Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
546830 | 2lic RC | 17888 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 GLU 1 H1 GLU 1 16.414 -1.803 -9.626
2 H2 GLU 1 H2 GLU 1 18.008 -2.243 -9.272
3 H3 GLU 1 H3 GLU 1 17.604 -0.612 -9.450
4 HA GLU 1 HA GLU 1 16.298 -0.618 -7.491
5 HB2 GLU 1 HB2 GLU 1 16.012 -2.612 -6.130
6 HB3 GLU 1 HB3 GLU 1 15.406 -2.903 -7.753
7 HG2 GLU 1 HG2 GLU 1 18.134 -3.756 -6.825
8 HG3 GLU 1 HG3 GLU 1 16.703 -4.781 -6.733
9 H LYS 2 HN LYS 2 19.339 -1.247 -8.515
10 HA LYS 2 HA LYS 2 20.628 -1.368 -5.923
11 HB2 LYS 2 HB2 LYS 2 21.776 -1.106 -8.707
12 HB3 LYS 2 HB3 LYS 2 22.730 -1.302 -7.242
13 HG2 LYS 2 HG2 LYS 2 21.593 -3.469 -6.853
14 HG3 LYS 2 HG3 LYS 2 20.778 -3.276 -8.406
15 HD2 LYS 2 HD2 LYS 2 22.935 -3.228 -9.542
16 HD3 LYS 2 HD3 LYS 2 23.766 -3.382 -7.992
17 HE2 LYS 2 HE2 LYS 2 21.915 -5.400 -9.257
18 HE3 LYS 2 HE3 LYS 2 23.665 -5.535 -9.096
19 HZ1 LYS 2 HZ1 LYS 2 22.569 -6.816 -7.393
20 HZ2 LYS 2 HZ2 LYS 2 21.705 -5.462 -6.868
21 HZ3 LYS 2 HZ3 LYS 2 23.384 -5.516 -6.677
22 H LEU 3 HN LEU 3 21.008 0.358 -4.735
23 HA LEU 3 HA LEU 3 22.100 2.754 -5.776
24 HB2 LEU 3 HB2 LEU 3 19.625 2.900 -6.350
25 HB3 LEU 3 HB3 LEU 3 19.334 3.021 -4.628
26 HG LEU 3 HG LEU 3 20.922 5.042 -4.689
27 HD11 LEU 3 HD11 LEU 3 20.228 4.852 -7.615
28 HD12 LEU 3 HD12 LEU 3 21.043 6.203 -6.825
29 HD13 LEU 3 HD13 LEU 3 21.831 4.629 -6.918
30 HD21 LEU 3 HD21 LEU 3 19.097 6.526 -5.270
31 HD22 LEU 3 HD22 LEU 3 18.256 5.205 -6.082
32 HD23 LEU 3 HD23 LEU 3 18.498 5.154 -4.336
33 H LYS 4 HN LYS 4 22.245 0.649 -3.695
34 HA LYS 4 HA LYS 4 22.737 0.357 -1.481
35 HB2 LYS 4 HB2 LYS 4 23.922 3.107 -1.876
36 HB3 LYS 4 HB3 LYS 4 24.348 1.978 -0.599
37 HG2 LYS 4 HG2 LYS 4 24.685 1.366 -3.522
38 HG3 LYS 4 HG3 LYS 4 25.946 2.083 -2.522
39 HD2 LYS 4 HD2 LYS 4 25.942 0.147 -1.067
40 HD3 LYS 4 HD3 LYS 4 24.595 -0.555 -1.964
41 HE2 LYS 4 HE2 LYS 4 27.332 0.034 -3.086
42 HE3 LYS 4 HE3 LYS 4 26.758 -1.554 -2.581
43 HZ1 LYS 4 HZ1 LYS 4 26.569 -1.260 -4.970
44 HZ2 LYS 4 HZ2 LYS 4 25.582 0.098 -4.754
45 HZ3 LYS 4 HZ3 LYS 4 25.037 -1.430 -4.271
46 H GLN 5 HN GLN 5 20.703 0.320 -0.536
47 HA GLN 5 HA GLN 5 19.546 2.831 0.388
48 HB2 GLN 5 HB2 GLN 5 18.510 0.005 0.677
49 HB3 GLN 5 HB3 GLN 5 17.624 1.477 1.058
50 HG2 GLN 5 HG2 GLN 5 17.741 2.138 -1.303
51 HG3 GLN 5 HG3 GLN 5 18.574 0.626 -1.669
52 HE21 GLN 5 HE21 GLN 5 17.429 -1.313 -1.591
53 HE22 GLN 5 HE22 GLN 5 15.702 -1.359 -1.604
54 H ASP 6 HN ASP 6 18.437 2.484 2.691
55 HA ASP 6 HA ASP 6 18.784 2.535 4.933
56 HB2 ASP 6 HB2 ASP 6 20.471 0.088 4.365
57 HB3 ASP 6 HB3 ASP 6 19.848 0.566 5.938
58 H ILE 7 HN ILE 7 19.940 4.516 4.802
59 HA ILE 7 HA ILE 7 22.798 4.210 5.418
60 HB ILE 7 HB ILE 7 21.583 6.456 3.808
61 HG12 ILE 7 HG12 ILE 7 21.743 4.364 2.523
62 HG13 ILE 7 HG13 ILE 7 22.880 5.569 1.930
63 HG21 ILE 7 HG21 ILE 7 24.438 5.926 4.620
64 HG22 ILE 7 HG22 ILE 7 23.920 7.181 3.494
65 HG23 ILE 7 HG23 ILE 7 23.408 7.245 5.181
66 HD11 ILE 7 HD11 ILE 7 23.853 3.326 2.010
67 HD12 ILE 7 HD12 ILE 7 24.699 4.451 3.072
68 HD13 ILE 7 HD13 ILE 7 23.574 3.276 3.751
69 H LEU 8 HN LEU 8 20.060 6.462 5.585
70 HA LEU 8 HA LEU 8 20.704 7.016 8.368
71 HB2 LEU 8 HB2 LEU 8 21.755 8.704 6.644
72 HB3 LEU 8 HB3 LEU 8 20.123 9.346 6.591
73 HG LEU 8 HG LEU 8 20.219 9.671 9.058
74 HD11 LEU 8 HD11 LEU 8 22.312 9.497 10.218
75 HD12 LEU 8 HD12 LEU 8 21.955 7.945 9.461
76 HD13 LEU 8 HD13 LEU 8 23.143 9.026 8.735
77 HD21 LEU 8 HD21 LEU 8 21.711 11.617 8.976
78 HD22 LEU 8 HD22 LEU 8 22.372 11.037 7.446
79 HD23 LEU 8 HD23 LEU 8 20.678 11.520 7.550
80 H ASN 9 HN ASN 9 18.505 6.407 5.952
81 HA ASN 9 HA ASN 9 16.261 7.766 7.213
82 HB2 ASN 9 HB2 ASN 9 16.375 5.972 4.779
83 HB3 ASN 9 HB3 ASN 9 14.944 6.833 5.337
84 HD21 ASN 9 HD21 ASN 9 18.034 7.097 3.801
85 HD22 ASN 9 HD22 ASN 9 17.856 8.727 3.257
86 H LEU 10 HN LEU 10 17.814 4.725 7.287
87 HA LEU 10 HA LEU 10 17.381 2.767 8.357
88 HB2 LEU 10 HB2 LEU 10 17.071 4.285 10.277
89 HB3 LEU 10 HB3 LEU 10 15.372 4.436 9.873
90 HG LEU 10 HG LEU 10 15.174 1.941 10.228
91 HD11 LEU 10 HD11 LEU 10 17.540 1.390 10.016
92 HD12 LEU 10 HD12 LEU 10 17.892 2.320 11.471
93 HD13 LEU 10 HD13 LEU 10 16.901 0.866 11.573
94 HD21 LEU 10 HD21 LEU 10 14.385 3.544 11.876
95 HD22 LEU 10 HD22 LEU 10 15.096 2.140 12.669
96 HD23 LEU 10 HD23 LEU 10 16.003 3.651 12.570
97 H ARG 11 HN ARG 11 16.562 1.677 6.590
98 HA ARG 11 HA ARG 11 15.069 0.419 5.439
99 HB2 ARG 11 HB2 ARG 11 13.268 1.085 7.768
100 HB3 ARG 11 HB3 ARG 11 12.861 -0.065 6.503
101 HG2 ARG 11 HG2 ARG 11 14.843 -1.395 7.123
102 HG3 ARG 11 HG3 ARG 11 15.150 -0.265 8.445
103 HD2 ARG 11 HD2 ARG 11 12.626 -1.877 8.098
104 HD3 ARG 11 HD3 ARG 11 13.959 -2.311 9.166
105 HE ARG 11 HE ARG 11 13.235 0.236 9.897
106 HH11 ARG 11 HH12 ARG 11 11.639 -2.853 9.673
107 HH12 ARG 11 HH11 ARG 11 10.546 -2.527 10.976
108 HH21 ARG 11 HH22 ARG 11 11.802 0.674 11.613
109 HH22 ARG 11 HH21 ARG 11 10.641 -0.521 12.080
110 H THR 12 HN THR 12 13.453 0.607 3.885
111 HA THR 12 HA THR 12 12.360 1.742 2.243
112 HB THR 12 HB THR 12 10.454 3.104 2.963
113 HG1 THR 12 HG1 THR 12 10.319 3.905 4.948
114 HG21 THR 12 HG21 THR 12 9.327 1.406 4.347
115 HG22 THR 12 HG22 THR 12 10.885 0.634 4.645
116 HG23 THR 12 HG23 THR 12 10.223 0.684 3.012
117 H ASP 13 HN ASP 13 14.034 2.858 1.266
118 HA ASP 13 HA ASP 13 14.788 5.482 2.237
119 HB2 ASP 13 HB2 ASP 13 16.498 3.988 1.292
120 HB3 ASP 13 HB3 ASP 13 15.648 3.988 -0.252
121 H ILE 14 HN ILE 14 13.252 6.990 1.942
122 HA ILE 14 HA ILE 14 11.815 8.424 0.916
123 HB ILE 14 HB ILE 14 13.306 7.642 -1.594
124 HG12 ILE 14 HG12 ILE 14 13.799 9.938 0.318
125 HG13 ILE 14 HG13 ILE 14 14.772 8.474 0.233
126 HG21 ILE 14 HG21 ILE 14 11.185 8.767 -2.046
127 HG22 ILE 14 HG22 ILE 14 11.652 10.088 -0.976
128 HG23 ILE 14 HG23 ILE 14 12.554 9.796 -2.462
129 HD11 ILE 14 HD11 ILE 14 15.880 10.258 -0.931
130 HD12 ILE 14 HD12 ILE 14 15.352 9.042 -2.096
131 HD13 ILE 14 HD13 ILE 14 14.450 10.548 -1.923
132 H SER 15 HN SER 15 9.883 7.371 1.224
133 HA SER 15 HA SER 15 8.934 5.716 -1.023
134 HB2 SER 15 HB2 SER 15 7.435 4.591 0.586
135 HB3 SER 15 HB3 SER 15 9.129 4.400 1.036
136 HG SER 15 HG SER 15 8.553 6.475 2.315
137 H THR 16 HN THR 16 7.092 6.308 -2.026
138 HA THR 16 HA THR 16 6.044 8.905 -1.606
139 HB THR 16 HB THR 16 4.404 8.358 -3.331
140 HG1 THR 16 HG1 THR 16 5.262 5.860 -3.933
141 HG21 THR 16 HG21 THR 16 5.936 7.805 -5.146
142 HG22 THR 16 HG22 THR 16 7.124 7.216 -3.983
143 HG23 THR 16 HG23 THR 16 6.697 8.927 -4.018
144 H SER 17 HN SER 17 5.161 5.758 -0.440
145 HA SER 17 HA SER 17 2.489 6.194 0.250
146 HB2 SER 17 HB2 SER 17 2.807 4.361 1.883
147 HB3 SER 17 HB3 SER 17 3.505 3.970 0.312
148 HG SER 17 HG SER 17 4.723 4.280 2.740
149 H SEP 18 HN SER 18 1.681 7.731 1.508
150 HA SEP 18 HA SER 18 2.757 8.180 4.144
151 HB2 SEP 18 HB2 SER 18 3.040 10.621 3.851
152 HB3 SEP 18 HB3 SER 18 4.165 9.702 2.853
153 H SER 19 HN SER 19 0.641 9.831 1.782
154 HA SER 19 HA SER 19 -1.616 9.410 3.594
155 HB2 SER 19 HB2 SER 19 -0.915 12.115 2.438
156 HB3 SER 19 HB3 SER 19 -2.325 11.740 3.426
157 HG SER 19 HG SER 19 -1.047 11.481 5.177
158 H SER 20 HN SER 20 -0.754 8.338 0.965
159 HA SER 20 HA SER 20 -2.840 9.383 -0.805
160 HB2 SER 20 HB2 SER 20 -0.583 7.445 -1.366
161 HB3 SER 20 HB3 SER 20 -1.734 8.040 -2.562
162 HG SER 20 HG SER 20 0.305 9.192 -2.475
163 H ILE 21 HN ILE 21 -4.541 8.177 -1.525
164 HA ILE 21 HA ILE 21 -4.735 5.355 -0.879
165 HB ILE 21 HB ILE 21 -5.550 6.412 1.180
166 HG12 ILE 21 HG12 ILE 21 -7.837 5.372 1.207
167 HG13 ILE 21 HG13 ILE 21 -7.686 5.119 -0.529
168 HG21 ILE 21 HG21 ILE 21 -6.278 8.538 0.270
169 HG22 ILE 21 HG22 ILE 21 -7.583 7.739 -0.606
170 HG23 ILE 21 HG23 ILE 21 -7.593 7.770 1.158
171 HD11 ILE 21 HD11 ILE 21 -5.925 3.931 1.602
172 HD12 ILE 21 HD12 ILE 21 -7.172 3.091 0.679
173 HD13 ILE 21 HD13 ILE 21 -5.729 3.698 -0.136
174 H SER 22 HN SER 22 -6.190 4.257 -2.180
175 HA SER 22 HA SER 22 -8.140 5.615 -3.777
176 HB2 SER 22 HB2 SER 22 -6.148 6.214 -5.060
177 HB3 SER 22 HB3 SER 22 -5.675 4.518 -5.151
178 HG SER 22 HG SER 22 -8.226 4.983 -6.026
179 H SER 23 HN SER 23 -9.759 4.224 -3.619
180 HA SER 23 HA SER 23 -10.987 2.314 -3.634
181 HB2 SER 23 HB2 SER 23 -8.782 1.358 -5.474
182 HB3 SER 23 HB3 SER 23 -10.356 0.586 -5.279
183 HG SER 23 HG SER 23 -9.988 2.194 -7.080
184 H SER 24 HN SER 24 -8.487 2.614 -1.821
185 HA SER 24 HA SER 24 -7.448 1.434 -0.176
186 HB2 SER 24 HB2 SER 24 -9.802 1.070 0.500
187 HB3 SER 24 HB3 SER 24 -9.839 -0.402 -0.473
188 HG SER 24 HG SER 24 -7.727 -0.570 1.094
189 H GLU 25 HN GLU 25 -6.780 0.802 -2.940
190 HA GLU 25 HA GLU 25 -5.485 -0.645 -4.119
191 HB2 GLU 25 HB2 GLU 25 -5.025 -1.874 -1.395
192 HB3 GLU 25 HB3 GLU 25 -4.099 -2.254 -2.839
193 HG2 GLU 25 HG2 GLU 25 -3.266 0.004 -2.952
194 HG3 GLU 25 HG3 GLU 25 -4.279 0.478 -1.588
195 H GLU 26 HN GLU 26 -5.067 -3.221 -4.314
196 HA GLU 26 HA GLU 26 -7.763 -4.401 -4.392
197 HB2 GLU 26 HB2 GLU 26 -5.355 -5.013 -6.113
198 HB3 GLU 26 HB3 GLU 26 -6.923 -5.798 -6.242
199 HG2 GLU 26 HG2 GLU 26 -6.344 -2.885 -6.731
200 HG3 GLU 26 HG3 GLU 26 -6.651 -4.113 -7.960
201 H ASN 27 HN ASN 27 -5.016 -4.515 -2.624
202 HA ASN 27 HA ASN 27 -5.176 -7.416 -2.166
203 HB2 ASN 27 HB2 ASN 27 -2.993 -5.438 -1.481
204 HB3 ASN 27 HB3 ASN 27 -2.974 -7.135 -1.016
205 HD21 ASN 27 HD21 ASN 27 -1.118 -5.655 -2.687
206 HD22 ASN 27 HD22 ASN 27 -1.092 -6.461 -4.214
207 H ASP 28 HN ASP 28 -6.880 -7.562 -0.760
208 HA ASP 28 HA ASP 28 -6.342 -6.878 1.971
209 HB2 ASP 28 HB2 ASP 28 -8.383 -5.526 2.318
210 HB3 ASP 28 HB3 ASP 28 -7.237 -4.735 1.239
211 H PHE 29 HN PHE 29 -7.006 -9.189 0.184
212 HA PHE 29 HA PHE 29 -8.561 -10.668 1.986
213 HB2 PHE 29 HB2 PHE 29 -10.405 -9.270 1.031
214 HB3 PHE 29 HB3 PHE 29 -10.054 -9.961 -0.550
215 HD1 PHE 29 HD2 PHE 29 -11.064 -10.869 2.905
216 HD2 PHE 29 HD1 PHE 29 -11.021 -11.970 -1.205
217 HE1 PHE 29 HE2 PHE 29 -12.562 -12.755 3.400
218 HE2 PHE 29 HE1 PHE 29 -12.519 -13.860 -0.718
219 HZ PHE 29 HZ PHE 29 -13.293 -14.252 1.595
220 H TRP 30 HN TRP 30 -6.566 -11.782 1.505
221 HA TRP 30 HA TRP 30 -5.448 -13.547 0.658
222 HB2 TRP 30 HB2 TRP 30 -7.986 -13.962 -0.922
223 HB3 TRP 30 HB3 TRP 30 -6.629 -15.084 -0.914
224 HD1 TRP 30 HD1 TRP 30 -9.715 -14.194 0.947
225 HE1 TRP 30 HE1 TRP 30 -9.938 -15.661 3.056
226 HE3 TRP 30 HE3 TRP 30 -5.040 -16.230 0.994
227 HZ2 TRP 30 HZ2 TRP 30 -8.328 -17.447 4.540
228 HZ3 TRP 30 HZ3 TRP 30 -4.452 -17.806 2.789
229 HH2 TRP 30 HH2 TRP 30 -6.063 -18.401 4.526
230 H GLN 31 HN GLN 31 -3.872 -13.612 -0.738
231 HA GLN 31 HA GLN 31 -4.121 -12.026 -3.197
232 HB2 GLN 31 HB2 GLN 31 -1.616 -12.627 -1.614
233 HB3 GLN 31 HB3 GLN 31 -1.705 -11.639 -3.065
234 HG2 GLN 31 HG2 GLN 31 -2.933 -9.952 -1.948
235 HG3 GLN 31 HG3 GLN 31 -3.198 -10.982 -0.541
236 HE21 GLN 31 HE21 GLN 31 -1.993 -8.335 -0.709
237 HE22 GLN 31 HE22 GLN 31 -0.406 -8.487 -0.047
238 HA PRO 32 HA PRO 32 -3.485 -16.431 -4.503
239 HB2 PRO 32 HB2 PRO 32 -5.309 -15.754 -6.680
240 HB3 PRO 32 HB3 PRO 32 -5.459 -17.011 -5.450
241 HG2 PRO 32 HG2 PRO 32 -7.045 -14.818 -5.503
242 HG3 PRO 32 HG3 PRO 32 -6.590 -15.640 -3.997
243 HD2 PRO 32 HD2 PRO 32 -5.472 -13.136 -5.204
244 HD3 PRO 32 HD3 PRO 32 -5.842 -13.506 -3.507
245 H LYS 33 HN LYS 33 -1.529 -16.515 -5.428
246 HA LYS 33 HA LYS 33 -0.946 -14.827 -7.743
247 HB2 LYS 33 HB2 LYS 33 1.385 -15.535 -7.403
248 HB3 LYS 33 HB3 LYS 33 0.701 -14.836 -5.942
249 HG2 LYS 33 HG2 LYS 33 0.196 -17.266 -5.268
250 HG3 LYS 33 HG3 LYS 33 1.344 -17.697 -6.534
251 HD2 LYS 33 HD2 LYS 33 3.059 -16.345 -5.458
252 HD3 LYS 33 HD3 LYS 33 1.907 -15.861 -4.211
253 HE2 LYS 33 HE2 LYS 33 1.683 -18.209 -3.526
254 HE3 LYS 33 HE3 LYS 33 2.865 -18.670 -4.752
255 HZ1 LYS 33 HZ1 LYS 33 4.528 -17.365 -3.626
256 HZ2 LYS 33 HZ2 LYS 33 3.844 -18.459 -2.533
257 HZ3 LYS 33 HZ3 LYS 33 3.400 -16.828 -2.484
258 HA PRO 34 HA PRO 34 -1.393 -17.989 -10.784
259 HB2 PRO 34 HB2 PRO 34 0.962 -17.702 -12.214
260 HB3 PRO 34 HB3 PRO 34 -0.491 -16.726 -12.449
261 HG2 PRO 34 HG2 PRO 34 1.982 -16.104 -10.888
262 HG3 PRO 34 HG3 PRO 34 1.010 -15.039 -11.924
263 HD2 PRO 34 HD2 PRO 34 0.822 -14.932 -9.256
264 HD3 PRO 34 HD3 PRO 34 -0.611 -14.727 -10.288
265 H THR 35 HN THR 35 -1.282 -19.903 -9.672
266 HA THR 35 HA THR 35 1.078 -20.974 -8.541
267 HB THR 35 HB THR 35 -1.386 -22.501 -9.404
268 HG1 THR 35 HG1 THR 35 -1.386 -22.054 -6.802
269 HG21 THR 35 HG21 THR 35 0.715 -23.103 -7.317
270 HG22 THR 35 HG22 THR 35 0.538 -23.921 -8.870
271 HG23 THR 35 HG23 THR 35 -0.721 -24.074 -7.644
Start of MODEL 2
1 H1 GLU 1 H1 GLU 1 25.798 3.386 -0.795
2 H2 GLU 1 H2 GLU 1 26.278 1.772 -0.636
3 H3 GLU 1 H3 GLU 1 27.384 2.933 -1.175
4 HA GLU 1 HA GLU 1 27.838 2.383 1.103
5 HB2 GLU 1 HB2 GLU 1 26.568 5.114 0.814
6 HB3 GLU 1 HB3 GLU 1 27.711 4.644 2.065
7 HG2 GLU 1 HG2 GLU 1 29.428 4.285 0.383
8 HG3 GLU 1 HG3 GLU 1 28.284 4.710 -0.890
9 H LYS 2 HN LYS 2 26.980 3.273 3.392
10 HA LYS 2 HA LYS 2 24.586 1.744 3.877
11 HB2 LYS 2 HB2 LYS 2 25.026 2.307 6.264
12 HB3 LYS 2 HB3 LYS 2 26.381 1.528 5.458
13 HG2 LYS 2 HG2 LYS 2 27.410 3.755 5.138
14 HG3 LYS 2 HG3 LYS 2 26.091 4.459 6.074
15 HD2 LYS 2 HD2 LYS 2 26.719 3.077 7.996
16 HD3 LYS 2 HD3 LYS 2 28.039 2.375 7.058
17 HE2 LYS 2 HE2 LYS 2 27.729 5.270 7.847
18 HE3 LYS 2 HE3 LYS 2 28.884 4.118 8.516
19 HZ1 LYS 2 HZ1 LYS 2 28.808 5.051 5.697
20 HZ2 LYS 2 HZ2 LYS 2 29.918 3.948 6.338
21 HZ3 LYS 2 HZ3 LYS 2 29.916 5.552 6.873
22 H LEU 3 HN LEU 3 25.215 4.929 3.050
23 HA LEU 3 HA LEU 3 23.005 6.070 4.524
24 HB2 LEU 3 HB2 LEU 3 24.943 7.229 2.533
25 HB3 LEU 3 HB3 LEU 3 23.610 8.145 3.207
26 HG LEU 3 HG LEU 3 24.612 7.596 5.502
27 HD11 LEU 3 HD11 LEU 3 26.118 5.827 4.776
28 HD12 LEU 3 HD12 LEU 3 26.994 6.973 3.762
29 HD13 LEU 3 HD13 LEU 3 27.014 7.153 5.517
30 HD21 LEU 3 HD21 LEU 3 26.128 9.371 3.594
31 HD22 LEU 3 HD22 LEU 3 24.676 9.813 4.491
32 HD23 LEU 3 HD23 LEU 3 26.174 9.468 5.354
33 H LYS 4 HN LYS 4 21.754 7.752 2.928
34 HA LYS 4 HA LYS 4 19.944 7.860 1.553
35 HB2 LYS 4 HB2 LYS 4 21.646 6.303 -0.384
36 HB3 LYS 4 HB3 LYS 4 20.418 7.508 -0.747
37 HG2 LYS 4 HG2 LYS 4 23.048 8.050 0.616
38 HG3 LYS 4 HG3 LYS 4 22.682 8.367 -1.078
39 HD2 LYS 4 HD2 LYS 4 20.945 9.946 -0.424
40 HD3 LYS 4 HD3 LYS 4 21.263 9.606 1.278
41 HE2 LYS 4 HE2 LYS 4 22.339 11.680 0.595
42 HE3 LYS 4 HE3 LYS 4 23.541 10.463 1.021
43 HZ1 LYS 4 HZ1 LYS 4 22.709 11.199 -1.735
44 HZ2 LYS 4 HZ2 LYS 4 23.837 10.001 -1.342
45 HZ3 LYS 4 HZ3 LYS 4 24.168 11.622 -0.989
46 H GLN 5 HN GLN 5 19.070 6.186 3.175
47 HA GLN 5 HA GLN 5 17.780 4.364 3.602
48 HB2 GLN 5 HB2 GLN 5 17.408 4.362 0.602
49 HB3 GLN 5 HB3 GLN 5 16.375 3.551 1.769
50 HG2 GLN 5 HG2 GLN 5 16.773 6.519 1.476
51 HG3 GLN 5 HG3 GLN 5 15.342 5.594 1.027
52 HE21 GLN 5 HE21 GLN 5 15.495 3.901 3.405
53 HE22 GLN 5 HE22 GLN 5 14.956 4.878 4.722
54 H ASP 6 HN ASP 6 17.286 2.007 2.274
55 HA ASP 6 HA ASP 6 19.966 0.789 2.193
56 HB2 ASP 6 HB2 ASP 6 17.322 -0.479 2.943
57 HB3 ASP 6 HB3 ASP 6 18.881 -1.299 2.924
58 H ILE 7 HN ILE 7 20.583 0.405 0.173
59 HA ILE 7 HA ILE 7 18.580 -0.319 -1.841
60 HB ILE 7 HB ILE 7 21.482 0.189 -2.438
61 HG12 ILE 7 HG12 ILE 7 19.337 2.318 -2.256
62 HG13 ILE 7 HG13 ILE 7 20.597 2.075 -1.050
63 HG21 ILE 7 HG21 ILE 7 20.550 0.956 -4.591
64 HG22 ILE 7 HG22 ILE 7 20.126 -0.717 -4.230
65 HG23 ILE 7 HG23 ILE 7 18.933 0.563 -4.009
66 HD11 ILE 7 HD11 ILE 7 22.295 2.585 -2.722
67 HD12 ILE 7 HD12 ILE 7 21.034 2.820 -3.933
68 HD13 ILE 7 HD13 ILE 7 21.140 3.906 -2.547
69 H LEU 8 HN LEU 8 19.698 -2.112 0.300
70 HA LEU 8 HA LEU 8 21.019 -4.132 -1.369
71 HB2 LEU 8 HB2 LEU 8 20.838 -3.808 1.621
72 HB3 LEU 8 HB3 LEU 8 21.474 -5.251 0.856
73 HG LEU 8 HG LEU 8 23.215 -3.807 -0.240
74 HD11 LEU 8 HD11 LEU 8 22.149 -1.658 -0.123
75 HD12 LEU 8 HD12 LEU 8 22.078 -1.742 1.636
76 HD13 LEU 8 HD13 LEU 8 23.636 -1.606 0.823
77 HD21 LEU 8 HD21 LEU 8 23.138 -3.841 2.772
78 HD22 LEU 8 HD22 LEU 8 23.710 -5.144 1.731
79 HD23 LEU 8 HD23 LEU 8 24.579 -3.611 1.782
80 H ASN 9 HN ASN 9 18.086 -3.338 0.098
81 HA ASN 9 HA ASN 9 17.055 -6.039 -0.418
82 HB2 ASN 9 HB2 ASN 9 15.471 -5.712 1.474
83 HB3 ASN 9 HB3 ASN 9 17.156 -5.763 1.984
84 HD21 ASN 9 HD21 ASN 9 14.330 -3.800 1.610
85 HD22 ASN 9 HD22 ASN 9 14.905 -2.437 2.502
86 H LEU 10 HN LEU 10 16.477 -2.580 -0.434
87 HA LEU 10 HA LEU 10 14.320 -3.011 -2.368
88 HB2 LEU 10 HB2 LEU 10 14.149 -1.327 0.119
89 HB3 LEU 10 HB3 LEU 10 13.089 -1.076 -1.253
90 HG LEU 10 HG LEU 10 13.291 -3.666 0.287
91 HD11 LEU 10 HD11 LEU 10 11.244 -1.458 0.445
92 HD12 LEU 10 HD12 LEU 10 11.095 -3.042 1.205
93 HD13 LEU 10 HD13 LEU 10 12.374 -1.937 1.710
94 HD21 LEU 10 HD21 LEU 10 11.220 -4.222 -0.910
95 HD22 LEU 10 HD22 LEU 10 11.352 -2.717 -1.819
96 HD23 LEU 10 HD23 LEU 10 12.576 -3.973 -2.012
97 H ARG 11 HN ARG 11 14.958 -2.054 -4.161
98 HA ARG 11 HA ARG 11 16.976 -0.117 -4.343
99 HB2 ARG 11 HB2 ARG 11 14.791 -0.789 -6.323
100 HB3 ARG 11 HB3 ARG 11 16.238 0.140 -6.688
101 HG2 ARG 11 HG2 ARG 11 17.635 -1.767 -6.257
102 HG3 ARG 11 HG3 ARG 11 16.245 -2.708 -5.711
103 HD2 ARG 11 HD2 ARG 11 16.898 -3.289 -8.000
104 HD3 ARG 11 HD3 ARG 11 15.275 -2.607 -7.934
105 HE ARG 11 HE ARG 11 17.234 -0.613 -8.476
106 HH11 ARG 11 HH12 ARG 11 15.400 -3.193 -9.933
107 HH12 ARG 11 HH11 ARG 11 15.465 -2.514 -11.525
108 HH21 ARG 11 HH22 ARG 11 17.326 0.286 -10.572
109 HH22 ARG 11 HH21 ARG 11 16.561 -0.540 -11.888
110 H THR 12 HN THR 12 16.832 1.822 -3.435
111 HA THR 12 HA THR 12 16.037 3.833 -2.727
112 HB THR 12 HB THR 12 14.864 5.187 -4.443
113 HG1 THR 12 HG1 THR 12 15.073 2.904 -6.122
114 HG21 THR 12 HG21 THR 12 17.218 3.599 -5.470
115 HG22 THR 12 HG22 THR 12 17.302 5.034 -4.448
116 HG23 THR 12 HG23 THR 12 16.677 5.158 -6.093
117 H ASP 13 HN ASP 13 14.765 3.235 -0.990
118 HA ASP 13 HA ASP 13 11.865 3.201 -1.516
119 HB2 ASP 13 HB2 ASP 13 12.661 1.001 -0.745
120 HB3 ASP 13 HB3 ASP 13 13.342 1.754 0.694
121 H ILE 14 HN ILE 14 11.136 5.159 -0.976
122 HA ILE 14 HA ILE 14 12.295 6.585 1.292
123 HB ILE 14 HB ILE 14 10.167 7.522 -0.638
124 HG12 ILE 14 HG12 ILE 14 13.138 8.103 -0.651
125 HG13 ILE 14 HG13 ILE 14 12.329 6.990 -1.749
126 HG21 ILE 14 HG21 ILE 14 10.779 9.762 0.174
127 HG22 ILE 14 HG22 ILE 14 10.140 8.735 1.458
128 HG23 ILE 14 HG23 ILE 14 11.877 9.024 1.340
129 HD11 ILE 14 HD11 ILE 14 11.016 8.839 -2.652
130 HD12 ILE 14 HD12 ILE 14 11.836 9.952 -1.556
131 HD13 ILE 14 HD13 ILE 14 12.750 9.123 -2.817
132 H SER 15 HN SER 15 9.408 4.899 0.349
133 HA SER 15 HA SER 15 7.519 4.302 1.454
134 HB2 SER 15 HB2 SER 15 9.064 3.362 3.091
135 HB3 SER 15 HB3 SER 15 9.203 4.927 3.892
136 HG SER 15 HG SER 15 7.217 4.710 4.703
137 H THR 16 HN THR 16 6.248 5.982 0.675
138 HA THR 16 HA THR 16 5.437 7.906 2.713
139 HB THR 16 HB THR 16 5.323 9.738 1.001
140 HG1 THR 16 HG1 THR 16 6.587 7.738 -0.516
141 HG21 THR 16 HG21 THR 16 8.079 8.653 1.597
142 HG22 THR 16 HG22 THR 16 7.116 9.679 2.662
143 HG23 THR 16 HG23 THR 16 7.704 10.310 1.122
144 H SER 17 HN SER 17 4.855 6.830 -0.629
145 HA SER 17 HA SER 17 2.964 6.310 -1.767
146 HB2 SER 17 HB2 SER 17 1.932 5.797 1.028
147 HB3 SER 17 HB3 SER 17 1.063 5.361 -0.443
148 HG SER 17 HG SER 17 3.552 4.441 -0.630
149 H SEP 18 HN SER 18 0.541 6.862 -1.969
150 HA SEP 18 HA SER 18 -0.448 9.210 -0.724
151 HB2 SEP 18 HB2 SER 18 -0.326 10.751 -2.627
152 HB3 SEP 18 HB3 SER 18 1.293 10.271 -2.121
153 H SER 19 HN SER 19 -2.523 8.641 -0.636
154 HA SER 19 HA SER 19 -3.978 8.133 -3.082
155 HB2 SER 19 HB2 SER 19 -3.240 5.883 -2.571
156 HB3 SER 19 HB3 SER 19 -3.811 6.035 -0.909
157 HG SER 19 HG SER 19 -5.202 5.466 -3.202
158 H SER 20 HN SER 20 -4.202 7.955 0.468
159 HA SER 20 HA SER 20 -5.706 8.791 1.950
160 HB2 SER 20 HB2 SER 20 -5.156 10.952 0.924
161 HB3 SER 20 HB3 SER 20 -6.380 10.686 -0.316
162 HG SER 20 HG SER 20 -6.764 11.889 1.916
163 H ILE 21 HN ILE 21 -8.175 9.362 2.162
164 HA ILE 21 HA ILE 21 -10.321 8.615 2.074
165 HB ILE 21 HB ILE 21 -9.718 7.857 -0.786
166 HG12 ILE 21 HG12 ILE 21 -10.823 10.460 0.292
167 HG13 ILE 21 HG13 ILE 21 -9.165 10.232 -0.250
168 HG21 ILE 21 HG21 ILE 21 -12.327 8.509 0.581
169 HG22 ILE 21 HG22 ILE 21 -12.116 8.096 -1.121
170 HG23 ILE 21 HG23 ILE 21 -11.780 6.894 0.127
171 HD11 ILE 21 HD11 ILE 21 -11.639 9.984 -1.943
172 HD12 ILE 21 HD12 ILE 21 -10.485 11.317 -1.957
173 HD13 ILE 21 HD13 ILE 21 -9.987 9.713 -2.497
174 H SER 22 HN SER 22 -10.615 6.903 3.344
175 HA SER 22 HA SER 22 -10.631 4.772 4.144
176 HB2 SER 22 HB2 SER 22 -11.458 3.075 2.619
177 HB3 SER 22 HB3 SER 22 -12.279 4.599 2.287
178 HG SER 22 HG SER 22 -11.586 3.576 0.369
179 H SER 23 HN SER 23 -9.781 2.339 3.078
180 HA SER 23 HA SER 23 -6.963 2.689 2.402
181 HB2 SER 23 HB2 SER 23 -7.898 1.111 4.811
182 HB3 SER 23 HB3 SER 23 -6.243 1.162 4.203
183 HG SER 23 HG SER 23 -6.153 3.340 4.711
184 H SER 24 HN SER 24 -9.653 1.469 1.423
185 HA SER 24 HA SER 24 -9.148 -1.325 1.157
186 HB2 SER 24 HB2 SER 24 -11.426 -0.436 1.050
187 HB3 SER 24 HB3 SER 24 -11.016 0.481 -0.398
188 HG SER 24 HG SER 24 -11.536 -2.222 -0.091
189 H GLU 25 HN GLU 25 -8.292 -2.470 -0.522
190 HA GLU 25 HA GLU 25 -6.901 -0.894 -2.588
191 HB2 GLU 25 HB2 GLU 25 -5.462 -2.165 -0.985
192 HB3 GLU 25 HB3 GLU 25 -6.191 -3.651 -1.573
193 HG2 GLU 25 HG2 GLU 25 -4.042 -3.300 -2.610
194 HG3 GLU 25 HG3 GLU 25 -5.328 -3.188 -3.813
195 H GLU 26 HN GLU 26 -7.215 -1.358 -4.705
196 HA GLU 26 HA GLU 26 -9.507 -2.846 -5.452
197 HB2 GLU 26 HB2 GLU 26 -8.881 -2.310 -7.746
198 HB3 GLU 26 HB3 GLU 26 -8.730 -0.894 -6.716
199 HG2 GLU 26 HG2 GLU 26 -6.310 -1.259 -6.586
200 HG3 GLU 26 HG3 GLU 26 -6.474 -2.655 -7.649
201 H ASN 27 HN ASN 27 -6.423 -3.846 -4.678
202 HA ASN 27 HA ASN 27 -6.596 -6.238 -6.376
203 HB2 ASN 27 HB2 ASN 27 -4.494 -4.951 -6.532
204 HB3 ASN 27 HB3 ASN 27 -4.237 -5.176 -4.804
205 HD21 ASN 27 HD21 ASN 27 -4.239 -6.686 -7.927
206 HD22 ASN 27 HD22 ASN 27 -3.415 -8.130 -7.456
207 H ASP 28 HN ASP 28 -7.806 -7.712 -5.338
208 HA ASP 28 HA ASP 28 -6.805 -8.816 -2.870
209 HB2 ASP 28 HB2 ASP 28 -8.938 -8.615 -1.651
210 HB3 ASP 28 HB3 ASP 28 -8.235 -7.040 -1.998
211 H PHE 29 HN PHE 29 -7.331 -9.579 -5.698
212 HA PHE 29 HA PHE 29 -8.993 -11.944 -5.140
213 HB2 PHE 29 HB2 PHE 29 -10.175 -10.318 -6.610
214 HB3 PHE 29 HB3 PHE 29 -8.865 -10.465 -7.776
215 HD1 PHE 29 HD2 PHE 29 -11.605 -12.292 -6.113
216 HD2 PHE 29 HD1 PHE 29 -8.773 -12.275 -9.290
217 HE1 PHE 29 HE2 PHE 29 -12.748 -14.216 -7.136
218 HE2 PHE 29 HE1 PHE 29 -9.911 -14.199 -10.320
219 HZ PHE 29 HZ PHE 29 -11.900 -15.173 -9.241
220 H TRP 30 HN TRP 30 -6.064 -10.655 -6.348
221 HA TRP 30 HA TRP 30 -5.340 -13.154 -7.677
222 HB2 TRP 30 HB2 TRP 30 -4.098 -10.415 -7.615
223 HB3 TRP 30 HB3 TRP 30 -3.209 -11.811 -8.220
224 HD1 TRP 30 HD1 TRP 30 -5.748 -9.264 -9.245
225 HE1 TRP 30 HE1 TRP 30 -6.544 -9.744 -11.647
226 HE3 TRP 30 HE3 TRP 30 -3.725 -13.916 -9.847
227 HZ2 TRP 30 HZ2 TRP 30 -6.340 -11.825 -13.546
228 HZ3 TRP 30 HZ3 TRP 30 -4.072 -15.087 -11.986
229 HH2 TRP 30 HH2 TRP 30 -5.353 -14.062 -13.794
230 H GLN 31 HN GLN 31 -2.820 -11.271 -6.221
231 HA GLN 31 HA GLN 31 -2.601 -13.112 -3.968
232 HB2 GLN 31 HB2 GLN 31 -0.392 -12.669 -5.983
233 HB3 GLN 31 HB3 GLN 31 -0.206 -13.522 -4.456
234 HG2 GLN 31 HG2 GLN 31 -1.840 -15.188 -5.201
235 HG3 GLN 31 HG3 GLN 31 -1.986 -14.342 -6.741
236 HE21 GLN 31 HE21 GLN 31 -0.275 -14.407 -8.203
237 HE22 GLN 31 HE22 GLN 31 0.984 -15.583 -8.087
238 HA PRO 32 HA PRO 32 -1.566 -8.658 -2.980
239 HB2 PRO 32 HB2 PRO 32 -3.358 -9.111 -0.701
240 HB3 PRO 32 HB3 PRO 32 -3.395 -7.833 -1.917
241 HG2 PRO 32 HG2 PRO 32 -5.245 -9.784 -1.844
242 HG3 PRO 32 HG3 PRO 32 -4.690 -9.063 -3.366
243 HD2 PRO 32 HD2 PRO 32 -3.913 -11.670 -2.109
244 HD3 PRO 32 HD3 PRO 32 -4.256 -11.298 -3.813
245 H LYS 33 HN LYS 33 -1.683 -11.634 -1.155
246 HA LYS 33 HA LYS 33 0.033 -10.572 0.935
247 HB2 LYS 33 HB2 LYS 33 -1.325 -13.223 0.511
248 HB3 LYS 33 HB3 LYS 33 -0.103 -13.010 1.757
249 HG2 LYS 33 HG2 LYS 33 -2.248 -12.753 2.762
250 HG3 LYS 33 HG3 LYS 33 -1.476 -11.168 2.706
251 HD2 LYS 33 HD2 LYS 33 -2.772 -10.672 0.644
252 HD3 LYS 33 HD3 LYS 33 -3.609 -12.212 0.845
253 HE2 LYS 33 HE2 LYS 33 -4.462 -11.474 3.008
254 HE3 LYS 33 HE3 LYS 33 -3.597 -9.947 2.838
255 HZ1 LYS 33 HZ1 LYS 33 -4.937 -9.487 0.853
256 HZ2 LYS 33 HZ2 LYS 33 -5.892 -9.662 2.238
257 HZ3 LYS 33 HZ3 LYS 33 -5.807 -10.917 1.107
258 HA PRO 34 HA PRO 34 3.838 -11.811 -0.942
259 HB2 PRO 34 HB2 PRO 34 4.891 -12.329 1.756
260 HB3 PRO 34 HB3 PRO 34 5.402 -11.133 0.562
261 HG2 PRO 34 HG2 PRO 34 4.099 -10.424 2.799
262 HG3 PRO 34 HG3 PRO 34 3.852 -9.573 1.262
263 HD2 PRO 34 HD2 PRO 34 2.132 -11.642 2.582
264 HD3 PRO 34 HD3 PRO 34 1.658 -10.150 1.742
265 H THR 35 HN THR 35 1.853 -13.890 0.720
266 HA THR 35 HA THR 35 1.683 -16.151 0.885
267 HB THR 35 HB THR 35 3.844 -16.193 -1.233
268 HG1 THR 35 HG1 THR 35 2.214 -16.034 -2.690
269 HG21 THR 35 HG21 THR 35 3.549 -18.363 -0.162
270 HG22 THR 35 HG22 THR 35 2.903 -18.396 -1.802
271 HG23 THR 35 HG23 THR 35 1.808 -18.274 -0.425
Start of MODEL 3
1 H1 GLU 1 H1 GLU 1 33.936 9.288 5.142
2 H2 GLU 1 H2 GLU 1 34.978 8.011 5.522
3 H3 GLU 1 H3 GLU 1 35.598 9.439 4.861
4 HA GLU 1 HA GLU 1 34.254 9.235 7.490
5 HB2 GLU 1 HB2 GLU 1 36.464 9.499 8.482
6 HB3 GLU 1 HB3 GLU 1 36.414 8.060 7.477
7 HG2 GLU 1 HG2 GLU 1 37.521 10.694 6.546
8 HG3 GLU 1 HG3 GLU 1 38.497 9.435 7.301
9 H LYS 2 HN LYS 2 34.686 11.116 4.878
10 HA LYS 2 HA LYS 2 34.803 13.580 6.490
11 HB2 LYS 2 HB2 LYS 2 35.734 13.224 3.635
12 HB3 LYS 2 HB3 LYS 2 35.795 14.716 4.563
13 HG2 LYS 2 HG2 LYS 2 37.376 13.702 6.113
14 HG3 LYS 2 HG3 LYS 2 37.300 12.187 5.208
15 HD2 LYS 2 HD2 LYS 2 38.169 13.344 3.225
16 HD3 LYS 2 HD3 LYS 2 38.265 14.843 4.149
17 HE2 LYS 2 HE2 LYS 2 39.856 13.799 5.683
18 HE3 LYS 2 HE3 LYS 2 39.755 12.297 4.768
19 HZ1 LYS 2 HZ1 LYS 2 40.637 13.474 2.836
20 HZ2 LYS 2 HZ2 LYS 2 41.708 13.548 4.143
21 HZ3 LYS 2 HZ3 LYS 2 40.765 14.896 3.745
22 H LEU 3 HN LEU 3 32.973 11.643 4.434
23 HA LEU 3 HA LEU 3 31.015 13.780 4.113
24 HB2 LEU 3 HB2 LEU 3 31.675 11.786 1.951
25 HB3 LEU 3 HB3 LEU 3 30.483 13.067 1.857
26 HG LEU 3 HG LEU 3 32.578 14.611 2.302
27 HD11 LEU 3 HD11 LEU 3 33.810 12.170 1.028
28 HD12 LEU 3 HD12 LEU 3 34.590 13.740 1.227
29 HD13 LEU 3 HD13 LEU 3 34.155 12.787 2.644
30 HD21 LEU 3 HD21 LEU 3 31.167 14.740 0.339
31 HD22 LEU 3 HD22 LEU 3 32.866 14.817 -0.131
32 HD23 LEU 3 HD23 LEU 3 31.956 13.323 -0.352
33 H LYS 4 HN LYS 4 29.033 13.225 4.739
34 HA LYS 4 HA LYS 4 28.544 10.415 5.418
35 HB2 LYS 4 HB2 LYS 4 27.070 12.916 6.265
36 HB3 LYS 4 HB3 LYS 4 26.737 11.287 6.841
37 HG2 LYS 4 HG2 LYS 4 28.660 11.196 8.110
38 HG3 LYS 4 HG3 LYS 4 29.469 12.449 7.164
39 HD2 LYS 4 HD2 LYS 4 28.878 13.367 9.305
40 HD3 LYS 4 HD3 LYS 4 27.847 14.101 8.076
41 HE2 LYS 4 HE2 LYS 4 26.052 12.530 8.668
42 HE3 LYS 4 HE3 LYS 4 27.085 11.831 9.915
43 HZ1 LYS 4 HZ1 LYS 4 25.537 13.438 10.843
44 HZ2 LYS 4 HZ2 LYS 4 26.145 14.648 9.832
45 HZ3 LYS 4 HZ3 LYS 4 27.130 13.975 11.029
46 H GLN 5 HN GLN 5 25.827 10.334 5.496
47 HA GLN 5 HA GLN 5 23.961 9.969 4.261
48 HB2 GLN 5 HB2 GLN 5 25.106 12.167 2.534
49 HB3 GLN 5 HB3 GLN 5 23.500 11.482 2.331
50 HG2 GLN 5 HG2 GLN 5 24.510 12.939 4.764
51 HG3 GLN 5 HG3 GLN 5 23.418 13.584 3.541
52 HE21 GLN 5 HE21 GLN 5 23.020 13.252 6.409
53 HE22 GLN 5 HE22 GLN 5 21.620 12.257 6.587
54 H ASP 6 HN ASP 6 26.013 10.823 1.497
55 HA ASP 6 HA ASP 6 26.166 7.998 0.753
56 HB2 ASP 6 HB2 ASP 6 25.136 10.162 -1.095
57 HB3 ASP 6 HB3 ASP 6 25.416 8.479 -1.534
58 H ILE 7 HN ILE 7 28.300 7.701 0.684
59 HA ILE 7 HA ILE 7 30.117 9.757 -0.181
60 HB ILE 7 HB ILE 7 30.625 6.855 0.502
61 HG12 ILE 7 HG12 ILE 7 31.734 8.022 2.532
62 HG13 ILE 7 HG13 ILE 7 30.765 9.417 2.073
63 HG21 ILE 7 HG21 ILE 7 32.568 9.106 0.014
64 HG22 ILE 7 HG22 ILE 7 32.994 7.519 0.655
65 HG23 ILE 7 HG23 ILE 7 32.352 7.666 -0.981
66 HD11 ILE 7 HD11 ILE 7 28.737 8.158 2.383
67 HD12 ILE 7 HD12 ILE 7 29.661 6.695 2.714
68 HD13 ILE 7 HD13 ILE 7 29.730 8.055 3.835
69 H LEU 8 HN LEU 8 28.661 6.879 -1.517
70 HA LEU 8 HA LEU 8 30.202 7.184 -3.992
71 HB2 LEU 8 HB2 LEU 8 28.486 4.943 -2.936
72 HB3 LEU 8 HB3 LEU 8 29.082 4.979 -4.583
73 HG LEU 8 HG LEU 8 30.489 3.540 -3.273
74 HD11 LEU 8 HD11 LEU 8 31.890 6.152 -3.811
75 HD12 LEU 8 HD12 LEU 8 32.664 4.580 -3.621
76 HD13 LEU 8 HD13 LEU 8 31.590 4.873 -4.988
77 HD21 LEU 8 HD21 LEU 8 29.986 4.497 -1.067
78 HD22 LEU 8 HD22 LEU 8 31.719 4.301 -1.331
79 HD23 LEU 8 HD23 LEU 8 30.983 5.898 -1.461
80 H ASN 9 HN ASN 9 27.694 8.622 -2.799
81 HA ASN 9 HA ASN 9 25.874 9.702 -3.611
82 HB2 ASN 9 HB2 ASN 9 27.564 10.113 -5.499
83 HB3 ASN 9 HB3 ASN 9 26.694 8.864 -6.384
84 HD21 ASN 9 HD21 ASN 9 25.166 11.088 -4.164
85 HD22 ASN 9 HD22 ASN 9 24.278 11.970 -5.355
86 H LEU 10 HN LEU 10 26.006 6.646 -3.264
87 HA LEU 10 HA LEU 10 23.734 5.857 -4.924
88 HB2 LEU 10 HB2 LEU 10 25.645 4.324 -4.766
89 HB3 LEU 10 HB3 LEU 10 25.442 4.241 -3.027
90 HG LEU 10 HG LEU 10 23.187 3.229 -3.397
91 HD11 LEU 10 HD11 LEU 10 22.685 2.305 -5.606
92 HD12 LEU 10 HD12 LEU 10 22.763 4.066 -5.638
93 HD13 LEU 10 HD13 LEU 10 24.107 3.114 -6.266
94 HD21 LEU 10 HD21 LEU 10 24.046 1.023 -4.017
95 HD22 LEU 10 HD22 LEU 10 25.533 1.769 -4.603
96 HD23 LEU 10 HD23 LEU 10 25.123 1.846 -2.888
97 H ARG 11 HN ARG 11 21.969 6.823 -4.042
98 HA ARG 11 HA ARG 11 21.402 7.276 -1.379
99 HB2 ARG 11 HB2 ARG 11 19.401 6.619 -3.546
100 HB3 ARG 11 HB3 ARG 11 19.065 7.474 -2.046
101 HG2 ARG 11 HG2 ARG 11 20.579 9.278 -2.770
102 HG3 ARG 11 HG3 ARG 11 20.825 8.426 -4.296
103 HD2 ARG 11 HD2 ARG 11 19.168 10.151 -4.601
104 HD3 ARG 11 HD3 ARG 11 18.397 8.570 -4.728
105 HE ARG 11 HE ARG 11 18.245 9.574 -2.076
106 HH11 ARG 11 HH12 ARG 11 16.841 9.913 -5.250
107 HH12 ARG 11 HH11 ARG 11 15.317 10.482 -4.654
108 HH21 ARG 11 HH22 ARG 11 16.246 10.323 -1.286
109 HH22 ARG 11 HH21 ARG 11 14.981 10.719 -2.402
110 H THR 12 HN THR 12 21.380 5.867 0.224
111 HA THR 12 HA THR 12 19.734 3.470 -0.004
112 HB THR 12 HB THR 12 21.962 2.668 -0.608
113 HG1 THR 12 HG1 THR 12 21.437 0.963 0.513
114 HG21 THR 12 HG21 THR 12 23.301 4.387 0.502
115 HG22 THR 12 HG22 THR 12 23.816 2.773 0.995
116 HG23 THR 12 HG23 THR 12 22.826 3.752 2.077
117 H ASP 13 HN ASP 13 20.210 6.183 1.542
118 HA ASP 13 HA ASP 13 20.353 5.339 4.284
119 HB2 ASP 13 HB2 ASP 13 19.524 8.012 3.131
120 HB3 ASP 13 HB3 ASP 13 19.937 7.691 4.813
121 H ILE 14 HN ILE 14 17.978 5.059 2.034
122 HA ILE 14 HA ILE 14 15.870 5.168 4.087
123 HB ILE 14 HB ILE 14 15.549 6.989 2.478
124 HG12 ILE 14 HG12 ILE 14 13.520 4.774 2.098
125 HG13 ILE 14 HG13 ILE 14 13.596 5.837 3.498
126 HG21 ILE 14 HG21 ILE 14 16.675 6.001 0.563
127 HG22 ILE 14 HG22 ILE 14 15.395 4.798 0.412
128 HG23 ILE 14 HG23 ILE 14 15.041 6.503 0.131
129 HD11 ILE 14 HD11 ILE 14 13.161 7.759 2.045
130 HD12 ILE 14 HD12 ILE 14 13.047 6.672 0.661
131 HD13 ILE 14 HD13 ILE 14 11.872 6.558 1.971
132 H SER 15 HN SER 15 14.487 3.468 4.205
133 HA SER 15 HA SER 15 14.511 1.415 2.147
134 HB2 SER 15 HB2 SER 15 15.258 0.820 5.020
135 HB3 SER 15 HB3 SER 15 14.985 -0.389 3.767
136 HG SER 15 HG SER 15 17.040 -0.137 3.409
137 H THR 16 HN THR 16 12.930 3.265 4.388
138 HA THR 16 HA THR 16 10.697 1.375 4.671
139 HB THR 16 HB THR 16 11.154 3.967 6.161
140 HG1 THR 16 HG1 THR 16 12.592 2.696 7.116
141 HG21 THR 16 HG21 THR 16 8.795 3.330 6.007
142 HG22 THR 16 HG22 THR 16 9.393 3.144 7.656
143 HG23 THR 16 HG23 THR 16 9.183 1.724 6.627
144 H SER 17 HN SER 17 9.361 1.568 2.978
145 HA SER 17 HA SER 17 8.261 4.226 2.421
146 HB2 SER 17 HB2 SER 17 9.958 3.837 0.693
147 HB3 SER 17 HB3 SER 17 9.210 2.292 0.290
148 HG SER 17 HG SER 17 8.292 3.606 -1.139
149 H SEP 18 HN SER 18 6.186 4.149 1.289
150 HA SEP 18 HA SER 18 4.776 1.593 1.678
151 HB2 SEP 18 HB2 SER 18 4.164 3.172 3.463
152 HB3 SEP 18 HB3 SER 18 3.694 4.364 2.248
153 H SER 19 HN SER 19 4.016 0.829 -0.167
154 HA SER 19 HA SER 19 4.020 2.258 -2.587
155 HB2 SER 19 HB2 SER 19 2.793 0.305 -3.500
156 HB3 SER 19 HB3 SER 19 4.191 -0.174 -2.538
157 HG SER 19 HG SER 19 2.321 -1.400 -2.032
158 H SER 20 HN SER 20 2.044 2.467 -4.009
159 HA SER 20 HA SER 20 0.102 4.085 -2.625
160 HB2 SER 20 HB2 SER 20 0.974 4.800 -4.802
161 HB3 SER 20 HB3 SER 20 0.326 3.342 -5.554
162 HG SER 20 HG SER 20 -0.973 5.647 -4.719
163 H ILE 21 HN ILE 21 0.365 0.846 -3.069
164 HA ILE 21 HA ILE 21 -2.194 0.057 -3.930
165 HB ILE 21 HB ILE 21 -0.330 -1.408 -2.056
166 HG12 ILE 21 HG12 ILE 21 -0.617 -1.627 -5.063
167 HG13 ILE 21 HG13 ILE 21 0.687 -0.776 -4.240
168 HG21 ILE 21 HG21 ILE 21 -2.612 -2.282 -2.006
169 HG22 ILE 21 HG22 ILE 21 -2.594 -2.440 -3.764
170 HG23 ILE 21 HG23 ILE 21 -1.508 -3.421 -2.779
171 HD11 ILE 21 HD11 ILE 21 1.434 -2.948 -4.954
172 HD12 ILE 21 HD12 ILE 21 1.365 -2.897 -3.192
173 HD13 ILE 21 HD13 ILE 21 0.100 -3.724 -4.101
174 H SER 22 HN SER 22 -4.021 0.691 -2.997
175 HA SER 22 HA SER 22 -4.162 0.754 -0.055
176 HB2 SER 22 HB2 SER 22 -4.553 2.945 -1.090
177 HB3 SER 22 HB3 SER 22 -5.839 2.260 -2.080
178 HG SER 22 HG SER 22 -5.800 2.827 0.660
179 H SER 23 HN SER 23 -5.205 -0.874 -2.818
180 HA SER 23 HA SER 23 -7.760 -1.733 -1.798
181 HB2 SER 23 HB2 SER 23 -6.144 -2.754 -4.147
182 HB3 SER 23 HB3 SER 23 -7.818 -3.180 -3.791
183 HG SER 23 HG SER 23 -7.353 -0.479 -3.884
184 H SER 24 HN SER 24 -8.214 -4.147 -1.742
185 HA SER 24 HA SER 24 -5.987 -5.578 -0.449
186 HB2 SER 24 HB2 SER 24 -7.624 -6.576 1.112
187 HB3 SER 24 HB3 SER 24 -7.574 -4.820 1.261
188 HG SER 24 HG SER 24 -9.398 -5.008 -0.394
189 H GLU 25 HN GLU 25 -6.055 -7.890 -0.610
190 HA GLU 25 HA GLU 25 -6.737 -8.837 -3.162
191 HB2 GLU 25 HB2 GLU 25 -6.097 -10.330 -0.615
192 HB3 GLU 25 HB3 GLU 25 -6.280 -11.109 -2.181
193 HG2 GLU 25 HG2 GLU 25 -3.957 -10.808 -1.764
194 HG3 GLU 25 HG3 GLU 25 -4.435 -9.688 -3.039
195 H GLU 26 HN GLU 26 -8.718 -9.104 -3.930
196 HA GLU 26 HA GLU 26 -10.961 -9.570 -2.177
197 HB2 GLU 26 HB2 GLU 26 -11.190 -8.073 -4.103
198 HB3 GLU 26 HB3 GLU 26 -10.811 -9.401 -5.193
199 HG2 GLU 26 HG2 GLU 26 -12.840 -10.533 -4.619
200 HG3 GLU 26 HG3 GLU 26 -13.192 -9.356 -3.354
201 H ASN 27 HN ASN 27 -12.049 -11.429 -1.857
202 HA ASN 27 HA ASN 27 -10.868 -13.861 -2.970
203 HB2 ASN 27 HB2 ASN 27 -12.780 -13.435 -0.665
204 HB3 ASN 27 HB3 ASN 27 -12.199 -15.010 -1.196
205 HD21 ASN 27 HD21 ASN 27 -11.317 -11.979 0.276
206 HD22 ASN 27 HD22 ASN 27 -9.824 -12.518 0.959
207 H ASP 28 HN ASP 28 -12.660 -15.703 -3.117
208 HA ASP 28 HA ASP 28 -15.234 -15.015 -4.029
209 HB2 ASP 28 HB2 ASP 28 -14.089 -14.027 -5.927
210 HB3 ASP 28 HB3 ASP 28 -13.178 -15.509 -6.191
211 H PHE 29 HN PHE 29 -16.273 -16.759 -3.366
212 HA PHE 29 HA PHE 29 -15.252 -19.405 -4.138
213 HB2 PHE 29 HB2 PHE 29 -16.728 -19.063 -1.555
214 HB3 PHE 29 HB3 PHE 29 -15.603 -20.329 -2.032
215 HD1 PHE 29 HD2 PHE 29 -15.897 -16.883 -0.804
216 HD2 PHE 29 HD1 PHE 29 -13.265 -20.102 -1.696
217 HE1 PHE 29 HE2 PHE 29 -14.090 -15.729 0.401
218 HE2 PHE 29 HE1 PHE 29 -11.446 -18.953 -0.492
219 HZ PHE 29 HZ PHE 29 -11.877 -16.769 0.589
220 H TRP 30 HN TRP 30 -17.968 -17.548 -2.944
221 HA TRP 30 HA TRP 30 -19.724 -18.754 -4.893
222 HB2 TRP 30 HB2 TRP 30 -20.249 -18.964 -1.925
223 HB3 TRP 30 HB3 TRP 30 -21.474 -19.229 -3.160
224 HD1 TRP 30 HD1 TRP 30 -18.830 -20.968 -1.254
225 HE1 TRP 30 HE1 TRP 30 -18.540 -23.383 -2.107
226 HE3 TRP 30 HE3 TRP 30 -21.551 -20.625 -5.558
227 HZ2 TRP 30 HZ2 TRP 30 -19.359 -24.932 -4.322
228 HZ3 TRP 30 HZ3 TRP 30 -21.750 -22.616 -6.992
229 HH2 TRP 30 HH2 TRP 30 -20.675 -24.723 -6.385
230 H GLN 31 HN GLN 31 -21.201 -17.375 -5.582
231 HA GLN 31 HA GLN 31 -21.474 -14.813 -4.169
232 HB2 GLN 31 HB2 GLN 31 -20.321 -14.563 -6.299
233 HB3 GLN 31 HB3 GLN 31 -21.625 -15.398 -7.130
234 HG2 GLN 31 HG2 GLN 31 -23.145 -13.610 -6.658
235 HG3 GLN 31 HG3 GLN 31 -21.940 -12.795 -5.663
236 HE21 GLN 31 HE21 GLN 31 -23.365 -11.863 -8.041
237 HE22 GLN 31 HE22 GLN 31 -22.145 -11.431 -9.187
238 HA PRO 32 HA PRO 32 -25.650 -16.787 -4.101
239 HB2 PRO 32 HB2 PRO 32 -25.903 -15.462 -1.510
240 HB3 PRO 32 HB3 PRO 32 -26.011 -17.179 -1.898
241 HG2 PRO 32 HG2 PRO 32 -23.946 -16.123 -0.505
242 HG3 PRO 32 HG3 PRO 32 -23.771 -17.535 -1.565
243 HD2 PRO 32 HD2 PRO 32 -23.046 -14.675 -2.081
244 HD3 PRO 32 HD3 PRO 32 -22.167 -16.158 -2.506
245 H LYS 33 HN LYS 33 -25.069 -13.633 -2.520
246 HA LYS 33 HA LYS 33 -27.396 -12.561 -3.953
247 HB2 LYS 33 HB2 LYS 33 -25.951 -11.687 -1.459
248 HB3 LYS 33 HB3 LYS 33 -27.070 -10.623 -2.296
249 HG2 LYS 33 HG2 LYS 33 -28.343 -11.597 -0.608
250 HG3 LYS 33 HG3 LYS 33 -28.774 -12.505 -2.056
251 HD2 LYS 33 HD2 LYS 33 -28.461 -14.058 -0.257
252 HD3 LYS 33 HD3 LYS 33 -27.117 -14.239 -1.384
253 HE2 LYS 33 HE2 LYS 33 -25.699 -12.896 0.062
254 HE3 LYS 33 HE3 LYS 33 -27.045 -12.636 1.170
255 HZ1 LYS 33 HZ1 LYS 33 -25.582 -14.372 1.973
256 HZ2 LYS 33 HZ2 LYS 33 -25.789 -15.256 0.545
257 HZ3 LYS 33 HZ3 LYS 33 -27.099 -15.022 1.591
258 HA PRO 34 HA PRO 34 -25.104 -10.011 -6.727
259 HB2 PRO 34 HB2 PRO 34 -26.637 -7.688 -5.663
260 HB3 PRO 34 HB3 PRO 34 -26.430 -8.228 -7.334
261 HG2 PRO 34 HG2 PRO 34 -28.721 -8.656 -6.053
262 HG3 PRO 34 HG3 PRO 34 -28.043 -9.889 -7.133
263 HD2 PRO 34 HD2 PRO 34 -28.065 -9.786 -4.149
264 HD3 PRO 34 HD3 PRO 34 -28.237 -11.181 -5.232
265 H THR 35 HN THR 35 -23.035 -9.577 -6.285
266 HA THR 35 HA THR 35 -22.110 -8.550 -3.823
267 HB THR 35 HB THR 35 -19.915 -8.307 -4.961
268 HG1 THR 35 HG1 THR 35 -20.344 -9.498 -7.251
269 HG21 THR 35 HG21 THR 35 -19.607 -10.690 -5.476
270 HG22 THR 35 HG22 THR 35 -21.358 -10.904 -5.517
271 HG23 THR 35 HG23 THR 35 -20.558 -10.460 -4.008
Start of MODEL 4
1 H1 GLU 1 H1 GLU 1 30.678 18.152 -1.653
2 H2 GLU 1 H2 GLU 1 29.537 18.365 -0.423
3 H3 GLU 1 H3 GLU 1 29.298 17.174 -1.598
4 HA GLU 1 HA GLU 1 31.254 15.988 -0.825
5 HB2 GLU 1 HB2 GLU 1 31.247 18.082 1.362
6 HB3 GLU 1 HB3 GLU 1 32.291 16.668 1.301
7 HG2 GLU 1 HG2 GLU 1 32.281 18.942 -0.674
8 HG3 GLU 1 HG3 GLU 1 33.464 18.683 0.608
9 H LYS 2 HN LYS 2 28.367 17.299 0.445
10 HA LYS 2 HA LYS 2 28.024 15.416 2.582
11 HB2 LYS 2 HB2 LYS 2 26.969 17.644 2.615
12 HB3 LYS 2 HB3 LYS 2 26.004 17.202 1.214
13 HG2 LYS 2 HG2 LYS 2 24.924 15.436 2.527
14 HG3 LYS 2 HG3 LYS 2 25.878 15.912 3.934
15 HD2 LYS 2 HD2 LYS 2 23.702 16.906 4.124
16 HD3 LYS 2 HD3 LYS 2 24.868 18.184 3.770
17 HE2 LYS 2 HE2 LYS 2 24.216 18.096 1.402
18 HE3 LYS 2 HE3 LYS 2 23.029 16.848 1.784
19 HZ1 LYS 2 HZ1 LYS 2 21.978 19.002 1.654
20 HZ2 LYS 2 HZ2 LYS 2 23.032 19.634 2.816
21 HZ3 LYS 2 HZ3 LYS 2 21.917 18.439 3.248
22 H LEU 3 HN LEU 3 26.766 13.570 2.622
23 HA LEU 3 HA LEU 3 25.177 12.753 0.397
24 HB2 LEU 3 HB2 LEU 3 27.525 12.304 -0.380
25 HB3 LEU 3 HB3 LEU 3 27.676 11.157 0.936
26 HG LEU 3 HG LEU 3 25.819 9.836 -0.031
27 HD11 LEU 3 HD11 LEU 3 24.646 11.597 -1.207
28 HD12 LEU 3 HD12 LEU 3 26.021 11.823 -2.289
29 HD13 LEU 3 HD13 LEU 3 25.102 10.317 -2.331
30 HD21 LEU 3 HD21 LEU 3 28.130 10.372 -1.893
31 HD22 LEU 3 HD22 LEU 3 28.121 9.245 -0.538
32 HD23 LEU 3 HD23 LEU 3 27.086 8.952 -1.935
33 H LYS 4 HN LYS 4 23.585 11.521 1.148
34 HA LYS 4 HA LYS 4 23.815 10.430 3.843
35 HB2 LYS 4 HB2 LYS 4 21.397 10.652 2.043
36 HB3 LYS 4 HB3 LYS 4 21.388 10.202 3.744
37 HG2 LYS 4 HG2 LYS 4 21.920 12.361 4.442
38 HG3 LYS 4 HG3 LYS 4 22.493 12.834 2.843
39 HD2 LYS 4 HD2 LYS 4 20.213 12.702 1.981
40 HD3 LYS 4 HD3 LYS 4 19.633 12.213 3.576
41 HE2 LYS 4 HE2 LYS 4 20.307 14.334 4.514
42 HE3 LYS 4 HE3 LYS 4 21.029 14.818 2.980
43 HZ1 LYS 4 HZ1 LYS 4 18.840 14.775 1.970
44 HZ2 LYS 4 HZ2 LYS 4 18.850 15.817 3.301
45 HZ3 LYS 4 HZ3 LYS 4 18.140 14.288 3.432
46 H GLN 5 HN GLN 5 24.164 9.366 0.679
47 HA GLN 5 HA GLN 5 23.086 6.716 1.059
48 HB2 GLN 5 HB2 GLN 5 24.856 7.775 -1.151
49 HB3 GLN 5 HB3 GLN 5 23.987 6.246 -1.165
50 HG2 GLN 5 HG2 GLN 5 22.779 9.004 -1.151
51 HG3 GLN 5 HG3 GLN 5 22.815 7.869 -2.500
52 HE21 GLN 5 HE21 GLN 5 21.348 8.675 0.533
53 HE22 GLN 5 HE22 GLN 5 20.036 7.557 0.434
54 H ASP 6 HN ASP 6 25.534 8.032 2.542
55 HA ASP 6 HA ASP 6 27.620 6.100 2.012
56 HB2 ASP 6 HB2 ASP 6 28.079 8.489 2.648
57 HB3 ASP 6 HB3 ASP 6 27.457 8.127 4.254
58 H ILE 7 HN ILE 7 24.861 5.423 3.130
59 HA ILE 7 HA ILE 7 25.019 4.590 5.777
60 HB ILE 7 HB ILE 7 23.524 3.145 3.593
61 HG12 ILE 7 HG12 ILE 7 22.999 5.530 3.489
62 HG13 ILE 7 HG13 ILE 7 21.627 4.631 4.127
63 HG21 ILE 7 HG21 ILE 7 21.985 2.528 5.389
64 HG22 ILE 7 HG22 ILE 7 23.621 1.956 5.718
65 HG23 ILE 7 HG23 ILE 7 23.000 3.378 6.554
66 HD11 ILE 7 HD11 ILE 7 21.926 6.687 5.346
67 HD12 ILE 7 HD12 ILE 7 22.265 5.314 6.398
68 HD13 ILE 7 HD13 ILE 7 23.593 6.257 5.723
69 H LEU 8 HN LEU 8 25.282 2.453 2.955
70 HA LEU 8 HA LEU 8 27.336 0.920 4.379
71 HB2 LEU 8 HB2 LEU 8 25.105 -0.247 2.726
72 HB3 LEU 8 HB3 LEU 8 26.390 -1.155 3.497
73 HG LEU 8 HG LEU 8 24.294 0.446 4.967
74 HD11 LEU 8 HD11 LEU 8 23.325 -1.487 3.839
75 HD12 LEU 8 HD12 LEU 8 24.545 -2.532 4.570
76 HD13 LEU 8 HD13 LEU 8 23.356 -1.717 5.588
77 HD21 LEU 8 HD21 LEU 8 26.362 -1.497 5.986
78 HD22 LEU 8 HD22 LEU 8 26.433 0.256 6.157
79 HD23 LEU 8 HD23 LEU 8 25.151 -0.657 6.953
80 H ASN 9 HN ASN 9 25.761 1.313 1.272
81 HA ASN 9 HA ASN 9 28.042 2.092 -0.142
82 HB2 ASN 9 HB2 ASN 9 28.744 -0.258 0.302
83 HB3 ASN 9 HB3 ASN 9 27.328 -0.816 -0.582
84 HD21 ASN 9 HD21 ASN 9 29.002 2.045 -1.586
85 HD22 ASN 9 HD22 ASN 9 29.734 1.368 -2.999
86 H LEU 10 HN LEU 10 25.491 3.036 -0.061
87 HA LEU 10 HA LEU 10 23.813 3.783 -1.413
88 HB2 LEU 10 HB2 LEU 10 25.753 4.105 -2.975
89 HB3 LEU 10 HB3 LEU 10 25.393 2.537 -3.667
90 HG LEU 10 HG LEU 10 23.106 3.444 -4.260
91 HD11 LEU 10 HD11 LEU 10 24.429 6.060 -3.558
92 HD12 LEU 10 HD12 LEU 10 22.880 5.875 -4.382
93 HD13 LEU 10 HD13 LEU 10 23.065 5.321 -2.717
94 HD21 LEU 10 HD21 LEU 10 25.541 4.735 -5.481
95 HD22 LEU 10 HD22 LEU 10 24.839 3.179 -5.926
96 HD23 LEU 10 HD23 LEU 10 23.942 4.669 -6.222
97 H ARG 11 HN ARG 11 24.081 0.851 -0.460
98 HA ARG 11 HA ARG 11 22.751 -0.836 -2.240
99 HB2 ARG 11 HB2 ARG 11 22.698 -0.861 0.779
100 HB3 ARG 11 HB3 ARG 11 22.180 -2.188 -0.252
101 HG2 ARG 11 HG2 ARG 11 24.433 -2.414 -1.127
102 HG3 ARG 11 HG3 ARG 11 24.968 -1.063 -0.126
103 HD2 ARG 11 HD2 ARG 11 24.341 -2.332 1.884
104 HD3 ARG 11 HD3 ARG 11 23.857 -3.686 0.866
105 HE ARG 11 HE ARG 11 26.532 -2.951 0.319
106 HH11 ARG 11 HH12 ARG 11 24.566 -4.548 2.711
107 HH12 ARG 11 HH11 ARG 11 25.856 -5.546 3.292
108 HH21 ARG 11 HH22 ARG 11 28.236 -4.263 1.077
109 HH22 ARG 11 HH21 ARG 11 27.942 -5.384 2.364
110 H THR 12 HN THR 12 21.182 0.213 0.726
111 HA THR 12 HA THR 12 19.011 1.535 -0.537
112 HB THR 12 HB THR 12 18.240 -0.585 -1.267
113 HG1 THR 12 HG1 THR 12 16.411 0.245 -0.544
114 HG21 THR 12 HG21 THR 12 18.718 -1.566 1.550
115 HG22 THR 12 HG22 THR 12 19.614 -2.038 0.105
116 HG23 THR 12 HG23 THR 12 17.918 -2.491 0.281
117 H ASP 13 HN ASP 13 18.391 2.985 0.908
118 HA ASP 13 HA ASP 13 18.734 2.386 3.759
119 HB2 ASP 13 HB2 ASP 13 19.882 4.393 2.990
120 HB3 ASP 13 HB3 ASP 13 18.377 5.031 2.333
121 H ILE 14 HN ILE 14 16.910 1.327 4.352
122 HA ILE 14 HA ILE 14 14.754 1.003 4.986
123 HB ILE 14 HB ILE 14 14.479 3.989 4.621
124 HG12 ILE 14 HG12 ILE 14 15.125 2.417 7.126
125 HG13 ILE 14 HG13 ILE 14 16.319 3.284 6.164
126 HG21 ILE 14 HG21 ILE 14 12.627 3.774 6.222
127 HG22 ILE 14 HG22 ILE 14 12.329 2.870 4.738
128 HG23 ILE 14 HG23 ILE 14 12.828 2.022 6.201
129 HD11 ILE 14 HD11 ILE 14 15.640 4.551 8.128
130 HD12 ILE 14 HD12 ILE 14 15.190 5.384 6.639
131 HD13 ILE 14 HD13 ILE 14 13.967 4.523 7.574
132 H SER 15 HN SER 15 13.988 3.761 2.915
133 HA SER 15 HA SER 15 12.757 3.981 1.022
134 HB2 SER 15 HB2 SER 15 14.442 2.536 -0.013
135 HB3 SER 15 HB3 SER 15 13.571 1.104 0.536
136 HG SER 15 HG SER 15 13.242 2.164 -1.729
137 H THR 16 HN THR 16 10.683 3.538 0.136
138 HA THR 16 HA THR 16 9.049 1.636 1.674
139 HB THR 16 HB THR 16 7.198 3.260 1.724
140 HG1 THR 16 HG1 THR 16 8.903 5.384 1.116
141 HG21 THR 16 HG21 THR 16 8.687 3.098 3.658
142 HG22 THR 16 HG22 THR 16 8.116 4.753 3.438
143 HG23 THR 16 HG23 THR 16 9.753 4.312 2.948
144 H SER 17 HN SER 17 8.333 0.180 0.265
145 HA SER 17 HA SER 17 7.853 0.939 -2.509
146 HB2 SER 17 HB2 SER 17 7.610 -1.491 -2.900
147 HB3 SER 17 HB3 SER 17 9.137 -1.106 -2.104
148 HG SER 17 HG SER 17 7.675 -2.911 -1.274
149 H SEP 18 HN SER 18 6.128 0.346 0.392
150 HA SEP 18 HA SER 18 3.599 0.053 -1.077
151 HB2 SEP 18 HB2 SER 18 4.024 -1.691 0.594
152 HB3 SEP 18 HB3 SER 18 4.212 -0.459 1.843
153 H SER 19 HN SER 19 1.778 1.325 -0.464
154 HA SER 19 HA SER 19 2.236 3.641 1.233
155 HB2 SER 19 HB2 SER 19 3.015 4.451 -0.920
156 HB3 SER 19 HB3 SER 19 1.531 3.904 -1.698
157 HG SER 19 HG SER 19 0.574 5.655 -1.044
158 H SER 20 HN SER 20 0.210 4.932 1.506
159 HA SER 20 HA SER 20 -1.939 3.252 2.191
160 HB2 SER 20 HB2 SER 20 -1.906 6.259 1.841
161 HB3 SER 20 HB3 SER 20 -3.164 5.341 2.667
162 HG SER 20 HG SER 20 -0.964 4.567 3.787
163 H ILE 21 HN ILE 21 -2.978 2.134 0.655
164 HA ILE 21 HA ILE 21 -3.835 3.532 -1.782
165 HB ILE 21 HB ILE 21 -2.565 1.485 -2.170
166 HG12 ILE 21 HG12 ILE 21 -4.252 0.266 -3.571
167 HG13 ILE 21 HG13 ILE 21 -5.507 1.267 -2.846
168 HG21 ILE 21 HG21 ILE 21 -3.082 0.312 -0.108
169 HG22 ILE 21 HG22 ILE 21 -4.756 0.112 -0.621
170 HG23 ILE 21 HG23 ILE 21 -3.462 -0.699 -1.502
171 HD11 ILE 21 HD11 ILE 21 -3.199 2.245 -4.510
172 HD12 ILE 21 HD12 ILE 21 -4.880 2.108 -5.026
173 HD13 ILE 21 HD13 ILE 21 -4.432 3.263 -3.770
174 H SER 22 HN SER 22 -5.959 3.700 -2.350
175 HA SER 22 HA SER 22 -7.899 3.399 -0.251
176 HB2 SER 22 HB2 SER 22 -7.973 5.333 -1.763
177 HB3 SER 22 HB3 SER 22 -8.250 4.258 -3.134
178 HG SER 22 HG SER 22 -10.146 3.544 -1.771
179 H SER 23 HN SER 23 -8.937 1.570 0.173
180 HA SER 23 HA SER 23 -9.093 -0.514 -1.855
181 HB2 SER 23 HB2 SER 23 -9.905 -1.940 -0.004
182 HB3 SER 23 HB3 SER 23 -8.367 -1.169 0.383
183 HG SER 23 HG SER 23 -9.752 0.493 1.428
184 H SER 24 HN SER 24 -10.764 -0.530 -3.192
185 HA SER 24 HA SER 24 -13.300 0.659 -2.360
186 HB2 SER 24 HB2 SER 24 -12.385 -0.309 -5.081
187 HB3 SER 24 HB3 SER 24 -13.915 0.503 -4.747
188 HG SER 24 HG SER 24 -12.784 2.347 -4.175
189 H GLU 25 HN GLU 25 -15.265 -0.546 -3.460
190 HA GLU 25 HA GLU 25 -15.152 -3.302 -2.460
191 HB2 GLU 25 HB2 GLU 25 -17.619 -3.155 -2.379
192 HB3 GLU 25 HB3 GLU 25 -16.840 -1.914 -1.407
193 HG2 GLU 25 HG2 GLU 25 -17.220 -0.284 -3.188
194 HG3 GLU 25 HG3 GLU 25 -18.011 -1.528 -4.155
195 H GLU 26 HN GLU 26 -14.526 -1.971 -5.237
196 HA GLU 26 HA GLU 26 -16.210 -3.712 -6.888
197 HB2 GLU 26 HB2 GLU 26 -16.075 -1.302 -7.483
198 HB3 GLU 26 HB3 GLU 26 -14.346 -1.489 -7.740
199 HG2 GLU 26 HG2 GLU 26 -15.541 -1.507 -9.844
200 HG3 GLU 26 HG3 GLU 26 -14.779 -3.069 -9.547
201 H ASN 27 HN ASN 27 -13.171 -3.579 -5.483
202 HA ASN 27 HA ASN 27 -12.078 -5.487 -7.443
203 HB2 ASN 27 HB2 ASN 27 -10.539 -3.742 -5.510
204 HB3 ASN 27 HB3 ASN 27 -9.849 -4.813 -6.726
205 HD21 ASN 27 HD21 ASN 27 -9.982 -4.241 -8.903
206 HD22 ASN 27 HD22 ASN 27 -10.321 -2.623 -9.402
207 H ASP 28 HN ASP 28 -13.405 -5.231 -4.414
208 HA ASP 28 HA ASP 28 -12.797 -7.924 -3.735
209 HB2 ASP 28 HB2 ASP 28 -11.657 -7.415 -1.563
210 HB3 ASP 28 HB3 ASP 28 -10.685 -7.050 -2.985
211 H PHE 29 HN PHE 29 -14.663 -8.611 -2.946
212 HA PHE 29 HA PHE 29 -15.916 -7.347 -0.713
213 HB2 PHE 29 HB2 PHE 29 -16.754 -5.915 -2.553
214 HB3 PHE 29 HB3 PHE 29 -17.428 -7.345 -3.331
215 HD1 PHE 29 HD2 PHE 29 -17.637 -5.220 -0.312
216 HD2 PHE 29 HD1 PHE 29 -19.527 -8.188 -2.706
217 HE1 PHE 29 HE2 PHE 29 -19.713 -4.931 0.976
218 HE2 PHE 29 HE1 PHE 29 -21.606 -7.904 -1.424
219 HZ PHE 29 HZ PHE 29 -21.699 -6.283 0.425
220 H TRP 30 HN TRP 30 -16.033 -9.706 -3.282
221 HA TRP 30 HA TRP 30 -17.770 -11.445 -1.702
222 HB2 TRP 30 HB2 TRP 30 -17.025 -11.262 -4.564
223 HB3 TRP 30 HB3 TRP 30 -17.296 -12.884 -3.935
224 HD1 TRP 30 HD1 TRP 30 -19.119 -9.987 -5.320
225 HE1 TRP 30 HE1 TRP 30 -21.660 -10.295 -5.028
226 HE3 TRP 30 HE3 TRP 30 -19.084 -13.902 -2.042
227 HZ2 TRP 30 HZ2 TRP 30 -23.416 -11.981 -3.593
228 HZ3 TRP 30 HZ3 TRP 30 -21.234 -14.805 -1.255
229 HH2 TRP 30 HH2 TRP 30 -23.355 -13.863 -2.015
230 H GLN 31 HN GLN 31 -14.987 -12.192 -3.782
231 HA GLN 31 HA GLN 31 -13.267 -13.649 -3.542
232 HB2 GLN 31 HB2 GLN 31 -12.803 -11.803 -1.787
233 HB3 GLN 31 HB3 GLN 31 -13.273 -13.016 -0.604
234 HG2 GLN 31 HG2 GLN 31 -11.526 -14.506 -1.472
235 HG3 GLN 31 HG3 GLN 31 -11.036 -13.241 -2.598
236 HE21 GLN 31 HE21 GLN 31 -8.975 -13.098 -1.733
237 HE22 GLN 31 HE22 GLN 31 -8.665 -12.389 -0.189
238 HA PRO 32 HA PRO 32 -16.112 -16.911 -1.768
239 HB2 PRO 32 HB2 PRO 32 -15.727 -18.194 -4.374
240 HB3 PRO 32 HB3 PRO 32 -17.227 -17.773 -3.548
241 HG2 PRO 32 HG2 PRO 32 -16.390 -16.471 -5.754
242 HG3 PRO 32 HG3 PRO 32 -17.298 -15.664 -4.462
243 HD2 PRO 32 HD2 PRO 32 -14.355 -15.622 -5.023
244 HD3 PRO 32 HD3 PRO 32 -15.428 -14.294 -4.531
245 H LYS 33 HN LYS 33 -13.853 -18.028 -4.272
246 HA LYS 33 HA LYS 33 -12.457 -19.590 -2.201
247 HB2 LYS 33 HB2 LYS 33 -13.079 -20.291 -5.070
248 HB3 LYS 33 HB3 LYS 33 -11.890 -21.166 -4.118
249 HG2 LYS 33 HG2 LYS 33 -13.808 -22.454 -3.927
250 HG3 LYS 33 HG3 LYS 33 -13.790 -21.519 -2.431
251 HD2 LYS 33 HD2 LYS 33 -15.375 -19.928 -3.411
252 HD3 LYS 33 HD3 LYS 33 -15.393 -20.869 -4.904
253 HE2 LYS 33 HE2 LYS 33 -16.250 -22.803 -3.634
254 HE3 LYS 33 HE3 LYS 33 -16.296 -21.805 -2.183
255 HZ1 LYS 33 HZ1 LYS 33 -18.465 -21.875 -3.154
256 HZ2 LYS 33 HZ2 LYS 33 -17.874 -21.401 -4.666
257 HZ3 LYS 33 HZ3 LYS 33 -17.846 -20.314 -3.368
258 HA PRO 34 HA PRO 34 -8.702 -17.498 -3.194
259 HB2 PRO 34 HB2 PRO 34 -6.925 -19.620 -3.102
260 HB3 PRO 34 HB3 PRO 34 -7.488 -18.708 -1.697
261 HG2 PRO 34 HG2 PRO 34 -8.422 -21.340 -2.751
262 HG3 PRO 34 HG3 PRO 34 -8.217 -20.810 -1.070
263 HD2 PRO 34 HD2 PRO 34 -10.640 -20.946 -2.224
264 HD3 PRO 34 HD3 PRO 34 -10.236 -19.676 -1.050
265 H THR 35 HN THR 35 -8.833 -16.851 -5.293
266 HA THR 35 HA THR 35 -8.848 -18.562 -7.532
267 HB THR 35 HB THR 35 -8.337 -16.530 -8.858
268 HG1 THR 35 HG1 THR 35 -7.691 -14.713 -7.898
269 HG21 THR 35 HG21 THR 35 -10.351 -15.279 -8.259
270 HG22 THR 35 HG22 THR 35 -10.411 -16.101 -6.702
271 HG23 THR 35 HG23 THR 35 -10.648 -17.015 -8.192
Start of MODEL 5
1 H1 GLU 1 H1 GLU 1 26.073 13.429 0.135
2 H2 GLU 1 H2 GLU 1 25.864 13.159 -1.520
3 H3 GLU 1 H3 GLU 1 24.654 12.706 -0.430
4 HA GLU 1 HA GLU 1 24.209 14.974 0.133
5 HB2 GLU 1 HB2 GLU 1 25.353 16.799 -1.023
6 HB3 GLU 1 HB3 GLU 1 26.502 15.809 -0.136
7 HG2 GLU 1 HG2 GLU 1 27.087 14.654 -2.233
8 HG3 GLU 1 HG3 GLU 1 25.991 15.728 -3.100
9 H LYS 2 HN LYS 2 24.343 12.949 -2.498
10 HA LYS 2 HA LYS 2 22.072 14.320 -3.742
11 HB2 LYS 2 HB2 LYS 2 24.167 14.834 -5.020
12 HB3 LYS 2 HB3 LYS 2 24.340 13.114 -5.335
13 HG2 LYS 2 HG2 LYS 2 22.249 13.100 -6.564
14 HG3 LYS 2 HG3 LYS 2 22.005 14.809 -6.197
15 HD2 LYS 2 HD2 LYS 2 22.873 14.715 -8.400
16 HD3 LYS 2 HD3 LYS 2 24.198 15.248 -7.367
17 HE2 LYS 2 HE2 LYS 2 25.061 13.619 -8.883
18 HE3 LYS 2 HE3 LYS 2 24.985 12.882 -7.284
19 HZ1 LYS 2 HZ1 LYS 2 23.035 12.486 -9.488
20 HZ2 LYS 2 HZ2 LYS 2 22.891 11.824 -7.940
21 HZ3 LYS 2 HZ3 LYS 2 24.172 11.358 -8.942
22 H LEU 3 HN LEU 3 23.497 11.527 -2.547
23 HA LEU 3 HA LEU 3 21.360 9.893 -3.693
24 HB2 LEU 3 HB2 LEU 3 24.150 8.925 -3.102
25 HB3 LEU 3 HB3 LEU 3 22.843 7.970 -3.766
26 HG LEU 3 HG LEU 3 22.901 9.719 -5.706
27 HD11 LEU 3 HD11 LEU 3 24.438 11.284 -4.716
28 HD12 LEU 3 HD12 LEU 3 25.648 10.020 -4.506
29 HD13 LEU 3 HD13 LEU 3 25.195 10.546 -6.127
30 HD21 LEU 3 HD21 LEU 3 23.412 7.354 -5.959
31 HD22 LEU 3 HD22 LEU 3 24.542 8.338 -6.887
32 HD23 LEU 3 HD23 LEU 3 25.045 7.625 -5.354
33 H LYS 4 HN LYS 4 20.083 9.022 -2.220
34 HA LYS 4 HA LYS 4 20.970 8.989 0.574
35 HB2 LYS 4 HB2 LYS 4 18.185 8.696 -0.562
36 HB3 LYS 4 HB3 LYS 4 18.601 8.848 1.140
37 HG2 LYS 4 HG2 LYS 4 19.138 11.089 0.945
38 HG3 LYS 4 HG3 LYS 4 19.390 10.978 -0.799
39 HD2 LYS 4 HD2 LYS 4 16.990 10.647 -1.124
40 HD3 LYS 4 HD3 LYS 4 16.735 10.752 0.620
41 HE2 LYS 4 HE2 LYS 4 16.206 12.868 -0.468
42 HE3 LYS 4 HE3 LYS 4 17.593 13.042 0.607
43 HZ1 LYS 4 HZ1 LYS 4 17.704 12.749 -2.347
44 HZ2 LYS 4 HZ2 LYS 4 19.048 12.872 -1.328
45 HZ3 LYS 4 HZ3 LYS 4 17.978 14.174 -1.478
46 H GLN 5 HN GLN 5 21.109 6.940 -1.887
47 HA GLN 5 HA GLN 5 20.005 4.593 -0.580
48 HB2 GLN 5 HB2 GLN 5 21.446 4.949 -3.212
49 HB3 GLN 5 HB3 GLN 5 20.836 3.407 -2.623
50 HG2 GLN 5 HG2 GLN 5 18.582 4.185 -2.715
51 HG3 GLN 5 HG3 GLN 5 19.109 5.829 -3.067
52 HE21 GLN 5 HE21 GLN 5 19.852 6.332 -5.122
53 HE22 GLN 5 HE22 GLN 5 19.569 5.306 -6.483
54 H ASP 6 HN ASP 6 21.195 4.041 1.157
55 HA ASP 6 HA ASP 6 23.960 3.220 0.664
56 HB2 ASP 6 HB2 ASP 6 23.070 4.869 3.044
57 HB3 ASP 6 HB3 ASP 6 24.678 4.187 2.817
58 H ILE 7 HN ILE 7 24.623 2.260 3.122
59 HA ILE 7 HA ILE 7 22.512 0.279 3.679
60 HB ILE 7 HB ILE 7 25.428 -0.326 4.041
61 HG12 ILE 7 HG12 ILE 7 23.837 -0.816 1.513
62 HG13 ILE 7 HG13 ILE 7 25.069 0.429 1.691
63 HG21 ILE 7 HG21 ILE 7 23.814 -1.824 5.080
64 HG22 ILE 7 HG22 ILE 7 23.001 -2.046 3.530
65 HG23 ILE 7 HG23 ILE 7 24.647 -2.638 3.757
66 HD11 ILE 7 HD11 ILE 7 25.962 -1.496 0.537
67 HD12 ILE 7 HD12 ILE 7 26.746 -1.307 2.106
68 HD13 ILE 7 HD13 ILE 7 25.506 -2.542 1.882
69 H LEU 8 HN LEU 8 23.186 2.866 5.026
70 HA LEU 8 HA LEU 8 23.315 1.779 7.729
71 HB2 LEU 8 HB2 LEU 8 24.994 3.274 8.498
72 HB3 LEU 8 HB3 LEU 8 25.624 2.454 7.084
73 HG LEU 8 HG LEU 8 24.405 5.194 6.887
74 HD11 LEU 8 HD11 LEU 8 27.285 4.504 7.457
75 HD12 LEU 8 HD12 LEU 8 26.675 6.108 7.046
76 HD13 LEU 8 HD13 LEU 8 26.174 5.332 8.548
77 HD21 LEU 8 HD21 LEU 8 25.902 5.304 4.908
78 HD22 LEU 8 HD22 LEU 8 26.334 3.617 5.189
79 HD23 LEU 8 HD23 LEU 8 24.671 4.046 4.792
80 H ASN 9 HN ASN 9 22.097 3.943 5.478
81 HA ASN 9 HA ASN 9 21.081 5.865 7.392
82 HB2 ASN 9 HB2 ASN 9 20.260 7.081 5.546
83 HB3 ASN 9 HB3 ASN 9 21.772 6.380 4.975
84 HD21 ASN 9 HD21 ASN 9 21.678 4.561 3.580
85 HD22 ASN 9 HD22 ASN 9 20.280 4.264 2.612
86 H LEU 10 HN LEU 10 19.918 3.113 5.558
87 HA LEU 10 HA LEU 10 17.755 2.661 7.337
88 HB2 LEU 10 HB2 LEU 10 16.780 4.533 6.083
89 HB3 LEU 10 HB3 LEU 10 17.048 3.671 4.580
90 HG LEU 10 HG LEU 10 15.474 1.909 5.350
91 HD11 LEU 10 HD11 LEU 10 14.954 3.818 7.623
92 HD12 LEU 10 HD12 LEU 10 14.032 2.359 7.264
93 HD13 LEU 10 HD13 LEU 10 15.719 2.236 7.755
94 HD21 LEU 10 HD21 LEU 10 14.721 3.722 3.900
95 HD22 LEU 10 HD22 LEU 10 13.448 3.227 5.016
96 HD23 LEU 10 HD23 LEU 10 14.357 4.709 5.315
97 H ARG 11 HN ARG 11 17.136 0.575 7.235
98 HA ARG 11 HA ARG 11 18.578 -1.221 5.581
99 HB2 ARG 11 HB2 ARG 11 16.132 -1.758 7.275
100 HB3 ARG 11 HB3 ARG 11 17.236 -2.971 6.641
101 HG2 ARG 11 HG2 ARG 11 19.043 -2.011 7.995
102 HG3 ARG 11 HG3 ARG 11 17.908 -0.828 8.645
103 HD2 ARG 11 HD2 ARG 11 18.213 -2.683 10.193
104 HD3 ARG 11 HD3 ARG 11 16.558 -2.632 9.588
105 HE ARG 11 HE ARG 11 17.838 -4.356 7.907
106 HH11 ARG 11 HH12 ARG 11 17.430 -4.157 11.361
107 HH12 ARG 11 HH11 ARG 11 17.481 -5.872 11.595
108 HH21 ARG 11 HH22 ARG 11 17.905 -6.615 8.207
109 HH22 ARG 11 HH21 ARG 11 17.750 -7.269 9.804
110 H THR 12 HN THR 12 18.158 -1.874 3.588
111 HA THR 12 HA THR 12 17.157 -2.060 1.552
112 HB THR 12 HB THR 12 14.965 -3.199 1.531
113 HG1 THR 12 HG1 THR 12 13.722 -3.230 3.262
114 HG21 THR 12 HG21 THR 12 16.918 -4.271 3.570
115 HG22 THR 12 HG22 THR 12 16.980 -4.529 1.827
116 HG23 THR 12 HG23 THR 12 15.657 -5.212 2.772
117 H ASP 13 HN ASP 13 17.109 0.062 0.849
118 HA ASP 13 HA ASP 13 14.774 1.692 1.491
119 HB2 ASP 13 HB2 ASP 13 17.044 2.700 1.567
120 HB3 ASP 13 HB3 ASP 13 17.207 2.401 -0.161
121 H ILE 14 HN ILE 14 13.026 1.254 0.313
122 HA ILE 14 HA ILE 14 13.219 1.430 -2.585
123 HB ILE 14 HB ILE 14 13.426 -0.960 -2.236
124 HG12 ILE 14 HG12 ILE 14 11.413 -1.742 -3.467
125 HG13 ILE 14 HG13 ILE 14 10.651 -0.184 -3.168
126 HG21 ILE 14 HG21 ILE 14 10.868 -0.749 -0.654
127 HG22 ILE 14 HG22 ILE 14 11.683 -2.251 -1.097
128 HG23 ILE 14 HG23 ILE 14 12.471 -1.106 -0.010
129 HD11 ILE 14 HD11 ILE 14 12.388 0.922 -4.469
130 HD12 ILE 14 HD12 ILE 14 13.169 -0.635 -4.750
131 HD13 ILE 14 HD13 ILE 14 11.566 -0.319 -5.415
132 H SER 15 HN SER 15 11.529 2.507 -3.438
133 HA SER 15 HA SER 15 9.215 3.000 -1.682
134 HB2 SER 15 HB2 SER 15 8.960 5.170 -2.832
135 HB3 SER 15 HB3 SER 15 10.534 5.028 -2.051
136 HG SER 15 HG SER 15 11.490 5.019 -3.944
137 H THR 16 HN THR 16 7.186 2.744 -2.467
138 HA THR 16 HA THR 16 6.959 1.652 -5.194
139 HB THR 16 HB THR 16 4.920 0.515 -4.442
140 HG1 THR 16 HG1 THR 16 4.794 0.531 -1.956
141 HG21 THR 16 HG21 THR 16 7.078 -0.646 -4.249
142 HG22 THR 16 HG22 THR 16 5.958 -1.140 -2.980
143 HG23 THR 16 HG23 THR 16 7.265 -0.015 -2.612
144 H SER 17 HN SER 17 6.796 4.499 -4.075
145 HA SER 17 HA SER 17 5.587 6.402 -4.374
146 HB2 SER 17 HB2 SER 17 4.561 6.676 -6.546
147 HB3 SER 17 HB3 SER 17 6.027 5.713 -6.738
148 HG SER 17 HG SER 17 4.140 4.902 -7.863
149 H SEP 18 HN SER 18 4.384 4.276 -2.734
150 HA SEP 18 HA SER 18 1.718 5.405 -2.599
151 HB2 SEP 18 HB2 SER 18 0.621 3.175 -2.550
152 HB3 SEP 18 HB3 SER 18 1.348 3.538 -4.115
153 H SER 19 HN SER 19 0.601 4.842 -0.604
154 HA SER 19 HA SER 19 2.013 3.425 1.458
155 HB2 SER 19 HB2 SER 19 2.256 5.349 2.986
156 HB3 SER 19 HB3 SER 19 3.230 5.553 1.530
157 HG SER 19 HG SER 19 0.759 6.578 1.182
158 H SER 20 HN SER 20 -0.649 5.442 0.425
159 HA SER 20 HA SER 20 -2.264 5.069 2.735
160 HB2 SER 20 HB2 SER 20 -4.101 5.936 1.319
161 HB3 SER 20 HB3 SER 20 -2.657 6.943 1.223
162 HG SER 20 HG SER 20 -3.794 5.262 -0.698
163 H ILE 21 HN ILE 21 -2.767 3.063 3.353
164 HA ILE 21 HA ILE 21 -3.602 0.949 3.353
165 HB ILE 21 HB ILE 21 -5.181 1.923 0.967
166 HG12 ILE 21 HG12 ILE 21 -5.952 1.815 3.892
167 HG13 ILE 21 HG13 ILE 21 -5.453 3.276 3.048
168 HG21 ILE 21 HG21 ILE 21 -5.606 -0.439 2.794
169 HG22 ILE 21 HG22 ILE 21 -6.758 0.124 1.583
170 HG23 ILE 21 HG23 ILE 21 -5.183 -0.491 1.084
171 HD11 ILE 21 HD11 ILE 21 -7.381 3.109 1.585
172 HD12 ILE 21 HD12 ILE 21 -7.867 1.610 2.376
173 HD13 ILE 21 HD13 ILE 21 -7.877 3.124 3.278
174 H SER 22 HN SER 22 -1.881 -0.329 2.894
175 HA SER 22 HA SER 22 -1.479 -1.046 0.064
176 HB2 SER 22 HB2 SER 22 0.870 -1.561 0.635
177 HB3 SER 22 HB3 SER 22 0.476 0.129 0.951
178 HG SER 22 HG SER 22 1.598 -1.396 2.626
179 H SER 23 HN SER 23 -0.197 -3.281 0.039
180 HA SER 23 HA SER 23 -1.341 -5.126 2.000
181 HB2 SER 23 HB2 SER 23 -2.085 -6.657 0.202
182 HB3 SER 23 HB3 SER 23 -2.946 -5.120 0.156
183 HG SER 23 HG SER 23 -1.041 -6.156 -1.607
184 H SER 24 HN SER 24 -0.006 -6.778 2.529
185 HA SER 24 HA SER 24 2.622 -6.802 1.268
186 HB2 SER 24 HB2 SER 24 2.540 -6.696 3.713
187 HB3 SER 24 HB3 SER 24 1.625 -8.204 3.759
188 HG SER 24 HG SER 24 4.274 -7.861 3.645
189 H GLU 25 HN GLU 25 -0.205 -8.824 1.663
190 HA GLU 25 HA GLU 25 0.692 -10.538 -0.471
191 HB2 GLU 25 HB2 GLU 25 0.607 -12.623 0.753
192 HB3 GLU 25 HB3 GLU 25 1.786 -11.557 1.499
193 HG2 GLU 25 HG2 GLU 25 0.140 -10.969 3.222
194 HG3 GLU 25 HG3 GLU 25 -1.007 -12.086 2.486
195 H GLU 26 HN GLU 26 -1.652 -8.877 1.003
196 HA GLU 26 HA GLU 26 -3.880 -10.635 0.870
197 HB2 GLU 26 HB2 GLU 26 -3.791 -7.614 0.770
198 HB3 GLU 26 HB3 GLU 26 -5.239 -8.578 1.020
199 HG2 GLU 26 HG2 GLU 26 -4.282 -9.460 3.095
200 HG3 GLU 26 HG3 GLU 26 -2.851 -8.461 2.848
201 H ASN 27 HN ASN 27 -5.320 -11.034 -0.746
202 HA ASN 27 HA ASN 27 -4.505 -10.173 -3.423
203 HB2 ASN 27 HB2 ASN 27 -6.440 -12.334 -2.560
204 HB3 ASN 27 HB3 ASN 27 -5.984 -11.984 -4.224
205 HD21 ASN 27 HD21 ASN 27 -4.929 -13.271 -1.174
206 HD22 ASN 27 HD22 ASN 27 -3.520 -14.072 -1.770
207 H ASP 28 HN ASP 28 -5.335 -8.084 -3.454
208 HA ASP 28 HA ASP 28 -7.978 -7.803 -4.382
209 HB2 ASP 28 HB2 ASP 28 -8.862 -6.372 -2.528
210 HB3 ASP 28 HB3 ASP 28 -8.676 -8.068 -2.091
211 H PHE 29 HN PHE 29 -7.618 -6.327 -5.901
212 HA PHE 29 HA PHE 29 -6.160 -3.886 -5.165
213 HB2 PHE 29 HB2 PHE 29 -5.873 -5.116 -7.891
214 HB3 PHE 29 HB3 PHE 29 -4.865 -3.890 -7.130
215 HD1 PHE 29 HD1 PHE 29 -3.200 -4.500 -5.479
216 HD2 PHE 29 HD2 PHE 29 -5.559 -7.452 -7.434
217 HE1 PHE 29 HE1 PHE 29 -1.632 -6.245 -4.725
218 HE2 PHE 29 HE2 PHE 29 -4.000 -9.203 -6.685
219 HZ PHE 29 HZ PHE 29 -2.037 -8.609 -5.342
220 H TRP 30 HN TRP 30 -8.421 -5.470 -7.308
221 HA TRP 30 HA TRP 30 -9.385 -2.915 -8.309
222 HB2 TRP 30 HB2 TRP 30 -9.850 -5.775 -9.075
223 HB3 TRP 30 HB3 TRP 30 -10.991 -4.535 -9.589
224 HD1 TRP 30 HD1 TRP 30 -7.873 -6.167 -10.657
225 HE1 TRP 30 HE1 TRP 30 -6.778 -4.857 -12.586
226 HE3 TRP 30 HE3 TRP 30 -10.575 -1.845 -10.330
227 HZ2 TRP 30 HZ2 TRP 30 -7.029 -2.320 -13.807
228 HZ3 TRP 30 HZ3 TRP 30 -10.088 -0.022 -11.914
229 HH2 TRP 30 HH2 TRP 30 -8.350 -0.256 -13.615
230 H GLN 31 HN GLN 31 -11.497 -5.643 -7.777
231 HA GLN 31 HA GLN 31 -12.692 -4.642 -5.390
232 HB2 GLN 31 HB2 GLN 31 -14.916 -4.142 -6.416
233 HB3 GLN 31 HB3 GLN 31 -13.655 -2.993 -6.847
234 HG2 GLN 31 HG2 GLN 31 -13.375 -4.091 -9.001
235 HG3 GLN 31 HG3 GLN 31 -14.617 -5.267 -8.569
236 HE21 GLN 31 HE21 GLN 31 -13.964 -1.988 -9.494
237 HE22 GLN 31 HE22 GLN 31 -15.597 -1.544 -9.848
238 HA PRO 32 HA PRO 32 -13.608 -9.061 -6.749
239 HB2 PRO 32 HB2 PRO 32 -11.831 -10.424 -5.267
240 HB3 PRO 32 HB3 PRO 32 -11.407 -9.747 -6.845
241 HG2 PRO 32 HG2 PRO 32 -10.792 -8.713 -4.111
242 HG3 PRO 32 HG3 PRO 32 -9.771 -8.735 -5.560
243 HD2 PRO 32 HD2 PRO 32 -11.176 -6.535 -4.665
244 HD3 PRO 32 HD3 PRO 32 -10.646 -6.777 -6.340
245 H LYS 33 HN LYS 33 -15.236 -10.029 -5.722
246 HA LYS 33 HA LYS 33 -15.262 -10.158 -2.810
247 HB2 LYS 33 HB2 LYS 33 -17.519 -9.275 -2.628
248 HB3 LYS 33 HB3 LYS 33 -16.467 -8.079 -3.374
249 HG2 LYS 33 HG2 LYS 33 -18.174 -9.908 -5.024
250 HG3 LYS 33 HG3 LYS 33 -18.805 -8.407 -4.349
251 HD2 LYS 33 HD2 LYS 33 -17.003 -7.169 -5.492
252 HD3 LYS 33 HD3 LYS 33 -16.442 -8.682 -6.206
253 HE2 LYS 33 HE2 LYS 33 -19.148 -7.414 -6.616
254 HE3 LYS 33 HE3 LYS 33 -17.822 -7.427 -7.778
255 HZ1 LYS 33 HZ1 LYS 33 -19.455 -9.135 -8.275
256 HZ2 LYS 33 HZ2 LYS 33 -19.239 -9.828 -6.747
257 HZ3 LYS 33 HZ3 LYS 33 -17.971 -9.838 -7.866
258 HA PRO 34 HA PRO 34 -16.898 -14.201 -3.432
259 HB2 PRO 34 HB2 PRO 34 -18.779 -14.358 -1.427
260 HB3 PRO 34 HB3 PRO 34 -17.043 -14.580 -1.186
261 HG2 PRO 34 HG2 PRO 34 -18.733 -12.165 -0.697
262 HG3 PRO 34 HG3 PRO 34 -17.398 -12.817 0.270
263 HD2 PRO 34 HD2 PRO 34 -17.079 -10.693 -1.349
264 HD3 PRO 34 HD3 PRO 34 -15.785 -11.880 -1.096
265 H THR 35 HN THR 35 -18.177 -14.748 -5.067
266 HA THR 35 HA THR 35 -20.303 -13.232 -6.047
267 HB THR 35 HB THR 35 -19.934 -16.205 -6.455
268 HG1 THR 35 HG1 THR 35 -18.152 -15.644 -7.439
269 HG21 THR 35 HG21 THR 35 -22.071 -15.300 -7.264
270 HG22 THR 35 HG22 THR 35 -21.032 -15.797 -8.600
271 HG23 THR 35 HG23 THR 35 -21.197 -14.087 -8.201
Start of MODEL 6
1 H1 GLU 1 H1 GLU 1 23.389 14.244 8.490
2 H2 GLU 1 H2 GLU 1 23.807 12.672 8.030
3 H3 GLU 1 H3 GLU 1 25.017 13.781 8.443
4 HA GLU 1 HA GLU 1 24.679 12.225 10.229
5 HB2 GLU 1 HB2 GLU 1 25.345 14.481 10.827
6 HB3 GLU 1 HB3 GLU 1 23.673 15.021 10.789
7 HG2 GLU 1 HG2 GLU 1 23.157 13.574 12.685
8 HG3 GLU 1 HG3 GLU 1 24.834 13.027 12.723
9 H LYS 2 HN LYS 2 21.735 14.000 9.380
10 HA LYS 2 HA LYS 2 20.182 11.971 10.845
11 HB2 LYS 2 HB2 LYS 2 18.387 13.654 10.999
12 HB3 LYS 2 HB3 LYS 2 19.869 14.178 11.789
13 HG2 LYS 2 HG2 LYS 2 20.419 15.537 9.821
14 HG3 LYS 2 HG3 LYS 2 18.899 15.044 9.075
15 HD2 LYS 2 HD2 LYS 2 17.654 16.071 10.907
16 HD3 LYS 2 HD3 LYS 2 19.168 16.536 11.684
17 HE2 LYS 2 HE2 LYS 2 19.727 17.932 9.753
18 HE3 LYS 2 HE3 LYS 2 18.210 17.470 8.981
19 HZ1 LYS 2 HZ1 LYS 2 18.513 18.999 11.508
20 HZ2 LYS 2 HZ2 LYS 2 17.034 18.473 10.879
21 HZ3 LYS 2 HZ3 LYS 2 17.961 19.599 10.024
22 H LEU 3 HN LEU 3 21.213 12.296 7.917
23 HA LEU 3 HA LEU 3 18.630 11.762 6.642
24 HB2 LEU 3 HB2 LEU 3 21.154 12.810 5.377
25 HB3 LEU 3 HB3 LEU 3 19.669 12.451 4.520
26 HG LEU 3 HG LEU 3 20.010 14.593 6.623
27 HD11 LEU 3 HD11 LEU 3 19.662 14.788 3.633
28 HD12 LEU 3 HD12 LEU 3 19.703 16.145 4.760
29 HD13 LEU 3 HD13 LEU 3 21.136 15.143 4.536
30 HD21 LEU 3 HD21 LEU 3 17.764 13.672 6.666
31 HD22 LEU 3 HD22 LEU 3 17.748 15.285 5.953
32 HD23 LEU 3 HD23 LEU 3 17.631 13.862 4.918
33 H LYS 4 HN LYS 4 18.306 9.833 5.752
34 HA LYS 4 HA LYS 4 20.607 8.006 5.554
35 HB2 LYS 4 HB2 LYS 4 17.681 7.343 5.924
36 HB3 LYS 4 HB3 LYS 4 19.002 6.184 5.865
37 HG2 LYS 4 HG2 LYS 4 19.763 6.730 7.956
38 HG3 LYS 4 HG3 LYS 4 19.082 8.357 7.896
39 HD2 LYS 4 HD2 LYS 4 17.813 7.046 9.461
40 HD3 LYS 4 HD3 LYS 4 16.815 7.354 8.038
41 HE2 LYS 4 HE2 LYS 4 16.576 5.046 8.763
42 HE3 LYS 4 HE3 LYS 4 17.362 5.119 7.186
43 HZ1 LYS 4 HZ1 LYS 4 18.768 4.765 9.778
44 HZ2 LYS 4 HZ2 LYS 4 19.489 4.781 8.249
45 HZ3 LYS 4 HZ3 LYS 4 18.432 3.530 8.672
46 H GLN 5 HN GLN 5 20.161 6.173 3.928
47 HA GLN 5 HA GLN 5 20.002 5.547 1.748
48 HB2 GLN 5 HB2 GLN 5 17.592 7.372 1.758
49 HB3 GLN 5 HB3 GLN 5 17.946 6.144 0.550
50 HG2 GLN 5 HG2 GLN 5 17.778 4.416 2.299
51 HG3 GLN 5 HG3 GLN 5 17.342 5.669 3.461
52 HE21 GLN 5 HE21 GLN 5 15.336 4.769 3.871
53 HE22 GLN 5 HE22 GLN 5 14.041 4.824 2.728
54 H ASP 6 HN ASP 6 21.788 6.352 0.772
55 HA ASP 6 HA ASP 6 21.487 8.942 -0.583
56 HB2 ASP 6 HB2 ASP 6 24.039 7.916 0.676
57 HB3 ASP 6 HB3 ASP 6 23.829 9.452 -0.158
58 H ILE 7 HN ILE 7 23.639 9.051 -2.112
59 HA ILE 7 HA ILE 7 23.193 6.919 -4.021
60 HB ILE 7 HB ILE 7 25.033 9.303 -4.261
61 HG12 ILE 7 HG12 ILE 7 22.707 10.008 -3.848
62 HG13 ILE 7 HG13 ILE 7 23.220 10.400 -5.485
63 HG21 ILE 7 HG21 ILE 7 25.579 7.592 -5.855
64 HG22 ILE 7 HG22 ILE 7 23.886 7.422 -6.318
65 HG23 ILE 7 HG23 ILE 7 24.759 8.908 -6.695
66 HD11 ILE 7 HD11 ILE 7 22.023 8.415 -6.307
67 HD12 ILE 7 HD12 ILE 7 21.467 8.095 -4.664
68 HD13 ILE 7 HD13 ILE 7 20.962 9.565 -5.496
69 H LEU 8 HN LEU 8 25.310 7.521 -1.484
70 HA LEU 8 HA LEU 8 27.226 5.549 -2.537
71 HB2 LEU 8 HB2 LEU 8 27.843 7.929 -0.781
72 HB3 LEU 8 HB3 LEU 8 28.992 6.682 -1.226
73 HG LEU 8 HG LEU 8 27.633 8.524 -3.194
74 HD11 LEU 8 HD11 LEU 8 29.810 9.635 -3.355
75 HD12 LEU 8 HD12 LEU 8 29.117 9.780 -1.740
76 HD13 LEU 8 HD13 LEU 8 30.417 8.627 -2.041
77 HD21 LEU 8 HD21 LEU 8 29.291 7.679 -4.767
78 HD22 LEU 8 HD22 LEU 8 29.934 6.604 -3.525
79 HD23 LEU 8 HD23 LEU 8 28.297 6.366 -4.134
80 H ASN 9 HN ASN 9 24.994 6.353 -0.191
81 HA ASN 9 HA ASN 9 26.172 4.566 1.812
82 HB2 ASN 9 HB2 ASN 9 25.475 6.781 2.620
83 HB3 ASN 9 HB3 ASN 9 23.836 6.478 2.050
84 HD21 ASN 9 HD21 ASN 9 22.957 6.713 4.087
85 HD22 ASN 9 HD22 ASN 9 23.158 5.525 5.326
86 H LEU 10 HN LEU 10 24.027 4.542 -0.723
87 HA LEU 10 HA LEU 10 23.016 1.955 -0.022
88 HB2 LEU 10 HB2 LEU 10 21.432 3.475 1.142
89 HB3 LEU 10 HB3 LEU 10 21.052 4.218 -0.399
90 HG LEU 10 HG LEU 10 20.176 2.040 -1.202
91 HD11 LEU 10 HD11 LEU 10 19.758 0.257 0.424
92 HD12 LEU 10 HD12 LEU 10 21.482 0.559 0.217
93 HD13 LEU 10 HD13 LEU 10 20.646 1.167 1.647
94 HD21 LEU 10 HD21 LEU 10 18.670 3.708 -0.266
95 HD22 LEU 10 HD22 LEU 10 18.130 2.078 0.139
96 HD23 LEU 10 HD23 LEU 10 18.945 3.065 1.353
97 H ARG 11 HN ARG 11 22.320 0.826 -1.795
98 HA ARG 11 HA ARG 11 23.394 1.311 -4.253
99 HB2 ARG 11 HB2 ARG 11 20.809 -0.166 -3.760
100 HB3 ARG 11 HB3 ARG 11 21.851 -0.341 -5.164
101 HG2 ARG 11 HG2 ARG 11 23.626 -1.222 -3.752
102 HG3 ARG 11 HG3 ARG 11 22.595 -1.035 -2.332
103 HD2 ARG 11 HD2 ARG 11 22.530 -3.330 -3.064
104 HD3 ARG 11 HD3 ARG 11 20.964 -2.580 -3.361
105 HE ARG 11 HE ARG 11 22.594 -2.385 -5.661
106 HH11 ARG 11 HH12 ARG 11 20.735 -4.683 -3.816
107 HH12 ARG 11 HH11 ARG 11 20.415 -5.708 -5.174
108 HH21 ARG 11 HH22 ARG 11 22.185 -3.732 -7.453
109 HH22 ARG 11 HH21 ARG 11 21.244 -5.173 -7.240
110 H THR 12 HN THR 12 19.894 1.258 -4.201
111 HA THR 12 HA THR 12 19.643 3.977 -5.137
112 HB THR 12 HB THR 12 18.948 1.707 -7.015
113 HG1 THR 12 HG1 THR 12 20.779 2.158 -8.009
114 HG21 THR 12 HG21 THR 12 18.680 4.697 -7.348
115 HG22 THR 12 HG22 THR 12 17.353 3.550 -7.159
116 HG23 THR 12 HG23 THR 12 18.370 3.492 -8.599
117 H ASP 13 HN ASP 13 18.080 4.493 -3.704
118 HA ASP 13 HA ASP 13 15.466 3.294 -4.057
119 HB2 ASP 13 HB2 ASP 13 16.885 3.225 -1.386
120 HB3 ASP 13 HB3 ASP 13 15.164 2.922 -1.602
121 H ILE 14 HN ILE 14 14.072 4.919 -4.180
122 HA ILE 14 HA ILE 14 14.000 7.031 -2.257
123 HB ILE 14 HB ILE 14 15.810 7.892 -3.666
124 HG12 ILE 14 HG12 ILE 14 14.757 10.081 -4.277
125 HG13 ILE 14 HG13 ILE 14 13.183 9.366 -3.948
126 HG21 ILE 14 HG21 ILE 14 13.799 7.780 -5.908
127 HG22 ILE 14 HG22 ILE 14 15.409 8.491 -6.000
128 HG23 ILE 14 HG23 ILE 14 15.225 6.755 -5.741
129 HD11 ILE 14 HD11 ILE 14 13.845 9.004 -1.622
130 HD12 ILE 14 HD12 ILE 14 15.413 9.739 -1.960
131 HD13 ILE 14 HD13 ILE 14 13.942 10.705 -2.079
132 H SER 15 HN SER 15 11.982 7.829 -2.093
133 HA SER 15 HA SER 15 9.742 8.046 -2.418
134 HB2 SER 15 HB2 SER 15 10.436 9.562 -4.192
135 HB3 SER 15 HB3 SER 15 10.611 8.212 -5.313
136 HG SER 15 HG SER 15 8.588 9.438 -5.436
137 H THR 16 HN THR 16 11.121 5.317 -2.705
138 HA THR 16 HA THR 16 8.990 3.919 -4.172
139 HB THR 16 HB THR 16 11.629 2.785 -3.226
140 HG1 THR 16 HG1 THR 16 11.155 3.162 -5.936
141 HG21 THR 16 HG21 THR 16 11.109 0.958 -4.779
142 HG22 THR 16 HG22 THR 16 9.564 1.720 -5.159
143 HG23 THR 16 HG23 THR 16 9.869 1.109 -3.533
144 H SER 17 HN SER 17 10.645 4.090 -1.063
145 HA SER 17 HA SER 17 8.454 2.505 0.103
146 HB2 SER 17 HB2 SER 17 10.062 1.505 1.682
147 HB3 SER 17 HB3 SER 17 10.474 1.114 0.012
148 HG SER 17 HG SER 17 11.764 3.288 0.444
149 H SEP 18 HN SER 18 8.053 2.921 2.376
150 HA SEP 18 HA SER 18 7.577 4.306 4.108
151 HB2 SEP 18 HB2 SER 18 10.334 5.337 3.422
152 HB3 SEP 18 HB3 SER 18 9.425 5.869 4.836
153 H SER 19 HN SER 19 7.226 5.168 1.138
154 HA SER 19 HA SER 19 6.753 8.028 1.651
155 HB2 SER 19 HB2 SER 19 6.917 6.598 -1.011
156 HB3 SER 19 HB3 SER 19 6.759 8.337 -0.764
157 HG SER 19 HG SER 19 8.977 6.974 -0.949
158 H SER 20 HN SER 20 5.323 5.435 -0.334
159 HA SER 20 HA SER 20 2.724 5.861 0.846
160 HB2 SER 20 HB2 SER 20 2.737 7.651 -0.821
161 HB3 SER 20 HB3 SER 20 3.191 6.503 -2.079
162 HG SER 20 HG SER 20 0.849 6.140 -0.549
163 H ILE 21 HN ILE 21 2.483 3.754 1.350
164 HA ILE 21 HA ILE 21 2.723 1.793 -0.838
165 HB ILE 21 HB ILE 21 2.955 1.284 2.133
166 HG12 ILE 21 HG12 ILE 21 5.344 0.601 1.325
167 HG13 ILE 21 HG13 ILE 21 4.988 1.644 -0.048
168 HG21 ILE 21 HG21 ILE 21 3.649 -0.977 1.463
169 HG22 ILE 21 HG22 ILE 21 1.998 -0.612 0.963
170 HG23 ILE 21 HG23 ILE 21 3.308 -0.571 -0.218
171 HD11 ILE 21 HD11 ILE 21 6.242 2.811 1.682
172 HD12 ILE 21 HD12 ILE 21 4.644 3.522 1.453
173 HD13 ILE 21 HD13 ILE 21 4.954 2.482 2.842
174 H SER 22 HN SER 22 0.977 0.609 -1.377
175 HA SER 22 HA SER 22 -1.218 0.224 0.447
176 HB2 SER 22 HB2 SER 22 -2.917 1.256 -1.040
177 HB3 SER 22 HB3 SER 22 -1.783 2.442 -0.393
178 HG SER 22 HG SER 22 -0.698 1.651 -2.606
179 H SER 23 HN SER 23 -1.938 -1.767 0.144
180 HA SER 23 HA SER 23 -1.418 -3.081 -2.428
181 HB2 SER 23 HB2 SER 23 -2.029 -4.264 0.292
182 HB3 SER 23 HB3 SER 23 -1.722 -5.197 -1.171
183 HG SER 23 HG SER 23 0.152 -4.943 0.145
184 H SER 24 HN SER 24 -3.087 -2.968 -3.774
185 HA SER 24 HA SER 24 -5.812 -2.915 -2.757
186 HB2 SER 24 HB2 SER 24 -6.434 -2.485 -5.115
187 HB3 SER 24 HB3 SER 24 -5.219 -1.345 -4.538
188 HG SER 24 HG SER 24 -4.148 -1.967 -6.234
189 H GLU 25 HN GLU 25 -3.753 -5.314 -3.157
190 HA GLU 25 HA GLU 25 -5.019 -7.146 -4.881
191 HB2 GLU 25 HB2 GLU 25 -3.283 -7.692 -2.464
192 HB3 GLU 25 HB3 GLU 25 -3.697 -8.866 -3.706
193 HG2 GLU 25 HG2 GLU 25 -2.117 -6.339 -4.138
194 HG3 GLU 25 HG3 GLU 25 -1.453 -7.967 -4.013
195 H GLU 26 HN GLU 26 -4.974 -7.213 -1.309
196 HA GLU 26 HA GLU 26 -7.083 -9.069 -1.095
197 HB2 GLU 26 HB2 GLU 26 -7.158 -8.404 1.288
198 HB3 GLU 26 HB3 GLU 26 -5.527 -8.753 0.732
199 HG2 GLU 26 HG2 GLU 26 -4.991 -6.432 0.621
200 HG3 GLU 26 HG3 GLU 26 -6.667 -5.979 0.933
201 H ASN 27 HN ASN 27 -9.253 -8.808 -0.560
202 HA ASN 27 HA ASN 27 -10.404 -6.161 -0.409
203 HB2 ASN 27 HB2 ASN 27 -11.945 -6.531 -2.320
204 HB3 ASN 27 HB3 ASN 27 -10.261 -6.420 -2.821
205 HD21 ASN 27 HD21 ASN 27 -9.190 -8.276 -3.524
206 HD22 ASN 27 HD22 ASN 27 -10.051 -9.692 -4.016
207 H ASP 28 HN ASP 28 -12.663 -6.194 0.169
208 HA ASP 28 HA ASP 28 -13.710 -8.796 1.015
209 HB2 ASP 28 HB2 ASP 28 -12.552 -7.791 2.963
210 HB3 ASP 28 HB3 ASP 28 -13.590 -6.374 2.828
211 H PHE 29 HN PHE 29 -15.498 -8.919 -0.177
212 HA PHE 29 HA PHE 29 -17.705 -7.232 0.316
213 HB2 PHE 29 HB2 PHE 29 -16.114 -5.914 -1.323
214 HB3 PHE 29 HB3 PHE 29 -16.842 -6.966 -2.533
215 HD1 PHE 29 HD1 PHE 29 -19.206 -6.781 -3.081
216 HD2 PHE 29 HD2 PHE 29 -17.390 -4.199 -0.228
217 HE1 PHE 29 HE1 PHE 29 -21.144 -5.273 -3.217
218 HE2 PHE 29 HE2 PHE 29 -19.326 -2.686 -0.358
219 HZ PHE 29 HZ PHE 29 -21.208 -3.223 -1.855
220 H TRP 30 HN TRP 30 -16.146 -9.674 -1.592
221 HA TRP 30 HA TRP 30 -18.690 -11.071 -1.851
222 HB2 TRP 30 HB2 TRP 30 -16.730 -10.592 -4.100
223 HB3 TRP 30 HB3 TRP 30 -17.995 -11.813 -4.155
224 HD1 TRP 30 HD1 TRP 30 -17.362 -8.224 -4.837
225 HE1 TRP 30 HE1 TRP 30 -19.548 -7.048 -5.519
226 HE3 TRP 30 HE3 TRP 30 -20.675 -11.881 -3.535
227 HZ2 TRP 30 HZ2 TRP 30 -22.319 -7.604 -5.505
228 HZ3 TRP 30 HZ3 TRP 30 -23.076 -11.487 -3.902
229 HH2 TRP 30 HH2 TRP 30 -23.880 -9.391 -4.866
230 H GLN 31 HN GLN 31 -18.562 -13.177 -1.516
231 HA GLN 31 HA GLN 31 -15.906 -14.373 -1.132
232 HB2 GLN 31 HB2 GLN 31 -17.076 -14.113 0.990
233 HB3 GLN 31 HB3 GLN 31 -18.482 -14.947 0.340
234 HG2 GLN 31 HG2 GLN 31 -17.339 -17.004 0.250
235 HG3 GLN 31 HG3 GLN 31 -15.781 -16.235 0.536
236 HE21 GLN 31 HE21 GLN 31 -18.727 -15.455 2.278
237 HE22 GLN 31 HE22 GLN 31 -18.211 -16.075 3.803
238 HA PRO 32 HA PRO 32 -17.977 -16.720 -4.533
239 HB2 PRO 32 HB2 PRO 32 -15.288 -16.913 -5.650
240 HB3 PRO 32 HB3 PRO 32 -16.738 -16.201 -6.357
241 HG2 PRO 32 HG2 PRO 32 -14.622 -14.715 -5.551
242 HG3 PRO 32 HG3 PRO 32 -16.292 -14.115 -5.511
243 HD2 PRO 32 HD2 PRO 32 -14.603 -15.188 -3.278
244 HD3 PRO 32 HD3 PRO 32 -15.716 -13.801 -3.288
245 H LYS 33 HN LYS 33 -17.762 -18.919 -5.151
246 HA LYS 33 HA LYS 33 -16.515 -20.558 -3.110
247 HB2 LYS 33 HB2 LYS 33 -18.213 -21.312 -5.499
248 HB3 LYS 33 HB3 LYS 33 -17.692 -22.419 -4.236
249 HG2 LYS 33 HG2 LYS 33 -19.074 -21.426 -2.635
250 HG3 LYS 33 HG3 LYS 33 -19.300 -19.969 -3.605
251 HD2 LYS 33 HD2 LYS 33 -20.619 -21.193 -5.215
252 HD3 LYS 33 HD3 LYS 33 -20.305 -22.709 -4.368
253 HE2 LYS 33 HE2 LYS 33 -21.756 -20.347 -3.182
254 HE3 LYS 33 HE3 LYS 33 -22.547 -21.751 -3.897
255 HZ1 LYS 33 HZ1 LYS 33 -22.407 -21.931 -1.491
256 HZ2 LYS 33 HZ2 LYS 33 -20.720 -21.812 -1.554
257 HZ3 LYS 33 HZ3 LYS 33 -21.501 -23.150 -2.234
258 HA PRO 34 HA PRO 34 -12.817 -21.768 -5.192
259 HB2 PRO 34 HB2 PRO 34 -13.671 -24.594 -4.779
260 HB3 PRO 34 HB3 PRO 34 -12.151 -23.803 -4.346
261 HG2 PRO 34 HG2 PRO 34 -13.959 -24.354 -2.478
262 HG3 PRO 34 HG3 PRO 34 -13.051 -22.829 -2.436
263 HD2 PRO 34 HD2 PRO 34 -15.874 -23.335 -3.279
264 HD3 PRO 34 HD3 PRO 34 -15.187 -21.951 -2.401
265 H THR 35 HN THR 35 -13.020 -21.264 -7.324
266 HA THR 35 HA THR 35 -14.827 -22.320 -9.147
267 HB THR 35 HB THR 35 -13.709 -20.376 -9.840
268 HG1 THR 35 HG1 THR 35 -13.949 -21.614 -11.646
269 HG21 THR 35 HG21 THR 35 -11.087 -21.834 -9.481
270 HG22 THR 35 HG22 THR 35 -11.728 -20.583 -8.415
271 HG23 THR 35 HG23 THR 35 -11.281 -20.184 -10.074
Start of MODEL 7
1 H1 GLU 1 H1 GLU 1 17.802 1.053 11.575
2 H2 GLU 1 H2 GLU 1 16.404 1.344 10.667
3 H3 GLU 1 H3 GLU 1 16.705 2.244 12.066
4 HA GLU 1 HA GLU 1 18.334 2.294 9.594
5 HB2 GLU 1 HB2 GLU 1 17.466 4.585 9.332
6 HB3 GLU 1 HB3 GLU 1 16.180 3.387 9.275
7 HG2 GLU 1 HG2 GLU 1 15.605 3.893 11.595
8 HG3 GLU 1 HG3 GLU 1 16.895 5.095 11.650
9 H LYS 2 HN LYS 2 20.135 3.631 9.637
10 HA LYS 2 HA LYS 2 20.801 5.108 12.032
11 HB2 LYS 2 HB2 LYS 2 21.474 2.727 12.503
12 HB3 LYS 2 HB3 LYS 2 22.610 2.848 11.167
13 HG2 LYS 2 HG2 LYS 2 23.792 4.640 12.304
14 HG3 LYS 2 HG3 LYS 2 22.630 4.579 13.629
15 HD2 LYS 2 HD2 LYS 2 23.299 2.225 14.040
16 HD3 LYS 2 HD3 LYS 2 24.538 2.398 12.794
17 HE2 LYS 2 HE2 LYS 2 25.578 4.198 14.078
18 HE3 LYS 2 HE3 LYS 2 24.334 4.040 15.316
19 HZ1 LYS 2 HZ1 LYS 2 25.097 1.761 15.700
20 HZ2 LYS 2 HZ2 LYS 2 26.323 2.888 15.985
21 HZ3 LYS 2 HZ3 LYS 2 26.330 1.974 14.562
22 H LEU 3 HN LEU 3 21.194 4.322 8.743
23 HA LEU 3 HA LEU 3 22.749 6.729 8.328
24 HB2 LEU 3 HB2 LEU 3 24.443 4.971 8.516
25 HB3 LEU 3 HB3 LEU 3 23.627 4.049 7.267
26 HG LEU 3 HG LEU 3 24.116 5.838 5.639
27 HD11 LEU 3 HD11 LEU 3 25.653 7.066 7.923
28 HD12 LEU 3 HD12 LEU 3 25.731 7.589 6.240
29 HD13 LEU 3 HD13 LEU 3 24.221 7.735 7.139
30 HD21 LEU 3 HD21 LEU 3 26.509 5.402 5.448
31 HD22 LEU 3 HD22 LEU 3 26.537 4.795 7.103
32 HD23 LEU 3 HD23 LEU 3 25.626 3.932 5.863
33 H LYS 4 HN LYS 4 22.044 7.824 6.620
34 HA LYS 4 HA LYS 4 20.169 6.476 4.802
35 HB2 LYS 4 HB2 LYS 4 20.454 9.438 5.317
36 HB3 LYS 4 HB3 LYS 4 19.189 8.650 4.387
37 HG2 LYS 4 HG2 LYS 4 18.126 9.055 6.385
38 HG3 LYS 4 HG3 LYS 4 18.691 7.401 6.610
39 HD2 LYS 4 HD2 LYS 4 19.168 8.622 8.611
40 HD3 LYS 4 HD3 LYS 4 20.696 8.328 7.782
41 HE2 LYS 4 HE2 LYS 4 20.568 10.609 6.831
42 HE3 LYS 4 HE3 LYS 4 19.102 10.887 7.770
43 HZ1 LYS 4 HZ1 LYS 4 21.029 11.796 8.888
44 HZ2 LYS 4 HZ2 LYS 4 21.790 10.286 8.880
45 HZ3 LYS 4 HZ3 LYS 4 20.387 10.519 9.793
46 H GLN 5 HN GLN 5 22.408 9.246 4.670
47 HA GLN 5 HA GLN 5 22.804 8.976 1.858
48 HB2 GLN 5 HB2 GLN 5 24.483 10.744 2.136
49 HB3 GLN 5 HB3 GLN 5 22.983 11.149 2.959
50 HG2 GLN 5 HG2 GLN 5 23.950 10.531 5.089
51 HG3 GLN 5 HG3 GLN 5 25.439 10.027 4.292
52 HE21 GLN 5 HE21 GLN 5 26.697 11.478 5.431
53 HE22 GLN 5 HE22 GLN 5 26.651 13.180 5.139
54 H ASP 6 HN ASP 6 24.528 8.141 0.736
55 HA ASP 6 HA ASP 6 26.864 7.134 2.056
56 HB2 ASP 6 HB2 ASP 6 25.203 5.336 2.516
57 HB3 ASP 6 HB3 ASP 6 24.985 5.133 0.781
58 H ILE 7 HN ILE 7 28.392 6.173 0.515
59 HA ILE 7 HA ILE 7 28.391 7.659 -1.943
60 HB ILE 7 HB ILE 7 30.370 5.518 -1.183
61 HG12 ILE 7 HG12 ILE 7 30.102 7.055 0.726
62 HG13 ILE 7 HG13 ILE 7 31.678 7.244 -0.034
63 HG21 ILE 7 HG21 ILE 7 30.566 6.340 -3.447
64 HG22 ILE 7 HG22 ILE 7 30.578 8.009 -2.871
65 HG23 ILE 7 HG23 ILE 7 31.919 6.931 -2.484
66 HD11 ILE 7 HD11 ILE 7 30.747 9.395 0.557
67 HD12 ILE 7 HD12 ILE 7 30.859 9.242 -1.197
68 HD13 ILE 7 HD13 ILE 7 29.300 9.055 -0.393
69 H LEU 8 HN LEU 8 26.996 4.789 -1.049
70 HA LEU 8 HA LEU 8 27.089 3.760 -3.807
71 HB2 LEU 8 HB2 LEU 8 26.781 2.198 -1.242
72 HB3 LEU 8 HB3 LEU 8 26.673 1.514 -2.853
73 HG LEU 8 HG LEU 8 29.143 2.857 -1.756
74 HD11 LEU 8 HD11 LEU 8 28.663 0.855 -0.473
75 HD12 LEU 8 HD12 LEU 8 28.469 -0.074 -1.960
76 HD13 LEU 8 HD13 LEU 8 30.047 0.587 -1.532
77 HD21 LEU 8 HD21 LEU 8 30.244 1.769 -3.661
78 HD22 LEU 8 HD22 LEU 8 28.679 1.172 -4.215
79 HD23 LEU 8 HD23 LEU 8 28.998 2.906 -4.182
80 H ASN 9 HN ASN 9 25.196 5.131 -1.434
81 HA ASN 9 HA ASN 9 22.727 4.083 -2.642
82 HB2 ASN 9 HB2 ASN 9 22.949 3.529 -0.248
83 HB3 ASN 9 HB3 ASN 9 23.109 5.241 0.129
84 HD21 ASN 9 HD21 ASN 9 21.301 5.245 1.440
85 HD22 ASN 9 HD22 ASN 9 19.696 5.131 0.812
86 H LEU 10 HN LEU 10 24.733 6.715 -2.447
87 HA LEU 10 HA LEU 10 24.601 8.861 -3.166
88 HB2 LEU 10 HB2 LEU 10 22.971 7.541 -4.831
89 HB3 LEU 10 HB3 LEU 10 21.789 8.582 -4.072
90 HG LEU 10 HG LEU 10 22.625 9.516 -6.181
91 HD11 LEU 10 HD11 LEU 10 23.510 11.114 -3.786
92 HD12 LEU 10 HD12 LEU 10 23.131 11.746 -5.387
93 HD13 LEU 10 HD13 LEU 10 21.861 11.019 -4.404
94 HD21 LEU 10 HD21 LEU 10 24.872 8.559 -6.124
95 HD22 LEU 10 HD22 LEU 10 24.921 10.306 -6.365
96 HD23 LEU 10 HD23 LEU 10 25.295 9.624 -4.783
97 H ARG 11 HN ARG 11 24.315 10.644 -2.003
98 HA ARG 11 HA ARG 11 22.990 10.696 0.417
99 HB2 ARG 11 HB2 ARG 11 23.685 13.042 -1.356
100 HB3 ARG 11 HB3 ARG 11 23.286 13.145 0.353
101 HG2 ARG 11 HG2 ARG 11 25.245 11.841 0.922
102 HG3 ARG 11 HG3 ARG 11 25.637 11.652 -0.789
103 HD2 ARG 11 HD2 ARG 11 25.908 14.072 -0.996
104 HD3 ARG 11 HD3 ARG 11 25.495 14.268 0.707
105 HE ARG 11 HE ARG 11 27.599 12.594 0.811
106 HH11 ARG 11 HH12 ARG 11 27.094 15.620 -0.849
107 HH12 ARG 11 HH11 ARG 11 28.758 16.088 -0.769
108 HH21 ARG 11 HH22 ARG 11 29.792 13.207 0.921
109 HH22 ARG 11 HH21 ARG 11 30.293 14.718 0.240
110 H THR 12 HN THR 12 21.654 11.045 -2.711
111 HA THR 12 HA THR 12 19.070 11.767 -1.512
112 HB THR 12 HB THR 12 18.509 13.051 -3.575
113 HG1 THR 12 HG1 THR 12 20.572 13.781 -4.688
114 HG21 THR 12 HG21 THR 12 20.889 14.061 -2.013
115 HG22 THR 12 HG22 THR 12 19.196 14.229 -1.552
116 HG23 THR 12 HG23 THR 12 19.806 15.058 -2.984
117 H ASP 13 HN ASP 13 18.126 9.795 -1.606
118 HA ASP 13 HA ASP 13 17.819 8.602 -4.282
119 HB2 ASP 13 HB2 ASP 13 17.780 6.374 -3.223
120 HB3 ASP 13 HB3 ASP 13 19.316 7.194 -2.961
121 H ILE 14 HN ILE 14 16.287 10.233 -1.959
122 HA ILE 14 HA ILE 14 13.919 8.703 -1.565
123 HB ILE 14 HB ILE 14 14.469 10.376 0.057
124 HG12 ILE 14 HG12 ILE 14 12.054 11.305 -1.513
125 HG13 ILE 14 HG13 ILE 14 12.065 9.955 -0.383
126 HG21 ILE 14 HG21 ILE 14 14.146 12.478 -2.076
127 HG22 ILE 14 HG22 ILE 14 14.630 12.722 -0.398
128 HG23 ILE 14 HG23 ILE 14 15.699 11.866 -1.510
129 HD11 ILE 14 HD11 ILE 14 12.500 12.862 0.253
130 HD12 ILE 14 HD12 ILE 14 11.122 11.857 0.702
131 HD13 ILE 14 HD13 ILE 14 12.709 11.549 1.410
132 H SER 15 HN SER 15 12.541 8.212 -3.120
133 HA SER 15 HA SER 15 11.255 10.206 -4.682
134 HB2 SER 15 HB2 SER 15 11.959 9.416 -6.913
135 HB3 SER 15 HB3 SER 15 13.318 10.067 -6.000
136 HG SER 15 HG SER 15 14.072 8.182 -6.764
137 H THR 16 HN THR 16 9.286 9.434 -4.247
138 HA THR 16 HA THR 16 7.495 8.036 -4.085
139 HB THR 16 HB THR 16 7.043 6.623 -6.001
140 HG1 THR 16 HG1 THR 16 8.989 6.767 -7.618
141 HG21 THR 16 HG21 THR 16 7.321 8.259 -7.806
142 HG22 THR 16 HG22 THR 16 8.481 9.150 -6.819
143 HG23 THR 16 HG23 THR 16 6.796 9.034 -6.311
144 H SER 17 HN SER 17 10.065 7.204 -2.754
145 HA SER 17 HA SER 17 10.062 4.328 -2.829
146 HB2 SER 17 HB2 SER 17 12.140 5.542 -2.382
147 HB3 SER 17 HB3 SER 17 11.431 6.251 -0.933
148 HG SER 17 HG SER 17 11.512 3.458 -1.226
149 H SEP 18 HN SER 18 9.447 6.648 -0.186
150 HA SEP 18 HA SER 18 8.084 4.660 1.376
151 HB2 SEP 18 HB2 SER 18 8.326 7.650 1.793
152 HB3 SEP 18 HB3 SER 18 7.716 6.495 2.979
153 H SER 19 HN SER 19 7.145 6.241 -1.298
154 HA SER 19 HA SER 19 4.384 6.670 -0.397
155 HB2 SER 19 HB2 SER 19 5.362 8.573 -1.548
156 HB3 SER 19 HB3 SER 19 5.783 7.559 -2.928
157 HG SER 19 HG SER 19 3.134 7.443 -2.233
158 H SER 20 HN SER 20 3.296 4.800 -0.499
159 HA SER 20 HA SER 20 3.571 3.153 -2.923
160 HB2 SER 20 HB2 SER 20 2.517 2.395 -0.188
161 HB3 SER 20 HB3 SER 20 2.618 1.313 -1.575
162 HG SER 20 HG SER 20 4.767 2.564 -0.211
163 H ILE 21 HN ILE 21 1.382 1.795 -3.176
164 HA ILE 21 HA ILE 21 -0.942 3.530 -2.850
165 HB ILE 21 HB ILE 21 -0.028 4.138 -5.042
166 HG12 ILE 21 HG12 ILE 21 -2.536 2.467 -5.325
167 HG13 ILE 21 HG13 ILE 21 -2.495 4.087 -4.633
168 HG21 ILE 21 HG21 ILE 21 -0.403 1.224 -5.728
169 HG22 ILE 21 HG22 ILE 21 0.047 2.499 -6.861
170 HG23 ILE 21 HG23 ILE 21 1.138 2.060 -5.546
171 HD11 ILE 21 HD11 ILE 21 -1.692 4.969 -6.765
172 HD12 ILE 21 HD12 ILE 21 -1.751 3.348 -7.454
173 HD13 ILE 21 HD13 ILE 21 -3.239 4.141 -6.937
174 H SER 22 HN SER 22 -2.891 2.449 -2.773
175 HA SER 22 HA SER 22 -4.326 0.729 -2.403
176 HB2 SER 22 HB2 SER 22 -3.865 0.219 -4.773
177 HB3 SER 22 HB3 SER 22 -2.499 -0.784 -4.286
178 HG SER 22 HG SER 22 -4.971 -1.338 -3.129
179 H SER 23 HN SER 23 -4.302 -1.785 -1.801
180 HA SER 23 HA SER 23 -1.985 -2.648 -0.343
181 HB2 SER 23 HB2 SER 23 -3.059 -2.659 1.881
182 HB3 SER 23 HB3 SER 23 -2.874 -1.020 1.258
183 HG SER 23 HG SER 23 -4.934 -1.106 1.962
184 H SER 24 HN SER 24 -2.420 -4.725 0.823
185 HA SER 24 HA SER 24 -3.892 -6.475 -0.879
186 HB2 SER 24 HB2 SER 24 -3.168 -8.244 0.683
187 HB3 SER 24 HB3 SER 24 -1.823 -7.207 0.210
188 HG SER 24 HG SER 24 -2.486 -6.018 2.257
189 H GLU 25 HN GLU 25 -5.453 -8.109 0.047
190 HA GLU 25 HA GLU 25 -7.110 -7.045 2.202
191 HB2 GLU 25 HB2 GLU 25 -9.168 -7.460 0.793
192 HB3 GLU 25 HB3 GLU 25 -8.203 -6.061 0.347
193 HG2 GLU 25 HG2 GLU 25 -8.813 -7.094 -1.667
194 HG3 GLU 25 HG3 GLU 25 -7.123 -7.516 -1.406
195 H GLU 26 HN GLU 26 -8.663 -8.577 3.032
196 HA GLU 26 HA GLU 26 -8.126 -11.375 2.321
197 HB2 GLU 26 HB2 GLU 26 -8.118 -10.200 5.104
198 HB3 GLU 26 HB3 GLU 26 -8.172 -11.925 4.772
199 HG2 GLU 26 HG2 GLU 26 -5.971 -10.094 3.849
200 HG3 GLU 26 HG3 GLU 26 -5.918 -11.053 5.327
201 H ASN 27 HN ASN 27 -10.344 -9.069 2.411
202 HA ASN 27 HA ASN 27 -12.509 -10.243 3.826
203 HB2 ASN 27 HB2 ASN 27 -13.896 -8.632 2.456
204 HB3 ASN 27 HB3 ASN 27 -12.600 -7.897 3.398
205 HD21 ASN 27 HD21 ASN 27 -12.566 -6.095 2.052
206 HD22 ASN 27 HD22 ASN 27 -11.882 -6.149 0.468
207 H ASP 28 HN ASP 28 -14.635 -10.240 2.100
208 HA ASP 28 HA ASP 28 -15.809 -11.564 0.679
209 HB2 ASP 28 HB2 ASP 28 -13.131 -11.625 -0.711
210 HB3 ASP 28 HB3 ASP 28 -14.563 -12.411 -1.371
211 H PHE 29 HN PHE 29 -16.466 -13.303 1.782
212 HA PHE 29 HA PHE 29 -14.656 -15.628 1.875
213 HB2 PHE 29 HB2 PHE 29 -16.868 -15.236 3.866
214 HB3 PHE 29 HB3 PHE 29 -15.407 -16.207 4.012
215 HD1 PHE 29 HD2 PHE 29 -16.800 -12.823 4.191
216 HD2 PHE 29 HD1 PHE 29 -13.338 -15.237 4.744
217 HE1 PHE 29 HE2 PHE 29 -15.715 -10.980 5.408
218 HE2 PHE 29 HE1 PHE 29 -12.246 -13.399 5.963
219 HZ PHE 29 HZ PHE 29 -13.434 -11.269 6.295
220 H TRP 30 HN TRP 30 -17.680 -14.350 0.959
221 HA TRP 30 HA TRP 30 -19.264 -16.671 0.882
222 HB2 TRP 30 HB2 TRP 30 -19.341 -14.056 -0.599
223 HB3 TRP 30 HB3 TRP 30 -20.486 -15.341 -0.972
224 HD1 TRP 30 HD1 TRP 30 -19.701 -12.692 1.617
225 HE1 TRP 30 HE1 TRP 30 -21.609 -12.616 3.347
226 HE3 TRP 30 HE3 TRP 30 -22.254 -16.878 0.187
227 HZ2 TRP 30 HZ2 TRP 30 -23.896 -14.135 4.017
228 HZ3 TRP 30 HZ3 TRP 30 -24.291 -17.502 1.424
229 HH2 TRP 30 HH2 TRP 30 -25.093 -16.158 3.298
230 H GLN 31 HN GLN 31 -18.490 -15.079 -2.147
231 HA GLN 31 HA GLN 31 -17.260 -17.537 -3.151
232 HB2 GLN 31 HB2 GLN 31 -19.558 -16.076 -4.466
233 HB3 GLN 31 HB3 GLN 31 -18.609 -17.337 -5.243
234 HG2 GLN 31 HG2 GLN 31 -19.329 -18.935 -3.555
235 HG3 GLN 31 HG3 GLN 31 -20.260 -17.675 -2.751
236 HE21 GLN 31 HE21 GLN 31 -22.178 -18.800 -2.998
237 HE22 GLN 31 HE22 GLN 31 -22.978 -18.944 -4.523
238 HA PRO 32 HA PRO 32 -15.035 -13.577 -4.320
239 HB2 PRO 32 HB2 PRO 32 -12.679 -15.058 -3.372
240 HB3 PRO 32 HB3 PRO 32 -13.244 -13.447 -2.926
241 HG2 PRO 32 HG2 PRO 32 -13.398 -15.514 -1.221
242 HG3 PRO 32 HG3 PRO 32 -14.638 -14.247 -1.270
243 HD2 PRO 32 HD2 PRO 32 -14.695 -16.999 -2.456
244 HD3 PRO 32 HD3 PRO 32 -15.969 -16.126 -1.577
245 H LYS 33 HN LYS 33 -15.230 -16.723 -5.323
246 HA LYS 33 HA LYS 33 -13.002 -16.976 -7.042
247 HB2 LYS 33 HB2 LYS 33 -15.740 -18.239 -7.287
248 HB3 LYS 33 HB3 LYS 33 -14.276 -18.780 -8.098
249 HG2 LYS 33 HG2 LYS 33 -13.297 -19.489 -6.073
250 HG3 LYS 33 HG3 LYS 33 -14.516 -18.653 -5.108
251 HD2 LYS 33 HD2 LYS 33 -16.232 -20.176 -5.979
252 HD3 LYS 33 HD3 LYS 33 -15.000 -21.020 -6.918
253 HE2 LYS 33 HE2 LYS 33 -15.507 -22.219 -4.855
254 HE3 LYS 33 HE3 LYS 33 -13.844 -21.636 -4.858
255 HZ1 LYS 33 HZ1 LYS 33 -16.125 -20.348 -3.460
256 HZ2 LYS 33 HZ2 LYS 33 -14.532 -19.783 -3.466
257 HZ3 LYS 33 HZ3 LYS 33 -14.903 -21.258 -2.724
258 HA PRO 34 HA PRO 34 -14.088 -14.421 -10.478
259 HB2 PRO 34 HB2 PRO 34 -13.128 -15.820 -12.586
260 HB3 PRO 34 HB3 PRO 34 -12.073 -15.020 -11.416
261 HG2 PRO 34 HG2 PRO 34 -12.878 -17.901 -11.578
262 HG3 PRO 34 HG3 PRO 34 -11.276 -17.204 -11.271
263 HD2 PRO 34 HD2 PRO 34 -12.860 -18.148 -9.287
264 HD3 PRO 34 HD3 PRO 34 -11.742 -16.789 -9.053
265 H THR 35 HN THR 35 -15.733 -17.149 -9.804
266 HA THR 35 HA THR 35 -17.575 -18.226 -10.601
267 HB THR 35 HB THR 35 -19.334 -16.763 -11.545
268 HG1 THR 35 HG1 THR 35 -18.140 -14.391 -11.225
269 HG21 THR 35 HG21 THR 35 -17.854 -15.587 -9.190
270 HG22 THR 35 HG22 THR 35 -19.047 -16.884 -9.127
271 HG23 THR 35 HG23 THR 35 -19.535 -15.261 -9.612
Start of MODEL 8
1 H1 GLU 1 H1 GLU 1 32.699 11.357 7.968
2 H2 GLU 1 H2 GLU 1 31.773 12.374 6.984
3 H3 GLU 1 H3 GLU 1 33.450 12.591 7.083
4 HA GLU 1 HA GLU 1 32.823 11.520 5.014
5 HB2 GLU 1 HB2 GLU 1 34.305 9.742 6.962
6 HB3 GLU 1 HB3 GLU 1 34.343 9.571 5.213
7 HG2 GLU 1 HG2 GLU 1 35.323 11.952 6.769
8 HG3 GLU 1 HG3 GLU 1 36.331 10.695 6.055
9 H LYS 2 HN LYS 2 31.489 10.103 7.874
10 HA LYS 2 HA LYS 2 30.375 7.811 6.513
11 HB2 LYS 2 HB2 LYS 2 31.048 7.659 8.870
12 HB3 LYS 2 HB3 LYS 2 29.865 8.890 9.291
13 HG2 LYS 2 HG2 LYS 2 28.068 7.389 8.532
14 HG3 LYS 2 HG3 LYS 2 29.277 6.146 8.195
15 HD2 LYS 2 HD2 LYS 2 28.861 7.409 10.902
16 HD3 LYS 2 HD3 LYS 2 28.110 5.895 10.394
17 HE2 LYS 2 HE2 LYS 2 31.082 6.406 10.487
18 HE3 LYS 2 HE3 LYS 2 30.164 5.563 11.733
19 HZ1 LYS 2 HZ1 LYS 2 31.233 4.013 10.228
20 HZ2 LYS 2 HZ2 LYS 2 30.435 4.702 8.905
21 HZ3 LYS 2 HZ3 LYS 2 29.550 3.893 10.096
22 H LEU 3 HN LEU 3 28.318 7.542 5.797
23 HA LEU 3 HA LEU 3 26.148 9.222 6.481
24 HB2 LEU 3 HB2 LEU 3 27.428 10.787 5.042
25 HB3 LEU 3 HB3 LEU 3 27.305 9.637 3.723
26 HG LEU 3 HG LEU 3 24.804 9.862 3.868
27 HD11 LEU 3 HD11 LEU 3 25.504 12.184 5.661
28 HD12 LEU 3 HD12 LEU 3 23.903 11.809 5.023
29 HD13 LEU 3 HD13 LEU 3 24.680 10.704 6.157
30 HD21 LEU 3 HD21 LEU 3 24.750 12.013 2.705
31 HD22 LEU 3 HD22 LEU 3 26.385 12.362 3.272
32 HD23 LEU 3 HD23 LEU 3 26.104 11.019 2.162
33 H LYS 4 HN LYS 4 24.272 8.217 6.014
34 HA LYS 4 HA LYS 4 24.440 5.756 4.436
35 HB2 LYS 4 HB2 LYS 4 22.243 6.699 6.288
36 HB3 LYS 4 HB3 LYS 4 22.348 5.118 5.526
37 HG2 LYS 4 HG2 LYS 4 23.166 4.604 7.581
38 HG3 LYS 4 HG3 LYS 4 24.670 5.058 6.778
39 HD2 LYS 4 HD2 LYS 4 24.372 7.365 7.678
40 HD3 LYS 4 HD3 LYS 4 22.985 6.774 8.596
41 HE2 LYS 4 HE2 LYS 4 24.458 5.144 9.714
42 HE3 LYS 4 HE3 LYS 4 25.834 5.814 8.839
43 HZ1 LYS 4 HZ1 LYS 4 25.384 7.959 9.904
44 HZ2 LYS 4 HZ2 LYS 4 25.719 6.749 11.040
45 HZ3 LYS 4 HZ3 LYS 4 24.124 7.258 10.791
46 H GLN 5 HN GLN 5 23.626 5.670 2.449
47 HA GLN 5 HA GLN 5 21.368 7.380 1.743
48 HB2 GLN 5 HB2 GLN 5 22.515 8.004 -0.407
49 HB3 GLN 5 HB3 GLN 5 23.187 8.742 1.040
50 HG2 GLN 5 HG2 GLN 5 25.027 7.203 1.043
51 HG3 GLN 5 HG3 GLN 5 24.319 6.293 -0.290
52 HE21 GLN 5 HE21 GLN 5 24.305 9.787 -0.104
53 HE22 GLN 5 HE22 GLN 5 25.401 10.052 -1.411
54 H ASP 6 HN ASP 6 23.567 4.790 0.752
55 HA ASP 6 HA ASP 6 21.343 3.595 -0.771
56 HB2 ASP 6 HB2 ASP 6 23.277 4.275 -2.173
57 HB3 ASP 6 HB3 ASP 6 24.307 3.198 -1.232
58 H ILE 7 HN ILE 7 20.448 2.205 0.662
59 HA ILE 7 HA ILE 7 22.199 0.099 1.733
60 HB ILE 7 HB ILE 7 19.937 1.414 3.244
61 HG12 ILE 7 HG12 ILE 7 21.995 2.781 3.143
62 HG13 ILE 7 HG13 ILE 7 21.654 2.216 4.774
63 HG21 ILE 7 HG21 ILE 7 20.660 -0.037 5.115
64 HG22 ILE 7 HG22 ILE 7 20.018 -0.941 3.743
65 HG23 ILE 7 HG23 ILE 7 21.760 -0.862 4.010
66 HD11 ILE 7 HD11 ILE 7 24.033 2.091 4.210
67 HD12 ILE 7 HD12 ILE 7 23.350 0.505 4.566
68 HD13 ILE 7 HD13 ILE 7 23.654 0.981 2.894
69 H LEU 8 HN LEU 8 18.839 1.040 1.098
70 HA LEU 8 HA LEU 8 18.327 -1.556 -0.076
71 HB2 LEU 8 HB2 LEU 8 17.809 -1.627 2.426
72 HB3 LEU 8 HB3 LEU 8 16.494 -0.522 2.076
73 HG LEU 8 HG LEU 8 15.534 -2.206 0.524
74 HD11 LEU 8 HD11 LEU 8 17.742 -3.318 0.102
75 HD12 LEU 8 HD12 LEU 8 17.577 -4.084 1.681
76 HD13 LEU 8 HD13 LEU 8 16.393 -4.413 0.413
77 HD21 LEU 8 HD21 LEU 8 14.752 -2.046 2.829
78 HD22 LEU 8 HD22 LEU 8 14.729 -3.718 2.268
79 HD23 LEU 8 HD23 LEU 8 16.013 -3.166 3.344
80 H ASN 9 HN ASN 9 17.825 1.754 0.197
81 HA ASN 9 HA ASN 9 15.315 1.888 -1.204
82 HB2 ASN 9 HB2 ASN 9 17.346 4.048 -0.596
83 HB3 ASN 9 HB3 ASN 9 15.733 4.324 -1.245
84 HD21 ASN 9 HD21 ASN 9 16.930 5.289 1.219
85 HD22 ASN 9 HD22 ASN 9 15.914 4.735 2.502
86 H LEU 10 HN LEU 10 18.725 2.296 -1.984
87 HA LEU 10 HA LEU 10 19.858 2.350 -3.956
88 HB2 LEU 10 HB2 LEU 10 18.545 0.231 -4.274
89 HB3 LEU 10 HB3 LEU 10 17.348 1.166 -5.148
90 HG LEU 10 HG LEU 10 19.067 1.742 -6.837
91 HD11 LEU 10 HD11 LEU 10 20.794 -0.167 -5.269
92 HD12 LEU 10 HD12 LEU 10 21.181 0.505 -6.852
93 HD13 LEU 10 HD13 LEU 10 21.052 1.568 -5.452
94 HD21 LEU 10 HD21 LEU 10 19.151 -0.448 -7.889
95 HD22 LEU 10 HD22 LEU 10 18.730 -1.214 -6.358
96 HD23 LEU 10 HD23 LEU 10 17.567 -0.163 -7.166
97 H ARG 11 HN ARG 11 17.745 4.467 -3.169
98 HA ARG 11 HA ARG 11 17.284 5.677 -5.790
99 HB2 ARG 11 HB2 ARG 11 16.307 6.648 -3.105
100 HB3 ARG 11 HB3 ARG 11 15.755 7.170 -4.690
101 HG2 ARG 11 HG2 ARG 11 14.848 4.949 -5.110
102 HG3 ARG 11 HG3 ARG 11 15.390 4.427 -3.515
103 HD2 ARG 11 HD2 ARG 11 13.949 6.114 -2.478
104 HD3 ARG 11 HD3 ARG 11 13.409 6.631 -4.074
105 HE ARG 11 HE ARG 11 12.984 3.836 -3.541
106 HH11 ARG 11 HH12 ARG 11 11.665 7.047 -3.248
107 HH12 ARG 11 HH11 ARG 11 10.024 6.504 -3.153
108 HH21 ARG 11 HH22 ARG 11 10.828 3.111 -3.415
109 HH22 ARG 11 HH21 ARG 11 9.547 4.266 -3.249
110 H THR 12 HN THR 12 17.612 7.641 -2.950
111 HA THR 12 HA THR 12 20.310 8.475 -3.591
112 HB THR 12 HB THR 12 18.032 10.454 -3.794
113 HG1 THR 12 HG1 THR 12 18.184 9.204 -5.676
114 HG21 THR 12 HG21 THR 12 20.024 11.462 -2.831
115 HG22 THR 12 HG22 THR 12 19.794 12.038 -4.483
116 HG23 THR 12 HG23 THR 12 21.011 10.809 -4.138
117 H ASP 13 HN ASP 13 17.746 10.329 -2.011
118 HA ASP 13 HA ASP 13 18.386 9.531 0.633
119 HB2 ASP 13 HB2 ASP 13 20.437 10.816 0.162
120 HB3 ASP 13 HB3 ASP 13 19.458 12.226 -0.237
121 H ILE 14 HN ILE 14 16.099 9.393 0.615
122 HA ILE 14 HA ILE 14 14.804 11.710 1.621
123 HB ILE 14 HB ILE 14 14.715 12.349 -0.726
124 HG12 ILE 14 HG12 ILE 14 12.240 12.574 -0.957
125 HG13 ILE 14 HG13 ILE 14 12.047 11.454 0.387
126 HG21 ILE 14 HG21 ILE 14 14.875 10.146 -1.737
127 HG22 ILE 14 HG22 ILE 14 13.257 9.747 -1.159
128 HG23 ILE 14 HG23 ILE 14 13.475 11.017 -2.363
129 HD11 ILE 14 HD11 ILE 14 13.234 13.025 1.845
130 HD12 ILE 14 HD12 ILE 14 13.381 14.148 0.494
131 HD13 ILE 14 HD13 ILE 14 11.787 13.739 1.132
132 H SER 15 HN SER 15 14.366 8.529 0.115
133 HA SER 15 HA SER 15 13.024 6.762 0.618
134 HB2 SER 15 HB2 SER 15 13.117 7.967 3.394
135 HB3 SER 15 HB3 SER 15 12.615 6.322 3.007
136 HG SER 15 HG SER 15 15.009 6.815 1.908
137 H THR 16 HN THR 16 11.208 7.202 -0.568
138 HA THR 16 HA THR 16 8.998 8.498 0.892
139 HB THR 16 HB THR 16 9.495 8.591 -2.091
140 HG1 THR 16 HG1 THR 16 10.105 10.677 -1.747
141 HG21 THR 16 HG21 THR 16 7.328 9.859 -0.410
142 HG22 THR 16 HG22 THR 16 7.113 8.548 -1.570
143 HG23 THR 16 HG23 THR 16 7.594 10.151 -2.129
144 H SER 17 HN SER 17 7.500 7.066 1.417
145 HA SER 17 HA SER 17 7.155 4.659 -0.218
146 HB2 SER 17 HB2 SER 17 6.114 5.335 2.545
147 HB3 SER 17 HB3 SER 17 5.861 3.800 1.715
148 HG SER 17 HG SER 17 7.792 4.257 3.278
149 H SEP 18 HN SER 18 6.116 7.490 -0.720
150 HA SEP 18 HA SER 18 4.287 8.466 -1.644
151 HB2 SEP 18 HB2 SER 18 4.255 6.496 -3.100
152 HB3 SEP 18 HB3 SER 18 3.318 5.607 -1.900
153 H SER 19 HN SER 19 1.803 8.643 -1.411
154 HA SER 19 HA SER 19 1.241 9.047 1.333
155 HB2 SER 19 HB2 SER 19 0.246 10.481 -0.348
156 HB3 SER 19 HB3 SER 19 -0.587 9.107 -1.076
157 HG SER 19 HG SER 19 -2.106 9.354 0.341
158 H SER 20 HN SER 20 -0.159 6.781 -1.038
159 HA SER 20 HA SER 20 -0.628 4.881 1.132
160 HB2 SER 20 HB2 SER 20 -2.795 5.779 -0.783
161 HB3 SER 20 HB3 SER 20 -2.943 4.456 0.375
162 HG SER 20 HG SER 20 -2.700 5.947 2.044
163 H ILE 21 HN ILE 21 0.029 2.920 0.563
164 HA ILE 21 HA ILE 21 -0.010 2.178 -2.285
165 HB ILE 21 HB ILE 21 2.304 2.782 -1.432
166 HG12 ILE 21 HG12 ILE 21 3.376 0.758 -2.454
167 HG13 ILE 21 HG13 ILE 21 1.792 -0.008 -2.486
168 HG21 ILE 21 HG21 ILE 21 1.973 0.211 0.106
169 HG22 ILE 21 HG22 ILE 21 3.466 1.134 -0.060
170 HG23 ILE 21 HG23 ILE 21 2.092 1.828 0.800
171 HD11 ILE 21 HD11 ILE 21 2.339 0.903 -4.651
172 HD12 ILE 21 HD12 ILE 21 0.977 1.778 -3.951
173 HD13 ILE 21 HD13 ILE 21 2.585 2.499 -3.942
174 H SER 22 HN SER 22 -1.498 1.616 0.412
175 HA SER 22 HA SER 22 -1.231 -1.262 0.621
176 HB2 SER 22 HB2 SER 22 -3.122 0.653 2.011
177 HB3 SER 22 HB3 SER 22 -2.940 -1.059 2.395
178 HG SER 22 HG SER 22 -1.017 1.000 2.679
179 H SER 23 HN SER 23 -2.997 -2.731 0.342
180 HA SER 23 HA SER 23 -4.995 -1.803 -1.617
181 HB2 SER 23 HB2 SER 23 -3.343 -3.286 -2.659
182 HB3 SER 23 HB3 SER 23 -3.672 -4.521 -1.445
183 HG SER 23 HG SER 23 -5.909 -3.612 -2.745
184 H SER 24 HN SER 24 -6.983 -3.181 -1.676
185 HA SER 24 HA SER 24 -7.659 -4.789 0.576
186 HB2 SER 24 HB2 SER 24 -7.744 -2.597 1.681
187 HB3 SER 24 HB3 SER 24 -8.864 -2.011 0.452
188 HG SER 24 HG SER 24 -9.412 -4.270 2.066
189 H GLU 25 HN GLU 25 -8.030 -3.844 -2.517
190 HA GLU 25 HA GLU 25 -10.856 -4.405 -2.815
191 HB2 GLU 25 HB2 GLU 25 -9.759 -2.710 -4.229
192 HB3 GLU 25 HB3 GLU 25 -8.722 -3.954 -4.910
193 HG2 GLU 25 HG2 GLU 25 -10.551 -3.385 -6.411
194 HG3 GLU 25 HG3 GLU 25 -10.645 -5.065 -5.881
195 H GLU 26 HN GLU 26 -8.091 -5.755 -4.602
196 HA GLU 26 HA GLU 26 -9.475 -8.248 -4.967
197 HB2 GLU 26 HB2 GLU 26 -7.873 -7.102 -6.619
198 HB3 GLU 26 HB3 GLU 26 -6.579 -7.735 -5.615
199 HG2 GLU 26 HG2 GLU 26 -8.694 -9.416 -6.940
200 HG3 GLU 26 HG3 GLU 26 -7.083 -9.128 -7.590
201 H ASN 27 HN ASN 27 -9.674 -9.514 -3.219
202 HA ASN 27 HA ASN 27 -7.235 -10.110 -1.677
203 HB2 ASN 27 HB2 ASN 27 -10.093 -9.971 -0.695
204 HB3 ASN 27 HB3 ASN 27 -8.744 -10.577 0.260
205 HD21 ASN 27 HD21 ASN 27 -8.987 -9.002 1.822
206 HD22 ASN 27 HD22 ASN 27 -8.561 -7.351 1.552
207 H ASP 28 HN ASP 28 -6.894 -12.250 -1.044
208 HA ASP 28 HA ASP 28 -8.758 -14.277 -2.013
209 HB2 ASP 28 HB2 ASP 28 -6.924 -15.531 -3.117
210 HB3 ASP 28 HB3 ASP 28 -7.239 -13.978 -3.885
211 H PHE 29 HN PHE 29 -9.108 -15.640 -0.406
212 HA PHE 29 HA PHE 29 -7.083 -16.996 0.997
213 HB2 PHE 29 HB2 PHE 29 -6.789 -14.829 2.125
214 HB3 PHE 29 HB3 PHE 29 -8.489 -14.839 2.587
215 HD1 PHE 29 HD1 PHE 29 -5.260 -16.579 3.063
216 HD2 PHE 29 HD2 PHE 29 -9.218 -15.974 4.509
217 HE1 PHE 29 HE1 PHE 29 -4.686 -17.787 5.127
218 HE2 PHE 29 HE2 PHE 29 -8.648 -17.179 6.577
219 HZ PHE 29 HZ PHE 29 -6.380 -18.080 6.892
220 H TRP 30 HN TRP 30 -10.401 -15.973 0.765
221 HA TRP 30 HA TRP 30 -11.258 -18.408 2.165
222 HB2 TRP 30 HB2 TRP 30 -12.633 -15.779 1.668
223 HB3 TRP 30 HB3 TRP 30 -13.538 -17.218 2.134
224 HD1 TRP 30 HD1 TRP 30 -11.527 -14.418 3.571
225 HE1 TRP 30 HE1 TRP 30 -11.271 -14.743 6.113
226 HE3 TRP 30 HE3 TRP 30 -13.225 -19.221 3.940
227 HZ2 TRP 30 HZ2 TRP 30 -11.734 -16.772 8.023
228 HZ3 TRP 30 HZ3 TRP 30 -13.290 -20.285 6.162
229 HH2 TRP 30 HH2 TRP 30 -12.558 -19.083 8.159
230 H GLN 31 HN GLN 31 -13.391 -16.695 0.014
231 HA GLN 31 HA GLN 31 -13.035 -18.685 -2.085
232 HB2 GLN 31 HB2 GLN 31 -15.649 -18.197 -0.648
233 HB3 GLN 31 HB3 GLN 31 -15.506 -19.084 -2.161
234 HG2 GLN 31 HG2 GLN 31 -14.102 -20.744 -1.073
235 HG3 GLN 31 HG3 GLN 31 -14.202 -19.847 0.441
236 HE21 GLN 31 HE21 GLN 31 -16.105 -19.874 1.618
237 HE22 GLN 31 HE22 GLN 31 -17.364 -21.021 1.319
238 HA PRO 32 HA PRO 32 -13.864 -14.341 -3.586
239 HB2 PRO 32 HB2 PRO 32 -11.528 -14.771 -5.283
240 HB3 PRO 32 HB3 PRO 32 -11.829 -13.491 -4.107
241 HG2 PRO 32 HG2 PRO 32 -9.985 -15.436 -3.719
242 HG3 PRO 32 HG3 PRO 32 -10.860 -14.655 -2.389
243 HD2 PRO 32 HD2 PRO 32 -11.325 -17.325 -3.659
244 HD3 PRO 32 HD3 PRO 32 -11.414 -16.859 -1.947
245 H LYS 33 HN LYS 33 -15.010 -13.893 -5.385
246 HA LYS 33 HA LYS 33 -14.827 -15.672 -7.696
247 HB2 LYS 33 HB2 LYS 33 -17.277 -15.898 -7.813
248 HB3 LYS 33 HB3 LYS 33 -16.623 -16.623 -6.352
249 HG2 LYS 33 HG2 LYS 33 -17.654 -13.822 -6.294
250 HG3 LYS 33 HG3 LYS 33 -18.773 -15.185 -6.226
251 HD2 LYS 33 HD2 LYS 33 -17.546 -16.059 -4.272
252 HD3 LYS 33 HD3 LYS 33 -16.486 -14.650 -4.329
253 HE2 LYS 33 HE2 LYS 33 -18.258 -14.391 -2.656
254 HE3 LYS 33 HE3 LYS 33 -18.379 -13.181 -3.932
255 HZ1 LYS 33 HZ1 LYS 33 -20.540 -14.113 -3.374
256 HZ2 LYS 33 HZ2 LYS 33 -19.995 -15.668 -3.759
257 HZ3 LYS 33 HZ3 LYS 33 -20.118 -14.493 -4.968
258 HA PRO 34 HA PRO 34 -15.207 -12.030 -10.138
259 HB2 PRO 34 HB2 PRO 34 -17.119 -12.750 -11.999
260 HB3 PRO 34 HB3 PRO 34 -15.406 -13.167 -12.100
261 HG2 PRO 34 HG2 PRO 34 -17.705 -14.806 -11.112
262 HG3 PRO 34 HG3 PRO 34 -16.317 -15.301 -12.101
263 HD2 PRO 34 HD2 PRO 34 -16.425 -15.858 -9.484
264 HD3 PRO 34 HD3 PRO 34 -14.893 -15.410 -10.268
265 H THR 35 HN THR 35 -17.850 -13.262 -8.428
266 HA THR 35 HA THR 35 -19.096 -10.630 -8.379
267 HB THR 35 HB THR 35 -21.382 -11.628 -8.627
268 HG1 THR 35 HG1 THR 35 -20.528 -13.790 -10.057
269 HG21 THR 35 HG21 THR 35 -20.306 -10.430 -10.482
270 HG22 THR 35 HG22 THR 35 -21.319 -11.750 -11.068
271 HG23 THR 35 HG23 THR 35 -19.565 -11.937 -11.021
Start of MODEL 9
1 H1 GLU 1 H1 GLU 1 15.312 10.649 3.820
2 H2 GLU 1 H2 GLU 1 15.017 12.301 4.026
3 H3 GLU 1 H3 GLU 1 13.925 11.350 3.149
4 HA GLU 1 HA GLU 1 14.499 11.173 6.048
5 HB2 GLU 1 HB2 GLU 1 12.073 12.070 4.486
6 HB3 GLU 1 HB3 GLU 1 12.048 11.739 6.212
7 HG2 GLU 1 HG2 GLU 1 12.257 14.077 5.954
8 HG3 GLU 1 HG3 GLU 1 13.828 13.477 6.480
9 H LYS 2 HN LYS 2 13.139 9.654 7.194
10 HA LYS 2 HA LYS 2 12.349 7.558 7.572
11 HB2 LYS 2 HB2 LYS 2 10.399 8.334 6.355
12 HB3 LYS 2 HB3 LYS 2 11.172 7.969 4.818
13 HG2 LYS 2 HG2 LYS 2 11.177 5.581 5.417
14 HG3 LYS 2 HG3 LYS 2 10.331 5.977 6.915
15 HD2 LYS 2 HD2 LYS 2 8.446 6.840 5.662
16 HD3 LYS 2 HD3 LYS 2 9.300 6.569 4.142
17 HE2 LYS 2 HE2 LYS 2 7.672 4.800 4.571
18 HE3 LYS 2 HE3 LYS 2 9.318 4.171 4.565
19 HZ1 LYS 2 HZ1 LYS 2 8.047 3.254 6.393
20 HZ2 LYS 2 HZ2 LYS 2 7.711 4.801 6.984
21 HZ3 LYS 2 HZ3 LYS 2 9.300 4.222 6.988
22 H LEU 3 HN LEU 3 14.163 6.347 7.722
23 HA LEU 3 HA LEU 3 15.664 4.722 7.223
24 HB2 LEU 3 HB2 LEU 3 13.683 3.607 6.234
25 HB3 LEU 3 HB3 LEU 3 14.055 4.358 4.695
26 HG LEU 3 HG LEU 3 16.210 3.130 4.650
27 HD11 LEU 3 HD11 LEU 3 15.120 1.812 7.131
28 HD12 LEU 3 HD12 LEU 3 16.529 1.264 6.222
29 HD13 LEU 3 HD13 LEU 3 16.555 2.833 7.027
30 HD21 LEU 3 HD21 LEU 3 15.240 0.927 4.180
31 HD22 LEU 3 HD22 LEU 3 13.743 1.426 4.969
32 HD23 LEU 3 HD23 LEU 3 14.275 2.232 3.492
33 H LYS 4 HN LYS 4 17.667 4.619 6.314
34 HA LYS 4 HA LYS 4 18.270 6.679 4.307
35 HB2 LYS 4 HB2 LYS 4 20.181 5.329 6.220
36 HB3 LYS 4 HB3 LYS 4 20.529 6.702 5.177
37 HG2 LYS 4 HG2 LYS 4 18.606 6.678 7.496
38 HG3 LYS 4 HG3 LYS 4 20.213 7.412 7.476
39 HD2 LYS 4 HD2 LYS 4 19.463 8.911 5.659
40 HD3 LYS 4 HD3 LYS 4 17.849 8.207 5.773
41 HE2 LYS 4 HE2 LYS 4 17.929 10.297 6.991
42 HE3 LYS 4 HE3 LYS 4 17.712 8.954 8.113
43 HZ1 LYS 4 HZ1 LYS 4 20.275 10.345 7.546
44 HZ2 LYS 4 HZ2 LYS 4 20.081 9.041 8.607
45 HZ3 LYS 4 HZ3 LYS 4 19.337 10.521 8.944
46 H GLN 5 HN GLN 5 20.110 6.179 2.838
47 HA GLN 5 HA GLN 5 19.617 3.685 1.517
48 HB2 GLN 5 HB2 GLN 5 21.290 4.482 -0.113
49 HB3 GLN 5 HB3 GLN 5 20.046 5.681 0.207
50 HG2 GLN 5 HG2 GLN 5 21.549 6.898 1.659
51 HG3 GLN 5 HG3 GLN 5 22.791 5.667 1.437
52 HE21 GLN 5 HE21 GLN 5 21.066 8.302 -0.035
53 HE22 GLN 5 HE22 GLN 5 22.137 8.524 -1.371
54 H ASP 6 HN ASP 6 21.444 2.274 0.805
55 HA ASP 6 HA ASP 6 23.740 2.155 2.563
56 HB2 ASP 6 HB2 ASP 6 23.295 -0.015 3.475
57 HB3 ASP 6 HB3 ASP 6 21.866 0.969 3.769
58 H ILE 7 HN ILE 7 24.405 -0.557 1.955
59 HA ILE 7 HA ILE 7 25.444 -0.182 -0.707
60 HB ILE 7 HB ILE 7 25.715 -2.699 0.911
61 HG12 ILE 7 HG12 ILE 7 27.453 -0.234 1.175
62 HG13 ILE 7 HG13 ILE 7 26.238 -0.718 2.351
63 HG21 ILE 7 HG21 ILE 7 27.504 -1.321 -1.089
64 HG22 ILE 7 HG22 ILE 7 27.904 -2.806 -0.225
65 HG23 ILE 7 HG23 ILE 7 26.555 -2.782 -1.361
66 HD11 ILE 7 HD11 ILE 7 28.461 -1.369 3.066
67 HD12 ILE 7 HD12 ILE 7 27.462 -2.790 2.760
68 HD13 ILE 7 HD13 ILE 7 28.681 -2.299 1.584
69 H LEU 8 HN LEU 8 22.537 -0.528 -0.395
70 HA LEU 8 HA LEU 8 22.217 -2.770 -2.259
71 HB2 LEU 8 HB2 LEU 8 20.517 -2.249 0.177
72 HB3 LEU 8 HB3 LEU 8 20.051 -3.331 -1.121
73 HG LEU 8 HG LEU 8 22.578 -3.706 0.476
74 HD11 LEU 8 HD11 LEU 8 19.859 -4.918 0.942
75 HD12 LEU 8 HD12 LEU 8 21.351 -5.400 1.751
76 HD13 LEU 8 HD13 LEU 8 20.693 -3.784 2.004
77 HD21 LEU 8 HD21 LEU 8 22.527 -4.825 -1.684
78 HD22 LEU 8 HD22 LEU 8 22.413 -5.999 -0.375
79 HD23 LEU 8 HD23 LEU 8 20.970 -5.552 -1.286
80 H ASN 9 HN ASN 9 21.750 0.436 -1.564
81 HA ASN 9 HA ASN 9 20.203 0.878 -3.912
82 HB2 ASN 9 HB2 ASN 9 18.215 1.834 -2.926
83 HB3 ASN 9 HB3 ASN 9 18.407 0.189 -2.333
84 HD21 ASN 9 HD21 ASN 9 20.509 0.864 -0.453
85 HD22 ASN 9 HD22 ASN 9 19.748 1.715 0.842
86 H LEU 10 HN LEU 10 22.716 1.732 -2.832
87 HA LEU 10 HA LEU 10 22.529 4.387 -1.840
88 HB2 LEU 10 HB2 LEU 10 24.846 4.460 -1.927
89 HB3 LEU 10 HB3 LEU 10 24.513 2.754 -1.705
90 HG LEU 10 HG LEU 10 25.162 4.037 -4.362
91 HD11 LEU 10 HD11 LEU 10 27.340 2.964 -4.133
92 HD12 LEU 10 HD12 LEU 10 27.063 4.137 -2.846
93 HD13 LEU 10 HD13 LEU 10 26.905 2.410 -2.517
94 HD21 LEU 10 HD21 LEU 10 23.832 2.046 -4.640
95 HD22 LEU 10 HD22 LEU 10 25.503 1.694 -5.080
96 HD23 LEU 10 HD23 LEU 10 24.868 1.154 -3.525
97 H ARG 11 HN ARG 11 21.449 3.369 -4.646
98 HA ARG 11 HA ARG 11 22.612 5.048 -6.582
99 HB2 ARG 11 HB2 ARG 11 19.842 3.855 -6.471
100 HB3 ARG 11 HB3 ARG 11 20.552 4.612 -7.890
101 HG2 ARG 11 HG2 ARG 11 22.268 2.915 -7.983
102 HG3 ARG 11 HG3 ARG 11 21.653 2.179 -6.502
103 HD2 ARG 11 HD2 ARG 11 19.556 1.652 -7.606
104 HD3 ARG 11 HD3 ARG 11 20.100 2.462 -9.072
105 HE ARG 11 HE ARG 11 22.001 0.566 -8.619
106 HH11 ARG 11 HH12 ARG 11 18.532 0.514 -8.948
107 HH12 ARG 11 HH11 ARG 11 18.491 -1.078 -9.629
108 HH21 ARG 11 HH22 ARG 11 21.957 -1.529 -9.516
109 HH22 ARG 11 HH21 ARG 11 20.439 -2.240 -9.952
110 H THR 12 HN THR 12 19.251 5.402 -5.625
111 HA THR 12 HA THR 12 19.699 8.285 -5.226
112 HB THR 12 HB THR 12 17.468 8.700 -6.263
113 HG1 THR 12 HG1 THR 12 17.675 5.919 -6.716
114 HG21 THR 12 HG21 THR 12 18.220 8.423 -8.596
115 HG22 THR 12 HG22 THR 12 19.521 7.371 -8.038
116 HG23 THR 12 HG23 THR 12 19.493 9.070 -7.562
117 H ASP 13 HN ASP 13 18.980 5.590 -3.685
118 HA ASP 13 HA ASP 13 17.843 5.004 -1.807
119 HB2 ASP 13 HB2 ASP 13 19.055 6.926 -0.886
120 HB3 ASP 13 HB3 ASP 13 17.763 8.004 -1.404
121 H ILE 14 HN ILE 14 16.054 4.139 -2.919
122 HA ILE 14 HA ILE 14 13.777 5.764 -3.571
123 HB ILE 14 HB ILE 14 13.907 2.753 -3.353
124 HG12 ILE 14 HG12 ILE 14 14.331 4.494 -5.794
125 HG13 ILE 14 HG13 ILE 14 15.617 3.680 -4.910
126 HG21 ILE 14 HG21 ILE 14 11.990 2.798 -4.863
127 HG22 ILE 14 HG22 ILE 14 11.645 3.679 -3.375
128 HG23 ILE 14 HG23 ILE 14 12.017 4.561 -4.856
129 HD11 ILE 14 HD11 ILE 14 13.352 2.361 -6.387
130 HD12 ILE 14 HD12 ILE 14 15.040 2.438 -6.892
131 HD13 ILE 14 HD13 ILE 14 14.592 1.517 -5.458
132 H SER 15 HN SER 15 14.231 3.077 -1.273
133 HA SER 15 HA SER 15 13.260 2.574 0.715
134 HB2 SER 15 HB2 SER 15 12.923 5.578 0.878
135 HB3 SER 15 HB3 SER 15 12.729 4.459 2.227
136 HG SER 15 HG SER 15 14.826 5.414 2.137
137 H THR 16 HN THR 16 11.485 1.414 0.211
138 HA THR 16 HA THR 16 8.943 2.891 0.057
139 HB THR 16 HB THR 16 8.069 1.122 -1.454
140 HG1 THR 16 HG1 THR 16 10.077 -0.256 -0.766
141 HG21 THR 16 HG21 THR 16 9.207 1.902 -3.479
142 HG22 THR 16 HG22 THR 16 10.505 2.576 -2.493
143 HG23 THR 16 HG23 THR 16 8.875 3.240 -2.378
144 H SER 17 HN SER 17 7.840 2.478 1.843
145 HA SER 17 HA SER 17 7.967 -0.235 2.987
146 HB2 SER 17 HB2 SER 17 7.388 2.395 4.373
147 HB3 SER 17 HB3 SER 17 7.371 0.812 5.150
148 HG SER 17 HG SER 17 9.676 1.314 3.763
149 H SEP 18 HN SER 18 5.830 2.531 2.394
150 HA SEP 18 HA SER 18 3.599 0.661 2.077
151 HB2 SEP 18 HB2 SER 18 3.496 1.560 4.394
152 HB3 SEP 18 HB3 SER 18 3.412 3.191 3.732
153 H SER 19 HN SER 19 2.036 1.313 0.609
154 HA SER 19 HA SER 19 2.896 3.234 -1.334
155 HB2 SER 19 HB2 SER 19 0.835 2.597 -2.542
156 HB3 SER 19 HB3 SER 19 1.764 1.184 -2.040
157 HG SER 19 HG SER 19 -0.014 1.932 -0.137
158 H SER 20 HN SER 20 2.068 5.226 -1.794
159 HA SER 20 HA SER 20 0.753 6.613 0.334
160 HB2 SER 20 HB2 SER 20 0.907 8.577 -1.159
161 HB3 SER 20 HB3 SER 20 2.449 7.733 -1.025
162 HG SER 20 HG SER 20 2.206 6.941 -3.046
163 H ILE 21 HN ILE 21 -0.453 4.578 -1.923
164 HA ILE 21 HA ILE 21 -2.718 5.964 -2.905
165 HB ILE 21 HB ILE 21 -2.402 2.989 -2.492
166 HG12 ILE 21 HG12 ILE 21 -1.842 4.642 -4.963
167 HG13 ILE 21 HG13 ILE 21 -0.601 4.031 -3.874
168 HG21 ILE 21 HG21 ILE 21 -4.251 4.553 -4.290
169 HG22 ILE 21 HG22 ILE 21 -4.100 2.796 -4.246
170 HG23 ILE 21 HG23 ILE 21 -4.716 3.664 -2.839
171 HD11 ILE 21 HD11 ILE 21 -1.313 1.738 -4.391
172 HD12 ILE 21 HD12 ILE 21 -2.498 2.381 -5.528
173 HD13 ILE 21 HD13 ILE 21 -0.776 2.621 -5.820
174 H SER 22 HN SER 22 -4.636 6.398 -2.004
175 HA SER 22 HA SER 22 -5.050 5.842 0.779
176 HB2 SER 22 HB2 SER 22 -6.866 7.150 -1.262
177 HB3 SER 22 HB3 SER 22 -7.158 7.107 0.477
178 HG SER 22 HG SER 22 -4.719 8.022 0.158
179 H SER 23 HN SER 23 -6.963 5.093 -2.141
180 HA SER 23 HA SER 23 -8.271 2.928 -0.668
181 HB2 SER 23 HB2 SER 23 -8.911 4.122 -3.378
182 HB3 SER 23 HB3 SER 23 -9.853 2.872 -2.563
183 HG SER 23 HG SER 23 -10.171 5.430 -2.325
184 H SER 24 HN SER 24 -7.315 1.015 -0.763
185 HA SER 24 HA SER 24 -6.414 0.012 -3.360
186 HB2 SER 24 HB2 SER 24 -4.352 -0.904 -2.354
187 HB3 SER 24 HB3 SER 24 -4.391 0.858 -2.272
188 HG SER 24 HG SER 24 -5.292 0.487 -0.079
189 H GLU 25 HN GLU 25 -7.492 -1.794 -3.724
190 HA GLU 25 HA GLU 25 -8.568 -3.773 -3.441
191 HB2 GLU 25 HB2 GLU 25 -6.627 -3.984 -1.136
192 HB3 GLU 25 HB3 GLU 25 -7.654 -5.304 -1.677
193 HG2 GLU 25 HG2 GLU 25 -5.482 -5.615 -2.598
194 HG3 GLU 25 HG3 GLU 25 -6.574 -5.161 -3.905
195 H GLU 26 HN GLU 26 -10.614 -3.003 -2.984
196 HA GLU 26 HA GLU 26 -11.336 -2.427 -0.228
197 HB2 GLU 26 HB2 GLU 26 -12.196 -1.017 -2.077
198 HB3 GLU 26 HB3 GLU 26 -13.044 -2.413 -2.724
199 HG2 GLU 26 HG2 GLU 26 -14.415 -2.534 -0.728
200 HG3 GLU 26 HG3 GLU 26 -13.536 -1.179 -0.023
201 H ASN 27 HN ASN 27 -11.132 -5.097 -2.210
202 HA ASN 27 HA ASN 27 -13.233 -6.537 -0.734
203 HB2 ASN 27 HB2 ASN 27 -11.903 -7.221 -3.365
204 HB3 ASN 27 HB3 ASN 27 -13.109 -8.216 -2.556
205 HD21 ASN 27 HD21 ASN 27 -14.639 -5.908 -1.636
206 HD22 ASN 27 HD22 ASN 27 -15.470 -5.304 -3.024
207 H ASP 28 HN ASP 28 -12.741 -8.295 0.476
208 HA ASP 28 HA ASP 28 -9.951 -9.226 0.484
209 HB2 ASP 28 HB2 ASP 28 -11.657 -8.535 2.881
210 HB3 ASP 28 HB3 ASP 28 -10.163 -9.463 2.986
211 H PHE 29 HN PHE 29 -12.667 -10.194 -0.534
212 HA PHE 29 HA PHE 29 -12.535 -12.860 0.712
213 HB2 PHE 29 HB2 PHE 29 -14.591 -11.684 1.388
214 HB3 PHE 29 HB3 PHE 29 -15.013 -11.452 -0.303
215 HD1 PHE 29 HD2 PHE 29 -14.419 -14.053 2.268
216 HD2 PHE 29 HD1 PHE 29 -16.204 -13.085 -1.472
217 HE1 PHE 29 HE2 PHE 29 -15.594 -16.215 2.274
218 HE2 PHE 29 HE1 PHE 29 -17.383 -15.242 -1.473
219 HZ PHE 29 HZ PHE 29 -17.081 -16.811 0.399
220 H TRP 30 HN TRP 30 -12.434 -10.989 -2.130
221 HA TRP 30 HA TRP 30 -13.117 -13.170 -3.907
222 HB2 TRP 30 HB2 TRP 30 -12.269 -10.316 -4.333
223 HB3 TRP 30 HB3 TRP 30 -12.330 -11.457 -5.673
224 HD1 TRP 30 HD1 TRP 30 -14.493 -9.193 -3.640
225 HE1 TRP 30 HE1 TRP 30 -16.952 -9.448 -4.364
226 HE3 TRP 30 HE3 TRP 30 -14.054 -13.384 -6.531
227 HZ2 TRP 30 HZ2 TRP 30 -18.500 -11.199 -5.953
228 HZ3 TRP 30 HZ3 TRP 30 -16.070 -14.287 -7.618
229 HH2 TRP 30 HH2 TRP 30 -18.246 -13.215 -7.333
230 H GLN 31 HN GLN 31 -10.412 -11.134 -4.713
231 HA GLN 31 HA GLN 31 -8.506 -13.265 -4.145
232 HB2 GLN 31 HB2 GLN 31 -8.984 -12.148 -6.910
233 HB3 GLN 31 HB3 GLN 31 -7.601 -13.142 -6.469
234 HG2 GLN 31 HG2 GLN 31 -9.244 -14.919 -5.776
235 HG3 GLN 31 HG3 GLN 31 -10.500 -13.935 -6.524
236 HE21 GLN 31 HE21 GLN 31 -8.784 -13.022 -8.696
237 HE22 GLN 31 HE22 GLN 31 -8.595 -14.369 -9.759
238 HA PRO 32 HA PRO 32 -6.963 -8.882 -3.437
239 HB2 PRO 32 HB2 PRO 32 -6.069 -10.038 -0.882
240 HB3 PRO 32 HB3 PRO 32 -7.000 -8.569 -1.183
241 HG2 PRO 32 HG2 PRO 32 -8.120 -10.754 -0.099
242 HG3 PRO 32 HG3 PRO 32 -9.014 -9.684 -1.195
243 HD2 PRO 32 HD2 PRO 32 -7.745 -12.338 -1.750
244 HD3 PRO 32 HD3 PRO 32 -9.302 -11.693 -2.314
245 H LYS 33 HN LYS 33 -5.576 -12.056 -2.770
246 HA LYS 33 HA LYS 33 -3.109 -11.245 -4.072
247 HB2 LYS 33 HB2 LYS 33 -1.660 -11.961 -2.277
248 HB3 LYS 33 HB3 LYS 33 -2.763 -10.736 -1.666
249 HG2 LYS 33 HG2 LYS 33 -3.229 -13.685 -1.314
250 HG3 LYS 33 HG3 LYS 33 -2.340 -12.696 -0.154
251 HD2 LYS 33 HD2 LYS 33 -4.325 -11.253 0.097
252 HD3 LYS 33 HD3 LYS 33 -5.207 -12.300 -1.017
253 HE2 LYS 33 HE2 LYS 33 -5.743 -12.840 1.298
254 HE3 LYS 33 HE3 LYS 33 -4.914 -14.181 0.511
255 HZ1 LYS 33 HZ1 LYS 33 -2.848 -13.447 1.568
256 HZ2 LYS 33 HZ2 LYS 33 -4.034 -13.832 2.711
257 HZ3 LYS 33 HZ3 LYS 33 -3.688 -12.212 2.366
258 HA PRO 34 HA PRO 34 -3.326 -15.356 -5.681
259 HB2 PRO 34 HB2 PRO 34 -0.391 -15.464 -5.731
260 HB3 PRO 34 HB3 PRO 34 -1.535 -15.476 -7.075
261 HG2 PRO 34 HG2 PRO 34 0.026 -13.348 -6.560
262 HG3 PRO 34 HG3 PRO 34 -1.620 -13.173 -7.197
263 HD2 PRO 34 HD2 PRO 34 -0.623 -12.830 -4.392
264 HD3 PRO 34 HD3 PRO 34 -1.791 -11.847 -5.300
265 H THR 35 HN THR 35 -2.122 -14.675 -2.676
266 HA THR 35 HA THR 35 -1.462 -15.878 -0.860
267 HB THR 35 HB THR 35 -2.682 -17.980 -0.464
268 HG1 THR 35 HG1 THR 35 -4.308 -18.112 -2.516
269 HG21 THR 35 HG21 THR 35 -4.950 -17.064 -0.598
270 HG22 THR 35 HG22 THR 35 -4.384 -15.818 -1.711
271 HG23 THR 35 HG23 THR 35 -3.801 -15.844 -0.048
Start of MODEL 10
1 H1 GLU 1 H1 GLU 1 32.113 1.502 0.879
2 H2 GLU 1 H2 GLU 1 31.402 3.005 1.180
3 H3 GLU 1 H3 GLU 1 33.076 2.819 1.324
4 HA GLU 1 HA GLU 1 32.561 3.959 -0.711
5 HB2 GLU 1 HB2 GLU 1 33.527 1.116 -1.022
6 HB3 GLU 1 HB3 GLU 1 33.587 2.295 -2.324
7 HG2 GLU 1 HG2 GLU 1 35.733 2.201 -1.309
8 HG3 GLU 1 HG3 GLU 1 34.991 3.738 -0.867
9 H LYS 2 HN LYS 2 30.677 1.119 -0.122
10 HA LYS 2 HA LYS 2 28.924 1.856 -2.366
11 HB2 LYS 2 HB2 LYS 2 29.656 -0.954 -1.528
12 HB3 LYS 2 HB3 LYS 2 28.455 -0.540 -2.744
13 HG2 LYS 2 HG2 LYS 2 30.215 0.513 -4.096
14 HG3 LYS 2 HG3 LYS 2 31.409 0.032 -2.890
15 HD2 LYS 2 HD2 LYS 2 30.852 -2.319 -3.276
16 HD3 LYS 2 HD3 LYS 2 29.647 -1.840 -4.473
17 HE2 LYS 2 HE2 LYS 2 31.437 -0.799 -5.815
18 HE3 LYS 2 HE3 LYS 2 32.622 -1.359 -4.634
19 HZ1 LYS 2 HZ1 LYS 2 31.977 -3.640 -5.131
20 HZ2 LYS 2 HZ2 LYS 2 32.508 -2.844 -6.526
21 HZ3 LYS 2 HZ3 LYS 2 30.854 -3.095 -6.273
22 H LEU 3 HN LEU 3 29.251 1.510 0.888
23 HA LEU 3 HA LEU 3 26.560 0.557 1.393
24 HB2 LEU 3 HB2 LEU 3 28.892 1.229 3.151
25 HB3 LEU 3 HB3 LEU 3 27.292 1.003 3.823
26 HG LEU 3 HG LEU 3 28.578 -1.030 4.062
27 HD11 LEU 3 HD11 LEU 3 27.074 -2.607 2.963
28 HD12 LEU 3 HD12 LEU 3 26.186 -1.259 3.674
29 HD13 LEU 3 HD13 LEU 3 26.465 -1.312 1.933
30 HD21 LEU 3 HD21 LEU 3 30.142 -0.691 2.218
31 HD22 LEU 3 HD22 LEU 3 29.383 -2.280 2.128
32 HD23 LEU 3 HD23 LEU 3 28.846 -0.985 1.059
33 H LYS 4 HN LYS 4 26.912 3.032 0.004
34 HA LYS 4 HA LYS 4 26.210 5.108 1.914
35 HB2 LYS 4 HB2 LYS 4 26.418 5.266 -1.099
36 HB3 LYS 4 HB3 LYS 4 26.273 6.626 0.007
37 HG2 LYS 4 HG2 LYS 4 28.591 4.710 -0.153
38 HG3 LYS 4 HG3 LYS 4 28.556 6.364 -0.767
39 HD2 LYS 4 HD2 LYS 4 28.172 7.172 1.538
40 HD3 LYS 4 HD3 LYS 4 28.308 5.512 2.119
41 HE2 LYS 4 HE2 LYS 4 30.591 5.416 1.159
42 HE3 LYS 4 HE3 LYS 4 30.443 7.118 0.719
43 HZ1 LYS 4 HZ1 LYS 4 30.133 7.631 3.085
44 HZ2 LYS 4 HZ2 LYS 4 31.629 6.902 2.785
45 HZ3 LYS 4 HZ3 LYS 4 30.373 6.002 3.472
46 H GLN 5 HN GLN 5 24.451 6.659 0.544
47 HA GLN 5 HA GLN 5 22.235 7.002 0.196
48 HB2 GLN 5 HB2 GLN 5 22.360 4.191 -0.907
49 HB3 GLN 5 HB3 GLN 5 21.001 5.287 -1.105
50 HG2 GLN 5 HG2 GLN 5 23.791 5.768 -2.120
51 HG3 GLN 5 HG3 GLN 5 22.427 5.207 -3.086
52 HE21 GLN 5 HE21 GLN 5 24.080 7.628 -3.313
53 HE22 GLN 5 HE22 GLN 5 22.975 8.955 -3.257
54 H ASP 6 HN ASP 6 21.780 3.545 0.735
55 HA ASP 6 HA ASP 6 19.979 4.143 2.924
56 HB2 ASP 6 HB2 ASP 6 20.697 1.574 1.507
57 HB3 ASP 6 HB3 ASP 6 19.601 1.638 2.885
58 H ILE 7 HN ILE 7 21.609 4.943 4.394
59 HA ILE 7 HA ILE 7 22.781 2.788 5.959
60 HB ILE 7 HB ILE 7 24.652 3.402 4.621
61 HG12 ILE 7 HG12 ILE 7 24.904 4.905 7.231
62 HG13 ILE 7 HG13 ILE 7 25.025 3.156 7.078
63 HG21 ILE 7 HG21 ILE 7 23.807 5.509 3.751
64 HG22 ILE 7 HG22 ILE 7 24.047 6.271 5.324
65 HG23 ILE 7 HG23 ILE 7 25.437 5.710 4.391
66 HD11 ILE 7 HD11 ILE 7 27.220 4.180 7.216
67 HD12 ILE 7 HD12 ILE 7 26.983 3.419 5.643
68 HD13 ILE 7 HD13 ILE 7 26.861 5.170 5.802
69 H LEU 8 HN LEU 8 22.084 6.234 5.665
70 HA LEU 8 HA LEU 8 20.840 6.382 8.199
71 HB2 LEU 8 HB2 LEU 8 23.562 6.450 8.426
72 HB3 LEU 8 HB3 LEU 8 23.187 8.156 8.287
73 HG LEU 8 HG LEU 8 23.348 7.469 10.624
74 HD11 LEU 8 HD11 LEU 8 21.228 8.364 11.416
75 HD12 LEU 8 HD12 LEU 8 21.829 9.287 10.039
76 HD13 LEU 8 HD13 LEU 8 20.519 8.127 9.819
77 HD21 LEU 8 HD21 LEU 8 21.706 5.944 11.598
78 HD22 LEU 8 HD22 LEU 8 21.042 5.631 9.994
79 HD23 LEU 8 HD23 LEU 8 22.692 5.138 10.377
80 H ASN 9 HN ASN 9 21.891 7.638 5.262
81 HA ASN 9 HA ASN 9 20.587 10.225 5.713
82 HB2 ASN 9 HB2 ASN 9 21.690 10.942 3.633
83 HB3 ASN 9 HB3 ASN 9 22.857 10.334 4.803
84 HD21 ASN 9 HD21 ASN 9 21.270 9.768 1.774
85 HD22 ASN 9 HD22 ASN 9 22.296 8.485 1.241
86 H LEU 10 HN LEU 10 19.226 7.599 5.274
87 HA LEU 10 HA LEU 10 18.106 7.648 2.655
88 HB2 LEU 10 HB2 LEU 10 18.269 5.632 4.155
89 HB3 LEU 10 HB3 LEU 10 16.968 6.316 5.108
90 HG LEU 10 HG LEU 10 15.484 6.209 3.129
91 HD11 LEU 10 HD11 LEU 10 17.828 4.807 1.849
92 HD12 LEU 10 HD12 LEU 10 16.197 4.899 1.179
93 HD13 LEU 10 HD13 LEU 10 17.153 6.367 1.375
94 HD21 LEU 10 HD21 LEU 10 15.490 4.396 4.754
95 HD22 LEU 10 HD22 LEU 10 15.215 3.775 3.125
96 HD23 LEU 10 HD23 LEU 10 16.800 3.602 3.880
97 H ARG 11 HN ARG 11 17.814 9.852 4.942
98 HA ARG 11 HA ARG 11 14.936 10.300 4.653
99 HB2 ARG 11 HB2 ARG 11 16.942 11.766 6.378
100 HB3 ARG 11 HB3 ARG 11 15.198 11.984 6.405
101 HG2 ARG 11 HG2 ARG 11 14.963 9.623 7.117
102 HG3 ARG 11 HG3 ARG 11 16.721 9.515 7.203
103 HD2 ARG 11 HD2 ARG 11 15.809 9.937 9.406
104 HD3 ARG 11 HD3 ARG 11 16.737 11.331 8.858
105 HE ARG 11 HE ARG 11 14.108 11.803 8.139
106 HH11 ARG 11 HH12 ARG 11 15.914 11.306 11.077
107 HH12 ARG 11 HH11 ARG 11 14.860 12.284 12.042
108 HH21 ARG 11 HH22 ARG 11 12.715 13.093 9.403
109 HH22 ARG 11 HH21 ARG 11 13.043 13.299 11.091
110 H THR 12 HN THR 12 17.935 11.321 3.412
111 HA THR 12 HA THR 12 16.984 13.922 2.538
112 HB THR 12 HB THR 12 19.601 12.514 1.973
113 HG1 THR 12 HG1 THR 12 19.890 13.105 3.999
114 HG21 THR 12 HG21 THR 12 18.744 15.363 1.461
115 HG22 THR 12 HG22 THR 12 19.088 14.141 0.238
116 HG23 THR 12 HG23 THR 12 20.384 14.745 1.272
117 H ASP 13 HN ASP 13 17.988 10.845 1.062
118 HA ASP 13 HA ASP 13 17.571 11.567 -1.608
119 HB2 ASP 13 HB2 ASP 13 18.782 9.536 -0.955
120 HB3 ASP 13 HB3 ASP 13 17.294 8.839 -0.322
121 H ILE 14 HN ILE 14 15.700 12.596 -2.097
122 HA ILE 14 HA ILE 14 13.163 11.852 -1.064
123 HB ILE 14 HB ILE 14 13.470 14.119 -1.738
124 HG12 ILE 14 HG12 ILE 14 11.594 14.434 -3.335
125 HG13 ILE 14 HG13 ILE 14 11.629 12.708 -3.683
126 HG21 ILE 14 HG21 ILE 14 14.036 13.090 -4.512
127 HG22 ILE 14 HG22 ILE 14 13.918 14.786 -4.044
128 HG23 ILE 14 HG23 ILE 14 15.216 13.781 -3.398
129 HD11 ILE 14 HD11 ILE 14 11.026 13.958 -1.012
130 HD12 ILE 14 HD12 ILE 14 9.850 13.266 -2.129
131 HD13 ILE 14 HD13 ILE 14 11.054 12.228 -1.362
132 H SER 15 HN SER 15 12.087 10.093 -1.572
133 HA SER 15 HA SER 15 11.800 9.318 -4.363
134 HB2 SER 15 HB2 SER 15 13.719 7.993 -3.600
135 HB3 SER 15 HB3 SER 15 12.776 7.388 -2.240
136 HG SER 15 HG SER 15 11.926 5.964 -3.519
137 H THR 16 HN THR 16 10.138 7.529 -4.576
138 HA THR 16 HA THR 16 7.763 8.302 -3.277
139 HB THR 16 HB THR 16 8.274 5.721 -4.769
140 HG1 THR 16 HG1 THR 16 8.742 7.480 -6.104
141 HG21 THR 16 HG21 THR 16 5.715 7.222 -4.196
142 HG22 THR 16 HG22 THR 16 6.204 5.690 -3.472
143 HG23 THR 16 HG23 THR 16 5.857 5.777 -5.198
144 H SER 17 HN SER 17 7.953 8.140 -1.057
145 HA SER 17 HA SER 17 8.046 5.391 -0.002
146 HB2 SER 17 HB2 SER 17 10.088 6.601 0.622
147 HB3 SER 17 HB3 SER 17 9.116 7.897 1.320
148 HG SER 17 HG SER 17 8.659 6.672 3.005
149 H SEP 18 HN SER 18 6.044 7.846 -0.617
150 HA SEP 18 HA SER 18 4.585 7.790 1.910
151 HB2 SEP 18 HB2 SER 18 4.104 9.351 -0.639
152 HB3 SEP 18 HB3 SER 18 3.124 9.488 0.821
153 H SER 19 HN SER 19 4.631 6.219 -1.097
154 HA SER 19 HA SER 19 3.315 4.642 -2.065
155 HB2 SER 19 HB2 SER 19 1.899 4.528 0.608
156 HB3 SER 19 HB3 SER 19 1.887 3.291 -0.646
157 HG SER 19 HG SER 19 3.452 2.603 0.666
158 H SER 20 HN SER 20 0.914 4.070 -2.520
159 HA SER 20 HA SER 20 -0.920 6.291 -2.257
160 HB2 SER 20 HB2 SER 20 -1.244 6.569 -4.689
161 HB3 SER 20 HB3 SER 20 0.399 6.983 -4.204
162 HG SER 20 HG SER 20 -0.497 4.617 -5.474
163 H ILE 21 HN ILE 21 -0.163 3.060 -3.309
164 HA ILE 21 HA ILE 21 -2.780 2.312 -4.118
165 HB ILE 21 HB ILE 21 -1.997 0.010 -4.004
166 HG12 ILE 21 HG12 ILE 21 0.545 1.127 -2.798
167 HG13 ILE 21 HG13 ILE 21 -0.693 0.267 -1.888
168 HG21 ILE 21 HG21 ILE 21 -1.397 1.357 -5.944
169 HG22 ILE 21 HG22 ILE 21 0.081 1.879 -5.135
170 HG23 ILE 21 HG23 ILE 21 -0.133 0.183 -5.576
171 HD11 ILE 21 HD11 ILE 21 0.983 -0.846 -4.127
172 HD12 ILE 21 HD12 ILE 21 1.137 -1.211 -2.408
173 HD13 ILE 21 HD13 ILE 21 -0.305 -1.715 -3.290
174 H SER 22 HN SER 22 -4.213 0.832 -3.018
175 HA SER 22 HA SER 22 -4.051 1.045 -0.085
176 HB2 SER 22 HB2 SER 22 -6.519 1.135 -0.049
177 HB3 SER 22 HB3 SER 22 -5.833 2.484 -0.951
178 HG SER 22 HG SER 22 -7.645 0.852 -1.801
179 H SER 23 HN SER 23 -5.767 -0.609 0.880
180 HA SER 23 HA SER 23 -5.536 -3.169 -0.540
181 HB2 SER 23 HB2 SER 23 -4.845 -2.727 2.377
182 HB3 SER 23 HB3 SER 23 -4.906 -4.295 1.572
183 HG SER 23 HG SER 23 -2.969 -3.933 0.873
184 H SER 24 HN SER 24 -7.437 -0.953 1.053
185 HA SER 24 HA SER 24 -9.395 -2.945 1.947
186 HB2 SER 24 HB2 SER 24 -9.274 0.046 2.423
187 HB3 SER 24 HB3 SER 24 -10.507 -1.037 3.072
188 HG SER 24 HG SER 24 -8.471 -0.453 4.355
189 H GLU 25 HN GLU 25 -10.870 -3.528 0.500
190 HA GLU 25 HA GLU 25 -12.375 -1.533 -0.937
191 HB2 GLU 25 HB2 GLU 25 -10.383 -1.946 -2.395
192 HB3 GLU 25 HB3 GLU 25 -10.878 -3.628 -2.517
193 HG2 GLU 25 HG2 GLU 25 -13.013 -2.887 -3.518
194 HG3 GLU 25 HG3 GLU 25 -12.417 -1.228 -3.480
195 H GLU 26 HN GLU 26 -11.702 -5.021 -1.290
196 HA GLU 26 HA GLU 26 -14.525 -5.551 -0.644
197 HB2 GLU 26 HB2 GLU 26 -12.893 -6.743 -2.889
198 HB3 GLU 26 HB3 GLU 26 -14.425 -7.411 -2.344
199 HG2 GLU 26 HG2 GLU 26 -15.570 -5.372 -2.954
200 HG3 GLU 26 HG3 GLU 26 -14.039 -4.624 -3.413
201 H ASN 27 HN ASN 27 -14.904 -7.865 -0.026
202 HA ASN 27 HA ASN 27 -12.714 -8.750 1.703
203 HB2 ASN 27 HB2 ASN 27 -15.625 -9.574 1.680
204 HB3 ASN 27 HB3 ASN 27 -14.421 -10.110 2.846
205 HD21 ASN 27 HD21 ASN 27 -15.506 -9.267 4.589
206 HD22 ASN 27 HD22 ASN 27 -15.628 -7.571 4.888
207 H ASP 28 HN ASP 28 -13.312 -9.287 -1.324
208 HA ASP 28 HA ASP 28 -12.887 -10.948 -2.813
209 HB2 ASP 28 HB2 ASP 28 -11.643 -12.254 -0.385
210 HB3 ASP 28 HB3 ASP 28 -11.492 -12.871 -2.028
211 H PHE 29 HN PHE 29 -14.872 -11.627 -3.427
212 HA PHE 29 HA PHE 29 -16.086 -13.823 -1.876
213 HB2 PHE 29 HB2 PHE 29 -17.592 -12.048 -3.787
214 HB3 PHE 29 HB3 PHE 29 -18.240 -13.092 -2.526
215 HD1 PHE 29 HD2 PHE 29 -18.146 -12.408 -0.179
216 HD2 PHE 29 HD1 PHE 29 -16.783 -9.861 -3.304
217 HE1 PHE 29 HE2 PHE 29 -18.200 -10.491 1.367
218 HE2 PHE 29 HE1 PHE 29 -16.834 -7.940 -1.766
219 HZ PHE 29 HZ PHE 29 -17.546 -8.253 0.571
220 H TRP 30 HN TRP 30 -14.780 -12.819 -4.871
221 HA TRP 30 HA TRP 30 -16.069 -14.772 -6.513
222 HB2 TRP 30 HB2 TRP 30 -13.953 -12.728 -6.863
223 HB3 TRP 30 HB3 TRP 30 -13.889 -14.105 -7.958
224 HD1 TRP 30 HD1 TRP 30 -15.672 -10.865 -7.411
225 HE1 TRP 30 HE1 TRP 30 -17.514 -10.572 -9.187
226 HE3 TRP 30 HE3 TRP 30 -15.680 -15.590 -9.349
227 HZ2 TRP 30 HZ2 TRP 30 -18.803 -12.143 -11.151
228 HZ3 TRP 30 HZ3 TRP 30 -17.246 -16.117 -11.176
229 HH2 TRP 30 HH2 TRP 30 -18.774 -14.428 -12.057
230 H GLN 31 HN GLN 31 -12.581 -14.444 -5.887
231 HA GLN 31 HA GLN 31 -10.930 -15.984 -5.656
232 HB2 GLN 31 HB2 GLN 31 -13.144 -17.551 -4.327
233 HB3 GLN 31 HB3 GLN 31 -11.436 -17.962 -4.251
234 HG2 GLN 31 HG2 GLN 31 -10.924 -16.031 -2.996
235 HG3 GLN 31 HG3 GLN 31 -12.504 -15.317 -3.316
236 HE21 GLN 31 HE21 GLN 31 -12.024 -18.684 -2.458
237 HE22 GLN 31 HE22 GLN 31 -12.763 -18.586 -0.901
238 HA PRO 32 HA PRO 32 -12.437 -18.448 -9.301
239 HB2 PRO 32 HB2 PRO 32 -10.435 -17.119 -10.899
240 HB3 PRO 32 HB3 PRO 32 -12.191 -17.061 -11.068
241 HG2 PRO 32 HG2 PRO 32 -10.640 -14.930 -10.293
242 HG3 PRO 32 HG3 PRO 32 -12.359 -15.110 -9.901
243 HD2 PRO 32 HD2 PRO 32 -9.958 -15.634 -8.198
244 HD3 PRO 32 HD3 PRO 32 -11.533 -14.943 -7.753
245 H LYS 33 HN LYS 33 -9.251 -17.594 -8.112
246 HA LYS 33 HA LYS 33 -8.037 -19.950 -9.314
247 HB2 LYS 33 HB2 LYS 33 -6.798 -17.880 -7.491
248 HB3 LYS 33 HB3 LYS 33 -5.940 -19.085 -8.443
249 HG2 LYS 33 HG2 LYS 33 -7.610 -16.855 -9.589
250 HG3 LYS 33 HG3 LYS 33 -5.851 -16.837 -9.435
251 HD2 LYS 33 HD2 LYS 33 -5.723 -18.828 -10.877
252 HD3 LYS 33 HD3 LYS 33 -7.479 -18.793 -11.057
253 HE2 LYS 33 HE2 LYS 33 -5.579 -16.606 -11.897
254 HE3 LYS 33 HE3 LYS 33 -6.338 -17.776 -12.976
255 HZ1 LYS 33 HZ1 LYS 33 -7.853 -15.881 -11.271
256 HZ2 LYS 33 HZ2 LYS 33 -8.472 -16.882 -12.485
257 HZ3 LYS 33 HZ3 LYS 33 -7.463 -15.587 -12.890
258 HA PRO 34 HA PRO 34 -8.319 -22.750 -5.924
259 HB2 PRO 34 HB2 PRO 34 -5.349 -22.968 -5.984
260 HB3 PRO 34 HB3 PRO 34 -6.573 -24.240 -6.063
261 HG2 PRO 34 HG2 PRO 34 -5.245 -23.496 -8.247
262 HG3 PRO 34 HG3 PRO 34 -6.970 -23.901 -8.323
263 HD2 PRO 34 HD2 PRO 34 -5.643 -21.227 -8.376
264 HD3 PRO 34 HD3 PRO 34 -7.091 -21.787 -9.237
265 H THR 35 HN THR 35 -8.894 -21.679 -4.105
266 HA THR 35 HA THR 35 -7.332 -19.716 -2.814
267 HB THR 35 HB THR 35 -9.530 -21.400 -1.596
268 HG1 THR 35 HG1 THR 35 -9.934 -20.073 -3.622
269 HG21 THR 35 HG21 THR 35 -9.832 -19.481 -0.097
270 HG22 THR 35 HG22 THR 35 -8.462 -18.672 -0.857
271 HG23 THR 35 HG23 THR 35 -8.213 -20.161 0.053
Start of MODEL 11
1 H1 GLU 1 H1 GLU 1 19.647 15.479 9.782
2 H2 GLU 1 H2 GLU 1 18.401 16.607 9.594
3 H3 GLU 1 H3 GLU 1 19.832 16.770 8.702
4 HA GLU 1 HA GLU 1 17.880 14.555 8.456
5 HB2 GLU 1 HB2 GLU 1 17.047 16.694 7.558
6 HB3 GLU 1 HB3 GLU 1 18.499 16.844 6.577
7 HG2 GLU 1 HG2 GLU 1 17.880 14.795 5.376
8 HG3 GLU 1 HG3 GLU 1 16.407 14.692 6.339
9 H LYS 2 HN LYS 2 18.435 12.915 7.071
10 HA LYS 2 HA LYS 2 20.935 13.052 5.596
11 HB2 LYS 2 HB2 LYS 2 21.620 12.253 7.818
12 HB3 LYS 2 HB3 LYS 2 20.448 10.948 7.713
13 HG2 LYS 2 HG2 LYS 2 21.649 10.025 5.793
14 HG3 LYS 2 HG3 LYS 2 22.831 11.329 5.912
15 HD2 LYS 2 HD2 LYS 2 23.463 10.568 8.139
16 HD3 LYS 2 HD3 LYS 2 22.256 9.282 8.054
17 HE2 LYS 2 HE2 LYS 2 23.429 8.306 6.143
18 HE3 LYS 2 HE3 LYS 2 24.628 9.597 6.216
19 HZ1 LYS 2 HZ1 LYS 2 25.267 8.833 8.415
20 HZ2 LYS 2 HZ2 LYS 2 25.426 7.584 7.286
21 HZ3 LYS 2 HZ3 LYS 2 24.113 7.596 8.352
22 H LEU 3 HN LEU 3 18.260 10.956 6.626
23 HA LEU 3 HA LEU 3 17.014 9.410 5.529
24 HB2 LEU 3 HB2 LEU 3 17.659 11.331 3.318
25 HB3 LEU 3 HB3 LEU 3 16.565 9.979 3.095
26 HG LEU 3 HG LEU 3 16.057 11.908 5.318
27 HD11 LEU 3 HD11 LEU 3 16.491 13.281 3.331
28 HD12 LEU 3 HD12 LEU 3 15.267 12.366 2.449
29 HD13 LEU 3 HD13 LEU 3 14.802 13.349 3.839
30 HD21 LEU 3 HD21 LEU 3 14.705 9.897 5.173
31 HD22 LEU 3 HD22 LEU 3 13.728 11.319 4.810
32 HD23 LEU 3 HD23 LEU 3 14.286 10.276 3.501
33 H LYS 4 HN LYS 4 19.907 9.067 5.695
34 HA LYS 4 HA LYS 4 21.595 7.719 4.958
35 HB2 LYS 4 HB2 LYS 4 19.305 6.017 3.971
36 HB3 LYS 4 HB3 LYS 4 20.922 5.470 4.399
37 HG2 LYS 4 HG2 LYS 4 19.020 6.749 6.346
38 HG3 LYS 4 HG3 LYS 4 19.168 5.008 6.112
39 HD2 LYS 4 HD2 LYS 4 21.514 5.104 6.761
40 HD3 LYS 4 HD3 LYS 4 21.403 6.857 6.944
41 HE2 LYS 4 HE2 LYS 4 19.860 4.812 8.537
42 HE3 LYS 4 HE3 LYS 4 21.266 5.711 9.104
43 HZ1 LYS 4 HZ1 LYS 4 19.193 6.694 9.880
44 HZ2 LYS 4 HZ2 LYS 4 18.675 6.912 8.286
45 HZ3 LYS 4 HZ3 LYS 4 20.021 7.761 8.860
46 H GLN 5 HN GLN 5 22.634 8.855 3.362
47 HA GLN 5 HA GLN 5 21.752 8.333 0.597
48 HB2 GLN 5 HB2 GLN 5 23.406 10.658 1.600
49 HB3 GLN 5 HB3 GLN 5 22.849 10.414 -0.049
50 HG2 GLN 5 HG2 GLN 5 20.535 10.623 0.698
51 HG3 GLN 5 HG3 GLN 5 21.094 10.866 2.350
52 HE21 GLN 5 HE21 GLN 5 20.836 12.254 -0.824
53 HE22 GLN 5 HE22 GLN 5 21.204 13.878 -0.364
54 H ASP 6 HN ASP 6 23.015 7.040 -0.547
55 HA ASP 6 HA ASP 6 25.901 7.032 -0.033
56 HB2 ASP 6 HB2 ASP 6 24.149 4.577 -0.260
57 HB3 ASP 6 HB3 ASP 6 25.911 4.547 -0.300
58 H ILE 7 HN ILE 7 26.600 7.924 -1.883
59 HA ILE 7 HA ILE 7 25.472 7.016 -4.427
60 HB ILE 7 HB ILE 7 25.527 9.417 -4.146
61 HG12 ILE 7 HG12 ILE 7 27.725 8.586 -6.046
62 HG13 ILE 7 HG13 ILE 7 26.007 8.426 -6.389
63 HG21 ILE 7 HG21 ILE 7 27.329 9.538 -2.502
64 HG22 ILE 7 HG22 ILE 7 28.501 9.124 -3.753
65 HG23 ILE 7 HG23 ILE 7 27.613 10.645 -3.845
66 HD11 ILE 7 HD11 ILE 7 27.449 11.017 -5.869
67 HD12 ILE 7 HD12 ILE 7 26.978 10.396 -7.452
68 HD13 ILE 7 HD13 ILE 7 25.741 10.834 -6.274
69 H LEU 8 HN LEU 8 28.437 7.104 -2.571
70 HA LEU 8 HA LEU 8 29.693 5.386 -4.585
71 HB2 LEU 8 HB2 LEU 8 31.877 6.484 -3.773
72 HB3 LEU 8 HB3 LEU 8 30.881 7.344 -4.927
73 HG LEU 8 HG LEU 8 29.888 8.516 -2.832
74 HD11 LEU 8 HD11 LEU 8 31.469 8.725 -0.979
75 HD12 LEU 8 HD12 LEU 8 30.904 7.065 -1.168
76 HD13 LEU 8 HD13 LEU 8 32.511 7.518 -1.735
77 HD21 LEU 8 HD21 LEU 8 32.695 9.070 -3.783
78 HD22 LEU 8 HD22 LEU 8 31.206 9.641 -4.535
79 HD23 LEU 8 HD23 LEU 8 31.656 10.210 -2.926
80 H ASN 9 HN ASN 9 28.803 5.921 -1.389
81 HA ASN 9 HA ASN 9 30.751 4.126 -0.215
82 HB2 ASN 9 HB2 ASN 9 28.347 5.564 0.921
83 HB3 ASN 9 HB3 ASN 9 29.360 4.480 1.867
84 HD21 ASN 9 HD21 ASN 9 28.836 7.360 2.128
85 HD22 ASN 9 HD22 ASN 9 30.387 8.120 2.095
86 H LEU 10 HN LEU 10 27.567 4.022 -1.538
87 HA LEU 10 HA LEU 10 27.522 1.174 -1.521
88 HB2 LEU 10 HB2 LEU 10 26.758 2.019 0.850
89 HB3 LEU 10 HB3 LEU 10 25.253 2.368 0.023
90 HG LEU 10 HG LEU 10 25.143 -0.031 -0.672
91 HD11 LEU 10 HD11 LEU 10 26.563 -1.645 0.477
92 HD12 LEU 10 HD12 LEU 10 27.524 -0.546 -0.514
93 HD13 LEU 10 HD13 LEU 10 27.458 -0.327 1.233
94 HD21 LEU 10 HD21 LEU 10 24.437 -0.854 1.505
95 HD22 LEU 10 HD22 LEU 10 25.298 0.465 2.298
96 HD23 LEU 10 HD23 LEU 10 23.910 0.812 1.268
97 H ARG 11 HN ARG 11 24.556 1.130 -1.599
98 HA ARG 11 HA ARG 11 24.272 2.044 -4.342
99 HB2 ARG 11 HB2 ARG 11 22.392 0.430 -2.608
100 HB3 ARG 11 HB3 ARG 11 22.169 0.764 -4.319
101 HG2 ARG 11 HG2 ARG 11 24.258 -0.456 -4.798
102 HG3 ARG 11 HG3 ARG 11 24.387 -0.848 -3.082
103 HD2 ARG 11 HD2 ARG 11 22.271 -2.040 -3.177
104 HD3 ARG 11 HD3 ARG 11 22.081 -1.602 -4.874
105 HE ARG 11 HE ARG 11 24.516 -2.948 -4.567
106 HH11 ARG 11 HH12 ARG 11 21.091 -3.566 -4.379
107 HH12 ARG 11 HH11 ARG 11 21.237 -5.230 -4.835
108 HH21 ARG 11 HH22 ARG 11 24.715 -5.139 -5.171
109 HH22 ARG 11 HH21 ARG 11 23.295 -6.125 -5.283
110 H THR 12 HN THR 12 22.070 2.976 -4.940
111 HA THR 12 HA THR 12 21.539 5.213 -3.133
112 HB THR 12 HB THR 12 20.374 6.240 -5.059
113 HG1 THR 12 HG1 THR 12 19.787 4.936 -6.612
114 HG21 THR 12 HG21 THR 12 23.156 5.257 -5.711
115 HG22 THR 12 HG22 THR 12 22.771 6.652 -4.704
116 HG23 THR 12 HG23 THR 12 22.358 6.662 -6.419
117 H ASP 13 HN ASP 13 20.208 4.211 -1.613
118 HA ASP 13 HA ASP 13 17.790 2.866 -2.477
119 HB2 ASP 13 HB2 ASP 13 18.828 3.547 0.281
120 HB3 ASP 13 HB3 ASP 13 17.362 2.624 -0.033
121 H ILE 14 HN ILE 14 16.343 4.241 -3.353
122 HA ILE 14 HA ILE 14 15.853 6.848 -2.201
123 HB ILE 14 HB ILE 14 15.772 6.560 -4.633
124 HG12 ILE 14 HG12 ILE 14 13.034 7.212 -3.518
125 HG13 ILE 14 HG13 ILE 14 14.405 8.318 -3.502
126 HG21 ILE 14 HG21 ILE 14 13.973 5.321 -5.702
127 HG22 ILE 14 HG22 ILE 14 14.935 4.258 -4.675
128 HG23 ILE 14 HG23 ILE 14 13.359 4.827 -4.125
129 HD11 ILE 14 HD11 ILE 14 14.451 8.295 -5.941
130 HD12 ILE 14 HD12 ILE 14 13.078 7.187 -5.955
131 HD13 ILE 14 HD13 ILE 14 12.885 8.823 -5.324
132 H SER 15 HN SER 15 14.433 3.673 -2.123
133 HA SER 15 HA SER 15 11.871 4.405 -1.168
134 HB2 SER 15 HB2 SER 15 11.666 2.035 -0.507
135 HB3 SER 15 HB3 SER 15 12.303 2.198 -2.144
136 HG SER 15 HG SER 15 13.451 0.667 -0.829
137 H THR 16 HN THR 16 11.083 4.658 0.877
138 HA THR 16 HA THR 16 13.005 4.456 3.101
139 HB THR 16 HB THR 16 11.003 6.692 2.714
140 HG1 THR 16 HG1 THR 16 13.754 7.157 2.853
141 HG21 THR 16 HG21 THR 16 11.353 6.126 5.070
142 HG22 THR 16 HG22 THR 16 12.072 7.689 4.683
143 HG23 THR 16 HG23 THR 16 13.098 6.264 4.851
144 H SER 17 HN SER 17 9.597 4.601 2.139
145 HA SER 17 HA SER 17 8.777 3.483 4.705
146 HB2 SER 17 HB2 SER 17 7.131 4.378 2.325
147 HB3 SER 17 HB3 SER 17 6.478 3.848 3.876
148 HG SER 17 HG SER 17 8.241 6.046 3.531
149 H SEP 18 HN SER 18 6.910 1.785 4.451
150 HA SEP 18 HA SER 18 8.033 -0.409 2.874
151 HB2 SEP 18 HB2 SER 18 6.651 -1.873 4.293
152 HB3 SEP 18 HB3 SER 18 7.672 -0.820 5.272
153 H SER 19 HN SER 19 5.966 1.923 2.234
154 HA SER 19 HA SER 19 3.564 0.748 1.443
155 HB2 SER 19 HB2 SER 19 3.814 3.154 1.539
156 HB3 SER 19 HB3 SER 19 5.033 3.116 0.265
157 HG SER 19 HG SER 19 3.491 2.605 -1.205
158 H SER 20 HN SER 20 2.799 0.110 -0.638
159 HA SER 20 HA SER 20 4.729 -0.404 -2.737
160 HB2 SER 20 HB2 SER 20 4.238 -2.822 -2.845
161 HB3 SER 20 HB3 SER 20 5.007 -2.382 -1.320
162 HG SER 20 HG SER 20 3.247 -3.740 -0.937
163 H ILE 21 HN ILE 21 1.566 0.017 -1.572
164 HA ILE 21 HA ILE 21 -0.457 0.324 -2.562
165 HB ILE 21 HB ILE 21 1.173 0.757 -5.067
166 HG12 ILE 21 HG12 ILE 21 1.892 2.231 -3.244
167 HG13 ILE 21 HG13 ILE 21 1.059 3.145 -4.495
168 HG21 ILE 21 HG21 ILE 21 -1.163 0.398 -5.575
169 HG22 ILE 21 HG22 ILE 21 -1.637 1.590 -4.363
170 HG23 ILE 21 HG23 ILE 21 -0.758 2.100 -5.804
171 HD11 ILE 21 HD11 ILE 21 0.406 3.902 -2.293
172 HD12 ILE 21 HD12 ILE 21 -0.966 3.162 -3.118
173 HD13 ILE 21 HD13 ILE 21 -0.106 2.271 -1.861
174 H SER 22 HN SER 22 -1.370 -1.681 -2.376
175 HA SER 22 HA SER 22 -1.691 -3.167 -4.830
176 HB2 SER 22 HB2 SER 22 -1.005 -5.330 -3.863
177 HB3 SER 22 HB3 SER 22 0.343 -4.196 -3.936
178 HG SER 22 HG SER 22 -0.144 -3.719 -1.693
179 H SER 23 HN SER 23 -2.817 -1.967 -1.974
180 HA SER 23 HA SER 23 -4.947 -3.950 -1.666
181 HB2 SER 23 HB2 SER 23 -5.500 -2.731 0.409
182 HB3 SER 23 HB3 SER 23 -3.811 -3.240 0.384
183 HG SER 23 HG SER 23 -3.360 -1.221 0.694
184 H SER 24 HN SER 24 -7.105 -2.723 -0.912
185 HA SER 24 HA SER 24 -7.653 -0.503 -2.743
186 HB2 SER 24 HB2 SER 24 -9.729 -1.584 -3.520
187 HB3 SER 24 HB3 SER 24 -8.306 -2.532 -3.950
188 HG SER 24 HG SER 24 -10.367 -3.114 -2.195
189 H GLU 25 HN GLU 25 -10.285 -0.122 -2.362
190 HA GLU 25 HA GLU 25 -10.390 0.656 0.443
191 HB2 GLU 25 HB2 GLU 25 -12.176 1.362 -1.892
192 HB3 GLU 25 HB3 GLU 25 -12.379 1.981 -0.258
193 HG2 GLU 25 HG2 GLU 25 -11.280 3.650 -1.531
194 HG3 GLU 25 HG3 GLU 25 -10.092 2.958 -0.427
195 H GLU 26 HN GLU 26 -12.989 -0.398 -1.734
196 HA GLU 26 HA GLU 26 -13.796 -2.381 0.284
197 HB2 GLU 26 HB2 GLU 26 -15.244 -0.416 0.484
198 HB3 GLU 26 HB3 GLU 26 -15.622 -0.505 -1.231
199 HG2 GLU 26 HG2 GLU 26 -16.727 -2.640 -0.898
200 HG3 GLU 26 HG3 GLU 26 -16.301 -2.609 0.813
201 H ASN 27 HN ASN 27 -14.910 -4.216 -0.517
202 HA ASN 27 HA ASN 27 -14.815 -4.569 -3.432
203 HB2 ASN 27 HB2 ASN 27 -13.840 -6.539 -1.356
204 HB3 ASN 27 HB3 ASN 27 -14.014 -6.896 -3.071
205 HD21 ASN 27 HD21 ASN 27 -12.206 -5.155 -0.672
206 HD22 ASN 27 HD22 ASN 27 -10.862 -4.757 -1.682
207 H ASP 28 HN ASP 28 -16.409 -5.839 -4.326
208 HA ASP 28 HA ASP 28 -18.307 -7.201 -2.600
209 HB2 ASP 28 HB2 ASP 28 -20.243 -6.016 -3.671
210 HB3 ASP 28 HB3 ASP 28 -19.270 -4.997 -2.616
211 H PHE 29 HN PHE 29 -18.225 -9.153 -3.499
212 HA PHE 29 HA PHE 29 -18.383 -10.842 -5.007
213 HB2 PHE 29 HB2 PHE 29 -20.582 -9.776 -5.470
214 HB3 PHE 29 HB3 PHE 29 -19.820 -8.805 -6.724
215 HD1 PHE 29 HD1 PHE 29 -19.056 -9.832 -8.800
216 HD2 PHE 29 HD2 PHE 29 -21.076 -12.096 -5.816
217 HE1 PHE 29 HE1 PHE 29 -19.458 -11.624 -10.439
218 HE2 PHE 29 HE2 PHE 29 -21.481 -13.893 -7.449
219 HZ PHE 29 HZ PHE 29 -20.685 -13.654 -9.762
220 H TRP 30 HN TRP 30 -16.178 -10.990 -5.394
221 HA TRP 30 HA TRP 30 -15.379 -10.236 -8.082
222 HB2 TRP 30 HB2 TRP 30 -14.004 -9.278 -5.585
223 HB3 TRP 30 HB3 TRP 30 -13.141 -9.422 -7.113
224 HD1 TRP 30 HD1 TRP 30 -15.396 -7.130 -5.220
225 HE1 TRP 30 HE1 TRP 30 -15.987 -5.093 -6.681
226 HE3 TRP 30 HE3 TRP 30 -13.646 -8.830 -9.695
227 HZ2 TRP 30 HZ2 TRP 30 -15.741 -4.312 -9.394
228 HZ3 TRP 30 HZ3 TRP 30 -13.860 -7.384 -11.683
229 HH2 TRP 30 HH2 TRP 30 -14.889 -5.173 -11.531
230 H GLN 31 HN GLN 31 -13.545 -11.282 -5.229
231 HA GLN 31 HA GLN 31 -13.206 -13.917 -6.454
232 HB2 GLN 31 HB2 GLN 31 -10.942 -12.147 -5.524
233 HB3 GLN 31 HB3 GLN 31 -10.768 -13.844 -5.949
234 HG2 GLN 31 HG2 GLN 31 -11.438 -13.381 -8.225
235 HG3 GLN 31 HG3 GLN 31 -11.729 -11.689 -7.818
236 HE21 GLN 31 HE21 GLN 31 -9.984 -10.317 -7.488
237 HE22 GLN 31 HE22 GLN 31 -8.381 -10.726 -7.985
238 HA PRO 32 HA PRO 32 -13.932 -13.866 -1.777
239 HB2 PRO 32 HB2 PRO 32 -16.217 -15.592 -2.448
240 HB3 PRO 32 HB3 PRO 32 -16.162 -14.150 -1.431
241 HG2 PRO 32 HG2 PRO 32 -17.356 -14.144 -3.840
242 HG3 PRO 32 HG3 PRO 32 -16.512 -12.720 -3.201
243 HD2 PRO 32 HD2 PRO 32 -15.589 -14.722 -5.231
244 HD3 PRO 32 HD3 PRO 32 -15.387 -12.957 -5.209
245 H LYS 33 HN LYS 33 -14.719 -16.153 -0.609
246 HA LYS 33 HA LYS 33 -13.200 -18.316 -1.879
247 HB2 LYS 33 HB2 LYS 33 -12.174 -18.868 0.313
248 HB3 LYS 33 HB3 LYS 33 -11.657 -17.310 -0.318
249 HG2 LYS 33 HG2 LYS 33 -13.927 -17.476 1.620
250 HG3 LYS 33 HG3 LYS 33 -12.257 -17.530 2.184
251 HD2 LYS 33 HD2 LYS 33 -11.821 -15.394 1.046
252 HD3 LYS 33 HD3 LYS 33 -13.508 -15.338 0.528
253 HE2 LYS 33 HE2 LYS 33 -12.538 -15.359 3.385
254 HE3 LYS 33 HE3 LYS 33 -13.114 -13.943 2.504
255 HZ1 LYS 33 HZ1 LYS 33 -14.843 -14.866 3.910
256 HZ2 LYS 33 HZ2 LYS 33 -14.720 -16.362 3.132
257 HZ3 LYS 33 HZ3 LYS 33 -15.272 -15.010 2.279
258 HA PRO 34 HA PRO 34 -16.638 -20.784 -0.582
259 HB2 PRO 34 HB2 PRO 34 -15.561 -23.251 -0.660
260 HB3 PRO 34 HB3 PRO 34 -15.864 -22.315 -2.129
261 HG2 PRO 34 HG2 PRO 34 -13.304 -22.711 -0.630
262 HG3 PRO 34 HG3 PRO 34 -13.591 -22.740 -2.378
263 HD2 PRO 34 HD2 PRO 34 -12.574 -20.579 -1.056
264 HD3 PRO 34 HD3 PRO 34 -13.522 -20.452 -2.550
265 H THR 35 HN THR 35 -14.206 -20.000 1.395
266 HA THR 35 HA THR 35 -13.639 -20.340 3.572
267 HB THR 35 HB THR 35 -15.514 -20.589 5.147
268 HG1 THR 35 HG1 THR 35 -17.665 -20.688 4.117
269 HG21 THR 35 HG21 THR 35 -16.142 -18.724 2.855
270 HG22 THR 35 HG22 THR 35 -15.020 -18.387 4.172
271 HG23 THR 35 HG23 THR 35 -16.742 -18.580 4.506
Start of MODEL 12
1 H1 GLU 1 H1 GLU 1 14.618 16.566 0.530
2 H2 GLU 1 H2 GLU 1 14.058 17.198 -0.936
3 H3 GLU 1 H3 GLU 1 14.904 18.190 0.143
4 HA GLU 1 HA GLU 1 16.028 15.827 -1.243
5 HB2 GLU 1 HB2 GLU 1 16.542 18.765 -1.735
6 HB3 GLU 1 HB3 GLU 1 17.288 17.422 -2.588
7 HG2 GLU 1 HG2 GLU 1 15.139 16.788 -3.518
8 HG3 GLU 1 HG3 GLU 1 14.355 18.089 -2.622
9 H LYS 2 HN LYS 2 17.172 14.960 0.421
10 HA LYS 2 HA LYS 2 19.589 16.244 1.181
11 HB2 LYS 2 HB2 LYS 2 18.043 17.439 2.689
12 HB3 LYS 2 HB3 LYS 2 17.514 15.899 3.354
13 HG2 LYS 2 HG2 LYS 2 19.755 15.476 4.202
14 HG3 LYS 2 HG3 LYS 2 20.312 17.000 3.509
15 HD2 LYS 2 HD2 LYS 2 19.900 17.371 5.831
16 HD3 LYS 2 HD3 LYS 2 18.609 18.165 4.928
17 HE2 LYS 2 HE2 LYS 2 17.163 16.210 5.339
18 HE3 LYS 2 HE3 LYS 2 18.451 15.484 6.300
19 HZ1 LYS 2 HZ1 LYS 2 17.070 18.043 6.900
20 HZ2 LYS 2 HZ2 LYS 2 18.322 17.370 7.815
21 HZ3 LYS 2 HZ3 LYS 2 16.832 16.576 7.706
22 H LEU 3 HN LEU 3 21.064 14.822 2.025
23 HA LEU 3 HA LEU 3 22.046 12.838 2.516
24 HB2 LEU 3 HB2 LEU 3 20.537 12.827 4.440
25 HB3 LEU 3 HB3 LEU 3 19.285 12.076 3.469
26 HG LEU 3 HG LEU 3 20.724 10.077 3.199
27 HD11 LEU 3 HD11 LEU 3 22.535 11.545 5.111
28 HD12 LEU 3 HD12 LEU 3 22.688 9.844 4.673
29 HD13 LEU 3 HD13 LEU 3 22.900 11.092 3.447
30 HD21 LEU 3 HD21 LEU 3 20.473 9.260 5.499
31 HD22 LEU 3 HD22 LEU 3 20.189 10.911 6.049
32 HD23 LEU 3 HD23 LEU 3 19.043 10.137 4.954
33 H LYS 4 HN LYS 4 22.626 11.092 1.351
34 HA LYS 4 HA LYS 4 20.951 10.431 -0.950
35 HB2 LYS 4 HB2 LYS 4 23.820 9.711 -0.325
36 HB3 LYS 4 HB3 LYS 4 22.980 9.336 -1.824
37 HG2 LYS 4 HG2 LYS 4 22.945 11.551 -2.508
38 HG3 LYS 4 HG3 LYS 4 23.217 12.161 -0.874
39 HD2 LYS 4 HD2 LYS 4 25.491 11.305 -0.911
40 HD3 LYS 4 HD3 LYS 4 25.227 10.627 -2.520
41 HE2 LYS 4 HE2 LYS 4 26.449 12.743 -2.628
42 HE3 LYS 4 HE3 LYS 4 24.878 12.864 -3.418
43 HZ1 LYS 4 HZ1 LYS 4 25.332 14.799 -2.047
44 HZ2 LYS 4 HZ2 LYS 4 25.510 13.822 -0.678
45 HZ3 LYS 4 HZ3 LYS 4 24.005 13.941 -1.439
46 H GLN 5 HN GLN 5 21.336 8.011 -1.667
47 HA GLN 5 HA GLN 5 20.204 6.397 0.453
48 HB2 GLN 5 HB2 GLN 5 20.001 4.673 -1.359
49 HB3 GLN 5 HB3 GLN 5 19.170 6.186 -1.695
50 HG2 GLN 5 HG2 GLN 5 21.051 6.883 -3.113
51 HG3 GLN 5 HG3 GLN 5 21.836 5.334 -2.805
52 HE21 GLN 5 HE21 GLN 5 21.828 4.789 -4.980
53 HE22 GLN 5 HE22 GLN 5 20.385 4.326 -5.809
54 H ASP 6 HN ASP 6 23.099 6.377 -1.588
55 HA ASP 6 HA ASP 6 25.111 5.350 -1.400
56 HB2 ASP 6 HB2 ASP 6 24.368 5.239 1.530
57 HB3 ASP 6 HB3 ASP 6 25.982 4.988 0.873
58 H ILE 7 HN ILE 7 25.175 3.444 -2.405
59 HA ILE 7 HA ILE 7 23.668 1.171 -1.450
60 HB ILE 7 HB ILE 7 25.732 1.056 -3.636
61 HG12 ILE 7 HG12 ILE 7 22.857 1.948 -3.973
62 HG13 ILE 7 HG13 ILE 7 24.240 3.036 -3.999
63 HG21 ILE 7 HG21 ILE 7 24.830 -1.066 -3.035
64 HG22 ILE 7 HG22 ILE 7 23.184 -0.437 -3.042
65 HG23 ILE 7 HG23 ILE 7 24.074 -0.590 -4.555
66 HD11 ILE 7 HD11 ILE 7 25.089 1.998 -5.983
67 HD12 ILE 7 HD12 ILE 7 23.844 0.751 -5.913
68 HD13 ILE 7 HD13 ILE 7 23.398 2.425 -6.241
69 H LEU 8 HN LEU 8 25.948 2.365 0.118
70 HA LEU 8 HA LEU 8 27.595 -0.065 0.363
71 HB2 LEU 8 HB2 LEU 8 28.337 2.741 1.194
72 HB3 LEU 8 HB3 LEU 8 29.369 1.327 1.263
73 HG LEU 8 HG LEU 8 28.299 2.530 -1.293
74 HD11 LEU 8 HD11 LEU 8 31.028 2.776 -0.032
75 HD12 LEU 8 HD12 LEU 8 30.572 3.365 -1.630
76 HD13 LEU 8 HD13 LEU 8 29.837 4.065 -0.188
77 HD21 LEU 8 HD21 LEU 8 28.790 0.143 -1.449
78 HD22 LEU 8 HD22 LEU 8 29.952 1.094 -2.371
79 HD23 LEU 8 HD23 LEU 8 30.406 0.426 -0.803
80 H ASN 9 HN ASN 9 25.000 1.225 1.669
81 HA ASN 9 HA ASN 9 25.385 -0.034 4.207
82 HB2 ASN 9 HB2 ASN 9 24.824 2.069 5.518
83 HB3 ASN 9 HB3 ASN 9 26.456 1.981 4.861
84 HD21 ASN 9 HD21 ASN 9 23.342 3.499 4.611
85 HD22 ASN 9 HD22 ASN 9 23.837 4.807 3.596
86 H LEU 10 HN LEU 10 23.410 2.165 2.265
87 HA LEU 10 HA LEU 10 21.024 0.759 3.268
88 HB2 LEU 10 HB2 LEU 10 21.606 3.635 3.176
89 HB3 LEU 10 HB3 LEU 10 20.048 3.196 2.505
90 HG LEU 10 HG LEU 10 19.823 3.812 4.841
91 HD11 LEU 10 HD11 LEU 10 19.466 0.846 4.438
92 HD12 LEU 10 HD12 LEU 10 18.664 1.835 5.660
93 HD13 LEU 10 HD13 LEU 10 18.327 2.098 3.949
94 HD21 LEU 10 HD21 LEU 10 20.860 2.513 6.615
95 HD22 LEU 10 HD22 LEU 10 21.703 1.528 5.422
96 HD23 LEU 10 HD23 LEU 10 22.084 3.242 5.578
97 H ARG 11 HN ARG 11 20.254 -0.436 1.682
98 HA ARG 11 HA ARG 11 20.778 0.013 -1.066
99 HB2 ARG 11 HB2 ARG 11 18.695 -1.744 0.246
100 HB3 ARG 11 HB3 ARG 11 19.175 -1.826 -1.444
101 HG2 ARG 11 HG2 ARG 11 21.448 -2.432 -0.755
102 HG3 ARG 11 HG3 ARG 11 20.935 -2.378 0.933
103 HD2 ARG 11 HD2 ARG 11 19.815 -4.203 -1.190
104 HD3 ARG 11 HD3 ARG 11 20.966 -4.669 0.062
105 HE ARG 11 HE ARG 11 18.760 -3.565 1.338
106 HH11 ARG 11 HH12 ARG 11 19.480 -6.323 -0.671
107 HH12 ARG 11 HH11 ARG 11 18.246 -7.315 0.032
108 HH21 ARG 11 HH22 ARG 11 17.135 -4.862 2.262
109 HH22 ARG 11 HH21 ARG 11 16.916 -6.486 1.702
110 H THR 12 HN THR 12 18.515 -0.336 -2.467
111 HA THR 12 HA THR 12 17.335 2.265 -2.409
112 HB THR 12 HB THR 12 15.915 1.415 -4.279
113 HG1 THR 12 HG1 THR 12 16.715 -0.953 -3.300
114 HG21 THR 12 HG21 THR 12 18.873 0.868 -4.547
115 HG22 THR 12 HG22 THR 12 18.090 2.439 -4.724
116 HG23 THR 12 HG23 THR 12 17.751 1.149 -5.878
117 H ASP 13 HN ASP 13 16.372 2.316 -0.329
118 HA ASP 13 HA ASP 13 13.756 0.978 -0.255
119 HB2 ASP 13 HB2 ASP 13 15.195 -0.234 1.285
120 HB3 ASP 13 HB3 ASP 13 15.685 1.270 2.057
121 H ILE 14 HN ILE 14 12.210 2.457 -0.252
122 HA ILE 14 HA ILE 14 12.792 5.166 0.664
123 HB ILE 14 HB ILE 14 11.692 4.879 -1.522
124 HG12 ILE 14 HG12 ILE 14 9.791 6.463 -1.112
125 HG13 ILE 14 HG13 ILE 14 10.026 6.222 0.617
126 HG21 ILE 14 HG21 ILE 14 9.398 3.751 0.078
127 HG22 ILE 14 HG22 ILE 14 9.364 4.132 -1.644
128 HG23 ILE 14 HG23 ILE 14 10.425 2.857 -1.043
129 HD11 ILE 14 HD11 ILE 14 11.068 8.278 -0.131
130 HD12 ILE 14 HD12 ILE 14 12.284 7.133 0.434
131 HD13 ILE 14 HD13 ILE 14 12.040 7.378 -1.295
132 H SER 15 HN SER 15 10.850 2.386 1.499
133 HA SER 15 HA SER 15 10.376 3.414 4.132
134 HB2 SER 15 HB2 SER 15 7.907 3.338 4.016
135 HB3 SER 15 HB3 SER 15 8.571 4.571 2.946
136 HG SER 15 HG SER 15 8.278 3.142 1.211
137 H THR 16 HN THR 16 8.839 1.822 5.342
138 HA THR 16 HA THR 16 9.976 -0.769 5.091
139 HB THR 16 HB THR 16 8.405 -1.427 6.884
140 HG1 THR 16 HG1 THR 16 7.424 1.234 6.566
141 HG21 THR 16 HG21 THR 16 9.235 0.125 8.602
142 HG22 THR 16 HG22 THR 16 9.769 1.230 7.337
143 HG23 THR 16 HG23 THR 16 10.514 -0.363 7.491
144 H SER 17 HN SER 17 7.409 0.735 3.504
145 HA SER 17 HA SER 17 6.248 -1.870 2.756
146 HB2 SER 17 HB2 SER 17 4.622 -0.456 3.903
147 HB3 SER 17 HB3 SER 17 4.936 0.859 2.770
148 HG SER 17 HG SER 17 3.355 -1.351 2.488
149 H SEP 18 HN SER 18 6.375 -2.478 0.687
150 HA SEP 18 HA SER 18 7.336 -0.495 -1.266
151 HB2 SEP 18 HB2 SER 18 8.903 -2.348 -0.866
152 HB3 SEP 18 HB3 SER 18 7.648 -3.507 -1.303
153 H SER 19 HN SER 19 6.347 -0.292 -3.240
154 HA SER 19 HA SER 19 4.665 -0.313 -4.768
155 HB2 SER 19 HB2 SER 19 4.200 -3.136 -3.789
156 HB3 SER 19 HB3 SER 19 3.609 -2.445 -5.301
157 HG SER 19 HG SER 19 5.739 -2.247 -5.997
158 H SER 20 HN SER 20 4.186 0.043 -1.692
159 HA SER 20 HA SER 20 2.463 0.602 -0.320
160 HB2 SER 20 HB2 SER 20 1.075 1.126 -2.958
161 HB3 SER 20 HB3 SER 20 0.521 1.702 -1.387
162 HG SER 20 HG SER 20 3.109 2.285 -2.354
163 H ILE 21 HN ILE 21 2.134 -1.446 0.565
164 HA ILE 21 HA ILE 21 -0.154 -2.936 -0.546
165 HB ILE 21 HB ILE 21 1.938 -4.227 -0.591
166 HG12 ILE 21 HG12 ILE 21 1.107 -6.210 0.690
167 HG13 ILE 21 HG13 ILE 21 -0.127 -5.177 1.407
168 HG21 ILE 21 HG21 ILE 21 3.078 -3.184 1.283
169 HG22 ILE 21 HG22 ILE 21 1.909 -3.882 2.404
170 HG23 ILE 21 HG23 ILE 21 3.001 -4.932 1.502
171 HD11 ILE 21 HD11 ILE 21 0.181 -5.795 -1.523
172 HD12 ILE 21 HD12 ILE 21 -1.027 -6.477 -0.432
173 HD13 ILE 21 HD13 ILE 21 -1.053 -4.754 -0.812
174 H SER 22 HN SER 22 -1.796 -3.569 0.814
175 HA SER 22 HA SER 22 -3.221 -3.468 2.583
176 HB2 SER 22 HB2 SER 22 -1.467 -4.767 3.719
177 HB3 SER 22 HB3 SER 22 -0.669 -3.270 4.202
178 HG SER 22 HG SER 22 -2.795 -4.540 5.322
179 H SER 23 HN SER 23 -1.797 -0.957 1.380
180 HA SER 23 HA SER 23 -2.786 0.927 3.421
181 HB2 SER 23 HB2 SER 23 -0.364 1.129 3.152
182 HB3 SER 23 HB3 SER 23 -0.557 1.336 1.411
183 HG SER 23 HG SER 23 -1.030 3.357 1.726
184 H SER 24 HN SER 24 -2.933 -0.157 0.164
185 HA SER 24 HA SER 24 -4.903 1.947 -0.433
186 HB2 SER 24 HB2 SER 24 -2.870 2.439 -1.691
187 HB3 SER 24 HB3 SER 24 -2.848 0.797 -2.339
188 HG SER 24 HG SER 24 -5.210 2.145 -2.743
189 H GLU 25 HN GLU 25 -4.031 -1.368 -0.452
190 HA GLU 25 HA GLU 25 -5.153 -3.279 -0.949
191 HB2 GLU 25 HB2 GLU 25 -6.911 -2.286 0.442
192 HB3 GLU 25 HB3 GLU 25 -7.559 -1.446 -0.959
193 HG2 GLU 25 HG2 GLU 25 -8.071 -3.597 -2.004
194 HG3 GLU 25 HG3 GLU 25 -7.441 -4.429 -0.585
195 H GLU 26 HN GLU 26 -4.412 -3.903 -2.900
196 HA GLU 26 HA GLU 26 -5.850 -2.906 -5.273
197 HB2 GLU 26 HB2 GLU 26 -3.821 -3.274 -6.574
198 HB3 GLU 26 HB3 GLU 26 -3.499 -2.181 -5.234
199 HG2 GLU 26 HG2 GLU 26 -2.615 -4.150 -3.963
200 HG3 GLU 26 HG3 GLU 26 -2.754 -5.085 -5.449
201 H ASN 27 HN ASN 27 -5.413 -5.512 -3.296
202 HA ASN 27 HA ASN 27 -5.565 -7.533 -5.389
203 HB2 ASN 27 HB2 ASN 27 -5.497 -9.140 -3.480
204 HB3 ASN 27 HB3 ASN 27 -4.115 -8.051 -3.531
205 HD21 ASN 27 HD21 ASN 27 -3.896 -6.467 -1.967
206 HD22 ASN 27 HD22 ASN 27 -4.804 -6.490 -0.497
207 H ASP 28 HN ASP 28 -7.735 -5.798 -5.372
208 HA ASP 28 HA ASP 28 -9.890 -7.680 -4.926
209 HB2 ASP 28 HB2 ASP 28 -9.748 -6.467 -2.776
210 HB3 ASP 28 HB3 ASP 28 -9.944 -4.943 -3.636
211 H PHE 29 HN PHE 29 -10.192 -7.691 -7.137
212 HA PHE 29 HA PHE 29 -10.817 -5.146 -8.442
213 HB2 PHE 29 HB2 PHE 29 -10.725 -7.750 -9.909
214 HB3 PHE 29 HB3 PHE 29 -10.318 -6.136 -10.482
215 HD1 PHE 29 HD2 PHE 29 -9.145 -9.027 -8.560
216 HD2 PHE 29 HD1 PHE 29 -8.121 -5.241 -10.206
217 HE1 PHE 29 HE2 PHE 29 -6.759 -9.506 -8.170
218 HE2 PHE 29 HE1 PHE 29 -5.736 -5.710 -9.821
219 HZ PHE 29 HZ PHE 29 -5.053 -7.844 -8.801
220 H TRP 30 HN TRP 30 -12.151 -8.311 -7.754
221 HA TRP 30 HA TRP 30 -14.809 -7.260 -8.431
222 HB2 TRP 30 HB2 TRP 30 -13.631 -9.950 -9.080
223 HB3 TRP 30 HB3 TRP 30 -15.373 -9.709 -8.994
224 HD1 TRP 30 HD1 TRP 30 -12.489 -9.362 -11.321
225 HE1 TRP 30 HE1 TRP 30 -13.250 -8.222 -13.503
226 HE3 TRP 30 HE3 TRP 30 -17.095 -7.742 -9.821
227 HZ2 TRP 30 HZ2 TRP 30 -15.508 -6.821 -14.459
228 HZ3 TRP 30 HZ3 TRP 30 -18.496 -6.508 -11.426
229 HH2 TRP 30 HH2 TRP 30 -17.717 -6.059 -13.696
230 H GLN 31 HN GLN 31 -14.244 -10.487 -7.214
231 HA GLN 31 HA GLN 31 -14.991 -9.668 -4.511
232 HB2 GLN 31 HB2 GLN 31 -16.480 -11.792 -6.064
233 HB3 GLN 31 HB3 GLN 31 -16.745 -11.380 -4.375
234 HG2 GLN 31 HG2 GLN 31 -17.342 -9.067 -5.134
235 HG3 GLN 31 HG3 GLN 31 -17.291 -9.673 -6.788
236 HE21 GLN 31 HE21 GLN 31 -19.460 -9.260 -7.139
237 HE22 GLN 31 HE22 GLN 31 -20.713 -10.204 -6.417
238 HA PRO 32 HA PRO 32 -11.682 -13.002 -4.802
239 HB2 PRO 32 HB2 PRO 32 -10.278 -11.211 -2.935
240 HB3 PRO 32 HB3 PRO 32 -9.697 -11.951 -4.430
241 HG2 PRO 32 HG2 PRO 32 -10.211 -9.323 -4.265
242 HG3 PRO 32 HG3 PRO 32 -10.511 -10.248 -5.748
243 HD2 PRO 32 HD2 PRO 32 -12.453 -9.329 -3.660
244 HD3 PRO 32 HD3 PRO 32 -12.622 -9.342 -5.429
245 H LYS 33 HN LYS 33 -13.044 -11.137 -2.147
246 HA LYS 33 HA LYS 33 -12.509 -13.294 -0.255
247 HB2 LYS 33 HB2 LYS 33 -13.381 -11.725 1.437
248 HB3 LYS 33 HB3 LYS 33 -12.061 -11.030 0.507
249 HG2 LYS 33 HG2 LYS 33 -13.919 -9.986 -0.942
250 HG3 LYS 33 HG3 LYS 33 -14.978 -10.376 0.413
251 HD2 LYS 33 HD2 LYS 33 -13.514 -9.094 1.910
252 HD3 LYS 33 HD3 LYS 33 -12.480 -8.691 0.537
253 HE2 LYS 33 HE2 LYS 33 -14.434 -7.601 -0.540
254 HE3 LYS 33 HE3 LYS 33 -15.364 -7.904 0.926
255 HZ1 LYS 33 HZ1 LYS 33 -14.520 -5.683 0.985
256 HZ2 LYS 33 HZ2 LYS 33 -12.941 -6.208 0.680
257 HZ3 LYS 33 HZ3 LYS 33 -13.688 -6.588 2.149
258 HA PRO 34 HA PRO 34 -16.492 -15.161 -0.389
259 HB2 PRO 34 HB2 PRO 34 -17.112 -15.397 2.289
260 HB3 PRO 34 HB3 PRO 34 -16.055 -16.501 1.403
261 HG2 PRO 34 HG2 PRO 34 -15.337 -14.196 3.167
262 HG3 PRO 34 HG3 PRO 34 -14.577 -15.793 3.043
263 HD2 PRO 34 HD2 PRO 34 -13.482 -13.631 1.896
264 HD3 PRO 34 HD3 PRO 34 -13.412 -15.227 1.118
265 H THR 35 HN THR 35 -16.023 -12.105 0.969
266 HA THR 35 HA THR 35 -18.581 -11.177 0.239
267 HB THR 35 HB THR 35 -19.531 -12.192 2.137
268 HG1 THR 35 HG1 THR 35 -20.329 -10.431 3.126
269 HG21 THR 35 HG21 THR 35 -17.222 -11.118 3.762
270 HG22 THR 35 HG22 THR 35 -17.473 -12.802 3.300
271 HG23 THR 35 HG23 THR 35 -18.599 -12.013 4.402
Start of MODEL 13
1 H1 GLU 1 H1 GLU 1 20.839 -1.621 -8.390
2 H2 GLU 1 H2 GLU 1 20.907 -1.929 -10.053
3 H3 GLU 1 H3 GLU 1 22.315 -2.010 -9.121
4 HA GLU 1 HA GLU 1 19.972 -3.801 -8.853
5 HB2 GLU 1 HB2 GLU 1 22.715 -4.304 -10.021
6 HB3 GLU 1 HB3 GLU 1 21.499 -5.540 -9.742
7 HG2 GLU 1 HG2 GLU 1 21.216 -3.188 -11.599
8 HG3 GLU 1 HG3 GLU 1 21.585 -4.845 -12.078
9 H LYS 2 HN LYS 2 23.086 -2.722 -7.691
10 HA LYS 2 HA LYS 2 23.307 -4.805 -5.714
11 HB2 LYS 2 HB2 LYS 2 25.295 -3.572 -4.955
12 HB3 LYS 2 HB3 LYS 2 25.330 -3.874 -6.687
13 HG2 LYS 2 HG2 LYS 2 24.432 -1.543 -6.994
14 HG3 LYS 2 HG3 LYS 2 24.736 -1.290 -5.276
15 HD2 LYS 2 HD2 LYS 2 26.882 -2.248 -7.151
16 HD3 LYS 2 HD3 LYS 2 26.545 -0.533 -6.915
17 HE2 LYS 2 HE2 LYS 2 28.310 -1.066 -5.438
18 HE3 LYS 2 HE3 LYS 2 26.861 -0.937 -4.443
19 HZ1 LYS 2 HZ1 LYS 2 27.912 -3.516 -5.461
20 HZ2 LYS 2 HZ2 LYS 2 26.711 -3.282 -4.292
21 HZ3 LYS 2 HZ3 LYS 2 28.317 -2.880 -3.946
22 H LEU 3 HN LEU 3 22.786 -4.728 -3.607
23 HA LEU 3 HA LEU 3 21.892 -4.049 -1.637
24 HB2 LEU 3 HB2 LEU 3 23.580 -2.267 -1.735
25 HB3 LEU 3 HB3 LEU 3 22.469 -1.264 -2.647
26 HG LEU 3 HG LEU 3 20.924 -1.282 -0.692
27 HD11 LEU 3 HD11 LEU 3 21.800 -2.003 1.478
28 HD12 LEU 3 HD12 LEU 3 21.659 -3.350 0.349
29 HD13 LEU 3 HD13 LEU 3 23.239 -2.640 0.681
30 HD21 LEU 3 HD21 LEU 3 23.713 -0.258 -0.182
31 HD22 LEU 3 HD22 LEU 3 22.435 0.584 -1.061
32 HD23 LEU 3 HD23 LEU 3 22.257 0.265 0.664
33 H LYS 4 HN LYS 4 19.861 -3.816 -0.906
34 HA LYS 4 HA LYS 4 17.869 -2.795 -2.818
35 HB2 LYS 4 HB2 LYS 4 17.358 -4.724 -0.555
36 HB3 LYS 4 HB3 LYS 4 16.292 -4.338 -1.897
37 HG2 LYS 4 HG2 LYS 4 17.108 -6.350 -2.593
38 HG3 LYS 4 HG3 LYS 4 18.290 -5.267 -3.331
39 HD2 LYS 4 HD2 LYS 4 19.505 -7.036 -2.300
40 HD3 LYS 4 HD3 LYS 4 19.722 -5.602 -1.297
41 HE2 LYS 4 HE2 LYS 4 18.001 -6.410 0.237
42 HE3 LYS 4 HE3 LYS 4 17.762 -7.836 -0.773
43 HZ1 LYS 4 HZ1 LYS 4 20.026 -8.513 -0.312
44 HZ2 LYS 4 HZ2 LYS 4 19.182 -8.295 1.138
45 HZ3 LYS 4 HZ3 LYS 4 20.288 -7.126 0.620
46 H GLN 5 HN GLN 5 16.808 -1.004 -2.284
47 HA GLN 5 HA GLN 5 17.151 0.148 0.347
48 HB2 GLN 5 HB2 GLN 5 15.542 1.219 -1.976
49 HB3 GLN 5 HB3 GLN 5 16.083 2.116 -0.564
50 HG2 GLN 5 HG2 GLN 5 17.823 0.952 -2.726
51 HG3 GLN 5 HG3 GLN 5 17.455 2.657 -2.468
52 HE21 GLN 5 HE21 GLN 5 19.238 -0.099 -1.326
53 HE22 GLN 5 HE22 GLN 5 20.293 0.766 -0.268
54 H ASP 6 HN ASP 6 15.645 0.337 1.920
55 HA ASP 6 HA ASP 6 12.855 -0.252 1.392
56 HB2 ASP 6 HB2 ASP 6 14.560 -1.986 3.186
57 HB3 ASP 6 HB3 ASP 6 12.799 -1.970 3.246
58 H ILE 7 HN ILE 7 11.477 0.671 2.858
59 HA ILE 7 HA ILE 7 12.663 2.591 4.681
60 HB ILE 7 HB ILE 7 9.706 2.162 4.347
61 HG12 ILE 7 HG12 ILE 7 11.457 3.829 2.525
62 HG13 ILE 7 HG13 ILE 7 10.775 2.266 2.089
63 HG21 ILE 7 HG21 ILE 7 9.657 4.599 4.749
64 HG22 ILE 7 HG22 ILE 7 10.399 3.709 6.078
65 HG23 ILE 7 HG23 ILE 7 11.410 4.584 4.928
66 HD11 ILE 7 HD11 ILE 7 9.480 4.098 1.158
67 HD12 ILE 7 HD12 ILE 7 8.528 3.181 2.327
68 HD13 ILE 7 HD13 ILE 7 9.211 4.742 2.776
69 H LEU 8 HN LEU 8 12.625 -0.399 5.161
70 HA LEU 8 HA LEU 8 11.270 -0.371 7.780
71 HB2 LEU 8 HB2 LEU 8 11.922 -2.692 5.960
72 HB3 LEU 8 HB3 LEU 8 11.365 -2.882 7.609
73 HG LEU 8 HG LEU 8 9.496 -3.231 6.186
74 HD11 LEU 8 HD11 LEU 8 9.030 -1.943 8.201
75 HD12 LEU 8 HD12 LEU 8 9.311 -0.444 7.315
76 HD13 LEU 8 HD13 LEU 8 7.953 -1.483 6.882
77 HD21 LEU 8 HD21 LEU 8 8.744 -1.648 4.515
78 HD22 LEU 8 HD22 LEU 8 10.083 -0.567 4.904
79 HD23 LEU 8 HD23 LEU 8 10.404 -2.143 4.182
80 H ASN 9 HN ASN 9 14.089 0.365 6.703
81 HA ASN 9 HA ASN 9 15.503 -0.439 9.044
82 HB2 ASN 9 HB2 ASN 9 17.319 -1.672 7.845
83 HB3 ASN 9 HB3 ASN 9 15.781 -2.527 7.872
84 HD21 ASN 9 HD21 ASN 9 18.104 -0.865 5.920
85 HD22 ASN 9 HD22 ASN 9 17.449 -1.317 4.386
86 H LEU 10 HN LEU 10 15.656 0.833 5.763
87 HA LEU 10 HA LEU 10 17.386 2.989 6.745
88 HB2 LEU 10 HB2 LEU 10 17.823 1.360 4.247
89 HB3 LEU 10 HB3 LEU 10 18.600 2.905 4.536
90 HG LEU 10 HG LEU 10 18.920 0.492 6.322
91 HD11 LEU 10 HD11 LEU 10 21.144 0.280 5.313
92 HD12 LEU 10 HD12 LEU 10 19.859 0.031 4.131
93 HD13 LEU 10 HD13 LEU 10 20.740 1.559 4.168
94 HD21 LEU 10 HD21 LEU 10 20.410 3.112 6.189
95 HD22 LEU 10 HD22 LEU 10 19.282 2.622 7.452
96 HD23 LEU 10 HD23 LEU 10 20.803 1.756 7.243
97 H ARG 11 HN ARG 11 15.817 4.533 6.708
98 HA ARG 11 HA ARG 11 13.960 4.830 4.563
99 HB2 ARG 11 HB2 ARG 11 14.746 6.837 6.683
100 HB3 ARG 11 HB3 ARG 11 13.316 6.913 5.664
101 HG2 ARG 11 HG2 ARG 11 12.502 4.834 6.692
102 HG3 ARG 11 HG3 ARG 11 13.919 4.822 7.744
103 HD2 ARG 11 HD2 ARG 11 13.230 7.027 8.629
104 HD3 ARG 11 HD3 ARG 11 11.774 6.941 7.639
105 HE ARG 11 HE ARG 11 11.787 4.636 9.136
106 HH11 ARG 11 HH12 ARG 11 11.787 8.060 9.782
107 HH12 ARG 11 HH11 ARG 11 10.936 7.908 11.283
108 HH21 ARG 11 HH22 ARG 11 10.666 4.426 11.111
109 HH22 ARG 11 HH21 ARG 11 10.297 5.843 12.038
110 H THR 12 HN THR 12 15.017 5.058 2.624
111 HA THR 12 HA THR 12 16.692 7.467 2.334
112 HB THR 12 HB THR 12 17.770 6.368 0.409
113 HG1 THR 12 HG1 THR 12 15.744 4.617 0.743
114 HG21 THR 12 HG21 THR 12 18.797 6.188 2.620
115 HG22 THR 12 HG22 THR 12 19.081 4.728 1.673
116 HG23 THR 12 HG23 THR 12 17.858 4.730 2.944
117 H ASP 13 HN ASP 13 14.326 5.385 0.699
118 HA ASP 13 HA ASP 13 13.832 7.348 -1.358
119 HB2 ASP 13 HB2 ASP 13 12.537 4.703 -0.690
120 HB3 ASP 13 HB3 ASP 13 11.987 5.732 -2.008
121 H ILE 14 HN ILE 14 12.932 9.181 -0.587
122 HA ILE 14 HA ILE 14 10.744 9.045 1.320
123 HB ILE 14 HB ILE 14 10.855 11.568 1.173
124 HG12 ILE 14 HG12 ILE 14 13.460 11.024 -0.265
125 HG13 ILE 14 HG13 ILE 14 11.996 11.570 -1.079
126 HG21 ILE 14 HG21 ILE 14 13.332 10.072 2.018
127 HG22 ILE 14 HG22 ILE 14 12.881 11.693 2.548
128 HG23 ILE 14 HG23 ILE 14 11.877 10.310 2.984
129 HD11 ILE 14 HD11 ILE 14 13.462 13.062 1.085
130 HD12 ILE 14 HD12 ILE 14 13.526 13.409 -0.644
131 HD13 ILE 14 HD13 ILE 14 12.015 13.611 0.242
132 H SER 15 HN SER 15 8.708 8.973 0.724
133 HA SER 15 HA SER 15 7.961 9.538 -2.028
134 HB2 SER 15 HB2 SER 15 6.327 8.435 0.270
135 HB3 SER 15 HB3 SER 15 5.785 8.556 -1.403
136 HG SER 15 HG SER 15 6.545 6.522 -1.222
137 H THR 16 HN THR 16 7.004 11.352 -2.680
138 HA THR 16 HA THR 16 6.246 13.334 -0.671
139 HB THR 16 HB THR 16 6.160 14.926 -2.558
140 HG1 THR 16 HG1 THR 16 7.179 13.962 -4.572
141 HG21 THR 16 HG21 THR 16 8.267 14.598 -1.349
142 HG22 THR 16 HG22 THR 16 8.557 14.956 -3.052
143 HG23 THR 16 HG23 THR 16 8.704 13.300 -2.461
144 H SER 17 HN SER 17 4.227 12.941 0.039
145 HA SER 17 HA SER 17 1.969 12.695 0.073
146 HB2 SER 17 HB2 SER 17 2.202 14.084 -2.605
147 HB3 SER 17 HB3 SER 17 0.699 13.867 -1.711
148 HG SER 17 HG SER 17 1.502 15.880 -1.217
149 H SEP 18 HN SER 18 2.166 10.398 -0.021
150 HA SEP 18 HA SER 18 0.775 9.262 -2.283
151 HB2 SEP 18 HB2 SER 18 3.544 8.267 -1.565
152 HB3 SEP 18 HB3 SER 18 2.460 7.534 -2.746
153 H SER 19 HN SER 19 -0.692 7.930 -1.471
154 HA SER 19 HA SER 19 -0.056 6.475 1.012
155 HB2 SER 19 HB2 SER 19 -2.743 7.621 0.231
156 HB3 SER 19 HB3 SER 19 -2.388 6.712 1.699
157 HG SER 19 HG SER 19 -0.866 8.404 2.210
158 H SER 20 HN SER 20 -0.701 4.359 1.158
159 HA SER 20 HA SER 20 -1.004 2.921 -1.258
160 HB2 SER 20 HB2 SER 20 0.069 1.939 0.722
161 HB3 SER 20 HB3 SER 20 -1.465 2.002 1.591
162 HG SER 20 HG SER 20 -0.922 0.505 -0.759
163 H ILE 21 HN ILE 21 -2.769 2.802 -2.453
164 HA ILE 21 HA ILE 21 -5.393 2.927 -1.124
165 HB ILE 21 HB ILE 21 -4.997 4.792 -2.656
166 HG12 ILE 21 HG12 ILE 21 -7.003 2.825 -3.784
167 HG13 ILE 21 HG13 ILE 21 -7.281 3.856 -2.384
168 HG21 ILE 21 HG21 ILE 21 -3.410 3.729 -4.156
169 HG22 ILE 21 HG22 ILE 21 -4.676 2.665 -4.771
170 HG23 ILE 21 HG23 ILE 21 -4.761 4.402 -5.068
171 HD11 ILE 21 HD11 ILE 21 -7.062 5.830 -3.783
172 HD12 ILE 21 HD12 ILE 21 -6.743 4.814 -5.188
173 HD13 ILE 21 HD13 ILE 21 -8.319 4.755 -4.395
174 H SER 22 HN SER 22 -6.986 1.458 -1.680
175 HA SER 22 HA SER 22 -7.881 -0.535 -2.297
176 HB2 SER 22 HB2 SER 22 -5.939 -0.329 -4.612
177 HB3 SER 22 HB3 SER 22 -7.316 -1.428 -4.519
178 HG SER 22 HG SER 22 -8.615 0.164 -4.997
179 H SER 23 HN SER 23 -7.366 -1.979 -0.766
180 HA SER 23 HA SER 23 -5.049 -3.689 -1.250
181 HB2 SER 23 HB2 SER 23 -4.269 -2.019 0.377
182 HB3 SER 23 HB3 SER 23 -5.628 -2.404 1.432
183 HG SER 23 HG SER 23 -3.753 -3.514 2.076
184 H SER 24 HN SER 24 -5.480 -5.792 -0.925
185 HA SER 24 HA SER 24 -8.137 -6.495 0.062
186 HB2 SER 24 HB2 SER 24 -7.662 -8.720 -0.917
187 HB3 SER 24 HB3 SER 24 -7.486 -7.423 -2.099
188 HG SER 24 HG SER 24 -5.180 -7.511 -1.546
189 H GLU 25 HN GLU 25 -7.736 -9.088 0.897
190 HA GLU 25 HA GLU 25 -6.001 -8.754 3.254
191 HB2 GLU 25 HB2 GLU 25 -8.411 -8.626 3.809
192 HB3 GLU 25 HB3 GLU 25 -8.636 -10.229 3.123
193 HG2 GLU 25 HG2 GLU 25 -8.515 -10.363 5.525
194 HG3 GLU 25 HG3 GLU 25 -7.115 -11.155 4.804
195 H GLU 26 HN GLU 26 -7.339 -11.000 0.884
196 HA GLU 26 HA GLU 26 -5.889 -13.265 1.860
197 HB2 GLU 26 HB2 GLU 26 -7.998 -13.491 0.605
198 HB3 GLU 26 HB3 GLU 26 -7.218 -12.820 -0.820
199 HG2 GLU 26 HG2 GLU 26 -7.385 -15.227 -0.987
200 HG3 GLU 26 HG3 GLU 26 -5.697 -14.729 -0.889
201 H ASN 27 HN ASN 27 -5.018 -10.554 0.089
202 HA ASN 27 HA ASN 27 -2.447 -11.758 -0.583
203 HB2 ASN 27 HB2 ASN 27 -4.249 -10.378 -2.574
204 HB3 ASN 27 HB3 ASN 27 -2.523 -10.605 -2.841
205 HD21 ASN 27 HD21 ASN 27 -1.734 -12.630 -3.297
206 HD22 ASN 27 HD22 ASN 27 -2.756 -13.971 -3.678
207 H ASP 28 HN ASP 28 -1.096 -10.538 0.569
208 HA ASP 28 HA ASP 28 -0.802 -7.759 -0.013
209 HB2 ASP 28 HB2 ASP 28 -1.182 -6.935 2.292
210 HB3 ASP 28 HB3 ASP 28 -2.653 -7.546 1.542
211 H PHE 29 HN PHE 29 1.310 -7.412 0.005
212 HA PHE 29 HA PHE 29 3.004 -8.078 2.166
213 HB2 PHE 29 HB2 PHE 29 2.624 -10.323 0.905
214 HB3 PHE 29 HB3 PHE 29 3.710 -9.638 -0.299
215 HD1 PHE 29 HD1 PHE 29 6.029 -8.986 0.390
216 HD2 PHE 29 HD2 PHE 29 3.447 -11.246 2.900
217 HE1 PHE 29 HE1 PHE 29 7.967 -9.716 1.717
218 HE2 PHE 29 HE2 PHE 29 5.378 -11.984 4.234
219 HZ PHE 29 HZ PHE 29 7.636 -11.222 3.649
220 H TRP 30 HN TRP 30 2.619 -7.192 -1.177
221 HA TRP 30 HA TRP 30 4.831 -5.279 -0.887
222 HB2 TRP 30 HB2 TRP 30 4.356 -7.201 -3.153
223 HB3 TRP 30 HB3 TRP 30 5.240 -5.701 -3.403
224 HD1 TRP 30 HD1 TRP 30 5.732 -9.215 -2.337
225 HE1 TRP 30 HE1 TRP 30 8.125 -9.546 -1.442
226 HE3 TRP 30 HE3 TRP 30 7.115 -4.319 -1.906
227 HZ2 TRP 30 HZ2 TRP 30 10.312 -7.939 -0.657
228 HZ3 TRP 30 HZ3 TRP 30 9.373 -3.796 -1.074
229 HH2 TRP 30 HH2 TRP 30 10.936 -5.571 -0.463
230 H GLN 31 HN GLN 31 3.021 -5.848 -3.824
231 HA GLN 31 HA GLN 31 1.285 -3.562 -3.308
232 HB2 GLN 31 HB2 GLN 31 3.164 -3.749 -5.669
233 HB3 GLN 31 HB3 GLN 31 1.856 -2.586 -5.535
234 HG2 GLN 31 HG2 GLN 31 2.906 -1.630 -3.548
235 HG3 GLN 31 HG3 GLN 31 4.219 -2.797 -3.685
236 HE21 GLN 31 HE21 GLN 31 4.287 0.122 -3.764
237 HE22 GLN 31 HE22 GLN 31 5.021 0.541 -5.269
238 HA PRO 32 HA PRO 32 -0.644 -7.234 -5.544
239 HB2 PRO 32 HB2 PRO 32 -2.736 -6.843 -3.504
240 HB3 PRO 32 HB3 PRO 32 -1.903 -8.323 -3.989
241 HG2 PRO 32 HG2 PRO 32 -1.416 -7.152 -1.629
242 HG3 PRO 32 HG3 PRO 32 -0.138 -7.962 -2.552
243 HD2 PRO 32 HD2 PRO 32 -0.728 -5.036 -2.296
244 HD3 PRO 32 HD3 PRO 32 0.839 -5.874 -2.297
245 H LYS 33 HN LYS 33 -2.273 -7.086 -7.031
246 HA LYS 33 HA LYS 33 -3.407 -4.443 -7.434
247 HB2 LYS 33 HB2 LYS 33 -3.309 -6.942 -9.111
248 HB3 LYS 33 HB3 LYS 33 -4.298 -5.564 -9.565
249 HG2 LYS 33 HG2 LYS 33 -2.235 -5.444 -10.756
250 HG3 LYS 33 HG3 LYS 33 -2.253 -4.158 -9.549
251 HD2 LYS 33 HD2 LYS 33 -0.781 -5.372 -8.121
252 HD3 LYS 33 HD3 LYS 33 -0.925 -6.826 -9.112
253 HE2 LYS 33 HE2 LYS 33 0.212 -5.732 -10.944
254 HE3 LYS 33 HE3 LYS 33 0.268 -4.218 -10.044
255 HZ1 LYS 33 HZ1 LYS 33 2.374 -5.447 -9.978
256 HZ2 LYS 33 HZ2 LYS 33 1.599 -6.736 -9.204
257 HZ3 LYS 33 HZ3 LYS 33 1.715 -5.235 -8.434
258 HA PRO 34 HA PRO 34 -7.416 -5.483 -5.890
259 HB2 PRO 34 HB2 PRO 34 -8.991 -3.791 -7.269
260 HB3 PRO 34 HB3 PRO 34 -7.847 -3.218 -6.047
261 HG2 PRO 34 HG2 PRO 34 -7.565 -3.269 -9.029
262 HG3 PRO 34 HG3 PRO 34 -7.147 -1.977 -7.888
263 HD2 PRO 34 HD2 PRO 34 -5.312 -3.702 -8.922
264 HD3 PRO 34 HD3 PRO 34 -5.146 -2.952 -7.322
265 H THR 35 HN THR 35 -6.336 -6.658 -8.638
266 HA THR 35 HA THR 35 -7.150 -7.815 -10.452
267 HB THR 35 HB THR 35 -7.019 -9.585 -8.904
268 HG1 THR 35 HG1 THR 35 -9.257 -10.640 -9.386
269 HG21 THR 35 HG21 THR 35 -8.755 -10.113 -7.261
270 HG22 THR 35 HG22 THR 35 -9.667 -8.688 -7.758
271 HG23 THR 35 HG23 THR 35 -8.091 -8.502 -6.988
Start of MODEL 14
1 H1 GLU 1 H1 GLU 1 19.335 10.596 9.617
2 H2 GLU 1 H2 GLU 1 19.135 12.259 9.859
3 H3 GLU 1 H3 GLU 1 20.083 11.357 10.932
4 HA GLU 1 HA GLU 1 21.520 12.592 9.514
5 HB2 GLU 1 HB2 GLU 1 21.387 9.645 8.860
6 HB3 GLU 1 HB3 GLU 1 22.726 10.680 8.386
7 HG2 GLU 1 HG2 GLU 1 23.392 9.557 10.347
8 HG3 GLU 1 HG3 GLU 1 23.042 11.219 10.813
9 H LYS 2 HN LYS 2 22.491 12.574 7.228
10 HA LYS 2 HA LYS 2 20.324 12.539 5.233
11 HB2 LYS 2 HB2 LYS 2 22.503 14.614 5.532
12 HB3 LYS 2 HB3 LYS 2 21.350 14.549 4.208
13 HG2 LYS 2 HG2 LYS 2 20.562 14.859 7.094
14 HG3 LYS 2 HG3 LYS 2 20.817 16.210 5.990
15 HD2 LYS 2 HD2 LYS 2 18.833 13.979 5.549
16 HD3 LYS 2 HD3 LYS 2 18.432 15.560 6.223
17 HE2 LYS 2 HE2 LYS 2 19.525 14.984 3.472
18 HE3 LYS 2 HE3 LYS 2 17.897 15.529 3.868
19 HZ1 LYS 2 HZ1 LYS 2 20.400 17.069 4.306
20 HZ2 LYS 2 HZ2 LYS 2 18.845 17.593 4.719
21 HZ3 LYS 2 HZ3 LYS 2 19.253 17.359 3.095
22 H LEU 3 HN LEU 3 23.189 11.213 6.115
23 HA LEU 3 HA LEU 3 24.231 10.964 3.412
24 HB2 LEU 3 HB2 LEU 3 25.362 10.315 6.114
25 HB3 LEU 3 HB3 LEU 3 26.105 9.720 4.645
26 HG LEU 3 HG LEU 3 27.274 11.690 5.404
27 HD11 LEU 3 HD11 LEU 3 27.092 11.369 2.997
28 HD12 LEU 3 HD12 LEU 3 25.595 12.301 2.976
29 HD13 LEU 3 HD13 LEU 3 27.115 13.084 3.410
30 HD21 LEU 3 HD21 LEU 3 26.185 13.864 5.565
31 HD22 LEU 3 HD22 LEU 3 24.628 13.122 5.195
32 HD23 LEU 3 HD23 LEU 3 25.466 12.712 6.692
33 H LYS 4 HN LYS 4 21.781 9.671 4.213
34 HA LYS 4 HA LYS 4 22.308 6.878 4.589
35 HB2 LYS 4 HB2 LYS 4 19.760 8.220 3.671
36 HB3 LYS 4 HB3 LYS 4 19.912 6.587 4.306
37 HG2 LYS 4 HG2 LYS 4 20.429 7.382 6.478
38 HG3 LYS 4 HG3 LYS 4 20.636 9.034 5.893
39 HD2 LYS 4 HD2 LYS 4 18.514 8.919 6.970
40 HD3 LYS 4 HD3 LYS 4 18.224 9.009 5.232
41 HE2 LYS 4 HE2 LYS 4 16.771 7.356 6.310
42 HE3 LYS 4 HE3 LYS 4 17.862 6.608 5.144
43 HZ1 LYS 4 HZ1 LYS 4 19.303 5.963 6.990
44 HZ2 LYS 4 HZ2 LYS 4 17.753 5.309 7.160
45 HZ3 LYS 4 HZ3 LYS 4 18.215 6.641 8.094
46 H GLN 5 HN GLN 5 21.168 8.851 1.862
47 HA GLN 5 HA GLN 5 22.355 6.917 0.020
48 HB2 GLN 5 HB2 GLN 5 20.336 6.943 -1.405
49 HB3 GLN 5 HB3 GLN 5 20.037 6.215 0.168
50 HG2 GLN 5 HG2 GLN 5 18.966 8.241 0.937
51 HG3 GLN 5 HG3 GLN 5 19.335 9.042 -0.589
52 HE21 GLN 5 HE21 GLN 5 17.375 6.641 0.993
53 HE22 GLN 5 HE22 GLN 5 16.204 6.478 -0.266
54 H ASP 6 HN ASP 6 21.390 8.057 -2.338
55 HA ASP 6 HA ASP 6 21.818 9.713 -3.832
56 HB2 ASP 6 HB2 ASP 6 20.284 10.989 -2.323
57 HB3 ASP 6 HB3 ASP 6 21.696 11.578 -1.451
58 H ILE 7 HN ILE 7 23.964 8.600 -1.772
59 HA ILE 7 HA ILE 7 26.035 10.547 -1.790
60 HB ILE 7 HB ILE 7 26.355 7.558 -1.507
61 HG12 ILE 7 HG12 ILE 7 25.888 9.625 0.653
62 HG13 ILE 7 HG13 ILE 7 24.682 8.479 0.082
63 HG21 ILE 7 HG21 ILE 7 28.073 9.849 -0.562
64 HG22 ILE 7 HG22 ILE 7 28.379 8.139 -0.267
65 HG23 ILE 7 HG23 ILE 7 28.434 8.773 -1.911
66 HD11 ILE 7 HD11 ILE 7 27.215 7.900 1.579
67 HD12 ILE 7 HD12 ILE 7 25.555 7.613 2.093
68 HD13 ILE 7 HD13 ILE 7 26.254 6.649 0.793
69 H LEU 8 HN LEU 8 25.474 7.611 -3.684
70 HA LEU 8 HA LEU 8 27.065 8.771 -5.862
71 HB2 LEU 8 HB2 LEU 8 27.247 5.927 -4.855
72 HB3 LEU 8 HB3 LEU 8 28.011 6.521 -6.317
73 HG LEU 8 HG LEU 8 28.630 7.524 -3.536
74 HD11 LEU 8 HD11 LEU 8 30.153 5.610 -5.298
75 HD12 LEU 8 HD12 LEU 8 30.730 6.286 -3.775
76 HD13 LEU 8 HD13 LEU 8 29.330 5.212 -3.791
77 HD21 LEU 8 HD21 LEU 8 29.031 9.188 -5.261
78 HD22 LEU 8 HD22 LEU 8 30.558 8.576 -4.625
79 HD23 LEU 8 HD23 LEU 8 29.970 8.021 -6.192
80 H ASN 9 HN ASN 9 24.183 8.501 -5.291
81 HA ASN 9 HA ASN 9 22.251 8.027 -6.383
82 HB2 ASN 9 HB2 ASN 9 23.563 8.951 -8.324
83 HB3 ASN 9 HB3 ASN 9 23.991 7.295 -8.745
84 HD21 ASN 9 HD21 ASN 9 20.893 8.242 -7.432
85 HD22 ASN 9 HD22 ASN 9 19.975 7.920 -8.859
86 H LEU 10 HN LEU 10 23.941 5.919 -5.035
87 HA LEU 10 HA LEU 10 22.681 3.555 -6.270
88 HB2 LEU 10 HB2 LEU 10 25.289 3.827 -6.106
89 HB3 LEU 10 HB3 LEU 10 25.039 3.353 -4.438
90 HG LEU 10 HG LEU 10 25.684 1.446 -5.809
91 HD11 LEU 10 HD11 LEU 10 23.871 -0.081 -5.220
92 HD12 LEU 10 HD12 LEU 10 24.230 1.038 -3.903
93 HD13 LEU 10 HD13 LEU 10 22.809 1.293 -4.918
94 HD21 LEU 10 HD21 LEU 10 24.772 2.254 -7.944
95 HD22 LEU 10 HD22 LEU 10 24.266 0.603 -7.581
96 HD23 LEU 10 HD23 LEU 10 23.140 1.941 -7.351
97 H ARG 11 HN ARG 11 20.867 3.193 -5.143
98 HA ARG 11 HA ARG 11 20.376 3.899 -2.490
99 HB2 ARG 11 HB2 ARG 11 19.123 1.673 -4.106
100 HB3 ARG 11 HB3 ARG 11 18.468 2.334 -2.615
101 HG2 ARG 11 HG2 ARG 11 18.227 4.518 -3.707
102 HG3 ARG 11 HG3 ARG 11 18.852 3.820 -5.203
103 HD2 ARG 11 HD2 ARG 11 16.976 2.258 -5.264
104 HD3 ARG 11 HD3 ARG 11 16.357 2.932 -3.758
105 HE ARG 11 HE ARG 11 16.647 4.989 -5.658
106 HH11 ARG 11 HH12 ARG 11 14.668 2.201 -4.978
107 HH12 ARG 11 HH11 ARG 11 13.272 2.836 -5.783
108 HH21 ARG 11 HH22 ARG 11 14.814 5.832 -6.715
109 HH22 ARG 11 HH21 ARG 11 13.355 4.901 -6.771
110 H THR 12 HN THR 12 21.282 3.179 -0.694
111 HA THR 12 HA THR 12 22.537 0.534 -0.669
112 HB THR 12 HB THR 12 22.758 2.760 1.368
113 HG1 THR 12 HG1 THR 12 24.949 2.836 0.342
114 HG21 THR 12 HG21 THR 12 23.211 0.519 2.278
115 HG22 THR 12 HG22 THR 12 24.670 1.508 2.218
116 HG23 THR 12 HG23 THR 12 24.405 0.252 1.008
117 H ASP 13 HN ASP 13 20.292 2.506 1.258
118 HA ASP 13 HA ASP 13 19.684 0.381 3.071
119 HB2 ASP 13 HB2 ASP 13 17.863 1.923 3.840
120 HB3 ASP 13 HB3 ASP 13 19.472 2.639 3.860
121 H ILE 14 HN ILE 14 18.734 -1.387 2.293
122 HA ILE 14 HA ILE 14 16.192 -1.058 0.858
123 HB ILE 14 HB ILE 14 18.350 -3.046 0.134
124 HG12 ILE 14 HG12 ILE 14 17.139 -0.786 -1.477
125 HG13 ILE 14 HG13 ILE 14 18.711 -0.725 -0.685
126 HG21 ILE 14 HG21 ILE 14 16.172 -4.082 -0.040
127 HG22 ILE 14 HG22 ILE 14 15.561 -2.711 -0.966
128 HG23 ILE 14 HG23 ILE 14 16.804 -3.756 -1.653
129 HD11 ILE 14 HD11 ILE 14 19.491 -2.558 -2.097
130 HD12 ILE 14 HD12 ILE 14 17.917 -2.607 -2.895
131 HD13 ILE 14 HD13 ILE 14 18.942 -1.181 -3.053
132 H SER 15 HN SER 15 14.858 -1.634 2.492
133 HA SER 15 HA SER 15 15.299 -4.275 3.727
134 HB2 SER 15 HB2 SER 15 13.872 -1.878 4.906
135 HB3 SER 15 HB3 SER 15 14.060 -3.447 5.687
136 HG SER 15 HG SER 15 16.467 -2.754 5.006
137 H THR 16 HN THR 16 13.645 -2.959 1.361
138 HA THR 16 HA THR 16 11.631 -3.241 0.342
139 HB THR 16 HB THR 16 10.730 -5.530 0.364
140 HG1 THR 16 HG1 THR 16 12.348 -6.946 1.734
141 HG21 THR 16 HG21 THR 16 12.650 -5.017 -1.062
142 HG22 THR 16 HG22 THR 16 12.734 -6.674 -0.465
143 HG23 THR 16 HG23 THR 16 13.747 -5.425 0.258
144 H SER 17 HN SER 17 10.424 -1.677 1.426
145 HA SER 17 HA SER 17 8.493 -2.775 3.358
146 HB2 SER 17 HB2 SER 17 9.770 -0.028 3.466
147 HB3 SER 17 HB3 SER 17 8.497 -0.608 4.541
148 HG SER 17 HG SER 17 11.200 -1.191 4.511
149 H SEP 18 HN SER 18 6.414 -2.403 2.894
150 HA SEP 18 HA SER 18 5.809 -0.840 0.505
151 HB2 SEP 18 HB2 SER 18 4.101 -2.731 2.138
152 HB3 SEP 18 HB3 SER 18 3.562 -1.901 0.680
153 H SER 19 HN SER 19 3.529 0.257 0.639
154 HA SER 19 HA SER 19 2.796 1.427 3.137
155 HB2 SER 19 HB2 SER 19 3.378 3.761 2.577
156 HB3 SER 19 HB3 SER 19 4.816 2.749 2.722
157 HG SER 19 HG SER 19 4.026 2.638 0.203
158 H SER 20 HN SER 20 2.124 0.421 0.137
159 HA SER 20 HA SER 20 0.136 2.362 -0.626
160 HB2 SER 20 HB2 SER 20 -0.380 0.781 -2.448
161 HB3 SER 20 HB3 SER 20 1.352 1.101 -2.344
162 HG SER 20 HG SER 20 -0.018 -1.172 -1.334
163 H ILE 21 HN ILE 21 -2.130 1.597 -1.104
164 HA ILE 21 HA ILE 21 -3.124 -0.427 0.746
165 HB ILE 21 HB ILE 21 -3.192 1.660 2.041
166 HG12 ILE 21 HG12 ILE 21 -5.949 0.763 1.165
167 HG13 ILE 21 HG13 ILE 21 -4.942 -0.081 2.339
168 HG21 ILE 21 HG21 ILE 21 -3.350 3.237 0.193
169 HG22 ILE 21 HG22 ILE 21 -4.979 2.668 -0.171
170 HG23 ILE 21 HG23 ILE 21 -4.654 3.500 1.351
171 HD11 ILE 21 HD11 ILE 21 -6.612 1.225 3.475
172 HD12 ILE 21 HD12 ILE 21 -5.018 1.913 3.786
173 HD13 ILE 21 HD13 ILE 21 -6.100 2.684 2.625
174 H SER 22 HN SER 22 -4.974 -1.426 0.058
175 HA SER 22 HA SER 22 -6.542 -2.164 -1.415
176 HB2 SER 22 HB2 SER 22 -6.842 0.801 -1.958
177 HB3 SER 22 HB3 SER 22 -7.992 -0.442 -2.451
178 HG SER 22 HG SER 22 -7.741 -0.903 0.037
179 H SER 23 HN SER 23 -7.344 -1.364 -3.922
180 HA SER 23 HA SER 23 -4.965 -1.047 -5.565
181 HB2 SER 23 HB2 SER 23 -5.083 -3.473 -5.213
182 HB3 SER 23 HB3 SER 23 -6.752 -3.482 -5.782
183 HG SER 23 HG SER 23 -4.380 -3.227 -7.212
184 H SER 24 HN SER 24 -8.043 -0.251 -4.906
185 HA SER 24 HA SER 24 -9.706 0.846 -5.999
186 HB2 SER 24 HB2 SER 24 -7.539 1.331 -8.059
187 HB3 SER 24 HB3 SER 24 -9.069 2.204 -7.955
188 HG SER 24 HG SER 24 -7.766 3.474 -6.813
189 H GLU 25 HN GLU 25 -10.524 1.097 -8.553
190 HA GLU 25 HA GLU 25 -11.669 0.050 -10.207
191 HB2 GLU 25 HB2 GLU 25 -9.442 -0.588 -10.990
192 HB3 GLU 25 HB3 GLU 25 -9.464 -2.001 -9.944
193 HG2 GLU 25 HG2 GLU 25 -11.275 -2.965 -11.205
194 HG3 GLU 25 HG3 GLU 25 -11.394 -1.514 -12.199
195 H GLU 26 HN GLU 26 -10.525 -2.963 -8.760
196 HA GLU 26 HA GLU 26 -13.308 -3.733 -8.300
197 HB2 GLU 26 HB2 GLU 26 -11.942 -5.277 -9.604
198 HB3 GLU 26 HB3 GLU 26 -10.767 -5.372 -8.299
199 HG2 GLU 26 HG2 GLU 26 -12.371 -6.460 -6.873
200 HG3 GLU 26 HG3 GLU 26 -13.633 -6.262 -8.087
201 H ASN 27 HN ASN 27 -14.109 -4.301 -6.319
202 HA ASN 27 HA ASN 27 -12.674 -3.296 -4.021
203 HB2 ASN 27 HB2 ASN 27 -14.754 -3.786 -2.795
204 HB3 ASN 27 HB3 ASN 27 -15.060 -2.831 -4.242
205 HD21 ASN 27 HD21 ASN 27 -15.441 -5.911 -2.704
206 HD22 ASN 27 HD22 ASN 27 -16.581 -6.562 -3.827
207 H ASP 28 HN ASP 28 -11.632 -4.454 -2.518
208 HA ASP 28 HA ASP 28 -12.208 -7.146 -1.860
209 HB2 ASP 28 HB2 ASP 28 -11.177 -7.623 -4.024
210 HB3 ASP 28 HB3 ASP 28 -9.751 -6.696 -3.570
211 H PHE 29 HN PHE 29 -11.803 -7.086 0.248
212 HA PHE 29 HA PHE 29 -9.187 -6.292 1.186
213 HB2 PHE 29 HB2 PHE 29 -10.385 -4.163 1.208
214 HB3 PHE 29 HB3 PHE 29 -11.679 -4.887 2.160
215 HD1 PHE 29 HD1 PHE 29 -8.006 -4.275 2.265
216 HD2 PHE 29 HD2 PHE 29 -11.633 -4.695 4.452
217 HE1 PHE 29 HE1 PHE 29 -6.826 -3.660 4.334
218 HE2 PHE 29 HE2 PHE 29 -10.460 -4.080 6.524
219 HZ PHE 29 HZ PHE 29 -8.052 -3.562 6.468
220 H TRP 30 HN TRP 30 -12.380 -7.533 1.882
221 HA TRP 30 HA TRP 30 -11.349 -8.883 4.272
222 HB2 TRP 30 HB2 TRP 30 -14.126 -8.218 3.336
223 HB3 TRP 30 HB3 TRP 30 -13.861 -9.457 4.558
224 HD1 TRP 30 HD1 TRP 30 -14.190 -5.765 4.149
225 HE1 TRP 30 HE1 TRP 30 -13.767 -4.593 6.403
226 HE3 TRP 30 HE3 TRP 30 -12.279 -9.715 6.766
227 HZ2 TRP 30 HZ2 TRP 30 -12.757 -5.259 8.956
228 HZ3 TRP 30 HZ3 TRP 30 -11.609 -9.366 9.110
229 HH2 TRP 30 HH2 TRP 30 -11.843 -7.183 10.181
230 H GLN 31 HN GLN 31 -14.102 -10.147 2.567
231 HA GLN 31 HA GLN 31 -12.539 -12.266 1.326
232 HB2 GLN 31 HB2 GLN 31 -14.664 -12.806 3.408
233 HB3 GLN 31 HB3 GLN 31 -13.930 -14.030 2.383
234 HG2 GLN 31 HG2 GLN 31 -11.766 -13.613 3.382
235 HG3 GLN 31 HG3 GLN 31 -12.448 -12.312 4.359
236 HE21 GLN 31 HE21 GLN 31 -12.233 -15.746 3.897
237 HE22 GLN 31 HE22 GLN 31 -12.902 -16.201 5.423
238 HA PRO 32 HA PRO 32 -16.407 -10.763 -0.956
239 HB2 PRO 32 HB2 PRO 32 -14.453 -10.525 -3.163
240 HB3 PRO 32 HB3 PRO 32 -15.680 -9.378 -2.618
241 HG2 PRO 32 HG2 PRO 32 -13.083 -8.941 -2.165
242 HG3 PRO 32 HG3 PRO 32 -14.319 -8.491 -0.978
243 HD2 PRO 32 HD2 PRO 32 -12.481 -10.857 -0.998
244 HD3 PRO 32 HD3 PRO 32 -12.971 -9.824 0.362
245 H LYS 33 HN LYS 33 -13.750 -12.927 -1.672
246 HA LYS 33 HA LYS 33 -15.507 -14.576 -3.354
247 HB2 LYS 33 HB2 LYS 33 -12.495 -14.566 -3.057
248 HB3 LYS 33 HB3 LYS 33 -13.396 -15.669 -4.088
249 HG2 LYS 33 HG2 LYS 33 -13.906 -14.042 -5.623
250 HG3 LYS 33 HG3 LYS 33 -13.764 -12.736 -4.445
251 HD2 LYS 33 HD2 LYS 33 -11.902 -12.578 -5.932
252 HD3 LYS 33 HD3 LYS 33 -11.303 -13.170 -4.380
253 HE2 LYS 33 HE2 LYS 33 -12.052 -15.056 -6.590
254 HE3 LYS 33 HE3 LYS 33 -10.462 -14.301 -6.533
255 HZ1 LYS 33 HZ1 LYS 33 -11.667 -16.072 -4.480
256 HZ2 LYS 33 HZ2 LYS 33 -10.212 -15.235 -4.269
257 HZ3 LYS 33 HZ3 LYS 33 -10.339 -16.418 -5.473
258 HA PRO 34 HA PRO 34 -15.824 -17.785 -0.346
259 HB2 PRO 34 HB2 PRO 34 -15.236 -20.042 -1.817
260 HB3 PRO 34 HB3 PRO 34 -16.806 -19.233 -1.810
261 HG2 PRO 34 HG2 PRO 34 -14.576 -19.027 -3.789
262 HG3 PRO 34 HG3 PRO 34 -16.324 -19.094 -4.073
263 HD2 PRO 34 HD2 PRO 34 -14.964 -16.784 -4.205
264 HD3 PRO 34 HD3 PRO 34 -16.621 -16.853 -3.570
265 H THR 35 HN THR 35 -12.929 -17.151 -1.957
266 HA THR 35 HA THR 35 -11.362 -18.122 0.246
267 HB THR 35 HB THR 35 -10.869 -19.331 -2.486
268 HG1 THR 35 HG1 THR 35 -12.014 -20.969 -1.797
269 HG21 THR 35 HG21 THR 35 -9.144 -20.648 -1.330
270 HG22 THR 35 HG22 THR 35 -9.462 -19.752 0.155
271 HG23 THR 35 HG23 THR 35 -8.803 -18.919 -1.252
Start of MODEL 15
1 H1 GLU 1 H1 GLU 1 19.378 5.409 15.359
2 H2 GLU 1 H2 GLU 1 18.164 6.469 15.870
3 H3 GLU 1 H3 GLU 1 19.683 7.072 15.441
4 HA GLU 1 HA GLU 1 17.766 5.749 13.615
5 HB2 GLU 1 HB2 GLU 1 17.443 7.934 12.626
6 HB3 GLU 1 HB3 GLU 1 17.093 8.020 14.347
7 HG2 GLU 1 HG2 GLU 1 19.293 9.001 14.747
8 HG3 GLU 1 HG3 GLU 1 19.642 8.916 13.021
9 H LYS 2 HN LYS 2 18.398 5.849 11.375
10 HA LYS 2 HA LYS 2 21.206 6.393 10.820
11 HB2 LYS 2 HB2 LYS 2 21.500 4.192 9.716
12 HB3 LYS 2 HB3 LYS 2 21.266 4.064 11.454
13 HG2 LYS 2 HG2 LYS 2 18.951 3.423 11.121
14 HG3 LYS 2 HG3 LYS 2 19.136 3.613 9.376
15 HD2 LYS 2 HD2 LYS 2 20.755 1.693 11.045
16 HD3 LYS 2 HD3 LYS 2 19.279 1.250 10.187
17 HE2 LYS 2 HE2 LYS 2 20.293 1.829 8.070
18 HE3 LYS 2 HE3 LYS 2 21.743 2.405 8.890
19 HZ1 LYS 2 HZ1 LYS 2 20.758 -0.396 8.936
20 HZ2 LYS 2 HZ2 LYS 2 22.178 0.172 9.656
21 HZ3 LYS 2 HZ3 LYS 2 22.027 0.176 7.972
22 H LEU 3 HN LEU 3 21.569 5.790 8.340
23 HA LEU 3 HA LEU 3 19.240 6.252 6.714
24 HB2 LEU 3 HB2 LEU 3 19.971 8.299 5.712
25 HB3 LEU 3 HB3 LEU 3 19.901 8.520 7.449
26 HG LEU 3 HG LEU 3 22.479 7.911 6.015
27 HD11 LEU 3 HD11 LEU 3 22.950 10.307 6.085
28 HD12 LEU 3 HD12 LEU 3 21.553 9.955 5.069
29 HD13 LEU 3 HD13 LEU 3 21.321 10.612 6.690
30 HD21 LEU 3 HD21 LEU 3 22.496 7.497 8.403
31 HD22 LEU 3 HD22 LEU 3 23.462 8.923 8.030
32 HD23 LEU 3 HD23 LEU 3 21.844 9.105 8.710
33 H LYS 4 HN LYS 4 19.490 5.619 4.607
34 HA LYS 4 HA LYS 4 22.070 4.361 3.957
35 HB2 LYS 4 HB2 LYS 4 19.359 3.812 2.741
36 HB3 LYS 4 HB3 LYS 4 20.835 2.894 2.481
37 HG2 LYS 4 HG2 LYS 4 20.744 1.899 4.556
38 HG3 LYS 4 HG3 LYS 4 19.738 3.178 5.240
39 HD2 LYS 4 HD2 LYS 4 18.393 1.206 4.964
40 HD3 LYS 4 HD3 LYS 4 17.878 2.413 3.783
41 HE2 LYS 4 HE2 LYS 4 19.182 1.288 2.053
42 HE3 LYS 4 HE3 LYS 4 19.731 0.096 3.230
43 HZ1 LYS 4 HZ1 LYS 4 17.471 -0.652 3.510
44 HZ2 LYS 4 HZ2 LYS 4 17.886 -0.716 1.870
45 HZ3 LYS 4 HZ3 LYS 4 16.900 0.534 2.446
46 H GLN 5 HN GLN 5 19.900 6.850 3.069
47 HA GLN 5 HA GLN 5 20.810 7.071 0.334
48 HB2 GLN 5 HB2 GLN 5 19.436 9.221 0.425
49 HB3 GLN 5 HB3 GLN 5 18.566 7.710 0.644
50 HG2 GLN 5 HG2 GLN 5 18.605 8.061 3.075
51 HG3 GLN 5 HG3 GLN 5 19.423 9.602 2.822
52 HE21 GLN 5 HE21 GLN 5 18.282 11.329 1.959
53 HE22 GLN 5 HE22 GLN 5 16.556 11.353 1.892
54 H ASP 6 HN ASP 6 23.065 7.326 0.668
55 HA ASP 6 HA ASP 6 23.955 9.982 0.665
56 HB2 ASP 6 HB2 ASP 6 23.545 9.860 3.089
57 HB3 ASP 6 HB3 ASP 6 24.619 8.468 3.193
58 H ILE 7 HN ILE 7 24.731 6.641 1.210
59 HA ILE 7 HA ILE 7 27.307 7.006 -0.168
60 HB ILE 7 HB ILE 7 26.532 4.574 1.435
61 HG12 ILE 7 HG12 ILE 7 26.366 6.526 2.915
62 HG13 ILE 7 HG13 ILE 7 27.759 5.535 3.337
63 HG21 ILE 7 HG21 ILE 7 28.399 4.254 -0.054
64 HG22 ILE 7 HG22 ILE 7 29.181 5.711 0.554
65 HG23 ILE 7 HG23 ILE 7 28.988 4.309 1.607
66 HD11 ILE 7 HD11 ILE 7 28.274 7.912 3.438
67 HD12 ILE 7 HD12 ILE 7 29.231 7.102 2.199
68 HD13 ILE 7 HD13 ILE 7 27.841 8.084 1.738
69 H LEU 8 HN LEU 8 24.246 6.240 -0.828
70 HA LEU 8 HA LEU 8 24.998 4.550 -3.081
71 HB2 LEU 8 HB2 LEU 8 22.772 3.891 -1.153
72 HB3 LEU 8 HB3 LEU 8 23.002 3.104 -2.701
73 HG LEU 8 HG LEU 8 25.005 3.039 -0.444
74 HD11 LEU 8 HD11 LEU 8 22.962 1.860 0.167
75 HD12 LEU 8 HD12 LEU 8 23.026 0.949 -1.342
76 HD13 LEU 8 HD13 LEU 8 24.282 0.727 -0.123
77 HD21 LEU 8 HD21 LEU 8 26.031 2.775 -2.630
78 HD22 LEU 8 HD22 LEU 8 26.029 1.237 -1.767
79 HD23 LEU 8 HD23 LEU 8 24.856 1.528 -3.054
80 H ASN 9 HN ASN 9 23.161 6.997 -1.664
81 HA ASN 9 HA ASN 9 21.008 7.163 -3.503
82 HB2 ASN 9 HB2 ASN 9 20.858 8.272 -1.352
83 HB3 ASN 9 HB3 ASN 9 22.265 9.264 -1.724
84 HD21 ASN 9 HD21 ASN 9 22.069 10.956 -3.187
85 HD22 ASN 9 HD22 ASN 9 20.534 11.597 -3.650
86 H LEU 10 HN LEU 10 24.321 8.047 -3.643
87 HA LEU 10 HA LEU 10 23.887 9.781 -5.964
88 HB2 LEU 10 HB2 LEU 10 26.315 9.211 -4.271
89 HB3 LEU 10 HB3 LEU 10 26.397 10.128 -5.763
90 HG LEU 10 HG LEU 10 24.707 11.719 -4.731
91 HD11 LEU 10 HD11 LEU 10 25.467 10.180 -2.254
92 HD12 LEU 10 HD12 LEU 10 24.637 11.736 -2.263
93 HD13 LEU 10 HD13 LEU 10 23.859 10.319 -2.966
94 HD21 LEU 10 HD21 LEU 10 26.425 12.887 -3.425
95 HD22 LEU 10 HD22 LEU 10 27.424 11.433 -3.453
96 HD23 LEU 10 HD23 LEU 10 27.056 12.280 -4.956
97 H ARG 11 HN ARG 11 23.826 6.681 -5.642
98 HA ARG 11 HA ARG 11 25.413 6.160 -8.062
99 HB2 ARG 11 HB2 ARG 11 25.015 4.139 -5.863
100 HB3 ARG 11 HB3 ARG 11 26.117 4.045 -7.232
101 HG2 ARG 11 HG2 ARG 11 27.339 5.999 -6.275
102 HG3 ARG 11 HG3 ARG 11 26.316 5.865 -4.846
103 HD2 ARG 11 HD2 ARG 11 27.110 3.545 -4.540
104 HD3 ARG 11 HD3 ARG 11 28.187 3.755 -5.917
105 HE ARG 11 HE ARG 11 28.525 5.717 -3.833
106 HH11 ARG 11 HH12 ARG 11 29.480 2.583 -5.026
107 HH12 ARG 11 HH11 ARG 11 30.992 2.582 -4.182
108 HH21 ARG 11 HH22 ARG 11 30.514 5.721 -2.720
109 HH22 ARG 11 HH21 ARG 11 31.579 4.364 -2.869
110 H THR 12 HN THR 12 22.445 5.918 -6.402
111 HA THR 12 HA THR 12 21.285 4.519 -8.696
112 HB THR 12 HB THR 12 19.825 3.179 -7.152
113 HG1 THR 12 HG1 THR 12 21.017 4.661 -5.310
114 HG21 THR 12 HG21 THR 12 21.514 1.466 -6.707
115 HG22 THR 12 HG22 THR 12 22.793 2.650 -6.974
116 HG23 THR 12 HG23 THR 12 21.740 2.176 -8.305
117 H ASP 13 HN ASP 13 20.192 5.744 -5.513
118 HA ASP 13 HA ASP 13 18.495 7.138 -4.932
119 HB2 ASP 13 HB2 ASP 13 19.810 8.830 -6.069
120 HB3 ASP 13 HB3 ASP 13 19.144 8.351 -7.626
121 H ILE 14 HN ILE 14 16.807 5.690 -4.859
122 HA ILE 14 HA ILE 14 15.142 5.510 -7.283
123 HB ILE 14 HB ILE 14 15.951 3.329 -6.559
124 HG12 ILE 14 HG12 ILE 14 13.744 2.196 -6.251
125 HG13 ILE 14 HG13 ILE 14 13.008 3.778 -6.015
126 HG21 ILE 14 HG21 ILE 14 14.569 3.921 -3.947
127 HG22 ILE 14 HG22 ILE 14 15.309 2.385 -4.398
128 HG23 ILE 14 HG23 ILE 14 16.311 3.822 -4.203
129 HD11 ILE 14 HD11 ILE 14 14.396 2.828 -8.509
130 HD12 ILE 14 HD12 ILE 14 12.656 2.980 -8.275
131 HD13 ILE 14 HD13 ILE 14 13.674 4.420 -8.274
132 H SER 15 HN SER 15 15.149 6.106 -3.817
133 HA SER 15 HA SER 15 13.648 7.072 -2.410
134 HB2 SER 15 HB2 SER 15 12.603 8.274 -4.985
135 HB3 SER 15 HB3 SER 15 12.181 8.825 -3.364
136 HG SER 15 HG SER 15 14.098 9.760 -4.715
137 H THR 16 HN THR 16 12.451 5.478 -1.525
138 HA THR 16 HA THR 16 10.603 3.858 -2.858
139 HB THR 16 HB THR 16 11.459 3.152 -0.728
140 HG1 THR 16 HG1 THR 16 8.680 3.754 -0.486
141 HG21 THR 16 HG21 THR 16 11.764 5.373 0.281
142 HG22 THR 16 HG22 THR 16 10.897 4.282 1.361
143 HG23 THR 16 HG23 THR 16 10.016 5.522 0.470
144 H SER 17 HN SER 17 10.136 6.862 -1.037
145 HA SER 17 HA SER 17 8.384 8.299 -0.860
146 HB2 SER 17 HB2 SER 17 7.794 7.216 -3.623
147 HB3 SER 17 HB3 SER 17 7.045 8.651 -2.927
148 HG SER 17 HG SER 17 8.737 9.716 -3.537
149 H SEP 18 HN SER 18 7.233 7.431 0.824
150 HA SEP 18 HA SER 18 5.558 5.189 0.698
151 HB2 SEP 18 HB2 SER 18 4.559 6.070 2.794
152 HB3 SEP 18 HB3 SER 18 6.322 6.091 2.828
153 H SER 19 HN SER 19 3.301 4.989 0.550
154 HA SER 19 HA SER 19 1.776 7.310 -0.341
155 HB2 SER 19 HB2 SER 19 0.882 6.065 -2.297
156 HB3 SER 19 HB3 SER 19 2.612 6.378 -2.428
157 HG SER 19 HG SER 19 1.273 3.961 -1.910
158 H SER 20 HN SER 20 2.022 4.289 1.195
159 HA SER 20 HA SER 20 0.596 3.027 2.436
160 HB2 SER 20 HB2 SER 20 0.241 5.181 3.589
161 HB3 SER 20 HB3 SER 20 -1.068 5.558 2.468
162 HG SER 20 HG SER 20 -0.988 3.351 4.251
163 H ILE 21 HN ILE 21 0.307 2.982 -0.459
164 HA ILE 21 HA ILE 21 -2.519 2.795 -1.007
165 HB ILE 21 HB ILE 21 -1.037 3.528 -2.786
166 HG12 ILE 21 HG12 ILE 21 -2.134 0.779 -3.418
167 HG13 ILE 21 HG13 ILE 21 -3.109 2.242 -3.329
168 HG21 ILE 21 HG21 ILE 21 0.212 0.788 -2.625
169 HG22 ILE 21 HG22 ILE 21 0.603 2.047 -3.796
170 HG23 ILE 21 HG23 ILE 21 0.962 2.291 -2.087
171 HD11 ILE 21 HD11 ILE 21 -0.854 1.751 -5.260
172 HD12 ILE 21 HD12 ILE 21 -2.574 1.644 -5.628
173 HD13 ILE 21 HD13 ILE 21 -1.862 3.195 -5.186
174 H SER 22 HN SER 22 -3.772 1.042 -0.931
175 HA SER 22 HA SER 22 -4.492 -1.067 -0.507
176 HB2 SER 22 HB2 SER 22 -3.345 -1.585 -2.607
177 HB3 SER 22 HB3 SER 22 -1.832 -1.830 -1.738
178 HG SER 22 HG SER 22 -3.023 -3.784 -2.217
179 H SER 23 HN SER 23 -4.673 -1.378 1.627
180 HA SER 23 HA SER 23 -2.286 -2.313 3.077
181 HB2 SER 23 HB2 SER 23 -2.911 -0.073 3.845
182 HB3 SER 23 HB3 SER 23 -4.554 -0.628 4.166
183 HG SER 23 HG SER 23 -2.563 -0.659 5.830
184 H SER 24 HN SER 24 -5.218 -3.190 1.873
185 HA SER 24 HA SER 24 -6.105 -4.854 4.062
186 HB2 SER 24 HB2 SER 24 -7.764 -3.848 2.568
187 HB3 SER 24 HB3 SER 24 -7.054 -4.691 1.191
188 HG SER 24 HG SER 24 -8.988 -5.599 2.498
189 H GLU 25 HN GLU 25 -5.352 -6.811 4.492
190 HA GLU 25 HA GLU 25 -3.593 -8.138 2.610
191 HB2 GLU 25 HB2 GLU 25 -2.961 -8.053 4.964
192 HB3 GLU 25 HB3 GLU 25 -4.442 -8.885 5.415
193 HG2 GLU 25 HG2 GLU 25 -3.702 -10.865 4.184
194 HG3 GLU 25 HG3 GLU 25 -2.211 -10.030 3.750
195 H GLU 26 HN GLU 26 -6.689 -8.791 4.216
196 HA GLU 26 HA GLU 26 -7.074 -11.347 3.046
197 HB2 GLU 26 HB2 GLU 26 -9.119 -9.413 4.154
198 HB3 GLU 26 HB3 GLU 26 -9.406 -11.111 3.803
199 HG2 GLU 26 HG2 GLU 26 -7.477 -10.030 5.846
200 HG3 GLU 26 HG3 GLU 26 -9.055 -10.742 6.179
201 H ASN 27 HN ASN 27 -7.988 -11.964 1.175
202 HA ASN 27 HA ASN 27 -8.773 -11.872 -0.952
203 HB2 ASN 27 HB2 ASN 27 -10.213 -9.430 0.099
204 HB3 ASN 27 HB3 ASN 27 -10.548 -10.200 -1.448
205 HD21 ASN 27 HD21 ASN 27 -11.547 -12.211 -1.490
206 HD22 ASN 27 HD22 ASN 27 -12.375 -12.852 -0.117
207 H ASP 28 HN ASP 28 -7.026 -11.528 -2.210
208 HA ASP 28 HA ASP 28 -6.602 -8.811 -3.177
209 HB2 ASP 28 HB2 ASP 28 -4.993 -9.213 -1.278
210 HB3 ASP 28 HB3 ASP 28 -4.274 -10.499 -2.239
211 H PHE 29 HN PHE 29 -7.626 -11.491 -4.126
212 HA PHE 29 HA PHE 29 -6.462 -11.378 -6.730
213 HB2 PHE 29 HB2 PHE 29 -4.931 -12.866 -5.175
214 HB3 PHE 29 HB3 PHE 29 -6.167 -14.078 -5.494
215 HD1 PHE 29 HD2 PHE 29 -6.677 -14.677 -7.891
216 HD2 PHE 29 HD1 PHE 29 -3.267 -12.404 -6.752
217 HE1 PHE 29 HE2 PHE 29 -5.608 -15.214 -10.039
218 HE2 PHE 29 HE1 PHE 29 -2.190 -12.935 -8.900
219 HZ PHE 29 HZ PHE 29 -3.353 -14.332 -10.545
220 H TRP 30 HN TRP 30 -8.577 -12.928 -4.434
221 HA TRP 30 HA TRP 30 -10.547 -13.308 -6.540
222 HB2 TRP 30 HB2 TRP 30 -9.636 -15.487 -4.660
223 HB3 TRP 30 HB3 TRP 30 -11.138 -15.559 -5.576
224 HD1 TRP 30 HD1 TRP 30 -7.627 -16.532 -5.782
225 HE1 TRP 30 HE1 TRP 30 -6.994 -17.240 -8.176
226 HE3 TRP 30 HE3 TRP 30 -11.710 -14.725 -8.252
227 HZ2 TRP 30 HZ2 TRP 30 -8.089 -17.048 -10.773
228 HZ3 TRP 30 HZ3 TRP 30 -11.846 -15.023 -10.690
229 HH2 TRP 30 HH2 TRP 30 -10.071 -16.162 -11.924
230 H GLN 31 HN GLN 31 -12.540 -12.897 -5.924
231 HA GLN 31 HA GLN 31 -13.053 -12.383 -3.068
232 HB2 GLN 31 HB2 GLN 31 -14.245 -10.914 -5.426
233 HB3 GLN 31 HB3 GLN 31 -14.586 -10.597 -3.731
234 HG2 GLN 31 HG2 GLN 31 -12.217 -9.994 -3.403
235 HG3 GLN 31 HG3 GLN 31 -11.951 -10.222 -5.131
236 HE21 GLN 31 HE21 GLN 31 -11.354 -8.093 -5.454
237 HE22 GLN 31 HE22 GLN 31 -12.490 -6.793 -5.403
238 HA PRO 32 HA PRO 32 -16.050 -15.616 -4.455
239 HB2 PRO 32 HB2 PRO 32 -15.628 -16.773 -1.816
240 HB3 PRO 32 HB3 PRO 32 -15.329 -17.487 -3.400
241 HG2 PRO 32 HG2 PRO 32 -13.337 -16.791 -1.692
242 HG3 PRO 32 HG3 PRO 32 -13.152 -16.785 -3.454
243 HD2 PRO 32 HD2 PRO 32 -13.634 -14.494 -1.588
244 HD3 PRO 32 HD3 PRO 32 -12.574 -14.588 -3.010
245 H LYS 33 HN LYS 33 -18.047 -14.799 -4.326
246 HA LYS 33 HA LYS 33 -19.007 -13.768 -1.748
247 HB2 LYS 33 HB2 LYS 33 -20.730 -12.613 -3.049
248 HB3 LYS 33 HB3 LYS 33 -19.123 -12.211 -3.638
249 HG2 LYS 33 HG2 LYS 33 -19.547 -14.122 -5.340
250 HG3 LYS 33 HG3 LYS 33 -21.243 -13.879 -4.915
251 HD2 LYS 33 HD2 LYS 33 -20.987 -11.476 -5.474
252 HD3 LYS 33 HD3 LYS 33 -19.337 -11.812 -6.007
253 HE2 LYS 33 HE2 LYS 33 -20.866 -11.747 -7.904
254 HE3 LYS 33 HE3 LYS 33 -20.194 -13.364 -7.689
255 HZ1 LYS 33 HZ1 LYS 33 -22.569 -13.426 -8.147
256 HZ2 LYS 33 HZ2 LYS 33 -22.881 -12.484 -6.779
257 HZ3 LYS 33 HZ3 LYS 33 -22.237 -14.038 -6.605
258 HA PRO 34 HA PRO 34 -21.806 -17.093 -1.034
259 HB2 PRO 34 HB2 PRO 34 -24.158 -15.734 -0.487
260 HB3 PRO 34 HB3 PRO 34 -22.871 -16.046 0.681
261 HG2 PRO 34 HG2 PRO 34 -23.429 -13.583 -0.916
262 HG3 PRO 34 HG3 PRO 34 -22.893 -13.733 0.769
263 HD2 PRO 34 HD2 PRO 34 -21.180 -13.075 -1.182
264 HD3 PRO 34 HD3 PRO 34 -20.685 -14.126 0.162
265 H THR 35 HN THR 35 -22.284 -18.265 -2.786
266 HA THR 35 HA THR 35 -23.464 -17.285 -5.144
267 HB THR 35 HB THR 35 -23.771 -19.644 -5.780
268 HG1 THR 35 HG1 THR 35 -22.725 -20.320 -3.224
269 HG21 THR 35 HG21 THR 35 -21.423 -20.321 -5.673
270 HG22 THR 35 HG22 THR 35 -21.126 -19.118 -4.420
271 HG23 THR 35 HG23 THR 35 -21.564 -18.603 -6.047
Start of MODEL 16
1 H1 GLU 1 H1 GLU 1 20.530 -3.727 -9.537
2 H2 GLU 1 H2 GLU 1 19.431 -3.916 -8.268
3 H3 GLU 1 H3 GLU 1 20.507 -5.164 -8.644
4 HA GLU 1 HA GLU 1 21.203 -3.980 -6.665
5 HB2 GLU 1 HB2 GLU 1 23.011 -3.451 -9.031
6 HB3 GLU 1 HB3 GLU 1 23.506 -3.565 -7.348
7 HG2 GLU 1 HG2 GLU 1 22.782 -5.915 -7.320
8 HG3 GLU 1 HG3 GLU 1 22.365 -5.787 -9.026
9 H LYS 2 HN LYS 2 21.013 -2.139 -5.577
10 HA LYS 2 HA LYS 2 21.343 0.405 -6.983
11 HB2 LYS 2 HB2 LYS 2 19.336 1.333 -5.891
12 HB3 LYS 2 HB3 LYS 2 18.950 0.019 -6.994
13 HG2 LYS 2 HG2 LYS 2 18.646 -1.504 -5.170
14 HG3 LYS 2 HG3 LYS 2 19.218 -0.300 -4.016
15 HD2 LYS 2 HD2 LYS 2 16.879 -0.252 -3.821
16 HD3 LYS 2 HD3 LYS 2 17.275 1.149 -4.818
17 HE2 LYS 2 HE2 LYS 2 16.468 -1.522 -5.954
18 HE3 LYS 2 HE3 LYS 2 15.317 -0.235 -5.596
19 HZ1 LYS 2 HZ1 LYS 2 16.645 1.207 -7.106
20 HZ2 LYS 2 HZ2 LYS 2 15.889 -0.093 -7.881
21 HZ3 LYS 2 HZ3 LYS 2 17.547 -0.154 -7.551
22 H LEU 3 HN LEU 3 21.027 2.232 -5.173
23 HA LEU 3 HA LEU 3 22.728 1.430 -2.930
24 HB2 LEU 3 HB2 LEU 3 22.546 4.068 -4.373
25 HB3 LEU 3 HB3 LEU 3 23.430 3.845 -2.877
26 HG LEU 3 HG LEU 3 25.011 3.811 -4.655
27 HD11 LEU 3 HD11 LEU 3 24.501 0.964 -3.809
28 HD12 LEU 3 HD12 LEU 3 26.018 1.616 -4.427
29 HD13 LEU 3 HD13 LEU 3 25.385 2.172 -2.878
30 HD21 LEU 3 HD21 LEU 3 23.404 3.314 -6.465
31 HD22 LEU 3 HD22 LEU 3 24.879 2.352 -6.566
32 HD23 LEU 3 HD23 LEU 3 23.392 1.626 -5.956
33 H LYS 4 HN LYS 4 22.120 1.914 -0.890
34 HA LYS 4 HA LYS 4 19.577 3.369 -0.558
35 HB2 LYS 4 HB2 LYS 4 20.711 1.225 1.248
36 HB3 LYS 4 HB3 LYS 4 19.129 1.984 1.376
37 HG2 LYS 4 HG2 LYS 4 18.251 0.784 -0.351
38 HG3 LYS 4 HG3 LYS 4 19.812 0.590 -1.154
39 HD2 LYS 4 HD2 LYS 4 20.497 -0.975 0.626
40 HD3 LYS 4 HD3 LYS 4 18.894 -0.824 1.350
41 HE2 LYS 4 HE2 LYS 4 17.888 -1.709 -0.699
42 HE3 LYS 4 HE3 LYS 4 19.489 -1.851 -1.424
43 HZ1 LYS 4 HZ1 LYS 4 20.077 -3.410 0.365
44 HZ2 LYS 4 HZ2 LYS 4 18.791 -3.972 -0.579
45 HZ3 LYS 4 HZ3 LYS 4 18.493 -3.323 0.954
46 H GLN 5 HN GLN 5 22.457 2.445 1.335
47 HA GLN 5 HA GLN 5 22.342 5.059 2.670
48 HB2 GLN 5 HB2 GLN 5 23.907 3.985 4.327
49 HB3 GLN 5 HB3 GLN 5 22.298 3.281 4.258
50 HG2 GLN 5 HG2 GLN 5 23.176 1.473 2.840
51 HG3 GLN 5 HG3 GLN 5 24.789 2.166 2.992
52 HE21 GLN 5 HE21 GLN 5 23.763 -0.453 3.808
53 HE22 GLN 5 HE22 GLN 5 24.086 -0.581 5.500
54 H ASP 6 HN ASP 6 23.826 6.561 2.229
55 HA ASP 6 HA ASP 6 26.530 5.917 1.556
56 HB2 ASP 6 HB2 ASP 6 25.171 5.587 -0.605
57 HB3 ASP 6 HB3 ASP 6 24.978 7.337 -0.606
58 H ILE 7 HN ILE 7 27.480 8.183 0.534
59 HA ILE 7 HA ILE 7 27.110 10.072 2.674
60 HB ILE 7 HB ILE 7 28.835 10.352 0.205
61 HG12 ILE 7 HG12 ILE 7 30.640 9.760 2.029
62 HG13 ILE 7 HG13 ILE 7 29.284 8.971 2.825
63 HG21 ILE 7 HG21 ILE 7 28.483 12.471 1.277
64 HG22 ILE 7 HG22 ILE 7 28.855 11.784 2.858
65 HG23 ILE 7 HG23 ILE 7 30.119 11.924 1.636
66 HD11 ILE 7 HD11 ILE 7 30.270 8.388 0.043
67 HD12 ILE 7 HD12 ILE 7 30.566 7.408 1.478
68 HD13 ILE 7 HD13 ILE 7 28.926 7.584 0.857
69 H LEU 8 HN LEU 8 25.645 9.548 -0.310
70 HA LEU 8 HA LEU 8 25.069 12.335 -0.856
71 HB2 LEU 8 HB2 LEU 8 25.494 10.925 -2.751
72 HB3 LEU 8 HB3 LEU 8 24.286 9.770 -2.224
73 HG LEU 8 HG LEU 8 22.543 11.532 -2.601
74 HD11 LEU 8 HD11 LEU 8 23.954 13.502 -2.463
75 HD12 LEU 8 HD12 LEU 8 24.850 12.985 -3.892
76 HD13 LEU 8 HD13 LEU 8 23.149 13.432 -4.031
77 HD21 LEU 8 HD21 LEU 8 22.475 11.197 -4.981
78 HD22 LEU 8 HD22 LEU 8 24.199 10.823 -5.014
79 HD23 LEU 8 HD23 LEU 8 23.078 9.729 -4.206
80 H ASN 9 HN ASN 9 23.647 9.597 0.632
81 HA ASN 9 HA ASN 9 21.074 10.982 0.910
82 HB2 ASN 9 HB2 ASN 9 21.745 8.080 1.458
83 HB3 ASN 9 HB3 ASN 9 20.142 8.807 1.546
84 HD21 ASN 9 HD21 ASN 9 22.682 7.706 -0.539
85 HD22 ASN 9 HD22 ASN 9 21.766 7.725 -2.004
86 H LEU 10 HN LEU 10 23.915 10.074 2.532
87 HA LEU 10 HA LEU 10 24.644 10.237 4.675
88 HB2 LEU 10 HB2 LEU 10 23.919 12.571 4.322
89 HB3 LEU 10 HB3 LEU 10 22.335 12.161 4.951
90 HG LEU 10 HG LEU 10 23.460 11.531 7.117
91 HD11 LEU 10 HD11 LEU 10 25.714 11.211 6.244
92 HD12 LEU 10 HD12 LEU 10 25.807 12.925 5.838
93 HD13 LEU 10 HD13 LEU 10 25.694 12.424 7.524
94 HD21 LEU 10 HD21 LEU 10 23.740 14.385 6.181
95 HD22 LEU 10 HD22 LEU 10 22.276 13.644 6.831
96 HD23 LEU 10 HD23 LEU 10 23.694 13.847 7.860
97 H ARG 11 HN ARG 11 24.241 8.172 5.391
98 HA ARG 11 HA ARG 11 23.252 6.457 6.504
99 HB2 ARG 11 HB2 ARG 11 22.150 8.641 8.266
100 HB3 ARG 11 HB3 ARG 11 22.574 6.996 8.717
101 HG2 ARG 11 HG2 ARG 11 24.919 7.461 8.356
102 HG3 ARG 11 HG3 ARG 11 24.531 9.097 7.820
103 HD2 ARG 11 HD2 ARG 11 23.565 9.559 10.044
104 HD3 ARG 11 HD3 ARG 11 24.048 7.946 10.568
105 HE ARG 11 HE ARG 11 26.308 9.254 9.574
106 HH11 ARG 11 HH12 ARG 11 24.083 9.490 12.245
107 HH12 ARG 11 HH11 ARG 11 25.241 10.209 13.313
108 HH21 ARG 11 HH22 ARG 11 27.839 10.197 10.972
109 HH22 ARG 11 HH21 ARG 11 27.377 10.609 12.591
110 H THR 12 HN THR 12 21.709 7.355 4.310
111 HA THR 12 HA THR 12 19.675 6.998 3.361
112 HB THR 12 HB THR 12 18.948 5.693 5.993
113 HG1 THR 12 HG1 THR 12 19.656 4.322 3.626
114 HG21 THR 12 HG21 THR 12 17.692 5.428 3.258
115 HG22 THR 12 HG22 THR 12 16.993 6.288 4.629
116 HG23 THR 12 HG23 THR 12 17.221 4.541 4.707
117 H ASP 13 HN ASP 13 18.294 8.579 2.956
118 HA ASP 13 HA ASP 13 17.603 10.493 4.997
119 HB2 ASP 13 HB2 ASP 13 16.370 11.615 3.103
120 HB3 ASP 13 HB3 ASP 13 18.096 11.395 2.840
121 H ILE 14 HN ILE 14 16.057 10.020 6.390
122 HA ILE 14 HA ILE 14 14.077 8.090 6.122
123 HB ILE 14 HB ILE 14 13.921 10.579 7.825
124 HG12 ILE 14 HG12 ILE 14 15.039 7.848 8.507
125 HG13 ILE 14 HG13 ILE 14 16.011 9.275 8.165
126 HG21 ILE 14 HG21 ILE 14 12.558 7.903 8.102
127 HG22 ILE 14 HG22 ILE 14 12.444 9.241 9.244
128 HG23 ILE 14 HG23 ILE 14 11.790 9.413 7.616
129 HD11 ILE 14 HD11 ILE 14 14.111 8.911 10.467
130 HD12 ILE 14 HD12 ILE 14 15.873 8.923 10.539
131 HD13 ILE 14 HD13 ILE 14 14.998 10.393 10.108
132 H SER 15 HN SER 15 12.510 8.020 4.667
133 HA SER 15 HA SER 15 11.415 10.460 3.534
134 HB2 SER 15 HB2 SER 15 10.200 8.931 2.016
135 HB3 SER 15 HB3 SER 15 11.932 8.607 2.023
136 HG SER 15 HG SER 15 11.587 6.719 2.921
137 H THR 16 HN THR 16 9.129 10.879 3.448
138 HA THR 16 HA THR 16 7.719 9.854 5.822
139 HB THR 16 HB THR 16 8.117 12.247 5.957
140 HG1 THR 16 HG1 THR 16 6.207 11.964 6.884
141 HG21 THR 16 HG21 THR 16 7.140 13.797 4.331
142 HG22 THR 16 HG22 THR 16 6.588 12.433 3.358
143 HG23 THR 16 HG23 THR 16 8.314 12.729 3.564
144 H SER 17 HN SER 17 7.634 10.139 2.395
145 HA SER 17 HA SER 17 6.199 9.385 0.801
146 HB2 SER 17 HB2 SER 17 6.344 7.277 2.086
147 HB3 SER 17 HB3 SER 17 4.981 7.798 3.076
148 HG SER 17 HG SER 17 4.590 7.847 0.333
149 H SEP 18 HN SER 18 3.729 9.124 0.310
150 HA SEP 18 HA SER 18 2.135 11.054 1.823
151 HB2 SEP 18 HB2 SER 18 1.467 12.243 -0.213
152 HB3 SEP 18 HB3 SER 18 3.214 12.333 0.007
153 H SER 19 HN SER 19 -0.030 10.620 1.848
154 HA SER 19 HA SER 19 -0.881 8.016 1.158
155 HB2 SER 19 HB2 SER 19 -1.888 9.201 3.021
156 HB3 SER 19 HB3 SER 19 -2.489 10.456 1.939
157 HG SER 19 HG SER 19 -3.202 7.809 1.409
158 H SER 20 HN SER 20 -1.903 7.221 -0.589
159 HA SER 20 HA SER 20 -3.100 9.012 -2.541
160 HB2 SER 20 HB2 SER 20 -1.806 8.062 -4.418
161 HB3 SER 20 HB3 SER 20 -0.766 8.907 -3.272
162 HG SER 20 HG SER 20 -1.155 6.105 -3.490
163 H ILE 21 HN ILE 21 -3.204 6.277 -0.767
164 HA ILE 21 HA ILE 21 -4.553 4.448 -0.719
165 HB ILE 21 HB ILE 21 -6.005 5.752 -3.026
166 HG12 ILE 21 HG12 ILE 21 -5.880 7.255 -1.095
167 HG13 ILE 21 HG13 ILE 21 -7.520 6.661 -1.314
168 HG21 ILE 21 HG21 ILE 21 -7.920 4.412 -2.256
169 HG22 ILE 21 HG22 ILE 21 -6.568 3.411 -2.785
170 HG23 ILE 21 HG23 ILE 21 -6.879 3.636 -1.063
171 HD11 ILE 21 HD11 ILE 21 -7.201 5.070 0.494
172 HD12 ILE 21 HD12 ILE 21 -5.540 5.622 0.699
173 HD13 ILE 21 HD13 ILE 21 -6.879 6.718 1.033
174 H SER 22 HN SER 22 -3.446 2.684 -1.283
175 HA SER 22 HA SER 22 -2.283 2.239 -3.818
176 HB2 SER 22 HB2 SER 22 -1.422 1.152 -1.806
177 HB3 SER 22 HB3 SER 22 -2.935 0.266 -1.615
178 HG SER 22 HG SER 22 -0.872 -0.570 -2.892
179 H SER 23 HN SER 23 -2.814 0.572 -5.365
180 HA SER 23 HA SER 23 -5.676 0.447 -5.843
181 HB2 SER 23 HB2 SER 23 -5.030 -0.462 -8.053
182 HB3 SER 23 HB3 SER 23 -4.229 1.069 -7.705
183 HG SER 23 HG SER 23 -2.370 -0.114 -7.128
184 H SER 24 HN SER 24 -2.989 -1.903 -5.816
185 HA SER 24 HA SER 24 -4.858 -4.102 -5.576
186 HB2 SER 24 HB2 SER 24 -2.847 -5.529 -5.664
187 HB3 SER 24 HB3 SER 24 -2.873 -4.367 -6.992
188 HG SER 24 HG SER 24 -1.054 -4.672 -5.015
189 H GLU 25 HN GLU 25 -5.436 -5.091 -3.744
190 HA GLU 25 HA GLU 25 -3.770 -5.196 -1.429
191 HB2 GLU 25 HB2 GLU 25 -5.212 -3.921 0.085
192 HB3 GLU 25 HB3 GLU 25 -4.569 -2.895 -1.190
193 HG2 GLU 25 HG2 GLU 25 -6.708 -3.109 -2.397
194 HG3 GLU 25 HG3 GLU 25 -7.343 -4.050 -1.049
195 H GLU 26 HN GLU 26 -6.851 -5.698 -2.981
196 HA GLU 26 HA GLU 26 -7.909 -7.450 -0.982
197 HB2 GLU 26 HB2 GLU 26 -9.361 -6.187 -2.517
198 HB3 GLU 26 HB3 GLU 26 -8.714 -7.093 -3.874
199 HG2 GLU 26 HG2 GLU 26 -10.880 -7.949 -3.233
200 HG3 GLU 26 HG3 GLU 26 -9.627 -9.155 -2.943
201 H ASN 27 HN ASN 27 -7.244 -9.449 -0.601
202 HA ASN 27 HA ASN 27 -5.866 -10.921 -2.734
203 HB2 ASN 27 HB2 ASN 27 -5.919 -11.464 0.244
204 HB3 ASN 27 HB3 ASN 27 -4.956 -12.332 -0.950
205 HD21 ASN 27 HD21 ASN 27 -3.197 -11.297 -1.916
206 HD22 ASN 27 HD22 ASN 27 -2.468 -9.900 -1.211
207 H ASP 28 HN ASP 28 -8.888 -10.600 -1.698
208 HA ASP 28 HA ASP 28 -9.534 -13.429 -2.193
209 HB2 ASP 28 HB2 ASP 28 -10.937 -11.576 -0.254
210 HB3 ASP 28 HB3 ASP 28 -11.434 -13.222 -0.634
211 H PHE 29 HN PHE 29 -10.322 -13.418 -4.207
212 HA PHE 29 HA PHE 29 -12.783 -12.089 -4.759
213 HB2 PHE 29 HB2 PHE 29 -11.202 -10.226 -5.149
214 HB3 PHE 29 HB3 PHE 29 -10.361 -11.211 -6.341
215 HD1 PHE 29 HD2 PHE 29 -13.491 -9.425 -5.598
216 HD2 PHE 29 HD1 PHE 29 -11.212 -11.483 -8.543
217 HE1 PHE 29 HE2 PHE 29 -15.016 -8.604 -7.345
218 HE2 PHE 29 HE1 PHE 29 -12.731 -10.666 -10.296
219 HZ PHE 29 HZ PHE 29 -14.636 -9.225 -9.698
220 H TRP 30 HN TRP 30 -10.042 -13.927 -5.882
221 HA TRP 30 HA TRP 30 -11.124 -14.879 -8.292
222 HB2 TRP 30 HB2 TRP 30 -8.998 -15.935 -6.441
223 HB3 TRP 30 HB3 TRP 30 -9.460 -16.803 -7.903
224 HD1 TRP 30 HD1 TRP 30 -7.083 -14.260 -6.749
225 HE1 TRP 30 HE1 TRP 30 -6.019 -13.031 -8.748
226 HE3 TRP 30 HE3 TRP 30 -10.282 -15.789 -10.422
227 HZ2 TRP 30 HZ2 TRP 30 -6.484 -12.751 -11.524
228 HZ3 TRP 30 HZ3 TRP 30 -9.908 -14.999 -12.724
229 HH2 TRP 30 HH2 TRP 30 -8.049 -13.509 -13.261
230 H GLN 31 HN GLN 31 -10.378 -17.299 -5.883
231 HA GLN 31 HA GLN 31 -13.172 -18.046 -5.604
232 HB2 GLN 31 HB2 GLN 31 -12.670 -20.407 -6.287
233 HB3 GLN 31 HB3 GLN 31 -12.629 -19.239 -7.604
234 HG2 GLN 31 HG2 GLN 31 -10.208 -19.195 -7.520
235 HG3 GLN 31 HG3 GLN 31 -10.218 -20.307 -6.154
236 HE21 GLN 31 HE21 GLN 31 -8.994 -20.593 -8.787
237 HE22 GLN 31 HE22 GLN 31 -9.661 -22.033 -9.472
238 HA PRO 32 HA PRO 32 -10.336 -19.093 -1.992
239 HB2 PRO 32 HB2 PRO 32 -10.816 -17.051 -0.325
240 HB3 PRO 32 HB3 PRO 32 -9.608 -16.934 -1.610
241 HG2 PRO 32 HG2 PRO 32 -12.378 -15.829 -1.502
242 HG3 PRO 32 HG3 PRO 32 -10.906 -15.110 -2.179
243 HD2 PRO 32 HD2 PRO 32 -12.879 -16.383 -3.654
244 HD3 PRO 32 HD3 PRO 32 -11.211 -16.122 -4.193
245 H LYS 33 HN LYS 33 -13.552 -18.760 -2.672
246 HA LYS 33 HA LYS 33 -14.468 -19.476 0.015
247 HB2 LYS 33 HB2 LYS 33 -16.115 -18.913 -2.459
248 HB3 LYS 33 HB3 LYS 33 -16.710 -19.068 -0.813
249 HG2 LYS 33 HG2 LYS 33 -14.866 -16.904 -1.807
250 HG3 LYS 33 HG3 LYS 33 -16.601 -16.736 -1.537
251 HD2 LYS 33 HD2 LYS 33 -14.599 -17.477 0.596
252 HD3 LYS 33 HD3 LYS 33 -15.206 -15.843 0.318
253 HE2 LYS 33 HE2 LYS 33 -16.882 -18.249 1.037
254 HE3 LYS 33 HE3 LYS 33 -16.395 -16.970 2.148
255 HZ1 LYS 33 HZ1 LYS 33 -17.625 -15.384 0.789
256 HZ2 LYS 33 HZ2 LYS 33 -18.638 -16.616 1.352
257 HZ3 LYS 33 HZ3 LYS 33 -18.108 -16.626 -0.254
258 HA PRO 34 HA PRO 34 -14.940 -23.811 -0.645
259 HB2 PRO 34 HB2 PRO 34 -17.830 -23.458 0.012
260 HB3 PRO 34 HB3 PRO 34 -16.651 -24.585 0.694
261 HG2 PRO 34 HG2 PRO 34 -17.395 -22.436 2.064
262 HG3 PRO 34 HG3 PRO 34 -15.702 -22.966 2.068
263 HD2 PRO 34 HD2 PRO 34 -16.975 -20.692 0.611
264 HD3 PRO 34 HD3 PRO 34 -15.362 -20.801 1.348
265 H THR 35 HN THR 35 -14.870 -24.535 -2.678
266 HA THR 35 HA THR 35 -16.441 -23.581 -4.800
267 HB THR 35 HB THR 35 -14.416 -24.563 -5.445
268 HG1 THR 35 HG1 THR 35 -15.688 -25.265 -7.025
269 HG21 THR 35 HG21 THR 35 -13.741 -26.849 -4.884
270 HG22 THR 35 HG22 THR 35 -15.224 -27.064 -3.956
271 HG23 THR 35 HG23 THR 35 -14.017 -25.892 -3.428
Start of MODEL 17
1 H1 GLU 1 H1 GLU 1 24.896 -6.745 4.148
2 H2 GLU 1 H2 GLU 1 24.414 -5.148 3.875
3 H3 GLU 1 H3 GLU 1 23.537 -6.422 3.195
4 HA GLU 1 HA GLU 1 22.826 -7.176 5.335
5 HB2 GLU 1 HB2 GLU 1 24.897 -6.487 6.521
6 HB3 GLU 1 HB3 GLU 1 24.379 -4.811 6.411
7 HG2 GLU 1 HG2 GLU 1 22.426 -5.308 7.776
8 HG3 GLU 1 HG3 GLU 1 22.913 -7.002 7.864
9 H LYS 2 HN LYS 2 23.281 -3.744 4.535
10 HA LYS 2 HA LYS 2 20.376 -3.440 4.395
11 HB2 LYS 2 HB2 LYS 2 22.191 -1.624 5.993
12 HB3 LYS 2 HB3 LYS 2 20.500 -1.297 5.641
13 HG2 LYS 2 HG2 LYS 2 19.847 -3.285 6.896
14 HG3 LYS 2 HG3 LYS 2 21.545 -3.629 7.237
15 HD2 LYS 2 HD2 LYS 2 21.731 -1.486 8.418
16 HD3 LYS 2 HD3 LYS 2 20.025 -1.167 8.096
17 HE2 LYS 2 HE2 LYS 2 19.415 -3.160 9.381
18 HE3 LYS 2 HE3 LYS 2 21.120 -3.479 9.697
19 HZ1 LYS 2 HZ1 LYS 2 21.251 -1.359 10.869
20 HZ2 LYS 2 HZ2 LYS 2 20.095 -2.376 11.569
21 HZ3 LYS 2 HZ3 LYS 2 19.604 -1.086 10.592
22 H LEU 3 HN LEU 3 20.487 -3.223 2.177
23 HA LEU 3 HA LEU 3 22.116 -1.050 1.123
24 HB2 LEU 3 HB2 LEU 3 20.864 -3.461 -0.134
25 HB3 LEU 3 HB3 LEU 3 21.345 -2.097 -1.120
26 HG LEU 3 HG LEU 3 23.070 -3.786 -1.168
27 HD11 LEU 3 HD11 LEU 3 23.918 -1.434 0.518
28 HD12 LEU 3 HD12 LEU 3 24.985 -2.470 -0.431
29 HD13 LEU 3 HD13 LEU 3 23.791 -1.457 -1.241
30 HD21 LEU 3 HD21 LEU 3 24.263 -4.478 0.839
31 HD22 LEU 3 HD22 LEU 3 23.190 -3.490 1.830
32 HD23 LEU 3 HD23 LEU 3 22.550 -4.882 0.955
33 H LYS 4 HN LYS 4 19.660 -0.646 2.593
34 HA LYS 4 HA LYS 4 17.698 0.200 0.635
35 HB2 LYS 4 HB2 LYS 4 17.735 0.548 3.640
36 HB3 LYS 4 HB3 LYS 4 16.370 0.890 2.586
37 HG2 LYS 4 HG2 LYS 4 17.623 -1.817 3.007
38 HG3 LYS 4 HG3 LYS 4 16.121 -1.247 3.738
39 HD2 LYS 4 HD2 LYS 4 15.114 -1.023 1.531
40 HD3 LYS 4 HD3 LYS 4 16.625 -1.530 0.777
41 HE2 LYS 4 HE2 LYS 4 14.962 -3.349 0.911
42 HE3 LYS 4 HE3 LYS 4 16.448 -3.713 1.786
43 HZ1 LYS 4 HZ1 LYS 4 14.451 -4.326 3.034
44 HZ2 LYS 4 HZ2 LYS 4 13.944 -2.713 3.032
45 HZ3 LYS 4 HZ3 LYS 4 15.359 -3.150 3.847
46 H GLN 5 HN GLN 5 17.345 2.233 -0.057
47 HA GLN 5 HA GLN 5 17.723 4.429 -0.510
48 HB2 GLN 5 HB2 GLN 5 18.469 4.509 2.417
49 HB3 GLN 5 HB3 GLN 5 18.175 5.923 1.414
50 HG2 GLN 5 HG2 GLN 5 15.866 5.089 1.024
51 HG3 GLN 5 HG3 GLN 5 16.186 3.800 2.181
52 HE21 GLN 5 HE21 GLN 5 17.805 5.511 3.907
53 HE22 GLN 5 HE22 GLN 5 16.694 6.548 4.730
54 H ASP 6 HN ASP 6 19.480 6.244 -0.267
55 HA ASP 6 HA ASP 6 22.159 5.453 0.213
56 HB2 ASP 6 HB2 ASP 6 21.434 4.297 -2.032
57 HB3 ASP 6 HB3 ASP 6 21.666 5.906 -2.711
58 H ILE 7 HN ILE 7 23.424 7.173 -1.653
59 HA ILE 7 HA ILE 7 22.331 9.783 -0.860
60 HB ILE 7 HB ILE 7 24.400 9.206 0.332
61 HG12 ILE 7 HG12 ILE 7 24.859 11.376 -1.714
62 HG13 ILE 7 HG13 ILE 7 23.831 11.558 -0.297
63 HG21 ILE 7 HG21 ILE 7 25.408 7.746 -1.322
64 HG22 ILE 7 HG22 ILE 7 25.638 9.112 -2.413
65 HG23 ILE 7 HG23 ILE 7 26.520 9.043 -0.887
66 HD11 ILE 7 HD11 ILE 7 26.784 10.975 -0.244
67 HD12 ILE 7 HD12 ILE 7 26.039 12.550 0.030
68 HD13 ILE 7 HD13 ILE 7 25.742 11.227 1.157
69 H LEU 8 HN LEU 8 23.454 7.772 -3.391
70 HA LEU 8 HA LEU 8 23.262 10.021 -5.277
71 HB2 LEU 8 HB2 LEU 8 25.573 8.929 -4.883
72 HB3 LEU 8 HB3 LEU 8 24.930 7.589 -5.813
73 HG LEU 8 HG LEU 8 24.529 9.122 -7.711
74 HD11 LEU 8 HD11 LEU 8 25.945 11.134 -5.970
75 HD12 LEU 8 HD12 LEU 8 25.513 11.359 -7.666
76 HD13 LEU 8 HD13 LEU 8 24.248 11.182 -6.448
77 HD21 LEU 8 HD21 LEU 8 27.354 9.097 -6.652
78 HD22 LEU 8 HD22 LEU 8 26.589 7.835 -7.618
79 HD23 LEU 8 HD23 LEU 8 26.887 9.423 -8.323
80 H ASN 9 HN ASN 9 21.971 7.092 -4.311
81 HA ASN 9 HA ASN 9 20.431 6.921 -6.794
82 HB2 ASN 9 HB2 ASN 9 20.566 4.455 -6.765
83 HB3 ASN 9 HB3 ASN 9 22.146 5.201 -6.997
84 HD21 ASN 9 HD21 ASN 9 20.068 3.527 -4.746
85 HD22 ASN 9 HD22 ASN 9 21.317 3.032 -3.660
86 H LEU 10 HN LEU 10 20.128 7.744 -3.850
87 HA LEU 10 HA LEU 10 18.441 6.071 -2.461
88 HB2 LEU 10 HB2 LEU 10 17.498 8.147 -1.438
89 HB3 LEU 10 HB3 LEU 10 19.246 8.035 -1.400
90 HG LEU 10 HG LEU 10 18.326 9.452 -3.759
91 HD11 LEU 10 HD11 LEU 10 16.453 10.089 -2.357
92 HD12 LEU 10 HD12 LEU 10 17.556 10.568 -1.066
93 HD13 LEU 10 HD13 LEU 10 17.540 11.461 -2.586
94 HD21 LEU 10 HD21 LEU 10 19.949 11.091 -2.985
95 HD22 LEU 10 HD22 LEU 10 20.067 10.261 -1.433
96 HD23 LEU 10 HD23 LEU 10 20.622 9.462 -2.905
97 H ARG 11 HN ARG 11 16.988 4.979 -3.711
98 HA ARG 11 HA ARG 11 15.239 6.187 -5.575
99 HB2 ARG 11 HB2 ARG 11 14.971 3.558 -4.109
100 HB3 ARG 11 HB3 ARG 11 14.009 4.042 -5.498
101 HG2 ARG 11 HG2 ARG 11 16.065 4.155 -6.849
102 HG3 ARG 11 HG3 ARG 11 16.984 3.594 -5.452
103 HD2 ARG 11 HD2 ARG 11 15.675 1.528 -5.420
104 HD3 ARG 11 HD3 ARG 11 14.750 2.091 -6.811
105 HE ARG 11 HE ARG 11 17.438 2.150 -7.521
106 HH11 ARG 11 HH12 ARG 11 15.029 -0.207 -6.637
107 HH12 ARG 11 HH11 ARG 11 15.740 -1.474 -7.578
108 HH21 ARG 11 HH22 ARG 11 18.381 0.487 -8.762
109 HH22 ARG 11 HH21 ARG 11 17.644 -1.082 -8.786
110 H THR 12 HN THR 12 15.262 6.217 -2.205
111 HA THR 12 HA THR 12 13.826 6.989 -0.621
112 HB THR 12 HB THR 12 12.243 8.104 -2.946
113 HG1 THR 12 HG1 THR 12 13.505 10.052 -2.272
114 HG21 THR 12 HG21 THR 12 12.356 8.925 -0.040
115 HG22 THR 12 HG22 THR 12 11.012 8.096 -0.828
116 HG23 THR 12 HG23 THR 12 11.439 9.738 -1.309
117 H ASP 13 HN ASP 13 12.870 5.311 0.364
118 HA ASP 13 HA ASP 13 10.300 4.394 -0.708
119 HB2 ASP 13 HB2 ASP 13 10.895 2.052 -0.065
120 HB3 ASP 13 HB3 ASP 13 11.856 2.689 -1.397
121 H ILE 14 HN ILE 14 8.733 4.307 0.771
122 HA ILE 14 HA ILE 14 9.334 3.844 3.570
123 HB ILE 14 HB ILE 14 9.611 6.280 3.357
124 HG12 ILE 14 HG12 ILE 14 7.909 6.939 5.090
125 HG13 ILE 14 HG13 ILE 14 7.160 5.360 4.869
126 HG21 ILE 14 HG21 ILE 14 7.686 7.699 2.819
127 HG22 ILE 14 HG22 ILE 14 8.154 6.677 1.457
128 HG23 ILE 14 HG23 ILE 14 6.743 6.260 2.431
129 HD11 ILE 14 HD11 ILE 14 9.964 5.868 5.829
130 HD12 ILE 14 HD12 ILE 14 8.591 5.375 6.818
131 HD13 ILE 14 HD13 ILE 14 9.231 4.282 5.590
132 H SER 15 HN SER 15 7.645 2.922 4.660
133 HA SER 15 HA SER 15 5.302 2.245 3.053
134 HB2 SER 15 HB2 SER 15 6.261 1.134 5.703
135 HB3 SER 15 HB3 SER 15 4.868 0.544 4.796
136 HG SER 15 HG SER 15 6.416 -0.746 4.070
137 H THR 16 HN THR 16 5.734 4.897 4.401
138 HA THR 16 HA THR 16 3.441 4.882 6.244
139 HB THR 16 HB THR 16 5.538 7.029 5.851
140 HG1 THR 16 HG1 THR 16 6.556 6.132 7.513
141 HG21 THR 16 HG21 THR 16 4.562 8.005 7.900
142 HG22 THR 16 HG22 THR 16 3.290 6.785 7.854
143 HG23 THR 16 HG23 THR 16 3.415 7.976 6.561
144 H SER 17 HN SER 17 1.610 5.206 5.153
145 HA SER 17 HA SER 17 1.321 7.654 3.621
146 HB2 SER 17 HB2 SER 17 0.685 4.950 2.412
147 HB3 SER 17 HB3 SER 17 0.301 6.510 1.686
148 HG SER 17 HG SER 17 2.344 6.784 1.156
149 H SEP 18 HN SER 18 -1.119 7.623 2.731
150 HA SEP 18 HA SER 18 -2.974 6.304 4.501
151 HB2 SEP 18 HB2 SER 18 -2.234 8.233 5.874
152 HB3 SEP 18 HB3 SER 18 -2.754 9.325 4.591
153 H SER 19 HN SER 19 -2.832 9.221 2.450
154 HA SER 19 HA SER 19 -5.399 8.765 1.309
155 HB2 SER 19 HB2 SER 19 -4.810 10.618 -0.209
156 HB3 SER 19 HB3 SER 19 -4.435 11.016 1.469
157 HG SER 19 HG SER 19 -2.278 9.904 0.544
158 H SER 20 HN SER 20 -2.119 8.558 -0.077
159 HA SER 20 HA SER 20 -3.199 6.747 -2.132
160 HB2 SER 20 HB2 SER 20 -0.746 8.517 -2.244
161 HB3 SER 20 HB3 SER 20 -1.272 7.426 -3.527
162 HG SER 20 HG SER 20 -2.998 9.407 -2.505
163 H ILE 21 HN ILE 21 -2.508 4.708 -2.171
164 HA ILE 21 HA ILE 21 -0.052 4.032 -0.692
165 HB ILE 21 HB ILE 21 -1.990 3.334 0.623
166 HG12 ILE 21 HG12 ILE 21 -1.459 0.888 0.771
167 HG13 ILE 21 HG13 ILE 21 -0.485 1.060 -0.687
168 HG21 ILE 21 HG21 ILE 21 -3.617 3.117 -1.164
169 HG22 ILE 21 HG22 ILE 21 -2.757 1.715 -1.800
170 HG23 ILE 21 HG23 ILE 21 -3.537 1.629 -0.220
171 HD11 ILE 21 HD11 ILE 21 0.903 1.086 1.298
172 HD12 ILE 21 HD12 ILE 21 0.964 2.647 0.480
173 HD13 ILE 21 HD13 ILE 21 -0.008 2.454 1.937
174 H SER 22 HN SER 22 1.248 2.426 -1.561
175 HA SER 22 HA SER 22 1.173 2.113 -4.370
176 HB2 SER 22 HB2 SER 22 3.285 2.063 -3.149
177 HB3 SER 22 HB3 SER 22 2.777 0.611 -2.288
178 HG SER 22 HG SER 22 4.170 0.260 -4.153
179 H SER 23 HN SER 23 0.695 0.343 -5.650
180 HA SER 23 HA SER 23 -0.566 -1.967 -4.359
181 HB2 SER 23 HB2 SER 23 -2.436 -1.901 -5.961
182 HB3 SER 23 HB3 SER 23 -2.397 -0.449 -4.962
183 HG SER 23 HG SER 23 -0.991 0.268 -6.933
184 H SER 24 HN SER 24 0.178 -3.814 -5.161
185 HA SER 24 HA SER 24 1.603 -3.747 -7.731
186 HB2 SER 24 HB2 SER 24 2.702 -5.827 -6.949
187 HB3 SER 24 HB3 SER 24 2.959 -4.483 -5.837
188 HG SER 24 HG SER 24 2.366 -6.445 -4.775
189 H GLU 25 HN GLU 25 -0.827 -5.529 -5.895
190 HA GLU 25 HA GLU 25 -1.815 -6.649 -8.423
191 HB2 GLU 25 HB2 GLU 25 -1.495 -8.190 -5.840
192 HB3 GLU 25 HB3 GLU 25 -2.285 -8.793 -7.289
193 HG2 GLU 25 HG2 GLU 25 -0.160 -8.570 -8.509
194 HG3 GLU 25 HG3 GLU 25 0.616 -8.040 -7.019
195 H GLU 26 HN GLU 26 -4.030 -7.852 -7.817
196 HA GLU 26 HA GLU 26 -5.731 -5.747 -6.811
197 HB2 GLU 26 HB2 GLU 26 -6.433 -8.501 -7.844
198 HB3 GLU 26 HB3 GLU 26 -7.577 -7.203 -7.520
199 HG2 GLU 26 HG2 GLU 26 -6.595 -5.856 -9.266
200 HG3 GLU 26 HG3 GLU 26 -5.358 -7.079 -9.551
201 H ASN 27 HN ASN 27 -6.229 -5.534 -4.740
202 HA ASN 27 HA ASN 27 -6.758 -7.926 -3.142
203 HB2 ASN 27 HB2 ASN 27 -5.431 -7.071 -1.262
204 HB3 ASN 27 HB3 ASN 27 -4.422 -7.339 -2.679
205 HD21 ASN 27 HD21 ASN 27 -5.854 -4.978 -0.580
206 HD22 ASN 27 HD22 ASN 27 -4.922 -3.631 -1.127
207 H ASP 28 HN ASP 28 -8.184 -5.510 -4.383
208 HA ASP 28 HA ASP 28 -9.430 -4.463 -1.932
209 HB2 ASP 28 HB2 ASP 28 -9.526 -3.362 -4.751
210 HB3 ASP 28 HB3 ASP 28 -10.273 -2.627 -3.336
211 H PHE 29 HN PHE 29 -9.975 -7.085 -3.244
212 HA PHE 29 HA PHE 29 -12.812 -6.995 -3.066
213 HB2 PHE 29 HB2 PHE 29 -12.352 -6.124 -5.409
214 HB3 PHE 29 HB3 PHE 29 -11.761 -7.737 -5.791
215 HD1 PHE 29 HD2 PHE 29 -14.745 -5.987 -4.424
216 HD2 PHE 29 HD1 PHE 29 -13.233 -9.339 -6.562
217 HE1 PHE 29 HE2 PHE 29 -17.047 -6.708 -4.912
218 HE2 PHE 29 HE1 PHE 29 -15.530 -10.068 -7.056
219 HZ PHE 29 HZ PHE 29 -17.442 -8.752 -6.229
220 H TRP 30 HN TRP 30 -9.893 -8.725 -3.825
221 HA TRP 30 HA TRP 30 -11.162 -11.194 -2.883
222 HB2 TRP 30 HB2 TRP 30 -9.071 -10.910 -5.047
223 HB3 TRP 30 HB3 TRP 30 -9.557 -12.443 -4.333
224 HD1 TRP 30 HD1 TRP 30 -10.396 -10.113 -7.058
225 HE1 TRP 30 HE1 TRP 30 -12.561 -10.849 -8.249
226 HE3 TRP 30 HE3 TRP 30 -12.024 -13.581 -3.686
227 HZ2 TRP 30 HZ2 TRP 30 -14.679 -12.666 -7.806
228 HZ3 TRP 30 HZ3 TRP 30 -14.127 -14.774 -4.140
229 HH2 TRP 30 HH2 TRP 30 -15.426 -14.326 -6.158
230 H GLN 31 HN GLN 31 -10.213 -12.149 -1.288
231 HA GLN 31 HA GLN 31 -7.510 -11.304 -0.485
232 HB2 GLN 31 HB2 GLN 31 -9.790 -12.079 1.340
233 HB3 GLN 31 HB3 GLN 31 -8.176 -11.601 1.850
234 HG2 GLN 31 HG2 GLN 31 -8.522 -9.382 0.920
235 HG3 GLN 31 HG3 GLN 31 -10.128 -9.858 0.367
236 HE21 GLN 31 HE21 GLN 31 -11.773 -10.166 1.882
237 HE22 GLN 31 HE22 GLN 31 -11.663 -9.542 3.490
238 HA PRO 32 HA PRO 32 -7.442 -15.889 -0.877
239 HB2 PRO 32 HB2 PRO 32 -5.695 -16.117 -2.907
240 HB3 PRO 32 HB3 PRO 32 -7.410 -15.798 -3.180
241 HG2 PRO 32 HG2 PRO 32 -5.093 -13.976 -3.423
242 HG3 PRO 32 HG3 PRO 32 -6.657 -13.926 -4.253
243 HD2 PRO 32 HD2 PRO 32 -5.836 -12.396 -1.993
244 HD3 PRO 32 HD3 PRO 32 -7.439 -12.432 -2.750
245 H LYS 33 HN LYS 33 -5.043 -13.436 -0.497
246 HA LYS 33 HA LYS 33 -3.022 -15.349 0.397
247 HB2 LYS 33 HB2 LYS 33 -2.835 -12.346 0.090
248 HB3 LYS 33 HB3 LYS 33 -1.501 -13.438 0.431
249 HG2 LYS 33 HG2 LYS 33 -3.154 -13.409 -2.085
250 HG3 LYS 33 HG3 LYS 33 -1.525 -12.754 -1.905
251 HD2 LYS 33 HD2 LYS 33 -0.680 -14.984 -1.376
252 HD3 LYS 33 HD3 LYS 33 -2.311 -15.642 -1.527
253 HE2 LYS 33 HE2 LYS 33 -0.786 -14.268 -3.735
254 HE3 LYS 33 HE3 LYS 33 -0.925 -16.015 -3.541
255 HZ1 LYS 33 HZ1 LYS 33 -3.326 -15.806 -3.785
256 HZ2 LYS 33 HZ2 LYS 33 -2.526 -15.186 -5.140
257 HZ3 LYS 33 HZ3 LYS 33 -3.180 -14.133 -3.989
258 HA PRO 34 HA PRO 34 -3.567 -14.892 4.748
259 HB2 PRO 34 HB2 PRO 34 -0.750 -13.933 4.907
260 HB3 PRO 34 HB3 PRO 34 -1.544 -15.241 5.792
261 HG2 PRO 34 HG2 PRO 34 0.132 -15.779 3.797
262 HG3 PRO 34 HG3 PRO 34 -1.344 -16.735 4.029
263 HD2 PRO 34 HD2 PRO 34 -0.751 -14.617 2.012
264 HD3 PRO 34 HD3 PRO 34 -1.715 -16.100 1.845
265 H THR 35 HN THR 35 -4.911 -13.196 5.104
266 HA THR 35 HA THR 35 -4.158 -10.478 4.658
267 HB THR 35 HB THR 35 -6.300 -9.933 5.810
268 HG1 THR 35 HG1 THR 35 -7.071 -12.602 5.828
269 HG21 THR 35 HG21 THR 35 -7.760 -10.928 4.110
270 HG22 THR 35 HG22 THR 35 -6.483 -12.068 3.680
271 HG23 THR 35 HG23 THR 35 -6.256 -10.342 3.401
Start of MODEL 18
1 H1 GLU 1 H1 GLU 1 17.259 0.047 -4.663
2 H2 GLU 1 H2 GLU 1 16.735 -0.015 -6.270
3 H3 GLU 1 H3 GLU 1 16.156 -1.140 -5.149
4 HA GLU 1 HA GLU 1 15.646 1.777 -5.108
5 HB2 GLU 1 HB2 GLU 1 14.431 0.579 -6.886
6 HB3 GLU 1 HB3 GLU 1 13.797 -0.546 -5.694
7 HG2 GLU 1 HG2 GLU 1 12.676 1.356 -4.569
8 HG3 GLU 1 HG3 GLU 1 13.220 2.400 -5.882
9 H LYS 2 HN LYS 2 15.385 -1.338 -3.532
10 HA LYS 2 HA LYS 2 14.024 -0.105 -1.246
11 HB2 LYS 2 HB2 LYS 2 14.575 -3.026 -1.802
12 HB3 LYS 2 HB3 LYS 2 13.607 -2.388 -0.480
13 HG2 LYS 2 HG2 LYS 2 12.036 -1.444 -2.143
14 HG3 LYS 2 HG3 LYS 2 12.976 -2.220 -3.418
15 HD2 LYS 2 HD2 LYS 2 12.552 -4.407 -2.358
16 HD3 LYS 2 HD3 LYS 2 11.552 -3.602 -1.145
17 HE2 LYS 2 HE2 LYS 2 10.151 -4.560 -2.871
18 HE3 LYS 2 HE3 LYS 2 10.067 -2.799 -2.931
19 HZ1 LYS 2 HZ1 LYS 2 11.693 -4.530 -4.717
20 HZ2 LYS 2 HZ2 LYS 2 11.664 -2.840 -4.761
21 HZ3 LYS 2 HZ3 LYS 2 10.271 -3.720 -5.142
22 H LEU 3 HN LEU 3 16.991 0.003 -2.073
23 HA LEU 3 HA LEU 3 17.990 -0.383 0.610
24 HB2 LEU 3 HB2 LEU 3 18.383 -2.485 -0.769
25 HB3 LEU 3 HB3 LEU 3 19.516 -1.532 -1.706
26 HG LEU 3 HG LEU 3 20.665 -1.048 0.553
27 HD11 LEU 3 HD11 LEU 3 20.380 -2.798 2.232
28 HD12 LEU 3 HD12 LEU 3 18.889 -1.892 1.986
29 HD13 LEU 3 HD13 LEU 3 19.070 -3.499 1.281
30 HD21 LEU 3 HD21 LEU 3 20.726 -3.816 -0.635
31 HD22 LEU 3 HD22 LEU 3 21.616 -2.414 -1.229
32 HD23 LEU 3 HD23 LEU 3 21.987 -3.085 0.360
33 H LYS 4 HN LYS 4 17.413 1.736 -1.360
34 HA LYS 4 HA LYS 4 20.043 2.943 -1.765
35 HB2 LYS 4 HB2 LYS 4 17.323 3.954 -2.621
36 HB3 LYS 4 HB3 LYS 4 18.877 4.622 -3.101
37 HG2 LYS 4 HG2 LYS 4 17.854 1.875 -3.784
38 HG3 LYS 4 HG3 LYS 4 17.910 3.263 -4.869
39 HD2 LYS 4 HD2 LYS 4 20.360 3.322 -4.635
40 HD3 LYS 4 HD3 LYS 4 20.280 1.900 -3.593
41 HE2 LYS 4 HE2 LYS 4 19.255 0.637 -5.448
42 HE3 LYS 4 HE3 LYS 4 19.427 2.055 -6.481
43 HZ1 LYS 4 HZ1 LYS 4 21.831 1.938 -6.145
44 HZ2 LYS 4 HZ2 LYS 4 21.232 0.524 -6.853
45 HZ3 LYS 4 HZ3 LYS 4 21.642 0.540 -5.212
46 H GLN 5 HN GLN 5 18.111 2.689 0.754
47 HA GLN 5 HA GLN 5 18.442 5.483 1.623
48 HB2 GLN 5 HB2 GLN 5 16.654 5.035 3.257
49 HB3 GLN 5 HB3 GLN 5 16.109 4.788 1.606
50 HG2 GLN 5 HG2 GLN 5 16.414 2.366 1.888
51 HG3 GLN 5 HG3 GLN 5 16.894 2.640 3.561
52 HE21 GLN 5 HE21 GLN 5 14.268 2.634 1.293
53 HE22 GLN 5 HE22 GLN 5 12.993 2.718 2.457
54 H ASP 6 HN ASP 6 20.303 3.065 1.692
55 HA ASP 6 HA ASP 6 20.632 2.365 4.432
56 HB2 ASP 6 HB2 ASP 6 21.418 1.111 2.292
57 HB3 ASP 6 HB3 ASP 6 22.817 2.176 2.374
58 H ILE 7 HN ILE 7 23.457 2.651 4.682
59 HA ILE 7 HA ILE 7 23.794 5.570 4.847
60 HB ILE 7 HB ILE 7 24.768 3.749 7.035
61 HG12 ILE 7 HG12 ILE 7 22.142 5.253 7.023
62 HG13 ILE 7 HG13 ILE 7 22.288 3.515 6.791
63 HG21 ILE 7 HG21 ILE 7 24.224 6.709 6.861
64 HG22 ILE 7 HG22 ILE 7 24.683 5.865 8.340
65 HG23 ILE 7 HG23 ILE 7 25.797 5.919 6.973
66 HD11 ILE 7 HD11 ILE 7 21.647 4.113 9.076
67 HD12 ILE 7 HD12 ILE 7 23.191 3.264 9.016
68 HD13 ILE 7 HD13 ILE 7 23.154 5.010 9.254
69 H LEU 8 HN LEU 8 24.888 2.991 3.354
70 HA LEU 8 HA LEU 8 27.736 3.693 3.652
71 HB2 LEU 8 HB2 LEU 8 26.378 1.096 3.024
72 HB3 LEU 8 HB3 LEU 8 28.021 1.378 2.486
73 HG LEU 8 HG LEU 8 27.996 0.113 4.562
74 HD11 LEU 8 HD11 LEU 8 28.982 2.930 4.980
75 HD12 LEU 8 HD12 LEU 8 29.497 1.504 5.880
76 HD13 LEU 8 HD13 LEU 8 29.857 1.638 4.160
77 HD21 LEU 8 HD21 LEU 8 25.855 0.958 5.432
78 HD22 LEU 8 HD22 LEU 8 27.148 1.040 6.628
79 HD23 LEU 8 HD23 LEU 8 26.630 2.503 5.790
80 H ASN 9 HN ASN 9 25.077 3.848 1.623
81 HA ASN 9 HA ASN 9 26.788 4.214 -0.742
82 HB2 ASN 9 HB2 ASN 9 24.867 3.632 -2.124
83 HB3 ASN 9 HB3 ASN 9 25.181 2.346 -0.962
84 HD21 ASN 9 HD21 ASN 9 22.730 3.067 -2.398
85 HD22 ASN 9 HD22 ASN 9 21.533 3.332 -1.180
86 H LEU 10 HN LEU 10 24.319 5.556 1.298
87 HA LEU 10 HA LEU 10 24.822 8.201 0.362
88 HB2 LEU 10 HB2 LEU 10 23.353 7.355 -1.447
89 HB3 LEU 10 HB3 LEU 10 22.111 7.027 -0.255
90 HG LEU 10 HG LEU 10 22.042 9.466 0.271
91 HD11 LEU 10 HD11 LEU 10 23.076 11.033 -1.271
92 HD12 LEU 10 HD12 LEU 10 24.301 10.029 -0.497
93 HD13 LEU 10 HD13 LEU 10 23.814 9.700 -2.159
94 HD21 LEU 10 HD21 LEU 10 20.421 8.459 -1.239
95 HD22 LEU 10 HD22 LEU 10 20.830 10.093 -1.760
96 HD23 LEU 10 HD23 LEU 10 21.517 8.704 -2.599
97 H ARG 11 HN ARG 11 24.378 9.617 1.947
98 HA ARG 11 HA ARG 11 23.583 8.726 4.488
99 HB2 ARG 11 HB2 ARG 11 23.647 11.555 3.428
100 HB3 ARG 11 HB3 ARG 11 23.602 11.094 5.123
101 HG2 ARG 11 HG2 ARG 11 25.777 9.969 4.844
102 HG3 ARG 11 HG3 ARG 11 25.824 10.533 3.172
103 HD2 ARG 11 HD2 ARG 11 25.750 12.254 5.648
104 HD3 ARG 11 HD3 ARG 11 27.138 11.993 4.594
105 HE ARG 11 HE ARG 11 25.079 12.983 3.015
106 HH11 ARG 11 HH12 ARG 11 27.046 14.037 5.689
107 HH12 ARG 11 HH11 ARG 11 26.965 15.712 5.256
108 HH21 ARG 11 HH22 ARG 11 24.962 15.185 2.438
109 HH22 ARG 11 HH21 ARG 11 25.778 16.366 3.407
110 H THR 12 HN THR 12 21.805 10.066 5.717
111 HA THR 12 HA THR 12 19.306 9.469 4.349
112 HB THR 12 HB THR 12 19.772 10.271 7.228
113 HG1 THR 12 HG1 THR 12 19.139 7.692 6.206
114 HG21 THR 12 HG21 THR 12 17.514 10.798 6.492
115 HG22 THR 12 HG22 THR 12 17.487 9.412 7.579
116 HG23 THR 12 HG23 THR 12 17.325 9.171 5.840
117 H ASP 13 HN ASP 13 19.114 11.180 2.918
118 HA ASP 13 HA ASP 13 18.972 13.882 4.040
119 HB2 ASP 13 HB2 ASP 13 18.923 14.609 1.657
120 HB3 ASP 13 HB3 ASP 13 20.364 13.685 2.072
121 H ILE 14 HN ILE 14 16.926 11.533 4.052
122 HA ILE 14 HA ILE 14 14.663 11.307 4.069
123 HB ILE 14 HB ILE 14 14.655 14.323 3.898
124 HG12 ILE 14 HG12 ILE 14 15.899 13.507 5.845
125 HG13 ILE 14 HG13 ILE 14 14.387 14.260 6.339
126 HG21 ILE 14 HG21 ILE 14 12.505 13.400 3.279
127 HG22 ILE 14 HG22 ILE 14 12.491 12.397 4.730
128 HG23 ILE 14 HG23 ILE 14 12.402 14.154 4.870
129 HD11 ILE 14 HD11 ILE 14 14.833 12.244 7.614
130 HD12 ILE 14 HD12 ILE 14 13.384 12.056 6.626
131 HD13 ILE 14 HD13 ILE 14 14.897 11.300 6.125
132 H SER 15 HN SER 15 14.039 10.291 2.261
133 HA SER 15 HA SER 15 14.215 11.429 -0.341
134 HB2 SER 15 HB2 SER 15 14.325 8.995 0.048
135 HB3 SER 15 HB3 SER 15 12.649 9.011 0.596
136 HG SER 15 HG SER 15 12.325 10.056 -1.614
137 H THR 16 HN THR 16 12.500 12.006 -1.750
138 HA THR 16 HA THR 16 10.229 13.202 -0.343
139 HB THR 16 HB THR 16 9.855 14.490 -2.402
140 HG1 THR 16 HG1 THR 16 10.607 13.196 -4.023
141 HG21 THR 16 HG21 THR 16 11.370 15.384 -0.696
142 HG22 THR 16 HG22 THR 16 11.879 15.862 -2.314
143 HG23 THR 16 HG23 THR 16 12.726 14.566 -1.470
144 H SER 17 HN SER 17 10.839 10.339 -1.717
145 HA SER 17 HA SER 17 8.350 10.100 -3.220
146 HB2 SER 17 HB2 SER 17 10.384 9.082 -4.161
147 HB3 SER 17 HB3 SER 17 10.544 8.071 -2.725
148 HG SER 17 HG SER 17 8.074 7.848 -3.797
149 H SEP 18 HN SER 18 6.536 9.544 -2.223
150 HA SEP 18 HA SER 18 6.563 7.483 -0.178
151 HB2 SEP 18 HB2 SER 18 5.249 8.858 1.419
152 HB3 SEP 18 HB3 SER 18 6.874 9.489 1.166
153 H SER 19 HN SER 19 4.529 6.520 0.180
154 HA SER 19 HA SER 19 2.207 7.454 -1.251
155 HB2 SER 19 HB2 SER 19 1.946 5.421 -2.621
156 HB3 SER 19 HB3 SER 19 3.413 6.300 -3.051
157 HG SER 19 HG SER 19 3.188 3.781 -2.270
158 H SER 20 HN SER 20 0.526 5.434 -1.164
159 HA SER 20 HA SER 20 0.753 3.841 1.211
160 HB2 SER 20 HB2 SER 20 0.174 5.992 2.231
161 HB3 SER 20 HB3 SER 20 -1.236 6.123 1.180
162 HG SER 20 HG SER 20 -2.055 4.236 2.182
163 H ILE 21 HN ILE 21 0.060 2.005 0.314
164 HA ILE 21 HA ILE 21 -2.128 1.996 -1.586
165 HB ILE 21 HB ILE 21 -0.696 -0.406 -0.453
166 HG12 ILE 21 HG12 ILE 21 0.010 1.155 -2.950
167 HG13 ILE 21 HG13 ILE 21 0.902 1.249 -1.436
168 HG21 ILE 21 HG21 ILE 21 -2.203 0.022 -3.030
169 HG22 ILE 21 HG22 ILE 21 -1.410 -1.473 -2.533
170 HG23 ILE 21 HG23 ILE 21 -2.791 -0.863 -1.623
171 HD11 ILE 21 HD11 ILE 21 2.010 -0.210 -3.019
172 HD12 ILE 21 HD12 ILE 21 1.456 -1.119 -1.614
173 HD13 ILE 21 HD13 ILE 21 0.564 -1.212 -3.133
174 H SER 22 HN SER 22 -4.160 1.215 -1.240
175 HA SER 22 HA SER 22 -5.203 1.258 1.372
176 HB2 SER 22 HB2 SER 22 -6.567 1.781 -0.597
177 HB3 SER 22 HB3 SER 22 -6.425 0.112 -1.152
178 HG SER 22 HG SER 22 -8.221 -0.071 -0.046
179 H SER 23 HN SER 23 -5.069 -1.521 -0.868
180 HA SER 23 HA SER 23 -5.076 -3.299 1.471
181 HB2 SER 23 HB2 SER 23 -5.705 -3.902 -1.428
182 HB3 SER 23 HB3 SER 23 -5.779 -5.067 -0.106
183 HG SER 23 HG SER 23 -7.297 -2.673 -0.233
184 H SER 24 HN SER 24 -3.772 -5.298 1.294
185 HA SER 24 HA SER 24 -1.278 -4.851 -0.209
186 HB2 SER 24 HB2 SER 24 -0.032 -5.828 1.689
187 HB3 SER 24 HB3 SER 24 -0.890 -4.361 2.158
188 HG SER 24 HG SER 24 -1.906 -6.979 2.549
189 H GLU 25 HN GLU 25 -3.908 -6.767 0.088
190 HA GLU 25 HA GLU 25 -2.492 -9.049 -1.078
191 HB2 GLU 25 HB2 GLU 25 -4.058 -10.574 0.221
192 HB3 GLU 25 HB3 GLU 25 -2.764 -9.818 1.138
193 HG2 GLU 25 HG2 GLU 25 -4.724 -9.713 2.457
194 HG3 GLU 25 HG3 GLU 25 -4.403 -8.082 1.870
195 H GLU 26 HN GLU 26 -4.170 -10.663 -1.989
196 HA GLU 26 HA GLU 26 -6.429 -9.172 -3.149
197 HB2 GLU 26 HB2 GLU 26 -4.651 -9.351 -4.819
198 HB3 GLU 26 HB3 GLU 26 -4.594 -11.094 -4.594
199 HG2 GLU 26 HG2 GLU 26 -6.834 -11.315 -5.474
200 HG3 GLU 26 HG3 GLU 26 -6.977 -9.565 -5.616
201 H ASN 27 HN ASN 27 -8.301 -10.337 -3.569
202 HA ASN 27 HA ASN 27 -8.783 -12.546 -1.846
203 HB2 ASN 27 HB2 ASN 27 -11.041 -12.558 -2.946
204 HB3 ASN 27 HB3 ASN 27 -10.571 -11.002 -2.269
205 HD21 ASN 27 HD21 ASN 27 -10.035 -9.310 -3.648
206 HD22 ASN 27 HD22 ASN 27 -10.473 -9.320 -5.319
207 H ASP 28 HN ASP 28 -8.619 -14.659 -2.214
208 HA ASP 28 HA ASP 28 -8.943 -15.803 -4.826
209 HB2 ASP 28 HB2 ASP 28 -6.637 -15.052 -5.041
210 HB3 ASP 28 HB3 ASP 28 -6.209 -15.843 -3.528
211 H PHE 29 HN PHE 29 -10.007 -17.625 -4.492
212 HA PHE 29 HA PHE 29 -10.716 -19.596 -3.609
213 HB2 PHE 29 HB2 PHE 29 -8.184 -20.001 -3.531
214 HB3 PHE 29 HB3 PHE 29 -8.290 -19.606 -1.819
215 HD1 PHE 29 HD1 PHE 29 -9.697 -21.889 -4.390
216 HD2 PHE 29 HD2 PHE 29 -8.813 -21.258 -0.276
217 HE1 PHE 29 HE1 PHE 29 -10.316 -24.220 -3.903
218 HE2 PHE 29 HE2 PHE 29 -9.431 -23.587 0.218
219 HZ PHE 29 HZ PHE 29 -10.182 -25.072 -1.598
220 H TRP 30 HN TRP 30 -10.655 -16.790 -2.074
221 HA TRP 30 HA TRP 30 -12.112 -17.843 0.241
222 HB2 TRP 30 HB2 TRP 30 -10.034 -15.663 0.218
223 HB3 TRP 30 HB3 TRP 30 -11.206 -15.846 1.524
224 HD1 TRP 30 HD1 TRP 30 -7.980 -17.239 0.229
225 HE1 TRP 30 HE1 TRP 30 -7.144 -19.092 1.818
226 HE3 TRP 30 HE3 TRP 30 -12.172 -17.780 3.066
227 HZ2 TRP 30 HZ2 TRP 30 -8.156 -20.595 3.995
228 HZ3 TRP 30 HZ3 TRP 30 -12.174 -19.451 4.883
229 HH2 TRP 30 HH2 TRP 30 -10.207 -20.827 5.332
230 H GLN 31 HN GLN 31 -14.008 -17.496 -0.829
231 HA GLN 31 HA GLN 31 -15.838 -16.378 -1.562
232 HB2 GLN 31 HB2 GLN 31 -14.720 -14.396 0.412
233 HB3 GLN 31 HB3 GLN 31 -16.275 -14.179 -0.377
234 HG2 GLN 31 HG2 GLN 31 -17.110 -16.211 0.607
235 HG3 GLN 31 HG3 GLN 31 -15.531 -16.552 1.313
236 HE21 GLN 31 HE21 GLN 31 -14.848 -15.395 3.101
237 HE22 GLN 31 HE22 GLN 31 -15.923 -14.424 4.044
238 HA PRO 32 HA PRO 32 -13.208 -13.716 -4.427
239 HB2 PRO 32 HB2 PRO 32 -13.633 -15.721 -6.486
240 HB3 PRO 32 HB3 PRO 32 -12.113 -15.107 -5.834
241 HG2 PRO 32 HG2 PRO 32 -13.004 -17.642 -5.408
242 HG3 PRO 32 HG3 PRO 32 -11.960 -16.768 -4.271
243 HD2 PRO 32 HD2 PRO 32 -14.919 -17.221 -4.165
244 HD3 PRO 32 HD3 PRO 32 -13.720 -17.263 -2.856
245 H LYS 33 HN LYS 33 -14.637 -12.138 -4.869
246 HA LYS 33 HA LYS 33 -16.879 -12.801 -6.659
247 HB2 LYS 33 HB2 LYS 33 -16.791 -11.075 -4.224
248 HB3 LYS 33 HB3 LYS 33 -17.848 -10.598 -5.545
249 HG2 LYS 33 HG2 LYS 33 -19.187 -11.850 -4.086
250 HG3 LYS 33 HG3 LYS 33 -18.822 -12.932 -5.431
251 HD2 LYS 33 HD2 LYS 33 -17.067 -13.995 -4.107
252 HD3 LYS 33 HD3 LYS 33 -17.400 -12.896 -2.768
253 HE2 LYS 33 HE2 LYS 33 -19.678 -13.791 -2.612
254 HE3 LYS 33 HE3 LYS 33 -19.327 -14.902 -3.935
255 HZ1 LYS 33 HZ1 LYS 33 -17.595 -15.907 -2.562
256 HZ2 LYS 33 HZ2 LYS 33 -19.106 -16.005 -1.810
257 HZ3 LYS 33 HZ3 LYS 33 -17.977 -14.859 -1.290
258 HA PRO 34 HA PRO 34 -15.245 -9.971 -9.612
259 HB2 PRO 34 HB2 PRO 34 -17.568 -8.717 -10.442
260 HB3 PRO 34 HB3 PRO 34 -16.989 -10.274 -11.041
261 HG2 PRO 34 HG2 PRO 34 -19.045 -9.693 -8.950
262 HG3 PRO 34 HG3 PRO 34 -19.051 -10.936 -10.214
263 HD2 PRO 34 HD2 PRO 34 -18.465 -11.541 -7.673
264 HD3 PRO 34 HD3 PRO 34 -17.623 -12.328 -9.026
265 H THR 35 HN THR 35 -14.099 -8.279 -8.972
266 HA THR 35 HA THR 35 -14.776 -6.493 -6.940
267 HB THR 35 HB THR 35 -12.920 -5.090 -7.774
268 HG1 THR 35 HG1 THR 35 -12.947 -6.946 -9.940
269 HG21 THR 35 HG21 THR 35 -12.450 -7.050 -6.366
270 HG22 THR 35 HG22 THR 35 -11.148 -6.748 -7.518
271 HG23 THR 35 HG23 THR 35 -12.305 -8.047 -7.813
Start of MODEL 19
1 H1 GLU 1 H1 GLU 1 30.087 6.773 11.242
2 H2 GLU 1 H2 GLU 1 29.011 7.252 12.457
3 H3 GLU 1 H3 GLU 1 30.608 7.809 12.474
4 HA GLU 1 HA GLU 1 29.128 9.535 11.717
5 HB2 GLU 1 HB2 GLU 1 30.867 8.390 9.522
6 HB3 GLU 1 HB3 GLU 1 30.261 10.040 9.578
7 HG2 GLU 1 HG2 GLU 1 32.129 8.779 11.575
8 HG3 GLU 1 HG3 GLU 1 32.582 9.907 10.298
9 H LYS 2 HN LYS 2 28.682 6.464 10.192
10 HA LYS 2 HA LYS 2 27.050 5.604 8.863
11 HB2 LYS 2 HB2 LYS 2 25.482 7.977 9.884
12 HB3 LYS 2 HB3 LYS 2 24.794 6.561 9.106
13 HG2 LYS 2 HG2 LYS 2 25.648 5.165 10.943
14 HG3 LYS 2 HG3 LYS 2 26.251 6.620 11.736
15 HD2 LYS 2 HD2 LYS 2 23.361 6.261 10.979
16 HD3 LYS 2 HD3 LYS 2 24.007 5.740 12.537
17 HE2 LYS 2 HE2 LYS 2 23.144 7.869 12.958
18 HE3 LYS 2 HE3 LYS 2 24.876 8.135 12.769
19 HZ1 LYS 2 HZ1 LYS 2 23.501 9.777 11.584
20 HZ2 LYS 2 HZ2 LYS 2 22.872 8.542 10.616
21 HZ3 LYS 2 HZ3 LYS 2 24.518 8.916 10.545
22 H LEU 3 HN LEU 3 25.116 6.651 7.251
23 HA LEU 3 HA LEU 3 26.097 8.808 5.659
24 HB2 LEU 3 HB2 LEU 3 27.582 7.011 4.897
25 HB3 LEU 3 HB3 LEU 3 26.189 6.010 4.530
26 HG LEU 3 HG LEU 3 25.490 7.644 2.808
27 HD11 LEU 3 HD11 LEU 3 27.069 9.378 2.099
28 HD12 LEU 3 HD12 LEU 3 26.498 9.645 3.745
29 HD13 LEU 3 HD13 LEU 3 28.109 8.984 3.468
30 HD21 LEU 3 HD21 LEU 3 28.316 6.636 2.487
31 HD22 LEU 3 HD22 LEU 3 26.849 5.698 2.206
32 HD23 LEU 3 HD23 LEU 3 27.217 7.088 1.185
33 H LYS 4 HN LYS 4 24.454 9.744 4.595
34 HA LYS 4 HA LYS 4 21.836 8.484 4.785
35 HB2 LYS 4 HB2 LYS 4 22.608 11.276 3.923
36 HB3 LYS 4 HB3 LYS 4 20.969 10.701 4.194
37 HG2 LYS 4 HG2 LYS 4 21.269 10.557 6.500
38 HG3 LYS 4 HG3 LYS 4 23.029 10.585 6.365
39 HD2 LYS 4 HD2 LYS 4 22.940 12.912 5.629
40 HD3 LYS 4 HD3 LYS 4 21.178 12.887 5.732
41 HE2 LYS 4 HE2 LYS 4 21.384 12.368 8.153
42 HE3 LYS 4 HE3 LYS 4 23.132 12.553 8.008
43 HZ1 LYS 4 HZ1 LYS 4 22.150 14.577 8.827
44 HZ2 LYS 4 HZ2 LYS 4 21.096 14.657 7.506
45 HZ3 LYS 4 HZ3 LYS 4 22.760 14.848 7.272
46 H GLN 5 HN GLN 5 20.334 9.137 2.841
47 HA GLN 5 HA GLN 5 21.331 7.705 0.578
48 HB2 GLN 5 HB2 GLN 5 19.104 8.159 -0.399
49 HB3 GLN 5 HB3 GLN 5 19.008 7.473 1.218
50 HG2 GLN 5 HG2 GLN 5 18.493 9.615 2.162
51 HG3 GLN 5 HG3 GLN 5 18.766 10.409 0.612
52 HE21 GLN 5 HE21 GLN 5 16.394 10.347 2.330
53 HE22 GLN 5 HE22 GLN 5 15.113 9.739 1.343
54 H ASP 6 HN ASP 6 21.136 8.530 -1.654
55 HA ASP 6 HA ASP 6 21.488 11.403 -1.979
56 HB2 ASP 6 HB2 ASP 6 23.534 9.405 -2.972
57 HB3 ASP 6 HB3 ASP 6 23.560 11.142 -3.254
58 H ILE 7 HN ILE 7 22.139 11.572 -4.583
59 HA ILE 7 HA ILE 7 19.802 10.391 -5.874
60 HB ILE 7 HB ILE 7 21.632 12.333 -7.239
61 HG12 ILE 7 HG12 ILE 7 19.449 13.079 -5.276
62 HG13 ILE 7 HG13 ILE 7 21.177 13.265 -4.990
63 HG21 ILE 7 HG21 ILE 7 18.652 11.866 -7.339
64 HG22 ILE 7 HG22 ILE 7 19.545 13.028 -8.319
65 HG23 ILE 7 HG23 ILE 7 19.833 11.299 -8.520
66 HD11 ILE 7 HD11 ILE 7 21.294 14.838 -6.872
67 HD12 ILE 7 HD12 ILE 7 19.552 14.678 -7.092
68 HD13 ILE 7 HD13 ILE 7 20.192 15.379 -5.603
69 H LEU 8 HN LEU 8 22.366 8.923 -5.279
70 HA LEU 8 HA LEU 8 22.753 7.873 -7.989
71 HB2 LEU 8 HB2 LEU 8 24.985 8.451 -6.040
72 HB3 LEU 8 HB3 LEU 8 25.168 7.629 -7.578
73 HG LEU 8 HG LEU 8 24.256 10.491 -7.252
74 HD11 LEU 8 HD11 LEU 8 26.588 10.179 -6.581
75 HD12 LEU 8 HD12 LEU 8 26.925 9.396 -8.125
76 HD13 LEU 8 HD13 LEU 8 26.459 11.097 -8.083
77 HD21 LEU 8 HD21 LEU 8 24.579 10.633 -9.659
78 HD22 LEU 8 HD22 LEU 8 25.030 8.930 -9.716
79 HD23 LEU 8 HD23 LEU 8 23.389 9.393 -9.268
80 H ASN 9 HN ASN 9 22.035 7.316 -4.791
81 HA ASN 9 HA ASN 9 22.422 4.437 -5.155
82 HB2 ASN 9 HB2 ASN 9 23.087 4.263 -2.735
83 HB3 ASN 9 HB3 ASN 9 24.282 5.035 -3.773
84 HD21 ASN 9 HD21 ASN 9 21.874 5.543 -1.302
85 HD22 ASN 9 HD22 ASN 9 22.428 7.102 -0.808
86 H LEU 10 HN LEU 10 20.158 6.485 -5.137
87 HA LEU 10 HA LEU 10 18.560 5.737 -2.865
88 HB2 LEU 10 HB2 LEU 10 16.751 6.981 -4.169
89 HB3 LEU 10 HB3 LEU 10 18.131 7.902 -3.606
90 HG LEU 10 HG LEU 10 19.107 7.656 -5.926
91 HD11 LEU 10 HD11 LEU 10 17.820 5.781 -6.727
92 HD12 LEU 10 HD12 LEU 10 16.317 6.681 -6.518
93 HD13 LEU 10 HD13 LEU 10 17.489 7.190 -7.734
94 HD21 LEU 10 HD21 LEU 10 17.720 9.442 -6.855
95 HD22 LEU 10 HD22 LEU 10 16.488 9.119 -5.636
96 HD23 LEU 10 HD23 LEU 10 18.074 9.718 -5.150
97 H ARG 11 HN ARG 11 19.501 3.872 -5.200
98 HA ARG 11 HA ARG 11 16.994 2.817 -6.162
99 HB2 ARG 11 HB2 ARG 11 19.803 1.734 -6.444
100 HB3 ARG 11 HB3 ARG 11 18.386 1.150 -7.307
101 HG2 ARG 11 HG2 ARG 11 18.149 3.315 -8.398
102 HG3 ARG 11 HG3 ARG 11 19.571 3.907 -7.538
103 HD2 ARG 11 HD2 ARG 11 19.537 1.574 -9.447
104 HD3 ARG 11 HD3 ARG 11 20.078 3.203 -9.846
105 HE ARG 11 HE ARG 11 21.428 2.018 -7.593
106 HH11 ARG 11 HH12 ARG 11 21.399 2.421 -11.054
107 HH12 ARG 11 HH11 ARG 11 23.090 2.096 -11.236
108 HH21 ARG 11 HH22 ARG 11 23.655 1.589 -7.822
109 HH22 ARG 11 HH21 ARG 11 24.372 1.618 -9.398
110 H THR 12 HN THR 12 18.874 2.430 -3.380
111 HA THR 12 HA THR 12 17.578 -0.157 -2.810
112 HB THR 12 HB THR 12 19.973 -0.466 -2.889
113 HG1 THR 12 HG1 THR 12 18.797 -1.540 -1.193
114 HG21 THR 12 HG21 THR 12 21.478 0.738 -1.360
115 HG22 THR 12 HG22 THR 12 20.126 1.738 -0.829
116 HG23 THR 12 HG23 THR 12 20.689 1.831 -2.497
117 H ASP 13 HN ASP 13 18.463 3.008 -1.549
118 HA ASP 13 HA ASP 13 16.589 2.559 0.682
119 HB2 ASP 13 HB2 ASP 13 19.064 4.303 0.663
120 HB3 ASP 13 HB3 ASP 13 17.925 4.165 2.001
121 H ILE 14 HN ILE 14 14.800 3.709 0.486
122 HA ILE 14 HA ILE 14 14.889 6.504 -0.201
123 HB ILE 14 HB ILE 14 14.854 5.609 -2.438
124 HG12 ILE 14 HG12 ILE 14 12.677 6.530 -3.253
125 HG13 ILE 14 HG13 ILE 14 12.138 6.633 -1.578
126 HG21 ILE 14 HG21 ILE 14 14.007 3.380 -1.918
127 HG22 ILE 14 HG22 ILE 14 12.408 4.054 -1.609
128 HG23 ILE 14 HG23 ILE 14 13.093 4.121 -3.233
129 HD11 ILE 14 HD11 ILE 14 12.898 8.785 -2.386
130 HD12 ILE 14 HD12 ILE 14 13.951 8.198 -1.098
131 HD13 ILE 14 HD13 ILE 14 14.475 8.099 -2.779
132 H SER 15 HN SER 15 13.421 7.530 0.983
133 HA SER 15 HA SER 15 10.811 6.419 1.482
134 HB2 SER 15 HB2 SER 15 12.725 6.843 3.790
135 HB3 SER 15 HB3 SER 15 11.005 6.495 3.949
136 HG SER 15 HG SER 15 11.462 4.470 3.702
137 H THR 16 HN THR 16 9.325 7.955 2.259
138 HA THR 16 HA THR 16 10.284 10.646 2.815
139 HB THR 16 HB THR 16 8.332 10.139 0.560
140 HG1 THR 16 HG1 THR 16 10.583 9.640 0.088
141 HG21 THR 16 HG21 THR 16 9.600 12.690 1.566
142 HG22 THR 16 HG22 THR 16 7.909 12.228 1.757
143 HG23 THR 16 HG23 THR 16 8.559 12.548 0.149
144 H SER 17 HN SER 17 9.405 10.204 4.887
145 HA SER 17 HA SER 17 7.826 10.211 6.522
146 HB2 SER 17 HB2 SER 17 6.266 11.727 4.418
147 HB3 SER 17 HB3 SER 17 5.880 11.682 6.139
148 HG SER 17 HG SER 17 7.166 13.528 5.345
149 H SEP 18 HN SER 18 7.747 8.091 4.321
150 HA SEP 18 HA SER 18 6.544 6.235 3.807
151 HB2 SEP 18 HB2 SER 18 6.512 5.925 6.238
152 HB3 SEP 18 HB3 SER 18 5.069 6.932 6.359
153 H SER 19 HN SER 19 5.604 6.930 1.912
154 HA SER 19 HA SER 19 3.216 8.504 1.866
155 HB2 SER 19 HB2 SER 19 3.239 8.063 -0.560
156 HB3 SER 19 HB3 SER 19 4.823 8.583 0.010
157 HG SER 19 HG SER 19 5.582 6.547 -0.201
158 H SER 20 HN SER 20 1.497 7.423 0.143
159 HA SER 20 HA SER 20 0.865 4.696 0.906
160 HB2 SER 20 HB2 SER 20 -1.012 6.982 1.562
161 HB3 SER 20 HB3 SER 20 -1.396 5.268 1.718
162 HG SER 20 HG SER 20 0.236 6.882 3.290
163 H ILE 21 HN ILE 21 0.675 3.880 -1.082
164 HA ILE 21 HA ILE 21 -1.249 5.155 -2.908
165 HB ILE 21 HB ILE 21 0.139 4.537 -4.830
166 HG12 ILE 21 HG12 ILE 21 2.285 3.836 -2.816
167 HG13 ILE 21 HG13 ILE 21 1.314 2.642 -3.671
168 HG21 ILE 21 HG21 ILE 21 1.875 6.233 -4.550
169 HG22 ILE 21 HG22 ILE 21 0.335 6.778 -3.888
170 HG23 ILE 21 HG23 ILE 21 1.611 6.221 -2.805
171 HD11 ILE 21 HD11 ILE 21 3.476 2.902 -4.719
172 HD12 ILE 21 HD12 ILE 21 2.201 3.466 -5.799
173 HD13 ILE 21 HD13 ILE 21 3.194 4.633 -4.922
174 H SER 22 HN SER 22 -1.060 2.716 -0.996
175 HA SER 22 HA SER 22 -1.164 0.354 -2.466
176 HB2 SER 22 HB2 SER 22 -1.047 0.380 -0.019
177 HB3 SER 22 HB3 SER 22 -2.674 1.057 0.063
178 HG SER 22 HG SER 22 -2.638 -1.224 0.362
179 H SER 23 HN SER 23 -2.368 0.148 -4.249
180 HA SER 23 HA SER 23 -5.046 1.268 -4.364
181 HB2 SER 23 HB2 SER 23 -3.448 -0.235 -6.450
182 HB3 SER 23 HB3 SER 23 -5.004 0.548 -6.724
183 HG SER 23 HG SER 23 -3.885 2.273 -7.108
184 H SER 24 HN SER 24 -3.480 -1.907 -4.463
185 HA SER 24 HA SER 24 -6.112 -3.124 -3.946
186 HB2 SER 24 HB2 SER 24 -3.849 -4.299 -5.576
187 HB3 SER 24 HB3 SER 24 -5.365 -5.115 -5.195
188 HG SER 24 HG SER 24 -5.840 -4.245 -7.091
189 H GLU 25 HN GLU 25 -6.020 -5.191 -2.791
190 HA GLU 25 HA GLU 25 -3.606 -5.782 -1.302
191 HB2 GLU 25 HB2 GLU 25 -4.668 -3.987 0.026
192 HB3 GLU 25 HB3 GLU 25 -6.139 -4.946 0.129
193 HG2 GLU 25 HG2 GLU 25 -4.939 -5.167 2.178
194 HG3 GLU 25 HG3 GLU 25 -4.850 -6.700 1.313
195 H GLU 26 HN GLU 26 -7.114 -6.385 -1.429
196 HA GLU 26 HA GLU 26 -6.533 -9.271 -1.454
197 HB2 GLU 26 HB2 GLU 26 -8.760 -7.862 0.028
198 HB3 GLU 26 HB3 GLU 26 -8.657 -9.606 -0.178
199 HG2 GLU 26 HG2 GLU 26 -6.583 -7.921 1.208
200 HG3 GLU 26 HG3 GLU 26 -7.866 -8.813 2.024
201 H ASN 27 HN ASN 27 -7.359 -10.311 -3.147
202 HA ASN 27 HA ASN 27 -9.072 -8.890 -4.994
203 HB2 ASN 27 HB2 ASN 27 -8.710 -10.791 -6.482
204 HB3 ASN 27 HB3 ASN 27 -7.176 -10.240 -5.816
205 HD21 ASN 27 HD21 ASN 27 -6.083 -11.520 -4.347
206 HD22 ASN 27 HD22 ASN 27 -6.473 -13.186 -4.100
207 H ASP 28 HN ASP 28 -11.141 -9.475 -5.614
208 HA ASP 28 HA ASP 28 -12.447 -11.717 -4.319
209 HB2 ASP 28 HB2 ASP 28 -14.317 -10.254 -3.498
210 HB3 ASP 28 HB3 ASP 28 -12.797 -10.046 -2.636
211 H PHE 29 HN PHE 29 -13.724 -12.682 -5.732
212 HA PHE 29 HA PHE 29 -15.488 -11.309 -7.479
213 HB2 PHE 29 HB2 PHE 29 -13.363 -10.941 -8.709
214 HB3 PHE 29 HB3 PHE 29 -13.135 -12.685 -8.792
215 HD1 PHE 29 HD2 PHE 29 -15.080 -9.839 -10.034
216 HD2 PHE 29 HD1 PHE 29 -14.422 -14.035 -10.309
217 HE1 PHE 29 HE2 PHE 29 -16.374 -9.902 -12.126
218 HE2 PHE 29 HE1 PHE 29 -15.713 -14.104 -12.402
219 HZ PHE 29 HZ PHE 29 -16.709 -12.038 -13.302
220 H TRP 30 HN TRP 30 -13.786 -14.218 -6.614
221 HA TRP 30 HA TRP 30 -15.915 -15.903 -7.668
222 HB2 TRP 30 HB2 TRP 30 -13.265 -16.611 -6.381
223 HB3 TRP 30 HB3 TRP 30 -14.405 -17.776 -7.050
224 HD1 TRP 30 HD1 TRP 30 -11.390 -15.994 -8.003
225 HE1 TRP 30 HE1 TRP 30 -11.092 -15.972 -10.562
226 HE3 TRP 30 HE3 TRP 30 -16.092 -17.435 -9.361
227 HZ2 TRP 30 HZ2 TRP 30 -12.658 -16.495 -12.858
228 HZ3 TRP 30 HZ3 TRP 30 -16.618 -17.647 -11.762
229 HH2 TRP 30 HH2 TRP 30 -14.936 -17.186 -13.470
230 H GLN 31 HN GLN 31 -15.225 -17.918 -5.485
231 HA GLN 31 HA GLN 31 -16.872 -16.701 -3.383
232 HB2 GLN 31 HB2 GLN 31 -16.785 -19.588 -4.276
233 HB3 GLN 31 HB3 GLN 31 -17.723 -18.980 -2.920
234 HG2 GLN 31 HG2 GLN 31 -18.996 -17.553 -4.454
235 HG3 GLN 31 HG3 GLN 31 -18.075 -18.209 -5.807
236 HE21 GLN 31 HE21 GLN 31 -19.918 -19.023 -6.795
237 HE22 GLN 31 HE22 GLN 31 -20.751 -20.411 -6.192
238 HA PRO 32 HA PRO 32 -12.748 -17.591 -1.460
239 HB2 PRO 32 HB2 PRO 32 -13.789 -15.526 0.392
240 HB3 PRO 32 HB3 PRO 32 -12.216 -15.634 -0.404
241 HG2 PRO 32 HG2 PRO 32 -14.039 -13.856 -1.200
242 HG3 PRO 32 HG3 PRO 32 -12.994 -14.691 -2.365
243 HD2 PRO 32 HD2 PRO 32 -15.861 -15.204 -1.682
244 HD3 PRO 32 HD3 PRO 32 -15.055 -15.238 -3.264
245 H LYS 33 HN LYS 33 -12.265 -18.053 0.890
246 HA LYS 33 HA LYS 33 -12.615 -19.193 2.825
247 HB2 LYS 33 HB2 LYS 33 -15.414 -18.182 2.346
248 HB3 LYS 33 HB3 LYS 33 -15.047 -19.244 3.696
249 HG2 LYS 33 HG2 LYS 33 -15.025 -16.992 4.479
250 HG3 LYS 33 HG3 LYS 33 -13.365 -17.587 4.467
251 HD2 LYS 33 HD2 LYS 33 -12.933 -16.414 2.384
252 HD3 LYS 33 HD3 LYS 33 -14.614 -15.879 2.314
253 HE2 LYS 33 HE2 LYS 33 -14.317 -14.585 4.340
254 HE3 LYS 33 HE3 LYS 33 -12.667 -15.181 4.510
255 HZ1 LYS 33 HZ1 LYS 33 -12.079 -14.067 2.460
256 HZ2 LYS 33 HZ2 LYS 33 -12.735 -12.956 3.553
257 HZ3 LYS 33 HZ3 LYS 33 -13.667 -13.521 2.260
258 HA PRO 34 HA PRO 34 -13.370 -23.490 2.137
259 HB2 PRO 34 HB2 PRO 34 -15.801 -23.191 3.873
260 HB3 PRO 34 HB3 PRO 34 -14.598 -24.486 3.851
261 HG2 PRO 34 HG2 PRO 34 -14.517 -22.518 5.678
262 HG3 PRO 34 HG3 PRO 34 -13.044 -23.249 5.021
263 HD2 PRO 34 HD2 PRO 34 -14.135 -20.557 4.595
264 HD3 PRO 34 HD3 PRO 34 -12.499 -21.168 4.288
265 H THR 35 HN THR 35 -13.895 -23.273 -0.032
266 HA THR 35 HA THR 35 -16.165 -22.302 -1.194
267 HB THR 35 HB THR 35 -14.444 -22.875 -2.669
268 HG1 THR 35 HG1 THR 35 -16.134 -23.395 -3.883
269 HG21 THR 35 HG21 THR 35 -14.563 -25.688 -1.575
270 HG22 THR 35 HG22 THR 35 -13.279 -24.508 -1.303
271 HG23 THR 35 HG23 THR 35 -13.547 -25.163 -2.919
Start of MODEL 20
1 H1 GLU 1 H1 GLU 1 31.059 4.826 -5.023
2 H2 GLU 1 H2 GLU 1 29.460 5.371 -5.071
3 H3 GLU 1 H3 GLU 1 30.018 4.509 -3.728
4 HA GLU 1 HA GLU 1 31.564 6.285 -3.200
5 HB2 GLU 1 HB2 GLU 1 30.257 7.565 -5.602
6 HB3 GLU 1 HB3 GLU 1 31.133 8.493 -4.393
7 HG2 GLU 1 HG2 GLU 1 32.564 8.071 -6.266
8 HG3 GLU 1 HG3 GLU 1 33.151 7.166 -4.873
9 H LYS 2 HN LYS 2 30.757 6.845 -1.304
10 HA LYS 2 HA LYS 2 29.354 7.566 0.333
11 HB2 LYS 2 HB2 LYS 2 27.934 9.107 -1.842
12 HB3 LYS 2 HB3 LYS 2 27.975 9.475 -0.123
13 HG2 LYS 2 HG2 LYS 2 30.333 9.578 -1.995
14 HG3 LYS 2 HG3 LYS 2 29.415 10.966 -1.410
15 HD2 LYS 2 HD2 LYS 2 30.074 10.452 0.881
16 HD3 LYS 2 HD3 LYS 2 30.960 9.031 0.319
17 HE2 LYS 2 HE2 LYS 2 31.548 11.907 -0.379
18 HE3 LYS 2 HE3 LYS 2 32.482 10.882 0.711
19 HZ1 LYS 2 HZ1 LYS 2 32.991 9.431 -1.156
20 HZ2 LYS 2 HZ2 LYS 2 33.505 11.012 -1.470
21 HZ3 LYS 2 HZ3 LYS 2 32.099 10.421 -2.199
22 H LEU 3 HN LEU 3 26.746 8.026 0.628
23 HA LEU 3 HA LEU 3 25.073 6.198 -0.784
24 HB2 LEU 3 HB2 LEU 3 26.365 4.655 0.679
25 HB3 LEU 3 HB3 LEU 3 25.752 5.516 2.076
26 HG LEU 3 HG LEU 3 23.436 4.875 1.375
27 HD11 LEU 3 HD11 LEU 3 23.194 3.036 -0.229
28 HD12 LEU 3 HD12 LEU 3 23.852 4.488 -0.985
29 HD13 LEU 3 HD13 LEU 3 24.916 3.138 -0.594
30 HD21 LEU 3 HD21 LEU 3 24.600 3.641 3.112
31 HD22 LEU 3 HD22 LEU 3 23.631 2.546 2.126
32 HD23 LEU 3 HD23 LEU 3 25.378 2.628 1.896
33 H LYS 4 HN LYS 4 23.000 6.841 -0.631
34 HA LYS 4 HA LYS 4 22.386 8.914 1.360
35 HB2 LYS 4 HB2 LYS 4 20.898 8.276 -1.192
36 HB3 LYS 4 HB3 LYS 4 20.623 9.651 -0.133
37 HG2 LYS 4 HG2 LYS 4 21.838 10.589 -1.845
38 HG3 LYS 4 HG3 LYS 4 23.095 10.229 -0.662
39 HD2 LYS 4 HD2 LYS 4 23.745 8.256 -1.854
40 HD3 LYS 4 HD3 LYS 4 22.362 8.398 -2.942
41 HE2 LYS 4 HE2 LYS 4 24.399 9.160 -4.034
42 HE3 LYS 4 HE3 LYS 4 23.267 10.495 -3.819
43 HZ1 LYS 4 HZ1 LYS 4 25.513 11.157 -3.256
44 HZ2 LYS 4 HZ2 LYS 4 25.624 9.925 -2.103
45 HZ3 LYS 4 HZ3 LYS 4 24.532 11.196 -1.877
46 H GLN 5 HN GLN 5 20.775 6.216 -0.324
47 HA GLN 5 HA GLN 5 19.286 5.670 2.159
48 HB2 GLN 5 HB2 GLN 5 17.354 4.998 0.733
49 HB3 GLN 5 HB3 GLN 5 17.731 6.715 0.656
50 HG2 GLN 5 HG2 GLN 5 18.943 6.311 -1.460
51 HG3 GLN 5 HG3 GLN 5 18.434 4.623 -1.391
52 HE21 GLN 5 HE21 GLN 5 17.870 6.674 -3.388
53 HE22 GLN 5 HE22 GLN 5 16.150 6.788 -3.484
54 H ASP 6 HN ASP 6 17.944 3.422 1.390
55 HA ASP 6 HA ASP 6 20.133 1.527 0.846
56 HB2 ASP 6 HB2 ASP 6 17.605 1.106 2.458
57 HB3 ASP 6 HB3 ASP 6 18.855 -0.102 2.180
58 H ILE 7 HN ILE 7 20.015 0.778 -1.163
59 HA ILE 7 HA ILE 7 17.729 0.873 -2.793
60 HB ILE 7 HB ILE 7 20.033 0.806 -3.666
61 HG12 ILE 7 HG12 ILE 7 18.362 -1.513 -4.650
62 HG13 ILE 7 HG13 ILE 7 18.060 0.172 -5.056
63 HG21 ILE 7 HG21 ILE 7 21.241 -1.314 -3.785
64 HG22 ILE 7 HG22 ILE 7 20.960 -0.830 -2.111
65 HG23 ILE 7 HG23 ILE 7 19.969 -2.093 -2.843
66 HD11 ILE 7 HD11 ILE 7 20.244 0.296 -6.144
67 HD12 ILE 7 HD12 ILE 7 20.529 -1.398 -5.747
68 HD13 ILE 7 HD13 ILE 7 19.226 -0.960 -6.851
69 H LEU 8 HN LEU 8 18.925 -1.557 -0.599
70 HA LEU 8 HA LEU 8 16.479 -3.034 -0.822
71 HB2 LEU 8 HB2 LEU 8 18.060 -3.867 -2.654
72 HB3 LEU 8 HB3 LEU 8 19.039 -4.519 -1.353
73 HG LEU 8 HG LEU 8 17.170 -5.932 -0.641
74 HD11 LEU 8 HD11 LEU 8 15.733 -4.869 -3.066
75 HD12 LEU 8 HD12 LEU 8 15.135 -6.064 -1.913
76 HD13 LEU 8 HD13 LEU 8 15.383 -4.393 -1.403
77 HD21 LEU 8 HD21 LEU 8 18.778 -6.800 -2.244
78 HD22 LEU 8 HD22 LEU 8 17.167 -7.440 -2.571
79 HD23 LEU 8 HD23 LEU 8 17.824 -6.147 -3.575
80 H ASN 9 HN ASN 9 19.300 -2.087 0.744
81 HA ASN 9 HA ASN 9 19.589 -4.020 2.747
82 HB2 ASN 9 HB2 ASN 9 20.035 -1.071 3.194
83 HB3 ASN 9 HB3 ASN 9 20.888 -2.423 3.929
84 HD21 ASN 9 HD21 ASN 9 20.564 -0.416 1.127
85 HD22 ASN 9 HD22 ASN 9 21.999 -0.950 0.326
86 H LEU 10 HN LEU 10 17.408 -1.308 2.402
87 HA LEU 10 HA LEU 10 15.462 -2.349 4.123
88 HB2 LEU 10 HB2 LEU 10 17.151 -1.774 5.855
89 HB3 LEU 10 HB3 LEU 10 17.049 -0.098 5.356
90 HG LEU 10 HG LEU 10 14.632 -0.118 5.989
91 HD11 LEU 10 HD11 LEU 10 15.337 -2.815 7.138
92 HD12 LEU 10 HD12 LEU 10 13.843 -1.928 7.443
93 HD13 LEU 10 HD13 LEU 10 14.211 -2.501 5.816
94 HD21 LEU 10 HD21 LEU 10 16.299 0.801 7.491
95 HD22 LEU 10 HD22 LEU 10 15.049 -0.040 8.410
96 HD23 LEU 10 HD23 LEU 10 16.619 -0.802 8.151
97 H ARG 11 HN ARG 11 13.966 -1.706 2.646
98 HA ARG 11 HA ARG 11 13.952 0.931 1.519
99 HB2 ARG 11 HB2 ARG 11 11.798 -1.192 1.467
100 HB3 ARG 11 HB3 ARG 11 11.849 0.251 0.465
101 HG2 ARG 11 HG2 ARG 11 13.930 -0.556 -0.555
102 HG3 ARG 11 HG3 ARG 11 13.803 -2.035 0.399
103 HD2 ARG 11 HD2 ARG 11 11.863 -1.046 -1.688
104 HD3 ARG 11 HD3 ARG 11 12.948 -2.428 -1.824
105 HE ARG 11 HE ARG 11 11.397 -2.944 0.379
106 HH11 ARG 11 HH12 ARG 11 10.801 -2.296 -2.995
107 HH12 ARG 11 HH11 ARG 11 9.363 -3.259 -3.056
108 HH21 ARG 11 HH22 ARG 11 9.504 -4.212 0.302
109 HH22 ARG 11 HH21 ARG 11 8.626 -4.346 -1.184
110 H THR 12 HN THR 12 13.307 2.688 2.566
111 HA THR 12 HA THR 12 10.908 2.555 4.228
112 HB THR 12 HB THR 12 12.607 2.303 5.892
113 HG1 THR 12 HG1 THR 12 10.894 4.107 6.025
114 HG21 THR 12 HG21 THR 12 14.530 3.057 4.580
115 HG22 THR 12 HG22 THR 12 14.468 3.875 6.141
116 HG23 THR 12 HG23 THR 12 13.953 4.721 4.682
117 H ASP 13 HN ASP 13 13.394 4.602 2.748
118 HA ASP 13 HA ASP 13 13.312 6.673 1.820
119 HB2 ASP 13 HB2 ASP 13 11.786 5.659 0.256
120 HB3 ASP 13 HB3 ASP 13 10.442 5.857 1.375
121 H ILE 14 HN ILE 14 9.998 7.048 2.750
122 HA ILE 14 HA ILE 14 10.756 8.756 5.010
123 HB ILE 14 HB ILE 14 8.789 9.591 2.871
124 HG12 ILE 14 HG12 ILE 14 11.506 10.756 3.527
125 HG13 ILE 14 HG13 ILE 14 11.186 9.689 2.164
126 HG21 ILE 14 HG21 ILE 14 8.171 10.373 5.093
127 HG22 ILE 14 HG22 ILE 14 9.786 11.044 5.319
128 HG23 ILE 14 HG23 ILE 14 8.717 11.718 4.088
129 HD11 ILE 14 HD11 ILE 14 10.009 12.424 2.605
130 HD12 ILE 14 HD12 ILE 14 11.260 11.989 1.440
131 HD13 ILE 14 HD13 ILE 14 9.624 11.352 1.257
132 H SER 15 HN SER 15 7.711 8.061 3.302
133 HA SER 15 HA SER 15 6.609 7.086 5.852
134 HB2 SER 15 HB2 SER 15 4.393 7.711 4.952
135 HB3 SER 15 HB3 SER 15 5.482 9.094 5.021
136 HG SER 15 HG SER 15 4.196 8.132 2.918
137 H THR 16 HN THR 16 5.666 5.113 5.962
138 HA THR 16 HA THR 16 6.122 3.311 3.735
139 HB THR 16 HB THR 16 6.714 2.539 5.968
140 HG1 THR 16 HG1 THR 16 5.418 1.182 4.238
141 HG21 THR 16 HG21 THR 16 3.771 2.806 6.605
142 HG22 THR 16 HG22 THR 16 5.061 3.824 7.247
143 HG23 THR 16 HG23 THR 16 5.000 2.112 7.661
144 H SER 17 HN SER 17 3.551 5.155 4.998
145 HA SER 17 HA SER 17 1.568 3.506 3.579
146 HB2 SER 17 HB2 SER 17 1.157 5.571 5.756
147 HB3 SER 17 HB3 SER 17 -0.131 4.675 4.951
148 HG SER 17 HG SER 17 1.970 3.577 6.514
149 H SEP 18 HN SER 18 -0.246 4.775 2.587
150 HA SEP 18 HA SER 18 -0.914 6.148 0.898
151 HB2 SEP 18 HB2 SER 18 -0.835 8.498 1.368
152 HB3 SEP 18 HB3 SER 18 -1.009 7.664 2.911
153 H SER 19 HN SER 19 1.792 4.882 0.688
154 HA SER 19 HA SER 19 3.325 6.803 -0.856
155 HB2 SER 19 HB2 SER 19 4.949 4.939 -1.103
156 HB3 SER 19 HB3 SER 19 4.548 5.266 0.583
157 HG SER 19 HG SER 19 3.902 3.073 -1.015
158 H SER 20 HN SER 20 2.122 3.508 -1.517
159 HA SER 20 HA SER 20 1.126 4.343 -4.103
160 HB2 SER 20 HB2 SER 20 3.356 2.304 -3.885
161 HB3 SER 20 HB3 SER 20 2.451 2.667 -5.354
162 HG SER 20 HG SER 20 4.092 4.013 -5.578
163 H ILE 21 HN ILE 21 -0.704 3.302 -4.499
164 HA ILE 21 HA ILE 21 -2.422 1.820 -4.361
165 HB ILE 21 HB ILE 21 -0.282 -0.245 -3.840
166 HG12 ILE 21 HG12 ILE 21 -1.419 0.666 -6.493
167 HG13 ILE 21 HG13 ILE 21 0.157 1.144 -5.869
168 HG21 ILE 21 HG21 ILE 21 -2.532 -1.042 -3.396
169 HG22 ILE 21 HG22 ILE 21 -3.065 -0.477 -4.978
170 HG23 ILE 21 HG23 ILE 21 -1.896 -1.792 -4.861
171 HD11 ILE 21 HD11 ILE 21 0.344 -0.646 -7.502
172 HD12 ILE 21 HD12 ILE 21 0.882 -1.179 -5.909
173 HD13 ILE 21 HD13 ILE 21 -0.701 -1.667 -6.514
174 H SER 22 HN SER 22 -3.420 2.573 -2.516
175 HA SER 22 HA SER 22 -3.074 0.889 -0.149
176 HB2 SER 22 HB2 SER 22 -1.768 2.914 0.307
177 HB3 SER 22 HB3 SER 22 -3.168 3.916 -0.074
178 HG SER 22 HG SER 22 -2.524 2.764 2.246
179 H SER 23 HN SER 23 -4.982 3.516 -1.597
180 HA SER 23 HA SER 23 -7.407 2.253 -0.502
181 HB2 SER 23 HB2 SER 23 -8.458 4.488 -0.640
182 HB3 SER 23 HB3 SER 23 -7.046 4.488 0.413
183 HG SER 23 HG SER 23 -6.140 5.054 -1.966
184 H SER 24 HN SER 24 -9.400 3.105 -1.893
185 HA SER 24 HA SER 24 -10.579 2.822 -3.813
186 HB2 SER 24 HB2 SER 24 -8.035 3.853 -5.093
187 HB3 SER 24 HB3 SER 24 -9.615 3.776 -5.872
188 HG SER 24 HG SER 24 -8.905 5.842 -4.821
189 H GLU 25 HN GLU 25 -9.991 1.991 -6.340
190 HA GLU 25 HA GLU 25 -9.724 0.106 -7.579
191 HB2 GLU 25 HB2 GLU 25 -7.347 0.616 -7.255
192 HB3 GLU 25 HB3 GLU 25 -7.348 -0.303 -5.755
193 HG2 GLU 25 HG2 GLU 25 -7.852 -2.340 -6.997
194 HG3 GLU 25 HG3 GLU 25 -7.868 -1.421 -8.501
195 H GLU 26 HN GLU 26 -11.540 -1.045 -7.081
196 HA GLU 26 HA GLU 26 -12.024 -2.434 -4.699
197 HB2 GLU 26 HB2 GLU 26 -13.740 -1.858 -6.418
198 HB3 GLU 26 HB3 GLU 26 -13.080 -3.121 -7.449
199 HG2 GLU 26 HG2 GLU 26 -13.629 -4.789 -5.741
200 HG3 GLU 26 HG3 GLU 26 -14.321 -3.516 -4.736
201 H ASN 27 HN ASN 27 -11.545 -4.457 -3.992
202 HA ASN 27 HA ASN 27 -10.261 -6.340 -5.812
203 HB2 ASN 27 HB2 ASN 27 -8.440 -6.749 -4.119
204 HB3 ASN 27 HB3 ASN 27 -8.346 -5.201 -4.949
205 HD21 ASN 27 HD21 ASN 27 -7.170 -4.213 -3.352
206 HD22 ASN 27 HD22 ASN 27 -7.831 -3.813 -1.808
207 H ASP 28 HN ASP 28 -12.690 -5.897 -3.869
208 HA ASP 28 HA ASP 28 -12.503 -8.052 -2.009
209 HB2 ASP 28 HB2 ASP 28 -14.858 -6.461 -3.038
210 HB3 ASP 28 HB3 ASP 28 -14.998 -7.706 -1.800
211 H PHE 29 HN PHE 29 -11.846 -9.829 -3.285
212 HA PHE 29 HA PHE 29 -13.930 -11.488 -4.181
213 HB2 PHE 29 HB2 PHE 29 -13.615 -9.751 -6.107
214 HB3 PHE 29 HB3 PHE 29 -12.181 -10.698 -6.485
215 HD1 PHE 29 HD2 PHE 29 -15.716 -11.457 -5.551
216 HD2 PHE 29 HD1 PHE 29 -12.478 -12.160 -8.221
217 HE1 PHE 29 HE2 PHE 29 -17.105 -13.051 -6.810
218 HE2 PHE 29 HE1 PHE 29 -13.860 -13.755 -9.484
219 HZ PHE 29 HZ PHE 29 -16.181 -14.187 -8.792
220 H TRP 30 HN TRP 30 -10.549 -10.712 -4.075
221 HA TRP 30 HA TRP 30 -9.911 -13.478 -3.500
222 HB2 TRP 30 HB2 TRP 30 -8.652 -11.940 -5.777
223 HB3 TRP 30 HB3 TRP 30 -7.917 -13.367 -5.058
224 HD1 TRP 30 HD1 TRP 30 -10.314 -12.333 -7.672
225 HE1 TRP 30 HE1 TRP 30 -11.464 -14.391 -8.707
226 HE3 TRP 30 HE3 TRP 30 -8.878 -15.851 -4.263
227 HZ2 TRP 30 HZ2 TRP 30 -11.724 -17.147 -8.147
228 HZ3 TRP 30 HZ3 TRP 30 -9.617 -18.175 -4.582
229 HH2 TRP 30 HH2 TRP 30 -11.010 -18.809 -6.484
230 H GLN 31 HN GLN 31 -8.237 -13.687 -2.130
231 HA GLN 31 HA GLN 31 -6.669 -11.300 -1.451
232 HB2 GLN 31 HB2 GLN 31 -6.893 -11.899 0.965
233 HB3 GLN 31 HB3 GLN 31 -8.391 -11.368 0.214
234 HG2 GLN 31 HG2 GLN 31 -9.120 -13.682 0.006
235 HG3 GLN 31 HG3 GLN 31 -7.608 -14.230 0.728
236 HE21 GLN 31 HE21 GLN 31 -10.357 -14.623 1.621
237 HE22 GLN 31 HE22 GLN 31 -10.440 -13.972 3.220
238 HA PRO 32 HA PRO 32 -4.099 -15.230 -1.682
239 HB2 PRO 32 HB2 PRO 32 -2.898 -14.930 -4.053
240 HB3 PRO 32 HB3 PRO 32 -4.524 -15.615 -3.929
241 HG2 PRO 32 HG2 PRO 32 -3.686 -12.848 -4.692
242 HG3 PRO 32 HG3 PRO 32 -4.957 -13.867 -5.394
243 HD2 PRO 32 HD2 PRO 32 -5.398 -11.852 -3.561
244 HD3 PRO 32 HD3 PRO 32 -6.489 -13.222 -3.835
245 H LYS 33 HN LYS 33 -1.700 -15.370 -1.795
246 HA LYS 33 HA LYS 33 -0.515 -13.074 -0.554
247 HB2 LYS 33 HB2 LYS 33 1.500 -14.488 -0.412
248 HB3 LYS 33 HB3 LYS 33 0.069 -15.311 0.196
249 HG2 LYS 33 HG2 LYS 33 -0.118 -16.412 -2.060
250 HG3 LYS 33 HG3 LYS 33 1.479 -15.755 -2.420
251 HD2 LYS 33 HD2 LYS 33 2.339 -16.903 -0.387
252 HD3 LYS 33 HD3 LYS 33 0.750 -17.647 -0.193
253 HE2 LYS 33 HE2 LYS 33 2.531 -17.952 -2.606
254 HE3 LYS 33 HE3 LYS 33 2.366 -19.136 -1.310
255 HZ1 LYS 33 HZ1 LYS 33 0.175 -18.219 -3.095
256 HZ2 LYS 33 HZ2 LYS 33 0.028 -19.366 -1.860
257 HZ3 LYS 33 HZ3 LYS 33 0.988 -19.699 -3.213
258 HA PRO 34 HA PRO 34 1.261 -11.015 -4.026
259 HB2 PRO 34 HB2 PRO 34 3.797 -10.793 -2.522
260 HB3 PRO 34 HB3 PRO 34 2.763 -9.519 -3.175
261 HG2 PRO 34 HG2 PRO 34 2.872 -10.003 -0.549
262 HG3 PRO 34 HG3 PRO 34 1.356 -9.535 -1.341
263 HD2 PRO 34 HD2 PRO 34 2.270 -12.236 -0.434
264 HD3 PRO 34 HD3 PRO 34 0.654 -11.504 -0.348
265 H THR 35 HN THR 35 2.585 -13.850 -2.742
266 HA THR 35 HA THR 35 3.928 -15.500 -3.551
267 HB THR 35 HB THR 35 3.214 -14.315 -6.242
268 HG1 THR 35 HG1 THR 35 1.887 -16.569 -5.418
269 HG21 THR 35 HG21 THR 35 3.616 -16.595 -7.077
270 HG22 THR 35 HG22 THR 35 4.149 -17.083 -5.468
271 HG23 THR 35 HG23 THR 35 5.072 -15.887 -6.379