB VAL 56 -7.304 -3.713 -5.596
417 HG11 VAL 56 HG11 VAL 56 -9.041 -5.387 -6.063
418 HG12 VAL 56 HG12 VAL 56 -8.439 -4.707 -7.575
419 HG13 VAL 56 HG13 VAL 56 -9.986 -4.182 -6.927
420 HG21 VAL 56 HG21 VAL 56 -7.624 -2.420 -7.682
421 HG22 VAL 56 HG22 VAL 56 -7.577 -1.404 -6.240
422 HG23 VAL 56 HG23 VAL 56 -9.120 -1.767 -7.012
423 HA PRO 57 HA PRO 57 -6.843 -1.643 -1.246
424 HB2 PRO 57 HB2 PRO 57 -4.519 -3.122 -1.219
425 HB3 PRO 57 HB1 PRO 57 -5.974 -3.574 -0.331
426 HG2 PRO 57 HG2 PRO 57 -5.003 -4.550 -2.986
427 HG3 PRO 57 HG1 PRO 57 -5.719 -5.472 -1.647
428 HD2 PRO 57 HD2 PRO 57 -7.113 -4.797 -3.823
429 HD3 PRO 57 HD1 PRO 57 -7.865 -4.823 -2.213
430 H THR 58 HN THR 58 -5.574 0.082 -1.411
431 HA THR 58 HA THR 58 -3.732 0.153 -3.650
432 HB THR 58 HB THR 58 -5.391 2.491 -2.638
433 HG1 THR 58 HG1 THR 58 -6.053 0.476 -4.031
434 HG21 THR 58 HG21 THR 58 -4.616 3.601 -4.690
435 HG22 THR 58 HG22 THR 58 -3.589 2.228 -5.066
436 HG23 THR 58 HG23 THR 58 -3.253 3.225 -3.635
437 H VAL 59 HN VAL 59 -1.705 1.251 -3.112
438 HA VAL 59 HA VAL 59 -1.398 1.771 -0.250
439 HB VAL 59 HB VAL 59 1.024 1.309 -0.567
440 HG11 VAL 59 HG11 VAL 59 0.813 -1.125 -0.881
441 HG12 VAL 59 HG12 VAL 59 -0.873 -0.864 -1.380
442 HG13 VAL 59 HG13 VAL 59 -0.345 -0.445 0.262
443 HG21 VAL 59 HG21 VAL 59 1.211 1.807 -2.933
444 HG22 VAL 59 HG22 VAL 59 0.179 0.430 -3.318
445 HG23 VAL 59 HG23 VAL 59 1.771 0.167 -2.600
446 H LYS 60 HN LYS 60 -0.896 3.691 0.374
447 HA LYS 60 HA LYS 60 0.090 5.647 -1.595
448 HB2 LYS 60 HB2 LYS 60 -1.967 6.233 -0.220
449 HB3 LYS 60 HB1 LYS 60 -0.943 6.166 1.205
450 HG2 LYS 60 HG2 LYS 60 0.455 7.972 0.279
451 HG3 LYS 60 HG1 LYS 60 -0.606 8.063 -1.122
452 HD2 LYS 60 HD2 LYS 60 -1.221 9.819 0.390
453 HD3 LYS 60 HD1 LYS 60 -2.494 8.598 0.437
454 HE2 LYS 60 HE2 LYS 60 -1.515 7.681 2.501
455 HE3 LYS 60 HE1 LYS 60 -0.265 8.922 2.445
456 HZ1 LYS 60 HZ1 LYS 60 -2.002 9.531 3.961
457 HZ2 LYS 60 HZ2 LYS 60 -3.184 9.363 2.799
458 HZ3 LYS 60 HZ3 LYS 60 -2.012 10.600 2.666
459 H PHE 61 HN PHE 61 2.191 5.971 -1.505
460 HA PHE 61 HA PHE 61 3.678 4.816 0.696
461 HB2 PHE 61 HB2 PHE 61 4.643 6.163 -1.819
462 HB3 PHE 61 HB1 PHE 61 5.664 5.380 -0.622
463 HD1 PHE 61 HD1 PHE 61 3.201 4.880 -3.251
464 HD2 PHE 61 HD2 PHE 61 5.823 2.970 -0.500
465 HE1 PHE 61 HE1 PHE 61 2.914 2.797 -4.440
466 HE2 PHE 61 HE2 PHE 61 5.554 0.855 -1.702
467 HZ PHE 61 HZ PHE 61 4.101 0.756 -3.689
468 H ALA 62 HN ALA 62 5.583 6.069 1.463
469 HA ALA 62 HA ALA 62 4.704 8.257 2.923
470 HB1 ALA 62 HB1 ALA 62 7.524 7.437 2.332
471 HB2 ALA 62 HB2 ALA 62 6.494 6.764 3.596
472 HB3 ALA 62 HB3 ALA 62 6.980 8.460 3.659
473 H ASP 63 HN ASP 63 5.693 8.216 -0.304
474 HA ASP 63 HA ASP 63 6.661 10.954 -0.311
475 HB2 ASP 63 HB2 ASP 63 7.050 10.657 -2.671
476 HB3 ASP 63 HB1 ASP 63 7.625 9.209 -1.849
477 H GLY 64 HN GLY 64 3.691 9.374 -0.351
478 HA2 GLY 64 HA2 GLY 64 1.688 10.619 -0.176
479 HA3 GLY 64 HA1 GLY 64 2.397 11.855 -1.197
480 H SER 65 HN SER 65 3.273 9.379 -2.948
481 HA SER 65 HA SER 65 0.837 9.531 -4.530
482 HB2 SER 65 HB2 SER 65 3.493 8.353 -5.300
483 HB3 SER 65 HB1 SER 65 2.167 8.830 -6.372
484 HG SER 65 HG SER 65 3.974 10.301 -4.918
485 H THR 66 HN THR 66 0.258 7.493 -5.788
486 HA THR 66 HA THR 66 0.225 5.244 -3.919
487 HB THR 66 HB THR 66 -1.976 4.795 -5.132
488 HG1 THR 66 HG1 THR 66 -2.551 7.379 -5.495
489 HG21 THR 66 HG21 THR 66 -1.850 5.451 -2.805
490 HG22 THR 66 HG22 THR 66 -3.194 6.273 -3.601
491 HG23 THR 66 HG23 THR 66 -1.690 7.148 -3.270
492 H LEU 67 HN LEU 67 0.104 3.215 -4.793
493 HA LEU 67 HA LEU 67 0.251 2.920 -7.685
494 HB2 LEU 67 HB2 LEU 67 1.754 1.266 -5.620
495 HB3 LEU 67 HB1 LEU 67 1.518 0.742 -7.268
496 HG LEU 67 HG LEU 67 3.173 3.123 -6.372
497 HD11 LEU 67 HD11 LEU 67 4.006 0.532 -7.674
498 HD12 LEU 67 HD12 LEU 67 4.211 0.889 -5.969
499 HD13 LEU 67 HD13 LEU 67 5.072 1.841 -7.177
500 HD21 LEU 67 HD21 LEU 67 2.619 2.064 -9.145
501 HD22 LEU 67 HD22 LEU 67 3.855 3.243 -8.729
502 HD23 LEU 67 HD23 LEU 67 2.159 3.652 -8.509
503 H THR 68 HN THR 68 -1.462 1.925 -8.400
504 HA THR 68 HA THR 68 -3.488 0.911 -6.782
505 HB THR 68 HB THR 68 -2.959 0.228 -9.695
506 HG1 THR 68 HG1 THR 68 -4.412 2.526 -8.772
507 HG21 THR 68 HG21 THR 68 -4.848 -0.953 -8.621
508 HG22 THR 68 HG22 THR 68 -5.428 0.198 -9.829
509 HG23 THR 68 HG23 THR 68 -5.522 0.594 -8.112
510 H ASN 69 HN ASN 69 -4.042 -1.190 -6.259
511 HA ASN 69 HA ASN 69 -2.825 -2.820 -4.901
512 HB2 ASN 69 HB2 ASN 69 -4.979 -3.351 -5.707
513 HB3 ASN 69 HB1 ASN 69 -4.343 -3.963 -7.236
514 HD21 ASN 69 HD21 ASN 69 -5.372 -6.002 -6.805
515 HD22 ASN 69 HD22 ASN 69 -4.670 -7.106 -5.686
516 HA PRO 70 HA PRO 70 0.938 -4.133 -7.040
517 HB2 PRO 70 HB2 PRO 70 2.547 -3.239 -5.064
518 HB3 PRO 70 HB1 PRO 70 2.001 -2.222 -6.395
519 HG2 PRO 70 HG2 PRO 70 1.339 -2.036 -3.601
520 HG3 PRO 70 HG1 PRO 70 0.876 -0.951 -4.920
521 HD2 PRO 70 HD2 PRO 70 -0.658 -3.094 -3.628
522 HD3 PRO 70 HD1 PRO 70 -1.214 -1.722 -4.616
523 H SER 71 HN SER 71 2.263 -5.811 -6.647
524 HA SER 71 HA SER 71 1.600 -7.502 -4.419
525 HB2 SER 71 HB2 SER 71 2.042 -8.409 -6.726
526 HB3 SER 71 HB1 SER 71 3.718 -7.884 -6.566
527 HG SER 71 HG SER 71 2.599 -10.125 -5.753
528 H ALA 72 HN ALA 72 3.734 -8.511 -3.401
529 HA ALA 72 HA ALA 72 4.767 -6.462 -1.756
530 HB1 ALA 72 HB1 ALA 72 5.688 -9.318 -2.047
531 HB2 ALA 72 HB2 ALA 72 4.436 -8.716 -0.947
532 HB3 ALA 72 HB3 ALA 72 6.109 -8.223 -0.730
533 H ASP 73 HN ASP 73 6.047 -8.070 -4.574
534 HA ASP 73 HA ASP 73 8.698 -7.073 -4.352
535 HB2 ASP 73 HB2 ASP 73 7.952 -9.007 -5.798
536 HB3 ASP 73 HB1 ASP 73 7.245 -7.829 -6.897
537 H GLU 74 HN GLU 74 5.760 -5.877 -5.786
538 HA GLU 74 HA GLU 74 6.867 -3.747 -7.299
539 HB2 GLU 74 HB2 GLU 74 4.083 -4.059 -6.181
540 HB3 GLU 74 HB1 GLU 74 4.554 -2.874 -7.387
541 HG2 GLU 74 HG2 GLU 74 4.594 -5.867 -7.713
542 HG3 GLU 74 HG1 GLU 74 3.401 -4.757 -8.383
543 H VAL 75 HN VAL 75 5.334 -3.872 -4.112
544 HA VAL 75 HA VAL 75 5.705 -1.128 -3.620
545 HB VAL 75 HB VAL 75 5.354 -1.724 -1.133
546 HG11 VAL 75 HG11 VAL 75 2.974 -2.195 -1.467
547 HG12 VAL 75 HG12 VAL 75 3.305 -2.646 -3.135
548 HG13 VAL 75 HG13 VAL 75 3.539 -0.975 -2.611
549 HG21 VAL 75 HG21 VAL 75 4.496 -3.921 -0.661
550 HG22 VAL 75 HG22 VAL 75 6.124 -4.074 -1.362
551 HG23 VAL 75 HG23 VAL 75 4.681 -4.359 -2.353
552 H LYS 76 HN LYS 76 7.763 -3.915 -2.843
553 HA LYS 76 HA LYS 76 9.659 -2.439 -1.345
554 HB2 LYS 76 HB2 LYS 76 9.906 -5.020 -2.867
555 HB3 LYS 76 HB1 LYS 76 11.257 -4.314 -1.998
556 HG2 LYS 76 HG2 LYS 76 9.942 -4.426 0.076
557 HG3 LYS 76 HG1 LYS 76 8.628 -5.184 -0.824
558 HD2 LYS 76 HD2 LYS 76 9.903 -6.888 0.333
559 HD3 LYS 76 HD1 LYS 76 10.150 -7.047 -1.404
560 HE2 LYS 76 HE2 LYS 76 12.241 -7.343 -0.180
561 HE3 LYS 76 HE1 LYS 76 12.321 -5.918 -1.204
562 HZ1 LYS 76 HZ1 LYS 76 13.258 -5.573 1.015
563 HZ2 LYS 76 HZ2 LYS 76 11.771 -5.862 1.733
564 HZ3 LYS 76 HZ3 LYS 76 11.976 -4.524 0.737
565 H ALA 77 HN ALA 77 9.300 -2.981 -4.765
566 HA ALA 77 HA ALA 77 11.778 -2.015 -5.597
567 HB1 ALA 77 HB1 ALA 77 10.747 -1.751 -7.777
568 HB2 ALA 77 HB2 ALA 77 9.147 -1.866 -7.047
569 HB3 ALA 77 HB3 ALA 77 10.223 -3.262 -7.030
570 H LYS 78 HN LYS 78 8.760 -0.303 -4.885
571 HA LYS 78 HA LYS 78 10.013 2.183 -5.682
572 HB2 LYS 78 HB2 LYS 78 7.461 1.652 -5.862
573 HB3 LYS 78 HB1 LYS 78 7.418 2.117 -4.159
574 HG2 LYS 78 HG2 LYS 78 8.721 4.227 -4.989
575 HG3 LYS 78 HG1 LYS 78 8.095 3.738 -6.550
576 HD2 LYS 78 HD2 LYS 78 5.815 3.907 -5.746
577 HD3 LYS 78 HD1 LYS 78 6.402 4.358 -4.138
578 HE2 LYS 78 HE2 LYS 78 7.595 6.280 -5.189
579 HE3 LYS 78 HE1 LYS 78 6.809 5.881 -6.707
580 HZ1 LYS 78 HZ1 LYS 78 5.654 7.608 -5.657
581 HZ2 LYS 78 HZ2 LYS 78 5.558 6.852 -4.202
582 HZ3 LYS 78 HZ3 LYS 78 4.644 6.258 -5.536
583 H LEU 79 HN LEU 79 9.085 0.575 -2.697
584 HA LEU 79 HA LEU 79 9.437 2.659 -0.883
585 HB2 LEU 79 HB2 LEU 79 8.270 0.538 -0.419
586 HB3 LEU 79 HB1 LEU 79 9.805 -0.295 -0.419
587 HG LEU 79 HG LEU 79 10.479 1.045 1.573
588 HD11 LEU 79 HD11 LEU 79 9.009 2.973 1.209
589 HD12 LEU 79 HD12 LEU 79 8.780 2.271 2.805
590 HD13 LEU 79 HD13 LEU 79 7.605 1.955 1.528
591 HD21 LEU 79 HD21 LEU 79 9.062 -0.175 3.149
592 HD22 LEU 79 HD22 LEU 79 9.552 -1.203 1.801
593 HD23 LEU 79 HD23 LEU 79 7.924 -0.532 1.851
594 H VAL 80 HN VAL 80 11.779 0.354 -2.148
595 HA VAL 80 HA VAL 80 13.895 0.832 -0.377
596 HB VAL 80 HB VAL 80 13.797 -1.042 -2.022
597 HG11 VAL 80 HG11 VAL 80 14.545 -0.724 -4.331
598 HG12 VAL 80 HG12 VAL 80 14.474 1.025 -4.092
599 HG13 VAL 80 HG13 VAL 80 13.006 0.058 -3.972
600 HG21 VAL 80 HG21 VAL 80 16.301 0.628 -2.150
601 HG22 VAL 80 HG22 VAL 80 16.182 -1.059 -2.648
602 HG23 VAL 80 HG23 VAL 80 15.900 -0.628 -0.963
603 H LYS 81 HN LYS 81 12.729 2.651 -3.080
604 HA LYS 81 HA LYS 81 15.069 4.282 -3.378
605 HB2 LYS 81 HB2 LYS 81 12.319 4.629 -4.552
606 HB3 LYS 81 HB1 LYS 81 13.800 5.435 -5.064
607 HG2 LYS 81 HG2 LYS 81 14.746 3.277 -5.729
608 HG3 LYS 81 HG1 LYS 81 13.261 2.474 -5.221
609 HD2 LYS 81 HD2 LYS 81 13.225 2.751 -7.600
610 HD3 LYS 81 HD1 LYS 81 12.024 3.829 -6.890
611 HE2 LYS 81 HE2 LYS 81 13.256 4.923 -8.665
612 HE3 LYS 81 HE1 LYS 81 13.578 5.696 -7.115
613 HZ1 LYS 81 HZ1 LYS 81 15.364 3.740 -8.468
614 HZ2 LYS 81 HZ2 LYS 81 15.725 4.552 -7.026
615 HZ3 LYS 81 HZ3 LYS 81 15.554 5.407 -8.470
616 H ILE 82 HN ILE 82 11.990 4.456 -1.747
617 HA ILE 82 HA ILE 82 12.015 7.268 -1.223
618 HB ILE 82 HB ILE 82 10.628 5.091 0.364
619 HG12 ILE 82 HG12 ILE 82 9.576 6.689 -1.987
620 HG13 ILE 82 HG11 ILE 82 10.023 4.979 -2.001
621 HG21 ILE 82 HG21 ILE 82 10.709 7.228 1.545
622 HG22 ILE 82 HG22 ILE 82 9.061 6.882 1.022
623 HG23 ILE 82 HG23 ILE 82 10.036 8.050 0.135
624 HD11 ILE 82 HD11 ILE 82 7.796 6.209 -0.409
625 HD12 ILE 82 HD12 ILE 82 8.233 4.501 -0.429
626 HD13 ILE 82 HD13 ILE 82 7.622 5.273 -1.894
627 H ALA 83 HN ALA 83 12.903 4.386 0.586
628 HA ALA 83 HA ALA 83 13.889 5.741 2.874
629 HB1 ALA 83 HB1 ALA 83 13.244 3.372 2.922
630 HB2 ALA 83 HB2 ALA 83 14.908 3.586 3.456
631 HB3 ALA 83 HB3 ALA 83 14.575 2.986 1.832
632 H GLY 84 HN GLY 84 15.184 4.921 -0.217
633 HA2 GLY 84 HA2 GLY 84 16.997 5.806 -1.318
634 HA3 GLY 84 HA1 GLY 84 17.349 6.758 0.119
635 H LEU 85 HN LEU 85 16.988 3.307 0.030
636 HA LEU 85 HA LEU 85 19.715 3.087 1.071
637 HB2 LEU 85 HB2 LEU 85 17.547 0.983 0.977
638 HB3 LEU 85 HB1 LEU 85 19.078 0.861 1.810
639 HG LEU 85 HG LEU 85 16.842 2.756 2.519
640 HD11 LEU 85 HD11 LEU 85 16.499 1.300 4.438
641 HD12 LEU 85 HD12 LEU 85 17.756 0.215 3.842
642 HD13 LEU 85 HD13 LEU 85 16.270 0.431 2.918
643 HD21 LEU 85 HD21 LEU 85 19.033 3.645 3.138
644 HD22 LEU 85 HD22 LEU 85 19.432 2.131 3.948
645 HD23 LEU 85 HD23 LEU 85 18.133 3.148 4.571
646 H GLU 86 HN GLU 86 18.657 3.343 -1.820
647 HA GLU 86 HA GLU 86 19.678 0.883 -2.999
648 HB2 GLU 86 HB2 GLU 86 18.927 1.783 -5.128
649 HB3 GLU 86 HB1 GLU 86 17.642 1.925 -3.943
650 HG2 GLU 86 HG2 GLU 86 18.068 4.267 -3.688
651 HG3 GLU 86 HG1 GLU 86 19.489 4.164 -4.726
652 H HIS 87 HN HIS 87 21.079 3.387 -1.709
653 HA HIS 87 HA HIS 87 23.165 3.732 -3.749
654 HB2 HIS 87 HB2 HIS 87 21.953 5.788 -2.935
655 HB3 HIS 87 HB1 HIS 87 22.535 5.436 -1.317
656 HD1 HIS 87 HD1 HIS 87 24.965 6.186 -0.766
657 HD2 HIS 87 HD2 HIS 87 23.885 6.710 -4.749
658 HE1 HIS 87 HE1 HIS 87 26.780 7.586 -1.814
659 H HIS 88 HN HIS 88 25.339 3.369 -3.029
660 HA HIS 88 HA HIS 88 25.483 2.180 -0.397
661 HB2 HIS 88 HB2 HIS 88 27.155 0.524 -1.174
662 HB3 HIS 88 HB1 HIS 88 25.614 0.322 -1.977
663 HD1 HIS 88 HD1 HIS 88 25.605 1.162 -4.601
664 HD2 HIS 88 HD2 HIS 88 29.303 0.742 -2.763
665 HE1 HIS 88 HE1 HIS 88 27.305 1.049 -6.457
Start of MODEL 16
1 H1 MET 1 HT1 MET 1 13.632 8.061 9.321
2 H2 MET 1 HT2 MET 1 14.974 7.810 8.355
3 H3 MET 1 HT3 MET 1 13.516 7.016 8.032
4 HA MET 1 HA MET 1 13.924 9.939 7.956
5 HB2 MET 1 HB2 MET 1 13.503 8.019 5.648
6 HB3 MET 1 HB1 MET 1 13.549 9.767 5.517
7 HG2 MET 1 HG2 MET 1 15.817 7.963 6.333
8 HG3 MET 1 HG1 MET 1 15.642 8.824 4.810
9 HE1 MET 1 HE1 MET 1 16.069 12.547 5.872
10 HE2 MET 1 HE2 MET 1 14.547 11.673 5.728
11 HE3 MET 1 HE3 MET 1 15.825 11.423 4.536
12 H VAL 2 HN VAL 2 11.684 7.422 6.698
13 HA VAL 2 HA VAL 2 9.538 9.311 7.247
14 HB VAL 2 HB VAL 2 8.149 7.973 5.714
15 HG11 VAL 2 HG11 VAL 2 9.502 9.772 4.779
16 HG12 VAL 2 HG12 VAL 2 9.323 8.453 3.622
17 HG13 VAL 2 HG13 VAL 2 10.830 8.646 4.518
18 HG21 VAL 2 HG21 VAL 2 10.603 6.245 5.328
19 HG22 VAL 2 HG22 VAL 2 9.116 6.134 4.388
20 HG23 VAL 2 HG23 VAL 2 9.100 5.750 6.111
21 H THR 3 HN THR 3 7.838 8.782 8.564
22 HA THR 3 HA THR 3 8.374 6.589 10.366
23 HB THR 3 HB THR 3 7.756 8.691 11.432
24 HG1 THR 3 HG1 THR 3 5.994 8.035 12.680
25 HG21 THR 3 HG21 THR 3 5.536 9.698 11.174
26 HG22 THR 3 HG22 THR 3 5.159 8.519 9.913
27 HG23 THR 3 HG23 THR 3 6.447 9.701 9.666
28 H ALA 4 HN ALA 4 6.141 7.432 7.850
29 HA ALA 4 HA ALA 4 5.014 4.748 8.033
30 HB1 ALA 4 HB1 ALA 4 3.709 7.259 6.950
31 HB2 ALA 4 HB2 ALA 4 3.284 6.447 8.457
32 HB3 ALA 4 HB3 ALA 4 3.003 5.644 6.912
33 H ALA 5 HN ALA 5 5.936 3.592 6.533
34 HA ALA 5 HA ALA 5 7.356 4.755 4.341
35 HB1 ALA 5 HB1 ALA 5 8.219 2.788 5.459
36 HB2 ALA 5 HB2 ALA 5 7.845 2.384 3.774
37 HB3 ALA 5 HB3 ALA 5 6.758 1.891 5.063
38 H LEU 6 HN LEU 6 4.563 2.602 4.628
39 HA LEU 6 HA LEU 6 3.364 3.845 2.363
40 HB2 LEU 6 HB2 LEU 6 2.873 1.741 1.182
41 HB3 LEU 6 HB1 LEU 6 4.573 2.125 1.170
42 HG LEU 6 HG LEU 6 3.364 0.064 3.041
43 HD11 LEU 6 HD11 LEU 6 4.604 -0.305 0.336
44 HD12 LEU 6 HD12 LEU 6 2.930 -0.671 0.795
45 HD13 LEU 6 HD13 LEU 6 4.259 -1.606 1.470
46 HD21 LEU 6 HD21 LEU 6 5.662 -0.763 3.161
47 HD22 LEU 6 HD22 LEU 6 5.548 0.915 3.693
48 HD23 LEU 6 HD23 LEU 6 6.185 0.542 2.093
49 H THR 7 HN THR 7 1.303 4.038 2.607
50 HA THR 7 HA THR 7 0.054 2.665 4.864
51 HB THR 7 HB THR 7 -0.809 5.167 3.416
52 HG1 THR 7 HG1 THR 7 1.132 4.706 5.222
53 HG21 THR 7 HG21 THR 7 -1.642 4.005 6.091
54 HG22 THR 7 HG22 THR 7 -2.617 3.994 4.624
55 HG23 THR 7 HG23 THR 7 -2.222 5.525 5.408
56 H ILE 8 HN ILE 8 -1.270 1.114 4.325
57 HA ILE 8 HA ILE 8 -2.159 0.813 1.590
58 HB ILE 8 HB ILE 8 -2.315 -1.007 3.985
59 HG12 ILE 8 HG12 ILE 8 -0.764 -1.233 1.409
60 HG13 ILE 8 HG11 ILE 8 -0.099 -0.737 2.964
61 HG21 ILE 8 HG21 ILE 8 -3.409 -1.432 1.233
62 HG22 ILE 8 HG22 ILE 8 -4.243 -1.442 2.807
63 HG23 ILE 8 HG23 ILE 8 -3.100 -2.732 2.394
64 HD11 ILE 8 HD11 ILE 8 -0.620 -2.907 3.896
65 HD12 ILE 8 HD12 ILE 8 0.385 -3.043 2.449
66 HD13 ILE 8 HD13 ILE 8 -1.339 -3.403 2.360
67 H TYR 9 HN TYR 9 -4.043 1.398 0.918
68 HA TYR 9 HA TYR 9 -6.216 1.850 2.809
69 HB2 TYR 9 HB2 TYR 9 -5.755 2.846 -0.002
70 HB3 TYR 9 HB1 TYR 9 -7.256 3.049 0.858
71 HD1 TYR 9 HD1 TYR 9 -6.511 3.884 3.498
72 HD2 TYR 9 HD2 TYR 9 -4.735 4.862 -0.231
73 HE1 TYR 9 HE1 TYR 9 -5.745 6.004 4.439
74 HE2 TYR 9 HE2 TYR 9 -3.955 6.974 0.682
75 HH TYR 9 HH TYR 9 -4.684 8.521 2.543
76 H THR 10 HN THR 10 -7.512 0.215 3.054
77 HA THR 10 HA THR 10 -8.666 -1.003 0.728
78 HB THR 10 HB THR 10 -6.689 -2.420 1.014
79 HG1 THR 10 HG1 THR 10 -8.964 -3.827 1.994
80 HG21 THR 10 HG21 THR 10 -6.320 -3.741 3.051
81 HG22 THR 10 HG22 THR 10 -7.698 -2.951 3.811
82 HG23 THR 10 HG23 THR 10 -6.263 -2.012 3.404
83 H THR 11 HN THR 11 -10.533 -2.330 1.301
84 HA THR 11 HA THR 11 -11.813 -1.568 3.805
85 HB THR 11 HB THR 11 -13.670 -2.909 2.603
86 HG1 THR 11 HG1 THR 11 -13.394 -2.921 0.319
87 HG21 THR 11 HG21 THR 11 -12.734 -0.277 1.454
88 HG22 THR 11 HG22 THR 11 -13.691 -0.472 2.917
89 HG23 THR 11 HG23 THR 11 -14.374 -0.925 1.353
90 H SER 12 HN SER 12 -12.606 -3.016 5.181
91 HA SER 12 HA SER 12 -11.100 -5.350 5.617
92 HB2 SER 12 HB2 SER 12 -13.738 -4.500 6.825
93 HB3 SER 12 HB1 SER 12 -12.605 -5.662 7.519
94 HG SER 12 HG SER 12 -12.000 -2.910 7.001
95 H TRP 13 HN TRP 13 -13.977 -4.676 3.825
96 HA TRP 13 HA TRP 13 -14.705 -7.458 3.682
97 HB2 TRP 13 HB2 TRP 13 -16.572 -6.706 2.206
98 HB3 TRP 13 HB1 TRP 13 -16.576 -5.997 3.810
99 HD1 TRP 13 HD1 TRP 13 -16.633 -3.401 3.945
100 HE1 TRP 13 HE1 TRP 13 -16.748 -1.514 2.213
101 HE3 TRP 13 HE3 TRP 13 -15.600 -6.097 -0.292
102 HZ2 TRP 13 HZ2 TRP 13 -16.429 -1.193 -0.568
103 HZ3 TRP 13 HZ3 TRP 13 -15.532 -4.912 -2.446
104 HH2 TRP 13 HH2 TRP 13 -15.934 -2.514 -2.576
105 H CYS 14 HN CYS 14 -12.364 -5.759 2.212
106 HA CYS 14 HA CYS 14 -12.711 -6.660 -0.485
107 HB2 CYS 14 HB2 CYS 14 -11.381 -4.647 -0.006
108 HB3 CYS 14 HB1 CYS 14 -10.271 -5.587 0.975
109 HG CYS 14 HG CYS 14 -10.368 -5.105 -2.299
110 H GLY 15 HN GLY 15 -11.677 -8.428 -1.462
111 HA2 GLY 15 HA2 GLY 15 -10.954 -10.573 0.322
112 HA3 GLY 15 HA1 GLY 15 -11.057 -10.660 -1.433
113 H TYR 16 HN TYR 16 -9.383 -8.329 -1.804
114 HA TYR 16 HA TYR 16 -6.868 -9.707 -1.842
115 HB2 TYR 16 HB2 TYR 16 -7.699 -6.998 -2.786
116 HB3 TYR 16 HB1 TYR 16 -6.031 -7.539 -2.867
117 HD1 TYR 16 HD2 TYR 16 -6.279 -10.279 -3.779
118 HD2 TYR 16 HD1 TYR 16 -8.490 -6.845 -4.927
119 HE1 TYR 16 HE2 TYR 16 -6.720 -11.300 -5.958
120 HE2 TYR 16 HE1 TYR 16 -8.944 -7.862 -7.111
121 HH TYR 16 HH TYR 16 -8.309 -11.144 -7.740
122 H CYS 17 HN CYS 17 -8.321 -7.866 0.494
123 HA CYS 17 HA CYS 17 -6.312 -6.114 1.312
124 HB2 CYS 17 HB2 CYS 17 -7.429 -6.063 3.512
125 HB3 CYS 17 HB1 CYS 17 -8.576 -5.920 2.194
126 HG CYS 17 HG CYS 17 -9.949 -8.136 2.665
127 H LEU 18 HN LEU 18 -7.038 -9.293 2.626
128 HA LEU 18 HA LEU 18 -4.655 -9.335 4.136
129 HB2 LEU 18 HB2 LEU 18 -5.350 -11.781 4.541
130 HB3 LEU 18 HB1 LEU 18 -6.331 -10.494 5.196
131 HG LEU 18 HG LEU 18 -7.893 -10.810 3.239
132 HD11 LEU 18 HD11 LEU 18 -7.841 -12.932 2.058
133 HD12 LEU 18 HD12 LEU 18 -6.279 -13.301 2.800
134 HD13 LEU 18 HD13 LEU 18 -6.444 -11.916 1.714
135 HD21 LEU 18 HD21 LEU 18 -7.506 -13.143 5.093
136 HD22 LEU 18 HD22 LEU 18 -8.972 -12.778 4.184
137 HD23 LEU 18 HD23 LEU 18 -8.410 -11.667 5.436
138 H ARG 19 HN ARG 19 -5.348 -10.172 0.929
139 HA ARG 19 HA ARG 19 -3.326 -12.144 0.547
140 HB2 ARG 19 HB2 ARG 19 -4.364 -10.240 -1.568
141 HB3 ARG 19 HB1 ARG 19 -3.629 -11.811 -1.829
142 HG2 ARG 19 HG2 ARG 19 -6.321 -11.294 -0.570
143 HG3 ARG 19 HG1 ARG 19 -6.037 -11.870 -2.208
144 HD2 ARG 19 HD2 ARG 19 -5.189 -13.345 0.279
145 HD3 ARG 19 HD1 ARG 19 -6.723 -13.602 -0.533
146 HE ARG 19 HE ARG 19 -4.726 -13.916 -2.425
147 HH11 ARG 19 HH11 ARG 19 -5.736 -15.502 0.606
148 HH12 ARG 19 HH12 ARG 19 -5.331 -17.058 0.084
149 HH21 ARG 19 HH21 ARG 19 -4.162 -16.071 -3.104
150 HH22 ARG 19 HH22 ARG 19 -4.411 -17.405 -2.067
151 H LEU 20 HN LEU 20 -3.499 -8.646 0.015
152 HA LEU 20 HA LEU 20 -0.826 -8.317 -0.807
153 HB2 LEU 20 HB2 LEU 20 -2.536 -6.651 -1.315
154 HB3 LEU 20 HB1 LEU 20 -2.782 -6.347 0.385
155 HG LEU 20 HG LEU 20 -0.558 -5.399 0.566
156 HD11 LEU 20 HD11 LEU 20 -0.383 -5.785 -2.429
157 HD12 LEU 20 HD12 LEU 20 0.631 -6.570 -1.216
158 HD13 LEU 20 HD13 LEU 20 0.745 -4.833 -1.477
159 HD21 LEU 20 HD21 LEU 20 -0.964 -3.325 -0.672
160 HD22 LEU 20 HD22 LEU 20 -2.425 -3.916 0.120
161 HD23 LEU 20 HD23 LEU 20 -2.200 -4.145 -1.619
162 H LYS 21 HN LYS 21 -2.351 -8.314 2.361
163 HA LYS 21 HA LYS 21 -0.176 -7.317 3.887
164 HB2 LYS 21 HB2 LYS 21 -2.116 -9.453 4.795
165 HB3 LYS 21 HB1 LYS 21 -1.173 -8.382 5.812
166 HG2 LYS 21 HG2 LYS 21 -3.447 -7.594 4.014
167 HG3 LYS 21 HG1 LYS 21 -3.505 -7.743 5.765
168 HD2 LYS 21 HD2 LYS 21 -1.891 -5.888 5.954
169 HD3 LYS 21 HD1 LYS 21 -1.835 -5.790 4.199
170 HE2 LYS 21 HE2 LYS 21 -3.353 -4.110 5.161
171 HE3 LYS 21 HE1 LYS 21 -4.183 -5.249 4.085
172 HZ1 LYS 21 HZ1 LYS 21 -4.221 -5.221 7.056
173 HZ2 LYS 21 HZ2 LYS 21 -4.948 -6.425 6.141
174 HZ3 LYS 21 HZ3 LYS 21 -5.492 -4.856 6.041
175 H THR 22 HN THR 22 -1.116 -10.557 2.927
176 HA THR 22 HA THR 22 0.904 -12.021 4.200
177 HB THR 22 HB THR 22 -0.451 -12.717 1.568
178 HG1 THR 22 HG1 THR 22 -1.987 -12.207 3.251
179 HG21 THR 22 HG21 THR 22 1.438 -14.188 2.190
180 HG22 THR 22 HG22 THR 22 -0.100 -15.042 2.285
181 HG23 THR 22 HG23 THR 22 0.686 -14.474 3.758
182 H ALA 23 HN ALA 23 0.722 -10.509 1.015
183 HA ALA 23 HA ALA 23 3.153 -11.450 -0.018
184 HB1 ALA 23 HB1 ALA 23 1.698 -8.902 -0.701
185 HB2 ALA 23 HB2 ALA 23 1.338 -10.488 -1.363
186 HB3 ALA 23 HB3 ALA 23 2.897 -9.734 -1.701
187 H LEU 24 HN LEU 24 2.366 -8.411 1.638
188 HA LEU 24 HA LEU 24 5.031 -7.450 1.394
189 HB2 LEU 24 HB2 LEU 24 2.902 -6.518 3.292
190 HB3 LEU 24 HB1 LEU 24 4.379 -5.670 2.947
191 HG LEU 24 HG LEU 24 1.995 -6.029 1.134
192 HD11 LEU 24 HD11 LEU 24 1.965 -3.570 1.288
193 HD12 LEU 24 HD12 LEU 24 3.329 -3.673 2.398
194 HD13 LEU 24 HD13 LEU 24 1.784 -4.376 2.860
195 HD21 LEU 24 HD21 LEU 24 4.646 -4.723 0.519
196 HD22 LEU 24 HD22 LEU 24 3.189 -4.557 -0.436
197 HD23 LEU 24 HD23 LEU 24 3.969 -6.123 -0.331
198 H THR 25 HN THR 25 3.317 -8.942 4.127
199 HA THR 25 HA THR 25 5.445 -8.608 5.906
200 HB THR 25 HB THR 25 3.207 -10.659 5.931
201 HG1 THR 25 HG1 THR 25 3.562 -8.174 7.231
202 HG21 THR 25 HG21 THR 25 5.000 -9.716 8.192
203 HG22 THR 25 HG22 THR 25 5.067 -11.311 7.443
204 HG23 THR 25 HG23 THR 25 3.638 -10.826 8.355
205 H ALA 26 HN ALA 26 4.791 -11.177 3.565
206 HA ALA 26 HA ALA 26 6.889 -12.880 4.495
207 HB1 ALA 26 HB1 ALA 26 6.522 -14.137 2.436
208 HB2 ALA 26 HB2 ALA 26 5.513 -12.834 1.810
209 HB3 ALA 26 HB3 ALA 26 4.986 -13.758 3.218
210 H ASN 27 HN ASN 27 6.906 -9.974 2.854
211 HA ASN 27 HA ASN 27 9.521 -10.541 1.664
212 HB2 ASN 27 HB2 ASN 27 7.344 -8.676 0.820
213 HB3 ASN 27 HB1 ASN 27 9.016 -8.324 0.396
214 HD21 ASN 27 HD21 ASN 27 6.353 -10.528 -0.069
215 HD22 ASN 27 HD22 ASN 27 7.021 -11.326 -1.451
216 H ARG 28 HN ARG 28 8.558 -9.629 4.434
217 HA ARG 28 HA ARG 28 9.498 -8.529 6.186
218 HB2 ARG 28 HB2 ARG 28 11.759 -8.204 4.221
219 HB3 ARG 28 HB1 ARG 28 11.862 -7.664 5.885
220 HG2 ARG 28 HG2 ARG 28 11.375 -10.501 4.995
221 HG3 ARG 28 HG1 ARG 28 12.925 -9.845 5.527
222 HD2 ARG 28 HD2 ARG 28 10.404 -10.110 7.178
223 HD3 ARG 28 HD1 ARG 28 11.890 -11.035 7.354
224 HE ARG 28 HE ARG 28 12.506 -8.317 7.580
225 HH11 ARG 28 HH11 ARG 28 10.872 -10.861 9.458
226 HH12 ARG 28 HH12 ARG 28 11.089 -10.075 10.935
227 HH21 ARG 28 HH21 ARG 28 12.807 -7.273 9.609
228 HH22 ARG 28 HH22 ARG 28 12.252 -7.980 11.052
229 H ILE 29 HN ILE 29 7.804 -7.044 4.335
230 HA ILE 29 HA ILE 29 8.965 -4.379 4.298
231 HB ILE 29 HB ILE 29 6.279 -5.331 3.312
232 HG12 ILE 29 HG12 ILE 29 8.783 -4.742 1.715
233 HG13 ILE 29 HG11 ILE 29 8.297 -6.364 2.205
234 HG21 ILE 29 HG21 ILE 29 7.801 -2.764 2.767
235 HG22 ILE 29 HG22 ILE 29 6.439 -2.909 3.846
236 HG23 ILE 29 HG23 ILE 29 6.212 -3.183 2.108
237 HD11 ILE 29 HD11 ILE 29 7.717 -5.945 -0.047
238 HD12 ILE 29 HD12 ILE 29 6.836 -4.478 0.392
239 HD13 ILE 29 HD13 ILE 29 6.248 -6.066 0.911
240 H ALA 30 HN ALA 30 8.511 -2.845 5.719
241 HA ALA 30 HA ALA 30 6.532 -3.305 7.795
242 HB1 ALA 30 HB1 ALA 30 7.555 -1.292 8.786
243 HB2 ALA 30 HB2 ALA 30 8.558 -1.139 7.338
244 HB3 ALA 30 HB3 ALA 30 8.777 -2.523 8.414
245 H TYR 31 HN TYR 31 4.594 -2.220 7.742
246 HA TYR 31 HA TYR 31 4.268 0.054 5.981
247 HB2 TYR 31 HB2 TYR 31 2.321 -0.992 4.816
248 HB3 TYR 31 HB1 TYR 31 3.864 -1.731 4.415
249 HD1 TYR 31 HD1 TYR 31 0.636 -2.225 6.103
250 HD2 TYR 31 HD2 TYR 31 4.347 -4.008 5.071
251 HE1 TYR 31 HE1 TYR 31 -0.295 -4.440 6.621
252 HE2 TYR 31 HE2 TYR 31 3.434 -6.237 5.594
253 HH TYR 31 HH TYR 31 1.704 -7.321 6.694
254 H ASP 32 HN ASP 32 1.845 0.736 6.070
255 HA ASP 32 HA ASP 32 0.773 0.207 8.753
256 HB2 ASP 32 HB2 ASP 32 1.937 2.483 8.500
257 HB3 ASP 32 HB1 ASP 32 0.660 2.899 7.360
258 H GLU 33 HN GLU 33 -1.462 -0.078 8.762
259 HA GLU 33 HA GLU 33 -2.808 0.048 6.139
260 HB2 GLU 33 HB2 GLU 33 -3.939 -2.079 6.799
261 HB3 GLU 33 HB1 GLU 33 -2.217 -2.244 6.506
262 HG2 GLU 33 HG2 GLU 33 -1.809 -2.229 8.926
263 HG3 GLU 33 HG1 GLU 33 -3.541 -2.082 9.216
264 H VAL 34 HN VAL 34 -4.766 0.996 6.148
265 HA VAL 34 HA VAL 34 -6.238 1.158 8.632
266 HB VAL 34 HB VAL 34 -4.910 3.265 8.459
267 HG11 VAL 34 HG11 VAL 34 -4.707 3.472 6.063
268 HG12 VAL 34 HG12 VAL 34 -5.354 4.938 6.788
269 HG13 VAL 34 HG13 VAL 34 -6.436 3.843 5.939
270 HG21 VAL 34 HG21 VAL 34 -7.870 3.690 8.109
271 HG22 VAL 34 HG22 VAL 34 -6.739 4.882 8.746
272 HG23 VAL 34 HG23 VAL 34 -7.023 3.379 9.628
273 H ASP 35 HN ASP 35 -8.590 1.504 8.245
274 HA ASP 35 HA ASP 35 -9.274 0.276 5.699
275 HB2 ASP 35 HB2 ASP 35 -10.298 -0.521 7.872
276 HB3 ASP 35 HB1 ASP 35 -11.128 1.027 7.976
277 H ILE 36 HN ILE 36 -10.530 1.216 4.205
278 HA ILE 36 HA ILE 36 -10.333 4.090 4.171
279 HB ILE 36 HB ILE 36 -10.942 4.010 1.833
280 HG12 ILE 36 HG12 ILE 36 -11.207 1.040 2.240
281 HG13 ILE 36 HG11 ILE 36 -12.575 2.123 1.956
282 HG21 ILE 36 HG21 ILE 36 -8.677 3.700 2.343
283 HG22 ILE 36 HG22 ILE 36 -9.079 2.401 1.175
284 HG23 ILE 36 HG23 ILE 36 -8.964 2.057 2.885
285 HD11 ILE 36 HD11 ILE 36 -11.637 2.625 -0.260
286 HD12 ILE 36 HD12 ILE 36 -11.976 0.908 -0.067
287 HD13 ILE 36 HD13 ILE 36 -10.319 1.498 0.051
288 H GLU 37 HN GLU 37 -12.877 1.806 4.603
289 HA GLU 37 HA GLU 37 -14.872 3.657 3.670
290 HB2 GLU 37 HB2 GLU 37 -14.845 1.141 3.403
291 HB3 GLU 37 HB1 GLU 37 -15.254 1.041 5.108
292 HG2 GLU 37 HG2 GLU 37 -17.344 2.122 4.721
293 HG3 GLU 37 HG1 GLU 37 -16.912 2.459 3.043
294 H HIS 38 HN HIS 38 -13.188 2.967 6.443
295 HA HIS 38 HA HIS 38 -15.082 4.189 8.281
296 HB2 HIS 38 HB2 HIS 38 -12.338 2.982 8.670
297 HB3 HIS 38 HB1 HIS 38 -13.225 3.781 9.962
298 HD1 HIS 38 HD1 HIS 38 -13.644 0.766 7.610
299 HD2 HIS 38 HD2 HIS 38 -14.901 2.180 11.322
300 HE1 HIS 38 HE1 HIS 38 -14.953 -1.095 8.662
301 H ASN 39 HN ASN 39 -12.968 5.348 6.024
302 HA ASN 39 HA ASN 39 -12.611 7.840 7.510
303 HB2 ASN 39 HB2 ASN 39 -10.447 6.424 5.940
304 HB3 ASN 39 HB1 ASN 39 -10.336 8.115 6.408
305 HD21 ASN 39 HD21 ASN 39 -10.041 4.829 7.395
306 HD22 ASN 39 HD22 ASN 39 -9.508 5.154 8.993
307 H ARG 40 HN ARG 40 -13.876 9.157 6.433
308 HA ARG 40 HA ARG 40 -14.959 8.864 3.919
309 HB2 ARG 40 HB2 ARG 40 -15.796 10.392 5.619
310 HB3 ARG 40 HB1 ARG 40 -14.391 11.423 5.397
311 HG2 ARG 40 HG2 ARG 40 -15.128 11.725 3.013
312 HG3 ARG 40 HG1 ARG 40 -16.627 10.905 3.458
313 HD2 ARG 40 HD2 ARG 40 -16.943 13.289 3.610
314 HD3 ARG 40 HD1 ARG 40 -16.979 12.587 5.230
315 HE ARG 40 HE ARG 40 -14.590 13.874 4.095
316 HH11 ARG 40 HH11 ARG 40 -16.728 13.330 6.879
317 HH12 ARG 40 HH12 ARG 40 -15.987 14.508 7.851
318 HH21 ARG 40 HH21 ARG 40 -13.550 15.447 5.457
319 HH22 ARG 40 HH22 ARG 40 -14.130 15.723 7.036
320 H ALA 41 HN ALA 41 -12.188 10.897 4.814
321 HA ALA 41 HA ALA 41 -11.744 11.916 2.221
322 HB1 ALA 41 HB1 ALA 41 -11.020 13.078 4.271
323 HB2 ALA 41 HB2 ALA 41 -9.715 12.849 3.109
324 HB3 ALA 41 HB3 ALA 41 -9.816 11.814 4.531
325 H ALA 42 HN ALA 42 -10.444 9.220 4.013
326 HA ALA 42 HA ALA 42 -8.394 8.663 2.130
327 HB1 ALA 42 HB1 ALA 42 -9.680 6.715 4.052
328 HB2 ALA 42 HB2 ALA 42 -8.328 7.775 4.441
329 HB3 ALA 42 HB3 ALA 42 -8.140 6.524 3.207
330 H ALA 43 HN ALA 43 -11.682 7.498 2.588
331 HA ALA 43 HA ALA 43 -11.735 5.557 0.580
332 HB1 ALA 43 HB1 ALA 43 -14.155 5.719 0.710
333 HB2 ALA 43 HB2 ALA 43 -14.009 7.239 1.597
334 HB3 ALA 43 HB3 ALA 43 -13.437 5.739 2.321
335 H GLU 44 HN GLU 44 -12.536 9.016 0.422
336 HA GLU 44 HA GLU 44 -13.352 8.791 -2.269
337 HB2 GLU 44 HB2 GLU 44 -13.450 11.257 -2.302
338 HB3 GLU 44 HB1 GLU 44 -14.317 10.515 -0.971
339 HG2 GLU 44 HG2 GLU 44 -13.408 12.221 0.000
340 HG3 GLU 44 HG1 GLU 44 -12.176 10.997 0.342
341 H PHE 45 HN PHE 45 -10.348 9.168 -0.809
342 HA PHE 45 HA PHE 45 -8.925 10.086 -3.104
343 HB2 PHE 45 HB2 PHE 45 -8.048 10.483 -0.856
344 HB3 PHE 45 HB1 PHE 45 -8.044 8.764 -0.531
345 HD1 PHE 45 HD2 PHE 45 -6.558 11.245 -2.883
346 HD2 PHE 45 HD1 PHE 45 -6.079 7.577 -0.772
347 HE1 PHE 45 HE2 PHE 45 -4.239 11.113 -3.652
348 HE2 PHE 45 HE1 PHE 45 -3.758 7.454 -1.530
349 HZ PHE 45 HZ PHE 45 -2.829 9.219 -2.971
350 H VAL 46 HN VAL 46 -8.975 6.989 -1.394
351 HA VAL 46 HA VAL 46 -7.575 5.555 -3.372
352 HB VAL 46 HB VAL 46 -7.550 4.703 -1.116
353 HG11 VAL 46 HG11 VAL 46 -10.483 4.293 -1.447
354 HG12 VAL 46 HG12 VAL 46 -9.695 5.513 -0.408
355 HG13 VAL 46 HG13 VAL 46 -9.477 3.780 -0.091
356 HG21 VAL 46 HG21 VAL 46 -7.527 3.081 -2.979
357 HG22 VAL 46 HG22 VAL 46 -9.249 2.786 -2.633
358 HG23 VAL 46 HG23 VAL 46 -8.026 2.429 -1.411
359 H GLY 47 HN GLY 47 -11.034 6.034 -2.919
360 HA2 GLY 47 HA2 GLY 47 -11.887 4.052 -4.724
361 HA3 GLY 47 HA1 GLY 47 -12.811 5.462 -4.234
362 H SER 48 HN SER 48 -10.861 7.365 -5.206
363 HA SER 48 HA SER 48 -11.813 7.462 -7.892
364 HB2 SER 48 HB2 SER 48 -9.915 9.308 -6.438
365 HB3 SER 48 HB1 SER 48 -10.776 9.662 -7.940
366 HG SER 48 HG SER 48 -11.629 9.846 -5.378
367 H VAL 49 HN VAL 49 -8.825 6.581 -6.321
368 HA VAL 49 HA VAL 49 -7.403 6.522 -8.885
369 HB VAL 49 HB VAL 49 -5.356 6.136 -7.589
370 HG11 VAL 49 HG11 VAL 49 -7.026 8.345 -6.452
371 HG12 VAL 49 HG12 VAL 49 -6.038 8.436 -7.918
372 HG13 VAL 49 HG13 VAL 49 -5.272 8.242 -6.330
373 HG21 VAL 49 HG21 VAL 49 -5.349 6.098 -5.150
374 HG22 VAL 49 HG22 VAL 49 -6.362 4.784 -5.780
375 HG23 VAL 49 HG23 VAL 49 -7.105 6.254 -5.150
376 H ASN 50 HN ASN 50 -9.478 4.607 -7.654
377 HA ASN 50 HA ASN 50 -8.013 2.103 -7.494
378 HB2 ASN 50 HB2 ASN 50 -10.485 3.053 -6.490
379 HB3 ASN 50 HB1 ASN 50 -10.882 1.768 -7.624
380 HD21 ASN 50 HD21 ASN 50 -8.097 2.113 -5.556
381 HD22 ASN 50 HD22 ASN 50 -8.373 0.680 -4.645
382 H GLY 51 HN GLY 51 -9.555 0.263 -8.669
383 HA2 GLY 51 HA2 GLY 51 -9.800 1.061 -11.486
384 HA3 GLY 51 HA1 GLY 51 -9.406 -0.567 -10.933
385 H GLY 52 HN GLY 52 -11.929 1.848 -11.155
386 HA2 GLY 52 HA2 GLY 52 -14.155 1.180 -11.746
387 HA3 GLY 52 HA1 GLY 52 -13.919 -0.282 -10.787
388 H ASN 53 HN ASN 53 -14.874 -0.255 -8.894
389 HA ASN 53 HA ASN 53 -15.533 2.293 -7.593
390 HB2 ASN 53 HB2 ASN 53 -16.361 -0.565 -6.940
391 HB3 ASN 53 HB1 ASN 53 -16.880 0.852 -6.041
392 HD21 ASN 53 HD21 ASN 53 -18.429 2.215 -6.949
393 HD22 ASN 53 HD22 ASN 53 -19.360 1.734 -8.325
394 H ARG 54 HN ARG 54 -15.331 1.761 -4.920
395 HA ARG 54 HA ARG 54 -12.491 1.303 -4.752
396 HB2 ARG 54 HB2 ARG 54 -12.454 2.190 -2.542
397 HB3 ARG 54 HB1 ARG 54 -13.658 3.147 -3.359
398 HG2 ARG 54 HG2 ARG 54 -14.217 0.893 -1.422
399 HG3 ARG 54 HG1 ARG 54 -14.234 2.603 -1.031
400 HD2 ARG 54 HD2 ARG 54 -16.129 2.919 -2.550
401 HD3 ARG 54 HD1 ARG 54 -16.082 1.199 -2.960
402 HE ARG 54 HE ARG 54 -16.296 1.058 -0.332
403 HH11 ARG 54 HH11 ARG 54 -18.178 3.011 -2.601
404 HH12 ARG 54 HH12 ARG 54 -19.543 3.097 -1.588
405 HH21 ARG 54 HH21 ARG 54 -18.166 1.166 1.046
406 HH22 ARG 54 HH22 ARG 54 -19.538 2.025 0.518
407 H THR 55 HN THR 55 -11.893 -0.646 -4.986
408 HA THR 55 HA THR 55 -13.095 -2.691 -3.284
409 HB THR 55 HB THR 55 -14.353 -2.804 -5.351
410 HG1 THR 55 HG1 THR 55 -13.934 -4.785 -4.400
411 HG21 THR 55 HG21 THR 55 -12.756 -1.796 -6.889
412 HG22 THR 55 HG22 THR 55 -13.267 -3.368 -7.511
413 HG23 THR 55 HG23 THR 55 -11.692 -3.189 -6.734
414 H VAL 56 HN VAL 56 -10.284 -1.570 -5.082
415 HA VAL 56 HA VAL 56 -8.904 -3.950 -4.142
416 HB VAL 56 HB VAL 56 -7.102 -3.416 -5.842
417 HG11 VAL 56 HG11 VAL 56 -9.858 -4.052 -6.902
418 HG12 VAL 56 HG12 VAL 56 -8.715 -5.204 -6.220
419 HG13 VAL 56 HG13 VAL 56 -8.339 -4.381 -7.733
420 HG21 VAL 56 HG21 VAL 56 -7.739 -2.039 -7.765
421 HG22 VAL 56 HG22 VAL 56 -7.667 -1.097 -6.275
422 HG23 VAL 56 HG23 VAL 56 -9.229 -1.588 -6.935
423 HA PRO 57 HA PRO 57 -6.626 -1.651 -1.212
424 HB2 PRO 57 HB2 PRO 57 -4.305 -3.169 -1.263
425 HB3 PRO 57 HB1 PRO 57 -5.737 -3.578 -0.318
426 HG2 PRO 57 HG2 PRO 57 -4.851 -4.628 -2.956
427 HG3 PRO 57 HG1 PRO 57 -5.636 -5.474 -1.614
428 HD2 PRO 57 HD2 PRO 57 -6.964 -4.728 -3.825
429 HD3 PRO 57 HD1 PRO 57 -7.746 -4.736 -2.224
430 H THR 58 HN THR 58 -5.707 0.180 -1.577
431 HA THR 58 HA THR 58 -3.764 0.476 -3.785
432 HB THR 58 HB THR 58 -5.428 2.572 -2.447
433 HG1 THR 58 HG1 THR 58 -6.364 0.670 -3.817
434 HG21 THR 58 HG21 THR 58 -4.984 3.872 -4.466
435 HG22 THR 58 HG22 THR 58 -4.039 2.552 -5.141
436 HG23 THR 58 HG23 THR 58 -3.475 3.409 -3.687
437 H VAL 59 HN VAL 59 -1.881 1.130 -3.291
438 HA VAL 59 HA VAL 59 -1.432 1.553 -0.470
439 HB VAL 59 HB VAL 59 -0.348 -0.401 -1.383
440 HG11 VAL 59 HG11 VAL 59 1.455 -0.250 -3.027
441 HG12 VAL 59 HG12 VAL 59 1.053 1.452 -3.280
442 HG13 VAL 59 HG13 VAL 59 -0.121 0.196 -3.688
443 HG21 VAL 59 HG21 VAL 59 0.718 0.687 0.375
444 HG22 VAL 59 HG22 VAL 59 1.481 1.831 -0.751
445 HG23 VAL 59 HG23 VAL 59 1.953 0.111 -0.771
446 H LYS 60 HN LYS 60 -0.945 3.491 0.209
447 HA LYS 60 HA LYS 60 -0.066 5.515 -1.731
448 HB2 LYS 60 HB2 LYS 60 -2.082 5.982 -0.175
449 HB3 LYS 60 HB1 LYS 60 -0.919 5.960 1.132
450 HG2 LYS 60 HG2 LYS 60 0.342 7.788 0.022
451 HG3 LYS 60 HG1 LYS 60 -0.924 7.873 -1.198
452 HD2 LYS 60 HD2 LYS 60 -1.313 9.604 0.411
453 HD3 LYS 60 HD1 LYS 60 -2.554 8.383 0.639
454 HE2 LYS 60 HE2 LYS 60 -1.332 7.456 2.531
455 HE3 LYS 60 HE1 LYS 60 -0.022 8.608 2.257
456 HZ1 LYS 60 HZ1 LYS 60 -1.599 10.394 2.758
457 HZ2 LYS 60 HZ2 LYS 60 -1.413 9.348 4.046
458 HZ3 LYS 60 HZ3 LYS 60 -2.805 9.263 3.107
459 H PHE 61 HN PHE 61 2.007 5.853 -1.760
460 HA PHE 61 HA PHE 61 3.653 4.908 0.415
461 HB2 PHE 61 HB2 PHE 61 4.326 6.134 -2.241
462 HB3 PHE 61 HB1 PHE 61 5.522 5.677 -1.036
463 HD1 PHE 61 HD2 PHE 61 2.894 4.394 -3.266
464 HD2 PHE 61 HD1 PHE 61 6.208 3.465 -0.777
465 HE1 PHE 61 HE2 PHE 61 2.917 2.120 -4.154
466 HE2 PHE 61 HE1 PHE 61 6.242 1.179 -1.667
467 HZ PHE 61 HZ PHE 61 4.601 0.510 -3.355
468 H ALA 62 HN ALA 62 5.388 6.288 1.230
469 HA ALA 62 HA ALA 62 4.484 8.612 2.412
470 HB1 ALA 62 HB1 ALA 62 7.336 7.795 1.911
471 HB2 ALA 62 HB2 ALA 62 6.333 7.261 3.261
472 HB3 ALA 62 HB3 ALA 62 6.783 8.961 3.110
473 H ASP 63 HN ASP 63 5.720 8.216 -0.803
474 HA ASP 63 HA ASP 63 6.518 10.999 -1.039
475 HB2 ASP 63 HB2 ASP 63 7.268 10.514 -3.235
476 HB3 ASP 63 HB1 ASP 63 7.685 9.093 -2.301
477 H GLY 64 HN GLY 64 3.646 9.436 -1.003
478 HA2 GLY 64 HA2 GLY 64 1.568 10.420 -1.267
479 HA3 GLY 64 HA1 GLY 64 2.317 11.731 -2.166
480 H SER 65 HN SER 65 3.138 8.578 -3.173
481 HA SER 65 HA SER 65 1.356 8.900 -5.461
482 HB2 SER 65 HB2 SER 65 3.733 8.858 -6.008
483 HB3 SER 65 HB1 SER 65 3.928 7.342 -5.141
484 HG SER 65 HG SER 65 2.695 7.876 -7.588
485 H THR 66 HN THR 66 0.016 7.227 -6.059
486 HA THR 66 HA THR 66 -0.169 5.003 -4.180
487 HB THR 66 HB THR 66 -2.599 4.984 -5.166
488 HG1 THR 66 HG1 THR 66 -2.095 6.795 -6.605
489 HG21 THR 66 HG21 THR 66 -2.053 5.286 -2.830
490 HG22 THR 66 HG22 THR 66 -3.331 6.404 -3.326
491 HG23 THR 66 HG23 THR 66 -1.675 6.988 -3.122
492 H LEU 67 HN LEU 67 -0.323 2.996 -4.986
493 HA LEU 67 HA LEU 67 -0.528 2.696 -7.898
494 HB2 LEU 67 HB2 LEU 67 1.171 0.987 -6.042
495 HB3 LEU 67 HB1 LEU 67 0.927 0.687 -7.745
496 HG LEU 67 HG LEU 67 2.464 2.988 -6.519
497 HD11 LEU 67 HD11 LEU 67 4.397 1.956 -7.602
498 HD12 LEU 67 HD12 LEU 67 3.372 0.658 -8.193
499 HD13 LEU 67 HD13 LEU 67 3.642 0.834 -6.466
500 HD21 LEU 67 HD21 LEU 67 1.941 2.367 -9.435
501 HD22 LEU 67 HD22 LEU 67 3.058 3.587 -8.829
502 HD23 LEU 67 HD23 LEU 67 1.331 3.763 -8.540
503 H THR 68 HN THR 68 -2.087 1.338 -8.556
504 HA THR 68 HA THR 68 -4.029 0.313 -6.814
505 HB THR 68 HB THR 68 -3.532 -0.697 -9.598
506 HG1 THR 68 HG1 THR 68 -4.119 1.214 -10.424
507 HG21 THR 68 HG21 THR 68 -6.001 0.138 -8.073
508 HG22 THR 68 HG22 THR 68 -5.465 -1.519 -8.326
509 HG23 THR 68 HG23 THR 68 -5.989 -0.541 -9.702
510 H ASN 69 HN ASN 69 -4.203 -1.773 -5.965
511 HA ASN 69 HA ASN 69 -2.652 -3.321 -4.846
512 HB2 ASN 69 HB2 ASN 69 -3.829 -5.436 -5.351
513 HB3 ASN 69 HB1 ASN 69 -4.905 -4.086 -5.055
514 HD21 ASN 69 HD21 ASN 69 -5.444 -6.601 -6.399
515 HD22 ASN 69 HD22 ASN 69 -5.942 -6.230 -8.002
516 HA PRO 70 HA PRO 70 0.668 -4.598 -7.678
517 HB2 PRO 70 HB2 PRO 70 2.585 -3.335 -6.262
518 HB3 PRO 70 HB1 PRO 70 1.624 -2.540 -7.507
519 HG2 PRO 70 HG2 PRO 70 1.590 -2.058 -4.649
520 HG3 PRO 70 HG1 PRO 70 0.725 -1.185 -5.923
521 HD2 PRO 70 HD2 PRO 70 -0.254 -3.311 -4.106
522 HD3 PRO 70 HD1 PRO 70 -1.135 -2.097 -5.054
523 H SER 71 HN SER 71 2.628 -5.777 -7.295
524 HA SER 71 HA SER 71 2.322 -7.687 -5.157
525 HB2 SER 71 HB2 SER 71 4.588 -7.485 -7.156
526 HB3 SER 71 HB1 SER 71 4.011 -8.917 -6.312
527 HG SER 71 HG SER 71 2.793 -7.464 -8.377
528 H ALA 72 HN ALA 72 4.265 -8.202 -3.782
529 HA ALA 72 HA ALA 72 5.163 -5.912 -2.328
530 HB1 ALA 72 HB1 ALA 72 6.407 -7.487 -1.018
531 HB2 ALA 72 HB2 ALA 72 6.207 -8.730 -2.246
532 HB3 ALA 72 HB3 ALA 72 4.807 -8.152 -1.343
533 H ASP 73 HN ASP 73 6.717 -7.979 -4.669
534 HA ASP 73 HA ASP 73 9.297 -6.884 -4.525
535 HB2 ASP 73 HB2 ASP 73 7.840 -8.031 -6.908
536 HB3 ASP 73 HB1 ASP 73 9.553 -7.643 -6.893
537 H GLU 74 HN GLU 74 6.505 -5.941 -6.401
538 HA GLU 74 HA GLU 74 7.685 -3.924 -7.959
539 HB2 GLU 74 HB2 GLU 74 4.832 -4.211 -7.045
540 HB3 GLU 74 HB1 GLU 74 5.384 -3.122 -8.307
541 HG2 GLU 74 HG2 GLU 74 6.110 -5.054 -9.626
542 HG3 GLU 74 HG1 GLU 74 5.504 -6.130 -8.367
543 H VAL 75 HN VAL 75 5.861 -3.786 -4.933
544 HA VAL 75 HA VAL 75 6.101 -0.987 -4.760
545 HB VAL 75 HB VAL 75 5.294 -1.239 -2.368
546 HG11 VAL 75 HG11 VAL 75 3.780 -0.886 -4.340
547 HG12 VAL 75 HG12 VAL 75 3.066 -1.826 -3.026
548 HG13 VAL 75 HG13 VAL 75 3.673 -2.646 -4.463
549 HG21 VAL 75 HG21 VAL 75 4.402 -3.353 -1.689
550 HG22 VAL 75 HG22 VAL 75 6.123 -3.591 -2.082
551 HG23 VAL 75 HG23 VAL 75 4.845 -4.043 -3.234
552 H LYS 76 HN LYS 76 8.115 -3.558 -3.473
553 HA LYS 76 HA LYS 76 9.654 -1.935 -1.737
554 HB2 LYS 76 HB2 LYS 76 10.425 -4.428 -3.255
555 HB3 LYS 76 HB1 LYS 76 11.457 -3.687 -2.019
556 HG2 LYS 76 HG2 LYS 76 9.596 -4.042 -0.418
557 HG3 LYS 76 HG1 LYS 76 8.724 -4.881 -1.693
558 HD2 LYS 76 HD2 LYS 76 9.733 -6.565 -0.345
559 HD3 LYS 76 HD1 LYS 76 10.692 -6.471 -1.823
560 HE2 LYS 76 HE2 LYS 76 12.397 -5.215 -0.705
561 HE3 LYS 76 HE1 LYS 76 11.386 -5.040 0.729
562 HZ1 LYS 76 HZ1 LYS 76 13.047 -6.725 1.063
563 HZ2 LYS 76 HZ2 LYS 76 12.560 -7.587 -0.285
564 HZ3 LYS 76 HZ3 LYS 76 11.539 -7.453 1.067
565 H ALA 77 HN ALA 77 9.797 -2.466 -5.161
566 HA ALA 77 HA ALA 77 12.296 -1.235 -5.619
567 HB1 ALA 77 HB1 ALA 77 9.945 -1.607 -7.451
568 HB2 ALA 77 HB2 ALA 77 11.274 -2.747 -7.225
569 HB3 ALA 77 HB3 ALA 77 11.572 -1.170 -7.964
570 H LYS 78 HN LYS 78 9.074 0.005 -5.224
571 HA LYS 78 HA LYS 78 9.797 2.658 -6.178
572 HB2 LYS 78 HB2 LYS 78 7.428 1.541 -6.226
573 HB3 LYS 78 HB1 LYS 78 7.344 2.040 -4.540
574 HG2 LYS 78 HG2 LYS 78 7.921 4.398 -5.402
575 HG3 LYS 78 HG1 LYS 78 7.563 3.724 -6.987
576 HD2 LYS 78 HD2 LYS 78 5.328 3.089 -6.215
577 HD3 LYS 78 HD1 LYS 78 5.664 3.874 -4.674
578 HE2 LYS 78 HE2 LYS 78 5.696 5.207 -7.368
579 HE3 LYS 78 HE1 LYS 78 4.387 5.333 -6.190
580 HZ1 LYS 78 HZ1 LYS 78 7.180 6.278 -5.788
581 HZ2 LYS 78 HZ2 LYS 78 5.892 6.580 -4.701
582 HZ3 LYS 78 HZ3 LYS 78 5.903 7.248 -6.212
583 H LEU 79 HN LEU 79 9.035 1.012 -3.186
584 HA LEU 79 HA LEU 79 9.194 3.033 -1.311
585 HB2 LEU 79 HB2 LEU 79 8.229 0.912 -0.816
586 HB3 LEU 79 HB1 LEU 79 9.735 0.086 -1.133
587 HG LEU 79 HG LEU 79 10.708 1.066 0.864
588 HD11 LEU 79 HD11 LEU 79 7.953 2.219 1.367
589 HD12 LEU 79 HD12 LEU 79 9.398 3.142 0.948
590 HD13 LEU 79 HD13 LEU 79 9.329 2.267 2.473
591 HD21 LEU 79 HD21 LEU 79 8.087 -0.346 1.325
592 HD22 LEU 79 HD22 LEU 79 9.387 -0.200 2.506
593 HD23 LEU 79 HD23 LEU 79 9.650 -1.098 1.012
594 H VAL 80 HN VAL 80 11.799 1.009 -2.597
595 HA VAL 80 HA VAL 80 13.729 1.789 -0.748
596 HB VAL 80 HB VAL 80 14.067 -0.182 -2.148
597 HG11 VAL 80 HG11 VAL 80 13.084 0.571 -4.205
598 HG12 VAL 80 HG12 VAL 80 14.714 -0.038 -4.491
599 HG13 VAL 80 HG13 VAL 80 14.414 1.703 -4.467
600 HG21 VAL 80 HG21 VAL 80 16.426 0.121 -2.770
601 HG22 VAL 80 HG22 VAL 80 16.057 0.821 -1.193
602 HG23 VAL 80 HG23 VAL 80 16.232 1.867 -2.605
603 H LYS 81 HN LYS 81 12.678 3.370 -3.646
604 HA LYS 81 HA LYS 81 14.845 5.258 -3.742
605 HB2 LYS 81 HB2 LYS 81 12.139 5.277 -5.081
606 HB3 LYS 81 HB1 LYS 81 13.517 6.291 -5.497
607 HG2 LYS 81 HG2 LYS 81 14.769 4.408 -6.273
608 HG3 LYS 81 HG1 LYS 81 13.563 3.286 -5.641
609 HD2 LYS 81 HD2 LYS 81 13.367 3.517 -8.066
610 HD3 LYS 81 HD1 LYS 81 11.930 4.133 -7.255
611 HE2 LYS 81 HE2 LYS 81 12.772 6.416 -7.511
612 HE3 LYS 81 HE1 LYS 81 14.217 5.789 -8.308
613 HZ1 LYS 81 HZ1 LYS 81 12.586 6.607 -9.860
614 HZ2 LYS 81 HZ2 LYS 81 11.431 5.530 -9.300
615 HZ3 LYS 81 HZ3 LYS 81 12.825 4.955 -10.079
616 H ILE 82 HN ILE 82 11.865 4.982 -2.130
617 HA ILE 82 HA ILE 82 11.458 7.814 -1.707
618 HB ILE 82 HB ILE 82 9.995 5.408 -0.631
619 HG12 ILE 82 HG12 ILE 82 9.234 7.372 -2.792
620 HG13 ILE 82 HG11 ILE 82 9.878 5.754 -3.065
621 HG21 ILE 82 HG21 ILE 82 8.213 7.019 -0.002
622 HG22 ILE 82 HG22 ILE 82 9.317 8.346 -0.399
623 HG23 ILE 82 HG23 ILE 82 9.705 7.242 0.910
624 HD11 ILE 82 HD11 ILE 82 7.330 6.406 -1.647
625 HD12 ILE 82 HD12 ILE 82 7.930 4.783 -2.010
626 HD13 ILE 82 HD13 ILE 82 7.448 5.872 -3.315
627 H ALA 83 HN ALA 83 12.092 5.002 0.344
628 HA ALA 83 HA ALA 83 12.578 6.787 2.588
629 HB1 ALA 83 HB1 ALA 83 11.195 4.774 2.898
630 HB2 ALA 83 HB2 ALA 83 12.598 4.823 3.965
631 HB3 ALA 83 HB3 ALA 83 12.618 3.782 2.543
632 H GLY 84 HN GLY 84 14.383 4.729 0.403
633 HA2 GLY 84 HA2 GLY 84 16.620 4.423 0.159
634 HA3 GLY 84 HA1 GLY 84 16.876 5.781 1.260
635 H LEU 85 HN LEU 85 15.136 2.802 1.851
636 HA LEU 85 HA LEU 85 16.431 2.319 4.315
637 HB2 LEU 85 HB2 LEU 85 15.272 0.184 4.434
638 HB3 LEU 85 HB1 LEU 85 14.181 1.411 3.833
639 HG LEU 85 HG LEU 85 15.552 -0.523 1.975
640 HD11 LEU 85 HD11 LEU 85 14.284 -1.813 3.646
641 HD12 LEU 85 HD12 LEU 85 13.504 -1.874 2.066
642 HD13 LEU 85 HD13 LEU 85 12.860 -0.824 3.322
643 HD21 LEU 85 HD21 LEU 85 13.028 1.114 1.758
644 HD22 LEU 85 HD22 LEU 85 13.643 -0.006 0.540
645 HD23 LEU 85 HD23 LEU 85 14.574 1.435 0.967
646 H GLU 86 HN GLU 86 16.989 1.161 1.078
647 HA GLU 86 HA GLU 86 19.098 -0.603 1.922
648 HB2 GLU 86 HB2 GLU 86 17.704 -1.188 -0.039
649 HB3 GLU 86 HB1 GLU 86 18.234 0.278 -0.846
650 HG2 GLU 86 HG2 GLU 86 19.397 -1.714 -1.669
651 HG3 GLU 86 HG1 GLU 86 20.503 -0.551 -0.938
652 H HIS 87 HN HIS 87 21.126 -0.056 2.121
653 HA HIS 87 HA HIS 87 21.805 2.722 1.762
654 HB2 HIS 87 HB2 HIS 87 23.922 2.191 2.966
655 HB3 HIS 87 HB1 HIS 87 22.495 1.709 3.853
656 HD1 HIS 87 HD1 HIS 87 22.293 -0.763 4.485
657 HD2 HIS 87 HD2 HIS 87 25.462 0.037 1.919
658 HE1 HIS 87 HE1 HIS 87 23.688 -2.852 4.419
659 H HIS 88 HN HIS 88 22.332 -0.250 0.179
660 HA HIS 88 HA HIS 88 23.043 -0.756 -1.899
661 HB2 HIS 88 HB2 HIS 88 21.852 1.398 -2.482
662 HB3 HIS 88 HB1 HIS 88 23.400 2.215 -2.327
663 HD1 HIS 88 HD1 HIS 88 21.311 0.346 -4.692
664 HD2 HIS 88 HD2 HIS 88 25.288 1.492 -4.384
665 HE1 HIS 88 HE1 HIS 88 22.264 0.161 -6.994
Start of MODEL 17
1 H1 MET 1 HT1 MET 1 13.509 8.589 9.215
2 H2 MET 1 HT2 MET 1 14.886 8.446 8.297
3 H3 MET 1 HT3 MET 1 13.690 7.269 8.177
4 HA MET 1 HA MET 1 13.564 10.102 7.382
5 HB2 MET 1 HB2 MET 1 13.513 7.576 5.730
6 HB3 MET 1 HB1 MET 1 13.121 9.159 5.088
7 HG2 MET 1 HG2 MET 1 15.768 8.261 6.211
8 HG3 MET 1 HG1 MET 1 15.387 8.595 4.525
9 HE1 MET 1 HE1 MET 1 14.822 11.088 3.598
10 HE2 MET 1 HE2 MET 1 14.776 12.507 4.643
11 HE3 MET 1 HE3 MET 1 13.568 11.241 4.828
12 H VAL 2 HN VAL 2 11.603 7.069 7.028
13 HA VAL 2 HA VAL 2 9.296 8.782 7.435
14 HB VAL 2 HB VAL 2 8.049 7.528 5.677
15 HG11 VAL 2 HG11 VAL 2 9.096 8.602 3.734
16 HG12 VAL 2 HG12 VAL 2 10.535 8.923 4.698
17 HG13 VAL 2 HG13 VAL 2 9.004 9.689 5.120
18 HG21 VAL 2 HG21 VAL 2 9.276 6.197 4.007
19 HG22 VAL 2 HG22 VAL 2 9.398 5.475 5.613
20 HG23 VAL 2 HG23 VAL 2 10.755 6.383 4.952
21 H THR 3 HN THR 3 7.920 8.027 8.886
22 HA THR 3 HA THR 3 8.366 5.348 9.880
23 HB THR 3 HB THR 3 8.169 7.108 11.580
24 HG1 THR 3 HG1 THR 3 6.472 4.966 11.432
25 HG21 THR 3 HG21 THR 3 6.029 8.260 11.989
26 HG22 THR 3 HG22 THR 3 5.351 7.499 10.549
27 HG23 THR 3 HG23 THR 3 6.674 8.655 10.396
28 H ALA 4 HN ALA 4 6.162 7.127 7.943
29 HA ALA 4 HA ALA 4 4.378 4.830 7.809
30 HB1 ALA 4 HB1 ALA 4 2.851 6.324 6.594
31 HB2 ALA 4 HB2 ALA 4 4.046 7.616 6.661
32 HB3 ALA 4 HB3 ALA 4 3.296 7.036 8.147
33 H ALA 5 HN ALA 5 5.667 3.518 6.682
34 HA ALA 5 HA ALA 5 7.321 4.171 4.505
35 HB1 ALA 5 HB1 ALA 5 7.376 1.733 4.118
36 HB2 ALA 5 HB2 ALA 5 6.038 1.530 5.236
37 HB3 ALA 5 HB3 ALA 5 7.590 2.124 5.823
38 H LEU 6 HN LEU 6 4.252 2.427 4.516
39 HA LEU 6 HA LEU 6 3.240 3.991 2.467
40 HB2 LEU 6 HB2 LEU 6 2.801 2.231 0.783
41 HB3 LEU 6 HB1 LEU 6 4.492 2.581 0.957
42 HG LEU 6 HG LEU 6 4.335 0.318 0.524
43 HD11 LEU 6 HD11 LEU 6 4.712 0.457 3.464
44 HD12 LEU 6 HD12 LEU 6 5.931 0.629 2.201
45 HD13 LEU 6 HD13 LEU 6 5.113 -0.918 2.436
46 HD21 LEU 6 HD21 LEU 6 2.907 -1.266 1.731
47 HD22 LEU 6 HD22 LEU 6 2.079 -0.044 0.762
48 HD23 LEU 6 HD23 LEU 6 2.133 0.128 2.525
49 H THR 7 HN THR 7 1.143 4.021 2.416
50 HA THR 7 HA THR 7 -0.075 2.680 4.714
51 HB THR 7 HB THR 7 -1.145 5.060 3.178
52 HG1 THR 7 HG1 THR 7 1.063 5.124 4.395
53 HG21 THR 7 HG21 THR 7 -2.398 5.461 5.255
54 HG22 THR 7 HG22 THR 7 -1.652 4.036 5.978
55 HG23 THR 7 HG23 THR 7 -2.756 3.853 4.615
56 H ILE 8 HN ILE 8 -1.591 1.259 4.425
57 HA ILE 8 HA ILE 8 -2.517 0.612 1.757
58 HB ILE 8 HB ILE 8 -2.640 -0.876 4.386
59 HG12 ILE 8 HG12 ILE 8 -1.219 -1.457 1.786
60 HG13 ILE 8 HG11 ILE 8 -0.459 -0.947 3.294
61 HG21 ILE 8 HG21 ILE 8 -4.686 -1.303 3.241
62 HG22 ILE 8 HG22 ILE 8 -3.672 -2.746 3.184
63 HG23 ILE 8 HG23 ILE 8 -3.839 -1.724 1.748
64 HD11 ILE 8 HD11 ILE 8 -1.162 -3.065 4.317
65 HD12 ILE 8 HD12 ILE 8 -0.147 -3.315 2.899
66 HD13 ILE 8 HD13 ILE 8 -1.890 -3.551 2.787
67 H TYR 9 HN TYR 9 -4.330 1.397 1.119
68 HA TYR 9 HA TYR 9 -6.461 1.975 3.044
69 HB2 TYR 9 HB2 TYR 9 -6.173 2.724 0.128
70 HB3 TYR 9 HB1 TYR 9 -7.554 3.127 1.134
71 HD1 TYR 9 HD2 TYR 9 -6.786 4.365 3.419
72 HD2 TYR 9 HD1 TYR 9 -4.678 4.391 -0.265
73 HE1 TYR 9 HE2 TYR 9 -5.702 6.461 4.068
74 HE2 TYR 9 HE1 TYR 9 -3.590 6.485 0.368
75 HH TYR 9 HH TYR 9 -4.205 8.429 1.937
76 H THR 10 HN THR 10 -7.846 0.372 3.330
77 HA THR 10 HA THR 10 -8.935 -1.020 1.091
78 HB THR 10 HB THR 10 -6.848 -2.430 1.519
79 HG1 THR 10 HG1 THR 10 -8.713 -4.121 2.528
80 HG21 THR 10 HG21 THR 10 -6.610 -1.870 3.931
81 HG22 THR 10 HG22 THR 10 -6.605 -3.609 3.634
82 HG23 THR 10 HG23 THR 10 -8.054 -2.827 4.265
83 H THR 11 HN THR 11 -10.476 -2.687 2.043
84 HA THR 11 HA THR 11 -11.545 -1.914 4.631
85 HB THR 11 HB THR 11 -13.662 -2.949 3.116
86 HG1 THR 11 HG1 THR 11 -12.686 -2.585 1.133
87 HG21 THR 11 HG21 THR 11 -12.975 -0.064 3.732
88 HG22 THR 11 HG22 THR 11 -13.864 -1.166 4.778
89 HG23 THR 11 HG23 THR 11 -14.560 -0.651 3.241
90 H SER 12 HN SER 12 -12.632 -3.786 5.667
91 HA SER 12 HA SER 12 -10.983 -6.064 5.412
92 HB2 SER 12 HB2 SER 12 -11.924 -5.203 7.568
93 HB3 SER 12 HB1 SER 12 -13.508 -5.775 7.060
94 HG SER 12 HG SER 12 -11.791 -7.790 6.795
95 H TRP 13 HN TRP 13 -13.890 -5.203 3.853
96 HA TRP 13 HA TRP 13 -14.614 -7.939 3.331
97 HB2 TRP 13 HB2 TRP 13 -16.403 -6.913 1.838
98 HB3 TRP 13 HB1 TRP 13 -16.516 -6.592 3.557
99 HD1 TRP 13 HD1 TRP 13 -16.495 -4.117 4.316
100 HE1 TRP 13 HE1 TRP 13 -16.492 -1.865 3.101
101 HE3 TRP 13 HE3 TRP 13 -15.344 -5.723 -0.397
102 HZ2 TRP 13 HZ2 TRP 13 -16.052 -0.878 0.507
103 HZ3 TRP 13 HZ3 TRP 13 -15.147 -4.044 -2.194
104 HH2 TRP 13 HH2 TRP 13 -15.495 -1.675 -1.747
105 H CYS 14 HN CYS 14 -12.292 -6.000 2.073
106 HA CYS 14 HA CYS 14 -12.578 -6.718 -0.688
107 HB2 CYS 14 HB2 CYS 14 -10.240 -5.565 0.842
108 HB3 CYS 14 HB1 CYS 14 -10.310 -5.732 -0.912
109 HG CYS 14 HG CYS 14 -11.773 -3.732 -1.436
110 H GLY 15 HN GLY 15 -11.713 -8.434 -1.734
111 HA2 GLY 15 HA2 GLY 15 -10.899 -10.654 -0.143
112 HA3 GLY 15 HA1 GLY 15 -11.088 -10.622 -1.890
113 H TYR 16 HN TYR 16 -9.266 -8.510 -2.412
114 HA TYR 16 HA TYR 16 -6.878 -10.064 -2.238
115 HB2 TYR 16 HB2 TYR 16 -7.416 -7.400 -3.495
116 HB3 TYR 16 HB1 TYR 16 -5.792 -8.086 -3.414
117 HD1 TYR 16 HD1 TYR 16 -6.104 -10.852 -4.060
118 HD2 TYR 16 HD2 TYR 16 -8.239 -7.537 -5.647
119 HE1 TYR 16 HE1 TYR 16 -6.565 -12.137 -6.095
120 HE2 TYR 16 HE2 TYR 16 -8.718 -8.820 -7.689
121 HH TYR 16 HH TYR 16 -7.700 -10.745 -8.923
122 H CYS 17 HN CYS 17 -8.240 -8.024 -0.088
123 HA CYS 17 HA CYS 17 -6.128 -6.516 0.948
124 HB2 CYS 17 HB2 CYS 17 -8.446 -6.224 1.650
125 HB3 CYS 17 HB1 CYS 17 -8.440 -7.809 2.420
126 HG CYS 17 HG CYS 17 -8.249 -6.363 4.587
127 H LEU 18 HN LEU 18 -7.348 -9.680 2.191
128 HA LEU 18 HA LEU 18 -5.023 -10.072 3.737
129 HB2 LEU 18 HB2 LEU 18 -5.862 -12.356 4.267
130 HB3 LEU 18 HB1 LEU 18 -6.963 -11.072 4.649
131 HG LEU 18 HG LEU 18 -8.126 -13.018 3.923
132 HD11 LEU 18 HD11 LEU 18 -9.179 -10.931 3.372
133 HD12 LEU 18 HD12 LEU 18 -9.583 -12.192 2.216
134 HD13 LEU 18 HD13 LEU 18 -8.419 -10.950 1.774
135 HD21 LEU 18 HD21 LEU 18 -7.991 -13.930 1.630
136 HD22 LEU 18 HD22 LEU 18 -6.494 -14.123 2.541
137 HD23 LEU 18 HD23 LEU 18 -6.624 -12.859 1.318
138 H ARG 19 HN ARG 19 -5.713 -10.811 0.533
139 HA ARG 19 HA ARG 19 -3.791 -12.850 0.119
140 HB2 ARG 19 HB2 ARG 19 -5.562 -12.434 -1.512
141 HB3 ARG 19 HB1 ARG 19 -4.945 -10.816 -1.791
142 HG2 ARG 19 HG2 ARG 19 -4.355 -12.216 -3.627
143 HG3 ARG 19 HG1 ARG 19 -2.887 -11.784 -2.757
144 HD2 ARG 19 HD2 ARG 19 -4.365 -14.423 -2.513
145 HD3 ARG 19 HD1 ARG 19 -2.910 -14.164 -3.467
146 HE ARG 19 HE ARG 19 -2.109 -13.412 -1.021
147 HH11 ARG 19 HH11 ARG 19 -3.682 -16.361 -2.187
148 HH12 ARG 19 HH12 ARG 19 -3.138 -17.328 -0.909
149 HH21 ARG 19 HH21 ARG 19 -1.358 -14.783 0.774
150 HH22 ARG 19 HH22 ARG 19 -1.804 -16.433 0.778
151 H LEU 20 HN LEU 20 -3.734 -9.356 -0.152
152 HA LEU 20 HA LEU 20 -1.046 -9.157 -0.964
153 HB2 LEU 20 HB2 LEU 20 -2.635 -7.464 -1.511
154 HB3 LEU 20 HB1 LEU 20 -3.043 -7.226 0.172
155 HG LEU 20 HG LEU 20 -0.829 -6.353 0.567
156 HD11 LEU 20 HD11 LEU 20 0.578 -5.659 -1.370
157 HD12 LEU 20 HD12 LEU 20 -0.507 -6.546 -2.438
158 HD13 LEU 20 HD13 LEU 20 0.437 -7.407 -1.222
159 HD21 LEU 20 HD21 LEU 20 -2.672 -4.863 0.149
160 HD22 LEU 20 HD22 LEU 20 -2.367 -4.942 -1.593
161 HD23 LEU 20 HD23 LEU 20 -1.175 -4.211 -0.513
162 H LYS 21 HN LYS 21 -2.701 -9.095 2.140
163 HA LYS 21 HA LYS 21 -0.705 -8.080 3.806
164 HB2 LYS 21 HB2 LYS 21 -2.683 -10.248 4.464
165 HB3 LYS 21 HB1 LYS 21 -1.733 -9.351 5.634
166 HG2 LYS 21 HG2 LYS 21 -3.816 -8.236 3.793
167 HG3 LYS 21 HG1 LYS 21 -3.982 -8.509 5.528
168 HD2 LYS 21 HD2 LYS 21 -2.162 -6.891 5.911
169 HD3 LYS 21 HD1 LYS 21 -2.089 -6.599 4.169
170 HE2 LYS 21 HE2 LYS 21 -3.406 -4.898 5.286
171 HE3 LYS 21 HE1 LYS 21 -4.399 -5.862 4.189
172 HZ1 LYS 21 HZ1 LYS 21 -5.376 -5.390 6.402
173 HZ2 LYS 21 HZ2 LYS 21 -4.197 -6.343 7.099
174 HZ3 LYS 21 HZ3 LYS 21 -5.314 -7.049 6.050
175 H THR 22 HN THR 22 -1.277 -11.421 2.900
176 HA THR 22 HA THR 22 0.834 -12.443 4.434
177 HB THR 22 HB THR 22 0.491 -14.449 2.793
178 HG1 THR 22 HG1 THR 22 -1.984 -13.160 2.339
179 HG21 THR 22 HG21 THR 22 -0.343 -14.377 5.108
180 HG22 THR 22 HG22 THR 22 -1.532 -15.113 4.034
181 HG23 THR 22 HG23 THR 22 -1.742 -13.447 4.576
182 H ALA 23 HN ALA 23 0.647 -11.249 1.152
183 HA ALA 23 HA ALA 23 3.159 -12.180 0.255
184 HB1 ALA 23 HB1 ALA 23 1.591 -9.755 -0.641
185 HB2 ALA 23 HB2 ALA 23 1.404 -11.391 -1.271
186 HB3 ALA 23 HB3 ALA 23 2.914 -10.516 -1.528
187 H LEU 24 HN LEU 24 2.114 -9.162 1.777
188 HA LEU 24 HA LEU 24 4.749 -8.014 1.730
189 HB2 LEU 24 HB2 LEU 24 2.405 -7.213 3.440
190 HB3 LEU 24 HB1 LEU 24 3.849 -6.275 3.207
191 HG LEU 24 HG LEU 24 1.644 -6.793 1.229
192 HD11 LEU 24 HD11 LEU 24 1.185 -5.070 2.883
193 HD12 LEU 24 HD12 LEU 24 1.494 -4.283 1.315
194 HD13 LEU 24 HD13 LEU 24 2.732 -4.321 2.545
195 HD21 LEU 24 HD21 LEU 24 3.693 -6.821 -0.082
196 HD22 LEU 24 HD22 LEU 24 4.265 -5.372 0.758
197 HD23 LEU 24 HD23 LEU 24 2.872 -5.281 -0.299
198 H THR 25 HN THR 25 2.865 -9.689 4.185
199 HA THR 25 HA THR 25 4.722 -9.227 6.227
200 HB THR 25 HB THR 25 2.645 -11.425 5.989
201 HG1 THR 25 HG1 THR 25 1.489 -9.629 6.017
202 HG21 THR 25 HG21 THR 25 4.312 -11.879 7.770
203 HG22 THR 25 HG22 THR 25 2.735 -11.484 8.453
204 HG23 THR 25 HG23 THR 25 4.020 -10.276 8.442
205 H ALA 26 HN ALA 26 4.507 -11.838 3.828
206 HA ALA 26 HA ALA 26 6.517 -13.497 4.879
207 HB1 ALA 26 HB1 ALA 26 5.024 -14.206 3.067
208 HB2 ALA 26 HB2 ALA 26 6.714 -14.373 2.579
209 HB3 ALA 26 HB3 ALA 26 5.757 -13.016 1.992
210 H ASN 27 HN ASN 27 6.627 -10.664 2.864
211 HA ASN 27 HA ASN 27 9.509 -10.815 2.606
212 HB2 ASN 27 HB2 ASN 27 7.465 -8.958 1.422
213 HB3 ASN 27 HB1 ASN 27 9.187 -8.602 1.342
214 HD21 ASN 27 HD21 ASN 27 6.629 -10.704 0.217
215 HD22 ASN 27 HD22 ASN 27 7.559 -11.475 -1.005
216 H ARG 28 HN ARG 28 7.595 -9.951 5.006
217 HA ARG 28 HA ARG 28 7.819 -8.774 6.916
218 HB2 ARG 28 HB2 ARG 28 10.675 -8.957 6.011
219 HB3 ARG 28 HB1 ARG 28 10.237 -8.196 7.537
220 HG2 ARG 28 HG2 ARG 28 9.821 -10.154 8.539
221 HG3 ARG 28 HG1 ARG 28 9.026 -10.820 7.113
222 HD2 ARG 28 HD2 ARG 28 11.995 -10.477 7.304
223 HD3 ARG 28 HD1 ARG 28 11.171 -11.935 7.850
224 HE ARG 28 HE ARG 28 10.225 -11.912 5.451
225 HH11 ARG 28 HH11 ARG 28 13.493 -10.827 6.261
226 HH12 ARG 28 HH12 ARG 28 14.165 -11.389 4.800
227 HH21 ARG 28 HH21 ARG 28 11.169 -12.661 3.439
228 HH22 ARG 28 HH22 ARG 28 12.839 -12.458 3.195
229 H ILE 29 HN ILE 29 7.115 -7.381 4.597
230 HA ILE 29 HA ILE 29 8.411 -4.841 4.549
231 HB ILE 29 HB ILE 29 5.779 -5.742 3.342
232 HG12 ILE 29 HG12 ILE 29 8.463 -5.367 2.005
233 HG13 ILE 29 HG11 ILE 29 7.855 -6.927 2.559
234 HG21 ILE 29 HG21 ILE 29 7.412 -3.261 2.761
235 HG22 ILE 29 HG22 ILE 29 5.885 -3.293 3.626
236 HG23 ILE 29 HG23 ILE 29 5.937 -3.742 1.915
237 HD11 ILE 29 HD11 ILE 29 7.578 -6.666 0.216
238 HD12 ILE 29 HD12 ILE 29 6.705 -5.145 0.433
239 HD13 ILE 29 HD13 ILE 29 5.993 -6.668 0.981
240 H ALA 30 HN ALA 30 7.818 -3.029 5.539
241 HA ALA 30 HA ALA 30 5.902 -3.229 7.711
242 HB1 ALA 30 HB1 ALA 30 7.902 -1.140 6.935
243 HB2 ALA 30 HB2 ALA 30 8.092 -2.350 8.215
244 HB3 ALA 30 HB3 ALA 30 6.879 -1.069 8.367
245 H TYR 31 HN TYR 31 3.907 -2.512 7.391
246 HA TYR 31 HA TYR 31 3.467 -0.304 5.531
247 HB2 TYR 31 HB2 TYR 31 1.384 -1.470 4.776
248 HB3 TYR 31 HB1 TYR 31 2.870 -2.261 4.253
249 HD1 TYR 31 HD1 TYR 31 3.501 -4.412 5.244
250 HD2 TYR 31 HD2 TYR 31 -0.144 -2.515 6.289
251 HE1 TYR 31 HE1 TYR 31 2.673 -6.535 6.186
252 HE2 TYR 31 HE2 TYR 31 -0.990 -4.624 7.235
253 HH TYR 31 HH TYR 31 1.015 -7.212 7.890
254 H ASP 32 HN ASP 32 1.333 0.705 5.935
255 HA ASP 32 HA ASP 32 0.398 0.235 8.674
256 HB2 ASP 32 HB2 ASP 32 1.820 2.299 8.547
257 HB3 ASP 32 HB1 ASP 32 0.689 2.949 7.369
258 H GLU 33 HN GLU 33 -1.800 0.216 8.899
259 HA GLU 33 HA GLU 33 -3.353 0.459 6.391
260 HB2 GLU 33 HB2 GLU 33 -3.830 -1.198 8.838
261 HB3 GLU 33 HB1 GLU 33 -4.942 -1.062 7.491
262 HG2 GLU 33 HG2 GLU 33 -3.277 -2.094 6.047
263 HG3 GLU 33 HG1 GLU 33 -2.176 -2.219 7.426
264 H VAL 34 HN VAL 34 -5.133 1.719 6.399
265 HA VAL 34 HA VAL 34 -6.368 2.378 8.911
266 HB VAL 34 HB VAL 34 -4.919 4.348 8.311
267 HG11 VAL 34 HG11 VAL 34 -4.927 4.184 5.903
268 HG12 VAL 34 HG12 VAL 34 -5.461 5.778 6.435
269 HG13 VAL 34 HG13 VAL 34 -6.645 4.604 5.875
270 HG21 VAL 34 HG21 VAL 34 -7.873 4.876 8.155
271 HG22 VAL 34 HG22 VAL 34 -6.639 6.087 8.489
272 HG23 VAL 34 HG23 VAL 34 -6.898 4.758 9.625
273 H ASP 35 HN ASP 35 -8.661 2.359 8.701
274 HA ASP 35 HA ASP 35 -9.486 1.095 6.249
275 HB2 ASP 35 HB2 ASP 35 -11.639 0.682 7.208
276 HB3 ASP 35 HB1 ASP 35 -10.463 0.397 8.477
277 H ILE 36 HN ILE 36 -10.858 1.781 4.761
278 HA ILE 36 HA ILE 36 -10.837 4.620 4.349
279 HB ILE 36 HB ILE 36 -11.688 4.128 2.115
280 HG12 ILE 36 HG12 ILE 36 -11.649 1.240 2.996
281 HG13 ILE 36 HG11 ILE 36 -13.126 2.179 2.777
282 HG21 ILE 36 HG21 ILE 36 -9.319 4.055 2.413
283 HG22 ILE 36 HG22 ILE 36 -9.745 2.619 1.449
284 HG23 ILE 36 HG23 ILE 36 -9.416 2.468 3.161
285 HD11 ILE 36 HD11 ILE 36 -12.716 0.729 0.887
286 HD12 ILE 36 HD12 ILE 36 -11.120 1.444 0.651
287 HD13 ILE 36 HD13 ILE 36 -12.574 2.420 0.397
288 H GLU 37 HN GLU 37 -13.023 2.627 5.901
289 HA GLU 37 HA GLU 37 -15.277 3.936 4.734
290 HB2 GLU 37 HB2 GLU 37 -16.660 2.518 6.310
291 HB3 GLU 37 HB1 GLU 37 -15.729 1.682 5.084
292 HG2 GLU 37 HG2 GLU 37 -14.057 1.095 6.756
293 HG3 GLU 37 HG1 GLU 37 -14.986 1.945 7.990
294 H HIS 38 HN HIS 38 -13.496 4.136 7.721
295 HA HIS 38 HA HIS 38 -15.352 6.124 8.741
296 HB2 HIS 38 HB2 HIS 38 -12.733 5.054 9.814
297 HB3 HIS 38 HB1 HIS 38 -13.592 6.382 10.577
298 HD1 HIS 38 HD1 HIS 38 -13.911 4.895 12.743
299 HD2 HIS 38 HD2 HIS 38 -15.732 3.421 9.309
300 HE1 HIS 38 HE1 HIS 38 -15.462 3.073 13.509
301 H ASN 39 HN ASN 39 -12.876 6.105 6.568
302 HA ASN 39 HA ASN 39 -12.278 8.952 7.036
303 HB2 ASN 39 HB2 ASN 39 -10.535 6.832 5.794
304 HB3 ASN 39 HB1 ASN 39 -10.138 8.538 5.746
305 HD21 ASN 39 HD21 ASN 39 -10.122 5.661 7.549
306 HD22 ASN 39 HD22 ASN 39 -9.395 6.287 8.965
307 H ARG 40 HN ARG 40 -13.709 9.958 5.753
308 HA ARG 40 HA ARG 40 -14.644 8.879 3.310
309 HB2 ARG 40 HB2 ARG 40 -16.024 10.442 4.573
310 HB3 ARG 40 HB1 ARG 40 -14.853 11.722 4.300
311 HG2 ARG 40 HG2 ARG 40 -15.273 11.648 1.914
312 HG3 ARG 40 HG1 ARG 40 -16.399 10.312 2.129
313 HD2 ARG 40 HD2 ARG 40 -16.728 13.091 3.265
314 HD3 ARG 40 HD1 ARG 40 -17.552 12.452 1.848
315 HE ARG 40 HE ARG 40 -18.106 10.668 3.787
316 HH11 ARG 40 HH11 ARG 40 -18.539 14.168 3.541
317 HH12 ARG 40 HH12 ARG 40 -19.963 14.216 4.473
318 HH21 ARG 40 HH21 ARG 40 -20.063 10.725 5.108
319 HH22 ARG 40 HH22 ARG 40 -20.841 12.191 5.399
320 H ALA 41 HN ALA 41 -12.337 11.521 3.913
321 HA ALA 41 HA ALA 41 -11.896 12.021 1.166
322 HB1 ALA 41 HB1 ALA 41 -10.015 12.624 3.459
323 HB2 ALA 41 HB2 ALA 41 -11.341 13.658 2.936
324 HB3 ALA 41 HB3 ALA 41 -9.987 13.351 1.853
325 H ALA 42 HN ALA 42 -10.434 9.796 3.410
326 HA ALA 42 HA ALA 42 -8.369 8.983 1.647
327 HB1 ALA 42 HB1 ALA 42 -8.027 7.083 3.089
328 HB2 ALA 42 HB2 ALA 42 -9.570 7.353 3.900
329 HB3 ALA 42 HB3 ALA 42 -8.263 8.518 4.083
330 H ALA 43 HN ALA 43 -11.638 7.726 2.285
331 HA ALA 43 HA ALA 43 -11.582 5.549 0.498
332 HB1 ALA 43 HB1 ALA 43 -13.363 5.872 2.163
333 HB2 ALA 43 HB2 ALA 43 -14.023 5.666 0.540
334 HB3 ALA 43 HB3 ALA 43 -13.941 7.274 1.264
335 H GLU 44 HN GLU 44 -12.440 8.893 0.080
336 HA GLU 44 HA GLU 44 -13.204 8.925 -2.596
337 HB2 GLU 44 HB2 GLU 44 -13.473 10.813 -1.080
338 HB3 GLU 44 HB1 GLU 44 -11.734 10.964 -0.932
339 HG2 GLU 44 HG2 GLU 44 -11.584 11.556 -3.282
340 HG3 GLU 44 HG1 GLU 44 -13.341 11.432 -3.416
341 H PHE 45 HN PHE 45 -10.061 9.440 -1.106
342 HA PHE 45 HA PHE 45 -8.516 9.849 -3.372
343 HB2 PHE 45 HB2 PHE 45 -7.732 10.394 -1.139
344 HB3 PHE 45 HB1 PHE 45 -7.763 8.697 -0.686
345 HD1 PHE 45 HD2 PHE 45 -6.149 11.115 -2.970
346 HD2 PHE 45 HD1 PHE 45 -5.882 7.361 -0.991
347 HE1 PHE 45 HE2 PHE 45 -3.808 10.918 -3.682
348 HE2 PHE 45 HE1 PHE 45 -3.543 7.159 -1.699
349 HZ PHE 45 HZ PHE 45 -2.501 8.931 -3.045
350 H VAL 46 HN VAL 46 -8.878 6.846 -1.493
351 HA VAL 46 HA VAL 46 -7.399 5.300 -3.335
352 HB VAL 46 HB VAL 46 -7.547 4.488 -1.055
353 HG11 VAL 46 HG11 VAL 46 -9.686 5.332 -0.461
354 HG12 VAL 46 HG12 VAL 46 -9.554 3.571 -0.188
355 HG13 VAL 46 HG13 VAL 46 -10.457 4.185 -1.587
356 HG21 VAL 46 HG21 VAL 46 -7.399 2.842 -2.859
357 HG22 VAL 46 HG22 VAL 46 -9.156 2.599 -2.697
358 HG23 VAL 46 HG23 VAL 46 -8.077 2.223 -1.349
359 H GLY 47 HN GLY 47 -10.830 5.983 -3.138
360 HA2 GLY 47 HA2 GLY 47 -11.616 4.098 -5.090
361 HA3 GLY 47 HA1 GLY 47 -12.516 5.555 -4.651
362 H SER 48 HN SER 48 -10.412 7.347 -5.283
363 HA SER 48 HA SER 48 -10.883 7.784 -8.016
364 HB2 SER 48 HB2 SER 48 -10.388 9.544 -6.300
365 HB3 SER 48 HB1 SER 48 -8.733 8.957 -6.225
366 HG SER 48 HG SER 48 -10.060 10.038 -8.469
367 H VAL 49 HN VAL 49 -8.104 6.479 -6.225
368 HA VAL 49 HA VAL 49 -6.630 6.020 -8.705
369 HB VAL 49 HB VAL 49 -4.745 5.353 -7.230
370 HG11 VAL 49 HG11 VAL 49 -6.055 7.960 -6.531
371 HG12 VAL 49 HG12 VAL 49 -4.985 7.667 -7.913
372 HG13 VAL 49 HG13 VAL 49 -4.353 7.572 -6.258
373 HG21 VAL 49 HG21 VAL 49 -6.122 4.487 -5.369
374 HG22 VAL 49 HG22 VAL 49 -6.570 6.152 -4.978
375 HG23 VAL 49 HG23 VAL 49 -4.891 5.637 -4.832
376 H ASN 50 HN ASN 50 -9.004 4.436 -7.522
377 HA ASN 50 HA ASN 50 -7.811 1.802 -7.422
378 HB2 ASN 50 HB2 ASN 50 -10.198 2.941 -6.364
379 HB3 ASN 50 HB1 ASN 50 -10.683 1.674 -7.483
380 HD21 ASN 50 HD21 ASN 50 -7.812 1.815 -5.475
381 HD22 ASN 50 HD22 ASN 50 -8.203 0.418 -4.549
382 H GLY 51 HN GLY 51 -9.625 0.219 -8.658
383 HA2 GLY 51 HA2 GLY 51 -9.350 0.975 -11.446
384 HA3 GLY 51 HA1 GLY 51 -9.817 -0.611 -10.828
385 H GLY 52 HN GLY 52 -10.964 2.731 -10.856
386 HA2 GLY 52 HA2 GLY 52 -12.984 3.571 -11.599
387 HA3 GLY 52 HA1 GLY 52 -13.480 1.936 -12.004
388 H ASN 53 HN ASN 53 -13.216 0.739 -9.571
389 HA ASN 53 HA ASN 53 -15.295 2.082 -7.970
390 HB2 ASN 53 HB2 ASN 53 -14.874 -0.893 -8.422
391 HB3 ASN 53 HB1 ASN 53 -16.094 -0.197 -7.371
392 HD21 ASN 53 HD21 ASN 53 -15.166 -0.875 -10.652
393 HD22 ASN 53 HD22 ASN 53 -16.677 -0.450 -11.361
394 H ARG 54 HN ARG 54 -14.935 2.065 -5.729
395 HA ARG 54 HA ARG 54 -12.261 1.320 -4.958
396 HB2 ARG 54 HB2 ARG 54 -12.695 2.196 -2.668
397 HB3 ARG 54 HB1 ARG 54 -13.071 3.379 -3.887
398 HG2 ARG 54 HG2 ARG 54 -15.156 1.732 -2.449
399 HG3 ARG 54 HG1 ARG 54 -14.602 3.308 -1.901
400 HD2 ARG 54 HD2 ARG 54 -15.332 4.206 -4.159
401 HD3 ARG 54 HD1 ARG 54 -16.067 2.626 -4.430
402 HE ARG 54 HE ARG 54 -16.922 3.688 -1.971
403 HH11 ARG 54 HH11 ARG 54 -17.550 3.903 -5.453
404 HH12 ARG 54 HH12 ARG 54 -19.042 4.696 -5.303
405 HH21 ARG 54 HH21 ARG 54 -18.990 4.821 -1.749
406 HH22 ARG 54 HH22 ARG 54 -19.885 5.225 -3.129
407 H THR 55 HN THR 55 -11.918 -0.667 -5.010
408 HA THR 55 HA THR 55 -13.514 -2.453 -3.320
409 HB THR 55 HB THR 55 -14.500 -2.595 -5.539
410 HG1 THR 55 HG1 THR 55 -14.530 -4.714 -5.666
411 HG21 THR 55 HG21 THR 55 -13.215 -3.377 -7.496
412 HG22 THR 55 HG22 THR 55 -11.739 -3.319 -6.528
413 HG23 THR 55 HG23 THR 55 -12.608 -1.837 -6.882
414 H VAL 56 HN VAL 56 -10.410 -1.525 -4.563
415 HA VAL 56 HA VAL 56 -9.297 -3.945 -3.406
416 HB VAL 56 HB VAL 56 -7.375 -3.740 -5.036
417 HG11 VAL 56 HG11 VAL 56 -8.587 -4.950 -6.810
418 HG12 VAL 56 HG12 VAL 56 -10.114 -4.492 -6.046
419 HG13 VAL 56 HG13 VAL 56 -8.970 -5.528 -5.193
420 HG21 VAL 56 HG21 VAL 56 -7.875 -2.719 -7.210
421 HG22 VAL 56 HG22 VAL 56 -7.823 -1.524 -5.913
422 HG23 VAL 56 HG23 VAL 56 -9.375 -2.070 -6.551
423 HA PRO 57 HA PRO 57 -6.710 -1.622 -0.736
424 HB2 PRO 57 HB2 PRO 57 -4.463 -3.257 -0.914
425 HB3 PRO 57 HB1 PRO 57 -5.819 -3.537 0.179
426 HG2 PRO 57 HG2 PRO 57 -5.268 -4.738 -2.502
427 HG3 PRO 57 HG1 PRO 57 -5.908 -5.510 -1.040
428 HD2 PRO 57 HD2 PRO 57 -7.503 -4.850 -3.051
429 HD3 PRO 57 HD1 PRO 57 -8.038 -4.621 -1.369
430 H THR 58 HN THR 58 -5.535 0.092 -1.115
431 HA THR 58 HA THR 58 -3.744 0.112 -3.440
432 HB THR 58 HB THR 58 -5.266 2.481 -2.326
433 HG1 THR 58 HG1 THR 58 -6.367 0.567 -3.378
434 HG21 THR 58 HG21 THR 58 -3.182 2.964 -3.650
435 HG22 THR 58 HG22 THR 58 -4.670 3.550 -4.385
436 HG23 THR 58 HG23 THR 58 -3.918 2.087 -5.010
437 H VAL 59 HN VAL 59 -1.721 0.919 -3.026
438 HA VAL 59 HA VAL 59 -1.205 1.628 -0.248
439 HB VAL 59 HB VAL 59 1.186 1.078 -0.721
440 HG11 VAL 59 HG11 VAL 59 -0.242 -0.532 0.339
441 HG12 VAL 59 HG12 VAL 59 0.856 -1.359 -0.778
442 HG13 VAL 59 HG13 VAL 59 -0.838 -1.074 -1.233
443 HG21 VAL 59 HG21 VAL 59 1.728 -0.241 -2.704
444 HG22 VAL 59 HG22 VAL 59 1.167 1.381 -3.129
445 HG23 VAL 59 HG23 VAL 59 0.082 -0.006 -3.302
446 H LYS 60 HN LYS 60 -0.651 3.541 0.242
447 HA LYS 60 HA LYS 60 0.227 5.417 -1.856
448 HB2 LYS 60 HB2 LYS 60 -1.786 6.011 -0.443
449 HB3 LYS 60 HB1 LYS 60 -0.715 6.042 0.951
450 HG2 LYS 60 HG2 LYS 60 0.627 7.804 -0.204
451 HG3 LYS 60 HG1 LYS 60 -0.602 7.849 -1.464
452 HD2 LYS 60 HD2 LYS 60 -1.131 9.624 -0.002
453 HD3 LYS 60 HD1 LYS 60 -2.272 8.344 0.399
454 HE2 LYS 60 HE2 LYS 60 -0.748 7.674 2.278
455 HE3 LYS 60 HE1 LYS 60 0.245 9.074 1.861
456 HZ1 LYS 60 HZ1 LYS 60 -1.250 9.626 3.694
457 HZ2 LYS 60 HZ2 LYS 60 -2.573 9.140 2.788
458 HZ3 LYS 60 HZ3 LYS 60 -1.716 10.497 2.321
459 H PHE 61 HN PHE 61 2.359 5.560 -1.872
460 HA PHE 61 HA PHE 61 3.885 4.752 0.449
461 HB2 PHE 61 HB2 PHE 61 4.743 5.706 -2.270
462 HB3 PHE 61 HB1 PHE 61 5.849 5.264 -0.978
463 HD1 PHE 61 HD1 PHE 61 3.280 4.023 -3.274
464 HD2 PHE 61 HD2 PHE 61 6.347 2.944 -0.500
465 HE1 PHE 61 HE1 PHE 61 3.216 1.729 -4.069
466 HE2 PHE 61 HE2 PHE 61 6.276 0.671 -1.311
467 HZ PHE 61 HZ PHE 61 4.725 0.049 -3.092
468 H ALA 62 HN ALA 62 5.633 6.048 1.237
469 HA ALA 62 HA ALA 62 4.779 8.525 2.141
470 HB1 ALA 62 HB1 ALA 62 6.943 8.746 3.154
471 HB2 ALA 62 HB2 ALA 62 7.591 7.480 2.113
472 HB3 ALA 62 HB3 ALA 62 6.366 7.088 3.319
473 H ASP 63 HN ASP 63 6.307 7.786 -0.861
474 HA ASP 63 HA ASP 63 7.357 10.469 -1.206
475 HB2 ASP 63 HB2 ASP 63 8.138 9.789 -3.371
476 HB3 ASP 63 HB1 ASP 63 8.439 8.439 -2.287
477 H GLY 64 HN GLY 64 4.362 9.082 -1.337
478 HA2 GLY 64 HA2 GLY 64 2.421 10.322 -1.632
479 HA3 GLY 64 HA1 GLY 64 3.308 11.455 -2.641
480 H SER 65 HN SER 65 3.708 8.100 -3.417
481 HA SER 65 HA SER 65 1.822 8.510 -5.612
482 HB2 SER 65 HB2 SER 65 3.193 6.749 -6.806
483 HB3 SER 65 HB1 SER 65 3.988 8.302 -6.541
484 HG SER 65 HG SER 65 5.247 7.432 -5.036
485 H THR 66 HN THR 66 0.590 6.700 -6.351
486 HA THR 66 HA THR 66 0.112 4.732 -4.254
487 HB THR 66 HB THR 66 -2.227 4.802 -5.458
488 HG1 THR 66 HG1 THR 66 -2.122 6.324 -6.913
489 HG21 THR 66 HG21 THR 66 -1.295 6.833 -3.428
490 HG22 THR 66 HG22 THR 66 -1.905 5.205 -3.095
491 HG23 THR 66 HG23 THR 66 -2.977 6.428 -3.762
492 H LEU 67 HN LEU 67 -0.123 2.664 -4.876
493 HA LEU 67 HA LEU 67 -0.342 2.109 -7.744
494 HB2 LEU 67 HB2 LEU 67 1.261 0.446 -5.760
495 HB3 LEU 67 HB1 LEU 67 0.943 0.007 -7.415
496 HG LEU 67 HG LEU 67 2.685 2.294 -6.475
497 HD11 LEU 67 HD11 LEU 67 3.389 -0.281 -7.879
498 HD12 LEU 67 HD12 LEU 67 3.646 0.023 -6.174
499 HD13 LEU 67 HD13 LEU 67 4.520 0.974 -7.378
500 HD21 LEU 67 HD21 LEU 67 1.577 2.886 -8.573
501 HD22 LEU 67 HD22 LEU 67 2.059 1.346 -9.277
502 HD23 LEU 67 HD23 LEU 67 3.285 2.542 -8.853
503 H THR 68 HN THR 68 -2.133 1.053 -8.208
504 HA THR 68 HA THR 68 -3.955 0.089 -6.293
505 HB THR 68 HB THR 68 -3.773 -0.722 -9.207
506 HG1 THR 68 HG1 THR 68 -4.855 1.759 -8.192
507 HG21 THR 68 HG21 THR 68 -5.571 -1.723 -7.847
508 HG22 THR 68 HG22 THR 68 -6.226 -0.635 -9.073
509 HG23 THR 68 HG23 THR 68 -6.124 -0.110 -7.393
510 H ASN 69 HN ASN 69 -4.357 -2.140 -5.725
511 HA ASN 69 HA ASN 69 -2.928 -3.829 -4.631
512 HB2 ASN 69 HB2 ASN 69 -5.111 -4.557 -5.233
513 HB3 ASN 69 HB1 ASN 69 -4.651 -4.811 -6.914
514 HD21 ASN 69 HD21 ASN 69 -5.227 -6.943 -6.966
515 HD22 ASN 69 HD22 ASN 69 -4.389 -8.178 -6.100
516 HA PRO 70 HA PRO 70 0.682 -4.682 -7.347
517 HB2 PRO 70 HB2 PRO 70 2.445 -3.570 -5.601
518 HB3 PRO 70 HB1 PRO 70 1.617 -2.670 -6.871
519 HG2 PRO 70 HG2 PRO 70 1.308 -2.366 -4.036
520 HG3 PRO 70 HG1 PRO 70 0.449 -1.505 -5.321
521 HD2 PRO 70 HD2 PRO 70 -0.411 -3.860 -3.722
522 HD3 PRO 70 HD1 PRO 70 -1.372 -2.587 -4.514
523 H SER 71 HN SER 71 2.423 -6.027 -7.112
524 HA SER 71 HA SER 71 2.122 -8.016 -5.049
525 HB2 SER 71 HB2 SER 71 2.765 -8.604 -7.417
526 HB3 SER 71 HB1 SER 71 4.295 -7.763 -7.172
527 HG SER 71 HG SER 71 5.025 -9.571 -6.273
528 H ALA 72 HN ALA 72 3.936 -8.599 -3.677
529 HA ALA 72 HA ALA 72 4.932 -6.481 -2.130
530 HB1 ALA 72 HB1 ALA 72 4.681 -8.739 -1.276
531 HB2 ALA 72 HB2 ALA 72 6.338 -8.174 -1.057
532 HB3 ALA 72 HB3 ALA 72 5.958 -9.312 -2.354
533 H ASP 73 HN ASP 73 6.294 -8.147 -4.855
534 HA ASP 73 HA ASP 73 8.957 -7.280 -4.761
535 HB2 ASP 73 HB2 ASP 73 7.301 -7.706 -7.246
536 HB3 ASP 73 HB1 ASP 73 9.047 -7.870 -7.078
537 H GLU 74 HN GLU 74 6.087 -5.845 -6.217
538 HA GLU 74 HA GLU 74 7.397 -3.714 -7.553
539 HB2 GLU 74 HB2 GLU 74 4.519 -4.014 -6.706
540 HB3 GLU 74 HB1 GLU 74 5.127 -2.816 -7.837
541 HG2 GLU 74 HG2 GLU 74 5.761 -4.552 -9.388
542 HG3 GLU 74 HG1 GLU 74 5.275 -5.791 -8.233
543 H VAL 75 HN VAL 75 5.639 -3.989 -4.527
544 HA VAL 75 HA VAL 75 5.940 -1.254 -3.931
545 HB VAL 75 HB VAL 75 5.165 -1.868 -1.562
546 HG11 VAL 75 HG11 VAL 75 2.915 -2.396 -2.233
547 HG12 VAL 75 HG12 VAL 75 3.483 -3.067 -3.745
548 HG13 VAL 75 HG13 VAL 75 3.552 -1.329 -3.495
549 HG21 VAL 75 HG21 VAL 75 6.073 -4.185 -1.625
550 HG22 VAL 75 HG22 VAL 75 4.796 -4.534 -2.823
551 HG23 VAL 75 HG23 VAL 75 4.356 -4.078 -1.189
552 H LYS 76 HN LYS 76 7.888 -4.072 -3.118
553 HA LYS 76 HA LYS 76 9.690 -2.866 -1.312
554 HB2 LYS 76 HB2 LYS 76 10.070 -5.121 -3.288
555 HB3 LYS 76 HB1 LYS 76 11.325 -4.613 -2.171
556 HG2 LYS 76 HG2 LYS 76 10.057 -5.299 -0.290
557 HG3 LYS 76 HG1 LYS 76 8.601 -5.483 -1.268
558 HD2 LYS 76 HD2 LYS 76 9.553 -7.668 -0.741
559 HD3 LYS 76 HD1 LYS 76 9.648 -7.353 -2.468
560 HE2 LYS 76 HE2 LYS 76 12.011 -6.707 -2.195
561 HE3 LYS 76 HE1 LYS 76 11.888 -7.079 -0.474
562 HZ1 LYS 76 HZ1 LYS 76 11.461 -9.022 -2.670
563 HZ2 LYS 76 HZ2 LYS 76 11.407 -9.379 -1.032
564 HZ3 LYS 76 HZ3 LYS 76 12.862 -8.892 -1.748
565 H ALA 77 HN ALA 77 9.676 -3.037 -4.824
566 HA ALA 77 HA ALA 77 12.191 -1.992 -5.387
567 HB1 ALA 77 HB1 ALA 77 10.738 -3.037 -7.063
568 HB2 ALA 77 HB2 ALA 77 11.322 -1.462 -7.597
569 HB3 ALA 77 HB3 ALA 77 9.672 -1.634 -7.005
570 H LYS 78 HN LYS 78 9.223 -0.347 -4.613
571 HA LYS 78 HA LYS 78 10.402 2.234 -5.096
572 HB2 LYS 78 HB2 LYS 78 7.720 1.393 -4.095
573 HB3 LYS 78 HB1 LYS 78 8.261 3.066 -3.996
574 HG2 LYS 78 HG2 LYS 78 8.621 3.070 -6.435
575 HG3 LYS 78 HG1 LYS 78 8.002 1.422 -6.500
576 HD2 LYS 78 HD2 LYS 78 6.336 3.135 -7.109
577 HD3 LYS 78 HD1 LYS 78 5.864 2.112 -5.744
578 HE2 LYS 78 HE2 LYS 78 5.300 4.504 -5.408
579 HE3 LYS 78 HE1 LYS 78 6.377 3.877 -4.176
580 HZ1 LYS 78 HZ1 LYS 78 6.993 6.054 -4.876
581 HZ2 LYS 78 HZ2 LYS 78 7.185 5.575 -6.495
582 HZ3 LYS 78 HZ3 LYS 78 8.226 5.001 -5.312
583 H LEU 79 HN LEU 79 9.274 0.424 -2.302
584 HA LEU 79 HA LEU 79 9.660 2.326 -0.350
585 HB2 LEU 79 HB2 LEU 79 8.331 0.335 -0.050
586 HB3 LEU 79 HB1 LEU 79 9.753 -0.672 -0.175
587 HG LEU 79 HG LEU 79 10.595 0.233 1.913
588 HD11 LEU 79 HD11 LEU 79 8.010 1.780 2.026
589 HD12 LEU 79 HD12 LEU 79 9.629 2.453 1.815
590 HD13 LEU 79 HD13 LEU 79 9.207 1.653 3.320
591 HD21 LEU 79 HD21 LEU 79 7.766 -0.783 2.092
592 HD22 LEU 79 HD22 LEU 79 8.942 -0.785 3.407
593 HD23 LEU 79 HD23 LEU 79 9.225 -1.765 1.966
594 H VAL 80 HN VAL 80 11.995 0.037 -1.657
595 HA VAL 80 HA VAL 80 13.966 0.336 0.292
596 HB VAL 80 HB VAL 80 13.977 -1.472 -1.396
597 HG11 VAL 80 HG11 VAL 80 13.325 -0.281 -3.368
598 HG12 VAL 80 HG12 VAL 80 14.850 -1.122 -3.651
599 HG13 VAL 80 HG13 VAL 80 14.842 0.620 -3.368
600 HG21 VAL 80 HG21 VAL 80 16.398 -1.541 -1.866
601 HG22 VAL 80 HG22 VAL 80 16.034 -1.099 -0.205
602 HG23 VAL 80 HG23 VAL 80 16.522 0.146 -1.370
603 H LYS 81 HN LYS 81 13.224 2.365 -2.450
604 HA LYS 81 HA LYS 81 15.620 3.965 -2.192
605 HB2 LYS 81 HB2 LYS 81 13.095 4.447 -3.776
606 HB3 LYS 81 HB1 LYS 81 14.552 5.414 -3.882
607 HG2 LYS 81 HG2 LYS 81 15.775 3.489 -4.751
608 HG3 LYS 81 HG1 LYS 81 14.315 2.506 -4.609
609 HD2 LYS 81 HD2 LYS 81 13.161 4.032 -6.182
610 HD3 LYS 81 HD1 LYS 81 14.641 4.965 -6.313
611 HE2 LYS 81 HE2 LYS 81 14.455 2.047 -7.013
612 HE3 LYS 81 HE1 LYS 81 14.239 3.351 -8.178
613 HZ1 LYS 81 HZ1 LYS 81 16.486 2.517 -8.227
614 HZ2 LYS 81 HZ2 LYS 81 16.716 2.838 -6.583
615 HZ3 LYS 81 HZ3 LYS 81 16.474 4.102 -7.675
616 H ILE 82 HN ILE 82 12.188 4.302 -1.575
617 HA ILE 82 HA ILE 82 11.994 6.948 -0.805
618 HB ILE 82 HB ILE 82 10.415 4.583 0.163
619 HG12 ILE 82 HG12 ILE 82 9.848 6.517 -2.084
620 HG13 ILE 82 HG11 ILE 82 10.487 4.889 -2.285
621 HG21 ILE 82 HG21 ILE 82 10.035 6.526 1.624
622 HG22 ILE 82 HG22 ILE 82 8.606 6.216 0.636
623 HG23 ILE 82 HG23 ILE 82 9.699 7.534 0.214
624 HD11 ILE 82 HD11 ILE 82 8.105 5.005 -2.732
625 HD12 ILE 82 HD12 ILE 82 7.837 5.600 -1.091
626 HD13 ILE 82 HD13 ILE 82 8.454 3.967 -1.348
627 H ALA 83 HN ALA 83 12.634 4.133 1.236
628 HA ALA 83 HA ALA 83 12.545 5.677 3.635
629 HB1 ALA 83 HB1 ALA 83 13.550 2.875 3.227
630 HB2 ALA 83 HB2 ALA 83 11.893 3.344 3.641
631 HB3 ALA 83 HB3 ALA 83 13.207 3.640 4.777
632 H GLY 84 HN GLY 84 14.880 5.596 1.312
633 HA2 GLY 84 HA2 GLY 84 17.026 6.443 1.321
634 HA3 GLY 84 HA1 GLY 84 16.789 6.860 3.015
635 H LEU 85 HN LEU 85 16.855 3.854 1.179
636 HA LEU 85 HA LEU 85 18.851 2.840 3.097
637 HB2 LEU 85 HB2 LEU 85 16.613 1.316 1.777
638 HB3 LEU 85 HB1 LEU 85 17.826 0.634 2.847
639 HG LEU 85 HG LEU 85 15.747 2.671 3.640
640 HD11 LEU 85 HD11 LEU 85 14.691 0.807 4.830
641 HD12 LEU 85 HD12 LEU 85 15.879 -0.299 4.142
642 HD13 LEU 85 HD13 LEU 85 14.736 0.528 3.090
643 HD21 LEU 85 HD21 LEU 85 16.442 2.141 5.921
644 HD22 LEU 85 HD22 LEU 85 17.782 2.801 4.989
645 HD23 LEU 85 HD23 LEU 85 17.692 1.066 5.296
646 H GLU 86 HN GLU 86 18.270 3.657 -0.064
647 HA GLU 86 HA GLU 86 19.893 1.499 -1.191
648 HB2 GLU 86 HB2 GLU 86 17.808 2.069 -2.356
649 HB3 GLU 86 HB1 GLU 86 18.343 3.731 -2.504
650 HG2 GLU 86 HG2 GLU 86 20.172 3.000 -3.971
651 HG3 GLU 86 HG1 GLU 86 19.601 1.337 -3.837
652 H HIS 87 HN HIS 87 19.719 4.995 -1.069
653 HA HIS 87 HA HIS 87 21.160 6.676 -1.222
654 HB2 HIS 87 HB2 HIS 87 23.203 4.624 -0.329
655 HB3 HIS 87 HB1 HIS 87 23.529 6.345 -0.462
656 HD1 HIS 87 HD1 HIS 87 22.943 7.755 1.553
657 HD2 HIS 87 HD2 HIS 87 21.259 3.964 1.693
658 HE1 HIS 87 HE1 HIS 87 21.929 7.525 3.848
659 H HIS 88 HN HIS 88 20.701 6.753 -3.443
660 HA HIS 88 HA HIS 88 23.084 6.580 -5.013
661 HB2 HIS 88 HB2 HIS 88 22.121 4.316 -5.314
662 HB3 HIS 88 HB1 HIS 88 20.593 5.023 -5.809
663 HD1 HIS 88 HD1 HIS 88 20.341 5.490 -8.289
664 HD2 HIS 88 HD2 HIS 88 24.278 4.778 -7.180
665 HE1 HIS 88 HE1 HIS 88 21.655 5.376 -10.425
Start of MODEL 18
1 H1 MET 1 HT1 MET 1 11.470 10.761 6.318
2 H2 MET 1 HT2 MET 1 10.678 11.057 7.787
3 H3 MET 1 HT3 MET 1 11.112 12.333 6.824
4 HA MET 1 HA MET 1 8.771 11.890 6.748
5 HB2 MET 1 HB2 MET 1 8.491 11.825 4.316
6 HB3 MET 1 HB1 MET 1 9.805 12.894 4.766
7 HG2 MET 1 HG2 MET 1 11.422 11.211 4.126
8 HG3 MET 1 HG1 MET 1 10.125 10.076 3.745
9 HE1 MET 1 HE1 MET 1 11.195 9.660 1.378
10 HE2 MET 1 HE2 MET 1 12.500 10.789 1.737
11 HE3 MET 1 HE3 MET 1 11.595 10.937 0.232
12 H VAL 2 HN VAL 2 10.282 9.155 7.453
13 HA VAL 2 HA VAL 2 8.187 7.616 6.220
14 HB VAL 2 HB VAL 2 10.236 7.047 5.067
15 HG11 VAL 2 HG11 VAL 2 11.400 6.264 7.727
16 HG12 VAL 2 HG12 VAL 2 11.905 7.604 6.700
17 HG13 VAL 2 HG13 VAL 2 12.135 5.942 6.156
18 HG21 VAL 2 HG21 VAL 2 10.252 4.593 5.392
19 HG22 VAL 2 HG22 VAL 2 8.623 5.264 5.326
20 HG23 VAL 2 HG23 VAL 2 9.324 4.809 6.878
21 H THR 3 HN THR 3 6.961 8.049 8.064
22 HA THR 3 HA THR 3 7.715 6.430 10.368
23 HB THR 3 HB THR 3 6.817 8.685 10.912
24 HG1 THR 3 HG1 THR 3 4.957 6.663 11.669
25 HG21 THR 3 HG21 THR 3 5.313 9.022 9.009
26 HG22 THR 3 HG22 THR 3 4.435 9.231 10.524
27 HG23 THR 3 HG23 THR 3 4.258 7.741 9.599
28 H ALA 4 HN ALA 4 5.581 6.642 7.674
29 HA ALA 4 HA ALA 4 4.662 3.925 8.170
30 HB1 ALA 4 HB1 ALA 4 2.563 4.612 6.985
31 HB2 ALA 4 HB2 ALA 4 3.134 6.280 7.048
32 HB3 ALA 4 HB3 ALA 4 2.784 5.417 8.540
33 H ALA 5 HN ALA 5 5.845 2.824 6.772
34 HA ALA 5 HA ALA 5 7.202 3.832 4.541
35 HB1 ALA 5 HB1 ALA 5 7.557 1.443 3.965
36 HB2 ALA 5 HB2 ALA 5 6.361 0.997 5.178
37 HB3 ALA 5 HB3 ALA 5 7.858 1.776 5.671
38 H LEU 6 HN LEU 6 4.237 1.950 4.757
39 HA LEU 6 HA LEU 6 3.155 3.370 2.557
40 HB2 LEU 6 HB2 LEU 6 2.461 1.410 1.263
41 HB3 LEU 6 HB1 LEU 6 4.196 1.538 1.325
42 HG LEU 6 HG LEU 6 2.681 -0.371 3.118
43 HD11 LEU 6 HD11 LEU 6 3.253 -2.090 1.445
44 HD12 LEU 6 HD12 LEU 6 3.788 -0.791 0.362
45 HD13 LEU 6 HD13 LEU 6 2.100 -0.895 0.851
46 HD21 LEU 6 HD21 LEU 6 5.527 -0.318 2.107
47 HD22 LEU 6 HD22 LEU 6 4.823 -1.545 3.166
48 HD23 LEU 6 HD23 LEU 6 5.003 0.116 3.734
49 H THR 7 HN THR 7 1.170 3.727 2.799
50 HA THR 7 HA THR 7 -0.180 2.530 5.084
51 HB THR 7 HB THR 7 -0.906 5.003 3.487
52 HG1 THR 7 HG1 THR 7 0.148 5.267 6.046
53 HG21 THR 7 HG21 THR 7 -1.720 4.066 6.246
54 HG22 THR 7 HG22 THR 7 -2.739 4.014 4.807
55 HG23 THR 7 HG23 THR 7 -2.240 5.569 5.479
56 H ILE 8 HN ILE 8 -1.626 1.080 4.644
57 HA ILE 8 HA ILE 8 -2.487 0.572 1.935
58 HB ILE 8 HB ILE 8 -2.697 -0.996 4.506
59 HG12 ILE 8 HG12 ILE 8 -1.304 -1.596 1.906
60 HG13 ILE 8 HG11 ILE 8 -0.509 -1.006 3.371
61 HG21 ILE 8 HG21 ILE 8 -4.721 -1.374 3.415
62 HG22 ILE 8 HG22 ILE 8 -3.719 -2.823 3.267
63 HG23 ILE 8 HG23 ILE 8 -3.932 -1.740 1.876
64 HD11 ILE 8 HD11 ILE 8 -1.171 -3.103 4.488
65 HD12 ILE 8 HD12 ILE 8 -0.171 -3.371 3.055
66 HD13 ILE 8 HD13 ILE 8 -1.908 -3.641 2.976
67 H TYR 9 HN TYR 9 -4.221 1.378 1.149
68 HA TYR 9 HA TYR 9 -6.536 1.959 2.863
69 HB2 TYR 9 HB2 TYR 9 -5.903 2.805 0.031
70 HB3 TYR 9 HB1 TYR 9 -7.374 3.207 0.894
71 HD1 TYR 9 HD1 TYR 9 -6.664 4.290 3.378
72 HD2 TYR 9 HD2 TYR 9 -4.520 4.566 -0.281
73 HE1 TYR 9 HE1 TYR 9 -5.654 6.383 4.141
74 HE2 TYR 9 HE2 TYR 9 -3.497 6.657 0.465
75 HH TYR 9 HH TYR 9 -3.987 8.487 2.056
76 H THR 10 HN THR 10 -7.955 0.332 2.940
77 HA THR 10 HA THR 10 -9.007 -0.716 0.541
78 HB THR 10 HB THR 10 -6.959 -2.125 0.730
79 HG1 THR 10 HG1 THR 10 -8.324 -3.401 -0.223
80 HG21 THR 10 HG21 THR 10 -6.700 -2.056 3.161
81 HG22 THR 10 HG22 THR 10 -6.723 -3.717 2.571
82 HG23 THR 10 HG23 THR 10 -8.153 -3.034 3.344
83 H THR 11 HN THR 11 -10.364 -2.838 1.445
84 HA THR 11 HA THR 11 -11.919 -1.842 3.715
85 HB THR 11 HB THR 11 -13.823 -3.045 2.564
86 HG1 THR 11 HG1 THR 11 -13.063 -2.928 0.080
87 HG21 THR 11 HG21 THR 11 -13.628 -0.593 2.473
88 HG22 THR 11 HG22 THR 11 -14.270 -1.233 0.959
89 HG23 THR 11 HG23 THR 11 -12.578 -0.743 1.063
90 H SER 12 HN SER 12 -13.112 -3.652 4.769
91 HA SER 12 HA SER 12 -11.351 -5.826 5.306
92 HB2 SER 12 HB2 SER 12 -14.164 -5.293 6.220
93 HB3 SER 12 HB1 SER 12 -13.018 -6.404 6.990
94 HG SER 12 HG SER 12 -12.953 -4.513 8.105
95 H TRP 13 HN TRP 13 -13.906 -5.289 3.080
96 HA TRP 13 HA TRP 13 -14.527 -8.115 2.876
97 HB2 TRP 13 HB2 TRP 13 -16.301 -7.360 1.218
98 HB3 TRP 13 HB1 TRP 13 -16.521 -6.854 2.880
99 HD1 TRP 13 HD1 TRP 13 -16.625 -4.273 3.352
100 HE1 TRP 13 HE1 TRP 13 -16.722 -2.190 1.842
101 HE3 TRP 13 HE3 TRP 13 -15.330 -6.430 -1.114
102 HZ2 TRP 13 HZ2 TRP 13 -16.302 -1.543 -0.866
103 HZ3 TRP 13 HZ3 TRP 13 -15.206 -5.000 -3.116
104 HH2 TRP 13 HH2 TRP 13 -15.682 -2.606 -2.991
105 H CYS 14 HN CYS 14 -12.235 -6.249 1.642
106 HA CYS 14 HA CYS 14 -12.299 -7.190 -1.076
107 HB2 CYS 14 HB2 CYS 14 -11.359 -4.977 -0.587
108 HB3 CYS 14 HB1 CYS 14 -10.162 -5.680 0.477
109 HG CYS 14 HG CYS 14 -10.247 -5.326 -2.768
110 H GLY 15 HN GLY 15 -11.339 -9.012 -1.830
111 HA2 GLY 15 HA2 GLY 15 -10.292 -10.942 -0.027
112 HA3 GLY 15 HA1 GLY 15 -10.317 -11.052 -1.785
113 H TYR 16 HN TYR 16 -8.878 -8.907 -2.537
114 HA TYR 16 HA TYR 16 -6.243 -9.805 -2.177
115 HB2 TYR 16 HB2 TYR 16 -7.331 -7.297 -3.386
116 HB3 TYR 16 HB1 TYR 16 -5.599 -7.569 -3.262
117 HD1 TYR 16 HD1 TYR 16 -5.201 -10.330 -3.956
118 HD2 TYR 16 HD2 TYR 16 -7.984 -7.546 -5.583
119 HE1 TYR 16 HE1 TYR 16 -5.207 -11.579 -6.064
120 HE2 TYR 16 HE2 TYR 16 -8.006 -8.786 -7.692
121 HH TYR 16 HH TYR 16 -6.582 -10.324 -8.908
122 H CYS 17 HN CYS 17 -8.110 -7.834 -0.220
123 HA CYS 17 HA CYS 17 -6.229 -6.101 0.916
124 HB2 CYS 17 HB2 CYS 17 -8.473 -5.697 1.368
125 HB3 CYS 17 HB1 CYS 17 -8.782 -7.347 1.904
126 HG CYS 17 HG CYS 17 -8.960 -5.190 3.765
127 H LEU 18 HN LEU 18 -7.417 -9.144 2.240
128 HA LEU 18 HA LEU 18 -5.322 -9.173 4.143
129 HB2 LEU 18 HB2 LEU 18 -6.292 -11.489 4.689
130 HB3 LEU 18 HB1 LEU 18 -7.275 -10.075 4.984
131 HG LEU 18 HG LEU 18 -8.407 -10.569 2.758
132 HD11 LEU 18 HD11 LEU 18 -8.344 -12.847 1.946
133 HD12 LEU 18 HD12 LEU 18 -7.032 -13.211 3.081
134 HD13 LEU 18 HD13 LEU 18 -6.799 -12.008 1.804
135 HD21 LEU 18 HD21 LEU 18 -8.690 -12.537 5.009
136 HD22 LEU 18 HD22 LEU 18 -9.879 -12.248 3.734
137 HD23 LEU 18 HD23 LEU 18 -9.474 -10.963 4.874
138 H ARG 19 HN ARG 19 -5.692 -10.433 1.020
139 HA ARG 19 HA ARG 19 -3.659 -12.399 1.055
140 HB2 ARG 19 HB2 ARG 19 -4.688 -10.673 -1.148
141 HB3 ARG 19 HB1 ARG 19 -3.569 -12.011 -1.396
142 HG2 ARG 19 HG2 ARG 19 -6.400 -12.190 -0.355
143 HG3 ARG 19 HG1 ARG 19 -5.834 -12.706 -1.940
144 HD2 ARG 19 HD2 ARG 19 -5.003 -13.869 0.719
145 HD3 ARG 19 HD1 ARG 19 -6.085 -14.612 -0.447
146 HE ARG 19 HE ARG 19 -3.957 -14.291 -1.948
147 HH11 ARG 19 HH11 ARG 19 -4.092 -15.431 1.422
148 HH12 ARG 19 HH12 ARG 19 -2.793 -16.505 1.248
149 HH21 ARG 19 HH21 ARG 19 -2.150 -15.785 -2.152
150 HH22 ARG 19 HH22 ARG 19 -1.678 -16.731 -0.828
151 H LEU 20 HN LEU 20 -3.629 -8.969 0.180
152 HA LEU 20 HA LEU 20 -0.880 -8.987 -0.370
153 HB2 LEU 20 HB2 LEU 20 -2.455 -7.405 -1.369
154 HB3 LEU 20 HB1 LEU 20 -2.733 -6.695 0.202
155 HG LEU 20 HG LEU 20 -0.440 -5.938 0.296
156 HD11 LEU 20 HD11 LEU 20 -0.207 -7.087 -2.494
157 HD12 LEU 20 HD12 LEU 20 0.755 -7.537 -1.071
158 HD13 LEU 20 HD13 LEU 20 0.933 -5.950 -1.790
159 HD21 LEU 20 HD21 LEU 20 -2.084 -4.443 -0.517
160 HD22 LEU 20 HD22 LEU 20 -1.970 -5.151 -2.142
161 HD23 LEU 20 HD23 LEU 20 -0.605 -4.252 -1.482
162 H LYS 21 HN LYS 21 -2.784 -8.308 2.493
163 HA LYS 21 HA LYS 21 -0.828 -7.196 4.188
164 HB2 LYS 21 HB2 LYS 21 -2.868 -9.274 4.916
165 HB3 LYS 21 HB1 LYS 21 -2.103 -8.243 6.078
166 HG2 LYS 21 HG2 LYS 21 -4.066 -7.503 3.898
167 HG3 LYS 21 HG1 LYS 21 -4.425 -7.532 5.617
168 HD2 LYS 21 HD2 LYS 21 -2.425 -5.653 4.372
169 HD3 LYS 21 HD1 LYS 21 -4.141 -5.287 4.415
170 HE2 LYS 21 HE2 LYS 21 -2.247 -5.560 6.770
171 HE3 LYS 21 HE1 LYS 21 -3.127 -4.182 6.189
172 HZ1 LYS 21 HZ1 LYS 21 -4.457 -6.570 7.395
173 HZ2 LYS 21 HZ2 LYS 21 -5.212 -5.153 6.848
174 HZ3 LYS 21 HZ3 LYS 21 -4.170 -5.081 8.131
175 H THR 22 HN THR 22 -1.621 -10.506 3.384
176 HA THR 22 HA THR 22 0.252 -11.850 4.990
177 HB THR 22 HB THR 22 -1.003 -12.688 2.361
178 HG1 THR 22 HG1 THR 22 -2.566 -12.167 3.945
179 HG21 THR 22 HG21 THR 22 0.156 -14.383 4.590
180 HG22 THR 22 HG22 THR 22 0.911 -14.101 3.025
181 HG23 THR 22 HG23 THR 22 -0.609 -14.988 3.119
182 H ALA 23 HN ALA 23 0.310 -10.869 1.571
183 HA ALA 23 HA ALA 23 2.767 -11.944 0.858
184 HB1 ALA 23 HB1 ALA 23 1.097 -11.159 -0.748
185 HB2 ALA 23 HB2 ALA 23 2.691 -10.463 -1.055
186 HB3 ALA 23 HB3 ALA 23 1.443 -9.493 -0.278
187 H LEU 24 HN LEU 24 2.053 -8.685 2.085
188 HA LEU 24 HA LEU 24 4.764 -7.804 1.898
189 HB2 LEU 24 HB2 LEU 24 2.575 -6.791 3.695
190 HB3 LEU 24 HB1 LEU 24 4.082 -5.966 3.411
191 HG LEU 24 HG LEU 24 1.846 -6.388 1.423
192 HD11 LEU 24 HD11 LEU 24 1.370 -4.728 3.111
193 HD12 LEU 24 HD12 LEU 24 1.697 -3.906 1.570
194 HD13 LEU 24 HD13 LEU 24 2.921 -3.962 2.825
195 HD21 LEU 24 HD21 LEU 24 3.152 -4.841 -0.017
196 HD22 LEU 24 HD22 LEU 24 3.888 -6.409 0.140
197 HD23 LEU 24 HD23 LEU 24 4.528 -5.031 1.062
198 H THR 25 HN THR 25 2.911 -9.238 4.509
199 HA THR 25 HA THR 25 4.873 -9.012 6.496
200 HB THR 25 HB THR 25 2.696 -11.086 6.137
201 HG1 THR 25 HG1 THR 25 1.759 -9.055 6.319
202 HG21 THR 25 HG21 THR 25 4.242 -10.297 8.615
203 HG22 THR 25 HG22 THR 25 4.379 -11.831 7.760
204 HG23 THR 25 HG23 THR 25 2.874 -11.410 8.580
205 H ALA 26 HN ALA 26 4.203 -11.525 4.104
206 HA ALA 26 HA ALA 26 6.090 -13.425 4.936
207 HB1 ALA 26 HB1 ALA 26 4.923 -12.950 2.204
208 HB2 ALA 26 HB2 ALA 26 4.214 -13.943 3.478
209 HB3 ALA 26 HB3 ALA 26 5.744 -14.415 2.734
210 H ASN 27 HN ASN 27 6.427 -10.511 3.162
211 HA ASN 27 HA ASN 27 9.107 -11.304 2.327
212 HB2 ASN 27 HB2 ASN 27 7.278 -9.170 1.270
213 HB3 ASN 27 HB1 ASN 27 9.001 -9.175 0.914
214 HD21 ASN 27 HD21 ASN 27 5.970 -10.834 0.410
215 HD22 ASN 27 HD22 ASN 27 6.516 -11.802 -0.905
216 H ARG 28 HN ARG 28 7.898 -10.126 4.950
217 HA ARG 28 HA ARG 28 8.690 -8.944 6.708
218 HB2 ARG 28 HB2 ARG 28 11.265 -9.065 5.133
219 HB3 ARG 28 HB1 ARG 28 11.163 -8.456 6.768
220 HG2 ARG 28 HG2 ARG 28 10.400 -11.256 5.959
221 HG3 ARG 28 HG1 ARG 28 11.989 -10.797 6.569
222 HD2 ARG 28 HD2 ARG 28 10.753 -11.702 8.396
223 HD3 ARG 28 HD1 ARG 28 10.860 -9.964 8.642
224 HE ARG 28 HE ARG 28 8.467 -11.315 7.587
225 HH11 ARG 28 HH11 ARG 28 9.893 -8.789 9.617
226 HH12 ARG 28 HH12 ARG 28 8.445 -8.426 10.439
227 HH21 ARG 28 HH21 ARG 28 6.480 -10.797 8.723
228 HH22 ARG 28 HH22 ARG 28 6.470 -9.558 9.915
229 H ILE 29 HN ILE 29 7.280 -7.490 4.893
230 HA ILE 29 HA ILE 29 8.726 -4.974 4.691
231 HB ILE 29 HB ILE 29 6.094 -5.804 3.438
232 HG12 ILE 29 HG12 ILE 29 8.803 -5.442 2.132
233 HG13 ILE 29 HG11 ILE 29 8.149 -7.002 2.616
234 HG21 ILE 29 HG21 ILE 29 7.813 -3.352 2.961
235 HG22 ILE 29 HG22 ILE 29 6.320 -3.368 3.871
236 HG23 ILE 29 HG23 ILE 29 6.291 -3.724 2.136
237 HD11 ILE 29 HD11 ILE 29 6.300 -6.663 1.056
238 HD12 ILE 29 HD12 ILE 29 7.873 -6.656 0.281
239 HD13 ILE 29 HD13 ILE 29 7.019 -5.128 0.554
240 H ALA 30 HN ALA 30 8.169 -3.305 5.938
241 HA ALA 30 HA ALA 30 6.170 -3.661 8.015
242 HB1 ALA 30 HB1 ALA 30 8.357 -2.763 8.587
243 HB2 ALA 30 HB2 ALA 30 7.109 -1.532 8.857
244 HB3 ALA 30 HB3 ALA 30 8.128 -1.474 7.410
245 H TYR 31 HN TYR 31 4.155 -2.811 7.863
246 HA TYR 31 HA TYR 31 3.745 -0.579 6.017
247 HB2 TYR 31 HB2 TYR 31 1.681 -1.637 5.134
248 HB3 TYR 31 HB1 TYR 31 3.143 -2.518 4.711
249 HD1 TYR 31 HD2 TYR 31 0.126 -2.550 6.828
250 HD2 TYR 31 HD1 TYR 31 3.492 -4.745 5.485
251 HE1 TYR 31 HE2 TYR 31 -0.865 -4.594 7.755
252 HE2 TYR 31 HE1 TYR 31 2.514 -6.820 6.407
253 HH TYR 31 HH TYR 31 -0.733 -7.011 7.555
254 H ASP 32 HN ASP 32 1.645 0.462 6.263
255 HA ASP 32 HA ASP 32 0.562 0.309 8.987
256 HB2 ASP 32 HB2 ASP 32 1.868 2.363 8.668
257 HB3 ASP 32 HB1 ASP 32 0.959 2.741 7.207
258 H GLU 33 HN GLU 33 -1.732 0.442 9.074
259 HA GLU 33 HA GLU 33 -3.088 0.411 6.463
260 HB2 GLU 33 HB2 GLU 33 -4.439 -1.492 7.231
261 HB3 GLU 33 HB1 GLU 33 -2.737 -1.897 7.111
262 HG2 GLU 33 HG2 GLU 33 -2.483 -1.737 9.505
263 HG3 GLU 33 HG1 GLU 33 -4.155 -1.195 9.672
264 H VAL 34 HN VAL 34 -5.030 1.403 6.431
265 HA VAL 34 HA VAL 34 -6.313 1.995 8.950
266 HB VAL 34 HB VAL 34 -4.957 4.009 8.376
267 HG11 VAL 34 HG11 VAL 34 -5.462 5.398 6.465
268 HG12 VAL 34 HG12 VAL 34 -6.598 4.190 5.883
269 HG13 VAL 34 HG13 VAL 34 -4.869 3.805 5.983
270 HG21 VAL 34 HG21 VAL 34 -7.920 4.440 8.103
271 HG22 VAL 34 HG22 VAL 34 -6.742 5.697 8.462
272 HG23 VAL 34 HG23 VAL 34 -6.998 4.376 9.610
273 H ASP 35 HN ASP 35 -8.624 2.137 8.721
274 HA ASP 35 HA ASP 35 -9.575 0.799 6.346
275 HB2 ASP 35 HB2 ASP 35 -10.532 0.255 8.563
276 HB3 ASP 35 HB1 ASP 35 -11.114 1.910 8.713
277 H ILE 36 HN ILE 36 -10.845 1.665 4.774
278 HA ILE 36 HA ILE 36 -10.517 4.495 4.497
279 HB ILE 36 HB ILE 36 -11.250 4.279 2.212
280 HG12 ILE 36 HG12 ILE 36 -11.596 1.315 2.762
281 HG13 ILE 36 HG11 ILE 36 -12.928 2.451 2.565
282 HG21 ILE 36 HG21 ILE 36 -8.955 3.957 2.623
283 HG22 ILE 36 HG22 ILE 36 -9.427 2.654 1.502
284 HG23 ILE 36 HG23 ILE 36 -9.228 2.325 3.210
285 HD11 ILE 36 HD11 ILE 36 -12.569 1.223 0.515
286 HD12 ILE 36 HD12 ILE 36 -10.876 1.714 0.487
287 HD13 ILE 36 HD13 ILE 36 -12.148 2.919 0.274
288 H GLU 37 HN GLU 37 -13.155 2.365 5.210
289 HA GLU 37 HA GLU 37 -15.087 4.274 4.340
290 HB2 GLU 37 HB2 GLU 37 -15.312 1.640 5.758
291 HB3 GLU 37 HB1 GLU 37 -16.713 2.667 5.469
292 HG2 GLU 37 HG2 GLU 37 -14.874 1.657 3.311
293 HG3 GLU 37 HG1 GLU 37 -16.392 0.890 3.768
294 H HIS 38 HN HIS 38 -13.278 3.809 7.106
295 HA HIS 38 HA HIS 38 -15.041 5.343 8.795
296 HB2 HIS 38 HB2 HIS 38 -13.435 3.674 9.745
297 HB3 HIS 38 HB1 HIS 38 -12.104 4.693 9.216
298 HD1 HIS 38 HD1 HIS 38 -11.268 6.315 10.984
299 HD2 HIS 38 HD2 HIS 38 -15.177 5.081 11.674
300 HE1 HIS 38 HE1 HIS 38 -11.951 7.344 13.168
301 H ASN 39 HN ASN 39 -12.577 6.012 6.440
302 HA ASN 39 HA ASN 39 -12.584 8.853 7.244
303 HB2 ASN 39 HB2 ASN 39 -10.313 7.362 5.905
304 HB3 ASN 39 HB1 ASN 39 -10.322 9.076 6.288
305 HD21 ASN 39 HD21 ASN 39 -9.914 5.855 7.475
306 HD22 ASN 39 HD22 ASN 39 -9.348 6.311 9.026
307 H ARG 40 HN ARG 40 -14.171 9.501 5.869
308 HA ARG 40 HA ARG 40 -14.716 8.544 3.359
309 HB2 ARG 40 HB2 ARG 40 -16.288 9.920 4.572
310 HB3 ARG 40 HB1 ARG 40 -15.230 11.315 4.420
311 HG2 ARG 40 HG2 ARG 40 -15.502 11.270 2.007
312 HG3 ARG 40 HG1 ARG 40 -16.539 9.852 2.156
313 HD2 ARG 40 HD2 ARG 40 -18.167 11.124 3.378
314 HD3 ARG 40 HD1 ARG 40 -17.112 12.541 3.377
315 HE ARG 40 HE ARG 40 -17.524 11.647 0.764
316 HH11 ARG 40 HH11 ARG 40 -19.318 13.240 3.365
317 HH12 ARG 40 HH12 ARG 40 -20.305 14.159 2.332
318 HH21 ARG 40 HH21 ARG 40 -18.872 12.930 -0.678
319 HH22 ARG 40 HH22 ARG 40 -20.017 14.000 -0.008
320 H ALA 41 HN ALA 41 -12.579 11.305 4.095
321 HA ALA 41 HA ALA 41 -12.105 12.019 1.406
322 HB1 ALA 41 HB1 ALA 41 -11.555 13.504 3.272
323 HB2 ALA 41 HB2 ALA 41 -10.153 13.227 2.233
324 HB3 ALA 41 HB3 ALA 41 -10.282 12.392 3.783
325 H ALA 42 HN ALA 42 -10.517 9.714 3.519
326 HA ALA 42 HA ALA 42 -8.380 9.122 1.731
327 HB1 ALA 42 HB1 ALA 42 -7.947 7.178 3.144
328 HB2 ALA 42 HB2 ALA 42 -9.489 7.392 3.963
329 HB3 ALA 42 HB3 ALA 42 -8.220 8.598 4.153
330 H ALA 43 HN ALA 43 -11.526 7.727 2.383
331 HA ALA 43 HA ALA 43 -11.357 5.526 0.630
332 HB1 ALA 43 HB1 ALA 43 -13.724 5.346 0.898
333 HB2 ALA 43 HB2 ALA 43 -13.821 6.997 1.510
334 HB3 ALA 43 HB3 ALA 43 -13.002 5.753 2.453
335 H GLU 44 HN GLU 44 -12.394 8.828 0.154
336 HA GLU 44 HA GLU 44 -13.408 8.462 -2.462
337 HB2 GLU 44 HB2 GLU 44 -13.871 10.382 -0.877
338 HB3 GLU 44 HB1 GLU 44 -12.270 10.987 -1.271
339 HG2 GLU 44 HG2 GLU 44 -13.956 12.124 -2.543
340 HG3 GLU 44 HG1 GLU 44 -12.914 11.178 -3.610
341 H PHE 45 HN PHE 45 -10.311 9.340 -1.106
342 HA PHE 45 HA PHE 45 -8.908 9.906 -3.458
343 HB2 PHE 45 HB2 PHE 45 -8.049 10.524 -1.270
344 HB3 PHE 45 HB1 PHE 45 -7.994 8.842 -0.780
345 HD1 PHE 45 HD1 PHE 45 -6.544 11.207 -3.251
346 HD2 PHE 45 HD2 PHE 45 -6.030 7.623 -1.004
347 HE1 PHE 45 HE1 PHE 45 -4.196 11.079 -3.979
348 HE2 PHE 45 HE2 PHE 45 -3.707 7.502 -1.719
349 HZ PHE 45 HZ PHE 45 -2.777 9.224 -3.214
350 H VAL 46 HN VAL 46 -8.922 6.916 -1.520
351 HA VAL 46 HA VAL 46 -7.480 5.408 -3.396
352 HB VAL 46 HB VAL 46 -7.487 4.644 -1.105
353 HG11 VAL 46 HG11 VAL 46 -9.643 5.427 -0.456
354 HG12 VAL 46 HG12 VAL 46 -9.395 3.703 -0.085
355 HG13 VAL 46 HG13 VAL 46 -10.402 4.173 -1.470
356 HG21 VAL 46 HG21 VAL 46 -7.342 2.943 -2.849
357 HG22 VAL 46 HG22 VAL 46 -9.085 2.643 -2.625
358 HG23 VAL 46 HG23 VAL 46 -7.955 2.345 -1.303
359 H GLY 47 HN GLY 47 -10.945 5.915 -3.077
360 HA2 GLY 47 HA2 GLY 47 -11.760 3.913 -4.882
361 HA3 GLY 47 HA1 GLY 47 -12.675 5.357 -4.468
362 H SER 48 HN SER 48 -10.435 7.069 -5.386
363 HA SER 48 HA SER 48 -11.245 7.215 -8.146
364 HB2 SER 48 HB2 SER 48 -9.354 8.960 -6.569
365 HB3 SER 48 HB1 SER 48 -10.037 9.314 -8.161
366 HG SER 48 HG SER 48 -11.226 9.351 -5.633
367 H VAL 49 HN VAL 49 -8.369 6.345 -6.323
368 HA VAL 49 HA VAL 49 -6.800 6.116 -8.781
369 HB VAL 49 HB VAL 49 -4.867 5.663 -7.294
370 HG11 VAL 49 HG11 VAL 49 -4.754 7.877 -6.268
371 HG12 VAL 49 HG12 VAL 49 -6.498 8.052 -6.516
372 HG13 VAL 49 HG13 VAL 49 -5.420 7.951 -7.909
373 HG21 VAL 49 HG21 VAL 49 -5.091 5.875 -4.879
374 HG22 VAL 49 HG22 VAL 49 -6.142 4.568 -5.466
375 HG23 VAL 49 HG23 VAL 49 -6.820 6.149 -5.072
376 H ASN 50 HN ASN 50 -8.979 4.358 -7.576
377 HA ASN 50 HA ASN 50 -7.648 1.815 -7.351
378 HB2 ASN 50 HB2 ASN 50 -10.145 2.876 -6.516
379 HB3 ASN 50 HB1 ASN 50 -10.498 1.555 -7.621
380 HD21 ASN 50 HD21 ASN 50 -7.780 1.872 -5.414
381 HD22 ASN 50 HD22 ASN 50 -8.207 0.483 -4.483
382 H GLY 51 HN GLY 51 -9.139 0.046 -8.645
383 HA2 GLY 51 HA2 GLY 51 -8.798 0.687 -11.437
384 HA3 GLY 51 HA1 GLY 51 -9.236 -0.880 -10.751
385 H GLY 52 HN GLY 52 -10.532 2.386 -11.032
386 HA2 GLY 52 HA2 GLY 52 -12.557 2.821 -12.263
387 HA3 GLY 52 HA1 GLY 52 -13.111 1.206 -11.836
388 H ASN 53 HN ASN 53 -13.192 0.869 -9.372
389 HA ASN 53 HA ASN 53 -14.075 3.265 -7.972
390 HB2 ASN 53 HB2 ASN 53 -16.086 2.212 -9.127
391 HB3 ASN 53 HB1 ASN 53 -15.814 0.785 -8.130
392 HD21 ASN 53 HD21 ASN 53 -17.776 1.015 -7.120
393 HD22 ASN 53 HD22 ASN 53 -18.125 2.257 -5.977
394 H ARG 54 HN ARG 54 -14.347 2.764 -5.660
395 HA ARG 54 HA ARG 54 -12.097 1.424 -4.674
396 HB2 ARG 54 HB2 ARG 54 -12.975 1.713 -2.380
397 HB3 ARG 54 HB1 ARG 54 -13.089 3.193 -3.303
398 HG2 ARG 54 HG2 ARG 54 -15.458 1.371 -3.034
399 HG3 ARG 54 HG1 ARG 54 -15.040 2.489 -1.746
400 HD2 ARG 54 HD2 ARG 54 -15.578 3.297 -4.618
401 HD3 ARG 54 HD1 ARG 54 -16.762 3.324 -3.319
402 HE ARG 54 HE ARG 54 -14.957 4.796 -2.214
403 HH11 ARG 54 HH11 ARG 54 -15.918 4.985 -5.655
404 HH12 ARG 54 HH12 ARG 54 -15.712 6.669 -5.760
405 HH21 ARG 54 HH21 ARG 54 -14.732 7.121 -2.383
406 HH22 ARG 54 HH22 ARG 54 -15.005 7.939 -3.852
407 H THR 55 HN THR 55 -11.659 -0.573 -4.662
408 HA THR 55 HA THR 55 -13.364 -2.500 -3.434
409 HB THR 55 HB THR 55 -14.386 -2.504 -5.682
410 HG1 THR 55 HG1 THR 55 -14.502 -4.634 -5.784
411 HG21 THR 55 HG21 THR 55 -11.642 -3.275 -6.699
412 HG22 THR 55 HG22 THR 55 -12.469 -1.750 -7.012
413 HG23 THR 55 HG23 THR 55 -13.120 -3.254 -7.664
414 H VAL 56 HN VAL 56 -10.334 -1.653 -5.016
415 HA VAL 56 HA VAL 56 -9.133 -4.001 -3.771
416 HB VAL 56 HB VAL 56 -7.206 -3.581 -5.389
417 HG11 VAL 56 HG11 VAL 56 -8.740 -5.498 -5.592
418 HG12 VAL 56 HG12 VAL 56 -8.310 -4.892 -7.189
419 HG13 VAL 56 HG13 VAL 56 -9.883 -4.502 -6.492
420 HG21 VAL 56 HG21 VAL 56 -9.352 -2.050 -6.842
421 HG22 VAL 56 HG22 VAL 56 -7.816 -2.567 -7.538
422 HG23 VAL 56 HG23 VAL 56 -7.833 -1.400 -6.211
423 HA PRO 57 HA PRO 57 -6.675 -1.517 -1.121
424 HB2 PRO 57 HB2 PRO 57 -4.315 -2.907 -1.122
425 HB3 PRO 57 HB1 PRO 57 -5.741 -3.436 -0.224
426 HG2 PRO 57 HG2 PRO 57 -4.778 -4.312 -2.919
427 HG3 PRO 57 HG1 PRO 57 -5.368 -5.309 -1.572
428 HD2 PRO 57 HD2 PRO 57 -6.917 -4.725 -3.655
429 HD3 PRO 57 HD1 PRO 57 -7.581 -4.767 -2.012
430 H THR 58 HN THR 58 -5.467 0.228 -1.337
431 HA THR 58 HA THR 58 -3.656 0.355 -3.604
432 HB THR 58 HB THR 58 -5.174 2.700 -2.399
433 HG1 THR 58 HG1 THR 58 -5.974 0.723 -3.922
434 HG21 THR 58 HG21 THR 58 -3.027 3.198 -3.646
435 HG22 THR 58 HG22 THR 58 -4.495 3.906 -4.320
436 HG23 THR 58 HG23 THR 58 -3.802 2.480 -5.081
437 H VAL 59 HN VAL 59 -1.567 1.114 -2.963
438 HA VAL 59 HA VAL 59 -1.295 1.631 -0.096
439 HB VAL 59 HB VAL 59 1.113 1.050 -0.354
440 HG11 VAL 59 HG11 VAL 59 0.760 -1.363 -0.709
441 HG12 VAL 59 HG12 VAL 59 -0.923 -0.979 -1.167
442 HG13 VAL 59 HG13 VAL 59 -0.323 -0.613 0.461
443 HG21 VAL 59 HG21 VAL 59 1.385 1.525 -2.723
444 HG22 VAL 59 HG22 VAL 59 0.298 0.191 -3.125
445 HG23 VAL 59 HG23 VAL 59 1.857 -0.136 -2.360
446 H LYS 60 HN LYS 60 -0.683 3.508 0.598
447 HA LYS 60 HA LYS 60 0.383 5.451 -1.338
448 HB2 LYS 60 HB2 LYS 60 -1.606 6.100 0.087
449 HB3 LYS 60 HB1 LYS 60 -0.550 5.959 1.485
450 HG2 LYS 60 HG2 LYS 60 0.974 7.640 0.341
451 HG3 LYS 60 HG1 LYS 60 -0.350 7.923 -0.786
452 HD2 LYS 60 HD2 LYS 60 -0.520 9.596 0.877
453 HD3 LYS 60 HD1 LYS 60 -1.787 8.417 1.232
454 HE2 LYS 60 HE2 LYS 60 -0.699 9.042 3.289
455 HE3 LYS 60 HE1 LYS 60 -0.275 7.376 2.916
456 HZ1 LYS 60 HZ1 LYS 60 1.901 8.203 2.059
457 HZ2 LYS 60 HZ2 LYS 60 1.637 8.600 3.656
458 HZ3 LYS 60 HZ3 LYS 60 1.439 9.772 2.494
459 H PHE 61 HN PHE 61 2.474 5.675 -1.266
460 HA PHE 61 HA PHE 61 3.995 4.455 0.837
461 HB2 PHE 61 HB2 PHE 61 4.821 5.995 -1.604
462 HB3 PHE 61 HB1 PHE 61 5.953 5.290 -0.453
463 HD1 PHE 61 HD1 PHE 61 3.271 4.509 -2.849
464 HD2 PHE 61 HD2 PHE 61 6.500 3.010 -0.528
465 HE1 PHE 61 HE1 PHE 61 3.127 2.400 -4.032
466 HE2 PHE 61 HE2 PHE 61 6.377 0.877 -1.728
467 HZ PHE 61 HZ PHE 61 4.701 0.566 -3.492
468 H ALA 62 HN ALA 62 5.875 5.679 1.709
469 HA ALA 62 HA ALA 62 5.039 7.818 3.299
470 HB1 ALA 62 HB1 ALA 62 6.875 6.320 3.902
471 HB2 ALA 62 HB2 ALA 62 7.383 8.010 3.955
472 HB3 ALA 62 HB3 ALA 62 7.850 6.991 2.593
473 H ASP 63 HN ASP 63 6.400 7.742 0.109
474 HA ASP 63 HA ASP 63 7.160 10.515 0.080
475 HB2 ASP 63 HB2 ASP 63 7.757 10.211 -2.211
476 HB3 ASP 63 HB1 ASP 63 8.200 8.720 -1.399
477 H GLY 64 HN GLY 64 4.247 8.791 -0.305
478 HA2 GLY 64 HA2 GLY 64 2.199 10.044 -0.163
479 HA3 GLY 64 HA1 GLY 64 2.925 11.269 -1.193
480 H SER 65 HN SER 65 3.985 8.894 -2.895
481 HA SER 65 HA SER 65 1.846 8.925 -4.757
482 HB2 SER 65 HB2 SER 65 4.193 8.853 -5.429
483 HB3 SER 65 HB1 SER 65 4.364 7.267 -4.689
484 HG SER 65 HG SER 65 3.244 8.011 -7.090
485 H THR 66 HN THR 66 0.892 6.967 -5.712
486 HA THR 66 HA THR 66 0.343 4.915 -3.717
487 HB THR 66 HB THR 66 -1.953 4.878 -4.853
488 HG1 THR 66 HG1 THR 66 -1.742 6.265 -6.513
489 HG21 THR 66 HG21 THR 66 -1.197 7.174 -3.035
490 HG22 THR 66 HG22 THR 66 -1.658 5.535 -2.538
491 HG23 THR 66 HG23 THR 66 -2.834 6.577 -3.328
492 H LEU 67 HN LEU 67 0.264 2.903 -4.488
493 HA LEU 67 HA LEU 67 0.146 2.543 -7.391
494 HB2 LEU 67 HB2 LEU 67 1.663 0.757 -5.435
495 HB3 LEU 67 HB1 LEU 67 1.440 0.426 -7.131
496 HG LEU 67 HG LEU 67 3.093 2.682 -5.971
497 HD11 LEU 67 HD11 LEU 67 5.008 1.471 -6.830
498 HD12 LEU 67 HD12 LEU 67 3.958 0.218 -7.473
499 HD13 LEU 67 HD13 LEU 67 4.112 0.413 -5.734
500 HD21 LEU 67 HD21 LEU 67 3.827 3.060 -8.270
501 HD22 LEU 67 HD22 LEU 67 2.102 3.360 -8.073
502 HD23 LEU 67 HD23 LEU 67 2.658 1.869 -8.841
503 H THR 68 HN THR 68 -1.708 1.639 -7.968
504 HA THR 68 HA THR 68 -3.614 0.594 -6.208
505 HB THR 68 HB THR 68 -3.354 -0.005 -9.164
506 HG1 THR 68 HG1 THR 68 -4.657 2.365 -8.435
507 HG21 THR 68 HG21 THR 68 -5.280 -0.975 -7.949
508 HG22 THR 68 HG22 THR 68 -5.811 0.254 -9.095
509 HG23 THR 68 HG23 THR 68 -5.723 0.633 -7.375
510 H ASN 69 HN ASN 69 -4.158 -1.621 -5.816
511 HA ASN 69 HA ASN 69 -2.755 -3.337 -4.755
512 HB2 ASN 69 HB2 ASN 69 -3.839 -5.376 -5.732
513 HB3 ASN 69 HB1 ASN 69 -4.909 -4.124 -5.146
514 HD21 ASN 69 HD21 ASN 69 -5.311 -6.338 -7.097
515 HD22 ASN 69 HD22 ASN 69 -5.888 -5.589 -8.531
516 HA PRO 70 HA PRO 70 0.748 -4.433 -7.338
517 HB2 PRO 70 HB2 PRO 70 2.481 -3.640 -5.326
518 HB3 PRO 70 HB1 PRO 70 2.039 -2.669 -6.727
519 HG2 PRO 70 HG2 PRO 70 1.434 -2.071 -4.044
520 HG3 PRO 70 HG1 PRO 70 0.728 -1.302 -5.473
521 HD2 PRO 70 HD2 PRO 70 -0.359 -3.481 -3.758
522 HD3 PRO 70 HD1 PRO 70 -1.194 -2.153 -4.604
523 H SER 71 HN SER 71 2.794 -5.560 -6.384
524 HA SER 71 HA SER 71 1.922 -7.594 -4.496
525 HB2 SER 71 HB2 SER 71 3.708 -8.939 -5.720
526 HB3 SER 71 HB1 SER 71 2.266 -8.555 -6.673
527 HG SER 71 HG SER 71 4.779 -7.990 -7.153
528 H ALA 72 HN ALA 72 3.897 -8.427 -3.278
529 HA ALA 72 HA ALA 72 5.146 -6.346 -1.905
530 HB1 ALA 72 HB1 ALA 72 6.455 -8.066 -0.821
531 HB2 ALA 72 HB2 ALA 72 5.987 -9.226 -2.060
532 HB3 ALA 72 HB3 ALA 72 4.770 -8.560 -0.963
533 H ASP 73 HN ASP 73 6.308 -8.267 -4.632
534 HA ASP 73 HA ASP 73 8.927 -7.195 -4.499
535 HB2 ASP 73 HB2 ASP 73 9.309 -8.201 -6.716
536 HB3 ASP 73 HB1 ASP 73 8.528 -9.344 -5.643
537 H GLU 74 HN GLU 74 5.998 -6.207 -6.134
538 HA GLU 74 HA GLU 74 7.210 -4.181 -7.705
539 HB2 GLU 74 HB2 GLU 74 4.374 -4.605 -6.831
540 HB3 GLU 74 HB1 GLU 74 4.859 -3.206 -7.779
541 HG2 GLU 74 HG2 GLU 74 5.132 -6.086 -8.557
542 HG3 GLU 74 HG1 GLU 74 3.973 -4.928 -9.198
543 H VAL 75 HN VAL 75 5.630 -4.109 -4.559
544 HA VAL 75 HA VAL 75 5.946 -1.323 -4.327
545 HB VAL 75 HB VAL 75 5.525 -1.677 -1.829
546 HG11 VAL 75 HG11 VAL 75 3.522 -2.770 -3.805
547 HG12 VAL 75 HG12 VAL 75 3.731 -1.061 -3.450
548 HG13 VAL 75 HG13 VAL 75 3.126 -2.159 -2.208
549 HG21 VAL 75 HG21 VAL 75 4.830 -4.403 -2.809
550 HG22 VAL 75 HG22 VAL 75 4.572 -3.808 -1.169
551 HG23 VAL 75 HG23 VAL 75 6.223 -4.059 -1.780
552 H LYS 76 HN LYS 76 8.018 -3.987 -3.303
553 HA LYS 76 HA LYS 76 9.783 -2.441 -1.747
554 HB2 LYS 76 HB2 LYS 76 10.262 -4.977 -3.288
555 HB3 LYS 76 HB1 LYS 76 11.502 -4.209 -2.312
556 HG2 LYS 76 HG2 LYS 76 9.999 -4.433 -0.341
557 HG3 LYS 76 HG1 LYS 76 8.871 -5.321 -1.362
558 HD2 LYS 76 HD2 LYS 76 10.238 -6.873 -0.075
559 HD3 LYS 76 HD1 LYS 76 10.624 -7.009 -1.791
560 HE2 LYS 76 HE2 LYS 76 12.617 -5.672 -1.490
561 HE3 LYS 76 HE1 LYS 76 12.204 -5.384 0.204
562 HZ1 LYS 76 HZ1 LYS 76 13.885 -7.077 -0.052
563 HZ2 LYS 76 HZ2 LYS 76 12.872 -8.010 -1.013
564 HZ3 LYS 76 HZ3 LYS 76 12.489 -7.737 0.610
565 H ALA 77 HN ALA 77 9.552 -2.804 -5.181
566 HA ALA 77 HA ALA 77 12.109 -1.781 -5.816
567 HB1 ALA 77 HB1 ALA 77 11.224 -1.492 -8.074
568 HB2 ALA 77 HB2 ALA 77 9.585 -1.744 -7.472
569 HB3 ALA 77 HB3 ALA 77 10.758 -3.060 -7.413
570 H LYS 78 HN LYS 78 9.008 -0.274 -5.199
571 HA LYS 78 HA LYS 78 10.019 2.334 -5.950
572 HB2 LYS 78 HB2 LYS 78 7.560 1.546 -6.168
573 HB3 LYS 78 HB1 LYS 78 7.453 1.844 -4.435
574 HG2 LYS 78 HG2 LYS 78 8.270 4.184 -4.904
575 HG3 LYS 78 HG1 LYS 78 8.052 3.792 -6.617
576 HD2 LYS 78 HD2 LYS 78 5.682 3.347 -6.173
577 HD3 LYS 78 HD1 LYS 78 5.924 3.868 -4.503
578 HE2 LYS 78 HE2 LYS 78 6.380 5.528 -6.976
579 HE3 LYS 78 HE1 LYS 78 5.014 5.678 -5.877
580 HZ1 LYS 78 HZ1 LYS 78 7.870 6.222 -5.178
581 HZ2 LYS 78 HZ2 LYS 78 6.573 6.469 -4.123
582 HZ3 LYS 78 HZ3 LYS 78 6.712 7.377 -5.503
583 H LEU 79 HN LEU 79 9.211 0.530 -3.070
584 HA LEU 79 HA LEU 79 9.477 2.512 -1.130
585 HB2 LEU 79 HB2 LEU 79 8.342 0.363 -0.796
586 HB3 LEU 79 HB1 LEU 79 9.881 -0.460 -0.879
587 HG LEU 79 HG LEU 79 10.582 0.726 1.187
588 HD11 LEU 79 HD11 LEU 79 8.945 1.874 2.536
589 HD12 LEU 79 HD12 LEU 79 7.707 1.609 1.311
590 HD13 LEU 79 HD13 LEU 79 9.073 2.667 0.966
591 HD21 LEU 79 HD21 LEU 79 9.188 -0.603 2.703
592 HD22 LEU 79 HD22 LEU 79 9.682 -1.535 1.294
593 HD23 LEU 79 HD23 LEU 79 8.043 -0.892 1.393
594 H VAL 80 HN VAL 80 11.921 0.308 -2.483
595 HA VAL 80 HA VAL 80 13.928 0.788 -0.588
596 HB VAL 80 HB VAL 80 14.063 -1.056 -2.233
597 HG11 VAL 80 HG11 VAL 80 14.865 -0.689 -4.508
598 HG12 VAL 80 HG12 VAL 80 14.694 1.051 -4.268
599 HG13 VAL 80 HG13 VAL 80 13.271 0.004 -4.207
600 HG21 VAL 80 HG21 VAL 80 16.476 -0.926 -2.710
601 HG22 VAL 80 HG22 VAL 80 16.091 -0.424 -1.064
602 HG23 VAL 80 HG23 VAL 80 16.450 0.788 -2.294
603 H LYS 81 HN LYS 81 12.994 2.667 -3.355
604 HA LYS 81 HA LYS 81 15.311 4.340 -3.276
605 HB2 LYS 81 HB2 LYS 81 12.670 4.681 -4.660
606 HB3 LYS 81 HB1 LYS 81 14.071 5.712 -4.923
607 HG2 LYS 81 HG2 LYS 81 15.345 3.810 -5.774
608 HG3 LYS 81 HG1 LYS 81 13.975 2.747 -5.470
609 HD2 LYS 81 HD2 LYS 81 13.942 5.096 -7.370
610 HD3 LYS 81 HD1 LYS 81 14.201 3.421 -7.851
611 HE2 LYS 81 HE2 LYS 81 11.983 2.836 -6.958
612 HE3 LYS 81 HE1 LYS 81 11.714 4.515 -6.511
613 HZ1 LYS 81 HZ1 LYS 81 12.054 3.437 -9.240
614 HZ2 LYS 81 HZ2 LYS 81 11.933 5.089 -8.872
615 HZ3 LYS 81 HZ3 LYS 81 10.648 4.059 -8.543
616 H ILE 82 HN ILE 82 12.358 4.259 -1.579
617 HA ILE 82 HA ILE 82 12.361 7.064 -0.868
618 HB ILE 82 HB ILE 82 10.855 4.767 0.407
619 HG12 ILE 82 HG12 ILE 82 9.927 6.722 -1.705
620 HG13 ILE 82 HG11 ILE 82 10.338 5.035 -1.996
621 HG21 ILE 82 HG21 ILE 82 9.350 6.517 1.261
622 HG22 ILE 82 HG22 ILE 82 10.388 7.752 0.550
623 HG23 ILE 82 HG23 ILE 82 10.998 6.735 1.859
624 HD11 ILE 82 HD11 ILE 82 8.502 4.354 -0.536
625 HD12 ILE 82 HD12 ILE 82 7.944 5.353 -1.878
626 HD13 ILE 82 HD13 ILE 82 8.102 6.049 -0.267
627 H ALA 83 HN ALA 83 13.040 3.973 0.709
628 HA ALA 83 HA ALA 83 13.962 5.126 3.145
629 HB1 ALA 83 HB1 ALA 83 14.424 2.355 2.036
630 HB2 ALA 83 HB2 ALA 83 13.077 2.849 3.065
631 HB3 ALA 83 HB3 ALA 83 14.724 2.863 3.696
632 H GLY 84 HN GLY 84 15.465 4.206 0.141
633 HA2 GLY 84 HA2 GLY 84 17.434 5.217 -0.622
634 HA3 GLY 84 HA1 GLY 84 17.938 5.457 1.051
635 H LEU 85 HN LEU 85 19.035 3.948 2.058
636 HA LEU 85 HA LEU 85 20.303 2.125 2.498
637 HB2 LEU 85 HB2 LEU 85 18.182 0.662 0.917
638 HB3 LEU 85 HB1 LEU 85 19.356 -0.094 1.970
639 HG LEU 85 HG LEU 85 17.163 1.791 2.849
640 HD11 LEU 85 HD11 LEU 85 16.142 -0.198 3.835
641 HD12 LEU 85 HD12 LEU 85 17.406 -1.199 3.125
642 HD13 LEU 85 HD13 LEU 85 16.276 -0.334 2.083
643 HD21 LEU 85 HD21 LEU 85 19.126 0.158 4.467
644 HD22 LEU 85 HD22 LEU 85 17.781 1.092 5.121
645 HD23 LEU 85 HD23 LEU 85 19.111 1.916 4.314
646 H GLU 86 HN GLU 86 19.168 1.124 -0.642
647 HA GLU 86 HA GLU 86 21.856 0.440 -1.503
648 HB2 GLU 86 HB2 GLU 86 19.143 0.018 -2.747
649 HB3 GLU 86 HB1 GLU 86 20.656 -0.559 -3.436
650 HG2 GLU 86 HG2 GLU 86 19.489 -1.365 -0.784
651 HG3 GLU 86 HG1 GLU 86 19.462 -2.323 -2.266
652 H HIS 87 HN HIS 87 19.842 3.072 -1.621
653 HA HIS 87 HA HIS 87 21.257 4.180 -3.929
654 HB2 HIS 87 HB2 HIS 87 18.914 3.370 -4.529
655 HB3 HIS 87 HB1 HIS 87 18.295 4.577 -3.415
656 HD1 HIS 87 HD1 HIS 87 18.343 7.074 -4.255
657 HD2 HIS 87 HD2 HIS 87 19.936 4.312 -6.921
658 HE1 HIS 87 HE1 HIS 87 18.575 8.274 -6.461
659 H HIS 88 HN HIS 88 21.253 6.554 -3.835
660 HA HIS 88 HA HIS 88 21.332 7.507 -1.105
661 HB2 HIS 88 HB2 HIS 88 23.232 8.042 -2.593
662 HB3 HIS 88 HB1 HIS 88 22.138 8.831 -3.723
663 HD1 HIS 88 HD1 HIS 88 21.686 11.283 -3.317
664 HD2 HIS 88 HD2 HIS 88 23.503 9.426 -0.083
665 HE1 HIS 88 HE1 HIS 88 22.255 13.120 -1.691
Start of MODEL 19
1 H1 MET 1 HT1 MET 1 14.504 8.133 7.706
2 H2 MET 1 HT2 MET 1 14.203 9.070 9.064
3 H3 MET 1 HT3 MET 1 15.629 9.309 8.188
4 HA MET 1 HA MET 1 14.076 11.050 7.816
5 HB2 MET 1 HB2 MET 1 15.598 10.328 5.973
6 HB3 MET 1 HB1 MET 1 14.328 9.268 5.379
7 HG2 MET 1 HG2 MET 1 14.411 11.302 4.083
8 HG3 MET 1 HG1 MET 1 12.893 11.223 4.982
9 HE1 MET 1 HE1 MET 1 16.542 12.217 6.199
10 HE2 MET 1 HE2 MET 1 16.473 13.967 6.007
11 HE3 MET 1 HE3 MET 1 16.401 12.919 4.589
12 H VAL 2 HN VAL 2 12.686 7.957 6.551
13 HA VAL 2 HA VAL 2 10.118 9.261 6.472
14 HB VAL 2 HB VAL 2 9.235 7.132 5.556
15 HG11 VAL 2 HG11 VAL 2 10.132 8.781 4.027
16 HG12 VAL 2 HG12 VAL 2 10.471 7.155 3.437
17 HG13 VAL 2 HG13 VAL 2 11.747 8.098 4.205
18 HG21 VAL 2 HG21 VAL 2 10.762 5.282 4.990
19 HG22 VAL 2 HG22 VAL 2 10.694 5.543 6.735
20 HG23 VAL 2 HG23 VAL 2 12.076 6.121 5.810
21 H THR 3 HN THR 3 8.481 9.040 7.859
22 HA THR 3 HA THR 3 9.071 7.477 10.264
23 HB THR 3 HB THR 3 8.780 9.915 10.634
24 HG1 THR 3 HG1 THR 3 6.474 8.840 11.753
25 HG21 THR 3 HG21 THR 3 5.961 9.457 9.625
26 HG22 THR 3 HG22 THR 3 7.203 10.424 8.832
27 HG23 THR 3 HG23 THR 3 6.541 10.938 10.387
28 H ALA 4 HN ALA 4 7.191 7.530 7.539
29 HA ALA 4 HA ALA 4 5.622 5.290 8.471
30 HB1 ALA 4 HB1 ALA 4 4.086 7.182 8.709
31 HB2 ALA 4 HB2 ALA 4 3.606 6.203 7.324
32 HB3 ALA 4 HB3 ALA 4 4.475 7.719 7.078
33 H ALA 5 HN ALA 5 5.865 3.762 6.999
34 HA ALA 5 HA ALA 5 7.361 4.343 4.633
35 HB1 ALA 5 HB1 ALA 5 6.162 1.746 5.587
36 HB2 ALA 5 HB2 ALA 5 7.800 2.317 5.917
37 HB3 ALA 5 HB3 ALA 5 7.311 1.925 4.267
38 H LEU 6 HN LEU 6 4.158 2.810 5.156
39 HA LEU 6 HA LEU 6 3.033 4.215 2.956
40 HB2 LEU 6 HB2 LEU 6 2.486 2.349 1.534
41 HB3 LEU 6 HB1 LEU 6 4.218 2.429 1.721
42 HG LEU 6 HG LEU 6 2.458 0.456 3.212
43 HD11 LEU 6 HD11 LEU 6 4.049 0.136 0.695
44 HD12 LEU 6 HD12 LEU 6 2.290 0.040 0.854
45 HD13 LEU 6 HD13 LEU 6 3.314 -1.188 1.604
46 HD21 LEU 6 HD21 LEU 6 5.441 0.515 2.745
47 HD22 LEU 6 HD22 LEU 6 4.550 -0.753 3.588
48 HD23 LEU 6 HD23 LEU 6 4.629 0.876 4.267
49 H THR 7 HN THR 7 0.878 4.187 2.998
50 HA THR 7 HA THR 7 -0.403 2.670 5.148
51 HB THR 7 HB THR 7 -1.208 5.301 3.864
52 HG1 THR 7 HG1 THR 7 -0.694 4.780 6.587
53 HG21 THR 7 HG21 THR 7 -3.198 3.945 4.418
54 HG22 THR 7 HG22 THR 7 -3.056 5.345 5.488
55 HG23 THR 7 HG23 THR 7 -2.572 3.747 6.058
56 H ILE 8 HN ILE 8 -1.712 1.142 4.593
57 HA ILE 8 HA ILE 8 -2.568 0.725 1.849
58 HB ILE 8 HB ILE 8 -2.782 -0.992 4.340
59 HG12 ILE 8 HG12 ILE 8 -1.178 -1.432 1.835
60 HG13 ILE 8 HG11 ILE 8 -0.505 -0.780 3.334
61 HG21 ILE 8 HG21 ILE 8 -3.748 -1.620 1.580
62 HG22 ILE 8 HG22 ILE 8 -4.682 -1.438 3.080
63 HG23 ILE 8 HG23 ILE 8 -3.564 -2.790 2.899
64 HD11 ILE 8 HD11 ILE 8 -1.102 -2.894 4.444
65 HD12 ILE 8 HD12 ILE 8 -0.004 -3.129 3.085
66 HD13 ILE 8 HD13 ILE 8 -1.718 -3.503 2.907
67 H TYR 9 HN TYR 9 -4.462 1.207 1.133
68 HA TYR 9 HA TYR 9 -6.698 1.683 2.992
69 HB2 TYR 9 HB2 TYR 9 -6.303 2.641 0.158
70 HB3 TYR 9 HB1 TYR 9 -7.676 3.012 1.196
71 HD1 TYR 9 HD1 TYR 9 -7.170 4.260 3.369
72 HD2 TYR 9 HD2 TYR 9 -4.472 4.030 0.111
73 HE1 TYR 9 HE1 TYR 9 -6.022 6.222 4.220
74 HE2 TYR 9 HE2 TYR 9 -3.299 6.001 0.926
75 HH TYR 9 HH TYR 9 -3.841 7.323 4.042
76 H THR 10 HN THR 10 -8.295 0.308 2.957
77 HA THR 10 HA THR 10 -9.051 -1.070 0.593
78 HB THR 10 HB THR 10 -7.089 -2.411 1.247
79 HG1 THR 10 HG1 THR 10 -9.239 -4.062 1.982
80 HG21 THR 10 HG21 THR 10 -7.070 -3.704 3.349
81 HG22 THR 10 HG22 THR 10 -8.549 -2.886 3.852
82 HG23 THR 10 HG23 THR 10 -7.059 -1.967 3.650
83 H THR 11 HN THR 11 -10.826 -2.653 1.197
84 HA THR 11 HA THR 11 -12.287 -1.827 3.625
85 HB THR 11 HB THR 11 -13.829 -2.885 1.316
86 HG1 THR 11 HG1 THR 11 -12.623 -1.450 0.131
87 HG21 THR 11 HG21 THR 11 -14.845 -2.149 3.431
88 HG22 THR 11 HG22 THR 11 -15.398 -1.168 2.074
89 HG23 THR 11 HG23 THR 11 -14.181 -0.534 3.181
90 H SER 12 HN SER 12 -13.714 -3.586 4.381
91 HA SER 12 HA SER 12 -12.313 -5.924 4.790
92 HB2 SER 12 HB2 SER 12 -15.247 -5.388 5.002
93 HB3 SER 12 HB1 SER 12 -14.367 -6.647 5.894
94 HG SER 12 HG SER 12 -14.608 -3.936 6.342
95 H TRP 13 HN TRP 13 -14.600 -5.117 2.253
96 HA TRP 13 HA TRP 13 -14.969 -7.877 1.464
97 HB2 TRP 13 HB2 TRP 13 -16.446 -6.903 -0.320
98 HB3 TRP 13 HB1 TRP 13 -16.927 -6.557 1.334
99 HD1 TRP 13 HD1 TRP 13 -16.962 -4.063 2.101
100 HE1 TRP 13 HE1 TRP 13 -16.713 -1.827 0.875
101 HE3 TRP 13 HE3 TRP 13 -15.194 -5.777 -2.381
102 HZ2 TRP 13 HZ2 TRP 13 -15.908 -0.901 -1.657
103 HZ3 TRP 13 HZ3 TRP 13 -14.719 -4.144 -4.155
104 HH2 TRP 13 HH2 TRP 13 -15.067 -1.753 -3.796
105 H CYS 14 HN CYS 14 -12.519 -5.805 0.938
106 HA CYS 14 HA CYS 14 -12.149 -6.317 -1.861
107 HB2 CYS 14 HB2 CYS 14 -10.298 -5.174 0.242
108 HB3 CYS 14 HB1 CYS 14 -9.937 -5.226 -1.480
109 HG CYS 14 HG CYS 14 -11.626 -3.420 -2.283
110 H GLY 15 HN GLY 15 -11.545 -8.247 -2.567
111 HA2 GLY 15 HA2 GLY 15 -10.957 -10.390 -0.849
112 HA3 GLY 15 HA1 GLY 15 -10.799 -10.405 -2.595
113 H TYR 16 HN TYR 16 -8.833 -8.197 -2.491
114 HA TYR 16 HA TYR 16 -6.606 -9.937 -2.065
115 HB2 TYR 16 HB2 TYR 16 -6.726 -7.216 -3.305
116 HB3 TYR 16 HB1 TYR 16 -5.229 -8.131 -3.112
117 HD1 TYR 16 HD1 TYR 16 -5.579 -10.719 -3.895
118 HD2 TYR 16 HD2 TYR 16 -7.653 -7.327 -5.434
119 HE1 TYR 16 HE1 TYR 16 -6.049 -11.952 -5.961
120 HE2 TYR 16 HE2 TYR 16 -8.132 -8.563 -7.507
121 HH TYR 16 HH TYR 16 -7.774 -11.878 -7.724
122 H CYS 17 HN CYS 17 -8.139 -7.930 0.039
123 HA CYS 17 HA CYS 17 -6.115 -6.412 1.186
124 HB2 CYS 17 HB2 CYS 17 -7.484 -6.375 3.251
125 HB3 CYS 17 HB1 CYS 17 -8.431 -6.047 1.806
126 HG CYS 17 HG CYS 17 -9.915 -8.217 1.836
127 H LEU 18 HN LEU 18 -7.240 -9.580 2.403
128 HA LEU 18 HA LEU 18 -5.156 -9.836 4.274
129 HB2 LEU 18 HB2 LEU 18 -5.882 -12.066 4.712
130 HB3 LEU 18 HB1 LEU 18 -7.296 -11.077 4.468
131 HG LEU 18 HG LEU 18 -6.165 -13.008 2.422
132 HD11 LEU 18 HD11 LEU 18 -8.072 -14.411 2.993
133 HD12 LEU 18 HD12 LEU 18 -8.496 -13.299 4.299
134 HD13 LEU 18 HD13 LEU 18 -6.975 -14.191 4.352
135 HD21 LEU 18 HD21 LEU 18 -7.436 -11.219 1.390
136 HD22 LEU 18 HD22 LEU 18 -8.789 -11.509 2.490
137 HD23 LEU 18 HD23 LEU 18 -8.329 -12.735 1.304
138 H ARG 19 HN ARG 19 -5.390 -10.809 0.954
139 HA ARG 19 HA ARG 19 -3.245 -12.600 0.815
140 HB2 ARG 19 HB2 ARG 19 -4.375 -10.710 -1.241
141 HB3 ARG 19 HB1 ARG 19 -3.105 -11.858 -1.617
142 HG2 ARG 19 HG2 ARG 19 -5.817 -12.651 -0.554
143 HG3 ARG 19 HG1 ARG 19 -5.422 -12.566 -2.267
144 HD2 ARG 19 HD2 ARG 19 -5.199 -14.843 -1.607
145 HD3 ARG 19 HD1 ARG 19 -3.576 -14.216 -1.840
146 HE ARG 19 HE ARG 19 -4.828 -14.489 0.800
147 HH11 ARG 19 HH11 ARG 19 -2.025 -15.031 -1.329
148 HH12 ARG 19 HH12 ARG 19 -1.092 -15.816 -0.146
149 HH21 ARG 19 HH21 ARG 19 -3.505 -15.573 2.446
150 HH22 ARG 19 HH22 ARG 19 -1.955 -16.101 2.076
151 H LEU 20 HN LEU 20 -3.451 -9.144 0.304
152 HA LEU 20 HA LEU 20 -0.767 -8.608 -0.234
153 HB2 LEU 20 HB2 LEU 20 -2.570 -7.134 -0.831
154 HB3 LEU 20 HB1 LEU 20 -3.027 -6.949 0.843
155 HG LEU 20 HG LEU 20 -0.948 -5.758 1.264
156 HD11 LEU 20 HD11 LEU 20 0.386 -4.933 -0.667
157 HD12 LEU 20 HD12 LEU 20 -0.563 -5.960 -1.738
158 HD13 LEU 20 HD13 LEU 20 0.467 -6.683 -0.503
159 HD21 LEU 20 HD21 LEU 20 -1.614 -3.713 0.156
160 HD22 LEU 20 HD22 LEU 20 -3.018 -4.597 0.754
161 HD23 LEU 20 HD23 LEU 20 -2.615 -4.630 -0.965
162 H LYS 21 HN LYS 21 -2.631 -8.697 2.774
163 HA LYS 21 HA LYS 21 -0.687 -7.618 4.502
164 HB2 LYS 21 HB2 LYS 21 -2.775 -9.707 5.162
165 HB3 LYS 21 HB1 LYS 21 -1.879 -8.761 6.332
166 HG2 LYS 21 HG2 LYS 21 -3.884 -7.722 4.341
167 HG3 LYS 21 HG1 LYS 21 -4.120 -7.914 6.077
168 HD2 LYS 21 HD2 LYS 21 -2.340 -6.250 6.472
169 HD3 LYS 21 HD1 LYS 21 -2.175 -6.040 4.726
170 HE2 LYS 21 HE2 LYS 21 -3.565 -4.281 5.656
171 HE3 LYS 21 HE1 LYS 21 -4.521 -5.328 4.602
172 HZ1 LYS 21 HZ1 LYS 21 -4.529 -5.266 7.581
173 HZ2 LYS 21 HZ2 LYS 21 -5.216 -6.497 6.704
174 HZ3 LYS 21 HZ3 LYS 21 -5.807 -4.945 6.538
175 H THR 22 HN THR 22 -1.371 -10.981 3.584
176 HA THR 22 HA THR 22 0.559 -12.221 5.149
177 HB THR 22 HB THR 22 -0.468 -13.046 2.418
178 HG1 THR 22 HG1 THR 22 -1.653 -12.966 4.914
179 HG21 THR 22 HG21 THR 22 1.504 -14.325 3.168
180 HG22 THR 22 HG22 THR 22 0.052 -15.321 3.133
181 HG23 THR 22 HG23 THR 22 0.672 -14.721 4.673
182 H ALA 23 HN ALA 23 0.737 -10.980 1.825
183 HA ALA 23 HA ALA 23 3.307 -11.876 1.203
184 HB1 ALA 23 HB1 ALA 23 1.638 -11.106 -0.434
185 HB2 ALA 23 HB2 ALA 23 3.220 -10.371 -0.664
186 HB3 ALA 23 HB3 ALA 23 1.919 -9.445 0.091
187 H LEU 24 HN LEU 24 2.260 -8.797 2.616
188 HA LEU 24 HA LEU 24 4.938 -7.713 2.647
189 HB2 LEU 24 HB2 LEU 24 2.538 -6.856 4.208
190 HB3 LEU 24 HB1 LEU 24 4.014 -5.940 4.034
191 HG LEU 24 HG LEU 24 1.974 -6.506 1.884
192 HD11 LEU 24 HD11 LEU 24 2.861 -3.983 3.248
193 HD12 LEU 24 HD12 LEU 24 1.327 -4.795 3.493
194 HD13 LEU 24 HD13 LEU 24 1.711 -4.055 1.921
195 HD21 LEU 24 HD21 LEU 24 4.135 -6.478 0.781
196 HD22 LEU 24 HD22 LEU 24 4.597 -5.028 1.690
197 HD23 LEU 24 HD23 LEU 24 3.277 -4.967 0.522
198 H THR 25 HN THR 25 2.957 -9.411 4.953
199 HA THR 25 HA THR 25 4.676 -9.004 7.131
200 HB THR 25 HB THR 25 2.700 -11.224 6.567
201 HG1 THR 25 HG1 THR 25 1.581 -9.361 6.667
202 HG21 THR 25 HG21 THR 25 3.932 -10.356 9.200
203 HG22 THR 25 HG22 THR 25 4.270 -11.872 8.365
204 HG23 THR 25 HG23 THR 25 2.661 -11.567 9.021
205 H ALA 26 HN ALA 26 4.543 -11.498 4.608
206 HA ALA 26 HA ALA 26 6.527 -13.201 5.616
207 HB1 ALA 26 HB1 ALA 26 4.991 -13.794 3.780
208 HB2 ALA 26 HB2 ALA 26 6.677 -14.093 3.362
209 HB3 ALA 26 HB3 ALA 26 5.849 -12.671 2.726
210 H ASN 27 HN ASN 27 6.759 -10.400 3.494
211 HA ASN 27 HA ASN 27 9.642 -10.734 3.249
212 HB2 ASN 27 HB2 ASN 27 7.747 -8.748 2.009
213 HB3 ASN 27 HB1 ASN 27 9.492 -8.640 1.824
214 HD21 ASN 27 HD21 ASN 27 6.630 -10.516 1.060
215 HD22 ASN 27 HD22 ASN 27 7.390 -11.460 -0.166
216 H ARG 28 HN ARG 28 7.661 -9.362 5.419
217 HA ARG 28 HA ARG 28 7.891 -8.118 7.222
218 HB2 ARG 28 HB2 ARG 28 10.865 -8.292 6.745
219 HB3 ARG 28 HB1 ARG 28 10.088 -7.779 8.232
220 HG2 ARG 28 HG2 ARG 28 9.099 -9.987 8.502
221 HG3 ARG 28 HG1 ARG 28 9.841 -10.505 6.988
222 HD2 ARG 28 HD2 ARG 28 12.057 -10.066 7.958
223 HD3 ARG 28 HD1 ARG 28 11.288 -9.617 9.478
224 HE ARG 28 HE ARG 28 10.625 -12.218 8.435
225 HH11 ARG 28 HH11 ARG 28 12.812 -10.416 10.590
226 HH12 ARG 28 HH12 ARG 28 13.092 -11.735 11.615
227 HH21 ARG 28 HH21 ARG 28 11.062 -14.051 9.842
228 HH22 ARG 28 HH22 ARG 28 12.100 -13.842 11.162
229 H ILE 29 HN ILE 29 6.952 -6.594 5.526
230 HA ILE 29 HA ILE 29 8.571 -4.148 5.556
231 HB ILE 29 HB ILE 29 5.998 -4.735 3.998
232 HG12 ILE 29 HG12 ILE 29 7.495 -4.066 1.985
233 HG13 ILE 29 HG11 ILE 29 8.840 -4.274 3.088
234 HG21 ILE 29 HG21 ILE 29 7.535 -2.155 4.083
235 HG22 ILE 29 HG22 ILE 29 5.951 -2.438 4.794
236 HG23 ILE 29 HG23 ILE 29 6.160 -2.496 3.036
237 HD11 ILE 29 HD11 ILE 29 8.445 -6.128 1.612
238 HD12 ILE 29 HD12 ILE 29 6.857 -6.390 2.340
239 HD13 ILE 29 HD13 ILE 29 8.328 -6.599 3.310
240 H ALA 30 HN ALA 30 7.928 -2.421 6.826
241 HA ALA 30 HA ALA 30 5.785 -2.951 8.704
242 HB1 ALA 30 HB1 ALA 30 7.699 -0.642 8.491
243 HB2 ALA 30 HB2 ALA 30 7.890 -2.050 9.544
244 HB3 ALA 30 HB3 ALA 30 6.569 -0.908 9.820
245 H TYR 31 HN TYR 31 3.838 -2.454 8.052
246 HA TYR 31 HA TYR 31 3.484 -0.118 6.326
247 HB2 TYR 31 HB2 TYR 31 1.583 -1.359 5.272
248 HB3 TYR 31 HB1 TYR 31 3.172 -2.042 4.947
249 HD1 TYR 31 HD2 TYR 31 3.847 -4.149 6.005
250 HD2 TYR 31 HD1 TYR 31 -0.079 -2.612 6.520
251 HE1 TYR 31 HE2 TYR 31 3.107 -6.340 6.798
252 HE2 TYR 31 HE1 TYR 31 -0.829 -4.810 7.322
253 HH TYR 31 HH TYR 31 1.400 -7.246 8.141
254 H ASP 32 HN ASP 32 1.495 0.924 6.458
255 HA ASP 32 HA ASP 32 0.144 0.640 9.041
256 HB2 ASP 32 HB2 ASP 32 1.201 2.827 8.742
257 HB3 ASP 32 HB1 ASP 32 0.475 2.987 7.154
258 H GLU 33 HN GLU 33 -2.126 0.471 8.975
259 HA GLU 33 HA GLU 33 -3.335 0.290 6.312
260 HB2 GLU 33 HB2 GLU 33 -4.476 -1.785 6.980
261 HB3 GLU 33 HB1 GLU 33 -2.732 -1.985 6.909
262 HG2 GLU 33 HG2 GLU 33 -2.585 -1.832 9.321
263 HG3 GLU 33 HG1 GLU 33 -4.315 -1.530 9.423
264 H VAL 34 HN VAL 34 -5.250 1.233 6.201
265 HA VAL 34 HA VAL 34 -6.777 1.461 8.624
266 HB VAL 34 HB VAL 34 -5.607 3.622 8.503
267 HG11 VAL 34 HG11 VAL 34 -6.815 4.042 5.807
268 HG12 VAL 34 HG12 VAL 34 -5.117 3.655 6.137
269 HG13 VAL 34 HG13 VAL 34 -5.805 5.163 6.718
270 HG21 VAL 34 HG21 VAL 34 -7.892 3.642 9.339
271 HG22 VAL 34 HG22 VAL 34 -8.479 3.913 7.690
272 HG23 VAL 34 HG23 VAL 34 -7.493 5.134 8.481
273 H ASP 35 HN ASP 35 -8.883 1.065 8.310
274 HA ASP 35 HA ASP 35 -9.599 0.246 5.647
275 HB2 ASP 35 HB2 ASP 35 -11.743 -0.482 6.642
276 HB3 ASP 35 HB1 ASP 35 -10.370 -1.119 7.531
277 H ILE 36 HN ILE 36 -11.005 1.155 4.341
278 HA ILE 36 HA ILE 36 -11.289 3.994 4.694
279 HB ILE 36 HB ILE 36 -11.960 4.087 2.378
280 HG12 ILE 36 HG12 ILE 36 -11.695 1.070 2.432
281 HG13 ILE 36 HG11 ILE 36 -13.227 1.934 2.339
282 HG21 ILE 36 HG21 ILE 36 -9.839 3.229 1.468
283 HG22 ILE 36 HG22 ILE 36 -9.585 2.318 2.951
284 HG23 ILE 36 HG23 ILE 36 -9.609 4.083 2.990
285 HD11 ILE 36 HD11 ILE 36 -11.027 1.891 0.296
286 HD12 ILE 36 HD12 ILE 36 -12.504 2.864 0.178
287 HD13 ILE 36 HD13 ILE 36 -12.598 1.100 0.191
288 H GLU 37 HN GLU 37 -13.266 1.364 5.201
289 HA GLU 37 HA GLU 37 -15.688 2.607 4.547
290 HB2 GLU 37 HB2 GLU 37 -16.674 0.829 6.179
291 HB3 GLU 37 HB1 GLU 37 -15.948 0.310 4.665
292 HG2 GLU 37 HG2 GLU 37 -13.984 -0.378 5.752
293 HG3 GLU 37 HG1 GLU 37 -14.478 0.343 7.288
294 H HIS 38 HN HIS 38 -13.720 2.547 7.447
295 HA HIS 38 HA HIS 38 -15.582 4.125 8.935
296 HB2 HIS 38 HB2 HIS 38 -14.007 2.711 10.123
297 HB3 HIS 38 HB1 HIS 38 -12.645 3.541 9.381
298 HD1 HIS 38 HD1 HIS 38 -11.591 5.263 10.909
299 HD2 HIS 38 HD2 HIS 38 -15.612 4.636 11.770
300 HE1 HIS 38 HE1 HIS 38 -12.111 6.686 12.905
301 H ASN 39 HN ASN 39 -12.545 4.801 7.200
302 HA ASN 39 HA ASN 39 -13.010 7.608 7.706
303 HB2 ASN 39 HB2 ASN 39 -10.568 6.221 6.663
304 HB3 ASN 39 HB1 ASN 39 -10.741 7.972 6.650
305 HD21 ASN 39 HD21 ASN 39 -8.824 6.476 8.048
306 HD22 ASN 39 HD22 ASN 39 -9.030 6.808 9.722
307 H ARG 40 HN ARG 40 -14.275 8.541 6.544
308 HA ARG 40 HA ARG 40 -15.122 8.100 3.938
309 HB2 ARG 40 HB2 ARG 40 -16.363 9.401 5.503
310 HB3 ARG 40 HB1 ARG 40 -15.047 10.542 5.687
311 HG2 ARG 40 HG2 ARG 40 -15.397 11.236 3.342
312 HG3 ARG 40 HG1 ARG 40 -16.804 10.165 3.278
313 HD2 ARG 40 HD2 ARG 40 -17.865 11.365 5.065
314 HD3 ARG 40 HD1 ARG 40 -16.432 12.358 5.302
315 HE ARG 40 HE ARG 40 -17.584 12.485 2.683
316 HH11 ARG 40 HH11 ARG 40 -17.553 13.911 5.949
317 HH12 ARG 40 HH12 ARG 40 -18.223 15.381 5.447
318 HH21 ARG 40 HH21 ARG 40 -18.511 14.556 2.025
319 HH22 ARG 40 HH22 ARG 40 -18.786 15.755 3.209
320 H ALA 41 HN ALA 41 -12.599 10.280 5.177
321 HA ALA 41 HA ALA 41 -12.015 11.518 2.701
322 HB1 ALA 41 HB1 ALA 41 -11.392 12.529 4.845
323 HB2 ALA 41 HB2 ALA 41 -9.992 12.343 3.784
324 HB3 ALA 41 HB3 ALA 41 -10.238 11.221 5.121
325 H ALA 42 HN ALA 42 -10.723 8.694 4.326
326 HA ALA 42 HA ALA 42 -8.618 8.304 2.462
327 HB1 ALA 42 HB1 ALA 42 -8.555 7.361 4.744
328 HB2 ALA 42 HB2 ALA 42 -8.281 6.181 3.471
329 HB3 ALA 42 HB3 ALA 42 -9.849 6.238 4.290
330 H ALA 43 HN ALA 43 -11.892 7.087 2.798
331 HA ALA 43 HA ALA 43 -11.909 5.234 0.684
332 HB1 ALA 43 HB1 ALA 43 -14.190 6.932 1.690
333 HB2 ALA 43 HB2 ALA 43 -13.687 5.398 2.391
334 HB3 ALA 43 HB3 ALA 43 -14.329 5.450 0.747
335 H GLU 44 HN GLU 44 -12.555 8.668 0.769
336 HA GLU 44 HA GLU 44 -13.293 9.086 -1.898
337 HB2 GLU 44 HB2 GLU 44 -13.472 10.768 -0.080
338 HB3 GLU 44 HB1 GLU 44 -11.720 10.893 -0.050
339 HG2 GLU 44 HG2 GLU 44 -12.580 12.756 -1.251
340 HG3 GLU 44 HG1 GLU 44 -11.799 11.675 -2.405
341 H PHE 45 HN PHE 45 -10.184 9.309 -0.283
342 HA PHE 45 HA PHE 45 -8.549 9.979 -2.401
343 HB2 PHE 45 HB2 PHE 45 -7.860 10.132 -0.053
344 HB3 PHE 45 HB1 PHE 45 -7.908 8.383 0.080
345 HD1 PHE 45 HD2 PHE 45 -6.161 11.182 -1.571
346 HD2 PHE 45 HD1 PHE 45 -6.083 7.059 -0.525
347 HE1 PHE 45 HE2 PHE 45 -3.807 11.052 -2.282
348 HE2 PHE 45 HE1 PHE 45 -3.752 6.920 -1.241
349 HZ PHE 45 HZ PHE 45 -2.598 8.919 -2.119
350 H VAL 46 HN VAL 46 -8.947 6.702 -1.034
351 HA VAL 46 HA VAL 46 -7.429 5.467 -3.105
352 HB VAL 46 HB VAL 46 -7.580 4.395 -0.930
353 HG11 VAL 46 HG11 VAL 46 -9.602 3.166 -0.413
354 HG12 VAL 46 HG12 VAL 46 -10.475 4.192 -1.579
355 HG13 VAL 46 HG13 VAL 46 -9.682 4.910 -0.138
356 HG21 VAL 46 HG21 VAL 46 -7.957 2.165 -1.540
357 HG22 VAL 46 HG22 VAL 46 -7.298 3.033 -2.958
358 HG23 VAL 46 HG23 VAL 46 -9.034 2.669 -2.843
359 H GLY 47 HN GLY 47 -10.817 6.212 -2.830
360 HA2 GLY 47 HA2 GLY 47 -11.682 4.529 -4.931
361 HA3 GLY 47 HA1 GLY 47 -12.535 5.940 -4.306
362 H SER 48 HN SER 48 -10.042 7.535 -4.866
363 HA SER 48 HA SER 48 -10.744 8.275 -7.566
364 HB2 SER 48 HB2 SER 48 -8.670 9.433 -5.695
365 HB3 SER 48 HB1 SER 48 -9.249 10.166 -7.193
366 HG SER 48 HG SER 48 -10.902 9.551 -4.949
367 H VAL 49 HN VAL 49 -8.073 6.716 -5.893
368 HA VAL 49 HA VAL 49 -6.371 6.834 -8.285
369 HB VAL 49 HB VAL 49 -4.537 6.111 -6.786
370 HG11 VAL 49 HG11 VAL 49 -4.415 8.160 -5.467
371 HG12 VAL 49 HG12 VAL 49 -6.138 8.425 -5.753
372 HG13 VAL 49 HG13 VAL 49 -5.000 8.490 -7.108
373 HG21 VAL 49 HG21 VAL 49 -6.602 6.344 -4.623
374 HG22 VAL 49 HG22 VAL 49 -4.887 5.982 -4.379
375 HG23 VAL 49 HG23 VAL 49 -5.938 4.823 -5.205
376 H ASN 50 HN ASN 50 -8.660 4.855 -7.615
377 HA ASN 50 HA ASN 50 -7.248 2.344 -7.447
378 HB2 ASN 50 HB2 ASN 50 -9.914 3.172 -6.938
379 HB3 ASN 50 HB1 ASN 50 -9.983 1.957 -8.210
380 HD21 ASN 50 HD21 ASN 50 -7.647 2.172 -5.603
381 HD22 ASN 50 HD22 ASN 50 -8.104 0.689 -4.855
382 H GLY 51 HN GLY 51 -8.136 0.584 -8.989
383 HA2 GLY 51 HA2 GLY 51 -7.375 1.535 -11.644
384 HA3 GLY 51 HA1 GLY 51 -7.314 -0.134 -11.082
385 H GLY 52 HN GLY 52 -9.380 2.434 -12.183
386 HA2 GLY 52 HA2 GLY 52 -11.122 2.004 -13.712
387 HA3 GLY 52 HA1 GLY 52 -11.316 0.403 -13.003
388 H ASN 53 HN ASN 53 -11.955 0.413 -10.680
389 HA ASN 53 HA ASN 53 -13.614 2.668 -9.883
390 HB2 ASN 53 HB2 ASN 53 -14.926 0.893 -11.305
391 HB3 ASN 53 HB1 ASN 53 -14.736 -0.147 -9.902
392 HD21 ASN 53 HD21 ASN 53 -17.132 0.894 -11.129
393 HD22 ASN 53 HD22 ASN 53 -17.974 1.783 -9.921
394 H ARG 54 HN ARG 54 -14.230 2.273 -7.537
395 HA ARG 54 HA ARG 54 -11.923 1.279 -6.194
396 HB2 ARG 54 HB2 ARG 54 -12.827 2.012 -4.094
397 HB3 ARG 54 HB1 ARG 54 -13.253 3.218 -5.280
398 HG2 ARG 54 HG2 ARG 54 -15.133 1.116 -4.202
399 HG3 ARG 54 HG1 ARG 54 -15.031 2.775 -3.629
400 HD2 ARG 54 HD2 ARG 54 -15.689 3.563 -5.857
401 HD3 ARG 54 HD1 ARG 54 -15.783 1.893 -6.411
402 HE ARG 54 HE ARG 54 -17.353 2.240 -4.130
403 HH11 ARG 54 HH11 ARG 54 -17.338 2.943 -7.590
404 HH12 ARG 54 HH12 ARG 54 -19.027 3.154 -7.716
405 HH21 ARG 54 HH21 ARG 54 -19.688 2.426 -4.304
406 HH22 ARG 54 HH22 ARG 54 -20.410 2.799 -5.794
407 H THR 55 HN THR 55 -11.428 -0.600 -5.699
408 HA THR 55 HA THR 55 -13.261 -2.560 -4.712
409 HB THR 55 HB THR 55 -13.850 -2.683 -7.077
410 HG1 THR 55 HG1 THR 55 -14.043 -4.673 -6.556
411 HG21 THR 55 HG21 THR 55 -12.199 -3.323 -8.812
412 HG22 THR 55 HG22 THR 55 -10.920 -3.228 -7.590
413 HG23 THR 55 HG23 THR 55 -11.792 -1.783 -8.046
414 H VAL 56 HN VAL 56 -10.037 -1.636 -5.792
415 HA VAL 56 HA VAL 56 -8.975 -3.950 -4.376
416 HB VAL 56 HB VAL 56 -6.864 -3.504 -5.724
417 HG11 VAL 56 HG11 VAL 56 -7.715 -4.805 -7.650
418 HG12 VAL 56 HG12 VAL 56 -9.367 -4.445 -7.139
419 HG13 VAL 56 HG13 VAL 56 -8.325 -5.427 -6.116
420 HG21 VAL 56 HG21 VAL 56 -7.422 -1.317 -6.589
421 HG22 VAL 56 HG22 VAL 56 -8.825 -1.987 -7.429
422 HG23 VAL 56 HG23 VAL 56 -7.197 -2.458 -7.917
423 HA PRO 57 HA PRO 57 -6.971 -1.450 -1.363
424 HB2 PRO 57 HB2 PRO 57 -4.638 -2.918 -1.094
425 HB3 PRO 57 HB1 PRO 57 -6.160 -3.323 -0.296
426 HG2 PRO 57 HG2 PRO 57 -4.984 -4.429 -2.806
427 HG3 PRO 57 HG1 PRO 57 -5.825 -5.277 -1.497
428 HD2 PRO 57 HD2 PRO 57 -7.058 -4.709 -3.800
429 HD3 PRO 57 HD1 PRO 57 -7.921 -4.611 -2.248
430 H THR 58 HN THR 58 -5.474 0.158 -1.276
431 HA THR 58 HA THR 58 -3.552 0.335 -3.465
432 HB THR 58 HB THR 58 -5.183 2.660 -2.404
433 HG1 THR 58 HG1 THR 58 -5.880 0.713 -3.983
434 HG21 THR 58 HG21 THR 58 -3.379 2.418 -4.830
435 HG22 THR 58 HG22 THR 58 -3.002 3.308 -3.345
436 HG23 THR 58 HG23 THR 58 -4.327 3.835 -4.382
437 H VAL 59 HN VAL 59 -1.592 1.312 -2.838
438 HA VAL 59 HA VAL 59 -1.301 1.820 0.033
439 HB VAL 59 HB VAL 59 1.153 1.358 -0.357
440 HG11 VAL 59 HG11 VAL 59 0.877 -1.090 -0.555
441 HG12 VAL 59 HG12 VAL 59 -0.843 -0.801 -0.911
442 HG13 VAL 59 HG13 VAL 59 -0.141 -0.313 0.652
443 HG21 VAL 59 HG21 VAL 59 1.790 0.099 -2.332
444 HG22 VAL 59 HG22 VAL 59 1.185 1.707 -2.753
445 HG23 VAL 59 HG23 VAL 59 0.156 0.288 -2.981
446 H LYS 60 HN LYS 60 -0.719 3.787 0.631
447 HA LYS 60 HA LYS 60 0.328 5.616 -1.432
448 HB2 LYS 60 HB2 LYS 60 -1.678 6.388 -0.129
449 HB3 LYS 60 HB1 LYS 60 -0.690 6.315 1.326
450 HG2 LYS 60 HG2 LYS 60 0.911 7.897 0.144
451 HG3 LYS 60 HG1 LYS 60 -0.359 8.136 -1.050
452 HD2 LYS 60 HD2 LYS 60 -0.503 9.915 0.531
453 HD3 LYS 60 HD1 LYS 60 -1.861 8.832 0.835
454 HE2 LYS 60 HE2 LYS 60 -0.812 9.546 2.916
455 HE3 LYS 60 HE1 LYS 60 -0.637 7.810 2.702
456 HZ1 LYS 60 HZ1 LYS 60 1.685 8.235 1.925
457 HZ2 LYS 60 HZ2 LYS 60 1.405 8.766 3.480
458 HZ3 LYS 60 HZ3 LYS 60 1.460 9.881 2.233
459 H PHE 61 HN PHE 61 2.417 5.960 -1.317
460 HA PHE 61 HA PHE 61 3.841 4.917 0.971
461 HB2 PHE 61 HB2 PHE 61 4.819 6.089 -1.627
462 HB3 PHE 61 HB1 PHE 61 5.860 5.438 -0.369
463 HD1 PHE 61 HD1 PHE 61 3.183 4.567 -2.748
464 HD2 PHE 61 HD2 PHE 61 6.307 3.139 -0.251
465 HE1 PHE 61 HE1 PHE 61 2.967 2.370 -3.761
466 HE2 PHE 61 HE2 PHE 61 6.101 0.907 -1.273
467 HZ PHE 61 HZ PHE 61 4.438 0.519 -3.032
468 H ALA 62 HN ALA 62 5.838 6.313 1.524
469 HA ALA 62 HA ALA 62 4.998 8.573 2.928
470 HB1 ALA 62 HB1 ALA 62 6.911 7.225 3.569
471 HB2 ALA 62 HB2 ALA 62 7.378 8.920 3.393
472 HB3 ALA 62 HB3 ALA 62 7.781 7.759 2.135
473 H ASP 63 HN ASP 63 6.020 8.258 -0.342
474 HA ASP 63 HA ASP 63 6.846 11.006 -0.659
475 HB2 ASP 63 HB2 ASP 63 7.307 10.444 -2.963
476 HB3 ASP 63 HB1 ASP 63 7.911 9.143 -1.952
477 H GLY 64 HN GLY 64 3.980 9.328 -0.591
478 HA2 GLY 64 HA2 GLY 64 1.866 10.326 -0.618
479 HA3 GLY 64 HA1 GLY 64 2.529 11.664 -1.550
480 H SER 65 HN SER 65 3.605 8.796 -2.900
481 HA SER 65 HA SER 65 1.566 9.080 -4.946
482 HB2 SER 65 HB2 SER 65 3.950 9.287 -5.619
483 HB3 SER 65 HB1 SER 65 4.237 7.648 -5.049
484 HG SER 65 HG SER 65 2.660 8.553 -7.192
485 H THR 66 HN THR 66 0.578 7.176 -5.819
486 HA THR 66 HA THR 66 0.369 5.043 -3.850
487 HB THR 66 HB THR 66 -1.914 4.773 -4.978
488 HG1 THR 66 HG1 THR 66 -2.092 6.072 -6.612
489 HG21 THR 66 HG21 THR 66 -2.929 6.498 -3.532
490 HG22 THR 66 HG22 THR 66 -1.328 7.206 -3.276
491 HG23 THR 66 HG23 THR 66 -1.685 5.568 -2.707
492 H LEU 67 HN LEU 67 0.099 2.988 -4.602
493 HA LEU 67 HA LEU 67 0.256 2.501 -7.481
494 HB2 LEU 67 HB2 LEU 67 1.669 0.872 -5.326
495 HB3 LEU 67 HB1 LEU 67 1.508 0.374 -6.990
496 HG LEU 67 HG LEU 67 3.119 2.735 -5.994
497 HD11 LEU 67 HD11 LEU 67 5.056 1.428 -6.583
498 HD12 LEU 67 HD12 LEU 67 4.044 0.123 -7.183
499 HD13 LEU 67 HD13 LEU 67 4.077 0.480 -5.461
500 HD21 LEU 67 HD21 LEU 67 3.966 2.840 -8.294
501 HD22 LEU 67 HD22 LEU 67 2.241 3.171 -8.216
502 HD23 LEU 67 HD23 LEU 67 2.815 1.596 -8.778
503 H THR 68 HN THR 68 -1.420 1.384 -8.137
504 HA THR 68 HA THR 68 -3.463 0.510 -6.370
505 HB THR 68 HB THR 68 -3.056 -0.218 -9.295
506 HG1 THR 68 HG1 THR 68 -4.327 2.127 -8.234
507 HG21 THR 68 HG21 THR 68 -5.515 -0.222 -9.347
508 HG22 THR 68 HG22 THR 68 -5.550 0.202 -7.635
509 HG23 THR 68 HG23 THR 68 -4.913 -1.362 -8.143
510 H ASN 69 HN ASN 69 -3.989 -1.689 -5.788
511 HA ASN 69 HA ASN 69 -2.575 -3.262 -4.540
512 HB2 ASN 69 HB2 ASN 69 -3.558 -5.403 -5.338
513 HB3 ASN 69 HB1 ASN 69 -4.708 -4.141 -4.965
514 HD21 ASN 69 HD21 ASN 69 -4.924 -6.543 -6.634
515 HD22 ASN 69 HD22 ASN 69 -5.413 -6.022 -8.202
516 HA PRO 70 HA PRO 70 1.027 -4.361 -6.943
517 HB2 PRO 70 HB2 PRO 70 2.754 -3.275 -5.173
518 HB3 PRO 70 HB1 PRO 70 1.987 -2.357 -6.465
519 HG2 PRO 70 HG2 PRO 70 1.543 -2.145 -3.594
520 HG3 PRO 70 HG1 PRO 70 0.944 -1.103 -4.895
521 HD2 PRO 70 HD2 PRO 70 -0.430 -3.266 -3.460
522 HD3 PRO 70 HD1 PRO 70 -1.071 -1.981 -4.502
523 H SER 71 HN SER 71 2.452 -5.961 -6.660
524 HA SER 71 HA SER 71 1.987 -7.824 -4.554
525 HB2 SER 71 HB2 SER 71 4.225 -7.806 -6.599
526 HB3 SER 71 HB1 SER 71 3.525 -9.203 -5.773
527 HG SER 71 HG SER 71 2.403 -7.566 -7.763
528 H ALA 72 HN ALA 72 3.961 -8.667 -3.282
529 HA ALA 72 HA ALA 72 4.881 -6.606 -1.642
530 HB1 ALA 72 HB1 ALA 72 5.893 -9.436 -1.842
531 HB2 ALA 72 HB2 ALA 72 4.581 -8.841 -0.805
532 HB3 ALA 72 HB3 ALA 72 6.233 -8.308 -0.529
533 H ASP 73 HN ASP 73 6.425 -8.196 -4.346
534 HA ASP 73 HA ASP 73 8.977 -7.001 -3.845
535 HB2 ASP 73 HB2 ASP 73 7.878 -8.230 -6.383
536 HB3 ASP 73 HB1 ASP 73 9.531 -7.654 -6.206
537 H GLU 74 HN GLU 74 6.154 -6.114 -5.660
538 HA GLU 74 HA GLU 74 7.264 -3.982 -7.141
539 HB2 GLU 74 HB2 GLU 74 4.416 -4.432 -6.260
540 HB3 GLU 74 HB1 GLU 74 4.920 -3.244 -7.452
541 HG2 GLU 74 HG2 GLU 74 5.766 -5.092 -8.858
542 HG3 GLU 74 HG1 GLU 74 5.140 -6.236 -7.674
543 H VAL 75 HN VAL 75 5.573 -4.104 -4.044
544 HA VAL 75 HA VAL 75 5.698 -1.303 -3.636
545 HB VAL 75 HB VAL 75 5.352 -1.854 -1.164
546 HG11 VAL 75 HG11 VAL 75 3.405 -2.913 -3.184
547 HG12 VAL 75 HG12 VAL 75 3.533 -1.221 -2.689
548 HG13 VAL 75 HG13 VAL 75 3.003 -2.448 -1.532
549 HG21 VAL 75 HG21 VAL 75 4.846 -4.553 -2.321
550 HG22 VAL 75 HG22 VAL 75 4.566 -4.049 -0.646
551 HG23 VAL 75 HG23 VAL 75 6.212 -4.136 -1.283
552 H LYS 76 HN LYS 76 7.815 -3.922 -2.595
553 HA LYS 76 HA LYS 76 9.467 -2.370 -0.971
554 HB2 LYS 76 HB2 LYS 76 9.957 -4.899 -2.505
555 HB3 LYS 76 HB1 LYS 76 11.239 -4.110 -1.570
556 HG2 LYS 76 HG2 LYS 76 9.886 -4.450 0.448
557 HG3 LYS 76 HG1 LYS 76 8.597 -5.120 -0.545
558 HD2 LYS 76 HD2 LYS 76 9.917 -6.902 0.497
559 HD3 LYS 76 HD1 LYS 76 10.034 -6.958 -1.261
560 HE2 LYS 76 HE2 LYS 76 12.223 -5.675 -1.025
561 HE3 LYS 76 HE1 LYS 76 12.085 -5.945 0.706
562 HZ1 LYS 76 HZ1 LYS 76 12.127 -8.086 -1.326
563 HZ2 LYS 76 HZ2 LYS 76 12.236 -8.311 0.352
564 HZ3 LYS 76 HZ3 LYS 76 13.475 -7.554 -0.503
565 H ALA 77 HN ALA 77 9.544 -3.015 -4.428
566 HA ALA 77 HA ALA 77 11.974 -1.796 -5.041
567 HB1 ALA 77 HB1 ALA 77 11.163 -1.722 -7.339
568 HB2 ALA 77 HB2 ALA 77 9.519 -2.023 -6.777
569 HB3 ALA 77 HB3 ALA 77 10.757 -3.261 -6.579
570 H LYS 78 HN LYS 78 8.773 -0.390 -4.640
571 HA LYS 78 HA LYS 78 9.730 2.227 -5.500
572 HB2 LYS 78 HB2 LYS 78 7.372 1.531 -5.964
573 HB3 LYS 78 HB1 LYS 78 7.084 1.543 -4.220
574 HG2 LYS 78 HG2 LYS 78 7.678 3.889 -4.115
575 HG3 LYS 78 HG1 LYS 78 7.994 3.863 -5.852
576 HD2 LYS 78 HD2 LYS 78 5.733 3.603 -6.353
577 HD3 LYS 78 HD1 LYS 78 5.323 3.225 -4.671
578 HE2 LYS 78 HE2 LYS 78 4.698 5.510 -5.121
579 HE3 LYS 78 HE1 LYS 78 6.069 5.422 -4.012
580 HZ1 LYS 78 HZ1 LYS 78 6.432 7.152 -5.553
581 HZ2 LYS 78 HZ2 LYS 78 6.215 6.115 -6.889
582 HZ3 LYS 78 HZ3 LYS 78 7.551 5.928 -5.878
583 H LEU 79 HN LEU 79 8.790 0.676 -2.474
584 HA LEU 79 HA LEU 79 9.017 2.930 -0.831
585 HB2 LEU 79 HB2 LEU 79 7.847 0.918 -0.139
586 HB3 LEU 79 HB1 LEU 79 9.347 0.018 -0.146
587 HG LEU 79 HG LEU 79 10.185 1.433 1.694
588 HD11 LEU 79 HD11 LEU 79 8.651 2.877 2.913
589 HD12 LEU 79 HD12 LEU 79 7.397 2.581 1.709
590 HD13 LEU 79 HD13 LEU 79 8.867 3.435 1.255
591 HD21 LEU 79 HD21 LEU 79 7.552 0.059 2.223
592 HD22 LEU 79 HD22 LEU 79 8.773 0.449 3.435
593 HD23 LEU 79 HD23 LEU 79 9.138 -0.710 2.160
594 H VAL 80 HN VAL 80 11.410 0.495 -1.751
595 HA VAL 80 HA VAL 80 13.429 1.238 0.065
596 HB VAL 80 HB VAL 80 13.323 -0.862 -1.362
597 HG11 VAL 80 HG11 VAL 80 14.496 0.888 -3.495
598 HG12 VAL 80 HG12 VAL 80 12.936 0.071 -3.532
599 HG13 VAL 80 HG13 VAL 80 14.421 -0.877 -3.535
600 HG21 VAL 80 HG21 VAL 80 15.233 -0.342 0.007
601 HG22 VAL 80 HG22 VAL 80 15.929 0.631 -1.302
602 HG23 VAL 80 HG23 VAL 80 15.722 -1.113 -1.499
603 H LYS 81 HN LYS 81 12.596 2.577 -3.073
604 HA LYS 81 HA LYS 81 14.951 4.155 -3.234
605 HB2 LYS 81 HB2 LYS 81 12.331 4.395 -4.676
606 HB3 LYS 81 HB1 LYS 81 13.724 5.420 -5.002
607 HG2 LYS 81 HG2 LYS 81 15.022 3.345 -5.455
608 HG3 LYS 81 HG1 LYS 81 13.503 2.457 -5.349
609 HD2 LYS 81 HD2 LYS 81 12.591 3.664 -7.186
610 HD3 LYS 81 HD1 LYS 81 13.963 4.774 -7.193
611 HE2 LYS 81 HE2 LYS 81 14.060 1.829 -7.800
612 HE3 LYS 81 HE1 LYS 81 14.205 3.142 -8.964
613 HZ1 LYS 81 HZ1 LYS 81 16.414 2.414 -8.431
614 HZ2 LYS 81 HZ2 LYS 81 16.079 2.489 -6.774
615 HZ3 LYS 81 HZ3 LYS 81 16.184 3.898 -7.648
616 H ILE 82 HN ILE 82 11.957 4.586 -1.658
617 HA ILE 82 HA ILE 82 12.142 7.430 -1.440
618 HB ILE 82 HB ILE 82 10.513 5.499 0.245
619 HG12 ILE 82 HG12 ILE 82 9.714 7.034 -2.227
620 HG13 ILE 82 HG11 ILE 82 10.105 5.320 -2.197
621 HG21 ILE 82 HG21 ILE 82 9.088 7.467 0.655
622 HG22 ILE 82 HG22 ILE 82 10.216 8.469 -0.261
623 HG23 ILE 82 HG23 ILE 82 10.728 7.720 1.255
624 HD11 ILE 82 HD11 ILE 82 7.717 5.671 -2.214
625 HD12 ILE 82 HD12 ILE 82 7.833 6.653 -0.752
626 HD13 ILE 82 HD13 ILE 82 8.218 4.933 -0.697
627 H ALA 83 HN ALA 83 12.978 4.653 0.500
628 HA ALA 83 HA ALA 83 13.928 6.263 2.695
629 HB1 ALA 83 HB1 ALA 83 14.225 3.300 2.200
630 HB2 ALA 83 HB2 ALA 83 12.920 4.064 3.102
631 HB3 ALA 83 HB3 ALA 83 14.576 4.138 3.712
632 H GLY 84 HN GLY 84 15.332 4.435 0.023
633 HA2 GLY 84 HA2 GLY 84 17.349 5.256 -0.982
634 HA3 GLY 84 HA1 GLY 84 17.950 5.600 0.644
635 H LEU 85 HN LEU 85 19.547 4.210 0.983
636 HA LEU 85 HA LEU 85 20.532 2.299 1.646
637 HB2 LEU 85 HB2 LEU 85 17.810 1.015 1.370
638 HB3 LEU 85 HB1 LEU 85 19.184 0.315 2.209
639 HG LEU 85 HG LEU 85 17.572 2.736 3.003
640 HD11 LEU 85 HD11 LEU 85 16.961 1.397 4.941
641 HD12 LEU 85 HD12 LEU 85 17.873 0.036 4.289
642 HD13 LEU 85 HD13 LEU 85 16.456 0.644 3.430
643 HD21 LEU 85 HD21 LEU 85 19.908 3.120 3.583
644 HD22 LEU 85 HD22 LEU 85 19.994 1.537 4.357
645 HD23 LEU 85 HD23 LEU 85 18.966 2.796 5.037
646 H GLU 86 HN GLU 86 18.182 1.088 -0.736
647 HA GLU 86 HA GLU 86 20.411 -0.148 -2.222
648 HB2 GLU 86 HB2 GLU 86 17.706 -1.334 -1.600
649 HB3 GLU 86 HB1 GLU 86 18.912 -2.055 -2.648
650 HG2 GLU 86 HG2 GLU 86 19.328 -1.511 0.278
651 HG3 GLU 86 HG1 GLU 86 18.770 -3.049 -0.378
652 H HIS 87 HN HIS 87 20.423 1.108 -4.032
653 HA HIS 87 HA HIS 87 19.877 1.929 -6.051
654 HB2 HIS 87 HB2 HIS 87 17.500 0.116 -5.773
655 HB3 HIS 87 HB1 HIS 87 17.643 1.209 -7.136
656 HD1 HIS 87 HD1 HIS 87 18.915 0.299 -9.124
657 HD2 HIS 87 HD2 HIS 87 19.742 -1.730 -5.597
658 HE1 HIS 87 HE1 HIS 87 20.273 -1.700 -9.775
659 H HIS 88 HN HIS 88 19.768 3.990 -5.771
660 HA HIS 88 HA HIS 88 17.339 5.236 -4.771
661 HB2 HIS 88 HB2 HIS 88 20.016 6.403 -5.578
662 HB3 HIS 88 HB1 HIS 88 18.678 7.328 -4.912
663 HD1 HIS 88 HD1 HIS 88 21.256 4.735 -3.923
664 HD2 HIS 88 HD2 HIS 88 18.472 7.284 -2.187
665 HE1 HIS 88 HE1 HIS 88 21.718 4.690 -1.448
Start of MODEL 20
1 H1 MET 1 HT1 MET 1 10.301 12.847 6.028
2 H2 MET 1 HT2 MET 1 11.237 13.777 7.078
3 H3 MET 1 HT3 MET 1 9.679 13.261 7.521
4 HA MET 1 HA MET 1 11.882 11.435 6.925
5 HB2 MET 1 HB2 MET 1 10.746 12.273 9.621
6 HB3 MET 1 HB1 MET 1 11.810 10.901 9.396
7 HG2 MET 1 HG2 MET 1 13.574 12.367 8.619
8 HG3 MET 1 HG1 MET 1 12.507 13.760 8.771
9 HE1 MET 1 HE1 MET 1 12.046 14.060 12.623
10 HE2 MET 1 HE2 MET 1 10.989 13.153 11.549
11 HE3 MET 1 HE3 MET 1 11.637 14.715 11.039
12 H VAL 2 HN VAL 2 11.322 9.230 7.314
13 HA VAL 2 HA VAL 2 8.593 8.882 6.525
14 HB VAL 2 HB VAL 2 9.228 6.467 6.055
15 HG11 VAL 2 HG11 VAL 2 10.405 7.049 3.984
16 HG12 VAL 2 HG12 VAL 2 10.739 8.653 4.629
17 HG13 VAL 2 HG13 VAL 2 9.076 8.164 4.305
18 HG21 VAL 2 HG21 VAL 2 11.616 5.962 5.821
19 HG22 VAL 2 HG22 VAL 2 11.228 6.347 7.500
20 HG23 VAL 2 HG23 VAL 2 12.025 7.544 6.478
21 H THR 3 HN THR 3 7.494 9.251 8.400
22 HA THR 3 HA THR 3 7.708 7.179 10.420
23 HB THR 3 HB THR 3 7.218 9.426 11.275
24 HG1 THR 3 HG1 THR 3 5.032 7.612 11.538
25 HG21 THR 3 HG21 THR 3 5.077 10.576 10.777
26 HG22 THR 3 HG22 THR 3 4.701 9.328 9.586
27 HG23 THR 3 HG23 THR 3 6.080 10.395 9.340
28 H ALA 4 HN ALA 4 5.927 8.039 7.622
29 HA ALA 4 HA ALA 4 4.439 5.543 7.837
30 HB1 ALA 4 HB1 ALA 4 2.610 6.622 6.575
31 HB2 ALA 4 HB2 ALA 4 3.488 8.153 6.624
32 HB3 ALA 4 HB3 ALA 4 2.889 7.431 8.118
33 H ALA 5 HN ALA 5 5.710 4.350 6.606
34 HA ALA 5 HA ALA 5 7.228 5.178 4.397
35 HB1 ALA 5 HB1 ALA 5 7.677 3.109 5.629
36 HB2 ALA 5 HB2 ALA 5 7.439 2.763 3.914
37 HB3 ALA 5 HB3 ALA 5 6.153 2.429 5.066
38 H LEU 6 HN LEU 6 4.289 3.182 4.400
39 HA LEU 6 HA LEU 6 3.086 4.769 2.462
40 HB2 LEU 6 HB2 LEU 6 2.723 3.044 0.710
41 HB3 LEU 6 HB1 LEU 6 4.399 3.522 0.829
42 HG LEU 6 HG LEU 6 4.402 1.279 0.316
43 HD11 LEU 6 HD11 LEU 6 5.258 -0.004 2.179
44 HD12 LEU 6 HD12 LEU 6 4.837 1.350 3.240
45 HD13 LEU 6 HD13 LEU 6 6.004 1.575 1.943
46 HD21 LEU 6 HD21 LEU 6 3.079 -0.464 1.457
47 HD22 LEU 6 HD22 LEU 6 2.161 0.734 0.545
48 HD23 LEU 6 HD23 LEU 6 2.217 0.841 2.307
49 H THR 7 HN THR 7 1.024 4.661 2.433
50 HA THR 7 HA THR 7 -0.096 3.017 4.545
51 HB THR 7 HB THR 7 -1.137 5.584 3.307
52 HG1 THR 7 HG1 THR 7 -0.277 5.241 5.984
53 HG21 THR 7 HG21 THR 7 -2.116 4.021 5.699
54 HG22 THR 7 HG22 THR 7 -2.941 4.118 4.142
55 HG23 THR 7 HG23 THR 7 -2.771 5.563 5.144
56 H ILE 8 HN ILE 8 -1.350 1.497 4.053
57 HA ILE 8 HA ILE 8 -2.176 0.975 1.335
58 HB ILE 8 HB ILE 8 -2.258 -0.651 3.874
59 HG12 ILE 8 HG12 ILE 8 -0.661 -1.052 1.355
60 HG13 ILE 8 HG11 ILE 8 -0.020 -0.386 2.861
61 HG21 ILE 8 HG21 ILE 8 -4.134 -1.242 2.721
62 HG22 ILE 8 HG22 ILE 8 -2.954 -2.551 2.484
63 HG23 ILE 8 HG23 ILE 8 -3.295 -1.400 1.174
64 HD11 ILE 8 HD11 ILE 8 -1.115 -3.154 2.424
65 HD12 ILE 8 HD12 ILE 8 -0.527 -2.516 3.962
66 HD13 ILE 8 HD13 ILE 8 0.582 -2.705 2.604
67 H TYR 9 HN TYR 9 -4.087 1.471 0.652
68 HA TYR 9 HA TYR 9 -6.266 1.811 2.562
69 HB2 TYR 9 HB2 TYR 9 -5.928 2.829 -0.243
70 HB3 TYR 9 HB1 TYR 9 -7.396 3.014 0.707
71 HD1 TYR 9 HD1 TYR 9 -6.833 4.044 3.153
72 HD2 TYR 9 HD2 TYR 9 -4.601 4.653 -0.403
73 HE1 TYR 9 HE1 TYR 9 -5.989 6.137 4.066
74 HE2 TYR 9 HE2 TYR 9 -3.740 6.752 0.486
75 HH TYR 9 HH TYR 9 -4.078 7.638 3.766
76 H THR 10 HN THR 10 -7.365 0.094 2.817
77 HA THR 10 HA THR 10 -8.727 -1.085 0.656
78 HB THR 10 HB THR 10 -6.497 -2.321 0.553
79 HG1 THR 10 HG1 THR 10 -7.954 -3.653 -0.204
80 HG21 THR 10 HG21 THR 10 -5.946 -2.219 2.953
81 HG22 THR 10 HG22 THR 10 -5.917 -3.877 2.355
82 HG23 THR 10 HG23 THR 10 -7.290 -3.305 3.299
83 H THR 11 HN THR 11 -9.859 -3.136 1.868
84 HA THR 11 HA THR 11 -10.303 -2.359 4.609
85 HB THR 11 HB THR 11 -12.643 -3.464 3.148
86 HG1 THR 11 HG1 THR 11 -13.100 -1.521 2.236
87 HG21 THR 11 HG21 THR 11 -12.572 -3.046 5.570
88 HG22 THR 11 HG22 THR 11 -13.776 -2.058 4.748
89 HG23 THR 11 HG23 THR 11 -12.244 -1.343 5.243
90 H SER 12 HN SER 12 -10.754 -4.209 5.873
91 HA SER 12 HA SER 12 -9.464 -6.539 5.177
92 HB2 SER 12 HB2 SER 12 -11.512 -6.110 7.337
93 HB3 SER 12 HB1 SER 12 -10.338 -7.432 7.271
94 HG SER 12 HG SER 12 -9.814 -4.640 7.497
95 H TRP 13 HN TRP 13 -12.544 -5.713 4.033
96 HA TRP 13 HA TRP 13 -13.307 -8.487 3.661
97 HB2 TRP 13 HB2 TRP 13 -15.322 -7.449 2.409
98 HB3 TRP 13 HB1 TRP 13 -15.249 -7.303 4.152
99 HD1 TRP 13 HD1 TRP 13 -15.450 -4.978 5.123
100 HE1 TRP 13 HE1 TRP 13 -15.570 -2.605 4.229
101 HE3 TRP 13 HE3 TRP 13 -14.306 -5.908 0.218
102 HZ2 TRP 13 HZ2 TRP 13 -15.280 -1.264 1.741
103 HZ3 TRP 13 HZ3 TRP 13 -14.257 -4.013 -1.355
104 HH2 TRP 13 HH2 TRP 13 -14.737 -1.730 -0.604
105 H CYS 14 HN CYS 14 -11.249 -6.527 2.134
106 HA CYS 14 HA CYS 14 -11.901 -7.255 -0.577
107 HB2 CYS 14 HB2 CYS 14 -10.834 -5.101 -0.161
108 HB3 CYS 14 HB1 CYS 14 -9.487 -5.891 0.640
109 HG CYS 14 HG CYS 14 -10.116 -5.450 -2.613
110 H GLY 15 HN GLY 15 -10.873 -8.829 -1.786
111 HA2 GLY 15 HA2 GLY 15 -9.853 -11.058 -0.332
112 HA3 GLY 15 HA1 GLY 15 -10.002 -10.912 -2.080
113 H TYR 16 HN TYR 16 -8.465 -8.516 -2.265
114 HA TYR 16 HA TYR 16 -5.890 -9.752 -2.150
115 HB2 TYR 16 HB2 TYR 16 -6.769 -7.136 -3.295
116 HB3 TYR 16 HB1 TYR 16 -5.066 -7.586 -3.209
117 HD1 TYR 16 HD1 TYR 16 -5.008 -10.355 -3.917
118 HD2 TYR 16 HD2 TYR 16 -7.459 -7.265 -5.514
119 HE1 TYR 16 HE1 TYR 16 -5.214 -11.612 -5.999
120 HE2 TYR 16 HE2 TYR 16 -7.678 -8.532 -7.605
121 HH TYR 16 HH TYR 16 -6.704 -11.793 -7.871
122 H CYS 17 HN CYS 17 -7.575 -8.020 0.088
123 HA CYS 17 HA CYS 17 -5.605 -6.306 1.106
124 HB2 CYS 17 HB2 CYS 17 -7.828 -5.989 1.839
125 HB3 CYS 17 HB1 CYS 17 -7.969 -7.647 2.427
126 HG CYS 17 HG CYS 17 -7.542 -6.970 4.797
127 H LEU 18 HN LEU 18 -6.573 -9.511 2.461
128 HA LEU 18 HA LEU 18 -4.283 -9.647 4.125
129 HB2 LEU 18 HB2 LEU 18 -4.920 -11.884 4.710
130 HB3 LEU 18 HB1 LEU 18 -6.363 -10.908 4.637
131 HG LEU 18 HG LEU 18 -5.503 -12.820 2.456
132 HD11 LEU 18 HD11 LEU 18 -5.909 -14.050 4.468
133 HD12 LEU 18 HD12 LEU 18 -7.254 -14.292 3.349
134 HD13 LEU 18 HD13 LEU 18 -7.431 -13.201 4.723
135 HD21 LEU 18 HD21 LEU 18 -7.853 -12.650 1.737
136 HD22 LEU 18 HD22 LEU 18 -7.010 -11.112 1.646
137 HD23 LEU 18 HD23 LEU 18 -8.138 -11.420 2.975
138 H ARG 19 HN ARG 19 -4.919 -10.609 0.928
139 HA ARG 19 HA ARG 19 -2.883 -12.470 0.470
140 HB2 ARG 19 HB2 ARG 19 -4.759 -11.995 -1.084
141 HB3 ARG 19 HB1 ARG 19 -4.050 -10.430 -1.425
142 HG2 ARG 19 HG2 ARG 19 -3.600 -11.917 -3.262
143 HG3 ARG 19 HG1 ARG 19 -2.090 -11.581 -2.419
144 HD2 ARG 19 HD2 ARG 19 -3.737 -14.017 -1.824
145 HD3 ARG 19 HD1 ARG 19 -2.577 -14.001 -3.138
146 HE ARG 19 HE ARG 19 -0.928 -13.358 -1.330
147 HH11 ARG 19 HH11 ARG 19 -3.758 -15.314 -0.559
148 HH12 ARG 19 HH12 ARG 19 -2.926 -16.344 0.516
149 HH21 ARG 19 HH21 ARG 19 0.224 -14.809 0.118
150 HH22 ARG 19 HH22 ARG 19 -0.623 -16.072 0.885
151 H LEU 20 HN LEU 20 -3.029 -8.954 -0.023
152 HA LEU 20 HA LEU 20 -0.353 -8.685 -0.806
153 HB2 LEU 20 HB2 LEU 20 -2.137 -7.158 -1.483
154 HB3 LEU 20 HB1 LEU 20 -2.355 -6.670 0.173
155 HG LEU 20 HG LEU 20 -0.181 -5.681 0.214
156 HD11 LEU 20 HD11 LEU 20 -0.020 -6.468 -2.711
157 HD12 LEU 20 HD12 LEU 20 1.069 -6.987 -1.414
158 HD13 LEU 20 HD13 LEU 20 1.057 -5.313 -1.942
159 HD21 LEU 20 HD21 LEU 20 -2.053 -4.289 -0.369
160 HD22 LEU 20 HD22 LEU 20 -1.890 -4.744 -2.068
161 HD23 LEU 20 HD23 LEU 20 -0.628 -3.789 -1.287
162 H LYS 21 HN LYS 21 -2.029 -8.382 2.303
163 HA LYS 21 HA LYS 21 0.052 -7.269 3.843
164 HB2 LYS 21 HB2 LYS 21 -1.885 -9.413 4.795
165 HB3 LYS 21 HB1 LYS 21 -0.961 -8.339 5.818
166 HG2 LYS 21 HG2 LYS 21 -3.147 -7.492 3.929
167 HG3 LYS 21 HG1 LYS 21 -3.345 -7.726 5.664
168 HD2 LYS 21 HD2 LYS 21 -1.727 -5.889 6.047
169 HD3 LYS 21 HD1 LYS 21 -1.569 -5.693 4.305
170 HE2 LYS 21 HE2 LYS 21 -3.113 -4.027 5.178
171 HE3 LYS 21 HE1 LYS 21 -3.973 -5.167 4.140
172 HZ1 LYS 21 HZ1 LYS 21 -4.680 -6.307 6.277
173 HZ2 LYS 21 HZ2 LYS 21 -5.305 -4.774 6.056
174 HZ3 LYS 21 HZ3 LYS 21 -4.059 -4.982 7.119
175 H THR 22 HN THR 22 -0.593 -10.581 2.897
176 HA THR 22 HA THR 22 1.503 -11.805 4.334
177 HB THR 22 HB THR 22 0.166 -12.771 1.787
178 HG1 THR 22 HG1 THR 22 -1.418 -12.385 3.361
179 HG21 THR 22 HG21 THR 22 1.553 -14.276 4.023
180 HG22 THR 22 HG22 THR 22 2.200 -14.021 2.406
181 HG23 THR 22 HG23 THR 22 0.756 -15.010 2.630
182 H ALA 23 HN ALA 23 1.210 -10.745 0.939
183 HA ALA 23 HA ALA 23 3.711 -11.541 0.026
184 HB1 ALA 23 HB1 ALA 23 3.374 -9.974 -1.802
185 HB2 ALA 23 HB2 ALA 23 2.101 -9.162 -0.893
186 HB3 ALA 23 HB3 ALA 23 1.871 -10.824 -1.438
187 H LEU 24 HN LEU 24 2.735 -8.484 1.525
188 HA LEU 24 HA LEU 24 5.308 -7.284 1.238
189 HB2 LEU 24 HB2 LEU 24 3.132 -6.624 3.183
190 HB3 LEU 24 HB1 LEU 24 4.518 -5.617 2.883
191 HG LEU 24 HG LEU 24 2.171 -6.128 1.057
192 HD11 LEU 24 HD11 LEU 24 3.313 -3.691 2.378
193 HD12 LEU 24 HD12 LEU 24 1.801 -4.476 2.791
194 HD13 LEU 24 HD13 LEU 24 1.989 -3.637 1.235
195 HD21 LEU 24 HD21 LEU 24 3.224 -4.550 -0.524
196 HD22 LEU 24 HD22 LEU 24 4.092 -6.052 -0.431
197 HD23 LEU 24 HD23 LEU 24 4.706 -4.611 0.410
198 H THR 25 HN THR 25 3.831 -9.125 3.827
199 HA THR 25 HA THR 25 5.888 -8.657 5.693
200 HB THR 25 HB THR 25 3.930 -10.953 5.465
201 HG1 THR 25 HG1 THR 25 2.723 -9.215 5.833
202 HG21 THR 25 HG21 THR 25 5.832 -11.546 6.934
203 HG22 THR 25 HG22 THR 25 4.355 -11.338 7.869
204 HG23 THR 25 HG23 THR 25 5.577 -10.064 7.855
205 H ALA 26 HN ALA 26 5.476 -11.067 3.154
206 HA ALA 26 HA ALA 26 7.668 -12.719 3.865
207 HB1 ALA 26 HB1 ALA 26 5.846 -13.456 2.400
208 HB2 ALA 26 HB2 ALA 26 7.425 -13.670 1.647
209 HB3 ALA 26 HB3 ALA 26 6.395 -12.323 1.163
210 H ASN 27 HN ASN 27 7.481 -9.683 2.342
211 HA ASN 27 HA ASN 27 10.269 -9.870 1.420
212 HB2 ASN 27 HB2 ASN 27 8.001 -8.095 0.509
213 HB3 ASN 27 HB1 ASN 27 9.685 -7.790 0.093
214 HD21 ASN 27 HD21 ASN 27 6.957 -9.947 -0.371
215 HD22 ASN 27 HD22 ASN 27 7.605 -10.767 -1.732
216 H ARG 28 HN ARG 28 8.851 -9.260 4.041
217 HA ARG 28 HA ARG 28 8.849 -7.881 5.766
218 HB2 ARG 28 HB2 ARG 28 11.793 -7.977 5.129
219 HB3 ARG 28 HB1 ARG 28 11.142 -7.375 6.648
220 HG2 ARG 28 HG2 ARG 28 10.095 -9.554 7.060
221 HG3 ARG 28 HG1 ARG 28 10.767 -10.154 5.546
222 HD2 ARG 28 HD2 ARG 28 12.370 -9.144 7.891
223 HD3 ARG 28 HD1 ARG 28 12.064 -10.839 7.527
224 HE ARG 28 HE ARG 28 13.188 -9.674 5.275
225 HH11 ARG 28 HH11 ARG 28 14.134 -10.476 8.600
226 HH12 ARG 28 HH12 ARG 28 15.785 -10.642 8.245
227 HH21 ARG 28 HH21 ARG 28 15.523 -9.930 4.800
228 HH22 ARG 28 HH22 ARG 28 16.573 -10.326 6.086
229 H ILE 29 HN ILE 29 7.651 -6.421 4.463
230 HA ILE 29 HA ILE 29 9.008 -3.867 4.006
231 HB ILE 29 HB ILE 29 6.356 -4.924 3.030
232 HG12 ILE 29 HG12 ILE 29 8.874 -4.324 1.472
233 HG13 ILE 29 HG11 ILE 29 8.419 -5.932 2.034
234 HG21 ILE 29 HG21 ILE 29 7.729 -2.316 2.406
235 HG22 ILE 29 HG22 ILE 29 6.280 -2.498 3.373
236 HG23 ILE 29 HG23 ILE 29 6.239 -2.886 1.644
237 HD11 ILE 29 HD11 ILE 29 6.924 -4.202 0.090
238 HD12 ILE 29 HD12 ILE 29 6.409 -5.787 0.670
239 HD13 ILE 29 HD13 ILE 29 7.880 -5.641 -0.277
240 H ALA 30 HN ALA 30 8.583 -2.232 5.318
241 HA ALA 30 HA ALA 30 6.680 -2.454 7.469
242 HB1 ALA 30 HB1 ALA 30 8.852 -1.425 7.813
243 HB2 ALA 30 HB2 ALA 30 7.564 -0.231 8.066
244 HB3 ALA 30 HB3 ALA 30 8.489 -0.245 6.556
245 H TYR 31 HN TYR 31 4.610 -1.775 7.269
246 HA TYR 31 HA TYR 31 4.050 0.337 5.347
247 HB2 TYR 31 HB2 TYR 31 2.015 -0.873 4.585
248 HB3 TYR 31 HB1 TYR 31 3.522 -1.638 4.085
249 HD1 TYR 31 HD1 TYR 31 0.525 -1.890 6.171
250 HD2 TYR 31 HD2 TYR 31 4.107 -3.819 4.979
251 HE1 TYR 31 HE1 TYR 31 -0.331 -4.011 7.070
252 HE2 TYR 31 HE2 TYR 31 3.268 -5.955 5.879
253 HH TYR 31 HH TYR 31 1.664 -6.729 7.501
254 H ASP 32 HN ASP 32 1.846 1.182 5.584
255 HA ASP 32 HA ASP 32 0.926 1.059 8.354
256 HB2 ASP 32 HB2 ASP 32 1.938 3.243 7.956
257 HB3 ASP 32 HB1 ASP 32 1.063 3.412 6.444
258 H GLU 33 HN GLU 33 -1.186 0.416 8.483
259 HA GLU 33 HA GLU 33 -2.740 0.483 5.976
260 HB2 GLU 33 HB2 GLU 33 -3.773 -1.627 6.617
261 HB3 GLU 33 HB1 GLU 33 -2.038 -1.797 6.426
262 HG2 GLU 33 HG2 GLU 33 -1.744 -1.788 8.829
263 HG3 GLU 33 HG1 GLU 33 -3.468 -1.509 9.054
264 H VAL 34 HN VAL 34 -4.711 1.239 6.068
265 HA VAL 34 HA VAL 34 -6.059 1.401 8.609
266 HB VAL 34 HB VAL 34 -5.072 3.650 8.267
267 HG11 VAL 34 HG11 VAL 34 -4.811 3.633 5.849
268 HG12 VAL 34 HG12 VAL 34 -5.652 5.073 6.407
269 HG13 VAL 34 HG13 VAL 34 -6.565 3.769 5.664
270 HG21 VAL 34 HG21 VAL 34 -7.119 5.010 8.298
271 HG22 VAL 34 HG22 VAL 34 -7.212 3.592 9.347
272 HG23 VAL 34 HG23 VAL 34 -8.039 3.596 7.782
273 H ASP 35 HN ASP 35 -8.216 0.824 8.368
274 HA ASP 35 HA ASP 35 -8.908 -0.099 5.735
275 HB2 ASP 35 HB2 ASP 35 -10.528 -0.057 8.314
276 HB3 ASP 35 HB1 ASP 35 -11.172 -0.660 6.798
277 H ILE 36 HN ILE 36 -10.420 0.754 4.430
278 HA ILE 36 HA ILE 36 -10.262 3.605 4.473
279 HB ILE 36 HB ILE 36 -11.252 3.529 2.248
280 HG12 ILE 36 HG12 ILE 36 -11.527 0.595 2.896
281 HG13 ILE 36 HG11 ILE 36 -12.814 1.723 2.506
282 HG21 ILE 36 HG21 ILE 36 -9.422 2.107 1.267
283 HG22 ILE 36 HG22 ILE 36 -9.029 1.621 2.914
284 HG23 ILE 36 HG23 ILE 36 -8.898 3.313 2.441
285 HD11 ILE 36 HD11 ILE 36 -12.396 0.266 0.696
286 HD12 ILE 36 HD12 ILE 36 -10.685 0.681 0.704
287 HD13 ILE 36 HD13 ILE 36 -11.897 1.907 0.235
288 H GLU 37 HN GLU 37 -12.773 1.381 5.202
289 HA GLU 37 HA GLU 37 -14.883 3.172 4.696
290 HB2 GLU 37 HB2 GLU 37 -16.291 1.574 6.002
291 HB3 GLU 37 HB1 GLU 37 -15.394 0.848 4.677
292 HG2 GLU 37 HG2 GLU 37 -13.797 -0.083 6.205
293 HG3 GLU 37 HG1 GLU 37 -14.530 0.787 7.552
294 H HIS 38 HN HIS 38 -12.571 3.252 7.018
295 HA HIS 38 HA HIS 38 -14.254 4.353 9.123
296 HB2 HIS 38 HB2 HIS 38 -11.294 3.727 9.065
297 HB3 HIS 38 HB1 HIS 38 -12.127 4.475 10.423
298 HD1 HIS 38 HD1 HIS 38 -12.738 2.838 12.195
299 HD2 HIS 38 HD2 HIS 38 -12.593 1.083 8.438
300 HE1 HIS 38 HE1 HIS 38 -13.242 0.389 12.544
301 H ASN 39 HN ASN 39 -12.148 5.395 6.564
302 HA ASN 39 HA ASN 39 -12.284 8.111 7.663
303 HB2 ASN 39 HB2 ASN 39 -9.958 6.904 6.131
304 HB3 ASN 39 HB1 ASN 39 -10.109 8.615 6.477
305 HD21 ASN 39 HD21 ASN 39 -7.918 7.020 7.231
306 HD22 ASN 39 HD22 ASN 39 -7.864 6.960 8.944
307 H ARG 40 HN ARG 40 -13.694 9.159 6.541
308 HA ARG 40 HA ARG 40 -14.845 8.587 4.114
309 HB2 ARG 40 HB2 ARG 40 -15.805 10.148 5.684
310 HB3 ARG 40 HB1 ARG 40 -14.460 11.252 5.457
311 HG2 ARG 40 HG2 ARG 40 -15.151 11.535 3.101
312 HG3 ARG 40 HG1 ARG 40 -16.550 10.515 3.440
313 HD2 ARG 40 HD2 ARG 40 -17.326 12.091 5.109
314 HD3 ARG 40 HD1 ARG 40 -15.894 13.090 4.850
315 HE ARG 40 HE ARG 40 -17.466 12.568 2.515
316 HH11 ARG 40 HH11 ARG 40 -16.883 14.792 5.220
317 HH12 ARG 40 HH12 ARG 40 -17.604 16.136 4.484
318 HH21 ARG 40 HH21 ARG 40 -18.462 14.457 1.463
319 HH22 ARG 40 HH22 ARG 40 -18.539 15.938 2.272
320 H ALA 41 HN ALA 41 -12.173 10.834 4.730
321 HA ALA 41 HA ALA 41 -11.911 11.828 2.142
322 HB1 ALA 41 HB1 ALA 41 -9.799 11.588 4.280
323 HB2 ALA 41 HB2 ALA 41 -10.946 12.914 4.110
324 HB3 ALA 41 HB3 ALA 41 -9.725 12.640 2.867
325 H ALA 42 HN ALA 42 -10.486 9.117 3.806
326 HA ALA 42 HA ALA 42 -8.573 8.502 1.794
327 HB1 ALA 42 HB1 ALA 42 -8.268 7.839 4.135
328 HB2 ALA 42 HB2 ALA 42 -8.187 6.466 3.031
329 HB3 ALA 42 HB3 ALA 42 -9.645 6.738 3.987
330 H ALA 43 HN ALA 43 -11.760 7.269 2.670
331 HA ALA 43 HA ALA 43 -11.904 5.137 0.883
332 HB1 ALA 43 HB1 ALA 43 -14.304 5.197 1.241
333 HB2 ALA 43 HB2 ALA 43 -14.172 6.815 1.938
334 HB3 ALA 43 HB3 ALA 43 -13.439 5.438 2.759
335 H GLU 44 HN GLU 44 -12.688 8.544 0.375
336 HA GLU 44 HA GLU 44 -13.822 7.983 -2.203
337 HB2 GLU 44 HB2 GLU 44 -14.213 10.305 -2.410
338 HB3 GLU 44 HB1 GLU 44 -14.382 9.971 -0.695
339 HG2 GLU 44 HG2 GLU 44 -12.069 10.773 -0.380
340 HG3 GLU 44 HG1 GLU 44 -12.052 11.229 -2.067
341 H PHE 45 HN PHE 45 -10.736 8.955 -0.934
342 HA PHE 45 HA PHE 45 -9.429 9.681 -3.295
343 HB2 PHE 45 HB2 PHE 45 -8.557 10.259 -1.111
344 HB3 PHE 45 HB1 PHE 45 -8.394 8.562 -0.688
345 HD1 PHE 45 HD2 PHE 45 -7.156 11.141 -3.045
346 HD2 PHE 45 HD1 PHE 45 -6.387 7.442 -1.073
347 HE1 PHE 45 HE2 PHE 45 -4.835 11.174 -3.870
348 HE2 PHE 45 HE1 PHE 45 -4.090 7.488 -1.884
349 HZ PHE 45 HZ PHE 45 -3.306 9.352 -3.283
350 H VAL 46 HN VAL 46 -9.269 6.650 -1.471
351 HA VAL 46 HA VAL 46 -7.795 5.281 -3.439
352 HB VAL 46 HB VAL 46 -7.710 4.441 -1.171
353 HG11 VAL 46 HG11 VAL 46 -9.919 5.075 -0.441
354 HG12 VAL 46 HG12 VAL 46 -9.542 3.364 -0.147
355 HG13 VAL 46 HG13 VAL 46 -10.606 3.811 -1.496
356 HG21 VAL 46 HG21 VAL 46 -8.035 2.132 -1.460
357 HG22 VAL 46 HG22 VAL 46 -7.570 2.821 -3.042
358 HG23 VAL 46 HG23 VAL 46 -9.259 2.425 -2.692
359 H GLY 47 HN GLY 47 -11.223 5.701 -3.011
360 HA2 GLY 47 HA2 GLY 47 -12.076 3.670 -4.796
361 HA3 GLY 47 HA1 GLY 47 -13.001 5.075 -4.294
362 H SER 48 HN SER 48 -10.986 6.940 -5.296
363 HA SER 48 HA SER 48 -11.995 7.068 -7.987
364 HB2 SER 48 HB2 SER 48 -10.065 8.905 -6.555
365 HB3 SER 48 HB1 SER 48 -10.930 9.259 -8.056
366 HG SER 48 HG SER 48 -11.925 9.027 -5.425
367 H VAL 49 HN VAL 49 -8.932 6.406 -6.417
368 HA VAL 49 HA VAL 49 -7.541 6.198 -8.969
369 HB VAL 49 HB VAL 49 -5.516 5.801 -7.615
370 HG11 VAL 49 HG11 VAL 49 -5.440 7.965 -6.459
371 HG12 VAL 49 HG12 VAL 49 -7.199 8.074 -6.628
372 HG13 VAL 49 HG13 VAL 49 -6.174 8.094 -8.068
373 HG21 VAL 49 HG21 VAL 49 -6.558 4.551 -5.782
374 HG22 VAL 49 HG22 VAL 49 -7.364 6.030 -5.253
375 HG23 VAL 49 HG23 VAL 49 -5.604 5.914 -5.175
376 H ASN 50 HN ASN 50 -9.614 4.327 -7.622
377 HA ASN 50 HA ASN 50 -8.167 1.823 -7.553
378 HB2 ASN 50 HB2 ASN 50 -10.547 2.801 -6.373
379 HB3 ASN 50 HB1 ASN 50 -11.044 1.515 -7.463
380 HD21 ASN 50 HD21 ASN 50 -8.057 1.787 -5.613
381 HD22 ASN 50 HD22 ASN 50 -8.359 0.367 -4.679
382 H GLY 51 HN GLY 51 -9.674 -0.013 -8.692
383 HA2 GLY 51 HA2 GLY 51 -9.953 0.721 -11.479
384 HA3 GLY 51 HA1 GLY 51 -10.089 -0.906 -10.793
385 H GLY 52 HN GLY 52 -11.695 2.166 -11.110
386 HA2 GLY 52 HA2 GLY 52 -14.008 2.367 -11.627
387 HA3 GLY 52 HA1 GLY 52 -14.283 0.803 -10.858
388 H ASN 53 HN ASN 53 -14.607 0.681 -8.709
389 HA ASN 53 HA ASN 53 -14.520 3.152 -7.091
390 HB2 ASN 53 HB2 ASN 53 -16.622 0.945 -6.929
391 HB3 ASN 53 HB1 ASN 53 -16.548 2.367 -5.920
392 HD21 ASN 53 HD21 ASN 53 -16.188 4.349 -8.108
393 HD22 ASN 53 HD22 ASN 53 -17.674 4.318 -8.954
394 H ARG 54 HN ARG 54 -14.955 2.170 -4.692
395 HA ARG 54 HA ARG 54 -12.562 0.970 -3.905
396 HB2 ARG 54 HB2 ARG 54 -15.191 1.067 -2.519
397 HB3 ARG 54 HB1 ARG 54 -13.858 0.156 -1.836
398 HG2 ARG 54 HG2 ARG 54 -13.792 2.142 -0.771
399 HG3 ARG 54 HG1 ARG 54 -12.559 2.247 -2.036
400 HD2 ARG 54 HD2 ARG 54 -13.822 4.349 -1.914
401 HD3 ARG 54 HD1 ARG 54 -14.116 3.497 -3.438
402 HE ARG 54 HE ARG 54 -16.170 2.635 -2.110
403 HH11 ARG 54 HH11 ARG 54 -14.888 5.929 -1.865
404 HH12 ARG 54 HH12 ARG 54 -16.423 6.652 -1.666
405 HH21 ARG 54 HH21 ARG 54 -18.260 3.614 -1.830
406 HH22 ARG 54 HH22 ARG 54 -18.370 5.298 -1.638
407 H THR 55 HN THR 55 -11.816 -0.912 -4.449
408 HA THR 55 HA THR 55 -13.233 -3.039 -3.416
409 HB THR 55 HB THR 55 -14.416 -3.077 -5.510
410 HG1 THR 55 HG1 THR 55 -13.742 -5.157 -4.702
411 HG21 THR 55 HG21 THR 55 -13.297 -3.335 -7.694
412 HG22 THR 55 HG22 THR 55 -11.729 -3.188 -6.897
413 HG23 THR 55 HG23 THR 55 -12.850 -1.827 -6.898
414 H VAL 56 HN VAL 56 -10.399 -1.836 -5.104
415 HA VAL 56 HA VAL 56 -8.919 -4.148 -4.130
416 HB VAL 56 HB VAL 56 -7.164 -3.483 -5.835
417 HG11 VAL 56 HG11 VAL 56 -9.861 -4.462 -6.819
418 HG12 VAL 56 HG12 VAL 56 -8.593 -5.464 -6.114
419 HG13 VAL 56 HG13 VAL 56 -8.339 -4.688 -7.677
420 HG21 VAL 56 HG21 VAL 56 -7.981 -1.282 -6.402
421 HG22 VAL 56 HG22 VAL 56 -9.486 -1.979 -7.011
422 HG23 VAL 56 HG23 VAL 56 -7.961 -2.314 -7.834
423 HA PRO 57 HA PRO 57 -6.543 -1.614 -1.471
424 HB2 PRO 57 HB2 PRO 57 -4.123 -2.903 -1.539
425 HB3 PRO 57 HB1 PRO 57 -5.523 -3.547 -0.687
426 HG2 PRO 57 HG2 PRO 57 -4.525 -4.223 -3.422
427 HG3 PRO 57 HG1 PRO 57 -5.050 -5.311 -2.118
428 HD2 PRO 57 HD2 PRO 57 -6.651 -4.687 -4.168
429 HD3 PRO 57 HD1 PRO 57 -7.293 -4.899 -2.526
430 H THR 58 HN THR 58 -5.367 0.197 -1.655
431 HA THR 58 HA THR 58 -3.714 0.519 -4.033
432 HB THR 58 HB THR 58 -5.378 2.710 -2.728
433 HG1 THR 58 HG1 THR 58 -6.158 0.688 -4.109
434 HG21 THR 58 HG21 THR 58 -4.915 3.979 -4.681
435 HG22 THR 58 HG22 THR 58 -4.186 2.616 -5.490
436 HG23 THR 58 HG23 THR 58 -3.342 3.388 -4.118
437 H VAL 59 HN VAL 59 -1.694 1.572 -3.512
438 HA VAL 59 HA VAL 59 -1.287 2.052 -0.643
439 HB VAL 59 HB VAL 59 1.139 1.733 -1.062
440 HG11 VAL 59 HG11 VAL 59 -0.604 -0.533 -1.991
441 HG12 VAL 59 HG12 VAL 59 -0.138 -0.164 -0.318
442 HG13 VAL 59 HG13 VAL 59 1.080 -0.686 -1.480
443 HG21 VAL 59 HG21 VAL 59 0.267 0.954 -3.827
444 HG22 VAL 59 HG22 VAL 59 1.904 0.792 -3.175
445 HG23 VAL 59 HG23 VAL 59 1.195 2.393 -3.401
446 H LYS 60 HN LYS 60 -0.627 3.981 0.059
447 HA LYS 60 HA LYS 60 0.103 6.010 -1.955
448 HB2 LYS 60 HB2 LYS 60 -2.049 6.389 -0.576
449 HB3 LYS 60 HB1 LYS 60 -0.982 6.537 0.802
450 HG2 LYS 60 HG2 LYS 60 0.184 8.415 -0.285
451 HG3 LYS 60 HG1 LYS 60 -0.942 8.315 -1.635
452 HD2 LYS 60 HD2 LYS 60 -1.738 10.044 -0.226
453 HD3 LYS 60 HD1 LYS 60 -2.801 8.666 0.048
454 HE2 LYS 60 HE2 LYS 60 -1.382 8.097 2.056
455 HE3 LYS 60 HE1 LYS 60 -0.535 9.622 1.773
456 HZ1 LYS 60 HZ1 LYS 60 -2.259 9.928 3.427
457 HZ2 LYS 60 HZ2 LYS 60 -3.405 9.273 2.412
458 HZ3 LYS 60 HZ3 LYS 60 -2.723 10.757 2.028
459 H PHE 61 HN PHE 61 2.190 6.370 -1.836
460 HA PHE 61 HA PHE 61 3.725 5.569 0.513
461 HB2 PHE 61 HB2 PHE 61 4.614 6.803 -2.083
462 HB3 PHE 61 HB1 PHE 61 5.676 6.188 -0.821
463 HD1 PHE 61 HD1 PHE 61 3.253 5.303 -3.409
464 HD2 PHE 61 HD2 PHE 61 6.149 3.813 -0.654
465 HE1 PHE 61 HE1 PHE 61 3.208 3.152 -4.530
466 HE2 PHE 61 HE2 PHE 61 6.101 1.651 -1.782
467 HZ PHE 61 HZ PHE 61 4.636 1.310 -3.729
468 H ALA 62 HN ALA 62 5.360 7.030 1.421
469 HA ALA 62 HA ALA 62 4.408 9.592 2.150
470 HB1 ALA 62 HB1 ALA 62 6.046 8.335 3.488
471 HB2 ALA 62 HB2 ALA 62 6.658 9.937 3.084
472 HB3 ALA 62 HB3 ALA 62 7.241 8.524 2.205
473 H ASP 63 HN ASP 63 5.789 8.449 -0.582
474 HA ASP 63 HA ASP 63 7.048 10.725 -1.758
475 HB2 ASP 63 HB2 ASP 63 7.573 8.479 -2.496
476 HB3 ASP 63 HB1 ASP 63 5.891 8.165 -2.874
477 H GLY 64 HN GLY 64 3.785 9.729 -1.221
478 HA2 GLY 64 HA2 GLY 64 1.933 11.093 -1.416
479 HA3 GLY 64 HA1 GLY 64 2.775 12.074 -2.614
480 H SER 65 HN SER 65 3.532 9.465 -3.924
481 HA SER 65 HA SER 65 1.350 9.444 -5.766
482 HB2 SER 65 HB2 SER 65 3.807 7.717 -5.680
483 HB3 SER 65 HB1 SER 65 2.738 7.979 -7.059
484 HG SER 65 HG SER 65 4.779 9.498 -6.085
485 H THR 66 HN THR 66 0.046 7.741 -6.275
486 HA THR 66 HA THR 66 -0.114 5.523 -4.395
487 HB THR 66 HB THR 66 -2.447 5.372 -5.541
488 HG1 THR 66 HG1 THR 66 -2.687 6.920 -6.941
489 HG21 THR 66 HG21 THR 66 -3.398 6.852 -3.836
490 HG22 THR 66 HG22 THR 66 -1.772 7.471 -3.492
491 HG23 THR 66 HG23 THR 66 -2.167 5.764 -3.208
492 H LEU 67 HN LEU 67 -0.444 3.513 -5.227
493 HA LEU 67 HA LEU 67 -0.507 3.183 -8.121
494 HB2 LEU 67 HB2 LEU 67 1.218 1.526 -6.236
495 HB3 LEU 67 HB1 LEU 67 0.935 1.156 -7.915
496 HG LEU 67 HG LEU 67 2.456 3.556 -6.873
497 HD11 LEU 67 HD11 LEU 67 3.442 1.095 -8.311
498 HD12 LEU 67 HD12 LEU 67 3.603 1.357 -6.588
499 HD13 LEU 67 HD13 LEU 67 4.428 2.432 -7.722
500 HD21 LEU 67 HD21 LEU 67 2.007 2.582 -9.700
501 HD22 LEU 67 HD22 LEU 67 3.075 3.900 -9.221
502 HD23 LEU 67 HD23 LEU 67 1.336 4.053 -8.993
503 H THR 68 HN THR 68 -2.229 2.038 -8.630
504 HA THR 68 HA THR 68 -3.966 0.825 -6.780
505 HB THR 68 HB THR 68 -3.720 0.241 -9.756
506 HG1 THR 68 HG1 THR 68 -5.338 2.316 -8.658
507 HG21 THR 68 HG21 THR 68 -6.162 -0.050 -9.613
508 HG22 THR 68 HG22 THR 68 -6.114 0.339 -7.895
509 HG23 THR 68 HG23 THR 68 -5.350 -1.137 -8.484
510 H ASN 69 HN ASN 69 -4.254 -1.444 -6.371
511 HA ASN 69 HA ASN 69 -2.703 -2.960 -5.217
512 HB2 ASN 69 HB2 ASN 69 -4.820 -3.813 -5.891
513 HB3 ASN 69 HB1 ASN 69 -4.221 -4.202 -7.507
514 HD21 ASN 69 HD21 ASN 69 -4.766 -6.392 -7.249
515 HD22 ASN 69 HD22 ASN 69 -3.837 -7.422 -6.212
516 HA PRO 70 HA PRO 70 1.010 -3.659 -7.695
517 HB2 PRO 70 HB2 PRO 70 2.652 -2.399 -5.982
518 HB3 PRO 70 HB1 PRO 70 1.727 -1.543 -7.216
519 HG2 PRO 70 HG2 PRO 70 1.393 -1.466 -4.323
520 HG3 PRO 70 HG1 PRO 70 0.635 -0.447 -5.557
521 HD2 PRO 70 HD2 PRO 70 -0.416 -2.807 -4.165
522 HD3 PRO 70 HD1 PRO 70 -1.269 -1.555 -5.094
523 H SER 71 HN SER 71 2.581 -5.109 -7.419
524 HA SER 71 HA SER 71 2.289 -7.001 -5.292
525 HB2 SER 71 HB2 SER 71 4.497 -6.847 -7.351
526 HB3 SER 71 HB1 SER 71 3.880 -8.275 -6.523
527 HG SER 71 HG SER 71 2.645 -6.694 -8.492
528 H ALA 72 HN ALA 72 4.378 -7.700 -4.143
529 HA ALA 72 HA ALA 72 5.242 -5.591 -2.505
530 HB1 ALA 72 HB1 ALA 72 5.093 -7.895 -1.752
531 HB2 ALA 72 HB2 ALA 72 6.693 -7.217 -1.463
532 HB3 ALA 72 HB3 ALA 72 6.439 -8.338 -2.805
533 H ASP 73 HN ASP 73 6.809 -7.063 -5.288
534 HA ASP 73 HA ASP 73 9.296 -5.708 -4.914
535 HB2 ASP 73 HB2 ASP 73 9.032 -7.700 -6.395
536 HB3 ASP 73 HB1 ASP 73 8.103 -6.708 -7.507
537 H GLU 74 HN GLU 74 6.301 -4.898 -6.436
538 HA GLU 74 HA GLU 74 7.257 -2.674 -7.936
539 HB2 GLU 74 HB2 GLU 74 4.418 -3.317 -7.125
540 HB3 GLU 74 HB1 GLU 74 4.918 -2.236 -8.422
541 HG2 GLU 74 HG2 GLU 74 5.973 -4.154 -9.551
542 HG3 GLU 74 HG1 GLU 74 5.342 -5.208 -8.301
543 H VAL 75 HN VAL 75 5.810 -3.091 -4.769
544 HA VAL 75 HA VAL 75 5.738 -0.264 -4.362
545 HB VAL 75 HB VAL 75 5.217 -0.834 -1.907
546 HG11 VAL 75 HG11 VAL 75 3.494 -0.334 -3.598
547 HG12 VAL 75 HG12 VAL 75 2.953 -1.534 -2.418
548 HG13 VAL 75 HG13 VAL 75 3.466 -2.044 -4.024
549 HG21 VAL 75 HG21 VAL 75 4.538 -3.096 -1.425
550 HG22 VAL 75 HG22 VAL 75 6.226 -3.117 -1.978
551 HG23 VAL 75 HG23 VAL 75 4.908 -3.559 -3.076
552 H LYS 76 HN LYS 76 7.985 -2.821 -3.554
553 HA LYS 76 HA LYS 76 9.620 -1.305 -1.838
554 HB2 LYS 76 HB2 LYS 76 10.296 -3.670 -3.590
555 HB3 LYS 76 HB1 LYS 76 11.422 -2.972 -2.426
556 HG2 LYS 76 HG2 LYS 76 9.966 -3.554 -0.608
557 HG3 LYS 76 HG1 LYS 76 8.710 -4.068 -1.730
558 HD2 LYS 76 HD2 LYS 76 9.710 -6.068 -0.986
559 HD3 LYS 76 HD1 LYS 76 10.394 -5.790 -2.579
560 HE2 LYS 76 HE2 LYS 76 12.141 -6.491 -1.124
561 HE3 LYS 76 HE1 LYS 76 12.381 -4.777 -1.453
562 HZ1 LYS 76 HZ1 LYS 76 11.440 -4.279 0.750
563 HZ2 LYS 76 HZ2 LYS 76 12.758 -5.280 0.804
564 HZ3 LYS 76 HZ3 LYS 76 11.241 -5.944 1.060
565 H ALA 77 HN ALA 77 9.462 -1.569 -5.314
566 HA ALA 77 HA ALA 77 11.811 -0.370 -6.113
567 HB1 ALA 77 HB1 ALA 77 10.657 0.225 -8.167
568 HB2 ALA 77 HB2 ALA 77 9.100 -0.025 -7.381
569 HB3 ALA 77 HB3 ALA 77 10.182 -1.394 -7.642
570 H LYS 78 HN LYS 78 8.822 1.201 -5.093
571 HA LYS 78 HA LYS 78 10.024 3.806 -5.411
572 HB2 LYS 78 HB2 LYS 78 7.333 2.879 -4.627
573 HB3 LYS 78 HB1 LYS 78 7.869 4.392 -3.923
574 HG2 LYS 78 HG2 LYS 78 8.341 5.206 -6.236
575 HG3 LYS 78 HG1 LYS 78 7.574 3.733 -6.838
576 HD2 LYS 78 HD2 LYS 78 5.502 4.302 -5.799
577 HD3 LYS 78 HD1 LYS 78 6.239 5.665 -4.954
578 HE2 LYS 78 HE2 LYS 78 6.031 5.406 -7.933
579 HE3 LYS 78 HE1 LYS 78 4.868 6.278 -6.920
580 HZ1 LYS 78 HZ1 LYS 78 6.491 7.738 -7.969
581 HZ2 LYS 78 HZ2 LYS 78 7.768 6.976 -7.206
582 HZ3 LYS 78 HZ3 LYS 78 6.613 7.839 -6.300
583 H LEU 79 HN LEU 79 8.975 1.760 -2.770
584 HA LEU 79 HA LEU 79 9.402 3.424 -0.632
585 HB2 LEU 79 HB2 LEU 79 8.198 1.355 -0.465
586 HB3 LEU 79 HB1 LEU 79 9.645 0.445 -0.837
587 HG LEU 79 HG LEU 79 10.632 1.105 1.251
588 HD11 LEU 79 HD11 LEU 79 9.266 2.217 2.987
589 HD12 LEU 79 HD12 LEU 79 7.997 2.489 1.787
590 HD13 LEU 79 HD13 LEU 79 9.571 3.263 1.604
591 HD21 LEU 79 HD21 LEU 79 9.182 -0.188 2.735
592 HD22 LEU 79 HD22 LEU 79 9.391 -0.942 1.152
593 HD23 LEU 79 HD23 LEU 79 7.895 -0.080 1.532
594 H VAL 80 HN VAL 80 11.773 1.414 -2.292
595 HA VAL 80 HA VAL 80 13.805 1.654 -0.395
596 HB VAL 80 HB VAL 80 13.870 -0.026 -2.213
597 HG11 VAL 80 HG11 VAL 80 14.586 0.553 -4.471
598 HG12 VAL 80 HG12 VAL 80 14.516 2.265 -4.052
599 HG13 VAL 80 HG13 VAL 80 13.039 1.301 -4.066
600 HG21 VAL 80 HG21 VAL 80 15.887 0.555 -1.040
601 HG22 VAL 80 HG22 VAL 80 16.236 1.814 -2.229
602 HG23 VAL 80 HG23 VAL 80 16.241 0.115 -2.719
603 H LYS 81 HN LYS 81 12.873 3.792 -3.014
604 HA LYS 81 HA LYS 81 15.221 5.457 -2.762
605 HB2 LYS 81 HB2 LYS 81 12.642 6.002 -4.222
606 HB3 LYS 81 HB1 LYS 81 14.145 6.883 -4.408
607 HG2 LYS 81 HG2 LYS 81 15.190 4.858 -5.336
608 HG3 LYS 81 HG1 LYS 81 13.642 4.016 -5.183
609 HD2 LYS 81 HD2 LYS 81 12.614 5.773 -6.629
610 HD3 LYS 81 HD1 LYS 81 14.219 6.451 -6.850
611 HE2 LYS 81 HE2 LYS 81 14.981 4.386 -7.866
612 HE3 LYS 81 HE1 LYS 81 13.396 3.658 -7.617
613 HZ1 LYS 81 HZ1 LYS 81 12.438 5.319 -9.072
614 HZ2 LYS 81 HZ2 LYS 81 13.655 4.491 -9.893
615 HZ3 LYS 81 HZ3 LYS 81 13.929 6.045 -9.313
616 H ILE 82 HN ILE 82 12.096 5.247 -1.443
617 HA ILE 82 HA ILE 82 11.870 8.010 -0.680
618 HB ILE 82 HB ILE 82 10.208 5.622 0.181
619 HG12 ILE 82 HG12 ILE 82 9.641 7.680 -1.973
620 HG13 ILE 82 HG11 ILE 82 10.247 6.055 -2.275
621 HG21 ILE 82 HG21 ILE 82 8.504 7.295 0.786
622 HG22 ILE 82 HG22 ILE 82 9.623 8.589 0.363
623 HG23 ILE 82 HG23 ILE 82 9.984 7.522 1.721
624 HD11 ILE 82 HD11 ILE 82 8.200 5.119 -1.354
625 HD12 ILE 82 HD12 ILE 82 7.866 6.225 -2.687
626 HD13 ILE 82 HD13 ILE 82 7.618 6.751 -1.020
627 H ALA 83 HN ALA 83 12.440 4.944 1.040
628 HA ALA 83 HA ALA 83 12.890 6.436 3.503
629 HB1 ALA 83 HB1 ALA 83 12.866 4.302 4.619
630 HB2 ALA 83 HB2 ALA 83 12.876 3.472 3.071
631 HB3 ALA 83 HB3 ALA 83 11.466 4.439 3.546
632 H GLY 84 HN GLY 84 14.728 4.572 1.142
633 HA2 GLY 84 HA2 GLY 84 17.019 4.483 0.914
634 HA3 GLY 84 HA1 GLY 84 17.184 5.411 2.404
635 H LEU 85 HN LEU 85 16.818 2.242 1.055
636 HA LEU 85 HA LEU 85 17.470 1.102 3.685
637 HB2 LEU 85 HB2 LEU 85 15.509 -0.136 1.723
638 HB3 LEU 85 HB1 LEU 85 16.005 -0.792 3.260
639 HG LEU 85 HG LEU 85 14.532 1.816 3.025
640 HD11 LEU 85 HD11 LEU 85 13.426 -0.951 3.456
641 HD12 LEU 85 HD12 LEU 85 13.248 0.024 2.000
642 HD13 LEU 85 HD13 LEU 85 12.505 0.560 3.513
643 HD21 LEU 85 HD21 LEU 85 13.985 1.356 5.366
644 HD22 LEU 85 HD22 LEU 85 15.730 1.421 5.125
645 HD23 LEU 85 HD23 LEU 85 14.922 -0.137 5.297
646 H GLU 86 HN GLU 86 16.808 -0.438 0.621
647 HA GLU 86 HA GLU 86 17.846 -2.084 -0.489
648 HB2 GLU 86 HB2 GLU 86 18.557 0.031 -1.607
649 HB3 GLU 86 HB1 GLU 86 20.054 -0.035 -0.690
650 HG2 GLU 86 HG2 GLU 86 20.380 -0.888 -2.941
651 HG3 GLU 86 HG1 GLU 86 20.602 -2.176 -1.757
652 H HIS 87 HN HIS 87 17.958 -3.632 0.775
653 HA HIS 87 HA HIS 87 20.383 -4.902 1.147
654 HB2 HIS 87 HB2 HIS 87 20.521 -5.094 3.626
655 HB3 HIS 87 HB1 HIS 87 20.679 -3.417 3.153
656 HD1 HIS 87 HD1 HIS 87 18.699 -5.680 5.280
657 HD2 HIS 87 HD2 HIS 87 18.343 -1.828 3.762
658 HE1 HIS 87 HE1 HIS 87 16.907 -4.554 6.646
659 H HIS 88 HN HIS 88 17.095 -4.511 2.353
660 HA HIS 88 HA HIS 88 16.288 -6.884 1.101
661 HB2 HIS 88 HB2 HIS 88 17.075 -7.745 3.328
662 HB3 HIS 88 HB1 HIS 88 15.950 -6.640 4.114
663 HD1 HIS 88 HD1 HIS 88 16.132 -9.965 2.450
664 HD2 HIS 88 HD2 HIS 88 13.207 -7.300 3.718
665 HE1 HIS 88 HE1 HIS 88 13.967 -11.247 2.435
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