Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
20630 | 2g9l RC | 7065 | cing | 1-original | 6 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 1H GLY 1 1H GLY 1 65.064 53.832 14.587
2 2H GLY 1 2H GLY 1 63.756 54.688 15.112
3 3H GLY 1 3H GLY 1 65.200 54.822 15.900
4 1HA GLY 1 2HA GLY 1 64.817 56.754 14.575
5 2HA GLY 1 1HA GLY 1 66.222 55.829 14.009
6 H ILE 2 H ILE 2 65.542 57.330 12.092
7 HA ILE 2 HA ILE 2 63.331 56.781 10.482
8 HB ILE 2 HB ILE 2 64.834 58.708 10.407
9 1HG1 ILE 2 1HG1 ILE 2 63.304 57.967 8.478
10 2HG1 ILE 2 2HG1 ILE 2 64.501 59.247 8.255
11 1HG2 ILE 2 1HG2 ILE 2 66.949 58.655 9.179
12 2HG2 ILE 2 2HG2 ILE 2 67.011 57.604 10.604
13 3HG2 ILE 2 3HG2 ILE 2 66.825 56.895 8.988
14 1HD1 ILE 2 1HD1 ILE 2 64.925 56.372 7.338
15 2HD1 ILE 2 2HD1 ILE 2 64.396 57.720 6.319
16 3HD1 ILE 2 3HD1 ILE 2 66.003 57.757 7.057
17 H LEU 3 H LEU 3 66.463 55.114 10.751
18 HA LEU 3 HA LEU 3 66.099 53.492 8.402
19 1HB LEU 3 1HB LEU 3 67.867 53.082 10.847
20 2HB LEU 3 2HB LEU 3 68.029 52.243 9.298
21 HG LEU 3 HG LEU 3 68.394 55.241 9.761
22 1HD1 LEU 3 1HD2 LEU 3 70.761 54.763 9.296
23 2HD1 LEU 3 2HD2 LEU 3 70.392 53.031 9.137
24 3HD1 LEU 3 3HD2 LEU 3 70.193 53.844 10.706
25 1HD2 LEU 3 1HD1 LEU 3 67.551 54.844 7.485
26 2HD2 LEU 3 2HD1 LEU 3 69.277 55.228 7.424
27 3HD2 LEU 3 3HD1 LEU 3 68.742 53.543 7.248
28 H ASP 4 H ASP 4 64.682 53.335 11.540
29 HA ASP 4 HA ASP 4 64.127 50.434 11.343
30 1HB ASP 4 2HB ASP 4 64.822 51.451 13.519
31 2HB ASP 4 1HB ASP 4 63.383 52.479 13.474
32 HD2 ASP 4 HD2 ASP 4 61.371 51.488 13.575
33 H THR 5 H THR 5 62.920 53.679 10.799
34 HA THR 5 HA THR 5 60.185 53.089 11.080
35 HB THR 5 HB THR 5 61.503 55.355 9.532
36 HG1 THR 5 HG1 THR 5 61.144 56.446 11.506
37 1HG2 THR 5 1HG2 THR 5 59.121 55.120 8.939
38 2HG2 THR 5 2HG2 THR 5 58.689 55.061 10.665
39 3HG2 THR 5 3HG2 THR 5 59.372 56.545 9.965
40 H LEU 6 H LEU 6 62.162 53.634 8.103
41 HA LEU 6 HA LEU 6 60.175 52.881 6.229
42 1HB LEU 6 2HB LEU 6 63.207 52.686 6.087
43 2HB LEU 6 1HB LEU 6 62.103 52.627 4.706
44 HG LEU 6 HG LEU 6 62.475 55.010 6.579
45 1HD1 LEU 6 1HD1 LEU 6 63.551 56.047 4.618
46 2HD1 LEU 6 2HD1 LEU 6 63.350 54.538 3.701
47 3HD1 LEU 6 3HD1 LEU 6 64.417 54.581 5.123
48 1HD2 LEU 6 1HD2 LEU 6 60.189 54.987 5.680
49 2HD2 LEU 6 2HD2 LEU 6 60.812 54.674 4.042
50 3HD2 LEU 6 3HD2 LEU 6 61.143 56.224 4.847
51 H LYS 7 H LYS 7 62.547 50.993 8.094
52 HA LYS 7 HA LYS 7 62.253 48.514 6.718
53 1HB LYS 7 1HB LYS 7 63.144 49.306 9.499
54 2HB LYS 7 2HB LYS 7 62.978 47.613 9.025
55 1HG LYS 7 2HG LYS 7 65.252 48.285 8.796
56 2HG LYS 7 1HG LYS 7 64.592 47.885 7.210
57 1HD LYS 7 2HD LYS 7 64.565 50.772 8.106
58 2HD LYS 7 1HD LYS 7 66.119 50.046 7.688
59 1HE LYS 7 2HE LYS 7 63.742 50.047 5.788
60 2HE LYS 7 1HE LYS 7 65.064 51.224 5.777
61 1HZ LYS 7 1HZ LYS 7 65.437 49.486 4.227
62 2HZ LYS 7 2HZ LYS 7 65.356 48.334 5.402
63 3HZ LYS 7 3HZ LYS 7 66.584 49.435 5.410
64 H GLN 8 H GLN 8 60.488 49.970 9.490
65 HA GLN 8 HA GLN 8 58.947 47.762 10.221
66 1HB GLN 8 2HB GLN 8 59.215 49.915 11.434
67 2HB GLN 8 1HB GLN 8 58.141 50.705 10.275
68 1HG GLN 8 2HG GLN 8 57.377 48.306 11.985
69 2HG GLN 8 1HG GLN 8 57.088 49.992 12.445
70 1HE2 GLN 8 2HE2 GLN 8 55.971 51.342 10.585
71 2HE2 GLN 8 1HE2 GLN 8 54.567 50.569 9.881
72 H PHE 9 H PHE 9 58.005 50.463 8.026
73 HA PHE 9 HA PHE 9 55.575 49.239 7.166
74 1HB PHE 9 2HB PHE 9 57.301 51.387 5.887
75 2HB PHE 9 1HB PHE 9 55.671 50.954 5.363
76 HD1 PHE 9 HD1 PHE 9 53.763 51.096 7.113
77 HD2 PHE 9 HD2 PHE 9 57.569 53.058 7.549
78 HE1 PHE 9 HE1 PHE 9 52.782 52.629 8.797
79 HE2 PHE 9 HE2 PHE 9 56.589 54.575 9.249
80 HZ PHE 9 HZ PHE 9 54.198 54.361 9.876
81 H ALA 10 H ALA 10 58.909 49.168 5.841
82 HA ALA 10 HA ALA 10 58.275 47.809 3.424
83 1HB ALA 10 1HB ALA 10 60.801 47.670 5.118
84 2HB ALA 10 2HB ALA 10 60.648 47.171 3.421
85 3HB ALA 10 3HB ALA 10 60.454 48.881 3.862
86 H LYS 11 H LYS 11 59.065 46.632 6.724
87 HA LYS 11 HA LYS 11 58.445 43.846 6.006
88 1HB LYS 11 2HB LYS 11 59.070 45.198 8.661
89 2HB LYS 11 1HB LYS 11 58.808 43.455 8.433
90 1HG LYS 11 2HG LYS 11 60.697 43.353 6.856
91 2HG LYS 11 1HG LYS 11 61.001 45.088 7.083
92 1HD LYS 11 1HD LYS 11 61.352 44.700 9.513
93 2HD LYS 11 2HD LYS 11 61.110 42.958 9.265
94 1HE LYS 11 2HE LYS 11 63.290 44.649 7.962
95 2HE LYS 11 1HE LYS 11 63.513 43.582 9.362
96 1HZ LYS 11 1HZ LYS 11 62.675 42.731 6.684
97 2HZ LYS 11 2HZ LYS 11 64.166 42.516 7.353
98 3HZ LYS 11 3HZ LYS 11 62.856 41.744 7.993
99 H GLY 12 H GLY 12 56.409 45.461 5.233
100 1HA GLY 12 1HA GLY 12 54.184 44.288 6.573
101 2HA GLY 12 2HA GLY 12 54.270 46.046 6.913
102 H VAL 13 H VAL 13 55.464 46.707 4.323
103 HA VAL 13 HA VAL 13 53.450 45.752 2.365
104 HB VAL 13 HB VAL 13 55.777 47.664 1.927
105 1HG1 VAL 13 1HG1 VAL 13 54.824 46.664 -0.157
106 2HG1 VAL 13 2HG1 VAL 13 53.202 47.175 0.351
107 3HG1 VAL 13 3HG1 VAL 13 54.436 48.387 -0.051
108 1HG2 VAL 13 1HG2 VAL 13 54.096 49.508 2.026
109 2HG2 VAL 13 2HG2 VAL 13 54.288 48.703 3.589
110 3HG2 VAL 13 3HG2 VAL 13 52.874 48.338 2.574
111 H GLY 14 H GLY 14 54.777 43.927 3.646
112 1HA GLY 14 1HA GLY 14 56.242 42.501 1.550
113 2HA GLY 14 2HA GLY 14 57.109 42.757 3.084
114 H LYS 15 H LYS 15 54.636 42.819 4.682
115 HA LYS 15 HA LYS 15 54.117 39.993 5.066
116 1HB LYS 15 2HB LYS 15 54.274 41.726 6.872
117 2HB LYS 15 1HB LYS 15 52.766 42.437 6.259
118 1HG LYS 15 2HG LYS 15 52.385 40.918 8.179
119 2HG LYS 15 1HG LYS 15 51.576 40.305 6.721
120 1HD LYS 15 1HD LYS 15 53.320 38.675 6.345
121 2HD LYS 15 2HD LYS 15 54.373 39.450 7.548
122 1HE LYS 15 1HE LYS 15 52.767 38.821 9.338
123 2HE LYS 15 2HE LYS 15 51.702 38.080 8.125
124 1HZ LYS 15 1HZ LYS 15 54.443 37.235 8.744
125 2HZ LYS 15 2HZ LYS 15 53.063 36.467 9.218
126 3HZ LYS 15 3HZ LYS 15 53.455 36.546 7.618
127 H ASP 16 H ASP 16 52.541 42.899 3.742
128 HA ASP 16 HA ASP 16 50.014 41.770 3.064
129 1HB ASP 16 1HB ASP 16 50.556 44.197 3.229
130 2HB ASP 16 2HB ASP 16 51.572 44.057 1.788
131 HD2 ASP 16 HD2 ASP 16 48.895 44.054 -0.443
132 H LEU 17 H LEU 17 53.224 41.437 1.679
133 HA LEU 17 HA LEU 17 52.274 40.596 -0.981
134 1HB LEU 17 1HB LEU 17 54.967 40.970 0.373
135 2HB LEU 17 2HB LEU 17 54.794 40.287 -1.230
136 HG LEU 17 HG LEU 17 55.405 42.726 -1.121
137 1HD1 LEU 17 1HD1 LEU 17 54.565 41.625 -3.166
138 2HD1 LEU 17 2HD1 LEU 17 54.019 43.311 -3.068
139 3HD1 LEU 17 3HD1 LEU 17 52.893 41.993 -2.685
140 1HD2 LEU 17 1HD2 LEU 17 52.461 43.194 -0.544
141 2HD2 LEU 17 2HD2 LEU 17 53.719 44.407 -0.826
142 3HD2 LEU 17 3HD2 LEU 17 53.772 43.416 0.643
143 H VAL 18 H VAL 18 53.887 39.475 2.025
144 HA VAL 18 HA VAL 18 54.037 36.717 1.236
145 HB VAL 18 HB VAL 18 54.108 38.210 3.869
146 1HG1 VAL 18 1HG1 VAL 18 53.055 36.090 4.407
147 2HG1 VAL 18 2HG1 VAL 18 54.272 35.209 3.446
148 3HG1 VAL 18 3HG1 VAL 18 54.746 36.063 4.936
149 1HG2 VAL 18 1HG2 VAL 18 56.443 37.443 3.870
150 2HG2 VAL 18 2HG2 VAL 18 56.161 36.508 2.385
151 3HG2 VAL 18 3HG2 VAL 18 56.102 38.281 2.342
152 H LYS 19 H LYS 19 51.573 38.890 2.524
153 HA LYS 19 HA LYS 19 49.637 36.833 3.218
154 1HB LYS 19 2HB LYS 19 49.662 39.087 4.210
155 2HB LYS 19 1HB LYS 19 49.246 39.783 2.629
156 1HG LYS 19 2HG LYS 19 47.131 38.540 2.598
157 2HG LYS 19 1HG LYS 19 47.577 37.690 4.097
158 1HD LYS 19 1HD LYS 19 47.624 39.825 5.315
159 2HD LYS 19 2HD LYS 19 47.215 40.699 3.820
160 1HE LYS 19 1HE LYS 19 45.074 39.454 3.681
161 2HE LYS 19 2HE LYS 19 45.484 38.580 5.172
162 1HZ LYS 19 1HZ LYS 19 45.501 40.671 6.316
163 2HZ LYS 19 2HZ LYS 19 44.041 40.421 5.590
164 3HZ LYS 19 3HZ LYS 19 45.120 41.482 4.932
165 H GLY 20 H GLY 20 50.499 38.778 0.401
166 1HA GLY 20 1HA GLY 20 48.225 38.097 -1.249
167 2HA GLY 20 2HA GLY 20 49.743 38.867 -1.756
168 H ALA 21 H ALA 21 51.612 36.941 -0.863
169 HA ALA 21 HA ALA 21 51.435 34.836 -2.808
170 1HB ALA 21 1HB ALA 21 53.158 35.102 -0.311
171 2HB ALA 21 2HB ALA 21 53.415 33.954 -1.643
172 3HB ALA 21 3HB ALA 21 53.579 35.701 -1.932
173 H ALA 22 H ALA 22 50.582 35.206 0.612
174 HA ALA 22 HA ALA 22 49.874 32.364 0.839
175 1HB ALA 22 1HB ALA 22 49.746 34.579 2.902
176 2HB ALA 22 2HB ALA 22 51.101 33.451 2.664
177 3HB ALA 22 3HB ALA 22 49.524 32.841 3.200
178 H GLN 23 H GLN 23 48.311 33.905 -1.065
179 HA GLN 23 HA GLN 23 45.806 34.608 0.267
180 1HB GLN 23 1HB GLN 23 46.742 36.020 -1.485
181 2HB GLN 23 2HB GLN 23 46.723 34.673 -2.632
182 1HG GLN 23 1HG GLN 23 44.839 36.171 -3.010
183 2HG GLN 23 2HG GLN 23 44.259 34.577 -2.509
184 1HE2 GLN 23 1HE2 GLN 23 45.189 37.780 -1.110
185 2HE2 GLN 23 2HE2 GLN 23 43.930 37.806 0.106
186 H GLY 24 H GLY 24 46.833 32.361 -2.358
187 1HA GLY 24 2HA GLY 24 44.181 31.193 -2.528
188 2HA GLY 24 1HA GLY 24 45.606 30.785 -3.495
189 H VAL 25 H VAL 25 46.847 28.373 -1.060
190 HA VAL 25 HA VAL 25 47.863 30.680 -2.508
191 HB VAL 25 HB VAL 25 49.138 28.061 -1.634
192 1HG1 VAL 25 1HG1 VAL 25 51.234 29.369 -1.848
193 2HG1 VAL 25 2HG1 VAL 25 50.402 29.197 -3.407
194 3HG1 VAL 25 3HG1 VAL 25 50.305 30.734 -2.511
195 1HG2 VAL 25 1HG2 VAL 25 48.945 30.793 -0.316
196 2HG2 VAL 25 2HG2 VAL 25 48.298 29.265 0.317
197 3HG2 VAL 25 3HG2 VAL 25 50.051 29.505 0.216
198 H LEU 26 H LEU 26 47.552 27.139 -3.094
199 HA LEU 26 HA LEU 26 48.657 27.091 -5.656
200 1HB LEU 26 2HB LEU 26 46.474 25.332 -4.482
201 2HB LEU 26 1HB LEU 26 47.499 24.928 -5.867
202 HG LEU 26 HG LEU 26 48.475 25.371 -3.007
203 1HD1 LEU 26 1HD2 LEU 26 47.170 23.300 -3.313
204 2HD1 LEU 26 2HD2 LEU 26 48.891 22.948 -3.048
205 3HD1 LEU 26 3HD2 LEU 26 48.206 22.846 -4.686
206 1HD2 LEU 26 1HD1 LEU 26 50.229 26.008 -4.604
207 2HD2 LEU 26 2HD1 LEU 26 49.954 24.516 -5.536
208 3HD2 LEU 26 3HD1 LEU 26 50.618 24.436 -3.889
209 H SER 27 H SER 27 45.341 27.902 -4.656
210 HA SER 27 HA SER 27 44.179 27.757 -7.270
211 1HB SER 27 2HB SER 27 42.350 29.057 -6.229
212 2HB SER 27 1HB SER 27 42.838 27.665 -5.238
213 HG SER 27 HG SER 27 42.608 29.583 -4.013
214 H THR 28 H THR 28 45.763 30.366 -5.403
215 HA THR 28 HA THR 28 45.217 32.400 -7.397
216 HB THR 28 HB THR 28 47.074 32.359 -4.989
217 HG1 THR 28 HG1 THR 28 45.340 33.546 -4.093
218 1HG2 THR 28 1HG2 THR 28 46.071 34.663 -6.722
219 2HG2 THR 28 2HG2 THR 28 47.754 34.099 -6.602
220 3HG2 THR 28 3HG2 THR 28 46.965 34.836 -5.196
221 H VAL 29 H VAL 29 48.154 30.611 -6.292
222 HA VAL 29 HA VAL 29 49.926 31.754 -8.178
223 HB VAL 29 HB VAL 29 49.986 29.148 -6.613
224 1HG1 VAL 29 1HG1 VAL 29 51.488 28.945 -8.542
225 2HG1 VAL 29 2HG1 VAL 29 52.184 30.547 -8.192
226 3HG1 VAL 29 3HG1 VAL 29 52.432 29.195 -7.061
227 1HG2 VAL 29 1HG2 VAL 29 51.331 31.859 -6.197
228 2HG2 VAL 29 2HG2 VAL 29 49.976 31.225 -5.240
229 3HG2 VAL 29 3HG2 VAL 29 51.557 30.423 -5.178
230 H SER 30 H SER 30 48.106 28.641 -8.223
231 HA SER 30 HA SER 30 48.978 27.909 -10.856
232 1HB SER 30 1HB SER 30 48.073 26.299 -9.189
233 2HB SER 30 2HB SER 30 46.483 27.085 -9.300
234 HG SER 30 HG SER 30 46.666 25.256 -10.669
235 H CYS 31 H CYS 31 46.063 29.510 -9.568
236 HA CYS 31 HA CYS 31 44.737 30.000 -12.033
237 1HB CYS 31 2HB CYS 31 43.693 30.186 -9.821
238 2HB CYS 31 1HB CYS 31 44.768 31.529 -9.414
239 H LYS 32 H LYS 32 47.730 31.291 -10.825
240 HA LYS 32 HA LYS 32 47.372 33.963 -11.840
241 1HB LYS 32 2HB LYS 32 48.733 33.176 -9.803
242 2HB LYS 32 1HB LYS 32 49.997 32.781 -10.996
243 1HG LYS 32 2HG LYS 32 49.377 35.162 -11.956
244 2HG LYS 32 1HG LYS 32 48.669 35.427 -10.352
245 1HD LYS 32 1HD LYS 32 51.513 34.625 -11.012
246 2HD LYS 32 2HD LYS 32 51.018 36.246 -10.476
247 1HE LYS 32 1HE LYS 32 50.904 33.673 -8.837
248 2HE LYS 32 2HE LYS 32 52.017 35.029 -8.603
249 1HZ LYS 32 1HZ LYS 32 49.102 35.145 -8.302
250 2HZ LYS 32 2HZ LYS 32 50.141 36.410 -8.098
251 3HZ LYS 32 3HZ LYS 32 50.206 35.115 -7.078
252 H LEU 33 H LEU 33 46.762 32.592 -13.944
253 HA LEU 33 HA LEU 33 48.937 32.067 -15.804
254 1HB LEU 33 2HB LEU 33 45.962 32.629 -16.120
255 2HB LEU 33 1HB LEU 33 47.059 32.499 -17.502
256 HG LEU 33 HG LEU 33 47.725 30.223 -16.799
257 1HD1 LEU 33 1HD2 LEU 33 47.250 30.257 -14.400
258 2HD1 LEU 33 2HD2 LEU 33 45.525 30.579 -14.714
259 3HD1 LEU 33 3HD2 LEU 33 46.248 29.022 -15.171
260 1HD2 LEU 33 1HD1 LEU 33 45.613 29.155 -17.494
261 2HD2 LEU 33 2HD1 LEU 33 45.940 30.610 -18.459
262 3HD2 LEU 33 3HD1 LEU 33 44.731 30.662 -17.155
263 H ALA 34 H ALA 34 46.588 34.752 -15.425
264 HA ALA 34 HA ALA 34 48.756 36.705 -15.921
265 1HB ALA 34 1HB ALA 34 47.272 38.039 -17.368
266 2HB ALA 34 2HB ALA 34 47.573 36.440 -18.080
267 3HB ALA 34 3HB ALA 34 46.024 36.773 -17.273
268 H LYS 35 H LYS 35 47.844 35.793 -13.488
269 HA LYS 35 HA LYS 35 46.800 36.237 -11.572
270 1HB LYS 35 2HB LYS 35 48.469 38.091 -11.844
271 2HB LYS 35 1HB LYS 35 47.152 39.133 -12.409
272 1HG LYS 35 2HG LYS 35 47.517 39.534 -10.063
273 2HG LYS 35 1HG LYS 35 45.975 38.665 -10.206
274 1HD LYS 35 2HD LYS 35 47.181 36.528 -9.677
275 2HD LYS 35 1HD LYS 35 48.677 37.459 -9.461
276 1HE LYS 35 1HE LYS 35 46.105 37.845 -7.864
277 2HE LYS 35 2HE LYS 35 47.526 36.939 -7.313
278 1HZ LYS 35 1HZ LYS 35 47.475 39.796 -7.970
279 2HZ LYS 35 2HZ LYS 35 47.521 39.144 -6.456
280 3HZ LYS 35 3HZ LYS 35 48.800 38.945 -7.478
281 H THR 36 H THR 36 44.914 35.298 -12.942
282 HA THR 36 HA THR 36 42.636 37.183 -13.048
283 HB THR 36 HB THR 36 41.405 35.299 -13.994
284 HG1 THR 36 HG1 THR 36 42.392 33.595 -12.976
285 1HG2 THR 36 1HG2 THR 36 42.639 35.097 -16.095
286 2HG2 THR 36 2HG2 THR 36 42.756 36.761 -15.482
287 3HG2 THR 36 3HG2 THR 36 44.135 35.649 -15.313
288 H CYS 37 H CYS 37 44.275 35.873 -10.611
289 HA CYS 37 HA CYS 37 41.834 35.805 -8.930
290 1HB CYS 37 1HB CYS 37 44.176 33.881 -8.758
291 2HB CYS 37 2HB CYS 37 42.999 34.145 -7.467
292 HXT CYS 37 HO OH 38 43.717 37.418 -6.432
Start of MODEL 2
1 1H GLY 1 1H GLY 1 67.390 55.327 10.316
2 2H GLY 1 2H GLY 1 67.962 54.415 11.566
3 3H GLY 1 3H GLY 1 67.119 53.700 10.341
4 1HA GLY 1 1HA GLY 1 65.764 53.893 12.290
5 2HA GLY 1 2HA GLY 1 66.051 55.643 12.265
6 H ILE 2 H ILE 2 65.504 56.714 10.061
7 HA ILE 2 HA ILE 2 62.770 56.381 9.518
8 HB ILE 2 HB ILE 2 64.015 58.472 9.238
9 1HG1 ILE 2 1HG1 ILE 2 63.179 59.175 7.024
10 2HG1 ILE 2 2HG1 ILE 2 62.872 57.483 6.603
11 1HG2 ILE 2 1HG2 ILE 2 65.530 58.846 7.366
12 2HG2 ILE 2 2HG2 ILE 2 66.152 57.521 8.362
13 3HG2 ILE 2 3HG2 ILE 2 65.337 57.171 6.820
14 1HD1 ILE 2 1HD1 ILE 2 60.830 58.729 7.356
15 2HD1 ILE 2 2HD1 ILE 2 61.174 57.329 8.384
16 3HD1 ILE 2 3HD1 ILE 2 61.589 58.967 8.944
17 H LEU 3 H LEU 3 65.651 54.919 8.089
18 HA LEU 3 HA LEU 3 64.326 53.908 5.730
19 1HB LEU 3 1HB LEU 3 66.906 53.046 7.097
20 2HB LEU 3 2HB LEU 3 66.407 52.620 5.453
21 HG LEU 3 HG LEU 3 67.029 55.435 6.467
22 1HD1 LEU 3 1HD2 LEU 3 69.007 53.977 6.247
23 2HD1 LEU 3 2HD2 LEU 3 68.537 53.583 4.578
24 3HD1 LEU 3 3HD2 LEU 3 68.999 55.246 5.004
25 1HD2 LEU 3 1HD1 LEU 3 65.338 55.545 4.687
26 2HD2 LEU 3 2HD1 LEU 3 66.910 56.046 4.045
27 3HD2 LEU 3 3HD1 LEU 3 66.286 54.421 3.685
28 H ASP 4 H ASP 4 64.361 52.902 9.048
29 HA ASP 4 HA ASP 4 63.670 50.103 8.387
30 1HB ASP 4 2HB ASP 4 65.301 50.577 10.219
31 2HB ASP 4 1HB ASP 4 64.061 51.521 11.057
32 HD2 ASP 4 HD2 ASP 4 63.631 47.469 10.802
33 H THR 5 H THR 5 62.466 53.282 9.196
34 HA THR 5 HA THR 5 60.062 52.428 10.415
35 HB THR 5 HB THR 5 60.711 55.084 9.073
36 HG1 THR 5 HG1 THR 5 62.067 54.500 10.820
37 1HG2 THR 5 1HG2 THR 5 58.281 54.811 9.366
38 2HG2 THR 5 2HG2 THR 5 58.529 54.322 11.059
39 3HG2 THR 5 3HG2 THR 5 58.919 55.977 10.540
40 H LEU 6 H LEU 6 60.742 53.774 7.139
41 HA LEU 6 HA LEU 6 58.196 53.111 6.021
42 1HB LEU 6 2HB LEU 6 59.250 53.595 3.886
43 2HB LEU 6 1HB LEU 6 59.650 54.805 5.108
44 HG LEU 6 HG LEU 6 61.825 53.238 5.420
45 1HD1 LEU 6 1HD2 LEU 6 61.110 51.596 3.642
46 2HD1 LEU 6 2HD2 LEU 6 61.076 52.928 2.473
47 3HD1 LEU 6 3HD2 LEU 6 62.609 52.442 3.225
48 1HD2 LEU 6 1HD1 LEU 6 62.977 54.775 3.858
49 2HD2 LEU 6 2HD1 LEU 6 61.404 55.284 3.206
50 3HD2 LEU 6 3HD1 LEU 6 61.824 55.636 4.898
51 H LYS 7 H LYS 7 61.233 51.322 6.448
52 HA LYS 7 HA LYS 7 60.788 49.152 4.773
53 1HB LYS 7 2HB LYS 7 62.813 49.903 6.303
54 2HB LYS 7 1HB LYS 7 62.025 48.883 7.517
55 1HG LYS 7 1HG LYS 7 63.577 47.454 6.438
56 2HG LYS 7 2HG LYS 7 61.997 47.041 5.749
57 1HD LYS 7 1HD LYS 7 63.416 47.188 3.870
58 2HD LYS 7 2HD LYS 7 62.553 48.736 3.879
59 1HE LYS 7 1HE LYS 7 64.892 49.116 3.388
60 2HE LYS 7 2HE LYS 7 64.547 49.790 4.988
61 1HZ LYS 7 1HZ LYS 7 65.499 47.817 5.943
62 2HZ LYS 7 2HZ LYS 7 66.579 48.547 4.935
63 3HZ LYS 7 3HZ LYS 7 65.790 47.184 4.448
64 H GLN 8 H GLN 8 59.826 49.654 8.187
65 HA GLN 8 HA GLN 8 58.745 47.213 8.844
66 1HB GLN 8 1HB GLN 8 59.112 49.168 10.311
67 2HB GLN 8 2HB GLN 8 57.715 49.986 9.602
68 1HG GLN 8 2HG GLN 8 57.592 47.292 11.006
69 2HG GLN 8 1HG GLN 8 57.341 48.848 11.816
70 1HE2 GLN 8 2HE2 GLN 8 55.632 46.311 10.699
71 2HE2 GLN 8 1HE2 GLN 8 54.160 47.114 10.197
72 H PHE 9 H PHE 9 56.986 49.995 7.386
73 HA PHE 9 HA PHE 9 54.516 48.598 7.077
74 1HB PHE 9 2HB PHE 9 55.609 51.055 5.666
75 2HB PHE 9 1HB PHE 9 53.929 50.509 5.617
76 HD1 PHE 9 HD1 PHE 9 56.375 52.421 7.458
77 HD2 PHE 9 HD2 PHE 9 52.622 50.347 7.815
78 HE1 PHE 9 HE1 PHE 9 55.927 53.598 9.595
79 HE2 PHE 9 HE2 PHE 9 52.167 51.541 9.942
80 HZ PHE 9 HZ PHE 9 53.823 53.159 10.838
81 H ALA 10 H ALA 10 57.267 49.191 4.841
82 HA ALA 10 HA ALA 10 56.074 48.026 2.535
83 1HB ALA 10 1HB ALA 10 58.065 49.481 2.481
84 2HB ALA 10 2HB ALA 10 59.009 48.232 3.324
85 3HB ALA 10 3HB ALA 10 58.379 47.920 1.692
86 H LYS 11 H LYS 11 57.971 46.624 5.234
87 HA LYS 11 HA LYS 11 57.978 43.927 4.160
88 1HB LYS 11 1HB LYS 11 58.426 45.083 6.937
89 2HB LYS 11 2HB LYS 11 58.529 43.351 6.555
90 1HG LYS 11 2HG LYS 11 60.322 43.730 4.959
91 2HG LYS 11 1HG LYS 11 60.164 45.484 5.125
92 1HD LYS 11 1HD LYS 11 62.077 44.730 6.399
93 2HD LYS 11 2HD LYS 11 60.831 45.323 7.514
94 1HE LYS 11 1HE LYS 11 60.156 43.007 8.020
95 2HE LYS 11 2HE LYS 11 61.310 42.391 6.817
96 1HZ LYS 11 1HZ LYS 11 63.066 43.320 8.129
97 2HZ LYS 11 2HZ LYS 11 61.992 43.896 9.240
98 3HZ LYS 11 3HZ LYS 11 62.166 42.270 9.029
99 H GLY 12 H GLY 12 55.705 45.911 6.016
100 1HA GLY 12 1HA GLY 12 53.957 43.660 6.620
101 2HA GLY 12 2HA GLY 12 53.579 45.397 6.821
102 H VAL 13 H VAL 13 54.413 45.934 3.949
103 HA VAL 13 HA VAL 13 52.236 44.565 2.504
104 HB VAL 13 HB VAL 13 54.228 46.686 1.591
105 1HG1 VAL 13 1HG2 VAL 13 52.525 47.124 -0.194
106 2HG1 VAL 13 2HG2 VAL 13 53.230 45.513 -0.341
107 3HG1 VAL 13 3HG2 VAL 13 51.611 45.706 0.371
108 1HG2 VAL 13 1HG1 VAL 13 52.325 48.288 1.811
109 2HG2 VAL 13 2HG1 VAL 13 52.777 47.604 3.377
110 3HG2 VAL 13 3HG1 VAL 13 51.339 46.996 2.529
111 H GLY 14 H GLY 14 54.101 43.036 3.676
112 1HA GLY 14 1HA GLY 14 55.156 41.555 1.345
113 2HA GLY 14 2HA GLY 14 56.240 41.871 2.722
114 H LYS 15 H LYS 15 54.083 41.884 4.695
115 HA LYS 15 HA LYS 15 53.697 39.017 5.159
116 1HB LYS 15 2HB LYS 15 52.701 41.489 6.604
117 2HB LYS 15 1HB LYS 15 52.537 39.813 7.172
118 1HG LYS 15 1HG LYS 15 54.999 39.592 7.314
119 2HG LYS 15 2HG LYS 15 55.193 41.185 6.569
120 1HD LYS 15 2HD LYS 15 55.507 41.772 8.710
121 2HD LYS 15 1HD LYS 15 53.765 42.049 8.603
122 1HE LYS 15 2HE LYS 15 55.135 39.559 9.737
123 2HE LYS 15 1HE LYS 15 54.418 40.873 10.686
124 1HZ LYS 15 1HZ LYS 15 52.930 39.067 10.537
125 2HZ LYS 15 2HZ LYS 15 52.303 40.335 9.689
126 3HZ LYS 15 3HZ LYS 15 52.982 39.058 8.892
127 H ASP 16 H ASP 16 51.862 41.896 4.141
128 HA ASP 16 HA ASP 16 49.276 40.653 3.985
129 1HB ASP 16 1HB ASP 16 49.685 43.110 4.085
130 2HB ASP 16 2HB ASP 16 50.451 43.029 2.489
131 HD2 ASP 16 HD2 ASP 16 46.418 42.460 2.779
132 H LEU 17 H LEU 17 52.175 40.531 2.058
133 HA LEU 17 HA LEU 17 50.796 39.608 -0.394
134 1HB LEU 17 2HB LEU 17 53.724 40.122 0.269
135 2HB LEU 17 1HB LEU 17 53.114 39.556 -1.282
136 HG LEU 17 HG LEU 17 52.510 42.242 0.053
137 1HD1 LEU 17 1HD2 LEU 17 53.787 43.169 -1.835
138 2HD1 LEU 17 2HD2 LEU 17 54.782 42.007 -0.933
139 3HD1 LEU 17 3HD2 LEU 17 54.051 41.534 -2.481
140 1HD2 LEU 17 1HD1 LEU 17 51.411 42.809 -2.132
141 2HD2 LEU 17 2HD1 LEU 17 51.535 41.100 -2.603
142 3HD2 LEU 17 3HD1 LEU 17 50.528 41.581 -1.215
143 H VAL 18 H VAL 18 53.128 38.568 2.139
144 HA VAL 18 HA VAL 18 53.234 35.857 1.127
145 HB VAL 18 HB VAL 18 53.994 37.149 3.771
146 1HG1 VAL 18 1HG2 VAL 18 54.272 34.227 2.946
147 2HG1 VAL 18 2HG2 VAL 18 53.332 34.856 4.320
148 3HG1 VAL 18 3HG2 VAL 18 55.098 34.980 4.328
149 1HG2 VAL 18 1HG1 VAL 18 55.631 35.819 1.561
150 2HG2 VAL 18 2HG1 VAL 18 56.272 36.646 2.997
151 3HG2 VAL 18 3HG1 VAL 18 55.427 37.571 1.740
152 H LYS 19 H LYS 19 51.089 37.773 3.120
153 HA LYS 19 HA LYS 19 49.571 35.549 4.235
154 1HB LYS 19 2HB LYS 19 49.705 37.731 5.332
155 2HB LYS 19 1HB LYS 19 48.905 38.494 3.940
156 1HG LYS 19 2HG LYS 19 46.894 37.141 4.308
157 2HG LYS 19 1HG LYS 19 47.699 36.250 5.621
158 1HD LYS 19 1HD LYS 19 47.947 38.337 6.901
159 2HD LYS 19 2HD LYS 19 47.153 39.246 5.596
160 1HE LYS 19 2HE LYS 19 45.885 36.982 7.205
161 2HE LYS 19 1HE LYS 19 45.599 38.713 7.468
162 1HZ LYS 19 1HZ LYS 19 44.967 37.228 5.019
163 2HZ LYS 19 2HZ LYS 19 43.888 37.750 6.150
164 3HZ LYS 19 3HZ LYS 19 44.730 38.844 5.249
165 H GLY 20 H GLY 20 49.441 37.686 1.401
166 1HA GLY 20 1HA GLY 20 46.780 36.978 0.547
167 2HA GLY 20 2HA GLY 20 48.013 37.864 -0.373
168 H ALA 21 H ALA 21 50.119 36.107 -0.457
169 HA ALA 21 HA ALA 21 49.433 34.142 -2.398
170 1HB ALA 21 1HB ALA 21 51.697 35.096 -2.147
171 2HB ALA 21 2HB ALA 21 51.844 34.339 -0.544
172 3HB ALA 21 3HB ALA 21 51.732 33.325 -2.001
173 H ALA 22 H ALA 22 49.643 34.127 1.133
174 HA ALA 22 HA ALA 22 49.292 31.228 1.308
175 1HB ALA 22 1HB ALA 22 49.334 31.604 3.723
176 2HB ALA 22 2HB ALA 22 49.290 33.361 3.466
177 3HB ALA 22 3HB ALA 22 50.695 32.416 2.921
178 H GLN 23 H GLN 23 47.160 33.983 1.016
179 HA GLN 23 HA GLN 23 45.013 32.936 2.621
180 1HB GLN 23 2HB GLN 23 45.417 35.339 2.222
181 2HB GLN 23 1HB GLN 23 45.040 35.118 0.500
182 1HG GLN 23 1HG GLN 23 42.769 34.375 1.078
183 2HG GLN 23 2HG GLN 23 43.146 34.508 2.808
184 1HE2 GLN 23 1HE2 GLN 23 43.989 36.757 3.504
185 2HE2 GLN 23 2HE2 GLN 23 43.160 38.137 2.816
186 H GLY 24 H GLY 24 45.826 32.958 -0.865
187 1HA GLY 24 2HA GLY 24 43.669 30.956 -1.379
188 2HA GLY 24 1HA GLY 24 43.935 32.351 -2.450
189 H VAL 25 H VAL 25 45.644 29.626 -0.876
190 HA VAL 25 HA VAL 25 48.074 30.026 -2.105
191 HB VAL 25 HB VAL 25 46.941 27.338 -1.188
192 1HG1 VAL 25 1HG1 VAL 25 49.311 26.896 -0.626
193 2HG1 VAL 25 2HG1 VAL 25 49.115 27.223 -2.363
194 3HG1 VAL 25 3HG1 VAL 25 49.762 28.485 -1.286
195 1HG2 VAL 25 1HG2 VAL 25 48.250 29.565 0.415
196 2HG2 VAL 25 2HG2 VAL 25 47.948 27.924 1.020
197 3HG2 VAL 25 3HG2 VAL 25 46.584 28.974 0.614
198 H LEU 26 H LEU 26 45.507 27.689 -3.034
199 HA LEU 26 HA LEU 26 46.859 26.654 -5.317
200 1HB LEU 26 1HB LEU 26 43.900 26.715 -4.643
201 2HB LEU 26 2HB LEU 26 44.672 25.659 -5.836
202 HG LEU 26 HG LEU 26 45.208 25.632 -2.828
203 1HD1 LEU 26 1HD1 LEU 26 42.973 24.793 -3.452
204 2HD1 LEU 26 2HD1 LEU 26 43.713 23.686 -4.631
205 3HD1 LEU 26 3HD1 LEU 26 44.026 23.475 -2.893
206 1HD2 LEU 26 1HD2 LEU 26 46.414 23.505 -3.343
207 2HD2 LEU 26 2HD2 LEU 26 47.213 24.916 -4.052
208 3HD2 LEU 26 3HD2 LEU 26 46.232 23.842 -5.078
209 H SER 27 H SER 27 44.469 29.308 -4.924
210 HA SER 27 HA SER 27 44.013 29.642 -7.716
211 1HB SER 27 2HB SER 27 42.947 31.743 -7.074
212 2HB SER 27 1HB SER 27 42.455 30.422 -5.994
213 HG SER 27 HG SER 27 43.007 32.334 -4.865
214 H THR 28 H THR 28 46.304 31.203 -5.444
215 HA THR 28 HA THR 28 47.265 33.247 -7.092
216 HB THR 28 HB THR 28 48.676 31.611 -4.951
217 HG1 THR 28 HG1 THR 28 46.798 32.796 -4.346
218 1HG2 THR 28 1HG2 THR 28 50.377 32.770 -6.282
219 2HG2 THR 28 2HG2 THR 28 49.426 34.273 -6.236
220 3HG2 THR 28 3HG2 THR 28 50.151 33.626 -4.749
221 H VAL 29 H VAL 29 47.957 29.770 -7.205
222 HA VAL 29 HA VAL 29 50.290 29.903 -8.814
223 HB VAL 29 HB VAL 29 48.126 27.765 -8.655
224 1HG1 VAL 29 1HG1 VAL 29 49.570 27.475 -10.614
225 2HG1 VAL 29 2HG1 VAL 29 49.950 26.256 -9.381
226 3HG1 VAL 29 3HG1 VAL 29 51.018 27.665 -9.592
227 1HG2 VAL 29 1HG2 VAL 29 49.674 26.687 -7.033
228 2HG2 VAL 29 2HG2 VAL 29 49.089 28.245 -6.427
229 3HG2 VAL 29 3HG2 VAL 29 50.730 28.115 -7.101
230 H SER 30 H SER 30 46.788 29.863 -9.585
231 HA SER 30 HA SER 30 47.258 29.893 -12.451
232 1HB SER 30 1HB SER 30 45.229 28.883 -11.462
233 2HB SER 30 2HB SER 30 44.746 30.464 -10.814
234 HG SER 30 HG SER 30 44.695 31.225 -12.976
235 H CYS 31 H CYS 31 45.803 32.306 -10.202
236 HA CYS 31 HA CYS 31 46.252 34.439 -12.136
237 1HB CYS 31 1HB CYS 31 45.335 35.885 -10.320
238 2HB CYS 31 2HB CYS 31 44.289 34.589 -10.888
239 H LYS 32 H LYS 32 48.681 32.963 -11.197
240 HA LYS 32 HA LYS 32 50.130 35.052 -9.699
241 1HB LYS 32 1HB LYS 32 51.701 33.617 -9.253
242 2HB LYS 32 2HB LYS 32 50.334 32.490 -9.414
243 1HG LYS 32 2HG LYS 32 51.065 32.127 -11.822
244 2HG LYS 32 1HG LYS 32 52.465 33.165 -11.490
245 1HD LYS 32 2HD LYS 32 51.893 30.431 -10.322
246 2HD LYS 32 1HD LYS 32 53.206 31.044 -11.338
247 1HE LYS 32 1HE LYS 32 54.209 30.851 -9.245
248 2HE LYS 32 2HE LYS 32 53.836 32.578 -9.366
249 1HZ LYS 32 1HZ LYS 32 53.242 31.640 -7.248
250 2HZ LYS 32 2HZ LYS 32 51.873 32.123 -8.025
251 3HZ LYS 32 3HZ LYS 32 52.261 30.524 -7.960
252 H LEU 33 H LEU 33 49.619 33.983 -13.000
253 HA LEU 33 HA LEU 33 52.017 34.940 -14.135
254 1HB LEU 33 2HB LEU 33 50.782 34.768 -16.291
255 2HB LEU 33 1HB LEU 33 50.756 33.330 -15.270
256 HG LEU 33 HG LEU 33 48.448 33.825 -14.550
257 1HD1 LEU 33 1HD2 LEU 33 47.144 35.518 -15.882
258 2HD1 LEU 33 2HD2 LEU 33 48.283 36.240 -14.743
259 3HD1 LEU 33 3HD2 LEU 33 48.683 36.175 -16.480
260 1HD2 LEU 33 1HD1 LEU 33 47.398 33.293 -16.702
261 2HD2 LEU 33 2HD1 LEU 33 48.917 32.397 -16.503
262 3HD2 LEU 33 3HD1 LEU 33 48.861 33.824 -17.563
263 H ALA 34 H ALA 34 49.862 36.862 -12.583
264 HA ALA 34 HA ALA 34 50.892 39.237 -14.003
265 1HB ALA 34 1HB ALA 34 47.944 38.771 -13.397
266 2HB ALA 34 2HB ALA 34 48.685 38.817 -15.012
267 3HB ALA 34 3HB ALA 34 48.655 40.283 -14.011
268 H LYS 35 H LYS 35 50.619 37.524 -11.209
269 HA LYS 35 HA LYS 35 50.595 37.929 -9.010
270 1HB LYS 35 1HB LYS 35 52.134 40.393 -9.901
271 2HB LYS 35 2HB LYS 35 52.168 39.655 -8.294
272 1HG LYS 35 2HG LYS 35 53.106 38.365 -10.891
273 2HG LYS 35 1HG LYS 35 54.138 39.015 -9.618
274 1HD LYS 35 2HD LYS 35 52.276 36.606 -9.384
275 2HD LYS 35 1HD LYS 35 54.039 36.586 -9.480
276 1HE LYS 35 2HE LYS 35 52.386 37.752 -7.199
277 2HE LYS 35 1HE LYS 35 53.314 36.246 -7.182
278 1HZ LYS 35 1HZ LYS 35 54.512 38.009 -6.157
279 2HZ LYS 35 2HZ LYS 35 55.297 37.521 -7.523
280 3HZ LYS 35 3HZ LYS 35 54.440 38.931 -7.521
281 H THR 36 H THR 36 48.229 38.891 -10.356
282 HA THR 36 HA THR 36 47.284 41.214 -8.874
283 HB THR 36 HB THR 36 45.052 40.321 -9.562
284 HG1 THR 36 HG1 THR 36 45.085 38.512 -10.965
285 1HG2 THR 36 1HG2 THR 36 47.116 40.441 -11.806
286 2HG2 THR 36 2HG2 THR 36 46.312 41.837 -11.054
287 3HG2 THR 36 3HG2 THR 36 45.362 40.656 -11.981
288 H CYS 37 H CYS 37 47.782 37.782 -8.373
289 HA CYS 37 HA CYS 37 46.365 37.810 -5.754
290 1HB CYS 37 1HB CYS 37 47.331 35.608 -7.597
291 2HB CYS 37 2HB CYS 37 46.655 35.328 -5.989
292 HXT CYS 37 HO OH 38 50.345 36.925 -5.934
Start of MODEL 3
1 1H GLY 1 1H GLY 1 67.664 57.733 16.040
2 2H GLY 1 2H GLY 1 67.476 58.669 14.696
3 3H GLY 1 3H GLY 1 68.962 58.523 15.397
4 1HA GLY 1 2HA GLY 1 68.868 57.217 13.415
5 2HA GLY 1 1HA GLY 1 69.071 56.214 14.863
6 H ILE 2 H ILE 2 66.452 57.674 12.874
7 HA ILE 2 HA ILE 2 64.623 55.483 13.522
8 HB ILE 2 HB ILE 2 63.109 56.837 11.979
9 1HG1 ILE 2 1HG1 ILE 2 63.608 59.191 11.678
10 2HG1 ILE 2 2HG1 ILE 2 65.216 59.009 12.375
11 1HG2 ILE 2 1HG2 ILE 2 62.989 56.854 14.430
12 2HG2 ILE 2 2HG2 ILE 2 64.228 58.128 14.492
13 3HG2 ILE 2 3HG2 ILE 2 62.642 58.461 13.763
14 1HD1 ILE 2 1HD1 ILE 2 65.888 57.588 10.460
15 2HD1 ILE 2 2HD1 ILE 2 64.233 57.701 9.800
16 3HD1 ILE 2 3HD1 ILE 2 65.255 59.146 9.907
17 H LEU 3 H LEU 3 66.984 54.647 12.238
18 HA LEU 3 HA LEU 3 66.502 54.351 9.395
19 1HB LEU 3 2HB LEU 3 68.588 53.155 11.264
20 2HB LEU 3 1HB LEU 3 68.645 53.122 9.498
21 HG LEU 3 HG LEU 3 68.717 55.637 11.234
22 1HD1 LEU 3 1HD2 LEU 3 71.065 55.774 10.512
23 2HD1 LEU 3 2HD2 LEU 3 70.759 54.264 11.396
24 3HD1 LEU 3 3HD2 LEU 3 70.892 54.243 9.623
25 1HD2 LEU 3 1HD1 LEU 3 69.353 56.765 9.097
26 2HD2 LEU 3 2HD1 LEU 3 69.004 55.260 8.219
27 3HD2 LEU 3 3HD1 LEU 3 67.699 56.138 9.054
28 H ASP 4 H ASP 4 66.066 52.374 12.298
29 HA ASP 4 HA ASP 4 65.385 49.979 10.693
30 1HB ASP 4 1HB ASP 4 66.838 49.745 12.700
31 2HB ASP 4 2HB ASP 4 65.556 50.451 13.698
32 HD2 ASP 4 HD2 ASP 4 65.023 46.716 12.129
33 H THR 5 H THR 5 64.117 52.823 12.197
34 HA THR 5 HA THR 5 61.648 51.769 13.062
35 HB THR 5 HB THR 5 62.424 54.627 12.373
36 HG1 THR 5 HG1 THR 5 62.763 54.691 14.641
37 1HG2 THR 5 1HG2 THR 5 60.139 53.526 14.066
38 2HG2 THR 5 2HG2 THR 5 59.970 54.376 12.511
39 3HG2 THR 5 3HG2 THR 5 60.591 55.239 13.931
40 H LEU 6 H LEU 6 62.533 53.755 10.177
41 HA LEU 6 HA LEU 6 60.016 53.598 8.891
42 1HB LEU 6 2HB LEU 6 61.189 54.367 6.919
43 2HB LEU 6 1HB LEU 6 61.739 55.223 8.362
44 HG LEU 6 HG LEU 6 63.641 53.308 8.318
45 1HD1 LEU 6 1HD2 LEU 6 64.345 52.878 5.995
46 2HD1 LEU 6 2HD2 LEU 6 62.721 52.211 6.232
47 3HD1 LEU 6 3HD2 LEU 6 62.927 53.750 5.378
48 1HD2 LEU 6 1HD1 LEU 6 65.060 54.932 7.121
49 2HD2 LEU 6 2HD1 LEU 6 63.608 55.804 6.576
50 3HD2 LEU 6 3HD1 LEU 6 64.013 55.738 8.306
51 H LYS 7 H LYS 7 62.799 51.369 8.948
52 HA LYS 7 HA LYS 7 62.006 49.657 6.849
53 1HB LYS 7 2HB LYS 7 64.234 49.783 7.837
54 2HB LYS 7 1HB LYS 7 63.614 49.116 9.361
55 1HG LYS 7 2HG LYS 7 62.991 47.032 8.242
56 2HG LYS 7 1HG LYS 7 63.463 47.709 6.661
57 1HD LYS 7 1HD LYS 7 65.769 47.988 7.451
58 2HD LYS 7 2HD LYS 7 65.310 47.367 9.054
59 1HE LYS 7 2HE LYS 7 64.675 45.194 8.027
60 2HE LYS 7 1HE LYS 7 65.138 45.814 6.428
61 1HZ LYS 7 1HZ LYS 7 66.932 45.485 8.726
62 2HZ LYS 7 2HZ LYS 7 67.364 46.060 7.242
63 3HZ LYS 7 3HZ LYS 7 66.858 44.499 7.406
64 H GLN 8 H GLN 8 61.292 49.660 10.373
65 HA GLN 8 HA GLN 8 60.010 47.188 10.563
66 1HB GLN 8 1HB GLN 8 60.772 48.639 12.415
67 2HB GLN 8 2HB GLN 8 59.432 49.752 12.116
68 1HG GLN 8 2HG GLN 8 59.091 46.800 12.773
69 2HG GLN 8 1HG GLN 8 59.117 48.090 13.989
70 1HE2 GLN 8 1HE2 GLN 8 57.016 46.154 12.374
71 2HE2 GLN 8 2HE2 GLN 8 55.616 47.203 12.317
72 H PHE 9 H PHE 9 58.500 50.434 10.105
73 HA PHE 9 HA PHE 9 55.873 49.360 9.646
74 1HB PHE 9 2HB PHE 9 57.095 52.073 9.021
75 2HB PHE 9 1HB PHE 9 55.375 51.687 8.901
76 HD1 PHE 9 HD1 PHE 9 57.945 52.889 11.077
77 HD2 PHE 9 HD2 PHE 9 54.196 50.776 11.029
78 HE1 PHE 9 HE1 PHE 9 57.637 53.376 13.488
79 HE2 PHE 9 HE2 PHE 9 53.883 51.281 13.436
80 HZ PHE 9 HZ PHE 9 55.608 52.572 14.670
81 H ALA 10 H ALA 10 58.610 50.123 7.495
82 HA ALA 10 HA ALA 10 57.091 49.918 5.068
83 1HB ALA 10 1HB ALA 10 59.318 50.972 5.153
84 2HB ALA 10 2HB ALA 10 59.293 49.624 3.996
85 3HB ALA 10 3HB ALA 10 60.051 49.410 5.588
86 H LYS 11 H LYS 11 58.966 47.597 7.063
87 HA LYS 11 HA LYS 11 57.938 45.284 5.535
88 1HB LYS 11 1HB LYS 11 59.638 45.487 8.054
89 2HB LYS 11 2HB LYS 11 59.189 43.983 7.221
90 1HG LYS 11 1HG LYS 11 60.366 44.723 5.187
91 2HG LYS 11 2HG LYS 11 60.755 46.273 5.952
92 1HD LYS 11 2HD LYS 11 62.700 44.881 6.061
93 2HD LYS 11 1HD LYS 11 62.058 45.067 7.704
94 1HE LYS 11 1HE LYS 11 61.037 42.825 7.575
95 2HE LYS 11 2HE LYS 11 61.568 42.667 5.886
96 1HZ LYS 11 1HZ LYS 11 63.028 41.554 7.393
97 2HZ LYS 11 2HZ LYS 11 63.322 42.951 8.219
98 3HZ LYS 11 3HZ LYS 11 63.818 42.799 6.654
99 H GLY 12 H GLY 12 55.865 46.734 6.203
100 1HA GLY 12 2HA GLY 12 54.397 45.344 8.377
101 2HA GLY 12 1HA GLY 12 54.825 47.066 8.488
102 H VAL 13 H VAL 13 54.430 48.421 6.466
103 HA VAL 13 HA VAL 13 51.798 47.959 5.299
104 HB VAL 13 HB VAL 13 53.243 50.175 5.627
105 1HG1 VAL 13 1HG2 VAL 13 54.540 50.858 3.754
106 2HG1 VAL 13 2HG2 VAL 13 55.166 49.290 4.301
107 3HG1 VAL 13 3HG2 VAL 13 54.156 49.389 2.842
108 1HG2 VAL 13 1HG1 VAL 13 52.019 51.203 3.733
109 2HG2 VAL 13 2HG1 VAL 13 50.977 50.082 4.634
110 3HG2 VAL 13 3HG1 VAL 13 51.673 49.589 3.073
111 H GLY 14 H GLY 14 54.558 46.275 5.433
112 1HA GLY 14 2HA GLY 14 54.713 45.455 2.577
113 2HA GLY 14 1HA GLY 14 56.029 45.347 3.759
114 H LYS 15 H LYS 15 53.867 44.713 5.877
115 HA LYS 15 HA LYS 15 53.518 41.817 5.373
116 1HB LYS 15 2HB LYS 15 52.951 43.540 7.795
117 2HB LYS 15 1HB LYS 15 52.723 41.784 7.688
118 1HG LYS 15 1HG LYS 15 55.389 43.227 7.359
119 2HG LYS 15 2HG LYS 15 54.842 42.378 8.817
120 1HD LYS 15 1HD LYS 15 54.700 40.258 7.514
121 2HD LYS 15 2HD LYS 15 55.256 41.127 6.068
122 1HE LYS 15 2HE LYS 15 57.131 39.955 7.064
123 2HE LYS 15 1HE LYS 15 57.373 41.703 7.236
124 1HZ LYS 15 1HZ LYS 15 56.608 41.517 9.489
125 2HZ LYS 15 2HZ LYS 15 57.886 40.508 9.235
126 3HZ LYS 15 3HZ LYS 15 56.357 39.896 9.317
127 H ASP 16 H ASP 16 51.873 44.892 5.232
128 HA ASP 16 HA ASP 16 49.180 43.781 5.070
129 1HB ASP 16 1HB ASP 16 49.642 46.114 5.762
130 2HB ASP 16 2HB ASP 16 50.347 46.445 4.169
131 HD2 ASP 16 HD2 ASP 16 49.001 46.423 2.391
132 H LEU 17 H LEU 17 51.990 44.280 2.996
133 HA LEU 17 HA LEU 17 50.477 43.806 0.501
134 1HB LEU 17 1HB LEU 17 53.368 44.505 1.113
135 2HB LEU 17 2HB LEU 17 52.751 44.171 -0.500
136 HG LEU 17 HG LEU 17 51.662 46.418 1.242
137 1HD1 LEU 17 1HD1 LEU 17 53.670 46.513 -1.052
138 2HD1 LEU 17 2HD1 LEU 17 52.977 47.919 -0.213
139 3HD1 LEU 17 3HD1 LEU 17 54.043 46.801 0.662
140 1HD2 LEU 17 1HD2 LEU 17 50.760 47.238 -0.932
141 2HD2 LEU 17 2HD2 LEU 17 51.332 45.750 -1.715
142 3HD2 LEU 17 3HD2 LEU 17 50.063 45.679 -0.470
143 H VAL 18 H VAL 18 53.083 42.499 2.660
144 HA VAL 18 HA VAL 18 53.292 40.119 0.988
145 HB VAL 18 HB VAL 18 54.300 40.795 3.748
146 1HG1 VAL 18 1HG1 VAL 18 54.425 38.109 2.360
147 2HG1 VAL 18 2HG1 VAL 18 55.419 38.598 3.756
148 3HG1 VAL 18 3HG1 VAL 18 53.659 38.476 3.930
149 1HG2 VAL 18 1HG2 VAL 18 56.463 40.502 2.643
150 2HG2 VAL 18 2HG2 VAL 18 55.667 39.926 1.163
151 3HG2 VAL 18 3HG2 VAL 18 55.486 41.617 1.664
152 H LYS 19 H LYS 19 51.199 41.281 3.535
153 HA LYS 19 HA LYS 19 49.905 38.766 4.153
154 1HB LYS 19 2HB LYS 19 49.849 40.707 5.636
155 2HB LYS 19 1HB LYS 19 48.975 41.655 4.422
156 1HG LYS 19 2HG LYS 19 47.900 39.042 5.565
157 2HG LYS 19 1HG LYS 19 47.607 40.622 6.314
158 1HD LYS 19 1HD LYS 19 46.569 41.448 4.224
159 2HD LYS 19 2HD LYS 19 46.775 39.842 3.492
160 1HE LYS 19 2HE LYS 19 45.376 38.843 5.265
161 2HE LYS 19 1HE LYS 19 45.196 40.435 6.030
162 1HZ LYS 19 1HZ LYS 19 44.102 41.196 4.057
163 2HZ LYS 19 2HZ LYS 19 44.266 39.718 3.343
164 3HZ LYS 19 3HZ LYS 19 43.320 39.885 4.684
165 H GLY 20 H GLY 20 49.467 41.401 1.817
166 1HA GLY 20 2HA GLY 20 46.964 40.480 0.705
167 2HA GLY 20 1HA GLY 20 48.062 41.707 0.038
168 H ALA 21 H ALA 21 50.447 40.199 -0.141
169 HA ALA 21 HA ALA 21 50.066 38.593 -2.491
170 1HB ALA 21 1HB ALA 21 52.179 39.781 -1.954
171 2HB ALA 21 2HB ALA 21 52.410 38.707 -0.553
172 3HB ALA 21 3HB ALA 21 52.433 38.038 -2.198
173 H ALA 22 H ALA 22 50.107 37.983 0.992
174 HA ALA 22 HA ALA 22 50.099 35.069 0.591
175 1HB ALA 22 1HB ALA 22 50.207 34.950 3.025
176 2HB ALA 22 2HB ALA 22 51.459 36.038 2.396
177 3HB ALA 22 3HB ALA 22 49.990 36.710 3.141
178 H GLN 23 H GLN 23 47.881 36.515 -0.562
179 HA GLN 23 HA GLN 23 45.591 35.994 1.216
180 1HB GLN 23 2HB GLN 23 45.621 38.047 -0.084
181 2HB GLN 23 1HB GLN 23 45.807 37.135 -1.597
182 1HG GLN 23 1HG GLN 23 43.610 36.070 -1.233
183 2HG GLN 23 2HG GLN 23 43.466 36.889 0.336
184 1HE2 GLN 23 1HE2 GLN 23 44.054 37.641 -3.153
185 2HE2 GLN 23 2HE2 GLN 23 43.081 39.096 -3.177
186 H GLY 24 H GLY 24 46.599 35.074 -2.149
187 1HA GLY 24 1HA GLY 24 46.153 32.280 -1.730
188 2HA GLY 24 2HA GLY 24 44.769 33.019 -2.573
189 H VAL 25 H VAL 25 48.345 33.415 -2.605
190 HA VAL 25 HA VAL 25 48.289 33.922 -5.463
191 HB VAL 25 HB VAL 25 49.619 35.245 -3.892
192 1HG1 VAL 25 1HG1 VAL 25 50.380 33.412 -2.373
193 2HG1 VAL 25 2HG1 VAL 25 51.474 32.847 -3.661
194 3HG1 VAL 25 3HG1 VAL 25 51.694 34.454 -2.952
195 1HG2 VAL 25 1HG2 VAL 25 50.191 35.135 -6.296
196 2HG2 VAL 25 2HG2 VAL 25 51.636 35.365 -5.290
197 3HG2 VAL 25 3HG2 VAL 25 51.280 33.766 -5.976
198 H LEU 26 H LEU 26 49.576 31.467 -3.233
199 HA LEU 26 HA LEU 26 50.999 29.857 -5.032
200 1HB LEU 26 2HB LEU 26 49.383 29.034 -2.590
201 2HB LEU 26 1HB LEU 26 50.659 28.078 -3.356
202 HG LEU 26 HG LEU 26 51.046 30.797 -2.021
203 1HD1 LEU 26 1HD2 LEU 26 51.829 27.988 -1.146
204 2HD1 LEU 26 2HD2 LEU 26 52.223 29.499 -0.295
205 3HD1 LEU 26 3HD2 LEU 26 50.531 28.977 -0.438
206 1HD2 LEU 26 1HD1 LEU 26 52.697 30.478 -3.816
207 2HD2 LEU 26 2HD1 LEU 26 53.046 28.834 -3.231
208 3HD2 LEU 26 3HD1 LEU 26 53.472 30.248 -2.242
209 H SER 27 H SER 27 47.508 29.898 -4.267
210 HA SER 27 HA SER 27 46.854 27.570 -5.819
211 1HB SER 27 1HB SER 27 44.538 28.394 -5.548
212 2HB SER 27 2HB SER 27 45.427 28.372 -4.010
213 HG SER 27 HG SER 27 44.272 30.319 -4.332
214 H THR 28 H THR 28 46.798 31.109 -6.470
215 HA THR 28 HA THR 28 45.594 31.058 -8.983
216 HB THR 28 HB THR 28 47.758 32.935 -7.967
217 HG1 THR 28 HG1 THR 28 45.882 32.798 -6.674
218 1HG2 THR 28 1HG2 THR 28 45.724 33.214 -10.224
219 2HG2 THR 28 2HG2 THR 28 46.731 34.531 -9.587
220 3HG2 THR 28 3HG2 THR 28 47.491 33.155 -10.401
221 H VAL 29 H VAL 29 49.052 30.621 -8.145
222 HA VAL 29 HA VAL 29 50.184 30.633 -10.690
223 HB VAL 29 HB VAL 29 50.890 28.956 -8.254
224 1HG1 VAL 29 1HG2 VAL 29 52.507 29.573 -10.764
225 2HG1 VAL 29 2HG2 VAL 29 51.949 27.968 -10.236
226 3HG1 VAL 29 3HG2 VAL 29 53.158 28.840 -9.282
227 1HG2 VAL 29 1HG1 VAL 29 52.586 30.721 -7.896
228 2HG2 VAL 29 2HG1 VAL 29 51.985 31.598 -9.320
229 3HG2 VAL 29 3HG1 VAL 29 50.955 31.414 -7.885
230 H SER 30 H SER 30 48.435 27.987 -9.027
231 HA SER 30 HA SER 30 48.967 26.052 -11.103
232 1HB SER 30 1HB SER 30 48.482 25.401 -8.774
233 2HB SER 30 2HB SER 30 46.863 26.119 -8.891
234 HG SER 30 HG SER 30 46.433 24.630 -10.581
235 H CYS 31 H CYS 31 45.949 27.735 -10.122
236 HA CYS 31 HA CYS 31 44.683 27.094 -12.672
237 1HB CYS 31 1HB CYS 31 42.807 28.458 -11.713
238 2HB CYS 31 2HB CYS 31 43.287 27.026 -10.811
239 H LYS 32 H LYS 32 47.187 28.743 -12.719
240 HA LYS 32 HA LYS 32 46.313 31.366 -13.676
241 1HB LYS 32 2HB LYS 32 48.385 30.740 -12.282
242 2HB LYS 32 1HB LYS 32 49.050 30.055 -13.778
243 1HG LYS 32 1HG LYS 32 48.257 32.921 -13.195
244 2HG LYS 32 2HG LYS 32 49.887 32.237 -13.424
245 1HD LYS 32 1HD LYS 32 49.268 31.667 -15.780
246 2HD LYS 32 2HD LYS 32 47.726 32.511 -15.544
247 1HE LYS 32 2HE LYS 32 48.884 34.607 -15.034
248 2HE LYS 32 1HE LYS 32 50.456 33.799 -15.164
249 1HZ LYS 32 1HZ LYS 32 48.510 34.123 -17.338
250 2HZ LYS 32 2HZ LYS 32 49.973 33.372 -17.463
251 3HZ LYS 32 3HZ LYS 32 49.901 34.989 -17.148
252 H LEU 33 H LEU 33 48.088 28.518 -14.932
253 HA LEU 33 HA LEU 33 48.300 29.172 -17.598
254 1HB LEU 33 1HB LEU 33 49.346 27.218 -16.563
255 2HB LEU 33 2HB LEU 33 47.763 26.456 -16.337
256 HG LEU 33 HG LEU 33 47.460 26.348 -18.803
257 1HD1 LEU 33 1HD1 LEU 33 50.295 27.477 -18.871
258 2HD1 LEU 33 2HD1 LEU 33 48.834 28.257 -19.524
259 3HD1 LEU 33 3HD1 LEU 33 49.444 26.767 -20.260
260 1HD2 LEU 33 1HD2 LEU 33 50.080 25.166 -17.798
261 2HD2 LEU 33 2HD2 LEU 33 48.463 24.465 -17.564
262 3HD2 LEU 33 3HD2 LEU 33 49.144 24.597 -19.199
263 H ALA 34 H ALA 34 45.612 27.173 -16.211
264 HA ALA 34 HA ALA 34 43.983 27.458 -18.567
265 1HB ALA 34 1HB ALA 34 42.238 26.394 -17.169
266 2HB ALA 34 2HB ALA 34 43.255 26.624 -15.728
267 3HB ALA 34 3HB ALA 34 43.783 25.527 -17.026
268 H LYS 35 H LYS 35 44.684 29.411 -15.946
269 HA LYS 35 HA LYS 35 44.028 31.395 -15.161
270 1HB LYS 35 1HB LYS 35 44.683 31.696 -17.664
271 2HB LYS 35 2HB LYS 35 42.954 31.969 -17.917
272 1HG LYS 35 2HG LYS 35 43.924 34.116 -17.546
273 2HG LYS 35 1HG LYS 35 43.122 33.709 -16.012
274 1HD LYS 35 2HD LYS 35 45.367 32.875 -15.150
275 2HD LYS 35 1HD LYS 35 46.084 33.438 -16.675
276 1HE LYS 35 2HE LYS 35 44.592 35.207 -14.692
277 2HE LYS 35 1HE LYS 35 46.356 35.057 -14.800
278 1HZ LYS 35 1HZ LYS 35 45.577 36.951 -15.984
279 2HZ LYS 35 2HZ LYS 35 44.597 36.027 -16.935
280 3HZ LYS 35 3HZ LYS 35 46.235 35.865 -17.037
281 H THR 36 H THR 36 42.274 29.750 -14.187
282 HA THR 36 HA THR 36 39.665 31.183 -14.430
283 HB THR 36 HB THR 36 38.781 29.414 -12.979
284 HG1 THR 36 HG1 THR 36 40.128 27.616 -12.565
285 1HG2 THR 36 1HG2 THR 36 40.278 28.283 -15.385
286 2HG2 THR 36 2HG2 THR 36 38.856 27.575 -14.593
287 3HG2 THR 36 3HG2 THR 36 38.713 29.127 -15.444
288 H CYS 37 H CYS 37 42.524 31.892 -13.235
289 HA CYS 37 HA CYS 37 41.455 33.079 -10.737
290 1HB CYS 37 2HB CYS 37 44.009 31.473 -11.035
291 2HB CYS 37 1HB CYS 37 43.579 32.429 -9.613
292 HXT CYS 37 HO OH 38 43.017 34.643 -9.943
Start of MODEL 4
1 1H GLY 1 1H GLY 1 66.424 55.356 13.310
2 2H GLY 1 2H GLY 1 65.663 56.390 12.274
3 3H GLY 1 3H GLY 1 64.782 55.312 13.159
4 1HA GLY 1 2HA GLY 1 66.725 54.627 11.069
5 2HA GLY 1 1HA GLY 1 65.779 53.470 12.024
6 H ILE 2 H ILE 2 65.264 56.422 10.019
7 HA ILE 2 HA ILE 2 62.595 55.897 9.321
8 HB ILE 2 HB ILE 2 64.141 57.983 9.134
9 1HG1 ILE 2 2HG1 ILE 2 61.812 58.130 8.763
10 2HG1 ILE 2 1HG1 ILE 2 62.681 59.060 7.536
11 1HG2 ILE 2 1HG2 ILE 2 64.497 56.896 6.314
12 2HG2 ILE 2 2HG2 ILE 2 64.962 58.500 6.907
13 3HG2 ILE 2 3HG2 ILE 2 65.760 57.057 7.555
14 1HD1 ILE 2 1HD1 ILE 2 62.323 57.121 5.930
15 2HD1 ILE 2 2HD1 ILE 2 61.261 56.399 7.171
16 3HD1 ILE 2 3HD1 ILE 2 60.853 57.962 6.456
17 H LEU 3 H LEU 3 65.672 54.776 7.938
18 HA LEU 3 HA LEU 3 64.560 53.618 5.557
19 1HB LEU 3 1HB LEU 3 67.118 52.987 7.078
20 2HB LEU 3 2HB LEU 3 66.748 52.479 5.424
21 HG LEU 3 HG LEU 3 67.059 55.366 6.373
22 1HD1 LEU 3 1HD1 LEU 3 68.847 53.597 4.657
23 2HD1 LEU 3 2HD1 LEU 3 69.131 55.309 5.047
24 3HD1 LEU 3 3HD1 LEU 3 69.169 54.088 6.336
25 1HD2 LEU 3 1HD2 LEU 3 67.053 55.882 3.926
26 2HD2 LEU 3 2HD2 LEU 3 66.596 54.197 3.591
27 3HD2 LEU 3 3HD2 LEU 3 65.490 55.268 4.485
28 H ASP 4 H ASP 4 64.521 52.599 8.890
29 HA ASP 4 HA ASP 4 64.082 49.759 8.192
30 1HB ASP 4 2HB ASP 4 64.306 51.198 10.871
31 2HB ASP 4 1HB ASP 4 64.129 49.456 10.626
32 HD2 ASP 4 HD2 ASP 4 67.456 49.084 9.365
33 H THR 5 H THR 5 62.560 52.824 8.905
34 HA THR 5 HA THR 5 60.223 51.732 10.067
35 HB THR 5 HB THR 5 60.641 54.448 8.755
36 HG1 THR 5 HG1 THR 5 61.997 54.000 10.538
37 1HG2 THR 5 1HG2 THR 5 58.491 53.456 10.675
38 2HG2 THR 5 2HG2 THR 5 58.242 53.922 8.976
39 3HG2 THR 5 3HG2 THR 5 58.726 55.144 10.168
40 H LEU 6 H LEU 6 60.944 53.086 6.812
41 HA LEU 6 HA LEU 6 58.492 52.282 5.593
42 1HB LEU 6 2HB LEU 6 59.607 52.797 3.500
43 2HB LEU 6 1HB LEU 6 59.903 54.036 4.724
44 HG LEU 6 HG LEU 6 62.135 52.589 5.137
45 1HD1 LEU 6 1HD1 LEU 6 63.041 51.792 2.987
46 2HD1 LEU 6 2HD1 LEU 6 61.577 50.874 3.373
47 3HD1 LEU 6 3HD1 LEU 6 61.510 52.177 2.173
48 1HD2 LEU 6 1HD2 LEU 6 62.040 54.970 4.561
49 2HD2 LEU 6 2HD2 LEU 6 63.265 54.146 3.574
50 3HD2 LEU 6 3HD2 LEU 6 61.691 54.565 2.864
51 H LYS 7 H LYS 7 61.576 50.635 6.203
52 HA LYS 7 HA LYS 7 61.218 48.393 4.537
53 1HB LYS 7 2HB LYS 7 63.310 49.152 5.752
54 2HB LYS 7 1HB LYS 7 62.589 48.533 7.248
55 1HG LYS 7 1HG LYS 7 64.081 46.868 6.365
56 2HG LYS 7 2HG LYS 7 62.420 46.268 6.166
57 1HD LYS 7 1HD LYS 7 62.445 47.027 3.801
58 2HD LYS 7 2HD LYS 7 64.089 47.665 4.026
59 1HE LYS 7 2HE LYS 7 64.898 45.377 4.555
60 2HE LYS 7 1HE LYS 7 63.256 44.744 4.316
61 1HZ LYS 7 1HZ LYS 7 64.610 44.454 2.385
62 2HZ LYS 7 2HZ LYS 7 63.368 45.487 2.054
63 3HZ LYS 7 3HZ LYS 7 64.893 46.075 2.277
64 H GLN 8 H GLN 8 60.303 49.020 7.952
65 HA GLN 8 HA GLN 8 59.136 46.516 8.525
66 1HB GLN 8 1HB GLN 8 59.828 48.302 10.129
67 2HB GLN 8 2HB GLN 8 58.425 49.265 9.651
68 1HG GLN 8 2HG GLN 8 58.317 46.450 10.810
69 2HG GLN 8 1HG GLN 8 58.151 47.939 11.758
70 1HE2 GLN 8 2HE2 GLN 8 56.313 45.518 10.706
71 2HE2 GLN 8 1HE2 GLN 8 54.825 46.359 10.328
72 H PHE 9 H PHE 9 57.685 49.611 7.401
73 HA PHE 9 HA PHE 9 55.020 48.697 7.174
74 1HB PHE 9 1HB PHE 9 55.661 51.056 7.166
75 2HB PHE 9 2HB PHE 9 56.512 50.847 5.633
76 HD1 PHE 9 HD1 PHE 9 55.338 50.893 3.541
77 HD2 PHE 9 HD2 PHE 9 53.147 50.768 7.244
78 HE1 PHE 9 HE1 PHE 9 53.232 51.337 2.311
79 HE2 PHE 9 HE2 PHE 9 51.041 51.211 6.010
80 HZ PHE 9 HZ PHE 9 51.082 51.497 3.543
81 H ALA 10 H ALA 10 57.645 48.879 4.711
82 HA ALA 10 HA ALA 10 56.186 47.740 2.564
83 1HB ALA 10 1HB ALA 10 58.318 48.939 2.293
84 2HB ALA 10 2HB ALA 10 59.169 47.648 3.172
85 3HB ALA 10 3HB ALA 10 58.413 47.305 1.600
86 H LYS 11 H LYS 11 58.160 46.273 5.175
87 HA LYS 11 HA LYS 11 57.859 43.557 4.293
88 1HB LYS 11 2HB LYS 11 59.642 44.353 5.804
89 2HB LYS 11 1HB LYS 11 58.432 44.726 7.048
90 1HG LYS 11 1HG LYS 11 57.804 42.347 7.183
91 2HG LYS 11 2HG LYS 11 58.936 41.959 5.865
92 1HD LYS 11 1HD LYS 11 60.820 42.768 7.247
93 2HD LYS 11 2HD LYS 11 59.690 43.174 8.558
94 1HE LYS 11 2HE LYS 11 59.018 40.795 8.721
95 2HE LYS 11 1HE LYS 11 60.136 40.385 7.403
96 1HZ LYS 11 1HZ LYS 11 60.891 41.522 10.000
97 2HZ LYS 11 2HZ LYS 11 61.930 41.141 8.777
98 3HZ LYS 11 3HZ LYS 11 61.081 39.950 9.539
99 H GLY 12 H GLY 12 55.910 45.775 6.293
100 1HA GLY 12 1HA GLY 12 54.088 43.663 7.126
101 2HA GLY 12 2HA GLY 12 53.894 45.418 7.409
102 H VAL 13 H VAL 13 54.262 45.994 4.471
103 HA VAL 13 HA VAL 13 51.806 44.743 3.368
104 HB VAL 13 HB VAL 13 53.627 46.822 2.106
105 1HG1 VAL 13 1HG1 VAL 13 51.606 47.312 0.710
106 2HG1 VAL 13 2HG1 VAL 13 50.745 45.983 1.512
107 3HG1 VAL 13 3HG1 VAL 13 52.142 45.646 0.472
108 1HG2 VAL 13 1HG2 VAL 13 51.042 47.226 3.680
109 2HG2 VAL 13 2HG2 VAL 13 52.656 47.790 4.163
110 3HG2 VAL 13 3HG2 VAL 13 51.870 48.485 2.739
111 H GLY 14 H GLY 14 53.827 43.145 4.166
112 1HA GLY 14 2HA GLY 14 54.608 41.804 1.644
113 2HA GLY 14 1HA GLY 14 55.847 42.119 2.876
114 H LYS 15 H LYS 15 53.887 41.916 5.091
115 HA LYS 15 HA LYS 15 53.606 38.978 5.327
116 1HB LYS 15 1HB LYS 15 52.999 41.240 7.261
117 2HB LYS 15 2HB LYS 15 52.870 39.505 7.610
118 1HG LYS 15 1HG LYS 15 55.435 40.994 6.893
119 2HG LYS 15 2HG LYS 15 54.959 40.439 8.506
120 1HD LYS 15 1HD LYS 15 54.964 38.089 7.698
121 2HD LYS 15 2HD LYS 15 55.483 38.651 6.092
122 1HE LYS 15 2HE LYS 15 57.523 39.634 7.088
123 2HE LYS 15 1HE LYS 15 57.010 39.077 8.695
124 1HZ LYS 15 1HZ LYS 15 57.596 37.357 6.393
125 2HZ LYS 15 2HZ LYS 15 58.575 37.594 7.699
126 3HZ LYS 15 3HZ LYS 15 57.120 36.839 7.884
127 H ASP 16 H ASP 16 51.730 42.019 5.197
128 HA ASP 16 HA ASP 16 49.118 40.853 5.277
129 1HB ASP 16 1HB ASP 16 49.722 43.259 5.702
130 2HB ASP 16 2HB ASP 16 50.043 43.441 3.972
131 HD2 ASP 16 HD2 ASP 16 48.350 43.391 2.569
132 H LEU 17 H LEU 17 51.626 40.836 2.905
133 HA LEU 17 HA LEU 17 49.871 40.525 0.574
134 1HB LEU 17 2HB LEU 17 51.953 41.866 0.383
135 2HB LEU 17 1HB LEU 17 52.874 40.486 1.029
136 HG LEU 17 HG LEU 17 52.303 39.125 -0.879
137 1HD1 LEU 17 1HD2 LEU 17 50.934 41.640 -1.947
138 2HD1 LEU 17 2HD2 LEU 17 51.288 40.192 -2.915
139 3HD1 LEU 17 3HD2 LEU 17 50.142 40.092 -1.569
140 1HD2 LEU 17 1HD1 LEU 17 54.358 40.485 -0.895
141 2HD2 LEU 17 2HD1 LEU 17 53.701 40.318 -2.537
142 3HD2 LEU 17 3HD1 LEU 17 53.470 41.835 -1.638
143 H VAL 18 H VAL 18 52.229 38.835 2.689
144 HA VAL 18 HA VAL 18 51.848 36.251 1.467
145 HB VAL 18 HB VAL 18 52.917 37.136 4.167
146 1HG1 VAL 18 1HG2 VAL 18 53.716 34.786 4.418
147 2HG1 VAL 18 2HG2 VAL 18 52.732 34.321 3.014
148 3HG1 VAL 18 3HG2 VAL 18 51.952 34.910 4.502
149 1HG2 VAL 18 1HG1 VAL 18 54.236 35.861 1.724
150 2HG2 VAL 18 2HG1 VAL 18 54.296 37.591 2.112
151 3HG2 VAL 18 3HG1 VAL 18 55.059 36.413 3.199
152 H LYS 19 H LYS 19 50.194 38.216 3.896
153 HA LYS 19 HA LYS 19 48.416 36.140 4.865
154 1HB LYS 19 2HB LYS 19 48.973 38.211 6.101
155 2HB LYS 19 1HB LYS 19 48.083 39.156 4.887
156 1HG LYS 19 2HG LYS 19 46.009 37.974 5.434
157 2HG LYS 19 1HG LYS 19 46.883 36.889 6.542
158 1HD LYS 19 2HD LYS 19 47.533 38.817 7.932
159 2HD LYS 19 1HD LYS 19 46.649 39.910 6.844
160 1HE LYS 19 2HE LYS 19 45.417 37.618 8.442
161 2HE LYS 19 1HE LYS 19 45.349 39.334 8.889
162 1HZ LYS 19 1HZ LYS 19 43.372 38.652 7.783
163 2HZ LYS 19 2HZ LYS 19 44.174 39.756 6.858
164 3HZ LYS 19 3HZ LYS 19 44.213 38.157 6.455
165 H GLY 20 H GLY 20 48.503 38.417 2.173
166 1HA GLY 20 1HA GLY 20 45.748 38.091 1.332
167 2HA GLY 20 2HA GLY 20 47.085 38.822 0.417
168 H ALA 21 H ALA 21 48.964 36.827 0.307
169 HA ALA 21 HA ALA 21 47.964 35.012 -1.655
170 1HB ALA 21 1HB ALA 21 50.539 34.942 -0.035
171 2HB ALA 21 2HB ALA 21 50.303 35.805 -1.573
172 3HB ALA 21 3HB ALA 21 50.212 34.030 -1.525
173 H ALA 22 H ALA 22 48.319 34.863 1.859
174 HA ALA 22 HA ALA 22 48.310 32.051 2.188
175 1HB ALA 22 1HB ALA 22 47.575 32.490 4.471
176 2HB ALA 22 2HB ALA 22 48.842 33.638 3.997
177 3HB ALA 22 3HB ALA 22 47.139 34.154 4.042
178 H GLN 23 H GLN 23 45.690 34.307 1.466
179 HA GLN 23 HA GLN 23 43.451 32.791 2.179
180 1HB GLN 23 2HB GLN 23 43.474 35.161 1.460
181 2HB GLN 23 1HB GLN 23 43.831 34.653 -0.203
182 1HG GLN 23 2HG GLN 23 41.708 33.397 -0.281
183 2HG GLN 23 1HG GLN 23 41.368 33.847 1.402
184 1HE2 GLN 23 2HE2 GLN 23 41.395 36.308 1.833
185 2HE2 GLN 23 1HE2 GLN 23 40.635 37.313 0.619
186 H GLY 24 H GLY 24 45.570 32.576 -0.711
187 1HA GLY 24 2HA GLY 24 44.685 29.884 -1.274
188 2HA GLY 24 1HA GLY 24 44.061 31.067 -2.447
189 H VAL 25 H VAL 25 47.030 29.797 -0.912
190 HA VAL 25 HA VAL 25 48.876 31.324 -2.343
191 HB VAL 25 HB VAL 25 50.501 29.606 -1.669
192 1HG1 VAL 25 1HG1 VAL 25 49.754 31.347 -0.088
193 2HG1 VAL 25 2HG1 VAL 25 48.475 30.257 0.504
194 3HG1 VAL 25 3HG1 VAL 25 50.184 29.839 0.745
195 1HG2 VAL 25 1HG2 VAL 25 49.755 27.708 -0.224
196 2HG2 VAL 25 2HG2 VAL 25 48.085 28.001 -0.747
197 3HG2 VAL 25 3HG2 VAL 25 49.330 27.513 -1.925
198 H LEU 26 H LEU 26 47.583 28.073 -3.022
199 HA LEU 26 HA LEU 26 48.940 27.570 -5.457
200 1HB LEU 26 1HB LEU 26 46.148 26.717 -4.613
201 2HB LEU 26 2HB LEU 26 47.129 25.968 -5.881
202 HG LEU 26 HG LEU 26 47.788 26.023 -2.901
203 1HD1 LEU 26 1HD1 LEU 26 46.925 23.764 -4.750
204 2HD1 LEU 26 2HD1 LEU 26 47.352 23.607 -3.031
205 3HD1 LEU 26 3HD1 LEU 26 45.916 24.537 -3.507
206 1HD2 LEU 26 1HD2 LEU 26 49.243 24.730 -5.253
207 2HD2 LEU 26 2HD2 LEU 26 49.591 24.414 -3.539
208 3HD2 LEU 26 3HD2 LEU 26 49.870 26.028 -4.209
209 H SER 27 H SER 27 45.917 29.344 -4.753
210 HA SER 27 HA SER 27 45.204 29.789 -7.496
211 1HB SER 27 1HB SER 27 43.595 29.929 -5.632
212 2HB SER 27 2HB SER 27 44.460 31.338 -4.980
213 HG SER 27 HG SER 27 42.682 31.921 -6.298
214 H THR 28 H THR 28 47.173 31.603 -5.102
215 HA THR 28 HA THR 28 47.485 33.942 -6.699
216 HB THR 28 HB THR 28 49.325 32.853 -4.539
217 HG1 THR 28 HG1 THR 28 47.089 34.599 -4.432
218 1HG2 THR 28 1HG2 THR 28 48.880 35.660 -5.660
219 2HG2 THR 28 2HG2 THR 28 49.888 35.265 -4.251
220 3HG2 THR 28 3HG2 THR 28 50.349 34.679 -5.860
221 H VAL 29 H VAL 29 49.317 30.865 -6.501
222 HA VAL 29 HA VAL 29 51.466 31.623 -8.215
223 HB VAL 29 HB VAL 29 50.199 28.947 -7.523
224 1HG1 VAL 29 1HG1 VAL 29 52.768 29.559 -9.033
225 2HG1 VAL 29 2HG1 VAL 29 51.343 28.693 -9.664
226 3HG1 VAL 29 3HG1 VAL 29 52.321 27.966 -8.378
227 1HG2 VAL 29 1HG2 VAL 29 52.771 30.314 -6.614
228 2HG2 VAL 29 2HG2 VAL 29 51.291 30.173 -5.644
229 3HG2 VAL 29 3HG2 VAL 29 52.195 28.716 -6.093
230 H SER 30 H SER 30 48.117 30.601 -8.809
231 HA SER 30 HA SER 30 48.551 30.290 -11.685
232 1HB SER 30 2HB SER 30 46.855 28.963 -10.369
233 2HB SER 30 1HB SER 30 45.961 30.461 -10.073
234 HG SER 30 HG SER 30 45.187 29.323 -11.902
235 H CYS 31 H CYS 31 46.688 32.455 -9.573
236 HA CYS 31 HA CYS 31 46.029 34.471 -11.432
237 1HB CYS 31 1HB CYS 31 45.075 34.128 -9.157
238 2HB CYS 31 2HB CYS 31 46.609 34.651 -8.461
239 H LYS 32 H LYS 32 49.149 33.566 -10.282
240 HA LYS 32 HA LYS 32 50.331 36.172 -10.007
241 1HB LYS 32 1HB LYS 32 51.067 34.124 -8.818
242 2HB LYS 32 2HB LYS 32 51.415 33.362 -10.380
243 1HG LYS 32 2HG LYS 32 53.498 33.996 -9.738
244 2HG LYS 32 1HG LYS 32 53.030 35.329 -10.791
245 1HD LYS 32 2HD LYS 32 53.965 36.409 -8.906
246 2HD LYS 32 1HD LYS 32 52.213 36.513 -8.627
247 1HE LYS 32 1HE LYS 32 52.376 34.503 -7.133
248 2HE LYS 32 2HE LYS 32 54.122 34.444 -7.440
249 1HZ LYS 32 1HZ LYS 32 52.672 36.651 -6.167
250 2HZ LYS 32 2HZ LYS 32 54.295 36.610 -6.457
251 3HZ LYS 32 3HZ LYS 32 53.617 35.539 -5.401
252 H LEU 33 H LEU 33 50.265 33.586 -12.465
253 HA LEU 33 HA LEU 33 51.991 34.470 -14.406
254 1HB LEU 33 1HB LEU 33 49.191 33.351 -14.827
255 2HB LEU 33 2HB LEU 33 50.482 33.370 -16.040
256 HG LEU 33 HG LEU 33 50.602 31.879 -13.373
257 1HD1 LEU 33 1HD1 LEU 33 48.930 30.945 -14.923
258 2HD1 LEU 33 2HD1 LEU 33 50.331 29.866 -14.757
259 3HD1 LEU 33 3HD1 LEU 33 50.155 30.876 -16.211
260 1HD2 LEU 33 1HD2 LEU 33 52.854 32.486 -14.156
261 2HD2 LEU 33 2HD2 LEU 33 52.467 31.891 -15.789
262 3HD2 LEU 33 3HD2 LEU 33 52.569 30.759 -14.423
263 H ALA 34 H ALA 34 48.524 35.464 -14.194
264 HA ALA 34 HA ALA 34 48.991 37.659 -16.056
265 1HB ALA 34 1HB ALA 34 46.543 36.901 -14.413
266 2HB ALA 34 2HB ALA 34 46.854 36.406 -16.093
267 3HB ALA 34 3HB ALA 34 46.586 38.120 -15.707
268 H LYS 35 H LYS 35 48.911 37.096 -12.734
269 HA LYS 35 HA LYS 35 49.401 38.268 -10.880
270 1HB LYS 35 2HB LYS 35 51.378 38.838 -12.301
271 2HB LYS 35 1HB LYS 35 50.564 40.344 -12.756
272 1HG LYS 35 2HG LYS 35 52.012 40.860 -10.931
273 2HG LYS 35 1HG LYS 35 50.379 40.816 -10.234
274 1HD LYS 35 2HD LYS 35 50.855 38.429 -9.470
275 2HD LYS 35 1HD LYS 35 52.501 38.629 -10.107
276 1HE LYS 35 1HE LYS 35 52.844 40.585 -8.616
277 2HE LYS 35 2HE LYS 35 51.207 40.370 -7.963
278 1HZ LYS 35 1HZ LYS 35 53.395 38.424 -7.788
279 2HZ LYS 35 2HZ LYS 35 52.857 39.392 -6.566
280 3HZ LYS 35 3HZ LYS 35 51.874 38.220 -7.182
281 H THR 36 H THR 36 47.115 38.473 -10.579
282 HA THR 36 HA THR 36 46.632 41.332 -10.039
283 HB THR 36 HB THR 36 45.153 40.751 -11.916
284 HG1 THR 36 HG1 THR 36 43.271 41.482 -10.871
285 1HG2 THR 36 1HG2 THR 36 43.268 39.230 -11.604
286 2HG2 THR 36 2HG2 THR 36 44.795 38.344 -11.436
287 3HG2 THR 36 3HG2 THR 36 43.849 38.787 -9.989
288 H CYS 37 H CYS 37 47.657 38.639 -8.755
289 HA CYS 37 HA CYS 37 46.276 39.234 -6.176
290 1HB CYS 37 2HB CYS 37 47.232 36.502 -7.065
291 2HB CYS 37 1HB CYS 37 46.435 36.924 -5.545
292 HXT CYS 37 HO OH 38 50.223 38.281 -6.509
Start of MODEL 5
1 1H GLY 1 1H GLY 1 64.392 52.790 14.469
2 2H GLY 1 2H GLY 1 62.773 53.106 14.409
3 3H GLY 1 3H GLY 1 63.735 53.921 15.473
4 1HA GLY 1 1HA GLY 1 63.855 54.096 12.552
5 2HA GLY 1 2HA GLY 1 63.162 55.315 13.648
6 H ILE 2 H ILE 2 66.595 56.523 12.887
7 HA ILE 2 HA ILE 2 63.882 56.538 11.860
8 HB ILE 2 HB ILE 2 65.775 58.374 12.062
9 1HG1 ILE 2 2HG1 ILE 2 63.554 58.899 11.465
10 2HG1 ILE 2 1HG1 ILE 2 64.678 59.731 10.382
11 1HG2 ILE 2 1HG2 ILE 2 66.915 58.844 9.974
12 2HG2 ILE 2 2HG2 ILE 2 66.270 57.370 9.231
13 3HG2 ILE 2 3HG2 ILE 2 67.396 57.259 10.603
14 1HD1 ILE 2 1HD1 ILE 2 62.813 58.955 9.083
15 2HD1 ILE 2 2HD1 ILE 2 62.948 57.318 9.732
16 3HD1 ILE 2 3HD1 ILE 2 64.207 57.953 8.638
17 H LEU 3 H LEU 3 66.911 54.861 11.223
18 HA LEU 3 HA LEU 3 66.530 54.196 8.501
19 1HB LEU 3 2HB LEU 3 68.026 52.767 10.732
20 2HB LEU 3 1HB LEU 3 68.232 52.467 9.004
21 HG LEU 3 HG LEU 3 68.826 55.103 10.432
22 1HD1 LEU 3 1HD1 LEU 3 70.671 52.978 9.270
23 2HD1 LEU 3 2HD1 LEU 3 71.176 54.522 9.993
24 3HD1 LEU 3 3HD1 LEU 3 70.393 53.285 11.000
25 1HD2 LEU 3 1HD2 LEU 3 69.938 55.703 8.273
26 2HD2 LEU 3 2HD2 LEU 3 69.260 54.234 7.538
27 3HD2 LEU 3 3HD2 LEU 3 68.185 55.537 8.101
28 H ASP 4 H ASP 4 65.065 52.848 11.408
29 HA ASP 4 HA ASP 4 64.410 50.291 10.089
30 1HB ASP 4 2HB ASP 4 63.955 51.338 12.911
31 2HB ASP 4 1HB ASP 4 63.557 49.718 12.325
32 HD2 ASP 4 HD2 ASP 4 67.410 50.734 13.105
33 H THR 5 H THR 5 63.189 53.470 10.521
34 HA THR 5 HA THR 5 60.545 52.957 11.130
35 HB THR 5 HB THR 5 61.749 55.239 9.517
36 HG1 THR 5 HG1 THR 5 61.652 56.242 11.565
37 1HG2 THR 5 1HG2 THR 5 59.740 56.517 10.244
38 2HG2 THR 5 2HG2 THR 5 59.049 55.026 10.923
39 3HG2 THR 5 3HG2 THR 5 59.304 55.177 9.168
40 H LEU 6 H LEU 6 62.047 53.480 7.889
41 HA LEU 6 HA LEU 6 59.703 52.932 6.358
42 1HB LEU 6 2HB LEU 6 62.651 52.662 5.658
43 2HB LEU 6 1HB LEU 6 61.312 52.730 4.504
44 HG LEU 6 HG LEU 6 62.118 54.970 6.417
45 1HD1 LEU 6 1HD2 LEU 6 63.744 54.576 4.604
46 2HD1 LEU 6 2HD2 LEU 6 62.436 54.678 3.403
47 3HD1 LEU 6 3HD2 LEU 6 62.873 56.105 4.369
48 1HD2 LEU 6 1HD1 LEU 6 60.012 54.857 4.211
49 2HD2 LEU 6 2HD1 LEU 6 59.708 55.075 5.952
50 3HD2 LEU 6 3HD1 LEU 6 60.547 56.337 5.037
51 H LYS 7 H LYS 7 62.317 50.888 7.662
52 HA LYS 7 HA LYS 7 61.748 48.523 6.216
53 1HB LYS 7 1HB LYS 7 62.837 48.781 9.039
54 2HB LYS 7 2HB LYS 7 62.987 47.381 7.972
55 1HG LYS 7 1HG LYS 7 64.196 50.140 7.479
56 2HG LYS 7 2HG LYS 7 65.058 48.681 7.995
57 1HD LYS 7 2HD LYS 7 64.382 47.543 5.892
58 2HD LYS 7 1HD LYS 7 63.572 49.036 5.359
59 1HE LYS 7 1HE LYS 7 65.727 50.248 5.479
60 2HE LYS 7 2HE LYS 7 66.537 48.761 6.014
61 1HZ LYS 7 1HZ LYS 7 65.924 47.755 3.944
62 2HZ LYS 7 2HZ LYS 7 65.171 49.136 3.445
63 3HZ LYS 7 3HZ LYS 7 66.803 49.126 3.682
64 H GLN 8 H GLN 8 60.396 49.852 9.245
65 HA GLN 8 HA GLN 8 58.920 47.641 10.109
66 1HB GLN 8 1HB GLN 8 59.423 49.764 11.328
67 2HB GLN 8 2HB GLN 8 58.195 50.594 10.364
68 1HG GLN 8 2HG GLN 8 57.682 48.166 12.128
69 2HG GLN 8 1HG GLN 8 57.460 49.848 12.642
70 1HE2 GLN 8 1HE2 GLN 8 56.085 51.208 10.966
71 2HE2 GLN 8 2HE2 GLN 8 54.594 50.437 10.470
72 H PHE 9 H PHE 9 57.810 50.432 8.107
73 HA PHE 9 HA PHE 9 55.245 49.273 7.542
74 1HB PHE 9 1HB PHE 9 56.803 51.480 6.146
75 2HB PHE 9 2HB PHE 9 55.100 51.099 5.868
76 HD1 PHE 9 HD1 PHE 9 57.387 53.029 7.839
77 HD2 PHE 9 HD2 PHE 9 53.489 51.206 7.890
78 HE1 PHE 9 HE1 PHE 9 56.736 54.471 9.749
79 HE2 PHE 9 HE2 PHE 9 52.831 52.669 9.781
80 HZ PHE 9 HZ PHE 9 54.458 54.292 10.721
81 H ALA 10 H ALA 10 58.401 49.157 5.871
82 HA ALA 10 HA ALA 10 57.428 47.949 3.468
83 1HB ALA 10 1HB ALA 10 60.127 47.635 4.844
84 2HB ALA 10 2HB ALA 10 59.692 48.925 3.698
85 3HB ALA 10 3HB ALA 10 59.753 47.234 3.156
86 H LYS 11 H LYS 11 58.497 46.657 6.632
87 HA LYS 11 HA LYS 11 57.648 43.915 5.938
88 1HB LYS 11 2HB LYS 11 58.685 45.168 8.511
89 2HB LYS 11 1HB LYS 11 58.317 43.448 8.288
90 1HG LYS 11 1HG LYS 11 60.405 45.006 6.701
91 2HG LYS 11 2HG LYS 11 60.725 43.913 8.060
92 1HD LYS 11 2HD LYS 11 59.695 42.039 6.788
93 2HD LYS 11 1HD LYS 11 59.440 43.132 5.408
94 1HE LYS 11 2HE LYS 11 61.877 43.539 5.275
95 2HE LYS 11 1HE LYS 11 62.136 42.454 6.658
96 1HZ LYS 11 1HZ LYS 11 60.976 41.687 4.075
97 2HZ LYS 11 2HZ LYS 11 61.217 40.681 5.360
98 3HZ LYS 11 3HZ LYS 11 62.508 41.354 4.586
99 H GLY 12 H GLY 12 55.617 45.519 5.411
100 1HA GLY 12 2HA GLY 12 53.488 44.906 7.372
101 2HA GLY 12 1HA GLY 12 54.006 46.580 7.114
102 H VAL 13 H VAL 13 54.458 47.150 4.744
103 HA VAL 13 HA VAL 13 52.351 46.071 2.985
104 HB VAL 13 HB VAL 13 54.725 47.833 2.261
105 1HG1 VAL 13 1HG1 VAL 13 51.994 47.402 0.952
106 2HG1 VAL 13 2HG1 VAL 13 53.539 46.783 0.335
107 3HG1 VAL 13 3HG1 VAL 13 53.241 48.524 0.372
108 1HG2 VAL 13 1HG2 VAL 13 53.168 49.782 2.369
109 2HG2 VAL 13 2HG2 VAL 13 51.949 48.737 3.131
110 3HG2 VAL 13 3HG2 VAL 13 53.484 49.083 3.962
111 H GLY 14 H GLY 14 54.348 44.601 4.642
112 1HA GLY 14 1HA GLY 14 55.409 42.901 2.432
113 2HA GLY 14 2HA GLY 14 56.263 43.136 3.967
114 H LYS 15 H LYS 15 53.690 43.384 5.486
115 HA LYS 15 HA LYS 15 53.114 40.547 5.929
116 1HB LYS 15 1HB LYS 15 52.008 43.067 7.199
117 2HB LYS 15 2HB LYS 15 51.720 41.398 7.731
118 1HG LYS 15 2HG LYS 15 54.405 42.847 7.710
119 2HG LYS 15 1HG LYS 15 53.437 42.395 9.128
120 1HD LYS 15 2HD LYS 15 53.632 39.982 8.284
121 2HD LYS 15 1HD LYS 15 54.886 40.564 7.174
122 1HE LYS 15 2HE LYS 15 54.937 40.842 10.211
123 2HE LYS 15 1HE LYS 15 55.859 39.659 9.264
124 1HZ LYS 15 1HZ LYS 15 56.124 42.575 9.067
125 2HZ LYS 15 2HZ LYS 15 56.974 41.466 8.191
126 3HZ LYS 15 3HZ LYS 15 57.174 41.554 9.826
127 H ASP 16 H ASP 16 51.703 43.407 4.384
128 HA ASP 16 HA ASP 16 49.105 42.216 3.909
129 1HB ASP 16 1HB ASP 16 49.592 44.668 3.951
130 2HB ASP 16 2HB ASP 16 50.521 44.484 2.454
131 HD2 ASP 16 HD2 ASP 16 49.395 43.826 0.606
132 H LEU 17 H LEU 17 52.328 42.019 2.472
133 HA LEU 17 HA LEU 17 51.372 40.865 -0.066
134 1HB LEU 17 1HB LEU 17 54.035 41.722 1.107
135 2HB LEU 17 2HB LEU 17 53.920 40.740 -0.347
136 HG LEU 17 HG LEU 17 52.636 42.385 -1.523
137 1HD1 LEU 17 1HD1 LEU 17 51.280 43.466 0.068
138 2HD1 LEU 17 2HD1 LEU 17 52.670 43.979 1.046
139 3HD1 LEU 17 3HD1 LEU 17 52.368 44.716 -0.545
140 1HD2 LEU 17 1HD2 LEU 17 55.093 42.532 -1.594
141 2HD2 LEU 17 2HD2 LEU 17 55.082 43.614 -0.185
142 3HD2 LEU 17 3HD2 LEU 17 54.366 44.147 -1.723
143 H VAL 18 H VAL 18 53.206 40.160 2.964
144 HA VAL 18 HA VAL 18 53.554 37.372 2.235
145 HB VAL 18 HB VAL 18 53.849 38.942 4.792
146 1HG1 VAL 18 1HG1 VAL 18 54.656 36.867 5.870
147 2HG1 VAL 18 2HG1 VAL 18 54.030 35.932 4.489
148 3HG1 VAL 18 3HG1 VAL 18 52.914 36.841 5.544
149 1HG2 VAL 18 1HG2 VAL 18 56.182 38.239 4.548
150 2HG2 VAL 18 2HG2 VAL 18 55.646 38.960 3.016
151 3HG2 VAL 18 3HG2 VAL 18 55.757 37.197 3.173
152 H LYS 19 H LYS 19 51.022 39.372 3.583
153 HA LYS 19 HA LYS 19 49.345 37.201 4.550
154 1HB LYS 19 1HB LYS 19 49.190 39.521 5.396
155 2HB LYS 19 2HB LYS 19 48.692 40.071 3.786
156 1HG LYS 19 2HG LYS 19 46.760 39.809 5.270
157 2HG LYS 19 1HG LYS 19 46.659 38.672 3.916
158 1HD LYS 19 1HD LYS 19 47.507 36.854 5.364
159 2HD LYS 19 2HD LYS 19 47.683 38.001 6.713
160 1HE LYS 19 2HE LYS 19 45.243 38.437 6.651
161 2HE LYS 19 1HE LYS 19 45.072 37.287 5.308
162 1HZ LYS 19 1HZ LYS 19 45.881 35.575 6.756
163 2HZ LYS 19 2HZ LYS 19 46.039 36.644 8.002
164 3HZ LYS 19 3HZ LYS 19 44.544 36.294 7.401
165 H GLY 20 H GLY 20 49.831 39.024 1.563
166 1HA GLY 20 2HA GLY 20 47.537 38.024 0.121
167 2HA GLY 20 1HA GLY 20 48.942 38.888 -0.537
168 H ALA 21 H ALA 21 51.040 37.228 0.324
169 HA ALA 21 HA ALA 21 50.968 34.996 -1.474
170 1HB ALA 21 1HB ALA 21 52.791 35.576 0.895
171 2HB ALA 21 2HB ALA 21 53.056 36.127 -0.776
172 3HB ALA 21 3HB ALA 21 53.093 34.392 -0.395
173 H ALA 22 H ALA 22 50.223 35.492 1.951
174 HA ALA 22 HA ALA 22 49.827 32.610 2.385
175 1HB ALA 22 1HB ALA 22 49.524 34.943 4.299
176 2HB ALA 22 2HB ALA 22 49.497 33.218 4.722
177 3HB ALA 22 3HB ALA 22 50.985 33.950 4.094
178 H GLN 23 H GLN 23 48.056 34.143 0.494
179 HA GLN 23 HA GLN 23 45.473 34.235 1.886
180 1HB GLN 23 1HB GLN 23 46.128 35.942 0.222
181 2HB GLN 23 2HB GLN 23 46.206 34.692 -1.036
182 1HG GLN 23 2HG GLN 23 43.814 34.175 -0.672
183 2HG GLN 23 1HG GLN 23 43.748 35.394 0.617
184 1HE2 GLN 23 1HE2 GLN 23 44.508 37.673 -0.086
185 2HE2 GLN 23 2HE2 GLN 23 43.963 38.217 -1.658
186 H GLY 24 H GLY 24 46.815 32.603 -1.034
187 1HA GLY 24 1HA GLY 24 45.862 29.990 -0.354
188 2HA GLY 24 2HA GLY 24 44.734 30.796 -1.470
189 H VAL 25 H VAL 25 48.116 29.809 -0.989
190 HA VAL 25 HA VAL 25 49.228 30.676 -3.392
191 HB VAL 25 HB VAL 25 49.904 28.182 -1.769
192 1HG1 VAL 25 1HG2 VAL 25 52.174 28.483 -2.736
193 2HG1 VAL 25 2HG2 VAL 25 50.974 28.132 -3.992
194 3HG1 VAL 25 3HG2 VAL 25 51.557 29.797 -3.761
195 1HG2 VAL 25 1HG1 VAL 25 51.594 29.651 -0.710
196 2HG2 VAL 25 2HG1 VAL 25 50.946 31.039 -1.614
197 3HG2 VAL 25 3HG1 VAL 25 49.948 30.221 -0.388
198 H LEU 26 H LEU 26 47.829 27.472 -2.611
199 HA LEU 26 HA LEU 26 48.084 26.234 -5.114
200 1HB LEU 26 2HB LEU 26 45.872 25.952 -3.047
201 2HB LEU 26 1HB LEU 26 46.249 24.788 -4.325
202 HG LEU 26 HG LEU 26 48.109 25.562 -2.030
203 1HD1 LEU 26 1HD1 LEU 26 46.148 24.243 -1.323
204 2HD1 LEU 26 2HD1 LEU 26 46.512 23.027 -2.569
205 3HD1 LEU 26 3HD1 LEU 26 47.641 23.287 -1.221
206 1HD2 LEU 26 1HD2 LEU 26 49.420 24.918 -4.005
207 2HD2 LEU 26 2HD2 LEU 26 49.443 23.603 -2.821
208 3HD2 LEU 26 3HD2 LEU 26 48.391 23.486 -4.249
209 H SER 27 H SER 27 45.730 28.629 -3.986
210 HA SER 27 HA SER 27 44.007 28.322 -6.333
211 1HB SER 27 1HB SER 27 43.060 28.917 -4.144
212 2HB SER 27 2HB SER 27 44.053 30.391 -4.099
213 HG SER 27 HG SER 27 42.113 29.736 -6.067
214 H THR 28 H THR 28 46.394 30.687 -5.047
215 HA THR 28 HA THR 28 46.078 32.608 -7.096
216 HB THR 28 HB THR 28 48.474 32.036 -5.314
217 HG1 THR 28 HG1 THR 28 46.519 32.455 -4.210
218 1HG2 THR 28 1HG2 THR 28 49.092 33.510 -7.177
219 2HG2 THR 28 2HG2 THR 28 48.953 34.463 -5.692
220 3HG2 THR 28 3HG2 THR 28 47.650 34.512 -6.898
221 H VAL 29 H VAL 29 48.669 30.140 -6.637
222 HA VAL 29 HA VAL 29 50.191 30.657 -8.851
223 HB VAL 29 HB VAL 29 50.556 29.083 -6.911
224 1HG1 VAL 29 1HG2 VAL 29 49.978 26.750 -7.125
225 2HG1 VAL 29 2HG2 VAL 29 49.195 27.024 -8.691
226 3HG1 VAL 29 3HG2 VAL 29 48.490 27.712 -7.210
227 1HG2 VAL 29 1HG1 VAL 29 52.083 27.639 -8.178
228 2HG2 VAL 29 2HG1 VAL 29 52.132 29.307 -8.789
229 3HG2 VAL 29 3HG1 VAL 29 51.244 28.055 -9.691
230 H SER 30 H SER 30 47.183 28.818 -8.696
231 HA SER 30 HA SER 30 47.347 27.705 -11.323
232 1HB SER 30 1HB SER 30 45.927 26.763 -9.532
233 2HB SER 30 2HB SER 30 44.916 28.223 -9.549
234 HG SER 30 HG SER 30 45.344 26.451 -11.728
235 H CYS 31 H CYS 31 45.231 30.364 -10.122
236 HA CYS 31 HA CYS 31 44.497 31.203 -12.762
237 1HB CYS 31 2HB CYS 31 43.656 33.236 -11.598
238 2HB CYS 31 1HB CYS 31 43.051 31.716 -10.944
239 H LYS 32 H LYS 32 47.567 31.309 -11.485
240 HA LYS 32 HA LYS 32 48.169 33.995 -12.591
241 1HB LYS 32 2HB LYS 32 49.782 31.983 -11.021
242 2HB LYS 32 1HB LYS 32 50.545 33.373 -11.820
243 1HG LYS 32 2HG LYS 32 48.100 33.861 -10.166
244 2HG LYS 32 1HG LYS 32 49.648 33.550 -9.329
245 1HD LYS 32 2HD LYS 32 50.718 35.373 -10.598
246 2HD LYS 32 1HD LYS 32 49.185 35.719 -11.418
247 1HE LYS 32 1HE LYS 32 49.671 35.880 -8.412
248 2HE LYS 32 2HE LYS 32 49.609 37.261 -9.524
249 1HZ LYS 32 1HZ LYS 32 47.354 36.681 -10.028
250 2HZ LYS 32 2HZ LYS 32 47.402 35.406 -8.982
251 3HZ LYS 32 3HZ LYS 32 47.542 36.946 -8.412
252 H LEU 33 H LEU 33 47.089 32.560 -14.460
253 HA LEU 33 HA LEU 33 49.047 31.140 -16.110
254 1HB LEU 33 1HB LEU 33 46.679 30.545 -16.238
255 2HB LEU 33 2HB LEU 33 46.248 32.209 -16.659
256 HG LEU 33 HG LEU 33 47.527 32.009 -18.782
257 1HD1 LEU 33 1HD2 LEU 33 49.207 30.326 -18.151
258 2HD1 LEU 33 2HD2 LEU 33 47.927 29.119 -17.886
259 3HD1 LEU 33 3HD2 LEU 33 48.252 29.737 -19.520
260 1HD2 LEU 33 1HD1 LEU 33 45.957 30.471 -19.891
261 2HD2 LEU 33 2HD1 LEU 33 45.118 31.484 -18.697
262 3HD2 LEU 33 3HD1 LEU 33 45.496 29.788 -18.315
263 H ALA 34 H ALA 34 47.138 34.147 -16.480
264 HA ALA 34 HA ALA 34 49.597 35.619 -17.237
265 1HB ALA 34 1HB ALA 34 46.892 35.873 -18.625
266 2HB ALA 34 2HB ALA 34 48.365 35.180 -19.341
267 3HB ALA 34 3HB ALA 34 48.316 36.903 -18.911
268 H LYS 35 H LYS 35 48.633 35.283 -14.712
269 HA LYS 35 HA LYS 35 47.629 36.136 -12.899
270 1HB LYS 35 1HB LYS 35 48.290 38.800 -14.198
271 2HB LYS 35 2HB LYS 35 47.991 38.480 -12.478
272 1HG LYS 35 2HG LYS 35 50.314 37.453 -14.150
273 2HG LYS 35 1HG LYS 35 50.371 38.647 -12.843
274 1HD LYS 35 2HD LYS 35 49.554 36.846 -11.250
275 2HD LYS 35 1HD LYS 35 49.713 35.682 -12.581
276 1HE LYS 35 2HE LYS 35 51.976 37.398 -11.485
277 2HE LYS 35 1HE LYS 35 51.684 35.697 -11.075
278 1HZ LYS 35 1HZ LYS 35 52.270 36.727 -13.757
279 2HZ LYS 35 2HZ LYS 35 53.314 35.909 -12.778
280 3HZ LYS 35 3HZ LYS 35 51.978 35.149 -13.375
281 H THR 36 H THR 36 45.740 35.109 -14.149
282 HA THR 36 HA THR 36 43.566 36.765 -14.980
283 HB THR 36 HB THR 36 43.494 34.031 -13.633
284 HG1 THR 36 HG1 THR 36 43.737 34.755 -16.366
285 1HG2 THR 36 1HG2 THR 36 41.409 33.767 -14.941
286 2HG2 THR 36 2HG2 THR 36 41.285 35.124 -13.804
287 3HG2 THR 36 3HG2 THR 36 41.566 35.435 -15.534
288 H CYS 37 H CYS 37 44.690 35.472 -11.833
289 HA CYS 37 HA CYS 37 42.644 36.861 -10.269
290 1HB CYS 37 2HB CYS 37 45.260 35.483 -9.646
291 2HB CYS 37 1HB CYS 37 44.381 36.418 -8.430
292 HXT CYS 37 HO OH 38 46.044 37.302 -10.993
Start of MODEL 6
1 1H GLY 1 1H GLY 1 66.196 53.375 10.958
2 2H GLY 1 2H GLY 1 65.216 54.104 12.066
3 3H GLY 1 3H GLY 1 66.851 54.309 12.149
4 1HA GLY 1 1HA GLY 1 65.836 56.269 11.278
5 2HA GLY 1 2HA GLY 1 66.882 55.477 10.083
6 H ILE 2 H ILE 2 65.400 56.978 8.748
7 HA ILE 2 HA ILE 2 62.707 56.349 8.253
8 HB ILE 2 HB ILE 2 64.254 58.346 7.610
9 1HG1 ILE 2 2HG1 ILE 2 61.920 58.456 7.301
10 2HG1 ILE 2 1HG1 ILE 2 62.738 59.093 5.869
11 1HG2 ILE 2 1HG2 ILE 2 65.809 57.111 6.186
12 2HG2 ILE 2 2HG2 ILE 2 64.992 58.409 5.298
13 3HG2 ILE 2 3HG2 ILE 2 64.499 56.725 5.047
14 1HD1 ILE 2 1HD1 ILE 2 62.299 56.855 4.734
15 2HD1 ILE 2 2HD1 ILE 2 61.283 56.442 6.142
16 3HD1 ILE 2 3HD1 ILE 2 60.861 57.818 5.120
17 H LEU 3 H LEU 3 65.741 54.944 7.027
18 HA LEU 3 HA LEU 3 64.560 53.366 4.945
19 1HB LEU 3 2HB LEU 3 67.155 53.088 6.516
20 2HB LEU 3 1HB LEU 3 66.759 52.208 5.037
21 HG LEU 3 HG LEU 3 67.042 55.241 5.276
22 1HD1 LEU 3 1HD2 LEU 3 68.851 53.146 4.008
23 2HD1 LEU 3 2HD2 LEU 3 69.106 54.905 3.979
24 3HD1 LEU 3 3HD2 LEU 3 69.174 54.025 5.519
25 1HD2 LEU 3 1HD1 LEU 3 65.464 54.679 3.479
26 2HD2 LEU 3 2HD1 LEU 3 66.581 53.442 2.853
27 3HD2 LEU 3 3HD1 LEU 3 67.013 55.164 2.776
28 H ASP 4 H ASP 4 64.635 52.996 8.407
29 HA ASP 4 HA ASP 4 64.166 50.076 8.265
30 1HB ASP 4 1HB ASP 4 65.785 50.960 9.953
31 2HB ASP 4 2HB ASP 4 64.490 51.952 10.644
32 HD2 ASP 4 HD2 ASP 4 64.333 47.896 11.084
33 H THR 5 H THR 5 62.724 53.252 8.473
34 HA THR 5 HA THR 5 60.330 52.390 9.736
35 HB THR 5 HB THR 5 60.801 54.859 8.019
36 HG1 THR 5 HG1 THR 5 60.927 54.430 10.822
37 1HG2 THR 5 1HG2 THR 5 58.402 54.380 8.312
38 2HG2 THR 5 2HG2 THR 5 58.643 54.202 10.066
39 3HG2 THR 5 3HG2 THR 5 58.885 55.781 9.287
40 H LEU 6 H LEU 6 61.380 52.965 6.365
41 HA LEU 6 HA LEU 6 58.997 52.105 5.038
42 1HB LEU 6 2HB LEU 6 61.926 52.065 4.213
43 2HB LEU 6 1HB LEU 6 60.557 51.828 3.119
44 HG LEU 6 HG LEU 6 61.074 54.365 4.734
45 1HD1 LEU 6 1HD2 LEU 6 62.790 53.978 3.008
46 2HD1 LEU 6 2HD2 LEU 6 61.519 53.755 1.785
47 3HD1 LEU 6 3HD2 LEU 6 61.734 55.336 2.569
48 1HD2 LEU 6 1HD1 LEU 6 59.382 55.346 3.185
49 2HD2 LEU 6 2HD1 LEU 6 58.683 54.095 4.223
50 3HD2 LEU 6 3HD1 LEU 6 59.068 53.726 2.525
51 H LYS 7 H LYS 7 61.938 50.434 6.243
52 HA LYS 7 HA LYS 7 61.463 47.906 5.147
53 1HB LYS 7 2HB LYS 7 63.559 48.752 6.243
54 2HB LYS 7 1HB LYS 7 62.748 48.612 7.812
55 1HG LYS 7 2HG LYS 7 64.132 46.664 7.436
56 2HG LYS 7 1HG LYS 7 62.426 46.168 7.397
57 1HD LYS 7 1HD LYS 7 62.471 46.224 4.920
58 2HD LYS 7 2HD LYS 7 64.160 46.780 4.960
59 1HE LYS 7 1HE LYS 7 64.819 44.679 6.105
60 2HE LYS 7 2HE LYS 7 63.131 44.127 6.066
61 1HZ LYS 7 1HZ LYS 7 64.800 44.702 3.722
62 2HZ LYS 7 2HZ LYS 7 64.410 43.203 4.289
63 3HZ LYS 7 3HZ LYS 7 63.234 44.189 3.686
64 H GLN 8 H GLN 8 60.441 49.324 8.291
65 HA GLN 8 HA GLN 8 59.115 47.053 9.314
66 1HB GLN 8 2HB GLN 8 59.799 49.037 10.627
67 2HB GLN 8 1HB GLN 8 58.627 50.030 9.754
68 1HG GLN 8 1HG GLN 8 57.752 49.412 11.929
69 2HG GLN 8 2HG GLN 8 56.770 48.676 10.654
70 1HE2 GLN 8 2HE2 GLN 8 56.825 46.382 10.365
71 2HE2 GLN 8 1HE2 GLN 8 57.512 45.319 11.575
72 H PHE 9 H PHE 9 57.946 49.871 7.438
73 HA PHE 9 HA PHE 9 55.222 49.072 7.251
74 1HB PHE 9 1HB PHE 9 56.037 51.348 6.820
75 2HB PHE 9 2HB PHE 9 56.925 50.781 5.403
76 HD1 PHE 9 HD1 PHE 9 55.842 50.531 3.285
77 HD2 PHE 9 HD2 PHE 9 53.504 51.215 6.834
78 HE1 PHE 9 HE1 PHE 9 53.835 50.932 1.887
79 HE2 PHE 9 HE2 PHE 9 51.496 51.609 5.432
80 HZ PHE 9 HZ PHE 9 51.661 51.476 2.958
81 H ALA 10 H ALA 10 58.067 48.457 5.146
82 HA ALA 10 HA ALA 10 56.645 47.006 3.133
83 1HB ALA 10 1HB ALA 10 58.892 47.960 2.788
84 2HB ALA 10 2HB ALA 10 59.564 46.836 3.991
85 3HB ALA 10 3HB ALA 10 58.879 46.210 2.476
86 H LYS 11 H LYS 11 58.322 46.042 6.160
87 HA LYS 11 HA LYS 11 57.412 43.249 5.904
88 1HB LYS 11 1HB LYS 11 58.837 44.755 8.135
89 2HB LYS 11 2HB LYS 11 58.441 43.023 8.148
90 1HG LYS 11 1HG LYS 11 59.835 42.643 6.166
91 2HG LYS 11 2HG LYS 11 60.184 44.376 6.046
92 1HD LYS 11 2HD LYS 11 62.067 43.277 7.067
93 2HD LYS 11 1HD LYS 11 61.282 44.305 8.280
94 1HE LYS 11 1HE LYS 11 60.186 42.330 9.270
95 2HE LYS 11 2HE LYS 11 60.857 41.297 7.989
96 1HZ LYS 11 1HZ LYS 11 63.033 41.844 8.789
97 2HZ LYS 11 2HZ LYS 11 62.404 42.805 9.972
98 3HZ LYS 11 3HZ LYS 11 62.123 41.180 9.994
99 H GLY 12 H GLY 12 55.350 45.065 5.640
100 1HA GLY 12 1HA GLY 12 53.583 44.140 7.724
101 2HA GLY 12 2HA GLY 12 53.777 45.921 7.700
102 H VAL 13 H VAL 13 54.163 46.124 4.849
103 HA VAL 13 HA VAL 13 51.743 44.877 3.657
104 HB VAL 13 HB VAL 13 53.765 46.695 2.307
105 1HG1 VAL 13 1HG1 VAL 13 51.882 47.123 0.736
106 2HG1 VAL 13 2HG1 VAL 13 50.844 46.038 1.683
107 3HG1 VAL 13 3HG1 VAL 13 52.241 45.391 0.801
108 1HG2 VAL 13 1HG2 VAL 13 52.115 48.551 2.630
109 2HG2 VAL 13 2HG2 VAL 13 52.848 48.015 4.149
110 3HG2 VAL 13 3HG2 VAL 13 51.195 47.503 3.731
111 H GLY 14 H GLY 14 53.640 43.312 4.832
112 1HA GLY 14 1HA GLY 14 54.943 41.914 2.542
113 2HA GLY 14 2HA GLY 14 55.759 42.162 4.101
114 H LYS 15 H LYS 15 53.327 41.943 5.695
115 HA LYS 15 HA LYS 15 52.955 39.005 5.669
116 1HB LYS 15 2HB LYS 15 52.022 39.269 7.853
117 2HB LYS 15 1HB LYS 15 53.586 40.105 7.758
118 1HG LYS 15 2HG LYS 15 52.337 42.267 7.395
119 2HG LYS 15 1HG LYS 15 50.815 41.385 7.649
120 1HD LYS 15 1HD LYS 15 51.574 40.739 9.917
121 2HD LYS 15 2HD LYS 15 53.121 41.566 9.631
122 1HE LYS 15 2HE LYS 15 51.635 42.983 10.966
123 2HE LYS 15 1HE LYS 15 51.936 43.723 9.383
124 1HZ LYS 15 1HZ LYS 15 49.551 42.182 10.126
125 2HZ LYS 15 2HZ LYS 15 49.640 43.824 10.013
126 3HZ LYS 15 3HZ LYS 15 49.821 42.895 8.663
127 H ASP 16 H ASP 16 51.331 42.033 4.931
128 HA ASP 16 HA ASP 16 48.688 40.886 4.536
129 1HB ASP 16 1HB ASP 16 49.126 43.308 4.920
130 2HB ASP 16 2HB ASP 16 50.000 43.378 3.380
131 HD2 ASP 16 HD2 ASP 16 48.850 43.094 1.495
132 H LEU 17 H LEU 17 51.773 41.016 2.853
133 HA LEU 17 HA LEU 17 50.675 40.441 0.216
134 1HB LEU 17 2HB LEU 17 52.577 42.054 0.851
135 2HB LEU 17 1HB LEU 17 53.545 40.618 1.211
136 HG LEU 17 HG LEU 17 54.044 41.597 -0.900
137 1HD1 LEU 17 1HD2 LEU 17 54.278 39.120 -0.600
138 2HD1 LEU 17 2HD2 LEU 17 54.084 39.628 -2.291
139 3HD1 LEU 17 3HD2 LEU 17 52.714 38.914 -1.428
140 1HD2 LEU 17 1HD1 LEU 17 51.801 42.513 -1.461
141 2HD2 LEU 17 2HD1 LEU 17 51.244 40.869 -1.856
142 3HD2 LEU 17 3HD1 LEU 17 52.534 41.622 -2.811
143 H VAL 18 H VAL 18 52.905 39.040 2.693
144 HA VAL 18 HA VAL 18 53.046 36.463 1.389
145 HB VAL 18 HB VAL 18 53.726 37.427 4.184
146 1HG1 VAL 18 1HG2 VAL 18 54.832 35.212 4.489
147 2HG1 VAL 18 2HG2 VAL 18 53.068 35.081 4.420
148 3HG1 VAL 18 3HG2 VAL 18 54.048 34.637 3.002
149 1HG2 VAL 18 1HG1 VAL 18 55.426 36.393 1.866
150 2HG2 VAL 18 2HG1 VAL 18 55.201 38.109 2.250
151 3HG2 VAL 18 3HG1 VAL 18 56.025 37.044 3.407
152 H LYS 19 H LYS 19 50.847 38.099 3.602
153 HA LYS 19 HA LYS 19 49.328 35.780 4.410
154 1HB LYS 19 1HB LYS 19 49.269 37.891 5.624
155 2HB LYS 19 2HB LYS 19 48.582 38.725 4.220
156 1HG LYS 19 2HG LYS 19 47.215 36.353 5.557
157 2HG LYS 19 1HG LYS 19 46.973 38.029 6.081
158 1HD LYS 19 2HD LYS 19 46.180 38.653 3.827
159 2HD LYS 19 1HD LYS 19 46.354 36.968 3.295
160 1HE LYS 19 1HE LYS 19 44.740 36.248 5.023
161 2HE LYS 19 2HE LYS 19 44.572 37.928 5.571
162 1HZ LYS 19 1HZ LYS 19 43.724 38.482 3.414
163 2HZ LYS 19 2HZ LYS 19 42.813 37.294 4.107
164 3HZ LYS 19 3HZ LYS 19 43.879 36.921 2.904
165 H GLY 20 H GLY 20 49.272 38.065 1.704
166 1HA GLY 20 2HA GLY 20 46.757 37.233 0.562
167 2HA GLY 20 1HA GLY 20 48.013 38.235 -0.194
168 H ALA 21 H ALA 21 50.233 36.574 -0.068
169 HA ALA 21 HA ALA 21 49.830 34.659 -2.159
170 1HB ALA 21 1HB ALA 21 51.998 35.764 -1.708
171 2HB ALA 21 2HB ALA 21 52.143 33.994 -1.648
172 3HB ALA 21 3HB ALA 21 52.093 34.931 -0.139
173 H ALA 22 H ALA 22 49.783 34.539 1.378
174 HA ALA 22 HA ALA 22 49.692 31.618 1.461
175 1HB ALA 22 1HB ALA 22 50.799 32.886 3.239
176 2HB ALA 22 2HB ALA 22 49.252 33.663 3.655
177 3HB ALA 22 3HB ALA 22 49.456 31.913 3.870
178 H GLN 23 H GLN 23 47.338 34.169 1.065
179 HA GLN 23 HA GLN 23 45.132 33.097 2.408
180 1HB GLN 23 2HB GLN 23 45.398 35.375 1.453
181 2HB GLN 23 1HB GLN 23 45.167 34.718 -0.174
182 1HG GLN 23 2HG GLN 23 43.155 34.447 2.103
183 2HG GLN 23 1HG GLN 23 43.145 35.764 0.919
184 1HE2 GLN 23 2HE2 GLN 23 41.279 33.355 1.561
185 2HE2 GLN 23 1HE2 GLN 23 40.950 32.682 -0.021
186 H GLY 24 H GLY 24 46.379 32.459 -0.902
187 1HA GLY 24 1HA GLY 24 44.980 29.898 -0.997
188 2HA GLY 24 2HA GLY 24 44.400 31.115 -2.159
189 H VAL 25 H VAL 25 47.297 29.409 -0.970
190 HA VAL 25 HA VAL 25 49.158 30.463 -2.768
191 HB VAL 25 HB VAL 25 49.078 27.678 -1.508
192 1HG1 VAL 25 1HG2 VAL 25 51.403 29.313 -2.614
193 2HG1 VAL 25 2HG2 VAL 25 50.756 27.810 -3.311
194 3HG1 VAL 25 3HG2 VAL 25 51.551 27.781 -1.727
195 1HG2 VAL 25 1HG1 VAL 25 48.902 29.462 0.187
196 2HG2 VAL 25 2HG1 VAL 25 50.316 30.277 -0.523
197 3HG2 VAL 25 3HG1 VAL 25 50.493 28.684 0.246
198 H LEU 26 H LEU 26 47.259 27.435 -2.964
199 HA LEU 26 HA LEU 26 48.104 26.545 -5.502
200 1HB LEU 26 1HB LEU 26 45.399 26.239 -4.153
201 2HB LEU 26 2HB LEU 26 46.008 25.247 -5.486
202 HG LEU 26 HG LEU 26 47.237 25.410 -2.694
203 1HD1 LEU 26 1HD2 LEU 26 45.627 23.220 -4.065
204 2HD1 LEU 26 2HD2 LEU 26 46.370 23.121 -2.452
205 3HD1 LEU 26 3HD2 LEU 26 45.050 24.271 -2.751
206 1HD2 LEU 26 1HD1 LEU 26 47.922 23.672 -5.107
207 2HD2 LEU 26 2HD1 LEU 26 48.557 23.433 -3.465
208 3HD2 LEU 26 3HD1 LEU 26 48.969 24.902 -4.361
209 H SER 27 H SER 27 45.426 28.753 -4.578
210 HA SER 27 HA SER 27 44.471 29.177 -7.251
211 1HB SER 27 1HB SER 27 44.280 30.965 -4.790
212 2HB SER 27 2HB SER 27 43.303 31.090 -6.266
213 HG SER 27 HG SER 27 42.256 29.914 -4.602
214 H THR 28 H THR 28 46.786 30.988 -5.142
215 HA THR 28 HA THR 28 47.435 32.766 -7.375
216 HB THR 28 HB THR 28 48.924 32.666 -4.748
217 HG1 THR 28 HG1 THR 28 46.461 33.962 -5.276
218 1HG2 THR 28 1HG2 THR 28 49.034 35.134 -5.216
219 2HG2 THR 28 2HG2 THR 28 49.764 34.202 -6.536
220 3HG2 THR 28 3HG2 THR 28 48.138 34.868 -6.723
221 H VAL 29 H VAL 29 47.852 29.962 -7.814
222 HA VAL 29 HA VAL 29 50.634 30.282 -8.807
223 HB VAL 29 HB VAL 29 48.687 27.940 -9.085
224 1HG1 VAL 29 1HG2 VAL 29 50.619 26.782 -10.138
225 2HG1 VAL 29 2HG2 VAL 29 50.097 28.183 -11.089
226 3HG1 VAL 29 3HG2 VAL 29 51.551 28.294 -10.070
227 1HG2 VAL 29 1HG1 VAL 29 49.682 28.075 -6.821
228 2HG2 VAL 29 2HG1 VAL 29 51.305 28.193 -7.537
229 3HG2 VAL 29 3HG1 VAL 29 50.351 26.704 -7.724
230 H SER 30 H SER 30 47.187 30.005 -9.618
231 HA SER 30 HA SER 30 47.579 30.691 -12.395
232 1HB SER 30 2HB SER 30 45.123 30.609 -10.571
233 2HB SER 30 1HB SER 30 45.073 30.832 -12.337
234 HG SER 30 HG SER 30 44.794 28.648 -11.703
235 H CYS 31 H CYS 31 46.066 32.447 -9.619
236 HA CYS 31 HA CYS 31 46.204 34.933 -11.141
237 1HB CYS 31 1HB CYS 31 45.195 35.959 -9.209
238 2HB CYS 31 2HB CYS 31 44.297 34.561 -9.780
239 H LYS 32 H LYS 32 48.849 33.623 -10.699
240 HA LYS 32 HA LYS 32 50.244 35.579 -9.025
241 1HB LYS 32 2HB LYS 32 51.123 33.699 -11.255
242 2HB LYS 32 1HB LYS 32 52.245 34.676 -10.301
243 1HG LYS 32 2HG LYS 32 50.339 32.605 -9.207
244 2HG LYS 32 1HG LYS 32 52.042 32.287 -9.554
245 1HD LYS 32 1HD LYS 32 50.979 34.255 -7.478
246 2HD LYS 32 2HD LYS 32 51.692 32.671 -7.154
247 1HE LYS 32 2HE LYS 32 53.130 35.075 -8.356
248 2HE LYS 32 1HE LYS 32 53.327 34.414 -6.729
249 1HZ LYS 32 1HZ LYS 32 55.054 33.683 -8.167
250 2HZ LYS 32 2HZ LYS 32 53.978 33.016 -9.222
251 3HZ LYS 32 3HZ LYS 32 54.137 32.394 -7.703
252 H LEU 33 H LEU 33 50.291 34.894 -12.473
253 HA LEU 33 HA LEU 33 51.997 36.384 -13.542
254 1HB LEU 33 1HB LEU 33 50.366 34.975 -14.748
255 2HB LEU 33 2HB LEU 33 49.203 36.304 -14.724
256 HG LEU 33 HG LEU 33 50.814 37.684 -16.082
257 1HD1 LEU 33 1HD1 LEU 33 52.690 36.478 -17.203
258 2HD1 LEU 33 2HD1 LEU 33 52.415 35.087 -16.131
259 3HD1 LEU 33 3HD1 LEU 33 52.952 36.647 -15.461
260 1HD2 LEU 33 1HD2 LEU 33 50.467 36.432 -18.169
261 2HD2 LEU 33 2HD2 LEU 33 50.110 34.958 -17.240
262 3HD2 LEU 33 3HD2 LEU 33 49.021 36.361 -17.140
263 H ALA 34 H ALA 34 52.183 38.028 -11.931
264 HA ALA 34 HA ALA 34 52.544 40.237 -11.465
265 1HB ALA 34 1HB ALA 34 52.231 41.942 -13.164
266 2HB ALA 34 2HB ALA 34 51.238 40.852 -14.149
267 3HB ALA 34 3HB ALA 34 52.959 40.494 -13.887
268 H LYS 35 H LYS 35 50.721 39.232 -10.022
269 HA LYS 35 HA LYS 35 48.400 41.035 -9.871
270 1HB LYS 35 2HB LYS 35 48.424 38.026 -9.764
271 2HB LYS 35 1HB LYS 35 47.003 39.041 -9.480
272 1HG LYS 35 1HG LYS 35 46.847 39.660 -11.769
273 2HG LYS 35 2HG LYS 35 48.484 39.072 -12.129
274 1HD LYS 35 2HD LYS 35 47.844 36.772 -11.604
275 2HD LYS 35 1HD LYS 35 46.179 37.305 -11.252
276 1HE LYS 35 1HE LYS 35 45.875 38.071 -13.549
277 2HE LYS 35 2HE LYS 35 47.568 37.709 -13.935
278 1HZ LYS 35 1HZ LYS 35 47.115 35.410 -13.511
279 2HZ LYS 35 2HZ LYS 35 45.537 35.741 -13.161
280 3HZ LYS 35 3HZ LYS 35 46.114 35.993 -14.686
281 H THR 36 H THR 36 50.036 38.248 -8.437
282 HA THR 36 HA THR 36 50.122 37.387 -6.391
283 HB THR 36 HB THR 36 50.476 38.643 -4.421
284 HG1 THR 36 HG1 THR 36 49.713 40.977 -5.816
285 1HG2 THR 36 1HG2 THR 36 51.775 40.177 -6.710
286 2HG2 THR 36 2HG2 THR 36 52.350 40.073 -5.034
287 3HG2 THR 36 3HG2 THR 36 52.341 38.621 -6.058
288 H CYS 37 H CYS 37 47.665 38.247 -7.956
289 HA CYS 37 HA CYS 37 45.524 37.588 -7.883
290 1HB CYS 37 1HB CYS 37 46.527 36.073 -5.892
291 2HB CYS 37 2HB CYS 37 45.421 37.070 -4.955
292 HXT CYS 37 HO OH 38 45.033 40.469 -5.053
Start of MODEL 7
1 1H GLY 1 1H GLY 1 65.446 53.443 13.500
2 2H GLY 1 2H GLY 1 64.889 54.553 14.584
3 3H GLY 1 3H GLY 1 63.845 53.479 13.894
4 1HA GLY 1 1HA GLY 1 64.172 54.421 11.749
5 2HA GLY 1 2HA GLY 1 63.579 55.621 12.922
6 H ILE 2 H ILE 2 66.391 57.273 11.117
7 HA ILE 2 HA ILE 2 63.553 56.670 10.905
8 HB ILE 2 HB ILE 2 64.367 58.932 10.544
9 1HG1 ILE 2 1HG1 ILE 2 63.395 59.415 8.348
10 2HG1 ILE 2 2HG1 ILE 2 63.480 57.703 7.910
11 1HG2 ILE 2 1HG2 ILE 2 66.648 58.460 9.693
12 2HG2 ILE 2 2HG2 ILE 2 65.753 59.522 8.600
13 3HG2 ILE 2 3HG2 ILE 2 65.951 57.809 8.192
14 1HD1 ILE 2 1HD1 ILE 2 61.201 58.437 8.627
15 2HD1 ILE 2 2HD1 ILE 2 61.853 58.848 10.229
16 3HD1 ILE 2 3HD1 ILE 2 61.836 57.158 9.671
17 H LEU 3 H LEU 3 66.599 55.600 9.504
18 HA LEU 3 HA LEU 3 65.587 54.603 7.039
19 1HB LEU 3 1HB LEU 3 68.009 53.754 8.669
20 2HB LEU 3 2HB LEU 3 67.732 53.380 6.962
21 HG LEU 3 HG LEU 3 68.075 56.183 8.132
22 1HD1 LEU 3 1HD2 LEU 3 69.937 54.461 6.447
23 2HD1 LEU 3 2HD2 LEU 3 70.243 56.133 6.969
24 3HD1 LEU 3 3HD2 LEU 3 70.139 54.833 8.175
25 1HD2 LEU 3 1HD1 LEU 3 68.279 56.857 5.734
26 2HD2 LEU 3 2HD1 LEU 3 67.804 55.214 5.250
27 3HD2 LEU 3 3HD1 LEU 3 66.659 56.260 6.123
28 H ASP 4 H ASP 4 65.207 53.341 10.257
29 HA ASP 4 HA ASP 4 64.886 50.553 9.322
30 1HB ASP 4 1HB ASP 4 66.205 51.032 11.383
31 2HB ASP 4 2HB ASP 4 64.774 51.791 12.101
32 HD2 ASP 4 HD2 ASP 4 65.746 48.827 10.507
33 H THR 5 H THR 5 63.170 53.500 9.993
34 HA THR 5 HA THR 5 60.841 52.426 11.067
35 HB THR 5 HB THR 5 61.204 54.952 9.408
36 HG1 THR 5 HG1 THR 5 61.251 54.460 12.204
37 1HG2 THR 5 1HG2 THR 5 58.827 54.413 9.588
38 2HG2 THR 5 2HG2 THR 5 58.993 54.139 11.340
39 3HG2 THR 5 3HG2 THR 5 59.213 55.769 10.663
40 H LEU 6 H LEU 6 61.672 53.228 7.661
41 HA LEU 6 HA LEU 6 59.249 52.342 6.462
42 1HB LEU 6 2HB LEU 6 62.094 52.405 5.384
43 2HB LEU 6 1HB LEU 6 60.621 52.276 4.413
44 HG LEU 6 HG LEU 6 61.377 54.654 6.173
45 1HD1 LEU 6 1HD2 LEU 6 62.805 54.403 4.178
46 2HD1 LEU 6 2HD2 LEU 6 61.358 54.309 3.148
47 3HD1 LEU 6 3HD2 LEU 6 61.730 55.808 4.029
48 1HD2 LEU 6 1HD1 LEU 6 59.047 54.221 4.249
49 2HD2 LEU 6 2HD1 LEU 6 59.491 55.779 4.980
50 3HD2 LEU 6 3HD1 LEU 6 58.933 54.452 6.010
51 H LYS 7 H LYS 7 62.277 50.670 7.346
52 HA LYS 7 HA LYS 7 61.746 48.211 6.025
53 1HB LYS 7 1HB LYS 7 63.346 48.641 8.571
54 2HB LYS 7 2HB LYS 7 63.502 47.306 7.427
55 1HG LYS 7 2HG LYS 7 64.153 50.235 6.894
56 2HG LYS 7 1HG LYS 7 65.309 48.915 7.125
57 1HD LYS 7 1HD LYS 7 64.402 47.782 5.105
58 2HD LYS 7 2HD LYS 7 63.312 49.161 4.833
59 1HE LYS 7 2HE LYS 7 66.354 49.316 4.923
60 2HE LYS 7 1HE LYS 7 65.368 49.289 3.449
61 1HZ LYS 7 1HZ LYS 7 65.963 51.499 4.047
62 2HZ LYS 7 2HZ LYS 7 64.330 51.309 4.175
63 3HZ LYS 7 3HZ LYS 7 65.265 51.350 5.533
64 H GLN 8 H GLN 8 61.056 49.370 9.331
65 HA GLN 8 HA GLN 8 59.962 47.038 10.448
66 1HB GLN 8 1HB GLN 8 60.624 49.073 11.675
67 2HB GLN 8 2HB GLN 8 59.293 49.973 10.930
68 1HG GLN 8 2HG GLN 8 57.653 48.495 11.996
69 2HG GLN 8 1HG GLN 8 58.969 47.513 12.680
70 1HE2 GLN 8 1HE2 GLN 8 57.936 50.979 12.510
71 2HE2 GLN 8 2HE2 GLN 8 58.299 51.342 14.183
72 H PHE 9 H PHE 9 58.450 49.710 8.606
73 HA PHE 9 HA PHE 9 55.795 48.516 8.678
74 1HB PHE 9 2HB PHE 9 56.916 50.742 6.947
75 2HB PHE 9 1HB PHE 9 55.209 50.369 7.199
76 HD1 PHE 9 HD1 PHE 9 56.461 53.070 7.566
77 HD2 PHE 9 HD2 PHE 9 55.771 49.867 10.370
78 HE1 PHE 9 HE1 PHE 9 56.303 54.709 9.417
79 HE2 PHE 9 HE2 PHE 9 55.656 51.504 12.207
80 HZ PHE 9 HZ PHE 9 55.921 53.928 11.743
81 H ALA 10 H ALA 10 58.579 48.388 6.484
82 HA ALA 10 HA ALA 10 57.160 47.436 4.205
83 1HB ALA 10 1HB ALA 10 59.354 46.702 3.411
84 2HB ALA 10 2HB ALA 10 60.041 46.901 5.035
85 3HB ALA 10 3HB ALA 10 59.472 48.323 4.128
86 H LYS 11 H LYS 11 58.609 45.760 7.025
87 HA LYS 11 HA LYS 11 57.637 43.147 6.067
88 1HB LYS 11 2HB LYS 11 58.619 42.277 8.130
89 2HB LYS 11 1HB LYS 11 59.773 43.220 7.175
90 1HG LYS 11 2HG LYS 11 59.488 45.152 8.693
91 2HG LYS 11 1HG LYS 11 58.268 44.266 9.615
92 1HD LYS 11 2HD LYS 11 60.348 44.162 10.806
93 2HD LYS 11 1HD LYS 11 59.942 42.546 10.207
94 1HE LYS 11 1HE LYS 11 62.333 43.035 9.931
95 2HE LYS 11 2HE LYS 11 61.567 42.821 8.352
96 1HZ LYS 11 1HZ LYS 11 62.175 45.391 9.640
97 2HZ LYS 11 2HZ LYS 11 61.473 45.207 8.160
98 3HZ LYS 11 3HZ LYS 11 63.024 44.704 8.404
99 H GLY 12 H GLY 12 55.638 45.002 6.157
100 1HA GLY 12 2HA GLY 12 53.759 43.993 8.231
101 2HA GLY 12 1HA GLY 12 54.259 45.697 8.148
102 H VAL 13 H VAL 13 54.343 46.650 5.865
103 HA VAL 13 HA VAL 13 51.921 46.141 4.317
104 HB VAL 13 HB VAL 13 54.538 47.650 3.835
105 1HG1 VAL 13 1HG2 VAL 13 53.674 47.102 1.655
106 2HG1 VAL 13 2HG2 VAL 13 53.245 48.780 1.990
107 3HG1 VAL 13 3HG2 VAL 13 52.009 47.510 2.154
108 1HG2 VAL 13 1HG1 VAL 13 53.135 48.671 5.597
109 2HG2 VAL 13 2HG1 VAL 13 51.734 48.642 4.503
110 3HG2 VAL 13 3HG1 VAL 13 53.135 49.671 4.137
111 H GLY 14 H GLY 14 54.386 44.282 5.315
112 1HA GLY 14 2HA GLY 14 54.817 42.857 2.729
113 2HA GLY 14 1HA GLY 14 55.964 42.886 4.074
114 H LYS 15 H LYS 15 53.425 42.925 5.917
115 HA LYS 15 HA LYS 15 52.964 40.001 6.012
116 1HB LYS 15 2HB LYS 15 52.185 42.283 7.844
117 2HB LYS 15 1HB LYS 15 51.775 40.573 8.104
118 1HG LYS 15 1HG LYS 15 54.127 39.958 8.241
119 2HG LYS 15 2HG LYS 15 54.629 41.610 7.827
120 1HD LYS 15 2HD LYS 15 53.550 42.468 9.871
121 2HD LYS 15 1HD LYS 15 53.047 40.818 10.309
122 1HE LYS 15 2HE LYS 15 55.423 40.118 10.392
123 2HE LYS 15 1HE LYS 15 55.925 41.764 9.952
124 1HZ LYS 15 1HZ LYS 15 56.044 41.398 12.296
125 2HZ LYS 15 2HZ LYS 15 54.907 42.545 11.959
126 3HZ LYS 15 3HZ LYS 15 54.441 41.017 12.369
127 H ASP 16 H ASP 16 51.450 43.106 5.230
128 HA ASP 16 HA ASP 16 48.804 42.039 4.686
129 1HB ASP 16 1HB ASP 16 49.270 44.431 5.166
130 2HB ASP 16 2HB ASP 16 50.231 44.535 3.681
131 HD2 ASP 16 HD2 ASP 16 49.180 44.349 1.726
132 H LEU 17 H LEU 17 51.938 42.167 3.119
133 HA LEU 17 HA LEU 17 50.914 41.549 0.450
134 1HB LEU 17 2HB LEU 17 53.018 43.028 1.342
135 2HB LEU 17 1HB LEU 17 53.840 41.476 1.090
136 HG LEU 17 HG LEU 17 52.124 43.008 -0.896
137 1HD1 LEU 17 1HD2 LEU 17 54.265 44.133 -0.397
138 2HD1 LEU 17 2HD2 LEU 17 54.267 43.490 -2.053
139 3HD1 LEU 17 3HD2 LEU 17 55.149 42.635 -0.767
140 1HD2 LEU 17 1HD1 LEU 17 53.815 40.489 -1.263
141 2HD2 LEU 17 2HD1 LEU 17 52.047 40.614 -1.424
142 3HD2 LEU 17 3HD1 LEU 17 53.099 41.421 -2.596
143 H VAL 18 H VAL 18 52.944 40.166 3.103
144 HA VAL 18 HA VAL 18 53.091 37.559 1.791
145 HB VAL 18 HB VAL 18 53.655 38.480 4.614
146 1HG1 VAL 18 1HG2 VAL 18 52.739 36.233 4.877
147 2HG1 VAL 18 2HG2 VAL 18 53.742 35.636 3.531
148 3HG1 VAL 18 3HG2 VAL 18 54.500 36.178 5.044
149 1HG2 VAL 18 1HG1 VAL 18 55.375 37.170 2.456
150 2HG2 VAL 18 2HG1 VAL 18 55.940 37.851 3.996
151 3HG2 VAL 18 3HG1 VAL 18 55.305 38.920 2.728
152 H LYS 19 H LYS 19 50.750 39.309 3.714
153 HA LYS 19 HA LYS 19 49.066 37.029 4.372
154 1HB LYS 19 2HB LYS 19 49.115 39.202 5.584
155 2HB LYS 19 1HB LYS 19 48.325 39.956 4.180
156 1HG LYS 19 1HG LYS 19 46.458 38.313 4.381
157 2HG LYS 19 2HG LYS 19 47.239 37.603 5.807
158 1HD LYS 19 1HD LYS 19 46.320 40.495 5.551
159 2HD LYS 19 2HD LYS 19 45.406 39.189 6.338
160 1HE LYS 19 2HE LYS 19 47.289 38.863 7.943
161 2HE LYS 19 1HE LYS 19 48.121 40.257 7.220
162 1HZ LYS 19 1HZ LYS 19 46.902 40.868 9.154
163 2HZ LYS 19 2HZ LYS 19 46.263 41.608 7.825
164 3HZ LYS 19 3HZ LYS 19 45.489 40.318 8.503
165 H GLY 20 H GLY 20 49.369 39.399 1.755
166 1HA GLY 20 1HA GLY 20 46.962 38.683 0.326
167 2HA GLY 20 2HA GLY 20 48.315 39.677 -0.254
168 H ALA 21 H ALA 21 50.464 37.893 0.093
169 HA ALA 21 HA ALA 21 50.240 36.081 -2.115
170 1HB ALA 21 1HB ALA 21 52.430 35.278 -1.353
171 2HB ALA 21 2HB ALA 21 52.383 37.055 -1.340
172 3HB ALA 21 3HB ALA 21 52.234 36.148 0.184
173 H ALA 22 H ALA 22 49.688 35.859 1.373
174 HA ALA 22 HA ALA 22 49.355 32.941 1.245
175 1HB ALA 22 1HB ALA 22 49.111 34.852 3.588
176 2HB ALA 22 2HB ALA 22 50.571 33.943 3.130
177 3HB ALA 22 3HB ALA 22 49.121 33.077 3.670
178 H GLN 23 H GLN 23 47.451 34.854 -0.181
179 HA GLN 23 HA GLN 23 44.948 34.615 1.276
180 1HB GLN 23 2HB GLN 23 45.498 36.495 -0.208
181 2HB GLN 23 1HB GLN 23 45.559 35.408 -1.606
182 1HG GLN 23 2HG GLN 23 43.124 35.810 0.188
183 2HG GLN 23 1HG GLN 23 43.432 36.724 -1.298
184 1HE2 GLN 23 1HE2 GLN 23 41.499 34.371 -0.233
185 2HE2 GLN 23 2HE2 GLN 23 41.382 33.363 -1.659
186 H GLY 24 H GLY 24 46.385 33.177 -1.709
187 1HA GLY 24 2HA GLY 24 45.215 30.577 -1.209
188 2HA GLY 24 1HA GLY 24 44.383 31.474 -2.501
189 H VAL 25 H VAL 25 47.572 30.335 -1.377
190 HA VAL 25 HA VAL 25 49.097 31.125 -3.591
191 HB VAL 25 HB VAL 25 49.487 28.736 -1.729
192 1HG1 VAL 25 1HG2 VAL 25 50.921 28.565 -3.731
193 2HG1 VAL 25 2HG2 VAL 25 51.460 30.245 -3.500
194 3HG1 VAL 25 3HG2 VAL 25 51.887 28.997 -2.309
195 1HG2 VAL 25 1HG1 VAL 25 50.498 31.604 -1.570
196 2HG2 VAL 25 2HG1 VAL 25 50.963 30.277 -0.480
197 3HG2 VAL 25 3HG1 VAL 25 49.290 30.861 -0.494
198 H LEU 26 H LEU 26 47.762 27.872 -2.851
199 HA LEU 26 HA LEU 26 48.369 26.655 -5.331
200 1HB LEU 26 2HB LEU 26 46.098 26.092 -3.388
201 2HB LEU 26 1HB LEU 26 46.697 24.987 -4.632
202 HG LEU 26 HG LEU 26 48.298 25.996 -2.235
203 1HD1 LEU 26 1HD1 LEU 26 48.089 23.677 -1.443
204 2HD1 LEU 26 2HD1 LEU 26 46.491 24.425 -1.642
205 3HD1 LEU 26 3HD1 LEU 26 47.089 23.272 -2.857
206 1HD2 LEU 26 1HD2 LEU 26 49.927 24.234 -2.933
207 2HD2 LEU 26 2HD2 LEU 26 49.802 25.539 -4.122
208 3HD2 LEU 26 3HD2 LEU 26 48.990 23.983 -4.421
209 H SER 27 H SER 27 45.646 28.700 -4.311
210 HA SER 27 HA SER 27 44.022 28.187 -6.641
211 1HB SER 27 1HB SER 27 43.100 29.020 -4.508
212 2HB SER 27 2HB SER 27 44.023 30.528 -4.693
213 HG SER 27 HG SER 27 41.877 30.703 -5.465
214 H THR 28 H THR 28 46.537 30.619 -5.790
215 HA THR 28 HA THR 28 46.042 32.257 -8.049
216 HB THR 28 HB THR 28 48.592 31.972 -6.428
217 HG1 THR 28 HG1 THR 28 47.704 33.831 -5.429
218 1HG2 THR 28 1HG2 THR 28 47.607 34.067 -8.423
219 2HG2 THR 28 2HG2 THR 28 49.057 33.058 -8.581
220 3HG2 THR 28 3HG2 THR 28 48.985 34.307 -7.329
221 H VAL 29 H VAL 29 48.076 29.355 -7.597
222 HA VAL 29 HA VAL 29 49.639 29.444 -9.906
223 HB VAL 29 HB VAL 29 48.307 27.087 -8.522
224 1HG1 VAL 29 1HG1 VAL 29 49.029 26.406 -10.751
225 2HG1 VAL 29 2HG1 VAL 29 50.611 27.190 -10.505
226 3HG1 VAL 29 3HG1 VAL 29 50.153 25.766 -9.540
227 1HG2 VAL 29 1HG2 VAL 29 51.092 28.308 -8.265
228 2HG2 VAL 29 2HG2 VAL 29 50.524 26.840 -7.441
229 3HG2 VAL 29 3HG2 VAL 29 49.803 28.409 -7.046
230 H SER 30 H SER 30 46.171 28.826 -9.525
231 HA SER 30 HA SER 30 45.867 27.615 -12.096
232 1HB SER 30 1HB SER 30 44.353 27.112 -10.215
233 2HB SER 30 2HB SER 30 43.822 28.802 -10.154
234 HG SER 30 HG SER 30 42.389 27.461 -11.339
235 H CYS 31 H CYS 31 44.624 30.800 -10.947
236 HA CYS 31 HA CYS 31 44.093 31.860 -13.535
237 1HB CYS 31 2HB CYS 31 44.443 34.071 -12.456
238 2HB CYS 31 1HB CYS 31 43.337 33.024 -11.575
239 H LYS 32 H LYS 32 47.133 31.035 -12.017
240 HA LYS 32 HA LYS 32 48.506 33.362 -12.979
241 1HB LYS 32 1HB LYS 32 48.838 32.407 -10.824
242 2HB LYS 32 2HB LYS 32 49.531 30.936 -11.558
243 1HG LYS 32 2HG LYS 32 51.287 32.312 -12.619
244 2HG LYS 32 1HG LYS 32 50.541 33.792 -11.986
245 1HD LYS 32 2HD LYS 32 50.974 33.134 -9.693
246 2HD LYS 32 1HD LYS 32 51.399 31.500 -10.228
247 1HE LYS 32 1HE LYS 32 53.424 32.805 -9.635
248 2HE LYS 32 2HE LYS 32 53.408 32.345 -11.348
249 1HZ LYS 32 1HZ LYS 32 54.054 34.612 -11.044
250 2HZ LYS 32 2HZ LYS 32 52.627 34.538 -11.867
251 3HZ LYS 32 3HZ LYS 32 52.640 34.965 -10.274
252 H LEU 33 H LEU 33 47.682 32.682 -15.113
253 HA LEU 33 HA LEU 33 49.662 31.171 -16.745
254 1HB LEU 33 1HB LEU 33 47.256 32.843 -17.580
255 2HB LEU 33 2HB LEU 33 48.251 31.837 -18.646
256 HG LEU 33 HG LEU 33 46.539 30.825 -16.325
257 1HD1 LEU 33 1HD2 LEU 33 46.162 30.635 -19.342
258 2HD1 LEU 33 2HD2 LEU 33 45.116 29.897 -18.107
259 3HD1 LEU 33 3HD2 LEU 33 45.224 31.665 -18.237
260 1HD2 LEU 33 1HD1 LEU 33 48.467 29.341 -16.674
261 2HD2 LEU 33 2HD1 LEU 33 47.005 28.581 -17.321
262 3HD2 LEU 33 3HD1 LEU 33 48.172 29.334 -18.430
263 H ALA 34 H ALA 34 48.339 34.501 -16.428
264 HA ALA 34 HA ALA 34 51.033 35.619 -16.645
265 1HB ALA 34 1HB ALA 34 50.349 35.391 -19.014
266 2HB ALA 34 2HB ALA 34 50.462 37.097 -18.535
267 3HB ALA 34 3HB ALA 34 48.870 36.317 -18.673
268 H LYS 35 H LYS 35 48.059 35.566 -15.220
269 HA LYS 35 HA LYS 35 47.785 38.420 -14.645
270 1HB LYS 35 2HB LYS 35 45.834 37.626 -13.332
271 2HB LYS 35 1HB LYS 35 45.748 37.428 -15.087
272 1HG LYS 35 1HG LYS 35 46.105 35.126 -15.021
273 2HG LYS 35 2HG LYS 35 46.799 35.168 -13.393
274 1HD LYS 35 2HD LYS 35 44.878 34.402 -12.708
275 2HD LYS 35 1HD LYS 35 44.326 36.085 -12.805
276 1HE LYS 35 2HE LYS 35 43.976 33.987 -14.994
277 2HE LYS 35 1HE LYS 35 42.704 34.625 -13.937
278 1HZ LYS 35 1HZ LYS 35 43.077 36.780 -14.903
279 2HZ LYS 35 2HZ LYS 35 44.243 36.173 -15.899
280 3HZ LYS 35 3HZ LYS 35 42.681 35.675 -16.061
281 H THR 36 H THR 36 48.579 35.409 -12.883
282 HA THR 36 HA THR 36 49.189 35.069 -10.746
283 HB THR 36 HB THR 36 49.987 37.993 -10.453
284 HG1 THR 36 HG1 THR 36 50.966 37.122 -12.306
285 1HG2 THR 36 1HG2 THR 36 51.704 36.975 -8.956
286 2HG2 THR 36 2HG2 THR 36 50.927 35.394 -9.177
287 3HG2 THR 36 3HG2 THR 36 50.056 36.711 -8.366
288 H CYS 37 H CYS 37 46.646 36.554 -11.906
289 HA CYS 37 HA CYS 37 44.513 36.769 -11.053
290 1HB CYS 37 2HB CYS 37 45.892 35.942 -8.525
291 2HB CYS 37 1HB CYS 37 44.361 36.795 -8.402
292 HXT CYS 37 HO OH 38 44.030 39.946 -9.618
Start of MODEL 8
1 1H GLY 1 1H GLY 1 65.070 53.362 12.869
2 2H GLY 1 2H GLY 1 66.687 53.297 13.189
3 3H GLY 1 3H GLY 1 66.038 52.329 12.022
4 1HA GLY 1 2HA GLY 1 66.190 55.256 11.952
5 2HA GLY 1 1HA GLY 1 67.220 54.142 11.033
6 H ILE 2 H ILE 2 66.004 55.935 9.517
7 HA ILE 2 HA ILE 2 63.385 55.292 8.638
8 HB ILE 2 HB ILE 2 64.912 57.389 8.374
9 1HG1 ILE 2 2HG1 ILE 2 62.614 57.409 7.797
10 2HG1 ILE 2 1HG1 ILE 2 63.568 58.251 6.571
11 1HG2 ILE 2 1HG2 ILE 2 65.519 56.002 5.740
12 2HG2 ILE 2 2HG2 ILE 2 66.673 56.348 7.052
13 3HG2 ILE 2 3HG2 ILE 2 65.900 57.679 6.173
14 1HD1 ILE 2 1HD1 ILE 2 63.407 56.171 5.122
15 2HD1 ILE 2 2HD1 ILE 2 61.871 56.995 5.445
16 3HD1 ILE 2 3HD1 ILE 2 62.265 55.518 6.328
17 H LEU 3 H LEU 3 66.598 54.002 7.873
18 HA LEU 3 HA LEU 3 65.878 52.483 5.562
19 1HB LEU 3 1HB LEU 3 68.029 52.274 7.700
20 2HB LEU 3 2HB LEU 3 67.877 51.047 6.443
21 HG LEU 3 HG LEU 3 69.605 52.714 5.969
22 1HD1 LEU 3 1HD1 LEU 3 68.495 51.442 4.154
23 2HD1 LEU 3 2HD1 LEU 3 67.326 52.766 3.948
24 3HD1 LEU 3 3HD1 LEU 3 69.047 53.044 3.624
25 1HD2 LEU 3 1HD2 LEU 3 69.094 54.964 5.281
26 2HD2 LEU 3 2HD2 LEU 3 68.455 54.714 6.919
27 3HD2 LEU 3 3HD2 LEU 3 67.358 54.695 5.510
28 H ASP 4 H ASP 4 65.121 52.036 8.967
29 HA ASP 4 HA ASP 4 64.602 49.146 8.617
30 1HB ASP 4 2HB ASP 4 64.463 50.979 11.050
31 2HB ASP 4 1HB ASP 4 64.188 49.234 11.030
32 HD2 ASP 4 HD2 ASP 4 66.548 51.710 10.414
33 H THR 5 H THR 5 63.201 52.324 8.511
34 HA THR 5 HA THR 5 60.635 51.548 9.456
35 HB THR 5 HB THR 5 61.474 54.025 7.906
36 HG1 THR 5 HG1 THR 5 61.144 53.504 10.678
37 1HG2 THR 5 1HG2 THR 5 59.446 55.033 8.919
38 2HG2 THR 5 2HG2 THR 5 59.033 53.706 7.817
39 3HG2 THR 5 3HG2 THR 5 58.992 53.446 9.577
40 H LEU 6 H LEU 6 62.086 52.161 6.246
41 HA LEU 6 HA LEU 6 59.812 51.630 4.624
42 1HB LEU 6 1HB LEU 6 62.767 51.148 4.076
43 2HB LEU 6 2HB LEU 6 61.487 51.238 2.855
44 HG LEU 6 HG LEU 6 62.335 53.519 4.702
45 1HD1 LEU 6 1HD2 LEU 6 64.037 52.936 3.016
46 2HD1 LEU 6 2HD2 LEU 6 63.278 54.501 2.653
47 3HD1 LEU 6 3HD2 LEU 6 62.812 53.053 1.732
48 1HD2 LEU 6 1HD1 LEU 6 60.361 53.425 2.377
49 2HD2 LEU 6 2HD1 LEU 6 60.936 54.908 3.170
50 3HD2 LEU 6 3HD1 LEU 6 59.966 53.742 4.083
51 H LYS 7 H LYS 7 62.311 49.525 6.062
52 HA LYS 7 HA LYS 7 61.477 47.081 4.826
53 1HB LYS 7 1HB LYS 7 63.046 47.766 7.334
54 2HB LYS 7 2HB LYS 7 62.685 46.100 6.865
55 1HG LYS 7 2HG LYS 7 64.890 46.694 6.093
56 2HG LYS 7 1HG LYS 7 63.820 46.408 4.710
57 1HD LYS 7 1HD LYS 7 63.619 48.810 4.310
58 2HD LYS 7 2HD LYS 7 64.478 49.168 5.826
59 1HE LYS 7 2HE LYS 7 65.977 49.440 3.919
60 2HE LYS 7 1HE LYS 7 66.512 48.080 4.925
61 1HZ LYS 7 1HZ LYS 7 64.957 47.872 2.442
62 2HZ LYS 7 2HZ LYS 7 65.470 46.605 3.365
63 3HZ LYS 7 3HZ LYS 7 66.570 47.565 2.600
64 H GLN 8 H GLN 8 60.711 48.627 7.983
65 HA GLN 8 HA GLN 8 58.956 46.619 8.944
66 1HB GLN 8 1HB GLN 8 60.008 48.385 10.311
67 2HB GLN 8 2HB GLN 8 59.017 49.615 9.503
68 1HG GLN 8 1HG GLN 8 56.967 48.526 10.333
69 2HG GLN 8 2HG GLN 8 57.944 47.261 11.109
70 1HE2 GLN 8 1HE2 GLN 8 59.687 48.130 12.677
71 2HE2 GLN 8 2HE2 GLN 8 59.196 49.445 13.723
72 H PHE 9 H PHE 9 58.394 49.643 7.098
73 HA PHE 9 HA PHE 9 55.569 49.422 6.887
74 1HB PHE 9 2HB PHE 9 56.819 51.473 6.418
75 2HB PHE 9 1HB PHE 9 57.609 50.706 5.038
76 HD1 PHE 9 HD1 PHE 9 54.351 51.938 6.351
77 HD2 PHE 9 HD2 PHE 9 56.502 50.508 2.907
78 HE1 PHE 9 HE1 PHE 9 52.483 52.653 4.884
79 HE2 PHE 9 HE2 PHE 9 54.631 51.222 1.445
80 HZ PHE 9 HZ PHE 9 52.624 52.301 2.431
81 H ALA 10 H ALA 10 58.200 48.392 4.650
82 HA ALA 10 HA ALA 10 56.485 47.167 2.728
83 1HB ALA 10 1HB ALA 10 59.413 46.645 3.382
84 2HB ALA 10 2HB ALA 10 58.795 47.873 2.252
85 3HB ALA 10 3HB ALA 10 58.567 46.146 1.900
86 H LYS 11 H LYS 11 57.852 46.033 5.809
87 HA LYS 11 HA LYS 11 57.313 43.254 5.349
88 1HB LYS 11 2HB LYS 11 59.000 44.122 6.969
89 2HB LYS 11 1HB LYS 11 57.703 44.860 7.912
90 1HG LYS 11 2HG LYS 11 58.425 42.746 8.918
91 2HG LYS 11 1HG LYS 11 56.736 42.676 8.410
92 1HD LYS 11 2HD LYS 11 57.894 40.605 7.855
93 2HD LYS 11 1HD LYS 11 57.357 41.422 6.385
94 1HE LYS 11 2HE LYS 11 59.620 40.491 6.134
95 2HE LYS 11 1HE LYS 11 59.656 42.254 5.993
96 1HZ LYS 11 1HZ LYS 11 60.389 42.349 8.266
97 2HZ LYS 11 2HZ LYS 11 61.410 41.415 7.371
98 3HZ LYS 11 3HZ LYS 11 60.331 40.706 8.397
99 H GLY 12 H GLY 12 55.552 45.978 6.884
100 1HA GLY 12 1HA GLY 12 53.315 44.236 7.565
101 2HA GLY 12 2HA GLY 12 53.418 45.997 7.858
102 H VAL 13 H VAL 13 54.156 46.493 4.982
103 HA VAL 13 HA VAL 13 51.686 45.620 3.593
104 HB VAL 13 HB VAL 13 53.953 47.456 2.696
105 1HG1 VAL 13 1HG2 VAL 13 52.680 46.557 0.775
106 2HG1 VAL 13 2HG2 VAL 13 52.274 48.259 1.021
107 3HG1 VAL 13 3HG2 VAL 13 51.153 46.994 1.577
108 1HG2 VAL 13 1HG1 VAL 13 52.337 49.327 3.098
109 2HG2 VAL 13 2HG1 VAL 13 52.777 48.502 4.600
110 3HG2 VAL 13 3HG1 VAL 13 51.210 48.167 3.831
111 H GLY 14 H GLY 14 53.274 43.703 4.584
112 1HA GLY 14 1HA GLY 14 54.308 42.396 2.126
113 2HA GLY 14 2HA GLY 14 55.310 42.447 3.589
114 H LYS 15 H LYS 15 52.953 42.374 5.392
115 HA LYS 15 HA LYS 15 52.399 39.465 5.271
116 1HB LYS 15 1HB LYS 15 51.618 39.668 7.504
117 2HB LYS 15 2HB LYS 15 53.193 40.479 7.365
118 1HG LYS 15 1HG LYS 15 51.881 42.654 7.028
119 2HG LYS 15 2HG LYS 15 50.431 41.773 7.531
120 1HD LYS 15 1HD LYS 15 52.991 42.032 9.176
121 2HD LYS 15 2HD LYS 15 51.560 43.063 9.345
122 1HE LYS 15 1HE LYS 15 50.186 41.054 9.883
123 2HE LYS 15 2HE LYS 15 51.641 40.041 9.769
124 1HZ LYS 15 1HZ LYS 15 52.587 41.308 11.547
125 2HZ LYS 15 2HZ LYS 15 51.236 42.247 11.656
126 3HZ LYS 15 3HZ LYS 15 51.153 40.639 12.011
127 H ASP 16 H ASP 16 50.978 42.564 4.563
128 HA ASP 16 HA ASP 16 48.231 41.617 4.363
129 1HB ASP 16 1HB ASP 16 48.919 44.008 4.706
130 2HB ASP 16 2HB ASP 16 49.602 44.011 3.076
131 HD2 ASP 16 HD2 ASP 16 48.166 43.664 1.345
132 H LEU 17 H LEU 17 51.211 41.551 2.475
133 HA LEU 17 HA LEU 17 49.897 40.935 -0.082
134 1HB LEU 17 1HB LEU 17 52.740 41.320 0.909
135 2HB LEU 17 2HB LEU 17 52.378 40.769 -0.713
136 HG LEU 17 HG LEU 17 52.878 43.231 -0.441
137 1HD1 LEU 17 1HD1 LEU 17 51.861 42.257 -2.469
138 2HD1 LEU 17 2HD1 LEU 17 51.228 43.883 -2.148
139 3HD1 LEU 17 3HD1 LEU 17 50.242 42.457 -1.763
140 1HD2 LEU 17 1HD2 LEU 17 50.007 43.419 0.529
141 2HD2 LEU 17 2HD2 LEU 17 51.121 44.752 0.193
142 3HD2 LEU 17 3HD2 LEU 17 51.444 43.662 1.555
143 H VAL 18 H VAL 18 52.153 39.545 2.375
144 HA VAL 18 HA VAL 18 52.136 36.942 1.110
145 HB VAL 18 HB VAL 18 53.013 37.910 3.845
146 1HG1 VAL 18 1HG2 VAL 18 53.138 35.093 2.693
147 2HG1 VAL 18 2HG2 VAL 18 52.261 35.603 4.156
148 3HG1 VAL 18 3HG2 VAL 18 54.030 35.651 4.125
149 1HG2 VAL 18 1HG1 VAL 18 54.529 36.769 1.453
150 2HG2 VAL 18 2HG1 VAL 18 55.243 37.408 2.948
151 3HG2 VAL 18 3HG1 VAL 18 54.406 38.498 1.825
152 H LYS 19 H LYS 19 50.113 38.728 3.359
153 HA LYS 19 HA LYS 19 48.519 36.474 4.248
154 1HB LYS 19 1HB LYS 19 48.653 38.597 5.500
155 2HB LYS 19 2HB LYS 19 47.934 39.456 4.125
156 1HG LYS 19 2HG LYS 19 46.271 39.034 5.863
157 2HG LYS 19 1HG LYS 19 45.846 38.170 4.378
158 1HD LYS 19 2HD LYS 19 46.712 36.063 5.333
159 2HD LYS 19 1HD LYS 19 47.294 36.937 6.767
160 1HE LYS 19 1HE LYS 19 45.195 35.805 7.273
161 2HE LYS 19 2HE LYS 19 44.957 37.563 7.323
162 1HZ LYS 19 1HZ LYS 19 43.202 36.440 6.164
163 2HZ LYS 19 2HZ LYS 19 44.265 35.799 5.078
164 3HZ LYS 19 3HZ LYS 19 44.022 37.430 5.132
165 H GLY 20 H GLY 20 48.565 38.717 1.527
166 1HA GLY 20 2HA GLY 20 45.967 38.046 0.442
167 2HA GLY 20 1HA GLY 20 47.288 38.922 -0.363
168 H ALA 21 H ALA 21 49.389 37.121 -0.204
169 HA ALA 21 HA ALA 21 48.786 35.183 -2.223
170 1HB ALA 21 1HB ALA 21 51.176 35.404 -0.352
171 2HB ALA 21 2HB ALA 21 51.015 36.215 -1.928
172 3HB ALA 21 3HB ALA 21 51.095 34.441 -1.844
173 H ALA 22 H ALA 22 48.772 35.156 1.310
174 HA ALA 22 HA ALA 22 48.911 32.311 1.640
175 1HB ALA 22 1HB ALA 22 49.380 33.902 3.462
176 2HB ALA 22 2HB ALA 22 48.127 32.727 3.907
177 3HB ALA 22 3HB ALA 22 47.666 34.384 3.477
178 H GLN 23 H GLN 23 46.373 34.377 0.485
179 HA GLN 23 HA GLN 23 44.058 33.040 1.301
180 1HB GLN 23 2HB GLN 23 44.153 35.215 0.139
181 2HB GLN 23 1HB GLN 23 44.671 34.403 -1.354
182 1HG GLN 23 2HG GLN 23 42.552 33.152 -1.424
183 2HG GLN 23 1HG GLN 23 42.067 33.861 0.129
184 1HE2 GLN 23 1HE2 GLN 23 43.243 34.930 -3.127
185 2HE2 GLN 23 2HE2 GLN 23 42.130 36.272 -3.269
186 H GLY 24 H GLY 24 46.321 32.314 -1.403
187 1HA GLY 24 1HA GLY 24 45.596 29.533 -1.425
188 2HA GLY 24 2HA GLY 24 44.873 30.403 -2.798
189 H VAL 25 H VAL 25 47.961 29.788 -1.087
190 HA VAL 25 HA VAL 25 49.712 31.037 -2.821
191 HB VAL 25 HB VAL 25 51.398 29.484 -1.920
192 1HG1 VAL 25 1HG1 VAL 25 51.134 30.115 0.427
193 2HG1 VAL 25 2HG1 VAL 25 50.634 31.453 -0.631
194 3HG1 VAL 25 3HG1 VAL 25 49.407 30.442 0.173
195 1HG2 VAL 25 1HG2 VAL 25 50.739 27.823 -0.186
196 2HG2 VAL 25 2HG2 VAL 25 50.229 27.361 -1.811
197 3HG2 VAL 25 3HG2 VAL 25 49.042 28.022 -0.660
198 H LEU 26 H LEU 26 48.382 27.769 -2.965
199 HA LEU 26 HA LEU 26 49.812 26.700 -5.121
200 1HB LEU 26 1HB LEU 26 46.904 26.246 -4.373
201 2HB LEU 26 2HB LEU 26 47.899 25.173 -5.369
202 HG LEU 26 HG LEU 26 48.385 25.827 -2.426
203 1HD1 LEU 26 1HD2 LEU 26 47.392 23.300 -3.802
204 2HD1 LEU 26 2HD2 LEU 26 46.405 24.415 -2.829
205 3HD1 LEU 26 3HD2 LEU 26 47.714 23.490 -2.063
206 1HD2 LEU 26 1HD1 LEU 26 49.818 23.920 -4.331
207 2HD2 LEU 26 2HD1 LEU 26 50.045 23.966 -2.569
208 3HD2 LEU 26 3HD1 LEU 26 50.521 25.358 -3.553
209 H SER 27 H SER 27 46.959 28.855 -5.158
210 HA SER 27 HA SER 27 46.819 28.708 -8.099
211 1HB SER 27 2HB SER 27 44.809 30.069 -7.835
212 2HB SER 27 1HB SER 27 44.739 28.623 -6.810
213 HG SER 27 HG SER 27 44.100 30.526 -5.712
214 H THR 28 H THR 28 47.538 31.103 -5.511
215 HA THR 28 HA THR 28 47.810 33.405 -7.010
216 HB THR 28 HB THR 28 49.536 32.457 -4.688
217 HG1 THR 28 HG1 THR 28 48.023 33.665 -3.501
218 1HG2 THR 28 1HG2 THR 28 49.068 35.252 -5.818
219 2HG2 THR 28 2HG2 THR 28 50.606 34.362 -5.820
220 3HG2 THR 28 3HG2 THR 28 49.898 34.892 -4.289
221 H VAL 29 H VAL 29 50.411 31.030 -6.301
222 HA VAL 29 HA VAL 29 52.502 32.194 -7.685
223 HB VAL 29 HB VAL 29 52.543 30.202 -6.202
224 1HG1 VAL 29 1HG1 VAL 29 52.150 27.977 -7.074
225 2HG1 VAL 29 2HG1 VAL 29 50.678 28.954 -7.239
226 3HG1 VAL 29 3HG1 VAL 29 51.697 28.625 -8.661
227 1HG2 VAL 29 1HG2 VAL 29 54.503 30.837 -7.586
228 2HG2 VAL 29 2HG2 VAL 29 54.404 29.080 -7.348
229 3HG2 VAL 29 3HG2 VAL 29 53.911 29.793 -8.898
230 H SER 30 H SER 30 49.773 30.397 -8.938
231 HA SER 30 HA SER 30 50.825 30.401 -11.673
232 1HB SER 30 2HB SER 30 49.452 28.492 -10.630
233 2HB SER 30 1HB SER 30 48.059 29.575 -10.655
234 HG SER 30 HG SER 30 49.605 28.802 -12.908
235 H CYS 31 H CYS 31 47.866 31.650 -10.117
236 HA CYS 31 HA CYS 31 46.977 33.129 -12.330
237 1HB CYS 31 2HB CYS 31 46.610 33.874 -9.424
238 2HB CYS 31 1HB CYS 31 45.558 34.307 -10.774
239 H LYS 32 H LYS 32 49.873 33.745 -10.573
240 HA LYS 32 HA LYS 32 49.297 36.527 -10.102
241 1HB LYS 32 2HB LYS 32 51.375 36.770 -9.118
242 2HB LYS 32 1HB LYS 32 50.601 35.274 -8.584
243 1HG LYS 32 2HG LYS 32 51.980 34.140 -10.477
244 2HG LYS 32 1HG LYS 32 52.970 35.613 -10.479
245 1HD LYS 32 1HD LYS 32 52.280 34.122 -7.937
246 2HD LYS 32 2HD LYS 32 53.657 33.611 -8.943
247 1HE LYS 32 1HE LYS 32 54.551 34.959 -7.209
248 2HE LYS 32 2HE LYS 32 54.628 35.921 -8.695
249 1HZ LYS 32 1HZ LYS 32 52.537 36.151 -6.646
250 2HZ LYS 32 2HZ LYS 32 52.745 37.133 -7.957
251 3HZ LYS 32 3HZ LYS 32 53.862 37.126 -6.753
252 H LEU 33 H LEU 33 49.235 35.689 -12.952
253 HA LEU 33 HA LEU 33 51.252 37.137 -14.398
254 1HB LEU 33 2HB LEU 33 48.296 36.722 -15.008
255 2HB LEU 33 1HB LEU 33 49.530 37.248 -16.164
256 HG LEU 33 HG LEU 33 49.472 34.546 -14.738
257 1HD1 LEU 33 1HD1 LEU 33 47.673 34.823 -16.404
258 2HD1 LEU 33 2HD1 LEU 33 48.871 35.315 -17.622
259 3HD1 LEU 33 3HD1 LEU 33 48.898 33.664 -16.963
260 1HD2 LEU 33 1HD2 LEU 33 51.246 33.950 -16.392
261 2HD2 LEU 33 2HD2 LEU 33 51.308 35.648 -16.914
262 3HD2 LEU 33 3HD2 LEU 33 51.785 35.198 -15.259
263 H ALA 34 H ALA 34 48.178 38.013 -12.810
264 HA ALA 34 HA ALA 34 49.176 40.766 -12.484
265 1HB ALA 34 1HB ALA 34 47.780 40.850 -14.525
266 2HB ALA 34 2HB ALA 34 46.429 40.113 -13.634
267 3HB ALA 34 3HB ALA 34 47.020 41.731 -13.183
268 H LYS 35 H LYS 35 49.247 38.738 -10.643
269 HA LYS 35 HA LYS 35 48.576 38.006 -8.625
270 1HB LYS 35 1HB LYS 35 49.045 40.650 -8.538
271 2HB LYS 35 2HB LYS 35 47.364 40.658 -7.994
272 1HG LYS 35 2HG LYS 35 49.726 39.131 -6.809
273 2HG LYS 35 1HG LYS 35 48.884 40.514 -6.084
274 1HD LYS 35 1HD LYS 35 46.806 39.128 -5.933
275 2HD LYS 35 2HD LYS 35 47.719 37.748 -6.601
276 1HE LYS 35 1HE LYS 35 49.278 37.844 -4.689
277 2HE LYS 35 2HE LYS 35 48.404 39.244 -4.032
278 1HZ LYS 35 1HZ LYS 35 46.477 37.865 -3.813
279 2HZ LYS 35 2HZ LYS 35 47.747 37.218 -2.984
280 3HZ LYS 35 3HZ LYS 35 47.284 36.562 -4.424
281 H THR 36 H THR 36 46.797 37.148 -10.492
282 HA THR 36 HA THR 36 44.142 38.108 -10.117
283 HB THR 36 HB THR 36 45.160 35.599 -11.492
284 HG1 THR 36 HG1 THR 36 45.079 36.992 -13.300
285 1HG2 THR 36 1HG2 THR 36 42.735 35.459 -11.184
286 2HG2 THR 36 2HG2 THR 36 43.095 35.868 -12.868
287 3HG2 THR 36 3HG2 THR 36 42.540 37.136 -11.753
288 H CYS 37 H CYS 37 45.990 35.808 -8.293
289 HA CYS 37 HA CYS 37 43.542 35.154 -6.746
290 1HB CYS 37 2HB CYS 37 45.604 33.058 -7.449
291 2HB CYS 37 1HB CYS 37 44.114 32.840 -6.530
292 HXT CYS 37 HO OH 38 44.052 34.437 -4.658
Start of MODEL 9
1 1H GLY 1 1H GLY 1 68.267 58.156 8.220
2 2H GLY 1 2H GLY 1 68.958 57.194 9.367
3 3H GLY 1 3H GLY 1 69.385 58.783 9.258
4 1HA GLY 1 1HA GLY 1 67.950 58.453 11.121
5 2HA GLY 1 2HA GLY 1 67.213 59.495 9.889
6 H ILE 2 H ILE 2 66.171 57.933 8.029
7 HA ILE 2 HA ILE 2 63.972 56.601 9.388
8 HB ILE 2 HB ILE 2 63.128 56.374 7.049
9 1HG1 ILE 2 1HG1 ILE 2 65.472 58.132 6.228
10 2HG1 ILE 2 2HG1 ILE 2 65.437 56.382 5.959
11 1HG2 ILE 2 1HG2 ILE 2 62.595 58.282 8.545
12 2HG2 ILE 2 2HG2 ILE 2 63.971 59.181 7.871
13 3HG2 ILE 2 3HG2 ILE 2 62.589 58.753 6.840
14 1HD1 ILE 2 1HD1 ILE 2 64.677 57.484 3.954
15 2HD1 ILE 2 2HD1 ILE 2 63.300 56.642 4.695
16 3HD1 ILE 2 3HD1 ILE 2 63.456 58.407 4.851
17 H LEU 3 H LEU 3 66.033 55.179 10.160
18 HA LEU 3 HA LEU 3 66.753 53.083 8.291
19 1HB LEU 3 2HB LEU 3 67.354 53.416 11.256
20 2HB LEU 3 1HB LEU 3 68.168 52.315 10.136
21 HG LEU 3 HG LEU 3 68.216 55.364 10.021
22 1HD1 LEU 3 1HD2 LEU 3 69.519 54.395 11.875
23 2HD1 LEU 3 2HD2 LEU 3 70.581 55.096 10.635
24 3HD1 LEU 3 3HD2 LEU 3 70.369 53.333 10.728
25 1HD2 LEU 3 1HD1 LEU 3 68.382 54.458 7.745
26 2HD2 LEU 3 2HD1 LEU 3 69.972 55.023 8.279
27 3HD2 LEU 3 3HD1 LEU 3 69.609 53.283 8.279
28 H ASP 4 H ASP 4 64.791 53.335 11.249
29 HA ASP 4 HA ASP 4 63.988 50.489 11.059
30 1HB ASP 4 2HB ASP 4 63.479 52.674 13.121
31 2HB ASP 4 1HB ASP 4 62.854 51.021 13.204
32 HD2 ASP 4 HD2 ASP 4 66.780 51.759 13.951
33 H THR 5 H THR 5 63.165 53.605 9.945
34 HA THR 5 HA THR 5 60.362 53.484 10.358
35 HB THR 5 HB THR 5 62.046 55.191 8.497
36 HG1 THR 5 HG1 THR 5 61.807 56.677 10.221
37 1HG2 THR 5 1HG2 THR 5 59.178 55.555 9.467
38 2HG2 THR 5 2HG2 THR 5 60.125 56.775 8.586
39 3HG2 THR 5 3HG2 THR 5 59.693 55.250 7.790
40 H LEU 6 H LEU 6 62.328 53.319 7.324
41 HA LEU 6 HA LEU 6 60.279 52.346 5.621
42 1HB LEU 6 1HB LEU 6 63.280 51.829 5.559
43 2HB LEU 6 2HB LEU 6 62.160 51.571 4.212
44 HG LEU 6 HG LEU 6 62.774 54.266 5.510
45 1HD1 LEU 6 1HD1 LEU 6 63.946 54.719 3.382
46 2HD1 LEU 6 2HD1 LEU 6 64.663 53.334 4.231
47 3HD1 LEU 6 3HD1 LEU 6 63.596 53.065 2.834
48 1HD2 LEU 6 1HD2 LEU 6 61.562 55.175 3.518
49 2HD2 LEU 6 2HD2 LEU 6 60.495 54.257 4.592
50 3HD2 LEU 6 3HD2 LEU 6 61.082 53.521 3.081
51 H LYS 7 H LYS 7 62.576 50.666 7.800
52 HA LYS 7 HA LYS 7 62.089 48.020 7.062
53 1HB LYS 7 2HB LYS 7 63.905 48.835 8.466
54 2HB LYS 7 1HB LYS 7 62.759 49.223 9.764
55 1HG LYS 7 2HG LYS 7 62.172 46.877 10.021
56 2HG LYS 7 1HG LYS 7 63.149 46.436 8.593
57 1HD LYS 7 1HD LYS 7 65.174 47.270 9.679
58 2HD LYS 7 2HD LYS 7 64.240 47.771 11.103
59 1HE LYS 7 1HE LYS 7 64.487 44.896 10.097
60 2HE LYS 7 2HE LYS 7 65.445 45.591 11.419
61 1HZ LYS 7 1HZ LYS 7 62.525 45.339 11.390
62 2HZ LYS 7 2HZ LYS 7 63.574 44.392 12.238
63 3HZ LYS 7 3HZ LYS 7 63.425 45.992 12.607
64 H GLN 8 H GLN 8 60.391 50.105 9.474
65 HA GLN 8 HA GLN 8 58.653 48.149 10.494
66 1HB GLN 8 1HB GLN 8 59.060 50.361 11.515
67 2HB GLN 8 2HB GLN 8 58.269 51.153 10.146
68 1HG GLN 8 2HG GLN 8 56.765 51.035 12.036
69 2HG GLN 8 1HG GLN 8 56.138 50.056 10.702
70 1HE2 GLN 8 2HE2 GLN 8 56.101 47.748 10.911
71 2HE2 GLN 8 1HE2 GLN 8 56.318 46.964 12.461
72 H PHE 9 H PHE 9 58.150 50.548 7.860
73 HA PHE 9 HA PHE 9 55.561 49.577 7.117
74 1HB PHE 9 1HB PHE 9 57.626 51.157 5.540
75 2HB PHE 9 2HB PHE 9 55.940 50.920 5.067
76 HD1 PHE 9 HD1 PHE 9 58.034 53.317 6.340
77 HD2 PHE 9 HD2 PHE 9 54.239 51.469 7.195
78 HE1 PHE 9 HE1 PHE 9 57.322 55.339 7.585
79 HE2 PHE 9 HE2 PHE 9 53.548 53.480 8.464
80 HZ PHE 9 HZ PHE 9 55.090 55.416 8.664
81 H ALA 10 H ALA 10 58.870 48.800 5.975
82 HA ALA 10 HA ALA 10 58.071 47.096 3.830
83 1HB ALA 10 1HB ALA 10 60.348 46.191 4.012
84 2HB ALA 10 2HB ALA 10 60.364 47.965 4.110
85 3HB ALA 10 3HB ALA 10 60.558 46.989 5.585
86 H LYS 11 H LYS 11 58.519 46.566 7.343
87 HA LYS 11 HA LYS 11 57.715 43.740 7.141
88 1HB LYS 11 1HB LYS 11 58.271 45.574 9.503
89 2HB LYS 11 2HB LYS 11 57.810 43.861 9.629
90 1HG LYS 11 1HG LYS 11 59.791 43.172 8.380
91 2HG LYS 11 2HG LYS 11 60.247 44.859 8.098
92 1HD LYS 11 1HD LYS 11 61.599 43.978 9.883
93 2HD LYS 11 2HD LYS 11 60.497 45.199 10.550
94 1HE LYS 11 1HE LYS 11 59.025 43.422 11.416
95 2HE LYS 11 2HE LYS 11 60.041 42.183 10.647
96 1HZ LYS 11 1HZ LYS 11 60.888 44.036 12.756
97 2HZ LYS 11 2HZ LYS 11 61.833 42.884 12.050
98 3HZ LYS 11 3HZ LYS 11 60.529 42.439 12.956
99 H GLY 12 H GLY 12 55.933 45.445 5.890
100 1HA GLY 12 1HA GLY 12 53.502 44.574 7.091
101 2HA GLY 12 2HA GLY 12 53.657 46.358 7.200
102 H VAL 13 H VAL 13 55.159 46.664 4.747
103 HA VAL 13 HA VAL 13 53.433 45.527 2.636
104 HB VAL 13 HB VAL 13 55.894 47.323 2.464
105 1HG1 VAL 13 1HG2 VAL 13 55.394 46.153 0.332
106 2HG1 VAL 13 2HG2 VAL 13 55.012 47.874 0.200
107 3HG1 VAL 13 3HG2 VAL 13 53.703 46.692 0.438
108 1HG2 VAL 13 1HG1 VAL 13 54.118 48.547 3.660
109 2HG2 VAL 13 2HG1 VAL 13 52.943 48.097 2.404
110 3HG2 VAL 13 3HG1 VAL 13 54.290 49.190 2.021
111 H GLY 14 H GLY 14 54.490 43.823 4.348
112 1HA GLY 14 2HA GLY 14 56.196 42.133 2.654
113 2HA GLY 14 1HA GLY 14 56.812 42.525 4.273
114 H LYS 15 H LYS 15 54.059 42.793 5.372
115 HA LYS 15 HA LYS 15 53.443 39.972 5.923
116 1HB LYS 15 2HB LYS 15 52.166 42.575 6.818
117 2HB LYS 15 1HB LYS 15 51.735 40.946 7.388
118 1HG LYS 15 1HG LYS 15 53.977 40.633 8.333
119 2HG LYS 15 2HG LYS 15 54.517 42.178 7.651
120 1HD LYS 15 1HD LYS 15 54.061 42.479 9.998
121 2HD LYS 15 2HD LYS 15 52.872 43.388 9.044
122 1HE LYS 15 2HE LYS 15 51.192 41.622 9.423
123 2HE LYS 15 1HE LYS 15 52.401 40.633 10.271
124 1HZ LYS 15 1HZ LYS 15 51.434 43.269 11.119
125 2HZ LYS 15 2HZ LYS 15 50.996 41.819 11.773
126 3HZ LYS 15 3HZ LYS 15 52.551 42.351 11.913
127 H ASP 16 H ASP 16 52.111 42.860 4.306
128 HA ASP 16 HA ASP 16 49.690 41.720 3.319
129 1HB ASP 16 2HB ASP 16 50.211 44.146 3.492
130 2HB ASP 16 1HB ASP 16 51.426 43.968 2.218
131 HD2 ASP 16 HD2 ASP 16 50.750 43.594 0.154
132 H LEU 17 H LEU 17 53.038 41.276 2.452
133 HA LEU 17 HA LEU 17 52.462 40.382 -0.304
134 1HB LEU 17 1HB LEU 17 55.063 40.569 1.265
135 2HB LEU 17 2HB LEU 17 54.878 40.211 -0.454
136 HG LEU 17 HG LEU 17 54.259 42.855 0.924
137 1HD1 LEU 17 1HD1 LEU 17 56.656 42.368 0.441
138 2HD1 LEU 17 2HD1 LEU 17 56.241 42.080 -1.261
139 3HD1 LEU 17 3HD1 LEU 17 56.037 43.699 -0.559
140 1HD2 LEU 17 1HD2 LEU 17 53.801 42.019 -1.972
141 2HD2 LEU 17 2HD2 LEU 17 53.756 43.693 -1.378
142 3HD2 LEU 17 3HD2 LEU 17 52.557 42.526 -0.803
143 H VAL 18 H VAL 18 53.587 39.313 2.922
144 HA VAL 18 HA VAL 18 53.795 36.532 2.208
145 HB VAL 18 HB VAL 18 53.554 38.087 4.795
146 1HG1 VAL 18 1HG1 VAL 18 52.350 36.021 5.226
147 2HG1 VAL 18 2HG1 VAL 18 53.651 35.070 4.462
148 3HG1 VAL 18 3HG1 VAL 18 53.950 35.944 5.984
149 1HG2 VAL 18 1HG2 VAL 18 55.739 38.032 3.547
150 2HG2 VAL 18 2HG2 VAL 18 55.718 36.261 3.653
151 3HG2 VAL 18 3HG2 VAL 18 55.833 37.238 5.132
152 H LYS 19 H LYS 19 51.235 38.787 3.129
153 HA LYS 19 HA LYS 19 49.177 36.791 3.561
154 1HB LYS 19 1HB LYS 19 49.077 39.074 4.501
155 2HB LYS 19 2HB LYS 19 49.003 39.745 2.862
156 1HG LYS 19 2HG LYS 19 46.783 39.656 3.879
157 2HG LYS 19 1HG LYS 19 46.856 38.592 2.464
158 1HD LYS 19 1HD LYS 19 47.208 36.637 3.950
159 2HD LYS 19 2HD LYS 19 47.144 37.698 5.372
160 1HE LYS 19 1HE LYS 19 44.891 37.309 3.351
161 2HE LYS 19 2HE LYS 19 44.996 36.515 4.933
162 1HZ LYS 19 1HZ LYS 19 43.606 38.425 5.022
163 2HZ LYS 19 2HZ LYS 19 44.943 38.666 5.956
164 3HZ LYS 19 3HZ LYS 19 44.817 39.407 4.487
165 H GLY 20 H GLY 20 50.473 38.652 0.854
166 1HA GLY 20 1HA GLY 20 48.442 37.955 -1.085
167 2HA GLY 20 2HA GLY 20 50.025 38.701 -1.390
168 H ALA 21 H ALA 21 51.735 36.788 -0.216
169 HA ALA 21 HA ALA 21 51.826 34.656 -2.131
170 1HB ALA 21 1HB ALA 21 53.821 35.520 -0.948
171 2HB ALA 21 2HB ALA 21 53.156 34.932 0.594
172 3HB ALA 21 3HB ALA 21 53.605 33.776 -0.679
173 H ALA 22 H ALA 22 50.442 35.084 1.099
174 HA ALA 22 HA ALA 22 49.647 32.256 1.250
175 1HB ALA 22 1HB ALA 22 50.568 33.357 3.245
176 2HB ALA 22 2HB ALA 22 49.227 34.525 3.218
177 3HB ALA 22 3HB ALA 22 48.904 32.802 3.507
178 H GLN 23 H GLN 23 48.496 33.625 -0.942
179 HA GLN 23 HA GLN 23 45.764 34.383 -0.162
180 1HB GLN 23 2HB GLN 23 46.899 35.744 -1.788
181 2HB GLN 23 1HB GLN 23 47.257 34.338 -2.807
182 1HG GLN 23 1HG GLN 23 44.811 33.985 -3.141
183 2HG GLN 23 2HG GLN 23 44.486 35.406 -2.129
184 1HE2 GLN 23 1HE2 GLN 23 45.684 37.483 -2.895
185 2HE2 GLN 23 2HE2 GLN 23 45.694 37.767 -4.623
186 H GLY 24 H GLY 24 47.305 32.013 -2.433
187 1HA GLY 24 2HA GLY 24 44.777 30.547 -2.655
188 2HA GLY 24 1HA GLY 24 46.270 30.255 -3.553
189 H VAL 25 H VAL 25 47.676 28.117 -0.976
190 HA VAL 25 HA VAL 25 48.464 30.287 -2.771
191 HB VAL 25 HB VAL 25 49.959 27.816 -1.811
192 1HG1 VAL 25 1HG2 VAL 25 50.909 30.457 -3.008
193 2HG1 VAL 25 2HG2 VAL 25 50.965 28.869 -3.806
194 3HG1 VAL 25 3HG2 VAL 25 51.959 29.173 -2.371
195 1HG2 VAL 25 1HG1 VAL 25 50.987 29.378 -0.171
196 2HG2 VAL 25 2HG1 VAL 25 49.835 30.637 -0.676
197 3HG2 VAL 25 3HG1 VAL 25 49.252 29.153 0.115
198 H LEU 26 H LEU 26 47.969 26.761 -2.839
199 HA LEU 26 HA LEU 26 48.879 26.134 -5.384
200 1HB LEU 26 2HB LEU 26 46.529 24.959 -3.856
201 2HB LEU 26 1HB LEU 26 47.384 24.176 -5.191
202 HG LEU 26 HG LEU 26 48.615 24.917 -2.496
203 1HD1 LEU 26 1HD2 LEU 26 47.826 22.228 -3.685
204 2HD1 LEU 26 2HD2 LEU 26 46.979 23.075 -2.370
205 3HD1 LEU 26 3HD2 LEU 26 48.636 22.486 -2.123
206 1HD2 LEU 26 1HD1 LEU 26 49.752 23.409 -4.893
207 2HD2 LEU 26 2HD1 LEU 26 50.328 24.968 -4.256
208 3HD2 LEU 26 3HD1 LEU 26 50.512 23.496 -3.290
209 H SER 27 H SER 27 46.035 27.976 -4.585
210 HA SER 27 HA SER 27 44.711 27.436 -7.152
211 1HB SER 27 2HB SER 27 44.061 29.360 -4.878
212 2HB SER 27 1HB SER 27 43.015 28.985 -6.265
213 HG SER 27 HG SER 27 43.036 26.801 -5.562
214 H THR 28 H THR 28 46.290 30.213 -5.478
215 HA THR 28 HA THR 28 45.871 32.206 -7.324
216 HB THR 28 HB THR 28 48.389 31.665 -5.703
217 HG1 THR 28 HG1 THR 28 47.324 33.018 -4.234
218 1HG2 THR 28 1HG2 THR 28 47.328 34.231 -6.973
219 2HG2 THR 28 2HG2 THR 28 48.822 33.379 -7.423
220 3HG2 THR 28 3HG2 THR 28 48.685 34.139 -5.829
221 H VAL 29 H VAL 29 48.639 29.905 -7.310
222 HA VAL 29 HA VAL 29 50.052 30.813 -9.486
223 HB VAL 29 HB VAL 29 50.779 28.429 -9.705
224 1HG1 VAL 29 1HG2 VAL 29 51.894 30.052 -8.210
225 2HG1 VAL 29 2HG2 VAL 29 51.926 28.416 -7.523
226 3HG1 VAL 29 3HG2 VAL 29 50.776 29.617 -6.898
227 1HG2 VAL 29 1HG1 VAL 29 48.919 27.954 -7.350
228 2HG2 VAL 29 2HG1 VAL 29 48.718 27.275 -8.984
229 3HG2 VAL 29 3HG1 VAL 29 50.113 26.816 -7.996
230 H SER 30 H SER 30 47.175 28.669 -9.547
231 HA SER 30 HA SER 30 47.379 28.210 -12.363
232 1HB SER 30 1HB SER 30 45.420 26.949 -12.134
233 2HB SER 30 2HB SER 30 46.181 26.803 -10.534
234 HG SER 30 HG SER 30 44.777 28.427 -9.809
235 H CYS 31 H CYS 31 45.109 30.185 -10.454
236 HA CYS 31 HA CYS 31 44.202 31.638 -12.831
237 1HB CYS 31 1HB CYS 31 42.837 32.895 -11.146
238 2HB CYS 31 2HB CYS 31 42.561 31.157 -11.218
239 H LYS 32 H LYS 32 47.127 31.795 -12.010
240 HA LYS 32 HA LYS 32 47.428 34.513 -11.034
241 1HB LYS 32 1HB LYS 32 48.824 32.560 -10.387
242 2HB LYS 32 2HB LYS 32 49.497 32.504 -12.035
243 1HG LYS 32 2HG LYS 32 49.510 34.996 -10.344
244 2HG LYS 32 1HG LYS 32 50.760 33.746 -10.161
245 1HD LYS 32 2HD LYS 32 51.411 34.018 -12.520
246 2HD LYS 32 1HD LYS 32 50.149 35.254 -12.741
247 1HE LYS 32 1HE LYS 32 51.216 36.702 -11.084
248 2HE LYS 32 2HE LYS 32 52.407 35.445 -10.703
249 1HZ LYS 32 1HZ LYS 32 52.115 36.805 -13.291
250 2HZ LYS 32 2HZ LYS 32 53.227 35.638 -12.938
251 3HZ LYS 32 3HZ LYS 32 53.291 37.097 -12.172
252 H LEU 33 H LEU 33 47.985 32.734 -14.051
253 HA LEU 33 HA LEU 33 49.391 34.524 -15.556
254 1HB LEU 33 1HB LEU 33 48.825 32.264 -16.280
255 2HB LEU 33 2HB LEU 33 47.121 32.709 -16.448
256 HG LEU 33 HG LEU 33 47.709 34.306 -18.260
257 1HD1 LEU 33 1HD2 LEU 33 50.528 33.203 -17.870
258 2HD1 LEU 33 2HD2 LEU 33 50.014 34.891 -17.633
259 3HD1 LEU 33 3HD2 LEU 33 49.996 34.181 -19.255
260 1HD2 LEU 33 1HD1 LEU 33 48.800 31.491 -18.659
261 2HD2 LEU 33 2HD1 LEU 33 47.092 31.973 -18.777
262 3HD2 LEU 33 3HD1 LEU 33 48.275 32.602 -19.943
263 H ALA 34 H ALA 34 45.779 34.317 -15.823
264 HA ALA 34 HA ALA 34 45.624 36.964 -16.989
265 1HB ALA 34 1HB ALA 34 43.461 35.133 -15.872
266 2HB ALA 34 2HB ALA 34 43.187 36.579 -16.871
267 3HB ALA 34 3HB ALA 34 44.021 35.169 -17.560
268 H LYS 35 H LYS 35 46.079 35.849 -13.895
269 HA LYS 35 HA LYS 35 45.867 36.593 -11.820
270 1HB LYS 35 1HB LYS 35 47.590 38.028 -13.088
271 2HB LYS 35 2HB LYS 35 46.390 39.321 -12.999
272 1HG LYS 35 1HG LYS 35 48.033 39.430 -11.173
273 2HG LYS 35 2HG LYS 35 46.406 39.145 -10.521
274 1HD LYS 35 1HD LYS 35 46.878 36.784 -10.200
275 2HD LYS 35 2HD LYS 35 48.448 36.922 -11.012
276 1HE LYS 35 1HE LYS 35 47.663 38.366 -8.440
277 2HE LYS 35 2HE LYS 35 48.592 36.856 -8.517
278 1HZ LYS 35 1HZ LYS 35 49.423 39.424 -9.662
279 2HZ LYS 35 2HZ LYS 35 50.268 38.010 -9.752
280 3HZ LYS 35 3HZ LYS 35 50.015 38.729 -8.290
281 H THR 36 H THR 36 43.376 36.179 -12.563
282 HA THR 36 HA THR 36 41.717 38.389 -11.563
283 HB THR 36 HB THR 36 40.742 36.702 -13.058
284 HG1 THR 36 HG1 THR 36 39.483 37.727 -11.453
285 1HG2 THR 36 1HG2 THR 36 42.057 34.712 -12.378
286 2HG2 THR 36 2HG2 THR 36 41.253 34.728 -10.789
287 3HG2 THR 36 3HG2 THR 36 40.313 34.416 -12.261
288 H CYS 37 H CYS 37 43.977 36.077 -10.388
289 HA CYS 37 HA CYS 37 43.004 36.301 -7.579
290 1HB CYS 37 1HB CYS 37 44.865 34.365 -8.987
291 2HB CYS 37 2HB CYS 37 44.588 34.387 -7.243
292 HXT CYS 37 HO OH 38 45.522 38.810 -7.591
Start of MODEL 10
1 1H GLY 1 1H GLY 1 64.058 55.134 11.424
2 2H GLY 1 2H GLY 1 65.599 55.134 10.834
3 3H GLY 1 3H GLY 1 64.785 56.557 11.011
4 1HA GLY 1 2HA GLY 1 64.067 54.390 9.177
5 2HA GLY 1 1HA GLY 1 63.194 55.927 9.360
6 H ILE 2 H ILE 2 65.340 56.433 6.401
7 HA ILE 2 HA ILE 2 62.841 55.185 7.312
8 HB ILE 2 HB ILE 2 62.360 55.220 4.850
9 1HG1 ILE 2 2HG1 ILE 2 63.571 56.764 3.431
10 2HG1 ILE 2 1HG1 ILE 2 64.768 57.087 4.687
11 1HG2 ILE 2 1HG2 ILE 2 62.955 57.857 6.239
12 2HG2 ILE 2 2HG2 ILE 2 61.831 57.617 4.884
13 3HG2 ILE 2 3HG2 ILE 2 61.496 56.864 6.455
14 1HD1 ILE 2 1HD1 ILE 2 65.606 54.791 4.524
15 2HD1 ILE 2 2HD1 ILE 2 65.545 55.509 2.908
16 3HD1 ILE 2 3HD1 ILE 2 64.286 54.360 3.404
17 H LEU 3 H LEU 3 65.721 53.938 7.387
18 HA LEU 3 HA LEU 3 65.488 51.677 5.585
19 1HB LEU 3 1HB LEU 3 67.342 52.224 7.937
20 2HB LEU 3 2HB LEU 3 67.541 50.916 6.762
21 HG LEU 3 HG LEU 3 67.605 53.899 6.100
22 1HD1 LEU 3 1HD2 LEU 3 69.531 53.166 7.456
23 2HD1 LEU 3 2HD2 LEU 3 70.021 53.535 5.789
24 3HD1 LEU 3 3HD2 LEU 3 69.842 51.843 6.309
25 1HD2 LEU 3 1HD1 LEU 3 68.188 51.427 4.406
26 2HD2 LEU 3 2HD1 LEU 3 66.854 52.578 4.161
27 3HD2 LEU 3 3HD1 LEU 3 68.527 53.102 3.919
28 H ASP 4 H ASP 4 64.198 52.405 8.690
29 HA ASP 4 HA ASP 4 63.661 49.550 9.295
30 1HB ASP 4 2HB ASP 4 64.350 51.066 11.149
31 2HB ASP 4 1HB ASP 4 62.988 52.132 10.775
32 HD2 ASP 4 HD2 ASP 4 63.685 48.768 11.451
33 H THR 5 H THR 5 62.406 52.535 7.962
34 HA THR 5 HA THR 5 59.701 52.030 8.591
35 HB THR 5 HB THR 5 60.929 53.985 6.610
36 HG1 THR 5 HG1 THR 5 60.175 54.221 9.338
37 1HG2 THR 5 1HG2 THR 5 58.522 53.757 6.215
38 2HG2 THR 5 2HG2 THR 5 58.195 53.946 7.955
39 3HG2 THR 5 3HG2 THR 5 58.860 55.302 7.017
40 H LEU 6 H LEU 6 61.377 52.019 5.377
41 HA LEU 6 HA LEU 6 59.152 51.008 3.909
42 1HB LEU 6 2HB LEU 6 62.141 50.769 3.396
43 2HB LEU 6 1HB LEU 6 60.860 50.516 2.203
44 HG LEU 6 HG LEU 6 61.467 53.148 3.629
45 1HD1 LEU 6 1HD1 LEU 6 62.267 53.872 1.420
46 2HD1 LEU 6 2HD1 LEU 6 63.191 52.467 1.996
47 3HD1 LEU 6 3HD1 LEU 6 61.934 52.256 0.755
48 1HD2 LEU 6 1HD2 LEU 6 59.898 54.108 1.936
49 2HD2 LEU 6 2HD2 LEU 6 59.471 52.461 1.425
50 3HD2 LEU 6 3HD2 LEU 6 59.080 53.022 3.069
51 H LYS 7 H LYS 7 61.762 49.491 5.763
52 HA LYS 7 HA LYS 7 61.359 46.793 4.928
53 1HB LYS 7 2HB LYS 7 62.673 48.204 7.265
54 2HB LYS 7 1HB LYS 7 62.627 46.444 7.162
55 1HG LYS 7 2HG LYS 7 64.721 47.416 6.240
56 2HG LYS 7 1HG LYS 7 63.828 46.446 5.057
57 1HD LYS 7 2HD LYS 7 62.988 48.412 3.940
58 2HD LYS 7 1HD LYS 7 63.605 49.480 5.218
59 1HE LYS 7 2HE LYS 7 65.927 48.785 4.654
60 2HE LYS 7 1HE LYS 7 65.290 47.764 3.348
61 1HZ LYS 7 1HZ LYS 7 64.989 50.677 3.556
62 2HZ LYS 7 2HZ LYS 7 64.398 49.734 2.339
63 3HZ LYS 7 3HZ LYS 7 66.027 49.881 2.552
64 H GLN 8 H GLN 8 60.037 48.799 7.591
65 HA GLN 8 HA GLN 8 58.567 46.736 8.906
66 1HB GLN 8 2HB GLN 8 59.107 48.893 9.933
67 2HB GLN 8 1HB GLN 8 58.128 49.750 8.731
68 1HG GLN 8 1HG GLN 8 56.109 48.590 9.522
69 2HG GLN 8 2HG GLN 8 57.083 47.703 10.717
70 1HE2 GLN 8 2HE2 GLN 8 58.428 49.166 12.229
71 2HE2 GLN 8 1HE2 GLN 8 57.634 50.609 12.821
72 H PHE 9 H PHE 9 57.733 49.145 6.389
73 HA PHE 9 HA PHE 9 55.015 48.299 6.063
74 1HB PHE 9 2HB PHE 9 56.868 49.713 4.113
75 2HB PHE 9 1HB PHE 9 55.109 49.623 3.995
76 HD1 PHE 9 HD1 PHE 9 56.377 52.180 3.776
77 HD2 PHE 9 HD2 PHE 9 55.198 50.068 7.348
78 HE1 PHE 9 HE1 PHE 9 56.101 54.332 4.973
79 HE2 PHE 9 HE2 PHE 9 54.977 52.209 8.538
80 HZ PHE 9 HZ PHE 9 55.408 54.350 7.357
81 H ALA 10 H ALA 10 58.030 47.485 4.281
82 HA ALA 10 HA ALA 10 56.815 45.653 2.455
83 1HB ALA 10 1HB ALA 10 59.085 46.576 2.160
84 2HB ALA 10 2HB ALA 10 59.634 45.713 3.615
85 3HB ALA 10 3HB ALA 10 59.113 44.799 2.181
86 H LYS 11 H LYS 11 58.127 45.323 5.788
87 HA LYS 11 HA LYS 11 57.424 42.496 5.955
88 1HB LYS 11 1HB LYS 11 59.385 43.682 7.046
89 2HB LYS 11 2HB LYS 11 58.225 44.460 8.136
90 1HG LYS 11 2HG LYS 11 57.491 42.178 8.893
91 2HG LYS 11 1HG LYS 11 58.705 41.452 7.825
92 1HD LYS 11 2HD LYS 11 59.342 43.486 10.004
93 2HD LYS 11 1HD LYS 11 59.365 41.728 10.257
94 1HE LYS 11 1HE LYS 11 61.070 41.505 8.453
95 2HE LYS 11 2HE LYS 11 61.117 43.274 8.300
96 1HZ LYS 11 1HZ LYS 11 61.765 41.752 10.716
97 2HZ LYS 11 2HZ LYS 11 62.847 42.467 9.698
98 3HZ LYS 11 3HZ LYS 11 61.801 43.394 10.573
99 H GLY 12 H GLY 12 55.299 44.095 5.082
100 1HA GLY 12 1HA GLY 12 53.262 43.300 6.926
101 2HA GLY 12 2HA GLY 12 53.403 45.086 6.829
102 H VAL 13 H VAL 13 54.209 45.210 4.071
103 HA VAL 13 HA VAL 13 52.044 43.889 2.551
104 HB VAL 13 HB VAL 13 54.360 45.656 1.641
105 1HG1 VAL 13 1HG2 VAL 13 53.380 44.330 -0.213
106 2HG1 VAL 13 2HG2 VAL 13 51.755 44.866 0.268
107 3HG1 VAL 13 3HG2 VAL 13 52.936 46.034 -0.370
108 1HG2 VAL 13 1HG1 VAL 13 52.904 46.973 3.137
109 2HG2 VAL 13 2HG1 VAL 13 52.664 47.484 1.461
110 3HG2 VAL 13 3HG1 VAL 13 51.469 46.427 2.242
111 H GLY 14 H GLY 14 53.558 42.335 4.092
112 1HA GLY 14 1HA GLY 14 54.835 40.518 2.151
113 2HA GLY 14 2HA GLY 14 55.749 40.980 3.606
114 H LYS 15 H LYS 15 53.347 41.351 5.238
115 HA LYS 15 HA LYS 15 52.710 38.581 5.987
116 1HB LYS 15 1HB LYS 15 51.780 41.270 7.047
117 2HB LYS 15 2HB LYS 15 51.413 39.683 7.761
118 1HG LYS 15 1HG LYS 15 53.810 39.284 8.169
119 2HG LYS 15 2HG LYS 15 54.221 40.839 7.410
120 1HD LYS 15 2HD LYS 15 52.903 42.039 9.108
121 2HD LYS 15 1HD LYS 15 52.481 40.496 9.888
122 1HE LYS 15 2HE LYS 15 54.884 40.053 10.308
123 2HE LYS 15 1HE LYS 15 55.304 41.593 9.527
124 1HZ LYS 15 1HZ LYS 15 53.661 41.289 11.938
125 2HZ LYS 15 2HZ LYS 15 55.232 41.788 11.894
126 3HZ LYS 15 3HZ LYS 15 54.052 42.718 11.213
127 H ASP 16 H ASP 16 51.228 41.516 4.600
128 HA ASP 16 HA ASP 16 48.605 40.437 4.132
129 1HB ASP 16 2HB ASP 16 50.210 42.756 3.009
130 2HB ASP 16 1HB ASP 16 48.571 42.404 2.468
131 HD2 ASP 16 HD2 ASP 16 47.161 43.120 5.713
132 H LEU 17 H LEU 17 51.674 39.820 2.678
133 HA LEU 17 HA LEU 17 50.497 38.949 0.090
134 1HB LEU 17 2HB LEU 17 53.355 39.092 1.131
135 2HB LEU 17 1HB LEU 17 52.881 38.400 -0.417
136 HG LEU 17 HG LEU 17 52.532 41.308 0.462
137 1HD1 LEU 17 1HD1 LEU 17 54.280 40.034 -1.688
138 2HD1 LEU 17 2HD1 LEU 17 54.858 40.624 -0.116
139 3HD1 LEU 17 3HD1 LEU 17 54.190 41.766 -1.300
140 1HD2 LEU 17 1HD2 LEU 17 50.672 40.763 -1.020
141 2HD2 LEU 17 2HD2 LEU 17 51.770 39.933 -2.152
142 3HD2 LEU 17 3HD2 LEU 17 51.867 41.693 -1.931
143 H VAL 18 H VAL 18 52.153 37.844 3.064
144 HA VAL 18 HA VAL 18 51.990 35.056 2.366
145 HB VAL 18 HB VAL 18 52.412 36.613 4.938
146 1HG1 VAL 18 1HG1 VAL 18 52.275 33.597 4.591
147 2HG1 VAL 18 2HG1 VAL 18 51.219 34.605 5.616
148 3HG1 VAL 18 3HG1 VAL 18 52.938 34.437 6.015
149 1HG2 VAL 18 1HG2 VAL 18 54.662 35.634 4.780
150 2HG2 VAL 18 2HG2 VAL 18 54.275 36.464 3.259
151 3HG2 VAL 18 3HG2 VAL 18 54.179 34.694 3.351
152 H LYS 19 H LYS 19 49.869 37.495 3.782
153 HA LYS 19 HA LYS 19 47.802 35.685 4.701
154 1HB LYS 19 2HB LYS 19 48.129 37.971 5.548
155 2HB LYS 19 1HB LYS 19 47.710 38.641 3.964
156 1HG LYS 19 1HG LYS 19 45.808 36.834 5.507
157 2HG LYS 19 2HG LYS 19 45.906 38.579 5.805
158 1HD LYS 19 1HD LYS 19 45.374 39.056 3.445
159 2HD LYS 19 2HD LYS 19 45.270 37.319 3.111
160 1HE LYS 19 2HE LYS 19 43.036 38.167 3.407
161 2HE LYS 19 1HE LYS 19 43.427 37.133 4.793
162 1HZ LYS 19 1HZ LYS 19 42.354 39.162 5.441
163 2HZ LYS 19 2HZ LYS 19 43.541 40.069 4.744
164 3HZ LYS 19 3HZ LYS 19 43.887 39.117 6.045
165 H GLY 20 H GLY 20 48.659 37.320 1.688
166 1HA GLY 20 1HA GLY 20 46.204 36.792 0.257
167 2HA GLY 20 2HA GLY 20 47.776 37.270 -0.423
168 H ALA 21 H ALA 21 49.478 35.319 0.420
169 HA ALA 21 HA ALA 21 48.885 33.066 -1.243
170 1HB ALA 21 1HB ALA 21 50.993 32.180 -0.352
171 2HB ALA 21 2HB ALA 21 51.171 33.891 -0.792
172 3HB ALA 21 3HB ALA 21 50.999 33.425 0.916
173 H ALA 22 H ALA 22 48.367 33.792 2.180
174 HA ALA 22 HA ALA 22 48.114 31.107 3.106
175 1HB ALA 22 1HB ALA 22 46.729 33.597 4.165
176 2HB ALA 22 2HB ALA 22 46.939 32.058 5.018
177 3HB ALA 22 3HB ALA 22 48.359 33.043 4.617
178 H GLN 23 H GLN 23 45.849 33.286 1.453
179 HA GLN 23 HA GLN 23 43.448 31.876 1.884
180 1HB GLN 23 1HB GLN 23 43.743 34.176 0.925
181 2HB GLN 23 2HB GLN 23 44.306 33.441 -0.586
182 1HG GLN 23 2HG GLN 23 42.158 32.230 -0.803
183 2HG GLN 23 1HG GLN 23 41.596 32.950 0.718
184 1HE2 GLN 23 1HE2 GLN 23 41.726 35.456 0.768
185 2HE2 GLN 23 2HE2 GLN 23 41.197 36.278 -0.684
186 H GLY 24 H GLY 24 45.940 31.597 -0.703
187 1HA GLY 24 1HA GLY 24 45.521 28.799 -1.114
188 2HA GLY 24 2HA GLY 24 44.672 29.744 -2.361
189 H VAL 25 H VAL 25 47.746 28.660 -1.163
190 HA VAL 25 HA VAL 25 49.439 30.634 -2.134
191 HB VAL 25 HB VAL 25 49.975 27.633 -1.896
192 1HG1 VAL 25 1HG2 VAL 25 52.341 28.327 -1.604
193 2HG1 VAL 25 2HG2 VAL 25 51.732 28.761 -3.210
194 3HG1 VAL 25 3HG2 VAL 25 51.885 30.009 -1.953
195 1HG2 VAL 25 1HG1 VAL 25 50.401 29.886 0.105
196 2HG2 VAL 25 2HG1 VAL 25 49.164 28.612 0.225
197 3HG2 VAL 25 3HG1 VAL 25 50.881 28.190 0.319
198 H LEU 26 H LEU 26 48.732 27.469 -3.683
199 HA LEU 26 HA LEU 26 49.976 27.938 -6.158
200 1HB LEU 26 1HB LEU 26 47.497 26.296 -5.544
201 2HB LEU 26 2HB LEU 26 48.514 26.135 -6.983
202 HG LEU 26 HG LEU 26 49.411 25.607 -4.110
203 1HD1 LEU 26 1HD2 LEU 26 47.811 23.941 -4.977
204 2HD1 LEU 26 2HD2 LEU 26 49.440 23.252 -4.821
205 3HD1 LEU 26 3HD2 LEU 26 48.821 23.716 -6.423
206 1HD2 LEU 26 1HD1 LEU 26 51.417 24.610 -5.216
207 2HD2 LEU 26 2HD1 LEU 26 50.849 25.241 -6.777
208 3HD2 LEU 26 3HD1 LEU 26 51.313 26.358 -5.472
209 H SER 27 H SER 27 46.686 28.767 -5.030
210 HA SER 27 HA SER 27 45.692 29.675 -7.540
211 1HB SER 27 1HB SER 27 44.247 29.121 -5.632
212 2HB SER 27 2HB SER 27 44.915 30.486 -4.710
213 HG SER 27 HG SER 27 42.961 31.011 -5.776
214 H THR 28 H THR 28 47.151 31.463 -4.755
215 HA THR 28 HA THR 28 47.073 34.018 -5.968
216 HB THR 28 HB THR 28 49.025 32.961 -3.893
217 HG1 THR 28 HG1 THR 28 46.824 32.741 -3.321
218 1HG2 THR 28 1HG2 THR 28 49.735 35.119 -4.886
219 2HG2 THR 28 2HG2 THR 28 49.142 35.362 -3.233
220 3HG2 THR 28 3HG2 THR 28 48.112 35.787 -4.617
221 H VAL 29 H VAL 29 49.699 31.564 -5.824
222 HA VAL 29 HA VAL 29 51.598 32.935 -7.425
223 HB VAL 29 HB VAL 29 51.092 29.989 -6.907
224 1HG1 VAL 29 1HG2 VAL 29 53.450 31.339 -8.291
225 2HG1 VAL 29 2HG2 VAL 29 53.429 29.656 -7.720
226 3HG1 VAL 29 3HG2 VAL 29 52.332 30.158 -9.016
227 1HG2 VAL 29 1HG1 VAL 29 51.766 31.407 -4.947
228 2HG2 VAL 29 2HG1 VAL 29 53.188 31.947 -5.859
229 3HG2 VAL 29 3HG1 VAL 29 53.023 30.239 -5.398
230 H SER 30 H SER 30 48.746 30.971 -8.290
231 HA SER 30 HA SER 30 49.421 30.859 -11.095
232 1HB SER 30 2HB SER 30 47.921 29.225 -9.935
233 2HB SER 30 1HB SER 30 46.718 30.504 -9.717
234 HG SER 30 HG SER 30 47.760 29.592 -12.195
235 H CYS 31 H CYS 31 46.828 32.611 -9.343
236 HA CYS 31 HA CYS 31 46.403 34.451 -11.558
237 1HB CYS 31 1HB CYS 31 44.725 35.394 -10.205
238 2HB CYS 31 2HB CYS 31 44.632 33.649 -9.973
239 H LYS 32 H LYS 32 49.166 34.320 -10.098
240 HA LYS 32 HA LYS 32 49.384 37.030 -8.979
241 1HB LYS 32 1HB LYS 32 50.428 35.079 -7.931
242 2HB LYS 32 2HB LYS 32 51.441 34.834 -9.384
243 1HG LYS 32 2HG LYS 32 52.365 37.069 -9.156
244 2HG LYS 32 1HG LYS 32 51.274 37.396 -7.789
245 1HD LYS 32 2HD LYS 32 53.503 35.320 -7.806
246 2HD LYS 32 1HD LYS 32 53.559 36.962 -7.122
247 1HE LYS 32 2HE LYS 32 51.726 36.403 -5.563
248 2HE LYS 32 1HE LYS 32 51.700 34.742 -6.187
249 1HZ LYS 32 1HZ LYS 32 53.976 36.035 -4.878
250 2HZ LYS 32 2HZ LYS 32 53.948 34.494 -5.465
251 3HZ LYS 32 3HZ LYS 32 52.973 34.914 -4.203
252 H LEU 33 H LEU 33 50.272 35.212 -11.920
253 HA LEU 33 HA LEU 33 52.055 37.087 -13.073
254 1HB LEU 33 1HB LEU 33 51.764 34.804 -13.925
255 2HB LEU 33 2HB LEU 33 50.074 35.144 -14.332
256 HG LEU 33 HG LEU 33 50.810 36.839 -15.996
257 1HD1 LEU 33 1HD1 LEU 33 52.963 37.531 -15.026
258 2HD1 LEU 33 2HD1 LEU 33 53.610 35.887 -15.238
259 3HD1 LEU 33 3HD1 LEU 33 53.218 36.885 -16.655
260 1HD2 LEU 33 1HD2 LEU 33 50.420 34.495 -16.659
261 2HD2 LEU 33 2HD2 LEU 33 52.120 34.107 -16.309
262 3HD2 LEU 33 3HD2 LEU 33 51.715 35.231 -17.626
263 H ALA 34 H ALA 34 48.530 36.590 -13.509
264 HA ALA 34 HA ALA 34 48.097 39.431 -14.220
265 1HB ALA 34 1HB ALA 34 46.669 37.730 -15.273
266 2HB ALA 34 2HB ALA 34 45.715 38.763 -14.187
267 3HB ALA 34 3HB ALA 34 46.179 37.122 -13.676
268 H LYS 35 H LYS 35 49.254 40.109 -12.311
269 HA LYS 35 HA LYS 35 48.788 39.310 -9.682
270 1HB LYS 35 2HB LYS 35 50.760 40.491 -10.701
271 2HB LYS 35 1HB LYS 35 49.827 41.989 -10.673
272 1HG LYS 35 2HG LYS 35 51.386 41.888 -8.822
273 2HG LYS 35 1HG LYS 35 49.751 41.856 -8.174
274 1HD LYS 35 2HD LYS 35 49.965 39.322 -7.968
275 2HD LYS 35 1HD LYS 35 51.647 39.505 -8.523
276 1HE LYS 35 2HE LYS 35 52.120 41.011 -6.619
277 2HE LYS 35 1HE LYS 35 50.438 40.859 -6.071
278 1HZ LYS 35 1HZ LYS 35 51.889 39.414 -4.877
279 2HZ LYS 35 2HZ LYS 35 50.816 38.528 -5.762
280 3HZ LYS 35 3HZ LYS 35 52.380 38.672 -6.264
281 H THR 36 H THR 36 46.299 40.193 -11.222
282 HA THR 36 HA THR 36 45.232 42.258 -9.396
283 HB THR 36 HB THR 36 44.520 42.173 -11.755
284 HG1 THR 36 HG1 THR 36 42.308 42.331 -11.260
285 1HG2 THR 36 1HG2 THR 36 43.172 39.541 -10.993
286 2HG2 THR 36 2HG2 THR 36 42.945 40.440 -12.505
287 3HG2 THR 36 3HG2 THR 36 44.524 39.729 -12.132
288 H CYS 37 H CYS 37 46.367 39.420 -8.557
289 HA CYS 37 HA CYS 37 44.335 38.839 -6.575
290 1HB CYS 37 2HB CYS 37 43.085 37.982 -8.359
291 2HB CYS 37 1HB CYS 37 44.502 37.328 -9.170
292 HXT CYS 37 HO OH 38 48.006 37.254 -6.997
Start of MODEL 11
1 1H GLY 1 1H GLY 1 65.967 56.066 10.727
2 2H GLY 1 2H GLY 1 66.566 57.022 9.524
3 3H GLY 1 3H GLY 1 67.596 56.169 10.490
4 1HA GLY 1 2HA GLY 1 67.427 55.126 8.361
5 2HA GLY 1 1HA GLY 1 66.785 54.101 9.658
6 H ILE 2 H ILE 2 65.695 56.688 7.404
7 HA ILE 2 HA ILE 2 62.964 56.064 7.429
8 HB ILE 2 HB ILE 2 64.367 58.071 6.533
9 1HG1 ILE 2 2HG1 ILE 2 62.013 58.184 6.716
10 2HG1 ILE 2 1HG1 ILE 2 62.534 58.878 5.177
11 1HG2 ILE 2 1HG2 ILE 2 64.066 56.511 3.937
12 2HG2 ILE 2 2HG2 ILE 2 64.613 58.187 4.119
13 3HG2 ILE 2 3HG2 ILE 2 65.585 56.867 4.791
14 1HD1 ILE 2 1HD1 ILE 2 61.149 56.211 5.620
15 2HD1 ILE 2 2HD1 ILE 2 60.532 57.634 4.777
16 3HD1 ILE 2 3HD1 ILE 2 61.856 56.702 4.055
17 H LEU 3 H LEU 3 65.682 54.674 5.611
18 HA LEU 3 HA LEU 3 64.132 53.169 3.738
19 1HB LEU 3 2HB LEU 3 66.947 52.789 4.837
20 2HB LEU 3 1HB LEU 3 66.287 51.972 3.418
21 HG LEU 3 HG LEU 3 66.686 54.986 3.706
22 1HD1 LEU 3 1HD2 LEU 3 68.794 53.716 3.539
23 2HD1 LEU 3 2HD2 LEU 3 68.489 54.656 2.063
24 3HD1 LEU 3 3HD2 LEU 3 68.193 52.902 2.076
25 1HD2 LEU 3 1HD1 LEU 3 65.767 53.291 1.340
26 2HD2 LEU 3 2HD1 LEU 3 66.229 55.005 1.246
27 3HD2 LEU 3 3HD1 LEU 3 64.810 54.529 2.189
28 H ASP 4 H ASP 4 64.856 52.672 7.120
29 HA ASP 4 HA ASP 4 64.254 49.781 6.974
30 1HB ASP 4 1HB ASP 4 66.201 50.566 8.333
31 2HB ASP 4 2HB ASP 4 65.100 51.565 9.295
32 HD2 ASP 4 HD2 ASP 4 65.433 50.535 11.152
33 H THR 5 H THR 5 62.959 52.968 7.538
34 HA THR 5 HA THR 5 60.945 52.148 9.368
35 HB THR 5 HB THR 5 61.106 54.650 7.638
36 HG1 THR 5 HG1 THR 5 61.907 55.522 9.591
37 1HG2 THR 5 1HG2 THR 5 59.579 55.620 9.338
38 2HG2 THR 5 2HG2 THR 5 58.814 54.299 8.437
39 3HG2 THR 5 3HG2 THR 5 59.414 54.018 10.090
40 H LEU 6 H LEU 6 60.935 52.954 5.853
41 HA LEU 6 HA LEU 6 58.235 52.107 5.396
42 1HB LEU 6 2HB LEU 6 58.814 52.227 3.046
43 2HB LEU 6 1HB LEU 6 59.421 53.627 3.935
44 HG LEU 6 HG LEU 6 61.661 52.133 4.040
45 1HD1 LEU 6 1HD2 LEU 6 60.324 51.310 1.417
46 2HD1 LEU 6 2HD2 LEU 6 60.646 50.203 2.764
47 3HD1 LEU 6 3HD2 LEU 6 61.996 50.958 1.900
48 1HD2 LEU 6 1HD1 LEU 6 60.714 53.757 1.646
49 2HD2 LEU 6 2HD1 LEU 6 61.474 54.398 3.121
50 3HD2 LEU 6 3HD1 LEU 6 62.405 53.361 2.021
51 H LYS 7 H LYS 7 61.374 50.447 5.493
52 HA LYS 7 HA LYS 7 60.627 47.993 4.360
53 1HB LYS 7 2HB LYS 7 62.946 48.848 4.899
54 2HB LYS 7 1HB LYS 7 62.611 48.507 6.605
55 1HG LYS 7 2HG LYS 7 63.856 46.674 5.685
56 2HG LYS 7 1HG LYS 7 62.201 46.104 5.992
57 1HD LYS 7 1HD LYS 7 61.646 46.506 3.596
58 2HD LYS 7 2HD LYS 7 63.312 47.045 3.307
59 1HE LYS 7 2HE LYS 7 62.492 44.272 4.292
60 2HE LYS 7 1HE LYS 7 62.920 44.679 2.619
61 1HZ LYS 7 1HZ LYS 7 64.758 43.741 3.776
62 2HZ LYS 7 2HZ LYS 7 65.086 45.309 3.386
63 3HZ LYS 7 3HZ LYS 7 64.699 44.909 4.938
64 H GLN 8 H GLN 8 60.507 49.186 7.737
65 HA GLN 8 HA GLN 8 59.733 46.913 9.111
66 1HB GLN 8 2HB GLN 8 60.335 49.145 10.058
67 2HB GLN 8 1HB GLN 8 58.757 49.768 9.542
68 1HG GLN 8 1HG GLN 8 57.633 48.072 10.947
69 2HG GLN 8 2HG GLN 8 59.224 47.494 11.494
70 1HE2 GLN 8 2HE2 GLN 8 60.693 49.308 12.417
71 2HE2 GLN 8 1HE2 GLN 8 59.912 50.465 13.472
72 H PHE 9 H PHE 9 57.631 49.369 7.561
73 HA PHE 9 HA PHE 9 55.208 47.892 8.146
74 1HB PHE 9 2HB PHE 9 55.682 50.314 6.383
75 2HB PHE 9 1HB PHE 9 54.118 49.740 6.976
76 HD1 PHE 9 HD1 PHE 9 54.197 49.308 9.712
77 HD2 PHE 9 HD2 PHE 9 56.504 52.194 7.498
78 HE1 PHE 9 HE1 PHE 9 54.543 50.624 11.782
79 HE2 PHE 9 HE2 PHE 9 56.830 53.514 9.571
80 HZ PHE 9 HZ PHE 9 55.866 52.724 11.716
81 H ALA 10 H ALA 10 57.382 48.191 5.349
82 HA ALA 10 HA ALA 10 55.631 47.198 3.354
83 1HB ALA 10 1HB ALA 10 58.647 46.889 3.612
84 2HB ALA 10 2HB ALA 10 57.796 48.265 2.872
85 3HB ALA 10 3HB ALA 10 57.693 46.654 2.133
86 H LYS 11 H LYS 11 57.757 45.532 5.706
87 HA LYS 11 HA LYS 11 57.228 42.856 4.804
88 1HB LYS 11 1HB LYS 11 58.065 43.996 7.494
89 2HB LYS 11 2HB LYS 11 58.052 42.265 7.096
90 1HG LYS 11 2HG LYS 11 59.636 42.639 5.254
91 2HG LYS 11 1HG LYS 11 59.690 44.372 5.612
92 1HD LYS 11 1HD LYS 11 60.535 42.155 7.529
93 2HD LYS 11 2HD LYS 11 61.627 43.133 6.528
94 1HE LYS 11 2HE LYS 11 60.755 45.195 7.665
95 2HE LYS 11 1HE LYS 11 59.829 44.153 8.766
96 1HZ LYS 11 1HZ LYS 11 61.907 44.792 9.699
97 2HZ LYS 11 2HZ LYS 11 61.876 43.162 9.454
98 3HZ LYS 11 3HZ LYS 11 62.738 44.132 8.437
99 H GLY 12 H GLY 12 55.478 45.148 6.872
100 1HA GLY 12 1HA GLY 12 53.596 43.135 7.812
101 2HA GLY 12 2HA GLY 12 53.475 44.904 8.035
102 H VAL 13 H VAL 13 53.835 45.376 5.089
103 HA VAL 13 HA VAL 13 51.286 44.272 4.060
104 HB VAL 13 HB VAL 13 53.232 46.144 2.667
105 1HG1 VAL 13 1HG1 VAL 13 51.529 45.091 1.166
106 2HG1 VAL 13 2HG1 VAL 13 51.190 46.811 1.382
107 3HG1 VAL 13 3HG1 VAL 13 50.245 45.604 2.277
108 1HG2 VAL 13 1HG2 VAL 13 52.520 47.265 4.738
109 2HG2 VAL 13 2HG2 VAL 13 51.696 47.997 3.355
110 3HG2 VAL 13 3HG2 VAL 13 50.823 46.855 4.398
111 H GLY 14 H GLY 14 53.390 42.608 4.852
112 1HA GLY 14 2HA GLY 14 53.869 41.137 2.306
113 2HA GLY 14 1HA GLY 14 55.088 41.202 3.592
114 H LYS 15 H LYS 15 53.195 41.323 5.783
115 HA LYS 15 HA LYS 15 52.470 38.524 6.111
116 1HB LYS 15 2HB LYS 15 51.805 40.949 7.814
117 2HB LYS 15 1HB LYS 15 51.662 39.239 8.270
118 1HG LYS 15 2HG LYS 15 54.223 40.801 7.717
119 2HG LYS 15 1HG LYS 15 53.684 40.098 9.253
120 1HD LYS 15 2HD LYS 15 53.777 37.827 8.148
121 2HD LYS 15 1HD LYS 15 54.516 38.599 6.730
122 1HE LYS 15 2HE LYS 15 56.365 39.444 8.145
123 2HE LYS 15 1HE LYS 15 55.637 38.665 9.565
124 1HZ LYS 15 1HZ LYS 15 55.914 36.564 8.477
125 2HZ LYS 15 2HZ LYS 15 56.592 37.286 7.158
126 3HZ LYS 15 3HZ LYS 15 57.363 37.339 8.615
127 H ASP 16 H ASP 16 50.809 41.675 5.696
128 HA ASP 16 HA ASP 16 48.142 40.633 5.536
129 1HB ASP 16 1HB ASP 16 48.784 43.016 6.013
130 2HB ASP 16 2HB ASP 16 49.329 43.163 4.335
131 HD2 ASP 16 HD2 ASP 16 46.547 42.123 6.188
132 H LEU 17 H LEU 17 50.866 40.528 3.423
133 HA LEU 17 HA LEU 17 49.334 40.277 0.938
134 1HB LEU 17 2HB LEU 17 51.736 41.404 1.540
135 2HB LEU 17 1HB LEU 17 52.290 39.775 1.102
136 HG LEU 17 HG LEU 17 50.530 41.638 -0.531
137 1HD1 LEU 17 1HD1 LEU 17 53.455 40.851 -0.893
138 2HD1 LEU 17 2HD1 LEU 17 52.860 42.430 -0.332
139 3HD1 LEU 17 3HD1 LEU 17 52.523 41.894 -1.991
140 1HD2 LEU 17 1HD2 LEU 17 51.004 40.040 -2.423
141 2HD2 LEU 17 2HD2 LEU 17 50.030 39.316 -1.136
142 3HD2 LEU 17 3HD2 LEU 17 51.766 38.939 -1.255
143 H VAL 18 H VAL 18 51.457 38.497 3.215
144 HA VAL 18 HA VAL 18 51.147 35.919 1.954
145 HB VAL 18 HB VAL 18 52.007 36.914 4.678
146 1HG1 VAL 18 1HG1 VAL 18 50.816 34.857 5.176
147 2HG1 VAL 18 2HG1 VAL 18 52.562 34.565 5.255
148 3HG1 VAL 18 3HG1 VAL 18 51.639 34.021 3.832
149 1HG2 VAL 18 1HG2 VAL 18 53.580 37.014 2.713
150 2HG2 VAL 18 2HG2 VAL 18 53.399 35.259 2.524
151 3HG2 VAL 18 3HG2 VAL 18 54.145 35.922 3.994
152 H LYS 19 H LYS 19 49.293 37.924 4.216
153 HA LYS 19 HA LYS 19 47.380 35.867 4.925
154 1HB LYS 19 1HB LYS 19 47.834 37.901 6.315
155 2HB LYS 19 2HB LYS 19 47.193 38.899 5.010
156 1HG LYS 19 1HG LYS 19 45.537 38.582 6.780
157 2HG LYS 19 2HG LYS 19 44.984 37.931 5.237
158 1HD LYS 19 2HD LYS 19 44.351 36.489 7.062
159 2HD LYS 19 1HD LYS 19 45.473 35.623 6.014
160 1HE LYS 19 1HE LYS 19 46.420 37.086 8.514
161 2HE LYS 19 2HE LYS 19 45.728 35.456 8.596
162 1HZ LYS 19 1HZ LYS 19 48.083 36.182 7.018
163 2HZ LYS 19 2HZ LYS 19 48.071 35.360 8.444
164 3HZ LYS 19 3HZ LYS 19 47.388 34.691 7.102
165 H GLY 20 H GLY 20 47.793 38.239 2.357
166 1HA GLY 20 1HA GLY 20 45.140 38.030 1.222
167 2HA GLY 20 2HA GLY 20 46.591 38.729 0.471
168 H ALA 21 H ALA 21 48.389 36.636 0.541
169 HA ALA 21 HA ALA 21 47.521 34.899 -1.569
170 1HB ALA 21 1HB ALA 21 49.865 35.614 -1.260
171 2HB ALA 21 2HB ALA 21 49.714 33.843 -1.248
172 3HB ALA 21 3HB ALA 21 49.932 34.725 0.280
173 H ALA 22 H ALA 22 47.503 34.703 1.962
174 HA ALA 22 HA ALA 22 47.343 31.870 2.206
175 1HB ALA 22 1HB ALA 22 46.449 32.289 4.434
176 2HB ALA 22 2HB ALA 22 47.812 33.376 4.103
177 3HB ALA 22 3HB ALA 22 46.141 33.987 4.025
178 H GLN 23 H GLN 23 44.884 34.350 1.520
179 HA GLN 23 HA GLN 23 42.567 32.797 1.906
180 1HB GLN 23 2HB GLN 23 42.669 35.261 1.674
181 2HB GLN 23 1HB GLN 23 43.117 35.078 -0.031
182 1HG GLN 23 2HG GLN 23 40.736 35.583 0.221
183 2HG GLN 23 1HG GLN 23 40.976 33.995 -0.518
184 1HE2 GLN 23 1HE2 GLN 23 40.585 35.509 2.746
185 2HE2 GLN 23 2HE2 GLN 23 39.552 34.254 3.395
186 H GLY 24 H GLY 24 44.928 32.883 -0.758
187 1HA GLY 24 2HA GLY 24 43.727 30.543 -1.995
188 2HA GLY 24 1HA GLY 24 43.565 32.034 -2.953
189 H VAL 25 H VAL 25 45.841 29.773 -1.437
190 HA VAL 25 HA VAL 25 48.183 31.233 -2.139
191 HB VAL 25 HB VAL 25 47.821 28.295 -1.393
192 1HG1 VAL 25 1HG2 VAL 25 50.210 28.429 -0.723
193 2HG1 VAL 25 2HG2 VAL 25 50.301 30.072 -1.394
194 3HG1 VAL 25 3HG2 VAL 25 50.011 28.682 -2.465
195 1HG2 VAL 25 1HG1 VAL 25 46.980 29.840 0.341
196 2HG2 VAL 25 2HG1 VAL 25 48.523 30.729 0.295
197 3HG2 VAL 25 3HG1 VAL 25 48.477 29.044 0.860
198 H LEU 26 H LEU 26 46.932 28.097 -3.369
199 HA LEU 26 HA LEU 26 48.734 27.733 -5.459
200 1HB LEU 26 2HB LEU 26 45.812 26.902 -5.311
201 2HB LEU 26 1HB LEU 26 47.042 26.189 -6.365
202 HG LEU 26 HG LEU 26 47.061 26.114 -3.312
203 1HD1 LEU 26 1HD1 LEU 26 45.312 24.712 -4.342
204 2HD1 LEU 26 2HD1 LEU 26 46.532 23.951 -5.388
205 3HD1 LEU 26 3HD1 LEU 26 46.598 23.720 -3.626
206 1HD2 LEU 26 1HD2 LEU 26 49.363 26.094 -4.167
207 2HD2 LEU 26 2HD2 LEU 26 48.928 24.859 -5.373
208 3HD2 LEU 26 3HD2 LEU 26 48.910 24.467 -3.640
209 H SER 27 H SER 27 45.700 29.629 -5.431
210 HA SER 27 HA SER 27 45.641 30.076 -8.257
211 1HB SER 27 1HB SER 27 44.006 31.825 -7.697
212 2HB SER 27 2HB SER 27 43.660 30.297 -6.865
213 HG SER 27 HG SER 27 44.950 32.571 -5.764
214 H THR 28 H THR 28 46.885 32.049 -5.498
215 HA THR 28 HA THR 28 47.793 34.248 -7.014
216 HB THR 28 HB THR 28 48.828 33.065 -4.409
217 HG1 THR 28 HG1 THR 28 47.036 35.171 -5.047
218 1HG2 THR 28 1HG2 THR 28 49.337 35.787 -5.687
219 2HG2 THR 28 2HG2 THR 28 50.553 34.528 -5.372
220 3HG2 THR 28 3HG2 THR 28 49.753 35.343 -4.017
221 H VAL 29 H VAL 29 49.491 31.223 -6.059
222 HA VAL 29 HA VAL 29 51.995 31.749 -7.201
223 HB VAL 29 HB VAL 29 50.424 29.184 -6.779
224 1HG1 VAL 29 1HG1 VAL 29 52.090 28.728 -8.501
225 2HG1 VAL 29 2HG1 VAL 29 53.343 29.561 -7.545
226 3HG1 VAL 29 3HG1 VAL 29 52.627 28.040 -6.959
227 1HG2 VAL 29 1HG2 VAL 29 52.742 30.462 -5.261
228 2HG2 VAL 29 2HG2 VAL 29 51.919 28.946 -4.837
229 3HG2 VAL 29 3HG2 VAL 29 51.048 30.487 -4.735
230 H SER 30 H SER 30 48.919 30.795 -8.725
231 HA SER 30 HA SER 30 50.246 30.325 -11.298
232 1HB SER 30 2HB SER 30 47.310 30.219 -10.472
233 2HB SER 30 1HB SER 30 47.983 29.680 -12.024
234 HG SER 30 HG SER 30 47.724 27.968 -10.519
235 H CYS 31 H CYS 31 47.832 32.599 -9.911
236 HA CYS 31 HA CYS 31 47.463 34.207 -12.201
237 1HB CYS 31 1HB CYS 31 47.537 34.994 -9.265
238 2HB CYS 31 2HB CYS 31 46.895 35.968 -10.588
239 H LYS 32 H LYS 32 50.331 33.792 -10.258
240 HA LYS 32 HA LYS 32 50.901 36.573 -10.047
241 1HB LYS 32 1HB LYS 32 52.747 36.000 -8.762
242 2HB LYS 32 2HB LYS 32 51.466 34.840 -8.400
243 1HG LYS 32 1HG LYS 32 53.043 33.277 -8.714
244 2HG LYS 32 2HG LYS 32 52.775 33.542 -10.445
245 1HD LYS 32 2HD LYS 32 55.127 33.687 -10.132
246 2HD LYS 32 1HD LYS 32 54.571 35.373 -10.276
247 1HE LYS 32 1HE LYS 32 54.716 35.671 -7.855
248 2HE LYS 32 2HE LYS 32 54.994 33.938 -7.614
249 1HZ LYS 32 1HZ LYS 32 57.006 35.189 -7.474
250 2HZ LYS 32 2HZ LYS 32 57.064 34.171 -8.770
251 3HZ LYS 32 3HZ LYS 32 56.805 35.784 -8.999
252 H LEU 33 H LEU 33 50.773 35.475 -12.877
253 HA LEU 33 HA LEU 33 53.336 35.776 -14.084
254 1HB LEU 33 1HB LEU 33 51.398 34.817 -15.246
255 2HB LEU 33 2HB LEU 33 50.523 36.350 -15.102
256 HG LEU 33 HG LEU 33 52.218 37.459 -16.543
257 1HD1 LEU 33 1HD2 LEU 33 53.815 36.021 -17.815
258 2HD1 LEU 33 2HD2 LEU 33 53.378 34.645 -16.779
259 3HD1 LEU 33 3HD2 LEU 33 54.195 36.066 -16.086
260 1HD2 LEU 33 1HD1 LEU 33 50.176 36.472 -17.513
261 2HD2 LEU 33 2HD1 LEU 33 51.546 36.352 -18.637
262 3HD2 LEU 33 3HD1 LEU 33 51.019 34.920 -17.723
263 H ALA 34 H ALA 34 50.654 38.065 -13.433
264 HA ALA 34 HA ALA 34 52.621 40.233 -13.046
265 1HB ALA 34 1HB ALA 34 51.254 41.804 -14.365
266 2HB ALA 34 2HB ALA 34 50.161 40.479 -14.830
267 3HB ALA 34 3HB ALA 34 51.850 40.478 -15.385
268 H LYS 35 H LYS 35 51.485 38.699 -11.102
269 HA LYS 35 HA LYS 35 50.092 38.541 -9.367
270 1HB LYS 35 1HB LYS 35 51.623 40.536 -8.935
271 2HB LYS 35 2HB LYS 35 50.232 41.556 -9.341
272 1HG LYS 35 2HG LYS 35 50.357 41.306 -6.950
273 2HG LYS 35 1HG LYS 35 48.937 40.397 -7.510
274 1HD LYS 35 1HD LYS 35 50.181 38.283 -7.311
275 2HD LYS 35 2HD LYS 35 51.675 39.171 -6.950
276 1HE LYS 35 1HE LYS 35 50.725 38.287 -4.893
277 2HE LYS 35 2HE LYS 35 50.630 40.058 -4.878
278 1HZ LYS 35 1HZ LYS 35 48.612 39.034 -4.131
279 2HZ LYS 35 2HZ LYS 35 48.440 38.225 -5.559
280 3HZ LYS 35 3HZ LYS 35 48.341 39.871 -5.525
281 H THR 36 H THR 36 48.539 37.990 -11.324
282 HA THR 36 HA THR 36 46.294 39.754 -11.704
283 HB THR 36 HB THR 36 46.582 36.765 -12.200
284 HG1 THR 36 HG1 THR 36 46.967 39.028 -13.866
285 1HG2 THR 36 1HG2 THR 36 44.792 37.164 -13.884
286 2HG2 THR 36 2HG2 THR 36 44.607 38.823 -13.275
287 3HG2 THR 36 3HG2 THR 36 44.220 37.435 -12.229
288 H CYS 37 H CYS 37 47.279 37.556 -9.174
289 HA CYS 37 HA CYS 37 45.148 38.450 -7.528
290 1HB CYS 37 2HB CYS 37 43.832 36.599 -7.210
291 2HB CYS 37 1HB CYS 37 43.954 36.689 -8.964
292 HXT CYS 37 HO OH 38 46.788 36.779 -4.867
Start of MODEL 12
1 1H GLY 1 1H GLY 1 65.322 55.248 15.584
2 2H GLY 1 2H GLY 1 65.560 56.443 16.696
3 3H GLY 1 3H GLY 1 64.092 56.280 15.960
4 1HA GLY 1 1HA GLY 1 65.285 58.132 15.049
5 2HA GLY 1 2HA GLY 1 66.606 57.018 14.645
6 H ILE 2 H ILE 2 66.006 58.181 12.491
7 HA ILE 2 HA ILE 2 63.715 57.491 11.036
8 HB ILE 2 HB ILE 2 65.233 59.308 10.444
9 1HG1 ILE 2 1HG1 ILE 2 65.493 58.904 8.025
10 2HG1 ILE 2 2HG1 ILE 2 65.177 57.180 8.276
11 1HG2 ILE 2 1HG2 ILE 2 67.423 58.918 9.446
12 2HG2 ILE 2 2HG2 ILE 2 67.392 58.220 11.073
13 3HG2 ILE 2 3HG2 ILE 2 67.249 57.166 9.647
14 1HD1 ILE 2 1HD1 ILE 2 62.883 57.692 9.023
15 2HD1 ILE 2 2HD1 ILE 2 63.230 59.437 8.945
16 3HD1 ILE 2 3HD1 ILE 2 63.187 58.464 7.458
17 H LEU 3 H LEU 3 66.703 55.708 11.693
18 HA LEU 3 HA LEU 3 66.359 53.728 9.649
19 1HB LEU 3 2HB LEU 3 67.926 53.721 12.264
20 2HB LEU 3 1HB LEU 3 68.120 52.557 10.951
21 HG LEU 3 HG LEU 3 68.677 55.556 10.776
22 1HD1 LEU 3 1HD2 LEU 3 71.033 54.857 10.642
23 2HD1 LEU 3 2HD2 LEU 3 70.551 53.157 10.840
24 3HD1 LEU 3 3HD2 LEU 3 70.295 54.316 12.164
25 1HD2 LEU 3 1HD1 LEU 3 69.735 54.961 8.589
26 2HD2 LEU 3 2HD1 LEU 3 69.086 53.314 8.744
27 3HD2 LEU 3 3HD1 LEU 3 67.984 54.702 8.578
28 H ASP 4 H ASP 4 64.826 54.195 12.722
29 HA ASP 4 HA ASP 4 64.048 51.346 12.959
30 1HB ASP 4 1HB ASP 4 64.792 52.573 14.987
31 2HB ASP 4 2HB ASP 4 63.503 53.762 14.736
32 HD2 ASP 4 HD2 ASP 4 60.966 51.690 15.944
33 H THR 5 H THR 5 63.135 54.539 11.851
34 HA THR 5 HA THR 5 60.333 54.143 12.109
35 HB THR 5 HB THR 5 61.892 56.200 10.499
36 HG1 THR 5 HG1 THR 5 61.456 57.466 12.349
37 1HG2 THR 5 1HG2 THR 5 58.980 56.153 11.393
38 2HG2 THR 5 2HG2 THR 5 59.572 56.083 9.715
39 3HG2 THR 5 3HG2 THR 5 59.813 57.552 10.679
40 H LEU 6 H LEU 6 62.615 54.112 9.327
41 HA LEU 6 HA LEU 6 60.683 53.350 7.347
42 1HB LEU 6 1HB LEU 6 63.688 52.877 7.496
43 2HB LEU 6 2HB LEU 6 62.693 52.712 6.040
44 HG LEU 6 HG LEU 6 63.098 55.305 7.607
45 1HD1 LEU 6 1HD1 LEU 6 64.485 55.973 5.688
46 2HD1 LEU 6 2HD1 LEU 6 64.257 54.370 4.951
47 3HD1 LEU 6 3HD1 LEU 6 65.150 54.529 6.481
48 1HD2 LEU 6 1HD2 LEU 6 61.721 54.732 4.944
49 2HD2 LEU 6 2HD2 LEU 6 62.086 56.351 5.580
50 3HD2 LEU 6 3HD2 LEU 6 60.938 55.310 6.434
51 H LYS 7 H LYS 7 62.760 51.544 9.622
52 HA LYS 7 HA LYS 7 62.296 48.929 8.609
53 1HB LYS 7 2HB LYS 7 63.155 50.123 11.253
54 2HB LYS 7 1HB LYS 7 62.825 48.401 11.102
55 1HG LYS 7 2HG LYS 7 65.164 48.776 10.861
56 2HG LYS 7 1HG LYS 7 64.518 48.163 9.339
57 1HD LYS 7 1HD LYS 7 64.779 51.153 9.723
58 2HD LYS 7 2HD LYS 7 66.252 50.206 9.495
59 1HE LYS 7 1HE LYS 7 63.929 50.144 7.529
60 2HE LYS 7 2HE LYS 7 65.381 51.144 7.374
61 1HZ LYS 7 1HZ LYS 7 65.577 49.137 6.152
62 2HZ LYS 7 2HZ LYS 7 66.685 49.158 7.373
63 3HZ LYS 7 3HZ LYS 7 65.335 48.218 7.498
64 H GLN 8 H GLN 8 60.551 50.950 11.005
65 HA GLN 8 HA GLN 8 58.755 49.096 12.031
66 1HB GLN 8 1HB GLN 8 59.089 51.470 12.755
67 2HB GLN 8 2HB GLN 8 58.197 52.005 11.318
68 1HG GLN 8 2HG GLN 8 56.220 50.731 12.068
69 2HG GLN 8 1HG GLN 8 57.110 50.227 13.523
70 1HE2 GLN 8 1HE2 GLN 8 58.085 52.136 14.825
71 2HE2 GLN 8 2HE2 GLN 8 57.056 53.538 15.021
72 H PHE 9 H PHE 9 58.567 51.010 9.026
73 HA PHE 9 HA PHE 9 55.963 49.861 8.316
74 1HB PHE 9 1HB PHE 9 57.750 51.831 6.861
75 2HB PHE 9 2HB PHE 9 56.069 51.452 6.467
76 HD1 PHE 9 HD1 PHE 9 54.531 51.566 8.831
77 HD2 PHE 9 HD2 PHE 9 57.978 53.944 7.823
78 HE1 PHE 9 HE1 PHE 9 53.813 53.297 10.448
79 HE2 PHE 9 HE2 PHE 9 57.233 55.688 9.419
80 HZ PHE 9 HZ PHE 9 55.166 55.357 10.750
81 H ALA 10 H ALA 10 59.361 49.698 7.198
82 HA ALA 10 HA ALA 10 58.933 48.405 4.751
83 1HB ALA 10 1HB ALA 10 61.277 48.130 6.671
84 2HB ALA 10 2HB ALA 10 61.284 47.703 4.946
85 3HB ALA 10 3HB ALA 10 61.074 49.397 5.437
86 H LYS 11 H LYS 11 59.221 46.991 8.042
87 HA LYS 11 HA LYS 11 59.132 44.259 7.111
88 1HB LYS 11 2HB LYS 11 58.758 43.679 9.420
89 2HB LYS 11 1HB LYS 11 60.049 44.889 9.304
90 1HG LYS 11 1HG LYS 11 58.359 46.665 9.865
91 2HG LYS 11 2HG LYS 11 57.156 45.390 10.143
92 1HD LYS 11 1HD LYS 11 59.810 45.677 11.621
93 2HD LYS 11 2HD LYS 11 58.227 46.201 12.228
94 1HE LYS 11 1HE LYS 11 57.409 43.848 12.073
95 2HE LYS 11 2HE LYS 11 59.039 43.335 11.585
96 1HZ LYS 11 1HZ LYS 11 59.860 44.178 13.650
97 2HZ LYS 11 2HZ LYS 11 58.686 43.049 13.908
98 3HZ LYS 11 3HZ LYS 11 58.348 44.650 14.109
99 H GLY 12 H GLY 12 56.659 46.678 7.957
100 1HA GLY 12 1HA GLY 12 54.464 44.796 7.667
101 2HA GLY 12 2HA GLY 12 54.347 46.579 7.740
102 H VAL 13 H VAL 13 56.420 46.731 5.469
103 HA VAL 13 HA VAL 13 54.783 45.708 3.237
104 HB VAL 13 HB VAL 13 57.420 47.233 3.224
105 1HG1 VAL 13 1HG2 VAL 13 55.332 46.770 1.052
106 2HG1 VAL 13 2HG2 VAL 13 56.764 47.812 0.892
107 3HG1 VAL 13 3HG2 VAL 13 56.964 46.065 1.083
108 1HG2 VAL 13 1HG1 VAL 13 56.050 49.237 2.629
109 2HG2 VAL 13 2HG1 VAL 13 55.677 48.651 4.256
110 3HG2 VAL 13 3HG1 VAL 13 54.574 48.289 2.910
111 H GLY 14 H GLY 14 55.422 43.891 4.957
112 1HA GLY 14 1HA GLY 14 57.058 42.027 3.367
113 2HA GLY 14 2HA GLY 14 57.476 42.228 5.084
114 H LYS 15 H LYS 15 54.771 42.853 5.932
115 HA LYS 15 HA LYS 15 53.520 40.194 6.069
116 1HB LYS 15 2HB LYS 15 52.784 42.959 7.059
117 2HB LYS 15 1HB LYS 15 51.627 41.621 7.047
118 1HG LYS 15 2HG LYS 15 52.562 41.776 9.222
119 2HG LYS 15 1HG LYS 15 53.099 40.260 8.489
120 1HD LYS 15 1HD LYS 15 54.866 42.678 8.226
121 2HD LYS 15 2HD LYS 15 54.728 41.940 9.823
122 1HE LYS 15 2HE LYS 15 55.448 39.779 9.010
123 2HE LYS 15 1HE LYS 15 55.529 40.370 7.344
124 1HZ LYS 15 1HZ LYS 15 57.211 41.911 8.037
125 2HZ LYS 15 2HZ LYS 15 57.662 40.359 8.369
126 3HZ LYS 15 3HZ LYS 15 57.144 41.347 9.585
127 H ASP 16 H ASP 16 52.984 43.363 4.488
128 HA ASP 16 HA ASP 16 50.606 42.674 3.084
129 1HB ASP 16 2HB ASP 16 51.397 44.980 3.496
130 2HB ASP 16 1HB ASP 16 52.786 44.692 2.432
131 HD2 ASP 16 HD2 ASP 16 49.058 44.986 0.793
132 H LEU 17 H LEU 17 53.962 41.804 2.584
133 HA LEU 17 HA LEU 17 53.600 41.153 -0.272
134 1HB LEU 17 1HB LEU 17 55.959 40.752 1.600
135 2HB LEU 17 2HB LEU 17 55.946 40.566 -0.153
136 HG LEU 17 HG LEU 17 55.598 43.176 1.378
137 1HD1 LEU 17 1HD1 LEU 17 57.743 42.181 -0.550
138 2HD1 LEU 17 2HD1 LEU 17 57.710 43.771 0.240
139 3HD1 LEU 17 3HD1 LEU 17 57.920 42.299 1.213
140 1HD2 LEU 17 1HD2 LEU 17 55.609 44.242 -0.883
141 2HD2 LEU 17 2HD2 LEU 17 54.159 43.267 -0.601
142 3HD2 LEU 17 3HD2 LEU 17 55.474 42.630 -1.619
143 H VAL 18 H VAL 18 53.990 39.733 2.983
144 HA VAL 18 HA VAL 18 53.787 36.997 2.061
145 HB VAL 18 HB VAL 18 53.474 38.432 4.716
146 1HG1 VAL 18 1HG1 VAL 18 53.269 36.215 5.787
147 2HG1 VAL 18 2HG1 VAL 18 53.065 35.472 4.183
148 3HG1 VAL 18 3HG1 VAL 18 51.851 36.621 4.805
149 1HG2 VAL 18 1HG2 VAL 18 55.474 37.126 5.292
150 2HG2 VAL 18 2HG2 VAL 18 55.408 36.290 3.725
151 3HG2 VAL 18 3HG2 VAL 18 55.768 38.027 3.791
152 H LYS 19 H LYS 19 51.635 39.703 2.754
153 HA LYS 19 HA LYS 19 49.194 38.090 2.619
154 1HB LYS 19 1HB LYS 19 49.867 40.544 3.704
155 2HB LYS 19 2HB LYS 19 48.989 41.025 2.252
156 1HG LYS 19 2HG LYS 19 48.039 39.104 4.429
157 2HG LYS 19 1HG LYS 19 47.541 40.794 4.276
158 1HD LYS 19 1HD LYS 19 46.989 38.643 2.186
159 2HD LYS 19 2HD LYS 19 45.859 39.147 3.449
160 1HE LYS 19 1HE LYS 19 45.855 41.452 2.593
161 2HE LYS 19 2HE LYS 19 46.974 40.992 1.296
162 1HZ LYS 19 1HZ LYS 19 45.332 39.462 0.503
163 2HZ LYS 19 2HZ LYS 19 44.288 39.895 1.704
164 3HZ LYS 19 3HZ LYS 19 44.725 40.995 0.555
165 H GLY 20 H GLY 20 51.468 38.876 0.383
166 1HA GLY 20 1HA GLY 20 49.524 39.243 -1.861
167 2HA GLY 20 2HA GLY 20 51.175 39.886 -1.826
168 H ALA 21 H ALA 21 52.948 38.175 -1.484
169 HA ALA 21 HA ALA 21 52.910 36.222 -3.489
170 1HB ALA 21 1HB ALA 21 54.953 37.180 -2.531
171 2HB ALA 21 2HB ALA 21 54.606 36.413 -0.967
172 3HB ALA 21 3HB ALA 21 54.972 35.408 -2.387
173 H ALA 22 H ALA 22 52.898 35.647 0.022
174 HA ALA 22 HA ALA 22 51.889 32.921 -0.381
175 1HB ALA 22 1HB ALA 22 52.401 32.647 2.004
176 2HB ALA 22 2HB ALA 22 52.768 34.383 2.133
177 3HB ALA 22 3HB ALA 22 53.785 33.330 1.126
178 H GLN 23 H GLN 23 50.013 34.934 -1.122
179 HA GLN 23 HA GLN 23 48.106 35.283 1.045
180 1HB GLN 23 1HB GLN 23 48.542 36.902 -0.798
181 2HB GLN 23 2HB GLN 23 47.835 35.775 -1.957
182 1HG GLN 23 2HG GLN 23 46.413 36.923 0.487
183 2HG GLN 23 1HG GLN 23 46.302 37.583 -1.153
184 1HE2 GLN 23 1HE2 GLN 23 45.738 35.786 -2.888
185 2HE2 GLN 23 2HE2 GLN 23 44.383 34.766 -2.454
186 H GLY 24 H GLY 24 48.066 33.622 -2.150
187 1HA GLY 24 2HA GLY 24 46.851 31.208 -1.106
188 2HA GLY 24 1HA GLY 24 45.703 32.232 -2.002
189 H VAL 25 H VAL 25 48.953 30.744 -2.203
190 HA VAL 25 HA VAL 25 49.414 31.277 -4.936
191 HB VAL 25 HB VAL 25 50.493 29.020 -3.192
192 1HG1 VAL 25 1HG2 VAL 25 50.937 28.631 -5.588
193 2HG1 VAL 25 2HG2 VAL 25 52.426 29.099 -4.750
194 3HG1 VAL 25 3HG2 VAL 25 51.564 30.287 -5.752
195 1HG2 VAL 25 1HG1 VAL 25 52.401 30.562 -2.830
196 2HG2 VAL 25 2HG1 VAL 25 50.896 31.219 -2.167
197 3HG2 VAL 25 3HG1 VAL 25 51.528 31.837 -3.711
198 H LEU 26 H LEU 26 48.200 28.354 -3.287
199 HA LEU 26 HA LEU 26 47.955 26.601 -5.410
200 1HB LEU 26 1HB LEU 26 46.074 26.935 -3.052
201 2HB LEU 26 2HB LEU 26 46.224 25.486 -4.057
202 HG LEU 26 HG LEU 26 48.428 26.657 -2.295
203 1HD1 LEU 26 1HD1 LEU 26 48.033 24.659 -0.917
204 2HD1 LEU 26 2HD1 LEU 26 46.564 25.651 -1.031
205 3HD1 LEU 26 3HD1 LEU 26 46.708 24.163 -1.994
206 1HD2 LEU 26 1HD2 LEU 26 49.579 24.493 -2.783
207 2HD2 LEU 26 2HD2 LEU 26 48.324 24.116 -3.982
208 3HD2 LEU 26 3HD2 LEU 26 49.413 25.502 -4.227
209 H SER 27 H SER 27 45.657 29.181 -4.460
210 HA SER 27 HA SER 27 43.717 28.373 -6.481
211 1HB SER 27 2HB SER 27 42.498 30.373 -5.720
212 2HB SER 27 1HB SER 27 42.955 29.307 -4.376
213 HG SER 27 HG SER 27 44.316 31.660 -5.191
214 H THR 28 H THR 28 46.176 30.955 -6.066
215 HA THR 28 HA THR 28 45.496 32.460 -8.366
216 HB THR 28 HB THR 28 48.159 32.152 -6.930
217 HG1 THR 28 HG1 THR 28 47.409 34.047 -5.899
218 1HG2 THR 28 1HG2 THR 28 47.122 34.313 -8.820
219 2HG2 THR 28 2HG2 THR 28 48.458 33.186 -9.154
220 3HG2 THR 28 3HG2 THR 28 48.625 34.405 -7.877
221 H VAL 29 H VAL 29 48.040 29.939 -7.879
222 HA VAL 29 HA VAL 29 48.926 29.948 -10.563
223 HB VAL 29 HB VAL 29 50.051 29.089 -8.450
224 1HG1 VAL 29 1HG2 VAL 29 49.808 26.760 -7.854
225 2HG1 VAL 29 2HG2 VAL 29 48.231 27.555 -7.704
226 3HG1 VAL 29 3HG2 VAL 29 48.574 26.508 -9.101
227 1HG2 VAL 29 1HG1 VAL 29 51.354 27.420 -9.703
228 2HG2 VAL 29 2HG1 VAL 29 50.071 27.332 -10.934
229 3HG2 VAL 29 3HG1 VAL 29 50.990 28.841 -10.708
230 H SER 30 H SER 30 46.421 28.148 -8.851
231 HA SER 30 HA SER 30 45.851 26.250 -10.898
232 1HB SER 30 1HB SER 30 45.204 25.975 -8.524
233 2HB SER 30 2HB SER 30 44.064 27.328 -8.673
234 HG SER 30 HG SER 30 43.063 25.291 -8.967
235 H CYS 31 H CYS 31 44.102 29.260 -9.966
236 HA CYS 31 HA CYS 31 42.298 29.115 -12.190
237 1HB CYS 31 1HB CYS 31 41.518 31.242 -11.431
238 2HB CYS 31 2HB CYS 31 41.911 30.285 -9.996
239 H LYS 32 H LYS 32 45.553 29.459 -12.506
240 HA LYS 32 HA LYS 32 45.671 31.989 -13.880
241 1HB LYS 32 2HB LYS 32 47.463 31.173 -12.465
242 2HB LYS 32 1HB LYS 32 47.755 29.797 -13.557
243 1HG LYS 32 1HG LYS 32 48.613 31.152 -15.239
244 2HG LYS 32 2HG LYS 32 47.626 32.539 -14.746
245 1HD LYS 32 2HD LYS 32 49.984 32.995 -14.256
246 2HD LYS 32 1HD LYS 32 49.022 32.881 -12.769
247 1HE LYS 32 2HE LYS 32 51.179 31.714 -12.519
248 2HE LYS 32 1HE LYS 32 49.840 30.557 -12.426
249 1HZ LYS 32 1HZ LYS 32 51.484 31.081 -14.798
250 2HZ LYS 32 2HZ LYS 32 51.616 29.774 -13.801
251 3HZ LYS 32 3HZ LYS 32 50.252 29.988 -14.701
252 H LEU 33 H LEU 33 43.783 30.913 -15.171
253 HA LEU 33 HA LEU 33 44.790 29.712 -17.714
254 1HB LEU 33 1HB LEU 33 41.995 30.416 -16.725
255 2HB LEU 33 2HB LEU 33 42.364 29.859 -18.359
256 HG LEU 33 HG LEU 33 41.486 28.058 -17.063
257 1HD1 LEU 33 1HD2 LEU 33 43.246 27.567 -18.754
258 2HD1 LEU 33 2HD2 LEU 33 44.464 27.570 -17.456
259 3HD1 LEU 33 3HD2 LEU 33 43.164 26.366 -17.449
260 1HD2 LEU 33 1HD1 LEU 33 43.844 28.240 -15.156
261 2HD2 LEU 33 2HD1 LEU 33 42.470 27.128 -15.096
262 3HD2 LEU 33 3HD1 LEU 33 42.209 28.859 -14.803
263 H ALA 34 H ALA 34 46.204 31.612 -17.815
264 HA ALA 34 HA ALA 34 46.841 33.631 -18.570
265 1HB ALA 34 1HB ALA 34 45.526 34.840 -20.208
266 2HB ALA 34 2HB ALA 34 44.078 33.887 -19.832
267 3HB ALA 34 3HB ALA 34 45.490 33.104 -20.577
268 H LYS 35 H LYS 35 46.244 33.477 -15.997
269 HA LYS 35 HA LYS 35 45.724 34.606 -14.124
270 1HB LYS 35 1HB LYS 35 46.010 36.984 -15.998
271 2HB LYS 35 2HB LYS 35 46.063 37.029 -14.226
272 1HG LYS 35 2HG LYS 35 48.012 35.478 -15.983
273 2HG LYS 35 1HG LYS 35 48.312 37.066 -15.254
274 1HD LYS 35 1HD LYS 35 48.003 36.101 -12.990
275 2HD LYS 35 2HD LYS 35 47.693 34.510 -13.711
276 1HE LYS 35 2HE LYS 35 49.994 34.606 -12.954
277 2HE LYS 35 1HE LYS 35 49.967 34.539 -14.726
278 1HZ LYS 35 1HZ LYS 35 51.514 36.153 -13.897
279 2HZ LYS 35 2HZ LYS 35 50.317 36.962 -13.103
280 3HZ LYS 35 3HZ LYS 35 50.319 36.900 -14.751
281 H THR 36 H THR 36 43.531 33.526 -14.462
282 HA THR 36 HA THR 36 41.314 35.297 -15.103
283 HB THR 36 HB THR 36 41.354 32.575 -13.749
284 HG1 THR 36 HG1 THR 36 40.814 31.914 -15.883
285 1HG2 THR 36 1HG2 THR 36 39.115 34.155 -15.086
286 2HG2 THR 36 2HG2 THR 36 39.000 32.470 -14.533
287 3HG2 THR 36 3HG2 THR 36 39.238 33.772 -13.352
288 H CYS 37 H CYS 37 43.006 34.162 -12.163
289 HA CYS 37 HA CYS 37 41.553 36.254 -10.640
290 1HB CYS 37 1HB CYS 37 40.859 34.911 -8.963
291 2HB CYS 37 2HB CYS 37 40.623 33.833 -10.336
292 HXT CYS 37 HO OH 38 45.420 35.351 -10.215
Start of MODEL 13
1 1H GLY 1 1H GLY 1 69.182 56.152 15.642
2 2H GLY 1 2H GLY 1 69.656 57.576 16.328
3 3H GLY 1 3H GLY 1 68.314 56.796 16.888
4 1HA GLY 1 1HA GLY 1 67.699 58.682 15.564
5 2HA GLY 1 2HA GLY 1 68.633 57.983 14.227
6 H ILE 2 H ILE 2 66.445 58.286 13.180
7 HA ILE 2 HA ILE 2 64.388 56.327 13.864
8 HB ILE 2 HB ILE 2 63.322 57.339 11.771
9 1HG1 ILE 2 1HG1 ILE 2 64.029 59.551 11.096
10 2HG1 ILE 2 2HG1 ILE 2 65.423 59.514 12.175
11 1HG2 ILE 2 1HG2 ILE 2 62.596 59.316 13.037
12 2HG2 ILE 2 2HG2 ILE 2 63.966 59.114 14.152
13 3HG2 ILE 2 3HG2 ILE 2 62.686 57.882 14.077
14 1HD1 ILE 2 1HD1 ILE 2 66.032 59.102 9.814
15 2HD1 ILE 2 2HD1 ILE 2 66.428 57.700 10.821
16 3HD1 ILE 2 3HD1 ILE 2 64.979 57.676 9.781
17 H LEU 3 H LEU 3 66.861 55.133 13.340
18 HA LEU 3 HA LEU 3 66.982 54.254 10.585
19 1HB LEU 3 2HB LEU 3 68.476 53.362 13.086
20 2HB LEU 3 1HB LEU 3 68.922 52.972 11.420
21 HG LEU 3 HG LEU 3 68.850 55.776 12.635
22 1HD1 LEU 3 1HD2 LEU 3 70.660 54.359 13.526
23 2HD1 LEU 3 2HD2 LEU 3 71.301 55.642 12.479
24 3HD1 LEU 3 3HD2 LEU 3 71.183 53.976 11.870
25 1HD2 LEU 3 1HD1 LEU 3 69.765 54.790 9.896
26 2HD2 LEU 3 2HD1 LEU 3 68.396 55.880 10.222
27 3HD2 LEU 3 3HD1 LEU 3 70.050 56.421 10.542
28 H ASP 4 H ASP 4 65.802 52.939 13.657
29 HA ASP 4 HA ASP 4 65.199 50.311 12.438
30 1HB ASP 4 1HB ASP 4 64.577 49.735 14.744
31 2HB ASP 4 2HB ASP 4 66.228 50.383 14.672
32 HD2 ASP 4 HD2 ASP 4 63.315 52.396 16.640
33 H THR 5 H THR 5 63.956 53.455 13.055
34 HA THR 5 HA THR 5 61.282 52.717 13.635
35 HB THR 5 HB THR 5 62.411 55.362 12.647
36 HG1 THR 5 HG1 THR 5 61.874 54.347 15.245
37 1HG2 THR 5 1HG2 THR 5 59.957 55.286 12.389
38 2HG2 THR 5 2HG2 THR 5 59.791 54.706 14.063
39 3HG2 THR 5 3HG2 THR 5 60.408 56.342 13.742
40 H LEU 6 H LEU 6 62.862 54.048 10.674
41 HA LEU 6 HA LEU 6 60.594 53.683 8.947
42 1HB LEU 6 2HB LEU 6 63.577 53.852 8.372
43 2HB LEU 6 1HB LEU 6 62.286 53.997 7.172
44 HG LEU 6 HG LEU 6 62.745 55.901 9.513
45 1HD1 LEU 6 1HD1 LEU 6 63.225 56.220 6.522
46 2HD1 LEU 6 2HD1 LEU 6 64.483 56.038 7.765
47 3HD1 LEU 6 3HD1 LEU 6 63.446 57.481 7.755
48 1HD2 LEU 6 1HD2 LEU 6 60.763 55.988 7.194
49 2HD2 LEU 6 2HD2 LEU 6 60.363 55.842 8.923
50 3HD2 LEU 6 3HD2 LEU 6 61.089 57.334 8.307
51 H LYS 7 H LYS 7 63.369 51.668 9.951
52 HA LYS 7 HA LYS 7 63.136 49.581 8.116
53 1HB LYS 7 2HB LYS 7 64.970 50.022 9.799
54 2HB LYS 7 1HB LYS 7 63.883 49.414 11.059
55 1HG LYS 7 2HG LYS 7 65.367 47.641 10.389
56 2HG LYS 7 1HG LYS 7 63.736 47.236 9.811
57 1HD LYS 7 2HD LYS 7 64.334 48.101 7.561
58 2HD LYS 7 1HD LYS 7 65.948 48.542 8.163
59 1HE LYS 7 2HE LYS 7 66.399 46.157 8.685
60 2HE LYS 7 1HE LYS 7 64.790 45.720 8.072
61 1HZ LYS 7 1HZ LYS 7 65.449 46.553 5.938
62 2HZ LYS 7 2HZ LYS 7 66.486 45.375 6.444
63 3HZ LYS 7 3HZ LYS 7 66.942 46.959 6.509
64 H GLN 8 H GLN 8 61.543 50.064 11.300
65 HA GLN 8 HA GLN 8 60.103 47.658 11.442
66 1HB GLN 8 1HB GLN 8 60.436 49.222 13.316
67 2HB GLN 8 2HB GLN 8 59.460 50.444 12.495
68 1HG GLN 8 1HG GLN 8 58.181 49.282 14.238
69 2HG GLN 8 2HG GLN 8 57.473 49.053 12.631
70 1HE2 GLN 8 1HE2 GLN 8 59.938 47.481 14.773
71 2HE2 GLN 8 2HE2 GLN 8 59.409 45.843 14.459
72 H PHE 9 H PHE 9 59.174 50.864 10.146
73 HA PHE 9 HA PHE 9 56.572 50.091 9.270
74 1HB PHE 9 1HB PHE 9 57.258 52.409 9.699
75 2HB PHE 9 2HB PHE 9 58.419 52.333 8.372
76 HD1 PHE 9 HD1 PHE 9 54.762 52.093 9.153
77 HD2 PHE 9 HD2 PHE 9 57.756 52.879 6.161
78 HE1 PHE 9 HE1 PHE 9 53.002 52.891 7.598
79 HE2 PHE 9 HE2 PHE 9 55.995 53.688 4.615
80 HZ PHE 9 HZ PHE 9 53.618 53.698 5.332
81 H ALA 10 H ALA 10 59.756 50.222 7.625
82 HA ALA 10 HA ALA 10 58.819 49.719 5.010
83 1HB ALA 10 1HB ALA 10 61.503 49.031 6.276
84 2HB ALA 10 2HB ALA 10 61.161 49.128 4.534
85 3HB ALA 10 3HB ALA 10 61.061 50.589 5.540
86 H LYS 11 H LYS 11 59.772 47.427 7.624
87 HA LYS 11 HA LYS 11 59.271 45.145 5.840
88 1HB LYS 11 2HB LYS 11 59.914 43.749 7.642
89 2HB LYS 11 1HB LYS 11 61.095 45.058 7.491
90 1HG LYS 11 2HG LYS 11 60.079 46.209 9.426
91 2HG LYS 11 1HG LYS 11 58.838 44.938 9.542
92 1HD LYS 11 1HD LYS 11 60.617 43.240 9.894
93 2HD LYS 11 2HD LYS 11 61.849 44.512 9.782
94 1HE LYS 11 2HE LYS 11 61.411 43.948 12.117
95 2HE LYS 11 1HE LYS 11 60.900 45.612 11.787
96 1HZ LYS 11 1HZ LYS 11 59.136 43.264 11.877
97 2HZ LYS 11 2HZ LYS 11 59.300 44.388 13.072
98 3HZ LYS 11 3HZ LYS 11 58.658 44.822 11.619
99 H GLY 12 H GLY 12 57.445 47.173 7.989
100 1HA GLY 12 1HA GLY 12 55.247 45.256 8.183
101 2HA GLY 12 2HA GLY 12 55.239 46.950 8.758
102 H VAL 13 H VAL 13 56.328 47.893 6.111
103 HA VAL 13 HA VAL 13 54.090 47.250 4.278
104 HB VAL 13 HB VAL 13 56.431 49.194 4.059
105 1HG1 VAL 13 1HG2 VAL 13 55.061 50.228 2.224
106 2HG1 VAL 13 2HG2 VAL 13 55.633 48.614 1.804
107 3HG1 VAL 13 3HG2 VAL 13 53.948 48.844 2.326
108 1HG2 VAL 13 1HG1 VAL 13 54.831 49.919 5.811
109 2HG2 VAL 13 2HG1 VAL 13 53.483 49.701 4.676
110 3HG2 VAL 13 3HG1 VAL 13 54.697 50.963 4.389
111 H GLY 14 H GLY 14 55.500 45.180 5.172
112 1HA GLY 14 2HA GLY 14 56.781 44.193 2.696
113 2HA GLY 14 1HA GLY 14 57.686 44.064 4.215
114 H LYS 15 H LYS 15 55.128 43.783 5.777
115 HA LYS 15 HA LYS 15 54.642 40.906 5.261
116 1HB LYS 15 2HB LYS 15 53.710 40.781 7.427
117 2HB LYS 15 1HB LYS 15 55.258 41.634 7.507
118 1HG LYS 15 1HG LYS 15 53.974 42.943 8.898
119 2HG LYS 15 2HG LYS 15 53.766 43.805 7.364
120 1HD LYS 15 2HD LYS 15 51.573 42.648 7.047
121 2HD LYS 15 1HD LYS 15 51.851 41.743 8.546
122 1HE LYS 15 1HE LYS 15 50.359 43.594 9.001
123 2HE LYS 15 2HE LYS 15 51.912 43.897 9.804
124 1HZ LYS 15 1HZ LYS 15 51.079 45.831 8.693
125 2HZ LYS 15 2HZ LYS 15 52.482 45.340 7.978
126 3HZ LYS 15 3HZ LYS 15 51.035 45.044 7.245
127 H ASP 16 H ASP 16 53.241 44.076 4.895
128 HA ASP 16 HA ASP 16 50.550 43.183 4.252
129 1HB ASP 16 2HB ASP 16 51.074 45.494 4.973
130 2HB ASP 16 1HB ASP 16 52.111 45.702 3.551
131 HD2 ASP 16 HD2 ASP 16 48.064 45.508 3.044
132 H LEU 17 H LEU 17 53.709 43.271 2.711
133 HA LEU 17 HA LEU 17 52.636 43.103 -0.030
134 1HB LEU 17 1HB LEU 17 55.489 43.136 1.031
135 2HB LEU 17 2HB LEU 17 54.974 43.261 -0.653
136 HG LEU 17 HG LEU 17 54.500 45.315 1.546
137 1HD1 LEU 17 1HD1 LEU 17 56.067 45.409 -1.070
138 2HD1 LEU 17 2HD1 LEU 17 56.779 45.241 0.548
139 3HD1 LEU 17 3HD1 LEU 17 55.917 46.731 0.107
140 1HD2 LEU 17 1HD2 LEU 17 52.517 45.306 0.108
141 2HD2 LEU 17 2HD2 LEU 17 53.514 46.716 -0.277
142 3HD2 LEU 17 3HD2 LEU 17 53.540 45.299 -1.349
143 H VAL 18 H VAL 18 54.656 41.334 2.373
144 HA VAL 18 HA VAL 18 54.797 38.941 0.771
145 HB VAL 18 HB VAL 18 55.326 39.604 3.677
146 1HG1 VAL 18 1HG1 VAL 18 54.487 37.328 3.709
147 2HG1 VAL 18 2HG1 VAL 18 56.250 37.314 3.895
148 3HG1 VAL 18 3HG1 VAL 18 55.523 36.895 2.323
149 1HG2 VAL 18 1HG2 VAL 18 56.966 40.322 1.908
150 2HG2 VAL 18 2HG2 VAL 18 57.108 38.628 1.400
151 3HG2 VAL 18 3HG2 VAL 18 57.641 39.115 3.022
152 H LYS 19 H LYS 19 52.542 40.375 3.075
153 HA LYS 19 HA LYS 19 50.853 38.060 3.442
154 1HB LYS 19 1HB LYS 19 50.909 39.972 4.969
155 2HB LYS 19 2HB LYS 19 50.288 41.043 3.703
156 1HG LYS 19 2HG LYS 19 48.772 38.575 4.645
157 2HG LYS 19 1HG LYS 19 48.638 40.147 5.453
158 1HD LYS 19 1HD LYS 19 47.879 41.204 3.356
159 2HD LYS 19 2HD LYS 19 48.000 39.645 2.522
160 1HE LYS 19 1HE LYS 19 45.695 40.009 3.113
161 2HE LYS 19 2HE LYS 19 46.327 38.690 4.117
162 1HZ LYS 19 1HZ LYS 19 46.017 41.492 4.946
163 2HZ LYS 19 2HZ LYS 19 45.023 40.246 5.367
164 3HZ LYS 19 3HZ LYS 19 46.585 40.268 5.894
165 H GLY 20 H GLY 20 51.063 40.756 1.152
166 1HA GLY 20 2HA GLY 20 48.592 40.235 -0.250
167 2HA GLY 20 1HA GLY 20 49.925 41.294 -0.756
168 H ALA 21 H ALA 21 52.072 39.477 -0.741
169 HA ALA 21 HA ALA 21 51.723 37.958 -3.151
170 1HB ALA 21 1HB ALA 21 53.911 38.833 -2.387
171 2HB ALA 21 2HB ALA 21 53.844 37.749 -0.977
172 3HB ALA 21 3HB ALA 21 53.949 37.071 -2.615
173 H ALA 22 H ALA 22 51.407 37.297 0.312
174 HA ALA 22 HA ALA 22 50.989 34.426 -0.176
175 1HB ALA 22 1HB ALA 22 50.976 35.997 2.419
176 2HB ALA 22 2HB ALA 22 50.947 34.228 2.253
177 3HB ALA 22 3HB ALA 22 52.375 35.141 1.727
178 H GLN 23 H GLN 23 49.047 36.514 -1.208
179 HA GLN 23 HA GLN 23 46.659 36.191 0.422
180 1HB GLN 23 1HB GLN 23 47.092 38.211 -0.907
181 2HB GLN 23 2HB GLN 23 47.057 37.261 -2.405
182 1HG GLN 23 2HG GLN 23 44.714 36.610 -1.936
183 2HG GLN 23 1HG GLN 23 44.769 37.516 -0.411
184 1HE2 GLN 23 1HE2 GLN 23 45.425 39.915 -0.663
185 2HE2 GLN 23 2HE2 GLN 23 44.722 40.770 -2.019
186 H GLY 24 H GLY 24 47.543 35.220 -2.939
187 1HA GLY 24 2HA GLY 24 46.804 32.483 -2.608
188 2HA GLY 24 1HA GLY 24 45.481 33.380 -3.390
189 H VAL 25 H VAL 25 49.076 33.568 -3.540
190 HA VAL 25 HA VAL 25 49.022 34.104 -6.359
191 HB VAL 25 HB VAL 25 50.665 35.038 -4.808
192 1HG1 VAL 25 1HG1 VAL 25 51.075 33.005 -3.404
193 2HG1 VAL 25 2HG1 VAL 25 52.550 33.802 -3.980
194 3HG1 VAL 25 3HG1 VAL 25 52.001 32.312 -4.760
195 1HG2 VAL 25 1HG2 VAL 25 52.610 34.800 -6.291
196 2HG2 VAL 25 2HG2 VAL 25 51.113 34.930 -7.236
197 3HG2 VAL 25 3HG2 VAL 25 51.897 33.348 -7.024
198 H LEU 26 H LEU 26 49.963 31.322 -4.335
199 HA LEU 26 HA LEU 26 50.614 29.513 -6.450
200 1HB LEU 26 1HB LEU 26 49.517 28.952 -3.673
201 2HB LEU 26 2HB LEU 26 50.331 27.787 -4.727
202 HG LEU 26 HG LEU 26 51.595 30.286 -3.511
203 1HD1 LEU 26 1HD1 LEU 26 51.986 27.325 -2.924
204 2HD1 LEU 26 2HD1 LEU 26 52.876 28.669 -2.173
205 3HD1 LEU 26 3HD1 LEU 26 51.132 28.490 -1.886
206 1HD2 LEU 26 1HD2 LEU 26 52.645 29.788 -5.678
207 2HD2 LEU 26 2HD2 LEU 26 52.787 28.069 -5.238
208 3HD2 LEU 26 3HD2 LEU 26 53.726 29.299 -4.365
209 H SER 27 H SER 27 47.563 30.421 -4.853
210 HA SER 27 HA SER 27 45.946 28.351 -5.953
211 1HB SER 27 1HB SER 27 45.183 31.163 -5.071
212 2HB SER 27 2HB SER 27 44.077 29.792 -5.296
213 HG SER 27 HG SER 27 44.734 30.062 -3.116
214 H THR 28 H THR 28 46.651 31.716 -7.026
215 HA THR 28 HA THR 28 45.002 31.752 -9.311
216 HB THR 28 HB THR 28 47.660 33.144 -8.794
217 HG1 THR 28 HG1 THR 28 46.245 34.831 -8.190
218 1HG2 THR 28 1HG2 THR 28 46.824 34.788 -10.475
219 2HG2 THR 28 2HG2 THR 28 45.456 33.711 -10.829
220 3HG2 THR 28 3HG2 THR 28 47.117 33.197 -11.195
221 H VAL 29 H VAL 29 48.470 30.832 -8.970
222 HA VAL 29 HA VAL 29 49.013 30.230 -11.645
223 HB VAL 29 HB VAL 29 50.105 29.124 -9.035
224 1HG1 VAL 29 1HG1 VAL 29 51.157 28.794 -11.870
225 2HG1 VAL 29 2HG1 VAL 29 50.615 27.494 -10.778
226 3HG1 VAL 29 3HG1 VAL 29 52.072 28.424 -10.389
227 1HG2 VAL 29 1HG2 VAL 29 51.175 31.176 -11.025
228 2HG2 VAL 29 2HG2 VAL 29 50.434 31.567 -9.461
229 3HG2 VAL 29 3HG2 VAL 29 51.963 30.671 -9.515
230 H SER 30 H SER 30 47.314 28.305 -9.170
231 HA SER 30 HA SER 30 47.366 25.877 -10.732
232 1HB SER 30 1HB SER 30 47.143 25.870 -8.268
233 2HB SER 30 2HB SER 30 45.586 26.715 -8.398
234 HG SER 30 HG SER 30 45.352 24.444 -8.216
235 H CYS 31 H CYS 31 44.640 28.065 -9.863
236 HA CYS 31 HA CYS 31 43.005 27.001 -12.017
237 1HB CYS 31 1HB CYS 31 41.419 28.761 -11.300
238 2HB CYS 31 2HB CYS 31 41.937 27.686 -10.002
239 H LYS 32 H LYS 32 45.721 28.541 -12.538
240 HA LYS 32 HA LYS 32 44.755 30.791 -14.149
241 1HB LYS 32 2HB LYS 32 46.668 31.089 -12.751
242 2HB LYS 32 1HB LYS 32 47.528 29.735 -13.527
243 1HG LYS 32 2HG LYS 32 47.788 30.876 -15.544
244 2HG LYS 32 1HG LYS 32 46.437 31.987 -15.195
245 1HD LYS 32 1HD LYS 32 47.688 33.028 -13.384
246 2HD LYS 32 2HD LYS 32 49.098 31.989 -13.716
247 1HE LYS 32 2HE LYS 32 49.252 32.950 -15.993
248 2HE LYS 32 1HE LYS 32 47.845 33.982 -15.662
249 1HZ LYS 32 1HZ LYS 32 50.403 34.060 -14.228
250 2HZ LYS 32 2HZ LYS 32 49.892 35.149 -15.356
251 3HZ LYS 32 3HZ LYS 32 49.096 35.017 -13.918
252 H LEU 33 H LEU 33 46.018 27.490 -14.546
253 HA LEU 33 HA LEU 33 46.847 27.503 -17.170
254 1HB LEU 33 1HB LEU 33 47.108 25.610 -15.650
255 2HB LEU 33 2HB LEU 33 45.360 25.337 -15.638
256 HG LEU 33 HG LEU 33 45.423 24.793 -18.064
257 1HD1 LEU 33 1HD2 LEU 33 47.378 26.103 -18.780
258 2HD1 LEU 33 2HD2 LEU 33 48.438 25.137 -17.726
259 3HD1 LEU 33 3HD2 LEU 33 47.645 24.389 -19.129
260 1HD2 LEU 33 1HD1 LEU 33 47.410 23.230 -16.367
261 2HD2 LEU 33 2HD1 LEU 33 45.644 23.022 -16.361
262 3HD2 LEU 33 3HD1 LEU 33 46.578 22.634 -17.821
263 H ALA 34 H ALA 34 43.537 26.438 -16.156
264 HA ALA 34 HA ALA 34 42.500 26.942 -18.846
265 1HB ALA 34 1HB ALA 34 41.112 26.111 -16.267
266 2HB ALA 34 2HB ALA 34 41.722 25.007 -17.521
267 3HB ALA 34 3HB ALA 34 40.383 26.116 -17.889
268 H LYS 35 H LYS 35 43.227 28.838 -16.227
269 HA LYS 35 HA LYS 35 42.583 30.773 -15.345
270 1HB LYS 35 2HB LYS 35 43.667 31.262 -17.530
271 2HB LYS 35 1HB LYS 35 42.067 31.474 -18.254
272 1HG LYS 35 1HG LYS 35 43.177 33.590 -17.590
273 2HG LYS 35 2HG LYS 35 41.632 33.368 -16.749
274 1HD LYS 35 1HD LYS 35 42.779 32.628 -14.726
275 2HD LYS 35 2HD LYS 35 44.358 32.697 -15.533
276 1HE LYS 35 1HE LYS 35 42.498 35.077 -15.092
277 2HE LYS 35 2HE LYS 35 43.888 34.664 -14.070
278 1HZ LYS 35 1HZ LYS 35 45.299 34.936 -15.969
279 2HZ LYS 35 2HZ LYS 35 44.454 36.318 -15.661
280 3HZ LYS 35 3HZ LYS 35 44.014 35.348 -16.918
281 H THR 36 H THR 36 40.638 29.298 -14.636
282 HA THR 36 HA THR 36 38.074 30.627 -15.215
283 HB THR 36 HB THR 36 38.085 28.267 -14.541
284 HG1 THR 36 HG1 THR 36 36.551 28.544 -12.878
285 1HG2 THR 36 1HG2 THR 36 38.621 27.629 -12.225
286 2HG2 THR 36 2HG2 THR 36 39.195 29.273 -11.882
287 3HG2 THR 36 3HG2 THR 36 40.063 28.246 -13.051
288 H CYS 37 H CYS 37 40.994 31.122 -13.423
289 HA CYS 37 HA CYS 37 39.761 33.100 -11.581
290 1HB CYS 37 1HB CYS 37 42.481 31.793 -11.816
291 2HB CYS 37 2HB CYS 37 42.168 33.157 -10.742
292 HXT CYS 37 HO OH 38 41.055 35.063 -11.394
Start of MODEL 14
1 1H GLY 1 1H GLY 1 67.967 57.632 12.090
2 2H GLY 1 2H GLY 1 67.182 58.138 13.450
3 3H GLY 1 3H GLY 1 68.167 59.178 12.631
4 1HA GLY 1 2HA GLY 1 65.893 59.705 12.196
5 2HA GLY 1 1HA GLY 1 66.739 59.154 10.737
6 H ILE 2 H ILE 2 64.425 58.810 10.068
7 HA ILE 2 HA ILE 2 63.062 56.481 11.191
8 HB ILE 2 HB ILE 2 61.450 57.012 9.294
9 1HG1 ILE 2 2HG1 ILE 2 61.463 59.263 8.383
10 2HG1 ILE 2 1HG1 ILE 2 63.014 59.628 9.134
11 1HG2 ILE 2 1HG2 ILE 2 60.487 58.892 10.545
12 2HG2 ILE 2 2HG2 ILE 2 61.108 57.644 11.642
13 3HG2 ILE 2 3HG2 ILE 2 62.034 59.139 11.384
14 1HD1 ILE 2 1HD1 ILE 2 62.527 57.512 6.990
15 2HD1 ILE 2 2HD1 ILE 2 63.212 59.125 6.721
16 3HD1 ILE 2 3HD1 ILE 2 64.113 57.946 7.686
17 H LEU 3 H LEU 3 65.623 55.849 10.341
18 HA LEU 3 HA LEU 3 65.567 54.839 7.620
19 1HB LEU 3 1HB LEU 3 67.616 54.466 9.834
20 2HB LEU 3 2HB LEU 3 67.866 54.151 8.109
21 HG LEU 3 HG LEU 3 67.291 56.878 9.365
22 1HD1 LEU 3 1HD1 LEU 3 69.624 57.363 8.762
23 2HD1 LEU 3 2HD1 LEU 3 69.823 55.705 8.150
24 3HD1 LEU 3 3HD1 LEU 3 69.531 55.987 9.881
25 1HD2 LEU 3 1HD2 LEU 3 67.913 56.081 6.486
26 2HD2 LEU 3 2HD2 LEU 3 67.886 57.748 7.102
27 3HD2 LEU 3 3HD2 LEU 3 66.394 56.795 7.078
28 H ASP 4 H ASP 4 65.141 53.479 10.865
29 HA ASP 4 HA ASP 4 65.104 50.709 9.810
30 1HB ASP 4 2HB ASP 4 66.352 51.252 11.913
31 2HB ASP 4 1HB ASP 4 64.839 51.811 12.641
32 HD2 ASP 4 HD2 ASP 4 66.158 49.050 10.933
33 H THR 5 H THR 5 63.174 53.479 10.494
34 HA THR 5 HA THR 5 60.839 52.170 11.383
35 HB THR 5 HB THR 5 61.161 54.858 10.000
36 HG1 THR 5 HG1 THR 5 61.162 55.570 12.182
37 1HG2 THR 5 1HG2 THR 5 59.047 55.435 11.171
38 2HG2 THR 5 2HG2 THR 5 58.904 53.754 11.731
39 3HG2 THR 5 3HG2 THR 5 58.801 54.130 9.995
40 H LEU 6 H LEU 6 61.924 53.334 8.162
41 HA LEU 6 HA LEU 6 59.714 52.462 6.619
42 1HB LEU 6 2HB LEU 6 62.666 52.719 5.935
43 2HB LEU 6 1HB LEU 6 61.355 52.565 4.758
44 HG LEU 6 HG LEU 6 61.660 54.867 6.739
45 1HD1 LEU 6 1HD1 LEU 6 62.302 56.175 4.751
46 2HD1 LEU 6 2HD1 LEU 6 62.206 54.711 3.747
47 3HD1 LEU 6 3HD1 LEU 6 63.434 54.835 5.027
48 1HD2 LEU 6 1HD2 LEU 6 59.303 54.535 6.124
49 2HD2 LEU 6 2HD2 LEU 6 59.746 54.428 4.403
50 3HD2 LEU 6 3HD2 LEU 6 59.944 55.956 5.288
51 H LYS 7 H LYS 7 62.660 50.795 7.768
52 HA LYS 7 HA LYS 7 62.328 48.406 6.244
53 1HB LYS 7 1HB LYS 7 63.645 48.789 8.959
54 2HB LYS 7 2HB LYS 7 63.889 47.429 7.859
55 1HG LYS 7 1HG LYS 7 64.629 50.336 7.296
56 2HG LYS 7 2HG LYS 7 65.742 49.021 7.713
57 1HD LYS 7 2HD LYS 7 65.048 47.793 5.666
58 2HD LYS 7 1HD LYS 7 63.981 49.150 5.230
59 1HE LYS 7 1HE LYS 7 65.935 50.668 5.165
60 2HE LYS 7 2HE LYS 7 67.002 49.317 5.605
61 1HZ LYS 7 1HZ LYS 7 65.363 49.483 3.178
62 2HZ LYS 7 2HZ LYS 7 66.993 49.715 3.263
63 3HZ LYS 7 3HZ LYS 7 66.353 48.230 3.587
64 H GLN 8 H GLN 8 61.420 49.261 9.614
65 HA GLN 8 HA GLN 8 60.100 46.878 10.306
66 1HB GLN 8 2HB GLN 8 60.845 48.737 11.798
67 2HB GLN 8 1HB GLN 8 59.504 49.731 11.221
68 1HG GLN 8 1HG GLN 8 59.207 47.004 12.550
69 2HG GLN 8 2HG GLN 8 59.127 48.548 13.415
70 1HE2 GLN 8 1HE2 GLN 8 57.133 46.219 12.550
71 2HE2 GLN 8 2HE2 GLN 8 55.715 47.126 12.069
72 H PHE 9 H PHE 9 58.858 49.936 8.905
73 HA PHE 9 HA PHE 9 56.144 49.165 8.676
74 1HB PHE 9 2HB PHE 9 56.965 51.475 8.531
75 2HB PHE 9 1HB PHE 9 57.803 51.100 7.023
76 HD1 PHE 9 HD1 PHE 9 56.659 51.163 4.926
77 HD2 PHE 9 HD2 PHE 9 54.430 51.359 8.604
78 HE1 PHE 9 HE1 PHE 9 54.623 51.795 3.661
79 HE2 PHE 9 HE2 PHE 9 52.394 51.986 7.334
80 HZ PHE 9 HZ PHE 9 52.491 52.215 4.863
81 H ALA 10 H ALA 10 58.888 48.879 6.369
82 HA ALA 10 HA ALA 10 57.366 47.702 4.254
83 1HB ALA 10 1HB ALA 10 59.570 47.039 3.372
84 2HB ALA 10 2HB ALA 10 60.332 47.470 4.918
85 3HB ALA 10 3HB ALA 10 59.577 48.730 3.915
86 H LYS 11 H LYS 11 59.201 46.348 7.026
87 HA LYS 11 HA LYS 11 58.320 43.601 6.395
88 1HB LYS 11 1HB LYS 11 59.851 44.773 8.752
89 2HB LYS 11 2HB LYS 11 59.524 43.049 8.498
90 1HG LYS 11 1HG LYS 11 61.139 44.817 6.608
91 2HG LYS 11 2HG LYS 11 61.798 43.674 7.792
92 1HD LYS 11 1HD LYS 11 60.627 41.807 6.639
93 2HD LYS 11 2HD LYS 11 59.972 42.959 5.457
94 1HE LYS 11 1HE LYS 11 61.903 41.850 4.500
95 2HE LYS 11 2HE LYS 11 62.286 43.561 4.772
96 1HZ LYS 11 1HZ LYS 11 63.432 42.915 6.764
97 2HZ LYS 11 2HZ LYS 11 63.051 41.329 6.522
98 3HZ LYS 11 3HZ LYS 11 64.047 42.109 5.464
99 H GLY 12 H GLY 12 56.236 45.407 6.545
100 1HA GLY 12 1HA GLY 12 54.592 44.121 8.530
101 2HA GLY 12 2HA GLY 12 54.792 45.880 8.823
102 H VAL 13 H VAL 13 54.992 46.633 6.056
103 HA VAL 13 HA VAL 13 52.530 45.570 4.767
104 HB VAL 13 HB VAL 13 54.511 47.599 3.676
105 1HG1 VAL 13 1HG1 VAL 13 52.979 46.526 2.006
106 2HG1 VAL 13 2HG1 VAL 13 52.594 48.240 2.222
107 3HG1 VAL 13 3HG1 VAL 13 51.588 47.001 3.000
108 1HG2 VAL 13 1HG2 VAL 13 52.842 49.351 4.322
109 2HG2 VAL 13 2HG2 VAL 13 53.608 48.587 5.723
110 3HG2 VAL 13 3HG2 VAL 13 51.955 48.123 5.252
111 H GLY 14 H GLY 14 54.292 43.789 5.554
112 1HA GLY 14 1HA GLY 14 55.364 42.655 3.035
113 2HA GLY 14 2HA GLY 14 56.352 42.644 4.519
114 H LYS 15 H LYS 15 54.215 42.433 6.387
115 HA LYS 15 HA LYS 15 53.486 39.647 6.357
116 1HB LYS 15 2HB LYS 15 52.318 41.960 7.918
117 2HB LYS 15 1HB LYS 15 52.188 40.246 8.348
118 1HG LYS 15 1HG LYS 15 54.897 41.646 8.155
119 2HG LYS 15 2HG LYS 15 53.881 41.790 9.585
120 1HD LYS 15 2HD LYS 15 55.594 40.100 9.819
121 2HD LYS 15 1HD LYS 15 53.963 39.432 10.026
122 1HE LYS 15 1HE LYS 15 54.057 38.365 7.866
123 2HE LYS 15 2HE LYS 15 55.557 39.232 7.438
124 1HZ LYS 15 1HZ LYS 15 55.250 37.251 9.579
125 2HZ LYS 15 2HZ LYS 15 56.644 38.042 9.189
126 3HZ LYS 15 3HZ LYS 15 55.963 36.993 8.114
127 H ASP 16 H ASP 16 51.946 42.748 5.552
128 HA ASP 16 HA ASP 16 49.342 41.770 4.888
129 1HB ASP 16 2HB ASP 16 50.946 44.217 4.058
130 2HB ASP 16 1HB ASP 16 49.256 43.971 3.631
131 HD2 ASP 16 HD2 ASP 16 50.233 44.822 7.482
132 H LEU 17 H LEU 17 52.441 41.660 3.241
133 HA LEU 17 HA LEU 17 51.233 41.188 0.584
134 1HB LEU 17 1HB LEU 17 54.136 41.286 1.476
135 2HB LEU 17 2HB LEU 17 53.532 41.215 -0.178
136 HG LEU 17 HG LEU 17 53.146 43.536 1.758
137 1HD1 LEU 17 1HD2 LEU 17 54.587 44.747 0.163
138 2HD1 LEU 17 2HD2 LEU 17 54.733 43.283 -0.834
139 3HD1 LEU 17 3HD2 LEU 17 55.430 43.318 0.799
140 1HD2 LEU 17 1HD1 LEU 17 52.188 44.714 -0.228
141 2HD2 LEU 17 2HD1 LEU 17 52.203 43.176 -1.119
142 3HD2 LEU 17 3HD1 LEU 17 51.171 43.372 0.319
143 H VAL 18 H VAL 18 53.107 39.705 3.249
144 HA VAL 18 HA VAL 18 53.245 37.097 2.016
145 HB VAL 18 HB VAL 18 53.543 38.167 4.830
146 1HG1 VAL 18 1HG1 VAL 18 54.276 35.892 5.496
147 2HG1 VAL 18 2HG1 VAL 18 53.673 35.268 3.940
148 3HG1 VAL 18 3HG1 VAL 18 52.545 35.974 5.127
149 1HG2 VAL 18 1HG2 VAL 18 55.459 36.739 2.933
150 2HG2 VAL 18 2HG2 VAL 18 55.395 38.497 3.162
151 3HG2 VAL 18 3HG2 VAL 18 55.869 37.445 4.511
152 H LYS 19 H LYS 19 50.877 38.989 3.814
153 HA LYS 19 HA LYS 19 49.022 36.813 4.338
154 1HB LYS 19 1HB LYS 19 49.102 38.893 5.651
155 2HB LYS 19 2HB LYS 19 48.567 39.811 4.227
156 1HG LYS 19 1HG LYS 19 46.463 38.555 4.162
157 2HG LYS 19 2HG LYS 19 47.027 37.491 5.473
158 1HD LYS 19 1HD LYS 19 47.134 39.404 7.011
159 2HD LYS 19 2HD LYS 19 46.661 40.504 5.697
160 1HE LYS 19 2HE LYS 19 44.722 40.007 7.101
161 2HE LYS 19 1HE LYS 19 44.491 39.313 5.484
162 1HZ LYS 19 1HZ LYS 19 45.397 37.852 7.866
163 2HZ LYS 19 2HZ LYS 19 43.880 37.799 7.221
164 3HZ LYS 19 3HZ LYS 19 45.158 37.201 6.369
165 H GLY 20 H GLY 20 49.629 39.186 1.788
166 1HA GLY 20 2HA GLY 20 47.238 38.700 0.239
167 2HA GLY 20 1HA GLY 20 48.701 39.573 -0.265
168 H ALA 21 H ALA 21 50.663 37.604 0.159
169 HA ALA 21 HA ALA 21 50.376 35.821 -2.068
170 1HB ALA 21 1HB ALA 21 52.281 35.742 0.307
171 2HB ALA 21 2HB ALA 21 52.563 36.608 -1.221
172 3HB ALA 21 3HB ALA 21 52.460 34.834 -1.210
173 H ALA 22 H ALA 22 49.732 35.633 1.409
174 HA ALA 22 HA ALA 22 49.114 32.763 1.242
175 1HB ALA 22 1HB ALA 22 48.875 32.884 3.664
176 2HB ALA 22 2HB ALA 22 49.031 34.654 3.612
177 3HB ALA 22 3HB ALA 22 50.405 33.622 3.152
178 H GLN 23 H GLN 23 47.427 34.784 -0.228
179 HA GLN 23 HA GLN 23 44.907 34.884 1.210
180 1HB GLN 23 2HB GLN 23 45.651 36.625 -0.342
181 2HB GLN 23 1HB GLN 23 45.632 35.479 -1.693
182 1HG GLN 23 2HG GLN 23 43.212 36.186 0.023
183 2HG GLN 23 1HG GLN 23 43.641 37.012 -1.484
184 1HE2 GLN 23 2HE2 GLN 23 41.491 34.857 -0.365
185 2HE2 GLN 23 1HE2 GLN 23 41.297 33.831 -1.770
186 H GLY 24 H GLY 24 46.142 33.185 -1.731
187 1HA GLY 24 2HA GLY 24 44.781 30.723 -1.102
188 2HA GLY 24 1HA GLY 24 43.932 31.651 -2.361
189 H VAL 25 H VAL 25 47.143 30.359 -1.427
190 HA VAL 25 HA VAL 25 48.523 30.897 -3.778
191 HB VAL 25 HB VAL 25 50.051 29.122 -3.040
192 1HG1 VAL 25 1HG1 VAL 25 49.009 30.826 -0.742
193 2HG1 VAL 25 2HG1 VAL 25 50.635 30.129 -0.894
194 3HG1 VAL 25 3HG1 VAL 25 50.100 31.384 -2.033
195 1HG2 VAL 25 1HG2 VAL 25 49.627 27.943 -0.884
196 2HG2 VAL 25 2HG2 VAL 25 47.936 28.477 -0.946
197 3HG2 VAL 25 3HG2 VAL 25 48.586 27.387 -2.197
198 H LEU 26 H LEU 26 46.624 28.039 -2.880
199 HA LEU 26 HA LEU 26 46.999 26.456 -5.181
200 1HB LEU 26 1HB LEU 26 44.516 26.747 -3.455
201 2HB LEU 26 2HB LEU 26 44.883 25.389 -4.530
202 HG LEU 26 HG LEU 26 46.476 26.185 -2.050
203 1HD1 LEU 26 1HD2 LEU 26 45.576 24.094 -1.122
204 2HD1 LEU 26 2HD2 LEU 26 44.265 25.208 -1.564
205 3HD1 LEU 26 3HD2 LEU 26 44.643 23.820 -2.611
206 1HD2 LEU 26 1HD1 LEU 26 47.631 24.000 -2.421
207 2HD2 LEU 26 2HD1 LEU 26 46.803 23.848 -3.986
208 3HD2 LEU 26 3HD1 LEU 26 47.972 25.162 -3.711
209 H SER 27 H SER 27 44.772 29.180 -4.576
210 HA SER 27 HA SER 27 43.399 28.856 -7.124
211 1HB SER 27 1HB SER 27 43.363 31.134 -5.105
212 2HB SER 27 2HB SER 27 42.239 30.902 -6.459
213 HG SER 27 HG SER 27 41.649 28.904 -5.497
214 H THR 28 H THR 28 45.928 30.989 -5.736
215 HA THR 28 HA THR 28 46.071 32.787 -7.926
216 HB THR 28 HB THR 28 48.175 32.048 -5.857
217 HG1 THR 28 HG1 THR 28 47.291 33.872 -4.806
218 1HG2 THR 28 1HG2 THR 28 47.859 34.510 -7.633
219 2HG2 THR 28 2HG2 THR 28 49.036 34.337 -6.313
220 3HG2 THR 28 3HG2 THR 28 49.158 33.299 -7.746
221 H VAL 29 H VAL 29 48.098 29.917 -7.092
222 HA VAL 29 HA VAL 29 49.878 30.173 -9.254
223 HB VAL 29 HB VAL 29 50.126 28.795 -7.181
224 1HG1 VAL 29 1HG1 VAL 29 47.949 27.585 -7.298
225 2HG1 VAL 29 2HG1 VAL 29 48.565 26.667 -8.694
226 3HG1 VAL 29 3HG1 VAL 29 49.351 26.515 -7.113
227 1HG2 VAL 29 1HG2 VAL 29 50.675 27.386 -9.829
228 2HG2 VAL 29 2HG2 VAL 29 51.691 28.646 -9.091
229 3HG2 VAL 29 3HG2 VAL 29 51.501 27.074 -8.287
230 H SER 30 H SER 30 46.799 28.421 -8.965
231 HA SER 30 HA SER 30 46.850 27.336 -11.631
232 1HB SER 30 2HB SER 30 44.537 27.834 -9.701
233 2HB SER 30 1HB SER 30 44.480 26.808 -11.150
234 HG SER 30 HG SER 30 46.142 25.543 -10.199
235 H CYS 31 H CYS 31 45.268 30.160 -10.104
236 HA CYS 31 HA CYS 31 44.089 31.191 -12.500
237 1HB CYS 31 2HB CYS 31 43.420 31.757 -10.170
238 2HB CYS 31 1HB CYS 31 44.957 32.606 -9.958
239 H LYS 32 H LYS 32 47.404 30.900 -11.592
240 HA LYS 32 HA LYS 32 48.213 33.493 -12.647
241 1HB LYS 32 1HB LYS 32 49.189 32.664 -10.619
242 2HB LYS 32 2HB LYS 32 49.807 31.209 -11.435
243 1HG LYS 32 1HG LYS 32 51.431 32.372 -12.576
244 2HG LYS 32 2HG LYS 32 50.433 33.831 -12.701
245 1HD LYS 32 2HD LYS 32 52.364 34.231 -11.225
246 2HD LYS 32 1HD LYS 32 50.816 34.378 -10.369
247 1HE LYS 32 1HE LYS 32 52.516 33.161 -9.032
248 2HE LYS 32 2HE LYS 32 51.114 32.140 -9.387
249 1HZ LYS 32 1HZ LYS 32 53.173 30.995 -9.720
250 2HZ LYS 32 2HZ LYS 32 53.666 32.105 -10.836
251 3HZ LYS 32 3HZ LYS 32 52.366 31.139 -11.150
252 H LEU 33 H LEU 33 47.039 32.617 -14.639
253 HA LEU 33 HA LEU 33 48.609 31.051 -16.530
254 1HB LEU 33 2HB LEU 33 46.135 31.431 -16.617
255 2HB LEU 33 1HB LEU 33 46.420 33.119 -17.052
256 HG LEU 33 HG LEU 33 47.443 30.721 -18.650
257 1HD1 LEU 33 1HD2 LEU 33 44.958 32.432 -19.068
258 2HD1 LEU 33 2HD2 LEU 33 44.979 30.735 -18.536
259 3HD1 LEU 33 3HD2 LEU 33 45.545 31.159 -20.164
260 1HD2 LEU 33 1HD1 LEU 33 47.203 33.693 -19.308
261 2HD2 LEU 33 2HD1 LEU 33 48.700 32.733 -19.229
262 3HD2 LEU 33 3HD1 LEU 33 47.526 32.427 -20.510
263 H ALA 34 H ALA 34 47.823 34.535 -16.138
264 HA ALA 34 HA ALA 34 50.649 35.243 -16.581
265 1HB ALA 34 1HB ALA 34 49.604 35.451 -18.813
266 2HB ALA 34 2HB ALA 34 48.341 36.498 -18.128
267 3HB ALA 34 3HB ALA 34 50.036 37.042 -18.154
268 H LYS 35 H LYS 35 49.438 35.008 -14.183
269 HA LYS 35 HA LYS 35 48.685 35.995 -12.308
270 1HB LYS 35 1HB LYS 35 50.297 38.308 -13.447
271 2HB LYS 35 2HB LYS 35 49.741 38.169 -11.776
272 1HG LYS 35 2HG LYS 35 51.554 36.149 -13.149
273 2HG LYS 35 1HG LYS 35 52.166 37.503 -12.199
274 1HD LYS 35 1HD LYS 35 50.239 35.520 -10.937
275 2HD LYS 35 2HD LYS 35 51.953 35.151 -11.122
276 1HE LYS 35 1HE LYS 35 51.604 36.025 -8.927
277 2HE LYS 35 2HE LYS 35 52.572 37.178 -9.860
278 1HZ LYS 35 1HZ LYS 35 50.637 38.502 -10.145
279 2HZ LYS 35 2HZ LYS 35 50.836 38.192 -8.542
280 3HZ LYS 35 3HZ LYS 35 49.679 37.385 -9.396
281 H THR 36 H THR 36 46.604 35.850 -13.832
282 HA THR 36 HA THR 36 45.314 38.407 -14.311
283 HB THR 36 HB THR 36 43.290 37.020 -14.619
284 HG1 THR 36 HG1 THR 36 43.566 34.756 -14.491
285 1HG2 THR 36 1HG2 THR 36 44.879 37.369 -16.494
286 2HG2 THR 36 2HG2 THR 36 44.084 35.783 -16.586
287 3HG2 THR 36 3HG2 THR 36 45.762 35.899 -16.017
288 H CYS 37 H CYS 37 45.519 36.040 -11.654
289 HA CYS 37 HA CYS 37 43.787 37.694 -9.913
290 1HB CYS 37 2HB CYS 37 45.358 35.142 -9.437
291 2HB CYS 37 1HB CYS 37 44.470 36.028 -8.193
292 HXT CYS 37 HO OH 38 47.794 37.868 -9.153
Start of MODEL 15
1 1H GLY 1 1H GLY 1 66.665 54.542 14.909
2 2H GLY 1 2H GLY 1 67.013 55.204 16.379
3 3H GLY 1 3H GLY 1 66.787 56.179 15.068
4 1HA GLY 1 2HA GLY 1 64.754 54.483 16.328
5 2HA GLY 1 1HA GLY 1 64.879 56.243 16.499
6 H ILE 2 H ILE 2 64.864 57.502 14.374
7 HA ILE 2 HA ILE 2 62.530 56.911 12.899
8 HB ILE 2 HB ILE 2 63.817 59.107 13.397
9 1HG1 ILE 2 2HG1 ILE 2 61.714 59.141 12.333
10 2HG1 ILE 2 1HG1 ILE 2 62.807 60.271 11.526
11 1HG2 ILE 2 1HG2 ILE 2 65.213 59.972 11.609
12 2HG2 ILE 2 2HG2 ILE 2 65.931 58.517 12.322
13 3HG2 ILE 2 3HG2 ILE 2 65.129 58.431 10.736
14 1HD1 ILE 2 1HD1 ILE 2 63.154 58.502 9.721
15 2HD1 ILE 2 2HD1 ILE 2 61.833 57.586 10.497
16 3HD1 ILE 2 3HD1 ILE 2 61.524 59.191 9.830
17 H LEU 3 H LEU 3 65.986 56.235 12.334
18 HA LEU 3 HA LEU 3 65.619 55.260 9.640
19 1HB LEU 3 1HB LEU 3 67.863 54.833 11.651
20 2HB LEU 3 2HB LEU 3 67.941 54.451 9.925
21 HG LEU 3 HG LEU 3 67.570 57.240 11.113
22 1HD1 LEU 3 1HD1 LEU 3 69.951 55.929 9.742
23 2HD1 LEU 3 2HD1 LEU 3 69.816 56.288 11.479
24 3HD1 LEU 3 3HD1 LEU 3 69.862 57.615 10.299
25 1HD2 LEU 3 1HD2 LEU 3 68.012 57.997 8.771
26 2HD2 LEU 3 2HD2 LEU 3 66.487 57.110 8.910
27 3HD2 LEU 3 3HD2 LEU 3 67.921 56.307 8.228
28 H ASP 4 H ASP 4 64.817 53.900 12.683
29 HA ASP 4 HA ASP 4 65.067 51.112 11.713
30 1HB ASP 4 1HB ASP 4 65.809 51.644 14.024
31 2HB ASP 4 2HB ASP 4 64.185 52.235 14.405
32 HD2 ASP 4 HD2 ASP 4 62.493 50.765 14.390
33 H THR 5 H THR 5 62.953 53.870 12.251
34 HA THR 5 HA THR 5 60.541 52.423 12.376
35 HB THR 5 HB THR 5 60.989 55.324 11.575
36 HG1 THR 5 HG1 THR 5 60.538 55.647 13.788
37 1HG2 THR 5 1HG2 THR 5 58.729 54.555 10.966
38 2HG2 THR 5 2HG2 THR 5 58.663 55.629 12.376
39 3HG2 THR 5 3HG2 THR 5 58.512 53.872 12.595
40 H LEU 6 H LEU 6 62.298 54.047 9.715
41 HA LEU 6 HA LEU 6 60.461 53.627 7.613
42 1HB LEU 6 2HB LEU 6 63.503 53.702 7.606
43 2HB LEU 6 1HB LEU 6 62.468 53.897 6.186
44 HG LEU 6 HG LEU 6 62.508 55.769 8.597
45 1HD1 LEU 6 1HD1 LEU 6 64.587 55.848 7.271
46 2HD1 LEU 6 2HD1 LEU 6 63.636 56.097 5.789
47 3HD1 LEU 6 3HD1 LEU 6 63.633 57.332 7.069
48 1HD2 LEU 6 1HD2 LEU 6 61.200 57.271 7.094
49 2HD2 LEU 6 2HD2 LEU 6 61.083 55.956 5.905
50 3HD2 LEU 6 3HD2 LEU 6 60.308 55.797 7.500
51 H LYS 7 H LYS 7 63.151 51.575 8.864
52 HA LYS 7 HA LYS 7 62.929 49.481 6.992
53 1HB LYS 7 2HB LYS 7 64.824 49.931 8.483
54 2HB LYS 7 1HB LYS 7 63.841 49.470 9.888
55 1HG LYS 7 1HG LYS 7 63.602 47.191 9.009
56 2HG LYS 7 2HG LYS 7 64.460 47.654 7.515
57 1HD LYS 7 2HD LYS 7 66.455 48.236 8.821
58 2HD LYS 7 1HD LYS 7 65.607 47.818 10.328
59 1HE LYS 7 2HE LYS 7 65.365 45.474 9.538
60 2HE LYS 7 1HE LYS 7 66.211 45.894 8.033
61 1HZ LYS 7 1HZ LYS 7 67.340 46.056 10.737
62 2HZ LYS 7 2HZ LYS 7 67.666 44.887 9.620
63 3HZ LYS 7 3HZ LYS 7 68.126 46.445 9.340
64 H GLN 8 H GLN 8 61.476 49.929 10.258
65 HA GLN 8 HA GLN 8 60.049 47.497 10.374
66 1HB GLN 8 2HB GLN 8 60.588 49.061 12.241
67 2HB GLN 8 1HB GLN 8 59.363 50.186 11.648
68 1HG GLN 8 2HG GLN 8 58.847 47.294 12.475
69 2HG GLN 8 1HG GLN 8 58.632 48.696 13.536
70 1HE2 GLN 8 2HE2 GLN 8 57.277 50.563 12.325
71 2HE2 GLN 8 1HE2 GLN 8 55.764 49.991 11.656
72 H PHE 9 H PHE 9 59.024 50.797 9.382
73 HA PHE 9 HA PHE 9 56.385 50.168 8.614
74 1HB PHE 9 2HB PHE 9 57.199 52.445 8.929
75 2HB PHE 9 1HB PHE 9 58.306 52.274 7.563
76 HD1 PHE 9 HD1 PHE 9 57.564 52.622 5.313
77 HD2 PHE 9 HD2 PHE 9 54.695 52.372 8.513
78 HE1 PHE 9 HE1 PHE 9 55.772 53.357 3.766
79 HE2 PHE 9 HE2 PHE 9 52.905 53.108 6.961
80 HZ PHE 9 HZ PHE 9 53.442 53.600 4.587
81 H ALA 10 H ALA 10 59.389 50.318 6.624
82 HA ALA 10 HA ALA 10 58.203 49.447 4.189
83 1HB ALA 10 1HB ALA 10 61.061 49.156 5.201
84 2HB ALA 10 2HB ALA 10 60.527 48.983 3.514
85 3HB ALA 10 3HB ALA 10 60.396 50.557 4.328
86 H LYS 11 H LYS 11 59.479 47.696 7.016
87 HA LYS 11 HA LYS 11 59.281 45.083 5.777
88 1HB LYS 11 2HB LYS 11 60.825 45.703 7.679
89 2HB LYS 11 1HB LYS 11 59.402 45.841 8.723
90 1HG LYS 11 1HG LYS 11 60.456 43.681 9.034
91 2HG LYS 11 2HG LYS 11 58.873 43.437 8.275
92 1HD LYS 11 1HD LYS 11 59.938 43.113 6.084
93 2HD LYS 11 2HD LYS 11 61.515 43.585 6.752
94 1HE LYS 11 1HE LYS 11 61.398 41.164 6.528
95 2HE LYS 11 2HE LYS 11 61.470 41.605 8.245
96 1HZ LYS 11 1HZ LYS 11 59.038 40.907 6.754
97 2HZ LYS 11 2HZ LYS 11 59.840 39.922 7.805
98 3HZ LYS 11 3HZ LYS 11 59.111 41.294 8.355
99 H GLY 12 H GLY 12 57.158 47.255 7.603
100 1HA GLY 12 1HA GLY 12 55.041 45.269 7.873
101 2HA GLY 12 2HA GLY 12 54.929 47.015 8.240
102 H VAL 13 H VAL 13 55.994 47.763 5.534
103 HA VAL 13 HA VAL 13 53.806 46.827 3.784
104 HB VAL 13 HB VAL 13 56.093 48.771 3.256
105 1HG1 VAL 13 1HG2 VAL 13 54.603 49.590 1.419
106 2HG1 VAL 13 2HG2 VAL 13 55.098 47.915 1.154
107 3HG1 VAL 13 3HG2 VAL 13 53.471 48.266 1.780
108 1HG2 VAL 13 1HG1 VAL 13 54.377 50.568 3.529
109 2HG2 VAL 13 2HG1 VAL 13 53.198 49.343 4.044
110 3HG2 VAL 13 3HG1 VAL 13 54.630 49.682 5.038
111 H GLY 14 H GLY 14 55.348 44.945 4.889
112 1HA GLY 14 2HA GLY 14 56.501 43.652 2.496
113 2HA GLY 14 1HA GLY 14 57.437 43.647 4.007
114 H LYS 15 H LYS 15 55.082 43.676 5.737
115 HA LYS 15 HA LYS 15 54.295 40.884 5.811
116 1HB LYS 15 2HB LYS 15 53.186 43.334 7.227
117 2HB LYS 15 1HB LYS 15 52.820 41.639 7.605
118 1HG LYS 15 1HG LYS 15 55.532 43.019 7.874
119 2HG LYS 15 2HG LYS 15 54.468 42.454 9.177
120 1HD LYS 15 2HD LYS 15 54.685 40.122 8.163
121 2HD LYS 15 1HD LYS 15 55.977 40.774 7.136
122 1HE LYS 15 1HE LYS 15 57.211 41.503 9.171
123 2HE LYS 15 2HE LYS 15 55.929 40.813 10.187
124 1HZ LYS 15 1HZ LYS 15 57.768 39.328 9.955
125 2HZ LYS 15 2HZ LYS 15 57.611 39.310 8.313
126 3HZ LYS 15 3HZ LYS 15 56.420 38.677 9.262
127 H ASP 16 H ASP 16 52.893 44.004 4.781
128 HA ASP 16 HA ASP 16 50.322 43.039 3.997
129 1HB ASP 16 1HB ASP 16 50.906 45.411 4.422
130 2HB ASP 16 2HB ASP 16 51.956 45.406 2.995
131 HD2 ASP 16 HD2 ASP 16 49.337 45.709 0.716
132 H LEU 17 H LEU 17 53.514 42.827 2.566
133 HA LEU 17 HA LEU 17 52.512 42.245 -0.146
134 1HB LEU 17 1HB LEU 17 55.338 42.323 0.971
135 2HB LEU 17 2HB LEU 17 54.858 42.228 -0.723
136 HG LEU 17 HG LEU 17 54.414 44.596 1.143
137 1HD1 LEU 17 1HD1 LEU 17 55.939 45.741 -0.420
138 2HD1 LEU 17 2HD1 LEU 17 56.086 44.256 -1.386
139 3HD1 LEU 17 3HD1 LEU 17 56.726 44.305 0.271
140 1HD2 LEU 17 1HD2 LEU 17 52.489 44.446 -0.367
141 2HD2 LEU 17 2HD2 LEU 17 53.569 44.199 -1.761
142 3HD2 LEU 17 3HD2 LEU 17 53.556 45.754 -0.900
143 H VAL 18 H VAL 18 54.187 40.807 2.682
144 HA VAL 18 HA VAL 18 54.321 38.163 1.507
145 HB VAL 18 HB VAL 18 54.517 39.218 4.342
146 1HG1 VAL 18 1HG2 VAL 18 54.693 36.328 3.393
147 2HG1 VAL 18 2HG2 VAL 18 55.226 36.913 4.984
148 3HG1 VAL 18 3HG2 VAL 18 53.513 36.997 4.547
149 1HG2 VAL 18 1HG1 VAL 18 56.506 37.810 2.501
150 2HG2 VAL 18 2HG1 VAL 18 56.852 38.495 4.104
151 3HG2 VAL 18 3HG1 VAL 18 56.443 39.565 2.748
152 H LYS 19 H LYS 19 51.912 40.162 3.099
153 HA LYS 19 HA LYS 19 50.011 38.024 3.624
154 1HB LYS 19 1HB LYS 19 50.029 40.156 4.876
155 2HB LYS 19 2HB LYS 19 49.647 41.033 3.384
156 1HG LYS 19 2HG LYS 19 47.646 40.703 4.747
157 2HG LYS 19 1HG LYS 19 47.492 39.838 3.209
158 1HD LYS 19 1HD LYS 19 48.150 37.725 4.328
159 2HD LYS 19 2HD LYS 19 48.317 38.586 5.872
160 1HE LYS 19 1HE LYS 19 45.747 38.360 4.241
161 2HE LYS 19 2HE LYS 19 46.153 37.370 5.656
162 1HZ LYS 19 1HZ LYS 19 45.829 40.284 5.651
163 2HZ LYS 19 2HZ LYS 19 46.235 39.363 6.959
164 3HZ LYS 19 3HZ LYS 19 44.758 39.184 6.249
165 H GLY 20 H GLY 20 50.759 40.298 1.023
166 1HA GLY 20 1HA GLY 20 48.438 39.766 -0.616
167 2HA GLY 20 2HA GLY 20 49.928 40.613 -1.085
168 H ALA 21 H ALA 21 51.863 38.667 -0.508
169 HA ALA 21 HA ALA 21 51.675 36.798 -2.670
170 1HB ALA 21 1HB ALA 21 53.451 36.790 -0.197
171 2HB ALA 21 2HB ALA 21 53.820 37.605 -1.735
172 3HB ALA 21 3HB ALA 21 53.704 35.832 -1.672
173 H ALA 22 H ALA 22 50.858 36.734 0.775
174 HA ALA 22 HA ALA 22 50.198 33.870 0.659
175 1HB ALA 22 1HB ALA 22 51.409 34.755 2.610
176 2HB ALA 22 2HB ALA 22 49.841 34.062 3.063
177 3HB ALA 22 3HB ALA 22 50.035 35.826 2.972
178 H GLN 23 H GLN 23 48.627 35.920 -0.926
179 HA GLN 23 HA GLN 23 46.032 36.053 0.385
180 1HB GLN 23 1HB GLN 23 46.821 37.792 -1.161
181 2HB GLN 23 2HB GLN 23 46.887 36.616 -2.488
182 1HG GLN 23 2HG GLN 23 44.453 36.224 -2.261
183 2HG GLN 23 1HG GLN 23 44.398 37.361 -0.899
184 1HE2 GLN 23 1HE2 GLN 23 45.305 39.632 -1.416
185 2HE2 GLN 23 2HE2 GLN 23 44.866 40.304 -2.971
186 H GLY 24 H GLY 24 47.222 34.497 -2.642
187 1HA GLY 24 2HA GLY 24 46.221 31.904 -1.989
188 2HA GLY 24 1HA GLY 24 45.085 32.738 -3.075
189 H VAL 25 H VAL 25 48.673 32.852 -2.841
190 HA VAL 25 HA VAL 25 49.041 32.842 -5.650
191 HB VAL 25 HB VAL 25 50.594 33.783 -4.009
192 1HG1 VAL 25 1HG1 VAL 25 50.507 31.962 -2.301
193 2HG1 VAL 25 2HG1 VAL 25 51.469 30.937 -3.395
194 3HG1 VAL 25 3HG1 VAL 25 52.154 32.440 -2.754
195 1HG2 VAL 25 1HG2 VAL 25 52.663 33.086 -5.133
196 2HG2 VAL 25 2HG2 VAL 25 51.341 33.249 -6.307
197 3HG2 VAL 25 3HG2 VAL 25 51.856 31.635 -5.766
198 H LEU 26 H LEU 26 49.196 30.303 -3.177
199 HA LEU 26 HA LEU 26 49.976 28.115 -4.802
200 1HB LEU 26 2HB LEU 26 48.163 28.186 -2.359
201 2HB LEU 26 1HB LEU 26 48.983 26.757 -3.004
202 HG LEU 26 HG LEU 26 50.358 29.229 -1.855
203 1HD1 LEU 26 1HD2 LEU 26 50.042 26.403 -0.770
204 2HD1 LEU 26 2HD2 LEU 26 49.201 27.850 -0.170
205 3HD1 LEU 26 3HD2 LEU 26 50.965 27.720 -0.011
206 1HD2 LEU 26 1HD1 LEU 26 51.779 28.195 -3.574
207 2HD2 LEU 26 2HD1 LEU 26 52.408 27.806 -1.967
208 3HD2 LEU 26 3HD1 LEU 26 51.491 26.584 -2.873
209 H SER 27 H SER 27 46.768 29.551 -4.097
210 HA SER 27 HA SER 27 45.274 27.569 -5.562
211 1HB SER 27 2HB SER 27 44.546 30.420 -4.774
212 2HB SER 27 1HB SER 27 43.426 29.150 -5.307
213 HG SER 27 HG SER 27 43.558 29.321 -3.027
214 H THR 28 H THR 28 46.678 30.785 -6.366
215 HA THR 28 HA THR 28 45.476 30.849 -8.969
216 HB THR 28 HB THR 28 47.852 32.447 -7.980
217 HG1 THR 28 HG1 THR 28 45.995 32.628 -6.653
218 1HG2 THR 28 1HG2 THR 28 47.576 32.689 -10.401
219 2HG2 THR 28 2HG2 THR 28 45.813 32.788 -10.234
220 3HG2 THR 28 3HG2 THR 28 46.842 34.106 -9.643
221 H VAL 29 H VAL 29 47.976 28.848 -7.828
222 HA VAL 29 HA VAL 29 49.381 28.577 -10.353
223 HB VAL 29 HB VAL 29 48.899 26.570 -8.109
224 1HG1 VAL 29 1HG2 VAL 29 50.880 25.415 -9.070
225 2HG1 VAL 29 2HG2 VAL 29 49.520 25.444 -10.206
226 3HG1 VAL 29 3HG2 VAL 29 50.884 26.567 -10.423
227 1HG2 VAL 29 1HG1 VAL 29 51.210 27.161 -7.425
228 2HG2 VAL 29 2HG1 VAL 29 50.140 28.572 -7.337
229 3HG2 VAL 29 3HG1 VAL 29 51.270 28.400 -8.699
230 H SER 30 H SER 30 46.415 27.265 -8.882
231 HA SER 30 HA SER 30 45.761 25.655 -11.215
232 1HB SER 30 1HB SER 30 45.016 24.983 -8.966
233 2HB SER 30 2HB SER 30 44.142 26.514 -8.766
234 HG SER 30 HG SER 30 43.652 24.542 -10.756
235 H CYS 31 H CYS 31 44.132 28.509 -9.714
236 HA CYS 31 HA CYS 31 42.864 29.125 -12.270
237 1HB CYS 31 2HB CYS 31 42.012 31.117 -11.091
238 2HB CYS 31 1HB CYS 31 41.529 29.566 -10.457
239 H LYS 32 H LYS 32 45.806 29.030 -12.526
240 HA LYS 32 HA LYS 32 46.676 31.788 -12.651
241 1HB LYS 32 2HB LYS 32 48.137 30.003 -11.941
242 2HB LYS 32 1HB LYS 32 47.778 29.079 -13.405
243 1HG LYS 32 1HG LYS 32 49.956 30.016 -13.636
244 2HG LYS 32 2HG LYS 32 48.880 30.768 -14.806
245 1HD LYS 32 2HD LYS 32 49.932 32.650 -14.079
246 2HD LYS 32 1HD LYS 32 48.666 32.626 -12.848
247 1HE LYS 32 2HE LYS 32 51.510 31.537 -12.591
248 2HE LYS 32 1HE LYS 32 50.892 33.038 -11.879
249 1HZ LYS 32 1HZ LYS 32 49.376 31.712 -10.583
250 2HZ LYS 32 2HZ LYS 32 50.946 31.301 -10.286
251 3HZ LYS 32 3HZ LYS 32 50.002 30.327 -11.221
252 H LEU 33 H LEU 33 46.088 29.194 -15.046
253 HA LEU 33 HA LEU 33 47.705 29.674 -16.881
254 1HB LEU 33 2HB LEU 33 45.779 28.082 -16.924
255 2HB LEU 33 1HB LEU 33 44.821 29.295 -17.773
256 HG LEU 33 HG LEU 33 47.494 28.158 -18.738
257 1HD1 LEU 33 1HD2 LEU 33 45.746 26.426 -18.590
258 2HD1 LEU 33 2HD2 LEU 33 44.644 27.447 -19.542
259 3HD1 LEU 33 3HD2 LEU 33 46.128 26.806 -20.281
260 1HD2 LEU 33 1HD1 LEU 33 45.377 29.855 -20.137
261 2HD2 LEU 33 2HD1 LEU 33 47.075 30.300 -19.831
262 3HD2 LEU 33 3HD1 LEU 33 46.695 29.009 -20.972
263 H ALA 34 H ALA 34 44.625 31.269 -17.699
264 HA ALA 34 HA ALA 34 46.108 33.744 -18.490
265 1HB ALA 34 1HB ALA 34 43.817 32.403 -19.990
266 2HB ALA 34 2HB ALA 34 45.507 32.504 -20.533
267 3HB ALA 34 3HB ALA 34 44.537 33.984 -20.381
268 H LYS 35 H LYS 35 45.392 33.733 -16.043
269 HA LYS 35 HA LYS 35 42.649 34.755 -15.737
270 1HB LYS 35 2HB LYS 35 44.037 32.654 -14.069
271 2HB LYS 35 1HB LYS 35 42.381 33.255 -13.855
272 1HG LYS 35 2HG LYS 35 41.787 32.285 -16.090
273 2HG LYS 35 1HG LYS 35 43.450 31.685 -16.241
274 1HD LYS 35 1HD LYS 35 42.157 29.861 -15.490
275 2HD LYS 35 2HD LYS 35 43.175 30.399 -14.129
276 1HE LYS 35 1HE LYS 35 41.252 31.460 -13.069
277 2HE LYS 35 2HE LYS 35 40.300 31.363 -14.563
278 1HZ LYS 35 1HZ LYS 35 41.120 29.068 -12.943
279 2HZ LYS 35 2HZ LYS 35 40.254 29.010 -14.344
280 3HZ LYS 35 3HZ LYS 35 39.616 29.735 -13.008
281 H THR 36 H THR 36 45.556 33.937 -13.834
282 HA THR 36 HA THR 36 46.456 34.838 -12.000
283 HB THR 36 HB THR 36 45.177 37.534 -12.561
284 HG1 THR 36 HG1 THR 36 46.186 36.813 -14.460
285 1HG2 THR 36 1HG2 THR 36 46.423 37.305 -10.429
286 2HG2 THR 36 2HG2 THR 36 47.310 38.328 -11.572
287 3HG2 THR 36 3HG2 THR 36 47.816 36.645 -11.316
288 H CYS 37 H CYS 37 43.491 33.941 -12.500
289 HA CYS 37 HA CYS 37 41.851 33.252 -11.179
290 1HB CYS 37 2HB CYS 37 43.857 33.264 -9.469
291 2HB CYS 37 1HB CYS 37 42.952 34.583 -8.721
292 HXT CYS 37 HO OH 38 41.106 37.105 -10.106