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 |
|
|
22596 |
2jpj   |
15259 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 GLY 1 H GLY 1 -22.080 -4.440 8.983
2 HA2 GLY 1 2HA GLY 1 -20.872 -3.837 11.602
3 HA3 GLY 1 3HA GLY 1 -19.917 -4.633 10.361
4 H THR 2 H THR 2 -19.768 -1.941 11.748
5 HA THR 2 HA THR 2 -20.347 0.114 9.938
6 HB THR 2 HB THR 2 -18.438 1.337 11.161
7 HG1 THR 2 1HG THR 2 -17.524 -0.790 11.854
8 HG21 THR 2 3HG2 THR 2 -20.626 1.842 11.834
9 HG22 THR 2 1HG2 THR 2 -19.820 1.357 13.324
10 HG23 THR 2 2HG2 THR 2 -20.892 0.229 12.495
11 H TRP 3 H TRP 3 -17.941 -2.308 9.846
12 HA TRP 3 HA TRP 3 -15.807 -1.126 8.564
13 HD1 TRP 3 HD TRP 3 -17.590 -4.723 10.299
14 HE1 TRP 3 1HE TRP 3 -16.244 -5.186 12.443
15 HE3 TRP 3 3HE TRP 3 -13.219 -2.397 9.031
16 HZ2 TRP 3 2HZ TRP 3 -13.669 -4.636 13.462
17 HZ3 TRP 3 3HZ TRP 3 -11.363 -2.410 10.646
18 HH2 TRP 3 HH TRP 3 -11.587 -3.507 12.815
19 HB2 TRP 3 1HB TRP 3 -16.951 -3.853 7.894
20 HB3 TRP 3 2HB TRP 3 -15.286 -3.315 7.656
21 H ASP 4 H ASP 4 -18.969 -1.869 7.311
22 HA ASP 4 HA ASP 4 -18.408 -1.773 4.561
23 HD2 ASP 4 HD ASP 4 -20.256 -3.875 3.011
24 HB2 ASP 4 1HB ASP 4 -20.787 -1.670 6.275
25 HB3 ASP 4 2HB ASP 4 -20.962 -0.756 4.772
26 H ASP 5 H ASP 5 -19.486 0.785 6.787
27 HA ASP 5 HA ASP 5 -19.281 2.820 4.769
28 HD2 ASP 5 HD ASP 5 -19.386 6.422 7.450
29 HB2 ASP 5 1HB ASP 5 -20.949 3.007 6.550
30 HB3 ASP 5 2HB ASP 5 -19.663 3.037 7.762
31 H ILE 6 H ILE 6 -17.414 1.888 7.638
32 HA ILE 6 HA ILE 6 -15.503 3.934 7.510
33 HB ILE 6 HB ILE 6 -15.092 1.127 8.543
34 HG12 ILE 6 1HG1 ILE 6 -15.945 3.594 10.073
35 HG13 ILE 6 2HG1 ILE 6 -17.074 2.356 9.498
36 HG21 ILE 6 1HG2 ILE 6 -13.005 1.801 8.909
37 HG22 ILE 6 2HG2 ILE 6 -13.386 3.443 8.395
38 HG23 ILE 6 3HG2 ILE 6 -13.650 2.960 10.069
39 HD11 ILE 6 3HD1 ILE 6 -14.769 1.569 11.220
40 HD12 ILE 6 1HD1 ILE 6 -16.226 2.257 11.936
41 HD13 ILE 6 2HD1 ILE 6 -16.326 0.771 10.992
42 H GLY 7 H GLY 7 -15.828 0.961 5.729
43 HA2 GLY 7 2HA GLY 7 -13.124 0.957 4.739
44 HA3 GLY 7 3HA GLY 7 -14.438 -0.078 4.195
45 H GLN 8 H GLN 8 -16.175 2.283 3.701
46 HA GLN 8 HA GLN 8 -15.421 2.708 0.984
47 HB2 GLN 8 1HB GLN 8 -17.758 3.011 2.568
48 HB3 GLN 8 2HB GLN 8 -17.415 4.582 1.822
49 HG2 GLN 8 1HG GLN 8 -17.712 3.806 -0.320
50 HG3 GLN 8 2HG GLN 8 -17.345 2.134 0.130
51 HE21 GLN 8 1HE2 GLN 8 -19.042 0.878 -0.087
52 HE22 GLN 8 2HE2 GLN 8 -20.677 1.294 0.284
53 H GLY 9 H GLY 9 -15.080 4.511 3.955
54 HA2 GLY 9 2HA GLY 9 -14.334 6.967 2.617
55 HA3 GLY 9 3HA GLY 9 -14.303 6.667 4.349
56 H ILE 10 H ILE 10 -12.609 4.717 4.783
57 HA ILE 10 HA ILE 10 -10.089 5.825 4.574
58 HB ILE 10 HB ILE 10 -10.704 3.993 6.133
59 HG12 ILE 10 1HG1 ILE 10 -8.318 3.215 4.447
60 HG13 ILE 10 2HG1 ILE 10 -8.318 4.633 5.510
61 HG21 ILE 10 1HG2 ILE 10 -10.799 1.724 5.435
62 HG22 ILE 10 2HG2 ILE 10 -11.869 2.634 4.368
63 HG23 ILE 10 3HG2 ILE 10 -10.276 2.135 3.803
64 HD11 ILE 10 3HD1 ILE 10 -7.946 1.844 6.162
65 HD12 ILE 10 1HD1 ILE 10 -7.581 3.286 7.107
66 HD13 ILE 10 2HD1 ILE 10 -9.203 2.592 7.147
67 H GLY 11 H GLY 11 -11.815 3.833 2.291
68 HA2 GLY 11 2HA GLY 11 -9.638 2.997 0.705
69 HA3 GLY 11 3HA GLY 11 -11.306 3.132 0.165
70 H ARG 12 H ARG 12 -11.859 5.753 0.265
71 HA ARG 12 HA ARG 12 -10.344 6.771 -1.952
72 HE ARG 12 HE ARG 12 -12.298 5.611 -4.255
73 HB2 ARG 12 1HB ARG 12 -12.650 7.872 -0.340
74 HB3 ARG 12 2HB ARG 12 -11.895 8.763 -1.671
75 HG2 ARG 12 1HG ARG 12 -12.770 5.992 -2.252
76 HG3 ARG 12 2HG ARG 12 -14.034 7.209 -1.996
77 HD2 ARG 12 1HD ARG 12 -13.702 8.077 -4.021
78 HD3 ARG 12 2HD ARG 12 -11.976 8.280 -3.684
79 HH11 ARG 12 1HH1 ARG 12 -12.902 8.625 -5.889
80 HH12 ARG 12 2HH1 ARG 12 -12.649 7.969 -7.472
81 HH21 ARG 12 1HH2 ARG 12 -11.963 4.734 -6.335
82 HH22 ARG 12 2HH2 ARG 12 -12.117 5.753 -7.724
83 H VAL 13 H VAL 13 -10.529 7.380 1.490
84 HA VAL 13 HA VAL 13 -9.093 9.832 1.486
85 HB VAL 13 HB VAL 13 -9.424 7.812 3.711
86 HG11 VAL 13 1HG1 VAL 13 -8.863 9.663 5.208
87 HG12 VAL 13 2HG1 VAL 13 -7.534 9.308 4.102
88 HG13 VAL 13 3HG1 VAL 13 -8.572 10.705 3.815
89 HG21 VAL 13 3HG2 VAL 13 -11.330 9.437 2.469
90 HG22 VAL 13 1HG2 VAL 13 -11.491 8.579 4.002
91 HG23 VAL 13 2HG2 VAL 13 -10.933 10.252 3.980
92 H ALA 14 H ALA 14 -8.146 6.448 1.854
93 HA ALA 14 HA ALA 14 -5.508 6.748 2.632
94 HB1 ALA 14 1HB ALA 14 -6.593 4.583 2.551
95 HB2 ALA 14 2HB ALA 14 -6.677 4.665 0.791
96 HB3 ALA 14 3HB ALA 14 -5.112 4.551 1.595
97 H TYR 15 H TYR 15 -6.961 7.180 -0.523
98 HA TYR 15 HA TYR 15 -4.502 7.255 -1.972
99 HD1 TYR 15 1HD TYR 15 -4.609 6.602 -4.681
100 HD2 TYR 15 2HD TYR 15 -6.880 10.149 -4.065
101 HE1 TYR 15 1HE TYR 15 -3.723 7.527 -6.779
102 HE2 TYR 15 2HE TYR 15 -5.999 11.081 -6.163
103 HH TYR 15 HH TYR 15 -3.442 10.257 -7.613
104 HB2 TYR 15 1HB TYR 15 -6.589 6.686 -3.092
105 HB3 TYR 15 2HB TYR 15 -7.260 8.270 -2.694
106 H TRP 16 H TRP 16 -6.435 9.589 -0.254
107 HA TRP 16 HA TRP 16 -5.125 11.887 -1.377
108 HD1 TRP 16 HD TRP 16 -9.005 11.035 -1.046
109 HE1 TRP 16 1HE TRP 16 -10.096 12.563 -2.805
110 HE3 TRP 16 3HE TRP 16 -5.718 14.945 -0.871
111 HZ2 TRP 16 2HZ TRP 16 -9.624 15.094 -3.966
112 HZ3 TRP 16 3HZ TRP 16 -6.110 16.882 -2.338
113 HH2 TRP 16 HH TRP 16 -8.023 16.952 -3.853
114 HB2 TRP 16 1HB TRP 16 -7.137 11.409 0.789
115 HB3 TRP 16 2HB TRP 16 -6.280 12.949 0.752
116 H VAL 17 H VAL 17 -4.934 10.086 1.670
117 HA VAL 17 HA VAL 17 -2.988 11.762 2.872
118 HB VAL 17 HB VAL 17 -4.399 10.241 4.187
119 HG11 VAL 17 1HG1 VAL 17 -2.704 8.003 3.090
120 HG12 VAL 17 2HG1 VAL 17 -4.069 7.873 4.203
121 HG13 VAL 17 3HG1 VAL 17 -4.335 8.371 2.532
122 HG21 VAL 17 3HG2 VAL 17 -1.494 9.512 4.507
123 HG22 VAL 17 1HG2 VAL 17 -2.179 11.057 5.009
124 HG23 VAL 17 2HG2 VAL 17 -2.735 9.562 5.758
125 H GLY 18 H GLY 18 -2.806 8.958 0.770
126 HA2 GLY 18 2HA GLY 18 -0.184 8.165 1.104
127 HA3 GLY 18 3HA GLY 18 -1.045 8.092 -0.425
128 H LYS 19 H LYS 19 -1.352 10.616 -1.206
129 HA LYS 19 HA LYS 19 1.295 11.366 -1.981
130 HB2 LYS 19 1HB LYS 19 0.285 12.964 -3.395
131 HB3 LYS 19 2HB LYS 19 -0.822 11.580 -3.380
132 HG2 LYS 19 1HG LYS 19 -2.360 13.207 -3.079
133 HG3 LYS 19 2HG LYS 19 -1.897 12.982 -1.383
134 HD2 LYS 19 1HD LYS 19 -1.253 15.108 -1.264
135 HD3 LYS 19 2HD LYS 19 -0.056 14.805 -2.536
136 HE2 LYS 19 1HE LYS 19 -1.434 16.605 -3.285
137 HE3 LYS 19 2HE LYS 19 -1.877 15.168 -4.220
138 HZ1 LYS 19 3HZ LYS 19 -3.390 15.652 -1.776
139 HZ2 LYS 19 1HZ LYS 19 -3.910 15.057 -3.272
140 HZ3 LYS 19 2HZ LYS 19 -3.666 16.718 -3.060
141 H ALA 20 H ALA 20 -1.010 12.472 0.397
142 HA ALA 20 HA ALA 20 0.074 15.000 0.949
143 HB1 ALA 20 1HB ALA 20 -2.052 13.545 1.878
144 HB2 ALA 20 2HB ALA 20 -0.989 13.611 3.284
145 HB3 ALA 20 3HB ALA 20 -1.522 15.102 2.510
146 H LEU 21 H LEU 21 1.023 11.789 1.961
147 HA LEU 21 HA LEU 21 2.970 12.844 3.856
148 HG LEU 21 HG LEU 21 1.595 9.847 5.540
149 HB2 LEU 21 1HB LEU 21 1.881 10.143 3.196
150 HB3 LEU 21 2HB LEU 21 3.476 10.260 3.955
151 HD11 LEU 21 1HD1 LEU 21 2.473 12.399 6.540
152 HD12 LEU 21 2HD1 LEU 21 3.805 11.529 5.779
153 HD13 LEU 21 3HD1 LEU 21 2.890 10.774 7.084
154 HD21 LEU 21 3HD2 LEU 21 0.826 12.663 4.779
155 HD22 LEU 21 1HD2 LEU 21 0.147 11.741 6.121
156 HD23 LEU 21 2HD2 LEU 21 -0.110 11.201 4.462
157 H GLY 22 H GLY 22 2.809 11.359 0.687
158 HA2 GLY 22 2HA GLY 22 4.826 12.275 -0.649
159 HA3 GLY 22 3HA GLY 22 5.747 11.351 0.529
160 H ASN 23 H ASN 23 3.655 9.239 0.600
161 HA ASN 23 HA ASN 23 3.270 7.221 -0.374
162 HB2 ASN 23 1HB ASN 23 2.234 8.941 -2.067
163 HB3 ASN 23 2HB ASN 23 3.581 8.437 -3.094
164 HD21 ASN 23 1HD2 ASN 23 1.173 6.909 -0.977
165 HD22 ASN 23 2HD2 ASN 23 0.767 5.639 -2.077
166 H LEU 24 H LEU 24 5.256 6.354 0.346
167 HA LEU 24 HA LEU 24 6.888 5.288 -1.705
168 HG LEU 24 HG LEU 24 8.005 7.145 1.228
169 HB2 LEU 24 1HB LEU 24 9.006 6.333 -1.179
170 HB3 LEU 24 2HB LEU 24 7.819 7.554 -1.675
171 HD11 LEU 24 1HD1 LEU 24 10.401 6.949 0.155
172 HD12 LEU 24 2HD1 LEU 24 10.124 7.905 1.611
173 HD13 LEU 24 3HD1 LEU 24 10.243 8.703 0.043
174 HD21 LEU 24 3HD2 LEU 24 7.026 9.050 -0.518
175 HD22 LEU 24 1HD2 LEU 24 8.483 9.794 0.141
176 HD23 LEU 24 2HD2 LEU 24 7.212 9.229 1.227
177 H SER 25 H SER 25 5.390 4.253 0.426
178 HA SER 25 HA SER 25 7.329 3.421 2.443
179 HG SER 25 HG SER 25 4.235 1.628 1.987
180 HB2 SER 25 1HB SER 25 5.460 2.500 3.657
181 HB3 SER 25 2HB SER 25 5.008 4.120 3.094
182 H ASP 26 H ASP 26 5.166 1.975 0.025
183 HA ASP 26 HA ASP 26 5.906 -0.697 0.440
184 HD2 ASP 26 HD ASP 26 5.293 -3.337 -1.531
185 HB2 ASP 26 1HB ASP 26 3.940 0.227 -0.917
186 HB3 ASP 26 2HB ASP 26 5.100 0.434 -2.236
187 H VAL 27 H VAL 27 7.377 1.862 -1.445
188 HA VAL 27 HA VAL 27 9.129 0.263 -2.979
189 HB VAL 27 HB VAL 27 10.487 2.375 -3.191
190 HG11 VAL 27 1HG1 VAL 27 8.656 1.748 -4.736
191 HG12 VAL 27 2HG1 VAL 27 7.539 2.688 -3.744
192 HG13 VAL 27 3HG1 VAL 27 8.866 3.493 -4.580
193 HG21 VAL 27 3HG2 VAL 27 10.204 4.063 -1.774
194 HG22 VAL 27 1HG2 VAL 27 8.487 4.151 -2.169
195 HG23 VAL 27 2HG2 VAL 27 9.043 3.083 -0.879
196 H ASN 28 H ASN 28 9.234 1.398 0.301
197 HA ASN 28 HA ASN 28 11.989 1.211 0.791
198 HB2 ASN 28 1HB ASN 28 10.202 2.234 2.288
199 HB3 ASN 28 2HB ASN 28 9.833 0.586 2.809
200 HD21 ASN 28 1HD2 ASN 28 10.825 -0.076 4.563
201 HD22 ASN 28 2HD2 ASN 28 12.325 0.520 5.174
202 H GLN 29 H GLN 29 9.437 -1.211 0.822
203 HA GLN 29 HA GLN 29 11.113 -3.282 1.889
204 HB2 GLN 29 1HB GLN 29 8.329 -2.924 1.278
205 HB3 GLN 29 2HB GLN 29 8.905 -4.426 0.541
206 HG2 GLN 29 1HG GLN 29 9.444 -5.394 2.572
207 HG3 GLN 29 2HG GLN 29 9.542 -3.830 3.395
208 HE21 GLN 29 1HE2 GLN 29 7.946 -6.403 3.773
209 HE22 GLN 29 2HE2 GLN 29 6.328 -5.848 4.012
210 H ALA 30 H ALA 30 10.255 -2.111 -1.278
211 HA ALA 30 HA ALA 30 11.008 -4.352 -2.802
212 HB1 ALA 30 1HB ALA 30 10.954 -2.927 -4.688
213 HB2 ALA 30 2HB ALA 30 9.710 -2.333 -3.588
214 HB3 ALA 30 3HB ALA 30 11.257 -1.494 -3.705
215 H SER 31 H SER 31 12.863 -1.862 -1.245
216 HA SER 31 HA SER 31 15.234 -1.956 -2.694
217 HG SER 31 HG SER 31 15.318 -1.185 1.282
218 HB2 SER 31 1HB SER 31 16.189 -0.768 -0.966
219 HB3 SER 31 2HB SER 31 14.474 -0.507 -0.610
220 H ARG 32 H ARG 32 13.835 -4.290 -0.582
221 HA ARG 32 HA ARG 32 16.202 -5.697 0.110
222 HE ARG 32 HE ARG 32 14.353 -4.532 2.935
223 HB2 ARG 32 1HB ARG 32 13.603 -5.795 0.924
224 HB3 ARG 32 2HB ARG 32 13.711 -7.259 -0.068
225 HG2 ARG 32 1HG ARG 32 14.214 -7.960 2.112
226 HG3 ARG 32 2HG ARG 32 15.776 -7.852 1.281
227 HD2 ARG 32 1HD ARG 32 15.865 -6.891 3.552
228 HD3 ARG 32 2HD ARG 32 16.212 -5.697 2.294
229 HH11 ARG 32 1HH1 ARG 32 14.151 -7.771 4.198
230 HH12 ARG 32 2HH1 ARG 32 12.740 -7.450 5.152
231 HH21 ARG 32 1HH2 ARG 32 12.496 -4.098 4.186
232 HH22 ARG 32 2HH2 ARG 32 11.799 -5.360 5.144
233 H ILE 33 H ILE 33 14.401 -5.471 -2.766
234 HA ILE 33 HA ILE 33 15.975 -7.655 -3.929
235 HB ILE 33 HB ILE 33 13.115 -7.252 -4.750
236 HG12 ILE 33 1HG1 ILE 33 12.945 -9.513 -3.321
237 HG13 ILE 33 2HG1 ILE 33 14.189 -8.680 -2.375
238 HG21 ILE 33 1HG2 ILE 33 15.279 -8.851 -5.646
239 HG22 ILE 33 2HG2 ILE 33 14.052 -9.923 -4.971
240 HG23 ILE 33 3HG2 ILE 33 13.625 -8.795 -6.259
241 HD11 ILE 33 3HD1 ILE 33 12.564 -6.683 -2.392
242 HD12 ILE 33 1HD1 ILE 33 11.350 -7.881 -2.842
243 HD13 ILE 33 2HD1 ILE 33 12.233 -8.048 -1.324
244 H ASN 34 H ASN 34 15.711 -4.550 -3.927
245 HA ASN 34 HA ASN 34 15.680 -4.224 -6.854
246 HB2 ASN 34 1HB ASN 34 14.674 -2.565 -4.630
247 HB3 ASN 34 2HB ASN 34 15.553 -1.673 -5.877
248 HD21 ASN 34 1HD2 ASN 34 13.014 -4.118 -5.527
249 HD22 ASN 34 2HD2 ASN 34 12.051 -3.555 -6.847
250 H ARG 35 H ARG 35 17.533 -3.862 -3.952
251 HA ARG 35 HA ARG 35 19.493 -2.061 -4.800
252 HE ARG 35 HE ARG 35 21.726 -1.801 -0.438
253 HB2 ARG 35 1HB ARG 35 19.103 -3.014 -2.464
254 HB3 ARG 35 2HB ARG 35 20.030 -4.420 -3.002
255 HG2 ARG 35 1HG ARG 35 21.694 -3.210 -2.020
256 HG3 ARG 35 2HG ARG 35 21.797 -2.599 -3.679
257 HD2 ARG 35 1HD ARG 35 21.363 -0.525 -2.992
258 HD3 ARG 35 2HD ARG 35 19.853 -1.072 -2.251
259 HH11 ARG 35 1HH1 ARG 35 20.997 1.192 -2.060
260 HH12 ARG 35 2HH1 ARG 35 21.549 2.184 -0.754
261 HH21 ARG 35 1HH2 ARG 35 22.457 -0.504 1.290
262 HH22 ARG 35 2HH2 ARG 35 22.382 1.220 1.150
263 H LYS 36 H LYS 36 18.969 -5.395 -5.588
264 HA LYS 36 HA LYS 36 21.579 -6.027 -6.489
265 HB2 LYS 36 1HB LYS 36 20.425 -7.869 -7.746
266 HB3 LYS 36 2HB LYS 36 20.075 -7.822 -6.011
267 HG2 LYS 36 1HG LYS 36 17.897 -7.126 -6.315
268 HG3 LYS 36 2HG LYS 36 18.236 -6.451 -7.918
269 HD2 LYS 36 1HD LYS 36 18.768 -9.303 -7.837
270 HD3 LYS 36 2HD LYS 36 17.102 -8.929 -7.362
271 HE2 LYS 36 1HE LYS 36 17.157 -9.270 -9.746
272 HE3 LYS 36 2HE LYS 36 16.870 -7.556 -9.415
273 HZ1 LYS 36 3HZ LYS 36 19.295 -7.200 -9.746
274 HZ2 LYS 36 1HZ LYS 36 18.479 -7.713 -11.137
275 HZ3 LYS 36 2HZ LYS 36 19.424 -8.806 -10.260
276 H LYS 37 H LYS 37 18.894 -4.350 -7.924
277 HA LYS 37 HA LYS 37 20.490 -3.984 -10.371
278 HB2 LYS 37 1HB LYS 37 18.373 -3.866 -11.654
279 HB3 LYS 37 2HB LYS 37 18.646 -5.452 -10.917
280 HG2 LYS 37 1HG LYS 37 17.001 -5.111 -9.275
281 HG3 LYS 37 2HG LYS 37 16.938 -3.369 -9.595
282 HD2 LYS 37 1HD LYS 37 16.260 -5.293 -11.789
283 HD3 LYS 37 2HD LYS 37 15.070 -4.948 -10.524
284 HE2 LYS 37 1HE LYS 37 15.822 -2.429 -11.118
285 HE3 LYS 37 2HE LYS 37 16.107 -3.210 -12.679
286 HZ1 LYS 37 3HZ LYS 37 13.549 -3.225 -11.169
287 HZ2 LYS 37 1HZ LYS 37 13.818 -4.030 -12.633
288 HZ3 LYS 37 2HZ LYS 37 13.875 -2.340 -12.574
289 H LYS 38 H LYS 38 20.615 -2.288 -8.157
290 HA LYS 38 HA LYS 38 19.023 0.050 -8.947
291 HB2 LYS 38 1HB LYS 38 19.311 -0.954 -6.489
292 HB3 LYS 38 2HB LYS 38 20.739 0.091 -6.514
293 HG2 LYS 38 1HG LYS 38 18.940 1.313 -5.527
294 HG3 LYS 38 2HG LYS 38 19.267 1.997 -7.131
295 HD2 LYS 38 1HD LYS 38 17.334 1.080 -8.067
296 HD3 LYS 38 2HD LYS 38 17.173 -0.121 -6.773
297 HE2 LYS 38 1HE LYS 38 15.537 1.346 -6.127
298 HE3 LYS 38 2HE LYS 38 16.923 2.033 -5.268
299 HZ1 LYS 38 3HZ LYS 38 15.823 3.806 -6.344
300 HZ2 LYS 38 1HZ LYS 38 15.738 2.974 -7.816
301 HZ3 LYS 38 2HZ LYS 38 17.230 3.520 -7.239
302 H HIS 39 H HIS 39 21.350 -0.904 -10.438
303 HA HIS 39 HA HIS 39 23.479 0.967 -9.861
304 HD1 HIS 39 1HD HIS 39 26.319 0.105 -12.247
305 HD2 HIS 39 2HD HIS 39 24.733 -1.762 -8.890
306 HE1 HIS 39 1HE HIS 39 28.299 -0.524 -10.830
307 HE2 HIS 39 2HE HIS 39 27.331 -1.667 -8.779
308 HB2 HIS 39 1HB HIS 39 23.162 -1.441 -11.411
309 HB3 HIS 39 2HB HIS 39 23.865 -0.171 -12.416
Start of MODEL 2
1 H1 GLY 1 H GLY 1 -14.438 -1.889 -4.814
2 HA2 GLY 1 2HA GLY 1 -13.773 -3.997 -3.419
3 HA3 GLY 1 3HA GLY 1 -12.527 -2.905 -2.834
4 H THR 2 H THR 2 -15.470 -4.155 -2.129
5 HA THR 2 HA THR 2 -16.970 -1.989 -1.183
6 HB THR 2 HB THR 2 -17.946 -3.742 0.432
7 HG1 THR 2 1HG THR 2 -15.959 -5.088 0.164
8 HG21 THR 2 3HG2 THR 2 -19.194 -3.265 -1.497
9 HG22 THR 2 1HG2 THR 2 -18.976 -5.014 -1.547
10 HG23 THR 2 2HG2 THR 2 -17.979 -3.972 -2.565
11 H TRP 3 H TRP 3 -14.083 -3.368 0.004
12 HA TRP 3 HA TRP 3 -14.217 -3.026 2.734
13 HD1 TRP 3 HD TRP 3 -11.909 -4.293 -0.757
14 HE1 TRP 3 1HE TRP 3 -11.761 -6.859 -0.584
15 HE3 TRP 3 3HE TRP 3 -12.499 -4.802 4.295
16 HZ2 TRP 3 2HZ TRP 3 -11.881 -8.834 1.427
17 HZ3 TRP 3 3HZ TRP 3 -12.471 -7.065 5.264
18 HH2 TRP 3 HH TRP 3 -12.169 -9.038 3.858
19 HB2 TRP 3 1HB TRP 3 -11.824 -2.336 1.010
20 HB3 TRP 3 2HB TRP 3 -11.801 -2.798 2.711
21 H ASP 4 H ASP 4 -14.008 -0.609 0.241
22 HA ASP 4 HA ASP 4 -13.131 1.569 1.782
23 HD2 ASP 4 HD ASP 4 -11.410 1.004 -1.707
24 HB2 ASP 4 1HB ASP 4 -14.758 1.340 -0.743
25 HB3 ASP 4 2HB ASP 4 -14.437 2.912 -0.002
26 H ASP 5 H ASP 5 -16.422 0.490 0.974
27 HA ASP 5 HA ASP 5 -17.636 2.481 2.657
28 HD2 ASP 5 HD ASP 5 -20.526 3.764 0.803
29 HB2 ASP 5 1HB ASP 5 -18.502 0.979 0.522
30 HB3 ASP 5 2HB ASP 5 -19.299 0.188 1.889
31 H ILE 6 H ILE 6 -17.133 -1.026 2.825
32 HA ILE 6 HA ILE 6 -18.465 -1.468 5.253
33 HB ILE 6 HB ILE 6 -16.084 -2.989 4.182
34 HG12 ILE 6 1HG1 ILE 6 -19.028 -3.572 3.793
35 HG13 ILE 6 2HG1 ILE 6 -18.026 -2.743 2.590
36 HG21 ILE 6 1HG2 ILE 6 -17.632 -3.255 6.568
37 HG22 ILE 6 2HG2 ILE 6 -17.906 -4.658 5.536
38 HG23 ILE 6 3HG2 ILE 6 -16.265 -4.223 6.016
39 HD11 ILE 6 3HD1 ILE 6 -18.448 -5.318 2.432
40 HD12 ILE 6 1HD1 ILE 6 -16.875 -4.630 2.026
41 HD13 ILE 6 2HD1 ILE 6 -17.125 -5.390 3.598
42 H GLY 7 H GLY 7 -15.295 -0.210 4.547
43 HA2 GLY 7 2HA GLY 7 -14.322 -0.539 7.251
44 HA3 GLY 7 3HA GLY 7 -13.501 0.295 5.938
45 H GLN 8 H GLN 8 -15.464 2.155 5.245
46 HA GLN 8 HA GLN 8 -15.984 4.317 5.757
47 HB2 GLN 8 1HB GLN 8 -17.810 3.013 6.870
48 HB3 GLN 8 2HB GLN 8 -16.885 3.109 8.376
49 HG2 GLN 8 1HG GLN 8 -17.012 5.739 7.535
50 HG3 GLN 8 2HG GLN 8 -18.601 5.080 7.119
51 HE21 GLN 8 1HE2 GLN 8 -17.095 6.732 9.408
52 HE22 GLN 8 2HE2 GLN 8 -17.956 6.214 10.813
53 H GLY 9 H GLY 9 -13.501 4.482 5.890
54 HA2 GLY 9 2HA GLY 9 -12.704 6.389 7.626
55 HA3 GLY 9 3HA GLY 9 -12.430 4.915 8.542
56 H ILE 10 H ILE 10 -11.017 3.280 7.559
57 HA ILE 10 HA ILE 10 -8.545 4.285 6.848
58 HB ILE 10 HB ILE 10 -9.637 1.562 6.128
59 HG12 ILE 10 1HG1 ILE 10 -7.827 1.704 8.397
60 HG13 ILE 10 2HG1 ILE 10 -9.273 2.697 8.654
61 HG21 ILE 10 1HG2 ILE 10 -7.671 1.796 4.902
62 HG22 ILE 10 2HG2 ILE 10 -6.873 2.717 6.176
63 HG23 ILE 10 3HG2 ILE 10 -7.145 0.985 6.376
64 HD11 ILE 10 3HD1 ILE 10 -10.648 0.924 8.803
65 HD12 ILE 10 1HD1 ILE 10 -9.751 -0.014 7.610
66 HD13 ILE 10 2HD1 ILE 10 -9.161 0.101 9.268
67 H GLY 11 H GLY 11 -11.288 3.548 4.824
68 HA2 GLY 11 2HA GLY 11 -9.973 3.424 2.333
69 HA3 GLY 11 3HA GLY 11 -11.665 3.831 2.577
70 H ARG 12 H ARG 12 -11.631 6.160 3.906
71 HA ARG 12 HA ARG 12 -10.778 7.999 1.872
72 HE ARG 12 HE ARG 12 -14.748 7.692 0.861
73 HB2 ARG 12 1HB ARG 12 -12.054 8.465 4.578
74 HB3 ARG 12 2HB ARG 12 -11.792 9.715 3.355
75 HG2 ARG 12 1HG ARG 12 -13.291 7.303 2.505
76 HG3 ARG 12 2HG ARG 12 -14.100 8.422 3.616
77 HD2 ARG 12 1HD ARG 12 -14.194 10.118 2.087
78 HD3 ARG 12 2HD ARG 12 -12.708 9.601 1.279
79 HH11 ARG 12 1HH1 ARG 12 -13.765 10.890 -0.097
80 HH12 ARG 12 2HH1 ARG 12 -14.542 10.807 -1.644
81 HH21 ARG 12 1HH2 ARG 12 -15.773 7.570 -1.173
82 HH22 ARG 12 2HH2 ARG 12 -15.682 8.919 -2.254
83 H VAL 13 H VAL 13 -9.678 7.046 5.055
84 HA VAL 13 HA VAL 13 -7.876 9.205 5.457
85 HB VAL 13 HB VAL 13 -7.837 6.431 6.657
86 HG11 VAL 13 1HG1 VAL 13 -6.709 8.354 8.388
87 HG12 VAL 13 2HG1 VAL 13 -5.908 6.996 7.601
88 HG13 VAL 13 3HG1 VAL 13 -5.952 8.572 6.810
89 HG21 VAL 13 3HG2 VAL 13 -9.758 8.360 6.960
90 HG22 VAL 13 1HG2 VAL 13 -9.400 7.083 8.122
91 HG23 VAL 13 2HG2 VAL 13 -8.682 8.681 8.319
92 H ALA 14 H ALA 14 -7.549 5.976 4.067
93 HA ALA 14 HA ALA 14 -4.797 5.812 3.822
94 HB1 ALA 14 1HB ALA 14 -6.250 3.943 3.318
95 HB2 ALA 14 2HB ALA 14 -6.900 4.792 1.916
96 HB3 ALA 14 3HB ALA 14 -5.211 4.286 1.935
97 H TYR 15 H TYR 15 -7.100 7.633 1.914
98 HA TYR 15 HA TYR 15 -5.298 8.255 -0.212
99 HD1 TYR 15 2HD TYR 15 -6.634 8.748 -2.725
100 HD2 TYR 15 1HD TYR 15 -7.393 11.882 0.050
101 HE1 TYR 15 2HE TYR 15 -6.320 10.403 -4.517
102 HE2 TYR 15 1HE TYR 15 -7.083 13.545 -1.735
103 HH TYR 15 HH TYR 15 -6.634 13.883 -3.878
104 HB2 TYR 15 1HB TYR 15 -7.729 8.305 -0.527
105 HB3 TYR 15 2HB TYR 15 -7.862 9.618 0.643
106 H TRP 16 H TRP 16 -6.030 9.648 2.893
107 HA TRP 16 HA TRP 16 -4.747 12.163 2.358
108 HD1 TRP 16 HD TRP 16 -8.327 11.468 3.547
109 HE1 TRP 16 1HE TRP 16 -9.568 13.701 3.235
110 HE3 TRP 16 3HE TRP 16 -4.493 14.680 4.605
111 HZ2 TRP 16 2HZ TRP 16 -8.995 16.459 3.413
112 HZ3 TRP 16 3HZ TRP 16 -4.922 17.101 4.510
113 HH2 TRP 16 HH TRP 16 -7.127 17.972 3.926
114 HB2 TRP 16 1HB TRP 16 -5.995 10.847 4.733
115 HB3 TRP 16 2HB TRP 16 -4.872 12.178 5.014
116 H VAL 17 H VAL 17 -3.905 9.205 4.121
117 HA VAL 17 HA VAL 17 -1.376 10.109 5.022
118 HB VAL 17 HB VAL 17 -2.518 8.212 6.070
119 HG11 VAL 17 1HG1 VAL 17 -2.727 6.081 5.014
120 HG12 VAL 17 2HG1 VAL 17 -3.438 7.286 3.937
121 HG13 VAL 17 3HG1 VAL 17 -1.835 6.634 3.597
122 HG21 VAL 17 3HG2 VAL 17 -0.603 7.048 6.601
123 HG22 VAL 17 1HG2 VAL 17 -0.017 7.044 4.937
124 HG23 VAL 17 2HG2 VAL 17 0.077 8.517 5.902
125 H GLY 18 H GLY 18 -2.465 8.486 2.100
126 HA2 GLY 18 2HA GLY 18 0.100 7.774 1.121
127 HA3 GLY 18 3HA GLY 18 -1.365 7.913 0.163
128 H LYS 19 H LYS 19 -1.955 10.611 0.583
129 HA LYS 19 HA LYS 19 -0.176 11.812 -1.300
130 HB2 LYS 19 1HB LYS 19 -1.588 13.788 -1.096
131 HB3 LYS 19 2HB LYS 19 -2.578 12.326 -1.260
132 HG2 LYS 19 1HG LYS 19 -3.073 12.317 1.097
133 HG3 LYS 19 2HG LYS 19 -1.975 13.685 1.358
134 HD2 LYS 19 1HD LYS 19 -3.923 14.287 -0.705
135 HD3 LYS 19 2HD LYS 19 -4.707 13.806 0.810
136 HE2 LYS 19 1HE LYS 19 -4.348 16.234 0.721
137 HE3 LYS 19 2HE LYS 19 -3.430 15.479 2.032
138 HZ1 LYS 19 3HZ LYS 19 -1.962 15.640 -0.434
139 HZ2 LYS 19 1HZ LYS 19 -1.502 16.097 1.129
140 HZ3 LYS 19 2HZ LYS 19 -2.409 17.156 0.172
141 H ALA 20 H ALA 20 -0.583 11.962 2.174
142 HA ALA 20 HA ALA 20 1.079 14.241 2.585
143 HB1 ALA 20 1HB ALA 20 0.368 12.069 4.552
144 HB2 ALA 20 2HB ALA 20 0.965 13.687 4.929
145 HB3 ALA 20 3HB ALA 20 -0.630 13.483 4.204
146 H LEU 21 H LEU 21 1.642 10.807 2.301
147 HA LEU 21 HA LEU 21 4.363 10.980 3.265
148 HG LEU 21 HG LEU 21 3.179 9.314 4.826
149 HB2 LEU 21 1HB LEU 21 2.508 8.842 2.401
150 HB3 LEU 21 2HB LEU 21 4.232 8.549 2.118
151 HD11 LEU 21 1HD1 LEU 21 3.213 6.642 3.485
152 HD12 LEU 21 2HD1 LEU 21 1.967 7.374 4.495
153 HD13 LEU 21 3HD1 LEU 21 3.453 6.770 5.228
154 HD21 LEU 21 3HD2 LEU 21 5.636 9.474 4.229
155 HD22 LEU 21 1HD2 LEU 21 5.617 7.716 4.088
156 HD23 LEU 21 2HD2 LEU 21 5.233 8.482 5.631
157 H GLY 22 H GLY 22 2.675 11.045 0.222
158 HA2 GLY 22 2HA GLY 22 4.250 12.300 -1.417
159 HA3 GLY 22 3HA GLY 22 5.212 10.840 -1.247
160 H ASN 23 H ASN 23 5.045 9.778 -3.115
161 HA ASN 23 HA ASN 23 2.474 8.764 -3.925
162 HB2 ASN 23 1HB ASN 23 3.962 10.791 -5.586
163 HB3 ASN 23 2HB ASN 23 2.897 9.599 -6.339
164 HD21 ASN 23 1HD2 ASN 23 0.805 9.412 -4.696
165 HD22 ASN 23 2HD2 ASN 23 -0.012 10.928 -4.554
166 H LEU 24 H LEU 24 5.905 9.145 -4.686
167 HA LEU 24 HA LEU 24 6.341 6.354 -4.848
168 HG LEU 24 HG LEU 24 7.238 8.704 -7.551
169 HB2 LEU 24 1HB LEU 24 6.866 6.130 -7.207
170 HB3 LEU 24 2HB LEU 24 5.178 6.618 -6.979
171 HD11 LEU 24 1HD1 LEU 24 7.307 6.661 -9.182
172 HD12 LEU 24 2HD1 LEU 24 7.313 8.309 -9.808
173 HD13 LEU 24 3HD1 LEU 24 5.819 7.373 -9.806
174 HD21 LEU 24 3HD2 LEU 24 5.160 9.635 -7.065
175 HD22 LEU 24 1HD2 LEU 24 4.283 8.361 -7.917
176 HD23 LEU 24 2HD2 LEU 24 5.180 9.576 -8.828
177 H SER 25 H SER 25 7.448 8.741 -3.621
178 HA SER 25 HA SER 25 10.027 9.132 -4.901
179 HG SER 25 HG SER 25 10.917 11.375 -4.051
180 HB2 SER 25 1HB SER 25 8.755 11.008 -3.797
181 HB3 SER 25 2HB SER 25 9.080 10.224 -2.241
182 H ASP 26 H ASP 26 8.797 7.883 -1.805
183 HA ASP 26 HA ASP 26 11.343 7.003 -0.886
184 HD2 ASP 26 HD ASP 26 11.572 7.188 2.646
185 HB2 ASP 26 1HB ASP 26 8.576 6.947 0.053
186 HB3 ASP 26 2HB ASP 26 9.464 5.474 0.467
187 H VAL 27 H VAL 27 8.788 5.550 -2.779
188 HA VAL 27 HA VAL 27 9.577 2.855 -2.551
189 HB VAL 27 HB VAL 27 8.231 4.140 -4.928
190 HG11 VAL 27 1HG1 VAL 27 8.952 1.933 -5.460
191 HG12 VAL 27 2HG1 VAL 27 8.361 1.304 -3.920
192 HG13 VAL 27 3HG1 VAL 27 7.218 1.855 -5.147
193 HG21 VAL 27 3HG2 VAL 27 6.587 4.655 -3.506
194 HG22 VAL 27 1HG2 VAL 27 6.275 2.921 -3.421
195 HG23 VAL 27 2HG2 VAL 27 7.295 3.694 -2.209
196 H ASN 28 H ASN 28 10.886 5.503 -4.326
197 HA ASN 28 HA ASN 28 12.248 3.957 -6.310
198 HB2 ASN 28 1HB ASN 28 11.601 6.439 -6.427
199 HB3 ASN 28 2HB ASN 28 13.024 6.732 -5.423
200 HD21 ASN 28 1HD2 ASN 28 14.809 7.197 -6.469
201 HD22 ASN 28 2HD2 ASN 28 15.195 6.732 -8.088
202 H GLN 29 H GLN 29 13.115 5.352 -3.184
203 HA GLN 29 HA GLN 29 15.863 4.530 -3.365
204 HB2 GLN 29 1HB GLN 29 16.073 5.343 -1.090
205 HB3 GLN 29 2HB GLN 29 15.179 6.516 -2.072
206 HG2 GLN 29 1HG GLN 29 13.130 5.992 -1.062
207 HG3 GLN 29 2HG GLN 29 13.768 4.493 -0.370
208 HE21 GLN 29 1HE2 GLN 29 13.837 7.987 -0.157
209 HE22 GLN 29 2HE2 GLN 29 14.389 8.066 1.479
210 H ALA 30 H ALA 30 12.898 3.164 -2.207
211 HA ALA 30 HA ALA 30 13.920 1.263 -0.404
212 HB1 ALA 30 1HB ALA 30 11.803 0.214 -0.509
213 HB2 ALA 30 2HB ALA 30 11.506 1.941 -0.711
214 HB3 ALA 30 3HB ALA 30 11.475 0.873 -2.111
215 H SER 31 H SER 31 13.806 1.355 -3.874
216 HA SER 31 HA SER 31 14.007 -1.345 -4.503
217 HG SER 31 HG SER 31 16.586 0.141 -6.342
218 HB2 SER 31 1HB SER 31 14.548 -0.677 -6.643
219 HB3 SER 31 2HB SER 31 13.866 0.832 -6.009
220 H ARG 32 H ARG 32 16.305 0.768 -3.049
221 HA ARG 32 HA ARG 32 18.669 -0.655 -3.731
222 HE ARG 32 HE ARG 32 21.816 0.944 -3.197
223 HB2 ARG 32 1HB ARG 32 18.053 1.227 -1.442
224 HB3 ARG 32 2HB ARG 32 19.667 0.602 -1.809
225 HG2 ARG 32 1HG ARG 32 18.037 2.145 -3.818
226 HG3 ARG 32 2HG ARG 32 19.135 2.921 -2.662
227 HD2 ARG 32 1HD ARG 32 19.993 0.738 -4.570
228 HD3 ARG 32 2HD ARG 32 20.114 2.464 -4.931
229 HH11 ARG 32 1HH1 ARG 32 20.562 4.115 -3.894
230 HH12 ARG 32 2HH1 ARG 32 21.892 4.946 -3.160
231 HH21 ARG 32 1HH2 ARG 32 23.576 2.026 -2.227
232 HH22 ARG 32 2HH2 ARG 32 23.608 3.758 -2.213
233 H ILE 33 H ILE 33 16.117 -1.300 -1.575
234 HA ILE 33 HA ILE 33 17.642 -3.534 -0.438
235 HB ILE 33 HB ILE 33 15.714 -1.992 1.274
236 HG12 ILE 33 1HG1 ILE 33 18.072 -1.217 2.291
237 HG13 ILE 33 2HG1 ILE 33 18.533 -1.340 0.586
238 HG21 ILE 33 1HG2 ILE 33 17.940 -3.259 2.593
239 HG22 ILE 33 2HG2 ILE 33 16.209 -3.518 2.813
240 HG23 ILE 33 3HG2 ILE 33 17.082 -4.407 1.565
241 HD11 ILE 33 3HD1 ILE 33 17.892 0.870 0.788
242 HD12 ILE 33 1HD1 ILE 33 16.446 0.096 0.135
243 HD13 ILE 33 2HD1 ILE 33 16.539 0.486 1.854
244 H ASN 34 H ASN 34 15.331 -2.898 -2.431
245 HA ASN 34 HA ASN 34 13.406 -4.834 -1.325
246 HB2 ASN 34 1HB ASN 34 13.098 -2.356 -2.896
247 HB3 ASN 34 2HB ASN 34 12.107 -3.710 -3.452
248 HD21 ASN 34 1HD2 ASN 34 12.984 -1.946 -0.514
249 HD22 ASN 34 2HD2 ASN 34 11.441 -2.103 0.249
250 H ARG 35 H ARG 35 15.573 -4.119 -3.927
251 HA ARG 35 HA ARG 35 14.593 -5.886 -5.879
252 HE ARG 35 HE ARG 35 19.894 -5.504 -6.860
253 HB2 ARG 35 1HB ARG 35 16.730 -5.693 -6.942
254 HB3 ARG 35 2HB ARG 35 16.326 -4.118 -6.242
255 HG2 ARG 35 1HG ARG 35 17.721 -4.953 -4.205
256 HG3 ARG 35 2HG ARG 35 18.398 -6.087 -5.386
257 HD2 ARG 35 1HD ARG 35 18.240 -3.231 -6.200
258 HD3 ARG 35 2HD ARG 35 19.423 -3.655 -4.955
259 HH11 ARG 35 1HH1 ARG 35 19.601 -2.034 -6.945
260 HH12 ARG 35 2HH1 ARG 35 20.691 -1.845 -8.279
261 HH21 ARG 35 1HH2 ARG 35 21.330 -5.266 -8.615
262 HH22 ARG 35 2HH2 ARG 35 21.674 -3.685 -9.229
263 H LYS 36 H LYS 36 16.402 -6.422 -2.971
264 HA LYS 36 HA LYS 36 17.439 -8.986 -3.630
265 HB2 LYS 36 1HB LYS 36 17.079 -7.403 -1.114
266 HB3 LYS 36 2HB LYS 36 17.451 -9.131 -0.994
267 HG2 LYS 36 1HG LYS 36 19.586 -8.865 -1.649
268 HG3 LYS 36 2HG LYS 36 19.166 -7.620 -2.839
269 HD2 LYS 36 1HD LYS 36 19.000 -5.935 -1.116
270 HD3 LYS 36 2HD LYS 36 19.246 -7.160 0.143
271 HE2 LYS 36 1HE LYS 36 21.501 -7.430 -0.361
272 HE3 LYS 36 2HE LYS 36 21.299 -6.801 -2.002
273 HZ1 LYS 36 3HZ LYS 36 21.960 -5.404 0.380
274 HZ2 LYS 36 1HZ LYS 36 20.579 -4.733 -0.332
275 HZ3 LYS 36 2HZ LYS 36 22.010 -4.864 -1.223
276 H LYS 37 H LYS 37 14.406 -7.841 -2.326
277 HA LYS 37 HA LYS 37 13.239 -10.465 -2.721
278 HB2 LYS 37 1HB LYS 37 14.192 -10.275 -0.320
279 HB3 LYS 37 2HB LYS 37 12.828 -9.181 -0.034
280 HG2 LYS 37 1HG LYS 37 11.289 -10.995 -0.790
281 HG3 LYS 37 2HG LYS 37 12.694 -12.076 -0.849
282 HD2 LYS 37 1HD LYS 37 13.117 -11.565 1.563
283 HD3 LYS 37 2HD LYS 37 11.596 -10.655 1.577
284 HE2 LYS 37 1HE LYS 37 10.957 -12.745 2.385
285 HE3 LYS 37 2HE LYS 37 10.537 -12.823 0.670
286 HZ1 LYS 37 3HZ LYS 37 12.442 -14.373 2.147
287 HZ2 LYS 37 1HZ LYS 37 13.106 -13.711 0.738
288 HZ3 LYS 37 2HZ LYS 37 11.729 -14.687 0.644
289 H LYS 38 H LYS 38 12.098 -9.323 -4.351
290 HA LYS 38 HA LYS 38 10.141 -7.356 -3.382
291 HB2 LYS 38 1HB LYS 38 11.810 -7.085 -5.457
292 HB3 LYS 38 2HB LYS 38 10.465 -7.885 -6.290
293 HG2 LYS 38 1HG LYS 38 8.975 -6.089 -5.224
294 HG3 LYS 38 2HG LYS 38 10.492 -5.231 -4.897
295 HD2 LYS 38 1HD LYS 38 10.377 -6.206 -7.634
296 HD3 LYS 38 2HD LYS 38 9.011 -5.143 -7.246
297 HE2 LYS 38 1HE LYS 38 10.932 -3.665 -6.158
298 HE3 LYS 38 2HE LYS 38 11.923 -4.541 -7.334
299 HZ1 LYS 38 3HZ LYS 38 10.957 -3.496 -9.068
300 HZ2 LYS 38 1HZ LYS 38 10.648 -2.300 -7.913
301 HZ3 LYS 38 2HZ LYS 38 9.436 -3.403 -8.333
302 H HIS 39 H HIS 39 9.535 -9.878 -2.634
303 HA HIS 39 HA HIS 39 7.846 -11.173 -4.578
304 HD1 HIS 39 1HD HIS 39 7.035 -13.222 -4.933
305 HD2 HIS 39 2HD HIS 39 6.558 -13.838 -0.851
306 HE1 HIS 39 1HE HIS 39 5.375 -15.100 -4.725
307 HE2 HIS 39 2HE HIS 39 5.085 -15.476 -2.231
308 HB2 HIS 39 1HB HIS 39 9.129 -12.415 -2.831
309 HB3 HIS 39 2HB HIS 39 8.069 -11.707 -1.609
Start of MODEL 3
1 H1 GLY 1 H GLY 1 -27.675 -2.449 7.312
2 HA2 GLY 1 2HA GLY 1 -25.302 -3.727 6.786
3 HA3 GLY 1 3HA GLY 1 -25.903 -2.368 5.848
4 H THR 2 H THR 2 -23.583 -3.448 8.126
5 HA THR 2 HA THR 2 -22.712 -1.021 9.218
6 HB THR 2 HB THR 2 -20.451 -2.242 9.394
7 HG1 THR 2 1HG THR 2 -21.128 -3.738 7.621
8 HG21 THR 2 3HG2 THR 2 -21.782 -2.188 11.325
9 HG22 THR 2 1HG2 THR 2 -21.463 -3.904 11.069
10 HG23 THR 2 2HG2 THR 2 -23.021 -3.217 10.608
11 H TRP 3 H TRP 3 -22.452 -2.239 6.040
12 HA TRP 3 HA TRP 3 -20.080 -1.213 5.089
13 HD1 TRP 3 HD TRP 3 -23.745 -3.465 4.310
14 HE1 TRP 3 1HE TRP 3 -22.993 -5.905 3.997
15 HE3 TRP 3 3HE TRP 3 -18.925 -2.642 2.818
16 HZ2 TRP 3 2HZ TRP 3 -20.663 -7.299 3.221
17 HZ3 TRP 3 3HZ TRP 3 -17.500 -4.583 2.310
18 HH2 TRP 3 HH TRP 3 -18.354 -6.863 2.508
19 HB2 TRP 3 1HB TRP 3 -22.724 -1.134 3.612
20 HB3 TRP 3 2HB TRP 3 -21.112 -1.154 2.896
21 H ASP 4 H ASP 4 -22.983 0.480 5.995
22 HA ASP 4 HA ASP 4 -22.528 2.917 4.670
23 HD2 ASP 4 HD ASP 4 -24.896 5.871 6.711
24 HB2 ASP 4 1HB ASP 4 -24.637 2.111 5.905
25 HB3 ASP 4 2HB ASP 4 -23.844 2.697 7.372
26 H ASP 5 H ASP 5 -21.664 1.882 7.962
27 HA ASP 5 HA ASP 5 -20.212 4.306 8.491
28 HD2 ASP 5 HD ASP 5 -21.926 4.202 12.422
29 HB2 ASP 5 1HB ASP 5 -20.836 1.799 9.971
30 HB3 ASP 5 2HB ASP 5 -19.400 2.700 10.476
31 H ILE 6 H ILE 6 -19.361 0.931 7.813
32 HA ILE 6 HA ILE 6 -16.578 1.204 8.046
33 HB ILE 6 HB ILE 6 -18.073 -0.690 6.228
34 HG12 ILE 6 1HG1 ILE 6 -17.104 -1.160 9.055
35 HG13 ILE 6 2HG1 ILE 6 -18.774 -0.727 8.650
36 HG21 ILE 6 1HG2 ILE 6 -16.101 -2.085 6.375
37 HG22 ILE 6 2HG2 ILE 6 -15.665 -0.490 5.761
38 HG23 ILE 6 3HG2 ILE 6 -15.323 -0.914 7.438
39 HD11 ILE 6 3HD1 ILE 6 -17.368 -3.178 7.620
40 HD12 ILE 6 1HD1 ILE 6 -18.451 -3.147 9.010
41 HD13 ILE 6 2HD1 ILE 6 -19.066 -2.755 7.403
42 H GLY 7 H GLY 7 -18.778 2.036 5.476
43 HA2 GLY 7 2HA GLY 7 -16.733 2.303 3.467
44 HA3 GLY 7 3HA GLY 7 -18.410 2.808 3.323
45 H GLN 8 H GLN 8 -18.316 4.427 5.760
46 HA GLN 8 HA GLN 8 -17.553 6.882 4.606
47 HB2 GLN 8 1HB GLN 8 -19.290 6.805 6.277
48 HB3 GLN 8 2HB GLN 8 -18.158 6.151 7.474
49 HG2 GLN 8 1HG GLN 8 -18.615 8.521 7.856
50 HG3 GLN 8 2HG GLN 8 -16.911 8.222 7.485
51 HE21 GLN 8 1HE2 GLN 8 -16.767 10.455 6.940
52 HE22 GLN 8 2HE2 GLN 8 -17.302 11.015 5.395
53 H GLY 9 H GLY 9 -15.974 4.781 6.979
54 HA2 GLY 9 2HA GLY 9 -13.758 6.585 7.349
55 HA3 GLY 9 3HA GLY 9 -13.897 4.956 7.990
56 H ILE 10 H ILE 10 -13.735 3.197 6.258
57 HA ILE 10 HA ILE 10 -11.217 3.223 5.126
58 HB ILE 10 HB ILE 10 -13.595 1.620 4.178
59 HG12 ILE 10 1HG1 ILE 10 -13.183 1.321 6.561
60 HG13 ILE 10 2HG1 ILE 10 -12.717 -0.136 5.669
61 HG21 ILE 10 1HG2 ILE 10 -10.707 1.569 3.514
62 HG22 ILE 10 2HG2 ILE 10 -11.535 0.023 3.680
63 HG23 ILE 10 3HG2 ILE 10 -12.107 1.209 2.507
64 HD11 ILE 10 3HD1 ILE 10 -11.051 0.275 7.314
65 HD12 ILE 10 1HD1 ILE 10 -10.357 0.655 5.739
66 HD13 ILE 10 2HD1 ILE 10 -10.884 1.954 6.807
67 H GLY 11 H GLY 11 -14.225 4.426 3.832
68 HA2 GLY 11 2HA GLY 11 -13.507 4.567 1.111
69 HA3 GLY 11 3HA GLY 11 -14.724 5.559 1.900
70 H ARG 12 H ARG 12 -13.369 7.082 3.634
71 HA ARG 12 HA ARG 12 -12.011 8.919 1.894
72 HE ARG 12 HE ARG 12 -15.769 10.549 1.265
73 HB2 ARG 12 1HB ARG 12 -12.440 9.019 4.890
74 HB3 ARG 12 2HB ARG 12 -11.877 10.359 3.879
75 HG2 ARG 12 1HG ARG 12 -14.540 9.007 3.481
76 HG3 ARG 12 2HG ARG 12 -14.303 10.422 4.522
77 HD2 ARG 12 1HD ARG 12 -13.586 11.770 2.676
78 HD3 ARG 12 2HD ARG 12 -13.518 10.356 1.615
79 HH11 ARG 12 1HH1 ARG 12 -14.894 12.409 4.074
80 HH12 ARG 12 2HH1 ARG 12 -16.458 13.135 4.241
81 HH21 ARG 12 1HH2 ARG 12 -17.831 11.497 1.475
82 HH22 ARG 12 2HH2 ARG 12 -18.128 12.615 2.763
83 H VAL 13 H VAL 13 -11.096 6.622 4.372
84 HA VAL 13 HA VAL 13 -8.430 7.538 4.728
85 HB VAL 13 HB VAL 13 -9.594 4.793 5.228
86 HG11 VAL 13 1HG1 VAL 13 -7.447 5.364 6.965
87 HG12 VAL 13 2HG1 VAL 13 -7.526 4.136 5.700
88 HG13 VAL 13 3HG1 VAL 13 -6.901 5.745 5.333
89 HG21 VAL 13 3HG2 VAL 13 -8.992 6.510 7.513
90 HG22 VAL 13 1HG2 VAL 13 -10.256 7.149 6.462
91 HG23 VAL 13 2HG2 VAL 13 -10.425 5.542 7.169
92 H ALA 14 H ALA 14 -9.924 5.128 2.620
93 HA ALA 14 HA ALA 14 -7.671 3.885 1.603
94 HB1 ALA 14 1HB ALA 14 -10.239 4.554 0.171
95 HB2 ALA 14 2HB ALA 14 -9.032 3.398 -0.392
96 HB3 ALA 14 3HB ALA 14 -9.906 3.099 1.110
97 H TYR 15 H TYR 15 -9.010 7.032 0.851
98 HA TYR 15 HA TYR 15 -7.441 7.470 -1.492
99 HD1 TYR 15 1HD TYR 15 -7.886 9.319 -3.262
100 HD2 TYR 15 2HD TYR 15 -8.064 11.476 0.402
101 HE1 TYR 15 1HE TYR 15 -6.931 11.291 -4.382
102 HE2 TYR 15 2HE TYR 15 -7.110 13.451 -0.708
103 HH TYR 15 HH TYR 15 -5.629 13.341 -3.705
104 HB2 TYR 15 1HB TYR 15 -9.487 8.699 -1.244
105 HB3 TYR 15 2HB TYR 15 -8.970 9.349 0.314
106 H TRP 16 H TRP 16 -6.967 7.946 1.923
107 HA TRP 16 HA TRP 16 -4.696 9.686 1.631
108 HD1 TRP 16 HD TRP 16 -7.998 10.135 3.841
109 HE1 TRP 16 1HE TRP 16 -8.069 12.671 4.266
110 HE3 TRP 16 3HE TRP 16 -2.978 11.098 3.830
111 HZ2 TRP 16 2HZ TRP 16 -6.238 14.802 4.556
112 HZ3 TRP 16 3HZ TRP 16 -2.220 13.413 4.189
113 HH2 TRP 16 HH TRP 16 -3.818 15.223 4.543
114 HB2 TRP 16 1HB TRP 16 -6.080 8.325 3.912
115 HB3 TRP 16 2HB TRP 16 -4.435 8.913 4.151
116 H VAL 17 H VAL 17 -5.194 6.259 2.393
117 HA VAL 17 HA VAL 17 -2.454 5.637 2.747
118 HB VAL 17 HB VAL 17 -4.227 4.191 3.618
119 HG11 VAL 17 1HG1 VAL 17 -5.767 4.498 1.679
120 HG12 VAL 17 2HG1 VAL 17 -4.750 3.384 0.762
121 HG13 VAL 17 3HG1 VAL 17 -5.594 2.826 2.207
122 HG21 VAL 17 3HG2 VAL 17 -1.887 3.372 2.280
123 HG22 VAL 17 1HG2 VAL 17 -2.737 2.545 3.585
124 HG23 VAL 17 2HG2 VAL 17 -3.132 2.178 1.906
125 H GLY 18 H GLY 18 -4.580 5.689 -0.052
126 HA2 GLY 18 2HA GLY 18 -2.855 4.305 -1.826
127 HA3 GLY 18 3HA GLY 18 -4.176 5.365 -2.291
128 H LYS 19 H LYS 19 -3.296 7.754 -1.138
129 HA LYS 19 HA LYS 19 -1.429 8.611 -3.119
130 HB2 LYS 19 1HB LYS 19 -1.645 10.816 -2.101
131 HB3 LYS 19 2HB LYS 19 -3.235 10.066 -2.313
132 HG2 LYS 19 1HG LYS 19 -3.350 9.503 0.030
133 HG3 LYS 19 2HG LYS 19 -1.698 10.097 0.277
134 HD2 LYS 19 1HD LYS 19 -3.929 11.848 -0.759
135 HD3 LYS 19 2HD LYS 19 -3.559 11.668 0.966
136 HE2 LYS 19 1HE LYS 19 -1.100 12.237 0.132
137 HE3 LYS 19 2HE LYS 19 -1.998 13.004 -1.185
138 HZ1 LYS 19 3HZ LYS 19 -2.875 13.580 1.541
139 HZ2 LYS 19 1HZ LYS 19 -2.853 14.583 0.179
140 HZ3 LYS 19 2HZ LYS 19 -1.423 14.281 1.030
141 H ALA 20 H ALA 20 -1.241 7.782 0.277
142 HA ALA 20 HA ALA 20 1.321 8.875 0.786
143 HB1 ALA 20 1HB ALA 20 1.314 7.243 2.718
144 HB2 ALA 20 2HB ALA 20 -0.032 8.382 2.657
145 HB3 ALA 20 3HB ALA 20 -0.268 6.712 2.143
146 H LEU 21 H LEU 21 0.238 5.903 -0.670
147 HA LEU 21 HA LEU 21 2.750 4.542 -0.449
148 HG LEU 21 HG LEU 21 1.558 2.813 0.385
149 HB2 LEU 21 1HB LEU 21 0.094 4.017 -1.581
150 HB3 LEU 21 2HB LEU 21 1.431 3.312 -2.505
151 HD11 LEU 21 1HD1 LEU 21 -0.708 2.491 0.464
152 HD12 LEU 21 2HD1 LEU 21 -0.173 0.893 -0.052
153 HD13 LEU 21 3HD1 LEU 21 -0.815 2.032 -1.234
154 HD21 LEU 21 3HD2 LEU 21 1.890 1.240 -2.151
155 HD22 LEU 21 1HD2 LEU 21 1.894 0.470 -0.565
156 HD23 LEU 21 2HD2 LEU 21 3.112 1.684 -0.958
157 H GLY 22 H GLY 22 1.306 6.762 -2.692
158 HA2 GLY 22 2HA GLY 22 3.454 6.260 -4.641
159 HA3 GLY 22 3HA GLY 22 1.962 7.131 -4.968
160 H ASN 23 H ASN 23 3.824 8.520 -5.913
161 HA ASN 23 HA ASN 23 5.021 10.454 -5.863
162 HB2 ASN 23 1HB ASN 23 2.719 11.137 -4.916
163 HB3 ASN 23 2HB ASN 23 3.536 11.185 -3.349
164 HD21 ASN 23 1HD2 ASN 23 4.506 12.170 -6.616
165 HD22 ASN 23 2HD2 ASN 23 4.910 13.795 -6.190
166 H LEU 24 H LEU 24 7.010 9.450 -5.390
167 HA LEU 24 HA LEU 24 8.286 10.403 -3.041
168 HG LEU 24 HG LEU 24 7.254 9.733 -1.204
169 HB2 LEU 24 1HB LEU 24 7.269 7.625 -3.088
170 HB3 LEU 24 2HB LEU 24 8.939 7.837 -2.535
171 HD11 LEU 24 1HD1 LEU 24 6.402 6.864 -0.859
172 HD12 LEU 24 2HD1 LEU 24 5.473 8.086 -1.726
173 HD13 LEU 24 3HD1 LEU 24 5.781 8.273 0.002
174 HD21 LEU 24 3HD2 LEU 24 8.320 8.922 0.705
175 HD22 LEU 24 1HD2 LEU 24 9.505 8.667 -0.577
176 HD23 LEU 24 2HD2 LEU 24 8.542 7.314 0.013
177 H SER 25 H SER 25 9.769 11.236 -4.487
178 HA SER 25 HA SER 25 11.065 9.631 -6.464
179 HG SER 25 HG SER 25 10.284 12.996 -5.663
180 HB2 SER 25 1HB SER 25 12.254 12.191 -5.438
181 HB3 SER 25 2HB SER 25 12.187 11.563 -7.096
182 H ASP 26 H ASP 26 11.801 10.624 -3.181
183 HA ASP 26 HA ASP 26 14.500 9.960 -3.058
184 HD2 ASP 26 HD ASP 26 15.269 8.923 1.086
185 HB2 ASP 26 1HB ASP 26 13.140 11.134 -1.285
186 HB3 ASP 26 2HB ASP 26 12.511 9.548 -0.821
187 H VAL 27 H VAL 27 11.642 7.922 -2.760
188 HA VAL 27 HA VAL 27 12.958 5.573 -1.910
189 HB VAL 27 HB VAL 27 10.385 5.840 -3.472
190 HG11 VAL 27 1HG1 VAL 27 11.564 3.524 -1.949
191 HG12 VAL 27 2HG1 VAL 27 9.884 3.603 -2.481
192 HG13 VAL 27 3HG1 VAL 27 11.187 3.598 -3.669
193 HG21 VAL 27 3HG2 VAL 27 10.733 5.453 -0.506
194 HG22 VAL 27 1HG2 VAL 27 10.513 7.032 -1.260
195 HG23 VAL 27 2HG2 VAL 27 9.248 5.811 -1.385
196 H ASN 28 H ASN 28 12.671 7.104 -4.994
197 HA ASN 28 HA ASN 28 13.055 4.899 -6.689
198 HB2 ASN 28 1HB ASN 28 12.392 7.266 -7.343
199 HB3 ASN 28 2HB ASN 28 14.104 7.686 -7.201
200 HD21 ASN 28 1HD2 ASN 28 15.219 7.607 -9.002
201 HD22 ASN 28 2HD2 ASN 28 14.864 6.630 -10.382
202 H GLN 29 H GLN 29 15.327 6.908 -4.907
203 HA GLN 29 HA GLN 29 17.666 5.823 -6.132
204 HB2 GLN 29 1HB GLN 29 17.033 7.738 -4.000
205 HB3 GLN 29 2HB GLN 29 18.507 6.803 -3.707
206 HG2 GLN 29 1HG GLN 29 19.038 7.469 -6.202
207 HG3 GLN 29 2HG GLN 29 17.915 8.785 -5.839
208 HE21 GLN 29 1HE2 GLN 29 20.954 7.303 -4.966
209 HE22 GLN 29 2HE2 GLN 29 21.608 8.670 -4.142
210 H ALA 30 H ALA 30 15.711 4.997 -3.353
211 HA ALA 30 HA ALA 30 17.521 3.282 -2.050
212 HB1 ALA 30 1HB ALA 30 15.355 4.207 -1.135
213 HB2 ALA 30 2HB ALA 30 14.531 2.948 -2.056
214 HB3 ALA 30 3HB ALA 30 15.676 2.507 -0.789
215 H SER 31 H SER 31 15.507 2.856 -4.850
216 HA SER 31 HA SER 31 15.269 0.088 -4.940
217 HG SER 31 HG SER 31 15.787 1.240 -8.568
218 HB2 SER 31 1HB SER 31 14.552 0.347 -7.114
219 HB3 SER 31 2HB SER 31 14.366 2.009 -6.527
220 H ARG 32 H ARG 32 18.035 2.089 -5.404
221 HA ARG 32 HA ARG 32 19.594 0.293 -6.954
222 HE ARG 32 HE ARG 32 23.111 1.602 -4.958
223 HB2 ARG 32 1HB ARG 32 19.887 2.866 -6.367
224 HB3 ARG 32 2HB ARG 32 20.894 2.204 -5.072
225 HG2 ARG 32 1HG ARG 32 22.009 0.839 -7.000
226 HG3 ARG 32 2HG ARG 32 21.312 2.109 -8.019
227 HD2 ARG 32 1HD ARG 32 23.532 2.793 -7.469
228 HD3 ARG 32 2HD ARG 32 22.413 3.798 -6.534
229 HH11 ARG 32 1HH1 ARG 32 24.597 4.420 -6.361
230 HH12 ARG 32 2HH1 ARG 32 25.795 4.568 -5.120
231 HH21 ARG 32 1HH2 ARG 32 24.686 1.786 -3.317
232 HH22 ARG 32 2HH2 ARG 32 25.844 3.069 -3.389
233 H ILE 33 H ILE 33 18.649 0.312 -3.687
234 HA ILE 33 HA ILE 33 20.500 -1.895 -3.136
235 HB ILE 33 HB ILE 33 19.874 0.121 -0.999
236 HG12 ILE 33 1HG1 ILE 33 22.416 0.740 -1.591
237 HG13 ILE 33 2HG1 ILE 33 21.854 0.299 -3.211
238 HG21 ILE 33 1HG2 ILE 33 21.448 -2.313 -1.243
239 HG22 ILE 33 2HG2 ILE 33 22.358 -0.970 -0.552
240 HG23 ILE 33 3HG2 ILE 33 20.847 -1.491 0.197
241 HD11 ILE 33 3HD1 ILE 33 20.930 2.532 -1.456
242 HD12 ILE 33 1HD1 ILE 33 21.481 2.579 -3.130
243 HD13 ILE 33 2HD1 ILE 33 19.898 1.903 -2.741
244 H ASN 34 H ASN 34 17.486 -1.285 -3.649
245 HA ASN 34 HA ASN 34 16.453 -2.768 -1.324
246 HB2 ASN 34 1HB ASN 34 15.380 -0.542 -2.935
247 HB3 ASN 34 2HB ASN 34 14.219 -1.828 -2.587
248 HD21 ASN 34 1HD2 ASN 34 16.614 0.233 -0.999
249 HD22 ASN 34 2HD2 ASN 34 15.747 0.394 0.487
250 H ARG 35 H ARG 35 16.834 -2.741 -4.765
251 HA ARG 35 HA ARG 35 14.900 -4.628 -5.506
252 HE ARG 35 HE ARG 35 17.547 -5.259 -10.276
253 HB2 ARG 35 1HB ARG 35 16.716 -3.129 -6.848
254 HB3 ARG 35 2HB ARG 35 17.479 -4.724 -6.946
255 HG2 ARG 35 1HG ARG 35 15.551 -5.666 -8.020
256 HG3 ARG 35 2HG ARG 35 14.642 -4.163 -7.777
257 HD2 ARG 35 1HD ARG 35 15.349 -3.487 -9.782
258 HD3 ARG 35 2HD ARG 35 16.975 -3.388 -9.094
259 HH11 ARG 35 1HH1 ARG 35 14.076 -5.031 -10.131
260 HH12 ARG 35 2HH1 ARG 35 13.813 -6.346 -11.226
261 HH21 ARG 35 1HH2 ARG 35 17.213 -6.995 -11.720
262 HH22 ARG 35 2HH2 ARG 35 15.598 -7.464 -12.127
263 H LYS 36 H LYS 36 17.969 -4.982 -3.932
264 HA LYS 36 HA LYS 36 18.130 -7.832 -4.424
265 HB2 LYS 36 1HB LYS 36 19.790 -5.971 -2.710
266 HB3 LYS 36 2HB LYS 36 20.121 -7.699 -2.913
267 HG2 LYS 36 1HG LYS 36 19.869 -6.593 -5.507
268 HG3 LYS 36 2HG LYS 36 20.920 -5.522 -4.562
269 HD2 LYS 36 1HD LYS 36 21.333 -8.496 -4.496
270 HD3 LYS 36 2HD LYS 36 21.969 -7.523 -5.835
271 HE2 LYS 36 1HE LYS 36 23.006 -6.028 -4.014
272 HE3 LYS 36 2HE LYS 36 22.665 -7.374 -2.919
273 HZ1 LYS 36 3HZ LYS 36 24.534 -8.313 -3.598
274 HZ2 LYS 36 1HZ LYS 36 24.801 -7.084 -4.730
275 HZ3 LYS 36 2HZ LYS 36 23.902 -8.451 -5.161
276 H LYS 37 H LYS 37 15.769 -7.615 -3.351
277 HA LYS 37 HA LYS 37 16.096 -8.295 -0.501
278 HB2 LYS 37 1HB LYS 37 14.692 -6.224 -1.236
279 HB3 LYS 37 2HB LYS 37 13.476 -7.435 -1.683
280 HG2 LYS 37 1HG LYS 37 12.804 -6.946 0.446
281 HG3 LYS 37 2HG LYS 37 13.896 -8.309 0.750
282 HD2 LYS 37 1HD LYS 37 14.608 -6.776 2.333
283 HD3 LYS 37 2HD LYS 37 15.716 -6.463 0.985
284 HE2 LYS 37 1HE LYS 37 14.270 -4.606 0.237
285 HE3 LYS 37 2HE LYS 37 13.209 -4.907 1.621
286 HZ1 LYS 37 3HZ LYS 37 14.518 -3.299 2.502
287 HZ2 LYS 37 1HZ LYS 37 15.862 -3.690 1.550
288 HZ3 LYS 37 2HZ LYS 37 15.482 -4.631 2.905
289 H LYS 38 H LYS 38 16.609 -10.278 -2.263
290 HA LYS 38 HA LYS 38 14.152 -11.889 -2.371
291 HB2 LYS 38 1HB LYS 38 16.782 -12.295 -3.817
292 HB3 LYS 38 2HB LYS 38 15.326 -13.285 -4.010
293 HG2 LYS 38 1HG LYS 38 14.431 -10.708 -4.497
294 HG3 LYS 38 2HG LYS 38 16.031 -10.767 -5.254
295 HD2 LYS 38 1HD LYS 38 15.385 -12.819 -6.458
296 HD3 LYS 38 2HD LYS 38 13.774 -12.715 -5.725
297 HE2 LYS 38 1HE LYS 38 13.564 -11.782 -7.895
298 HE3 LYS 38 2HE LYS 38 13.573 -10.423 -6.762
299 HZ1 LYS 38 3HZ LYS 38 15.000 -9.830 -8.514
300 HZ2 LYS 38 1HZ LYS 38 15.778 -11.333 -8.516
301 HZ3 LYS 38 2HZ LYS 38 16.024 -10.254 -7.236
302 H HIS 39 H HIS 39 17.368 -11.711 -1.052
303 HA HIS 39 HA HIS 39 17.521 -14.415 -0.162
304 HD1 HIS 39 1HD HIS 39 21.693 -13.082 1.194
305 HD2 HIS 39 2HD HIS 39 18.521 -15.753 1.458
306 HE1 HIS 39 1HE HIS 39 22.639 -15.144 2.279
307 HE2 HIS 39 2HE HIS 39 20.701 -16.776 2.442
308 HB2 HIS 39 1HB HIS 39 19.435 -12.722 -0.507
309 HB3 HIS 39 2HB HIS 39 19.002 -12.111 1.090
Start of MODEL 4
1 H1 GLY 1 H GLY 1 -28.136 1.887 6.748
2 HA2 GLY 1 2HA GLY 1 -28.056 2.618 9.608
3 HA3 GLY 1 3HA GLY 1 -26.972 1.405 8.944
4 H THR 2 H THR 2 -26.382 3.961 10.277
5 HA THR 2 HA THR 2 -25.552 5.927 8.464
6 HB THR 2 HB THR 2 -23.869 6.522 10.323
7 HG1 THR 2 1HG THR 2 -24.056 4.276 11.200
8 HG21 THR 2 3HG2 THR 2 -25.802 7.195 11.873
9 HG22 THR 2 1HG2 THR 2 -26.854 6.439 10.676
10 HG23 THR 2 2HG2 THR 2 -25.831 7.803 10.219
11 H TRP 3 H TRP 3 -24.271 2.829 9.112
12 HA TRP 3 HA TRP 3 -21.560 3.092 8.697
13 HD1 TRP 3 HD TRP 3 -24.966 0.487 9.554
14 HE1 TRP 3 1HE TRP 3 -24.679 -0.225 12.012
15 HE3 TRP 3 3HE TRP 3 -19.903 1.056 9.977
16 HZ2 TRP 3 2HZ TRP 3 -22.583 -0.507 13.881
17 HZ3 TRP 3 3HZ TRP 3 -18.834 0.545 12.134
18 HH2 TRP 3 HH TRP 3 -20.149 -0.220 14.045
19 HB2 TRP 3 1HB TRP 3 -23.288 0.877 7.559
20 HB3 TRP 3 2HB TRP 3 -21.566 0.789 7.935
21 H ASP 4 H ASP 4 -24.157 3.377 6.397
22 HA ASP 4 HA ASP 4 -22.703 3.042 4.018
23 HD2 ASP 4 HD ASP 4 -24.488 2.592 1.071
24 HB2 ASP 4 1HB ASP 4 -25.345 3.802 4.771
25 HB3 ASP 4 2HB ASP 4 -24.737 5.009 3.629
26 H ASP 5 H ASP 5 -23.501 5.991 5.838
27 HA ASP 5 HA ASP 5 -21.922 7.655 4.104
28 HD2 ASP 5 HD ASP 5 -23.618 10.152 3.052
29 HB2 ASP 5 1HB ASP 5 -23.715 8.029 6.410
30 HB3 ASP 5 2HB ASP 5 -22.365 9.170 6.344
31 H ILE 6 H ILE 6 -21.592 6.385 7.399
32 HA ILE 6 HA ILE 6 -19.161 7.634 8.027
33 HB ILE 6 HB ILE 6 -20.137 4.953 9.020
34 HG12 ILE 6 1HG1 ILE 6 -20.533 7.683 10.263
35 HG13 ILE 6 2HG1 ILE 6 -21.760 6.866 9.280
36 HG21 ILE 6 1HG2 ILE 6 -17.767 6.477 9.543
37 HG22 ILE 6 2HG2 ILE 6 -18.738 6.354 11.008
38 HG23 ILE 6 3HG2 ILE 6 -18.233 4.894 10.161
39 HD11 ILE 6 3HD1 ILE 6 -22.188 6.578 11.659
40 HD12 ILE 6 1HD1 ILE 6 -21.859 5.036 10.872
41 HD13 ILE 6 2HD1 ILE 6 -20.613 5.811 11.853
42 H GLY 7 H GLY 7 -19.887 4.811 6.121
43 HA2 GLY 7 2HA GLY 7 -17.191 3.796 6.128
44 HA3 GLY 7 3HA GLY 7 -18.517 3.233 5.121
45 H GLN 8 H GLN 8 -19.003 6.054 4.211
46 HA GLN 8 HA GLN 8 -17.511 5.948 1.835
47 HB2 GLN 8 1HB GLN 8 -19.154 8.103 3.147
48 HB3 GLN 8 2HB GLN 8 -18.307 8.392 1.620
49 HG2 GLN 8 1HG GLN 8 -19.651 5.994 1.208
50 HG3 GLN 8 2HG GLN 8 -20.788 6.998 2.119
51 HE21 GLN 8 1HE2 GLN 8 -21.490 8.964 1.238
52 HE22 GLN 8 2HE2 GLN 8 -21.363 9.292 -0.453
53 H GLY 9 H GLY 9 -16.865 7.425 4.919
54 HA2 GLY 9 2HA GLY 9 -14.757 9.132 3.949
55 HA3 GLY 9 3HA GLY 9 -15.158 8.819 5.630
56 H ILE 10 H ILE 10 -14.622 6.491 6.338
57 HA ILE 10 HA ILE 10 -11.885 6.129 6.294
58 HB ILE 10 HB ILE 10 -13.966 3.980 6.711
59 HG12 ILE 10 1HG1 ILE 10 -12.587 5.801 8.701
60 HG13 ILE 10 2HG1 ILE 10 -14.275 5.941 8.178
61 HG21 ILE 10 1HG2 ILE 10 -11.753 3.050 6.337
62 HG22 ILE 10 2HG2 ILE 10 -11.077 4.122 7.562
63 HG23 ILE 10 3HG2 ILE 10 -12.220 2.861 8.028
64 HD11 ILE 10 3HD1 ILE 10 -13.056 4.113 10.115
65 HD12 ILE 10 1HD1 ILE 10 -14.696 4.753 10.026
66 HD13 ILE 10 2HD1 ILE 10 -14.232 3.377 9.026
67 H GLY 11 H GLY 11 -14.291 5.022 4.025
68 HA2 GLY 11 2HA GLY 11 -12.788 3.006 2.748
69 HA3 GLY 11 3HA GLY 11 -14.126 3.893 2.032
70 H ARG 12 H ARG 12 -13.253 6.422 1.851
71 HA ARG 12 HA ARG 12 -11.341 6.247 -0.283
72 HE ARG 12 HE ARG 12 -14.616 6.441 -2.687
73 HB2 ARG 12 1HB ARG 12 -12.731 8.608 1.001
74 HB3 ARG 12 2HB ARG 12 -11.673 8.726 -0.413
75 HG2 ARG 12 1HG ARG 12 -13.900 6.780 -0.586
76 HG3 ARG 12 2HG ARG 12 -14.323 8.500 -0.601
77 HD2 ARG 12 1HD ARG 12 -13.387 8.868 -2.634
78 HD3 ARG 12 2HD ARG 12 -12.076 7.718 -2.342
79 HH11 ARG 12 1HH1 ARG 12 -11.875 7.806 -4.344
80 HH12 ARG 12 2HH1 ARG 12 -12.105 6.858 -5.776
81 HH21 ARG 12 1HH2 ARG 12 -14.929 5.189 -4.568
82 HH22 ARG 12 2HH2 ARG 12 -13.844 5.371 -5.903
83 H VAL 13 H VAL 13 -11.324 7.283 3.058
84 HA VAL 13 HA VAL 13 -8.829 8.642 2.984
85 HB VAL 13 HB VAL 13 -10.249 7.379 5.331
86 HG11 VAL 13 1HG1 VAL 13 -8.874 8.857 6.710
87 HG12 VAL 13 2HG1 VAL 13 -7.876 7.739 5.777
88 HG13 VAL 13 3HG1 VAL 13 -8.028 9.420 5.269
89 HG21 VAL 13 3HG2 VAL 13 -10.276 10.264 5.205
90 HG22 VAL 13 1HG2 VAL 13 -11.006 9.552 3.766
91 HG23 VAL 13 2HG2 VAL 13 -11.620 9.134 5.365
92 H ALA 14 H ALA 14 -9.788 5.326 3.735
93 HA ALA 14 HA ALA 14 -7.410 4.339 4.749
94 HB1 ALA 14 1HB ALA 14 -9.454 3.039 4.748
95 HB2 ALA 14 2HB ALA 14 -9.412 2.928 2.988
96 HB3 ALA 14 3HB ALA 14 -8.165 2.136 3.952
97 H TYR 15 H TYR 15 -8.296 5.047 1.439
98 HA TYR 15 HA TYR 15 -6.097 3.671 0.242
99 HD1 TYR 15 2HD TYR 15 -6.711 2.802 -2.515
100 HD2 TYR 15 1HD TYR 15 -6.256 7.021 -2.214
101 HE1 TYR 15 2HE TYR 15 -5.394 2.802 -4.593
102 HE2 TYR 15 1HE TYR 15 -4.940 7.034 -4.292
103 HH TYR 15 HH TYR 15 -4.860 4.503 -6.431
104 HB2 TYR 15 1HB TYR 15 -8.148 4.131 -1.012
105 HB3 TYR 15 2HB TYR 15 -7.870 5.866 -0.852
106 H TRP 16 H TRP 16 -6.601 6.852 1.566
107 HA TRP 16 HA TRP 16 -4.248 8.002 0.380
108 HD1 TRP 16 HD TRP 16 -7.893 9.191 0.184
109 HE1 TRP 16 1HE TRP 16 -7.911 10.934 -1.710
110 HE3 TRP 16 3HE TRP 16 -3.238 11.188 0.874
111 HZ2 TRP 16 2HZ TRP 16 -6.181 12.894 -2.772
112 HZ3 TRP 16 3HZ TRP 16 -2.495 12.993 -0.624
113 HH2 TRP 16 HH TRP 16 -3.938 13.828 -2.409
114 HB2 TRP 16 1HB TRP 16 -6.321 8.888 2.344
115 HB3 TRP 16 2HB TRP 16 -4.777 9.739 2.325
116 H VAL 17 H VAL 17 -5.136 6.759 3.579
117 HA VAL 17 HA VAL 17 -2.654 7.335 4.816
118 HB VAL 17 HB VAL 17 -4.681 6.922 6.126
119 HG11 VAL 17 1HG1 VAL 17 -5.680 4.771 6.336
120 HG12 VAL 17 2HG1 VAL 17 -5.551 5.120 4.610
121 HG13 VAL 17 3HG1 VAL 17 -4.406 4.018 5.375
122 HG21 VAL 17 3HG2 VAL 17 -2.105 5.781 6.602
123 HG22 VAL 17 1HG2 VAL 17 -3.254 6.453 7.759
124 HG23 VAL 17 2HG2 VAL 17 -3.340 4.747 7.321
125 H GLY 18 H GLY 18 -3.876 4.575 3.015
126 HA2 GLY 18 2HA GLY 18 -1.841 2.739 3.685
127 HA3 GLY 18 3HA GLY 18 -2.849 2.671 2.247
128 H LYS 19 H LYS 19 -2.122 5.026 0.986
129 HA LYS 19 HA LYS 19 0.353 4.246 -0.203
130 HB2 LYS 19 1HB LYS 19 0.061 6.270 -1.600
131 HB3 LYS 19 2HB LYS 19 -1.379 5.240 -1.573
132 HG2 LYS 19 1HG LYS 19 -2.415 6.728 0.083
133 HG3 LYS 19 2HG LYS 19 -0.985 7.771 0.011
134 HD2 LYS 19 1HD LYS 19 -2.754 7.107 -2.352
135 HD3 LYS 19 2HD LYS 19 -2.857 8.592 -1.389
136 HE2 LYS 19 1HE LYS 19 -0.436 9.020 -1.959
137 HE3 LYS 19 2HE LYS 19 -0.552 7.665 -3.092
138 HZ1 LYS 19 3HZ LYS 19 -2.497 8.913 -4.092
139 HZ2 LYS 19 1HZ LYS 19 -0.961 9.569 -4.359
140 HZ3 LYS 19 2HZ LYS 19 -1.982 10.252 -3.196
141 H ALA 20 H ALA 20 -0.620 6.641 2.150
142 HA ALA 20 HA ALA 20 1.741 8.205 2.087
143 HB1 ALA 20 1HB ALA 20 0.906 9.312 3.960
144 HB2 ALA 20 2HB ALA 20 -0.545 8.776 3.111
145 HB3 ALA 20 3HB ALA 20 0.027 7.891 4.525
146 H LEU 21 H LEU 21 0.830 5.276 3.780
147 HA LEU 21 HA LEU 21 3.277 5.312 5.365
148 HG LEU 21 HG LEU 21 0.712 4.050 7.713
149 HB2 LEU 21 1HB LEU 21 0.760 3.710 5.359
150 HB3 LEU 21 2HB LEU 21 2.227 2.984 6.041
151 HD11 LEU 21 1HD1 LEU 21 3.577 4.548 7.362
152 HD12 LEU 21 2HD1 LEU 21 2.695 3.896 8.743
153 HD13 LEU 21 3HD1 LEU 21 2.773 5.639 8.492
154 HD21 LEU 21 3HD2 LEU 21 0.221 6.273 7.731
155 HD22 LEU 21 1HD2 LEU 21 0.356 6.033 5.989
156 HD23 LEU 21 2HD2 LEU 21 1.705 6.724 6.890
157 H GLY 22 H GLY 22 1.849 3.657 2.627
158 HA2 GLY 22 2HA GLY 22 2.867 2.399 0.981
159 HA3 GLY 22 3HA GLY 22 4.412 2.739 1.748
160 H ASN 23 H ASN 23 2.079 0.394 1.125
161 HA ASN 23 HA ASN 23 2.892 -1.328 3.336
162 HB2 ASN 23 1HB ASN 23 0.836 -1.698 1.140
163 HB3 ASN 23 2HB ASN 23 1.171 -2.888 2.404
164 HD21 ASN 23 1HD2 ASN 23 0.335 -2.625 4.406
165 HD22 ASN 23 2HD2 ASN 23 -0.717 -1.329 4.850
166 H LEU 24 H LEU 24 5.002 -0.786 1.691
167 HA LEU 24 HA LEU 24 5.883 -3.363 0.964
168 HG LEU 24 HG LEU 24 5.410 -0.372 -1.153
169 HB2 LEU 24 1HB LEU 24 6.209 -2.889 -1.489
170 HB3 LEU 24 2HB LEU 24 4.546 -3.211 -0.970
171 HD11 LEU 24 1HD1 LEU 24 4.355 -1.450 -3.656
172 HD12 LEU 24 2HD1 LEU 24 5.987 -1.994 -3.269
173 HD13 LEU 24 3HD1 LEU 24 5.634 -0.270 -3.376
174 HD21 LEU 24 3HD2 LEU 24 2.976 -0.582 -2.298
175 HD22 LEU 24 1HD2 LEU 24 3.235 -0.349 -0.569
176 HD23 LEU 24 2HD2 LEU 24 2.936 -1.966 -1.206
177 H SER 25 H SER 25 6.760 -1.112 2.507
178 HA SER 25 HA SER 25 8.892 0.197 1.097
179 HG SER 25 HG SER 25 9.242 2.006 1.994
180 HB2 SER 25 1HB SER 25 7.581 0.450 3.651
181 HB3 SER 25 2HB SER 25 9.338 0.411 3.878
182 H ASP 26 H ASP 26 8.519 -2.863 2.369
183 HA ASP 26 HA ASP 26 11.269 -3.210 3.227
184 HD2 ASP 26 HD ASP 26 7.160 -4.241 5.199
185 HB2 ASP 26 1HB ASP 26 9.299 -5.450 2.823
186 HB3 ASP 26 2HB ASP 26 10.642 -5.345 3.969
187 H VAL 27 H VAL 27 10.013 -2.819 0.318
188 HA VAL 27 HA VAL 27 12.081 -4.403 -0.964
189 HB VAL 27 HB VAL 27 9.173 -4.743 -1.705
190 HG11 VAL 27 1HG1 VAL 27 11.644 -5.155 -3.205
191 HG12 VAL 27 2HG1 VAL 27 10.604 -6.579 -3.151
192 HG13 VAL 27 3HG1 VAL 27 9.979 -5.050 -3.771
193 HG21 VAL 27 3HG2 VAL 27 11.201 -6.600 -0.478
194 HG22 VAL 27 1HG2 VAL 27 9.644 -6.098 0.182
195 HG23 VAL 27 2HG2 VAL 27 9.704 -7.164 -1.221
196 H ASN 28 H ASN 28 9.363 -2.169 -1.341
197 HA ASN 28 HA ASN 28 10.075 -1.194 -3.889
198 HB2 ASN 28 1HB ASN 28 7.841 -0.872 -2.925
199 HB3 ASN 28 2HB ASN 28 8.527 0.172 -1.677
200 HD21 ASN 28 1HD2 ASN 28 8.156 2.224 -2.037
201 HD22 ASN 28 2HD2 ASN 28 8.119 3.004 -3.579
202 H GLN 29 H GLN 29 11.225 -0.480 -0.694
203 HA GLN 29 HA GLN 29 12.462 2.016 -1.362
204 HB2 GLN 29 1HB GLN 29 11.830 0.728 0.985
205 HB3 GLN 29 2HB GLN 29 13.591 0.559 0.917
206 HG2 GLN 29 1HG GLN 29 13.739 3.033 0.548
207 HG3 GLN 29 2HG GLN 29 12.001 3.109 0.876
208 HE21 GLN 29 1HE2 GLN 29 12.086 4.265 2.735
209 HE22 GLN 29 2HE2 GLN 29 12.802 3.688 4.198
210 H ALA 30 H ALA 30 13.358 -1.325 -1.555
211 HA ALA 30 HA ALA 30 16.158 -1.063 -1.608
212 HB1 ALA 30 1HB ALA 30 16.220 -3.270 -2.453
213 HB2 ALA 30 2HB ALA 30 14.824 -3.196 -1.378
214 HB3 ALA 30 3HB ALA 30 14.594 -3.137 -3.125
215 H SER 31 H SER 31 13.715 -0.447 -3.998
216 HA SER 31 HA SER 31 15.189 -0.625 -6.350
217 HG SER 31 HG SER 31 12.834 1.990 -5.076
218 HB2 SER 31 1HB SER 31 13.436 0.456 -7.382
219 HB3 SER 31 2HB SER 31 12.645 -0.050 -5.878
220 H ARG 32 H ARG 32 15.364 1.679 -3.793
221 HA ARG 32 HA ARG 32 16.523 3.825 -5.247
222 HE ARG 32 HE ARG 32 18.637 5.177 -2.050
223 HB2 ARG 32 1HB ARG 32 15.575 3.464 -2.684
224 HB3 ARG 32 2HB ARG 32 17.320 3.620 -2.439
225 HG2 ARG 32 1HG ARG 32 15.581 5.597 -3.919
226 HG3 ARG 32 2HG ARG 32 16.167 5.771 -2.255
227 HD2 ARG 32 1HD ARG 32 17.905 5.555 -4.725
228 HD3 ARG 32 2HD ARG 32 17.541 7.041 -3.836
229 HH11 ARG 32 1HH1 ARG 32 19.565 7.110 -4.793
230 HH12 ARG 32 2HH1 ARG 32 21.222 7.242 -4.306
231 HH21 ARG 32 1HH2 ARG 32 20.816 5.345 -1.396
232 HH22 ARG 32 2HH2 ARG 32 21.933 6.234 -2.373
233 H ILE 33 H ILE 33 17.722 0.814 -4.214
234 HA ILE 33 HA ILE 33 20.436 1.633 -4.965
235 HB ILE 33 HB ILE 33 20.012 -0.284 -2.693
236 HG12 ILE 33 1HG1 ILE 33 20.816 1.917 -1.390
237 HG13 ILE 33 2HG1 ILE 33 19.874 2.687 -2.679
238 HG21 ILE 33 1HG2 ILE 33 22.260 0.811 -4.124
239 HG22 ILE 33 2HG2 ILE 33 22.375 1.164 -2.401
240 HG23 ILE 33 3HG2 ILE 33 22.208 -0.503 -2.948
241 HD11 ILE 33 3HD1 ILE 33 18.938 0.844 -0.522
242 HD12 ILE 33 1HD1 ILE 33 18.329 2.434 -0.978
243 HD13 ILE 33 2HD1 ILE 33 18.013 1.041 -2.011
244 H ASN 34 H ASN 34 18.019 -0.062 -5.961
245 HA ASN 34 HA ASN 34 19.559 -2.496 -6.574
246 HB2 ASN 34 1HB ASN 34 16.718 -2.014 -5.937
247 HB3 ASN 34 2HB ASN 34 16.994 -3.103 -7.303
248 HD21 ASN 34 1HD2 ASN 34 18.104 -2.531 -3.988
249 HD22 ASN 34 2HD2 ASN 34 18.271 -4.200 -3.572
250 H ARG 35 H ARG 35 17.906 0.250 -7.879
251 HA ARG 35 HA ARG 35 17.472 -0.585 -10.506
252 HE ARG 35 HE ARG 35 15.308 3.837 -13.140
253 HB2 ARG 35 1HB ARG 35 16.803 1.613 -9.266
254 HB3 ARG 35 2HB ARG 35 18.349 2.214 -9.885
255 HG2 ARG 35 1HG ARG 35 17.653 1.780 -12.170
256 HG3 ARG 35 2HG ARG 35 16.127 1.097 -11.583
257 HD2 ARG 35 1HD ARG 35 15.272 3.153 -10.962
258 HD3 ARG 35 2HD ARG 35 16.879 3.863 -10.762
259 HH11 ARG 35 1HH1 ARG 35 18.578 3.787 -11.944
260 HH12 ARG 35 2HH1 ARG 35 19.250 4.502 -13.374
261 HH21 ARG 35 1HH2 ARG 35 16.180 4.776 -15.027
262 HH22 ARG 35 2HH2 ARG 35 17.885 5.062 -15.125
263 H LYS 36 H LYS 36 20.389 0.332 -8.863
264 HA LYS 36 HA LYS 36 21.916 0.655 -11.300
265 HB2 LYS 36 1HB LYS 36 22.589 0.726 -8.365
266 HB3 LYS 36 2HB LYS 36 23.856 0.730 -9.603
267 HG2 LYS 36 1HG LYS 36 21.656 2.727 -9.826
268 HG3 LYS 36 2HG LYS 36 22.913 2.970 -8.600
269 HD2 LYS 36 1HD LYS 36 24.024 2.213 -11.188
270 HD3 LYS 36 2HD LYS 36 23.066 3.700 -11.263
271 HE2 LYS 36 1HE LYS 36 24.396 4.770 -9.610
272 HE3 LYS 36 2HE LYS 36 25.181 3.245 -9.173
273 HZ1 LYS 36 3HZ LYS 36 26.462 4.864 -10.642
274 HZ2 LYS 36 1HZ LYS 36 25.441 4.364 -11.894
275 HZ3 LYS 36 2HZ LYS 36 26.436 3.240 -11.114
276 H LYS 37 H LYS 37 21.319 -1.813 -8.897
277 HA LYS 37 HA LYS 37 21.872 -4.015 -8.779
278 HB2 LYS 37 1HB LYS 37 21.897 -3.397 -11.678
279 HB3 LYS 37 2HB LYS 37 22.711 -4.892 -11.193
280 HG2 LYS 37 1HG LYS 37 19.929 -4.285 -10.246
281 HG3 LYS 37 2HG LYS 37 20.226 -4.990 -11.845
282 HD2 LYS 37 1HD LYS 37 21.337 -6.896 -10.874
283 HD3 LYS 37 2HD LYS 37 21.257 -6.162 -9.263
284 HE2 LYS 37 1HE LYS 37 19.513 -7.776 -9.348
285 HE3 LYS 37 2HE LYS 37 18.749 -6.188 -9.491
286 HZ1 LYS 37 3HZ LYS 37 17.923 -7.917 -11.073
287 HZ2 LYS 37 1HZ LYS 37 19.431 -7.864 -11.839
288 HZ3 LYS 37 2HZ LYS 37 18.451 -6.485 -11.804
289 H LYS 38 H LYS 38 23.677 -3.406 -7.426
290 HA LYS 38 HA LYS 38 26.299 -3.325 -8.694
291 HB2 LYS 38 1HB LYS 38 25.516 -3.103 -5.777
292 HB3 LYS 38 2HB LYS 38 27.141 -2.845 -6.434
293 HG2 LYS 38 1HG LYS 38 24.756 -1.209 -7.281
294 HG3 LYS 38 2HG LYS 38 25.812 -0.770 -5.926
295 HD2 LYS 38 1HD LYS 38 27.287 -1.437 -8.364
296 HD3 LYS 38 2HD LYS 38 26.193 -0.056 -8.553
297 HE2 LYS 38 1HE LYS 38 28.254 -0.346 -6.354
298 HE3 LYS 38 2HE LYS 38 28.462 0.605 -7.831
299 HZ1 LYS 38 3HZ LYS 38 26.950 1.219 -5.448
300 HZ2 LYS 38 1HZ LYS 38 26.141 1.564 -6.892
301 HZ3 LYS 38 2HZ LYS 38 27.653 2.257 -6.582
302 H HIS 39 H HIS 39 24.295 -5.454 -6.784
303 HA HIS 39 HA HIS 39 24.556 -7.600 -6.062
304 HD1 HIS 39 1HD HIS 39 23.146 -9.469 -8.311
305 HD2 HIS 39 2HD HIS 39 26.917 -10.582 -6.970
306 HE1 HIS 39 1HE HIS 39 22.992 -11.934 -7.841
307 HE2 HIS 39 2HE HIS 39 25.296 -12.616 -7.020
308 HB2 HIS 39 1HB HIS 39 24.926 -7.654 -8.670
309 HB3 HIS 39 2HB HIS 39 26.583 -8.063 -8.217
Start of MODEL 5
1 H1 GLY 1 H GLY 1 -11.967 -5.530 14.631
2 HA2 GLY 1 2HA GLY 1 -12.441 -5.563 12.365
3 HA3 GLY 1 3HA GLY 1 -14.035 -5.111 12.951
4 H THR 2 H THR 2 -11.072 -3.180 13.007
5 HA THR 2 HA THR 2 -12.319 -0.840 12.108
6 HB THR 2 HB THR 2 -9.912 -0.118 11.542
7 HG1 THR 2 1HG THR 2 -9.249 -2.439 11.427
8 HG21 THR 2 3HG2 THR 2 -10.848 -0.970 14.268
9 HG22 THR 2 1HG2 THR 2 -10.802 0.651 13.573
10 HG23 THR 2 2HG2 THR 2 -9.302 -0.155 14.036
11 H TRP 3 H TRP 3 -11.270 -3.592 10.382
12 HA TRP 3 HA TRP 3 -10.499 -2.623 7.922
13 HD1 TRP 3 HD TRP 3 -11.215 -6.072 10.514
14 HE1 TRP 3 1HE TRP 3 -8.883 -7.025 11.040
15 HE3 TRP 3 3HE TRP 3 -8.692 -4.352 6.413
16 HZ2 TRP 3 2HZ TRP 3 -6.313 -7.044 9.872
17 HZ3 TRP 3 3HZ TRP 3 -6.299 -4.881 6.193
18 HH2 TRP 3 HH TRP 3 -5.136 -6.199 7.888
19 HB2 TRP 3 1HB TRP 3 -12.312 -5.010 8.361
20 HB3 TRP 3 2HB TRP 3 -11.250 -4.731 6.982
21 H ASP 4 H ASP 4 -13.671 -2.663 9.357
22 HA ASP 4 HA ASP 4 -15.227 -2.304 7.046
23 HD2 ASP 4 HD ASP 4 -18.235 -3.459 7.227
24 HB2 ASP 4 1HB ASP 4 -15.742 -2.574 9.731
25 HB3 ASP 4 2HB ASP 4 -16.177 -0.884 9.437
26 H ASP 5 H ASP 5 -13.838 0.082 9.289
27 HA ASP 5 HA ASP 5 -14.710 2.303 7.683
28 HD2 ASP 5 HD ASP 5 -15.339 5.363 9.777
29 HB2 ASP 5 1HB ASP 5 -13.564 1.900 10.309
30 HB3 ASP 5 2HB ASP 5 -12.709 3.188 9.449
31 H ILE 6 H ILE 6 -11.612 0.708 8.351
32 HA ILE 6 HA ILE 6 -9.991 2.412 6.824
33 HB ILE 6 HB ILE 6 -9.565 -0.534 7.324
34 HG12 ILE 6 1HG1 ILE 6 -8.538 1.818 8.925
35 HG13 ILE 6 2HG1 ILE 6 -9.964 0.872 9.378
36 HG21 ILE 6 1HG2 ILE 6 -8.063 1.426 5.877
37 HG22 ILE 6 2HG2 ILE 6 -7.142 0.887 7.280
38 HG23 ILE 6 3HG2 ILE 6 -7.726 -0.290 6.105
39 HD11 ILE 6 3HD1 ILE 6 -7.576 0.349 10.371
40 HD12 ILE 6 1HD1 ILE 6 -8.750 -0.925 10.043
41 HD13 ILE 6 2HD1 ILE 6 -7.447 -0.611 8.897
42 H GLY 7 H GLY 7 -12.093 -0.211 5.913
43 HA2 GLY 7 2HA GLY 7 -10.978 -0.533 3.278
44 HA3 GLY 7 3HA GLY 7 -12.465 -1.253 3.879
45 H GLN 8 H GLN 8 -13.535 1.368 4.714
46 HA GLN 8 HA GLN 8 -14.773 2.053 2.221
47 HB2 GLN 8 1HB GLN 8 -16.098 2.071 4.241
48 HB3 GLN 8 2HB GLN 8 -15.012 3.256 4.983
49 HG2 GLN 8 1HG GLN 8 -16.990 4.392 4.281
50 HG3 GLN 8 2HG GLN 8 -15.655 4.882 3.230
51 HE21 GLN 8 1HE2 GLN 8 -16.863 5.457 1.487
52 HE22 GLN 8 2HE2 GLN 8 -17.782 4.338 0.546
53 H GLY 9 H GLY 9 -12.090 3.220 4.037
54 HA2 GLY 9 2HA GLY 9 -12.062 5.769 2.592
55 HA3 GLY 9 3HA GLY 9 -11.027 5.338 3.945
56 H ILE 10 H ILE 10 -10.001 2.921 3.090
57 HA ILE 10 HA ILE 10 -7.859 3.713 1.489
58 HB ILE 10 HB ILE 10 -7.865 1.733 3.007
59 HG12 ILE 10 1HG1 ILE 10 -6.959 0.319 0.707
60 HG13 ILE 10 2HG1 ILE 10 -6.622 2.039 0.453
61 HG21 ILE 10 1HG2 ILE 10 -8.954 -0.236 2.530
62 HG22 ILE 10 2HG2 ILE 10 -10.118 0.949 1.940
63 HG23 ILE 10 3HG2 ILE 10 -9.059 0.115 0.805
64 HD11 ILE 10 3HD1 ILE 10 -4.704 1.123 1.472
65 HD12 ILE 10 1HD1 ILE 10 -5.532 2.059 2.715
66 HD13 ILE 10 2HD1 ILE 10 -5.662 0.300 2.702
67 H GLY 11 H GLY 11 -11.034 2.770 0.610
68 HA2 GLY 11 2HA GLY 11 -10.724 1.604 -1.878
69 HA3 GLY 11 3HA GLY 11 -12.068 2.649 -1.438
70 H ARG 12 H ARG 12 -10.089 4.878 -0.947
71 HA ARG 12 HA ARG 12 -8.952 5.438 -3.528
72 HE ARG 12 HE ARG 12 -13.836 6.155 -2.877
73 HB2 ARG 12 1HB ARG 12 -10.299 7.416 -4.013
74 HB3 ARG 12 2HB ARG 12 -11.307 5.963 -3.959
75 HG2 ARG 12 1HG ARG 12 -11.995 6.545 -1.658
76 HG3 ARG 12 2HG ARG 12 -11.059 8.042 -1.798
77 HD2 ARG 12 1HD ARG 12 -13.091 8.860 -2.431
78 HD3 ARG 12 2HD ARG 12 -12.515 8.295 -4.007
79 HH11 ARG 12 1HH1 ARG 12 -14.613 9.416 -3.811
80 HH12 ARG 12 2HH1 ARG 12 -16.271 9.057 -4.168
81 HH21 ARG 12 1HH2 ARG 12 -16.015 5.670 -3.341
82 HH22 ARG 12 2HH2 ARG 12 -17.067 6.927 -3.898
83 H VAL 13 H VAL 13 -9.948 6.665 -0.368
84 HA VAL 13 HA VAL 13 -8.452 8.965 -0.180
85 HB VAL 13 HB VAL 13 -8.810 6.969 2.058
86 HG11 VAL 13 1HG1 VAL 13 -8.527 8.790 3.546
87 HG12 VAL 13 2HG1 VAL 13 -7.205 8.889 2.381
88 HG13 VAL 13 3HG1 VAL 13 -8.596 9.964 2.233
89 HG21 VAL 13 3HG2 VAL 13 -10.999 7.315 1.889
90 HG22 VAL 13 1HG2 VAL 13 -10.717 9.017 2.250
91 HG23 VAL 13 2HG2 VAL 13 -10.760 8.468 0.575
92 H ALA 14 H ALA 14 -7.392 5.628 0.220
93 HA ALA 14 HA ALA 14 -4.884 5.988 1.310
94 HB1 ALA 14 1HB ALA 14 -5.254 3.774 1.144
95 HB2 ALA 14 2HB ALA 14 -6.166 3.931 -0.357
96 HB3 ALA 14 3HB ALA 14 -4.402 3.943 -0.390
97 H TYR 15 H TYR 15 -5.969 6.573 -1.961
98 HA TYR 15 HA TYR 15 -3.367 6.824 -3.107
99 HD1 TYR 15 1HD TYR 15 -2.541 7.463 -5.108
100 HD2 TYR 15 2HD TYR 15 -6.405 9.073 -5.868
101 HE1 TYR 15 1HE TYR 15 -1.608 8.828 -6.928
102 HE2 TYR 15 2HE TYR 15 -5.483 10.443 -7.691
103 HH TYR 15 HH TYR 15 -2.314 9.974 -8.919
104 HB2 TYR 15 1HB TYR 15 -5.171 6.295 -4.575
105 HB3 TYR 15 2HB TYR 15 -6.106 7.689 -4.031
106 H TRP 16 H TRP 16 -5.687 9.062 -1.692
107 HA TRP 16 HA TRP 16 -4.306 11.435 -2.428
108 HD1 TRP 16 HD TRP 16 -8.075 9.939 -2.209
109 HE1 TRP 16 1HE TRP 16 -9.359 11.118 -4.102
110 HE3 TRP 16 3HE TRP 16 -5.535 14.375 -2.272
111 HZ2 TRP 16 2HZ TRP 16 -9.303 13.598 -5.446
112 HZ3 TRP 16 3HZ TRP 16 -6.214 16.097 -3.891
113 HH2 TRP 16 HH TRP 16 -8.057 15.716 -5.445
114 HB2 TRP 16 1HB TRP 16 -6.396 10.835 -0.326
115 HB3 TRP 16 2HB TRP 16 -5.727 12.449 -0.563
116 H VAL 17 H VAL 17 -4.369 9.469 0.524
117 HA VAL 17 HA VAL 17 -2.623 11.128 2.015
118 HB VAL 17 HB VAL 17 -4.095 9.486 3.090
119 HG11 VAL 17 1HG1 VAL 17 -3.615 7.118 3.023
120 HG12 VAL 17 2HG1 VAL 17 -3.870 7.717 1.383
121 HG13 VAL 17 3HG1 VAL 17 -2.234 7.398 1.962
122 HG21 VAL 17 3HG2 VAL 17 -2.199 10.263 4.350
123 HG22 VAL 17 1HG2 VAL 17 -2.431 8.544 4.673
124 HG23 VAL 17 2HG2 VAL 17 -1.149 9.072 3.582
125 H GLY 18 H GLY 18 -2.109 8.448 -0.197
126 HA2 GLY 18 2HA GLY 18 0.624 8.006 0.430
127 HA3 GLY 18 3HA GLY 18 -0.193 7.501 -1.041
128 H LYS 19 H LYS 19 -0.976 9.999 -2.024
129 HA LYS 19 HA LYS 19 1.464 10.847 -3.237
130 HB2 LYS 19 1HB LYS 19 0.085 12.430 -4.473
131 HB3 LYS 19 2HB LYS 19 -0.668 10.827 -4.461
132 HG2 LYS 19 1HG LYS 19 -2.242 11.511 -2.766
133 HG3 LYS 19 2HG LYS 19 -1.438 13.084 -2.624
134 HD2 LYS 19 1HD LYS 19 -2.053 12.714 -5.367
135 HD3 LYS 19 2HD LYS 19 -3.497 12.285 -4.434
136 HE2 LYS 19 1HE LYS 19 -3.341 14.439 -3.226
137 HE3 LYS 19 2HE LYS 19 -1.946 14.864 -4.226
138 HZ1 LYS 19 3HZ LYS 19 -3.278 14.927 -6.156
139 HZ2 LYS 19 1HZ LYS 19 -4.135 15.785 -4.974
140 HZ3 LYS 19 2HZ LYS 19 -4.596 14.208 -5.377
141 H ALA 20 H ALA 20 -0.584 12.059 -0.670
142 HA ALA 20 HA ALA 20 0.598 14.644 -0.507
143 HB1 ALA 20 1HB ALA 20 -1.449 14.666 0.496
144 HB2 ALA 20 2HB ALA 20 -1.261 13.043 1.167
145 HB3 ALA 20 3HB ALA 20 -0.437 14.411 1.917
146 H LEU 21 H LEU 21 1.422 11.512 0.743
147 HA LEU 21 HA LEU 21 3.231 12.494 2.753
148 HG LEU 21 HG LEU 21 2.930 11.205 4.413
149 HB2 LEU 21 1HB LEU 21 2.053 10.004 2.047
150 HB3 LEU 21 2HB LEU 21 3.813 9.802 2.041
151 HD11 LEU 21 1HD1 LEU 21 1.725 8.500 3.855
152 HD12 LEU 21 2HD1 LEU 21 0.868 10.005 4.184
153 HD13 LEU 21 3HD1 LEU 21 1.822 9.241 5.454
154 HD21 LEU 21 3HD2 LEU 21 4.245 8.510 4.133
155 HD22 LEU 21 1HD2 LEU 21 4.326 9.620 5.501
156 HD23 LEU 21 2HD2 LEU 21 5.114 10.040 3.980
157 H GLY 22 H GLY 22 3.408 11.597 -0.602
158 HA2 GLY 22 2HA GLY 22 5.541 12.875 -1.462
159 HA3 GLY 22 3HA GLY 22 6.333 11.595 -0.555
160 H ASN 23 H ASN 23 6.739 11.963 -3.285
161 HA ASN 23 HA ASN 23 5.098 10.021 -4.685
162 HB2 ASN 23 1HB ASN 23 7.512 11.593 -5.633
163 HB3 ASN 23 2HB ASN 23 6.439 10.625 -6.653
164 HD21 ASN 23 1HD2 ASN 23 4.328 11.337 -7.048
165 HD22 ASN 23 2HD2 ASN 23 3.870 12.986 -6.815
166 H LEU 24 H LEU 24 6.133 8.608 -2.750
167 HA LEU 24 HA LEU 24 7.684 6.634 -4.041
168 HG LEU 24 HG LEU 24 8.606 8.111 -0.816
169 HB2 LEU 24 1HB LEU 24 9.746 6.763 -2.809
170 HB3 LEU 24 2HB LEU 24 9.464 8.292 -3.656
171 HD11 LEU 24 1HD1 LEU 24 10.637 7.359 -0.210
172 HD12 LEU 24 2HD1 LEU 24 11.129 9.024 -0.518
173 HD13 LEU 24 3HD1 LEU 24 11.376 7.789 -1.752
174 HD21 LEU 24 3HD2 LEU 24 8.812 10.384 -0.855
175 HD22 LEU 24 1HD2 LEU 24 8.464 10.087 -2.559
176 HD23 LEU 24 2HD2 LEU 24 10.126 10.357 -2.034
177 H SER 25 H SER 25 5.273 6.869 -2.495
178 HA SER 25 HA SER 25 5.837 5.611 0.060
179 HG SER 25 HG SER 25 3.850 6.735 1.491
180 HB2 SER 25 1HB SER 25 3.451 6.791 -1.271
181 HB3 SER 25 2HB SER 25 3.154 5.496 -0.101
182 H ASP 26 H ASP 26 4.408 4.769 -3.058
183 HA ASP 26 HA ASP 26 3.761 2.086 -2.258
184 HD2 ASP 26 HD ASP 26 1.445 0.182 -3.900
185 HB2 ASP 26 1HB ASP 26 2.644 3.544 -4.096
186 HB3 ASP 26 2HB ASP 26 3.982 2.993 -5.114
187 H VAL 27 H VAL 27 6.427 3.688 -3.858
188 HA VAL 27 HA VAL 27 7.697 1.373 -4.879
189 HB VAL 27 HB VAL 27 8.187 3.727 -5.599
190 HG11 VAL 27 1HG1 VAL 27 8.396 4.441 -3.105
191 HG12 VAL 27 2HG1 VAL 27 10.074 3.926 -3.291
192 HG13 VAL 27 3HG1 VAL 27 9.420 5.201 -4.322
193 HG21 VAL 27 3HG2 VAL 27 10.287 1.733 -4.891
194 HG22 VAL 27 1HG2 VAL 27 9.703 2.243 -6.476
195 HG23 VAL 27 2HG2 VAL 27 10.775 3.293 -5.549
196 H ASN 28 H ASN 28 7.742 2.971 -1.769
197 HA ASN 28 HA ASN 28 10.051 1.808 -0.689
198 HB2 ASN 28 1HB ASN 28 8.661 3.710 0.273
199 HB3 ASN 28 2HB ASN 28 7.562 2.469 0.885
200 HD21 ASN 28 1HD2 ASN 28 7.914 1.808 2.869
201 HD22 ASN 28 2HD2 ASN 28 9.419 1.873 3.716
202 H GLN 29 H GLN 29 6.744 0.634 -0.932
203 HA GLN 29 HA GLN 29 7.230 -1.695 0.682
204 HB2 GLN 29 1HB GLN 29 4.941 -0.996 -1.171
205 HB3 GLN 29 2HB GLN 29 4.974 -2.391 -0.081
206 HG2 GLN 29 1HG GLN 29 5.516 0.176 1.231
207 HG3 GLN 29 2HG GLN 29 3.905 0.035 0.514
208 HE21 GLN 29 1HE2 GLN 29 6.172 -1.758 2.560
209 HE22 GLN 29 2HE2 GLN 29 4.970 -2.442 3.594
210 H ALA 30 H ALA 30 7.357 -0.885 -2.707
211 HA ALA 30 HA ALA 30 7.296 -3.478 -3.789
212 HB1 ALA 30 1HB ALA 30 7.100 -1.246 -5.005
213 HB2 ALA 30 2HB ALA 30 8.863 -1.211 -4.978
214 HB3 ALA 30 3HB ALA 30 8.018 -2.521 -5.803
215 H SER 31 H SER 31 9.830 -1.640 -2.257
216 HA SER 31 HA SER 31 12.090 -2.963 -3.190
217 HG SER 31 HG SER 31 12.192 -1.641 0.608
218 HB2 SER 31 1HB SER 31 13.231 -2.154 -1.222
219 HB3 SER 31 2HB SER 31 12.080 -0.914 -1.751
220 H ARG 32 H ARG 32 9.609 -4.048 -1.058
221 HA ARG 32 HA ARG 32 11.068 -6.087 0.275
222 HE ARG 32 HE ARG 32 8.922 -6.654 3.708
223 HB2 ARG 32 1HB ARG 32 8.930 -5.161 1.109
224 HB3 ARG 32 2HB ARG 32 8.096 -5.917 -0.257
225 HG2 ARG 32 1HG ARG 32 8.599 -8.115 0.537
226 HG3 ARG 32 2HG ARG 32 9.664 -7.459 1.794
227 HD2 ARG 32 1HD ARG 32 6.953 -6.351 1.878
228 HD3 ARG 32 2HD ARG 32 7.015 -8.104 2.118
229 HH11 ARG 32 1HH1 ARG 32 5.652 -7.834 3.518
230 HH12 ARG 32 2HH1 ARG 32 5.421 -7.856 5.234
231 HH21 ARG 32 1HH2 ARG 32 8.630 -6.676 5.971
232 HH22 ARG 32 2HH2 ARG 32 7.116 -7.197 6.629
233 H ILE 33 H ILE 33 9.922 -5.789 -2.901
234 HA ILE 33 HA ILE 33 10.476 -8.634 -3.377
235 HB ILE 33 HB ILE 33 8.293 -7.226 -4.886
236 HG12 ILE 33 1HG1 ILE 33 6.863 -8.800 -3.264
237 HG13 ILE 33 2HG1 ILE 33 8.207 -8.437 -2.169
238 HG21 ILE 33 1HG2 ILE 33 8.417 -9.110 -6.063
239 HG22 ILE 33 2HG2 ILE 33 9.512 -9.846 -4.894
240 HG23 ILE 33 3HG2 ILE 33 7.768 -9.944 -4.653
241 HD11 ILE 33 3HD1 ILE 33 6.750 -6.759 -1.641
242 HD12 ILE 33 1HD1 ILE 33 7.739 -5.968 -2.868
243 HD13 ILE 33 2HD1 ILE 33 6.151 -6.607 -3.293
244 H ASN 34 H ASN 34 11.496 -5.652 -3.916
245 HA ASN 34 HA ASN 34 12.290 -6.193 -6.701
246 HB2 ASN 34 1HB ASN 34 11.342 -3.739 -5.357
247 HB3 ASN 34 2HB ASN 34 12.746 -3.521 -6.410
248 HD21 ASN 34 1HD2 ASN 34 9.384 -3.960 -6.262
249 HD22 ASN 34 2HD2 ASN 34 9.079 -4.036 -7.961
250 H ARG 35 H ARG 35 13.381 -4.344 -3.849
251 HA ARG 35 HA ARG 35 15.432 -4.079 -2.903
252 HE ARG 35 HE ARG 35 13.510 -7.813 -0.918
253 HB2 ARG 35 1HB ARG 35 16.252 -6.555 -4.433
254 HB3 ARG 35 2HB ARG 35 16.982 -5.911 -2.956
255 HG2 ARG 35 1HG ARG 35 14.143 -6.915 -3.105
256 HG3 ARG 35 2HG ARG 35 15.526 -7.917 -2.631
257 HD2 ARG 35 1HD ARG 35 15.991 -6.506 -0.733
258 HD3 ARG 35 2HD ARG 35 14.765 -5.344 -1.260
259 HH11 ARG 35 1HH1 ARG 35 15.107 -5.379 0.989
260 HH12 ARG 35 2HH1 ARG 35 14.195 -5.716 2.422
261 HH21 ARG 35 1HH2 ARG 35 12.301 -8.267 0.962
262 HH22 ARG 35 2HH2 ARG 35 12.598 -7.360 2.405
263 H LYS 36 H LYS 36 14.761 -3.308 -5.831
264 HA LYS 36 HA LYS 36 17.250 -3.216 -7.202
265 HB2 LYS 36 1HB LYS 36 16.099 -1.561 -8.675
266 HB3 LYS 36 2HB LYS 36 15.218 -3.083 -8.474
267 HG2 LYS 36 1HG LYS 36 13.422 -1.975 -7.815
268 HG3 LYS 36 2HG LYS 36 14.336 -1.306 -6.452
269 HD2 LYS 36 1HD LYS 36 14.672 0.692 -7.465
270 HD3 LYS 36 2HD LYS 36 14.838 -0.042 -9.070
271 HE2 LYS 36 1HE LYS 36 12.153 -0.062 -7.751
272 HE3 LYS 36 2HE LYS 36 12.750 1.442 -8.462
273 HZ1 LYS 36 3HZ LYS 36 12.893 -1.006 -10.069
274 HZ2 LYS 36 1HZ LYS 36 12.676 0.598 -10.565
275 HZ3 LYS 36 2HZ LYS 36 11.388 -0.257 -9.877
276 H LYS 37 H LYS 37 15.633 -1.115 -4.929
277 HA LYS 37 HA LYS 37 17.254 1.181 -5.370
278 HB2 LYS 37 1HB LYS 37 14.944 0.875 -4.128
279 HB3 LYS 37 2HB LYS 37 15.988 0.645 -2.716
280 HG2 LYS 37 1HG LYS 37 15.309 2.947 -2.827
281 HG3 LYS 37 2HG LYS 37 17.042 2.829 -3.175
282 HD2 LYS 37 1HD LYS 37 16.641 4.037 -5.012
283 HD3 LYS 37 2HD LYS 37 15.855 2.589 -5.664
284 HE2 LYS 37 1HE LYS 37 14.509 4.824 -4.126
285 HE3 LYS 37 2HE LYS 37 14.380 4.507 -5.861
286 HZ1 LYS 37 3HZ LYS 37 12.472 3.667 -4.597
287 HZ2 LYS 37 1HZ LYS 37 13.495 2.629 -3.736
288 HZ3 LYS 37 2HZ LYS 37 13.292 2.425 -5.403
289 H LYS 38 H LYS 38 17.604 -1.710 -3.469
290 HA LYS 38 HA LYS 38 19.260 -2.493 -2.117
291 HB2 LYS 38 1HB LYS 38 20.452 -1.895 -4.348
292 HB3 LYS 38 2HB LYS 38 21.142 -0.553 -3.421
293 HG2 LYS 38 1HG LYS 38 22.079 -2.145 -1.804
294 HG3 LYS 38 2HG LYS 38 21.417 -3.479 -2.763
295 HD2 LYS 38 1HD LYS 38 23.378 -3.488 -3.842
296 HD3 LYS 38 2HD LYS 38 22.802 -2.014 -4.636
297 HE2 LYS 38 1HE LYS 38 24.609 -1.002 -3.784
298 HE3 LYS 38 2HE LYS 38 23.774 -1.089 -2.226
299 HZ1 LYS 38 3HZ LYS 38 25.531 -3.249 -3.243
300 HZ2 LYS 38 1HZ LYS 38 24.908 -3.077 -1.680
301 HZ3 LYS 38 2HZ LYS 38 26.080 -1.999 -2.245
302 H HIS 39 H HIS 39 17.740 -0.112 -1.266
303 HA HIS 39 HA HIS 39 17.686 1.357 0.469
304 HD1 HIS 39 1HD HIS 39 19.700 1.952 3.694
305 HD2 HIS 39 2HD HIS 39 16.515 -0.533 2.720
306 HE1 HIS 39 1HE HIS 39 18.044 2.214 5.570
307 HE2 HIS 39 2HE HIS 39 16.098 0.694 4.976
308 HB2 HIS 39 1HB HIS 39 19.060 -0.840 1.373
309 HB3 HIS 39 2HB HIS 39 20.193 0.470 1.724
Start of MODEL 6
1 H1 GLY 1 H GLY 1 -26.979 2.487 10.786
2 HA2 GLY 1 2HA GLY 1 -25.066 1.941 9.413
3 HA3 GLY 1 3HA GLY 1 -26.500 1.688 8.429
4 H THR 2 H THR 2 -23.639 2.549 7.861
5 HA THR 2 HA THR 2 -24.196 4.243 5.690
6 HB THR 2 HB THR 2 -22.542 6.083 6.879
7 HG1 THR 2 1HG THR 2 -23.008 4.974 8.926
8 HG21 THR 2 3HG2 THR 2 -24.229 7.534 6.427
9 HG22 THR 2 1HG2 THR 2 -25.446 6.540 7.225
10 HG23 THR 2 2HG2 THR 2 -24.903 6.130 5.598
11 H TRP 3 H TRP 3 -22.670 1.862 6.458
12 HA TRP 3 HA TRP 3 -19.889 2.471 6.365
13 HD1 TRP 3 HD TRP 3 -22.594 -0.484 8.096
14 HE1 TRP 3 1HE TRP 3 -21.855 -0.533 10.562
15 HE3 TRP 3 3HE TRP 3 -17.812 1.240 7.545
16 HZ2 TRP 3 2HZ TRP 3 -19.552 0.083 12.074
17 HZ3 TRP 3 3HZ TRP 3 -16.407 1.482 9.551
18 HH2 TRP 3 HH TRP 3 -17.261 0.914 11.766
19 HB2 TRP 3 1HB TRP 3 -21.405 -0.096 5.825
20 HB3 TRP 3 2HB TRP 3 -19.646 0.020 5.884
21 H ASP 4 H ASP 4 -22.362 2.037 3.979
22 HA ASP 4 HA ASP 4 -20.606 1.516 1.780
23 HD2 ASP 4 HD ASP 4 -23.187 -0.995 -0.043
24 HB2 ASP 4 1HB ASP 4 -23.515 2.136 2.107
25 HB3 ASP 4 2HB ASP 4 -22.782 2.346 0.511
26 H ASP 5 H ASP 5 -22.255 4.389 3.037
27 HA ASP 5 HA ASP 5 -21.170 6.102 0.995
28 HD2 ASP 5 HD ASP 5 -22.464 9.486 0.580
29 HB2 ASP 5 1HB ASP 5 -23.310 6.259 2.749
30 HB3 ASP 5 2HB ASP 5 -22.161 7.439 3.396
31 H ILE 6 H ILE 6 -20.553 5.519 4.435
32 HA ILE 6 HA ILE 6 -18.445 7.454 4.592
33 HB ILE 6 HB ILE 6 -19.153 5.194 6.470
34 HG12 ILE 6 1HG1 ILE 6 -19.735 8.160 6.668
35 HG13 ILE 6 2HG1 ILE 6 -20.910 6.944 6.140
36 HG21 ILE 6 1HG2 ILE 6 -16.885 5.778 6.860
37 HG22 ILE 6 2HG2 ILE 6 -17.241 7.501 6.753
38 HG23 ILE 6 3HG2 ILE 6 -17.838 6.559 8.120
39 HD11 ILE 6 3HD1 ILE 6 -20.365 5.816 8.419
40 HD12 ILE 6 1HD1 ILE 6 -19.800 7.428 8.859
41 HD13 ILE 6 2HD1 ILE 6 -21.472 7.188 8.347
42 H GLY 7 H GLY 7 -18.498 3.884 4.650
43 HA2 GLY 7 2HA GLY 7 -15.769 3.425 4.719
44 HA3 GLY 7 3HA GLY 7 -16.934 2.349 3.964
45 H GLN 8 H GLN 8 -17.737 4.467 2.038
46 HA GLN 8 HA GLN 8 -16.057 3.757 -0.083
47 HB2 GLN 8 1HB GLN 8 -18.418 5.317 0.300
48 HB3 GLN 8 2HB GLN 8 -17.281 6.253 -0.684
49 HG2 GLN 8 1HG GLN 8 -17.622 3.422 -1.454
50 HG3 GLN 8 2HG GLN 8 -19.021 4.478 -1.695
51 HE21 GLN 8 1HE2 GLN 8 -15.605 4.095 -2.435
52 HE22 GLN 8 2HE2 GLN 8 -15.633 4.997 -3.908
53 H GLY 9 H GLY 9 -15.837 6.312 2.257
54 HA2 GLY 9 2HA GLY 9 -13.794 7.728 0.729
55 HA3 GLY 9 3HA GLY 9 -14.474 8.226 2.271
56 H ILE 10 H ILE 10 -13.966 6.512 4.078
57 HA ILE 10 HA ILE 10 -11.267 6.644 4.649
58 HB ILE 10 HB ILE 10 -13.054 6.151 6.309
59 HG12 ILE 10 1HG1 ILE 10 -10.832 4.094 6.303
60 HG13 ILE 10 2HG1 ILE 10 -10.616 5.793 6.763
61 HG21 ILE 10 1HG2 ILE 10 -13.881 4.217 4.666
62 HG22 ILE 10 2HG2 ILE 10 -12.876 3.252 5.746
63 HG23 ILE 10 3HG2 ILE 10 -14.211 4.202 6.399
64 HD11 ILE 10 3HD1 ILE 10 -11.867 3.582 8.254
65 HD12 ILE 10 1HD1 ILE 10 -10.936 4.964 8.831
66 HD13 ILE 10 2HD1 ILE 10 -12.635 5.162 8.397
67 H GLY 11 H GLY 11 -13.011 4.271 2.782
68 HA2 GLY 11 2HA GLY 11 -11.115 2.188 2.832
69 HA3 GLY 11 3HA GLY 11 -12.316 2.447 1.577
70 H ARG 12 H ARG 12 -11.617 4.748 0.404
71 HA ARG 12 HA ARG 12 -9.256 3.996 -1.047
72 HE ARG 12 HE ARG 12 -12.526 6.852 -3.649
73 HB2 ARG 12 1HB ARG 12 -10.865 6.546 -1.293
74 HB3 ARG 12 2HB ARG 12 -9.767 5.852 -2.496
75 HG2 ARG 12 1HG ARG 12 -11.562 3.809 -2.064
76 HG3 ARG 12 2HG ARG 12 -12.565 5.266 -1.973
77 HD2 ARG 12 1HD ARG 12 -10.589 4.888 -4.211
78 HD3 ARG 12 2HD ARG 12 -12.200 4.156 -4.273
79 HH11 ARG 12 1HH1 ARG 12 -11.376 4.891 -6.285
80 HH12 ARG 12 2HH1 ARG 12 -11.815 6.043 -7.504
81 HH21 ARG 12 1HH2 ARG 12 -13.109 8.375 -5.244
82 HH22 ARG 12 2HH2 ARG 12 -12.800 8.024 -6.912
83 H VAL 13 H VAL 13 -10.093 6.373 1.380
84 HA VAL 13 HA VAL 13 -7.763 7.976 1.119
85 HB VAL 13 HB VAL 13 -9.577 7.620 3.508
86 HG11 VAL 13 1HG1 VAL 13 -8.404 10.182 3.446
87 HG12 VAL 13 2HG1 VAL 13 -8.151 8.898 4.630
88 HG13 VAL 13 3HG1 VAL 13 -7.102 9.014 3.216
89 HG21 VAL 13 3HG2 VAL 13 -11.027 9.049 2.573
90 HG22 VAL 13 1HG2 VAL 13 -9.742 10.094 1.963
91 HG23 VAL 13 2HG2 VAL 13 -10.219 8.660 1.054
92 H ALA 14 H ALA 14 -8.599 5.200 3.136
93 HA ALA 14 HA ALA 14 -6.454 5.172 4.878
94 HB1 ALA 14 1HB ALA 14 -7.863 2.818 3.626
95 HB2 ALA 14 2HB ALA 14 -6.811 2.741 5.042
96 HB3 ALA 14 3HB ALA 14 -8.320 3.651 5.113
97 H TYR 15 H TYR 15 -6.590 4.217 1.512
98 HA TYR 15 HA TYR 15 -4.067 2.888 1.472
99 HD1 TYR 15 2HD TYR 15 -3.238 1.329 -0.117
100 HD2 TYR 15 1HD TYR 15 -4.602 4.363 -2.771
101 HE1 TYR 15 2HE TYR 15 -1.469 0.720 -1.714
102 HE2 TYR 15 1HE TYR 15 -2.839 3.760 -4.375
103 HH TYR 15 HH TYR 15 -1.186 0.957 -4.324
104 HB2 TYR 15 1HB TYR 15 -5.778 2.396 -0.196
105 HB3 TYR 15 2HB TYR 15 -5.712 4.062 -0.780
106 H TRP 16 H TRP 16 -5.130 6.187 1.037
107 HA TRP 16 HA TRP 16 -2.664 7.123 -0.084
108 HD1 TRP 16 HD TRP 16 -6.440 7.585 -1.248
109 HE1 TRP 16 1HE TRP 16 -6.229 8.186 -3.741
110 HE3 TRP 16 3HE TRP 16 -1.965 10.052 -1.114
111 HZ2 TRP 16 2HZ TRP 16 -4.408 9.530 -5.428
112 HZ3 TRP 16 3HZ TRP 16 -1.058 10.965 -3.210
113 HH2 TRP 16 HH TRP 16 -2.257 10.708 -5.323
114 HB2 TRP 16 1HB TRP 16 -5.175 8.403 0.936
115 HB3 TRP 16 2HB TRP 16 -3.739 9.401 0.699
116 H VAL 17 H VAL 17 -4.162 7.220 3.129
117 HA VAL 17 HA VAL 17 -2.082 8.683 4.377
118 HB VAL 17 HB VAL 17 -4.317 8.523 5.363
119 HG11 VAL 17 1HG1 VAL 17 -5.136 6.514 6.384
120 HG12 VAL 17 2HG1 VAL 17 -4.711 6.149 4.710
121 HG13 VAL 17 3HG1 VAL 17 -3.637 5.661 6.021
122 HG21 VAL 17 3HG2 VAL 17 -3.648 8.222 7.664
123 HG22 VAL 17 1HG2 VAL 17 -2.231 7.297 7.164
124 HG23 VAL 17 2HG2 VAL 17 -2.346 9.013 6.777
125 H GLY 18 H GLY 18 -2.637 5.253 3.834
126 HA2 GLY 18 2HA GLY 18 -0.654 4.273 5.594
127 HA3 GLY 18 3HA GLY 18 -1.326 3.408 4.219
128 H LYS 19 H LYS 19 -0.549 5.085 2.142
129 HA LYS 19 HA LYS 19 2.171 4.280 1.820
130 HB2 LYS 19 1HB LYS 19 2.025 5.351 -0.375
131 HB3 LYS 19 2HB LYS 19 0.615 4.324 -0.071
132 HG2 LYS 19 1HG LYS 19 -0.759 6.237 0.418
133 HG3 LYS 19 2HG LYS 19 0.644 7.312 0.301
134 HD2 LYS 19 1HD LYS 19 -0.302 7.597 -1.782
135 HD3 LYS 19 2HD LYS 19 0.863 6.302 -2.101
136 HE2 LYS 19 1HE LYS 19 -0.815 4.631 -2.088
137 HE3 LYS 19 2HE LYS 19 -1.991 5.729 -1.352
138 HZ1 LYS 19 3HZ LYS 19 -2.695 6.097 -3.414
139 HZ2 LYS 19 1HZ LYS 19 -1.343 5.356 -4.111
140 HZ3 LYS 19 2HZ LYS 19 -1.275 6.986 -3.664
141 H ALA 20 H ALA 20 0.549 7.271 2.639
142 HA ALA 20 HA ALA 20 2.816 8.964 2.275
143 HB1 ALA 20 1HB ALA 20 0.429 9.493 4.031
144 HB2 ALA 20 2HB ALA 20 1.511 10.675 3.296
145 HB3 ALA 20 3HB ALA 20 0.428 9.722 2.282
146 H LEU 21 H LEU 21 1.553 7.065 4.934
147 HA LEU 21 HA LEU 21 3.088 8.239 6.997
148 HG LEU 21 HG LEU 21 1.117 6.132 9.214
149 HB2 LEU 21 1HB LEU 21 1.147 6.239 6.775
150 HB3 LEU 21 2HB LEU 21 2.585 5.424 7.412
151 HD11 LEU 21 1HD1 LEU 21 3.394 8.038 9.409
152 HD12 LEU 21 2HD1 LEU 21 3.740 6.316 9.239
153 HD13 LEU 21 3HD1 LEU 21 2.772 6.891 10.596
154 HD21 LEU 21 3HD2 LEU 21 1.374 8.877 9.365
155 HD22 LEU 21 1HD2 LEU 21 -0.075 7.989 8.897
156 HD23 LEU 21 2HD2 LEU 21 1.030 8.585 7.660
157 H GLY 22 H GLY 22 3.720 5.644 4.707
158 HA2 GLY 22 2HA GLY 22 6.223 5.632 4.176
159 HA3 GLY 22 3HA GLY 22 6.396 5.293 5.892
160 H ASN 23 H ASN 23 4.472 4.067 3.146
161 HA ASN 23 HA ASN 23 4.844 1.352 4.189
162 HB2 ASN 23 1HB ASN 23 2.635 2.687 3.074
163 HB3 ASN 23 2HB ASN 23 3.144 1.510 1.856
164 HD21 ASN 23 1HD2 ASN 23 2.985 1.530 5.404
165 HD22 ASN 23 2HD2 ASN 23 2.109 0.046 5.541
166 H LEU 24 H LEU 24 6.924 2.897 2.760
167 HA LEU 24 HA LEU 24 7.913 0.827 1.118
168 HG LEU 24 HG LEU 24 7.606 4.285 -0.001
169 HB2 LEU 24 1HB LEU 24 7.816 1.816 -1.059
170 HB3 LEU 24 2HB LEU 24 6.173 1.727 -0.398
171 HD11 LEU 24 1HD1 LEU 24 6.390 3.738 -2.682
172 HD12 LEU 24 2HD1 LEU 24 8.097 3.415 -2.381
173 HD13 LEU 24 3HD1 LEU 24 7.462 5.049 -2.186
174 HD21 LEU 24 3HD2 LEU 24 4.995 4.424 -1.177
175 HD22 LEU 24 1HD2 LEU 24 5.534 4.957 0.415
176 HD23 LEU 24 2HD2 LEU 24 4.983 3.298 0.182
177 H SER 25 H SER 25 8.878 2.336 3.268
178 HA SER 25 HA SER 25 10.822 4.198 2.139
179 HG SER 25 HG SER 25 8.980 4.302 5.527
180 HB2 SER 25 1HB SER 25 10.949 3.604 5.031
181 HB3 SER 25 2HB SER 25 10.915 5.163 4.189
182 H ASP 26 H ASP 26 10.741 1.212 4.058
183 HA ASP 26 HA ASP 26 13.520 0.855 4.254
184 HD2 ASP 26 HD ASP 26 12.319 -0.356 7.896
185 HB2 ASP 26 1HB ASP 26 11.304 -1.214 4.250
186 HB3 ASP 26 2HB ASP 26 12.973 -1.511 4.754
187 H VAL 27 H VAL 27 11.221 0.033 1.743
188 HA VAL 27 HA VAL 27 12.859 -1.730 0.268
189 HB VAL 27 HB VAL 27 11.365 -1.118 -1.666
190 HG11 VAL 27 1HG1 VAL 27 9.924 -1.853 0.878
191 HG12 VAL 27 2HG1 VAL 27 9.438 -2.250 -0.771
192 HG13 VAL 27 3HG1 VAL 27 10.895 -2.968 -0.084
193 HG21 VAL 27 3HG2 VAL 27 10.130 0.727 -1.612
194 HG22 VAL 27 1HG2 VAL 27 9.342 0.191 -0.128
195 HG23 VAL 27 2HG2 VAL 27 10.835 1.125 -0.047
196 H ASN 28 H ASN 28 12.739 1.732 0.503
197 HA ASN 28 HA ASN 28 13.989 2.418 -1.915
198 HB2 ASN 28 1HB ASN 28 12.835 3.966 -0.254
199 HB3 ASN 28 2HB ASN 28 14.330 3.911 0.686
200 HD21 ASN 28 1HD2 ASN 28 15.723 5.464 0.306
201 HD22 ASN 28 2HD2 ASN 28 15.858 6.380 -1.152
202 H GLN 29 H GLN 29 15.291 1.439 1.206
203 HA GLN 29 HA GLN 29 18.017 1.979 0.497
204 HB2 GLN 29 1HB GLN 29 16.647 1.479 2.856
205 HB3 GLN 29 2HB GLN 29 17.639 0.030 2.632
206 HG2 GLN 29 1HG GLN 29 19.546 1.773 2.169
207 HG3 GLN 29 2HG GLN 29 18.479 2.848 3.084
208 HE21 GLN 29 1HE2 GLN 29 20.659 2.641 4.328
209 HE22 GLN 29 2HE2 GLN 29 20.648 1.492 5.618
210 H ALA 30 H ALA 30 15.847 -0.733 0.243
211 HA ALA 30 HA ALA 30 17.736 -2.791 -0.096
212 HB1 ALA 30 1HB ALA 30 15.055 -2.740 -1.450
213 HB2 ALA 30 2HB ALA 30 15.957 -4.129 -0.840
214 HB3 ALA 30 3HB ALA 30 15.222 -2.991 0.288
215 H SER 31 H SER 31 16.519 -0.350 -2.264
216 HA SER 31 HA SER 31 17.129 -1.477 -4.733
217 HG SER 31 HG SER 31 17.823 1.428 -2.978
218 HB2 SER 31 1HB SER 31 17.140 0.769 -5.621
219 HB3 SER 31 2HB SER 31 15.893 0.672 -4.365
220 H ARG 32 H ARG 32 19.218 -0.290 -2.260
221 HA ARG 32 HA ARG 32 21.502 0.240 -3.860
222 HE ARG 32 HE ARG 32 23.499 2.273 -0.761
223 HB2 ARG 32 1HB ARG 32 21.332 -0.512 -0.931
224 HB3 ARG 32 2HB ARG 32 22.743 0.184 -1.741
225 HG2 ARG 32 1HG ARG 32 20.111 1.623 -1.750
226 HG3 ARG 32 2HG ARG 32 21.212 1.730 -0.367
227 HD2 ARG 32 1HD ARG 32 22.065 2.324 -3.206
228 HD3 ARG 32 2HD ARG 32 21.443 3.553 -2.096
229 HH11 ARG 32 1HH1 ARG 32 23.103 4.156 -3.662
230 HH12 ARG 32 2HH1 ARG 32 24.708 4.805 -3.616
231 HH21 ARG 32 1HH2 ARG 32 25.615 3.119 -0.688
232 HH22 ARG 32 2HH2 ARG 32 26.138 4.214 -1.924
233 H ILE 33 H ILE 33 19.979 -2.639 -2.918
234 HA ILE 33 HA ILE 33 22.295 -4.183 -3.851
235 HB ILE 33 HB ILE 33 20.565 -5.217 -1.625
236 HG12 ILE 33 1HG1 ILE 33 22.789 -4.574 -0.288
237 HG13 ILE 33 2HG1 ILE 33 22.818 -3.274 -1.493
238 HG21 ILE 33 1HG2 ILE 33 21.809 -7.037 -1.867
239 HG22 ILE 33 2HG2 ILE 33 22.656 -6.271 -3.210
240 HG23 ILE 33 3HG2 ILE 33 23.271 -6.098 -1.566
241 HD11 ILE 33 3HD1 ILE 33 20.854 -3.777 0.684
242 HD12 ILE 33 1HD1 ILE 33 21.646 -2.278 0.201
243 HD13 ILE 33 2HD1 ILE 33 20.333 -2.936 -0.776
244 H ASN 34 H ASN 34 19.295 -3.313 -4.531
245 HA ASN 34 HA ASN 34 18.535 -5.961 -5.583
246 HB2 ASN 34 1HB ASN 34 16.971 -3.840 -4.244
247 HB3 ASN 34 2HB ASN 34 16.212 -4.536 -5.683
248 HD21 ASN 34 1HD2 ASN 34 17.350 -5.168 -2.463
249 HD22 ASN 34 2HD2 ASN 34 16.564 -6.695 -2.268
250 H ARG 35 H ARG 35 17.989 -2.490 -6.230
251 HA ARG 35 HA ARG 35 17.983 -1.288 -8.161
252 HE ARG 35 HE ARG 35 20.142 -0.386 -12.369
253 HB2 ARG 35 1HB ARG 35 20.251 -2.533 -8.322
254 HB3 ARG 35 2HB ARG 35 19.436 -3.529 -9.536
255 HG2 ARG 35 1HG ARG 35 18.805 -1.201 -10.581
256 HG3 ARG 35 2HG ARG 35 20.214 -0.661 -9.656
257 HD2 ARG 35 1HD ARG 35 21.678 -2.110 -10.812
258 HD3 ARG 35 2HD ARG 35 20.333 -3.050 -11.472
259 HH11 ARG 35 1HH1 ARG 35 22.064 -3.258 -12.798
260 HH12 ARG 35 2HH1 ARG 35 22.516 -2.870 -14.424
261 HH21 ARG 35 1HH2 ARG 35 20.733 0.135 -14.510
262 HH22 ARG 35 2HH2 ARG 35 21.760 -0.938 -15.397
263 H LYS 36 H LYS 36 16.101 -3.690 -7.610
264 HA LYS 36 HA LYS 36 15.230 -4.573 -10.177
265 HB2 LYS 36 1HB LYS 36 14.114 -4.721 -7.392
266 HB3 LYS 36 2HB LYS 36 13.125 -5.205 -8.778
267 HG2 LYS 36 1HG LYS 36 15.869 -6.351 -8.360
268 HG3 LYS 36 2HG LYS 36 14.447 -7.015 -7.533
269 HD2 LYS 36 1HD LYS 36 14.015 -8.228 -9.350
270 HD3 LYS 36 2HD LYS 36 13.692 -6.716 -10.219
271 HE2 LYS 36 1HE LYS 36 16.063 -6.544 -10.831
272 HE3 LYS 36 2HE LYS 36 16.390 -8.045 -9.951
273 HZ1 LYS 36 3HZ LYS 36 14.481 -7.886 -12.215
274 HZ2 LYS 36 1HZ LYS 36 15.105 -9.280 -11.483
275 HZ3 LYS 36 2HZ LYS 36 16.114 -8.285 -12.407
276 H LYS 37 H LYS 37 14.432 -1.888 -8.096
277 HA LYS 37 HA LYS 37 13.083 -0.075 -8.356
278 HB2 LYS 37 1HB LYS 37 14.067 -0.759 -11.031
279 HB3 LYS 37 2HB LYS 37 12.555 0.162 -11.051
280 HG2 LYS 37 1HG LYS 37 15.016 1.016 -9.526
281 HG3 LYS 37 2HG LYS 37 14.624 1.548 -11.173
282 HD2 LYS 37 1HD LYS 37 12.855 2.847 -10.495
283 HD3 LYS 37 2HD LYS 37 12.545 1.850 -9.062
284 HE2 LYS 37 1HE LYS 37 13.894 3.090 -7.763
285 HE3 LYS 37 2HE LYS 37 15.159 3.135 -9.001
286 HZ1 LYS 37 3HZ LYS 37 13.356 4.769 -10.081
287 HZ2 LYS 37 1HZ LYS 37 14.602 5.297 -9.067
288 HZ3 LYS 37 2HZ LYS 37 13.051 5.049 -8.441
289 H LYS 38 H LYS 38 11.323 -1.119 -7.309
290 HA LYS 38 HA LYS 38 9.272 -2.294 -9.030
291 HB2 LYS 38 1HB LYS 38 8.136 -2.835 -6.866
292 HB3 LYS 38 2HB LYS 38 9.737 -3.564 -7.051
293 HG2 LYS 38 1HG LYS 38 9.826 -0.956 -5.745
294 HG3 LYS 38 2HG LYS 38 8.852 -2.153 -4.872
295 HD2 LYS 38 1HD LYS 38 11.431 -3.155 -5.900
296 HD3 LYS 38 2HD LYS 38 11.542 -1.912 -4.640
297 HE2 LYS 38 1HE LYS 38 11.374 -3.687 -3.245
298 HE3 LYS 38 2HE LYS 38 9.644 -3.485 -3.563
299 HZ1 LYS 38 3HZ LYS 38 11.362 -5.255 -5.204
300 HZ2 LYS 38 1HZ LYS 38 9.671 -5.210 -5.143
301 HZ3 LYS 38 2HZ LYS 38 10.550 -5.799 -3.823
302 H HIS 39 H HIS 39 9.955 0.559 -7.173
303 HA HIS 39 HA HIS 39 7.266 1.536 -7.101
304 HD1 HIS 39 1HD HIS 39 9.599 5.274 -5.413
305 HD2 HIS 39 2HD HIS 39 6.070 3.634 -6.865
306 HE1 HIS 39 1HE HIS 39 7.896 7.120 -5.279
307 HE2 HIS 39 2HE HIS 39 5.738 6.117 -6.165
308 HB2 HIS 39 1HB HIS 39 8.952 2.228 -5.446
309 HB3 HIS 39 2HB HIS 39 9.880 3.015 -6.726
Start of MODEL 7
1 H1 GLY 1 H GLY 1 -11.050 -7.881 7.853
2 HA2 GLY 1 2HA GLY 1 -10.445 -5.565 7.589
3 HA3 GLY 1 3HA GLY 1 -9.389 -6.039 6.266
4 H THR 2 H THR 2 -11.736 -4.122 6.556
5 HA THR 2 HA THR 2 -12.752 -4.402 3.951
6 HB THR 2 HB THR 2 -15.231 -4.669 5.096
7 HG1 THR 2 1HG THR 2 -14.099 -5.381 7.057
8 HG21 THR 2 3HG2 THR 2 -15.271 -6.039 3.338
9 HG22 THR 2 1HG2 THR 2 -14.461 -7.259 4.319
10 HG23 THR 2 2HG2 THR 2 -13.511 -6.148 3.333
11 H TRP 3 H TRP 3 -11.710 -2.426 5.846
12 HA TRP 3 HA TRP 3 -13.814 -0.661 6.602
13 HD1 TRP 3 HD TRP 3 -9.876 -1.925 7.990
14 HE1 TRP 3 1HE TRP 3 -10.315 -2.478 10.467
15 HE3 TRP 3 3HE TRP 3 -14.034 0.952 8.741
16 HZ2 TRP 3 2HZ TRP 3 -12.178 -1.786 12.471
17 HZ3 TRP 3 3HZ TRP 3 -15.084 0.952 10.966
18 HH2 TRP 3 HH TRP 3 -14.175 -0.392 12.790
19 HB2 TRP 3 1HB TRP 3 -10.833 -0.220 6.286
20 HB3 TRP 3 2HB TRP 3 -11.945 0.984 6.940
21 H ASP 4 H ASP 4 -11.985 -1.161 3.704
22 HA ASP 4 HA ASP 4 -12.535 1.390 2.527
23 HD2 ASP 4 HD ASP 4 -8.865 0.563 3.011
24 HB2 ASP 4 1HB ASP 4 -11.523 -1.237 1.434
25 HB3 ASP 4 2HB ASP 4 -11.829 0.158 0.390
26 H ASP 5 H ASP 5 -13.947 -1.848 2.253
27 HA ASP 5 HA ASP 5 -15.934 -0.997 0.354
28 HD2 ASP 5 HD ASP 5 -17.189 -3.158 -1.927
29 HB2 ASP 5 1HB ASP 5 -14.862 -3.383 0.774
30 HB3 ASP 5 2HB ASP 5 -16.208 -3.531 1.910
31 H ILE 6 H ILE 6 -15.880 -1.818 3.800
32 HA ILE 6 HA ILE 6 -18.678 -1.330 4.166
33 HB ILE 6 HB ILE 6 -16.465 -1.558 6.208
34 HG12 ILE 6 1HG1 ILE 6 -18.548 -3.581 5.347
35 HG13 ILE 6 2HG1 ILE 6 -16.865 -3.577 4.791
36 HG21 ILE 6 1HG2 ILE 6 -19.456 -1.448 6.506
37 HG22 ILE 6 2HG2 ILE 6 -18.382 -2.057 7.764
38 HG23 ILE 6 3HG2 ILE 6 -18.253 -0.382 7.228
39 HD11 ILE 6 3HD1 ILE 6 -16.656 -5.068 6.474
40 HD12 ILE 6 1HD1 ILE 6 -16.401 -3.591 7.403
41 HD13 ILE 6 2HD1 ILE 6 -17.983 -4.373 7.406
42 H GLY 7 H GLY 7 -15.738 0.414 5.191
43 HA2 GLY 7 2HA GLY 7 -17.135 2.657 6.217
44 HA3 GLY 7 3HA GLY 7 -15.425 2.604 5.814
45 H GLN 8 H GLN 8 -15.747 1.952 3.050
46 HA GLN 8 HA GLN 8 -15.776 3.099 1.077
47 HB2 GLN 8 1HB GLN 8 -18.230 2.475 1.573
48 HB3 GLN 8 2HB GLN 8 -18.438 4.194 1.949
49 HG2 GLN 8 1HG GLN 8 -17.514 4.702 -0.342
50 HG3 GLN 8 2HG GLN 8 -17.650 2.971 -0.678
51 HE21 GLN 8 1HE2 GLN 8 -19.017 4.286 -2.368
52 HE22 GLN 8 2HE2 GLN 8 -20.706 4.352 -2.013
53 H GLY 9 H GLY 9 -14.246 4.448 2.827
54 HA2 GLY 9 2HA GLY 9 -14.318 7.096 1.827
55 HA3 GLY 9 3HA GLY 9 -14.939 7.068 3.472
56 H ILE 10 H ILE 10 -13.490 5.820 5.049
57 HA ILE 10 HA ILE 10 -11.057 7.124 5.291
58 HB ILE 10 HB ILE 10 -11.696 4.408 6.445
59 HG12 ILE 10 1HG1 ILE 10 -12.146 6.278 8.422
60 HG13 ILE 10 2HG1 ILE 10 -12.806 7.067 6.978
61 HG21 ILE 10 1HG2 ILE 10 -10.186 5.172 8.266
62 HG22 ILE 10 2HG2 ILE 10 -9.378 4.969 6.713
63 HG23 ILE 10 3HG2 ILE 10 -9.790 6.583 7.289
64 HD11 ILE 10 3HD1 ILE 10 -13.870 4.865 8.524
65 HD12 ILE 10 1HD1 ILE 10 -14.667 5.924 7.359
66 HD13 ILE 10 2HD1 ILE 10 -13.788 4.500 6.800
67 H GLY 11 H GLY 11 -11.863 4.243 3.516
68 HA2 GLY 11 2HA GLY 11 -9.290 3.125 3.263
69 HA3 GLY 11 3HA GLY 11 -10.625 2.878 2.148
70 H ARG 12 H ARG 12 -11.064 5.266 1.030
71 HA ARG 12 HA ARG 12 -8.777 5.568 -0.681
72 HE ARG 12 HE ARG 12 -10.787 2.510 -2.785
73 HB2 ARG 12 1HB ARG 12 -11.376 7.119 -0.609
74 HB3 ARG 12 2HB ARG 12 -10.179 7.162 -1.912
75 HG2 ARG 12 1HG ARG 12 -11.742 4.721 -1.060
76 HG3 ARG 12 2HG ARG 12 -12.097 5.743 -2.463
77 HD2 ARG 12 1HD ARG 12 -9.963 5.183 -3.476
78 HD3 ARG 12 2HD ARG 12 -9.507 4.260 -2.039
79 HH11 ARG 12 1HH1 ARG 12 -11.585 5.378 -4.589
80 HH12 ARG 12 2HH1 ARG 12 -12.569 4.536 -5.742
81 HH21 ARG 12 1HH2 ARG 12 -12.080 1.391 -4.294
82 HH22 ARG 12 2HH2 ARG 12 -12.852 2.270 -5.572
83 H VAL 13 H VAL 13 -10.244 7.369 1.936
84 HA VAL 13 HA VAL 13 -8.831 9.797 1.530
85 HB VAL 13 HB VAL 13 -10.047 8.697 4.068
86 HG11 VAL 13 1HG1 VAL 13 -9.159 10.446 5.108
87 HG12 VAL 13 2HG1 VAL 13 -8.421 11.000 3.604
88 HG13 VAL 13 3HG1 VAL 13 -10.053 11.515 4.030
89 HG21 VAL 13 3HG2 VAL 13 -11.400 10.887 2.691
90 HG22 VAL 13 1HG2 VAL 13 -11.338 9.395 1.753
91 HG23 VAL 13 2HG2 VAL 13 -12.054 9.394 3.364
92 H ALA 14 H ALA 14 -8.210 6.917 3.482
93 HA ALA 14 HA ALA 14 -6.047 7.789 4.974
94 HB1 ALA 14 1HB ALA 14 -5.374 5.431 5.101
95 HB2 ALA 14 2HB ALA 14 -7.109 5.637 5.345
96 HB3 ALA 14 3HB ALA 14 -6.500 5.047 3.799
97 H TYR 15 H TYR 15 -6.196 6.845 1.607
98 HA TYR 15 HA TYR 15 -3.372 6.653 1.228
99 HD1 TYR 15 2HD TYR 15 -2.356 5.203 -0.713
100 HD2 TYR 15 1HD TYR 15 -4.804 8.085 -2.664
101 HE1 TYR 15 2HE TYR 15 -0.708 5.364 -2.531
102 HE2 TYR 15 1HE TYR 15 -3.162 8.253 -4.487
103 HH TYR 15 HH TYR 15 -1.308 6.590 -5.453
104 HB2 TYR 15 1HB TYR 15 -4.914 5.478 -0.251
105 HB3 TYR 15 2HB TYR 15 -5.615 7.014 -0.769
106 H TRP 16 H TRP 16 -5.713 9.225 1.111
107 HA TRP 16 HA TRP 16 -3.999 11.074 -0.271
108 HD1 TRP 16 HD TRP 16 -7.780 10.012 -1.041
109 HE1 TRP 16 1HE TRP 16 -8.066 10.653 -3.518
110 HE3 TRP 16 3HE TRP 16 -4.578 13.993 -1.224
111 HZ2 TRP 16 2HZ TRP 16 -7.067 12.590 -5.311
112 HZ3 TRP 16 3HZ TRP 16 -4.300 15.185 -3.358
113 HH2 TRP 16 HH TRP 16 -5.519 14.497 -5.357
114 HB2 TRP 16 1HB TRP 16 -6.687 11.208 1.040
115 HB3 TRP 16 2HB TRP 16 -5.821 12.713 0.732
116 H VAL 17 H VAL 17 -5.026 10.580 3.088
117 HA VAL 17 HA VAL 17 -3.602 12.785 4.155
118 HB VAL 17 HB VAL 17 -5.444 11.725 5.372
119 HG11 VAL 17 1HG1 VAL 17 -3.579 9.408 5.853
120 HG12 VAL 17 2HG1 VAL 17 -5.252 9.568 6.390
121 HG13 VAL 17 3HG1 VAL 17 -4.887 9.394 4.672
122 HG21 VAL 17 3HG2 VAL 17 -3.550 11.150 7.411
123 HG22 VAL 17 1HG2 VAL 17 -2.929 12.486 6.441
124 HG23 VAL 17 2HG2 VAL 17 -4.521 12.605 7.190
125 H GLY 18 H GLY 18 -2.758 9.427 3.543
126 HA2 GLY 18 2HA GLY 18 -0.344 9.399 5.031
127 HA3 GLY 18 3HA GLY 18 -0.775 8.283 3.744
128 H LYS 19 H LYS 19 -1.036 10.083 1.624
129 HA LYS 19 HA LYS 19 1.707 10.420 0.909
130 HB2 LYS 19 1HB LYS 19 0.857 11.269 -1.213
131 HB3 LYS 19 2HB LYS 19 -0.004 9.795 -0.740
132 HG2 LYS 19 1HG LYS 19 -1.915 11.070 -0.012
133 HG3 LYS 19 2HG LYS 19 -1.050 12.587 -0.320
134 HD2 LYS 19 1HD LYS 19 -1.147 10.767 -2.627
135 HD3 LYS 19 2HD LYS 19 -2.729 11.358 -2.088
136 HE2 LYS 19 1HE LYS 19 -2.152 13.038 -3.544
137 HE3 LYS 19 2HE LYS 19 -1.485 13.677 -2.035
138 HZ1 LYS 19 3HZ LYS 19 0.508 13.705 -2.962
139 HZ2 LYS 19 1HZ LYS 19 -0.130 13.100 -4.408
140 HZ3 LYS 19 2HZ LYS 19 0.447 12.036 -3.227
141 H ALA 20 H ALA 20 -0.843 12.539 2.032
142 HA ALA 20 HA ALA 20 0.463 14.989 1.412
143 HB1 ALA 20 1HB ALA 20 -1.980 14.755 1.806
144 HB2 ALA 20 2HB ALA 20 -1.637 14.510 3.520
145 HB3 ALA 20 3HB ALA 20 -1.227 16.042 2.747
146 H LEU 21 H LEU 21 0.609 12.760 4.088
147 HA LEU 21 HA LEU 21 2.063 14.618 5.775
148 HG LEU 21 HG LEU 21 -0.284 13.916 6.839
149 HB2 LEU 21 1HB LEU 21 1.007 11.837 6.068
150 HB3 LEU 21 2HB LEU 21 2.289 12.397 7.156
151 HD11 LEU 21 1HD1 LEU 21 0.204 11.941 9.038
152 HD12 LEU 21 2HD1 LEU 21 -0.573 11.458 7.530
153 HD13 LEU 21 3HD1 LEU 21 -1.306 12.705 8.540
154 HD21 LEU 21 3HD2 LEU 21 0.630 15.295 8.316
155 HD22 LEU 21 1HD2 LEU 21 2.131 14.372 8.212
156 HD23 LEU 21 2HD2 LEU 21 0.925 13.961 9.432
157 H GLY 22 H GLY 22 2.713 12.031 3.554
158 HA2 GLY 22 2HA GLY 22 4.763 11.577 2.535
159 HA3 GLY 22 3HA GLY 22 5.554 12.601 3.726
160 H ASN 23 H ASN 23 3.525 9.677 3.958
161 HA ASN 23 HA ASN 23 5.502 8.552 5.805
162 HB2 ASN 23 1HB ASN 23 2.595 7.954 5.265
163 HB3 ASN 23 2HB ASN 23 3.614 6.838 6.180
164 HD21 ASN 23 1HD2 ASN 23 4.257 7.347 8.234
165 HD22 ASN 23 2HD2 ASN 23 3.631 8.697 9.113
166 H LEU 24 H LEU 24 6.027 8.624 2.977
167 HA LEU 24 HA LEU 24 6.869 5.950 2.594
168 HG LEU 24 HG LEU 24 4.748 7.969 0.346
169 HB2 LEU 24 1HB LEU 24 5.562 5.450 0.555
170 HB3 LEU 24 2HB LEU 24 4.581 5.519 2.028
171 HD11 LEU 24 1HD1 LEU 24 2.764 5.842 -0.339
172 HD12 LEU 24 2HD1 LEU 24 4.350 5.868 -1.108
173 HD13 LEU 24 3HD1 LEU 24 3.266 7.248 -1.276
174 HD21 LEU 24 3HD2 LEU 24 3.063 6.833 2.438
175 HD22 LEU 24 1HD2 LEU 24 2.149 7.507 1.089
176 HD23 LEU 24 2HD2 LEU 24 3.304 8.514 1.961
177 H SER 25 H SER 25 8.174 8.382 2.604
178 HA SER 25 HA SER 25 8.680 9.103 -0.175
179 HG SER 25 HG SER 25 10.114 10.793 3.177
180 HB2 SER 25 1HB SER 25 10.392 10.683 1.085
181 HB3 SER 25 2HB SER 25 8.659 11.056 1.056
182 H ASP 26 H ASP 26 10.283 7.574 2.559
183 HA ASP 26 HA ASP 26 12.791 7.281 1.175
184 HD2 ASP 26 HD ASP 26 14.540 9.100 3.229
185 HB2 ASP 26 1HB ASP 26 11.704 6.399 3.829
186 HB3 ASP 26 2HB ASP 26 13.191 5.674 3.206
187 H VAL 27 H VAL 27 9.915 5.375 1.688
188 HA VAL 27 HA VAL 27 10.979 2.858 0.946
189 HB VAL 27 HB VAL 27 8.807 3.211 2.153
190 HG11 VAL 27 1HG1 VAL 27 8.049 5.028 0.567
191 HG12 VAL 27 2HG1 VAL 27 7.652 3.743 -0.574
192 HG13 VAL 27 3HG1 VAL 27 6.839 3.817 0.990
193 HG21 VAL 27 3HG2 VAL 27 8.891 1.033 1.566
194 HG22 VAL 27 1HG2 VAL 27 7.606 1.498 0.451
195 HG23 VAL 27 2HG2 VAL 27 9.273 1.390 -0.118
196 H ASN 28 H ASN 28 9.701 5.562 -0.867
197 HA ASN 28 HA ASN 28 9.233 4.287 -3.318
198 HB2 ASN 28 1HB ASN 28 8.570 6.647 -2.627
199 HB3 ASN 28 2HB ASN 28 10.227 7.122 -3.016
200 HD21 ASN 28 1HD2 ASN 28 10.551 7.855 -4.979
201 HD22 ASN 28 2HD2 ASN 28 9.591 7.503 -6.372
202 H GLN 29 H GLN 29 12.172 5.602 -1.899
203 HA GLN 29 HA GLN 29 13.752 5.299 -4.263
204 HB2 GLN 29 1HB GLN 29 14.357 5.865 -1.371
205 HB3 GLN 29 2HB GLN 29 15.661 5.533 -2.520
206 HG2 GLN 29 1HG GLN 29 13.806 7.505 -3.554
207 HG3 GLN 29 2HG GLN 29 14.497 7.988 -1.999
208 HE21 GLN 29 1HE2 GLN 29 15.263 7.020 -5.278
209 HE22 GLN 29 2HE2 GLN 29 16.836 7.733 -5.324
210 H ALA 30 H ALA 30 13.009 3.309 -1.481
211 HA ALA 30 HA ALA 30 15.046 1.391 -1.771
212 HB1 ALA 30 1HB ALA 30 12.288 0.827 -0.712
213 HB2 ALA 30 2HB ALA 30 13.808 0.040 -0.279
214 HB3 ALA 30 3HB ALA 30 13.510 1.709 0.208
215 H SER 31 H SER 31 12.054 1.888 -3.465
216 HA SER 31 HA SER 31 11.583 -0.651 -4.503
217 HG SER 31 HG SER 31 11.286 2.839 -6.154
218 HB2 SER 31 1HB SER 31 10.077 0.352 -5.930
219 HB3 SER 31 2HB SER 31 10.271 1.643 -4.731
220 H ARG 32 H ARG 32 14.075 1.615 -5.230
221 HA ARG 32 HA ARG 32 14.736 0.684 -7.830
222 HE ARG 32 HE ARG 32 15.591 1.822 -9.756
223 HB2 ARG 32 1HB ARG 32 16.136 2.326 -5.746
224 HB3 ARG 32 2HB ARG 32 17.026 1.755 -7.164
225 HG2 ARG 32 1HG ARG 32 14.519 2.932 -7.963
226 HG3 ARG 32 2HG ARG 32 15.458 4.052 -6.960
227 HD2 ARG 32 1HD ARG 32 16.248 4.523 -9.093
228 HD3 ARG 32 2HD ARG 32 17.444 3.375 -8.477
229 HH11 ARG 32 1HH1 ARG 32 17.611 4.514 -10.645
230 HH12 ARG 32 2HH1 ARG 32 17.757 4.026 -12.300
231 HH21 ARG 32 1HH2 ARG 32 15.775 1.169 -11.933
232 HH22 ARG 32 2HH2 ARG 32 16.711 2.122 -13.033
233 H ILE 33 H ILE 33 15.173 -0.628 -4.727
234 HA ILE 33 HA ILE 33 16.931 -2.694 -5.844
235 HB ILE 33 HB ILE 33 17.338 -1.714 -3.034
236 HG12 ILE 33 1HG1 ILE 33 19.483 -0.687 -4.275
237 HG13 ILE 33 2HG1 ILE 33 18.299 -0.526 -5.585
238 HG21 ILE 33 1HG2 ILE 33 18.621 -3.633 -4.867
239 HG22 ILE 33 2HG2 ILE 33 19.712 -2.655 -3.885
240 HG23 ILE 33 3HG2 ILE 33 18.483 -3.655 -3.108
241 HD11 ILE 33 3HD1 ILE 33 17.774 0.510 -2.819
242 HD12 ILE 33 1HD1 ILE 33 18.566 1.472 -4.070
243 HD13 ILE 33 2HD1 ILE 33 16.918 0.888 -4.313
244 H ASN 34 H ASN 34 14.011 -2.193 -4.823
245 HA ASN 34 HA ASN 34 13.877 -4.571 -3.090
246 HB2 ASN 34 1HB ASN 34 12.450 -1.989 -3.081
247 HB3 ASN 34 2HB ASN 34 11.416 -3.404 -2.849
248 HD21 ASN 34 1HD2 ASN 34 14.399 -1.919 -1.670
249 HD22 ASN 34 2HD2 ASN 34 14.230 -2.462 -0.038
250 H ARG 35 H ARG 35 12.842 -3.131 -6.061
251 HA ARG 35 HA ARG 35 10.607 -4.697 -6.659
252 HE ARG 35 HE ARG 35 9.046 -1.635 -9.584
253 HB2 ARG 35 1HB ARG 35 11.800 -2.656 -7.898
254 HB3 ARG 35 2HB ARG 35 12.478 -3.979 -8.859
255 HG2 ARG 35 1HG ARG 35 10.167 -4.785 -9.305
256 HG3 ARG 35 2HG ARG 35 9.562 -3.342 -8.470
257 HD2 ARG 35 1HD ARG 35 11.552 -2.660 -10.476
258 HD3 ARG 35 2HD ARG 35 10.196 -3.561 -11.167
259 HH11 ARG 35 1HH1 ARG 35 11.219 -1.683 -12.302
260 HH12 ARG 35 2HH1 ARG 35 10.692 -0.154 -12.919
261 HH21 ARG 35 1HH2 ARG 35 8.341 0.381 -10.384
262 HH22 ARG 35 2HH2 ARG 35 9.055 1.021 -11.826
263 H LYS 36 H LYS 36 13.986 -5.457 -6.683
264 HA LYS 36 HA LYS 36 13.370 -8.233 -7.249
265 HB2 LYS 36 1HB LYS 36 15.278 -6.628 -8.966
266 HB3 LYS 36 2HB LYS 36 15.149 -8.395 -8.989
267 HG2 LYS 36 1HG LYS 36 12.771 -8.176 -9.663
268 HG3 LYS 36 2HG LYS 36 13.010 -6.423 -9.766
269 HD2 LYS 36 1HD LYS 36 14.293 -6.553 -11.656
270 HD3 LYS 36 2HD LYS 36 14.914 -8.162 -11.243
271 HE2 LYS 36 1HE LYS 36 13.020 -9.255 -12.048
272 HE3 LYS 36 2HE LYS 36 12.024 -7.797 -11.931
273 HZ1 LYS 36 3HZ LYS 36 14.245 -7.511 -13.731
274 HZ2 LYS 36 1HZ LYS 36 12.608 -7.152 -13.967
275 HZ3 LYS 36 2HZ LYS 36 13.170 -8.732 -14.196
276 H LYS 37 H LYS 37 13.997 -8.280 -4.987
277 HA LYS 37 HA LYS 37 16.764 -8.958 -4.684
278 HB2 LYS 37 1HB LYS 37 16.806 -6.475 -4.440
279 HB3 LYS 37 2HB LYS 37 15.716 -6.638 -3.054
280 HG2 LYS 37 1HG LYS 37 17.870 -6.396 -2.142
281 HG3 LYS 37 2HG LYS 37 17.472 -8.118 -2.002
282 HD2 LYS 37 1HD LYS 37 19.216 -8.710 -3.262
283 HD3 LYS 37 2HD LYS 37 18.749 -7.563 -4.530
284 HE2 LYS 37 1HE LYS 37 19.858 -5.741 -3.328
285 HE3 LYS 37 2HE LYS 37 20.291 -6.867 -2.032
286 HZ1 LYS 37 3HZ LYS 37 21.375 -8.162 -4.016
287 HZ2 LYS 37 1HZ LYS 37 22.194 -6.891 -3.258
288 HZ3 LYS 37 2HZ LYS 37 21.405 -6.629 -4.730
289 H LYS 38 H LYS 38 15.407 -10.896 -4.288
290 HA LYS 38 HA LYS 38 13.698 -11.142 -2.075
291 HB2 LYS 38 1HB LYS 38 14.071 -12.745 -4.063
292 HB3 LYS 38 2HB LYS 38 15.402 -13.399 -3.097
293 HG2 LYS 38 1HG LYS 38 13.574 -13.586 -1.230
294 HG3 LYS 38 2HG LYS 38 12.467 -13.538 -2.613
295 HD2 LYS 38 1HD LYS 38 13.608 -15.445 -3.628
296 HD3 LYS 38 2HD LYS 38 14.751 -15.483 -2.274
297 HE2 LYS 38 1HE LYS 38 13.326 -16.603 -0.957
298 HE3 LYS 38 2HE LYS 38 11.991 -15.523 -1.374
299 HZ1 LYS 38 3HZ LYS 38 12.497 -17.087 -3.616
300 HZ2 LYS 38 1HZ LYS 38 11.145 -17.141 -2.598
301 HZ3 LYS 38 2HZ LYS 38 12.476 -18.138 -2.290
302 H HIS 39 H HIS 39 17.162 -11.176 -2.339
303 HA HIS 39 HA HIS 39 17.512 -12.211 0.357
304 HD1 HIS 39 1HD HIS 39 19.656 -13.440 1.419
305 HD2 HIS 39 2HD HIS 39 19.496 -14.405 -2.619
306 HE1 HIS 39 1HE HIS 39 20.080 -15.915 1.301
307 HE2 HIS 39 2HE HIS 39 19.983 -16.505 -1.166
308 HB2 HIS 39 1HB HIS 39 19.217 -11.780 -2.001
309 HB3 HIS 39 2HB HIS 39 20.000 -11.392 -0.465
Start of MODEL 8
1 H1 GLY 1 H GLY 1 -24.831 -1.218 9.145
2 HA2 GLY 1 2HA GLY 1 -22.681 -2.038 8.950
3 HA3 GLY 1 3HA GLY 1 -23.472 -3.224 7.923
4 H THR 2 H THR 2 -20.786 -1.794 7.871
5 HA THR 2 HA THR 2 -20.493 -1.685 5.078
6 HB THR 2 HB THR 2 -19.788 0.949 5.394
7 HG1 THR 2 1HG THR 2 -20.998 0.883 7.435
8 HG21 THR 2 3HG2 THR 2 -20.901 0.819 3.462
9 HG22 THR 2 1HG2 THR 2 -22.383 1.039 4.393
10 HG23 THR 2 2HG2 THR 2 -21.816 -0.588 4.007
11 H TRP 3 H TRP 3 -19.212 -2.679 7.520
12 HA TRP 3 HA TRP 3 -16.788 -1.250 7.947
13 HD1 TRP 3 HD TRP 3 -19.612 -3.735 10.152
14 HE1 TRP 3 1HE TRP 3 -20.070 -2.321 12.255
15 HE3 TRP 3 3HE TRP 3 -15.338 -0.932 10.189
16 HZ2 TRP 3 2HZ TRP 3 -18.788 -0.286 13.732
17 HZ3 TRP 3 3HZ TRP 3 -15.032 0.727 11.980
18 HH2 TRP 3 HH TRP 3 -16.722 1.041 13.714
19 HB2 TRP 3 1HB TRP 3 -17.579 -4.103 8.585
20 HB3 TRP 3 2HB TRP 3 -16.063 -3.360 9.100
21 H ASP 4 H ASP 4 -17.837 -3.607 5.644
22 HA ASP 4 HA ASP 4 -15.226 -4.467 4.845
23 HD2 ASP 4 HD ASP 4 -15.332 -7.597 2.491
24 HB2 ASP 4 1HB ASP 4 -17.380 -5.772 4.542
25 HB3 ASP 4 2HB ASP 4 -17.767 -4.657 3.225
26 H ASP 5 H ASP 5 -17.594 -2.148 3.598
27 HA ASP 5 HA ASP 5 -15.911 -1.372 1.393
28 HD2 ASP 5 HD ASP 5 -19.521 -2.585 -0.087
29 HB2 ASP 5 1HB ASP 5 -18.570 -0.503 2.472
30 HB3 ASP 5 2HB ASP 5 -17.708 0.559 1.350
31 H ILE 6 H ILE 6 -16.855 0.033 4.505
32 HA ILE 6 HA ILE 6 -15.300 2.408 4.135
33 HB ILE 6 HB ILE 6 -16.503 1.248 6.650
34 HG12 ILE 6 1HG1 ILE 6 -17.465 3.516 4.892
35 HG13 ILE 6 2HG1 ILE 6 -18.113 1.868 4.840
36 HG21 ILE 6 1HG2 ILE 6 -14.818 2.694 7.386
37 HG22 ILE 6 2HG2 ILE 6 -15.123 3.852 6.092
38 HG23 ILE 6 3HG2 ILE 6 -16.281 3.681 7.411
39 HD11 ILE 6 3HD1 ILE 6 -19.646 2.849 6.202
40 HD12 ILE 6 1HD1 ILE 6 -18.488 2.283 7.408
41 HD13 ILE 6 2HD1 ILE 6 -18.479 3.972 6.896
42 H GLY 7 H GLY 7 -14.758 -0.747 5.533
43 HA2 GLY 7 2HA GLY 7 -12.328 0.013 6.887
44 HA3 GLY 7 3HA GLY 7 -12.947 -1.618 6.689
45 H GLN 8 H GLN 8 -13.115 -1.798 3.937
46 HA GLN 8 HA GLN 8 -10.358 -2.232 3.278
47 HB2 GLN 8 1HB GLN 8 -12.272 -3.735 2.613
48 HB3 GLN 8 2HB GLN 8 -12.743 -2.490 1.445
49 HG2 GLN 8 1HG GLN 8 -11.505 -3.810 0.078
50 HG3 GLN 8 2HG GLN 8 -10.229 -2.747 0.687
51 HE21 GLN 8 1HE2 GLN 8 -9.460 -5.086 -0.317
52 HE22 GLN 8 2HE2 GLN 8 -8.970 -6.176 0.931
53 H GLY 9 H GLY 9 -10.030 0.224 3.607
54 HA2 GLY 9 2HA GLY 9 -9.660 1.360 0.987
55 HA3 GLY 9 3HA GLY 9 -10.855 2.214 1.948
56 H ILE 10 H ILE 10 -9.812 2.204 4.442
57 HA ILE 10 HA ILE 10 -8.006 4.302 4.428
58 HB ILE 10 HB ILE 10 -8.389 2.256 6.617
59 HG12 ILE 10 1HG1 ILE 10 -9.666 4.982 6.362
60 HG13 ILE 10 2HG1 ILE 10 -10.441 3.504 5.766
61 HG21 ILE 10 1HG2 ILE 10 -7.775 4.523 7.908
62 HG22 ILE 10 2HG2 ILE 10 -6.571 3.329 7.425
63 HG23 ILE 10 3HG2 ILE 10 -6.838 4.760 6.433
64 HD11 ILE 10 3HD1 ILE 10 -9.515 3.450 8.566
65 HD12 ILE 10 1HD1 ILE 10 -10.887 4.495 8.201
66 HD13 ILE 10 2HD1 ILE 10 -10.967 2.772 7.832
67 H GLY 11 H GLY 11 -7.426 0.878 4.211
68 HA2 GLY 11 2HA GLY 11 -4.714 0.834 4.981
69 HA3 GLY 11 3HA GLY 11 -5.504 -0.346 3.946
70 H ARG 12 H ARG 12 -6.162 1.010 1.729
71 HA ARG 12 HA ARG 12 -3.605 1.401 0.482
72 HE ARG 12 HE ARG 12 -3.928 -1.534 0.659
73 HB2 ARG 12 1HB ARG 12 -6.383 1.781 -0.662
74 HB3 ARG 12 2HB ARG 12 -4.879 1.660 -1.585
75 HG2 ARG 12 1HG ARG 12 -5.766 -0.563 0.229
76 HG3 ARG 12 2HG ARG 12 -6.377 -0.412 -1.428
77 HD2 ARG 12 1HD ARG 12 -4.559 -1.504 -2.125
78 HD3 ARG 12 2HD ARG 12 -3.616 -0.086 -1.648
79 HH11 ARG 12 1HH1 ARG 12 -2.609 -2.130 -2.507
80 HH12 ARG 12 2HH1 ARG 12 -1.439 -3.278 -1.946
81 HH21 ARG 12 1HH2 ARG 12 -2.393 -3.044 1.410
82 HH22 ARG 12 2HH2 ARG 12 -1.318 -3.798 0.281
83 H VAL 13 H VAL 13 -6.231 3.438 1.581
84 HA VAL 13 HA VAL 13 -5.412 5.809 0.250
85 HB VAL 13 HB VAL 13 -7.070 5.500 2.758
86 HG11 VAL 13 1HG1 VAL 13 -7.883 7.753 2.265
87 HG12 VAL 13 2HG1 VAL 13 -6.141 7.748 2.542
88 HG13 VAL 13 3HG1 VAL 13 -6.773 7.858 0.898
89 HG21 VAL 13 3HG2 VAL 13 -8.473 6.260 0.343
90 HG22 VAL 13 1HG2 VAL 13 -7.650 4.710 0.159
91 HG23 VAL 13 2HG2 VAL 13 -8.804 4.945 1.472
92 H ALA 14 H ALA 14 -4.763 4.460 3.454
93 HA ALA 14 HA ALA 14 -3.486 6.609 4.644
94 HB1 ALA 14 1HB ALA 14 -4.044 4.587 5.862
95 HB2 ALA 14 2HB ALA 14 -2.846 3.677 4.939
96 HB3 ALA 14 3HB ALA 14 -2.328 4.953 6.040
97 H TYR 15 H TYR 15 -2.300 4.372 2.228
98 HA TYR 15 HA TYR 15 0.449 5.104 2.470
99 HD1 TYR 15 2HD TYR 15 0.292 4.963 -1.518
100 HD2 TYR 15 1HD TYR 15 2.158 2.619 1.504
101 HE1 TYR 15 2HE TYR 15 2.369 4.929 -2.836
102 HE2 TYR 15 1HE TYR 15 4.241 2.581 0.195
103 HH TYR 15 HH TYR 15 5.193 4.405 -1.801
104 HB2 TYR 15 1HB TYR 15 -0.220 2.941 1.542
105 HB3 TYR 15 2HB TYR 15 -1.031 3.755 0.201
106 H TRP 16 H TRP 16 -2.287 6.323 0.696
107 HA TRP 16 HA TRP 16 -0.732 7.920 -1.118
108 HD1 TRP 16 HD TRP 16 -3.561 5.281 -1.868
109 HE1 TRP 16 1HE TRP 16 -3.217 4.713 -4.355
110 HE3 TRP 16 3HE TRP 16 -1.820 9.804 -3.499
111 HZ2 TRP 16 2HZ TRP 16 -2.324 6.010 -6.698
112 HZ3 TRP 16 3HZ TRP 16 -1.243 10.057 -5.877
113 HH2 TRP 16 HH TRP 16 -1.491 8.198 -7.443
114 HB2 TRP 16 1HB TRP 16 -3.644 7.568 -0.519
115 HB3 TRP 16 2HB TRP 16 -3.130 9.020 -1.378
116 H VAL 17 H VAL 17 -2.633 8.524 1.814
117 HA VAL 17 HA VAL 17 -2.224 11.326 1.857
118 HB VAL 17 HB VAL 17 -4.038 10.267 3.116
119 HG11 VAL 17 1HG1 VAL 17 -2.688 8.255 3.777
120 HG12 VAL 17 2HG1 VAL 17 -1.940 9.253 5.025
121 HG13 VAL 17 3HG1 VAL 17 -3.677 8.947 5.062
122 HG21 VAL 17 3HG2 VAL 17 -4.013 12.073 4.409
123 HG22 VAL 17 1HG2 VAL 17 -2.782 11.345 5.442
124 HG23 VAL 17 2HG2 VAL 17 -2.303 12.296 4.036
125 H GLY 18 H GLY 18 -0.425 8.599 3.154
126 HA2 GLY 18 2HA GLY 18 1.306 10.090 4.834
127 HA3 GLY 18 3HA GLY 18 1.604 8.468 4.226
128 H LYS 19 H LYS 19 1.607 8.986 1.480
129 HA LYS 19 HA LYS 19 4.259 9.990 1.160
130 HB2 LYS 19 1HB LYS 19 3.961 9.497 -1.211
131 HB3 LYS 19 2HB LYS 19 3.385 8.151 -0.215
132 HG2 LYS 19 1HG LYS 19 1.089 8.801 -0.550
133 HG3 LYS 19 2HG LYS 19 1.602 10.253 -1.426
134 HD2 LYS 19 1HD LYS 19 2.516 7.570 -2.389
135 HD3 LYS 19 2HD LYS 19 0.862 8.104 -2.733
136 HE2 LYS 19 1HE LYS 19 1.655 10.072 -3.871
137 HE3 LYS 19 2HE LYS 19 3.320 9.724 -3.381
138 HZ1 LYS 19 3HZ LYS 19 3.226 8.958 -5.545
139 HZ2 LYS 19 1HZ LYS 19 1.662 8.335 -5.384
140 HZ3 LYS 19 2HZ LYS 19 2.967 7.541 -4.658
141 H ALA 20 H ALA 20 1.043 11.265 0.632
142 HA ALA 20 HA ALA 20 1.813 13.521 -0.914
143 HB1 ALA 20 1HB ALA 20 -0.629 12.536 0.367
144 HB2 ALA 20 2HB ALA 20 -0.509 14.295 0.287
145 HB3 ALA 20 3HB ALA 20 -0.403 13.337 -1.189
146 H LEU 21 H LEU 21 1.763 12.837 2.494
147 HA LEU 21 HA LEU 21 1.990 15.604 3.288
148 HG LEU 21 HG LEU 21 1.405 15.975 5.531
149 HB2 LEU 21 1HB LEU 21 1.383 13.134 4.548
150 HB3 LEU 21 2HB LEU 21 2.811 13.810 5.350
151 HD11 LEU 21 1HD1 LEU 21 -0.603 13.966 4.651
152 HD12 LEU 21 2HD1 LEU 21 -0.488 15.688 4.287
153 HD13 LEU 21 3HD1 LEU 21 -1.074 15.159 5.863
154 HD21 LEU 21 3HD2 LEU 21 2.080 14.574 7.424
155 HD22 LEU 21 1HD2 LEU 21 0.685 13.531 7.148
156 HD23 LEU 21 2HD2 LEU 21 0.447 15.211 7.637
157 H GLY 22 H GLY 22 4.119 12.965 2.535
158 HA2 GLY 22 2HA GLY 22 6.397 12.990 2.156
159 HA3 GLY 22 3HA GLY 22 6.389 14.713 2.496
160 H ASN 23 H ASN 23 6.193 11.549 4.100
161 HA ASN 23 HA ASN 23 7.355 12.757 6.510
162 HB2 ASN 23 1HB ASN 23 5.843 10.190 6.016
163 HB3 ASN 23 2HB ASN 23 6.748 10.467 7.510
164 HD21 ASN 23 1HD2 ASN 23 6.233 12.531 8.657
165 HD22 ASN 23 2HD2 ASN 23 4.572 13.003 8.717
166 H LEU 24 H LEU 24 7.933 10.396 4.004
167 HA LEU 24 HA LEU 24 10.729 10.396 4.452
168 HG LEU 24 HG LEU 24 8.146 7.823 4.831
169 HB2 LEU 24 1HB LEU 24 10.849 7.887 4.937
170 HB3 LEU 24 2HB LEU 24 10.445 8.981 6.274
171 HD11 LEU 24 1HD1 LEU 24 9.539 5.877 4.834
172 HD12 LEU 24 2HD1 LEU 24 8.339 5.700 6.112
173 HD13 LEU 24 3HD1 LEU 24 9.997 6.146 6.515
174 HD21 LEU 24 3HD2 LEU 24 8.698 9.089 7.291
175 HD22 LEU 24 1HD2 LEU 24 8.166 7.449 7.658
176 HD23 LEU 24 2HD2 LEU 24 7.146 8.510 6.686
177 H SER 25 H SER 25 10.196 11.000 2.192
178 HA SER 25 HA SER 25 9.362 8.865 0.427
179 HG SER 25 HG SER 25 8.210 9.743 -1.067
180 HB2 SER 25 1HB SER 25 9.110 11.571 0.283
181 HB3 SER 25 2HB SER 25 10.530 11.314 -0.746
182 H ASP 26 H ASP 26 12.141 9.422 1.989
183 HA ASP 26 HA ASP 26 13.983 8.961 -0.203
184 HD2 ASP 26 HD ASP 26 15.189 12.546 2.085
185 HB2 ASP 26 1HB ASP 26 14.337 9.289 2.779
186 HB3 ASP 26 2HB ASP 26 15.675 8.856 1.709
187 H VAL 27 H VAL 27 11.867 7.027 1.223
188 HA VAL 27 HA VAL 27 13.417 4.648 0.659
189 HB VAL 27 HB VAL 27 12.673 3.618 2.886
190 HG11 VAL 27 1HG1 VAL 27 15.017 4.360 2.154
191 HG12 VAL 27 2HG1 VAL 27 14.759 5.750 3.212
192 HG13 VAL 27 3HG1 VAL 27 14.729 4.115 3.877
193 HG21 VAL 27 3HG2 VAL 27 11.155 5.375 3.590
194 HG22 VAL 27 1HG2 VAL 27 12.470 5.210 4.753
195 HG23 VAL 27 2HG2 VAL 27 12.476 6.543 3.600
196 H ASN 28 H ASN 28 10.382 6.026 1.845
197 HA ASN 28 HA ASN 28 8.763 3.773 1.381
198 HB2 ASN 28 1HB ASN 28 8.100 5.713 2.779
199 HB3 ASN 28 2HB ASN 28 7.956 6.688 1.311
200 HD21 ASN 28 1HD2 ASN 28 5.941 6.966 0.726
201 HD22 ASN 28 2HD2 ASN 28 4.670 5.800 0.846
202 H GLN 29 H GLN 29 9.911 6.319 -0.717
203 HA GLN 29 HA GLN 29 8.115 5.727 -2.869
204 HB2 GLN 29 1HB GLN 29 10.072 7.722 -2.253
205 HB3 GLN 29 2HB GLN 29 10.434 7.041 -3.847
206 HG2 GLN 29 1HG GLN 29 7.688 8.013 -3.090
207 HG3 GLN 29 2HG GLN 29 8.924 9.066 -3.792
208 HE21 GLN 29 1HE2 GLN 29 6.535 8.698 -5.058
209 HE22 GLN 29 2HE2 GLN 29 6.772 7.791 -6.506
210 H ALA 30 H ALA 30 11.254 4.623 -1.851
211 HA ALA 30 HA ALA 30 12.151 3.510 -4.272
212 HB1 ALA 30 1HB ALA 30 13.774 2.359 -2.994
213 HB2 ALA 30 2HB ALA 30 13.500 3.897 -2.172
214 HB3 ALA 30 3HB ALA 30 12.775 2.418 -1.539
215 H SER 31 H SER 31 9.838 2.418 -1.921
216 HA SER 31 HA SER 31 9.808 -0.319 -2.410
217 HG SER 31 HG SER 31 6.790 2.094 -1.666
218 HB2 SER 31 1HB SER 31 7.831 -0.379 -1.226
219 HB3 SER 31 2HB SER 31 8.441 1.209 -0.730
220 H ARG 32 H ARG 32 8.768 2.298 -4.395
221 HA ARG 32 HA ARG 32 6.930 0.877 -6.027
222 HE ARG 32 HE ARG 32 4.331 3.319 -8.371
223 HB2 ARG 32 1HB ARG 32 7.077 3.372 -5.831
224 HB3 ARG 32 2HB ARG 32 8.565 3.299 -6.785
225 HG2 ARG 32 1HG ARG 32 7.448 2.622 -8.724
226 HG3 ARG 32 2HG ARG 32 6.003 2.144 -7.819
227 HD2 ARG 32 1HD ARG 32 6.283 4.825 -7.190
228 HD3 ARG 32 2HD ARG 32 6.755 4.741 -8.893
229 HH11 ARG 32 1HH1 ARG 32 5.680 6.477 -8.950
230 HH12 ARG 32 2HH1 ARG 32 4.208 7.134 -9.583
231 HH21 ARG 32 1HH2 ARG 32 2.386 4.174 -9.202
232 HH22 ARG 32 2HH2 ARG 32 2.335 5.823 -9.725
233 H ILE 33 H ILE 33 10.323 0.842 -5.790
234 HA ILE 33 HA ILE 33 10.479 -0.780 -8.231
235 HB ILE 33 HB ILE 33 12.692 1.130 -7.539
236 HG12 ILE 33 1HG1 ILE 33 11.581 2.348 -9.654
237 HG13 ILE 33 2HG1 ILE 33 10.116 1.681 -8.912
238 HG21 ILE 33 1HG2 ILE 33 12.476 0.665 -10.299
239 HG22 ILE 33 2HG2 ILE 33 13.697 0.040 -9.192
240 HG23 ILE 33 3HG2 ILE 33 12.237 -0.896 -9.516
241 HD11 ILE 33 3HD1 ILE 33 12.019 3.699 -7.806
242 HD12 ILE 33 1HD1 ILE 33 10.266 3.791 -7.975
243 HD13 ILE 33 2HD1 ILE 33 10.981 2.753 -6.740
244 H ASN 34 H ASN 34 10.607 -0.997 -5.123
245 HA ASN 34 HA ASN 34 13.101 -2.559 -5.011
246 HB2 ASN 34 1HB ASN 34 11.749 -0.780 -3.087
247 HB3 ASN 34 2HB ASN 34 12.334 -2.300 -2.401
248 HD21 ASN 34 1HD2 ASN 34 13.370 0.415 -4.412
249 HD22 ASN 34 2HD2 ASN 34 15.008 0.424 -3.861
250 H ARG 35 H ARG 35 9.659 -2.633 -4.667
251 HA ARG 35 HA ARG 35 9.345 -4.994 -3.192
252 HE ARG 35 HE ARG 35 4.931 -3.567 -5.453
253 HB2 ARG 35 1HB ARG 35 7.619 -3.194 -4.068
254 HB3 ARG 35 2HB ARG 35 7.442 -4.345 -5.399
255 HG2 ARG 35 1HG ARG 35 7.177 -6.072 -3.404
256 HG3 ARG 35 2HG ARG 35 6.653 -4.607 -2.555
257 HD2 ARG 35 1HD ARG 35 5.482 -5.768 -5.091
258 HD3 ARG 35 2HD ARG 35 4.720 -5.669 -3.497
259 HH11 ARG 35 1HH1 ARG 35 4.488 -4.324 -2.083
260 HH12 ARG 35 2HH1 ARG 35 3.688 -2.831 -1.719
261 HH21 ARG 35 1HH2 ARG 35 3.877 -1.598 -4.985
262 HH22 ARG 35 2HH2 ARG 35 3.340 -1.283 -3.369
263 H LYS 36 H LYS 36 10.205 -4.450 -6.511
264 HA LYS 36 HA LYS 36 9.601 -7.072 -7.461
265 HB2 LYS 36 1HB LYS 36 11.222 -4.761 -8.501
266 HB3 LYS 36 2HB LYS 36 11.274 -6.334 -9.313
267 HG2 LYS 36 1HG LYS 36 9.543 -5.575 -10.502
268 HG3 LYS 36 2HG LYS 36 8.589 -5.940 -9.052
269 HD2 LYS 36 1HD LYS 36 8.425 -3.742 -8.419
270 HD3 LYS 36 2HD LYS 36 9.957 -3.303 -9.195
271 HE2 LYS 36 1HE LYS 36 8.782 -2.470 -10.899
272 HE3 LYS 36 2HE LYS 36 8.301 -4.129 -11.284
273 HZ1 LYS 36 3HZ LYS 36 6.739 -3.019 -9.162
274 HZ2 LYS 36 1HZ LYS 36 6.236 -3.745 -10.604
275 HZ3 LYS 36 2HZ LYS 36 6.626 -2.099 -10.579
276 H LYS 37 H LYS 37 12.286 -5.627 -5.808
277 HA LYS 37 HA LYS 37 14.221 -6.477 -4.970
278 HB2 LYS 37 1HB LYS 37 12.439 -8.287 -4.324
279 HB3 LYS 37 2HB LYS 37 13.284 -9.264 -5.536
280 HG2 LYS 37 1HG LYS 37 14.670 -7.942 -3.205
281 HG3 LYS 37 2HG LYS 37 14.048 -9.601 -3.179
282 HD2 LYS 37 1HD LYS 37 15.456 -9.979 -5.294
283 HD3 LYS 37 2HD LYS 37 16.260 -8.458 -4.861
284 HE2 LYS 37 1HE LYS 37 17.087 -9.333 -2.830
285 HE3 LYS 37 2HE LYS 37 15.985 -10.716 -2.899
286 HZ1 LYS 37 3HZ LYS 37 17.704 -11.808 -3.766
287 HZ2 LYS 37 1HZ LYS 37 18.576 -10.395 -4.085
288 HZ3 LYS 37 2HZ LYS 37 17.422 -10.944 -5.191
289 H LYS 38 H LYS 38 15.408 -5.659 -6.756
290 HA LYS 38 HA LYS 38 16.428 -7.780 -8.521
291 HB2 LYS 38 1HB LYS 38 15.499 -5.015 -9.231
292 HB3 LYS 38 2HB LYS 38 16.750 -5.810 -10.200
293 HG2 LYS 38 1HG LYS 38 14.116 -7.139 -9.627
294 HG3 LYS 38 2HG LYS 38 14.334 -6.022 -10.983
295 HD2 LYS 38 1HD LYS 38 16.462 -8.006 -10.847
296 HD3 LYS 38 2HD LYS 38 14.857 -8.742 -10.998
297 HE2 LYS 38 1HE LYS 38 15.395 -8.430 -13.217
298 HE3 LYS 38 2HE LYS 38 14.522 -6.933 -12.858
299 HZ1 LYS 38 3HZ LYS 38 16.861 -6.919 -14.032
300 HZ2 LYS 38 1HZ LYS 38 17.415 -6.942 -12.434
301 HZ3 LYS 38 2HZ LYS 38 16.405 -5.692 -12.961
302 H HIS 39 H HIS 39 18.000 -7.789 -6.662
303 HA HIS 39 HA HIS 39 20.034 -7.301 -5.760
304 HD1 HIS 39 1HD HIS 39 21.823 -8.150 -5.457
305 HD2 HIS 39 2HD HIS 39 23.524 -6.157 -8.682
306 HE1 HIS 39 1HE HIS 39 24.309 -8.282 -5.094
307 HE2 HIS 39 2HE HIS 39 25.349 -7.064 -7.063
308 HB2 HIS 39 1HB HIS 39 20.469 -7.689 -8.308
309 HB3 HIS 39 2HB HIS 39 20.790 -5.951 -8.329
Start of MODEL 9
1 H1 GLY 1 H GLY 1 -21.462 -7.247 6.871
2 HA2 GLY 1 2HA GLY 1 -19.560 -6.463 7.918
3 HA3 GLY 1 3HA GLY 1 -18.758 -7.277 6.584
4 H THR 2 H THR 2 -19.172 -4.363 8.141
5 HA THR 2 HA THR 2 -19.101 -2.484 6.067
6 HB THR 2 HB THR 2 -17.892 -1.029 7.813
7 HG1 THR 2 1HG THR 2 -17.212 -3.024 8.995
8 HG21 THR 2 3HG2 THR 2 -20.611 -2.252 8.190
9 HG22 THR 2 1HG2 THR 2 -20.194 -0.667 7.542
10 HG23 THR 2 2HG2 THR 2 -20.010 -0.990 9.266
11 H TRP 3 H TRP 3 -16.729 -4.696 7.133
12 HA TRP 3 HA TRP 3 -14.331 -3.424 6.669
13 HD1 TRP 3 HD TRP 3 -16.458 -7.042 7.904
14 HE1 TRP 3 1HE TRP 3 -16.036 -7.251 10.434
15 HE3 TRP 3 3HE TRP 3 -12.068 -4.440 8.212
16 HZ2 TRP 3 2HZ TRP 3 -14.098 -6.423 12.312
17 HZ3 TRP 3 3HZ TRP 3 -10.995 -4.194 10.413
18 HH2 TRP 3 HH TRP 3 -11.992 -5.164 12.419
19 HB2 TRP 3 1HB TRP 3 -14.976 -6.275 5.863
20 HB3 TRP 3 2HB TRP 3 -13.382 -5.615 6.237
21 H ASP 4 H ASP 4 -16.705 -4.509 4.368
22 HA ASP 4 HA ASP 4 -15.122 -4.542 2.050
23 HD2 ASP 4 HD ASP 4 -16.335 -7.276 0.617
24 HB2 ASP 4 1HB ASP 4 -17.896 -4.785 2.707
25 HB3 ASP 4 2HB ASP 4 -17.733 -3.631 1.375
26 H ASP 5 H ASP 5 -17.116 -1.948 3.445
27 HA ASP 5 HA ASP 5 -16.244 -0.034 1.483
28 HD2 ASP 5 HD ASP 5 -17.794 3.578 4.064
29 HB2 ASP 5 1HB ASP 5 -18.439 0.302 2.308
30 HB3 ASP 5 2HB ASP 5 -17.907 0.160 3.988
31 H ILE 6 H ILE 6 -15.604 -0.622 4.922
32 HA ILE 6 HA ILE 6 -13.905 1.567 5.353
33 HB ILE 6 HB ILE 6 -13.783 -1.125 6.718
34 HG12 ILE 6 1HG1 ILE 6 -15.293 1.354 7.569
35 HG13 ILE 6 2HG1 ILE 6 -16.042 -0.007 6.718
36 HG21 ILE 6 1HG2 ILE 6 -11.857 -0.033 7.381
37 HG22 ILE 6 2HG2 ILE 6 -12.612 1.558 7.318
38 HG23 ILE 6 3HG2 ILE 6 -13.004 0.448 8.631
39 HD11 ILE 6 3HD1 ILE 6 -16.479 -0.197 9.072
40 HD12 ILE 6 1HD1 ILE 6 -15.397 -1.496 8.568
41 HD13 ILE 6 2HD1 ILE 6 -14.755 -0.099 9.433
42 H GLY 7 H GLY 7 -13.351 -1.533 3.866
43 HA2 GLY 7 2HA GLY 7 -10.469 -1.316 3.975
44 HA3 GLY 7 3HA GLY 7 -11.394 -2.558 3.144
45 H GLN 8 H GLN 8 -13.007 -0.760 1.592
46 HA GLN 8 HA GLN 8 -11.171 -0.305 -0.563
47 HB2 GLN 8 1HB GLN 8 -13.665 -1.059 -0.643
48 HB3 GLN 8 2HB GLN 8 -14.005 0.678 -0.556
49 HG2 GLN 8 1HG GLN 8 -13.708 0.849 -2.738
50 HG3 GLN 8 2HG GLN 8 -12.032 0.322 -2.539
51 HE21 GLN 8 1HE2 GLN 8 -11.533 -1.895 -2.757
52 HE22 GLN 8 2HE2 GLN 8 -12.564 -2.956 -3.648
53 H GLY 9 H GLY 9 -9.953 1.243 0.977
54 HA2 GLY 9 2HA GLY 9 -10.072 3.820 -0.043
55 HA3 GLY 9 3HA GLY 9 -11.014 3.836 1.442
56 H ILE 10 H ILE 10 -9.488 2.010 2.942
57 HA ILE 10 HA ILE 10 -7.500 3.725 3.973
58 HB ILE 10 HB ILE 10 -8.620 2.070 5.376
59 HG12 ILE 10 1HG1 ILE 10 -5.732 1.236 5.302
60 HG13 ILE 10 2HG1 ILE 10 -6.175 2.897 5.733
61 HG21 ILE 10 1HG2 ILE 10 -7.059 -0.013 3.859
62 HG22 ILE 10 2HG2 ILE 10 -8.167 -0.290 5.201
63 HG23 ILE 10 3HG2 ILE 10 -8.781 0.300 3.657
64 HD11 ILE 10 3HD1 ILE 10 -5.862 1.051 7.572
65 HD12 ILE 10 1HD1 ILE 10 -7.104 2.293 7.722
66 HD13 ILE 10 2HD1 ILE 10 -7.535 0.678 7.160
67 H GLY 11 H GLY 11 -7.453 1.428 1.425
68 HA2 GLY 11 2HA GLY 11 -4.548 1.122 1.516
69 HA3 GLY 11 3HA GLY 11 -5.647 0.303 0.415
70 H ARG 12 H ARG 12 -5.993 3.713 0.837
71 HA ARG 12 HA ARG 12 -4.295 4.380 -1.412
72 HE ARG 12 HE ARG 12 -9.162 2.953 -2.405
73 HB2 ARG 12 1HB ARG 12 -7.248 4.976 -1.605
74 HB3 ARG 12 2HB ARG 12 -6.010 5.201 -2.849
75 HG2 ARG 12 1HG ARG 12 -5.704 2.728 -2.923
76 HG3 ARG 12 2HG ARG 12 -7.081 2.586 -1.814
77 HD2 ARG 12 1HD ARG 12 -7.473 4.226 -4.267
78 HD3 ARG 12 2HD ARG 12 -7.352 2.471 -4.464
79 HH11 ARG 12 1HH1 ARG 12 -8.879 3.523 -5.827
80 HH12 ARG 12 2HH1 ARG 12 -10.588 3.473 -6.109
81 HH21 ARG 12 1HH2 ARG 12 -11.414 2.885 -2.763
82 HH22 ARG 12 2HH2 ARG 12 -12.029 3.112 -4.366
83 H VAL 13 H VAL 13 -6.780 5.438 0.874
84 HA VAL 13 HA VAL 13 -6.341 8.198 0.693
85 HB VAL 13 HB VAL 13 -7.248 6.606 3.095
86 HG11 VAL 13 1HG1 VAL 13 -6.509 8.818 3.750
87 HG12 VAL 13 2HG1 VAL 13 -7.490 9.550 2.479
88 HG13 VAL 13 3HG1 VAL 13 -8.268 8.725 3.831
89 HG21 VAL 13 3HG2 VAL 13 -9.232 6.379 2.112
90 HG22 VAL 13 1HG2 VAL 13 -9.287 8.092 1.695
91 HG23 VAL 13 2HG2 VAL 13 -8.485 6.948 0.619
92 H ALA 14 H ALA 14 -4.962 5.809 2.940
93 HA ALA 14 HA ALA 14 -3.404 7.491 4.485
94 HB1 ALA 14 1HB ALA 14 -1.893 5.148 4.110
95 HB2 ALA 14 2HB ALA 14 -2.993 5.530 5.434
96 HB3 ALA 14 3HB ALA 14 -3.589 4.676 4.010
97 H TYR 15 H TYR 15 -2.826 6.276 1.253
98 HA TYR 15 HA TYR 15 -0.081 7.045 1.127
99 HD1 TYR 15 2HD TYR 15 1.589 6.715 -0.516
100 HD2 TYR 15 1HD TYR 15 -1.714 6.999 -3.182
101 HE1 TYR 15 2HE TYR 15 3.104 7.463 -2.304
102 HE2 TYR 15 1HE TYR 15 -0.208 7.745 -4.978
103 HH TYR 15 HH TYR 15 1.873 8.263 -5.541
104 HB2 TYR 15 1HB TYR 15 -0.843 5.320 -0.353
105 HB3 TYR 15 2HB TYR 15 -2.106 6.365 -1.008
106 H TRP 16 H TRP 16 -3.123 8.623 0.458
107 HA TRP 16 HA TRP 16 -1.977 10.837 -0.955
108 HD1 TRP 16 HD TRP 16 -5.028 8.495 -1.932
109 HE1 TRP 16 1HE TRP 16 -5.246 8.846 -4.474
110 HE3 TRP 16 3HE TRP 16 -3.443 13.347 -2.222
111 HZ2 TRP 16 2HZ TRP 16 -4.805 10.904 -6.351
112 HZ3 TRP 16 3HZ TRP 16 -3.369 14.432 -4.429
113 HH2 TRP 16 HH TRP 16 -4.036 13.236 -6.449
114 HB2 TRP 16 1HB TRP 16 -4.684 10.136 0.110
115 HB3 TRP 16 2HB TRP 16 -4.344 11.826 -0.270
116 H VAL 17 H VAL 17 -3.150 10.301 2.348
117 HA VAL 17 HA VAL 17 -2.663 12.937 3.264
118 HB VAL 17 HB VAL 17 -4.177 11.417 4.446
119 HG11 VAL 17 1HG1 VAL 17 -2.827 9.363 4.073
120 HG12 VAL 17 2HG1 VAL 17 -1.710 9.920 5.320
121 HG13 VAL 17 3HG1 VAL 17 -3.385 9.556 5.735
122 HG21 VAL 17 3HG2 VAL 17 -2.153 13.045 5.628
123 HG22 VAL 17 1HG2 VAL 17 -3.800 12.747 6.186
124 HG23 VAL 17 2HG2 VAL 17 -2.490 11.684 6.698
125 H GLY 18 H GLY 18 -0.695 10.028 3.110
126 HA2 GLY 18 2HA GLY 18 1.408 10.938 4.778
127 HA3 GLY 18 3HA GLY 18 1.519 9.646 3.590
128 H LYS 19 H LYS 19 0.922 11.076 1.269
129 HA LYS 19 HA LYS 19 3.460 12.274 0.747
130 HB2 LYS 19 1HB LYS 19 2.627 12.612 -1.519
131 HB3 LYS 19 2HB LYS 19 2.255 10.975 -0.955
132 HG2 LYS 19 1HG LYS 19 -0.042 11.576 -0.534
133 HG3 LYS 19 2HG LYS 19 0.301 13.267 -0.940
134 HD2 LYS 19 1HD LYS 19 1.162 11.524 -3.078
135 HD3 LYS 19 2HD LYS 19 -0.542 11.240 -2.680
136 HE2 LYS 19 1HE LYS 19 -0.991 13.659 -2.887
137 HE3 LYS 19 2HE LYS 19 0.705 13.911 -3.326
138 HZ1 LYS 19 3HZ LYS 19 -1.016 13.709 -5.188
139 HZ2 LYS 19 1HZ LYS 19 -0.985 12.049 -4.869
140 HZ3 LYS 19 2HZ LYS 19 0.429 12.843 -5.349
141 H ALA 20 H ALA 20 0.239 13.475 1.412
142 HA ALA 20 HA ALA 20 0.738 16.171 0.636
143 HB1 ALA 20 1HB ALA 20 -1.519 15.494 0.678
144 HB2 ALA 20 2HB ALA 20 -1.389 14.889 2.331
145 HB3 ALA 20 3HB ALA 20 -1.335 16.623 2.021
146 H LEU 21 H LEU 21 1.377 14.309 3.484
147 HA LEU 21 HA LEU 21 1.811 16.646 5.150
148 HG LEU 21 HG LEU 21 0.939 16.269 7.064
149 HB2 LEU 21 1HB LEU 21 1.415 13.815 5.552
150 HB3 LEU 21 2HB LEU 21 2.845 14.382 6.432
151 HD11 LEU 21 1HD1 LEU 21 -0.831 14.955 6.059
152 HD12 LEU 21 2HD1 LEU 21 -1.008 14.973 7.813
153 HD13 LEU 21 3HD1 LEU 21 -0.354 13.546 7.009
154 HD21 LEU 21 3HD2 LEU 21 2.316 14.036 8.361
155 HD22 LEU 21 1HD2 LEU 21 0.811 14.514 9.146
156 HD23 LEU 21 2HD2 LEU 21 2.090 15.701 8.900
157 H GLY 22 H GLY 22 3.646 14.409 3.221
158 HA2 GLY 22 2HA GLY 22 5.840 14.508 2.525
159 HA3 GLY 22 3HA GLY 22 5.964 16.069 3.325
160 H ASN 23 H ASN 23 5.897 12.580 3.991
161 HA ASN 23 HA ASN 23 8.134 12.859 5.791
162 HB2 ASN 23 1HB ASN 23 5.380 12.117 6.785
163 HB3 ASN 23 2HB ASN 23 6.848 11.633 7.643
164 HD21 ASN 23 1HD2 ASN 23 8.463 13.708 7.594
165 HD22 ASN 23 2HD2 ASN 23 7.748 15.100 8.327
166 H LEU 24 H LEU 24 7.546 11.486 3.304
167 HA LEU 24 HA LEU 24 8.742 9.002 3.853
168 HG LEU 24 HG LEU 24 5.479 9.502 2.212
169 HB2 LEU 24 1HB LEU 24 6.904 7.494 3.216
170 HB3 LEU 24 2HB LEU 24 6.589 8.367 4.727
171 HD11 LEU 24 1HD1 LEU 24 4.979 7.119 2.010
172 HD12 LEU 24 2HD1 LEU 24 3.524 8.058 2.341
173 HD13 LEU 24 3HD1 LEU 24 4.283 7.126 3.631
174 HD21 LEU 24 3HD2 LEU 24 4.764 10.840 3.873
175 HD22 LEU 24 1HD2 LEU 24 5.004 9.606 5.110
176 HD23 LEU 24 2HD2 LEU 24 3.551 9.580 4.110
177 H SER 25 H SER 25 9.658 10.701 2.156
178 HA SER 25 HA SER 25 8.593 10.188 -0.512
179 HG SER 25 HG SER 25 8.848 12.612 1.192
180 HB2 SER 25 1HB SER 25 10.911 11.968 0.302
181 HB3 SER 25 2HB SER 25 10.092 11.938 -1.270
182 H ASP 26 H ASP 26 11.376 9.484 1.491
183 HA ASP 26 HA ASP 26 13.025 8.429 -0.562
184 HD2 ASP 26 HD ASP 26 15.526 10.341 0.166
185 HB2 ASP 26 1HB ASP 26 13.009 8.294 2.433
186 HB3 ASP 26 2HB ASP 26 14.077 7.218 1.522
187 H VAL 27 H VAL 27 10.536 7.071 1.495
188 HA VAL 27 HA VAL 27 11.082 4.339 0.959
189 HB VAL 27 HB VAL 27 9.680 5.186 2.863
190 HG11 VAL 27 1HG1 VAL 27 8.350 6.798 1.568
191 HG12 VAL 27 2HG1 VAL 27 7.560 5.457 0.733
192 HG13 VAL 27 3HG1 VAL 27 7.336 5.672 2.470
193 HG21 VAL 27 3HG2 VAL 27 9.722 2.816 2.175
194 HG22 VAL 27 1HG2 VAL 27 8.164 3.296 2.849
195 HG23 VAL 27 2HG2 VAL 27 8.353 3.122 1.104
196 H ASN 28 H ASN 28 9.227 6.804 -0.691
197 HA ASN 28 HA ASN 28 7.764 5.075 -2.397
198 HB2 ASN 28 1HB ASN 28 7.307 7.541 -1.876
199 HB3 ASN 28 2HB ASN 28 8.556 7.905 -3.070
200 HD21 ASN 28 1HD2 ASN 28 7.867 8.260 -5.041
201 HD22 ASN 28 2HD2 ASN 28 6.412 7.646 -5.743
202 H GLN 29 H GLN 29 10.884 6.701 -2.683
203 HA GLN 29 HA GLN 29 11.306 5.830 -5.390
204 HB2 GLN 29 1HB GLN 29 13.501 6.828 -5.188
205 HB3 GLN 29 2HB GLN 29 12.287 7.922 -4.502
206 HG2 GLN 29 1HG GLN 29 12.930 7.430 -2.286
207 HG3 GLN 29 2HG GLN 29 13.889 6.036 -2.803
208 HE21 GLN 29 1HE2 GLN 29 15.927 6.339 -3.645
209 HE22 GLN 29 2HE2 GLN 29 16.758 7.851 -3.562
210 H ALA 30 H ALA 30 11.969 4.606 -2.216
211 HA ALA 30 HA ALA 30 14.066 2.831 -2.820
212 HB1 ALA 30 1HB ALA 30 13.636 1.812 -0.730
213 HB2 ALA 30 2HB ALA 30 13.260 3.524 -0.530
214 HB3 ALA 30 3HB ALA 30 11.957 2.355 -0.728
215 H SER 31 H SER 31 10.639 2.658 -3.363
216 HA SER 31 HA SER 31 10.254 -0.086 -3.595
217 HG SER 31 HG SER 31 7.965 2.260 -5.963
218 HB2 SER 31 1HB SER 31 8.216 0.408 -4.549
219 HB3 SER 31 2HB SER 31 8.598 1.974 -3.807
220 H ARG 32 H ARG 32 11.965 2.094 -5.644
221 HA ARG 32 HA ARG 32 11.847 0.582 -8.046
222 HE ARG 32 HE ARG 32 15.610 1.345 -9.931
223 HB2 ARG 32 1HB ARG 32 12.901 3.057 -7.229
224 HB3 ARG 32 2HB ARG 32 14.283 2.112 -7.806
225 HG2 ARG 32 1HG ARG 32 11.759 2.411 -9.418
226 HG3 ARG 32 2HG ARG 32 13.098 3.565 -9.509
227 HD2 ARG 32 1HD ARG 32 13.448 0.594 -9.941
228 HD3 ARG 32 2HD ARG 32 13.101 1.736 -11.249
229 HH11 ARG 32 1HH1 ARG 32 13.632 3.665 -11.610
230 HH12 ARG 32 2HH1 ARG 32 14.974 4.625 -12.137
231 HH21 ARG 32 1HH2 ARG 32 17.386 2.599 -10.618
232 HH22 ARG 32 2HH2 ARG 32 17.109 4.016 -11.574
233 H ILE 33 H ILE 33 13.521 0.148 -5.118
234 HA ILE 33 HA ILE 33 15.085 -2.017 -6.330
235 HB ILE 33 HB ILE 33 16.284 -0.316 -4.165
236 HG12 ILE 33 1HG1 ILE 33 17.672 0.497 -6.311
237 HG13 ILE 33 2HG1 ILE 33 16.098 0.234 -7.080
238 HG21 ILE 33 1HG2 ILE 33 17.809 -1.930 -4.239
239 HG22 ILE 33 2HG2 ILE 33 17.045 -2.661 -5.650
240 HG23 ILE 33 3HG2 ILE 33 18.233 -1.375 -5.859
241 HD11 ILE 33 3HD1 ILE 33 16.828 2.182 -4.938
242 HD12 ILE 33 1HD1 ILE 33 16.020 2.466 -6.480
243 HD13 ILE 33 2HD1 ILE 33 15.156 1.669 -5.164
244 H ASN 34 H ASN 34 12.648 -1.496 -4.457
245 HA ASN 34 HA ASN 34 13.504 -3.309 -2.299
246 HB2 ASN 34 1HB ASN 34 11.731 -0.952 -2.368
247 HB3 ASN 34 2HB ASN 34 11.096 -2.329 -1.459
248 HD21 ASN 34 1HD2 ASN 34 14.005 -0.352 -1.818
249 HD22 ASN 34 2HD2 ASN 34 14.474 -0.428 -0.157
250 H ARG 35 H ARG 35 11.317 -2.832 -4.938
251 HA ARG 35 HA ARG 35 9.326 -4.692 -4.306
252 HE ARG 35 HE ARG 35 7.375 -4.939 -5.096
253 HB2 ARG 35 1HB ARG 35 10.421 -3.678 -6.925
254 HB3 ARG 35 2HB ARG 35 9.107 -4.859 -6.861
255 HG2 ARG 35 1HG ARG 35 8.600 -2.590 -5.123
256 HG3 ARG 35 2HG ARG 35 8.849 -2.111 -6.810
257 HD2 ARG 35 1HD ARG 35 6.492 -2.535 -6.434
258 HD3 ARG 35 2HD ARG 35 7.164 -3.770 -7.510
259 HH11 ARG 35 1HH1 ARG 35 4.740 -3.338 -6.711
260 HH12 ARG 35 2HH1 ARG 35 3.517 -4.291 -5.940
261 HH21 ARG 35 1HH2 ARG 35 5.774 -6.202 -4.076
262 HH22 ARG 35 2HH2 ARG 35 4.105 -5.919 -4.441
263 H LYS 36 H LYS 36 12.572 -5.116 -5.471
264 HA LYS 36 HA LYS 36 12.170 -7.878 -6.233
265 HB2 LYS 36 1HB LYS 36 14.638 -7.871 -6.586
266 HB3 LYS 36 2HB LYS 36 13.783 -6.614 -7.494
267 HG2 LYS 36 1HG LYS 36 14.932 -4.982 -6.514
268 HG3 LYS 36 2HG LYS 36 14.641 -5.659 -4.902
269 HD2 LYS 36 1HD LYS 36 16.909 -5.898 -4.973
270 HD3 LYS 36 2HD LYS 36 16.438 -7.430 -5.731
271 HE2 LYS 36 1HE LYS 36 16.616 -5.239 -7.655
272 HE3 LYS 36 2HE LYS 36 18.139 -5.537 -6.802
273 HZ1 LYS 36 3HZ LYS 36 17.823 -7.942 -7.398
274 HZ2 LYS 36 1HZ LYS 36 18.149 -6.909 -8.698
275 HZ3 LYS 36 2HZ LYS 36 16.571 -7.456 -8.427
276 H LYS 37 H LYS 37 11.271 -7.893 -3.793
277 HA LYS 37 HA LYS 37 13.434 -8.582 -1.949
278 HB2 LYS 37 1HB LYS 37 11.256 -7.124 -1.476
279 HB3 LYS 37 2HB LYS 37 10.571 -8.721 -1.138
280 HG2 LYS 37 1HG LYS 37 11.528 -8.791 0.860
281 HG3 LYS 37 2HG LYS 37 13.118 -8.441 0.158
282 HD2 LYS 37 1HD LYS 37 12.311 -5.995 0.038
283 HD3 LYS 37 2HD LYS 37 11.046 -6.518 1.166
284 HE2 LYS 37 1HE LYS 37 12.457 -6.506 2.900
285 HE3 LYS 37 2HE LYS 37 13.653 -7.451 2.001
286 HZ1 LYS 37 3HZ LYS 37 13.335 -4.515 2.093
287 HZ2 LYS 37 1HZ LYS 37 14.201 -5.268 0.849
288 HZ3 LYS 37 2HZ LYS 37 14.705 -5.440 2.454
289 H LYS 38 H LYS 38 10.756 -10.003 -3.696
290 HA LYS 38 HA LYS 38 11.412 -12.634 -2.553
291 HB2 LYS 38 1HB LYS 38 8.917 -11.343 -3.390
292 HB3 LYS 38 2HB LYS 38 9.108 -12.986 -4.021
293 HG2 LYS 38 1HG LYS 38 9.816 -13.366 -1.432
294 HG3 LYS 38 2HG LYS 38 8.626 -12.062 -1.277
295 HD2 LYS 38 1HD LYS 38 7.411 -14.090 -1.097
296 HD3 LYS 38 2HD LYS 38 7.082 -13.448 -2.716
297 HE2 LYS 38 1HE LYS 38 7.934 -15.262 -3.702
298 HE3 LYS 38 2HE LYS 38 9.415 -15.145 -2.739
299 HZ1 LYS 38 3HZ LYS 38 7.935 -16.139 -0.885
300 HZ2 LYS 38 1HZ LYS 38 8.561 -17.156 -2.081
301 HZ3 LYS 38 2HZ LYS 38 6.953 -16.645 -2.165
302 H HIS 39 H HIS 39 11.174 -10.788 -5.507
303 HA HIS 39 HA HIS 39 11.744 -13.120 -7.156
304 HD1 HIS 39 1HD HIS 39 8.424 -11.267 -8.577
305 HD2 HIS 39 2HD HIS 39 11.609 -13.556 -9.947
306 HE1 HIS 39 1HE HIS 39 7.421 -12.927 -10.178
307 HE2 HIS 39 2HE HIS 39 9.368 -14.328 -11.013
308 HB2 HIS 39 1HB HIS 39 10.560 -10.530 -7.572
309 HB3 HIS 39 2HB HIS 39 11.899 -10.757 -8.702
Start of MODEL 10
1 H1 GLY 1 H GLY 1 -21.372 -1.111 5.659
2 HA2 GLY 1 2HA GLY 1 -18.616 -1.532 4.768
3 HA3 GLY 1 3HA GLY 1 -19.399 -0.034 4.285
4 H THR 2 H THR 2 -17.090 -0.746 6.133
5 HA THR 2 HA THR 2 -17.462 1.332 7.988
6 HB THR 2 HB THR 2 -17.175 -0.562 9.955
7 HG1 THR 2 1HG THR 2 -17.861 -2.152 8.332
8 HG21 THR 2 3HG2 THR 2 -19.921 0.000 9.840
9 HG22 THR 2 1HG2 THR 2 -19.115 1.393 9.120
10 HG23 THR 2 2HG2 THR 2 -18.688 0.870 10.750
11 H TRP 3 H TRP 3 -15.507 0.191 6.127
12 HA TRP 3 HA TRP 3 -13.336 -0.904 7.611
13 HD1 TRP 3 HD TRP 3 -15.106 -1.161 3.633
14 HE1 TRP 3 1HE TRP 3 -15.313 -3.703 3.284
15 HE3 TRP 3 3HE TRP 3 -11.493 -2.722 6.893
16 HZ2 TRP 3 2HZ TRP 3 -14.104 -6.058 4.262
17 HZ3 TRP 3 3HZ TRP 3 -11.079 -5.136 7.128
18 HH2 TRP 3 HH TRP 3 -12.359 -6.768 5.839
19 HB2 TRP 3 1HB TRP 3 -13.450 0.400 4.878
20 HB3 TRP 3 2HB TRP 3 -12.012 -0.375 5.542
21 H ASP 4 H ASP 4 -14.444 2.309 6.939
22 HA ASP 4 HA ASP 4 -11.977 3.635 7.520
23 HD2 ASP 4 HD ASP 4 -14.746 5.157 4.143
24 HB2 ASP 4 1HB ASP 4 -14.780 4.779 7.601
25 HB3 ASP 4 2HB ASP 4 -13.267 5.681 7.452
26 H ASP 5 H ASP 5 -14.931 2.943 9.344
27 HA ASP 5 HA ASP 5 -13.955 4.229 11.727
28 HD2 ASP 5 HD ASP 5 -16.280 3.847 14.863
29 HB2 ASP 5 1HB ASP 5 -16.315 4.273 11.416
30 HB3 ASP 5 2HB ASP 5 -16.375 2.526 11.140
31 H ILE 6 H ILE 6 -14.407 0.891 10.629
32 HA ILE 6 HA ILE 6 -13.407 -0.257 13.055
33 HB ILE 6 HB ILE 6 -13.799 -1.508 10.334
34 HG12 ILE 6 1HG1 ILE 6 -15.511 -1.673 12.827
35 HG13 ILE 6 2HG1 ILE 6 -15.855 -0.622 11.443
36 HG21 ILE 6 1HG2 ILE 6 -12.627 -3.215 11.151
37 HG22 ILE 6 2HG2 ILE 6 -12.579 -2.502 12.762
38 HG23 ILE 6 3HG2 ILE 6 -13.961 -3.482 12.274
39 HD11 ILE 6 3HD1 ILE 6 -15.689 -2.903 10.121
40 HD12 ILE 6 1HD1 ILE 6 -16.140 -3.555 11.696
41 HD13 ILE 6 2HD1 ILE 6 -17.181 -2.375 10.899
42 H GLY 7 H GLY 7 -12.098 -0.020 9.742
43 HA2 GLY 7 2HA GLY 7 -9.544 -1.053 10.445
44 HA3 GLY 7 3HA GLY 7 -9.944 -0.201 8.960
45 H GLN 8 H GLN 8 -10.790 2.241 10.062
46 HA GLN 8 HA GLN 8 -9.868 4.280 10.514
47 HB2 GLN 8 1HB GLN 8 -10.194 3.250 12.791
48 HB3 GLN 8 2HB GLN 8 -8.481 2.806 12.754
49 HG2 GLN 8 1HG GLN 8 -8.208 5.396 12.221
50 HG3 GLN 8 2HG GLN 8 -9.747 5.460 13.094
51 HE21 GLN 8 1HE2 GLN 8 -9.724 4.095 15.165
52 HE22 GLN 8 2HE2 GLN 8 -8.335 4.293 16.173
53 H GLY 9 H GLY 9 -8.597 3.822 8.455
54 HA2 GLY 9 2HA GLY 9 -6.077 4.896 8.583
55 HA3 GLY 9 3HA GLY 9 -5.818 3.162 8.714
56 H ILE 10 H ILE 10 -7.529 2.049 7.003
57 HA ILE 10 HA ILE 10 -6.345 2.296 4.524
58 HB ILE 10 HB ILE 10 -9.182 1.406 5.056
59 HG12 ILE 10 1HG1 ILE 10 -7.292 -0.718 4.596
60 HG13 ILE 10 2HG1 ILE 10 -6.734 0.303 5.932
61 HG21 ILE 10 1HG2 ILE 10 -8.984 1.714 2.737
62 HG22 ILE 10 2HG2 ILE 10 -7.342 1.072 2.708
63 HG23 ILE 10 3HG2 ILE 10 -8.706 -0.010 2.992
64 HD11 ILE 10 3HD1 ILE 10 -8.483 -0.246 7.284
65 HD12 ILE 10 1HD1 ILE 10 -9.570 -0.575 5.934
66 HD13 ILE 10 2HD1 ILE 10 -8.318 -1.740 6.363
67 H GLY 11 H GLY 11 -8.962 4.151 5.904
68 HA2 GLY 11 2HA GLY 11 -9.977 5.280 3.524
69 HA3 GLY 11 3HA GLY 11 -10.136 5.967 5.135
70 H ARG 12 H ARG 12 -7.572 6.523 5.836
71 HA ARG 12 HA ARG 12 -7.040 8.847 4.233
72 HE ARG 12 HE ARG 12 -9.685 10.663 7.161
73 HB2 ARG 12 1HB ARG 12 -5.478 7.708 6.564
74 HB3 ARG 12 2HB ARG 12 -5.301 9.332 5.879
75 HG2 ARG 12 1HG ARG 12 -7.827 8.285 7.159
76 HG3 ARG 12 2HG ARG 12 -6.610 9.277 7.978
77 HD2 ARG 12 1HD ARG 12 -6.963 11.078 6.341
78 HD3 ARG 12 2HD ARG 12 -8.184 10.083 5.535
79 HH11 ARG 12 1HH1 ARG 12 -6.467 11.413 8.259
80 HH12 ARG 12 2HH1 ARG 12 -7.006 12.250 9.678
81 HH21 ARG 12 1HH2 ARG 12 -10.406 11.760 9.026
82 HH22 ARG 12 2HH2 ARG 12 -9.247 12.445 10.113
83 H VAL 13 H VAL 13 -5.603 5.681 4.677
84 HA VAL 13 HA VAL 13 -3.167 6.229 3.315
85 HB VAL 13 HB VAL 13 -4.554 3.583 3.775
86 HG11 VAL 13 1HG1 VAL 13 -2.937 3.457 1.956
87 HG12 VAL 13 2HG1 VAL 13 -1.702 4.175 2.991
88 HG13 VAL 13 3HG1 VAL 13 -2.358 2.585 3.373
89 HG21 VAL 13 3HG2 VAL 13 -3.331 3.362 5.750
90 HG22 VAL 13 1HG2 VAL 13 -2.210 4.649 5.308
91 HG23 VAL 13 2HG2 VAL 13 -3.864 5.043 5.777
92 H ALA 14 H ALA 14 -6.287 4.894 2.315
93 HA ALA 14 HA ALA 14 -5.666 4.061 -0.249
94 HB1 ALA 14 1HB ALA 14 -7.818 3.622 0.793
95 HB2 ALA 14 2HB ALA 14 -8.227 5.335 0.705
96 HB3 ALA 14 3HB ALA 14 -8.037 4.398 -0.776
97 H TYR 15 H TYR 15 -6.182 7.300 0.977
98 HA TYR 15 HA TYR 15 -6.401 8.552 -1.579
99 HD1 TYR 15 1HD TYR 15 -7.279 10.963 -1.995
100 HD2 TYR 15 2HD TYR 15 -4.486 11.527 1.165
101 HE1 TYR 15 1HE TYR 15 -6.707 13.178 -2.902
102 HE2 TYR 15 2HE TYR 15 -3.908 13.743 0.268
103 HH TYR 15 HH TYR 15 -4.689 14.743 -2.796
104 HB2 TYR 15 1HB TYR 15 -7.359 9.666 0.315
105 HB3 TYR 15 2HB TYR 15 -5.819 9.637 1.179
106 H TRP 16 H TRP 16 -3.770 7.658 0.517
107 HA TRP 16 HA TRP 16 -1.811 9.291 -0.811
108 HD1 TRP 16 HD TRP 16 -2.813 9.288 2.808
109 HE1 TRP 16 1HE TRP 16 -1.695 11.365 3.841
110 HE3 TRP 16 3HE TRP 16 1.554 9.264 0.150
111 HZ2 TRP 16 2HZ TRP 16 0.718 12.802 3.564
112 HZ3 TRP 16 3HZ TRP 16 3.214 11.024 0.595
113 HH2 TRP 16 HH TRP 16 2.803 12.757 2.266
114 HB2 TRP 16 1HB TRP 16 -1.789 7.234 1.357
115 HB3 TRP 16 2HB TRP 16 -0.277 7.558 0.509
116 H VAL 17 H VAL 17 -2.691 5.854 -0.826
117 HA VAL 17 HA VAL 17 -0.677 5.045 -2.648
118 HB VAL 17 HB VAL 17 -1.828 3.441 -1.198
119 HG11 VAL 17 1HG1 VAL 17 -4.101 2.773 -1.557
120 HG12 VAL 17 2HG1 VAL 17 -4.069 4.526 -1.360
121 HG13 VAL 17 3HG1 VAL 17 -4.239 3.822 -2.968
122 HG21 VAL 17 3HG2 VAL 17 -2.689 2.331 -3.745
123 HG22 VAL 17 1HG2 VAL 17 -1.092 3.076 -3.832
124 HG23 VAL 17 2HG2 VAL 17 -1.407 1.801 -2.656
125 H GLY 18 H GLY 18 -3.955 6.253 -3.046
126 HA2 GLY 18 2HA GLY 18 -4.236 5.599 -5.791
127 HA3 GLY 18 3HA GLY 18 -5.170 6.805 -4.917
128 H LYS 19 H LYS 19 -3.112 8.528 -4.141
129 HA LYS 19 HA LYS 19 -2.764 10.014 -6.553
130 HB2 LYS 19 1HB LYS 19 -1.632 11.661 -5.155
131 HB3 LYS 19 2HB LYS 19 -3.130 11.111 -4.385
132 HG2 LYS 19 1HG LYS 19 -1.904 9.692 -2.872
133 HG3 LYS 19 2HG LYS 19 -0.385 10.082 -3.698
134 HD2 LYS 19 1HD LYS 19 -1.356 12.575 -3.089
135 HD3 LYS 19 2HD LYS 19 -1.884 11.611 -1.699
136 HE2 LYS 19 1HE LYS 19 0.180 12.042 -0.896
137 HE3 LYS 19 2HE LYS 19 0.668 10.736 -1.985
138 HZ1 LYS 19 3HZ LYS 19 0.896 13.650 -2.400
139 HZ2 LYS 19 1HZ LYS 19 0.932 12.580 -3.708
140 HZ3 LYS 19 2HZ LYS 19 2.103 12.470 -2.493
141 H ALA 20 H ALA 20 -0.733 7.932 -4.606
142 HA ALA 20 HA ALA 20 1.754 8.648 -5.747
143 HB1 ALA 20 1HB ALA 20 2.572 6.536 -4.798
144 HB2 ALA 20 2HB ALA 20 1.617 7.458 -3.635
145 HB3 ALA 20 3HB ALA 20 0.911 6.061 -4.448
146 H LEU 21 H LEU 21 -0.777 6.437 -6.718
147 HA LEU 21 HA LEU 21 0.762 5.049 -8.679
148 HG LEU 21 HG LEU 21 -0.234 3.013 -9.147
149 HB2 LEU 21 1HB LEU 21 -1.922 4.986 -7.632
150 HB3 LEU 21 2HB LEU 21 -1.948 4.931 -9.402
151 HD11 LEU 21 1HD1 LEU 21 -0.446 3.678 -6.484
152 HD12 LEU 21 2HD1 LEU 21 0.223 2.181 -7.132
153 HD13 LEU 21 3HD1 LEU 21 -1.467 2.246 -6.630
154 HD21 LEU 21 3HD2 LEU 21 -3.139 2.737 -8.392
155 HD22 LEU 21 1HD2 LEU 21 -2.089 1.385 -8.815
156 HD23 LEU 21 2HD2 LEU 21 -2.438 2.638 -10.009
157 H GLY 22 H GLY 22 -0.976 8.044 -8.612
158 HA2 GLY 22 2HA GLY 22 -1.565 8.406 -11.314
159 HA3 GLY 22 3HA GLY 22 -1.225 9.703 -10.177
160 H ASN 23 H ASN 23 0.800 10.637 -10.126
161 HA ASN 23 HA ASN 23 2.512 9.967 -12.414
162 HB2 ASN 23 1HB ASN 23 2.816 12.470 -10.783
163 HB3 ASN 23 2HB ASN 23 3.198 12.194 -12.485
164 HD21 ASN 23 1HD2 ASN 23 0.880 11.080 -13.412
165 HD22 ASN 23 2HD2 ASN 23 -0.398 12.237 -13.322
166 H LEU 24 H LEU 24 3.016 8.135 -10.690
167 HA LEU 24 HA LEU 24 5.688 8.583 -9.851
168 HG LEU 24 HG LEU 24 5.847 10.314 -8.478
169 HB2 LEU 24 1HB LEU 24 3.509 8.869 -7.875
170 HB3 LEU 24 2HB LEU 24 4.867 7.840 -7.387
171 HD11 LEU 24 1HD1 LEU 24 3.698 11.233 -7.789
172 HD12 LEU 24 2HD1 LEU 24 5.001 11.826 -6.760
173 HD13 LEU 24 3HD1 LEU 24 3.921 10.564 -6.172
174 HD21 LEU 24 3HD2 LEU 24 6.662 10.388 -5.987
175 HD22 LEU 24 1HD2 LEU 24 7.320 9.203 -7.114
176 HD23 LEU 24 2HD2 LEU 24 6.070 8.726 -5.965
177 H SER 25 H SER 25 5.705 6.745 -11.314
178 HA SER 25 HA SER 25 4.631 4.250 -10.244
179 HG SER 25 HG SER 25 4.681 2.800 -13.345
180 HB2 SER 25 1HB SER 25 4.404 4.911 -12.693
181 HB3 SER 25 2HB SER 25 6.147 4.615 -12.832
182 H ASP 26 H ASP 26 7.658 5.899 -10.765
183 HA ASP 26 HA ASP 26 9.454 3.785 -10.547
184 HD2 ASP 26 HD ASP 26 10.420 5.457 -13.321
185 HB2 ASP 26 1HB ASP 26 9.697 6.660 -9.631
186 HB3 ASP 26 2HB ASP 26 11.047 5.521 -9.656
187 H VAL 27 H VAL 27 7.767 5.602 -8.045
188 HA VAL 27 HA VAL 27 9.172 4.536 -5.834
189 HB VAL 27 HB VAL 27 7.149 5.243 -4.513
190 HG11 VAL 27 1HG1 VAL 27 9.143 6.701 -5.131
191 HG12 VAL 27 2HG1 VAL 27 8.094 7.428 -6.349
192 HG13 VAL 27 3HG1 VAL 27 7.668 7.532 -4.640
193 HG21 VAL 27 3HG2 VAL 27 5.366 6.415 -5.577
194 HG22 VAL 27 1HG2 VAL 27 6.177 6.342 -7.144
195 HG23 VAL 27 2HG2 VAL 27 5.547 4.868 -6.406
196 H ASN 28 H ASN 28 6.563 3.339 -7.790
197 HA ASN 28 HA ASN 28 5.613 1.382 -5.952
198 HB2 ASN 28 1HB ASN 28 4.390 2.350 -7.987
199 HB3 ASN 28 2HB ASN 28 5.354 1.227 -8.951
200 HD21 ASN 28 1HD2 ASN 28 4.440 -0.639 -9.370
201 HD22 ASN 28 2HD2 ASN 28 3.230 -1.421 -8.417
202 H GLN 29 H GLN 29 7.967 1.370 -8.582
203 HA GLN 29 HA GLN 29 8.469 -1.452 -8.377
204 HB2 GLN 29 1HB GLN 29 10.210 -1.087 -10.021
205 HB3 GLN 29 2HB GLN 29 8.743 -0.217 -10.500
206 HG2 GLN 29 1HG GLN 29 9.651 1.875 -9.929
207 HG3 GLN 29 2HG GLN 29 10.975 1.132 -9.022
208 HE21 GLN 29 1HE2 GLN 29 9.641 0.738 -12.289
209 HE22 GLN 29 2HE2 GLN 29 11.151 0.911 -13.110
210 H ALA 30 H ALA 30 9.720 1.436 -6.934
211 HA ALA 30 HA ALA 30 12.253 0.512 -6.130
212 HB1 ALA 30 1HB ALA 30 11.407 2.891 -6.096
213 HB2 ALA 30 2HB ALA 30 10.574 2.480 -4.596
214 HB3 ALA 30 3HB ALA 30 12.333 2.378 -4.684
215 H SER 31 H SER 31 9.061 -0.052 -4.879
216 HA SER 31 HA SER 31 9.621 -0.786 -2.255
217 HG SER 31 HG SER 31 6.531 -2.777 -3.889
218 HB2 SER 31 1HB SER 31 7.478 -1.631 -2.169
219 HB3 SER 31 2HB SER 31 7.351 -0.612 -3.613
220 H ARG 32 H ARG 32 10.348 -2.398 -5.211
221 HA ARG 32 HA ARG 32 10.595 -5.037 -4.196
222 HE ARG 32 HE ARG 32 9.191 -7.174 -7.545
223 HB2 ARG 32 1HB ARG 32 11.765 -3.675 -6.626
224 HB3 ARG 32 2HB ARG 32 11.988 -5.397 -6.274
225 HG2 ARG 32 1HG ARG 32 9.454 -5.577 -6.221
226 HG3 ARG 32 2HG ARG 32 9.441 -3.955 -6.935
227 HD2 ARG 32 1HD ARG 32 9.834 -4.790 -8.963
228 HD3 ARG 32 2HD ARG 32 11.290 -5.598 -8.368
229 HH11 ARG 32 1HH1 ARG 32 10.435 -6.006 -10.580
230 HH12 ARG 32 2HH1 ARG 32 9.890 -7.384 -11.482
231 HH21 ARG 32 1HH2 ARG 32 8.470 -8.990 -8.720
232 HH22 ARG 32 2HH2 ARG 32 8.771 -9.079 -10.422
233 H ILE 33 H ILE 33 12.506 -2.242 -3.868
234 HA ILE 33 HA ILE 33 14.631 -3.838 -2.624
235 HB ILE 33 HB ILE 33 15.317 -1.395 -4.233
236 HG12 ILE 33 1HG1 ILE 33 16.201 -3.357 -5.836
237 HG13 ILE 33 2HG1 ILE 33 14.764 -4.159 -5.180
238 HG21 ILE 33 1HG2 ILE 33 17.309 -3.456 -4.105
239 HG22 ILE 33 2HG2 ILE 33 17.379 -1.795 -3.516
240 HG23 ILE 33 3HG2 ILE 33 16.730 -3.069 -2.484
241 HD11 ILE 33 3HD1 ILE 33 14.927 -1.693 -6.857
242 HD12 ILE 33 1HD1 ILE 33 13.972 -3.155 -7.106
243 HD13 ILE 33 2HD1 ILE 33 13.517 -2.008 -5.844
244 H ASN 34 H ASN 34 12.290 -1.897 -1.934
245 HA ASN 34 HA ASN 34 13.852 -0.112 -0.187
246 HB2 ASN 34 1HB ASN 34 11.380 0.259 -1.754
247 HB3 ASN 34 2HB ASN 34 11.314 0.896 -0.108
248 HD21 ASN 34 1HD2 ASN 34 13.411 0.878 -2.961
249 HD22 ASN 34 2HD2 ASN 34 13.959 2.507 -2.781
250 H ARG 35 H ARG 35 11.465 -2.616 -0.323
251 HA ARG 35 HA ARG 35 10.260 -2.342 2.180
252 HE ARG 35 HE ARG 35 7.539 -6.131 3.562
253 HB2 ARG 35 1HB ARG 35 9.717 -3.946 0.218
254 HB3 ARG 35 2HB ARG 35 10.885 -5.027 0.991
255 HG2 ARG 35 1HG ARG 35 9.430 -4.555 3.134
256 HG3 ARG 35 2HG ARG 35 8.196 -4.169 1.922
257 HD2 ARG 35 1HD ARG 35 8.315 -6.346 0.962
258 HD3 ARG 35 2HD ARG 35 9.778 -6.728 1.878
259 HH11 ARG 35 1HH1 ARG 35 9.106 -8.618 1.700
260 HH12 ARG 35 2HH1 ARG 35 8.437 -9.919 2.630
261 HH21 ARG 35 1HH2 ARG 35 6.652 -7.832 4.795
262 HH22 ARG 35 2HH2 ARG 35 7.041 -9.469 4.390
263 H LYS 36 H LYS 36 13.410 -3.471 1.291
264 HA LYS 36 HA LYS 36 14.147 -3.655 4.090
265 HB2 LYS 36 1HB LYS 36 15.292 -5.883 3.684
266 HB3 LYS 36 2HB LYS 36 13.525 -5.923 3.802
267 HG2 LYS 36 1HG LYS 36 13.324 -6.799 1.774
268 HG3 LYS 36 2HG LYS 36 14.354 -5.541 1.070
269 HD2 LYS 36 1HD LYS 36 16.352 -6.765 1.608
270 HD3 LYS 36 2HD LYS 36 15.417 -7.952 2.535
271 HE2 LYS 36 1HE LYS 36 14.280 -8.692 0.506
272 HE3 LYS 36 2HE LYS 36 15.147 -7.464 -0.430
273 HZ1 LYS 36 3HZ LYS 36 16.361 -9.391 -0.783
274 HZ2 LYS 36 1HZ LYS 36 16.213 -9.917 0.818
275 HZ3 LYS 36 2HZ LYS 36 17.239 -8.625 0.443
276 H LYS 37 H LYS 37 15.212 -1.693 3.204
277 HA LYS 37 HA LYS 37 17.957 -2.190 2.737
278 HB2 LYS 37 1HB LYS 37 16.780 -2.586 0.443
279 HB3 LYS 37 2HB LYS 37 16.675 -0.819 0.394
280 HG2 LYS 37 1HG LYS 37 18.626 -1.350 -0.793
281 HG3 LYS 37 2HG LYS 37 19.181 -0.800 0.797
282 HD2 LYS 37 1HD LYS 37 20.325 -2.702 0.991
283 HD3 LYS 37 2HD LYS 37 18.776 -3.557 1.065
284 HE2 LYS 37 1HE LYS 37 18.758 -3.880 -1.325
285 HE3 LYS 37 2HE LYS 37 20.194 -2.862 -1.502
286 HZ1 LYS 37 3HZ LYS 37 20.776 -4.914 0.320
287 HZ2 LYS 37 1HZ LYS 37 21.460 -4.633 -1.202
288 HZ3 LYS 37 2HZ LYS 37 20.089 -5.613 -1.060
289 H LYS 38 H LYS 38 16.320 -0.681 4.525
290 HA LYS 38 HA LYS 38 16.377 2.086 3.876
291 HB2 LYS 38 1HB LYS 38 15.379 0.470 5.967
292 HB3 LYS 38 2HB LYS 38 16.472 1.643 6.716
293 HG2 LYS 38 1HG LYS 38 15.197 3.408 5.333
294 HG3 LYS 38 2HG LYS 38 13.969 2.142 5.156
295 HD2 LYS 38 1HD LYS 38 13.826 1.935 7.604
296 HD3 LYS 38 2HD LYS 38 15.032 3.224 7.767
297 HE2 LYS 38 1HE LYS 38 13.579 4.880 7.090
298 HE3 LYS 38 2HE LYS 38 12.587 3.754 6.148
299 HZ1 LYS 38 3HZ LYS 38 11.613 4.648 8.298
300 HZ2 LYS 38 1HZ LYS 38 12.691 3.618 9.099
301 HZ3 LYS 38 2HZ LYS 38 11.526 2.974 8.056
302 H HIS 39 H HIS 39 18.667 -0.126 5.287
303 HA HIS 39 HA HIS 39 20.830 0.098 5.957
304 HD1 HIS 39 1HD HIS 39 23.385 3.306 4.194
305 HD2 HIS 39 2HD HIS 39 22.919 -0.747 4.973
306 HE1 HIS 39 1HE HIS 39 25.719 2.388 4.404
307 HE2 HIS 39 2HE HIS 39 25.434 -0.089 4.880
308 HB2 HIS 39 1HB HIS 39 20.776 1.174 3.573
309 HB3 HIS 39 2HB HIS 39 21.007 2.688 4.452
Start of MODEL 11
1 H1 GLY 1 H GLY 1 -19.191 -0.674 13.509
2 HA2 GLY 1 2HA GLY 1 -19.576 -0.536 11.247
3 HA3 GLY 1 3HA GLY 1 -20.944 0.461 11.715
4 H THR 2 H THR 2 -18.908 0.539 9.456
5 HA THR 2 HA THR 2 -18.804 3.332 9.163
6 HB THR 2 HB THR 2 -16.070 3.086 9.120
7 HG1 THR 2 1HG THR 2 -16.372 1.051 10.304
8 HG21 THR 2 3HG2 THR 2 -18.080 4.474 10.645
9 HG22 THR 2 1HG2 THR 2 -16.465 5.007 10.181
10 HG23 THR 2 2HG2 THR 2 -16.694 4.084 11.665
11 H TRP 3 H TRP 3 -19.394 0.857 7.711
12 HA TRP 3 HA TRP 3 -17.407 0.456 5.707
13 HD1 TRP 3 HD TRP 3 -20.448 -1.803 7.875
14 HE1 TRP 3 1HE TRP 3 -19.132 -3.861 8.685
15 HE3 TRP 3 3HE TRP 3 -16.694 -1.783 4.404
16 HZ2 TRP 3 2HZ TRP 3 -16.809 -5.287 7.950
17 HZ3 TRP 3 3HZ TRP 3 -14.963 -3.527 4.529
18 HH2 TRP 3 HH TRP 3 -15.019 -5.243 6.266
19 HB2 TRP 3 1HB TRP 3 -20.351 -0.256 5.793
20 HB3 TRP 3 2HB TRP 3 -19.250 -0.760 4.509
21 H ASP 4 H ASP 4 -20.010 2.697 6.128
22 HA ASP 4 HA ASP 4 -20.233 3.457 3.377
23 HD2 ASP 4 HD ASP 4 -23.141 6.054 2.713
24 HB2 ASP 4 1HB ASP 4 -22.075 3.747 5.015
25 HB3 ASP 4 2HB ASP 4 -21.104 4.970 5.848
26 H ASP 5 H ASP 5 -18.588 4.783 6.218
27 HA ASP 5 HA ASP 5 -17.486 7.000 4.749
28 HD2 ASP 5 HD ASP 5 -17.976 9.747 7.655
29 HB2 ASP 5 1HB ASP 5 -17.345 5.986 7.550
30 HB3 ASP 5 2HB ASP 5 -16.029 7.027 6.988
31 H ILE 6 H ILE 6 -16.269 3.932 6.043
32 HA ILE 6 HA ILE 6 -13.600 4.361 5.103
33 HB ILE 6 HB ILE 6 -14.953 1.822 6.020
34 HG12 ILE 6 1HG1 ILE 6 -13.030 3.648 7.481
35 HG13 ILE 6 2HG1 ILE 6 -14.786 3.657 7.711
36 HG21 ILE 6 1HG2 ILE 6 -12.647 0.974 6.311
37 HG22 ILE 6 2HG2 ILE 6 -13.059 1.289 4.628
38 HG23 ILE 6 3HG2 ILE 6 -12.042 2.425 5.515
39 HD11 ILE 6 3HD1 ILE 6 -12.784 1.640 8.575
40 HD12 ILE 6 1HD1 ILE 6 -14.139 2.342 9.459
41 HD13 ILE 6 2HD1 ILE 6 -14.432 1.115 8.224
42 H GLY 7 H GLY 7 -16.491 2.874 3.830
43 HA2 GLY 7 2HA GLY 7 -15.132 1.526 1.673
44 HA3 GLY 7 3HA GLY 7 -16.869 1.683 1.877
45 H GLN 8 H GLN 8 -17.156 4.431 1.962
46 HA GLN 8 HA GLN 8 -16.927 5.062 -0.825
47 HB2 GLN 8 1HB GLN 8 -18.873 5.697 0.623
48 HB3 GLN 8 2HB GLN 8 -17.816 6.871 1.425
49 HG2 GLN 8 1HG GLN 8 -18.535 8.334 -0.087
50 HG3 GLN 8 2HG GLN 8 -17.481 7.484 -1.224
51 HE21 GLN 8 1HE2 GLN 8 -18.380 5.967 -2.651
52 HE22 GLN 8 2HE2 GLN 8 -20.067 5.967 -3.024
53 H GLY 9 H GLY 9 -14.455 4.799 -0.546
54 HA2 GLY 9 2HA GLY 9 -13.181 7.162 -1.101
55 HA3 GLY 9 3HA GLY 9 -13.037 6.988 0.642
56 H ILE 10 H ILE 10 -12.958 4.021 0.386
57 HA ILE 10 HA ILE 10 -10.192 3.665 0.400
58 HB ILE 10 HB ILE 10 -11.846 2.105 1.424
59 HG12 ILE 10 1HG1 ILE 10 -9.862 0.856 -0.496
60 HG13 ILE 10 2HG1 ILE 10 -9.490 1.465 1.126
61 HG21 ILE 10 1HG2 ILE 10 -13.116 0.608 0.189
62 HG22 ILE 10 2HG2 ILE 10 -13.230 2.089 -0.761
63 HG23 ILE 10 3HG2 ILE 10 -12.126 0.806 -1.257
64 HD11 ILE 10 3HD1 ILE 10 -9.905 -0.549 1.931
65 HD12 ILE 10 1HD1 ILE 10 -11.594 -0.353 1.460
66 HD13 ILE 10 2HD1 ILE 10 -10.450 -1.112 0.351
67 H GLY 11 H GLY 11 -12.370 3.898 -2.235
68 HA2 GLY 11 2HA GLY 11 -11.230 2.329 -4.202
69 HA3 GLY 11 3HA GLY 11 -12.011 3.875 -4.504
70 H ARG 12 H ARG 12 -9.957 5.206 -2.743
71 HA ARG 12 HA ARG 12 -7.456 4.847 -4.116
72 HE ARG 12 HE ARG 12 -11.239 7.729 -6.168
73 HB2 ARG 12 1HB ARG 12 -7.342 7.080 -5.097
74 HB3 ARG 12 2HB ARG 12 -8.695 6.163 -5.775
75 HG2 ARG 12 1HG ARG 12 -10.238 7.348 -4.250
76 HG3 ARG 12 2HG ARG 12 -8.869 8.314 -3.673
77 HD2 ARG 12 1HD ARG 12 -9.657 9.737 -5.277
78 HD3 ARG 12 2HD ARG 12 -8.559 8.763 -6.263
79 HH11 ARG 12 1HH1 ARG 12 -9.076 9.943 -7.761
80 HH12 ARG 12 2HH1 ARG 12 -9.984 9.972 -9.237
81 HH21 ARG 12 1HH2 ARG 12 -12.443 7.759 -8.105
82 HH22 ARG 12 2HH2 ARG 12 -11.899 8.729 -9.431
83 H VAL 13 H VAL 13 -9.453 6.861 -2.011
84 HA VAL 13 HA VAL 13 -7.545 8.399 -0.761
85 HB VAL 13 HB VAL 13 -9.879 7.098 0.644
86 HG11 VAL 13 1HG1 VAL 13 -8.119 8.285 2.016
87 HG12 VAL 13 2HG1 VAL 13 -8.614 9.770 1.201
88 HG13 VAL 13 3HG1 VAL 13 -9.769 8.880 2.193
89 HG21 VAL 13 3HG2 VAL 13 -10.504 9.734 -0.121
90 HG22 VAL 13 1HG2 VAL 13 -9.843 8.937 -1.550
91 HG23 VAL 13 2HG2 VAL 13 -11.227 8.236 -0.708
92 H ALA 14 H ALA 14 -8.346 5.019 -0.201
93 HA ALA 14 HA ALA 14 -7.034 4.549 2.186
94 HB1 ALA 14 1HB ALA 14 -8.293 2.997 0.292
95 HB2 ALA 14 2HB ALA 14 -6.635 2.398 0.265
96 HB3 ALA 14 3HB ALA 14 -7.542 2.414 1.777
97 H TYR 15 H TYR 15 -5.709 5.007 -1.016
98 HA TYR 15 HA TYR 15 -3.097 4.036 -0.421
99 HD1 TYR 15 1HD TYR 15 -1.103 4.040 -1.449
100 HD2 TYR 15 2HD TYR 15 -2.789 6.863 -4.151
101 HE1 TYR 15 1HE TYR 15 1.154 4.643 -2.218
102 HE2 TYR 15 2HE TYR 15 -0.539 7.473 -4.927
103 HH TYR 15 HH TYR 15 2.053 5.734 -4.606
104 HB2 TYR 15 1HB TYR 15 -3.766 4.074 -2.711
105 HB3 TYR 15 2HB TYR 15 -4.179 5.787 -2.626
106 H TRP 16 H TRP 16 -4.619 7.219 -0.391
107 HA TRP 16 HA TRP 16 -2.259 8.697 0.125
108 HD1 TRP 16 HD TRP 16 -5.568 8.760 -2.065
109 HE1 TRP 16 1HE TRP 16 -4.992 10.116 -4.176
110 HE3 TRP 16 3HE TRP 16 -2.212 12.038 -0.033
111 HZ2 TRP 16 2HZ TRP 16 -3.335 12.288 -4.887
112 HZ3 TRP 16 3HZ TRP 16 -1.176 13.723 -1.497
113 HH2 TRP 16 HH TRP 16 -1.727 13.844 -3.874
114 HB2 TRP 16 1HB TRP 16 -5.189 9.292 0.570
115 HB3 TRP 16 2HB TRP 16 -3.917 10.451 0.955
116 H VAL 17 H VAL 17 -4.778 7.379 2.249
117 HA VAL 17 HA VAL 17 -3.682 8.389 4.658
118 HB VAL 17 HB VAL 17 -6.021 7.661 4.488
119 HG11 VAL 17 1HG1 VAL 17 -4.904 4.861 4.373
120 HG12 VAL 17 2HG1 VAL 17 -6.609 5.309 4.437
121 HG13 VAL 17 3HG1 VAL 17 -5.641 5.720 3.021
122 HG21 VAL 17 3HG2 VAL 17 -6.168 6.996 6.669
123 HG22 VAL 17 1HG2 VAL 17 -4.867 5.816 6.513
124 HG23 VAL 17 2HG2 VAL 17 -4.489 7.533 6.643
125 H GLY 18 H GLY 18 -3.175 5.436 2.822
126 HA2 GLY 18 2HA GLY 18 -1.759 4.019 4.833
127 HA3 GLY 18 3HA GLY 18 -1.720 3.680 3.110
128 H LYS 19 H LYS 19 -0.695 6.106 2.173
129 HA LYS 19 HA LYS 19 2.087 5.703 2.684
130 HB2 LYS 19 1HB LYS 19 2.451 7.508 1.087
131 HB3 LYS 19 2HB LYS 19 1.245 6.368 0.471
132 HG2 LYS 19 1HG LYS 19 -0.554 7.871 1.034
133 HG3 LYS 19 2HG LYS 19 0.588 8.988 1.802
134 HD2 LYS 19 1HD LYS 19 1.098 8.235 -1.035
135 HD3 LYS 19 2HD LYS 19 -0.258 9.326 -0.696
136 HE2 LYS 19 1HE LYS 19 1.112 11.000 0.147
137 HE3 LYS 19 2HE LYS 19 2.410 9.865 0.537
138 HZ1 LYS 19 3HZ LYS 19 1.640 10.384 -2.266
139 HZ2 LYS 19 1HZ LYS 19 3.093 9.757 -1.667
140 HZ3 LYS 19 2HZ LYS 19 2.728 11.396 -1.456
141 H ALA 20 H ALA 20 -0.326 8.006 3.750
142 HA ALA 20 HA ALA 20 1.498 9.882 4.876
143 HB1 ALA 20 1HB ALA 20 -0.817 10.280 6.257
144 HB2 ALA 20 2HB ALA 20 -0.444 10.984 4.683
145 HB3 ALA 20 3HB ALA 20 -1.405 9.510 4.784
146 H LEU 21 H LEU 21 0.020 6.935 5.999
147 HA LEU 21 HA LEU 21 0.588 7.373 8.775
148 HG LEU 21 HG LEU 21 -1.813 6.804 8.799
149 HB2 LEU 21 1HB LEU 21 -0.593 5.251 7.112
150 HB3 LEU 21 2HB LEU 21 0.283 4.680 8.543
151 HD11 LEU 21 1HD1 LEU 21 -3.558 5.309 8.850
152 HD12 LEU 21 2HD1 LEU 21 -2.506 3.924 9.144
153 HD13 LEU 21 3HD1 LEU 21 -2.579 4.651 7.539
154 HD21 LEU 21 3HD2 LEU 21 -0.355 4.920 10.572
155 HD22 LEU 21 1HD2 LEU 21 -2.013 5.342 10.996
156 HD23 LEU 21 2HD2 LEU 21 -0.796 6.609 10.830
157 H GLY 22 H GLY 22 2.295 6.061 6.055
158 HA2 GLY 22 2HA GLY 22 4.681 5.912 6.079
159 HA3 GLY 22 3HA GLY 22 4.611 5.597 7.806
160 H ASN 23 H ASN 23 2.999 4.106 5.000
161 HA ASN 23 HA ASN 23 3.781 1.482 6.048
162 HB2 ASN 23 1HB ASN 23 1.628 2.425 4.170
163 HB3 ASN 23 2HB ASN 23 2.120 0.727 4.190
164 HD21 ASN 23 1HD2 ASN 23 1.638 3.158 6.729
165 HD22 ASN 23 2HD2 ASN 23 0.542 2.207 7.667
166 H LEU 24 H LEU 24 5.707 3.170 4.717
167 HA LEU 24 HA LEU 24 6.848 1.275 2.962
168 HG LEU 24 HG LEU 24 6.273 4.787 2.116
169 HB2 LEU 24 1HB LEU 24 6.757 2.462 0.866
170 HB3 LEU 24 2HB LEU 24 5.116 2.141 1.452
171 HD11 LEU 24 1HD1 LEU 24 5.806 3.824 -0.654
172 HD12 LEU 24 2HD1 LEU 24 6.975 4.995 -0.042
173 HD13 LEU 24 3HD1 LEU 24 5.283 5.457 -0.239
174 HD21 LEU 24 3HD2 LEU 24 3.633 4.582 0.892
175 HD22 LEU 24 1HD2 LEU 24 4.125 5.328 2.414
176 HD23 LEU 24 2HD2 LEU 24 3.814 3.592 2.341
177 H SER 25 H SER 25 7.642 2.736 5.245
178 HA SER 25 HA SER 25 9.342 4.910 4.485
179 HG SER 25 HG SER 25 9.777 5.731 7.666
180 HB2 SER 25 1HB SER 25 8.264 4.454 6.792
181 HB3 SER 25 2HB SER 25 9.619 3.339 7.039
182 H ASP 26 H ASP 26 9.922 1.544 5.477
183 HA ASP 26 HA ASP 26 12.735 1.669 5.054
184 HD2 ASP 26 HD ASP 26 14.522 -1.532 6.612
185 HB2 ASP 26 1HB ASP 26 10.932 -0.144 6.203
186 HB3 ASP 26 2HB ASP 26 11.656 -1.010 4.840
187 H VAL 27 H VAL 27 9.987 0.809 3.064
188 HA VAL 27 HA VAL 27 11.374 -0.481 0.980
189 HB VAL 27 HB VAL 27 8.832 1.127 0.719
190 HG11 VAL 27 1HG1 VAL 27 10.370 -0.563 -1.081
191 HG12 VAL 27 2HG1 VAL 27 8.686 -1.076 -0.931
192 HG13 VAL 27 3HG1 VAL 27 9.067 0.572 -1.431
193 HG21 VAL 27 3HG2 VAL 27 7.715 -1.099 1.074
194 HG22 VAL 27 1HG2 VAL 27 9.275 -1.712 1.624
195 HG23 VAL 27 2HG2 VAL 27 8.479 -0.408 2.504
196 H ASN 28 H ASN 28 11.082 2.839 1.849
197 HA ASN 28 HA ASN 28 11.680 3.931 -0.727
198 HB2 ASN 28 1HB ASN 28 10.514 5.100 1.240
199 HB3 ASN 28 2HB ASN 28 12.136 5.323 1.907
200 HD21 ASN 28 1HD2 ASN 28 13.080 7.162 1.432
201 HD22 ASN 28 2HD2 ASN 28 12.767 8.144 0.045
202 H GLN 29 H GLN 29 13.558 3.124 2.153
203 HA GLN 29 HA GLN 29 16.016 4.144 1.067
204 HB2 GLN 29 1HB GLN 29 17.066 3.236 3.058
205 HB3 GLN 29 2HB GLN 29 15.580 4.092 3.499
206 HG2 GLN 29 1HG GLN 29 14.413 2.109 3.937
207 HG3 GLN 29 2HG GLN 29 15.611 1.125 3.084
208 HE21 GLN 29 1HE2 GLN 29 17.867 1.276 4.041
209 HE22 GLN 29 2HE2 GLN 29 17.972 1.201 5.764
210 H ALA 30 H ALA 30 14.311 1.133 1.030
211 HA ALA 30 HA ALA 30 16.445 -0.621 0.495
212 HB1 ALA 30 1HB ALA 30 14.038 -1.191 1.113
213 HB2 ALA 30 2HB ALA 30 13.674 -0.981 -0.600
214 HB3 ALA 30 3HB ALA 30 14.828 -2.213 -0.089
215 H SER 31 H SER 31 14.675 1.600 -1.526
216 HA SER 31 HA SER 31 15.214 0.569 -4.051
217 HG SER 31 HG SER 31 15.377 3.608 -2.253
218 HB2 SER 31 1HB SER 31 14.803 2.788 -4.913
219 HB3 SER 31 2HB SER 31 13.706 2.504 -3.551
220 H ARG 32 H ARG 32 17.321 2.068 -1.772
221 HA ARG 32 HA ARG 32 19.337 2.931 -3.574
222 HE ARG 32 HE ARG 32 18.979 5.920 -1.210
223 HB2 ARG 32 1HB ARG 32 18.946 3.548 -1.078
224 HB3 ARG 32 2HB ARG 32 19.903 2.098 -0.748
225 HG2 ARG 32 1HG ARG 32 21.543 3.694 -0.719
226 HG3 ARG 32 2HG ARG 32 21.594 3.194 -2.417
227 HD2 ARG 32 1HD ARG 32 21.646 5.619 -2.267
228 HD3 ARG 32 2HD ARG 32 20.134 5.080 -3.008
229 HH11 ARG 32 1HH1 ARG 32 22.375 5.802 -0.460
230 HH12 ARG 32 2HH1 ARG 32 22.217 6.710 1.007
231 HH21 ARG 32 1HH2 ARG 32 18.756 7.116 0.720
232 HH22 ARG 32 2HH2 ARG 32 20.156 7.456 1.677
233 H ILE 33 H ILE 33 18.365 -0.141 -2.522
234 HA ILE 33 HA ILE 33 20.791 -1.317 -3.688
235 HB ILE 33 HB ILE 33 19.455 -2.594 -1.319
236 HG12 ILE 33 1HG1 ILE 33 21.673 -1.615 -0.192
237 HG13 ILE 33 2HG1 ILE 33 21.391 -0.332 -1.381
238 HG21 ILE 33 1HG2 ILE 33 21.882 -3.486 -1.141
239 HG22 ILE 33 2HG2 ILE 33 20.809 -4.149 -2.373
240 HG23 ILE 33 3HG2 ILE 33 22.021 -2.947 -2.814
241 HD11 ILE 33 3HD1 ILE 33 19.743 -1.119 0.967
242 HD12 ILE 33 1HD1 ILE 33 20.249 0.481 0.427
243 HD13 ILE 33 2HD1 ILE 33 18.964 -0.372 -0.428
244 H ASN 34 H ASN 34 17.642 -0.918 -4.070
245 HA ASN 34 HA ASN 34 17.197 -3.651 -5.075
246 HB2 ASN 34 1HB ASN 34 15.460 -1.790 -3.574
247 HB3 ASN 34 2HB ASN 34 14.684 -2.601 -4.939
248 HD21 ASN 34 1HD2 ASN 34 15.876 -2.932 -1.759
249 HD22 ASN 34 2HD2 ASN 34 15.485 -4.600 -1.539
250 H ARG 35 H ARG 35 16.069 -0.310 -5.628
251 HA ARG 35 HA ARG 35 15.697 0.873 -7.535
252 HE ARG 35 HE ARG 35 17.641 2.655 -7.772
253 HB2 ARG 35 1HB ARG 35 18.103 -0.035 -7.923
254 HB3 ARG 35 2HB ARG 35 17.321 -1.118 -9.085
255 HG2 ARG 35 1HG ARG 35 17.303 0.470 -10.628
256 HG3 ARG 35 2HG ARG 35 16.403 1.544 -9.542
257 HD2 ARG 35 1HD ARG 35 19.375 1.180 -9.244
258 HD3 ARG 35 2HD ARG 35 18.703 2.316 -10.420
259 HH11 ARG 35 1HH1 ARG 35 20.242 3.474 -9.937
260 HH12 ARG 35 2HH1 ARG 35 20.646 4.938 -9.104
261 HH21 ARG 35 1HH2 ARG 35 18.165 4.580 -6.666
262 HH22 ARG 35 2HH2 ARG 35 19.465 5.566 -7.245
263 H LYS 36 H LYS 36 14.262 -1.785 -6.836
264 HA LYS 36 HA LYS 36 12.535 -3.024 -7.648
265 HB2 LYS 36 1HB LYS 36 12.326 -0.654 -9.519
266 HB3 LYS 36 2HB LYS 36 11.091 -1.914 -9.354
267 HG2 LYS 36 1HG LYS 36 12.020 -0.304 -6.991
268 HG3 LYS 36 2HG LYS 36 10.742 0.270 -8.080
269 HD2 LYS 36 1HD LYS 36 9.260 -1.383 -7.454
270 HD3 LYS 36 2HD LYS 36 10.553 -2.486 -6.951
271 HE2 LYS 36 1HE LYS 36 11.041 -0.830 -5.071
272 HE3 LYS 36 2HE LYS 36 9.498 -0.073 -5.498
273 HZ1 LYS 36 3HZ LYS 36 8.337 -2.064 -4.981
274 HZ2 LYS 36 1HZ LYS 36 9.363 -1.735 -3.677
275 HZ3 LYS 36 2HZ LYS 36 9.770 -2.941 -4.792
276 H LYS 37 H LYS 37 13.973 -4.679 -8.371
277 HA LYS 37 HA LYS 37 14.569 -4.693 -11.240
278 HB2 LYS 37 1HB LYS 37 15.488 -6.688 -9.163
279 HB3 LYS 37 2HB LYS 37 16.140 -6.442 -10.791
280 HG2 LYS 37 1HG LYS 37 16.525 -3.978 -9.777
281 HG3 LYS 37 2HG LYS 37 16.650 -4.951 -8.300
282 HD2 LYS 37 1HD LYS 37 18.804 -5.198 -8.906
283 HD3 LYS 37 2HD LYS 37 18.159 -6.422 -10.014
284 HE2 LYS 37 1HE LYS 37 19.434 -5.137 -11.451
285 HE3 LYS 37 2HE LYS 37 17.833 -4.404 -11.629
286 HZ1 LYS 37 3HZ LYS 37 19.000 -3.077 -9.524
287 HZ2 LYS 37 1HZ LYS 37 18.781 -2.488 -11.095
288 HZ3 LYS 37 2HZ LYS 37 20.239 -3.235 -10.667
289 H LYS 38 H LYS 38 12.684 -6.304 -8.790
290 HA LYS 38 HA LYS 38 11.991 -8.621 -10.241
291 HB2 LYS 38 1HB LYS 38 11.283 -7.383 -7.743
292 HB3 LYS 38 2HB LYS 38 9.816 -7.930 -8.573
293 HG2 LYS 38 1HG LYS 38 10.768 -10.183 -8.783
294 HG3 LYS 38 2HG LYS 38 12.215 -9.631 -7.920
295 HD2 LYS 38 1HD LYS 38 11.235 -9.890 -5.933
296 HD3 LYS 38 2HD LYS 38 9.823 -8.955 -6.451
297 HE2 LYS 38 1HE LYS 38 8.845 -10.925 -7.491
298 HE3 LYS 38 2HE LYS 38 10.285 -11.868 -7.083
299 HZ1 LYS 38 3HZ LYS 38 8.043 -11.625 -5.551
300 HZ2 LYS 38 1HZ LYS 38 9.147 -10.593 -4.791
301 HZ3 LYS 38 2HZ LYS 38 9.539 -12.219 -5.033
302 H HIS 39 H HIS 39 10.870 -5.346 -10.382
303 HA HIS 39 HA HIS 39 8.535 -6.075 -11.975
304 HD1 HIS 39 1HD HIS 39 6.222 -3.823 -9.959
305 HD2 HIS 39 2HD HIS 39 7.548 -3.447 -13.879
306 HE1 HIS 39 1HE HIS 39 4.181 -3.234 -11.306
307 HE2 HIS 39 2HE HIS 39 4.991 -3.003 -13.702
308 HB2 HIS 39 1HB HIS 39 8.656 -4.225 -10.129
309 HB3 HIS 39 2HB HIS 39 9.371 -3.248 -11.415
Start of MODEL 12
1 H1 GLY 1 H GLY 1 -7.194 -8.875 10.692
2 HA2 GLY 1 2HA GLY 1 -6.116 -6.693 9.970
3 HA3 GLY 1 3HA GLY 1 -5.693 -7.572 8.508
4 H THR 2 H THR 2 -7.466 -5.178 9.135
5 HA THR 2 HA THR 2 -9.386 -5.620 7.130
6 HB THR 2 HB THR 2 -11.293 -5.176 9.055
7 HG1 THR 2 1HG THR 2 -9.644 -5.812 10.640
8 HG21 THR 2 3HG2 THR 2 -12.145 -6.733 7.700
9 HG22 THR 2 1HG2 THR 2 -11.295 -7.942 8.662
10 HG23 THR 2 2HG2 THR 2 -10.539 -7.273 7.215
11 H TRP 3 H TRP 3 -7.447 -3.651 8.110
12 HA TRP 3 HA TRP 3 -8.849 -1.385 9.116
13 HD1 TRP 3 HD TRP 3 -4.908 -3.239 9.373
14 HE1 TRP 3 1HE TRP 3 -4.496 -3.312 11.912
15 HE3 TRP 3 3HE TRP 3 -8.038 0.539 10.809
16 HZ2 TRP 3 2HZ TRP 3 -5.381 -1.947 14.220
17 HZ3 TRP 3 3HZ TRP 3 -8.198 1.092 13.202
18 HH2 TRP 3 HH TRP 3 -6.897 -0.128 14.869
19 HB2 TRP 3 1HB TRP 3 -6.157 -1.643 7.750
20 HB3 TRP 3 2HB TRP 3 -6.764 -0.146 8.460
21 H ASP 4 H ASP 4 -8.302 -2.694 5.958
22 HA ASP 4 HA ASP 4 -8.856 -0.289 4.508
23 HD2 ASP 4 HD ASP 4 -7.431 0.182 1.575
24 HB2 ASP 4 1HB ASP 4 -8.060 -2.989 3.907
25 HB3 ASP 4 2HB ASP 4 -9.417 -2.524 2.871
26 H ASP 5 H ASP 5 -10.729 -3.155 5.415
27 HA ASP 5 HA ASP 5 -13.122 -2.194 4.136
28 HD2 ASP 5 HD ASP 5 -14.721 -5.749 2.914
29 HB2 ASP 5 1HB ASP 5 -12.219 -4.672 5.000
30 HB3 ASP 5 2HB ASP 5 -13.501 -4.273 6.149
31 H ILE 6 H ILE 6 -11.941 -2.478 7.466
32 HA ILE 6 HA ILE 6 -14.313 -1.361 8.618
33 HB ILE 6 HB ILE 6 -11.565 -1.741 9.814
34 HG12 ILE 6 1HG1 ILE 6 -14.088 -3.380 10.152
35 HG13 ILE 6 2HG1 ILE 6 -12.748 -3.819 9.082
36 HG21 ILE 6 1HG2 ILE 6 -12.670 -0.069 11.083
37 HG22 ILE 6 2HG2 ILE 6 -14.193 -0.957 11.052
38 HG23 ILE 6 3HG2 ILE 6 -12.830 -1.575 11.984
39 HD11 ILE 6 3HD1 ILE 6 -12.195 -5.059 10.898
40 HD12 ILE 6 1HD1 ILE 6 -11.342 -3.566 11.298
41 HD13 ILE 6 2HD1 ILE 6 -12.907 -3.916 12.037
42 H GLY 7 H GLY 7 -11.289 -0.106 7.420
43 HA2 GLY 7 2HA GLY 7 -11.642 2.487 8.658
44 HA3 GLY 7 3HA GLY 7 -10.369 2.028 7.537
45 H GLN 8 H GLN 8 -11.909 1.133 5.390
46 HA GLN 8 HA GLN 8 -12.753 1.993 3.453
47 HB2 GLN 8 1HB GLN 8 -14.763 1.733 5.036
48 HB3 GLN 8 2HB GLN 8 -14.699 3.497 5.188
49 HG2 GLN 8 1HG GLN 8 -14.618 3.135 2.467
50 HG3 GLN 8 2HG GLN 8 -15.696 1.842 3.009
51 HE21 GLN 8 1HE2 GLN 8 -15.109 5.295 3.580
52 HE22 GLN 8 2HE2 GLN 8 -16.776 5.740 3.654
53 H GLY 9 H GLY 9 -10.620 3.299 3.596
54 HA2 GLY 9 2HA GLY 9 -11.058 5.832 2.512
55 HA3 GLY 9 3HA GLY 9 -10.711 6.059 4.219
56 H ILE 10 H ILE 10 -8.865 3.901 4.493
57 HA ILE 10 HA ILE 10 -6.463 5.148 3.953
58 HB ILE 10 HB ILE 10 -6.714 3.259 5.522
59 HG12 ILE 10 1HG1 ILE 10 -4.651 2.362 3.549
60 HG13 ILE 10 2HG1 ILE 10 -4.511 3.985 4.246
61 HG21 ILE 10 1HG2 ILE 10 -8.101 1.941 3.786
62 HG22 ILE 10 2HG2 ILE 10 -6.537 1.377 3.202
63 HG23 ILE 10 3HG2 ILE 10 -7.024 1.054 4.866
64 HD11 ILE 10 3HD1 ILE 10 -3.409 1.812 5.349
65 HD12 ILE 10 1HD1 ILE 10 -3.924 3.220 6.278
66 HD13 ILE 10 2HD1 ILE 10 -4.971 1.804 6.169
67 H GLY 11 H GLY 11 -8.406 3.122 1.881
68 HA2 GLY 11 2HA GLY 11 -6.450 2.464 -0.042
69 HA3 GLY 11 3HA GLY 11 -8.185 2.513 -0.321
70 H ARG 12 H ARG 12 -8.855 5.095 -0.038
71 HA ARG 12 HA ARG 12 -7.759 6.262 -2.422
72 HE ARG 12 HE ARG 12 -10.792 4.120 -4.294
73 HB2 ARG 12 1HB ARG 12 -9.739 7.388 -0.427
74 HB3 ARG 12 2HB ARG 12 -9.385 8.059 -2.025
75 HG2 ARG 12 1HG ARG 12 -10.542 5.316 -1.533
76 HG3 ARG 12 2HG ARG 12 -11.477 6.758 -1.964
77 HD2 ARG 12 1HD ARG 12 -10.369 6.936 -4.091
78 HD3 ARG 12 2HD ARG 12 -9.234 5.653 -3.645
79 HH11 ARG 12 1HH1 ARG 12 -12.399 7.147 -3.681
80 HH12 ARG 12 2HH1 ARG 12 -13.940 6.590 -4.242
81 HH21 ARG 12 1HH2 ARG 12 -12.817 3.375 -5.035
82 HH22 ARG 12 2HH2 ARG 12 -14.178 4.444 -5.011
83 H VAL 13 H VAL 13 -7.431 6.760 1.026
84 HA VAL 13 HA VAL 13 -6.138 9.285 0.889
85 HB VAL 13 HB VAL 13 -6.015 7.191 3.064
86 HG11 VAL 13 1HG1 VAL 13 -5.299 10.121 3.133
87 HG12 VAL 13 2HG1 VAL 13 -5.326 9.033 4.522
88 HG13 VAL 13 3HG1 VAL 13 -4.168 8.773 3.218
89 HG21 VAL 13 3HG2 VAL 13 -8.185 8.693 2.193
90 HG22 VAL 13 1HG2 VAL 13 -8.032 7.854 3.737
91 HG23 VAL 13 2HG2 VAL 13 -7.589 9.557 3.610
92 H ALA 14 H ALA 14 -4.975 5.950 1.003
93 HA ALA 14 HA ALA 14 -2.264 6.387 1.358
94 HB1 ALA 14 1HB ALA 14 -3.595 4.265 -0.320
95 HB2 ALA 14 2HB ALA 14 -1.921 4.228 0.238
96 HB3 ALA 14 3HB ALA 14 -3.242 4.168 1.405
97 H TYR 15 H TYR 15 -4.232 6.815 -1.495
98 HA TYR 15 HA TYR 15 -2.052 7.024 -3.331
99 HD1 TYR 15 2HD TYR 15 -2.573 6.629 -6.095
100 HD2 TYR 15 1HD TYR 15 -4.992 9.856 -4.741
101 HE1 TYR 15 2HE TYR 15 -2.173 7.812 -8.214
102 HE2 TYR 15 1HE TYR 15 -4.601 11.045 -6.857
103 HH TYR 15 HH TYR 15 -2.614 9.611 -9.430
104 HB2 TYR 15 1HB TYR 15 -4.203 6.372 -4.179
105 HB3 TYR 15 2HB TYR 15 -4.957 7.827 -3.527
106 H TRP 16 H TRP 16 -3.815 9.240 -1.292
107 HA TRP 16 HA TRP 16 -2.803 11.615 -2.549
108 HD1 TRP 16 HD TRP 16 -6.530 10.548 -1.611
109 HE1 TRP 16 1HE TRP 16 -7.971 12.034 -3.141
110 HE3 TRP 16 3HE TRP 16 -3.467 14.630 -1.898
111 HZ2 TRP 16 2HZ TRP 16 -7.829 14.595 -4.316
112 HZ3 TRP 16 3HZ TRP 16 -4.192 16.556 -3.247
113 HH2 TRP 16 HH TRP 16 -6.328 16.536 -4.432
114 HB2 TRP 16 1HB TRP 16 -4.411 11.007 -0.094
115 HB3 TRP 16 2HB TRP 16 -3.651 12.593 -0.245
116 H VAL 17 H VAL 17 -2.039 9.787 0.391
117 HA VAL 17 HA VAL 17 -0.007 11.542 1.301
118 HB VAL 17 HB VAL 17 -1.116 9.937 2.793
119 HG11 VAL 17 1HG1 VAL 17 -0.676 7.589 2.708
120 HG12 VAL 17 2HG1 VAL 17 -1.233 8.093 1.111
121 HG13 VAL 17 3HG1 VAL 17 0.483 7.801 1.396
122 HG21 VAL 17 3HG2 VAL 17 0.947 9.083 3.917
123 HG22 VAL 17 1HG2 VAL 17 1.870 9.637 2.521
124 HG23 VAL 17 2HG2 VAL 17 0.995 10.800 3.516
125 H GLY 18 H GLY 18 -0.033 8.776 -0.860
126 HA2 GLY 18 2HA GLY 18 2.643 8.111 -0.965
127 HA3 GLY 18 3HA GLY 18 1.551 8.014 -2.339
128 H LYS 19 H LYS 19 1.005 10.528 -3.009
129 HA LYS 19 HA LYS 19 3.455 11.420 -4.182
130 HB2 LYS 19 1HB LYS 19 2.158 12.984 -5.382
131 HB3 LYS 19 2HB LYS 19 1.134 11.546 -5.220
132 HG2 LYS 19 1HG LYS 19 -0.411 13.090 -4.645
133 HG3 LYS 19 2HG LYS 19 0.327 12.866 -3.050
134 HD2 LYS 19 1HD LYS 19 0.722 15.062 -3.020
135 HD3 LYS 19 2HD LYS 19 1.926 14.777 -4.287
136 HE2 LYS 19 1HE LYS 19 0.061 15.000 -5.978
137 HE3 LYS 19 2HE LYS 19 -0.967 15.535 -4.641
138 HZ1 LYS 19 3HZ LYS 19 -0.219 17.553 -5.191
139 HZ2 LYS 19 1HZ LYS 19 1.119 16.958 -6.036
140 HZ3 LYS 19 2HZ LYS 19 1.184 17.119 -4.354
141 H ALA 20 H ALA 20 1.511 12.383 -1.444
142 HA ALA 20 HA ALA 20 2.563 14.952 -1.024
143 HB1 ALA 20 1HB ALA 20 1.823 13.288 1.322
144 HB2 ALA 20 2HB ALA 20 1.398 14.955 0.935
145 HB3 ALA 20 3HB ALA 20 0.580 13.625 0.116
146 H LEU 21 H LEU 21 3.787 11.774 -0.247
147 HA LEU 21 HA LEU 21 5.819 12.692 1.552
148 HG LEU 21 HG LEU 21 3.925 10.803 2.157
149 HB2 LEU 21 1HB LEU 21 5.414 10.078 0.097
150 HB3 LEU 21 2HB LEU 21 6.730 10.375 1.245
151 HD11 LEU 21 1HD1 LEU 21 4.028 8.335 2.879
152 HD12 LEU 21 2HD1 LEU 21 5.195 8.156 1.569
153 HD13 LEU 21 3HD1 LEU 21 3.557 8.711 1.220
154 HD21 LEU 21 3HD2 LEU 21 4.896 10.889 4.156
155 HD22 LEU 21 1HD2 LEU 21 6.449 10.879 3.320
156 HD23 LEU 21 2HD2 LEU 21 5.743 9.365 3.881
157 H GLY 22 H GLY 22 5.535 12.285 -1.881
158 HA2 GLY 22 2HA GLY 22 7.276 13.799 -2.992
159 HA3 GLY 22 3HA GLY 22 8.430 12.740 -2.195
160 H ASN 23 H ASN 23 5.388 11.889 -3.800
161 HA ASN 23 HA ASN 23 4.924 10.430 -5.482
162 HB2 ASN 23 1HB ASN 23 6.394 12.308 -6.605
163 HB3 ASN 23 2HB ASN 23 7.578 11.003 -6.745
164 HD21 ASN 23 1HD2 ASN 23 4.142 11.628 -7.354
165 HD22 ASN 23 2HD2 ASN 23 4.066 10.737 -8.832
166 H LEU 24 H LEU 24 4.995 8.513 -4.338
167 HA LEU 24 HA LEU 24 6.887 6.595 -5.166
168 HG LEU 24 HG LEU 24 6.106 7.508 -1.705
169 HB2 LEU 24 1HB LEU 24 7.982 6.104 -3.043
170 HB3 LEU 24 2HB LEU 24 8.355 7.741 -3.608
171 HD11 LEU 24 1HD1 LEU 24 7.586 7.354 0.227
172 HD12 LEU 24 2HD1 LEU 24 8.965 7.095 -0.842
173 HD13 LEU 24 3HD1 LEU 24 7.673 5.896 -0.762
174 HD21 LEU 24 3HD2 LEU 24 8.166 9.372 -1.024
175 HD22 LEU 24 1HD2 LEU 24 6.512 9.684 -1.553
176 HD23 LEU 24 2HD2 LEU 24 7.799 9.503 -2.745
177 H SER 25 H SER 25 4.072 6.851 -5.055
178 HA SER 25 HA SER 25 3.010 5.325 -2.887
179 HG SER 25 HG SER 25 0.771 5.437 -2.890
180 HB2 SER 25 1HB SER 25 1.767 7.017 -4.366
181 HB3 SER 25 2HB SER 25 1.673 5.713 -5.563
182 H ASP 26 H ASP 26 3.896 4.607 -6.236
183 HA ASP 26 HA ASP 26 3.060 1.872 -6.096
184 HD2 ASP 26 HD ASP 26 1.379 1.683 -9.438
185 HB2 ASP 26 1HB ASP 26 3.862 3.668 -8.120
186 HB3 ASP 26 2HB ASP 26 5.024 2.335 -8.152
187 H VAL 27 H VAL 27 6.054 3.612 -5.567
188 HA VAL 27 HA VAL 27 7.813 1.413 -5.580
189 HB VAL 27 HB VAL 27 8.051 4.010 -4.054
190 HG11 VAL 27 1HG1 VAL 27 10.570 3.359 -4.424
191 HG12 VAL 27 2HG1 VAL 27 9.662 2.717 -3.053
192 HG13 VAL 27 3HG1 VAL 27 9.913 1.724 -4.489
193 HG21 VAL 27 3HG2 VAL 27 8.309 3.339 -6.863
194 HG22 VAL 27 1HG2 VAL 27 8.258 4.918 -6.079
195 HG23 VAL 27 2HG2 VAL 27 9.787 4.048 -6.213
196 H ASN 28 H ASN 28 5.521 2.530 -3.256
197 HA ASN 28 HA ASN 28 6.672 1.352 -0.944
198 HB2 ASN 28 1HB ASN 28 4.866 3.161 -1.049
199 HB3 ASN 28 2HB ASN 28 3.727 1.845 -1.364
200 HD21 ASN 28 1HD2 ASN 28 2.753 1.035 0.337
201 HD22 ASN 28 2HD2 ASN 28 3.342 1.064 1.961
202 H GLN 29 H GLN 29 4.383 0.227 -3.378
203 HA GLN 29 HA GLN 29 3.764 -2.218 -2.051
204 HB2 GLN 29 1HB GLN 29 2.729 -0.823 -4.198
205 HB3 GLN 29 2HB GLN 29 3.463 -2.244 -4.958
206 HG2 GLN 29 1HG GLN 29 2.011 -3.711 -3.989
207 HG3 GLN 29 2HG GLN 29 1.756 -2.680 -2.573
208 HE21 GLN 29 1HE2 GLN 29 0.286 -3.893 -5.205
209 HE22 GLN 29 2HE2 GLN 29 -0.930 -2.694 -5.458
210 H ALA 30 H ALA 30 6.308 -1.161 -4.143
211 HA ALA 30 HA ALA 30 7.153 -3.643 -5.163
212 HB1 ALA 30 1HB ALA 30 9.107 -2.553 -5.854
213 HB2 ALA 30 2HB ALA 30 7.868 -1.299 -5.878
214 HB3 ALA 30 3HB ALA 30 9.020 -1.374 -4.545
215 H SER 31 H SER 31 7.635 -2.091 -2.079
216 HA SER 31 HA SER 31 9.868 -3.455 -1.138
217 HG SER 31 HG SER 31 6.960 -3.527 0.977
218 HB2 SER 31 1HB SER 31 9.123 -2.892 1.092
219 HB3 SER 31 2HB SER 31 8.738 -1.540 0.010
220 H ARG 32 H ARG 32 6.657 -4.576 -1.694
221 HA ARG 32 HA ARG 32 6.682 -6.803 0.068
222 HE ARG 32 HE ARG 32 4.590 -5.492 1.170
223 HB2 ARG 32 1HB ARG 32 4.786 -5.588 -1.474
224 HB3 ARG 32 2HB ARG 32 5.099 -7.065 -2.401
225 HG2 ARG 32 1HG ARG 32 3.835 -8.243 -1.021
226 HG3 ARG 32 2HG ARG 32 4.858 -7.768 0.344
227 HD2 ARG 32 1HD ARG 32 2.647 -6.028 -0.758
228 HD3 ARG 32 2HD ARG 32 2.423 -7.180 0.568
229 HH11 ARG 32 1HH1 ARG 32 1.123 -5.416 0.863
230 HH12 ARG 32 2HH1 ARG 32 0.920 -4.126 2.002
231 HH21 ARG 32 1HH2 ARG 32 4.336 -3.794 2.672
232 HH22 ARG 32 2HH2 ARG 32 2.748 -3.204 3.030
233 H ILE 33 H ILE 33 8.290 -6.168 -2.848
234 HA ILE 33 HA ILE 33 9.090 -8.986 -3.033
235 HB ILE 33 HB ILE 33 8.735 -7.332 -5.513
236 HG12 ILE 33 1HG1 ILE 33 6.616 -8.952 -5.674
237 HG13 ILE 33 2HG1 ILE 33 6.675 -8.764 -3.911
238 HG21 ILE 33 1HG2 ILE 33 8.281 -10.037 -6.002
239 HG22 ILE 33 2HG2 ILE 33 9.726 -9.111 -6.400
240 HG23 ILE 33 3HG2 ILE 33 9.636 -9.995 -4.876
241 HD11 ILE 33 3HD1 ILE 33 6.827 -6.221 -4.476
242 HD12 ILE 33 1HD1 ILE 33 6.107 -6.728 -6.003
243 HD13 ILE 33 2HD1 ILE 33 5.273 -7.053 -4.483
244 H ASN 34 H ASN 34 10.088 -6.030 -2.329
245 HA ASN 34 HA ASN 34 12.715 -6.378 -3.621
246 HB2 ASN 34 1HB ASN 34 11.015 -3.997 -3.205
247 HB3 ASN 34 2HB ASN 34 12.726 -3.768 -2.827
248 HD21 ASN 34 1HD2 ASN 34 10.397 -4.215 -5.303
249 HD22 ASN 34 2HD2 ASN 34 11.470 -4.058 -6.648
250 H ARG 35 H ARG 35 11.260 -4.824 -0.753
251 HA ARG 35 HA ARG 35 11.905 -4.751 1.428
252 HE ARG 35 HE ARG 35 9.924 -10.075 1.966
253 HB2 ARG 35 1HB ARG 35 13.637 -7.149 0.801
254 HB3 ARG 35 2HB ARG 35 13.003 -6.661 2.380
255 HG2 ARG 35 1HG ARG 35 10.674 -6.959 1.211
256 HG3 ARG 35 2HG ARG 35 11.607 -7.985 0.109
257 HD2 ARG 35 1HD ARG 35 12.129 -9.532 1.751
258 HD3 ARG 35 2HD ARG 35 11.909 -8.356 3.056
259 HH11 ARG 35 1HH1 ARG 35 10.409 -6.910 3.333
260 HH12 ARG 35 2HH1 ARG 35 8.785 -6.773 3.922
261 HH21 ARG 35 1HH2 ARG 35 7.783 -9.906 2.738
262 HH22 ARG 35 2HH2 ARG 35 7.293 -8.479 3.582
263 H LYS 36 H LYS 36 13.639 -3.720 -0.926
264 HA LYS 36 HA LYS 36 16.287 -3.617 0.202
265 HB2 LYS 36 1HB LYS 36 14.950 -2.445 -2.217
266 HB3 LYS 36 2HB LYS 36 16.530 -1.837 -1.698
267 HG2 LYS 36 1HG LYS 36 17.081 -4.453 -1.674
268 HG3 LYS 36 2HG LYS 36 15.802 -4.436 -2.902
269 HD2 LYS 36 1HD LYS 36 17.749 -4.130 -4.153
270 HD3 LYS 36 2HD LYS 36 17.117 -2.484 -3.952
271 HE2 LYS 36 1HE LYS 36 18.642 -2.184 -2.002
272 HE3 LYS 36 2HE LYS 36 19.326 -3.779 -2.357
273 HZ1 LYS 36 3HZ LYS 36 19.478 -1.324 -4.000
274 HZ2 LYS 36 1HZ LYS 36 19.805 -2.852 -4.649
275 HZ3 LYS 36 2HZ LYS 36 20.749 -2.252 -3.380
276 H LYS 37 H LYS 37 14.262 -0.895 -0.858
277 HA LYS 37 HA LYS 37 13.989 0.358 1.623
278 HB2 LYS 37 1HB LYS 37 16.623 0.522 0.626
279 HB3 LYS 37 2HB LYS 37 15.895 2.118 0.379
280 HG2 LYS 37 1HG LYS 37 15.109 1.750 2.886
281 HG3 LYS 37 2HG LYS 37 16.532 0.693 2.899
282 HD2 LYS 37 1HD LYS 37 17.149 3.193 1.590
283 HD3 LYS 37 2HD LYS 37 16.484 3.474 3.209
284 HE2 LYS 37 1HE LYS 37 18.620 3.158 3.875
285 HE3 LYS 37 2HE LYS 37 18.194 1.447 3.729
286 HZ1 LYS 37 3HZ LYS 37 20.176 1.674 2.548
287 HZ2 LYS 37 1HZ LYS 37 19.701 3.122 1.817
288 HZ3 LYS 37 2HZ LYS 37 18.990 1.664 1.341
289 H LYS 38 H LYS 38 14.399 0.724 -1.843
290 HA LYS 38 HA LYS 38 11.932 1.977 -2.230
291 HB2 LYS 38 1HB LYS 38 13.845 3.758 -1.224
292 HB3 LYS 38 2HB LYS 38 13.763 4.100 -2.959
293 HG2 LYS 38 1HG LYS 38 11.272 4.283 -2.729
294 HG3 LYS 38 2HG LYS 38 11.504 4.174 -0.975
295 HD2 LYS 38 1HD LYS 38 13.320 6.120 -1.727
296 HD3 LYS 38 2HD LYS 38 11.924 6.425 -2.776
297 HE2 LYS 38 1HE LYS 38 11.015 7.531 -1.056
298 HE3 LYS 38 2HE LYS 38 10.784 5.946 -0.302
299 HZ1 LYS 38 3HZ LYS 38 12.084 6.691 1.319
300 HZ2 LYS 38 1HZ LYS 38 12.561 8.052 0.435
301 HZ3 LYS 38 2HZ LYS 38 13.387 6.589 0.243
302 H HIS 39 H HIS 39 15.230 1.530 -3.348
303 HA HIS 39 HA HIS 39 14.231 0.732 -5.952
304 HD1 HIS 39 1HD HIS 39 12.703 2.862 -6.640
305 HD2 HIS 39 2HD HIS 39 16.046 2.717 -9.104
306 HE1 HIS 39 1HE HIS 39 11.835 3.217 -8.973
307 HE2 HIS 39 2HE HIS 39 13.878 3.131 -10.479
308 HB2 HIS 39 1HB HIS 39 15.314 3.334 -5.526
309 HB3 HIS 39 2HB HIS 39 16.489 2.411 -6.467
Start of MODEL 13
1 H1 GLY 1 H GLY 1 -5.058 -8.906 12.925
2 HA2 GLY 1 2HA GLY 1 -6.198 -9.257 10.714
3 HA3 GLY 1 3HA GLY 1 -7.622 -9.660 11.662
4 H THR 2 H THR 2 -6.923 -7.469 9.669
5 HA THR 2 HA THR 2 -8.506 -5.438 10.795
6 HB THR 2 HB THR 2 -6.328 -3.788 10.540
7 HG1 THR 2 1HG THR 2 -5.005 -5.761 10.569
8 HG21 THR 2 3HG2 THR 2 -7.306 -3.142 12.435
9 HG22 THR 2 1HG2 THR 2 -6.475 -4.455 13.268
10 HG23 THR 2 2HG2 THR 2 -8.092 -4.711 12.613
11 H TRP 3 H TRP 3 -8.075 -6.962 8.328
12 HA TRP 3 HA TRP 3 -7.058 -5.212 6.322
13 HD1 TRP 3 HD TRP 3 -7.327 -9.481 7.189
14 HE1 TRP 3 1HE TRP 3 -4.904 -10.271 6.827
15 HE3 TRP 3 3HE TRP 3 -5.722 -5.773 4.058
16 HZ2 TRP 3 2HZ TRP 3 -2.615 -9.434 5.403
17 HZ3 TRP 3 3HZ TRP 3 -3.403 -5.839 3.241
18 HH2 TRP 3 HH TRP 3 -1.883 -7.633 3.901
19 HB2 TRP 3 1HB TRP 3 -8.844 -7.654 6.147
20 HB3 TRP 3 2HB TRP 3 -8.183 -6.811 4.744
21 H ASP 4 H ASP 4 -10.121 -5.582 7.890
22 HA ASP 4 HA ASP 4 -11.673 -4.250 5.887
23 HD2 ASP 4 HD ASP 4 -15.074 -6.518 6.720
24 HB2 ASP 4 1HB ASP 4 -12.122 -5.306 8.624
25 HB3 ASP 4 2HB ASP 4 -13.186 -3.990 8.104
26 H ASP 5 H ASP 5 -10.183 -3.290 8.953
27 HA ASP 5 HA ASP 5 -11.105 -0.573 8.738
28 HD2 ASP 5 HD ASP 5 -12.191 -0.839 12.684
29 HB2 ASP 5 1HB ASP 5 -9.754 -2.223 10.722
30 HB3 ASP 5 2HB ASP 5 -9.029 -0.616 10.596
31 H ILE 6 H ILE 6 -8.025 -2.271 8.297
32 HA ILE 6 HA ILE 6 -6.583 0.104 7.600
33 HB ILE 6 HB ILE 6 -5.861 -2.799 7.184
34 HG12 ILE 6 1HG1 ILE 6 -4.925 -0.837 9.290
35 HG13 ILE 6 2HG1 ILE 6 -6.173 -2.066 9.555
36 HG21 ILE 6 1HG2 ILE 6 -4.547 -1.594 5.661
37 HG22 ILE 6 2HG2 ILE 6 -4.308 -0.261 6.790
38 HG23 ILE 6 3HG2 ILE 6 -3.514 -1.811 7.073
39 HD11 ILE 6 3HD1 ILE 6 -3.237 -2.394 9.244
40 HD12 ILE 6 1HD1 ILE 6 -4.344 -3.141 10.395
41 HD13 ILE 6 2HD1 ILE 6 -4.301 -3.701 8.723
42 H GLY 7 H GLY 7 -8.373 -2.339 5.858
43 HA2 GLY 7 2HA GLY 7 -7.350 -1.577 3.272
44 HA3 GLY 7 3HA GLY 7 -8.674 -2.689 3.587
45 H GLN 8 H GLN 8 -10.394 -1.080 5.033
46 HA GLN 8 HA GLN 8 -11.548 0.477 2.920
47 HB2 GLN 8 1HB GLN 8 -12.859 -0.895 4.561
48 HB3 GLN 8 2HB GLN 8 -12.444 0.302 5.799
49 HG2 GLN 8 1HG GLN 8 -14.595 0.888 5.088
50 HG3 GLN 8 2HG GLN 8 -13.507 2.033 4.289
51 HE21 GLN 8 1HE2 GLN 8 -16.142 0.200 3.816
52 HE22 GLN 8 2HE2 GLN 8 -16.038 -0.056 2.110
53 H GLY 9 H GLY 9 -9.445 1.827 2.946
54 HA2 GLY 9 2HA GLY 9 -10.003 4.434 3.596
55 HA3 GLY 9 3HA GLY 9 -9.178 3.794 5.011
56 H ILE 10 H ILE 10 -7.307 2.132 3.862
57 HA ILE 10 HA ILE 10 -5.207 3.834 3.289
58 HB ILE 10 HB ILE 10 -4.880 1.503 3.961
59 HG12 ILE 10 1HG1 ILE 10 -3.024 0.954 2.434
60 HG13 ILE 10 2HG1 ILE 10 -3.623 2.165 1.288
61 HG21 ILE 10 1HG2 ILE 10 -6.737 0.642 2.478
62 HG22 ILE 10 2HG2 ILE 10 -5.580 0.704 1.149
63 HG23 ILE 10 3HG2 ILE 10 -5.274 -0.340 2.536
64 HD11 ILE 10 3HD1 ILE 10 -2.679 3.851 2.390
65 HD12 ILE 10 1HD1 ILE 10 -3.200 3.240 3.959
66 HD13 ILE 10 2HD1 ILE 10 -1.735 2.606 3.209
67 H GLY 11 H GLY 11 -7.611 2.496 1.146
68 HA2 GLY 11 2HA GLY 11 -6.279 2.928 -1.307
69 HA3 GLY 11 3HA GLY 11 -8.019 2.799 -1.094
70 H ARG 12 H ARG 12 -8.665 4.944 0.407
71 HA ARG 12 HA ARG 12 -8.405 7.085 -1.489
72 HE ARG 12 HE ARG 12 -11.617 5.788 -2.862
73 HB2 ARG 12 1HB ARG 12 -9.770 6.900 1.202
74 HB3 ARG 12 2HB ARG 12 -9.826 8.333 0.167
75 HG2 ARG 12 1HG ARG 12 -10.671 5.685 -0.934
76 HG3 ARG 12 2HG ARG 12 -11.769 6.606 0.107
77 HD2 ARG 12 1HD ARG 12 -12.135 8.214 -1.447
78 HD3 ARG 12 2HD ARG 12 -10.473 8.141 -2.049
79 HH11 ARG 12 1HH1 ARG 12 -12.313 9.175 -3.281
80 HH12 ARG 12 2HH1 ARG 12 -13.047 8.965 -4.835
81 HH21 ARG 12 1HH2 ARG 12 -12.582 5.500 -4.909
82 HH22 ARG 12 2HH2 ARG 12 -13.201 6.876 -5.760
83 H VAL 13 H VAL 13 -7.048 6.283 1.634
84 HA VAL 13 HA VAL 13 -5.948 8.844 2.194
85 HB VAL 13 HB VAL 13 -5.108 6.134 3.231
86 HG11 VAL 13 1HG1 VAL 13 -3.352 7.806 3.509
87 HG12 VAL 13 2HG1 VAL 13 -4.502 8.894 4.287
88 HG13 VAL 13 3HG1 VAL 13 -4.064 7.371 5.061
89 HG21 VAL 13 3HG2 VAL 13 -7.493 7.476 3.631
90 HG22 VAL 13 1HG2 VAL 13 -6.829 6.198 4.650
91 HG23 VAL 13 2HG2 VAL 13 -6.534 7.890 5.052
92 H ALA 14 H ALA 14 -4.696 5.924 0.646
93 HA ALA 14 HA ALA 14 -2.019 6.590 0.425
94 HB1 ALA 14 1HB ALA 14 -3.730 5.089 -1.555
95 HB2 ALA 14 2HB ALA 14 -1.966 5.097 -1.529
96 HB3 ALA 14 3HB ALA 14 -2.865 4.401 -0.182
97 H TYR 15 H TYR 15 -4.762 7.745 -1.417
98 HA TYR 15 HA TYR 15 -3.232 8.967 -3.495
99 HD1 TYR 15 2HD TYR 15 -4.556 9.340 -5.967
100 HD2 TYR 15 1HD TYR 15 -6.455 11.725 -3.000
101 HE1 TYR 15 2HE TYR 15 -4.786 11.170 -7.594
102 HE2 TYR 15 1HE TYR 15 -6.690 13.562 -4.618
103 HH TYR 15 HH TYR 15 -5.221 14.175 -6.932
104 HB2 TYR 15 1HB TYR 15 -5.550 8.332 -3.878
105 HB3 TYR 15 2HB TYR 15 -6.085 9.423 -2.596
106 H TRP 16 H TRP 16 -4.330 9.934 -0.338
107 HA TRP 16 HA TRP 16 -3.845 12.740 -0.743
108 HD1 TRP 16 HD TRP 16 -7.092 10.899 0.611
109 HE1 TRP 16 1HE TRP 16 -8.944 12.656 0.285
110 HE3 TRP 16 3HE TRP 16 -4.317 15.140 1.279
111 HZ2 TRP 16 2HZ TRP 16 -9.197 15.466 0.307
112 HZ3 TRP 16 3HZ TRP 16 -5.440 17.323 1.110
113 HH2 TRP 16 HH TRP 16 -7.829 17.480 0.633
114 HB2 TRP 16 1HB TRP 16 -4.625 11.006 1.569
115 HB3 TRP 16 2HB TRP 16 -3.970 12.608 1.902
116 H VAL 17 H VAL 17 -2.165 10.076 0.891
117 HA VAL 17 HA VAL 17 -0.011 11.642 1.860
118 HB VAL 17 HB VAL 17 -0.541 9.447 2.806
119 HG11 VAL 17 1HG1 VAL 17 -0.116 7.401 1.650
120 HG12 VAL 17 2HG1 VAL 17 -1.153 8.392 0.622
121 HG13 VAL 17 3HG1 VAL 17 0.570 8.257 0.271
122 HG21 VAL 17 3HG2 VAL 17 2.216 9.478 1.582
123 HG22 VAL 17 1HG2 VAL 17 1.735 10.392 3.011
124 HG23 VAL 17 2HG2 VAL 17 1.720 8.628 3.046
125 H GLY 18 H GLY 18 -0.583 9.910 -1.147
126 HA2 GLY 18 2HA GLY 18 2.075 10.034 -2.128
127 HA3 GLY 18 3HA GLY 18 0.629 9.778 -3.094
128 H LYS 19 H LYS 19 -0.726 12.163 -2.556
129 HA LYS 19 HA LYS 19 0.614 13.920 -4.363
130 HB2 LYS 19 1HB LYS 19 -1.318 15.381 -4.081
131 HB3 LYS 19 2HB LYS 19 -1.832 13.705 -4.326
132 HG2 LYS 19 1HG LYS 19 -2.293 13.437 -1.974
133 HG3 LYS 19 2HG LYS 19 -1.648 15.053 -1.640
134 HD2 LYS 19 1HD LYS 19 -3.683 15.174 -3.692
135 HD3 LYS 19 2HD LYS 19 -4.298 14.379 -2.233
136 HE2 LYS 19 1HE LYS 19 -3.905 16.249 -0.883
137 HE3 LYS 19 2HE LYS 19 -2.760 16.944 -2.038
138 HZ1 LYS 19 3HZ LYS 19 -4.606 17.355 -3.557
139 HZ2 LYS 19 1HZ LYS 19 -4.845 18.137 -2.075
140 HZ3 LYS 19 2HZ LYS 19 -5.695 16.719 -2.429
141 H ALA 20 H ALA 20 0.192 13.779 -0.891
142 HA ALA 20 HA ALA 20 1.088 16.423 -0.339
143 HB1 ALA 20 1HB ALA 20 0.543 13.982 1.251
144 HB2 ALA 20 2HB ALA 20 1.576 15.215 1.975
145 HB3 ALA 20 3HB ALA 20 -0.058 15.628 1.456
146 H LEU 21 H LEU 21 2.687 13.371 -0.869
147 HA LEU 21 HA LEU 21 5.207 14.115 0.230
148 HG LEU 21 HG LEU 21 6.319 12.396 0.802
149 HB2 LEU 21 1HB LEU 21 4.041 11.787 -0.751
150 HB3 LEU 21 2HB LEU 21 5.354 12.142 -1.888
151 HD11 LEU 21 1HD1 LEU 21 4.357 10.781 1.128
152 HD12 LEU 21 2HD1 LEU 21 5.943 10.284 1.717
153 HD13 LEU 21 3HD1 LEU 21 5.322 9.634 0.199
154 HD21 LEU 21 3HD2 LEU 21 6.925 10.562 -1.509
155 HD22 LEU 21 1HD2 LEU 21 7.862 10.608 -0.016
156 HD23 LEU 21 2HD2 LEU 21 7.780 12.035 -1.048
157 H GLY 22 H GLY 22 3.646 14.587 -2.837
158 HA2 GLY 22 2HA GLY 22 4.676 16.608 -3.987
159 HA3 GLY 22 3HA GLY 22 6.159 15.666 -3.945
160 H ASN 23 H ASN 23 6.540 14.174 -5.503
161 HA ASN 23 HA ASN 23 4.372 13.330 -7.254
162 HB2 ASN 23 1HB ASN 23 6.796 14.868 -8.217
163 HB3 ASN 23 2HB ASN 23 5.737 13.939 -9.285
164 HD21 ASN 23 1HD2 ASN 23 5.873 16.663 -7.084
165 HD22 ASN 23 2HD2 ASN 23 4.505 17.497 -7.731
166 H LEU 24 H LEU 24 4.800 11.278 -6.328
167 HA LEU 24 HA LEU 24 6.657 9.711 -7.788
168 HG LEU 24 HG LEU 24 8.729 10.492 -7.605
169 HB2 LEU 24 1HB LEU 24 7.445 10.723 -5.132
170 HB3 LEU 24 2HB LEU 24 7.663 8.983 -5.380
171 HD11 LEU 24 1HD1 LEU 24 10.415 11.736 -6.579
172 HD12 LEU 24 2HD1 LEU 24 10.138 10.990 -5.005
173 HD13 LEU 24 3HD1 LEU 24 8.964 12.133 -5.656
174 HD21 LEU 24 3HD2 LEU 24 9.444 8.294 -7.386
175 HD22 LEU 24 1HD2 LEU 24 9.688 8.441 -5.646
176 HD23 LEU 24 2HD2 LEU 24 10.811 9.217 -6.762
177 H SER 25 H SER 25 4.597 8.700 -8.142
178 HA SER 25 HA SER 25 3.419 7.299 -5.869
179 HG SER 25 HG SER 25 1.748 8.049 -9.482
180 HB2 SER 25 1HB SER 25 1.810 6.531 -7.821
181 HB3 SER 25 2HB SER 25 1.680 8.158 -7.127
182 H ASP 26 H ASP 26 5.354 6.715 -8.690
183 HA ASP 26 HA ASP 26 4.962 3.983 -9.061
184 HD2 ASP 26 HD ASP 26 6.312 3.628 -12.732
185 HB2 ASP 26 1HB ASP 26 7.049 5.953 -9.743
186 HB3 ASP 26 2HB ASP 26 7.612 4.279 -9.649
187 H VAL 27 H VAL 27 6.781 5.705 -6.637
188 HA VAL 27 HA VAL 27 8.241 3.414 -5.710
189 HB VAL 27 HB VAL 27 8.792 4.870 -3.751
190 HG11 VAL 27 1HG1 VAL 27 10.280 6.290 -4.956
191 HG12 VAL 27 2HG1 VAL 27 10.118 4.792 -5.876
192 HG13 VAL 27 3HG1 VAL 27 9.257 6.243 -6.391
193 HG21 VAL 27 3HG2 VAL 27 7.301 7.012 -5.256
194 HG22 VAL 27 1HG2 VAL 27 6.653 6.165 -3.850
195 HG23 VAL 27 2HG2 VAL 27 8.104 7.156 -3.693
196 H ASN 28 H ASN 28 5.162 4.878 -5.019
197 HA ASN 28 HA ASN 28 4.673 3.809 -2.478
198 HB2 ASN 28 1HB ASN 28 3.284 5.564 -3.492
199 HB3 ASN 28 2HB ASN 28 2.693 4.405 -4.690
200 HD21 ASN 28 1HD2 ASN 28 3.213 4.045 -1.209
201 HD22 ASN 28 2HD2 ASN 28 1.579 3.629 -0.831
202 H GLN 29 H GLN 29 3.918 2.516 -5.700
203 HA GLN 29 HA GLN 29 2.801 0.091 -4.666
204 HB2 GLN 29 1HB GLN 29 3.337 1.264 -7.328
205 HB3 GLN 29 2HB GLN 29 3.355 -0.504 -7.253
206 HG2 GLN 29 1HG GLN 29 1.122 -0.636 -6.591
207 HG3 GLN 29 2HG GLN 29 1.082 1.062 -6.096
208 HE21 GLN 29 1HE2 GLN 29 2.185 -0.500 -9.079
209 HE22 GLN 29 2HE2 GLN 29 1.141 0.385 -10.133
210 H ALA 30 H ALA 30 5.958 1.145 -5.716
211 HA ALA 30 HA ALA 30 7.162 -1.370 -6.086
212 HB1 ALA 30 1HB ALA 30 9.237 -0.238 -6.054
213 HB2 ALA 30 2HB ALA 30 8.077 0.882 -6.772
214 HB3 ALA 30 3HB ALA 30 8.582 1.089 -5.094
215 H SER 31 H SER 31 6.377 0.440 -3.227
216 HA SER 31 HA SER 31 8.140 -0.659 -1.379
217 HG SER 31 HG SER 31 4.865 -0.454 0.447
218 HB2 SER 31 1HB SER 31 6.818 0.285 0.256
219 HB3 SER 31 2HB SER 31 6.251 1.187 -1.161
220 H ARG 32 H ARG 32 5.458 -2.086 -3.002
221 HA ARG 32 HA ARG 32 4.909 -4.167 -1.148
222 HE ARG 32 HE ARG 32 3.094 -7.197 -3.196
223 HB2 ARG 32 1HB ARG 32 3.818 -3.249 -3.551
224 HB3 ARG 32 2HB ARG 32 4.367 -4.894 -3.901
225 HG2 ARG 32 1HG ARG 32 3.134 -5.500 -1.683
226 HG3 ARG 32 2HG ARG 32 2.286 -3.971 -1.975
227 HD2 ARG 32 1HD ARG 32 0.910 -5.511 -3.036
228 HD3 ARG 32 2HD ARG 32 1.912 -4.900 -4.358
229 HH11 ARG 32 1HH1 ARG 32 0.493 -6.200 -5.282
230 HH12 ARG 32 2HH1 ARG 32 0.442 -7.697 -6.153
231 HH21 ARG 32 1HH2 ARG 32 3.036 -9.174 -4.334
232 HH22 ARG 32 2HH2 ARG 32 1.888 -9.389 -5.611
233 H ILE 33 H ILE 33 7.462 -3.622 -3.329
234 HA ILE 33 HA ILE 33 8.454 -6.343 -2.850
235 HB ILE 33 HB ILE 33 8.876 -5.026 -5.517
236 HG12 ILE 33 1HG1 ILE 33 7.062 -6.903 -6.129
237 HG13 ILE 33 2HG1 ILE 33 6.484 -6.478 -4.509
238 HG21 ILE 33 1HG2 ILE 33 9.927 -7.289 -4.285
239 HG22 ILE 33 2HG2 ILE 33 8.747 -7.909 -5.439
240 HG23 ILE 33 3HG2 ILE 33 10.049 -6.856 -5.989
241 HD11 ILE 33 3HD1 ILE 33 6.640 -4.764 -6.951
242 HD12 ILE 33 1HD1 ILE 33 5.268 -5.075 -5.887
243 HD13 ILE 33 2HD1 ILE 33 6.592 -4.046 -5.342
244 H ASN 34 H ASN 34 8.956 -3.367 -2.061
245 HA ASN 34 HA ASN 34 11.854 -3.377 -2.588
246 HB2 ASN 34 1HB ASN 34 9.827 -1.235 -2.502
247 HB3 ASN 34 2HB ASN 34 11.333 -0.862 -1.655
248 HD21 ASN 34 1HD2 ASN 34 10.129 -2.115 -4.735
249 HD22 ASN 34 2HD2 ASN 34 11.375 -1.416 -5.705
250 H ARG 35 H ARG 35 9.386 -3.390 -0.162
251 HA ARG 35 HA ARG 35 10.832 -2.518 2.065
252 HE ARG 35 HE ARG 35 5.974 -4.256 1.130
253 HB2 ARG 35 1HB ARG 35 9.201 -3.798 3.407
254 HB3 ARG 35 2HB ARG 35 8.426 -2.820 2.151
255 HG2 ARG 35 1HG ARG 35 8.046 -4.738 0.771
256 HG3 ARG 35 2HG ARG 35 9.008 -5.756 1.856
257 HD2 ARG 35 1HD ARG 35 7.023 -6.302 2.770
258 HD3 ARG 35 2HD ARG 35 7.178 -4.738 3.585
259 HH11 ARG 35 1HH1 ARG 35 5.283 -5.996 4.066
260 HH12 ARG 35 2HH1 ARG 35 3.567 -5.813 3.924
261 HH21 ARG 35 1HH2 ARG 35 3.715 -4.010 0.930
262 HH22 ARG 35 2HH2 ARG 35 2.675 -4.686 2.139
263 H LYS 36 H LYS 36 10.907 -5.522 0.327
264 HA LYS 36 HA LYS 36 11.947 -7.263 2.215
265 HB2 LYS 36 1HB LYS 36 12.512 -7.056 -0.750
266 HB3 LYS 36 2HB LYS 36 13.024 -8.417 0.259
267 HG2 LYS 36 1HG LYS 36 11.036 -9.387 0.098
268 HG3 LYS 36 2HG LYS 36 10.217 -7.904 0.620
269 HD2 LYS 36 1HD LYS 36 9.977 -7.102 -1.560
270 HD3 LYS 36 2HD LYS 36 11.247 -8.170 -2.183
271 HE2 LYS 36 1HE LYS 36 8.789 -9.387 -0.984
272 HE3 LYS 36 2HE LYS 36 8.711 -8.701 -2.614
273 HZ1 LYS 36 3HZ LYS 36 9.239 -11.016 -2.762
274 HZ2 LYS 36 1HZ LYS 36 10.539 -10.851 -1.690
275 HZ3 LYS 36 2HZ LYS 36 10.608 -10.132 -3.220
276 H LYS 37 H LYS 37 13.486 -4.642 0.513
277 HA LYS 37 HA LYS 37 16.043 -5.327 1.809
278 HB2 LYS 37 1HB LYS 37 15.977 -5.261 -0.722
279 HB3 LYS 37 2HB LYS 37 15.689 -3.517 -0.581
280 HG2 LYS 37 1HG LYS 37 18.015 -3.848 -0.994
281 HG3 LYS 37 2HG LYS 37 17.822 -3.334 0.692
282 HD2 LYS 37 1HD LYS 37 18.750 -5.211 1.467
283 HD3 LYS 37 2HD LYS 37 17.691 -6.214 0.457
284 HE2 LYS 37 1HE LYS 37 19.805 -4.820 -1.038
285 HE3 LYS 37 2HE LYS 37 20.396 -5.985 0.156
286 HZ1 LYS 37 3HZ LYS 37 18.453 -7.393 -1.010
287 HZ2 LYS 37 1HZ LYS 37 20.069 -7.433 -1.509
288 HZ3 LYS 37 2HZ LYS 37 18.958 -6.445 -2.317
289 H LYS 38 H LYS 38 14.357 -4.158 3.480
290 HA LYS 38 HA LYS 38 14.086 -1.401 3.503
291 HB2 LYS 38 1HB LYS 38 13.011 -2.971 5.101
292 HB3 LYS 38 2HB LYS 38 14.575 -3.169 5.907
293 HG2 LYS 38 1HG LYS 38 14.594 -0.938 6.673
294 HG3 LYS 38 2HG LYS 38 13.256 -0.490 5.601
295 HD2 LYS 38 1HD LYS 38 11.688 -1.772 6.869
296 HD3 LYS 38 2HD LYS 38 12.987 -2.516 7.816
297 HE2 LYS 38 1HE LYS 38 13.505 -0.437 8.897
298 HE3 LYS 38 2HE LYS 38 12.413 0.443 7.816
299 HZ1 LYS 38 3HZ LYS 38 11.636 -0.207 10.184
300 HZ2 LYS 38 1HZ LYS 38 11.338 -1.721 9.491
301 HZ3 LYS 38 2HZ LYS 38 10.559 -0.346 8.887
302 H HIS 39 H HIS 39 16.865 -3.378 4.278
303 HA HIS 39 HA HIS 39 19.030 -2.877 4.768
304 HD1 HIS 39 1HD HIS 39 20.715 0.926 4.272
305 HD2 HIS 39 2HD HIS 39 21.197 -2.899 2.723
306 HE1 HIS 39 1HE HIS 39 23.197 0.611 4.019
307 HE2 HIS 39 2HE HIS 39 23.491 -1.728 3.071
308 HB2 HIS 39 1HB HIS 39 18.597 -1.546 2.603
309 HB3 HIS 39 2HB HIS 39 18.538 -0.125 3.649
Start of MODEL 14
1 H1 GLY 1 H GLY 1 -22.354 -3.978 2.526
2 HA2 GLY 1 2HA GLY 1 -21.789 -2.394 4.366
3 HA3 GLY 1 3HA GLY 1 -20.619 -3.597 4.888
4 H THR 2 H THR 2 -20.965 -0.751 3.274
5 HA THR 2 HA THR 2 -19.255 -0.977 1.068
6 HB THR 2 HB THR 2 -18.833 1.526 1.503
7 HG1 THR 2 1HG THR 2 -19.497 1.232 3.807
8 HG21 THR 2 3HG2 THR 2 -20.406 0.987 -0.150
9 HG22 THR 2 1HG2 THR 2 -21.285 2.049 0.948
10 HG23 THR 2 2HG2 THR 2 -21.536 0.306 1.020
11 H TRP 3 H TRP 3 -18.577 -1.069 4.412
12 HA TRP 3 HA TRP 3 -16.069 0.042 4.646
13 HD1 TRP 3 HD TRP 3 -19.441 -1.987 6.551
14 HE1 TRP 3 1HE TRP 3 -20.533 -0.217 8.066
15 HE3 TRP 3 3HE TRP 3 -15.394 1.046 7.307
16 HZ2 TRP 3 2HZ TRP 3 -19.781 2.153 9.404
17 HZ3 TRP 3 3HZ TRP 3 -15.667 3.045 8.717
18 HH2 TRP 3 HH TRP 3 -17.814 3.585 9.742
19 HB2 TRP 3 1HB TRP 3 -16.943 -2.563 5.923
20 HB3 TRP 3 2HB TRP 3 -15.700 -1.462 6.514
21 H ASP 4 H ASP 4 -17.010 -2.905 3.055
22 HA ASP 4 HA ASP 4 -14.507 -4.176 2.919
23 HD2 ASP 4 HD ASP 4 -15.457 -7.490 3.225
24 HB2 ASP 4 1HB ASP 4 -17.111 -4.647 1.950
25 HB3 ASP 4 2HB ASP 4 -16.056 -4.635 0.529
26 H ASP 5 H ASP 5 -16.111 -1.988 0.620
27 HA ASP 5 HA ASP 5 -13.821 -1.906 -1.116
28 HD2 ASP 5 HD ASP 5 -14.034 -1.085 -4.416
29 HB2 ASP 5 1HB ASP 5 -16.549 -1.246 -1.325
30 HB3 ASP 5 2HB ASP 5 -15.667 0.270 -1.545
31 H ILE 6 H ILE 6 -15.340 0.316 1.194
32 HA ILE 6 HA ILE 6 -13.612 2.489 0.798
33 HB ILE 6 HB ILE 6 -15.012 1.724 3.362
34 HG12 ILE 6 1HG1 ILE 6 -15.972 3.572 1.166
35 HG13 ILE 6 2HG1 ILE 6 -16.487 1.885 1.324
36 HG21 ILE 6 1HG2 ILE 6 -13.257 3.430 3.612
37 HG22 ILE 6 2HG2 ILE 6 -14.057 4.412 2.386
38 HG23 ILE 6 3HG2 ILE 6 -14.869 4.078 3.916
39 HD11 ILE 6 3HD1 ILE 6 -18.076 3.574 2.261
40 HD12 ILE 6 1HD1 ILE 6 -17.576 2.306 3.383
41 HD13 ILE 6 2HD1 ILE 6 -16.869 3.919 3.500
42 H GLY 7 H GLY 7 -13.242 -0.464 2.610
43 HA2 GLY 7 2HA GLY 7 -10.985 0.470 4.142
44 HA3 GLY 7 3HA GLY 7 -11.577 -1.182 4.055
45 H GLN 8 H GLN 8 -11.466 -1.297 1.148
46 HA GLN 8 HA GLN 8 -8.784 -2.193 0.878
47 HB2 GLN 8 1HB GLN 8 -11.189 -2.589 -0.472
48 HB3 GLN 8 2HB GLN 8 -10.150 -1.773 -1.652
49 HG2 GLN 8 1HG GLN 8 -9.269 -3.750 -2.121
50 HG3 GLN 8 2HG GLN 8 -8.511 -3.698 -0.523
51 HE21 GLN 8 1HE2 GLN 8 -11.157 -4.953 -2.395
52 HE22 GLN 8 2HE2 GLN 8 -11.643 -6.169 -1.269
53 H GLY 9 H GLY 9 -10.406 0.796 0.183
54 HA2 GLY 9 2HA GLY 9 -8.280 1.775 -1.537
55 HA3 GLY 9 3HA GLY 9 -9.712 2.661 -1.035
56 H ILE 10 H ILE 10 -9.662 2.825 1.582
57 HA ILE 10 HA ILE 10 -7.808 4.778 2.192
58 HB ILE 10 HB ILE 10 -9.883 4.327 3.487
59 HG12 ILE 10 1HG1 ILE 10 -7.599 4.246 5.431
60 HG13 ILE 10 2HG1 ILE 10 -7.735 5.606 4.304
61 HG21 ILE 10 1HG2 ILE 10 -9.357 1.819 3.604
62 HG22 ILE 10 2HG2 ILE 10 -8.344 2.234 4.985
63 HG23 ILE 10 3HG2 ILE 10 -10.073 2.581 5.026
64 HD11 ILE 10 3HD1 ILE 10 -10.145 5.820 5.169
65 HD12 ILE 10 1HD1 ILE 10 -9.590 4.819 6.508
66 HD13 ILE 10 2HD1 ILE 10 -8.824 6.375 6.195
67 H GLY 11 H GLY 11 -7.504 1.309 2.402
68 HA2 GLY 11 2HA GLY 11 -5.279 1.174 4.131
69 HA3 GLY 11 3HA GLY 11 -5.743 -0.053 2.960
70 H ARG 12 H ARG 12 -5.420 1.132 0.570
71 HA ARG 12 HA ARG 12 -2.561 1.230 0.336
72 HE ARG 12 HE ARG 12 -2.632 -1.188 0.601
73 HB2 ARG 12 1HB ARG 12 -4.776 1.549 -1.699
74 HB3 ARG 12 2HB ARG 12 -3.053 1.533 -2.105
75 HG2 ARG 12 1HG ARG 12 -4.383 -0.739 -0.644
76 HG3 ARG 12 2HG ARG 12 -4.314 -0.639 -2.411
77 HD2 ARG 12 1HD ARG 12 -2.370 -1.757 -2.188
78 HD3 ARG 12 2HD ARG 12 -1.722 -0.165 -1.769
79 HH11 ARG 12 1HH1 ARG 12 -0.383 -2.218 -1.850
80 HH12 ARG 12 2HH1 ARG 12 0.620 -3.097 -0.744
81 HH21 ARG 12 1HH2 ARG 12 -1.319 -2.342 2.066
82 HH22 ARG 12 2HH2 ARG 12 0.086 -3.168 1.482
83 H VAL 13 H VAL 13 -5.191 3.535 0.265
84 HA VAL 13 HA VAL 13 -3.711 5.710 -0.811
85 HB VAL 13 HB VAL 13 -6.202 5.750 0.897
86 HG11 VAL 13 1HG1 VAL 13 -6.551 7.997 -0.005
87 HG12 VAL 13 2HG1 VAL 13 -5.044 7.901 0.910
88 HG13 VAL 13 3HG1 VAL 13 -5.007 7.898 -0.854
89 HG21 VAL 13 3HG2 VAL 13 -7.336 5.102 -0.902
90 HG22 VAL 13 1HG2 VAL 13 -6.616 6.396 -1.862
91 HG23 VAL 13 2HG2 VAL 13 -5.803 4.835 -1.735
92 H ALA 14 H ALA 14 -4.417 4.613 2.472
93 HA ALA 14 HA ALA 14 -3.484 6.772 3.931
94 HB1 ALA 14 1HB ALA 14 -3.268 3.840 4.604
95 HB2 ALA 14 2HB ALA 14 -3.067 5.168 5.749
96 HB3 ALA 14 3HB ALA 14 -4.627 4.905 4.970
97 H TYR 15 H TYR 15 -1.695 4.267 2.265
98 HA TYR 15 HA TYR 15 0.826 4.849 3.476
99 HD1 TYR 15 2HD TYR 15 2.658 2.889 3.622
100 HD2 TYR 15 1HD TYR 15 2.024 3.664 -0.513
101 HE1 TYR 15 2HE TYR 15 5.064 2.608 3.207
102 HE2 TYR 15 1HE TYR 15 4.430 3.382 -0.941
103 HH TYR 15 HH TYR 15 6.730 3.490 1.356
104 HB2 TYR 15 1HB TYR 15 0.352 2.658 2.485
105 HB3 TYR 15 2HB TYR 15 0.179 3.407 0.895
106 H TRP 16 H TRP 16 -0.944 6.076 0.742
107 HA TRP 16 HA TRP 16 1.305 7.414 -0.446
108 HD1 TRP 16 HD TRP 16 -1.261 4.899 -2.060
109 HE1 TRP 16 1HE TRP 16 -0.072 4.111 -4.203
110 HE3 TRP 16 3HE TRP 16 1.340 9.162 -3.158
111 HZ2 TRP 16 2HZ TRP 16 1.731 5.158 -6.105
112 HZ3 TRP 16 3HZ TRP 16 2.775 9.186 -5.157
113 HH2 TRP 16 HH TRP 16 2.964 7.225 -6.598
114 HB2 TRP 16 1HB TRP 16 -1.638 7.287 -0.962
115 HB3 TRP 16 2HB TRP 16 -0.724 8.634 -1.644
116 H VAL 17 H VAL 17 -1.482 8.381 1.522
117 HA VAL 17 HA VAL 17 -0.869 11.146 1.556
118 HB VAL 17 HB VAL 17 -3.106 10.312 2.103
119 HG11 VAL 17 1HG1 VAL 17 -2.294 8.284 3.327
120 HG12 VAL 17 2HG1 VAL 17 -1.945 9.332 4.704
121 HG13 VAL 17 3HG1 VAL 17 -3.603 9.153 4.127
122 HG21 VAL 17 3HG2 VAL 17 -1.660 12.302 3.491
123 HG22 VAL 17 1HG2 VAL 17 -3.398 12.216 3.206
124 HG23 VAL 17 2HG2 VAL 17 -2.707 11.508 4.666
125 H GLY 18 H GLY 18 0.076 8.434 3.585
126 HA2 GLY 18 2HA GLY 18 1.191 9.955 5.703
127 HA3 GLY 18 3HA GLY 18 1.546 8.273 5.343
128 H LYS 19 H LYS 19 2.607 8.552 2.773
129 HA LYS 19 HA LYS 19 5.269 9.359 3.412
130 HB2 LYS 19 1HB LYS 19 5.822 8.686 1.135
131 HB3 LYS 19 2HB LYS 19 4.803 7.465 1.917
132 HG2 LYS 19 1HG LYS 19 2.859 8.225 0.710
133 HG3 LYS 19 2HG LYS 19 3.788 9.562 0.009
134 HD2 LYS 19 1HD LYS 19 4.461 6.644 -0.406
135 HD3 LYS 19 2HD LYS 19 3.469 7.604 -1.518
136 HE2 LYS 19 1HE LYS 19 5.710 9.190 -1.136
137 HE3 LYS 19 2HE LYS 19 6.359 7.546 -1.178
138 HZ1 LYS 19 3HZ LYS 19 4.425 7.941 -3.227
139 HZ2 LYS 19 1HZ LYS 19 6.034 7.436 -3.355
140 HZ3 LYS 19 2HZ LYS 19 5.665 9.086 -3.339
141 H ALA 20 H ALA 20 2.601 10.779 1.647
142 HA ALA 20 HA ALA 20 4.080 12.840 0.373
143 HB1 ALA 20 1HB ALA 20 1.156 12.539 1.015
144 HB2 ALA 20 2HB ALA 20 1.812 13.924 0.140
145 HB3 ALA 20 3HB ALA 20 1.962 12.303 -0.537
146 H LEU 21 H LEU 21 2.781 12.448 3.564
147 HA LEU 21 HA LEU 21 2.921 15.253 4.229
148 HG LEU 21 HG LEU 21 0.600 14.726 4.632
149 HB2 LEU 21 1HB LEU 21 2.116 12.745 5.592
150 HB3 LEU 21 2HB LEU 21 2.703 14.063 6.619
151 HD11 LEU 21 1HD1 LEU 21 0.097 12.475 5.879
152 HD12 LEU 21 2HD1 LEU 21 -1.150 13.709 5.705
153 HD13 LEU 21 3HD1 LEU 21 -0.272 13.552 7.225
154 HD21 LEU 21 3HD2 LEU 21 -0.185 16.045 6.645
155 HD22 LEU 21 1HD2 LEU 21 1.374 16.512 5.966
156 HD23 LEU 21 2HD2 LEU 21 1.309 15.542 7.438
157 H GLY 22 H GLY 22 4.968 12.448 4.454
158 HA2 GLY 22 2HA GLY 22 7.312 12.560 4.692
159 HA3 GLY 22 3HA GLY 22 7.140 14.160 5.400
160 H ASN 23 H ASN 23 6.146 10.806 6.106
161 HA ASN 23 HA ASN 23 7.242 11.119 8.801
162 HB2 ASN 23 1HB ASN 23 4.440 10.124 8.211
163 HB3 ASN 23 2HB ASN 23 5.221 10.099 9.797
164 HD21 ASN 23 1HD2 ASN 23 4.198 12.265 7.211
165 HD22 ASN 23 2HD2 ASN 23 3.885 13.625 8.232
166 H LEU 24 H LEU 24 8.264 9.714 6.558
167 HA LEU 24 HA LEU 24 8.842 7.223 7.729
168 HG LEU 24 HG LEU 24 6.974 8.090 4.705
169 HB2 LEU 24 1HB LEU 24 7.812 5.793 5.910
170 HB3 LEU 24 2HB LEU 24 6.709 6.453 7.131
171 HD11 LEU 24 1HD1 LEU 24 6.958 6.229 3.385
172 HD12 LEU 24 2HD1 LEU 24 5.225 6.420 3.657
173 HD13 LEU 24 3HD1 LEU 24 6.141 5.240 4.596
174 HD21 LEU 24 3HD2 LEU 24 4.355 7.648 5.060
175 HD22 LEU 24 1HD2 LEU 24 5.260 8.866 5.958
176 HD23 LEU 24 2HD2 LEU 24 4.936 7.293 6.689
177 H SER 25 H SER 25 10.873 8.259 7.202
178 HA SER 25 HA SER 25 11.610 8.521 4.421
179 HG SER 25 HG SER 25 12.625 10.308 4.445
180 HB2 SER 25 1HB SER 25 12.795 9.209 7.040
181 HB3 SER 25 2HB SER 25 13.960 8.746 5.788
182 H ASP 26 H ASP 26 12.124 6.252 7.047
183 HA ASP 26 HA ASP 26 14.133 4.707 5.764
184 HD2 ASP 26 HD ASP 26 15.077 1.441 8.154
185 HB2 ASP 26 1HB ASP 26 13.211 4.802 8.289
186 HB3 ASP 26 2HB ASP 26 12.317 3.391 7.709
187 H VAL 27 H VAL 27 10.636 4.673 5.717
188 HA VAL 27 HA VAL 27 10.513 2.154 4.288
189 HB VAL 27 HB VAL 27 8.272 4.108 4.812
190 HG11 VAL 27 1HG1 VAL 27 8.420 1.298 3.805
191 HG12 VAL 27 2HG1 VAL 27 6.991 1.849 4.681
192 HG13 VAL 27 3HG1 VAL 27 7.480 2.660 3.193
193 HG21 VAL 27 3HG2 VAL 27 9.312 1.827 6.482
194 HG22 VAL 27 1HG2 VAL 27 9.154 3.522 6.939
195 HG23 VAL 27 2HG2 VAL 27 7.713 2.539 6.697
196 H ASN 28 H ASN 28 10.689 5.514 3.562
197 HA ASN 28 HA ASN 28 9.430 5.589 1.062
198 HB2 ASN 28 1HB ASN 28 9.976 7.660 2.081
199 HB3 ASN 28 2HB ASN 28 11.678 7.213 2.249
200 HD21 ASN 28 1HD2 ASN 28 9.410 8.800 0.352
201 HD22 ASN 28 2HD2 ASN 28 10.393 9.078 -1.042
202 H GLN 29 H GLN 29 12.852 5.043 1.877
203 HA GLN 29 HA GLN 29 13.675 4.607 -0.803
204 HB2 GLN 29 1HB GLN 29 14.942 4.955 1.624
205 HB3 GLN 29 2HB GLN 29 15.282 3.260 1.236
206 HG2 GLN 29 1HG GLN 29 16.076 4.034 -1.025
207 HG3 GLN 29 2HG GLN 29 15.956 5.686 -0.403
208 HE21 GLN 29 1HE2 GLN 29 17.359 6.359 1.241
209 HE22 GLN 29 2HE2 GLN 29 18.830 5.519 1.578
210 H ALA 30 H ALA 30 12.383 2.540 1.695
211 HA ALA 30 HA ALA 30 13.129 0.046 0.632
212 HB1 ALA 30 1HB ALA 30 12.197 0.514 2.933
213 HB2 ALA 30 2HB ALA 30 10.604 0.572 2.179
214 HB3 ALA 30 3HB ALA 30 11.557 -0.912 2.115
215 H SER 31 H SER 31 10.623 2.292 -0.231
216 HA SER 31 HA SER 31 8.825 0.628 -1.549
217 HG SER 31 HG SER 31 9.925 4.300 -2.509
218 HB2 SER 31 1HB SER 31 7.876 2.546 -2.406
219 HB3 SER 31 2HB SER 31 8.828 3.237 -1.080
220 H ARG 32 H ARG 32 12.017 1.582 -2.427
221 HA ARG 32 HA ARG 32 11.819 1.161 -5.229
222 HE ARG 32 HE ARG 32 15.676 0.211 -6.848
223 HB2 ARG 32 1HB ARG 32 13.702 2.242 -3.599
224 HB3 ARG 32 2HB ARG 32 14.428 0.664 -3.942
225 HG2 ARG 32 1HG ARG 32 13.863 1.262 -6.429
226 HG3 ARG 32 2HG ARG 32 13.841 2.918 -5.796
227 HD2 ARG 32 1HD ARG 32 16.060 2.926 -6.096
228 HD3 ARG 32 2HD ARG 32 16.130 1.858 -4.690
229 HH11 ARG 32 1HH1 ARG 32 18.120 2.490 -5.871
230 HH12 ARG 32 2HH1 ARG 32 19.402 1.671 -6.703
231 HH21 ARG 32 1HH2 ARG 32 17.354 -0.875 -7.949
232 HH22 ARG 32 2HH2 ARG 32 18.965 -0.241 -7.885
233 H ILE 33 H ILE 33 11.885 -0.958 -2.576
234 HA ILE 33 HA ILE 33 12.224 -3.235 -4.394
235 HB ILE 33 HB ILE 33 13.387 -3.320 -1.627
236 HG12 ILE 33 1HG1 ILE 33 15.600 -3.123 -3.131
237 HG13 ILE 33 2HG1 ILE 33 14.516 -2.099 -4.090
238 HG21 ILE 33 1HG2 ILE 33 13.110 -5.140 -3.845
239 HG22 ILE 33 2HG2 ILE 33 14.804 -4.944 -3.396
240 HG23 ILE 33 3HG2 ILE 33 13.624 -5.459 -2.189
241 HD11 ILE 33 3HD1 ILE 33 15.922 -0.921 -2.360
242 HD12 ILE 33 1HD1 ILE 33 14.191 -0.589 -2.319
243 HD13 ILE 33 2HD1 ILE 33 14.906 -1.693 -1.143
244 H ASN 34 H ASN 34 10.092 -1.720 -2.667
245 HA ASN 34 HA ASN 34 8.977 -4.123 -1.379
246 HB2 ASN 34 1HB ASN 34 9.055 -1.277 -0.611
247 HB3 ASN 34 2HB ASN 34 7.484 -2.057 -0.390
248 HD21 ASN 34 1HD2 ASN 34 10.920 -2.476 0.320
249 HD22 ASN 34 2HD2 ASN 34 10.689 -3.286 1.828
250 H ARG 35 H ARG 35 8.477 -1.653 -3.748
251 HA ARG 35 HA ARG 35 5.691 -1.857 -4.072
252 HE ARG 35 HE ARG 35 5.684 1.628 -3.959
253 HB2 ARG 35 1HB ARG 35 7.681 -0.323 -5.172
254 HB3 ARG 35 2HB ARG 35 7.223 -1.364 -6.528
255 HG2 ARG 35 1HG ARG 35 5.213 -0.382 -6.797
256 HG3 ARG 35 2HG ARG 35 4.985 -0.149 -5.055
257 HD2 ARG 35 1HD ARG 35 7.139 1.454 -6.302
258 HD3 ARG 35 2HD ARG 35 5.483 1.859 -6.777
259 HH11 ARG 35 1HH1 ARG 35 6.494 3.732 -6.613
260 HH12 ARG 35 2HH1 ARG 35 6.461 5.172 -5.652
261 HH21 ARG 35 1HH2 ARG 35 5.637 3.519 -2.684
262 HH22 ARG 35 2HH2 ARG 35 5.975 5.049 -3.417
263 H LYS 36 H LYS 36 8.310 -3.881 -5.108
264 HA LYS 36 HA LYS 36 8.406 -5.699 -6.516
265 HB2 LYS 36 1HB LYS 36 6.879 -7.480 -5.842
266 HB3 LYS 36 2HB LYS 36 7.495 -6.609 -4.428
267 HG2 LYS 36 1HG LYS 36 5.445 -5.479 -4.091
268 HG3 LYS 36 2HG LYS 36 4.833 -5.992 -5.673
269 HD2 LYS 36 1HD LYS 36 5.442 -8.389 -4.454
270 HD3 LYS 36 2HD LYS 36 4.820 -7.403 -3.119
271 HE2 LYS 36 1HE LYS 36 3.051 -6.859 -5.178
272 HE3 LYS 36 2HE LYS 36 3.412 -8.580 -5.381
273 HZ1 LYS 36 3HZ LYS 36 1.778 -7.334 -3.443
274 HZ2 LYS 36 1HZ LYS 36 3.022 -8.181 -2.669
275 HZ3 LYS 36 2HZ LYS 36 1.995 -8.983 -3.747
276 H LYS 37 H LYS 37 7.328 -3.545 -7.897
277 HA LYS 37 HA LYS 37 5.212 -4.810 -9.512
278 HB2 LYS 37 1HB LYS 37 4.548 -2.703 -8.374
279 HB3 LYS 37 2HB LYS 37 5.828 -1.861 -9.261
280 HG2 LYS 37 1HG LYS 37 4.155 -1.382 -10.686
281 HG3 LYS 37 2HG LYS 37 4.528 -2.996 -11.316
282 HD2 LYS 37 1HD LYS 37 2.794 -3.957 -9.831
283 HD3 LYS 37 2HD LYS 37 2.390 -2.315 -9.296
284 HE2 LYS 37 1HE LYS 37 2.275 -2.046 -12.019
285 HE3 LYS 37 2HE LYS 37 1.708 -3.707 -11.786
286 HZ1 LYS 37 3HZ LYS 37 0.410 -1.224 -11.128
287 HZ2 LYS 37 1HZ LYS 37 0.363 -2.360 -9.874
288 HZ3 LYS 37 2HZ LYS 37 -0.256 -2.755 -11.398
289 H LYS 38 H LYS 38 8.339 -3.285 -9.512
290 HA LYS 38 HA LYS 38 8.595 -3.912 -12.379
291 HB2 LYS 38 1HB LYS 38 9.629 -1.507 -10.871
292 HB3 LYS 38 2HB LYS 38 10.227 -1.973 -12.470
293 HG2 LYS 38 1HG LYS 38 7.845 -1.830 -13.291
294 HG3 LYS 38 2HG LYS 38 7.454 -1.082 -11.732
295 HD2 LYS 38 1HD LYS 38 7.988 0.873 -12.679
296 HD3 LYS 38 2HD LYS 38 9.673 0.332 -12.577
297 HE2 LYS 38 1HE LYS 38 9.252 1.043 -14.835
298 HE3 LYS 38 2HE LYS 38 9.418 -0.718 -14.817
299 HZ1 LYS 38 3HZ LYS 38 7.334 0.707 -15.877
300 HZ2 LYS 38 1HZ LYS 38 6.707 0.082 -14.436
301 HZ3 LYS 38 2HZ LYS 38 7.365 -0.961 -15.593
302 H HIS 39 H HIS 39 9.284 -5.938 -11.012
303 HA HIS 39 HA HIS 39 10.937 -7.363 -10.366
304 HD1 HIS 39 1HD HIS 39 15.072 -6.297 -11.627
305 HD2 HIS 39 2HD HIS 39 12.359 -9.437 -11.434
306 HE1 HIS 39 1HE HIS 39 16.463 -8.368 -11.308
307 HE2 HIS 39 2HE HIS 39 14.807 -10.286 -11.186
308 HB2 HIS 39 1HB HIS 39 11.705 -6.714 -12.672
309 HB3 HIS 39 2HB HIS 39 12.758 -5.514 -11.917
Start of MODEL 15
1 H1 GLY 1 H GLY 1 -25.848 0.049 10.583
2 HA2 GLY 1 2HA GLY 1 -24.401 -1.060 9.147
3 HA3 GLY 1 3HA GLY 1 -25.760 -1.388 8.081
4 H THR 2 H THR 2 -22.949 -0.289 7.697
5 HA THR 2 HA THR 2 -23.526 1.434 5.554
6 HB THR 2 HB THR 2 -22.087 3.352 6.888
7 HG1 THR 2 1HG THR 2 -22.569 2.138 8.871
8 HG21 THR 2 3HG2 THR 2 -24.754 4.082 7.250
9 HG22 THR 2 1HG2 THR 2 -24.767 3.000 5.859
10 HG23 THR 2 2HG2 THR 2 -23.741 4.434 5.851
11 H TRP 3 H TRP 3 -21.858 -0.846 6.325
12 HA TRP 3 HA TRP 3 -19.132 -0.021 6.404
13 HD1 TRP 3 HD TRP 3 -21.675 -3.236 7.895
14 HE1 TRP 3 1HE TRP 3 -21.056 -3.317 10.392
15 HE3 TRP 3 3HE TRP 3 -17.022 -1.134 7.646
16 HZ2 TRP 3 2HZ TRP 3 -18.885 -2.586 12.039
17 HZ3 TRP 3 3HZ TRP 3 -15.741 -0.859 9.728
18 HH2 TRP 3 HH TRP 3 -16.653 -1.569 11.878
19 HB2 TRP 3 1HB TRP 3 -20.412 -2.676 5.699
20 HB3 TRP 3 2HB TRP 3 -18.671 -2.429 5.855
21 H ASP 4 H ASP 4 -21.435 -0.556 3.874
22 HA ASP 4 HA ASP 4 -19.532 -0.859 1.758
23 HD2 ASP 4 HD ASP 4 -22.058 -3.531 -0.165
24 HB2 ASP 4 1HB ASP 4 -22.495 -0.459 1.937
25 HB3 ASP 4 2HB ASP 4 -21.686 -0.168 0.391
26 H ASP 5 H ASP 5 -21.465 1.829 3.017
27 HA ASP 5 HA ASP 5 -20.417 3.697 1.095
28 HD2 ASP 5 HD ASP 5 -23.616 3.718 -0.064
29 HB2 ASP 5 1HB ASP 5 -22.096 4.059 3.589
30 HB3 ASP 5 2HB ASP 5 -21.623 5.385 2.521
31 H ILE 6 H ILE 6 -19.934 3.039 4.544
32 HA ILE 6 HA ILE 6 -17.997 5.120 4.878
33 HB ILE 6 HB ILE 6 -18.620 2.750 6.641
34 HG12 ILE 6 1HG1 ILE 6 -19.446 5.649 6.902
35 HG13 ILE 6 2HG1 ILE 6 -20.490 4.365 6.269
36 HG21 ILE 6 1HG2 ILE 6 -16.892 5.170 7.076
37 HG22 ILE 6 2HG2 ILE 6 -17.519 4.192 8.402
38 HG23 ILE 6 3HG2 ILE 6 -16.442 3.470 7.206
39 HD11 ILE 6 3HD1 ILE 6 -21.209 4.372 8.414
40 HD12 ILE 6 1HD1 ILE 6 -19.876 3.233 8.581
41 HD13 ILE 6 2HD1 ILE 6 -19.658 4.918 9.053
42 H GLY 7 H GLY 7 -17.772 1.559 4.820
43 HA2 GLY 7 2HA GLY 7 -15.017 1.322 5.017
44 HA3 GLY 7 3HA GLY 7 -16.056 0.171 4.189
45 H GLN 8 H GLN 8 -16.934 2.315 2.292
46 HA GLN 8 HA GLN 8 -15.005 1.809 0.275
47 HB2 GLN 8 1HB GLN 8 -17.597 3.165 0.494
48 HB3 GLN 8 2HB GLN 8 -16.505 3.905 -0.687
49 HG2 GLN 8 1HG GLN 8 -16.208 1.678 -1.748
50 HG3 GLN 8 2HG GLN 8 -17.424 1.041 -0.633
51 HE21 GLN 8 1HE2 GLN 8 -17.744 0.882 -3.359
52 HE22 GLN 8 2HE2 GLN 8 -19.052 1.903 -3.844
53 H GLY 9 H GLY 9 -15.472 4.383 2.563
54 HA2 GLY 9 2HA GLY 9 -13.643 6.168 1.170
55 HA3 GLY 9 3HA GLY 9 -14.487 6.505 2.674
56 H ILE 10 H ILE 10 -13.756 4.684 4.412
57 HA ILE 10 HA ILE 10 -11.181 5.404 5.196
58 HB ILE 10 HB ILE 10 -12.895 4.495 6.731
59 HG12 ILE 10 1HG1 ILE 10 -10.739 2.556 7.178
60 HG13 ILE 10 2HG1 ILE 10 -10.158 4.195 6.841
61 HG21 ILE 10 1HG2 ILE 10 -12.195 1.702 6.106
62 HG22 ILE 10 2HG2 ILE 10 -13.727 2.399 6.625
63 HG23 ILE 10 3HG2 ILE 10 -13.233 2.516 4.937
64 HD11 ILE 10 3HD1 ILE 10 -11.801 3.219 9.129
65 HD12 ILE 10 1HD1 ILE 10 -10.344 4.213 9.133
66 HD13 ILE 10 2HD1 ILE 10 -11.886 4.911 8.636
67 H GLY 11 H GLY 11 -12.256 2.911 3.044
68 HA2 GLY 11 2HA GLY 11 -9.657 1.567 3.105
69 HA3 GLY 11 3HA GLY 11 -11.089 1.018 2.244
70 H ARG 12 H ARG 12 -9.971 4.316 2.023
71 HA ARG 12 HA ARG 12 -8.549 3.852 -0.456
72 HE ARG 12 HE ARG 12 -9.843 1.281 -1.689
73 HB2 ARG 12 1HB ARG 12 -11.246 5.179 -0.338
74 HB3 ARG 12 2HB ARG 12 -10.074 5.613 -1.592
75 HG2 ARG 12 1HG ARG 12 -11.151 2.835 -1.093
76 HG3 ARG 12 2HG ARG 12 -11.683 3.942 -2.371
77 HD2 ARG 12 1HD ARG 12 -9.991 3.339 -3.698
78 HD3 ARG 12 2HD ARG 12 -8.821 3.674 -2.416
79 HH11 ARG 12 1HH1 ARG 12 -8.478 2.496 -4.652
80 HH12 ARG 12 2HH1 ARG 12 -7.856 0.957 -5.149
81 HH21 ARG 12 1HH2 ARG 12 -9.029 -0.751 -2.333
82 HH22 ARG 12 2HH2 ARG 12 -8.171 -0.889 -3.829
83 H VAL 13 H VAL 13 -9.955 6.196 1.790
84 HA VAL 13 HA VAL 13 -8.155 8.302 1.018
85 HB VAL 13 HB VAL 13 -9.960 8.083 3.432
86 HG11 VAL 13 1HG1 VAL 13 -9.476 10.765 2.712
87 HG12 VAL 13 2HG1 VAL 13 -8.975 9.927 4.182
88 HG13 VAL 13 3HG1 VAL 13 -7.908 9.961 2.778
89 HG21 VAL 13 3HG2 VAL 13 -11.544 9.381 2.215
90 HG22 VAL 13 1HG2 VAL 13 -10.406 9.639 0.892
91 HG23 VAL 13 2HG2 VAL 13 -11.071 8.031 1.180
92 H ALA 14 H ALA 14 -8.294 5.868 3.543
93 HA ALA 14 HA ALA 14 -6.406 6.827 5.322
94 HB1 ALA 14 1HB ALA 14 -7.863 4.731 5.479
95 HB2 ALA 14 2HB ALA 14 -6.567 3.918 4.599
96 HB3 ALA 14 3HB ALA 14 -6.242 4.653 6.170
97 H TYR 15 H TYR 15 -5.950 5.286 2.207
98 HA TYR 15 HA TYR 15 -3.147 4.849 2.497
99 HD1 TYR 15 1HD TYR 15 -1.738 3.365 1.242
100 HD2 TYR 15 2HD TYR 15 -3.755 5.318 -1.955
101 HE1 TYR 15 1HE TYR 15 0.257 3.096 -0.172
102 HE2 TYR 15 2HE TYR 15 -1.767 5.054 -3.379
103 HH TYR 15 HH TYR 15 0.831 3.023 -2.550
104 HB2 TYR 15 1HB TYR 15 -4.458 3.535 0.920
105 HB3 TYR 15 2HB TYR 15 -4.882 4.995 0.023
106 H TRP 16 H TRP 16 -5.126 7.514 1.455
107 HA TRP 16 HA TRP 16 -2.980 8.964 0.207
108 HD1 TRP 16 HD TRP 16 -6.627 8.017 -1.145
109 HE1 TRP 16 1HE TRP 16 -6.368 8.191 -3.699
110 HE3 TRP 16 3HE TRP 16 -3.070 11.684 -1.352
111 HZ2 TRP 16 2HZ TRP 16 -4.855 9.684 -5.557
112 HZ3 TRP 16 3HZ TRP 16 -2.271 12.427 -3.557
113 HH2 TRP 16 HH TRP 16 -3.145 11.446 -5.615
114 HB2 TRP 16 1HB TRP 16 -5.847 9.530 0.876
115 HB3 TRP 16 2HB TRP 16 -4.774 10.878 0.494
116 H VAL 17 H VAL 17 -4.716 9.151 3.294
117 HA VAL 17 HA VAL 17 -3.312 11.403 4.283
118 HB VAL 17 HB VAL 17 -5.466 10.715 5.221
119 HG11 VAL 17 1HG1 VAL 17 -5.722 8.764 6.581
120 HG12 VAL 17 2HG1 VAL 17 -5.038 8.262 5.033
121 HG13 VAL 17 3HG1 VAL 17 -4.004 8.389 6.458
122 HG21 VAL 17 3HG2 VAL 17 -4.036 10.359 7.675
123 HG22 VAL 17 1HG2 VAL 17 -3.180 11.518 6.657
124 HG23 VAL 17 2HG2 VAL 17 -4.873 11.791 7.073
125 H GLY 18 H GLY 18 -2.728 7.939 4.418
126 HA2 GLY 18 2HA GLY 18 -0.688 8.003 6.384
127 HA3 GLY 18 3HA GLY 18 -0.961 6.712 5.224
128 H LYS 19 H LYS 19 -0.585 8.121 2.843
129 HA LYS 19 HA LYS 19 2.267 8.137 2.710
130 HB2 LYS 19 1HB LYS 19 1.968 8.655 0.346
131 HB3 LYS 19 2HB LYS 19 0.879 7.350 0.842
132 HG2 LYS 19 1HG LYS 19 -1.000 8.859 0.917
133 HG3 LYS 19 2HG LYS 19 0.064 10.236 0.576
134 HD2 LYS 19 1HD LYS 19 -1.122 9.546 -1.443
135 HD3 LYS 19 2HD LYS 19 0.620 9.266 -1.607
136 HE2 LYS 19 1HE LYS 19 -0.575 6.927 -0.470
137 HE3 LYS 19 2HE LYS 19 -1.496 7.405 -1.903
138 HZ1 LYS 19 3HZ LYS 19 0.086 6.510 -3.139
139 HZ2 LYS 19 1HZ LYS 19 1.020 6.151 -1.774
140 HZ3 LYS 19 2HZ LYS 19 1.195 7.644 -2.552
141 H ALA 20 H ALA 20 -0.224 10.592 2.890
142 HA ALA 20 HA ALA 20 1.430 12.798 2.193
143 HB1 ALA 20 1HB ALA 20 -1.043 12.826 2.071
144 HB2 ALA 20 2HB ALA 20 -1.099 12.823 3.835
145 HB3 ALA 20 3HB ALA 20 -0.376 14.184 2.978
146 H LEU 21 H LEU 21 0.748 11.107 5.176
147 HA LEU 21 HA LEU 21 1.840 13.091 6.911
148 HG LEU 21 HG LEU 21 -0.668 12.027 7.413
149 HB2 LEU 21 1HB LEU 21 1.083 10.202 7.204
150 HB3 LEU 21 2HB LEU 21 1.963 11.042 8.495
151 HD11 LEU 21 1HD1 LEU 21 -0.091 10.027 9.570
152 HD12 LEU 21 2HD1 LEU 21 -1.249 9.925 8.246
153 HD13 LEU 21 3HD1 LEU 21 -1.547 11.019 9.595
154 HD21 LEU 21 3HD2 LEU 21 -0.674 13.039 9.768
155 HD22 LEU 21 1HD2 LEU 21 0.395 13.760 8.564
156 HD23 LEU 21 2HD2 LEU 21 1.051 12.671 9.787
157 H GLY 22 H GLY 22 3.151 10.464 5.052
158 HA2 GLY 22 2HA GLY 22 5.478 10.493 4.449
159 HA3 GLY 22 3HA GLY 22 5.832 11.208 6.014
160 H ASN 23 H ASN 23 3.799 8.398 5.312
161 HA ASN 23 HA ASN 23 5.514 6.821 7.095
162 HB2 ASN 23 1HB ASN 23 2.671 6.375 6.152
163 HB3 ASN 23 2HB ASN 23 3.565 5.255 7.186
164 HD21 ASN 23 1HD2 ASN 23 4.724 6.606 9.055
165 HD22 ASN 23 2HD2 ASN 23 3.627 7.587 9.960
166 H LEU 24 H LEU 24 6.822 7.035 4.861
167 HA LEU 24 HA LEU 24 7.006 4.404 3.856
168 HG LEU 24 HG LEU 24 6.761 7.297 1.592
169 HB2 LEU 24 1HB LEU 24 6.342 4.714 1.568
170 HB3 LEU 24 2HB LEU 24 4.988 5.127 2.635
171 HD11 LEU 24 1HD1 LEU 24 4.530 7.150 -0.090
172 HD12 LEU 24 2HD1 LEU 24 5.205 5.523 -0.040
173 HD13 LEU 24 3HD1 LEU 24 6.220 6.883 -0.517
174 HD21 LEU 24 3HD2 LEU 24 4.090 7.021 2.826
175 HD22 LEU 24 1HD2 LEU 24 4.259 8.250 1.572
176 HD23 LEU 24 2HD2 LEU 24 5.297 8.295 2.999
177 H SER 25 H SER 25 8.742 6.313 4.999
178 HA SER 25 HA SER 25 10.372 7.452 2.914
179 HG SER 25 HG SER 25 9.125 8.644 5.121
180 HB2 SER 25 1HB SER 25 11.518 7.186 5.633
181 HB3 SER 25 2HB SER 25 11.411 8.604 4.577
182 H ASP 26 H ASP 26 10.754 4.835 5.293
183 HA ASP 26 HA ASP 26 13.295 3.993 4.423
184 HD2 ASP 26 HD ASP 26 14.073 3.755 8.116
185 HB2 ASP 26 1HB ASP 26 11.085 2.506 5.861
186 HB3 ASP 26 2HB ASP 26 12.704 1.845 5.596
187 H VAL 27 H VAL 27 10.052 3.211 3.348
188 HA VAL 27 HA VAL 27 10.680 0.949 1.786
189 HB VAL 27 HB VAL 27 8.459 2.947 1.324
190 HG11 VAL 27 1HG1 VAL 27 7.573 0.443 0.595
191 HG12 VAL 27 2HG1 VAL 27 8.105 1.715 -0.506
192 HG13 VAL 27 3HG1 VAL 27 9.238 0.467 0.016
193 HG21 VAL 27 3HG2 VAL 27 8.633 0.525 3.102
194 HG22 VAL 27 1HG2 VAL 27 8.240 2.184 3.554
195 HG23 VAL 27 2HG2 VAL 27 7.100 1.238 2.598
196 H ASN 28 H ASN 28 11.149 4.331 1.270
197 HA ASN 28 HA ASN 28 11.259 4.338 -1.556
198 HB2 ASN 28 1HB ASN 28 11.074 6.346 0.010
199 HB3 ASN 28 2HB ASN 28 12.819 6.187 0.248
200 HD21 ASN 28 1HD2 ASN 28 14.036 7.371 -1.020
201 HD22 ASN 28 2HD2 ASN 28 13.608 7.964 -2.585
202 H GLN 29 H GLN 29 13.669 3.740 0.944
203 HA GLN 29 HA GLN 29 15.874 3.615 -0.876
204 HB2 GLN 29 1HB GLN 29 15.431 3.255 2.016
205 HB3 GLN 29 2HB GLN 29 16.731 2.266 1.334
206 HG2 GLN 29 1HG GLN 29 17.855 4.224 0.479
207 HG3 GLN 29 2HG GLN 29 16.521 5.250 1.026
208 HE21 GLN 29 1HE2 GLN 29 18.968 2.989 2.199
209 HE22 GLN 29 2HE2 GLN 29 19.191 3.748 3.735
210 H ALA 30 H ALA 30 13.542 1.357 0.371
211 HA ALA 30 HA ALA 30 14.903 -1.047 -0.162
212 HB1 ALA 30 1HB ALA 30 12.823 -2.136 0.113
213 HB2 ALA 30 2HB ALA 30 12.800 -0.750 1.204
214 HB3 ALA 30 3HB ALA 30 11.921 -0.684 -0.324
215 H SER 31 H SER 31 13.215 1.181 -2.224
216 HA SER 31 HA SER 31 12.588 -0.441 -4.393
217 HG SER 31 HG SER 31 13.540 3.263 -5.541
218 HB2 SER 31 1HB SER 31 12.194 1.503 -5.571
219 HB3 SER 31 2HB SER 31 12.180 2.135 -3.914
220 H ARG 32 H ARG 32 15.651 0.642 -3.248
221 HA ARG 32 HA ARG 32 17.113 0.391 -5.671
222 HE ARG 32 HE ARG 32 19.488 3.582 -4.530
223 HB2 ARG 32 1HB ARG 32 17.883 1.676 -3.678
224 HB3 ARG 32 2HB ARG 32 18.137 0.138 -2.838
225 HG2 ARG 32 1HG ARG 32 20.021 -0.365 -3.997
226 HG3 ARG 32 2HG ARG 32 19.462 0.461 -5.462
227 HD2 ARG 32 1HD ARG 32 20.165 2.021 -2.988
228 HD3 ARG 32 2HD ARG 32 21.417 1.488 -4.122
229 HH11 ARG 32 1HH1 ARG 32 21.615 1.299 -6.071
230 HH12 ARG 32 2HH1 ARG 32 21.750 2.215 -7.537
231 HH21 ARG 32 1HH2 ARG 32 19.656 4.797 -6.453
232 HH22 ARG 32 2HH2 ARG 32 20.635 4.206 -7.752
233 H ILE 33 H ILE 33 15.782 -1.885 -3.523
234 HA ILE 33 HA ILE 33 17.206 -4.037 -4.918
235 HB ILE 33 HB ILE 33 16.620 -4.267 -1.980
236 HG12 ILE 33 1HG1 ILE 33 19.280 -3.915 -1.967
237 HG13 ILE 33 2HG1 ILE 33 18.865 -2.860 -3.330
238 HG21 ILE 33 1HG2 ILE 33 17.427 -6.319 -2.232
239 HG22 ILE 33 2HG2 ILE 33 17.530 -6.034 -3.967
240 HG23 ILE 33 3HG2 ILE 33 18.916 -5.688 -2.934
241 HD11 ILE 33 3HD1 ILE 33 18.066 -2.611 -0.464
242 HD12 ILE 33 1HD1 ILE 33 18.822 -1.421 -1.522
243 HD13 ILE 33 2HD1 ILE 33 17.121 -1.839 -1.738
244 H ASN 34 H ASN 34 14.402 -2.695 -4.685
245 HA ASN 34 HA ASN 34 12.881 -5.186 -4.292
246 HB2 ASN 34 1HB ASN 34 12.355 -2.371 -3.587
247 HB3 ASN 34 2HB ASN 34 10.984 -3.219 -4.313
248 HD21 ASN 34 1HD2 ASN 34 13.461 -3.645 -1.818
249 HD22 ASN 34 2HD2 ASN 34 12.440 -4.479 -0.702
250 H ARG 35 H ARG 35 13.689 -2.643 -6.495
251 HA ARG 35 HA ARG 35 11.609 -2.899 -8.353
252 HE ARG 35 HE ARG 35 14.817 0.155 -8.068
253 HB2 ARG 35 1HB ARG 35 13.062 -1.798 -9.931
254 HB3 ARG 35 2HB ARG 35 13.283 -1.066 -8.335
255 HG2 ARG 35 1HG ARG 35 15.326 -2.405 -8.011
256 HG3 ARG 35 2HG ARG 35 15.115 -3.067 -9.641
257 HD2 ARG 35 1HD ARG 35 16.739 -1.229 -9.632
258 HD3 ARG 35 2HD ARG 35 15.309 -0.838 -10.597
259 HH11 ARG 35 1HH1 ARG 35 17.175 0.637 -10.583
260 HH12 ARG 35 2HH1 ARG 35 17.472 2.293 -10.167
261 HH21 ARG 35 1HH2 ARG 35 15.199 2.332 -7.510
262 HH22 ARG 35 2HH2 ARG 35 16.349 3.256 -8.418
263 H LYS 36 H LYS 36 14.378 -4.886 -7.717
264 HA LYS 36 HA LYS 36 15.117 -6.851 -8.593
265 HB2 LYS 36 1HB LYS 36 12.188 -6.859 -9.135
266 HB3 LYS 36 2HB LYS 36 13.174 -8.084 -9.949
267 HG2 LYS 36 1HG LYS 36 13.124 -7.628 -6.965
268 HG3 LYS 36 2HG LYS 36 12.191 -8.868 -7.824
269 HD2 LYS 36 1HD LYS 36 14.996 -8.943 -8.571
270 HD3 LYS 36 2HD LYS 36 14.777 -9.118 -6.821
271 HE2 LYS 36 1HE LYS 36 13.096 -10.713 -8.737
272 HE3 LYS 36 2HE LYS 36 14.732 -11.233 -8.313
273 HZ1 LYS 36 3HZ LYS 36 13.910 -12.118 -6.475
274 HZ2 LYS 36 1HZ LYS 36 12.361 -11.537 -6.831
275 HZ3 LYS 36 2HZ LYS 36 13.436 -10.587 -5.936
276 H LYS 37 H LYS 37 16.597 -5.871 -10.015
277 HA LYS 37 HA LYS 37 16.394 -6.621 -12.697
278 HB2 LYS 37 1HB LYS 37 15.033 -4.201 -12.135
279 HB3 LYS 37 2HB LYS 37 16.512 -3.769 -13.008
280 HG2 LYS 37 1HG LYS 37 14.869 -6.009 -14.078
281 HG3 LYS 37 2HG LYS 37 14.268 -4.351 -14.272
282 HD2 LYS 37 1HD LYS 37 16.589 -3.784 -15.192
283 HD3 LYS 37 2HD LYS 37 16.835 -5.537 -15.300
284 HE2 LYS 37 1HE LYS 37 14.528 -5.493 -16.557
285 HE3 LYS 37 2HE LYS 37 14.942 -3.791 -16.814
286 HZ1 LYS 37 3HZ LYS 37 16.798 -4.344 -18.061
287 HZ2 LYS 37 1HZ LYS 37 15.663 -5.496 -18.560
288 HZ3 LYS 37 2HZ LYS 37 16.876 -5.924 -17.461
289 H LYS 38 H LYS 38 17.798 -4.434 -10.337
290 HA LYS 38 HA LYS 38 20.375 -4.590 -11.749
291 HB2 LYS 38 1HB LYS 38 19.230 -2.338 -11.100
292 HB3 LYS 38 2HB LYS 38 19.832 -2.707 -9.478
293 HG2 LYS 38 1HG LYS 38 21.700 -1.665 -10.087
294 HG3 LYS 38 2HG LYS 38 22.047 -3.114 -11.048
295 HD2 LYS 38 1HD LYS 38 20.321 -0.964 -12.219
296 HD3 LYS 38 2HD LYS 38 22.080 -0.743 -12.162
297 HE2 LYS 38 1HE LYS 38 20.694 -3.146 -13.376
298 HE3 LYS 38 2HE LYS 38 21.259 -1.738 -14.288
299 HZ1 LYS 38 3HZ LYS 38 23.101 -2.986 -14.497
300 HZ2 LYS 38 1HZ LYS 38 22.781 -3.916 -13.120
301 HZ3 LYS 38 2HZ LYS 38 23.474 -2.381 -12.961
302 H HIS 39 H HIS 39 18.739 -5.208 -8.718
303 HA HIS 39 HA HIS 39 19.311 -6.431 -6.887
304 HD1 HIS 39 1HD HIS 39 18.314 -9.100 -7.611
305 HD2 HIS 39 2HD HIS 39 22.107 -9.202 -5.918
306 HE1 HIS 39 1HE HIS 39 18.233 -10.934 -5.894
307 HE2 HIS 39 2HE HIS 39 20.552 -11.000 -4.858
308 HB2 HIS 39 1HB HIS 39 20.252 -7.851 -8.998
309 HB3 HIS 39 2HB HIS 39 21.749 -7.589 -8.097
Start of MODEL 16
1 H1 GLY 1 H GLY 1 -21.771 9.993 11.591
2 HA2 GLY 1 2HA GLY 1 -21.157 7.448 10.429
3 HA3 GLY 1 3HA GLY 1 -22.304 8.625 9.811
4 H THR 2 H THR 2 -20.076 6.948 8.587
5 HA THR 2 HA THR 2 -19.312 8.770 6.590
6 HB THR 2 HB THR 2 -16.716 8.299 7.347
7 HG1 THR 2 1HG THR 2 -17.594 7.654 9.456
8 HG21 THR 2 3HG2 THR 2 -18.503 10.537 7.082
9 HG22 THR 2 1HG2 THR 2 -16.767 10.458 6.790
10 HG23 THR 2 2HG2 THR 2 -17.373 10.816 8.407
11 H TRP 3 H TRP 3 -20.292 6.040 7.004
12 HA TRP 3 HA TRP 3 -18.247 4.196 6.265
13 HD1 TRP 3 HD TRP 3 -21.929 4.319 8.604
14 HE1 TRP 3 1HE TRP 3 -21.205 3.245 10.829
15 HE3 TRP 3 3HE TRP 3 -17.924 1.613 6.936
16 HZ2 TRP 3 2HZ TRP 3 -19.201 1.485 11.755
17 HZ3 TRP 3 3HZ TRP 3 -16.656 0.262 8.556
18 HH2 TRP 3 HH TRP 3 -17.283 0.201 10.915
19 HB2 TRP 3 1HB TRP 3 -21.268 4.019 6.113
20 HB3 TRP 3 2HB TRP 3 -20.181 2.674 5.760
21 H ASP 4 H ASP 4 -20.306 6.361 4.520
22 HA ASP 4 HA ASP 4 -20.059 5.066 1.978
23 HD2 ASP 4 HD ASP 4 -21.592 7.343 -1.018
24 HB2 ASP 4 1HB ASP 4 -21.971 6.447 2.276
25 HB3 ASP 4 2HB ASP 4 -20.983 7.812 2.816
26 H ASP 5 H ASP 5 -18.465 7.805 3.561
27 HA ASP 5 HA ASP 5 -16.741 8.311 1.313
28 HD2 ASP 5 HD ASP 5 -14.847 10.903 0.754
29 HB2 ASP 5 1HB ASP 5 -17.595 9.850 3.384
30 HB3 ASP 5 2HB ASP 5 -15.987 9.392 3.957
31 H ILE 6 H ILE 6 -16.394 6.844 4.519
32 HA ILE 6 HA ILE 6 -13.612 6.260 4.175
33 HB ILE 6 HB ILE 6 -15.592 5.165 6.175
34 HG12 ILE 6 1HG1 ILE 6 -13.471 7.303 6.493
35 HG13 ILE 6 2HG1 ILE 6 -15.196 7.634 6.250
36 HG21 ILE 6 1HG2 ILE 6 -13.824 3.615 6.087
37 HG22 ILE 6 2HG2 ILE 6 -12.611 4.887 5.942
38 HG23 ILE 6 3HG2 ILE 6 -13.466 4.655 7.467
39 HD11 ILE 6 3HD1 ILE 6 -15.053 7.803 8.521
40 HD12 ILE 6 1HD1 ILE 6 -15.483 6.102 8.351
41 HD13 ILE 6 2HD1 ILE 6 -13.806 6.562 8.647
42 H GLY 7 H GLY 7 -16.615 4.589 3.549
43 HA2 GLY 7 2HA GLY 7 -15.375 2.013 3.169
44 HA3 GLY 7 3HA GLY 7 -17.045 2.432 2.816
45 H GLN 8 H GLN 8 -16.705 4.519 1.032
46 HA GLN 8 HA GLN 8 -16.049 3.062 -1.349
47 HB2 GLN 8 1HB GLN 8 -17.942 4.648 -1.236
48 HB3 GLN 8 2HB GLN 8 -16.789 5.974 -1.021
49 HG2 GLN 8 1HG GLN 8 -15.971 4.568 -3.324
50 HG3 GLN 8 2HG GLN 8 -17.723 4.776 -3.436
51 HE21 GLN 8 1HE2 GLN 8 -18.253 7.141 -2.400
52 HE22 GLN 8 2HE2 GLN 8 -17.422 8.409 -3.230
53 H GLY 9 H GLY 9 -13.747 2.815 -0.407
54 HA2 GLY 9 2HA GLY 9 -11.918 4.037 -2.046
55 HA3 GLY 9 3HA GLY 9 -11.993 5.069 -0.626
56 H ILE 10 H ILE 10 -12.563 2.731 1.120
57 HA ILE 10 HA ILE 10 -9.966 2.195 1.982
58 HB ILE 10 HB ILE 10 -11.908 1.919 3.438
59 HG12 ILE 10 1HG1 ILE 10 -10.997 -0.860 3.496
60 HG13 ILE 10 2HG1 ILE 10 -9.665 0.299 3.339
61 HG21 ILE 10 1HG2 ILE 10 -12.641 -0.727 2.393
62 HG22 ILE 10 2HG2 ILE 10 -13.656 0.566 3.030
63 HG23 ILE 10 3HG2 ILE 10 -13.082 0.635 1.364
64 HD11 ILE 10 3HD1 ILE 10 -9.932 -0.055 5.643
65 HD12 ILE 10 1HD1 ILE 10 -10.658 1.518 5.316
66 HD13 ILE 10 2HD1 ILE 10 -11.686 0.102 5.546
67 H GLY 11 H GLY 11 -11.768 0.803 -0.580
68 HA2 GLY 11 2HA GLY 11 -10.822 -1.786 -0.747
69 HA3 GLY 11 3HA GLY 11 -11.201 -0.786 -2.140
70 H ARG 12 H ARG 12 -9.089 1.173 -1.276
71 HA ARG 12 HA ARG 12 -6.605 -0.263 -1.466
72 HE ARG 12 HE ARG 12 -9.362 0.615 -5.620
73 HB2 ARG 12 1HB ARG 12 -5.895 0.666 -3.609
74 HB3 ARG 12 2HB ARG 12 -7.340 -0.338 -3.805
75 HG2 ARG 12 1HG ARG 12 -8.732 1.708 -3.825
76 HG3 ARG 12 2HG ARG 12 -7.248 2.671 -3.745
77 HD2 ARG 12 1HD ARG 12 -7.495 2.665 -6.007
78 HD3 ARG 12 2HD ARG 12 -6.617 1.138 -5.833
79 HH11 ARG 12 1HH1 ARG 12 -7.017 1.640 -7.980
80 HH12 ARG 12 2HH1 ARG 12 -7.885 0.972 -9.324
81 HH21 ARG 12 1HH2 ARG 12 -10.513 -0.270 -7.381
82 HH22 ARG 12 2HH2 ARG 12 -9.874 -0.112 -8.981
83 H VAL 13 H VAL 13 -8.299 2.823 -1.731
84 HA VAL 13 HA VAL 13 -6.226 4.603 -1.398
85 HB VAL 13 HB VAL 13 -8.933 4.868 -0.088
86 HG11 VAL 13 1HG1 VAL 13 -8.573 7.200 -0.111
87 HG12 VAL 13 2HG1 VAL 13 -7.083 6.493 0.518
88 HG13 VAL 13 3HG1 VAL 13 -7.160 7.051 -1.155
89 HG21 VAL 13 3HG2 VAL 13 -8.265 4.640 -2.850
90 HG22 VAL 13 1HG2 VAL 13 -9.842 4.918 -2.113
91 HG23 VAL 13 2HG2 VAL 13 -8.811 6.286 -2.530
92 H ALA 14 H ALA 14 -7.937 2.747 1.074
93 HA ALA 14 HA ALA 14 -6.934 3.916 3.368
94 HB1 ALA 14 1HB ALA 14 -7.089 1.438 4.246
95 HB2 ALA 14 2HB ALA 14 -8.540 2.355 3.836
96 HB3 ALA 14 3HB ALA 14 -7.887 1.181 2.693
97 H TYR 15 H TYR 15 -5.366 1.755 1.119
98 HA TYR 15 HA TYR 15 -3.133 1.186 2.836
99 HD1 TYR 15 1HD TYR 15 -1.227 -0.079 2.640
100 HD2 TYR 15 2HD TYR 15 -1.940 0.158 -1.548
101 HE1 TYR 15 1HE TYR 15 1.135 -0.622 2.213
102 HE2 TYR 15 2HE TYR 15 0.418 -0.385 -1.986
103 HH TYR 15 HH TYR 15 2.356 -1.030 -1.089
104 HB2 TYR 15 1HB TYR 15 -3.700 -0.478 1.222
105 HB3 TYR 15 2HB TYR 15 -3.654 0.694 -0.096
106 H TRP 16 H TRP 16 -3.915 3.532 0.372
107 HA TRP 16 HA TRP 16 -1.220 4.484 0.069
108 HD1 TRP 16 HD TRP 16 -4.131 3.135 -2.192
109 HE1 TRP 16 1HE TRP 16 -3.026 2.307 -4.363
110 HE3 TRP 16 3HE TRP 16 -0.307 6.514 -2.495
111 HZ2 TRP 16 2HZ TRP 16 -0.825 2.996 -5.990
112 HZ3 TRP 16 3HZ TRP 16 1.255 6.361 -4.390
113 HH2 TRP 16 HH TRP 16 1.001 4.636 -6.100
114 HB2 TRP 16 1HB TRP 16 -3.909 5.500 -0.857
115 HB3 TRP 16 2HB TRP 16 -2.422 6.406 -1.130
116 H VAL 17 H VAL 17 -4.122 5.552 1.791
117 HA VAL 17 HA VAL 17 -3.026 7.974 2.768
118 HB VAL 17 HB VAL 17 -5.445 7.573 2.698
119 HG11 VAL 17 1HG1 VAL 17 -6.552 6.078 4.193
120 HG12 VAL 17 2HG1 VAL 17 -5.290 5.162 3.365
121 HG13 VAL 17 3HG1 VAL 17 -5.044 5.703 5.026
122 HG21 VAL 17 3HG2 VAL 17 -4.652 9.285 4.191
123 HG22 VAL 17 1HG2 VAL 17 -5.980 8.425 4.971
124 HG23 VAL 17 2HG2 VAL 17 -4.315 8.093 5.447
125 H GLY 18 H GLY 18 -3.037 4.668 3.963
126 HA2 GLY 18 2HA GLY 18 -2.112 5.262 6.584
127 HA3 GLY 18 3HA GLY 18 -2.041 3.694 5.793
128 H LYS 19 H LYS 19 -0.447 4.372 3.587
129 HA LYS 19 HA LYS 19 2.137 4.262 4.795
130 HB2 LYS 19 1HB LYS 19 2.990 4.114 2.511
131 HB3 LYS 19 2HB LYS 19 1.614 3.023 2.744
132 HG2 LYS 19 1HG LYS 19 0.137 4.538 1.584
133 HG3 LYS 19 2HG LYS 19 1.434 5.740 1.455
134 HD2 LYS 19 1HD LYS 19 1.623 2.967 0.270
135 HD3 LYS 19 2HD LYS 19 1.015 4.375 -0.621
136 HE2 LYS 19 1HE LYS 19 3.402 5.273 0.484
137 HE3 LYS 19 2HE LYS 19 3.746 3.605 0.004
138 HZ1 LYS 19 3HZ LYS 19 4.151 5.342 -1.736
139 HZ2 LYS 19 1HZ LYS 19 2.475 5.562 -1.822
140 HZ3 LYS 19 2HZ LYS 19 3.152 4.063 -2.218
141 H ALA 20 H ALA 20 0.236 6.744 3.219
142 HA ALA 20 HA ALA 20 2.362 8.615 2.901
143 HB1 ALA 20 1HB ALA 20 0.398 8.790 1.518
144 HB2 ALA 20 2HB ALA 20 -0.626 9.010 2.938
145 HB3 ALA 20 3HB ALA 20 0.548 10.250 2.497
146 H LEU 21 H LEU 21 0.207 7.782 5.498
147 HA LEU 21 HA LEU 21 0.579 10.170 7.017
148 HG LEU 21 HG LEU 21 -0.619 10.321 8.964
149 HB2 LEU 21 1HB LEU 21 -1.163 8.083 7.126
150 HB3 LEU 21 2HB LEU 21 -0.075 7.701 8.471
151 HD11 LEU 21 1HD1 LEU 21 -2.535 11.024 8.090
152 HD12 LEU 21 2HD1 LEU 21 -3.366 9.541 8.555
153 HD13 LEU 21 3HD1 LEU 21 -2.489 9.618 7.026
154 HD21 LEU 21 3HD2 LEU 21 -1.650 9.538 10.851
155 HD22 LEU 21 1HD2 LEU 21 -0.813 8.076 10.329
156 HD23 LEU 21 2HD2 LEU 21 -2.530 8.278 9.983
157 H GLY 22 H GLY 22 2.307 7.171 6.680
158 HA2 GLY 22 2HA GLY 22 4.680 7.213 7.250
159 HA3 GLY 22 3HA GLY 22 4.253 8.146 8.678
160 H ASN 23 H ASN 23 2.458 5.344 7.564
161 HA ASN 23 HA ASN 23 3.170 3.987 10.066
162 HB2 ASN 23 1HB ASN 23 0.842 3.667 8.162
163 HB3 ASN 23 2HB ASN 23 1.165 2.532 9.476
164 HD21 ASN 23 1HD2 ASN 23 1.567 3.688 11.647
165 HD22 ASN 23 2HD2 ASN 23 0.414 4.908 12.055
166 H LEU 24 H LEU 24 4.864 4.057 7.645
167 HA LEU 24 HA LEU 24 5.628 1.327 7.617
168 HG LEU 24 HG LEU 24 3.944 -0.000 7.036
169 HB2 LEU 24 1HB LEU 24 3.853 2.319 5.481
170 HB3 LEU 24 2HB LEU 24 5.294 1.449 4.930
171 HD11 LEU 24 1HD1 LEU 24 2.332 0.931 4.693
172 HD12 LEU 24 2HD1 LEU 24 1.880 0.845 6.394
173 HD13 LEU 24 3HD1 LEU 24 2.021 -0.635 5.446
174 HD21 LEU 24 3HD2 LEU 24 4.016 -1.782 5.327
175 HD22 LEU 24 1HD2 LEU 24 5.578 -1.000 5.569
176 HD23 LEU 24 2HD2 LEU 24 4.602 -0.602 4.155
177 H SER 25 H SER 25 7.622 2.230 8.145
178 HA SER 25 HA SER 25 8.886 4.015 6.212
179 HG SER 25 HG SER 25 9.620 5.739 7.859
180 HB2 SER 25 1HB SER 25 9.528 3.153 9.023
181 HB3 SER 25 2HB SER 25 10.786 3.870 8.001
182 H ASP 26 H ASP 26 9.117 0.750 7.464
183 HA ASP 26 HA ASP 26 11.608 0.010 6.463
184 HD2 ASP 26 HD ASP 26 12.024 -3.743 8.326
185 HB2 ASP 26 1HB ASP 26 9.635 -1.256 7.855
186 HB3 ASP 26 2HB ASP 26 9.504 -2.047 6.279
187 H VAL 27 H VAL 27 8.485 0.233 4.871
188 HA VAL 27 HA VAL 27 9.221 -1.100 2.479
189 HB VAL 27 HB VAL 27 6.863 -0.655 3.217
190 HG11 VAL 27 1HG1 VAL 27 7.162 2.066 1.995
191 HG12 VAL 27 2HG1 VAL 27 5.863 1.437 3.012
192 HG13 VAL 27 3HG1 VAL 27 7.437 1.809 3.717
193 HG21 VAL 27 3HG2 VAL 27 6.149 0.086 0.815
194 HG22 VAL 27 1HG2 VAL 27 7.872 -0.059 0.471
195 HG23 VAL 27 2HG2 VAL 27 6.969 -1.455 1.058
196 H ASN 28 H ASN 28 9.541 2.197 3.601
197 HA ASN 28 HA ASN 28 10.029 3.469 1.153
198 HB2 ASN 28 1HB ASN 28 9.624 4.549 3.420
199 HB3 ASN 28 2HB ASN 28 11.325 4.221 3.773
200 HD21 ASN 28 1HD2 ASN 28 12.682 5.795 3.345
201 HD22 ASN 28 2HD2 ASN 28 12.450 7.058 2.191
202 H GLN 29 H GLN 29 12.150 1.679 3.315
203 HA GLN 29 HA GLN 29 14.579 2.372 2.013
204 HB2 GLN 29 1HB GLN 29 13.711 0.456 4.094
205 HB3 GLN 29 2HB GLN 29 15.167 0.007 3.189
206 HG2 GLN 29 1HG GLN 29 16.390 1.800 3.966
207 HG3 GLN 29 2HG GLN 29 14.941 2.747 4.339
208 HE21 GLN 29 1HE2 GLN 29 13.461 1.321 5.938
209 HE22 GLN 29 2HE2 GLN 29 14.299 0.840 7.369
210 H ALA 30 H ALA 30 12.188 -0.139 1.538
211 HA ALA 30 HA ALA 30 13.692 -1.850 -0.112
212 HB1 ALA 30 1HB ALA 30 11.469 -2.338 0.984
213 HB2 ALA 30 2HB ALA 30 10.722 -1.425 -0.326
214 HB3 ALA 30 3HB ALA 30 11.645 -2.885 -0.683
215 H SER 31 H SER 31 12.091 1.171 -0.730
216 HA SER 31 HA SER 31 11.720 1.043 -3.483
217 HG SER 31 HG SER 31 12.814 4.649 -2.700
218 HB2 SER 31 1HB SER 31 11.344 3.316 -3.411
219 HB3 SER 31 2HB SER 31 11.163 2.915 -1.693
220 H ARG 32 H ARG 32 14.626 1.265 -1.647
221 HA ARG 32 HA ARG 32 16.297 2.391 -3.647
222 HE ARG 32 HE ARG 32 17.999 3.174 0.075
223 HB2 ARG 32 1HB ARG 32 16.686 2.112 -1.084
224 HB3 ARG 32 2HB ARG 32 17.313 0.520 -1.536
225 HG2 ARG 32 1HG ARG 32 18.940 1.596 -3.043
226 HG3 ARG 32 2HG ARG 32 18.344 3.175 -2.507
227 HD2 ARG 32 1HD ARG 32 19.721 1.068 -0.834
228 HD3 ARG 32 2HD ARG 32 20.319 2.678 -1.259
229 HH11 ARG 32 1HH1 ARG 32 20.892 1.377 0.791
230 HH12 ARG 32 2HH1 ARG 32 20.795 1.650 2.500
231 HH21 ARG 32 1HH2 ARG 32 17.860 3.539 2.322
232 HH22 ARG 32 2HH2 ARG 32 19.069 2.878 3.370
233 H ILE 33 H ILE 33 14.886 -0.681 -3.270
234 HA ILE 33 HA ILE 33 16.515 -1.703 -5.484
235 HB ILE 33 HB ILE 33 15.694 -3.527 -3.244
236 HG12 ILE 33 1HG1 ILE 33 18.324 -3.274 -2.788
237 HG13 ILE 33 2HG1 ILE 33 17.983 -1.632 -3.363
238 HG21 ILE 33 1HG2 ILE 33 17.804 -4.706 -4.215
239 HG22 ILE 33 2HG2 ILE 33 16.265 -4.810 -5.072
240 HG23 ILE 33 3HG2 ILE 33 17.503 -3.677 -5.615
241 HD11 ILE 33 3HD1 ILE 33 16.933 -3.018 -0.934
242 HD12 ILE 33 1HD1 ILE 33 17.725 -1.449 -1.073
243 HD13 ILE 33 2HD1 ILE 33 16.068 -1.655 -1.643
244 H ASN 34 H ASN 34 13.647 -0.688 -4.808
245 HA ASN 34 HA ASN 34 12.207 -2.955 -6.015
246 HB2 ASN 34 1HB ASN 34 11.503 -1.010 -3.914
247 HB3 ASN 34 2HB ASN 34 10.236 -1.291 -5.115
248 HD21 ASN 34 1HD2 ASN 34 12.483 -3.032 -3.010
249 HD22 ASN 34 2HD2 ASN 34 11.416 -4.347 -2.669
250 H ARG 35 H ARG 35 13.086 0.375 -6.338
251 HA ARG 35 HA ARG 35 11.187 1.243 -8.197
252 HE ARG 35 HE ARG 35 16.653 2.127 -6.676
253 HB2 ARG 35 1HB ARG 35 12.732 2.996 -8.769
254 HB3 ARG 35 2HB ARG 35 12.830 2.704 -7.025
255 HG2 ARG 35 1HG ARG 35 14.848 1.282 -7.447
256 HG3 ARG 35 2HG ARG 35 14.790 1.829 -9.130
257 HD2 ARG 35 1HD ARG 35 15.702 3.817 -8.633
258 HD3 ARG 35 2HD ARG 35 14.624 4.033 -7.245
259 HH11 ARG 35 1HH1 ARG 35 16.058 5.543 -6.975
260 HH12 ARG 35 2HH1 ARG 35 17.330 5.995 -5.889
261 HH21 ARG 35 1HH2 ARG 35 18.333 2.707 -5.244
262 HH22 ARG 35 2HH2 ARG 35 18.625 4.380 -4.906
263 H LYS 36 H LYS 36 13.934 -0.842 -8.549
264 HA LYS 36 HA LYS 36 14.819 -1.972 -10.317
265 HB2 LYS 36 1HB LYS 36 12.059 -1.566 -11.493
266 HB3 LYS 36 2HB LYS 36 13.241 -2.784 -11.994
267 HG2 LYS 36 1HG LYS 36 12.709 -4.182 -10.329
268 HG3 LYS 36 2HG LYS 36 12.588 -2.868 -9.146
269 HD2 LYS 36 1HD LYS 36 10.392 -3.507 -9.223
270 HD3 LYS 36 2HD LYS 36 10.403 -2.297 -10.519
271 HE2 LYS 36 1HE LYS 36 10.317 -3.883 -12.204
272 HE3 LYS 36 2HE LYS 36 11.018 -5.142 -11.179
273 HZ1 LYS 36 3HZ LYS 36 8.612 -5.424 -11.657
274 HZ2 LYS 36 1HZ LYS 36 8.303 -4.022 -10.763
275 HZ3 LYS 36 2HZ LYS 36 8.979 -5.374 -10.006
276 H LYS 37 H LYS 37 16.125 0.026 -10.639
277 HA LYS 37 HA LYS 37 15.408 1.503 -13.070
278 HB2 LYS 37 1HB LYS 37 16.680 2.214 -10.610
279 HB3 LYS 37 2HB LYS 37 17.826 2.478 -11.933
280 HG2 LYS 37 1HG LYS 37 15.451 3.535 -12.898
281 HG3 LYS 37 2HG LYS 37 15.480 4.000 -11.187
282 HD2 LYS 37 1HD LYS 37 17.802 4.864 -11.516
283 HD3 LYS 37 2HD LYS 37 17.618 4.533 -13.248
284 HE2 LYS 37 1HE LYS 37 15.547 6.190 -11.861
285 HE3 LYS 37 2HE LYS 37 17.106 6.916 -12.277
286 HZ1 LYS 37 3HZ LYS 37 15.231 7.085 -13.970
287 HZ2 LYS 37 1HZ LYS 37 15.520 5.448 -14.292
288 HZ3 LYS 37 2HZ LYS 37 16.745 6.588 -14.539
289 H LYS 38 H LYS 38 17.669 -0.797 -11.794
290 HA LYS 38 HA LYS 38 19.776 -0.542 -13.603
291 HB2 LYS 38 1HB LYS 38 18.681 -3.006 -12.229
292 HB3 LYS 38 2HB LYS 38 20.222 -2.951 -13.099
293 HG2 LYS 38 1HG LYS 38 21.290 -2.016 -11.383
294 HG3 LYS 38 2HG LYS 38 19.993 -0.836 -11.122
295 HD2 LYS 38 1HD LYS 38 20.182 -2.194 -9.148
296 HD3 LYS 38 2HD LYS 38 18.676 -2.617 -9.983
297 HE2 LYS 38 1HE LYS 38 19.363 -4.718 -10.454
298 HE3 LYS 38 2HE LYS 38 21.021 -4.195 -10.790
299 HZ1 LYS 38 3HZ LYS 38 20.637 -5.655 -8.761
300 HZ2 LYS 38 1HZ LYS 38 19.974 -4.281 -8.028
301 HZ3 LYS 38 2HZ LYS 38 21.585 -4.269 -8.545
302 H HIS 39 H HIS 39 16.624 -1.988 -13.967
303 HA HIS 39 HA HIS 39 17.281 -3.333 -16.432
304 HD1 HIS 39 1HD HIS 39 14.290 -3.153 -18.208
305 HD2 HIS 39 2HD HIS 39 15.239 -6.445 -15.857
306 HE1 HIS 39 1HE HIS 39 13.755 -5.165 -19.619
307 HE2 HIS 39 2HE HIS 39 14.336 -7.176 -18.183
308 HB2 HIS 39 1HB HIS 39 15.493 -4.010 -14.684
309 HB3 HIS 39 2HB HIS 39 14.487 -2.784 -15.463
Start of MODEL 17
1 H1 GLY 1 H GLY 1 -24.653 3.037 6.796
2 HA2 GLY 1 2HA GLY 1 -22.324 1.447 7.655
3 HA3 GLY 1 3HA GLY 1 -23.576 0.720 6.659
4 H THR 2 H THR 2 -20.629 1.368 6.264
5 HA THR 2 HA THR 2 -20.745 1.895 3.506
6 HB THR 2 HB THR 2 -19.257 4.144 4.014
7 HG1 THR 2 1HG THR 2 -20.108 4.040 6.227
8 HG21 THR 2 3HG2 THR 2 -22.158 4.573 3.619
9 HG22 THR 2 1HG2 THR 2 -21.356 3.507 2.463
10 HG23 THR 2 2HG2 THR 2 -20.786 5.163 2.682
11 H TRP 3 H TRP 3 -19.459 0.174 5.499
12 HA TRP 3 HA TRP 3 -16.684 0.806 5.619
13 HD1 TRP 3 HD TRP 3 -19.745 -1.191 8.001
14 HE1 TRP 3 1HE TRP 3 -19.438 -0.108 10.316
15 HE3 TRP 3 3HE TRP 3 -14.880 0.316 7.554
16 HZ2 TRP 3 2HZ TRP 3 -17.404 1.212 11.760
17 HZ3 TRP 3 3HZ TRP 3 -13.830 1.482 9.447
18 HH2 TRP 3 HH TRP 3 -15.067 1.921 11.506
19 HB2 TRP 3 1HB TRP 3 -18.174 -1.800 6.029
20 HB3 TRP 3 2HB TRP 3 -16.448 -1.594 6.326
21 H ASP 4 H ASP 4 -18.719 -0.753 3.292
22 HA ASP 4 HA ASP 4 -16.630 -2.115 1.890
23 HD2 ASP 4 HD ASP 4 -17.355 -4.784 -0.120
24 HB2 ASP 4 1HB ASP 4 -19.473 -1.994 1.784
25 HB3 ASP 4 2HB ASP 4 -18.858 -1.581 0.178
26 H ASP 5 H ASP 5 -18.368 0.938 1.439
27 HA ASP 5 HA ASP 5 -16.889 1.618 -0.935
28 HD2 ASP 5 HD ASP 5 -20.007 0.863 -2.043
29 HB2 ASP 5 1HB ASP 5 -18.818 3.168 0.804
30 HB3 ASP 5 2HB ASP 5 -18.039 3.852 -0.630
31 H ILE 6 H ILE 6 -16.896 2.651 2.455
32 HA ILE 6 HA ILE 6 -14.779 4.545 2.093
33 HB ILE 6 HB ILE 6 -15.880 3.329 4.628
34 HG12 ILE 6 1HG1 ILE 6 -16.384 6.041 3.383
35 HG13 ILE 6 2HG1 ILE 6 -17.490 4.662 3.259
36 HG21 ILE 6 1HG2 ILE 6 -14.124 4.241 5.638
37 HG22 ILE 6 2HG2 ILE 6 -13.593 5.019 4.146
38 HG23 ILE 6 3HG2 ILE 6 -14.772 5.819 5.186
39 HD11 ILE 6 3HD1 ILE 6 -18.453 5.707 5.015
40 HD12 ILE 6 1HD1 ILE 6 -17.276 4.741 5.903
41 HD13 ILE 6 2HD1 ILE 6 -16.941 6.438 5.554
42 H GLY 7 H GLY 7 -14.970 1.375 3.725
43 HA2 GLY 7 2HA GLY 7 -12.316 1.118 4.459
44 HA3 GLY 7 3HA GLY 7 -13.370 -0.234 4.069
45 H GLN 8 H GLN 8 -13.742 0.783 1.297
46 HA GLN 8 HA GLN 8 -11.533 -0.605 0.127
47 HB2 GLN 8 1HB GLN 8 -14.063 0.620 -0.815
48 HB3 GLN 8 2HB GLN 8 -12.758 0.507 -2.005
49 HG2 GLN 8 1HG GLN 8 -13.419 -1.914 -0.398
50 HG3 GLN 8 2HG GLN 8 -14.513 -1.426 -1.702
51 HE21 GLN 8 1HE2 GLN 8 -13.010 -3.818 -1.627
52 HE22 GLN 8 2HE2 GLN 8 -11.904 -3.790 -2.954
53 H GLY 9 H GLY 9 -12.454 2.760 0.512
54 HA2 GLY 9 2HA GLY 9 -10.396 3.748 -1.247
55 HA3 GLY 9 3HA GLY 9 -11.421 4.712 -0.191
56 H ILE 10 H ILE 10 -10.891 3.901 2.282
57 HA ILE 10 HA ILE 10 -8.524 5.148 2.968
58 HB ILE 10 HB ILE 10 -10.369 4.658 4.550
59 HG12 ILE 10 1HG1 ILE 10 -7.705 3.576 5.497
60 HG13 ILE 10 2HG1 ILE 10 -8.061 5.299 5.293
61 HG21 ILE 10 1HG2 ILE 10 -10.718 2.312 3.851
62 HG22 ILE 10 2HG2 ILE 10 -9.206 1.881 4.648
63 HG23 ILE 10 3HG2 ILE 10 -10.558 2.493 5.597
64 HD11 ILE 10 3HD1 ILE 10 -9.613 5.312 7.046
65 HD12 ILE 10 1HD1 ILE 10 -9.708 3.550 7.086
66 HD13 ILE 10 2HD1 ILE 10 -8.247 4.370 7.640
67 H GLY 11 H GLY 11 -9.079 1.836 2.022
68 HA2 GLY 11 2HA GLY 11 -6.694 0.697 3.007
69 HA3 GLY 11 3HA GLY 11 -7.650 0.075 1.670
70 H ARG 12 H ARG 12 -7.459 1.947 -0.242
71 HA ARG 12 HA ARG 12 -4.752 1.613 -1.139
72 HE ARG 12 HE ARG 12 -6.174 -1.412 -2.604
73 HB2 ARG 12 1HB ARG 12 -7.110 3.057 -2.373
74 HB3 ARG 12 2HB ARG 12 -5.554 2.799 -3.177
75 HG2 ARG 12 1HG ARG 12 -7.055 0.444 -2.109
76 HG3 ARG 12 2HG ARG 12 -7.558 1.196 -3.633
77 HD2 ARG 12 1HD ARG 12 -5.826 0.334 -4.765
78 HD3 ARG 12 2HD ARG 12 -4.684 0.789 -3.492
79 HH11 ARG 12 1HH1 ARG 12 -3.765 -0.606 -4.984
80 HH12 ARG 12 2HH1 ARG 12 -3.075 -2.196 -5.014
81 HH21 ARG 12 1HH2 ARG 12 -5.276 -3.507 -2.634
82 HH22 ARG 12 2HH2 ARG 12 -3.936 -3.845 -3.677
83 H VAL 13 H VAL 13 -6.691 4.220 0.159
84 HA VAL 13 HA VAL 13 -4.926 6.339 -0.534
85 HB VAL 13 HB VAL 13 -6.985 6.210 1.674
86 HG11 VAL 13 1HG1 VAL 13 -6.912 8.653 1.620
87 HG12 VAL 13 2HG1 VAL 13 -5.341 7.974 2.051
88 HG13 VAL 13 3HG1 VAL 13 -5.620 8.590 0.422
89 HG21 VAL 13 3HG2 VAL 13 -7.283 6.266 -1.139
90 HG22 VAL 13 1HG2 VAL 13 -8.534 6.412 0.097
91 HG23 VAL 13 2HG2 VAL 13 -7.738 7.857 -0.528
92 H ALA 14 H ALA 14 -5.295 4.294 2.324
93 HA ALA 14 HA ALA 14 -3.602 5.595 4.085
94 HB1 ALA 14 1HB ALA 14 -4.977 3.721 4.763
95 HB2 ALA 14 2HB ALA 14 -4.023 2.628 3.759
96 HB3 ALA 14 3HB ALA 14 -3.288 3.405 5.161
97 H TYR 15 H TYR 15 -2.829 3.566 1.343
98 HA TYR 15 HA TYR 15 -0.071 3.221 1.998
99 HD1 TYR 15 2HD TYR 15 1.374 1.398 1.182
100 HD2 TYR 15 1HD TYR 15 -0.114 3.006 -2.465
101 HE1 TYR 15 2HE TYR 15 3.515 0.880 0.086
102 HE2 TYR 15 1HE TYR 15 2.022 2.493 -3.571
103 HH TYR 15 HH TYR 15 4.420 2.148 -2.873
104 HB2 TYR 15 1HB TYR 15 -1.237 1.638 0.543
105 HB3 TYR 15 2HB TYR 15 -1.518 2.917 -0.642
106 H TRP 16 H TRP 16 -1.928 5.629 0.306
107 HA TRP 16 HA TRP 16 0.341 6.877 -0.946
108 HD1 TRP 16 HD TRP 16 -2.834 5.477 -2.539
109 HE1 TRP 16 1HE TRP 16 -2.326 5.379 -5.060
110 HE3 TRP 16 3HE TRP 16 0.109 9.639 -2.936
111 HZ2 TRP 16 2HZ TRP 16 -0.870 6.870 -6.965
112 HZ3 TRP 16 3HZ TRP 16 1.021 10.232 -5.144
113 HH2 TRP 16 HH TRP 16 0.541 8.874 -7.115
114 HB2 TRP 16 1HB TRP 16 -2.583 7.456 -0.725
115 HB3 TRP 16 2HB TRP 16 -1.503 8.783 -1.151
116 H VAL 17 H VAL 17 -1.717 7.567 1.860
117 HA VAL 17 HA VAL 17 -0.429 9.985 2.578
118 HB VAL 17 HB VAL 17 -2.670 9.425 3.390
119 HG11 VAL 17 1HG1 VAL 17 -3.065 7.742 5.044
120 HG12 VAL 17 2HG1 VAL 17 -2.218 6.990 3.692
121 HG13 VAL 17 3HG1 VAL 17 -1.342 7.389 5.170
122 HG21 VAL 17 3HG2 VAL 17 -0.705 10.708 4.767
123 HG22 VAL 17 1HG2 VAL 17 -2.401 10.658 5.248
124 HG23 VAL 17 2HG2 VAL 17 -1.250 9.524 5.954
125 H GLY 18 H GLY 18 0.143 6.609 3.379
126 HA2 GLY 18 2HA GLY 18 1.961 7.060 5.507
127 HA3 GLY 18 3HA GLY 18 1.812 5.578 4.575
128 H LYS 19 H LYS 19 2.436 6.552 2.031
129 HA LYS 19 HA LYS 19 5.286 6.592 2.194
130 HB2 LYS 19 1HB LYS 19 5.239 6.681 -0.242
131 HB3 LYS 19 2HB LYS 19 4.098 5.467 0.361
132 HG2 LYS 19 1HG LYS 19 2.228 6.936 -0.027
133 HG3 LYS 19 2HG LYS 19 3.325 8.246 -0.497
134 HD2 LYS 19 1HD LYS 19 3.480 5.643 -1.961
135 HD3 LYS 19 2HD LYS 19 2.146 6.755 -2.315
136 HE2 LYS 19 1HE LYS 19 4.064 8.543 -2.483
137 HE3 LYS 19 2HE LYS 19 5.080 7.119 -2.739
138 HZ1 LYS 19 3HZ LYS 19 3.792 8.394 -4.694
139 HZ2 LYS 19 1HZ LYS 19 2.653 7.201 -4.321
140 HZ3 LYS 19 2HZ LYS 19 4.223 6.761 -4.768
141 H ALA 20 H ALA 20 2.795 8.999 1.677
142 HA ALA 20 HA ALA 20 4.556 11.071 0.811
143 HB1 ALA 20 1HB ALA 20 1.765 11.232 1.943
144 HB2 ALA 20 2HB ALA 20 2.633 12.557 1.167
145 HB3 ALA 20 3HB ALA 20 2.199 11.125 0.236
146 H LEU 21 H LEU 21 3.447 9.905 3.905
147 HA LEU 21 HA LEU 21 4.392 12.216 5.355
148 HG LEU 21 HG LEU 21 1.695 11.694 5.784
149 HB2 LEU 21 1HB LEU 21 3.061 9.640 6.033
150 HB3 LEU 21 2HB LEU 21 3.991 10.455 7.301
151 HD11 LEU 21 1HD1 LEU 21 1.810 10.499 8.547
152 HD12 LEU 21 2HD1 LEU 21 0.887 9.894 7.173
153 HD13 LEU 21 3HD1 LEU 21 0.467 11.441 7.905
154 HD21 LEU 21 3HD2 LEU 21 3.764 12.823 7.368
155 HD22 LEU 21 1HD2 LEU 21 2.252 12.941 8.270
156 HD23 LEU 21 2HD2 LEU 21 2.365 13.625 6.648
157 H GLY 22 H GLY 22 5.593 9.089 4.419
158 HA2 GLY 22 2HA GLY 22 7.754 8.277 4.475
159 HA3 GLY 22 3HA GLY 22 8.261 9.807 5.175
160 H ASN 23 H ASN 23 7.067 6.592 5.846
161 HA ASN 23 HA ASN 23 8.126 6.830 8.566
162 HB2 ASN 23 1HB ASN 23 5.338 5.988 7.798
163 HB3 ASN 23 2HB ASN 23 6.087 5.391 9.284
164 HD21 ASN 23 1HD2 ASN 23 4.950 8.229 7.601
165 HD22 ASN 23 2HD2 ASN 23 4.839 9.249 8.992
166 H LEU 24 H LEU 24 9.218 5.599 6.225
167 HA LEU 24 HA LEU 24 9.964 3.099 7.286
168 HG LEU 24 HG LEU 24 8.095 3.941 4.234
169 HB2 LEU 24 1HB LEU 24 9.034 1.700 5.391
170 HB3 LEU 24 2HB LEU 24 7.886 2.227 6.636
171 HD11 LEU 24 1HD1 LEU 24 8.165 1.849 3.112
172 HD12 LEU 24 2HD1 LEU 24 6.499 2.421 3.030
173 HD13 LEU 24 3HD1 LEU 24 6.943 1.161 4.181
174 HD21 LEU 24 3HD2 LEU 24 6.244 4.727 5.166
175 HD22 LEU 24 1HD2 LEU 24 6.313 3.478 6.409
176 HD23 LEU 24 2HD2 LEU 24 5.459 3.171 4.898
177 H SER 25 H SER 25 11.773 4.688 6.727
178 HA SER 25 HA SER 25 12.532 4.885 3.964
179 HG SER 25 HG SER 25 13.722 4.990 7.301
180 HB2 SER 25 1HB SER 25 14.523 6.009 4.767
181 HB3 SER 25 2HB SER 25 13.123 6.608 5.674
182 H ASP 26 H ASP 26 12.690 2.432 6.220
183 HA ASP 26 HA ASP 26 15.200 1.294 5.309
184 HD2 ASP 26 HD ASP 26 16.744 -1.507 6.806
185 HB2 ASP 26 1HB ASP 26 13.896 1.144 7.684
186 HB3 ASP 26 2HB ASP 26 13.360 -0.362 6.926
187 H VAL 27 H VAL 27 12.372 1.579 3.851
188 HA VAL 27 HA VAL 27 12.759 -0.835 2.283
189 HB VAL 27 HB VAL 27 10.115 -0.251 3.626
190 HG11 VAL 27 1HG1 VAL 27 9.404 -1.070 1.613
191 HG12 VAL 27 2HG1 VAL 27 10.880 -2.002 1.345
192 HG13 VAL 27 3HG1 VAL 27 9.662 -2.584 2.481
193 HG21 VAL 27 3HG2 VAL 27 11.577 -1.323 5.173
194 HG22 VAL 27 1HG2 VAL 27 10.466 -2.551 4.567
195 HG23 VAL 27 2HG2 VAL 27 12.117 -2.478 3.953
196 H ASN 28 H ASN 28 10.870 2.111 2.821
197 HA ASN 28 HA ASN 28 9.775 2.306 0.236
198 HB2 ASN 28 1HB ASN 28 8.926 3.580 2.164
199 HB3 ASN 28 2HB ASN 28 10.422 4.522 2.192
200 HD21 ASN 28 1HD2 ASN 28 10.281 6.429 1.285
201 HD22 ASN 28 2HD2 ASN 28 9.237 6.870 -0.019
202 H GLN 29 H GLN 29 12.904 3.095 1.514
203 HA GLN 29 HA GLN 29 13.725 4.863 -0.550
204 HB2 GLN 29 1HB GLN 29 15.921 4.677 0.351
205 HB3 GLN 29 2HB GLN 29 14.798 4.634 1.718
206 HG2 GLN 29 1HG GLN 29 15.012 2.224 1.878
207 HG3 GLN 29 2HG GLN 29 16.066 2.213 0.457
208 HE21 GLN 29 1HE2 GLN 29 17.694 1.217 1.695
209 HE22 GLN 29 2HE2 GLN 29 18.655 2.121 2.810
210 H ALA 30 H ALA 30 13.553 1.414 -0.268
211 HA ALA 30 HA ALA 30 15.428 0.683 -2.233
212 HB1 ALA 30 1HB ALA 30 14.513 -1.464 -2.133
213 HB2 ALA 30 2HB ALA 30 14.223 -0.797 -0.526
214 HB3 ALA 30 3HB ALA 30 12.911 -0.861 -1.703
215 H SER 31 H SER 31 12.159 1.868 -2.445
216 HA SER 31 HA SER 31 11.450 1.031 -4.999
217 HG SER 31 HG SER 31 9.998 4.517 -3.490
218 HB2 SER 31 1HB SER 31 9.840 2.827 -5.015
219 HB3 SER 31 2HB SER 31 9.950 2.197 -3.361
220 H ARG 32 H ARG 32 13.768 3.377 -3.999
221 HA ARG 32 HA ARG 32 13.868 4.908 -6.388
222 HE ARG 32 HE ARG 32 16.359 7.783 -5.039
223 HB2 ARG 32 1HB ARG 32 15.910 4.462 -4.199
224 HB3 ARG 32 2HB ARG 32 16.112 5.622 -5.520
225 HG2 ARG 32 1HG ARG 32 13.711 5.731 -3.720
226 HG3 ARG 32 2HG ARG 32 15.249 6.481 -3.265
227 HD2 ARG 32 1HD ARG 32 13.781 7.049 -5.847
228 HD3 ARG 32 2HD ARG 32 13.645 8.031 -4.382
229 HH11 ARG 32 1HH1 ARG 32 13.446 9.263 -6.244
230 HH12 ARG 32 2HH1 ARG 32 14.279 10.566 -7.027
231 HH21 ARG 32 1HH2 ARG 32 17.465 9.493 -6.065
232 HH22 ARG 32 2HH2 ARG 32 16.564 10.696 -6.924
233 H ILE 33 H ILE 33 14.889 1.763 -5.633
234 HA ILE 33 HA ILE 33 16.400 1.638 -8.148
235 HB ILE 33 HB ILE 33 17.271 0.043 -5.758
236 HG12 ILE 33 1HG1 ILE 33 19.188 1.904 -5.858
237 HG13 ILE 33 2HG1 ILE 33 17.823 2.897 -6.402
238 HG21 ILE 33 1HG2 ILE 33 18.134 0.405 -8.516
239 HG22 ILE 33 2HG2 ILE 33 19.444 0.585 -7.352
240 HG23 ILE 33 3HG2 ILE 33 18.488 -0.895 -7.380
241 HD11 ILE 33 3HD1 ILE 33 17.749 3.253 -4.146
242 HD12 ILE 33 1HD1 ILE 33 16.628 1.903 -4.309
243 HD13 ILE 33 2HD1 ILE 33 18.280 1.618 -3.757
244 H ASN 34 H ASN 34 13.741 0.681 -6.652
245 HA ASN 34 HA ASN 34 13.824 -2.038 -7.782
246 HB2 ASN 34 1HB ASN 34 12.762 -0.986 -5.234
247 HB3 ASN 34 2HB ASN 34 11.694 -2.112 -6.084
248 HD21 ASN 34 1HD2 ASN 34 13.484 -2.218 -3.608
249 HD22 ASN 34 2HD2 ASN 34 14.337 -3.710 -3.794
250 H ARG 35 H ARG 35 11.470 0.510 -6.935
251 HA ARG 35 HA ARG 35 9.663 1.337 -8.039
252 HE ARG 35 HE ARG 35 13.680 3.456 -11.727
253 HB2 ARG 35 1HB ARG 35 10.836 0.104 -10.536
254 HB3 ARG 35 2HB ARG 35 9.724 1.477 -10.428
255 HG2 ARG 35 1HG ARG 35 11.661 2.568 -9.040
256 HG3 ARG 35 2HG ARG 35 12.649 1.368 -9.887
257 HD2 ARG 35 1HD ARG 35 10.953 2.519 -11.831
258 HD3 ARG 35 2HD ARG 35 11.593 3.849 -10.855
259 HH11 ARG 35 1HH1 ARG 35 11.586 0.773 -12.465
260 HH12 ARG 35 2HH1 ARG 35 12.710 0.026 -13.552
261 HH21 ARG 35 1HH2 ARG 35 15.169 2.480 -13.154
262 HH22 ARG 35 2HH2 ARG 35 14.748 0.997 -13.942
263 H LYS 36 H LYS 36 9.986 -1.638 -7.227
264 HA LYS 36 HA LYS 36 8.051 -2.962 -8.914
265 HB2 LYS 36 1HB LYS 36 9.448 -3.782 -6.359
266 HB3 LYS 36 2HB LYS 36 8.294 -4.813 -7.220
267 HG2 LYS 36 1HG LYS 36 10.087 -4.051 -9.191
268 HG3 LYS 36 2HG LYS 36 11.095 -4.319 -7.758
269 HD2 LYS 36 1HD LYS 36 10.930 -6.393 -8.961
270 HD3 LYS 36 2HD LYS 36 9.989 -6.532 -7.464
271 HE2 LYS 36 1HE LYS 36 8.077 -6.881 -8.574
272 HE3 LYS 36 2HE LYS 36 8.387 -5.515 -9.656
273 HZ1 LYS 36 3HZ LYS 36 8.345 -7.393 -11.026
274 HZ2 LYS 36 1HZ LYS 36 9.282 -8.318 -9.961
275 HZ3 LYS 36 2HZ LYS 36 9.993 -7.055 -10.834
276 H LYS 37 H LYS 37 8.101 -1.270 -5.870
277 HA LYS 37 HA LYS 37 6.476 -0.707 -4.377
278 HB2 LYS 37 1HB LYS 37 4.697 -1.022 -6.806
279 HB3 LYS 37 2HB LYS 37 4.287 -0.141 -5.325
280 HG2 LYS 37 1HG LYS 37 6.712 0.621 -6.914
281 HG3 LYS 37 2HG LYS 37 5.097 1.171 -7.399
282 HD2 LYS 37 1HD LYS 37 5.404 2.876 -5.983
283 HD3 LYS 37 2HD LYS 37 5.141 1.689 -4.693
284 HE2 LYS 37 1HE LYS 37 7.757 1.249 -5.171
285 HE3 LYS 37 2HE LYS 37 7.644 2.956 -5.626
286 HZ1 LYS 37 3HZ LYS 37 8.045 3.168 -3.414
287 HZ2 LYS 37 1HZ LYS 37 7.294 1.707 -3.005
288 HZ3 LYS 37 2HZ LYS 37 6.357 3.073 -3.350
289 H LYS 38 H LYS 38 7.060 -3.079 -3.707
290 HA LYS 38 HA LYS 38 6.381 -5.055 -2.802
291 HB2 LYS 38 1HB LYS 38 3.949 -3.319 -2.639
292 HB3 LYS 38 2HB LYS 38 3.816 -5.026 -2.191
293 HG2 LYS 38 1HG LYS 38 5.819 -4.598 -0.650
294 HG3 LYS 38 2HG LYS 38 5.464 -2.880 -0.904
295 HD2 LYS 38 1HD LYS 38 3.011 -4.208 -0.316
296 HD3 LYS 38 2HD LYS 38 4.215 -4.699 0.889
297 HE2 LYS 38 1HE LYS 38 4.458 -2.580 1.735
298 HE3 LYS 38 2HE LYS 38 4.052 -1.815 0.193
299 HZ1 LYS 38 3HZ LYS 38 2.060 -1.453 1.073
300 HZ2 LYS 38 1HZ LYS 38 2.345 -2.488 2.381
301 HZ3 LYS 38 2HZ LYS 38 1.761 -3.111 0.922
302 H HIS 39 H HIS 39 6.797 -5.621 -5.239
303 HA HIS 39 HA HIS 39 6.285 -6.949 -7.015
304 HD1 HIS 39 1HD HIS 39 4.933 -8.284 -8.617
305 HD2 HIS 39 2HD HIS 39 5.453 -11.035 -5.547
306 HE1 HIS 39 1HE HIS 39 5.300 -10.497 -9.753
307 HE2 HIS 39 2HE HIS 39 5.620 -12.179 -7.879
308 HB2 HIS 39 1HB HIS 39 5.489 -8.316 -4.896
309 HB3 HIS 39 2HB HIS 39 3.888 -8.028 -5.588
Start of MODEL 18
1 H1 GLY 1 H GLY 1 -20.719 -5.028 9.988
2 HA2 GLY 1 2HA GLY 1 -23.032 -3.418 9.130
3 HA3 GLY 1 3HA GLY 1 -22.021 -3.077 10.526
4 H THR 2 H THR 2 -21.554 -0.977 9.918
5 HA THR 2 HA THR 2 -20.716 -0.148 7.378
6 HB THR 2 HB THR 2 -19.604 1.770 8.688
7 HG1 THR 2 1HG THR 2 -19.573 0.389 10.672
8 HG21 THR 2 3HG2 THR 2 -21.910 2.625 9.422
9 HG22 THR 2 1HG2 THR 2 -22.531 1.099 8.794
10 HG23 THR 2 2HG2 THR 2 -21.692 2.219 7.720
11 H TRP 3 H TRP 3 -19.078 -1.945 9.775
12 HA TRP 3 HA TRP 3 -16.432 -1.234 9.494
13 HD1 TRP 3 HD TRP 3 -19.427 -3.771 11.421
14 HE1 TRP 3 1HE TRP 3 -19.549 -2.951 13.857
15 HE3 TRP 3 3HE TRP 3 -14.754 -1.739 11.831
16 HZ2 TRP 3 2HZ TRP 3 -17.885 -1.620 15.708
17 HZ3 TRP 3 3HZ TRP 3 -14.097 -0.713 13.967
18 HH2 TRP 3 HH TRP 3 -15.633 -0.654 15.865
19 HB2 TRP 3 1HB TRP 3 -17.457 -4.077 9.695
20 HB3 TRP 3 2HB TRP 3 -15.869 -3.489 10.185
21 H ASP 4 H ASP 4 -18.486 -2.927 7.252
22 HA ASP 4 HA ASP 4 -16.521 -4.081 5.611
23 HD2 ASP 4 HD ASP 4 -19.766 -6.393 6.445
24 HB2 ASP 4 1HB ASP 4 -19.368 -3.217 5.161
25 HB3 ASP 4 2HB ASP 4 -18.389 -3.818 3.818
26 H ASP 5 H ASP 5 -18.196 -0.955 5.353
27 HA ASP 5 HA ASP 5 -16.602 -0.128 3.106
28 HD2 ASP 5 HD ASP 5 -19.666 0.479 1.135
29 HB2 ASP 5 1HB ASP 5 -18.953 0.821 4.519
30 HB3 ASP 5 2HB ASP 5 -17.819 2.142 4.205
31 H ILE 6 H ILE 6 -16.767 0.704 6.551
32 HA ILE 6 HA ILE 6 -14.786 2.688 6.539
33 HB ILE 6 HB ILE 6 -15.463 0.809 8.805
34 HG12 ILE 6 1HG1 ILE 6 -16.590 3.559 8.232
35 HG13 ILE 6 2HG1 ILE 6 -17.415 2.050 7.801
36 HG21 ILE 6 1HG2 ILE 6 -13.385 2.020 9.160
37 HG22 ILE 6 2HG2 ILE 6 -14.195 3.546 8.803
38 HG23 ILE 6 3HG2 ILE 6 -14.644 2.625 10.238
39 HD11 ILE 6 3HD1 ILE 6 -16.743 3.009 10.570
40 HD12 ILE 6 1HD1 ILE 6 -18.344 2.856 9.844
41 HD13 ILE 6 2HD1 ILE 6 -17.394 1.411 10.198
42 H GLY 7 H GLY 7 -14.578 -0.787 6.536
43 HA2 GLY 7 2HA GLY 7 -11.780 -0.830 7.280
44 HA3 GLY 7 3HA GLY 7 -12.756 -2.210 6.798
45 H GLN 8 H GLN 8 -13.672 -1.115 4.316
46 HA GLN 8 HA GLN 8 -11.417 -1.799 2.688
47 HB2 GLN 8 1HB GLN 8 -13.818 -2.387 2.188
48 HB3 GLN 8 2HB GLN 8 -14.069 -0.687 1.769
49 HG2 GLN 8 1HG GLN 8 -13.701 -1.667 -0.289
50 HG3 GLN 8 2HG GLN 8 -12.110 -1.020 0.135
51 HE21 GLN 8 1HE2 GLN 8 -12.786 -3.185 -1.675
52 HE22 GLN 8 2HE2 GLN 8 -11.957 -4.583 -1.093
53 H GLY 9 H GLY 9 -12.884 1.143 3.784
54 HA2 GLY 9 2HA GLY 9 -12.028 2.934 1.819
55 HA3 GLY 9 3HA GLY 9 -12.300 3.344 3.506
56 H ILE 10 H ILE 10 -10.236 1.350 4.343
57 HA ILE 10 HA ILE 10 -8.074 3.036 4.677
58 HB ILE 10 HB ILE 10 -8.455 0.919 5.934
59 HG12 ILE 10 1HG1 ILE 10 -5.694 0.825 4.753
60 HG13 ILE 10 2HG1 ILE 10 -6.211 2.233 5.696
61 HG21 ILE 10 1HG2 ILE 10 -8.206 -1.154 5.044
62 HG22 ILE 10 2HG2 ILE 10 -8.692 -0.302 3.578
63 HG23 ILE 10 3HG2 ILE 10 -6.985 -0.629 3.884
64 HD11 ILE 10 3HD1 ILE 10 -5.140 -0.149 6.669
65 HD12 ILE 10 1HD1 ILE 10 -5.835 1.176 7.599
66 HD13 ILE 10 2HD1 ILE 10 -6.847 -0.182 7.107
67 H GLY 11 H GLY 11 -8.870 0.982 1.971
68 HA2 GLY 11 2HA GLY 11 -6.336 0.888 0.737
69 HA3 GLY 11 3HA GLY 11 -7.880 0.685 -0.079
70 H ARG 12 H ARG 12 -9.088 3.069 0.131
71 HA ARG 12 HA ARG 12 -7.564 4.679 -1.694
72 HE ARG 12 HE ARG 12 -9.986 1.951 -3.441
73 HB2 ARG 12 1HB ARG 12 -10.209 5.328 -0.378
74 HB3 ARG 12 2HB ARG 12 -9.536 6.064 -1.840
75 HG2 ARG 12 1HG ARG 12 -10.210 3.135 -1.642
76 HG3 ARG 12 2HG ARG 12 -11.354 4.365 -2.204
77 HD2 ARG 12 1HD ARG 12 -10.348 4.580 -4.209
78 HD3 ARG 12 2HD ARG 12 -8.730 4.493 -3.499
79 HH11 ARG 12 1HH1 ARG 12 -8.417 4.207 -5.580
80 HH12 ARG 12 2HH1 ARG 12 -7.875 2.987 -6.682
81 HH21 ARG 12 1HH2 ARG 12 -9.277 0.335 -4.885
82 HH22 ARG 12 2HH2 ARG 12 -8.365 0.783 -6.287
83 H VAL 13 H VAL 13 -8.420 4.806 1.697
84 HA VAL 13 HA VAL 13 -7.665 7.510 2.143
85 HB VAL 13 HB VAL 13 -7.817 5.219 4.107
86 HG11 VAL 13 1HG1 VAL 13 -7.975 6.954 5.821
87 HG12 VAL 13 2HG1 VAL 13 -6.447 7.059 4.944
88 HG13 VAL 13 3HG1 VAL 13 -7.749 8.197 4.590
89 HG21 VAL 13 3HG2 VAL 13 -10.028 5.420 4.038
90 HG22 VAL 13 1HG2 VAL 13 -9.916 7.157 4.328
91 HG23 VAL 13 2HG2 VAL 13 -9.851 6.533 2.681
92 H ALA 14 H ALA 14 -5.965 4.424 2.393
93 HA ALA 14 HA ALA 14 -3.640 5.236 3.657
94 HB1 ALA 14 1HB ALA 14 -3.952 3.181 1.472
95 HB2 ALA 14 2HB ALA 14 -2.547 3.340 2.527
96 HB3 ALA 14 3HB ALA 14 -4.115 2.905 3.207
97 H TYR 15 H TYR 15 -4.652 5.703 0.340
98 HA TYR 15 HA TYR 15 -2.098 6.529 -0.636
99 HD1 TYR 15 2HD TYR 15 -1.329 6.606 -2.898
100 HD2 TYR 15 1HD TYR 15 -5.054 8.613 -3.346
101 HE1 TYR 15 2HE TYR 15 -0.377 7.952 -4.723
102 HE2 TYR 15 1HE TYR 15 -4.113 9.964 -5.173
103 HH TYR 15 HH TYR 15 -0.724 9.594 -6.172
104 HB2 TYR 15 1HB TYR 15 -3.788 5.632 -2.148
105 HB3 TYR 15 2HB TYR 15 -4.877 6.965 -1.753
106 H TRP 16 H TRP 16 -4.783 8.113 0.915
107 HA TRP 16 HA TRP 16 -3.943 10.774 0.233
108 HD1 TRP 16 HD TRP 16 -7.493 8.972 -0.154
109 HE1 TRP 16 1HE TRP 16 -8.672 10.374 -1.961
110 HE3 TRP 16 3HE TRP 16 -5.363 13.514 0.830
111 HZ2 TRP 16 2HZ TRP 16 -8.696 13.052 -2.851
112 HZ3 TRP 16 3HZ TRP 16 -6.018 15.445 -0.546
113 HH2 TRP 16 HH TRP 16 -7.649 15.218 -2.348
114 HB2 TRP 16 1HB TRP 16 -6.062 9.580 1.986
115 HB3 TRP 16 2HB TRP 16 -5.630 11.277 2.198
116 H VAL 17 H VAL 17 -3.771 8.712 3.111
117 HA VAL 17 HA VAL 17 -2.508 10.628 4.771
118 HB VAL 17 HB VAL 17 -3.659 8.677 5.700
119 HG11 VAL 17 1HG1 VAL 17 -1.351 7.029 4.683
120 HG12 VAL 17 2HG1 VAL 17 -2.785 6.458 5.539
121 HG13 VAL 17 3HG1 VAL 17 -2.931 7.101 3.903
122 HG21 VAL 17 3HG2 VAL 17 -1.795 9.856 6.919
123 HG22 VAL 17 1HG2 VAL 17 -2.127 8.208 7.453
124 HG23 VAL 17 2HG2 VAL 17 -0.738 8.537 6.418
125 H GLY 18 H GLY 18 -1.304 8.205 2.527
126 HA2 GLY 18 2HA GLY 18 1.409 8.274 3.314
127 HA3 GLY 18 3HA GLY 18 0.807 7.753 1.746
128 H LYS 19 H LYS 19 -0.368 10.101 0.844
129 HA LYS 19 HA LYS 19 1.939 11.517 -0.065
130 HB2 LYS 19 1HB LYS 19 0.348 12.903 -1.314
131 HB3 LYS 19 2HB LYS 19 0.006 11.178 -1.520
132 HG2 LYS 19 1HG LYS 19 -1.844 11.289 0.007
133 HG3 LYS 19 2HG LYS 19 -1.452 12.970 0.410
134 HD2 LYS 19 1HD LYS 19 -3.312 12.914 -1.146
135 HD3 LYS 19 2HD LYS 19 -1.886 13.615 -1.929
136 HE2 LYS 19 1HE LYS 19 -1.395 11.382 -2.928
137 HE3 LYS 19 2HE LYS 19 -2.920 10.800 -2.246
138 HZ1 LYS 19 3HZ LYS 19 -4.141 11.928 -3.757
139 HZ2 LYS 19 1HZ LYS 19 -2.736 11.775 -4.687
140 HZ3 LYS 19 2HZ LYS 19 -3.053 13.219 -3.866
141 H ALA 20 H ALA 20 -0.528 12.081 2.352
142 HA ALA 20 HA ALA 20 0.009 14.833 2.779
143 HB1 ALA 20 1HB ALA 20 -1.143 14.396 4.999
144 HB2 ALA 20 2HB ALA 20 -2.071 14.035 3.544
145 HB3 ALA 20 3HB ALA 20 -1.323 12.727 4.460
146 H LEU 21 H LEU 21 1.462 11.885 3.947
147 HA LEU 21 HA LEU 21 2.935 13.177 6.060
148 HG LEU 21 HG LEU 21 2.938 11.847 7.701
149 HB2 LEU 21 1HB LEU 21 2.321 10.509 5.278
150 HB3 LEU 21 2HB LEU 21 4.084 10.673 5.360
151 HD11 LEU 21 1HD1 LEU 21 1.768 9.252 6.836
152 HD12 LEU 21 2HD1 LEU 21 1.038 10.579 7.739
153 HD13 LEU 21 3HD1 LEU 21 2.158 9.478 8.542
154 HD21 LEU 21 3HD2 LEU 21 4.352 10.189 8.811
155 HD22 LEU 21 1HD2 LEU 21 5.211 10.990 7.497
156 HD23 LEU 21 2HD2 LEU 21 4.587 9.357 7.274
157 H GLY 22 H GLY 22 3.429 12.394 2.709
158 HA2 GLY 22 2HA GLY 22 5.583 14.129 2.369
159 HA3 GLY 22 3HA GLY 22 6.255 12.532 2.659
160 H ASN 23 H ASN 23 6.587 14.010 0.270
161 HA ASN 23 HA ASN 23 4.768 13.042 -1.723
162 HB2 ASN 23 1HB ASN 23 7.389 14.525 -1.797
163 HB3 ASN 23 2HB ASN 23 6.652 13.909 -3.281
164 HD21 ASN 23 1HD2 ASN 23 5.319 15.438 -0.371
165 HD22 ASN 23 2HD2 ASN 23 4.486 16.698 -1.208
166 H LEU 24 H LEU 24 7.870 12.039 -0.438
167 HA LEU 24 HA LEU 24 9.279 10.312 -0.998
168 HG LEU 24 HG LEU 24 8.849 9.344 0.986
169 HB2 LEU 24 1HB LEU 24 6.515 9.191 -0.787
170 HB3 LEU 24 2HB LEU 24 7.854 8.128 -1.254
171 HD11 LEU 24 1HD1 LEU 24 7.009 9.065 2.670
172 HD12 LEU 24 2HD1 LEU 24 5.878 8.993 1.318
173 HD13 LEU 24 3HD1 LEU 24 6.835 10.450 1.591
174 HD21 LEU 24 3HD2 LEU 24 8.740 7.230 1.948
175 HD22 LEU 24 1HD2 LEU 24 8.693 6.889 0.218
176 HD23 LEU 24 2HD2 LEU 24 7.206 6.846 1.165
177 H SER 25 H SER 25 9.656 11.475 -3.114
178 HA SER 25 HA SER 25 8.502 10.125 -5.430
179 HG SER 25 HG SER 25 10.554 13.616 -5.322
180 HB2 SER 25 1HB SER 25 9.679 11.848 -6.755
181 HB3 SER 25 2HB SER 25 8.645 12.566 -5.508
182 H ASP 26 H ASP 26 11.716 10.840 -4.082
183 HA ASP 26 HA ASP 26 13.195 9.356 -5.949
184 HD2 ASP 26 HD ASP 26 16.535 10.428 -6.196
185 HB2 ASP 26 1HB ASP 26 13.685 10.729 -3.440
186 HB3 ASP 26 2HB ASP 26 14.611 9.225 -3.537
187 H VAL 27 H VAL 27 11.540 8.423 -3.004
188 HA VAL 27 HA VAL 27 12.696 5.873 -2.680
189 HB VAL 27 HB VAL 27 9.903 6.713 -1.893
190 HG11 VAL 27 1HG1 VAL 27 11.526 4.319 -1.447
191 HG12 VAL 27 2HG1 VAL 27 10.827 5.003 0.022
192 HG13 VAL 27 3HG1 VAL 27 9.782 4.548 -1.324
193 HG21 VAL 27 3HG2 VAL 27 11.054 7.127 0.350
194 HG22 VAL 27 1HG2 VAL 27 12.562 7.140 -0.565
195 HG23 VAL 27 2HG2 VAL 27 11.305 8.325 -0.920
196 H ASN 28 H ASN 28 10.314 7.079 -4.868
197 HA ASN 28 HA ASN 28 8.995 4.651 -5.473
198 HB2 ASN 28 1HB ASN 28 8.249 7.028 -6.041
199 HB3 ASN 28 2HB ASN 28 9.382 6.944 -7.396
200 HD21 ASN 28 1HD2 ASN 28 8.569 6.305 -9.247
201 HD22 ASN 28 2HD2 ASN 28 7.168 5.316 -9.461
202 H GLN 29 H GLN 29 11.881 6.210 -6.762
203 HA GLN 29 HA GLN 29 12.229 4.280 -8.863
204 HB2 GLN 29 1HB GLN 29 13.981 6.476 -7.754
205 HB3 GLN 29 2HB GLN 29 14.504 5.399 -9.060
206 HG2 GLN 29 1HG GLN 29 13.104 6.328 -10.600
207 HG3 GLN 29 2HG GLN 29 11.911 6.799 -9.381
208 HE21 GLN 29 1HE2 GLN 29 15.163 7.552 -10.539
209 HE22 GLN 29 2HE2 GLN 29 15.095 9.240 -10.173
210 H ALA 30 H ALA 30 13.384 4.720 -5.591
211 HA ALA 30 HA ALA 30 15.526 2.898 -5.644
212 HB1 ALA 30 1HB ALA 30 15.509 3.004 -3.282
213 HB2 ALA 30 2HB ALA 30 15.007 4.599 -3.849
214 HB3 ALA 30 3HB ALA 30 13.804 3.460 -3.242
215 H SER 31 H SER 31 12.089 2.445 -5.434
216 HA SER 31 HA SER 31 11.936 -0.076 -4.274
217 HG SER 31 HG SER 31 9.652 1.396 -7.172
218 HB2 SER 31 1HB SER 31 9.740 -0.125 -4.976
219 HB3 SER 31 2HB SER 31 10.078 1.607 -5.138
220 H ARG 32 H ARG 32 13.111 0.870 -7.370
221 HA ARG 32 HA ARG 32 12.783 -1.609 -8.716
222 HE ARG 32 HE ARG 32 11.119 -0.924 -10.650
223 HB2 ARG 32 1HB ARG 32 13.506 0.904 -9.479
224 HB3 ARG 32 2HB ARG 32 15.069 0.073 -9.510
225 HG2 ARG 32 1HG ARG 32 14.568 -0.698 -11.525
226 HG3 ARG 32 2HG ARG 32 13.283 -1.662 -10.777
227 HD2 ARG 32 1HD ARG 32 12.844 1.223 -11.515
228 HD3 ARG 32 2HD ARG 32 12.648 -0.079 -12.698
229 HH11 ARG 32 1HH1 ARG 32 11.316 2.107 -12.352
230 HH12 ARG 32 2HH1 ARG 32 9.646 2.499 -12.114
231 HH21 ARG 32 1HH2 ARG 32 8.917 -0.419 -10.331
232 HH22 ARG 32 2HH2 ARG 32 8.282 1.062 -10.962
233 H ILE 33 H ILE 33 14.905 -0.563 -6.272
234 HA ILE 33 HA ILE 33 16.469 -3.026 -6.573
235 HB ILE 33 HB ILE 33 17.811 -0.480 -5.712
236 HG12 ILE 33 1HG1 ILE 33 18.783 -0.783 -8.193
237 HG13 ILE 33 2HG1 ILE 33 17.143 -1.401 -8.460
238 HG21 ILE 33 1HG2 ILE 33 19.520 -1.848 -5.356
239 HG22 ILE 33 2HG2 ILE 33 18.556 -3.217 -5.908
240 HG23 ILE 33 3HG2 ILE 33 19.514 -2.291 -7.062
241 HD11 ILE 33 3HD1 ILE 33 16.368 0.768 -7.310
242 HD12 ILE 33 1HD1 ILE 33 17.997 1.345 -7.656
243 HD13 ILE 33 2HD1 ILE 33 16.940 0.840 -8.975
244 H ASN 34 H ASN 34 14.298 -1.700 -4.774
245 HA ASN 34 HA ASN 34 15.631 -2.240 -2.203
246 HB2 ASN 34 1HB ASN 34 13.652 -0.231 -3.063
247 HB3 ASN 34 2HB ASN 34 13.289 -1.010 -1.518
248 HD21 ASN 34 1HD2 ASN 34 15.973 0.513 -3.258
249 HD22 ASN 34 2HD2 ASN 34 16.662 1.281 -1.873
250 H ARG 35 H ARG 35 13.045 -3.122 -4.326
251 HA ARG 35 HA ARG 35 11.385 -4.496 -2.524
252 HE ARG 35 HE ARG 35 8.046 -5.386 -2.976
253 HB2 ARG 35 1HB ARG 35 11.864 -4.711 -5.486
254 HB3 ARG 35 2HB ARG 35 10.769 -5.827 -4.660
255 HG2 ARG 35 1HG ARG 35 10.133 -3.156 -3.864
256 HG3 ARG 35 2HG ARG 35 10.212 -3.245 -5.631
257 HD2 ARG 35 1HD ARG 35 8.070 -3.949 -5.443
258 HD3 ARG 35 2HD ARG 35 8.842 -5.506 -5.110
259 HH11 ARG 35 1HH1 ARG 35 8.063 -2.181 -4.341
260 HH12 ARG 35 2HH1 ARG 35 7.270 -1.458 -2.981
261 HH21 ARG 35 1HH2 ARG 35 7.002 -4.442 -1.181
262 HH22 ARG 35 2HH2 ARG 35 6.668 -2.744 -1.184
263 H LYS 36 H LYS 36 14.415 -5.332 -3.983
264 HA LYS 36 HA LYS 36 14.175 -8.150 -3.347
265 HB2 LYS 36 1HB LYS 36 16.580 -6.597 -4.335
266 HB3 LYS 36 2HB LYS 36 16.404 -8.360 -4.303
267 HG2 LYS 36 1HG LYS 36 14.322 -7.913 -5.810
268 HG3 LYS 36 2HG LYS 36 15.129 -6.367 -6.120
269 HD2 LYS 36 1HD LYS 36 16.923 -8.680 -6.299
270 HD3 LYS 36 2HD LYS 36 15.598 -8.702 -7.477
271 HE2 LYS 36 1HE LYS 36 16.911 -6.084 -7.182
272 HE3 LYS 36 2HE LYS 36 17.957 -7.372 -7.801
273 HZ1 LYS 36 3HZ LYS 36 15.310 -6.659 -8.944
274 HZ2 LYS 36 1HZ LYS 36 16.397 -7.799 -9.562
275 HZ3 LYS 36 2HZ LYS 36 16.799 -6.157 -9.570
276 H LYS 37 H LYS 37 13.774 -6.982 -1.034
277 HA LYS 37 HA LYS 37 16.354 -6.978 0.384
278 HB2 LYS 37 1HB LYS 37 15.024 -5.883 2.241
279 HB3 LYS 37 2HB LYS 37 15.239 -4.919 0.770
280 HG2 LYS 37 1HG LYS 37 12.980 -5.548 0.031
281 HG3 LYS 37 2HG LYS 37 12.766 -6.459 1.538
282 HD2 LYS 37 1HD LYS 37 12.403 -4.607 2.769
283 HD3 LYS 37 2HD LYS 37 13.649 -3.683 1.910
284 HE2 LYS 37 1HE LYS 37 12.161 -2.741 0.522
285 HE3 LYS 37 2HE LYS 37 11.350 -4.286 0.230
286 HZ1 LYS 37 3HZ LYS 37 10.795 -3.415 2.855
287 HZ2 LYS 37 1HZ LYS 37 9.719 -3.685 1.578
288 HZ3 LYS 37 2HZ LYS 37 10.439 -2.167 1.770
289 H LYS 38 H LYS 38 14.896 -9.371 -0.448
290 HA LYS 38 HA LYS 38 13.835 -10.457 2.038
291 HB2 LYS 38 1HB LYS 38 13.873 -11.318 -0.823
292 HB3 LYS 38 2HB LYS 38 13.680 -12.554 0.431
293 HG2 LYS 38 1HG LYS 38 11.693 -11.482 1.271
294 HG3 LYS 38 2HG LYS 38 11.915 -10.131 0.147
295 HD2 LYS 38 1HD LYS 38 11.953 -12.530 -1.379
296 HD3 LYS 38 2HD LYS 38 10.560 -12.598 -0.286
297 HE2 LYS 38 1HE LYS 38 9.773 -10.439 -1.081
298 HE3 LYS 38 2HE LYS 38 11.203 -10.282 -2.109
299 HZ1 LYS 38 3HZ LYS 38 10.348 -12.528 -3.076
300 HZ2 LYS 38 1HZ LYS 38 9.666 -11.068 -3.589
301 HZ3 LYS 38 2HZ LYS 38 8.863 -12.021 -2.448
302 H HIS 39 H HIS 39 16.708 -10.547 0.102
303 HA HIS 39 HA HIS 39 17.788 -12.788 1.649
304 HD1 HIS 39 1HD HIS 39 17.783 -14.670 0.881
305 HD2 HIS 39 2HD HIS 39 18.222 -13.223 -2.989
306 HE1 HIS 39 1HE HIS 39 16.989 -16.523 -0.623
307 HE2 HIS 39 2HE HIS 39 17.254 -15.639 -2.988
308 HB2 HIS 39 1HB HIS 39 18.582 -11.434 -0.913
309 HB3 HIS 39 2HB HIS 39 19.764 -12.392 -0.017
Start of MODEL 19
1 H1 GLY 1 H GLY 1 -18.154 -8.870 6.577
2 HA2 GLY 1 2HA GLY 1 -18.917 -7.056 7.797
3 HA3 GLY 1 3HA GLY 1 -17.344 -6.959 8.570
4 H THR 2 H THR 2 -18.330 -4.612 8.078
5 HA THR 2 HA THR 2 -18.062 -3.522 5.513
6 HB THR 2 HB THR 2 -17.670 -1.326 6.799
7 HG1 THR 2 1HG THR 2 -16.969 -2.590 8.735
8 HG21 THR 2 3HG2 THR 2 -20.104 -3.065 7.082
9 HG22 THR 2 1HG2 THR 2 -19.838 -1.709 5.989
10 HG23 THR 2 2HG2 THR 2 -20.069 -1.418 7.713
11 H TRP 3 H TRP 3 -15.689 -4.557 7.736
12 HA TRP 3 HA TRP 3 -13.543 -2.887 7.298
13 HD1 TRP 3 HD TRP 3 -15.191 -6.381 9.348
14 HE1 TRP 3 1HE TRP 3 -15.436 -5.673 11.811
15 HE3 TRP 3 3HE TRP 3 -11.630 -2.716 9.500
16 HZ2 TRP 3 2HZ TRP 3 -14.274 -3.807 13.583
17 HZ3 TRP 3 3HZ TRP 3 -11.259 -1.517 11.616
18 HH2 TRP 3 HH TRP 3 -12.556 -2.054 13.614
19 HB2 TRP 3 1HB TRP 3 -13.386 -5.909 7.484
20 HB3 TRP 3 2HB TRP 3 -12.111 -4.756 7.882
21 H ASP 4 H ASP 4 -14.955 -5.236 5.152
22 HA ASP 4 HA ASP 4 -12.827 -5.549 3.347
23 HD2 ASP 4 HD ASP 4 -13.817 -6.482 -0.281
24 HB2 ASP 4 1HB ASP 4 -14.572 -7.099 3.123
25 HB3 ASP 4 2HB ASP 4 -15.809 -5.836 3.098
26 H ASP 5 H ASP 5 -15.582 -3.300 3.296
27 HA ASP 5 HA ASP 5 -14.597 -1.925 0.972
28 HD2 ASP 5 HD ASP 5 -17.853 0.945 0.088
29 HB2 ASP 5 1HB ASP 5 -17.032 -2.163 1.558
30 HB3 ASP 5 2HB ASP 5 -16.757 -1.024 2.884
31 H ILE 6 H ILE 6 -14.809 -1.221 4.441
32 HA ILE 6 HA ILE 6 -13.742 1.368 4.354
33 HB ILE 6 HB ILE 6 -13.481 -0.628 6.605
34 HG12 ILE 6 1HG1 ILE 6 -15.610 1.481 6.193
35 HG13 ILE 6 2HG1 ILE 6 -15.827 -0.227 5.772
36 HG21 ILE 6 1HG2 ILE 6 -12.003 1.232 6.932
37 HG22 ILE 6 2HG2 ILE 6 -13.281 2.378 6.534
38 HG23 ILE 6 3HG2 ILE 6 -13.384 1.421 8.013
39 HD11 ILE 6 3HD1 ILE 6 -15.259 0.827 8.533
40 HD12 ILE 6 1HD1 ILE 6 -16.826 0.293 7.930
41 HD13 ILE 6 2HD1 ILE 6 -15.507 -0.863 8.095
42 H GLY 7 H GLY 7 -12.223 -1.762 4.234
43 HA2 GLY 7 2HA GLY 7 -9.579 -0.789 4.833
44 HA3 GLY 7 3HA GLY 7 -9.996 -2.396 4.257
45 H GLN 8 H GLN 8 -11.465 -1.356 1.938
46 HA GLN 8 HA GLN 8 -9.341 -1.326 0.083
47 HB2 GLN 8 1HB GLN 8 -12.291 -1.026 -0.019
48 HB3 GLN 8 2HB GLN 8 -11.385 -0.368 -1.390
49 HG2 GLN 8 1HG GLN 8 -10.854 -3.157 -0.434
50 HG3 GLN 8 2HG GLN 8 -12.243 -2.807 -1.475
51 HE21 GLN 8 1HE2 GLN 8 -11.899 -2.096 -3.588
52 HE22 GLN 8 2HE2 GLN 8 -10.379 -2.299 -4.383
53 H GLY 9 H GLY 9 -11.032 1.202 1.767
54 HA2 GLY 9 2HA GLY 9 -10.266 3.336 0.030
55 HA3 GLY 9 3HA GLY 9 -10.883 3.498 1.667
56 H ILE 10 H ILE 10 -8.972 2.102 3.098
57 HA ILE 10 HA ILE 10 -7.026 4.003 3.573
58 HB ILE 10 HB ILE 10 -6.805 1.031 4.076
59 HG12 ILE 10 1HG1 ILE 10 -7.716 3.236 5.939
60 HG13 ILE 10 2HG1 ILE 10 -8.821 2.178 5.045
61 HG21 ILE 10 1HG2 ILE 10 -5.357 2.007 6.025
62 HG22 ILE 10 2HG2 ILE 10 -4.656 1.765 4.427
63 HG23 ILE 10 3HG2 ILE 10 -5.170 3.375 4.928
64 HD11 ILE 10 3HD1 ILE 10 -6.964 1.467 7.280
65 HD12 ILE 10 1HD1 ILE 10 -8.706 1.220 7.161
66 HD13 ILE 10 2HD1 ILE 10 -7.605 0.241 6.188
67 H GLY 11 H GLY 11 -7.063 1.429 1.218
68 HA2 GLY 11 2HA GLY 11 -4.307 1.326 0.637
69 HA3 GLY 11 3HA GLY 11 -5.601 0.852 -0.455
70 H ARG 12 H ARG 12 -6.912 3.121 -1.006
71 HA ARG 12 HA ARG 12 -5.051 4.500 -2.702
72 HE ARG 12 HE ARG 12 -5.306 2.654 -4.558
73 HB2 ARG 12 1HB ARG 12 -7.988 5.029 -2.188
74 HB3 ARG 12 2HB ARG 12 -7.023 5.733 -3.493
75 HG2 ARG 12 1HG ARG 12 -7.077 2.773 -3.322
76 HG3 ARG 12 2HG ARG 12 -8.566 3.590 -3.831
77 HD2 ARG 12 1HD ARG 12 -7.633 3.470 -5.885
78 HD3 ARG 12 2HD ARG 12 -6.766 4.911 -5.341
79 HH11 ARG 12 1HH1 ARG 12 -6.245 4.344 -7.452
80 HH12 ARG 12 2HH1 ARG 12 -4.847 3.852 -8.350
81 HH21 ARG 12 1HH2 ARG 12 -3.461 1.998 -5.727
82 HH22 ARG 12 2HH2 ARG 12 -3.265 2.516 -7.368
83 H VAL 13 H VAL 13 -6.723 5.165 0.300
84 HA VAL 13 HA VAL 13 -6.213 7.957 0.373
85 HB VAL 13 HB VAL 13 -6.741 6.049 2.657
86 HG11 VAL 13 1HG1 VAL 13 -6.361 7.761 4.019
87 HG12 VAL 13 2HG1 VAL 13 -5.990 8.805 2.646
88 HG13 VAL 13 3HG1 VAL 13 -7.651 8.660 3.222
89 HG21 VAL 13 3HG2 VAL 13 -8.931 6.161 2.195
90 HG22 VAL 13 1HG2 VAL 13 -8.856 7.885 1.827
91 HG23 VAL 13 2HG2 VAL 13 -8.424 6.701 0.594
92 H ALA 14 H ALA 14 -4.495 5.130 1.613
93 HA ALA 14 HA ALA 14 -2.587 6.352 3.198
94 HB1 ALA 14 1HB ALA 14 -2.266 3.932 1.427
95 HB2 ALA 14 2HB ALA 14 -1.165 4.398 2.725
96 HB3 ALA 14 3HB ALA 14 -2.828 3.947 3.099
97 H TYR 15 H TYR 15 -2.766 6.135 -0.292
98 HA TYR 15 HA TYR 15 -0.097 7.010 -0.787
99 HD1 TYR 15 1HD TYR 15 1.197 6.732 -2.780
100 HD2 TYR 15 2HD TYR 15 -2.368 8.350 -4.446
101 HE1 TYR 15 1HE TYR 15 2.519 7.806 -4.552
102 HE2 TYR 15 2HE TYR 15 -1.055 9.427 -6.223
103 HH TYR 15 HH TYR 15 2.109 8.632 -6.914
104 HB2 TYR 15 1HB TYR 15 -1.334 5.723 -2.451
105 HB3 TYR 15 2HB TYR 15 -2.533 7.014 -2.581
106 H TRP 16 H TRP 16 -3.161 8.596 -0.274
107 HA TRP 16 HA TRP 16 -2.296 11.164 -1.216
108 HD1 TRP 16 HD TRP 16 -5.257 9.017 -2.252
109 HE1 TRP 16 1HE TRP 16 -6.136 10.071 -4.430
110 HE3 TRP 16 3HE TRP 16 -4.346 13.935 -1.200
111 HZ2 TRP 16 2HZ TRP 16 -6.406 12.646 -5.553
112 HZ3 TRP 16 3HZ TRP 16 -4.943 15.632 -2.879
113 HH2 TRP 16 HH TRP 16 -5.951 14.997 -5.010
114 HB2 TRP 16 1HB TRP 16 -4.720 10.091 0.175
115 HB3 TRP 16 2HB TRP 16 -4.427 11.830 0.214
116 H VAL 17 H VAL 17 -2.729 9.660 1.967
117 HA VAL 17 HA VAL 17 -1.983 11.941 3.473
118 HB VAL 17 HB VAL 17 -3.240 10.090 4.470
119 HG11 VAL 17 1HG1 VAL 17 -0.685 8.500 4.312
120 HG12 VAL 17 2HG1 VAL 17 -2.237 7.966 4.958
121 HG13 VAL 17 3HG1 VAL 17 -2.060 8.281 3.232
122 HG21 VAL 17 3HG2 VAL 17 -1.219 11.545 5.640
123 HG22 VAL 17 1HG2 VAL 17 -2.431 10.589 6.494
124 HG23 VAL 17 2HG2 VAL 17 -0.852 9.889 6.130
125 H GLY 18 H GLY 18 -0.175 9.274 2.066
126 HA2 GLY 18 2HA GLY 18 2.264 9.722 3.422
127 HA3 GLY 18 3HA GLY 18 2.079 8.872 1.896
128 H LYS 19 H LYS 19 1.051 10.907 0.308
129 HA LYS 19 HA LYS 19 3.444 12.330 -0.322
130 HB2 LYS 19 1HB LYS 19 2.144 13.319 -2.146
131 HB3 LYS 19 2HB LYS 19 1.915 11.564 -2.072
132 HG2 LYS 19 1HG LYS 19 -0.244 11.821 -1.043
133 HG3 LYS 19 2HG LYS 19 -0.009 13.573 -0.920
134 HD2 LYS 19 1HD LYS 19 -1.316 13.437 -2.817
135 HD3 LYS 19 2HD LYS 19 0.316 13.424 -3.512
136 HE2 LYS 19 1HE LYS 19 0.267 11.081 -3.867
137 HE3 LYS 19 2HE LYS 19 -1.164 10.893 -2.841
138 HZ1 LYS 19 3HZ LYS 19 -2.154 10.844 -4.862
139 HZ2 LYS 19 1HZ LYS 19 -0.973 11.796 -5.610
140 HZ3 LYS 19 2HZ LYS 19 -2.159 12.522 -4.649
141 H ALA 20 H ALA 20 0.455 13.108 1.323
142 HA ALA 20 HA ALA 20 0.748 15.927 1.310
143 HB1 ALA 20 1HB ALA 20 -0.854 15.795 3.275
144 HB2 ALA 20 2HB ALA 20 -1.410 15.094 1.755
145 HB3 ALA 20 3HB ALA 20 -0.826 14.046 3.048
146 H LEU 21 H LEU 21 2.018 13.386 3.343
147 HA LEU 21 HA LEU 21 2.879 15.128 5.451
148 HG LEU 21 HG LEU 21 3.006 14.066 7.335
149 HB2 LEU 21 1HB LEU 21 2.721 12.325 4.984
150 HB3 LEU 21 2HB LEU 21 4.395 12.719 5.406
151 HD11 LEU 21 1HD1 LEU 21 1.346 11.826 6.360
152 HD12 LEU 21 2HD1 LEU 21 0.879 13.316 7.177
153 HD13 LEU 21 3HD1 LEU 21 1.536 11.970 8.107
154 HD21 LEU 21 3HD2 LEU 21 3.916 11.198 7.517
155 HD22 LEU 21 1HD2 LEU 21 3.796 12.368 8.832
156 HD23 LEU 21 2HD2 LEU 21 4.997 12.591 7.558
157 H GLY 22 H GLY 22 4.191 14.029 2.434
158 HA2 GLY 22 2HA GLY 22 6.091 14.649 1.301
159 HA3 GLY 22 3HA GLY 22 6.276 15.944 2.477
160 H ASN 23 H ASN 23 8.593 15.402 2.099
161 HA ASN 23 HA ASN 23 10.568 14.563 2.850
162 HB2 ASN 23 1HB ASN 23 8.994 14.815 5.067
163 HB3 ASN 23 2HB ASN 23 9.422 13.101 5.138
164 HD21 ASN 23 1HD2 ASN 23 10.890 16.288 4.665
165 HD22 ASN 23 2HD2 ASN 23 12.358 15.927 5.501
166 H LEU 24 H LEU 24 8.788 12.965 1.106
167 HA LEU 24 HA LEU 24 8.496 10.820 0.333
168 HG LEU 24 HG LEU 24 9.743 10.923 -1.618
169 HB2 LEU 24 1HB LEU 24 11.410 11.219 0.863
170 HB3 LEU 24 2HB LEU 24 10.842 9.625 0.339
171 HD11 LEU 24 1HD1 LEU 24 9.983 13.160 -1.023
172 HD12 LEU 24 2HD1 LEU 24 11.265 12.906 -2.207
173 HD13 LEU 24 3HD1 LEU 24 11.648 12.938 -0.486
174 HD21 LEU 24 3HD2 LEU 24 12.454 9.937 -1.187
175 HD22 LEU 24 1HD2 LEU 24 12.331 11.095 -2.512
176 HD23 LEU 24 2HD2 LEU 24 11.335 9.639 -2.518
177 H SER 25 H SER 25 7.190 10.344 2.313
178 HA SER 25 HA SER 25 8.513 8.587 4.234
179 HG SER 25 HG SER 25 6.472 9.125 6.616
180 HB2 SER 25 1HB SER 25 6.301 10.387 4.345
181 HB3 SER 25 2HB SER 25 5.697 8.757 4.698
182 H ASP 26 H ASP 26 5.734 8.513 2.011
183 HA ASP 26 HA ASP 26 5.089 5.806 2.372
184 HD2 ASP 26 HD ASP 26 2.640 4.504 -0.724
185 HB2 ASP 26 1HB ASP 26 3.794 7.722 1.160
186 HB3 ASP 26 2HB ASP 26 4.700 7.191 -0.263
187 H VAL 27 H VAL 27 7.449 7.387 0.322
188 HA VAL 27 HA VAL 27 8.032 5.213 -1.377
189 HB VAL 27 HB VAL 27 9.876 7.442 -0.505
190 HG11 VAL 27 1HG1 VAL 27 10.113 5.241 -2.464
191 HG12 VAL 27 2HG1 VAL 27 10.673 6.832 -2.987
192 HG13 VAL 27 3HG1 VAL 27 11.360 6.082 -1.545
193 HG21 VAL 27 3HG2 VAL 27 8.044 7.258 -2.896
194 HG22 VAL 27 1HG2 VAL 27 7.798 8.281 -1.481
195 HG23 VAL 27 2HG2 VAL 27 9.169 8.573 -2.552
196 H ASN 28 H ASN 28 8.887 5.894 1.899
197 HA ASN 28 HA ASN 28 11.226 4.316 2.084
198 HB2 ASN 28 1HB ASN 28 10.382 6.067 3.739
199 HB3 ASN 28 2HB ASN 28 9.287 4.814 4.339
200 HD21 ASN 28 1HD2 ASN 28 9.991 3.681 5.986
201 HD22 ASN 28 2HD2 ASN 28 11.645 3.408 6.406
202 H GLN 29 H GLN 29 7.799 3.595 2.473
203 HA GLN 29 HA GLN 29 8.260 0.898 3.352
204 HB2 GLN 29 1HB GLN 29 6.107 2.672 3.386
205 HB3 GLN 29 2HB GLN 29 5.612 1.385 2.271
206 HG2 GLN 29 1HG GLN 29 6.565 -0.132 4.258
207 HG3 GLN 29 2HG GLN 29 6.076 1.294 5.185
208 HE21 GLN 29 1HE2 GLN 29 4.174 0.972 6.073
209 HE22 GLN 29 2HE2 GLN 29 2.810 0.220 5.324
210 H ALA 30 H ALA 30 7.711 2.522 0.316
211 HA ALA 30 HA ALA 30 6.960 0.303 -1.243
212 HB1 ALA 30 1HB ALA 30 7.396 1.650 -3.137
213 HB2 ALA 30 2HB ALA 30 6.816 2.743 -1.880
214 HB3 ALA 30 3HB ALA 30 8.538 2.658 -2.248
215 H SER 31 H SER 31 10.040 1.373 -0.045
216 HA SER 31 HA SER 31 11.782 0.137 -1.826
217 HG SER 31 HG SER 31 13.146 0.320 1.955
218 HB2 SER 31 1HB SER 31 13.450 0.558 -0.290
219 HB3 SER 31 2HB SER 31 12.193 1.656 0.306
220 H ARG 32 H ARG 32 9.684 -1.237 0.535
221 HA ARG 32 HA ARG 32 11.037 -3.706 0.905
222 HE ARG 32 HE ARG 32 10.290 -5.591 3.112
223 HB2 ARG 32 1HB ARG 32 8.228 -2.747 1.390
224 HB3 ARG 32 2HB ARG 32 8.647 -4.454 1.596
225 HG2 ARG 32 1HG ARG 32 10.634 -3.189 3.008
226 HG3 ARG 32 2HG ARG 32 9.214 -2.172 3.312
227 HD2 ARG 32 1HD ARG 32 9.196 -3.796 5.027
228 HD3 ARG 32 2HD ARG 32 7.970 -4.310 3.860
229 HH11 ARG 32 1HH1 ARG 32 8.261 -5.468 5.938
230 HH12 ARG 32 2HH1 ARG 32 8.633 -7.086 6.437
231 HH21 ARG 32 1HH2 ARG 32 10.789 -7.723 3.758
232 HH22 ARG 32 2HH2 ARG 32 10.071 -8.367 5.195
233 H ILE 33 H ILE 33 9.252 -2.416 -1.681
234 HA ILE 33 HA ILE 33 9.248 -5.040 -2.994
235 HB ILE 33 HB ILE 33 6.963 -3.133 -3.409
236 HG12 ILE 33 1HG1 ILE 33 5.809 -5.038 -1.914
237 HG13 ILE 33 2HG1 ILE 33 7.420 -5.044 -1.178
238 HG21 ILE 33 1HG2 ILE 33 7.653 -5.907 -4.200
239 HG22 ILE 33 2HG2 ILE 33 5.957 -5.544 -3.887
240 HG23 ILE 33 3HG2 ILE 33 6.840 -4.635 -5.113
241 HD11 ILE 33 3HD1 ILE 33 5.709 -3.543 -0.095
242 HD12 ILE 33 1HD1 ILE 33 7.252 -2.797 -0.511
243 HD13 ILE 33 2HD1 ILE 33 5.837 -2.521 -1.527
244 H ASN 34 H ASN 34 10.645 -2.234 -3.036
245 HA ASN 34 HA ASN 34 10.429 -1.825 -5.945
246 HB2 ASN 34 1HB ASN 34 10.696 0.025 -3.662
247 HB3 ASN 34 2HB ASN 34 11.751 0.388 -5.034
248 HD21 ASN 34 1HD2 ASN 34 8.386 -0.303 -4.213
249 HD22 ASN 34 2HD2 ASN 34 7.697 0.681 -5.454
250 H ARG 35 H ARG 35 12.538 -2.583 -3.309
251 HA ARG 35 HA ARG 35 15.022 -2.024 -4.489
252 HE ARG 35 HE ARG 35 18.363 -1.786 -1.460
253 HB2 ARG 35 1HB ARG 35 14.259 -2.868 -2.052
254 HB3 ARG 35 2HB ARG 35 14.817 -4.404 -2.731
255 HG2 ARG 35 1HG ARG 35 17.004 -3.747 -2.835
256 HG3 ARG 35 2HG ARG 35 16.585 -2.033 -2.998
257 HD2 ARG 35 1HD ARG 35 15.702 -2.221 -0.581
258 HD3 ARG 35 2HD ARG 35 16.631 -3.726 -0.523
259 HH11 ARG 35 1HH1 ARG 35 16.494 -2.380 1.416
260 HH12 ARG 35 2HH1 ARG 35 17.600 -1.555 2.463
261 HH21 ARG 35 1HH2 ARG 35 19.828 -0.697 -0.093
262 HH22 ARG 35 2HH2 ARG 35 19.495 -0.598 1.604
263 H LYS 36 H LYS 36 12.762 -4.603 -4.976
264 HA LYS 36 HA LYS 36 14.371 -5.615 -7.168
265 HB2 LYS 36 1HB LYS 36 13.930 -7.092 -4.631
266 HB3 LYS 36 2HB LYS 36 13.727 -8.014 -6.130
267 HG2 LYS 36 1HG LYS 36 16.193 -6.423 -5.415
268 HG3 LYS 36 2HG LYS 36 16.001 -8.167 -5.177
269 HD2 LYS 36 1HD LYS 36 15.422 -8.233 -7.700
270 HD3 LYS 36 2HD LYS 36 16.175 -6.629 -7.745
271 HE2 LYS 36 1HE LYS 36 18.261 -7.451 -7.500
272 HE3 LYS 36 2HE LYS 36 17.739 -8.656 -6.314
273 HZ1 LYS 36 3HZ LYS 36 17.680 -10.215 -7.871
274 HZ2 LYS 36 1HZ LYS 36 18.417 -9.122 -8.931
275 HZ3 LYS 36 2HZ LYS 36 16.731 -9.266 -8.902
276 H LYS 37 H LYS 37 12.675 -4.841 -8.458
277 HA LYS 37 HA LYS 37 10.519 -6.707 -8.811
278 HB2 LYS 37 1HB LYS 37 9.940 -4.786 -7.017
279 HB3 LYS 37 2HB LYS 37 9.505 -3.937 -8.509
280 HG2 LYS 37 1HG LYS 37 8.433 -6.606 -8.554
281 HG3 LYS 37 2HG LYS 37 7.955 -5.768 -7.068
282 HD2 LYS 37 1HD LYS 37 7.449 -3.780 -8.728
283 HD3 LYS 37 2HD LYS 37 7.331 -5.100 -9.904
284 HE2 LYS 37 1HE LYS 37 5.516 -6.090 -8.829
285 HE3 LYS 37 2HE LYS 37 5.871 -5.276 -7.297
286 HZ1 LYS 37 3HZ LYS 37 5.401 -3.244 -9.078
287 HZ2 LYS 37 1HZ LYS 37 4.343 -3.797 -7.878
288 HZ3 LYS 37 2HZ LYS 37 4.229 -4.404 -9.452
289 H LYS 38 H LYS 38 12.736 -5.775 -10.364
290 HA LYS 38 HA LYS 38 13.264 -5.057 -12.459
291 HB2 LYS 38 1HB LYS 38 10.382 -5.869 -12.737
292 HB3 LYS 38 2HB LYS 38 11.273 -5.206 -14.117
293 HG2 LYS 38 1HG LYS 38 12.981 -6.999 -13.806
294 HG3 LYS 38 2HG LYS 38 11.923 -7.705 -12.569
295 HD2 LYS 38 1HD LYS 38 10.826 -7.104 -15.295
296 HD3 LYS 38 2HD LYS 38 11.803 -8.559 -15.035
297 HE2 LYS 38 1HE LYS 38 10.287 -9.365 -13.346
298 HE3 LYS 38 2HE LYS 38 9.382 -7.843 -13.388
299 HZ1 LYS 38 3HZ LYS 38 9.364 -8.732 -15.978
300 HZ2 LYS 38 1HZ LYS 38 8.081 -8.819 -14.880
301 HZ3 LYS 38 2HZ LYS 38 9.128 -10.135 -15.064
302 H HIS 39 H HIS 39 13.709 -2.913 -11.737
303 HA HIS 39 HA HIS 39 11.803 -0.954 -12.806
304 HD1 HIS 39 1HD HIS 39 14.254 1.141 -9.492
305 HD2 HIS 39 2HD HIS 39 13.476 -2.939 -9.424
306 HE1 HIS 39 1HE HIS 39 15.913 0.167 -7.871
307 HE2 HIS 39 2HE HIS 39 15.438 -2.327 -7.828
308 HB2 HIS 39 1HB HIS 39 12.308 0.565 -10.915
309 HB3 HIS 39 2HB HIS 39 11.480 -0.909 -10.405
Start of MODEL 20
1 H1 GLY 1 H GLY 1 -14.355 -10.306 8.142
2 HA2 GLY 1 2HA GLY 1 -12.253 -9.409 7.936
3 HA3 GLY 1 3HA GLY 1 -12.230 -10.094 6.318
4 H THR 2 H THR 2 -13.240 -7.293 8.211
5 HA THR 2 HA THR 2 -14.057 -5.653 6.094
6 HB THR 2 HB THR 2 -13.377 -3.745 7.688
7 HG1 THR 2 1HG THR 2 -11.894 -5.256 8.852
8 HG21 THR 2 3HG2 THR 2 -15.231 -4.434 9.324
9 HG22 THR 2 1HG2 THR 2 -15.373 -5.893 8.345
10 HG23 THR 2 2HG2 THR 2 -15.654 -4.311 7.616
11 H TRP 3 H TRP 3 -10.942 -6.720 6.993
12 HA TRP 3 HA TRP 3 -9.263 -4.655 6.283
13 HD1 TRP 3 HD TRP 3 -9.727 -8.733 7.794
14 HE1 TRP 3 1HE TRP 3 -9.071 -8.618 10.280
15 HE3 TRP 3 3HE TRP 3 -6.675 -4.634 7.638
16 HZ2 TRP 3 2HZ TRP 3 -7.469 -7.003 11.953
17 HZ3 TRP 3 3HZ TRP 3 -5.620 -3.868 9.724
18 HH2 TRP 3 HH TRP 3 -6.010 -5.030 11.837
19 HB2 TRP 3 1HB TRP 3 -8.813 -7.575 5.608
20 HB3 TRP 3 2HB TRP 3 -7.574 -6.336 5.820
21 H ASP 4 H ASP 4 -11.199 -6.697 4.235
22 HA ASP 4 HA ASP 4 -9.901 -6.254 1.784
23 HD2 ASP 4 HD ASP 4 -10.681 -8.064 -0.974
24 HB2 ASP 4 1HB ASP 4 -11.825 -7.899 2.422
25 HB3 ASP 4 2HB ASP 4 -12.883 -6.554 1.973
26 H ASP 5 H ASP 5 -12.636 -4.547 3.289
27 HA ASP 5 HA ASP 5 -12.719 -2.561 1.211
28 HD2 ASP 5 HD ASP 5 -16.471 -2.976 0.701
29 HB2 ASP 5 1HB ASP 5 -14.384 -3.383 3.401
30 HB3 ASP 5 2HB ASP 5 -14.101 -1.639 3.511
31 H ILE 6 H ILE 6 -11.647 -2.659 4.591
32 HA ILE 6 HA ILE 6 -10.899 0.033 4.813
33 HB ILE 6 HB ILE 6 -9.646 -2.322 6.227
34 HG12 ILE 6 1HG1 ILE 6 -11.930 -0.568 7.151
35 HG13 ILE 6 2HG1 ILE 6 -12.155 -2.157 6.404
36 HG21 ILE 6 1HG2 ILE 6 -9.048 -0.717 7.948
37 HG22 ILE 6 2HG2 ILE 6 -8.363 -0.237 6.396
38 HG23 ILE 6 3HG2 ILE 6 -9.795 0.583 7.019
39 HD11 ILE 6 3HD1 ILE 6 -10.526 -1.747 8.893
40 HD12 ILE 6 1HD1 ILE 6 -12.249 -2.117 8.909
41 HD13 ILE 6 2HD1 ILE 6 -11.108 -3.265 8.209
42 H GLY 7 H GLY 7 -9.302 -2.697 3.357
43 HA2 GLY 7 2HA GLY 7 -6.715 -1.436 3.224
44 HA3 GLY 7 3HA GLY 7 -7.189 -2.934 2.436
45 H GLN 8 H GLN 8 -9.524 -1.654 1.156
46 HA GLN 8 HA GLN 8 -8.216 -0.813 -1.231
47 HB2 GLN 8 1HB GLN 8 -10.935 -1.445 -0.368
48 HB3 GLN 8 2HB GLN 8 -10.875 -0.102 -1.521
49 HG2 GLN 8 1HG GLN 8 -9.871 -1.419 -3.190
50 HG3 GLN 8 2HG GLN 8 -9.464 -2.697 -2.036
51 HE21 GLN 8 1HE2 GLN 8 -11.045 -2.678 -4.562
52 HE22 GLN 8 2HE2 GLN 8 -12.557 -3.405 -4.146
53 H GLY 9 H GLY 9 -9.731 0.832 1.458
54 HA2 GLY 9 2HA GLY 9 -9.771 3.398 0.134
55 HA3 GLY 9 3HA GLY 9 -10.164 3.083 1.818
56 H ILE 10 H ILE 10 -7.960 2.049 2.893
57 HA ILE 10 HA ILE 10 -6.316 4.215 3.394
58 HB ILE 10 HB ILE 10 -6.443 2.191 4.818
59 HG12 ILE 10 1HG1 ILE 10 -3.559 2.260 4.323
60 HG13 ILE 10 2HG1 ILE 10 -4.291 3.872 4.386
61 HG21 ILE 10 1HG2 ILE 10 -4.383 0.799 3.224
62 HG22 ILE 10 2HG2 ILE 10 -5.693 0.147 4.209
63 HG23 ILE 10 3HG2 ILE 10 -6.027 0.760 2.590
64 HD11 ILE 10 3HD1 ILE 10 -5.113 2.048 6.534
65 HD12 ILE 10 1HD1 ILE 10 -3.419 2.536 6.551
66 HD13 ILE 10 2HD1 ILE 10 -4.691 3.758 6.590
67 H GLY 11 H GLY 11 -6.147 1.862 0.829
68 HA2 GLY 11 2HA GLY 11 -3.466 2.253 0.047
69 HA3 GLY 11 3HA GLY 11 -4.757 1.658 -0.987
70 H ARG 12 H ARG 12 -6.452 3.720 -1.230
71 HA ARG 12 HA ARG 12 -4.986 5.509 -2.934
72 HE ARG 12 HE ARG 12 -6.867 2.326 -5.289
73 HB2 ARG 12 1HB ARG 12 -7.909 5.580 -2.148
74 HB3 ARG 12 2HB ARG 12 -7.163 6.436 -3.505
75 HG2 ARG 12 1HG ARG 12 -7.182 3.430 -3.256
76 HG3 ARG 12 2HG ARG 12 -8.431 4.358 -4.107
77 HD2 ARG 12 1HD ARG 12 -6.888 5.165 -5.721
78 HD3 ARG 12 2HD ARG 12 -5.508 4.618 -4.761
79 HH11 ARG 12 1HH1 ARG 12 -5.605 4.908 -7.253
80 HH12 ARG 12 2HH1 ARG 12 -5.314 3.897 -8.628
81 HH21 ARG 12 1HH2 ARG 12 -6.489 0.982 -7.094
82 HH22 ARG 12 2HH2 ARG 12 -5.818 1.664 -8.537
83 H VAL 13 H VAL 13 -6.458 5.662 0.238
84 HA VAL 13 HA VAL 13 -6.380 8.489 0.520
85 HB VAL 13 HB VAL 13 -6.406 6.352 2.658
86 HG11 VAL 13 1HG1 VAL 13 -5.629 8.502 3.515
87 HG12 VAL 13 2HG1 VAL 13 -7.051 9.295 2.836
88 HG13 VAL 13 3HG1 VAL 13 -7.234 8.116 4.135
89 HG21 VAL 13 3HG2 VAL 13 -8.872 7.770 2.344
90 HG22 VAL 13 1HG2 VAL 13 -8.377 7.100 0.790
91 HG23 VAL 13 2HG2 VAL 13 -8.556 6.042 2.190
92 H ALA 14 H ALA 14 -4.151 5.885 1.376
93 HA ALA 14 HA ALA 14 -2.318 7.283 2.908
94 HB1 ALA 14 1HB ALA 14 -2.215 4.878 2.638
95 HB2 ALA 14 2HB ALA 14 -1.781 5.064 0.938
96 HB3 ALA 14 3HB ALA 14 -0.669 5.604 2.196
97 H TYR 15 H TYR 15 -2.777 7.276 -0.561
98 HA TYR 15 HA TYR 15 -0.315 8.580 -1.189
99 HD1 TYR 15 1HD TYR 15 0.823 8.663 -3.296
100 HD2 TYR 15 2HD TYR 15 -3.092 9.764 -4.548
101 HE1 TYR 15 1HE TYR 15 1.791 10.055 -5.077
102 HE2 TYR 15 2HE TYR 15 -2.134 11.159 -6.333
103 HH TYR 15 HH TYR 15 0.649 10.920 -7.562
104 HB2 TYR 15 1HB TYR 15 -1.474 7.226 -2.852
105 HB3 TYR 15 2HB TYR 15 -2.870 8.302 -2.787
106 H TRP 16 H TRP 16 -3.507 9.630 -0.283
107 HA TRP 16 HA TRP 16 -3.128 12.358 -1.104
108 HD1 TRP 16 HD TRP 16 -6.102 9.837 -1.921
109 HE1 TRP 16 1HE TRP 16 -7.188 10.872 -4.013
110 HE3 TRP 16 3HE TRP 16 -5.157 14.769 -0.969
111 HZ2 TRP 16 2HZ TRP 16 -7.593 13.439 -5.112
112 HZ3 TRP 16 3HZ TRP 16 -5.927 16.452 -2.590
113 HH2 TRP 16 HH TRP 16 -7.118 15.799 -4.619
114 HB2 TRP 16 1HB TRP 16 -5.241 10.833 0.370
115 HB3 TRP 16 2HB TRP 16 -5.211 12.591 0.515
116 H VAL 17 H VAL 17 -3.065 10.594 1.972
117 HA VAL 17 HA VAL 17 -2.553 12.858 3.597
118 HB VAL 17 HB VAL 17 -3.426 10.769 4.531
119 HG11 VAL 17 1HG1 VAL 17 -2.060 9.274 3.058
120 HG12 VAL 17 2HG1 VAL 17 -0.681 9.604 4.109
121 HG13 VAL 17 3HG1 VAL 17 -2.108 8.795 4.754
122 HG21 VAL 17 3HG2 VAL 17 -2.299 10.887 6.563
123 HG22 VAL 17 1HG2 VAL 17 -0.742 11.191 5.793
124 HG23 VAL 17 2HG2 VAL 17 -1.967 12.458 5.832
125 H GLY 18 H GLY 18 -0.483 10.611 1.857
126 HA2 GLY 18 2HA GLY 18 1.963 11.376 3.071
127 HA3 GLY 18 3HA GLY 18 1.790 10.566 1.522
128 H LYS 19 H LYS 19 0.308 12.486 0.139
129 HA LYS 19 HA LYS 19 2.395 14.281 -0.620
130 HB2 LYS 19 1HB LYS 19 0.813 15.124 -2.273
131 HB3 LYS 19 2HB LYS 19 0.817 13.352 -2.258
132 HG2 LYS 19 1HG LYS 19 -1.248 13.298 -1.012
133 HG3 LYS 19 2HG LYS 19 -1.231 15.066 -0.866
134 HD2 LYS 19 1HD LYS 19 -2.771 14.364 -2.625
135 HD3 LYS 19 2HD LYS 19 -1.409 15.269 -3.304
136 HE2 LYS 19 1HE LYS 19 -0.713 12.494 -3.224
137 HE3 LYS 19 2HE LYS 19 -2.302 12.670 -3.983
138 HZ1 LYS 19 3HZ LYS 19 0.265 13.336 -5.018
139 HZ2 LYS 19 1HZ LYS 19 -0.773 14.670 -5.074
140 HZ3 LYS 19 2HZ LYS 19 -1.218 13.220 -5.823
141 H ALA 20 H ALA 20 -0.510 14.529 1.317
142 HA ALA 20 HA ALA 20 -0.616 17.359 1.441
143 HB1 ALA 20 1HB ALA 20 -1.642 15.688 3.682
144 HB2 ALA 20 2HB ALA 20 -2.363 17.095 2.902
145 HB3 ALA 20 3HB ALA 20 -2.385 15.531 2.089
146 H LEU 21 H LEU 21 1.142 14.930 3.230
147 HA LEU 21 HA LEU 21 1.939 16.701 5.346
148 HG LEU 21 HG LEU 21 2.613 15.451 7.281
149 HB2 LEU 21 1HB LEU 21 2.135 13.898 4.737
150 HB3 LEU 21 2HB LEU 21 3.724 14.531 5.201
151 HD11 LEU 21 1HD1 LEU 21 0.373 13.753 6.218
152 HD12 LEU 21 2HD1 LEU 21 0.326 15.446 6.704
153 HD13 LEU 21 3HD1 LEU 21 0.523 14.185 7.921
154 HD21 LEU 21 3HD2 LEU 21 3.770 13.684 8.006
155 HD22 LEU 21 1HD2 LEU 21 3.318 12.705 6.609
156 HD23 LEU 21 2HD2 LEU 21 2.231 12.821 7.993
157 H GLY 22 H GLY 22 3.162 15.793 2.221
158 HA2 GLY 22 2HA GLY 22 4.926 16.594 0.987
159 HA3 GLY 22 3HA GLY 22 4.966 17.951 2.101
160 H ASN 23 H ASN 23 5.525 14.498 2.707
161 HA ASN 23 HA ASN 23 8.348 15.056 3.228
162 HB2 ASN 23 1HB ASN 23 6.648 13.543 5.220
163 HB3 ASN 23 2HB ASN 23 8.325 14.066 5.408
164 HD21 ASN 23 1HD2 ASN 23 8.617 16.505 5.128
165 HD22 ASN 23 2HD2 ASN 23 7.474 17.496 5.961
166 H LEU 24 H LEU 24 7.034 13.660 1.097
167 HA LEU 24 HA LEU 24 6.926 11.626 0.033
168 HG LEU 24 HG LEU 24 8.592 11.850 -1.624
169 HB2 LEU 24 1HB LEU 24 9.664 11.917 1.193
170 HB3 LEU 24 2HB LEU 24 9.233 10.401 0.379
171 HD11 LEU 24 1HD1 LEU 24 8.720 14.052 -1.436
172 HD12 LEU 24 2HD1 LEU 24 10.444 13.927 -1.089
173 HD13 LEU 24 3HD1 LEU 24 9.274 13.889 0.230
174 HD21 LEU 24 3HD2 LEU 24 10.535 10.481 -1.721
175 HD22 LEU 24 1HD2 LEU 24 11.436 11.576 -0.673
176 HD23 LEU 24 2HD2 LEU 24 10.996 12.080 -2.305
177 H SER 25 H SER 25 5.272 11.059 1.796
178 HA SER 25 HA SER 25 6.193 9.003 3.640
179 HG SER 25 HG SER 25 3.559 8.128 4.553
180 HB2 SER 25 1HB SER 25 4.497 10.799 4.264
181 HB3 SER 25 2HB SER 25 3.348 9.931 3.232
182 H ASP 26 H ASP 26 3.821 9.312 1.005
183 HA ASP 26 HA ASP 26 3.065 6.618 0.907
184 HD2 ASP 26 HD ASP 26 0.545 5.818 -2.065
185 HB2 ASP 26 1HB ASP 26 1.800 8.407 -0.199
186 HB3 ASP 26 2HB ASP 26 3.131 8.642 -1.341
187 H VAL 27 H VAL 27 5.780 8.319 -0.512
188 HA VAL 27 HA VAL 27 6.593 6.332 -2.338
189 HB VAL 27 HB VAL 27 8.380 8.302 -0.909
190 HG11 VAL 27 1HG1 VAL 27 9.934 7.138 -2.035
191 HG12 VAL 27 2HG1 VAL 27 8.746 6.396 -3.108
192 HG13 VAL 27 3HG1 VAL 27 9.338 8.024 -3.439
193 HG21 VAL 27 3HG2 VAL 27 6.916 9.778 -1.839
194 HG22 VAL 27 1HG2 VAL 27 7.939 9.493 -3.247
195 HG23 VAL 27 2HG2 VAL 27 6.399 8.646 -3.090
196 H ASN 28 H ASN 28 6.891 6.595 1.091
197 HA ASN 28 HA ASN 28 9.129 4.911 1.474
198 HB2 ASN 28 1HB ASN 28 8.043 6.487 3.166
199 HB3 ASN 28 2HB ASN 28 6.837 5.219 3.412
200 HD21 ASN 28 1HD2 ASN 28 7.220 3.873 5.003
201 HD22 ASN 28 2HD2 ASN 28 8.769 3.484 5.662
202 H GLN 29 H GLN 29 5.673 4.287 1.184
203 HA GLN 29 HA GLN 29 5.876 1.508 1.832
204 HB2 GLN 29 1HB GLN 29 3.761 3.392 1.010
205 HB3 GLN 29 2HB GLN 29 3.522 1.720 0.473
206 HG2 GLN 29 1HG GLN 29 3.742 0.938 2.787
207 HG3 GLN 29 2HG GLN 29 3.953 2.614 3.315
208 HE21 GLN 29 1HE2 GLN 29 2.209 3.675 3.927
209 HE22 GLN 29 2HE2 GLN 29 0.576 3.243 3.562
210 H ALA 30 H ALA 30 6.039 3.414 -1.088
211 HA ALA 30 HA ALA 30 5.628 1.368 -2.973
212 HB1 ALA 30 1HB ALA 30 6.483 2.862 -4.591
213 HB2 ALA 30 2HB ALA 30 5.651 3.859 -3.396
214 HB3 ALA 30 3HB ALA 30 7.411 3.754 -3.386
215 H SER 31 H SER 31 8.377 2.233 -1.035
216 HA SER 31 HA SER 31 10.457 1.109 -2.499
217 HG SER 31 HG SER 31 10.593 1.128 1.550
218 HB2 SER 31 1HB SER 31 11.748 1.340 -0.602
219 HB3 SER 31 2HB SER 31 10.401 2.417 -0.193
220 H ARG 32 H ARG 32 7.874 -0.408 -0.798
221 HA ARG 32 HA ARG 32 9.086 -2.940 -0.373
222 HE ARG 32 HE ARG 32 8.496 -4.234 2.641
223 HB2 ARG 32 1HB ARG 32 6.145 -2.305 -0.694
224 HB3 ARG 32 2HB ARG 32 6.839 -3.741 0.070
225 HG2 ARG 32 1HG ARG 32 7.919 -1.429 1.350
226 HG3 ARG 32 2HG ARG 32 6.156 -1.279 1.269
227 HD2 ARG 32 1HD ARG 32 6.266 -2.494 3.187
228 HD3 ARG 32 2HD ARG 32 6.321 -3.834 2.035
229 HH11 ARG 32 1HH1 ARG 32 7.523 -1.108 3.822
230 HH12 ARG 32 2HH1 ARG 32 8.947 -0.881 4.780
231 HH21 ARG 32 1HH2 ARG 32 10.377 -3.947 3.899
232 HH22 ARG 32 2HH2 ARG 32 10.571 -2.497 4.823
233 H ILE 33 H ILE 33 7.914 -1.371 -3.154
234 HA ILE 33 HA ILE 33 8.200 -3.859 -4.682
235 HB ILE 33 HB ILE 33 6.055 -1.881 -5.399
236 HG12 ILE 33 1HG1 ILE 33 4.605 -3.890 -4.369
237 HG13 ILE 33 2HG1 ILE 33 6.020 -3.993 -3.307
238 HG21 ILE 33 1HG2 ILE 33 6.815 -4.653 -6.208
239 HG22 ILE 33 2HG2 ILE 33 5.144 -4.120 -6.373
240 HG23 ILE 33 3HG2 ILE 33 6.432 -3.255 -7.212
241 HD11 ILE 33 3HD1 ILE 33 5.691 -1.464 -2.973
242 HD12 ILE 33 1HD1 ILE 33 4.074 -1.751 -3.611
243 HD13 ILE 33 2HD1 ILE 33 4.605 -2.581 -2.150
244 H ASN 34 H ASN 34 9.603 -1.128 -4.155
245 HA ASN 34 HA ASN 34 9.989 -0.407 -6.985
246 HB2 ASN 34 1HB ASN 34 9.823 1.183 -4.505
247 HB3 ASN 34 2HB ASN 34 11.138 1.645 -5.592
248 HD21 ASN 34 1HD2 ASN 34 7.676 0.898 -5.638
249 HD22 ASN 34 2HD2 ASN 34 7.264 2.074 -6.836
250 H ARG 35 H ARG 35 11.509 -1.513 -4.077
251 HA ARG 35 HA ARG 35 14.194 -1.118 -5.119
252 HE ARG 35 HE ARG 35 15.023 -2.220 0.123
253 HB2 ARG 35 1HB ARG 35 14.988 -1.858 -3.009
254 HB3 ARG 35 2HB ARG 35 13.597 -0.812 -2.686
255 HG2 ARG 35 1HG ARG 35 12.248 -3.043 -2.672
256 HG3 ARG 35 2HG ARG 35 13.839 -3.769 -2.390
257 HD2 ARG 35 1HD ARG 35 13.043 -1.422 -0.726
258 HD3 ARG 35 2HD ARG 35 12.300 -2.991 -0.388
259 HH11 ARG 35 1HH1 ARG 35 12.850 -4.887 -0.416
260 HH12 ARG 35 2HH1 ARG 35 13.854 -6.039 0.399
261 HH21 ARG 35 1HH2 ARG 35 16.352 -3.727 1.199
262 HH22 ARG 35 2HH2 ARG 35 15.845 -5.379 1.319
263 H LYS 36 H LYS 36 11.934 -3.153 -5.989
264 HA LYS 36 HA LYS 36 11.883 -5.199 -6.980
265 HB2 LYS 36 1HB LYS 36 14.901 -5.145 -6.816
266 HB3 LYS 36 2HB LYS 36 13.899 -6.063 -7.954
267 HG2 LYS 36 1HG LYS 36 13.180 -4.031 -9.047
268 HG3 LYS 36 2HG LYS 36 14.056 -3.056 -7.855
269 HD2 LYS 36 1HD LYS 36 16.179 -3.910 -8.613
270 HD3 LYS 36 2HD LYS 36 15.366 -5.055 -9.694
271 HE2 LYS 36 1HE LYS 36 14.377 -2.452 -10.290
272 HE3 LYS 36 2HE LYS 36 16.142 -2.364 -10.211
273 HZ1 LYS 36 3HZ LYS 36 14.946 -4.586 -11.698
274 HZ2 LYS 36 1HZ LYS 36 16.389 -3.749 -11.983
275 HZ3 LYS 36 2HZ LYS 36 14.908 -3.048 -12.405
276 H LYS 37 H LYS 37 11.006 -5.848 -4.841
277 HA LYS 37 HA LYS 37 12.666 -7.162 -2.941
278 HB2 LYS 37 1HB LYS 37 10.351 -6.145 -2.565
279 HB3 LYS 37 2HB LYS 37 9.710 -7.626 -3.296
280 HG2 LYS 37 1HG LYS 37 10.196 -8.910 -1.495
281 HG3 LYS 37 2HG LYS 37 11.646 -7.977 -1.093
282 HD2 LYS 37 1HD LYS 37 10.315 -7.310 0.636
283 HD3 LYS 37 2HD LYS 37 9.837 -6.102 -0.569
284 HE2 LYS 37 1HE LYS 37 8.388 -8.690 0.037
285 HE3 LYS 37 2HE LYS 37 7.879 -7.062 0.512
286 HZ1 LYS 37 3HZ LYS 37 7.947 -8.247 -2.192
287 HZ2 LYS 37 1HZ LYS 37 7.925 -6.569 -1.978
288 HZ3 LYS 37 2HZ LYS 37 6.652 -7.514 -1.390
289 H LYS 38 H LYS 38 11.040 -8.156 -5.847
290 HA LYS 38 HA LYS 38 12.116 -10.868 -5.467
291 HB2 LYS 38 1HB LYS 38 9.625 -10.754 -5.079
292 HB3 LYS 38 2HB LYS 38 9.458 -10.282 -6.778
293 HG2 LYS 38 1HG LYS 38 9.034 -12.583 -6.759
294 HG3 LYS 38 2HG LYS 38 10.705 -12.430 -7.336
295 HD2 LYS 38 1HD LYS 38 11.376 -12.729 -4.861
296 HD3 LYS 38 2HD LYS 38 9.720 -13.324 -4.645
297 HE2 LYS 38 1HE LYS 38 10.177 -15.294 -5.614
298 HE3 LYS 38 2HE LYS 38 11.045 -14.515 -6.945
299 HZ1 LYS 38 3HZ LYS 38 12.978 -15.028 -6.020
300 HZ2 LYS 38 1HZ LYS 38 12.146 -15.957 -4.877
301 HZ3 LYS 38 2HZ LYS 38 12.538 -14.347 -4.536
302 H HIS 39 H HIS 39 13.714 -9.311 -6.757
303 HA HIS 39 HA HIS 39 14.802 -8.879 -8.712
304 HD1 HIS 39 1HD HIS 39 15.433 -8.896 -11.165
305 HD2 HIS 39 2HD HIS 39 16.378 -12.740 -9.902
306 HE1 HIS 39 1HE HIS 39 17.635 -9.440 -12.253
307 HE2 HIS 39 2HE HIS 39 18.212 -11.790 -11.481
308 HB2 HIS 39 1HB HIS 39 14.222 -11.514 -8.702
309 HB3 HIS 39 2HB HIS 39 13.371 -11.030 -10.173
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