Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
22808 | 2jr8 RC | 15323 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 GLY 1 1H GLY 1 -29.592 13.833 0.092
2 H2 GLY 1 2H GLY 1 -29.959 12.281 -0.471
3 H3 GLY 1 3H GLY 1 -29.002 13.315 -1.407
4 HA2 GLY 1 1HA GLY 1 -27.366 13.316 0.504
5 HA3 GLY 1 2HA GLY 1 -28.291 11.956 1.123
6 H LYS 2 H LYS 2 -28.885 11.017 -1.631
7 HA LYS 2 HA LYS 2 -28.047 9.532 -3.136
8 HB2 LYS 2 2HB LYS 2 -25.880 11.529 -2.820
9 HB3 LYS 2 1HB LYS 2 -25.427 10.002 -3.566
10 HG2 LYS 2 2HG LYS 2 -26.029 11.093 -5.441
11 HG3 LYS 2 1HG LYS 2 -27.633 10.523 -4.977
12 HD2 LYS 2 2HD LYS 2 -28.360 12.595 -4.469
13 HD3 LYS 2 1HD LYS 2 -26.817 13.072 -3.760
14 HE2 LYS 2 2HE LYS 2 -26.723 12.676 -6.657
15 HE3 LYS 2 1HE LYS 2 -27.812 13.965 -6.147
16 HZ1 LYS 2 3HZ LYS 2 -25.909 15.147 -6.223
17 HZ2 LYS 2 1HZ LYS 2 -24.911 13.804 -5.971
18 HZ3 LYS 2 2HZ LYS 2 -25.697 14.532 -4.662
19 H ILE 3 H ILE 3 -28.003 7.518 -2.365
20 HA ILE 3 HA ILE 3 -26.701 6.618 -0.093
21 HB ILE 3 HB ILE 3 -27.300 4.903 -2.497
22 HG12 ILE 3 2HG1 ILE 3 -29.314 6.145 -2.113
23 HG13 ILE 3 1HG1 ILE 3 -29.544 4.559 -1.387
24 HG21 ILE 3 1HG2 ILE 3 -27.720 4.038 0.301
25 HG22 ILE 3 2HG2 ILE 3 -26.060 4.181 -0.273
26 HG23 ILE 3 3HG2 ILE 3 -27.193 3.115 -1.106
27 HD11 ILE 3 3HD1 ILE 3 -30.421 6.096 0.145
28 HD12 ILE 3 1HD1 ILE 3 -29.031 7.172 -0.012
29 HD13 ILE 3 2HD1 ILE 3 -28.856 5.619 0.806
30 HA PRO 4 HA PRO 4 -22.538 6.643 -1.878
31 HB2 PRO 4 2HB PRO 4 -21.201 6.438 0.449
32 HB3 PRO 4 1HB PRO 4 -21.936 7.956 -0.077
33 HG2 PRO 4 2HG PRO 4 -22.958 5.938 1.882
34 HG3 PRO 4 1HG PRO 4 -22.956 7.707 1.997
35 HD2 PRO 4 2HD PRO 4 -25.144 6.254 1.258
36 HD3 PRO 4 1HD PRO 4 -24.845 7.916 0.715
37 H VAL 5 H VAL 5 -23.764 4.346 -2.390
38 HA VAL 5 HA VAL 5 -23.044 2.076 -0.939
39 HB VAL 5 HB VAL 5 -23.348 2.103 -3.935
40 HG11 VAL 5 1HG1 VAL 5 -24.462 -0.084 -3.430
41 HG12 VAL 5 2HG1 VAL 5 -23.915 0.105 -1.765
42 HG13 VAL 5 3HG1 VAL 5 -22.737 -0.018 -3.071
43 HG21 VAL 5 3HG2 VAL 5 -25.852 1.605 -3.119
44 HG22 VAL 5 1HG2 VAL 5 -25.282 3.220 -3.537
45 HG23 VAL 5 2HG2 VAL 5 -25.352 2.718 -1.847
46 H LYS 6 H LYS 6 -21.332 3.879 -3.424
47 HA LYS 6 HA LYS 6 -19.305 2.018 -3.965
48 HB2 LYS 6 2HB LYS 6 -19.892 4.742 -4.623
49 HB3 LYS 6 1HB LYS 6 -18.203 4.630 -4.144
50 HG2 LYS 6 2HG LYS 6 -17.699 3.850 -6.147
51 HG3 LYS 6 1HG LYS 6 -18.727 2.447 -5.854
52 HD2 LYS 6 2HD LYS 6 -20.181 4.886 -6.586
53 HD3 LYS 6 1HD LYS 6 -19.103 4.277 -7.842
54 HE2 LYS 6 2HE LYS 6 -21.315 3.322 -8.108
55 HE3 LYS 6 1HE LYS 6 -20.162 2.067 -7.655
56 HZ1 LYS 6 3HZ LYS 6 -22.108 3.403 -5.856
57 HZ2 LYS 6 1HZ LYS 6 -20.944 2.284 -5.349
58 HZ3 LYS 6 2HZ LYS 6 -22.178 1.805 -6.404
59 H ALA 7 H ALA 7 -19.680 4.398 -1.419
60 HA ALA 7 HA ALA 7 -17.066 4.380 -0.406
61 HB1 ALA 7 3HB ALA 7 -17.878 5.686 1.245
62 HB2 ALA 7 1HB ALA 7 -19.247 4.618 1.564
63 HB3 ALA 7 2HB ALA 7 -19.305 5.745 0.207
64 H ILE 8 H ILE 8 -19.904 2.463 0.576
65 HA ILE 8 HA ILE 8 -18.573 0.921 2.516
66 HB ILE 8 HB ILE 8 -20.934 -0.024 0.904
67 HG12 ILE 8 2HG1 ILE 8 -21.637 1.260 3.401
68 HG13 ILE 8 1HG1 ILE 8 -20.793 2.383 2.345
69 HG21 ILE 8 1HG2 ILE 8 -21.525 -1.072 3.112
70 HG22 ILE 8 2HG2 ILE 8 -19.923 -0.597 3.678
71 HG23 ILE 8 3HG2 ILE 8 -20.084 -1.719 2.328
72 HD11 ILE 8 3HD1 ILE 8 -23.492 1.447 2.219
73 HD12 ILE 8 1HD1 ILE 8 -22.644 1.057 0.721
74 HD13 ILE 8 2HD1 ILE 8 -22.704 2.726 1.294
75 H LYS 9 H LYS 9 -19.270 0.319 -0.898
76 HA LYS 9 HA LYS 9 -18.159 -2.273 -1.001
77 HB2 LYS 9 2HB LYS 9 -19.428 -0.497 -2.795
78 HB3 LYS 9 1HB LYS 9 -17.883 -0.913 -3.522
79 HG2 LYS 9 2HG LYS 9 -18.396 -3.238 -3.467
80 HG3 LYS 9 1HG LYS 9 -19.841 -2.951 -2.497
81 HD2 LYS 9 2HD LYS 9 -21.070 -2.308 -4.281
82 HD3 LYS 9 1HD LYS 9 -19.710 -1.488 -5.052
83 HE2 LYS 9 2HE LYS 9 -19.319 -3.238 -6.365
84 HE3 LYS 9 1HE LYS 9 -19.262 -4.329 -4.983
85 HZ1 LYS 9 3HZ LYS 9 -21.024 -5.153 -6.172
86 HZ2 LYS 9 1HZ LYS 9 -21.542 -3.632 -6.702
87 HZ3 LYS 9 2HZ LYS 9 -21.826 -4.116 -5.106
88 H GLN 10 H GLN 10 -16.775 0.927 -1.326
89 HA GLN 10 HA GLN 10 -14.279 0.139 -2.402
90 HB2 GLN 10 2HB GLN 10 -15.446 2.579 -1.246
91 HB3 GLN 10 1HB GLN 10 -13.709 2.433 -1.029
92 HG2 GLN 10 2HG GLN 10 -15.074 2.152 -3.690
93 HG3 GLN 10 1HG GLN 10 -14.440 3.678 -3.072
94 HE21 GLN 10 1HE2 GLN 10 -13.768 1.062 -4.958
95 HE22 GLN 10 2HE2 GLN 10 -12.041 1.156 -4.971
96 H ALA 11 H ALA 11 -15.533 0.378 0.861
97 HA ALA 11 HA ALA 11 -13.073 0.156 2.232
98 HB1 ALA 11 3HB ALA 11 -15.566 -0.956 3.419
99 HB2 ALA 11 1HB ALA 11 -15.488 0.771 3.070
100 HB3 ALA 11 2HB ALA 11 -14.310 0.037 4.156
101 H GLY 12 H GLY 12 -15.309 -2.215 0.921
102 HA2 GLY 12 2HA GLY 12 -14.138 -4.488 2.165
103 HA3 GLY 12 1HA GLY 12 -15.196 -4.508 0.760
104 H LYS 13 H LYS 13 -13.399 -2.689 -0.732
105 HA LYS 13 HA LYS 13 -11.770 -4.693 -1.935
106 HB2 LYS 13 2HB LYS 13 -12.731 -2.111 -2.620
107 HB3 LYS 13 1HB LYS 13 -10.979 -2.069 -2.765
108 HG2 LYS 13 2HG LYS 13 -11.396 -2.838 -4.830
109 HG3 LYS 13 1HG LYS 13 -11.505 -4.397 -4.013
110 HD2 LYS 13 2HD LYS 13 -13.493 -4.467 -5.110
111 HD3 LYS 13 1HD LYS 13 -14.026 -3.576 -3.683
112 HE2 LYS 13 2HE LYS 13 -14.301 -1.647 -4.827
113 HE3 LYS 13 1HE LYS 13 -12.917 -1.948 -5.875
114 HZ1 LYS 13 3HZ LYS 13 -15.698 -2.862 -6.172
115 HZ2 LYS 13 1HZ LYS 13 -14.445 -3.756 -6.876
116 HZ3 LYS 13 2HZ LYS 13 -14.683 -2.140 -7.315
117 H VAL 14 H VAL 14 -11.151 -1.928 0.174
118 HA VAL 14 HA VAL 14 -8.370 -1.912 0.072
119 HB VAL 14 HB VAL 14 -9.943 -1.293 2.563
120 HG11 VAL 14 1HG1 VAL 14 -8.117 0.614 2.413
121 HG12 VAL 14 2HG1 VAL 14 -7.281 -0.611 1.462
122 HG13 VAL 14 3HG1 VAL 14 -7.765 -0.962 3.120
123 HG21 VAL 14 3HG2 VAL 14 -11.197 0.010 1.191
124 HG22 VAL 14 1HG2 VAL 14 -9.952 0.089 -0.056
125 HG23 VAL 14 2HG2 VAL 14 -9.826 1.101 1.384
126 H ILE 15 H ILE 15 -10.593 -3.907 1.909
127 HA ILE 15 HA ILE 15 -8.732 -5.005 3.721
128 HB ILE 15 HB ILE 15 -11.221 -6.340 2.647
129 HG12 ILE 15 2HG1 ILE 15 -10.910 -4.553 5.070
130 HG13 ILE 15 1HG1 ILE 15 -11.664 -4.071 3.552
131 HG21 ILE 15 1HG2 ILE 15 -11.001 -7.147 5.207
132 HG22 ILE 15 2HG2 ILE 15 -9.297 -6.968 4.789
133 HG23 ILE 15 3HG2 ILE 15 -10.331 -8.036 3.839
134 HD11 ILE 15 3HD1 ILE 15 -12.630 -6.234 5.405
135 HD12 ILE 15 1HD1 ILE 15 -13.382 -5.780 3.874
136 HD13 ILE 15 2HD1 ILE 15 -13.332 -4.629 5.213
137 H GLY 16 H GLY 16 -9.733 -5.932 0.468
138 HA2 GLY 16 2HA GLY 16 -8.101 -8.328 0.496
139 HA3 GLY 16 1HA GLY 16 -9.038 -7.717 -0.858
140 H LYS 17 H LYS 17 -8.033 -5.179 -1.156
141 HA LYS 17 HA LYS 17 -5.696 -5.635 -2.638
142 HB2 LYS 17 2HB LYS 17 -7.469 -3.667 -2.670
143 HB3 LYS 17 1HB LYS 17 -6.301 -2.900 -1.604
144 HG2 LYS 17 2HG LYS 17 -4.931 -4.008 -3.852
145 HG3 LYS 17 1HG LYS 17 -6.280 -3.022 -4.415
146 HD2 LYS 17 2HD LYS 17 -5.353 -1.097 -3.673
147 HD3 LYS 17 1HD LYS 17 -4.666 -1.860 -2.239
148 HE2 LYS 17 2HE LYS 17 -3.479 -2.717 -4.784
149 HE3 LYS 17 1HE LYS 17 -3.230 -1.015 -4.388
150 HZ1 LYS 17 3HZ LYS 17 -1.453 -1.991 -3.356
151 HZ2 LYS 17 1HZ LYS 17 -2.292 -3.410 -2.969
152 HZ3 LYS 17 2HZ LYS 17 -2.572 -1.996 -2.085
153 H GLY 18 H GLY 18 -6.214 -4.523 0.649
154 HA2 GLY 18 2HA GLY 18 -3.505 -3.760 1.135
155 HA3 GLY 18 1HA GLY 18 -4.737 -4.055 2.356
156 H LEU 19 H LEU 19 -5.336 -6.740 1.528
157 HA LEU 19 HA LEU 19 -3.358 -8.124 3.020
158 HG LEU 19 HG LEU 19 -3.719 -10.342 3.426
159 HB2 LEU 19 2HB LEU 19 -5.887 -8.657 2.606
160 HB3 LEU 19 1HB LEU 19 -5.283 -9.521 1.206
161 HD11 LEU 19 1HD1 LEU 19 -6.635 -10.753 4.001
162 HD12 LEU 19 2HD1 LEU 19 -5.724 -9.416 4.702
163 HD13 LEU 19 3HD1 LEU 19 -5.247 -11.081 5.037
164 HD21 LEU 19 3HD2 LEU 19 -5.876 -12.097 2.449
165 HD22 LEU 19 1HD2 LEU 19 -4.143 -12.392 2.585
166 HD23 LEU 19 2HD2 LEU 19 -4.776 -11.466 1.223
167 H ARG 20 H ARG 20 -4.053 -7.811 -0.423
168 HA ARG 20 HA ARG 20 -2.106 -9.717 -1.262
169 HE ARG 20 HE ARG 20 -4.143 -11.911 -4.566
170 HB2 ARG 20 2HB ARG 20 -4.114 -8.126 -2.485
171 HB3 ARG 20 1HB ARG 20 -2.598 -7.757 -3.293
172 HG2 ARG 20 2HG ARG 20 -2.519 -9.744 -4.311
173 HG3 ARG 20 1HG ARG 20 -3.042 -10.613 -2.868
174 HD2 ARG 20 2HD ARG 20 -5.363 -9.806 -3.323
175 HD3 ARG 20 1HD ARG 20 -4.778 -9.146 -4.849
176 HH11 ARG 20 1HH1 ARG 20 -6.711 -9.699 -5.400
177 HH12 ARG 20 2HH1 ARG 20 -7.541 -10.844 -6.401
178 HH21 ARG 20 1HH2 ARG 20 -5.234 -13.417 -5.883
179 HH22 ARG 20 2HH2 ARG 20 -6.701 -12.954 -6.674
180 H ALA 21 H ALA 21 -2.038 -6.348 -0.433
181 HA ALA 21 HA ALA 21 0.448 -5.741 -1.699
182 HB1 ALA 21 3HB ALA 21 -0.363 -4.130 0.632
183 HB2 ALA 21 1HB ALA 21 -1.529 -4.217 -0.688
184 HB3 ALA 21 2HB ALA 21 0.105 -3.625 -0.993
185 H ILE 22 H ILE 22 -0.523 -6.644 1.576
186 HA ILE 22 HA ILE 22 2.020 -6.381 2.769
187 HB ILE 22 HB ILE 22 -0.212 -8.240 3.597
188 HG12 ILE 22 2HG1 ILE 22 0.277 -5.587 4.876
189 HG13 ILE 22 1HG1 ILE 22 -0.575 -5.627 3.337
190 HG21 ILE 22 1HG2 ILE 22 2.375 -7.482 4.788
191 HG22 ILE 22 2HG2 ILE 22 1.428 -8.958 4.973
192 HG23 ILE 22 3HG2 ILE 22 0.997 -7.511 5.884
193 HD11 ILE 22 3HD1 ILE 22 -1.732 -5.852 5.786
194 HD12 ILE 22 1HD1 ILE 22 -1.583 -7.543 5.297
195 HD13 ILE 22 2HD1 ILE 22 -2.449 -6.397 4.269
196 H ASN 23 H ASN 23 0.503 -8.946 0.941
197 HA ASN 23 HA ASN 23 2.319 -11.010 1.637
198 HB2 ASN 23 2HB ASN 23 -0.037 -10.938 0.284
199 HB3 ASN 23 1HB ASN 23 1.097 -11.112 -1.052
200 HD21 ASN 23 1HD2 ASN 23 -0.734 -12.744 1.151
201 HD22 ASN 23 2HD2 ASN 23 0.074 -14.269 1.118
202 H ILE 24 H ILE 24 2.258 -8.572 -0.901
203 HA ILE 24 HA ILE 24 4.645 -9.609 -2.166
204 HB ILE 24 HB ILE 24 3.272 -6.979 -2.705
205 HG12 ILE 24 2HG1 ILE 24 2.839 -9.562 -4.203
206 HG13 ILE 24 1HG1 ILE 24 1.788 -9.040 -2.892
207 HG21 ILE 24 1HG2 ILE 24 5.171 -6.747 -3.901
208 HG22 ILE 24 2HG2 ILE 24 4.319 -7.775 -5.055
209 HG23 ILE 24 3HG2 ILE 24 5.488 -8.480 -3.937
210 HD11 ILE 24 3HD1 ILE 24 1.015 -8.523 -5.234
211 HD12 ILE 24 1HD1 ILE 24 2.324 -7.342 -5.307
212 HD13 ILE 24 2HD1 ILE 24 1.044 -7.168 -4.106
213 H ALA 25 H ALA 25 3.820 -7.256 0.236
214 HA ALA 25 HA ALA 25 5.982 -5.511 0.083
215 HB1 ALA 25 3HB ALA 25 4.486 -4.718 1.585
216 HB2 ALA 25 1HB ALA 25 5.556 -5.530 2.727
217 HB3 ALA 25 2HB ALA 25 4.074 -6.322 2.187
218 H GLY 26 H GLY 26 5.806 -8.778 1.283
219 HA2 GLY 26 2HA GLY 26 8.165 -8.751 2.847
220 HA3 GLY 26 1HA GLY 26 7.387 -10.180 2.187
221 H THR 27 H THR 27 7.572 -9.634 -0.526
222 HA THR 27 HA THR 27 10.279 -10.387 -1.022
223 HB THR 27 HB THR 27 8.546 -11.343 -2.390
224 HG1 THR 27 1HG THR 27 9.977 -9.499 -3.994
225 HG21 THR 27 3HG2 THR 27 7.387 -9.894 -4.102
226 HG22 THR 27 1HG2 THR 27 7.859 -8.516 -3.106
227 HG23 THR 27 2HG2 THR 27 6.811 -9.768 -2.438
228 H THR 28 H THR 28 8.382 -7.456 -1.493
229 HA THR 28 HA THR 28 10.293 -6.024 -2.994
230 HB THR 28 HB THR 28 8.555 -4.497 -1.146
231 HG1 THR 28 1HG THR 28 7.429 -6.038 -3.237
232 HG21 THR 28 3HG2 THR 28 9.521 -4.291 -3.899
233 HG22 THR 28 1HG2 THR 28 9.149 -3.033 -2.723
234 HG23 THR 28 2HG2 THR 28 7.852 -3.779 -3.654
235 H HIS 29 H HIS 29 9.860 -6.556 0.434
236 HA HIS 29 HA HIS 29 11.539 -4.531 1.414
237 HD1 HIS 29 1HD HIS 29 12.762 -4.023 2.994
238 HD2 HIS 29 2HD HIS 29 10.407 -6.260 5.588
239 HE1 HIS 29 1HE HIS 29 13.164 -3.050 5.278
240 HE2 HIS 29 2HE HIS 29 11.663 -4.363 6.817
241 HB2 HIS 29 2HB HIS 29 9.923 -6.194 2.646
242 HB3 HIS 29 1HB HIS 29 11.363 -7.199 2.769
243 H ASP 30 H ASP 30 12.215 -7.675 0.058
244 HA ASP 30 HA ASP 30 14.960 -7.735 0.904
245 HB2 ASP 30 2HB ASP 30 13.127 -9.583 -0.132
246 HB3 ASP 30 1HB ASP 30 14.370 -9.434 -1.368
247 H VAL 31 H VAL 31 13.296 -7.248 -2.199
248 HA VAL 31 HA VAL 31 15.391 -6.857 -3.892
249 HB VAL 31 HB VAL 31 12.958 -5.086 -3.950
250 HG11 VAL 31 1HG1 VAL 31 14.253 -4.402 -5.696
251 HG12 VAL 31 2HG1 VAL 31 13.371 -5.716 -6.477
252 HG13 VAL 31 3HG1 VAL 31 15.013 -5.981 -5.892
253 HG21 VAL 31 3HG2 VAL 31 12.212 -7.123 -5.517
254 HG22 VAL 31 1HG2 VAL 31 11.816 -7.045 -3.800
255 HG23 VAL 31 2HG2 VAL 31 13.186 -8.012 -4.345
256 H VAL 32 H VAL 32 13.956 -4.470 -1.718
257 HA VAL 32 HA VAL 32 15.403 -2.229 -2.533
258 HB VAL 32 HB VAL 32 14.474 -2.854 0.274
259 HG11 VAL 32 1HG1 VAL 32 16.080 -0.957 0.026
260 HG12 VAL 32 2HG1 VAL 32 14.500 -0.492 0.655
261 HG13 VAL 32 3HG1 VAL 32 14.906 -0.171 -1.030
262 HG21 VAL 32 3HG2 VAL 32 12.409 -2.786 -0.549
263 HG22 VAL 32 1HG2 VAL 32 12.997 -2.334 -2.150
264 HG23 VAL 32 2HG2 VAL 32 12.688 -1.089 -0.938
265 H SER 33 H SER 33 16.331 -4.930 -0.532
266 HA SER 33 HA SER 33 18.598 -3.754 0.687
267 HG SER 33 HG SER 33 20.165 -6.163 1.307
268 HB2 SER 33 2HB SER 33 17.351 -5.972 1.259
269 HB3 SER 33 1HB SER 33 18.431 -6.690 0.067
270 H PHE 34 H PHE 34 18.052 -5.278 -2.406
271 HA PHE 34 HA PHE 34 20.750 -5.732 -3.111
272 HD1 PHE 34 2HD PHE 34 20.736 -5.078 -6.705
273 HD2 PHE 34 1HD PHE 34 19.733 -8.458 -4.321
274 HE1 PHE 34 2HE PHE 34 22.244 -6.475 -8.059
275 HE2 PHE 34 1HE PHE 34 21.240 -9.860 -5.669
276 HZ PHE 34 HZ PHE 34 22.498 -8.870 -7.540
277 HB2 PHE 34 2HB PHE 34 18.421 -6.451 -4.223
278 HB3 PHE 34 1HB PHE 34 18.790 -5.065 -5.245
279 H PHE 35 H PHE 35 18.565 -3.001 -3.661
280 HA PHE 35 HA PHE 35 20.529 -1.486 -5.108
281 HD1 PHE 35 1HD PHE 35 19.668 -1.204 -7.139
282 HD2 PHE 35 2HD PHE 35 18.056 1.981 -4.825
283 HE1 PHE 35 1HE PHE 35 20.071 0.349 -9.005
284 HE2 PHE 35 2HE PHE 35 18.456 3.541 -6.685
285 HZ PHE 35 HZ PHE 35 19.465 2.725 -8.778
286 HB2 PHE 35 2HB PHE 35 17.840 -1.375 -5.034
287 HB3 PHE 35 1HB PHE 35 18.213 -0.097 -3.882
288 H ARG 36 H ARG 36 18.923 -0.986 -1.959
289 HA ARG 36 HA ARG 36 19.625 -0.004 -0.035
290 HE ARG 36 HE ARG 36 22.823 -0.495 3.477
291 HB2 ARG 36 2HB ARG 36 21.563 -1.650 -0.493
292 HB3 ARG 36 1HB ARG 36 22.464 -0.227 -1.000
293 HG2 ARG 36 2HG ARG 36 22.196 0.765 1.188
294 HG3 ARG 36 1HG ARG 36 21.195 -0.592 1.706
295 HD2 ARG 36 2HD ARG 36 23.173 -2.078 1.184
296 HD3 ARG 36 1HD ARG 36 24.124 -0.603 1.015
297 HH11 ARG 36 1HH1 ARG 36 25.270 -2.415 1.892
298 HH12 ARG 36 2HH1 ARG 36 26.090 -2.813 3.363
299 HH21 ARG 36 1HH2 ARG 36 23.901 -1.017 5.412
300 HH22 ARG 36 2HH2 ARG 36 25.313 -2.020 5.364
301 HA PRO 37 HA PRO 37 19.961 4.201 -1.557
302 HB2 PRO 37 2HB PRO 37 19.363 5.448 0.767
303 HB3 PRO 37 1HB PRO 37 18.134 4.663 -0.235
304 HG2 PRO 37 2HG PRO 37 19.507 3.643 2.225
305 HG3 PRO 37 1HG PRO 37 17.791 3.553 1.781
306 HD2 PRO 37 2HD PRO 37 19.501 1.469 1.467
307 HD3 PRO 37 1HD PRO 37 18.115 1.746 0.393
308 H LYS 38 H LYS 38 21.779 5.319 -1.832
309 HA LYS 38 HA LYS 38 23.518 5.910 0.406
310 HB2 LYS 38 2HB LYS 38 24.134 3.816 -1.513
311 HB3 LYS 38 1HB LYS 38 25.366 5.070 -1.507
312 HG2 LYS 38 2HG LYS 38 25.534 4.808 0.960
313 HG3 LYS 38 1HG LYS 38 24.423 3.442 0.841
314 HD2 LYS 38 2HD LYS 38 26.586 2.502 0.862
315 HD3 LYS 38 1HD LYS 38 26.061 2.444 -0.822
316 HE2 LYS 38 2HE LYS 38 27.275 4.689 -1.072
317 HE3 LYS 38 1HE LYS 38 28.038 4.297 0.470
318 HZ1 LYS 38 3HZ LYS 38 28.545 2.065 -0.756
319 HZ2 LYS 38 1HZ LYS 38 29.533 3.418 -0.992
320 HZ3 LYS 38 2HZ LYS 38 28.364 3.013 -2.145
321 H LYS 39 H LYS 39 23.243 8.070 0.105
322 HA LYS 39 HA LYS 39 23.966 9.179 -2.526
323 HB2 LYS 39 2HB LYS 39 21.671 9.652 -1.422
324 HB3 LYS 39 1HB LYS 39 22.572 10.719 -0.353
325 HG2 LYS 39 2HG LYS 39 21.897 12.184 -1.974
326 HG3 LYS 39 1HG LYS 39 23.482 11.714 -2.589
327 HD2 LYS 39 2HD LYS 39 22.609 10.687 -4.387
328 HD3 LYS 39 1HD LYS 39 21.293 9.970 -3.455
329 HE2 LYS 39 2HE LYS 39 21.338 12.887 -4.175
330 HE3 LYS 39 1HE LYS 39 20.666 11.664 -5.257
331 HZ1 LYS 39 3HZ LYS 39 19.768 11.777 -2.457
332 HZ2 LYS 39 1HZ LYS 39 18.943 11.221 -3.827
333 HZ3 LYS 39 2HZ LYS 39 19.141 12.882 -3.574
334 H LYS 40 H LYS 40 25.336 11.017 -2.620
335 HA LYS 40 HA LYS 40 27.603 10.903 -1.006
336 HB2 LYS 40 2HB LYS 40 26.545 12.779 -3.042
337 HB3 LYS 40 1HB LYS 40 27.786 13.414 -1.969
338 HG2 LYS 40 2HG LYS 40 28.536 10.814 -2.942
339 HG3 LYS 40 1HG LYS 40 28.145 11.893 -4.283
340 HD2 LYS 40 2HD LYS 40 29.974 12.698 -2.033
341 HD3 LYS 40 1HD LYS 40 30.560 11.888 -3.488
342 HE2 LYS 40 2HE LYS 40 29.072 13.862 -4.580
343 HE3 LYS 40 1HE LYS 40 29.619 14.652 -3.101
344 HZ1 LYS 40 3HZ LYS 40 31.895 13.580 -3.939
345 HZ2 LYS 40 1HZ LYS 40 31.386 15.131 -4.390
346 HZ3 LYS 40 2HZ LYS 40 31.142 13.824 -5.435
347 H LYS 41 H LYS 41 28.469 12.489 0.477
348 HA LYS 41 HA LYS 41 26.460 14.111 1.866
349 HB2 LYS 41 2HB LYS 41 27.478 13.342 4.051
350 HB3 LYS 41 1HB LYS 41 26.500 12.153 3.203
351 HG2 LYS 41 2HG LYS 41 29.467 12.226 2.836
352 HG3 LYS 41 1HG LYS 41 28.744 11.423 4.232
353 HD2 LYS 41 2HD LYS 41 27.235 10.320 2.356
354 HD3 LYS 41 1HD LYS 41 28.634 10.698 1.349
355 HE2 LYS 41 2HE LYS 41 29.206 9.421 3.950
356 HE3 LYS 41 1HE LYS 41 28.378 8.419 2.759
357 HZ1 LYS 41 3HZ LYS 41 30.819 9.941 2.072
358 HZ2 LYS 41 1HZ LYS 41 30.138 8.619 1.263
359 HZ3 LYS 41 2HZ LYS 41 30.904 8.395 2.756
360 H HIS 42 H HIS 42 27.590 15.521 3.581
361 HA HIS 42 HA HIS 42 30.260 16.335 2.679
362 HD1 HIS 42 1HD HIS 42 30.367 16.589 0.699
363 HD2 HIS 42 2HD HIS 42 29.389 20.577 1.336
364 HE1 HIS 42 1HE HIS 42 31.485 17.859 -1.160
365 HE2 HIS 42 2HE HIS 42 30.953 20.278 -0.704
366 HB2 HIS 42 2HB HIS 42 27.813 17.824 2.338
367 HB3 HIS 42 1HB HIS 42 28.910 18.706 3.392
Start of MODEL 2
1 H1 GLY 1 1H GLY 1 -33.213 -3.330 6.885
2 H2 GLY 1 2H GLY 1 -33.786 -2.593 5.475
3 H3 GLY 1 3H GLY 1 -32.653 -1.796 6.444
4 HA2 GLY 1 1HA GLY 1 -31.302 -4.021 5.951
5 HA3 GLY 1 2HA GLY 1 -32.272 -3.920 4.490
6 H LYS 2 H LYS 2 -29.331 -3.525 5.116
7 HA LYS 2 HA LYS 2 -28.634 -0.830 4.782
8 HB2 LYS 2 2HB LYS 2 -27.017 -3.120 3.685
9 HB3 LYS 2 1HB LYS 2 -26.443 -1.583 4.319
10 HG2 LYS 2 2HG LYS 2 -27.891 -2.872 6.382
11 HG3 LYS 2 1HG LYS 2 -26.789 -4.055 5.674
12 HD2 LYS 2 2HD LYS 2 -25.675 -2.909 7.482
13 HD3 LYS 2 1HD LYS 2 -24.939 -2.430 5.952
14 HE2 LYS 2 2HE LYS 2 -25.912 -0.315 6.007
15 HE3 LYS 2 1HE LYS 2 -27.144 -0.807 7.166
16 HZ1 LYS 2 3HZ LYS 2 -24.269 -0.305 7.676
17 HZ2 LYS 2 1HZ LYS 2 -25.270 -1.092 8.790
18 HZ3 LYS 2 2HZ LYS 2 -25.600 0.504 8.337
19 H ILE 3 H ILE 3 -29.607 0.306 3.187
20 HA ILE 3 HA ILE 3 -30.139 -0.726 0.601
21 HB ILE 3 HB ILE 3 -29.927 2.216 0.996
22 HG12 ILE 3 2HG1 ILE 3 -32.469 1.721 1.893
23 HG13 ILE 3 1HG1 ILE 3 -31.563 0.425 2.669
24 HG21 ILE 3 1HG2 ILE 3 -32.053 2.127 -0.279
25 HG22 ILE 3 2HG2 ILE 3 -31.889 0.373 -0.336
26 HG23 ILE 3 3HG2 ILE 3 -30.683 1.395 -1.117
27 HD11 ILE 3 3HD1 ILE 3 -31.881 2.899 3.692
28 HD12 ILE 3 1HD1 ILE 3 -30.336 3.083 2.859
29 HD13 ILE 3 2HD1 ILE 3 -30.535 1.827 4.081
30 HA PRO 4 HA PRO 4 -26.315 2.008 -0.676
31 HB2 PRO 4 2HB PRO 4 -24.771 2.162 1.830
32 HB3 PRO 4 1HB PRO 4 -25.176 3.440 0.683
33 HG2 PRO 4 2HG PRO 4 -26.319 3.313 3.107
34 HG3 PRO 4 1HG PRO 4 -27.216 3.870 1.680
35 HD2 PRO 4 2HD PRO 4 -27.279 1.196 3.031
36 HD3 PRO 4 1HD PRO 4 -28.623 2.165 2.394
37 H VAL 5 H VAL 5 -26.435 -0.466 -1.197
38 HA VAL 5 HA VAL 5 -24.658 -2.255 0.034
39 HB VAL 5 HB VAL 5 -25.610 -2.302 -2.831
40 HG11 VAL 5 1HG1 VAL 5 -25.218 -4.658 -2.737
41 HG12 VAL 5 2HG1 VAL 5 -24.808 -4.567 -1.025
42 HG13 VAL 5 3HG1 VAL 5 -23.748 -3.828 -2.223
43 HG21 VAL 5 3HG2 VAL 5 -26.982 -3.935 -0.798
44 HG22 VAL 5 1HG2 VAL 5 -27.633 -3.069 -2.190
45 HG23 VAL 5 2HG2 VAL 5 -27.266 -2.198 -0.701
46 H LYS 6 H LYS 6 -24.249 0.115 -2.514
47 HA LYS 6 HA LYS 6 -21.698 -0.823 -3.381
48 HB2 LYS 6 2HB LYS 6 -21.561 1.296 -4.604
49 HB3 LYS 6 1HB LYS 6 -23.122 0.521 -4.844
50 HG2 LYS 6 2HG LYS 6 -23.875 2.051 -2.878
51 HG3 LYS 6 1HG LYS 6 -22.448 2.993 -3.318
52 HD2 LYS 6 2HD LYS 6 -24.439 2.157 -5.398
53 HD3 LYS 6 1HD LYS 6 -24.720 3.586 -4.400
54 HE2 LYS 6 2HE LYS 6 -22.186 4.050 -5.159
55 HE3 LYS 6 1HE LYS 6 -22.746 3.121 -6.548
56 HZ1 LYS 6 3HZ LYS 6 -24.517 5.233 -5.626
57 HZ2 LYS 6 1HZ LYS 6 -24.122 4.760 -7.204
58 HZ3 LYS 6 2HZ LYS 6 -23.063 5.745 -6.322
59 H ALA 7 H ALA 7 -22.802 1.276 -0.843
60 HA ALA 7 HA ALA 7 -20.321 2.598 -0.380
61 HB1 ALA 7 3HB ALA 7 -22.895 2.342 1.098
62 HB2 ALA 7 1HB ALA 7 -22.066 3.785 0.519
63 HB3 ALA 7 2HB ALA 7 -21.477 2.947 1.953
64 H ILE 8 H ILE 8 -21.769 -0.392 0.709
65 HA ILE 8 HA ILE 8 -19.847 -0.860 2.790
66 HB ILE 8 HB ILE 8 -21.575 -2.976 1.540
67 HG12 ILE 8 2HG1 ILE 8 -22.638 -1.592 3.914
68 HG13 ILE 8 1HG1 ILE 8 -22.648 -0.630 2.443
69 HG21 ILE 8 1HG2 ILE 8 -20.134 -3.957 3.069
70 HG22 ILE 8 2HG2 ILE 8 -21.592 -3.677 4.022
71 HG23 ILE 8 3HG2 ILE 8 -20.214 -2.587 4.177
72 HD11 ILE 8 3HD1 ILE 8 -24.613 -1.608 2.063
73 HD12 ILE 8 1HD1 ILE 8 -24.292 -2.912 3.206
74 HD13 ILE 8 2HD1 ILE 8 -23.650 -3.002 1.566
75 H LYS 9 H LYS 9 -20.469 -2.257 -0.409
76 HA LYS 9 HA LYS 9 -18.336 -4.060 -0.444
77 HB2 LYS 9 2HB LYS 9 -18.606 -4.095 -2.872
78 HB3 LYS 9 1HB LYS 9 -20.169 -4.122 -2.069
79 HG2 LYS 9 2HG LYS 9 -20.616 -2.577 -3.658
80 HG3 LYS 9 1HG LYS 9 -19.974 -1.504 -2.415
81 HD2 LYS 9 2HD LYS 9 -18.547 -0.784 -3.978
82 HD3 LYS 9 1HD LYS 9 -17.715 -2.328 -3.767
83 HE2 LYS 9 2HE LYS 9 -18.069 -2.212 -6.065
84 HE3 LYS 9 1HE LYS 9 -19.394 -3.226 -5.499
85 HZ1 LYS 9 3HZ LYS 9 -20.509 -0.816 -5.345
86 HZ2 LYS 9 1HZ LYS 9 -20.607 -1.800 -6.716
87 HZ3 LYS 9 2HZ LYS 9 -19.459 -0.559 -6.645
88 H GLN 10 H GLN 10 -18.410 -0.623 -0.988
89 HA GLN 10 HA GLN 10 -15.899 -0.423 -2.312
90 HB2 GLN 10 2HB GLN 10 -17.878 1.299 -2.085
91 HB3 GLN 10 1HB GLN 10 -16.994 1.813 -0.655
92 HG2 GLN 10 2HG GLN 10 -15.341 2.761 -1.848
93 HG3 GLN 10 1HG GLN 10 -15.394 1.527 -3.107
94 HE21 GLN 10 1HE2 GLN 10 -17.410 4.144 -1.806
95 HE22 GLN 10 2HE2 GLN 10 -17.945 4.724 -3.343
96 H ALA 11 H ALA 11 -16.911 -0.394 1.047
97 HA ALA 11 HA ALA 11 -14.421 0.468 2.119
98 HB1 ALA 11 3HB ALA 11 -16.897 0.231 3.147
99 HB2 ALA 11 1HB ALA 11 -15.439 0.356 4.132
100 HB3 ALA 11 2HB ALA 11 -16.151 -1.224 3.806
101 H GLY 12 H GLY 12 -15.792 -2.657 1.304
102 HA2 GLY 12 2HA GLY 12 -13.842 -4.236 2.644
103 HA3 GLY 12 1HA GLY 12 -14.914 -4.783 1.364
104 H LYS 13 H LYS 13 -13.934 -2.663 -0.466
105 HA LYS 13 HA LYS 13 -11.806 -4.158 -1.636
106 HB2 LYS 13 2HB LYS 13 -13.651 -2.224 -2.495
107 HB3 LYS 13 1HB LYS 13 -12.067 -1.501 -2.737
108 HG2 LYS 13 2HG LYS 13 -12.640 -2.606 -4.746
109 HG3 LYS 13 1HG LYS 13 -11.407 -3.591 -3.957
110 HD2 LYS 13 2HD LYS 13 -13.685 -4.657 -2.925
111 HD3 LYS 13 1HD LYS 13 -14.223 -4.191 -4.540
112 HE2 LYS 13 2HE LYS 13 -12.722 -5.606 -5.591
113 HE3 LYS 13 1HE LYS 13 -11.651 -5.671 -4.193
114 HZ1 LYS 13 3HZ LYS 13 -12.686 -7.728 -4.194
115 HZ2 LYS 13 1HZ LYS 13 -14.194 -7.098 -4.633
116 HZ3 LYS 13 2HZ LYS 13 -13.601 -6.858 -3.066
117 H VAL 14 H VAL 14 -12.021 -1.075 0.085
118 HA VAL 14 HA VAL 14 -9.406 -0.195 -0.295
119 HB VAL 14 HB VAL 14 -10.962 0.267 2.241
120 HG11 VAL 14 1HG1 VAL 14 -9.886 2.597 1.735
121 HG12 VAL 14 2HG1 VAL 14 -8.775 1.633 0.764
122 HG13 VAL 14 3HG1 VAL 14 -8.940 1.313 2.490
123 HG21 VAL 14 3HG2 VAL 14 -11.596 1.114 -0.516
124 HG22 VAL 14 1HG2 VAL 14 -11.675 2.368 0.722
125 HG23 VAL 14 2HG2 VAL 14 -12.652 0.910 0.880
126 H ILE 15 H ILE 15 -10.739 -2.544 1.930
127 HA ILE 15 HA ILE 15 -8.499 -2.680 3.671
128 HB ILE 15 HB ILE 15 -10.535 -4.846 3.148
129 HG12 ILE 15 2HG1 ILE 15 -10.677 -2.816 5.364
130 HG13 ILE 15 1HG1 ILE 15 -11.399 -2.494 3.792
131 HG21 ILE 15 1HG2 ILE 15 -8.538 -5.566 4.376
132 HG22 ILE 15 2HG2 ILE 15 -9.981 -5.604 5.390
133 HG23 ILE 15 3HG2 ILE 15 -8.814 -4.291 5.560
134 HD11 ILE 15 3HD1 ILE 15 -12.457 -3.968 5.972
135 HD12 ILE 15 1HD1 ILE 15 -12.256 -5.058 4.602
136 HD13 ILE 15 2HD1 ILE 15 -13.210 -3.586 4.424
137 H GLY 16 H GLY 16 -9.478 -4.510 0.801
138 HA2 GLY 16 2HA GLY 16 -7.328 -6.378 0.943
139 HA3 GLY 16 1HA GLY 16 -8.355 -6.083 -0.450
140 H LYS 17 H LYS 17 -7.738 -3.251 -0.604
141 HA LYS 17 HA LYS 17 -5.555 -3.334 -2.346
142 HB2 LYS 17 2HB LYS 17 -7.318 -1.584 -2.356
143 HB3 LYS 17 1HB LYS 17 -6.636 -0.923 -0.876
144 HG2 LYS 17 2HG LYS 17 -4.722 -1.229 -3.077
145 HG3 LYS 17 1HG LYS 17 -6.026 -0.079 -3.378
146 HD2 LYS 17 2HD LYS 17 -5.300 0.565 -0.830
147 HD3 LYS 17 1HD LYS 17 -3.753 0.083 -1.528
148 HE2 LYS 17 2HE LYS 17 -4.076 2.457 -1.833
149 HE3 LYS 17 1HE LYS 17 -4.140 1.643 -3.397
150 HZ1 LYS 17 3HZ LYS 17 -6.678 2.012 -2.022
151 HZ2 LYS 17 1HZ LYS 17 -6.309 2.139 -3.668
152 HZ3 LYS 17 2HZ LYS 17 -5.941 3.412 -2.617
153 H GLY 18 H GLY 18 -5.739 -2.723 1.094
154 HA2 GLY 18 2HA GLY 18 -3.088 -1.692 1.361
155 HA3 GLY 18 1HA GLY 18 -4.112 -2.278 2.665
156 H LEU 19 H LEU 19 -4.523 -4.903 1.606
157 HA LEU 19 HA LEU 19 -2.196 -6.175 2.627
158 HG LEU 19 HG LEU 19 -4.200 -6.727 3.992
159 HB2 LEU 19 2HB LEU 19 -4.773 -7.079 1.432
160 HB3 LEU 19 1HB LEU 19 -3.457 -8.233 1.525
161 HD11 LEU 19 1HD1 LEU 19 -5.656 -9.226 3.191
162 HD12 LEU 19 2HD1 LEU 19 -6.302 -7.620 2.859
163 HD13 LEU 19 3HD1 LEU 19 -6.005 -8.123 4.520
164 HD21 LEU 19 3HD2 LEU 19 -2.243 -8.353 3.721
165 HD22 LEU 19 1HD2 LEU 19 -3.468 -9.621 3.680
166 HD23 LEU 19 2HD2 LEU 19 -3.316 -8.588 5.101
167 H ARG 20 H ARG 20 -3.393 -5.472 -0.591
168 HA ARG 20 HA ARG 20 -1.486 -7.127 -1.946
169 HE ARG 20 HE ARG 20 -4.292 -9.217 -4.733
170 HB2 ARG 20 2HB ARG 20 -3.533 -5.117 -2.740
171 HB3 ARG 20 1HB ARG 20 -2.238 -5.452 -3.881
172 HG2 ARG 20 2HG ARG 20 -3.262 -7.924 -2.888
173 HG3 ARG 20 1HG ARG 20 -4.603 -6.918 -3.439
174 HD2 ARG 20 2HD ARG 20 -3.679 -6.718 -5.610
175 HD3 ARG 20 1HD ARG 20 -2.128 -7.374 -5.087
176 HH11 ARG 20 1HH1 ARG 20 -2.006 -7.946 -7.045
177 HH12 ARG 20 2HH1 ARG 20 -2.043 -9.360 -8.045
178 HH21 ARG 20 1HH2 ARG 20 -4.340 -11.076 -6.046
179 HH22 ARG 20 2HH2 ARG 20 -3.368 -11.136 -7.479
180 H ALA 21 H ALA 21 -1.582 -3.841 -0.792
181 HA ALA 21 HA ALA 21 0.667 -2.928 -2.308
182 HB1 ALA 21 3HB ALA 21 -1.069 -1.827 -0.184
183 HB2 ALA 21 1HB ALA 21 -0.542 -1.110 -1.705
184 HB3 ALA 21 2HB ALA 21 0.551 -1.142 -0.322
185 H ILE 22 H ILE 22 0.174 -4.210 0.938
186 HA ILE 22 HA ILE 22 2.830 -3.748 1.840
187 HB ILE 22 HB ILE 22 0.867 -5.808 2.854
188 HG12 ILE 22 2HG1 ILE 22 1.275 -3.208 4.236
189 HG13 ILE 22 1HG1 ILE 22 0.329 -3.182 2.753
190 HG21 ILE 22 1HG2 ILE 22 2.294 -5.048 5.003
191 HG22 ILE 22 2HG2 ILE 22 3.514 -4.867 3.745
192 HG23 ILE 22 3HG2 ILE 22 2.721 -6.423 3.985
193 HD11 ILE 22 3HD1 ILE 22 -1.238 -3.431 4.460
194 HD12 ILE 22 1HD1 ILE 22 -0.248 -4.608 5.321
195 HD13 ILE 22 2HD1 ILE 22 -1.039 -5.058 3.810
196 H ASN 23 H ASN 23 1.308 -6.261 -0.021
197 HA ASN 23 HA ASN 23 3.335 -8.233 0.371
198 HB2 ASN 23 2HB ASN 23 0.810 -8.292 -0.647
199 HB3 ASN 23 1HB ASN 23 1.764 -8.349 -2.125
200 HD21 ASN 23 1HD2 ASN 23 3.593 -9.964 -2.061
201 HD22 ASN 23 2HD2 ASN 23 3.239 -11.503 -1.361
202 H ILE 24 H ILE 24 2.682 -5.789 -2.102
203 HA ILE 24 HA ILE 24 4.846 -6.571 -3.793
204 HB ILE 24 HB ILE 24 3.464 -3.889 -3.719
205 HG12 ILE 24 2HG1 ILE 24 2.718 -6.109 -5.593
206 HG13 ILE 24 1HG1 ILE 24 2.029 -6.066 -3.974
207 HG21 ILE 24 1HG2 ILE 24 4.794 -5.280 -6.033
208 HG22 ILE 24 2HG2 ILE 24 5.610 -4.106 -5.000
209 HG23 ILE 24 3HG2 ILE 24 4.213 -3.615 -5.958
210 HD11 ILE 24 3HD1 ILE 24 1.750 -4.010 -6.145
211 HD12 ILE 24 1HD1 ILE 24 1.249 -3.739 -4.476
212 HD13 ILE 24 2HD1 ILE 24 0.489 -5.014 -5.430
213 H ALA 25 H ALA 25 4.443 -4.277 -1.168
214 HA ALA 25 HA ALA 25 6.945 -2.952 -1.567
215 HB1 ALA 25 3HB ALA 25 4.725 -2.319 -0.184
216 HB2 ALA 25 1HB ALA 25 6.300 -1.581 0.105
217 HB3 ALA 25 2HB ALA 25 5.749 -2.910 1.125
218 H GLY 26 H GLY 26 5.912 -5.812 0.124
219 HA2 GLY 26 2HA GLY 26 8.257 -5.997 1.785
220 HA3 GLY 26 1HA GLY 26 7.024 -7.233 1.572
221 H THR 27 H THR 27 7.311 -7.172 -1.368
222 HA THR 27 HA THR 27 9.273 -9.196 -1.610
223 HB THR 27 HB THR 27 8.387 -7.754 -4.050
224 HG1 THR 27 1HG THR 27 6.372 -7.821 -3.537
225 HG21 THR 27 3HG2 THR 27 8.610 -10.618 -3.210
226 HG22 THR 27 1HG2 THR 27 9.452 -9.774 -4.511
227 HG23 THR 27 2HG2 THR 27 7.731 -10.134 -4.661
228 H THR 28 H THR 28 9.184 -5.851 -2.837
229 HA THR 28 HA THR 28 11.717 -5.828 -4.003
230 HB THR 28 HB THR 28 10.173 -4.056 -4.475
231 HG1 THR 28 1HG THR 28 11.617 -2.496 -4.481
232 HG21 THR 28 3HG2 THR 28 9.407 -4.105 -1.894
233 HG22 THR 28 1HG2 THR 28 9.059 -2.784 -3.009
234 HG23 THR 28 2HG2 THR 28 10.429 -2.667 -1.904
235 H HIS 29 H HIS 29 10.728 -5.427 -0.675
236 HA HIS 29 HA HIS 29 13.120 -4.332 0.336
237 HD1 HIS 29 1HD HIS 29 14.180 -4.050 2.220
238 HD2 HIS 29 2HD HIS 29 10.362 -3.500 3.768
239 HE1 HIS 29 1HE HIS 29 14.426 -2.299 4.011
240 HE2 HIS 29 2HE HIS 29 12.118 -2.039 4.985
241 HB2 HIS 29 2HB HIS 29 10.653 -4.942 1.385
242 HB3 HIS 29 1HB HIS 29 11.689 -6.133 2.160
243 H ASP 30 H ASP 30 12.175 -7.584 -0.485
244 HA ASP 30 HA ASP 30 14.246 -8.915 0.950
245 HB2 ASP 30 2HB ASP 30 11.980 -9.676 -0.488
246 HB3 ASP 30 1HB ASP 30 13.323 -10.332 -1.415
247 H VAL 31 H VAL 31 13.812 -8.145 -2.499
248 HA VAL 31 HA VAL 31 16.148 -9.113 -3.535
249 HB VAL 31 HB VAL 31 15.021 -6.449 -4.371
250 HG11 VAL 31 1HG1 VAL 31 16.699 -8.562 -5.609
251 HG12 VAL 31 2HG1 VAL 31 16.857 -6.807 -5.681
252 HG13 VAL 31 3HG1 VAL 31 15.621 -7.624 -6.638
253 HG21 VAL 31 3HG2 VAL 31 13.731 -8.148 -5.987
254 HG22 VAL 31 1HG2 VAL 31 13.047 -7.564 -4.471
255 HG23 VAL 31 2HG2 VAL 31 13.818 -9.148 -4.537
256 H VAL 32 H VAL 32 15.657 -6.096 -1.789
257 HA VAL 32 HA VAL 32 18.278 -5.072 -2.275
258 HB VAL 32 HB VAL 32 16.382 -4.317 -0.047
259 HG11 VAL 32 1HG1 VAL 32 18.657 -3.518 0.291
260 HG12 VAL 32 2HG1 VAL 32 17.578 -2.176 -0.092
261 HG13 VAL 32 3HG1 VAL 32 18.666 -2.815 -1.326
262 HG21 VAL 32 3HG2 VAL 32 15.024 -3.679 -1.713
263 HG22 VAL 32 1HG2 VAL 32 16.296 -3.807 -2.929
264 HG23 VAL 32 2HG2 VAL 32 16.170 -2.356 -1.935
265 H SER 33 H SER 33 16.851 -7.165 0.122
266 HA SER 33 HA SER 33 19.000 -6.959 2.004
267 HG SER 33 HG SER 33 18.616 -8.800 3.792
268 HB2 SER 33 2HB SER 33 16.459 -7.855 2.209
269 HB3 SER 33 1HB SER 33 17.306 -9.391 2.019
270 H PHE 34 H PHE 34 18.309 -8.926 -0.785
271 HA PHE 34 HA PHE 34 20.247 -10.953 -0.208
272 HD1 PHE 34 2HD PHE 34 17.974 -12.166 -0.004
273 HD2 PHE 34 1HD PHE 34 20.049 -12.988 -3.628
274 HE1 PHE 34 2HE PHE 34 17.689 -14.578 0.387
275 HE2 PHE 34 1HE PHE 34 19.767 -15.402 -3.245
276 HZ PHE 34 HZ PHE 34 18.586 -16.199 -1.237
277 HB2 PHE 34 2HB PHE 34 18.221 -10.503 -2.167
278 HB3 PHE 34 1HB PHE 34 19.736 -10.813 -3.010
279 H PHE 35 H PHE 35 20.256 -7.884 -1.871
280 HA PHE 35 HA PHE 35 22.833 -8.298 -3.092
281 HD1 PHE 35 1HD PHE 35 22.507 -8.072 -5.426
282 HD2 PHE 35 2HD PHE 35 23.106 -4.159 -3.863
283 HE1 PHE 35 1HE PHE 35 24.029 -7.565 -7.290
284 HE2 PHE 35 2HE PHE 35 24.630 -3.644 -5.725
285 HZ PHE 35 HZ PHE 35 25.094 -5.348 -7.443
286 HB2 PHE 35 2HB PHE 35 20.815 -6.724 -3.800
287 HB3 PHE 35 1HB PHE 35 21.669 -5.570 -2.782
288 H ARG 36 H ARG 36 21.782 -7.457 0.008
289 HA ARG 36 HA ARG 36 23.569 -5.528 0.865
290 HE ARG 36 HE ARG 36 18.788 -5.508 3.422
291 HB2 ARG 36 2HB ARG 36 22.105 -7.754 2.186
292 HB3 ARG 36 1HB ARG 36 23.409 -6.995 3.091
293 HG2 ARG 36 2HG ARG 36 22.341 -4.909 3.094
294 HG3 ARG 36 1HG ARG 36 21.220 -5.389 1.818
295 HD2 ARG 36 2HD ARG 36 20.382 -7.150 3.474
296 HD3 ARG 36 1HD ARG 36 21.256 -6.234 4.700
297 HH11 ARG 36 1HH1 ARG 36 21.610 -4.297 5.079
298 HH12 ARG 36 2HH1 ARG 36 20.830 -2.844 5.609
299 HH21 ARG 36 1HH2 ARG 36 17.759 -3.598 4.118
300 HH22 ARG 36 2HH2 ARG 36 18.643 -2.449 5.065
301 HA PRO 37 HA PRO 37 26.788 -8.925 2.039
302 HB2 PRO 37 2HB PRO 37 26.362 -11.451 1.125
303 HB3 PRO 37 1HB PRO 37 25.777 -10.880 2.691
304 HG2 PRO 37 2HG PRO 37 24.304 -11.138 0.098
305 HG3 PRO 37 1HG PRO 37 23.771 -11.569 1.734
306 HD2 PRO 37 2HD PRO 37 23.000 -9.283 0.518
307 HD3 PRO 37 1HD PRO 37 23.245 -9.386 2.272
308 H LYS 38 H LYS 38 28.629 -9.639 0.874
309 HA LYS 38 HA LYS 38 28.386 -9.611 -2.055
310 HB2 LYS 38 2HB LYS 38 29.132 -7.375 -1.177
311 HB3 LYS 38 1HB LYS 38 30.569 -8.167 -0.549
312 HG2 LYS 38 2HG LYS 38 31.454 -7.533 -2.509
313 HG3 LYS 38 1HG LYS 38 30.661 -8.990 -3.109
314 HD2 LYS 38 2HD LYS 38 28.874 -7.781 -4.018
315 HD3 LYS 38 1HD LYS 38 29.238 -6.347 -3.057
316 HE2 LYS 38 2HE LYS 38 31.425 -7.178 -4.811
317 HE3 LYS 38 1HE LYS 38 29.950 -6.734 -5.672
318 HZ1 LYS 38 3HZ LYS 38 31.782 -4.975 -4.910
319 HZ2 LYS 38 1HZ LYS 38 30.781 -4.936 -3.547
320 HZ3 LYS 38 2HZ LYS 38 30.144 -4.585 -5.075
321 H LYS 39 H LYS 39 28.895 -11.666 -2.521
322 HA LYS 39 HA LYS 39 30.088 -13.592 -2.729
323 HB2 LYS 39 2HB LYS 39 32.432 -11.904 -1.841
324 HB3 LYS 39 1HB LYS 39 32.510 -13.436 -2.704
325 HG2 LYS 39 2HG LYS 39 32.298 -12.430 -4.670
326 HG3 LYS 39 1HG LYS 39 30.885 -11.523 -4.128
327 HD2 LYS 39 2HD LYS 39 32.537 -9.927 -4.727
328 HD3 LYS 39 1HD LYS 39 32.473 -9.954 -2.965
329 HE2 LYS 39 2HE LYS 39 34.370 -11.762 -3.276
330 HE3 LYS 39 1HE LYS 39 34.597 -10.925 -4.809
331 HZ1 LYS 39 3HZ LYS 39 34.471 -9.422 -2.271
332 HZ2 LYS 39 1HZ LYS 39 35.164 -8.960 -3.745
333 HZ3 LYS 39 2HZ LYS 39 35.919 -10.131 -2.787
334 H LYS 40 H LYS 40 28.813 -12.991 -0.206
335 HA LYS 40 HA LYS 40 30.592 -14.397 1.674
336 HB2 LYS 40 2HB LYS 40 28.212 -12.608 2.193
337 HB3 LYS 40 1HB LYS 40 29.057 -13.509 3.443
338 HG2 LYS 40 2HG LYS 40 30.545 -11.618 1.669
339 HG3 LYS 40 1HG LYS 40 29.642 -11.026 3.065
340 HD2 LYS 40 2HD LYS 40 30.923 -12.788 4.408
341 HD3 LYS 40 1HD LYS 40 31.985 -12.906 3.005
342 HE2 LYS 40 2HE LYS 40 32.892 -11.361 4.653
343 HE3 LYS 40 1HE LYS 40 32.466 -10.515 3.165
344 HZ1 LYS 40 3HZ LYS 40 30.645 -9.519 4.156
345 HZ2 LYS 40 1HZ LYS 40 31.791 -9.489 5.400
346 HZ3 LYS 40 2HZ LYS 40 30.560 -10.648 5.412
347 H LYS 41 H LYS 41 27.449 -14.407 0.143
348 HA LYS 41 HA LYS 41 27.140 -17.209 0.574
349 HB2 LYS 41 2HB LYS 41 26.435 -16.255 2.789
350 HB3 LYS 41 1HB LYS 41 25.127 -15.427 1.954
351 HG2 LYS 41 2HG LYS 41 24.233 -17.402 2.921
352 HG3 LYS 41 1HG LYS 41 24.315 -17.657 1.177
353 HD2 LYS 41 2HD LYS 41 26.757 -18.571 2.038
354 HD3 LYS 41 1HD LYS 41 25.679 -19.058 3.349
355 HE2 LYS 41 2HE LYS 41 25.597 -20.869 1.893
356 HE3 LYS 41 1HE LYS 41 24.157 -19.945 1.472
357 HZ1 LYS 41 3HZ LYS 41 26.723 -19.622 0.032
358 HZ2 LYS 41 1HZ LYS 41 25.183 -19.116 -0.454
359 HZ3 LYS 41 2HZ LYS 41 25.564 -20.763 -0.433
360 H HIS 42 H HIS 42 27.272 -16.111 -1.779
361 HA HIS 42 HA HIS 42 24.627 -15.382 -2.749
362 HD1 HIS 42 1HD HIS 42 28.844 -15.310 -2.740
363 HD2 HIS 42 2HD HIS 42 27.305 -16.678 -6.349
364 HE1 HIS 42 1HE HIS 42 30.731 -16.549 -3.850
365 HE2 HIS 42 2HE HIS 42 29.796 -17.309 -6.063
366 HB2 HIS 42 2HB HIS 42 25.748 -14.968 -4.887
367 HB3 HIS 42 1HB HIS 42 26.581 -14.140 -3.576
Start of MODEL 3
1 H1 GLY 1 1H GLY 1 -32.504 6.579 -0.659
2 H2 GLY 1 2H GLY 1 -31.257 6.163 0.405
3 H3 GLY 1 3H GLY 1 -31.353 5.425 -1.113
4 HA2 GLY 1 1HA GLY 1 -31.015 7.636 -2.156
5 HA3 GLY 1 2HA GLY 1 -30.718 8.266 -0.543
6 H LYS 2 H LYS 2 -29.249 6.169 0.548
7 HA LYS 2 HA LYS 2 -26.801 6.302 -1.082
8 HB2 LYS 2 2HB LYS 2 -25.666 5.862 1.173
9 HB3 LYS 2 1HB LYS 2 -26.356 7.456 0.909
10 HG2 LYS 2 2HG LYS 2 -27.915 7.197 2.513
11 HG3 LYS 2 1HG LYS 2 -28.144 5.482 2.164
12 HD2 LYS 2 2HD LYS 2 -26.221 4.879 3.410
13 HD3 LYS 2 1HD LYS 2 -25.679 6.554 3.516
14 HE2 LYS 2 2HE LYS 2 -26.870 6.892 5.363
15 HE3 LYS 2 1HE LYS 2 -28.332 6.275 4.598
16 HZ1 LYS 2 3HZ LYS 2 -28.047 4.233 5.485
17 HZ2 LYS 2 1HZ LYS 2 -27.187 5.093 6.662
18 HZ3 LYS 2 2HZ LYS 2 -26.358 4.299 5.421
19 H ILE 3 H ILE 3 -26.459 4.446 -2.117
20 HA ILE 3 HA ILE 3 -27.591 1.983 -1.525
21 HB ILE 3 HB ILE 3 -24.940 2.279 -2.916
22 HG12 ILE 3 2HG1 ILE 3 -26.838 2.352 -4.912
23 HG13 ILE 3 1HG1 ILE 3 -27.557 3.377 -3.673
24 HG21 ILE 3 1HG2 ILE 3 -25.992 0.031 -2.392
25 HG22 ILE 3 2HG2 ILE 3 -25.537 0.329 -4.070
26 HG23 ILE 3 3HG2 ILE 3 -27.225 0.456 -3.576
27 HD11 ILE 3 3HD1 ILE 3 -25.082 3.769 -5.264
28 HD12 ILE 3 1HD1 ILE 3 -25.169 4.460 -3.643
29 HD13 ILE 3 2HD1 ILE 3 -26.363 4.912 -4.859
30 HA PRO 4 HA PRO 4 -25.047 0.851 1.990
31 HB2 PRO 4 2HB PRO 4 -26.139 -1.572 2.450
32 HB3 PRO 4 1HB PRO 4 -26.966 -0.069 2.871
33 HG2 PRO 4 2HG PRO 4 -27.351 -1.836 0.484
34 HG3 PRO 4 1HG PRO 4 -28.571 -1.052 1.504
35 HD2 PRO 4 2HD PRO 4 -27.795 -0.061 -0.908
36 HD3 PRO 4 1HD PRO 4 -28.352 0.969 0.426
37 H VAL 5 H VAL 5 -25.608 -1.319 -0.738
38 HA VAL 5 HA VAL 5 -23.569 -3.156 -0.249
39 HB VAL 5 HB VAL 5 -24.420 -2.310 -3.011
40 HG11 VAL 5 1HG1 VAL 5 -23.184 -4.703 -1.765
41 HG12 VAL 5 2HG1 VAL 5 -22.815 -3.904 -3.293
42 HG13 VAL 5 3HG1 VAL 5 -24.242 -4.930 -3.157
43 HG21 VAL 5 3HG2 VAL 5 -26.176 -4.174 -2.668
44 HG22 VAL 5 1HG2 VAL 5 -26.507 -2.566 -2.017
45 HG23 VAL 5 2HG2 VAL 5 -25.948 -3.856 -0.948
46 H LYS 6 H LYS 6 -23.525 -0.018 -1.829
47 HA LYS 6 HA LYS 6 -20.953 -0.199 -2.963
48 HB2 LYS 6 2HB LYS 6 -22.916 1.589 -3.198
49 HB3 LYS 6 1HB LYS 6 -21.947 2.436 -2.001
50 HG2 LYS 6 2HG LYS 6 -21.107 3.287 -3.956
51 HG3 LYS 6 1HG LYS 6 -19.991 1.952 -3.657
52 HD2 LYS 6 2HD LYS 6 -20.926 0.632 -5.321
53 HD3 LYS 6 1HD LYS 6 -22.449 1.522 -5.308
54 HE2 LYS 6 2HE LYS 6 -21.601 2.435 -7.191
55 HE3 LYS 6 1HE LYS 6 -20.780 3.491 -6.043
56 HZ1 LYS 6 3HZ LYS 6 -19.101 2.768 -7.447
57 HZ2 LYS 6 1HZ LYS 6 -19.690 1.184 -7.527
58 HZ3 LYS 6 2HZ LYS 6 -18.943 1.738 -6.116
59 H ALA 7 H ALA 7 -22.083 0.724 0.226
60 HA ALA 7 HA ALA 7 -19.698 1.859 1.195
61 HB1 ALA 7 3HB ALA 7 -21.649 2.256 2.447
62 HB2 ALA 7 1HB ALA 7 -20.654 1.211 3.460
63 HB3 ALA 7 2HB ALA 7 -22.020 0.538 2.570
64 H ILE 8 H ILE 8 -20.931 -1.469 1.325
65 HA ILE 8 HA ILE 8 -18.724 -2.517 2.766
66 HB ILE 8 HB ILE 8 -20.475 -4.108 0.910
67 HG12 ILE 8 2HG1 ILE 8 -21.353 -4.068 3.679
68 HG13 ILE 8 1HG1 ILE 8 -21.426 -2.467 2.958
69 HG21 ILE 8 1HG2 ILE 8 -20.104 -5.864 2.628
70 HG22 ILE 8 2HG2 ILE 8 -18.990 -4.768 3.445
71 HG23 ILE 8 3HG2 ILE 8 -18.630 -5.338 1.815
72 HD11 ILE 8 3HD1 ILE 8 -23.175 -4.702 2.605
73 HD12 ILE 8 1HD1 ILE 8 -22.502 -4.203 1.053
74 HD13 ILE 8 2HD1 ILE 8 -23.360 -3.035 2.060
75 H LYS 9 H LYS 9 -19.561 -2.459 -0.668
76 HA LYS 9 HA LYS 9 -17.434 -3.952 -1.652
77 HB2 LYS 9 2HB LYS 9 -19.562 -2.577 -2.746
78 HB3 LYS 9 1HB LYS 9 -18.166 -1.715 -3.380
79 HG2 LYS 9 2HG LYS 9 -17.282 -3.749 -4.320
80 HG3 LYS 9 1HG LYS 9 -18.584 -4.690 -3.589
81 HD2 LYS 9 2HD LYS 9 -19.332 -4.414 -5.764
82 HD3 LYS 9 1HD LYS 9 -20.139 -3.093 -4.917
83 HE2 LYS 9 2HE LYS 9 -17.501 -2.365 -5.915
84 HE3 LYS 9 1HE LYS 9 -18.605 -2.866 -7.195
85 HZ1 LYS 9 3HZ LYS 9 -18.939 -0.581 -6.960
86 HZ2 LYS 9 1HZ LYS 9 -18.926 -0.647 -5.267
87 HZ3 LYS 9 2HZ LYS 9 -20.240 -1.271 -6.128
88 H GLN 10 H GLN 10 -17.665 -0.434 -1.270
89 HA GLN 10 HA GLN 10 -15.041 0.116 -2.150
90 HB2 GLN 10 2HB GLN 10 -15.372 2.337 -1.298
91 HB3 GLN 10 1HB GLN 10 -16.883 1.793 -2.013
92 HG2 GLN 10 2HG GLN 10 -17.733 1.257 0.227
93 HG3 GLN 10 1HG GLN 10 -16.229 1.856 0.924
94 HE21 GLN 10 1HE2 GLN 10 -19.097 2.757 -0.879
95 HE22 GLN 10 2HE2 GLN 10 -19.060 4.434 -0.467
96 H ALA 11 H ALA 11 -16.403 -0.557 1.021
97 HA ALA 11 HA ALA 11 -14.024 0.019 2.481
98 HB1 ALA 11 3HB ALA 11 -15.155 -0.774 4.378
99 HB2 ALA 11 1HB ALA 11 -16.208 -1.814 3.421
100 HB3 ALA 11 2HB ALA 11 -16.416 -0.063 3.369
101 H GLY 12 H GLY 12 -15.343 -2.831 0.930
102 HA2 GLY 12 2HA GLY 12 -13.534 -4.688 2.127
103 HA3 GLY 12 1HA GLY 12 -14.525 -4.973 0.703
104 H LYS 13 H LYS 13 -13.401 -2.596 -0.658
105 HA LYS 13 HA LYS 13 -11.207 -3.904 -1.925
106 HB2 LYS 13 2HB LYS 13 -12.982 -1.821 -2.562
107 HB3 LYS 13 1HB LYS 13 -11.384 -1.090 -2.566
108 HG2 LYS 13 2HG LYS 13 -11.765 -1.812 -4.767
109 HG3 LYS 13 1HG LYS 13 -10.661 -2.996 -4.065
110 HD2 LYS 13 2HD LYS 13 -12.098 -4.561 -4.745
111 HD3 LYS 13 1HD LYS 13 -13.176 -3.995 -3.468
112 HE2 LYS 13 2HE LYS 13 -13.676 -2.193 -5.449
113 HE3 LYS 13 1HE LYS 13 -13.347 -3.655 -6.378
114 HZ1 LYS 13 3HZ LYS 13 -15.315 -3.465 -4.163
115 HZ2 LYS 13 1HZ LYS 13 -15.045 -4.810 -5.156
116 HZ3 LYS 13 2HZ LYS 13 -15.705 -3.395 -5.806
117 H VAL 14 H VAL 14 -11.533 -1.216 0.339
118 HA VAL 14 HA VAL 14 -8.903 -0.287 0.274
119 HB VAL 14 HB VAL 14 -10.597 -0.309 2.764
120 HG11 VAL 14 1HG1 VAL 14 -8.133 0.601 2.458
121 HG12 VAL 14 2HG1 VAL 14 -9.315 1.423 3.477
122 HG13 VAL 14 3HG1 VAL 14 -9.001 2.006 1.842
123 HG21 VAL 14 3HG2 VAL 14 -11.145 2.079 1.516
124 HG22 VAL 14 1HG2 VAL 14 -12.222 0.686 1.591
125 HG23 VAL 14 2HG2 VAL 14 -11.184 0.922 0.187
126 H ILE 15 H ILE 15 -10.377 -2.966 1.995
127 HA ILE 15 HA ILE 15 -8.176 -3.471 3.733
128 HB ILE 15 HB ILE 15 -10.288 -5.436 2.840
129 HG12 ILE 15 2HG1 ILE 15 -10.357 -3.683 5.301
130 HG13 ILE 15 1HG1 ILE 15 -11.162 -3.250 3.795
131 HG21 ILE 15 1HG2 ILE 15 -9.801 -6.581 4.917
132 HG22 ILE 15 2HG2 ILE 15 -8.614 -5.350 5.348
133 HG23 ILE 15 3HG2 ILE 15 -8.327 -6.408 3.965
134 HD11 ILE 15 3HD1 ILE 15 -11.845 -5.334 5.784
135 HD12 ILE 15 1HD1 ILE 15 -12.214 -5.656 4.090
136 HD13 ILE 15 2HD1 ILE 15 -12.890 -4.234 4.885
137 H GLY 16 H GLY 16 -9.039 -4.484 0.495
138 HA2 GLY 16 2HA GLY 16 -6.910 -6.464 0.399
139 HA3 GLY 16 1HA GLY 16 -8.035 -6.079 -0.893
140 H LYS 17 H LYS 17 -7.631 -3.293 -1.002
141 HA LYS 17 HA LYS 17 -5.428 -3.139 -2.725
142 HB2 LYS 17 2HB LYS 17 -7.518 -1.417 -1.854
143 HB3 LYS 17 1HB LYS 17 -6.003 -0.544 -1.668
144 HG2 LYS 17 2HG LYS 17 -6.407 -1.983 -4.220
145 HG3 LYS 17 1HG LYS 17 -7.403 -0.555 -3.932
146 HD2 LYS 17 2HD LYS 17 -4.448 -0.454 -3.471
147 HD3 LYS 17 1HD LYS 17 -5.100 -0.294 -5.104
148 HE2 LYS 17 2HE LYS 17 -6.394 1.621 -4.463
149 HE3 LYS 17 1HE LYS 17 -5.961 1.404 -2.767
150 HZ1 LYS 17 3HZ LYS 17 -4.337 2.439 -4.982
151 HZ2 LYS 17 1HZ LYS 17 -3.559 1.649 -3.706
152 HZ3 LYS 17 2HZ LYS 17 -4.497 3.022 -3.402
153 H GLY 18 H GLY 18 -5.764 -2.459 0.700
154 HA2 GLY 18 2HA GLY 18 -3.191 -1.240 0.992
155 HA3 GLY 18 1HA GLY 18 -4.219 -1.825 2.293
156 H LEU 19 H LEU 19 -4.447 -4.514 1.354
157 HA LEU 19 HA LEU 19 -2.011 -5.561 2.436
158 HG LEU 19 HG LEU 19 -2.474 -7.253 3.730
159 HB2 LEU 19 2HB LEU 19 -4.594 -6.450 2.312
160 HB3 LEU 19 1HB LEU 19 -3.824 -7.444 1.091
161 HD11 LEU 19 1HD1 LEU 19 -5.124 -7.661 3.843
162 HD12 LEU 19 2HD1 LEU 19 -3.973 -8.426 4.940
163 HD13 LEU 19 3HD1 LEU 19 -4.577 -9.311 3.539
164 HD21 LEU 19 3HD2 LEU 19 -2.478 -9.839 3.051
165 HD22 LEU 19 1HD2 LEU 19 -1.294 -8.686 2.432
166 HD23 LEU 19 2HD2 LEU 19 -2.693 -9.126 1.452
167 H ARG 20 H ARG 20 -3.427 -5.241 -0.753
168 HA ARG 20 HA ARG 20 -1.506 -6.903 -2.069
169 HE ARG 20 HE ARG 20 -4.370 -8.644 -3.911
170 HB2 ARG 20 2HB ARG 20 -3.828 -6.359 -2.921
171 HB3 ARG 20 1HB ARG 20 -3.219 -4.760 -3.326
172 HG2 ARG 20 2HG ARG 20 -2.259 -5.490 -5.194
173 HG3 ARG 20 1HG ARG 20 -1.532 -6.874 -4.376
174 HD2 ARG 20 2HD ARG 20 -4.429 -6.752 -5.193
175 HD3 ARG 20 1HD ARG 20 -3.160 -7.433 -6.211
176 HH11 ARG 20 1HH1 ARG 20 -1.485 -8.524 -5.869
177 HH12 ARG 20 2HH1 ARG 20 -0.969 -10.119 -5.430
178 HH21 ARG 20 1HH2 ARG 20 -3.693 -10.741 -3.330
179 HH22 ARG 20 2HH2 ARG 20 -2.222 -11.376 -3.989
180 H ALA 21 H ALA 21 -1.729 -3.538 -1.199
181 HA ALA 21 HA ALA 21 0.384 -2.642 -2.903
182 HB1 ALA 21 3HB ALA 21 -1.298 -1.460 -0.782
183 HB2 ALA 21 1HB ALA 21 -0.878 -0.836 -2.379
184 HB3 ALA 21 2HB ALA 21 0.276 -0.713 -1.051
185 H ILE 22 H ILE 22 0.126 -3.557 0.498
186 HA ILE 22 HA ILE 22 2.809 -2.949 1.181
187 HB ILE 22 HB ILE 22 0.955 -4.946 2.492
188 HG12 ILE 22 2HG1 ILE 22 1.464 -2.208 3.573
189 HG13 ILE 22 1HG1 ILE 22 0.342 -2.378 2.225
190 HG21 ILE 22 1HG2 ILE 22 3.068 -5.424 3.336
191 HG22 ILE 22 2HG2 ILE 22 2.415 -4.285 4.513
192 HG23 ILE 22 3HG2 ILE 22 3.572 -3.734 3.301
193 HD11 ILE 22 3HD1 ILE 22 -0.843 -4.123 3.641
194 HD12 ILE 22 1HD1 ILE 22 -0.979 -2.440 4.153
195 HD13 ILE 22 2HD1 ILE 22 0.131 -3.528 4.984
196 H ASN 23 H ASN 23 1.271 -5.696 -0.309
197 HA ASN 23 HA ASN 23 3.348 -7.579 0.132
198 HB2 ASN 23 2HB ASN 23 0.806 -7.710 -0.879
199 HB3 ASN 23 1HB ASN 23 1.777 -7.912 -2.335
200 HD21 ASN 23 1HD2 ASN 23 2.021 -8.993 1.041
201 HD22 ASN 23 2HD2 ASN 23 2.265 -10.661 0.665
202 H ILE 24 H ILE 24 2.628 -5.305 -2.479
203 HA ILE 24 HA ILE 24 4.723 -6.156 -4.195
204 HB ILE 24 HB ILE 24 3.436 -3.427 -4.114
205 HG12 ILE 24 2HG1 ILE 24 2.564 -5.606 -5.969
206 HG13 ILE 24 1HG1 ILE 24 1.949 -5.593 -4.320
207 HG21 ILE 24 1HG2 ILE 24 5.533 -3.706 -5.451
208 HG22 ILE 24 2HG2 ILE 24 4.122 -3.209 -6.385
209 HG23 ILE 24 3HG2 ILE 24 4.669 -4.883 -6.441
210 HD11 ILE 24 3HD1 ILE 24 1.633 -2.984 -5.241
211 HD12 ILE 24 1HD1 ILE 24 0.378 -4.200 -5.009
212 HD13 ILE 24 2HD1 ILE 24 1.153 -4.020 -6.583
213 H ALA 25 H ALA 25 4.482 -3.758 -1.634
214 HA ALA 25 HA ALA 25 7.122 -2.698 -2.127
215 HB1 ALA 25 3HB ALA 25 5.246 -2.243 0.193
216 HB2 ALA 25 1HB ALA 25 5.353 -1.251 -1.263
217 HB3 ALA 25 2HB ALA 25 6.716 -1.329 -0.146
218 H GLY 26 H GLY 26 5.638 -5.084 -0.050
219 HA2 GLY 26 2HA GLY 26 7.765 -5.334 1.811
220 HA3 GLY 26 1HA GLY 26 6.511 -6.528 1.511
221 H THR 27 H THR 27 7.105 -6.835 -1.297
222 HA THR 27 HA THR 27 9.023 -8.890 -1.144
223 HB THR 27 HB THR 27 8.121 -7.459 -3.649
224 HG1 THR 27 1HG THR 27 6.406 -8.903 -3.666
225 HG21 THR 27 3HG2 THR 27 8.251 -9.896 -4.494
226 HG22 THR 27 1HG2 THR 27 9.330 -10.134 -3.119
227 HG23 THR 27 2HG2 THR 27 9.731 -8.946 -4.358
228 H THR 28 H THR 28 9.218 -5.754 -2.838
229 HA THR 28 HA THR 28 11.912 -5.917 -3.538
230 HB THR 28 HB THR 28 10.455 -4.270 -4.543
231 HG1 THR 28 1HG THR 28 11.874 -2.612 -4.545
232 HG21 THR 28 3HG2 THR 28 9.446 -2.483 -3.477
233 HG22 THR 28 1HG2 THR 28 10.458 -2.637 -2.041
234 HG23 THR 28 2HG2 THR 28 9.186 -3.820 -2.355
235 H HIS 29 H HIS 29 10.389 -5.044 -0.530
236 HA HIS 29 HA HIS 29 12.688 -3.815 0.640
237 HD1 HIS 29 1HD HIS 29 13.533 -3.401 2.517
238 HD2 HIS 29 2HD HIS 29 9.741 -2.408 3.898
239 HE1 HIS 29 1HE HIS 29 13.905 -1.744 4.370
240 HE2 HIS 29 2HE HIS 29 11.594 -1.092 5.132
241 HB2 HIS 29 2HB HIS 29 10.124 -3.686 1.287
242 HB3 HIS 29 1HB HIS 29 10.544 -5.052 2.316
243 H ASP 30 H ASP 30 11.627 -7.072 0.212
244 HA ASP 30 HA ASP 30 13.555 -8.043 2.199
245 HB2 ASP 30 2HB ASP 30 10.972 -8.867 1.584
246 HB3 ASP 30 1HB ASP 30 11.994 -10.091 0.837
247 H VAL 31 H VAL 31 12.509 -8.861 -1.116
248 HA VAL 31 HA VAL 31 14.588 -10.513 -1.819
249 HB VAL 31 HB VAL 31 13.334 -8.556 -3.730
250 HG11 VAL 31 1HG1 VAL 31 13.994 -9.952 -5.399
251 HG12 VAL 31 2HG1 VAL 31 13.930 -11.386 -4.375
252 HG13 VAL 31 3HG1 VAL 31 15.282 -10.262 -4.236
253 HG21 VAL 31 3HG2 VAL 31 11.343 -9.394 -3.147
254 HG22 VAL 31 1HG2 VAL 31 12.075 -10.667 -2.171
255 HG23 VAL 31 2HG2 VAL 31 11.873 -10.893 -3.908
256 H VAL 32 H VAL 32 14.367 -7.053 -2.604
257 HA VAL 32 HA VAL 32 16.933 -6.772 -3.653
258 HB VAL 32 HB VAL 32 15.445 -4.625 -2.139
259 HG11 VAL 32 1HG1 VAL 32 16.965 -3.939 -4.543
260 HG12 VAL 32 2HG1 VAL 32 17.950 -4.553 -3.214
261 HG13 VAL 32 3HG1 VAL 32 16.913 -3.149 -2.968
262 HG21 VAL 32 3HG2 VAL 32 13.914 -4.485 -3.752
263 HG22 VAL 32 1HG2 VAL 32 14.484 -6.057 -4.314
264 HG23 VAL 32 2HG2 VAL 32 15.137 -4.579 -5.020
265 H SER 33 H SER 33 15.852 -6.919 -0.350
266 HA SER 33 HA SER 33 18.154 -5.770 0.851
267 HG SER 33 HG SER 33 18.086 -6.064 3.220
268 HB2 SER 33 2HB SER 33 15.695 -6.526 1.769
269 HB3 SER 33 1HB SER 33 16.714 -7.814 2.413
270 H PHE 34 H PHE 34 17.309 -9.001 -0.209
271 HA PHE 34 HA PHE 34 19.380 -10.391 1.116
272 HD1 PHE 34 2HD PHE 34 20.018 -13.263 0.290
273 HD2 PHE 34 1HD PHE 34 16.055 -11.867 0.975
274 HE1 PHE 34 2HE PHE 34 19.660 -15.084 1.904
275 HE2 PHE 34 1HE PHE 34 15.691 -13.687 2.593
276 HZ PHE 34 HZ PHE 34 17.493 -15.298 3.057
277 HB2 PHE 34 2HB PHE 34 17.315 -10.989 -0.799
278 HB3 PHE 34 1HB PHE 34 18.826 -11.736 -1.305
279 H PHE 35 H PHE 35 19.226 -8.646 -1.918
280 HA PHE 35 HA PHE 35 21.941 -9.466 -2.617
281 HD1 PHE 35 1HD PHE 35 22.962 -7.770 -5.357
282 HD2 PHE 35 2HD PHE 35 20.231 -11.020 -5.049
283 HE1 PHE 35 1HE PHE 35 24.290 -9.036 -6.998
284 HE2 PHE 35 2HE PHE 35 21.554 -12.291 -6.690
285 HZ PHE 35 HZ PHE 35 23.586 -11.299 -7.666
286 HB2 PHE 35 2HB PHE 35 19.681 -8.894 -4.140
287 HB3 PHE 35 1HB PHE 35 20.721 -7.493 -4.378
288 H ARG 36 H ARG 36 20.134 -6.699 -1.488
289 HA ARG 36 HA ARG 36 22.661 -5.293 -1.034
290 HE ARG 36 HE ARG 36 22.079 -0.825 -2.528
291 HB2 ARG 36 2HB ARG 36 20.823 -4.549 -3.026
292 HB3 ARG 36 1HB ARG 36 20.586 -3.401 -1.717
293 HG2 ARG 36 2HG ARG 36 22.840 -2.694 -1.806
294 HG3 ARG 36 1HG ARG 36 23.290 -4.035 -2.862
295 HD2 ARG 36 2HD ARG 36 23.055 -2.507 -4.497
296 HD3 ARG 36 1HD ARG 36 21.338 -2.870 -4.329
297 HH11 ARG 36 1HH1 ARG 36 21.532 -1.390 -5.927
298 HH12 ARG 36 2HH1 ARG 36 21.077 0.248 -6.255
299 HH21 ARG 36 1HH2 ARG 36 21.482 1.330 -2.956
300 HH22 ARG 36 2HH2 ARG 36 21.050 1.793 -4.569
301 HA PRO 37 HA PRO 37 19.986 -5.619 2.788
302 HB2 PRO 37 2HB PRO 37 22.741 -5.405 3.896
303 HB3 PRO 37 1HB PRO 37 21.416 -6.470 4.373
304 HG2 PRO 37 2HG PRO 37 23.474 -7.410 2.971
305 HG3 PRO 37 1HG PRO 37 21.822 -7.967 2.647
306 HD2 PRO 37 2HD PRO 37 23.516 -6.053 1.103
307 HD3 PRO 37 1HD PRO 37 22.353 -7.260 0.518
308 H LYS 38 H LYS 38 20.394 -4.187 4.874
309 HA LYS 38 HA LYS 38 21.241 -1.498 4.059
310 HB2 LYS 38 2HB LYS 38 18.551 -2.382 4.727
311 HB3 LYS 38 1HB LYS 38 19.083 -1.072 5.769
312 HG2 LYS 38 2HG LYS 38 19.742 -0.525 3.016
313 HG3 LYS 38 1HG LYS 38 18.020 -0.868 3.205
314 HD2 LYS 38 2HD LYS 38 17.917 1.328 3.718
315 HD3 LYS 38 1HD LYS 38 18.416 0.765 5.315
316 HE2 LYS 38 2HE LYS 38 20.824 1.038 4.291
317 HE3 LYS 38 1HE LYS 38 19.996 2.150 3.203
318 HZ1 LYS 38 3HZ LYS 38 19.611 2.384 6.112
319 HZ2 LYS 38 1HZ LYS 38 19.469 3.574 4.916
320 HZ3 LYS 38 2HZ LYS 38 20.997 3.034 5.393
321 H LYS 39 H LYS 39 22.527 -3.539 5.694
322 HA LYS 39 HA LYS 39 23.727 -3.696 7.618
323 HB2 LYS 39 2HB LYS 39 24.040 -1.186 6.949
324 HB3 LYS 39 1HB LYS 39 23.000 -0.879 8.334
325 HG2 LYS 39 2HG LYS 39 24.876 -2.646 9.318
326 HG3 LYS 39 1HG LYS 39 25.806 -1.606 8.236
327 HD2 LYS 39 2HD LYS 39 25.919 -0.306 10.090
328 HD3 LYS 39 1HD LYS 39 24.360 0.263 9.494
329 HE2 LYS 39 2HE LYS 39 23.191 -0.805 11.129
330 HE3 LYS 39 1HE LYS 39 24.350 -2.128 11.243
331 HZ1 LYS 39 3HZ LYS 39 24.287 0.409 12.653
332 HZ2 LYS 39 1HZ LYS 39 25.818 -0.107 12.152
333 HZ3 LYS 39 2HZ LYS 39 24.880 -1.093 13.153
334 H LYS 40 H LYS 40 22.661 -5.089 8.904
335 HA LYS 40 HA LYS 40 20.424 -4.075 10.514
336 HB2 LYS 40 2HB LYS 40 21.171 -6.780 9.496
337 HB3 LYS 40 1HB LYS 40 20.244 -6.668 10.987
338 HG2 LYS 40 2HG LYS 40 18.998 -4.951 9.141
339 HG3 LYS 40 1HG LYS 40 19.354 -6.450 8.281
340 HD2 LYS 40 2HD LYS 40 18.263 -6.831 10.976
341 HD3 LYS 40 1HD LYS 40 17.166 -6.023 9.855
342 HE2 LYS 40 2HE LYS 40 18.604 -8.595 9.228
343 HE3 LYS 40 1HE LYS 40 16.983 -8.526 9.918
344 HZ1 LYS 40 3HZ LYS 40 16.439 -7.066 7.920
345 HZ2 LYS 40 1HZ LYS 40 16.642 -8.723 7.640
346 HZ3 LYS 40 2HZ LYS 40 17.882 -7.640 7.246
347 H LYS 41 H LYS 41 22.685 -6.729 11.107
348 HA LYS 41 HA LYS 41 23.259 -5.540 13.740
349 HB2 LYS 41 2HB LYS 41 22.082 -7.860 13.471
350 HB3 LYS 41 1HB LYS 41 23.706 -8.438 13.122
351 HG2 LYS 41 2HG LYS 41 24.176 -7.043 15.376
352 HG3 LYS 41 1HG LYS 41 22.511 -7.557 15.660
353 HD2 LYS 41 2HD LYS 41 23.094 -9.715 15.923
354 HD3 LYS 41 1HD LYS 41 24.277 -9.655 14.615
355 HE2 LYS 41 2HE LYS 41 24.640 -8.690 17.448
356 HE3 LYS 41 1HE LYS 41 25.422 -10.077 16.688
357 HZ1 LYS 41 3HZ LYS 41 26.147 -8.134 15.027
358 HZ2 LYS 41 1HZ LYS 41 27.064 -8.589 16.375
359 HZ3 LYS 41 2HZ LYS 41 26.039 -7.248 16.464
360 H HIS 42 H HIS 42 25.027 -4.302 13.102
361 HA HIS 42 HA HIS 42 27.216 -3.846 12.699
362 HD1 HIS 42 1HD HIS 42 30.325 -5.102 12.390
363 HD2 HIS 42 2HD HIS 42 28.540 -4.432 16.082
364 HE1 HIS 42 1HE HIS 42 32.034 -3.850 13.746
365 HE2 HIS 42 2HE HIS 42 30.963 -3.530 16.004
366 HB2 HIS 42 2HB HIS 42 27.212 -6.046 14.328
367 HB3 HIS 42 1HB HIS 42 28.175 -6.616 12.968
Start of MODEL 4
1 H1 GLY 1 1H GLY 1 -22.217 15.304 -0.426
2 H2 GLY 1 2H GLY 1 -23.578 14.315 -0.588
3 H3 GLY 1 3H GLY 1 -23.323 15.582 -1.676
4 HA2 GLY 1 1HA GLY 1 -21.651 14.507 -2.800
5 HA3 GLY 1 2HA GLY 1 -21.286 13.483 -1.423
6 H LYS 2 H LYS 2 -21.316 11.787 -3.094
7 HA LYS 2 HA LYS 2 -23.920 11.055 -4.145
8 HB2 LYS 2 2HB LYS 2 -21.221 9.713 -4.380
9 HB3 LYS 2 1HB LYS 2 -22.682 9.167 -5.192
10 HG2 LYS 2 2HG LYS 2 -21.403 11.865 -5.587
11 HG3 LYS 2 1HG LYS 2 -21.186 10.472 -6.651
12 HD2 LYS 2 2HD LYS 2 -23.758 10.468 -6.810
13 HD3 LYS 2 1HD LYS 2 -23.654 12.106 -6.162
14 HE2 LYS 2 2HE LYS 2 -21.881 12.403 -8.077
15 HE3 LYS 2 1HE LYS 2 -22.736 11.036 -8.788
16 HZ1 LYS 2 3HZ LYS 2 -24.065 12.618 -9.612
17 HZ2 LYS 2 1HZ LYS 2 -23.577 13.784 -8.487
18 HZ3 LYS 2 2HZ LYS 2 -24.759 12.650 -8.070
19 H ILE 3 H ILE 3 -24.088 8.404 -4.055
20 HA ILE 3 HA ILE 3 -25.133 7.805 -1.576
21 HB ILE 3 HB ILE 3 -23.970 5.655 -3.323
22 HG12 ILE 3 2HG1 ILE 3 -26.548 5.985 -4.233
23 HG13 ILE 3 1HG1 ILE 3 -26.009 7.650 -4.028
24 HG21 ILE 3 1HG2 ILE 3 -24.950 4.794 -1.378
25 HG22 ILE 3 2HG2 ILE 3 -26.165 4.579 -2.637
26 HG23 ILE 3 3HG2 ILE 3 -26.318 5.899 -1.477
27 HD11 ILE 3 3HD1 ILE 3 -24.941 5.529 -5.838
28 HD12 ILE 3 1HD1 ILE 3 -23.933 6.896 -5.359
29 HD13 ILE 3 2HD1 ILE 3 -25.451 7.175 -6.217
30 HA PRO 4 HA PRO 4 -21.459 7.023 0.822
31 HB2 PRO 4 2HB PRO 4 -22.619 6.175 3.087
32 HB3 PRO 4 1HB PRO 4 -22.727 7.861 2.565
33 HG2 PRO 4 2HG PRO 4 -24.742 5.664 2.299
34 HG3 PRO 4 1HG PRO 4 -24.989 7.353 2.774
35 HD2 PRO 4 2HD PRO 4 -25.462 6.396 0.252
36 HD3 PRO 4 1HD PRO 4 -25.035 8.083 0.601
37 H VAL 5 H VAL 5 -23.917 4.582 0.285
38 HA VAL 5 HA VAL 5 -22.771 2.361 1.441
39 HB VAL 5 HB VAL 5 -24.184 2.291 -1.219
40 HG11 VAL 5 1HG1 VAL 5 -23.478 0.148 -0.720
41 HG12 VAL 5 2HG1 VAL 5 -25.112 0.179 -0.057
42 HG13 VAL 5 3HG1 VAL 5 -23.723 0.364 1.013
43 HG21 VAL 5 3HG2 VAL 5 -25.803 3.462 -0.161
44 HG22 VAL 5 1HG2 VAL 5 -25.195 3.060 1.445
45 HG23 VAL 5 2HG2 VAL 5 -26.174 1.893 0.556
46 H LYS 6 H LYS 6 -22.013 3.901 -1.625
47 HA LYS 6 HA LYS 6 -20.347 1.833 -2.621
48 HB2 LYS 6 2HB LYS 6 -19.541 3.521 -4.212
49 HB3 LYS 6 1HB LYS 6 -21.296 3.535 -4.093
50 HG2 LYS 6 2HG LYS 6 -21.168 5.722 -3.765
51 HG3 LYS 6 1HG LYS 6 -20.449 5.377 -2.192
52 HD2 LYS 6 2HD LYS 6 -18.311 5.781 -2.926
53 HD3 LYS 6 1HD LYS 6 -18.694 5.372 -4.600
54 HE2 LYS 6 2HE LYS 6 -20.124 7.473 -4.625
55 HE3 LYS 6 1HE LYS 6 -19.337 7.900 -3.105
56 HZ1 LYS 6 3HZ LYS 6 -18.394 8.659 -5.435
57 HZ2 LYS 6 1HZ LYS 6 -17.614 7.160 -5.343
58 HZ3 LYS 6 2HZ LYS 6 -17.375 8.312 -4.128
59 H ALA 7 H ALA 7 -19.823 4.559 -0.499
60 HA ALA 7 HA ALA 7 -17.000 4.588 -0.586
61 HB1 ALA 7 3HB ALA 7 -19.097 5.773 1.102
62 HB2 ALA 7 1HB ALA 7 -17.645 6.501 0.411
63 HB3 ALA 7 2HB ALA 7 -17.534 5.543 1.888
64 H ILE 8 H ILE 8 -19.311 2.976 1.572
65 HA ILE 8 HA ILE 8 -17.366 1.783 3.244
66 HB ILE 8 HB ILE 8 -20.107 0.652 2.735
67 HG12 ILE 8 2HG1 ILE 8 -19.958 2.451 5.004
68 HG13 ILE 8 1HG1 ILE 8 -19.586 3.294 3.505
69 HG21 ILE 8 1HG2 ILE 8 -18.344 0.690 5.178
70 HG22 ILE 8 2HG2 ILE 8 -18.609 -0.687 4.107
71 HG23 ILE 8 3HG2 ILE 8 -19.942 -0.048 5.069
72 HD11 ILE 8 3HD1 ILE 8 -21.739 3.414 3.046
73 HD12 ILE 8 1HD1 ILE 8 -22.109 2.553 4.539
74 HD13 ILE 8 2HD1 ILE 8 -21.845 1.654 3.045
75 H LYS 9 H LYS 9 -19.186 0.602 0.454
76 HA LYS 9 HA LYS 9 -18.262 -2.025 0.426
77 HB2 LYS 9 2HB LYS 9 -19.732 -0.300 -1.322
78 HB3 LYS 9 1HB LYS 9 -18.537 -1.176 -2.267
79 HG2 LYS 9 2HG LYS 9 -19.403 -3.281 -1.161
80 HG3 LYS 9 1HG LYS 9 -20.744 -2.298 -0.569
81 HD2 LYS 9 2HD LYS 9 -21.095 -1.616 -3.002
82 HD3 LYS 9 1HD LYS 9 -20.006 -2.943 -3.412
83 HE2 LYS 9 2HE LYS 9 -21.536 -4.526 -2.914
84 HE3 LYS 9 1HE LYS 9 -22.177 -3.619 -1.543
85 HZ1 LYS 9 3HZ LYS 9 -23.745 -3.890 -3.435
86 HZ2 LYS 9 1HZ LYS 9 -22.728 -2.918 -4.374
87 HZ3 LYS 9 2HZ LYS 9 -23.472 -2.280 -2.996
88 H GLN 10 H GLN 10 -16.782 0.921 -0.769
89 HA GLN 10 HA GLN 10 -14.707 -0.305 -2.257
90 HB2 GLN 10 2HB GLN 10 -15.591 2.261 -1.936
91 HB3 GLN 10 1HB GLN 10 -14.089 2.294 -1.023
92 HG2 GLN 10 2HG GLN 10 -13.486 0.969 -3.408
93 HG3 GLN 10 1HG GLN 10 -14.507 2.332 -3.863
94 HE21 GLN 10 1HE2 GLN 10 -12.604 3.140 -4.932
95 HE22 GLN 10 2HE2 GLN 10 -11.408 3.995 -4.025
96 H ALA 11 H ALA 11 -15.080 0.552 1.118
97 HA ALA 11 HA ALA 11 -12.396 0.332 1.913
98 HB1 ALA 11 3HB ALA 11 -14.665 1.067 3.166
99 HB2 ALA 11 1HB ALA 11 -13.167 0.670 4.009
100 HB3 ALA 11 2HB ALA 11 -14.439 -0.543 3.850
101 H GLY 12 H GLY 12 -14.968 -2.058 1.618
102 HA2 GLY 12 2HA GLY 12 -13.525 -4.215 2.774
103 HA3 GLY 12 1HA GLY 12 -14.942 -4.356 1.743
104 H LYS 13 H LYS 13 -13.639 -2.849 -0.434
105 HA LYS 13 HA LYS 13 -12.464 -5.061 -1.782
106 HB2 LYS 13 2HB LYS 13 -13.227 -2.301 -2.427
107 HB3 LYS 13 1HB LYS 13 -11.820 -2.875 -3.314
108 HG2 LYS 13 2HG LYS 13 -13.630 -3.394 -4.686
109 HG3 LYS 13 1HG LYS 13 -13.237 -4.919 -3.890
110 HD2 LYS 13 2HD LYS 13 -15.097 -4.812 -2.495
111 HD3 LYS 13 1HD LYS 13 -15.289 -3.072 -2.726
112 HE2 LYS 13 2HE LYS 13 -16.468 -3.321 -4.634
113 HE3 LYS 13 1HE LYS 13 -15.516 -4.708 -5.163
114 HZ1 LYS 13 3HZ LYS 13 -17.663 -5.514 -4.723
115 HZ2 LYS 13 1HZ LYS 13 -17.782 -4.677 -3.256
116 HZ3 LYS 13 2HZ LYS 13 -16.735 -5.998 -3.394
117 H VAL 14 H VAL 14 -11.198 -2.148 -0.252
118 HA VAL 14 HA VAL 14 -8.556 -2.299 -1.121
119 HB VAL 14 HB VAL 14 -9.357 -1.360 1.627
120 HG11 VAL 14 1HG1 VAL 14 -7.301 -0.299 -0.292
121 HG12 VAL 14 2HG1 VAL 14 -6.953 -1.469 0.981
122 HG13 VAL 14 3HG1 VAL 14 -7.522 0.148 1.398
123 HG21 VAL 14 3HG2 VAL 14 -10.070 -0.243 -1.017
124 HG22 VAL 14 1HG2 VAL 14 -9.489 0.900 0.192
125 HG23 VAL 14 2HG2 VAL 14 -10.897 -0.104 0.534
126 H ILE 15 H ILE 15 -10.278 -4.105 1.306
127 HA ILE 15 HA ILE 15 -8.129 -5.064 2.825
128 HB ILE 15 HB ILE 15 -10.685 -6.544 2.186
129 HG12 ILE 15 2HG1 ILE 15 -10.082 -4.609 4.435
130 HG13 ILE 15 1HG1 ILE 15 -11.122 -4.276 3.055
131 HG21 ILE 15 1HG2 ILE 15 -8.486 -7.485 3.487
132 HG22 ILE 15 2HG2 ILE 15 -10.133 -8.061 3.743
133 HG23 ILE 15 3HG2 ILE 15 -9.444 -6.848 4.822
134 HD11 ILE 15 3HD1 ILE 15 -12.602 -4.798 4.757
135 HD12 ILE 15 1HD1 ILE 15 -11.593 -6.114 5.364
136 HD13 ILE 15 2HD1 ILE 15 -12.475 -6.305 3.849
137 H GLY 16 H GLY 16 -9.604 -6.278 -0.158
138 HA2 GLY 16 2HA GLY 16 -7.972 -8.625 -0.287
139 HA3 GLY 16 1HA GLY 16 -8.962 -7.976 -1.584
140 H LYS 17 H LYS 17 -7.951 -5.588 -2.159
141 HA LYS 17 HA LYS 17 -5.636 -6.153 -3.627
142 HB2 LYS 17 2HB LYS 17 -7.425 -4.217 -3.814
143 HB3 LYS 17 1HB LYS 17 -6.262 -3.341 -2.829
144 HG2 LYS 17 2HG LYS 17 -4.958 -2.951 -4.576
145 HG3 LYS 17 1HG LYS 17 -4.949 -4.655 -5.029
146 HD2 LYS 17 2HD LYS 17 -7.330 -2.939 -5.620
147 HD3 LYS 17 1HD LYS 17 -5.922 -2.913 -6.682
148 HE2 LYS 17 2HE LYS 17 -6.407 -5.610 -6.257
149 HE3 LYS 17 1HE LYS 17 -8.015 -4.904 -6.417
150 HZ1 LYS 17 3HZ LYS 17 -6.771 -5.676 -8.517
151 HZ2 LYS 17 1HZ LYS 17 -5.904 -4.233 -8.359
152 HZ3 LYS 17 2HZ LYS 17 -7.584 -4.193 -8.554
153 H GLY 18 H GLY 18 -6.097 -4.775 -0.437
154 HA2 GLY 18 2HA GLY 18 -3.388 -3.938 -0.082
155 HA3 GLY 18 1HA GLY 18 -4.595 -4.124 1.186
156 H LEU 19 H LEU 19 -5.176 -6.888 0.611
157 HA LEU 19 HA LEU 19 -3.130 -8.097 2.178
158 HG LEU 19 HG LEU 19 -5.173 -8.473 3.536
159 HB2 LEU 19 2HB LEU 19 -5.730 -8.863 1.068
160 HB3 LEU 19 1HB LEU 19 -4.581 -10.186 1.134
161 HD11 LEU 19 1HD1 LEU 19 -6.683 -10.807 2.436
162 HD12 LEU 19 2HD1 LEU 19 -7.292 -9.307 3.136
163 HD13 LEU 19 3HD1 LEU 19 -6.589 -10.544 4.176
164 HD21 LEU 19 3HD2 LEU 19 -3.627 -10.923 2.959
165 HD22 LEU 19 1HD2 LEU 19 -4.539 -10.902 4.469
166 HD23 LEU 19 2HD2 LEU 19 -3.339 -9.649 4.145
167 H ARG 20 H ARG 20 -3.966 -8.112 -1.241
168 HA ARG 20 HA ARG 20 -2.076 -10.123 -1.972
169 HE ARG 20 HE ARG 20 -3.646 -12.947 -5.512
170 HB2 ARG 20 2HB ARG 20 -4.196 -9.029 -3.233
171 HB3 ARG 20 1HB ARG 20 -2.898 -8.116 -3.992
172 HG2 ARG 20 2HG ARG 20 -2.980 -9.858 -5.431
173 HG3 ARG 20 1HG ARG 20 -1.868 -10.551 -4.251
174 HD2 ARG 20 2HD ARG 20 -3.423 -12.007 -3.436
175 HD3 ARG 20 1HD ARG 20 -4.774 -10.935 -3.796
176 HH11 ARG 20 1HH1 ARG 20 -5.479 -9.978 -5.401
177 HH12 ARG 20 2HH1 ARG 20 -6.250 -10.250 -6.926
178 HH21 ARG 20 1HH2 ARG 20 -4.659 -13.306 -7.521
179 HH22 ARG 20 2HH2 ARG 20 -5.785 -12.140 -8.130
180 H ALA 21 H ALA 21 -1.957 -6.674 -1.532
181 HA ALA 21 HA ALA 21 0.497 -6.269 -2.944
182 HB1 ALA 21 3HB ALA 21 -0.285 -4.350 -0.839
183 HB2 ALA 21 1HB ALA 21 -1.435 -4.591 -2.153
184 HB3 ALA 21 2HB ALA 21 0.211 -4.066 -2.507
185 H ILE 22 H ILE 22 -0.405 -6.757 0.431
186 HA ILE 22 HA ILE 22 2.193 -6.348 1.498
187 HB ILE 22 HB ILE 22 -0.057 -7.977 2.687
188 HG12 ILE 22 2HG1 ILE 22 0.507 -5.193 3.564
189 HG13 ILE 22 1HG1 ILE 22 -0.299 -5.394 2.011
190 HG21 ILE 22 1HG2 ILE 22 1.723 -6.545 4.493
191 HG22 ILE 22 2HG2 ILE 22 2.551 -7.770 3.532
192 HG23 ILE 22 3HG2 ILE 22 1.173 -8.219 4.536
193 HD11 ILE 22 3HD1 ILE 22 -1.949 -5.090 3.710
194 HD12 ILE 22 1HD1 ILE 22 -1.248 -6.379 4.688
195 HD13 ILE 22 2HD1 ILE 22 -2.024 -6.760 3.151
196 H ASN 23 H ASN 23 0.544 -9.095 0.113
197 HA ASN 23 HA ASN 23 2.285 -11.111 1.076
198 HB2 ASN 23 2HB ASN 23 -0.082 -11.112 -0.284
199 HB3 ASN 23 1HB ASN 23 1.043 -11.567 -1.561
200 HD21 ASN 23 1HD2 ASN 23 -1.071 -13.061 -0.087
201 HD22 ASN 23 2HD2 ASN 23 -0.282 -14.480 0.503
202 H ILE 24 H ILE 24 2.314 -9.021 -1.752
203 HA ILE 24 HA ILE 24 4.718 -10.317 -2.782
204 HB ILE 24 HB ILE 24 3.259 -7.950 -3.953
205 HG12 ILE 24 2HG1 ILE 24 2.912 -10.888 -4.593
206 HG13 ILE 24 1HG1 ILE 24 1.746 -9.889 -3.731
207 HG21 ILE 24 1HG2 ILE 24 5.169 -7.939 -5.150
208 HG22 ILE 24 2HG2 ILE 24 4.378 -9.247 -6.029
209 HG23 ILE 24 3HG2 ILE 24 5.548 -9.618 -4.762
210 HD11 ILE 24 3HD1 ILE 24 1.715 -10.374 -6.397
211 HD12 ILE 24 1HD1 ILE 24 2.554 -8.824 -6.332
212 HD13 ILE 24 2HD1 ILE 24 0.950 -8.991 -5.614
213 H ALA 25 H ALA 25 3.713 -7.448 -1.098
214 HA ALA 25 HA ALA 25 5.855 -5.743 -1.612
215 HB1 ALA 25 3HB ALA 25 4.094 -6.041 0.807
216 HB2 ALA 25 1HB ALA 25 3.961 -4.864 -0.502
217 HB3 ALA 25 2HB ALA 25 5.298 -4.762 0.646
218 H GLY 26 H GLY 26 5.569 -8.443 0.620
219 HA2 GLY 26 2HA GLY 26 7.823 -7.973 2.207
220 HA3 GLY 26 1HA GLY 26 7.139 -9.558 1.871
221 H THR 27 H THR 27 7.582 -9.155 -1.058
222 HA THR 27 HA THR 27 10.274 -10.194 -1.108
223 HB THR 27 HB THR 27 8.515 -9.612 -3.489
224 HG1 THR 27 1HG THR 27 7.738 -11.735 -3.217
225 HG21 THR 27 3HG2 THR 27 9.653 -11.526 -4.486
226 HG22 THR 27 1HG2 THR 27 10.658 -11.678 -3.044
227 HG23 THR 27 2HG2 THR 27 10.783 -10.240 -4.060
228 H THR 28 H THR 28 8.611 -7.511 -2.777
229 HA THR 28 HA THR 28 10.879 -6.363 -3.920
230 HB THR 28 HB THR 28 8.659 -5.709 -4.622
231 HG1 THR 28 1HG THR 28 8.945 -3.452 -4.590
232 HG21 THR 28 3HG2 THR 28 7.751 -5.792 -2.191
233 HG22 THR 28 1HG2 THR 28 7.055 -4.672 -3.361
234 HG23 THR 28 2HG2 THR 28 8.215 -4.091 -2.165
235 H HIS 29 H HIS 29 9.505 -5.998 -0.708
236 HA HIS 29 HA HIS 29 11.017 -3.772 0.118
237 HD1 HIS 29 1HD HIS 29 11.699 -2.749 1.694
238 HD2 HIS 29 2HD HIS 29 8.857 -4.376 4.249
239 HE1 HIS 29 1HE HIS 29 11.665 -1.244 3.706
240 HE2 HIS 29 2HE HIS 29 9.875 -2.198 5.202
241 HB2 HIS 29 2HB HIS 29 8.978 -4.948 1.247
242 HB3 HIS 29 1HB HIS 29 10.204 -5.947 2.022
243 H ASP 30 H ASP 30 11.737 -7.185 -0.061
244 HA ASP 30 HA ASP 30 14.075 -7.116 1.566
245 HB2 ASP 30 2HB ASP 30 12.527 -9.092 0.355
246 HB3 ASP 30 1HB ASP 30 14.079 -9.200 -0.465
247 H VAL 31 H VAL 31 13.621 -7.322 -1.963
248 HA VAL 31 HA VAL 31 16.266 -7.163 -2.735
249 HB VAL 31 HB VAL 31 14.032 -5.841 -4.262
250 HG11 VAL 31 1HG1 VAL 31 16.710 -6.964 -4.900
251 HG12 VAL 31 2HG1 VAL 31 15.955 -5.468 -5.446
252 HG13 VAL 31 3HG1 VAL 31 15.445 -7.014 -6.125
253 HG21 VAL 31 3HG2 VAL 31 14.451 -8.700 -3.628
254 HG22 VAL 31 1HG2 VAL 31 14.055 -8.312 -5.300
255 HG23 VAL 31 2HG2 VAL 31 12.965 -7.826 -4.000
256 H VAL 32 H VAL 32 14.007 -4.564 -1.976
257 HA VAL 32 HA VAL 32 15.698 -2.433 -2.771
258 HB VAL 32 HB VAL 32 13.484 -2.351 -0.716
259 HG11 VAL 32 1HG1 VAL 32 14.620 -0.160 -2.449
260 HG12 VAL 32 2HG1 VAL 32 14.985 -0.393 -0.740
261 HG13 VAL 32 3HG1 VAL 32 13.342 0.004 -1.243
262 HG21 VAL 32 3HG2 VAL 32 12.966 -1.436 -3.464
263 HG22 VAL 32 1HG2 VAL 32 11.926 -2.316 -2.345
264 HG23 VAL 32 2HG2 VAL 32 13.157 -3.179 -3.267
265 H SER 33 H SER 33 15.315 -4.241 0.208
266 HA SER 33 HA SER 33 16.803 -2.487 1.870
267 HG SER 33 HG SER 33 16.963 -4.700 4.370
268 HB2 SER 33 2HB SER 33 15.213 -4.531 2.444
269 HB3 SER 33 1HB SER 33 16.733 -5.426 2.418
270 H PHE 34 H PHE 34 17.654 -5.206 -0.185
271 HA PHE 34 HA PHE 34 20.295 -5.576 0.689
272 HD1 PHE 34 2HD PHE 34 22.054 -7.276 -0.306
273 HD2 PHE 34 1HD PHE 34 17.995 -8.461 -0.785
274 HE1 PHE 34 2HE PHE 34 22.585 -9.478 0.654
275 HE2 PHE 34 1HE PHE 34 18.521 -10.663 0.177
276 HZ PHE 34 HZ PHE 34 20.818 -11.176 0.894
277 HB2 PHE 34 2HB PHE 34 18.658 -6.416 -1.581
278 HB3 PHE 34 1HB PHE 34 20.350 -6.194 -2.011
279 H PHE 35 H PHE 35 18.848 -3.281 -1.511
280 HA PHE 35 HA PHE 35 21.402 -2.287 -2.443
281 HD1 PHE 35 2HD PHE 35 21.918 -0.277 -3.789
282 HD2 PHE 35 1HD PHE 35 18.890 -2.647 -5.612
283 HE1 PHE 35 2HE PHE 35 23.143 -0.195 -5.922
284 HE2 PHE 35 1HE PHE 35 20.109 -2.571 -7.747
285 HZ PHE 35 HZ PHE 35 22.239 -1.342 -7.904
286 HB2 PHE 35 2HB PHE 35 18.737 -2.188 -3.376
287 HB3 PHE 35 1HB PHE 35 19.205 -0.525 -3.043
288 H ARG 36 H ARG 36 18.989 -1.489 -0.056
289 HA ARG 36 HA ARG 36 20.156 1.105 0.508
290 HE ARG 36 HE ARG 36 19.367 3.197 -0.460
291 HB2 ARG 36 2HB ARG 36 17.668 -0.239 1.079
292 HB3 ARG 36 1HB ARG 36 18.358 0.409 2.560
293 HG2 ARG 36 2HG ARG 36 16.891 2.043 1.619
294 HG3 ARG 36 1HG ARG 36 18.552 2.616 1.448
295 HD2 ARG 36 2HD ARG 36 17.770 1.058 -0.846
296 HD3 ARG 36 1HD ARG 36 16.616 2.360 -0.560
297 HH11 ARG 36 1HH1 ARG 36 16.612 2.642 -2.532
298 HH12 ARG 36 2HH1 ARG 36 17.161 3.731 -3.761
299 HH21 ARG 36 1HH2 ARG 36 20.089 4.628 -2.077
300 HH22 ARG 36 2HH2 ARG 36 19.135 4.857 -3.505
301 HA PRO 37 HA PRO 37 22.704 -0.198 3.861
302 HB2 PRO 37 2HB PRO 37 22.536 1.814 5.632
303 HB3 PRO 37 1HB PRO 37 23.276 2.027 4.041
304 HG2 PRO 37 2HG PRO 37 20.583 2.861 5.007
305 HG3 PRO 37 1HG PRO 37 21.683 3.684 3.890
306 HD2 PRO 37 2HD PRO 37 19.473 2.159 3.152
307 HD3 PRO 37 1HD PRO 37 20.825 2.595 2.088
308 H LYS 38 H LYS 38 19.710 1.139 5.235
309 HA LYS 38 HA LYS 38 18.739 -1.133 6.435
310 HB2 LYS 38 2HB LYS 38 19.407 -0.666 8.859
311 HB3 LYS 38 1HB LYS 38 20.619 -1.410 7.827
312 HG2 LYS 38 2HG LYS 38 21.471 0.978 7.437
313 HG3 LYS 38 1HG LYS 38 20.489 1.404 8.841
314 HD2 LYS 38 2HD LYS 38 21.836 -0.822 9.707
315 HD3 LYS 38 1HD LYS 38 23.036 -0.024 8.691
316 HE2 LYS 38 2HE LYS 38 21.587 1.801 10.453
317 HE3 LYS 38 1HE LYS 38 22.509 0.572 11.317
318 HZ1 LYS 38 3HZ LYS 38 24.295 1.349 9.509
319 HZ2 LYS 38 1HZ LYS 38 24.162 2.052 11.042
320 HZ3 LYS 38 2HZ LYS 38 23.444 2.797 9.703
321 H LYS 39 H LYS 39 16.736 -0.720 7.170
322 HA LYS 39 HA LYS 39 15.957 2.093 7.418
323 HB2 LYS 39 2HB LYS 39 14.690 -0.298 6.382
324 HB3 LYS 39 1HB LYS 39 13.657 0.503 7.557
325 HG2 LYS 39 2HG LYS 39 13.927 2.613 6.283
326 HG3 LYS 39 1HG LYS 39 14.836 1.715 5.067
327 HD2 LYS 39 2HD LYS 39 12.454 0.276 5.515
328 HD3 LYS 39 1HD LYS 39 11.997 1.975 5.384
329 HE2 LYS 39 2HE LYS 39 11.924 1.136 3.187
330 HE3 LYS 39 1HE LYS 39 13.430 2.046 3.291
331 HZ1 LYS 39 3HZ LYS 39 13.276 -0.421 2.324
332 HZ2 LYS 39 1HZ LYS 39 13.600 -0.780 3.946
333 HZ3 LYS 39 2HZ LYS 39 14.666 0.193 3.067
334 H LYS 40 H LYS 40 14.987 2.929 9.224
335 HA LYS 40 HA LYS 40 15.146 1.259 11.633
336 HB2 LYS 40 2HB LYS 40 15.981 3.919 11.059
337 HB3 LYS 40 1HB LYS 40 14.710 4.008 12.270
338 HG2 LYS 40 2HG LYS 40 16.477 3.765 13.655
339 HG3 LYS 40 1HG LYS 40 16.152 2.058 13.357
340 HD2 LYS 40 2HD LYS 40 17.783 2.465 11.319
341 HD3 LYS 40 1HD LYS 40 18.355 3.783 12.343
342 HE2 LYS 40 2HE LYS 40 18.475 1.994 14.195
343 HE3 LYS 40 1HE LYS 40 18.388 0.833 12.871
344 HZ1 LYS 40 3HZ LYS 40 20.465 1.316 12.196
345 HZ2 LYS 40 1HZ LYS 40 20.667 1.839 13.793
346 HZ3 LYS 40 2HZ LYS 40 20.341 2.962 12.569
347 H LYS 41 H LYS 41 13.017 3.303 9.751
348 HA LYS 41 HA LYS 41 10.816 2.718 11.613
349 HB2 LYS 41 2HB LYS 41 11.378 4.969 9.737
350 HB3 LYS 41 1HB LYS 41 9.700 4.543 10.039
351 HG2 LYS 41 2HG LYS 41 9.734 5.336 12.148
352 HG3 LYS 41 1HG LYS 41 11.401 4.834 12.428
353 HD2 LYS 41 2HD LYS 41 12.232 6.820 11.791
354 HD3 LYS 41 1HD LYS 41 11.112 6.960 10.435
355 HE2 LYS 41 2HE LYS 41 10.169 7.327 13.255
356 HE3 LYS 41 1HE LYS 41 10.939 8.651 12.381
357 HZ1 LYS 41 3HZ LYS 41 8.828 7.279 10.945
358 HZ2 LYS 41 1HZ LYS 41 9.155 8.934 11.071
359 HZ3 LYS 41 2HZ LYS 41 8.322 8.140 12.310
360 H HIS 42 H HIS 42 9.123 1.509 10.985
361 HA HIS 42 HA HIS 42 9.209 0.381 8.283
362 HD1 HIS 42 1HD HIS 42 7.856 -3.460 9.303
363 HD2 HIS 42 2HD HIS 42 11.223 -1.026 9.369
364 HE1 HIS 42 1HE HIS 42 9.779 -4.957 8.685
365 HE2 HIS 42 2HE HIS 42 11.818 -3.482 8.815
366 HB2 HIS 42 2HB HIS 42 8.366 -0.602 10.925
367 HB3 HIS 42 1HB HIS 42 7.283 -1.044 9.608
Start of MODEL 5
1 H1 GLY 1 1H GLY 1 -27.156 1.366 13.662
2 H2 GLY 1 2H GLY 1 -25.819 0.761 12.820
3 H3 GLY 1 3H GLY 1 -27.204 1.236 11.975
4 HA2 GLY 1 1HA GLY 1 -26.817 3.539 12.936
5 HA3 GLY 1 2HA GLY 1 -25.218 2.939 13.352
6 H LYS 2 H LYS 2 -25.176 1.208 10.931
7 HA LYS 2 HA LYS 2 -24.447 3.319 9.028
8 HB2 LYS 2 2HB LYS 2 -23.649 0.427 8.809
9 HB3 LYS 2 1HB LYS 2 -22.881 1.832 8.082
10 HG2 LYS 2 2HG LYS 2 -21.413 1.361 9.769
11 HG3 LYS 2 1HG LYS 2 -22.471 2.525 10.570
12 HD2 LYS 2 2HD LYS 2 -22.996 1.014 12.116
13 HD3 LYS 2 1HD LYS 2 -23.585 -0.086 10.869
14 HE2 LYS 2 2HE LYS 2 -20.652 0.093 11.200
15 HE3 LYS 2 1HE LYS 2 -21.548 -0.676 12.510
16 HZ1 LYS 2 3HZ LYS 2 -22.643 -1.861 10.395
17 HZ2 LYS 2 1HZ LYS 2 -21.303 -2.482 11.220
18 HZ3 LYS 2 2HZ LYS 2 -21.084 -1.592 9.798
19 H ILE 3 H ILE 3 -25.961 3.734 7.560
20 HA ILE 3 HA ILE 3 -27.859 1.694 6.773
21 HB ILE 3 HB ILE 3 -27.978 4.210 5.277
22 HG12 ILE 3 2HG1 ILE 3 -28.249 4.249 8.293
23 HG13 ILE 3 1HG1 ILE 3 -27.137 5.204 7.318
24 HG21 ILE 3 1HG2 ILE 3 -29.915 2.665 6.983
25 HG22 ILE 3 2HG2 ILE 3 -29.760 2.602 5.229
26 HG23 ILE 3 3HG2 ILE 3 -30.335 4.074 6.010
27 HD11 ILE 3 3HD1 ILE 3 -28.937 6.487 6.414
28 HD12 ILE 3 1HD1 ILE 3 -29.083 6.470 8.171
29 HD13 ILE 3 2HD1 ILE 3 -30.131 5.446 7.189
30 HA PRO 4 HA PRO 4 -25.751 2.620 2.498
31 HB2 PRO 4 2HB PRO 4 -23.191 3.864 3.237
32 HB3 PRO 4 1HB PRO 4 -24.377 4.372 2.034
33 HG2 PRO 4 2HG PRO 4 -24.003 5.732 4.323
34 HG3 PRO 4 1HG PRO 4 -25.597 5.597 3.558
35 HD2 PRO 4 2HD PRO 4 -24.480 4.092 5.899
36 HD3 PRO 4 1HD PRO 4 -26.102 4.777 5.672
37 H VAL 5 H VAL 5 -25.668 0.322 3.581
38 HA VAL 5 HA VAL 5 -23.325 -0.816 4.502
39 HB VAL 5 HB VAL 5 -25.266 -2.271 2.719
40 HG11 VAL 5 1HG1 VAL 5 -24.101 -3.415 5.184
41 HG12 VAL 5 2HG1 VAL 5 -23.025 -3.187 3.806
42 HG13 VAL 5 3HG1 VAL 5 -24.470 -4.185 3.642
43 HG21 VAL 5 3HG2 VAL 5 -26.851 -1.472 4.126
44 HG22 VAL 5 1HG2 VAL 5 -25.688 -1.098 5.398
45 HG23 VAL 5 2HG2 VAL 5 -26.245 -2.757 5.173
46 H LYS 6 H LYS 6 -24.340 -0.121 1.221
47 HA LYS 6 HA LYS 6 -22.405 -1.660 -0.127
48 HB2 LYS 6 2HB LYS 6 -22.852 -0.137 -2.048
49 HB3 LYS 6 1HB LYS 6 -24.310 -0.807 -1.329
50 HG2 LYS 6 2HG LYS 6 -25.028 1.313 -1.419
51 HG3 LYS 6 1HG LYS 6 -24.090 1.494 0.066
52 HD2 LYS 6 2HD LYS 6 -23.106 3.187 -1.046
53 HD3 LYS 6 1HD LYS 6 -22.172 1.897 -1.808
54 HE2 LYS 6 2HE LYS 6 -24.530 2.039 -3.284
55 HE3 LYS 6 1HE LYS 6 -24.097 3.719 -2.967
56 HZ1 LYS 6 3HZ LYS 6 -21.934 1.976 -3.827
57 HZ2 LYS 6 1HZ LYS 6 -22.267 3.582 -4.249
58 HZ3 LYS 6 2HZ LYS 6 -23.113 2.318 -4.991
59 H ALA 7 H ALA 7 -22.324 1.537 1.297
60 HA ALA 7 HA ALA 7 -19.949 2.471 0.121
61 HB1 ALA 7 3HB ALA 7 -20.733 3.182 2.922
62 HB2 ALA 7 1HB ALA 7 -21.700 3.725 1.550
63 HB3 ALA 7 2HB ALA 7 -20.005 4.197 1.677
64 H ILE 8 H ILE 8 -20.495 0.815 3.227
65 HA ILE 8 HA ILE 8 -17.801 0.694 4.006
66 HB ILE 8 HB ILE 8 -19.872 -1.368 4.723
67 HG12 ILE 8 2HG1 ILE 8 -19.644 0.772 6.646
68 HG13 ILE 8 1HG1 ILE 8 -20.119 1.414 5.078
69 HG21 ILE 8 1HG2 ILE 8 -17.481 -1.696 5.390
70 HG22 ILE 8 2HG2 ILE 8 -18.628 -1.645 6.730
71 HG23 ILE 8 3HG2 ILE 8 -17.625 -0.238 6.373
72 HD11 ILE 8 3HD1 ILE 8 -21.713 0.107 7.010
73 HD12 ILE 8 1HD1 ILE 8 -21.655 -0.914 5.573
74 HD13 ILE 8 2HD1 ILE 8 -22.192 0.760 5.444
75 H LYS 9 H LYS 9 -19.831 -1.613 2.258
76 HA LYS 9 HA LYS 9 -17.973 -3.691 2.046
77 HB2 LYS 9 2HB LYS 9 -20.292 -2.873 0.305
78 HB3 LYS 9 1HB LYS 9 -19.321 -4.297 -0.044
79 HG2 LYS 9 2HG LYS 9 -19.946 -4.635 2.605
80 HG3 LYS 9 1HG LYS 9 -21.406 -3.890 1.950
81 HD2 LYS 9 2HD LYS 9 -21.976 -5.951 1.294
82 HD3 LYS 9 1HD LYS 9 -20.752 -5.759 0.037
83 HE2 LYS 9 2HE LYS 9 -19.812 -6.659 2.696
84 HE3 LYS 9 1HE LYS 9 -20.773 -7.805 1.765
85 HZ1 LYS 9 3HZ LYS 9 -19.073 -6.962 -0.098
86 HZ2 LYS 9 1HZ LYS 9 -18.776 -8.303 0.891
87 HZ3 LYS 9 2HZ LYS 9 -18.094 -6.803 1.273
88 H GLN 10 H GLN 10 -18.446 -0.807 0.097
89 HA GLN 10 HA GLN 10 -16.617 -1.570 -1.961
90 HB2 GLN 10 2HB GLN 10 -18.524 0.199 -2.020
91 HB3 GLN 10 1HB GLN 10 -17.323 1.279 -1.328
92 HG2 GLN 10 2HG GLN 10 -15.868 0.404 -3.338
93 HG3 GLN 10 1HG GLN 10 -17.453 0.070 -4.035
94 HE21 GLN 10 1HE2 GLN 10 -16.000 1.796 -5.377
95 HE22 GLN 10 2HE2 GLN 10 -16.537 3.421 -5.143
96 H ALA 11 H ALA 11 -16.384 0.185 1.062
97 HA ALA 11 HA ALA 11 -13.766 1.217 0.635
98 HB1 ALA 11 3HB ALA 11 -14.999 0.694 3.325
99 HB2 ALA 11 1HB ALA 11 -15.499 2.043 2.304
100 HB3 ALA 11 2HB ALA 11 -13.832 1.938 2.873
101 H GLY 12 H GLY 12 -15.052 -1.755 1.986
102 HA2 GLY 12 2HA GLY 12 -12.612 -2.669 3.133
103 HA3 GLY 12 1HA GLY 12 -14.020 -3.658 2.772
104 H LYS 13 H LYS 13 -13.991 -2.843 -0.068
105 HA LYS 13 HA LYS 13 -12.292 -4.917 -1.033
106 HB2 LYS 13 2HB LYS 13 -14.478 -3.400 -2.015
107 HB3 LYS 13 1HB LYS 13 -13.154 -3.187 -3.151
108 HG2 LYS 13 2HG LYS 13 -14.543 -5.049 -3.812
109 HG3 LYS 13 1HG LYS 13 -12.940 -5.621 -3.342
110 HD2 LYS 13 2HD LYS 13 -13.713 -6.639 -1.439
111 HD3 LYS 13 1HD LYS 13 -15.081 -5.536 -1.274
112 HE2 LYS 13 2HE LYS 13 -16.349 -6.679 -2.853
113 HE3 LYS 13 1HE LYS 13 -14.937 -7.455 -3.569
114 HZ1 LYS 13 3HZ LYS 13 -14.863 -9.035 -1.938
115 HZ2 LYS 13 1HZ LYS 13 -16.534 -8.774 -2.009
116 HZ3 LYS 13 2HZ LYS 13 -15.620 -8.059 -0.779
117 H VAL 14 H VAL 14 -12.158 -1.385 -1.072
118 HA VAL 14 HA VAL 14 -9.972 -1.043 -2.757
119 HB VAL 14 HB VAL 14 -10.496 0.693 -0.352
120 HG11 VAL 14 1HG1 VAL 14 -8.516 1.211 -1.642
121 HG12 VAL 14 2HG1 VAL 14 -9.734 2.465 -1.868
122 HG13 VAL 14 3HG1 VAL 14 -9.471 1.258 -3.124
123 HG21 VAL 14 3HG2 VAL 14 -12.620 0.842 -1.096
124 HG22 VAL 14 1HG2 VAL 14 -12.217 0.196 -2.686
125 HG23 VAL 14 2HG2 VAL 14 -11.914 1.895 -2.325
126 H ILE 15 H ILE 15 -10.152 -1.993 0.596
127 HA ILE 15 HA ILE 15 -7.468 -1.484 1.314
128 HB ILE 15 HB ILE 15 -9.283 -3.619 2.444
129 HG12 ILE 15 2HG1 ILE 15 -8.893 -0.858 3.579
130 HG13 ILE 15 1HG1 ILE 15 -10.144 -1.183 2.385
131 HG21 ILE 15 1HG2 ILE 15 -7.779 -2.783 4.508
132 HG22 ILE 15 2HG2 ILE 15 -6.637 -2.549 3.184
133 HG23 ILE 15 3HG2 ILE 15 -7.340 -4.140 3.471
134 HD11 ILE 15 3HD1 ILE 15 -10.689 -3.138 4.119
135 HD12 ILE 15 1HD1 ILE 15 -11.374 -1.518 4.241
136 HD13 ILE 15 2HD1 ILE 15 -9.977 -1.960 5.223
137 H GLY 16 H GLY 16 -9.080 -4.287 -0.112
138 HA2 GLY 16 2HA GLY 16 -6.954 -6.109 0.069
139 HA3 GLY 16 1HA GLY 16 -8.240 -6.171 -1.124
140 H LYS 17 H LYS 17 -7.677 -3.639 -2.343
141 HA LYS 17 HA LYS 17 -5.855 -4.413 -4.307
142 HB2 LYS 17 2HB LYS 17 -7.606 -2.648 -4.556
143 HB3 LYS 17 1HB LYS 17 -6.610 -1.578 -3.577
144 HG2 LYS 17 2HG LYS 17 -4.984 -1.378 -5.225
145 HG3 LYS 17 1HG LYS 17 -5.526 -2.830 -6.069
146 HD2 LYS 17 2HD LYS 17 -7.109 -1.720 -7.223
147 HD3 LYS 17 1HD LYS 17 -7.551 -0.717 -5.841
148 HE2 LYS 17 2HE LYS 17 -5.276 0.445 -6.273
149 HE3 LYS 17 1HE LYS 17 -5.385 -0.301 -7.866
150 HZ1 LYS 17 3HZ LYS 17 -7.574 1.346 -6.746
151 HZ2 LYS 17 1HZ LYS 17 -7.331 0.883 -8.355
152 HZ3 LYS 17 2HZ LYS 17 -6.308 2.021 -7.638
153 H GLY 18 H GLY 18 -5.416 -2.498 -1.387
154 HA2 GLY 18 2HA GLY 18 -2.750 -1.685 -1.922
155 HA3 GLY 18 1HA GLY 18 -3.520 -1.715 -0.343
156 H LEU 19 H LEU 19 -4.143 -4.489 -0.298
157 HA LEU 19 HA LEU 19 -1.740 -5.525 0.749
158 HG LEU 19 HG LEU 19 -3.956 -5.662 2.429
159 HB2 LEU 19 2HB LEU 19 -4.463 -6.573 0.207
160 HB3 LEU 19 1HB LEU 19 -3.185 -7.759 0.396
161 HD11 LEU 19 1HD1 LEU 19 -4.364 -8.008 3.648
162 HD12 LEU 19 2HD1 LEU 19 -4.733 -8.477 1.990
163 HD13 LEU 19 3HD1 LEU 19 -5.620 -7.156 2.750
164 HD21 LEU 19 3HD2 LEU 19 -1.786 -5.952 3.000
165 HD22 LEU 19 1HD2 LEU 19 -1.667 -7.516 2.195
166 HD23 LEU 19 2HD2 LEU 19 -2.430 -7.397 3.779
167 H ARG 20 H ARG 20 -3.384 -5.966 -2.348
168 HA ARG 20 HA ARG 20 -1.734 -8.003 -3.362
169 HE ARG 20 HE ARG 20 -6.534 -9.133 -5.733
170 HB2 ARG 20 2HB ARG 20 -3.705 -6.106 -4.443
171 HB3 ARG 20 1HB ARG 20 -2.480 -6.610 -5.599
172 HG2 ARG 20 2HG ARG 20 -3.042 -8.945 -5.200
173 HG3 ARG 20 1HG ARG 20 -4.248 -8.458 -4.009
174 HD2 ARG 20 2HD ARG 20 -5.383 -7.155 -5.820
175 HD3 ARG 20 1HD ARG 20 -4.258 -7.886 -6.967
176 HH11 ARG 20 1HH1 ARG 20 -3.442 -9.687 -7.250
177 HH12 ARG 20 2HH1 ARG 20 -3.827 -11.304 -7.733
178 HH21 ARG 20 1HH2 ARG 20 -7.045 -11.259 -6.365
179 HH22 ARG 20 2HH2 ARG 20 -5.873 -12.198 -7.231
180 H ALA 21 H ALA 21 -1.396 -4.514 -3.281
181 HA ALA 21 HA ALA 21 0.850 -4.403 -5.038
182 HB1 ALA 21 3HB ALA 21 0.685 -2.167 -4.827
183 HB2 ALA 21 1HB ALA 21 0.558 -2.240 -3.071
184 HB3 ALA 21 2HB ALA 21 -0.862 -2.542 -4.072
185 H ILE 22 H ILE 22 0.414 -4.570 -1.550
186 HA ILE 22 HA ILE 22 3.140 -4.213 -0.861
187 HB ILE 22 HB ILE 22 1.027 -5.690 0.717
188 HG12 ILE 22 2HG1 ILE 22 1.756 -2.868 1.315
189 HG13 ILE 22 1HG1 ILE 22 0.741 -3.151 -0.095
190 HG21 ILE 22 1HG2 ILE 22 3.021 -6.182 1.775
191 HG22 ILE 22 2HG2 ILE 22 2.512 -4.718 2.619
192 HG23 ILE 22 3HG2 ILE 22 3.745 -4.629 1.362
193 HD11 ILE 22 3HD1 ILE 22 0.002 -3.052 2.640
194 HD12 ILE 22 1HD1 ILE 22 -0.316 -4.678 2.035
195 HD13 ILE 22 2HD1 ILE 22 -1.023 -3.279 1.224
196 H ASN 23 H ASN 23 1.318 -6.915 -2.023
197 HA ASN 23 HA ASN 23 3.040 -8.976 -1.086
198 HB2 ASN 23 2HB ASN 23 0.577 -9.011 -2.127
199 HB3 ASN 23 1HB ASN 23 1.486 -9.365 -3.592
200 HD21 ASN 23 1HD2 ASN 23 -0.273 -10.863 -1.493
201 HD22 ASN 23 2HD2 ASN 23 0.585 -12.347 -1.285
202 H ILE 24 H ILE 24 2.793 -7.176 -4.128
203 HA ILE 24 HA ILE 24 4.965 -8.589 -5.362
204 HB ILE 24 HB ILE 24 3.801 -5.934 -6.203
205 HG12 ILE 24 2HG1 ILE 24 2.958 -8.593 -7.321
206 HG13 ILE 24 1HG1 ILE 24 2.173 -7.935 -5.889
207 HG21 ILE 24 1HG2 ILE 24 5.969 -6.641 -7.209
208 HG22 ILE 24 2HG2 ILE 24 4.659 -6.451 -8.374
209 HG23 ILE 24 3HG2 ILE 24 5.148 -8.063 -7.853
210 HD11 ILE 24 3HD1 ILE 24 0.818 -7.277 -7.660
211 HD12 ILE 24 1HD1 ILE 24 2.194 -6.853 -8.677
212 HD13 ILE 24 2HD1 ILE 24 1.775 -5.843 -7.295
213 H ALA 25 H ALA 25 4.629 -5.736 -3.402
214 HA ALA 25 HA ALA 25 7.313 -4.802 -4.004
215 HB1 ALA 25 3HB ALA 25 5.233 -3.336 -3.526
216 HB2 ALA 25 1HB ALA 25 6.787 -2.867 -2.839
217 HB3 ALA 25 2HB ALA 25 5.588 -3.677 -1.832
218 H GLY 26 H GLY 26 5.614 -6.591 -1.538
219 HA2 GLY 26 2HA GLY 26 7.435 -6.356 0.576
220 HA3 GLY 26 1HA GLY 26 6.349 -7.714 0.324
221 H THR 27 H THR 27 7.404 -8.545 -2.187
222 HA THR 27 HA THR 27 9.520 -10.200 -1.287
223 HB THR 27 HB THR 27 7.995 -10.954 -3.025
224 HG1 THR 27 1HG THR 27 9.504 -11.990 -4.100
225 HG21 THR 27 3HG2 THR 27 8.052 -10.096 -5.282
226 HG22 THR 27 1HG2 THR 27 9.213 -8.858 -4.803
227 HG23 THR 27 2HG2 THR 27 7.572 -8.828 -4.154
228 H THR 28 H THR 28 9.421 -7.381 -3.438
229 HA THR 28 HA THR 28 12.203 -7.368 -3.994
230 HB THR 28 HB THR 28 10.770 -4.780 -4.048
231 HG1 THR 28 1HG THR 28 9.092 -5.481 -5.057
232 HG21 THR 28 3HG2 THR 28 11.500 -5.043 -6.519
233 HG22 THR 28 1HG2 THR 28 12.516 -6.340 -5.893
234 HG23 THR 28 2HG2 THR 28 12.707 -4.697 -5.279
235 H HIS 29 H HIS 29 10.210 -5.948 -1.485
236 HA HIS 29 HA HIS 29 12.154 -4.196 -0.411
237 HD1 HIS 29 1HD HIS 29 12.588 -3.403 1.884
238 HD2 HIS 29 2HD HIS 29 8.618 -2.318 1.331
239 HE1 HIS 29 1HE HIS 29 12.367 -1.123 2.918
240 HE2 HIS 29 2HE HIS 29 9.976 -0.450 2.499
241 HB2 HIS 29 2HB HIS 29 9.513 -4.574 0.042
242 HB3 HIS 29 1HB HIS 29 10.185 -5.391 1.449
243 H ASP 30 H ASP 30 11.473 -7.597 0.028
244 HA ASP 30 HA ASP 30 13.008 -8.002 2.369
245 HB2 ASP 30 2HB ASP 30 11.369 -9.552 0.729
246 HB3 ASP 30 1HB ASP 30 12.957 -10.293 0.577
247 H VAL 31 H VAL 31 13.738 -8.590 -1.063
248 HA VAL 31 HA VAL 31 16.344 -9.461 -0.819
249 HB VAL 31 HB VAL 31 15.375 -7.688 -3.055
250 HG11 VAL 31 1HG1 VAL 31 17.817 -8.600 -2.731
251 HG12 VAL 31 2HG1 VAL 31 17.057 -8.568 -4.322
252 HG13 VAL 31 3HG1 VAL 31 17.113 -10.070 -3.400
253 HG21 VAL 31 3HG2 VAL 31 14.561 -10.432 -2.302
254 HG22 VAL 31 1HG2 VAL 31 14.894 -10.142 -4.009
255 HG23 VAL 31 2HG2 VAL 31 13.673 -9.183 -3.174
256 H VAL 32 H VAL 32 15.198 -6.139 -1.305
257 HA VAL 32 HA VAL 32 17.736 -4.920 -1.248
258 HB VAL 32 HB VAL 32 15.132 -3.647 -0.400
259 HG11 VAL 32 1HG1 VAL 32 16.169 -1.651 -0.488
260 HG12 VAL 32 2HG1 VAL 32 17.171 -2.114 -1.864
261 HG13 VAL 32 3HG1 VAL 32 17.624 -2.613 -0.233
262 HG21 VAL 32 3HG2 VAL 32 14.388 -3.923 -2.476
263 HG22 VAL 32 1HG2 VAL 32 15.890 -4.719 -2.948
264 HG23 VAL 32 2HG2 VAL 32 15.748 -2.966 -3.061
265 H SER 33 H SER 33 15.542 -5.929 1.272
266 HA SER 33 HA SER 33 16.706 -4.445 3.391
267 HG SER 33 HG SER 33 14.759 -5.031 5.407
268 HB2 SER 33 2HB SER 33 14.420 -5.546 3.397
269 HB3 SER 33 1HB SER 33 15.249 -7.080 3.656
270 H PHE 34 H PHE 34 17.399 -7.554 1.932
271 HA PHE 34 HA PHE 34 19.091 -8.573 3.941
272 HD1 PHE 34 1HD PHE 34 18.850 -10.709 4.358
273 HD2 PHE 34 2HD PHE 34 21.079 -10.793 0.734
274 HE1 PHE 34 1HE PHE 34 20.122 -12.644 5.190
275 HE2 PHE 34 2HE PHE 34 22.354 -12.729 1.559
276 HZ PHE 34 HZ PHE 34 21.876 -13.657 3.790
277 HB2 PHE 34 2HB PHE 34 18.073 -9.747 1.857
278 HB3 PHE 34 1HB PHE 34 19.507 -9.159 1.024
279 H PHE 35 H PHE 35 19.616 -6.331 1.313
280 HA PHE 35 HA PHE 35 22.492 -6.273 1.831
281 HD1 PHE 35 2HD PHE 35 23.092 -3.151 0.614
282 HD2 PHE 35 1HD PHE 35 23.415 -6.803 -1.547
283 HE1 PHE 35 2HE PHE 35 25.353 -2.513 -0.120
284 HE2 PHE 35 1HE PHE 35 25.677 -6.172 -2.282
285 HZ PHE 35 HZ PHE 35 26.648 -4.025 -1.570
286 HB2 PHE 35 2HB PHE 35 21.426 -6.285 -0.523
287 HB3 PHE 35 1HB PHE 35 21.051 -4.593 -0.210
288 H ARG 36 H ARG 36 19.596 -4.360 2.227
289 HA ARG 36 HA ARG 36 21.101 -2.495 3.900
290 HE ARG 36 HE ARG 36 21.768 -0.174 5.128
291 HB2 ARG 36 2HB ARG 36 20.358 -1.788 1.346
292 HB3 ARG 36 1HB ARG 36 19.027 -1.166 2.311
293 HG2 ARG 36 2HG ARG 36 21.879 -0.595 3.030
294 HG3 ARG 36 1HG ARG 36 21.007 0.381 1.847
295 HD2 ARG 36 2HD ARG 36 20.136 1.558 3.517
296 HD3 ARG 36 1HD ARG 36 19.301 0.106 4.068
297 HH11 ARG 36 1HH1 ARG 36 19.446 2.429 5.176
298 HH12 ARG 36 2HH1 ARG 36 19.950 3.018 6.724
299 HH21 ARG 36 1HH2 ARG 36 22.435 0.598 7.165
300 HH22 ARG 36 2HH2 ARG 36 21.647 1.980 7.852
301 HA PRO 37 HA PRO 37 17.329 -3.900 6.094
302 HB2 PRO 37 2HB PRO 37 18.364 -3.490 8.582
303 HB3 PRO 37 1HB PRO 37 18.632 -4.969 7.651
304 HG2 PRO 37 2HG PRO 37 20.420 -2.591 7.989
305 HG3 PRO 37 1HG PRO 37 20.835 -4.316 8.015
306 HD2 PRO 37 2HD PRO 37 21.259 -2.768 5.846
307 HD3 PRO 37 1HD PRO 37 20.821 -4.484 5.712
308 H LYS 38 H LYS 38 15.743 -2.743 7.184
309 HA LYS 38 HA LYS 38 16.221 -0.094 8.182
310 HB2 LYS 38 2HB LYS 38 14.679 1.042 6.623
311 HB3 LYS 38 1HB LYS 38 16.114 0.425 5.815
312 HG2 LYS 38 2HG LYS 38 14.679 -0.411 4.327
313 HG3 LYS 38 1HG LYS 38 14.380 -1.661 5.537
314 HD2 LYS 38 2HD LYS 38 12.251 -0.874 4.900
315 HD3 LYS 38 1HD LYS 38 12.582 -0.129 6.465
316 HE2 LYS 38 2HE LYS 38 11.691 1.582 5.103
317 HE3 LYS 38 1HE LYS 38 13.428 1.878 5.185
318 HZ1 LYS 38 3HZ LYS 38 11.833 0.847 2.929
319 HZ2 LYS 38 1HZ LYS 38 13.492 0.526 3.020
320 HZ3 LYS 38 2HZ LYS 38 12.943 2.125 2.952
321 H LYS 39 H LYS 39 14.963 0.087 9.905
322 HA LYS 39 HA LYS 39 12.735 -1.697 10.299
323 HB2 LYS 39 2HB LYS 39 12.596 -0.705 12.525
324 HB3 LYS 39 1HB LYS 39 14.250 -1.164 12.150
325 HG2 LYS 39 2HG LYS 39 14.018 1.485 11.304
326 HG3 LYS 39 1HG LYS 39 13.177 1.409 12.855
327 HD2 LYS 39 2HD LYS 39 15.423 1.910 13.375
328 HD3 LYS 39 1HD LYS 39 15.223 0.195 13.740
329 HE2 LYS 39 2HE LYS 39 17.294 0.450 12.589
330 HE3 LYS 39 1HE LYS 39 16.156 -0.311 11.476
331 HZ1 LYS 39 3HZ LYS 39 17.426 1.432 10.391
332 HZ2 LYS 39 1HZ LYS 39 16.874 2.572 11.513
333 HZ3 LYS 39 2HZ LYS 39 15.785 1.842 10.444
334 H LYS 40 H LYS 40 10.642 -1.271 10.000
335 HA LYS 40 HA LYS 40 9.900 1.443 9.166
336 HB2 LYS 40 2HB LYS 40 9.099 -1.233 8.356
337 HB3 LYS 40 1HB LYS 40 7.711 -0.217 8.718
338 HG2 LYS 40 2HG LYS 40 8.355 1.389 7.092
339 HG3 LYS 40 1HG LYS 40 9.928 0.621 6.869
340 HD2 LYS 40 2HD LYS 40 7.502 -1.026 6.393
341 HD3 LYS 40 1HD LYS 40 7.905 0.209 5.198
342 HE2 LYS 40 2HE LYS 40 9.190 -1.412 4.317
343 HE3 LYS 40 1HE LYS 40 10.328 -0.930 5.573
344 HZ1 LYS 40 3HZ LYS 40 9.598 -3.419 5.265
345 HZ2 LYS 40 1HZ LYS 40 8.312 -2.937 6.252
346 HZ3 LYS 40 2HZ LYS 40 9.902 -2.778 6.800
347 H LYS 41 H LYS 41 9.288 2.629 10.866
348 HA LYS 41 HA LYS 41 7.714 1.403 12.998
349 HB2 LYS 41 2HB LYS 41 9.749 3.203 13.099
350 HB3 LYS 41 1HB LYS 41 8.360 4.279 13.158
351 HG2 LYS 41 2HG LYS 41 7.498 3.071 15.093
352 HG3 LYS 41 1HG LYS 41 8.881 1.978 15.030
353 HD2 LYS 41 2HD LYS 41 9.731 3.434 16.538
354 HD3 LYS 41 1HD LYS 41 10.169 4.335 15.086
355 HE2 LYS 41 2HE LYS 41 9.095 6.021 16.126
356 HE3 LYS 41 1HE LYS 41 7.659 5.237 15.470
357 HZ1 LYS 41 3HZ LYS 41 7.024 4.506 17.494
358 HZ2 LYS 41 1HZ LYS 41 7.939 5.824 18.033
359 HZ3 LYS 41 2HZ LYS 41 8.603 4.268 18.047
360 H HIS 42 H HIS 42 7.553 4.277 10.894
361 HA HIS 42 HA HIS 42 4.635 4.010 10.873
362 HD1 HIS 42 1HD HIS 42 6.257 7.608 9.498
363 HD2 HIS 42 2HD HIS 42 7.379 6.850 13.426
364 HE1 HIS 42 1HE HIS 42 8.275 9.051 9.911
365 HE2 HIS 42 2HE HIS 42 8.991 8.506 12.264
366 HB2 HIS 42 2HB HIS 42 4.388 6.463 11.142
367 HB3 HIS 42 1HB HIS 42 5.083 5.692 12.565
Start of MODEL 6
1 H1 GLY 1 1H GLY 1 -35.249 1.865 -0.967
2 H2 GLY 1 2H GLY 1 -33.769 2.381 -0.333
3 H3 GLY 1 3H GLY 1 -33.856 0.943 -1.217
4 HA2 GLY 1 1HA GLY 1 -34.846 2.671 -3.000
5 HA3 GLY 1 2HA GLY 1 -33.695 3.682 -2.139
6 H LYS 2 H LYS 2 -31.567 3.493 -2.582
7 HA LYS 2 HA LYS 2 -30.823 1.817 -4.812
8 HB2 LYS 2 2HB LYS 2 -29.204 3.771 -3.169
9 HB3 LYS 2 1HB LYS 2 -28.631 2.962 -4.621
10 HG2 LYS 2 2HG LYS 2 -31.006 4.811 -4.520
11 HG3 LYS 2 1HG LYS 2 -29.378 5.284 -5.012
12 HD2 LYS 2 2HD LYS 2 -29.626 4.396 -7.051
13 HD3 LYS 2 1HD LYS 2 -30.343 2.916 -6.410
14 HE2 LYS 2 2HE LYS 2 -31.853 4.215 -7.907
15 HE3 LYS 2 1HE LYS 2 -32.505 3.936 -6.291
16 HZ1 LYS 2 3HZ LYS 2 -32.413 6.116 -5.778
17 HZ2 LYS 2 1HZ LYS 2 -32.510 6.307 -7.455
18 HZ3 LYS 2 2HZ LYS 2 -31.011 6.404 -6.679
19 H ILE 3 H ILE 3 -29.195 0.237 -4.806
20 HA ILE 3 HA ILE 3 -29.205 -1.571 -2.718
21 HB ILE 3 HB ILE 3 -26.914 -1.310 -4.651
22 HG12 ILE 3 2HG1 ILE 3 -28.826 -3.118 -5.675
23 HG13 ILE 3 1HG1 ILE 3 -29.712 -1.654 -5.257
24 HG21 ILE 3 1HG2 ILE 3 -26.371 -3.050 -3.296
25 HG22 ILE 3 2HG2 ILE 3 -27.361 -3.906 -4.477
26 HG23 ILE 3 3HG2 ILE 3 -28.052 -3.429 -2.928
27 HD11 ILE 3 3HD1 ILE 3 -29.083 -1.349 -7.475
28 HD12 ILE 3 1HD1 ILE 3 -27.466 -1.997 -7.203
29 HD13 ILE 3 2HD1 ILE 3 -27.899 -0.413 -6.562
30 HA PRO 4 HA PRO 4 -26.456 0.760 0.032
31 HB2 PRO 4 2HB PRO 4 -26.852 -0.813 2.205
32 HB3 PRO 4 1HB PRO 4 -28.004 0.430 1.701
33 HG2 PRO 4 2HG PRO 4 -28.073 -2.524 1.211
34 HG3 PRO 4 1HG PRO 4 -29.389 -1.442 1.707
35 HD2 PRO 4 2HD PRO 4 -29.079 -2.267 -0.848
36 HD3 PRO 4 1HD PRO 4 -29.730 -0.666 -0.440
37 H VAL 5 H VAL 5 -26.442 -2.654 -0.716
38 HA VAL 5 HA VAL 5 -24.178 -3.526 0.590
39 HB VAL 5 HB VAL 5 -24.875 -4.380 -2.213
40 HG11 VAL 5 1HG1 VAL 5 -23.018 -5.572 -1.668
41 HG12 VAL 5 2HG1 VAL 5 -24.242 -6.619 -0.952
42 HG13 VAL 5 3HG1 VAL 5 -23.342 -5.492 0.062
43 HG21 VAL 5 3HG2 VAL 5 -26.961 -4.686 -1.372
44 HG22 VAL 5 1HG2 VAL 5 -26.400 -4.724 0.301
45 HG23 VAL 5 2HG2 VAL 5 -26.223 -6.151 -0.721
46 H LYS 6 H LYS 6 -24.457 -1.553 -2.283
47 HA LYS 6 HA LYS 6 -21.873 -1.859 -3.308
48 HB2 LYS 6 2HB LYS 6 -24.135 -0.251 -3.848
49 HB3 LYS 6 1HB LYS 6 -22.775 0.845 -3.662
50 HG2 LYS 6 2HG LYS 6 -23.096 0.173 -5.988
51 HG3 LYS 6 1HG LYS 6 -21.535 -0.362 -5.361
52 HD2 LYS 6 2HD LYS 6 -22.244 -2.596 -5.197
53 HD3 LYS 6 1HD LYS 6 -23.948 -2.153 -5.339
54 HE2 LYS 6 2HE LYS 6 -23.348 -3.081 -7.422
55 HE3 LYS 6 1HE LYS 6 -23.405 -1.337 -7.668
56 HZ1 LYS 6 3HZ LYS 6 -20.857 -2.642 -6.981
57 HZ2 LYS 6 1HZ LYS 6 -21.125 -1.195 -7.818
58 HZ3 LYS 6 2HZ LYS 6 -21.418 -2.679 -8.577
59 H ALA 7 H ALA 7 -23.116 0.187 -0.739
60 HA ALA 7 HA ALA 7 -20.896 1.868 -0.415
61 HB1 ALA 7 3HB ALA 7 -23.280 1.884 0.691
62 HB2 ALA 7 1HB ALA 7 -21.896 2.599 1.518
63 HB3 ALA 7 2HB ALA 7 -22.455 0.991 1.969
64 H ILE 8 H ILE 8 -21.723 -1.134 1.325
65 HA ILE 8 HA ILE 8 -19.371 -1.289 2.838
66 HB ILE 8 HB ILE 8 -20.922 -3.676 1.861
67 HG12 ILE 8 2HG1 ILE 8 -21.748 -2.736 4.462
68 HG13 ILE 8 1HG1 ILE 8 -21.976 -1.469 3.261
69 HG21 ILE 8 1HG2 ILE 8 -19.371 -3.160 4.394
70 HG22 ILE 8 2HG2 ILE 8 -18.849 -4.159 3.036
71 HG23 ILE 8 3HG2 ILE 8 -20.242 -4.644 4.001
72 HD11 ILE 8 3HD1 ILE 8 -23.866 -2.451 2.677
73 HD12 ILE 8 1HD1 ILE 8 -23.536 -3.813 3.745
74 HD13 ILE 8 2HD1 ILE 8 -22.930 -3.825 2.089
75 H LYS 9 H LYS 9 -20.202 -2.651 -0.313
76 HA LYS 9 HA LYS 9 -17.922 -4.181 -0.752
77 HB2 LYS 9 2HB LYS 9 -19.899 -2.831 -2.535
78 HB3 LYS 9 1HB LYS 9 -18.444 -3.503 -3.253
79 HG2 LYS 9 2HG LYS 9 -20.440 -5.024 -1.589
80 HG3 LYS 9 1HG LYS 9 -20.311 -5.068 -3.348
81 HD2 LYS 9 2HD LYS 9 -17.779 -5.675 -2.699
82 HD3 LYS 9 1HD LYS 9 -18.611 -6.329 -1.285
83 HE2 LYS 9 2HE LYS 9 -19.276 -6.977 -4.155
84 HE3 LYS 9 1HE LYS 9 -18.323 -7.996 -3.079
85 HZ1 LYS 9 3HZ LYS 9 -21.195 -7.525 -3.131
86 HZ2 LYS 9 1HZ LYS 9 -20.491 -7.667 -1.600
87 HZ3 LYS 9 2HZ LYS 9 -20.334 -8.922 -2.723
88 H GLN 10 H GLN 10 -18.454 -0.735 -1.156
89 HA GLN 10 HA GLN 10 -15.998 -0.230 -2.519
90 HB2 GLN 10 2HB GLN 10 -17.989 1.535 -1.109
91 HB3 GLN 10 1HB GLN 10 -16.500 2.179 -1.782
92 HG2 GLN 10 2HG GLN 10 -17.544 0.701 -3.857
93 HG3 GLN 10 1HG GLN 10 -18.967 1.415 -3.102
94 HE21 GLN 10 1HE2 GLN 10 -19.540 3.131 -4.227
95 HE22 GLN 10 2HE2 GLN 10 -18.482 4.364 -4.811
96 H ALA 11 H ALA 11 -17.036 -0.198 0.838
97 HA ALA 11 HA ALA 11 -14.652 0.962 1.879
98 HB1 ALA 11 3HB ALA 11 -15.670 0.840 3.893
99 HB2 ALA 11 1HB ALA 11 -16.212 -0.818 3.637
100 HB3 ALA 11 2HB ALA 11 -17.101 0.521 2.910
101 H GLY 12 H GLY 12 -15.698 -2.301 1.159
102 HA2 GLY 12 2HA GLY 12 -13.635 -3.648 2.578
103 HA3 GLY 12 1HA GLY 12 -14.615 -4.327 1.285
104 H LYS 13 H LYS 13 -13.871 -2.301 -0.653
105 HA LYS 13 HA LYS 13 -11.574 -3.542 -1.732
106 HB2 LYS 13 2HB LYS 13 -13.557 -1.802 -2.649
107 HB3 LYS 13 1HB LYS 13 -12.062 -0.892 -2.814
108 HG2 LYS 13 2HG LYS 13 -12.446 -2.032 -4.861
109 HG3 LYS 13 1HG LYS 13 -11.104 -2.841 -4.047
110 HD2 LYS 13 2HD LYS 13 -12.239 -4.737 -4.401
111 HD3 LYS 13 1HD LYS 13 -13.304 -4.196 -3.100
112 HE2 LYS 13 2HE LYS 13 -14.796 -3.167 -4.703
113 HE3 LYS 13 1HE LYS 13 -13.703 -3.574 -6.025
114 HZ1 LYS 13 3HZ LYS 13 -14.680 -5.751 -4.332
115 HZ2 LYS 13 1HZ LYS 13 -14.314 -5.750 -5.985
116 HZ3 LYS 13 2HZ LYS 13 -15.762 -5.068 -5.439
117 H VAL 14 H VAL 14 -12.070 -0.520 0.027
118 HA VAL 14 HA VAL 14 -9.546 0.606 -0.310
119 HB VAL 14 HB VAL 14 -11.167 0.836 2.223
120 HG11 VAL 14 1HG1 VAL 14 -9.319 2.086 2.614
121 HG12 VAL 14 2HG1 VAL 14 -10.256 3.286 1.726
122 HG13 VAL 14 3HG1 VAL 14 -9.005 2.356 0.901
123 HG21 VAL 14 3HG2 VAL 14 -12.136 2.880 0.913
124 HG22 VAL 14 1HG2 VAL 14 -12.841 1.278 0.701
125 HG23 VAL 14 2HG2 VAL 14 -11.723 1.917 -0.506
126 H ILE 15 H ILE 15 -10.675 -1.916 1.843
127 HA ILE 15 HA ILE 15 -8.390 -1.915 3.553
128 HB ILE 15 HB ILE 15 -10.299 -4.202 3.063
129 HG12 ILE 15 2HG1 ILE 15 -10.532 -2.152 5.259
130 HG13 ILE 15 1HG1 ILE 15 -11.338 -1.941 3.708
131 HG21 ILE 15 1HG2 ILE 15 -8.349 -3.545 5.250
132 HG22 ILE 15 2HG2 ILE 15 -8.447 -5.003 4.263
133 HG23 ILE 15 3HG2 ILE 15 -9.678 -4.680 5.484
134 HD11 ILE 15 3HD1 ILE 15 -13.029 -3.128 4.485
135 HD12 ILE 15 1HD1 ILE 15 -12.149 -3.474 5.974
136 HD13 ILE 15 2HD1 ILE 15 -11.968 -4.533 4.575
137 H GLY 16 H GLY 16 -9.288 -3.607 0.601
138 HA2 GLY 16 2HA GLY 16 -7.120 -5.466 0.666
139 HA3 GLY 16 1HA GLY 16 -8.129 -5.097 -0.723
140 H LYS 17 H LYS 17 -7.470 -2.195 -0.465
141 HA LYS 17 HA LYS 17 -5.381 -2.074 -2.307
142 HB2 LYS 17 2HB LYS 17 -7.124 -0.293 -1.789
143 HB3 LYS 17 1HB LYS 17 -6.118 0.158 -0.420
144 HG2 LYS 17 2HG LYS 17 -4.245 0.315 -2.249
145 HG3 LYS 17 1HG LYS 17 -5.625 0.502 -3.333
146 HD2 LYS 17 2HD LYS 17 -5.242 2.163 -0.851
147 HD3 LYS 17 1HD LYS 17 -4.634 2.643 -2.435
148 HE2 LYS 17 2HE LYS 17 -6.646 3.692 -2.509
149 HE3 LYS 17 1HE LYS 17 -7.148 2.117 -3.119
150 HZ1 LYS 17 3HZ LYS 17 -8.684 2.735 -1.457
151 HZ2 LYS 17 1HZ LYS 17 -7.464 3.176 -0.370
152 HZ3 LYS 17 2HZ LYS 17 -7.702 1.548 -0.757
153 H GLY 18 H GLY 18 -5.360 -1.605 1.198
154 HA2 GLY 18 2HA GLY 18 -2.610 -0.943 1.393
155 HA3 GLY 18 1HA GLY 18 -3.629 -1.511 2.709
156 H LEU 19 H LEU 19 -4.360 -3.998 1.491
157 HA LEU 19 HA LEU 19 -2.163 -5.583 2.331
158 HG LEU 19 HG LEU 19 -2.586 -7.727 2.716
159 HB2 LEU 19 2HB LEU 19 -4.844 -6.004 1.990
160 HB3 LEU 19 1HB LEU 19 -4.173 -6.887 0.632
161 HD11 LEU 19 1HD1 LEU 19 -4.337 -6.475 4.161
162 HD12 LEU 19 2HD1 LEU 19 -3.826 -8.097 4.630
163 HD13 LEU 19 3HD1 LEU 19 -5.365 -7.862 3.802
164 HD21 LEU 19 3HD2 LEU 19 -5.061 -8.894 1.473
165 HD22 LEU 19 1HD2 LEU 19 -4.058 -9.785 2.616
166 HD23 LEU 19 2HD2 LEU 19 -3.375 -9.236 1.086
167 H ARG 20 H ARG 20 -3.278 -4.426 -0.771
168 HA ARG 20 HA ARG 20 -1.714 -6.181 -2.369
169 HE ARG 20 HE ARG 20 -5.500 -6.360 -4.587
170 HB2 ARG 20 2HB ARG 20 -3.739 -4.492 -2.913
171 HB3 ARG 20 1HB ARG 20 -2.386 -3.485 -3.410
172 HG2 ARG 20 2HG ARG 20 -1.863 -4.810 -5.178
173 HG3 ARG 20 1HG ARG 20 -2.435 -6.282 -4.389
174 HD2 ARG 20 2HD ARG 20 -4.535 -4.310 -4.927
175 HD3 ARG 20 1HD ARG 20 -3.751 -4.944 -6.374
176 HH11 ARG 20 1HH1 ARG 20 -2.951 -6.681 -6.948
177 HH12 ARG 20 2HH1 ARG 20 -3.370 -8.312 -7.361
178 HH21 ARG 20 1HH2 ARG 20 -6.049 -8.503 -5.123
179 HH22 ARG 20 2HH2 ARG 20 -5.129 -9.344 -6.324
180 H ALA 21 H ALA 21 -1.178 -3.015 -0.944
181 HA ALA 21 HA ALA 21 1.284 -2.508 -2.291
182 HB1 ALA 21 3HB ALA 21 0.485 -0.524 -1.550
183 HB2 ALA 21 1HB ALA 21 1.465 -0.918 -0.138
184 HB3 ALA 21 2HB ALA 21 -0.268 -1.236 -0.124
185 H ILE 22 H ILE 22 0.414 -3.825 0.865
186 HA ILE 22 HA ILE 22 3.067 -4.079 1.833
187 HB ILE 22 HB ILE 22 0.656 -5.709 2.650
188 HG12 ILE 22 2HG1 ILE 22 1.596 -3.306 4.161
189 HG13 ILE 22 1HG1 ILE 22 0.619 -3.061 2.717
190 HG21 ILE 22 1HG2 ILE 22 2.056 -5.510 4.886
191 HG22 ILE 22 2HG2 ILE 22 3.392 -5.342 3.746
192 HG23 ILE 22 3HG2 ILE 22 2.372 -6.780 3.702
193 HD11 ILE 22 3HD1 ILE 22 -0.677 -5.045 4.218
194 HD12 ILE 22 1HD1 ILE 22 -1.186 -3.379 3.948
195 HD13 ILE 22 2HD1 ILE 22 -0.199 -3.782 5.354
196 H ASN 23 H ASN 23 1.055 -6.044 -0.222
197 HA ASN 23 HA ASN 23 2.509 -8.470 0.043
198 HB2 ASN 23 2HB ASN 23 0.144 -7.762 -1.140
199 HB3 ASN 23 1HB ASN 23 1.182 -8.003 -2.542
200 HD21 ASN 23 1HD2 ASN 23 -0.057 -9.808 -3.136
201 HD22 ASN 23 2HD2 ASN 23 0.113 -11.323 -2.324
202 H ILE 24 H ILE 24 2.760 -5.688 -2.107
203 HA ILE 24 HA ILE 24 4.836 -6.904 -3.704
204 HB ILE 24 HB ILE 24 3.996 -4.005 -3.675
205 HG12 ILE 24 2HG1 ILE 24 2.985 -6.165 -5.528
206 HG13 ILE 24 1HG1 ILE 24 2.114 -5.652 -4.088
207 HG21 ILE 24 1HG2 ILE 24 4.968 -5.322 -6.127
208 HG22 ILE 24 2HG2 ILE 24 6.162 -5.085 -4.850
209 HG23 ILE 24 3HG2 ILE 24 5.282 -3.702 -5.503
210 HD11 ILE 24 3HD1 ILE 24 2.255 -3.297 -5.094
211 HD12 ILE 24 1HD1 ILE 24 1.123 -4.450 -5.806
212 HD13 ILE 24 2HD1 ILE 24 2.665 -4.125 -6.597
213 H ALA 25 H ALA 25 4.597 -4.719 -0.987
214 HA ALA 25 HA ALA 25 7.245 -3.714 -1.081
215 HB1 ALA 25 3HB ALA 25 5.023 -3.702 0.866
216 HB2 ALA 25 1HB ALA 25 6.023 -2.374 0.274
217 HB3 ALA 25 2HB ALA 25 6.644 -3.460 1.518
218 H GLY 26 H GLY 26 5.785 -6.575 0.328
219 HA2 GLY 26 2HA GLY 26 7.913 -7.327 2.016
220 HA3 GLY 26 1HA GLY 26 6.699 -8.413 1.359
221 H THR 27 H THR 27 7.365 -7.816 -1.413
222 HA THR 27 HA THR 27 9.444 -9.746 -1.748
223 HB THR 27 HB THR 27 8.362 -7.972 -3.926
224 HG1 THR 27 1HG THR 27 6.606 -9.300 -4.078
225 HG21 THR 27 3HG2 THR 27 10.205 -9.857 -4.174
226 HG22 THR 27 1HG2 THR 27 8.979 -9.564 -5.408
227 HG23 THR 27 2HG2 THR 27 8.772 -10.881 -4.253
228 H THR 28 H THR 28 9.180 -6.268 -2.431
229 HA THR 28 HA THR 28 11.754 -5.898 -3.453
230 HB THR 28 HB THR 28 10.601 -3.712 -1.811
231 HG1 THR 28 1HG THR 28 8.747 -3.661 -2.784
232 HG21 THR 28 3HG2 THR 28 12.412 -3.173 -3.284
233 HG22 THR 28 1HG2 THR 28 10.932 -2.431 -3.895
234 HG23 THR 28 2HG2 THR 28 11.564 -3.891 -4.655
235 H HIS 29 H HIS 29 10.565 -5.961 -0.145
236 HA HIS 29 HA HIS 29 12.846 -4.962 1.143
237 HD1 HIS 29 1HD HIS 29 13.886 -5.420 3.350
238 HD2 HIS 29 2HD HIS 29 9.963 -4.483 4.354
239 HE1 HIS 29 1HE HIS 29 14.043 -3.968 5.397
240 HE2 HIS 29 2HE HIS 29 11.664 -3.334 5.929
241 HB2 HIS 29 2HB HIS 29 10.383 -5.764 1.970
242 HB3 HIS 29 1HB HIS 29 11.373 -7.098 2.553
243 H ASP 30 H ASP 30 12.121 -8.096 -0.192
244 HA ASP 30 HA ASP 30 14.337 -9.411 1.105
245 HB2 ASP 30 2HB ASP 30 11.988 -10.258 -0.140
246 HB3 ASP 30 1HB ASP 30 13.272 -10.798 -1.216
247 H VAL 31 H VAL 31 13.521 -8.556 -2.253
248 HA VAL 31 HA VAL 31 15.844 -9.325 -3.502
249 HB VAL 31 HB VAL 31 14.372 -6.803 -4.236
250 HG11 VAL 31 1HG1 VAL 31 16.208 -7.053 -5.635
251 HG12 VAL 31 2HG1 VAL 31 14.895 -7.795 -6.550
252 HG13 VAL 31 3HG1 VAL 31 16.049 -8.809 -5.684
253 HG21 VAL 31 3HG2 VAL 31 12.517 -8.099 -4.193
254 HG22 VAL 31 1HG2 VAL 31 13.436 -9.603 -4.258
255 HG23 VAL 31 2HG2 VAL 31 13.151 -8.680 -5.733
256 H VAL 32 H VAL 32 15.187 -6.349 -1.735
257 HA VAL 32 HA VAL 32 17.641 -5.073 -2.441
258 HB VAL 32 HB VAL 32 15.868 -4.489 -0.064
259 HG11 VAL 32 1HG1 VAL 32 16.913 -2.122 -0.778
260 HG12 VAL 32 2HG1 VAL 32 18.237 -3.188 -1.252
261 HG13 VAL 32 3HG1 VAL 32 17.655 -3.191 0.414
262 HG21 VAL 32 3HG2 VAL 32 15.716 -2.829 -2.505
263 HG22 VAL 32 1HG2 VAL 32 14.452 -3.295 -1.367
264 HG23 VAL 32 2HG2 VAL 32 14.994 -4.436 -2.600
265 H SER 33 H SER 33 16.610 -7.200 0.137
266 HA SER 33 HA SER 33 18.890 -6.784 1.800
267 HG SER 33 HG SER 33 17.953 -7.307 3.866
268 HB2 SER 33 2HB SER 33 16.477 -7.905 2.240
269 HB3 SER 33 1HB SER 33 17.434 -9.362 1.978
270 H PHE 34 H PHE 34 18.130 -8.884 -0.880
271 HA PHE 34 HA PHE 34 20.234 -10.749 -0.487
272 HD1 PHE 34 1HD PHE 34 18.771 -12.718 -0.526
273 HD2 PHE 34 2HD PHE 34 20.281 -11.959 -4.430
274 HE1 PHE 34 1HE PHE 34 19.362 -15.096 -0.754
275 HE2 PHE 34 2HE PHE 34 20.874 -14.336 -4.667
276 HZ PHE 34 HZ PHE 34 20.413 -15.906 -2.828
277 HB2 PHE 34 2HB PHE 34 18.067 -10.668 -2.118
278 HB3 PHE 34 1HB PHE 34 19.337 -10.237 -3.259
279 H PHE 35 H PHE 35 19.977 -7.673 -2.164
280 HA PHE 35 HA PHE 35 22.666 -7.918 -3.251
281 HD1 PHE 35 2HD PHE 35 22.677 -8.145 -5.380
282 HD2 PHE 35 1HD PHE 35 22.226 -3.943 -4.887
283 HE1 PHE 35 2HE PHE 35 24.230 -7.763 -7.250
284 HE2 PHE 35 1HE PHE 35 23.777 -3.554 -6.757
285 HZ PHE 35 HZ PHE 35 24.782 -5.464 -7.941
286 HB2 PHE 35 2HB PHE 35 20.492 -6.727 -4.270
287 HB3 PHE 35 1HB PHE 35 21.177 -5.350 -3.415
288 H ARG 36 H ARG 36 20.963 -6.286 -0.671
289 HA ARG 36 HA ARG 36 23.533 -5.184 0.255
290 HE ARG 36 HE ARG 36 22.253 -0.416 -1.248
291 HB2 ARG 36 2HB ARG 36 21.331 -3.704 -0.494
292 HB3 ARG 36 1HB ARG 36 21.142 -3.812 1.251
293 HG2 ARG 36 2HG ARG 36 22.439 -1.980 1.225
294 HG3 ARG 36 1HG ARG 36 23.744 -3.161 1.113
295 HD2 ARG 36 2HD ARG 36 24.347 -2.351 -0.865
296 HD3 ARG 36 1HD ARG 36 22.730 -2.644 -1.506
297 HH11 ARG 36 1HH1 ARG 36 25.182 -1.165 0.497
298 HH12 ARG 36 2HH1 ARG 36 25.557 0.492 0.830
299 HH21 ARG 36 1HH2 ARG 36 22.745 1.764 -0.813
300 HH22 ARG 36 2HH2 ARG 36 24.172 2.157 0.086
301 HA PRO 37 HA PRO 37 21.456 -8.002 3.441
302 HB2 PRO 37 2HB PRO 37 23.293 -9.991 3.455
303 HB3 PRO 37 1HB PRO 37 21.914 -9.976 2.349
304 HG2 PRO 37 2HG PRO 37 24.758 -9.185 1.846
305 HG3 PRO 37 1HG PRO 37 23.663 -10.132 0.822
306 HD2 PRO 37 2HD PRO 37 24.162 -7.495 0.403
307 HD3 PRO 37 1HD PRO 37 22.613 -8.258 -0.003
308 H LYS 38 H LYS 38 22.559 -5.778 4.228
309 HA LYS 38 HA LYS 38 24.993 -6.370 5.745
310 HB2 LYS 38 2HB LYS 38 23.669 -3.892 4.778
311 HB3 LYS 38 1HB LYS 38 24.566 -3.782 6.285
312 HG2 LYS 38 2HG LYS 38 26.571 -4.032 5.274
313 HG3 LYS 38 1HG LYS 38 25.934 -5.115 4.032
314 HD2 LYS 38 2HD LYS 38 26.611 -3.020 3.025
315 HD3 LYS 38 1HD LYS 38 24.856 -3.183 2.941
316 HE2 LYS 38 2HE LYS 38 25.329 -0.944 3.593
317 HE3 LYS 38 1HE LYS 38 24.716 -1.786 5.013
318 HZ1 LYS 38 3HZ LYS 38 27.326 -2.188 5.298
319 HZ2 LYS 38 1HZ LYS 38 26.516 -0.859 5.960
320 HZ3 LYS 38 2HZ LYS 38 27.357 -0.696 4.502
321 H LYS 39 H LYS 39 22.417 -7.506 6.491
322 HA LYS 39 HA LYS 39 21.573 -6.044 8.846
323 HB2 LYS 39 2HB LYS 39 20.084 -7.437 7.246
324 HB3 LYS 39 1HB LYS 39 20.688 -8.825 8.141
325 HG2 LYS 39 2HG LYS 39 19.002 -8.486 9.543
326 HG3 LYS 39 1HG LYS 39 19.907 -7.089 10.129
327 HD2 LYS 39 2HD LYS 39 17.691 -6.357 9.609
328 HD3 LYS 39 1HD LYS 39 18.772 -5.720 8.367
329 HE2 LYS 39 2HE LYS 39 16.605 -6.684 7.527
330 HE3 LYS 39 1HE LYS 39 18.064 -7.343 6.793
331 HZ1 LYS 39 3HZ LYS 39 16.113 -8.860 7.727
332 HZ2 LYS 39 1HZ LYS 39 17.042 -8.737 9.137
333 HZ3 LYS 39 2HZ LYS 39 17.730 -9.357 7.723
334 H LYS 40 H LYS 40 23.566 -8.791 8.039
335 HA LYS 40 HA LYS 40 23.820 -9.591 10.826
336 HB2 LYS 40 2HB LYS 40 25.291 -11.381 9.905
337 HB3 LYS 40 1HB LYS 40 23.667 -11.384 9.236
338 HG2 LYS 40 2HG LYS 40 24.394 -10.506 7.182
339 HG3 LYS 40 1HG LYS 40 25.960 -10.036 7.849
340 HD2 LYS 40 2HD LYS 40 26.237 -12.010 6.493
341 HD3 LYS 40 1HD LYS 40 26.484 -12.434 8.186
342 HE2 LYS 40 2HE LYS 40 24.201 -13.299 8.303
343 HE3 LYS 40 1HE LYS 40 23.945 -12.862 6.615
344 HZ1 LYS 40 3HZ LYS 40 26.241 -14.556 7.165
345 HZ2 LYS 40 1HZ LYS 40 25.129 -14.616 5.889
346 HZ3 LYS 40 2HZ LYS 40 24.726 -15.273 7.396
347 H LYS 41 H LYS 41 25.900 -9.797 11.850
348 HA LYS 41 HA LYS 41 27.717 -8.717 12.720
349 HB2 LYS 41 2HB LYS 41 29.652 -8.640 11.117
350 HB3 LYS 41 1HB LYS 41 28.856 -10.199 11.254
351 HG2 LYS 41 2HG LYS 41 27.637 -9.728 9.161
352 HG3 LYS 41 1HG LYS 41 28.525 -8.208 9.016
353 HD2 LYS 41 2HD LYS 41 30.492 -10.131 9.439
354 HD3 LYS 41 1HD LYS 41 29.343 -10.910 8.348
355 HE2 LYS 41 2HE LYS 41 30.698 -8.247 7.929
356 HE3 LYS 41 1HE LYS 41 31.063 -9.751 7.085
357 HZ1 LYS 41 3HZ LYS 41 28.932 -7.861 6.638
358 HZ2 LYS 41 1HZ LYS 41 28.423 -9.475 6.644
359 HZ3 LYS 41 2HZ LYS 41 29.634 -8.973 5.574
360 H HIS 42 H HIS 42 26.954 -6.716 13.312
361 HA HIS 42 HA HIS 42 26.779 -4.545 11.441
362 HD1 HIS 42 1HD HIS 42 24.939 -6.704 13.123
363 HD2 HIS 42 2HD HIS 42 23.690 -2.748 13.373
364 HE1 HIS 42 1HE HIS 42 22.440 -6.768 12.851
365 HE2 HIS 42 2HE HIS 42 21.699 -4.373 13.093
366 HB2 HIS 42 2HB HIS 42 26.579 -4.648 14.456
367 HB3 HIS 42 1HB HIS 42 26.348 -3.180 13.510
Start of MODEL 7
1 H1 GLY 1 1H GLY 1 -27.212 13.003 -3.195
2 H2 GLY 1 2H GLY 1 -25.841 12.107 -2.775
3 H3 GLY 1 3H GLY 1 -25.871 13.778 -2.514
4 HA2 GLY 1 1HA GLY 1 -26.423 13.252 -0.426
5 HA3 GLY 1 2HA GLY 1 -28.023 13.048 -1.121
6 H LYS 2 H LYS 2 -27.492 10.675 -2.594
7 HA LYS 2 HA LYS 2 -27.501 8.774 -0.378
8 HB2 LYS 2 2HB LYS 2 -28.529 8.765 -3.179
9 HB3 LYS 2 1HB LYS 2 -28.137 7.220 -2.435
10 HG2 LYS 2 2HG LYS 2 -30.102 7.222 -1.425
11 HG3 LYS 2 1HG LYS 2 -29.649 8.688 -0.554
12 HD2 LYS 2 2HD LYS 2 -30.309 9.688 -3.001
13 HD3 LYS 2 1HD LYS 2 -31.427 8.331 -2.863
14 HE2 LYS 2 2HE LYS 2 -31.625 9.445 -0.391
15 HE3 LYS 2 1HE LYS 2 -31.339 10.870 -1.391
16 HZ1 LYS 2 3HZ LYS 2 -33.310 8.976 -2.384
17 HZ2 LYS 2 1HZ LYS 2 -33.326 10.668 -2.404
18 HZ3 LYS 2 2HZ LYS 2 -33.744 9.833 -0.993
19 H ILE 3 H ILE 3 -25.765 7.606 0.100
20 HA ILE 3 HA ILE 3 -23.349 7.749 -1.269
21 HB ILE 3 HB ILE 3 -24.188 5.498 0.553
22 HG12 ILE 3 2HG1 ILE 3 -24.725 7.540 1.710
23 HG13 ILE 3 1HG1 ILE 3 -23.218 6.923 2.379
24 HG21 ILE 3 1HG2 ILE 3 -21.974 5.589 -0.837
25 HG22 ILE 3 2HG2 ILE 3 -21.967 5.047 0.840
26 HG23 ILE 3 3HG2 ILE 3 -21.470 6.691 0.443
27 HD11 ILE 3 3HD1 ILE 3 -23.752 9.386 0.865
28 HD12 ILE 3 1HD1 ILE 3 -22.243 8.554 0.486
29 HD13 ILE 3 2HD1 ILE 3 -22.578 9.062 2.141
30 HA PRO 4 HA PRO 4 -24.223 4.839 -4.557
31 HB2 PRO 4 2HB PRO 4 -21.810 4.899 -5.754
32 HB3 PRO 4 1HB PRO 4 -22.950 6.245 -5.872
33 HG2 PRO 4 2HG PRO 4 -20.562 5.937 -4.094
34 HG3 PRO 4 1HG PRO 4 -21.096 7.356 -5.014
35 HD2 PRO 4 2HD PRO 4 -21.564 7.036 -2.345
36 HD3 PRO 4 1HD PRO 4 -22.629 7.966 -3.417
37 H VAL 5 H VAL 5 -23.394 2.765 -5.342
38 HA VAL 5 HA VAL 5 -22.816 0.963 -3.310
39 HB VAL 5 HB VAL 5 -22.131 0.480 -6.202
40 HG11 VAL 5 1HG1 VAL 5 -23.036 -1.268 -3.931
41 HG12 VAL 5 2HG1 VAL 5 -21.480 -1.296 -4.759
42 HG13 VAL 5 3HG1 VAL 5 -22.940 -1.807 -5.606
43 HG21 VAL 5 3HG2 VAL 5 -24.806 0.757 -4.903
44 HG22 VAL 5 1HG2 VAL 5 -24.588 -0.409 -6.209
45 HG23 VAL 5 2HG2 VAL 5 -24.267 1.302 -6.493
46 H LYS 6 H LYS 6 -20.700 2.931 -5.228
47 HA LYS 6 HA LYS 6 -18.324 1.495 -5.093
48 HB2 LYS 6 2HB LYS 6 -19.096 4.290 -5.532
49 HB3 LYS 6 1HB LYS 6 -17.491 4.103 -4.836
50 HG2 LYS 6 2HG LYS 6 -16.718 3.718 -6.872
51 HG3 LYS 6 1HG LYS 6 -17.641 2.213 -6.893
52 HD2 LYS 6 2HD LYS 6 -19.206 4.623 -7.489
53 HD3 LYS 6 1HD LYS 6 -17.951 4.252 -8.670
54 HE2 LYS 6 2HE LYS 6 -19.668 2.018 -7.744
55 HE3 LYS 6 1HE LYS 6 -20.400 3.217 -8.811
56 HZ1 LYS 6 3HZ LYS 6 -18.902 2.723 -10.507
57 HZ2 LYS 6 1HZ LYS 6 -19.297 1.205 -9.873
58 HZ3 LYS 6 2HZ LYS 6 -17.822 1.931 -9.475
59 H ALA 7 H ALA 7 -19.851 3.571 -2.699
60 HA ALA 7 HA ALA 7 -17.741 3.782 -0.880
61 HB1 ALA 7 3HB ALA 7 -20.683 4.058 -0.737
62 HB2 ALA 7 1HB ALA 7 -19.412 5.187 -0.270
63 HB3 ALA 7 2HB ALA 7 -19.827 3.835 0.787
64 H ILE 8 H ILE 8 -20.429 1.443 -0.935
65 HA ILE 8 HA ILE 8 -19.542 -0.111 1.227
66 HB ILE 8 HB ILE 8 -21.109 -1.174 -1.115
67 HG12 ILE 8 2HG1 ILE 8 -22.749 -0.275 1.087
68 HG13 ILE 8 1HG1 ILE 8 -21.791 1.057 0.457
69 HG21 ILE 8 1HG2 ILE 8 -20.614 -2.945 0.305
70 HG22 ILE 8 2HG2 ILE 8 -22.215 -2.432 0.844
71 HG23 ILE 8 3HG2 ILE 8 -20.781 -1.957 1.757
72 HD11 ILE 8 3HD1 ILE 8 -24.141 -0.148 -0.620
73 HD12 ILE 8 1HD1 ILE 8 -22.815 -0.300 -1.773
74 HD13 ILE 8 2HD1 ILE 8 -23.273 1.290 -1.160
75 H LYS 9 H LYS 9 -19.026 -0.443 -2.254
76 HA LYS 9 HA LYS 9 -17.569 -2.853 -2.150
77 HB2 LYS 9 2HB LYS 9 -17.495 -0.624 -4.191
78 HB3 LYS 9 1HB LYS 9 -16.773 -2.211 -4.416
79 HG2 LYS 9 2HG LYS 9 -19.626 -2.184 -3.673
80 HG3 LYS 9 1HG LYS 9 -19.228 -1.553 -5.272
81 HD2 LYS 9 2HD LYS 9 -17.890 -4.072 -4.545
82 HD3 LYS 9 1HD LYS 9 -19.643 -4.174 -4.722
83 HE2 LYS 9 2HE LYS 9 -19.047 -2.743 -6.914
84 HE3 LYS 9 1HE LYS 9 -17.549 -3.656 -6.745
85 HZ1 LYS 9 3HZ LYS 9 -20.288 -4.675 -7.173
86 HZ2 LYS 9 1HZ LYS 9 -19.076 -5.672 -6.536
87 HZ3 LYS 9 2HZ LYS 9 -18.892 -4.989 -8.073
88 H GLN 10 H GLN 10 -16.661 0.485 -1.688
89 HA GLN 10 HA GLN 10 -13.863 0.164 -1.963
90 HB2 GLN 10 2HB GLN 10 -15.221 2.337 -1.953
91 HB3 GLN 10 1HB GLN 10 -15.196 2.210 -0.200
92 HG2 GLN 10 2HG GLN 10 -12.807 2.352 -0.161
93 HG3 GLN 10 1HG GLN 10 -12.732 2.278 -1.922
94 HE21 GLN 10 1HE2 GLN 10 -14.467 4.020 -2.821
95 HE22 GLN 10 2HE2 GLN 10 -14.155 5.618 -2.239
96 H ALA 11 H ALA 11 -16.069 -0.127 0.762
97 HA ALA 11 HA ALA 11 -14.166 -0.303 2.815
98 HB1 ALA 11 3HB ALA 11 -16.593 -1.949 3.115
99 HB2 ALA 11 1HB ALA 11 -16.858 -0.243 2.757
100 HB3 ALA 11 2HB ALA 11 -15.920 -0.708 4.175
101 H GLY 12 H GLY 12 -15.450 -2.711 0.601
102 HA2 GLY 12 2HA GLY 12 -14.288 -4.959 1.936
103 HA3 GLY 12 1HA GLY 12 -14.946 -4.942 0.306
104 H LYS 13 H LYS 13 -13.140 -2.657 -0.402
105 HA LYS 13 HA LYS 13 -10.915 -4.274 -1.255
106 HB2 LYS 13 2HB LYS 13 -12.080 -1.689 -1.966
107 HB3 LYS 13 1HB LYS 13 -10.321 -1.672 -1.975
108 HG2 LYS 13 2HG LYS 13 -10.607 -2.372 -4.090
109 HG3 LYS 13 1HG LYS 13 -10.759 -3.953 -3.318
110 HD2 LYS 13 2HD LYS 13 -12.714 -4.081 -4.410
111 HD3 LYS 13 1HD LYS 13 -13.312 -2.993 -3.156
112 HE2 LYS 13 2HE LYS 13 -11.994 -1.877 -5.596
113 HE3 LYS 13 1HE LYS 13 -13.673 -2.409 -5.672
114 HZ1 LYS 13 3HZ LYS 13 -14.355 -0.759 -4.269
115 HZ2 LYS 13 1HZ LYS 13 -13.073 0.032 -5.039
116 HZ3 LYS 13 2HZ LYS 13 -12.858 -0.621 -3.494
117 H VAL 14 H VAL 14 -11.467 -1.646 1.028
118 HA VAL 14 HA VAL 14 -8.825 -1.009 1.628
119 HB VAL 14 HB VAL 14 -11.044 -0.992 3.661
120 HG11 VAL 14 1HG1 VAL 14 -9.231 -0.238 4.785
121 HG12 VAL 14 2HG1 VAL 14 -9.714 1.281 4.032
122 HG13 VAL 14 3HG1 VAL 14 -8.421 0.317 3.322
123 HG21 VAL 14 3HG2 VAL 14 -10.948 0.386 1.120
124 HG22 VAL 14 1HG2 VAL 14 -10.973 1.523 2.468
125 HG23 VAL 14 2HG2 VAL 14 -12.245 0.313 2.311
126 H ILE 15 H ILE 15 -10.873 -3.623 2.753
127 HA ILE 15 HA ILE 15 -9.169 -4.441 4.890
128 HB ILE 15 HB ILE 15 -11.208 -6.127 3.432
129 HG12 ILE 15 2HG1 ILE 15 -11.715 -4.574 5.962
130 HG13 ILE 15 1HG1 ILE 15 -11.991 -3.853 4.378
131 HG21 ILE 15 1HG2 ILE 15 -11.347 -7.234 5.696
132 HG22 ILE 15 2HG2 ILE 15 -9.892 -6.335 6.131
133 HG23 ILE 15 3HG2 ILE 15 -9.848 -7.496 4.804
134 HD11 ILE 15 3HD1 ILE 15 -14.068 -4.678 5.111
135 HD12 ILE 15 1HD1 ILE 15 -13.367 -6.222 5.601
136 HD13 ILE 15 2HD1 ILE 15 -13.494 -5.815 3.889
137 H GLY 16 H GLY 16 -9.589 -5.455 1.523
138 HA2 GLY 16 2HA GLY 16 -7.604 -7.539 1.745
139 HA3 GLY 16 1HA GLY 16 -8.418 -7.023 0.276
140 H LYS 17 H LYS 17 -7.680 -4.198 0.726
141 HA LYS 17 HA LYS 17 -5.330 -4.118 -0.782
142 HB2 LYS 17 2HB LYS 17 -6.995 -2.272 -0.620
143 HB3 LYS 17 1HB LYS 17 -6.417 -1.936 1.006
144 HG2 LYS 17 2HG LYS 17 -4.312 -1.993 -1.025
145 HG3 LYS 17 1HG LYS 17 -5.521 -0.728 -1.260
146 HD2 LYS 17 2HD LYS 17 -4.457 -1.100 1.483
147 HD3 LYS 17 1HD LYS 17 -3.370 -0.396 0.284
148 HE2 LYS 17 2HE LYS 17 -6.068 0.738 0.262
149 HE3 LYS 17 1HE LYS 17 -5.196 0.991 1.773
150 HZ1 LYS 17 3HZ LYS 17 -3.873 1.555 -0.794
151 HZ2 LYS 17 1HZ LYS 17 -3.571 2.219 0.733
152 HZ3 LYS 17 2HZ LYS 17 -4.945 2.686 -0.138
153 H GLY 18 H GLY 18 -5.855 -3.958 2.691
154 HA2 GLY 18 2HA GLY 18 -3.166 -3.284 3.360
155 HA3 GLY 18 1HA GLY 18 -4.379 -3.923 4.461
156 H LEU 19 H LEU 19 -4.925 -6.326 3.041
157 HA LEU 19 HA LEU 19 -2.775 -7.934 4.024
158 HG LEU 19 HG LEU 19 -4.913 -8.527 5.319
159 HB2 LEU 19 2HB LEU 19 -5.440 -8.399 2.823
160 HB3 LEU 19 1HB LEU 19 -4.267 -9.687 2.618
161 HD11 LEU 19 1HD1 LEU 19 -6.831 -9.673 3.851
162 HD12 LEU 19 2HD1 LEU 19 -6.704 -9.879 5.599
163 HD13 LEU 19 3HD1 LEU 19 -6.075 -11.122 4.515
164 HD21 LEU 19 3HD2 LEU 19 -3.607 -11.073 4.376
165 HD22 LEU 19 1HD2 LEU 19 -4.074 -10.763 6.047
166 HD23 LEU 19 2HD2 LEU 19 -2.859 -9.750 5.267
167 H ARG 20 H ARG 20 -3.857 -6.844 0.867
168 HA ARG 20 HA ARG 20 -2.113 -8.535 -0.630
169 HE ARG 20 HE ARG 20 -6.496 -8.803 -3.847
170 HB2 ARG 20 2HB ARG 20 -4.027 -6.384 -1.188
171 HB3 ARG 20 1HB ARG 20 -2.645 -6.392 -2.275
172 HG2 ARG 20 2HG ARG 20 -3.700 -7.934 -3.461
173 HG3 ARG 20 1HG ARG 20 -3.422 -9.053 -2.126
174 HD2 ARG 20 2HD ARG 20 -5.609 -9.175 -1.770
175 HD3 ARG 20 1HD ARG 20 -5.661 -7.440 -1.461
176 HH11 ARG 20 1HH1 ARG 20 -5.373 -5.771 -2.535
177 HH12 ARG 20 2HH1 ARG 20 -6.080 -4.820 -3.796
178 HH21 ARG 20 1HH2 ARG 20 -7.427 -7.554 -5.509
179 HH22 ARG 20 2HH2 ARG 20 -7.246 -5.831 -5.486
180 H ALA 21 H ALA 21 -1.852 -5.372 0.827
181 HA ALA 21 HA ALA 21 0.545 -4.620 -0.537
182 HB1 ALA 21 3HB ALA 21 0.579 -3.032 1.622
183 HB2 ALA 21 1HB ALA 21 -1.118 -3.506 1.635
184 HB3 ALA 21 2HB ALA 21 -0.432 -2.721 0.212
185 H ILE 22 H ILE 22 -0.202 -6.003 2.625
186 HA ILE 22 HA ILE 22 2.478 -6.033 3.564
187 HB ILE 22 HB ILE 22 0.180 -7.788 4.442
188 HG12 ILE 22 2HG1 ILE 22 1.066 -5.357 5.938
189 HG13 ILE 22 1HG1 ILE 22 0.050 -5.144 4.515
190 HG21 ILE 22 1HG2 ILE 22 2.942 -7.374 5.416
191 HG22 ILE 22 2HG2 ILE 22 1.907 -8.799 5.504
192 HG23 ILE 22 3HG2 ILE 22 1.674 -7.473 6.640
193 HD11 ILE 22 3HD1 ILE 22 -1.360 -5.201 6.424
194 HD12 ILE 22 1HD1 ILE 22 -0.600 -6.679 7.014
195 HD13 ILE 22 2HD1 ILE 22 -1.584 -6.718 5.552
196 H ASN 23 H ASN 23 0.638 -8.127 1.502
197 HA ASN 23 HA ASN 23 2.355 -10.409 1.797
198 HB2 ASN 23 2HB ASN 23 -0.174 -10.084 0.849
199 HB3 ASN 23 1HB ASN 23 0.731 -10.185 -0.659
200 HD21 ASN 23 1HD2 ASN 23 -1.052 -12.101 -0.187
201 HD22 ASN 23 2HD2 ASN 23 -0.279 -13.588 0.232
202 H ILE 24 H ILE 24 1.942 -7.842 -0.615
203 HA ILE 24 HA ILE 24 4.076 -8.828 -2.272
204 HB ILE 24 HB ILE 24 2.767 -6.110 -2.365
205 HG12 ILE 24 2HG1 ILE 24 2.028 -8.490 -4.059
206 HG13 ILE 24 1HG1 ILE 24 1.224 -8.159 -2.529
207 HG21 ILE 24 1HG2 ILE 24 4.891 -6.311 -3.584
208 HG22 ILE 24 2HG2 ILE 24 3.522 -6.064 -4.669
209 HG23 ILE 24 3HG2 ILE 24 4.228 -7.669 -4.492
210 HD11 ILE 24 3HD1 ILE 24 1.385 -6.084 -4.679
211 HD12 ILE 24 1HD1 ILE 24 0.260 -6.197 -3.325
212 HD13 ILE 24 2HD1 ILE 24 0.129 -7.322 -4.677
213 H ALA 25 H ALA 25 3.753 -6.576 0.360
214 HA ALA 25 HA ALA 25 6.013 -4.992 -0.010
215 HB1 ALA 25 3HB ALA 25 4.327 -5.755 2.293
216 HB2 ALA 25 1HB ALA 25 4.794 -4.158 1.705
217 HB3 ALA 25 2HB ALA 25 5.926 -5.110 2.664
218 H GLY 26 H GLY 26 5.704 -8.275 1.140
219 HA2 GLY 26 2HA GLY 26 8.292 -8.482 2.304
220 HA3 GLY 26 1HA GLY 26 7.261 -9.823 1.827
221 H THR 27 H THR 27 7.056 -8.929 -0.942
222 HA THR 27 HA THR 27 9.437 -10.188 -1.931
223 HB THR 27 HB THR 27 7.457 -8.810 -3.706
224 HG1 THR 27 1HG THR 27 5.939 -9.886 -2.744
225 HG21 THR 27 3HG2 THR 27 8.654 -9.924 -5.206
226 HG22 THR 27 1HG2 THR 27 7.837 -11.368 -4.609
227 HG23 THR 27 2HG2 THR 27 9.423 -10.927 -3.978
228 H THR 28 H THR 28 8.017 -6.942 -2.197
229 HA THR 28 HA THR 28 10.002 -5.801 -3.803
230 HB THR 28 HB THR 28 8.773 -4.081 -1.722
231 HG1 THR 28 1HG THR 28 6.877 -4.907 -1.996
232 HG21 THR 28 3HG2 THR 28 8.048 -3.389 -4.376
233 HG22 THR 28 1HG2 THR 28 9.772 -3.757 -4.340
234 HG23 THR 28 2HG2 THR 28 9.110 -2.535 -3.257
235 H HIS 29 H HIS 29 9.878 -6.410 -0.362
236 HA HIS 29 HA HIS 29 11.982 -4.748 0.463
237 HD1 HIS 29 1HD HIS 29 13.561 -4.668 1.933
238 HD2 HIS 29 2HD HIS 29 10.809 -6.180 4.654
239 HE1 HIS 29 1HE HIS 29 14.246 -3.743 4.167
240 HE2 HIS 29 2HE HIS 29 12.513 -4.596 5.783
241 HB2 HIS 29 2HB HIS 29 10.255 -6.241 1.812
242 HB3 HIS 29 1HB HIS 29 11.579 -7.403 1.772
243 H ASP 30 H ASP 30 11.944 -7.906 -1.035
244 HA ASP 30 HA ASP 30 14.653 -8.579 -0.518
245 HB2 ASP 30 2HB ASP 30 12.449 -9.842 -1.662
246 HB3 ASP 30 1HB ASP 30 13.592 -9.691 -2.991
247 H VAL 31 H VAL 31 13.037 -7.350 -3.446
248 HA VAL 31 HA VAL 31 15.257 -7.030 -5.054
249 HB VAL 31 HB VAL 31 12.935 -5.109 -5.036
250 HG11 VAL 31 1HG1 VAL 31 13.417 -5.491 -7.587
251 HG12 VAL 31 2HG1 VAL 31 15.008 -5.955 -6.986
252 HG13 VAL 31 3HG1 VAL 31 14.370 -4.349 -6.641
253 HG21 VAL 31 3HG2 VAL 31 11.704 -7.030 -5.090
254 HG22 VAL 31 1HG2 VAL 31 13.025 -7.989 -5.761
255 HG23 VAL 31 2HG2 VAL 31 12.105 -6.904 -6.802
256 H VAL 32 H VAL 32 13.905 -4.827 -2.653
257 HA VAL 32 HA VAL 32 15.664 -2.667 -3.202
258 HB VAL 32 HB VAL 32 14.260 -3.240 -0.589
259 HG11 VAL 32 1HG1 VAL 32 14.265 -0.683 -0.537
260 HG12 VAL 32 2HG1 VAL 32 15.480 -0.786 -1.811
261 HG13 VAL 32 3HG1 VAL 32 15.795 -1.508 -0.233
262 HG21 VAL 32 3HG2 VAL 32 12.977 -1.316 -2.350
263 HG22 VAL 32 1HG2 VAL 32 12.287 -2.683 -1.473
264 HG23 VAL 32 2HG2 VAL 32 13.038 -2.934 -3.050
265 H SER 33 H SER 33 15.842 -5.504 -1.167
266 HA SER 33 HA SER 33 18.040 -4.690 0.420
267 HG SER 33 HG SER 33 18.060 -7.714 1.975
268 HB2 SER 33 2HB SER 33 16.334 -6.785 0.529
269 HB3 SER 33 1HB SER 33 17.743 -7.578 -0.179
270 H PHE 34 H PHE 34 17.745 -6.156 -2.740
271 HA PHE 34 HA PHE 34 20.372 -7.078 -3.066
272 HD1 PHE 34 1HD PHE 34 19.847 -9.369 -4.551
273 HD2 PHE 34 2HD PHE 34 20.523 -5.896 -6.914
274 HE1 PHE 34 1HE PHE 34 21.416 -10.637 -5.958
275 HE2 PHE 34 2HE PHE 34 22.094 -7.157 -8.327
276 HZ PHE 34 HZ PHE 34 22.542 -9.530 -7.851
277 HB2 PHE 34 2HB PHE 34 18.278 -7.413 -4.566
278 HB3 PHE 34 1HB PHE 34 18.787 -5.916 -5.338
279 H PHE 35 H PHE 35 18.915 -3.912 -3.663
280 HA PHE 35 HA PHE 35 21.319 -2.778 -4.737
281 HD1 PHE 35 1HD PHE 35 19.917 -1.522 -7.137
282 HD2 PHE 35 2HD PHE 35 20.627 0.777 -3.628
283 HE1 PHE 35 1HE PHE 35 20.949 0.244 -8.506
284 HE2 PHE 35 2HE PHE 35 21.658 2.547 -4.989
285 HZ PHE 35 HZ PHE 35 21.819 2.281 -7.432
286 HB2 PHE 35 2HB PHE 35 18.812 -2.050 -5.052
287 HB3 PHE 35 1HB PHE 35 19.113 -1.104 -3.599
288 H ARG 36 H ARG 36 19.848 -3.045 -1.586
289 HA ARG 36 HA ARG 36 21.673 -1.154 -0.369
290 HE ARG 36 HE ARG 36 18.276 1.184 3.124
291 HB2 ARG 36 2HB ARG 36 19.256 -2.613 0.432
292 HB3 ARG 36 1HB ARG 36 20.459 -2.481 1.708
293 HG2 ARG 36 2HG ARG 36 20.462 -0.074 1.500
294 HG3 ARG 36 1HG ARG 36 19.339 -0.164 0.143
295 HD2 ARG 36 2HD ARG 36 17.587 -0.286 1.510
296 HD3 ARG 36 1HD ARG 36 18.320 -1.602 2.426
297 HH11 ARG 36 1HH1 ARG 36 19.945 -1.848 3.565
298 HH12 ARG 36 2HH1 ARG 36 20.628 -1.393 5.090
299 HH21 ARG 36 1HH2 ARG 36 19.174 1.784 5.130
300 HH22 ARG 36 2HH2 ARG 36 20.190 0.668 5.979
301 HA PRO 37 HA PRO 37 24.840 -3.899 0.976
302 HB2 PRO 37 2HB PRO 37 25.091 -3.407 3.653
303 HB3 PRO 37 1HB PRO 37 25.688 -2.317 2.398
304 HG2 PRO 37 2HG PRO 37 23.156 -2.175 3.986
305 HG3 PRO 37 1HG PRO 37 24.276 -0.871 3.543
306 HD2 PRO 37 2HD PRO 37 21.957 -1.275 2.229
307 HD3 PRO 37 1HD PRO 37 23.419 -0.693 1.404
308 H LYS 38 H LYS 38 25.358 -5.366 3.138
309 HA LYS 38 HA LYS 38 22.947 -6.886 3.807
310 HB2 LYS 38 2HB LYS 38 24.017 -7.935 1.814
311 HB3 LYS 38 1HB LYS 38 25.474 -8.178 2.767
312 HG2 LYS 38 2HG LYS 38 24.247 -10.226 2.707
313 HG3 LYS 38 1HG LYS 38 24.149 -9.566 4.340
314 HD2 LYS 38 2HD LYS 38 21.923 -9.254 4.213
315 HD3 LYS 38 1HD LYS 38 21.995 -8.713 2.535
316 HE2 LYS 38 2HE LYS 38 20.774 -10.749 2.552
317 HE3 LYS 38 1HE LYS 38 22.366 -11.111 1.885
318 HZ1 LYS 38 3HZ LYS 38 22.106 -11.429 4.759
319 HZ2 LYS 38 1HZ LYS 38 22.893 -12.410 3.627
320 HZ3 LYS 38 2HZ LYS 38 21.218 -12.525 3.827
321 H LYS 39 H LYS 39 22.891 -6.781 5.952
322 HA LYS 39 HA LYS 39 23.492 -6.919 8.141
323 HB2 LYS 39 2HB LYS 39 24.403 -9.165 7.065
324 HB3 LYS 39 1HB LYS 39 25.962 -8.454 7.464
325 HG2 LYS 39 2HG LYS 39 25.161 -9.951 9.218
326 HG3 LYS 39 1HG LYS 39 25.320 -8.292 9.796
327 HD2 LYS 39 2HD LYS 39 22.998 -7.954 9.802
328 HD3 LYS 39 1HD LYS 39 22.706 -9.363 8.781
329 HE2 LYS 39 2HE LYS 39 22.697 -10.773 10.526
330 HE3 LYS 39 1HE LYS 39 24.066 -9.975 11.299
331 HZ1 LYS 39 3HZ LYS 39 21.213 -9.182 11.426
332 HZ2 LYS 39 1HZ LYS 39 22.473 -8.195 11.972
333 HZ3 LYS 39 2HZ LYS 39 22.199 -9.695 12.701
334 H LYS 40 H LYS 40 24.282 -4.608 6.875
335 HA LYS 40 HA LYS 40 27.036 -4.093 7.702
336 HB2 LYS 40 2HB LYS 40 25.902 -3.322 5.471
337 HB3 LYS 40 1HB LYS 40 25.252 -2.028 6.468
338 HG2 LYS 40 2HG LYS 40 27.155 -1.046 5.674
339 HG3 LYS 40 1HG LYS 40 27.751 -1.735 7.187
340 HD2 LYS 40 2HD LYS 40 28.162 -3.813 5.523
341 HD3 LYS 40 1HD LYS 40 28.355 -2.473 4.393
342 HE2 LYS 40 2HE LYS 40 30.299 -1.825 5.310
343 HE3 LYS 40 1HE LYS 40 29.725 -2.096 6.954
344 HZ1 LYS 40 3HZ LYS 40 30.555 -4.171 6.993
345 HZ2 LYS 40 1HZ LYS 40 31.581 -3.591 5.779
346 HZ3 LYS 40 2HZ LYS 40 30.203 -4.482 5.369
347 H LYS 41 H LYS 41 27.347 -3.514 9.742
348 HA LYS 41 HA LYS 41 25.307 -2.542 11.445
349 HB2 LYS 41 2HB LYS 41 27.166 -2.135 13.050
350 HB3 LYS 41 1HB LYS 41 27.165 -3.760 12.377
351 HG2 LYS 41 2HG LYS 41 29.064 -3.389 11.129
352 HG3 LYS 41 1HG LYS 41 28.830 -1.641 11.100
353 HD2 LYS 41 2HD LYS 41 29.644 -1.371 13.265
354 HD3 LYS 41 1HD LYS 41 29.380 -3.067 13.677
355 HE2 LYS 41 2HE LYS 41 31.337 -2.279 11.546
356 HE3 LYS 41 1HE LYS 41 31.792 -2.248 13.249
357 HZ1 LYS 41 3HZ LYS 41 32.351 -4.370 12.824
358 HZ2 LYS 41 1HZ LYS 41 31.301 -4.516 11.504
359 HZ3 LYS 41 2HZ LYS 41 30.706 -4.666 13.079
360 H HIS 42 H HIS 42 24.745 -0.517 12.056
361 HA HIS 42 HA HIS 42 26.134 1.707 10.713
362 HD1 HIS 42 1HD HIS 42 22.327 2.698 12.975
363 HD2 HIS 42 2HD HIS 42 22.581 -0.771 10.701
364 HE1 HIS 42 1HE HIS 42 20.494 1.202 13.826
365 HE2 HIS 42 2HE HIS 42 20.727 -0.926 12.497
366 HB2 HIS 42 2HB HIS 42 23.914 2.915 11.022
367 HB3 HIS 42 1HB HIS 42 23.935 1.609 9.842
Start of MODEL 8
1 H1 GLY 1 1H GLY 1 -28.689 5.794 15.605
2 H2 GLY 1 2H GLY 1 -27.219 5.714 16.437
3 H3 GLY 1 3H GLY 1 -28.015 4.290 15.989
4 HA2 GLY 1 1HA GLY 1 -27.763 5.485 13.608
5 HA3 GLY 1 2HA GLY 1 -26.307 6.030 14.428
6 H LYS 2 H LYS 2 -26.215 4.401 12.180
7 HA LYS 2 HA LYS 2 -24.812 2.110 13.283
8 HB2 LYS 2 2HB LYS 2 -25.958 0.573 11.627
9 HB3 LYS 2 1HB LYS 2 -26.931 1.081 13.000
10 HG2 LYS 2 2HG LYS 2 -27.091 2.674 10.497
11 HG3 LYS 2 1HG LYS 2 -27.884 1.098 10.547
12 HD2 LYS 2 2HD LYS 2 -28.376 2.765 12.904
13 HD3 LYS 2 1HD LYS 2 -28.991 3.448 11.398
14 HE2 LYS 2 2HE LYS 2 -29.924 1.035 11.029
15 HE3 LYS 2 1HE LYS 2 -29.734 0.903 12.777
16 HZ1 LYS 2 3HZ LYS 2 -31.838 1.720 12.665
17 HZ2 LYS 2 1HZ LYS 2 -31.572 2.570 11.227
18 HZ3 LYS 2 2HZ LYS 2 -31.000 3.189 12.692
19 H ILE 3 H ILE 3 -22.888 2.120 12.339
20 HA ILE 3 HA ILE 3 -22.176 3.655 10.140
21 HB ILE 3 HB ILE 3 -20.763 1.156 11.055
22 HG12 ILE 3 2HG1 ILE 3 -19.734 3.656 12.121
23 HG13 ILE 3 1HG1 ILE 3 -21.397 3.379 12.628
24 HG21 ILE 3 1HG2 ILE 3 -20.198 2.626 8.917
25 HG22 ILE 3 2HG2 ILE 3 -18.949 1.871 9.908
26 HG23 ILE 3 3HG2 ILE 3 -19.345 3.575 10.130
27 HD11 ILE 3 3HD1 ILE 3 -19.573 2.511 14.145
28 HD12 ILE 3 1HD1 ILE 3 -19.267 1.289 12.911
29 HD13 ILE 3 2HD1 ILE 3 -20.842 1.369 13.700
30 HA PRO 4 HA PRO 4 -24.224 1.178 6.940
31 HB2 PRO 4 2HB PRO 4 -22.490 2.966 5.296
32 HB3 PRO 4 1HB PRO 4 -24.204 2.578 5.109
33 HG2 PRO 4 2HG PRO 4 -23.455 4.922 6.116
34 HG3 PRO 4 1HG PRO 4 -24.859 4.059 6.772
35 HD2 PRO 4 2HD PRO 4 -22.115 4.356 7.904
36 HD3 PRO 4 1HD PRO 4 -23.678 4.279 8.736
37 H VAL 5 H VAL 5 -23.313 -0.826 7.015
38 HA VAL 5 HA VAL 5 -20.619 -1.466 6.834
39 HB VAL 5 HB VAL 5 -22.826 -3.244 5.814
40 HG11 VAL 5 1HG1 VAL 5 -20.211 -3.700 5.812
41 HG12 VAL 5 2HG1 VAL 5 -21.391 -4.974 6.118
42 HG13 VAL 5 3HG1 VAL 5 -20.567 -4.195 7.466
43 HG21 VAL 5 3HG2 VAL 5 -22.612 -4.000 8.377
44 HG22 VAL 5 1HG2 VAL 5 -23.803 -2.823 7.817
45 HG23 VAL 5 2HG2 VAL 5 -22.299 -2.272 8.558
46 H LYS 6 H LYS 6 -22.956 -0.790 4.331
47 HA LYS 6 HA LYS 6 -21.613 -1.925 2.143
48 HB2 LYS 6 2HB LYS 6 -23.951 -0.436 2.547
49 HB3 LYS 6 1HB LYS 6 -22.986 0.527 1.436
50 HG2 LYS 6 2HG LYS 6 -23.072 -1.049 -0.226
51 HG3 LYS 6 1HG LYS 6 -23.326 -2.382 0.902
52 HD2 LYS 6 2HD LYS 6 -25.600 -1.569 1.336
53 HD3 LYS 6 1HD LYS 6 -25.341 -0.249 0.194
54 HE2 LYS 6 2HE LYS 6 -24.829 -2.993 -0.786
55 HE3 LYS 6 1HE LYS 6 -26.510 -2.557 -0.482
56 HZ1 LYS 6 3HZ LYS 6 -24.922 -0.633 -1.981
57 HZ2 LYS 6 1HZ LYS 6 -26.535 -1.103 -2.187
58 HZ3 LYS 6 2HZ LYS 6 -25.287 -2.079 -2.779
59 H ALA 7 H ALA 7 -21.315 1.220 3.697
60 HA ALA 7 HA ALA 7 -19.668 2.473 1.815
61 HB1 ALA 7 3HB ALA 7 -20.800 3.255 4.130
62 HB2 ALA 7 1HB ALA 7 -19.524 4.157 3.312
63 HB3 ALA 7 2HB ALA 7 -19.125 3.077 4.650
64 H ILE 8 H ILE 8 -18.774 0.668 4.753
65 HA ILE 8 HA ILE 8 -15.989 0.809 4.341
66 HB ILE 8 HB ILE 8 -17.399 -1.408 5.810
67 HG12 ILE 8 2HG1 ILE 8 -16.564 0.785 7.502
68 HG13 ILE 8 1HG1 ILE 8 -17.721 1.342 6.300
69 HG21 ILE 8 1HG2 ILE 8 -14.712 -0.093 6.173
70 HG22 ILE 8 2HG2 ILE 8 -15.021 -1.706 5.528
71 HG23 ILE 8 3HG2 ILE 8 -15.382 -1.345 7.217
72 HD11 ILE 8 3HD1 ILE 8 -18.171 -0.152 8.690
73 HD12 ILE 8 1HD1 ILE 8 -18.733 -1.072 7.297
74 HD13 ILE 8 2HD1 ILE 8 -19.340 0.560 7.580
75 H LYS 9 H LYS 9 -18.393 -1.644 3.526
76 HA LYS 9 HA LYS 9 -16.816 -3.692 2.626
77 HB2 LYS 9 2HB LYS 9 -19.328 -3.652 2.764
78 HB3 LYS 9 1HB LYS 9 -19.334 -2.790 1.232
79 HG2 LYS 9 2HG LYS 9 -17.821 -4.879 0.536
80 HG3 LYS 9 1HG LYS 9 -18.782 -5.632 1.810
81 HD2 LYS 9 2HD LYS 9 -20.705 -4.303 0.443
82 HD3 LYS 9 1HD LYS 9 -19.578 -4.687 -0.863
83 HE2 LYS 9 2HE LYS 9 -20.419 -6.789 1.096
84 HE3 LYS 9 1HE LYS 9 -21.457 -6.372 -0.269
85 HZ1 LYS 9 3HZ LYS 9 -18.609 -7.063 -0.657
86 HZ2 LYS 9 1HZ LYS 9 -19.866 -7.089 -1.790
87 HZ3 LYS 9 2HZ LYS 9 -19.798 -8.261 -0.573
88 H GLN 10 H GLN 10 -18.056 -1.041 0.611
89 HA GLN 10 HA GLN 10 -16.699 -1.761 -1.728
90 HB2 GLN 10 2HB GLN 10 -17.085 0.588 -2.441
91 HB3 GLN 10 1HB GLN 10 -18.529 -0.195 -1.814
92 HG2 GLN 10 2HG GLN 10 -18.376 0.990 0.241
93 HG3 GLN 10 1HG GLN 10 -16.778 1.612 -0.170
94 HE21 GLN 10 1HE2 GLN 10 -16.744 2.882 -2.273
95 HE22 GLN 10 2HE2 GLN 10 -18.034 4.007 -2.506
96 H ALA 11 H ALA 11 -15.732 0.285 0.969
97 HA ALA 11 HA ALA 11 -13.314 1.202 -0.211
98 HB1 ALA 11 3HB ALA 11 -12.806 1.475 2.408
99 HB2 ALA 11 1HB ALA 11 -14.561 1.316 2.464
100 HB3 ALA 11 2HB ALA 11 -13.822 2.593 1.500
101 H GLY 12 H GLY 12 -14.186 -1.559 1.774
102 HA2 GLY 12 2HA GLY 12 -11.554 -2.421 2.367
103 HA3 GLY 12 1HA GLY 12 -13.002 -3.418 2.418
104 H LYS 13 H LYS 13 -13.650 -2.884 -0.396
105 HA LYS 13 HA LYS 13 -12.263 -5.057 -1.557
106 HB2 LYS 13 2HB LYS 13 -14.540 -3.554 -2.157
107 HB3 LYS 13 1HB LYS 13 -13.458 -3.282 -3.516
108 HG2 LYS 13 2HG LYS 13 -14.976 -5.165 -3.890
109 HG3 LYS 13 1HG LYS 13 -13.281 -5.661 -3.899
110 HD2 LYS 13 2HD LYS 13 -14.071 -5.907 -1.242
111 HD3 LYS 13 1HD LYS 13 -15.445 -6.506 -2.170
112 HE2 LYS 13 2HE LYS 13 -14.009 -8.357 -1.733
113 HE3 LYS 13 1HE LYS 13 -13.854 -7.953 -3.442
114 HZ1 LYS 13 3HZ LYS 13 -11.962 -7.089 -1.322
115 HZ2 LYS 13 1HZ LYS 13 -11.799 -6.818 -2.985
116 HZ3 LYS 13 2HZ LYS 13 -11.708 -8.393 -2.372
117 H VAL 14 H VAL 14 -11.968 -1.546 -1.931
118 HA VAL 14 HA VAL 14 -10.072 -1.531 -3.982
119 HB VAL 14 HB VAL 14 -10.250 0.508 -1.768
120 HG11 VAL 14 1HG1 VAL 14 -9.135 1.926 -3.137
121 HG12 VAL 14 2HG1 VAL 14 -9.798 1.204 -4.604
122 HG13 VAL 14 3HG1 VAL 14 -8.482 0.403 -3.746
123 HG21 VAL 14 3HG2 VAL 14 -11.781 1.276 -4.044
124 HG22 VAL 14 1HG2 VAL 14 -12.317 1.043 -2.381
125 HG23 VAL 14 2HG2 VAL 14 -12.331 -0.312 -3.508
126 H ILE 15 H ILE 15 -9.752 -1.883 -0.504
127 HA ILE 15 HA ILE 15 -6.969 -1.487 -0.317
128 HB ILE 15 HB ILE 15 -8.680 -3.262 1.430
129 HG12 ILE 15 2HG1 ILE 15 -7.937 -0.389 1.966
130 HG13 ILE 15 1HG1 ILE 15 -9.419 -0.824 1.120
131 HG21 ILE 15 1HG2 ILE 15 -5.958 -3.030 1.413
132 HG22 ILE 15 2HG2 ILE 15 -6.929 -3.510 2.802
133 HG23 ILE 15 3HG2 ILE 15 -6.424 -1.830 2.618
134 HD11 ILE 15 3HD1 ILE 15 -8.679 -1.187 3.968
135 HD12 ILE 15 1HD1 ILE 15 -9.762 -2.365 3.225
136 HD13 ILE 15 2HD1 ILE 15 -10.200 -0.656 3.248
137 H GLY 16 H GLY 16 -8.930 -4.359 -0.950
138 HA2 GLY 16 2HA GLY 16 -6.891 -6.280 -0.820
139 HA3 GLY 16 1HA GLY 16 -8.365 -6.431 -1.762
140 H LYS 17 H LYS 17 -8.085 -4.401 -3.594
141 HA LYS 17 HA LYS 17 -6.394 -5.570 -5.510
142 HB2 LYS 17 2HB LYS 17 -8.450 -3.975 -5.783
143 HB3 LYS 17 1HB LYS 17 -7.244 -2.699 -5.689
144 HG2 LYS 17 2HG LYS 17 -7.170 -2.952 -7.915
145 HG3 LYS 17 1HG LYS 17 -6.106 -4.308 -7.534
146 HD2 LYS 17 2HD LYS 17 -8.352 -5.642 -7.381
147 HD3 LYS 17 1HD LYS 17 -8.976 -4.317 -8.365
148 HE2 LYS 17 2HE LYS 17 -8.208 -6.213 -9.729
149 HE3 LYS 17 1HE LYS 17 -7.294 -4.743 -10.055
150 HZ1 LYS 17 3HZ LYS 17 -6.197 -6.496 -8.017
151 HZ2 LYS 17 1HZ LYS 17 -5.411 -5.628 -9.237
152 HZ3 LYS 17 2HZ LYS 17 -6.162 -7.099 -9.595
153 H GLY 18 H GLY 18 -5.998 -2.751 -3.424
154 HA2 GLY 18 2HA GLY 18 -3.472 -1.975 -4.487
155 HA3 GLY 18 1HA GLY 18 -4.151 -1.459 -2.949
156 H LEU 19 H LEU 19 -4.494 -4.139 -1.927
157 HA LEU 19 HA LEU 19 -1.955 -4.493 -0.727
158 HG LEU 19 HG LEU 19 -3.562 -6.718 1.690
159 HB2 LEU 19 2HB LEU 19 -4.422 -5.193 -0.001
160 HB3 LEU 19 1HB LEU 19 -3.933 -6.715 -0.724
161 HD11 LEU 19 1HD1 LEU 19 -0.788 -6.581 0.699
162 HD12 LEU 19 2HD1 LEU 19 -1.877 -7.650 -0.182
163 HD13 LEU 19 3HD1 LEU 19 -1.631 -7.876 1.548
164 HD21 LEU 19 3HD2 LEU 19 -2.183 -5.206 2.811
165 HD22 LEU 19 1HD2 LEU 19 -3.127 -4.190 1.721
166 HD23 LEU 19 2HD2 LEU 19 -1.462 -4.608 1.316
167 H ARG 20 H ARG 20 -3.633 -6.095 -3.382
168 HA ARG 20 HA ARG 20 -1.912 -8.280 -3.702
169 HE ARG 20 HE ARG 20 -6.110 -8.900 -6.589
170 HB2 ARG 20 2HB ARG 20 -4.190 -7.487 -4.920
171 HB3 ARG 20 1HB ARG 20 -3.022 -7.062 -6.164
172 HG2 ARG 20 2HG ARG 20 -2.161 -9.393 -6.060
173 HG3 ARG 20 1HG ARG 20 -3.481 -9.778 -4.953
174 HD2 ARG 20 2HD ARG 20 -4.086 -8.488 -7.576
175 HD3 ARG 20 1HD ARG 20 -3.731 -10.215 -7.521
176 HH11 ARG 20 1HH1 ARG 20 -4.092 -11.729 -6.268
177 HH12 ARG 20 2HH1 ARG 20 -5.370 -12.723 -5.655
178 HH21 ARG 20 1HH2 ARG 20 -7.791 -10.208 -5.783
179 HH22 ARG 20 2HH2 ARG 20 -7.471 -11.861 -5.380
180 H ALA 21 H ALA 21 -1.710 -4.968 -4.850
181 HA ALA 21 HA ALA 21 0.586 -5.416 -6.504
182 HB1 ALA 21 3HB ALA 21 -0.436 -2.800 -5.404
183 HB2 ALA 21 1HB ALA 21 -1.029 -3.567 -6.879
184 HB3 ALA 21 2HB ALA 21 0.646 -3.026 -6.779
185 H ILE 22 H ILE 22 0.012 -4.235 -3.236
186 HA ILE 22 HA ILE 22 2.701 -3.523 -2.682
187 HB ILE 22 HB ILE 22 0.561 -4.318 -0.704
188 HG12 ILE 22 2HG1 ILE 22 1.224 -1.472 -1.270
189 HG13 ILE 22 1HG1 ILE 22 0.247 -2.327 -2.459
190 HG21 ILE 22 1HG2 ILE 22 2.953 -2.538 -0.290
191 HG22 ILE 22 2HG2 ILE 22 2.926 -4.254 0.116
192 HG23 ILE 22 3HG2 ILE 22 1.831 -3.137 0.930
193 HD11 ILE 22 3HD1 ILE 22 -0.499 -1.239 0.098
194 HD12 ILE 22 1HD1 ILE 22 -0.913 -2.951 -0.016
195 HD13 ILE 22 2HD1 ILE 22 -1.514 -1.815 -1.224
196 H ASN 23 H ASN 23 0.941 -6.519 -2.642
197 HA ASN 23 HA ASN 23 2.664 -7.986 -0.943
198 HB2 ASN 23 2HB ASN 23 0.260 -8.491 -2.119
199 HB3 ASN 23 1HB ASN 23 1.329 -9.471 -3.117
200 HD21 ASN 23 1HD2 ASN 23 -0.485 -9.386 -0.344
201 HD22 ASN 23 2HD2 ASN 23 0.195 -10.749 0.472
202 H ILE 24 H ILE 24 2.652 -7.324 -4.397
203 HA ILE 24 HA ILE 24 4.821 -9.118 -4.978
204 HB ILE 24 HB ILE 24 3.833 -6.842 -6.696
205 HG12 ILE 24 2HG1 ILE 24 2.894 -9.706 -6.839
206 HG13 ILE 24 1HG1 ILE 24 2.041 -8.484 -5.902
207 HG21 ILE 24 1HG2 ILE 24 6.033 -8.274 -7.082
208 HG22 ILE 24 2HG2 ILE 24 5.007 -7.753 -8.418
209 HG23 ILE 24 3HG2 ILE 24 4.871 -9.394 -7.790
210 HD11 ILE 24 3HD1 ILE 24 1.275 -7.406 -7.752
211 HD12 ILE 24 1HD1 ILE 24 1.369 -9.051 -8.379
212 HD13 ILE 24 2HD1 ILE 24 2.648 -7.894 -8.744
213 H ALA 25 H ALA 25 4.469 -5.593 -4.705
214 HA ALA 25 HA ALA 25 7.228 -5.049 -5.158
215 HB1 ALA 25 3HB ALA 25 5.887 -3.237 -5.645
216 HB2 ALA 25 1HB ALA 25 6.526 -2.794 -4.064
217 HB3 ALA 25 2HB ALA 25 4.895 -3.448 -4.203
218 H GLY 26 H GLY 26 5.289 -5.745 -2.336
219 HA2 GLY 26 2HA GLY 26 7.101 -4.820 -0.370
220 HA3 GLY 26 1HA GLY 26 5.829 -6.007 -0.120
221 H THR 27 H THR 27 6.847 -7.848 -2.126
222 HA THR 27 HA THR 27 8.507 -9.424 -0.518
223 HB THR 27 HB THR 27 8.492 -9.693 -3.505
224 HG1 THR 27 1HG THR 27 6.411 -9.773 -3.476
225 HG21 THR 27 3HG2 THR 27 9.628 -11.498 -2.716
226 HG22 THR 27 1HG2 THR 27 7.980 -12.127 -2.657
227 HG23 THR 27 2HG2 THR 27 8.745 -11.526 -1.189
228 H THR 28 H THR 28 9.329 -7.571 -3.450
229 HA THR 28 HA THR 28 12.086 -8.055 -3.377
230 HB THR 28 HB THR 28 11.028 -7.160 -5.362
231 HG1 THR 28 1HG THR 28 12.596 -5.752 -5.877
232 HG21 THR 28 3HG2 THR 28 9.293 -5.778 -4.586
233 HG22 THR 28 1HG2 THR 28 10.427 -4.716 -5.422
234 HG23 THR 28 2HG2 THR 28 10.406 -4.772 -3.658
235 H HIS 29 H HIS 29 10.102 -5.627 -1.793
236 HA HIS 29 HA HIS 29 12.161 -3.950 -0.874
237 HD1 HIS 29 1HD HIS 29 12.613 -2.546 0.654
238 HD2 HIS 29 2HD HIS 29 8.659 -1.308 0.352
239 HE1 HIS 29 1HE HIS 29 12.634 -0.096 1.221
240 HE2 HIS 29 2HE HIS 29 10.217 0.612 1.116
241 HB2 HIS 29 2HB HIS 29 9.474 -3.812 -0.790
242 HB3 HIS 29 1HB HIS 29 9.784 -4.323 0.866
243 H ASP 30 H ASP 30 10.883 -6.978 0.317
244 HA ASP 30 HA ASP 30 12.028 -6.883 2.905
245 HB2 ASP 30 2HB ASP 30 10.361 -8.614 1.494
246 HB3 ASP 30 1HB ASP 30 11.807 -9.567 1.805
247 H VAL 31 H VAL 31 13.059 -8.529 -0.078
248 HA VAL 31 HA VAL 31 15.420 -9.633 0.800
249 HB VAL 31 HB VAL 31 15.100 -8.409 -1.936
250 HG11 VAL 31 1HG1 VAL 31 16.631 -10.760 -0.858
251 HG12 VAL 31 2HG1 VAL 31 17.283 -9.272 -1.544
252 HG13 VAL 31 3HG1 VAL 31 16.431 -10.421 -2.576
253 HG21 VAL 31 3HG2 VAL 31 13.672 -10.686 -0.694
254 HG22 VAL 31 1HG2 VAL 31 14.280 -10.927 -2.332
255 HG23 VAL 31 2HG2 VAL 31 13.169 -9.601 -1.990
256 H VAL 32 H VAL 32 14.806 -6.352 -0.339
257 HA VAL 32 HA VAL 32 17.536 -5.532 -0.293
258 HB VAL 32 HB VAL 32 15.096 -3.760 -0.105
259 HG11 VAL 32 1HG1 VAL 32 16.748 -2.255 0.209
260 HG12 VAL 32 2HG1 VAL 32 16.912 -2.383 -1.541
261 HG13 VAL 32 3HG1 VAL 32 17.983 -3.304 -0.487
262 HG21 VAL 32 3HG2 VAL 32 14.546 -4.538 -2.123
263 HG22 VAL 32 1HG2 VAL 32 16.067 -5.415 -2.288
264 HG23 VAL 32 2HG2 VAL 32 15.982 -3.709 -2.725
265 H SER 33 H SER 33 14.958 -5.647 2.052
266 HA SER 33 HA SER 33 16.158 -3.900 3.955
267 HG SER 33 HG SER 33 13.319 -3.695 5.351
268 HB2 SER 33 2HB SER 33 13.677 -4.953 3.699
269 HB3 SER 33 1HB SER 33 14.335 -6.017 4.940
270 H PHE 34 H PHE 34 16.368 -7.323 3.267
271 HA PHE 34 HA PHE 34 17.587 -8.133 5.684
272 HD1 PHE 34 2HD PHE 34 15.982 -10.093 6.036
273 HD2 PHE 34 1HD PHE 34 19.540 -11.309 4.045
274 HE1 PHE 34 2HE PHE 34 16.213 -11.975 7.606
275 HE2 PHE 34 1HE PHE 34 19.777 -13.194 5.608
276 HZ PHE 34 HZ PHE 34 18.113 -13.529 7.392
277 HB2 PHE 34 2HB PHE 34 16.610 -9.466 3.556
278 HB3 PHE 34 1HB PHE 34 18.331 -9.554 3.191
279 H PHE 35 H PHE 35 18.823 -6.702 2.749
280 HA PHE 35 HA PHE 35 21.587 -7.119 3.549
281 HD1 PHE 35 2HD PHE 35 23.558 -5.498 2.431
282 HD2 PHE 35 1HD PHE 35 21.721 -8.348 -0.141
283 HE1 PHE 35 2HE PHE 35 25.779 -6.324 1.763
284 HE2 PHE 35 1HE PHE 35 23.938 -9.177 -0.814
285 HZ PHE 35 HZ PHE 35 25.970 -8.165 0.138
286 HB2 PHE 35 2HB PHE 35 20.392 -6.964 1.097
287 HB3 PHE 35 1HB PHE 35 21.047 -5.340 1.265
288 H ARG 36 H ARG 36 19.151 -4.650 3.619
289 HA ARG 36 HA ARG 36 20.715 -2.353 3.832
290 HE ARG 36 HE ARG 36 15.918 0.228 2.780
291 HB2 ARG 36 2HB ARG 36 17.965 -3.119 4.387
292 HB3 ARG 36 1HB ARG 36 18.549 -1.919 5.527
293 HG2 ARG 36 2HG ARG 36 19.410 -0.805 3.254
294 HG3 ARG 36 1HG ARG 36 18.009 -1.686 2.638
295 HD2 ARG 36 2HD ARG 36 17.535 -0.217 5.133
296 HD3 ARG 36 1HD ARG 36 17.927 0.800 3.747
297 HH11 ARG 36 1HH1 ARG 36 16.493 -1.808 5.558
298 HH12 ARG 36 2HH1 ARG 36 14.888 -2.455 5.569
299 HH21 ARG 36 1HH2 ARG 36 13.807 -0.622 2.799
300 HH22 ARG 36 2HH2 ARG 36 13.364 -1.784 4.004
301 HA PRO 37 HA PRO 37 22.533 -2.107 7.836
302 HB2 PRO 37 2HB PRO 37 20.702 0.036 8.747
303 HB3 PRO 37 1HB PRO 37 22.463 0.046 8.600
304 HG2 PRO 37 2HG PRO 37 20.929 1.384 6.872
305 HG3 PRO 37 1HG PRO 37 22.406 0.556 6.343
306 HD2 PRO 37 2HD PRO 37 19.549 -0.285 6.045
307 HD3 PRO 37 1HD PRO 37 20.895 -0.436 4.896
308 H LYS 38 H LYS 38 19.109 -2.519 7.678
309 HA LYS 38 HA LYS 38 17.634 -3.658 8.977
310 HB2 LYS 38 2HB LYS 38 20.098 -4.581 10.470
311 HB3 LYS 38 1HB LYS 38 18.491 -5.277 10.613
312 HG2 LYS 38 2HG LYS 38 18.567 -6.195 8.467
313 HG3 LYS 38 1HG LYS 38 19.918 -5.168 7.981
314 HD2 LYS 38 2HD LYS 38 21.415 -6.364 9.442
315 HD3 LYS 38 1HD LYS 38 20.079 -7.310 10.100
316 HE2 LYS 38 2HE LYS 38 20.830 -8.815 8.577
317 HE3 LYS 38 1HE LYS 38 19.755 -7.897 7.525
318 HZ1 LYS 38 3HZ LYS 38 22.326 -8.383 6.985
319 HZ2 LYS 38 1HZ LYS 38 22.453 -6.866 7.723
320 HZ3 LYS 38 2HZ LYS 38 21.468 -7.065 6.365
321 H LYS 39 H LYS 39 18.017 -0.983 9.534
322 HA LYS 39 HA LYS 39 16.832 -0.725 12.056
323 HB2 LYS 39 2HB LYS 39 19.477 -1.167 12.413
324 HB3 LYS 39 1HB LYS 39 19.474 0.586 12.267
325 HG2 LYS 39 2HG LYS 39 17.884 0.758 14.092
326 HG3 LYS 39 1HG LYS 39 17.815 -1.001 14.215
327 HD2 LYS 39 2HD LYS 39 19.532 -0.935 15.628
328 HD3 LYS 39 1HD LYS 39 20.539 -0.294 14.331
329 HE2 LYS 39 2HE LYS 39 19.765 1.987 14.925
330 HE3 LYS 39 1HE LYS 39 18.884 1.296 16.287
331 HZ1 LYS 39 3HZ LYS 39 21.302 2.240 16.559
332 HZ2 LYS 39 1HZ LYS 39 21.736 0.686 16.049
333 HZ3 LYS 39 2HZ LYS 39 20.787 0.888 17.436
334 H LYS 40 H LYS 40 18.830 0.816 9.600
335 HA LYS 40 HA LYS 40 17.455 3.362 10.027
336 HB2 LYS 40 2HB LYS 40 19.984 2.527 8.704
337 HB3 LYS 40 1HB LYS 40 19.161 3.938 8.050
338 HG2 LYS 40 2HG LYS 40 19.605 5.213 9.866
339 HG3 LYS 40 1HG LYS 40 19.538 3.849 10.982
340 HD2 LYS 40 2HD LYS 40 21.731 3.273 10.625
341 HD3 LYS 40 1HD LYS 40 21.757 3.959 9.000
342 HE2 LYS 40 2HE LYS 40 21.833 6.192 9.887
343 HE3 LYS 40 1HE LYS 40 21.615 5.590 11.530
344 HZ1 LYS 40 3HZ LYS 40 23.959 5.040 9.790
345 HZ2 LYS 40 1HZ LYS 40 23.751 4.479 11.375
346 HZ3 LYS 40 2HZ LYS 40 23.925 6.136 11.079
347 H LYS 41 H LYS 41 15.675 3.771 8.913
348 HA LYS 41 HA LYS 41 14.752 2.182 6.776
349 HB2 LYS 41 2HB LYS 41 13.903 4.883 7.815
350 HB3 LYS 41 1HB LYS 41 13.086 4.091 6.475
351 HG2 LYS 41 2HG LYS 41 13.432 2.806 9.170
352 HG3 LYS 41 1HG LYS 41 12.036 3.796 8.738
353 HD2 LYS 41 2HD LYS 41 12.634 1.763 6.742
354 HD3 LYS 41 1HD LYS 41 12.295 1.077 8.332
355 HE2 LYS 41 2HE LYS 41 10.123 1.616 8.229
356 HE3 LYS 41 1HE LYS 41 10.457 3.212 7.561
357 HZ1 LYS 41 3HZ LYS 41 10.484 0.683 6.003
358 HZ2 LYS 41 1HZ LYS 41 10.703 2.243 5.385
359 HZ3 LYS 41 2HZ LYS 41 9.206 1.791 6.029
360 H HIS 42 H HIS 42 14.441 2.730 4.566
361 HA HIS 42 HA HIS 42 15.118 3.458 2.522
362 HD1 HIS 42 1HD HIS 42 12.998 3.978 3.750
363 HD2 HIS 42 2HD HIS 42 13.715 7.788 2.253
364 HE1 HIS 42 1HE HIS 42 10.728 4.956 3.284
365 HE2 HIS 42 2HE HIS 42 11.185 7.294 2.463
366 HB2 HIS 42 2HB HIS 42 15.656 5.954 4.136
367 HB3 HIS 42 1HB HIS 42 15.850 5.882 2.387
Start of MODEL 9
1 H1 GLY 1 1H GLY 1 -17.602 5.375 9.649
2 H2 GLY 1 2H GLY 1 -17.092 6.307 8.334
3 H3 GLY 1 3H GLY 1 -17.731 4.759 8.080
4 HA2 GLY 1 1HA GLY 1 -19.814 5.729 9.266
5 HA3 GLY 1 2HA GLY 1 -19.117 7.261 8.762
6 H LYS 2 H LYS 2 -19.785 7.996 6.867
7 HA LYS 2 HA LYS 2 -20.665 8.101 4.773
8 HB2 LYS 2 2HB LYS 2 -19.536 5.305 4.542
9 HB3 LYS 2 1HB LYS 2 -20.089 6.294 3.197
10 HG2 LYS 2 2HG LYS 2 -17.889 7.166 5.046
11 HG3 LYS 2 1HG LYS 2 -17.596 6.207 3.595
12 HD2 LYS 2 2HD LYS 2 -17.455 8.162 2.517
13 HD3 LYS 2 1HD LYS 2 -19.209 8.247 2.685
14 HE2 LYS 2 2HE LYS 2 -18.394 10.304 3.495
15 HE3 LYS 2 1HE LYS 2 -18.800 9.357 4.925
16 HZ1 LYS 2 3HZ LYS 2 -16.396 8.712 4.999
17 HZ2 LYS 2 1HZ LYS 2 -16.707 10.346 5.317
18 HZ3 LYS 2 2HZ LYS 2 -16.104 9.876 3.807
19 H ILE 3 H ILE 3 -22.814 8.187 4.714
20 HA ILE 3 HA ILE 3 -24.565 6.353 5.851
21 HB ILE 3 HB ILE 3 -25.216 8.198 3.557
22 HG12 ILE 3 2HG1 ILE 3 -25.830 9.197 6.221
23 HG13 ILE 3 1HG1 ILE 3 -24.103 8.937 6.010
24 HG21 ILE 3 1HG2 ILE 3 -27.430 8.083 4.270
25 HG22 ILE 3 2HG2 ILE 3 -26.985 7.414 5.838
26 HG23 ILE 3 3HG2 ILE 3 -26.851 6.422 4.386
27 HD11 ILE 3 3HD1 ILE 3 -24.227 10.306 3.934
28 HD12 ILE 3 1HD1 ILE 3 -24.598 11.184 5.418
29 HD13 ILE 3 2HD1 ILE 3 -25.902 10.674 4.345
30 HA PRO 4 HA PRO 4 -25.310 4.601 1.372
31 HB2 PRO 4 2HB PRO 4 -23.249 4.958 -0.391
32 HB3 PRO 4 1HB PRO 4 -24.653 6.027 -0.294
33 HG2 PRO 4 2HG PRO 4 -21.922 6.375 0.882
34 HG3 PRO 4 1HG PRO 4 -22.950 7.567 0.067
35 HD2 PRO 4 2HD PRO 4 -22.731 7.470 2.743
36 HD3 PRO 4 1HD PRO 4 -24.253 7.912 1.945
37 H VAL 5 H VAL 5 -25.028 2.478 1.553
38 HA VAL 5 HA VAL 5 -22.949 1.252 2.929
39 HB VAL 5 HB VAL 5 -24.594 -0.127 0.817
40 HG11 VAL 5 1HG1 VAL 5 -23.054 -1.633 1.656
41 HG12 VAL 5 2HG1 VAL 5 -24.466 -1.921 2.673
42 HG13 VAL 5 3HG1 VAL 5 -23.124 -0.951 3.279
43 HG21 VAL 5 3HG2 VAL 5 -26.031 -0.558 3.038
44 HG22 VAL 5 1HG2 VAL 5 -26.367 0.762 1.917
45 HG23 VAL 5 2HG2 VAL 5 -25.443 1.067 3.387
46 H LYS 6 H LYS 6 -23.216 2.162 -0.419
47 HA LYS 6 HA LYS 6 -21.271 0.454 -1.511
48 HB2 LYS 6 2HB LYS 6 -22.761 1.655 -2.964
49 HB3 LYS 6 1HB LYS 6 -22.206 3.202 -2.341
50 HG2 LYS 6 2HG LYS 6 -20.257 1.370 -3.656
51 HG3 LYS 6 1HG LYS 6 -21.364 2.327 -4.643
52 HD2 LYS 6 2HD LYS 6 -20.437 4.177 -2.855
53 HD3 LYS 6 1HD LYS 6 -19.019 3.155 -3.095
54 HE2 LYS 6 2HE LYS 6 -19.486 3.406 -5.596
55 HE3 LYS 6 1HE LYS 6 -20.573 4.719 -5.139
56 HZ1 LYS 6 3HZ LYS 6 -17.656 4.594 -5.033
57 HZ2 LYS 6 1HZ LYS 6 -18.436 5.463 -3.807
58 HZ3 LYS 6 2HZ LYS 6 -18.670 5.890 -5.426
59 H ALA 7 H ALA 7 -21.032 3.576 0.090
60 HA ALA 7 HA ALA 7 -18.360 4.162 -0.488
61 HB1 ALA 7 3HB ALA 7 -20.265 4.966 1.650
62 HB2 ALA 7 1HB ALA 7 -19.421 5.953 0.458
63 HB3 ALA 7 2HB ALA 7 -18.555 5.339 1.866
64 H ILE 8 H ILE 8 -19.739 2.540 2.372
65 HA ILE 8 HA ILE 8 -17.263 1.908 3.559
66 HB ILE 8 HB ILE 8 -19.796 0.322 3.913
67 HG12 ILE 8 2HG1 ILE 8 -19.395 2.410 5.881
68 HG13 ILE 8 1HG1 ILE 8 -19.553 3.090 4.270
69 HG21 ILE 8 1HG2 ILE 8 -17.437 0.886 5.695
70 HG22 ILE 8 2HG2 ILE 8 -17.892 -0.659 4.979
71 HG23 ILE 8 3HG2 ILE 8 -18.910 0.071 6.223
72 HD11 ILE 8 3HD1 ILE 8 -21.574 1.234 4.362
73 HD12 ILE 8 1HD1 ILE 8 -21.741 2.973 4.606
74 HD13 ILE 8 2HD1 ILE 8 -21.555 1.903 5.995
75 H LYS 9 H LYS 9 -19.426 0.073 1.456
76 HA LYS 9 HA LYS 9 -18.119 -2.375 1.477
77 HB2 LYS 9 2HB LYS 9 -19.957 -0.978 -0.375
78 HB3 LYS 9 1HB LYS 9 -19.028 -2.300 -1.067
79 HG2 LYS 9 2HG LYS 9 -20.147 -3.073 1.468
80 HG3 LYS 9 1HG LYS 9 -21.402 -2.472 0.386
81 HD2 LYS 9 2HD LYS 9 -20.377 -4.006 -1.378
82 HD3 LYS 9 1HD LYS 9 -19.490 -4.750 -0.048
83 HE2 LYS 9 2HE LYS 9 -22.359 -4.432 0.447
84 HE3 LYS 9 1HE LYS 9 -21.972 -5.499 -0.902
85 HZ1 LYS 9 3HZ LYS 9 -22.129 -6.484 1.447
86 HZ2 LYS 9 1HZ LYS 9 -20.596 -5.808 1.687
87 HZ3 LYS 9 2HZ LYS 9 -20.833 -6.954 0.465
88 H GLN 10 H GLN 10 -17.371 0.562 -0.277
89 HA GLN 10 HA GLN 10 -15.490 -0.556 -2.073
90 HB2 GLN 10 2HB GLN 10 -16.651 1.913 -1.753
91 HB3 GLN 10 1HB GLN 10 -14.992 2.219 -1.256
92 HG2 GLN 10 2HG GLN 10 -15.595 0.799 -3.818
93 HG3 GLN 10 1HG GLN 10 -15.634 2.557 -3.718
94 HE21 GLN 10 1HE2 GLN 10 -13.913 2.060 -5.407
95 HE22 GLN 10 2HE2 GLN 10 -12.289 1.964 -4.831
96 H ALA 11 H ALA 11 -15.273 0.658 1.207
97 HA ALA 11 HA ALA 11 -12.451 0.784 1.361
98 HB1 ALA 11 3HB ALA 11 -13.311 1.950 3.100
99 HB2 ALA 11 1HB ALA 11 -13.125 0.403 3.926
100 HB3 ALA 11 2HB ALA 11 -14.698 0.874 3.277
101 H GLY 12 H GLY 12 -14.798 -1.754 2.038
102 HA2 GLY 12 2HA GLY 12 -12.987 -3.596 3.198
103 HA3 GLY 12 1HA GLY 12 -14.545 -3.994 2.487
104 H LYS 13 H LYS 13 -13.904 -2.919 -0.124
105 HA LYS 13 HA LYS 13 -12.734 -5.228 -1.274
106 HB2 LYS 13 2HB LYS 13 -14.057 -2.837 -2.186
107 HB3 LYS 13 1HB LYS 13 -12.627 -3.135 -3.166
108 HG2 LYS 13 2HG LYS 13 -14.254 -4.288 -4.310
109 HG3 LYS 13 1HG LYS 13 -13.540 -5.556 -3.314
110 HD2 LYS 13 2HD LYS 13 -15.392 -4.876 -1.610
111 HD3 LYS 13 1HD LYS 13 -16.176 -4.177 -3.027
112 HE2 LYS 13 2HE LYS 13 -16.534 -6.214 -4.008
113 HE3 LYS 13 1HE LYS 13 -15.148 -6.961 -3.216
114 HZ1 LYS 13 3HZ LYS 13 -16.347 -7.465 -1.383
115 HZ2 LYS 13 1HZ LYS 13 -17.627 -7.457 -2.491
116 HZ3 LYS 13 2HZ LYS 13 -17.351 -6.109 -1.505
117 H VAL 14 H VAL 14 -11.517 -1.994 -0.556
118 HA VAL 14 HA VAL 14 -9.083 -2.125 -1.899
119 HB VAL 14 HB VAL 14 -9.444 -0.751 0.756
120 HG11 VAL 14 1HG1 VAL 14 -8.031 0.437 -1.555
121 HG12 VAL 14 2HG1 VAL 14 -7.258 -0.917 -0.731
122 HG13 VAL 14 3HG1 VAL 14 -7.675 0.541 0.169
123 HG21 VAL 14 3HG2 VAL 14 -10.844 -0.266 -1.771
124 HG22 VAL 14 1HG2 VAL 14 -10.044 1.158 -1.103
125 HG23 VAL 14 2HG2 VAL 14 -11.230 0.277 -0.138
126 H ILE 15 H ILE 15 -10.129 -3.576 1.086
127 HA ILE 15 HA ILE 15 -7.655 -4.087 2.290
128 HB ILE 15 HB ILE 15 -10.120 -5.833 2.399
129 HG12 ILE 15 2HG1 ILE 15 -9.294 -3.525 4.176
130 HG13 ILE 15 1HG1 ILE 15 -10.601 -3.491 2.997
131 HG21 ILE 15 1HG2 ILE 15 -7.532 -5.853 3.804
132 HG22 ILE 15 2HG2 ILE 15 -8.666 -7.166 3.489
133 HG23 ILE 15 3HG2 ILE 15 -8.958 -6.052 4.823
134 HD11 ILE 15 3HD1 ILE 15 -11.480 -3.785 5.224
135 HD12 ILE 15 1HD1 ILE 15 -10.465 -5.208 5.463
136 HD13 ILE 15 2HD1 ILE 15 -11.760 -5.240 4.267
137 H GLY 16 H GLY 16 -9.492 -5.926 -0.118
138 HA2 GLY 16 2HA GLY 16 -7.735 -8.157 -0.182
139 HA3 GLY 16 1HA GLY 16 -8.908 -7.731 -1.418
140 H LYS 17 H LYS 17 -8.086 -5.383 -2.392
141 HA LYS 17 HA LYS 17 -5.961 -6.057 -4.086
142 HB2 LYS 17 2HB LYS 17 -7.802 -4.257 -4.366
143 HB3 LYS 17 1HB LYS 17 -6.709 -3.211 -3.468
144 HG2 LYS 17 2HG LYS 17 -5.557 -2.780 -5.304
145 HG3 LYS 17 1HG LYS 17 -5.250 -4.500 -5.553
146 HD2 LYS 17 2HD LYS 17 -6.363 -3.936 -7.496
147 HD3 LYS 17 1HD LYS 17 -7.687 -4.514 -6.482
148 HE2 LYS 17 2HE LYS 17 -6.930 -1.613 -6.561
149 HE3 LYS 17 1HE LYS 17 -8.006 -2.310 -7.771
150 HZ1 LYS 17 3HZ LYS 17 -8.453 -2.333 -4.833
151 HZ2 LYS 17 1HZ LYS 17 -9.486 -3.012 -5.989
152 HZ3 LYS 17 2HZ LYS 17 -9.248 -1.338 -5.947
153 H GLY 18 H GLY 18 -6.061 -4.265 -1.067
154 HA2 GLY 18 2HA GLY 18 -3.369 -3.347 -1.155
155 HA3 GLY 18 1HA GLY 18 -4.389 -3.429 0.276
156 H LEU 19 H LEU 19 -4.924 -6.248 0.087
157 HA LEU 19 HA LEU 19 -2.664 -7.230 1.499
158 HG LEU 19 HG LEU 19 -2.996 -9.269 2.614
159 HB2 LEU 19 2HB LEU 19 -5.102 -7.933 1.754
160 HB3 LEU 19 1HB LEU 19 -4.865 -8.907 0.315
161 HD11 LEU 19 1HD1 LEU 19 -5.627 -9.326 3.164
162 HD12 LEU 19 2HD1 LEU 19 -4.441 -10.373 3.944
163 HD13 LEU 19 3HD1 LEU 19 -5.395 -10.978 2.590
164 HD21 LEU 19 3HD2 LEU 19 -2.533 -10.426 0.539
165 HD22 LEU 19 1HD2 LEU 19 -4.159 -11.107 0.526
166 HD23 LEU 19 2HD2 LEU 19 -3.015 -11.583 1.778
167 H ARG 20 H ARG 20 -3.908 -7.711 -1.773
168 HA ARG 20 HA ARG 20 -1.991 -9.672 -2.520
169 HE ARG 20 HE ARG 20 -1.446 -11.136 -7.333
170 HB2 ARG 20 2HB ARG 20 -4.293 -8.864 -3.621
171 HB3 ARG 20 1HB ARG 20 -3.183 -7.905 -4.591
172 HG2 ARG 20 2HG ARG 20 -2.411 -10.712 -4.319
173 HG3 ARG 20 1HG ARG 20 -3.950 -10.456 -5.143
174 HD2 ARG 20 2HD ARG 20 -2.725 -8.729 -6.552
175 HD3 ARG 20 1HD ARG 20 -1.237 -9.395 -5.883
176 HH11 ARG 20 1HH1 ARG 20 -4.601 -9.715 -6.881
177 HH12 ARG 20 2HH1 ARG 20 -5.366 -10.738 -8.050
178 HH21 ARG 20 1HH2 ARG 20 -2.453 -12.482 -8.871
179 HH22 ARG 20 2HH2 ARG 20 -4.148 -12.309 -9.180
180 H ALA 21 H ALA 21 -2.019 -6.191 -2.466
181 HA ALA 21 HA ALA 21 0.232 -5.829 -4.188
182 HB1 ALA 21 3HB ALA 21 -1.313 -4.018 -3.956
183 HB2 ALA 21 1HB ALA 21 0.227 -3.507 -3.262
184 HB3 ALA 21 2HB ALA 21 -1.097 -3.992 -2.204
185 H ILE 22 H ILE 22 -0.236 -5.985 -0.694
186 HA ILE 22 HA ILE 22 2.429 -5.369 0.023
187 HB ILE 22 HB ILE 22 0.436 -7.027 1.579
188 HG12 ILE 22 2HG1 ILE 22 0.914 -4.171 2.224
189 HG13 ILE 22 1HG1 ILE 22 -0.007 -4.497 0.760
190 HG21 ILE 22 1HG2 ILE 22 2.284 -7.357 2.834
191 HG22 ILE 22 2HG2 ILE 22 1.904 -5.740 3.431
192 HG23 ILE 22 3HG2 ILE 22 3.117 -5.952 2.168
193 HD11 ILE 22 3HD1 ILE 22 -1.251 -6.137 2.508
194 HD12 ILE 22 1HD1 ILE 22 -1.749 -4.481 2.163
195 HD13 ILE 22 2HD1 ILE 22 -0.750 -4.825 3.576
196 H ASN 23 H ASN 23 0.819 -8.322 -0.924
197 HA ASN 23 HA ASN 23 2.763 -10.157 -0.028
198 HB2 ASN 23 2HB ASN 23 0.302 -10.399 -1.149
199 HB3 ASN 23 1HB ASN 23 1.319 -10.821 -2.523
200 HD21 ASN 23 1HD2 ASN 23 3.125 -12.394 -1.935
201 HD22 ASN 23 2HD2 ASN 23 2.667 -13.733 -0.944
202 H ILE 24 H ILE 24 2.413 -8.303 -3.000
203 HA ILE 24 HA ILE 24 4.741 -9.539 -4.209
204 HB ILE 24 HB ILE 24 3.228 -7.125 -5.202
205 HG12 ILE 24 2HG1 ILE 24 2.751 -9.980 -6.055
206 HG13 ILE 24 1HG1 ILE 24 1.809 -9.211 -4.782
207 HG21 ILE 24 1HG2 ILE 24 5.139 -7.210 -6.468
208 HG22 ILE 24 2HG2 ILE 24 4.076 -8.250 -7.415
209 HG23 ILE 24 3HG2 ILE 24 5.278 -8.962 -6.339
210 HD11 ILE 24 3HD1 ILE 24 1.021 -7.538 -6.338
211 HD12 ILE 24 1HD1 ILE 24 0.682 -9.156 -6.954
212 HD13 ILE 24 2HD1 ILE 24 2.025 -8.225 -7.616
213 H ALA 25 H ALA 25 3.903 -6.603 -2.504
214 HA ALA 25 HA ALA 25 6.324 -5.210 -3.140
215 HB1 ALA 25 3HB ALA 25 4.043 -4.237 -2.413
216 HB2 ALA 25 1HB ALA 25 5.520 -3.479 -1.821
217 HB3 ALA 25 2HB ALA 25 4.607 -4.565 -0.773
218 H GLY 26 H GLY 26 5.267 -7.392 -0.624
219 HA2 GLY 26 2HA GLY 26 7.180 -6.863 1.342
220 HA3 GLY 26 1HA GLY 26 6.410 -8.422 1.081
221 H THR 27 H THR 27 7.428 -8.740 -1.614
222 HA THR 27 HA THR 27 9.939 -9.935 -0.968
223 HB THR 27 HB THR 27 9.104 -9.531 -3.804
224 HG1 THR 27 1HG THR 27 7.340 -10.674 -3.619
225 HG21 THR 27 3HG2 THR 27 10.695 -11.069 -3.999
226 HG22 THR 27 1HG2 THR 27 9.495 -12.203 -3.381
227 HG23 THR 27 2HG2 THR 27 10.658 -11.460 -2.282
228 H THR 28 H THR 28 8.960 -7.161 -2.958
229 HA THR 28 HA THR 28 11.531 -6.456 -3.842
230 HB THR 28 HB THR 28 9.574 -4.277 -3.375
231 HG1 THR 28 1HG THR 28 7.979 -5.257 -4.281
232 HG21 THR 28 3HG2 THR 28 11.446 -3.787 -4.768
233 HG22 THR 28 1HG2 THR 28 10.002 -3.857 -5.779
234 HG23 THR 28 2HG2 THR 28 11.136 -5.208 -5.767
235 H HIS 29 H HIS 29 9.741 -5.670 -0.925
236 HA HIS 29 HA HIS 29 11.398 -3.618 0.038
237 HD1 HIS 29 1HD HIS 29 11.790 -2.435 1.625
238 HD2 HIS 29 2HD HIS 29 7.943 -3.217 2.987
239 HE1 HIS 29 1HE HIS 29 11.117 -0.401 2.942
240 HE2 HIS 29 2HE HIS 29 8.753 -0.862 3.684
241 HB2 HIS 29 2HB HIS 29 9.074 -4.807 0.883
242 HB3 HIS 29 1HB HIS 29 10.228 -5.359 2.095
243 H ASP 30 H ASP 30 11.681 -7.095 0.115
244 HA ASP 30 HA ASP 30 13.696 -7.251 2.109
245 HB2 ASP 30 2HB ASP 30 12.162 -9.059 0.642
246 HB3 ASP 30 1HB ASP 30 13.814 -9.375 0.128
247 H VAL 31 H VAL 31 13.841 -7.459 -1.442
248 HA VAL 31 HA VAL 31 16.552 -7.694 -1.794
249 HB VAL 31 HB VAL 31 14.844 -5.960 -3.567
250 HG11 VAL 31 1HG1 VAL 31 16.279 -6.813 -5.325
251 HG12 VAL 31 2HG1 VAL 31 17.131 -7.825 -4.157
252 HG13 VAL 31 3HG1 VAL 31 17.244 -6.069 -4.049
253 HG21 VAL 31 3HG2 VAL 31 14.813 -8.932 -3.204
254 HG22 VAL 31 1HG2 VAL 31 14.452 -8.218 -4.775
255 HG23 VAL 31 2HG2 VAL 31 13.461 -7.814 -3.373
256 H VAL 32 H VAL 32 14.668 -4.765 -1.249
257 HA VAL 32 HA VAL 32 16.791 -2.934 -1.659
258 HB VAL 32 HB VAL 32 14.331 -2.532 0.047
259 HG11 VAL 32 1HG1 VAL 32 14.828 -0.125 -0.990
260 HG12 VAL 32 2HG1 VAL 32 16.475 -0.756 -0.963
261 HG13 VAL 32 3HG1 VAL 32 15.540 -0.671 0.529
262 HG21 VAL 32 3HG2 VAL 32 14.620 -2.855 -2.816
263 HG22 VAL 32 1HG2 VAL 32 13.939 -1.282 -2.404
264 HG23 VAL 32 2HG2 VAL 32 13.159 -2.758 -1.832
265 H SER 33 H SER 33 15.686 -4.767 1.107
266 HA SER 33 HA SER 33 17.259 -3.324 3.022
267 HG SER 33 HG SER 33 15.716 -3.701 4.962
268 HB2 SER 33 2HB SER 33 15.124 -4.965 3.265
269 HB3 SER 33 1HB SER 33 16.422 -6.097 3.648
270 H PHE 34 H PHE 34 17.701 -6.135 0.997
271 HA PHE 34 HA PHE 34 20.069 -7.058 2.325
272 HD1 PHE 34 1HD PHE 34 21.390 -9.258 1.839
273 HD2 PHE 34 2HD PHE 34 17.218 -9.551 1.057
274 HE1 PHE 34 1HE PHE 34 21.289 -11.315 3.185
275 HE2 PHE 34 2HE PHE 34 17.107 -11.608 2.404
276 HZ PHE 34 HZ PHE 34 19.144 -12.493 3.469
277 HB2 PHE 34 2HB PHE 34 18.423 -7.883 0.050
278 HB3 PHE 34 1HB PHE 34 20.143 -8.142 -0.213
279 H PHE 35 H PHE 35 19.348 -4.959 -0.392
280 HA PHE 35 HA PHE 35 22.117 -4.745 -1.192
281 HD1 PHE 35 2HD PHE 35 21.921 -1.392 -2.108
282 HD2 PHE 35 1HD PHE 35 21.427 -4.772 -4.646
283 HE1 PHE 35 2HE PHE 35 23.527 -0.425 -3.702
284 HE2 PHE 35 1HE PHE 35 23.034 -3.812 -6.244
285 HZ PHE 35 HZ PHE 35 24.086 -1.636 -5.774
286 HB2 PHE 35 2HB PHE 35 20.123 -4.589 -2.766
287 HB3 PHE 35 1HB PHE 35 19.833 -2.990 -2.090
288 H ARG 36 H ARG 36 19.687 -2.540 0.199
289 HA ARG 36 HA ARG 36 19.883 -0.677 1.484
290 HE ARG 36 HE ARG 36 21.567 0.259 6.467
291 HB2 ARG 36 2HB ARG 36 21.202 -2.264 2.904
292 HB3 ARG 36 1HB ARG 36 22.659 -1.685 2.109
293 HG2 ARG 36 2HG ARG 36 22.786 -0.188 3.746
294 HG3 ARG 36 1HG ARG 36 21.446 0.637 2.948
295 HD2 ARG 36 2HD ARG 36 20.134 0.245 4.694
296 HD3 ARG 36 1HD ARG 36 20.403 -1.491 4.537
297 HH11 ARG 36 1HH1 ARG 36 22.122 -2.653 4.626
298 HH12 ARG 36 2HH1 ARG 36 23.235 -3.316 5.774
299 HH21 ARG 36 1HH2 ARG 36 23.032 -0.612 7.978
300 HH22 ARG 36 2HH2 ARG 36 23.752 -2.159 7.676
301 HA PRO 37 HA PRO 37 21.869 1.910 -1.628
302 HB2 PRO 37 2HB PRO 37 20.714 4.242 -0.834
303 HB3 PRO 37 1HB PRO 37 19.883 3.043 -1.830
304 HG2 PRO 37 2HG PRO 37 19.701 3.509 1.122
305 HG3 PRO 37 1HG PRO 37 18.401 3.187 -0.042
306 HD2 PRO 37 2HD PRO 37 19.397 1.267 1.576
307 HD3 PRO 37 1HD PRO 37 18.812 0.916 -0.063
308 H LYS 38 H LYS 38 23.895 2.599 -1.441
309 HA LYS 38 HA LYS 38 25.143 3.142 1.028
310 HB2 LYS 38 2HB LYS 38 25.912 3.274 -1.834
311 HB3 LYS 38 1HB LYS 38 26.874 4.235 -0.718
312 HG2 LYS 38 2HG LYS 38 26.350 1.426 0.043
313 HG3 LYS 38 1HG LYS 38 27.447 1.708 -1.313
314 HD2 LYS 38 2HD LYS 38 28.690 1.575 0.773
315 HD3 LYS 38 1HD LYS 38 28.787 3.204 0.102
316 HE2 LYS 38 2HE LYS 38 28.412 3.394 2.454
317 HE3 LYS 38 1HE LYS 38 26.931 3.867 1.625
318 HZ1 LYS 38 3HZ LYS 38 26.033 1.660 2.062
319 HZ2 LYS 38 1HZ LYS 38 26.453 2.442 3.503
320 HZ3 LYS 38 2HZ LYS 38 27.449 1.225 2.879
321 H LYS 39 H LYS 39 24.769 5.403 -1.704
322 HA LYS 39 HA LYS 39 24.968 7.652 0.110
323 HB2 LYS 39 2HB LYS 39 24.985 9.025 -1.899
324 HB3 LYS 39 1HB LYS 39 26.124 7.697 -2.066
325 HG2 LYS 39 2HG LYS 39 23.732 6.731 -3.118
326 HG3 LYS 39 1HG LYS 39 23.857 8.393 -3.699
327 HD2 LYS 39 2HD LYS 39 25.152 7.514 -5.309
328 HD3 LYS 39 1HD LYS 39 26.402 7.477 -4.065
329 HE2 LYS 39 2HE LYS 39 24.574 5.176 -4.069
330 HE3 LYS 39 1HE LYS 39 25.591 5.322 -5.502
331 HZ1 LYS 39 3HZ LYS 39 26.527 3.996 -3.596
332 HZ2 LYS 39 1HZ LYS 39 26.691 5.457 -2.755
333 HZ3 LYS 39 2HZ LYS 39 27.529 5.214 -4.204
334 H LYS 40 H LYS 40 23.362 9.057 0.653
335 HA LYS 40 HA LYS 40 20.653 8.123 0.315
336 HB2 LYS 40 2HB LYS 40 22.026 10.187 1.952
337 HB3 LYS 40 1HB LYS 40 20.327 10.459 1.595
338 HG2 LYS 40 2HG LYS 40 21.150 7.793 2.627
339 HG3 LYS 40 1HG LYS 40 21.085 9.158 3.745
340 HD2 LYS 40 2HD LYS 40 18.767 8.759 1.937
341 HD3 LYS 40 1HD LYS 40 18.975 7.607 3.257
342 HE2 LYS 40 2HE LYS 40 17.661 9.222 4.247
343 HE3 LYS 40 1HE LYS 40 19.280 9.739 4.712
344 HZ1 LYS 40 3HZ LYS 40 17.907 10.799 2.312
345 HZ2 LYS 40 1HZ LYS 40 19.264 11.430 3.100
346 HZ3 LYS 40 2HZ LYS 40 17.743 11.515 3.837
347 H LYS 41 H LYS 41 20.162 8.384 -1.856
348 HA LYS 41 HA LYS 41 19.591 11.136 -2.644
349 HB2 LYS 41 2HB LYS 41 21.837 10.397 -3.590
350 HB3 LYS 41 1HB LYS 41 20.939 9.239 -4.562
351 HG2 LYS 41 2HG LYS 41 19.678 11.720 -4.937
352 HG3 LYS 41 1HG LYS 41 21.414 12.021 -5.032
353 HD2 LYS 41 2HD LYS 41 21.178 9.742 -6.503
354 HD3 LYS 41 1HD LYS 41 19.646 10.544 -6.855
355 HE2 LYS 41 2HE LYS 41 21.004 11.427 -8.490
356 HE3 LYS 41 1HE LYS 41 21.161 12.640 -7.221
357 HZ1 LYS 41 3HZ LYS 41 23.072 10.454 -7.139
358 HZ2 LYS 41 1HZ LYS 41 23.303 12.105 -6.852
359 HZ3 LYS 41 2HZ LYS 41 23.236 11.523 -8.440
360 H HIS 42 H HIS 42 17.687 11.347 -3.675
361 HA HIS 42 HA HIS 42 16.394 8.920 -4.715
362 HD1 HIS 42 1HD HIS 42 12.516 9.337 -3.922
363 HD2 HIS 42 2HD HIS 42 15.768 7.298 -2.331
364 HE1 HIS 42 1HE HIS 42 11.684 7.012 -3.447
365 HE2 HIS 42 2HE HIS 42 13.692 5.771 -2.564
366 HB2 HIS 42 2HB HIS 42 15.615 10.289 -2.403
367 HB3 HIS 42 1HB HIS 42 14.475 10.813 -3.639
Start of MODEL 10
1 H1 GLY 1 1H GLY 1 -35.870 3.418 -2.438
2 H2 GLY 1 2H GLY 1 -36.197 4.526 -1.202
3 H3 GLY 1 3H GLY 1 -36.751 2.933 -1.076
4 HA2 GLY 1 1HA GLY 1 -34.609 3.712 0.185
5 HA3 GLY 1 2HA GLY 1 -34.746 2.092 -0.484
6 H LYS 2 H LYS 2 -32.270 3.007 -0.047
7 HA LYS 2 HA LYS 2 -31.285 3.558 -2.766
8 HB2 LYS 2 2HB LYS 2 -29.926 4.606 -0.290
9 HB3 LYS 2 1HB LYS 2 -29.628 5.053 -1.963
10 HG2 LYS 2 2HG LYS 2 -30.860 6.849 -1.406
11 HG3 LYS 2 1HG LYS 2 -32.206 5.765 -1.759
12 HD2 LYS 2 2HD LYS 2 -32.254 5.138 0.650
13 HD3 LYS 2 1HD LYS 2 -31.021 6.367 0.948
14 HE2 LYS 2 2HE LYS 2 -33.039 7.432 1.464
15 HE3 LYS 2 1HE LYS 2 -32.640 8.004 -0.156
16 HZ1 LYS 2 3HZ LYS 2 -34.206 6.486 -1.094
17 HZ2 LYS 2 1HZ LYS 2 -34.994 7.349 0.130
18 HZ3 LYS 2 2HZ LYS 2 -34.496 5.755 0.403
19 H ILE 3 H ILE 3 -29.733 2.214 -3.475
20 HA ILE 3 HA ILE 3 -28.690 0.230 -1.597
21 HB ILE 3 HB ILE 3 -28.842 0.144 -4.611
22 HG12 ILE 3 2HG1 ILE 3 -30.473 -1.847 -3.684
23 HG13 ILE 3 1HG1 ILE 3 -30.734 -0.591 -2.476
24 HG21 ILE 3 1HG2 ILE 3 -27.645 -1.722 -4.575
25 HG22 ILE 3 2HG2 ILE 3 -28.538 -2.368 -3.200
26 HG23 ILE 3 3HG2 ILE 3 -27.188 -1.269 -2.936
27 HD11 ILE 3 3HD1 ILE 3 -31.866 0.716 -3.901
28 HD12 ILE 3 1HD1 ILE 3 -32.108 -0.793 -4.780
29 HD13 ILE 3 2HD1 ILE 3 -30.824 0.315 -5.266
30 HA PRO 4 HA PRO 4 -25.038 2.936 -2.646
31 HB2 PRO 4 2HB PRO 4 -24.001 2.968 -0.139
32 HB3 PRO 4 1HB PRO 4 -25.241 4.106 -0.677
33 HG2 PRO 4 2HG PRO 4 -25.544 1.591 0.921
34 HG3 PRO 4 1HG PRO 4 -26.303 3.173 1.175
35 HD2 PRO 4 2HD PRO 4 -27.601 1.119 -0.012
36 HD3 PRO 4 1HD PRO 4 -27.892 2.813 -0.458
37 H VAL 5 H VAL 5 -24.912 0.507 -3.604
38 HA VAL 5 HA VAL 5 -23.388 -1.410 -2.258
39 HB VAL 5 HB VAL 5 -23.385 -0.990 -5.242
40 HG11 VAL 5 1HG1 VAL 5 -23.476 -3.626 -4.895
41 HG12 VAL 5 2HG1 VAL 5 -22.679 -3.178 -3.386
42 HG13 VAL 5 3HG1 VAL 5 -21.962 -2.723 -4.931
43 HG21 VAL 5 3HG2 VAL 5 -25.510 -2.161 -3.469
44 HG22 VAL 5 1HG2 VAL 5 -25.359 -2.602 -5.169
45 HG23 VAL 5 2HG2 VAL 5 -25.676 -0.929 -4.719
46 H LYS 6 H LYS 6 -22.464 1.309 -4.295
47 HA LYS 6 HA LYS 6 -19.747 0.699 -4.587
48 HB2 LYS 6 2HB LYS 6 -21.133 3.384 -4.506
49 HB3 LYS 6 1HB LYS 6 -19.464 3.146 -5.003
50 HG2 LYS 6 2HG LYS 6 -20.131 1.872 -6.902
51 HG3 LYS 6 1HG LYS 6 -21.806 1.822 -6.347
52 HD2 LYS 6 2HD LYS 6 -22.254 3.902 -7.099
53 HD3 LYS 6 1HD LYS 6 -20.660 4.516 -6.654
54 HE2 LYS 6 2HE LYS 6 -19.675 3.540 -8.616
55 HE3 LYS 6 1HE LYS 6 -21.189 2.731 -9.023
56 HZ1 LYS 6 3HZ LYS 6 -21.327 5.619 -8.734
57 HZ2 LYS 6 1HZ LYS 6 -22.064 4.606 -9.873
58 HZ3 LYS 6 2HZ LYS 6 -20.446 5.057 -10.065
59 H ALA 7 H ALA 7 -21.508 2.303 -2.011
60 HA ALA 7 HA ALA 7 -19.337 3.343 -0.578
61 HB1 ALA 7 3HB ALA 7 -20.821 3.701 1.177
62 HB2 ALA 7 1HB ALA 7 -21.785 2.279 0.782
63 HB3 ALA 7 2HB ALA 7 -21.865 3.712 -0.243
64 H ILE 8 H ILE 8 -21.023 0.226 -0.243
65 HA ILE 8 HA ILE 8 -19.321 -0.758 1.800
66 HB ILE 8 HB ILE 8 -20.895 -2.473 -0.106
67 HG12 ILE 8 2HG1 ILE 8 -22.253 -1.791 2.383
68 HG13 ILE 8 1HG1 ILE 8 -21.980 -0.380 1.369
69 HG21 ILE 8 1HG2 ILE 8 -21.073 -3.964 1.817
70 HG22 ILE 8 2HG2 ILE 8 -20.149 -2.822 2.792
71 HG23 ILE 8 3HG2 ILE 8 -19.387 -3.628 1.423
72 HD11 ILE 8 3HD1 ILE 8 -22.920 -2.121 -0.459
73 HD12 ILE 8 1HD1 ILE 8 -23.926 -0.993 0.451
74 HD13 ILE 8 2HD1 ILE 8 -23.774 -2.668 0.985
75 H LYS 9 H LYS 9 -19.449 -1.272 -1.696
76 HA LYS 9 HA LYS 9 -17.368 -3.132 -1.887
77 HB2 LYS 9 2HB LYS 9 -19.096 -1.956 -3.657
78 HB3 LYS 9 1HB LYS 9 -17.560 -1.242 -4.131
79 HG2 LYS 9 2HG LYS 9 -16.704 -3.692 -4.089
80 HG3 LYS 9 1HG LYS 9 -18.417 -4.102 -4.192
81 HD2 LYS 9 2HD LYS 9 -18.085 -3.937 -6.412
82 HD3 LYS 9 1HD LYS 9 -18.217 -2.203 -6.122
83 HE2 LYS 9 2HE LYS 9 -15.702 -2.238 -5.735
84 HE3 LYS 9 1HE LYS 9 -15.728 -3.859 -6.422
85 HZ1 LYS 9 3HZ LYS 9 -16.221 -1.282 -7.729
86 HZ2 LYS 9 1HZ LYS 9 -17.013 -2.652 -8.325
87 HZ3 LYS 9 2HZ LYS 9 -15.324 -2.609 -8.271
88 H GLN 10 H GLN 10 -17.334 0.375 -1.758
89 HA GLN 10 HA GLN 10 -14.623 0.732 -2.477
90 HB2 GLN 10 2HB GLN 10 -16.455 2.497 -2.407
91 HB3 GLN 10 1HB GLN 10 -16.211 2.549 -0.667
92 HG2 GLN 10 2HG GLN 10 -14.367 3.783 -0.848
93 HG3 GLN 10 1HG GLN 10 -13.734 2.809 -2.174
94 HE21 GLN 10 1HE2 GLN 10 -14.474 5.822 -1.426
95 HE22 GLN 10 2HE2 GLN 10 -15.015 6.425 -2.953
96 H ALA 11 H ALA 11 -16.248 0.202 0.599
97 HA ALA 11 HA ALA 11 -13.990 0.671 2.247
98 HB1 ALA 11 3HB ALA 11 -15.407 -0.858 3.847
99 HB2 ALA 11 1HB ALA 11 -16.654 -0.610 2.624
100 HB3 ALA 11 2HB ALA 11 -15.940 0.776 3.452
101 H GLY 12 H GLY 12 -15.273 -2.179 0.638
102 HA2 GLY 12 2HA GLY 12 -13.623 -4.091 1.913
103 HA3 GLY 12 1HA GLY 12 -14.420 -4.295 0.359
104 H LYS 13 H LYS 13 -13.093 -1.921 -0.774
105 HA LYS 13 HA LYS 13 -10.807 -3.215 -1.836
106 HB2 LYS 13 2HB LYS 13 -12.375 -1.000 -2.500
107 HB3 LYS 13 1HB LYS 13 -10.777 -0.336 -2.194
108 HG2 LYS 13 2HG LYS 13 -10.945 -0.839 -4.516
109 HG3 LYS 13 1HG LYS 13 -9.844 -2.007 -3.781
110 HD2 LYS 13 2HD LYS 13 -11.085 -3.610 -4.711
111 HD3 LYS 13 1HD LYS 13 -12.354 -3.184 -3.560
112 HE2 LYS 13 2HE LYS 13 -13.607 -2.770 -5.368
113 HE3 LYS 13 1HE LYS 13 -12.669 -1.285 -5.510
114 HZ1 LYS 13 3HZ LYS 13 -12.550 -3.716 -7.104
115 HZ2 LYS 13 1HZ LYS 13 -11.067 -2.969 -6.776
116 HZ3 LYS 13 2HZ LYS 13 -12.292 -2.107 -7.560
117 H VAL 14 H VAL 14 -11.214 -0.564 0.492
118 HA VAL 14 HA VAL 14 -8.511 0.025 0.870
119 HB VAL 14 HB VAL 14 -10.606 0.229 3.023
120 HG11 VAL 14 1HG1 VAL 14 -9.299 1.948 3.901
121 HG12 VAL 14 2HG1 VAL 14 -8.396 2.149 2.401
122 HG13 VAL 14 3HG1 VAL 14 -8.130 0.726 3.406
123 HG21 VAL 14 3HG2 VAL 14 -10.434 2.673 1.634
124 HG22 VAL 14 1HG2 VAL 14 -11.817 1.585 1.743
125 HG23 VAL 14 2HG2 VAL 14 -10.668 1.419 0.418
126 H ILE 15 H ILE 15 -10.610 -2.368 2.368
127 HA ILE 15 HA ILE 15 -8.721 -3.181 4.351
128 HB ILE 15 HB ILE 15 -11.066 -4.763 3.296
129 HG12 ILE 15 2HG1 ILE 15 -11.091 -2.987 5.729
130 HG13 ILE 15 1HG1 ILE 15 -11.538 -2.376 4.139
131 HG21 ILE 15 1HG2 ILE 15 -9.854 -6.242 4.585
132 HG22 ILE 15 2HG2 ILE 15 -10.954 -5.548 5.778
133 HG23 ILE 15 3HG2 ILE 15 -9.286 -4.984 5.683
134 HD11 ILE 15 3HD1 ILE 15 -13.258 -4.190 4.032
135 HD12 ILE 15 1HD1 ILE 15 -13.535 -2.962 5.267
136 HD13 ILE 15 2HD1 ILE 15 -12.891 -4.540 5.721
137 H GLY 16 H GLY 16 -9.459 -4.146 1.068
138 HA2 GLY 16 2HA GLY 16 -7.847 -6.538 1.184
139 HA3 GLY 16 1HA GLY 16 -8.607 -5.859 -0.247
140 H LYS 17 H LYS 17 -7.430 -3.220 0.090
141 HA LYS 17 HA LYS 17 -5.097 -3.556 -1.413
142 HB2 LYS 17 2HB LYS 17 -6.500 -1.475 -1.285
143 HB3 LYS 17 1HB LYS 17 -5.779 -1.154 0.287
144 HG2 LYS 17 2HG LYS 17 -3.966 -1.604 -2.022
145 HG3 LYS 17 1HG LYS 17 -4.831 -0.071 -1.915
146 HD2 LYS 17 2HD LYS 17 -3.587 0.648 -0.186
147 HD3 LYS 17 1HD LYS 17 -3.588 -0.934 0.596
148 HE2 LYS 17 2HE LYS 17 -1.331 -0.283 -0.055
149 HE3 LYS 17 1HE LYS 17 -1.863 -1.707 -0.950
150 HZ1 LYS 17 3HZ LYS 17 -0.706 0.092 -2.263
151 HZ2 LYS 17 1HZ LYS 17 -2.099 1.028 -2.058
152 HZ3 LYS 17 2HZ LYS 17 -2.183 -0.445 -2.884
153 H GLY 18 H GLY 18 -5.599 -3.253 2.044
154 HA2 GLY 18 2HA GLY 18 -2.860 -2.899 2.735
155 HA3 GLY 18 1HA GLY 18 -4.145 -3.400 3.825
156 H LEU 19 H LEU 19 -4.935 -5.729 2.369
157 HA LEU 19 HA LEU 19 -3.081 -7.592 3.439
158 HG LEU 19 HG LEU 19 -5.881 -9.873 3.370
159 HB2 LEU 19 2HB LEU 19 -5.709 -7.640 2.343
160 HB3 LEU 19 1HB LEU 19 -4.755 -8.847 1.500
161 HD11 LEU 19 1HD1 LEU 19 -3.954 -11.046 3.172
162 HD12 LEU 19 2HD1 LEU 19 -3.674 -10.374 4.779
163 HD13 LEU 19 3HD1 LEU 19 -2.935 -9.619 3.368
164 HD21 LEU 19 3HD2 LEU 19 -4.414 -7.955 5.169
165 HD22 LEU 19 1HD2 LEU 19 -5.601 -9.174 5.636
166 HD23 LEU 19 2HD2 LEU 19 -6.104 -7.769 4.695
167 H ARG 20 H ARG 20 -3.661 -6.297 0.228
168 HA ARG 20 HA ARG 20 -1.916 -8.114 -1.118
169 HE ARG 20 HE ARG 20 -2.487 -8.707 -5.494
170 HB2 ARG 20 2HB ARG 20 -3.763 -6.117 -1.862
171 HB3 ARG 20 1HB ARG 20 -2.213 -5.614 -2.521
172 HG2 ARG 20 2HG ARG 20 -2.277 -8.267 -3.171
173 HG3 ARG 20 1HG ARG 20 -3.973 -7.803 -3.314
174 HD2 ARG 20 2HD ARG 20 -3.549 -6.276 -4.994
175 HD3 ARG 20 1HD ARG 20 -1.860 -6.074 -4.525
176 HH11 ARG 20 1HH1 ARG 20 -1.551 -5.471 -6.406
177 HH12 ARG 20 2HH1 ARG 20 -0.829 -5.967 -7.901
178 HH21 ARG 20 1HH2 ARG 20 -1.539 -9.361 -7.458
179 HH22 ARG 20 2HH2 ARG 20 -0.824 -8.174 -8.498
180 H ALA 21 H ALA 21 -1.535 -5.079 0.536
181 HA ALA 21 HA ALA 21 1.034 -4.452 -0.549
182 HB1 ALA 21 3HB ALA 21 0.116 -2.534 0.241
183 HB2 ALA 21 1HB ALA 21 1.005 -3.002 1.692
184 HB3 ALA 21 2HB ALA 21 -0.719 -3.348 1.564
185 H ILE 22 H ILE 22 -0.131 -6.025 2.385
186 HA ILE 22 HA ILE 22 2.410 -6.306 3.616
187 HB ILE 22 HB ILE 22 -0.039 -8.028 4.028
188 HG12 ILE 22 2HG1 ILE 22 0.701 -5.791 5.860
189 HG13 ILE 22 1HG1 ILE 22 -0.088 -5.388 4.338
190 HG21 ILE 22 1HG2 ILE 22 1.989 -9.010 4.943
191 HG22 ILE 22 2HG2 ILE 22 0.929 -8.458 6.240
192 HG23 ILE 22 3HG2 ILE 22 2.347 -7.510 5.798
193 HD11 ILE 22 3HD1 ILE 22 -1.540 -7.512 5.492
194 HD12 ILE 22 1HD1 ILE 22 -2.041 -5.835 5.264
195 HD13 ILE 22 2HD1 ILE 22 -1.240 -6.321 6.758
196 H ASN 23 H ASN 23 0.666 -8.164 1.234
197 HA ASN 23 HA ASN 23 2.280 -10.518 1.454
198 HB2 ASN 23 2HB ASN 23 -0.128 -9.963 0.282
199 HB3 ASN 23 1HB ASN 23 0.933 -10.034 -1.121
200 HD21 ASN 23 1HD2 ASN 23 1.528 -11.960 -1.883
201 HD22 ASN 23 2HD2 ASN 23 1.185 -13.476 -1.126
202 H ILE 24 H ILE 24 2.176 -7.759 -0.776
203 HA ILE 24 HA ILE 24 4.405 -8.667 -2.325
204 HB ILE 24 HB ILE 24 3.296 -5.864 -2.195
205 HG12 ILE 24 2HG1 ILE 24 2.505 -7.890 -4.262
206 HG13 ILE 24 1HG1 ILE 24 1.666 -7.843 -2.716
207 HG21 ILE 24 1HG2 ILE 24 4.592 -5.362 -3.957
208 HG22 ILE 24 2HG2 ILE 24 4.348 -6.936 -4.713
209 HG23 ILE 24 3HG2 ILE 24 5.546 -6.750 -3.434
210 HD11 ILE 24 3HD1 ILE 24 0.359 -6.530 -4.110
211 HD12 ILE 24 1HD1 ILE 24 1.759 -5.767 -4.867
212 HD13 ILE 24 2HD1 ILE 24 1.316 -5.353 -3.210
213 H ALA 25 H ALA 25 3.982 -6.688 0.509
214 HA ALA 25 HA ALA 25 6.344 -5.229 0.529
215 HB1 ALA 25 3HB ALA 25 6.039 -5.683 3.151
216 HB2 ALA 25 1HB ALA 25 4.445 -6.179 2.582
217 HB3 ALA 25 2HB ALA 25 5.035 -4.552 2.245
218 H GLY 26 H GLY 26 5.781 -8.603 1.255
219 HA2 GLY 26 2HA GLY 26 8.257 -9.108 2.552
220 HA3 GLY 26 1HA GLY 26 7.210 -10.316 1.823
221 H THR 27 H THR 27 7.269 -9.071 -0.811
222 HA THR 27 HA THR 27 9.677 -10.310 -1.766
223 HB THR 27 HB THR 27 8.593 -9.014 -3.941
224 HG1 THR 27 1HG THR 27 6.851 -8.260 -2.689
225 HG21 THR 27 3HG2 THR 27 7.261 -11.537 -3.218
226 HG22 THR 27 1HG2 THR 27 9.020 -11.576 -3.307
227 HG23 THR 27 2HG2 THR 27 8.078 -11.063 -4.707
228 H THR 28 H THR 28 8.432 -7.007 -1.540
229 HA THR 28 HA THR 28 10.492 -5.711 -2.922
230 HB THR 28 HB THR 28 9.322 -4.326 -0.572
231 HG1 THR 28 1HG THR 28 7.294 -4.243 -1.485
232 HG21 THR 28 3HG2 THR 28 10.336 -3.615 -3.139
233 HG22 THR 28 1HG2 THR 28 9.861 -2.573 -1.799
234 HG23 THR 28 2HG2 THR 28 8.664 -3.069 -2.995
235 H HIS 29 H HIS 29 10.272 -6.861 0.378
236 HA HIS 29 HA HIS 29 12.449 -5.502 1.490
237 HD1 HIS 29 1HD HIS 29 14.108 -5.887 2.839
238 HD2 HIS 29 2HD HIS 29 11.755 -8.355 5.216
239 HE1 HIS 29 1HE HIS 29 15.293 -6.016 5.052
240 HE2 HIS 29 2HE HIS 29 13.809 -7.448 6.500
241 HB2 HIS 29 2HB HIS 29 10.733 -6.884 2.724
242 HB3 HIS 29 1HB HIS 29 11.600 -8.316 2.185
243 H ASP 30 H ASP 30 12.297 -8.289 -0.599
244 HA ASP 30 HA ASP 30 15.062 -9.012 -0.191
245 HB2 ASP 30 2HB ASP 30 12.794 -10.314 -1.175
246 HB3 ASP 30 1HB ASP 30 13.843 -10.132 -2.575
247 H VAL 31 H VAL 31 13.148 -7.763 -2.924
248 HA VAL 31 HA VAL 31 15.180 -7.377 -4.741
249 HB VAL 31 HB VAL 31 12.883 -5.456 -4.444
250 HG11 VAL 31 1HG1 VAL 31 13.067 -5.782 -7.028
251 HG12 VAL 31 2HG1 VAL 31 14.700 -6.321 -6.635
252 HG13 VAL 31 3HG1 VAL 31 14.174 -4.700 -6.182
253 HG21 VAL 31 3HG2 VAL 31 11.601 -7.327 -4.417
254 HG22 VAL 31 1HG2 VAL 31 12.858 -8.331 -5.140
255 HG23 VAL 31 2HG2 VAL 31 11.893 -7.261 -6.157
256 H VAL 32 H VAL 32 14.041 -5.168 -2.227
257 HA VAL 32 HA VAL 32 15.739 -3.014 -2.907
258 HB VAL 32 HB VAL 32 14.600 -3.646 -0.179
259 HG11 VAL 32 1HG1 VAL 32 16.036 -1.344 -1.338
260 HG12 VAL 32 2HG1 VAL 32 15.959 -1.915 0.328
261 HG13 VAL 32 3HG1 VAL 32 14.634 -0.965 -0.341
262 HG21 VAL 32 3HG2 VAL 32 13.077 -3.403 -2.353
263 HG22 VAL 32 1HG2 VAL 32 13.295 -1.693 -1.985
264 HG23 VAL 32 2HG2 VAL 32 12.592 -2.772 -0.780
265 H SER 33 H SER 33 16.200 -5.901 -1.006
266 HA SER 33 HA SER 33 18.541 -5.068 0.366
267 HG SER 33 HG SER 33 18.395 -6.812 2.267
268 HB2 SER 33 2HB SER 33 16.917 -7.146 0.719
269 HB3 SER 33 1HB SER 33 18.123 -7.949 -0.286
270 H PHE 34 H PHE 34 17.934 -6.464 -2.779
271 HA PHE 34 HA PHE 34 20.610 -7.236 -3.339
272 HD1 PHE 34 1HD PHE 34 17.970 -8.741 -2.968
273 HD2 PHE 34 2HD PHE 34 20.161 -9.047 -6.604
274 HE1 PHE 34 1HE PHE 34 17.871 -11.195 -2.817
275 HE2 PHE 34 2HE PHE 34 20.066 -11.502 -6.460
276 HZ PHE 34 HZ PHE 34 18.917 -12.578 -4.564
277 HB2 PHE 34 2HB PHE 34 18.119 -6.862 -4.944
278 HB3 PHE 34 1HB PHE 34 19.657 -6.972 -5.796
279 H PHE 35 H PHE 35 18.780 -4.274 -3.770
280 HA PHE 35 HA PHE 35 20.929 -3.006 -5.252
281 HD1 PHE 35 2HD PHE 35 20.435 0.249 -4.462
282 HD2 PHE 35 1HD PHE 35 18.662 -1.896 -7.682
283 HE1 PHE 35 2HE PHE 35 21.169 2.001 -6.026
284 HE2 PHE 35 1HE PHE 35 19.395 -0.148 -9.252
285 HZ PHE 35 HZ PHE 35 20.647 1.802 -8.426
286 HB2 PHE 35 2HB PHE 35 18.348 -2.643 -5.526
287 HB3 PHE 35 1HB PHE 35 18.553 -1.527 -4.181
288 H ARG 36 H ARG 36 19.407 -2.773 -2.066
289 HA ARG 36 HA ARG 36 20.099 -1.858 -0.103
290 HE ARG 36 HE ARG 36 22.044 -2.042 3.078
291 HB2 ARG 36 2HB ARG 36 22.056 -3.286 -0.436
292 HB3 ARG 36 1HB ARG 36 22.816 -2.040 -1.415
293 HG2 ARG 36 2HG ARG 36 23.572 -0.946 0.370
294 HG3 ARG 36 1HG ARG 36 22.024 -1.072 1.207
295 HD2 ARG 36 2HD ARG 36 23.304 -3.646 1.070
296 HD3 ARG 36 1HD ARG 36 24.397 -2.453 1.774
297 HH11 ARG 36 1HH1 ARG 36 24.076 -4.831 2.549
298 HH12 ARG 36 2HH1 ARG 36 23.632 -5.593 4.039
299 HH21 ARG 36 1HH2 ARG 36 21.461 -3.044 5.039
300 HH22 ARG 36 2HH2 ARG 36 22.148 -4.578 5.453
301 HA PRO 37 HA PRO 37 20.281 2.345 -2.140
302 HB2 PRO 37 2HB PRO 37 17.923 3.255 -1.177
303 HB3 PRO 37 1HB PRO 37 18.042 2.311 -2.668
304 HG2 PRO 37 2HG PRO 37 17.280 1.414 0.084
305 HG3 PRO 37 1HG PRO 37 16.539 0.999 -1.472
306 HD2 PRO 37 2HD PRO 37 18.272 -0.647 -0.184
307 HD3 PRO 37 1HD PRO 37 18.137 -0.588 -1.952
308 H LYS 38 H LYS 38 19.441 4.486 -0.779
309 HA LYS 38 HA LYS 38 19.872 4.394 2.024
310 HB2 LYS 38 2HB LYS 38 22.218 4.142 0.739
311 HB3 LYS 38 1HB LYS 38 22.089 5.895 0.745
312 HG2 LYS 38 2HG LYS 38 21.736 4.300 3.255
313 HG3 LYS 38 1HG LYS 38 23.334 4.770 2.672
314 HD2 LYS 38 2HD LYS 38 23.026 6.953 3.186
315 HD3 LYS 38 1HD LYS 38 21.310 6.916 2.778
316 HE2 LYS 38 2HE LYS 38 21.264 7.211 5.072
317 HE3 LYS 38 1HE LYS 38 21.094 5.463 4.914
318 HZ1 LYS 38 3HZ LYS 38 22.866 6.617 6.513
319 HZ2 LYS 38 1HZ LYS 38 23.812 6.467 5.119
320 HZ3 LYS 38 2HZ LYS 38 23.109 5.096 5.816
321 H LYS 39 H LYS 39 20.477 6.546 -0.754
322 HA LYS 39 HA LYS 39 18.543 8.436 0.381
323 HB2 LYS 39 2HB LYS 39 20.815 9.183 1.021
324 HB3 LYS 39 1HB LYS 39 21.263 9.225 -0.677
325 HG2 LYS 39 2HG LYS 39 19.094 10.802 -0.746
326 HG3 LYS 39 1HG LYS 39 19.640 11.108 0.903
327 HD2 LYS 39 2HD LYS 39 20.963 12.645 -0.073
328 HD3 LYS 39 1HD LYS 39 21.985 11.258 -0.449
329 HE2 LYS 39 2HE LYS 39 20.555 11.061 -2.583
330 HE3 LYS 39 1HE LYS 39 20.049 12.711 -2.220
331 HZ1 LYS 39 3HZ LYS 39 22.151 13.529 -2.580
332 HZ2 LYS 39 1HZ LYS 39 22.082 12.298 -3.740
333 HZ3 LYS 39 2HZ LYS 39 22.915 12.048 -2.289
334 H LYS 40 H LYS 40 17.006 8.100 -1.156
335 HA LYS 40 HA LYS 40 17.453 9.275 -3.735
336 HB2 LYS 40 2HB LYS 40 18.203 6.756 -3.777
337 HB3 LYS 40 1HB LYS 40 16.473 6.453 -3.862
338 HG2 LYS 40 2HG LYS 40 17.467 8.470 -5.747
339 HG3 LYS 40 1HG LYS 40 18.082 6.834 -6.005
340 HD2 LYS 40 2HD LYS 40 16.012 5.990 -6.503
341 HD3 LYS 40 1HD LYS 40 15.165 7.191 -5.526
342 HE2 LYS 40 2HE LYS 40 16.277 8.775 -7.413
343 HE3 LYS 40 1HE LYS 40 16.029 7.296 -8.340
344 HZ1 LYS 40 3HZ LYS 40 14.071 9.135 -7.226
345 HZ2 LYS 40 1HZ LYS 40 13.680 7.491 -7.131
346 HZ3 LYS 40 2HZ LYS 40 14.001 8.199 -8.633
347 H LYS 41 H LYS 41 15.314 7.270 -1.760
348 HA LYS 41 HA LYS 41 13.083 9.012 -2.543
349 HB2 LYS 41 2HB LYS 41 13.312 6.088 -2.875
350 HB3 LYS 41 1HB LYS 41 11.797 6.647 -2.179
351 HG2 LYS 41 2HG LYS 41 12.772 8.053 -4.593
352 HG3 LYS 41 1HG LYS 41 12.182 6.405 -4.798
353 HD2 LYS 41 2HD LYS 41 10.062 7.067 -4.608
354 HD3 LYS 41 1HD LYS 41 10.407 7.924 -3.104
355 HE2 LYS 41 2HE LYS 41 11.414 9.743 -4.618
356 HE3 LYS 41 1HE LYS 41 10.544 8.938 -5.924
357 HZ1 LYS 41 3HZ LYS 41 8.485 9.256 -4.695
358 HZ2 LYS 41 1HZ LYS 41 9.246 10.740 -4.983
359 HZ3 LYS 41 2HZ LYS 41 9.321 10.033 -3.448
360 H HIS 42 H HIS 42 14.245 6.562 -0.253
361 HA HIS 42 HA HIS 42 14.004 6.350 1.997
362 HD1 HIS 42 1HD HIS 42 15.430 10.501 3.117
363 HD2 HIS 42 2HD HIS 42 15.516 6.355 3.382
364 HE1 HIS 42 1HE HIS 42 17.560 9.950 4.334
365 HE2 HIS 42 2HE HIS 42 17.544 7.440 4.561
366 HB2 HIS 42 2HB HIS 42 13.758 9.227 1.513
367 HB3 HIS 42 1HB HIS 42 12.934 8.699 2.977
Start of MODEL 11
1 H1 GLY 1 1H GLY 1 -25.228 12.460 9.776
2 H2 GLY 1 2H GLY 1 -23.690 11.776 9.602
3 H3 GLY 1 3H GLY 1 -24.828 11.049 10.619
4 HA2 GLY 1 1HA GLY 1 -26.274 10.768 8.577
5 HA3 GLY 1 2HA GLY 1 -24.827 11.172 7.663
6 H LYS 2 H LYS 2 -26.425 8.679 7.796
7 HA LYS 2 HA LYS 2 -24.662 6.775 9.089
8 HB2 LYS 2 2HB LYS 2 -27.369 6.795 8.429
9 HB3 LYS 2 1HB LYS 2 -26.664 5.623 7.324
10 HG2 LYS 2 2HG LYS 2 -26.425 4.109 8.934
11 HG3 LYS 2 1HG LYS 2 -25.683 5.278 10.026
12 HD2 LYS 2 2HD LYS 2 -27.621 5.700 11.098
13 HD3 LYS 2 1HD LYS 2 -28.574 5.622 9.614
14 HE2 LYS 2 2HE LYS 2 -27.436 3.063 10.512
15 HE3 LYS 2 1HE LYS 2 -28.647 3.763 11.585
16 HZ1 LYS 2 3HZ LYS 2 -30.229 3.786 9.838
17 HZ2 LYS 2 1HZ LYS 2 -29.534 2.245 9.840
18 HZ3 LYS 2 2HZ LYS 2 -29.070 3.381 8.675
19 H ILE 3 H ILE 3 -23.178 5.507 8.112
20 HA ILE 3 HA ILE 3 -22.078 6.226 5.660
21 HB ILE 3 HB ILE 3 -21.773 3.494 6.889
22 HG12 ILE 3 2HG1 ILE 3 -21.454 4.989 8.732
23 HG13 ILE 3 1HG1 ILE 3 -19.854 4.522 8.168
24 HG21 ILE 3 1HG2 ILE 3 -19.970 5.259 5.257
25 HG22 ILE 3 2HG2 ILE 3 -20.734 3.754 4.748
26 HG23 ILE 3 3HG2 ILE 3 -19.481 3.730 5.988
27 HD11 ILE 3 3HD1 ILE 3 -21.009 7.131 8.411
28 HD12 ILE 3 1HD1 ILE 3 -20.506 6.838 6.746
29 HD13 ILE 3 2HD1 ILE 3 -19.343 6.669 8.061
30 HA PRO 4 HA PRO 4 -24.823 4.157 2.828
31 HB2 PRO 4 2HB PRO 4 -23.345 4.394 0.580
32 HB3 PRO 4 1HB PRO 4 -24.173 5.772 1.314
33 HG2 PRO 4 2HG PRO 4 -21.296 4.966 1.515
34 HG3 PRO 4 1HG PRO 4 -21.993 6.580 1.269
35 HD2 PRO 4 2HD PRO 4 -21.120 5.694 3.688
36 HD3 PRO 4 1HD PRO 4 -22.446 6.860 3.506
37 H VAL 5 H VAL 5 -24.995 2.205 1.656
38 HA VAL 5 HA VAL 5 -23.520 0.048 2.628
39 HB VAL 5 HB VAL 5 -25.002 -0.001 0.009
40 HG11 VAL 5 1HG1 VAL 5 -25.637 -2.277 1.169
41 HG12 VAL 5 2HG1 VAL 5 -24.139 -1.976 2.046
42 HG13 VAL 5 3HG1 VAL 5 -24.123 -2.085 0.286
43 HG21 VAL 5 3HG2 VAL 5 -26.073 0.278 2.780
44 HG22 VAL 5 1HG2 VAL 5 -26.954 -0.707 1.610
45 HG23 VAL 5 2HG2 VAL 5 -26.645 0.997 1.274
46 H LYS 6 H LYS 6 -23.135 1.998 -0.265
47 HA LYS 6 HA LYS 6 -21.273 0.334 -1.584
48 HB2 LYS 6 2HB LYS 6 -21.729 3.317 -1.761
49 HB3 LYS 6 1HB LYS 6 -20.673 2.418 -2.841
50 HG2 LYS 6 2HG LYS 6 -22.501 1.192 -3.739
51 HG3 LYS 6 1HG LYS 6 -23.601 1.818 -2.507
52 HD2 LYS 6 2HD LYS 6 -23.921 3.757 -3.604
53 HD3 LYS 6 1HD LYS 6 -22.227 3.879 -4.083
54 HE2 LYS 6 2HE LYS 6 -24.117 1.921 -5.354
55 HE3 LYS 6 1HE LYS 6 -23.944 3.574 -5.940
56 HZ1 LYS 6 3HZ LYS 6 -22.117 1.330 -6.158
57 HZ2 LYS 6 1HZ LYS 6 -21.399 2.824 -5.830
58 HZ3 LYS 6 2HZ LYS 6 -22.361 2.632 -7.208
59 H ALA 7 H ALA 7 -20.956 2.806 0.877
60 HA ALA 7 HA ALA 7 -18.177 3.193 0.739
61 HB1 ALA 7 3HB ALA 7 -20.270 3.667 2.795
62 HB2 ALA 7 1HB ALA 7 -19.164 4.803 2.026
63 HB3 ALA 7 2HB ALA 7 -18.580 3.727 3.294
64 H ILE 8 H ILE 8 -20.127 0.958 2.702
65 HA ILE 8 HA ILE 8 -17.963 -0.218 4.071
66 HB ILE 8 HB ILE 8 -20.540 -1.626 3.416
67 HG12 ILE 8 2HG1 ILE 8 -20.504 -0.269 5.984
68 HG13 ILE 8 1HG1 ILE 8 -20.351 0.872 4.655
69 HG21 ILE 8 1HG2 ILE 8 -18.394 -1.930 5.461
70 HG22 ILE 8 2HG2 ILE 8 -19.218 -3.157 4.497
71 HG23 ILE 8 3HG2 ILE 8 -20.044 -2.408 5.863
72 HD11 ILE 8 3HD1 ILE 8 -22.376 -0.921 3.920
73 HD12 ILE 8 1HD1 ILE 8 -22.538 0.773 4.386
74 HD13 ILE 8 2HD1 ILE 8 -22.666 -0.493 5.606
75 H LYS 9 H LYS 9 -19.723 -1.198 1.164
76 HA LYS 9 HA LYS 9 -18.322 -3.581 0.688
77 HB2 LYS 9 2HB LYS 9 -20.485 -2.544 -0.424
78 HB3 LYS 9 1HB LYS 9 -19.324 -1.947 -1.603
79 HG2 LYS 9 2HG LYS 9 -18.567 -4.238 -2.011
80 HG3 LYS 9 1HG LYS 9 -19.749 -4.831 -0.841
81 HD2 LYS 9 2HD LYS 9 -21.325 -3.331 -2.467
82 HD3 LYS 9 1HD LYS 9 -20.117 -3.919 -3.612
83 HE2 LYS 9 2HE LYS 9 -21.870 -5.569 -1.798
84 HE3 LYS 9 1HE LYS 9 -21.958 -5.466 -3.557
85 HZ1 LYS 9 3HZ LYS 9 -19.608 -6.503 -2.073
86 HZ2 LYS 9 1HZ LYS 9 -19.856 -6.548 -3.745
87 HZ3 LYS 9 2HZ LYS 9 -20.824 -7.483 -2.719
88 H GLN 10 H GLN 10 -17.698 -0.262 -0.318
89 HA GLN 10 HA GLN 10 -15.515 -0.874 -2.026
90 HB2 GLN 10 2HB GLN 10 -16.787 1.537 -0.945
91 HB3 GLN 10 1HB GLN 10 -15.054 1.706 -1.192
92 HG2 GLN 10 2HG GLN 10 -15.335 0.989 -3.524
93 HG3 GLN 10 1HG GLN 10 -17.076 0.885 -3.266
94 HE21 GLN 10 1HE2 GLN 10 -16.871 2.410 -5.162
95 HE22 GLN 10 2HE2 GLN 10 -16.795 4.096 -4.793
96 H ALA 11 H ALA 11 -15.818 -0.169 1.394
97 HA ALA 11 HA ALA 11 -13.075 0.212 1.949
98 HB1 ALA 11 3HB ALA 11 -13.860 -0.530 4.317
99 HB2 ALA 11 1HB ALA 11 -15.471 -0.452 3.603
100 HB3 ALA 11 2HB ALA 11 -14.450 0.985 3.634
101 H GLY 12 H GLY 12 -15.104 -2.643 1.730
102 HA2 GLY 12 2HA GLY 12 -13.222 -4.450 2.879
103 HA3 GLY 12 1HA GLY 12 -14.620 -4.888 1.908
104 H LYS 13 H LYS 13 -13.671 -3.148 -0.319
105 HA LYS 13 HA LYS 13 -12.047 -5.141 -1.614
106 HB2 LYS 13 2HB LYS 13 -13.795 -3.029 -2.425
107 HB3 LYS 13 1HB LYS 13 -12.240 -2.794 -3.208
108 HG2 LYS 13 2HG LYS 13 -13.519 -4.101 -4.683
109 HG3 LYS 13 1HG LYS 13 -12.377 -5.212 -3.926
110 HD2 LYS 13 2HD LYS 13 -14.215 -6.471 -3.580
111 HD3 LYS 13 1HD LYS 13 -14.465 -5.384 -2.209
112 HE2 LYS 13 2HE LYS 13 -15.987 -4.042 -3.454
113 HE3 LYS 13 1HE LYS 13 -15.586 -4.870 -4.957
114 HZ1 LYS 13 3HZ LYS 13 -17.713 -5.470 -3.518
115 HZ2 LYS 13 1HZ LYS 13 -16.609 -6.520 -2.783
116 HZ3 LYS 13 2HZ LYS 13 -16.896 -6.621 -4.445
117 H VAL 14 H VAL 14 -11.615 -1.832 -0.451
118 HA VAL 14 HA VAL 14 -9.098 -1.313 -1.508
119 HB VAL 14 HB VAL 14 -9.984 -0.361 1.207
120 HG11 VAL 14 1HG1 VAL 14 -7.915 0.521 0.912
121 HG12 VAL 14 2HG1 VAL 14 -8.857 1.747 0.064
122 HG13 VAL 14 3HG1 VAL 14 -8.029 0.484 -0.845
123 HG21 VAL 14 3HG2 VAL 14 -11.796 0.562 0.301
124 HG22 VAL 14 1HG2 VAL 14 -11.337 0.005 -1.308
125 HG23 VAL 14 2HG2 VAL 14 -10.735 1.549 -0.702
126 H ILE 15 H ILE 15 -10.057 -3.099 1.358
127 HA ILE 15 HA ILE 15 -7.507 -3.304 2.551
128 HB ILE 15 HB ILE 15 -9.773 -5.291 2.760
129 HG12 ILE 15 2HG1 ILE 15 -9.279 -3.134 4.771
130 HG13 ILE 15 1HG1 ILE 15 -10.152 -2.732 3.297
131 HG21 ILE 15 1HG2 ILE 15 -8.657 -6.297 4.431
132 HG22 ILE 15 2HG2 ILE 15 -8.019 -4.776 5.058
133 HG23 ILE 15 3HG2 ILE 15 -7.239 -5.560 3.686
134 HD11 ILE 15 3HD1 ILE 15 -11.324 -5.079 4.263
135 HD12 ILE 15 1HD1 ILE 15 -11.997 -3.450 4.276
136 HD13 ILE 15 2HD1 ILE 15 -11.084 -4.038 5.665
137 H GLY 16 H GLY 16 -9.136 -5.156 0.054
138 HA2 GLY 16 2HA GLY 16 -7.195 -7.279 0.038
139 HA3 GLY 16 1HA GLY 16 -8.469 -7.021 -1.142
140 H LYS 17 H LYS 17 -7.923 -4.557 -2.140
141 HA LYS 17 HA LYS 17 -5.883 -5.063 -3.989
142 HB2 LYS 17 2HB LYS 17 -7.899 -3.319 -3.935
143 HB3 LYS 17 1HB LYS 17 -6.618 -2.240 -3.401
144 HG2 LYS 17 2HG LYS 17 -6.795 -2.012 -5.749
145 HG3 LYS 17 1HG LYS 17 -5.319 -2.925 -5.430
146 HD2 LYS 17 2HD LYS 17 -6.458 -3.968 -7.261
147 HD3 LYS 17 1HD LYS 17 -6.611 -5.019 -5.851
148 HE2 LYS 17 2HE LYS 17 -8.763 -3.042 -6.185
149 HE3 LYS 17 1HE LYS 17 -8.675 -4.276 -7.441
150 HZ1 LYS 17 3HZ LYS 17 -8.459 -5.226 -4.704
151 HZ2 LYS 17 1HZ LYS 17 -9.288 -5.892 -6.021
152 HZ3 LYS 17 2HZ LYS 17 -9.972 -4.614 -5.152
153 H GLY 18 H GLY 18 -5.885 -3.324 -0.940
154 HA2 GLY 18 2HA GLY 18 -3.269 -2.215 -1.239
155 HA3 GLY 18 1HA GLY 18 -4.183 -2.331 0.258
156 H LEU 19 H LEU 19 -4.550 -5.191 0.125
157 HA LEU 19 HA LEU 19 -2.129 -5.992 1.389
158 HG LEU 19 HG LEU 19 -2.598 -7.271 3.033
159 HB2 LEU 19 2HB LEU 19 -4.744 -6.868 1.400
160 HB3 LEU 19 1HB LEU 19 -3.910 -8.154 0.550
161 HD11 LEU 19 1HD1 LEU 19 -4.362 -8.922 4.175
162 HD12 LEU 19 2HD1 LEU 19 -5.417 -8.153 2.989
163 HD13 LEU 19 3HD1 LEU 19 -4.550 -7.169 4.169
164 HD21 LEU 19 3HD2 LEU 19 -1.608 -9.152 2.228
165 HD22 LEU 19 1HD2 LEU 19 -3.096 -9.760 1.503
166 HD23 LEU 19 2HD2 LEU 19 -2.837 -9.908 3.240
167 H ARG 20 H ARG 20 -3.535 -6.472 -1.793
168 HA ARG 20 HA ARG 20 -1.675 -8.446 -2.655
169 HE ARG 20 HE ARG 20 -6.003 -8.751 -3.367
170 HB2 ARG 20 2HB ARG 20 -3.837 -6.852 -3.856
171 HB3 ARG 20 1HB ARG 20 -2.537 -7.262 -4.968
172 HG2 ARG 20 2HG ARG 20 -2.876 -9.571 -4.681
173 HG3 ARG 20 1HG ARG 20 -3.894 -9.325 -3.260
174 HD2 ARG 20 2HD ARG 20 -4.778 -8.053 -5.783
175 HD3 ARG 20 1HD ARG 20 -4.881 -9.812 -5.700
176 HH11 ARG 20 1HH1 ARG 20 -6.646 -8.873 -6.795
177 HH12 ARG 20 2HH1 ARG 20 -8.362 -8.762 -6.604
178 HH21 ARG 20 1HH2 ARG 20 -8.262 -8.604 -3.115
179 HH22 ARG 20 2HH2 ARG 20 -9.281 -8.609 -4.515
180 H ALA 21 H ALA 21 -1.733 -4.946 -2.671
181 HA ALA 21 HA ALA 21 0.483 -4.619 -4.440
182 HB1 ALA 21 3HB ALA 21 -1.385 -2.928 -3.740
183 HB2 ALA 21 1HB ALA 21 0.240 -2.354 -4.118
184 HB3 ALA 21 2HB ALA 21 -0.260 -2.539 -2.438
185 H ILE 22 H ILE 22 0.089 -4.648 -0.933
186 HA ILE 22 HA ILE 22 2.785 -4.031 -0.315
187 HB ILE 22 HB ILE 22 0.822 -5.563 1.394
188 HG12 ILE 22 2HG1 ILE 22 1.316 -2.652 1.774
189 HG13 ILE 22 1HG1 ILE 22 0.299 -3.127 0.418
190 HG21 ILE 22 1HG2 ILE 22 2.756 -5.807 2.562
191 HG22 ILE 22 2HG2 ILE 22 2.297 -4.206 3.145
192 HG23 ILE 22 3HG2 ILE 22 3.494 -4.368 1.859
193 HD11 ILE 22 3HD1 ILE 22 -0.796 -4.596 2.398
194 HD12 ILE 22 1HD1 ILE 22 -1.341 -2.986 1.931
195 HD13 ILE 22 2HD1 ILE 22 -0.242 -3.184 3.295
196 H ASN 23 H ASN 23 1.131 -6.974 -1.155
197 HA ASN 23 HA ASN 23 3.108 -8.774 -0.171
198 HB2 ASN 23 2HB ASN 23 0.568 -9.100 -1.027
199 HB3 ASN 23 1HB ASN 23 1.436 -9.602 -2.474
200 HD21 ASN 23 1HD2 ASN 23 1.334 -11.735 -2.506
201 HD22 ASN 23 2HD2 ASN 23 1.755 -12.784 -1.199
202 H ILE 24 H ILE 24 2.461 -7.289 -3.318
203 HA ILE 24 HA ILE 24 4.609 -8.648 -4.640
204 HB ILE 24 HB ILE 24 3.198 -6.136 -5.541
205 HG12 ILE 24 2HG1 ILE 24 2.470 -8.916 -6.421
206 HG13 ILE 24 1HG1 ILE 24 1.759 -8.226 -4.966
207 HG21 ILE 24 1HG2 ILE 24 4.179 -8.144 -7.463
208 HG22 ILE 24 2HG2 ILE 24 5.415 -7.237 -6.591
209 HG23 ILE 24 3HG2 ILE 24 4.202 -6.383 -7.547
210 HD11 ILE 24 3HD1 ILE 24 0.261 -7.875 -6.785
211 HD12 ILE 24 1HD1 ILE 24 1.542 -7.172 -7.771
212 HD13 ILE 24 2HD1 ILE 24 0.959 -6.319 -6.342
213 H ALA 25 H ALA 25 4.150 -5.449 -3.209
214 HA ALA 25 HA ALA 25 6.765 -4.527 -3.978
215 HB1 ALA 25 3HB ALA 25 6.160 -2.630 -2.362
216 HB2 ALA 25 1HB ALA 25 4.573 -3.398 -2.266
217 HB3 ALA 25 2HB ALA 25 5.180 -2.817 -3.818
218 H GLY 26 H GLY 26 5.310 -6.041 -1.184
219 HA2 GLY 26 2HA GLY 26 7.336 -5.454 0.696
220 HA3 GLY 26 1HA GLY 26 6.194 -6.785 0.802
221 H THR 27 H THR 27 7.005 -7.987 -1.709
222 HA THR 27 HA THR 27 9.072 -9.659 -0.746
223 HB THR 27 HB THR 27 8.321 -9.428 -3.650
224 HG1 THR 27 1HG THR 27 6.505 -10.614 -3.249
225 HG21 THR 27 3HG2 THR 27 8.626 -11.804 -3.703
226 HG22 THR 27 1HG2 THR 27 8.903 -11.848 -1.963
227 HG23 THR 27 2HG2 THR 27 10.069 -11.052 -3.022
228 H THR 28 H THR 28 9.071 -7.371 -3.486
229 HA THR 28 HA THR 28 11.814 -7.526 -4.016
230 HB THR 28 HB THR 28 10.276 -6.563 -5.624
231 HG1 THR 28 1HG THR 28 11.467 -4.708 -6.139
232 HG21 THR 28 3HG2 THR 28 10.006 -4.069 -4.015
233 HG22 THR 28 1HG2 THR 28 8.877 -5.406 -3.783
234 HG23 THR 28 2HG2 THR 28 9.033 -4.647 -5.366
235 H HIS 29 H HIS 29 9.993 -5.597 -1.730
236 HA HIS 29 HA HIS 29 12.048 -3.780 -1.045
237 HD1 HIS 29 1HD HIS 29 12.810 -2.897 0.856
238 HD2 HIS 29 2HD HIS 29 8.907 -2.030 1.994
239 HE1 HIS 29 1HE HIS 29 12.994 -1.001 2.500
240 HE2 HIS 29 2HE HIS 29 10.614 -0.436 3.105
241 HB2 HIS 29 2HB HIS 29 9.581 -3.544 -0.519
242 HB3 HIS 29 1HB HIS 29 9.821 -4.720 0.768
243 H ASP 30 H ASP 30 11.280 -7.030 -0.023
244 HA ASP 30 HA ASP 30 12.948 -7.051 2.286
245 HB2 ASP 30 2HB ASP 30 11.059 -8.761 1.161
246 HB3 ASP 30 1HB ASP 30 12.568 -9.655 1.047
247 H VAL 31 H VAL 31 13.327 -8.482 -0.955
248 HA VAL 31 HA VAL 31 15.894 -9.457 -0.684
249 HB VAL 31 HB VAL 31 14.862 -8.234 -3.235
250 HG11 VAL 31 1HG1 VAL 31 16.620 -10.618 -2.706
251 HG12 VAL 31 2HG1 VAL 31 17.180 -9.024 -3.209
252 HG13 VAL 31 3HG1 VAL 31 16.167 -9.985 -4.287
253 HG21 VAL 31 3HG2 VAL 31 13.030 -9.529 -2.718
254 HG22 VAL 31 1HG2 VAL 31 13.980 -10.702 -1.803
255 HG23 VAL 31 2HG2 VAL 31 14.037 -10.701 -3.566
256 H VAL 32 H VAL 32 14.836 -6.236 -1.682
257 HA VAL 32 HA VAL 32 17.429 -5.229 -2.230
258 HB VAL 32 HB VAL 32 14.986 -3.641 -1.431
259 HG11 VAL 32 1HG1 VAL 32 17.626 -2.950 -2.638
260 HG12 VAL 32 2HG1 VAL 32 16.717 -2.124 -1.373
261 HG13 VAL 32 3HG1 VAL 32 16.201 -1.996 -3.055
262 HG21 VAL 32 3HG2 VAL 32 15.068 -5.345 -3.533
263 HG22 VAL 32 1HG2 VAL 32 15.694 -3.873 -4.276
264 HG23 VAL 32 2HG2 VAL 32 14.112 -3.864 -3.495
265 H SER 33 H SER 33 15.463 -5.431 0.659
266 HA SER 33 HA SER 33 16.986 -3.654 2.256
267 HG SER 33 HG SER 33 16.015 -3.440 4.317
268 HB2 SER 33 2HB SER 33 14.634 -4.491 2.730
269 HB3 SER 33 1HB SER 33 15.373 -5.998 3.272
270 H PHE 34 H PHE 34 17.283 -7.040 1.443
271 HA PHE 34 HA PHE 34 19.073 -7.814 3.469
272 HD1 PHE 34 2HD PHE 34 19.909 -9.927 4.031
273 HD2 PHE 34 1HD PHE 34 16.566 -10.462 1.452
274 HE1 PHE 34 2HE PHE 34 19.025 -11.653 5.543
275 HE2 PHE 34 1HE PHE 34 15.674 -12.190 2.960
276 HZ PHE 34 HZ PHE 34 16.905 -12.788 5.008
277 HB2 PHE 34 2HB PHE 34 18.138 -8.898 0.908
278 HB3 PHE 34 1HB PHE 34 19.780 -9.378 1.321
279 H PHE 35 H PHE 35 19.542 -6.204 0.392
280 HA PHE 35 HA PHE 35 22.443 -6.313 0.677
281 HD1 PHE 35 2HD PHE 35 23.041 -7.958 -1.006
282 HD2 PHE 35 1HD PHE 35 23.071 -4.077 -2.747
283 HE1 PHE 35 2HE PHE 35 25.222 -8.442 -2.032
284 HE2 PHE 35 1HE PHE 35 25.254 -4.553 -3.779
285 HZ PHE 35 HZ PHE 35 26.332 -6.738 -3.422
286 HB2 PHE 35 2HB PHE 35 20.874 -6.432 -1.532
287 HB3 PHE 35 1HB PHE 35 21.259 -4.714 -1.510
288 H ARG 36 H ARG 36 19.781 -4.076 0.985
289 HA ARG 36 HA ARG 36 21.574 -1.809 1.341
290 HE ARG 36 HE ARG 36 21.946 -0.670 -1.514
291 HB2 ARG 36 2HB ARG 36 18.663 -2.170 0.913
292 HB3 ARG 36 1HB ARG 36 19.146 -0.781 1.877
293 HG2 ARG 36 2HG ARG 36 18.934 -0.102 -0.404
294 HG3 ARG 36 1HG ARG 36 20.642 -0.077 0.035
295 HD2 ARG 36 2HD ARG 36 20.181 -2.654 -0.930
296 HD3 ARG 36 1HD ARG 36 19.284 -1.596 -2.017
297 HH11 ARG 36 1HH1 ARG 36 20.030 -2.864 -3.436
298 HH12 ARG 36 2HH1 ARG 36 21.168 -2.915 -4.740
299 HH21 ARG 36 1HH2 ARG 36 23.443 -0.734 -3.230
300 HH22 ARG 36 2HH2 ARG 36 23.107 -1.706 -4.623
301 HA PRO 37 HA PRO 37 21.729 -1.501 5.721
302 HB2 PRO 37 2HB PRO 37 20.064 0.968 5.648
303 HB3 PRO 37 1HB PRO 37 21.651 0.701 6.377
304 HG2 PRO 37 2HG PRO 37 21.417 2.061 4.101
305 HG3 PRO 37 1HG PRO 37 22.766 0.939 4.359
306 HD2 PRO 37 2HD PRO 37 20.300 0.592 2.713
307 HD3 PRO 37 1HD PRO 37 21.954 0.032 2.399
308 H LYS 38 H LYS 38 20.155 -0.783 7.696
309 HA LYS 38 HA LYS 38 17.867 -2.563 7.439
310 HB2 LYS 38 2HB LYS 38 18.850 -1.146 9.916
311 HB3 LYS 38 1HB LYS 38 17.762 -2.527 9.838
312 HG2 LYS 38 2HG LYS 38 19.585 -3.902 8.948
313 HG3 LYS 38 1HG LYS 38 20.671 -2.517 9.060
314 HD2 LYS 38 2HD LYS 38 20.677 -2.546 11.383
315 HD3 LYS 38 1HD LYS 38 19.165 -3.455 11.471
316 HE2 LYS 38 2HE LYS 38 20.655 -5.260 10.196
317 HE3 LYS 38 1HE LYS 38 21.942 -4.407 11.048
318 HZ1 LYS 38 3HZ LYS 38 20.501 -4.732 13.100
319 HZ2 LYS 38 1HZ LYS 38 21.293 -6.099 12.489
320 HZ3 LYS 38 2HZ LYS 38 19.643 -5.872 12.190
321 H LYS 39 H LYS 39 18.578 0.803 8.259
322 HA LYS 39 HA LYS 39 17.286 2.672 8.302
323 HB2 LYS 39 2HB LYS 39 16.209 1.023 6.196
324 HB3 LYS 39 1HB LYS 39 14.919 1.938 6.962
325 HG2 LYS 39 2HG LYS 39 16.907 3.813 6.646
326 HG3 LYS 39 1HG LYS 39 17.042 2.828 5.188
327 HD2 LYS 39 2HD LYS 39 14.342 3.147 5.387
328 HD3 LYS 39 1HD LYS 39 14.929 4.684 6.025
329 HE2 LYS 39 2HE LYS 39 15.944 5.274 4.037
330 HE3 LYS 39 1HE LYS 39 16.081 3.603 3.491
331 HZ1 LYS 39 3HZ LYS 39 13.358 4.363 3.825
332 HZ2 LYS 39 1HZ LYS 39 14.142 3.753 2.455
333 HZ3 LYS 39 2HZ LYS 39 14.151 5.415 2.766
334 H LYS 40 H LYS 40 15.382 3.615 9.273
335 HA LYS 40 HA LYS 40 14.398 1.983 11.454
336 HB2 LYS 40 2HB LYS 40 14.815 4.787 10.968
337 HB3 LYS 40 1HB LYS 40 13.162 4.526 11.508
338 HG2 LYS 40 2HG LYS 40 15.500 3.347 12.969
339 HG3 LYS 40 1HG LYS 40 14.934 4.990 13.279
340 HD2 LYS 40 2HD LYS 40 12.606 3.566 13.366
341 HD3 LYS 40 1HD LYS 40 13.760 2.410 14.033
342 HE2 LYS 40 2HE LYS 40 13.296 5.230 14.997
343 HE3 LYS 40 1HE LYS 40 12.762 3.756 15.800
344 HZ1 LYS 40 3HZ LYS 40 14.944 3.175 16.336
345 HZ2 LYS 40 1HZ LYS 40 14.886 4.841 16.632
346 HZ3 LYS 40 2HZ LYS 40 15.619 4.257 15.224
347 H LYS 41 H LYS 41 13.000 0.528 10.438
348 HA LYS 41 HA LYS 41 10.449 1.715 9.579
349 HB2 LYS 41 2HB LYS 41 11.713 -0.721 8.316
350 HB3 LYS 41 1HB LYS 41 10.206 0.049 7.840
351 HG2 LYS 41 2HG LYS 41 12.583 1.783 7.819
352 HG3 LYS 41 1HG LYS 41 12.566 0.482 6.629
353 HD2 LYS 41 2HD LYS 41 10.045 1.976 6.882
354 HD3 LYS 41 1HD LYS 41 11.410 2.909 6.265
355 HE2 LYS 41 2HE LYS 41 11.788 0.971 4.652
356 HE3 LYS 41 1HE LYS 41 10.187 0.409 5.130
357 HZ1 LYS 41 3HZ LYS 41 10.380 3.201 4.343
358 HZ2 LYS 41 1HZ LYS 41 9.177 2.060 4.004
359 HZ3 LYS 41 2HZ LYS 41 10.612 2.072 3.105
360 H HIS 42 H HIS 42 8.801 1.022 10.755
361 HA HIS 42 HA HIS 42 9.130 -1.445 12.318
362 HD1 HIS 42 1HD HIS 42 9.005 2.686 12.964
363 HD2 HIS 42 2HD HIS 42 9.640 -0.599 15.429
364 HE1 HIS 42 1HE HIS 42 10.798 3.393 14.576
365 HE2 HIS 42 2HE HIS 42 11.227 1.360 16.003
366 HB2 HIS 42 2HB HIS 42 7.219 0.864 12.733
367 HB3 HIS 42 1HB HIS 42 7.355 -0.550 13.774
Start of MODEL 12
1 H1 GLY 1 1H GLY 1 -35.193 2.477 3.375
2 H2 GLY 1 2H GLY 1 -34.121 2.998 4.575
3 H3 GLY 1 3H GLY 1 -34.864 1.485 4.706
4 HA2 GLY 1 1HA GLY 1 -32.951 0.712 3.867
5 HA3 GLY 1 2HA GLY 1 -33.686 1.191 2.345
6 H LYS 2 H LYS 2 -32.134 2.999 4.996
7 HA LYS 2 HA LYS 2 -30.609 4.495 3.001
8 HB2 LYS 2 2HB LYS 2 -31.068 4.934 5.950
9 HB3 LYS 2 1HB LYS 2 -30.005 5.937 4.974
10 HG2 LYS 2 2HG LYS 2 -31.702 7.087 4.098
11 HG3 LYS 2 1HG LYS 2 -32.667 5.635 3.830
12 HD2 LYS 2 2HD LYS 2 -33.339 5.630 6.171
13 HD3 LYS 2 1HD LYS 2 -32.329 7.044 6.479
14 HE2 LYS 2 2HE LYS 2 -34.510 7.082 4.417
15 HE3 LYS 2 1HE LYS 2 -34.843 7.409 6.118
16 HZ1 LYS 2 3HZ LYS 2 -33.215 9.210 6.034
17 HZ2 LYS 2 1HZ LYS 2 -34.462 9.454 4.915
18 HZ3 LYS 2 2HZ LYS 2 -32.949 8.910 4.390
19 H ILE 3 H ILE 3 -30.078 1.658 4.157
20 HA ILE 3 HA ILE 3 -27.631 1.817 5.562
21 HB ILE 3 HB ILE 3 -28.680 -0.492 3.931
22 HG12 ILE 3 2HG1 ILE 3 -29.095 -0.037 6.884
23 HG13 ILE 3 1HG1 ILE 3 -30.274 0.471 5.680
24 HG21 ILE 3 1HG2 ILE 3 -26.245 -0.247 5.023
25 HG22 ILE 3 2HG2 ILE 3 -27.096 -1.784 4.867
26 HG23 ILE 3 3HG2 ILE 3 -27.134 -0.905 6.396
27 HD11 ILE 3 3HD1 ILE 3 -29.998 -2.063 4.931
28 HD12 ILE 3 1HD1 ILE 3 -31.137 -1.554 6.178
29 HD13 ILE 3 2HD1 ILE 3 -29.574 -2.234 6.634
30 HA PRO 4 HA PRO 4 -25.262 2.935 1.867
31 HB2 PRO 4 2HB PRO 4 -22.994 2.846 3.746
32 HB3 PRO 4 1HB PRO 4 -23.568 4.181 2.743
33 HG2 PRO 4 2HG PRO 4 -23.893 4.180 5.406
34 HG3 PRO 4 1HG PRO 4 -25.110 4.872 4.316
35 HD2 PRO 4 2HD PRO 4 -25.106 2.225 5.719
36 HD3 PRO 4 1HD PRO 4 -26.442 3.374 5.482
37 H VAL 5 H VAL 5 -25.843 0.524 1.438
38 HA VAL 5 HA VAL 5 -24.106 -1.548 2.105
39 HB VAL 5 HB VAL 5 -25.562 -1.383 -0.523
40 HG11 VAL 5 1HG1 VAL 5 -24.002 -3.279 -0.003
41 HG12 VAL 5 2HG1 VAL 5 -25.661 -3.745 -0.377
42 HG13 VAL 5 3HG1 VAL 5 -25.104 -3.729 1.297
43 HG21 VAL 5 3HG2 VAL 5 -27.432 -2.534 0.856
44 HG22 VAL 5 1HG2 VAL 5 -27.291 -0.777 0.900
45 HG23 VAL 5 2HG2 VAL 5 -26.668 -1.745 2.235
46 H LYS 6 H LYS 6 -23.997 0.809 -0.503
47 HA LYS 6 HA LYS 6 -21.877 -0.392 -1.947
48 HB2 LYS 6 2HB LYS 6 -22.907 2.444 -1.860
49 HB3 LYS 6 1HB LYS 6 -21.629 1.917 -2.947
50 HG2 LYS 6 2HG LYS 6 -24.369 0.679 -2.882
51 HG3 LYS 6 1HG LYS 6 -23.916 2.009 -3.950
52 HD2 LYS 6 2HD LYS 6 -22.324 0.675 -5.087
53 HD3 LYS 6 1HD LYS 6 -22.408 -0.593 -3.863
54 HE2 LYS 6 2HE LYS 6 -24.794 -0.948 -4.510
55 HE3 LYS 6 1HE LYS 6 -24.547 0.186 -5.837
56 HZ1 LYS 6 3HZ LYS 6 -24.043 -1.690 -6.944
57 HZ2 LYS 6 1HZ LYS 6 -23.635 -2.555 -5.548
58 HZ3 LYS 6 2HZ LYS 6 -22.521 -1.485 -6.237
59 H ALA 7 H ALA 7 -22.016 1.790 0.778
60 HA ALA 7 HA ALA 7 -19.331 2.670 0.721
61 HB1 ALA 7 3HB ALA 7 -20.649 2.401 3.351
62 HB2 ALA 7 1HB ALA 7 -21.480 3.391 2.153
63 HB3 ALA 7 2HB ALA 7 -19.827 3.783 2.626
64 H ILE 8 H ILE 8 -20.919 -0.090 2.260
65 HA ILE 8 HA ILE 8 -18.602 -0.974 3.662
66 HB ILE 8 HB ILE 8 -20.903 -2.740 2.868
67 HG12 ILE 8 2HG1 ILE 8 -21.127 -1.489 5.495
68 HG13 ILE 8 1HG1 ILE 8 -21.223 -0.321 4.187
69 HG21 ILE 8 1HG2 ILE 8 -18.987 -2.715 5.190
70 HG22 ILE 8 2HG2 ILE 8 -19.095 -3.910 3.897
71 HG23 ILE 8 3HG2 ILE 8 -20.395 -3.773 5.081
72 HD11 ILE 8 3HD1 ILE 8 -23.361 -0.845 4.014
73 HD12 ILE 8 1HD1 ILE 8 -23.177 -2.221 5.104
74 HD13 ILE 8 2HD1 ILE 8 -22.856 -2.413 3.379
75 H LYS 9 H LYS 9 -20.193 -2.003 0.671
76 HA LYS 9 HA LYS 9 -18.478 -4.106 0.022
77 HB2 LYS 9 2HB LYS 9 -20.684 -2.878 -1.146
78 HB3 LYS 9 1HB LYS 9 -19.398 -2.663 -2.324
79 HG2 LYS 9 2HG LYS 9 -19.007 -5.230 -1.830
80 HG3 LYS 9 1HG LYS 9 -20.708 -5.147 -1.371
81 HD2 LYS 9 2HD LYS 9 -19.730 -4.022 -3.977
82 HD3 LYS 9 1HD LYS 9 -20.142 -5.730 -3.806
83 HE2 LYS 9 2HE LYS 9 -22.272 -4.341 -2.653
84 HE3 LYS 9 1HE LYS 9 -21.872 -3.441 -4.115
85 HZ1 LYS 9 3HZ LYS 9 -21.818 -5.919 -5.056
86 HZ2 LYS 9 1HZ LYS 9 -23.222 -4.973 -5.037
87 HZ3 LYS 9 2HZ LYS 9 -22.959 -6.123 -3.824
88 H GLN 10 H GLN 10 -18.392 -0.746 -1.122
89 HA GLN 10 HA GLN 10 -15.996 -0.989 -2.572
90 HB2 GLN 10 2HB GLN 10 -15.959 1.433 -2.622
91 HB3 GLN 10 1HB GLN 10 -17.611 0.872 -2.849
92 HG2 GLN 10 2HG GLN 10 -18.132 2.379 -1.296
93 HG3 GLN 10 1HG GLN 10 -17.503 1.199 -0.148
94 HE21 GLN 10 1HE2 GLN 10 -16.241 2.100 1.299
95 HE22 GLN 10 2HE2 GLN 10 -15.132 3.395 1.027
96 H ALA 11 H ALA 11 -16.652 -0.395 0.805
97 HA ALA 11 HA ALA 11 -14.068 0.526 1.523
98 HB1 ALA 11 3HB ALA 11 -16.216 -0.773 3.190
99 HB2 ALA 11 1HB ALA 11 -15.957 0.956 2.960
100 HB3 ALA 11 2HB ALA 11 -14.766 -0.004 3.836
101 H GLY 12 H GLY 12 -15.535 -2.653 1.256
102 HA2 GLY 12 2HA GLY 12 -13.447 -4.085 2.554
103 HA3 GLY 12 1HA GLY 12 -14.663 -4.770 1.484
104 H LYS 13 H LYS 13 -13.921 -2.946 -0.712
105 HA LYS 13 HA LYS 13 -11.932 -4.594 -1.913
106 HB2 LYS 13 2HB LYS 13 -13.831 -2.649 -2.768
107 HB3 LYS 13 1HB LYS 13 -12.254 -2.164 -3.376
108 HG2 LYS 13 2HG LYS 13 -13.264 -3.508 -5.040
109 HG3 LYS 13 1HG LYS 13 -11.995 -4.480 -4.293
110 HD2 LYS 13 2HD LYS 13 -13.712 -5.548 -2.864
111 HD3 LYS 13 1HD LYS 13 -14.954 -4.636 -3.723
112 HE2 LYS 13 2HE LYS 13 -14.348 -5.719 -5.806
113 HE3 LYS 13 1HE LYS 13 -13.030 -6.573 -5.007
114 HZ1 LYS 13 3HZ LYS 13 -15.028 -7.358 -3.489
115 HZ2 LYS 13 1HZ LYS 13 -14.611 -8.170 -4.912
116 HZ3 LYS 13 2HZ LYS 13 -15.903 -7.079 -4.909
117 H VAL 14 H VAL 14 -11.951 -1.321 -0.573
118 HA VAL 14 HA VAL 14 -9.405 -0.517 -1.359
119 HB VAL 14 HB VAL 14 -10.638 0.242 1.280
120 HG11 VAL 14 1HG1 VAL 14 -9.031 1.843 -0.695
121 HG12 VAL 14 2HG1 VAL 14 -8.353 1.021 0.710
122 HG13 VAL 14 3HG1 VAL 14 -9.515 2.329 0.930
123 HG21 VAL 14 3HG2 VAL 14 -11.524 2.169 -0.398
124 HG22 VAL 14 1HG2 VAL 14 -12.484 0.776 0.098
125 HG23 VAL 14 2HG2 VAL 14 -11.630 0.755 -1.446
126 H ILE 15 H ILE 15 -10.468 -2.516 1.320
127 HA ILE 15 HA ILE 15 -7.986 -2.531 2.712
128 HB ILE 15 HB ILE 15 -10.160 -4.625 2.830
129 HG12 ILE 15 2HG1 ILE 15 -9.863 -2.258 4.676
130 HG13 ILE 15 1HG1 ILE 15 -10.874 -2.196 3.234
131 HG21 ILE 15 1HG2 ILE 15 -7.882 -3.896 4.654
132 HG22 ILE 15 2HG2 ILE 15 -8.220 -5.449 3.890
133 HG23 ILE 15 3HG2 ILE 15 -9.261 -4.861 5.185
134 HD11 ILE 15 3HD1 ILE 15 -11.447 -4.533 4.827
135 HD12 ILE 15 1HD1 ILE 15 -12.525 -3.258 4.259
136 HD13 ILE 15 2HD1 ILE 15 -11.620 -3.046 5.758
137 H GLY 16 H GLY 16 -9.355 -4.416 0.106
138 HA2 GLY 16 2HA GLY 16 -7.330 -6.473 0.244
139 HA3 GLY 16 1HA GLY 16 -8.560 -6.297 -1.000
140 H LYS 17 H LYS 17 -8.021 -3.697 -1.856
141 HA LYS 17 HA LYS 17 -5.964 -4.137 -3.707
142 HB2 LYS 17 2HB LYS 17 -7.947 -2.439 -3.732
143 HB3 LYS 17 1HB LYS 17 -6.810 -1.369 -2.921
144 HG2 LYS 17 2HG LYS 17 -5.319 -1.419 -4.771
145 HG3 LYS 17 1HG LYS 17 -6.229 -2.715 -5.546
146 HD2 LYS 17 2HD LYS 17 -7.279 -1.097 -6.678
147 HD3 LYS 17 1HD LYS 17 -8.128 -0.755 -5.168
148 HE2 LYS 17 2HE LYS 17 -6.593 0.966 -4.599
149 HE3 LYS 17 1HE LYS 17 -5.484 0.493 -5.887
150 HZ1 LYS 17 3HZ LYS 17 -7.694 1.010 -7.283
151 HZ2 LYS 17 1HZ LYS 17 -6.496 2.163 -6.971
152 HZ3 LYS 17 2HZ LYS 17 -7.889 2.110 -6.012
153 H GLY 18 H GLY 18 -6.014 -2.380 -0.650
154 HA2 GLY 18 2HA GLY 18 -3.358 -1.375 -0.854
155 HA3 GLY 18 1HA GLY 18 -4.316 -1.470 0.616
156 H LEU 19 H LEU 19 -4.756 -4.334 0.408
157 HA LEU 19 HA LEU 19 -2.425 -5.217 1.778
158 HG LEU 19 HG LEU 19 -2.480 -7.565 2.466
159 HB2 LEU 19 2HB LEU 19 -4.694 -6.062 2.259
160 HB3 LEU 19 1HB LEU 19 -4.732 -6.828 0.682
161 HD11 LEU 19 1HD1 LEU 19 -4.254 -9.388 3.288
162 HD12 LEU 19 2HD1 LEU 19 -5.326 -7.996 3.131
163 HD13 LEU 19 3HD1 LEU 19 -3.912 -7.906 4.182
164 HD21 LEU 19 3HD2 LEU 19 -2.461 -9.485 1.240
165 HD22 LEU 19 1HD2 LEU 19 -3.207 -8.409 0.058
166 HD23 LEU 19 2HD2 LEU 19 -4.211 -9.494 1.020
167 H ARG 20 H ARG 20 -3.636 -5.553 -1.495
168 HA ARG 20 HA ARG 20 -1.813 -7.558 -2.334
169 HE ARG 20 HE ARG 20 -0.922 -9.088 -5.588
170 HB2 ARG 20 2HB ARG 20 -3.867 -7.094 -3.571
171 HB3 ARG 20 1HB ARG 20 -3.298 -5.473 -3.942
172 HG2 ARG 20 2HG ARG 20 -2.508 -6.311 -5.838
173 HG3 ARG 20 1HG ARG 20 -1.269 -7.110 -4.866
174 HD2 ARG 20 2HD ARG 20 -3.413 -8.800 -4.603
175 HD3 ARG 20 1HD ARG 20 -3.584 -8.228 -6.261
176 HH11 ARG 20 1HH1 ARG 20 -4.054 -10.096 -6.752
177 HH12 ARG 20 2HH1 ARG 20 -3.441 -11.499 -7.561
178 HH21 ARG 20 1HH2 ARG 20 -0.113 -10.933 -6.652
179 HH22 ARG 20 2HH2 ARG 20 -1.203 -11.973 -7.504
180 H ALA 21 H ALA 21 -1.705 -4.048 -2.257
181 HA ALA 21 HA ALA 21 0.681 -3.780 -3.780
182 HB1 ALA 21 3HB ALA 21 -0.362 -1.772 -3.767
183 HB2 ALA 21 1HB ALA 21 0.658 -1.510 -2.354
184 HB3 ALA 21 2HB ALA 21 -1.022 -2.004 -2.147
185 H ILE 22 H ILE 22 -0.002 -3.841 -0.312
186 HA ILE 22 HA ILE 22 2.665 -3.455 0.540
187 HB ILE 22 HB ILE 22 0.462 -4.891 2.025
188 HG12 ILE 22 2HG1 ILE 22 1.182 -2.007 2.427
189 HG13 ILE 22 1HG1 ILE 22 0.087 -2.459 1.124
190 HG21 ILE 22 1HG2 ILE 22 1.686 -4.279 4.027
191 HG22 ILE 22 2HG2 ILE 22 2.914 -3.469 3.054
192 HG23 ILE 22 3HG2 ILE 22 2.715 -5.219 2.947
193 HD11 ILE 22 3HD1 ILE 22 -1.555 -2.354 2.602
194 HD12 ILE 22 1HD1 ILE 22 -0.419 -2.189 3.941
195 HD13 ILE 22 2HD1 ILE 22 -0.878 -3.792 3.367
196 H ASN 23 H ASN 23 0.883 -6.255 -0.514
197 HA ASN 23 HA ASN 23 2.635 -8.222 0.553
198 HB2 ASN 23 2HB ASN 23 0.175 -8.265 -0.685
199 HB3 ASN 23 1HB ASN 23 1.227 -8.963 -1.911
200 HD21 ASN 23 1HD2 ASN 23 -0.626 -10.575 -0.993
201 HD22 ASN 23 2HD2 ASN 23 0.017 -11.748 0.101
202 H ILE 24 H ILE 24 2.392 -6.598 -2.583
203 HA ILE 24 HA ILE 24 4.567 -8.054 -3.747
204 HB ILE 24 HB ILE 24 3.420 -5.416 -4.669
205 HG12 ILE 24 2HG1 ILE 24 2.605 -8.103 -5.741
206 HG13 ILE 24 1HG1 ILE 24 1.800 -7.426 -4.328
207 HG21 ILE 24 1HG2 ILE 24 4.813 -7.579 -6.237
208 HG22 ILE 24 2HG2 ILE 24 5.598 -6.118 -5.639
209 HG23 ILE 24 3HG2 ILE 24 4.297 -5.997 -6.824
210 HD11 ILE 24 3HD1 ILE 24 2.000 -6.070 -7.006
211 HD12 ILE 24 1HD1 ILE 24 1.097 -5.508 -5.600
212 HD13 ILE 24 2HD1 ILE 24 0.607 -6.985 -6.430
213 H ALA 25 H ALA 25 4.219 -5.061 -1.974
214 HA ALA 25 HA ALA 25 6.782 -3.998 -2.607
215 HB1 ALA 25 3HB ALA 25 6.206 -2.767 -0.296
216 HB2 ALA 25 1HB ALA 25 4.596 -3.338 -0.732
217 HB3 ALA 25 2HB ALA 25 5.495 -2.302 -1.840
218 H GLY 26 H GLY 26 5.536 -6.097 -0.073
219 HA2 GLY 26 2HA GLY 26 7.726 -6.012 1.677
220 HA3 GLY 26 1HA GLY 26 6.599 -7.352 1.527
221 H THR 27 H THR 27 7.210 -7.834 -1.275
222 HA THR 27 HA THR 27 9.360 -9.645 -0.938
223 HB THR 27 HB THR 27 8.076 -8.664 -3.497
224 HG1 THR 27 1HG THR 27 6.833 -10.577 -3.267
225 HG21 THR 27 3HG2 THR 27 9.439 -11.300 -3.061
226 HG22 THR 27 1HG2 THR 27 10.264 -9.897 -3.738
227 HG23 THR 27 2HG2 THR 27 8.874 -10.593 -4.573
228 H THR 28 H THR 28 9.084 -6.461 -2.427
229 HA THR 28 HA THR 28 11.640 -6.377 -3.604
230 HB THR 28 HB THR 28 10.508 -3.842 -2.565
231 HG1 THR 28 1HG THR 28 8.804 -3.915 -4.066
232 HG21 THR 28 3HG2 THR 28 12.344 -4.196 -4.366
233 HG22 THR 28 1HG2 THR 28 11.120 -2.946 -4.584
234 HG23 THR 28 2HG2 THR 28 10.972 -4.484 -5.435
235 H HIS 29 H HIS 29 10.494 -5.662 -0.367
236 HA HIS 29 HA HIS 29 12.761 -4.327 0.608
237 HD1 HIS 29 1HD HIS 29 13.724 -3.727 2.313
238 HD2 HIS 29 2HD HIS 29 10.031 -3.680 4.215
239 HE1 HIS 29 1HE HIS 29 13.914 -1.973 4.108
240 HE2 HIS 29 2HE HIS 29 11.694 -2.022 5.299
241 HB2 HIS 29 2HB HIS 29 10.328 -4.943 1.642
242 HB3 HIS 29 1HB HIS 29 11.341 -6.096 2.504
243 H ASP 30 H ASP 30 12.085 -7.713 0.114
244 HA ASP 30 HA ASP 30 14.217 -8.721 1.708
245 HB2 ASP 30 2HB ASP 30 12.050 -9.803 0.324
246 HB3 ASP 30 1HB ASP 30 13.460 -10.444 -0.508
247 H VAL 31 H VAL 31 13.810 -8.367 -1.812
248 HA VAL 31 HA VAL 31 16.280 -9.223 -2.653
249 HB VAL 31 HB VAL 31 14.885 -6.860 -3.893
250 HG11 VAL 31 1HG1 VAL 31 16.853 -7.227 -5.042
251 HG12 VAL 31 2HG1 VAL 31 15.695 -8.180 -5.966
252 HG13 VAL 31 3HG1 VAL 31 16.775 -8.974 -4.823
253 HG21 VAL 31 3HG2 VAL 31 13.727 -8.727 -5.266
254 HG22 VAL 31 1HG2 VAL 31 13.086 -8.316 -3.675
255 HG23 VAL 31 2HG2 VAL 31 14.093 -9.750 -3.877
256 H VAL 32 H VAL 32 15.360 -6.048 -1.435
257 HA VAL 32 HA VAL 32 17.837 -4.777 -1.995
258 HB VAL 32 HB VAL 32 15.820 -4.012 0.119
259 HG11 VAL 32 1HG1 VAL 32 17.640 -2.686 0.570
260 HG12 VAL 32 2HG1 VAL 32 16.789 -1.688 -0.609
261 HG13 VAL 32 3HG1 VAL 32 18.173 -2.657 -1.111
262 HG21 VAL 32 3HG2 VAL 32 14.471 -3.102 -1.438
263 HG22 VAL 32 1HG2 VAL 32 15.244 -4.267 -2.514
264 HG23 VAL 32 2HG2 VAL 32 15.818 -2.599 -2.461
265 H SER 33 H SER 33 16.581 -6.590 0.733
266 HA SER 33 HA SER 33 18.628 -5.926 2.572
267 HG SER 33 HG SER 33 17.113 -7.633 4.934
268 HB2 SER 33 2HB SER 33 16.339 -7.024 3.036
269 HB3 SER 33 1HB SER 33 17.128 -8.539 2.601
270 H PHE 34 H PHE 34 18.332 -8.327 0.046
271 HA PHE 34 HA PHE 34 20.445 -10.018 0.780
272 HD1 PHE 34 1HD PHE 34 21.210 -12.260 -0.895
273 HD2 PHE 34 2HD PHE 34 17.163 -10.945 -0.911
274 HE1 PHE 34 1HE PHE 34 20.466 -14.556 -0.420
275 HE2 PHE 34 2HE PHE 34 16.411 -13.238 -0.436
276 HZ PHE 34 HZ PHE 34 18.064 -15.050 -0.190
277 HB2 PHE 34 2HB PHE 34 18.855 -9.504 -1.637
278 HB3 PHE 34 1HB PHE 34 20.480 -10.099 -1.963
279 H PHE 35 H PHE 35 20.376 -6.949 -0.908
280 HA PHE 35 HA PHE 35 23.236 -7.079 -1.462
281 HD1 PHE 35 2HD PHE 35 23.547 -7.075 -4.046
282 HD2 PHE 35 1HD PHE 35 23.146 -3.110 -2.558
283 HE1 PHE 35 2HE PHE 35 25.481 -6.376 -5.399
284 HE2 PHE 35 1HE PHE 35 25.078 -2.403 -3.907
285 HZ PHE 35 HZ PHE 35 26.249 -4.038 -5.330
286 HB2 PHE 35 2HB PHE 35 21.366 -6.120 -3.028
287 HB3 PHE 35 1HB PHE 35 21.535 -4.677 -2.033
288 H ARG 36 H ARG 36 20.982 -5.591 0.728
289 HA ARG 36 HA ARG 36 23.180 -4.622 2.347
290 HE ARG 36 HE ARG 36 22.081 0.319 0.694
291 HB2 ARG 36 2HB ARG 36 22.426 -2.798 0.653
292 HB3 ARG 36 1HB ARG 36 21.015 -2.649 1.694
293 HG2 ARG 36 2HG ARG 36 22.172 -1.648 3.351
294 HG3 ARG 36 1HG ARG 36 23.641 -2.577 3.038
295 HD2 ARG 36 2HD ARG 36 24.240 -0.426 2.403
296 HD3 ARG 36 1HD ARG 36 23.791 -1.181 0.874
297 HH11 ARG 36 1HH1 ARG 36 23.116 0.223 4.024
298 HH12 ARG 36 2HH1 ARG 36 22.099 1.538 4.509
299 HH21 ARG 36 1HH2 ARG 36 20.743 2.048 1.328
300 HH22 ARG 36 2HH2 ARG 36 20.752 2.575 2.978
301 HA PRO 37 HA PRO 37 19.838 -6.629 4.831
302 HB2 PRO 37 2HB PRO 37 22.154 -6.594 6.704
303 HB3 PRO 37 1HB PRO 37 21.018 -7.900 6.341
304 HG2 PRO 37 2HG PRO 37 23.493 -7.946 5.361
305 HG3 PRO 37 1HG PRO 37 22.115 -8.486 4.384
306 HD2 PRO 37 2HD PRO 37 23.664 -5.940 4.233
307 HD3 PRO 37 1HD PRO 37 22.947 -6.905 2.927
308 H LYS 38 H LYS 38 18.434 -5.166 5.589
309 HA LYS 38 HA LYS 38 19.261 -2.701 6.785
310 HB2 LYS 38 2HB LYS 38 16.901 -2.230 7.025
311 HB3 LYS 38 1HB LYS 38 17.199 -2.910 5.431
312 HG2 LYS 38 2HG LYS 38 16.237 -4.972 6.011
313 HG3 LYS 38 1HG LYS 38 16.277 -4.596 7.735
314 HD2 LYS 38 2HD LYS 38 14.647 -3.028 5.748
315 HD3 LYS 38 1HD LYS 38 14.017 -4.428 6.615
316 HE2 LYS 38 2HE LYS 38 15.140 -1.944 7.903
317 HE3 LYS 38 1HE LYS 38 13.426 -2.292 7.696
318 HZ1 LYS 38 3HZ LYS 38 15.365 -3.828 9.336
319 HZ2 LYS 38 1HZ LYS 38 13.771 -4.316 9.045
320 HZ3 LYS 38 2HZ LYS 38 14.076 -2.888 9.900
321 H LYS 39 H LYS 39 18.548 -5.860 7.951
322 HA LYS 39 HA LYS 39 18.675 -6.780 10.027
323 HB2 LYS 39 2HB LYS 39 19.512 -4.068 11.054
324 HB3 LYS 39 1HB LYS 39 19.821 -5.636 11.788
325 HG2 LYS 39 2HG LYS 39 20.872 -5.267 9.063
326 HG3 LYS 39 1HG LYS 39 21.621 -4.285 10.324
327 HD2 LYS 39 2HD LYS 39 22.236 -6.207 11.575
328 HD3 LYS 39 1HD LYS 39 21.234 -7.261 10.576
329 HE2 LYS 39 2HE LYS 39 22.840 -6.216 8.688
330 HE3 LYS 39 1HE LYS 39 23.928 -6.156 10.075
331 HZ1 LYS 39 3HZ LYS 39 24.356 -8.245 9.354
332 HZ2 LYS 39 1HZ LYS 39 22.822 -8.468 8.677
333 HZ3 LYS 39 2HZ LYS 39 23.037 -8.610 10.347
334 H LYS 40 H LYS 40 16.736 -7.314 10.769
335 HA LYS 40 HA LYS 40 14.779 -5.264 11.414
336 HB2 LYS 40 2HB LYS 40 14.716 -8.198 10.949
337 HB3 LYS 40 1HB LYS 40 13.480 -7.525 12.002
338 HG2 LYS 40 2HG LYS 40 13.986 -6.277 9.342
339 HG3 LYS 40 1HG LYS 40 13.044 -7.764 9.450
340 HD2 LYS 40 2HD LYS 40 11.891 -6.292 11.409
341 HD3 LYS 40 1HD LYS 40 12.360 -5.023 10.275
342 HE2 LYS 40 2HE LYS 40 11.146 -6.097 8.495
343 HE3 LYS 40 1HE LYS 40 10.789 -7.483 9.526
344 HZ1 LYS 40 3HZ LYS 40 9.540 -4.863 9.442
345 HZ2 LYS 40 1HZ LYS 40 9.779 -5.507 10.989
346 HZ3 LYS 40 2HZ LYS 40 8.879 -6.367 9.845
347 H LYS 41 H LYS 41 15.634 -8.272 13.082
348 HA LYS 41 HA LYS 41 15.249 -6.904 15.640
349 HB2 LYS 41 2HB LYS 41 14.989 -9.686 14.692
350 HB3 LYS 41 1HB LYS 41 15.645 -9.505 16.313
351 HG2 LYS 41 2HG LYS 41 13.460 -9.578 16.863
352 HG3 LYS 41 1HG LYS 41 13.565 -7.849 16.524
353 HD2 LYS 41 2HD LYS 41 12.580 -8.091 14.408
354 HD3 LYS 41 1HD LYS 41 12.851 -9.834 14.387
355 HE2 LYS 41 2HE LYS 41 11.185 -10.175 16.076
356 HE3 LYS 41 1HE LYS 41 11.015 -8.438 16.325
357 HZ1 LYS 41 3HZ LYS 41 9.283 -9.626 14.896
358 HZ2 LYS 41 1HZ LYS 41 10.470 -9.659 13.692
359 HZ3 LYS 41 2HZ LYS 41 9.928 -8.179 14.304
360 H HIS 42 H HIS 42 17.650 -8.682 13.790
361 HA HIS 42 HA HIS 42 19.725 -7.641 15.566
362 HD1 HIS 42 1HD HIS 42 17.977 -11.807 16.114
363 HD2 HIS 42 2HD HIS 42 20.167 -10.867 12.712
364 HE1 HIS 42 1HE HIS 42 17.372 -13.564 14.419
365 HE2 HIS 42 2HE HIS 42 18.640 -12.921 12.340
366 HB2 HIS 42 2HB HIS 42 20.878 -9.879 15.510
367 HB3 HIS 42 1HB HIS 42 19.403 -9.830 16.469
Start of MODEL 13
1 H1 GLY 1 1H GLY 1 -33.508 8.168 0.957
2 H2 GLY 1 2H GLY 1 -32.678 7.812 2.388
3 H3 GLY 1 3H GLY 1 -33.721 6.667 1.708
4 HA2 GLY 1 1HA GLY 1 -32.070 7.075 -0.345
5 HA3 GLY 1 2HA GLY 1 -30.987 7.333 1.013
6 H LYS 2 H LYS 2 -32.374 5.047 -1.008
7 HA LYS 2 HA LYS 2 -32.625 2.801 0.637
8 HB2 LYS 2 2HB LYS 2 -32.289 1.485 -1.444
9 HB3 LYS 2 1HB LYS 2 -33.474 2.772 -1.622
10 HG2 LYS 2 2HG LYS 2 -32.313 3.085 -3.542
11 HG3 LYS 2 1HG LYS 2 -31.352 4.109 -2.472
12 HD2 LYS 2 2HD LYS 2 -29.617 2.910 -3.245
13 HD3 LYS 2 1HD LYS 2 -30.171 1.687 -2.102
14 HE2 LYS 2 2HE LYS 2 -31.098 1.846 -4.962
15 HE3 LYS 2 1HE LYS 2 -29.740 0.855 -4.431
16 HZ1 LYS 2 3HZ LYS 2 -31.351 -0.684 -4.222
17 HZ2 LYS 2 1HZ LYS 2 -32.594 0.454 -4.046
18 HZ3 LYS 2 2HZ LYS 2 -31.610 0.060 -2.726
19 H ILE 3 H ILE 3 -31.221 1.113 1.152
20 HA ILE 3 HA ILE 3 -28.658 1.755 1.935
21 HB ILE 3 HB ILE 3 -29.492 -1.043 1.204
22 HG12 ILE 3 2HG1 ILE 3 -29.992 -0.566 3.946
23 HG13 ILE 3 1HG1 ILE 3 -30.753 0.756 3.067
24 HG21 ILE 3 1HG2 ILE 3 -27.403 0.212 2.862
25 HG22 ILE 3 2HG2 ILE 3 -27.358 -1.269 1.909
26 HG23 ILE 3 3HG2 ILE 3 -28.141 -1.259 3.489
27 HD11 ILE 3 3HD1 ILE 3 -32.184 -1.265 3.517
28 HD12 ILE 3 1HD1 ILE 3 -31.181 -2.126 2.349
29 HD13 ILE 3 2HD1 ILE 3 -32.117 -0.721 1.842
30 HA PRO 4 HA PRO 4 -26.769 1.600 -2.181
31 HB2 PRO 4 2HB PRO 4 -24.540 2.963 -1.551
32 HB3 PRO 4 1HB PRO 4 -26.094 3.776 -1.774
33 HG2 PRO 4 2HG PRO 4 -24.722 2.984 0.766
34 HG3 PRO 4 1HG PRO 4 -25.558 4.498 0.373
35 HD2 PRO 4 2HD PRO 4 -26.698 2.481 1.819
36 HD3 PRO 4 1HD PRO 4 -27.628 3.611 0.817
37 H VAL 5 H VAL 5 -26.245 -0.553 -2.401
38 HA VAL 5 HA VAL 5 -24.571 -2.049 -0.764
39 HB VAL 5 HB VAL 5 -24.828 -2.494 -3.732
40 HG11 VAL 5 1HG1 VAL 5 -24.918 -4.906 -2.766
41 HG12 VAL 5 2HG1 VAL 5 -24.181 -4.158 -1.348
42 HG13 VAL 5 3HG1 VAL 5 -23.371 -4.072 -2.912
43 HG21 VAL 5 3HG2 VAL 5 -26.888 -2.667 -1.618
44 HG22 VAL 5 1HG2 VAL 5 -26.805 -4.014 -2.753
45 HG23 VAL 5 2HG2 VAL 5 -27.060 -2.374 -3.348
46 H LYS 6 H LYS 6 -23.831 0.179 -3.349
47 HA LYS 6 HA LYS 6 -21.203 -0.626 -3.905
48 HB2 LYS 6 2HB LYS 6 -22.766 1.883 -4.262
49 HB3 LYS 6 1HB LYS 6 -21.018 1.982 -4.418
50 HG2 LYS 6 2HG LYS 6 -21.299 1.394 -6.539
51 HG3 LYS 6 1HG LYS 6 -21.679 -0.223 -5.940
52 HD2 LYS 6 2HD LYS 6 -23.637 0.046 -6.998
53 HD3 LYS 6 1HD LYS 6 -24.067 1.084 -5.637
54 HE2 LYS 6 2HE LYS 6 -22.686 2.105 -8.110
55 HE3 LYS 6 1HE LYS 6 -24.442 2.050 -7.945
56 HZ1 LYS 6 3HZ LYS 6 -23.041 4.163 -7.276
57 HZ2 LYS 6 1HZ LYS 6 -22.928 3.336 -5.804
58 HZ3 LYS 6 2HZ LYS 6 -24.444 3.728 -6.441
59 H ALA 7 H ALA 7 -22.537 1.447 -1.406
60 HA ALA 7 HA ALA 7 -20.168 2.580 -0.443
61 HB1 ALA 7 3HB ALA 7 -21.515 2.594 1.786
62 HB2 ALA 7 1HB ALA 7 -22.837 2.007 0.774
63 HB3 ALA 7 2HB ALA 7 -22.074 3.556 0.419
64 H ILE 8 H ILE 8 -21.888 -0.331 0.693
65 HA ILE 8 HA ILE 8 -19.921 -1.096 2.565
66 HB ILE 8 HB ILE 8 -21.806 -2.986 1.171
67 HG12 ILE 8 2HG1 ILE 8 -22.756 -1.939 3.712
68 HG13 ILE 8 1HG1 ILE 8 -22.572 -0.663 2.518
69 HG21 ILE 8 1HG2 ILE 8 -20.581 -2.981 3.925
70 HG22 ILE 8 2HG2 ILE 8 -20.140 -4.034 2.580
71 HG23 ILE 8 3HG2 ILE 8 -21.735 -4.171 3.322
72 HD11 ILE 8 3HD1 ILE 8 -24.666 -1.264 1.982
73 HD12 ILE 8 1HD1 ILE 8 -24.481 -2.895 2.624
74 HD13 ILE 8 2HD1 ILE 8 -23.839 -2.499 1.031
75 H LYS 9 H LYS 9 -20.547 -2.069 -0.772
76 HA LYS 9 HA LYS 9 -18.552 -4.036 -0.963
77 HB2 LYS 9 2HB LYS 9 -20.526 -3.162 -2.604
78 HB3 LYS 9 1HB LYS 9 -19.120 -2.465 -3.400
79 HG2 LYS 9 2HG LYS 9 -18.249 -4.988 -2.970
80 HG3 LYS 9 1HG LYS 9 -19.979 -5.262 -3.187
81 HD2 LYS 9 2HD LYS 9 -19.410 -3.505 -5.207
82 HD3 LYS 9 1HD LYS 9 -17.936 -4.472 -5.130
83 HE2 LYS 9 2HE LYS 9 -19.246 -6.511 -5.348
84 HE3 LYS 9 1HE LYS 9 -20.737 -5.570 -5.369
85 HZ1 LYS 9 3HZ LYS 9 -20.407 -4.920 -7.491
86 HZ2 LYS 9 1HZ LYS 9 -19.504 -6.349 -7.571
87 HZ3 LYS 9 2HZ LYS 9 -18.722 -4.866 -7.350
88 H GLN 10 H GLN 10 -18.459 -0.555 -1.376
89 HA GLN 10 HA GLN 10 -15.862 -0.429 -2.517
90 HB2 GLN 10 2HB GLN 10 -17.805 1.495 -1.381
91 HB3 GLN 10 1HB GLN 10 -16.120 1.998 -1.366
92 HG2 GLN 10 2HG GLN 10 -17.223 0.894 -3.890
93 HG3 GLN 10 1HG GLN 10 -17.716 2.515 -3.399
94 HE21 GLN 10 1HE2 GLN 10 -14.899 0.485 -4.015
95 HE22 GLN 10 2HE2 GLN 10 -13.857 1.769 -4.513
96 H ALA 11 H ALA 11 -17.094 -0.390 0.769
97 HA ALA 11 HA ALA 11 -14.666 0.339 2.036
98 HB1 ALA 11 3HB ALA 11 -16.910 -1.263 3.246
99 HB2 ALA 11 1HB ALA 11 -16.948 0.490 3.056
100 HB3 ALA 11 2HB ALA 11 -15.729 -0.259 4.085
101 H GLY 12 H GLY 12 -16.053 -2.722 1.033
102 HA2 GLY 12 2HA GLY 12 -14.204 -4.371 2.447
103 HA3 GLY 12 1HA GLY 12 -15.245 -4.878 1.126
104 H LYS 13 H LYS 13 -14.138 -2.755 -0.637
105 HA LYS 13 HA LYS 13 -11.961 -4.295 -1.695
106 HB2 LYS 13 2HB LYS 13 -13.769 -2.292 -2.651
107 HB3 LYS 13 1HB LYS 13 -12.124 -1.773 -2.994
108 HG2 LYS 13 2HG LYS 13 -12.679 -2.962 -4.887
109 HG3 LYS 13 1HG LYS 13 -11.815 -4.164 -3.926
110 HD2 LYS 13 2HD LYS 13 -13.640 -5.445 -3.673
111 HD3 LYS 13 1HD LYS 13 -14.691 -4.056 -3.392
112 HE2 LYS 13 2HE LYS 13 -13.644 -4.758 -6.122
113 HE3 LYS 13 1HE LYS 13 -15.136 -5.444 -5.481
114 HZ1 LYS 13 3HZ LYS 13 -16.048 -3.240 -5.262
115 HZ2 LYS 13 1HZ LYS 13 -15.520 -3.470 -6.853
116 HZ3 LYS 13 2HZ LYS 13 -14.598 -2.540 -5.785
117 H VAL 14 H VAL 14 -12.315 -1.182 -0.068
118 HA VAL 14 HA VAL 14 -9.727 -0.213 -0.385
119 HB VAL 14 HB VAL 14 -11.355 0.197 2.114
120 HG11 VAL 14 1HG1 VAL 14 -10.330 2.580 1.534
121 HG12 VAL 14 2HG1 VAL 14 -9.127 1.566 0.740
122 HG13 VAL 14 3HG1 VAL 14 -9.448 1.368 2.462
123 HG21 VAL 14 3HG2 VAL 14 -13.031 1.012 0.898
124 HG22 VAL 14 1HG2 VAL 14 -12.124 0.790 -0.598
125 HG23 VAL 14 2HG2 VAL 14 -11.939 2.276 0.333
126 H ILE 15 H ILE 15 -11.036 -2.576 1.840
127 HA ILE 15 HA ILE 15 -8.875 -2.646 3.658
128 HB ILE 15 HB ILE 15 -10.732 -4.925 2.965
129 HG12 ILE 15 2HG1 ILE 15 -11.171 -3.101 5.295
130 HG13 ILE 15 1HG1 ILE 15 -11.686 -2.570 3.697
131 HG21 ILE 15 1HG2 ILE 15 -9.269 -5.968 4.333
132 HG22 ILE 15 2HG2 ILE 15 -10.215 -5.175 5.594
133 HG23 ILE 15 3HG2 ILE 15 -8.698 -4.461 5.050
134 HD11 ILE 15 3HD1 ILE 15 -12.768 -5.017 3.723
135 HD12 ILE 15 1HD1 ILE 15 -13.596 -3.579 4.319
136 HD13 ILE 15 2HD1 ILE 15 -12.788 -4.663 5.450
137 H GLY 16 H GLY 16 -9.558 -4.416 0.675
138 HA2 GLY 16 2HA GLY 16 -7.318 -6.168 0.891
139 HA3 GLY 16 1HA GLY 16 -8.273 -5.877 -0.556
140 H LYS 17 H LYS 17 -7.767 -2.957 -0.397
141 HA LYS 17 HA LYS 17 -5.543 -2.825 -2.092
142 HB2 LYS 17 2HB LYS 17 -7.447 -1.133 -1.797
143 HB3 LYS 17 1HB LYS 17 -6.522 -0.506 -0.439
144 HG2 LYS 17 2HG LYS 17 -4.636 -0.071 -1.949
145 HG3 LYS 17 1HG LYS 17 -5.606 -0.650 -3.304
146 HD2 LYS 17 2HD LYS 17 -7.290 1.176 -2.260
147 HD3 LYS 17 1HD LYS 17 -5.740 1.898 -1.822
148 HE2 LYS 17 2HE LYS 17 -5.125 2.229 -4.005
149 HE3 LYS 17 1HE LYS 17 -6.109 0.895 -4.599
150 HZ1 LYS 17 3HZ LYS 17 -7.559 3.124 -3.433
151 HZ2 LYS 17 1HZ LYS 17 -7.913 2.200 -4.804
152 HZ3 LYS 17 2HZ LYS 17 -6.774 3.446 -4.896
153 H GLY 18 H GLY 18 -5.850 -2.333 1.380
154 HA2 GLY 18 2HA GLY 18 -3.198 -1.382 1.781
155 HA3 GLY 18 1HA GLY 18 -4.269 -2.014 3.023
156 H LEU 19 H LEU 19 -4.667 -4.579 1.813
157 HA LEU 19 HA LEU 19 -2.410 -5.939 2.870
158 HG LEU 19 HG LEU 19 -4.521 -6.490 4.063
159 HB2 LEU 19 2HB LEU 19 -4.901 -6.756 1.436
160 HB3 LEU 19 1HB LEU 19 -3.608 -7.924 1.623
161 HD11 LEU 19 1HD1 LEU 19 -6.071 -8.752 2.810
162 HD12 LEU 19 2HD1 LEU 19 -6.616 -7.078 2.932
163 HD13 LEU 19 3HD1 LEU 19 -6.363 -8.033 4.395
164 HD21 LEU 19 3HD2 LEU 19 -2.645 -8.227 3.869
165 HD22 LEU 19 1HD2 LEU 19 -3.940 -9.409 3.692
166 HD23 LEU 19 2HD2 LEU 19 -3.831 -8.433 5.157
167 H ARG 20 H ARG 20 -3.372 -4.953 -0.341
168 HA ARG 20 HA ARG 20 -1.499 -6.590 -1.740
169 HE ARG 20 HE ARG 20 -2.907 -5.637 -7.067
170 HB2 ARG 20 2HB ARG 20 -3.593 -5.570 -2.716
171 HB3 ARG 20 1HB ARG 20 -2.756 -4.024 -2.712
172 HG2 ARG 20 2HG ARG 20 -0.962 -5.188 -4.103
173 HG3 ARG 20 1HG ARG 20 -2.150 -6.475 -4.327
174 HD2 ARG 20 2HD ARG 20 -3.744 -4.712 -5.151
175 HD3 ARG 20 1HD ARG 20 -2.388 -3.584 -5.138
176 HH11 ARG 20 1HH1 ARG 20 -0.402 -3.733 -5.557
177 HH12 ARG 20 2HH1 ARG 20 0.692 -3.890 -6.890
178 HH21 ARG 20 1HH2 ARG 20 -1.471 -5.844 -8.820
179 HH22 ARG 20 2HH2 ARG 20 0.085 -5.089 -8.743
180 H ALA 21 H ALA 21 -1.463 -3.340 -0.414
181 HA ALA 21 HA ALA 21 0.992 -2.552 -1.620
182 HB1 ALA 21 3HB ALA 21 0.225 -1.280 0.925
183 HB2 ALA 21 1HB ALA 21 -0.971 -1.197 -0.370
184 HB3 ALA 21 2HB ALA 21 0.652 -0.555 -0.626
185 H ILE 22 H ILE 22 0.111 -3.917 1.512
186 HA ILE 22 HA ILE 22 2.697 -3.790 2.654
187 HB ILE 22 HB ILE 22 0.513 -5.762 3.336
188 HG12 ILE 22 2HG1 ILE 22 0.906 -3.273 4.914
189 HG13 ILE 22 1HG1 ILE 22 0.121 -3.106 3.347
190 HG21 ILE 22 1HG2 ILE 22 3.079 -5.708 4.234
191 HG22 ILE 22 2HG2 ILE 22 1.712 -6.355 5.138
192 HG23 ILE 22 3HG2 ILE 22 2.266 -4.709 5.438
193 HD11 ILE 22 3HD1 ILE 22 -0.848 -4.353 5.833
194 HD12 ILE 22 1HD1 ILE 22 -1.288 -5.156 4.326
195 HD13 ILE 22 2HD1 ILE 22 -1.723 -3.467 4.583
196 H ASN 23 H ASN 23 1.117 -6.058 0.531
197 HA ASN 23 HA ASN 23 2.874 -8.244 0.915
198 HB2 ASN 23 2HB ASN 23 0.531 -7.893 -0.428
199 HB3 ASN 23 1HB ASN 23 1.678 -7.933 -1.765
200 HD21 ASN 23 1HD2 ASN 23 1.854 -9.863 -2.611
201 HD22 ASN 23 2HD2 ASN 23 1.793 -11.366 -1.760
202 H ILE 24 H ILE 24 2.890 -5.480 -1.278
203 HA ILE 24 HA ILE 24 5.082 -6.342 -2.857
204 HB ILE 24 HB ILE 24 4.179 -3.503 -2.364
205 HG12 ILE 24 2HG1 ILE 24 3.369 -5.199 -4.710
206 HG13 ILE 24 1HG1 ILE 24 2.452 -5.251 -3.208
207 HG21 ILE 24 1HG2 ILE 24 6.144 -3.206 -3.475
208 HG22 ILE 24 2HG2 ILE 24 5.078 -3.456 -4.856
209 HG23 ILE 24 3HG2 ILE 24 6.070 -4.785 -4.257
210 HD11 ILE 24 3HD1 ILE 24 1.472 -3.291 -3.614
211 HD12 ILE 24 1HD1 ILE 24 2.011 -3.536 -5.274
212 HD13 ILE 24 2HD1 ILE 24 2.971 -2.549 -4.171
213 H ALA 25 H ALA 25 4.815 -4.616 0.172
214 HA ALA 25 HA ALA 25 7.416 -3.551 0.295
215 HB1 ALA 25 3HB ALA 25 6.843 -2.850 2.365
216 HB2 ALA 25 1HB ALA 25 6.197 -4.423 2.837
217 HB3 ALA 25 2HB ALA 25 5.227 -3.332 1.848
218 H GLY 26 H GLY 26 6.147 -6.739 0.966
219 HA2 GLY 26 2HA GLY 26 8.398 -7.711 2.413
220 HA3 GLY 26 1HA GLY 26 7.162 -8.692 1.641
221 H THR 27 H THR 27 7.610 -7.538 -0.999
222 HA THR 27 HA THR 27 9.605 -9.328 -1.908
223 HB THR 27 HB THR 27 8.318 -7.010 -3.362
224 HG1 THR 27 1HG THR 27 6.634 -8.230 -3.397
225 HG21 THR 27 3HG2 THR 27 8.804 -9.033 -5.173
226 HG22 THR 27 1HG2 THR 27 10.282 -8.950 -4.214
227 HG23 THR 27 2HG2 THR 27 9.681 -7.508 -5.033
228 H THR 28 H THR 28 9.533 -5.790 -1.589
229 HA THR 28 HA THR 28 12.074 -5.262 -2.621
230 HB THR 28 HB THR 28 11.167 -3.594 -0.346
231 HG1 THR 28 1HG THR 28 9.425 -2.779 -1.531
232 HG21 THR 28 3HG2 THR 28 11.309 -1.854 -2.244
233 HG22 THR 28 1HG2 THR 28 12.163 -3.126 -3.119
234 HG23 THR 28 2HG2 THR 28 12.795 -2.532 -1.583
235 H HIS 29 H HIS 29 11.048 -6.296 0.567
236 HA HIS 29 HA HIS 29 13.442 -5.813 1.955
237 HD1 HIS 29 1HD HIS 29 14.466 -6.183 3.638
238 HD2 HIS 29 2HD HIS 29 10.893 -7.071 5.566
239 HE1 HIS 29 1HE HIS 29 14.876 -5.701 6.074
240 HE2 HIS 29 2HE HIS 29 12.674 -6.159 7.206
241 HB2 HIS 29 2HB HIS 29 10.984 -6.682 2.678
242 HB3 HIS 29 1HB HIS 29 11.876 -8.199 2.738
243 H ASP 30 H ASP 30 12.545 -8.277 -0.305
244 HA ASP 30 HA ASP 30 14.777 -9.991 0.444
245 HB2 ASP 30 2HB ASP 30 12.262 -10.456 -0.688
246 HB3 ASP 30 1HB ASP 30 13.404 -10.749 -1.996
247 H VAL 31 H VAL 31 13.630 -8.321 -2.492
248 HA VAL 31 HA VAL 31 15.759 -8.797 -4.153
249 HB VAL 31 HB VAL 31 14.345 -6.142 -4.054
250 HG11 VAL 31 1HG1 VAL 31 15.886 -5.941 -5.716
251 HG12 VAL 31 2HG1 VAL 31 14.570 -6.683 -6.627
252 HG13 VAL 31 3HG1 VAL 31 15.910 -7.673 -6.051
253 HG21 VAL 31 3HG2 VAL 31 13.283 -8.822 -4.665
254 HG22 VAL 31 1HG2 VAL 31 12.903 -7.564 -5.840
255 HG23 VAL 31 2HG2 VAL 31 12.446 -7.359 -4.149
256 H VAL 32 H VAL 32 15.339 -5.794 -2.304
257 HA VAL 32 HA VAL 32 17.836 -4.702 -2.762
258 HB VAL 32 HB VAL 32 16.265 -4.421 -0.199
259 HG11 VAL 32 1HG1 VAL 32 18.340 -3.426 0.175
260 HG12 VAL 32 2HG1 VAL 32 17.328 -2.082 -0.352
261 HG13 VAL 32 3HG1 VAL 32 18.458 -2.829 -1.480
262 HG21 VAL 32 3HG2 VAL 32 15.699 -2.216 -1.724
263 HG22 VAL 32 1HG2 VAL 32 14.649 -3.618 -1.526
264 HG23 VAL 32 2HG2 VAL 32 15.720 -3.510 -2.922
265 H SER 33 H SER 33 16.949 -7.295 -0.634
266 HA SER 33 HA SER 33 19.233 -7.182 1.059
267 HG SER 33 HG SER 33 17.565 -8.805 3.059
268 HB2 SER 33 2HB SER 33 16.867 -8.570 1.103
269 HB3 SER 33 1HB SER 33 18.020 -9.834 0.674
270 H PHE 34 H PHE 34 18.542 -8.662 -2.031
271 HA PHE 34 HA PHE 34 21.050 -10.144 -2.012
272 HD1 PHE 34 1HD PHE 34 21.527 -12.410 -3.415
273 HD2 PHE 34 2HD PHE 34 17.436 -11.747 -2.448
274 HE1 PHE 34 1HE PHE 34 21.368 -14.702 -2.530
275 HE2 PHE 34 2HE PHE 34 17.268 -14.038 -1.562
276 HZ PHE 34 HZ PHE 34 19.238 -15.518 -1.602
277 HB2 PHE 34 2HB PHE 34 18.588 -10.152 -3.668
278 HB3 PHE 34 1HB PHE 34 20.088 -10.573 -4.490
279 H PHE 35 H PHE 35 19.690 -7.227 -3.315
280 HA PHE 35 HA PHE 35 21.423 -6.768 -5.458
281 HD1 PHE 35 2HD PHE 35 22.312 -4.067 -6.094
282 HD2 PHE 35 1HD PHE 35 18.163 -5.007 -6.209
283 HE1 PHE 35 2HE PHE 35 22.177 -3.177 -8.385
284 HE2 PHE 35 1HE PHE 35 18.022 -4.121 -8.500
285 HZ PHE 35 HZ PHE 35 20.030 -3.204 -9.591
286 HB2 PHE 35 2HB PHE 35 19.333 -5.405 -4.285
287 HB3 PHE 35 1HB PHE 35 20.707 -4.354 -3.957
288 H ARG 36 H ARG 36 21.748 -5.940 -2.027
289 HA ARG 36 HA ARG 36 24.123 -4.474 -2.208
290 HE ARG 36 HE ARG 36 23.623 -1.467 1.976
291 HB2 ARG 36 2HB ARG 36 22.653 -5.882 -0.059
292 HB3 ARG 36 1HB ARG 36 24.356 -5.570 0.246
293 HG2 ARG 36 2HG ARG 36 23.099 -3.216 -0.812
294 HG3 ARG 36 1HG ARG 36 22.202 -3.816 0.583
295 HD2 ARG 36 2HD ARG 36 24.779 -4.045 1.442
296 HD3 ARG 36 1HD ARG 36 24.869 -2.606 0.425
297 HH11 ARG 36 1HH1 ARG 36 23.429 -4.886 2.648
298 HH12 ARG 36 2HH1 ARG 36 22.631 -4.668 4.169
299 HH21 ARG 36 1HH2 ARG 36 22.575 -1.179 3.977
300 HH22 ARG 36 2HH2 ARG 36 22.144 -2.564 4.925
301 HA PRO 37 HA PRO 37 26.606 -8.494 -1.319
302 HB2 PRO 37 2HB PRO 37 25.298 -10.866 -1.290
303 HB3 PRO 37 1HB PRO 37 25.463 -9.849 0.148
304 HG2 PRO 37 2HG PRO 37 23.141 -10.123 -1.724
305 HG3 PRO 37 1HG PRO 37 23.147 -10.048 0.049
306 HD2 PRO 37 2HD PRO 37 22.553 -7.907 -1.506
307 HD3 PRO 37 1HD PRO 37 23.340 -7.755 0.077
308 H LYS 38 H LYS 38 26.770 -10.894 -2.553
309 HA LYS 38 HA LYS 38 27.082 -11.955 -4.538
310 HB2 LYS 38 2HB LYS 38 24.598 -10.492 -4.923
311 HB3 LYS 38 1HB LYS 38 25.484 -10.682 -6.428
312 HG2 LYS 38 2HG LYS 38 23.999 -12.519 -6.236
313 HG3 LYS 38 1HG LYS 38 25.627 -13.129 -5.937
314 HD2 LYS 38 2HD LYS 38 25.187 -12.948 -3.499
315 HD3 LYS 38 1HD LYS 38 23.526 -12.481 -3.871
316 HE2 LYS 38 2HE LYS 38 22.947 -14.580 -4.574
317 HE3 LYS 38 1HE LYS 38 24.589 -14.984 -5.074
318 HZ1 LYS 38 3HZ LYS 38 24.179 -14.560 -2.227
319 HZ2 LYS 38 1HZ LYS 38 25.132 -15.709 -3.026
320 HZ3 LYS 38 2HZ LYS 38 23.462 -15.947 -2.879
321 H LYS 39 H LYS 39 28.542 -9.523 -3.759
322 HA LYS 39 HA LYS 39 29.954 -7.927 -4.590
323 HB2 LYS 39 2HB LYS 39 31.566 -8.796 -6.133
324 HB3 LYS 39 1HB LYS 39 31.076 -10.104 -5.067
325 HG2 LYS 39 2HG LYS 39 30.117 -11.290 -6.737
326 HG3 LYS 39 1HG LYS 39 29.596 -9.851 -7.615
327 HD2 LYS 39 2HD LYS 39 31.514 -9.722 -8.802
328 HD3 LYS 39 1HD LYS 39 32.510 -10.257 -7.448
329 HE2 LYS 39 2HE LYS 39 32.691 -12.211 -8.500
330 HE3 LYS 39 1HE LYS 39 30.998 -12.487 -8.091
331 HZ1 LYS 39 3HZ LYS 39 30.359 -12.169 -10.198
332 HZ2 LYS 39 1HZ LYS 39 31.980 -12.455 -10.589
333 HZ3 LYS 39 2HZ LYS 39 31.412 -10.869 -10.448
334 H LYS 40 H LYS 40 27.389 -7.321 -5.399
335 HA LYS 40 HA LYS 40 27.324 -6.824 -8.233
336 HB2 LYS 40 2HB LYS 40 25.380 -7.107 -6.387
337 HB3 LYS 40 1HB LYS 40 25.478 -5.354 -6.440
338 HG2 LYS 40 2HG LYS 40 23.922 -5.688 -8.056
339 HG3 LYS 40 1HG LYS 40 25.379 -5.788 -9.047
340 HD2 LYS 40 2HD LYS 40 24.514 -7.740 -9.745
341 HD3 LYS 40 1HD LYS 40 25.113 -8.366 -8.205
342 HE2 LYS 40 2HE LYS 40 23.043 -8.586 -7.348
343 HE3 LYS 40 1HE LYS 40 22.477 -7.080 -8.069
344 HZ1 LYS 40 3HZ LYS 40 21.657 -8.150 -9.837
345 HZ2 LYS 40 1HZ LYS 40 21.735 -9.535 -8.867
346 HZ3 LYS 40 2HZ LYS 40 22.977 -9.199 -9.966
347 H LYS 41 H LYS 41 27.013 -4.632 -9.118
348 HA LYS 41 HA LYS 41 27.731 -2.510 -9.505
349 HB2 LYS 41 2HB LYS 41 27.207 -2.601 -6.627
350 HB3 LYS 41 1HB LYS 41 28.376 -1.370 -7.081
351 HG2 LYS 41 2HG LYS 41 26.828 -0.303 -8.523
352 HG3 LYS 41 1HG LYS 41 25.697 -1.649 -8.409
353 HD2 LYS 41 2HD LYS 41 26.435 -0.435 -5.839
354 HD3 LYS 41 1HD LYS 41 25.543 0.624 -6.932
355 HE2 LYS 41 2HE LYS 41 24.112 -1.660 -7.160
356 HE3 LYS 41 1HE LYS 41 24.668 -1.790 -5.493
357 HZ1 LYS 41 3HZ LYS 41 23.417 0.688 -6.504
358 HZ2 LYS 41 1HZ LYS 41 23.594 0.171 -4.903
359 HZ3 LYS 41 2HZ LYS 41 22.480 -0.594 -5.921
360 H HIS 42 H HIS 42 29.641 -0.906 -8.744
361 HA HIS 42 HA HIS 42 32.052 -2.258 -7.955
362 HD1 HIS 42 1HD HIS 42 34.576 -0.659 -10.811
363 HD2 HIS 42 2HD HIS 42 33.690 -4.407 -9.252
364 HE1 HIS 42 1HE HIS 42 36.790 -1.826 -10.569
365 HE2 HIS 42 2HE HIS 42 36.220 -4.124 -9.703
366 HB2 HIS 42 2HB HIS 42 31.617 -2.766 -10.473
367 HB3 HIS 42 1HB HIS 42 32.118 -1.097 -10.724
Start of MODEL 14
1 H1 GLY 1 1H GLY 1 -33.560 8.271 5.695
2 H2 GLY 1 2H GLY 1 -32.830 6.746 5.623
3 H3 GLY 1 3H GLY 1 -33.034 7.652 4.210
4 HA2 GLY 1 1HA GLY 1 -31.618 9.401 5.551
5 HA3 GLY 1 2HA GLY 1 -31.054 7.938 6.342
6 H LYS 2 H LYS 2 -29.007 8.822 5.334
7 HA LYS 2 HA LYS 2 -28.768 8.111 2.501
8 HB2 LYS 2 2HB LYS 2 -27.277 9.907 4.341
9 HB3 LYS 2 1HB LYS 2 -26.354 9.129 3.064
10 HG2 LYS 2 2HG LYS 2 -27.049 11.258 2.270
11 HG3 LYS 2 1HG LYS 2 -27.999 10.036 1.422
12 HD2 LYS 2 2HD LYS 2 -29.619 11.577 1.998
13 HD3 LYS 2 1HD LYS 2 -29.716 10.438 3.341
14 HE2 LYS 2 2HE LYS 2 -27.970 12.877 3.459
15 HE3 LYS 2 1HE LYS 2 -29.677 12.937 3.895
16 HZ1 LYS 2 3HZ LYS 2 -28.876 10.839 5.318
17 HZ2 LYS 2 1HZ LYS 2 -28.870 12.423 5.914
18 HZ3 LYS 2 2HZ LYS 2 -27.444 11.739 5.311
19 H ILE 3 H ILE 3 -27.871 6.249 1.910
20 HA ILE 3 HA ILE 3 -26.302 4.757 3.894
21 HB ILE 3 HB ILE 3 -28.052 3.827 1.621
22 HG12 ILE 3 2HG1 ILE 3 -28.206 2.784 4.408
23 HG13 ILE 3 1HG1 ILE 3 -28.800 4.413 4.107
24 HG21 ILE 3 1HG2 ILE 3 -25.738 2.530 2.800
25 HG22 ILE 3 2HG2 ILE 3 -26.644 2.133 1.342
26 HG23 ILE 3 3HG2 ILE 3 -27.202 1.555 2.909
27 HD11 ILE 3 3HD1 ILE 3 -30.451 3.649 2.627
28 HD12 ILE 3 1HD1 ILE 3 -30.491 2.539 3.996
29 HD13 ILE 3 2HD1 ILE 3 -29.705 2.056 2.492
30 HA PRO 4 HA PRO 4 -23.100 5.945 0.827
31 HB2 PRO 4 2HB PRO 4 -21.357 4.929 2.990
32 HB3 PRO 4 1HB PRO 4 -21.317 6.480 2.146
33 HG2 PRO 4 2HG PRO 4 -22.165 6.301 4.674
34 HG3 PRO 4 1HG PRO 4 -22.915 7.425 3.525
35 HD2 PRO 4 2HD PRO 4 -23.894 4.763 4.487
36 HD3 PRO 4 1HD PRO 4 -24.803 6.260 4.196
37 H VAL 5 H VAL 5 -24.015 3.998 -0.316
38 HA VAL 5 HA VAL 5 -23.101 1.397 0.215
39 HB VAL 5 HB VAL 5 -23.774 2.363 -2.549
40 HG11 VAL 5 1HG1 VAL 5 -23.023 -0.029 -1.844
41 HG12 VAL 5 2HG1 VAL 5 -24.350 0.186 -2.986
42 HG13 VAL 5 3HG1 VAL 5 -24.691 -0.174 -1.295
43 HG21 VAL 5 3HG2 VAL 5 -25.467 2.491 -0.192
44 HG22 VAL 5 1HG2 VAL 5 -26.156 1.470 -1.454
45 HG23 VAL 5 2HG2 VAL 5 -25.732 3.145 -1.807
46 H LYS 6 H LYS 6 -21.833 4.001 -1.789
47 HA LYS 6 HA LYS 6 -19.817 2.547 -3.096
48 HB2 LYS 6 2HB LYS 6 -20.329 5.425 -2.532
49 HB3 LYS 6 1HB LYS 6 -18.708 4.971 -3.038
50 HG2 LYS 6 2HG LYS 6 -19.337 4.756 -5.155
51 HG3 LYS 6 1HG LYS 6 -20.715 3.745 -4.716
52 HD2 LYS 6 2HD LYS 6 -20.720 6.740 -4.414
53 HD3 LYS 6 1HD LYS 6 -21.254 5.927 -5.887
54 HE2 LYS 6 2HE LYS 6 -22.387 5.341 -3.158
55 HE3 LYS 6 1HE LYS 6 -23.079 6.530 -4.264
56 HZ1 LYS 6 3HZ LYS 6 -23.819 3.980 -4.196
57 HZ2 LYS 6 1HZ LYS 6 -22.607 3.886 -5.372
58 HZ3 LYS 6 2HZ LYS 6 -23.917 4.934 -5.588
59 H ALA 7 H ALA 7 -19.961 4.044 0.066
60 HA ALA 7 HA ALA 7 -17.220 4.000 0.686
61 HB1 ALA 7 3HB ALA 7 -19.448 3.637 2.677
62 HB2 ALA 7 1HB ALA 7 -19.050 5.195 1.949
63 HB3 ALA 7 2HB ALA 7 -17.860 4.351 2.940
64 H ILE 8 H ILE 8 -19.790 1.631 1.349
65 HA ILE 8 HA ILE 8 -18.131 -0.256 2.629
66 HB ILE 8 HB ILE 8 -20.625 -0.933 1.086
67 HG12 ILE 8 2HG1 ILE 8 -21.028 -0.440 3.922
68 HG13 ILE 8 1HG1 ILE 8 -20.460 1.002 3.094
69 HG21 ILE 8 1HG2 ILE 8 -20.868 -2.632 2.879
70 HG22 ILE 8 2HG2 ILE 8 -19.294 -2.144 3.501
71 HG23 ILE 8 3HG2 ILE 8 -19.425 -2.850 1.890
72 HD11 ILE 8 3HD1 ILE 8 -22.565 1.359 2.515
73 HD12 ILE 8 1HD1 ILE 8 -23.054 -0.250 3.049
74 HD13 ILE 8 2HD1 ILE 8 -22.413 -0.017 1.421
75 H LYS 9 H LYS 9 -19.250 0.040 -0.712
76 HA LYS 9 HA LYS 9 -18.073 -2.298 -1.707
77 HB2 LYS 9 2HB LYS 9 -18.855 0.298 -3.009
78 HB3 LYS 9 1HB LYS 9 -18.135 -1.012 -3.933
79 HG2 LYS 9 2HG LYS 9 -20.566 -1.460 -2.243
80 HG3 LYS 9 1HG LYS 9 -20.686 -0.817 -3.881
81 HD2 LYS 9 2HD LYS 9 -20.888 -3.060 -4.308
82 HD3 LYS 9 1HD LYS 9 -19.138 -2.873 -4.442
83 HE2 LYS 9 2HE LYS 9 -18.734 -4.054 -2.557
84 HE3 LYS 9 1HE LYS 9 -20.170 -3.440 -1.739
85 HZ1 LYS 9 3HZ LYS 9 -21.289 -4.953 -3.610
86 HZ2 LYS 9 1HZ LYS 9 -20.876 -5.535 -2.076
87 HZ3 LYS 9 2HZ LYS 9 -19.847 -5.809 -3.391
88 H GLN 10 H GLN 10 -16.850 1.018 -1.579
89 HA GLN 10 HA GLN 10 -14.367 0.452 -2.818
90 HB2 GLN 10 2HB GLN 10 -15.485 2.722 -1.234
91 HB3 GLN 10 1HB GLN 10 -13.744 2.647 -1.464
92 HG2 GLN 10 2HG GLN 10 -13.905 2.919 -3.758
93 HG3 GLN 10 1HG GLN 10 -15.591 2.409 -3.800
94 HE21 GLN 10 1HE2 GLN 10 -13.447 5.022 -3.612
95 HE22 GLN 10 2HE2 GLN 10 -14.611 6.277 -3.380
96 H ALA 11 H ALA 11 -15.512 0.319 0.483
97 HA ALA 11 HA ALA 11 -12.967 0.087 1.724
98 HB1 ALA 11 3HB ALA 11 -15.115 0.734 2.862
99 HB2 ALA 11 1HB ALA 11 -14.146 -0.471 3.710
100 HB3 ALA 11 2HB ALA 11 -15.572 -0.968 2.800
101 H GLY 12 H GLY 12 -15.255 -2.217 0.379
102 HA2 GLY 12 2HA GLY 12 -14.053 -4.566 1.395
103 HA3 GLY 12 1HA GLY 12 -15.101 -4.476 -0.015
104 H LYS 13 H LYS 13 -13.503 -2.695 -1.547
105 HA LYS 13 HA LYS 13 -11.790 -4.525 -2.824
106 HB2 LYS 13 2HB LYS 13 -12.827 -1.975 -3.359
107 HB3 LYS 13 1HB LYS 13 -11.081 -1.774 -3.389
108 HG2 LYS 13 2HG LYS 13 -11.562 -2.293 -5.581
109 HG3 LYS 13 1HG LYS 13 -11.113 -3.865 -4.915
110 HD2 LYS 13 2HD LYS 13 -13.660 -4.092 -4.440
111 HD3 LYS 13 1HD LYS 13 -13.817 -2.820 -5.652
112 HE2 LYS 13 2HE LYS 13 -12.180 -4.436 -6.985
113 HE3 LYS 13 1HE LYS 13 -12.945 -5.641 -5.950
114 HZ1 LYS 13 3HZ LYS 13 -15.097 -4.950 -6.761
115 HZ2 LYS 13 1HZ LYS 13 -14.105 -5.371 -8.066
116 HZ3 LYS 13 2HZ LYS 13 -14.394 -3.741 -7.714
117 H VAL 14 H VAL 14 -11.167 -1.899 -0.537
118 HA VAL 14 HA VAL 14 -8.387 -1.882 -0.640
119 HB VAL 14 HB VAL 14 -9.954 -1.430 1.893
120 HG11 VAL 14 1HG1 VAL 14 -7.310 -0.622 0.811
121 HG12 VAL 14 2HG1 VAL 14 -7.751 -1.167 2.430
122 HG13 VAL 14 3HG1 VAL 14 -8.146 0.473 1.911
123 HG21 VAL 14 3HG2 VAL 14 -9.765 1.045 0.783
124 HG22 VAL 14 1HG2 VAL 14 -11.204 0.026 0.718
125 HG23 VAL 14 2HG2 VAL 14 -10.078 0.052 -0.641
126 H ILE 15 H ILE 15 -10.601 -4.086 0.891
127 HA ILE 15 HA ILE 15 -8.880 -5.266 2.769
128 HB ILE 15 HB ILE 15 -11.123 -6.623 1.267
129 HG12 ILE 15 2HG1 ILE 15 -11.197 -5.078 3.870
130 HG13 ILE 15 1HG1 ILE 15 -11.856 -4.521 2.335
131 HG21 ILE 15 1HG2 ILE 15 -9.891 -8.284 2.385
132 HG22 ILE 15 2HG2 ILE 15 -11.251 -7.926 3.450
133 HG23 ILE 15 3HG2 ILE 15 -9.654 -7.266 3.808
134 HD11 ILE 15 3HD1 ILE 15 -12.786 -6.911 3.907
135 HD12 ILE 15 1HD1 ILE 15 -13.432 -6.396 2.349
136 HD13 ILE 15 2HD1 ILE 15 -13.612 -5.358 3.763
137 H GLY 16 H GLY 16 -9.536 -6.068 -0.628
138 HA2 GLY 16 2HA GLY 16 -7.782 -8.328 -0.661
139 HA3 GLY 16 1HA GLY 16 -8.478 -7.532 -2.063
140 H LYS 17 H LYS 17 -7.489 -5.010 -1.929
141 HA LYS 17 HA LYS 17 -4.925 -5.265 -2.995
142 HB2 LYS 17 2HB LYS 17 -6.635 -3.313 -3.162
143 HB3 LYS 17 1HB LYS 17 -5.855 -2.718 -1.703
144 HG2 LYS 17 2HG LYS 17 -3.907 -2.209 -2.780
145 HG3 LYS 17 1HG LYS 17 -4.141 -3.446 -4.018
146 HD2 LYS 17 2HD LYS 17 -6.178 -1.344 -4.036
147 HD3 LYS 17 1HD LYS 17 -4.547 -0.760 -4.364
148 HE2 LYS 17 2HE LYS 17 -5.750 -1.388 -6.417
149 HE3 LYS 17 1HE LYS 17 -4.299 -2.357 -6.163
150 HZ1 LYS 17 3HZ LYS 17 -6.580 -3.450 -6.808
151 HZ2 LYS 17 1HZ LYS 17 -6.839 -3.388 -5.137
152 HZ3 LYS 17 2HZ LYS 17 -5.507 -4.227 -5.754
153 H GLY 18 H GLY 18 -5.998 -4.638 0.284
154 HA2 GLY 18 2HA GLY 18 -3.445 -3.936 1.331
155 HA3 GLY 18 1HA GLY 18 -4.841 -4.454 2.266
156 H LEU 19 H LEU 19 -5.184 -6.982 0.972
157 HA LEU 19 HA LEU 19 -3.393 -8.543 2.518
158 HG LEU 19 HG LEU 19 -3.896 -10.800 2.667
159 HB2 LEU 19 2HB LEU 19 -5.767 -9.126 1.753
160 HB3 LEU 19 1HB LEU 19 -5.043 -9.565 0.219
161 HD11 LEU 19 1HD1 LEU 19 -5.969 -11.384 3.352
162 HD12 LEU 19 2HD1 LEU 19 -5.773 -12.623 2.114
163 HD13 LEU 19 3HD1 LEU 19 -6.684 -11.157 1.757
164 HD21 LEU 19 3HD2 LEU 19 -3.517 -12.646 1.201
165 HD22 LEU 19 1HD2 LEU 19 -3.040 -11.179 0.348
166 HD23 LEU 19 2HD2 LEU 19 -4.577 -11.959 -0.030
167 H ARG 20 H ARG 20 -3.604 -7.769 -0.925
168 HA ARG 20 HA ARG 20 -1.427 -9.433 -1.703
169 HE ARG 20 HE ARG 20 -1.323 -9.621 -6.192
170 HB2 ARG 20 2HB ARG 20 -3.236 -7.533 -2.974
171 HB3 ARG 20 1HB ARG 20 -1.601 -7.418 -3.610
172 HG2 ARG 20 2HG ARG 20 -1.624 -9.814 -4.099
173 HG3 ARG 20 1HG ARG 20 -3.268 -9.921 -3.470
174 HD2 ARG 20 2HD ARG 20 -4.084 -9.324 -5.445
175 HD3 ARG 20 1HD ARG 20 -3.168 -7.818 -5.388
176 HH11 ARG 20 1HH1 ARG 20 -4.528 -8.829 -7.328
177 HH12 ARG 20 2HH1 ARG 20 -4.184 -9.254 -8.972
178 HH21 ARG 20 1HH2 ARG 20 -0.871 -10.178 -8.353
179 HH22 ARG 20 2HH2 ARG 20 -2.110 -10.019 -9.554
180 H ALA 21 H ALA 21 -1.705 -6.225 -0.409
181 HA ALA 21 HA ALA 21 0.879 -5.309 -1.198
182 HB1 ALA 21 3HB ALA 21 0.318 -3.721 0.884
183 HB2 ALA 21 1HB ALA 21 -1.301 -4.325 0.535
184 HB3 ALA 21 2HB ALA 21 -0.382 -3.489 -0.718
185 H ILE 22 H ILE 22 -0.454 -6.813 1.701
186 HA ILE 22 HA ILE 22 1.842 -6.586 3.320
187 HB ILE 22 HB ILE 22 -0.262 -8.752 3.424
188 HG12 ILE 22 2HG1 ILE 22 -0.338 -6.455 5.292
189 HG13 ILE 22 1HG1 ILE 22 -0.769 -6.100 3.621
190 HG21 ILE 22 1HG2 ILE 22 1.277 -9.564 4.881
191 HG22 ILE 22 2HG2 ILE 22 0.477 -8.424 5.966
192 HG23 ILE 22 3HG2 ILE 22 1.993 -7.978 5.181
193 HD11 ILE 22 3HD1 ILE 22 -2.247 -7.541 5.676
194 HD12 ILE 22 1HD1 ILE 22 -2.209 -8.362 4.116
195 HD13 ILE 22 2HD1 ILE 22 -2.821 -6.713 4.229
196 H ASN 23 H ASN 23 0.932 -8.855 0.824
197 HA ASN 23 HA ASN 23 2.917 -10.812 1.460
198 HB2 ASN 23 2HB ASN 23 0.702 -10.948 -0.014
199 HB3 ASN 23 1HB ASN 23 1.836 -10.574 -1.308
200 HD21 ASN 23 1HD2 ASN 23 2.065 -12.434 -2.352
201 HD22 ASN 23 2HD2 ASN 23 2.538 -13.934 -1.631
202 H ILE 24 H ILE 24 2.669 -8.196 -0.920
203 HA ILE 24 HA ILE 24 5.278 -8.681 -2.010
204 HB ILE 24 HB ILE 24 3.626 -6.175 -2.299
205 HG12 ILE 24 2HG1 ILE 24 3.617 -8.505 -4.211
206 HG13 ILE 24 1HG1 ILE 24 2.457 -8.388 -2.893
207 HG21 ILE 24 1HG2 ILE 24 5.083 -5.509 -3.870
208 HG22 ILE 24 2HG2 ILE 24 5.289 -7.139 -4.515
209 HG23 ILE 24 3HG2 ILE 24 6.184 -6.636 -3.080
210 HD11 ILE 24 3HD1 ILE 24 1.689 -7.561 -5.140
211 HD12 ILE 24 1HD1 ILE 24 2.812 -6.219 -4.931
212 HD13 ILE 24 2HD1 ILE 24 1.486 -6.442 -3.791
213 H ALA 25 H ALA 25 3.954 -6.737 0.554
214 HA ALA 25 HA ALA 25 5.905 -4.787 0.850
215 HB1 ALA 25 3HB ALA 25 5.185 -4.612 3.162
216 HB2 ALA 25 1HB ALA 25 4.392 -6.184 3.053
217 HB3 ALA 25 2HB ALA 25 3.792 -4.825 2.102
218 H GLY 26 H GLY 26 5.869 -8.128 2.011
219 HA2 GLY 26 2HA GLY 26 8.261 -7.918 3.539
220 HA3 GLY 26 1HA GLY 26 7.496 -9.410 3.013
221 H THR 27 H THR 27 7.588 -8.741 0.194
222 HA THR 27 HA THR 27 10.232 -9.690 -0.361
223 HB THR 27 HB THR 27 9.451 -9.417 -2.778
224 HG1 THR 27 1HG THR 27 7.355 -8.888 -3.117
225 HG21 THR 27 3HG2 THR 27 8.331 -11.228 -0.764
226 HG22 THR 27 1HG2 THR 27 9.111 -11.578 -2.307
227 HG23 THR 27 2HG2 THR 27 7.413 -11.100 -2.265
228 H THR 28 H THR 28 8.459 -6.707 -1.155
229 HA THR 28 HA THR 28 10.526 -5.383 -2.478
230 HB THR 28 HB THR 28 8.186 -4.622 -2.496
231 HG1 THR 28 1HG THR 28 8.952 -2.739 -2.941
232 HG21 THR 28 3HG2 THR 28 7.727 -5.006 -0.074
233 HG22 THR 28 1HG2 THR 28 7.181 -3.449 -0.698
234 HG23 THR 28 2HG2 THR 28 8.654 -3.545 0.267
235 H HIS 29 H HIS 29 10.030 -5.966 0.896
236 HA HIS 29 HA HIS 29 11.717 -3.879 1.867
237 HD1 HIS 29 1HD HIS 29 12.906 -3.410 3.668
238 HD2 HIS 29 2HD HIS 29 9.496 -4.651 5.693
239 HE1 HIS 29 1HE HIS 29 12.763 -1.943 5.706
240 HE2 HIS 29 2HE HIS 29 10.735 -2.762 6.953
241 HB2 HIS 29 2HB HIS 29 9.902 -5.512 3.040
242 HB3 HIS 29 1HB HIS 29 11.396 -6.314 3.518
243 H ASP 30 H ASP 30 12.283 -7.016 0.544
244 HA ASP 30 HA ASP 30 15.058 -6.975 1.516
245 HB2 ASP 30 2HB ASP 30 13.202 -9.039 1.456
246 HB3 ASP 30 1HB ASP 30 14.247 -9.382 0.083
247 H VAL 31 H VAL 31 13.258 -7.887 -1.431
248 HA VAL 31 HA VAL 31 15.337 -8.007 -3.202
249 HB VAL 31 HB VAL 31 12.659 -6.835 -3.926
250 HG11 VAL 31 1HG1 VAL 31 14.915 -8.081 -5.373
251 HG12 VAL 31 2HG1 VAL 31 13.828 -6.784 -5.865
252 HG13 VAL 31 3HG1 VAL 31 13.288 -8.460 -5.935
253 HG21 VAL 31 3HG2 VAL 31 11.763 -8.688 -3.024
254 HG22 VAL 31 1HG2 VAL 31 13.322 -9.502 -2.909
255 HG23 VAL 31 2HG2 VAL 31 12.434 -9.511 -4.434
256 H VAL 32 H VAL 32 13.434 -5.141 -2.354
257 HA VAL 32 HA VAL 32 14.813 -3.370 -4.081
258 HB VAL 32 HB VAL 32 13.363 -2.634 -1.536
259 HG11 VAL 32 1HG1 VAL 32 13.348 -0.890 -3.918
260 HG12 VAL 32 2HG1 VAL 32 14.879 -1.022 -3.053
261 HG13 VAL 32 3HG1 VAL 32 13.430 -0.475 -2.208
262 HG21 VAL 32 3HG2 VAL 32 12.257 -2.959 -4.325
263 HG22 VAL 32 1HG2 VAL 32 11.373 -2.342 -2.928
264 HG23 VAL 32 2HG2 VAL 32 11.929 -4.016 -2.951
265 H SER 33 H SER 33 15.415 -4.516 -0.841
266 HA SER 33 HA SER 33 17.332 -2.528 -0.137
267 HG SER 33 HG SER 33 16.840 -3.143 2.713
268 HB2 SER 33 2HB SER 33 15.979 -4.396 1.280
269 HB3 SER 33 1HB SER 33 17.543 -5.196 1.127
270 H PHE 34 H PHE 34 17.462 -5.579 -1.830
271 HA PHE 34 HA PHE 34 20.327 -5.802 -1.703
272 HD1 PHE 34 2HD PHE 34 21.184 -7.466 -4.561
273 HD2 PHE 34 1HD PHE 34 19.792 -9.066 -0.872
274 HE1 PHE 34 2HE PHE 34 23.132 -8.966 -4.480
275 HE2 PHE 34 1HE PHE 34 21.739 -10.569 -0.784
276 HZ PHE 34 HZ PHE 34 23.412 -10.519 -2.590
277 HB2 PHE 34 2HB PHE 34 18.421 -7.636 -2.097
278 HB3 PHE 34 1HB PHE 34 18.778 -7.265 -3.780
279 H PHE 35 H PHE 35 17.944 -4.664 -4.040
280 HA PHE 35 HA PHE 35 19.971 -4.126 -6.037
281 HD1 PHE 35 2HD PHE 35 18.582 -1.690 -7.970
282 HD2 PHE 35 1HD PHE 35 18.055 -5.904 -8.247
283 HE1 PHE 35 2HE PHE 35 19.199 -1.607 -10.350
284 HE2 PHE 35 1HE PHE 35 18.672 -5.828 -10.627
285 HZ PHE 35 HZ PHE 35 19.247 -3.678 -11.682
286 HB2 PHE 35 2HB PHE 35 17.402 -4.789 -6.313
287 HB3 PHE 35 1HB PHE 35 17.209 -3.040 -6.301
288 H ARG 36 H ARG 36 17.823 -2.266 -3.915
289 HA ARG 36 HA ARG 36 17.898 -0.121 -3.170
290 HE ARG 36 HE ARG 36 20.170 0.188 -0.399
291 HB2 ARG 36 2HB ARG 36 20.187 -0.795 -2.487
292 HB3 ARG 36 1HB ARG 36 20.794 -0.226 -4.037
293 HG2 ARG 36 2HG ARG 36 21.196 1.407 -2.288
294 HG3 ARG 36 1HG ARG 36 20.076 2.041 -3.495
295 HD2 ARG 36 2HD ARG 36 19.324 2.603 -1.254
296 HD3 ARG 36 1HD ARG 36 18.193 1.495 -2.029
297 HH11 ARG 36 1HH1 ARG 36 17.042 1.736 -0.417
298 HH12 ARG 36 2HH1 ARG 36 16.491 0.921 1.007
299 HH21 ARG 36 1HH2 ARG 36 19.447 -0.886 1.474
300 HH22 ARG 36 2HH2 ARG 36 17.856 -0.568 2.082
301 HA PRO 37 HA PRO 37 17.321 1.528 -7.428
302 HB2 PRO 37 2HB PRO 37 14.936 2.707 -6.925
303 HB3 PRO 37 1HB PRO 37 15.085 0.994 -7.333
304 HG2 PRO 37 2HG PRO 37 14.761 2.281 -4.649
305 HG3 PRO 37 1HG PRO 37 13.972 0.830 -5.298
306 HD2 PRO 37 2HD PRO 37 16.088 0.718 -3.604
307 HD3 PRO 37 1HD PRO 37 15.786 -0.513 -4.847
308 H LYS 38 H LYS 38 17.253 2.984 -4.263
309 HA LYS 38 HA LYS 38 17.922 5.015 -3.493
310 HB2 LYS 38 2HB LYS 38 19.413 4.615 -5.930
311 HB3 LYS 38 1HB LYS 38 19.040 6.322 -5.722
312 HG2 LYS 38 2HG LYS 38 19.987 5.056 -3.276
313 HG3 LYS 38 1HG LYS 38 21.153 4.982 -4.598
314 HD2 LYS 38 2HD LYS 38 20.598 7.497 -4.896
315 HD3 LYS 38 1HD LYS 38 19.959 7.380 -3.257
316 HE2 LYS 38 2HE LYS 38 22.006 7.162 -2.330
317 HE3 LYS 38 1HE LYS 38 22.628 6.207 -3.676
318 HZ1 LYS 38 3HZ LYS 38 23.533 8.571 -3.294
319 HZ2 LYS 38 1HZ LYS 38 22.094 9.083 -4.026
320 HZ3 LYS 38 2HZ LYS 38 23.168 8.086 -4.873
321 H LYS 39 H LYS 39 15.309 4.634 -4.741
322 HA LYS 39 HA LYS 39 14.721 7.457 -5.299
323 HB2 LYS 39 2HB LYS 39 14.175 5.113 -7.000
324 HB3 LYS 39 1HB LYS 39 12.801 6.187 -6.765
325 HG2 LYS 39 2HG LYS 39 13.686 7.207 -8.569
326 HG3 LYS 39 1HG LYS 39 14.669 8.009 -7.341
327 HD2 LYS 39 2HD LYS 39 16.161 5.816 -7.753
328 HD3 LYS 39 1HD LYS 39 15.420 5.971 -9.347
329 HE2 LYS 39 2HE LYS 39 16.227 8.250 -9.531
330 HE3 LYS 39 1HE LYS 39 16.896 8.168 -7.902
331 HZ1 LYS 39 3HZ LYS 39 18.631 6.890 -8.576
332 HZ2 LYS 39 1HZ LYS 39 18.364 7.726 -10.021
333 HZ3 LYS 39 2HZ LYS 39 17.770 6.155 -9.833
334 H LYS 40 H LYS 40 14.370 7.024 -2.866
335 HA LYS 40 HA LYS 40 11.837 5.733 -2.258
336 HB2 LYS 40 2HB LYS 40 14.069 5.797 -0.832
337 HB3 LYS 40 1HB LYS 40 13.373 7.296 -0.228
338 HG2 LYS 40 2HG LYS 40 11.446 6.155 0.593
339 HG3 LYS 40 1HG LYS 40 11.936 4.652 -0.192
340 HD2 LYS 40 2HD LYS 40 13.634 6.014 1.886
341 HD3 LYS 40 1HD LYS 40 12.381 4.846 2.308
342 HE2 LYS 40 2HE LYS 40 14.619 4.270 0.378
343 HE3 LYS 40 1HE LYS 40 14.698 3.902 2.102
344 HZ1 LYS 40 3HZ LYS 40 12.671 2.835 0.209
345 HZ2 LYS 40 1HZ LYS 40 12.785 2.460 1.857
346 HZ3 LYS 40 2HZ LYS 40 14.011 1.982 0.792
347 H LYS 41 H LYS 41 10.063 6.797 -1.294
348 HA LYS 41 HA LYS 41 8.527 8.455 -1.045
349 HB2 LYS 41 2HB LYS 41 10.964 9.534 -0.113
350 HB3 LYS 41 1HB LYS 41 10.207 10.790 -1.080
351 HG2 LYS 41 2HG LYS 41 8.513 9.360 0.887
352 HG3 LYS 41 1HG LYS 41 9.710 10.504 1.500
353 HD2 LYS 41 2HD LYS 41 8.776 12.258 0.092
354 HD3 LYS 41 1HD LYS 41 7.605 11.119 -0.571
355 HE2 LYS 41 2HE LYS 41 6.289 11.204 1.261
356 HE3 LYS 41 1HE LYS 41 7.657 11.314 2.365
357 HZ1 LYS 41 3HZ LYS 41 7.632 13.552 2.314
358 HZ2 LYS 41 1HZ LYS 41 6.011 13.334 1.875
359 HZ3 LYS 41 2HZ LYS 41 7.176 13.638 0.689
360 H HIS 42 H HIS 42 7.270 9.728 -2.353
361 HA HIS 42 HA HIS 42 8.204 10.017 -5.096
362 HD1 HIS 42 1HD HIS 42 5.279 7.560 -3.680
363 HD2 HIS 42 2HD HIS 42 6.551 8.916 -7.396
364 HE1 HIS 42 1HE HIS 42 5.207 5.549 -5.191
365 HE2 HIS 42 2HE HIS 42 5.897 6.414 -7.452
366 HB2 HIS 42 2HB HIS 42 5.524 10.049 -3.761
367 HB3 HIS 42 1HB HIS 42 5.706 10.790 -5.347
Start of MODEL 15
1 H1 GLY 1 1H GLY 1 -31.869 3.409 0.021
2 H2 GLY 1 2H GLY 1 -33.493 3.022 0.304
3 H3 GLY 1 3H GLY 1 -32.912 4.561 0.695
4 HA2 GLY 1 1HA GLY 1 -34.039 3.692 -1.715
5 HA3 GLY 1 2HA GLY 1 -33.476 5.300 -1.293
6 H LYS 2 H LYS 2 -30.777 4.934 -1.026
7 HA LYS 2 HA LYS 2 -30.012 4.502 -3.803
8 HB2 LYS 2 2HB LYS 2 -27.850 5.528 -3.093
9 HB3 LYS 2 1HB LYS 2 -29.249 6.562 -2.833
10 HG2 LYS 2 2HG LYS 2 -28.559 4.884 -0.537
11 HG3 LYS 2 1HG LYS 2 -27.313 6.047 -0.994
12 HD2 LYS 2 2HD LYS 2 -28.605 7.847 -0.458
13 HD3 LYS 2 1HD LYS 2 -30.110 7.027 -0.881
14 HE2 LYS 2 2HE LYS 2 -29.503 5.550 1.211
15 HE3 LYS 2 1HE LYS 2 -28.560 6.971 1.664
16 HZ1 LYS 2 3HZ LYS 2 -31.478 6.872 1.127
17 HZ2 LYS 2 1HZ LYS 2 -30.609 8.298 1.395
18 HZ3 LYS 2 2HZ LYS 2 -30.729 7.139 2.619
19 H ILE 3 H ILE 3 -28.897 2.791 -4.507
20 HA ILE 3 HA ILE 3 -28.560 0.473 -3.059
21 HB ILE 3 HB ILE 3 -26.779 1.238 -5.361
22 HG12 ILE 3 2HG1 ILE 3 -28.907 -0.126 -6.460
23 HG13 ILE 3 1HG1 ILE 3 -29.696 0.914 -5.278
24 HG21 ILE 3 1HG2 ILE 3 -27.276 -1.266 -5.828
25 HG22 ILE 3 2HG2 ILE 3 -27.726 -1.302 -4.124
26 HG23 ILE 3 3HG2 ILE 3 -26.096 -0.820 -4.598
27 HD11 ILE 3 3HD1 ILE 3 -29.295 2.769 -6.465
28 HD12 ILE 3 1HD1 ILE 3 -29.106 1.640 -7.807
29 HD13 ILE 3 2HD1 ILE 3 -27.684 2.239 -6.951
30 HA PRO 4 HA PRO 4 -24.958 1.845 -0.676
31 HB2 PRO 4 2HB PRO 4 -25.184 0.066 1.312
32 HB3 PRO 4 1HB PRO 4 -26.270 1.456 1.189
33 HG2 PRO 4 2HG PRO 4 -26.745 -1.392 0.398
34 HG3 PRO 4 1HG PRO 4 -27.829 -0.268 1.237
35 HD2 PRO 4 2HD PRO 4 -27.966 -0.815 -1.449
36 HD3 PRO 4 1HD PRO 4 -28.531 0.698 -0.714
37 H VAL 5 H VAL 5 -25.470 -0.901 -2.520
38 HA VAL 5 HA VAL 5 -23.505 -2.681 -1.713
39 HB VAL 5 HB VAL 5 -24.351 -2.106 -4.554
40 HG11 VAL 5 1HG1 VAL 5 -23.820 -4.540 -4.828
41 HG12 VAL 5 2HG1 VAL 5 -23.077 -4.483 -3.229
42 HG13 VAL 5 3HG1 VAL 5 -22.431 -3.495 -4.539
43 HG21 VAL 5 3HG2 VAL 5 -25.592 -3.876 -2.451
44 HG22 VAL 5 1HG2 VAL 5 -25.984 -3.957 -4.170
45 HG23 VAL 5 2HG2 VAL 5 -26.329 -2.491 -3.257
46 H LYS 6 H LYS 6 -23.255 0.315 -3.497
47 HA LYS 6 HA LYS 6 -20.609 -0.112 -4.462
48 HB2 LYS 6 2HB LYS 6 -22.040 1.491 -5.566
49 HB3 LYS 6 1HB LYS 6 -22.226 2.412 -4.081
50 HG2 LYS 6 2HG LYS 6 -19.501 2.014 -5.219
51 HG3 LYS 6 1HG LYS 6 -20.581 3.212 -5.934
52 HD2 LYS 6 2HD LYS 6 -20.873 3.817 -3.331
53 HD3 LYS 6 1HD LYS 6 -19.218 3.207 -3.317
54 HE2 LYS 6 2HE LYS 6 -18.425 4.985 -4.436
55 HE3 LYS 6 1HE LYS 6 -19.809 5.036 -5.527
56 HZ1 LYS 6 3HZ LYS 6 -20.888 6.505 -4.231
57 HZ2 LYS 6 1HZ LYS 6 -19.335 6.874 -3.670
58 HZ3 LYS 6 2HZ LYS 6 -20.328 5.832 -2.783
59 H ALA 7 H ALA 7 -21.987 1.119 -1.506
60 HA ALA 7 HA ALA 7 -19.683 2.413 -0.500
61 HB1 ALA 7 3HB ALA 7 -20.802 2.316 1.668
62 HB2 ALA 7 1HB ALA 7 -21.973 1.167 1.019
63 HB3 ALA 7 2HB ALA 7 -21.923 2.817 0.402
64 H ILE 8 H ILE 8 -20.958 -0.877 -0.095
65 HA ILE 8 HA ILE 8 -18.956 -1.768 1.683
66 HB ILE 8 HB ILE 8 -20.433 -3.528 -0.260
67 HG12 ILE 8 2HG1 ILE 8 -21.650 -3.305 2.369
68 HG13 ILE 8 1HG1 ILE 8 -21.643 -1.760 1.532
69 HG21 ILE 8 1HG2 ILE 8 -19.914 -5.276 1.110
70 HG22 ILE 8 2HG2 ILE 8 -19.831 -4.268 2.553
71 HG23 ILE 8 3HG2 ILE 8 -18.505 -4.251 1.389
72 HD11 ILE 8 3HD1 ILE 8 -23.434 -2.414 0.425
73 HD12 ILE 8 1HD1 ILE 8 -23.330 -4.028 1.132
74 HD13 ILE 8 2HD1 ILE 8 -22.457 -3.658 -0.355
75 H LYS 9 H LYS 9 -19.306 -2.043 -1.829
76 HA LYS 9 HA LYS 9 -17.011 -3.546 -2.339
77 HB2 LYS 9 2HB LYS 9 -18.759 -3.138 -4.016
78 HB3 LYS 9 1HB LYS 9 -18.295 -1.442 -4.090
79 HG2 LYS 9 2HG LYS 9 -15.927 -2.593 -4.631
80 HG3 LYS 9 1HG LYS 9 -17.023 -3.815 -5.284
81 HD2 LYS 9 2HD LYS 9 -18.092 -2.166 -6.687
82 HD3 LYS 9 1HD LYS 9 -17.133 -0.876 -5.961
83 HE2 LYS 9 2HE LYS 9 -15.671 -3.153 -7.174
84 HE3 LYS 9 1HE LYS 9 -16.475 -2.031 -8.270
85 HZ1 LYS 9 3HZ LYS 9 -14.156 -1.624 -6.573
86 HZ2 LYS 9 1HZ LYS 9 -15.247 -0.331 -6.639
87 HZ3 LYS 9 2HZ LYS 9 -14.547 -0.920 -8.060
88 H GLN 10 H GLN 10 -17.447 -0.058 -2.061
89 HA GLN 10 HA GLN 10 -14.751 0.587 -2.742
90 HB2 GLN 10 2HB GLN 10 -16.721 2.152 -2.919
91 HB3 GLN 10 1HB GLN 10 -16.696 2.277 -1.166
92 HG2 GLN 10 2HG GLN 10 -14.385 3.139 -1.300
93 HG3 GLN 10 1HG GLN 10 -14.506 3.102 -3.059
94 HE21 GLN 10 1HE2 GLN 10 -15.548 4.714 -4.102
95 HE22 GLN 10 2HE2 GLN 10 -16.248 6.085 -3.317
96 H ALA 11 H ALA 11 -16.483 -0.030 0.246
97 HA ALA 11 HA ALA 11 -14.349 0.766 1.971
98 HB1 ALA 11 3HB ALA 11 -16.938 -0.679 2.349
99 HB2 ALA 11 1HB ALA 11 -16.401 0.857 3.031
100 HB3 ALA 11 2HB ALA 11 -15.742 -0.659 3.646
101 H GLY 12 H GLY 12 -15.378 -2.236 0.476
102 HA2 GLY 12 2HA GLY 12 -13.640 -3.932 1.976
103 HA3 GLY 12 1HA GLY 12 -14.450 -4.345 0.469
104 H LYS 13 H LYS 13 -13.244 -1.933 -0.833
105 HA LYS 13 HA LYS 13 -10.895 -3.221 -1.820
106 HB2 LYS 13 2HB LYS 13 -12.591 -1.024 -2.588
107 HB3 LYS 13 1HB LYS 13 -10.905 -0.531 -2.675
108 HG2 LYS 13 2HG LYS 13 -11.721 -1.419 -4.801
109 HG3 LYS 13 1HG LYS 13 -10.407 -2.392 -4.142
110 HD2 LYS 13 2HD LYS 13 -11.870 -4.114 -3.487
111 HD3 LYS 13 1HD LYS 13 -13.292 -3.086 -3.670
112 HE2 LYS 13 2HE LYS 13 -12.656 -2.968 -6.144
113 HE3 LYS 13 1HE LYS 13 -11.584 -4.324 -5.806
114 HZ1 LYS 13 3HZ LYS 13 -13.407 -5.507 -6.322
115 HZ2 LYS 13 1HZ LYS 13 -14.481 -4.247 -5.966
116 HZ3 LYS 13 2HZ LYS 13 -13.848 -5.199 -4.718
117 H VAL 14 H VAL 14 -11.533 -0.422 0.249
118 HA VAL 14 HA VAL 14 -8.903 0.500 0.486
119 HB VAL 14 HB VAL 14 -10.931 0.666 2.703
120 HG11 VAL 14 1HG1 VAL 14 -8.896 1.605 3.360
121 HG12 VAL 14 2HG1 VAL 14 -9.865 2.981 2.835
122 HG13 VAL 14 3HG1 VAL 14 -8.618 2.323 1.777
123 HG21 VAL 14 3HG2 VAL 14 -11.123 1.725 -0.015
124 HG22 VAL 14 1HG2 VAL 14 -11.299 2.951 1.241
125 HG23 VAL 14 2HG2 VAL 14 -12.365 1.547 1.223
126 H ILE 15 H ILE 15 -10.692 -1.963 2.252
127 HA ILE 15 HA ILE 15 -8.710 -2.386 4.254
128 HB ILE 15 HB ILE 15 -10.820 -4.340 3.334
129 HG12 ILE 15 2HG1 ILE 15 -11.094 -2.427 5.642
130 HG13 ILE 15 1HG1 ILE 15 -11.599 -1.977 4.017
131 HG21 ILE 15 1HG2 ILE 15 -9.002 -4.168 5.688
132 HG22 ILE 15 2HG2 ILE 15 -9.462 -5.566 4.718
133 HG23 ILE 15 3HG2 ILE 15 -10.597 -4.892 5.887
134 HD11 ILE 15 3HD1 ILE 15 -12.882 -4.301 4.219
135 HD12 ILE 15 1HD1 ILE 15 -13.570 -2.773 4.771
136 HD13 ILE 15 2HD1 ILE 15 -12.813 -3.869 5.928
137 H GLY 16 H GLY 16 -9.388 -3.805 1.103
138 HA2 GLY 16 2HA GLY 16 -7.517 -5.941 1.332
139 HA3 GLY 16 1HA GLY 16 -8.238 -5.350 -0.157
140 H LYS 17 H LYS 17 -7.266 -2.596 0.379
141 HA LYS 17 HA LYS 17 -4.893 -2.680 -1.087
142 HB2 LYS 17 2HB LYS 17 -6.520 -0.709 -0.644
143 HB3 LYS 17 1HB LYS 17 -5.539 -0.421 0.786
144 HG2 LYS 17 2HG LYS 17 -4.321 -0.620 -1.948
145 HG3 LYS 17 1HG LYS 17 -4.979 0.894 -1.322
146 HD2 LYS 17 2HD LYS 17 -3.476 0.356 0.745
147 HD3 LYS 17 1HD LYS 17 -2.611 -0.676 -0.395
148 HE2 LYS 17 2HE LYS 17 -1.451 1.207 -0.819
149 HE3 LYS 17 1HE LYS 17 -2.829 1.582 -1.854
150 HZ1 LYS 17 3HZ LYS 17 -2.040 3.333 -0.182
151 HZ2 LYS 17 1HZ LYS 17 -2.815 2.386 0.986
152 HZ3 LYS 17 2HZ LYS 17 -3.700 3.039 -0.298
153 H GLY 18 H GLY 18 -5.462 -2.587 2.382
154 HA2 GLY 18 2HA GLY 18 -2.740 -2.202 3.125
155 HA3 GLY 18 1HA GLY 18 -4.027 -2.781 4.172
156 H LEU 19 H LEU 19 -4.774 -5.069 2.715
157 HA LEU 19 HA LEU 19 -2.811 -6.908 3.641
158 HG LEU 19 HG LEU 19 -4.764 -7.522 4.858
159 HB2 LEU 19 2HB LEU 19 -5.459 -7.052 2.340
160 HB3 LEU 19 1HB LEU 19 -4.401 -8.420 2.041
161 HD11 LEU 19 1HD1 LEU 19 -6.718 -9.489 3.832
162 HD12 LEU 19 2HD1 LEU 19 -7.014 -7.794 3.441
163 HD13 LEU 19 3HD1 LEU 19 -6.871 -8.298 5.125
164 HD21 LEU 19 3HD2 LEU 19 -3.355 -9.293 4.888
165 HD22 LEU 19 1HD2 LEU 19 -3.972 -9.951 3.373
166 HD23 LEU 19 2HD2 LEU 19 -4.870 -10.196 4.872
167 H ARG 20 H ARG 20 -3.610 -5.511 0.532
168 HA ARG 20 HA ARG 20 -1.965 -7.275 -1.004
169 HE ARG 20 HE ARG 20 -1.839 -7.091 -4.828
170 HB2 ARG 20 2HB ARG 20 -3.727 -5.025 -1.499
171 HB3 ARG 20 1HB ARG 20 -2.250 -4.887 -2.443
172 HG2 ARG 20 2HG ARG 20 -2.798 -7.433 -2.960
173 HG3 ARG 20 1HG ARG 20 -4.436 -6.878 -2.611
174 HD2 ARG 20 2HD ARG 20 -4.516 -6.183 -4.726
175 HD3 ARG 20 1HD ARG 20 -3.411 -4.898 -4.243
176 HH11 ARG 20 1HH1 ARG 20 -4.106 -5.056 -6.529
177 HH12 ARG 20 2HH1 ARG 20 -3.339 -5.271 -8.066
178 HH21 ARG 20 1HH2 ARG 20 -0.826 -7.375 -6.848
179 HH22 ARG 20 2HH2 ARG 20 -1.476 -6.586 -8.248
180 H ALA 21 H ALA 21 -1.503 -4.237 0.660
181 HA ALA 21 HA ALA 21 1.010 -3.606 -0.532
182 HB1 ALA 21 3HB ALA 21 1.089 -2.210 1.756
183 HB2 ALA 21 1HB ALA 21 -0.643 -2.533 1.668
184 HB3 ALA 21 2HB ALA 21 0.165 -1.696 0.342
185 H ILE 22 H ILE 22 0.010 -5.195 2.458
186 HA ILE 22 HA ILE 22 2.609 -5.513 3.537
187 HB ILE 22 HB ILE 22 0.197 -7.259 4.046
188 HG12 ILE 22 2HG1 ILE 22 0.960 -5.080 5.912
189 HG13 ILE 22 1HG1 ILE 22 0.195 -4.595 4.403
190 HG21 ILE 22 1HG2 ILE 22 2.524 -6.681 5.864
191 HG22 ILE 22 2HG2 ILE 22 2.443 -8.088 4.806
192 HG23 ILE 22 3HG2 ILE 22 1.247 -7.877 6.085
193 HD11 ILE 22 3HD1 ILE 22 -1.517 -6.491 5.107
194 HD12 ILE 22 1HD1 ILE 22 -1.653 -4.833 5.690
195 HD13 ILE 22 2HD1 ILE 22 -0.919 -6.068 6.713
196 H ASN 23 H ASN 23 0.736 -7.330 1.224
197 HA ASN 23 HA ASN 23 2.335 -9.695 1.308
198 HB2 ASN 23 2HB ASN 23 -0.108 -9.081 0.247
199 HB3 ASN 23 1HB ASN 23 0.898 -9.119 -1.198
200 HD21 ASN 23 1HD2 ASN 23 -1.235 -10.916 -0.279
201 HD22 ASN 23 2HD2 ASN 23 -0.532 -12.494 -0.244
202 H ILE 24 H ILE 24 2.167 -6.896 -0.873
203 HA ILE 24 HA ILE 24 4.271 -7.769 -2.570
204 HB ILE 24 HB ILE 24 3.325 -4.933 -2.150
205 HG12 ILE 24 2HG1 ILE 24 2.357 -6.696 -4.368
206 HG13 ILE 24 1HG1 ILE 24 1.608 -6.826 -2.782
207 HG21 ILE 24 1HG2 ILE 24 5.119 -4.594 -3.478
208 HG22 ILE 24 2HG2 ILE 24 4.005 -5.104 -4.747
209 HG23 ILE 24 3HG2 ILE 24 5.141 -6.261 -4.056
210 HD11 ILE 24 3HD1 ILE 24 0.904 -4.553 -2.850
211 HD12 ILE 24 1HD1 ILE 24 0.440 -5.311 -4.374
212 HD13 ILE 24 2HD1 ILE 24 1.847 -4.248 -4.307
213 H ALA 25 H ALA 25 4.156 -6.018 0.436
214 HA ALA 25 HA ALA 25 6.616 -4.715 0.394
215 HB1 ALA 25 3HB ALA 25 4.619 -4.877 2.183
216 HB2 ALA 25 1HB ALA 25 6.219 -4.246 2.570
217 HB3 ALA 25 2HB ALA 25 5.810 -5.914 2.967
218 H GLY 26 H GLY 26 5.816 -8.051 1.256
219 HA2 GLY 26 2HA GLY 26 8.342 -8.804 2.238
220 HA3 GLY 26 1HA GLY 26 7.141 -9.901 1.569
221 H THR 27 H THR 27 7.098 -8.569 -1.029
222 HA THR 27 HA THR 27 9.306 -9.975 -2.214
223 HB THR 27 HB THR 27 7.342 -8.134 -3.585
224 HG1 THR 27 1HG THR 27 6.033 -9.913 -3.826
225 HG21 THR 27 3HG2 THR 27 8.292 -10.582 -4.898
226 HG22 THR 27 1HG2 THR 27 9.495 -9.308 -4.692
227 HG23 THR 27 2HG2 THR 27 7.994 -8.974 -5.557
228 H THR 28 H THR 28 8.318 -6.577 -1.946
229 HA THR 28 HA THR 28 10.450 -5.463 -3.382
230 HB THR 28 HB THR 28 9.400 -3.941 -1.064
231 HG1 THR 28 1HG THR 28 7.369 -3.966 -1.682
232 HG21 THR 28 3HG2 THR 28 10.667 -2.740 -2.696
233 HG22 THR 28 1HG2 THR 28 8.979 -2.240 -2.805
234 HG23 THR 28 2HG2 THR 28 9.650 -3.351 -4.000
235 H HIS 29 H HIS 29 10.149 -6.405 -0.008
236 HA HIS 29 HA HIS 29 12.487 -5.216 0.976
237 HD1 HIS 29 1HD HIS 29 13.849 -5.236 2.437
238 HD2 HIS 29 2HD HIS 29 11.361 -7.363 4.997
239 HE1 HIS 29 1HE HIS 29 14.812 -4.909 4.738
240 HE2 HIS 29 2HE HIS 29 13.341 -6.278 6.258
241 HB2 HIS 29 2HB HIS 29 10.533 -6.439 2.213
242 HB3 HIS 29 1HB HIS 29 11.532 -7.871 1.995
243 H ASP 30 H ASP 30 11.961 -8.137 -0.855
244 HA ASP 30 HA ASP 30 14.530 -9.283 -0.371
245 HB2 ASP 30 2HB ASP 30 12.149 -10.123 -1.555
246 HB3 ASP 30 1HB ASP 30 13.304 -10.089 -2.881
247 H VAL 31 H VAL 31 13.107 -7.661 -3.208
248 HA VAL 31 HA VAL 31 15.321 -7.612 -4.840
249 HB VAL 31 HB VAL 31 13.384 -5.311 -4.657
250 HG11 VAL 31 1HG1 VAL 31 14.017 -4.784 -6.767
251 HG12 VAL 31 2HG1 VAL 31 14.344 -6.460 -7.206
252 HG13 VAL 31 3HG1 VAL 31 15.507 -5.562 -6.235
253 HG21 VAL 31 3HG2 VAL 31 12.935 -8.114 -5.559
254 HG22 VAL 31 1HG2 VAL 31 12.181 -6.805 -6.469
255 HG23 VAL 31 2HG2 VAL 31 11.834 -6.995 -4.752
256 H VAL 32 H VAL 32 14.470 -5.447 -2.202
257 HA VAL 32 HA VAL 32 16.584 -3.585 -2.705
258 HB VAL 32 HB VAL 32 15.056 -3.995 -0.132
259 HG11 VAL 32 1HG1 VAL 32 16.657 -2.553 0.547
260 HG12 VAL 32 2HG1 VAL 32 15.611 -1.367 -0.234
261 HG13 VAL 32 3HG1 VAL 32 17.014 -2.008 -1.092
262 HG21 VAL 32 3HG2 VAL 32 13.341 -2.686 -0.895
263 HG22 VAL 32 1HG2 VAL 32 13.792 -3.501 -2.395
264 HG23 VAL 32 2HG2 VAL 32 14.355 -1.859 -2.080
265 H SER 33 H SER 33 16.229 -6.518 -0.853
266 HA SER 33 HA SER 33 18.597 -6.165 0.715
267 HG SER 33 HG SER 33 17.489 -8.334 2.729
268 HB2 SER 33 2HB SER 33 16.455 -7.778 0.981
269 HB3 SER 33 1HB SER 33 17.575 -8.907 0.222
270 H PHE 34 H PHE 34 17.846 -7.500 -2.412
271 HA PHE 34 HA PHE 34 20.235 -9.001 -2.747
272 HD1 PHE 34 1HD PHE 34 21.337 -9.838 -4.685
273 HD2 PHE 34 2HD PHE 34 17.170 -10.648 -4.943
274 HE1 PHE 34 1HE PHE 34 21.833 -12.171 -5.291
275 HE2 PHE 34 2HE PHE 34 17.655 -12.982 -5.547
276 HZ PHE 34 HZ PHE 34 19.991 -13.747 -5.721
277 HB2 PHE 34 2HB PHE 34 17.863 -8.588 -4.200
278 HB3 PHE 34 1HB PHE 34 19.162 -8.039 -5.254
279 H PHE 35 H PHE 35 19.333 -5.667 -3.365
280 HA PHE 35 HA PHE 35 21.953 -5.139 -4.566
281 HD1 PHE 35 1HD PHE 35 21.252 -5.266 -6.917
282 HD2 PHE 35 2HD PHE 35 21.156 -1.243 -5.529
283 HE1 PHE 35 1HE PHE 35 22.499 -4.552 -8.913
284 HE2 PHE 35 2HE PHE 35 22.401 -0.522 -7.525
285 HZ PHE 35 HZ PHE 35 23.075 -2.176 -9.220
286 HB2 PHE 35 2HB PHE 35 19.438 -4.201 -5.200
287 HB3 PHE 35 1HB PHE 35 20.129 -2.861 -4.287
288 H ARG 36 H ARG 36 19.847 -3.894 -1.981
289 HA ARG 36 HA ARG 36 20.300 -2.831 -0.024
290 HE ARG 36 HE ARG 36 20.850 -4.161 4.438
291 HB2 ARG 36 2HB ARG 36 21.903 -4.920 0.025
292 HB3 ARG 36 1HB ARG 36 23.160 -3.703 -0.147
293 HG2 ARG 36 2HG ARG 36 23.022 -3.974 2.140
294 HG3 ARG 36 1HG ARG 36 22.001 -2.562 1.861
295 HD2 ARG 36 2HD ARG 36 20.075 -3.688 2.336
296 HD3 ARG 36 1HD ARG 36 20.711 -5.233 1.777
297 HH11 ARG 36 1HH1 ARG 36 22.329 -6.355 2.164
298 HH12 ARG 36 2HH1 ARG 36 23.044 -7.344 3.391
299 HH21 ARG 36 1HH2 ARG 36 21.789 -5.461 6.054
300 HH22 ARG 36 2HH2 ARG 36 22.735 -6.839 5.600
301 HA PRO 37 HA PRO 37 22.445 0.575 -2.408
302 HB2 PRO 37 2HB PRO 37 20.383 2.332 -2.342
303 HB3 PRO 37 1HB PRO 37 20.554 1.107 -3.606
304 HG2 PRO 37 2HG PRO 37 18.839 1.069 -1.151
305 HG3 PRO 37 1HG PRO 37 18.436 0.576 -2.806
306 HD2 PRO 37 2HD PRO 37 19.089 -1.202 -0.866
307 HD3 PRO 37 1HD PRO 37 19.463 -1.472 -2.580
308 H LYS 38 H LYS 38 22.427 3.018 -1.675
309 HA LYS 38 HA LYS 38 22.579 3.039 1.269
310 HB2 LYS 38 2HB LYS 38 24.400 4.088 -0.834
311 HB3 LYS 38 1HB LYS 38 24.230 5.045 0.632
312 HG2 LYS 38 2HG LYS 38 25.591 3.694 1.734
313 HG3 LYS 38 1HG LYS 38 24.607 2.290 1.319
314 HD2 LYS 38 2HD LYS 38 25.877 2.757 -1.037
315 HD3 LYS 38 1HD LYS 38 27.105 3.277 0.119
316 HE2 LYS 38 2HE LYS 38 26.630 1.051 1.312
317 HE3 LYS 38 1HE LYS 38 25.824 0.578 -0.183
318 HZ1 LYS 38 3HZ LYS 38 27.983 1.241 -1.309
319 HZ2 LYS 38 1HZ LYS 38 28.003 -0.185 -0.397
320 HZ3 LYS 38 2HZ LYS 38 28.677 1.233 0.232
321 H LYS 39 H LYS 39 20.418 3.772 1.455
322 HA LYS 39 HA LYS 39 20.169 6.651 1.084
323 HB2 LYS 39 2HB LYS 39 18.690 4.658 -0.456
324 HB3 LYS 39 1HB LYS 39 17.634 5.784 0.387
325 HG2 LYS 39 2HG LYS 39 19.927 6.720 -1.309
326 HG3 LYS 39 1HG LYS 39 18.329 6.385 -1.980
327 HD2 LYS 39 2HD LYS 39 17.327 8.035 -0.531
328 HD3 LYS 39 1HD LYS 39 18.870 8.304 0.283
329 HE2 LYS 39 2HE LYS 39 19.578 8.755 -2.285
330 HE3 LYS 39 1HE LYS 39 17.899 9.287 -2.318
331 HZ1 LYS 39 3HZ LYS 39 18.619 10.536 -0.161
332 HZ2 LYS 39 1HZ LYS 39 18.952 11.195 -1.684
333 HZ3 LYS 39 2HZ LYS 39 20.167 10.392 -0.826
334 H LYS 40 H LYS 40 19.435 7.537 2.893
335 HA LYS 40 HA LYS 40 18.475 7.807 4.938
336 HB2 LYS 40 2HB LYS 40 16.603 5.762 3.753
337 HB3 LYS 40 1HB LYS 40 16.346 6.471 5.342
338 HG2 LYS 40 2HG LYS 40 16.095 8.649 4.412
339 HG3 LYS 40 1HG LYS 40 16.605 8.089 2.818
340 HD2 LYS 40 2HD LYS 40 14.598 6.513 2.925
341 HD3 LYS 40 1HD LYS 40 14.050 7.494 4.286
342 HE2 LYS 40 2HE LYS 40 14.012 9.470 2.899
343 HE3 LYS 40 1HE LYS 40 14.693 8.569 1.544
344 HZ1 LYS 40 3HZ LYS 40 12.099 8.986 1.841
345 HZ2 LYS 40 1HZ LYS 40 12.229 7.527 2.691
346 HZ3 LYS 40 2HZ LYS 40 12.720 7.613 1.074
347 H LYS 41 H LYS 41 20.448 6.923 5.847
348 HA LYS 41 HA LYS 41 20.704 4.180 6.518
349 HB2 LYS 41 2HB LYS 41 22.135 6.688 7.138
350 HB3 LYS 41 1HB LYS 41 22.292 5.414 8.341
351 HG2 LYS 41 2HG LYS 41 22.722 4.067 5.996
352 HG3 LYS 41 1HG LYS 41 23.460 5.638 5.681
353 HD2 LYS 41 2HD LYS 41 24.383 5.162 8.172
354 HD3 LYS 41 1HD LYS 41 24.255 3.511 7.561
355 HE2 LYS 41 2HE LYS 41 25.804 3.873 5.882
356 HE3 LYS 41 1HE LYS 41 25.559 5.618 5.892
357 HZ1 LYS 41 3HZ LYS 41 26.891 4.073 8.051
358 HZ2 LYS 41 1HZ LYS 41 26.710 5.755 7.992
359 HZ3 LYS 41 2HZ LYS 41 27.692 4.970 6.860
360 H HIS 42 H HIS 42 19.712 7.021 8.409
361 HA HIS 42 HA HIS 42 18.111 5.289 10.117
362 HD1 HIS 42 1HD HIS 42 22.232 6.098 10.259
363 HD2 HIS 42 2HD HIS 42 19.783 3.469 12.347
364 HE1 HIS 42 1HE HIS 42 23.589 4.001 10.544
365 HE2 HIS 42 2HE HIS 42 22.119 2.458 11.889
366 HB2 HIS 42 2HB HIS 42 20.142 7.203 11.284
367 HB3 HIS 42 1HB HIS 42 19.036 6.170 12.184
Start of MODEL 16
1 H1 GLY 1 1H GLY 1 -26.564 3.100 -9.459
2 H2 GLY 1 2H GLY 1 -26.219 3.443 -7.838
3 H3 GLY 1 3H GLY 1 -26.561 4.702 -8.916
4 HA2 GLY 1 1HA GLY 1 -28.783 4.376 -8.868
5 HA3 GLY 1 2HA GLY 1 -28.601 2.642 -8.640
6 H LYS 2 H LYS 2 -26.872 4.901 -6.636
7 HA LYS 2 HA LYS 2 -26.979 5.402 -4.421
8 HB2 LYS 2 2HB LYS 2 -29.916 4.798 -4.781
9 HB3 LYS 2 1HB LYS 2 -29.209 5.587 -3.379
10 HG2 LYS 2 2HG LYS 2 -28.891 6.711 -6.140
11 HG3 LYS 2 1HG LYS 2 -30.308 7.060 -5.145
12 HD2 LYS 2 2HD LYS 2 -29.151 8.391 -3.730
13 HD3 LYS 2 1HD LYS 2 -27.692 7.403 -3.827
14 HE2 LYS 2 2HE LYS 2 -26.845 8.589 -5.551
15 HE3 LYS 2 1HE LYS 2 -28.425 8.832 -6.294
16 HZ1 LYS 2 3HZ LYS 2 -28.037 10.935 -5.607
17 HZ2 LYS 2 1HZ LYS 2 -27.022 10.472 -4.335
18 HZ3 LYS 2 2HZ LYS 2 -28.700 10.359 -4.160
19 H ILE 3 H ILE 3 -26.904 2.490 -5.502
20 HA ILE 3 HA ILE 3 -28.041 0.746 -3.677
21 HB ILE 3 HB ILE 3 -25.337 0.296 -4.918
22 HG12 ILE 3 2HG1 ILE 3 -27.191 -0.824 -6.643
23 HG13 ILE 3 1HG1 ILE 3 -27.919 0.725 -6.228
24 HG21 ILE 3 1HG2 ILE 3 -27.482 -1.373 -3.754
25 HG22 ILE 3 2HG2 ILE 3 -25.731 -1.551 -3.664
26 HG23 ILE 3 3HG2 ILE 3 -26.591 -2.030 -5.125
27 HD11 ILE 3 3HD1 ILE 3 -25.355 1.455 -6.744
28 HD12 ILE 3 1HD1 ILE 3 -26.676 1.501 -7.912
29 HD13 ILE 3 2HD1 ILE 3 -25.580 0.120 -7.873
30 HA PRO 4 HA PRO 4 -25.803 2.157 0.005
31 HB2 PRO 4 2HB PRO 4 -27.178 -0.245 1.090
32 HB3 PRO 4 1HB PRO 4 -27.119 1.401 1.728
33 HG2 PRO 4 2HG PRO 4 -29.318 0.485 0.543
34 HG3 PRO 4 1HG PRO 4 -28.782 2.158 0.302
35 HD2 PRO 4 2HD PRO 4 -28.556 -0.192 -1.530
36 HD3 PRO 4 1HD PRO 4 -28.885 1.511 -1.913
37 H VAL 5 H VAL 5 -26.059 -1.190 -1.091
38 HA VAL 5 HA VAL 5 -23.959 -2.283 0.382
39 HB VAL 5 HB VAL 5 -24.669 -3.164 -2.408
40 HG11 VAL 5 1HG1 VAL 5 -23.672 -4.567 0.055
41 HG12 VAL 5 2HG1 VAL 5 -22.815 -4.325 -1.468
42 HG13 VAL 5 3HG1 VAL 5 -24.213 -5.399 -1.402
43 HG21 VAL 5 3HG2 VAL 5 -26.318 -3.217 0.046
44 HG22 VAL 5 1HG2 VAL 5 -26.270 -4.702 -0.906
45 HG23 VAL 5 2HG2 VAL 5 -26.805 -3.194 -1.648
46 H LYS 6 H LYS 6 -23.976 -0.399 -2.563
47 HA LYS 6 HA LYS 6 -21.418 -1.002 -3.520
48 HB2 LYS 6 2HB LYS 6 -23.479 0.675 -4.284
49 HB3 LYS 6 1HB LYS 6 -22.180 1.792 -3.895
50 HG2 LYS 6 2HG LYS 6 -22.109 1.242 -6.235
51 HG3 LYS 6 1HG LYS 6 -20.696 0.564 -5.426
52 HD2 LYS 6 2HD LYS 6 -22.988 -1.248 -5.500
53 HD3 LYS 6 1HD LYS 6 -22.384 -0.803 -7.098
54 HE2 LYS 6 2HE LYS 6 -20.459 -1.940 -6.825
55 HE3 LYS 6 1HE LYS 6 -20.314 -1.487 -5.127
56 HZ1 LYS 6 3HZ LYS 6 -22.456 -3.344 -5.771
57 HZ2 LYS 6 1HZ LYS 6 -21.392 -3.327 -4.454
58 HZ3 LYS 6 2HZ LYS 6 -20.885 -3.948 -5.942
59 H ALA 7 H ALA 7 -22.498 1.297 -1.087
60 HA ALA 7 HA ALA 7 -20.123 2.731 -0.748
61 HB1 ALA 7 3HB ALA 7 -21.807 3.741 0.398
62 HB2 ALA 7 1HB ALA 7 -21.093 2.834 1.731
63 HB3 ALA 7 2HB ALA 7 -22.524 2.211 0.910
64 H ILE 8 H ILE 8 -21.312 -0.100 1.059
65 HA ILE 8 HA ILE 8 -19.005 -0.455 2.626
66 HB ILE 8 HB ILE 8 -20.842 -2.681 1.775
67 HG12 ILE 8 2HG1 ILE 8 -21.632 -1.522 4.273
68 HG13 ILE 8 1HG1 ILE 8 -21.593 -0.254 3.055
69 HG21 ILE 8 1HG2 ILE 8 -18.896 -3.367 3.028
70 HG22 ILE 8 2HG2 ILE 8 -20.337 -3.538 4.027
71 HG23 ILE 8 3HG2 ILE 8 -19.246 -2.176 4.280
72 HD11 ILE 8 3HD1 ILE 8 -23.731 -1.756 3.491
73 HD12 ILE 8 1HD1 ILE 8 -22.919 -2.794 2.321
74 HD13 ILE 8 2HD1 ILE 8 -23.323 -1.133 1.891
75 H LYS 9 H LYS 9 -20.018 -1.909 -0.431
76 HA LYS 9 HA LYS 9 -17.928 -3.721 -0.757
77 HB2 LYS 9 2HB LYS 9 -20.129 -2.949 -2.236
78 HB3 LYS 9 1HB LYS 9 -18.784 -2.454 -3.253
79 HG2 LYS 9 2HG LYS 9 -19.316 -5.219 -2.190
80 HG3 LYS 9 1HG LYS 9 -19.476 -4.671 -3.859
81 HD2 LYS 9 2HD LYS 9 -17.033 -4.140 -3.836
82 HD3 LYS 9 1HD LYS 9 -16.938 -4.902 -2.247
83 HE2 LYS 9 2HE LYS 9 -18.243 -6.795 -3.745
84 HE3 LYS 9 1HE LYS 9 -17.106 -6.107 -4.903
85 HZ1 LYS 9 3HZ LYS 9 -15.723 -7.599 -3.979
86 HZ2 LYS 9 1HZ LYS 9 -16.600 -7.707 -2.534
87 HZ3 LYS 9 2HZ LYS 9 -15.531 -6.419 -2.781
88 H GLN 10 H GLN 10 -18.103 -0.286 -1.474
89 HA GLN 10 HA GLN 10 -15.609 -0.174 -2.859
90 HB2 GLN 10 2HB GLN 10 -17.750 1.568 -2.437
91 HB3 GLN 10 1HB GLN 10 -16.394 2.332 -1.621
92 HG2 GLN 10 2HG GLN 10 -15.348 2.827 -3.539
93 HG3 GLN 10 1HG GLN 10 -15.796 1.300 -4.298
94 HE21 GLN 10 1HE2 GLN 10 -16.110 2.745 -6.161
95 HE22 GLN 10 2HE2 GLN 10 -17.643 3.520 -6.347
96 H ALA 11 H ALA 11 -16.650 0.350 0.460
97 HA ALA 11 HA ALA 11 -14.151 1.323 1.409
98 HB1 ALA 11 3HB ALA 11 -15.916 -0.070 3.318
99 HB2 ALA 11 1HB ALA 11 -16.636 1.283 2.445
100 HB3 ALA 11 2HB ALA 11 -15.180 1.530 3.411
101 H GLY 12 H GLY 12 -15.575 -1.857 1.043
102 HA2 GLY 12 2HA GLY 12 -13.683 -3.273 2.617
103 HA3 GLY 12 1HA GLY 12 -14.730 -3.968 1.388
104 H LYS 13 H LYS 13 -13.765 -2.288 -0.755
105 HA LYS 13 HA LYS 13 -11.614 -3.884 -1.650
106 HB2 LYS 13 2HB LYS 13 -13.387 -2.033 -2.783
107 HB3 LYS 13 1HB LYS 13 -11.789 -1.346 -3.040
108 HG2 LYS 13 2HG LYS 13 -12.505 -2.730 -4.920
109 HG3 LYS 13 1HG LYS 13 -11.061 -3.379 -4.141
110 HD2 LYS 13 2HD LYS 13 -12.147 -5.328 -4.053
111 HD3 LYS 13 1HD LYS 13 -13.136 -4.603 -2.785
112 HE2 LYS 13 2HE LYS 13 -14.848 -5.125 -4.144
113 HE3 LYS 13 1HE LYS 13 -14.373 -3.657 -5.001
114 HZ1 LYS 13 3HZ LYS 13 -13.780 -6.466 -5.695
115 HZ2 LYS 13 1HZ LYS 13 -12.854 -5.197 -6.324
116 HZ3 LYS 13 2HZ LYS 13 -14.511 -5.274 -6.647
117 H VAL 14 H VAL 14 -11.780 -0.634 -0.273
118 HA VAL 14 HA VAL 14 -9.129 0.133 -0.676
119 HB VAL 14 HB VAL 14 -10.732 0.905 1.753
120 HG11 VAL 14 1HG1 VAL 14 -9.104 2.784 0.144
121 HG12 VAL 14 2HG1 VAL 14 -8.257 1.597 1.135
122 HG13 VAL 14 3HG1 VAL 14 -9.381 2.728 1.884
123 HG21 VAL 14 3HG2 VAL 14 -11.287 1.458 -1.091
124 HG22 VAL 14 1HG2 VAL 14 -11.340 2.851 -0.013
125 HG23 VAL 14 2HG2 VAL 14 -12.374 1.455 0.298
126 H ILE 15 H ILE 15 -10.627 -1.839 1.809
127 HA ILE 15 HA ILE 15 -8.397 -1.916 3.565
128 HB ILE 15 HB ILE 15 -10.580 -3.984 3.296
129 HG12 ILE 15 2HG1 ILE 15 -10.541 -1.636 5.192
130 HG13 ILE 15 1HG1 ILE 15 -11.353 -1.579 3.628
131 HG21 ILE 15 1HG2 ILE 15 -9.986 -4.011 5.880
132 HG22 ILE 15 2HG2 ILE 15 -8.426 -3.464 5.268
133 HG23 ILE 15 3HG2 ILE 15 -9.107 -4.991 4.709
134 HD11 ILE 15 3HD1 ILE 15 -12.007 -3.284 6.006
135 HD12 ILE 15 1HD1 ILE 15 -12.647 -3.618 4.397
136 HD13 ILE 15 2HD1 ILE 15 -13.017 -2.087 5.195
137 H GLY 16 H GLY 16 -9.516 -3.997 0.933
138 HA2 GLY 16 2HA GLY 16 -7.550 -6.014 1.283
139 HA3 GLY 16 1HA GLY 16 -8.499 -5.740 -0.170
140 H LYS 17 H LYS 17 -7.552 -2.942 -0.371
141 HA LYS 17 HA LYS 17 -5.398 -3.334 -2.105
142 HB2 LYS 17 2HB LYS 17 -7.064 -1.298 -1.730
143 HB3 LYS 17 1HB LYS 17 -5.727 -0.691 -0.764
144 HG2 LYS 17 2HG LYS 17 -4.335 -0.463 -2.582
145 HG3 LYS 17 1HG LYS 17 -5.204 -1.669 -3.531
146 HD2 LYS 17 2HD LYS 17 -6.087 0.114 -4.576
147 HD3 LYS 17 1HD LYS 17 -7.135 0.210 -3.158
148 HE2 LYS 17 2HE LYS 17 -5.505 1.746 -2.110
149 HE3 LYS 17 1HE LYS 17 -4.549 1.701 -3.590
150 HZ1 LYS 17 3HZ LYS 17 -7.345 2.683 -3.361
151 HZ2 LYS 17 1HZ LYS 17 -6.433 2.632 -4.788
152 HZ3 LYS 17 2HZ LYS 17 -5.965 3.651 -3.519
153 H GLY 18 H GLY 18 -5.503 -2.482 1.304
154 HA2 GLY 18 2HA GLY 18 -2.731 -1.895 1.566
155 HA3 GLY 18 1HA GLY 18 -3.835 -2.273 2.880
156 H LEU 19 H LEU 19 -4.647 -4.830 1.990
157 HA LEU 19 HA LEU 19 -2.585 -6.421 3.073
158 HG LEU 19 HG LEU 19 -4.329 -7.602 4.467
159 HB2 LEU 19 2HB LEU 19 -5.294 -6.748 2.381
160 HB3 LEU 19 1HB LEU 19 -4.420 -7.965 1.470
161 HD11 LEU 19 1HD1 LEU 19 -6.329 -8.639 4.230
162 HD12 LEU 19 2HD1 LEU 19 -5.293 -10.062 4.104
163 HD13 LEU 19 3HD1 LEU 19 -5.924 -9.299 2.644
164 HD21 LEU 19 3HD2 LEU 19 -2.309 -8.568 2.983
165 HD22 LEU 19 1HD2 LEU 19 -3.267 -10.036 3.182
166 HD23 LEU 19 2HD2 LEU 19 -2.698 -9.155 4.600
167 H ARG 20 H ARG 20 -3.505 -5.588 -0.200
168 HA ARG 20 HA ARG 20 -1.869 -7.533 -1.488
169 HE ARG 20 HE ARG 20 -0.331 -8.520 -4.036
170 HB2 ARG 20 2HB ARG 20 -3.807 -5.684 -2.283
171 HB3 ARG 20 1HB ARG 20 -2.332 -5.143 -3.071
172 HG2 ARG 20 2HG ARG 20 -3.151 -8.014 -3.213
173 HG3 ARG 20 1HG ARG 20 -3.887 -6.816 -4.280
174 HD2 ARG 20 2HD ARG 20 -2.128 -6.955 -5.627
175 HD3 ARG 20 1HD ARG 20 -1.092 -6.381 -4.321
176 HH11 ARG 20 1HH1 ARG 20 -3.245 -8.610 -5.956
177 HH12 ARG 20 2HH1 ARG 20 -3.101 -10.295 -6.320
178 HH21 ARG 20 1HH2 ARG 20 -0.141 -10.738 -4.515
179 HH22 ARG 20 2HH2 ARG 20 -1.341 -11.505 -5.502
180 H ALA 21 H ALA 21 -1.419 -4.229 -0.406
181 HA ALA 21 HA ALA 21 1.066 -3.778 -1.698
182 HB1 ALA 21 3HB ALA 21 1.002 -1.731 -0.741
183 HB2 ALA 21 1HB ALA 21 0.553 -2.369 0.841
184 HB3 ALA 21 2HB ALA 21 -0.674 -2.178 -0.413
185 H ILE 22 H ILE 22 0.168 -4.948 1.506
186 HA ILE 22 HA ILE 22 2.795 -5.095 2.546
187 HB ILE 22 HB ILE 22 0.426 -6.785 3.357
188 HG12 ILE 22 2HG1 ILE 22 1.225 -4.289 4.796
189 HG13 ILE 22 1HG1 ILE 22 0.276 -4.143 3.321
190 HG21 ILE 22 1HG2 ILE 22 1.753 -6.444 5.618
191 HG22 ILE 22 2HG2 ILE 22 3.113 -6.265 4.509
192 HG23 ILE 22 3HG2 ILE 22 2.152 -7.744 4.497
193 HD11 ILE 22 3HD1 ILE 22 -0.961 -6.120 4.895
194 HD12 ILE 22 1HD1 ILE 22 -1.553 -4.506 4.503
195 HD13 ILE 22 2HD1 ILE 22 -0.588 -4.764 5.957
196 H ASN 23 H ASN 23 0.854 -7.253 0.598
197 HA ASN 23 HA ASN 23 2.489 -9.561 0.940
198 HB2 ASN 23 2HB ASN 23 0.015 -9.178 -0.072
199 HB3 ASN 23 1HB ASN 23 0.940 -9.264 -1.569
200 HD21 ASN 23 1HD2 ASN 23 -0.596 -11.012 0.828
201 HD22 ASN 23 2HD2 ASN 23 0.022 -12.579 0.447
202 H ILE 24 H ILE 24 2.238 -7.074 -1.580
203 HA ILE 24 HA ILE 24 4.334 -8.144 -3.183
204 HB ILE 24 HB ILE 24 3.302 -5.306 -3.171
205 HG12 ILE 24 2HG1 ILE 24 2.362 -7.439 -5.059
206 HG13 ILE 24 1HG1 ILE 24 1.618 -7.284 -3.472
207 HG21 ILE 24 1HG2 ILE 24 5.271 -5.353 -4.434
208 HG22 ILE 24 2HG2 ILE 24 3.981 -5.516 -5.626
209 HG23 ILE 24 3HG2 ILE 24 4.899 -6.935 -5.120
210 HD11 ILE 24 3HD1 ILE 24 1.863 -4.831 -5.111
211 HD12 ILE 24 1HD1 ILE 24 0.592 -5.332 -3.995
212 HD13 ILE 24 2HD1 ILE 24 0.679 -6.043 -5.606
213 H ALA 25 H ALA 25 4.204 -6.032 -0.436
214 HA ALA 25 HA ALA 25 6.565 -4.601 -0.676
215 HB1 ALA 25 3HB ALA 25 5.958 -5.620 2.023
216 HB2 ALA 25 1HB ALA 25 4.650 -4.761 1.211
217 HB3 ALA 25 2HB ALA 25 6.205 -3.968 1.461
218 H GLY 26 H GLY 26 6.045 -7.927 0.354
219 HA2 GLY 26 2HA GLY 26 8.575 -8.472 1.413
220 HA3 GLY 26 1HA GLY 26 7.511 -9.664 0.683
221 H THR 27 H THR 27 7.485 -8.309 -1.910
222 HA THR 27 HA THR 27 9.734 -9.596 -3.066
223 HB THR 27 HB THR 27 8.215 -7.490 -4.548
224 HG1 THR 27 1HG THR 27 7.157 -9.959 -3.661
225 HG21 THR 27 3HG2 THR 27 8.231 -9.125 -6.340
226 HG22 THR 27 1HG2 THR 27 9.031 -10.289 -5.286
227 HG23 THR 27 2HG2 THR 27 9.865 -8.810 -5.757
228 H THR 28 H THR 28 8.866 -6.146 -2.814
229 HA THR 28 HA THR 28 11.284 -5.155 -3.847
230 HB THR 28 HB THR 28 9.311 -3.750 -3.701
231 HG1 THR 28 1HG THR 28 10.996 -2.433 -3.666
232 HG21 THR 28 3HG2 THR 28 8.330 -4.599 -1.637
233 HG22 THR 28 1HG2 THR 28 8.499 -2.844 -1.604
234 HG23 THR 28 2HG2 THR 28 9.635 -3.855 -0.712
235 H HIS 29 H HIS 29 10.274 -5.973 -0.570
236 HA HIS 29 HA HIS 29 12.528 -4.919 0.768
237 HD1 HIS 29 1HD HIS 29 13.616 -5.167 2.691
238 HD2 HIS 29 2HD HIS 29 9.776 -5.411 4.260
239 HE1 HIS 29 1HE HIS 29 13.731 -4.028 4.931
240 HE2 HIS 29 2HE HIS 29 11.417 -4.261 5.897
241 HB2 HIS 29 2HB HIS 29 10.165 -6.042 1.563
242 HB3 HIS 29 1HB HIS 29 11.306 -7.322 1.956
243 H ASP 30 H ASP 30 11.910 -7.952 -0.862
244 HA ASP 30 HA ASP 30 14.132 -9.383 0.141
245 HB2 ASP 30 2HB ASP 30 11.974 -9.924 -1.534
246 HB3 ASP 30 1HB ASP 30 13.382 -10.112 -2.573
247 H VAL 31 H VAL 31 13.626 -7.682 -2.944
248 HA VAL 31 HA VAL 31 16.127 -8.014 -4.050
249 HB VAL 31 HB VAL 31 14.547 -5.464 -4.303
250 HG11 VAL 31 1HG1 VAL 31 15.409 -5.674 -6.667
251 HG12 VAL 31 2HG1 VAL 31 16.462 -6.953 -6.066
252 HG13 VAL 31 3HG1 VAL 31 16.610 -5.317 -5.427
253 HG21 VAL 31 3HG2 VAL 31 13.908 -8.204 -5.261
254 HG22 VAL 31 1HG2 VAL 31 13.595 -6.851 -6.350
255 HG23 VAL 31 2HG2 VAL 31 12.830 -6.900 -4.760
256 H VAL 32 H VAL 32 15.003 -5.540 -1.801
257 HA VAL 32 HA VAL 32 17.323 -3.957 -1.781
258 HB VAL 32 HB VAL 32 15.401 -4.374 0.512
259 HG11 VAL 32 1HG1 VAL 32 17.538 -2.381 -0.077
260 HG12 VAL 32 2HG1 VAL 32 17.121 -3.171 1.444
261 HG13 VAL 32 3HG1 VAL 32 16.108 -1.870 0.820
262 HG21 VAL 32 3HG2 VAL 32 13.832 -3.281 -0.617
263 HG22 VAL 32 1HG2 VAL 32 14.853 -3.376 -2.053
264 HG23 VAL 32 2HG2 VAL 32 14.950 -1.969 -0.992
265 H SER 33 H SER 33 16.341 -6.695 0.227
266 HA SER 33 HA SER 33 18.480 -6.680 2.021
267 HG SER 33 HG SER 33 17.135 -9.254 3.557
268 HB2 SER 33 2HB SER 33 16.287 -8.137 1.930
269 HB3 SER 33 1HB SER 33 17.326 -9.280 1.081
270 H PHE 34 H PHE 34 18.258 -7.809 -1.270
271 HA PHE 34 HA PHE 34 20.669 -9.346 -1.229
272 HD1 PHE 34 2HD PHE 34 18.344 -10.761 -1.461
273 HD2 PHE 34 1HD PHE 34 20.789 -10.567 -4.938
274 HE1 PHE 34 2HE PHE 34 18.258 -13.212 -1.652
275 HE2 PHE 34 1HE PHE 34 20.708 -13.019 -5.136
276 HZ PHE 34 HZ PHE 34 19.442 -14.344 -3.492
277 HB2 PHE 34 2HB PHE 34 18.617 -8.627 -3.175
278 HB3 PHE 34 1HB PHE 34 20.231 -8.625 -3.877
279 H PHE 35 H PHE 35 19.852 -6.007 -1.811
280 HA PHE 35 HA PHE 35 22.640 -5.436 -2.547
281 HD1 PHE 35 1HD PHE 35 22.671 -1.926 -2.890
282 HD2 PHE 35 2HD PHE 35 21.849 -5.032 -5.681
283 HE1 PHE 35 1HE PHE 35 24.356 -0.993 -4.421
284 HE2 PHE 35 2HE PHE 35 23.533 -4.105 -7.215
285 HZ PHE 35 HZ PHE 35 24.789 -2.084 -6.586
286 HB2 PHE 35 2HB PHE 35 20.394 -4.651 -3.841
287 HB3 PHE 35 1HB PHE 35 20.623 -3.285 -2.755
288 H ARG 36 H ARG 36 21.491 -5.904 0.191
289 HA ARG 36 HA ARG 36 22.886 -3.787 1.506
290 HE ARG 36 HE ARG 36 20.156 0.889 1.014
291 HB2 ARG 36 2HB ARG 36 19.989 -3.601 1.190
292 HB3 ARG 36 1HB ARG 36 20.493 -3.539 2.873
293 HG2 ARG 36 2HG ARG 36 21.162 -1.440 2.657
294 HG3 ARG 36 1HG ARG 36 22.183 -1.854 1.278
295 HD2 ARG 36 2HD ARG 36 20.190 -1.720 -0.184
296 HD3 ARG 36 1HD ARG 36 19.239 -1.201 1.206
297 HH11 ARG 36 1HH1 ARG 36 22.026 -1.349 -0.902
298 HH12 ARG 36 2HH1 ARG 36 22.970 -0.108 -1.656
299 HH21 ARG 36 1HH2 ARG 36 21.398 2.522 0.025
300 HH22 ARG 36 2HH2 ARG 36 22.615 2.089 -1.130
301 HA PRO 37 HA PRO 37 23.193 -6.796 4.711
302 HB2 PRO 37 2HB PRO 37 23.078 -5.385 7.011
303 HB3 PRO 37 1HB PRO 37 24.445 -5.268 5.896
304 HG2 PRO 37 2HG PRO 37 22.111 -3.425 6.229
305 HG3 PRO 37 1HG PRO 37 23.825 -3.030 6.014
306 HD2 PRO 37 2HD PRO 37 22.012 -2.940 3.986
307 HD3 PRO 37 1HD PRO 37 23.730 -3.303 3.735
308 H LYS 38 H LYS 38 22.167 -7.720 6.712
309 HA LYS 38 HA LYS 38 19.288 -7.766 6.350
310 HB2 LYS 38 2HB LYS 38 19.385 -9.643 8.000
311 HB3 LYS 38 1HB LYS 38 20.356 -9.905 6.556
312 HG2 LYS 38 2HG LYS 38 22.367 -9.519 7.713
313 HG3 LYS 38 1HG LYS 38 21.526 -8.823 9.101
314 HD2 LYS 38 2HD LYS 38 20.850 -10.882 9.890
315 HD3 LYS 38 1HD LYS 38 20.936 -11.637 8.296
316 HE2 LYS 38 2HE LYS 38 23.508 -10.652 9.275
317 HE3 LYS 38 1HE LYS 38 22.796 -11.901 10.294
318 HZ1 LYS 38 3HZ LYS 38 23.546 -12.072 7.441
319 HZ2 LYS 38 1HZ LYS 38 22.473 -13.178 8.141
320 HZ3 LYS 38 2HZ LYS 38 24.057 -13.050 8.723
321 H LYS 39 H LYS 39 21.647 -6.657 8.674
322 HA LYS 39 HA LYS 39 19.506 -5.877 10.525
323 HB2 LYS 39 2HB LYS 39 21.405 -5.406 12.101
324 HB3 LYS 39 1HB LYS 39 21.241 -7.091 11.626
325 HG2 LYS 39 2HG LYS 39 23.084 -6.918 10.117
326 HG3 LYS 39 1HG LYS 39 23.172 -5.170 10.346
327 HD2 LYS 39 2HD LYS 39 24.266 -5.353 12.315
328 HD3 LYS 39 1HD LYS 39 23.358 -6.785 12.804
329 HE2 LYS 39 2HE LYS 39 24.764 -7.867 10.823
330 HE3 LYS 39 1HE LYS 39 25.874 -6.564 11.246
331 HZ1 LYS 39 3HZ LYS 39 26.460 -8.473 12.507
332 HZ2 LYS 39 1HZ LYS 39 24.869 -8.709 13.031
333 HZ3 LYS 39 2HZ LYS 39 25.750 -7.372 13.575
334 H LYS 40 H LYS 40 19.468 -3.737 11.400
335 HA LYS 40 HA LYS 40 19.785 -1.717 9.458
336 HB2 LYS 40 2HB LYS 40 18.160 -1.779 11.433
337 HB3 LYS 40 1HB LYS 40 19.507 -1.226 12.418
338 HG2 LYS 40 2HG LYS 40 18.597 0.785 11.923
339 HG3 LYS 40 1HG LYS 40 19.643 0.617 10.511
340 HD2 LYS 40 2HD LYS 40 17.658 1.176 9.503
341 HD3 LYS 40 1HD LYS 40 17.540 -0.584 9.496
342 HE2 LYS 40 2HE LYS 40 16.462 -0.013 11.911
343 HE3 LYS 40 1HE LYS 40 15.989 1.418 10.996
344 HZ1 LYS 40 3HZ LYS 40 14.691 0.197 9.582
345 HZ2 LYS 40 1HZ LYS 40 14.495 -0.697 11.006
346 HZ3 LYS 40 2HZ LYS 40 15.564 -1.233 9.809
347 H LYS 41 H LYS 41 21.491 -0.531 8.916
348 HA LYS 41 HA LYS 41 24.008 -0.908 10.213
349 HB2 LYS 41 2HB LYS 41 23.319 -0.260 7.693
350 HB3 LYS 41 1HB LYS 41 23.665 1.344 8.316
351 HG2 LYS 41 2HG LYS 41 25.712 -0.593 9.026
352 HG3 LYS 41 1HG LYS 41 25.493 -0.427 7.281
353 HD2 LYS 41 2HD LYS 41 25.511 2.131 8.683
354 HD3 LYS 41 1HD LYS 41 27.010 1.220 8.887
355 HE2 LYS 41 2HE LYS 41 27.240 2.616 6.957
356 HE3 LYS 41 1HE LYS 41 27.101 0.943 6.413
357 HZ1 LYS 41 3HZ LYS 41 25.094 1.320 5.468
358 HZ2 LYS 41 1HZ LYS 41 25.697 2.898 5.350
359 HZ3 LYS 41 2HZ LYS 41 24.634 2.489 6.600
360 H HIS 42 H HIS 42 24.952 0.272 11.753
361 HA HIS 42 HA HIS 42 23.478 2.479 12.916
362 HD1 HIS 42 1HD HIS 42 27.787 2.395 13.940
363 HD2 HIS 42 2HD HIS 42 25.867 -1.253 13.416
364 HE1 HIS 42 1HE HIS 42 29.619 0.725 13.512
365 HE2 HIS 42 2HE HIS 42 28.427 -1.456 13.109
366 HB2 HIS 42 2HB HIS 42 25.312 2.409 14.638
367 HB3 HIS 42 1HB HIS 42 24.407 0.909 14.466
Start of MODEL 17
1 H1 GLY 1 1H GLY 1 -34.877 -2.256 -6.054
2 H2 GLY 1 2H GLY 1 -33.871 -1.100 -5.338
3 H3 GLY 1 3H GLY 1 -34.181 -2.562 -4.541
4 HA2 GLY 1 1HA GLY 1 -32.698 -3.728 -5.742
5 HA3 GLY 1 2HA GLY 1 -33.042 -2.807 -7.198
6 H LYS 2 H LYS 2 -31.491 -1.494 -7.879
7 HA LYS 2 HA LYS 2 -29.628 -0.192 -7.935
8 HB2 LYS 2 2HB LYS 2 -31.035 0.608 -5.628
9 HB3 LYS 2 1HB LYS 2 -29.347 0.495 -5.151
10 HG2 LYS 2 2HG LYS 2 -29.337 2.628 -5.891
11 HG3 LYS 2 1HG LYS 2 -29.037 1.831 -7.437
12 HD2 LYS 2 2HD LYS 2 -30.756 3.293 -7.957
13 HD3 LYS 2 1HD LYS 2 -31.626 1.794 -7.627
14 HE2 LYS 2 2HE LYS 2 -31.141 3.646 -5.357
15 HE3 LYS 2 1HE LYS 2 -32.345 4.116 -6.555
16 HZ1 LYS 2 3HZ LYS 2 -32.370 1.862 -4.682
17 HZ2 LYS 2 1HZ LYS 2 -33.161 1.681 -6.167
18 HZ3 LYS 2 2HZ LYS 2 -33.617 2.920 -5.109
19 H ILE 3 H ILE 3 -27.599 -0.878 -8.108
20 HA ILE 3 HA ILE 3 -26.604 -3.227 -7.157
21 HB ILE 3 HB ILE 3 -24.828 -0.834 -7.573
22 HG12 ILE 3 2HG1 ILE 3 -24.957 -2.090 -10.017
23 HG13 ILE 3 1HG1 ILE 3 -26.631 -2.167 -9.473
24 HG21 ILE 3 1HG2 ILE 3 -24.328 -3.644 -8.457
25 HG22 ILE 3 2HG2 ILE 3 -24.020 -3.152 -6.794
26 HG23 ILE 3 3HG2 ILE 3 -23.170 -2.358 -8.118
27 HD11 ILE 3 3HD1 ILE 3 -25.630 0.450 -8.985
28 HD12 ILE 3 1HD1 ILE 3 -26.930 -0.061 -10.060
29 HD13 ILE 3 2HD1 ILE 3 -25.269 -0.003 -10.650
30 HA PRO 4 HA PRO 4 -26.020 -1.950 -2.845
31 HB2 PRO 4 2HB PRO 4 -26.327 -4.358 -1.731
32 HB3 PRO 4 1HB PRO 4 -27.715 -3.460 -2.361
33 HG2 PRO 4 2HG PRO 4 -26.216 -5.738 -3.585
34 HG3 PRO 4 1HG PRO 4 -27.959 -5.424 -3.568
35 HD2 PRO 4 2HD PRO 4 -26.265 -4.854 -5.685
36 HD3 PRO 4 1HD PRO 4 -27.847 -4.101 -5.417
37 H VAL 5 H VAL 5 -24.419 -4.545 -4.590
38 HA VAL 5 HA VAL 5 -22.395 -5.166 -2.790
39 HB VAL 5 HB VAL 5 -22.007 -5.130 -5.776
40 HG11 VAL 5 1HG1 VAL 5 -20.719 -7.207 -5.231
41 HG12 VAL 5 2HG1 VAL 5 -20.934 -6.806 -3.528
42 HG13 VAL 5 3HG1 VAL 5 -20.041 -5.712 -4.584
43 HG21 VAL 5 3HG2 VAL 5 -24.056 -6.213 -5.680
44 HG22 VAL 5 1HG2 VAL 5 -23.718 -6.927 -4.103
45 HG23 VAL 5 2HG2 VAL 5 -22.915 -7.553 -5.544
46 H LYS 6 H LYS 6 -22.739 -2.474 -4.992
47 HA LYS 6 HA LYS 6 -20.078 -1.616 -5.094
48 HB2 LYS 6 2HB LYS 6 -22.729 -0.344 -5.528
49 HB3 LYS 6 1HB LYS 6 -21.356 0.727 -5.295
50 HG2 LYS 6 2HG LYS 6 -20.305 0.015 -7.230
51 HG3 LYS 6 1HG LYS 6 -21.209 -1.499 -7.282
52 HD2 LYS 6 2HD LYS 6 -22.451 -0.458 -8.838
53 HD3 LYS 6 1HD LYS 6 -23.213 0.336 -7.458
54 HE2 LYS 6 2HE LYS 6 -21.628 2.194 -7.659
55 HE3 LYS 6 1HE LYS 6 -20.878 1.402 -9.044
56 HZ1 LYS 6 3HZ LYS 6 -22.573 3.196 -9.528
57 HZ2 LYS 6 1HZ LYS 6 -23.753 2.099 -9.008
58 HZ3 LYS 6 2HZ LYS 6 -22.781 1.727 -10.342
59 H ALA 7 H ALA 7 -22.627 -0.969 -2.746
60 HA ALA 7 HA ALA 7 -21.335 1.002 -1.245
61 HB1 ALA 7 3HB ALA 7 -23.491 0.832 -0.565
62 HB2 ALA 7 1HB ALA 7 -22.770 -0.208 0.661
63 HB3 ALA 7 2HB ALA 7 -23.532 -0.919 -0.760
64 H ILE 8 H ILE 8 -21.440 -2.519 -0.703
65 HA ILE 8 HA ILE 8 -19.609 -2.511 1.449
66 HB ILE 8 HB ILE 8 -20.096 -4.832 -0.405
67 HG12 ILE 8 2HG1 ILE 8 -21.757 -4.808 1.973
68 HG13 ILE 8 1HG1 ILE 8 -22.083 -3.410 0.961
69 HG21 ILE 8 1HG2 ILE 8 -19.399 -4.668 2.522
70 HG22 ILE 8 2HG2 ILE 8 -18.320 -5.139 1.208
71 HG23 ILE 8 3HG2 ILE 8 -19.701 -6.156 1.624
72 HD11 ILE 8 3HD1 ILE 8 -22.010 -5.432 -0.866
73 HD12 ILE 8 1HD1 ILE 8 -23.468 -4.771 -0.126
74 HD13 ILE 8 2HD1 ILE 8 -22.720 -6.222 0.544
75 H LYS 9 H LYS 9 -19.248 -3.101 -2.013
76 HA LYS 9 HA LYS 9 -16.651 -3.959 -2.172
77 HB2 LYS 9 2HB LYS 9 -18.301 -3.612 -4.066
78 HB3 LYS 9 1HB LYS 9 -17.818 -1.922 -4.066
79 HG2 LYS 9 2HG LYS 9 -15.403 -3.099 -4.218
80 HG3 LYS 9 1HG LYS 9 -16.393 -4.302 -5.046
81 HD2 LYS 9 2HD LYS 9 -16.014 -2.999 -6.847
82 HD3 LYS 9 1HD LYS 9 -17.325 -2.027 -6.175
83 HE2 LYS 9 2HE LYS 9 -15.299 -0.956 -4.823
84 HE3 LYS 9 1HE LYS 9 -14.404 -1.507 -6.239
85 HZ1 LYS 9 3HZ LYS 9 -15.397 0.832 -6.268
86 HZ2 LYS 9 1HZ LYS 9 -16.884 0.068 -6.531
87 HZ3 LYS 9 2HZ LYS 9 -15.619 -0.136 -7.637
88 H GLN 10 H GLN 10 -17.801 -0.718 -1.520
89 HA GLN 10 HA GLN 10 -15.321 0.604 -1.914
90 HB2 GLN 10 2HB GLN 10 -17.985 1.293 -0.968
91 HB3 GLN 10 1HB GLN 10 -16.730 2.119 -0.056
92 HG2 GLN 10 2HG GLN 10 -15.951 2.375 -2.711
93 HG3 GLN 10 1HG GLN 10 -17.700 2.611 -2.727
94 HE21 GLN 10 1HE2 GLN 10 -18.294 3.919 -0.532
95 HE22 GLN 10 2HE2 GLN 10 -17.454 5.424 -0.420
96 H ALA 11 H ALA 11 -16.965 -0.629 0.965
97 HA ALA 11 HA ALA 11 -14.938 0.146 2.792
98 HB1 ALA 11 3HB ALA 11 -16.283 -0.715 4.389
99 HB2 ALA 11 1HB ALA 11 -16.584 -2.198 3.487
100 HB3 ALA 11 2HB ALA 11 -17.472 -0.727 3.085
101 H GLY 12 H GLY 12 -15.494 -2.712 0.839
102 HA2 GLY 12 2HA GLY 12 -13.532 -4.344 2.116
103 HA3 GLY 12 1HA GLY 12 -14.256 -4.630 0.537
104 H LYS 13 H LYS 13 -13.421 -1.924 -0.389
105 HA LYS 13 HA LYS 13 -10.883 -2.688 -1.447
106 HB2 LYS 13 2HB LYS 13 -12.893 -0.745 -2.022
107 HB3 LYS 13 1HB LYS 13 -11.354 0.091 -1.872
108 HG2 LYS 13 2HG LYS 13 -11.660 -0.493 -4.158
109 HG3 LYS 13 1HG LYS 13 -10.393 -1.530 -3.500
110 HD2 LYS 13 2HD LYS 13 -11.968 -3.355 -3.259
111 HD3 LYS 13 1HD LYS 13 -13.289 -2.321 -3.804
112 HE2 LYS 13 2HE LYS 13 -12.654 -3.645 -5.664
113 HE3 LYS 13 1HE LYS 13 -12.022 -2.025 -5.958
114 HZ1 LYS 13 3HZ LYS 13 -9.950 -3.129 -4.725
115 HZ2 LYS 13 1HZ LYS 13 -10.156 -3.176 -6.406
116 HZ3 LYS 13 2HZ LYS 13 -10.598 -4.508 -5.462
117 H VAL 14 H VAL 14 -11.967 -0.374 0.997
118 HA VAL 14 HA VAL 14 -9.520 0.905 1.438
119 HB VAL 14 HB VAL 14 -11.546 0.405 3.605
120 HG11 VAL 14 1HG1 VAL 14 -9.804 1.575 4.530
121 HG12 VAL 14 2HG1 VAL 14 -10.847 2.889 3.989
122 HG13 VAL 14 3HG1 VAL 14 -9.441 2.428 3.030
123 HG21 VAL 14 3HG2 VAL 14 -11.845 1.956 1.104
124 HG22 VAL 14 1HG2 VAL 14 -12.379 2.745 2.588
125 HG23 VAL 14 2HG2 VAL 14 -13.067 1.190 2.119
126 H ILE 15 H ILE 15 -10.941 -1.976 2.900
127 HA ILE 15 HA ILE 15 -8.818 -2.391 4.760
128 HB ILE 15 HB ILE 15 -10.772 -4.452 3.740
129 HG12 ILE 15 2HG1 ILE 15 -11.059 -2.604 6.117
130 HG13 ILE 15 1HG1 ILE 15 -11.909 -2.406 4.589
131 HG21 ILE 15 1HG2 ILE 15 -8.595 -4.862 5.269
132 HG22 ILE 15 2HG2 ILE 15 -10.070 -5.821 5.387
133 HG23 ILE 15 3HG2 ILE 15 -9.788 -4.494 6.514
134 HD11 ILE 15 3HD1 ILE 15 -13.139 -4.410 4.927
135 HD12 ILE 15 1HD1 ILE 15 -13.235 -3.466 6.414
136 HD13 ILE 15 2HD1 ILE 15 -12.147 -4.852 6.318
137 H GLY 16 H GLY 16 -9.458 -3.378 1.466
138 HA2 GLY 16 2HA GLY 16 -7.377 -5.365 1.399
139 HA3 GLY 16 1HA GLY 16 -8.286 -4.756 0.024
140 H LYS 17 H LYS 17 -7.631 -1.953 0.679
141 HA LYS 17 HA LYS 17 -5.350 -1.662 -0.920
142 HB2 LYS 17 2HB LYS 17 -7.183 0.056 -0.389
143 HB3 LYS 17 1HB LYS 17 -6.266 0.402 1.070
144 HG2 LYS 17 2HG LYS 17 -4.700 1.560 -0.037
145 HG3 LYS 17 1HG LYS 17 -4.679 0.427 -1.390
146 HD2 LYS 17 2HD LYS 17 -6.068 1.696 -2.598
147 HD3 LYS 17 1HD LYS 17 -7.164 1.929 -1.235
148 HE2 LYS 17 2HE LYS 17 -5.900 3.757 -0.414
149 HE3 LYS 17 1HE LYS 17 -4.560 3.407 -1.506
150 HZ1 LYS 17 3HZ LYS 17 -6.421 3.793 -3.295
151 HZ2 LYS 17 1HZ LYS 17 -5.567 5.091 -2.628
152 HZ3 LYS 17 2HZ LYS 17 -7.117 4.718 -2.061
153 H GLY 18 H GLY 18 -5.750 -1.771 2.571
154 HA2 GLY 18 2HA GLY 18 -3.090 -1.009 3.221
155 HA3 GLY 18 1HA GLY 18 -4.217 -1.839 4.286
156 H LEU 19 H LEU 19 -4.642 -4.114 2.607
157 HA LEU 19 HA LEU 19 -2.448 -5.712 3.434
158 HG LEU 19 HG LEU 19 -4.494 -6.454 4.482
159 HB2 LEU 19 2HB LEU 19 -4.915 -6.174 1.814
160 HB3 LEU 19 1HB LEU 19 -3.656 -7.394 1.814
161 HD11 LEU 19 1HD1 LEU 19 -6.400 -7.576 2.527
162 HD12 LEU 19 2HD1 LEU 19 -6.685 -6.558 3.938
163 HD13 LEU 19 3HD1 LEU 19 -6.411 -8.288 4.141
164 HD21 LEU 19 3HD2 LEU 19 -3.660 -8.984 3.149
165 HD22 LEU 19 1HD2 LEU 19 -4.561 -9.066 4.663
166 HD23 LEU 19 2HD2 LEU 19 -3.021 -8.208 4.599
167 H ARG 20 H ARG 20 -3.418 -4.297 0.356
168 HA ARG 20 HA ARG 20 -1.425 -5.619 -1.195
169 HE ARG 20 HE ARG 20 -2.343 -6.554 -5.018
170 HB2 ARG 20 2HB ARG 20 -3.643 -4.284 -1.863
171 HB3 ARG 20 1HB ARG 20 -2.488 -2.972 -2.051
172 HG2 ARG 20 2HG ARG 20 -1.684 -3.807 -3.952
173 HG3 ARG 20 1HG ARG 20 -1.603 -5.446 -3.302
174 HD2 ARG 20 2HD ARG 20 -4.291 -5.093 -3.558
175 HD3 ARG 20 1HD ARG 20 -3.682 -4.155 -4.921
176 HH11 ARG 20 1HH1 ARG 20 -5.677 -5.528 -5.116
177 HH12 ARG 20 2HH1 ARG 20 -6.189 -6.858 -6.101
178 HH21 ARG 20 1HH2 ARG 20 -3.013 -8.303 -6.313
179 HH22 ARG 20 2HH2 ARG 20 -4.677 -8.435 -6.780
180 H ALA 21 H ALA 21 -1.557 -2.658 0.658
181 HA ALA 21 HA ALA 21 0.816 -1.494 -0.378
182 HB1 ALA 21 3HB ALA 21 0.642 -0.327 2.016
183 HB2 ALA 21 1HB ALA 21 -0.996 -0.974 1.904
184 HB3 ALA 21 2HB ALA 21 -0.393 0.122 0.660
185 H ILE 22 H ILE 22 0.113 -3.529 2.421
186 HA ILE 22 HA ILE 22 2.723 -3.480 3.513
187 HB ILE 22 HB ILE 22 0.679 -5.684 3.803
188 HG12 ILE 22 2HG1 ILE 22 0.985 -3.611 5.899
189 HG13 ILE 22 1HG1 ILE 22 0.190 -3.099 4.415
190 HG21 ILE 22 1HG2 ILE 22 3.129 -4.909 5.351
191 HG22 ILE 22 2HG2 ILE 22 2.717 -6.473 4.647
192 HG23 ILE 22 3HG2 ILE 22 1.847 -5.884 6.064
193 HD11 ILE 22 3HD1 ILE 22 -0.738 -4.901 6.539
194 HD12 ILE 22 1HD1 ILE 22 -1.121 -5.400 4.891
195 HD13 ILE 22 2HD1 ILE 22 -1.646 -3.823 5.479
196 H ASN 23 H ASN 23 1.238 -5.314 0.960
197 HA ASN 23 HA ASN 23 3.104 -7.438 0.845
198 HB2 ASN 23 2HB ASN 23 0.731 -6.871 -0.404
199 HB3 ASN 23 1HB ASN 23 1.889 -6.636 -1.709
200 HD21 ASN 23 1HD2 ASN 23 2.889 -8.367 -2.601
201 HD22 ASN 23 2HD2 ASN 23 2.548 -10.004 -2.170
202 H ILE 24 H ILE 24 3.018 -4.215 -0.528
203 HA ILE 24 HA ILE 24 5.081 -4.499 -2.414
204 HB ILE 24 HB ILE 24 4.375 -2.002 -0.867
205 HG12 ILE 24 2HG1 ILE 24 3.296 -2.928 -3.536
206 HG13 ILE 24 1HG1 ILE 24 2.430 -3.094 -2.013
207 HG21 ILE 24 1HG2 ILE 24 5.265 -1.772 -3.643
208 HG22 ILE 24 2HG2 ILE 24 6.491 -2.403 -2.545
209 HG23 ILE 24 3HG2 ILE 24 5.734 -0.843 -2.218
210 HD11 ILE 24 3HD1 ILE 24 1.662 -1.030 -2.175
211 HD12 ILE 24 1HD1 ILE 24 2.404 -0.927 -3.772
212 HD13 ILE 24 2HD1 ILE 24 3.296 -0.387 -2.348
213 H ALA 25 H ALA 25 5.147 -3.517 0.995
214 HA ALA 25 HA ALA 25 7.857 -2.887 1.187
215 HB1 ALA 25 3HB ALA 25 6.017 -4.028 3.287
216 HB2 ALA 25 1HB ALA 25 6.300 -2.322 2.947
217 HB3 ALA 25 2HB ALA 25 7.598 -3.318 3.605
218 H GLY 26 H GLY 26 6.200 -5.995 1.556
219 HA2 GLY 26 2HA GLY 26 8.504 -7.460 2.336
220 HA3 GLY 26 1HA GLY 26 7.010 -8.143 1.708
221 H THR 27 H THR 27 7.118 -6.634 -0.777
222 HA THR 27 HA THR 27 8.698 -8.458 -2.293
223 HB THR 27 HB THR 27 7.528 -5.902 -3.371
224 HG1 THR 27 1HG THR 27 5.742 -6.622 -2.488
225 HG21 THR 27 3HG2 THR 27 7.160 -8.425 -4.801
226 HG22 THR 27 1HG2 THR 27 8.835 -7.894 -4.660
227 HG23 THR 27 2HG2 THR 27 7.633 -6.834 -5.395
228 H THR 28 H THR 28 8.933 -4.969 -1.643
229 HA THR 28 HA THR 28 11.263 -4.486 -3.114
230 HB THR 28 HB THR 28 10.874 -2.961 -0.598
231 HG1 THR 28 1HG THR 28 8.965 -2.979 -2.694
232 HG21 THR 28 3HG2 THR 28 12.053 -1.505 -1.765
233 HG22 THR 28 1HG2 THR 28 10.659 -1.302 -2.825
234 HG23 THR 28 2HG2 THR 28 11.909 -2.480 -3.228
235 H HIS 29 H HIS 29 10.777 -5.684 0.147
236 HA HIS 29 HA HIS 29 13.484 -5.480 0.982
237 HD1 HIS 29 1HD HIS 29 14.773 -5.905 2.450
238 HD2 HIS 29 2HD HIS 29 11.569 -6.171 5.080
239 HE1 HIS 29 1HE HIS 29 15.707 -5.315 4.708
240 HE2 HIS 29 2HE HIS 29 13.732 -5.395 6.268
241 HB2 HIS 29 2HB HIS 29 11.112 -6.041 2.233
242 HB3 HIS 29 1HB HIS 29 11.885 -7.624 2.207
243 H ASP 30 H ASP 30 11.646 -7.873 -0.771
244 HA ASP 30 HA ASP 30 13.540 -9.990 -0.507
245 HB2 ASP 30 2HB ASP 30 10.938 -9.726 -1.478
246 HB3 ASP 30 1HB ASP 30 11.892 -10.141 -2.896
247 H VAL 31 H VAL 31 12.698 -7.820 -3.206
248 HA VAL 31 HA VAL 31 14.567 -8.637 -5.045
249 HB VAL 31 HB VAL 31 13.836 -5.744 -4.653
250 HG11 VAL 31 1HG1 VAL 31 14.836 -7.427 -6.888
251 HG12 VAL 31 2HG1 VAL 31 15.321 -5.806 -6.391
252 HG13 VAL 31 3HG1 VAL 31 13.801 -6.048 -7.257
253 HG21 VAL 31 3HG2 VAL 31 11.694 -6.452 -4.709
254 HG22 VAL 31 1HG2 VAL 31 12.125 -8.033 -5.363
255 HG23 VAL 31 2HG2 VAL 31 12.004 -6.637 -6.434
256 H VAL 32 H VAL 32 14.958 -6.342 -2.393
257 HA VAL 32 HA VAL 32 17.633 -5.620 -3.077
258 HB VAL 32 HB VAL 32 16.295 -5.361 -0.382
259 HG11 VAL 32 1HG1 VAL 32 18.611 -3.884 -1.630
260 HG12 VAL 32 2HG1 VAL 32 18.699 -5.043 -0.305
261 HG13 VAL 32 3HG1 VAL 32 17.875 -3.501 -0.072
262 HG21 VAL 32 3HG2 VAL 32 16.428 -3.009 -2.138
263 HG22 VAL 32 1HG2 VAL 32 15.135 -3.560 -1.072
264 HG23 VAL 32 2HG2 VAL 32 15.323 -4.277 -2.672
265 H SER 33 H SER 33 16.154 -8.039 -1.021
266 HA SER 33 HA SER 33 18.562 -8.838 0.280
267 HG SER 33 HG SER 33 18.123 -11.235 1.130
268 HB2 SER 33 2HB SER 33 16.113 -9.245 1.023
269 HB3 SER 33 1HB SER 33 16.162 -10.623 -0.076
270 H PHE 34 H PHE 34 16.973 -9.664 -2.705
271 HA PHE 34 HA PHE 34 18.324 -12.097 -3.214
272 HD1 PHE 34 2HD PHE 34 19.011 -12.817 -5.878
273 HD2 PHE 34 1HD PHE 34 14.884 -12.475 -4.897
274 HE1 PHE 34 2HE PHE 34 18.611 -15.065 -6.791
275 HE2 PHE 34 1HE PHE 34 14.476 -14.723 -5.810
276 HZ PHE 34 HZ PHE 34 16.341 -16.021 -6.760
277 HB2 PHE 34 2HB PHE 34 16.276 -10.733 -4.417
278 HB3 PHE 34 1HB PHE 34 17.584 -10.496 -5.569
279 H PHE 35 H PHE 35 19.127 -8.732 -3.753
280 HA PHE 35 HA PHE 35 21.499 -9.441 -5.291
281 HD1 PHE 35 1HD PHE 35 23.558 -7.406 -5.383
282 HD2 PHE 35 2HD PHE 35 20.034 -6.872 -7.708
283 HE1 PHE 35 1HE PHE 35 24.940 -7.021 -7.382
284 HE2 PHE 35 2HE PHE 35 21.409 -6.486 -9.712
285 HZ PHE 35 HZ PHE 35 23.865 -6.561 -9.550
286 HB2 PHE 35 2HB PHE 35 19.826 -7.312 -5.478
287 HB3 PHE 35 1HB PHE 35 21.096 -6.631 -4.469
288 H ARG 36 H ARG 36 20.661 -7.870 -2.221
289 HA ARG 36 HA ARG 36 21.844 -7.530 -0.308
290 HE ARG 36 HE ARG 36 23.999 -10.967 3.213
291 HB2 ARG 36 2HB ARG 36 22.108 -9.971 -0.400
292 HB3 ARG 36 1HB ARG 36 23.548 -9.780 -1.388
293 HG2 ARG 36 2HG ARG 36 24.655 -9.913 0.543
294 HG3 ARG 36 1HG ARG 36 24.155 -8.238 0.775
295 HD2 ARG 36 2HD ARG 36 22.390 -8.840 2.184
296 HD3 ARG 36 1HD ARG 36 22.406 -10.515 1.640
297 HH11 ARG 36 1HH1 ARG 36 23.860 -7.512 2.729
298 HH12 ARG 36 2HH1 ARG 36 24.943 -7.160 4.034
299 HH21 ARG 36 1HH2 ARG 36 25.423 -10.505 4.931
300 HH22 ARG 36 2HH2 ARG 36 25.829 -8.858 5.285
301 HA PRO 37 HA PRO 37 24.878 -4.789 -2.379
302 HB2 PRO 37 2HB PRO 37 24.576 -2.748 -0.604
303 HB3 PRO 37 1HB PRO 37 23.507 -2.991 -1.989
304 HG2 PRO 37 2HG PRO 37 23.097 -3.750 0.877
305 HG3 PRO 37 1HG PRO 37 21.949 -3.026 -0.266
306 HD2 PRO 37 2HD PRO 37 21.927 -5.662 0.330
307 HD3 PRO 37 1HD PRO 37 21.487 -5.049 -1.278
308 H LYS 38 H LYS 38 26.825 -5.687 -1.940
309 HA LYS 38 HA LYS 38 27.785 -6.372 0.610
310 HB2 LYS 38 2HB LYS 38 28.643 -6.696 -2.013
311 HB3 LYS 38 1HB LYS 38 29.894 -5.698 -1.283
312 HG2 LYS 38 2HG LYS 38 30.744 -7.431 -0.198
313 HG3 LYS 38 1HG LYS 38 29.169 -7.862 0.471
314 HD2 LYS 38 2HD LYS 38 28.775 -9.425 -1.120
315 HD3 LYS 38 1HD LYS 38 29.580 -8.493 -2.382
316 HE2 LYS 38 2HE LYS 38 31.588 -9.450 -1.994
317 HE3 LYS 38 1HE LYS 38 31.327 -9.537 -0.253
318 HZ1 LYS 38 3HZ LYS 38 30.690 -11.480 -2.325
319 HZ2 LYS 38 1HZ LYS 38 29.561 -11.327 -1.073
320 HZ3 LYS 38 2HZ LYS 38 31.169 -11.725 -0.721
321 H LYS 39 H LYS 39 28.513 -3.554 -1.440
322 HA LYS 39 HA LYS 39 29.313 -1.481 -0.950
323 HB2 LYS 39 2HB LYS 39 27.329 -1.634 0.658
324 HB3 LYS 39 1HB LYS 39 28.513 -1.981 1.912
325 HG2 LYS 39 2HG LYS 39 29.348 0.144 1.909
326 HG3 LYS 39 1HG LYS 39 28.917 0.428 0.220
327 HD2 LYS 39 2HD LYS 39 26.819 1.113 0.733
328 HD3 LYS 39 1HD LYS 39 26.672 -0.005 2.091
329 HE2 LYS 39 2HE LYS 39 26.736 2.048 3.153
330 HE3 LYS 39 1HE LYS 39 28.421 1.535 3.224
331 HZ1 LYS 39 3HZ LYS 39 28.404 2.851 0.914
332 HZ2 LYS 39 1HZ LYS 39 28.761 3.585 2.397
333 HZ3 LYS 39 2HZ LYS 39 27.208 3.717 1.741
334 H LYS 40 H LYS 40 31.049 -3.814 -0.718
335 HA LYS 40 HA LYS 40 33.187 -2.547 0.804
336 HB2 LYS 40 2HB LYS 40 31.862 -5.043 1.559
337 HB3 LYS 40 1HB LYS 40 33.605 -5.211 1.397
338 HG2 LYS 40 2HG LYS 40 33.751 -4.449 3.473
339 HG3 LYS 40 1HG LYS 40 33.306 -2.868 2.829
340 HD2 LYS 40 2HD LYS 40 30.867 -3.786 3.089
341 HD3 LYS 40 1HD LYS 40 31.621 -4.889 4.241
342 HE2 LYS 40 2HE LYS 40 31.743 -1.877 4.324
343 HE3 LYS 40 1HE LYS 40 30.756 -2.904 5.362
344 HZ1 LYS 40 3HZ LYS 40 33.034 -3.970 5.936
345 HZ2 LYS 40 1HZ LYS 40 32.579 -2.517 6.673
346 HZ3 LYS 40 2HZ LYS 40 33.667 -2.505 5.378
347 H LYS 41 H LYS 41 32.867 -5.779 -0.600
348 HA LYS 41 HA LYS 41 35.031 -5.086 -2.475
349 HB2 LYS 41 2HB LYS 41 35.128 -7.019 -0.604
350 HB3 LYS 41 1HB LYS 41 34.415 -7.935 -1.925
351 HG2 LYS 41 2HG LYS 41 36.801 -8.206 -1.960
352 HG3 LYS 41 1HG LYS 41 36.299 -7.264 -3.367
353 HD2 LYS 41 2HD LYS 41 37.021 -5.224 -2.343
354 HD3 LYS 41 1HD LYS 41 37.317 -6.040 -0.807
355 HE2 LYS 41 2HE LYS 41 38.748 -7.181 -3.102
356 HE3 LYS 41 1HE LYS 41 39.214 -5.532 -2.690
357 HZ1 LYS 41 3HZ LYS 41 40.034 -6.165 -0.676
358 HZ2 LYS 41 1HZ LYS 41 40.349 -7.578 -1.553
359 HZ3 LYS 41 2HZ LYS 41 39.005 -7.498 -0.528
360 H HIS 42 H HIS 42 34.982 -6.161 -4.575
361 HA HIS 42 HA HIS 42 32.272 -6.206 -5.631
362 HD1 HIS 42 1HD HIS 42 31.553 -4.726 -7.784
363 HD2 HIS 42 2HD HIS 42 35.294 -3.311 -6.657
364 HE1 HIS 42 1HE HIS 42 31.408 -2.222 -7.961
365 HE2 HIS 42 2HE HIS 42 33.709 -1.394 -7.359
366 HB2 HIS 42 2HB HIS 42 35.008 -5.999 -6.834
367 HB3 HIS 42 1HB HIS 42 33.654 -6.501 -7.844
Start of MODEL 18
1 H1 GLY 1 1H GLY 1 -19.739 3.706 -11.392
2 H2 GLY 1 2H GLY 1 -18.712 4.183 -10.136
3 H3 GLY 1 3H GLY 1 -18.160 4.211 -11.735
4 HA2 GLY 1 1HA GLY 1 -18.630 6.402 -11.531
5 HA3 GLY 1 2HA GLY 1 -20.201 5.813 -12.052
6 H LYS 2 H LYS 2 -20.697 4.469 -9.477
7 HA LYS 2 HA LYS 2 -22.025 6.587 -8.166
8 HB2 LYS 2 2HB LYS 2 -21.475 3.719 -7.470
9 HB3 LYS 2 1HB LYS 2 -22.228 4.791 -6.296
10 HG2 LYS 2 2HG LYS 2 -23.918 3.547 -7.478
11 HG3 LYS 2 1HG LYS 2 -24.029 5.256 -7.905
12 HD2 LYS 2 2HD LYS 2 -23.098 4.900 -10.028
13 HD3 LYS 2 1HD LYS 2 -22.464 3.316 -9.578
14 HE2 LYS 2 2HE LYS 2 -25.374 3.572 -9.332
15 HE3 LYS 2 1HE LYS 2 -24.765 3.747 -10.978
16 HZ1 LYS 2 3HZ LYS 2 -23.853 1.503 -9.302
17 HZ2 LYS 2 1HZ LYS 2 -23.929 1.614 -10.989
18 HZ3 LYS 2 2HZ LYS 2 -25.348 1.416 -10.090
19 H ILE 3 H ILE 3 -20.935 8.188 -7.208
20 HA ILE 3 HA ILE 3 -18.360 7.977 -6.110
21 HB ILE 3 HB ILE 3 -20.231 10.075 -5.107
22 HG12 ILE 3 2HG1 ILE 3 -19.275 11.177 -7.437
23 HG13 ILE 3 1HG1 ILE 3 -19.647 9.531 -7.938
24 HG21 ILE 3 1HG2 ILE 3 -18.118 10.430 -4.297
25 HG22 ILE 3 2HG2 ILE 3 -18.082 11.405 -5.767
26 HG23 ILE 3 3HG2 ILE 3 -17.341 9.806 -5.749
27 HD11 ILE 3 3HD1 ILE 3 -21.857 9.861 -7.804
28 HD12 ILE 3 1HD1 ILE 3 -21.415 11.565 -7.925
29 HD13 ILE 3 2HD1 ILE 3 -21.729 10.845 -6.344
30 HA PRO 4 HA PRO 4 -20.685 7.859 -1.806
31 HB2 PRO 4 2HB PRO 4 -23.212 6.551 -2.586
32 HB3 PRO 4 1HB PRO 4 -22.943 7.910 -1.493
33 HG2 PRO 4 2HG PRO 4 -24.038 8.267 -3.908
34 HG3 PRO 4 1HG PRO 4 -22.928 9.461 -3.210
35 HD2 PRO 4 2HD PRO 4 -22.406 7.376 -5.296
36 HD3 PRO 4 1HD PRO 4 -21.845 9.059 -5.221
37 H VAL 5 H VAL 5 -21.989 5.305 -3.903
38 HA VAL 5 HA VAL 5 -21.579 3.173 -2.186
39 HB VAL 5 HB VAL 5 -21.414 3.012 -5.191
40 HG11 VAL 5 1HG1 VAL 5 -22.771 0.845 -4.425
41 HG12 VAL 5 2HG1 VAL 5 -21.790 1.097 -2.981
42 HG13 VAL 5 3HG1 VAL 5 -21.012 0.884 -4.548
43 HG21 VAL 5 3HG2 VAL 5 -23.544 3.627 -5.377
44 HG22 VAL 5 1HG2 VAL 5 -23.526 4.081 -3.675
45 HG23 VAL 5 2HG2 VAL 5 -24.032 2.459 -4.151
46 H LYS 6 H LYS 6 -19.334 4.844 -4.258
47 HA LYS 6 HA LYS 6 -17.342 2.907 -4.515
48 HB2 LYS 6 2HB LYS 6 -17.424 5.104 -5.715
49 HB3 LYS 6 1HB LYS 6 -16.909 5.883 -4.225
50 HG2 LYS 6 2HG LYS 6 -14.927 5.666 -5.375
51 HG3 LYS 6 1HG LYS 6 -14.914 4.235 -4.343
52 HD2 LYS 6 2HD LYS 6 -16.212 3.283 -6.525
53 HD3 LYS 6 1HD LYS 6 -15.125 4.457 -7.268
54 HE2 LYS 6 2HE LYS 6 -13.920 2.710 -5.226
55 HE3 LYS 6 1HE LYS 6 -14.442 1.905 -6.706
56 HZ1 LYS 6 3HZ LYS 6 -13.169 4.033 -7.695
57 HZ2 LYS 6 1HZ LYS 6 -12.424 2.536 -7.422
58 HZ3 LYS 6 2HZ LYS 6 -12.271 3.778 -6.284
59 H ALA 7 H ALA 7 -18.024 5.164 -1.908
60 HA ALA 7 HA ALA 7 -15.694 4.816 -0.403
61 HB1 ALA 7 3HB ALA 7 -17.518 6.530 -0.045
62 HB2 ALA 7 1HB ALA 7 -16.862 5.783 1.412
63 HB3 ALA 7 2HB ALA 7 -18.425 5.261 0.779
64 H ILE 8 H ILE 8 -18.823 3.137 -0.141
65 HA ILE 8 HA ILE 8 -18.020 1.335 1.873
66 HB ILE 8 HB ILE 8 -20.138 0.767 -0.188
67 HG12 ILE 8 2HG1 ILE 8 -21.146 1.970 2.245
68 HG13 ILE 8 1HG1 ILE 8 -20.017 3.053 1.442
69 HG21 ILE 8 1HG2 ILE 8 -21.214 -0.376 1.744
70 HG22 ILE 8 2HG2 ILE 8 -19.755 -0.056 2.683
71 HG23 ILE 8 3HG2 ILE 8 -19.674 -1.085 1.254
72 HD11 ILE 8 3HD1 ILE 8 -21.691 2.020 -0.561
73 HD12 ILE 8 1HD1 ILE 8 -21.642 3.663 0.080
74 HD13 ILE 8 2HD1 ILE 8 -22.730 2.470 0.791
75 H LYS 9 H LYS 9 -18.156 1.049 -1.649
76 HA LYS 9 HA LYS 9 -17.366 -1.636 -1.831
77 HB2 LYS 9 2HB LYS 9 -18.201 0.196 -3.623
78 HB3 LYS 9 1HB LYS 9 -16.477 0.208 -3.975
79 HG2 LYS 9 2HG LYS 9 -17.055 -1.446 -5.386
80 HG3 LYS 9 1HG LYS 9 -16.899 -2.437 -3.934
81 HD2 LYS 9 2HD LYS 9 -19.447 -1.672 -3.657
82 HD3 LYS 9 1HD LYS 9 -19.322 -1.598 -5.415
83 HE2 LYS 9 2HE LYS 9 -19.148 -3.839 -5.629
84 HE3 LYS 9 1HE LYS 9 -18.187 -4.007 -4.160
85 HZ1 LYS 9 3HZ LYS 9 -21.094 -3.435 -4.112
86 HZ2 LYS 9 1HZ LYS 9 -20.115 -3.952 -2.832
87 HZ3 LYS 9 2HZ LYS 9 -20.475 -5.009 -4.103
88 H GLN 10 H GLN 10 -15.523 1.329 -1.516
89 HA GLN 10 HA GLN 10 -12.985 0.242 -2.141
90 HB2 GLN 10 2HB GLN 10 -13.991 2.726 -0.855
91 HB3 GLN 10 1HB GLN 10 -12.317 2.287 -0.545
92 HG2 GLN 10 2HG GLN 10 -12.517 1.973 -3.256
93 HG3 GLN 10 1HG GLN 10 -13.564 3.358 -2.949
94 HE21 GLN 10 1HE2 GLN 10 -11.444 3.848 -4.438
95 HE22 GLN 10 2HE2 GLN 10 -10.220 4.697 -3.561
96 H ALA 11 H ALA 11 -14.804 0.556 0.855
97 HA ALA 11 HA ALA 11 -12.762 -0.205 2.632
98 HB1 ALA 11 3HB ALA 11 -14.927 0.854 3.273
99 HB2 ALA 11 1HB ALA 11 -14.491 -0.549 4.251
100 HB3 ALA 11 2HB ALA 11 -15.714 -0.698 2.987
101 H GLY 12 H GLY 12 -15.087 -2.078 0.767
102 HA2 GLY 12 2HA GLY 12 -14.475 -4.586 1.975
103 HA3 GLY 12 1HA GLY 12 -15.325 -4.347 0.457
104 H LYS 13 H LYS 13 -13.042 -2.737 -0.597
105 HA LYS 13 HA LYS 13 -11.583 -4.939 -1.725
106 HB2 LYS 13 2HB LYS 13 -11.895 -2.066 -2.250
107 HB3 LYS 13 1HB LYS 13 -10.279 -2.674 -2.571
108 HG2 LYS 13 2HG LYS 13 -11.115 -3.168 -4.587
109 HG3 LYS 13 1HG LYS 13 -11.791 -4.579 -3.770
110 HD2 LYS 13 2HD LYS 13 -13.851 -3.253 -3.325
111 HD3 LYS 13 1HD LYS 13 -13.171 -1.949 -4.300
112 HE2 LYS 13 2HE LYS 13 -13.162 -4.588 -5.587
113 HE3 LYS 13 1HE LYS 13 -14.764 -3.936 -5.255
114 HZ1 LYS 13 3HZ LYS 13 -12.688 -2.315 -6.596
115 HZ2 LYS 13 1HZ LYS 13 -14.364 -2.081 -6.582
116 HZ3 LYS 13 2HZ LYS 13 -13.693 -3.356 -7.469
117 H VAL 14 H VAL 14 -10.908 -2.331 0.554
118 HA VAL 14 HA VAL 14 -8.151 -2.626 0.774
119 HB VAL 14 HB VAL 14 -9.933 -1.929 3.099
120 HG11 VAL 14 1HG1 VAL 14 -8.088 -0.519 3.752
121 HG12 VAL 14 2HG1 VAL 14 -7.221 -0.924 2.271
122 HG13 VAL 14 3HG1 VAL 14 -7.515 -2.165 3.488
123 HG21 VAL 14 3HG2 VAL 14 -9.738 -0.589 0.538
124 HG22 VAL 14 1HG2 VAL 14 -9.223 0.456 1.860
125 HG23 VAL 14 2HG2 VAL 14 -10.826 -0.280 1.890
126 H ILE 15 H ILE 15 -10.771 -4.473 2.180
127 HA ILE 15 HA ILE 15 -9.332 -5.799 4.197
128 HB ILE 15 HB ILE 15 -11.681 -6.875 2.631
129 HG12 ILE 15 2HG1 ILE 15 -11.842 -5.487 5.293
130 HG13 ILE 15 1HG1 ILE 15 -11.883 -4.564 3.796
131 HG21 ILE 15 1HG2 ILE 15 -11.118 -8.712 3.816
132 HG22 ILE 15 2HG2 ILE 15 -11.961 -7.865 5.115
133 HG23 ILE 15 3HG2 ILE 15 -10.202 -7.791 5.012
134 HD11 ILE 15 3HD1 ILE 15 -14.090 -4.855 3.948
135 HD12 ILE 15 1HD1 ILE 15 -13.934 -6.234 5.037
136 HD13 ILE 15 2HD1 ILE 15 -13.754 -6.460 3.298
137 H GLY 16 H GLY 16 -9.961 -6.673 0.810
138 HA2 GLY 16 2HA GLY 16 -8.392 -9.090 1.019
139 HA3 GLY 16 1HA GLY 16 -9.139 -8.452 -0.436
140 H LYS 17 H LYS 17 -8.004 -5.898 -0.472
141 HA LYS 17 HA LYS 17 -5.571 -6.383 -1.766
142 HB2 LYS 17 2HB LYS 17 -7.247 -4.133 -1.231
143 HB3 LYS 17 1HB LYS 17 -5.593 -3.691 -0.822
144 HG2 LYS 17 2HG LYS 17 -4.875 -3.830 -2.975
145 HG3 LYS 17 1HG LYS 17 -6.054 -5.071 -3.408
146 HD2 LYS 17 2HD LYS 17 -7.830 -3.294 -3.206
147 HD3 LYS 17 1HD LYS 17 -6.525 -2.114 -3.067
148 HE2 LYS 17 2HE LYS 17 -6.021 -2.227 -5.258
149 HE3 LYS 17 1HE LYS 17 -6.281 -3.968 -5.333
150 HZ1 LYS 17 3HZ LYS 17 -7.871 -2.456 -6.610
151 HZ2 LYS 17 1HZ LYS 17 -8.557 -2.105 -5.103
152 HZ3 LYS 17 2HZ LYS 17 -8.544 -3.696 -5.674
153 H GLY 18 H GLY 18 -6.318 -5.619 1.567
154 HA2 GLY 18 2HA GLY 18 -3.693 -4.944 2.392
155 HA3 GLY 18 1HA GLY 18 -4.996 -5.483 3.441
156 H LEU 19 H LEU 19 -5.390 -8.000 2.046
157 HA LEU 19 HA LEU 19 -3.430 -9.542 3.441
158 HG LEU 19 HG LEU 19 -4.733 -10.961 4.474
159 HB2 LEU 19 2HB LEU 19 -5.877 -10.066 1.879
160 HB3 LEU 19 1HB LEU 19 -4.679 -11.346 1.829
161 HD11 LEU 19 1HD1 LEU 19 -6.669 -10.144 5.340
162 HD12 LEU 19 2HD1 LEU 19 -7.627 -10.605 3.932
163 HD13 LEU 19 3HD1 LEU 19 -6.599 -9.172 3.869
164 HD21 LEU 19 3HD2 LEU 19 -6.280 -12.689 2.631
165 HD22 LEU 19 1HD2 LEU 19 -6.766 -12.679 4.327
166 HD23 LEU 19 2HD2 LEU 19 -5.116 -13.117 3.885
167 H ARG 20 H ARG 20 -4.197 -9.107 -0.011
168 HA ARG 20 HA ARG 20 -1.953 -10.609 -0.907
169 HE ARG 20 HE ARG 20 -4.566 -7.817 -4.900
170 HB2 ARG 20 2HB ARG 20 -2.460 -9.560 -3.127
171 HB3 ARG 20 1HB ARG 20 -3.820 -10.391 -2.385
172 HG2 ARG 20 2HG ARG 20 -4.178 -7.860 -1.464
173 HG3 ARG 20 1HG ARG 20 -3.470 -7.561 -3.051
174 HD2 ARG 20 2HD ARG 20 -5.501 -9.638 -3.119
175 HD3 ARG 20 1HD ARG 20 -6.128 -8.105 -2.516
176 HH11 ARG 20 1HH1 ARG 20 -7.739 -8.575 -3.661
177 HH12 ARG 20 2HH1 ARG 20 -8.556 -8.102 -5.113
178 HH21 ARG 20 1HH2 ARG 20 -5.639 -7.196 -6.810
179 HH22 ARG 20 2HH2 ARG 20 -7.363 -7.320 -6.902
180 H ALA 21 H ALA 21 -2.262 -7.484 0.376
181 HA ALA 21 HA ALA 21 -0.002 -6.347 -1.016
182 HB1 ALA 21 3HB ALA 21 -1.728 -5.362 1.242
183 HB2 ALA 21 1HB ALA 21 -1.698 -4.802 -0.431
184 HB3 ALA 21 2HB ALA 21 -0.335 -4.468 0.637
185 H ILE 22 H ILE 22 -0.703 -7.721 2.156
186 HA ILE 22 HA ILE 22 1.840 -7.123 3.288
187 HB ILE 22 HB ILE 22 -0.148 -9.252 4.100
188 HG12 ILE 22 2HG1 ILE 22 0.208 -6.708 5.605
189 HG13 ILE 22 1HG1 ILE 22 -0.671 -6.631 4.081
190 HG21 ILE 22 1HG2 ILE 22 1.395 -8.273 6.278
191 HG22 ILE 22 2HG2 ILE 22 2.500 -8.758 4.992
192 HG23 ILE 22 3HG2 ILE 22 1.324 -9.910 5.627
193 HD11 ILE 22 3HD1 ILE 22 -2.411 -7.022 5.466
194 HD12 ILE 22 1HD1 ILE 22 -1.424 -7.881 6.647
195 HD13 ILE 22 2HD1 ILE 22 -1.940 -8.695 5.170
196 H ASN 23 H ASN 23 0.584 -9.736 1.346
197 HA ASN 23 HA ASN 23 2.712 -11.569 1.856
198 HB2 ASN 23 2HB ASN 23 0.273 -11.840 0.738
199 HB3 ASN 23 1HB ASN 23 1.253 -11.738 -0.721
200 HD21 ASN 23 1HD2 ASN 23 1.485 -13.715 -1.470
201 HD22 ASN 23 2HD2 ASN 23 1.947 -15.103 -0.547
202 H ILE 24 H ILE 24 2.052 -9.162 -0.644
203 HA ILE 24 HA ILE 24 4.470 -9.787 -2.096
204 HB ILE 24 HB ILE 24 2.676 -7.392 -2.469
205 HG12 ILE 24 2HG1 ILE 24 2.509 -9.969 -4.021
206 HG13 ILE 24 1HG1 ILE 24 1.541 -9.696 -2.576
207 HG21 ILE 24 1HG2 ILE 24 4.980 -8.536 -3.907
208 HG22 ILE 24 2HG2 ILE 24 4.414 -6.868 -3.807
209 HG23 ILE 24 3HG2 ILE 24 3.631 -8.000 -4.910
210 HD11 ILE 24 3HD1 ILE 24 0.087 -9.057 -4.221
211 HD12 ILE 24 1HD1 ILE 24 1.364 -8.408 -5.251
212 HD13 ILE 24 2HD1 ILE 24 0.840 -7.511 -3.826
213 H ALA 25 H ALA 25 3.452 -7.545 0.359
214 HA ALA 25 HA ALA 25 5.341 -5.523 0.081
215 HB1 ALA 25 3HB ALA 25 3.834 -4.928 1.660
216 HB2 ALA 25 1HB ALA 25 5.069 -5.567 2.744
217 HB3 ALA 25 2HB ALA 25 3.685 -6.566 2.296
218 H GLY 26 H GLY 26 5.683 -8.764 1.323
219 HA2 GLY 26 2HA GLY 26 8.156 -8.331 2.687
220 HA3 GLY 26 1HA GLY 26 7.478 -9.889 2.232
221 H THR 27 H THR 27 7.292 -9.169 -0.605
222 HA THR 27 HA THR 27 9.930 -9.973 -1.368
223 HB THR 27 HB THR 27 7.914 -9.002 -3.354
224 HG1 THR 27 1HG THR 27 7.709 -11.365 -1.807
225 HG21 THR 27 3HG2 THR 27 8.684 -10.768 -4.713
226 HG22 THR 27 1HG2 THR 27 9.547 -11.520 -3.371
227 HG23 THR 27 2HG2 THR 27 10.116 -9.988 -4.038
228 H THR 28 H THR 28 7.972 -7.063 -2.000
229 HA THR 28 HA THR 28 9.878 -5.628 -3.431
230 HB THR 28 HB THR 28 7.605 -4.859 -3.350
231 HG1 THR 28 1HG THR 28 8.481 -2.981 -3.602
232 HG21 THR 28 3HG2 THR 28 6.679 -3.790 -1.310
233 HG22 THR 28 1HG2 THR 28 8.027 -4.475 -0.401
234 HG23 THR 28 2HG2 THR 28 6.865 -5.540 -1.192
235 H HIS 29 H HIS 29 9.495 -6.091 0.016
236 HA HIS 29 HA HIS 29 11.184 -4.058 0.942
237 HD1 HIS 29 1HD HIS 29 12.725 -3.897 2.896
238 HD2 HIS 29 2HD HIS 29 9.115 -4.982 4.644
239 HE1 HIS 29 1HE HIS 29 12.546 -2.508 4.986
240 HE2 HIS 29 2HE HIS 29 10.393 -3.243 6.069
241 HB2 HIS 29 2HB HIS 29 9.643 -5.948 2.138
242 HB3 HIS 29 1HB HIS 29 11.248 -6.608 2.435
243 H ASP 30 H ASP 30 11.867 -7.200 -0.420
244 HA ASP 30 HA ASP 30 14.619 -7.250 0.390
245 HB2 ASP 30 2HB ASP 30 12.808 -9.103 -0.638
246 HB3 ASP 30 1HB ASP 30 13.996 -8.902 -1.921
247 H VAL 31 H VAL 31 13.006 -6.840 -2.764
248 HA VAL 31 HA VAL 31 15.238 -6.266 -4.284
249 HB VAL 31 HB VAL 31 12.566 -4.950 -4.729
250 HG11 VAL 31 1HG1 VAL 31 14.946 -5.610 -6.376
251 HG12 VAL 31 2HG1 VAL 31 13.938 -4.163 -6.373
252 HG13 VAL 31 3HG1 VAL 31 13.359 -5.640 -7.141
253 HG21 VAL 31 3HG2 VAL 31 11.876 -7.141 -4.401
254 HG22 VAL 31 1HG2 VAL 31 13.365 -7.818 -5.065
255 HG23 VAL 31 2HG2 VAL 31 12.170 -7.091 -6.139
256 H VAL 32 H VAL 32 13.102 -4.008 -2.579
257 HA VAL 32 HA VAL 32 14.383 -1.641 -3.348
258 HB VAL 32 HB VAL 32 12.958 -2.142 -0.730
259 HG11 VAL 32 1HG1 VAL 32 12.598 0.210 -0.637
260 HG12 VAL 32 2HG1 VAL 32 13.256 0.437 -2.257
261 HG13 VAL 32 3HG1 VAL 32 14.318 -0.043 -0.932
262 HG21 VAL 32 3HG2 VAL 32 11.534 -0.837 -2.953
263 HG22 VAL 32 1HG2 VAL 32 10.957 -2.004 -1.761
264 HG23 VAL 32 2HG2 VAL 32 11.866 -2.556 -3.168
265 H SER 33 H SER 33 15.143 -3.975 -0.858
266 HA SER 33 HA SER 33 16.935 -2.378 0.633
267 HG SER 33 HG SER 33 17.698 -3.567 2.438
268 HB2 SER 33 2HB SER 33 15.891 -4.590 1.344
269 HB3 SER 33 1HB SER 33 17.104 -5.379 0.337
270 H PHE 34 H PHE 34 17.385 -4.592 -2.080
271 HA PHE 34 HA PHE 34 20.229 -4.253 -2.162
272 HD1 PHE 34 1HD PHE 34 21.161 -6.104 -1.873
273 HD2 PHE 34 2HD PHE 34 17.624 -7.610 -3.693
274 HE1 PHE 34 1HE PHE 34 21.407 -8.199 -0.604
275 HE2 PHE 34 2HE PHE 34 17.859 -9.706 -2.428
276 HZ PHE 34 HZ PHE 34 19.752 -10.002 -0.881
277 HB2 PHE 34 2HB PHE 34 18.263 -5.448 -4.121
278 HB3 PHE 34 1HB PHE 34 20.002 -5.414 -4.397
279 H PHE 35 H PHE 35 17.459 -2.815 -3.756
280 HA PHE 35 HA PHE 35 19.253 -1.039 -5.266
281 HD1 PHE 35 2HD PHE 35 19.135 -0.165 -7.599
282 HD2 PHE 35 1HD PHE 35 17.008 -3.838 -7.283
283 HE1 PHE 35 2HE PHE 35 20.265 -0.991 -9.625
284 HE2 PHE 35 1HE PHE 35 18.135 -4.670 -9.306
285 HZ PHE 35 HZ PHE 35 19.764 -3.244 -10.480
286 HB2 PHE 35 2HB PHE 35 16.558 -2.166 -5.786
287 HB3 PHE 35 1HB PHE 35 16.823 -0.506 -6.316
288 H ARG 36 H ARG 36 19.083 -0.486 -2.613
289 HA ARG 36 HA ARG 36 17.059 1.133 -1.677
290 HE ARG 36 HE ARG 36 22.712 2.478 -1.914
291 HB2 ARG 36 2HB ARG 36 18.719 2.101 -0.156
292 HB3 ARG 36 1HB ARG 36 18.901 0.356 -0.276
293 HG2 ARG 36 2HG ARG 36 21.051 0.703 -0.677
294 HG3 ARG 36 1HG ARG 36 20.581 1.363 -2.245
295 HD2 ARG 36 2HD ARG 36 20.364 3.593 -1.185
296 HD3 ARG 36 1HD ARG 36 20.956 2.900 0.324
297 HH11 ARG 36 1HH1 ARG 36 21.819 4.669 0.653
298 HH12 ARG 36 2HH1 ARG 36 23.362 5.455 0.687
299 HH21 ARG 36 1HH2 ARG 36 24.740 3.512 -1.870
300 HH22 ARG 36 2HH2 ARG 36 25.019 4.800 -0.745
301 HA PRO 37 HA PRO 37 17.244 4.680 -4.364
302 HB2 PRO 37 2HB PRO 37 15.727 6.364 -2.855
303 HB3 PRO 37 1HB PRO 37 15.044 5.064 -3.835
304 HG2 PRO 37 2HG PRO 37 15.624 5.118 -0.899
305 HG3 PRO 37 1HG PRO 37 14.196 4.491 -1.746
306 HD2 PRO 37 2HD PRO 37 16.158 2.870 -0.850
307 HD3 PRO 37 1HD PRO 37 15.257 2.526 -2.340
308 H LYS 38 H LYS 38 18.648 6.324 -4.573
309 HA LYS 38 HA LYS 38 20.191 7.110 -2.215
310 HB2 LYS 38 2HB LYS 38 21.030 6.379 -4.691
311 HB3 LYS 38 1HB LYS 38 20.988 8.126 -4.871
312 HG2 LYS 38 2HG LYS 38 22.256 7.317 -2.393
313 HG3 LYS 38 1HG LYS 38 23.049 6.627 -3.809
314 HD2 LYS 38 2HD LYS 38 23.314 8.826 -4.780
315 HD3 LYS 38 1HD LYS 38 22.399 9.554 -3.458
316 HE2 LYS 38 2HE LYS 38 24.189 9.616 -2.126
317 HE3 LYS 38 1HE LYS 38 24.629 7.952 -2.508
318 HZ1 LYS 38 3HZ LYS 38 25.761 8.676 -4.459
319 HZ2 LYS 38 1HZ LYS 38 26.309 9.625 -3.170
320 HZ3 LYS 38 2HZ LYS 38 25.204 10.263 -4.278
321 H LYS 39 H LYS 39 18.726 8.667 -5.070
322 HA LYS 39 HA LYS 39 18.880 11.278 -3.906
323 HB2 LYS 39 2HB LYS 39 17.831 10.108 -6.428
324 HB3 LYS 39 1HB LYS 39 17.152 11.648 -5.921
325 HG2 LYS 39 2HG LYS 39 18.912 12.224 -7.332
326 HG3 LYS 39 1HG LYS 39 19.566 12.445 -5.709
327 HD2 LYS 39 2HD LYS 39 21.269 11.162 -6.379
328 HD3 LYS 39 1HD LYS 39 20.144 9.808 -6.266
329 HE2 LYS 39 2HE LYS 39 19.494 10.636 -8.700
330 HE3 LYS 39 1HE LYS 39 21.141 11.261 -8.655
331 HZ1 LYS 39 3HZ LYS 39 21.509 8.785 -7.742
332 HZ2 LYS 39 1HZ LYS 39 21.634 9.207 -9.375
333 HZ3 LYS 39 2HZ LYS 39 20.204 8.522 -8.786
334 H LYS 40 H LYS 40 17.181 12.582 -3.174
335 HA LYS 40 HA LYS 40 14.567 11.356 -2.773
336 HB2 LYS 40 2HB LYS 40 16.160 12.469 -0.457
337 HB3 LYS 40 1HB LYS 40 14.537 11.793 -0.383
338 HG2 LYS 40 2HG LYS 40 15.369 9.606 -0.928
339 HG3 LYS 40 1HG LYS 40 16.993 10.248 -1.186
340 HD2 LYS 40 2HD LYS 40 17.356 9.679 0.952
341 HD3 LYS 40 1HD LYS 40 16.418 11.119 1.346
342 HE2 LYS 40 2HE LYS 40 15.373 9.476 2.600
343 HE3 LYS 40 1HE LYS 40 14.372 9.549 1.148
344 HZ1 LYS 40 3HZ LYS 40 16.590 7.674 1.073
345 HZ2 LYS 40 1HZ LYS 40 15.005 7.502 0.504
346 HZ3 LYS 40 2HZ LYS 40 15.344 7.289 2.149
347 H LYS 41 H LYS 41 12.929 12.888 -2.108
348 HA LYS 41 HA LYS 41 13.616 15.634 -2.914
349 HB2 LYS 41 2HB LYS 41 11.231 13.914 -3.345
350 HB3 LYS 41 1HB LYS 41 10.939 15.630 -3.099
351 HG2 LYS 41 2HG LYS 41 12.932 15.722 -4.923
352 HG3 LYS 41 1HG LYS 41 12.126 14.221 -5.386
353 HD2 LYS 41 2HD LYS 41 9.997 15.866 -5.002
354 HD3 LYS 41 1HD LYS 41 11.207 17.007 -5.592
355 HE2 LYS 41 2HE LYS 41 10.207 16.271 -7.549
356 HE3 LYS 41 1HE LYS 41 11.633 15.242 -7.432
357 HZ1 LYS 41 3HZ LYS 41 9.950 13.758 -7.915
358 HZ2 LYS 41 1HZ LYS 41 8.809 14.551 -6.948
359 HZ3 LYS 41 2HZ LYS 41 10.041 13.641 -6.230
360 H HIS 42 H HIS 42 14.357 15.496 -0.495
361 HA HIS 42 HA HIS 42 14.106 16.276 1.625
362 HD1 HIS 42 1HD HIS 42 15.369 17.596 0.813
363 HD2 HIS 42 2HD HIS 42 12.539 20.612 1.207
364 HE1 HIS 42 1HE HIS 42 16.679 19.743 0.863
365 HE2 HIS 42 2HE HIS 42 14.939 21.558 1.014
366 HB2 HIS 42 2HB HIS 42 11.997 17.718 0.100
367 HB3 HIS 42 1HB HIS 42 11.917 17.790 1.856
Start of MODEL 19
1 H1 GLY 1 1H GLY 1 -31.362 -9.636 4.477
2 H2 GLY 1 2H GLY 1 -30.680 -8.271 3.747
3 H3 GLY 1 3H GLY 1 -31.894 -8.089 4.909
4 HA2 GLY 1 1HA GLY 1 -30.405 -9.113 6.579
5 HA3 GLY 1 2HA GLY 1 -29.140 -9.097 5.358
6 H LYS 2 H LYS 2 -27.728 -7.564 5.875
7 HA LYS 2 HA LYS 2 -28.503 -5.191 7.299
8 HB2 LYS 2 2HB LYS 2 -25.966 -6.429 6.398
9 HB3 LYS 2 1HB LYS 2 -25.955 -4.680 6.573
10 HG2 LYS 2 2HG LYS 2 -25.186 -5.799 8.599
11 HG3 LYS 2 1HG LYS 2 -26.665 -4.882 8.884
12 HD2 LYS 2 2HD LYS 2 -27.147 -6.862 9.960
13 HD3 LYS 2 1HD LYS 2 -27.830 -7.165 8.362
14 HE2 LYS 2 2HE LYS 2 -26.627 -9.060 8.465
15 HE3 LYS 2 1HE LYS 2 -25.283 -8.015 8.003
16 HZ1 LYS 2 3HZ LYS 2 -25.025 -7.684 10.521
17 HZ2 LYS 2 1HZ LYS 2 -24.484 -9.136 9.841
18 HZ3 LYS 2 2HZ LYS 2 -25.959 -9.086 10.665
19 H ILE 3 H ILE 3 -28.796 -3.166 6.528
20 HA ILE 3 HA ILE 3 -29.279 -2.832 3.741
21 HB ILE 3 HB ILE 3 -29.073 -0.451 5.515
22 HG12 ILE 3 2HG1 ILE 3 -31.642 -1.259 5.992
23 HG13 ILE 3 1HG1 ILE 3 -30.781 -2.795 6.056
24 HG21 ILE 3 1HG2 ILE 3 -30.721 -1.388 3.224
25 HG22 ILE 3 2HG2 ILE 3 -29.831 0.120 3.429
26 HG23 ILE 3 3HG2 ILE 3 -31.351 -0.131 4.286
27 HD11 ILE 3 3HD1 ILE 3 -29.807 -2.299 8.008
28 HD12 ILE 3 1HD1 ILE 3 -31.101 -1.111 8.147
29 HD13 ILE 3 2HD1 ILE 3 -29.514 -0.622 7.555
30 HA PRO 4 HA PRO 4 -25.367 -0.103 3.841
31 HB2 PRO 4 2HB PRO 4 -23.897 0.139 6.054
32 HB3 PRO 4 1HB PRO 4 -25.403 1.043 5.859
33 HG2 PRO 4 2HG PRO 4 -24.872 -1.438 7.437
34 HG3 PRO 4 1HG PRO 4 -25.873 -0.036 7.853
35 HD2 PRO 4 2HD PRO 4 -26.828 -2.434 6.835
36 HD3 PRO 4 1HD PRO 4 -27.693 -0.889 6.785
37 H VAL 5 H VAL 5 -25.426 -2.815 3.213
38 HA VAL 5 HA VAL 5 -23.035 -4.086 4.189
39 HB VAL 5 HB VAL 5 -25.050 -4.869 2.082
40 HG11 VAL 5 1HG1 VAL 5 -22.650 -6.392 3.071
41 HG12 VAL 5 2HG1 VAL 5 -22.929 -5.793 1.437
42 HG13 VAL 5 3HG1 VAL 5 -23.946 -7.075 2.092
43 HG21 VAL 5 3HG2 VAL 5 -25.960 -6.319 3.655
44 HG22 VAL 5 1HG2 VAL 5 -25.585 -4.880 4.606
45 HG23 VAL 5 2HG2 VAL 5 -24.517 -6.285 4.668
46 H LYS 6 H LYS 6 -24.077 -2.310 1.353
47 HA LYS 6 HA LYS 6 -21.967 -2.977 -0.375
48 HB2 LYS 6 2HB LYS 6 -24.170 -1.670 -0.827
49 HB3 LYS 6 1HB LYS 6 -23.234 -0.256 -0.367
50 HG2 LYS 6 2HG LYS 6 -23.063 -0.322 -2.683
51 HG3 LYS 6 1HG LYS 6 -21.546 -1.028 -2.126
52 HD2 LYS 6 2HD LYS 6 -22.069 -3.099 -2.897
53 HD3 LYS 6 1HD LYS 6 -23.793 -2.899 -2.571
54 HE2 LYS 6 2HE LYS 6 -22.279 -1.621 -4.844
55 HE3 LYS 6 1HE LYS 6 -23.312 -3.041 -4.977
56 HZ1 LYS 6 3HZ LYS 6 -24.033 -0.240 -4.717
57 HZ2 LYS 6 1HZ LYS 6 -24.986 -1.325 -3.833
58 HZ3 LYS 6 2HZ LYS 6 -24.841 -1.498 -5.508
59 H ALA 7 H ALA 7 -22.237 -0.564 2.163
60 HA ALA 7 HA ALA 7 -19.946 0.936 1.593
61 HB1 ALA 7 3HB ALA 7 -20.375 2.011 3.531
62 HB2 ALA 7 1HB ALA 7 -20.567 0.514 4.445
63 HB3 ALA 7 2HB ALA 7 -21.892 1.116 3.445
64 H ILE 8 H ILE 8 -20.367 -1.992 3.538
65 HA ILE 8 HA ILE 8 -17.673 -2.145 4.413
66 HB ILE 8 HB ILE 8 -19.547 -4.484 4.133
67 HG12 ILE 8 2HG1 ILE 8 -19.433 -3.125 6.740
68 HG13 ILE 8 1HG1 ILE 8 -20.222 -2.193 5.475
69 HG21 ILE 8 1HG2 ILE 8 -18.260 -5.530 5.770
70 HG22 ILE 8 2HG2 ILE 8 -17.521 -4.015 6.293
71 HG23 ILE 8 3HG2 ILE 8 -17.067 -4.729 4.745
72 HD11 ILE 8 3HD1 ILE 8 -21.101 -4.615 6.863
73 HD12 ILE 8 1HD1 ILE 8 -21.375 -4.610 5.122
74 HD13 ILE 8 2HD1 ILE 8 -22.041 -3.320 6.122
75 H LYS 9 H LYS 9 -19.467 -3.897 1.907
76 HA LYS 9 HA LYS 9 -17.401 -5.464 0.930
77 HB2 LYS 9 2HB LYS 9 -19.946 -4.419 -0.199
78 HB3 LYS 9 1HB LYS 9 -18.779 -5.100 -1.325
79 HG2 LYS 9 2HG LYS 9 -19.586 -6.622 1.117
80 HG3 LYS 9 1HG LYS 9 -20.607 -6.619 -0.322
81 HD2 LYS 9 2HD LYS 9 -19.327 -8.406 -0.870
82 HD3 LYS 9 1HD LYS 9 -18.234 -7.151 -1.457
83 HE2 LYS 9 2HE LYS 9 -16.769 -7.422 0.274
84 HE3 LYS 9 1HE LYS 9 -18.023 -7.948 1.396
85 HZ1 LYS 9 3HZ LYS 9 -16.993 -9.592 -0.852
86 HZ2 LYS 9 1HZ LYS 9 -18.071 -10.088 0.358
87 HZ3 LYS 9 2HZ LYS 9 -16.465 -9.729 0.749
88 H GLN 10 H GLN 10 -18.463 -2.298 -0.277
89 HA GLN 10 HA GLN 10 -16.436 -2.029 -2.212
90 HB2 GLN 10 2HB GLN 10 -18.675 -0.586 -1.475
91 HB3 GLN 10 1HB GLN 10 -17.355 0.497 -1.053
92 HG2 GLN 10 2HG GLN 10 -16.518 0.451 -3.297
93 HG3 GLN 10 1HG GLN 10 -17.684 -0.790 -3.752
94 HE21 GLN 10 1HE2 GLN 10 -19.630 -0.188 -4.464
95 HE22 GLN 10 2HE2 GLN 10 -20.218 1.436 -4.491
96 H ALA 11 H ALA 11 -16.556 -1.284 1.206
97 HA ALA 11 HA ALA 11 -14.177 0.281 1.269
98 HB1 ALA 11 3HB ALA 11 -14.315 0.033 3.694
99 HB2 ALA 11 1HB ALA 11 -15.554 -1.207 3.503
100 HB3 ALA 11 2HB ALA 11 -15.886 0.454 3.013
101 H GLY 12 H GLY 12 -14.906 -3.132 1.720
102 HA2 GLY 12 2HA GLY 12 -12.324 -3.891 2.633
103 HA3 GLY 12 1HA GLY 12 -13.544 -4.969 1.970
104 H LYS 13 H LYS 13 -13.633 -3.264 -0.514
105 HA LYS 13 HA LYS 13 -11.646 -4.727 -1.967
106 HB2 LYS 13 2HB LYS 13 -14.037 -3.254 -2.563
107 HB3 LYS 13 1HB LYS 13 -12.739 -2.697 -3.611
108 HG2 LYS 13 2HG LYS 13 -13.347 -4.407 -4.913
109 HG3 LYS 13 1HG LYS 13 -12.428 -5.391 -3.771
110 HD2 LYS 13 2HD LYS 13 -14.966 -5.068 -2.625
111 HD3 LYS 13 1HD LYS 13 -15.253 -5.397 -4.334
112 HE2 LYS 13 2HE LYS 13 -14.190 -7.467 -4.239
113 HE3 LYS 13 1HE LYS 13 -13.328 -7.062 -2.756
114 HZ1 LYS 13 3HZ LYS 13 -14.930 -8.318 -1.836
115 HZ2 LYS 13 1HZ LYS 13 -16.016 -8.094 -3.113
116 HZ3 LYS 13 2HZ LYS 13 -15.850 -6.903 -1.925
117 H VAL 14 H VAL 14 -12.105 -1.341 -1.040
118 HA VAL 14 HA VAL 14 -9.987 -0.230 -2.470
119 HB VAL 14 HB VAL 14 -10.856 0.732 0.248
120 HG11 VAL 14 1HG1 VAL 14 -10.542 2.925 -1.221
121 HG12 VAL 14 2HG1 VAL 14 -9.440 1.858 -2.089
122 HG13 VAL 14 3HG1 VAL 14 -9.206 2.156 -0.366
123 HG21 VAL 14 3HG2 VAL 14 -12.951 0.732 -0.584
124 HG22 VAL 14 1HG2 VAL 14 -12.401 0.576 -2.252
125 HG23 VAL 14 2HG2 VAL 14 -12.401 2.154 -1.466
126 H ILE 15 H ILE 15 -10.066 -1.915 0.602
127 HA ILE 15 HA ILE 15 -7.485 -1.194 1.498
128 HB ILE 15 HB ILE 15 -8.993 -3.736 2.126
129 HG12 ILE 15 2HG1 ILE 15 -8.992 -1.171 3.720
130 HG13 ILE 15 1HG1 ILE 15 -10.235 -1.550 2.531
131 HG21 ILE 15 1HG2 ILE 15 -7.288 -2.523 4.173
132 HG22 ILE 15 2HG2 ILE 15 -6.414 -3.108 2.757
133 HG23 ILE 15 3HG2 ILE 15 -7.443 -4.207 3.675
134 HD11 ILE 15 3HD1 ILE 15 -9.875 -3.748 4.346
135 HD12 ILE 15 1HD1 ILE 15 -11.322 -2.805 3.990
136 HD13 ILE 15 2HD1 ILE 15 -10.191 -2.251 5.224
137 H GLY 16 H GLY 16 -8.673 -3.886 -0.471
138 HA2 GLY 16 2HA GLY 16 -6.205 -5.280 -0.597
139 HA3 GLY 16 1HA GLY 16 -7.558 -5.477 -1.699
140 H LYS 17 H LYS 17 -7.672 -2.814 -2.661
141 HA LYS 17 HA LYS 17 -5.868 -2.940 -4.787
142 HB2 LYS 17 2HB LYS 17 -8.082 -1.477 -4.277
143 HB3 LYS 17 1HB LYS 17 -6.846 -0.254 -4.021
144 HG2 LYS 17 2HG LYS 17 -6.249 -0.194 -6.209
145 HG3 LYS 17 1HG LYS 17 -6.649 -1.890 -6.481
146 HD2 LYS 17 2HD LYS 17 -8.914 -0.114 -5.828
147 HD3 LYS 17 1HD LYS 17 -8.139 0.161 -7.390
148 HE2 LYS 17 2HE LYS 17 -9.790 -1.395 -7.887
149 HE3 LYS 17 1HE LYS 17 -8.348 -2.390 -7.693
150 HZ1 LYS 17 3HZ LYS 17 -10.157 -3.406 -6.535
151 HZ2 LYS 17 1HZ LYS 17 -10.504 -1.980 -5.696
152 HZ3 LYS 17 2HZ LYS 17 -9.067 -2.814 -5.383
153 H GLY 18 H GLY 18 -5.822 -0.802 -1.952
154 HA2 GLY 18 2HA GLY 18 -3.345 0.412 -2.532
155 HA3 GLY 18 1HA GLY 18 -4.094 0.333 -0.942
156 H LEU 19 H LEU 19 -4.174 -2.595 -0.954
157 HA LEU 19 HA LEU 19 -1.662 -3.084 0.253
158 HG LEU 19 HG LEU 19 -3.263 -5.935 1.801
159 HB2 LEU 19 2HB LEU 19 -4.119 -4.301 0.288
160 HB3 LEU 19 1HB LEU 19 -3.166 -5.443 -0.639
161 HD11 LEU 19 1HD1 LEU 19 -0.825 -5.639 0.190
162 HD12 LEU 19 2HD1 LEU 19 -1.462 -7.043 1.045
163 HD13 LEU 19 3HD1 LEU 19 -0.561 -5.810 1.925
164 HD21 LEU 19 3HD2 LEU 19 -2.550 -4.508 3.401
165 HD22 LEU 19 1HD2 LEU 19 -2.972 -3.295 2.192
166 HD23 LEU 19 2HD2 LEU 19 -1.294 -3.811 2.379
167 H ARG 20 H ARG 20 -3.004 -3.797 -2.927
168 HA ARG 20 HA ARG 20 -1.027 -5.531 -3.862
169 HE ARG 20 HE ARG 20 -3.646 -8.489 -6.457
170 HB2 ARG 20 2HB ARG 20 -2.874 -3.594 -5.229
171 HB3 ARG 20 1HB ARG 20 -1.687 -4.505 -6.152
172 HG2 ARG 20 2HG ARG 20 -3.774 -5.746 -4.373
173 HG3 ARG 20 1HG ARG 20 -3.937 -5.533 -6.117
174 HD2 ARG 20 2HD ARG 20 -1.456 -6.771 -5.735
175 HD3 ARG 20 1HD ARG 20 -2.569 -7.593 -4.643
176 HH11 ARG 20 1HH1 ARG 20 -1.546 -5.918 -7.534
177 HH12 ARG 20 2HH1 ARG 20 -1.762 -6.275 -9.214
178 HH21 ARG 20 1HH2 ARG 20 -3.931 -8.960 -8.667
179 HH22 ARG 20 2HH2 ARG 20 -3.117 -8.001 -9.858
180 H ALA 21 H ALA 21 -1.161 -2.009 -3.822
181 HA ALA 21 HA ALA 21 1.262 -1.641 -5.279
182 HB1 ALA 21 3HB ALA 21 0.818 0.571 -5.151
183 HB2 ALA 21 1HB ALA 21 0.397 0.495 -3.439
184 HB3 ALA 21 2HB ALA 21 -0.778 -0.000 -4.658
185 H ILE 22 H ILE 22 0.401 -1.691 -1.859
186 HA ILE 22 HA ILE 22 2.987 -1.027 -0.894
187 HB ILE 22 HB ILE 22 0.824 -2.567 0.549
188 HG12 ILE 22 2HG1 ILE 22 1.285 0.371 0.889
189 HG13 ILE 22 1HG1 ILE 22 0.341 -0.191 -0.486
190 HG21 ILE 22 1HG2 ILE 22 1.953 -1.421 2.543
191 HG22 ILE 22 2HG2 ILE 22 3.306 -1.144 1.449
192 HG23 ILE 22 3HG2 ILE 22 2.782 -2.792 1.804
193 HD11 ILE 22 3HD1 ILE 22 -0.560 -1.470 1.913
194 HD12 ILE 22 1HD1 ILE 22 -1.447 -0.443 0.787
195 HD13 ILE 22 2HD1 ILE 22 -0.543 0.281 2.117
196 H ASN 23 H ASN 23 1.513 -3.972 -1.990
197 HA ASN 23 HA ASN 23 3.294 -5.784 -0.712
198 HB2 ASN 23 2HB ASN 23 0.960 -6.062 -2.094
199 HB3 ASN 23 1HB ASN 23 2.126 -6.621 -3.288
200 HD21 ASN 23 1HD2 ASN 23 0.073 -8.078 -1.786
201 HD22 ASN 23 2HD2 ASN 23 0.907 -9.351 -0.968
202 H ILE 24 H ILE 24 3.300 -4.092 -3.800
203 HA ILE 24 HA ILE 24 5.501 -5.488 -4.926
204 HB ILE 24 HB ILE 24 4.596 -2.679 -5.570
205 HG12 ILE 24 2HG1 ILE 24 3.767 -5.113 -7.111
206 HG13 ILE 24 1HG1 ILE 24 2.881 -4.659 -5.660
207 HG21 ILE 24 1HG2 ILE 24 5.513 -3.355 -7.849
208 HG22 ILE 24 2HG2 ILE 24 6.298 -4.691 -7.007
209 HG23 ILE 24 3HG2 ILE 24 6.687 -3.025 -6.577
210 HD11 ILE 24 3HD1 ILE 24 3.329 -2.476 -7.562
211 HD12 ILE 24 1HD1 ILE 24 1.880 -2.930 -6.667
212 HD13 ILE 24 2HD1 ILE 24 2.307 -3.786 -8.147
213 H ALA 25 H ALA 25 5.224 -2.782 -2.746
214 HA ALA 25 HA ALA 25 8.049 -2.118 -2.998
215 HB1 ALA 25 3HB ALA 25 7.224 -0.531 -1.006
216 HB2 ALA 25 1HB ALA 25 5.676 -0.834 -1.794
217 HB3 ALA 25 2HB ALA 25 7.010 -0.130 -2.710
218 H GLY 26 H GLY 26 5.896 -3.857 -0.891
219 HA2 GLY 26 2HA GLY 26 7.781 -3.958 1.308
220 HA3 GLY 26 1HA GLY 26 6.234 -4.791 1.215
221 H THR 27 H THR 27 6.880 -5.982 -1.400
222 HA THR 27 HA THR 27 8.111 -8.360 -0.442
223 HB THR 27 HB THR 27 6.399 -8.466 -2.158
224 HG1 THR 27 1HG THR 27 8.112 -10.040 -2.180
225 HG21 THR 27 3HG2 THR 27 7.474 -6.269 -3.285
226 HG22 THR 27 1HG2 THR 27 6.371 -7.371 -4.108
227 HG23 THR 27 2HG2 THR 27 8.112 -7.526 -4.345
228 H THR 28 H THR 28 9.190 -5.675 -2.456
229 HA THR 28 HA THR 28 11.664 -6.809 -3.223
230 HB THR 28 HB THR 28 10.737 -4.946 -4.456
231 HG1 THR 28 1HG THR 28 13.065 -5.135 -4.246
232 HG21 THR 28 3HG2 THR 28 11.251 -2.655 -3.056
233 HG22 THR 28 1HG2 THR 28 10.532 -3.703 -1.834
234 HG23 THR 28 2HG2 THR 28 9.659 -3.363 -3.328
235 H HIS 29 H HIS 29 10.603 -5.076 -0.386
236 HA HIS 29 HA HIS 29 13.160 -4.395 0.622
237 HD1 HIS 29 1HD HIS 29 14.119 -4.429 2.640
238 HD2 HIS 29 2HD HIS 29 10.798 -2.480 4.198
239 HE1 HIS 29 1HE HIS 29 14.941 -3.241 4.697
240 HE2 HIS 29 2HE HIS 29 12.896 -2.136 5.670
241 HB2 HIS 29 2HB HIS 29 10.934 -3.430 1.356
242 HB3 HIS 29 1HB HIS 29 10.683 -4.912 2.270
243 H ASP 30 H ASP 30 11.239 -7.300 0.730
244 HA ASP 30 HA ASP 30 12.686 -8.553 2.851
245 HB2 ASP 30 2HB ASP 30 10.332 -9.073 1.456
246 HB3 ASP 30 1HB ASP 30 11.400 -10.396 1.007
247 H VAL 31 H VAL 31 12.608 -9.082 -0.670
248 HA VAL 31 HA VAL 31 14.571 -10.990 -0.889
249 HB VAL 31 HB VAL 31 14.263 -8.748 -2.875
250 HG11 VAL 31 1HG1 VAL 31 16.059 -10.265 -3.354
251 HG12 VAL 31 2HG1 VAL 31 14.738 -10.568 -4.483
252 HG13 VAL 31 3HG1 VAL 31 14.999 -11.652 -3.117
253 HG21 VAL 31 3HG2 VAL 31 12.044 -9.292 -2.680
254 HG22 VAL 31 1HG2 VAL 31 12.383 -10.948 -2.173
255 HG23 VAL 31 2HG2 VAL 31 12.557 -10.491 -3.868
256 H VAL 32 H VAL 32 14.954 -7.476 -0.816
257 HA VAL 32 HA VAL 32 17.739 -7.432 -1.253
258 HB VAL 32 HB VAL 32 16.130 -5.394 0.288
259 HG11 VAL 32 1HG1 VAL 32 17.997 -3.994 -1.045
260 HG12 VAL 32 2HG1 VAL 32 18.877 -5.499 -0.786
261 HG13 VAL 32 3HG1 VAL 32 18.227 -4.610 0.592
262 HG21 VAL 32 3HG2 VAL 32 16.719 -4.895 -2.545
263 HG22 VAL 32 1HG2 VAL 32 15.256 -4.572 -1.615
264 HG23 VAL 32 2HG2 VAL 32 15.562 -6.191 -2.245
265 H SER 33 H SER 33 15.806 -7.942 1.601
266 HA SER 33 HA SER 33 17.976 -7.558 3.449
267 HG SER 33 HG SER 33 15.814 -7.842 6.070
268 HB2 SER 33 2HB SER 33 15.300 -7.462 3.753
269 HB3 SER 33 1HB SER 33 15.595 -9.118 4.286
270 H PHE 34 H PHE 34 16.652 -10.207 1.634
271 HA PHE 34 HA PHE 34 18.068 -12.200 3.206
272 HD1 PHE 34 1HD PHE 34 18.546 -14.728 2.066
273 HD2 PHE 34 2HD PHE 34 14.527 -13.735 3.044
274 HE1 PHE 34 1HE PHE 34 18.339 -16.829 3.332
275 HE2 PHE 34 2HE PHE 34 14.312 -15.832 4.313
276 HZ PHE 34 HZ PHE 34 16.220 -17.382 4.457
277 HB2 PHE 34 2HB PHE 34 15.736 -12.288 1.761
278 HB3 PHE 34 1HB PHE 34 16.874 -13.062 0.663
279 H PHE 35 H PHE 35 18.282 -10.618 0.074
280 HA PHE 35 HA PHE 35 20.355 -12.270 -0.958
281 HD1 PHE 35 2HD PHE 35 18.147 -12.335 -3.089
282 HD2 PHE 35 1HD PHE 35 21.892 -10.397 -3.666
283 HE1 PHE 35 2HE PHE 35 18.503 -13.640 -5.143
284 HE2 PHE 35 1HE PHE 35 22.254 -11.697 -5.722
285 HZ PHE 35 HZ PHE 35 20.558 -13.322 -6.463
286 HB2 PHE 35 2HB PHE 35 18.732 -10.212 -1.940
287 HB3 PHE 35 1HB PHE 35 20.373 -9.584 -2.050
288 H ARG 36 H ARG 36 20.285 -9.441 1.075
289 HA ARG 36 HA ARG 36 22.900 -8.526 0.760
290 HE ARG 36 HE ARG 36 23.917 -5.609 3.745
291 HB2 ARG 36 2HB ARG 36 20.820 -8.309 2.862
292 HB3 ARG 36 1HB ARG 36 22.470 -7.947 3.351
293 HG2 ARG 36 2HG ARG 36 21.264 -6.674 0.924
294 HG3 ARG 36 1HG ARG 36 20.980 -6.025 2.541
295 HD2 ARG 36 2HD ARG 36 23.775 -6.617 1.692
296 HD3 ARG 36 1HD ARG 36 22.983 -5.173 1.062
297 HH11 ARG 36 1HH1 ARG 36 21.682 -3.818 1.752
298 HH12 ARG 36 2HH1 ARG 36 21.537 -2.507 2.874
299 HH21 ARG 36 1HH2 ARG 36 23.728 -3.887 5.222
300 HH22 ARG 36 2HH2 ARG 36 22.698 -2.546 4.844
301 HA PRO 37 HA PRO 37 24.296 -11.366 4.393
302 HB2 PRO 37 2HB PRO 37 22.555 -13.238 5.306
303 HB3 PRO 37 1HB PRO 37 22.639 -11.600 5.966
304 HG2 PRO 37 2HG PRO 37 20.726 -12.742 3.967
305 HG3 PRO 37 1HG PRO 37 20.398 -11.676 5.346
306 HD2 PRO 37 2HD PRO 37 20.566 -10.757 2.806
307 HD3 PRO 37 1HD PRO 37 21.068 -9.787 4.207
308 H LYS 38 H LYS 38 25.389 -13.331 4.232
309 HA LYS 38 HA LYS 38 24.494 -15.503 2.641
310 HB2 LYS 38 2HB LYS 38 25.522 -13.399 1.150
311 HB3 LYS 38 1HB LYS 38 26.879 -14.505 1.291
312 HG2 LYS 38 2HG LYS 38 25.940 -16.034 -0.055
313 HG3 LYS 38 1HG LYS 38 24.322 -15.764 0.592
314 HD2 LYS 38 2HD LYS 38 24.025 -13.819 -0.762
315 HD3 LYS 38 1HD LYS 38 25.716 -13.845 -1.264
316 HE2 LYS 38 2HE LYS 38 25.356 -15.415 -2.835
317 HE3 LYS 38 1HE LYS 38 24.231 -16.315 -1.817
318 HZ1 LYS 38 3HZ LYS 38 22.472 -15.259 -2.688
319 HZ2 LYS 38 1HZ LYS 38 23.514 -14.912 -3.976
320 HZ3 LYS 38 2HZ LYS 38 23.254 -13.761 -2.766
321 H LYS 39 H LYS 39 25.623 -15.047 5.240
322 HA LYS 39 HA LYS 39 27.899 -16.877 5.048
323 HB2 LYS 39 2HB LYS 39 27.885 -14.186 6.364
324 HB3 LYS 39 1HB LYS 39 28.883 -15.473 7.025
325 HG2 LYS 39 2HG LYS 39 29.989 -15.706 4.838
326 HG3 LYS 39 1HG LYS 39 29.027 -14.357 4.234
327 HD2 LYS 39 2HD LYS 39 30.270 -12.818 5.319
328 HD3 LYS 39 1HD LYS 39 30.474 -13.842 6.744
329 HE2 LYS 39 2HE LYS 39 31.952 -15.214 4.961
330 HE3 LYS 39 1HE LYS 39 32.155 -13.579 4.331
331 HZ1 LYS 39 3HZ LYS 39 33.677 -14.607 6.245
332 HZ2 LYS 39 1HZ LYS 39 32.481 -13.889 7.201
333 HZ3 LYS 39 2HZ LYS 39 33.364 -12.950 6.106
334 H LYS 40 H LYS 40 28.121 -18.289 6.770
335 HA LYS 40 HA LYS 40 25.738 -18.634 8.377
336 HB2 LYS 40 2HB LYS 40 28.142 -20.271 7.733
337 HB3 LYS 40 1HB LYS 40 27.285 -20.628 9.228
338 HG2 LYS 40 2HG LYS 40 26.015 -21.957 7.973
339 HG3 LYS 40 1HG LYS 40 25.242 -20.468 7.419
340 HD2 LYS 40 2HD LYS 40 26.829 -20.361 5.544
341 HD3 LYS 40 1HD LYS 40 27.563 -21.869 6.090
342 HE2 LYS 40 2HE LYS 40 24.685 -22.097 5.808
343 HE3 LYS 40 1HE LYS 40 25.457 -21.597 4.305
344 HZ1 LYS 40 3HZ LYS 40 26.873 -23.503 4.379
345 HZ2 LYS 40 1HZ LYS 40 25.277 -24.032 4.573
346 HZ3 LYS 40 2HZ LYS 40 26.309 -23.943 5.912
347 H LYS 41 H LYS 41 25.684 -18.730 10.645
348 HA LYS 41 HA LYS 41 28.008 -17.580 12.033
349 HB2 LYS 41 2HB LYS 41 26.522 -16.176 13.377
350 HB3 LYS 41 1HB LYS 41 26.374 -15.794 11.668
351 HG2 LYS 41 2HG LYS 41 24.232 -16.499 11.552
352 HG3 LYS 41 1HG LYS 41 24.477 -17.788 12.730
353 HD2 LYS 41 2HD LYS 41 24.817 -15.579 14.277
354 HD3 LYS 41 1HD LYS 41 23.613 -15.008 13.121
355 HE2 LYS 41 2HE LYS 41 22.789 -17.579 13.858
356 HE3 LYS 41 1HE LYS 41 23.304 -16.801 15.356
357 HZ1 LYS 41 3HZ LYS 41 21.863 -14.891 14.703
358 HZ2 LYS 41 1HZ LYS 41 21.022 -16.317 15.047
359 HZ3 LYS 41 2HZ LYS 41 21.254 -15.838 13.441
360 H HIS 42 H HIS 42 27.440 -17.659 14.551
361 HA HIS 42 HA HIS 42 27.205 -20.453 15.156
362 HD1 HIS 42 1HD HIS 42 29.236 -20.013 14.488
363 HD2 HIS 42 2HD HIS 42 30.249 -18.197 18.085
364 HE1 HIS 42 1HE HIS 42 31.745 -19.849 14.474
365 HE2 HIS 42 2HE HIS 42 32.339 -18.825 16.697
366 HB2 HIS 42 2HB HIS 42 27.506 -18.040 16.955
367 HB3 HIS 42 1HB HIS 42 27.566 -19.711 17.507
Start of MODEL 20
1 H1 GLY 1 1H GLY 1 -33.051 8.592 4.592
2 H2 GLY 1 2H GLY 1 -32.455 7.501 5.741
3 H3 GLY 1 3H GLY 1 -33.584 6.986 4.591
4 HA2 GLY 1 1HA GLY 1 -31.888 7.606 2.841
5 HA3 GLY 1 2HA GLY 1 -30.745 7.708 4.171
6 H LYS 2 H LYS 2 -31.380 5.814 1.757
7 HA LYS 2 HA LYS 2 -31.286 3.292 3.270
8 HB2 LYS 2 2HB LYS 2 -31.761 2.274 0.977
9 HB3 LYS 2 1HB LYS 2 -33.065 3.181 1.732
10 HG2 LYS 2 2HG LYS 2 -33.104 4.709 0.104
11 HG3 LYS 2 1HG LYS 2 -31.344 4.801 0.017
12 HD2 LYS 2 2HD LYS 2 -31.407 2.587 -1.189
13 HD3 LYS 2 1HD LYS 2 -33.158 2.781 -1.287
14 HE2 LYS 2 2HE LYS 2 -32.163 5.207 -2.181
15 HE3 LYS 2 1HE LYS 2 -31.054 4.015 -2.862
16 HZ1 LYS 2 3HZ LYS 2 -33.894 3.413 -3.079
17 HZ2 LYS 2 1HZ LYS 2 -32.645 3.162 -4.194
18 HZ3 LYS 2 2HZ LYS 2 -33.330 4.698 -4.024
19 H ILE 3 H ILE 3 -29.188 2.912 3.735
20 HA ILE 3 HA ILE 3 -27.002 3.626 2.131
21 HB ILE 3 HB ILE 3 -27.109 1.439 4.205
22 HG12 ILE 3 2HG1 ILE 3 -26.528 4.391 4.543
23 HG13 ILE 3 1HG1 ILE 3 -27.977 3.564 5.100
24 HG21 ILE 3 1HG2 ILE 3 -25.076 1.197 3.158
25 HG22 ILE 3 2HG2 ILE 3 -24.679 2.305 4.470
26 HG23 ILE 3 3HG2 ILE 3 -24.920 2.923 2.836
27 HD11 ILE 3 3HD1 ILE 3 -25.580 2.298 6.093
28 HD12 ILE 3 1HD1 ILE 3 -26.982 2.913 6.968
29 HD13 ILE 3 2HD1 ILE 3 -25.663 4.002 6.539
30 HA PRO 4 HA PRO 4 -27.662 0.305 -0.879
31 HB2 PRO 4 2HB PRO 4 -25.675 1.085 -2.569
32 HB3 PRO 4 1HB PRO 4 -27.276 1.832 -2.548
33 HG2 PRO 4 2HG PRO 4 -24.730 2.771 -1.284
34 HG3 PRO 4 1HG PRO 4 -25.950 3.703 -2.171
35 HD2 PRO 4 2HD PRO 4 -25.829 3.689 0.524
36 HD3 PRO 4 1HD PRO 4 -27.367 3.823 -0.354
37 H VAL 5 H VAL 5 -26.691 -1.655 -1.159
38 HA VAL 5 HA VAL 5 -24.742 -2.534 0.607
39 HB VAL 5 HB VAL 5 -25.274 -3.833 -2.056
40 HG11 VAL 5 1HG1 VAL 5 -24.141 -4.645 0.548
41 HG12 VAL 5 2HG1 VAL 5 -23.697 -5.136 -1.085
42 HG13 VAL 5 3HG1 VAL 5 -25.122 -5.830 -0.309
43 HG21 VAL 5 3HG2 VAL 5 -27.011 -5.081 -0.425
44 HG22 VAL 5 1HG2 VAL 5 -27.456 -3.724 -1.460
45 HG23 VAL 5 2HG2 VAL 5 -27.088 -3.451 0.243
46 H LYS 6 H LYS 6 -24.445 -1.189 -2.610
47 HA LYS 6 HA LYS 6 -21.819 -1.991 -3.184
48 HB2 LYS 6 2HB LYS 6 -23.775 -0.405 -4.408
49 HB3 LYS 6 1HB LYS 6 -22.393 0.663 -4.196
50 HG2 LYS 6 2HG LYS 6 -21.855 -0.207 -6.214
51 HG3 LYS 6 1HG LYS 6 -21.104 -1.433 -5.189
52 HD2 LYS 6 2HD LYS 6 -22.810 -2.970 -5.569
53 HD3 LYS 6 1HD LYS 6 -23.951 -1.724 -6.080
54 HE2 LYS 6 2HE LYS 6 -23.158 -1.680 -8.204
55 HE3 LYS 6 1HE LYS 6 -21.502 -2.025 -7.710
56 HZ1 LYS 6 3HZ LYS 6 -23.699 -3.886 -8.270
57 HZ2 LYS 6 1HZ LYS 6 -22.519 -4.343 -7.146
58 HZ3 LYS 6 2HZ LYS 6 -22.076 -3.969 -8.736
59 H ALA 7 H ALA 7 -23.082 0.692 -1.304
60 HA ALA 7 HA ALA 7 -20.732 2.189 -1.032
61 HB1 ALA 7 3HB ALA 7 -21.783 3.180 0.928
62 HB2 ALA 7 1HB ALA 7 -22.977 1.883 0.962
63 HB3 ALA 7 2HB ALA 7 -22.946 3.019 -0.385
64 H ILE 8 H ILE 8 -22.092 -0.301 1.121
65 HA ILE 8 HA ILE 8 -19.968 -0.322 2.958
66 HB ILE 8 HB ILE 8 -21.680 -2.709 2.296
67 HG12 ILE 8 2HG1 ILE 8 -22.669 -1.120 4.500
68 HG13 ILE 8 1HG1 ILE 8 -22.617 -0.159 3.028
69 HG21 ILE 8 1HG2 ILE 8 -19.722 -2.915 3.866
70 HG22 ILE 8 2HG2 ILE 8 -21.287 -3.387 4.529
71 HG23 ILE 8 3HG2 ILE 8 -20.583 -1.829 4.955
72 HD11 ILE 8 3HD1 ILE 8 -24.529 -1.079 2.426
73 HD12 ILE 8 1HD1 ILE 8 -24.486 -2.167 3.816
74 HD13 ILE 8 2HD1 ILE 8 -23.705 -2.636 2.305
75 H LYS 9 H LYS 9 -20.606 -2.292 0.095
76 HA LYS 9 HA LYS 9 -18.452 -4.051 0.314
77 HB2 LYS 9 2HB LYS 9 -20.356 -4.285 -1.278
78 HB3 LYS 9 1HB LYS 9 -19.662 -2.991 -2.243
79 HG2 LYS 9 2HG LYS 9 -17.589 -4.416 -2.440
80 HG3 LYS 9 1HG LYS 9 -18.537 -5.729 -1.739
81 HD2 LYS 9 2HD LYS 9 -19.698 -4.262 -4.045
82 HD3 LYS 9 1HD LYS 9 -18.353 -5.359 -4.365
83 HE2 LYS 9 2HE LYS 9 -20.697 -6.248 -2.726
84 HE3 LYS 9 1HE LYS 9 -20.776 -6.262 -4.487
85 HZ1 LYS 9 3HZ LYS 9 -19.881 -8.303 -3.054
86 HZ2 LYS 9 1HZ LYS 9 -18.421 -7.485 -3.299
87 HZ3 LYS 9 2HZ LYS 9 -19.347 -7.981 -4.625
88 H GLN 10 H GLN 10 -18.623 -0.777 -0.925
89 HA GLN 10 HA GLN 10 -16.151 -0.700 -2.255
90 HB2 GLN 10 2HB GLN 10 -18.181 1.189 -1.429
91 HB3 GLN 10 1HB GLN 10 -16.572 1.858 -1.190
92 HG2 GLN 10 2HG GLN 10 -17.308 2.490 -3.355
93 HG3 GLN 10 1HG GLN 10 -16.051 1.269 -3.552
94 HE21 GLN 10 1HE2 GLN 10 -16.583 -0.741 -4.358
95 HE22 GLN 10 2HE2 GLN 10 -18.108 -1.077 -5.098
96 H ALA 11 H ALA 11 -17.019 -0.280 1.117
97 HA ALA 11 HA ALA 11 -14.503 0.714 1.982
98 HB1 ALA 11 3HB ALA 11 -16.767 0.826 3.187
99 HB2 ALA 11 1HB ALA 11 -15.325 0.535 4.160
100 HB3 ALA 11 2HB ALA 11 -16.394 -0.807 3.744
101 H GLY 12 H GLY 12 -15.878 -2.501 1.636
102 HA2 GLY 12 2HA GLY 12 -13.807 -3.883 3.011
103 HA3 GLY 12 1HA GLY 12 -14.960 -4.597 1.894
104 H LYS 13 H LYS 13 -14.169 -2.729 -0.259
105 HA LYS 13 HA LYS 13 -12.098 -4.327 -1.392
106 HB2 LYS 13 2HB LYS 13 -13.989 -2.379 -2.300
107 HB3 LYS 13 1HB LYS 13 -12.393 -1.927 -2.879
108 HG2 LYS 13 2HG LYS 13 -12.991 -3.282 -4.583
109 HG3 LYS 13 1HG LYS 13 -12.330 -4.515 -3.505
110 HD2 LYS 13 2HD LYS 13 -14.893 -4.369 -2.624
111 HD3 LYS 13 1HD LYS 13 -15.105 -4.020 -4.341
112 HE2 LYS 13 2HE LYS 13 -15.277 -6.438 -3.760
113 HE3 LYS 13 1HE LYS 13 -14.041 -6.067 -4.959
114 HZ1 LYS 13 3HZ LYS 13 -12.394 -6.675 -3.575
115 HZ2 LYS 13 1HZ LYS 13 -13.605 -7.581 -2.820
116 HZ3 LYS 13 2HZ LYS 13 -13.160 -6.076 -2.193
117 H VAL 14 H VAL 14 -12.255 -1.076 -0.023
118 HA VAL 14 HA VAL 14 -9.720 -0.168 -0.708
119 HB VAL 14 HB VAL 14 -11.048 0.476 1.916
120 HG11 VAL 14 1HG1 VAL 14 -9.055 1.598 1.881
121 HG12 VAL 14 2HG1 VAL 14 -10.108 2.781 1.106
122 HG13 VAL 14 3HG1 VAL 14 -9.055 1.762 0.127
123 HG21 VAL 14 3HG2 VAL 14 -12.878 1.011 0.725
124 HG22 VAL 14 1HG2 VAL 14 -12.008 0.990 -0.809
125 HG23 VAL 14 2HG2 VAL 14 -11.935 2.416 0.226
126 H ILE 15 H ILE 15 -10.757 -2.358 1.811
127 HA ILE 15 HA ILE 15 -8.431 -2.277 3.408
128 HB ILE 15 HB ILE 15 -10.292 -4.627 3.043
129 HG12 ILE 15 2HG1 ILE 15 -10.474 -2.337 5.014
130 HG13 ILE 15 1HG1 ILE 15 -11.514 -2.548 3.610
131 HG21 ILE 15 1HG2 ILE 15 -9.557 -5.318 5.227
132 HG22 ILE 15 2HG2 ILE 15 -8.580 -3.859 5.403
133 HG23 ILE 15 3HG2 ILE 15 -8.142 -5.073 4.202
134 HD11 ILE 15 3HD1 ILE 15 -12.682 -3.286 5.554
135 HD12 ILE 15 1HD1 ILE 15 -11.341 -4.329 6.025
136 HD13 ILE 15 2HD1 ILE 15 -12.279 -4.701 4.579
137 H GLY 16 H GLY 16 -9.284 -4.074 0.517
138 HA2 GLY 16 2HA GLY 16 -7.045 -5.859 0.646
139 HA3 GLY 16 1HA GLY 16 -8.100 -5.611 -0.736
140 H LYS 17 H LYS 17 -7.636 -2.717 -0.787
141 HA LYS 17 HA LYS 17 -5.510 -2.628 -2.593
142 HB2 LYS 17 2HB LYS 17 -7.474 -0.943 -2.106
143 HB3 LYS 17 1HB LYS 17 -6.285 -0.183 -1.057
144 HG2 LYS 17 2HG LYS 17 -6.226 0.910 -3.174
145 HG3 LYS 17 1HG LYS 17 -4.748 -0.040 -3.005
146 HD2 LYS 17 2HD LYS 17 -5.269 -0.786 -5.063
147 HD3 LYS 17 1HD LYS 17 -6.391 -1.841 -4.201
148 HE2 LYS 17 2HE LYS 17 -8.216 -0.401 -4.623
149 HE3 LYS 17 1HE LYS 17 -7.159 0.905 -5.159
150 HZ1 LYS 17 3HZ LYS 17 -8.398 -0.532 -6.895
151 HZ2 LYS 17 1HZ LYS 17 -7.167 -1.658 -6.609
152 HZ3 LYS 17 2HZ LYS 17 -6.785 -0.109 -7.175
153 H GLY 18 H GLY 18 -5.634 -1.916 0.854
154 HA2 GLY 18 2HA GLY 18 -2.972 -0.930 1.046
155 HA3 GLY 18 1HA GLY 18 -3.969 -1.484 2.385
156 H LEU 19 H LEU 19 -4.413 -4.127 1.391
157 HA LEU 19 HA LEU 19 -2.066 -5.387 2.388
158 HG LEU 19 HG LEU 19 -3.696 -6.333 3.928
159 HB2 LEU 19 2HB LEU 19 -4.753 -6.169 1.598
160 HB3 LEU 19 1HB LEU 19 -3.559 -7.352 1.100
161 HD11 LEU 19 1HD1 LEU 19 -5.881 -7.260 3.376
162 HD12 LEU 19 2HD1 LEU 19 -5.003 -8.323 4.477
163 HD13 LEU 19 3HD1 LEU 19 -5.113 -8.725 2.763
164 HD21 LEU 19 3HD2 LEU 19 -2.292 -8.083 4.458
165 HD22 LEU 19 1HD2 LEU 19 -1.693 -7.615 2.865
166 HD23 LEU 19 2HD2 LEU 19 -2.745 -9.020 3.034
167 H ARG 20 H ARG 20 -3.292 -4.664 -0.800
168 HA ARG 20 HA ARG 20 -1.559 -6.411 -2.228
169 HE ARG 20 HE ARG 20 -3.744 -6.944 -6.399
170 HB2 ARG 20 2HB ARG 20 -3.751 -5.133 -2.970
171 HB3 ARG 20 1HB ARG 20 -2.602 -3.892 -3.452
172 HG2 ARG 20 2HG ARG 20 -3.009 -5.208 -5.362
173 HG3 ARG 20 1HG ARG 20 -1.409 -5.667 -4.778
174 HD2 ARG 20 2HD ARG 20 -2.067 -7.756 -4.222
175 HD3 ARG 20 1HD ARG 20 -3.666 -7.228 -3.702
176 HH11 ARG 20 1HH1 ARG 20 -2.929 -9.590 -4.275
177 HH12 ARG 20 2HH1 ARG 20 -3.462 -10.809 -5.384
178 HH21 ARG 20 1HH2 ARG 20 -4.445 -8.546 -7.859
179 HH22 ARG 20 2HH2 ARG 20 -4.323 -10.217 -7.418
180 H ALA 21 H ALA 21 -1.372 -3.059 -1.187
181 HA ALA 21 HA ALA 21 1.026 -2.446 -2.592
182 HB1 ALA 21 3HB ALA 21 0.057 -1.060 -0.106
183 HB2 ALA 21 1HB ALA 21 -0.670 -0.793 -1.689
184 HB3 ALA 21 2HB ALA 21 1.027 -0.396 -1.421
185 H ILE 22 H ILE 22 0.311 -3.482 0.708
186 HA ILE 22 HA ILE 22 2.976 -3.358 1.657
187 HB ILE 22 HB ILE 22 0.771 -5.157 2.668
188 HG12 ILE 22 2HG1 ILE 22 1.404 -2.547 3.958
189 HG13 ILE 22 1HG1 ILE 22 0.473 -2.509 2.463
190 HG21 ILE 22 1HG2 ILE 22 3.080 -3.989 4.200
191 HG22 ILE 22 2HG2 ILE 22 3.144 -5.573 3.426
192 HG23 ILE 22 3HG2 ILE 22 1.969 -5.262 4.704
193 HD11 ILE 22 3HD1 ILE 22 -0.953 -4.336 3.715
194 HD12 ILE 22 1HD1 ILE 22 -1.213 -2.612 3.981
195 HD13 ILE 22 2HD1 ILE 22 -0.268 -3.549 5.137
196 H ASN 23 H ASN 23 1.186 -5.733 -0.157
197 HA ASN 23 HA ASN 23 2.881 -7.952 0.331
198 HB2 ASN 23 2HB ASN 23 0.471 -7.615 -0.906
199 HB3 ASN 23 1HB ASN 23 1.536 -7.860 -2.288
200 HD21 ASN 23 1HD2 ASN 23 3.243 -9.689 -1.700
201 HD22 ASN 23 2HD2 ASN 23 2.511 -11.158 -1.157
202 H ILE 24 H ILE 24 2.850 -5.406 -2.116
203 HA ILE 24 HA ILE 24 4.923 -6.511 -3.715
204 HB ILE 24 HB ILE 24 4.127 -3.606 -3.505
205 HG12 ILE 24 2HG1 ILE 24 3.105 -5.540 -5.569
206 HG13 ILE 24 1HG1 ILE 24 2.288 -5.361 -4.019
207 HG21 ILE 24 1HG2 ILE 24 5.033 -4.729 -6.062
208 HG22 ILE 24 2HG2 ILE 24 6.262 -4.656 -4.801
209 HG23 ILE 24 3HG2 ILE 24 5.418 -3.189 -5.296
210 HD11 ILE 24 3HD1 ILE 24 1.240 -3.556 -4.740
211 HD12 ILE 24 1HD1 ILE 24 1.960 -3.816 -6.328
212 HD13 ILE 24 2HD1 ILE 24 2.771 -2.782 -5.151
213 H ALA 25 H ALA 25 4.856 -4.421 -0.909
214 HA ALA 25 HA ALA 25 7.493 -3.450 -1.040
215 HB1 ALA 25 3HB ALA 25 5.659 -3.880 1.311
216 HB2 ALA 25 1HB ALA 25 5.926 -2.386 0.414
217 HB3 ALA 25 2HB ALA 25 7.214 -3.057 1.414
218 H GLY 26 H GLY 26 6.143 -6.467 0.099
219 HA2 GLY 26 2HA GLY 26 8.350 -7.356 1.619
220 HA3 GLY 26 1HA GLY 26 7.119 -8.383 0.901
221 H THR 27 H THR 27 7.633 -7.517 -1.814
222 HA THR 27 HA THR 27 9.623 -9.395 -2.510
223 HB THR 27 HB THR 27 8.826 -7.232 -4.410
224 HG1 THR 27 1HG THR 27 7.108 -9.217 -3.360
225 HG21 THR 27 3HG2 THR 27 8.793 -10.200 -4.820
226 HG22 THR 27 1HG2 THR 27 10.237 -9.221 -5.063
227 HG23 THR 27 2HG2 THR 27 8.794 -8.922 -6.035
228 H THR 28 H THR 28 9.610 -5.838 -2.783
229 HA THR 28 HA THR 28 12.269 -5.571 -3.609
230 HB THR 28 HB THR 28 10.715 -3.732 -3.824
231 HG1 THR 28 1HG THR 28 12.677 -2.869 -3.684
232 HG21 THR 28 3HG2 THR 28 10.099 -2.388 -1.806
233 HG22 THR 28 1HG2 THR 28 10.611 -3.759 -0.824
234 HG23 THR 28 2HG2 THR 28 9.275 -3.941 -1.963
235 H HIS 29 H HIS 29 10.849 -5.928 -0.435
236 HA HIS 29 HA HIS 29 13.092 -5.160 1.097
237 HD1 HIS 29 1HD HIS 29 13.890 -5.142 2.937
238 HD2 HIS 29 2HD HIS 29 10.070 -5.475 4.535
239 HE1 HIS 29 1HE HIS 29 14.020 -4.087 5.216
240 HE2 HIS 29 2HE HIS 29 11.718 -4.377 6.197
241 HB2 HIS 29 2HB HIS 29 10.524 -5.815 1.686
242 HB3 HIS 29 1HB HIS 29 11.356 -7.277 2.209
243 H ASP 30 H ASP 30 12.218 -8.127 -0.520
244 HA ASP 30 HA ASP 30 14.186 -9.738 0.816
245 HB2 ASP 30 2HB ASP 30 11.946 -10.235 -0.768
246 HB3 ASP 30 1HB ASP 30 13.301 -10.768 -1.755
247 H VAL 31 H VAL 31 13.856 -8.509 -2.516
248 HA VAL 31 HA VAL 31 16.277 -9.338 -3.525
249 HB VAL 31 HB VAL 31 15.061 -6.674 -4.223
250 HG11 VAL 31 1HG1 VAL 31 15.802 -7.707 -6.540
251 HG12 VAL 31 2HG1 VAL 31 16.911 -8.605 -5.503
252 HG13 VAL 31 3HG1 VAL 31 16.935 -6.841 -5.502
253 HG21 VAL 31 3HG2 VAL 31 13.990 -9.405 -4.636
254 HG22 VAL 31 1HG2 VAL 31 13.908 -8.298 -6.009
255 HG23 VAL 31 2HG2 VAL 31 13.143 -7.865 -4.481
256 H VAL 32 H VAL 32 15.540 -6.300 -1.863
257 HA VAL 32 HA VAL 32 18.143 -5.219 -2.039
258 HB VAL 32 HB VAL 32 16.074 -4.629 0.083
259 HG11 VAL 32 1HG1 VAL 32 17.847 -2.505 -0.891
260 HG12 VAL 32 2HG1 VAL 32 18.660 -3.797 -0.007
261 HG13 VAL 32 3HG1 VAL 32 17.343 -2.902 0.751
262 HG21 VAL 32 3HG2 VAL 32 16.390 -2.886 -2.293
263 HG22 VAL 32 1HG2 VAL 32 14.954 -3.251 -1.334
264 HG23 VAL 32 2HG2 VAL 32 15.545 -4.417 -2.520
265 H SER 33 H SER 33 16.612 -7.409 0.213
266 HA SER 33 HA SER 33 18.566 -7.231 2.267
267 HG SER 33 HG SER 33 17.384 -8.710 4.241
268 HB2 SER 33 2HB SER 33 16.234 -8.159 2.532
269 HB3 SER 33 1HB SER 33 16.782 -9.599 1.675
270 H PHE 34 H PHE 34 18.323 -9.047 -0.698
271 HA PHE 34 HA PHE 34 20.678 -10.637 0.000
272 HD1 PHE 34 2HD PHE 34 21.958 -12.163 -1.859
273 HD2 PHE 34 1HD PHE 34 18.063 -13.455 -0.731
274 HE1 PHE 34 2HE PHE 34 22.840 -14.415 -1.411
275 HE2 PHE 34 1HE PHE 34 18.938 -15.712 -0.282
276 HZ PHE 34 HZ PHE 34 21.328 -16.194 -0.621
277 HB2 PHE 34 2HB PHE 34 18.360 -11.282 -1.361
278 HB3 PHE 34 1HB PHE 34 19.539 -11.079 -2.655
279 H PHE 35 H PHE 35 20.301 -7.654 -1.064
280 HA PHE 35 HA PHE 35 22.478 -7.853 -3.038
281 HD1 PHE 35 1HD PHE 35 23.442 -5.762 -4.348
282 HD2 PHE 35 2HD PHE 35 19.621 -7.085 -5.671
283 HE1 PHE 35 1HE PHE 35 24.269 -5.818 -6.666
284 HE2 PHE 35 2HE PHE 35 20.439 -7.144 -7.991
285 HZ PHE 35 HZ PHE 35 22.767 -6.511 -8.490
286 HB2 PHE 35 2HB PHE 35 19.962 -6.762 -3.436
287 HB3 PHE 35 1HB PHE 35 20.969 -5.354 -3.111
288 H ARG 36 H ARG 36 21.120 -5.980 -0.366
289 HA ARG 36 HA ARG 36 23.104 -4.017 -0.194
290 HE ARG 36 HE ARG 36 21.124 -3.735 4.394
291 HB2 ARG 36 2HB ARG 36 20.840 -4.820 1.320
292 HB3 ARG 36 1HB ARG 36 22.194 -4.695 2.435
293 HG2 ARG 36 2HG ARG 36 22.624 -2.406 1.461
294 HG3 ARG 36 1HG ARG 36 21.065 -2.560 0.649
295 HD2 ARG 36 2HD ARG 36 20.990 -1.331 2.825
296 HD3 ARG 36 1HD ARG 36 19.915 -2.724 2.731
297 HH11 ARG 36 1HH1 ARG 36 22.935 -1.018 3.160
298 HH12 ARG 36 2HH1 ARG 36 24.139 -1.097 4.402
299 HH21 ARG 36 1HH2 ARG 36 22.705 -3.840 6.028
300 HH22 ARG 36 2HH2 ARG 36 24.010 -2.698 6.030
301 HA PRO 37 HA PRO 37 25.442 -6.757 3.009
302 HB2 PRO 37 2HB PRO 37 24.640 -9.335 3.314
303 HB3 PRO 37 1HB PRO 37 23.991 -8.004 4.280
304 HG2 PRO 37 2HG PRO 37 22.822 -9.344 1.872
305 HG3 PRO 37 1HG PRO 37 22.023 -8.847 3.374
306 HD2 PRO 37 2HD PRO 37 21.871 -7.393 1.098
307 HD3 PRO 37 1HD PRO 37 21.863 -6.644 2.708
308 H LYS 38 H LYS 38 27.313 -7.863 2.562
309 HA LYS 38 HA LYS 38 27.402 -9.610 0.224
310 HB2 LYS 38 2HB LYS 38 28.416 -6.903 0.285
311 HB3 LYS 38 1HB LYS 38 29.726 -8.043 0.014
312 HG2 LYS 38 2HG LYS 38 28.236 -9.046 -1.804
313 HG3 LYS 38 1HG LYS 38 27.283 -7.568 -1.653
314 HD2 LYS 38 2HD LYS 38 28.718 -6.847 -3.254
315 HD3 LYS 38 1HD LYS 38 29.727 -6.491 -1.852
316 HE2 LYS 38 2HE LYS 38 29.933 -9.229 -2.930
317 HE3 LYS 38 1HE LYS 38 30.546 -7.947 -3.973
318 HZ1 LYS 38 3HZ LYS 38 31.354 -7.822 -1.183
319 HZ2 LYS 38 1HZ LYS 38 32.247 -7.510 -2.585
320 HZ3 LYS 38 2HZ LYS 38 31.997 -9.103 -2.080
321 H LYS 39 H LYS 39 27.635 -10.016 3.101
322 HA LYS 39 HA LYS 39 30.265 -10.298 3.980
323 HB2 LYS 39 2HB LYS 39 27.676 -11.608 4.702
324 HB3 LYS 39 1HB LYS 39 29.170 -12.248 5.370
325 HG2 LYS 39 2HG LYS 39 28.745 -10.776 7.011
326 HG3 LYS 39 1HG LYS 39 29.506 -9.634 5.902
327 HD2 LYS 39 2HD LYS 39 27.177 -9.217 4.975
328 HD3 LYS 39 1HD LYS 39 26.572 -10.095 6.380
329 HE2 LYS 39 2HE LYS 39 27.338 -8.481 7.872
330 HE3 LYS 39 1HE LYS 39 28.478 -7.809 6.708
331 HZ1 LYS 39 3HZ LYS 39 26.821 -6.253 6.669
332 HZ2 LYS 39 1HZ LYS 39 25.583 -7.376 6.937
333 HZ3 LYS 39 2HZ LYS 39 26.304 -7.260 5.410
334 H LYS 40 H LYS 40 31.857 -11.686 3.534
335 HA LYS 40 HA LYS 40 31.265 -13.909 1.708
336 HB2 LYS 40 2HB LYS 40 33.807 -13.864 1.384
337 HB3 LYS 40 1HB LYS 40 32.883 -12.524 0.718
338 HG2 LYS 40 2HG LYS 40 33.539 -11.087 2.504
339 HG3 LYS 40 1HG LYS 40 34.268 -12.430 3.389
340 HD2 LYS 40 2HD LYS 40 35.245 -11.870 0.636
341 HD3 LYS 40 1HD LYS 40 35.719 -10.764 1.927
342 HE2 LYS 40 2HE LYS 40 37.393 -12.220 2.268
343 HE3 LYS 40 1HE LYS 40 36.165 -13.179 3.096
344 HZ1 LYS 40 3HZ LYS 40 37.106 -13.480 0.299
345 HZ2 LYS 40 1HZ LYS 40 35.733 -14.265 0.903
346 HZ3 LYS 40 2HZ LYS 40 37.254 -14.593 1.565
347 H LYS 41 H LYS 41 30.670 -14.213 4.447
348 HA LYS 41 HA LYS 41 32.787 -15.600 5.780
349 HB2 LYS 41 2HB LYS 41 30.987 -14.444 7.007
350 HB3 LYS 41 1HB LYS 41 29.819 -15.589 6.359
351 HG2 LYS 41 2HG LYS 41 31.063 -17.412 7.494
352 HG3 LYS 41 1HG LYS 41 32.093 -16.188 8.237
353 HD2 LYS 41 2HD LYS 41 30.516 -15.590 9.725
354 HD3 LYS 41 1HD LYS 41 29.214 -15.703 8.537
355 HE2 LYS 41 2HE LYS 41 29.354 -18.190 8.745
356 HE3 LYS 41 1HE LYS 41 30.494 -17.961 10.071
357 HZ1 LYS 41 3HZ LYS 41 27.997 -16.496 10.285
358 HZ2 LYS 41 1HZ LYS 41 28.871 -17.328 11.470
359 HZ3 LYS 41 2HZ LYS 41 27.865 -18.178 10.407
360 H HIS 42 H HIS 42 33.181 -16.970 3.792
361 HA HIS 42 HA HIS 42 33.184 -19.008 2.782
362 HD1 HIS 42 1HD HIS 42 34.881 -20.073 3.058
363 HD2 HIS 42 2HD HIS 42 32.603 -22.908 5.071
364 HE1 HIS 42 1HE HIS 42 36.058 -22.266 2.691
365 HE2 HIS 42 2HE HIS 42 34.708 -23.951 3.992
366 HB2 HIS 42 2HB HIS 42 32.934 -19.497 5.466
367 HB3 HIS 42 1HB HIS 42 31.555 -20.375 4.813