Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | in_recoord | in_dress | stage | position | program | type |
|
|
2947 | 1cwx RC | 4669 | cing | recoord | dress | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 1H SER 1 HT1 SER 1 -32.246 4.402 3.497
2 2H SER 1 HT2 SER 1 -31.279 3.005 3.458
3 3H SER 1 HT3 SER 1 -31.494 3.933 2.051
4 HA SER 1 HA SER 1 -29.963 5.455 2.627
5 1HB SER 1 HB2 SER 1 -30.519 4.948 5.558
6 2HB SER 1 HB1 SER 1 -29.721 6.344 4.839
7 HG SER 1 HG SER 1 -31.801 6.625 3.686
8 H THR 2 HN THR 2 -27.772 5.394 3.939
9 HA THR 2 HA THR 2 -26.833 2.957 5.069
10 HB THR 2 HB THR 2 -27.255 2.046 2.808
11 HG1 THR 2 HG1 THR 2 -24.660 2.350 3.806
12 1HG2 THR 2 HG2 THR 2 -26.276 4.577 2.006
13 2HG2 THR 2 HG2 THR 2 -26.825 3.261 0.968
14 3HG2 THR 2 HG2 THR 2 -25.122 3.383 1.411
15 H ASN 3 HN ASN 3 -25.797 4.552 6.391
16 HA ASN 3 HA ASN 3 -23.405 5.783 5.088
17 1HB ASN 3 HB2 ASN 3 -25.508 7.276 5.937
18 2HB ASN 3 HB1 ASN 3 -24.563 7.194 7.428
19 1HD2 ASN 3 HD2 ASN 3 -24.003 9.509 7.185
20 2HD2 ASN 3 HD2 ASN 3 -22.841 9.996 6.048
21 HA PRO 4 HA PRO 4 -22.111 3.216 8.661
22 1HB PRO 4 HB2 PRO 4 -20.050 2.002 7.305
23 2HB PRO 4 HB1 PRO 4 -21.712 1.387 7.314
24 1HG PRO 4 HG2 PRO 4 -20.248 2.805 5.137
25 2HG PRO 4 HG1 PRO 4 -21.592 1.657 5.022
26 1HD PRO 4 HD2 PRO 4 -21.791 4.471 4.788
27 2HD PRO 4 HD1 PRO 4 -23.146 3.343 5.008
28 H LYS 5 HN LYS 5 -19.683 4.390 6.291
29 HA LYS 5 HA LYS 5 -18.667 6.579 7.614
30 1HB LYS 5 HB2 LYS 5 -18.139 5.618 9.643
31 2HB LYS 5 HB1 LYS 5 -17.836 4.034 8.946
32 1HG LYS 5 HG2 LYS 5 -15.666 4.646 8.214
33 2HG LYS 5 HG1 LYS 5 -16.007 6.368 8.380
34 1HD LYS 5 HD2 LYS 5 -16.395 4.966 10.900
35 2HD LYS 5 HD1 LYS 5 -14.759 4.736 10.280
36 1HE LYS 5 HE2 LYS 5 -14.265 7.008 10.353
37 2HE LYS 5 HE1 LYS 5 -15.958 7.485 10.226
38 1HZ LYS 5 HZ1 LYS 5 -15.019 5.998 12.587
39 2HZ LYS 5 HZ2 LYS 5 -16.341 7.054 12.439
40 3HZ LYS 5 HZ3 LYS 5 -14.758 7.671 12.486
41 HA PRO 6 HA PRO 6 -15.188 4.712 4.922
42 1HB PRO 6 HB2 PRO 6 -15.515 2.136 4.022
43 2HB PRO 6 HB1 PRO 6 -14.687 2.548 5.534
44 1HG PRO 6 HG2 PRO 6 -17.407 1.388 5.138
45 2HG PRO 6 HG1 PRO 6 -16.309 1.228 6.519
46 1HD PRO 6 HD2 PRO 6 -18.559 2.928 6.391
47 2HD PRO 6 HD1 PRO 6 -17.259 3.007 7.597
48 H GLN 7 HN GLN 7 -15.063 4.909 2.626
49 HA GLN 7 HA GLN 7 -17.694 5.136 1.276
50 1HB GLN 7 HB2 GLN 7 -14.909 6.036 0.483
51 2HB GLN 7 HB1 GLN 7 -16.341 6.259 -0.523
52 1HG GLN 7 HG2 GLN 7 -17.339 7.744 1.013
53 2HG GLN 7 HG1 GLN 7 -16.289 7.225 2.333
54 1HE2 GLN 7 HE2 GLN 7 -15.376 8.155 -1.020
55 2HE2 GLN 7 HE2 GLN 7 -14.367 9.436 -0.551
56 H ARG 8 HN ARG 8 -14.884 3.113 1.371
57 HA ARG 8 HA ARG 8 -15.479 1.875 -1.243
58 1HB ARG 8 HB2 ARG 8 -13.386 1.317 0.877
59 2HB ARG 8 HB1 ARG 8 -13.544 0.374 -0.605
60 1HG ARG 8 HG2 ARG 8 -12.618 2.006 -1.882
61 2HG ARG 8 HG1 ARG 8 -13.503 3.283 -1.048
62 1HD ARG 8 HD2 ARG 8 -11.668 2.249 0.836
63 2HD ARG 8 HD1 ARG 8 -10.769 2.440 -0.670
64 HE ARG 8 HE ARG 8 -11.566 4.587 1.008
65 1HH1 ARG 8 HH1 ARG 8 -9.595 5.054 -1.097
66 2HH1 ARG 8 HH1 ARG 8 -10.455 6.017 -2.252
67 1HH2 ARG 8 HH2 ARG 8 -13.584 5.205 -0.996
68 2HH2 ARG 8 HH2 ARG 8 -12.713 6.103 -2.194
69 H LYS 9 HN LYS 9 -16.238 -0.275 -1.464
70 HA LYS 9 HA LYS 9 -16.669 -2.104 0.670
71 1HB LYS 9 HB2 LYS 9 -18.258 -0.265 1.385
72 2HB LYS 9 HB1 LYS 9 -19.181 -0.586 -0.084
73 1HG LYS 9 HG2 LYS 9 -20.295 -2.006 1.350
74 2HG LYS 9 HG1 LYS 9 -19.014 -3.099 0.824
75 1HD LYS 9 HD2 LYS 9 -17.656 -2.169 2.811
76 2HD LYS 9 HD1 LYS 9 -19.193 -1.528 3.395
77 1HE LYS 9 HE2 LYS 9 -18.738 -4.438 2.680
78 2HE LYS 9 HE1 LYS 9 -18.632 -3.798 4.320
79 1HZ LYS 9 HZ1 LYS 9 -21.028 -3.001 2.969
80 2HZ LYS 9 HZ2 LYS 9 -20.832 -3.720 4.496
81 3HZ LYS 9 HZ3 LYS 9 -20.893 -4.687 3.100
82 H THR 10 HN THR 10 -18.306 -0.845 -2.252
83 HA THR 10 HA THR 10 -18.914 -3.585 -3.139
84 HB THR 10 HB THR 10 -19.477 -1.929 -5.270
85 HG1 THR 10 HG1 THR 10 -18.938 -0.084 -4.144
86 1HG2 THR 10 HG2 THR 10 -21.438 -2.132 -3.017
87 2HG2 THR 10 HG2 THR 10 -20.866 -3.614 -3.781
88 3HG2 THR 10 HG2 THR 10 -21.688 -2.386 -4.744
89 H LYS 11 HN LYS 11 -17.606 -0.970 -5.141
90 HA LYS 11 HA LYS 11 -16.173 -2.462 -6.955
91 1HB LYS 11 HB2 LYS 11 -15.880 0.259 -5.841
92 2HB LYS 11 HB1 LYS 11 -14.422 -0.393 -6.589
93 1HG LYS 11 HG2 LYS 11 -15.950 0.853 -8.177
94 2HG LYS 11 HG1 LYS 11 -15.576 -0.800 -8.664
95 1HD LYS 11 HD2 LYS 11 -17.704 -1.578 -8.165
96 2HD LYS 11 HD1 LYS 11 -17.993 -0.322 -6.961
97 1HE LYS 11 HE2 LYS 11 -17.563 0.740 -9.664
98 2HE LYS 11 HE1 LYS 11 -18.981 -0.301 -9.539
99 1HZ LYS 11 HZ1 LYS 11 -18.365 2.102 -7.915
100 2HZ LYS 11 HZ2 LYS 11 -19.623 1.021 -7.548
101 3HZ LYS 11 HZ3 LYS 11 -19.649 1.896 -9.004
102 H ARG 12 HN ARG 12 -14.624 -1.095 -4.017
103 HA ARG 12 HA ARG 12 -12.850 -1.935 -2.729
104 1HB ARG 12 HB2 ARG 12 -14.456 -4.168 -3.420
105 2HB ARG 12 HB1 ARG 12 -12.780 -4.659 -3.667
106 1HG ARG 12 HG2 ARG 12 -12.186 -4.119 -1.420
107 2HG ARG 12 HG1 ARG 12 -13.695 -3.245 -1.156
108 1HD ARG 12 HD2 ARG 12 -14.979 -5.274 -1.217
109 2HD ARG 12 HD1 ARG 12 -13.593 -6.204 -1.788
110 HE ARG 12 HE ARG 12 -13.100 -4.929 0.784
111 1HH1 ARG 12 HH2 ARG 12 -12.114 -7.647 -0.164
112 2HH1 ARG 12 HH2 ARG 12 -13.016 -8.711 0.863
113 1HH2 ARG 12 HH1 ARG 12 -15.299 -6.284 1.820
114 2HH2 ARG 12 HH1 ARG 12 -14.818 -7.940 1.986
115 H ASN 13 HN ASN 13 -10.774 -3.558 -3.183
116 HA ASN 13 HA ASN 13 -9.078 -2.261 -4.950
117 1HB ASN 13 HB2 ASN 13 -9.084 -5.229 -4.317
118 2HB ASN 13 HB1 ASN 13 -7.718 -4.331 -4.982
119 1HD2 ASN 13 HD2 ASN 13 -7.997 -5.715 -2.292
120 2HD2 ASN 13 HD2 ASN 13 -7.655 -4.510 -1.146
121 H THR 14 HN THR 14 -8.143 -3.209 -7.060
122 HA THR 14 HA THR 14 -9.771 -4.910 -8.707
123 HB THR 14 HB THR 14 -10.035 -2.501 -10.166
124 HG1 THR 14 HG1 THR 14 -10.679 -1.068 -8.773
125 1HG2 THR 14 HG2 THR 14 -12.185 -3.945 -8.604
126 2HG2 THR 14 HG2 THR 14 -11.494 -4.578 -10.098
127 3HG2 THR 14 HG2 THR 14 -12.369 -3.046 -10.111
128 H ASN 15 HN ASN 15 -7.435 -2.234 -8.611
129 HA ASN 15 HA ASN 15 -5.985 -3.585 -10.855
130 1HB ASN 15 HB2 ASN 15 -4.946 -1.192 -11.092
131 2HB ASN 15 HB1 ASN 15 -6.558 -1.492 -11.741
132 1HD2 ASN 15 HD2 ASN 15 -4.820 -0.038 -8.986
133 2HD2 ASN 15 HD2 ASN 15 -6.122 0.913 -8.456
134 H ARG 16 HN ARG 16 -3.672 -3.703 -10.648
135 HA ARG 16 HA ARG 16 -2.734 -3.925 -7.910
136 1HB ARG 16 HB2 ARG 16 -1.945 -4.769 -10.593
137 2HB ARG 16 HB1 ARG 16 -0.581 -4.204 -9.641
138 1HG ARG 16 HG2 ARG 16 -2.238 -5.786 -7.942
139 2HG ARG 16 HG1 ARG 16 -1.967 -6.690 -9.432
140 1HD ARG 16 HD2 ARG 16 0.537 -5.838 -9.051
141 2HD ARG 16 HD1 ARG 16 0.002 -5.797 -7.371
142 HE ARG 16 HE ARG 16 0.583 -8.180 -8.872
143 1HH1 ARG 16 HH2 ARG 16 -2.476 -8.006 -8.190
144 2HH1 ARG 16 HH2 ARG 16 -2.507 -8.984 -6.760
145 1HH2 ARG 16 HH1 ARG 16 0.934 -8.930 -6.328
146 2HH2 ARG 16 HH1 ARG 16 -0.577 -9.507 -5.707
147 H ARG 17 HN ARG 17 -0.349 -3.069 -7.739
148 HA ARG 17 HA ARG 17 1.168 -1.172 -8.328
149 1HB ARG 17 HB2 ARG 17 -0.502 0.045 -9.682
150 2HB ARG 17 HB1 ARG 17 -1.399 0.445 -8.221
151 1HG ARG 17 HG2 ARG 17 0.036 2.325 -8.839
152 2HG ARG 17 HG1 ARG 17 0.609 1.610 -7.332
153 1HD ARG 17 HD2 ARG 17 2.506 2.030 -8.826
154 2HD ARG 17 HD1 ARG 17 2.282 0.294 -8.615
155 HE ARG 17 HE ARG 17 0.909 1.414 -10.953
156 1HH1 ARG 17 HH1 ARG 17 4.133 1.414 -10.417
157 2HH1 ARG 17 HH1 ARG 17 4.549 0.200 -11.580
158 1HH2 ARG 17 HH2 ARG 17 1.267 -0.775 -12.128
159 2HH2 ARG 17 HH2 ARG 17 2.926 -1.039 -12.550
160 HA PRO 18 HA PRO 18 -0.144 0.212 -3.963
161 1HB PRO 18 HB2 PRO 18 -2.500 -0.755 -2.969
162 2HB PRO 18 HB1 PRO 18 -2.379 0.743 -3.879
163 1HG PRO 18 HG2 PRO 18 -3.497 -1.854 -4.746
164 2HG PRO 18 HG1 PRO 18 -3.857 -0.227 -5.344
165 1HD PRO 18 HD2 PRO 18 -2.160 -2.156 -6.565
166 2HD PRO 18 HD1 PRO 18 -2.363 -0.462 -7.054
167 H GLN 19 HN GLN 19 -0.993 -2.829 -5.140
168 HA GLN 19 HA GLN 19 -0.376 -4.360 -2.745
169 1HB GLN 19 HB2 GLN 19 -1.571 -4.735 -5.325
170 2HB GLN 19 HB1 GLN 19 -0.524 -6.047 -4.846
171 1HG GLN 19 HG2 GLN 19 -2.008 -6.797 -3.332
172 2HG GLN 19 HG1 GLN 19 -2.132 -5.188 -2.621
173 1HE2 GLN 19 HE2 GLN 19 -3.653 -3.638 -3.757
174 2HE2 GLN 19 HE2 GLN 19 -5.009 -4.271 -4.558
175 H ASP 20 HN ASP 20 1.624 -2.866 -3.638
176 HA ASP 20 HA ASP 20 3.779 -4.818 -4.019
177 1HB ASP 20 HB2 ASP 20 3.347 -4.293 -6.281
178 2HB ASP 20 HB1 ASP 20 3.155 -2.593 -5.958
179 H VAL 21 HN VAL 21 2.851 -1.399 -3.816
180 HA VAL 21 HA VAL 21 5.437 -0.759 -2.795
181 HB VAL 21 HB VAL 21 2.993 1.002 -2.583
182 1HG1 VAL 21 HG1 VAL 21 4.517 2.382 -1.649
183 2HG1 VAL 21 HG1 VAL 21 5.274 2.484 -3.238
184 3HG1 VAL 21 HG1 VAL 21 5.844 1.298 -2.064
185 1HG2 VAL 21 HG2 VAL 21 2.900 0.916 -4.844
186 2HG2 VAL 21 HG2 VAL 21 4.419 0.025 -4.942
187 3HG2 VAL 21 HG2 VAL 21 4.435 1.785 -4.836
188 H LYS 22 HN LYS 22 3.101 -2.439 -1.428
189 HA LYS 22 HA LYS 22 3.446 -1.335 1.252
190 1HB LYS 22 HB2 LYS 22 1.658 -3.047 1.775
191 2HB LYS 22 HB1 LYS 22 1.149 -1.800 0.625
192 1HG LYS 22 HG2 LYS 22 1.205 -3.226 -1.164
193 2HG LYS 22 HG1 LYS 22 2.538 -4.148 -0.478
194 1HD LYS 22 HD2 LYS 22 0.343 -5.386 -0.576
195 2HD LYS 22 HD1 LYS 22 1.112 -5.326 1.011
196 1HE LYS 22 HE2 LYS 22 -0.455 -3.845 1.866
197 2HE LYS 22 HE1 LYS 22 -0.820 -3.157 0.284
198 1HZ LYS 22 HZ1 LYS 22 -2.640 -4.520 1.051
199 2HZ LYS 22 HZ2 LYS 22 -1.607 -5.855 1.243
200 3HZ LYS 22 HZ3 LYS 22 -1.922 -5.237 -0.308
201 H PHE 23 HN PHE 23 5.032 -3.166 -0.769
202 HA PHE 23 HA PHE 23 6.324 -5.063 -0.747
203 1HB PHE 23 HB2 PHE 23 6.748 -3.953 1.970
204 2HB PHE 23 HB1 PHE 23 7.870 -4.983 1.080
205 HD1 PHE 23 HD1 PHE 23 9.129 -4.172 -0.795
206 HD2 PHE 23 HD2 PHE 23 6.121 -1.733 1.050
207 HE1 PHE 23 HE1 PHE 23 9.773 -2.280 -2.247
208 HE2 PHE 23 HE2 PHE 23 6.771 0.168 -0.381
209 HZ PHE 23 HZ PHE 23 8.611 -0.093 -2.035
210 HA PRO 24 HA PRO 24 2.907 -7.302 1.187
211 1HB PRO 24 HB2 PRO 24 2.127 -8.323 -1.228
212 2HB PRO 24 HB1 PRO 24 1.592 -6.745 -0.624
213 1HG PRO 24 HG2 PRO 24 3.583 -7.372 -2.752
214 2HG PRO 24 HG1 PRO 24 2.512 -5.969 -2.579
215 1HD PRO 24 HD2 PRO 24 5.244 -6.027 -1.898
216 2HD PRO 24 HD1 PRO 24 4.079 -4.799 -1.381
217 H GLY 25 HN GLY 25 2.850 -9.598 1.552
218 1HA GLY 25 HA2 GLY 25 3.816 -11.728 1.780
219 2HA GLY 25 HA1 GLY 25 4.287 -11.555 0.087
220 H GLY 26 HN GLY 26 5.252 -10.347 3.313
221 1HA GLY 26 HA2 GLY 26 7.499 -10.611 4.193
222 2HA GLY 26 HA1 GLY 26 8.085 -10.827 2.542
223 H GLY 27 HN GLY 27 6.425 -8.338 4.521
224 1HA GLY 27 HA2 GLY 27 8.254 -6.306 4.323
225 2HA GLY 27 HA1 GLY 27 7.291 -6.180 2.842
226 H GLN 28 HN GLN 28 7.291 -5.676 6.242
227 HA GLN 28 HA GLN 28 4.632 -5.636 6.966
228 1HB GLN 28 HB2 GLN 28 6.493 -3.382 7.692
229 2HB GLN 28 HB1 GLN 28 5.271 -4.164 8.668
230 1HG GLN 28 HG2 GLN 28 6.951 -6.255 7.984
231 2HG GLN 28 HG1 GLN 28 8.051 -4.911 8.292
232 1HE2 GLN 28 HE2 GLN 28 6.906 -3.526 10.360
233 2HE2 GLN 28 HE2 GLN 28 6.680 -4.522 11.716
234 H ILE 29 HN ILE 29 6.026 -3.827 4.443
235 HA ILE 29 HA ILE 29 5.013 -2.365 2.926
236 HB ILE 29 HB ILE 29 2.750 -2.073 2.872
237 1HG1 ILE 29 HG1 ILE 29 1.486 -1.938 5.248
238 2HG1 ILE 29 HG1 ILE 29 3.078 -1.367 5.749
239 1HG2 ILE 29 HG2 ILE 29 3.442 -4.500 4.001
240 2HG2 ILE 29 HG2 ILE 29 1.873 -4.096 3.313
241 3HG2 ILE 29 HG2 ILE 29 2.147 -3.926 5.046
242 1HD1 ILE 29 HD1 ILE 29 1.127 0.200 4.581
243 2HD1 ILE 29 HD1 ILE 29 2.182 -0.185 3.221
244 3HD1 ILE 29 HD1 ILE 29 2.844 0.597 4.657
245 H VAL 30 HN VAL 30 5.877 -1.787 6.073
246 HA VAL 30 HA VAL 30 5.588 1.146 5.691
247 HB VAL 30 HB VAL 30 6.249 -0.452 8.180
248 1HG1 VAL 30 HG1 VAL 30 7.165 1.598 8.699
249 2HG1 VAL 30 HG1 VAL 30 5.485 1.959 9.094
250 3HG1 VAL 30 HG1 VAL 30 6.153 2.459 7.540
251 1HG2 VAL 30 HG2 VAL 30 3.710 0.806 7.129
252 2HG2 VAL 30 HG2 VAL 30 3.933 0.475 8.847
253 3HG2 VAL 30 HG2 VAL 30 3.961 -0.850 7.683
254 H GLY 31 HN GLY 31 7.684 -1.003 4.718
255 1HA GLY 31 HA2 GLY 31 9.994 0.680 5.488
256 2HA GLY 31 HA1 GLY 31 10.159 -1.055 5.513
257 H GLY 32 HN GLY 32 8.440 -1.150 2.949
258 1HA GLY 32 HA2 GLY 32 10.750 -0.747 1.242
259 2HA GLY 32 HA1 GLY 32 9.261 -1.438 0.677
260 H VAL 33 HN VAL 33 7.914 0.915 2.010
261 HA VAL 33 HA VAL 33 7.999 2.758 -0.264
262 HB VAL 33 HB VAL 33 6.611 2.775 2.430
263 1HG1 VAL 33 HG1 VAL 33 7.229 5.091 1.929
264 2HG1 VAL 33 HG1 VAL 33 5.497 4.878 1.674
265 3HG1 VAL 33 HG1 VAL 33 6.591 4.933 0.292
266 1HG2 VAL 33 HG2 VAL 33 4.826 3.151 0.271
267 2HG2 VAL 33 HG2 VAL 33 5.038 1.689 1.233
268 3HG2 VAL 33 HG2 VAL 33 5.960 1.906 -0.255
269 H TYR 34 HN TYR 34 9.723 2.096 2.441
270 HA TYR 34 HA TYR 34 10.930 4.767 2.807
271 1HB TYR 34 HB2 TYR 34 11.166 2.235 4.476
272 2HB TYR 34 HB1 TYR 34 11.573 3.876 4.978
273 HD1 TYR 34 HD1 TYR 34 8.770 1.686 3.900
274 HD2 TYR 34 HD2 TYR 34 9.889 5.406 5.710
275 HE1 TYR 34 HE1 TYR 34 6.413 2.131 4.395
276 HE2 TYR 34 HE2 TYR 34 7.522 5.847 6.237
277 HH TYR 34 HH TYR 34 5.025 4.461 4.829
278 H LEU 35 HN LEU 35 11.284 1.751 1.351
279 HA LEU 35 HA LEU 35 14.227 1.779 1.230
280 1HB LEU 35 HB2 LEU 35 12.024 -0.073 0.278
281 2HB LEU 35 HB1 LEU 35 13.692 -0.293 -0.248
282 HG LEU 35 HG LEU 35 13.095 0.076 2.655
283 1HD1 LEU 35 HD1 LEU 35 12.231 -2.168 0.991
284 2HD1 LEU 35 HD1 LEU 35 11.832 -1.806 2.670
285 3HD1 LEU 35 HD1 LEU 35 13.313 -2.682 2.285
286 1HD2 LEU 35 HD2 LEU 35 15.370 -0.519 1.016
287 2HD2 LEU 35 HD2 LEU 35 15.073 -1.900 2.072
288 3HD2 LEU 35 HD2 LEU 35 15.314 -0.296 2.765
289 H LEU 36 HN LEU 36 11.860 3.483 -0.048
290 HA LEU 36 HA LEU 36 12.602 3.382 -2.879
291 1HB LEU 36 HB2 LEU 36 10.658 5.295 -1.585
292 2HB LEU 36 HB1 LEU 36 10.712 4.781 -3.266
293 HG LEU 36 HG LEU 36 9.909 3.165 -0.854
294 1HD1 LEU 36 HD1 LEU 36 7.866 2.816 -2.185
295 2HD1 LEU 36 HD1 LEU 36 8.561 3.755 -3.506
296 3HD1 LEU 36 HD1 LEU 36 8.181 4.538 -1.972
297 1HD2 LEU 36 HD2 LEU 36 11.146 1.532 -1.948
298 2HD2 LEU 36 HD2 LEU 36 10.944 2.291 -3.526
299 3HD2 LEU 36 HD2 LEU 36 9.616 1.378 -2.810
300 HA PRO 37 HA PRO 37 13.983 7.834 -1.819
301 1HB PRO 37 HB2 PRO 37 14.239 8.466 0.843
302 2HB PRO 37 HB1 PRO 37 12.752 8.717 -0.088
303 1HG PRO 37 HG2 PRO 37 13.354 6.636 1.957
304 2HG PRO 37 HG1 PRO 37 11.789 7.301 1.459
305 1HD PRO 37 HD2 PRO 37 12.884 4.808 0.656
306 2HD PRO 37 HD1 PRO 37 11.461 5.598 -0.038
307 H ARG 38 HN ARG 38 15.111 5.877 0.981
308 HA ARG 38 HA ARG 38 17.884 6.680 0.428
309 1HB ARG 38 HB2 ARG 38 18.422 5.653 2.504
310 2HB ARG 38 HB1 ARG 38 16.842 6.396 2.753
311 1HG ARG 38 HG2 ARG 38 15.752 4.221 2.295
312 2HG ARG 38 HG1 ARG 38 17.338 3.479 2.085
313 1HD ARG 38 HD2 ARG 38 16.363 3.151 4.382
314 2HD ARG 38 HD1 ARG 38 17.936 3.949 4.382
315 HE ARG 38 HE ARG 38 15.349 5.418 4.712
316 1HH1 ARG 38 HH1 ARG 38 17.183 4.635 7.045
317 2HH1 ARG 38 HH1 ARG 38 18.030 6.124 7.304
318 1HH2 ARG 38 HH2 ARG 38 17.103 7.489 4.255
319 2HH2 ARG 38 HH2 ARG 38 17.985 7.739 5.725
320 H ARG 39 HN ARG 39 16.422 4.956 -1.539
321 HA ARG 39 HA ARG 39 17.181 2.253 -1.428
322 1HB ARG 39 HB2 ARG 39 15.907 3.756 -3.272
323 2HB ARG 39 HB1 ARG 39 17.482 3.616 -4.055
324 1HG ARG 39 HG2 ARG 39 16.369 1.119 -2.892
325 2HG ARG 39 HG1 ARG 39 15.551 1.747 -4.323
326 1HD ARG 39 HD2 ARG 39 17.179 0.566 -5.418
327 2HD ARG 39 HD1 ARG 39 18.126 2.022 -5.111
328 HE ARG 39 HE ARG 39 19.142 0.862 -3.185
329 1HH1 ARG 39 HH1 ARG 39 16.607 -1.121 -3.727
330 2HH1 ARG 39 HH1 ARG 39 17.510 -2.582 -3.948
331 1HH2 ARG 39 HH2 ARG 39 20.573 -0.970 -4.156
332 2HH2 ARG 39 HH2 ARG 39 19.756 -2.496 -4.191
333 H GLY 40 HN GLY 40 19.260 1.976 -0.540
334 1HA GLY 40 HA2 GLY 40 21.572 1.585 -0.775
335 2HA GLY 40 HA1 GLY 40 21.469 2.212 -2.421
336 HA PRO 41 HA PRO 41 22.015 6.008 0.452
337 1HB PRO 41 HB2 PRO 41 22.418 5.477 3.118
338 2HB PRO 41 HB1 PRO 41 20.817 5.736 2.403
339 1HG PRO 41 HG2 PRO 41 22.071 3.194 3.317
340 2HG PRO 41 HG1 PRO 41 20.356 3.607 3.167
341 1HD PRO 41 HD2 PRO 41 21.872 2.036 1.347
342 2HD PRO 41 HD1 PRO 41 20.238 2.678 1.075
343 H ARG 42 HN ARG 42 23.888 3.196 0.401
344 HA ARG 42 HA ARG 42 26.336 4.717 1.209
345 1HB ARG 42 HB2 ARG 42 27.326 2.363 1.491
346 2HB ARG 42 HB1 ARG 42 26.133 2.863 2.691
347 1HG ARG 42 HG2 ARG 42 24.367 1.690 1.397
348 2HG ARG 42 HG1 ARG 42 25.593 1.143 0.253
349 1HD ARG 42 HD2 ARG 42 25.522 0.506 3.217
350 2HD ARG 42 HD1 ARG 42 25.135 -0.613 1.909
351 HE ARG 42 HE ARG 42 27.786 0.502 1.586
352 1HH1 ARG 42 HH2 ARG 42 26.559 -2.394 1.367
353 2HH1 ARG 42 HH2 ARG 42 27.573 -3.214 2.506
354 1HH2 ARG 42 HH1 ARG 42 28.821 -0.295 3.899
355 2HH2 ARG 42 HH1 ARG 42 28.854 -2.026 3.939
356 H LEU 43 HN LEU 43 27.083 5.505 -0.741
357 HA LEU 43 HA LEU 43 27.586 3.473 -2.876
358 1HB LEU 43 HB2 LEU 43 26.760 6.365 -3.281
359 2HB LEU 43 HB1 LEU 43 27.138 5.213 -4.562
360 HG LEU 43 HG LEU 43 25.224 3.989 -2.835
361 1HD1 LEU 43 HD1 LEU 43 23.457 5.902 -3.675
362 2HD1 LEU 43 HD1 LEU 43 24.854 6.891 -3.251
363 3HD1 LEU 43 HD1 LEU 43 24.129 5.825 -2.047
364 1HD2 LEU 43 HD2 LEU 43 23.870 4.603 -5.121
365 2HD2 LEU 43 HD2 LEU 43 25.008 3.262 -4.991
366 3HD2 LEU 43 HD2 LEU 43 25.535 4.804 -5.667
367 H GLY 44 HN GLY 44 29.195 4.886 -0.632
368 1HA GLY 44 HA2 GLY 44 31.737 4.819 -1.522
369 2HA GLY 44 HA1 GLY 44 31.207 6.349 -2.223
Start of MODEL 2
1 1H SER 1 HT1 SER 1 -23.776 -8.924 6.231
2 2H SER 1 HT2 SER 1 -22.902 -7.917 7.282
3 3H SER 1 HT3 SER 1 -22.098 -8.767 6.050
4 HA SER 1 HA SER 1 -24.215 -7.090 5.068
5 1HB SER 1 HB2 SER 1 -23.003 -5.927 7.155
6 2HB SER 1 HB1 SER 1 -21.784 -5.586 5.930
7 HG SER 1 HG SER 1 -24.550 -5.089 5.556
8 H THR 2 HN THR 2 -23.485 -6.175 3.028
9 HA THR 2 HA THR 2 -22.289 -6.273 1.013
10 HB THR 2 HB THR 2 -20.017 -6.702 2.973
11 HG1 THR 2 HG1 THR 2 -20.668 -4.437 1.416
12 1HG2 THR 2 HG2 THR 2 -20.109 -6.915 0.073
13 2HG2 THR 2 HG2 THR 2 -18.785 -7.286 1.179
14 3HG2 THR 2 HG2 THR 2 -19.012 -5.637 0.596
15 H ASN 3 HN ASN 3 -20.085 -8.536 2.559
16 HA ASN 3 HA ASN 3 -21.495 -10.914 1.651
17 1HB ASN 3 HB2 ASN 3 -20.458 -9.830 -0.460
18 2HB ASN 3 HB1 ASN 3 -18.903 -10.331 0.216
19 1HD2 ASN 3 HD2 ASN 3 -18.256 -12.390 -0.410
20 2HD2 ASN 3 HD2 ASN 3 -19.298 -13.636 -0.901
21 HA PRO 4 HA PRO 4 -18.416 -11.590 4.974
22 1HB PRO 4 HB2 PRO 4 -20.176 -12.925 6.609
23 2HB PRO 4 HB1 PRO 4 -19.984 -11.164 6.610
24 1HG PRO 4 HG2 PRO 4 -22.200 -12.810 5.482
25 2HG PRO 4 HG1 PRO 4 -22.230 -11.137 6.065
26 1HD PRO 4 HD2 PRO 4 -22.146 -11.950 3.352
27 2HD PRO 4 HD1 PRO 4 -21.852 -10.306 3.962
28 H LYS 5 HN LYS 5 -17.817 -13.085 2.975
29 HA LYS 5 HA LYS 5 -18.833 -15.818 3.100
30 1HB LYS 5 HB2 LYS 5 -17.334 -14.255 1.255
31 2HB LYS 5 HB1 LYS 5 -16.353 -15.660 1.673
32 1HG LYS 5 HG2 LYS 5 -18.791 -16.833 1.381
33 2HG LYS 5 HG1 LYS 5 -18.925 -15.521 0.210
34 1HD LYS 5 HD2 LYS 5 -17.641 -16.677 -1.228
35 2HD LYS 5 HD1 LYS 5 -16.321 -16.657 -0.057
36 1HE LYS 5 HE2 LYS 5 -16.578 -18.873 0.224
37 2HE LYS 5 HE1 LYS 5 -18.196 -18.577 0.862
38 1HZ LYS 5 HZ1 LYS 5 -19.030 -18.576 -1.425
39 2HZ LYS 5 HZ2 LYS 5 -18.302 -20.057 -1.019
40 3HZ LYS 5 HZ3 LYS 5 -17.474 -18.940 -1.997
41 HA PRO 6 HA PRO 6 -14.522 -16.654 4.968
42 1HB PRO 6 HB2 PRO 6 -12.928 -14.485 5.528
43 2HB PRO 6 HB1 PRO 6 -12.910 -15.340 3.975
44 1HG PRO 6 HG2 PRO 6 -14.082 -12.682 4.640
45 2HG PRO 6 HG1 PRO 6 -13.497 -13.292 3.084
46 1HD PRO 6 HD2 PRO 6 -16.207 -13.101 3.887
47 2HD PRO 6 HD1 PRO 6 -15.593 -13.983 2.472
48 H GLN 7 HN GLN 7 -13.772 -16.657 7.231
49 HA GLN 7 HA GLN 7 -15.682 -15.240 9.028
50 1HB GLN 7 HB2 GLN 7 -14.039 -17.753 9.287
51 2HB GLN 7 HB1 GLN 7 -14.654 -16.935 10.722
52 1HG GLN 7 HG2 GLN 7 -16.952 -17.030 9.730
53 2HG GLN 7 HG1 GLN 7 -16.295 -17.986 8.401
54 1HE2 GLN 7 HE2 GLN 7 -18.277 -18.902 10.415
55 2HE2 GLN 7 HE2 GLN 7 -17.563 -20.217 11.216
56 H ARG 8 HN ARG 8 -14.839 -13.345 9.770
57 HA ARG 8 HA ARG 8 -13.269 -11.795 10.581
58 1HB ARG 8 HB2 ARG 8 -12.794 -14.360 11.960
59 2HB ARG 8 HB1 ARG 8 -11.422 -13.252 11.994
60 1HG ARG 8 HG2 ARG 8 -13.153 -11.450 12.676
61 2HG ARG 8 HG1 ARG 8 -14.215 -12.811 13.041
62 1HD ARG 8 HD2 ARG 8 -11.405 -12.642 14.138
63 2HD ARG 8 HD1 ARG 8 -12.779 -11.921 14.978
64 HE ARG 8 HE ARG 8 -12.732 -14.832 14.297
65 1HH1 ARG 8 HH1 ARG 8 -15.121 -13.489 15.607
66 2HH1 ARG 8 HH1 ARG 8 -14.860 -13.880 17.274
67 1HH2 ARG 8 HH2 ARG 8 -11.542 -14.780 16.818
68 2HH2 ARG 8 HH2 ARG 8 -12.833 -14.610 17.959
69 H LYS 9 HN LYS 9 -12.643 -11.841 8.144
70 HA LYS 9 HA LYS 9 -9.777 -11.747 7.961
71 1HB LYS 9 HB2 LYS 9 -9.812 -14.139 7.842
72 2HB LYS 9 HB1 LYS 9 -11.185 -14.130 6.736
73 1HG LYS 9 HG2 LYS 9 -9.881 -13.715 4.918
74 2HG LYS 9 HG1 LYS 9 -8.838 -12.600 5.802
75 1HD LYS 9 HD2 LYS 9 -7.701 -14.495 6.880
76 2HD LYS 9 HD1 LYS 9 -8.758 -15.623 6.030
77 1HE LYS 9 HE2 LYS 9 -7.651 -15.374 4.051
78 2HE LYS 9 HE1 LYS 9 -7.361 -13.655 4.315
79 1HZ LYS 9 HZ1 LYS 9 -5.971 -15.414 6.138
80 2HZ LYS 9 HZ2 LYS 9 -5.405 -14.050 5.296
81 3HZ LYS 9 HZ3 LYS 9 -5.485 -15.559 4.519
82 H THR 10 HN THR 10 -9.128 -10.758 5.968
83 HA THR 10 HA THR 10 -11.136 -10.341 3.865
84 HB THR 10 HB THR 10 -9.988 -7.842 5.064
85 HG1 THR 10 HG1 THR 10 -12.279 -7.963 6.100
86 1HG2 THR 10 HG2 THR 10 -12.443 -8.610 3.480
87 2HG2 THR 10 HG2 THR 10 -11.122 -7.550 2.989
88 3HG2 THR 10 HG2 THR 10 -12.262 -7.024 4.229
89 H LYS 11 HN LYS 11 -10.170 -9.691 1.913
90 HA LYS 11 HA LYS 11 -7.501 -8.642 1.720
91 1HB LYS 11 HB2 LYS 11 -6.960 -10.958 2.483
92 2HB LYS 11 HB1 LYS 11 -7.796 -11.588 1.063
93 1HG LYS 11 HG2 LYS 11 -6.244 -10.367 -0.408
94 2HG LYS 11 HG1 LYS 11 -5.411 -9.715 1.003
95 1HD LYS 11 HD2 LYS 11 -4.787 -11.976 1.713
96 2HD LYS 11 HD1 LYS 11 -5.673 -12.666 0.353
97 1HE LYS 11 HE2 LYS 11 -4.190 -11.500 -1.225
98 2HE LYS 11 HE1 LYS 11 -3.311 -10.777 0.124
99 1HZ LYS 11 HZ1 LYS 11 -2.048 -12.578 0.151
100 2HZ LYS 11 HZ2 LYS 11 -2.999 -13.339 -1.032
101 3HZ LYS 11 HZ3 LYS 11 -3.396 -13.497 0.612
102 H ARG 12 HN ARG 12 -9.704 -10.887 0.002
103 HA ARG 12 HA ARG 12 -10.613 -10.745 -2.157
104 1HB ARG 12 HB2 ARG 12 -9.917 -7.816 -1.773
105 2HB ARG 12 HB1 ARG 12 -10.916 -8.450 -3.081
106 1HG ARG 12 HG2 ARG 12 -11.513 -8.668 -0.115
107 2HG ARG 12 HG1 ARG 12 -12.346 -7.624 -1.269
108 1HD ARG 12 HD2 ARG 12 -12.565 -10.046 -2.512
109 2HD ARG 12 HD1 ARG 12 -12.622 -10.532 -0.817
110 HE ARG 12 HE ARG 12 -14.377 -8.290 -1.296
111 1HH1 ARG 12 HH2 ARG 12 -14.566 -11.174 0.080
112 2HH1 ARG 12 HH2 ARG 12 -16.001 -11.739 -0.709
113 1HH2 ARG 12 HH1 ARG 12 -15.992 -9.232 -3.104
114 2HH2 ARG 12 HH1 ARG 12 -16.807 -10.641 -2.510
115 H ASN 13 HN ASN 13 -9.651 -11.380 -4.034
116 HA ASN 13 HA ASN 13 -7.022 -10.151 -4.746
117 1HB ASN 13 HB2 ASN 13 -6.582 -12.592 -5.682
118 2HB ASN 13 HB1 ASN 13 -6.256 -12.212 -3.991
119 1HD2 ASN 13 HD2 ASN 13 -6.993 -13.912 -2.715
120 2HD2 ASN 13 HD2 ASN 13 -8.456 -14.743 -2.945
121 H THR 14 HN THR 14 -6.782 -9.713 -6.931
122 HA THR 14 HA THR 14 -8.352 -10.979 -8.995
123 HB THR 14 HB THR 14 -10.091 -9.526 -7.890
124 HG1 THR 14 HG1 THR 14 -10.909 -9.155 -9.803
125 1HG2 THR 14 HG2 THR 14 -8.371 -7.275 -8.966
126 2HG2 THR 14 HG2 THR 14 -8.504 -7.705 -7.261
127 3HG2 THR 14 HG2 THR 14 -9.916 -7.110 -8.133
128 H ASN 15 HN ASN 15 -6.629 -8.010 -8.045
129 HA ASN 15 HA ASN 15 -4.696 -8.372 -10.186
130 1HB ASN 15 HB2 ASN 15 -6.803 -7.304 -11.263
131 2HB ASN 15 HB1 ASN 15 -6.344 -5.852 -10.374
132 1HD2 ASN 15 HD2 ASN 15 -5.026 -4.481 -11.566
133 2HD2 ASN 15 HD2 ASN 15 -3.941 -4.971 -12.776
134 H ARG 16 HN ARG 16 -2.862 -7.806 -9.090
135 HA ARG 16 HA ARG 16 -2.959 -5.982 -6.841
136 1HB ARG 16 HB2 ARG 16 -1.110 -7.921 -8.051
137 2HB ARG 16 HB1 ARG 16 -0.328 -6.515 -7.355
138 1HG ARG 16 HG2 ARG 16 -1.742 -6.898 -5.278
139 2HG ARG 16 HG1 ARG 16 -2.199 -8.447 -5.988
140 1HD ARG 16 HD2 ARG 16 0.709 -7.731 -5.790
141 2HD ARG 16 HD1 ARG 16 -0.134 -8.316 -4.356
142 HE ARG 16 HE ARG 16 -0.827 -10.223 -6.143
143 1HH1 ARG 16 HH2 ARG 16 2.119 -8.875 -5.018
144 2HH1 ARG 16 HH2 ARG 16 3.113 -10.118 -5.702
145 1HH2 ARG 16 HH1 ARG 16 0.472 -11.745 -7.253
146 2HH2 ARG 16 HH1 ARG 16 2.180 -11.741 -6.969
147 H ARG 17 HN ARG 17 -1.098 -4.393 -6.786
148 HA ARG 17 HA ARG 17 0.227 -3.106 -8.801
149 1HB ARG 17 HB2 ARG 17 -2.564 -2.832 -9.334
150 2HB ARG 17 HB1 ARG 17 -1.974 -1.258 -8.805
151 1HG ARG 17 HG2 ARG 17 -1.553 -1.229 -11.113
152 2HG ARG 17 HG1 ARG 17 0.002 -1.686 -10.419
153 1HD ARG 17 HD2 ARG 17 -0.468 -4.051 -10.851
154 2HD ARG 17 HD1 ARG 17 -2.060 -3.635 -11.487
155 HE ARG 17 HE ARG 17 0.320 -2.457 -12.817
156 1HH1 ARG 17 HH2 ARG 17 -2.783 -2.952 -13.503
157 2HH1 ARG 17 HH2 ARG 17 -2.570 -3.992 -14.872
158 1HH2 ARG 17 HH1 ARG 17 0.803 -4.529 -14.272
159 2HH2 ARG 17 HH1 ARG 17 -0.539 -4.884 -15.308
160 HA PRO 18 HA PRO 18 -0.680 -0.046 -5.245
161 1HB PRO 18 HB2 PRO 18 -2.867 -0.533 -3.679
162 2HB PRO 18 HB1 PRO 18 -2.936 0.429 -5.149
163 1HG PRO 18 HG2 PRO 18 -3.901 -2.347 -4.705
164 2HG PRO 18 HG1 PRO 18 -4.505 -1.119 -5.831
165 1HD PRO 18 HD2 PRO 18 -2.833 -3.286 -6.507
166 2HD PRO 18 HD1 PRO 18 -3.148 -1.856 -7.511
167 H GLN 19 HN GLN 19 -1.442 -3.306 -4.999
168 HA GLN 19 HA GLN 19 -0.479 -3.705 -2.266
169 1HB GLN 19 HB2 GLN 19 -2.001 -5.117 -4.266
170 2HB GLN 19 HB1 GLN 19 -0.874 -6.114 -3.380
171 1HG GLN 19 HG2 GLN 19 -2.156 -6.079 -1.536
172 2HG GLN 19 HG1 GLN 19 -2.216 -4.317 -1.588
173 1HE2 GLN 19 HE2 GLN 19 -3.993 -3.310 -2.799
174 2HE2 GLN 19 HE2 GLN 19 -5.385 -4.195 -3.203
175 H ASP 20 HN ASP 20 1.313 -2.765 -3.916
176 HA ASP 20 HA ASP 20 3.415 -4.827 -3.884
177 1HB ASP 20 HB2 ASP 20 2.687 -5.032 -6.114
178 2HB ASP 20 HB1 ASP 20 2.523 -3.313 -6.334
179 H VAL 21 HN VAL 21 2.484 -1.478 -4.554
180 HA VAL 21 HA VAL 21 5.202 -0.665 -4.208
181 HB VAL 21 HB VAL 21 2.704 1.044 -4.290
182 1HG1 VAL 21 HG1 VAL 21 4.408 2.381 -3.320
183 2HG1 VAL 21 HG1 VAL 21 4.446 2.792 -5.034
184 3HG1 VAL 21 HG1 VAL 21 5.653 1.695 -4.363
185 1HG2 VAL 21 HG2 VAL 21 4.615 0.030 -6.396
186 2HG2 VAL 21 HG2 VAL 21 3.667 1.494 -6.656
187 3HG2 VAL 21 HG2 VAL 21 2.853 -0.048 -6.385
188 H LYS 22 HN LYS 22 3.179 -1.799 -2.046
189 HA LYS 22 HA LYS 22 3.959 0.033 0.089
190 1HB LYS 22 HB2 LYS 22 2.287 -1.461 1.371
191 2HB LYS 22 HB1 LYS 22 1.614 -0.368 0.156
192 1HG LYS 22 HG2 LYS 22 1.172 -2.066 -1.336
193 2HG LYS 22 HG1 LYS 22 2.516 -3.050 -0.762
194 1HD LYS 22 HD2 LYS 22 0.375 -4.063 -0.131
195 2HD LYS 22 HD1 LYS 22 1.289 -3.570 1.294
196 1HE LYS 22 HE2 LYS 22 -0.033 -1.493 1.432
197 2HE LYS 22 HE1 LYS 22 -0.945 -1.974 0.002
198 1HZ LYS 22 HZ1 LYS 22 -0.931 -4.061 1.911
199 2HZ LYS 22 HZ2 LYS 22 -2.255 -3.235 1.239
200 3HZ LYS 22 HZ3 LYS 22 -1.489 -2.630 2.630
201 H PHE 23 HN PHE 23 5.039 -2.520 -1.509
202 HA PHE 23 HA PHE 23 6.291 -4.399 -1.088
203 1HB PHE 23 HB2 PHE 23 7.229 -2.578 1.056
204 2HB PHE 23 HB1 PHE 23 8.144 -3.895 0.326
205 HD1 PHE 23 HD1 PHE 23 8.815 -3.821 -2.033
206 HD2 PHE 23 HD2 PHE 23 6.817 -0.526 -0.150
207 HE1 PHE 23 HE1 PHE 23 9.314 -2.406 -3.994
208 HE2 PHE 23 HE2 PHE 23 7.326 0.903 -2.098
209 HZ PHE 23 HZ PHE 23 8.588 -0.028 -4.030
210 HA PRO 24 HA PRO 24 3.212 -5.575 1.996
211 1HB PRO 24 HB2 PRO 24 1.887 -7.131 0.184
212 2HB PRO 24 HB1 PRO 24 1.579 -5.397 0.372
213 1HG PRO 24 HG2 PRO 24 3.033 -6.826 -1.800
214 2HG PRO 24 HG1 PRO 24 2.116 -5.312 -1.851
215 1HD PRO 24 HD2 PRO 24 4.924 -5.519 -1.700
216 2HD PRO 24 HD1 PRO 24 3.971 -4.056 -1.399
217 H GLY 25 HN GLY 25 3.904 -7.961 -0.570
218 1HA GLY 25 HA2 GLY 25 4.189 -10.195 1.094
219 2HA GLY 25 HA1 GLY 25 5.010 -10.036 -0.462
220 H GLY 26 HN GLY 26 6.361 -7.531 0.602
221 1HA GLY 26 HA2 GLY 26 8.846 -8.619 1.324
222 2HA GLY 26 HA1 GLY 26 8.345 -6.976 1.731
223 H GLY 27 HN GLY 27 6.823 -6.838 3.687
224 1HA GLY 27 HA2 GLY 27 6.947 -9.050 5.590
225 2HA GLY 27 HA1 GLY 27 8.000 -7.702 6.022
226 H GLN 28 HN GLN 28 7.031 -5.679 6.573
227 HA GLN 28 HA GLN 28 4.211 -5.944 7.457
228 1HB GLN 28 HB2 GLN 28 6.512 -4.994 8.710
229 2HB GLN 28 HB1 GLN 28 5.601 -3.535 8.303
230 1HG GLN 28 HG2 GLN 28 3.587 -4.536 9.293
231 2HG GLN 28 HG1 GLN 28 4.530 -5.955 9.747
232 1HE2 GLN 28 HE2 GLN 28 3.176 -4.007 11.583
233 2HE2 GLN 28 HE2 GLN 28 4.405 -3.368 12.565
234 H ILE 29 HN ILE 29 6.100 -4.438 5.105
235 HA ILE 29 HA ILE 29 5.432 -3.105 3.279
236 HB ILE 29 HB ILE 29 3.232 -2.604 2.855
237 1HG1 ILE 29 HG1 ILE 29 1.672 -2.346 5.080
238 2HG1 ILE 29 HG1 ILE 29 3.212 -1.731 5.681
239 1HG2 ILE 29 HG2 ILE 29 3.608 -5.023 4.161
240 2HG2 ILE 29 HG2 ILE 29 2.199 -4.569 3.201
241 3HG2 ILE 29 HG2 ILE 29 2.185 -4.341 4.949
242 1HD1 ILE 29 HD1 ILE 29 2.857 0.203 4.599
243 2HD1 ILE 29 HD1 ILE 29 1.338 -0.421 3.960
244 3HD1 ILE 29 HD1 ILE 29 2.838 -0.668 3.066
245 H VAL 30 HN VAL 30 5.678 -2.214 6.511
246 HA VAL 30 HA VAL 30 5.638 0.674 5.885
247 HB VAL 30 HB VAL 30 6.257 -0.766 8.479
248 1HG1 VAL 30 HG1 VAL 30 6.609 1.936 7.674
249 2HG1 VAL 30 HG1 VAL 30 6.778 1.266 9.296
250 3HG1 VAL 30 HG1 VAL 30 5.222 1.903 8.763
251 1HG2 VAL 30 HG2 VAL 30 3.772 -0.326 7.098
252 2HG2 VAL 30 HG2 VAL 30 3.787 0.646 8.569
253 3HG2 VAL 30 HG2 VAL 30 4.034 -1.099 8.662
254 H GLY 31 HN GLY 31 7.709 -1.520 5.043
255 1HA GLY 31 HA2 GLY 31 10.042 0.149 5.795
256 2HA GLY 31 HA1 GLY 31 10.167 -1.592 5.877
257 H GLY 32 HN GLY 32 8.332 -1.412 3.293
258 1HA GLY 32 HA2 GLY 32 10.673 -1.357 1.557
259 2HA GLY 32 HA1 GLY 32 9.127 -1.924 1.040
260 H VAL 33 HN VAL 33 8.005 0.548 2.335
261 HA VAL 33 HA VAL 33 8.223 2.361 0.031
262 HB VAL 33 HB VAL 33 6.785 2.444 2.701
263 1HG1 VAL 33 HG1 VAL 33 5.782 4.622 1.521
264 2HG1 VAL 33 HG1 VAL 33 7.382 4.665 0.780
265 3HG1 VAL 33 HG1 VAL 33 7.222 4.714 2.536
266 1HG2 VAL 33 HG2 VAL 33 6.133 1.604 0.034
267 2HG2 VAL 33 HG2 VAL 33 5.134 3.001 0.434
268 3HG2 VAL 33 HG2 VAL 33 5.109 1.574 1.469
269 H TYR 34 HN TYR 34 9.854 1.580 2.757
270 HA TYR 34 HA TYR 34 11.228 4.162 3.153
271 1HB TYR 34 HB2 TYR 34 11.332 1.610 4.802
272 2HB TYR 34 HB1 TYR 34 11.806 3.231 5.317
273 HD1 TYR 34 HD1 TYR 34 8.911 1.165 4.211
274 HD2 TYR 34 HD2 TYR 34 10.184 4.819 6.061
275 HE1 TYR 34 HE1 TYR 34 6.570 1.716 4.701
276 HE2 TYR 34 HE2 TYR 34 7.835 5.361 6.584
277 HH TYR 34 HH TYR 34 5.668 4.091 6.908
278 H LEU 35 HN LEU 35 11.367 1.290 1.495
279 HA LEU 35 HA LEU 35 14.293 1.034 1.440
280 1HB LEU 35 HB2 LEU 35 13.730 -1.149 0.987
281 2HB LEU 35 HB1 LEU 35 12.046 -0.692 1.096
282 HG LEU 35 HG LEU 35 12.285 0.096 -1.346
283 1HD1 LEU 35 HD1 LEU 35 14.250 -1.931 -1.948
284 2HD1 LEU 35 HD1 LEU 35 14.947 -0.750 -0.837
285 3HD1 LEU 35 HD1 LEU 35 14.270 -0.221 -2.377
286 1HD2 LEU 35 HD2 LEU 35 12.246 -2.481 -2.033
287 2HD2 LEU 35 HD2 LEU 35 10.921 -1.758 -1.121
288 3HD2 LEU 35 HD2 LEU 35 12.158 -2.697 -0.285
289 H LEU 36 HN LEU 36 11.933 2.915 0.176
290 HA LEU 36 HA LEU 36 12.796 3.051 -2.588
291 1HB LEU 36 HB2 LEU 36 10.951 4.969 -1.156
292 2HB LEU 36 HB1 LEU 36 11.001 4.598 -2.875
293 HG LEU 36 HG LEU 36 10.192 2.710 -0.651
294 1HD1 LEU 36 HD1 LEU 36 8.657 3.964 -2.949
295 2HD1 LEU 36 HD1 LEU 36 8.470 4.355 -1.240
296 3HD1 LEU 36 HD1 LEU 36 8.007 2.761 -1.834
297 1HD2 LEU 36 HD2 LEU 36 10.801 1.062 -2.070
298 2HD2 LEU 36 HD2 LEU 36 11.210 2.228 -3.328
299 3HD2 LEU 36 HD2 LEU 36 9.555 1.639 -3.176
300 HA PRO 37 HA PRO 37 14.579 7.222 -1.084
301 1HB PRO 37 HB2 PRO 37 14.741 7.603 1.634
302 2HB PRO 37 HB1 PRO 37 13.339 8.089 0.663
303 1HG PRO 37 HG2 PRO 37 13.610 5.799 2.545
304 2HG PRO 37 HG1 PRO 37 12.151 6.659 2.029
305 1HD PRO 37 HD2 PRO 37 13.049 4.139 1.066
306 2HD PRO 37 HD1 PRO 37 11.740 5.115 0.389
307 H ARG 38 HN ARG 38 15.235 4.805 1.482
308 HA ARG 38 HA ARG 38 18.129 5.292 1.261
309 1HB ARG 38 HB2 ARG 38 18.332 3.908 3.197
310 2HB ARG 38 HB1 ARG 38 16.872 4.867 3.446
311 1HG ARG 38 HG2 ARG 38 15.676 2.979 3.659
312 2HG ARG 38 HG1 ARG 38 16.111 2.528 2.010
313 1HD ARG 38 HD2 ARG 38 17.799 1.124 2.693
314 2HD ARG 38 HD1 ARG 38 18.182 2.105 4.108
315 HE ARG 38 HE ARG 38 15.610 0.649 4.177
316 1HH1 ARG 38 HH1 ARG 38 18.163 -1.104 4.211
317 2HH1 ARG 38 HH1 ARG 38 18.369 -1.316 5.918
318 1HH2 ARG 38 HH2 ARG 38 16.192 1.246 6.768
319 2HH2 ARG 38 HH2 ARG 38 17.254 0.013 7.365
320 H ARG 39 HN ARG 39 16.905 4.249 -1.107
321 HA ARG 39 HA ARG 39 16.935 1.497 -1.487
322 1HB ARG 39 HB2 ARG 39 16.310 2.705 -3.378
323 2HB ARG 39 HB1 ARG 39 17.641 3.848 -3.213
324 1HG ARG 39 HG2 ARG 39 19.170 2.424 -4.208
325 2HG ARG 39 HG1 ARG 39 18.264 0.977 -3.769
326 1HD ARG 39 HD2 ARG 39 16.433 1.947 -5.367
327 2HD ARG 39 HD1 ARG 39 17.761 2.905 -6.022
328 HE ARG 39 HE ARG 39 17.565 -0.060 -6.131
329 1HH1 ARG 39 HH1 ARG 39 18.224 2.732 -7.832
330 2HH1 ARG 39 HH1 ARG 39 19.641 2.135 -8.629
331 1HH2 ARG 39 HH2 ARG 39 19.796 -0.774 -6.749
332 2HH2 ARG 39 HH2 ARG 39 20.531 0.150 -8.016
333 H GLY 40 HN GLY 40 19.613 3.631 -0.833
334 1HA GLY 40 HA2 GLY 40 21.898 3.192 -0.531
335 2HA GLY 40 HA1 GLY 40 21.390 1.555 -0.116
336 HA PRO 41 HA PRO 41 22.542 1.779 -4.793
337 1HB PRO 41 HB2 PRO 41 24.528 3.614 -5.298
338 2HB PRO 41 HB1 PRO 41 22.801 3.968 -5.469
339 1HG PRO 41 HG2 PRO 41 24.688 4.828 -3.326
340 2HG PRO 41 HG1 PRO 41 23.207 5.612 -3.897
341 1HD PRO 41 HD2 PRO 41 23.459 4.069 -1.538
342 2HD PRO 41 HD1 PRO 41 21.933 4.570 -2.299
343 H ARG 42 HN ARG 42 24.590 0.931 -5.839
344 HA ARG 42 HA ARG 42 26.397 -0.181 -3.746
345 1HB ARG 42 HB2 ARG 42 25.409 -1.133 -6.393
346 2HB ARG 42 HB1 ARG 42 27.045 -1.605 -5.931
347 1HG ARG 42 HG2 ARG 42 26.129 -2.421 -3.743
348 2HG ARG 42 HG1 ARG 42 24.505 -2.086 -4.349
349 1HD ARG 42 HD2 ARG 42 24.543 -4.180 -5.197
350 2HD ARG 42 HD1 ARG 42 25.663 -3.549 -6.405
351 HE ARG 42 HE ARG 42 27.416 -4.165 -4.480
352 1HH1 ARG 42 HH1 ARG 42 26.525 -6.112 -6.726
353 2HH1 ARG 42 HH1 ARG 42 26.281 -7.555 -5.801
354 1HH2 ARG 42 HH2 ARG 42 26.271 -5.911 -2.747
355 2HH2 ARG 42 HH2 ARG 42 26.137 -7.441 -3.548
356 H LEU 43 HN LEU 43 26.301 2.098 -6.295
357 HA LEU 43 HA LEU 43 29.233 1.976 -6.726
358 1HB LEU 43 HB2 LEU 43 26.930 3.019 -8.201
359 2HB LEU 43 HB1 LEU 43 28.269 4.165 -8.135
360 HG LEU 43 HG LEU 43 29.643 1.900 -8.670
361 1HD1 LEU 43 HD1 LEU 43 27.048 1.583 -10.200
362 2HD1 LEU 43 HD1 LEU 43 27.442 0.642 -8.761
363 3HD1 LEU 43 HD1 LEU 43 28.438 0.498 -10.210
364 1HD2 LEU 43 HD2 LEU 43 28.894 4.248 -10.023
365 2HD2 LEU 43 HD2 LEU 43 28.541 2.938 -11.150
366 3HD2 LEU 43 HD2 LEU 43 30.168 3.123 -10.494
367 H GLY 44 HN GLY 44 29.284 2.604 -4.275
368 1HA GLY 44 HA2 GLY 44 30.013 5.413 -4.139
369 2HA GLY 44 HA1 GLY 44 28.545 5.065 -3.223
Start of MODEL 3
1 1H SER 1 HT1 SER 1 -41.564 -4.621 -1.668
2 2H SER 1 HT2 SER 1 -40.781 -6.123 -1.801
3 3H SER 1 HT3 SER 1 -42.421 -6.052 -1.360
4 HA SER 1 HA SER 1 -43.141 -5.768 -3.460
5 1HB SER 1 HB2 SER 1 -42.312 -4.149 -4.853
6 2HB SER 1 HB1 SER 1 -41.484 -3.627 -3.389
7 HG SER 1 HG SER 1 -39.863 -3.865 -4.798
8 H THR 2 HN THR 2 -42.607 -6.815 -5.608
9 HA THR 2 HA THR 2 -40.890 -9.174 -5.108
10 HB THR 2 HB THR 2 -42.015 -10.191 -6.961
11 HG1 THR 2 HG1 THR 2 -43.277 -8.965 -8.366
12 1HG2 THR 2 HG2 THR 2 -44.485 -9.521 -6.447
13 2HG2 THR 2 HG2 THR 2 -43.770 -8.494 -5.205
14 3HG2 THR 2 HG2 THR 2 -43.515 -10.238 -5.162
15 H ASN 3 HN ASN 3 -38.951 -7.660 -5.265
16 HA ASN 3 HA ASN 3 -37.651 -7.996 -7.791
17 1HB ASN 3 HB2 ASN 3 -39.399 -5.950 -7.995
18 2HB ASN 3 HB1 ASN 3 -38.012 -5.079 -7.331
19 1HD2 ASN 3 HD2 ASN 3 -36.826 -4.180 -9.019
20 2HD2 ASN 3 HD2 ASN 3 -36.502 -4.944 -10.500
21 HA PRO 4 HA PRO 4 -34.834 -7.247 -4.310
22 1HB PRO 4 HB2 PRO 4 -33.040 -9.172 -5.109
23 2HB PRO 4 HB1 PRO 4 -34.468 -9.514 -4.117
24 1HG PRO 4 HG2 PRO 4 -34.010 -10.091 -7.008
25 2HG PRO 4 HG1 PRO 4 -35.062 -10.922 -5.851
26 1HD PRO 4 HD2 PRO 4 -35.905 -9.064 -7.808
27 2HD PRO 4 HD1 PRO 4 -36.871 -9.639 -6.430
28 H LYS 5 HN LYS 5 -32.770 -6.191 -4.314
29 HA LYS 5 HA LYS 5 -31.941 -5.177 -6.989
30 1HB LYS 5 HB2 LYS 5 -32.052 -4.053 -4.282
31 2HB LYS 5 HB1 LYS 5 -30.521 -3.739 -5.101
32 1HG LYS 5 HG2 LYS 5 -32.716 -3.367 -6.942
33 2HG LYS 5 HG1 LYS 5 -32.970 -2.391 -5.495
34 1HD LYS 5 HD2 LYS 5 -30.308 -2.449 -6.920
35 2HD LYS 5 HD1 LYS 5 -31.585 -1.326 -7.386
36 1HE LYS 5 HE2 LYS 5 -30.355 -1.565 -4.624
37 2HE LYS 5 HE1 LYS 5 -30.065 -0.260 -5.776
38 1HZ LYS 5 HZ1 LYS 5 -31.831 0.753 -4.941
39 2HZ LYS 5 HZ2 LYS 5 -32.200 -0.578 -3.950
40 3HZ LYS 5 HZ3 LYS 5 -32.810 -0.499 -5.534
41 HA PRO 6 HA PRO 6 -28.499 -8.009 -6.254
42 1HB PRO 6 HB2 PRO 6 -27.770 -8.119 -8.903
43 2HB PRO 6 HB1 PRO 6 -29.053 -9.117 -8.198
44 1HG PRO 6 HG2 PRO 6 -29.292 -6.727 -9.965
45 2HG PRO 6 HG1 PRO 6 -30.409 -8.085 -9.758
46 1HD PRO 6 HD2 PRO 6 -30.704 -5.512 -8.618
47 2HD PRO 6 HD1 PRO 6 -31.610 -6.969 -8.155
48 H GLN 7 HN GLN 7 -26.567 -7.178 -5.555
49 HA GLN 7 HA GLN 7 -25.662 -4.555 -6.518
50 1HB GLN 7 HB2 GLN 7 -24.866 -6.442 -4.333
51 2HB GLN 7 HB1 GLN 7 -23.682 -5.257 -4.887
52 1HG GLN 7 HG2 GLN 7 -26.310 -4.055 -4.544
53 2HG GLN 7 HG1 GLN 7 -25.738 -4.800 -3.051
54 1HE2 GLN 7 HE2 GLN 7 -23.182 -4.302 -2.737
55 2HE2 GLN 7 HE2 GLN 7 -22.764 -2.671 -2.956
56 H ARG 8 HN ARG 8 -25.226 -5.236 -8.758
57 HA ARG 8 HA ARG 8 -22.925 -7.078 -9.102
58 1HB ARG 8 HB2 ARG 8 -24.975 -7.257 -10.567
59 2HB ARG 8 HB1 ARG 8 -24.559 -5.679 -11.238
60 1HG ARG 8 HG2 ARG 8 -23.003 -6.591 -12.587
61 2HG ARG 8 HG1 ARG 8 -22.245 -7.423 -11.229
62 1HD ARG 8 HD2 ARG 8 -23.313 -9.382 -11.672
63 2HD ARG 8 HD1 ARG 8 -24.826 -8.573 -12.079
64 HE ARG 8 HE ARG 8 -22.527 -8.764 -13.987
65 1HH1 ARG 8 HH2 ARG 8 -25.297 -10.389 -13.579
66 2HH1 ARG 8 HH2 ARG 8 -26.092 -9.868 -15.025
67 1HH2 ARG 8 HH1 ARG 8 -23.796 -7.357 -15.698
68 2HH2 ARG 8 HH1 ARG 8 -25.243 -8.151 -16.225
69 H LYS 9 HN LYS 9 -20.919 -6.186 -9.103
70 HA LYS 9 HA LYS 9 -20.475 -3.643 -10.537
71 1HB LYS 9 HB2 LYS 9 -20.961 -2.831 -8.306
72 2HB LYS 9 HB1 LYS 9 -19.869 -4.017 -7.591
73 1HG LYS 9 HG2 LYS 9 -17.969 -2.880 -8.259
74 2HG LYS 9 HG1 LYS 9 -18.765 -2.160 -9.658
75 1HD LYS 9 HD2 LYS 9 -19.893 -1.353 -7.052
76 2HD LYS 9 HD1 LYS 9 -18.237 -0.813 -7.336
77 1HE LYS 9 HE2 LYS 9 -19.228 0.899 -8.461
78 2HE LYS 9 HE1 LYS 9 -19.393 -0.283 -9.759
79 1HZ LYS 9 HZ1 LYS 9 -21.506 -0.762 -8.079
80 2HZ LYS 9 HZ2 LYS 9 -21.569 0.021 -9.584
81 3HZ LYS 9 HZ3 LYS 9 -21.411 0.929 -8.157
82 H THR 10 HN THR 10 -18.310 -4.931 -8.093
83 HA THR 10 HA THR 10 -16.339 -6.216 -8.304
84 HB THR 10 HB THR 10 -16.810 -6.418 -11.275
85 HG1 THR 10 HG1 THR 10 -18.605 -7.377 -10.801
86 1HG2 THR 10 HG2 THR 10 -15.290 -7.892 -9.159
87 2HG2 THR 10 HG2 THR 10 -14.777 -7.416 -10.777
88 3HG2 THR 10 HG2 THR 10 -15.868 -8.786 -10.565
89 H LYS 11 HN LYS 11 -16.508 -4.595 -11.492
90 HA LYS 11 HA LYS 11 -15.138 -2.924 -12.403
91 1HB LYS 11 HB2 LYS 11 -15.698 -2.137 -9.737
92 2HB LYS 11 HB1 LYS 11 -13.978 -1.843 -9.998
93 1HG LYS 11 HG2 LYS 11 -14.455 -0.035 -11.244
94 2HG LYS 11 HG1 LYS 11 -15.408 -1.030 -12.346
95 1HD LYS 11 HD2 LYS 11 -16.909 0.627 -11.495
96 2HD LYS 11 HD1 LYS 11 -17.304 -0.869 -10.648
97 1HE LYS 11 HE2 LYS 11 -17.012 0.269 -8.722
98 2HE LYS 11 HE1 LYS 11 -15.289 0.291 -9.096
99 1HZ LYS 11 HZ1 LYS 11 -15.454 2.384 -10.076
100 2HZ LYS 11 HZ2 LYS 11 -16.425 2.509 -8.687
101 3HZ LYS 11 HZ3 LYS 11 -17.143 2.304 -10.212
102 H ARG 12 HN ARG 12 -13.152 -3.243 -13.292
103 HA ARG 12 HA ARG 12 -11.012 -4.168 -13.590
104 1HB ARG 12 HB2 ARG 12 -11.023 -2.861 -10.911
105 2HB ARG 12 HB1 ARG 12 -9.655 -3.909 -11.286
106 1HG ARG 12 HG2 ARG 12 -10.623 -1.611 -13.014
107 2HG ARG 12 HG1 ARG 12 -9.206 -1.572 -11.964
108 1HD ARG 12 HD2 ARG 12 -8.069 -2.285 -13.795
109 2HD ARG 12 HD1 ARG 12 -8.767 -3.861 -13.428
110 HE ARG 12 HE ARG 12 -10.665 -2.451 -14.985
111 1HH1 ARG 12 HH2 ARG 12 -8.522 -4.927 -15.247
112 2HH1 ARG 12 HH2 ARG 12 -8.146 -4.705 -16.922
113 1HH2 ARG 12 HH1 ARG 12 -9.734 -1.630 -17.145
114 2HH2 ARG 12 HH1 ARG 12 -8.832 -2.837 -17.998
115 H ASN 13 HN ASN 13 -9.364 -5.763 -12.337
116 HA ASN 13 HA ASN 13 -10.827 -7.797 -10.773
117 1HB ASN 13 HB2 ASN 13 -11.297 -8.554 -13.018
118 2HB ASN 13 HB1 ASN 13 -9.615 -8.333 -13.499
119 1HD2 ASN 13 HD2 ASN 13 -9.084 -10.536 -13.935
120 2HD2 ASN 13 HD2 ASN 13 -9.123 -11.750 -12.750
121 H THR 14 HN THR 14 -7.782 -7.645 -12.663
122 HA THR 14 HA THR 14 -6.330 -8.122 -10.089
123 HB THR 14 HB THR 14 -5.730 -9.248 -12.841
124 HG1 THR 14 HG1 THR 14 -7.282 -10.412 -11.750
125 1HG2 THR 14 HG2 THR 14 -4.175 -9.474 -10.249
126 2HG2 THR 14 HG2 THR 14 -3.658 -8.600 -11.691
127 3HG2 THR 14 HG2 THR 14 -3.816 -10.356 -11.732
128 H ASN 15 HN ASN 15 -6.166 -5.723 -10.067
129 HA ASN 15 HA ASN 15 -4.106 -4.728 -11.998
130 1HB ASN 15 HB2 ASN 15 -6.487 -3.648 -11.861
131 2HB ASN 15 HB1 ASN 15 -5.880 -2.921 -10.371
132 1HD2 ASN 15 HD2 ASN 15 -5.061 -0.868 -10.761
133 2HD2 ASN 15 HD2 ASN 15 -4.228 -0.395 -12.162
134 H ARG 16 HN ARG 16 -2.192 -5.078 -10.857
135 HA ARG 16 HA ARG 16 -2.015 -4.669 -8.002
136 1HB ARG 16 HB2 ARG 16 -0.379 -5.706 -10.183
137 2HB ARG 16 HB1 ARG 16 0.549 -4.744 -9.050
138 1HG ARG 16 HG2 ARG 16 -1.015 -6.219 -7.355
139 2HG ARG 16 HG1 ARG 16 -0.741 -7.360 -8.672
140 1HD ARG 16 HD2 ARG 16 1.684 -7.016 -8.491
141 2HD ARG 16 HD1 ARG 16 1.434 -5.835 -7.205
142 HE ARG 16 HE ARG 16 0.855 -7.629 -5.717
143 1HH1 ARG 16 HH2 ARG 16 -0.649 -9.284 -7.772
144 2HH1 ARG 16 HH2 ARG 16 0.378 -10.671 -7.909
145 1HH2 ARG 16 HH1 ARG 16 3.099 -9.138 -6.402
146 2HH2 ARG 16 HH1 ARG 16 2.501 -10.588 -7.135
147 H ARG 17 HN ARG 17 -0.125 -3.293 -7.291
148 HA ARG 17 HA ARG 17 1.156 -1.163 -8.240
149 1HB ARG 17 HB2 ARG 17 -1.745 -0.611 -8.552
150 2HB ARG 17 HB1 ARG 17 -0.789 0.699 -7.858
151 1HG ARG 17 HG2 ARG 17 0.017 -0.778 -10.370
152 2HG ARG 17 HG1 ARG 17 -0.951 0.698 -10.392
153 1HD ARG 17 HD2 ARG 17 0.985 1.607 -8.830
154 2HD ARG 17 HD1 ARG 17 1.915 0.321 -9.600
155 HE ARG 17 HE ARG 17 0.703 2.642 -11.021
156 1HH1 ARG 17 HH1 ARG 17 3.460 0.816 -10.533
157 2HH1 ARG 17 HH1 ARG 17 3.898 0.697 -12.205
158 1HH2 ARG 17 HH2 ARG 17 0.934 2.077 -13.357
159 2HH2 ARG 17 HH2 ARG 17 2.468 1.410 -13.803
160 HA PRO 18 HA PRO 18 -0.339 0.012 -3.851
161 1HB PRO 18 HB2 PRO 18 -2.605 -1.203 -2.922
162 2HB PRO 18 HB1 PRO 18 -2.621 0.312 -3.814
163 1HG PRO 18 HG2 PRO 18 -3.363 -2.407 -4.766
164 2HG PRO 18 HG1 PRO 18 -4.000 -0.833 -5.272
165 1HD PRO 18 HD2 PRO 18 -2.113 -2.337 -6.700
166 2HD PRO 18 HD1 PRO 18 -2.430 -0.602 -6.915
167 H GLN 19 HN GLN 19 -0.845 -3.070 -5.112
168 HA GLN 19 HA GLN 19 -0.105 -4.561 -2.708
169 1HB GLN 19 HB2 GLN 19 -1.299 -5.044 -5.271
170 2HB GLN 19 HB1 GLN 19 -0.129 -6.256 -4.807
171 1HG GLN 19 HG2 GLN 19 -1.509 -7.133 -3.264
172 2HG GLN 19 HG1 GLN 19 -1.778 -5.539 -2.561
173 1HE2 GLN 19 HE2 GLN 19 -3.433 -4.135 -3.740
174 2HE2 GLN 19 HE2 GLN 19 -4.742 -4.907 -4.496
175 H ASP 20 HN ASP 20 1.738 -2.893 -3.636
176 HA ASP 20 HA ASP 20 4.042 -4.664 -4.058
177 1HB ASP 20 HB2 ASP 20 3.575 -4.167 -6.301
178 2HB ASP 20 HB1 ASP 20 3.181 -2.502 -5.972
179 H VAL 21 HN VAL 21 2.858 -1.329 -3.773
180 HA VAL 21 HA VAL 21 5.409 -0.527 -2.773
181 HB VAL 21 HB VAL 21 3.004 1.177 -2.276
182 1HG1 VAL 21 HG1 VAL 21 4.644 2.691 -1.992
183 2HG1 VAL 21 HG1 VAL 21 5.125 2.470 -3.674
184 3HG1 VAL 21 HG1 VAL 21 5.852 1.477 -2.412
185 1HG2 VAL 21 HG2 VAL 21 2.307 0.838 -4.417
186 2HG2 VAL 21 HG2 VAL 21 3.830 0.083 -4.889
187 3HG2 VAL 21 HG2 VAL 21 3.690 1.841 -4.854
188 H LYS 22 HN LYS 22 3.207 -2.385 -1.412
189 HA LYS 22 HA LYS 22 3.515 -1.310 1.284
190 1HB LYS 22 HB2 LYS 22 1.860 -3.162 1.793
191 2HB LYS 22 HB1 LYS 22 1.249 -1.912 0.699
192 1HG LYS 22 HG2 LYS 22 1.354 -3.269 -1.144
193 2HG LYS 22 HG1 LYS 22 2.742 -4.153 -0.517
194 1HD LYS 22 HD2 LYS 22 0.583 -5.471 -0.612
195 2HD LYS 22 HD1 LYS 22 1.402 -5.448 0.950
196 1HE LYS 22 HE2 LYS 22 -0.131 -3.880 1.856
197 2HE LYS 22 HE1 LYS 22 -0.748 -3.440 0.263
198 1HZ LYS 22 HZ1 LYS 22 -2.368 -4.869 0.870
199 2HZ LYS 22 HZ2 LYS 22 -1.371 -5.747 1.929
200 3HZ LYS 22 HZ3 LYS 22 -1.286 -6.022 0.254
201 H PHE 23 HN PHE 23 5.158 -3.042 -0.808
202 HA PHE 23 HA PHE 23 6.582 -4.842 -0.811
203 1HB PHE 23 HB2 PHE 23 6.948 -3.720 1.910
204 2HB PHE 23 HB1 PHE 23 8.128 -4.681 1.019
205 HD1 PHE 23 HD1 PHE 23 6.182 -1.543 0.996
206 HD2 PHE 23 HD2 PHE 23 9.349 -3.778 -0.841
207 HE1 PHE 23 HE1 PHE 23 6.710 0.399 -0.429
208 HE2 PHE 23 HE2 PHE 23 9.899 -1.831 -2.259
209 HZ PHE 23 HZ PHE 23 8.587 0.271 -2.059
210 HA PRO 24 HA PRO 24 3.304 -7.276 1.136
211 1HB PRO 24 HB2 PRO 24 2.521 -8.285 -1.279
212 2HB PRO 24 HB1 PRO 24 1.929 -6.743 -0.638
213 1HG PRO 24 HG2 PRO 24 3.901 -7.247 -2.816
214 2HG PRO 24 HG1 PRO 24 2.777 -5.893 -2.596
215 1HD PRO 24 HD2 PRO 24 5.526 -5.851 -1.969
216 2HD PRO 24 HD1 PRO 24 4.320 -4.678 -1.418
217 H GLY 25 HN GLY 25 2.903 -9.774 0.342
218 1HA GLY 25 HA2 GLY 25 3.815 -11.930 0.181
219 2HA GLY 25 HA1 GLY 25 5.166 -11.206 -0.693
220 H GLY 26 HN GLY 26 4.257 -10.160 2.537
221 1HA GLY 26 HA2 GLY 26 5.842 -11.831 4.129
222 2HA GLY 26 HA1 GLY 26 6.937 -10.592 3.516
223 H GLY 27 HN GLY 27 5.714 -8.263 3.650
224 1HA GLY 27 HA2 GLY 27 4.060 -7.073 5.181
225 2HA GLY 27 HA1 GLY 27 4.722 -8.080 6.472
226 H GLN 28 HN GLN 28 5.867 -5.846 3.939
227 HA GLN 28 HA GLN 28 7.737 -4.668 5.911
228 1HB GLN 28 HB2 GLN 28 8.261 -6.165 3.522
229 2HB GLN 28 HB1 GLN 28 8.877 -4.527 3.360
230 1HG GLN 28 HG2 GLN 28 9.857 -4.809 5.686
231 2HG GLN 28 HG1 GLN 28 9.480 -6.524 5.529
232 1HE2 GLN 28 HE2 GLN 28 11.955 -6.752 5.671
233 2HE2 GLN 28 HE2 GLN 28 12.850 -6.580 4.239
234 H ILE 29 HN ILE 29 5.105 -4.055 4.491
235 HA ILE 29 HA ILE 29 5.357 -1.944 2.637
236 HB ILE 29 HB ILE 29 3.163 -2.550 2.935
237 1HG1 ILE 29 HG1 ILE 29 3.563 0.006 3.270
238 2HG1 ILE 29 HG1 ILE 29 1.963 -0.662 3.576
239 1HG2 ILE 29 HG2 ILE 29 2.331 -2.432 5.510
240 2HG2 ILE 29 HG2 ILE 29 4.013 -2.926 5.711
241 3HG2 ILE 29 HG2 ILE 29 2.920 -3.898 4.726
242 1HD1 ILE 29 HD1 ILE 29 3.400 0.870 5.362
243 2HD1 ILE 29 HD1 ILE 29 3.749 -0.770 5.912
244 3HD1 ILE 29 HD1 ILE 29 2.079 -0.215 5.800
245 H VAL 30 HN VAL 30 5.834 -1.988 6.079
246 HA VAL 30 HA VAL 30 5.820 0.913 6.189
247 HB VAL 30 HB VAL 30 6.687 -1.108 8.268
248 1HG1 VAL 30 HG1 VAL 30 7.515 0.810 9.203
249 2HG1 VAL 30 HG1 VAL 30 5.828 1.068 9.646
250 3HG1 VAL 30 HG1 VAL 30 6.493 1.853 8.214
251 1HG2 VAL 30 HG2 VAL 30 4.039 0.282 7.762
252 2HG2 VAL 30 HG2 VAL 30 4.408 -0.635 9.222
253 3HG2 VAL 30 HG2 VAL 30 4.359 -1.448 7.658
254 H GLY 31 HN GLY 31 7.916 -0.802 4.669
255 1HA GLY 31 HA2 GLY 31 10.195 0.840 5.520
256 2HA GLY 31 HA1 GLY 31 10.464 -0.879 5.414
257 H GLY 32 HN GLY 32 8.614 -0.983 2.991
258 1HA GLY 32 HA2 GLY 32 10.718 -0.261 1.136
259 2HA GLY 32 HA1 GLY 32 9.237 -1.046 0.654
260 H VAL 33 HN VAL 33 7.944 1.151 2.386
261 HA VAL 33 HA VAL 33 7.552 3.116 0.253
262 HB VAL 33 HB VAL 33 6.670 2.975 3.156
263 1HG1 VAL 33 HG1 VAL 33 6.082 5.111 1.078
264 2HG1 VAL 33 HG1 VAL 33 7.013 5.329 2.559
265 3HG1 VAL 33 HG1 VAL 33 5.285 4.984 2.646
266 1HG2 VAL 33 HG2 VAL 33 5.666 1.795 0.835
267 2HG2 VAL 33 HG2 VAL 33 4.638 3.209 1.065
268 3HG2 VAL 33 HG2 VAL 33 4.788 2.009 2.348
269 H TYR 34 HN TYR 34 9.732 2.393 2.593
270 HA TYR 34 HA TYR 34 10.883 5.092 2.920
271 1HB TYR 34 HB2 TYR 34 11.491 2.467 4.330
272 2HB TYR 34 HB1 TYR 34 11.961 4.077 4.862
273 HD1 TYR 34 HD1 TYR 34 10.444 5.481 6.050
274 HD2 TYR 34 HD2 TYR 34 9.025 1.916 4.153
275 HE1 TYR 34 HE1 TYR 34 8.226 5.794 7.080
276 HE2 TYR 34 HE2 TYR 34 6.824 2.206 5.177
277 HH TYR 34 HH TYR 34 6.201 3.941 7.717
278 H LEU 35 HN LEU 35 11.123 2.122 1.292
279 HA LEU 35 HA LEU 35 13.978 2.368 0.605
280 1HB LEU 35 HB2 LEU 35 11.789 0.382 -0.109
281 2HB LEU 35 HB1 LEU 35 13.429 0.278 -0.747
282 HG LEU 35 HG LEU 35 12.955 0.511 2.205
283 1HD1 LEU 35 HD1 LEU 35 12.202 -1.714 0.493
284 2HD1 LEU 35 HD1 LEU 35 11.949 -1.515 2.227
285 3HD1 LEU 35 HD1 LEU 35 13.462 -2.197 1.629
286 1HD2 LEU 35 HD2 LEU 35 15.115 -0.955 2.057
287 2HD2 LEU 35 HD2 LEU 35 15.234 0.766 1.686
288 3HD2 LEU 35 HD2 LEU 35 15.165 -0.415 0.378
289 H LEU 36 HN LEU 36 11.261 3.878 -0.179
290 HA LEU 36 HA LEU 36 11.310 3.814 -3.067
291 1HB LEU 36 HB2 LEU 36 9.960 5.832 -1.258
292 2HB LEU 36 HB1 LEU 36 9.571 5.497 -2.940
293 HG LEU 36 HG LEU 36 9.213 3.681 -0.561
294 1HD1 LEU 36 HD1 LEU 36 7.466 5.224 -2.417
295 2HD1 LEU 36 HD1 LEU 36 7.242 4.859 -0.706
296 3HD1 LEU 36 HD1 LEU 36 6.890 3.632 -1.923
297 1HD2 LEU 36 HD2 LEU 36 8.255 2.147 -2.475
298 2HD2 LEU 36 HD2 LEU 36 9.988 2.146 -2.149
299 3HD2 LEU 36 HD2 LEU 36 9.347 3.074 -3.503
300 HA PRO 37 HA PRO 37 13.455 8.053 -2.518
301 1HB PRO 37 HB2 PRO 37 14.461 8.621 -0.023
302 2HB PRO 37 HB1 PRO 37 12.832 9.082 -0.549
303 1HG PRO 37 HG2 PRO 37 13.657 6.902 1.313
304 2HG PRO 37 HG1 PRO 37 12.131 7.798 1.241
305 1HD PRO 37 HD2 PRO 37 12.562 5.189 0.242
306 2HD PRO 37 HD1 PRO 37 11.170 6.217 -0.109
307 H ARG 38 HN ARG 38 14.919 5.884 -0.058
308 HA ARG 38 HA ARG 38 17.572 6.257 -1.280
309 1HB ARG 38 HB2 ARG 38 18.425 5.122 0.632
310 2HB ARG 38 HB1 ARG 38 17.093 6.108 1.237
311 1HG ARG 38 HG2 ARG 38 15.827 3.762 0.497
312 2HG ARG 38 HG1 ARG 38 17.359 3.189 1.157
313 1HD ARG 38 HD2 ARG 38 16.124 5.331 2.747
314 2HD ARG 38 HD1 ARG 38 15.148 3.864 2.660
315 HE ARG 38 HE ARG 38 18.021 3.700 3.454
316 1HH1 ARG 38 HH1 ARG 38 15.529 4.435 5.307
317 2HH1 ARG 38 HH1 ARG 38 15.369 2.923 6.138
318 1HH2 ARG 38 HH2 ARG 38 17.448 1.204 3.960
319 2HH2 ARG 38 HH2 ARG 38 16.456 1.094 5.377
320 H ARG 39 HN ARG 39 15.290 4.745 -2.647
321 HA ARG 39 HA ARG 39 15.681 1.976 -2.687
322 1HB ARG 39 HB2 ARG 39 14.183 3.696 -4.165
323 2HB ARG 39 HB1 ARG 39 15.404 3.239 -5.354
324 1HG ARG 39 HG2 ARG 39 14.342 0.986 -3.774
325 2HG ARG 39 HG1 ARG 39 13.154 1.772 -4.816
326 1HD ARG 39 HD2 ARG 39 14.603 1.480 -6.757
327 2HD ARG 39 HD1 ARG 39 15.874 0.802 -5.740
328 HE ARG 39 HE ARG 39 14.442 -1.168 -5.384
329 1HH1 ARG 39 HH1 ARG 39 12.417 1.079 -6.775
330 2HH1 ARG 39 HH1 ARG 39 11.786 0.032 -8.002
331 1HH2 ARG 39 HH2 ARG 39 14.061 -2.509 -7.376
332 2HH2 ARG 39 HH2 ARG 39 12.719 -1.998 -8.344
333 H GLY 40 HN GLY 40 17.840 1.329 -2.464
334 1HA GLY 40 HA2 GLY 40 20.095 1.011 -3.074
335 2HA GLY 40 HA1 GLY 40 19.406 0.796 -4.684
336 HA PRO 41 HA PRO 41 20.903 5.351 -4.217
337 1HB PRO 41 HB2 PRO 41 22.804 5.708 -2.263
338 2HB PRO 41 HB1 PRO 41 21.068 5.943 -1.994
339 1HG PRO 41 HG2 PRO 41 22.816 3.696 -1.107
340 2HG PRO 41 HG1 PRO 41 21.315 4.302 -0.387
341 1HD PRO 41 HD2 PRO 41 21.564 1.987 -2.000
342 2HD PRO 41 HD1 PRO 41 20.044 2.786 -1.546
343 H ARG 42 HN ARG 42 23.268 6.350 -4.527
344 HA ARG 42 HA ARG 42 24.861 4.266 -5.942
345 1HB ARG 42 HB2 ARG 42 24.009 6.844 -6.697
346 2HB ARG 42 HB1 ARG 42 25.746 6.980 -6.418
347 1HG ARG 42 HG2 ARG 42 25.969 4.836 -7.821
348 2HG ARG 42 HG1 ARG 42 24.300 5.127 -8.316
349 1HD ARG 42 HD2 ARG 42 25.017 6.617 -9.839
350 2HD ARG 42 HD1 ARG 42 25.708 7.596 -8.546
351 HE ARG 42 HE ARG 42 27.555 5.536 -8.997
352 1HH1 ARG 42 HH2 ARG 42 28.227 8.426 -9.345
353 2HH1 ARG 42 HH2 ARG 42 28.606 8.516 -11.034
354 1HH2 ARG 42 HH1 ARG 42 27.104 5.487 -11.801
355 2HH2 ARG 42 HH1 ARG 42 27.969 6.851 -12.424
356 H LEU 43 HN LEU 43 24.828 5.649 -2.987
357 HA LEU 43 HA LEU 43 27.817 5.678 -2.828
358 1HB LEU 43 HB2 LEU 43 25.775 7.361 -1.355
359 2HB LEU 43 HB1 LEU 43 27.457 7.229 -0.840
360 HG LEU 43 HG LEU 43 27.272 7.767 -3.691
361 1HD1 LEU 43 HD1 LEU 43 25.284 8.990 -3.352
362 2HD1 LEU 43 HD1 LEU 43 26.545 10.216 -3.220
363 3HD1 LEU 43 HD1 LEU 43 25.800 9.559 -1.764
364 1HD2 LEU 43 HD2 LEU 43 29.079 8.142 -1.706
365 2HD2 LEU 43 HD2 LEU 43 28.369 9.754 -1.775
366 3HD2 LEU 43 HD2 LEU 43 29.108 9.054 -3.215
367 H GLY 44 HN GLY 44 26.851 3.243 -2.550
368 1HA GLY 44 HA2 GLY 44 27.584 2.329 -0.019
369 2HA GLY 44 HA1 GLY 44 25.843 2.598 0.085
Start of MODEL 4
1 1H SER 1 HT1 SER 1 -27.125 -14.349 -29.710
2 2H SER 1 HT2 SER 1 -27.881 -13.191 -28.724
3 3H SER 1 HT3 SER 1 -27.170 -14.568 -28.028
4 HA SER 1 HA SER 1 -25.526 -12.715 -29.618
5 1HB SER 1 HB2 SER 1 -26.150 -12.424 -26.665
6 2HB SER 1 HB1 SER 1 -25.041 -11.427 -27.602
7 HG SER 1 HG SER 1 -27.788 -11.384 -27.450
8 H THR 2 HN THR 2 -23.343 -12.658 -28.163
9 HA THR 2 HA THR 2 -22.795 -15.215 -26.837
10 HB THR 2 HB THR 2 -21.405 -14.536 -29.448
11 HG1 THR 2 HG1 THR 2 -22.891 -16.856 -29.000
12 1HG2 THR 2 HG2 THR 2 -20.900 -16.460 -27.247
13 2HG2 THR 2 HG2 THR 2 -19.768 -15.723 -28.381
14 3HG2 THR 2 HG2 THR 2 -20.753 -17.098 -28.884
15 H ASN 3 HN ASN 3 -20.679 -12.979 -28.644
16 HA ASN 3 HA ASN 3 -18.705 -12.756 -26.657
17 1HB ASN 3 HB2 ASN 3 -19.596 -10.961 -28.896
18 2HB ASN 3 HB1 ASN 3 -18.381 -10.382 -27.751
19 1HD2 ASN 3 HD2 ASN 3 -17.408 -10.660 -30.272
20 2HD2 ASN 3 HD2 ASN 3 -16.475 -12.069 -30.435
21 HA PRO 4 HA PRO 4 -20.556 -10.289 -23.531
22 1HB PRO 4 HB2 PRO 4 -18.266 -9.243 -22.427
23 2HB PRO 4 HB1 PRO 4 -18.792 -10.918 -22.186
24 1HG PRO 4 HG2 PRO 4 -16.588 -9.872 -23.904
25 2HG PRO 4 HG1 PRO 4 -16.758 -11.462 -23.141
26 1HD PRO 4 HD2 PRO 4 -17.254 -10.870 -25.864
27 2HD PRO 4 HD1 PRO 4 -17.737 -12.354 -25.014
28 H LYS 5 HN LYS 5 -19.030 -8.978 -26.221
29 HA LYS 5 HA LYS 5 -19.059 -6.832 -27.171
30 1HB LYS 5 HB2 LYS 5 -21.117 -6.422 -24.980
31 2HB LYS 5 HB1 LYS 5 -20.782 -5.251 -26.256
32 1HG LYS 5 HG2 LYS 5 -21.122 -7.642 -27.637
33 2HG LYS 5 HG1 LYS 5 -22.348 -7.714 -26.371
34 1HD LYS 5 HD2 LYS 5 -23.258 -5.574 -27.040
35 2HD LYS 5 HD1 LYS 5 -21.940 -5.321 -28.185
36 1HE LYS 5 HE2 LYS 5 -23.871 -7.648 -28.359
37 2HE LYS 5 HE1 LYS 5 -24.094 -6.133 -29.234
38 1HZ LYS 5 HZ1 LYS 5 -21.930 -8.123 -29.527
39 2HZ LYS 5 HZ2 LYS 5 -21.746 -6.527 -30.079
40 3HZ LYS 5 HZ3 LYS 5 -22.974 -7.513 -30.717
41 HA PRO 6 HA PRO 6 -16.208 -5.366 -23.878
42 1HB PRO 6 HB2 PRO 6 -13.993 -5.339 -25.508
43 2HB PRO 6 HB1 PRO 6 -14.507 -6.757 -24.578
44 1HG PRO 6 HG2 PRO 6 -14.748 -6.246 -27.506
45 2HG PRO 6 HG1 PRO 6 -14.648 -7.789 -26.640
46 1HD PRO 6 HD2 PRO 6 -17.009 -6.620 -27.680
47 2HD PRO 6 HD1 PRO 6 -16.931 -7.978 -26.538
48 H GLN 7 HN GLN 7 -15.926 -3.170 -23.582
49 HA GLN 7 HA GLN 7 -16.692 -1.333 -25.706
50 1HB GLN 7 HB2 GLN 7 -16.011 -1.156 -22.828
51 2HB GLN 7 HB1 GLN 7 -15.635 0.278 -23.785
52 1HG GLN 7 HG2 GLN 7 -18.220 -0.710 -24.561
53 2HG GLN 7 HG1 GLN 7 -18.175 -0.532 -22.807
54 1HE2 GLN 7 HE2 GLN 7 -19.729 1.216 -24.514
55 2HE2 GLN 7 HE2 GLN 7 -19.065 2.775 -24.399
56 H ARG 8 HN ARG 8 -13.889 -0.627 -23.712
57 HA ARG 8 HA ARG 8 -11.881 -1.212 -25.679
58 1HB ARG 8 HB2 ARG 8 -13.143 0.664 -26.824
59 2HB ARG 8 HB1 ARG 8 -12.638 1.717 -25.503
60 1HG ARG 8 HG2 ARG 8 -10.537 1.906 -26.320
61 2HG ARG 8 HG1 ARG 8 -10.418 0.173 -26.627
62 1HD ARG 8 HD2 ARG 8 -11.321 0.352 -28.768
63 2HD ARG 8 HD1 ARG 8 -12.158 1.860 -28.397
64 HE ARG 8 HE ARG 8 -9.931 2.987 -28.491
65 1HH1 ARG 8 HH2 ARG 8 -8.120 0.665 -28.324
66 2HH1 ARG 8 HH2 ARG 8 -7.689 0.388 -29.979
67 1HH2 ARG 8 HH1 ARG 8 -10.310 2.266 -31.253
68 2HH2 ARG 8 HH1 ARG 8 -8.929 1.294 -31.637
69 H LYS 9 HN LYS 9 -10.575 -1.837 -23.959
70 HA LYS 9 HA LYS 9 -9.271 0.293 -22.458
71 1HB LYS 9 HB2 LYS 9 -11.207 0.071 -21.026
72 2HB LYS 9 HB1 LYS 9 -11.065 -1.687 -21.028
73 1HG LYS 9 HG2 LYS 9 -9.511 -1.656 -19.389
74 2HG LYS 9 HG1 LYS 9 -8.587 -0.387 -20.193
75 1HD LYS 9 HD2 LYS 9 -10.608 1.131 -19.381
76 2HD LYS 9 HD1 LYS 9 -10.784 -0.143 -18.175
77 1HE LYS 9 HE2 LYS 9 -8.688 0.269 -17.236
78 2HE LYS 9 HE1 LYS 9 -8.066 1.017 -18.706
79 1HZ LYS 9 HZ1 LYS 9 -8.638 2.979 -17.898
80 2HZ LYS 9 HZ2 LYS 9 -9.268 2.255 -16.497
81 3HZ LYS 9 HZ3 LYS 9 -10.265 2.505 -17.850
82 H THR 10 HN THR 10 -9.685 -2.981 -21.225
83 HA THR 10 HA THR 10 -7.591 -4.295 -22.573
84 HB THR 10 HB THR 10 -5.990 -2.723 -21.799
85 HG1 THR 10 HG1 THR 10 -5.348 -4.838 -21.363
86 1HG2 THR 10 HG2 THR 10 -6.047 -2.472 -19.095
87 2HG2 THR 10 HG2 THR 10 -7.768 -2.656 -19.434
88 3HG2 THR 10 HG2 THR 10 -6.855 -1.353 -20.193
89 H LYS 11 HN LYS 11 -6.696 -6.152 -21.122
90 HA LYS 11 HA LYS 11 -8.880 -7.610 -20.046
91 1HB LYS 11 HB2 LYS 11 -5.916 -7.934 -19.477
92 2HB LYS 11 HB1 LYS 11 -7.157 -9.139 -19.131
93 1HG LYS 11 HG2 LYS 11 -7.725 -8.729 -21.716
94 2HG LYS 11 HG1 LYS 11 -6.018 -8.289 -21.755
95 1HD LYS 11 HD2 LYS 11 -5.387 -10.436 -20.808
96 2HD LYS 11 HD1 LYS 11 -7.081 -10.873 -20.581
97 1HE LYS 11 HE2 LYS 11 -6.045 -11.893 -22.632
98 2HE LYS 11 HE1 LYS 11 -7.459 -10.897 -22.974
99 1HZ LYS 11 HZ1 LYS 11 -6.239 -9.442 -24.113
100 2HZ LYS 11 HZ2 LYS 11 -5.026 -10.631 -24.137
101 3HZ LYS 11 HZ3 LYS 11 -5.002 -9.413 -22.953
102 H ARG 12 HN ARG 12 -8.651 -8.506 -17.630
103 HA ARG 12 HA ARG 12 -7.793 -6.469 -15.701
104 1HB ARG 12 HB2 ARG 12 -10.320 -6.145 -16.717
105 2HB ARG 12 HB1 ARG 12 -10.634 -7.156 -15.306
106 1HG ARG 12 HG2 ARG 12 -10.419 -5.347 -13.990
107 2HG ARG 12 HG1 ARG 12 -8.740 -5.195 -14.509
108 1HD ARG 12 HD2 ARG 12 -9.879 -4.114 -16.662
109 2HD ARG 12 HD1 ARG 12 -11.170 -3.772 -15.510
110 HE ARG 12 HE ARG 12 -9.774 -1.981 -14.882
111 1HH1 ARG 12 HH1 ARG 12 -7.541 -2.720 -16.777
112 2HH1 ARG 12 HH1 ARG 12 -6.226 -2.987 -15.681
113 1HH2 ARG 12 HH2 ARG 12 -8.260 -3.242 -12.884
114 2HH2 ARG 12 HH2 ARG 12 -6.633 -3.282 -13.477
115 H ASN 13 HN ASN 13 -6.595 -8.043 -14.625
116 HA ASN 13 HA ASN 13 -8.128 -10.393 -13.586
117 1HB ASN 13 HB2 ASN 13 -6.196 -10.964 -15.050
118 2HB ASN 13 HB1 ASN 13 -5.128 -10.100 -13.942
119 1HD2 ASN 13 HD2 ASN 13 -6.319 -13.172 -14.632
120 2HD2 ASN 13 HD2 ASN 13 -6.061 -13.896 -13.119
121 H THR 14 HN THR 14 -5.238 -8.491 -12.646
122 HA THR 14 HA THR 14 -6.471 -8.092 -9.969
123 HB THR 14 HB THR 14 -5.017 -10.107 -9.825
124 HG1 THR 14 HG1 THR 14 -4.016 -7.770 -8.570
125 1HG2 THR 14 HG2 THR 14 -3.348 -8.538 -11.504
126 2HG2 THR 14 HG2 THR 14 -3.060 -10.178 -10.924
127 3HG2 THR 14 HG2 THR 14 -2.471 -8.798 -9.997
128 H ASN 15 HN ASN 15 -6.686 -5.888 -10.850
129 HA ASN 15 HA ASN 15 -4.677 -4.255 -11.871
130 1HB ASN 15 HB2 ASN 15 -7.181 -3.739 -11.238
131 2HB ASN 15 HB1 ASN 15 -6.473 -3.154 -9.732
132 1HD2 ASN 15 HD2 ASN 15 -7.384 -1.003 -10.709
133 2HD2 ASN 15 HD2 ASN 15 -6.339 -0.135 -11.728
134 H ARG 16 HN ARG 16 -2.624 -4.723 -10.956
135 HA ARG 16 HA ARG 16 -2.176 -4.565 -8.092
136 1HB ARG 16 HB2 ARG 16 -0.754 -5.365 -10.504
137 2HB ARG 16 HB1 ARG 16 0.261 -4.411 -9.432
138 1HG ARG 16 HG2 ARG 16 -1.317 -6.295 -7.913
139 2HG ARG 16 HG1 ARG 16 -0.394 -7.130 -9.163
140 1HD ARG 16 HD2 ARG 16 0.786 -5.139 -7.203
141 2HD ARG 16 HD1 ARG 16 0.877 -6.891 -7.021
142 HE ARG 16 HE ARG 16 2.564 -5.314 -8.727
143 1HH1 ARG 16 HH1 ARG 16 1.068 -8.360 -8.209
144 2HH1 ARG 16 HH1 ARG 16 1.953 -9.166 -9.460
145 1HH2 ARG 16 HH2 ARG 16 3.594 -6.297 -10.512
146 2HH2 ARG 16 HH2 ARG 16 3.383 -7.998 -10.764
147 H ARG 17 HN ARG 17 -0.035 -3.213 -7.699
148 HA ARG 17 HA ARG 17 1.090 -1.040 -8.266
149 1HB ARG 17 HB2 ARG 17 -0.762 -0.258 -9.746
150 2HB ARG 17 HB1 ARG 17 -1.752 0.026 -8.320
151 1HG ARG 17 HG2 ARG 17 -0.765 2.130 -8.820
152 2HG ARG 17 HG1 ARG 17 0.162 1.491 -7.462
153 1HD ARG 17 HD2 ARG 17 1.903 0.693 -8.978
154 2HD ARG 17 HD1 ARG 17 0.962 1.217 -10.374
155 HE ARG 17 HE ARG 17 2.395 2.997 -8.489
156 1HH1 ARG 17 HH1 ARG 17 1.763 2.482 -11.682
157 2HH1 ARG 17 HH1 ARG 17 1.298 4.107 -12.064
158 1HH2 ARG 17 HH2 ARG 17 1.160 5.128 -8.753
159 2HH2 ARG 17 HH2 ARG 17 0.957 5.604 -10.406
160 HA PRO 18 HA PRO 18 -0.780 -0.002 -4.013
161 1HB PRO 18 HB2 PRO 18 -2.993 -1.390 -3.208
162 2HB PRO 18 HB1 PRO 18 -3.083 0.118 -4.110
163 1HG PRO 18 HG2 PRO 18 -3.622 -2.638 -5.054
164 2HG PRO 18 HG1 PRO 18 -4.238 -1.100 -5.681
165 1HD PRO 18 HD2 PRO 18 -2.124 -2.658 -6.774
166 2HD PRO 18 HD1 PRO 18 -2.599 -1.022 -7.266
167 H GLN 19 HN GLN 19 -1.139 -3.166 -5.185
168 HA GLN 19 HA GLN 19 -0.314 -4.536 -2.746
169 1HB GLN 19 HB2 GLN 19 -1.410 -5.162 -5.363
170 2HB GLN 19 HB1 GLN 19 -0.333 -6.351 -4.673
171 1HG GLN 19 HG2 GLN 19 -1.911 -7.040 -3.233
172 2HG GLN 19 HG1 GLN 19 -2.101 -5.389 -2.644
173 1HE2 GLN 19 HE2 GLN 19 -3.784 -4.060 -3.609
174 2HE2 GLN 19 HE2 GLN 19 -5.004 -4.735 -4.578
175 H ASP 20 HN ASP 20 1.494 -2.881 -3.658
176 HA ASP 20 HA ASP 20 3.821 -4.602 -4.101
177 1HB ASP 20 HB2 ASP 20 3.336 -4.188 -6.356
178 2HB ASP 20 HB1 ASP 20 2.901 -2.523 -6.081
179 H VAL 21 HN VAL 21 2.544 -1.303 -3.869
180 HA VAL 21 HA VAL 21 5.091 -0.401 -2.948
181 HB VAL 21 HB VAL 21 2.404 0.994 -2.893
182 1HG1 VAL 21 HG1 VAL 21 5.183 1.908 -2.156
183 2HG1 VAL 21 HG1 VAL 21 3.682 2.114 -1.255
184 3HG1 VAL 21 HG1 VAL 21 3.968 3.057 -2.717
185 1HG2 VAL 21 HG2 VAL 21 4.112 2.270 -4.685
186 2HG2 VAL 21 HG2 VAL 21 2.810 1.160 -5.114
187 3HG2 VAL 21 HG2 VAL 21 4.458 0.558 -4.931
188 H LYS 22 HN LYS 22 2.999 -2.307 -1.509
189 HA LYS 22 HA LYS 22 3.372 -1.195 1.168
190 1HB LYS 22 HB2 LYS 22 1.676 -2.973 1.739
191 2HB LYS 22 HB1 LYS 22 1.075 -1.741 0.618
192 1HG LYS 22 HG2 LYS 22 1.087 -3.157 -1.171
193 2HG LYS 22 HG1 LYS 22 2.510 -4.011 -0.580
194 1HD LYS 22 HD2 LYS 22 0.377 -5.362 -0.555
195 2HD LYS 22 HD1 LYS 22 1.248 -5.280 0.977
196 1HE LYS 22 HE2 LYS 22 -0.244 -3.388 1.664
197 2HE LYS 22 HE1 LYS 22 -1.169 -3.627 0.181
198 1HZ LYS 22 HZ1 LYS 22 -2.319 -5.172 1.244
199 2HZ LYS 22 HZ2 LYS 22 -1.326 -5.047 2.618
200 3HZ LYS 22 HZ3 LYS 22 -0.914 -6.116 1.363
201 H PHE 23 HN PHE 23 4.983 -2.916 -0.918
202 HA PHE 23 HA PHE 23 6.330 -4.793 -0.956
203 1HB PHE 23 HB2 PHE 23 6.779 -3.692 1.760
204 2HB PHE 23 HB1 PHE 23 7.915 -4.676 0.837
205 HD1 PHE 23 HD1 PHE 23 9.034 -3.818 -1.129
206 HD2 PHE 23 HD2 PHE 23 6.125 -1.471 0.974
207 HE1 PHE 23 HE1 PHE 23 9.588 -1.868 -2.540
208 HE2 PHE 23 HE2 PHE 23 6.685 0.487 -0.416
209 HZ PHE 23 HZ PHE 23 8.432 0.302 -2.179
210 HA PRO 24 HA PRO 24 3.026 -7.140 1.032
211 1HB PRO 24 HB2 PRO 24 2.267 -8.218 -1.362
212 2HB PRO 24 HB1 PRO 24 1.679 -6.655 -0.773
213 1HG PRO 24 HG2 PRO 24 3.676 -7.234 -2.908
214 2HG PRO 24 HG1 PRO 24 2.565 -5.866 -2.737
215 1HD PRO 24 HD2 PRO 24 5.302 -5.832 -2.080
216 2HD PRO 24 HD1 PRO 24 4.106 -4.626 -1.571
217 H GLY 25 HN GLY 25 6.017 -7.751 -0.338
218 1HA GLY 25 HA2 GLY 25 6.068 -10.482 -0.971
219 2HA GLY 25 HA1 GLY 25 7.409 -9.644 -0.184
220 H GLY 26 HN GLY 26 5.506 -8.933 2.082
221 1HA GLY 26 HA2 GLY 26 4.276 -10.404 3.720
222 2HA GLY 26 HA1 GLY 26 5.523 -11.613 3.409
223 H GLY 27 HN GLY 27 5.891 -8.090 3.927
224 1HA GLY 27 HA2 GLY 27 7.589 -8.787 6.288
225 2HA GLY 27 HA1 GLY 27 7.969 -7.460 5.189
226 H GLN 28 HN GLN 28 6.915 -5.494 5.467
227 HA GLN 28 HA GLN 28 4.862 -5.335 7.607
228 1HB GLN 28 HB2 GLN 28 7.552 -4.491 7.744
229 2HB GLN 28 HB1 GLN 28 6.577 -3.033 7.577
230 1HG GLN 28 HG2 GLN 28 5.048 -4.151 9.347
231 2HG GLN 28 HG1 GLN 28 6.458 -5.153 9.685
232 1HE2 GLN 28 HE2 GLN 28 7.324 -4.280 11.601
233 2HE2 GLN 28 HE2 GLN 28 7.683 -2.638 11.829
234 H ILE 29 HN ILE 29 6.352 -3.893 4.777
235 HA ILE 29 HA ILE 29 5.350 -2.667 3.030
236 HB ILE 29 HB ILE 29 3.080 -2.318 2.871
237 1HG1 ILE 29 HG1 ILE 29 1.757 -2.111 5.227
238 2HG1 ILE 29 HG1 ILE 29 3.327 -1.471 5.713
239 1HG2 ILE 29 HG2 ILE 29 2.274 -4.362 3.312
240 2HG2 ILE 29 HG2 ILE 29 2.361 -4.093 5.052
241 3HG2 ILE 29 HG2 ILE 29 3.774 -4.688 4.179
242 1HD1 ILE 29 HD1 ILE 29 3.127 0.389 4.413
243 2HD1 ILE 29 HD1 ILE 29 1.402 0.039 4.534
244 3HD1 ILE 29 HD1 ILE 29 2.311 -0.484 3.115
245 H VAL 30 HN VAL 30 5.904 -1.745 6.210
246 HA VAL 30 HA VAL 30 5.697 1.134 5.538
247 HB VAL 30 HB VAL 30 6.433 -0.239 8.136
248 1HG1 VAL 30 HG1 VAL 30 6.349 2.571 7.232
249 2HG1 VAL 30 HG1 VAL 30 7.219 1.851 8.588
250 3HG1 VAL 30 HG1 VAL 30 5.514 2.269 8.756
251 1HG2 VAL 30 HG2 VAL 30 4.214 -0.666 8.271
252 2HG2 VAL 30 HG2 VAL 30 3.875 0.306 6.839
253 3HG2 VAL 30 HG2 VAL 30 3.985 1.076 8.422
254 H GLY 31 HN GLY 31 7.773 -1.005 4.632
255 1HA GLY 31 HA2 GLY 31 10.111 0.659 5.371
256 2HA GLY 31 HA1 GLY 31 10.253 -1.080 5.337
257 H GLY 32 HN GLY 32 8.461 -1.011 2.801
258 1HA GLY 32 HA2 GLY 32 10.753 -0.639 1.062
259 2HA GLY 32 HA1 GLY 32 9.239 -1.263 0.508
260 H VAL 33 HN VAL 33 7.954 1.074 1.888
261 HA VAL 33 HA VAL 33 8.098 2.983 -0.324
262 HB VAL 33 HB VAL 33 6.707 2.944 2.365
263 1HG1 VAL 33 HG1 VAL 33 7.438 5.261 1.914
264 2HG1 VAL 33 HG1 VAL 33 5.687 5.117 1.754
265 3HG1 VAL 33 HG1 VAL 33 6.702 5.187 0.314
266 1HG2 VAL 33 HG2 VAL 33 4.694 3.156 0.792
267 2HG2 VAL 33 HG2 VAL 33 5.576 1.631 0.714
268 3HG2 VAL 33 HG2 VAL 33 5.820 2.856 -0.531
269 H TYR 34 HN TYR 34 9.818 2.183 2.334
270 HA TYR 34 HA TYR 34 11.107 4.798 2.788
271 1HB TYR 34 HB2 TYR 34 11.277 2.205 4.373
272 2HB TYR 34 HB1 TYR 34 11.711 3.823 4.930
273 HD1 TYR 34 HD1 TYR 34 10.059 5.319 5.770
274 HD2 TYR 34 HD2 TYR 34 8.846 1.740 3.742
275 HE1 TYR 34 HE1 TYR 34 7.704 5.791 6.322
276 HE2 TYR 34 HE2 TYR 34 6.504 2.206 4.290
277 HH TYR 34 HH TYR 34 5.439 5.206 5.428
278 H LEU 35 HN LEU 35 11.360 1.761 1.300
279 HA LEU 35 HA LEU 35 14.304 1.750 1.100
280 1HB LEU 35 HB2 LEU 35 12.080 -0.097 0.180
281 2HB LEU 35 HB1 LEU 35 13.754 -0.341 -0.307
282 HG LEU 35 HG LEU 35 13.197 0.107 2.577
283 1HD1 LEU 35 HD1 LEU 35 11.801 -1.665 2.731
284 2HD1 LEU 35 HD1 LEU 35 13.146 -2.686 2.220
285 3HD1 LEU 35 HD1 LEU 35 12.020 -2.047 1.023
286 1HD2 LEU 35 HD2 LEU 35 15.166 -1.467 0.910
287 2HD2 LEU 35 HD2 LEU 35 15.034 -1.705 2.652
288 3HD2 LEU 35 HD2 LEU 35 15.492 -0.128 2.011
289 H LEU 36 HN LEU 36 11.944 3.476 -0.143
290 HA LEU 36 HA LEU 36 12.413 3.248 -2.990
291 1HB LEU 36 HB2 LEU 36 10.994 5.460 -1.493
292 2HB LEU 36 HB1 LEU 36 10.839 5.074 -3.202
293 HG LEU 36 HG LEU 36 9.970 3.402 -0.848
294 1HD1 LEU 36 HD1 LEU 36 8.671 5.101 -2.896
295 2HD1 LEU 36 HD1 LEU 36 8.118 4.668 -1.279
296 3HD1 LEU 36 HD1 LEU 36 7.894 3.543 -2.618
297 1HD2 LEU 36 HD2 LEU 36 10.486 2.686 -3.718
298 2HD2 LEU 36 HD2 LEU 36 9.142 1.916 -2.876
299 3HD2 LEU 36 HD2 LEU 36 10.785 1.736 -2.263
300 HA PRO 37 HA PRO 37 14.799 7.320 -2.278
301 1HB PRO 37 HB2 PRO 37 15.483 7.942 0.314
302 2HB PRO 37 HB1 PRO 37 13.986 8.480 -0.460
303 1HG PRO 37 HG2 PRO 37 14.368 6.336 1.580
304 2HG PRO 37 HG1 PRO 37 12.946 7.344 1.260
305 1HD PRO 37 HD2 PRO 37 13.293 4.663 0.422
306 2HD PRO 37 HD1 PRO 37 12.055 5.782 -0.163
307 H ARG 38 HN ARG 38 16.450 6.501 0.667
308 HA ARG 38 HA ARG 38 18.682 5.439 -0.890
309 1HB ARG 38 HB2 ARG 38 19.866 5.825 1.327
310 2HB ARG 38 HB1 ARG 38 19.194 7.252 0.539
311 1HG ARG 38 HG2 ARG 38 17.643 7.610 2.150
312 2HG ARG 38 HG1 ARG 38 17.339 5.888 2.378
313 1HD ARG 38 HD2 ARG 38 18.403 6.395 4.379
314 2HD ARG 38 HD1 ARG 38 19.785 5.921 3.393
315 HE ARG 38 HE ARG 38 19.478 8.477 4.542
316 1HH1 ARG 38 HH1 ARG 38 21.960 7.597 3.128
317 2HH1 ARG 38 HH1 ARG 38 22.016 8.680 1.777
318 1HH2 ARG 38 HH2 ARG 38 18.700 9.646 2.074
319 2HH2 ARG 38 HH2 ARG 38 20.170 9.840 1.180
320 H ARG 39 HN ARG 39 18.621 4.513 2.344
321 HA ARG 39 HA ARG 39 18.048 1.711 1.567
322 1HB ARG 39 HB2 ARG 39 20.148 2.915 3.037
323 2HB ARG 39 HB1 ARG 39 19.191 1.993 4.194
324 1HG ARG 39 HG2 ARG 39 19.278 0.063 2.538
325 2HG ARG 39 HG1 ARG 39 20.488 0.996 1.655
326 1HD ARG 39 HD2 ARG 39 21.746 -0.414 3.097
327 2HD ARG 39 HD1 ARG 39 21.752 1.162 3.886
328 HE ARG 39 HE ARG 39 19.639 0.071 5.117
329 1HH1 ARG 39 HH2 ARG 39 20.804 -2.571 3.936
330 2HH1 ARG 39 HH2 ARG 39 21.629 -3.182 5.332
331 1HH2 ARG 39 HH1 ARG 39 21.500 -0.175 7.053
332 2HH2 ARG 39 HH1 ARG 39 22.021 -1.826 7.096
333 H GLY 40 HN GLY 40 16.898 4.367 3.423
334 1HA GLY 40 HA2 GLY 40 14.607 4.308 4.290
335 2HA GLY 40 HA1 GLY 40 14.827 2.590 4.629
336 HA PRO 41 HA PRO 41 17.273 5.014 7.975
337 1HB PRO 41 HB2 PRO 41 16.830 7.727 8.052
338 2HB PRO 41 HB1 PRO 41 18.136 6.973 7.121
339 1HG PRO 41 HG2 PRO 41 15.577 8.154 6.147
340 2HG PRO 41 HG1 PRO 41 17.122 7.971 5.301
341 1HD PRO 41 HD2 PRO 41 14.841 6.323 4.972
342 2HD PRO 41 HD1 PRO 41 16.479 5.973 4.381
343 H ARG 42 HN ARG 42 16.537 5.663 10.131
344 HA ARG 42 HA ARG 42 13.567 5.610 10.368
345 1HB ARG 42 HB2 ARG 42 14.106 5.069 12.801
346 2HB ARG 42 HB1 ARG 42 14.589 3.846 11.627
347 1HG ARG 42 HG2 ARG 42 16.794 4.142 12.060
348 2HG ARG 42 HG1 ARG 42 16.640 5.899 12.074
349 1HD ARG 42 HD2 ARG 42 15.305 5.251 14.363
350 2HD ARG 42 HD1 ARG 42 16.526 3.979 14.319
351 HE ARG 42 HE ARG 42 18.188 5.625 14.702
352 1HH1 ARG 42 HH1 ARG 42 15.357 6.946 15.591
353 2HH1 ARG 42 HH1 ARG 42 15.735 8.589 15.191
354 1HH2 ARG 42 HH2 ARG 42 18.603 7.778 13.420
355 2HH2 ARG 42 HH2 ARG 42 17.573 9.059 13.963
356 H LEU 43 HN LEU 43 12.860 7.719 10.328
357 HA LEU 43 HA LEU 43 14.227 9.630 12.182
358 1HB LEU 43 HB2 LEU 43 12.935 10.044 9.488
359 2HB LEU 43 HB1 LEU 43 13.113 11.383 10.622
360 HG LEU 43 HG LEU 43 15.603 10.521 10.778
361 1HD1 LEU 43 HD1 LEU 43 14.504 9.267 8.277
362 2HD1 LEU 43 HD1 LEU 43 15.618 8.588 9.464
363 3HD1 LEU 43 HD1 LEU 43 16.184 9.803 8.316
364 1HD2 LEU 43 HD2 LEU 43 14.684 12.714 9.834
365 2HD2 LEU 43 HD2 LEU 43 14.716 11.934 8.252
366 3HD2 LEU 43 HD2 LEU 43 16.215 12.166 9.151
367 H GLY 44 HN GLY 44 12.520 8.234 13.554
368 1HA GLY 44 HA2 GLY 44 9.750 9.107 13.301
369 2HA GLY 44 HA1 GLY 44 10.417 8.154 14.627