Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
521740 | 2l71 RC | 17331 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 TYR 1 H1 TYR 1 1.120 -14.464 13.753
2 HA TYR 1 HA TYR 1 1.071 -16.129 11.900
3 HB2 TYR 1 HB2 TYR 1 -1.227 -17.231 13.647
4 HB3 TYR 1 HB3 TYR 1 -0.831 -17.831 12.024
5 HD1 TYR 1 HD1 TYR 1 1.306 -19.065 11.609
6 HD2 TYR 1 HD2 TYR 1 0.285 -17.714 15.566
7 HE1 TYR 1 HE1 TYR 1 2.976 -20.614 12.577
8 HE2 TYR 1 HE2 TYR 1 1.952 -19.250 16.528
9 HH TYR 1 HH TYR 1 3.585 -20.937 16.080
10 H ALA 2 H ALA 2 -0.607 -16.028 10.115
11 HA ALA 2 HA ALA 2 -2.817 -14.045 10.665
12 HB1 ALA 2 HB1 ALA 2 -2.476 -13.182 8.380
13 HB2 ALA 2 HB2 ALA 2 -0.949 -13.042 9.299
14 HB3 ALA 2 HB3 ALA 2 -1.147 -14.346 8.093
15 H GLU 3 H GLU 3 -3.284 -16.675 11.276
16 HA GLU 3 HA GLU 3 -4.047 -18.175 8.940
17 HB2 GLU 3 HB2 GLU 3 -3.548 -19.269 11.116
18 HB3 GLU 3 HB3 GLU 3 -4.988 -18.510 11.850
19 HG2 GLU 3 HG2 GLU 3 -6.484 -19.765 10.299
20 HG3 GLU 3 HG3 GLU 3 -5.074 -20.445 9.440
21 H GLY 4 H GLY 4 -6.262 -18.518 8.077
22 HA2 GLY 4 HA2 GLY 4 -8.581 -17.788 8.020
23 HA3 GLY 4 HA3 GLY 4 -8.125 -16.233 8.755
24 H THR 5 H THR 5 -5.678 -15.633 7.339
25 HA THR 5 HA THR 5 -6.744 -15.222 4.562
26 HB THR 5 HB THR 5 -4.988 -13.435 4.467
27 HG1 THR 5 HG1 THR 5 -3.567 -14.357 6.170
28 HG21 THR 5 HG21 THR 5 -7.320 -12.858 5.214
29 HG22 THR 5 HG22 THR 5 -6.092 -11.854 6.035
30 HG23 THR 5 HG23 THR 5 -6.862 -13.208 6.909
31 H PHE 6 H PHE 6 -5.555 -17.904 5.574
32 HA PHE 6 HA PHE 6 -3.030 -17.976 3.939
33 HB2 PHE 6 HB2 PHE 6 -4.540 -20.147 5.505
34 HB3 PHE 6 HB3 PHE 6 -2.975 -20.350 4.675
35 HD1 PHE 6 HD2 PHE 6 -2.351 -17.193 5.989
36 HD2 PHE 6 HD1 PHE 6 -3.321 -21.135 7.439
37 HE1 PHE 6 HE2 PHE 6 -0.784 -16.899 7.839
38 HE2 PHE 6 HE1 PHE 6 -1.925 -20.727 9.438
39 HZ PHE 6 HZ PHE 6 -0.603 -18.629 9.620
40 H ILE 7 H ILE 7 -4.640 -17.040 2.207
41 HA ILE 7 HA ILE 7 -6.375 -19.206 1.101
42 HB ILE 7 HB ILE 7 -6.172 -16.216 0.472
43 HG12 ILE 7 HG12 ILE 7 -8.391 -17.846 1.868
44 HG13 ILE 7 HG13 ILE 7 -7.159 -16.897 2.728
45 HG21 ILE 7 HG21 ILE 7 -8.156 -16.610 -1.013
46 HG22 ILE 7 HG22 ILE 7 -6.768 -17.560 -1.565
47 HG23 ILE 7 HG23 ILE 7 -8.080 -18.361 -0.656
48 HD11 ILE 7 HD11 ILE 7 -9.192 -15.567 2.621
49 HD12 ILE 7 HD12 ILE 7 -7.967 -14.792 1.579
50 HD13 ILE 7 HD13 ILE 7 -9.308 -15.735 0.855
51 H SER 8 H SER 8 -3.819 -16.800 -0.070
52 HA SER 8 HA SER 8 -3.433 -18.313 -2.499
53 HB2 SER 8 HB2 SER 8 -1.532 -16.332 -1.093
54 HB3 SER 8 HB3 SER 8 -1.269 -17.061 -2.698
55 HG SER 8 HG SER 8 -3.523 -15.396 -2.067
56 H ASP 9 H ASP 9 -1.616 -18.110 0.678
57 HA ASP 9 HA ASP 9 -1.003 -20.946 0.571
58 HB2 ASP 9 HB2 ASP 9 0.600 -20.342 -1.150
59 HB3 ASP 9 HB3 ASP 9 1.122 -18.901 -0.272
60 H TYR 10 H TYR 10 0.844 -18.063 1.882
61 HA TYR 10 HA TYR 10 -0.190 -18.441 4.553
62 HB2 TYR 10 HB2 TYR 10 2.567 -19.689 3.908
63 HB3 TYR 10 HB3 TYR 10 2.103 -19.165 5.538
64 HD1 TYR 10 HD1 TYR 10 0.055 -20.162 6.646
65 HD2 TYR 10 HD2 TYR 10 1.800 -21.865 3.107
66 HE1 TYR 10 HE1 TYR 10 -1.050 -22.331 7.128
67 HE2 TYR 10 HE2 TYR 10 0.552 -23.948 3.481
68 HH TYR 10 HH TYR 10 -0.876 -25.159 4.970
69 H SER 11 H SER 11 2.988 -17.600 2.881
70 HA SER 11 HA SER 11 2.519 -14.775 3.662
71 HB2 SER 11 HB2 SER 11 5.027 -16.376 4.440
72 HB3 SER 11 HB3 SER 11 4.773 -14.614 4.682
73 HG SER 11 HG SER 11 4.181 -15.881 6.616
74 H ILE 12 H ILE 12 2.058 -15.603 1.180
75 HA ILE 12 HA ILE 12 4.558 -14.791 -0.301
76 HB ILE 12 HB ILE 12 2.328 -16.643 -1.307
77 HG12 ILE 12 HG12 ILE 12 5.226 -17.222 -0.444
78 HG13 ILE 12 HG13 ILE 12 3.729 -17.772 0.353
79 HG21 ILE 12 HG21 ILE 12 3.686 -16.791 -3.373
80 HG22 ILE 12 HG22 ILE 12 3.342 -15.084 -3.054
81 HG23 ILE 12 HG23 ILE 12 4.952 -15.748 -2.657
82 HD11 ILE 12 HD11 ILE 12 3.146 -19.055 -1.813
83 HD12 ILE 12 HD12 ILE 12 4.791 -18.665 -2.399
84 HD13 ILE 12 HD13 ILE 12 4.582 -19.647 -0.932
85 H ALA 13 H ALA 13 0.883 -14.874 -0.772
86 HA ALA 13 HA ALA 13 1.043 -12.330 -2.180
87 HB1 ALA 13 HB1 ALA 13 -0.814 -13.961 -2.605
88 HB2 ALA 13 HB2 ALA 13 -1.398 -13.743 -0.924
89 HB3 ALA 13 HB3 ALA 13 -1.435 -12.369 -2.069
90 H MET 14 H MET 14 0.292 -13.456 1.227
91 HA MET 14 HA MET 14 -0.756 -10.927 2.024
92 HB2 MET 14 HB2 MET 14 0.441 -13.215 3.688
93 HB3 MET 14 HB3 MET 14 -0.035 -11.672 4.414
94 HG2 MET 14 HG2 MET 14 -1.893 -13.268 4.646
95 HG3 MET 14 HG3 MET 14 -2.374 -11.918 3.592
96 HE1 MET 14 HE1 MET 14 -1.726 -16.318 2.287
97 HE2 MET 14 HE2 MET 14 -0.244 -15.389 2.641
98 HE3 MET 14 HE3 MET 14 -1.461 -15.665 3.930
99 H ASP 15 H ASP 15 2.624 -12.316 2.676
100 HA ASP 15 HA ASP 15 3.441 -9.907 3.894
101 HB2 ASP 15 HB2 ASP 15 5.778 -10.604 3.520
102 HB3 ASP 15 HB3 ASP 15 4.790 -11.968 4.110
103 H LYS 16 H LYS 16 3.569 -10.861 0.359
104 HA LYS 16 HA LYS 16 5.139 -8.549 -0.321
105 HB2 LYS 16 HB2 LYS 16 5.025 -10.540 -1.739
106 HB3 LYS 16 HB3 LYS 16 3.313 -10.264 -2.122
107 HG2 LYS 16 HG2 LYS 16 5.508 -8.186 -2.763
108 HG3 LYS 16 HG3 LYS 16 5.100 -9.523 -3.867
109 HD2 LYS 16 HD2 LYS 16 2.746 -8.734 -4.052
110 HD3 LYS 16 HD3 LYS 16 3.106 -7.341 -3.002
111 HE2 LYS 16 HE2 LYS 16 4.801 -6.493 -4.587
112 HE3 LYS 16 HE3 LYS 16 4.498 -7.874 -5.679
113 HZ1 LYS 16 HZ1 LYS 16 2.168 -7.133 -5.965
114 HZ2 LYS 16 HZ2 LYS 16 3.267 -5.850 -6.383
115 HZ3 LYS 16 HZ3 LYS 16 2.431 -5.808 -4.861
116 H ILE 17 H ILE 17 1.564 -9.242 -0.705
117 HA ILE 17 HA ILE 17 1.043 -6.606 -1.711
118 HB ILE 17 HB ILE 17 -0.832 -8.601 -0.348
119 HG12 ILE 17 HG12 ILE 17 0.126 -9.416 -2.552
120 HG13 ILE 17 HG13 ILE 17 -1.633 -9.202 -2.565
121 HG21 ILE 17 HG21 ILE 17 -1.885 -6.461 -0.043
122 HG22 ILE 17 HG22 ILE 17 -1.521 -5.945 -1.711
123 HG23 ILE 17 HG23 ILE 17 -2.716 -7.239 -1.408
124 HD11 ILE 17 HD11 ILE 17 -1.350 -7.039 -3.850
125 HD12 ILE 17 HD12 ILE 17 0.421 -7.275 -3.847
126 HD13 ILE 17 HD13 ILE 17 -0.630 -8.435 -4.682
127 H HIS 18 H HIS 18 1.119 -7.930 1.671
128 HA HIS 18 HA HIS 18 -0.021 -5.548 2.799
129 HB2 HIS 18 HB2 HIS 18 1.944 -7.516 4.107
130 HB3 HIS 18 HB3 HIS 18 0.987 -6.271 4.947
131 HD1 HIS 18 HD1 HIS 18 0.414 -8.734 6.087
132 HD2 HIS 18 HD2 HIS 18 -1.441 -7.673 2.458
133 HE1 HIS 18 HE1 HIS 18 -1.671 -10.160 5.922
134 H GLN 19 H GLN 19 3.458 -6.621 2.251
135 HA GLN 19 HA GLN 19 4.608 -4.281 3.306
136 HB2 GLN 19 HB2 GLN 19 5.943 -6.234 2.786
137 HB3 GLN 19 HB3 GLN 19 5.681 -6.064 1.038
138 HG2 GLN 19 HG2 GLN 19 7.022 -3.878 2.767
139 HG3 GLN 19 HG3 GLN 19 7.932 -5.198 1.994
140 HE21 GLN 19 HE21 GLN 19 8.832 -2.770 1.271
141 HE22 GLN 19 HE22 GLN 19 8.310 -2.394 -0.329
142 H GLN 20 H GLN 20 3.827 -4.932 -0.212
143 HA GLN 20 HA GLN 20 4.315 -2.371 -1.179
144 HB2 GLN 20 HB2 GLN 20 3.575 -4.173 -2.685
145 HB3 GLN 20 HB3 GLN 20 2.028 -4.323 -1.822
146 HG2 GLN 20 HG2 GLN 20 1.360 -1.990 -2.613
147 HG3 GLN 20 HG3 GLN 20 2.905 -1.891 -3.496
148 HE21 GLN 20 HE21 GLN 20 -0.073 -4.021 -3.077
149 HE22 GLN 20 HE22 GLN 20 -0.111 -4.527 -4.723
150 H ASP 21 H ASP 21 1.218 -3.551 0.389
151 HA ASP 21 HA ASP 21 -0.095 -1.077 -0.150
152 HB2 ASP 21 HB2 ASP 21 -0.850 -3.272 1.855
153 HB3 ASP 21 HB3 ASP 21 -1.863 -1.868 1.427
154 H PHE 22 H PHE 22 0.983 -2.367 3.194
155 HA PHE 22 HA PHE 22 0.287 0.116 4.289
156 HB2 PHE 22 HB2 PHE 22 1.500 -0.380 6.322
157 HB3 PHE 22 HB3 PHE 22 0.501 -1.745 5.791
158 HD1 PHE 22 HD2 PHE 22 4.043 -0.417 5.787
159 HD2 PHE 22 HD1 PHE 22 1.533 -3.900 5.480
160 HE1 PHE 22 HE2 PHE 22 6.023 -1.873 6.057
161 HE2 PHE 22 HE1 PHE 22 3.517 -5.354 5.738
162 HZ PHE 22 HZ PHE 22 5.768 -4.343 6.035
163 H VAL 23 H VAL 23 3.448 -0.940 2.786
164 HA VAL 23 HA VAL 23 4.865 1.352 3.726
165 HB VAL 23 HB VAL 23 5.285 -0.278 1.157
166 HG11 VAL 23 HG11 VAL 23 6.157 1.968 0.694
167 HG12 VAL 23 HG12 VAL 23 6.980 2.026 2.284
168 HG13 VAL 23 HG13 VAL 23 7.529 0.887 1.020
169 HG21 VAL 23 HG21 VAL 23 6.844 -0.138 3.832
170 HG22 VAL 23 HG22 VAL 23 5.777 -1.478 3.349
171 HG23 VAL 23 HG23 VAL 23 7.265 -1.158 2.432
172 H ASN 24 H ASN 24 2.993 0.872 0.591
173 HA ASN 24 HA ASN 24 3.372 3.513 -0.298
174 HB2 ASN 24 HB2 ASN 24 2.274 1.843 -1.768
175 HB3 ASN 24 HB3 ASN 24 0.876 1.740 -0.673
176 HD21 ASN 24 HD21 ASN 24 2.752 4.175 -2.700
177 HD22 ASN 24 HD22 ASN 24 1.375 5.175 -2.986
178 H TRP 25 H TRP 25 0.683 2.156 1.788
179 HA TRP 25 HA TRP 25 -0.822 4.496 1.951
180 HB2 TRP 25 HB2 TRP 25 -1.674 2.372 2.918
181 HB3 TRP 25 HB3 TRP 25 -0.312 2.351 4.066
182 HD1 TRP 25 HD1 TRP 25 -2.831 5.274 3.401
183 HE1 TRP 25 HE1 TRP 25 -3.806 5.936 5.623
184 HE3 TRP 25 HE3 TRP 25 -0.482 1.782 6.447
185 HZ2 TRP 25 HZ2 TRP 25 -3.711 5.178 8.261
186 HZ3 TRP 25 HZ3 TRP 25 -1.022 1.849 8.885
187 HH2 TRP 25 HH2 TRP 25 -2.611 3.521 9.779
188 H LEU 26 H LEU 26 2.022 3.504 4.052
189 HA LEU 26 HA LEU 26 1.552 5.712 5.861
190 HB2 LEU 26 HB2 LEU 26 4.076 4.040 5.397
191 HB3 LEU 26 HB3 LEU 26 3.884 5.215 6.719
192 HG LEU 26 HG LEU 26 2.085 2.722 6.375
193 HD11 LEU 26 HD11 LEU 26 3.415 1.713 8.213
194 HD12 LEU 26 HD12 LEU 26 4.475 3.153 8.266
195 HD13 LEU 26 HD13 LEU 26 4.473 2.088 6.830
196 HD21 LEU 26 HD21 LEU 26 0.900 4.451 7.694
197 HD22 LEU 26 HD22 LEU 26 2.352 4.710 8.707
198 HD23 LEU 26 HD23 LEU 26 1.467 3.160 8.770
199 H LEU 27 H LEU 27 4.076 5.245 3.208
200 HA LEU 27 HA LEU 27 5.027 7.907 3.624
201 HB2 LEU 27 HB2 LEU 27 6.277 7.744 1.555
202 HB3 LEU 27 HB3 LEU 27 6.366 6.239 2.492
203 HG LEU 27 HG LEU 27 4.421 5.411 0.861
204 HD11 LEU 27 HD11 LEU 27 5.721 7.553 -0.940
205 HD12 LEU 27 HD12 LEU 27 4.066 7.683 -0.311
206 HD13 LEU 27 HD13 LEU 27 4.481 6.359 -1.415
207 HD21 LEU 27 HD21 LEU 27 6.141 4.557 -0.751
208 HD22 LEU 27 HD22 LEU 27 6.696 4.417 0.936
209 HD23 LEU 27 HD23 LEU 27 7.326 5.728 -0.099
210 H ALA 28 H ALA 28 2.318 6.617 1.614
211 HA ALA 28 HA ALA 28 1.890 9.096 0.218
212 HB1 ALA 28 HB1 ALA 28 0.902 6.918 -0.566
213 HB2 ALA 28 HB2 ALA 28 -0.139 6.869 0.891
214 HB3 ALA 28 HB3 ALA 28 -0.358 8.164 -0.323
215 H GLN 29 H GLN 29 0.669 7.738 3.383
216 HA GLN 29 HA GLN 29 -1.369 9.566 3.856
217 HB2 GLN 29 HB2 GLN 29 -0.838 7.708 5.426
218 HB3 GLN 29 HB3 GLN 29 0.682 8.507 5.906
219 HG2 GLN 29 HG2 GLN 29 -0.586 10.453 6.838
220 HG3 GLN 29 HG3 GLN 29 -2.125 9.697 6.353
221 HE21 GLN 29 HE21 GLN 29 -2.468 7.333 7.274
222 HE22 GLN 29 HE22 GLN 29 -1.921 7.079 8.889
223 H LYS 30 H LYS 30 2.239 10.018 4.332
224 HA LYS 30 HA LYS 30 1.794 12.752 5.250
225 HB2 LYS 30 HB2 LYS 30 3.828 11.253 5.802
226 HB3 LYS 30 HB3 LYS 30 4.460 11.668 4.194
227 HG2 LYS 30 HG2 LYS 30 3.817 13.583 6.533
228 HG3 LYS 30 HG3 LYS 30 5.429 13.119 5.935
229 HD2 LYS 30 HD2 LYS 30 4.850 14.266 3.702
230 HD3 LYS 30 HD3 LYS 30 3.350 14.848 4.480
231 HE2 LYS 30 HE2 LYS 30 4.761 15.943 6.298
232 HE3 LYS 30 HE3 LYS 30 6.207 15.537 5.331
233 HZ1 LYS 30 HZ1 LYS 30 5.211 16.846 3.433
234 HZ2 LYS 30 HZ2 LYS 30 5.469 17.822 4.852
235 HZ3 LYS 30 HZ3 LYS 30 3.868 17.277 4.456
236 H GLY 31 H GLY 31 3.198 11.240 2.174
237 HA2 GLY 31 HA2 GLY 31 3.694 13.471 0.754
238 HA3 GLY 31 HA3 GLY 31 3.002 12.025 -0.024
239 H LYS 32 H LYS 32 0.364 11.918 0.737
240 HA LYS 32 HA LYS 32 -0.741 13.745 -1.032
241 HB2 LYS 32 HB2 LYS 32 -2.941 13.130 -0.296
242 HB3 LYS 32 HB3 LYS 32 -1.930 11.672 -0.190
243 HG2 LYS 32 HG2 LYS 32 -1.641 12.135 2.298
244 HG3 LYS 32 HG3 LYS 32 -2.790 13.492 2.171
245 HD2 LYS 32 HD2 LYS 32 -3.441 10.541 1.548
246 HD3 LYS 32 HD3 LYS 32 -3.830 11.403 3.059
247 HE2 LYS 32 HE2 LYS 32 -5.235 13.058 1.702
248 HE3 LYS 32 HE3 LYS 32 -4.973 12.025 0.268
249 HZ1 LYS 32 HZ1 LYS 32 -6.034 10.139 1.445
250 HZ2 LYS 32 HZ2 LYS 32 -7.104 11.507 1.335
251 HZ3 LYS 32 HZ3 LYS 32 -6.315 11.146 2.841
252 H LYS 33 H LYS 33 -0.145 14.219 2.519
253 HA LYS 33 HA LYS 33 -1.854 16.318 2.998
254 HB2 LYS 33 HB2 LYS 33 1.092 16.191 3.900
255 HB3 LYS 33 HB3 LYS 33 -0.097 17.387 4.476
256 HG2 LYS 33 HG2 LYS 33 -1.505 15.639 5.492
257 HG3 LYS 33 HG3 LYS 33 -0.491 14.351 4.813
258 HD2 LYS 33 HD2 LYS 33 0.040 14.606 7.165
259 HD3 LYS 33 HD3 LYS 33 1.454 15.099 6.203
260 HE2 LYS 33 HE2 LYS 33 0.946 17.499 6.603
261 HE3 LYS 33 HE3 LYS 33 -0.587 17.067 7.417
262 HZ1 LYS 33 HZ1 LYS 33 1.213 17.578 9.025
263 HZ2 LYS 33 HZ2 LYS 33 2.197 16.302 8.365
264 HZ3 LYS 33 HZ3 LYS 33 0.703 15.927 9.186
265 H ASN 34 H ASN 34 1.391 16.504 1.321
266 HA ASN 34 HA ASN 34 1.207 19.323 0.868
267 HB2 ASN 34 HB2 ASN 34 3.354 18.143 0.500
268 HB3 ASN 34 HB3 ASN 34 2.642 17.168 -0.804
269 HD21 ASN 34 HD21 ASN 34 3.311 20.649 0.144
270 HD22 ASN 34 HD22 ASN 34 3.459 21.199 -1.485
271 H ASP 35 H ASP 35 0.313 16.451 -1.281
272 HA ASP 35 HA ASP 35 -1.037 18.394 -3.093
273 HB2 ASP 35 HB2 ASP 35 0.577 16.650 -3.961
274 HB3 ASP 35 HB3 ASP 35 -0.575 15.388 -3.453
275 H TRP 36 H TRP 36 -2.399 18.361 -0.667
276 HA TRP 36 HA TRP 36 -4.970 17.418 -1.608
277 HB2 TRP 36 HB2 TRP 36 -3.883 15.316 -0.631
278 HB3 TRP 36 HB3 TRP 36 -4.022 16.029 0.981
279 HD1 TRP 36 HD1 TRP 36 -5.781 13.857 -1.366
280 HE1 TRP 36 HE1 TRP 36 -8.181 13.495 -0.734
281 HE3 TRP 36 HE3 TRP 36 -6.389 17.710 2.076
282 HZ2 TRP 36 HZ2 TRP 36 -10.099 14.561 0.882
283 HZ3 TRP 36 HZ3 TRP 36 -8.627 17.944 3.136
284 HH2 TRP 36 HH2 TRP 36 -10.470 16.401 2.540
285 H LYS 37 H LYS 37 -3.274 18.232 1.586
286 HA LYS 37 HA LYS 37 -5.523 20.057 2.197
287 HB2 LYS 37 HB2 LYS 37 -2.925 19.510 3.764
288 HB3 LYS 37 HB3 LYS 37 -4.139 20.747 4.160
289 HG2 LYS 37 HG2 LYS 37 -4.711 18.968 5.591
290 HG3 LYS 37 HG3 LYS 37 -5.908 18.864 4.284
291 HD2 LYS 37 HD2 LYS 37 -4.414 16.996 3.256
292 HD3 LYS 37 HD3 LYS 37 -3.378 17.149 4.697
293 HE2 LYS 37 HE2 LYS 37 -5.349 16.529 6.144
294 HE3 LYS 37 HE3 LYS 37 -6.367 16.383 4.683
295 HZ1 LYS 37 HZ1 LYS 37 -5.541 14.184 5.419
296 HZ2 LYS 37 HZ2 LYS 37 -3.897 14.716 5.289
297 HZ3 LYS 37 HZ3 LYS 37 -4.882 14.578 3.857
298 H HIS 38 H HIS 38 -1.904 20.296 1.533
299 HA HIS 38 HA HIS 38 -2.369 23.218 0.967
300 HB2 HIS 38 HB2 HIS 38 -0.812 22.544 2.816
301 HB3 HIS 38 HB3 HIS 38 0.199 21.676 1.640
302 HD1 HIS 38 HD1 HIS 38 1.949 23.106 0.553
303 HD2 HIS 38 HD2 HIS 38 -1.148 25.352 2.298
304 HE1 HIS 38 HE1 HIS 38 2.690 25.519 0.404
305 H ASN 39 H ASN 39 -3.311 21.403 -1.020
306 HA ASN 39 HA ASN 39 -1.198 21.007 -2.976
307 HB2 ASN 39 HB2 ASN 39 -3.358 19.659 -2.832
308 HB3 ASN 39 HB3 ASN 39 -4.231 21.071 -3.480
309 HD21 ASN 39 HD21 ASN 39 -4.358 18.643 -4.887
310 HD22 ASN 39 HD22 ASN 39 -3.404 18.762 -6.319
311 H ILE 40 H ILE 40 -3.756 23.529 -2.333
312 HA ILE 40 HA ILE 40 -3.374 25.162 -4.506
313 HB ILE 40 HB ILE 40 -4.906 25.670 -2.584
314 HG12 ILE 40 HG12 ILE 40 -3.062 28.028 -3.327
315 HG13 ILE 40 HG13 ILE 40 -4.392 27.388 -4.322
316 HG21 ILE 40 HG21 ILE 40 -4.105 26.720 -0.505
317 HG22 ILE 40 HG22 ILE 40 -3.160 25.239 -0.729
318 HG23 ILE 40 HG23 ILE 40 -2.439 26.817 -1.133
319 HD11 ILE 40 HD11 ILE 40 -4.659 28.772 -1.578
320 HD12 ILE 40 HD12 ILE 40 -5.169 29.390 -3.163
321 HD13 ILE 40 HD13 ILE 40 -6.012 27.987 -2.449
322 H THR 41 H THR 41 -0.929 24.534 -1.916
323 HA THR 41 HA THR 41 1.197 25.301 -1.697
324 HB THR 41 HB THR 41 1.616 23.956 -3.618
325 HG1 THR 41 HG1 THR 41 3.362 25.374 -2.828
326 HG21 THR 41 HG21 THR 41 1.040 26.393 -5.413
327 HG22 THR 41 HG22 THR 41 0.148 24.839 -5.403
328 HG23 THR 41 HG23 THR 41 1.848 24.889 -5.906
329 H GLN 42 H GLN 42 -0.034 27.122 -0.586
330 HA GLN 42 HA GLN 42 1.202 29.615 -1.575
331 HB2 GLN 42 HB2 GLN 42 -1.021 29.473 -2.793
332 HB3 GLN 42 HB3 GLN 42 -1.848 29.309 -1.220
333 HG2 GLN 42 HG2 GLN 42 -0.990 31.607 -0.559
334 HG3 GLN 42 HG3 GLN 42 -0.147 31.729 -2.122
335 HE21 GLN 42 HE21 GLN 42 -3.495 31.204 -0.691
336 HE22 GLN 42 HE22 GLN 42 -4.309 32.003 -1.983
Start of MODEL 2
1 H1 TYR 1 H1 TYR 1 2.388 -17.194 11.184
2 HA TYR 1 HA TYR 1 2.301 -19.220 12.645
3 HB2 TYR 1 HB2 TYR 1 -0.216 -17.758 13.685
4 HB3 TYR 1 HB3 TYR 1 0.344 -19.356 14.229
5 HD1 TYR 1 HD2 TYR 1 2.436 -19.554 15.594
6 HD2 TYR 1 HD1 TYR 1 1.009 -15.696 14.332
7 HE1 TYR 1 HE2 TYR 1 3.980 -18.455 17.186
8 HE2 TYR 1 HE1 TYR 1 2.552 -14.603 15.908
9 HH TYR 1 HH TYR 1 4.245 -14.915 17.565
10 H ALA 2 H ALA 2 0.682 -21.082 12.137
11 HA ALA 2 HA ALA 2 -0.338 -20.799 9.495
12 HB1 ALA 2 HB1 ALA 2 0.087 -23.046 10.455
13 HB2 ALA 2 HB2 ALA 2 -1.223 -22.819 11.651
14 HB3 ALA 2 HB3 ALA 2 -1.613 -22.914 9.908
15 H GLU 3 H GLU 3 -2.032 -20.706 12.758
16 HA GLU 3 HA GLU 3 -4.590 -20.233 11.757
17 HB2 GLU 3 HB2 GLU 3 -4.134 -20.658 14.163
18 HB3 GLU 3 HB3 GLU 3 -3.373 -19.048 14.316
19 HG2 GLU 3 HG2 GLU 3 -5.573 -17.948 13.773
20 HG3 GLU 3 HG3 GLU 3 -6.320 -19.548 13.512
21 H GLY 4 H GLY 4 -5.739 -18.223 11.091
22 HA2 GLY 4 HA2 GLY 4 -5.935 -15.926 10.686
23 HA3 GLY 4 HA3 GLY 4 -4.345 -15.658 11.414
24 H THR 5 H THR 5 -2.416 -16.751 10.013
25 HA THR 5 HA THR 5 -2.449 -15.215 7.648
26 HB THR 5 HB THR 5 -0.387 -16.287 6.936
27 HG1 THR 5 HG1 THR 5 -0.754 -18.261 8.958
28 HG21 THR 5 HG21 THR 5 1.097 -15.831 8.833
29 HG22 THR 5 HG22 THR 5 -0.250 -15.874 9.992
30 HG23 THR 5 HG23 THR 5 -0.191 -14.589 8.761
31 H PHE 6 H PHE 6 -3.181 -18.770 8.134
32 HA PHE 6 HA PHE 6 -3.068 -19.502 5.468
33 HB2 PHE 6 HB2 PHE 6 -4.542 -21.332 5.869
34 HB3 PHE 6 HB3 PHE 6 -3.675 -21.097 7.401
35 HD1 PHE 6 HD1 PHE 6 -6.909 -20.694 5.561
36 HD2 PHE 6 HD2 PHE 6 -4.980 -20.283 9.378
37 HE1 PHE 6 HE1 PHE 6 -9.116 -20.600 6.669
38 HE2 PHE 6 HE2 PHE 6 -7.188 -20.257 10.497
39 HZ PHE 6 HZ PHE 6 -9.265 -20.393 9.140
40 H ILE 7 H ILE 7 -5.653 -17.655 7.185
41 HA ILE 7 HA ILE 7 -7.718 -18.059 5.344
42 HB ILE 7 HB ILE 7 -7.134 -15.565 7.019
43 HG12 ILE 7 HG12 ILE 7 -9.241 -17.799 7.392
44 HG13 ILE 7 HG13 ILE 7 -7.676 -17.769 8.235
45 HG21 ILE 7 HG21 ILE 7 -8.518 -14.893 5.047
46 HG22 ILE 7 HG22 ILE 7 -9.660 -16.225 5.388
47 HG23 ILE 7 HG23 ILE 7 -9.497 -14.846 6.513
48 HD11 ILE 7 HD11 ILE 7 -9.342 -16.947 9.766
49 HD12 ILE 7 HD12 ILE 7 -8.272 -15.587 9.323
50 HD13 ILE 7 HD13 ILE 7 -9.919 -15.709 8.631
51 H SER 8 H SER 8 -5.161 -15.400 5.275
52 HA SER 8 HA SER 8 -6.167 -14.575 2.655
53 HB2 SER 8 HB2 SER 8 -5.220 -12.843 3.988
54 HB3 SER 8 HB3 SER 8 -3.668 -13.697 4.165
55 HG SER 8 HG SER 8 -3.649 -12.145 2.334
56 H ASP 9 H ASP 9 -2.642 -15.522 3.169
57 HA ASP 9 HA ASP 9 -3.030 -17.942 1.616
58 HB2 ASP 9 HB2 ASP 9 -3.281 -16.182 -0.215
59 HB3 ASP 9 HB3 ASP 9 -1.709 -15.509 0.276
60 H TYR 10 H TYR 10 -1.967 -17.825 4.065
61 HA TYR 10 HA TYR 10 -0.040 -18.134 5.313
62 HB2 TYR 10 HB2 TYR 10 0.643 -19.580 2.709
63 HB3 TYR 10 HB3 TYR 10 1.627 -19.674 4.190
64 HD1 TYR 10 HD1 TYR 10 0.672 -20.639 6.283
65 HD2 TYR 10 HD2 TYR 10 -1.675 -20.543 2.677
66 HE1 TYR 10 HE1 TYR 10 -0.847 -22.325 7.235
67 HE2 TYR 10 HE2 TYR 10 -3.164 -22.289 3.610
68 HH TYR 10 HH TYR 10 -2.742 -23.720 6.853
69 H SER 11 H SER 11 2.180 -17.710 2.459
70 HA SER 11 HA SER 11 2.515 -14.870 3.242
71 HB2 SER 11 HB2 SER 11 4.752 -16.933 3.628
72 HB3 SER 11 HB3 SER 11 4.884 -15.157 3.875
73 HG SER 11 HG SER 11 4.412 -16.308 5.907
74 H ILE 12 H ILE 12 1.513 -15.706 0.826
75 HA ILE 12 HA ILE 12 3.861 -15.069 -0.951
76 HB ILE 12 HB ILE 12 1.643 -17.097 -1.543
77 HG12 ILE 12 HG12 ILE 12 4.662 -17.495 -1.124
78 HG13 ILE 12 HG13 ILE 12 3.388 -17.909 0.051
79 HG21 ILE 12 HG21 ILE 12 2.307 -15.682 -3.538
80 HG22 ILE 12 HG22 ILE 12 4.015 -16.133 -3.272
81 HG23 ILE 12 HG23 ILE 12 2.812 -17.368 -3.744
82 HD11 ILE 12 HD11 ILE 12 4.047 -19.948 -1.081
83 HD12 ILE 12 HD12 ILE 12 2.382 -19.541 -1.583
84 HD13 ILE 12 HD13 ILE 12 3.760 -19.252 -2.691
85 H ALA 13 H ALA 13 0.187 -15.291 -1.319
86 HA ALA 13 HA ALA 13 0.285 -12.471 -2.310
87 HB1 ALA 13 HB1 ALA 13 -1.075 -14.108 -3.607
88 HB2 ALA 13 HB2 ALA 13 -2.064 -14.450 -2.158
89 HB3 ALA 13 HB3 ALA 13 -2.081 -12.816 -2.883
90 H MET 14 H MET 14 1.203 -12.197 0.089
91 HA MET 14 HA MET 14 -0.971 -11.073 1.643
92 HB2 MET 14 HB2 MET 14 -1.273 -13.485 2.323
93 HB3 MET 14 HB3 MET 14 0.426 -13.567 2.802
94 HG2 MET 14 HG2 MET 14 -0.099 -11.547 4.421
95 HG3 MET 14 HG3 MET 14 -1.812 -11.882 4.090
96 HE1 MET 14 HE1 MET 14 1.199 -14.163 6.721
97 HE2 MET 14 HE2 MET 14 1.656 -13.337 5.202
98 HE3 MET 14 HE3 MET 14 0.954 -12.399 6.561
99 H ASP 15 H ASP 15 2.413 -12.495 2.202
100 HA ASP 15 HA ASP 15 3.151 -10.178 3.777
101 HB2 ASP 15 HB2 ASP 15 4.359 -12.331 4.046
102 HB3 ASP 15 HB3 ASP 15 4.894 -12.289 2.345
103 H LYS 16 H LYS 16 3.636 -11.254 0.314
104 HA LYS 16 HA LYS 16 5.207 -9.031 -0.478
105 HB2 LYS 16 HB2 LYS 16 3.058 -10.527 -2.117
106 HB3 LYS 16 HB3 LYS 16 4.247 -9.378 -2.786
107 HG2 LYS 16 HG2 LYS 16 6.128 -10.868 -2.060
108 HG3 LYS 16 HG3 LYS 16 4.968 -12.061 -1.422
109 HD2 LYS 16 HD2 LYS 16 3.935 -12.288 -3.721
110 HD3 LYS 16 HD3 LYS 16 5.150 -11.145 -4.356
111 HE2 LYS 16 HE2 LYS 16 6.986 -12.715 -3.660
112 HE3 LYS 16 HE3 LYS 16 5.773 -13.865 -3.029
113 HZ1 LYS 16 HZ1 LYS 16 5.981 -12.954 -5.918
114 HZ2 LYS 16 HZ2 LYS 16 4.832 -14.111 -5.289
115 HZ3 LYS 16 HZ3 LYS 16 6.533 -14.481 -5.300
116 H ILE 17 H ILE 17 1.605 -9.486 -0.206
117 HA ILE 17 HA ILE 17 1.038 -6.956 -1.480
118 HB ILE 17 HB ILE 17 -0.749 -8.569 0.435
119 HG12 ILE 17 HG12 ILE 17 -0.264 -10.043 -1.445
120 HG13 ILE 17 HG13 ILE 17 -1.917 -9.439 -1.565
121 HG21 ILE 17 HG21 ILE 17 -2.625 -7.260 -0.677
122 HG22 ILE 17 HG22 ILE 17 -1.523 -6.268 0.301
123 HG23 ILE 17 HG23 ILE 17 -1.395 -6.240 -1.477
124 HD11 ILE 17 HD11 ILE 17 -0.880 -9.461 -3.790
125 HD12 ILE 17 HD12 ILE 17 -1.131 -7.759 -3.332
126 HD13 ILE 17 HD13 ILE 17 0.502 -8.490 -3.236
127 H HIS 18 H HIS 18 1.059 -8.051 2.011
128 HA HIS 18 HA HIS 18 0.306 -5.550 3.061
129 HB2 HIS 18 HB2 HIS 18 2.201 -7.626 4.320
130 HB3 HIS 18 HB3 HIS 18 1.400 -6.293 5.194
131 HD1 HIS 18 HD1 HIS 18 0.815 -8.798 6.345
132 HD2 HIS 18 HD2 HIS 18 -1.349 -7.490 2.977
133 HE1 HIS 18 HE1 HIS 18 -1.358 -10.088 6.370
134 H GLN 19 H GLN 19 3.611 -6.899 2.333
135 HA GLN 19 HA GLN 19 5.151 -4.921 3.441
136 HB2 GLN 19 HB2 GLN 19 6.122 -6.914 2.383
137 HB3 GLN 19 HB3 GLN 19 5.658 -6.332 0.764
138 HG2 GLN 19 HG2 GLN 19 7.190 -4.341 1.054
139 HG3 GLN 19 HG3 GLN 19 7.582 -4.886 2.705
140 HE21 GLN 19 HE21 GLN 19 7.694 -5.992 -0.798
141 HE22 GLN 19 HE22 GLN 19 9.097 -6.971 -0.578
142 H GLN 20 H GLN 20 3.874 -4.816 -0.016
143 HA GLN 20 HA GLN 20 4.938 -2.130 -0.235
144 HB2 GLN 20 HB2 GLN 20 4.205 -2.069 -2.485
145 HB3 GLN 20 HB3 GLN 20 4.751 -3.725 -2.150
146 HG2 GLN 20 HG2 GLN 20 2.767 -3.951 -3.459
147 HG3 GLN 20 HG3 GLN 20 2.238 -4.347 -1.807
148 HE21 GLN 20 HE21 GLN 20 0.112 -3.851 -3.214
149 HE22 GLN 20 HE22 GLN 20 -0.427 -2.213 -3.153
150 H ASP 21 H ASP 21 1.662 -3.505 0.590
151 HA ASP 21 HA ASP 21 0.244 -1.131 0.099
152 HB2 ASP 21 HB2 ASP 21 -0.323 -3.232 2.267
153 HB3 ASP 21 HB3 ASP 21 -1.406 -1.883 1.835
154 H PHE 22 H PHE 22 1.595 -2.192 3.419
155 HA PHE 22 HA PHE 22 0.709 0.280 4.497
156 HB2 PHE 22 HB2 PHE 22 2.104 -0.121 6.484
157 HB3 PHE 22 HB3 PHE 22 1.078 -1.503 6.051
158 HD1 PHE 22 HD1 PHE 22 4.601 -0.174 5.806
159 HD2 PHE 22 HD2 PHE 22 2.084 -3.667 5.681
160 HE1 PHE 22 HE1 PHE 22 6.602 -1.626 5.876
161 HE2 PHE 22 HE2 PHE 22 4.084 -5.109 5.753
162 HZ PHE 22 HZ PHE 22 6.354 -4.094 5.775
163 H VAL 23 H VAL 23 3.857 -0.594 2.908
164 HA VAL 23 HA VAL 23 5.159 1.841 3.669
165 HB VAL 23 HB VAL 23 5.489 0.065 1.183
166 HG11 VAL 23 HG11 VAL 23 7.596 1.362 0.705
167 HG12 VAL 23 HG12 VAL 23 6.131 2.340 0.469
168 HG13 VAL 23 HG13 VAL 23 7.123 2.561 1.944
169 HG21 VAL 23 HG21 VAL 23 7.290 0.536 3.651
170 HG22 VAL 23 HG22 VAL 23 6.266 -0.900 3.387
171 HG23 VAL 23 HG23 VAL 23 7.636 -0.578 2.299
172 H ASN 24 H ASN 24 3.130 1.041 0.720
173 HA ASN 24 HA ASN 24 3.267 3.634 -0.353
174 HB2 ASN 24 HB2 ASN 24 2.318 1.778 -1.677
175 HB3 ASN 24 HB3 ASN 24 0.959 1.601 -0.545
176 HD21 ASN 24 HD21 ASN 24 2.543 4.125 -2.705
177 HD22 ASN 24 HD22 ASN 24 1.056 4.912 -3.084
178 H TRP 25 H TRP 25 0.693 2.233 1.868
179 HA TRP 25 HA TRP 25 -0.923 4.507 1.921
180 HB2 TRP 25 HB2 TRP 25 -1.690 2.445 3.052
181 HB3 TRP 25 HB3 TRP 25 -0.284 2.491 4.145
182 HD1 TRP 25 HD1 TRP 25 -2.805 5.383 3.388
183 HE1 TRP 25 HE1 TRP 25 -3.691 6.221 5.588
184 HE3 TRP 25 HE3 TRP 25 -0.455 2.041 6.601
185 HZ2 TRP 25 HZ2 TRP 25 -3.548 5.634 8.260
186 HZ3 TRP 25 HZ3 TRP 25 -0.883 2.324 9.048
187 HH2 TRP 25 HH2 TRP 25 -2.395 4.103 9.865
188 H LEU 26 H LEU 26 1.965 3.723 4.022
189 HA LEU 26 HA LEU 26 1.431 5.976 5.734
190 HB2 LEU 26 HB2 LEU 26 3.970 4.315 5.317
191 HB3 LEU 26 HB3 LEU 26 3.820 5.563 6.574
192 HG LEU 26 HG LEU 26 1.885 3.162 6.414
193 HD11 LEU 26 HD11 LEU 26 4.454 3.419 8.088
194 HD12 LEU 26 HD12 LEU 26 4.218 2.308 6.707
195 HD13 LEU 26 HD13 LEU 26 3.265 2.088 8.193
196 HD21 LEU 26 HD21 LEU 26 0.973 5.037 7.789
197 HD22 LEU 26 HD22 LEU 26 2.520 5.152 8.675
198 HD23 LEU 26 HD23 LEU 26 1.486 3.708 8.843
199 H LEU 27 H LEU 27 3.921 5.543 3.041
200 HA LEU 27 HA LEU 27 4.732 8.270 3.357
201 HB2 LEU 27 HB2 LEU 27 5.933 8.133 1.288
202 HB3 LEU 27 HB3 LEU 27 6.099 6.614 2.191
203 HG LEU 27 HG LEU 27 4.115 5.766 0.614
204 HD11 LEU 27 HD11 LEU 27 3.610 8.005 -0.519
205 HD12 LEU 27 HD12 LEU 27 4.129 6.767 -1.674
206 HD13 LEU 27 HD13 LEU 27 5.273 8.030 -1.143
207 HD21 LEU 27 HD21 LEU 27 5.788 4.987 -1.080
208 HD22 LEU 27 HD22 LEU 27 6.421 4.841 0.579
209 HD23 LEU 27 HD23 LEU 27 6.963 6.187 -0.463
210 H ALA 28 H ALA 28 1.964 6.744 1.582
211 HA ALA 28 HA ALA 28 1.336 9.127 0.099
212 HB1 ALA 28 HB1 ALA 28 0.372 6.903 -0.527
213 HB2 ALA 28 HB2 ALA 28 -0.557 6.873 1.003
214 HB3 ALA 28 HB3 ALA 28 -0.911 8.110 -0.233
215 H GLN 29 H GLN 29 0.541 8.001 3.475
216 HA GLN 29 HA GLN 29 -1.575 9.760 3.967
217 HB2 GLN 29 HB2 GLN 29 -0.762 8.047 5.608
218 HB3 GLN 29 HB3 GLN 29 0.695 9.027 5.922
219 HG2 GLN 29 HG2 GLN 29 -0.729 10.917 6.773
220 HG3 GLN 29 HG3 GLN 29 -2.197 9.959 6.455
221 HE21 GLN 29 HE21 GLN 29 -2.302 7.715 7.593
222 HE22 GLN 29 HE22 GLN 29 -1.591 7.605 9.162
223 H LYS 30 H LYS 30 2.036 10.405 4.082
224 HA LYS 30 HA LYS 30 1.543 13.242 4.616
225 HB2 LYS 30 HB2 LYS 30 3.602 12.149 5.334
226 HB3 LYS 30 HB3 LYS 30 4.100 11.821 3.658
227 HG2 LYS 30 HG2 LYS 30 3.498 14.701 4.580
228 HG3 LYS 30 HG3 LYS 30 5.060 13.932 4.950
229 HD2 LYS 30 HD2 LYS 30 5.624 13.641 2.608
230 HD3 LYS 30 HD3 LYS 30 4.019 14.163 2.061
231 HE2 LYS 30 HE2 LYS 30 5.677 15.955 1.754
232 HE3 LYS 30 HE3 LYS 30 4.386 16.456 2.875
233 HZ1 LYS 30 HZ1 LYS 30 5.896 16.169 4.773
234 HZ2 LYS 30 HZ2 LYS 30 6.695 17.117 3.582
235 HZ3 LYS 30 HZ3 LYS 30 7.113 15.438 3.747
236 H GLY 31 H GLY 31 2.399 11.174 1.714
237 HA2 GLY 31 HA2 GLY 31 2.819 13.110 -0.141
238 HA3 GLY 31 HA3 GLY 31 1.990 11.591 -0.543
239 H LYS 32 H LYS 32 -0.513 12.097 1.027
240 HA LYS 32 HA LYS 32 -1.801 13.567 -1.070
241 HB2 LYS 32 HB2 LYS 32 -3.878 13.294 0.052
242 HB3 LYS 32 HB3 LYS 32 -2.948 11.790 0.305
243 HG2 LYS 32 HG2 LYS 32 -2.221 12.850 2.586
244 HG3 LYS 32 HG3 LYS 32 -3.482 14.080 2.309
245 HD2 LYS 32 HD2 LYS 32 -3.910 11.024 2.524
246 HD3 LYS 32 HD3 LYS 32 -4.221 12.218 3.810
247 HE2 LYS 32 HE2 LYS 32 -5.940 13.348 2.324
248 HE3 LYS 32 HE3 LYS 32 -5.701 12.061 1.108
249 HZ1 LYS 32 HZ1 LYS 32 -6.661 11.637 3.959
250 HZ2 LYS 32 HZ2 LYS 32 -6.395 10.377 2.779
251 HZ3 LYS 32 HZ3 LYS 32 -7.637 11.569 2.523
252 H LYS 33 H LYS 33 -0.467 14.560 2.191
253 HA LYS 33 HA LYS 33 -1.698 17.157 2.060
254 HB2 LYS 33 HB2 LYS 33 0.909 16.306 3.452
255 HB3 LYS 33 HB3 LYS 33 0.341 17.986 3.359
256 HG2 LYS 33 HG2 LYS 33 -0.325 17.079 5.504
257 HG3 LYS 33 HG3 LYS 33 -1.770 17.426 4.519
258 HD2 LYS 33 HD2 LYS 33 -2.025 14.994 4.024
259 HD3 LYS 33 HD3 LYS 33 -0.474 14.648 4.839
260 HE2 LYS 33 HE2 LYS 33 -2.318 14.005 6.299
261 HE3 LYS 33 HE3 LYS 33 -1.471 15.395 7.025
262 HZ1 LYS 33 HZ1 LYS 33 -4.048 15.554 5.415
263 HZ2 LYS 33 HZ2 LYS 33 -3.293 16.884 6.267
264 HZ3 LYS 33 HZ3 LYS 33 -3.958 15.557 7.146
265 H ASN 34 H ASN 34 1.518 15.803 0.934
266 HA ASN 34 HA ASN 34 2.393 18.199 -0.239
267 HB2 ASN 34 HB2 ASN 34 3.840 16.134 0.015
268 HB3 ASN 34 HB3 ASN 34 2.915 15.347 -1.287
269 HD21 ASN 34 HD21 ASN 34 4.924 18.348 -0.614
270 HD22 ASN 34 HD22 ASN 34 5.520 18.456 -2.229
271 H ASP 35 H ASP 35 -0.038 15.819 -1.527
272 HA ASP 35 HA ASP 35 -0.293 17.608 -3.927
273 HB2 ASP 35 HB2 ASP 35 1.081 15.549 -4.417
274 HB3 ASP 35 HB3 ASP 35 -0.273 14.535 -3.856
275 H TRP 36 H TRP 36 -1.881 17.818 -1.522
276 HA TRP 36 HA TRP 36 -4.362 17.719 -3.034
277 HB2 TRP 36 HB2 TRP 36 -4.123 15.415 -1.775
278 HB3 TRP 36 HB3 TRP 36 -4.707 16.291 -0.358
279 HD1 TRP 36 HD1 TRP 36 -5.960 14.292 -3.035
280 HE1 TRP 36 HE1 TRP 36 -8.375 14.698 -3.579
281 HE3 TRP 36 HE3 TRP 36 -6.701 18.858 -0.600
282 HZ2 TRP 36 HZ2 TRP 36 -10.328 16.535 -3.156
283 HZ3 TRP 36 HZ3 TRP 36 -8.964 19.851 -0.751
284 HH2 TRP 36 HH2 TRP 36 -10.758 18.725 -2.023
285 H LYS 37 H LYS 37 -3.390 18.029 0.525
286 HA LYS 37 HA LYS 37 -5.042 20.368 0.854
287 HB2 LYS 37 HB2 LYS 37 -2.599 19.375 2.455
288 HB3 LYS 37 HB3 LYS 37 -3.340 20.962 2.724
289 HG2 LYS 37 HG2 LYS 37 -4.121 19.480 4.386
290 HG3 LYS 37 HG3 LYS 37 -5.493 19.980 3.388
291 HD2 LYS 37 HD2 LYS 37 -4.022 17.282 3.032
292 HD3 LYS 37 HD3 LYS 37 -5.314 17.492 4.235
293 HE2 LYS 37 HE2 LYS 37 -5.725 17.807 1.230
294 HE3 LYS 37 HE3 LYS 37 -6.151 16.397 2.206
295 HZ1 LYS 37 HZ1 LYS 37 -7.690 17.913 3.528
296 HZ2 LYS 37 HZ2 LYS 37 -8.131 17.680 1.862
297 HZ3 LYS 37 HZ3 LYS 37 -7.411 19.161 2.331
298 H HIS 38 H HIS 38 -1.464 19.850 0.264
299 HA HIS 38 HA HIS 38 -0.897 22.619 -0.077
300 HB2 HIS 38 HB2 HIS 38 0.870 20.899 0.266
301 HB3 HIS 38 HB3 HIS 38 0.506 20.174 -1.323
302 HD1 HIS 38 HD1 HIS 38 1.173 21.548 -3.409
303 HD2 HIS 38 HD2 HIS 38 2.239 23.265 0.277
304 HE1 HIS 38 HE1 HIS 38 2.828 23.384 -3.959
305 H ASN 39 H ASN 39 -1.978 20.059 -2.483
306 HA ASN 39 HA ASN 39 -1.639 21.734 -4.725
307 HB2 ASN 39 HB2 ASN 39 -2.153 19.264 -4.904
308 HB3 ASN 39 HB3 ASN 39 -3.821 19.616 -4.379
309 HD21 ASN 39 HD21 ASN 39 -1.374 20.710 -6.919
310 HD22 ASN 39 HD22 ASN 39 -2.566 20.926 -8.144
311 H ILE 40 H ILE 40 -4.084 22.034 -2.117
312 HA ILE 40 HA ILE 40 -6.069 23.365 -3.658
313 HB ILE 40 HB ILE 40 -5.213 23.987 -0.776
314 HG12 ILE 40 HG12 ILE 40 -7.692 22.446 -1.774
315 HG13 ILE 40 HG13 ILE 40 -6.205 21.657 -1.219
316 HG21 ILE 40 HG21 ILE 40 -7.693 24.964 -2.316
317 HG22 ILE 40 HG22 ILE 40 -7.342 25.290 -0.594
318 HG23 ILE 40 HG23 ILE 40 -6.308 25.986 -1.843
319 HD11 ILE 40 HD11 ILE 40 -8.048 23.376 0.534
320 HD12 ILE 40 HD12 ILE 40 -7.729 21.632 0.651
321 HD13 ILE 40 HD13 ILE 40 -6.432 22.793 1.038
322 H THR 41 H THR 41 -3.194 24.747 -1.802
323 HA THR 41 HA THR 41 -3.553 27.288 -3.063
324 HB THR 41 HB THR 41 -2.337 27.193 -0.936
325 HG1 THR 41 HG1 THR 41 -1.815 28.935 -2.465
326 HG21 THR 41 HG21 THR 41 -0.082 25.743 -2.469
327 HG22 THR 41 HG22 THR 41 -0.982 25.126 -1.044
328 HG23 THR 41 HG23 THR 41 0.090 26.525 -0.879
329 H GLN 42 H GLN 42 -1.606 24.355 -3.955
330 HA GLN 42 HA GLN 42 -0.742 25.816 -6.449
331 HB2 GLN 42 HB2 GLN 42 1.079 24.837 -5.112
332 HB3 GLN 42 HB3 GLN 42 0.286 23.240 -5.138
333 HG2 GLN 42 HG2 GLN 42 0.476 23.147 -7.638
334 HG3 GLN 42 HG3 GLN 42 1.260 24.747 -7.647
335 HE21 GLN 42 HE21 GLN 42 3.399 24.938 -6.325
336 HE22 GLN 42 HE22 GLN 42 4.394 23.529 -6.276
Start of MODEL 3
1 H1 TYR 1 H1 TYR 1 -2.049 -21.987 8.464
2 HA TYR 1 HA TYR 1 -2.072 -23.350 6.425
3 HB2 TYR 1 HB2 TYR 1 -4.952 -23.255 7.553
4 HB3 TYR 1 HB3 TYR 1 -4.211 -24.626 6.699
5 HD1 TYR 1 HD1 TYR 1 -2.190 -25.801 7.769
6 HD2 TYR 1 HD2 TYR 1 -4.578 -22.952 9.940
7 HE1 TYR 1 HE1 TYR 1 -1.304 -26.683 9.895
8 HE2 TYR 1 HE2 TYR 1 -3.695 -23.843 12.070
9 HH TYR 1 HH TYR 1 -1.395 -26.563 12.279
10 H ALA 2 H ALA 2 -3.437 -23.845 4.335
11 HA ALA 2 HA ALA 2 -4.009 -21.478 2.886
12 HB1 ALA 2 HB1 ALA 2 -5.261 -24.271 2.483
13 HB2 ALA 2 HB2 ALA 2 -5.327 -22.914 1.317
14 HB3 ALA 2 HB3 ALA 2 -3.755 -23.668 1.725
15 H GLU 3 H GLU 3 -6.189 -23.725 4.801
16 HA GLU 3 HA GLU 3 -8.587 -22.375 4.335
17 HB2 GLU 3 HB2 GLU 3 -8.468 -24.521 5.584
18 HB3 GLU 3 HB3 GLU 3 -7.676 -23.695 6.956
19 HG2 GLU 3 HG2 GLU 3 -9.748 -22.304 7.321
20 HG3 GLU 3 HG3 GLU 3 -10.515 -23.068 5.902
21 H GLY 4 H GLY 4 -9.596 -20.454 5.378
22 HA2 GLY 4 HA2 GLY 4 -9.688 -18.626 6.829
23 HA3 GLY 4 HA3 GLY 4 -8.241 -19.221 7.661
24 H THR 5 H THR 5 -6.092 -19.083 6.199
25 HA THR 5 HA THR 5 -5.726 -16.342 5.778
26 HB THR 5 HB THR 5 -3.639 -16.777 4.579
27 HG1 THR 5 HG1 THR 5 -4.374 -19.539 4.518
28 HG21 THR 5 HG21 THR 5 -3.567 -16.945 7.061
29 HG22 THR 5 HG22 THR 5 -2.385 -18.037 6.281
30 HG23 THR 5 HG23 THR 5 -3.884 -18.702 6.977
31 H PHE 6 H PHE 6 -6.821 -18.861 3.355
32 HA PHE 6 HA PHE 6 -6.246 -17.352 1.085
33 HB2 PHE 6 HB2 PHE 6 -7.919 -18.510 -0.152
34 HB3 PHE 6 HB3 PHE 6 -7.273 -19.683 1.013
35 HD1 PHE 6 HD2 PHE 6 -10.144 -17.447 0.121
36 HD2 PHE 6 HD1 PHE 6 -8.802 -20.516 2.813
37 HE1 PHE 6 HE2 PHE 6 -12.481 -17.883 0.789
38 HE2 PHE 6 HE1 PHE 6 -11.151 -20.974 3.459
39 HZ PHE 6 HZ PHE 6 -12.994 -19.647 2.461
40 H ILE 7 H ILE 7 -8.960 -16.954 3.461
41 HA ILE 7 HA ILE 7 -10.359 -14.996 1.904
42 HB ILE 7 HB ILE 7 -10.252 -15.323 4.956
43 HG12 ILE 7 HG12 ILE 7 -12.373 -16.146 2.858
44 HG13 ILE 7 HG13 ILE 7 -11.252 -17.252 3.689
45 HG21 ILE 7 HG21 ILE 7 -10.832 -12.954 4.333
46 HG22 ILE 7 HG22 ILE 7 -12.130 -13.561 3.266
47 HG23 ILE 7 HG23 ILE 7 -12.222 -13.782 5.037
48 HD11 ILE 7 HD11 ILE 7 -13.386 -17.462 4.777
49 HD12 ILE 7 HD12 ILE 7 -12.296 -16.615 5.912
50 HD13 ILE 7 HD13 ILE 7 -13.554 -15.709 5.011
51 H SER 8 H SER 8 -7.725 -14.726 4.459
52 HA SER 8 HA SER 8 -7.339 -11.901 3.842
53 HB2 SER 8 HB2 SER 8 -6.602 -12.599 6.028
54 HB3 SER 8 HB3 SER 8 -5.577 -13.884 5.362
55 HG SER 8 HG SER 8 -5.111 -11.090 4.899
56 H ASP 9 H ASP 9 -4.342 -13.902 3.373
57 HA ASP 9 HA ASP 9 -4.761 -14.053 0.509
58 HB2 ASP 9 HB2 ASP 9 -4.472 -11.563 0.745
59 HB3 ASP 9 HB3 ASP 9 -2.959 -11.824 1.622
60 H TYR 10 H TYR 10 -4.218 -16.171 1.918
61 HA TYR 10 HA TYR 10 -2.726 -17.908 2.150
62 HB2 TYR 10 HB2 TYR 10 -1.596 -16.560 -0.337
63 HB3 TYR 10 HB3 TYR 10 -1.173 -18.194 0.230
64 HD1 TYR 10 HD1 TYR 10 -2.921 -19.984 0.340
65 HD2 TYR 10 HD2 TYR 10 -3.875 -16.083 -1.211
66 HE1 TYR 10 HE1 TYR 10 -4.975 -20.893 -0.695
67 HE2 TYR 10 HE2 TYR 10 -5.919 -16.993 -2.246
68 HH TYR 10 HH TYR 10 -7.119 -18.990 -2.815
69 H SER 11 H SER 11 0.285 -16.272 1.135
70 HA SER 11 HA SER 11 0.979 -15.763 3.943
71 HB2 SER 11 HB2 SER 11 2.060 -18.254 2.501
72 HB3 SER 11 HB3 SER 11 2.767 -17.541 3.988
73 HG SER 11 HG SER 11 1.164 -19.237 4.461
74 H ILE 12 H ILE 12 2.773 -16.717 0.851
75 HA ILE 12 HA ILE 12 4.658 -14.540 1.356
76 HB ILE 12 HB ILE 12 4.099 -16.042 -1.261
77 HG12 ILE 12 HG12 ILE 12 4.894 -17.672 0.417
78 HG13 ILE 12 HG13 ILE 12 6.116 -17.382 -0.830
79 HG21 ILE 12 HG21 ILE 12 5.162 -13.891 -1.726
80 HG22 ILE 12 HG22 ILE 12 6.389 -14.135 -0.466
81 HG23 ILE 12 HG23 ILE 12 6.390 -15.159 -1.932
82 HD11 ILE 12 HD11 ILE 12 6.172 -16.228 2.038
83 HD12 ILE 12 HD12 ILE 12 7.165 -17.556 1.398
84 HD13 ILE 12 HD13 ILE 12 7.404 -15.907 0.779
85 H ALA 13 H ALA 13 1.662 -15.103 -0.679
86 HA ALA 13 HA ALA 13 1.669 -12.542 -1.823
87 HB1 ALA 13 HB1 ALA 13 -0.725 -12.821 -2.231
88 HB2 ALA 13 HB2 ALA 13 0.162 -14.320 -2.605
89 HB3 ALA 13 HB3 ALA 13 -0.780 -14.209 -1.096
90 H MET 14 H MET 14 0.314 -13.616 1.469
91 HA MET 14 HA MET 14 -0.688 -11.090 2.193
92 HB2 MET 14 HB2 MET 14 0.897 -12.978 4.062
93 HB3 MET 14 HB3 MET 14 0.055 -11.502 4.566
94 HG2 MET 14 HG2 MET 14 -2.126 -12.540 3.670
95 HG3 MET 14 HG3 MET 14 -1.246 -14.097 3.571
96 HE1 MET 14 HE1 MET 14 -0.542 -14.713 7.462
97 HE2 MET 14 HE2 MET 14 -0.633 -15.519 5.870
98 HE3 MET 14 HE3 MET 14 0.591 -14.234 6.160
99 H ASP 15 H ASP 15 2.757 -12.342 2.454
100 HA ASP 15 HA ASP 15 3.677 -10.019 3.732
101 HB2 ASP 15 HB2 ASP 15 5.059 -12.061 3.638
102 HB3 ASP 15 HB3 ASP 15 5.293 -11.873 1.885
103 H LYS 16 H LYS 16 3.968 -10.768 0.113
104 HA LYS 16 HA LYS 16 5.218 -8.242 -0.274
105 HB2 LYS 16 HB2 LYS 16 5.178 -8.599 -2.622
106 HB3 LYS 16 HB3 LYS 16 5.422 -10.189 -1.859
107 HG2 LYS 16 HG2 LYS 16 2.885 -10.585 -2.173
108 HG3 LYS 16 HG3 LYS 16 2.808 -9.031 -3.033
109 HD2 LYS 16 HD2 LYS 16 2.871 -10.675 -4.739
110 HD3 LYS 16 HD3 LYS 16 4.504 -9.954 -4.721
111 HE2 LYS 16 HE2 LYS 16 5.343 -11.973 -3.435
112 HE3 LYS 16 HE3 LYS 16 3.679 -12.621 -3.384
113 HZ1 LYS 16 HZ1 LYS 16 3.690 -12.752 -5.858
114 HZ2 LYS 16 HZ2 LYS 16 4.981 -13.678 -5.159
115 HZ3 LYS 16 HZ3 LYS 16 5.323 -12.134 -5.888
116 H ILE 17 H ILE 17 1.715 -9.245 -0.466
117 HA ILE 17 HA ILE 17 0.998 -6.753 -1.796
118 HB ILE 17 HB ILE 17 -0.745 -8.799 -0.333
119 HG12 ILE 17 HG12 ILE 17 0.325 -9.751 -2.393
120 HG13 ILE 17 HG13 ILE 17 -1.439 -9.621 -2.523
121 HG21 ILE 17 HG21 ILE 17 -1.561 -6.324 -1.964
122 HG22 ILE 17 HG22 ILE 17 -2.678 -7.660 -1.554
123 HG23 ILE 17 HG23 ILE 17 -1.939 -6.687 -0.263
124 HD11 ILE 17 HD11 ILE 17 0.586 -7.729 -3.880
125 HD12 ILE 17 HD12 ILE 17 -0.375 -9.009 -4.647
126 HD13 ILE 17 HD13 ILE 17 -1.193 -7.578 -3.980
127 H HIS 18 H HIS 18 0.850 -7.985 1.652
128 HA HIS 18 HA HIS 18 -0.396 -5.587 2.596
129 HB2 HIS 18 HB2 HIS 18 1.511 -7.445 4.131
130 HB3 HIS 18 HB3 HIS 18 0.428 -6.220 4.844
131 HD1 HIS 18 HD1 HIS 18 -0.088 -8.755 5.951
132 HD2 HIS 18 HD2 HIS 18 -1.762 -7.717 2.232
133 HE1 HIS 18 HE1 HIS 18 -2.101 -10.257 5.649
134 H GLN 19 H GLN 19 3.126 -6.581 2.345
135 HA GLN 19 HA GLN 19 4.242 -4.173 3.236
136 HB2 GLN 19 HB2 GLN 19 5.712 -5.998 2.765
137 HB3 GLN 19 HB3 GLN 19 5.187 -6.136 1.075
138 HG2 GLN 19 HG2 GLN 19 6.604 -3.641 2.170
139 HG3 GLN 19 HG3 GLN 19 7.479 -5.014 1.450
140 HE21 GLN 19 HE21 GLN 19 7.139 -2.078 0.398
141 HE22 GLN 19 HE22 GLN 19 6.607 -2.348 -1.217
142 H GLN 20 H GLN 20 3.160 -4.923 -0.193
143 HA GLN 20 HA GLN 20 3.839 -2.374 -1.221
144 HB2 GLN 20 HB2 GLN 20 1.486 -4.218 -1.942
145 HB3 GLN 20 HB3 GLN 20 1.823 -2.713 -2.819
146 HG2 GLN 20 HG2 GLN 20 3.886 -3.530 -3.731
147 HG3 GLN 20 HG3 GLN 20 4.044 -4.798 -2.507
148 HE21 GLN 20 HE21 GLN 20 1.551 -3.849 -5.059
149 HE22 GLN 20 HE22 GLN 20 1.317 -5.478 -5.576
150 H ASP 21 H ASP 21 0.795 -3.487 0.476
151 HA ASP 21 HA ASP 21 -0.545 -1.028 -0.058
152 HB2 ASP 21 HB2 ASP 21 -1.169 -3.084 2.135
153 HB3 ASP 21 HB3 ASP 21 -2.245 -1.781 1.566
154 H PHE 22 H PHE 22 0.889 -2.203 3.170
155 HA PHE 22 HA PHE 22 0.227 0.366 4.267
156 HB2 PHE 22 HB2 PHE 22 1.421 -0.256 6.305
157 HB3 PHE 22 HB3 PHE 22 0.249 -1.481 5.786
158 HD1 PHE 22 HD1 PHE 22 3.932 -0.642 5.745
159 HD2 PHE 22 HD2 PHE 22 0.985 -3.758 5.414
160 HE1 PHE 22 HE1 PHE 22 5.697 -2.344 6.047
161 HE2 PHE 22 HE2 PHE 22 2.761 -5.459 5.690
162 HZ PHE 22 HZ PHE 22 5.112 -4.758 6.052
163 H VAL 23 H VAL 23 3.337 -0.907 2.804
164 HA VAL 23 HA VAL 23 4.834 1.331 3.818
165 HB VAL 23 HB VAL 23 5.325 -0.361 1.308
166 HG11 VAL 23 HG11 VAL 23 6.340 1.839 0.899
167 HG12 VAL 23 HG12 VAL 23 7.083 1.848 2.528
168 HG13 VAL 23 HG13 VAL 23 7.626 0.679 1.289
169 HG21 VAL 23 HG21 VAL 23 7.217 -1.283 2.756
170 HG22 VAL 23 HG22 VAL 23 6.639 -0.295 4.117
171 HG23 VAL 23 HG23 VAL 23 5.614 -1.603 3.464
172 H ASN 24 H ASN 24 3.095 0.840 0.612
173 HA ASN 24 HA ASN 24 3.734 3.421 -0.320
174 HB2 ASN 24 HB2 ASN 24 2.707 1.719 -1.814
175 HB3 ASN 24 HB3 ASN 24 1.184 1.793 -0.894
176 HD21 ASN 24 HD21 ASN 24 3.508 3.998 -2.727
177 HD22 ASN 24 HD22 ASN 24 2.254 5.017 -3.330
178 H TRP 25 H TRP 25 0.813 2.315 1.615
179 HA TRP 25 HA TRP 25 -0.427 4.870 1.589
180 HB2 TRP 25 HB2 TRP 25 -1.726 2.942 2.382
181 HB3 TRP 25 HB3 TRP 25 -0.553 2.626 3.684
182 HD1 TRP 25 HD1 TRP 25 -2.726 5.711 2.634
183 HE1 TRP 25 HE1 TRP 25 -3.623 6.787 4.733
184 HE3 TRP 25 HE3 TRP 25 -0.558 2.621 6.199
185 HZ2 TRP 25 HZ2 TRP 25 -3.556 6.454 7.443
186 HZ3 TRP 25 HZ3 TRP 25 -1.024 3.149 8.599
187 HH2 TRP 25 HH2 TRP 25 -2.526 5.015 9.212
188 H LEU 26 H LEU 26 1.904 3.428 4.025
189 HA LEU 26 HA LEU 26 1.667 5.568 5.843
190 HB2 LEU 26 HB2 LEU 26 4.064 3.761 5.255
191 HB3 LEU 26 HB3 LEU 26 4.080 4.947 6.576
192 HG LEU 26 HG LEU 26 1.931 2.755 6.423
193 HD11 LEU 26 HD11 LEU 26 4.613 2.663 7.935
194 HD12 LEU 26 HD12 LEU 26 4.206 1.682 6.500
195 HD13 LEU 26 HD13 LEU 26 3.314 1.434 8.022
196 HD21 LEU 26 HD21 LEU 26 1.345 4.647 7.955
197 HD22 LEU 26 HD22 LEU 26 2.929 4.492 8.760
198 HD23 LEU 26 HD23 LEU 26 1.724 3.181 8.878
199 H LEU 27 H LEU 27 4.198 5.145 3.200
200 HA LEU 27 HA LEU 27 5.248 7.740 3.763
201 HB2 LEU 27 HB2 LEU 27 6.590 7.596 1.766
202 HB3 LEU 27 HB3 LEU 27 6.551 6.044 2.627
203 HG LEU 27 HG LEU 27 4.634 5.425 0.869
204 HD11 LEU 27 HD11 LEU 27 4.886 6.483 -1.357
205 HD12 LEU 27 HD12 LEU 27 6.149 7.581 -0.736
206 HD13 LEU 27 HD13 LEU 27 4.466 7.755 -0.192
207 HD21 LEU 27 HD21 LEU 27 7.590 5.599 0.034
208 HD22 LEU 27 HD22 LEU 27 6.361 4.526 -0.699
209 HD23 LEU 27 HD23 LEU 27 6.851 4.290 0.997
210 H ALA 28 H ALA 28 2.454 6.690 1.729
211 HA ALA 28 HA ALA 28 2.119 9.543 0.862
212 HB1 ALA 28 HB1 ALA 28 1.968 7.723 -0.875
213 HB2 ALA 28 HB2 ALA 28 0.584 7.024 0.017
214 HB3 ALA 28 HB3 ALA 28 0.451 8.654 -0.704
215 H GLN 29 H GLN 29 1.763 8.806 3.770
216 HA GLN 29 HA GLN 29 -1.188 8.836 4.053
217 HB2 GLN 29 HB2 GLN 29 0.197 7.556 5.649
218 HB3 GLN 29 HB3 GLN 29 1.007 9.040 6.201
219 HG2 GLN 29 HG2 GLN 29 -1.322 9.986 6.788
220 HG3 GLN 29 HG3 GLN 29 -1.986 8.363 6.483
221 HE21 GLN 29 HE21 GLN 29 -0.295 6.549 7.717
222 HE22 GLN 29 HE22 GLN 29 -0.086 6.953 9.377
223 H LYS 30 H LYS 30 1.685 10.971 4.989
224 HA LYS 30 HA LYS 30 -0.098 13.256 5.195
225 HB2 LYS 30 HB2 LYS 30 2.029 13.097 6.534
226 HB3 LYS 30 HB3 LYS 30 2.972 13.127 5.023
227 HG2 LYS 30 HG2 LYS 30 3.029 15.351 6.014
228 HG3 LYS 30 HG3 LYS 30 2.073 15.428 4.512
229 HD2 LYS 30 HD2 LYS 30 -0.048 15.470 5.848
230 HD3 LYS 30 HD3 LYS 30 0.868 15.173 7.347
231 HE2 LYS 30 HE2 LYS 30 0.206 17.519 7.212
232 HE3 LYS 30 HE3 LYS 30 1.978 17.419 7.089
233 HZ1 LYS 30 HZ1 LYS 30 1.859 17.819 4.690
234 HZ2 LYS 30 HZ2 LYS 30 0.898 19.016 5.472
235 HZ3 LYS 30 HZ3 LYS 30 0.111 17.677 4.698
236 H GLY 31 H GLY 31 2.257 11.876 2.737
237 HA2 GLY 31 HA2 GLY 31 2.397 13.979 0.983
238 HA3 GLY 31 HA3 GLY 31 2.331 12.283 0.440
239 H LYS 32 H LYS 32 -0.295 11.450 1.015
240 HA LYS 32 HA LYS 32 -1.602 12.701 -1.186
241 HB2 LYS 32 HB2 LYS 32 -3.571 11.398 -0.759
242 HB3 LYS 32 HB3 LYS 32 -2.136 10.370 -0.490
243 HG2 LYS 32 HG2 LYS 32 -2.422 10.744 2.014
244 HG3 LYS 32 HG3 LYS 32 -3.906 11.682 1.681
245 HD2 LYS 32 HD2 LYS 32 -4.947 9.676 0.624
246 HD3 LYS 32 HD3 LYS 32 -3.462 8.726 0.925
247 HE2 LYS 32 HE2 LYS 32 -3.731 9.038 3.390
248 HE3 LYS 32 HE3 LYS 32 -5.181 10.043 3.127
249 HZ1 LYS 32 HZ1 LYS 32 -6.330 8.114 2.101
250 HZ2 LYS 32 HZ2 LYS 32 -5.790 7.733 3.706
251 HZ3 LYS 32 HZ3 LYS 32 -4.914 7.122 2.328
252 H LYS 33 H LYS 33 -1.993 13.206 2.441
253 HA LYS 33 HA LYS 33 -4.241 14.872 2.231
254 HB2 LYS 33 HB2 LYS 33 -3.460 14.202 4.419
255 HB3 LYS 33 HB3 LYS 33 -1.896 15.025 4.200
256 HG2 LYS 33 HG2 LYS 33 -2.954 17.241 4.173
257 HG3 LYS 33 HG3 LYS 33 -4.587 16.520 4.234
258 HD2 LYS 33 HD2 LYS 33 -4.107 15.528 6.459
259 HD3 LYS 33 HD3 LYS 33 -2.457 16.212 6.451
260 HE2 LYS 33 HE2 LYS 33 -4.997 17.954 6.267
261 HE3 LYS 33 HE3 LYS 33 -4.250 17.489 7.816
262 HZ1 LYS 33 HZ1 LYS 33 -3.510 19.711 7.104
263 HZ2 LYS 33 HZ2 LYS 33 -2.807 19.067 5.655
264 HZ3 LYS 33 HZ3 LYS 33 -2.174 18.610 7.204
265 H ASN 34 H ASN 34 -0.691 15.776 2.069
266 HA ASN 34 HA ASN 34 -1.218 18.528 1.620
267 HB2 ASN 34 HB2 ASN 34 1.070 17.611 2.217
268 HB3 ASN 34 HB3 ASN 34 1.181 16.865 0.606
269 HD21 ASN 34 HD21 ASN 34 0.669 20.110 2.260
270 HD22 ASN 34 HD22 ASN 34 1.426 21.016 1.002
271 H ASP 35 H ASP 35 -0.885 15.728 -0.720
272 HA ASP 35 HA ASP 35 -1.473 17.674 -2.951
273 HB2 ASP 35 HB2 ASP 35 0.793 16.592 -2.951
274 HB3 ASP 35 HB3 ASP 35 0.013 14.990 -2.979
275 H TRP 36 H TRP 36 -3.669 16.798 -1.398
276 HA TRP 36 HA TRP 36 -5.195 15.763 -3.568
277 HB2 TRP 36 HB2 TRP 36 -4.122 13.547 -2.678
278 HB3 TRP 36 HB3 TRP 36 -5.188 13.699 -1.269
279 HD1 TRP 36 HD1 TRP 36 -5.190 12.592 -4.847
280 HE1 TRP 36 HE1 TRP 36 -7.510 11.958 -5.586
281 HE3 TRP 36 HE3 TRP 36 -7.914 14.359 -0.793
282 HZ2 TRP 36 HZ2 TRP 36 -10.105 12.203 -4.760
283 HZ3 TRP 36 HZ3 TRP 36 -10.401 14.172 -0.920
284 HH2 TRP 36 HH2 TRP 36 -11.483 13.100 -2.872
285 H LYS 37 H LYS 37 -5.254 15.684 0.119
286 HA LYS 37 HA LYS 37 -7.950 16.951 -0.002
287 HB2 LYS 37 HB2 LYS 37 -7.348 15.016 1.592
288 HB3 LYS 37 HB3 LYS 37 -6.382 16.180 2.515
289 HG2 LYS 37 HG2 LYS 37 -9.416 16.320 1.918
290 HG3 LYS 37 HG3 LYS 37 -8.657 15.893 3.471
291 HD2 LYS 37 HD2 LYS 37 -7.684 18.225 3.621
292 HD3 LYS 37 HD3 LYS 37 -8.547 18.663 2.115
293 HE2 LYS 37 HE2 LYS 37 -10.742 18.138 3.199
294 HE3 LYS 37 HE3 LYS 37 -9.894 17.718 4.714
295 HZ1 LYS 37 HZ1 LYS 37 -10.756 20.004 4.813
296 HZ2 LYS 37 HZ2 LYS 37 -9.892 20.439 3.369
297 HZ3 LYS 37 HZ3 LYS 37 -9.016 20.032 4.829
298 H HIS 38 H HIS 38 -6.847 18.825 -1.197
299 HA HIS 38 HA HIS 38 -5.779 20.752 0.847
300 HB2 HIS 38 HB2 HIS 38 -3.946 19.553 -0.455
301 HB3 HIS 38 HB3 HIS 38 -4.597 20.250 -1.957
302 HD1 HIS 38 HD1 HIS 38 -4.764 23.036 -1.764
303 HD2 HIS 38 HD2 HIS 38 -2.052 20.988 0.712
304 HE1 HIS 38 HE1 HIS 38 -3.079 24.763 -1.023
305 H ASN 39 H ASN 39 -8.476 20.505 0.145
306 HA ASN 39 HA ASN 39 -8.962 22.432 -2.032
307 HB2 ASN 39 HB2 ASN 39 -11.340 22.284 -1.384
308 HB3 ASN 39 HB3 ASN 39 -10.622 20.700 -1.792
309 HD21 ASN 39 HD21 ASN 39 -13.071 20.779 -0.382
310 HD22 ASN 39 HD22 ASN 39 -12.772 20.211 1.220
311 H ILE 40 H ILE 40 -9.406 22.340 1.621
312 HA ILE 40 HA ILE 40 -9.929 25.147 1.715
313 HB ILE 40 HB ILE 40 -10.457 23.482 3.570
314 HG12 ILE 40 HG12 ILE 40 -8.861 25.945 4.516
315 HG13 ILE 40 HG13 ILE 40 -10.528 25.988 3.886
316 HG21 ILE 40 HG21 ILE 40 -8.737 22.756 5.165
317 HG22 ILE 40 HG22 ILE 40 -8.083 22.382 3.563
318 HG23 ILE 40 HG23 ILE 40 -7.509 23.819 4.433
319 HD11 ILE 40 HD11 ILE 40 -9.628 24.538 6.456
320 HD12 ILE 40 HD12 ILE 40 -10.579 26.035 6.336
321 HD13 ILE 40 HD13 ILE 40 -11.281 24.495 5.768
322 H THR 41 H THR 41 -8.346 26.938 2.306
323 HA THR 41 HA THR 41 -5.794 26.603 1.179
324 HB THR 41 HB THR 41 -6.691 28.839 1.613
325 HG1 THR 41 HG1 THR 41 -4.551 29.633 2.288
326 HG21 THR 41 HG21 THR 41 -6.591 29.927 3.817
327 HG22 THR 41 HG22 THR 41 -5.916 28.474 4.585
328 HG23 THR 41 HG23 THR 41 -7.607 28.476 4.002
329 H GLN 42 H GLN 42 -3.953 25.388 1.986
330 HA GLN 42 HA GLN 42 -4.491 24.017 4.547
331 HB2 GLN 42 HB2 GLN 42 -3.687 22.824 2.442
332 HB3 GLN 42 HB3 GLN 42 -2.122 23.656 2.647
333 HG2 GLN 42 HG2 GLN 42 -1.941 21.415 3.659
334 HG3 GLN 42 HG3 GLN 42 -1.933 22.610 4.976
335 HE21 GLN 42 HE21 GLN 42 -4.213 20.438 3.065
336 HE22 GLN 42 HE22 GLN 42 -5.260 20.141 4.400
Start of MODEL 4
1 H1 TYR 1 H1 TYR 1 -5.128 -6.687 9.352
2 HA TYR 1 HA TYR 1 -3.731 -6.302 6.764
3 HB2 TYR 1 HB2 TYR 1 -3.295 -8.460 8.935
4 HB3 TYR 1 HB3 TYR 1 -2.599 -8.596 7.316
5 HD1 TYR 1 HD2 TYR 1 -1.398 -6.230 6.479
6 HD2 TYR 1 HD1 TYR 1 -1.643 -7.698 10.524
7 HE1 TYR 1 HE2 TYR 1 0.518 -4.820 7.124
8 HE2 TYR 1 HE1 TYR 1 0.438 -6.512 11.075
9 HH TYR 1 HH TYR 1 2.157 -5.048 10.285
10 H ALA 2 H ALA 2 -3.927 -8.313 5.275
11 HA ALA 2 HA ALA 2 -6.716 -8.775 4.866
12 HB1 ALA 2 HB1 ALA 2 -5.968 -10.477 3.179
13 HB2 ALA 2 HB2 ALA 2 -5.135 -8.905 2.994
14 HB3 ALA 2 HB3 ALA 2 -4.279 -10.279 3.741
15 H GLU 3 H GLU 3 -7.892 -9.930 6.560
16 HA GLU 3 HA GLU 3 -6.529 -11.993 8.058
17 HB2 GLU 3 HB2 GLU 3 -8.397 -10.654 9.047
18 HB3 GLU 3 HB3 GLU 3 -9.535 -11.365 7.870
19 HG2 GLU 3 HG2 GLU 3 -9.736 -12.482 10.076
20 HG3 GLU 3 HG3 GLU 3 -9.165 -13.644 8.864
21 H GLY 4 H GLY 4 -6.849 -14.379 7.829
22 HA2 GLY 4 HA2 GLY 4 -7.887 -16.276 6.893
23 HA3 GLY 4 HA3 GLY 4 -8.672 -15.284 5.651
24 H THR 5 H THR 5 -6.225 -13.839 4.720
25 HA THR 5 HA THR 5 -5.440 -15.773 2.787
26 HB THR 5 HB THR 5 -3.556 -14.030 2.307
27 HG1 THR 5 HG1 THR 5 -3.620 -13.090 4.528
28 HG21 THR 5 HG21 THR 5 -6.478 -13.035 2.385
29 HG22 THR 5 HG22 THR 5 -5.729 -13.983 1.066
30 HG23 THR 5 HG23 THR 5 -5.149 -12.331 1.420
31 H PHE 6 H PHE 6 -4.019 -15.062 6.082
32 HA PHE 6 HA PHE 6 -1.528 -16.246 5.504
33 HB2 PHE 6 HB2 PHE 6 -1.163 -16.640 7.817
34 HB3 PHE 6 HB3 PHE 6 -2.141 -15.165 7.761
35 HD1 PHE 6 HD1 PHE 6 -2.075 -18.795 8.583
36 HD2 PHE 6 HD2 PHE 6 -4.555 -15.277 8.536
37 HE1 PHE 6 HE1 PHE 6 -3.606 -19.853 10.209
38 HE2 PHE 6 HE2 PHE 6 -6.140 -16.386 10.085
39 HZ PHE 6 HZ PHE 6 -5.640 -18.647 10.973
40 H ILE 7 H ILE 7 -4.790 -17.758 6.072
41 HA ILE 7 HA ILE 7 -3.645 -20.434 6.168
42 HB ILE 7 HB ILE 7 -6.532 -19.600 5.539
43 HG12 ILE 7 HG12 ILE 7 -5.225 -20.629 8.137
44 HG13 ILE 7 HG13 ILE 7 -5.783 -18.962 7.831
45 HG21 ILE 7 HG21 ILE 7 -7.087 -22.003 5.857
46 HG22 ILE 7 HG22 ILE 7 -5.885 -21.861 4.574
47 HG23 ILE 7 HG23 ILE 7 -5.373 -22.376 6.205
48 HD11 ILE 7 HD11 ILE 7 -7.456 -20.073 9.193
49 HD12 ILE 7 HD12 ILE 7 -8.150 -19.802 7.569
50 HD13 ILE 7 HD13 ILE 7 -7.598 -21.434 8.065
51 H SER 8 H SER 8 -5.518 -18.577 3.559
52 HA SER 8 HA SER 8 -5.093 -20.728 1.728
53 HB2 SER 8 HB2 SER 8 -6.932 -19.137 1.400
54 HB3 SER 8 HB3 SER 8 -5.784 -17.798 1.118
55 HG SER 8 HG SER 8 -6.460 -18.816 -0.919
56 H ASP 9 H ASP 9 -3.511 -17.431 1.846
57 HA ASP 9 HA ASP 9 -1.750 -18.122 -0.325
58 HB2 ASP 9 HB2 ASP 9 -1.531 -15.838 1.722
59 HB3 ASP 9 HB3 ASP 9 -0.624 -15.969 0.198
60 H TYR 10 H TYR 10 -1.285 -17.842 3.297
61 HA TYR 10 HA TYR 10 0.437 -18.541 4.634
62 HB2 TYR 10 HB2 TYR 10 1.627 -20.178 2.337
63 HB3 TYR 10 HB3 TYR 10 2.086 -20.188 4.039
64 HD1 TYR 10 HD1 TYR 10 0.313 -20.838 5.800
65 HD2 TYR 10 HD2 TYR 10 -0.347 -21.438 1.591
66 HE1 TYR 10 HE1 TYR 10 -1.354 -22.592 6.306
67 HE2 TYR 10 HE2 TYR 10 -1.963 -23.222 2.094
68 HH TYR 10 HH TYR 10 -3.052 -24.488 3.802
69 H SER 11 H SER 11 2.182 -18.000 1.403
70 HA SER 11 HA SER 11 3.073 -15.404 2.415
71 HB2 SER 11 HB2 SER 11 4.521 -16.994 3.781
72 HB3 SER 11 HB3 SER 11 5.071 -17.742 2.263
73 HG SER 11 HG SER 11 5.514 -14.986 2.981
74 H ILE 12 H ILE 12 1.741 -15.433 0.206
75 HA ILE 12 HA ILE 12 3.834 -15.237 -1.927
76 HB ILE 12 HB ILE 12 1.113 -16.615 -2.221
77 HG12 ILE 12 HG12 ILE 12 2.828 -18.090 -1.213
78 HG13 ILE 12 HG13 ILE 12 2.261 -18.628 -2.805
79 HG21 ILE 12 HG21 ILE 12 1.479 -15.224 -4.207
80 HG22 ILE 12 HG22 ILE 12 3.167 -15.772 -4.353
81 HG23 ILE 12 HG23 ILE 12 1.822 -16.913 -4.652
82 HD11 ILE 12 HD11 ILE 12 4.700 -18.974 -2.575
83 HD12 ILE 12 HD12 ILE 12 4.361 -17.830 -3.894
84 HD13 ILE 12 HD13 ILE 12 4.980 -17.239 -2.328
85 H ALA 13 H ALA 13 0.204 -14.548 -1.673
86 HA ALA 13 HA ALA 13 0.943 -11.714 -2.384
87 HB1 ALA 13 HB1 ALA 13 -0.400 -12.855 -4.151
88 HB2 ALA 13 HB2 ALA 13 -1.653 -13.271 -2.945
89 HB3 ALA 13 HB3 ALA 13 -1.334 -11.558 -3.349
90 H MET 14 H MET 14 1.506 -12.200 0.119
91 HA MET 14 HA MET 14 -0.806 -11.080 1.620
92 HB2 MET 14 HB2 MET 14 -1.109 -13.473 1.759
93 HB3 MET 14 HB3 MET 14 0.562 -13.770 2.278
94 HG2 MET 14 HG2 MET 14 -1.521 -12.101 3.829
95 HG3 MET 14 HG3 MET 14 -1.143 -13.813 4.189
96 HE1 MET 14 HE1 MET 14 2.072 -14.092 4.257
97 HE2 MET 14 HE2 MET 14 2.344 -13.594 5.953
98 HE3 MET 14 HE3 MET 14 0.932 -14.621 5.542
99 H ASP 15 H ASP 15 2.572 -12.459 2.347
100 HA ASP 15 HA ASP 15 3.110 -10.208 4.066
101 HB2 ASP 15 HB2 ASP 15 4.467 -12.295 4.206
102 HB3 ASP 15 HB3 ASP 15 5.087 -12.033 2.555
103 H LYS 16 H LYS 16 3.748 -10.992 0.552
104 HA LYS 16 HA LYS 16 5.102 -8.569 -0.054
105 HB2 LYS 16 HB2 LYS 16 5.090 -10.503 -1.574
106 HB3 LYS 16 HB3 LYS 16 3.325 -10.368 -1.816
107 HG2 LYS 16 HG2 LYS 16 3.600 -8.161 -2.938
108 HG3 LYS 16 HG3 LYS 16 5.361 -8.200 -2.632
109 HD2 LYS 16 HD2 LYS 16 5.570 -10.262 -4.046
110 HD3 LYS 16 HD3 LYS 16 3.805 -10.277 -4.313
111 HE2 LYS 16 HE2 LYS 16 3.959 -8.051 -5.475
112 HE3 LYS 16 HE3 LYS 16 5.725 -8.035 -5.209
113 HZ1 LYS 16 HZ1 LYS 16 5.905 -10.120 -6.555
114 HZ2 LYS 16 HZ2 LYS 16 5.186 -8.829 -7.469
115 HZ3 LYS 16 HZ3 LYS 16 4.182 -10.096 -6.828
116 H ILE 17 H ILE 17 1.524 -9.386 -0.255
117 HA ILE 17 HA ILE 17 0.831 -6.820 -1.346
118 HB ILE 17 HB ILE 17 -0.792 -8.775 0.375
119 HG12 ILE 17 HG12 ILE 17 -0.156 -9.560 -1.950
120 HG13 ILE 17 HG13 ILE 17 -1.905 -9.499 -1.622
121 HG21 ILE 17 HG21 ILE 17 -2.849 -7.465 -0.369
122 HG22 ILE 17 HG22 ILE 17 -1.805 -6.613 0.788
123 HG23 ILE 17 HG23 ILE 17 -1.751 -6.169 -0.937
124 HD11 ILE 17 HD11 ILE 17 -0.365 -7.405 -3.286
125 HD12 ILE 17 HD12 ILE 17 -1.371 -8.732 -3.914
126 HD13 ILE 17 HD13 ILE 17 -2.129 -7.426 -2.978
127 H HIS 18 H HIS 18 0.913 -8.059 2.077
128 HA HIS 18 HA HIS 18 0.094 -5.622 3.264
129 HB2 HIS 18 HB2 HIS 18 2.061 -7.716 4.353
130 HB3 HIS 18 HB3 HIS 18 1.239 -6.476 5.333
131 HD1 HIS 18 HD1 HIS 18 0.755 -9.217 6.188
132 HD2 HIS 18 HD2 HIS 18 -1.559 -7.453 3.149
133 HE1 HIS 18 HE1 HIS 18 -1.408 -10.532 6.094
134 H GLN 19 H GLN 19 3.421 -6.753 2.252
135 HA GLN 19 HA GLN 19 4.803 -4.599 3.422
136 HB2 GLN 19 HB2 GLN 19 5.932 -6.628 2.334
137 HB3 GLN 19 HB3 GLN 19 5.529 -5.957 0.745
138 HG2 GLN 19 HG2 GLN 19 7.830 -5.333 1.247
139 HG3 GLN 19 HG3 GLN 19 6.843 -3.852 1.322
140 HE21 GLN 19 HE21 GLN 19 8.761 -3.019 2.668
141 HE22 GLN 19 HE22 GLN 19 8.799 -3.430 4.340
142 H GLN 20 H GLN 20 3.473 -4.924 0.030
143 HA GLN 20 HA GLN 20 4.278 -2.290 -0.738
144 HB2 GLN 20 HB2 GLN 20 1.960 -4.047 -1.760
145 HB3 GLN 20 HB3 GLN 20 2.435 -2.493 -2.496
146 HG2 GLN 20 HG2 GLN 20 4.721 -3.392 -2.996
147 HG3 GLN 20 HG3 GLN 20 4.300 -4.948 -2.250
148 HE21 GLN 20 HE21 GLN 20 3.257 -2.660 -4.924
149 HE22 GLN 20 HE22 GLN 20 2.654 -3.920 -5.936
150 H ASP 21 H ASP 21 1.282 -3.577 0.915
151 HA ASP 21 HA ASP 21 -0.221 -1.222 0.564
152 HB2 ASP 21 HB2 ASP 21 -0.398 -3.152 2.945
153 HB3 ASP 21 HB3 ASP 21 -1.585 -1.898 2.509
154 H PHE 22 H PHE 22 1.741 -2.177 3.599
155 HA PHE 22 HA PHE 22 1.127 0.411 4.660
156 HB2 PHE 22 HB2 PHE 22 2.715 0.028 6.472
157 HB3 PHE 22 HB3 PHE 22 1.529 -1.277 6.280
158 HD1 PHE 22 HD2 PHE 22 5.105 -0.340 5.413
159 HD2 PHE 22 HD1 PHE 22 2.284 -3.546 5.900
160 HE1 PHE 22 HE2 PHE 22 6.967 -1.946 5.664
161 HE2 PHE 22 HE1 PHE 22 4.145 -5.142 6.211
162 HZ PHE 22 HZ PHE 22 6.489 -4.307 6.279
163 H VAL 23 H VAL 23 3.995 -0.778 2.719
164 HA VAL 23 HA VAL 23 5.537 1.557 3.313
165 HB VAL 23 HB VAL 23 5.543 -0.187 0.785
166 HG11 VAL 23 HG11 VAL 23 7.701 0.998 0.211
167 HG12 VAL 23 HG12 VAL 23 6.318 2.108 0.143
168 HG13 VAL 23 HG13 VAL 23 7.416 2.144 1.551
169 HG21 VAL 23 HG21 VAL 23 6.412 -1.318 2.874
170 HG22 VAL 23 HG22 VAL 23 7.717 -0.997 1.703
171 HG23 VAL 23 HG23 VAL 23 7.529 0.046 3.140
172 H ASN 24 H ASN 24 3.358 0.872 0.425
173 HA ASN 24 HA ASN 24 3.631 3.486 -0.610
174 HB2 ASN 24 HB2 ASN 24 1.147 1.677 -0.842
175 HB3 ASN 24 HB3 ASN 24 1.539 3.076 -1.878
176 HD21 ASN 24 HD21 ASN 24 1.127 1.106 -3.482
177 HD22 ASN 24 HD22 ASN 24 2.549 0.238 -3.930
178 H TRP 25 H TRP 25 1.181 2.087 1.691
179 HA TRP 25 HA TRP 25 -0.492 4.392 1.681
180 HB2 TRP 25 HB2 TRP 25 -1.348 2.253 2.397
181 HB3 TRP 25 HB3 TRP 25 -0.185 2.155 3.734
182 HD1 TRP 25 HD1 TRP 25 -3.409 4.075 2.814
183 HE1 TRP 25 HE1 TRP 25 -4.418 4.934 4.965
184 HE3 TRP 25 HE3 TRP 25 0.325 2.707 6.100
185 HZ2 TRP 25 HZ2 TRP 25 -3.749 5.204 7.627
186 HZ3 TRP 25 HZ3 TRP 25 0.066 3.365 8.509
187 HH2 TRP 25 HH2 TRP 25 -1.920 4.642 9.244
188 H LEU 26 H LEU 26 2.027 3.373 4.178
189 HA LEU 26 HA LEU 26 1.712 5.524 5.866
190 HB2 LEU 26 HB2 LEU 26 4.302 4.125 4.990
191 HB3 LEU 26 HB3 LEU 26 4.336 5.399 6.224
192 HG LEU 26 HG LEU 26 2.562 2.919 6.547
193 HD11 LEU 26 HD11 LEU 26 4.876 2.098 6.241
194 HD12 LEU 26 HD12 LEU 26 4.327 1.881 7.923
195 HD13 LEU 26 HD13 LEU 26 5.452 3.212 7.515
196 HD21 LEU 26 HD21 LEU 26 2.078 4.910 8.087
197 HD22 LEU 26 HD22 LEU 26 3.778 4.859 8.618
198 HD23 LEU 26 HD23 LEU 26 2.688 3.492 8.973
199 H LEU 27 H LEU 27 4.124 5.565 3.102
200 HA LEU 27 HA LEU 27 4.599 8.344 3.513
201 HB2 LEU 27 HB2 LEU 27 5.872 8.350 1.437
202 HB3 LEU 27 HB3 LEU 27 6.211 6.926 2.438
203 HG LEU 27 HG LEU 27 4.456 5.690 0.815
204 HD11 LEU 27 HD11 LEU 27 4.447 6.553 -1.503
205 HD12 LEU 27 HD12 LEU 27 5.368 8.000 -1.005
206 HD13 LEU 27 HD13 LEU 27 3.697 7.759 -0.438
207 HD21 LEU 27 HD21 LEU 27 6.330 5.075 -0.716
208 HD22 LEU 27 HD22 LEU 27 6.867 5.104 0.982
209 HD23 LEU 27 HD23 LEU 27 7.284 6.462 -0.106
210 H ALA 28 H ALA 28 2.066 6.676 1.524
211 HA ALA 28 HA ALA 28 1.364 9.117 0.157
212 HB1 ALA 28 HB1 ALA 28 -0.747 7.982 -0.461
213 HB2 ALA 28 HB2 ALA 28 0.655 6.906 -0.736
214 HB3 ALA 28 HB3 ALA 28 -0.402 6.660 0.690
215 H GLN 29 H GLN 29 0.564 7.881 3.483
216 HA GLN 29 HA GLN 29 -1.840 9.364 3.739
217 HB2 GLN 29 HB2 GLN 29 0.208 8.760 5.952
218 HB3 GLN 29 HB3 GLN 29 -1.429 9.419 6.205
219 HG2 GLN 29 HG2 GLN 29 -0.775 6.605 5.154
220 HG3 GLN 29 HG3 GLN 29 -1.495 7.048 6.701
221 HE21 GLN 29 HE21 GLN 29 -2.121 6.853 3.126
222 HE22 GLN 29 HE22 GLN 29 -3.833 7.002 3.279
223 H LYS 30 H LYS 30 1.601 10.539 3.874
224 HA LYS 30 HA LYS 30 0.787 13.072 4.987
225 HB2 LYS 30 HB2 LYS 30 3.249 12.169 4.619
226 HB3 LYS 30 HB3 LYS 30 3.097 12.859 2.988
227 HG2 LYS 30 HG2 LYS 30 2.938 14.306 5.714
228 HG3 LYS 30 HG3 LYS 30 4.198 14.469 4.465
229 HD2 LYS 30 HD2 LYS 30 2.439 15.497 2.913
230 HD3 LYS 30 HD3 LYS 30 1.283 15.449 4.280
231 HE2 LYS 30 HE2 LYS 30 2.765 16.891 5.656
232 HE3 LYS 30 HE3 LYS 30 3.917 17.008 4.296
233 HZ1 LYS 30 HZ1 LYS 30 1.017 17.942 4.250
234 HZ2 LYS 30 HZ2 LYS 30 2.132 18.039 2.913
235 HZ3 LYS 30 HZ3 LYS 30 2.421 18.961 4.360
236 H GLY 31 H GLY 31 1.334 11.795 1.574
237 HA2 GLY 31 HA2 GLY 31 0.450 14.005 0.153
238 HA3 GLY 31 HA3 GLY 31 0.176 12.325 -0.380
239 H LYS 32 H LYS 32 -1.573 11.503 1.886
240 HA LYS 32 HA LYS 32 -4.011 12.281 0.716
241 HB2 LYS 32 HB2 LYS 32 -3.670 10.216 2.234
242 HB3 LYS 32 HB3 LYS 32 -3.624 11.319 3.614
243 HG2 LYS 32 HG2 LYS 32 -5.827 10.337 3.476
244 HG3 LYS 32 HG3 LYS 32 -5.939 12.080 3.147
245 HD2 LYS 32 HD2 LYS 32 -7.436 10.773 1.732
246 HD3 LYS 32 HD3 LYS 32 -6.277 11.625 0.701
247 HE2 LYS 32 HE2 LYS 32 -5.700 8.718 1.508
248 HE3 LYS 32 HE3 LYS 32 -6.940 9.049 0.283
249 HZ1 LYS 32 HZ1 LYS 32 -4.031 9.854 -0.018
250 HZ2 LYS 32 HZ2 LYS 32 -5.319 10.244 -1.106
251 HZ3 LYS 32 HZ3 LYS 32 -4.871 8.593 -0.824
252 H LYS 33 H LYS 33 -2.345 13.481 3.777
253 HA LYS 33 HA LYS 33 -4.377 15.407 4.337
254 HB2 LYS 33 HB2 LYS 33 -1.360 15.637 4.896
255 HB3 LYS 33 HB3 LYS 33 -2.608 16.698 5.587
256 HG2 LYS 33 HG2 LYS 33 -2.372 13.659 6.138
257 HG3 LYS 33 HG3 LYS 33 -1.808 14.979 7.184
258 HD2 LYS 33 HD2 LYS 33 -4.180 15.807 7.423
259 HD3 LYS 33 HD3 LYS 33 -4.746 14.456 6.405
260 HE2 LYS 33 HE2 LYS 33 -5.141 13.922 8.733
261 HE3 LYS 33 HE3 LYS 33 -3.945 12.789 8.055
262 HZ1 LYS 33 HZ1 LYS 33 -3.199 15.229 9.706
263 HZ2 LYS 33 HZ2 LYS 33 -2.158 13.891 9.267
264 HZ3 LYS 33 HZ3 LYS 33 -3.449 13.645 10.377
265 H ASN 34 H ASN 34 -1.406 15.648 2.222
266 HA ASN 34 HA ASN 34 -1.906 18.373 1.567
267 HB2 ASN 34 HB2 ASN 34 0.252 17.084 1.051
268 HB3 ASN 34 HB3 ASN 34 -0.610 16.295 -0.292
269 HD21 ASN 34 HD21 ASN 34 0.376 19.564 1.039
270 HD22 ASN 34 HD22 ASN 34 0.397 20.337 -0.502
271 H ASP 35 H ASP 35 -3.449 15.335 0.356
272 HA ASP 35 HA ASP 35 -4.634 16.693 -1.936
273 HB2 ASP 35 HB2 ASP 35 -4.138 14.229 -1.899
274 HB3 ASP 35 HB3 ASP 35 -5.404 14.018 -0.663
275 H TRP 36 H TRP 36 -5.230 17.551 1.210
276 HA TRP 36 HA TRP 36 -8.098 18.009 0.648
277 HB2 TRP 36 HB2 TRP 36 -7.003 16.315 2.956
278 HB3 TRP 36 HB3 TRP 36 -8.605 17.100 3.013
279 HD1 TRP 36 HD1 TRP 36 -6.947 14.002 1.635
280 HE1 TRP 36 HE1 TRP 36 -8.554 12.686 0.246
281 HE3 TRP 36 HE3 TRP 36 -10.780 17.470 1.267
282 HZ2 TRP 36 HZ2 TRP 36 -11.035 12.924 -0.863
283 HZ3 TRP 36 HZ3 TRP 36 -12.845 16.744 0.046
284 HH2 TRP 36 HH2 TRP 36 -12.978 14.499 -0.984
285 H LYS 37 H LYS 37 -5.679 18.331 3.441
286 HA LYS 37 HA LYS 37 -6.794 20.804 4.223
287 HB2 LYS 37 HB2 LYS 37 -5.199 19.498 5.649
288 HB3 LYS 37 HB3 LYS 37 -3.880 19.840 4.507
289 HG2 LYS 37 HG2 LYS 37 -3.712 21.309 6.463
290 HG3 LYS 37 HG3 LYS 37 -4.045 22.297 5.018
291 HD2 LYS 37 HD2 LYS 37 -6.365 22.662 5.698
292 HD3 LYS 37 HD3 LYS 37 -6.287 21.361 6.918
293 HE2 LYS 37 HE2 LYS 37 -6.254 23.587 7.981
294 HE3 LYS 37 HE3 LYS 37 -4.760 22.685 8.331
295 HZ1 LYS 37 HZ1 LYS 37 -4.392 25.090 7.788
296 HZ2 LYS 37 HZ2 LYS 37 -5.000 24.819 6.180
297 HZ3 LYS 37 HZ3 LYS 37 -3.528 24.042 6.724
298 H HIS 38 H HIS 38 -3.950 20.066 2.013
299 HA HIS 38 HA HIS 38 -3.649 22.917 1.418
300 HB2 HIS 38 HB2 HIS 38 -1.724 21.293 1.453
301 HB3 HIS 38 HB3 HIS 38 -2.357 20.544 -0.032
302 HD1 HIS 38 HD1 HIS 38 -2.815 22.493 -2.018
303 HD2 HIS 38 HD2 HIS 38 0.033 23.194 0.993
304 HE1 HIS 38 HE1 HIS 38 -1.306 24.301 -2.918
305 H ASN 39 H ASN 39 -4.980 19.945 -0.310
306 HA ASN 39 HA ASN 39 -5.305 21.177 -2.788
307 HB2 ASN 39 HB2 ASN 39 -5.755 18.751 -2.433
308 HB3 ASN 39 HB3 ASN 39 -7.228 19.133 -1.513
309 HD21 ASN 39 HD21 ASN 39 -5.648 19.522 -4.802
310 HD22 ASN 39 HD22 ASN 39 -7.144 19.623 -5.654
311 H ILE 40 H ILE 40 -7.707 21.079 -0.008
312 HA ILE 40 HA ILE 40 -9.381 23.083 -1.383
313 HB ILE 40 HB ILE 40 -9.476 21.907 1.444
314 HG12 ILE 40 HG12 ILE 40 -11.758 21.164 0.752
315 HG13 ILE 40 HG13 ILE 40 -11.565 21.943 -0.840
316 HG21 ILE 40 HG21 ILE 40 -11.473 23.326 1.895
317 HG22 ILE 40 HG22 ILE 40 -10.017 24.316 1.701
318 HG23 ILE 40 HG23 ILE 40 -11.205 24.204 0.365
319 HD11 ILE 40 HD11 ILE 40 -9.846 19.615 0.210
320 HD12 ILE 40 HD12 ILE 40 -11.232 19.437 -0.900
321 HD13 ILE 40 HD13 ILE 40 -9.778 20.307 -1.441
322 H THR 41 H THR 41 -9.322 25.400 -0.751
323 HA THR 41 HA THR 41 -7.215 26.768 -0.841
324 HB THR 41 HB THR 41 -9.171 27.223 1.475
325 HG1 THR 41 HG1 THR 41 -9.298 28.094 -1.253
326 HG21 THR 41 HG21 THR 41 -7.289 29.197 0.015
327 HG22 THR 41 HG22 THR 41 -7.206 28.744 1.745
328 HG23 THR 41 HG23 THR 41 -8.604 29.669 1.130
329 H GLN 42 H GLN 42 -5.041 26.531 -0.135
330 HA GLN 42 HA GLN 42 -4.404 25.150 2.309
331 HB2 GLN 42 HB2 GLN 42 -2.851 25.412 0.305
332 HB3 GLN 42 HB3 GLN 42 -2.680 27.140 0.709
333 HG2 GLN 42 HG2 GLN 42 -1.842 24.742 2.464
334 HG3 GLN 42 HG3 GLN 42 -0.749 25.812 1.558
335 HE21 GLN 42 HE21 GLN 42 -2.417 25.457 4.654
336 HE22 GLN 42 HE22 GLN 42 -2.008 27.022 5.245
Start of MODEL 5
1 H1 TYR 1 H1 TYR 1 2.899 -20.224 13.712
2 HA TYR 1 HA TYR 1 2.823 -19.590 11.332
3 HB2 TYR 1 HB2 TYR 1 0.006 -20.322 12.382
4 HB3 TYR 1 HB3 TYR 1 0.529 -20.499 10.693
5 HD1 TYR 1 HD2 TYR 1 2.519 -22.032 10.157
6 HD2 TYR 1 HD1 TYR 1 0.536 -22.098 13.977
7 HE1 TYR 1 HE2 TYR 1 3.502 -24.242 10.624
8 HE2 TYR 1 HE1 TYR 1 1.511 -24.322 14.438
9 HH TYR 1 HH TYR 1 3.564 -26.102 12.128
10 H ALA 2 H ALA 2 1.440 -18.357 9.632
11 HA ALA 2 HA ALA 2 0.707 -15.689 10.705
12 HB1 ALA 2 HB1 ALA 2 0.274 -15.127 8.329
13 HB2 ALA 2 HB2 ALA 2 1.900 -15.844 8.530
14 HB3 ALA 2 HB3 ALA 2 0.575 -16.826 7.844
15 H GLU 3 H GLU 3 -0.954 -16.759 12.215
16 HA GLU 3 HA GLU 3 -3.075 -18.309 11.027
17 HB2 GLU 3 HB2 GLU 3 -2.358 -18.554 13.396
18 HB3 GLU 3 HB3 GLU 3 -2.990 -16.929 13.769
19 HG2 GLU 3 HG2 GLU 3 -5.312 -17.716 13.054
20 HG3 GLU 3 HG3 GLU 3 -4.642 -19.337 12.739
21 H GLY 4 H GLY 4 -3.938 -16.961 9.258
22 HA2 GLY 4 HA2 GLY 4 -6.163 -15.500 9.654
23 HA3 GLY 4 HA3 GLY 4 -4.915 -14.246 9.920
24 H THR 5 H THR 5 -2.897 -15.049 8.041
25 HA THR 5 HA THR 5 -3.967 -13.804 5.715
26 HB THR 5 HB THR 5 -1.863 -14.703 4.559
27 HG1 THR 5 HG1 THR 5 -1.524 -16.615 5.909
28 HG21 THR 5 HG21 THR 5 -0.280 -13.308 5.896
29 HG22 THR 5 HG22 THR 5 -1.421 -13.276 7.265
30 HG23 THR 5 HG23 THR 5 -1.857 -12.483 5.729
31 H PHE 6 H PHE 6 -3.799 -17.334 6.622
32 HA PHE 6 HA PHE 6 -4.236 -18.268 3.999
33 HB2 PHE 6 HB2 PHE 6 -5.093 -20.353 4.950
34 HB3 PHE 6 HB3 PHE 6 -3.698 -19.808 5.905
35 HD1 PHE 6 HD2 PHE 6 -7.439 -20.070 5.818
36 HD2 PHE 6 HD1 PHE 6 -4.010 -19.235 8.284
37 HE1 PHE 6 HE2 PHE 6 -8.880 -20.053 7.826
38 HE2 PHE 6 HE1 PHE 6 -5.483 -19.063 10.265
39 HZ PHE 6 HZ PHE 6 -7.920 -19.483 10.046
40 H ILE 7 H ILE 7 -6.544 -16.774 6.326
41 HA ILE 7 HA ILE 7 -8.912 -17.679 5.031
42 HB ILE 7 HB ILE 7 -8.418 -15.004 6.460
43 HG12 ILE 7 HG12 ILE 7 -9.840 -17.577 7.417
44 HG13 ILE 7 HG13 ILE 7 -8.196 -17.098 7.892
45 HG21 ILE 7 HG21 ILE 7 -10.899 -14.724 6.501
46 HG22 ILE 7 HG22 ILE 7 -10.329 -14.808 4.835
47 HG23 ILE 7 HG23 ILE 7 -11.093 -16.243 5.575
48 HD11 ILE 7 HD11 ILE 7 -10.762 -15.602 8.651
49 HD12 ILE 7 HD12 ILE 7 -9.653 -16.497 9.709
50 HD13 ILE 7 HD13 ILE 7 -9.105 -14.984 8.934
51 H SER 8 H SER 8 -6.829 -14.695 4.466
52 HA SER 8 HA SER 8 -8.411 -13.906 2.203
53 HB2 SER 8 HB2 SER 8 -6.955 -12.261 3.337
54 HB3 SER 8 HB3 SER 8 -5.510 -13.194 2.878
55 HG SER 8 HG SER 8 -7.293 -11.974 0.982
56 H ASP 9 H ASP 9 -5.101 -15.567 2.362
57 HA ASP 9 HA ASP 9 -5.904 -17.152 0.035
58 HB2 ASP 9 HB2 ASP 9 -5.265 -15.026 -1.063
59 HB3 ASP 9 HB3 ASP 9 -3.700 -15.023 -0.229
60 H TYR 10 H TYR 10 -2.657 -16.151 1.552
61 HA TYR 10 HA TYR 10 -2.425 -18.890 2.586
62 HB2 TYR 10 HB2 TYR 10 -0.671 -17.979 0.240
63 HB3 TYR 10 HB3 TYR 10 -0.256 -19.316 1.337
64 HD1 TYR 10 HD2 TYR 10 -2.054 -21.197 1.667
65 HD2 TYR 10 HD1 TYR 10 -1.970 -18.525 -1.701
66 HE1 TYR 10 HE2 TYR 10 -3.557 -22.712 0.420
67 HE2 TYR 10 HE1 TYR 10 -3.440 -20.045 -2.953
68 HH TYR 10 HH TYR 10 -4.666 -22.096 -2.916
69 H SER 11 H SER 11 -0.006 -16.283 1.669
70 HA SER 11 HA SER 11 0.478 -15.323 4.239
71 HB2 SER 11 HB2 SER 11 1.083 -17.565 5.103
72 HB3 SER 11 HB3 SER 11 2.160 -17.843 3.704
73 HG SER 11 HG SER 11 3.314 -17.009 5.628
74 H ILE 12 H ILE 12 2.432 -16.801 1.483
75 HA ILE 12 HA ILE 12 4.352 -14.629 1.644
76 HB ILE 12 HB ILE 12 3.794 -16.642 -0.604
77 HG12 ILE 12 HG12 ILE 12 6.112 -16.460 1.433
78 HG13 ILE 12 HG13 ILE 12 4.712 -17.542 1.605
79 HG21 ILE 12 HG21 ILE 12 4.753 -14.519 -1.552
80 HG22 ILE 12 HG22 ILE 12 6.082 -14.587 -0.362
81 HG23 ILE 12 HG23 ILE 12 5.935 -15.826 -1.640
82 HD11 ILE 12 HD11 ILE 12 5.338 -18.675 -0.582
83 HD12 ILE 12 HD12 ILE 12 6.849 -17.714 -0.609
84 HD13 ILE 12 HD13 ILE 12 6.549 -18.856 0.718
85 H ALA 13 H ALA 13 1.544 -15.426 -0.594
86 HA ALA 13 HA ALA 13 1.710 -13.107 -2.143
87 HB1 ALA 13 HB1 ALA 13 -0.772 -13.330 -2.501
88 HB2 ALA 13 HB2 ALA 13 0.043 -14.917 -2.613
89 HB3 ALA 13 HB3 ALA 13 -0.870 -14.486 -1.139
90 H MET 14 H MET 14 -0.026 -13.577 1.056
91 HA MET 14 HA MET 14 -0.924 -10.837 1.071
92 HB2 MET 14 HB2 MET 14 -0.598 -12.863 3.349
93 HB3 MET 14 HB3 MET 14 -1.339 -11.255 3.552
94 HG2 MET 14 HG2 MET 14 -2.453 -13.445 1.669
95 HG3 MET 14 HG3 MET 14 -3.093 -12.987 3.267
96 HE1 MET 14 HE1 MET 14 -2.564 -11.873 -0.464
97 HE2 MET 14 HE2 MET 14 -4.204 -12.561 -0.249
98 HE3 MET 14 HE3 MET 14 -4.010 -10.828 -0.647
99 H ASP 15 H ASP 15 2.120 -12.389 2.368
100 HA ASP 15 HA ASP 15 2.866 -10.073 3.875
101 HB2 ASP 15 HB2 ASP 15 4.710 -12.035 2.374
102 HB3 ASP 15 HB3 ASP 15 5.229 -10.861 3.612
103 H LYS 16 H LYS 16 3.361 -11.010 0.385
104 HA LYS 16 HA LYS 16 4.940 -8.721 -0.248
105 HB2 LYS 16 HB2 LYS 16 4.803 -10.704 -1.719
106 HB3 LYS 16 HB3 LYS 16 3.075 -10.400 -2.040
107 HG2 LYS 16 HG2 LYS 16 3.622 -8.236 -3.146
108 HG3 LYS 16 HG3 LYS 16 5.360 -8.472 -2.789
109 HD2 LYS 16 HD2 LYS 16 5.335 -10.578 -4.187
110 HD3 LYS 16 HD3 LYS 16 3.603 -10.317 -4.539
111 HE2 LYS 16 HE2 LYS 16 4.177 -8.121 -5.649
112 HE3 LYS 16 HE3 LYS 16 5.906 -8.410 -5.306
113 HZ1 LYS 16 HZ1 LYS 16 5.822 -10.458 -6.690
114 HZ2 LYS 16 HZ2 LYS 16 5.333 -9.064 -7.610
115 HZ3 LYS 16 HZ3 LYS 16 4.132 -10.180 -7.023
116 H ILE 17 H ILE 17 1.326 -9.302 -0.516
117 HA ILE 17 HA ILE 17 0.813 -6.707 -1.618
118 HB ILE 17 HB ILE 17 -0.970 -8.513 0.109
119 HG12 ILE 17 HG12 ILE 17 -0.428 -9.515 -2.124
120 HG13 ILE 17 HG13 ILE 17 -2.147 -9.141 -1.923
121 HG21 ILE 17 HG21 ILE 17 -1.829 -6.281 0.439
122 HG22 ILE 17 HG22 ILE 17 -1.696 -5.883 -1.293
123 HG23 ILE 17 HG23 ILE 17 -2.909 -7.070 -0.729
124 HD11 ILE 17 HD11 ILE 17 -1.850 -7.080 -3.373
125 HD12 ILE 17 HD12 ILE 17 -0.128 -7.510 -3.603
126 HD13 ILE 17 HD13 ILE 17 -1.406 -8.590 -4.200
127 H HIS 18 H HIS 18 0.836 -7.904 1.830
128 HA HIS 18 HA HIS 18 0.076 -5.479 3.002
129 HB2 HIS 18 HB2 HIS 18 2.134 -7.492 4.084
130 HB3 HIS 18 HB3 HIS 18 1.360 -6.198 5.036
131 HD1 HIS 18 HD1 HIS 18 0.969 -8.754 6.184
132 HD2 HIS 18 HD2 HIS 18 -1.541 -7.403 3.087
133 HE1 HIS 18 HE1 HIS 18 -1.173 -10.068 6.410
134 H GLN 19 H GLN 19 3.433 -6.591 1.989
135 HA GLN 19 HA GLN 19 4.760 -4.395 3.113
136 HB2 GLN 19 HB2 GLN 19 6.005 -6.313 2.169
137 HB3 GLN 19 HB3 GLN 19 5.525 -5.838 0.521
138 HG2 GLN 19 HG2 GLN 19 6.717 -3.611 0.846
139 HG3 GLN 19 HG3 GLN 19 7.185 -4.129 2.491
140 HE21 GLN 19 HE21 GLN 19 9.369 -3.472 1.297
141 HE22 GLN 19 HE22 GLN 19 10.189 -4.787 0.537
142 H GLN 20 H GLN 20 3.515 -4.682 -0.337
143 HA GLN 20 HA GLN 20 4.163 -1.973 -0.954
144 HB2 GLN 20 HB2 GLN 20 1.970 -3.822 -2.067
145 HB3 GLN 20 HB3 GLN 20 2.174 -2.144 -2.627
146 HG2 GLN 20 HG2 GLN 20 3.317 -3.701 -4.162
147 HG3 GLN 20 HG3 GLN 20 4.457 -2.564 -3.420
148 HE21 GLN 20 HE21 GLN 20 6.063 -3.429 -1.800
149 HE22 GLN 20 HE22 GLN 20 6.338 -5.127 -1.741
150 H ASP 21 H ASP 21 1.203 -3.397 0.670
151 HA ASP 21 HA ASP 21 -0.266 -0.988 0.459
152 HB2 ASP 21 HB2 ASP 21 -0.544 -3.130 2.635
153 HB3 ASP 21 HB3 ASP 21 -1.674 -1.789 2.330
154 H PHE 22 H PHE 22 1.568 -2.187 3.492
155 HA PHE 22 HA PHE 22 1.044 0.368 4.669
156 HB2 PHE 22 HB2 PHE 22 2.579 -0.206 6.482
157 HB3 PHE 22 HB3 PHE 22 1.372 -1.465 6.166
158 HD1 PHE 22 HD1 PHE 22 4.968 -0.514 5.466
159 HD2 PHE 22 HD2 PHE 22 2.109 -3.724 5.742
160 HE1 PHE 22 HE1 PHE 22 6.807 -2.167 5.405
161 HE2 PHE 22 HE2 PHE 22 3.955 -5.365 5.747
162 HZ PHE 22 HZ PHE 22 6.312 -4.592 5.606
163 H VAL 23 H VAL 23 3.885 -0.840 2.728
164 HA VAL 23 HA VAL 23 5.535 1.386 3.402
165 HB VAL 23 HB VAL 23 5.429 -0.262 0.815
166 HG11 VAL 23 HG11 VAL 23 7.619 0.818 0.212
167 HG12 VAL 23 HG12 VAL 23 6.295 2.001 0.210
168 HG13 VAL 23 HG13 VAL 23 7.435 1.945 1.587
169 HG21 VAL 23 HG21 VAL 23 7.492 -0.174 3.118
170 HG22 VAL 23 HG22 VAL 23 6.283 -1.463 2.887
171 HG23 VAL 23 HG23 VAL 23 7.568 -1.224 1.677
172 H ASN 24 H ASN 24 3.280 0.973 0.513
173 HA ASN 24 HA ASN 24 3.758 3.666 -0.277
174 HB2 ASN 24 HB2 ASN 24 2.907 2.006 -1.904
175 HB3 ASN 24 HB3 ASN 24 1.375 1.866 -1.006
176 HD21 ASN 24 HD21 ASN 24 3.509 4.408 -2.621
177 HD22 ASN 24 HD22 ASN 24 2.178 5.390 -3.104
178 H TRP 25 H TRP 25 0.921 2.155 1.500
179 HA TRP 25 HA TRP 25 -0.647 4.438 1.666
180 HB2 TRP 25 HB2 TRP 25 -1.516 2.320 2.597
181 HB3 TRP 25 HB3 TRP 25 -0.187 2.276 3.782
182 HD1 TRP 25 HD1 TRP 25 -2.571 5.301 3.108
183 HE1 TRP 25 HE1 TRP 25 -3.630 5.932 5.301
184 HE3 TRP 25 HE3 TRP 25 -0.599 1.565 6.131
185 HZ2 TRP 25 HZ2 TRP 25 -3.765 5.038 7.896
186 HZ3 TRP 25 HZ3 TRP 25 -1.213 1.611 8.549
187 HH2 TRP 25 HH2 TRP 25 -2.785 3.312 9.417
188 H LEU 26 H LEU 26 2.043 3.471 3.981
189 HA LEU 26 HA LEU 26 1.375 5.633 5.740
190 HB2 LEU 26 HB2 LEU 26 3.986 4.068 5.467
191 HB3 LEU 26 HB3 LEU 26 3.664 5.226 6.776
192 HG LEU 26 HG LEU 26 1.898 2.734 6.296
193 HD11 LEU 26 HD11 LEU 26 4.249 3.107 8.251
194 HD12 LEU 26 HD12 LEU 26 4.237 2.022 6.830
195 HD13 LEU 26 HD13 LEU 26 3.150 1.699 8.204
196 HD21 LEU 26 HD21 LEU 26 1.192 3.142 8.682
197 HD22 LEU 26 HD22 LEU 26 0.692 4.465 7.617
198 HD23 LEU 26 HD23 LEU 26 2.112 4.669 8.683
199 H LEU 27 H LEU 27 4.092 5.392 3.253
200 HA LEU 27 HA LEU 27 4.819 8.114 3.749
201 HB2 LEU 27 HB2 LEU 27 6.162 8.080 1.744
202 HB3 LEU 27 HB3 LEU 27 6.307 6.547 2.625
203 HG LEU 27 HG LEU 27 4.451 5.700 0.896
204 HD11 LEU 27 HD11 LEU 27 4.027 7.965 -0.220
205 HD12 LEU 27 HD12 LEU 27 4.602 6.739 -1.365
206 HD13 LEU 27 HD13 LEU 27 5.727 7.978 -0.747
207 HD21 LEU 27 HD21 LEU 27 6.251 4.963 -0.685
208 HD22 LEU 27 HD22 LEU 27 6.743 4.760 1.013
209 HD23 LEU 27 HD23 LEU 27 7.375 6.137 0.062
210 H ALA 28 H ALA 28 2.230 6.672 1.686
211 HA ALA 28 HA ALA 28 1.688 9.207 0.367
212 HB1 ALA 28 HB1 ALA 28 -0.111 6.727 0.645
213 HB2 ALA 28 HB2 ALA 28 -0.345 8.084 -0.493
214 HB3 ALA 28 HB3 ALA 28 1.071 7.006 -0.673
215 H GLN 29 H GLN 29 0.844 7.890 3.587
216 HA GLN 29 HA GLN 29 -1.660 9.117 3.894
217 HB2 GLN 29 HB2 GLN 29 -0.677 7.553 5.556
218 HB3 GLN 29 HB3 GLN 29 0.531 8.771 6.034
219 HG2 GLN 29 HG2 GLN 29 -1.343 10.341 6.725
220 HG3 GLN 29 HG3 GLN 29 -2.521 9.054 6.354
221 HE21 GLN 29 HE21 GLN 29 -1.946 6.797 7.493
222 HE22 GLN 29 HE22 GLN 29 -1.407 6.925 9.127
223 H LYS 30 H LYS 30 1.649 10.518 4.806
224 HA LYS 30 HA LYS 30 0.454 13.112 5.168
225 HB2 LYS 30 HB2 LYS 30 2.624 14.048 5.443
226 HB3 LYS 30 HB3 LYS 30 2.561 12.482 6.259
227 HG2 LYS 30 HG2 LYS 30 4.723 12.628 5.268
228 HG3 LYS 30 HG3 LYS 30 3.829 11.428 4.325
229 HD2 LYS 30 HD2 LYS 30 5.308 12.915 2.963
230 HD3 LYS 30 HD3 LYS 30 3.636 12.974 2.421
231 HE2 LYS 30 HE2 LYS 30 4.669 15.203 2.369
232 HE3 LYS 30 HE3 LYS 30 3.325 15.211 3.519
233 HZ1 LYS 30 HZ1 LYS 30 4.942 15.060 5.393
234 HZ2 LYS 30 HZ2 LYS 30 5.336 16.387 4.364
235 HZ3 LYS 30 HZ3 LYS 30 6.262 14.918 4.257
236 H GLY 31 H GLY 31 1.558 11.326 2.264
237 HA2 GLY 31 HA2 GLY 31 2.051 13.245 0.440
238 HA3 GLY 31 HA3 GLY 31 0.951 11.891 0.072
239 H LYS 32 H LYS 32 -1.346 12.561 1.758
240 HA LYS 32 HA LYS 32 -2.446 14.511 -0.027
241 HB2 LYS 32 HB2 LYS 32 -4.499 14.450 1.086
242 HB3 LYS 32 HB3 LYS 32 -3.885 12.777 1.095
243 HG2 LYS 32 HG2 LYS 32 -3.164 13.101 3.497
244 HG3 LYS 32 HG3 LYS 32 -3.838 14.754 3.486
245 HD2 LYS 32 HD2 LYS 32 -5.483 12.186 3.041
246 HD3 LYS 32 HD3 LYS 32 -5.331 13.075 4.577
247 HE2 LYS 32 HE2 LYS 32 -6.303 15.139 3.437
248 HE3 LYS 32 HE3 LYS 32 -6.637 14.142 1.995
249 HZ1 LYS 32 HZ1 LYS 32 -7.752 13.668 4.775
250 HZ2 LYS 32 HZ2 LYS 32 -8.043 12.658 3.381
251 HZ3 LYS 32 HZ3 LYS 32 -8.612 14.305 3.410
252 H LYS 33 H LYS 33 -1.248 14.737 3.450
253 HA LYS 33 HA LYS 33 -2.171 17.275 3.986
254 HB2 LYS 33 HB2 LYS 33 -0.859 15.944 5.635
255 HB3 LYS 33 HB3 LYS 33 0.636 16.226 4.705
256 HG2 LYS 33 HG2 LYS 33 0.392 18.714 5.080
257 HG3 LYS 33 HG3 LYS 33 -1.093 18.412 6.027
258 HD2 LYS 33 HD2 LYS 33 0.228 17.081 7.689
259 HD3 LYS 33 HD3 LYS 33 1.714 17.333 6.729
260 HE2 LYS 33 HE2 LYS 33 1.531 19.814 7.079
261 HE3 LYS 33 HE3 LYS 33 0.037 19.577 8.028
262 HZ1 LYS 33 HZ1 LYS 33 2.781 18.481 8.750
263 HZ2 LYS 33 HZ2 LYS 33 1.322 18.260 9.683
264 HZ3 LYS 33 HZ3 LYS 33 2.002 19.849 9.489
265 H ASN 34 H ASN 34 0.915 16.414 2.200
266 HA ASN 34 HA ASN 34 1.495 19.162 1.578
267 HB2 ASN 34 HB2 ASN 34 3.258 17.427 1.373
268 HB3 ASN 34 HB3 ASN 34 2.324 16.571 0.124
269 HD21 ASN 34 HD21 ASN 34 3.792 19.881 0.810
270 HD22 ASN 34 HD22 ASN 34 4.154 20.195 -0.846
271 H ASP 35 H ASP 35 -0.207 16.490 -0.282
272 HA ASP 35 HA ASP 35 -0.820 18.467 -2.414
273 HB2 ASP 35 HB2 ASP 35 0.164 16.219 -2.955
274 HB3 ASP 35 HB3 ASP 35 -1.315 15.452 -2.328
275 H TRP 36 H TRP 36 -2.239 18.954 0.118
276 HA TRP 36 HA TRP 36 -4.859 19.121 -1.029
277 HB2 TRP 36 HB2 TRP 36 -5.188 16.761 -0.435
278 HB3 TRP 36 HB3 TRP 36 -4.616 17.038 1.224
279 HD1 TRP 36 HD1 TRP 36 -7.539 18.165 -1.074
280 HE1 TRP 36 HE1 TRP 36 -9.499 18.779 0.392
281 HE3 TRP 36 HE3 TRP 36 -5.336 17.587 3.583
282 HZ2 TRP 36 HZ2 TRP 36 -10.115 19.044 3.050
283 HZ3 TRP 36 HZ3 TRP 36 -6.747 18.090 5.591
284 HH2 TRP 36 HH2 TRP 36 -9.100 18.805 5.326
285 H LYS 37 H LYS 37 -3.364 18.863 2.356
286 HA LYS 37 HA LYS 37 -5.024 21.075 3.217
287 HB2 LYS 37 HB2 LYS 37 -4.204 19.384 4.804
288 HB3 LYS 37 HB3 LYS 37 -2.530 19.905 4.578
289 HG2 LYS 37 HG2 LYS 37 -4.816 21.634 5.731
290 HG3 LYS 37 HG3 LYS 37 -3.572 20.767 6.665
291 HD2 LYS 37 HD2 LYS 37 -1.784 22.183 5.463
292 HD3 LYS 37 HD3 LYS 37 -3.120 23.189 4.828
293 HE2 LYS 37 HE2 LYS 37 -3.897 23.672 7.149
294 HE3 LYS 37 HE3 LYS 37 -2.513 22.746 7.794
295 HZ1 LYS 37 HZ1 LYS 37 -2.012 25.145 7.750
296 HZ2 LYS 37 HZ2 LYS 37 -2.324 25.226 6.043
297 HZ3 LYS 37 HZ3 LYS 37 -0.968 24.306 6.638
298 H HIS 38 H HIS 38 -1.328 20.884 2.818
299 HA HIS 38 HA HIS 38 -1.156 23.712 2.922
300 HB2 HIS 38 HB2 HIS 38 0.829 22.226 3.275
301 HB3 HIS 38 HB3 HIS 38 0.835 21.801 1.541
302 HD1 HIS 38 HD1 HIS 38 1.224 23.866 -0.117
303 HD2 HIS 38 HD2 HIS 38 1.899 24.604 3.967
304 HE1 HIS 38 HE1 HIS 38 2.551 26.019 -0.018
305 H ASN 39 H ASN 39 -1.510 21.379 0.157
306 HA ASN 39 HA ASN 39 -1.116 22.965 -2.013
307 HB2 ASN 39 HB2 ASN 39 -2.013 20.613 -2.080
308 HB3 ASN 39 HB3 ASN 39 -3.609 21.222 -1.561
309 HD21 ASN 39 HD21 ASN 39 -4.018 19.857 -3.696
310 HD22 ASN 39 HD22 ASN 39 -4.004 20.782 -5.153
311 H ILE 40 H ILE 40 -4.006 23.245 0.240
312 HA ILE 40 HA ILE 40 -5.414 25.043 -1.433
313 HB ILE 40 HB ILE 40 -5.408 25.240 1.626
314 HG12 ILE 40 HG12 ILE 40 -6.094 22.992 1.348
315 HG13 ILE 40 HG13 ILE 40 -7.596 23.897 1.465
316 HG21 ILE 40 HG21 ILE 40 -7.470 26.172 -0.464
317 HG22 ILE 40 HG22 ILE 40 -7.637 26.308 1.308
318 HG23 ILE 40 HG23 ILE 40 -6.373 27.225 0.466
319 HD11 ILE 40 HD11 ILE 40 -6.348 22.797 -1.140
320 HD12 ILE 40 HD12 ILE 40 -7.793 22.195 -0.297
321 HD13 ILE 40 HD13 ILE 40 -7.830 23.801 -1.074
322 H THR 41 H THR 41 -3.042 25.851 1.292
323 HA THR 41 HA THR 41 -3.254 28.622 0.613
324 HB THR 41 HB THR 41 -2.548 27.840 2.870
325 HG1 THR 41 HG1 THR 41 -0.859 29.772 1.599
326 HG21 THR 41 HG21 THR 41 -0.127 27.461 3.328
327 HG22 THR 41 HG22 THR 41 0.236 27.438 1.583
328 HG23 THR 41 HG23 THR 41 -0.768 26.150 2.313
329 H GLN 42 H GLN 42 -0.893 26.034 -0.411
330 HA GLN 42 HA GLN 42 0.802 26.136 -1.980
331 HB2 GLN 42 HB2 GLN 42 -1.270 26.403 -3.388
332 HB3 GLN 42 HB3 GLN 42 -1.094 28.174 -3.307
333 HG2 GLN 42 HG2 GLN 42 1.182 27.993 -4.395
334 HG3 GLN 42 HG3 GLN 42 0.982 26.226 -4.511
335 HE21 GLN 42 HE21 GLN 42 -1.167 25.476 -5.713
336 HE22 GLN 42 HE22 GLN 42 -1.603 26.427 -7.083
Start of MODEL 6
1 H1 TYR 1 H1 TYR 1 -6.220 -3.101 9.833
2 HA TYR 1 HA TYR 1 -4.383 -4.764 9.907
3 HB2 TYR 1 HB2 TYR 1 -6.446 -6.269 11.637
4 HB3 TYR 1 HB3 TYR 1 -4.850 -6.903 11.167
5 HD1 TYR 1 HD2 TYR 1 -2.754 -5.850 12.058
6 HD2 TYR 1 HD1 TYR 1 -6.621 -4.468 13.345
7 HE1 TYR 1 HE2 TYR 1 -1.696 -4.654 13.932
8 HE2 TYR 1 HE1 TYR 1 -5.557 -3.261 15.223
9 HH TYR 1 HH TYR 1 -2.035 -3.205 15.801
10 H ALA 2 H ALA 2 -4.437 -6.922 8.617
11 HA ALA 2 HA ALA 2 -6.728 -6.748 6.672
12 HB1 ALA 2 HB1 ALA 2 -4.420 -6.416 5.780
13 HB2 ALA 2 HB2 ALA 2 -3.949 -8.025 6.401
14 HB3 ALA 2 HB3 ALA 2 -5.196 -7.884 5.121
15 H GLU 3 H GLU 3 -7.937 -7.834 8.671
16 HA GLU 3 HA GLU 3 -7.245 -10.521 9.308
17 HB2 GLU 3 HB2 GLU 3 -8.827 -9.182 10.694
18 HB3 GLU 3 HB3 GLU 3 -10.015 -9.179 9.363
19 HG2 GLU 3 HG2 GLU 3 -10.239 -11.687 9.540
20 HG3 GLU 3 HG3 GLU 3 -9.009 -11.708 10.830
21 H GLY 4 H GLY 4 -8.013 -12.583 8.304
22 HA2 GLY 4 HA2 GLY 4 -9.395 -13.761 6.781
23 HA3 GLY 4 HA3 GLY 4 -9.777 -12.280 5.902
24 H THR 5 H THR 5 -6.919 -11.295 5.628
25 HA THR 5 HA THR 5 -6.363 -12.852 3.251
26 HB THR 5 HB THR 5 -4.290 -11.555 3.047
27 HG1 THR 5 HG1 THR 5 -3.782 -10.030 4.779
28 HG21 THR 5 HG21 THR 5 -6.446 -10.501 2.263
29 HG22 THR 5 HG22 THR 5 -5.258 -9.282 2.801
30 HG23 THR 5 HG23 THR 5 -6.636 -9.704 3.851
31 H PHE 6 H PHE 6 -4.731 -12.504 6.548
32 HA PHE 6 HA PHE 6 -2.801 -14.484 5.988
33 HB2 PHE 6 HB2 PHE 6 -2.361 -14.703 8.331
34 HB3 PHE 6 HB3 PHE 6 -2.742 -12.994 8.051
35 HD1 PHE 6 HD2 PHE 6 -4.025 -16.264 9.366
36 HD2 PHE 6 HD1 PHE 6 -4.814 -12.037 9.084
37 HE1 PHE 6 HE2 PHE 6 -5.737 -16.464 11.135
38 HE2 PHE 6 HE1 PHE 6 -6.469 -12.237 10.914
39 HZ PHE 6 HZ PHE 6 -6.966 -14.449 11.915
40 H ILE 7 H ILE 7 -6.279 -14.825 6.987
41 HA ILE 7 HA ILE 7 -6.015 -17.606 7.645
42 HB ILE 7 HB ILE 7 -8.471 -16.124 6.561
43 HG12 ILE 7 HG12 ILE 7 -7.674 -16.976 9.424
44 HG13 ILE 7 HG13 ILE 7 -7.643 -15.308 8.801
45 HG21 ILE 7 HG21 ILE 7 -9.787 -18.120 7.282
46 HG22 ILE 7 HG22 ILE 7 -8.594 -18.585 6.067
47 HG23 ILE 7 HG23 ILE 7 -8.279 -18.940 7.789
48 HD11 ILE 7 HD11 ILE 7 -10.150 -17.004 9.312
49 HD12 ILE 7 HD12 ILE 7 -9.629 -15.522 10.141
50 HD13 ILE 7 HD13 ILE 7 -10.165 -15.441 8.440
51 H SER 8 H SER 8 -6.870 -15.892 4.496
52 HA SER 8 HA SER 8 -7.058 -18.383 3.092
53 HB2 SER 8 HB2 SER 8 -8.126 -16.385 2.178
54 HB3 SER 8 HB3 SER 8 -6.549 -15.562 1.984
55 HG SER 8 HG SER 8 -7.207 -16.674 -0.012
56 H ASP 9 H ASP 9 -4.373 -15.867 2.980
57 HA ASP 9 HA ASP 9 -2.814 -17.727 1.335
58 HB2 ASP 9 HB2 ASP 9 -2.007 -15.021 2.536
59 HB3 ASP 9 HB3 ASP 9 -1.200 -15.887 1.201
60 H TYR 10 H TYR 10 -2.791 -16.698 4.796
61 HA TYR 10 HA TYR 10 -1.467 -17.392 6.540
62 HB2 TYR 10 HB2 TYR 10 -0.250 -19.554 4.753
63 HB3 TYR 10 HB3 TYR 10 -0.196 -19.412 6.511
64 HD1 TYR 10 HD1 TYR 10 -2.385 -19.469 7.834
65 HD2 TYR 10 HD2 TYR 10 -2.284 -20.395 3.631
66 HE1 TYR 10 HE1 TYR 10 -4.563 -20.596 8.033
67 HE2 TYR 10 HE2 TYR 10 -4.458 -21.545 3.839
68 HH TYR 10 HH TYR 10 -6.268 -21.828 6.902
69 H SER 11 H SER 11 0.954 -17.725 3.759
70 HA SER 11 HA SER 11 2.074 -15.137 4.519
71 HB2 SER 11 HB2 SER 11 2.827 -16.568 6.460
72 HB3 SER 11 HB3 SER 11 3.574 -17.707 5.299
73 HG SER 11 HG SER 11 5.118 -16.056 6.086
74 H ILE 12 H ILE 12 1.245 -15.611 2.046
75 HA ILE 12 HA ILE 12 3.862 -15.875 0.615
76 HB ILE 12 HB ILE 12 1.289 -17.317 -0.224
77 HG12 ILE 12 HG12 ILE 12 4.011 -18.389 0.710
78 HG13 ILE 12 HG13 ILE 12 2.457 -18.489 1.580
79 HG21 ILE 12 HG21 ILE 12 2.577 -16.238 -2.153
80 HG22 ILE 12 HG22 ILE 12 4.022 -17.154 -1.647
81 HG23 ILE 12 HG23 ILE 12 2.564 -18.003 -2.240
82 HD11 ILE 12 HD11 ILE 12 2.850 -20.650 0.570
83 HD12 ILE 12 HD12 ILE 12 1.514 -19.881 -0.334
84 HD13 ILE 12 HD13 ILE 12 3.165 -19.948 -1.030
85 H ALA 13 H ALA 13 0.409 -15.220 -0.506
86 HA ALA 13 HA ALA 13 1.458 -12.945 -1.964
87 HB1 ALA 13 HB1 ALA 13 -1.469 -13.711 -1.370
88 HB2 ALA 13 HB2 ALA 13 -0.909 -12.496 -2.555
89 HB3 ALA 13 HB3 ALA 13 -0.521 -14.226 -2.795
90 H MET 14 H MET 14 -0.549 -13.404 1.093
91 HA MET 14 HA MET 14 -1.119 -10.709 1.423
92 HB2 MET 14 HB2 MET 14 -1.638 -11.093 3.726
93 HB3 MET 14 HB3 MET 14 -2.051 -12.576 2.851
94 HG2 MET 14 HG2 MET 14 -1.002 -13.262 4.905
95 HG3 MET 14 HG3 MET 14 0.267 -13.517 3.680
96 HE1 MET 14 HE1 MET 14 0.301 -13.055 7.071
97 HE2 MET 14 HE2 MET 14 1.846 -13.460 6.246
98 HE3 MET 14 HE3 MET 14 1.742 -12.014 7.295
99 H ASP 15 H ASP 15 1.982 -12.448 2.217
100 HA ASP 15 HA ASP 15 3.069 -10.268 3.721
101 HB2 ASP 15 HB2 ASP 15 4.097 -12.546 3.724
102 HB3 ASP 15 HB3 ASP 15 4.538 -12.368 2.007
103 H LYS 16 H LYS 16 3.151 -11.092 0.166
104 HA LYS 16 HA LYS 16 4.948 -8.909 -0.451
105 HB2 LYS 16 HB2 LYS 16 2.961 -10.409 -2.263
106 HB3 LYS 16 HB3 LYS 16 4.197 -9.255 -2.833
107 HG2 LYS 16 HG2 LYS 16 6.025 -10.695 -1.940
108 HG3 LYS 16 HG3 LYS 16 4.841 -11.856 -1.292
109 HD2 LYS 16 HD2 LYS 16 3.976 -12.278 -3.628
110 HD3 LYS 16 HD3 LYS 16 5.230 -11.177 -4.268
111 HE2 LYS 16 HE2 LYS 16 7.017 -12.675 -3.292
112 HE3 LYS 16 HE3 LYS 16 5.751 -13.768 -2.664
113 HZ1 LYS 16 HZ1 LYS 16 6.241 -13.132 -5.594
114 HZ2 LYS 16 HZ2 LYS 16 4.994 -14.189 -4.984
115 HZ3 LYS 16 HZ3 LYS 16 6.669 -14.608 -4.777
116 H ILE 17 H ILE 17 1.317 -9.291 -0.477
117 HA ILE 17 HA ILE 17 0.879 -6.685 -1.623
118 HB ILE 17 HB ILE 17 -0.942 -8.355 0.210
119 HG12 ILE 17 HG12 ILE 17 -0.523 -9.559 -1.923
120 HG13 ILE 17 HG13 ILE 17 -2.199 -9.008 -1.795
121 HG21 ILE 17 HG21 ILE 17 -1.567 -5.801 -1.377
122 HG22 ILE 17 HG22 ILE 17 -2.813 -6.871 -0.673
123 HG23 ILE 17 HG23 ILE 17 -1.661 -6.031 0.386
124 HD11 ILE 17 HD11 ILE 17 -1.686 -7.107 -3.390
125 HD12 ILE 17 HD12 ILE 17 0.002 -7.692 -3.526
126 HD13 ILE 17 HD13 ILE 17 -1.342 -8.708 -4.088
127 H HIS 18 H HIS 18 1.054 -7.910 1.812
128 HA HIS 18 HA HIS 18 0.412 -5.379 2.945
129 HB2 HIS 18 HB2 HIS 18 2.170 -7.625 4.105
130 HB3 HIS 18 HB3 HIS 18 1.537 -6.238 5.025
131 HD1 HIS 18 HD1 HIS 18 0.704 -8.606 6.234
132 HD2 HIS 18 HD2 HIS 18 -1.365 -7.161 2.865
133 HE1 HIS 18 HE1 HIS 18 -1.594 -9.657 6.325
134 H GLN 19 H GLN 19 3.685 -6.879 2.214
135 HA GLN 19 HA GLN 19 5.292 -4.855 3.129
136 HB2 GLN 19 HB2 GLN 19 6.215 -6.886 2.091
137 HB3 GLN 19 HB3 GLN 19 5.630 -6.376 0.484
138 HG2 GLN 19 HG2 GLN 19 7.153 -4.375 0.554
139 HG3 GLN 19 HG3 GLN 19 7.702 -4.849 2.185
140 HE21 GLN 19 HE21 GLN 19 9.818 -4.592 0.670
141 HE22 GLN 19 HE22 GLN 19 10.355 -6.079 -0.021
142 H GLN 20 H GLN 20 3.617 -4.888 -0.124
143 HA GLN 20 HA GLN 20 4.753 -2.267 -0.756
144 HB2 GLN 20 HB2 GLN 20 2.540 -3.919 -2.107
145 HB3 GLN 20 HB3 GLN 20 3.160 -2.363 -2.723
146 HG2 GLN 20 HG2 GLN 20 5.469 -3.298 -2.894
147 HG3 GLN 20 HG3 GLN 20 4.907 -4.868 -2.253
148 HE21 GLN 20 HE21 GLN 20 6.183 -5.184 -4.553
149 HE22 GLN 20 HE22 GLN 20 5.094 -5.365 -5.877
150 H ASP 21 H ASP 21 1.467 -3.441 0.378
151 HA ASP 21 HA ASP 21 0.292 -0.903 -0.099
152 HB2 ASP 21 HB2 ASP 21 -0.666 -3.116 1.792
153 HB3 ASP 21 HB3 ASP 21 -1.588 -1.651 1.352
154 H PHE 22 H PHE 22 1.322 -2.288 3.225
155 HA PHE 22 HA PHE 22 0.632 0.162 4.442
156 HB2 PHE 22 HB2 PHE 22 2.044 -0.378 6.371
157 HB3 PHE 22 HB3 PHE 22 1.000 -1.729 5.893
158 HD1 PHE 22 HD1 PHE 22 4.541 -0.419 5.658
159 HD2 PHE 22 HD2 PHE 22 1.993 -3.867 5.356
160 HE1 PHE 22 HE1 PHE 22 6.519 -1.894 5.816
161 HE2 PHE 22 HE2 PHE 22 3.982 -5.341 5.434
162 HZ PHE 22 HZ PHE 22 6.247 -4.360 5.703
163 H VAL 23 H VAL 23 3.713 -0.809 2.801
164 HA VAL 23 HA VAL 23 5.172 1.526 3.554
165 HB VAL 23 HB VAL 23 5.265 -0.255 1.059
166 HG11 VAL 23 HG11 VAL 23 7.082 2.154 1.628
167 HG12 VAL 23 HG12 VAL 23 7.389 0.892 0.397
168 HG13 VAL 23 HG13 VAL 23 5.974 1.955 0.234
169 HG21 VAL 23 HG21 VAL 23 7.400 -1.042 2.076
170 HG22 VAL 23 HG22 VAL 23 7.286 0.196 3.360
171 HG23 VAL 23 HG23 VAL 23 6.117 -1.145 3.306
172 H ASN 24 H ASN 24 2.912 0.990 0.726
173 HA ASN 24 HA ASN 24 3.267 3.598 -0.327
174 HB2 ASN 24 HB2 ASN 24 0.730 1.854 -0.436
175 HB3 ASN 24 HB3 ASN 24 1.071 3.271 -1.462
176 HD21 ASN 24 HD21 ASN 24 0.531 1.077 -2.913
177 HD22 ASN 24 HD22 ASN 24 1.976 0.380 -3.548
178 H TRP 25 H TRP 25 0.805 2.364 2.096
179 HA TRP 25 HA TRP 25 -0.568 4.850 2.282
180 HB2 TRP 25 HB2 TRP 25 -1.637 2.899 3.279
181 HB3 TRP 25 HB3 TRP 25 -0.213 2.570 4.295
182 HD1 TRP 25 HD1 TRP 25 -2.374 5.814 3.909
183 HE1 TRP 25 HE1 TRP 25 -2.919 6.654 6.220
184 HE3 TRP 25 HE3 TRP 25 -0.106 2.096 6.738
185 HZ2 TRP 25 HZ2 TRP 25 -2.495 5.981 8.841
186 HZ3 TRP 25 HZ3 TRP 25 -0.185 2.348 9.223
187 HH2 TRP 25 HH2 TRP 25 -1.331 4.279 10.259
188 H LEU 26 H LEU 26 2.125 3.498 4.367
189 HA LEU 26 HA LEU 26 2.084 5.632 6.183
190 HB2 LEU 26 HB2 LEU 26 4.429 3.887 5.286
191 HB3 LEU 26 HB3 LEU 26 4.571 5.049 6.625
192 HG LEU 26 HG LEU 26 2.534 2.735 6.651
193 HD11 LEU 26 HD11 LEU 26 4.128 1.591 8.196
194 HD12 LEU 26 HD12 LEU 26 5.306 2.922 7.989
195 HD13 LEU 26 HD13 LEU 26 4.886 1.869 6.608
196 HD21 LEU 26 HD21 LEU 26 2.478 3.225 9.135
197 HD22 LEU 26 HD22 LEU 26 1.843 4.580 8.192
198 HD23 LEU 26 HD23 LEU 26 3.497 4.663 8.857
199 H LEU 27 H LEU 27 3.864 5.446 3.024
200 HA LEU 27 HA LEU 27 5.090 8.048 3.609
201 HB2 LEU 27 HB2 LEU 27 6.242 7.898 1.532
202 HB3 LEU 27 HB3 LEU 27 6.264 6.320 2.343
203 HG LEU 27 HG LEU 27 4.185 5.789 0.713
204 HD11 LEU 27 HD11 LEU 27 5.652 7.958 -0.921
205 HD12 LEU 27 HD12 LEU 27 4.018 8.163 -0.254
206 HD13 LEU 27 HD13 LEU 27 4.313 6.921 -1.485
207 HD21 LEU 27 HD21 LEU 27 7.081 5.906 -0.298
208 HD22 LEU 27 HD22 LEU 27 5.772 4.913 -1.006
209 HD23 LEU 27 HD23 LEU 27 6.346 4.576 0.644
210 H ALA 28 H ALA 28 2.164 6.890 1.792
211 HA ALA 28 HA ALA 28 1.953 9.449 0.406
212 HB1 ALA 28 HB1 ALA 28 -0.141 8.506 -0.529
213 HB2 ALA 28 HB2 ALA 28 1.220 7.357 -0.669
214 HB3 ALA 28 HB3 ALA 28 -0.012 7.118 0.593
215 H GLN 29 H GLN 29 -0.106 7.840 3.027
216 HA GLN 29 HA GLN 29 -1.366 8.864 4.691
217 HB2 GLN 29 HB2 GLN 29 0.525 11.232 4.212
218 HB3 GLN 29 HB3 GLN 29 -0.435 10.914 5.679
219 HG2 GLN 29 HG2 GLN 29 1.702 8.971 4.613
220 HG3 GLN 29 HG3 GLN 29 2.069 10.277 5.750
221 HE21 GLN 29 HE21 GLN 29 0.201 7.147 5.479
222 HE22 GLN 29 HE22 GLN 29 0.037 6.986 7.186
223 H LYS 30 H LYS 30 -1.652 12.216 4.045
224 HA LYS 30 HA LYS 30 -4.273 12.002 3.224
225 HB2 LYS 30 HB2 LYS 30 -3.343 14.180 3.850
226 HB3 LYS 30 HB3 LYS 30 -2.182 14.130 2.498
227 HG2 LYS 30 HG2 LYS 30 -4.009 15.704 2.027
228 HG3 LYS 30 HG3 LYS 30 -4.012 14.387 0.834
229 HD2 LYS 30 HD2 LYS 30 -5.949 13.312 1.953
230 HD3 LYS 30 HD3 LYS 30 -5.864 14.473 3.306
231 HE2 LYS 30 HE2 LYS 30 -6.442 16.342 1.762
232 HE3 LYS 30 HE3 LYS 30 -6.438 15.233 0.368
233 HZ1 LYS 30 HZ1 LYS 30 -8.725 15.647 1.167
234 HZ2 LYS 30 HZ2 LYS 30 -8.311 15.061 2.750
235 HZ3 LYS 30 HZ3 LYS 30 -8.309 13.973 1.380
236 H GLY 31 H GLY 31 -1.258 11.933 1.126
237 HA2 GLY 31 HA2 GLY 31 -2.464 11.986 -1.362
238 HA3 GLY 31 HA3 GLY 31 -1.060 10.951 -0.990
239 H LYS 32 H LYS 32 -2.195 9.062 0.862
240 HA LYS 32 HA LYS 32 -3.375 7.313 -1.038
241 HB2 LYS 32 HB2 LYS 32 -2.191 6.408 0.953
242 HB3 LYS 32 HB3 LYS 32 -3.382 7.134 2.034
243 HG2 LYS 32 HG2 LYS 32 -3.804 4.734 1.818
244 HG3 LYS 32 HG3 LYS 32 -5.170 5.657 1.155
245 HD2 LYS 32 HD2 LYS 32 -4.679 3.709 -0.248
246 HD3 LYS 32 HD3 LYS 32 -4.355 5.178 -1.190
247 HE2 LYS 32 HE2 LYS 32 -1.915 4.918 -0.890
248 HE3 LYS 32 HE3 LYS 32 -2.161 3.557 0.243
249 HZ1 LYS 32 HZ1 LYS 32 -3.162 2.243 -1.586
250 HZ2 LYS 32 HZ2 LYS 32 -1.579 2.796 -2.036
251 HZ3 LYS 32 HZ3 LYS 32 -2.986 3.587 -2.684
252 H LYS 33 H LYS 33 -4.842 9.065 1.842
253 HA LYS 33 HA LYS 33 -7.471 8.199 1.461
254 HB2 LYS 33 HB2 LYS 33 -6.899 9.475 3.436
255 HB3 LYS 33 HB3 LYS 33 -6.387 10.879 2.476
256 HG2 LYS 33 HG2 LYS 33 -8.763 11.224 1.691
257 HG3 LYS 33 HG3 LYS 33 -9.275 9.857 2.720
258 HD2 LYS 33 HD2 LYS 33 -8.465 11.081 4.753
259 HD3 LYS 33 HD3 LYS 33 -7.886 12.425 3.729
260 HE2 LYS 33 HE2 LYS 33 -10.247 12.835 2.933
261 HE3 LYS 33 HE3 LYS 33 -10.818 11.518 3.997
262 HZ1 LYS 33 HZ1 LYS 33 -9.954 12.786 5.955
263 HZ2 LYS 33 HZ2 LYS 33 -11.130 13.707 5.055
264 HZ3 LYS 33 HZ3 LYS 33 -9.439 14.076 4.902
265 H ASN 34 H ASN 34 -5.948 11.227 0.111
266 HA ASN 34 HA ASN 34 -8.081 12.107 -1.416
267 HB2 ASN 34 HB2 ASN 34 -5.882 13.340 -1.142
268 HB3 ASN 34 HB3 ASN 34 -5.098 12.157 -2.210
269 HD21 ASN 34 HD21 ASN 34 -7.788 14.646 -2.091
270 HD22 ASN 34 HD22 ASN 34 -7.702 15.013 -3.773
271 H ASP 35 H ASP 35 -5.615 9.533 -2.296
272 HA ASP 35 HA ASP 35 -7.098 9.134 -4.885
273 HB2 ASP 35 HB2 ASP 35 -4.648 9.611 -4.985
274 HB3 ASP 35 HB3 ASP 35 -4.335 8.176 -3.976
275 H TRP 36 H TRP 36 -8.393 8.201 -2.367
276 HA TRP 36 HA TRP 36 -8.792 5.508 -3.313
277 HB2 TRP 36 HB2 TRP 36 -6.596 5.439 -1.871
278 HB3 TRP 36 HB3 TRP 36 -7.641 5.514 -0.450
279 HD1 TRP 36 HD1 TRP 36 -6.118 3.138 -2.822
280 HE1 TRP 36 HE1 TRP 36 -7.115 0.840 -2.628
281 HE3 TRP 36 HE3 TRP 36 -10.303 4.243 0.051
282 HZ2 TRP 36 HZ2 TRP 36 -9.304 -0.405 -1.565
283 HZ3 TRP 36 HZ3 TRP 36 -11.817 2.342 0.634
284 HH2 TRP 36 HH2 TRP 36 -11.328 0.052 -0.165
285 H LYS 37 H LYS 37 -9.105 7.316 -0.118
286 HA LYS 37 HA LYS 37 -12.026 6.623 -0.160
287 HB2 LYS 37 HB2 LYS 37 -10.663 5.978 1.834
288 HB3 LYS 37 HB3 LYS 37 -10.277 7.680 2.143
289 HG2 LYS 37 HG2 LYS 37 -13.107 6.437 2.058
290 HG3 LYS 37 HG3 LYS 37 -12.185 6.793 3.539
291 HD2 LYS 37 HD2 LYS 37 -12.146 9.254 2.883
292 HD3 LYS 37 HD3 LYS 37 -13.277 8.880 1.546
293 HE2 LYS 37 HE2 LYS 37 -13.859 8.452 4.532
294 HE3 LYS 37 HE3 LYS 37 -14.453 9.784 3.508
295 HZ1 LYS 37 HZ1 LYS 37 -15.170 6.845 3.245
296 HZ2 LYS 37 HZ2 LYS 37 -15.564 8.052 2.047
297 HZ3 LYS 37 HZ3 LYS 37 -16.209 8.162 3.654
298 H HIS 38 H HIS 38 -12.613 8.245 -1.793
299 HA HIS 38 HA HIS 38 -12.453 11.028 -0.843
300 HB2 HIS 38 HB2 HIS 38 -10.193 10.669 -1.799
301 HB3 HIS 38 HB3 HIS 38 -10.898 10.029 -3.298
302 HD1 HIS 38 HD1 HIS 38 -9.520 11.874 -4.459
303 HD2 HIS 38 HD2 HIS 38 -12.584 13.288 -1.945
304 HE1 HIS 38 HE1 HIS 38 -9.857 14.290 -5.085
305 H ASN 39 H ASN 39 -13.030 9.114 -3.962
306 HA ASN 39 HA ASN 39 -14.796 10.652 -5.227
307 HB2 ASN 39 HB2 ASN 39 -16.063 8.639 -5.959
308 HB3 ASN 39 HB3 ASN 39 -14.325 8.288 -5.931
309 HD21 ASN 39 HD21 ASN 39 -13.513 6.729 -4.205
310 HD22 ASN 39 HD22 ASN 39 -14.650 5.838 -3.270
311 H ILE 40 H ILE 40 -15.657 8.925 -2.123
312 HA ILE 40 HA ILE 40 -18.446 9.387 -2.334
313 HB ILE 40 HB ILE 40 -16.701 9.312 0.190
314 HG12 ILE 40 HG12 ILE 40 -16.625 7.132 -0.973
315 HG13 ILE 40 HG13 ILE 40 -17.548 7.026 0.532
316 HG21 ILE 40 HG21 ILE 40 -18.922 8.856 1.400
317 HG22 ILE 40 HG22 ILE 40 -18.696 10.521 0.819
318 HG23 ILE 40 HG23 ILE 40 -19.760 9.411 -0.078
319 HD11 ILE 40 HD11 ILE 40 -18.708 7.063 -2.330
320 HD12 ILE 40 HD12 ILE 40 -18.701 5.721 -1.168
321 HD13 ILE 40 HD13 ILE 40 -19.713 7.149 -0.853
322 H THR 41 H THR 41 -15.915 11.488 -0.676
323 HA THR 41 HA THR 41 -17.830 13.630 -0.357
324 HB THR 41 HB THR 41 -14.754 13.629 -0.348
325 HG1 THR 41 HG1 THR 41 -15.950 12.810 1.557
326 HG21 THR 41 HG21 THR 41 -15.435 15.845 -1.239
327 HG22 THR 41 HG22 THR 41 -14.940 16.000 0.466
328 HG23 THR 41 HG23 THR 41 -16.678 16.000 0.041
329 H GLN 42 H GLN 42 -15.110 13.101 -2.769
330 HA GLN 42 HA GLN 42 -16.275 15.240 -4.430
331 HB2 GLN 42 HB2 GLN 42 -13.813 15.011 -4.177
332 HB3 GLN 42 HB3 GLN 42 -13.871 13.383 -4.909
333 HG2 GLN 42 HG2 GLN 42 -13.156 15.136 -6.558
334 HG3 GLN 42 HG3 GLN 42 -14.655 14.333 -7.066
335 HE21 GLN 42 HE21 GLN 42 -16.662 15.654 -7.181
336 HE22 GLN 42 HE22 GLN 42 -16.606 17.354 -6.905
Start of MODEL 7
1 H1 TYR 1 H1 TYR 1 -11.628 -9.790 -5.863
2 HA TYR 1 HA TYR 1 -10.794 -7.500 -5.331
3 HB2 TYR 1 HB2 TYR 1 -13.752 -7.121 -4.523
4 HB3 TYR 1 HB3 TYR 1 -12.501 -5.859 -4.471
5 HD1 TYR 1 HD1 TYR 1 -11.264 -5.295 -6.707
6 HD2 TYR 1 HD2 TYR 1 -15.016 -7.402 -6.573
7 HE1 TYR 1 HE1 TYR 1 -11.669 -4.716 -9.068
8 HE2 TYR 1 HE2 TYR 1 -15.439 -6.786 -8.927
9 HH TYR 1 HH TYR 1 -13.082 -5.079 -10.978
10 H ALA 2 H ALA 2 -10.786 -6.566 -2.866
11 HA ALA 2 HA ALA 2 -10.082 -8.586 -1.138
12 HB1 ALA 2 HB1 ALA 2 -10.642 -7.058 0.783
13 HB2 ALA 2 HB2 ALA 2 -9.725 -6.223 -0.505
14 HB3 ALA 2 HB3 ALA 2 -11.484 -5.954 -0.344
15 H GLU 3 H GLU 3 -13.434 -7.069 -1.368
16 HA GLU 3 HA GLU 3 -14.586 -8.670 0.589
17 HB2 GLU 3 HB2 GLU 3 -15.845 -6.816 -0.442
18 HB3 GLU 3 HB3 GLU 3 -15.877 -7.661 -2.013
19 HG2 GLU 3 HG2 GLU 3 -18.061 -7.902 -0.805
20 HG3 GLU 3 HG3 GLU 3 -17.294 -9.487 -1.044
21 H GLY 4 H GLY 4 -15.023 -10.990 0.665
22 HA2 GLY 4 HA2 GLY 4 -15.774 -13.001 -0.312
23 HA3 GLY 4 HA3 GLY 4 -15.489 -12.356 -1.936
24 H THR 5 H THR 5 -12.746 -11.546 -1.886
25 HA THR 5 HA THR 5 -11.582 -14.197 -2.052
26 HB THR 5 HB THR 5 -9.439 -12.986 -2.551
27 HG1 THR 5 HG1 THR 5 -9.632 -10.620 -2.638
28 HG21 THR 5 HG21 THR 5 -11.924 -12.027 -4.134
29 HG22 THR 5 HG22 THR 5 -11.017 -13.540 -4.406
30 HG23 THR 5 HG23 THR 5 -10.239 -11.964 -4.720
31 H PHE 6 H PHE 6 -11.334 -11.404 0.360
32 HA PHE 6 HA PHE 6 -9.305 -12.635 1.845
33 HB2 PHE 6 HB2 PHE 6 -9.849 -11.339 3.749
34 HB3 PHE 6 HB3 PHE 6 -10.235 -10.307 2.359
35 HD1 PHE 6 HD2 PHE 6 -11.632 -12.553 5.030
36 HD2 PHE 6 HD1 PHE 6 -12.590 -9.557 2.094
37 HE1 PHE 6 HE2 PHE 6 -13.893 -12.332 5.989
38 HE2 PHE 6 HE1 PHE 6 -14.887 -9.410 3.000
39 HZ PHE 6 HZ PHE 6 -15.547 -10.797 4.948
40 H ILE 7 H ILE 7 -12.865 -13.310 1.667
41 HA ILE 7 HA ILE 7 -12.897 -15.000 3.987
42 HB ILE 7 HB ILE 7 -14.747 -15.117 1.540
43 HG12 ILE 7 HG12 ILE 7 -15.167 -13.824 4.304
44 HG13 ILE 7 HG13 ILE 7 -14.826 -12.932 2.797
45 HG21 ILE 7 HG21 ILE 7 -14.690 -17.299 2.826
46 HG22 ILE 7 HG22 ILE 7 -15.112 -16.404 4.313
47 HG23 ILE 7 HG23 ILE 7 -16.258 -16.499 2.944
48 HD11 ILE 7 HD11 ILE 7 -16.974 -13.866 1.799
49 HD12 ILE 7 HD12 ILE 7 -17.386 -14.498 3.424
50 HD13 ILE 7 HD13 ILE 7 -17.187 -12.750 3.178
51 H SER 8 H SER 8 -12.523 -15.726 0.386
52 HA SER 8 HA SER 8 -12.075 -18.556 1.130
53 HB2 SER 8 HB2 SER 8 -13.565 -18.048 -0.742
54 HB3 SER 8 HB3 SER 8 -12.255 -17.248 -1.643
55 HG SER 8 HG SER 8 -11.169 -19.382 -1.597
56 H ASP 9 H ASP 9 -10.231 -16.125 -0.949
57 HA ASP 9 HA ASP 9 -7.960 -17.936 -0.948
58 HB2 ASP 9 HB2 ASP 9 -8.037 -14.983 -1.791
59 HB3 ASP 9 HB3 ASP 9 -6.797 -16.187 -2.226
60 H TYR 10 H TYR 10 -8.965 -15.173 1.153
61 HA TYR 10 HA TYR 10 -7.926 -14.233 2.965
62 HB2 TYR 10 HB2 TYR 10 -5.940 -16.552 2.985
63 HB3 TYR 10 HB3 TYR 10 -6.215 -15.337 4.237
64 HD1 TYR 10 HD2 TYR 10 -8.501 -15.189 5.356
65 HD2 TYR 10 HD1 TYR 10 -7.518 -18.395 2.659
66 HE1 TYR 10 HE2 TYR 10 -10.459 -16.471 6.156
67 HE2 TYR 10 HE1 TYR 10 -9.435 -19.692 3.497
68 HH TYR 10 HH TYR 10 -11.338 -19.708 4.940
69 H SER 11 H SER 11 -4.981 -15.422 1.128
70 HA SER 11 HA SER 11 -4.517 -12.707 0.154
71 HB2 SER 11 HB2 SER 11 -2.911 -13.782 2.546
72 HB3 SER 11 HB3 SER 11 -2.341 -12.458 1.489
73 HG SER 11 HG SER 11 -4.289 -11.291 2.214
74 H ILE 12 H ILE 12 -2.602 -15.699 1.138
75 HA ILE 12 HA ILE 12 -1.379 -17.106 -0.160
76 HB ILE 12 HB ILE 12 -2.112 -15.647 -2.731
77 HG12 ILE 12 HG12 ILE 12 -4.254 -16.224 -1.722
78 HG13 ILE 12 HG13 ILE 12 -3.895 -17.368 -3.030
79 HG21 ILE 12 HG21 ILE 12 -0.161 -17.121 -2.878
80 HG22 ILE 12 HG22 ILE 12 -1.063 -18.480 -2.169
81 HG23 ILE 12 HG23 ILE 12 -1.537 -17.828 -3.760
82 HD11 ILE 12 HD11 ILE 12 -3.650 -17.924 0.004
83 HD12 ILE 12 HD12 ILE 12 -4.891 -18.549 -1.106
84 HD13 ILE 12 HD13 ILE 12 -3.205 -19.094 -1.276
85 H ALA 13 H ALA 13 -1.029 -13.702 -1.579
86 HA ALA 13 HA ALA 13 1.893 -13.956 -0.880
87 HB1 ALA 13 HB1 ALA 13 0.475 -12.072 -2.854
88 HB2 ALA 13 HB2 ALA 13 2.236 -12.227 -2.564
89 HB3 ALA 13 HB3 ALA 13 1.332 -13.577 -3.298
90 H MET 14 H MET 14 0.413 -13.681 1.388
91 HA MET 14 HA MET 14 -0.433 -11.063 1.994
92 HB2 MET 14 HB2 MET 14 -0.126 -11.547 4.353
93 HB3 MET 14 HB3 MET 14 -0.799 -12.994 3.565
94 HG2 MET 14 HG2 MET 14 1.536 -14.036 3.596
95 HG3 MET 14 HG3 MET 14 2.138 -12.578 4.452
96 HE1 MET 14 HE1 MET 14 3.004 -13.958 6.524
97 HE2 MET 14 HE2 MET 14 1.999 -15.145 7.416
98 HE3 MET 14 HE3 MET 14 2.481 -15.477 5.719
99 H ASP 15 H ASP 15 2.934 -12.447 1.987
100 HA ASP 15 HA ASP 15 4.061 -10.251 3.403
101 HB2 ASP 15 HB2 ASP 15 5.382 -12.035 1.262
102 HB3 ASP 15 HB3 ASP 15 6.236 -10.900 2.340
103 H LYS 16 H LYS 16 3.737 -10.856 -0.216
104 HA LYS 16 HA LYS 16 4.993 -8.382 -0.867
105 HB2 LYS 16 HB2 LYS 16 4.785 -10.209 -2.471
106 HB3 LYS 16 HB3 LYS 16 3.003 -9.997 -2.542
107 HG2 LYS 16 HG2 LYS 16 3.332 -7.638 -3.390
108 HG3 LYS 16 HG3 LYS 16 5.091 -7.915 -3.415
109 HD2 LYS 16 HD2 LYS 16 2.943 -9.405 -5.085
110 HD3 LYS 16 HD3 LYS 16 4.054 -8.133 -5.643
111 HE2 LYS 16 HE2 LYS 16 5.266 -9.952 -6.403
112 HE3 LYS 16 HE3 LYS 16 5.948 -9.882 -4.767
113 HZ1 LYS 16 HZ1 LYS 16 5.340 -12.165 -5.378
114 HZ2 LYS 16 HZ2 LYS 16 3.719 -11.693 -5.786
115 HZ3 LYS 16 HZ3 LYS 16 4.230 -11.700 -4.142
116 H ILE 17 H ILE 17 1.467 -9.338 -0.624
117 HA ILE 17 HA ILE 17 0.596 -6.795 -1.612
118 HB ILE 17 HB ILE 17 -0.921 -8.852 0.051
119 HG12 ILE 17 HG12 ILE 17 -0.243 -9.708 -2.214
120 HG13 ILE 17 HG13 ILE 17 -1.996 -9.571 -2.001
121 HG21 ILE 17 HG21 ILE 17 -2.042 -6.723 0.417
122 HG22 ILE 17 HG22 ILE 17 -1.920 -6.273 -1.299
123 HG23 ILE 17 HG23 ILE 17 -3.008 -7.598 -0.791
124 HD11 ILE 17 HD11 ILE 17 -0.197 -7.679 -3.647
125 HD12 ILE 17 HD12 ILE 17 -1.370 -8.861 -4.260
126 HD13 ILE 17 HD13 ILE 17 -1.953 -7.424 -3.393
127 H HIS 18 H HIS 18 1.004 -8.099 1.798
128 HA HIS 18 HA HIS 18 -0.140 -5.738 2.937
129 HB2 HIS 18 HB2 HIS 18 1.880 -7.648 4.236
130 HB3 HIS 18 HB3 HIS 18 0.940 -6.380 5.063
131 HD1 HIS 18 HD1 HIS 18 0.366 -8.764 6.318
132 HD2 HIS 18 HD2 HIS 18 -1.526 -7.891 2.662
133 HE1 HIS 18 HE1 HIS 18 -1.725 -10.188 6.256
134 H GLN 19 H GLN 19 3.406 -6.652 2.389
135 HA GLN 19 HA GLN 19 4.312 -4.272 3.564
136 HB2 GLN 19 HB2 GLN 19 6.477 -4.580 2.644
137 HB3 GLN 19 HB3 GLN 19 5.812 -6.185 3.065
138 HG2 GLN 19 HG2 GLN 19 5.231 -6.488 0.600
139 HG3 GLN 19 HG3 GLN 19 6.059 -4.952 0.237
140 HE21 GLN 19 HE21 GLN 19 7.084 -6.996 -1.164
141 HE22 GLN 19 HE22 GLN 19 8.552 -7.567 -0.462
142 H GLN 20 H GLN 20 3.507 -4.820 0.020
143 HA GLN 20 HA GLN 20 4.382 -2.163 -0.597
144 HB2 GLN 20 HB2 GLN 20 3.420 -2.394 -2.774
145 HB3 GLN 20 HB3 GLN 20 4.110 -3.975 -2.317
146 HG2 GLN 20 HG2 GLN 20 1.748 -4.703 -1.653
147 HG3 GLN 20 HG3 GLN 20 1.128 -3.155 -2.278
148 HE21 GLN 20 HE21 GLN 20 -0.149 -5.049 -3.495
149 HE22 GLN 20 HE22 GLN 20 0.532 -5.489 -5.018
150 H ASP 21 H ASP 21 1.210 -3.529 0.577
151 HA ASP 21 HA ASP 21 -0.250 -1.137 0.038
152 HB2 ASP 21 HB2 ASP 21 -0.779 -3.271 2.186
153 HB3 ASP 21 HB3 ASP 21 -1.869 -1.923 1.775
154 H PHE 22 H PHE 22 1.125 -2.281 3.316
155 HA PHE 22 HA PHE 22 0.255 0.210 4.380
156 HB2 PHE 22 HB2 PHE 22 1.339 -0.305 6.481
157 HB3 PHE 22 HB3 PHE 22 0.351 -1.649 5.881
158 HD1 PHE 22 HD2 PHE 22 3.901 -0.386 6.139
159 HD2 PHE 22 HD1 PHE 22 1.367 -3.824 5.579
160 HE1 PHE 22 HE2 PHE 22 5.837 -1.880 6.506
161 HE2 PHE 22 HE1 PHE 22 3.314 -5.311 5.912
162 HZ PHE 22 HZ PHE 22 5.559 -4.343 6.355
163 H VAL 23 H VAL 23 3.467 -0.814 3.009
164 HA VAL 23 HA VAL 23 4.819 1.466 4.159
165 HB VAL 23 HB VAL 23 5.549 -0.146 1.657
166 HG11 VAL 23 HG11 VAL 23 6.556 2.114 1.499
167 HG12 VAL 23 HG12 VAL 23 7.144 2.014 3.187
168 HG13 VAL 23 HG13 VAL 23 7.827 0.946 1.929
169 HG21 VAL 23 HG21 VAL 23 7.272 -1.183 3.149
170 HG22 VAL 23 HG22 VAL 23 6.702 -0.203 4.529
171 HG23 VAL 23 HG23 VAL 23 5.654 -1.463 3.825
172 H ASN 24 H ASN 24 3.284 0.866 0.854
173 HA ASN 24 HA ASN 24 3.758 3.470 -0.083
174 HB2 ASN 24 HB2 ASN 24 2.824 1.766 -1.613
175 HB3 ASN 24 HB3 ASN 24 1.323 1.685 -0.657
176 HD21 ASN 24 HD21 ASN 24 3.388 4.163 -2.450
177 HD22 ASN 24 HD22 ASN 24 2.032 5.097 -2.958
178 H TRP 25 H TRP 25 0.930 2.158 1.819
179 HA TRP 25 HA TRP 25 -0.680 4.427 1.740
180 HB2 TRP 25 HB2 TRP 25 -1.502 2.333 2.804
181 HB3 TRP 25 HB3 TRP 25 -0.206 2.453 4.020
182 HD1 TRP 25 HD1 TRP 25 -2.706 5.301 3.078
183 HE1 TRP 25 HE1 TRP 25 -3.843 6.022 5.200
184 HE3 TRP 25 HE3 TRP 25 -0.643 1.858 6.388
185 HZ2 TRP 25 HZ2 TRP 25 -3.969 5.329 7.846
186 HZ3 TRP 25 HZ3 TRP 25 -1.384 1.987 8.769
187 HH2 TRP 25 HH2 TRP 25 -3.024 3.694 9.488
188 H LEU 26 H LEU 26 2.025 3.701 4.131
189 HA LEU 26 HA LEU 26 1.299 6.051 5.674
190 HB2 LEU 26 HB2 LEU 26 3.826 4.332 5.722
191 HB3 LEU 26 HB3 LEU 26 3.499 5.643 6.876
192 HG LEU 26 HG LEU 26 1.635 3.202 6.517
193 HD11 LEU 26 HD11 LEU 26 3.859 3.645 8.602
194 HD12 LEU 26 HD12 LEU 26 3.863 2.420 7.301
195 HD13 LEU 26 HD13 LEU 26 2.671 2.309 8.615
196 HD21 LEU 26 HD21 LEU 26 0.789 3.877 8.808
197 HD22 LEU 26 HD22 LEU 26 0.411 5.091 7.576
198 HD23 LEU 26 HD23 LEU 26 1.765 5.365 8.711
199 H LEU 27 H LEU 27 4.114 5.402 3.374
200 HA LEU 27 HA LEU 27 4.976 8.107 3.617
201 HB2 LEU 27 HB2 LEU 27 6.379 7.821 1.681
202 HB3 LEU 27 HB3 LEU 27 6.404 6.366 2.699
203 HG LEU 27 HG LEU 27 4.616 5.413 1.013
204 HD11 LEU 27 HD11 LEU 27 5.850 7.619 -0.765
205 HD12 LEU 27 HD12 LEU 27 4.128 7.510 -0.332
206 HD13 LEU 27 HD13 LEU 27 4.851 6.263 -1.353
207 HD21 LEU 27 HD21 LEU 27 6.431 4.551 -0.484
208 HD22 LEU 27 HD22 LEU 27 6.961 4.555 1.216
209 HD23 LEU 27 HD23 LEU 27 7.527 5.836 0.108
210 H ALA 28 H ALA 28 2.300 6.681 1.671
211 HA ALA 28 HA ALA 28 1.979 9.076 0.065
212 HB1 ALA 28 HB1 ALA 28 1.013 6.901 -0.671
213 HB2 ALA 28 HB2 ALA 28 -0.072 6.880 0.752
214 HB3 ALA 28 HB3 ALA 28 -0.260 8.145 -0.494
215 H GLN 29 H GLN 29 0.577 7.855 3.210
216 HA GLN 29 HA GLN 29 -1.468 9.704 3.500
217 HB2 GLN 29 HB2 GLN 29 -1.179 7.891 5.113
218 HB3 GLN 29 HB3 GLN 29 0.391 8.532 5.650
219 HG2 GLN 29 HG2 GLN 29 -0.695 10.591 6.553
220 HG3 GLN 29 HG3 GLN 29 -2.292 9.976 6.060
221 HE21 GLN 29 HE21 GLN 29 -2.902 7.691 7.032
222 HE22 GLN 29 HE22 GLN 29 -2.308 7.354 8.616
223 H LYS 30 H LYS 30 1.984 10.161 4.738
224 HA LYS 30 HA LYS 30 1.441 12.969 5.222
225 HB2 LYS 30 HB2 LYS 30 3.215 11.652 6.396
226 HB3 LYS 30 HB3 LYS 30 4.194 11.611 4.910
227 HG2 LYS 30 HG2 LYS 30 3.250 14.284 6.152
228 HG3 LYS 30 HG3 LYS 30 4.676 13.431 6.781
229 HD2 LYS 30 HD2 LYS 30 5.890 13.609 4.703
230 HD3 LYS 30 HD3 LYS 30 4.468 14.208 3.827
231 HE2 LYS 30 HE2 LYS 30 6.078 16.037 4.352
232 HE3 LYS 30 HE3 LYS 30 4.469 16.325 5.053
233 HZ1 LYS 30 HZ1 LYS 30 6.364 16.880 6.577
234 HZ2 LYS 30 HZ2 LYS 30 6.829 15.201 6.605
235 HZ3 LYS 30 HZ3 LYS 30 5.292 15.731 7.266
236 H GLY 31 H GLY 31 2.954 10.991 2.546
237 HA2 GLY 31 HA2 GLY 31 3.989 12.745 0.860
238 HA3 GLY 31 HA3 GLY 31 2.861 11.513 0.255
239 H LYS 32 H LYS 32 0.297 12.525 1.282
240 HA LYS 32 HA LYS 32 -0.044 14.393 -0.833
241 HB2 LYS 32 HB2 LYS 32 -2.287 14.585 -0.428
242 HB3 LYS 32 HB3 LYS 32 -1.932 12.918 0.083
243 HG2 LYS 32 HG2 LYS 32 -1.943 13.731 2.493
244 HG3 LYS 32 HG3 LYS 32 -2.336 15.378 1.923
245 HD2 LYS 32 HD2 LYS 32 -4.106 12.875 1.589
246 HD3 LYS 32 HD3 LYS 32 -4.344 14.216 2.732
247 HE2 LYS 32 HE2 LYS 32 -4.506 15.788 0.646
248 HE3 LYS 32 HE3 LYS 32 -4.612 14.305 -0.338
249 HZ1 LYS 32 HZ1 LYS 32 -6.835 15.153 0.175
250 HZ2 LYS 32 HZ2 LYS 32 -6.528 15.068 1.879
251 HZ3 LYS 32 HZ3 LYS 32 -6.595 13.604 0.936
252 H LYS 33 H LYS 33 0.200 14.880 2.825
253 HA LYS 33 HA LYS 33 -0.117 17.672 2.743
254 HB2 LYS 33 HB2 LYS 33 0.119 16.576 4.913
255 HB3 LYS 33 HB3 LYS 33 1.764 16.014 4.526
256 HG2 LYS 33 HG2 LYS 33 2.598 18.339 4.395
257 HG3 LYS 33 HG3 LYS 33 0.966 18.982 4.740
258 HD2 LYS 33 HD2 LYS 33 1.020 17.828 6.982
259 HD3 LYS 33 HD3 LYS 33 2.649 17.199 6.628
260 HE2 LYS 33 HE2 LYS 33 1.864 20.171 6.911
261 HE3 LYS 33 HE3 LYS 33 2.762 19.191 8.097
262 HZ1 LYS 33 HZ1 LYS 33 3.739 20.129 5.379
263 HZ2 LYS 33 HZ2 LYS 33 4.556 18.892 6.311
264 HZ3 LYS 33 HZ3 LYS 33 4.367 20.508 6.928
265 H ASN 34 H ASN 34 2.950 15.698 2.281
266 HA ASN 34 HA ASN 34 4.623 17.885 1.908
267 HB2 ASN 34 HB2 ASN 34 5.464 15.491 1.969
268 HB3 ASN 34 HB3 ASN 34 4.786 15.226 0.348
269 HD21 ASN 34 HD21 ASN 34 7.106 17.412 2.178
270 HD22 ASN 34 HD22 ASN 34 8.148 17.655 0.825
271 H ASP 35 H ASP 35 2.421 16.298 -0.558
272 HA ASP 35 HA ASP 35 3.064 18.601 -2.366
273 HB2 ASP 35 HB2 ASP 35 4.428 16.595 -2.969
274 HB3 ASP 35 HB3 ASP 35 2.934 15.627 -3.090
275 H TRP 36 H TRP 36 0.808 18.688 -0.719
276 HA TRP 36 HA TRP 36 -1.125 18.890 -2.914
277 HB2 TRP 36 HB2 TRP 36 -1.363 16.514 -1.912
278 HB3 TRP 36 HB3 TRP 36 -2.133 17.274 -0.502
279 HD1 TRP 36 HD1 TRP 36 -2.860 16.026 -3.909
280 HE1 TRP 36 HE1 TRP 36 -5.186 16.630 -4.646
281 HE3 TRP 36 HE3 TRP 36 -4.042 19.572 -0.291
282 HZ2 TRP 36 HZ2 TRP 36 -7.242 18.274 -3.929
283 HZ3 TRP 36 HZ3 TRP 36 -6.328 20.561 -0.376
284 HH2 TRP 36 HH2 TRP 36 -7.912 19.919 -2.164
285 H LYS 37 H LYS 37 -1.097 19.007 0.792
286 HA LYS 37 HA LYS 37 -2.644 21.504 0.648
287 HB2 LYS 37 HB2 LYS 37 -1.220 20.185 3.048
288 HB3 LYS 37 HB3 LYS 37 -2.085 21.738 3.072
289 HG2 LYS 37 HG2 LYS 37 -3.650 20.208 3.936
290 HG3 LYS 37 HG3 LYS 37 -4.192 20.527 2.271
291 HD2 LYS 37 HD2 LYS 37 -3.252 18.274 1.573
292 HD3 LYS 37 HD3 LYS 37 -2.567 18.066 3.203
293 HE2 LYS 37 HE2 LYS 37 -4.593 16.740 3.013
294 HE3 LYS 37 HE3 LYS 37 -4.884 18.049 4.176
295 HZ1 LYS 37 HZ1 LYS 37 -5.772 18.089 1.268
296 HZ2 LYS 37 HZ2 LYS 37 -6.185 19.274 2.486
297 HZ3 LYS 37 HZ3 LYS 37 -6.783 17.666 2.610
298 H HIS 38 H HIS 38 0.794 20.521 1.527
299 HA HIS 38 HA HIS 38 1.706 23.177 1.751
300 HB2 HIS 38 HB2 HIS 38 3.019 21.121 2.427
301 HB3 HIS 38 HB3 HIS 38 3.388 20.826 0.708
302 HD1 HIS 38 HD1 HIS 38 4.757 22.829 -0.478
303 HD2 HIS 38 HD2 HIS 38 4.472 22.955 3.716
304 HE1 HIS 38 HE1 HIS 38 6.559 24.439 0.288
305 H ASN 39 H ASN 39 1.308 20.999 -1.133
306 HA ASN 39 HA ASN 39 2.696 22.566 -3.006
307 HB2 ASN 39 HB2 ASN 39 1.792 20.272 -3.436
308 HB3 ASN 39 HB3 ASN 39 0.139 20.934 -3.497
309 HD21 ASN 39 HD21 ASN 39 0.806 19.482 -5.645
310 HD22 ASN 39 HD22 ASN 39 1.207 20.488 -6.987
311 H ILE 40 H ILE 40 -0.820 22.745 -1.954
312 HA ILE 40 HA ILE 40 -1.516 24.676 -3.918
313 HB ILE 40 HB ILE 40 -2.760 23.983 -1.221
314 HG12 ILE 40 HG12 ILE 40 -3.837 23.745 -4.113
315 HG13 ILE 40 HG13 ILE 40 -2.922 22.454 -3.308
316 HG21 ILE 40 HG21 ILE 40 -3.187 26.405 -1.466
317 HG22 ILE 40 HG22 ILE 40 -3.727 26.172 -3.154
318 HG23 ILE 40 HG23 ILE 40 -4.682 25.525 -1.789
319 HD11 ILE 40 HD11 ILE 40 -5.688 23.512 -2.450
320 HD12 ILE 40 HD12 ILE 40 -5.268 21.905 -3.083
321 HD13 ILE 40 HD13 ILE 40 -4.686 22.400 -1.466
322 H THR 41 H THR 41 -0.696 25.353 -0.375
323 HA THR 41 HA THR 41 -0.662 28.134 -0.837
324 HB THR 41 HB THR 41 -0.573 27.219 1.457
325 HG1 THR 41 HG1 THR 41 1.515 29.087 0.853
326 HG21 THR 41 HG21 THR 41 2.424 26.653 0.918
327 HG22 THR 41 HG22 THR 41 1.149 25.430 1.205
328 HG23 THR 41 HG23 THR 41 1.597 26.574 2.494
329 H GLN 42 H GLN 42 1.942 25.641 -1.385
330 HA GLN 42 HA GLN 42 3.833 27.721 -2.244
331 HB2 GLN 42 HB2 GLN 42 4.574 25.522 -1.267
332 HB3 GLN 42 HB3 GLN 42 3.932 24.687 -2.706
333 HG2 GLN 42 HG2 GLN 42 6.168 26.814 -2.702
334 HG3 GLN 42 HG3 GLN 42 6.400 25.063 -2.876
335 HE21 GLN 42 HE21 GLN 42 5.563 28.024 -4.682
336 HE22 GLN 42 HE22 GLN 42 5.304 27.218 -6.183
Start of MODEL 8
1 H1 TYR 1 H1 TYR 1 -9.297 -2.162 1.033
2 HA TYR 1 HA TYR 1 -6.679 -1.527 -0.233
3 HB2 TYR 1 HB2 TYR 1 -7.286 -3.646 1.924
4 HB3 TYR 1 HB3 TYR 1 -5.683 -3.298 1.255
5 HD1 TYR 1 HD2 TYR 1 -4.721 -0.886 1.516
6 HD2 TYR 1 HD1 TYR 1 -8.182 -2.244 3.689
7 HE1 TYR 1 HE2 TYR 1 -4.438 0.964 3.129
8 HE2 TYR 1 HE1 TYR 1 -7.919 -0.384 5.273
9 HH TYR 1 HH TYR 1 -6.583 1.476 5.935
10 H ALA 2 H ALA 2 -5.646 -3.738 -1.154
11 HA ALA 2 HA ALA 2 -7.433 -4.369 -3.296
12 HB1 ALA 2 HB1 ALA 2 -4.968 -4.333 -3.564
13 HB2 ALA 2 HB2 ALA 2 -4.806 -5.745 -2.487
14 HB3 ALA 2 HB3 ALA 2 -5.645 -5.909 -4.067
15 H GLU 3 H GLU 3 -9.421 -5.234 -2.150
16 HA GLU 3 HA GLU 3 -9.115 -7.725 -0.689
17 HB2 GLU 3 HB2 GLU 3 -11.059 -6.223 -0.273
18 HB3 GLU 3 HB3 GLU 3 -11.667 -6.555 -1.919
19 HG2 GLU 3 HG2 GLU 3 -11.919 -8.989 -1.358
20 HG3 GLU 3 HG3 GLU 3 -11.189 -8.719 0.247
21 H GLY 4 H GLY 4 -9.484 -9.912 -1.576
22 HA2 GLY 4 HA2 GLY 4 -10.127 -11.312 -3.448
23 HA3 GLY 4 HA3 GLY 4 -9.674 -10.026 -4.590
24 H THR 5 H THR 5 -7.186 -9.093 -3.504
25 HA THR 5 HA THR 5 -5.492 -11.308 -4.351
26 HB THR 5 HB THR 5 -3.588 -9.790 -3.870
27 HG1 THR 5 HG1 THR 5 -4.540 -8.489 -2.129
28 HG21 THR 5 HG21 THR 5 -5.858 -8.449 -5.479
29 HG22 THR 5 HG22 THR 5 -4.724 -9.683 -6.101
30 HG23 THR 5 HG23 THR 5 -4.118 -8.077 -5.597
31 H PHE 6 H PHE 6 -6.375 -9.726 -1.141
32 HA PHE 6 HA PHE 6 -4.481 -11.277 0.329
33 HB2 PHE 6 HB2 PHE 6 -7.274 -10.394 1.303
34 HB3 PHE 6 HB3 PHE 6 -5.904 -10.863 2.337
35 HD1 PHE 6 HD2 PHE 6 -3.609 -9.537 1.839
36 HD2 PHE 6 HD1 PHE 6 -7.565 -8.028 1.079
37 HE1 PHE 6 HE2 PHE 6 -2.723 -7.241 1.656
38 HE2 PHE 6 HE1 PHE 6 -6.640 -5.771 0.697
39 HZ PHE 6 HZ PHE 6 -4.189 -5.387 0.897
40 H ILE 7 H ILE 7 -7.898 -11.916 -0.749
41 HA ILE 7 HA ILE 7 -8.115 -14.328 0.810
42 HB ILE 7 HB ILE 7 -9.648 -13.410 -1.684
43 HG12 ILE 7 HG12 ILE 7 -10.508 -13.545 1.276
44 HG13 ILE 7 HG13 ILE 7 -9.912 -12.067 0.491
45 HG21 ILE 7 HG21 ILE 7 -9.629 -15.916 -1.560
46 HG22 ILE 7 HG22 ILE 7 -10.166 -15.838 0.140
47 HG23 ILE 7 HG23 ILE 7 -11.242 -15.303 -1.181
48 HD11 ILE 7 HD11 ILE 7 -12.493 -13.551 -0.288
49 HD12 ILE 7 HD12 ILE 7 -12.345 -11.983 0.531
50 HD13 ILE 7 HD13 ILE 7 -11.805 -12.148 -1.163
51 H SER 8 H SER 8 -7.452 -13.758 -2.756
52 HA SER 8 HA SER 8 -6.901 -16.402 -3.417
53 HB2 SER 8 HB2 SER 8 -6.915 -14.583 -5.135
54 HB3 SER 8 HB3 SER 8 -5.456 -13.863 -4.402
55 HG SER 8 HG SER 8 -5.508 -16.459 -5.617
56 H ASP 9 H ASP 9 -4.685 -13.990 -1.835
57 HA ASP 9 HA ASP 9 -2.349 -15.653 -2.012
58 HB2 ASP 9 HB2 ASP 9 -3.071 -13.460 0.039
59 HB3 ASP 9 HB3 ASP 9 -1.469 -14.182 -0.168
60 H TYR 10 H TYR 10 -4.885 -15.224 0.587
61 HA TYR 10 HA TYR 10 -5.235 -16.373 2.533
62 HB2 TYR 10 HB2 TYR 10 -3.924 -18.797 1.173
63 HB3 TYR 10 HB3 TYR 10 -4.877 -18.775 2.664
64 HD1 TYR 10 HD1 TYR 10 -7.321 -17.925 2.504
65 HD2 TYR 10 HD2 TYR 10 -4.970 -18.864 -0.974
66 HE1 TYR 10 HE1 TYR 10 -9.380 -18.097 1.163
67 HE2 TYR 10 HE2 TYR 10 -7.027 -18.960 -2.337
68 HH TYR 10 HH TYR 10 -10.308 -18.608 -0.984
69 H SER 11 H SER 11 -1.976 -17.976 1.952
70 HA SER 11 HA SER 11 -0.723 -15.872 3.581
71 HB2 SER 11 HB2 SER 11 -0.893 -18.791 4.551
72 HB3 SER 11 HB3 SER 11 0.154 -17.522 5.253
73 HG SER 11 HG SER 11 -2.704 -17.410 5.279
74 H ILE 12 H ILE 12 -0.368 -16.238 0.912
75 HA ILE 12 HA ILE 12 2.317 -17.607 0.801
76 HB ILE 12 HB ILE 12 0.201 -17.312 -1.403
77 HG12 ILE 12 HG12 ILE 12 -0.409 -19.085 0.162
78 HG13 ILE 12 HG13 ILE 12 0.020 -19.702 -1.448
79 HG21 ILE 12 HG21 ILE 12 1.849 -18.588 -2.823
80 HG22 ILE 12 HG22 ILE 12 2.429 -16.966 -2.371
81 HG23 ILE 12 HG23 ILE 12 3.077 -18.402 -1.537
82 HD11 ILE 12 HD11 ILE 12 0.900 -21.193 0.303
83 HD12 ILE 12 HD12 ILE 12 2.265 -20.454 -0.567
84 HD13 ILE 12 HD13 ILE 12 1.814 -19.872 1.064
85 H ALA 13 H ALA 13 0.492 -15.074 -1.159
86 HA ALA 13 HA ALA 13 2.946 -13.371 -0.871
87 HB1 ALA 13 HB1 ALA 13 2.096 -12.269 -2.928
88 HB2 ALA 13 HB2 ALA 13 2.209 -14.030 -3.183
89 HB3 ALA 13 HB3 ALA 13 0.621 -13.269 -2.882
90 H MET 14 H MET 14 0.611 -13.754 1.269
91 HA MET 14 HA MET 14 -0.864 -11.296 1.033
92 HB2 MET 14 HB2 MET 14 -1.638 -11.605 3.279
93 HB3 MET 14 HB3 MET 14 -1.638 -13.202 2.480
94 HG2 MET 14 HG2 MET 14 0.541 -13.752 3.699
95 HG3 MET 14 HG3 MET 14 0.466 -12.155 4.505
96 HE1 MET 14 HE1 MET 14 -0.552 -14.652 7.374
97 HE2 MET 14 HE2 MET 14 0.670 -14.878 6.080
98 HE3 MET 14 HE3 MET 14 0.528 -13.294 6.916
99 H ASP 15 H ASP 15 2.297 -12.232 2.596
100 HA ASP 15 HA ASP 15 2.591 -9.684 3.893
101 HB2 ASP 15 HB2 ASP 15 4.758 -11.688 3.053
102 HB3 ASP 15 HB3 ASP 15 4.981 -10.307 4.163
103 H LYS 16 H LYS 16 3.375 -10.904 0.551
104 HA LYS 16 HA LYS 16 4.948 -8.633 -0.177
105 HB2 LYS 16 HB2 LYS 16 4.818 -10.620 -1.645
106 HB3 LYS 16 HB3 LYS 16 3.073 -10.352 -1.896
107 HG2 LYS 16 HG2 LYS 16 3.461 -8.239 -3.088
108 HG3 LYS 16 HG3 LYS 16 5.208 -8.308 -2.704
109 HD2 LYS 16 HD2 LYS 16 5.508 -10.274 -4.143
110 HD3 LYS 16 HD3 LYS 16 3.749 -10.464 -4.361
111 HE2 LYS 16 HE2 LYS 16 4.838 -9.461 -6.367
112 HE3 LYS 16 HE3 LYS 16 3.595 -8.393 -5.670
113 HZ1 LYS 16 HZ1 LYS 16 5.297 -6.954 -4.707
114 HZ2 LYS 16 HZ2 LYS 16 5.704 -7.226 -6.362
115 HZ3 LYS 16 HZ3 LYS 16 6.563 -8.089 -5.117
116 H ILE 17 H ILE 17 1.322 -9.243 -0.226
117 HA ILE 17 HA ILE 17 0.865 -6.663 -1.469
118 HB ILE 17 HB ILE 17 -1.115 -8.313 0.152
119 HG12 ILE 17 HG12 ILE 17 -0.354 -9.640 -1.817
120 HG13 ILE 17 HG13 ILE 17 -2.061 -9.180 -1.901
121 HG21 ILE 17 HG21 ILE 17 -1.792 -5.904 -0.070
122 HG22 ILE 17 HG22 ILE 17 -1.530 -5.951 -1.817
123 HG23 ILE 17 HG23 ILE 17 -2.842 -6.914 -1.092
124 HD11 ILE 17 HD11 ILE 17 0.222 -7.831 -3.482
125 HD12 ILE 17 HD12 ILE 17 -0.917 -9.046 -4.110
126 HD13 ILE 17 HD13 ILE 17 -1.522 -7.447 -3.632
127 H HIS 18 H HIS 18 0.970 -7.877 2.003
128 HA HIS 18 HA HIS 18 0.091 -5.476 3.190
129 HB2 HIS 18 HB2 HIS 18 2.410 -7.207 4.237
130 HB3 HIS 18 HB3 HIS 18 1.450 -6.053 5.187
131 HD1 HIS 18 HD1 HIS 18 1.682 -8.835 6.145
132 HD2 HIS 18 HD2 HIS 18 -1.353 -7.559 3.541
133 HE1 HIS 18 HE1 HIS 18 -0.204 -10.494 6.431
134 H GLN 19 H GLN 19 3.432 -6.499 2.127
135 HA GLN 19 HA GLN 19 4.786 -4.156 2.892
136 HB2 GLN 19 HB2 GLN 19 6.049 -6.063 2.172
137 HB3 GLN 19 HB3 GLN 19 5.286 -6.097 0.576
138 HG2 GLN 19 HG2 GLN 19 7.106 -3.839 1.595
139 HG3 GLN 19 HG3 GLN 19 7.630 -5.170 0.539
140 HE21 GLN 19 HE21 GLN 19 6.069 -5.459 -1.585
141 HE22 GLN 19 HE22 GLN 19 5.772 -3.963 -2.384
142 H GLN 20 H GLN 20 3.250 -4.861 -0.384
143 HA GLN 20 HA GLN 20 3.744 -2.318 -1.422
144 HB2 GLN 20 HB2 GLN 20 2.697 -4.153 -2.771
145 HB3 GLN 20 HB3 GLN 20 1.194 -3.990 -1.826
146 HG2 GLN 20 HG2 GLN 20 1.023 -1.553 -2.662
147 HG3 GLN 20 HG3 GLN 20 2.462 -1.857 -3.668
148 HE21 GLN 20 HE21 GLN 20 -0.923 -3.093 -2.964
149 HE22 GLN 20 HE22 GLN 20 -1.197 -3.673 -4.565
150 H ASP 21 H ASP 21 0.853 -3.375 0.607
151 HA ASP 21 HA ASP 21 -0.361 -0.829 0.447
152 HB2 ASP 21 HB2 ASP 21 -0.752 -2.989 2.586
153 HB3 ASP 21 HB3 ASP 21 -1.669 -1.459 2.494
154 H PHE 22 H PHE 22 1.288 -2.107 3.556
155 HA PHE 22 HA PHE 22 0.989 0.476 4.595
156 HB2 PHE 22 HB2 PHE 22 2.471 -0.096 6.449
157 HB3 PHE 22 HB3 PHE 22 1.315 -1.397 6.111
158 HD1 PHE 22 HD2 PHE 22 4.882 -0.286 5.551
159 HD2 PHE 22 HD1 PHE 22 2.156 -3.619 5.622
160 HE1 PHE 22 HE2 PHE 22 6.788 -1.853 5.436
161 HE2 PHE 22 HE1 PHE 22 4.068 -5.182 5.498
162 HZ PHE 22 HZ PHE 22 6.389 -4.305 5.411
163 H VAL 23 H VAL 23 3.645 -0.745 2.481
164 HA VAL 23 HA VAL 23 5.401 1.436 3.192
165 HB VAL 23 HB VAL 23 5.329 -0.268 0.647
166 HG11 VAL 23 HG11 VAL 23 7.354 1.882 1.513
167 HG12 VAL 23 HG12 VAL 23 7.609 0.717 0.183
168 HG13 VAL 23 HG13 VAL 23 6.312 1.927 0.057
169 HG21 VAL 23 HG21 VAL 23 7.410 -1.271 1.661
170 HG22 VAL 23 HG22 VAL 23 7.218 -0.238 3.100
171 HG23 VAL 23 HG23 VAL 23 6.016 -1.505 2.744
172 H ASN 24 H ASN 24 3.294 1.038 0.159
173 HA ASN 24 HA ASN 24 3.816 3.768 -0.483
174 HB2 ASN 24 HB2 ASN 24 2.172 3.602 -2.240
175 HB3 ASN 24 HB3 ASN 24 3.181 2.128 -2.214
176 HD21 ASN 24 HD21 ASN 24 0.945 1.864 -3.702
177 HD22 ASN 24 HD22 ASN 24 -0.274 0.989 -2.850
178 H TRP 25 H TRP 25 1.030 2.165 1.194
179 HA TRP 25 HA TRP 25 -0.682 4.376 1.113
180 HB2 TRP 25 HB2 TRP 25 -1.480 2.118 1.872
181 HB3 TRP 25 HB3 TRP 25 -0.432 2.242 3.309
182 HD1 TRP 25 HD1 TRP 25 -2.620 5.272 2.251
183 HE1 TRP 25 HE1 TRP 25 -4.280 5.686 4.074
184 HE3 TRP 25 HE3 TRP 25 -1.751 1.074 5.187
185 HZ2 TRP 25 HZ2 TRP 25 -5.143 4.568 6.420
186 HZ3 TRP 25 HZ3 TRP 25 -3.104 0.855 7.281
187 HH2 TRP 25 HH2 TRP 25 -4.753 2.589 7.902
188 H LEU 26 H LEU 26 1.777 3.423 3.701
189 HA LEU 26 HA LEU 26 0.823 5.638 5.315
190 HB2 LEU 26 HB2 LEU 26 3.297 3.937 5.783
191 HB3 LEU 26 HB3 LEU 26 2.580 5.097 6.926
192 HG LEU 26 HG LEU 26 1.219 2.514 5.921
193 HD11 LEU 26 HD11 LEU 26 2.307 3.273 8.701
194 HD12 LEU 26 HD12 LEU 26 3.113 2.166 7.552
195 HD13 LEU 26 HD13 LEU 26 1.538 1.722 8.261
196 HD21 LEU 26 HD21 LEU 26 -0.526 3.008 7.698
197 HD22 LEU 26 HD22 LEU 26 -0.595 4.120 6.323
198 HD23 LEU 26 HD23 LEU 26 0.159 4.651 7.858
199 H LEU 27 H LEU 27 3.817 5.125 3.252
200 HA LEU 27 HA LEU 27 4.948 7.584 4.119
201 HB2 LEU 27 HB2 LEU 27 6.428 7.557 2.224
202 HB3 LEU 27 HB3 LEU 27 6.208 5.914 2.857
203 HG LEU 27 HG LEU 27 4.399 5.684 0.918
204 HD11 LEU 27 HD11 LEU 27 4.855 7.003 -1.124
205 HD12 LEU 27 HD12 LEU 27 6.150 7.916 -0.297
206 HD13 LEU 27 HD13 LEU 27 4.452 8.148 0.167
207 HD21 LEU 27 HD21 LEU 27 6.512 4.375 0.985
208 HD22 LEU 27 HD22 LEU 27 7.421 5.765 0.333
209 HD23 LEU 27 HD23 LEU 27 6.210 4.929 -0.680
210 H ALA 28 H ALA 28 2.348 6.882 1.678
211 HA ALA 28 HA ALA 28 2.251 9.644 0.797
212 HB1 ALA 28 HB1 ALA 28 1.288 7.818 -0.596
213 HB2 ALA 28 HB2 ALA 28 0.077 7.460 0.674
214 HB3 ALA 28 HB3 ALA 28 0.042 9.033 -0.176
215 H GLN 29 H GLN 29 0.489 7.674 3.327
216 HA GLN 29 HA GLN 29 -1.445 9.521 4.051
217 HB2 GLN 29 HB2 GLN 29 -1.203 7.239 5.051
218 HB3 GLN 29 HB3 GLN 29 0.221 7.797 5.980
219 HG2 GLN 29 HG2 GLN 29 -1.181 9.421 7.231
220 HG3 GLN 29 HG3 GLN 29 -2.631 8.861 6.356
221 HE21 GLN 29 HE21 GLN 29 -2.973 6.291 6.452
222 HE22 GLN 29 HE22 GLN 29 -2.613 5.558 7.967
223 H LYS 30 H LYS 30 2.026 9.390 5.271
224 HA LYS 30 HA LYS 30 1.631 11.819 6.780
225 HB2 LYS 30 HB2 LYS 30 3.409 10.221 7.414
226 HB3 LYS 30 HB3 LYS 30 4.217 10.446 5.843
227 HG2 LYS 30 HG2 LYS 30 5.390 11.711 7.596
228 HG3 LYS 30 HG3 LYS 30 4.718 12.829 6.384
229 HD2 LYS 30 HD2 LYS 30 2.853 13.431 7.941
230 HD3 LYS 30 HD3 LYS 30 3.401 12.197 9.110
231 HE2 LYS 30 HE2 LYS 30 5.529 13.469 9.445
232 HE3 LYS 30 HE3 LYS 30 5.044 14.643 8.192
233 HZ1 LYS 30 HZ1 LYS 30 3.155 15.366 9.570
234 HZ2 LYS 30 HZ2 LYS 30 4.617 15.452 10.508
235 HZ3 LYS 30 HZ3 LYS 30 3.509 14.142 10.766
236 H GLY 31 H GLY 31 3.083 11.032 3.497
237 HA2 GLY 31 HA2 GLY 31 3.980 13.581 2.840
238 HA3 GLY 31 HA3 GLY 31 3.289 12.447 1.645
239 H LYS 32 H LYS 32 0.530 12.435 2.972
240 HA LYS 32 HA LYS 32 -0.600 14.534 1.463
241 HB2 LYS 32 HB2 LYS 32 -1.883 12.587 2.344
242 HB3 LYS 32 HB3 LYS 32 -1.716 13.200 4.015
243 HG2 LYS 32 HG2 LYS 32 -2.965 15.274 3.411
244 HG3 LYS 32 HG3 LYS 32 -3.176 14.683 1.738
245 HD2 LYS 32 HD2 LYS 32 -4.277 13.331 4.288
246 HD3 LYS 32 HD3 LYS 32 -5.206 14.390 3.198
247 HE2 LYS 32 HE2 LYS 32 -4.789 12.737 1.300
248 HE3 LYS 32 HE3 LYS 32 -4.026 11.630 2.474
249 HZ1 LYS 32 HZ1 LYS 32 -6.881 12.635 2.575
250 HZ2 LYS 32 HZ2 LYS 32 -6.137 11.618 3.789
251 HZ3 LYS 32 HZ3 LYS 32 -6.355 11.026 2.170
252 H LYS 33 H LYS 33 0.441 14.417 4.962
253 HA LYS 33 HA LYS 33 -0.677 17.003 5.547
254 HB2 LYS 33 HB2 LYS 33 1.494 15.368 6.961
255 HB3 LYS 33 HB3 LYS 33 1.035 17.003 7.484
256 HG2 LYS 33 HG2 LYS 33 -0.146 15.287 8.812
257 HG3 LYS 33 HG3 LYS 33 -1.274 16.358 7.941
258 HD2 LYS 33 HD2 LYS 33 -1.731 14.589 6.256
259 HD3 LYS 33 HD3 LYS 33 -0.493 13.526 7.003
260 HE2 LYS 33 HE2 LYS 33 -1.820 13.423 9.103
261 HE3 LYS 33 HE3 LYS 33 -3.036 14.533 8.415
262 HZ1 LYS 33 HZ1 LYS 33 -3.739 12.168 8.280
263 HZ2 LYS 33 HZ2 LYS 33 -2.356 11.793 7.291
264 HZ3 LYS 33 HZ3 LYS 33 -3.592 12.873 6.699
265 H ASN 34 H ASN 34 2.545 15.923 4.249
266 HA ASN 34 HA ASN 34 3.649 18.576 4.445
267 HB2 ASN 34 HB2 ASN 34 5.009 16.466 4.125
268 HB3 ASN 34 HB3 ASN 34 4.422 16.364 2.448
269 HD21 ASN 34 HD21 ASN 34 4.985 18.308 0.950
270 HD22 ASN 34 HD22 ASN 34 6.413 19.198 1.325
271 H ASP 35 H ASP 35 1.727 16.831 1.853
272 HA ASP 35 HA ASP 35 1.753 19.398 0.283
273 HB2 ASP 35 HB2 ASP 35 3.025 17.461 -0.729
274 HB3 ASP 35 HB3 ASP 35 1.528 16.496 -0.679
275 H TRP 36 H TRP 36 -0.200 19.072 2.379
276 HA TRP 36 HA TRP 36 -2.337 19.763 0.598
277 HB2 TRP 36 HB2 TRP 36 -2.559 17.125 0.875
278 HB3 TRP 36 HB3 TRP 36 -3.290 17.504 2.443
279 HD1 TRP 36 HD1 TRP 36 -4.093 17.353 -1.193
280 HE1 TRP 36 HE1 TRP 36 -6.402 18.243 -1.652
281 HE3 TRP 36 HE3 TRP 36 -5.108 19.582 3.395
282 HZ2 TRP 36 HZ2 TRP 36 -8.383 19.652 -0.405
283 HZ3 TRP 36 HZ3 TRP 36 -7.333 20.675 3.660
284 HH2 TRP 36 HH2 TRP 36 -8.961 20.688 1.800
285 H LYS 37 H LYS 37 -2.015 18.641 4.094
286 HA LYS 37 HA LYS 37 -3.505 20.981 5.010
287 HB2 LYS 37 HB2 LYS 37 -1.594 19.099 6.555
288 HB3 LYS 37 HB3 LYS 37 -2.459 20.494 7.237
289 HG2 LYS 37 HG2 LYS 37 -3.678 18.524 7.842
290 HG3 LYS 37 HG3 LYS 37 -4.652 19.508 6.716
291 HD2 LYS 37 HD2 LYS 37 -4.223 17.895 4.884
292 HD3 LYS 37 HD3 LYS 37 -3.019 17.027 5.867
293 HE2 LYS 37 HE2 LYS 37 -5.122 15.769 5.773
294 HE3 LYS 37 HE3 LYS 37 -4.769 16.272 7.443
295 HZ1 LYS 37 HZ1 LYS 37 -7.159 16.561 6.793
296 HZ2 LYS 37 HZ2 LYS 37 -6.688 17.733 5.593
297 HZ3 LYS 37 HZ3 LYS 37 -6.442 18.039 7.300
298 H HIS 38 H HIS 38 -0.039 20.007 4.546
299 HA HIS 38 HA HIS 38 1.841 21.259 4.267
300 HB2 HIS 38 HB2 HIS 38 0.336 22.716 2.847
301 HB3 HIS 38 HB3 HIS 38 0.210 23.847 4.220
302 HD1 HIS 38 HD1 HIS 38 1.507 24.608 1.559
303 HD2 HIS 38 HD2 HIS 38 3.611 23.188 4.913
304 HE1 HIS 38 HE1 HIS 38 3.876 25.460 1.309
305 H ASN 39 H ASN 39 1.285 20.120 6.611
306 HA ASN 39 HA ASN 39 1.649 22.112 8.752
307 HB2 ASN 39 HB2 ASN 39 2.016 19.052 8.817
308 HB3 ASN 39 HB3 ASN 39 1.944 20.155 10.218
309 HD21 ASN 39 HD21 ASN 39 0.121 17.938 9.985
310 HD22 ASN 39 HD22 ASN 39 -1.453 18.589 9.719
311 H ILE 40 H ILE 40 3.618 19.533 7.003
312 HA ILE 40 HA ILE 40 6.102 20.746 8.075
313 HB ILE 40 HB ILE 40 5.682 18.427 6.118
314 HG12 ILE 40 HG12 ILE 40 4.721 17.750 8.249
315 HG13 ILE 40 HG13 ILE 40 6.257 16.906 7.987
316 HG21 ILE 40 HG21 ILE 40 7.895 19.433 5.783
317 HG22 ILE 40 HG22 ILE 40 8.236 19.393 7.532
318 HG23 ILE 40 HG23 ILE 40 8.085 17.869 6.609
319 HD11 ILE 40 HD11 ILE 40 7.386 18.490 9.617
320 HD12 ILE 40 HD12 ILE 40 5.811 19.299 9.896
321 HD13 ILE 40 HD13 ILE 40 6.032 17.598 10.349
322 H THR 41 H THR 41 7.533 22.049 6.703
323 HA THR 41 HA THR 41 6.151 23.627 4.914
324 HB THR 41 HB THR 41 8.339 24.338 5.856
325 HG1 THR 41 HG1 THR 41 8.927 25.404 3.796
326 HG21 THR 41 HG21 THR 41 9.657 22.175 5.395
327 HG22 THR 41 HG22 THR 41 10.472 23.637 4.779
328 HG23 THR 41 HG23 THR 41 9.607 22.565 3.649
329 H GLN 42 H GLN 42 6.580 24.045 2.530
330 HA GLN 42 HA GLN 42 7.441 21.672 0.972
331 HB2 GLN 42 HB2 GLN 42 4.982 21.278 1.407
332 HB3 GLN 42 HB3 GLN 42 4.636 22.929 0.854
333 HG2 GLN 42 HG2 GLN 42 5.441 22.418 -1.445
334 HG3 GLN 42 HG3 GLN 42 5.932 20.785 -0.920
335 HE21 GLN 42 HE21 GLN 42 2.894 22.919 -0.781
336 HE22 GLN 42 HE22 GLN 42 1.844 21.634 -1.240
Start of MODEL 9
1 H1 TYR 1 H1 TYR 1 -5.947 -12.650 16.553
2 HA TYR 1 HA TYR 1 -5.913 -14.646 15.054
3 HB2 TYR 1 HB2 TYR 1 -8.682 -13.496 14.310
4 HB3 TYR 1 HB3 TYR 1 -7.921 -14.894 13.517
5 HD1 TYR 1 HD1 TYR 1 -9.511 -13.680 16.662
6 HD2 TYR 1 HD2 TYR 1 -7.688 -17.060 14.715
7 HE1 TYR 1 HE1 TYR 1 -10.290 -15.159 18.484
8 HE2 TYR 1 HE2 TYR 1 -8.483 -18.533 16.521
9 HH TYR 1 HH TYR 1 -9.518 -18.635 18.676
10 H ALA 2 H ALA 2 -5.664 -14.422 12.512
11 HA ALA 2 HA ALA 2 -4.601 -11.667 12.030
12 HB1 ALA 2 HB1 ALA 2 -3.388 -12.707 10.155
13 HB2 ALA 2 HB2 ALA 2 -3.112 -13.653 11.648
14 HB3 ALA 2 HB3 ALA 2 -4.251 -14.254 10.406
15 H GLU 3 H GLU 3 -7.469 -11.606 12.077
16 HA GLU 3 HA GLU 3 -8.540 -12.219 9.517
17 HB2 GLU 3 HB2 GLU 3 -9.989 -11.672 11.490
18 HB3 GLU 3 HB3 GLU 3 -9.414 -9.983 11.444
19 HG2 GLU 3 HG2 GLU 3 -11.660 -10.223 10.347
20 HG3 GLU 3 HG3 GLU 3 -10.442 -9.666 9.179
21 H GLY 4 H GLY 4 -8.720 -10.798 7.564
22 HA2 GLY 4 HA2 GLY 4 -8.332 -8.579 6.616
23 HA3 GLY 4 HA3 GLY 4 -6.921 -8.363 7.675
24 H THR 5 H THR 5 -5.621 -10.942 7.493
25 HA THR 5 HA THR 5 -4.359 -10.577 4.953
26 HB THR 5 HB THR 5 -3.282 -11.745 6.963
27 HG1 THR 5 HG1 THR 5 -3.151 -13.021 4.401
28 HG21 THR 5 HG21 THR 5 -3.503 -14.181 7.188
29 HG22 THR 5 HG22 THR 5 -4.724 -14.260 5.896
30 HG23 THR 5 HG23 THR 5 -5.119 -13.467 7.438
31 H PHE 6 H PHE 6 -7.101 -12.647 6.014
32 HA PHE 6 HA PHE 6 -6.973 -14.290 3.641
33 HB2 PHE 6 HB2 PHE 6 -9.437 -13.859 5.395
34 HB3 PHE 6 HB3 PHE 6 -9.048 -15.282 4.397
35 HD1 PHE 6 HD1 PHE 6 -6.703 -16.462 4.953
36 HD2 PHE 6 HD2 PHE 6 -8.902 -14.019 7.731
37 HE1 PHE 6 HE1 PHE 6 -5.304 -17.304 6.812
38 HE2 PHE 6 HE2 PHE 6 -7.466 -14.820 9.576
39 HZ PHE 6 HZ PHE 6 -5.649 -16.451 9.121
40 H ILE 7 H ILE 7 -8.751 -11.275 4.603
41 HA ILE 7 HA ILE 7 -10.326 -11.281 2.143
42 HB ILE 7 HB ILE 7 -9.833 -9.097 4.235
43 HG12 ILE 7 HG12 ILE 7 -12.381 -10.758 3.764
44 HG13 ILE 7 HG13 ILE 7 -11.127 -11.273 4.907
45 HG21 ILE 7 HG21 ILE 7 -11.794 -9.138 1.856
46 HG22 ILE 7 HG22 ILE 7 -11.767 -7.894 3.134
47 HG23 ILE 7 HG23 ILE 7 -10.387 -8.056 2.038
48 HD11 ILE 7 HD11 ILE 7 -12.858 -10.108 6.162
49 HD12 ILE 7 HD12 ILE 7 -11.368 -9.127 6.198
50 HD13 ILE 7 HD13 ILE 7 -12.731 -8.658 5.140
51 H SER 8 H SER 8 -7.538 -9.262 3.418
52 HA SER 8 HA SER 8 -7.295 -7.712 1.089
53 HB2 SER 8 HB2 SER 8 -5.078 -8.444 3.105
54 HB3 SER 8 HB3 SER 8 -4.910 -7.266 1.781
55 HG SER 8 HG SER 8 -6.820 -6.998 3.905
56 H ASP 9 H ASP 9 -5.257 -10.662 2.029
57 HA ASP 9 HA ASP 9 -5.181 -11.434 -0.798
58 HB2 ASP 9 HB2 ASP 9 -3.565 -9.546 -0.814
59 HB3 ASP 9 HB3 ASP 9 -2.710 -10.246 0.581
60 H TYR 10 H TYR 10 -6.251 -13.064 0.840
61 HA TYR 10 HA TYR 10 -6.104 -15.234 1.587
62 HB2 TYR 10 HB2 TYR 10 -3.926 -15.324 -0.556
63 HB3 TYR 10 HB3 TYR 10 -4.896 -16.679 0.060
64 HD1 TYR 10 HD2 TYR 10 -7.426 -16.628 -0.371
65 HD2 TYR 10 HD1 TYR 10 -4.795 -13.694 -2.100
66 HE1 TYR 10 HE2 TYR 10 -9.206 -15.947 -1.952
67 HE2 TYR 10 HE1 TYR 10 -6.583 -12.972 -3.621
68 HH TYR 10 HH TYR 10 -8.805 -13.380 -4.401
69 H SER 11 H SER 11 -2.457 -15.163 1.151
70 HA SER 11 HA SER 11 -1.956 -15.276 3.974
71 HB2 SER 11 HB2 SER 11 -2.534 -17.951 2.565
72 HB3 SER 11 HB3 SER 11 -1.559 -17.822 4.064
73 HG SER 11 HG SER 11 -3.838 -18.212 4.538
74 H ILE 12 H ILE 12 -1.000 -17.014 0.844
75 HA ILE 12 HA ILE 12 1.717 -17.251 1.812
76 HB ILE 12 HB ILE 12 0.564 -17.608 -1.001
77 HG12 ILE 12 HG12 ILE 12 1.482 -19.680 1.100
78 HG13 ILE 12 HG13 ILE 12 -0.212 -19.240 0.791
79 HG21 ILE 12 HG21 ILE 12 3.392 -18.281 0.027
80 HG22 ILE 12 HG22 ILE 12 2.760 -18.644 -1.606
81 HG23 ILE 12 HG23 ILE 12 3.000 -16.966 -1.117
82 HD11 ILE 12 HD11 ILE 12 0.064 -20.011 -1.629
83 HD12 ILE 12 HD12 ILE 12 1.668 -20.670 -1.181
84 HD13 ILE 12 HD13 ILE 12 0.201 -21.301 -0.402
85 H ALA 13 H ALA 13 0.221 -15.159 -0.831
86 HA ALA 13 HA ALA 13 2.708 -13.560 -0.858
87 HB1 ALA 13 HB1 ALA 13 0.082 -13.199 -2.408
88 HB2 ALA 13 HB2 ALA 13 1.602 -12.306 -2.698
89 HB3 ALA 13 HB3 ALA 13 1.532 -14.068 -2.980
90 H MET 14 H MET 14 0.463 -13.602 1.571
91 HA MET 14 HA MET 14 -0.571 -11.034 1.663
92 HB2 MET 14 HB2 MET 14 -0.768 -11.274 4.055
93 HB3 MET 14 HB3 MET 14 -0.997 -12.890 3.328
94 HG2 MET 14 HG2 MET 14 1.478 -13.386 3.908
95 HG3 MET 14 HG3 MET 14 1.516 -11.853 4.820
96 HE1 MET 14 HE1 MET 14 0.821 -11.832 7.427
97 HE2 MET 14 HE2 MET 14 -0.669 -11.334 6.563
98 HE3 MET 14 HE3 MET 14 -0.761 -12.545 7.881
99 H ASP 15 H ASP 15 2.845 -12.112 2.333
100 HA ASP 15 HA ASP 15 3.556 -9.657 3.636
101 HB2 ASP 15 HB2 ASP 15 5.348 -11.602 2.050
102 HB3 ASP 15 HB3 ASP 15 5.920 -10.283 3.104
103 H LYS 16 H LYS 16 3.772 -10.790 0.138
104 HA LYS 16 HA LYS 16 5.077 -8.444 -0.728
105 HB2 LYS 16 HB2 LYS 16 4.930 -10.386 -2.210
106 HB3 LYS 16 HB3 LYS 16 3.154 -10.308 -2.242
107 HG2 LYS 16 HG2 LYS 16 4.141 -9.437 -4.341
108 HG3 LYS 16 HG3 LYS 16 3.170 -8.202 -3.500
109 HD2 LYS 16 HD2 LYS 16 5.206 -7.044 -2.713
110 HD3 LYS 16 HD3 LYS 16 6.240 -8.400 -3.244
111 HE2 LYS 16 HE2 LYS 16 6.381 -6.451 -4.778
112 HE3 LYS 16 HE3 LYS 16 5.760 -7.892 -5.622
113 HZ1 LYS 16 HZ1 LYS 16 3.497 -6.990 -5.577
114 HZ2 LYS 16 HZ2 LYS 16 4.554 -5.754 -6.156
115 HZ3 LYS 16 HZ3 LYS 16 3.985 -5.706 -4.504
116 H ILE 17 H ILE 17 1.482 -9.214 -0.712
117 HA ILE 17 HA ILE 17 0.920 -6.584 -1.809
118 HB ILE 17 HB ILE 17 -0.942 -8.623 -0.499
119 HG12 ILE 17 HG12 ILE 17 0.024 -9.515 -2.596
120 HG13 ILE 17 HG13 ILE 17 -1.701 -9.150 -2.789
121 HG21 ILE 17 HG21 ILE 17 -2.007 -6.465 -0.242
122 HG22 ILE 17 HG22 ILE 17 -1.598 -5.967 -1.903
123 HG23 ILE 17 HG23 ILE 17 -2.806 -7.251 -1.620
124 HD11 ILE 17 HD11 ILE 17 0.629 -7.475 -3.926
125 HD12 ILE 17 HD12 ILE 17 -0.510 -8.502 -4.814
126 HD13 ILE 17 HD13 ILE 17 -1.099 -7.017 -4.029
127 H HIS 18 H HIS 18 0.703 -7.964 1.589
128 HA HIS 18 HA HIS 18 -0.417 -5.569 2.633
129 HB2 HIS 18 HB2 HIS 18 1.459 -7.513 4.117
130 HB3 HIS 18 HB3 HIS 18 0.543 -6.171 4.837
131 HD1 HIS 18 HD1 HIS 18 -0.342 -8.194 6.263
132 HD2 HIS 18 HD2 HIS 18 -1.751 -7.889 2.304
133 HE1 HIS 18 HE1 HIS 18 -2.474 -9.520 6.191
134 H GLN 19 H GLN 19 3.096 -6.619 2.330
135 HA GLN 19 HA GLN 19 4.159 -4.272 3.443
136 HB2 GLN 19 HB2 GLN 19 5.575 -6.222 2.931
137 HB3 GLN 19 HB3 GLN 19 5.390 -5.938 1.174
138 HG2 GLN 19 HG2 GLN 19 6.529 -3.728 1.387
139 HG3 GLN 19 HG3 GLN 19 6.626 -3.933 3.164
140 HE21 GLN 19 HE21 GLN 19 9.034 -3.440 2.329
141 HE22 GLN 19 HE22 GLN 19 9.979 -4.860 2.070
142 H GLN 20 H GLN 20 3.482 -4.926 -0.102
143 HA GLN 20 HA GLN 20 4.210 -2.379 -0.995
144 HB2 GLN 20 HB2 GLN 20 3.519 -4.187 -2.554
145 HB3 GLN 20 HB3 GLN 20 1.843 -4.121 -1.945
146 HG2 GLN 20 HG2 GLN 20 1.605 -1.762 -2.795
147 HG3 GLN 20 HG3 GLN 20 3.284 -1.805 -3.384
148 HE21 GLN 20 HE21 GLN 20 3.782 -3.299 -5.259
149 HE22 GLN 20 HE22 GLN 20 2.484 -3.879 -6.236
150 H ASP 21 H ASP 21 1.029 -3.469 0.444
151 HA ASP 21 HA ASP 21 -0.229 -0.967 -0.124
152 HB2 ASP 21 HB2 ASP 21 -1.031 -3.104 1.929
153 HB3 ASP 21 HB3 ASP 21 -2.034 -1.723 1.412
154 H PHE 22 H PHE 22 0.913 -2.267 3.191
155 HA PHE 22 HA PHE 22 0.227 0.236 4.322
156 HB2 PHE 22 HB2 PHE 22 1.425 -0.355 6.350
157 HB3 PHE 22 HB3 PHE 22 0.346 -1.649 5.793
158 HD1 PHE 22 HD1 PHE 22 3.979 -0.550 5.708
159 HD2 PHE 22 HD2 PHE 22 1.248 -3.866 5.515
160 HE1 PHE 22 HE1 PHE 22 5.855 -2.116 6.052
161 HE2 PHE 22 HE2 PHE 22 3.121 -5.430 5.911
162 HZ PHE 22 HZ PHE 22 5.430 -4.557 6.211
163 H VAL 23 H VAL 23 3.346 -0.908 2.839
164 HA VAL 23 HA VAL 23 4.840 1.350 3.783
165 HB VAL 23 HB VAL 23 5.201 -0.319 1.232
166 HG11 VAL 23 HG11 VAL 23 7.502 0.738 1.101
167 HG12 VAL 23 HG12 VAL 23 6.190 1.891 0.784
168 HG13 VAL 23 HG13 VAL 23 7.015 1.894 2.373
169 HG21 VAL 23 HG21 VAL 23 6.795 -0.262 3.886
170 HG22 VAL 23 HG22 VAL 23 5.629 -1.529 3.434
171 HG23 VAL 23 HG23 VAL 23 7.119 -1.318 2.484
172 H ASN 24 H ASN 24 2.926 0.837 0.689
173 HA ASN 24 HA ASN 24 3.521 3.421 -0.296
174 HB2 ASN 24 HB2 ASN 24 2.505 1.663 -1.745
175 HB3 ASN 24 HB3 ASN 24 0.990 1.740 -0.814
176 HD21 ASN 24 HD21 ASN 24 3.296 3.905 -2.709
177 HD22 ASN 24 HD22 ASN 24 2.039 4.912 -3.326
178 H TRP 25 H TRP 25 0.652 2.256 1.655
179 HA TRP 25 HA TRP 25 -0.716 4.711 1.756
180 HB2 TRP 25 HB2 TRP 25 -1.808 2.740 2.738
181 HB3 TRP 25 HB3 TRP 25 -0.429 2.481 3.829
182 HD1 TRP 25 HD1 TRP 25 -2.500 5.768 3.380
183 HE1 TRP 25 HE1 TRP 25 -3.272 6.489 5.664
184 HE3 TRP 25 HE3 TRP 25 -0.641 1.828 6.215
185 HZ2 TRP 25 HZ2 TRP 25 -3.234 5.613 8.255
186 HZ3 TRP 25 HZ3 TRP 25 -1.038 1.913 8.678
187 HH2 TRP 25 HH2 TRP 25 -2.305 3.783 9.688
188 H LEU 26 H LEU 26 1.896 3.474 4.017
189 HA LEU 26 HA LEU 26 1.547 5.687 5.782
190 HB2 LEU 26 HB2 LEU 26 3.935 3.821 5.367
191 HB3 LEU 26 HB3 LEU 26 3.876 5.019 6.676
192 HG LEU 26 HG LEU 26 1.704 2.852 6.377
193 HD11 LEU 26 HD11 LEU 26 4.253 2.737 8.098
194 HD12 LEU 26 HD12 LEU 26 3.950 1.752 6.641
195 HD13 LEU 26 HD13 LEU 26 2.933 1.531 8.087
196 HD21 LEU 26 HD21 LEU 26 2.534 4.628 8.756
197 HD22 LEU 26 HD22 LEU 26 1.331 3.317 8.823
198 HD23 LEU 26 HD23 LEU 26 1.006 4.755 7.842
199 H LEU 27 H LEU 27 4.116 5.183 3.183
200 HA LEU 27 HA LEU 27 5.194 7.782 3.704
201 HB2 LEU 27 HB2 LEU 27 6.494 7.599 1.691
202 HB3 LEU 27 HB3 LEU 27 6.429 6.041 2.532
203 HG LEU 27 HG LEU 27 4.462 5.491 0.797
204 HD11 LEU 27 HD11 LEU 27 4.301 7.821 -0.241
205 HD12 LEU 27 HD12 LEU 27 4.745 6.584 -1.434
206 HD13 LEU 27 HD13 LEU 27 5.995 7.667 -0.767
207 HD21 LEU 27 HD21 LEU 27 6.136 4.580 -0.817
208 HD22 LEU 27 HD22 LEU 27 6.653 4.306 0.866
209 HD23 LEU 27 HD23 LEU 27 7.404 5.614 -0.089
210 H ALA 28 H ALA 28 2.421 6.691 1.644
211 HA ALA 28 HA ALA 28 2.110 9.308 0.423
212 HB1 ALA 28 HB1 ALA 28 1.172 7.222 -0.612
213 HB2 ALA 28 HB2 ALA 28 0.046 7.047 0.769
214 HB3 ALA 28 HB3 ALA 28 -0.099 8.449 -0.328
215 H GLN 29 H GLN 29 1.139 7.913 3.599
216 HA GLN 29 HA GLN 29 -1.191 9.360 4.041
217 HB2 GLN 29 HB2 GLN 29 -0.276 7.632 5.598
218 HB3 GLN 29 HB3 GLN 29 0.988 8.765 6.137
219 HG2 GLN 29 HG2 GLN 29 -0.911 10.387 6.823
220 HG3 GLN 29 HG3 GLN 29 -2.050 9.045 6.557
221 HE21 GLN 29 HE21 GLN 29 -0.845 6.783 7.709
222 HE22 GLN 29 HE22 GLN 29 -0.477 7.104 9.357
223 H LYS 30 H LYS 30 2.244 10.418 4.916
224 HA LYS 30 HA LYS 30 1.295 12.991 5.670
225 HB2 LYS 30 HB2 LYS 30 3.571 13.781 5.786
226 HB3 LYS 30 HB3 LYS 30 3.406 12.175 6.507
227 HG2 LYS 30 HG2 LYS 30 5.505 12.200 5.377
228 HG3 LYS 30 HG3 LYS 30 4.450 11.123 4.456
229 HD2 LYS 30 HD2 LYS 30 5.925 12.517 3.028
230 HD3 LYS 30 HD3 LYS 30 4.225 12.781 2.646
231 HE2 LYS 30 HE2 LYS 30 5.516 14.883 2.599
232 HE3 LYS 30 HE3 LYS 30 4.262 14.980 3.846
233 HZ1 LYS 30 HZ1 LYS 30 7.187 14.316 4.355
234 HZ2 LYS 30 HZ2 LYS 30 5.975 14.565 5.587
235 HZ3 LYS 30 HZ3 LYS 30 6.457 15.880 4.586
236 H GLY 31 H GLY 31 1.950 11.664 2.417
237 HA2 GLY 31 HA2 GLY 31 2.354 14.083 1.066
238 HA3 GLY 31 HA3 GLY 31 1.484 12.687 0.378
239 H LYS 32 H LYS 32 -0.709 12.834 2.603
240 HA LYS 32 HA LYS 32 -2.414 14.518 1.091
241 HB2 LYS 32 HB2 LYS 32 -4.144 14.121 2.678
242 HB3 LYS 32 HB3 LYS 32 -3.160 12.639 2.658
243 HG2 LYS 32 HG2 LYS 32 -1.938 13.660 4.766
244 HG3 LYS 32 HG3 LYS 32 -3.226 14.890 4.763
245 HD2 LYS 32 HD2 LYS 32 -4.948 13.094 5.027
246 HD3 LYS 32 HD3 LYS 32 -3.674 11.842 4.977
247 HE2 LYS 32 HE2 LYS 32 -2.631 12.754 7.039
248 HE3 LYS 32 HE3 LYS 32 -3.839 14.068 7.102
249 HZ1 LYS 32 HZ1 LYS 32 -4.456 11.099 7.311
250 HZ2 LYS 32 HZ2 LYS 32 -5.629 12.394 7.390
251 HZ3 LYS 32 HZ3 LYS 32 -4.427 12.232 8.632
252 H LYS 33 H LYS 33 -0.278 15.245 3.974
253 HA LYS 33 HA LYS 33 -1.454 17.810 4.467
254 HB2 LYS 33 HB2 LYS 33 1.389 16.784 5.004
255 HB3 LYS 33 HB3 LYS 33 0.957 18.496 5.184
256 HG2 LYS 33 HG2 LYS 33 0.839 17.386 7.356
257 HG3 LYS 33 HG3 LYS 33 -0.753 18.013 6.855
258 HD2 LYS 33 HD2 LYS 33 -1.501 15.731 6.249
259 HD3 LYS 33 HD3 LYS 33 0.138 15.079 6.527
260 HE2 LYS 33 HE2 LYS 33 -1.296 14.491 8.413
261 HE3 LYS 33 HE3 LYS 33 -0.057 15.638 8.972
262 HZ1 LYS 33 HZ1 LYS 33 -1.734 17.449 8.953
263 HZ2 LYS 33 HZ2 LYS 33 -2.320 16.115 9.871
264 HZ3 LYS 33 HZ3 LYS 33 -2.926 16.372 8.262
265 H ASN 34 H ASN 34 1.440 16.770 2.451
266 HA ASN 34 HA ASN 34 1.968 19.269 1.364
267 HB2 ASN 34 HB2 ASN 34 3.418 17.295 0.897
268 HB3 ASN 34 HB3 ASN 34 2.136 16.562 -0.090
269 HD21 ASN 34 HD21 ASN 34 4.218 19.583 0.125
270 HD22 ASN 34 HD22 ASN 34 4.221 19.849 -1.579
271 H ASP 35 H ASP 35 -0.541 16.834 0.279
272 HA ASP 35 HA ASP 35 -1.332 18.760 -1.882
273 HB2 ASP 35 HB2 ASP 35 -1.888 15.763 -1.629
274 HB3 ASP 35 HB3 ASP 35 -2.204 16.799 -3.048
275 H TRP 36 H TRP 36 -2.278 18.943 1.087
276 HA TRP 36 HA TRP 36 -4.935 19.592 0.150
277 HB2 TRP 36 HB2 TRP 36 -5.460 17.238 0.658
278 HB3 TRP 36 HB3 TRP 36 -4.867 17.421 2.329
279 HD1 TRP 36 HD1 TRP 36 -7.711 18.653 0.015
280 HE1 TRP 36 HE1 TRP 36 -9.486 19.785 1.403
281 HE3 TRP 36 HE3 TRP 36 -5.425 18.457 4.663
282 HZ2 TRP 36 HZ2 TRP 36 -9.880 20.672 3.968
283 HZ3 TRP 36 HZ3 TRP 36 -6.578 19.619 6.558
284 HH2 TRP 36 HH2 TRP 36 -8.791 20.675 6.222
285 H LYS 37 H LYS 37 -3.220 19.001 3.369
286 HA LYS 37 HA LYS 37 -4.531 21.294 4.502
287 HB2 LYS 37 HB2 LYS 37 -3.390 19.383 5.807
288 HB3 LYS 37 HB3 LYS 37 -1.839 20.167 5.501
289 HG2 LYS 37 HG2 LYS 37 -4.271 21.254 7.052
290 HG3 LYS 37 HG3 LYS 37 -2.708 20.751 7.736
291 HD2 LYS 37 HD2 LYS 37 -3.217 23.242 5.996
292 HD3 LYS 37 HD3 LYS 37 -2.977 23.209 7.744
293 HE2 LYS 37 HE2 LYS 37 -0.651 22.426 7.514
294 HE3 LYS 37 HE3 LYS 37 -0.804 22.320 5.746
295 HZ1 LYS 37 HZ1 LYS 37 -1.217 24.745 5.625
296 HZ2 LYS 37 HZ2 LYS 37 0.302 24.406 6.396
297 HZ3 LYS 37 HZ3 LYS 37 -1.072 24.874 7.356
298 H HIS 38 H HIS 38 -1.071 20.760 3.338
299 HA HIS 38 HA HIS 38 -0.532 23.556 3.457
300 HB2 HIS 38 HB2 HIS 38 1.262 21.799 3.512
301 HB3 HIS 38 HB3 HIS 38 0.958 21.457 1.783
302 HD1 HIS 38 HD1 HIS 38 1.401 23.487 0.144
303 HD2 HIS 38 HD2 HIS 38 2.689 24.022 4.106
304 HE1 HIS 38 HE1 HIS 38 2.953 25.486 0.090
305 H ASN 39 H ASN 39 -1.858 21.422 0.810
306 HA ASN 39 HA ASN 39 -1.467 23.103 -1.354
307 HB2 ASN 39 HB2 ASN 39 -2.735 20.928 -1.486
308 HB3 ASN 39 HB3 ASN 39 -4.111 21.697 -0.655
309 HD21 ASN 39 HD21 ASN 39 -5.322 23.482 -1.821
310 HD22 ASN 39 HD22 ASN 39 -5.188 23.580 -3.535
311 H ILE 40 H ILE 40 -3.838 23.519 1.384
312 HA ILE 40 HA ILE 40 -5.322 25.602 0.137
313 HB ILE 40 HB ILE 40 -4.778 25.096 3.104
314 HG12 ILE 40 HG12 ILE 40 -7.398 24.698 1.537
315 HG13 ILE 40 HG13 ILE 40 -6.183 23.413 1.622
316 HG21 ILE 40 HG21 ILE 40 -5.278 27.516 2.826
317 HG22 ILE 40 HG22 ILE 40 -6.688 27.133 1.801
318 HG23 ILE 40 HG23 ILE 40 -6.691 26.721 3.537
319 HD11 ILE 40 HD11 ILE 40 -6.313 23.382 4.126
320 HD12 ILE 40 HD12 ILE 40 -7.616 24.607 4.070
321 HD13 ILE 40 HD13 ILE 40 -7.870 23.001 3.341
322 H THR 41 H THR 41 -2.471 25.872 2.490
323 HA THR 41 HA THR 41 -2.434 28.689 2.157
324 HB THR 41 HB THR 41 -1.297 27.501 4.064
325 HG1 THR 41 HG1 THR 41 0.221 29.480 2.656
326 HG21 THR 41 HG21 THR 41 1.012 27.099 2.035
327 HG22 THR 41 HG22 THR 41 0.077 25.804 2.834
328 HG23 THR 41 HG23 THR 41 1.111 26.876 3.802
329 H GLN 42 H GLN 42 -0.867 26.053 0.208
330 HA GLN 42 HA GLN 42 0.999 27.617 -1.127
331 HB2 GLN 42 HB2 GLN 42 0.711 25.139 -1.529
332 HB3 GLN 42 HB3 GLN 42 -0.798 25.465 -2.416
333 HG2 GLN 42 HG2 GLN 42 1.073 25.119 -4.010
334 HG3 GLN 42 HG3 GLN 42 0.482 26.787 -4.132
335 HE21 GLN 42 HE21 GLN 42 3.074 24.741 -2.526
336 HE22 GLN 42 HE22 GLN 42 4.232 26.019 -2.470
Start of MODEL 10
1 H1 TYR 1 H1 TYR 1 -7.047 -14.378 14.543
2 HA TYR 1 HA TYR 1 -6.697 -13.465 11.731
3 HB2 TYR 1 HB2 TYR 1 -4.551 -13.787 13.930
4 HB3 TYR 1 HB3 TYR 1 -4.213 -13.311 12.251
5 HD1 TYR 1 HD1 TYR 1 -5.174 -11.165 11.321
6 HD2 TYR 1 HD2 TYR 1 -5.456 -12.113 15.509
7 HE1 TYR 1 HE1 TYR 1 -5.657 -8.802 11.816
8 HE2 TYR 1 HE2 TYR 1 -5.930 -9.737 16.007
9 HH TYR 1 HH TYR 1 -6.073 -7.180 13.522
10 H ALA 2 H ALA 2 -5.018 -14.907 10.489
11 HA ALA 2 HA ALA 2 -5.764 -17.735 11.010
12 HB1 ALA 2 HB1 ALA 2 -5.870 -16.836 8.695
13 HB2 ALA 2 HB2 ALA 2 -4.117 -16.485 8.735
14 HB3 ALA 2 HB3 ALA 2 -4.698 -18.177 8.841
15 H GLU 3 H GLU 3 -4.537 -17.487 13.223
16 HA GLU 3 HA GLU 3 -1.687 -17.222 13.155
17 HB2 GLU 3 HB2 GLU 3 -2.988 -17.001 15.260
18 HB3 GLU 3 HB3 GLU 3 -3.483 -18.715 15.165
19 HG2 GLU 3 HG2 GLU 3 -1.085 -19.437 15.421
20 HG3 GLU 3 HG3 GLU 3 -0.576 -17.729 15.494
21 H GLY 4 H GLY 4 -0.020 -18.956 12.966
22 HA2 GLY 4 HA2 GLY 4 0.629 -21.224 12.806
23 HA3 GLY 4 HA3 GLY 4 -1.046 -21.731 12.536
24 H THR 5 H THR 5 -1.650 -19.697 10.331
25 HA THR 5 HA THR 5 -0.513 -21.287 8.219
26 HB THR 5 HB THR 5 -1.474 -19.572 6.649
27 HG1 THR 5 HG1 THR 5 -1.405 -17.672 8.057
28 HG21 THR 5 HG21 THR 5 -2.854 -21.512 7.408
29 HG22 THR 5 HG22 THR 5 -3.849 -20.049 7.167
30 HG23 THR 5 HG23 THR 5 -3.417 -20.571 8.821
31 H PHE 6 H PHE 6 0.391 -18.050 9.709
32 HA PHE 6 HA PHE 6 2.353 -17.549 7.697
33 HB2 PHE 6 HB2 PHE 6 3.403 -15.944 9.189
34 HB3 PHE 6 HB3 PHE 6 1.640 -15.748 9.249
35 HD1 PHE 6 HD1 PHE 6 4.634 -17.108 11.071
36 HD2 PHE 6 HD2 PHE 6 0.440 -16.167 11.371
37 HE1 PHE 6 HE1 PHE 6 4.768 -17.274 13.534
38 HE2 PHE 6 HE2 PHE 6 0.591 -16.314 13.829
39 HZ PHE 6 HZ PHE 6 2.736 -16.931 14.919
40 H ILE 7 H ILE 7 2.342 -19.801 10.508
41 HA ILE 7 HA ILE 7 5.248 -20.052 10.478
42 HB ILE 7 HB ILE 7 3.147 -21.958 11.643
43 HG12 ILE 7 HG12 ILE 7 4.901 -19.786 12.956
44 HG13 ILE 7 HG13 ILE 7 3.139 -19.692 12.708
45 HG21 ILE 7 HG21 ILE 7 5.054 -23.038 12.812
46 HG22 ILE 7 HG22 ILE 7 5.342 -23.094 11.071
47 HG23 ILE 7 HG23 ILE 7 6.199 -21.884 12.065
48 HD11 ILE 7 HD11 ILE 7 3.501 -20.258 15.022
49 HD12 ILE 7 HD12 ILE 7 2.844 -21.714 14.222
50 HD13 ILE 7 HD13 ILE 7 4.588 -21.606 14.624
51 H SER 8 H SER 8 2.441 -22.089 9.211
52 HA SER 8 HA SER 8 4.426 -23.806 7.875
53 HB2 SER 8 HB2 SER 8 2.489 -24.813 9.000
54 HB3 SER 8 HB3 SER 8 1.358 -23.997 7.897
55 HG SER 8 HG SER 8 2.448 -25.229 6.157
56 H ASP 9 H ASP 9 1.482 -21.919 6.683
57 HA ASP 9 HA ASP 9 2.297 -22.343 3.953
58 HB2 ASP 9 HB2 ASP 9 0.398 -20.188 5.056
59 HB3 ASP 9 HB3 ASP 9 0.540 -20.690 3.355
60 H TYR 10 H TYR 10 3.083 -19.790 6.392
61 HA TYR 10 HA TYR 10 4.432 -17.947 6.220
62 HB2 TYR 10 HB2 TYR 10 5.336 -18.811 3.431
63 HB3 TYR 10 HB3 TYR 10 6.023 -17.565 4.475
64 HD1 TYR 10 HD1 TYR 10 7.003 -18.219 6.732
65 HD2 TYR 10 HD2 TYR 10 5.811 -21.193 3.859
66 HE1 TYR 10 HE1 TYR 10 8.265 -19.923 7.980
67 HE2 TYR 10 HE2 TYR 10 7.112 -22.893 5.093
68 HH TYR 10 HH TYR 10 8.987 -22.201 8.047
69 H SER 11 H SER 11 3.065 -18.231 2.800
70 HA SER 11 HA SER 11 0.907 -16.520 3.459
71 HB2 SER 11 HB2 SER 11 1.710 -14.493 2.103
72 HB3 SER 11 HB3 SER 11 2.350 -14.593 3.755
73 HG SER 11 HG SER 11 4.332 -15.464 2.754
74 H ILE 12 H ILE 12 3.312 -16.797 0.714
75 HA ILE 12 HA ILE 12 2.977 -17.572 -1.419
76 HB ILE 12 HB ILE 12 -0.025 -17.912 -0.963
77 HG12 ILE 12 HG12 ILE 12 2.259 -19.995 -0.925
78 HG13 ILE 12 HG13 ILE 12 1.453 -19.384 0.537
79 HG21 ILE 12 HG21 ILE 12 0.656 -17.522 -3.330
80 HG22 ILE 12 HG22 ILE 12 1.796 -18.893 -3.222
81 HG23 ILE 12 HG23 ILE 12 0.038 -19.161 -3.073
82 HD11 ILE 12 HD11 ILE 12 -0.757 -20.276 -0.299
83 HD12 ILE 12 HD12 ILE 12 0.104 -21.051 -1.666
84 HD13 ILE 12 HD13 ILE 12 0.471 -21.536 0.004
85 H ALA 13 H ALA 13 0.146 -15.412 -0.384
86 HA ALA 13 HA ALA 13 1.362 -13.267 -2.038
87 HB1 ALA 13 HB1 ALA 13 0.117 -14.661 -3.706
88 HB2 ALA 13 HB2 ALA 13 -1.355 -14.569 -2.695
89 HB3 ALA 13 HB3 ALA 13 -0.699 -13.088 -3.465
90 H MET 14 H MET 14 1.435 -12.762 0.426
91 HA MET 14 HA MET 14 -0.852 -10.946 0.922
92 HB2 MET 14 HB2 MET 14 -0.076 -13.076 3.004
93 HB3 MET 14 HB3 MET 14 -1.180 -11.705 3.258
94 HG2 MET 14 HG2 MET 14 -2.685 -12.632 1.423
95 HG3 MET 14 HG3 MET 14 -1.638 -14.085 1.340
96 HE1 MET 14 HE1 MET 14 -1.572 -15.956 3.162
97 HE2 MET 14 HE2 MET 14 -0.925 -14.848 4.422
98 HE3 MET 14 HE3 MET 14 -2.361 -15.855 4.768
99 H ASP 15 H ASP 15 2.166 -12.273 2.618
100 HA ASP 15 HA ASP 15 2.664 -9.894 3.993
101 HB2 ASP 15 HB2 ASP 15 4.760 -11.841 2.853
102 HB3 ASP 15 HB3 ASP 15 5.028 -10.666 4.172
103 H LYS 16 H LYS 16 3.710 -10.873 0.600
104 HA LYS 16 HA LYS 16 5.258 -8.488 0.246
105 HB2 LYS 16 HB2 LYS 16 5.466 -10.401 -1.334
106 HB3 LYS 16 HB3 LYS 16 3.774 -10.205 -1.830
107 HG2 LYS 16 HG2 LYS 16 5.350 -9.269 -3.523
108 HG3 LYS 16 HG3 LYS 16 4.214 -8.049 -2.904
109 HD2 LYS 16 HD2 LYS 16 6.479 -7.115 -3.203
110 HD3 LYS 16 HD3 LYS 16 5.993 -7.028 -1.506
111 HE2 LYS 16 HE2 LYS 16 7.430 -9.047 -0.995
112 HE3 LYS 16 HE3 LYS 16 7.858 -9.165 -2.725
113 HZ1 LYS 16 HZ1 LYS 16 8.913 -6.920 -2.569
114 HZ2 LYS 16 HZ2 LYS 16 9.603 -8.020 -1.408
115 HZ3 LYS 16 HZ3 LYS 16 8.459 -6.819 -0.890
116 H ILE 17 H ILE 17 1.749 -9.306 -0.349
117 HA ILE 17 HA ILE 17 1.147 -6.767 -1.517
118 HB ILE 17 HB ILE 17 -0.763 -8.478 0.171
119 HG12 ILE 17 HG12 ILE 17 -0.096 -9.991 -1.583
120 HG13 ILE 17 HG13 ILE 17 -1.636 -9.298 -2.091
121 HG21 ILE 17 HG21 ILE 17 -1.618 -6.208 -0.100
122 HG22 ILE 17 HG22 ILE 17 -1.304 -6.226 -1.855
123 HG23 ILE 17 HG23 ILE 17 -2.560 -7.281 -1.149
124 HD11 ILE 17 HD11 ILE 17 1.171 -8.550 -3.146
125 HD12 ILE 17 HD12 ILE 17 -0.137 -9.380 -4.021
126 HD13 ILE 17 HD13 ILE 17 -0.318 -7.657 -3.593
127 H HIS 18 H HIS 18 1.448 -7.835 1.942
128 HA HIS 18 HA HIS 18 0.363 -5.384 2.984
129 HB2 HIS 18 HB2 HIS 18 2.436 -7.214 4.319
130 HB3 HIS 18 HB3 HIS 18 1.381 -6.038 5.131
131 HD1 HIS 18 HD1 HIS 18 1.283 -8.797 6.083
132 HD2 HIS 18 HD2 HIS 18 -1.151 -7.440 2.926
133 HE1 HIS 18 HE1 HIS 18 -0.681 -10.379 5.995
134 H GLN 19 H GLN 19 3.764 -6.555 2.305
135 HA GLN 19 HA GLN 19 5.142 -4.305 3.174
136 HB2 GLN 19 HB2 GLN 19 6.179 -6.446 2.193
137 HB3 GLN 19 HB3 GLN 19 5.783 -5.814 0.579
138 HG2 GLN 19 HG2 GLN 19 8.136 -5.286 1.078
139 HG3 GLN 19 HG3 GLN 19 7.217 -3.765 1.054
140 HE21 GLN 19 HE21 GLN 19 8.377 -6.404 3.345
141 HE22 GLN 19 HE22 GLN 19 8.634 -5.330 4.667
142 H GLN 20 H GLN 20 3.422 -4.844 0.015
143 HA GLN 20 HA GLN 20 4.219 -2.248 -1.020
144 HB2 GLN 20 HB2 GLN 20 1.930 -4.142 -1.794
145 HB3 GLN 20 HB3 GLN 20 2.348 -2.660 -2.695
146 HG2 GLN 20 HG2 GLN 20 4.586 -3.507 -3.243
147 HG3 GLN 20 HG3 GLN 20 4.366 -4.948 -2.217
148 HE21 GLN 20 HE21 GLN 20 5.127 -5.464 -4.785
149 HE22 GLN 20 HE22 GLN 20 3.791 -6.094 -5.678
150 H ASP 21 H ASP 21 1.209 -3.506 0.679
151 HA ASP 21 HA ASP 21 -0.193 -1.065 0.271
152 HB2 ASP 21 HB2 ASP 21 -0.670 -3.205 2.418
153 HB3 ASP 21 HB3 ASP 21 -1.751 -1.834 2.063
154 H PHE 22 H PHE 22 1.381 -2.258 3.451
155 HA PHE 22 HA PHE 22 0.702 0.221 4.632
156 HB2 PHE 22 HB2 PHE 22 2.182 -0.239 6.499
157 HB3 PHE 22 HB3 PHE 22 1.154 -1.630 6.103
158 HD1 PHE 22 HD1 PHE 22 4.648 -0.237 5.683
159 HD2 PHE 22 HD2 PHE 22 2.176 -3.758 5.596
160 HE1 PHE 22 HE1 PHE 22 6.667 -1.663 5.755
161 HE2 PHE 22 HE2 PHE 22 4.198 -5.180 5.629
162 HZ PHE 22 HZ PHE 22 6.448 -4.137 5.769
163 H VAL 23 H VAL 23 3.717 -0.776 2.829
164 HA VAL 23 HA VAL 23 5.162 1.583 3.541
165 HB VAL 23 HB VAL 23 5.279 -0.103 0.981
166 HG11 VAL 23 HG11 VAL 23 7.430 1.117 0.468
167 HG12 VAL 23 HG12 VAL 23 5.986 2.140 0.308
168 HG13 VAL 23 HG13 VAL 23 7.032 2.292 1.756
169 HG21 VAL 23 HG21 VAL 23 7.287 0.204 3.321
170 HG22 VAL 23 HG22 VAL 23 6.141 -1.149 3.175
171 HG23 VAL 23 HG23 VAL 23 7.415 -0.933 1.949
172 H ASN 24 H ASN 24 3.010 0.940 0.620
173 HA ASN 24 HA ASN 24 3.331 3.551 -0.380
174 HB2 ASN 24 HB2 ASN 24 2.307 1.737 -1.748
175 HB3 ASN 24 HB3 ASN 24 0.868 1.734 -0.701
176 HD21 ASN 24 HD21 ASN 24 2.869 3.958 -2.843
177 HD22 ASN 24 HD22 ASN 24 1.538 4.968 -3.262
178 H TRP 25 H TRP 25 0.732 2.177 1.783
179 HA TRP 25 HA TRP 25 -0.874 4.451 1.937
180 HB2 TRP 25 HB2 TRP 25 -1.591 2.330 3.019
181 HB3 TRP 25 HB3 TRP 25 -0.166 2.381 4.085
182 HD1 TRP 25 HD1 TRP 25 -2.678 5.317 3.514
183 HE1 TRP 25 HE1 TRP 25 -3.589 5.984 5.757
184 HE3 TRP 25 HE3 TRP 25 -0.421 1.692 6.484
185 HZ2 TRP 25 HZ2 TRP 25 -3.483 5.193 8.379
186 HZ3 TRP 25 HZ3 TRP 25 -0.893 1.778 8.936
187 HH2 TRP 25 HH2 TRP 25 -2.389 3.512 9.871
188 H LEU 26 H LEU 26 2.043 3.615 3.996
189 HA LEU 26 HA LEU 26 1.517 5.878 5.720
190 HB2 LEU 26 HB2 LEU 26 4.016 4.147 5.385
191 HB3 LEU 26 HB3 LEU 26 3.835 5.376 6.656
192 HG LEU 26 HG LEU 26 1.871 3.008 6.360
193 HD11 LEU 26 HD11 LEU 26 4.163 2.113 6.775
194 HD12 LEU 26 HD12 LEU 26 3.133 1.907 8.213
195 HD13 LEU 26 HD13 LEU 26 4.350 3.216 8.171
196 HD21 LEU 26 HD21 LEU 26 2.380 4.966 8.678
197 HD22 LEU 26 HD22 LEU 26 1.338 3.523 8.763
198 HD23 LEU 26 HD23 LEU 26 0.888 4.865 7.699
199 H LEU 27 H LEU 27 4.047 5.356 3.086
200 HA LEU 27 HA LEU 27 4.971 8.037 3.384
201 HB2 LEU 27 HB2 LEU 27 6.096 7.870 1.252
202 HB3 LEU 27 HB3 LEU 27 6.257 6.366 2.179
203 HG LEU 27 HG LEU 27 4.223 5.523 0.688
204 HD11 LEU 27 HD11 LEU 27 5.325 7.742 -1.156
205 HD12 LEU 27 HD12 LEU 27 3.678 7.723 -0.491
206 HD13 LEU 27 HD13 LEU 27 4.173 6.465 -1.631
207 HD21 LEU 27 HD21 LEU 27 5.820 4.686 -1.049
208 HD22 LEU 27 HD22 LEU 27 6.538 4.591 0.578
209 HD23 LEU 27 HD23 LEU 27 7.021 5.906 -0.529
210 H ALA 28 H ALA 28 2.115 6.687 1.623
211 HA ALA 28 HA ALA 28 1.607 9.201 0.247
212 HB1 ALA 28 HB1 ALA 28 0.711 7.037 -0.621
213 HB2 ALA 28 HB2 ALA 28 -0.304 6.860 0.845
214 HB3 ALA 28 HB3 ALA 28 -0.603 8.206 -0.293
215 H GLN 29 H GLN 29 0.754 7.870 3.515
216 HA GLN 29 HA GLN 29 -1.466 9.531 4.014
217 HB2 GLN 29 HB2 GLN 29 -0.713 7.720 5.560
218 HB3 GLN 29 HB3 GLN 29 0.747 8.659 5.973
219 HG2 GLN 29 HG2 GLN 29 -0.703 10.503 6.916
220 HG3 GLN 29 HG3 GLN 29 -2.150 9.522 6.568
221 HE21 GLN 29 HE21 GLN 29 -2.126 7.196 7.590
222 HE22 GLN 29 HE22 GLN 29 -1.376 7.033 9.134
223 H LYS 30 H LYS 30 2.110 10.199 4.360
224 HA LYS 30 HA LYS 30 1.551 12.989 5.114
225 HB2 LYS 30 HB2 LYS 30 3.589 11.520 5.801
226 HB3 LYS 30 HB3 LYS 30 4.255 11.869 4.188
227 HG2 LYS 30 HG2 LYS 30 3.533 13.891 6.421
228 HG3 LYS 30 HG3 LYS 30 5.165 13.356 5.947
229 HD2 LYS 30 HD2 LYS 30 4.787 14.408 3.644
230 HD3 LYS 30 HD3 LYS 30 3.248 15.073 4.264
231 HE2 LYS 30 HE2 LYS 30 4.456 16.286 6.078
232 HE3 LYS 30 HE3 LYS 30 6.015 15.656 5.473
233 HZ1 LYS 30 HZ1 LYS 30 5.693 16.832 3.364
234 HZ2 LYS 30 HZ2 LYS 30 5.556 17.954 4.682
235 HZ3 LYS 30 HZ3 LYS 30 4.116 17.412 3.876
236 H GLY 31 H GLY 31 2.864 11.153 2.200
237 HA2 GLY 31 HA2 GLY 31 3.421 13.210 0.539
238 HA3 GLY 31 HA3 GLY 31 2.688 11.703 -0.061
239 H LYS 32 H LYS 32 0.014 11.957 1.119
240 HA LYS 32 HA LYS 32 -1.062 13.584 -0.959
241 HB2 LYS 32 HB2 LYS 32 -3.246 13.150 -0.170
242 HB3 LYS 32 HB3 LYS 32 -2.320 11.647 0.076
243 HG2 LYS 32 HG2 LYS 32 -2.038 12.322 2.524
244 HG3 LYS 32 HG3 LYS 32 -3.097 13.730 2.234
245 HD2 LYS 32 HD2 LYS 32 -3.881 10.758 1.986
246 HD3 LYS 32 HD3 LYS 32 -4.331 11.888 3.290
247 HE2 LYS 32 HE2 LYS 32 -5.519 13.333 1.507
248 HE3 LYS 32 HE3 LYS 32 -5.253 12.004 0.348
249 HZ1 LYS 32 HZ1 LYS 32 -6.795 11.781 2.950
250 HZ2 LYS 32 HZ2 LYS 32 -6.502 10.476 1.826
251 HZ3 LYS 32 HZ3 LYS 32 -7.470 11.845 1.354
252 H LYS 33 H LYS 33 -0.467 14.216 2.610
253 HA LYS 33 HA LYS 33 -1.738 16.755 2.579
254 HB2 LYS 33 HB2 LYS 33 -0.816 15.554 4.659
255 HB3 LYS 33 HB3 LYS 33 0.814 16.022 4.139
256 HG2 LYS 33 HG2 LYS 33 0.291 17.732 5.710
257 HG3 LYS 33 HG3 LYS 33 -0.026 18.473 4.134
258 HD2 LYS 33 HD2 LYS 33 -1.957 19.136 5.271
259 HD3 LYS 33 HD3 LYS 33 -2.570 17.595 4.642
260 HE2 LYS 33 HE2 LYS 33 -1.465 18.140 7.465
261 HE3 LYS 33 HE3 LYS 33 -3.172 17.936 7.009
262 HZ1 LYS 33 HZ1 LYS 33 -2.657 15.586 6.329
263 HZ2 LYS 33 HZ2 LYS 33 -2.410 15.906 8.016
264 HZ3 LYS 33 HZ3 LYS 33 -1.031 15.793 6.999
265 H ASN 34 H ASN 34 1.661 15.700 1.774
266 HA ASN 34 HA ASN 34 2.583 18.318 1.217
267 HB2 ASN 34 HB2 ASN 34 4.065 16.253 1.492
268 HB3 ASN 34 HB3 ASN 34 3.534 15.705 -0.112
269 HD21 ASN 34 HD21 ASN 34 5.089 18.578 1.578
270 HD22 ASN 34 HD22 ASN 34 6.051 19.016 0.218
271 H ASP 35 H ASP 35 0.628 16.052 -0.855
272 HA ASP 35 HA ASP 35 0.521 18.239 -2.876
273 HB2 ASP 35 HB2 ASP 35 2.453 16.749 -3.476
274 HB3 ASP 35 HB3 ASP 35 1.364 15.338 -3.431
275 H TRP 36 H TRP 36 -1.509 17.786 -1.133
276 HA TRP 36 HA TRP 36 -3.525 17.257 -3.174
277 HB2 TRP 36 HB2 TRP 36 -3.123 14.966 -2.048
278 HB3 TRP 36 HB3 TRP 36 -3.950 15.609 -0.612
279 HD1 TRP 36 HD1 TRP 36 -4.636 14.017 -3.885
280 HE1 TRP 36 HE1 TRP 36 -7.089 14.041 -4.433
281 HE3 TRP 36 HE3 TRP 36 -6.318 17.413 -0.317
282 HZ2 TRP 36 HZ2 TRP 36 -9.404 15.217 -3.599
283 HZ3 TRP 36 HZ3 TRP 36 -8.757 17.897 -0.270
284 HH2 TRP 36 HH2 TRP 36 -10.289 16.810 -1.883
285 H LYS 37 H LYS 37 -3.278 17.633 0.505
286 HA LYS 37 HA LYS 37 -5.393 19.652 0.444
287 HB2 LYS 37 HB2 LYS 37 -3.287 18.997 2.604
288 HB3 LYS 37 HB3 LYS 37 -4.442 20.344 2.695
289 HG2 LYS 37 HG2 LYS 37 -5.400 18.598 3.991
290 HG3 LYS 37 HG3 LYS 37 -6.365 18.728 2.500
291 HD2 LYS 37 HD2 LYS 37 -5.198 16.643 1.612
292 HD3 LYS 37 HD3 LYS 37 -4.166 16.626 3.055
293 HE2 LYS 37 HE2 LYS 37 -5.893 14.966 3.355
294 HE3 LYS 37 HE3 LYS 37 -6.216 16.286 4.500
295 HZ1 LYS 37 HZ1 LYS 37 -7.612 15.916 1.817
296 HZ2 LYS 37 HZ2 LYS 37 -8.019 17.114 3.023
297 HZ3 LYS 37 HZ3 LYS 37 -8.253 15.440 3.359
298 H HIS 38 H HIS 38 -1.739 19.640 0.709
299 HA HIS 38 HA HIS 38 -1.390 22.411 0.534
300 HB2 HIS 38 HB2 HIS 38 0.499 20.790 0.903
301 HB3 HIS 38 HB3 HIS 38 0.270 20.176 -0.758
302 HD1 HIS 38 HD1 HIS 38 2.756 20.778 -1.085
303 HD2 HIS 38 HD2 HIS 38 0.216 24.072 -0.427
304 HE1 HIS 38 HE1 HIS 38 4.063 22.814 -1.802
305 H ASN 39 H ASN 39 -1.823 19.960 -2.170
306 HA ASN 39 HA ASN 39 -1.502 22.051 -4.181
307 HB2 ASN 39 HB2 ASN 39 -0.733 19.712 -4.550
308 HB3 ASN 39 HB3 ASN 39 -2.416 19.143 -4.511
309 HD21 ASN 39 HD21 ASN 39 -0.148 21.418 -6.271
310 HD22 ASN 39 HD22 ASN 39 -1.008 21.351 -7.763
311 H ILE 40 H ILE 40 -3.320 23.347 -2.938
312 HA ILE 40 HA ILE 40 -5.772 22.909 -4.617
313 HB ILE 40 HB ILE 40 -5.687 23.764 -1.670
314 HG12 ILE 40 HG12 ILE 40 -7.114 21.429 -3.090
315 HG13 ILE 40 HG13 ILE 40 -5.617 21.318 -2.133
316 HG21 ILE 40 HG21 ILE 40 -7.215 25.254 -3.049
317 HG22 ILE 40 HG22 ILE 40 -8.064 23.799 -3.642
318 HG23 ILE 40 HG23 ILE 40 -8.127 24.251 -1.912
319 HD11 ILE 40 HD11 ILE 40 -7.489 20.585 -0.740
320 HD12 ILE 40 HD12 ILE 40 -6.867 22.126 -0.085
321 HD13 ILE 40 HD13 ILE 40 -8.390 22.088 -1.026
322 H THR 41 H THR 41 -4.341 25.532 -2.424
323 HA THR 41 HA THR 41 -4.613 27.466 -4.561
324 HB THR 41 HB THR 41 -2.783 27.491 -2.081
325 HG1 THR 41 HG1 THR 41 -4.599 28.791 -1.283
326 HG21 THR 41 HG21 THR 41 -3.626 29.756 -4.009
327 HG22 THR 41 HG22 THR 41 -1.975 29.082 -3.852
328 HG23 THR 41 HG23 THR 41 -2.704 29.976 -2.492
329 H GLN 42 H GLN 42 -1.841 25.465 -3.167
330 HA GLN 42 HA GLN 42 -0.083 26.226 -5.357
331 HB2 GLN 42 HB2 GLN 42 0.733 25.448 -3.095
332 HB3 GLN 42 HB3 GLN 42 0.145 23.808 -3.467
333 HG2 GLN 42 HG2 GLN 42 2.284 25.353 -5.064
334 HG3 GLN 42 HG3 GLN 42 2.605 24.060 -3.897
335 HE21 GLN 42 HE21 GLN 42 1.545 24.695 -7.258
336 HE22 GLN 42 HE22 GLN 42 1.456 23.030 -7.692
Start of MODEL 11
1 H1 TYR 1 H1 TYR 1 -7.621 -11.910 -0.807
2 HA TYR 1 HA TYR 1 -6.091 -9.353 -0.791
3 HB2 TYR 1 HB2 TYR 1 -8.371 -10.191 1.119
4 HB3 TYR 1 HB3 TYR 1 -7.587 -8.596 1.063
5 HD1 TYR 1 HD2 TYR 1 -7.844 -7.156 -1.037
6 HD2 TYR 1 HD1 TYR 1 -10.143 -10.751 -0.469
7 HE1 TYR 1 HE2 TYR 1 -9.436 -6.425 -2.788
8 HE2 TYR 1 HE1 TYR 1 -11.730 -10.018 -2.200
9 HH TYR 1 HH TYR 1 -12.395 -8.217 -3.633
10 H ALA 2 H ALA 2 -5.087 -8.909 1.532
11 HA ALA 2 HA ALA 2 -3.405 -10.991 2.302
12 HB1 ALA 2 HB1 ALA 2 -4.557 -8.814 4.147
13 HB2 ALA 2 HB2 ALA 2 -3.140 -9.848 4.504
14 HB3 ALA 2 HB3 ALA 2 -3.081 -8.686 3.144
15 H GLU 3 H GLU 3 -6.736 -10.178 3.621
16 HA GLU 3 HA GLU 3 -6.730 -12.358 5.478
17 HB2 GLU 3 HB2 GLU 3 -8.343 -10.482 5.653
18 HB3 GLU 3 HB3 GLU 3 -9.128 -10.992 4.134
19 HG2 GLU 3 HG2 GLU 3 -9.802 -13.170 5.194
20 HG3 GLU 3 HG3 GLU 3 -8.945 -12.721 6.692
21 H GLY 4 H GLY 4 -7.538 -14.617 5.123
22 HA2 GLY 4 HA2 GLY 4 -8.442 -16.362 3.836
23 HA3 GLY 4 HA3 GLY 4 -8.623 -15.271 2.452
24 H THR 5 H THR 5 -6.198 -14.330 1.719
25 HA THR 5 HA THR 5 -4.967 -16.648 0.611
26 HB THR 5 HB THR 5 -3.043 -15.099 0.018
27 HG1 THR 5 HG1 THR 5 -3.360 -12.860 0.727
28 HG21 THR 5 HG21 THR 5 -5.882 -14.025 -0.612
29 HG22 THR 5 HG22 THR 5 -4.972 -15.246 -1.537
30 HG23 THR 5 HG23 THR 5 -4.394 -13.557 -1.467
31 H PHE 6 H PHE 6 -4.128 -14.699 3.621
32 HA PHE 6 HA PHE 6 -1.628 -15.837 3.988
33 HB2 PHE 6 HB2 PHE 6 -1.682 -15.347 6.307
34 HB3 PHE 6 HB3 PHE 6 -2.689 -14.088 5.560
35 HD1 PHE 6 HD2 PHE 6 -2.644 -17.173 7.654
36 HD2 PHE 6 HD1 PHE 6 -5.154 -14.134 5.943
37 HE1 PHE 6 HE2 PHE 6 -4.449 -17.782 9.226
38 HE2 PHE 6 HE1 PHE 6 -6.953 -14.713 7.556
39 HZ PHE 6 HZ PHE 6 -6.609 -16.555 9.183
40 H ILE 7 H ILE 7 -4.888 -17.317 4.544
41 HA ILE 7 HA ILE 7 -3.939 -19.500 6.116
42 HB ILE 7 HB ILE 7 -6.372 -19.400 4.251
43 HG12 ILE 7 HG12 ILE 7 -6.152 -19.141 7.323
44 HG13 ILE 7 HG13 ILE 7 -6.423 -17.787 6.201
45 HG21 ILE 7 HG21 ILE 7 -5.599 -21.771 4.596
46 HG22 ILE 7 HG22 ILE 7 -5.651 -21.516 6.363
47 HG23 ILE 7 HG23 ILE 7 -7.147 -21.480 5.384
48 HD11 ILE 7 HD11 ILE 7 -8.560 -18.348 7.154
49 HD12 ILE 7 HD12 ILE 7 -8.591 -18.868 5.444
50 HD13 ILE 7 HD13 ILE 7 -8.398 -20.071 6.760
51 H SER 8 H SER 8 -4.534 -19.250 2.474
52 HA SER 8 HA SER 8 -3.273 -21.909 2.210
53 HB2 SER 8 HB2 SER 8 -5.229 -21.407 0.810
54 HB3 SER 8 HB3 SER 8 -4.395 -20.017 0.073
55 HG SER 8 HG SER 8 -3.478 -22.729 -0.169
56 H ASP 9 H ASP 9 -2.589 -18.554 0.839
57 HA ASP 9 HA ASP 9 -0.196 -19.455 -0.414
58 HB2 ASP 9 HB2 ASP 9 -0.853 -16.572 0.480
59 HB3 ASP 9 HB3 ASP 9 0.407 -17.100 -0.662
60 H TYR 10 H TYR 10 -0.785 -17.742 2.741
61 HA TYR 10 HA TYR 10 0.550 -17.438 4.566
62 HB2 TYR 10 HB2 TYR 10 2.633 -19.374 3.434
63 HB3 TYR 10 HB3 TYR 10 2.564 -18.676 5.052
64 HD1 TYR 10 HD2 TYR 10 0.534 -19.124 6.546
65 HD2 TYR 10 HD1 TYR 10 1.218 -21.321 2.908
66 HE1 TYR 10 HE2 TYR 10 -0.929 -20.942 7.365
67 HE2 TYR 10 HE1 TYR 10 -0.285 -23.104 3.703
68 HH TYR 10 HH TYR 10 -1.912 -23.701 5.386
69 H SER 11 H SER 11 2.868 -17.528 1.637
70 HA SER 11 HA SER 11 3.353 -14.652 2.254
71 HB2 SER 11 HB2 SER 11 5.582 -16.772 2.225
72 HB3 SER 11 HB3 SER 11 5.789 -15.003 2.381
73 HG SER 11 HG SER 11 4.478 -16.651 4.327
74 H ILE 12 H ILE 12 1.903 -15.183 0.093
75 HA ILE 12 HA ILE 12 3.910 -14.519 -2.008
76 HB ILE 12 HB ILE 12 1.620 -16.446 -2.660
77 HG12 ILE 12 HG12 ILE 12 4.603 -17.084 -2.273
78 HG13 ILE 12 HG13 ILE 12 3.276 -17.571 -1.182
79 HG21 ILE 12 HG21 ILE 12 4.049 -15.554 -4.320
80 HG22 ILE 12 HG22 ILE 12 2.674 -16.552 -4.878
81 HG23 ILE 12 HG23 ILE 12 2.417 -14.846 -4.475
82 HD11 ILE 12 HD11 ILE 12 3.663 -18.543 -4.078
83 HD12 ILE 12 HD12 ILE 12 3.822 -19.484 -2.577
84 HD13 ILE 12 HD13 ILE 12 2.215 -18.882 -3.076
85 H ALA 13 H ALA 13 0.238 -14.864 -1.651
86 HA ALA 13 HA ALA 13 0.052 -12.043 -2.667
87 HB1 ALA 13 HB1 ALA 13 -1.302 -13.755 -3.889
88 HB2 ALA 13 HB2 ALA 13 -2.085 -14.238 -2.358
89 HB3 ALA 13 HB3 ALA 13 -2.344 -12.593 -3.012
90 H MET 14 H MET 14 1.251 -12.016 -0.288
91 HA MET 14 HA MET 14 -0.797 -11.000 1.504
92 HB2 MET 14 HB2 MET 14 -1.017 -13.487 1.946
93 HB3 MET 14 HB3 MET 14 0.688 -13.533 2.391
94 HG2 MET 14 HG2 MET 14 -0.262 -11.405 4.034
95 HG3 MET 14 HG3 MET 14 -1.689 -12.446 3.926
96 HE1 MET 14 HE1 MET 14 1.858 -11.783 5.397
97 HE2 MET 14 HE2 MET 14 2.438 -13.408 5.882
98 HE3 MET 14 HE3 MET 14 2.344 -12.978 4.152
99 H ASP 15 H ASP 15 2.637 -12.416 1.591
100 HA ASP 15 HA ASP 15 3.461 -10.500 3.558
101 HB2 ASP 15 HB2 ASP 15 4.753 -12.585 3.201
102 HB3 ASP 15 HB3 ASP 15 5.151 -12.105 1.532
103 H LYS 16 H LYS 16 3.857 -10.661 -0.092
104 HA LYS 16 HA LYS 16 5.023 -8.083 -0.339
105 HB2 LYS 16 HB2 LYS 16 4.881 -9.545 -2.311
106 HB3 LYS 16 HB3 LYS 16 3.097 -9.583 -2.231
107 HG2 LYS 16 HG2 LYS 16 2.954 -7.159 -2.752
108 HG3 LYS 16 HG3 LYS 16 4.735 -7.015 -2.706
109 HD2 LYS 16 HD2 LYS 16 4.918 -8.518 -4.690
110 HD3 LYS 16 HD3 LYS 16 3.150 -8.773 -4.695
111 HE2 LYS 16 HE2 LYS 16 2.755 -6.366 -5.142
112 HE3 LYS 16 HE3 LYS 16 4.505 -6.023 -5.047
113 HZ1 LYS 16 HZ1 LYS 16 3.739 -6.197 -7.379
114 HZ2 LYS 16 HZ2 LYS 16 3.174 -7.822 -7.105
115 HZ3 LYS 16 HZ3 LYS 16 4.880 -7.459 -7.018
116 H ILE 17 H ILE 17 1.521 -9.145 -0.214
117 HA ILE 17 HA ILE 17 0.486 -6.583 -0.782
118 HB ILE 17 HB ILE 17 -0.796 -8.616 1.114
119 HG12 ILE 17 HG12 ILE 17 -0.509 -9.772 -1.028
120 HG13 ILE 17 HG13 ILE 17 -2.203 -9.328 -0.841
121 HG21 ILE 17 HG21 ILE 17 -1.827 -6.421 1.418
122 HG22 ILE 17 HG22 ILE 17 -2.010 -6.205 -0.343
123 HG23 ILE 17 HG23 ILE 17 -2.958 -7.449 0.517
124 HD11 ILE 17 HD11 ILE 17 -0.124 -7.910 -2.642
125 HD12 ILE 17 HD12 ILE 17 -1.458 -8.961 -3.159
126 HD13 ILE 17 HD13 ILE 17 -1.822 -7.372 -2.441
127 H HIS 18 H HIS 18 1.557 -7.979 2.432
128 HA HIS 18 HA HIS 18 0.598 -5.725 3.900
129 HB2 HIS 18 HB2 HIS 18 2.944 -7.598 4.578
130 HB3 HIS 18 HB3 HIS 18 2.222 -6.390 5.670
131 HD1 HIS 18 HD1 HIS 18 2.026 -8.830 6.923
132 HD2 HIS 18 HD2 HIS 18 -0.711 -7.910 3.859
133 HE1 HIS 18 HE1 HIS 18 0.031 -10.341 7.294
134 H GLN 19 H GLN 19 4.039 -6.419 2.741
135 HA GLN 19 HA GLN 19 4.936 -3.883 3.638
136 HB2 GLN 19 HB2 GLN 19 6.436 -5.799 3.079
137 HB3 GLN 19 HB3 GLN 19 6.124 -5.548 1.343
138 HG2 GLN 19 HG2 GLN 19 7.091 -3.232 1.494
139 HG3 GLN 19 HG3 GLN 19 7.369 -3.451 3.242
140 HE21 GLN 19 HE21 GLN 19 8.783 -5.440 3.901
141 HE22 GLN 19 HE22 GLN 19 10.101 -5.800 2.849
142 H GLN 20 H GLN 20 3.965 -4.908 0.274
143 HA GLN 20 HA GLN 20 4.237 -2.459 -0.992
144 HB2 GLN 20 HB2 GLN 20 3.497 -4.510 -2.177
145 HB3 GLN 20 HB3 GLN 20 1.954 -4.502 -1.285
146 HG2 GLN 20 HG2 GLN 20 1.296 -2.346 -2.416
147 HG3 GLN 20 HG3 GLN 20 2.877 -2.302 -3.235
148 HE21 GLN 20 HE21 GLN 20 0.010 -4.586 -2.749
149 HE22 GLN 20 HE22 GLN 20 0.064 -5.191 -4.359
150 H ASP 21 H ASP 21 1.324 -3.589 0.949
151 HA ASP 21 HA ASP 21 -0.095 -1.167 0.297
152 HB2 ASP 21 HB2 ASP 21 -0.705 -3.258 2.455
153 HB3 ASP 21 HB3 ASP 21 -1.758 -1.890 2.010
154 H PHE 22 H PHE 22 1.350 -2.285 3.554
155 HA PHE 22 HA PHE 22 0.576 0.201 4.659
156 HB2 PHE 22 HB2 PHE 22 1.864 -0.220 6.632
157 HB3 PHE 22 HB3 PHE 22 0.968 -1.673 6.148
158 HD1 PHE 22 HD2 PHE 22 4.380 -0.032 5.933
159 HD2 PHE 22 HD1 PHE 22 2.201 -3.744 5.992
160 HE1 PHE 22 HE2 PHE 22 6.499 -1.274 6.196
161 HE2 PHE 22 HE1 PHE 22 4.326 -4.981 6.244
162 HZ PHE 22 HZ PHE 22 6.479 -3.751 6.366
163 H VAL 23 H VAL 23 3.717 -0.773 3.038
164 HA VAL 23 HA VAL 23 5.039 1.634 3.869
165 HB VAL 23 HB VAL 23 5.531 -0.031 1.334
166 HG11 VAL 23 HG11 VAL 23 6.302 2.283 0.919
167 HG12 VAL 23 HG12 VAL 23 7.140 2.323 2.499
168 HG13 VAL 23 HG13 VAL 23 7.714 1.242 1.195
169 HG21 VAL 23 HG21 VAL 23 7.533 -0.853 2.577
170 HG22 VAL 23 HG22 VAL 23 7.095 0.140 3.993
171 HG23 VAL 23 HG23 VAL 23 6.060 -1.228 3.503
172 H ASN 24 H ASN 24 3.300 0.824 0.731
173 HA ASN 24 HA ASN 24 3.607 3.350 -0.400
174 HB2 ASN 24 HB2 ASN 24 2.613 1.446 -1.665
175 HB3 ASN 24 HB3 ASN 24 1.165 1.486 -0.627
176 HD21 ASN 24 HD21 ASN 24 3.121 3.618 -2.904
177 HD22 ASN 24 HD22 ASN 24 1.742 4.501 -3.453
178 H TRP 25 H TRP 25 0.979 2.169 1.844
179 HA TRP 25 HA TRP 25 -0.531 4.571 1.779
180 HB2 TRP 25 HB2 TRP 25 -1.516 2.547 2.779
181 HB3 TRP 25 HB3 TRP 25 -0.212 2.454 3.987
182 HD1 TRP 25 HD1 TRP 25 -2.813 5.204 2.997
183 HE1 TRP 25 HE1 TRP 25 -3.695 6.242 5.112
184 HE3 TRP 25 HE3 TRP 25 -0.079 2.503 6.498
185 HZ2 TRP 25 HZ2 TRP 25 -3.349 6.082 7.819
186 HZ3 TRP 25 HZ3 TRP 25 -0.474 3.042 8.908
187 HH2 TRP 25 HH2 TRP 25 -2.098 4.791 9.560
188 H LEU 26 H LEU 26 2.134 3.542 4.105
189 HA LEU 26 HA LEU 26 1.790 5.807 5.766
190 HB2 LEU 26 HB2 LEU 26 4.330 4.203 5.186
191 HB3 LEU 26 HB3 LEU 26 4.257 5.488 6.414
192 HG LEU 26 HG LEU 26 2.457 2.988 6.511
193 HD11 LEU 26 HD11 LEU 26 4.055 2.095 8.204
194 HD12 LEU 26 HD12 LEU 26 5.112 3.522 7.980
195 HD13 LEU 26 HD13 LEU 26 4.891 2.349 6.652
196 HD21 LEU 26 HD21 LEU 26 3.111 5.121 8.637
197 HD22 LEU 26 HD22 LEU 26 2.204 3.613 8.934
198 HD23 LEU 26 HD23 LEU 26 1.524 4.851 7.866
199 H LEU 27 H LEU 27 4.227 5.371 3.030
200 HA LEU 27 HA LEU 27 5.001 8.102 3.282
201 HB2 LEU 27 HB2 LEU 27 6.249 7.932 1.224
202 HB3 LEU 27 HB3 LEU 27 6.468 6.510 2.265
203 HG LEU 27 HG LEU 27 4.638 5.380 0.698
204 HD11 LEU 27 HD11 LEU 27 4.598 6.188 -1.642
205 HD12 LEU 27 HD12 LEU 27 5.686 7.544 -1.239
206 HD13 LEU 27 HD13 LEU 27 4.031 7.512 -0.603
207 HD21 LEU 27 HD21 LEU 27 7.482 5.975 -0.331
208 HD22 LEU 27 HD22 LEU 27 6.446 4.620 -0.868
209 HD23 LEU 27 HD23 LEU 27 7.041 4.679 0.810
210 H ALA 28 H ALA 28 2.293 6.587 1.403
211 HA ALA 28 HA ALA 28 1.578 9.353 0.449
212 HB1 ALA 28 HB1 ALA 28 0.054 8.240 -1.109
213 HB2 ALA 28 HB2 ALA 28 1.679 7.533 -1.305
214 HB3 ALA 28 HB3 ALA 28 0.420 6.640 -0.408
215 H GLN 29 H GLN 29 1.316 9.099 3.230
216 HA GLN 29 HA GLN 29 -1.435 8.147 3.745
217 HB2 GLN 29 HB2 GLN 29 0.391 7.842 5.420
218 HB3 GLN 29 HB3 GLN 29 0.512 9.609 5.619
219 HG2 GLN 29 HG2 GLN 29 -1.886 9.673 6.400
220 HG3 GLN 29 HG3 GLN 29 -2.018 7.912 6.176
221 HE21 GLN 29 HE21 GLN 29 -0.176 6.573 7.403
222 HE22 GLN 29 HE22 GLN 29 0.152 7.121 9.004
223 H LYS 30 H LYS 30 -3.237 9.683 4.120
224 HA LYS 30 HA LYS 30 -4.357 11.664 3.703
225 HB2 LYS 30 HB2 LYS 30 -2.796 11.944 5.843
226 HB3 LYS 30 HB3 LYS 30 -1.899 13.092 4.853
227 HG2 LYS 30 HG2 LYS 30 -4.893 13.099 5.623
228 HG3 LYS 30 HG3 LYS 30 -3.672 14.145 6.375
229 HD2 LYS 30 HD2 LYS 30 -4.356 14.369 3.387
230 HD3 LYS 30 HD3 LYS 30 -5.331 15.159 4.631
231 HE2 LYS 30 HE2 LYS 30 -3.781 16.767 3.715
232 HE3 LYS 30 HE3 LYS 30 -3.464 16.515 5.442
233 HZ1 LYS 30 HZ1 LYS 30 -1.429 15.359 4.963
234 HZ2 LYS 30 HZ2 LYS 30 -1.441 16.717 3.922
235 HZ3 LYS 30 HZ3 LYS 30 -1.853 15.169 3.255
236 H GLY 31 H GLY 31 -3.483 10.681 1.402
237 HA2 GLY 31 HA2 GLY 31 -1.844 12.758 0.011
238 HA3 GLY 31 HA3 GLY 31 -2.342 11.185 -0.632
239 H LYS 32 H LYS 32 -4.976 10.937 -0.532
240 HA LYS 32 HA LYS 32 -6.045 12.143 -2.612
241 HB2 LYS 32 HB2 LYS 32 -7.267 10.518 -1.154
242 HB3 LYS 32 HB3 LYS 32 -7.497 11.771 0.073
243 HG2 LYS 32 HG2 LYS 32 -9.623 11.579 -1.035
244 HG3 LYS 32 HG3 LYS 32 -8.886 13.094 -1.579
245 HD2 LYS 32 HD2 LYS 32 -9.727 12.257 -3.591
246 HD3 LYS 32 HD3 LYS 32 -8.085 11.579 -3.682
247 HE2 LYS 32 HE2 LYS 32 -10.692 10.151 -2.843
248 HE3 LYS 32 HE3 LYS 32 -9.824 9.981 -4.386
249 HZ1 LYS 32 HZ1 LYS 32 -9.315 8.065 -3.076
250 HZ2 LYS 32 HZ2 LYS 32 -8.940 8.978 -1.674
251 HZ3 LYS 32 HZ3 LYS 32 -7.877 9.036 -3.086
252 H LYS 33 H LYS 33 -6.237 13.816 0.659
253 HA LYS 33 HA LYS 33 -7.677 16.042 -0.306
254 HB2 LYS 33 HB2 LYS 33 -7.362 15.605 2.059
255 HB3 LYS 33 HB3 LYS 33 -5.611 15.883 1.954
256 HG2 LYS 33 HG2 LYS 33 -7.700 18.078 1.376
257 HG3 LYS 33 HG3 LYS 33 -7.001 17.744 2.982
258 HD2 LYS 33 HD2 LYS 33 -4.650 18.129 1.929
259 HD3 LYS 33 HD3 LYS 33 -5.501 18.803 0.525
260 HE2 LYS 33 HE2 LYS 33 -6.615 20.493 2.007
261 HE3 LYS 33 HE3 LYS 33 -5.777 19.809 3.422
262 HZ1 LYS 33 HZ1 LYS 33 -3.610 20.400 2.484
263 HZ2 LYS 33 HZ2 LYS 33 -4.626 21.810 2.541
264 HZ3 LYS 33 HZ3 LYS 33 -4.334 21.008 1.030
265 H ASN 34 H ASN 34 -4.040 15.732 0.071
266 HA ASN 34 HA ASN 34 -3.577 18.257 -1.182
267 HB2 ASN 34 HB2 ASN 34 -1.707 15.814 -1.041
268 HB3 ASN 34 HB3 ASN 34 -1.210 17.478 -1.439
269 HD21 ASN 34 HD21 ASN 34 -1.802 19.244 0.311
270 HD22 ASN 34 HD22 ASN 34 -1.665 18.730 1.951
271 H ASP 35 H ASP 35 -3.886 14.890 -2.561
272 HA ASP 35 HA ASP 35 -3.189 16.003 -5.244
273 HB2 ASP 35 HB2 ASP 35 -1.987 13.997 -4.324
274 HB3 ASP 35 HB3 ASP 35 -3.530 13.104 -4.338
275 H TRP 36 H TRP 36 -6.021 16.431 -3.840
276 HA TRP 36 HA TRP 36 -7.402 15.824 -6.324
277 HB2 TRP 36 HB2 TRP 36 -7.379 13.612 -4.921
278 HB3 TRP 36 HB3 TRP 36 -8.598 14.397 -3.899
279 HD1 TRP 36 HD1 TRP 36 -8.257 12.424 -7.023
280 HE1 TRP 36 HE1 TRP 36 -10.389 12.394 -8.355
281 HE3 TRP 36 HE3 TRP 36 -10.929 16.073 -4.488
282 HZ2 TRP 36 HZ2 TRP 36 -12.781 13.721 -8.500
283 HZ3 TRP 36 HZ3 TRP 36 -13.121 16.773 -5.456
284 HH2 TRP 36 HH2 TRP 36 -14.040 15.607 -7.438
285 H LYS 37 H LYS 37 -8.222 16.548 -2.761
286 HA LYS 37 HA LYS 37 -10.405 18.259 -3.755
287 HB2 LYS 37 HB2 LYS 37 -9.376 17.880 -0.882
288 HB3 LYS 37 HB3 LYS 37 -10.605 19.051 -1.398
289 HG2 LYS 37 HG2 LYS 37 -11.848 17.229 -0.557
290 HG3 LYS 37 HG3 LYS 37 -12.001 17.125 -2.325
291 HD2 LYS 37 HD2 LYS 37 -10.218 15.277 -2.284
292 HD3 LYS 37 HD3 LYS 37 -10.110 15.479 -0.519
293 HE2 LYS 37 HE2 LYS 37 -11.481 13.549 -0.910
294 HE3 LYS 37 HE3 LYS 37 -12.587 14.832 -0.368
295 HZ1 LYS 37 HZ1 LYS 37 -13.483 13.525 -2.261
296 HZ2 LYS 37 HZ2 LYS 37 -12.127 13.962 -3.246
297 HZ3 LYS 37 HZ3 LYS 37 -13.285 15.171 -2.741
298 H HIS 38 H HIS 38 -7.401 18.993 -1.738
299 HA HIS 38 HA HIS 38 -7.702 21.757 -2.375
300 HB2 HIS 38 HB2 HIS 38 -6.403 20.973 -0.428
301 HB3 HIS 38 HB3 HIS 38 -5.133 20.305 -1.501
302 HD1 HIS 38 HD1 HIS 38 -3.955 22.156 -3.076
303 HD2 HIS 38 HD2 HIS 38 -6.223 23.572 0.169
304 HE1 HIS 38 HE1 HIS 38 -3.235 24.557 -2.734
305 H ASN 39 H ASN 39 -5.883 19.030 -3.955
306 HA ASN 39 HA ASN 39 -4.258 20.319 -5.719
307 HB2 ASN 39 HB2 ASN 39 -4.708 17.858 -5.750
308 HB3 ASN 39 HB3 ASN 39 -6.318 18.147 -6.458
309 HD21 ASN 39 HD21 ASN 39 -5.195 16.440 -7.995
310 HD22 ASN 39 HD22 ASN 39 -4.344 17.123 -9.332
311 H ILE 40 H ILE 40 -7.903 20.206 -5.950
312 HA ILE 40 HA ILE 40 -7.976 21.411 -8.541
313 HB ILE 40 HB ILE 40 -10.045 21.352 -6.299
314 HG12 ILE 40 HG12 ILE 40 -10.114 19.908 -9.022
315 HG13 ILE 40 HG13 ILE 40 -9.267 19.188 -7.644
316 HG21 ILE 40 HG21 ILE 40 -10.503 23.377 -7.652
317 HG22 ILE 40 HG22 ILE 40 -10.345 22.439 -9.164
318 HG23 ILE 40 HG23 ILE 40 -11.709 22.139 -8.051
319 HD11 ILE 40 HD11 ILE 40 -12.274 19.858 -7.678
320 HD12 ILE 40 HD12 ILE 40 -11.525 18.244 -7.771
321 HD13 ILE 40 HD13 ILE 40 -11.369 19.209 -6.278
322 H THR 41 H THR 41 -8.416 23.040 -5.224
323 HA THR 41 HA THR 41 -8.476 25.587 -6.474
324 HB THR 41 HB THR 41 -9.266 25.208 -4.133
325 HG1 THR 41 HG1 THR 41 -7.467 27.401 -4.528
326 HG21 THR 41 HG21 THR 41 -7.296 24.000 -3.132
327 HG22 THR 41 HG22 THR 41 -7.667 25.492 -2.240
328 HG23 THR 41 HG23 THR 41 -6.275 25.450 -3.351
329 H GLN 42 H GLN 42 -5.666 23.639 -5.212
330 HA GLN 42 HA GLN 42 -3.403 24.067 -5.333
331 HB2 GLN 42 HB2 GLN 42 -3.929 23.643 -7.726
332 HB3 GLN 42 HB3 GLN 42 -4.260 25.376 -7.992
333 HG2 GLN 42 HG2 GLN 42 -1.893 25.944 -7.381
334 HG3 GLN 42 HG3 GLN 42 -1.556 24.217 -7.059
335 HE21 GLN 42 HE21 GLN 42 0.183 25.262 -8.785
336 HE22 GLN 42 HE22 GLN 42 -0.199 24.850 -10.417
Start of MODEL 12
1 H1 TYR 1 H1 TYR 1 -11.767 -9.884 -4.570
2 HA TYR 1 HA TYR 1 -11.232 -7.525 -3.983
3 HB2 TYR 1 HB2 TYR 1 -14.125 -7.629 -2.913
4 HB3 TYR 1 HB3 TYR 1 -13.045 -6.215 -2.832
5 HD1 TYR 1 HD2 TYR 1 -12.231 -5.142 -5.010
6 HD2 TYR 1 HD1 TYR 1 -15.307 -8.153 -4.997
7 HE1 TYR 1 HE2 TYR 1 -12.890 -4.490 -7.305
8 HE2 TYR 1 HE1 TYR 1 -15.967 -7.498 -7.276
9 HH TYR 1 HH TYR 1 -15.575 -6.007 -9.101
10 H ALA 2 H ALA 2 -10.832 -6.807 -1.572
11 HA ALA 2 HA ALA 2 -9.870 -8.996 -0.120
12 HB1 ALA 2 HB1 ALA 2 -10.819 -6.293 1.020
13 HB2 ALA 2 HB2 ALA 2 -9.813 -7.489 1.891
14 HB3 ALA 2 HB3 ALA 2 -9.177 -6.683 0.427
15 H GLU 3 H GLU 3 -13.086 -7.261 0.287
16 HA GLU 3 HA GLU 3 -13.928 -8.858 2.459
17 HB2 GLU 3 HB2 GLU 3 -15.105 -6.782 1.736
18 HB3 GLU 3 HB3 GLU 3 -15.694 -7.609 0.274
19 HG2 GLU 3 HG2 GLU 3 -16.330 -8.446 3.185
20 HG3 GLU 3 HG3 GLU 3 -17.409 -7.479 2.150
21 H GLY 4 H GLY 4 -14.967 -11.012 2.508
22 HA2 GLY 4 HA2 GLY 4 -16.006 -12.888 1.563
23 HA3 GLY 4 HA3 GLY 4 -15.853 -12.176 -0.051
24 H THR 5 H THR 5 -13.283 -11.857 -0.692
25 HA THR 5 HA THR 5 -12.420 -14.548 -0.961
26 HB THR 5 HB THR 5 -10.296 -13.746 -1.880
27 HG1 THR 5 HG1 THR 5 -10.999 -11.118 -1.035
28 HG21 THR 5 HG21 THR 5 -11.092 -12.418 -3.792
29 HG22 THR 5 HG22 THR 5 -12.609 -12.011 -2.952
30 HG23 THR 5 HG23 THR 5 -12.270 -13.703 -3.397
31 H PHE 6 H PHE 6 -11.480 -11.993 1.499
32 HA PHE 6 HA PHE 6 -9.209 -13.301 2.422
33 HB2 PHE 6 HB2 PHE 6 -9.358 -12.181 4.504
34 HB3 PHE 6 HB3 PHE 6 -10.098 -11.065 3.344
35 HD1 PHE 6 HD2 PHE 6 -10.715 -13.495 6.124
36 HD2 PHE 6 HD1 PHE 6 -12.557 -10.612 3.520
37 HE1 PHE 6 HE2 PHE 6 -12.728 -13.488 7.553
38 HE2 PHE 6 HE1 PHE 6 -14.551 -10.563 4.987
39 HZ PHE 6 HZ PHE 6 -14.650 -12.016 6.997
40 H ILE 7 H ILE 7 -12.681 -14.191 2.892
41 HA ILE 7 HA ILE 7 -12.178 -15.977 5.083
42 HB ILE 7 HB ILE 7 -14.432 -16.049 3.013
43 HG12 ILE 7 HG12 ILE 7 -14.414 -15.007 5.925
44 HG13 ILE 7 HG13 ILE 7 -14.317 -13.968 4.486
45 HG21 ILE 7 HG21 ILE 7 -14.071 -18.310 4.058
46 HG22 ILE 7 HG22 ILE 7 -14.185 -17.569 5.679
47 HG23 ILE 7 HG23 ILE 7 -15.600 -17.604 4.589
48 HD11 ILE 7 HD11 ILE 7 -16.606 -13.899 5.211
49 HD12 ILE 7 HD12 ILE 7 -16.562 -14.859 3.705
50 HD13 ILE 7 HD13 ILE 7 -16.738 -15.669 5.294
51 H SER 8 H SER 8 -12.482 -16.556 1.440
52 HA SER 8 HA SER 8 -11.644 -19.346 1.938
53 HB2 SER 8 HB2 SER 8 -13.463 -18.892 0.358
54 HB3 SER 8 HB3 SER 8 -12.374 -17.967 -0.705
55 HG SER 8 HG SER 8 -11.138 -20.008 -0.912
56 H ASP 9 H ASP 9 -10.396 -16.613 -0.218
57 HA ASP 9 HA ASP 9 -8.027 -18.082 -0.856
58 HB2 ASP 9 HB2 ASP 9 -8.822 -16.153 -2.245
59 HB3 ASP 9 HB3 ASP 9 -8.479 -15.038 -0.892
60 H TYR 10 H TYR 10 -8.769 -15.634 1.730
61 HA TYR 10 HA TYR 10 -7.530 -14.951 3.544
62 HB2 TYR 10 HB2 TYR 10 -5.544 -17.236 3.097
63 HB3 TYR 10 HB3 TYR 10 -5.695 -16.166 4.490
64 HD1 TYR 10 HD2 TYR 10 -7.847 -16.185 5.862
65 HD2 TYR 10 HD1 TYR 10 -7.080 -19.122 2.808
66 HE1 TYR 10 HE2 TYR 10 -9.559 -17.669 6.851
67 HE2 TYR 10 HE1 TYR 10 -8.820 -20.576 3.765
68 HH TYR 10 HH TYR 10 -10.500 -20.810 5.450
69 H SER 11 H SER 11 -4.847 -15.948 1.234
70 HA SER 11 HA SER 11 -4.460 -13.229 0.398
71 HB2 SER 11 HB2 SER 11 -2.613 -14.160 2.690
72 HB3 SER 11 HB3 SER 11 -2.240 -12.837 1.550
73 HG SER 11 HG SER 11 -4.427 -12.778 3.378
74 H ILE 12 H ILE 12 -2.472 -16.180 1.335
75 HA ILE 12 HA ILE 12 -1.136 -17.493 0.047
76 HB ILE 12 HB ILE 12 -1.694 -15.884 -2.477
77 HG12 ILE 12 HG12 ILE 12 -3.876 -16.648 -1.652
78 HG13 ILE 12 HG13 ILE 12 -3.377 -17.586 -3.071
79 HG21 ILE 12 HG21 ILE 12 -0.939 -17.978 -3.595
80 HG22 ILE 12 HG22 ILE 12 0.330 -17.240 -2.586
81 HG23 ILE 12 HG23 ILE 12 -0.533 -18.686 -2.008
82 HD11 ILE 12 HD11 ILE 12 -2.745 -19.514 -1.546
83 HD12 ILE 12 HD12 ILE 12 -3.279 -18.552 -0.134
84 HD13 ILE 12 HD13 ILE 12 -4.452 -19.036 -1.378
85 H ALA 13 H ALA 13 -0.743 -14.006 -1.142
86 HA ALA 13 HA ALA 13 2.087 -14.223 -0.102
87 HB1 ALA 13 HB1 ALA 13 1.949 -14.260 -2.608
88 HB2 ALA 13 HB2 ALA 13 1.040 -12.719 -2.571
89 HB3 ALA 13 HB3 ALA 13 2.734 -12.775 -1.990
90 H MET 14 H MET 14 0.396 -13.555 1.849
91 HA MET 14 HA MET 14 -0.491 -10.892 1.885
92 HB2 MET 14 HB2 MET 14 -0.423 -10.911 4.304
93 HB3 MET 14 HB3 MET 14 -0.983 -12.510 3.764
94 HG2 MET 14 HG2 MET 14 1.358 -13.428 4.188
95 HG3 MET 14 HG3 MET 14 1.859 -11.806 4.768
96 HE1 MET 14 HE1 MET 14 1.595 -13.624 8.206
97 HE2 MET 14 HE2 MET 14 2.267 -14.265 6.671
98 HE3 MET 14 HE3 MET 14 2.591 -12.565 7.157
99 H ASP 15 H ASP 15 2.884 -12.199 2.318
100 HA ASP 15 HA ASP 15 3.999 -9.841 3.378
101 HB2 ASP 15 HB2 ASP 15 5.367 -11.890 3.135
102 HB3 ASP 15 HB3 ASP 15 5.264 -11.798 1.358
103 H LYS 16 H LYS 16 3.529 -10.794 -0.163
104 HA LYS 16 HA LYS 16 4.647 -8.367 -1.076
105 HB2 LYS 16 HB2 LYS 16 4.326 -10.247 -2.642
106 HB3 LYS 16 HB3 LYS 16 2.560 -10.188 -2.417
107 HG2 LYS 16 HG2 LYS 16 3.175 -9.188 -4.575
108 HG3 LYS 16 HG3 LYS 16 2.416 -7.971 -3.523
109 HD2 LYS 16 HD2 LYS 16 4.705 -7.024 -2.982
110 HD3 LYS 16 HD3 LYS 16 5.449 -8.271 -4.025
111 HE2 LYS 16 HE2 LYS 16 4.207 -7.312 -5.998
112 HE3 LYS 16 HE3 LYS 16 3.435 -6.107 -4.931
113 HZ1 LYS 16 HZ1 LYS 16 6.425 -6.348 -5.398
114 HZ2 LYS 16 HZ2 LYS 16 5.638 -5.149 -4.402
115 HZ3 LYS 16 HZ3 LYS 16 5.376 -5.159 -6.117
116 H ILE 17 H ILE 17 1.146 -9.271 -0.438
117 HA ILE 17 HA ILE 17 0.199 -6.776 -1.493
118 HB ILE 17 HB ILE 17 -1.209 -8.520 0.607
119 HG12 ILE 17 HG12 ILE 17 -0.920 -10.013 -1.255
120 HG13 ILE 17 HG13 ILE 17 -2.571 -9.400 -1.340
121 HG21 ILE 17 HG21 ILE 17 -2.314 -6.318 -1.247
122 HG22 ILE 17 HG22 ILE 17 -3.295 -7.378 -0.198
123 HG23 ILE 17 HG23 ILE 17 -2.147 -6.235 0.524
124 HD11 ILE 17 HD11 ILE 17 -1.618 -9.459 -3.594
125 HD12 ILE 17 HD12 ILE 17 -1.801 -7.742 -3.150
126 HD13 ILE 17 HD13 ILE 17 -0.190 -8.524 -3.098
127 H HIS 18 H HIS 18 0.788 -7.852 1.953
128 HA HIS 18 HA HIS 18 -0.059 -5.330 3.005
129 HB2 HIS 18 HB2 HIS 18 1.824 -7.414 4.271
130 HB3 HIS 18 HB3 HIS 18 1.057 -6.047 5.116
131 HD1 HIS 18 HD1 HIS 18 0.375 -8.366 6.429
132 HD2 HIS 18 HD2 HIS 18 -1.697 -7.306 2.922
133 HE1 HIS 18 HE1 HIS 18 -1.841 -9.574 6.541
134 H GLN 19 H GLN 19 3.318 -6.674 2.429
135 HA GLN 19 HA GLN 19 4.663 -4.388 3.307
136 HB2 GLN 19 HB2 GLN 19 5.772 -6.576 2.603
137 HB3 GLN 19 HB3 GLN 19 5.545 -6.083 0.906
138 HG2 GLN 19 HG2 GLN 19 7.821 -5.480 1.543
139 HG3 GLN 19 HG3 GLN 19 6.908 -3.959 1.437
140 HE21 GLN 19 HE21 GLN 19 7.921 -6.560 3.854
141 HE22 GLN 19 HE22 GLN 19 8.114 -5.451 5.158
142 H GLN 20 H GLN 20 3.460 -5.126 -0.073
143 HA GLN 20 HA GLN 20 4.341 -2.675 -1.174
144 HB2 GLN 20 HB2 GLN 20 3.473 -4.580 -2.546
145 HB3 GLN 20 HB3 GLN 20 1.826 -4.302 -1.911
146 HG2 GLN 20 HG2 GLN 20 1.813 -2.023 -2.991
147 HG3 GLN 20 HG3 GLN 20 3.489 -2.293 -3.556
148 HE21 GLN 20 HE21 GLN 20 2.782 -2.106 -5.867
149 HE22 GLN 20 HE22 GLN 20 1.847 -3.366 -6.579
150 H ASP 21 H ASP 21 1.147 -3.522 0.415
151 HA ASP 21 HA ASP 21 0.022 -0.981 -0.242
152 HB2 ASP 21 HB2 ASP 21 -0.865 -2.996 1.900
153 HB3 ASP 21 HB3 ASP 21 -1.784 -1.555 1.388
154 H PHE 22 H PHE 22 1.072 -2.188 3.121
155 HA PHE 22 HA PHE 22 0.523 0.371 4.164
156 HB2 PHE 22 HB2 PHE 22 1.686 -0.236 6.208
157 HB3 PHE 22 HB3 PHE 22 0.608 -1.525 5.661
158 HD1 PHE 22 HD2 PHE 22 4.255 -0.427 5.498
159 HD2 PHE 22 HD1 PHE 22 1.505 -3.731 5.511
160 HE1 PHE 22 HE2 PHE 22 6.134 -1.987 5.827
161 HE2 PHE 22 HE1 PHE 22 3.397 -5.299 5.832
162 HZ PHE 22 HZ PHE 22 5.709 -4.425 6.043
163 H VAL 23 H VAL 23 3.528 -0.819 2.520
164 HA VAL 23 HA VAL 23 5.134 1.341 3.517
165 HB VAL 23 HB VAL 23 5.339 -0.282 0.930
166 HG11 VAL 23 HG11 VAL 23 7.611 0.744 0.624
167 HG12 VAL 23 HG12 VAL 23 6.314 1.945 0.424
168 HG13 VAL 23 HG13 VAL 23 7.260 1.896 1.944
169 HG21 VAL 23 HG21 VAL 23 5.867 -1.434 3.157
170 HG22 VAL 23 HG22 VAL 23 7.295 -1.301 2.094
171 HG23 VAL 23 HG23 VAL 23 7.098 -0.193 3.480
172 H ASN 24 H ASN 24 3.371 1.122 0.278
173 HA ASN 24 HA ASN 24 3.888 3.823 -0.326
174 HB2 ASN 24 HB2 ASN 24 1.431 2.165 -1.150
175 HB3 ASN 24 HB3 ASN 24 1.870 3.747 -1.835
176 HD21 ASN 24 HD21 ASN 24 2.578 0.273 -2.064
177 HD22 ASN 24 HD22 ASN 24 3.838 0.449 -3.225
178 H TRP 25 H TRP 25 1.032 2.395 1.499
179 HA TRP 25 HA TRP 25 -0.335 4.884 1.618
180 HB2 TRP 25 HB2 TRP 25 -1.613 2.889 2.251
181 HB3 TRP 25 HB3 TRP 25 -0.434 2.486 3.512
182 HD1 TRP 25 HD1 TRP 25 -1.909 6.071 3.108
183 HE1 TRP 25 HE1 TRP 25 -3.063 6.674 5.244
184 HE3 TRP 25 HE3 TRP 25 -1.523 1.532 5.618
185 HZ2 TRP 25 HZ2 TRP 25 -3.743 5.559 7.643
186 HZ3 TRP 25 HZ3 TRP 25 -2.510 1.424 7.914
187 HH2 TRP 25 HH2 TRP 25 -3.610 3.403 8.908
188 H LEU 26 H LEU 26 1.754 3.282 4.188
189 HA LEU 26 HA LEU 26 1.234 5.311 6.055
190 HB2 LEU 26 HB2 LEU 26 3.720 3.567 5.854
191 HB3 LEU 26 HB3 LEU 26 3.335 4.588 7.259
192 HG LEU 26 HG LEU 26 1.483 2.302 6.308
193 HD11 LEU 26 HD11 LEU 26 3.698 1.412 7.058
194 HD12 LEU 26 HD12 LEU 26 2.426 1.007 8.240
195 HD13 LEU 26 HD13 LEU 26 3.566 2.337 8.578
196 HD21 LEU 26 HD21 LEU 26 1.472 3.939 8.904
197 HD22 LEU 26 HD22 LEU 26 0.465 2.503 8.573
198 HD23 LEU 26 HD23 LEU 26 0.213 3.982 7.634
199 H LEU 27 H LEU 27 3.915 5.150 3.589
200 HA LEU 27 HA LEU 27 5.019 7.632 4.609
201 HB2 LEU 27 HB2 LEU 27 6.605 7.580 2.828
202 HB3 LEU 27 HB3 LEU 27 6.361 5.939 3.449
203 HG LEU 27 HG LEU 27 4.646 5.746 1.369
204 HD11 LEU 27 HD11 LEU 27 6.596 7.897 0.325
205 HD12 LEU 27 HD12 LEU 27 4.874 8.200 0.647
206 HD13 LEU 27 HD13 LEU 27 5.344 7.049 -0.621
207 HD21 LEU 27 HD21 LEU 27 6.489 4.853 -0.047
208 HD22 LEU 27 HD22 LEU 27 6.688 4.351 1.648
209 HD23 LEU 27 HD23 LEU 27 7.695 5.671 0.991
210 H ALA 28 H ALA 28 2.538 6.848 2.062
211 HA ALA 28 HA ALA 28 2.715 9.534 0.960
212 HB1 ALA 28 HB1 ALA 28 0.528 7.405 0.578
213 HB2 ALA 28 HB2 ALA 28 0.741 8.898 -0.381
214 HB3 ALA 28 HB3 ALA 28 1.984 7.616 -0.441
215 H GLN 29 H GLN 29 0.288 7.838 3.123
216 HA GLN 29 HA GLN 29 -1.564 8.710 4.236
217 HB2 GLN 29 HB2 GLN 29 0.147 11.258 4.434
218 HB3 GLN 29 HB3 GLN 29 -1.289 10.870 5.409
219 HG2 GLN 29 HG2 GLN 29 1.314 9.218 5.413
220 HG3 GLN 29 HG3 GLN 29 0.933 10.492 6.588
221 HE21 GLN 29 HE21 GLN 29 -0.107 7.179 5.488
222 HE22 GLN 29 HE22 GLN 29 -0.974 6.841 6.940
223 H LYS 30 H LYS 30 -1.891 8.479 1.576
224 HA LYS 30 HA LYS 30 -3.780 10.604 1.120
225 HB2 LYS 30 HB2 LYS 30 -1.810 11.903 0.444
226 HB3 LYS 30 HB3 LYS 30 -1.215 10.562 -0.555
227 HG2 LYS 30 HG2 LYS 30 -2.180 12.344 -1.947
228 HG3 LYS 30 HG3 LYS 30 -3.121 10.846 -2.149
229 HD2 LYS 30 HD2 LYS 30 -4.874 11.759 -0.553
230 HD3 LYS 30 HD3 LYS 30 -3.922 13.259 -0.394
231 HE2 LYS 30 HE2 LYS 30 -5.240 12.139 -2.962
232 HE3 LYS 30 HE3 LYS 30 -5.860 13.462 -1.946
233 HZ1 LYS 30 HZ1 LYS 30 -4.798 14.420 -3.868
234 HZ2 LYS 30 HZ2 LYS 30 -3.355 13.505 -3.659
235 HZ3 LYS 30 HZ3 LYS 30 -3.769 14.754 -2.503
236 H GLY 31 H GLY 31 -1.791 8.146 -0.840
237 HA2 GLY 31 HA2 GLY 31 -3.778 7.655 -2.721
238 HA3 GLY 31 HA3 GLY 31 -2.619 6.412 -2.175
239 H LYS 32 H LYS 32 -3.293 5.906 0.483
240 HA LYS 32 HA LYS 32 -5.589 4.256 0.163
241 HB2 LYS 32 HB2 LYS 32 -3.872 3.909 1.967
242 HB3 LYS 32 HB3 LYS 32 -4.446 5.387 2.795
243 HG2 LYS 32 HG2 LYS 32 -6.692 4.383 3.096
244 HG3 LYS 32 HG3 LYS 32 -6.178 2.920 2.196
245 HD2 LYS 32 HD2 LYS 32 -4.440 2.505 4.046
246 HD3 LYS 32 HD3 LYS 32 -5.072 3.954 4.874
247 HE2 LYS 32 HE2 LYS 32 -6.127 2.097 5.966
248 HE3 LYS 32 HE3 LYS 32 -7.384 2.806 4.919
249 HZ1 LYS 32 HZ1 LYS 32 -5.735 0.340 4.290
250 HZ2 LYS 32 HZ2 LYS 32 -6.987 0.991 3.266
251 HZ3 LYS 32 HZ3 LYS 32 -7.394 0.362 4.816
252 H LYS 33 H LYS 33 -5.171 7.563 1.665
253 HA LYS 33 HA LYS 33 -7.922 7.691 2.493
254 HB2 LYS 33 HB2 LYS 33 -5.955 9.979 1.967
255 HB3 LYS 33 HB3 LYS 33 -7.559 10.151 2.729
256 HG2 LYS 33 HG2 LYS 33 -6.891 8.764 4.650
257 HG3 LYS 33 HG3 LYS 33 -5.347 8.324 3.886
258 HD2 LYS 33 HD2 LYS 33 -4.932 9.989 5.605
259 HD3 LYS 33 HD3 LYS 33 -4.564 10.697 4.012
260 HE2 LYS 33 HE2 LYS 33 -6.724 11.952 4.046
261 HE3 LYS 33 HE3 LYS 33 -7.202 11.122 5.557
262 HZ1 LYS 33 HZ1 LYS 33 -6.344 13.406 5.954
263 HZ2 LYS 33 HZ2 LYS 33 -4.814 12.972 5.249
264 HZ3 LYS 33 HZ3 LYS 33 -5.340 12.218 6.733
265 H ASN 34 H ASN 34 -6.420 8.140 -0.708
266 HA ASN 34 HA ASN 34 -8.672 9.727 -1.681
267 HB2 ASN 34 HB2 ASN 34 -6.286 9.786 -2.595
268 HB3 ASN 34 HB3 ASN 34 -6.576 8.186 -3.316
269 HD21 ASN 34 HD21 ASN 34 -8.705 8.102 -4.824
270 HD22 ASN 34 HD22 ASN 34 -8.959 9.517 -5.771
271 H ASP 35 H ASP 35 -7.686 6.177 -1.618
272 HA ASP 35 HA ASP 35 -10.381 5.567 -2.815
273 HB2 ASP 35 HB2 ASP 35 -8.501 5.426 -4.488
274 HB3 ASP 35 HB3 ASP 35 -7.693 4.229 -3.444
275 H TRP 36 H TRP 36 -10.242 5.692 -0.112
276 HA TRP 36 HA TRP 36 -11.105 2.997 0.399
277 HB2 TRP 36 HB2 TRP 36 -8.529 2.816 0.791
278 HB3 TRP 36 HB3 TRP 36 -8.793 3.754 2.267
279 HD1 TRP 36 HD1 TRP 36 -8.878 0.287 1.004
280 HE1 TRP 36 HE1 TRP 36 -9.829 -1.291 2.716
281 HE3 TRP 36 HE3 TRP 36 -10.970 3.715 4.320
282 HZ2 TRP 36 HZ2 TRP 36 -11.205 -1.237 5.069
283 HZ3 TRP 36 HZ3 TRP 36 -12.095 2.797 6.338
284 HH2 TRP 36 HH2 TRP 36 -12.225 0.354 6.710
285 H LYS 37 H LYS 37 -9.802 5.857 2.341
286 HA LYS 37 HA LYS 37 -12.370 5.977 3.798
287 HB2 LYS 37 HB2 LYS 37 -10.070 8.037 3.746
288 HB3 LYS 37 HB3 LYS 37 -11.588 8.139 4.658
289 HG2 LYS 37 HG2 LYS 37 -10.011 7.410 6.250
290 HG3 LYS 37 HG3 LYS 37 -10.959 5.956 5.854
291 HD2 LYS 37 HD2 LYS 37 -9.036 5.100 4.460
292 HD3 LYS 37 HD3 LYS 37 -8.202 6.656 4.648
293 HE2 LYS 37 HE2 LYS 37 -7.168 5.028 6.112
294 HE3 LYS 37 HE3 LYS 37 -7.973 6.259 7.108
295 HZ1 LYS 37 HZ1 LYS 37 -9.817 4.707 7.566
296 HZ2 LYS 37 HZ2 LYS 37 -8.313 3.932 7.924
297 HZ3 LYS 37 HZ3 LYS 37 -9.160 3.531 6.464
298 H HIS 38 H HIS 38 -10.500 7.792 1.234
299 HA HIS 38 HA HIS 38 -11.254 8.823 -0.645
300 HB2 HIS 38 HB2 HIS 38 -13.008 6.924 -0.598
301 HB3 HIS 38 HB3 HIS 38 -14.170 8.164 -0.047
302 HD1 HIS 38 HD1 HIS 38 -14.251 10.332 -1.683
303 HD2 HIS 38 HD2 HIS 38 -12.541 6.813 -3.205
304 HE1 HIS 38 HE1 HIS 38 -14.238 10.605 -4.208
305 H ASN 39 H ASN 39 -10.532 10.230 1.634
306 HA ASN 39 HA ASN 39 -12.500 12.241 2.247
307 HB2 ASN 39 HB2 ASN 39 -9.423 12.387 2.378
308 HB3 ASN 39 HB3 ASN 39 -10.557 13.581 3.072
309 HD21 ASN 39 HD21 ASN 39 -9.157 12.882 5.084
310 HD22 ASN 39 HD22 ASN 39 -9.797 11.559 5.993
311 H ILE 40 H ILE 40 -10.064 11.796 -0.403
312 HA ILE 40 HA ILE 40 -9.720 14.196 -1.412
313 HB ILE 40 HB ILE 40 -9.010 12.160 -2.590
314 HG12 ILE 40 HG12 ILE 40 -9.456 12.790 -4.995
315 HG13 ILE 40 HG13 ILE 40 -10.649 13.990 -4.453
316 HG21 ILE 40 HG21 ILE 40 -10.477 10.756 -3.961
317 HG22 ILE 40 HG22 ILE 40 -11.190 10.836 -2.340
318 HG23 ILE 40 HG23 ILE 40 -11.869 11.819 -3.671
319 HD11 ILE 40 HD11 ILE 40 -8.810 15.270 -3.282
320 HD12 ILE 40 HD12 ILE 40 -7.643 13.983 -3.713
321 HD13 ILE 40 HD13 ILE 40 -8.388 14.987 -4.984
322 H THR 41 H THR 41 -12.959 12.554 -1.635
323 HA THR 41 HA THR 41 -14.096 15.206 -2.494
324 HB THR 41 HB THR 41 -15.278 12.398 -2.740
325 HG1 THR 41 HG1 THR 41 -14.875 12.946 -5.031
326 HG21 THR 41 HG21 THR 41 -16.387 15.127 -3.656
327 HG22 THR 41 HG22 THR 41 -17.048 14.148 -2.310
328 HG23 THR 41 HG23 THR 41 -17.116 13.529 -3.982
329 H GLN 42 H GLN 42 -14.907 12.303 -0.334
330 HA GLN 42 HA GLN 42 -16.679 13.885 1.278
331 HB2 GLN 42 HB2 GLN 42 -16.743 11.392 1.181
332 HB3 GLN 42 HB3 GLN 42 -15.152 11.301 1.982
333 HG2 GLN 42 HG2 GLN 42 -17.685 12.536 3.237
334 HG3 GLN 42 HG3 GLN 42 -17.087 10.892 3.544
335 HE21 GLN 42 HE21 GLN 42 -16.665 14.270 4.540
336 HE22 GLN 42 HE22 GLN 42 -15.317 13.962 5.566
Start of MODEL 13
1 H1 TYR 1 H1 TYR 1 -3.622 -10.796 -0.214
2 HA TYR 1 HA TYR 1 -3.497 -9.454 1.925
3 HB2 TYR 1 HB2 TYR 1 -6.555 -9.476 1.451
4 HB3 TYR 1 HB3 TYR 1 -5.751 -8.806 2.886
5 HD1 TYR 1 HD2 TYR 1 -4.377 -6.724 2.718
6 HD2 TYR 1 HD1 TYR 1 -6.452 -8.267 -0.723
7 HE1 TYR 1 HE2 TYR 1 -4.265 -4.504 1.663
8 HE2 TYR 1 HE1 TYR 1 -6.331 -6.037 -1.788
9 HH TYR 1 HH TYR 1 -4.681 -3.238 -0.336
10 H ALA 2 H ALA 2 -4.237 -10.487 4.093
11 HA ALA 2 HA ALA 2 -4.593 -13.355 3.888
12 HB1 ALA 2 HB1 ALA 2 -5.092 -13.243 6.341
13 HB2 ALA 2 HB2 ALA 2 -3.613 -12.313 5.938
14 HB3 ALA 2 HB3 ALA 2 -5.149 -11.456 6.263
15 H GLU 3 H GLU 3 -6.786 -10.491 4.501
16 HA GLU 3 HA GLU 3 -9.164 -11.802 4.967
17 HB2 GLU 3 HB2 GLU 3 -8.925 -9.343 5.003
18 HB3 GLU 3 HB3 GLU 3 -8.706 -9.307 3.230
19 HG2 GLU 3 HG2 GLU 3 -11.054 -10.070 2.886
20 HG3 GLU 3 HG3 GLU 3 -11.263 -10.303 4.646
21 H GLY 4 H GLY 4 -10.941 -12.648 3.560
22 HA2 GLY 4 HA2 GLY 4 -11.893 -13.444 1.596
23 HA3 GLY 4 HA3 GLY 4 -10.694 -12.516 0.680
24 H THR 5 H THR 5 -8.432 -13.488 0.542
25 HA THR 5 HA THR 5 -8.303 -16.004 -0.461
26 HB THR 5 HB THR 5 -5.915 -16.226 0.388
27 HG1 THR 5 HG1 THR 5 -6.408 -13.770 1.779
28 HG21 THR 5 HG21 THR 5 -6.499 -13.429 -0.784
29 HG22 THR 5 HG22 THR 5 -6.304 -14.941 -1.712
30 HG23 THR 5 HG23 THR 5 -4.939 -14.278 -0.769
31 H PHE 6 H PHE 6 -7.985 -15.286 3.152
32 HA PHE 6 HA PHE 6 -7.210 -17.856 3.824
33 HB2 PHE 6 HB2 PHE 6 -7.904 -17.517 6.078
34 HB3 PHE 6 HB3 PHE 6 -7.445 -15.907 5.498
35 HD1 PHE 6 HD2 PHE 6 -10.270 -18.160 6.449
36 HD2 PHE 6 HD1 PHE 6 -9.266 -14.202 5.110
37 HE1 PHE 6 HE2 PHE 6 -12.489 -17.349 7.175
38 HE2 PHE 6 HE1 PHE 6 -11.464 -13.376 5.901
39 HZ PHE 6 HZ PHE 6 -13.089 -14.954 6.917
40 H ILE 7 H ILE 7 -10.533 -16.677 3.076
41 HA ILE 7 HA ILE 7 -11.886 -18.994 4.044
42 HB ILE 7 HB ILE 7 -12.686 -17.165 1.713
43 HG12 ILE 7 HG12 ILE 7 -13.690 -17.215 4.636
44 HG13 ILE 7 HG13 ILE 7 -12.505 -16.050 4.005
45 HG21 ILE 7 HG21 ILE 7 -13.789 -19.429 1.549
46 HG22 ILE 7 HG22 ILE 7 -14.372 -19.257 3.228
47 HG23 ILE 7 HG23 ILE 7 -14.972 -18.176 1.938
48 HD11 ILE 7 HD11 ILE 7 -14.182 -15.185 2.354
49 HD12 ILE 7 HD12 ILE 7 -15.435 -16.214 3.116
50 HD13 ILE 7 HD13 ILE 7 -14.639 -14.940 4.062
51 H SER 8 H SER 8 -10.508 -18.153 0.727
52 HA SER 8 HA SER 8 -11.082 -20.732 -0.341
53 HB2 SER 8 HB2 SER 8 -10.481 -18.889 -1.823
54 HB3 SER 8 HB3 SER 8 -8.829 -18.799 -1.168
55 HG SER 8 HG SER 8 -8.571 -21.027 -2.004
56 H ASP 9 H ASP 9 -7.781 -19.521 0.861
57 HA ASP 9 HA ASP 9 -7.528 -22.045 2.355
58 HB2 ASP 9 HB2 ASP 9 -5.636 -21.449 -0.000
59 HB3 ASP 9 HB3 ASP 9 -5.410 -22.715 1.233
60 H TYR 10 H TYR 10 -5.078 -19.513 1.159
61 HA TYR 10 HA TYR 10 -4.903 -18.569 3.949
62 HB2 TYR 10 HB2 TYR 10 -2.532 -20.038 2.652
63 HB3 TYR 10 HB3 TYR 10 -2.469 -19.063 4.138
64 HD1 TYR 10 HD2 TYR 10 -3.947 -19.738 6.123
65 HD2 TYR 10 HD1 TYR 10 -3.328 -22.326 2.738
66 HE1 TYR 10 HE2 TYR 10 -4.892 -21.623 7.398
67 HE2 TYR 10 HE1 TYR 10 -4.254 -24.220 4.028
68 HH TYR 10 HH TYR 10 -5.448 -23.948 7.376
69 H SER 11 H SER 11 -2.747 -18.453 0.958
70 HA SER 11 HA SER 11 -3.306 -16.305 -0.287
71 HB2 SER 11 HB2 SER 11 -2.261 -14.250 0.630
72 HB3 SER 11 HB3 SER 11 -3.695 -14.653 1.536
73 HG SER 11 HG SER 11 -2.277 -15.559 3.201
74 H ILE 12 H ILE 12 -0.530 -16.782 2.060
75 HA ILE 12 HA ILE 12 1.707 -17.013 1.685
76 HB ILE 12 HB ILE 12 1.243 -17.458 -1.299
77 HG12 ILE 12 HG12 ILE 12 -0.214 -19.056 -0.151
78 HG13 ILE 12 HG13 ILE 12 1.192 -19.875 -0.851
79 HG21 ILE 12 HG21 ILE 12 3.406 -18.692 -1.120
80 HG22 ILE 12 HG22 ILE 12 3.553 -16.960 -0.717
81 HG23 ILE 12 HG23 ILE 12 3.561 -18.176 0.581
82 HD11 ILE 12 HD11 ILE 12 2.239 -19.995 1.464
83 HD12 ILE 12 HD12 ILE 12 0.790 -19.187 2.140
84 HD13 ILE 12 HD13 ILE 12 0.646 -20.789 1.386
85 H ALA 13 H ALA 13 0.424 -15.164 -1.261
86 HA ALA 13 HA ALA 13 2.647 -13.314 -0.961
87 HB1 ALA 13 HB1 ALA 13 0.102 -13.076 -2.669
88 HB2 ALA 13 HB2 ALA 13 1.595 -12.111 -2.858
89 HB3 ALA 13 HB3 ALA 13 1.625 -13.865 -3.184
90 H MET 14 H MET 14 -0.088 -13.518 1.120
91 HA MET 14 HA MET 14 -0.970 -10.847 1.055
92 HB2 MET 14 HB2 MET 14 -1.689 -11.035 3.376
93 HB3 MET 14 HB3 MET 14 -2.103 -12.503 2.481
94 HG2 MET 14 HG2 MET 14 -1.285 -13.224 4.651
95 HG3 MET 14 HG3 MET 14 0.070 -13.565 3.535
96 HE1 MET 14 HE1 MET 14 0.711 -13.616 6.520
97 HE2 MET 14 HE2 MET 14 1.998 -13.622 5.267
98 HE3 MET 14 HE3 MET 14 2.109 -12.504 6.664
99 H ASP 15 H ASP 15 2.091 -12.301 2.379
100 HA ASP 15 HA ASP 15 2.866 -9.999 3.852
101 HB2 ASP 15 HB2 ASP 15 4.171 -12.112 4.003
102 HB3 ASP 15 HB3 ASP 15 4.651 -11.970 2.291
103 H LYS 16 H LYS 16 3.366 -10.905 0.301
104 HA LYS 16 HA LYS 16 4.837 -8.542 -0.244
105 HB2 LYS 16 HB2 LYS 16 4.798 -10.397 -1.859
106 HB3 LYS 16 HB3 LYS 16 3.057 -10.149 -2.163
107 HG2 LYS 16 HG2 LYS 16 3.498 -7.869 -3.081
108 HG3 LYS 16 HG3 LYS 16 5.229 -8.027 -2.664
109 HD2 LYS 16 HD2 LYS 16 5.473 -9.885 -4.307
110 HD3 LYS 16 HD3 LYS 16 3.719 -9.863 -4.631
111 HE2 LYS 16 HE2 LYS 16 4.973 -8.724 -6.439
112 HE3 LYS 16 HE3 LYS 16 3.868 -7.592 -5.622
113 HZ1 LYS 16 HZ1 LYS 16 6.158 -6.673 -6.121
114 HZ2 LYS 16 HZ2 LYS 16 6.829 -7.802 -4.978
115 HZ3 LYS 16 HZ3 LYS 16 5.728 -6.544 -4.461
116 H ILE 17 H ILE 17 1.238 -9.240 -0.432
117 HA ILE 17 HA ILE 17 0.576 -6.695 -1.537
118 HB ILE 17 HB ILE 17 -1.128 -8.343 0.419
119 HG12 ILE 17 HG12 ILE 17 -0.780 -9.833 -1.452
120 HG13 ILE 17 HG13 ILE 17 -2.371 -9.110 -1.672
121 HG21 ILE 17 HG21 ILE 17 -1.946 -6.071 -1.493
122 HG22 ILE 17 HG22 ILE 17 -3.069 -7.095 -0.560
123 HG23 ILE 17 HG23 ILE 17 -1.945 -6.017 0.286
124 HD11 ILE 17 HD11 ILE 17 -1.359 -7.493 -3.378
125 HD12 ILE 17 HD12 ILE 17 0.204 -8.352 -3.192
126 HD13 ILE 17 HD13 ILE 17 -1.216 -9.213 -3.824
127 H HIS 18 H HIS 18 0.947 -7.776 1.914
128 HA HIS 18 HA HIS 18 0.167 -5.218 2.956
129 HB2 HIS 18 HB2 HIS 18 1.948 -7.364 4.239
130 HB3 HIS 18 HB3 HIS 18 1.141 -6.023 5.093
131 HD1 HIS 18 HD1 HIS 18 0.454 -8.607 6.126
132 HD2 HIS 18 HD2 HIS 18 -1.585 -7.002 2.810
133 HE1 HIS 18 HE1 HIS 18 -1.784 -9.785 6.041
134 H GLN 19 H GLN 19 3.447 -6.670 2.249
135 HA GLN 19 HA GLN 19 5.044 -4.548 3.077
136 HB2 GLN 19 HB2 GLN 19 6.037 -6.629 2.205
137 HB3 GLN 19 HB3 GLN 19 5.349 -6.321 0.598
138 HG2 GLN 19 HG2 GLN 19 6.803 -4.220 0.402
139 HG3 GLN 19 HG3 GLN 19 7.541 -4.661 1.962
140 HE21 GLN 19 HE21 GLN 19 6.816 -5.989 -1.400
141 HE22 GLN 19 HE22 GLN 19 8.235 -6.963 -1.469
142 H GLN 20 H GLN 20 3.531 -4.954 -0.246
143 HA GLN 20 HA GLN 20 4.534 -2.425 -1.141
144 HB2 GLN 20 HB2 GLN 20 2.029 -3.953 -2.078
145 HB3 GLN 20 HB3 GLN 20 2.741 -2.544 -2.904
146 HG2 GLN 20 HG2 GLN 20 4.892 -3.806 -3.246
147 HG3 GLN 20 HG3 GLN 20 4.176 -5.259 -2.521
148 HE21 GLN 20 HE21 GLN 20 1.858 -5.894 -3.566
149 HE22 GLN 20 HE22 GLN 20 1.838 -5.806 -5.285
150 H ASP 21 H ASP 21 1.365 -3.448 0.385
151 HA ASP 21 HA ASP 21 0.209 -0.890 -0.053
152 HB2 ASP 21 HB2 ASP 21 -0.627 -3.079 1.914
153 HB3 ASP 21 HB3 ASP 21 -1.550 -1.590 1.582
154 H PHE 22 H PHE 22 1.360 -2.238 3.258
155 HA PHE 22 HA PHE 22 0.808 0.273 4.390
156 HB2 PHE 22 HB2 PHE 22 2.196 -0.256 6.335
157 HB3 PHE 22 HB3 PHE 22 1.065 -1.554 5.911
158 HD1 PHE 22 HD1 PHE 22 4.687 -0.491 5.541
159 HD2 PHE 22 HD2 PHE 22 1.912 -3.773 5.588
160 HE1 PHE 22 HE1 PHE 22 6.572 -2.084 5.651
161 HE2 PHE 22 HE2 PHE 22 3.800 -5.369 5.615
162 HZ PHE 22 HZ PHE 22 6.137 -4.528 5.703
163 H VAL 23 H VAL 23 3.839 -0.814 2.696
164 HA VAL 23 HA VAL 23 5.357 1.479 3.520
165 HB VAL 23 HB VAL 23 5.488 -0.180 0.935
166 HG11 VAL 23 HG11 VAL 23 7.373 2.082 1.836
167 HG12 VAL 23 HG12 VAL 23 7.706 0.933 0.508
168 HG13 VAL 23 HG13 VAL 23 6.349 2.072 0.367
169 HG21 VAL 23 HG21 VAL 23 7.553 -1.122 1.964
170 HG22 VAL 23 HG22 VAL 23 7.388 -0.035 3.372
171 HG23 VAL 23 HG23 VAL 23 6.200 -1.334 3.100
172 H ASN 24 H ASN 24 3.247 0.931 0.583
173 HA ASN 24 HA ASN 24 3.640 3.563 -0.412
174 HB2 ASN 24 HB2 ASN 24 1.170 1.785 -0.826
175 HB3 ASN 24 HB3 ASN 24 1.693 3.143 -1.864
176 HD21 ASN 24 HD21 ASN 24 1.305 0.863 -3.251
177 HD22 ASN 24 HD22 ASN 24 2.794 0.057 -3.589
178 H TRP 25 H TRP 25 1.163 2.199 1.863
179 HA TRP 25 HA TRP 25 -0.554 4.501 1.727
180 HB2 TRP 25 HB2 TRP 25 -1.325 2.229 2.416
181 HB3 TRP 25 HB3 TRP 25 -0.358 2.326 3.904
182 HD1 TRP 25 HD1 TRP 25 -3.535 3.743 2.303
183 HE1 TRP 25 HE1 TRP 25 -4.950 4.809 4.097
184 HE3 TRP 25 HE3 TRP 25 -0.176 3.592 6.252
185 HZ2 TRP 25 HZ2 TRP 25 -4.808 5.467 6.751
186 HZ3 TRP 25 HZ3 TRP 25 -0.915 4.613 8.421
187 HH2 TRP 25 HH2 TRP 25 -3.199 5.521 8.667
188 H LEU 26 H LEU 26 1.882 3.329 4.203
189 HA LEU 26 HA LEU 26 1.547 5.430 6.025
190 HB2 LEU 26 HB2 LEU 26 4.103 3.934 5.221
191 HB3 LEU 26 HB3 LEU 26 4.074 5.094 6.562
192 HG LEU 26 HG LEU 26 2.214 2.641 6.526
193 HD11 LEU 26 HD11 LEU 26 4.572 1.835 6.348
194 HD12 LEU 26 HD12 LEU 26 3.924 1.501 7.975
195 HD13 LEU 26 HD13 LEU 26 5.047 2.871 7.720
196 HD21 LEU 26 HD21 LEU 26 2.128 2.995 8.976
197 HD22 LEU 26 HD22 LEU 26 1.625 4.494 8.168
198 HD23 LEU 26 HD23 LEU 26 3.265 4.366 8.856
199 H LEU 27 H LEU 27 3.952 5.297 3.258
200 HA LEU 27 HA LEU 27 4.744 7.995 3.784
201 HB2 LEU 27 HB2 LEU 27 6.038 7.939 1.735
202 HB3 LEU 27 HB3 LEU 27 6.190 6.424 2.645
203 HG LEU 27 HG LEU 27 4.272 5.570 0.953
204 HD11 LEU 27 HD11 LEU 27 4.414 6.537 -1.311
205 HD12 LEU 27 HD12 LEU 27 5.585 7.765 -0.756
206 HD13 LEU 27 HD13 LEU 27 3.897 7.814 -0.191
207 HD21 LEU 27 HD21 LEU 27 6.056 4.746 -0.602
208 HD22 LEU 27 HD22 LEU 27 6.552 4.593 1.101
209 HD23 LEU 27 HD23 LEU 27 7.205 5.921 0.102
210 H ALA 28 H ALA 28 2.073 6.627 1.740
211 HA ALA 28 HA ALA 28 1.642 9.239 0.506
212 HB1 ALA 28 HB1 ALA 28 1.036 7.125 -0.688
213 HB2 ALA 28 HB2 ALA 28 -0.232 6.817 0.542
214 HB3 ALA 28 HB3 ALA 28 -0.344 8.245 -0.529
215 H GLN 29 H GLN 29 0.991 8.247 3.791
216 HA GLN 29 HA GLN 29 -1.634 9.370 3.981
217 HB2 GLN 29 HB2 GLN 29 0.612 9.228 6.093
218 HB3 GLN 29 HB3 GLN 29 -1.012 9.883 6.416
219 HG2 GLN 29 HG2 GLN 29 -0.408 6.984 5.597
220 HG3 GLN 29 HG3 GLN 29 -0.927 7.549 7.193
221 HE21 GLN 29 HE21 GLN 29 -2.046 6.882 3.825
222 HE22 GLN 29 HE22 GLN 29 -3.712 7.157 4.172
223 H LYS 30 H LYS 30 1.656 10.965 4.198
224 HA LYS 30 HA LYS 30 0.543 13.530 4.682
225 HB2 LYS 30 HB2 LYS 30 2.969 13.215 4.786
226 HB3 LYS 30 HB3 LYS 30 3.042 12.720 3.077
227 HG2 LYS 30 HG2 LYS 30 3.861 15.022 3.379
228 HG3 LYS 30 HG3 LYS 30 2.437 14.992 2.317
229 HD2 LYS 30 HD2 LYS 30 0.976 15.817 4.109
230 HD3 LYS 30 HD3 LYS 30 2.270 15.679 5.329
231 HE2 LYS 30 HE2 LYS 30 2.520 17.497 2.857
232 HE3 LYS 30 HE3 LYS 30 1.720 18.045 4.353
233 HZ1 LYS 30 HZ1 LYS 30 4.055 18.752 4.287
234 HZ2 LYS 30 HZ2 LYS 30 4.612 17.114 4.222
235 HZ3 LYS 30 HZ3 LYS 30 3.763 17.693 5.629
236 H GLY 31 H GLY 31 1.208 11.753 1.537
237 HA2 GLY 31 HA2 GLY 31 0.139 13.681 -0.191
238 HA3 GLY 31 HA3 GLY 31 0.074 11.928 -0.493
239 H LYS 32 H LYS 32 -1.650 11.264 1.887
240 HA LYS 32 HA LYS 32 -4.121 11.584 0.512
241 HB2 LYS 32 HB2 LYS 32 -3.668 9.684 2.087
242 HB3 LYS 32 HB3 LYS 32 -3.722 10.814 3.469
243 HG2 LYS 32 HG2 LYS 32 -6.078 11.443 2.850
244 HG3 LYS 32 HG3 LYS 32 -6.023 10.264 1.496
245 HD2 LYS 32 HD2 LYS 32 -5.619 8.423 3.191
246 HD3 LYS 32 HD3 LYS 32 -5.826 9.618 4.500
247 HE2 LYS 32 HE2 LYS 32 -7.930 8.764 2.399
248 HE3 LYS 32 HE3 LYS 32 -7.909 8.332 4.125
249 HZ1 LYS 32 HZ1 LYS 32 -8.144 10.807 4.634
250 HZ2 LYS 32 HZ2 LYS 32 -9.512 10.083 3.835
251 HZ3 LYS 32 HZ3 LYS 32 -8.440 11.071 2.928
252 H LYS 33 H LYS 33 -2.697 13.201 3.478
253 HA LYS 33 HA LYS 33 -4.980 14.842 3.950
254 HB2 LYS 33 HB2 LYS 33 -2.018 15.196 4.659
255 HB3 LYS 33 HB3 LYS 33 -3.168 16.523 4.906
256 HG2 LYS 33 HG2 LYS 33 -2.912 15.216 6.991
257 HG3 LYS 33 HG3 LYS 33 -4.587 15.198 6.385
258 HD2 LYS 33 HD2 LYS 33 -4.223 12.884 5.445
259 HD3 LYS 33 HD3 LYS 33 -2.541 12.911 6.060
260 HE2 LYS 33 HE2 LYS 33 -3.383 13.049 8.393
261 HE3 LYS 33 HE3 LYS 33 -5.066 13.175 7.812
262 HZ1 LYS 33 HZ1 LYS 33 -4.551 10.883 8.524
263 HZ2 LYS 33 HZ2 LYS 33 -3.246 10.783 7.377
264 HZ3 LYS 33 HZ3 LYS 33 -4.894 10.921 6.822
265 H ASN 34 H ASN 34 -2.077 15.327 1.765
266 HA ASN 34 HA ASN 34 -2.975 17.897 0.916
267 HB2 ASN 34 HB2 ASN 34 -1.374 15.841 -0.714
268 HB3 ASN 34 HB3 ASN 34 -1.526 17.574 -1.087
269 HD21 ASN 34 HD21 ASN 34 -0.866 19.143 0.859
270 HD22 ASN 34 HD22 ASN 34 0.522 18.645 1.749
271 H ASP 35 H ASP 35 -3.838 14.544 -0.223
272 HA ASP 35 HA ASP 35 -5.334 15.586 -2.477
273 HB2 ASP 35 HB2 ASP 35 -4.350 13.268 -2.421
274 HB3 ASP 35 HB3 ASP 35 -5.526 12.823 -1.158
275 H TRP 36 H TRP 36 -6.123 15.724 0.925
276 HA TRP 36 HA TRP 36 -8.980 16.108 0.139
277 HB2 TRP 36 HB2 TRP 36 -7.935 14.230 2.338
278 HB3 TRP 36 HB3 TRP 36 -9.631 14.764 2.194
279 HD1 TRP 36 HD1 TRP 36 -7.215 12.247 0.787
280 HE1 TRP 36 HE1 TRP 36 -8.343 10.848 -0.978
281 HE3 TRP 36 HE3 TRP 36 -11.472 15.098 0.062
282 HZ2 TRP 36 HZ2 TRP 36 -10.673 10.800 -2.420
283 HZ3 TRP 36 HZ3 TRP 36 -13.111 14.289 -1.653
284 HH2 TRP 36 HH2 TRP 36 -12.741 12.149 -2.837
285 H LYS 37 H LYS 37 -6.920 16.187 3.211
286 HA LYS 37 HA LYS 37 -8.450 18.190 4.377
287 HB2 LYS 37 HB2 LYS 37 -6.747 16.950 5.593
288 HB3 LYS 37 HB3 LYS 37 -5.426 17.736 4.705
289 HG2 LYS 37 HG2 LYS 37 -7.444 19.357 6.384
290 HG3 LYS 37 HG3 LYS 37 -6.004 18.581 7.094
291 HD2 LYS 37 HD2 LYS 37 -4.479 19.888 5.646
292 HD3 LYS 37 HD3 LYS 37 -5.855 20.685 4.856
293 HE2 LYS 37 HE2 LYS 37 -4.918 22.204 6.468
294 HE3 LYS 37 HE3 LYS 37 -6.566 21.747 6.969
295 HZ1 LYS 37 HZ1 LYS 37 -4.885 21.824 8.826
296 HZ2 LYS 37 HZ2 LYS 37 -4.027 20.503 8.087
297 HZ3 LYS 37 HZ3 LYS 37 -5.654 20.289 8.702
298 H HIS 38 H HIS 38 -5.409 18.624 2.333
299 HA HIS 38 HA HIS 38 -5.539 21.441 2.484
300 HB2 HIS 38 HB2 HIS 38 -3.516 20.265 1.596
301 HB3 HIS 38 HB3 HIS 38 -4.467 19.748 0.173
302 HD1 HIS 38 HD1 HIS 38 -2.890 20.957 -1.387
303 HD2 HIS 38 HD2 HIS 38 -4.804 23.477 1.390
304 HE1 HIS 38 HE1 HIS 38 -2.504 23.319 -2.206
305 H ASN 39 H ASN 39 -6.951 19.137 -0.025
306 HA ASN 39 HA ASN 39 -7.974 21.180 -1.652
307 HB2 ASN 39 HB2 ASN 39 -9.195 18.409 -1.100
308 HB3 ASN 39 HB3 ASN 39 -9.725 19.493 -2.409
309 HD21 ASN 39 HD21 ASN 39 -7.892 20.314 -3.978
310 HD22 ASN 39 HD22 ASN 39 -6.681 19.152 -4.365
311 H ILE 40 H ILE 40 -9.237 20.169 1.576
312 HA ILE 40 HA ILE 40 -11.819 21.324 1.189
313 HB ILE 40 HB ILE 40 -10.202 21.421 3.798
314 HG12 ILE 40 HG12 ILE 40 -10.419 19.066 3.275
315 HG13 ILE 40 HG13 ILE 40 -11.578 19.462 4.541
316 HG21 ILE 40 HG21 ILE 40 -13.200 21.851 3.262
317 HG22 ILE 40 HG22 ILE 40 -12.456 21.720 4.880
318 HG23 ILE 40 HG23 ILE 40 -12.022 23.069 3.811
319 HD11 ILE 40 HD11 ILE 40 -13.425 19.488 2.770
320 HD12 ILE 40 HD12 ILE 40 -12.205 19.002 1.548
321 HD13 ILE 40 HD13 ILE 40 -12.585 17.922 2.908
322 H THR 41 H THR 41 -8.674 22.821 2.384
323 HA THR 41 HA THR 41 -9.852 25.471 2.281
324 HB THR 41 HB THR 41 -6.905 24.598 2.360
325 HG1 THR 41 HG1 THR 41 -8.627 25.489 4.458
326 HG21 THR 41 HG21 THR 41 -6.445 26.953 3.055
327 HG22 THR 41 HG22 THR 41 -8.152 27.391 2.745
328 HG23 THR 41 HG23 THR 41 -7.091 26.899 1.390
329 H GLN 42 H GLN 42 -7.345 23.824 0.155
330 HA GLN 42 HA GLN 42 -7.873 25.747 -1.993
331 HB2 GLN 42 HB2 GLN 42 -5.638 24.799 -1.693
332 HB3 GLN 42 HB3 GLN 42 -6.225 23.130 -1.909
333 HG2 GLN 42 HG2 GLN 42 -6.378 25.361 -4.033
334 HG3 GLN 42 HG3 GLN 42 -5.116 24.104 -3.969
335 HE21 GLN 42 HE21 GLN 42 -6.966 24.539 -6.254
336 HE22 GLN 42 HE22 GLN 42 -7.830 23.054 -6.405
Start of MODEL 14
1 H1 TYR 1 H1 TYR 1 -6.026 -13.844 14.119
2 HA TYR 1 HA TYR 1 -3.682 -14.602 12.448
3 HB2 TYR 1 HB2 TYR 1 -6.507 -15.863 12.499
4 HB3 TYR 1 HB3 TYR 1 -5.201 -16.363 11.405
5 HD1 TYR 1 HD2 TYR 1 -3.035 -17.281 12.345
6 HD2 TYR 1 HD1 TYR 1 -6.514 -16.711 14.814
7 HE1 TYR 1 HE2 TYR 1 -2.041 -18.731 14.069
8 HE2 TYR 1 HE1 TYR 1 -5.524 -18.188 16.535
9 HH TYR 1 HH TYR 1 -2.248 -19.576 16.298
10 H ALA 2 H ALA 2 -4.264 -14.569 9.980
11 HA ALA 2 HA ALA 2 -5.617 -12.025 9.345
12 HB1 ALA 2 HB1 ALA 2 -3.651 -12.722 8.006
13 HB2 ALA 2 HB2 ALA 2 -4.466 -14.243 7.544
14 HB3 ALA 2 HB3 ALA 2 -5.111 -12.675 6.970
15 H GLU 3 H GLU 3 -7.671 -12.781 10.539
16 HA GLU 3 HA GLU 3 -8.961 -15.157 9.736
17 HB2 GLU 3 HB2 GLU 3 -9.473 -13.970 11.846
18 HB3 GLU 3 HB3 GLU 3 -10.209 -12.619 10.946
19 HG2 GLU 3 HG2 GLU 3 -11.208 -15.547 10.915
20 HG3 GLU 3 HG3 GLU 3 -11.907 -14.244 11.911
21 H GLY 4 H GLY 4 -10.514 -15.594 8.003
22 HA2 GLY 4 HA2 GLY 4 -12.136 -14.706 6.432
23 HA3 GLY 4 HA3 GLY 4 -11.160 -13.240 6.228
24 H THR 5 H THR 5 -8.483 -14.547 6.059
25 HA THR 5 HA THR 5 -8.698 -15.102 3.206
26 HB THR 5 HB THR 5 -6.259 -15.545 3.316
27 HG1 THR 5 HG1 THR 5 -5.255 -15.353 5.449
28 HG21 THR 5 HG21 THR 5 -5.526 -13.250 3.956
29 HG22 THR 5 HG22 THR 5 -7.046 -12.970 4.844
30 HG23 THR 5 HG23 THR 5 -7.068 -13.165 3.065
31 H PHE 6 H PHE 6 -7.481 -17.079 6.074
32 HA PHE 6 HA PHE 6 -7.140 -19.421 4.620
33 HB2 PHE 6 HB2 PHE 6 -7.273 -20.715 6.645
34 HB3 PHE 6 HB3 PHE 6 -6.486 -19.181 7.055
35 HD1 PHE 6 HD2 PHE 6 -9.632 -21.191 7.282
36 HD2 PHE 6 HD1 PHE 6 -7.706 -17.561 8.568
37 HE1 PHE 6 HE2 PHE 6 -11.203 -21.031 9.182
38 HE2 PHE 6 HE1 PHE 6 -9.263 -17.433 10.492
39 HZ PHE 6 HZ PHE 6 -11.012 -19.156 10.803
40 H ILE 7 H ILE 7 -10.203 -17.958 5.852
41 HA ILE 7 HA ILE 7 -11.798 -20.290 5.241
42 HB ILE 7 HB ILE 7 -12.624 -17.341 5.433
43 HG12 ILE 7 HG12 ILE 7 -12.792 -19.678 7.447
44 HG13 ILE 7 HG13 ILE 7 -11.738 -18.248 7.572
45 HG21 ILE 7 HG21 ILE 7 -14.401 -19.853 5.330
46 HG22 ILE 7 HG22 ILE 7 -14.969 -18.164 5.505
47 HG23 ILE 7 HG23 ILE 7 -14.210 -18.679 3.995
48 HD11 ILE 7 HD11 ILE 7 -13.856 -16.789 7.643
49 HD12 ILE 7 HD12 ILE 7 -14.793 -18.298 7.864
50 HD13 ILE 7 HD13 ILE 7 -13.567 -17.836 9.065
51 H SER 8 H SER 8 -11.158 -17.137 3.420
52 HA SER 8 HA SER 8 -12.581 -18.124 1.136
53 HB2 SER 8 HB2 SER 8 -12.410 -15.735 1.388
54 HB3 SER 8 HB3 SER 8 -10.637 -15.774 1.369
55 HG SER 8 HG SER 8 -12.277 -16.529 -0.868
56 H ASP 9 H ASP 9 -8.953 -17.344 0.968
57 HA ASP 9 HA ASP 9 -8.433 -20.114 0.227
58 HB2 ASP 9 HB2 ASP 9 -9.577 -19.233 -1.868
59 HB3 ASP 9 HB3 ASP 9 -8.368 -17.931 -1.943
60 H TYR 10 H TYR 10 -7.267 -18.586 2.265
61 HA TYR 10 HA TYR 10 -5.200 -18.150 3.117
62 HB2 TYR 10 HB2 TYR 10 -4.260 -19.875 0.758
63 HB3 TYR 10 HB3 TYR 10 -3.318 -19.465 2.208
64 HD1 TYR 10 HD1 TYR 10 -3.928 -20.389 4.419
65 HD2 TYR 10 HD2 TYR 10 -6.237 -21.403 0.935
66 HE1 TYR 10 HE1 TYR 10 -5.224 -22.024 5.745
67 HE2 TYR 10 HE2 TYR 10 -7.605 -22.947 2.284
68 HH TYR 10 HH TYR 10 -8.203 -23.549 4.550
69 H SER 11 H SER 11 -4.556 -17.663 -0.497
70 HA SER 11 HA SER 11 -3.980 -15.688 -1.501
71 HB2 SER 11 HB2 SER 11 -3.561 -14.231 1.155
72 HB3 SER 11 HB3 SER 11 -3.563 -13.585 -0.491
73 HG SER 11 HG SER 11 -5.861 -14.798 0.729
74 H ILE 12 H ILE 12 -1.976 -16.235 1.545
75 HA ILE 12 HA ILE 12 0.176 -16.963 1.716
76 HB ILE 12 HB ILE 12 0.040 -17.736 -1.246
77 HG12 ILE 12 HG12 ILE 12 -0.582 -19.395 1.269
78 HG13 ILE 12 HG13 ILE 12 -1.804 -18.720 0.161
79 HG21 ILE 12 HG21 ILE 12 1.950 -19.195 -0.712
80 HG22 ILE 12 HG22 ILE 12 2.366 -17.524 -0.297
81 HG23 ILE 12 HG23 ILE 12 1.917 -18.671 0.996
82 HD11 ILE 12 HD11 ILE 12 -1.479 -21.054 -0.414
83 HD12 ILE 12 HD12 ILE 12 -0.834 -20.054 -1.746
84 HD13 ILE 12 HD13 ILE 12 0.278 -20.856 -0.595
85 H ALA 13 H ALA 13 0.273 -15.433 -1.657
86 HA ALA 13 HA ALA 13 2.717 -14.098 -0.917
87 HB1 ALA 13 HB1 ALA 13 0.788 -13.464 -3.228
88 HB2 ALA 13 HB2 ALA 13 2.468 -12.869 -3.065
89 HB3 ALA 13 HB3 ALA 13 2.160 -14.614 -3.300
90 H MET 14 H MET 14 -0.627 -13.353 -0.029
91 HA MET 14 HA MET 14 -0.763 -10.686 -0.074
92 HB2 MET 14 HB2 MET 14 -1.897 -10.683 2.150
93 HB3 MET 14 HB3 MET 14 -2.453 -12.004 1.102
94 HG2 MET 14 HG2 MET 14 -0.900 -13.612 2.356
95 HG3 MET 14 HG3 MET 14 -0.451 -12.270 3.452
96 HE1 MET 14 HE1 MET 14 -2.913 -14.630 5.529
97 HE2 MET 14 HE2 MET 14 -1.623 -15.060 4.367
98 HE3 MET 14 HE3 MET 14 -1.340 -13.778 5.597
99 H ASP 15 H ASP 15 1.693 -12.451 1.967
100 HA ASP 15 HA ASP 15 2.426 -10.355 3.645
101 HB2 ASP 15 HB2 ASP 15 4.353 -12.224 2.138
102 HB3 ASP 15 HB3 ASP 15 4.771 -11.224 3.555
103 H LYS 16 H LYS 16 3.368 -10.826 0.143
104 HA LYS 16 HA LYS 16 4.978 -8.465 -0.001
105 HB2 LYS 16 HB2 LYS 16 3.213 -9.725 -2.201
106 HB3 LYS 16 HB3 LYS 16 4.396 -8.417 -2.455
107 HG2 LYS 16 HG2 LYS 16 6.241 -9.899 -1.662
108 HG3 LYS 16 HG3 LYS 16 5.094 -11.252 -1.452
109 HD2 LYS 16 HD2 LYS 16 4.483 -11.082 -3.908
110 HD3 LYS 16 HD3 LYS 16 5.735 -9.828 -4.111
111 HE2 LYS 16 HE2 LYS 16 6.205 -12.755 -3.240
112 HE3 LYS 16 HE3 LYS 16 6.523 -12.067 -4.852
113 HZ1 LYS 16 HZ1 LYS 16 8.608 -12.180 -3.678
114 HZ2 LYS 16 HZ2 LYS 16 7.988 -11.399 -2.275
115 HZ3 LYS 16 HZ3 LYS 16 8.174 -10.499 -3.764
116 H ILE 17 H ILE 17 1.398 -9.029 -0.529
117 HA ILE 17 HA ILE 17 0.890 -6.324 -1.257
118 HB ILE 17 HB ILE 17 -0.995 -8.300 0.115
119 HG12 ILE 17 HG12 ILE 17 -0.264 -9.112 -2.150
120 HG13 ILE 17 HG13 ILE 17 -1.987 -8.714 -2.084
121 HG21 ILE 17 HG21 ILE 17 -1.616 -5.558 -1.087
122 HG22 ILE 17 HG22 ILE 17 -2.856 -6.802 -0.754
123 HG23 ILE 17 HG23 ILE 17 -1.898 -6.127 0.578
124 HD11 ILE 17 HD11 ILE 17 0.203 -6.959 -3.384
125 HD12 ILE 17 HD12 ILE 17 -1.001 -7.965 -4.213
126 HD13 ILE 17 HD13 ILE 17 -1.536 -6.543 -3.290
127 H HIS 18 H HIS 18 1.382 -7.859 1.989
128 HA HIS 18 HA HIS 18 0.351 -5.605 3.429
129 HB2 HIS 18 HB2 HIS 18 2.627 -7.444 4.350
130 HB3 HIS 18 HB3 HIS 18 1.590 -6.427 5.373
131 HD1 HIS 18 HD1 HIS 18 1.707 -9.282 6.031
132 HD2 HIS 18 HD2 HIS 18 -1.028 -7.769 3.211
133 HE1 HIS 18 HE1 HIS 18 -0.163 -10.981 5.894
134 H GLN 19 H GLN 19 3.704 -6.496 2.190
135 HA GLN 19 HA GLN 19 4.936 -4.152 3.179
136 HB2 GLN 19 HB2 GLN 19 6.230 -6.051 2.249
137 HB3 GLN 19 HB3 GLN 19 5.664 -5.673 0.604
138 HG2 GLN 19 HG2 GLN 19 6.725 -3.407 0.725
139 HG3 GLN 19 HG3 GLN 19 7.281 -3.743 2.388
140 HE21 GLN 19 HE21 GLN 19 8.692 -5.852 2.650
141 HE22 GLN 19 HE22 GLN 19 9.826 -6.124 1.381
142 H GLN 20 H GLN 20 3.450 -4.746 -0.120
143 HA GLN 20 HA GLN 20 3.789 -2.162 -1.118
144 HB2 GLN 20 HB2 GLN 20 2.773 -4.044 -2.433
145 HB3 GLN 20 HB3 GLN 20 1.332 -3.990 -1.384
146 HG2 GLN 20 HG2 GLN 20 0.787 -1.680 -2.214
147 HG3 GLN 20 HG3 GLN 20 2.252 -1.705 -3.231
148 HE21 GLN 20 HE21 GLN 20 -0.819 -3.630 -2.563
149 HE22 GLN 20 HE22 GLN 20 -1.008 -4.143 -4.198
150 H ASP 21 H ASP 21 1.178 -3.420 1.125
151 HA ASP 21 HA ASP 21 -0.292 -0.971 1.005
152 HB2 ASP 21 HB2 ASP 21 -0.404 -3.160 3.151
153 HB3 ASP 21 HB3 ASP 21 -1.525 -1.782 2.999
154 H PHE 22 H PHE 22 1.723 -2.241 3.908
155 HA PHE 22 HA PHE 22 1.319 0.289 5.116
156 HB2 PHE 22 HB2 PHE 22 2.977 -0.261 6.801
157 HB3 PHE 22 HB3 PHE 22 1.833 -1.590 6.532
158 HD1 PHE 22 HD1 PHE 22 5.301 -0.389 5.641
159 HD2 PHE 22 HD2 PHE 22 2.689 -3.796 6.013
160 HE1 PHE 22 HE1 PHE 22 7.237 -1.909 5.400
161 HE2 PHE 22 HE2 PHE 22 4.635 -5.305 5.832
162 HZ PHE 22 HZ PHE 22 6.913 -4.369 5.497
163 H VAL 23 H VAL 23 4.008 -0.852 2.931
164 HA VAL 23 HA VAL 23 5.605 1.463 3.434
165 HB VAL 23 HB VAL 23 5.440 -0.207 0.865
166 HG11 VAL 23 HG11 VAL 23 7.405 2.034 1.644
167 HG12 VAL 23 HG12 VAL 23 7.629 0.919 0.267
168 HG13 VAL 23 HG13 VAL 23 6.263 2.053 0.269
169 HG21 VAL 23 HG21 VAL 23 6.350 -1.447 2.879
170 HG22 VAL 23 HG22 VAL 23 7.621 -1.147 1.671
171 HG23 VAL 23 HG23 VAL 23 7.535 -0.144 3.144
172 H ASN 24 H ASN 24 3.121 0.853 0.767
173 HA ASN 24 HA ASN 24 3.511 3.489 -0.242
174 HB2 ASN 24 HB2 ASN 24 2.504 1.703 -1.652
175 HB3 ASN 24 HB3 ASN 24 1.038 1.708 -0.641
176 HD21 ASN 24 HD21 ASN 24 3.141 3.894 -2.708
177 HD22 ASN 24 HD22 ASN 24 1.848 4.947 -3.146
178 H TRP 25 H TRP 25 0.865 2.063 1.840
179 HA TRP 25 HA TRP 25 -0.781 4.245 2.040
180 HB2 TRP 25 HB2 TRP 25 -1.363 2.145 3.215
181 HB3 TRP 25 HB3 TRP 25 0.081 2.302 4.250
182 HD1 TRP 25 HD1 TRP 25 -2.618 5.052 3.600
183 HE1 TRP 25 HE1 TRP 25 -3.514 5.788 5.832
184 HE3 TRP 25 HE3 TRP 25 -0.015 1.794 6.704
185 HZ2 TRP 25 HZ2 TRP 25 -3.305 5.144 8.487
186 HZ3 TRP 25 HZ3 TRP 25 -0.482 1.937 9.153
187 HH2 TRP 25 HH2 TRP 25 -2.100 3.588 10.033
188 H LEU 26 H LEU 26 2.217 3.667 4.094
189 HA LEU 26 HA LEU 26 1.569 5.948 5.752
190 HB2 LEU 26 HB2 LEU 26 4.243 4.501 5.354
191 HB3 LEU 26 HB3 LEU 26 3.939 5.723 6.606
192 HG LEU 26 HG LEU 26 2.374 3.052 6.422
193 HD11 LEU 26 HD11 LEU 26 3.848 2.281 8.296
194 HD12 LEU 26 HD12 LEU 26 4.789 3.798 8.183
195 HD13 LEU 26 HD13 LEU 26 4.807 2.625 6.835
196 HD21 LEU 26 HD21 LEU 26 1.781 3.563 8.812
197 HD22 LEU 26 HD22 LEU 26 1.079 4.736 7.680
198 HD23 LEU 26 HD23 LEU 26 2.527 5.174 8.635
199 H LEU 27 H LEU 27 4.133 5.496 3.160
200 HA LEU 27 HA LEU 27 4.808 8.263 3.252
201 HB2 LEU 27 HB2 LEU 27 6.047 7.969 1.189
202 HB3 LEU 27 HB3 LEU 27 6.277 6.577 2.270
203 HG LEU 27 HG LEU 27 4.361 5.445 0.801
204 HD11 LEU 27 HD11 LEU 27 3.700 7.438 -0.619
205 HD12 LEU 27 HD12 LEU 27 4.366 6.130 -1.602
206 HD13 LEU 27 HD13 LEU 27 5.379 7.549 -1.207
207 HD21 LEU 27 HD21 LEU 27 7.198 5.883 -0.284
208 HD22 LEU 27 HD22 LEU 27 6.102 4.558 -0.778
209 HD23 LEU 27 HD23 LEU 27 6.704 4.635 0.896
210 H ALA 28 H ALA 28 2.046 6.595 1.674
211 HA ALA 28 HA ALA 28 1.524 8.839 -0.115
212 HB1 ALA 28 HB1 ALA 28 -0.343 6.574 0.822
213 HB2 ALA 28 HB2 ALA 28 -0.672 7.739 -0.492
214 HB3 ALA 28 HB3 ALA 28 0.666 6.563 -0.657
215 H GLN 29 H GLN 29 0.318 7.716 3.160
216 HA GLN 29 HA GLN 29 -1.705 9.673 3.391
217 HB2 GLN 29 HB2 GLN 29 -1.675 7.861 5.005
218 HB3 GLN 29 HB3 GLN 29 -0.036 8.270 5.567
219 HG2 GLN 29 HG2 GLN 29 -0.824 10.440 6.504
220 HG3 GLN 29 HG3 GLN 29 -2.464 10.136 5.885
221 HE21 GLN 29 HE21 GLN 29 -3.662 8.171 6.834
222 HE22 GLN 29 HE22 GLN 29 -3.256 7.704 8.444
223 H LYS 30 H LYS 30 1.744 9.769 4.688
224 HA LYS 30 HA LYS 30 1.472 12.534 5.401
225 HB2 LYS 30 HB2 LYS 30 3.357 10.803 6.075
226 HB3 LYS 30 HB3 LYS 30 4.176 11.334 4.587
227 HG2 LYS 30 HG2 LYS 30 3.309 13.063 7.011
228 HG3 LYS 30 HG3 LYS 30 4.965 12.518 6.643
229 HD2 LYS 30 HD2 LYS 30 4.878 13.911 4.486
230 HD3 LYS 30 HD3 LYS 30 3.302 14.545 5.039
231 HE2 LYS 30 HE2 LYS 30 4.366 15.374 7.164
232 HE3 LYS 30 HE3 LYS 30 5.957 14.860 6.537
233 HZ1 LYS 30 HZ1 LYS 30 4.111 16.884 5.207
234 HZ2 LYS 30 HZ2 LYS 30 5.705 16.418 4.650
235 HZ3 LYS 30 HZ3 LYS 30 5.519 17.262 6.157
236 H GLY 31 H GLY 31 2.668 10.761 2.438
237 HA2 GLY 31 HA2 GLY 31 3.584 12.745 0.865
238 HA3 GLY 31 HA3 GLY 31 2.532 11.469 0.204
239 H LYS 32 H LYS 32 -0.067 12.076 1.207
240 HA LYS 32 HA LYS 32 -0.574 14.269 -0.578
241 HB2 LYS 32 HB2 LYS 32 -2.884 14.127 -0.199
242 HB3 LYS 32 HB3 LYS 32 -2.262 12.459 -0.234
243 HG2 LYS 32 HG2 LYS 32 -2.396 12.409 2.292
244 HG3 LYS 32 HG3 LYS 32 -3.004 14.091 2.282
245 HD2 LYS 32 HD2 LYS 32 -5.021 13.368 0.972
246 HD3 LYS 32 HD3 LYS 32 -4.376 11.705 0.924
247 HE2 LYS 32 HE2 LYS 32 -6.069 11.752 2.635
248 HE3 LYS 32 HE3 LYS 32 -4.496 11.616 3.462
249 HZ1 LYS 32 HZ1 LYS 32 -6.019 13.200 4.575
250 HZ2 LYS 32 HZ2 LYS 32 -6.133 14.162 3.132
251 HZ3 LYS 32 HZ3 LYS 32 -4.625 14.038 4.019
252 H LYS 33 H LYS 33 -0.583 13.988 3.123
253 HA LYS 33 HA LYS 33 -1.416 16.556 3.667
254 HB2 LYS 33 HB2 LYS 33 -0.827 15.044 5.494
255 HB3 LYS 33 HB3 LYS 33 0.892 15.073 5.033
256 HG2 LYS 33 HG2 LYS 33 1.043 17.512 5.550
257 HG3 LYS 33 HG3 LYS 33 -0.698 17.539 5.953
258 HD2 LYS 33 HD2 LYS 33 -0.314 15.978 7.847
259 HD3 LYS 33 HD3 LYS 33 1.413 15.826 7.416
260 HE2 LYS 33 HE2 LYS 33 1.789 18.240 7.885
261 HE3 LYS 33 HE3 LYS 33 0.049 18.479 8.212
262 HZ1 LYS 33 HZ1 LYS 33 1.342 18.243 10.299
263 HZ2 LYS 33 HZ2 LYS 33 1.894 16.665 9.807
264 HZ3 LYS 33 HZ3 LYS 33 0.200 16.944 10.129
265 H ASN 34 H ASN 34 1.940 15.535 2.609
266 HA ASN 34 HA ASN 34 2.958 18.196 2.637
267 HB2 ASN 34 HB2 ASN 34 4.482 16.226 2.429
268 HB3 ASN 34 HB3 ASN 34 3.817 15.845 0.831
269 HD21 ASN 34 HD21 ASN 34 5.450 18.571 2.670
270 HD22 ASN 34 HD22 ASN 34 6.232 19.214 1.274
271 H ASP 35 H ASP 35 1.492 16.196 -0.090
272 HA ASP 35 HA ASP 35 1.327 18.728 -1.693
273 HB2 ASP 35 HB2 ASP 35 2.617 16.791 -2.626
274 HB3 ASP 35 HB3 ASP 35 1.137 15.801 -2.573
275 H TRP 36 H TRP 36 -0.535 18.695 0.367
276 HA TRP 36 HA TRP 36 -2.891 18.967 -1.266
277 HB2 TRP 36 HB2 TRP 36 -3.447 16.658 -1.040
278 HB3 TRP 36 HB3 TRP 36 -2.987 16.606 0.673
279 HD1 TRP 36 HD1 TRP 36 -5.652 18.488 -1.453
280 HE1 TRP 36 HE1 TRP 36 -7.683 18.854 0.006
281 HE3 TRP 36 HE3 TRP 36 -3.928 16.395 2.971
282 HZ2 TRP 36 HZ2 TRP 36 -8.487 18.465 2.598
283 HZ3 TRP 36 HZ3 TRP 36 -5.429 16.525 4.962
284 HH2 TRP 36 HH2 TRP 36 -7.664 17.571 4.787
285 H LYS 37 H LYS 37 -2.440 18.298 2.349
286 HA LYS 37 HA LYS 37 -4.233 20.378 2.949
287 HB2 LYS 37 HB2 LYS 37 -3.638 18.784 4.724
288 HB3 LYS 37 HB3 LYS 37 -1.922 19.248 4.634
289 HG2 LYS 37 HG2 LYS 37 -2.982 20.203 6.628
290 HG3 LYS 37 HG3 LYS 37 -2.416 21.504 5.559
291 HD2 LYS 37 HD2 LYS 37 -4.742 21.865 4.719
292 HD3 LYS 37 HD3 LYS 37 -5.339 20.519 5.728
293 HE2 LYS 37 HE2 LYS 37 -4.044 23.130 6.764
294 HE3 LYS 37 HE3 LYS 37 -5.795 22.819 6.653
295 HZ1 LYS 37 HZ1 LYS 37 -5.106 22.465 8.918
296 HZ2 LYS 37 HZ2 LYS 37 -3.846 21.376 8.482
297 HZ3 LYS 37 HZ3 LYS 37 -5.516 20.916 8.245
298 H HIS 38 H HIS 38 -0.574 20.377 2.835
299 HA HIS 38 HA HIS 38 -0.348 23.148 3.511
300 HB2 HIS 38 HB2 HIS 38 1.521 21.554 1.657
301 HB3 HIS 38 HB3 HIS 38 1.921 23.049 2.538
302 HD1 HIS 38 HD1 HIS 38 3.775 20.942 2.984
303 HD2 HIS 38 HD2 HIS 38 0.193 21.091 5.192
304 HE1 HIS 38 HE1 HIS 38 4.190 19.580 5.069
305 H ASN 39 H ASN 39 -0.684 21.342 0.365
306 HA ASN 39 HA ASN 39 -0.259 23.580 -1.288
307 HB2 ASN 39 HB2 ASN 39 -0.300 21.159 -2.040
308 HB3 ASN 39 HB3 ASN 39 -2.074 21.181 -1.909
309 HD21 ASN 39 HD21 ASN 39 -3.271 22.901 -3.317
310 HD22 ASN 39 HD22 ASN 39 -2.522 23.318 -4.812
311 H ILE 40 H ILE 40 -3.370 22.372 0.265
312 HA ILE 40 HA ILE 40 -5.008 24.223 -1.183
313 HB ILE 40 HB ILE 40 -5.553 23.177 1.660
314 HG12 ILE 40 HG12 ILE 40 -5.500 21.161 0.362
315 HG13 ILE 40 HG13 ILE 40 -7.189 21.576 0.597
316 HG21 ILE 40 HG21 ILE 40 -7.950 23.792 1.134
317 HG22 ILE 40 HG22 ILE 40 -6.874 25.201 1.158
318 HG23 ILE 40 HG23 ILE 40 -7.405 24.522 -0.403
319 HD11 ILE 40 HD11 ILE 40 -6.833 20.788 -1.705
320 HD12 ILE 40 HD12 ILE 40 -7.268 22.513 -1.773
321 HD13 ILE 40 HD13 ILE 40 -5.564 22.001 -1.991
322 H THR 41 H THR 41 -3.327 24.319 2.084
323 HA THR 41 HA THR 41 -4.287 26.788 2.858
324 HB THR 41 HB THR 41 -1.374 25.902 3.305
325 HG1 THR 41 HG1 THR 41 -3.695 24.956 4.692
326 HG21 THR 41 HG21 THR 41 -1.960 28.182 4.219
327 HG22 THR 41 HG22 THR 41 -1.680 26.995 5.531
328 HG23 THR 41 HG23 THR 41 -3.345 27.469 5.102
329 H GLN 42 H GLN 42 -1.426 26.047 0.701
330 HA GLN 42 HA GLN 42 -1.084 28.887 0.028
331 HB2 GLN 42 HB2 GLN 42 0.830 27.315 -0.209
332 HB3 GLN 42 HB3 GLN 42 -0.087 26.339 -1.383
333 HG2 GLN 42 HG2 GLN 42 1.509 27.840 -2.563
334 HG3 GLN 42 HG3 GLN 42 -0.169 28.225 -2.996
335 HE21 GLN 42 HE21 GLN 42 2.478 29.230 -0.636
336 HE22 GLN 42 HE22 GLN 42 2.030 30.895 -0.655
Start of MODEL 15
1 H1 TYR 1 H1 TYR 1 -4.848 -7.022 14.158
2 HA TYR 1 HA TYR 1 -2.336 -7.528 12.647
3 HB2 TYR 1 HB2 TYR 1 -4.083 -9.566 14.172
4 HB3 TYR 1 HB3 TYR 1 -2.668 -9.991 13.184
5 HD1 TYR 1 HD1 TYR 1 -3.781 -8.301 16.321
6 HD2 TYR 1 HD2 TYR 1 -0.373 -9.455 13.960
7 HE1 TYR 1 HE1 TYR 1 -2.302 -7.818 18.229
8 HE2 TYR 1 HE2 TYR 1 1.109 -8.991 15.884
9 HH TYR 1 HH TYR 1 -0.061 -7.879 19.065
10 H ALA 2 H ALA 2 -2.675 -9.167 10.779
11 HA ALA 2 HA ALA 2 -5.246 -8.483 9.401
12 HB1 ALA 2 HB1 ALA 2 -4.079 -9.339 7.388
13 HB2 ALA 2 HB2 ALA 2 -3.119 -8.060 8.189
14 HB3 ALA 2 HB3 ALA 2 -2.650 -9.772 8.382
15 H GLU 3 H GLU 3 -6.284 -9.976 11.208
16 HA GLU 3 HA GLU 3 -5.618 -12.726 11.213
17 HB2 GLU 3 HB2 GLU 3 -6.954 -11.731 13.024
18 HB3 GLU 3 HB3 GLU 3 -8.295 -11.378 11.898
19 HG2 GLU 3 HG2 GLU 3 -8.746 -13.796 11.576
20 HG3 GLU 3 HG3 GLU 3 -7.297 -14.232 12.524
21 H GLY 4 H GLY 4 -6.602 -14.607 10.097
22 HA2 GLY 4 HA2 GLY 4 -8.155 -15.529 8.546
23 HA3 GLY 4 HA3 GLY 4 -8.476 -13.929 7.852
24 H THR 5 H THR 5 -5.770 -12.943 7.486
25 HA THR 5 HA THR 5 -5.196 -14.319 5.045
26 HB THR 5 HB THR 5 -3.148 -13.008 4.858
27 HG1 THR 5 HG1 THR 5 -3.602 -11.974 7.478
28 HG21 THR 5 HG21 THR 5 -5.356 -11.944 4.224
29 HG22 THR 5 HG22 THR 5 -4.113 -10.767 4.720
30 HG23 THR 5 HG23 THR 5 -5.431 -11.191 5.844
31 H PHE 6 H PHE 6 -3.395 -14.292 8.285
32 HA PHE 6 HA PHE 6 -1.455 -16.126 7.382
33 HB2 PHE 6 HB2 PHE 6 -0.922 -16.654 9.672
34 HB3 PHE 6 HB3 PHE 6 -1.271 -14.918 9.581
35 HD1 PHE 6 HD1 PHE 6 -2.640 -18.269 10.584
36 HD2 PHE 6 HD2 PHE 6 -3.186 -14.003 10.864
37 HE1 PHE 6 HE1 PHE 6 -4.240 -18.593 12.436
38 HE2 PHE 6 HE2 PHE 6 -4.725 -14.341 12.777
39 HZ PHE 6 HZ PHE 6 -5.333 -16.632 13.498
40 H ILE 7 H ILE 7 -4.884 -16.702 8.369
41 HA ILE 7 HA ILE 7 -4.494 -19.558 8.652
42 HB ILE 7 HB ILE 7 -7.080 -18.032 8.016
43 HG12 ILE 7 HG12 ILE 7 -6.001 -19.142 10.682
44 HG13 ILE 7 HG13 ILE 7 -6.078 -17.418 10.236
45 HG21 ILE 7 HG21 ILE 7 -8.248 -20.152 8.622
46 HG22 ILE 7 HG22 ILE 7 -7.153 -20.441 7.268
47 HG23 ILE 7 HG23 ILE 7 -6.676 -20.951 8.910
48 HD11 ILE 7 HD11 ILE 7 -7.953 -17.822 11.681
49 HD12 ILE 7 HD12 ILE 7 -8.623 -17.639 10.036
50 HD13 ILE 7 HD13 ILE 7 -8.473 -19.260 10.781
51 H SER 8 H SER 8 -5.798 -17.415 5.951
52 HA SER 8 HA SER 8 -5.906 -19.814 4.231
53 HB2 SER 8 HB2 SER 8 -7.799 -18.249 4.246
54 HB3 SER 8 HB3 SER 8 -6.751 -16.915 3.682
55 HG SER 8 HG SER 8 -7.802 -18.036 1.869
56 H ASP 9 H ASP 9 -4.384 -16.477 3.943
57 HA ASP 9 HA ASP 9 -3.012 -17.253 1.524
58 HB2 ASP 9 HB2 ASP 9 -2.509 -14.932 3.456
59 HB3 ASP 9 HB3 ASP 9 -1.759 -15.095 1.846
60 H TYR 10 H TYR 10 -2.075 -17.197 5.033
61 HA TYR 10 HA TYR 10 -0.376 -18.299 6.062
62 HB2 TYR 10 HB2 TYR 10 0.729 -19.368 3.419
63 HB3 TYR 10 HB3 TYR 10 1.112 -19.873 5.060
64 HD1 TYR 10 HD1 TYR 10 -0.852 -20.699 6.577
65 HD2 TYR 10 HD2 TYR 10 -1.151 -20.436 2.290
66 HE1 TYR 10 HE1 TYR 10 -2.685 -22.337 6.610
67 HE2 TYR 10 HE2 TYR 10 -2.992 -22.078 2.327
68 HH TYR 10 HH TYR 10 -4.302 -23.530 5.312
69 H SER 11 H SER 11 1.273 -17.029 2.980
70 HA SER 11 HA SER 11 2.773 -15.190 4.730
71 HB2 SER 11 HB2 SER 11 4.177 -17.665 3.527
72 HB3 SER 11 HB3 SER 11 4.983 -16.261 4.270
73 HG SER 11 HG SER 11 3.284 -18.077 5.684
74 H ILE 12 H ILE 12 3.108 -16.874 1.444
75 HA ILE 12 HA ILE 12 4.985 -14.894 0.674
76 HB ILE 12 HB ILE 12 3.371 -16.819 -1.054
77 HG12 ILE 12 HG12 ILE 12 6.362 -16.840 -0.284
78 HG13 ILE 12 HG13 ILE 12 5.128 -17.734 0.622
79 HG21 ILE 12 HG21 ILE 12 5.685 -14.958 -1.888
80 HG22 ILE 12 HG22 ILE 12 4.960 -16.214 -2.928
81 HG23 ILE 12 HG23 ILE 12 3.995 -14.821 -2.444
82 HD11 ILE 12 HD11 ILE 12 4.522 -19.038 -1.448
83 HD12 ILE 12 HD12 ILE 12 5.875 -18.258 -2.319
84 HD13 ILE 12 HD13 ILE 12 6.206 -19.286 -0.911
85 H ALA 13 H ALA 13 1.539 -15.225 -0.629
86 HA ALA 13 HA ALA 13 1.789 -12.731 -1.980
87 HB1 ALA 13 HB1 ALA 13 -0.703 -12.748 -2.180
88 HB2 ALA 13 HB2 ALA 13 0.011 -14.330 -2.621
89 HB3 ALA 13 HB3 ALA 13 -0.800 -14.125 -1.044
90 H MET 14 H MET 14 0.033 -13.519 1.144
91 HA MET 14 HA MET 14 -0.760 -10.944 1.702
92 HB2 MET 14 HB2 MET 14 -0.808 -11.515 4.109
93 HB3 MET 14 HB3 MET 14 -1.472 -12.801 3.081
94 HG2 MET 14 HG2 MET 14 0.699 -14.098 3.320
95 HG3 MET 14 HG3 MET 14 1.341 -12.819 4.393
96 HE1 MET 14 HE1 MET 14 1.020 -13.024 7.025
97 HE2 MET 14 HE2 MET 14 -0.318 -11.943 6.504
98 HE3 MET 14 HE3 MET 14 -0.638 -13.265 7.668
99 H ASP 15 H ASP 15 2.638 -12.228 2.241
100 HA ASP 15 HA ASP 15 3.383 -9.834 3.680
101 HB2 ASP 15 HB2 ASP 15 4.820 -11.857 3.797
102 HB3 ASP 15 HB3 ASP 15 5.195 -11.722 2.059
103 H LYS 16 H LYS 16 3.798 -10.878 0.160
104 HA LYS 16 HA LYS 16 4.998 -8.504 -0.702
105 HB2 LYS 16 HB2 LYS 16 4.672 -10.453 -2.220
106 HB3 LYS 16 HB3 LYS 16 2.905 -10.211 -2.195
107 HG2 LYS 16 HG2 LYS 16 3.200 -7.947 -3.294
108 HG3 LYS 16 HG3 LYS 16 4.962 -8.209 -3.318
109 HD2 LYS 16 HD2 LYS 16 4.608 -10.230 -4.795
110 HD3 LYS 16 HD3 LYS 16 2.842 -9.975 -4.718
111 HE2 LYS 16 HE2 LYS 16 3.100 -7.738 -5.810
112 HE3 LYS 16 HE3 LYS 16 4.870 -7.957 -5.874
113 HZ1 LYS 16 HZ1 LYS 16 3.821 -8.515 -8.025
114 HZ2 LYS 16 HZ2 LYS 16 2.820 -9.719 -7.263
115 HZ3 LYS 16 HZ3 LYS 16 4.553 -9.933 -7.328
116 H ILE 17 H ILE 17 1.426 -9.221 -0.340
117 HA ILE 17 HA ILE 17 0.758 -6.659 -1.542
118 HB ILE 17 HB ILE 17 -1.002 -8.601 0.032
119 HG12 ILE 17 HG12 ILE 17 -0.217 -9.772 -1.966
120 HG13 ILE 17 HG13 ILE 17 -1.900 -9.284 -2.211
121 HG21 ILE 17 HG21 ILE 17 -1.777 -6.165 -1.676
122 HG22 ILE 17 HG22 ILE 17 -2.924 -7.383 -1.047
123 HG23 ILE 17 HG23 ILE 17 -2.006 -6.364 0.080
124 HD11 ILE 17 HD11 ILE 17 -0.636 -8.952 -4.277
125 HD12 ILE 17 HD12 ILE 17 -1.061 -7.337 -3.662
126 HD13 ILE 17 HD13 ILE 17 0.601 -7.975 -3.470
127 H HIS 18 H HIS 18 0.886 -7.910 1.901
128 HA HIS 18 HA HIS 18 -0.186 -5.448 2.938
129 HB2 HIS 18 HB2 HIS 18 1.670 -7.461 4.344
130 HB3 HIS 18 HB3 HIS 18 0.744 -6.156 5.134
131 HD1 HIS 18 HD1 HIS 18 0.117 -8.714 6.207
132 HD2 HIS 18 HD2 HIS 18 -1.720 -7.396 2.653
133 HE1 HIS 18 HE1 HIS 18 -2.016 -10.043 5.984
134 H GLN 19 H GLN 19 3.249 -6.659 2.626
135 HA GLN 19 HA GLN 19 4.511 -4.301 3.472
136 HB2 GLN 19 HB2 GLN 19 5.349 -6.261 1.248
137 HB3 GLN 19 HB3 GLN 19 6.367 -4.898 1.757
138 HG2 GLN 19 HG2 GLN 19 5.379 -7.128 3.647
139 HG3 GLN 19 HG3 GLN 19 6.978 -7.093 2.854
140 HE21 GLN 19 HE21 GLN 19 6.821 -7.244 5.672
141 HE22 GLN 19 HE22 GLN 19 7.401 -5.753 6.317
142 H GLN 20 H GLN 20 3.553 -5.153 0.057
143 HA GLN 20 HA GLN 20 4.349 -2.727 -1.088
144 HB2 GLN 20 HB2 GLN 20 3.583 -4.714 -2.379
145 HB3 GLN 20 HB3 GLN 20 1.911 -4.476 -1.793
146 HG2 GLN 20 HG2 GLN 20 1.791 -2.284 -3.018
147 HG3 GLN 20 HG3 GLN 20 3.461 -2.524 -3.605
148 HE21 GLN 20 HE21 GLN 20 3.842 -4.761 -4.848
149 HE22 GLN 20 HE22 GLN 20 2.523 -5.285 -5.829
150 H ASP 21 H ASP 21 1.143 -3.514 0.498
151 HA ASP 21 HA ASP 21 0.043 -1.023 -0.479
152 HB2 ASP 21 HB2 ASP 21 -1.111 -2.981 1.571
153 HB3 ASP 21 HB3 ASP 21 -1.962 -1.600 0.832
154 H PHE 22 H PHE 22 0.848 -2.152 2.990
155 HA PHE 22 HA PHE 22 0.093 0.445 3.901
156 HB2 PHE 22 HB2 PHE 22 1.019 -0.019 6.082
157 HB3 PHE 22 HB3 PHE 22 0.042 -1.384 5.505
158 HD1 PHE 22 HD2 PHE 22 3.580 -0.121 5.878
159 HD2 PHE 22 HD1 PHE 22 1.056 -3.581 5.441
160 HE1 PHE 22 HE2 PHE 22 5.529 -1.595 6.256
161 HE2 PHE 22 HE1 PHE 22 3.023 -5.050 5.755
162 HZ PHE 22 HZ PHE 22 5.244 -4.060 6.240
163 H VAL 23 H VAL 23 3.309 -0.929 2.840
164 HA VAL 23 HA VAL 23 4.856 1.290 3.730
165 HB VAL 23 HB VAL 23 5.178 -0.454 1.227
166 HG11 VAL 23 HG11 VAL 23 7.149 1.645 2.300
167 HG12 VAL 23 HG12 VAL 23 7.510 0.423 1.047
168 HG13 VAL 23 HG13 VAL 23 6.300 1.686 0.726
169 HG21 VAL 23 HG21 VAL 23 6.975 -1.577 2.529
170 HG22 VAL 23 HG22 VAL 23 6.820 -0.387 3.851
171 HG23 VAL 23 HG23 VAL 23 5.525 -1.567 3.555
172 H ASN 24 H ASN 24 2.914 0.811 0.653
173 HA ASN 24 HA ASN 24 3.565 3.382 -0.345
174 HB2 ASN 24 HB2 ASN 24 2.573 1.696 -1.830
175 HB3 ASN 24 HB3 ASN 24 1.068 1.680 -0.881
176 HD21 ASN 24 HD21 ASN 24 3.246 4.055 -2.689
177 HD22 ASN 24 HD22 ASN 24 1.927 5.010 -3.253
178 H TRP 25 H TRP 25 0.895 2.346 1.948
179 HA TRP 25 HA TRP 25 -0.412 4.901 1.762
180 HB2 TRP 25 HB2 TRP 25 -1.667 3.000 2.733
181 HB3 TRP 25 HB3 TRP 25 -0.453 2.844 4.026
182 HD1 TRP 25 HD1 TRP 25 -2.276 6.129 2.846
183 HE1 TRP 25 HE1 TRP 25 -3.326 7.185 4.851
184 HE3 TRP 25 HE3 TRP 25 -1.067 2.568 6.436
185 HZ2 TRP 25 HZ2 TRP 25 -3.707 6.702 7.520
186 HZ3 TRP 25 HZ3 TRP 25 -1.832 3.015 8.774
187 HH2 TRP 25 HH2 TRP 25 -3.133 5.050 9.306
188 H LEU 26 H LEU 26 2.029 3.531 4.139
189 HA LEU 26 HA LEU 26 1.895 5.706 5.914
190 HB2 LEU 26 HB2 LEU 26 4.353 4.000 5.243
191 HB3 LEU 26 HB3 LEU 26 4.245 5.132 6.611
192 HG LEU 26 HG LEU 26 2.524 2.583 6.274
193 HD11 LEU 26 HD11 LEU 26 4.916 2.104 6.756
194 HD12 LEU 26 HD12 LEU 26 3.889 1.703 8.156
195 HD13 LEU 26 HD13 LEU 26 4.861 3.204 8.167
196 HD21 LEU 26 HD21 LEU 26 2.587 4.659 8.543
197 HD22 LEU 26 HD22 LEU 26 1.864 3.033 8.687
198 HD23 LEU 26 HD23 LEU 26 1.177 4.195 7.542
199 H LEU 27 H LEU 27 4.204 5.243 3.090
200 HA LEU 27 HA LEU 27 5.256 7.869 3.412
201 HB2 LEU 27 HB2 LEU 27 6.264 7.700 1.218
202 HB3 LEU 27 HB3 LEU 27 6.407 6.170 2.109
203 HG LEU 27 HG LEU 27 4.265 5.460 0.714
204 HD11 LEU 27 HD11 LEU 27 3.886 7.787 -0.377
205 HD12 LEU 27 HD12 LEU 27 4.061 6.454 -1.535
206 HD13 LEU 27 HD13 LEU 27 5.426 7.562 -1.224
207 HD21 LEU 27 HD21 LEU 27 6.457 4.349 0.470
208 HD22 LEU 27 HD22 LEU 27 7.041 5.671 -0.580
209 HD23 LEU 27 HD23 LEU 27 5.732 4.592 -1.138
210 H ALA 28 H ALA 28 2.264 6.696 1.703
211 HA ALA 28 HA ALA 28 1.805 9.475 0.753
212 HB1 ALA 28 HB1 ALA 28 0.094 6.976 0.295
213 HB2 ALA 28 HB2 ALA 28 -0.028 8.551 -0.536
214 HB3 ALA 28 HB3 ALA 28 1.407 7.519 -0.789
215 H GLN 29 H GLN 29 1.641 8.695 3.804
216 HA GLN 29 HA GLN 29 -1.233 8.792 4.283
217 HB2 GLN 29 HB2 GLN 29 0.364 7.633 5.802
218 HB3 GLN 29 HB3 GLN 29 1.078 9.200 6.266
219 HG2 GLN 29 HG2 GLN 29 -1.167 9.955 7.132
220 HG3 GLN 29 HG3 GLN 29 -1.887 8.398 6.667
221 HE21 GLN 29 HE21 GLN 29 -0.443 6.353 7.647
222 HE22 GLN 29 HE22 GLN 29 -0.106 6.563 9.321
223 H LYS 30 H LYS 30 1.542 11.151 4.203
224 HA LYS 30 HA LYS 30 0.850 13.260 5.453
225 HB2 LYS 30 HB2 LYS 30 1.659 14.780 3.819
226 HB3 LYS 30 HB3 LYS 30 2.595 13.282 3.622
227 HG2 LYS 30 HG2 LYS 30 0.267 14.228 1.822
228 HG3 LYS 30 HG3 LYS 30 1.985 14.428 1.465
229 HD2 LYS 30 HD2 LYS 30 2.382 12.097 1.106
230 HD3 LYS 30 HD3 LYS 30 0.877 11.606 1.894
231 HE2 LYS 30 HE2 LYS 30 0.597 11.323 -0.501
232 HE3 LYS 30 HE3 LYS 30 -0.497 12.598 0.074
233 HZ1 LYS 30 HZ1 LYS 30 0.629 13.166 -2.060
234 HZ2 LYS 30 HZ2 LYS 30 2.181 13.075 -1.280
235 HZ3 LYS 30 HZ3 LYS 30 1.026 14.311 -0.826
236 H GLY 31 H GLY 31 -1.209 12.438 2.530
237 HA2 GLY 31 HA2 GLY 31 -3.381 14.002 3.861
238 HA3 GLY 31 HA3 GLY 31 -2.861 14.430 2.210
239 H LYS 32 H LYS 32 -2.813 10.893 3.006
240 HA LYS 32 HA LYS 32 -4.169 9.226 2.107
241 HB2 LYS 32 HB2 LYS 32 -6.251 11.273 3.086
242 HB3 LYS 32 HB3 LYS 32 -6.687 9.763 2.292
243 HG2 LYS 32 HG2 LYS 32 -6.815 9.507 4.725
244 HG3 LYS 32 HG3 LYS 32 -5.641 8.386 3.996
245 HD2 LYS 32 HD2 LYS 32 -4.811 9.269 6.144
246 HD3 LYS 32 HD3 LYS 32 -3.750 9.769 4.822
247 HE2 LYS 32 HE2 LYS 32 -4.884 12.066 4.852
248 HE3 LYS 32 HE3 LYS 32 -5.915 11.501 6.190
249 HZ1 LYS 32 HZ1 LYS 32 -3.986 12.819 6.974
250 HZ2 LYS 32 HZ2 LYS 32 -2.883 11.705 6.226
251 HZ3 LYS 32 HZ3 LYS 32 -3.879 11.182 7.566
252 H LYS 33 H LYS 33 -3.035 9.705 -0.022
253 HA LYS 33 HA LYS 33 -5.071 10.733 -1.963
254 HB2 LYS 33 HB2 LYS 33 -2.118 11.574 -1.965
255 HB3 LYS 33 HB3 LYS 33 -3.365 11.929 -3.190
256 HG2 LYS 33 HG2 LYS 33 -4.697 13.137 -1.335
257 HG3 LYS 33 HG3 LYS 33 -3.350 12.770 -0.225
258 HD2 LYS 33 HD2 LYS 33 -3.151 15.075 -0.944
259 HD3 LYS 33 HD3 LYS 33 -1.793 14.155 -1.634
260 HE2 LYS 33 HE2 LYS 33 -2.945 14.102 -3.864
261 HE3 LYS 33 HE3 LYS 33 -4.382 14.889 -3.154
262 HZ1 LYS 33 HZ1 LYS 33 -2.973 16.474 -4.381
263 HZ2 LYS 33 HZ2 LYS 33 -1.601 16.095 -3.377
264 HZ3 LYS 33 HZ3 LYS 33 -2.997 16.894 -2.696
265 H ASN 34 H ASN 34 -1.667 9.293 -2.221
266 HA ASN 34 HA ASN 34 -2.538 7.959 -4.588
267 HB2 ASN 34 HB2 ASN 34 -0.101 8.431 -4.120
268 HB3 ASN 34 HB3 ASN 34 -0.146 7.236 -2.798
269 HD21 ASN 34 HD21 ASN 34 -0.986 7.471 -6.393
270 HD22 ASN 34 HD22 ASN 34 -0.439 5.874 -6.738
271 H ASP 35 H ASP 35 -2.880 7.052 -1.123
272 HA ASP 35 HA ASP 35 -3.940 4.394 -2.099
273 HB2 ASP 35 HB2 ASP 35 -1.884 4.287 -0.601
274 HB3 ASP 35 HB3 ASP 35 -2.811 5.139 0.653
275 H TRP 36 H TRP 36 -5.547 6.636 -2.505
276 HA TRP 36 HA TRP 36 -7.715 5.997 -0.681
277 HB2 TRP 36 HB2 TRP 36 -6.172 7.676 0.604
278 HB3 TRP 36 HB3 TRP 36 -6.766 8.911 -0.516
279 HD1 TRP 36 HD1 TRP 36 -7.646 7.119 2.630
280 HE1 TRP 36 HE1 TRP 36 -9.930 7.774 3.446
281 HE3 TRP 36 HE3 TRP 36 -9.451 9.519 -1.615
282 HZ2 TRP 36 HZ2 TRP 36 -12.165 9.078 2.574
283 HZ3 TRP 36 HZ3 TRP 36 -11.730 10.509 -1.482
284 HH2 TRP 36 HH2 TRP 36 -13.077 10.290 0.582
285 H LYS 37 H LYS 37 -6.653 8.795 -2.891
286 HA LYS 37 HA LYS 37 -9.356 8.791 -4.061
287 HB2 LYS 37 HB2 LYS 37 -6.773 10.249 -4.913
288 HB3 LYS 37 HB3 LYS 37 -8.247 10.161 -5.907
289 HG2 LYS 37 HG2 LYS 37 -8.458 12.234 -4.814
290 HG3 LYS 37 HG3 LYS 37 -9.576 11.159 -3.944
291 HD2 LYS 37 HD2 LYS 37 -7.614 10.873 -2.196
292 HD3 LYS 37 HD3 LYS 37 -6.812 12.200 -3.063
293 HE2 LYS 37 HE2 LYS 37 -9.558 12.297 -1.645
294 HE3 LYS 37 HE3 LYS 37 -8.034 13.003 -1.055
295 HZ1 LYS 37 HZ1 LYS 37 -9.648 13.895 -3.472
296 HZ2 LYS 37 HZ2 LYS 37 -8.032 14.473 -3.113
297 HZ3 LYS 37 HZ3 LYS 37 -9.349 14.766 -2.015
298 H HIS 38 H HIS 38 -6.013 7.615 -4.948
299 HA HIS 38 HA HIS 38 -6.412 6.320 -7.292
300 HB2 HIS 38 HB2 HIS 38 -4.349 6.041 -5.940
301 HB3 HIS 38 HB3 HIS 38 -5.269 5.153 -4.691
302 HD1 HIS 38 HD1 HIS 38 -4.469 2.832 -4.818
303 HD2 HIS 38 HD2 HIS 38 -5.047 4.538 -8.616
304 HE1 HIS 38 HE1 HIS 38 -3.990 0.985 -6.471
305 H ASN 39 H ASN 39 -7.726 5.189 -4.073
306 HA ASN 39 HA ASN 39 -8.657 2.746 -4.566
307 HB2 ASN 39 HB2 ASN 39 -9.168 4.090 -2.493
308 HB3 ASN 39 HB3 ASN 39 -10.454 4.941 -3.387
309 HD21 ASN 39 HD21 ASN 39 -12.432 3.649 -4.048
310 HD22 ASN 39 HD22 ASN 39 -12.750 2.165 -3.229
311 H ILE 40 H ILE 40 -10.254 5.717 -5.991
312 HA ILE 40 HA ILE 40 -12.573 4.235 -6.822
313 HB ILE 40 HB ILE 40 -11.517 6.923 -7.825
314 HG12 ILE 40 HG12 ILE 40 -13.815 6.172 -5.897
315 HG13 ILE 40 HG13 ILE 40 -12.240 6.844 -5.417
316 HG21 ILE 40 HG21 ILE 40 -12.918 5.752 -9.600
317 HG22 ILE 40 HG22 ILE 40 -14.234 5.590 -8.405
318 HG23 ILE 40 HG23 ILE 40 -13.707 7.201 -8.974
319 HD11 ILE 40 HD11 ILE 40 -13.828 8.657 -5.374
320 HD12 ILE 40 HD12 ILE 40 -12.765 8.939 -6.782
321 HD13 ILE 40 HD13 ILE 40 -14.426 8.305 -7.011
322 H THR 41 H THR 41 -9.841 5.550 -8.935
323 HA THR 41 HA THR 41 -10.661 3.925 -11.104
324 HB THR 41 HB THR 41 -9.130 5.840 -11.403
325 HG1 THR 41 HG1 THR 41 -7.887 4.615 -13.032
326 HG21 THR 41 HG21 THR 41 -6.676 5.589 -11.038
327 HG22 THR 41 HG22 THR 41 -6.918 3.980 -10.307
328 HG23 THR 41 HG23 THR 41 -7.512 5.450 -9.475
329 H GLN 42 H GLN 42 -8.506 3.186 -8.295
330 HA GLN 42 HA GLN 42 -7.357 0.829 -9.234
331 HB2 GLN 42 HB2 GLN 42 -6.946 1.913 -6.935
332 HB3 GLN 42 HB3 GLN 42 -8.484 1.199 -6.398
333 HG2 GLN 42 HG2 GLN 42 -7.610 -1.100 -6.901
334 HG3 GLN 42 HG3 GLN 42 -6.055 -0.393 -7.425
335 HE21 GLN 42 HE21 GLN 42 -5.967 -2.300 -5.402
336 HE22 GLN 42 HE22 GLN 42 -5.634 -1.529 -3.894