Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
537723 | 2lgb RC | 17803 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 GLY 1 H1 GLY 1 13.820 25.225 8.071
2 H2 GLY 1 H2 GLY 1 14.715 25.683 9.390
3 H3 GLY 1 H3 GLY 1 13.093 25.906 9.362
4 HA2 GLY 1 HA2 GLY 1 13.493 24.026 10.737
5 HA3 GLY 1 HA3 GLY 1 12.733 23.508 9.220
6 H ILE 2 H ILE 2 13.975 22.412 7.646
7 HA ILE 2 HA ILE 2 16.239 20.876 8.832
8 HB ILE 2 HB ILE 2 13.785 20.261 7.251
9 HG12 ILE 2 HG12 ILE 2 15.413 18.675 9.268
10 HG13 ILE 2 HG13 ILE 2 14.148 19.823 9.685
11 HG21 ILE 2 HG21 ILE 2 14.694 18.138 6.339
12 HG22 ILE 2 HG22 ILE 2 15.334 19.567 5.556
13 HG23 ILE 2 HG23 ILE 2 16.335 18.705 6.742
14 HD11 ILE 2 HD11 ILE 2 13.251 17.579 9.795
15 HD12 ILE 2 HD12 ILE 2 12.479 18.463 8.464
16 HD13 ILE 2 HD13 ILE 2 13.730 17.236 8.128
17 H VAL 3 H VAL 3 15.244 22.672 5.906
18 HA VAL 3 HA VAL 3 17.464 21.796 4.297
19 HB VAL 3 HB VAL 3 15.849 24.362 4.102
20 HG11 VAL 3 HG11 VAL 3 17.931 24.643 2.832
21 HG12 VAL 3 HG12 VAL 3 17.731 23.041 2.093
22 HG13 VAL 3 HG13 VAL 3 16.603 24.370 1.710
23 HG21 VAL 3 HG21 VAL 3 14.525 22.240 3.843
24 HG22 VAL 3 HG22 VAL 3 14.616 23.193 2.352
25 HG23 VAL 3 HG23 VAL 3 15.624 21.748 2.545
26 H GLU 4 H GLU 4 17.167 24.636 6.454
27 HA GLU 4 HA GLU 4 19.699 25.783 5.912
28 HB2 GLU 4 HB2 GLU 4 19.443 27.022 7.947
29 HB3 GLU 4 HB3 GLU 4 17.870 26.879 7.162
30 HG2 GLU 4 HG2 GLU 4 17.363 24.945 8.739
31 HG3 GLU 4 HG3 GLU 4 18.857 25.332 9.601
32 H GLN 5 H GLN 5 18.929 23.043 8.022
33 HA GLN 5 HA GLN 5 21.417 22.994 9.453
34 HB2 GLN 5 HB2 GLN 5 19.289 20.873 8.988
35 HB3 GLN 5 HB3 GLN 5 20.690 20.671 10.035
36 HG2 GLN 5 HG2 GLN 5 19.937 22.636 11.392
37 HG3 GLN 5 HG3 GLN 5 18.509 22.765 10.365
38 HE21 GLN 5 HE21 GLN 5 16.690 21.748 11.190
39 HE22 GLN 5 HE22 GLN 5 16.759 20.379 12.306
40 H CYS 6 H CYS 6 20.741 22.061 6.216
41 HA CYS 6 HA CYS 6 23.495 20.902 6.063
42 HB2 CYS 6 HB2 CYS 6 21.439 19.406 5.429
43 HB3 CYS 6 HB3 CYS 6 21.475 20.338 3.928
44 H CYS 7 H CYS 7 21.381 23.441 4.940
45 HA CYS 7 HA CYS 7 23.035 24.058 2.623
46 HB2 CYS 7 HB2 CYS 7 20.602 24.224 2.609
47 HB3 CYS 7 HB3 CYS 7 20.660 25.496 3.817
48 H THR 8 H THR 8 22.404 25.830 5.749
49 HA THR 8 HA THR 8 24.545 27.748 5.034
50 HB THR 8 HB THR 8 23.888 28.961 7.062
51 HG1 THR 8 HG1 THR 8 22.069 28.317 8.179
52 HG21 THR 8 HG21 THR 8 21.735 29.759 6.271
53 HG22 THR 8 HG22 THR 8 21.491 28.285 5.298
54 HG23 THR 8 HG23 THR 8 22.779 29.429 4.881
55 H SER 9 H SER 9 24.189 24.905 6.927
56 HA SER 9 HA SER 9 27.069 25.009 7.655
57 HB2 SER 9 HB2 SER 9 24.812 24.054 9.469
58 HB3 SER 9 HB3 SER 9 26.538 23.768 9.757
59 HG SER 9 HG SER 9 25.749 25.602 10.897
60 H ILE 10 H ILE 10 28.072 22.908 7.625
61 HA ILE 10 HA ILE 10 27.053 21.133 5.645
62 HB ILE 10 HB ILE 10 28.925 19.647 6.274
63 HG12 ILE 10 HG12 ILE 10 29.374 21.608 8.566
64 HG13 ILE 10 HG13 ILE 10 29.049 19.881 8.662
65 HG21 ILE 10 HG21 ILE 10 30.664 21.073 5.479
66 HG22 ILE 10 HG22 ILE 10 29.159 21.579 4.716
67 HG23 ILE 10 HG23 ILE 10 29.826 22.534 6.057
68 HD11 ILE 10 HD11 ILE 10 31.273 19.507 7.452
69 HD12 ILE 10 HD12 ILE 10 31.589 21.239 7.700
70 HD13 ILE 10 HD13 ILE 10 31.360 20.178 9.098
71 H CYS 11 H CYS 11 26.299 18.976 5.703
72 HA CYS 11 HA CYS 11 25.531 17.904 8.367
73 HB2 CYS 11 HB2 CYS 11 23.416 17.284 7.744
74 HB3 CYS 11 HB3 CYS 11 23.562 18.929 7.168
75 H SER 12 H SER 12 25.040 15.648 8.457
76 HA SER 12 HA SER 12 26.966 14.018 6.909
77 HB2 SER 12 HB2 SER 12 26.992 12.586 8.842
78 HB3 SER 12 HB3 SER 12 27.112 14.253 9.416
79 HG SER 12 HG SER 12 25.567 13.293 10.656
80 H LEU 13 H LEU 13 26.385 11.637 6.696
81 HA LEU 13 HA LEU 13 23.927 11.105 5.315
82 HB2 LEU 13 HB2 LEU 13 25.707 9.153 6.841
83 HB3 LEU 13 HB3 LEU 13 24.506 8.739 5.616
84 HG LEU 13 HG LEU 13 27.093 10.276 5.149
85 HD11 LEU 13 HD11 LEU 13 27.745 8.296 3.863
86 HD12 LEU 13 HD12 LEU 13 26.212 7.499 4.273
87 HD13 LEU 13 HD13 LEU 13 27.394 7.872 5.545
88 HD21 LEU 13 HD21 LEU 13 25.396 11.101 3.590
89 HD22 LEU 13 HD22 LEU 13 24.944 9.428 3.166
90 HD23 LEU 13 HD23 LEU 13 26.545 10.067 2.736
91 H TYR 14 H TYR 14 24.772 10.799 8.789
92 HA TYR 14 HA TYR 14 22.354 9.492 9.587
93 HB2 TYR 14 HB2 TYR 14 24.098 11.318 11.264
94 HB3 TYR 14 HB3 TYR 14 23.047 10.027 11.834
95 HD1 TYR 14 HD2 TYR 14 23.584 7.606 10.866
96 HD2 TYR 14 HD1 TYR 14 26.400 10.868 10.992
97 HE1 TYR 14 HE2 TYR 14 25.468 5.983 10.720
98 HE2 TYR 14 HE1 TYR 14 28.284 9.247 10.857
99 HH TYR 14 HH TYR 14 27.738 5.707 10.632
100 H GLN 15 H GLN 15 23.051 12.847 8.873
101 HA GLN 15 HA GLN 15 20.554 13.873 10.107
102 HB2 GLN 15 HB2 GLN 15 22.752 15.135 8.441
103 HB3 GLN 15 HB3 GLN 15 21.261 15.974 8.866
104 HG2 GLN 15 HG2 GLN 15 21.727 15.767 11.251
105 HG3 GLN 15 HG3 GLN 15 23.149 14.771 10.936
106 HE21 GLN 15 HE21 GLN 15 21.813 18.082 10.252
107 HE22 GLN 15 HE22 GLN 15 23.400 18.830 10.220
108 H LEU 16 H LEU 16 21.835 13.153 6.839
109 HA LEU 16 HA LEU 16 19.446 13.811 5.407
110 HB2 LEU 16 HB2 LEU 16 21.743 11.916 4.824
111 HB3 LEU 16 HB3 LEU 16 20.486 12.288 3.652
112 HG LEU 16 HG LEU 16 22.263 14.439 4.897
113 HD11 LEU 16 HD11 LEU 16 23.512 14.379 2.755
114 HD12 LEU 16 HD12 LEU 16 22.566 12.956 2.257
115 HD13 LEU 16 HD13 LEU 16 23.664 12.864 3.654
116 HD21 LEU 16 HD21 LEU 16 20.509 14.449 2.413
117 HD22 LEU 16 HD22 LEU 16 21.563 15.767 2.955
118 HD23 LEU 16 HD23 LEU 16 20.172 15.304 3.931
119 H GLU 17 H GLU 17 20.334 10.780 7.124
120 HA GLU 17 HA GLU 17 17.943 9.332 6.402
121 HB2 GLU 17 HB2 GLU 17 19.764 9.221 8.842
122 HB3 GLU 17 HB3 GLU 17 18.349 8.188 8.649
123 HG2 GLU 17 HG2 GLU 17 19.309 7.316 6.510
124 HG3 GLU 17 HG3 GLU 17 20.789 8.218 6.848
125 H ASN 18 H ASN 18 18.649 11.543 9.161
126 HA ASN 18 HA ASN 18 16.117 11.234 10.426
127 HB2 ASN 18 HB2 ASN 18 18.161 12.097 11.523
128 HB3 ASN 18 HB3 ASN 18 18.101 13.547 10.524
129 HD21 ASN 18 HD21 ASN 18 17.126 15.297 11.496
130 HD22 ASN 18 HD22 ASN 18 15.950 15.160 12.790
131 H TYR 19 H TYR 19 17.155 13.600 7.919
132 HA TYR 19 HA TYR 19 14.742 15.124 7.924
133 HB2 TYR 19 HB2 TYR 19 16.605 14.581 5.596
134 HB3 TYR 19 HB3 TYR 19 15.490 15.936 5.755
135 HD1 TYR 19 HD2 TYR 19 16.297 16.425 8.842
136 HD2 TYR 19 HD1 TYR 19 18.423 16.062 5.107
137 HE1 TYR 19 HE2 TYR 19 18.110 17.868 9.731
138 HE2 TYR 19 HE1 TYR 19 20.290 17.408 6.041
139 HH TYR 19 HH TYR 19 21.070 18.583 7.830
140 H CYS 20 H CYS 20 15.233 11.914 6.701
141 HA CYS 20 HA CYS 20 12.872 11.945 4.942
142 HB2 CYS 20 HB2 CYS 20 14.979 10.547 4.645
143 HB3 CYS 20 HB3 CYS 20 14.463 9.606 6.043
144 H ASN 21 H ASN 21 13.621 11.241 8.313
145 HA ASN 21 HA ASN 21 11.057 9.883 8.845
146 HB2 ASN 21 HB2 ASN 21 13.168 9.051 9.796
147 HB3 ASN 21 HB3 ASN 21 13.442 10.595 10.600
148 HD21 ASN 21 HD21 ASN 21 12.572 10.861 12.664
149 HD22 ASN 21 HD22 ASN 21 11.427 9.734 13.368
150 H GLY 22 H GLY 22 12.545 13.044 9.457
151 HA2 GLY 22 HA2 GLY 22 10.739 14.094 11.389
152 HA3 GLY 22 HA3 GLY 22 11.745 15.034 10.284
153 H1 PHE 101 H1 PHE 101 34.499 9.439 3.154
154 H2 PHE 101 H2 PHE 101 33.311 8.334 2.935
155 H3 PHE 101 H3 PHE 101 33.818 8.703 4.451
156 HA PHE 101 HA PHE 101 32.473 10.569 2.616
157 HB2 PHE 101 HB2 PHE 101 30.899 8.875 3.375
158 HB3 PHE 101 HB3 PHE 101 31.390 9.096 5.053
159 HD1 PHE 101 HD2 PHE 101 29.720 10.803 2.159
160 HD2 PHE 101 HD1 PHE 101 30.440 10.835 6.415
161 HE1 PHE 101 HE2 PHE 101 28.078 12.644 2.427
162 HE2 PHE 101 HE1 PHE 101 28.815 12.682 6.670
163 HZ PHE 101 HZ PHE 101 27.626 13.602 4.672
164 H VAL 102 H VAL 102 32.055 12.653 3.408
165 HA VAL 102 HA VAL 102 32.908 13.438 6.079
166 HB VAL 102 HB VAL 102 34.972 13.752 4.740
167 HG11 VAL 102 HG11 VAL 102 35.181 15.484 3.075
168 HG12 VAL 102 HG12 VAL 102 33.989 14.294 2.532
169 HG13 VAL 102 HG13 VAL 102 33.449 15.863 3.166
170 HG21 VAL 102 HG21 VAL 102 34.477 15.200 6.697
171 HG22 VAL 102 HG22 VAL 102 35.491 15.975 5.474
172 HG23 VAL 102 HG23 VAL 102 33.780 16.415 5.593
173 H ASN 103 H ASN 103 31.814 15.337 6.789
174 HA ASN 103 HA ASN 103 29.197 15.615 5.719
175 HB2 ASN 103 HB2 ASN 103 30.730 17.331 7.720
176 HB3 ASN 103 HB3 ASN 103 29.014 17.516 7.362
177 HD21 ASN 103 HD21 ASN 103 29.329 17.204 9.886
178 HD22 ASN 103 HD22 ASN 103 29.069 15.551 10.406
179 H GLN 104 H GLN 104 28.161 17.262 4.593
180 HA GLN 104 HA GLN 104 29.879 19.202 3.100
181 HB2 GLN 104 HB2 GLN 104 28.932 18.408 0.983
182 HB3 GLN 104 HB3 GLN 104 29.885 17.180 1.804
183 HG2 GLN 104 HG2 GLN 104 27.816 16.059 2.591
184 HG3 GLN 104 HG3 GLN 104 26.831 17.301 1.820
185 HE21 GLN 104 HE21 GLN 104 26.245 14.756 1.116
186 HE22 GLN 104 HE22 GLN 104 26.866 14.419 -0.494
187 H HIS 105 H HIS 105 28.738 20.803 1.837
188 HA HIS 105 HA HIS 105 26.217 21.722 3.074
189 HB2 HIS 105 HB2 HIS 105 28.098 22.917 1.012
190 HB3 HIS 105 HB3 HIS 105 26.507 23.590 1.342
191 HD1 HIS 105 HD1 HIS 105 26.173 24.954 3.605
192 HD2 HIS 105 HD2 HIS 105 30.002 23.357 2.885
193 HE1 HIS 105 HE1 HIS 105 27.750 26.080 5.264
194 H LEU 106 H LEU 106 24.250 21.495 2.211
195 HA LEU 106 HA LEU 106 23.830 20.979 -0.683
196 HB2 LEU 106 HB2 LEU 106 22.641 19.262 1.527
197 HB3 LEU 106 HB3 LEU 106 22.177 19.190 -0.158
198 HG LEU 106 HG LEU 106 24.996 18.527 0.815
199 HD11 LEU 106 HD11 LEU 106 22.568 16.783 0.388
200 HD12 LEU 106 HD12 LEU 106 23.488 17.001 1.888
201 HD13 LEU 106 HD13 LEU 106 24.221 16.153 0.524
202 HD21 LEU 106 HD21 LEU 106 24.763 19.067 -1.625
203 HD22 LEU 106 HD22 LEU 106 23.498 17.826 -1.753
204 HD23 LEU 106 HD23 LEU 106 25.166 17.367 -1.343
205 H CYS 107 H CYS 107 22.088 22.093 -1.430
206 HA CYS 107 HA CYS 107 20.145 23.272 0.515
207 HB2 CYS 107 HB2 CYS 107 21.414 24.575 -1.909
208 HB3 CYS 107 HB3 CYS 107 20.170 25.302 -0.909
209 H GLY 108 H GLY 108 18.033 23.554 -0.190
210 HA2 GLY 108 HA2 GLY 108 16.089 23.126 -1.348
211 HA3 GLY 108 HA3 GLY 108 17.034 23.641 -2.738
212 H SER 109 H SER 109 16.622 22.299 -4.383
213 HA SER 109 HA SER 109 15.618 19.691 -4.276
214 HB2 SER 109 HB2 SER 109 17.305 20.921 -6.490
215 HB3 SER 109 HB3 SER 109 16.172 19.563 -6.645
216 HG SER 109 HG SER 109 15.230 21.567 -7.291
217 H HIS 110 H HIS 110 19.051 20.681 -4.091
218 HA HIS 110 HA HIS 110 20.056 18.010 -4.639
219 HB2 HIS 110 HB2 HIS 110 21.235 20.306 -4.951
220 HB3 HIS 110 HB3 HIS 110 21.539 20.245 -3.211
221 HD1 HIS 110 HD1 HIS 110 24.156 20.309 -4.395
222 HD2 HIS 110 HD2 HIS 110 21.881 16.778 -4.588
223 HE1 HIS 110 HE1 HIS 110 25.795 18.426 -4.896
224 H LEU 111 H LEU 111 19.196 19.855 -1.728
225 HA LEU 111 HA LEU 111 20.127 17.894 0.195
226 HB2 LEU 111 HB2 LEU 111 19.833 20.266 0.676
227 HB3 LEU 111 HB3 LEU 111 18.114 20.182 0.379
228 HG LEU 111 HG LEU 111 18.926 20.325 2.768
229 HD11 LEU 111 HD11 LEU 111 16.602 19.666 2.159
230 HD12 LEU 111 HD12 LEU 111 17.173 18.966 3.680
231 HD13 LEU 111 HD13 LEU 111 17.104 17.970 2.225
232 HD21 LEU 111 HD21 LEU 111 19.451 17.349 2.496
233 HD22 LEU 111 HD22 LEU 111 19.579 18.350 3.949
234 HD23 LEU 111 HD23 LEU 111 20.709 18.590 2.600
235 H VAL 112 H VAL 112 16.966 18.507 -1.412
236 HA VAL 112 HA VAL 112 15.593 16.257 -0.260
237 HB VAL 112 HB VAL 112 15.194 17.597 -2.953
238 HG11 VAL 112 HG11 VAL 112 14.204 15.344 -3.040
239 HG12 VAL 112 HG12 VAL 112 13.362 15.632 -1.502
240 HG13 VAL 112 HG13 VAL 112 12.953 16.574 -2.959
241 HG21 VAL 112 HG21 VAL 112 13.313 18.714 -1.852
242 HG22 VAL 112 HG22 VAL 112 13.665 17.869 -0.327
243 HG23 VAL 112 HG23 VAL 112 14.800 19.066 -0.981
244 H GLU 113 H GLU 113 17.425 16.438 -3.398
245 HA GLU 113 HA GLU 113 17.061 13.720 -4.070
246 HB2 GLU 113 HB2 GLU 113 17.892 15.473 -5.589
247 HB3 GLU 113 HB3 GLU 113 19.421 15.541 -4.699
248 HG2 GLU 113 HG2 GLU 113 19.949 13.241 -5.346
249 HG3 GLU 113 HG3 GLU 113 18.350 13.042 -6.072
250 H ALA 114 H ALA 114 19.696 15.180 -2.100
251 HA ALA 114 HA ALA 114 21.103 12.738 -1.654
252 HB1 ALA 114 HB1 ALA 114 22.062 14.986 -1.335
253 HB2 ALA 114 HB2 ALA 114 20.951 15.264 0.028
254 HB3 ALA 114 HB3 ALA 114 22.205 14.014 0.139
255 H LEU 115 H LEU 115 18.512 14.332 0.372
256 HA LEU 115 HA LEU 115 18.644 12.273 2.365
257 HB2 LEU 115 HB2 LEU 115 17.029 13.348 3.484
258 HB3 LEU 115 HB3 LEU 115 17.665 14.646 2.513
259 HG LEU 115 HG LEU 115 15.619 14.004 0.898
260 HD11 LEU 115 HD11 LEU 115 14.860 11.994 2.206
261 HD12 LEU 115 HD12 LEU 115 13.641 13.255 2.152
262 HD13 LEU 115 HD13 LEU 115 14.625 13.045 3.612
263 HD21 LEU 115 HD21 LEU 115 15.266 15.423 3.553
264 HD22 LEU 115 HD22 LEU 115 14.259 15.633 2.115
265 HD23 LEU 115 HD23 LEU 115 15.952 16.123 2.074
266 H TYR 116 H TYR 116 16.733 12.545 -0.621
267 HA TYR 116 HA TYR 116 15.121 10.235 -0.188
268 HB2 TYR 116 HB2 TYR 116 15.105 12.217 -1.992
269 HB3 TYR 116 HB3 TYR 116 15.949 11.043 -2.970
270 HD1 TYR 116 HD2 TYR 116 14.726 8.592 -2.971
271 HD2 TYR 116 HD1 TYR 116 12.833 12.384 -2.104
272 HE1 TYR 116 HE2 TYR 116 12.509 7.617 -3.540
273 HE2 TYR 116 HE1 TYR 116 10.607 11.388 -2.677
274 HH TYR 116 HH TYR 116 9.470 9.463 -3.204
275 H LEU 117 H LEU 117 18.294 10.593 -1.862
276 HA LEU 117 HA LEU 117 18.569 7.801 -2.500
277 HB2 LEU 117 HB2 LEU 117 20.558 10.091 -2.252
278 HB3 LEU 117 HB3 LEU 117 21.035 8.477 -2.762
279 HG LEU 117 HG LEU 117 18.935 10.135 -4.241
280 HD11 LEU 117 HD11 LEU 117 20.719 10.588 -5.870
281 HD12 LEU 117 HD12 LEU 117 21.894 9.725 -4.856
282 HD13 LEU 117 HD13 LEU 117 21.151 11.234 -4.285
283 HD21 LEU 117 HD21 LEU 117 18.734 7.727 -4.685
284 HD22 LEU 117 HD22 LEU 117 20.475 7.618 -5.026
285 HD23 LEU 117 HD23 LEU 117 19.410 8.554 -6.094
286 H VAL 118 H VAL 118 19.754 9.694 0.323
287 HA VAL 118 HA VAL 118 21.092 7.441 1.555
288 HB VAL 118 HB VAL 118 20.125 10.099 2.666
289 HG11 VAL 118 HG11 VAL 118 21.577 9.590 4.635
290 HG12 VAL 118 HG12 VAL 118 20.128 8.599 4.556
291 HG13 VAL 118 HG13 VAL 118 21.703 7.910 4.082
292 HG21 VAL 118 HG21 VAL 118 22.578 10.551 2.728
293 HG22 VAL 118 HG22 VAL 118 22.891 8.940 2.046
294 HG23 VAL 118 HG23 VAL 118 22.054 10.165 1.082
295 H CYS 119 H CYS 119 17.744 8.597 1.678
296 HA CYS 119 HA CYS 119 16.925 6.528 3.564
297 HB2 CYS 119 HB2 CYS 119 16.017 8.886 3.291
298 HB3 CYS 119 HB3 CYS 119 15.159 8.305 1.869
299 H GLY 120 H GLY 120 17.913 6.121 0.468
300 HA2 GLY 120 HA2 GLY 120 17.756 4.366 -0.995
301 HA3 GLY 120 HA3 GLY 120 17.091 3.454 0.351
302 H GLU 121 H GLU 121 15.316 2.415 -0.278
303 HA GLU 121 HA GLU 121 13.688 3.254 -2.531
304 HB2 GLU 121 HB2 GLU 121 12.515 1.175 -2.202
305 HB3 GLU 121 HB3 GLU 121 14.250 0.910 -2.110
306 HG2 GLU 121 HG2 GLU 121 14.119 0.842 0.375
307 HG3 GLU 121 HG3 GLU 121 12.380 1.123 0.296
308 H ARG 122 H ARG 122 13.539 4.253 0.683
309 HA ARG 122 HA ARG 122 10.596 4.502 0.818
310 HB2 ARG 122 HB2 ARG 122 11.547 3.806 2.830
311 HB3 ARG 122 HB3 ARG 122 12.846 4.985 2.764
312 HG2 ARG 122 HG2 ARG 122 11.216 5.510 4.507
313 HG3 ARG 122 HG3 ARG 122 11.385 6.797 3.333
314 HD2 ARG 122 HD2 ARG 122 9.268 5.941 2.203
315 HD3 ARG 122 HD3 ARG 122 9.060 4.848 3.567
316 HE ARG 122 HE ARG 122 8.937 7.824 3.537
317 HH11 ARG 122 HH11 ARG 122 8.655 4.963 5.562
318 HH12 ARG 122 HH12 ARG 122 7.917 5.848 6.866
319 HH21 ARG 122 HH21 ARG 122 7.990 8.881 5.238
320 HH22 ARG 122 HH22 ARG 122 7.556 8.012 6.681
321 H GLY 123 H GLY 123 13.070 7.009 1.467
322 HA2 GLY 123 HA2 GLY 123 13.012 9.303 1.070
323 HA3 GLY 123 HA3 GLY 123 12.301 8.904 -0.487
324 H PHE 124 H PHE 124 10.970 10.738 -0.451
325 HA PHE 124 HA PHE 124 8.763 10.885 1.530
326 HB2 PHE 124 HB2 PHE 124 9.419 12.635 -0.862
327 HB3 PHE 124 HB3 PHE 124 8.086 12.890 0.247
328 HD1 PHE 124 HD1 PHE 124 9.045 12.743 2.915
329 HD2 PHE 124 HD2 PHE 124 11.128 14.225 -0.567
330 HE1 PHE 124 HE1 PHE 124 10.382 14.261 4.349
331 HE2 PHE 124 HE2 PHE 124 12.381 15.800 0.859
332 HZ PHE 124 HZ PHE 124 12.037 15.806 3.325
333 H PHE 125 H PHE 125 6.726 10.149 1.141
334 HA PHE 125 HA PHE 125 6.079 8.715 -1.315
335 HB2 PHE 125 HB2 PHE 125 4.309 9.558 1.007
336 HB3 PHE 125 HB3 PHE 125 3.879 8.412 -0.248
337 HD1 PHE 125 HD1 PHE 125 5.986 6.515 -0.535
338 HD2 PHE 125 HD2 PHE 125 4.597 8.463 3.058
339 HE1 PHE 125 HE1 PHE 125 6.768 4.584 0.816
340 HE2 PHE 125 HE2 PHE 125 5.373 6.524 4.400
341 HZ PHE 125 HZ PHE 125 6.446 4.583 3.280
342 H TYR 126 H TYR 126 5.784 11.975 -0.314
343 HA TYR 126 HA TYR 126 3.775 12.670 -2.416
344 HB2 TYR 126 HB2 TYR 126 4.560 14.225 0.073
345 HB3 TYR 126 HB3 TYR 126 3.260 14.610 -1.049
346 HD1 TYR 126 HD2 TYR 126 1.310 12.926 -1.289
347 HD2 TYR 126 HD1 TYR 126 4.165 12.806 1.947
348 HE1 TYR 126 HE2 TYR 126 -0.260 11.535 0.053
349 HE2 TYR 126 HE1 TYR 126 2.597 11.422 3.284
350 HH TYR 126 HH TYR 126 0.551 10.371 3.350
351 H THR 127 H THR 127 4.075 15.001 -3.263
352 HA THR 127 HA THR 127 6.651 15.296 -4.487
353 HB THR 127 HB THR 127 5.783 17.622 -5.089
354 HG1 THR 127 HG1 THR 127 3.595 17.950 -4.757
355 HG21 THR 127 HG21 THR 127 4.172 16.745 -6.730
356 HG22 THR 127 HG22 THR 127 4.048 15.221 -5.821
357 HG23 THR 127 HG23 THR 127 5.577 15.675 -6.604
358 HA PRO 128 HA PRO 128 8.737 17.150 -1.114
359 HB2 PRO 128 HB2 PRO 128 11.025 18.067 -2.246
360 HB3 PRO 128 HB3 PRO 128 10.620 16.326 -2.153
361 HG2 PRO 128 HG2 PRO 128 10.181 18.214 -4.495
362 HG3 PRO 128 HG3 PRO 128 10.963 16.599 -4.514
363 HD2 PRO 128 HD2 PRO 128 8.338 16.933 -5.165
364 HD3 PRO 128 HD3 PRO 128 8.907 15.490 -4.271
365 H LYS 129 H LYS 129 9.292 19.041 -0.062
366 HA LYS 129 HA LYS 129 9.099 21.675 -1.361
367 HB2 LYS 129 HB2 LYS 129 6.788 21.325 -0.784
368 HB3 LYS 129 HB3 LYS 129 7.204 20.706 0.807
369 HG2 LYS 129 HG2 LYS 129 6.249 22.934 0.969
370 HG3 LYS 129 HG3 LYS 129 7.895 22.887 1.572
371 HD2 LYS 129 HD2 LYS 129 8.620 23.847 -0.712
372 HD3 LYS 129 HD3 LYS 129 6.908 24.096 -1.054
373 HE2 LYS 129 HE2 LYS 129 6.674 25.715 0.640
374 HE3 LYS 129 HE3 LYS 129 8.036 25.080 1.573
375 HZ1 LYS 129 HZ1 LYS 129 9.564 25.964 -0.047
376 HZ2 LYS 129 HZ2 LYS 129 8.607 27.173 0.485
377 HZ3 LYS 129 HZ3 LYS 129 8.349 26.532 -0.994
378 H THR 130 H THR 130 10.434 23.143 -0.461
379 HA THR 130 HA THR 130 12.418 22.429 1.478
380 HB THR 130 HB THR 130 12.917 24.936 1.376
381 HG1 THR 130 HG1 THR 130 11.902 25.993 -0.383
382 HG21 THR 130 HG21 THR 130 12.763 23.477 -1.304
383 HG22 THR 130 HG22 THR 130 14.040 23.244 -0.088
384 HG23 THR 130 HG23 THR 130 13.849 24.818 -0.874
385 H ARG 131 H ARG 131 12.612 22.832 3.618
386 HA ARG 131 HA ARG 131 10.575 24.336 5.128
387 HB2 ARG 131 HB2 ARG 131 10.058 22.400 6.564
388 HB3 ARG 131 HB3 ARG 131 9.491 22.204 4.909
389 HG2 ARG 131 HG2 ARG 131 11.391 20.685 4.412
390 HG3 ARG 131 HG3 ARG 131 11.993 20.901 6.066
391 HD2 ARG 131 HD2 ARG 131 9.880 19.981 6.954
392 HD3 ARG 131 HD3 ARG 131 9.304 19.713 5.295
393 HE ARG 131 HE ARG 131 11.687 18.349 5.330
394 HH11 ARG 131 HH11 ARG 131 8.833 18.121 7.403
395 HH12 ARG 131 HH12 ARG 131 9.242 16.449 7.803
396 HH21 ARG 131 HH21 ARG 131 12.001 16.136 5.980
397 HH22 ARG 131 HH22 ARG 131 10.810 15.479 7.084
Start of MODEL 2
1 H1 GLY 1 H1 GLY 1 14.171 21.193 11.699
2 H2 GLY 1 H2 GLY 1 12.996 21.350 10.569
3 H3 GLY 1 H3 GLY 1 13.275 22.566 11.631
4 HA2 GLY 1 HA2 GLY 1 14.194 23.137 9.476
5 HA3 GLY 1 HA3 GLY 1 15.456 22.979 10.711
6 H ILE 2 H ILE 2 15.503 22.701 7.795
7 HA ILE 2 HA ILE 2 16.987 20.155 7.575
8 HB ILE 2 HB ILE 2 14.978 19.263 6.888
9 HG12 ILE 2 HG12 ILE 2 16.236 20.190 4.267
10 HG13 ILE 2 HG13 ILE 2 16.898 18.924 5.314
11 HG21 ILE 2 HG21 ILE 2 13.343 20.173 5.356
12 HG22 ILE 2 HG22 ILE 2 13.572 21.299 6.674
13 HG23 ILE 2 HG23 ILE 2 14.311 21.631 5.089
14 HD11 ILE 2 HD11 ILE 2 14.278 18.859 3.767
15 HD12 ILE 2 HD12 ILE 2 15.734 17.900 3.503
16 HD13 ILE 2 HD13 ILE 2 14.756 17.634 4.968
17 H VAL 3 H VAL 3 15.854 22.931 5.559
18 HA VAL 3 HA VAL 3 18.369 23.007 4.061
19 HB VAL 3 HB VAL 3 16.168 25.104 4.281
20 HG11 VAL 3 HG11 VAL 3 18.449 24.768 2.275
21 HG12 VAL 3 HG12 VAL 3 17.111 25.928 2.125
22 HG13 VAL 3 HG13 VAL 3 18.275 26.092 3.442
23 HG21 VAL 3 HG21 VAL 3 15.425 24.258 2.094
24 HG22 VAL 3 HG22 VAL 3 16.661 22.990 2.137
25 HG23 VAL 3 HG23 VAL 3 15.316 22.982 3.302
26 H GLU 4 H GLU 4 16.962 24.810 6.767
27 HA GLU 4 HA GLU 4 19.371 26.395 7.204
28 HB2 GLU 4 HB2 GLU 4 18.213 27.405 9.023
29 HB3 GLU 4 HB3 GLU 4 17.250 27.423 7.553
30 HG2 GLU 4 HG2 GLU 4 16.862 25.301 9.702
31 HG3 GLU 4 HG3 GLU 4 16.101 26.879 9.821
32 H GLN 5 H GLN 5 19.369 23.346 7.434
33 HA GLN 5 HA GLN 5 21.179 23.310 9.788
34 HB2 GLN 5 HB2 GLN 5 19.146 22.068 10.317
35 HB3 GLN 5 HB3 GLN 5 19.256 21.165 8.815
36 HG2 GLN 5 HG2 GLN 5 19.999 19.802 10.648
37 HG3 GLN 5 HG3 GLN 5 21.329 20.090 9.549
38 HE21 GLN 5 HE21 GLN 5 22.997 19.755 11.070
39 HE22 GLN 5 HE22 GLN 5 23.241 20.811 12.466
40 H CYS 6 H CYS 6 20.398 21.589 6.683
41 HA CYS 6 HA CYS 6 23.229 20.823 6.415
42 HB2 CYS 6 HB2 CYS 6 20.635 19.953 5.208
43 HB3 CYS 6 HB3 CYS 6 22.098 19.737 4.255
44 H CYS 7 H CYS 7 21.428 23.508 5.218
45 HA CYS 7 HA CYS 7 23.443 23.919 3.042
46 HB2 CYS 7 HB2 CYS 7 20.954 24.125 2.615
47 HB3 CYS 7 HB3 CYS 7 20.976 25.580 3.608
48 H THR 8 H THR 8 22.350 25.288 6.144
49 HA THR 8 HA THR 8 24.131 27.600 6.069
50 HB THR 8 HB THR 8 23.457 27.743 8.519
51 HG1 THR 8 HG1 THR 8 21.819 26.332 9.150
52 HG21 THR 8 HG21 THR 8 21.108 28.347 8.044
53 HG22 THR 8 HG22 THR 8 21.205 27.529 6.465
54 HG23 THR 8 HG23 THR 8 22.197 28.960 6.792
55 H SER 9 H SER 9 24.394 24.289 7.206
56 HA SER 9 HA SER 9 27.274 24.703 7.793
57 HB2 SER 9 HB2 SER 9 25.904 24.635 9.929
58 HB3 SER 9 HB3 SER 9 25.467 22.965 9.511
59 HG SER 9 HG SER 9 27.358 23.180 10.890
60 H ILE 10 H ILE 10 28.268 22.314 8.012
61 HA ILE 10 HA ILE 10 27.748 21.070 5.448
62 HB ILE 10 HB ILE 10 29.390 19.298 6.276
63 HG12 ILE 10 HG12 ILE 10 31.041 20.006 7.938
64 HG13 ILE 10 HG13 ILE 10 30.083 21.405 8.382
65 HG21 ILE 10 HG21 ILE 10 31.271 20.730 5.675
66 HG22 ILE 10 HG22 ILE 10 29.876 21.097 4.668
67 HG23 ILE 10 HG23 ILE 10 30.300 22.185 6.003
68 HD11 ILE 10 HD11 ILE 10 28.412 20.037 9.428
69 HD12 ILE 10 HD12 ILE 10 29.111 18.540 8.741
70 HD13 ILE 10 HD13 ILE 10 29.983 19.463 9.977
71 H CYS 11 H CYS 11 26.894 19.180 4.882
72 HA CYS 11 HA CYS 11 24.885 18.046 6.708
73 HB2 CYS 11 HB2 CYS 11 24.539 18.972 4.315
74 HB3 CYS 11 HB3 CYS 11 25.221 17.447 3.772
75 H SER 12 H SER 12 24.472 15.676 6.582
76 HA SER 12 HA SER 12 26.724 13.855 6.049
77 HB2 SER 12 HB2 SER 12 27.275 14.592 8.307
78 HB3 SER 12 HB3 SER 12 25.615 14.242 8.848
79 HG SER 12 HG SER 12 27.256 12.573 9.256
80 H LEU 13 H LEU 13 26.048 11.676 5.974
81 HA LEU 13 HA LEU 13 23.408 11.000 5.205
82 HB2 LEU 13 HB2 LEU 13 24.090 8.674 5.787
83 HB3 LEU 13 HB3 LEU 13 25.137 9.500 4.657
84 HG LEU 13 HG LEU 13 26.020 9.723 7.503
85 HD11 LEU 13 HD11 LEU 13 26.906 7.432 7.594
86 HD12 LEU 13 HD12 LEU 13 26.086 7.043 6.058
87 HD13 LEU 13 HD13 LEU 13 25.137 7.420 7.517
88 HD21 LEU 13 HD21 LEU 13 27.440 8.837 4.960
89 HD22 LEU 13 HD22 LEU 13 28.201 9.208 6.519
90 HD23 LEU 13 HD23 LEU 13 27.416 10.496 5.594
91 H TYR 14 H TYR 14 24.837 11.127 8.459
92 HA TYR 14 HA TYR 14 22.611 9.975 9.875
93 HB2 TYR 14 HB2 TYR 14 24.916 10.152 10.738
94 HB3 TYR 14 HB3 TYR 14 24.793 11.905 10.761
95 HD1 TYR 14 HD1 TYR 14 23.322 8.779 12.216
96 HD2 TYR 14 HD2 TYR 14 23.884 13.039 12.668
97 HE1 TYR 14 HE1 TYR 14 22.403 8.659 14.530
98 HE2 TYR 14 HE2 TYR 14 22.966 12.913 14.978
99 HH TYR 14 HH TYR 14 21.857 9.823 16.423
100 H GLN 15 H GLN 15 23.142 13.200 8.610
101 HA GLN 15 HA GLN 15 20.931 14.425 10.170
102 HB2 GLN 15 HB2 GLN 15 22.726 15.571 7.987
103 HB3 GLN 15 HB3 GLN 15 21.456 16.446 8.838
104 HG2 GLN 15 HG2 GLN 15 22.631 16.122 10.991
105 HG3 GLN 15 HG3 GLN 15 23.920 15.228 10.176
106 HE21 GLN 15 HE21 GLN 15 25.663 16.464 9.310
107 HE22 GLN 15 HE22 GLN 15 25.567 18.212 9.102
108 H LEU 16 H LEU 16 21.687 13.340 6.857
109 HA LEU 16 HA LEU 16 19.243 14.151 5.628
110 HB2 LEU 16 HB2 LEU 16 21.290 12.013 4.972
111 HB3 LEU 16 HB3 LEU 16 19.968 12.463 3.892
112 HG LEU 16 HG LEU 16 22.060 14.462 4.838
113 HD11 LEU 16 HD11 LEU 16 23.094 14.143 2.614
114 HD12 LEU 16 HD12 LEU 16 21.992 12.777 2.301
115 HD13 LEU 16 HD13 LEU 16 23.190 12.687 3.609
116 HD21 LEU 16 HD21 LEU 16 20.112 14.472 2.500
117 HD22 LEU 16 HD22 LEU 16 21.333 15.708 2.850
118 HD23 LEU 16 HD23 LEU 16 19.983 15.466 3.969
119 H GLU 17 H GLU 17 20.104 11.038 7.235
120 HA GLU 17 HA GLU 17 17.617 9.722 6.669
121 HB2 GLU 17 HB2 GLU 17 19.703 9.377 8.852
122 HB3 GLU 17 HB3 GLU 17 18.256 8.376 8.761
123 HG2 GLU 17 HG2 GLU 17 18.855 7.661 6.467
124 HG3 GLU 17 HG3 GLU 17 20.345 8.591 6.559
125 H ASN 18 H ASN 18 18.399 12.142 9.142
126 HA ASN 18 HA ASN 18 16.170 11.608 10.875
127 HB2 ASN 18 HB2 ASN 18 18.181 12.973 11.472
128 HB3 ASN 18 HB3 ASN 18 17.630 14.233 10.366
129 HD21 ASN 18 HD21 ASN 18 16.219 15.781 11.186
130 HD22 ASN 18 HD22 ASN 18 15.416 15.603 12.740
131 H TYR 19 H TYR 19 16.431 13.504 7.869
132 HA TYR 19 HA TYR 19 13.816 14.713 8.094
133 HB2 TYR 19 HB2 TYR 19 15.393 14.246 5.562
134 HB3 TYR 19 HB3 TYR 19 14.199 15.503 5.878
135 HD1 TYR 19 HD1 TYR 19 15.108 16.521 8.563
136 HD2 TYR 19 HD2 TYR 19 17.369 15.424 5.052
137 HE1 TYR 19 HE1 TYR 19 16.965 17.984 9.303
138 HE2 TYR 19 HE2 TYR 19 19.237 16.902 5.813
139 HH TYR 19 HH TYR 19 19.055 18.752 8.867
140 H CYS 20 H CYS 20 14.858 11.565 7.016
141 HA CYS 20 HA CYS 20 12.206 10.822 5.962
142 HB2 CYS 20 HB2 CYS 20 14.558 9.027 6.614
143 HB3 CYS 20 HB3 CYS 20 13.200 8.681 5.548
144 H ASN 21 H ASN 21 13.321 11.332 9.060
145 HA ASN 21 HA ASN 21 13.121 10.534 11.104
146 HB2 ASN 21 HB2 ASN 21 10.716 11.061 10.528
147 HB3 ASN 21 HB3 ASN 21 10.478 9.346 10.252
148 HD21 ASN 21 HD21 ASN 21 8.855 9.482 11.988
149 HD22 ASN 21 HD22 ASN 21 9.399 9.503 13.664
150 H GLY 22 H GLY 22 14.765 9.008 9.541
151 HA2 GLY 22 HA2 GLY 22 14.390 6.149 9.801
152 HA3 GLY 22 HA3 GLY 22 15.884 6.991 9.412
153 H1 PHE 101 H1 PHE 101 29.531 8.375 0.479
154 H2 PHE 101 H2 PHE 101 30.775 8.553 1.537
155 H3 PHE 101 H3 PHE 101 30.914 9.099 0.007
156 HA PHE 101 HA PHE 101 29.204 10.730 0.332
157 HB2 PHE 101 HB2 PHE 101 28.045 9.296 2.109
158 HB3 PHE 101 HB3 PHE 101 29.223 9.902 3.263
159 HD1 PHE 101 HD1 PHE 101 26.293 10.718 1.174
160 HD2 PHE 101 HD2 PHE 101 29.169 12.301 3.981
161 HE1 PHE 101 HE1 PHE 101 24.900 12.749 1.468
162 HE2 PHE 101 HE2 PHE 101 27.811 14.357 4.199
163 HZ PHE 101 HZ PHE 101 25.653 14.574 2.984
164 H VAL 102 H VAL 102 29.737 12.889 1.118
165 HA VAL 102 HA VAL 102 32.198 13.220 2.707
166 HB VAL 102 HB VAL 102 33.044 13.211 0.430
167 HG11 VAL 102 HG11 VAL 102 32.511 14.954 -1.202
168 HG12 VAL 102 HG12 VAL 102 31.071 13.988 -0.842
169 HG13 VAL 102 HG13 VAL 102 31.246 15.606 -0.141
170 HG21 VAL 102 HG21 VAL 102 33.087 16.038 1.564
171 HG22 VAL 102 HG22 VAL 102 34.082 14.678 2.141
172 HG23 VAL 102 HG23 VAL 102 34.283 15.287 0.491
173 H ASN 103 H ASN 103 32.176 15.000 4.013
174 HA ASN 103 HA ASN 103 29.604 16.200 4.524
175 HB2 ASN 103 HB2 ASN 103 30.744 17.303 6.387
176 HB3 ASN 103 HB3 ASN 103 31.039 15.574 6.355
177 HD21 ASN 103 HD21 ASN 103 32.576 18.458 6.941
178 HD22 ASN 103 HD22 ASN 103 34.214 17.947 6.552
179 H GLN 104 H GLN 104 28.769 17.660 3.269
180 HA GLN 104 HA GLN 104 30.242 20.111 2.485
181 HB2 GLN 104 HB2 GLN 104 28.843 18.158 0.608
182 HB3 GLN 104 HB3 GLN 104 29.116 19.836 0.167
183 HG2 GLN 104 HG2 GLN 104 31.312 17.844 0.862
184 HG3 GLN 104 HG3 GLN 104 30.812 18.295 -0.761
185 HE21 GLN 104 HE21 GLN 104 33.469 18.646 -0.200
186 HE22 GLN 104 HE22 GLN 104 33.800 20.360 -0.010
187 H HIS 105 H HIS 105 28.808 21.804 1.691
188 HA HIS 105 HA HIS 105 26.251 21.946 3.156
189 HB2 HIS 105 HB2 HIS 105 27.677 23.882 1.292
190 HB3 HIS 105 HB3 HIS 105 26.113 24.191 2.032
191 HD1 HIS 105 HD1 HIS 105 26.287 25.595 4.161
192 HD2 HIS 105 HD2 HIS 105 29.721 23.296 3.368
193 HE1 HIS 105 HE1 HIS 105 28.003 26.217 5.957
194 H LEU 106 H LEU 106 24.270 21.588 2.306
195 HA LEU 106 HA LEU 106 23.896 21.232 -0.639
196 HB2 LEU 106 HB2 LEU 106 22.998 19.384 1.611
197 HB3 LEU 106 HB3 LEU 106 22.406 19.280 -0.047
198 HG LEU 106 HG LEU 106 25.312 18.855 0.804
199 HD11 LEU 106 HD11 LEU 106 23.148 16.888 -0.049
200 HD12 LEU 106 HD12 LEU 106 23.779 17.092 1.602
201 HD13 LEU 106 HD13 LEU 106 24.842 16.492 0.314
202 HD21 LEU 106 HD21 LEU 106 23.901 18.494 -1.872
203 HD22 LEU 106 HD22 LEU 106 25.536 17.905 -1.505
204 HD23 LEU 106 HD23 LEU 106 25.216 19.638 -1.515
205 H CYS 107 H CYS 107 22.052 22.102 -1.415
206 HA CYS 107 HA CYS 107 20.019 23.204 0.489
207 HB2 CYS 107 HB2 CYS 107 21.913 24.652 -1.136
208 HB3 CYS 107 HB3 CYS 107 20.334 24.869 -1.840
209 H GLY 108 H GLY 108 17.921 23.499 -0.355
210 HA2 GLY 108 HA2 GLY 108 16.027 22.921 -1.536
211 HA3 GLY 108 HA3 GLY 108 16.989 23.497 -2.888
212 H SER 109 H SER 109 16.773 22.185 -4.556
213 HA SER 109 HA SER 109 15.754 19.556 -4.562
214 HB2 SER 109 HB2 SER 109 15.924 21.205 -6.493
215 HB3 SER 109 HB3 SER 109 17.631 20.744 -6.629
216 HG SER 109 HG SER 109 16.238 19.520 -8.035
217 H HIS 110 H HIS 110 19.215 20.585 -4.439
218 HA HIS 110 HA HIS 110 20.239 17.929 -4.842
219 HB2 HIS 110 HB2 HIS 110 21.377 20.281 -5.077
220 HB3 HIS 110 HB3 HIS 110 21.744 20.096 -3.360
221 HD1 HIS 110 HD1 HIS 110 22.428 16.887 -3.551
222 HD2 HIS 110 HD2 HIS 110 23.738 19.998 -6.054
223 HE1 HIS 110 HE1 HIS 110 24.613 16.075 -4.605
224 H LEU 111 H LEU 111 19.283 19.749 -1.960
225 HA LEU 111 HA LEU 111 20.244 17.791 -0.041
226 HB2 LEU 111 HB2 LEU 111 19.927 20.172 0.493
227 HB3 LEU 111 HB3 LEU 111 18.203 20.051 0.168
228 HG LEU 111 HG LEU 111 17.889 18.581 2.103
229 HD11 LEU 111 HD11 LEU 111 19.757 18.170 3.683
230 HD12 LEU 111 HD12 LEU 111 20.895 18.876 2.502
231 HD13 LEU 111 HD13 LEU 111 20.007 17.380 2.125
232 HD21 LEU 111 HD21 LEU 111 17.819 21.002 2.474
233 HD22 LEU 111 HD22 LEU 111 19.576 21.048 2.712
234 HD23 LEU 111 HD23 LEU 111 18.547 20.196 3.874
235 H VAL 112 H VAL 112 17.109 18.373 -1.692
236 HA VAL 112 HA VAL 112 15.688 16.192 -0.433
237 HB VAL 112 HB VAL 112 15.293 17.621 -3.083
238 HG11 VAL 112 HG11 VAL 112 13.578 15.452 -1.817
239 HG12 VAL 112 HG12 VAL 112 13.022 16.549 -3.111
240 HG13 VAL 112 HG13 VAL 112 14.335 15.413 -3.423
241 HG21 VAL 112 HG21 VAL 112 13.729 17.658 -0.462
242 HG22 VAL 112 HG22 VAL 112 14.841 18.925 -1.020
243 HG23 VAL 112 HG23 VAL 112 13.364 18.607 -1.928
244 H GLU 113 H GLU 113 17.592 16.307 -3.502
245 HA GLU 113 HA GLU 113 17.264 13.556 -4.136
246 HB2 GLU 113 HB2 GLU 113 18.107 15.316 -5.672
247 HB3 GLU 113 HB3 GLU 113 19.620 15.390 -4.758
248 HG2 GLU 113 HG2 GLU 113 20.123 13.058 -5.342
249 HG3 GLU 113 HG3 GLU 113 18.550 12.885 -6.125
250 H ALA 114 H ALA 114 19.843 15.126 -2.137
251 HA ALA 114 HA ALA 114 21.282 12.727 -1.629
252 HB1 ALA 114 HB1 ALA 114 22.293 14.024 0.199
253 HB2 ALA 114 HB2 ALA 114 22.165 14.992 -1.280
254 HB3 ALA 114 HB3 ALA 114 21.020 15.257 0.054
255 H LEU 115 H LEU 115 18.514 14.166 0.201
256 HA LEU 115 HA LEU 115 18.626 12.047 2.175
257 HB2 LEU 115 HB2 LEU 115 17.114 13.155 3.366
258 HB3 LEU 115 HB3 LEU 115 17.770 14.458 2.418
259 HG LEU 115 HG LEU 115 15.660 13.855 0.827
260 HD11 LEU 115 HD11 LEU 115 14.812 13.035 3.644
261 HD12 LEU 115 HD12 LEU 115 14.835 11.992 2.222
262 HD13 LEU 115 HD13 LEU 115 13.702 13.351 2.309
263 HD21 LEU 115 HD21 LEU 115 14.428 15.634 1.975
264 HD22 LEU 115 HD22 LEU 115 16.156 16.032 1.901
265 HD23 LEU 115 HD23 LEU 115 15.449 15.437 3.415
266 H TYR 116 H TYR 116 16.931 12.368 -0.903
267 HA TYR 116 HA TYR 116 15.357 9.974 -0.647
268 HB2 TYR 116 HB2 TYR 116 15.638 11.965 -2.559
269 HB3 TYR 116 HB3 TYR 116 16.418 10.620 -3.348
270 HD1 TYR 116 HD1 TYR 116 14.912 8.265 -2.952
271 HD2 TYR 116 HD2 TYR 116 13.438 12.329 -3.101
272 HE1 TYR 116 HE1 TYR 116 12.643 7.430 -3.551
273 HE2 TYR 116 HE2 TYR 116 11.177 11.481 -3.683
274 HH TYR 116 HH TYR 116 9.871 9.640 -4.078
275 H LEU 117 H LEU 117 18.669 10.553 -1.907
276 HA LEU 117 HA LEU 117 19.207 7.823 -2.581
277 HB2 LEU 117 HB2 LEU 117 20.969 10.236 -2.015
278 HB3 LEU 117 HB3 LEU 117 21.643 8.674 -2.469
279 HG LEU 117 HG LEU 117 19.628 10.150 -4.215
280 HD11 LEU 117 HD11 LEU 117 21.680 11.490 -3.946
281 HD12 LEU 117 HD12 LEU 117 21.583 10.806 -5.574
282 HD13 LEU 117 HD13 LEU 117 22.671 10.075 -4.378
283 HD21 LEU 117 HD21 LEU 117 20.503 8.675 -5.987
284 HD22 LEU 117 HD22 LEU 117 19.780 7.728 -4.687
285 HD23 LEU 117 HD23 LEU 117 21.548 7.856 -4.807
286 H VAL 118 H VAL 118 19.832 9.576 0.519
287 HA VAL 118 HA VAL 118 21.230 7.315 1.618
288 HB VAL 118 HB VAL 118 21.269 9.800 2.402
289 HG11 VAL 118 HG11 VAL 118 18.894 10.002 3.090
290 HG12 VAL 118 HG12 VAL 118 19.140 8.709 4.282
291 HG13 VAL 118 HG13 VAL 118 19.999 10.216 4.459
292 HG21 VAL 118 HG21 VAL 118 22.680 8.022 3.301
293 HG22 VAL 118 HG22 VAL 118 22.092 9.086 4.589
294 HG23 VAL 118 HG23 VAL 118 21.363 7.487 4.377
295 H CYS 119 H CYS 119 17.783 8.176 1.625
296 HA CYS 119 HA CYS 119 17.155 5.992 3.500
297 HB2 CYS 119 HB2 CYS 119 15.428 8.074 2.142
298 HB3 CYS 119 HB3 CYS 119 14.872 6.928 3.371
299 H GLY 120 H GLY 120 16.956 6.491 0.012
300 HA2 GLY 120 HA2 GLY 120 16.486 5.045 -1.709
301 HA3 GLY 120 HA3 GLY 120 17.071 3.796 -0.614
302 H GLU 121 H GLU 121 15.747 2.127 -0.691
303 HA GLU 121 HA GLU 121 13.043 2.180 -1.577
304 HB2 GLU 121 HB2 GLU 121 13.048 -0.195 -1.117
305 HB3 GLU 121 HB3 GLU 121 14.550 0.288 -1.889
306 HG2 GLU 121 HG2 GLU 121 15.695 0.245 0.337
307 HG3 GLU 121 HG3 GLU 121 14.177 -0.236 1.100
308 H ARG 122 H ARG 122 14.171 2.933 1.574
309 HA ARG 122 HA ARG 122 11.763 2.196 3.061
310 HB2 ARG 122 HB2 ARG 122 14.101 2.590 3.992
311 HB3 ARG 122 HB3 ARG 122 13.846 4.319 3.701
312 HG2 ARG 122 HG2 ARG 122 11.907 4.287 5.243
313 HG3 ARG 122 HG3 ARG 122 12.157 2.558 5.531
314 HD2 ARG 122 HD2 ARG 122 14.357 3.000 6.502
315 HD3 ARG 122 HD3 ARG 122 14.257 4.712 6.076
316 HE ARG 122 HE ARG 122 13.004 3.363 8.348
317 HH11 ARG 122 HH21 ARG 122 12.720 6.228 6.332
318 HH12 ARG 122 HH22 ARG 122 11.812 7.087 7.558
319 HH21 ARG 122 HH11 ARG 122 11.799 4.498 9.795
320 HH22 ARG 122 HH12 ARG 122 11.166 6.078 9.349
321 H GLY 123 H GLY 123 12.539 4.707 0.840
322 HA2 GLY 123 HA2 GLY 123 11.133 6.349 -0.055
323 HA3 GLY 123 HA3 GLY 123 9.989 6.167 1.273
324 H PHE 124 H PHE 124 11.156 8.597 0.160
325 HA PHE 124 HA PHE 124 13.185 9.535 2.029
326 HB2 PHE 124 HB2 PHE 124 13.682 11.046 0.475
327 HB3 PHE 124 HB3 PHE 124 12.823 9.953 -0.575
328 HD1 PHE 124 HD1 PHE 124 10.067 10.514 -0.572
329 HD2 PHE 124 HD2 PHE 124 13.295 13.289 0.109
330 HE1 PHE 124 HE1 PHE 124 8.570 12.405 -1.152
331 HE2 PHE 124 HE2 PHE 124 11.791 15.178 -0.397
332 HZ PHE 124 HZ PHE 124 9.424 14.744 -1.054
333 H PHE 125 H PHE 125 9.746 9.726 2.004
334 HA PHE 125 HA PHE 125 9.447 12.290 3.273
335 HB2 PHE 125 HB2 PHE 125 7.140 11.696 3.561
336 HB3 PHE 125 HB3 PHE 125 7.670 11.239 1.952
337 HD1 PHE 125 HD2 PHE 125 7.912 8.828 1.331
338 HD2 PHE 125 HD1 PHE 125 6.440 10.031 5.206
339 HE1 PHE 125 HE2 PHE 125 7.079 6.525 1.735
340 HE2 PHE 125 HE1 PHE 125 5.579 7.732 5.584
341 HZ PHE 125 HZ PHE 125 5.924 5.976 3.866
342 H TYR 126 H TYR 126 8.729 12.767 5.425
343 HA TYR 126 HA TYR 126 10.183 11.415 7.514
344 HB2 TYR 126 HB2 TYR 126 9.635 13.857 7.377
345 HB3 TYR 126 HB3 TYR 126 7.960 13.480 7.732
346 HD1 TYR 126 HD2 TYR 126 7.360 12.478 9.992
347 HD2 TYR 126 HD1 TYR 126 11.302 13.994 9.089
348 HE1 TYR 126 HE2 TYR 126 7.868 12.612 12.422
349 HE2 TYR 126 HE1 TYR 126 11.805 14.128 11.523
350 HH TYR 126 HH TYR 126 9.409 13.182 14.020
351 H THR 127 H THR 127 9.596 9.331 8.044
352 HA THR 127 HA THR 127 6.958 8.372 7.603
353 HB THR 127 HB THR 127 7.735 6.274 8.700
354 HG1 THR 127 HG1 THR 127 9.223 7.292 10.145
355 HG21 THR 127 HG21 THR 127 9.403 5.699 7.019
356 HG22 THR 127 HG22 THR 127 9.663 7.417 6.642
357 HG23 THR 127 HG23 THR 127 8.100 6.651 6.289
358 HA PRO 128 HA PRO 128 5.135 9.151 11.658
359 HB2 PRO 128 HB2 PRO 128 2.810 7.751 11.440
360 HB3 PRO 128 HB3 PRO 128 3.115 9.242 10.506
361 HG2 PRO 128 HG2 PRO 128 3.448 6.372 9.579
362 HG3 PRO 128 HG3 PRO 128 2.599 7.718 8.747
363 HD2 PRO 128 HD2 PRO 128 5.180 7.030 8.155
364 HD3 PRO 128 HD3 PRO 128 4.612 8.728 8.098
365 H LYS 129 H LYS 129 5.772 5.937 10.393
366 HA LYS 129 HA LYS 129 6.618 4.933 13.032
367 HB2 LYS 129 HB2 LYS 129 4.218 4.285 12.807
368 HB3 LYS 129 HB3 LYS 129 4.583 3.473 11.283
369 HG2 LYS 129 HG2 LYS 129 6.065 1.883 12.464
370 HG3 LYS 129 HG3 LYS 129 5.780 2.736 13.996
371 HD2 LYS 129 HD2 LYS 129 3.369 2.176 13.857
372 HD3 LYS 129 HD3 LYS 129 3.650 1.352 12.302
373 HE2 LYS 129 HE2 LYS 129 5.213 -0.222 13.426
374 HE3 LYS 129 HE3 LYS 129 4.926 0.592 14.969
375 HZ1 LYS 129 HZ1 LYS 129 2.852 -0.824 13.379
376 HZ2 LYS 129 HZ2 LYS 129 2.579 -0.059 14.798
377 HZ3 LYS 129 HZ3 LYS 129 3.535 -1.382 14.754
378 H THR 130 H THR 130 8.310 3.489 12.862
379 HA THR 130 HA THR 130 9.542 3.206 10.169
380 HB THR 130 HB THR 130 10.756 4.314 12.086
381 HG1 THR 130 HG1 THR 130 12.694 3.088 11.489
382 HG21 THR 130 HG21 THR 130 10.253 2.590 13.856
383 HG22 THR 130 HG22 THR 130 11.976 2.942 13.649
384 HG23 THR 130 HG23 THR 130 11.292 1.445 12.977
385 H ARG 131 H ARG 131 10.943 1.233 9.912
386 HA ARG 131 HA ARG 131 10.922 -0.913 9.152
387 HB2 ARG 131 HB2 ARG 131 11.761 -0.998 11.541
388 HB3 ARG 131 HB3 ARG 131 10.174 -1.606 12.005
389 HG2 ARG 131 HG2 ARG 131 10.562 -3.508 10.289
390 HG3 ARG 131 HG3 ARG 131 12.194 -2.872 10.091
391 HD2 ARG 131 HD2 ARG 131 12.305 -4.694 11.650
392 HD3 ARG 131 HD3 ARG 131 12.561 -3.191 12.561
393 HE ARG 131 HE ARG 131 9.777 -3.871 12.589
394 HH11 ARG 131 HH11 ARG 131 12.755 -5.060 14.001
395 HH12 ARG 131 HH12 ARG 131 11.932 -5.768 15.366
396 HH21 ARG 131 HH21 ARG 131 8.795 -4.799 14.346
397 HH22 ARG 131 HH22 ARG 131 9.753 -5.611 15.556
Start of MODEL 3
1 H1 GLY 1 H1 GLY 1 14.690 25.523 9.844
2 H2 GLY 1 H2 GLY 1 14.193 24.137 10.568
3 H3 GLY 1 H3 GLY 1 13.100 25.290 10.163
4 HA2 GLY 1 HA2 GLY 1 12.978 23.463 8.601
5 HA3 GLY 1 HA3 GLY 1 13.503 24.960 7.811
6 H ILE 2 H ILE 2 13.993 22.083 7.141
7 HA ILE 2 HA ILE 2 16.561 21.200 7.825
8 HB ILE 2 HB ILE 2 14.735 19.854 6.865
9 HG12 ILE 2 HG12 ILE 2 17.402 19.631 5.430
10 HG13 ILE 2 HG13 ILE 2 16.957 18.934 6.986
11 HG21 ILE 2 HG21 ILE 2 14.189 19.766 4.537
12 HG22 ILE 2 HG22 ILE 2 14.074 21.453 5.003
13 HG23 ILE 2 HG23 ILE 2 15.495 20.875 4.100
14 HD11 ILE 2 HD11 ILE 2 16.853 17.179 5.359
15 HD12 ILE 2 HD12 ILE 2 15.167 17.591 5.767
16 HD13 ILE 2 HD13 ILE 2 15.880 18.161 4.245
17 H VAL 3 H VAL 3 15.689 23.261 5.040
18 HA VAL 3 HA VAL 3 18.279 23.196 3.803
19 HB VAL 3 HB VAL 3 16.148 25.354 3.576
20 HG11 VAL 3 HG11 VAL 3 18.315 26.146 2.718
21 HG12 VAL 3 HG12 VAL 3 18.518 24.647 1.783
22 HG13 VAL 3 HG13 VAL 3 17.230 25.807 1.367
23 HG21 VAL 3 HG21 VAL 3 16.667 22.867 1.876
24 HG22 VAL 3 HG22 VAL 3 15.255 23.155 2.906
25 HG23 VAL 3 HG23 VAL 3 15.508 24.168 1.489
26 H GLU 4 H GLU 4 16.896 25.432 6.224
27 HA GLU 4 HA GLU 4 19.331 27.032 6.309
28 HB2 GLU 4 HB2 GLU 4 16.951 27.049 8.166
29 HB3 GLU 4 HB3 GLU 4 18.230 28.267 8.083
30 HG2 GLU 4 HG2 GLU 4 16.256 27.637 5.848
31 HG3 GLU 4 HG3 GLU 4 16.138 28.978 6.970
32 H GLN 5 H GLN 5 19.367 24.049 7.053
33 HA GLN 5 HA GLN 5 21.230 24.410 9.349
34 HB2 GLN 5 HB2 GLN 5 19.451 22.021 8.703
35 HB3 GLN 5 HB3 GLN 5 20.746 22.024 9.888
36 HG2 GLN 5 HG2 GLN 5 18.302 23.844 10.028
37 HG3 GLN 5 HG3 GLN 5 18.450 22.299 10.849
38 HE21 GLN 5 HE21 GLN 5 19.845 25.629 10.729
39 HE22 GLN 5 HE22 GLN 5 20.454 25.542 12.381
40 H CYS 6 H CYS 6 20.521 22.428 6.403
41 HA CYS 6 HA CYS 6 23.373 21.683 6.257
42 HB2 CYS 6 HB2 CYS 6 21.013 20.851 4.573
43 HB3 CYS 6 HB3 CYS 6 22.637 20.196 4.463
44 H CYS 7 H CYS 7 21.430 24.145 4.780
45 HA CYS 7 HA CYS 7 23.402 24.570 2.618
46 HB2 CYS 7 HB2 CYS 7 20.888 24.768 2.402
47 HB3 CYS 7 HB3 CYS 7 20.988 26.234 3.391
48 H THR 8 H THR 8 22.893 25.545 5.897
49 HA THR 8 HA THR 8 24.592 27.978 5.741
50 HB THR 8 HB THR 8 23.788 28.245 8.122
51 HG1 THR 8 HG1 THR 8 21.936 26.957 8.622
52 HG21 THR 8 HG21 THR 8 21.493 28.923 7.517
53 HG22 THR 8 HG22 THR 8 21.596 27.993 6.007
54 HG23 THR 8 HG23 THR 8 22.643 29.408 6.250
55 H SER 9 H SER 9 24.404 24.844 7.439
56 HA SER 9 HA SER 9 27.353 24.939 7.992
57 HB2 SER 9 HB2 SER 9 25.138 23.531 9.532
58 HB3 SER 9 HB3 SER 9 26.875 23.300 9.805
59 HG SER 9 HG SER 9 25.952 24.864 11.223
60 H ILE 10 H ILE 10 28.294 22.605 7.998
61 HA ILE 10 HA ILE 10 27.433 21.280 5.518
62 HB ILE 10 HB ILE 10 29.322 19.861 5.712
63 HG12 ILE 10 HG12 ILE 10 31.044 20.485 7.632
64 HG13 ILE 10 HG13 ILE 10 29.592 20.882 8.549
65 HG21 ILE 10 HG21 ILE 10 31.061 21.501 5.468
66 HG22 ILE 10 HG22 ILE 10 29.562 22.202 4.851
67 HG23 ILE 10 HG23 ILE 10 30.183 22.686 6.443
68 HD11 ILE 10 HD11 ILE 10 28.797 18.528 8.250
69 HD12 ILE 10 HD12 ILE 10 30.211 18.192 7.229
70 HD13 ILE 10 HD13 ILE 10 30.417 18.571 8.950
71 H CYS 11 H CYS 11 26.846 19.049 5.326
72 HA CYS 11 HA CYS 11 25.749 17.748 7.767
73 HB2 CYS 11 HB2 CYS 11 24.199 18.436 5.259
74 HB3 CYS 11 HB3 CYS 11 23.737 17.089 6.300
75 H SER 12 H SER 12 25.398 15.552 7.636
76 HA SER 12 HA SER 12 26.761 14.043 5.432
77 HB2 SER 12 HB2 SER 12 26.782 13.480 8.401
78 HB3 SER 12 HB3 SER 12 27.409 12.385 7.152
79 HG SER 12 HG SER 12 29.048 13.760 8.093
80 H LEU 13 H LEU 13 25.925 12.019 4.870
81 HA LEU 13 HA LEU 13 23.163 11.989 4.528
82 HB2 LEU 13 HB2 LEU 13 25.124 9.647 4.505
83 HB3 LEU 13 HB3 LEU 13 23.497 9.589 3.846
84 HG LEU 13 HG LEU 13 25.766 11.336 2.835
85 HD11 LEU 13 HD11 LEU 13 25.640 9.889 0.845
86 HD12 LEU 13 HD12 LEU 13 24.340 8.947 1.606
87 HD13 LEU 13 HD13 LEU 13 25.978 8.942 2.299
88 HD21 LEU 13 HD21 LEU 13 22.898 11.086 1.824
89 HD22 LEU 13 HD22 LEU 13 24.233 11.828 0.917
90 HD23 LEU 13 HD23 LEU 13 23.712 12.552 2.437
91 H TYR 14 H TYR 14 24.943 10.410 7.175
92 HA TYR 14 HA TYR 14 22.717 8.903 8.186
93 HB2 TYR 14 HB2 TYR 14 24.046 8.427 10.062
94 HB3 TYR 14 HB3 TYR 14 25.119 8.452 8.686
95 HD1 TYR 14 HD2 TYR 14 24.058 10.229 11.763
96 HD2 TYR 14 HD1 TYR 14 26.948 10.095 8.564
97 HE1 TYR 14 HE2 TYR 14 25.494 11.854 12.989
98 HE2 TYR 14 HE1 TYR 14 28.386 11.708 9.797
99 HH TYR 14 HH TYR 14 28.630 12.992 11.689
100 H GLN 15 H GLN 15 23.338 12.275 8.344
101 HA GLN 15 HA GLN 15 21.559 12.822 10.658
102 HB2 GLN 15 HB2 GLN 15 22.973 14.733 8.760
103 HB3 GLN 15 HB3 GLN 15 22.231 15.127 10.304
104 HG2 GLN 15 HG2 GLN 15 23.939 13.927 11.542
105 HG3 GLN 15 HG3 GLN 15 24.627 13.244 10.068
106 HE21 GLN 15 HE21 GLN 15 26.405 14.505 11.693
107 HE22 GLN 15 HE22 GLN 15 26.845 16.044 10.975
108 H LEU 16 H LEU 16 21.498 12.660 7.144
109 HA LEU 16 HA LEU 16 19.119 14.335 6.837
110 HB2 LEU 16 HB2 LEU 16 20.596 12.573 4.853
111 HB3 LEU 16 HB3 LEU 16 19.285 13.684 4.478
112 HG LEU 16 HG LEU 16 22.062 14.447 5.450
113 HD11 LEU 16 HD11 LEU 16 21.787 13.764 3.071
114 HD12 LEU 16 HD12 LEU 16 22.236 15.466 3.253
115 HD13 LEU 16 HD13 LEU 16 20.552 15.031 2.873
116 HD21 LEU 16 HD21 LEU 16 19.619 16.186 4.961
117 HD22 LEU 16 HD22 LEU 16 21.281 16.811 5.026
118 HD23 LEU 16 HD23 LEU 16 20.568 16.059 6.457
119 H GLU 17 H GLU 17 19.744 10.822 7.024
120 HA GLU 17 HA GLU 17 17.173 9.974 6.181
121 HB2 GLU 17 HB2 GLU 17 17.666 7.918 7.577
122 HB3 GLU 17 HB3 GLU 17 18.792 8.292 6.292
123 HG2 GLU 17 HG2 GLU 17 20.442 9.088 7.765
124 HG3 GLU 17 HG3 GLU 17 19.324 9.173 9.138
125 H ASN 18 H ASN 18 17.994 11.594 9.120
126 HA ASN 18 HA ASN 18 15.828 10.891 10.830
127 HB2 ASN 18 HB2 ASN 18 17.833 12.288 11.410
128 HB3 ASN 18 HB3 ASN 18 17.218 13.566 10.355
129 HD21 ASN 18 HD22 ASN 18 16.897 15.152 11.897
130 HD22 ASN 18 HD21 ASN 18 15.778 14.965 13.239
131 H TYR 19 H TYR 19 15.923 12.981 7.943
132 HA TYR 19 HA TYR 19 13.269 14.122 8.465
133 HB2 TYR 19 HB2 TYR 19 15.240 14.524 6.187
134 HB3 TYR 19 HB3 TYR 19 13.740 15.415 6.415
135 HD1 TYR 19 HD2 TYR 19 13.424 16.964 8.338
136 HD2 TYR 19 HD1 TYR 19 17.191 15.015 7.596
137 HE1 TYR 19 HE2 TYR 19 14.545 18.543 9.894
138 HE2 TYR 19 HE1 TYR 19 18.318 16.594 9.164
139 HH TYR 19 HH TYR 19 16.519 19.170 10.878
140 H CYS 20 H CYS 20 14.254 11.223 7.029
141 HA CYS 20 HA CYS 20 12.225 11.005 4.976
142 HB2 CYS 20 HB2 CYS 20 13.771 8.891 6.520
143 HB3 CYS 20 HB3 CYS 20 12.832 8.605 5.064
144 H ASN 21 H ASN 21 11.945 11.020 8.365
145 HA ASN 21 HA ASN 21 10.458 10.356 9.903
146 HB2 ASN 21 HB2 ASN 21 9.115 11.953 8.512
147 HB3 ASN 21 HB3 ASN 21 8.418 10.570 7.665
148 HD21 ASN 21 HD21 ASN 21 6.352 11.542 8.491
149 HD22 ASN 21 HD22 ASN 21 5.861 11.120 10.125
150 H GLY 22 H GLY 22 11.901 8.309 9.206
151 HA2 GLY 22 HA2 GLY 22 12.046 5.987 9.450
152 HA3 GLY 22 HA3 GLY 22 10.280 5.891 9.574
153 H1 PHE 101 H1 PHE 101 31.570 11.149 5.374
154 H2 PHE 101 H2 PHE 101 32.490 10.606 4.137
155 H3 PHE 101 H3 PHE 101 31.053 9.885 4.456
156 HA PHE 101 HA PHE 101 30.869 11.286 2.523
157 HB2 PHE 101 HB2 PHE 101 28.925 10.959 4.107
158 HB3 PHE 101 HB3 PHE 101 29.357 12.481 4.876
159 HD1 PHE 101 HD1 PHE 101 28.456 10.976 1.526
160 HD2 PHE 101 HD2 PHE 101 28.469 14.523 3.998
161 HE1 PHE 101 HE1 PHE 101 27.098 12.172 -0.168
162 HE2 PHE 101 HE2 PHE 101 27.101 15.696 2.316
163 HZ PHE 101 HZ PHE 101 26.409 14.533 0.224
164 H VAL 102 H VAL 102 30.634 13.611 1.768
165 HA VAL 102 HA VAL 102 33.143 14.960 2.295
166 HB VAL 102 HB VAL 102 32.340 16.622 0.649
167 HG11 VAL 102 HG11 VAL 102 33.617 14.640 -0.035
168 HG12 VAL 102 HG12 VAL 102 32.107 13.721 -0.243
169 HG13 VAL 102 HG13 VAL 102 32.459 15.127 -1.280
170 HG21 VAL 102 HG21 VAL 102 29.865 16.446 1.022
171 HG22 VAL 102 HG22 VAL 102 30.329 16.232 -0.669
172 HG23 VAL 102 HG23 VAL 102 29.899 14.820 0.312
173 H ASN 103 H ASN 103 33.574 16.941 3.154
174 HA ASN 103 HA ASN 103 31.697 17.963 5.171
175 HB2 ASN 103 HB2 ASN 103 34.137 17.496 5.593
176 HB3 ASN 103 HB3 ASN 103 34.543 18.846 4.537
177 HD21 ASN 103 HD21 ASN 103 33.667 21.013 5.202
178 HD22 ASN 103 HD22 ASN 103 33.553 21.326 6.937
179 H GLN 104 H GLN 104 30.210 18.506 3.293
180 HA GLN 104 HA GLN 104 30.660 21.283 2.302
181 HB2 GLN 104 HB2 GLN 104 29.833 18.874 0.627
182 HB3 GLN 104 HB3 GLN 104 29.722 20.551 0.094
183 HG2 GLN 104 HG2 GLN 104 32.196 20.802 0.424
184 HG3 GLN 104 HG3 GLN 104 32.294 19.085 0.822
185 HE21 GLN 104 HE21 GLN 104 31.382 21.374 -1.825
186 HE22 GLN 104 HE22 GLN 104 31.688 20.202 -3.098
187 H HIS 105 H HIS 105 28.760 22.333 1.468
188 HA HIS 105 HA HIS 105 26.378 21.918 3.117
189 HB2 HIS 105 HB2 HIS 105 26.976 23.915 0.898
190 HB3 HIS 105 HB3 HIS 105 25.581 23.959 1.969
191 HD1 HIS 105 HD1 HIS 105 26.462 23.989 4.770
192 HD2 HIS 105 HD2 HIS 105 28.888 25.510 1.677
193 HE1 HIS 105 HE1 HIS 105 28.145 25.580 5.873
194 H LEU 106 H LEU 106 24.281 21.727 2.321
195 HA LEU 106 HA LEU 106 23.796 20.828 -0.467
196 HB2 LEU 106 HB2 LEU 106 22.909 19.396 2.068
197 HB3 LEU 106 HB3 LEU 106 22.191 19.109 0.481
198 HG LEU 106 HG LEU 106 25.141 18.642 1.095
199 HD11 LEU 106 HD11 LEU 106 23.762 17.177 2.466
200 HD12 LEU 106 HD12 LEU 106 24.535 16.255 1.166
201 HD13 LEU 106 HD13 LEU 106 22.815 16.696 1.037
202 HD21 LEU 106 HD21 LEU 106 24.667 18.953 -1.317
203 HD22 LEU 106 HD22 LEU 106 23.363 17.746 -1.227
204 HD23 LEU 106 HD23 LEU 106 25.050 17.266 -0.976
205 H CYS 107 H CYS 107 22.211 21.988 -1.308
206 HA CYS 107 HA CYS 107 20.269 23.422 0.466
207 HB2 CYS 107 HB2 CYS 107 21.594 24.389 -2.087
208 HB3 CYS 107 HB3 CYS 107 20.464 25.302 -1.098
209 H GLY 108 H GLY 108 18.145 23.538 -0.225
210 HA2 GLY 108 HA2 GLY 108 16.209 22.947 -1.337
211 HA3 GLY 108 HA3 GLY 108 17.117 23.458 -2.759
212 H SER 109 H SER 109 16.805 22.018 -4.343
213 HA SER 109 HA SER 109 15.881 19.399 -4.106
214 HB2 SER 109 HB2 SER 109 17.533 20.567 -6.374
215 HB3 SER 109 HB3 SER 109 16.434 19.171 -6.467
216 HG SER 109 HG SER 109 15.428 21.090 -7.204
217 H HIS 110 H HIS 110 19.304 20.457 -3.997
218 HA HIS 110 HA HIS 110 20.375 17.812 -4.462
219 HB2 HIS 110 HB2 HIS 110 21.514 20.127 -4.741
220 HB3 HIS 110 HB3 HIS 110 21.753 20.085 -2.989
221 HD1 HIS 110 HD1 HIS 110 24.408 20.223 -4.066
222 HD2 HIS 110 HD2 HIS 110 22.252 16.613 -4.276
223 HE1 HIS 110 HE1 HIS 110 26.133 18.375 -4.408
224 H LEU 111 H LEU 111 19.374 19.647 -1.630
225 HA LEU 111 HA LEU 111 20.335 17.833 0.416
226 HB2 LEU 111 HB2 LEU 111 19.562 20.386 0.419
227 HB3 LEU 111 HB3 LEU 111 17.973 19.698 0.698
228 HG LEU 111 HG LEU 111 20.441 19.518 2.460
229 HD11 LEU 111 HD11 LEU 111 18.941 20.727 4.026
230 HD12 LEU 111 HD12 LEU 111 17.652 20.704 2.811
231 HD13 LEU 111 HD13 LEU 111 19.159 21.613 2.505
232 HD21 LEU 111 HD21 LEU 111 19.364 17.369 2.707
233 HD22 LEU 111 HD22 LEU 111 17.762 18.128 2.824
234 HD23 LEU 111 HD23 LEU 111 18.975 18.351 4.111
235 H VAL 112 H VAL 112 17.178 18.329 -1.215
236 HA VAL 112 HA VAL 112 15.820 16.132 0.048
237 HB VAL 112 HB VAL 112 15.282 17.453 -2.632
238 HG11 VAL 112 HG11 VAL 112 14.176 15.250 -2.573
239 HG12 VAL 112 HG12 VAL 112 13.533 15.594 -0.955
240 HG13 VAL 112 HG13 VAL 112 12.981 16.532 -2.365
241 HG21 VAL 112 HG21 VAL 112 13.489 18.627 -1.379
242 HG22 VAL 112 HG22 VAL 112 14.029 17.844 0.125
243 HG23 VAL 112 HG23 VAL 112 15.082 19.006 -0.707
244 H GLU 113 H GLU 113 17.676 16.247 -3.062
245 HA GLU 113 HA GLU 113 17.305 13.513 -3.716
246 HB2 GLU 113 HB2 GLU 113 18.180 15.236 -5.241
247 HB3 GLU 113 HB3 GLU 113 19.687 15.315 -4.317
248 HG2 GLU 113 HG2 GLU 113 20.187 12.969 -4.880
249 HG3 GLU 113 HG3 GLU 113 18.618 12.801 -5.664
250 H ALA 114 H ALA 114 19.861 15.019 -1.643
251 HA ALA 114 HA ALA 114 21.221 12.552 -1.140
252 HB1 ALA 114 HB1 ALA 114 21.107 15.107 0.497
253 HB2 ALA 114 HB2 ALA 114 22.307 13.799 0.656
254 HB3 ALA 114 HB3 ALA 114 22.236 14.760 -0.833
255 H LEU 115 H LEU 115 18.523 14.139 0.696
256 HA LEU 115 HA LEU 115 18.533 12.057 2.702
257 HB2 LEU 115 HB2 LEU 115 16.934 13.142 3.803
258 HB3 LEU 115 HB3 LEU 115 17.701 14.443 2.925
259 HG LEU 115 HG LEU 115 15.680 13.981 1.206
260 HD11 LEU 115 HD11 LEU 115 13.614 13.416 2.369
261 HD12 LEU 115 HD12 LEU 115 14.490 13.176 3.896
262 HD13 LEU 115 HD13 LEU 115 14.751 12.068 2.550
263 HD21 LEU 115 HD21 LEU 115 15.344 15.460 3.839
264 HD22 LEU 115 HD22 LEU 115 14.465 15.767 2.324
265 HD23 LEU 115 HD23 LEU 115 16.201 16.088 2.412
266 H TYR 116 H TYR 116 16.969 12.330 -0.446
267 HA TYR 116 HA TYR 116 15.350 9.942 -0.205
268 HB2 TYR 116 HB2 TYR 116 16.266 11.739 -2.412
269 HB3 TYR 116 HB3 TYR 116 15.938 10.084 -2.857
270 HD1 TYR 116 HD2 TYR 116 14.259 12.833 -0.861
271 HD2 TYR 116 HD1 TYR 116 13.833 9.522 -3.589
272 HE1 TYR 116 HE2 TYR 116 11.815 13.296 -1.051
273 HE2 TYR 116 HE1 TYR 116 11.388 9.968 -3.734
274 HH TYR 116 HH TYR 116 9.658 11.256 -3.071
275 H LEU 117 H LEU 117 18.654 10.487 -1.513
276 HA LEU 117 HA LEU 117 19.109 7.800 -2.264
277 HB2 LEU 117 HB2 LEU 117 20.941 10.114 -1.566
278 HB3 LEU 117 HB3 LEU 117 21.598 8.554 -2.029
279 HG LEU 117 HG LEU 117 19.672 10.101 -3.814
280 HD11 LEU 117 HD11 LEU 117 21.724 11.410 -3.426
281 HD12 LEU 117 HD12 LEU 117 21.677 10.781 -5.077
282 HD13 LEU 117 HD13 LEU 117 22.719 10.000 -3.866
283 HD21 LEU 117 HD21 LEU 117 19.808 7.697 -4.333
284 HD22 LEU 117 HD22 LEU 117 21.586 7.802 -4.386
285 HD23 LEU 117 HD23 LEU 117 20.594 8.662 -5.584
286 H VAL 118 H VAL 118 19.882 9.340 0.918
287 HA VAL 118 HA VAL 118 21.108 6.930 1.939
288 HB VAL 118 HB VAL 118 21.505 9.154 2.881
289 HG11 VAL 118 HG11 VAL 118 18.750 8.925 4.136
290 HG12 VAL 118 HG12 VAL 118 19.972 10.167 4.478
291 HG13 VAL 118 HG13 VAL 118 19.253 10.062 2.876
292 HG21 VAL 118 HG21 VAL 118 21.639 8.443 5.210
293 HG22 VAL 118 HG22 VAL 118 20.460 7.163 4.927
294 HG23 VAL 118 HG23 VAL 118 22.054 7.098 4.146
295 H CYS 119 H CYS 119 17.740 7.923 1.724
296 HA CYS 119 HA CYS 119 16.852 5.598 3.330
297 HB2 CYS 119 HB2 CYS 119 15.416 7.978 2.184
298 HB3 CYS 119 HB3 CYS 119 14.604 6.674 3.062
299 H GLY 120 H GLY 120 17.930 5.677 0.313
300 HA2 GLY 120 HA2 GLY 120 17.871 3.861 -1.165
301 HA3 GLY 120 HA3 GLY 120 16.350 3.310 -0.469
302 H GLU 121 H GLU 121 14.629 3.520 -1.790
303 HA GLU 121 HA GLU 121 14.828 5.080 -4.264
304 HB2 GLU 121 HB2 GLU 121 12.830 3.956 -4.935
305 HB3 GLU 121 HB3 GLU 121 13.954 2.790 -4.242
306 HG2 GLU 121 HG2 GLU 121 12.648 2.901 -2.072
307 HG3 GLU 121 HG3 GLU 121 11.475 3.936 -2.881
308 H ARG 122 H ARG 122 13.273 5.583 -1.167
309 HA ARG 122 HA ARG 122 12.186 8.159 -2.119
310 HB2 ARG 122 HB2 ARG 122 10.136 7.819 -0.978
311 HB3 ARG 122 HB3 ARG 122 10.386 6.482 -2.080
312 HG2 ARG 122 HG2 ARG 122 9.623 5.302 -0.304
313 HG3 ARG 122 HG3 ARG 122 11.339 5.264 0.105
314 HD2 ARG 122 HD2 ARG 122 10.917 7.311 1.568
315 HD3 ARG 122 HD3 ARG 122 9.196 7.144 1.204
316 HE ARG 122 HE ARG 122 9.580 4.718 2.136
317 HH11 ARG 122 HH11 ARG 122 11.007 7.657 3.563
318 HH12 ARG 122 HH12 ARG 122 11.156 6.836 5.116
319 HH21 ARG 122 HH21 ARG 122 9.721 3.920 4.214
320 HH22 ARG 122 HH22 ARG 122 10.344 4.938 5.493
321 H GLY 123 H GLY 123 12.360 9.837 -0.746
322 HA2 GLY 123 HA2 GLY 123 13.876 9.527 1.803
323 HA3 GLY 123 HA3 GLY 123 13.508 11.027 0.953
324 H PHE 124 H PHE 124 11.525 12.000 1.207
325 HA PHE 124 HA PHE 124 9.953 11.712 3.555
326 HB2 PHE 124 HB2 PHE 124 9.173 12.859 0.850
327 HB3 PHE 124 HB3 PHE 124 8.426 13.254 2.390
328 HD1 PHE 124 HD1 PHE 124 10.736 13.821 4.164
329 HD2 PHE 124 HD2 PHE 124 10.076 14.849 0.025
330 HE1 PHE 124 HE1 PHE 124 12.139 15.845 4.437
331 HE2 PHE 124 HE2 PHE 124 11.474 16.873 0.305
332 HZ PHE 124 HZ PHE 124 12.497 17.386 2.522
333 H PHE 125 H PHE 125 7.520 11.377 3.460
334 HA PHE 125 HA PHE 125 6.813 8.741 2.567
335 HB2 PHE 125 HB2 PHE 125 4.589 9.340 3.440
336 HB3 PHE 125 HB3 PHE 125 5.879 9.683 4.573
337 HD1 PHE 125 HD1 PHE 125 3.432 11.208 2.208
338 HD2 PHE 125 HD2 PHE 125 6.297 11.950 5.348
339 HE1 PHE 125 HE1 PHE 125 2.643 13.555 2.384
340 HE2 PHE 125 HE2 PHE 125 5.502 14.293 5.519
341 HZ PHE 125 HZ PHE 125 3.680 15.102 4.031
342 H TYR 126 H TYR 126 6.997 11.572 0.738
343 HA TYR 126 HA TYR 126 4.877 11.119 -1.180
344 HB2 TYR 126 HB2 TYR 126 7.472 12.695 -1.342
345 HB3 TYR 126 HB3 TYR 126 6.170 12.776 -2.522
346 HD1 TYR 126 HD1 TYR 126 3.730 13.252 -1.456
347 HD2 TYR 126 HD2 TYR 126 7.515 14.459 0.232
348 HE1 TYR 126 HE1 TYR 126 2.594 15.071 -0.202
349 HE2 TYR 126 HE2 TYR 126 6.373 16.263 1.506
350 HH TYR 126 HH TYR 126 2.831 16.829 1.256
351 H THR 127 H THR 127 5.589 10.948 -3.572
352 HA THR 127 HA THR 127 5.996 8.323 -4.147
353 HB THR 127 HB THR 127 6.720 10.572 -6.052
354 HG1 THR 127 HG1 THR 127 4.509 10.689 -6.450
355 HG21 THR 127 HG21 THR 127 7.009 8.324 -7.023
356 HG22 THR 127 HG22 THR 127 5.602 9.118 -7.726
357 HG23 THR 127 HG23 THR 127 5.376 7.863 -6.489
358 HA PRO 128 HA PRO 128 10.453 7.472 -4.084
359 HB2 PRO 128 HB2 PRO 128 9.625 5.583 -6.298
360 HB3 PRO 128 HB3 PRO 128 10.742 5.285 -4.930
361 HG2 PRO 128 HG2 PRO 128 8.208 4.361 -4.812
362 HG3 PRO 128 HG3 PRO 128 8.923 5.165 -3.374
363 HD2 PRO 128 HD2 PRO 128 7.043 6.324 -5.437
364 HD3 PRO 128 HD3 PRO 128 7.007 6.479 -3.652
365 H LYS 129 H LYS 129 12.223 8.079 -5.254
366 HA LYS 129 HA LYS 129 13.305 9.704 -6.426
367 HB2 LYS 129 HB2 LYS 129 12.068 8.220 -8.771
368 HB3 LYS 129 HB3 LYS 129 13.521 9.226 -8.802
369 HG2 LYS 129 HG2 LYS 129 14.625 7.683 -7.184
370 HG3 LYS 129 HG3 LYS 129 13.196 6.628 -7.241
371 HD2 LYS 129 HD2 LYS 129 13.502 6.331 -9.675
372 HD3 LYS 129 HD3 LYS 129 14.956 7.358 -9.618
373 HE2 LYS 129 HE2 LYS 129 16.009 5.763 -8.021
374 HE3 LYS 129 HE3 LYS 129 14.561 4.752 -8.070
375 HZ1 LYS 129 HZ1 LYS 129 16.281 3.930 -9.588
376 HZ2 LYS 129 HZ2 LYS 129 16.310 5.338 -10.402
377 HZ3 LYS 129 HZ3 LYS 129 14.978 4.390 -10.447
378 H THR 130 H THR 130 10.487 10.486 -5.723
379 HA THR 130 HA THR 130 9.088 12.205 -5.875
380 HB THR 130 HB THR 130 11.062 13.772 -7.538
381 HG1 THR 130 HG1 THR 130 11.166 13.271 -4.749
382 HG21 THR 130 HG21 THR 130 10.376 15.596 -5.929
383 HG22 THR 130 HG22 THR 130 9.134 14.489 -5.288
384 HG23 THR 130 HG23 THR 130 9.073 15.042 -6.973
385 H ARG 131 H ARG 131 9.579 10.392 -8.530
386 HA ARG 131 HA ARG 131 7.363 11.626 -10.095
387 HB2 ARG 131 HB2 ARG 131 10.105 10.922 -11.233
388 HB3 ARG 131 HB3 ARG 131 8.658 11.243 -12.192
389 HG2 ARG 131 HG2 ARG 131 8.534 13.544 -11.191
390 HG3 ARG 131 HG3 ARG 131 10.052 13.214 -10.337
391 HD2 ARG 131 HD2 ARG 131 10.560 14.491 -12.320
392 HD3 ARG 131 HD3 ARG 131 11.199 12.859 -12.502
393 HE ARG 131 HE ARG 131 9.748 12.451 -14.261
394 HH11 ARG 131 HH21 ARG 131 8.722 15.472 -12.795
395 HH12 ARG 131 HH22 ARG 131 7.611 15.811 -14.097
396 HH21 ARG 131 HH11 ARG 131 8.297 12.945 -15.848
397 HH22 ARG 131 HH12 ARG 131 7.382 14.424 -15.768
Start of MODEL 4
1 H1 GLY 1 H1 GLY 1 14.956 24.956 11.104
2 H2 GLY 1 H2 GLY 1 13.915 23.733 11.405
3 H3 GLY 1 H3 GLY 1 13.340 25.241 11.144
4 HA2 GLY 1 HA2 GLY 1 12.979 23.896 9.188
5 HA3 GLY 1 HA3 GLY 1 14.093 25.235 8.869
6 H ILE 2 H ILE 2 13.740 22.458 7.676
7 HA ILE 2 HA ILE 2 16.085 20.893 8.354
8 HB ILE 2 HB ILE 2 14.032 20.761 6.117
9 HG12 ILE 2 HG12 ILE 2 14.552 18.983 8.554
10 HG13 ILE 2 HG13 ILE 2 13.320 20.248 8.480
11 HG21 ILE 2 HG21 ILE 2 16.072 19.790 5.174
12 HG22 ILE 2 HG22 ILE 2 16.326 18.816 6.636
13 HG23 ILE 2 HG23 ILE 2 14.953 18.500 5.556
14 HD11 ILE 2 HD11 ILE 2 12.227 18.164 8.134
15 HD12 ILE 2 HD12 ILE 2 12.220 19.038 6.590
16 HD13 ILE 2 HD13 ILE 2 13.350 17.684 6.859
17 H VAL 3 H VAL 3 15.373 23.228 5.744
18 HA VAL 3 HA VAL 3 17.559 22.598 4.096
19 HB VAL 3 HB VAL 3 16.187 25.295 4.379
20 HG11 VAL 3 HG11 VAL 3 18.277 25.549 3.113
21 HG12 VAL 3 HG12 VAL 3 17.875 24.128 2.113
22 HG13 VAL 3 HG13 VAL 3 16.908 25.624 2.003
23 HG21 VAL 3 HG21 VAL 3 15.625 22.937 2.517
24 HG22 VAL 3 HG22 VAL 3 14.575 23.495 3.839
25 HG23 VAL 3 HG23 VAL 3 14.841 24.523 2.430
26 H GLU 4 H GLU 4 17.481 24.978 6.758
27 HA GLU 4 HA GLU 4 20.042 26.114 6.400
28 HB2 GLU 4 HB2 GLU 4 18.550 25.491 8.985
29 HB3 GLU 4 HB3 GLU 4 19.925 26.574 8.867
30 HG2 GLU 4 HG2 GLU 4 17.240 26.969 7.476
31 HG3 GLU 4 HG3 GLU 4 17.746 27.752 8.962
32 H GLN 5 H GLN 5 19.211 22.989 7.867
33 HA GLN 5 HA GLN 5 21.585 22.624 9.376
34 HB2 GLN 5 HB2 GLN 5 19.912 20.413 8.147
35 HB3 GLN 5 HB3 GLN 5 20.904 20.326 9.600
36 HG2 GLN 5 HG2 GLN 5 18.260 21.772 9.226
37 HG3 GLN 5 HG3 GLN 5 18.598 20.396 10.258
38 HE21 GLN 5 HE21 GLN 5 17.631 23.338 10.668
39 HE22 GLN 5 HE22 GLN 5 18.625 23.870 12.030
40 H CYS 6 H CYS 6 20.936 21.983 5.979
41 HA CYS 6 HA CYS 6 23.759 21.017 5.621
42 HB2 CYS 6 HB2 CYS 6 21.300 20.574 3.919
43 HB3 CYS 6 HB3 CYS 6 22.927 20.082 3.487
44 H CYS 7 H CYS 7 21.539 23.642 4.759
45 HA CYS 7 HA CYS 7 23.161 24.436 2.454
46 HB2 CYS 7 HB2 CYS 7 20.698 24.445 2.486
47 HB3 CYS 7 HB3 CYS 7 20.719 25.737 3.689
48 H THR 8 H THR 8 22.609 25.748 5.764
49 HA THR 8 HA THR 8 24.770 27.773 5.261
50 HB THR 8 HB THR 8 23.900 28.941 7.269
51 HG1 THR 8 HG1 THR 8 21.674 28.429 7.754
52 HG21 THR 8 HG21 THR 8 21.866 28.599 5.012
53 HG22 THR 8 HG22 THR 8 23.293 29.656 4.969
54 HG23 THR 8 HG23 THR 8 22.002 29.975 6.129
55 H SER 9 H SER 9 23.731 25.145 7.365
56 HA SER 9 HA SER 9 26.453 25.019 8.601
57 HB2 SER 9 HB2 SER 9 23.864 23.559 9.227
58 HB3 SER 9 HB3 SER 9 25.425 23.194 9.986
59 HG SER 9 HG SER 9 24.192 24.667 11.242
60 H ILE 10 H ILE 10 27.524 22.850 8.578
61 HA ILE 10 HA ILE 10 27.079 21.419 6.002
62 HB ILE 10 HB ILE 10 29.191 20.313 6.337
63 HG12 ILE 10 HG12 ILE 10 30.831 21.337 8.014
64 HG13 ILE 10 HG13 ILE 10 29.442 21.916 8.919
65 HG21 ILE 10 HG21 ILE 10 29.417 23.333 6.635
66 HG22 ILE 10 HG22 ILE 10 30.591 22.254 5.875
67 HG23 ILE 10 HG23 ILE 10 28.999 22.471 5.134
68 HD11 ILE 10 HD11 ILE 10 28.758 19.609 9.386
69 HD12 ILE 10 HD12 ILE 10 29.960 18.981 8.235
70 HD13 ILE 10 HD13 ILE 10 30.471 19.769 9.749
71 H CYS 11 H CYS 11 26.927 19.056 5.949
72 HA CYS 11 HA CYS 11 25.864 17.869 8.441
73 HB2 CYS 11 HB2 CYS 11 23.727 17.397 7.570
74 HB3 CYS 11 HB3 CYS 11 24.031 19.099 7.283
75 H SER 12 H SER 12 25.272 15.671 8.323
76 HA SER 12 HA SER 12 27.004 14.000 6.548
77 HB2 SER 12 HB2 SER 12 26.130 13.601 9.424
78 HB3 SER 12 HB3 SER 12 27.100 12.458 8.468
79 HG SER 12 HG SER 12 28.342 13.936 9.812
80 H LEU 13 H LEU 13 26.333 11.773 6.163
81 HA LEU 13 HA LEU 13 23.745 11.456 5.082
82 HB2 LEU 13 HB2 LEU 13 25.762 9.406 6.089
83 HB3 LEU 13 HB3 LEU 13 24.327 8.986 5.171
84 HG LEU 13 HG LEU 13 26.647 10.675 4.185
85 HD11 LEU 13 HD11 LEU 13 25.652 7.901 3.384
86 HD12 LEU 13 HD12 LEU 13 27.105 8.260 4.349
87 HD13 LEU 13 HD13 LEU 13 27.022 8.771 2.653
88 HD21 LEU 13 HD21 LEU 13 24.100 9.848 2.728
89 HD22 LEU 13 HD22 LEU 13 25.552 10.522 1.948
90 HD23 LEU 13 HD23 LEU 13 24.635 11.505 3.079
91 H TYR 14 H TYR 14 24.860 10.624 8.374
92 HA TYR 14 HA TYR 14 22.387 9.325 9.106
93 HB2 TYR 14 HB2 TYR 14 23.264 9.418 11.396
94 HB3 TYR 14 HB3 TYR 14 24.369 8.714 10.232
95 HD1 TYR 14 HD2 TYR 14 23.673 11.826 12.184
96 HD2 TYR 14 HD1 TYR 14 26.575 9.549 9.948
97 HE1 TYR 14 HE2 TYR 14 25.489 13.350 12.978
98 HE2 TYR 14 HE1 TYR 14 28.383 11.057 10.752
99 HH TYR 14 HH TYR 14 28.919 12.866 12.042
100 H GLN 15 H GLN 15 23.144 12.680 8.823
101 HA GLN 15 HA GLN 15 20.833 13.535 10.496
102 HB2 GLN 15 HB2 GLN 15 22.734 15.143 8.747
103 HB3 GLN 15 HB3 GLN 15 21.448 15.798 9.759
104 HG2 GLN 15 HG2 GLN 15 22.559 14.965 11.794
105 HG3 GLN 15 HG3 GLN 15 23.823 14.201 10.817
106 HE21 GLN 15 HE21 GLN 15 22.690 17.302 12.104
107 HE22 GLN 15 HE22 GLN 15 24.085 18.199 11.522
108 H LEU 16 H LEU 16 21.784 13.139 7.044
109 HA LEU 16 HA LEU 16 19.371 14.252 5.950
110 HB2 LEU 16 HB2 LEU 16 21.517 12.383 4.920
111 HB3 LEU 16 HB3 LEU 16 20.150 12.850 3.927
112 HG LEU 16 HG LEU 16 21.893 14.978 5.228
113 HD11 LEU 16 HD11 LEU 16 23.437 13.549 4.017
114 HD12 LEU 16 HD12 LEU 16 23.190 15.044 3.108
115 HD13 LEU 16 HD13 LEU 16 22.381 13.546 2.588
116 HD21 LEU 16 HD21 LEU 16 21.157 16.311 3.298
117 HD22 LEU 16 HD22 LEU 16 19.755 15.689 4.183
118 HD23 LEU 16 HD23 LEU 16 20.248 14.922 2.653
119 H GLU 17 H GLU 17 20.225 10.947 7.032
120 HA GLU 17 HA GLU 17 17.830 9.614 6.308
121 HB2 GLU 17 HB2 GLU 17 19.733 9.267 8.658
122 HB3 GLU 17 HB3 GLU 17 18.314 8.245 8.434
123 HG2 GLU 17 HG2 GLU 17 19.113 7.584 6.186
124 HG3 GLU 17 HG3 GLU 17 20.571 8.544 6.428
125 H ASN 18 H ASN 18 18.278 11.975 8.937
126 HA ASN 18 HA ASN 18 16.016 11.119 10.496
127 HB2 ASN 18 HB2 ASN 18 17.978 12.431 11.337
128 HB3 ASN 18 HB3 ASN 18 17.405 13.832 10.421
129 HD21 ASN 18 HD21 ASN 18 15.845 15.153 11.383
130 HD22 ASN 18 HD22 ASN 18 15.049 14.728 12.887
131 H TYR 19 H TYR 19 16.368 13.450 7.834
132 HA TYR 19 HA TYR 19 13.758 14.647 8.068
133 HB2 TYR 19 HB2 TYR 19 15.463 14.434 5.582
134 HB3 TYR 19 HB3 TYR 19 14.306 15.698 5.982
135 HD1 TYR 19 HD2 TYR 19 15.165 16.325 8.844
136 HD2 TYR 19 HD1 TYR 19 17.450 15.631 5.250
137 HE1 TYR 19 HE2 TYR 19 17.125 17.474 9.866
138 HE2 TYR 19 HE1 TYR 19 19.400 16.823 6.274
139 HH TYR 19 HH TYR 19 19.321 18.025 9.638
140 H CYS 20 H CYS 20 14.800 11.653 6.745
141 HA CYS 20 HA CYS 20 12.098 11.077 5.641
142 HB2 CYS 20 HB2 CYS 20 13.325 9.363 4.238
143 HB3 CYS 20 HB3 CYS 20 13.517 11.059 3.841
144 H ASN 21 H ASN 21 13.297 10.837 8.444
145 HA ASN 21 HA ASN 21 13.035 9.549 10.248
146 HB2 ASN 21 HB2 ASN 21 10.724 10.042 9.351
147 HB3 ASN 21 HB3 ASN 21 10.705 8.407 8.706
148 HD21 ASN 21 HD21 ASN 21 9.030 7.653 9.957
149 HD22 ASN 21 HD22 ASN 21 9.110 7.520 11.717
150 H GLY 22 H GLY 22 14.909 8.354 8.390
151 HA2 GLY 22 HA2 GLY 22 16.217 6.479 8.140
152 HA3 GLY 22 HA3 GLY 22 15.737 6.122 9.796
153 H1 PHE 101 H1 PHE 101 29.946 13.913 1.545
154 H2 PHE 101 H2 PHE 101 29.893 15.516 1.224
155 H3 PHE 101 H3 PHE 101 28.567 14.591 0.959
156 HA PHE 101 HA PHE 101 28.307 15.903 2.948
157 HB2 PHE 101 HB2 PHE 101 27.565 14.193 4.434
158 HB3 PHE 101 HB3 PHE 101 27.181 13.707 2.808
159 HD1 PHE 101 HD1 PHE 101 28.598 11.880 1.663
160 HD2 PHE 101 HD2 PHE 101 28.859 12.798 5.876
161 HE1 PHE 101 HE1 PHE 101 29.697 9.709 2.066
162 HE2 PHE 101 HE2 PHE 101 29.946 10.603 6.274
163 HZ PHE 101 HZ PHE 101 30.375 9.062 4.375
164 H VAL 102 H VAL 102 28.949 16.225 5.221
165 HA VAL 102 HA VAL 102 30.404 17.131 6.649
166 HB VAL 102 HB VAL 102 32.458 15.061 5.790
167 HG11 VAL 102 HG11 VAL 102 33.598 16.892 6.931
168 HG12 VAL 102 HG12 VAL 102 32.372 16.891 8.228
169 HG13 VAL 102 HG13 VAL 102 33.470 15.514 8.008
170 HG21 VAL 102 HG21 VAL 102 31.766 13.907 7.859
171 HG22 VAL 102 HG22 VAL 102 30.532 15.149 8.159
172 HG23 VAL 102 HG23 VAL 102 30.398 14.069 6.760
173 H ASN 103 H ASN 103 31.770 18.846 6.800
174 HA ASN 103 HA ASN 103 32.499 20.822 6.104
175 HB2 ASN 103 HB2 ASN 103 34.749 20.780 5.475
176 HB3 ASN 103 HB3 ASN 103 34.442 19.391 6.495
177 HD21 ASN 103 HD21 ASN 103 34.672 20.288 3.019
178 HD22 ASN 103 HD22 ASN 103 35.438 18.764 2.548
179 H GLN 104 H GLN 104 30.512 19.767 4.160
180 HA GLN 104 HA GLN 104 30.780 21.901 2.179
181 HB2 GLN 104 HB2 GLN 104 31.973 19.964 1.176
182 HB3 GLN 104 HB3 GLN 104 30.538 18.961 1.378
183 HG2 GLN 104 HG2 GLN 104 30.834 19.720 -0.938
184 HG3 GLN 104 HG3 GLN 104 29.317 20.305 -0.279
185 HE21 GLN 104 HE21 GLN 104 32.598 21.279 -1.338
186 HE22 GLN 104 HE22 GLN 104 32.236 22.998 -1.345
187 H HIS 105 H HIS 105 28.769 22.277 1.031
188 HA HIS 105 HA HIS 105 26.456 21.758 2.806
189 HB2 HIS 105 HB2 HIS 105 27.036 23.964 0.809
190 HB3 HIS 105 HB3 HIS 105 25.580 23.855 1.790
191 HD1 HIS 105 HD1 HIS 105 26.079 23.979 4.586
192 HD2 HIS 105 HD2 HIS 105 29.176 25.038 1.931
193 HE1 HIS 105 HE1 HIS 105 27.743 25.374 5.931
194 H LEU 106 H LEU 106 24.353 21.607 1.985
195 HA LEU 106 HA LEU 106 23.876 20.916 -0.856
196 HB2 LEU 106 HB2 LEU 106 22.870 19.246 1.485
197 HB3 LEU 106 HB3 LEU 106 22.331 19.073 -0.171
198 HG LEU 106 HG LEU 106 25.219 18.610 0.702
199 HD11 LEU 106 HD11 LEU 106 24.621 16.200 0.577
200 HD12 LEU 106 HD12 LEU 106 22.918 16.661 0.348
201 HD13 LEU 106 HD13 LEU 106 23.748 17.054 1.863
202 HD21 LEU 106 HD21 LEU 106 23.675 17.783 -1.792
203 HD22 LEU 106 HD22 LEU 106 25.358 17.365 -1.431
204 HD23 LEU 106 HD23 LEU 106 24.922 19.053 -1.724
205 H CYS 107 H CYS 107 22.026 21.933 -1.569
206 HA CYS 107 HA CYS 107 20.127 23.025 0.439
207 HB2 CYS 107 HB2 CYS 107 22.094 24.590 -0.278
208 HB3 CYS 107 HB3 CYS 107 21.191 24.772 -1.778
209 H GLY 108 H GLY 108 18.059 23.621 -0.387
210 HA2 GLY 108 HA2 GLY 108 16.142 23.214 -1.618
211 HA3 GLY 108 HA3 GLY 108 17.152 23.641 -2.996
212 H SER 109 H SER 109 16.652 22.223 -4.550
213 HA SER 109 HA SER 109 15.713 19.602 -4.318
214 HB2 SER 109 HB2 SER 109 17.376 20.724 -6.594
215 HB3 SER 109 HB3 SER 109 16.240 19.373 -6.684
216 HG SER 109 HG SER 109 14.544 20.822 -6.231
217 H HIS 110 H HIS 110 19.141 20.623 -4.172
218 HA HIS 110 HA HIS 110 20.174 17.967 -4.672
219 HB2 HIS 110 HB2 HIS 110 21.315 20.285 -4.955
220 HB3 HIS 110 HB3 HIS 110 21.638 20.194 -3.223
221 HD1 HIS 110 HD1 HIS 110 24.238 20.305 -4.479
222 HD2 HIS 110 HD2 HIS 110 22.006 16.740 -4.594
223 HE1 HIS 110 HE1 HIS 110 25.887 18.437 -5.014
224 H LEU 111 H LEU 111 19.199 19.753 -1.781
225 HA LEU 111 HA LEU 111 20.209 17.848 0.187
226 HB2 LEU 111 HB2 LEU 111 19.579 20.344 0.417
227 HB3 LEU 111 HB3 LEU 111 17.908 19.813 0.504
228 HG LEU 111 HG LEU 111 20.167 19.073 2.427
229 HD11 LEU 111 HD11 LEU 111 19.439 21.427 2.558
230 HD12 LEU 111 HD12 LEU 111 18.913 20.527 3.995
231 HD13 LEU 111 HD13 LEU 111 17.747 20.895 2.705
232 HD21 LEU 111 HD21 LEU 111 18.552 17.258 2.518
233 HD22 LEU 111 HD22 LEU 111 17.193 18.417 2.572
234 HD23 LEU 111 HD23 LEU 111 18.326 18.269 3.933
235 H VAL 112 H VAL 112 17.052 18.436 -1.427
236 HA VAL 112 HA VAL 112 15.648 16.235 -0.267
237 HB VAL 112 HB VAL 112 15.175 17.539 -2.974
238 HG11 VAL 112 HG11 VAL 112 13.989 15.380 -2.824
239 HG12 VAL 112 HG12 VAL 112 13.362 15.816 -1.215
240 HG13 VAL 112 HG13 VAL 112 12.843 16.711 -2.667
241 HG21 VAL 112 HG21 VAL 112 13.424 18.813 -1.758
242 HG22 VAL 112 HG22 VAL 112 13.968 18.085 -0.225
243 HG23 VAL 112 HG23 VAL 112 15.029 19.180 -1.131
244 H GLU 113 H GLU 113 17.522 16.372 -3.359
245 HA GLU 113 HA GLU 113 17.171 13.658 -4.080
246 HB2 GLU 113 HB2 GLU 113 18.174 15.513 -5.472
247 HB3 GLU 113 HB3 GLU 113 19.633 15.406 -4.494
248 HG2 GLU 113 HG2 GLU 113 20.110 14.198 -6.444
249 HG3 GLU 113 HG3 GLU 113 19.824 12.972 -5.229
250 H ALA 114 H ALA 114 19.729 15.113 -1.974
251 HA ALA 114 HA ALA 114 21.095 12.671 -1.487
252 HB1 ALA 114 HB1 ALA 114 20.946 15.206 0.191
253 HB2 ALA 114 HB2 ALA 114 22.202 13.944 0.287
254 HB3 ALA 114 HB3 ALA 114 22.046 14.921 -1.181
255 H LEU 115 H LEU 115 18.387 14.186 0.373
256 HA LEU 115 HA LEU 115 18.557 12.165 2.434
257 HB2 LEU 115 HB2 LEU 115 16.844 13.188 3.537
258 HB3 LEU 115 HB3 LEU 115 17.736 14.474 2.763
259 HG LEU 115 HG LEU 115 15.815 14.177 0.901
260 HD11 LEU 115 HD11 LEU 115 13.630 13.750 1.972
261 HD12 LEU 115 HD12 LEU 115 14.450 13.322 3.481
262 HD13 LEU 115 HD13 LEU 115 14.642 12.300 2.040
263 HD21 LEU 115 HD21 LEU 115 16.334 16.224 2.138
264 HD22 LEU 115 HD22 LEU 115 15.395 15.638 3.525
265 HD23 LEU 115 HD23 LEU 115 14.595 15.983 1.974
266 H TYR 116 H TYR 116 16.649 12.436 -0.557
267 HA TYR 116 HA TYR 116 15.113 10.022 -0.127
268 HB2 TYR 116 HB2 TYR 116 15.785 11.770 -2.487
269 HB3 TYR 116 HB3 TYR 116 15.178 10.151 -2.777
270 HD1 TYR 116 HD1 TYR 116 14.297 13.038 -0.500
271 HD2 TYR 116 HD2 TYR 116 12.915 9.912 -3.106
272 HE1 TYR 116 HE1 TYR 116 11.956 13.773 -0.115
273 HE2 TYR 116 HE2 TYR 116 10.554 10.645 -2.727
274 HH TYR 116 HH TYR 116 9.163 12.129 -1.643
275 H LEU 117 H LEU 117 18.317 10.623 -1.668
276 HA LEU 117 HA LEU 117 18.666 7.909 -2.455
277 HB2 LEU 117 HB2 LEU 117 20.595 10.209 -1.981
278 HB3 LEU 117 HB3 LEU 117 21.170 8.619 -2.450
279 HG LEU 117 HG LEU 117 19.153 10.170 -4.126
280 HD11 LEU 117 HD11 LEU 117 21.293 11.394 -3.950
281 HD12 LEU 117 HD12 LEU 117 21.061 10.728 -5.569
282 HD13 LEU 117 HD13 LEU 117 22.179 9.932 -4.439
283 HD21 LEU 117 HD21 LEU 117 19.152 7.747 -4.581
284 HD22 LEU 117 HD22 LEU 117 20.917 7.764 -4.744
285 HD23 LEU 117 HD23 LEU 117 19.890 8.634 -5.908
286 H VAL 118 H VAL 118 19.721 9.573 0.577
287 HA VAL 118 HA VAL 118 21.095 7.230 1.538
288 HB VAL 118 HB VAL 118 21.482 9.616 2.285
289 HG11 VAL 118 HG11 VAL 118 20.319 10.401 4.269
290 HG12 VAL 118 HG12 VAL 118 19.175 10.203 2.930
291 HG13 VAL 118 HG13 VAL 118 19.219 9.018 4.239
292 HG21 VAL 118 HG21 VAL 118 21.264 7.417 4.368
293 HG22 VAL 118 HG22 VAL 118 22.635 7.728 3.280
294 HG23 VAL 118 HG23 VAL 118 22.199 8.912 4.528
295 H CYS 119 H CYS 119 17.720 8.258 1.854
296 HA CYS 119 HA CYS 119 17.059 5.966 3.592
297 HB2 CYS 119 HB2 CYS 119 15.548 8.331 2.491
298 HB3 CYS 119 HB3 CYS 119 14.705 6.983 3.212
299 H GLY 120 H GLY 120 17.602 6.123 0.307
300 HA2 GLY 120 HA2 GLY 120 17.248 4.623 -1.379
301 HA3 GLY 120 HA3 GLY 120 16.798 3.460 -0.136
302 H GLU 121 H GLU 121 14.680 2.919 0.123
303 HA GLU 121 HA GLU 121 12.762 3.612 -1.982
304 HB2 GLU 121 HB2 GLU 121 12.542 1.839 0.481
305 HB3 GLU 121 HB3 GLU 121 11.310 1.988 -0.780
306 HG2 GLU 121 HG2 GLU 121 12.933 1.166 -2.473
307 HG3 GLU 121 HG3 GLU 121 14.140 0.942 -1.200
308 H ARG 122 H ARG 122 13.419 4.879 1.179
309 HA ARG 122 HA ARG 122 10.677 6.010 1.513
310 HB2 ARG 122 HB2 ARG 122 13.068 5.681 3.332
311 HB3 ARG 122 HB3 ARG 122 11.774 6.823 3.722
312 HG2 ARG 122 HG2 ARG 122 10.127 5.052 3.763
313 HG3 ARG 122 HG3 ARG 122 11.308 3.859 3.172
314 HD2 ARG 122 HD2 ARG 122 12.639 4.066 5.186
315 HD3 ARG 122 HD3 ARG 122 11.656 5.420 5.761
316 HE ARG 122 HE ARG 122 9.955 3.165 5.369
317 HH11 ARG 122 HH11 ARG 122 12.554 4.136 7.536
318 HH12 ARG 122 HH12 ARG 122 11.878 3.249 8.874
319 HH21 ARG 122 HH21 ARG 122 9.172 2.031 7.124
320 HH22 ARG 122 HH22 ARG 122 10.019 2.074 8.639
321 H GLY 123 H GLY 123 10.172 8.058 1.462
322 HA2 GLY 123 HA2 GLY 123 12.170 10.146 0.649
323 HA3 GLY 123 HA3 GLY 123 10.463 10.139 0.205
324 H PHE 124 H PHE 124 10.323 12.309 1.124
325 HA PHE 124 HA PHE 124 10.654 12.888 3.920
326 HB2 PHE 124 HB2 PHE 124 8.839 14.006 1.758
327 HB3 PHE 124 HB3 PHE 124 8.737 14.557 3.414
328 HD1 PHE 124 HD1 PHE 124 11.202 15.148 4.490
329 HD2 PHE 124 HD2 PHE 124 9.981 15.505 0.366
330 HE1 PHE 124 HE1 PHE 124 12.798 17.021 4.182
331 HE2 PHE 124 HE2 PHE 124 11.586 17.378 0.060
332 HZ PHE 124 HZ PHE 124 12.965 18.162 1.983
333 H PHE 125 H PHE 125 9.465 12.407 5.679
334 HA PHE 125 HA PHE 125 6.974 10.816 5.436
335 HB2 PHE 125 HB2 PHE 125 8.904 11.497 7.640
336 HB3 PHE 125 HB3 PHE 125 7.239 11.173 8.073
337 HD1 PHE 125 HD1 PHE 125 9.768 9.605 5.717
338 HD2 PHE 125 HD2 PHE 125 6.784 9.023 8.777
339 HE1 PHE 125 HE1 PHE 125 10.138 7.169 5.618
340 HE2 PHE 125 HE2 PHE 125 7.170 6.565 8.678
341 HZ PHE 125 HZ PHE 125 8.854 5.643 7.101
342 H TYR 126 H TYR 126 7.915 14.069 6.134
343 HA TYR 126 HA TYR 126 6.941 15.996 6.690
344 HB2 TYR 126 HB2 TYR 126 4.347 14.827 5.664
345 HB3 TYR 126 HB3 TYR 126 4.698 16.520 5.937
346 HD1 TYR 126 HD1 TYR 126 6.547 17.664 4.580
347 HD2 TYR 126 HD2 TYR 126 4.954 13.775 3.583
348 HE1 TYR 126 HE1 TYR 126 7.387 17.916 2.249
349 HE2 TYR 126 HE2 TYR 126 5.792 14.033 1.254
350 HH TYR 126 HH TYR 126 7.519 16.982 0.158
351 H THR 127 H THR 127 5.319 13.203 8.110
352 HA THR 127 HA THR 127 4.261 14.622 10.423
353 HB THR 127 HB THR 127 3.970 12.277 11.306
354 HG1 THR 127 HG1 THR 127 4.346 10.599 9.856
355 HG21 THR 127 HG21 THR 127 2.185 13.395 10.001
356 HG22 THR 127 HG22 THR 127 2.212 11.642 9.736
357 HG23 THR 127 HG23 THR 127 2.877 12.729 8.500
358 HA PRO 128 HA PRO 128 7.745 14.733 13.103
359 HB2 PRO 128 HB2 PRO 128 6.185 13.143 15.141
360 HB3 PRO 128 HB3 PRO 128 7.113 14.663 15.367
361 HG2 PRO 128 HG2 PRO 128 4.426 14.761 15.165
362 HG3 PRO 128 HG3 PRO 128 5.411 15.931 14.226
363 HD2 PRO 128 HD2 PRO 128 4.174 13.334 13.263
364 HD3 PRO 128 HD3 PRO 128 4.131 14.956 12.508
365 H LYS 129 H LYS 129 9.449 13.607 14.139
366 HA LYS 129 HA LYS 129 10.387 11.176 13.008
367 HB2 LYS 129 HB2 LYS 129 11.778 12.969 13.982
368 HB3 LYS 129 HB3 LYS 129 11.103 12.655 15.578
369 HG2 LYS 129 HG2 LYS 129 12.165 10.374 15.552
370 HG3 LYS 129 HG3 LYS 129 12.880 10.768 13.971
371 HD2 LYS 129 HD2 LYS 129 14.060 12.709 15.014
372 HD3 LYS 129 HD3 LYS 129 13.270 12.360 16.553
373 HE2 LYS 129 HE2 LYS 129 15.520 11.558 16.672
374 HE3 LYS 129 HE3 LYS 129 14.430 10.168 16.668
375 HZ1 LYS 129 HZ1 LYS 129 16.396 9.964 15.168
376 HZ2 LYS 129 HZ2 LYS 129 15.775 11.160 14.220
377 HZ3 LYS 129 HZ3 LYS 129 14.982 9.726 14.408
378 H THR 130 H THR 130 10.149 9.095 13.487
379 HA THR 130 HA THR 130 9.192 8.262 16.201
380 HB THR 130 HB THR 130 7.970 6.391 15.247
381 HG1 THR 130 HG1 THR 130 7.610 6.251 13.082
382 HG21 THR 130 HG21 THR 130 6.036 7.582 14.392
383 HG22 THR 130 HG22 THR 130 7.020 9.003 14.000
384 HG23 THR 130 HG23 THR 130 6.768 8.537 15.691
385 H ARG 131 H ARG 131 11.594 7.877 13.760
386 HA ARG 131 HA ARG 131 12.883 5.773 15.442
387 HB2 ARG 131 HB2 ARG 131 12.131 4.954 13.151
388 HB3 ARG 131 HB3 ARG 131 13.299 6.085 12.454
389 HG2 ARG 131 HG2 ARG 131 15.099 4.949 13.855
390 HG3 ARG 131 HG3 ARG 131 13.873 3.769 14.354
391 HD2 ARG 131 HD2 ARG 131 13.531 3.239 11.885
392 HD3 ARG 131 HD3 ARG 131 14.920 4.297 11.550
393 HE ARG 131 HE ARG 131 15.511 2.263 13.537
394 HH11 ARG 131 HH21 ARG 131 15.408 2.749 10.042
395 HH12 ARG 131 HH22 ARG 131 16.406 1.345 9.760
396 HH21 ARG 131 HH11 ARG 131 16.828 0.549 13.070
397 HH22 ARG 131 HH12 ARG 131 17.214 0.168 11.419
Start of MODEL 5
1 H1 GLY 1 H1 GLY 1 14.021 25.341 11.932
2 H2 GLY 1 H2 GLY 1 15.538 25.299 11.317
3 H3 GLY 1 H3 GLY 1 15.025 24.099 12.313
4 HA2 GLY 1 HA2 GLY 1 13.367 23.401 10.677
5 HA3 GLY 1 HA3 GLY 1 13.982 24.670 9.610
6 H ILE 2 H ILE 2 14.142 22.600 8.271
7 HA ILE 2 HA ILE 2 16.452 20.853 8.857
8 HB ILE 2 HB ILE 2 14.278 20.854 6.744
9 HG12 ILE 2 HG12 ILE 2 14.988 18.914 8.993
10 HG13 ILE 2 HG13 ILE 2 13.734 20.153 9.093
11 HG21 ILE 2 HG21 ILE 2 15.209 18.658 5.952
12 HG22 ILE 2 HG22 ILE 2 16.262 20.012 5.587
13 HG23 ILE 2 HG23 ILE 2 16.644 18.944 6.958
14 HD11 ILE 2 HD11 ILE 2 13.707 17.701 7.294
15 HD12 ILE 2 HD12 ILE 2 12.649 18.078 8.661
16 HD13 ILE 2 HD13 ILE 2 12.538 19.043 7.176
17 H VAL 3 H VAL 3 15.576 23.210 6.292
18 HA VAL 3 HA VAL 3 17.710 22.598 4.586
19 HB VAL 3 HB VAL 3 16.307 25.279 4.839
20 HG11 VAL 3 HG11 VAL 3 17.898 24.042 2.544
21 HG12 VAL 3 HG12 VAL 3 16.872 25.489 2.408
22 HG13 VAL 3 HG13 VAL 3 18.299 25.521 3.439
23 HG21 VAL 3 HG21 VAL 3 14.874 24.395 2.992
24 HG22 VAL 3 HG22 VAL 3 15.682 22.822 3.135
25 HG23 VAL 3 HG23 VAL 3 14.685 23.442 4.468
26 H GLU 4 H GLU 4 17.730 25.031 7.192
27 HA GLU 4 HA GLU 4 20.251 26.193 6.645
28 HB2 GLU 4 HB2 GLU 4 20.184 27.008 8.902
29 HB3 GLU 4 HB3 GLU 4 18.559 27.062 8.213
30 HG2 GLU 4 HG2 GLU 4 18.088 24.853 9.406
31 HG3 GLU 4 HG3 GLU 4 19.632 25.049 10.232
32 H GLN 5 H GLN 5 19.574 23.049 8.103
33 HA GLN 5 HA GLN 5 22.092 22.724 9.470
34 HB2 GLN 5 HB2 GLN 5 20.205 20.577 8.440
35 HB3 GLN 5 HB3 GLN 5 21.466 20.390 9.662
36 HG2 GLN 5 HG2 GLN 5 20.249 21.984 11.155
37 HG3 GLN 5 HG3 GLN 5 18.980 22.151 9.947
38 HE21 GLN 5 HE21 GLN 5 17.290 21.328 11.203
39 HE22 GLN 5 HE22 GLN 5 17.271 19.651 11.768
40 H CYS 6 H CYS 6 21.050 22.097 6.152
41 HA CYS 6 HA CYS 6 23.738 20.943 5.487
42 HB2 CYS 6 HB2 CYS 6 21.115 20.762 4.009
43 HB3 CYS 6 HB3 CYS 6 22.619 20.001 3.545
44 H CYS 7 H CYS 7 21.587 23.673 4.752
45 HA CYS 7 HA CYS 7 22.986 24.294 2.270
46 HB2 CYS 7 HB2 CYS 7 20.562 24.433 2.532
47 HB3 CYS 7 HB3 CYS 7 20.753 25.720 3.723
48 H THR 8 H THR 8 22.600 26.030 5.436
49 HA THR 8 HA THR 8 24.816 27.871 4.680
50 HB THR 8 HB THR 8 24.206 29.049 6.805
51 HG1 THR 8 HG1 THR 8 22.208 28.550 7.693
52 HG21 THR 8 HG21 THR 8 23.364 29.796 4.591
53 HG22 THR 8 HG22 THR 8 22.184 30.095 5.881
54 HG23 THR 8 HG23 THR 8 21.949 28.738 4.767
55 H SER 9 H SER 9 23.987 25.410 7.117
56 HA SER 9 HA SER 9 26.851 25.240 7.953
57 HB2 SER 9 HB2 SER 9 24.962 25.277 9.637
58 HB3 SER 9 HB3 SER 9 24.482 23.678 9.034
59 HG SER 9 HG SER 9 25.941 23.603 10.855
60 H ILE 10 H ILE 10 27.208 22.592 8.373
61 HA ILE 10 HA ILE 10 26.558 21.193 5.816
62 HB ILE 10 HB ILE 10 28.623 19.852 6.059
63 HG12 ILE 10 HG12 ILE 10 30.625 20.909 7.072
64 HG13 ILE 10 HG13 ILE 10 29.604 22.065 7.911
65 HG21 ILE 10 HG21 ILE 10 29.981 21.413 4.836
66 HG22 ILE 10 HG22 ILE 10 28.286 21.671 4.400
67 HG23 ILE 10 HG23 ILE 10 29.094 22.792 5.517
68 HD11 ILE 10 HD11 ILE 10 29.361 19.048 8.304
69 HD12 ILE 10 HD12 ILE 10 30.458 20.072 9.244
70 HD13 ILE 10 HD13 ILE 10 28.725 20.347 9.345
71 H CYS 11 H CYS 11 26.230 18.944 5.888
72 HA CYS 11 HA CYS 11 25.428 17.888 8.546
73 HB2 CYS 11 HB2 CYS 11 23.238 17.347 7.787
74 HB3 CYS 11 HB3 CYS 11 23.521 19.043 7.477
75 H SER 12 H SER 12 25.062 15.653 8.658
76 HA SER 12 HA SER 12 26.754 14.009 6.831
77 HB2 SER 12 HB2 SER 12 25.809 13.681 9.699
78 HB3 SER 12 HB3 SER 12 26.679 12.426 8.803
79 HG SER 12 HG SER 12 28.029 13.833 10.093
80 H LEU 13 H LEU 13 26.158 11.792 6.378
81 HA LEU 13 HA LEU 13 23.610 11.436 5.179
82 HB2 LEU 13 HB2 LEU 13 25.494 9.291 6.219
83 HB3 LEU 13 HB3 LEU 13 24.230 9.091 5.015
84 HG LEU 13 HG LEU 13 26.796 10.691 4.707
85 HD11 LEU 13 HD11 LEU 13 27.346 9.007 3.022
86 HD12 LEU 13 HD12 LEU 13 25.780 8.196 3.277
87 HD13 LEU 13 HD13 LEU 13 26.998 8.215 4.568
88 HD21 LEU 13 HD21 LEU 13 26.156 11.017 2.348
89 HD22 LEU 13 HD22 LEU 13 25.048 11.849 3.445
90 HD23 LEU 13 HD23 LEU 13 24.559 10.314 2.676
91 H TYR 14 H TYR 14 24.637 10.545 8.506
92 HA TYR 14 HA TYR 14 22.122 9.244 9.120
93 HB2 TYR 14 HB2 TYR 14 22.931 9.262 11.441
94 HB3 TYR 14 HB3 TYR 14 24.055 8.567 10.291
95 HD1 TYR 14 HD2 TYR 14 23.353 11.621 12.338
96 HD2 TYR 14 HD1 TYR 14 26.278 9.404 10.069
97 HE1 TYR 14 HE2 TYR 14 25.148 13.118 13.190
98 HE2 TYR 14 HE1 TYR 14 28.072 10.898 10.926
99 HH TYR 14 HH TYR 14 27.383 13.622 13.157
100 H GLN 15 H GLN 15 22.943 12.606 8.949
101 HA GLN 15 HA GLN 15 20.621 13.450 10.605
102 HB2 GLN 15 HB2 GLN 15 22.595 15.089 8.972
103 HB3 GLN 15 HB3 GLN 15 21.310 15.725 9.990
104 HG2 GLN 15 HG2 GLN 15 22.349 14.729 11.996
105 HG3 GLN 15 HG3 GLN 15 23.633 14.030 11.003
106 HE21 GLN 15 HE21 GLN 15 22.771 16.827 12.818
107 HE22 GLN 15 HE22 GLN 15 24.067 17.841 12.206
108 H LEU 16 H LEU 16 21.664 13.266 7.176
109 HA LEU 16 HA LEU 16 19.247 14.257 5.994
110 HB2 LEU 16 HB2 LEU 16 21.440 12.386 5.097
111 HB3 LEU 16 HB3 LEU 16 20.098 12.797 4.040
112 HG LEU 16 HG LEU 16 21.761 14.998 5.321
113 HD11 LEU 16 HD11 LEU 16 23.387 13.565 4.255
114 HD12 LEU 16 HD12 LEU 16 23.134 14.992 3.247
115 HD13 LEU 16 HD13 LEU 16 22.392 13.438 2.789
116 HD21 LEU 16 HD21 LEU 16 21.076 16.242 3.309
117 HD22 LEU 16 HD22 LEU 16 19.658 15.630 4.167
118 HD23 LEU 16 HD23 LEU 16 20.211 14.817 2.695
119 H GLU 17 H GLU 17 20.158 11.018 7.164
120 HA GLU 17 HA GLU 17 17.821 9.616 6.413
121 HB2 GLU 17 HB2 GLU 17 20.082 8.815 7.487
122 HB3 GLU 17 HB3 GLU 17 19.276 9.112 9.023
123 HG2 GLU 17 HG2 GLU 17 17.438 7.549 8.277
124 HG3 GLU 17 HG3 GLU 17 18.333 7.275 6.778
125 H ASN 18 H ASN 18 18.270 11.904 9.114
126 HA ASN 18 HA ASN 18 15.872 11.062 10.532
127 HB2 ASN 18 HB2 ASN 18 17.918 12.162 11.550
128 HB3 ASN 18 HB3 ASN 18 17.421 13.666 10.769
129 HD21 ASN 18 HD21 ASN 18 17.189 14.709 12.832
130 HD22 ASN 18 HD22 ASN 18 15.834 14.306 13.878
131 H TYR 19 H TYR 19 16.526 13.368 7.900
132 HA TYR 19 HA TYR 19 14.003 14.769 8.129
133 HB2 TYR 19 HB2 TYR 19 15.732 14.453 5.677
134 HB3 TYR 19 HB3 TYR 19 14.598 15.757 6.024
135 HD1 TYR 19 HD1 TYR 19 15.602 16.213 9.013
136 HD2 TYR 19 HD2 TYR 19 17.580 15.830 5.196
137 HE1 TYR 19 HE1 TYR 19 17.576 17.415 9.917
138 HE2 TYR 19 HE2 TYR 19 19.579 16.993 6.135
139 HH TYR 19 HH TYR 19 19.721 18.131 9.513
140 H CYS 20 H CYS 20 14.824 11.653 6.902
141 HA CYS 20 HA CYS 20 12.586 11.262 5.096
142 HB2 CYS 20 HB2 CYS 20 14.318 9.251 6.573
143 HB3 CYS 20 HB3 CYS 20 13.342 8.940 5.161
144 H ASN 21 H ASN 21 12.798 11.382 8.522
145 HA ASN 21 HA ASN 21 10.951 9.253 9.164
146 HB2 ASN 21 HB2 ASN 21 13.020 9.979 10.447
147 HB3 ASN 21 HB3 ASN 21 12.133 11.421 10.939
148 HD21 ASN 21 HD21 ASN 21 12.622 10.621 13.124
149 HD22 ASN 21 HD22 ASN 21 11.571 9.386 13.811
150 H GLY 22 H GLY 22 9.600 10.897 7.449
151 HA2 GLY 22 HA2 GLY 22 7.109 11.480 8.672
152 HA3 GLY 22 HA3 GLY 22 8.006 12.996 8.528
153 H1 PHE 101 H1 PHE 101 33.944 9.019 5.536
154 H2 PHE 101 H2 PHE 101 32.717 8.048 5.062
155 H3 PHE 101 H3 PHE 101 32.469 9.172 6.228
156 HA PHE 101 HA PHE 101 33.119 9.745 3.423
157 HB2 PHE 101 HB2 PHE 101 30.827 10.629 3.219
158 HB3 PHE 101 HB3 PHE 101 30.862 8.914 3.532
159 HD1 PHE 101 HD1 PHE 101 30.185 12.253 5.102
160 HD2 PHE 101 HD2 PHE 101 29.794 7.963 5.488
161 HE1 PHE 101 HE1 PHE 101 28.720 12.552 7.070
162 HE2 PHE 101 HE2 PHE 101 28.302 8.275 7.432
163 HZ PHE 101 HZ PHE 101 27.780 10.557 8.250
164 H VAL 102 H VAL 102 32.700 12.060 2.859
165 HA VAL 102 HA VAL 102 33.529 13.953 5.034
166 HB VAL 102 HB VAL 102 34.143 14.126 2.058
167 HG11 VAL 102 HG11 VAL 102 34.962 15.920 4.378
168 HG12 VAL 102 HG12 VAL 102 35.631 16.003 2.733
169 HG13 VAL 102 HG13 VAL 102 33.933 16.370 2.989
170 HG21 VAL 102 HG21 VAL 102 35.956 13.539 4.442
171 HG22 VAL 102 HG22 VAL 102 35.528 12.400 3.144
172 HG23 VAL 102 HG23 VAL 102 36.503 13.821 2.780
173 H ASN 103 H ASN 103 32.455 15.986 5.086
174 HA ASN 103 HA ASN 103 29.678 15.881 4.131
175 HB2 ASN 103 HB2 ASN 103 31.117 17.882 5.931
176 HB3 ASN 103 HB3 ASN 103 29.373 17.782 5.652
177 HD21 ASN 103 HD21 ASN 103 28.198 15.896 6.473
178 HD22 ASN 103 HD22 ASN 103 28.856 15.052 7.867
179 H GLN 104 H GLN 104 28.607 17.571 3.036
180 HA GLN 104 HA GLN 104 30.153 19.754 1.755
181 HB2 GLN 104 HB2 GLN 104 28.234 17.980 0.163
182 HB3 GLN 104 HB3 GLN 104 29.098 19.399 -0.400
183 HG2 GLN 104 HG2 GLN 104 30.303 17.652 -1.336
184 HG3 GLN 104 HG3 GLN 104 31.279 18.172 0.034
185 HE21 GLN 104 HE21 GLN 104 32.350 16.084 0.154
186 HE22 GLN 104 HE22 GLN 104 31.461 14.725 0.857
187 H HIS 105 H HIS 105 28.683 21.438 0.851
188 HA HIS 105 HA HIS 105 26.263 21.830 2.455
189 HB2 HIS 105 HB2 HIS 105 27.467 23.457 0.199
190 HB3 HIS 105 HB3 HIS 105 25.988 23.877 1.050
191 HD1 HIS 105 HD1 HIS 105 26.472 23.998 3.962
192 HD2 HIS 105 HD2 HIS 105 29.536 24.716 1.151
193 HE1 HIS 105 HE1 HIS 105 28.231 25.408 5.149
194 H LEU 106 H LEU 106 24.207 21.576 1.823
195 HA LEU 106 HA LEU 106 23.473 20.726 -0.935
196 HB2 LEU 106 HB2 LEU 106 22.693 19.243 1.602
197 HB3 LEU 106 HB3 LEU 106 22.128 18.880 -0.009
198 HG LEU 106 HG LEU 106 25.082 18.675 0.755
199 HD11 LEU 106 HD11 LEU 106 24.644 16.256 1.070
200 HD12 LEU 106 HD12 LEU 106 22.899 16.598 0.995
201 HD13 LEU 106 HD13 LEU 106 23.887 17.285 2.297
202 HD21 LEU 106 HD21 LEU 106 23.414 17.396 -1.452
203 HD22 LEU 106 HD22 LEU 106 25.136 17.103 -1.144
204 HD23 LEU 106 HD23 LEU 106 24.595 18.708 -1.654
205 H CYS 107 H CYS 107 21.710 21.903 -1.547
206 HA CYS 107 HA CYS 107 19.856 22.978 0.530
207 HB2 CYS 107 HB2 CYS 107 21.823 24.519 -0.271
208 HB3 CYS 107 HB3 CYS 107 20.866 24.693 -1.734
209 H GLY 108 H GLY 108 17.731 23.364 -0.164
210 HA2 GLY 108 HA2 GLY 108 15.809 22.938 -1.357
211 HA3 GLY 108 HA3 GLY 108 16.723 23.498 -2.751
212 H SER 109 H SER 109 16.560 22.121 -4.402
213 HA SER 109 HA SER 109 15.676 19.431 -4.324
214 HB2 SER 109 HB2 SER 109 16.603 19.352 -6.667
215 HB3 SER 109 HB3 SER 109 15.486 20.693 -6.350
216 HG SER 109 HG SER 109 17.376 21.383 -7.478
217 H HIS 110 H HIS 110 19.004 20.683 -3.976
218 HA HIS 110 HA HIS 110 20.206 18.099 -4.470
219 HB2 HIS 110 HB2 HIS 110 21.224 20.498 -4.672
220 HB3 HIS 110 HB3 HIS 110 21.520 20.351 -2.939
221 HD1 HIS 110 HD1 HIS 110 24.152 20.622 -3.972
222 HD2 HIS 110 HD2 HIS 110 22.058 17.044 -4.714
223 HE1 HIS 110 HE1 HIS 110 25.895 18.904 -4.686
224 H LEU 111 H LEU 111 18.995 19.757 -1.605
225 HA LEU 111 HA LEU 111 20.037 17.881 0.369
226 HB2 LEU 111 HB2 LEU 111 19.267 20.351 0.604
227 HB3 LEU 111 HB3 LEU 111 17.629 19.723 0.658
228 HG LEU 111 HG LEU 111 19.891 19.029 2.591
229 HD11 LEU 111 HD11 LEU 111 18.657 20.454 4.168
230 HD12 LEU 111 HD12 LEU 111 17.445 20.811 2.911
231 HD13 LEU 111 HD13 LEU 111 19.117 21.378 2.732
232 HD21 LEU 111 HD21 LEU 111 16.936 18.304 2.660
233 HD22 LEU 111 HD22 LEU 111 18.023 18.197 4.064
234 HD23 LEU 111 HD23 LEU 111 18.324 17.191 2.656
235 H VAL 112 H VAL 112 16.923 18.316 -1.376
236 HA VAL 112 HA VAL 112 15.610 15.985 -0.340
237 HB VAL 112 HB VAL 112 15.233 17.382 -3.013
238 HG11 VAL 112 HG11 VAL 112 13.487 15.325 -1.593
239 HG12 VAL 112 HG12 VAL 112 12.983 16.297 -2.997
240 HG13 VAL 112 HG13 VAL 112 14.290 15.121 -3.169
241 HG21 VAL 112 HG21 VAL 112 13.278 18.402 -1.899
242 HG22 VAL 112 HG22 VAL 112 13.692 17.562 -0.385
243 HG23 VAL 112 HG23 VAL 112 14.758 18.815 -1.034
244 H GLU 113 H GLU 113 17.608 16.348 -3.351
245 HA GLU 113 HA GLU 113 17.520 13.618 -4.091
246 HB2 GLU 113 HB2 GLU 113 18.325 15.469 -5.510
247 HB3 GLU 113 HB3 GLU 113 19.768 15.627 -4.497
248 HG2 GLU 113 HG2 GLU 113 20.514 13.387 -5.133
249 HG3 GLU 113 HG3 GLU 113 18.988 13.075 -5.967
250 H ALA 114 H ALA 114 19.792 15.237 -1.800
251 HA ALA 114 HA ALA 114 21.351 12.894 -1.324
252 HB1 ALA 114 HB1 ALA 114 20.907 15.349 0.407
253 HB2 ALA 114 HB2 ALA 114 22.218 14.159 0.579
254 HB3 ALA 114 HB3 ALA 114 22.132 15.164 -0.878
255 H LEU 115 H LEU 115 18.402 14.093 0.439
256 HA LEU 115 HA LEU 115 18.595 11.870 2.327
257 HB2 LEU 115 HB2 LEU 115 16.615 12.571 3.318
258 HB3 LEU 115 HB3 LEU 115 17.584 13.977 2.942
259 HG LEU 115 HG LEU 115 16.031 14.164 0.829
260 HD11 LEU 115 HD11 LEU 115 14.774 12.034 1.088
261 HD12 LEU 115 HD12 LEU 115 13.707 13.422 1.252
262 HD13 LEU 115 HD13 LEU 115 14.245 12.542 2.698
263 HD21 LEU 115 HD21 LEU 115 16.138 15.746 2.730
264 HD22 LEU 115 HD22 LEU 115 14.900 14.778 3.565
265 HD23 LEU 115 HD23 LEU 115 14.520 15.588 2.038
266 H TYR 116 H TYR 116 17.035 12.243 -0.845
267 HA TYR 116 HA TYR 116 15.773 9.624 -0.792
268 HB2 TYR 116 HB2 TYR 116 16.422 11.684 -2.863
269 HB3 TYR 116 HB3 TYR 116 16.227 10.034 -3.409
270 HD1 TYR 116 HD2 TYR 116 14.442 12.828 -1.684
271 HD2 TYR 116 HD1 TYR 116 14.106 8.924 -3.484
272 HE1 TYR 116 HE2 TYR 116 11.972 13.059 -1.720
273 HE2 TYR 116 HE1 TYR 116 11.628 9.157 -3.517
274 HH TYR 116 HH TYR 116 9.823 10.494 -2.998
275 H LEU 117 H LEU 117 19.093 10.689 -1.741
276 HA LEU 117 HA LEU 117 19.914 8.042 -2.542
277 HB2 LEU 117 HB2 LEU 117 21.426 10.514 -1.646
278 HB3 LEU 117 HB3 LEU 117 22.256 9.028 -2.059
279 HG LEU 117 HG LEU 117 20.356 10.388 -4.011
280 HD11 LEU 117 HD11 LEU 117 22.159 11.951 -3.437
281 HD12 LEU 117 HD12 LEU 117 22.364 11.338 -5.082
282 HD13 LEU 117 HD13 LEU 117 23.377 10.698 -3.765
283 HD21 LEU 117 HD21 LEU 117 20.871 8.022 -4.527
284 HD22 LEU 117 HD22 LEU 117 22.610 8.368 -4.405
285 HD23 LEU 117 HD23 LEU 117 21.633 9.110 -5.688
286 H VAL 118 H VAL 118 19.880 9.629 0.664
287 HA VAL 118 HA VAL 118 21.145 7.372 2.005
288 HB VAL 118 HB VAL 118 19.577 9.748 3.056
289 HG11 VAL 118 HG11 VAL 118 20.462 9.154 5.275
290 HG12 VAL 118 HG12 VAL 118 19.322 7.945 4.705
291 HG13 VAL 118 HG13 VAL 118 21.068 7.607 4.639
292 HG21 VAL 118 HG21 VAL 118 22.539 8.999 3.147
293 HG22 VAL 118 HG22 VAL 118 21.835 10.216 2.072
294 HG23 VAL 118 HG23 VAL 118 21.814 10.468 3.822
295 H CYS 119 H CYS 119 17.720 8.283 1.509
296 HA CYS 119 HA CYS 119 16.860 5.858 2.976
297 HB2 CYS 119 HB2 CYS 119 15.389 8.384 2.226
298 HB3 CYS 119 HB3 CYS 119 14.733 7.067 3.202
299 H GLY 120 H GLY 120 17.614 6.002 -0.030
300 HA2 GLY 120 HA2 GLY 120 17.093 4.721 -1.871
301 HA3 GLY 120 HA3 GLY 120 16.038 3.787 -0.810
302 H GLU 121 H GLU 121 14.491 3.458 -2.390
303 HA GLU 121 HA GLU 121 13.423 5.398 -4.137
304 HB2 GLU 121 HB2 GLU 121 11.748 3.745 -4.671
305 HB3 GLU 121 HB3 GLU 121 13.319 2.970 -4.485
306 HG2 GLU 121 HG2 GLU 121 12.648 2.238 -2.176
307 HG3 GLU 121 HG3 GLU 121 11.068 2.983 -2.416
308 H ARG 122 H ARG 122 12.722 5.079 -0.802
309 HA ARG 122 HA ARG 122 10.047 6.336 -0.880
310 HB2 ARG 122 HB2 ARG 122 11.967 5.457 1.305
311 HB3 ARG 122 HB3 ARG 122 10.576 6.454 1.676
312 HG2 ARG 122 HG2 ARG 122 10.272 3.815 0.191
313 HG3 ARG 122 HG3 ARG 122 10.314 3.938 1.952
314 HD2 ARG 122 HD2 ARG 122 8.413 5.594 1.842
315 HD3 ARG 122 HD3 ARG 122 8.312 5.269 0.108
316 HE ARG 122 HE ARG 122 7.320 3.218 0.527
317 HH11 ARG 122 HH21 ARG 122 8.575 4.404 3.595
318 HH12 ARG 122 HH22 ARG 122 7.854 3.087 4.480
319 HH21 ARG 122 HH11 ARG 122 6.377 1.616 1.760
320 HH22 ARG 122 HH12 ARG 122 6.581 1.615 3.487
321 H GLY 123 H GLY 123 13.296 7.324 0.268
322 HA2 GLY 123 HA2 GLY 123 14.154 9.459 0.742
323 HA3 GLY 123 HA3 GLY 123 12.888 10.157 -0.277
324 H PHE 124 H PHE 124 11.121 11.053 0.697
325 HA PHE 124 HA PHE 124 10.882 11.332 3.595
326 HB2 PHE 124 HB2 PHE 124 9.021 12.014 1.291
327 HB3 PHE 124 HB3 PHE 124 8.777 12.511 2.952
328 HD1 PHE 124 HD2 PHE 124 10.938 13.738 4.063
329 HD2 PHE 124 HD1 PHE 124 9.965 13.635 -0.138
330 HE1 PHE 124 HE2 PHE 124 12.208 15.835 3.718
331 HE2 PHE 124 HE1 PHE 124 11.247 15.741 -0.481
332 HZ PHE 124 HZ PHE 124 12.350 16.849 1.456
333 H PHE 125 H PHE 125 8.506 10.954 4.457
334 HA PHE 125 HA PHE 125 7.170 9.453 5.404
335 HB2 PHE 125 HB2 PHE 125 5.482 8.492 4.030
336 HB3 PHE 125 HB3 PHE 125 5.856 10.143 3.583
337 HD1 PHE 125 HD1 PHE 125 7.014 10.667 1.467
338 HD2 PHE 125 HD2 PHE 125 5.797 6.668 2.441
339 HE1 PHE 125 HE1 PHE 125 7.187 10.040 -0.940
340 HE2 PHE 125 HE2 PHE 125 5.913 6.041 0.033
341 HZ PHE 125 HZ PHE 125 6.626 7.729 -1.658
342 H TYR 126 H TYR 126 9.518 8.591 5.738
343 HA TYR 126 HA TYR 126 10.564 6.996 6.856
344 HB2 TYR 126 HB2 TYR 126 8.130 5.243 6.637
345 HB3 TYR 126 HB3 TYR 126 9.359 5.227 7.890
346 HD1 TYR 126 HD2 TYR 126 9.538 7.248 9.473
347 HD2 TYR 126 HD1 TYR 126 6.179 6.614 6.838
348 HE1 TYR 126 HE2 TYR 126 8.166 8.829 10.831
349 HE2 TYR 126 HE1 TYR 126 4.825 8.202 8.184
350 HH TYR 126 HH TYR 126 4.765 9.597 9.990
351 H THR 127 H THR 127 11.631 4.968 6.893
352 HA THR 127 HA THR 127 13.010 4.345 4.620
353 HB THR 127 HB THR 127 12.524 2.442 6.940
354 HG1 THR 127 HG1 THR 127 14.368 4.586 6.790
355 HG21 THR 127 HG21 THR 127 14.994 2.926 5.221
356 HG22 THR 127 HG22 THR 127 14.011 1.444 5.276
357 HG23 THR 127 HG23 THR 127 14.941 1.929 6.689
358 HA PRO 128 HA PRO 128 10.465 1.693 2.120
359 HB2 PRO 128 HB2 PRO 128 13.008 0.199 1.456
360 HB3 PRO 128 HB3 PRO 128 11.752 0.831 0.353
361 HG2 PRO 128 HG2 PRO 128 14.084 2.169 0.675
362 HG3 PRO 128 HG3 PRO 128 12.542 3.070 0.617
363 HD2 PRO 128 HD2 PRO 128 14.170 2.269 3.025
364 HD3 PRO 128 HD3 PRO 128 13.353 3.821 2.669
365 H LYS 129 H LYS 129 12.513 0.115 4.509
366 HA LYS 129 HA LYS 129 11.611 -2.574 4.187
367 HB2 LYS 129 HB2 LYS 129 13.655 -1.931 5.410
368 HB3 LYS 129 HB3 LYS 129 12.686 -1.117 6.638
369 HG2 LYS 129 HG2 LYS 129 13.492 -3.253 7.455
370 HG3 LYS 129 HG3 LYS 129 11.731 -3.266 7.357
371 HD2 LYS 129 HD2 LYS 129 11.848 -4.618 5.271
372 HD3 LYS 129 HD3 LYS 129 13.606 -4.472 5.273
373 HE2 LYS 129 HE2 LYS 129 12.984 -6.660 6.075
374 HE3 LYS 129 HE3 LYS 129 13.740 -5.741 7.381
375 HZ1 LYS 129 HZ1 LYS 129 11.697 -6.965 8.054
376 HZ2 LYS 129 HZ2 LYS 129 10.786 -6.035 7.061
377 HZ3 LYS 129 HZ3 LYS 129 11.561 -5.363 8.337
378 H THR 130 H THR 130 9.945 -3.711 4.950
379 HA THR 130 HA THR 130 8.004 -2.567 6.873
380 HB THR 130 HB THR 130 7.258 -2.000 4.565
381 HG1 THR 130 HG1 THR 130 5.171 -2.640 4.967
382 HG21 THR 130 HG21 THR 130 6.286 -3.714 3.132
383 HG22 THR 130 HG22 THR 130 6.799 -4.996 4.245
384 HG23 THR 130 HG23 THR 130 8.011 -4.040 3.353
385 H ARG 131 H ARG 131 6.245 -4.351 7.270
386 HA ARG 131 HA ARG 131 7.695 -6.556 8.538
387 HB2 ARG 131 HB2 ARG 131 5.935 -5.259 9.679
388 HB3 ARG 131 HB3 ARG 131 4.721 -5.867 8.555
389 HG2 ARG 131 HG2 ARG 131 6.422 -7.812 10.145
390 HG3 ARG 131 HG3 ARG 131 5.095 -6.972 10.941
391 HD2 ARG 131 HD2 ARG 131 3.450 -7.912 9.510
392 HD3 ARG 131 HD3 ARG 131 4.631 -8.554 8.386
393 HE ARG 131 HE ARG 131 3.798 -9.713 10.934
394 HH11 ARG 131 HH11 ARG 131 6.380 -9.811 8.499
395 HH12 ARG 131 HH12 ARG 131 6.822 -11.432 8.974
396 HH21 ARG 131 HH21 ARG 131 4.459 -11.753 11.433
397 HH22 ARG 131 HH22 ARG 131 5.789 -12.484 10.586
Start of MODEL 6
1 H1 GLY 1 H1 GLY 1 16.393 25.173 10.630
2 H2 GLY 1 H2 GLY 1 15.041 26.098 10.556
3 H3 GLY 1 H3 GLY 1 16.081 26.092 9.302
4 HA2 GLY 1 HA2 GLY 1 14.361 23.878 10.203
5 HA3 GLY 1 HA3 GLY 1 14.215 24.780 8.681
6 H ILE 2 H ILE 2 14.236 22.216 8.334
7 HA ILE 2 HA ILE 2 16.557 20.667 8.538
8 HB ILE 2 HB ILE 2 14.062 20.523 6.837
9 HG12 ILE 2 HG12 ILE 2 15.192 18.807 9.101
10 HG13 ILE 2 HG13 ILE 2 14.017 20.101 9.297
11 HG21 ILE 2 HG21 ILE 2 16.329 18.499 6.751
12 HG22 ILE 2 HG22 ILE 2 14.690 18.234 6.102
13 HG23 ILE 2 HG23 ILE 2 15.711 19.449 5.385
14 HD11 ILE 2 HD11 ILE 2 12.424 18.822 7.815
15 HD12 ILE 2 HD12 ILE 2 13.564 17.453 7.873
16 HD13 ILE 2 HD13 ILE 2 12.818 18.038 9.359
17 H VAL 3 H VAL 3 15.548 22.527 5.615
18 HA VAL 3 HA VAL 3 17.778 21.608 4.042
19 HB VAL 3 HB VAL 3 16.132 24.140 3.665
20 HG11 VAL 3 HG11 VAL 3 17.872 22.556 1.720
21 HG12 VAL 3 HG12 VAL 3 16.801 23.913 1.287
22 HG13 VAL 3 HG13 VAL 3 18.201 24.196 2.326
23 HG21 VAL 3 HG21 VAL 3 15.759 21.348 2.493
24 HG22 VAL 3 HG22 VAL 3 14.672 22.145 3.656
25 HG23 VAL 3 HG23 VAL 3 14.845 22.793 2.026
26 H GLU 4 H GLU 4 17.310 24.570 5.991
27 HA GLU 4 HA GLU 4 19.756 25.876 5.373
28 HB2 GLU 4 HB2 GLU 4 18.169 25.913 7.967
29 HB3 GLU 4 HB3 GLU 4 19.414 27.071 7.512
30 HG2 GLU 4 HG2 GLU 4 18.074 27.860 5.620
31 HG3 GLU 4 HG3 GLU 4 16.830 26.644 5.944
32 H GLN 5 H GLN 5 19.011 23.487 7.921
33 HA GLN 5 HA GLN 5 21.441 23.544 9.309
34 HB2 GLN 5 HB2 GLN 5 19.272 22.562 10.010
35 HB3 GLN 5 HB3 GLN 5 19.510 21.232 8.891
36 HG2 GLN 5 HG2 GLN 5 20.011 20.585 11.202
37 HG3 GLN 5 HG3 GLN 5 21.421 20.416 10.174
38 HE21 GLN 5 HE21 GLN 5 23.209 21.901 10.451
39 HE22 GLN 5 HE22 GLN 5 23.373 22.775 11.974
40 H CYS 6 H CYS 6 20.803 22.073 6.229
41 HA CYS 6 HA CYS 6 23.580 20.974 6.226
42 HB2 CYS 6 HB2 CYS 6 21.516 19.403 5.852
43 HB3 CYS 6 HB3 CYS 6 21.540 20.080 4.230
44 H CYS 7 H CYS 7 21.883 23.628 5.109
45 HA CYS 7 HA CYS 7 23.402 23.821 2.549
46 HB2 CYS 7 HB2 CYS 7 20.994 23.922 2.384
47 HB3 CYS 7 HB3 CYS 7 20.926 25.228 3.557
48 H THR 8 H THR 8 22.682 25.835 5.469
49 HA THR 8 HA THR 8 24.949 27.640 4.692
50 HB THR 8 HB THR 8 22.846 28.758 5.198
51 HG1 THR 8 HG1 THR 8 23.793 30.272 6.523
52 HG21 THR 8 HG21 THR 8 23.211 27.742 8.048
53 HG22 THR 8 HG22 THR 8 21.854 27.405 6.950
54 HG23 THR 8 HG23 THR 8 22.114 29.041 7.541
55 H SER 9 H SER 9 23.898 25.366 7.171
56 HA SER 9 HA SER 9 26.697 25.190 8.201
57 HB2 SER 9 HB2 SER 9 25.615 24.114 10.212
58 HB3 SER 9 HB3 SER 9 25.336 25.844 9.996
59 HG SER 9 HG SER 9 23.393 24.891 10.502
60 H ILE 10 H ILE 10 27.066 22.813 9.049
61 HA ILE 10 HA ILE 10 26.825 21.200 6.576
62 HB ILE 10 HB ILE 10 28.651 19.859 7.502
63 HG12 ILE 10 HG12 ILE 10 28.805 21.903 9.767
64 HG13 ILE 10 HG13 ILE 10 28.166 20.269 9.945
65 HG21 ILE 10 HG21 ILE 10 29.038 21.800 6.017
66 HG22 ILE 10 HG22 ILE 10 29.229 22.847 7.442
67 HG23 ILE 10 HG23 ILE 10 30.387 21.552 7.118
68 HD11 ILE 10 HD11 ILE 10 30.358 19.322 9.272
69 HD12 ILE 10 HD12 ILE 10 31.029 20.972 9.221
70 HD13 ILE 10 HD13 ILE 10 30.430 20.293 10.744
71 H CYS 11 H CYS 11 26.317 19.016 6.483
72 HA CYS 11 HA CYS 11 25.407 17.642 8.909
73 HB2 CYS 11 HB2 CYS 11 23.283 17.173 8.341
74 HB3 CYS 11 HB3 CYS 11 23.383 18.801 7.747
75 H SER 12 H SER 12 24.929 15.289 8.425
76 HA SER 12 HA SER 12 26.722 14.150 6.310
77 HB2 SER 12 HB2 SER 12 27.666 12.651 7.867
78 HB3 SER 12 HB3 SER 12 27.762 14.241 8.627
79 HG SER 12 HG SER 12 25.875 13.707 9.822
80 H LEU 13 H LEU 13 26.401 11.627 6.387
81 HA LEU 13 HA LEU 13 23.875 10.941 5.345
82 HB2 LEU 13 HB2 LEU 13 25.848 9.127 6.801
83 HB3 LEU 13 HB3 LEU 13 24.603 8.599 5.679
84 HG LEU 13 HG LEU 13 27.035 10.289 4.955
85 HD11 LEU 13 HD11 LEU 13 27.589 7.965 5.528
86 HD12 LEU 13 HD12 LEU 13 27.797 8.262 3.794
87 HD13 LEU 13 HD13 LEU 13 26.373 7.373 4.374
88 HD21 LEU 13 HD21 LEU 13 24.905 9.043 3.167
89 HD22 LEU 13 HD22 LEU 13 26.380 9.854 2.616
90 HD23 LEU 13 HD23 LEU 13 25.138 10.781 3.460
91 H TYR 14 H TYR 14 24.972 10.923 8.701
92 HA TYR 14 HA TYR 14 22.760 9.415 9.777
93 HB2 TYR 14 HB2 TYR 14 24.721 11.306 11.135
94 HB3 TYR 14 HB3 TYR 14 23.658 10.169 11.952
95 HD1 TYR 14 HD2 TYR 14 23.891 7.650 11.380
96 HD2 TYR 14 HD1 TYR 14 26.890 10.606 10.458
97 HE1 TYR 14 HE2 TYR 14 25.601 5.852 11.174
98 HE2 TYR 14 HE1 TYR 14 28.604 8.806 10.245
99 HH TYR 14 HH TYR 14 29.029 6.555 10.375
100 H GLN 15 H GLN 15 22.997 12.712 8.753
101 HA GLN 15 HA GLN 15 20.542 13.504 10.266
102 HB2 GLN 15 HB2 GLN 15 22.532 15.067 8.587
103 HB3 GLN 15 HB3 GLN 15 20.971 15.692 9.094
104 HG2 GLN 15 HG2 GLN 15 22.499 16.522 10.692
105 HG3 GLN 15 HG3 GLN 15 21.600 15.244 11.498
106 HE21 GLN 15 HE22 GLN 15 22.962 13.923 12.757
107 HE22 GLN 15 HE21 GLN 15 24.652 13.632 12.361
108 H LEU 16 H LEU 16 21.724 12.890 6.923
109 HA LEU 16 HA LEU 16 19.233 13.570 5.658
110 HB2 LEU 16 HB2 LEU 16 21.474 11.721 4.781
111 HB3 LEU 16 HB3 LEU 16 20.169 12.273 3.735
112 HG LEU 16 HG LEU 16 22.152 14.161 5.088
113 HD11 LEU 16 HD11 LEU 16 23.361 12.725 3.577
114 HD12 LEU 16 HD12 LEU 16 23.163 14.311 2.815
115 HD13 LEU 16 HD13 LEU 16 22.139 12.955 2.303
116 HD21 LEU 16 HD21 LEU 16 20.251 14.640 2.763
117 HD22 LEU 16 HD22 LEU 16 21.418 15.798 3.437
118 HD23 LEU 16 HD23 LEU 16 20.049 15.281 4.421
119 H GLU 17 H GLU 17 20.342 10.498 7.139
120 HA GLU 17 HA GLU 17 17.827 9.139 6.530
121 HB2 GLU 17 HB2 GLU 17 20.129 8.465 8.389
122 HB3 GLU 17 HB3 GLU 17 18.651 7.516 8.294
123 HG2 GLU 17 HG2 GLU 17 19.206 7.587 5.656
124 HG3 GLU 17 HG3 GLU 17 20.842 7.776 6.288
125 H ASN 18 H ASN 18 18.417 11.669 8.678
126 HA ASN 18 HA ASN 18 16.291 10.801 10.580
127 HB2 ASN 18 HB2 ASN 18 18.360 11.701 11.563
128 HB3 ASN 18 HB3 ASN 18 18.167 13.193 10.650
129 HD21 ASN 18 HD21 ASN 18 17.014 14.838 11.602
130 HD22 ASN 18 HD22 ASN 18 16.001 14.612 13.020
131 H TYR 19 H TYR 19 17.047 13.485 8.297
132 HA TYR 19 HA TYR 19 14.641 14.915 8.655
133 HB2 TYR 19 HB2 TYR 19 16.366 14.697 6.186
134 HB3 TYR 19 HB3 TYR 19 15.252 16.004 6.529
135 HD1 TYR 19 HD2 TYR 19 16.105 16.257 9.588
136 HD2 TYR 19 HD1 TYR 19 18.260 16.107 5.840
137 HE1 TYR 19 HE2 TYR 19 17.962 17.547 10.595
138 HE2 TYR 19 HE1 TYR 19 20.110 17.431 6.859
139 HH TYR 19 HH TYR 19 20.030 18.446 10.286
140 H CYS 20 H CYS 20 15.162 12.084 6.615
141 HA CYS 20 HA CYS 20 12.697 12.311 5.111
142 HB2 CYS 20 HB2 CYS 20 13.153 9.927 4.593
143 HB3 CYS 20 HB3 CYS 20 14.534 10.982 4.280
144 H ASN 21 H ASN 21 13.263 11.454 8.413
145 HA ASN 21 HA ASN 21 12.082 10.468 10.037
146 HB2 ASN 21 HB2 ASN 21 10.945 12.642 9.553
147 HB3 ASN 21 HB3 ASN 21 9.738 11.760 8.611
148 HD21 ASN 21 HD21 ASN 21 8.199 12.735 10.175
149 HD22 ASN 21 HD22 ASN 21 8.006 11.963 11.743
150 H GLY 22 H GLY 22 12.719 8.454 8.465
151 HA2 GLY 22 HA2 GLY 22 10.351 6.606 8.525
152 HA3 GLY 22 HA3 GLY 22 11.463 6.624 7.159
153 H1 PHE 101 H1 PHE 101 30.829 10.433 5.358
154 H2 PHE 101 H2 PHE 101 30.668 10.267 3.730
155 H3 PHE 101 H3 PHE 101 29.494 11.018 4.603
156 HA PHE 101 HA PHE 101 32.238 11.988 4.237
157 HB2 PHE 101 HB2 PHE 101 31.358 13.740 2.832
158 HB3 PHE 101 HB3 PHE 101 30.937 12.186 2.164
159 HD1 PHE 101 HD1 PHE 101 29.602 15.173 3.965
160 HD2 PHE 101 HD2 PHE 101 28.605 11.551 1.830
161 HE1 PHE 101 HE1 PHE 101 27.230 15.886 3.846
162 HE2 PHE 101 HE2 PHE 101 26.236 12.288 1.716
163 HZ PHE 101 HZ PHE 101 25.546 14.438 2.740
164 H VAL 102 H VAL 102 32.566 14.216 4.963
165 HA VAL 102 HA VAL 102 30.777 15.247 7.082
166 HB VAL 102 HB VAL 102 32.694 15.698 8.580
167 HG11 VAL 102 HG11 VAL 102 31.210 13.753 8.961
168 HG12 VAL 102 HG12 VAL 102 32.347 12.723 8.065
169 HG13 VAL 102 HG13 VAL 102 32.858 13.501 9.568
170 HG21 VAL 102 HG21 VAL 102 34.569 15.539 6.971
171 HG22 VAL 102 HG22 VAL 102 34.800 14.486 8.368
172 HG23 VAL 102 HG23 VAL 102 34.284 13.784 6.824
173 H ASN 103 H ASN 103 31.346 17.467 7.720
174 HA ASN 103 HA ASN 103 31.572 19.647 7.169
175 HB2 ASN 103 HB2 ASN 103 33.869 18.718 7.814
176 HB3 ASN 103 HB3 ASN 103 34.296 18.887 6.115
177 HD21 ASN 103 HD21 ASN 103 33.821 21.194 5.207
178 HD22 ASN 103 HD22 ASN 103 34.256 22.522 6.292
179 H GLN 104 H GLN 104 29.897 18.736 5.370
180 HA GLN 104 HA GLN 104 30.563 20.195 2.874
181 HB2 GLN 104 HB2 GLN 104 31.085 17.775 2.572
182 HB3 GLN 104 HB3 GLN 104 29.431 17.380 3.031
183 HG2 GLN 104 HG2 GLN 104 29.767 17.237 0.611
184 HG3 GLN 104 HG3 GLN 104 28.567 18.455 0.998
185 HE21 GLN 104 HE21 GLN 104 31.780 17.897 -0.381
186 HE22 GLN 104 HE22 GLN 104 32.027 19.559 -0.888
187 H HIS 105 H HIS 105 28.717 20.829 1.634
188 HA HIS 105 HA HIS 105 26.180 21.058 3.189
189 HB2 HIS 105 HB2 HIS 105 27.407 23.134 1.335
190 HB3 HIS 105 HB3 HIS 105 25.934 23.301 2.277
191 HD1 HIS 105 HD1 HIS 105 26.283 23.783 4.954
192 HD2 HIS 105 HD2 HIS 105 29.741 23.522 2.564
193 HE1 HIS 105 HE1 HIS 105 28.158 24.928 6.264
194 H LEU 106 H LEU 106 24.269 21.044 2.062
195 HA LEU 106 HA LEU 106 24.158 21.018 -0.865
196 HB2 LEU 106 HB2 LEU 106 23.020 18.755 0.827
197 HB3 LEU 106 HB3 LEU 106 22.503 19.076 -0.817
198 HG LEU 106 HG LEU 106 25.336 18.271 -0.004
199 HD11 LEU 106 HD11 LEU 106 23.176 16.741 -1.487
200 HD12 LEU 106 HD12 LEU 106 23.651 16.479 0.211
201 HD13 LEU 106 HD13 LEU 106 24.805 16.163 -1.089
202 HD21 LEU 106 HD21 LEU 106 25.412 19.634 -2.070
203 HD22 LEU 106 HD22 LEU 106 24.079 18.701 -2.761
204 HD23 LEU 106 HD23 LEU 106 25.655 17.938 -2.471
205 H CYS 107 H CYS 107 22.245 21.834 -1.663
206 HA CYS 107 HA CYS 107 20.403 23.090 0.342
207 HB2 CYS 107 HB2 CYS 107 21.707 24.270 -2.132
208 HB3 CYS 107 HB3 CYS 107 20.499 25.094 -1.157
209 H GLY 108 H GLY 108 18.316 23.631 -0.333
210 HA2 GLY 108 HA2 GLY 108 16.282 23.375 -1.408
211 HA3 GLY 108 HA3 GLY 108 17.237 23.695 -2.848
212 H SER 109 H SER 109 16.405 22.361 -4.356
213 HA SER 109 HA SER 109 15.293 19.803 -4.029
214 HB2 SER 109 HB2 SER 109 16.781 20.862 -6.463
215 HB3 SER 109 HB3 SER 109 15.590 19.551 -6.446
216 HG SER 109 HG SER 109 14.663 21.566 -7.078
217 H HIS 110 H HIS 110 18.762 20.642 -4.309
218 HA HIS 110 HA HIS 110 19.591 17.920 -4.820
219 HB2 HIS 110 HB2 HIS 110 20.780 20.194 -5.326
220 HB3 HIS 110 HB3 HIS 110 21.361 20.083 -3.665
221 HD1 HIS 110 HD1 HIS 110 21.920 16.840 -3.779
222 HD2 HIS 110 HD2 HIS 110 22.966 19.773 -6.597
223 HE1 HIS 110 HE1 HIS 110 23.903 15.886 -5.088
224 H LEU 111 H LEU 111 18.945 19.789 -1.897
225 HA LEU 111 HA LEU 111 20.125 17.856 -0.058
226 HB2 LEU 111 HB2 LEU 111 19.787 20.242 0.479
227 HB3 LEU 111 HB3 LEU 111 18.046 20.044 0.403
228 HG LEU 111 HG LEU 111 19.093 20.183 2.679
229 HD11 LEU 111 HD11 LEU 111 17.545 17.598 2.330
230 HD12 LEU 111 HD12 LEU 111 16.813 19.212 2.296
231 HD13 LEU 111 HD13 LEU 111 17.646 18.635 3.751
232 HD21 LEU 111 HD21 LEU 111 20.003 17.328 2.155
233 HD22 LEU 111 HD22 LEU 111 20.120 18.220 3.674
234 HD23 LEU 111 HD23 LEU 111 21.068 18.757 2.275
235 H VAL 112 H VAL 112 16.831 18.483 -1.342
236 HA VAL 112 HA VAL 112 15.534 16.249 -0.104
237 HB VAL 112 HB VAL 112 14.921 17.579 -2.776
238 HG11 VAL 112 HG11 VAL 112 13.799 15.431 -2.731
239 HG12 VAL 112 HG12 VAL 112 13.271 15.682 -1.053
240 HG13 VAL 112 HG13 VAL 112 12.603 16.671 -2.373
241 HG21 VAL 112 HG21 VAL 112 13.178 18.773 -1.471
242 HG22 VAL 112 HG22 VAL 112 13.816 18.048 0.020
243 HG23 VAL 112 HG23 VAL 112 14.805 19.176 -0.918
244 H GLU 113 H GLU 113 17.223 16.450 -3.280
245 HA GLU 113 HA GLU 113 16.923 13.720 -3.991
246 HB2 GLU 113 HB2 GLU 113 17.660 15.558 -5.484
247 HB3 GLU 113 HB3 GLU 113 19.225 15.590 -4.658
248 HG2 GLU 113 HG2 GLU 113 19.706 13.305 -5.387
249 HG3 GLU 113 HG3 GLU 113 18.081 13.132 -6.051
250 H ALA 114 H ALA 114 19.331 15.247 -1.822
251 HA ALA 114 HA ALA 114 20.931 12.893 -1.490
252 HB1 ALA 114 HB1 ALA 114 21.607 15.232 -0.966
253 HB2 ALA 114 HB2 ALA 114 20.566 15.187 0.472
254 HB3 ALA 114 HB3 ALA 114 21.943 14.080 0.331
255 H LEU 115 H LEU 115 18.032 14.048 0.354
256 HA LEU 115 HA LEU 115 17.917 11.843 2.196
257 HB2 LEU 115 HB2 LEU 115 15.416 12.965 0.876
258 HB3 LEU 115 HB3 LEU 115 15.596 12.251 2.470
259 HG LEU 115 HG LEU 115 16.570 14.947 1.521
260 HD11 LEU 115 HD11 LEU 115 14.136 14.763 1.907
261 HD12 LEU 115 HD12 LEU 115 14.906 15.842 3.086
262 HD13 LEU 115 HD13 LEU 115 14.439 14.198 3.563
263 HD21 LEU 115 HD21 LEU 115 17.173 15.368 3.897
264 HD22 LEU 115 HD22 LEU 115 18.133 14.047 3.209
265 HD23 LEU 115 HD23 LEU 115 16.778 13.659 4.275
266 H TYR 116 H TYR 116 16.534 12.265 -1.039
267 HA TYR 116 HA TYR 116 15.453 9.622 -1.259
268 HB2 TYR 116 HB2 TYR 116 15.859 11.954 -3.055
269 HB3 TYR 116 HB3 TYR 116 15.665 10.413 -3.852
270 HD1 TYR 116 HD1 TYR 116 13.637 9.029 -3.550
271 HD2 TYR 116 HD2 TYR 116 13.942 12.994 -1.877
272 HE1 TYR 116 HE1 TYR 116 11.158 9.113 -3.281
273 HE2 TYR 116 HE2 TYR 116 11.473 13.066 -1.602
274 HH TYR 116 HH TYR 116 9.373 10.314 -2.571
275 H LEU 117 H LEU 117 18.753 10.454 -1.489
276 HA LEU 117 HA LEU 117 19.379 7.869 -2.838
277 HB2 LEU 117 HB2 LEU 117 20.988 10.386 -2.306
278 HB3 LEU 117 HB3 LEU 117 21.719 8.899 -2.897
279 HG LEU 117 HG LEU 117 19.498 10.360 -4.400
280 HD11 LEU 117 HD11 LEU 117 22.521 10.394 -4.834
281 HD12 LEU 117 HD12 LEU 117 21.539 11.745 -4.213
282 HD13 LEU 117 HD13 LEU 117 21.300 11.167 -5.871
283 HD21 LEU 117 HD21 LEU 117 21.422 8.138 -5.219
284 HD22 LEU 117 HD22 LEU 117 20.322 9.003 -6.310
285 HD23 LEU 117 HD23 LEU 117 19.660 7.993 -5.017
286 H VAL 118 H VAL 118 19.907 9.641 0.187
287 HA VAL 118 HA VAL 118 21.605 7.476 1.277
288 HB VAL 118 HB VAL 118 20.739 10.151 2.432
289 HG11 VAL 118 HG11 VAL 118 22.667 8.062 3.512
290 HG12 VAL 118 HG12 VAL 118 22.589 9.739 4.069
291 HG13 VAL 118 HG13 VAL 118 21.199 8.687 4.290
292 HG21 VAL 118 HG21 VAL 118 23.380 9.160 1.243
293 HG22 VAL 118 HG22 VAL 118 22.285 10.343 0.501
294 HG23 VAL 118 HG23 VAL 118 23.122 10.750 1.998
295 H CYS 119 H CYS 119 18.375 8.799 1.810
296 HA CYS 119 HA CYS 119 17.744 6.659 3.787
297 HB2 CYS 119 HB2 CYS 119 17.385 9.051 4.387
298 HB3 CYS 119 HB3 CYS 119 16.204 9.182 3.093
299 H GLY 120 H GLY 120 16.958 7.868 0.563
300 HA2 GLY 120 HA2 GLY 120 16.115 6.567 -1.238
301 HA3 GLY 120 HA3 GLY 120 15.595 5.325 -0.117
302 H GLU 121 H GLU 121 13.566 5.289 -1.229
303 HA GLU 121 HA GLU 121 11.861 7.568 -1.510
304 HB2 GLU 121 HB2 GLU 121 11.274 4.594 -1.636
305 HB3 GLU 121 HB3 GLU 121 10.121 5.857 -2.072
306 HG2 GLU 121 HG2 GLU 121 11.717 6.712 -3.782
307 HG3 GLU 121 HG3 GLU 121 12.818 5.384 -3.405
308 H ARG 122 H ARG 122 12.713 6.313 1.382
309 HA ARG 122 HA ARG 122 10.241 6.474 2.919
310 HB2 ARG 122 HB2 ARG 122 13.198 6.713 3.570
311 HB3 ARG 122 HB3 ARG 122 11.944 6.956 4.791
312 HG2 ARG 122 HG2 ARG 122 11.064 4.692 4.394
313 HG3 ARG 122 HG3 ARG 122 12.310 4.388 3.174
314 HD2 ARG 122 HD2 ARG 122 12.883 5.129 6.077
315 HD3 ARG 122 HD3 ARG 122 12.783 3.463 5.493
316 HE ARG 122 HE ARG 122 14.638 4.527 3.797
317 HH11 ARG 122 HH11 ARG 122 14.625 4.957 7.333
318 HH12 ARG 122 HH12 ARG 122 16.370 4.806 7.348
319 HH21 ARG 122 HH21 ARG 122 16.779 4.437 4.021
320 HH22 ARG 122 HH22 ARG 122 17.532 4.638 5.601
321 H GLY 123 H GLY 123 12.417 8.899 1.552
322 HA2 GLY 123 HA2 GLY 123 11.594 11.142 3.165
323 HA3 GLY 123 HA3 GLY 123 12.320 11.218 1.557
324 H PHE 124 H PHE 124 10.242 12.885 2.592
325 HA PHE 124 HA PHE 124 8.190 13.756 2.195
326 HB2 PHE 124 HB2 PHE 124 9.400 13.285 -0.521
327 HB3 PHE 124 HB3 PHE 124 7.865 14.119 -0.339
328 HD1 PHE 124 HD2 PHE 124 11.455 14.267 0.760
329 HD2 PHE 124 HD1 PHE 124 7.733 16.381 0.270
330 HE1 PHE 124 HE2 PHE 124 12.588 16.413 1.323
331 HE2 PHE 124 HE1 PHE 124 8.872 18.524 0.801
332 HZ PHE 124 HZ PHE 124 11.305 18.534 1.341
333 H PHE 125 H PHE 125 7.753 11.652 -0.624
334 HA PHE 125 HA PHE 125 4.985 11.208 0.099
335 HB2 PHE 125 HB2 PHE 125 6.701 10.091 -2.143
336 HB3 PHE 125 HB3 PHE 125 4.971 9.828 -1.991
337 HD1 PHE 125 HD2 PHE 125 3.384 11.830 -1.992
338 HD2 PHE 125 HD1 PHE 125 7.527 12.131 -3.153
339 HE1 PHE 125 HE2 PHE 125 2.908 13.979 -3.155
340 HE2 PHE 125 HE1 PHE 125 7.048 14.270 -4.308
341 HZ PHE 125 HZ PHE 125 4.741 15.197 -4.317
342 H TYR 126 H TYR 126 7.815 9.504 0.935
343 HA TYR 126 HA TYR 126 8.244 7.766 2.233
344 HB2 TYR 126 HB2 TYR 126 6.707 8.880 3.715
345 HB3 TYR 126 HB3 TYR 126 5.342 8.012 3.035
346 HD1 TYR 126 HD1 TYR 126 8.439 7.611 5.076
347 HD2 TYR 126 HD2 TYR 126 4.746 5.811 3.760
348 HE1 TYR 126 HE1 TYR 126 8.734 5.777 6.740
349 HE2 TYR 126 HE2 TYR 126 5.030 3.994 5.436
350 HH TYR 126 HH TYR 126 6.309 3.174 7.159
351 H THR 127 H THR 127 8.200 5.574 2.698
352 HA THR 127 HA THR 127 6.423 3.746 1.334
353 HB THR 127 HB THR 127 8.253 4.121 -0.358
354 HG1 THR 127 HG1 THR 127 8.608 1.844 -0.610
355 HG21 THR 127 HG21 THR 127 10.010 2.498 1.530
356 HG22 THR 127 HG22 THR 127 10.200 4.235 1.248
357 HG23 THR 127 HG23 THR 127 10.418 3.089 -0.087
358 HA PRO 128 HA PRO 128 7.142 1.734 5.284
359 HB2 PRO 128 HB2 PRO 128 6.841 -0.815 3.672
360 HB3 PRO 128 HB3 PRO 128 6.149 -0.410 5.268
361 HG2 PRO 128 HG2 PRO 128 4.624 -0.200 3.045
362 HG3 PRO 128 HG3 PRO 128 4.574 1.099 4.280
363 HD2 PRO 128 HD2 PRO 128 6.072 1.054 1.657
364 HD3 PRO 128 HD3 PRO 128 5.134 2.380 2.411
365 H LYS 129 H LYS 129 8.983 1.238 6.357
366 HA LYS 129 HA LYS 129 11.480 1.065 4.992
367 HB2 LYS 129 HB2 LYS 129 11.049 2.130 7.187
368 HB3 LYS 129 HB3 LYS 129 10.875 0.531 7.929
369 HG2 LYS 129 HG2 LYS 129 13.179 0.011 7.635
370 HG3 LYS 129 HG3 LYS 129 13.397 1.271 6.410
371 HD2 LYS 129 HD2 LYS 129 14.460 1.962 8.489
372 HD3 LYS 129 HD3 LYS 129 13.114 3.023 8.081
373 HE2 LYS 129 HE2 LYS 129 11.676 1.672 9.692
374 HE3 LYS 129 HE3 LYS 129 13.134 0.806 10.172
375 HZ1 LYS 129 HZ1 LYS 129 14.075 2.990 10.841
376 HZ2 LYS 129 HZ2 LYS 129 12.688 2.673 11.656
377 HZ3 LYS 129 HZ3 LYS 129 12.678 3.740 10.417
378 H THR 130 H THR 130 9.395 -1.455 6.043
379 HA THR 130 HA THR 130 11.280 -3.493 4.910
380 HB THR 130 HB THR 130 9.192 -3.967 7.063
381 HG1 THR 130 HG1 THR 130 10.983 -4.336 8.367
382 HG21 THR 130 HG21 THR 130 10.221 -6.226 7.194
383 HG22 THR 130 HG22 THR 130 11.273 -5.827 5.816
384 HG23 THR 130 HG23 THR 130 9.509 -5.939 5.604
385 H ARG 131 H ARG 131 10.571 -3.959 2.919
386 HA ARG 131 HA ARG 131 7.704 -4.343 2.318
387 HB2 ARG 131 HB2 ARG 131 8.281 -1.893 2.034
388 HB3 ARG 131 HB3 ARG 131 9.417 -2.356 0.759
389 HG2 ARG 131 HG2 ARG 131 7.558 -3.304 -0.566
390 HG3 ARG 131 HG3 ARG 131 6.429 -2.969 0.766
391 HD2 ARG 131 HD2 ARG 131 6.943 -0.541 0.548
392 HD3 ARG 131 HD3 ARG 131 7.975 -0.899 -0.849
393 HE ARG 131 HE ARG 131 5.586 -2.070 -1.524
394 HH11 ARG 131 HH11 ARG 131 6.397 1.265 -0.684
395 HH12 ARG 131 HH12 ARG 131 5.018 1.876 -1.553
396 HH21 ARG 131 HH21 ARG 131 3.894 -1.181 -2.616
397 HH22 ARG 131 HH22 ARG 131 3.662 0.543 -2.622
Start of MODEL 7
1 H1 GLY 1 H1 GLY 1 15.082 25.901 9.953
2 H2 GLY 1 H2 GLY 1 14.904 24.826 11.192
3 H3 GLY 1 H3 GLY 1 13.744 25.945 10.891
4 HA2 GLY 1 HA2 GLY 1 12.921 23.898 10.067
5 HA3 GLY 1 HA3 GLY 1 13.337 24.942 8.692
6 H ILE 2 H ILE 2 13.237 22.640 7.783
7 HA ILE 2 HA ILE 2 15.259 20.706 8.429
8 HB ILE 2 HB ILE 2 13.389 21.017 6.051
9 HG12 ILE 2 HG12 ILE 2 12.234 20.662 8.204
10 HG13 ILE 2 HG13 ILE 2 11.997 19.362 7.061
11 HG21 ILE 2 HG21 ILE 2 15.229 18.711 6.717
12 HG22 ILE 2 HG22 ILE 2 13.815 18.555 5.653
13 HG23 ILE 2 HG23 ILE 2 15.137 19.643 5.215
14 HD11 ILE 2 HD11 ILE 2 12.301 18.560 9.386
15 HD12 ILE 2 HD12 ILE 2 13.518 17.899 8.287
16 HD13 ILE 2 HD13 ILE 2 13.946 19.216 9.405
17 H VAL 3 H VAL 3 14.998 22.881 5.586
18 HA VAL 3 HA VAL 3 17.362 21.821 4.361
19 HB VAL 3 HB VAL 3 15.948 24.454 3.787
20 HG11 VAL 3 HG11 VAL 3 16.853 24.161 1.495
21 HG12 VAL 3 HG12 VAL 3 18.133 24.384 2.682
22 HG13 VAL 3 HG13 VAL 3 17.792 22.752 2.052
23 HG21 VAL 3 HG21 VAL 3 15.490 21.698 2.565
24 HG22 VAL 3 HG22 VAL 3 14.355 22.583 3.607
25 HG23 VAL 3 HG23 VAL 3 14.756 23.214 2.011
26 H GLU 4 H GLU 4 16.870 24.691 6.373
27 HA GLU 4 HA GLU 4 19.222 26.113 5.851
28 HB2 GLU 4 HB2 GLU 4 17.717 25.807 8.487
29 HB3 GLU 4 HB3 GLU 4 18.891 27.083 8.138
30 HG2 GLU 4 HG2 GLU 4 17.487 27.987 6.360
31 HG3 GLU 4 HG3 GLU 4 16.324 26.665 6.543
32 H GLN 5 H GLN 5 18.787 23.420 8.140
33 HA GLN 5 HA GLN 5 21.204 23.694 9.600
34 HB2 GLN 5 HB2 GLN 5 19.411 21.316 8.993
35 HB3 GLN 5 HB3 GLN 5 20.766 21.233 10.124
36 HG2 GLN 5 HG2 GLN 5 19.774 22.943 11.554
37 HG3 GLN 5 HG3 GLN 5 18.460 23.206 10.408
38 HE21 GLN 5 HE21 GLN 5 16.656 21.820 10.474
39 HE22 GLN 5 HE22 GLN 5 16.543 20.475 11.610
40 H CYS 6 H CYS 6 20.619 22.039 6.517
41 HA CYS 6 HA CYS 6 23.491 21.218 6.410
42 HB2 CYS 6 HB2 CYS 6 21.107 20.147 4.904
43 HB3 CYS 6 HB3 CYS 6 22.775 19.607 4.717
44 H CYS 7 H CYS 7 21.375 23.552 5.108
45 HA CYS 7 HA CYS 7 22.979 23.942 2.668
46 HB2 CYS 7 HB2 CYS 7 20.537 24.169 2.669
47 HB3 CYS 7 HB3 CYS 7 20.643 25.472 3.851
48 H THR 8 H THR 8 22.529 25.575 5.851
49 HA THR 8 HA THR 8 24.502 27.658 5.154
50 HB THR 8 HB THR 8 24.128 28.556 7.355
51 HG1 THR 8 HG1 THR 8 22.314 26.409 7.766
52 HG21 THR 8 HG21 THR 8 21.466 27.799 6.071
53 HG22 THR 8 HG22 THR 8 22.520 29.145 5.574
54 HG23 THR 8 HG23 THR 8 21.774 29.145 7.189
55 H SER 9 H SER 9 24.618 24.557 6.676
56 HA SER 9 HA SER 9 27.531 24.804 7.199
57 HB2 SER 9 HB2 SER 9 25.471 23.710 9.165
58 HB3 SER 9 HB3 SER 9 27.224 23.538 9.337
59 HG SER 9 HG SER 9 27.384 25.828 9.428
60 H ILE 10 H ILE 10 28.572 22.656 7.400
61 HA ILE 10 HA ILE 10 27.584 20.834 5.388
62 HB ILE 10 HB ILE 10 29.554 19.497 5.829
63 HG12 ILE 10 HG12 ILE 10 30.214 21.415 8.107
64 HG13 ILE 10 HG13 ILE 10 29.650 19.753 8.311
65 HG21 ILE 10 HG21 ILE 10 31.209 21.187 5.150
66 HG22 ILE 10 HG22 ILE 10 29.656 21.483 4.373
67 HG23 ILE 10 HG23 ILE 10 30.172 22.486 5.741
68 HD11 ILE 10 HD11 ILE 10 31.663 18.922 7.093
69 HD12 ILE 10 HD12 ILE 10 32.278 20.596 7.034
70 HD13 ILE 10 HD13 ILE 10 32.039 19.800 8.593
71 H CYS 11 H CYS 11 27.109 18.598 5.586
72 HA CYS 11 HA CYS 11 26.117 17.668 8.234
73 HB2 CYS 11 HB2 CYS 11 24.559 17.965 5.672
74 HB3 CYS 11 HB3 CYS 11 24.154 16.681 6.810
75 H SER 12 H SER 12 25.742 15.463 8.445
76 HA SER 12 HA SER 12 27.207 13.644 6.566
77 HB2 SER 12 HB2 SER 12 26.660 13.348 9.533
78 HB3 SER 12 HB3 SER 12 27.302 12.067 8.489
79 HG SER 12 HG SER 12 28.497 14.566 9.114
80 H LEU 13 H LEU 13 26.330 11.536 6.238
81 HA LEU 13 HA LEU 13 23.805 11.624 5.057
82 HB2 LEU 13 HB2 LEU 13 25.239 9.154 6.112
83 HB3 LEU 13 HB3 LEU 13 24.032 9.205 4.841
84 HG LEU 13 HG LEU 13 26.865 10.314 4.746
85 HD11 LEU 13 HD11 LEU 13 25.471 8.151 3.119
86 HD12 LEU 13 HD12 LEU 13 26.630 7.885 4.447
87 HD13 LEU 13 HD13 LEU 13 27.157 8.674 2.951
88 HD21 LEU 13 HD21 LEU 13 24.733 10.548 2.580
89 HD22 LEU 13 HD22 LEU 13 26.450 10.905 2.384
90 HD23 LEU 13 HD23 LEU 13 25.483 11.890 3.474
91 H TYR 14 H TYR 14 24.520 10.653 8.396
92 HA TYR 14 HA TYR 14 21.941 9.563 9.049
93 HB2 TYR 14 HB2 TYR 14 23.963 9.221 10.398
94 HB3 TYR 14 HB3 TYR 14 24.038 10.935 10.779
95 HD1 TYR 14 HD1 TYR 14 21.891 7.882 11.172
96 HD2 TYR 14 HD2 TYR 14 22.877 11.810 12.665
97 HE1 TYR 14 HE1 TYR 14 20.409 7.510 13.148
98 HE2 TYR 14 HE2 TYR 14 21.410 11.429 14.642
99 HH TYR 14 HH TYR 14 19.981 9.988 15.699
100 H GLN 15 H GLN 15 23.059 12.925 8.850
101 HA GLN 15 HA GLN 15 20.763 14.055 10.285
102 HB2 GLN 15 HB2 GLN 15 22.915 15.310 8.521
103 HB3 GLN 15 HB3 GLN 15 21.706 16.220 9.402
104 HG2 GLN 15 HG2 GLN 15 22.528 15.393 11.556
105 HG3 GLN 15 HG3 GLN 15 23.698 14.343 10.749
106 HE21 GLN 15 HE21 GLN 15 22.954 17.749 11.543
107 HE22 GLN 15 HE22 GLN 15 24.548 18.332 11.083
108 H LEU 16 H LEU 16 21.633 13.367 6.900
109 HA LEU 16 HA LEU 16 19.234 14.574 5.764
110 HB2 LEU 16 HB2 LEU 16 21.356 12.635 4.756
111 HB3 LEU 16 HB3 LEU 16 19.945 13.031 3.802
112 HG LEU 16 HG LEU 16 21.854 14.287 3.087
113 HD11 LEU 16 HD11 LEU 16 20.848 16.478 2.956
114 HD12 LEU 16 HD12 LEU 16 19.849 16.174 4.381
115 HD13 LEU 16 HD13 LEU 16 19.563 15.269 2.874
116 HD21 LEU 16 HD21 LEU 16 21.885 15.763 5.737
117 HD22 LEU 16 HD22 LEU 16 22.889 16.073 4.315
118 HD23 LEU 16 HD23 LEU 16 23.080 14.558 5.201
119 H GLU 17 H GLU 17 20.125 11.266 6.819
120 HA GLU 17 HA GLU 17 17.722 9.975 6.034
121 HB2 GLU 17 HB2 GLU 17 19.961 8.998 6.936
122 HB3 GLU 17 HB3 GLU 17 19.291 9.261 8.538
123 HG2 GLU 17 HG2 GLU 17 17.288 7.866 7.847
124 HG3 GLU 17 HG3 GLU 17 18.082 7.571 6.299
125 H ASN 18 H ASN 18 18.453 11.828 9.009
126 HA ASN 18 HA ASN 18 16.100 11.267 10.475
127 HB2 ASN 18 HB2 ASN 18 18.115 12.369 11.370
128 HB3 ASN 18 HB3 ASN 18 17.815 13.787 10.369
129 HD21 ASN 18 HD21 ASN 18 16.579 15.414 11.254
130 HD22 ASN 18 HD22 ASN 18 15.602 15.211 12.705
131 H TYR 19 H TYR 19 16.508 13.528 7.739
132 HA TYR 19 HA TYR 19 13.893 14.740 8.057
133 HB2 TYR 19 HB2 TYR 19 15.692 14.732 5.628
134 HB3 TYR 19 HB3 TYR 19 14.418 15.882 5.999
135 HD1 TYR 19 HD2 TYR 19 15.158 16.301 9.009
136 HD2 TYR 19 HD1 TYR 19 17.468 16.263 5.368
137 HE1 TYR 19 HE2 TYR 19 16.859 17.750 10.079
138 HE2 TYR 19 HE1 TYR 19 19.179 17.717 6.447
139 HH TYR 19 HH TYR 19 18.864 18.795 9.863
140 H CYS 20 H CYS 20 14.669 11.650 6.978
141 HA CYS 20 HA CYS 20 12.702 11.378 4.868
142 HB2 CYS 20 HB2 CYS 20 14.881 10.110 5.173
143 HB3 CYS 20 HB3 CYS 20 14.070 9.204 6.457
144 H ASN 21 H ASN 21 11.327 12.555 6.883
145 HA ASN 21 HA ASN 21 9.840 10.556 8.481
146 HB2 ASN 21 HB2 ASN 21 10.565 12.592 9.595
147 HB3 ASN 21 HB3 ASN 21 9.795 13.593 8.357
148 HD21 ASN 21 HD21 ASN 21 8.972 11.070 10.821
149 HD22 ASN 21 HD22 ASN 21 7.391 11.761 11.140
150 H GLY 22 H GLY 22 8.507 9.384 7.186
151 HA2 GLY 22 HA2 GLY 22 6.052 10.550 6.221
152 HA3 GLY 22 HA3 GLY 22 7.104 10.057 4.886
153 H1 PHE 101 H1 PHE 101 32.291 12.684 7.883
154 H2 PHE 101 H2 PHE 101 30.821 11.949 7.970
155 H3 PHE 101 H3 PHE 101 30.922 13.579 8.033
156 HA PHE 101 HA PHE 101 31.594 11.898 5.710
157 HB2 PHE 101 HB2 PHE 101 29.142 12.204 6.275
158 HB3 PHE 101 HB3 PHE 101 29.361 13.935 6.034
159 HD1 PHE 101 HD1 PHE 101 29.988 10.666 4.223
160 HD2 PHE 101 HD2 PHE 101 28.758 14.798 3.930
161 HE1 PHE 101 HE1 PHE 101 29.480 10.356 1.815
162 HE2 PHE 101 HE2 PHE 101 28.227 14.468 1.530
163 HZ PHE 101 HZ PHE 101 28.599 12.258 0.464
164 H VAL 102 H VAL 102 31.721 13.387 3.667
165 HA VAL 102 HA VAL 102 33.873 15.294 4.045
166 HB VAL 102 HB VAL 102 33.593 15.717 1.599
167 HG11 VAL 102 HG11 VAL 102 35.149 14.012 2.470
168 HG12 VAL 102 HG12 VAL 102 33.862 12.787 2.395
169 HG13 VAL 102 HG13 VAL 102 34.465 13.543 0.905
170 HG21 VAL 102 HG21 VAL 102 31.135 15.130 1.454
171 HG22 VAL 102 HG22 VAL 102 32.160 14.342 0.241
172 HG23 VAL 102 HG23 VAL 102 31.582 13.427 1.644
173 H ASN 103 H ASN 103 33.872 17.484 3.247
174 HA ASN 103 HA ASN 103 31.867 18.965 4.669
175 HB2 ASN 103 HB2 ASN 103 33.417 20.872 4.304
176 HB3 ASN 103 HB3 ASN 103 34.158 19.438 4.993
177 HD21 ASN 103 HD21 ASN 103 33.667 21.066 1.832
178 HD22 ASN 103 HD22 ASN 103 35.249 20.598 1.191
179 H GLN 104 H GLN 104 30.339 17.999 2.831
180 HA GLN 104 HA GLN 104 29.910 19.953 0.629
181 HB2 GLN 104 HB2 GLN 104 28.655 17.260 1.273
182 HB3 GLN 104 HB3 GLN 104 28.125 18.299 -0.056
183 HG2 GLN 104 HG2 GLN 104 30.382 18.227 -1.058
184 HG3 GLN 104 HG3 GLN 104 30.957 17.198 0.253
185 HE21 GLN 104 HE21 GLN 104 31.421 16.118 -2.124
186 HE22 GLN 104 HE22 GLN 104 30.233 14.885 -2.516
187 H HIS 105 H HIS 105 28.040 21.102 0.294
188 HA HIS 105 HA HIS 105 26.169 21.466 2.596
189 HB2 HIS 105 HB2 HIS 105 27.062 23.374 0.412
190 HB3 HIS 105 HB3 HIS 105 25.636 23.639 1.399
191 HD1 HIS 105 HD1 HIS 105 26.100 25.229 3.338
192 HD2 HIS 105 HD2 HIS 105 29.438 22.936 2.190
193 HE1 HIS 105 HE1 HIS 105 28.031 25.979 4.825
194 H LEU 106 H LEU 106 24.032 21.232 2.281
195 HA LEU 106 HA LEU 106 23.026 20.314 -0.388
196 HB2 LEU 106 HB2 LEU 106 22.111 19.386 2.357
197 HB3 LEU 106 HB3 LEU 106 21.483 18.901 0.803
198 HG LEU 106 HG LEU 106 22.677 17.094 1.578
199 HD11 LEU 106 HD11 LEU 106 23.105 17.593 -0.806
200 HD12 LEU 106 HD12 LEU 106 24.403 16.670 -0.033
201 HD13 LEU 106 HD13 LEU 106 24.619 18.401 -0.339
202 HD21 LEU 106 HD21 LEU 106 24.030 18.253 3.308
203 HD22 LEU 106 HD22 LEU 106 25.190 18.721 2.047
204 HD23 LEU 106 HD23 LEU 106 24.907 17.013 2.410
205 H CYS 107 H CYS 107 21.865 21.955 -1.194
206 HA CYS 107 HA CYS 107 19.900 23.408 0.546
207 HB2 CYS 107 HB2 CYS 107 21.456 24.389 -1.868
208 HB3 CYS 107 HB3 CYS 107 20.235 25.314 -1.006
209 H GLY 108 H GLY 108 17.806 23.560 -0.199
210 HA2 GLY 108 HA2 GLY 108 15.913 23.109 -1.442
211 HA3 GLY 108 HA3 GLY 108 16.894 23.626 -2.810
212 H SER 109 H SER 109 16.805 22.195 -4.446
213 HA SER 109 HA SER 109 15.869 19.531 -4.318
214 HB2 SER 109 HB2 SER 109 17.744 20.758 -6.377
215 HB3 SER 109 HB3 SER 109 16.728 19.321 -6.601
216 HG SER 109 HG SER 109 15.758 21.230 -7.458
217 H HIS 110 H HIS 110 19.178 20.697 -3.679
218 HA HIS 110 HA HIS 110 20.382 18.063 -3.991
219 HB2 HIS 110 HB2 HIS 110 21.491 20.422 -4.150
220 HB3 HIS 110 HB3 HIS 110 21.544 20.349 -2.388
221 HD1 HIS 110 HD1 HIS 110 24.249 20.297 -2.419
222 HD2 HIS 110 HD2 HIS 110 22.326 17.165 -4.484
223 HE1 HIS 110 HE1 HIS 110 26.044 18.601 -2.987
224 H LEU 111 H LEU 111 18.800 19.794 -1.365
225 HA LEU 111 HA LEU 111 19.564 18.004 0.807
226 HB2 LEU 111 HB2 LEU 111 18.673 20.448 0.894
227 HB3 LEU 111 HB3 LEU 111 17.092 19.765 0.569
228 HG LEU 111 HG LEU 111 17.252 20.265 2.851
229 HD11 LEU 111 HD11 LEU 111 16.704 18.243 3.967
230 HD12 LEU 111 HD12 LEU 111 17.592 17.264 2.797
231 HD13 LEU 111 HD13 LEU 111 16.099 18.114 2.310
232 HD21 LEU 111 HD21 LEU 111 18.891 19.302 4.395
233 HD22 LEU 111 HD22 LEU 111 19.653 20.304 3.154
234 HD23 LEU 111 HD23 LEU 111 19.736 18.528 3.036
235 H VAL 112 H VAL 112 16.715 18.289 -1.335
236 HA VAL 112 HA VAL 112 15.360 15.917 -0.483
237 HB VAL 112 HB VAL 112 15.323 17.298 -3.188
238 HG11 VAL 112 HG11 VAL 112 13.116 16.191 -3.489
239 HG12 VAL 112 HG12 VAL 112 14.438 15.022 -3.452
240 HG13 VAL 112 HG13 VAL 112 13.410 15.237 -2.022
241 HG21 VAL 112 HG21 VAL 112 13.196 18.270 -2.346
242 HG22 VAL 112 HG22 VAL 112 13.482 17.511 -0.764
243 HG23 VAL 112 HG23 VAL 112 14.578 18.774 -1.367
244 H GLU 113 H GLU 113 17.667 16.357 -3.243
245 HA GLU 113 HA GLU 113 17.684 13.635 -4.036
246 HB2 GLU 113 HB2 GLU 113 18.522 15.521 -5.381
247 HB3 GLU 113 HB3 GLU 113 19.894 15.717 -4.278
248 HG2 GLU 113 HG2 GLU 113 20.773 13.544 -4.899
249 HG3 GLU 113 HG3 GLU 113 19.310 13.155 -5.810
250 H ALA 114 H ALA 114 19.804 15.286 -1.606
251 HA ALA 114 HA ALA 114 21.384 12.957 -1.110
252 HB1 ALA 114 HB1 ALA 114 22.173 14.198 0.836
253 HB2 ALA 114 HB2 ALA 114 22.117 15.229 -0.597
254 HB3 ALA 114 HB3 ALA 114 20.849 15.379 0.650
255 H LEU 115 H LEU 115 18.346 14.082 0.546
256 HA LEU 115 HA LEU 115 18.517 11.860 2.426
257 HB2 LEU 115 HB2 LEU 115 16.446 12.478 3.309
258 HB3 LEU 115 HB3 LEU 115 17.408 13.912 3.035
259 HG LEU 115 HG LEU 115 16.005 14.223 0.886
260 HD11 LEU 115 HD11 LEU 115 14.029 12.477 2.427
261 HD12 LEU 115 HD12 LEU 115 14.833 11.946 0.947
262 HD13 LEU 115 HD13 LEU 115 13.775 13.336 0.882
263 HD21 LEU 115 HD21 LEU 115 15.825 15.612 2.925
264 HD22 LEU 115 HD22 LEU 115 14.611 14.484 3.568
265 HD23 LEU 115 HD23 LEU 115 14.277 15.423 2.099
266 H TYR 116 H TYR 116 17.015 12.218 -0.787
267 HA TYR 116 HA TYR 116 15.784 9.591 -0.733
268 HB2 TYR 116 HB2 TYR 116 16.337 11.689 -2.784
269 HB3 TYR 116 HB3 TYR 116 16.176 10.052 -3.370
270 HD1 TYR 116 HD1 TYR 116 14.348 12.772 -1.594
271 HD2 TYR 116 HD2 TYR 116 14.098 8.854 -3.373
272 HE1 TYR 116 HE1 TYR 116 11.860 12.931 -1.590
273 HE2 TYR 116 HE2 TYR 116 11.610 9.010 -3.353
274 HH TYR 116 HH TYR 116 9.785 10.291 -2.850
275 H LEU 117 H LEU 117 19.073 10.673 -1.683
276 HA LEU 117 HA LEU 117 19.897 8.069 -2.615
277 HB2 LEU 117 HB2 LEU 117 21.380 10.548 -1.673
278 HB3 LEU 117 HB3 LEU 117 22.238 9.082 -2.116
279 HG LEU 117 HG LEU 117 20.325 10.478 -4.037
280 HD11 LEU 117 HD11 LEU 117 23.361 10.714 -3.802
281 HD12 LEU 117 HD12 LEU 117 22.181 11.991 -3.423
282 HD13 LEU 117 HD13 LEU 117 22.350 11.413 -5.090
283 HD21 LEU 117 HD21 LEU 117 20.788 8.126 -4.628
284 HD22 LEU 117 HD22 LEU 117 22.536 8.413 -4.455
285 HD23 LEU 117 HD23 LEU 117 21.612 9.218 -5.744
286 H VAL 118 H VAL 118 20.040 9.574 0.640
287 HA VAL 118 HA VAL 118 21.401 7.257 1.783
288 HB VAL 118 HB VAL 118 20.017 9.601 3.143
289 HG11 VAL 118 HG11 VAL 118 20.133 7.726 4.720
290 HG12 VAL 118 HG12 VAL 118 21.811 7.378 4.243
291 HG13 VAL 118 HG13 VAL 118 21.418 8.863 5.116
292 HG21 VAL 118 HG21 VAL 118 22.965 8.965 2.653
293 HG22 VAL 118 HG22 VAL 118 22.048 10.202 1.783
294 HG23 VAL 118 HG23 VAL 118 22.318 10.391 3.511
295 H CYS 119 H CYS 119 17.980 8.354 1.799
296 HA CYS 119 HA CYS 119 17.213 6.070 3.484
297 HB2 CYS 119 HB2 CYS 119 16.501 8.502 3.757
298 HB3 CYS 119 HB3 CYS 119 15.467 8.256 2.348
299 H GLY 120 H GLY 120 17.214 6.702 0.069
300 HA2 GLY 120 HA2 GLY 120 16.450 5.377 -1.699
301 HA3 GLY 120 HA3 GLY 120 15.642 4.303 -0.566
302 H GLU 121 H GLU 121 13.830 4.364 -2.025
303 HA GLU 121 HA GLU 121 12.525 6.785 -2.832
304 HB2 GLU 121 HB2 GLU 121 11.587 3.888 -2.898
305 HB3 GLU 121 HB3 GLU 121 10.786 5.236 -3.709
306 HG2 GLU 121 HG2 GLU 121 12.854 5.692 -5.016
307 HG3 GLU 121 HG3 GLU 121 13.615 4.279 -4.278
308 H ARG 122 H ARG 122 12.476 5.604 0.233
309 HA ARG 122 HA ARG 122 9.760 5.674 1.081
310 HB2 ARG 122 HB2 ARG 122 11.636 4.758 2.390
311 HB3 ARG 122 HB3 ARG 122 12.372 6.344 2.507
312 HG2 ARG 122 HG2 ARG 122 11.323 5.718 4.600
313 HG3 ARG 122 HG3 ARG 122 10.523 7.139 3.928
314 HD2 ARG 122 HD2 ARG 122 8.654 5.750 3.123
315 HD3 ARG 122 HD3 ARG 122 9.471 4.284 3.671
316 HE ARG 122 HE ARG 122 8.167 6.381 5.351
317 HH11 ARG 122 HH11 ARG 122 9.906 3.321 5.458
318 HH12 ARG 122 HH12 ARG 122 9.454 3.064 7.119
319 HH21 ARG 122 HH21 ARG 122 7.672 6.038 7.290
320 HH22 ARG 122 HH22 ARG 122 8.170 4.594 8.183
321 H GLY 123 H GLY 123 12.036 8.369 0.630
322 HA2 GLY 123 HA2 GLY 123 11.703 10.649 0.506
323 HA3 GLY 123 HA3 GLY 123 10.036 10.266 0.086
324 H PHE 124 H PHE 124 9.159 12.037 1.158
325 HA PHE 124 HA PHE 124 8.852 11.753 4.067
326 HB2 PHE 124 HB2 PHE 124 9.411 14.103 4.520
327 HB3 PHE 124 HB3 PHE 124 10.787 13.178 3.965
328 HD1 PHE 124 HD1 PHE 124 11.755 13.535 1.735
329 HD2 PHE 124 HD2 PHE 124 8.548 16.003 3.172
330 HE1 PHE 124 HE1 PHE 124 12.277 15.232 -0.015
331 HE2 PHE 124 HE2 PHE 124 9.037 17.680 1.416
332 HZ PHE 124 HZ PHE 124 10.906 17.304 -0.176
333 H PHE 125 H PHE 125 7.148 12.929 4.958
334 HA PHE 125 HA PHE 125 4.895 13.599 3.148
335 HB2 PHE 125 HB2 PHE 125 4.557 12.055 5.056
336 HB3 PHE 125 HB3 PHE 125 5.086 13.307 6.177
337 HD1 PHE 125 HD2 PHE 125 2.468 12.481 3.609
338 HD2 PHE 125 HD1 PHE 125 3.519 14.916 7.010
339 HE1 PHE 125 HE2 PHE 125 0.140 13.340 3.711
340 HE2 PHE 125 HE1 PHE 125 1.185 15.763 7.115
341 HZ PHE 125 HZ PHE 125 -0.501 14.978 5.464
342 H TYR 126 H TYR 126 3.642 15.594 3.660
343 HA TYR 126 HA TYR 126 5.167 17.921 3.310
344 HB2 TYR 126 HB2 TYR 126 2.792 17.603 2.701
345 HB3 TYR 126 HB3 TYR 126 2.346 17.654 4.404
346 HD1 TYR 126 HD1 TYR 126 3.956 19.662 1.675
347 HD2 TYR 126 HD2 TYR 126 1.890 19.745 5.461
348 HE1 TYR 126 HE1 TYR 126 3.747 22.139 1.509
349 HE2 TYR 126 HE2 TYR 126 1.656 22.216 5.284
350 HH TYR 126 HH TYR 126 2.107 24.087 4.037
351 H THR 127 H THR 127 5.885 19.558 4.564
352 HA THR 127 HA THR 127 7.203 20.283 6.266
353 HB THR 127 HB THR 127 5.950 21.079 8.253
354 HG1 THR 127 HG1 THR 127 3.685 21.003 8.110
355 HG21 THR 127 HG21 THR 127 4.801 21.728 5.519
356 HG22 THR 127 HG22 THR 127 6.250 22.447 6.253
357 HG23 THR 127 HG23 THR 127 4.659 22.738 6.976
358 HA PRO 128 HA PRO 128 8.015 16.004 7.828
359 HB2 PRO 128 HB2 PRO 128 10.754 17.318 7.853
360 HB3 PRO 128 HB3 PRO 128 10.344 15.615 7.483
361 HG2 PRO 128 HG2 PRO 128 10.744 17.324 5.455
362 HG3 PRO 128 HG3 PRO 128 9.320 16.229 5.413
363 HD2 PRO 128 HD2 PRO 128 9.429 19.155 6.161
364 HD3 PRO 128 HD3 PRO 128 8.229 18.289 5.161
365 H LYS 129 H LYS 129 7.767 15.384 9.874
366 HA LYS 129 HA LYS 129 7.916 17.426 12.010
367 HB2 LYS 129 HB2 LYS 129 6.593 14.681 11.991
368 HB3 LYS 129 HB3 LYS 129 6.514 15.868 13.280
369 HG2 LYS 129 HG2 LYS 129 4.550 16.343 12.308
370 HG3 LYS 129 HG3 LYS 129 5.553 17.475 11.402
371 HD2 LYS 129 HD2 LYS 129 5.598 15.860 9.473
372 HD3 LYS 129 HD3 LYS 129 4.719 14.690 10.458
373 HE2 LYS 129 HE2 LYS 129 3.048 15.642 9.119
374 HE3 LYS 129 HE3 LYS 129 2.857 16.429 10.689
375 HZ1 LYS 129 HZ1 LYS 129 4.129 17.578 8.259
376 HZ2 LYS 129 HZ2 LYS 129 4.230 18.303 9.703
377 HZ3 LYS 129 HZ3 LYS 129 2.767 18.097 8.992
378 H THR 130 H THR 130 8.687 17.003 14.102
379 HA THR 130 HA THR 130 11.204 15.494 14.233
380 HB THR 130 HB THR 130 11.293 16.491 16.545
381 HG1 THR 130 HG1 THR 130 9.810 18.129 16.996
382 HG21 THR 130 HG21 THR 130 10.875 18.501 14.287
383 HG22 THR 130 HG22 THR 130 12.377 17.601 14.594
384 HG23 THR 130 HG23 THR 130 11.775 18.764 15.790
385 H ARG 131 H ARG 131 11.686 14.185 16.160
386 HA ARG 131 HA ARG 131 9.460 12.334 16.879
387 HB2 ARG 131 HB2 ARG 131 11.195 11.375 15.383
388 HB3 ARG 131 HB3 ARG 131 12.426 11.749 16.597
389 HG2 ARG 131 HG2 ARG 131 11.281 10.213 18.209
390 HG3 ARG 131 HG3 ARG 131 10.036 9.888 16.995
391 HD2 ARG 131 HD2 ARG 131 11.593 8.058 16.993
392 HD3 ARG 131 HD3 ARG 131 11.778 8.955 15.477
393 HE ARG 131 HE ARG 131 13.633 9.957 17.415
394 HH11 ARG 131 HH11 ARG 131 13.206 7.074 15.463
395 HH12 ARG 131 HH12 ARG 131 14.916 6.722 15.464
396 HH21 ARG 131 HH21 ARG 131 15.791 9.449 17.343
397 HH22 ARG 131 HH22 ARG 131 16.332 8.038 16.487
Start of MODEL 8
1 H1 GLY 1 H1 GLY 1 14.425 24.047 11.065
2 H2 GLY 1 H2 GLY 1 13.192 25.094 10.782
3 H3 GLY 1 H3 GLY 1 14.649 25.344 10.079
4 HA2 GLY 1 HA2 GLY 1 12.784 23.132 9.512
5 HA3 GLY 1 HA3 GLY 1 13.164 24.485 8.433
6 H ILE 2 H ILE 2 13.407 21.926 7.524
7 HA ILE 2 HA ILE 2 15.821 20.540 7.981
8 HB ILE 2 HB ILE 2 14.181 20.561 5.415
9 HG12 ILE 2 HG12 ILE 2 12.601 20.161 7.192
10 HG13 ILE 2 HG13 ILE 2 12.876 18.688 6.300
11 HG21 ILE 2 HG21 ILE 2 14.961 18.176 5.243
12 HG22 ILE 2 HG22 ILE 2 16.246 19.373 5.083
13 HG23 ILE 2 HG23 ILE 2 16.053 18.492 6.609
14 HD11 ILE 2 HD11 ILE 2 14.299 17.814 8.111
15 HD12 ILE 2 HD12 ILE 2 14.101 19.324 9.028
16 HD13 ILE 2 HD13 ILE 2 12.703 18.275 8.716
17 H VAL 3 H VAL 3 15.055 22.907 5.422
18 HA VAL 3 HA VAL 3 17.367 22.515 3.889
19 HB VAL 3 HB VAL 3 15.150 23.776 3.444
20 HG11 VAL 3 HG11 VAL 3 16.865 26.216 3.948
21 HG12 VAL 3 HG12 VAL 3 15.257 26.162 3.209
22 HG13 VAL 3 HG13 VAL 3 15.450 25.708 4.906
23 HG21 VAL 3 HG21 VAL 3 17.776 24.623 2.150
24 HG22 VAL 3 HG22 VAL 3 16.828 23.166 1.752
25 HG23 VAL 3 HG23 VAL 3 16.158 24.773 1.422
26 H GLU 4 H GLU 4 16.796 24.842 6.384
27 HA GLU 4 HA GLU 4 19.087 26.450 6.224
28 HB2 GLU 4 HB2 GLU 4 17.656 25.525 8.750
29 HB3 GLU 4 HB3 GLU 4 18.757 26.908 8.647
30 HG2 GLU 4 HG2 GLU 4 17.246 28.069 7.112
31 HG3 GLU 4 HG3 GLU 4 16.150 26.691 7.079
32 H GLN 5 H GLN 5 18.784 23.386 8.048
33 HA GLN 5 HA GLN 5 21.259 23.626 9.392
34 HB2 GLN 5 HB2 GLN 5 19.325 22.303 10.128
35 HB3 GLN 5 HB3 GLN 5 19.603 21.130 8.837
36 HG2 GLN 5 HG2 GLN 5 21.655 20.378 9.821
37 HG3 GLN 5 HG3 GLN 5 21.755 21.797 10.875
38 HE21 GLN 5 HE21 GLN 5 19.751 18.817 10.323
39 HE22 GLN 5 HE22 GLN 5 19.325 18.684 12.026
40 H CYS 6 H CYS 6 20.536 21.964 6.314
41 HA CYS 6 HA CYS 6 23.409 21.226 6.058
42 HB2 CYS 6 HB2 CYS 6 21.114 20.494 4.235
43 HB3 CYS 6 HB3 CYS 6 22.759 19.870 4.183
44 H CYS 7 H CYS 7 21.297 23.741 4.922
45 HA CYS 7 HA CYS 7 23.000 24.326 2.608
46 HB2 CYS 7 HB2 CYS 7 20.565 24.551 2.619
47 HB3 CYS 7 HB3 CYS 7 20.679 25.869 3.789
48 H THR 8 H THR 8 22.529 25.693 5.900
49 HA THR 8 HA THR 8 24.567 27.771 5.413
50 HB THR 8 HB THR 8 24.158 28.515 7.668
51 HG1 THR 8 HG1 THR 8 22.273 26.406 7.878
52 HG21 THR 8 HG21 THR 8 21.518 27.937 6.257
53 HG22 THR 8 HG22 THR 8 22.617 29.284 5.905
54 HG23 THR 8 HG23 THR 8 21.818 29.186 7.486
55 H SER 9 H SER 9 24.611 24.543 6.653
56 HA SER 9 HA SER 9 27.502 24.738 7.313
57 HB2 SER 9 HB2 SER 9 25.386 23.495 9.132
58 HB3 SER 9 HB3 SER 9 27.130 23.313 9.328
59 HG SER 9 HG SER 9 25.652 25.737 9.470
60 H ILE 10 H ILE 10 28.559 22.581 7.315
61 HA ILE 10 HA ILE 10 27.570 20.807 5.292
62 HB ILE 10 HB ILE 10 29.386 19.289 5.962
63 HG12 ILE 10 HG12 ILE 10 30.018 21.346 8.123
64 HG13 ILE 10 HG13 ILE 10 29.473 19.689 8.380
65 HG21 ILE 10 HG21 ILE 10 30.393 22.134 5.666
66 HG22 ILE 10 HG22 ILE 10 31.153 20.623 5.098
67 HG23 ILE 10 HG23 ILE 10 29.667 21.186 4.351
68 HD11 ILE 10 HD11 ILE 10 31.834 19.779 8.774
69 HD12 ILE 10 HD12 ILE 10 31.581 18.871 7.271
70 HD13 ILE 10 HD13 ILE 10 32.147 20.559 7.223
71 H CYS 11 H CYS 11 26.725 18.744 5.360
72 HA CYS 11 HA CYS 11 25.580 17.828 7.975
73 HB2 CYS 11 HB2 CYS 11 24.381 18.094 5.246
74 HB3 CYS 11 HB3 CYS 11 23.895 16.705 6.219
75 H SER 12 H SER 12 25.311 15.685 8.387
76 HA SER 12 HA SER 12 27.220 13.792 7.100
77 HB2 SER 12 HB2 SER 12 25.702 13.579 9.732
78 HB3 SER 12 HB3 SER 12 26.949 12.465 9.140
79 HG SER 12 HG SER 12 27.702 14.044 10.688
80 H LEU 13 H LEU 13 26.526 11.551 6.807
81 HA LEU 13 HA LEU 13 24.037 11.033 5.545
82 HB2 LEU 13 HB2 LEU 13 25.849 9.175 7.151
83 HB3 LEU 13 HB3 LEU 13 24.553 8.633 6.091
84 HG LEU 13 HG LEU 13 27.039 10.147 5.186
85 HD11 LEU 13 HD11 LEU 13 27.678 8.001 4.168
86 HD12 LEU 13 HD12 LEU 13 26.229 7.225 4.851
87 HD13 LEU 13 HD13 LEU 13 27.507 7.834 5.922
88 HD21 LEU 13 HD21 LEU 13 26.254 9.476 2.898
89 HD22 LEU 13 HD22 LEU 13 25.163 10.618 3.682
90 HD23 LEU 13 HD23 LEU 13 24.746 8.885 3.623
91 H TYR 14 H TYR 14 24.923 10.668 8.993
92 HA TYR 14 HA TYR 14 22.496 9.567 9.903
93 HB2 TYR 14 HB2 TYR 14 24.362 11.393 11.456
94 HB3 TYR 14 HB3 TYR 14 23.287 10.167 12.113
95 HD1 TYR 14 HD1 TYR 14 23.688 7.689 11.177
96 HD2 TYR 14 HD2 TYR 14 26.642 10.840 11.152
97 HE1 TYR 14 HE1 TYR 14 25.499 5.996 10.997
98 HE2 TYR 14 HE2 TYR 14 28.447 9.141 10.965
99 HH TYR 14 HH TYR 14 27.755 5.623 10.852
100 H GLN 15 H GLN 15 23.067 12.862 8.918
101 HA GLN 15 HA GLN 15 20.644 13.895 10.304
102 HB2 GLN 15 HB2 GLN 15 22.611 15.239 8.411
103 HB3 GLN 15 HB3 GLN 15 21.241 16.027 9.168
104 HG2 GLN 15 HG2 GLN 15 23.587 14.799 10.683
105 HG3 GLN 15 HG3 GLN 15 23.415 16.502 10.280
106 HE21 GLN 15 HE21 GLN 15 23.804 16.013 12.901
107 HE22 GLN 15 HE22 GLN 15 22.293 16.209 13.778
108 H LEU 16 H LEU 16 21.852 13.278 6.984
109 HA LEU 16 HA LEU 16 19.428 13.940 5.620
110 HB2 LEU 16 HB2 LEU 16 21.768 12.133 4.926
111 HB3 LEU 16 HB3 LEU 16 20.508 12.553 3.768
112 HG LEU 16 HG LEU 16 22.204 14.669 5.180
113 HD11 LEU 16 HD11 LEU 16 22.655 13.327 2.486
114 HD12 LEU 16 HD12 LEU 16 23.675 13.162 3.923
115 HD13 LEU 16 HD13 LEU 16 23.547 14.728 3.120
116 HD21 LEU 16 HD21 LEU 16 21.485 16.085 3.289
117 HD22 LEU 16 HD22 LEU 16 20.088 15.490 4.188
118 HD23 LEU 16 HD23 LEU 16 20.522 14.739 2.638
119 H GLU 17 H GLU 17 20.458 10.863 7.097
120 HA GLU 17 HA GLU 17 18.213 9.343 6.117
121 HB2 GLU 17 HB2 GLU 17 20.552 8.607 7.088
122 HB3 GLU 17 HB3 GLU 17 19.741 8.694 8.647
123 HG2 GLU 17 HG2 GLU 17 18.009 7.083 7.731
124 HG3 GLU 17 HG3 GLU 17 18.920 7.023 6.219
125 H ASN 18 H ASN 18 18.381 11.747 8.605
126 HA ASN 18 HA ASN 18 16.186 10.613 10.228
127 HB2 ASN 18 HB2 ASN 18 18.155 11.723 11.260
128 HB3 ASN 18 HB3 ASN 18 17.723 13.233 10.459
129 HD21 ASN 18 HD21 ASN 18 16.507 14.630 11.681
130 HD22 ASN 18 HD22 ASN 18 15.481 14.123 13.015
131 H TYR 19 H TYR 19 16.607 13.122 7.757
132 HA TYR 19 HA TYR 19 14.188 14.522 8.255
133 HB2 TYR 19 HB2 TYR 19 15.775 14.291 5.683
134 HB3 TYR 19 HB3 TYR 19 14.665 15.596 6.095
135 HD1 TYR 19 HD2 TYR 19 15.602 16.021 9.034
136 HD2 TYR 19 HD1 TYR 19 17.703 15.587 5.289
137 HE1 TYR 19 HE2 TYR 19 17.435 17.443 9.894
138 HE2 TYR 19 HE1 TYR 19 19.565 16.949 6.179
139 HH TYR 19 HH TYR 19 20.327 18.209 7.929
140 H CYS 20 H CYS 20 14.576 11.527 6.478
141 HA CYS 20 HA CYS 20 12.540 11.998 4.545
142 HB2 CYS 20 HB2 CYS 20 12.713 9.560 4.121
143 HB3 CYS 20 HB3 CYS 20 14.245 10.439 4.068
144 H ASN 21 H ASN 21 10.508 11.127 4.252
145 HA ASN 21 HA ASN 21 8.823 10.900 6.624
146 HB2 ASN 21 HB2 ASN 21 8.264 12.274 4.595
147 HB3 ASN 21 HB3 ASN 21 8.124 10.776 3.664
148 HD21 ASN 21 HD21 ASN 21 5.890 11.487 3.223
149 HD22 ASN 21 HD22 ASN 21 4.664 11.237 4.471
150 H GLY 22 H GLY 22 10.320 8.849 7.031
151 HA2 GLY 22 HA2 GLY 22 8.589 6.513 6.865
152 HA3 GLY 22 HA3 GLY 22 10.015 6.347 5.846
153 H1 PHE 101 H1 PHE 101 30.425 8.197 0.203
154 H2 PHE 101 H2 PHE 101 31.387 8.289 1.527
155 H3 PHE 101 H3 PHE 101 31.892 8.915 0.099
156 HA PHE 101 HA PHE 101 30.195 10.591 0.132
157 HB2 PHE 101 HB2 PHE 101 28.499 9.243 1.342
158 HB3 PHE 101 HB3 PHE 101 29.438 9.367 2.817
159 HD1 PHE 101 HD2 PHE 101 27.466 11.339 0.312
160 HD2 PHE 101 HD1 PHE 101 29.250 11.305 4.243
161 HE1 PHE 101 HE2 PHE 101 26.253 13.426 0.890
162 HE2 PHE 101 HE1 PHE 101 28.026 13.385 4.813
163 HZ PHE 101 HZ PHE 101 26.516 14.445 3.141
164 H VAL 102 H VAL 102 30.513 12.636 1.164
165 HA VAL 102 HA VAL 102 32.386 12.850 3.410
166 HB VAL 102 HB VAL 102 33.855 12.988 1.434
167 HG11 VAL 102 HG11 VAL 102 32.368 15.539 0.683
168 HG12 VAL 102 HG12 VAL 102 33.820 14.882 -0.085
169 HG13 VAL 102 HG13 VAL 102 32.288 13.998 -0.205
170 HG21 VAL 102 HG21 VAL 102 33.624 15.666 2.857
171 HG22 VAL 102 HG22 VAL 102 34.392 14.203 3.528
172 HG23 VAL 102 HG23 VAL 102 35.057 14.972 2.085
173 H ASN 103 H ASN 103 31.964 14.652 4.713
174 HA ASN 103 HA ASN 103 29.283 15.625 4.571
175 HB2 ASN 103 HB2 ASN 103 31.679 16.338 6.309
176 HB3 ASN 103 HB3 ASN 103 30.137 17.188 6.421
177 HD21 ASN 103 HD21 ASN 103 29.968 16.505 8.612
178 HD22 ASN 103 HD22 ASN 103 29.226 14.939 8.891
179 H GLN 104 H GLN 104 28.396 17.358 3.719
180 HA GLN 104 HA GLN 104 29.984 19.558 2.535
181 HB2 GLN 104 HB2 GLN 104 29.165 19.083 0.286
182 HB3 GLN 104 HB3 GLN 104 30.095 17.729 0.908
183 HG2 GLN 104 HG2 GLN 104 27.826 16.639 1.536
184 HG3 GLN 104 HG3 GLN 104 27.082 17.917 0.565
185 HE21 GLN 104 HE21 GLN 104 29.361 15.155 0.483
186 HE22 GLN 104 HE22 GLN 104 29.170 14.861 -1.246
187 H HIS 105 H HIS 105 28.587 21.208 1.493
188 HA HIS 105 HA HIS 105 26.121 21.727 3.001
189 HB2 HIS 105 HB2 HIS 105 27.568 23.266 0.821
190 HB3 HIS 105 HB3 HIS 105 26.016 23.750 1.492
191 HD1 HIS 105 HD1 HIS 105 26.181 25.400 3.461
192 HD2 HIS 105 HD2 HIS 105 29.635 23.072 2.861
193 HE1 HIS 105 HE1 HIS 105 27.934 26.265 5.105
194 H LEU 106 H LEU 106 24.099 21.554 2.245
195 HA LEU 106 HA LEU 106 23.482 20.716 -0.546
196 HB2 LEU 106 HB2 LEU 106 22.641 19.257 1.986
197 HB3 LEU 106 HB3 LEU 106 21.939 18.970 0.400
198 HG LEU 106 HG LEU 106 24.894 18.540 1.001
199 HD11 LEU 106 HD11 LEU 106 24.316 16.140 1.119
200 HD12 LEU 106 HD12 LEU 106 22.593 16.592 1.099
201 HD13 LEU 106 HD13 LEU 106 23.636 17.096 2.445
202 HD21 LEU 106 HD21 LEU 106 24.787 17.112 -1.019
203 HD22 LEU 106 HD22 LEU 106 24.380 18.791 -1.388
204 HD23 LEU 106 HD23 LEU 106 23.088 17.570 -1.253
205 H CYS 107 H CYS 107 21.810 21.888 -1.289
206 HA CYS 107 HA CYS 107 19.891 23.113 0.646
207 HB2 CYS 107 HB2 CYS 107 21.970 24.525 -0.160
208 HB3 CYS 107 HB3 CYS 107 21.045 24.708 -1.640
209 H GLY 108 H GLY 108 17.824 23.491 -0.142
210 HA2 GLY 108 HA2 GLY 108 15.935 23.094 -1.399
211 HA3 GLY 108 HA3 GLY 108 16.918 23.640 -2.755
212 H SER 109 H SER 109 16.683 22.266 -4.411
213 HA SER 109 HA SER 109 15.706 19.623 -4.351
214 HB2 SER 109 HB2 SER 109 16.645 19.511 -6.686
215 HB3 SER 109 HB3 SER 109 15.576 20.892 -6.365
216 HG SER 109 HG SER 109 17.479 21.518 -7.485
217 H HIS 110 H HIS 110 19.104 20.731 -4.074
218 HA HIS 110 HA HIS 110 20.206 18.121 -4.571
219 HB2 HIS 110 HB2 HIS 110 21.352 20.464 -4.684
220 HB3 HIS 110 HB3 HIS 110 21.585 20.270 -2.943
221 HD1 HIS 110 HD1 HIS 110 24.268 20.383 -3.774
222 HD2 HIS 110 HD2 HIS 110 22.011 16.981 -4.811
223 HE1 HIS 110 HE1 HIS 110 25.946 18.574 -4.404
224 H LEU 111 H LEU 111 19.057 19.759 -1.660
225 HA LEU 111 HA LEU 111 20.029 17.792 0.250
226 HB2 LEU 111 HB2 LEU 111 19.276 20.328 0.489
227 HB3 LEU 111 HB3 LEU 111 17.679 19.649 0.703
228 HG LEU 111 HG LEU 111 20.151 19.148 2.426
229 HD11 LEU 111 HD11 LEU 111 17.496 20.537 2.947
230 HD12 LEU 111 HD12 LEU 111 19.058 21.356 2.689
231 HD13 LEU 111 HD13 LEU 111 18.808 20.348 4.130
232 HD21 LEU 111 HD21 LEU 111 18.570 18.013 4.006
233 HD22 LEU 111 HD22 LEU 111 18.842 17.109 2.520
234 HD23 LEU 111 HD23 LEU 111 17.334 18.033 2.727
235 H VAL 112 H VAL 112 16.908 18.396 -1.423
236 HA VAL 112 HA VAL 112 15.480 16.157 -0.359
237 HB VAL 112 HB VAL 112 15.173 17.545 -3.048
238 HG11 VAL 112 HG11 VAL 112 12.837 16.631 -2.979
239 HG12 VAL 112 HG12 VAL 112 14.063 15.382 -3.189
240 HG13 VAL 112 HG13 VAL 112 13.312 15.616 -1.597
241 HG21 VAL 112 HG21 VAL 112 13.295 18.714 -1.937
242 HG22 VAL 112 HG22 VAL 112 13.675 17.895 -0.405
243 HG23 VAL 112 HG23 VAL 112 14.813 19.052 -1.108
244 H GLU 113 H GLU 113 17.481 16.394 -3.363
245 HA GLU 113 HA GLU 113 17.202 13.660 -4.123
246 HB2 GLU 113 HB2 GLU 113 18.047 15.477 -5.572
247 HB3 GLU 113 HB3 GLU 113 19.529 15.563 -4.605
248 HG2 GLU 113 HG2 GLU 113 20.130 13.277 -5.264
249 HG3 GLU 113 HG3 GLU 113 18.575 13.064 -6.073
250 H ALA 114 H ALA 114 19.661 15.218 -1.982
251 HA ALA 114 HA ALA 114 21.179 12.862 -1.529
252 HB1 ALA 114 HB1 ALA 114 22.088 14.106 0.386
253 HB2 ALA 114 HB2 ALA 114 21.982 15.129 -1.061
254 HB3 ALA 114 HB3 ALA 114 20.786 15.305 0.244
255 H LEU 115 H LEU 115 18.350 14.120 0.407
256 HA LEU 115 HA LEU 115 18.520 11.857 2.218
257 HB2 LEU 115 HB2 LEU 115 16.494 12.605 3.220
258 HB3 LEU 115 HB3 LEU 115 17.620 13.921 2.966
259 HG LEU 115 HG LEU 115 16.194 14.447 0.842
260 HD11 LEU 115 HD11 LEU 115 14.156 12.893 2.490
261 HD12 LEU 115 HD12 LEU 115 14.725 12.432 0.873
262 HD13 LEU 115 HD13 LEU 115 13.797 13.908 1.080
263 HD21 LEU 115 HD21 LEU 115 16.340 15.843 2.885
264 HD22 LEU 115 HD22 LEU 115 14.999 14.902 3.592
265 HD23 LEU 115 HD23 LEU 115 14.736 15.882 2.142
266 H TYR 116 H TYR 116 16.822 12.323 -0.880
267 HA TYR 116 HA TYR 116 15.485 9.746 -0.776
268 HB2 TYR 116 HB2 TYR 116 15.981 11.872 -2.796
269 HB3 TYR 116 HB3 TYR 116 15.821 10.260 -3.448
270 HD1 TYR 116 HD1 TYR 116 13.808 8.817 -2.737
271 HD2 TYR 116 HD2 TYR 116 13.971 13.096 -2.276
272 HE1 TYR 116 HE1 TYR 116 11.320 8.890 -2.572
273 HE2 TYR 116 HE2 TYR 116 11.478 13.176 -2.162
274 HH TYR 116 HH TYR 116 9.498 10.195 -2.316
275 H LEU 117 H LEU 117 18.837 10.562 -1.421
276 HA LEU 117 HA LEU 117 19.397 7.861 -2.493
277 HB2 LEU 117 HB2 LEU 117 20.846 10.457 -2.258
278 HB3 LEU 117 HB3 LEU 117 21.838 9.056 -1.965
279 HG LEU 117 HG LEU 117 21.931 9.823 -4.292
280 HD11 LEU 117 HD11 LEU 117 21.744 7.670 -5.370
281 HD12 LEU 117 HD12 LEU 117 20.674 7.058 -4.090
282 HD13 LEU 117 HD13 LEU 117 22.365 7.449 -3.724
283 HD21 LEU 117 HD21 LEU 117 20.105 9.461 -5.861
284 HD22 LEU 117 HD22 LEU 117 19.608 10.597 -4.598
285 HD23 LEU 117 HD23 LEU 117 19.034 8.917 -4.554
286 H VAL 118 H VAL 118 19.953 9.641 0.555
287 HA VAL 118 HA VAL 118 21.357 7.423 1.786
288 HB VAL 118 HB VAL 118 20.188 9.967 2.982
289 HG11 VAL 118 HG11 VAL 118 20.475 8.284 4.757
290 HG12 VAL 118 HG12 VAL 118 22.123 7.941 4.201
291 HG13 VAL 118 HG13 VAL 118 21.724 9.532 4.878
292 HG21 VAL 118 HG21 VAL 118 23.015 9.158 2.162
293 HG22 VAL 118 HG22 VAL 118 22.027 10.374 1.359
294 HG23 VAL 118 HG23 VAL 118 22.592 10.664 3.006
295 H CYS 119 H CYS 119 17.972 8.592 2.035
296 HA CYS 119 HA CYS 119 17.281 6.243 3.735
297 HB2 CYS 119 HB2 CYS 119 16.774 8.548 4.469
298 HB3 CYS 119 HB3 CYS 119 15.708 8.743 3.080
299 H GLY 120 H GLY 120 17.382 6.883 0.451
300 HA2 GLY 120 HA2 GLY 120 16.554 5.687 -1.357
301 HA3 GLY 120 HA3 GLY 120 15.846 4.550 -0.222
302 H GLU 121 H GLU 121 13.917 4.302 -1.176
303 HA GLU 121 HA GLU 121 12.366 6.381 -2.411
304 HB2 GLU 121 HB2 GLU 121 10.819 4.571 -2.935
305 HB3 GLU 121 HB3 GLU 121 12.487 4.227 -3.364
306 HG2 GLU 121 HG2 GLU 121 11.424 3.180 -0.737
307 HG3 GLU 121 HG3 GLU 121 10.921 2.403 -2.229
308 H ARG 122 H ARG 122 12.700 6.989 0.254
309 HA ARG 122 HA ARG 122 9.938 6.976 1.470
310 HB2 ARG 122 HB2 ARG 122 12.688 6.716 2.753
311 HB3 ARG 122 HB3 ARG 122 11.188 6.864 3.666
312 HG2 ARG 122 HG2 ARG 122 10.372 4.732 2.832
313 HG3 ARG 122 HG3 ARG 122 11.717 4.616 1.699
314 HD2 ARG 122 HD2 ARG 122 13.272 4.703 3.784
315 HD3 ARG 122 HD3 ARG 122 11.809 4.393 4.724
316 HE ARG 122 HE ARG 122 11.817 2.184 3.961
317 HH11 ARG 122 HH21 ARG 122 14.144 3.952 1.995
318 HH12 ARG 122 HH22 ARG 122 14.172 2.679 0.782
319 HH21 ARG 122 HH11 ARG 122 12.280 0.470 2.574
320 HH22 ARG 122 HH12 ARG 122 13.448 0.702 1.294
321 H GLY 123 H GLY 123 12.143 9.069 0.128
322 HA2 GLY 123 HA2 GLY 123 12.845 10.983 1.944
323 HA3 GLY 123 HA3 GLY 123 12.512 11.346 0.257
324 H PHE 124 H PHE 124 9.982 11.515 -0.163
325 HA PHE 124 HA PHE 124 8.565 12.843 2.126
326 HB2 PHE 124 HB2 PHE 124 8.853 13.879 -0.714
327 HB3 PHE 124 HB3 PHE 124 7.598 14.418 0.392
328 HD1 PHE 124 HD2 PHE 124 11.237 14.442 -0.262
329 HD2 PHE 124 HD1 PHE 124 8.078 15.833 2.310
330 HE1 PHE 124 HE2 PHE 124 12.794 16.087 0.762
331 HE2 PHE 124 HE1 PHE 124 9.632 17.485 3.331
332 HZ PHE 124 HZ PHE 124 11.991 17.609 2.561
333 H PHE 125 H PHE 125 8.257 11.282 -1.040
334 HA PHE 125 HA PHE 125 5.765 9.921 -0.133
335 HB2 PHE 125 HB2 PHE 125 4.915 10.078 -2.446
336 HB3 PHE 125 HB3 PHE 125 5.060 11.632 -1.658
337 HD1 PHE 125 HD1 PHE 125 6.520 9.432 -4.286
338 HD2 PHE 125 HD2 PHE 125 6.581 13.345 -2.479
339 HE1 PHE 125 HE1 PHE 125 7.900 10.281 -6.164
340 HE2 PHE 125 HE2 PHE 125 7.949 14.193 -4.366
341 HZ PHE 125 HZ PHE 125 8.613 12.664 -6.210
342 H TYR 126 H TYR 126 5.368 7.845 -1.205
343 HA TYR 126 HA TYR 126 7.794 6.273 -1.358
344 HB2 TYR 126 HB2 TYR 126 5.847 5.354 -0.279
345 HB3 TYR 126 HB3 TYR 126 4.882 5.555 -1.738
346 HD1 TYR 126 HD1 TYR 126 7.961 3.824 -0.444
347 HD2 TYR 126 HD2 TYR 126 4.725 3.776 -3.302
348 HE1 TYR 126 HE1 TYR 126 8.684 1.577 -1.226
349 HE2 TYR 126 HE2 TYR 126 5.450 1.517 -4.073
350 HH TYR 126 HH TYR 126 8.270 -0.165 -2.652
351 H THR 127 H THR 127 8.746 5.276 -3.052
352 HA THR 127 HA THR 127 7.709 5.761 -5.817
353 HB THR 127 HB THR 127 10.623 5.534 -5.019
354 HG1 THR 127 HG1 THR 127 10.651 7.717 -5.623
355 HG21 THR 127 HG21 THR 127 11.030 6.261 -7.356
356 HG22 THR 127 HG22 THR 127 9.286 6.166 -7.691
357 HG23 THR 127 HG23 THR 127 10.216 4.698 -7.305
358 HA PRO 128 HA PRO 128 7.239 1.331 -5.710
359 HB2 PRO 128 HB2 PRO 128 7.640 1.565 -8.697
360 HB3 PRO 128 HB3 PRO 128 6.435 0.593 -7.791
361 HG2 PRO 128 HG2 PRO 128 5.702 2.960 -8.858
362 HG3 PRO 128 HG3 PRO 128 5.204 2.558 -7.180
363 HD2 PRO 128 HD2 PRO 128 7.491 4.329 -8.085
364 HD3 PRO 128 HD3 PRO 128 6.281 4.591 -6.790
365 H LYS 129 H LYS 129 8.518 -0.361 -5.378
366 HA LYS 129 HA LYS 129 11.357 -0.179 -5.611
367 HB2 LYS 129 HB2 LYS 129 11.410 -2.378 -4.600
368 HB3 LYS 129 HB3 LYS 129 10.225 -1.343 -3.806
369 HG2 LYS 129 HG2 LYS 129 8.480 -2.535 -5.385
370 HG3 LYS 129 HG3 LYS 129 9.742 -3.740 -5.607
371 HD2 LYS 129 HD2 LYS 129 8.459 -2.860 -2.984
372 HD3 LYS 129 HD3 LYS 129 8.137 -4.365 -3.825
373 HE2 LYS 129 HE2 LYS 129 10.883 -3.617 -2.720
374 HE3 LYS 129 HE3 LYS 129 9.657 -4.471 -1.777
375 HZ1 LYS 129 HZ1 LYS 129 9.685 -6.236 -3.476
376 HZ2 LYS 129 HZ2 LYS 129 11.152 -6.048 -2.790
377 HZ3 LYS 129 HZ3 LYS 129 10.889 -5.482 -4.294
378 H THR 130 H THR 130 12.866 -1.231 -6.820
379 HA THR 130 HA THR 130 12.072 -1.668 -9.604
380 HB THR 130 HB THR 130 14.554 -1.652 -9.985
381 HG1 THR 130 HG1 THR 130 15.842 -1.076 -8.232
382 HG21 THR 130 HG21 THR 130 13.522 0.698 -8.333
383 HG22 THR 130 HG22 THR 130 13.211 0.438 -10.065
384 HG23 THR 130 HG23 THR 130 14.867 0.709 -9.498
385 H ARG 131 H ARG 131 12.659 -3.791 -7.021
386 HA ARG 131 HA ARG 131 12.765 -6.147 -8.820
387 HB2 ARG 131 HB2 ARG 131 15.113 -5.592 -8.161
388 HB3 ARG 131 HB3 ARG 131 14.645 -5.721 -6.460
389 HG2 ARG 131 HG2 ARG 131 14.086 -8.115 -6.783
390 HG3 ARG 131 HG3 ARG 131 14.473 -7.975 -8.513
391 HD2 ARG 131 HD2 ARG 131 16.806 -7.379 -7.938
392 HD3 ARG 131 HD3 ARG 131 16.436 -7.501 -6.219
393 HE ARG 131 HE ARG 131 16.840 -9.692 -8.142
394 HH11 ARG 131 HH11 ARG 131 15.684 -8.956 -4.910
395 HH12 ARG 131 HH12 ARG 131 15.847 -10.611 -4.389
396 HH21 ARG 131 HH21 ARG 131 17.005 -11.769 -7.407
397 HH22 ARG 131 HH22 ARG 131 16.572 -12.151 -5.766
Start of MODEL 9
1 H1 GLY 1 H1 GLY 1 16.666 25.260 11.267
2 H2 GLY 1 H2 GLY 1 15.419 26.321 11.312
3 H3 GLY 1 H3 GLY 1 16.474 26.359 10.068
4 HA2 GLY 1 HA2 GLY 1 14.517 24.241 10.675
5 HA3 GLY 1 HA3 GLY 1 14.466 25.338 9.283
6 H ILE 2 H ILE 2 14.254 22.796 8.668
7 HA ILE 2 HA ILE 2 16.497 21.135 8.654
8 HB ILE 2 HB ILE 2 14.281 20.343 8.433
9 HG12 ILE 2 HG12 ILE 2 16.294 19.076 7.427
10 HG13 ILE 2 HG13 ILE 2 14.660 18.491 7.200
11 HG21 ILE 2 HG21 ILE 2 13.164 22.026 7.084
12 HG22 ILE 2 HG22 ILE 2 14.092 21.545 5.642
13 HG23 ILE 2 HG23 ILE 2 12.930 20.432 6.379
14 HD11 ILE 2 HD11 ILE 2 14.606 19.249 4.884
15 HD12 ILE 2 HD12 ILE 2 16.220 19.994 5.054
16 HD13 ILE 2 HD13 ILE 2 16.019 18.237 5.177
17 H VAL 3 H VAL 3 15.515 23.371 6.027
18 HA VAL 3 HA VAL 3 17.551 22.572 4.205
19 HB VAL 3 HB VAL 3 16.228 25.297 4.400
20 HG11 VAL 3 HG11 VAL 3 18.253 25.386 2.995
21 HG12 VAL 3 HG12 VAL 3 17.737 23.923 2.127
22 HG13 VAL 3 HG13 VAL 3 16.811 25.433 1.978
23 HG21 VAL 3 HG21 VAL 3 14.539 23.530 4.090
24 HG22 VAL 3 HG22 VAL 3 14.761 24.424 2.592
25 HG23 VAL 3 HG23 VAL 3 15.495 22.813 2.772
26 H GLU 4 H GLU 4 17.557 25.239 6.613
27 HA GLU 4 HA GLU 4 20.182 26.207 6.116
28 HB2 GLU 4 HB2 GLU 4 18.603 26.094 8.708
29 HB3 GLU 4 HB3 GLU 4 20.030 27.092 8.438
30 HG2 GLU 4 HG2 GLU 4 18.896 28.403 6.745
31 HG3 GLU 4 HG3 GLU 4 17.463 27.360 6.814
32 H GLN 5 H GLN 5 19.085 23.561 8.264
33 HA GLN 5 HA GLN 5 21.478 23.100 9.623
34 HB2 GLN 5 HB2 GLN 5 19.220 22.234 10.165
35 HB3 GLN 5 HB3 GLN 5 19.342 21.080 8.842
36 HG2 GLN 5 HG2 GLN 5 19.832 20.065 11.048
37 HG3 GLN 5 HG3 GLN 5 21.155 19.909 9.911
38 HE21 GLN 5 HE21 GLN 5 22.878 19.758 11.362
39 HE22 GLN 5 HE22 GLN 5 23.251 21.009 12.557
40 H CYS 6 H CYS 6 20.671 22.118 6.358
41 HA CYS 6 HA CYS 6 23.365 20.806 6.126
42 HB2 CYS 6 HB2 CYS 6 20.725 20.146 4.897
43 HB3 CYS 6 HB3 CYS 6 22.160 19.891 3.925
44 H CYS 7 H CYS 7 21.545 23.553 5.004
45 HA CYS 7 HA CYS 7 23.303 23.966 2.684
46 HB2 CYS 7 HB2 CYS 7 20.885 24.187 2.540
47 HB3 CYS 7 HB3 CYS 7 20.903 25.494 3.723
48 H THR 8 H THR 8 22.761 25.590 5.846
49 HA THR 8 HA THR 8 25.096 27.385 5.270
50 HB THR 8 HB THR 8 24.262 28.828 7.072
51 HG1 THR 8 HG1 THR 8 22.202 28.545 7.840
52 HG21 THR 8 HG21 THR 8 22.200 28.372 4.868
53 HG22 THR 8 HG22 THR 8 23.692 29.321 4.700
54 HG23 THR 8 HG23 THR 8 22.429 29.860 5.821
55 H SER 9 H SER 9 23.719 25.065 7.553
56 HA SER 9 HA SER 9 26.329 24.844 8.995
57 HB2 SER 9 HB2 SER 9 23.621 23.560 9.461
58 HB3 SER 9 HB3 SER 9 25.098 23.122 10.348
59 HG SER 9 HG SER 9 23.830 24.737 11.435
60 H ILE 10 H ILE 10 27.396 22.712 9.074
61 HA ILE 10 HA ILE 10 27.498 21.596 6.394
62 HB ILE 10 HB ILE 10 29.273 20.134 7.258
63 HG12 ILE 10 HG12 ILE 10 29.030 21.673 9.878
64 HG13 ILE 10 HG13 ILE 10 28.475 20.013 9.642
65 HG21 ILE 10 HG21 ILE 10 30.919 21.925 7.385
66 HG22 ILE 10 HG22 ILE 10 29.666 22.334 6.215
67 HG23 ILE 10 HG23 ILE 10 29.653 23.100 7.817
68 HD11 ILE 10 HD11 ILE 10 30.802 19.328 9.053
69 HD12 ILE 10 HD12 ILE 10 31.356 20.980 9.429
70 HD13 ILE 10 HD13 ILE 10 30.647 19.976 10.700
71 H CYS 11 H CYS 11 27.175 19.578 5.655
72 HA CYS 11 HA CYS 11 24.916 18.157 6.950
73 HB2 CYS 11 HB2 CYS 11 24.776 19.517 4.770
74 HB3 CYS 11 HB3 CYS 11 25.707 18.226 4.036
75 H SER 12 H SER 12 24.746 15.861 6.810
76 HA SER 12 HA SER 12 27.010 14.162 5.955
77 HB2 SER 12 HB2 SER 12 26.166 14.361 8.879
78 HB3 SER 12 HB3 SER 12 27.266 13.155 8.198
79 HG SER 12 HG SER 12 28.303 14.998 9.221
80 H LEU 13 H LEU 13 26.466 11.880 5.972
81 HA LEU 13 HA LEU 13 23.907 11.039 5.229
82 HB2 LEU 13 HB2 LEU 13 25.994 9.546 6.890
83 HB3 LEU 13 HB3 LEU 13 24.577 8.782 6.173
84 HG LEU 13 HG LEU 13 26.830 10.095 4.613
85 HD11 LEU 13 HD11 LEU 13 27.533 8.030 5.744
86 HD12 LEU 13 HD12 LEU 13 27.392 7.753 3.996
87 HD13 LEU 13 HD13 LEU 13 26.123 7.175 5.089
88 HD21 LEU 13 HD21 LEU 13 25.809 8.951 2.651
89 HD22 LEU 13 HD22 LEU 13 24.754 10.193 3.334
90 HD23 LEU 13 HD23 LEU 13 24.439 8.468 3.676
91 H TYR 14 H TYR 14 25.147 11.135 8.564
92 HA TYR 14 HA TYR 14 22.788 9.985 9.748
93 HB2 TYR 14 HB2 TYR 14 23.875 10.552 11.892
94 HB3 TYR 14 HB3 TYR 14 24.881 9.649 10.790
95 HD1 TYR 14 HD1 TYR 14 24.239 13.132 12.030
96 HD2 TYR 14 HD2 TYR 14 27.047 10.398 10.225
97 HE1 TYR 14 HE1 TYR 14 26.061 14.819 12.295
98 HE2 TYR 14 HE2 TYR 14 28.861 12.066 10.502
99 HH TYR 14 HH TYR 14 29.436 14.158 11.276
100 H GLN 15 H GLN 15 23.090 13.037 8.444
101 HA GLN 15 HA GLN 15 20.970 14.206 10.190
102 HB2 GLN 15 HB2 GLN 15 22.717 15.519 8.074
103 HB3 GLN 15 HB3 GLN 15 21.416 16.295 8.971
104 HG2 GLN 15 HG2 GLN 15 22.585 15.780 11.119
105 HG3 GLN 15 HG3 GLN 15 23.918 15.053 10.213
106 HE21 GLN 15 HE21 GLN 15 25.492 16.463 9.233
107 HE22 GLN 15 HE22 GLN 15 25.350 18.216 9.359
108 H LEU 16 H LEU 16 21.704 13.441 6.721
109 HA LEU 16 HA LEU 16 19.048 13.967 5.771
110 HB2 LEU 16 HB2 LEU 16 21.195 12.083 4.695
111 HB3 LEU 16 HB3 LEU 16 19.702 12.474 3.883
112 HG LEU 16 HG LEU 16 21.163 13.738 2.753
113 HD11 LEU 16 HD11 LEU 16 20.295 15.755 4.859
114 HD12 LEU 16 HD12 LEU 16 19.300 15.182 3.503
115 HD13 LEU 16 HD13 LEU 16 20.784 16.086 3.188
116 HD21 LEU 16 HD21 LEU 16 23.085 13.381 4.303
117 HD22 LEU 16 HD22 LEU 16 22.528 14.810 5.216
118 HD23 LEU 16 HD23 LEU 16 23.016 14.957 3.507
119 H GLU 17 H GLU 17 20.409 11.059 7.291
120 HA GLU 17 HA GLU 17 18.290 9.238 6.840
121 HB2 GLU 17 HB2 GLU 17 20.311 9.587 9.066
122 HB3 GLU 17 HB3 GLU 17 19.053 8.352 9.178
123 HG2 GLU 17 HG2 GLU 17 19.764 7.397 7.003
124 HG3 GLU 17 HG3 GLU 17 21.093 8.546 6.937
125 H ASN 18 H ASN 18 18.069 12.148 8.695
126 HA ASN 18 HA ASN 18 15.699 11.192 10.230
127 HB2 ASN 18 HB2 ASN 18 16.987 13.953 10.158
128 HB3 ASN 18 HB3 ASN 18 15.744 13.391 11.275
129 HD21 ASN 18 HD21 ASN 18 19.087 13.375 10.441
130 HD22 ASN 18 HD22 ASN 18 19.686 12.487 11.834
131 H TYR 19 H TYR 19 16.517 13.652 7.749
132 HA TYR 19 HA TYR 19 13.894 14.657 7.520
133 HB2 TYR 19 HB2 TYR 19 16.078 14.903 5.462
134 HB3 TYR 19 HB3 TYR 19 14.803 16.072 5.828
135 HD1 TYR 19 HD1 TYR 19 15.071 16.109 8.883
136 HD2 TYR 19 HD2 TYR 19 18.010 16.185 5.727
137 HE1 TYR 19 HE1 TYR 19 16.715 17.128 10.444
138 HE2 TYR 19 HE2 TYR 19 19.647 17.242 7.290
139 HH TYR 19 HH TYR 19 18.856 17.847 10.726
140 H CYS 20 H CYS 20 14.972 11.736 6.252
141 HA CYS 20 HA CYS 20 13.144 11.699 3.946
142 HB2 CYS 20 HB2 CYS 20 14.066 9.508 3.591
143 HB3 CYS 20 HB3 CYS 20 15.358 10.679 3.858
144 H ASN 21 H ASN 21 12.864 10.936 7.321
145 HA ASN 21 HA ASN 21 10.311 9.432 6.827
146 HB2 ASN 21 HB2 ASN 21 12.198 7.822 7.084
147 HB3 ASN 21 HB3 ASN 21 12.590 8.531 8.647
148 HD21 ASN 21 HD21 ASN 21 11.027 8.198 10.468
149 HD22 ASN 21 HD22 ASN 21 9.906 6.855 10.321
150 H GLY 22 H GLY 22 12.354 11.177 9.151
151 HA2 GLY 22 HA2 GLY 22 11.869 12.338 11.100
152 HA3 GLY 22 HA3 GLY 22 10.144 12.274 10.705
153 H1 PHE 101 H1 PHE 101 29.675 9.685 2.168
154 H2 PHE 101 H2 PHE 101 28.895 9.652 3.613
155 H3 PHE 101 H3 PHE 101 30.504 9.935 3.557
156 HA PHE 101 HA PHE 101 30.205 12.013 2.441
157 HB2 PHE 101 HB2 PHE 101 28.260 11.574 1.123
158 HB3 PHE 101 HB3 PHE 101 27.263 11.284 2.548
159 HD1 PHE 101 HD1 PHE 101 29.406 13.977 0.980
160 HD2 PHE 101 HD2 PHE 101 25.985 13.050 3.444
161 HE1 PHE 101 HE1 PHE 101 28.825 16.388 1.087
162 HE2 PHE 101 HE2 PHE 101 25.409 15.464 3.539
163 HZ PHE 101 HZ PHE 101 26.832 17.132 2.357
164 H VAL 102 H VAL 102 30.988 13.266 3.947
165 HA VAL 102 HA VAL 102 29.275 14.178 6.138
166 HB VAL 102 HB VAL 102 31.098 14.153 7.789
167 HG11 VAL 102 HG11 VAL 102 30.433 11.329 6.884
168 HG12 VAL 102 HG12 VAL 102 30.906 11.869 8.507
169 HG13 VAL 102 HG13 VAL 102 29.362 12.385 7.820
170 HG21 VAL 102 HG21 VAL 102 33.034 12.686 7.567
171 HG22 VAL 102 HG22 VAL 102 32.559 12.249 5.916
172 HG23 VAL 102 HG23 VAL 102 33.057 13.908 6.299
173 H ASN 103 H ASN 103 29.876 16.221 6.935
174 HA ASN 103 HA ASN 103 30.175 18.327 6.649
175 HB2 ASN 103 HB2 ASN 103 32.327 19.164 6.750
176 HB3 ASN 103 HB3 ASN 103 32.338 17.624 7.543
177 HD21 ASN 103 HD21 ASN 103 34.036 16.259 7.006
178 HD22 ASN 103 HD22 ASN 103 34.995 16.438 5.547
179 H GLN 104 H GLN 104 31.307 20.182 5.118
180 HA GLN 104 HA GLN 104 30.679 21.550 3.440
181 HB2 GLN 104 HB2 GLN 104 30.512 19.113 1.638
182 HB3 GLN 104 HB3 GLN 104 30.533 20.803 1.148
183 HG2 GLN 104 HG2 GLN 104 32.789 21.072 2.177
184 HG3 GLN 104 HG3 GLN 104 32.796 19.350 2.561
185 HE21 GLN 104 HE21 GLN 104 34.910 19.905 1.156
186 HE22 GLN 104 HE22 GLN 104 34.697 19.527 -0.550
187 H HIS 105 H HIS 105 28.747 21.620 1.501
188 HA HIS 105 HA HIS 105 26.296 21.395 3.200
189 HB2 HIS 105 HB2 HIS 105 27.059 23.603 1.278
190 HB3 HIS 105 HB3 HIS 105 25.605 23.537 2.261
191 HD1 HIS 105 HD1 HIS 105 26.235 23.405 5.093
192 HD2 HIS 105 HD2 HIS 105 29.061 24.884 2.336
193 HE1 HIS 105 HE1 HIS 105 27.949 24.739 6.446
194 H LEU 106 H LEU 106 24.292 21.252 2.285
195 HA LEU 106 HA LEU 106 23.922 20.703 -0.596
196 HB2 LEU 106 HB2 LEU 106 22.922 18.932 1.676
197 HB3 LEU 106 HB3 LEU 106 22.311 18.850 0.026
198 HG LEU 106 HG LEU 106 25.207 18.301 0.796
199 HD11 LEU 106 HD11 LEU 106 24.589 15.926 0.402
200 HD12 LEU 106 HD12 LEU 106 22.893 16.433 0.208
201 HD13 LEU 106 HD13 LEU 106 23.714 16.637 1.769
202 HD21 LEU 106 HD21 LEU 106 23.667 17.776 -1.786
203 HD22 LEU 106 HD22 LEU 106 25.336 17.273 -1.448
204 HD23 LEU 106 HD23 LEU 106 24.956 18.989 -1.570
205 H CYS 107 H CYS 107 22.063 21.673 -1.359
206 HA CYS 107 HA CYS 107 20.194 22.898 0.623
207 HB2 CYS 107 HB2 CYS 107 22.245 24.323 -0.309
208 HB3 CYS 107 HB3 CYS 107 21.208 24.485 -1.718
209 H GLY 108 H GLY 108 18.135 23.526 -0.198
210 HA2 GLY 108 HA2 GLY 108 16.205 23.221 -1.424
211 HA3 GLY 108 HA3 GLY 108 17.238 23.567 -2.802
212 H SER 109 H SER 109 16.714 22.166 -4.366
213 HA SER 109 HA SER 109 15.600 19.565 -4.067
214 HB2 SER 109 HB2 SER 109 16.274 19.299 -6.474
215 HB3 SER 109 HB3 SER 109 15.309 20.755 -6.118
216 HG SER 109 HG SER 109 17.149 21.172 -7.483
217 H HIS 110 H HIS 110 19.032 20.544 -4.051
218 HA HIS 110 HA HIS 110 19.987 17.862 -4.555
219 HB2 HIS 110 HB2 HIS 110 21.220 20.160 -4.853
220 HB3 HIS 110 HB3 HIS 110 21.606 20.000 -3.137
221 HD1 HIS 110 HD1 HIS 110 24.196 19.952 -4.224
222 HD2 HIS 110 HD2 HIS 110 21.691 16.639 -4.919
223 HE1 HIS 110 HE1 HIS 110 25.720 18.041 -4.948
224 H LEU 111 H LEU 111 19.135 19.674 -1.661
225 HA LEU 111 HA LEU 111 20.083 17.761 0.316
226 HB2 LEU 111 HB2 LEU 111 19.461 20.269 0.531
227 HB3 LEU 111 HB3 LEU 111 17.787 19.737 0.603
228 HG LEU 111 HG LEU 111 20.013 19.027 2.563
229 HD11 LEU 111 HD11 LEU 111 18.681 20.503 4.082
230 HD12 LEU 111 HD12 LEU 111 17.588 20.866 2.731
231 HD13 LEU 111 HD13 LEU 111 19.300 21.372 2.670
232 HD21 LEU 111 HD21 LEU 111 18.159 18.227 4.032
233 HD22 LEU 111 HD22 LEU 111 18.398 17.210 2.615
234 HD23 LEU 111 HD23 LEU 111 17.040 18.363 2.660
235 H VAL 112 H VAL 112 16.897 18.365 -1.264
236 HA VAL 112 HA VAL 112 15.540 16.141 -0.082
237 HB VAL 112 HB VAL 112 14.929 17.485 -2.732
238 HG11 VAL 112 HG11 VAL 112 12.621 16.655 -2.310
239 HG12 VAL 112 HG12 VAL 112 13.745 15.322 -2.540
240 HG13 VAL 112 HG13 VAL 112 13.205 15.743 -0.899
241 HG21 VAL 112 HG21 VAL 112 14.899 19.097 -0.853
242 HG22 VAL 112 HG22 VAL 112 13.258 18.752 -1.402
243 HG23 VAL 112 HG23 VAL 112 13.874 18.009 0.085
244 H GLU 113 H GLU 113 17.339 16.343 -3.213
245 HA GLU 113 HA GLU 113 16.915 13.626 -3.967
246 HB2 GLU 113 HB2 GLU 113 17.732 15.397 -5.466
247 HB3 GLU 113 HB3 GLU 113 19.266 15.458 -4.584
248 HG2 GLU 113 HG2 GLU 113 19.793 13.167 -5.250
249 HG3 GLU 113 HG3 GLU 113 18.184 12.958 -5.952
250 H ALA 114 H ALA 114 19.484 15.073 -1.880
251 HA ALA 114 HA ALA 114 20.914 12.641 -1.521
252 HB1 ALA 114 HB1 ALA 114 21.966 13.815 0.366
253 HB2 ALA 114 HB2 ALA 114 21.860 14.842 -1.080
254 HB3 ALA 114 HB3 ALA 114 20.734 15.086 0.279
255 H LEU 115 H LEU 115 18.210 14.009 0.506
256 HA LEU 115 HA LEU 115 18.363 11.763 2.350
257 HB2 LEU 115 HB2 LEU 115 16.288 12.589 3.327
258 HB3 LEU 115 HB3 LEU 115 17.515 13.813 3.154
259 HG LEU 115 HG LEU 115 16.289 14.448 0.964
260 HD11 LEU 115 HD11 LEU 115 13.974 14.048 0.823
261 HD12 LEU 115 HD12 LEU 115 13.909 13.303 2.446
262 HD13 LEU 115 HD13 LEU 115 14.650 12.454 1.096
263 HD21 LEU 115 HD21 LEU 115 16.400 15.840 3.030
264 HD22 LEU 115 HD22 LEU 115 14.879 15.075 3.559
265 HD23 LEU 115 HD23 LEU 115 14.920 16.049 2.087
266 H TYR 116 H TYR 116 16.608 12.208 -0.708
267 HA TYR 116 HA TYR 116 15.192 9.694 -0.534
268 HB2 TYR 116 HB2 TYR 116 15.838 11.697 -2.648
269 HB3 TYR 116 HB3 TYR 116 15.572 10.067 -3.214
270 HD1 TYR 116 HD1 TYR 116 13.972 12.823 -1.254
271 HD2 TYR 116 HD2 TYR 116 13.399 9.117 -3.375
272 HE1 TYR 116 HE1 TYR 116 11.513 13.152 -1.150
273 HE2 TYR 116 HE2 TYR 116 10.929 9.450 -3.287
274 HH TYR 116 HH TYR 116 9.209 10.791 -2.561
275 H LEU 117 H LEU 117 18.452 10.507 -1.866
276 HA LEU 117 HA LEU 117 19.016 7.793 -2.692
277 HB2 LEU 117 HB2 LEU 117 20.734 10.233 -2.161
278 HB3 LEU 117 HB3 LEU 117 21.423 8.710 -2.709
279 HG LEU 117 HG LEU 117 19.297 10.235 -4.280
280 HD11 LEU 117 HD11 LEU 117 21.387 11.533 -4.082
281 HD12 LEU 117 HD12 LEU 117 21.161 10.927 -5.734
282 HD13 LEU 117 HD13 LEU 117 22.321 10.129 -4.649
283 HD21 LEU 117 HD21 LEU 117 20.060 8.815 -6.158
284 HD22 LEU 117 HD22 LEU 117 19.348 7.852 -4.863
285 HD23 LEU 117 HD23 LEU 117 21.117 7.910 -5.047
286 H VAL 118 H VAL 118 19.689 9.532 0.346
287 HA VAL 118 HA VAL 118 21.328 7.461 1.493
288 HB VAL 118 HB VAL 118 19.908 9.877 2.653
289 HG11 VAL 118 HG11 VAL 118 21.300 9.569 4.695
290 HG12 VAL 118 HG12 VAL 118 20.070 8.320 4.526
291 HG13 VAL 118 HG13 VAL 118 21.761 7.955 4.113
292 HG21 VAL 118 HG21 VAL 118 22.839 9.171 2.159
293 HG22 VAL 118 HG22 VAL 118 21.889 10.263 1.162
294 HG23 VAL 118 HG23 VAL 118 22.248 10.710 2.836
295 H CYS 119 H CYS 119 17.799 8.021 1.610
296 HA CYS 119 HA CYS 119 17.548 5.667 3.433
297 HB2 CYS 119 HB2 CYS 119 15.556 7.840 2.769
298 HB3 CYS 119 HB3 CYS 119 15.412 6.590 4.007
299 H GLY 120 H GLY 120 16.859 6.436 0.099
300 HA2 GLY 120 HA2 GLY 120 15.807 5.209 -1.546
301 HA3 GLY 120 HA3 GLY 120 15.732 3.836 -0.442
302 H GLU 121 H GLU 121 13.707 3.169 -0.129
303 HA GLU 121 HA GLU 121 11.470 4.590 -1.134
304 HB2 GLU 121 HB2 GLU 121 10.162 2.625 -0.448
305 HB3 GLU 121 HB3 GLU 121 11.609 2.263 -1.364
306 HG2 GLU 121 HG2 GLU 121 11.349 0.601 0.324
307 HG3 GLU 121 HG3 GLU 121 12.787 1.542 0.669
308 H ARG 122 H ARG 122 12.796 5.130 1.883
309 HA ARG 122 HA ARG 122 10.448 5.705 3.465
310 HB2 ARG 122 HB2 ARG 122 13.183 7.049 3.503
311 HB3 ARG 122 HB3 ARG 122 11.967 7.198 4.754
312 HG2 ARG 122 HG2 ARG 122 13.361 4.577 4.036
313 HG3 ARG 122 HG3 ARG 122 13.828 5.675 5.332
314 HD2 ARG 122 HD2 ARG 122 12.612 3.967 6.383
315 HD3 ARG 122 HD3 ARG 122 11.574 5.388 6.367
316 HE ARG 122 HE ARG 122 11.324 3.224 4.298
317 HH11 ARG 122 HH11 ARG 122 9.680 5.091 6.830
318 HH12 ARG 122 HH12 ARG 122 8.144 4.387 6.413
319 HH21 ARG 122 HH21 ARG 122 9.352 2.498 3.790
320 HH22 ARG 122 HH22 ARG 122 7.954 2.952 4.751
321 H GLY 123 H GLY 123 12.074 7.605 0.971
322 HA2 GLY 123 HA2 GLY 123 11.294 9.414 -0.239
323 HA3 GLY 123 HA3 GLY 123 9.735 9.273 0.567
324 H PHE 124 H PHE 124 9.203 10.997 1.784
325 HA PHE 124 HA PHE 124 11.316 12.846 2.794
326 HB2 PHE 124 HB2 PHE 124 9.980 13.459 0.693
327 HB3 PHE 124 HB3 PHE 124 8.562 13.559 1.720
328 HD1 PHE 124 HD1 PHE 124 12.083 14.746 1.527
329 HD2 PHE 124 HD2 PHE 124 8.040 15.740 2.511
330 HE1 PHE 124 HE1 PHE 124 12.792 17.108 1.942
331 HE2 PHE 124 HE2 PHE 124 8.725 18.101 2.965
332 HZ PHE 124 HZ PHE 124 11.099 18.775 2.693
333 H PHE 125 H PHE 125 11.039 13.773 4.837
334 HA PHE 125 HA PHE 125 9.145 12.469 6.612
335 HB2 PHE 125 HB2 PHE 125 10.250 13.403 8.357
336 HB3 PHE 125 HB3 PHE 125 11.519 13.092 7.197
337 HD1 PHE 125 HD2 PHE 125 11.136 15.741 5.501
338 HD2 PHE 125 HD1 PHE 125 11.326 14.925 9.737
339 HE1 PHE 125 HE2 PHE 125 11.918 18.038 5.913
340 HE2 PHE 125 HE1 PHE 125 12.126 17.226 10.141
341 HZ PHE 125 HZ PHE 125 12.402 18.803 8.237
342 H TYR 126 H TYR 126 8.821 15.269 4.726
343 HA TYR 126 HA TYR 126 7.425 17.014 4.603
344 HB2 TYR 126 HB2 TYR 126 5.536 15.432 6.349
345 HB3 TYR 126 HB3 TYR 126 5.129 16.826 5.378
346 HD1 TYR 126 HD2 TYR 126 5.212 16.739 2.885
347 HD2 TYR 126 HD1 TYR 126 5.795 13.237 5.328
348 HE1 TYR 126 HE2 TYR 126 4.864 15.290 0.884
349 HE2 TYR 126 HE1 TYR 126 5.442 11.781 3.331
350 HH TYR 126 HH TYR 126 4.775 13.152 0.079
351 H THR 127 H THR 127 6.120 18.742 5.874
352 HA THR 127 HA THR 127 8.023 20.213 7.166
353 HB THR 127 HB THR 127 5.036 20.560 7.556
354 HG1 THR 127 HG1 THR 127 5.175 21.753 5.641
355 HG21 THR 127 HG21 THR 127 5.622 22.984 7.566
356 HG22 THR 127 HG22 THR 127 7.349 22.562 7.475
357 HG23 THR 127 HG23 THR 127 6.396 22.129 8.911
358 HA PRO 128 HA PRO 128 7.951 18.360 11.274
359 HB2 PRO 128 HB2 PRO 128 9.937 19.778 12.498
360 HB3 PRO 128 HB3 PRO 128 10.249 18.559 11.223
361 HG2 PRO 128 HG2 PRO 128 10.024 21.571 10.892
362 HG3 PRO 128 HG3 PRO 128 11.313 20.478 10.277
363 HD2 PRO 128 HD2 PRO 128 9.226 21.279 8.723
364 HD3 PRO 128 HD3 PRO 128 9.907 19.626 8.588
365 H LYS 129 H LYS 129 7.472 18.881 13.473
366 HA LYS 129 HA LYS 129 5.572 21.073 13.806
367 HB2 LYS 129 HB2 LYS 129 5.075 20.060 15.972
368 HB3 LYS 129 HB3 LYS 129 4.982 18.934 14.644
369 HG2 LYS 129 HG2 LYS 129 5.904 17.762 16.463
370 HG3 LYS 129 HG3 LYS 129 7.218 17.978 15.318
371 HD2 LYS 129 HD2 LYS 129 8.185 19.762 16.702
372 HD3 LYS 129 HD3 LYS 129 6.748 19.747 17.758
373 HE2 LYS 129 HE2 LYS 129 7.285 17.406 18.399
374 HE3 LYS 129 HE3 LYS 129 8.717 17.447 17.356
375 HZ1 LYS 129 HZ1 LYS 129 8.257 19.233 19.695
376 HZ2 LYS 129 HZ2 LYS 129 9.579 19.261 18.738
377 HZ3 LYS 129 HZ3 LYS 129 9.282 17.956 19.677
378 H THR 130 H THR 130 5.573 22.332 15.880
379 HA THR 130 HA THR 130 7.812 24.132 15.737
380 HB THR 130 HB THR 130 5.462 24.811 16.090
381 HG1 THR 130 HG1 THR 130 6.029 26.486 17.453
382 HG21 THR 130 HG21 THR 130 4.836 23.169 17.890
383 HG22 THR 130 HG22 THR 130 4.496 24.854 18.319
384 HG23 THR 130 HG23 THR 130 5.914 24.036 19.008
385 H ARG 131 H ARG 131 9.054 24.986 17.488
386 HA ARG 131 HA ARG 131 9.731 23.230 19.742
387 HB2 ARG 131 HB2 ARG 131 11.138 22.310 17.962
388 HB3 ARG 131 HB3 ARG 131 11.700 23.921 17.515
389 HG2 ARG 131 HG2 ARG 131 13.416 22.699 18.752
390 HG3 ARG 131 HG3 ARG 131 12.919 24.146 19.615
391 HD2 ARG 131 HD2 ARG 131 11.372 22.643 21.018
392 HD3 ARG 131 HD3 ARG 131 12.142 21.270 20.236
393 HE ARG 131 HE ARG 131 14.053 21.613 21.524
394 HH11 ARG 131 HH21 ARG 131 12.016 24.491 21.920
395 HH12 ARG 131 HH22 ARG 131 12.982 25.046 23.264
396 HH21 ARG 131 HH11 ARG 131 15.205 22.435 23.220
397 HH22 ARG 131 HH12 ARG 131 14.731 23.933 23.965
Start of MODEL 10
1 H1 GLY 1 H1 GLY 1 13.366 23.933 11.814
2 H2 GLY 1 H2 GLY 1 14.920 23.572 11.417
3 H3 GLY 1 H3 GLY 1 13.881 22.375 11.877
4 HA2 GLY 1 HA2 GLY 1 12.531 22.760 9.906
5 HA3 GLY 1 HA3 GLY 1 13.699 24.005 9.424
6 H ILE 2 H ILE 2 15.130 23.314 7.977
7 HA ILE 2 HA ILE 2 16.498 20.776 8.112
8 HB ILE 2 HB ILE 2 14.432 19.875 7.273
9 HG12 ILE 2 HG12 ILE 2 16.563 19.914 5.112
10 HG13 ILE 2 HG13 ILE 2 16.553 18.892 6.546
11 HG21 ILE 2 HG21 ILE 2 13.335 20.433 5.260
12 HG22 ILE 2 HG22 ILE 2 13.558 21.960 6.100
13 HG23 ILE 2 HG23 ILE 2 14.624 21.529 4.732
14 HD11 ILE 2 HD11 ILE 2 14.316 17.952 5.689
15 HD12 ILE 2 HD12 ILE 2 14.662 18.780 4.161
16 HD13 ILE 2 HD13 ILE 2 15.769 17.533 4.757
17 H VAL 3 H VAL 3 15.580 23.373 5.764
18 HA VAL 3 HA VAL 3 18.016 23.208 4.274
19 HB VAL 3 HB VAL 3 16.167 25.606 4.547
20 HG11 VAL 3 HG11 VAL 3 16.997 26.179 2.277
21 HG12 VAL 3 HG12 VAL 3 18.308 26.177 3.457
22 HG13 VAL 3 HG13 VAL 3 18.115 24.802 2.341
23 HG21 VAL 3 HG21 VAL 3 16.083 23.247 2.608
24 HG22 VAL 3 HG22 VAL 3 14.839 23.689 3.811
25 HG23 VAL 3 HG23 VAL 3 15.134 24.739 2.432
26 H GLU 4 H GLU 4 17.104 25.183 7.104
27 HA GLU 4 HA GLU 4 19.608 26.638 7.155
28 HB2 GLU 4 HB2 GLU 4 18.747 27.788 8.937
29 HB3 GLU 4 HB3 GLU 4 17.350 27.454 7.933
30 HG2 GLU 4 HG2 GLU 4 18.154 26.113 10.532
31 HG3 GLU 4 HG3 GLU 4 16.799 27.200 10.281
32 H GLN 5 H GLN 5 19.141 23.429 7.764
33 HA GLN 5 HA GLN 5 21.279 23.278 9.833
34 HB2 GLN 5 HB2 GLN 5 19.634 21.029 8.616
35 HB3 GLN 5 HB3 GLN 5 20.750 20.923 9.969
36 HG2 GLN 5 HG2 GLN 5 18.095 22.405 9.912
37 HG3 GLN 5 HG3 GLN 5 18.443 20.922 10.767
38 HE21 GLN 5 HE21 GLN 5 17.685 23.860 11.572
39 HE22 GLN 5 HE22 GLN 5 18.788 24.142 12.928
40 H CYS 6 H CYS 6 20.540 22.314 6.453
41 HA CYS 6 HA CYS 6 23.365 21.391 6.161
42 HB2 CYS 6 HB2 CYS 6 20.893 20.599 4.603
43 HB3 CYS 6 HB3 CYS 6 22.517 19.953 4.407
44 H CYS 7 H CYS 7 21.294 23.897 4.848
45 HA CYS 7 HA CYS 7 22.988 24.186 2.450
46 HB2 CYS 7 HB2 CYS 7 20.554 24.603 2.426
47 HB3 CYS 7 HB3 CYS 7 20.772 25.956 3.534
48 H THR 8 H THR 8 22.325 26.099 5.421
49 HA THR 8 HA THR 8 24.561 27.915 4.937
50 HB THR 8 HB THR 8 23.771 28.901 7.134
51 HG1 THR 8 HG1 THR 8 21.892 28.107 7.975
52 HG21 THR 8 HG21 THR 8 22.916 29.736 4.956
53 HG22 THR 8 HG22 THR 8 21.680 29.808 6.227
54 HG23 THR 8 HG23 THR 8 21.617 28.526 4.997
55 H SER 9 H SER 9 24.305 24.888 6.507
56 HA SER 9 HA SER 9 27.028 25.170 7.622
57 HB2 SER 9 HB2 SER 9 25.337 25.617 9.454
58 HB3 SER 9 HB3 SER 9 24.791 23.942 9.266
59 HG SER 9 HG SER 9 26.434 24.222 10.888
60 H ILE 10 H ILE 10 27.784 22.907 8.378
61 HA ILE 10 HA ILE 10 27.679 21.313 5.933
62 HB ILE 10 HB ILE 10 29.295 20.788 8.454
63 HG12 ILE 10 HG12 ILE 10 30.142 22.385 6.000
64 HG13 ILE 10 HG13 ILE 10 29.761 23.086 7.575
65 HG21 ILE 10 HG21 ILE 10 29.743 19.971 5.544
66 HG22 ILE 10 HG22 ILE 10 30.767 19.523 6.927
67 HG23 ILE 10 HG23 ILE 10 29.141 18.885 6.824
68 HD11 ILE 10 HD11 ILE 10 32.122 23.002 7.417
69 HD12 ILE 10 HD12 ILE 10 31.630 21.768 8.586
70 HD13 ILE 10 HD13 ILE 10 32.122 21.301 6.936
71 H CYS 11 H CYS 11 26.831 19.296 5.618
72 HA CYS 11 HA CYS 11 25.732 17.784 7.934
73 HB2 CYS 11 HB2 CYS 11 24.337 18.510 5.359
74 HB3 CYS 11 HB3 CYS 11 23.907 17.044 6.231
75 H SER 12 H SER 12 25.415 15.548 7.578
76 HA SER 12 HA SER 12 26.886 14.225 5.338
77 HB2 SER 12 HB2 SER 12 26.970 13.540 8.306
78 HB3 SER 12 HB3 SER 12 27.599 12.502 7.011
79 HG SER 12 HG SER 12 29.123 14.015 8.104
80 H LEU 13 H LEU 13 26.049 12.124 4.776
81 HA LEU 13 HA LEU 13 23.263 11.981 4.536
82 HB2 LEU 13 HB2 LEU 13 25.292 9.714 4.476
83 HB3 LEU 13 HB3 LEU 13 23.639 9.608 3.894
84 HG LEU 13 HG LEU 13 25.846 11.333 2.715
85 HD11 LEU 13 HD11 LEU 13 25.975 8.931 2.209
86 HD12 LEU 13 HD12 LEU 13 25.540 9.857 0.763
87 HD13 LEU 13 HD13 LEU 13 24.291 8.941 1.643
88 HD21 LEU 13 HD21 LEU 13 22.913 11.106 1.889
89 HD22 LEU 13 HD22 LEU 13 24.196 11.840 0.900
90 HD23 LEU 13 HD23 LEU 13 23.762 12.577 2.438
91 H TYR 14 H TYR 14 25.195 10.619 7.149
92 HA TYR 14 HA TYR 14 23.245 9.041 8.441
93 HB2 TYR 14 HB2 TYR 14 25.354 10.667 9.886
94 HB3 TYR 14 HB3 TYR 14 24.725 9.083 10.309
95 HD1 TYR 14 HD1 TYR 14 25.102 7.235 8.327
96 HD2 TYR 14 HD2 TYR 14 27.496 10.766 8.968
97 HE1 TYR 14 HE1 TYR 14 26.977 6.194 7.051
98 HE2 TYR 14 HE2 TYR 14 29.362 9.728 7.677
99 HH TYR 14 HH TYR 14 29.116 6.453 6.266
100 H GLN 15 H GLN 15 23.525 12.527 8.366
101 HA GLN 15 HA GLN 15 21.638 13.001 10.607
102 HB2 GLN 15 HB2 GLN 15 23.022 14.894 8.655
103 HB3 GLN 15 HB3 GLN 15 22.017 15.387 10.002
104 HG2 GLN 15 HG2 GLN 15 23.590 14.447 11.623
105 HG3 GLN 15 HG3 GLN 15 24.583 13.772 10.324
106 HE21 GLN 15 HE21 GLN 15 23.545 16.877 11.820
107 HE22 GLN 15 HE22 GLN 15 24.861 17.789 11.088
108 H LEU 16 H LEU 16 21.673 12.941 7.038
109 HA LEU 16 HA LEU 16 19.162 14.319 6.726
110 HB2 LEU 16 HB2 LEU 16 20.842 12.584 4.881
111 HB3 LEU 16 HB3 LEU 16 19.273 13.176 4.411
112 HG LEU 16 HG LEU 16 20.757 14.622 3.434
113 HD11 LEU 16 HD11 LEU 16 20.356 16.816 4.307
114 HD12 LEU 16 HD12 LEU 16 20.102 16.199 5.948
115 HD13 LEU 16 HD13 LEU 16 18.918 15.853 4.675
116 HD21 LEU 16 HD21 LEU 16 22.802 14.119 4.651
117 HD22 LEU 16 HD22 LEU 16 22.214 15.044 6.059
118 HD23 LEU 16 HD23 LEU 16 22.557 15.858 4.524
119 H GLU 17 H GLU 17 19.916 10.956 7.302
120 HA GLU 17 HA GLU 17 17.462 9.693 6.789
121 HB2 GLU 17 HB2 GLU 17 19.425 9.327 9.087
122 HB3 GLU 17 HB3 GLU 17 18.062 8.242 8.780
123 HG2 GLU 17 HG2 GLU 17 18.949 7.771 6.508
124 HG3 GLU 17 HG3 GLU 17 20.359 8.776 6.865
125 H ASN 18 H ASN 18 18.043 12.125 9.247
126 HA ASN 18 HA ASN 18 15.871 11.584 11.032
127 HB2 ASN 18 HB2 ASN 18 17.816 13.145 11.389
128 HB3 ASN 18 HB3 ASN 18 17.150 14.227 10.168
129 HD21 ASN 18 HD21 ASN 18 17.295 15.807 11.934
130 HD22 ASN 18 HD22 ASN 18 15.973 15.877 13.097
131 H TYR 19 H TYR 19 15.988 13.430 7.956
132 HA TYR 19 HA TYR 19 13.313 14.497 8.336
133 HB2 TYR 19 HB2 TYR 19 15.114 14.732 5.911
134 HB3 TYR 19 HB3 TYR 19 13.775 15.783 6.357
135 HD1 TYR 19 HD1 TYR 19 13.960 16.925 8.765
136 HD2 TYR 19 HD2 TYR 19 17.299 15.379 6.515
137 HE1 TYR 19 HE1 TYR 19 15.511 18.267 10.156
138 HE2 TYR 19 HE2 TYR 19 18.863 16.704 7.948
139 HH TYR 19 HH TYR 19 17.687 18.767 10.628
140 H CYS 20 H CYS 20 14.427 11.602 6.966
141 HA CYS 20 HA CYS 20 12.401 11.139 4.984
142 HB2 CYS 20 HB2 CYS 20 14.139 9.209 6.556
143 HB3 CYS 20 HB3 CYS 20 13.282 8.849 5.063
144 H ASN 21 H ASN 21 11.615 11.667 8.054
145 HA ASN 21 HA ASN 21 9.787 9.345 8.430
146 HB2 ASN 21 HB2 ASN 21 10.959 11.342 10.404
147 HB3 ASN 21 HB3 ASN 21 9.812 10.078 10.810
148 HD21 ASN 21 HD21 ASN 21 13.162 10.767 10.257
149 HD22 ASN 21 HD22 ASN 21 13.718 9.102 10.366
150 H GLY 22 H GLY 22 9.441 12.117 6.894
151 HA2 GLY 22 HA2 GLY 22 6.616 12.130 6.980
152 HA3 GLY 22 HA3 GLY 22 7.185 13.479 7.972
153 H1 PHE 101 H1 PHE 101 30.417 13.772 -1.229
154 H2 PHE 101 H2 PHE 101 29.358 13.010 -2.220
155 H3 PHE 101 H3 PHE 101 30.496 12.147 -1.405
156 HA PHE 101 HA PHE 101 28.270 13.634 -0.187
157 HB2 PHE 101 HB2 PHE 101 27.429 11.374 0.500
158 HB3 PHE 101 HB3 PHE 101 27.349 11.699 -1.217
159 HD1 PHE 101 HD1 PHE 101 29.336 9.841 1.388
160 HD2 PHE 101 HD2 PHE 101 28.372 10.242 -2.805
161 HE1 PHE 101 HE1 PHE 101 30.545 7.741 0.913
162 HE2 PHE 101 HE2 PHE 101 29.597 8.133 -3.276
163 HZ PHE 101 HZ PHE 101 30.685 6.882 -1.417
164 H VAL 102 H VAL 102 27.959 13.156 2.111
165 HA VAL 102 HA VAL 102 28.573 13.325 4.253
166 HB VAL 102 HB VAL 102 30.816 11.466 3.472
167 HG11 VAL 102 HG11 VAL 102 31.144 11.002 5.856
168 HG12 VAL 102 HG12 VAL 102 31.606 12.658 5.465
169 HG13 VAL 102 HG13 VAL 102 30.057 12.333 6.285
170 HG21 VAL 102 HG21 VAL 102 29.431 9.818 4.625
171 HG22 VAL 102 HG22 VAL 102 28.263 11.059 5.096
172 HG23 VAL 102 HG23 VAL 102 28.454 10.612 3.388
173 H ASN 103 H ASN 103 29.396 14.788 5.582
174 HA ASN 103 HA ASN 103 30.164 16.797 6.124
175 HB2 ASN 103 HB2 ASN 103 32.085 15.164 6.501
176 HB3 ASN 103 HB3 ASN 103 32.852 15.847 5.073
177 HD21 ASN 103 HD21 ASN 103 33.112 18.326 5.165
178 HD22 ASN 103 HD22 ASN 103 33.599 18.974 6.734
179 H GLN 104 H GLN 104 28.701 17.381 4.143
180 HA GLN 104 HA GLN 104 30.128 19.443 2.539
181 HB2 GLN 104 HB2 GLN 104 28.337 17.231 1.441
182 HB3 GLN 104 HB3 GLN 104 28.693 18.703 0.536
183 HG2 GLN 104 HG2 GLN 104 30.807 16.716 1.442
184 HG3 GLN 104 HG3 GLN 104 30.065 16.765 -0.145
185 HE21 GLN 104 HE21 GLN 104 32.286 18.493 2.039
186 HE22 GLN 104 HE22 GLN 104 32.970 19.513 0.763
187 H HIS 105 H HIS 105 28.629 20.935 1.432
188 HA HIS 105 HA HIS 105 26.233 21.574 3.068
189 HB2 HIS 105 HB2 HIS 105 27.703 23.093 0.886
190 HB3 HIS 105 HB3 HIS 105 26.153 23.591 1.558
191 HD1 HIS 105 HD1 HIS 105 26.245 25.025 3.712
192 HD2 HIS 105 HD2 HIS 105 29.807 22.966 2.827
193 HE1 HIS 105 HE1 HIS 105 27.977 25.793 5.436
194 H LEU 106 H LEU 106 24.191 21.472 2.301
195 HA LEU 106 HA LEU 106 23.585 20.408 -0.421
196 HB2 LEU 106 HB2 LEU 106 22.714 19.233 2.251
197 HB3 LEU 106 HB3 LEU 106 22.012 18.786 0.704
198 HG LEU 106 HG LEU 106 24.968 18.394 1.328
199 HD11 LEU 106 HD11 LEU 106 22.635 16.508 1.734
200 HD12 LEU 106 HD12 LEU 106 23.741 17.151 2.963
201 HD13 LEU 106 HD13 LEU 106 24.348 16.021 1.747
202 HD21 LEU 106 HD21 LEU 106 24.387 18.357 -1.066
203 HD22 LEU 106 HD22 LEU 106 23.115 17.153 -0.757
204 HD23 LEU 106 HD23 LEU 106 24.830 16.747 -0.502
205 H CYS 107 H CYS 107 22.073 21.695 -1.293
206 HA CYS 107 HA CYS 107 20.067 23.029 0.469
207 HB2 CYS 107 HB2 CYS 107 22.216 24.359 -0.265
208 HB3 CYS 107 HB3 CYS 107 21.403 24.472 -1.820
209 H GLY 108 H GLY 108 18.049 23.454 -0.459
210 HA2 GLY 108 HA2 GLY 108 16.208 23.011 -1.792
211 HA3 GLY 108 HA3 GLY 108 17.284 23.446 -3.121
212 H SER 109 H SER 109 17.039 21.979 -4.702
213 HA SER 109 HA SER 109 16.097 19.349 -4.493
214 HB2 SER 109 HB2 SER 109 17.964 20.449 -6.618
215 HB3 SER 109 HB3 SER 109 16.881 19.052 -6.772
216 HG SER 109 HG SER 109 15.960 20.952 -7.673
217 H HIS 110 H HIS 110 19.483 20.442 -4.044
218 HA HIS 110 HA HIS 110 20.612 17.793 -4.311
219 HB2 HIS 110 HB2 HIS 110 21.753 20.148 -4.479
220 HB3 HIS 110 HB3 HIS 110 21.843 20.054 -2.717
221 HD1 HIS 110 HD1 HIS 110 24.572 20.216 -3.626
222 HD2 HIS 110 HD2 HIS 110 22.439 16.606 -3.999
223 HE1 HIS 110 HE1 HIS 110 26.317 18.380 -3.900
224 H LEU 111 H LEU 111 19.239 19.661 -1.646
225 HA LEU 111 HA LEU 111 20.033 17.862 0.496
226 HB2 LEU 111 HB2 LEU 111 19.288 20.395 0.487
227 HB3 LEU 111 HB3 LEU 111 17.661 19.746 0.579
228 HG LEU 111 HG LEU 111 19.934 19.267 2.563
229 HD11 LEU 111 HD11 LEU 111 19.016 21.568 2.571
230 HD12 LEU 111 HD12 LEU 111 18.598 20.701 4.056
231 HD13 LEU 111 HD13 LEU 111 17.376 20.912 2.780
232 HD21 LEU 111 HD21 LEU 111 18.147 18.356 4.054
233 HD22 LEU 111 HD22 LEU 111 18.456 17.337 2.657
234 HD23 LEU 111 HD23 LEU 111 17.019 18.383 2.678
235 H VAL 112 H VAL 112 17.034 18.314 -1.426
236 HA VAL 112 HA VAL 112 15.557 16.095 -0.379
237 HB VAL 112 HB VAL 112 15.495 17.361 -3.150
238 HG11 VAL 112 HG11 VAL 112 13.538 15.437 -1.833
239 HG12 VAL 112 HG12 VAL 112 13.187 16.401 -3.282
240 HG13 VAL 112 HG13 VAL 112 14.450 15.175 -3.333
241 HG21 VAL 112 HG21 VAL 112 13.493 18.519 -2.280
242 HG22 VAL 112 HG22 VAL 112 13.739 17.768 -0.685
243 HG23 VAL 112 HG23 VAL 112 14.916 18.930 -1.329
244 H GLU 113 H GLU 113 17.805 16.214 -3.208
245 HA GLU 113 HA GLU 113 17.634 13.466 -3.861
246 HB2 GLU 113 HB2 GLU 113 18.576 15.198 -5.316
247 HB3 GLU 113 HB3 GLU 113 19.963 15.392 -4.227
248 HG2 GLU 113 HG2 GLU 113 20.702 13.117 -4.698
249 HG3 GLU 113 HG3 GLU 113 19.233 12.782 -5.617
250 H ALA 114 H ALA 114 19.746 15.080 -1.419
251 HA ALA 114 HA ALA 114 21.213 12.726 -0.737
252 HB1 ALA 114 HB1 ALA 114 20.515 15.129 0.985
253 HB2 ALA 114 HB2 ALA 114 21.818 13.957 1.275
254 HB3 ALA 114 HB3 ALA 114 21.890 15.020 -0.139
255 H LEU 115 H LEU 115 18.013 13.886 0.459
256 HA LEU 115 HA LEU 115 17.710 11.835 2.475
257 HB2 LEU 115 HB2 LEU 115 15.351 12.826 0.857
258 HB3 LEU 115 HB3 LEU 115 15.411 12.263 2.511
259 HG LEU 115 HG LEU 115 16.304 14.901 1.389
260 HD11 LEU 115 HD11 LEU 115 14.567 15.828 2.837
261 HD12 LEU 115 HD12 LEU 115 14.216 14.208 3.488
262 HD13 LEU 115 HD13 LEU 115 13.891 14.577 1.782
263 HD21 LEU 115 HD21 LEU 115 16.643 13.849 4.227
264 HD22 LEU 115 HD22 LEU 115 16.762 15.570 3.773
265 HD23 LEU 115 HD23 LEU 115 17.920 14.418 3.112
266 H TYR 116 H TYR 116 16.733 12.076 -0.927
267 HA TYR 116 HA TYR 116 15.671 9.405 -1.115
268 HB2 TYR 116 HB2 TYR 116 16.341 11.589 -3.060
269 HB3 TYR 116 HB3 TYR 116 16.066 9.964 -3.684
270 HD1 TYR 116 HD2 TYR 116 13.971 8.732 -3.161
271 HD2 TYR 116 HD1 TYR 116 14.422 12.934 -2.343
272 HE1 TYR 116 HE2 TYR 116 11.490 8.960 -2.956
273 HE2 TYR 116 HE1 TYR 116 11.953 13.168 -2.153
274 HH TYR 116 HH TYR 116 9.740 10.368 -2.514
275 H LEU 117 H LEU 117 18.997 10.474 -1.422
276 HA LEU 117 HA LEU 117 19.882 7.935 -2.539
277 HB2 LEU 117 HB2 LEU 117 21.286 10.335 -1.330
278 HB3 LEU 117 HB3 LEU 117 22.183 8.883 -1.746
279 HG LEU 117 HG LEU 117 20.491 10.397 -3.790
280 HD11 LEU 117 HD11 LEU 117 22.263 11.861 -2.926
281 HD12 LEU 117 HD12 LEU 117 22.613 11.358 -4.586
282 HD13 LEU 117 HD13 LEU 117 23.479 10.594 -3.227
283 HD21 LEU 117 HD21 LEU 117 20.986 8.070 -4.423
284 HD22 LEU 117 HD22 LEU 117 22.715 8.336 -4.098
285 HD23 LEU 117 HD23 LEU 117 21.903 9.201 -5.423
286 H VAL 118 H VAL 118 19.825 9.317 0.794
287 HA VAL 118 HA VAL 118 21.080 6.884 1.829
288 HB VAL 118 HB VAL 118 21.571 9.182 2.658
289 HG11 VAL 118 HG11 VAL 118 19.198 9.969 2.956
290 HG12 VAL 118 HG12 VAL 118 19.074 8.876 4.349
291 HG13 VAL 118 HG13 VAL 118 20.244 10.198 4.365
292 HG21 VAL 118 HG21 VAL 118 20.786 7.082 4.716
293 HG22 VAL 118 HG22 VAL 118 22.314 7.154 3.808
294 HG23 VAL 118 HG23 VAL 118 21.911 8.425 4.969
295 H CYS 119 H CYS 119 17.766 8.120 1.746
296 HA CYS 119 HA CYS 119 16.784 5.788 3.311
297 HB2 CYS 119 HB2 CYS 119 15.391 8.309 2.370
298 HB3 CYS 119 HB3 CYS 119 14.709 7.093 3.445
299 H GLY 120 H GLY 120 17.450 6.208 0.116
300 HA2 GLY 120 HA2 GLY 120 16.681 5.298 -1.862
301 HA3 GLY 120 HA3 GLY 120 15.770 4.135 -0.890
302 H GLU 121 H GLU 121 13.830 4.164 -1.987
303 HA GLU 121 HA GLU 121 12.505 6.461 -3.020
304 HB2 GLU 121 HB2 GLU 121 10.611 5.007 -3.344
305 HB3 GLU 121 HB3 GLU 121 12.099 4.159 -3.763
306 HG2 GLU 121 HG2 GLU 121 12.029 2.979 -1.561
307 HG3 GLU 121 HG3 GLU 121 10.536 3.823 -1.157
308 H ARG 122 H ARG 122 12.881 5.712 0.268
309 HA ARG 122 HA ARG 122 10.366 7.063 1.083
310 HB2 ARG 122 HB2 ARG 122 11.483 4.790 2.082
311 HB3 ARG 122 HB3 ARG 122 12.219 5.975 3.159
312 HG2 ARG 122 HG2 ARG 122 9.762 6.907 3.417
313 HG3 ARG 122 HG3 ARG 122 9.285 5.396 2.642
314 HD2 ARG 122 HD2 ARG 122 9.125 4.780 4.852
315 HD3 ARG 122 HD3 ARG 122 10.788 4.280 4.525
316 HE ARG 122 HE ARG 122 10.788 7.008 5.411
317 HH11 ARG 122 HH21 ARG 122 10.133 3.859 6.836
318 HH12 ARG 122 HH22 ARG 122 10.480 4.441 8.444
319 HH21 ARG 122 HH11 ARG 122 11.142 7.651 7.392
320 HH22 ARG 122 HH12 ARG 122 11.075 6.579 8.774
321 H GLY 123 H GLY 123 12.709 8.540 -0.093
322 HA2 GLY 123 HA2 GLY 123 14.059 10.187 1.733
323 HA3 GLY 123 HA3 GLY 123 13.499 10.710 0.137
324 H PHE 124 H PHE 124 10.686 10.392 0.721
325 HA PHE 124 HA PHE 124 10.040 12.104 3.045
326 HB2 PHE 124 HB2 PHE 124 9.119 12.527 0.187
327 HB3 PHE 124 HB3 PHE 124 8.083 12.945 1.539
328 HD1 PHE 124 HD1 PHE 124 11.447 13.686 0.043
329 HD2 PHE 124 HD2 PHE 124 8.364 14.945 2.781
330 HE1 PHE 124 HE1 PHE 124 12.521 15.916 0.234
331 HE2 PHE 124 HE2 PHE 124 9.452 17.165 2.985
332 HZ PHE 124 HZ PHE 124 11.533 17.660 1.711
333 H PHE 125 H PHE 125 8.008 11.548 3.997
334 HA PHE 125 HA PHE 125 6.948 8.872 3.199
335 HB2 PHE 125 HB2 PHE 125 8.796 8.851 4.912
336 HB3 PHE 125 HB3 PHE 125 7.745 9.761 5.988
337 HD1 PHE 125 HD2 PHE 125 7.166 6.767 3.732
338 HD2 PHE 125 HD1 PHE 125 7.155 8.353 7.741
339 HE1 PHE 125 HE2 PHE 125 6.308 4.604 4.586
340 HE2 PHE 125 HE1 PHE 125 6.302 6.182 8.596
341 HZ PHE 125 HZ PHE 125 5.874 4.302 7.018
342 H TYR 126 H TYR 126 4.896 8.247 4.158
343 HA TYR 126 HA TYR 126 3.062 10.472 3.744
344 HB2 TYR 126 HB2 TYR 126 1.389 8.755 3.434
345 HB3 TYR 126 HB3 TYR 126 2.830 8.425 2.495
346 HD1 TYR 126 HD2 TYR 126 1.001 7.465 5.630
347 HD2 TYR 126 HD1 TYR 126 3.959 6.329 2.691
348 HE1 TYR 126 HE2 TYR 126 1.127 5.193 6.634
349 HE2 TYR 126 HE1 TYR 126 4.042 4.039 3.677
350 HH TYR 126 HH TYR 126 2.052 3.108 6.512
351 H THR 127 H THR 127 4.189 9.033 6.674
352 HA THR 127 HA THR 127 1.708 9.057 8.108
353 HB THR 127 HB THR 127 3.192 8.955 10.171
354 HG1 THR 127 HG1 THR 127 5.049 9.923 9.357
355 HG21 THR 127 HG21 THR 127 3.684 6.931 7.943
356 HG22 THR 127 HG22 THR 127 2.319 6.932 9.081
357 HG23 THR 127 HG23 THR 127 3.967 6.668 9.674
358 HA PRO 128 HA PRO 128 1.166 13.293 9.096
359 HB2 PRO 128 HB2 PRO 128 -0.287 13.240 11.412
360 HB3 PRO 128 HB3 PRO 128 -0.935 12.701 9.833
361 HG2 PRO 128 HG2 PRO 128 0.284 10.980 12.020
362 HG3 PRO 128 HG3 PRO 128 -1.280 10.743 11.174
363 HD2 PRO 128 HD2 PRO 128 0.952 9.429 10.388
364 HD3 PRO 128 HD3 PRO 128 -0.208 10.057 9.179
365 H LYS 129 H LYS 129 1.821 15.016 10.417
366 HA LYS 129 HA LYS 129 3.595 14.578 12.734
367 HB2 LYS 129 HB2 LYS 129 5.415 15.907 11.714
368 HB3 LYS 129 HB3 LYS 129 5.193 14.339 10.949
369 HG2 LYS 129 HG2 LYS 129 4.202 15.258 8.993
370 HG3 LYS 129 HG3 LYS 129 3.906 16.823 9.746
371 HD2 LYS 129 HD2 LYS 129 6.696 15.725 9.211
372 HD3 LYS 129 HD3 LYS 129 5.804 16.795 8.106
373 HE2 LYS 129 HE2 LYS 129 5.564 18.467 9.949
374 HE3 LYS 129 HE3 LYS 129 6.545 17.444 11.000
375 HZ1 LYS 129 HZ1 LYS 129 8.391 17.724 9.424
376 HZ2 LYS 129 HZ2 LYS 129 7.856 19.146 10.053
377 HZ3 LYS 129 HZ3 LYS 129 7.480 18.738 8.504
378 H THR 130 H THR 130 4.205 16.552 13.817
379 HA THR 130 HA THR 130 2.008 18.578 13.673
380 HB THR 130 HB THR 130 2.348 18.784 16.125
381 HG1 THR 130 HG1 THR 130 3.536 17.169 17.129
382 HG21 THR 130 HG21 THR 130 0.643 17.210 15.169
383 HG22 THR 130 HG22 THR 130 1.278 16.702 16.740
384 HG23 THR 130 HG23 THR 130 1.843 15.902 15.255
385 H ARG 131 H ARG 131 5.332 18.514 13.140
386 HA ARG 131 HA ARG 131 5.681 21.407 13.877
387 HB2 ARG 131 HB2 ARG 131 7.551 19.055 14.256
388 HB3 ARG 131 HB3 ARG 131 8.119 20.723 14.254
389 HG2 ARG 131 HG2 ARG 131 7.292 21.210 16.298
390 HG3 ARG 131 HG3 ARG 131 5.804 20.291 16.078
391 HD2 ARG 131 HD2 ARG 131 8.495 18.979 16.584
392 HD3 ARG 131 HD3 ARG 131 7.365 19.423 17.869
393 HE ARG 131 HE ARG 131 5.681 17.986 16.439
394 HH11 ARG 131 HH11 ARG 131 9.001 17.067 17.114
395 HH12 ARG 131 HH12 ARG 131 8.637 15.369 16.977
396 HH21 ARG 131 HH21 ARG 131 5.287 15.909 16.311
397 HH22 ARG 131 HH22 ARG 131 6.549 14.713 16.530
Start of MODEL 11
1 H1 GLY 1 H1 GLY 1 15.462 24.836 11.546
2 H2 GLY 1 H2 GLY 1 14.220 24.288 12.467
3 H3 GLY 1 H3 GLY 1 14.213 25.836 11.918
4 HA2 GLY 1 HA2 GLY 1 12.680 24.492 10.621
5 HA3 GLY 1 HA3 GLY 1 14.036 25.084 9.636
6 H ILE 2 H ILE 2 15.040 23.584 8.455
7 HA ILE 2 HA ILE 2 15.700 20.997 9.374
8 HB ILE 2 HB ILE 2 13.201 20.701 8.746
9 HG12 ILE 2 HG12 ILE 2 13.582 18.488 7.616
10 HG13 ILE 2 HG13 ILE 2 15.309 18.863 7.568
11 HG21 ILE 2 HG21 ILE 2 13.224 21.949 6.603
12 HG22 ILE 2 HG22 ILE 2 14.208 20.641 5.882
13 HG23 ILE 2 HG23 ILE 2 12.574 20.308 6.472
14 HD11 ILE 2 HD11 ILE 2 13.620 18.826 10.121
15 HD12 ILE 2 HD12 ILE 2 14.535 17.435 9.526
16 HD13 ILE 2 HD13 ILE 2 15.395 18.907 10.020
17 H VAL 3 H VAL 3 15.206 23.025 6.492
18 HA VAL 3 HA VAL 3 17.237 21.871 4.894
19 HB VAL 3 HB VAL 3 16.059 24.667 4.725
20 HG11 VAL 3 HG11 VAL 3 16.626 24.507 2.304
21 HG12 VAL 3 HG12 VAL 3 18.057 24.499 3.317
22 HG13 VAL 3 HG13 VAL 3 17.478 22.975 2.621
23 HG21 VAL 3 HG21 VAL 3 14.253 23.044 4.609
24 HG22 VAL 3 HG22 VAL 3 14.556 23.674 2.993
25 HG23 VAL 3 HG23 VAL 3 15.148 22.058 3.437
26 H GLU 4 H GLU 4 17.327 24.710 7.043
27 HA GLU 4 HA GLU 4 19.839 25.718 6.262
28 HB2 GLU 4 HB2 GLU 4 19.749 27.072 8.173
29 HB3 GLU 4 HB3 GLU 4 18.124 26.934 7.539
30 HG2 GLU 4 HG2 GLU 4 19.256 25.449 9.944
31 HG3 GLU 4 HG3 GLU 4 18.240 26.891 10.007
32 H GLN 5 H GLN 5 19.162 23.060 8.438
33 HA GLN 5 HA GLN 5 21.770 22.912 9.667
34 HB2 GLN 5 HB2 GLN 5 19.317 21.145 9.515
35 HB3 GLN 5 HB3 GLN 5 20.777 20.618 10.353
36 HG2 GLN 5 HG2 GLN 5 20.643 22.401 11.947
37 HG3 GLN 5 HG3 GLN 5 19.430 23.262 11.004
38 HE21 GLN 5 HE21 GLN 5 17.261 22.802 11.330
39 HE22 GLN 5 HE22 GLN 5 16.696 21.489 12.380
40 H CYS 6 H CYS 6 20.789 22.021 6.555
41 HA CYS 6 HA CYS 6 23.385 20.582 6.127
42 HB2 CYS 6 HB2 CYS 6 20.652 20.055 4.939
43 HB3 CYS 6 HB3 CYS 6 22.124 19.540 4.134
44 H CYS 7 H CYS 7 21.287 23.180 5.147
45 HA CYS 7 HA CYS 7 22.702 23.695 2.652
46 HB2 CYS 7 HB2 CYS 7 20.317 23.969 2.854
47 HB3 CYS 7 HB3 CYS 7 20.505 25.118 4.166
48 H THR 8 H THR 8 22.844 25.071 5.978
49 HA THR 8 HA THR 8 24.521 27.313 5.135
50 HB THR 8 HB THR 8 24.941 27.693 7.526
51 HG1 THR 8 HG1 THR 8 23.148 25.560 8.014
52 HG21 THR 8 HG21 THR 8 22.006 27.262 6.837
53 HG22 THR 8 HG22 THR 8 22.972 28.717 6.516
54 HG23 THR 8 HG23 THR 8 22.637 28.235 8.186
55 H SER 9 H SER 9 25.215 24.057 6.334
56 HA SER 9 HA SER 9 27.918 24.171 5.238
57 HB2 SER 9 HB2 SER 9 29.048 23.487 7.310
58 HB3 SER 9 HB3 SER 9 28.347 25.098 7.466
59 HG SER 9 HG SER 9 27.933 23.799 9.312
60 H ILE 10 H ILE 10 28.987 21.975 5.419
61 HA ILE 10 HA ILE 10 27.234 19.918 4.529
62 HB ILE 10 HB ILE 10 29.181 18.401 4.749
63 HG12 ILE 10 HG12 ILE 10 30.763 20.839 5.673
64 HG13 ILE 10 HG13 ILE 10 30.238 19.532 6.743
65 HG21 ILE 10 HG21 ILE 10 29.727 21.051 3.331
66 HG22 ILE 10 HG22 ILE 10 30.466 19.484 2.946
67 HG23 ILE 10 HG23 ILE 10 28.734 19.708 2.716
68 HD11 ILE 10 HD11 ILE 10 32.527 19.150 6.136
69 HD12 ILE 10 HD12 ILE 10 31.535 17.902 5.358
70 HD13 ILE 10 HD13 ILE 10 32.172 19.271 4.409
71 H CYS 11 H CYS 11 26.476 18.018 5.433
72 HA CYS 11 HA CYS 11 26.209 18.037 8.412
73 HB2 CYS 11 HB2 CYS 11 23.868 17.761 8.140
74 HB3 CYS 11 HB3 CYS 11 24.398 19.174 7.263
75 H SER 12 H SER 12 24.760 16.022 9.065
76 HA SER 12 HA SER 12 26.588 13.785 8.561
77 HB2 SER 12 HB2 SER 12 26.003 14.412 10.840
78 HB3 SER 12 HB3 SER 12 24.290 14.073 10.513
79 HG SER 12 HG SER 12 25.611 12.325 11.505
80 H LEU 13 H LEU 13 25.973 11.668 8.003
81 HA LEU 13 HA LEU 13 23.815 11.325 6.078
82 HB2 LEU 13 HB2 LEU 13 25.397 9.256 7.666
83 HB3 LEU 13 HB3 LEU 13 24.383 8.927 6.264
84 HG LEU 13 HG LEU 13 26.957 10.569 6.262
85 HD11 LEU 13 HD11 LEU 13 27.297 8.141 6.557
86 HD12 LEU 13 HD12 LEU 13 27.871 8.700 4.971
87 HD13 LEU 13 HD13 LEU 13 26.331 7.830 5.097
88 HD21 LEU 13 HD21 LEU 13 26.763 10.507 3.789
89 HD22 LEU 13 HD22 LEU 13 25.440 11.416 4.514
90 HD23 LEU 13 HD23 LEU 13 25.158 9.753 3.941
91 H TYR 14 H TYR 14 24.142 10.902 9.589
92 HA TYR 14 HA TYR 14 21.645 9.566 10.059
93 HB2 TYR 14 HB2 TYR 14 23.550 9.653 11.639
94 HB3 TYR 14 HB3 TYR 14 23.290 11.379 11.851
95 HD1 TYR 14 HD1 TYR 14 21.614 8.039 12.253
96 HD2 TYR 14 HD2 TYR 14 21.771 12.170 13.498
97 HE1 TYR 14 HE1 TYR 14 19.990 7.552 14.076
98 HE2 TYR 14 HE2 TYR 14 20.139 11.678 15.324
99 HH TYR 14 HH TYR 14 18.793 8.395 15.845
100 H GLN 15 H GLN 15 22.379 12.952 9.400
101 HA GLN 15 HA GLN 15 19.807 13.998 10.386
102 HB2 GLN 15 HB2 GLN 15 22.052 15.161 8.690
103 HB3 GLN 15 HB3 GLN 15 20.550 16.003 8.940
104 HG2 GLN 15 HG2 GLN 15 20.888 16.114 11.336
105 HG3 GLN 15 HG3 GLN 15 22.311 15.074 11.238
106 HE21 GLN 15 HE21 GLN 15 21.040 18.227 9.984
107 HE22 GLN 15 HE22 GLN 15 22.623 18.980 9.883
108 H LEU 16 H LEU 16 21.250 13.135 7.201
109 HA LEU 16 HA LEU 16 18.809 13.614 5.744
110 HB2 LEU 16 HB2 LEU 16 21.222 11.878 5.099
111 HB3 LEU 16 HB3 LEU 16 19.968 12.323 3.946
112 HG LEU 16 HG LEU 16 21.768 14.330 5.401
113 HD11 LEU 16 HD11 LEU 16 23.075 13.003 3.868
114 HD12 LEU 16 HD12 LEU 16 22.810 14.611 3.183
115 HD13 LEU 16 HD13 LEU 16 21.865 13.229 2.579
116 HD21 LEU 16 HD21 LEU 16 19.608 15.333 4.709
117 HD22 LEU 16 HD22 LEU 16 19.862 14.728 3.055
118 HD23 LEU 16 HD23 LEU 16 20.956 15.944 3.754
119 H GLU 17 H GLU 17 19.979 10.676 7.416
120 HA GLU 17 HA GLU 17 17.688 9.063 6.678
121 HB2 GLU 17 HB2 GLU 17 19.697 8.868 8.952
122 HB3 GLU 17 HB3 GLU 17 18.394 7.710 8.695
123 HG2 GLU 17 HG2 GLU 17 19.249 7.273 6.383
124 HG3 GLU 17 HG3 GLU 17 20.637 8.296 6.745
125 H ASN 18 H ASN 18 17.911 11.771 8.792
126 HA ASN 18 HA ASN 18 15.499 10.997 10.346
127 HB2 ASN 18 HB2 ASN 18 17.490 11.896 11.528
128 HB3 ASN 18 HB3 ASN 18 17.354 13.393 10.610
129 HD21 ASN 18 HD21 ASN 18 15.719 11.352 13.014
130 HD22 ASN 18 HD22 ASN 18 14.735 12.662 13.664
131 H TYR 19 H TYR 19 16.548 13.286 7.790
132 HA TYR 19 HA TYR 19 14.109 14.817 7.826
133 HB2 TYR 19 HB2 TYR 19 16.177 14.496 5.627
134 HB3 TYR 19 HB3 TYR 19 14.940 15.744 5.718
135 HD1 TYR 19 HD2 TYR 19 16.007 15.581 9.069
136 HD2 TYR 19 HD1 TYR 19 17.360 16.769 5.140
137 HE1 TYR 19 HE2 TYR 19 17.671 17.082 10.100
138 HE2 TYR 19 HE1 TYR 19 18.915 18.406 6.208
139 HH TYR 19 HH TYR 19 19.818 19.144 8.118
140 H CYS 20 H CYS 20 14.960 11.793 6.266
141 HA CYS 20 HA CYS 20 12.710 11.778 4.418
142 HB2 CYS 20 HB2 CYS 20 13.361 9.498 3.980
143 HB3 CYS 20 HB3 CYS 20 14.779 10.539 3.966
144 H ASN 21 H ASN 21 11.176 9.865 4.536
145 HA ASN 21 HA ASN 21 9.221 9.182 5.312
146 HB2 ASN 21 HB2 ASN 21 10.887 7.669 6.541
147 HB3 ASN 21 HB3 ASN 21 10.525 8.622 7.973
148 HD21 ASN 21 HD21 ASN 21 8.016 8.786 8.391
149 HD22 ASN 21 HD22 ASN 21 7.148 7.255 8.201
150 H GLY 22 H GLY 22 9.620 11.871 5.250
151 HA2 GLY 22 HA2 GLY 22 8.669 13.297 7.578
152 HA3 GLY 22 HA3 GLY 22 8.814 13.940 5.944
153 H1 PHE 101 H1 PHE 101 31.339 11.068 5.535
154 H2 PHE 101 H2 PHE 101 32.108 11.984 4.410
155 H3 PHE 101 H3 PHE 101 30.975 10.901 3.947
156 HA PHE 101 HA PHE 101 29.232 12.116 5.034
157 HB2 PHE 101 HB2 PHE 101 31.511 13.972 5.831
158 HB3 PHE 101 HB3 PHE 101 29.818 14.439 5.906
159 HD1 PHE 101 HD2 PHE 101 28.185 12.819 7.159
160 HD2 PHE 101 HD1 PHE 101 32.450 12.974 7.784
161 HE1 PHE 101 HE2 PHE 101 27.902 11.765 9.409
162 HE2 PHE 101 HE1 PHE 101 32.161 11.924 10.020
163 HZ PHE 101 HZ PHE 101 29.886 11.322 10.828
164 H VAL 102 H VAL 102 28.305 14.268 4.233
165 HA VAL 102 HA VAL 102 28.544 14.285 1.355
166 HB VAL 102 HB VAL 102 26.811 15.921 1.350
167 HG11 VAL 102 HG11 VAL 102 26.179 13.571 1.907
168 HG12 VAL 102 HG12 VAL 102 26.214 13.985 3.630
169 HG13 VAL 102 HG13 VAL 102 25.061 14.783 2.548
170 HG21 VAL 102 HG21 VAL 102 27.473 17.502 3.038
171 HG22 VAL 102 HG22 VAL 102 25.885 16.876 3.482
172 HG23 VAL 102 HG23 VAL 102 27.336 16.285 4.323
173 H ASN 103 H ASN 103 28.828 16.267 0.039
174 HA ASN 103 HA ASN 103 30.799 18.198 1.152
175 HB2 ASN 103 HB2 ASN 103 31.906 16.359 -0.180
176 HB3 ASN 103 HB3 ASN 103 31.008 16.919 -1.595
177 HD21 ASN 103 HD21 ASN 103 33.334 17.096 -2.399
178 HD22 ASN 103 HD22 ASN 103 34.170 18.605 -2.043
179 H GLN 104 H GLN 104 30.862 20.197 0.090
180 HA GLN 104 HA GLN 104 29.834 22.139 -0.210
181 HB2 GLN 104 HB2 GLN 104 29.058 22.680 -2.343
182 HB3 GLN 104 HB3 GLN 104 30.355 21.518 -2.511
183 HG2 GLN 104 HG2 GLN 104 28.793 19.752 -3.114
184 HG3 GLN 104 HG3 GLN 104 27.400 20.778 -2.704
185 HE21 GLN 104 HE21 GLN 104 30.129 20.402 -5.026
186 HE22 GLN 104 HE22 GLN 104 29.365 21.375 -6.278
187 H HIS 105 H HIS 105 27.544 23.230 -1.059
188 HA HIS 105 HA HIS 105 26.001 22.831 1.360
189 HB2 HIS 105 HB2 HIS 105 25.708 24.787 -0.947
190 HB3 HIS 105 HB3 HIS 105 24.769 24.824 0.540
191 HD1 HIS 105 HD1 HIS 105 25.978 25.697 2.729
192 HD2 HIS 105 HD2 HIS 105 28.386 25.482 -0.711
193 HE1 HIS 105 HE1 HIS 105 28.218 26.766 3.356
194 H LEU 106 H LEU 106 24.248 21.650 1.670
195 HA LEU 106 HA LEU 106 22.683 20.566 -0.640
196 HB2 LEU 106 HB2 LEU 106 23.080 19.757 2.209
197 HB3 LEU 106 HB3 LEU 106 21.649 19.242 1.328
198 HG LEU 106 HG LEU 106 22.925 18.029 -0.299
199 HD11 LEU 106 HD11 LEU 106 25.051 19.297 -0.371
200 HD12 LEU 106 HD12 LEU 106 25.325 17.592 -0.036
201 HD13 LEU 106 HD13 LEU 106 25.416 18.783 1.288
202 HD21 LEU 106 HD21 LEU 106 22.239 16.960 1.827
203 HD22 LEU 106 HD22 LEU 106 23.771 17.437 2.578
204 HD23 LEU 106 HD23 LEU 106 23.767 16.278 1.233
205 H CYS 107 H CYS 107 21.657 22.393 -1.143
206 HA CYS 107 HA CYS 107 19.539 23.439 0.704
207 HB2 CYS 107 HB2 CYS 107 20.871 24.780 -1.668
208 HB3 CYS 107 HB3 CYS 107 19.674 25.516 -0.614
209 H GLY 108 H GLY 108 17.418 23.492 -0.034
210 HA2 GLY 108 HA2 GLY 108 15.559 22.932 -1.292
211 HA3 GLY 108 HA3 GLY 108 16.476 23.632 -2.628
212 H SER 109 H SER 109 16.382 22.326 -4.362
213 HA SER 109 HA SER 109 15.682 19.632 -4.442
214 HB2 SER 109 HB2 SER 109 17.451 21.107 -6.424
215 HB3 SER 109 HB3 SER 109 16.489 19.647 -6.739
216 HG SER 109 HG SER 109 15.402 21.556 -7.424
217 H HIS 110 H HIS 110 18.993 20.947 -3.919
218 HA HIS 110 HA HIS 110 20.292 18.404 -4.404
219 HB2 HIS 110 HB2 HIS 110 21.380 20.672 -4.590
220 HB3 HIS 110 HB3 HIS 110 21.318 20.795 -2.829
221 HD1 HIS 110 HD1 HIS 110 24.010 20.795 -2.625
222 HD2 HIS 110 HD2 HIS 110 22.287 17.452 -4.525
223 HE1 HIS 110 HE1 HIS 110 25.852 19.035 -2.803
224 H LEU 111 H LEU 111 18.812 19.930 -1.560
225 HA LEU 111 HA LEU 111 19.842 17.974 0.332
226 HB2 LEU 111 HB2 LEU 111 19.126 20.265 0.991
227 HB3 LEU 111 HB3 LEU 111 17.477 19.897 0.524
228 HG LEU 111 HG LEU 111 17.277 18.213 2.279
229 HD11 LEU 111 HD11 LEU 111 19.559 17.341 2.397
230 HD12 LEU 111 HD12 LEU 111 19.078 17.943 3.975
231 HD13 LEU 111 HD13 LEU 111 20.155 18.915 2.966
232 HD21 LEU 111 HD21 LEU 111 16.815 20.562 2.825
233 HD22 LEU 111 HD22 LEU 111 18.513 20.771 3.340
234 HD23 LEU 111 HD23 LEU 111 17.435 19.667 4.227
235 H VAL 112 H VAL 112 16.815 18.374 -1.523
236 HA VAL 112 HA VAL 112 15.489 16.010 -0.581
237 HB VAL 112 HB VAL 112 15.271 17.397 -3.285
238 HG11 VAL 112 HG11 VAL 112 14.331 15.142 -3.451
239 HG12 VAL 112 HG12 VAL 112 13.411 15.377 -1.952
240 HG13 VAL 112 HG13 VAL 112 13.027 16.325 -3.402
241 HG21 VAL 112 HG21 VAL 112 13.233 18.423 -2.303
242 HG22 VAL 112 HG22 VAL 112 13.603 17.658 -0.739
243 HG23 VAL 112 HG23 VAL 112 14.678 18.894 -1.414
244 H GLU 113 H GLU 113 17.656 16.497 -3.429
245 HA GLU 113 HA GLU 113 17.743 13.781 -4.257
246 HB2 GLU 113 HB2 GLU 113 18.533 15.693 -5.584
247 HB3 GLU 113 HB3 GLU 113 19.875 15.946 -4.453
248 HG2 GLU 113 HG2 GLU 113 20.854 13.799 -5.052
249 HG3 GLU 113 HG3 GLU 113 19.439 13.372 -6.024
250 H ALA 114 H ALA 114 19.915 15.491 -1.887
251 HA ALA 114 HA ALA 114 21.532 13.243 -1.345
252 HB1 ALA 114 HB1 ALA 114 20.787 15.553 0.483
253 HB2 ALA 114 HB2 ALA 114 22.211 14.496 0.623
254 HB3 ALA 114 HB3 ALA 114 22.056 15.584 -0.761
255 H LEU 115 H LEU 115 18.430 14.191 0.340
256 HA LEU 115 HA LEU 115 18.708 11.900 2.120
257 HB2 LEU 115 HB2 LEU 115 16.662 12.468 3.114
258 HB3 LEU 115 HB3 LEU 115 17.613 13.913 2.844
259 HG LEU 115 HG LEU 115 16.131 14.253 0.736
260 HD11 LEU 115 HD11 LEU 115 14.271 12.499 2.399
261 HD12 LEU 115 HD12 LEU 115 14.925 12.042 0.811
262 HD13 LEU 115 HD13 LEU 115 13.839 13.414 0.936
263 HD21 LEU 115 HD21 LEU 115 14.484 15.477 2.058
264 HD22 LEU 115 HD22 LEU 115 16.103 15.679 2.737
265 HD23 LEU 115 HD23 LEU 115 14.945 14.571 3.512
266 H TYR 116 H TYR 116 17.128 12.339 -1.027
267 HA TYR 116 HA TYR 116 15.979 9.676 -1.050
268 HB2 TYR 116 HB2 TYR 116 16.404 11.880 -3.019
269 HB3 TYR 116 HB3 TYR 116 16.299 10.272 -3.681
270 HD1 TYR 116 HD2 TYR 116 14.296 8.834 -3.331
271 HD2 TYR 116 HD1 TYR 116 14.367 12.972 -2.126
272 HE1 TYR 116 HE2 TYR 116 11.807 8.876 -3.318
273 HE2 TYR 116 HE1 TYR 116 11.878 13.017 -2.118
274 HH TYR 116 HH TYR 116 9.923 10.146 -3.017
275 H LEU 117 H LEU 117 19.270 10.705 -1.412
276 HA LEU 117 HA LEU 117 20.070 8.095 -2.593
277 HB2 LEU 117 HB2 LEU 117 21.560 10.647 -1.901
278 HB3 LEU 117 HB3 LEU 117 22.385 9.174 -2.386
279 HG LEU 117 HG LEU 117 20.285 10.530 -4.136
280 HD11 LEU 117 HD11 LEU 117 23.321 10.747 -4.244
281 HD12 LEU 117 HD12 LEU 117 22.194 12.040 -3.758
282 HD13 LEU 117 HD13 LEU 117 22.173 11.431 -5.416
283 HD21 LEU 117 HD21 LEU 117 22.409 8.425 -4.747
284 HD22 LEU 117 HD22 LEU 117 21.349 9.212 -5.941
285 HD23 LEU 117 HD23 LEU 117 20.649 8.167 -4.707
286 H VAL 118 H VAL 118 20.416 9.887 0.469
287 HA VAL 118 HA VAL 118 21.998 7.743 1.689
288 HB VAL 118 HB VAL 118 20.882 10.328 2.825
289 HG11 VAL 118 HG11 VAL 118 22.798 8.307 4.069
290 HG12 VAL 118 HG12 VAL 118 22.523 9.950 4.675
291 HG13 VAL 118 HG13 VAL 118 21.201 8.784 4.680
292 HG21 VAL 118 HG21 VAL 118 22.657 10.612 1.101
293 HG22 VAL 118 HG22 VAL 118 23.285 11.012 2.696
294 HG23 VAL 118 HG23 VAL 118 23.678 9.449 1.958
295 H CYS 119 H CYS 119 18.593 8.776 1.905
296 HA CYS 119 HA CYS 119 18.000 6.430 3.658
297 HB2 CYS 119 HB2 CYS 119 17.460 8.703 4.454
298 HB3 CYS 119 HB3 CYS 119 16.380 8.915 3.079
299 H GLY 120 H GLY 120 17.933 7.265 0.383
300 HA2 GLY 120 HA2 GLY 120 17.214 6.007 -1.418
301 HA3 GLY 120 HA3 GLY 120 16.610 4.811 -0.286
302 H GLU 121 H GLU 121 14.783 4.391 -1.361
303 HA GLU 121 HA GLU 121 13.034 6.023 -2.757
304 HB2 GLU 121 HB2 GLU 121 13.289 3.548 -2.813
305 HB3 GLU 121 HB3 GLU 121 12.526 3.447 -1.226
306 HG2 GLU 121 HG2 GLU 121 10.412 4.391 -2.259
307 HG3 GLU 121 HG3 GLU 121 11.212 4.325 -3.830
308 H ARG 122 H ARG 122 13.103 5.690 0.744
309 HA ARG 122 HA ARG 122 10.334 5.972 1.299
310 HB2 ARG 122 HB2 ARG 122 12.725 6.717 3.025
311 HB3 ARG 122 HB3 ARG 122 11.089 6.514 3.627
312 HG2 ARG 122 HG2 ARG 122 12.655 4.251 2.288
313 HG3 ARG 122 HG3 ARG 122 12.723 4.604 3.999
314 HD2 ARG 122 HD2 ARG 122 11.187 2.776 3.628
315 HD3 ARG 122 HD3 ARG 122 10.346 4.168 4.284
316 HE ARG 122 HE ARG 122 9.010 4.228 2.426
317 HH11 ARG 122 HH11 ARG 122 11.764 2.222 1.448
318 HH12 ARG 122 HH12 ARG 122 11.003 1.939 -0.123
319 HH21 ARG 122 HH21 ARG 122 8.222 3.721 0.371
320 HH22 ARG 122 HH22 ARG 122 9.225 2.695 -0.653
321 H GLY 123 H GLY 123 12.641 8.547 0.704
322 HA2 GLY 123 HA2 GLY 123 12.316 10.839 0.415
323 HA3 GLY 123 HA3 GLY 123 10.769 10.300 -0.248
324 H PHE 124 H PHE 124 9.486 11.956 0.402
325 HA PHE 124 HA PHE 124 8.491 11.793 3.128
326 HB2 PHE 124 HB2 PHE 124 8.524 14.256 3.509
327 HB3 PHE 124 HB3 PHE 124 10.111 13.514 3.560
328 HD1 PHE 124 HD1 PHE 124 7.857 15.677 1.515
329 HD2 PHE 124 HD2 PHE 124 11.845 14.127 2.024
330 HE1 PHE 124 HE1 PHE 124 8.693 17.281 -0.175
331 HE2 PHE 124 HE2 PHE 124 12.681 15.738 0.334
332 HZ PHE 124 HZ PHE 124 11.107 17.312 -0.782
333 H PHE 125 H PHE 125 6.377 12.868 3.355
334 HA PHE 125 HA PHE 125 4.879 12.717 0.804
335 HB2 PHE 125 HB2 PHE 125 4.158 11.427 2.789
336 HB3 PHE 125 HB3 PHE 125 3.909 12.933 3.669
337 HD1 PHE 125 HD2 PHE 125 2.931 11.441 0.319
338 HD2 PHE 125 HD1 PHE 125 1.671 13.613 3.822
339 HE1 PHE 125 HE2 PHE 125 0.635 11.613 -0.606
340 HE2 PHE 125 HE1 PHE 125 -0.620 13.794 2.886
341 HZ PHE 125 HZ PHE 125 -1.139 12.803 0.671
342 H TYR 126 H TYR 126 3.254 14.298 0.224
343 HA TYR 126 HA TYR 126 4.360 16.887 -0.018
344 HB2 TYR 126 HB2 TYR 126 1.502 15.988 -0.511
345 HB3 TYR 126 HB3 TYR 126 2.268 17.425 -1.178
346 HD1 TYR 126 HD1 TYR 126 4.414 17.070 -2.641
347 HD2 TYR 126 HD2 TYR 126 1.557 13.956 -1.736
348 HE1 TYR 126 HE1 TYR 126 5.235 15.750 -4.585
349 HE2 TYR 126 HE2 TYR 126 2.386 12.638 -3.678
350 HH TYR 126 HH TYR 126 5.023 13.820 -5.812
351 H THR 127 H THR 127 2.180 15.669 2.419
352 HA THR 127 HA THR 127 2.255 18.326 3.802
353 HB THR 127 HB THR 127 -0.072 16.386 3.925
354 HG1 THR 127 HG1 THR 127 0.183 18.919 2.659
355 HG21 THR 127 HG21 THR 127 0.213 17.702 5.997
356 HG22 THR 127 HG22 THR 127 -1.200 18.263 5.092
357 HG23 THR 127 HG23 THR 127 0.311 19.206 5.052
358 HA PRO 128 HA PRO 128 4.713 15.104 5.862
359 HB2 PRO 128 HB2 PRO 128 5.579 17.537 7.442
360 HB3 PRO 128 HB3 PRO 128 6.564 16.146 6.888
361 HG2 PRO 128 HG2 PRO 128 6.600 18.430 5.457
362 HG3 PRO 128 HG3 PRO 128 6.424 16.861 4.596
363 HD2 PRO 128 HD2 PRO 128 4.258 18.855 5.315
364 HD3 PRO 128 HD3 PRO 128 4.519 17.966 3.788
365 H LYS 129 H LYS 129 4.559 13.911 7.650
366 HA LYS 129 HA LYS 129 2.451 14.569 9.683
367 HB2 LYS 129 HB2 LYS 129 3.317 11.867 8.580
368 HB3 LYS 129 HB3 LYS 129 2.058 12.147 9.790
369 HG2 LYS 129 HG2 LYS 129 0.751 13.470 8.116
370 HG3 LYS 129 HG3 LYS 129 1.990 13.118 6.894
371 HD2 LYS 129 HD2 LYS 129 1.579 10.689 7.162
372 HD3 LYS 129 HD3 LYS 129 0.293 11.043 8.342
373 HE2 LYS 129 HE2 LYS 129 -0.911 12.373 6.613
374 HE3 LYS 129 HE3 LYS 129 0.361 12.006 5.445
375 HZ1 LYS 129 HZ1 LYS 129 -1.393 9.984 6.742
376 HZ2 LYS 129 HZ2 LYS 129 -0.209 9.639 5.668
377 HZ3 LYS 129 HZ3 LYS 129 -1.517 10.491 5.197
378 H THR 130 H THR 130 5.776 13.770 9.270
379 HA THR 130 HA THR 130 6.354 12.765 11.888
380 HB THR 130 HB THR 130 7.846 12.643 9.878
381 HG1 THR 130 HG1 THR 130 9.660 12.728 11.147
382 HG21 THR 130 HG21 THR 130 7.799 15.047 9.201
383 HG22 THR 130 HG22 THR 130 9.448 14.440 9.462
384 HG23 THR 130 HG23 THR 130 8.681 15.469 10.688
385 H ARG 131 H ARG 131 7.597 13.828 13.577
386 HA ARG 131 HA ARG 131 7.244 16.714 13.995
387 HB2 ARG 131 HB2 ARG 131 5.109 15.708 14.803
388 HB3 ARG 131 HB3 ARG 131 6.017 14.649 15.880
389 HG2 ARG 131 HG2 ARG 131 5.081 16.499 17.124
390 HG3 ARG 131 HG3 ARG 131 6.843 16.626 17.141
391 HD2 ARG 131 HD2 ARG 131 6.747 18.363 15.384
392 HD3 ARG 131 HD3 ARG 131 4.984 18.179 15.290
393 HE ARG 131 HE ARG 131 5.732 18.778 17.976
394 HH11 ARG 131 HH11 ARG 131 5.545 20.425 14.889
395 HH12 ARG 131 HH12 ARG 131 5.306 21.984 15.632
396 HH21 ARG 131 HH21 ARG 131 5.443 20.796 18.854
397 HH22 ARG 131 HH22 ARG 131 5.246 22.179 17.815
Start of MODEL 12
1 H1 GLY 1 H1 GLY 1 15.611 23.926 10.905
2 H2 GLY 1 H2 GLY 1 14.210 24.769 10.894
3 H3 GLY 1 H3 GLY 1 15.210 24.837 9.600
4 HA2 GLY 1 HA2 GLY 1 13.747 22.438 10.494
5 HA3 GLY 1 HA3 GLY 1 13.344 23.434 9.085
6 H ILE 2 H ILE 2 13.599 21.756 7.613
7 HA ILE 2 HA ILE 2 15.752 19.901 7.521
8 HB ILE 2 HB ILE 2 13.984 20.861 5.240
9 HG12 ILE 2 HG12 ILE 2 12.534 20.121 7.044
10 HG13 ILE 2 HG13 ILE 2 12.491 19.001 5.700
11 HG21 ILE 2 HG21 ILE 2 15.632 18.326 5.554
12 HG22 ILE 2 HG22 ILE 2 14.392 18.559 4.306
13 HG23 ILE 2 HG23 ILE 2 15.819 19.597 4.328
14 HD11 ILE 2 HD11 ILE 2 14.037 18.552 8.294
15 HD12 ILE 2 HD12 ILE 2 12.472 17.834 7.867
16 HD13 ILE 2 HD13 ILE 2 13.905 17.406 6.935
17 H VAL 3 H VAL 3 15.317 22.989 5.772
18 HA VAL 3 HA VAL 3 17.633 22.631 4.113
19 HB VAL 3 HB VAL 3 16.048 25.154 4.682
20 HG11 VAL 3 HG11 VAL 3 16.953 25.893 2.459
21 HG12 VAL 3 HG12 VAL 3 18.204 25.745 3.684
22 HG13 VAL 3 HG13 VAL 3 18.024 24.469 2.451
23 HG21 VAL 3 HG21 VAL 3 15.842 23.090 2.439
24 HG22 VAL 3 HG22 VAL 3 14.632 23.389 3.706
25 HG23 VAL 3 HG23 VAL 3 14.959 24.632 2.501
26 H GLU 4 H GLU 4 17.154 24.606 7.090
27 HA GLU 4 HA GLU 4 19.638 25.963 6.810
28 HB2 GLU 4 HB2 GLU 4 17.996 25.512 9.337
29 HB3 GLU 4 HB3 GLU 4 19.289 26.681 9.126
30 HG2 GLU 4 HG2 GLU 4 17.332 27.927 8.900
31 HG3 GLU 4 HG3 GLU 4 17.985 27.769 7.272
32 H GLN 5 H GLN 5 18.934 22.879 8.345
33 HA GLN 5 HA GLN 5 21.383 22.610 9.844
34 HB2 GLN 5 HB2 GLN 5 19.275 20.717 8.770
35 HB3 GLN 5 HB3 GLN 5 20.689 20.114 9.654
36 HG2 GLN 5 HG2 GLN 5 18.647 22.091 10.754
37 HG3 GLN 5 HG3 GLN 5 18.661 20.349 11.024
38 HE21 GLN 5 HE21 GLN 5 20.946 19.485 11.949
39 HE22 GLN 5 HE22 GLN 5 21.605 20.522 13.209
40 H CYS 6 H CYS 6 20.605 21.987 6.471
41 HA CYS 6 HA CYS 6 23.320 20.791 6.070
42 HB2 CYS 6 HB2 CYS 6 21.311 19.338 5.809
43 HB3 CYS 6 HB3 CYS 6 20.818 20.322 4.438
44 H CYS 7 H CYS 7 21.331 23.471 5.008
45 HA CYS 7 HA CYS 7 23.109 24.010 2.704
46 HB2 CYS 7 HB2 CYS 7 20.694 24.139 2.437
47 HB3 CYS 7 HB3 CYS 7 20.587 25.378 3.691
48 H THR 8 H THR 8 22.023 25.817 5.651
49 HA THR 8 HA THR 8 24.280 27.706 5.343
50 HB THR 8 HB THR 8 23.200 28.805 7.369
51 HG1 THR 8 HG1 THR 8 21.916 26.974 7.971
52 HG21 THR 8 HG21 THR 8 22.884 29.627 5.048
53 HG22 THR 8 HG22 THR 8 21.421 29.821 6.029
54 HG23 THR 8 HG23 THR 8 21.523 28.504 4.838
55 H SER 9 H SER 9 23.912 24.762 6.803
56 HA SER 9 HA SER 9 26.482 25.083 8.212
57 HB2 SER 9 HB2 SER 9 24.617 25.230 9.922
58 HB3 SER 9 HB3 SER 9 24.179 23.561 9.487
59 HG SER 9 HG SER 9 25.643 23.684 11.283
60 H ILE 10 H ILE 10 27.482 22.873 8.594
61 HA ILE 10 HA ILE 10 27.186 21.344 6.103
62 HB ILE 10 HB ILE 10 29.188 20.103 6.793
63 HG12 ILE 10 HG12 ILE 10 30.617 21.246 8.605
64 HG13 ILE 10 HG13 ILE 10 29.125 21.879 9.269
65 HG21 ILE 10 HG21 ILE 10 30.700 21.911 6.329
66 HG22 ILE 10 HG22 ILE 10 29.218 22.158 5.405
67 HG23 ILE 10 HG23 ILE 10 29.524 23.122 6.870
68 HD11 ILE 10 HD11 ILE 10 28.338 19.578 9.709
69 HD12 ILE 10 HD12 ILE 10 29.746 18.913 8.841
70 HD13 ILE 10 HD13 ILE 10 29.959 19.791 10.371
71 H CYS 11 H CYS 11 27.042 19.074 5.933
72 HA CYS 11 HA CYS 11 25.443 17.735 8.062
73 HB2 CYS 11 HB2 CYS 11 23.854 17.050 6.144
74 HB3 CYS 11 HB3 CYS 11 23.738 18.666 6.831
75 H SER 12 H SER 12 24.932 15.483 7.550
76 HA SER 12 HA SER 12 27.002 13.977 6.042
77 HB2 SER 12 HB2 SER 12 27.809 14.244 8.369
78 HB3 SER 12 HB3 SER 12 26.288 13.569 8.972
79 HG SER 12 HG SER 12 27.986 12.002 8.828
80 H LEU 13 H LEU 13 26.396 11.597 6.039
81 HA LEU 13 HA LEU 13 23.773 11.146 4.967
82 HB2 LEU 13 HB2 LEU 13 25.653 9.106 6.221
83 HB3 LEU 13 HB3 LEU 13 24.341 8.792 5.080
84 HG LEU 13 HG LEU 13 26.942 10.272 4.507
85 HD11 LEU 13 HD11 LEU 13 25.856 7.621 3.485
86 HD12 LEU 13 HD12 LEU 13 27.147 7.819 4.696
87 HD13 LEU 13 HD13 LEU 13 27.401 8.368 3.031
88 HD21 LEU 13 HD21 LEU 13 25.169 11.282 3.149
89 HD22 LEU 13 HD22 LEU 13 24.635 9.671 2.617
90 HD23 LEU 13 HD23 LEU 13 26.229 10.295 2.136
91 H TYR 14 H TYR 14 25.032 10.788 8.292
92 HA TYR 14 HA TYR 14 22.688 9.562 9.417
93 HB2 TYR 14 HB2 TYR 14 24.946 9.614 10.448
94 HB3 TYR 14 HB3 TYR 14 24.793 11.349 10.685
95 HD1 TYR 14 HD2 TYR 14 23.318 8.036 11.629
96 HD2 TYR 14 HD1 TYR 14 23.679 12.222 12.637
97 HE1 TYR 14 HE2 TYR 14 22.235 7.602 13.832
98 HE2 TYR 14 HE1 TYR 14 22.605 11.780 14.836
99 HH TYR 14 HH TYR 14 21.673 10.216 16.226
100 H GLN 15 H GLN 15 23.383 12.959 8.640
101 HA GLN 15 HA GLN 15 21.087 13.978 10.184
102 HB2 GLN 15 HB2 GLN 15 23.107 15.265 10.256
103 HB3 GLN 15 HB3 GLN 15 23.310 15.180 8.513
104 HG2 GLN 15 HG2 GLN 15 22.641 17.373 9.054
105 HG3 GLN 15 HG3 GLN 15 21.342 16.587 8.178
106 HE21 GLN 15 HE21 GLN 15 19.415 15.824 9.543
107 HE22 GLN 15 HE22 GLN 15 19.102 16.681 11.055
108 H LEU 16 H LEU 16 22.035 13.315 6.796
109 HA LEU 16 HA LEU 16 19.601 14.251 5.566
110 HB2 LEU 16 HB2 LEU 16 21.673 12.164 4.812
111 HB3 LEU 16 HB3 LEU 16 20.327 12.566 3.762
112 HG LEU 16 HG LEU 16 22.291 14.684 4.728
113 HD11 LEU 16 HD11 LEU 16 23.381 14.435 2.507
114 HD12 LEU 16 HD12 LEU 16 22.379 12.996 2.195
115 HD13 LEU 16 HD13 LEU 16 23.561 12.999 3.522
116 HD21 LEU 16 HD21 LEU 16 21.498 15.944 2.792
117 HD22 LEU 16 HD22 LEU 16 20.115 15.496 3.793
118 HD23 LEU 16 HD23 LEU 16 20.447 14.602 2.299
119 H GLU 17 H GLU 17 20.483 11.106 7.061
120 HA GLU 17 HA GLU 17 18.046 9.788 6.425
121 HB2 GLU 17 HB2 GLU 17 20.334 8.862 7.318
122 HB3 GLU 17 HB3 GLU 17 19.644 9.161 8.914
123 HG2 GLU 17 HG2 GLU 17 17.677 7.728 8.231
124 HG3 GLU 17 HG3 GLU 17 18.468 7.436 6.679
125 H ASN 18 H ASN 18 18.758 12.110 8.983
126 HA ASN 18 HA ASN 18 16.484 11.507 10.652
127 HB2 ASN 18 HB2 ASN 18 18.545 12.730 11.379
128 HB3 ASN 18 HB3 ASN 18 18.076 14.086 10.346
129 HD21 ASN 18 HD21 ASN 18 16.859 12.123 13.114
130 HD22 ASN 18 HD22 ASN 18 16.006 13.484 13.833
131 H TYR 19 H TYR 19 16.807 13.368 7.669
132 HA TYR 19 HA TYR 19 14.236 14.707 7.886
133 HB2 TYR 19 HB2 TYR 19 15.865 14.147 5.404
134 HB3 TYR 19 HB3 TYR 19 14.661 15.408 5.632
135 HD1 TYR 19 HD2 TYR 19 15.703 16.346 8.444
136 HD2 TYR 19 HD1 TYR 19 17.658 15.516 4.685
137 HE1 TYR 19 HE2 TYR 19 17.505 17.939 9.027
138 HE2 TYR 19 HE1 TYR 19 19.477 17.116 5.289
139 HH TYR 19 HH TYR 19 19.484 18.849 8.392
140 H CYS 20 H CYS 20 15.160 11.495 6.860
141 HA CYS 20 HA CYS 20 12.964 10.848 5.168
142 HB2 CYS 20 HB2 CYS 20 14.519 9.053 7.066
143 HB3 CYS 20 HB3 CYS 20 13.586 8.530 5.663
144 H ASN 21 H ASN 21 11.123 9.452 5.626
145 HA ASN 21 HA ASN 21 9.694 10.217 8.019
146 HB2 ASN 21 HB2 ASN 21 8.677 9.801 5.740
147 HB3 ASN 21 HB3 ASN 21 8.906 8.068 6.022
148 HD21 ASN 21 HD21 ASN 21 7.423 11.019 7.310
149 HD22 ASN 21 HD22 ASN 21 6.161 10.220 8.254
150 H GLY 22 H GLY 22 9.586 9.272 9.938
151 HA2 GLY 22 HA2 GLY 22 11.192 6.926 10.610
152 HA3 GLY 22 HA3 GLY 22 10.228 7.909 11.715
153 H1 PHE 101 H1 PHE 101 32.721 13.561 8.912
154 H2 PHE 101 H2 PHE 101 33.941 12.629 8.359
155 H3 PHE 101 H3 PHE 101 32.545 11.932 8.861
156 HA PHE 101 HA PHE 101 32.668 11.914 6.478
157 HB2 PHE 101 HB2 PHE 101 30.470 12.258 7.775
158 HB3 PHE 101 HB3 PHE 101 30.565 13.945 7.308
159 HD1 PHE 101 HD1 PHE 101 30.822 10.491 5.776
160 HD2 PHE 101 HD2 PHE 101 29.390 14.546 5.317
161 HE1 PHE 101 HE1 PHE 101 29.783 9.884 3.611
162 HE2 PHE 101 HE2 PHE 101 28.331 13.914 3.168
163 HZ PHE 101 HZ PHE 101 28.533 11.597 2.301
164 H VAL 102 H VAL 102 32.017 13.638 4.558
165 HA VAL 102 HA VAL 102 34.515 15.050 4.306
166 HB VAL 102 HB VAL 102 33.394 13.539 2.665
167 HG11 VAL 102 HG11 VAL 102 31.921 14.480 0.967
168 HG12 VAL 102 HG12 VAL 102 31.167 14.543 2.570
169 HG13 VAL 102 HG13 VAL 102 31.859 16.019 1.841
170 HG21 VAL 102 HG21 VAL 102 34.383 16.143 1.467
171 HG22 VAL 102 HG22 VAL 102 35.422 14.858 2.128
172 HG23 VAL 102 HG23 VAL 102 34.392 14.537 0.722
173 H ASN 103 H ASN 103 32.030 16.208 5.791
174 HA ASN 103 HA ASN 103 31.339 18.271 6.496
175 HB2 ASN 103 HB2 ASN 103 33.806 17.956 7.099
176 HB3 ASN 103 HB3 ASN 103 34.170 19.129 5.838
177 HD21 ASN 103 HD21 ASN 103 33.171 21.317 6.106
178 HD22 ASN 103 HD22 ASN 103 33.012 21.908 7.763
179 H GLN 104 H GLN 104 30.319 17.947 4.069
180 HA GLN 104 HA GLN 104 30.604 20.509 2.592
181 HB2 GLN 104 HB2 GLN 104 29.820 19.446 0.707
182 HB3 GLN 104 HB3 GLN 104 30.814 18.213 1.453
183 HG2 GLN 104 HG2 GLN 104 27.782 18.390 1.341
184 HG3 GLN 104 HG3 GLN 104 28.807 17.178 0.595
185 HE21 GLN 104 HE21 GLN 104 26.494 17.013 2.656
186 HE22 GLN 104 HE22 GLN 104 27.240 16.208 4.029
187 H HIS 105 H HIS 105 28.607 21.415 1.679
188 HA HIS 105 HA HIS 105 26.158 21.059 3.329
189 HB2 HIS 105 HB2 HIS 105 25.748 23.524 2.910
190 HB3 HIS 105 HB3 HIS 105 26.983 23.103 4.087
191 HD1 HIS 105 HD1 HIS 105 29.217 24.377 3.798
192 HD2 HIS 105 HD2 HIS 105 26.913 24.118 0.285
193 HE1 HIS 105 HE1 HIS 105 30.455 25.733 2.032
194 H LEU 106 H LEU 106 24.211 21.208 2.259
195 HA LEU 106 HA LEU 106 24.165 21.192 -0.724
196 HB2 LEU 106 HB2 LEU 106 22.714 19.207 1.064
197 HB3 LEU 106 HB3 LEU 106 22.628 19.274 -0.687
198 HG LEU 106 HG LEU 106 25.116 18.531 0.920
199 HD11 LEU 106 HD11 LEU 106 23.310 16.864 1.069
200 HD12 LEU 106 HD12 LEU 106 24.663 16.262 0.097
201 HD13 LEU 106 HD13 LEU 106 23.182 16.839 -0.701
202 HD21 LEU 106 HD21 LEU 106 25.735 19.492 -1.275
203 HD22 LEU 106 HD22 LEU 106 24.569 18.431 -2.083
204 HD23 LEU 106 HD23 LEU 106 25.990 17.745 -1.279
205 H CYS 107 H CYS 107 22.264 22.065 -1.602
206 HA CYS 107 HA CYS 107 20.180 23.039 0.299
207 HB2 CYS 107 HB2 CYS 107 22.162 24.684 -0.541
208 HB3 CYS 107 HB3 CYS 107 21.059 24.871 -1.889
209 H GLY 108 H GLY 108 18.160 23.604 -0.672
210 HA2 GLY 108 HA2 GLY 108 16.332 23.202 -2.022
211 HA3 GLY 108 HA3 GLY 108 17.428 23.614 -3.330
212 H SER 109 H SER 109 16.973 22.208 -4.913
213 HA SER 109 HA SER 109 15.944 19.624 -4.752
214 HB2 SER 109 HB2 SER 109 17.816 20.689 -6.905
215 HB3 SER 109 HB3 SER 109 16.645 19.366 -7.064
216 HG SER 109 HG SER 109 15.819 21.362 -7.873
217 H HIS 110 H HIS 110 19.418 20.547 -4.539
218 HA HIS 110 HA HIS 110 20.362 17.835 -4.877
219 HB2 HIS 110 HB2 HIS 110 21.571 20.115 -5.221
220 HB3 HIS 110 HB3 HIS 110 21.873 20.069 -3.488
221 HD1 HIS 110 HD1 HIS 110 22.525 16.813 -3.449
222 HD2 HIS 110 HD2 HIS 110 23.967 19.763 -6.070
223 HE1 HIS 110 HE1 HIS 110 24.724 15.906 -4.397
224 H LEU 111 H LEU 111 19.412 19.770 -2.070
225 HA LEU 111 HA LEU 111 20.309 17.906 -0.018
226 HB2 LEU 111 HB2 LEU 111 19.744 20.403 0.158
227 HB3 LEU 111 HB3 LEU 111 18.051 19.949 0.127
228 HG LEU 111 HG LEU 111 20.122 19.186 2.234
229 HD11 LEU 111 HD11 LEU 111 19.450 21.553 2.294
230 HD12 LEU 111 HD12 LEU 111 18.755 20.688 3.671
231 HD13 LEU 111 HD13 LEU 111 17.738 21.079 2.273
232 HD21 LEU 111 HD21 LEU 111 18.505 17.399 2.268
233 HD22 LEU 111 HD22 LEU 111 17.149 18.543 2.106
234 HD23 LEU 111 HD23 LEU 111 18.114 18.473 3.595
235 H VAL 112 H VAL 112 17.201 18.541 -1.703
236 HA VAL 112 HA VAL 112 15.659 16.448 -0.524
237 HB VAL 112 HB VAL 112 15.456 17.877 -3.196
238 HG11 VAL 112 HG11 VAL 112 13.090 17.074 -3.282
239 HG12 VAL 112 HG12 VAL 112 14.266 15.788 -3.526
240 HG13 VAL 112 HG13 VAL 112 13.452 15.958 -1.952
241 HG21 VAL 112 HG21 VAL 112 13.599 19.067 -2.074
242 HG22 VAL 112 HG22 VAL 112 13.867 18.114 -0.601
243 HG23 VAL 112 HG23 VAL 112 15.097 19.265 -1.159
244 H GLU 113 H GLU 113 17.570 16.382 -3.600
245 HA GLU 113 HA GLU 113 17.026 13.644 -4.186
246 HB2 GLU 113 HB2 GLU 113 17.881 15.294 -5.793
247 HB3 GLU 113 HB3 GLU 113 19.428 15.356 -4.943
248 HG2 GLU 113 HG2 GLU 113 19.832 12.977 -5.455
249 HG3 GLU 113 HG3 GLU 113 18.234 12.848 -6.196
250 H ALA 114 H ALA 114 19.805 15.090 -2.358
251 HA ALA 114 HA ALA 114 21.144 12.619 -1.897
252 HB1 ALA 114 HB1 ALA 114 22.199 14.808 -1.628
253 HB2 ALA 114 HB2 ALA 114 21.112 15.186 -0.267
254 HB3 ALA 114 HB3 ALA 114 22.296 13.868 -0.122
255 H LEU 115 H LEU 115 18.585 14.290 0.049
256 HA LEU 115 HA LEU 115 18.751 12.322 2.152
257 HB2 LEU 115 HB2 LEU 115 17.263 13.477 3.314
258 HB3 LEU 115 HB3 LEU 115 17.905 14.729 2.290
259 HG LEU 115 HG LEU 115 15.758 14.194 0.800
260 HD11 LEU 115 HD11 LEU 115 13.808 13.644 2.348
261 HD12 LEU 115 HD12 LEU 115 14.999 13.082 3.529
262 HD13 LEU 115 HD13 LEU 115 14.853 12.285 1.951
263 HD21 LEU 115 HD21 LEU 115 16.216 16.317 1.907
264 HD22 LEU 115 HD22 LEU 115 15.627 15.670 3.446
265 HD23 LEU 115 HD23 LEU 115 14.511 15.885 2.090
266 H TYR 116 H TYR 116 16.627 12.599 -0.745
267 HA TYR 116 HA TYR 116 15.101 10.236 -0.260
268 HB2 TYR 116 HB2 TYR 116 15.880 11.839 -2.670
269 HB3 TYR 116 HB3 TYR 116 15.357 10.200 -2.968
270 HD1 TYR 116 HD2 TYR 116 13.145 9.499 -1.493
271 HD2 TYR 116 HD1 TYR 116 14.160 13.428 -2.951
272 HE1 TYR 116 HE2 TYR 116 10.738 10.100 -1.535
273 HE2 TYR 116 HE1 TYR 116 11.743 14.029 -2.997
274 HH TYR 116 HH TYR 116 9.175 11.690 -2.093
275 H LEU 117 H LEU 117 18.308 10.561 -1.854
276 HA LEU 117 HA LEU 117 18.665 7.770 -2.400
277 HB2 LEU 117 HB2 LEU 117 20.364 10.229 -2.367
278 HB3 LEU 117 HB3 LEU 117 21.208 8.713 -2.142
279 HG LEU 117 HG LEU 117 20.315 7.798 -4.214
280 HD11 LEU 117 HD11 LEU 117 19.038 10.520 -4.721
281 HD12 LEU 117 HD12 LEU 117 18.155 9.011 -4.390
282 HD13 LEU 117 HD13 LEU 117 19.126 9.167 -5.853
283 HD21 LEU 117 HD21 LEU 117 21.545 10.559 -4.579
284 HD22 LEU 117 HD22 LEU 117 21.554 9.248 -5.775
285 HD23 LEU 117 HD23 LEU 117 22.437 9.062 -4.249
286 H VAL 118 H VAL 118 19.402 9.660 0.547
287 HA VAL 118 HA VAL 118 20.583 7.377 1.930
288 HB VAL 118 HB VAL 118 19.612 10.082 2.886
289 HG11 VAL 118 HG11 VAL 118 19.331 8.579 4.783
290 HG12 VAL 118 HG12 VAL 118 20.945 7.875 4.506
291 HG13 VAL 118 HG13 VAL 118 20.768 9.566 5.011
292 HG21 VAL 118 HG21 VAL 118 22.035 10.462 3.200
293 HG22 VAL 118 HG22 VAL 118 22.371 8.809 2.646
294 HG23 VAL 118 HG23 VAL 118 21.711 10.008 1.526
295 H CYS 119 H CYS 119 17.227 8.668 1.788
296 HA CYS 119 HA CYS 119 16.198 7.050 3.877
297 HB2 CYS 119 HB2 CYS 119 14.729 8.079 1.417
298 HB3 CYS 119 HB3 CYS 119 14.007 7.513 2.917
299 H GLY 120 H GLY 120 16.665 6.211 0.443
300 HA2 GLY 120 HA2 GLY 120 16.478 4.180 -0.658
301 HA3 GLY 120 HA3 GLY 120 16.633 3.406 0.924
302 H GLU 121 H GLU 121 14.926 2.320 1.693
303 HA GLU 121 HA GLU 121 12.378 2.267 0.237
304 HB2 GLU 121 HB2 GLU 121 11.806 0.424 1.704
305 HB3 GLU 121 HB3 GLU 121 13.348 0.172 0.906
306 HG2 GLU 121 HG2 GLU 121 13.318 1.308 3.716
307 HG3 GLU 121 HG3 GLU 121 12.981 -0.395 3.465
308 H ARG 122 H ARG 122 13.487 4.168 2.854
309 HA ARG 122 HA ARG 122 10.809 4.527 4.065
310 HB2 ARG 122 HB2 ARG 122 13.384 6.067 4.571
311 HB3 ARG 122 HB3 ARG 122 11.879 6.227 5.464
312 HG2 ARG 122 HG2 ARG 122 13.735 3.829 5.414
313 HG3 ARG 122 HG3 ARG 122 13.413 4.911 6.762
314 HD2 ARG 122 HD2 ARG 122 11.501 2.899 5.524
315 HD3 ARG 122 HD3 ARG 122 12.282 2.790 7.095
316 HE ARG 122 HE ARG 122 10.962 4.872 7.742
317 HH11 ARG 122 HH11 ARG 122 9.607 2.798 5.246
318 HH12 ARG 122 HH12 ARG 122 7.982 3.270 5.649
319 HH21 ARG 122 HH21 ARG 122 8.895 5.143 8.370
320 HH22 ARG 122 HH22 ARG 122 7.590 4.662 7.311
321 H GLY 123 H GLY 123 9.591 6.373 4.036
322 HA2 GLY 123 HA2 GLY 123 9.552 7.827 1.485
323 HA3 GLY 123 HA3 GLY 123 8.387 7.967 2.792
324 H PHE 124 H PHE 124 8.625 10.174 1.904
325 HA PHE 124 HA PHE 124 10.981 11.715 2.742
326 HB2 PHE 124 HB2 PHE 124 9.835 11.824 0.491
327 HB3 PHE 124 HB3 PHE 124 8.465 12.590 1.279
328 HD1 PHE 124 HD2 PHE 124 12.046 12.889 0.422
329 HD2 PHE 124 HD1 PHE 124 8.595 14.932 1.968
330 HE1 PHE 124 HE2 PHE 124 13.235 15.067 0.176
331 HE2 PHE 124 HE1 PHE 124 9.775 17.116 1.740
332 HZ PHE 124 HZ PHE 124 12.100 17.180 0.840
333 H PHE 125 H PHE 125 10.995 13.403 4.132
334 HA PHE 125 HA PHE 125 10.651 14.665 5.907
335 HB2 PHE 125 HB2 PHE 125 9.007 15.697 4.447
336 HB3 PHE 125 HB3 PHE 125 7.742 14.670 5.117
337 HD1 PHE 125 HD2 PHE 125 10.308 17.238 6.073
338 HD2 PHE 125 HD1 PHE 125 6.572 15.338 7.076
339 HE1 PHE 125 HE2 PHE 125 9.969 18.875 7.907
340 HE2 PHE 125 HE1 PHE 125 6.221 16.986 8.901
341 HZ PHE 125 HZ PHE 125 7.927 18.752 9.322
342 H TYR 126 H TYR 126 10.687 14.452 8.053
343 HA TYR 126 HA TYR 126 9.554 12.054 9.296
344 HB2 TYR 126 HB2 TYR 126 11.810 13.061 9.822
345 HB3 TYR 126 HB3 TYR 126 10.977 14.354 10.665
346 HD1 TYR 126 HD1 TYR 126 9.396 13.659 12.656
347 HD2 TYR 126 HD2 TYR 126 12.279 11.001 10.846
348 HE1 TYR 126 HE1 TYR 126 9.310 12.194 14.658
349 HE2 TYR 126 HE2 TYR 126 12.200 9.548 12.861
350 HH TYR 126 HH TYR 126 11.305 9.230 14.956
351 H THR 127 H THR 127 7.363 12.048 9.497
352 HA THR 127 HA THR 127 5.847 14.460 9.951
353 HB THR 127 HB THR 127 3.903 12.800 10.142
354 HG1 THR 127 HG1 THR 127 4.278 10.749 9.713
355 HG21 THR 127 HG21 THR 127 5.630 12.801 7.627
356 HG22 THR 127 HG22 THR 127 4.411 14.017 8.075
357 HG23 THR 127 HG23 THR 127 3.908 12.354 7.714
358 HA PRO 128 HA PRO 128 5.441 14.631 14.334
359 HB2 PRO 128 HB2 PRO 128 2.461 14.889 13.924
360 HB3 PRO 128 HB3 PRO 128 3.558 15.895 14.930
361 HG2 PRO 128 HG2 PRO 128 2.729 16.795 12.520
362 HG3 PRO 128 HG3 PRO 128 4.449 16.977 12.993
363 HD2 PRO 128 HD2 PRO 128 3.197 14.856 11.227
364 HD3 PRO 128 HD3 PRO 128 4.675 15.827 10.957
365 H LYS 129 H LYS 129 4.811 13.504 16.204
366 HA LYS 129 HA LYS 129 3.336 10.920 15.915
367 HB2 LYS 129 HB2 LYS 129 6.080 11.301 17.190
368 HB3 LYS 129 HB3 LYS 129 5.083 9.847 17.338
369 HG2 LYS 129 HG2 LYS 129 5.120 9.570 14.861
370 HG3 LYS 129 HG3 LYS 129 6.201 10.973 14.733
371 HD2 LYS 129 HD2 LYS 129 7.873 9.821 16.150
372 HD3 LYS 129 HD3 LYS 129 6.830 8.404 16.264
373 HE2 LYS 129 HE2 LYS 129 7.944 9.557 13.657
374 HE3 LYS 129 HE3 LYS 129 8.673 8.236 14.564
375 HZ1 LYS 129 HZ1 LYS 129 7.317 7.334 12.817
376 HZ2 LYS 129 HZ2 LYS 129 5.988 8.166 13.301
377 HZ3 LYS 129 HZ3 LYS 129 6.600 6.971 14.238
378 H THR 130 H THR 130 2.664 9.962 17.933
379 HA THR 130 HA THR 130 1.394 11.914 19.677
380 HB THR 130 HB THR 130 0.484 9.865 20.813
381 HG1 THR 130 HG1 THR 130 0.841 7.896 19.774
382 HG21 THR 130 HG21 THR 130 -0.983 9.223 18.963
383 HG22 THR 130 HG22 THR 130 0.143 9.916 17.774
384 HG23 THR 130 HG23 THR 130 -0.706 10.965 18.925
385 H ARG 131 H ARG 131 1.413 11.796 22.010
386 HA ARG 131 HA ARG 131 3.906 10.896 23.323
387 HB2 ARG 131 HB2 ARG 131 4.303 13.235 22.559
388 HB3 ARG 131 HB3 ARG 131 2.841 13.747 23.393
389 HG2 ARG 131 HG2 ARG 131 4.785 14.364 24.684
390 HG3 ARG 131 HG3 ARG 131 3.868 13.150 25.580
391 HD2 ARG 131 HD2 ARG 131 5.453 11.394 24.848
392 HD3 ARG 131 HD3 ARG 131 6.348 12.599 23.892
393 HE ARG 131 HE ARG 131 6.189 13.501 26.589
394 HH11 ARG 131 HH11 ARG 131 7.811 10.965 24.799
395 HH12 ARG 131 HH12 ARG 131 9.118 10.865 25.950
396 HH21 ARG 131 HH21 ARG 131 7.885 13.333 27.997
397 HH22 ARG 131 HH22 ARG 131 9.154 12.171 27.710
Start of MODEL 13
1 H1 GLY 1 H1 GLY 1 12.740 23.899 10.349
2 H2 GLY 1 H2 GLY 1 14.216 24.481 9.955
3 H3 GLY 1 H3 GLY 1 14.084 23.118 10.873
4 HA2 GLY 1 HA2 GLY 1 13.014 21.946 9.031
5 HA3 GLY 1 HA3 GLY 1 13.311 23.388 8.042
6 H ILE 2 H ILE 2 14.341 21.345 6.893
7 HA ILE 2 HA ILE 2 16.949 20.515 7.876
8 HB ILE 2 HB ILE 2 15.394 19.051 6.651
9 HG12 ILE 2 HG12 ILE 2 18.181 19.367 5.471
10 HG13 ILE 2 HG13 ILE 2 17.709 18.450 6.887
11 HG21 ILE 2 HG21 ILE 2 16.137 20.567 4.113
12 HG22 ILE 2 HG22 ILE 2 15.082 19.152 4.254
13 HG23 ILE 2 HG23 ILE 2 14.571 20.685 4.937
14 HD11 ILE 2 HD11 ILE 2 17.982 16.870 5.130
15 HD12 ILE 2 HD12 ILE 2 16.229 17.049 5.334
16 HD13 ILE 2 HD13 ILE 2 17.054 17.844 3.981
17 H VAL 3 H VAL 3 15.933 22.929 5.480
18 HA VAL 3 HA VAL 3 18.423 23.240 4.130
19 HB VAL 3 HB VAL 3 16.268 25.335 4.617
20 HG11 VAL 3 HG11 VAL 3 18.348 26.387 3.780
21 HG12 VAL 3 HG12 VAL 3 18.414 25.199 2.453
22 HG13 VAL 3 HG13 VAL 3 17.098 26.389 2.543
23 HG21 VAL 3 HG21 VAL 3 16.663 23.376 2.303
24 HG22 VAL 3 HG22 VAL 3 15.350 23.328 3.500
25 HG23 VAL 3 HG23 VAL 3 15.453 24.669 2.364
26 H GLU 4 H GLU 4 17.201 24.883 7.067
27 HA GLU 4 HA GLU 4 19.676 26.381 7.419
28 HB2 GLU 4 HB2 GLU 4 18.634 27.335 9.322
29 HB3 GLU 4 HB3 GLU 4 17.463 27.239 7.997
30 HG2 GLU 4 HG2 GLU 4 16.638 25.054 9.056
31 HG3 GLU 4 HG3 GLU 4 17.623 25.434 10.467
32 H GLN 5 H GLN 5 19.478 23.229 7.617
33 HA GLN 5 HA GLN 5 21.480 23.026 9.831
34 HB2 GLN 5 HB2 GLN 5 19.442 20.972 8.864
35 HB3 GLN 5 HB3 GLN 5 20.715 20.664 10.035
36 HG2 GLN 5 HG2 GLN 5 18.487 22.721 10.448
37 HG3 GLN 5 HG3 GLN 5 18.429 21.066 11.015
38 HE21 GLN 5 HE21 GLN 5 20.254 24.161 11.402
39 HE22 GLN 5 HE22 GLN 5 20.816 23.741 13.022
40 H CYS 6 H CYS 6 20.612 22.093 6.508
41 HA CYS 6 HA CYS 6 23.353 20.948 6.114
42 HB2 CYS 6 HB2 CYS 6 20.685 20.476 4.774
43 HB3 CYS 6 HB3 CYS 6 22.206 19.925 4.078
44 H CYS 7 H CYS 7 21.412 23.682 5.021
45 HA CYS 7 HA CYS 7 23.215 24.098 2.689
46 HB2 CYS 7 HB2 CYS 7 20.762 24.240 2.408
47 HB3 CYS 7 HB3 CYS 7 20.719 25.610 3.525
48 H THR 8 H THR 8 22.167 25.781 5.690
49 HA THR 8 HA THR 8 23.954 28.038 5.349
50 HB THR 8 HB THR 8 23.323 28.495 7.746
51 HG1 THR 8 HG1 THR 8 21.942 27.118 8.734
52 HG21 THR 8 HG21 THR 8 20.966 27.836 5.901
53 HG22 THR 8 HG22 THR 8 21.916 29.340 5.881
54 HG23 THR 8 HG23 THR 8 20.943 28.929 7.305
55 H SER 9 H SER 9 24.362 24.873 6.732
56 HA SER 9 HA SER 9 27.218 25.378 7.241
57 HB2 SER 9 HB2 SER 9 25.882 25.774 9.415
58 HB3 SER 9 HB3 SER 9 25.513 24.042 9.365
59 HG SER 9 HG SER 9 27.978 25.381 9.739
60 H ILE 10 H ILE 10 28.319 23.225 7.738
61 HA ILE 10 HA ILE 10 27.649 21.256 5.757
62 HB ILE 10 HB ILE 10 29.355 19.841 6.958
63 HG12 ILE 10 HG12 ILE 10 29.871 22.348 8.617
64 HG13 ILE 10 HG13 ILE 10 29.097 20.891 9.233
65 HG21 ILE 10 HG21 ILE 10 29.825 21.318 5.013
66 HG22 ILE 10 HG22 ILE 10 30.366 22.576 6.147
67 HG23 ILE 10 HG23 ILE 10 31.217 21.013 6.048
68 HD11 ILE 10 HD11 ILE 10 31.424 20.917 9.896
69 HD12 ILE 10 HD12 ILE 10 31.151 19.590 8.759
70 HD13 ILE 10 HD13 ILE 10 31.959 21.080 8.219
71 H CYS 11 H CYS 11 26.792 19.210 5.881
72 HA CYS 11 HA CYS 11 26.088 18.098 8.511
73 HB2 CYS 11 HB2 CYS 11 23.841 17.758 8.142
74 HB3 CYS 11 HB3 CYS 11 24.105 19.397 7.583
75 H SER 12 H SER 12 25.195 15.797 8.181
76 HA SER 12 HA SER 12 26.873 14.350 6.169
77 HB2 SER 12 HB2 SER 12 27.807 14.369 8.470
78 HB3 SER 12 HB3 SER 12 26.319 13.599 9.056
79 HG SER 12 HG SER 12 28.151 12.175 8.527
80 H LEU 13 H LEU 13 26.236 12.199 5.634
81 HA LEU 13 HA LEU 13 23.520 11.833 4.815
82 HB2 LEU 13 HB2 LEU 13 25.601 9.673 5.356
83 HB3 LEU 13 HB3 LEU 13 24.197 9.565 4.302
84 HG LEU 13 HG LEU 13 26.706 11.220 3.881
85 HD11 LEU 13 HD11 LEU 13 26.908 8.819 3.399
86 HD12 LEU 13 HD12 LEU 13 27.014 9.780 1.919
87 HD13 LEU 13 HD13 LEU 13 25.513 8.908 2.308
88 HD21 LEU 13 HD21 LEU 13 25.809 11.867 1.675
89 HD22 LEU 13 HD22 LEU 13 24.828 12.536 2.977
90 HD23 LEU 13 HD23 LEU 13 24.257 11.113 2.069
91 H TYR 14 H TYR 14 25.198 10.754 7.786
92 HA TYR 14 HA TYR 14 23.033 9.174 8.789
93 HB2 TYR 14 HB2 TYR 14 25.264 10.558 10.314
94 HB3 TYR 14 HB3 TYR 14 24.276 9.223 10.900
95 HD1 TYR 14 HD2 TYR 14 24.269 7.035 9.401
96 HD2 TYR 14 HD1 TYR 14 27.342 10.055 9.293
97 HE1 TYR 14 HE2 TYR 14 25.840 5.395 8.387
98 HE2 TYR 14 HE1 TYR 14 28.913 8.421 8.256
99 HH TYR 14 HH TYR 14 27.939 5.038 7.563
100 H GLN 15 H GLN 15 23.376 12.616 8.680
101 HA GLN 15 HA GLN 15 21.258 13.102 10.717
102 HB2 GLN 15 HB2 GLN 15 22.771 15.032 8.914
103 HB3 GLN 15 HB3 GLN 15 21.614 15.459 10.172
104 HG2 GLN 15 HG2 GLN 15 23.069 14.530 11.908
105 HG3 GLN 15 HG3 GLN 15 24.230 13.973 10.696
106 HE21 GLN 15 HE21 GLN 15 23.130 16.785 12.517
107 HE22 GLN 15 HE22 GLN 15 24.329 17.875 11.833
108 H LEU 16 H LEU 16 21.707 12.970 7.165
109 HA LEU 16 HA LEU 16 19.159 14.085 6.473
110 HB2 LEU 16 HB2 LEU 16 20.900 12.122 4.954
111 HB3 LEU 16 HB3 LEU 16 19.500 12.958 4.310
112 HG LEU 16 HG LEU 16 22.068 14.305 5.251
113 HD11 LEU 16 HD11 LEU 16 20.820 13.958 2.501
114 HD12 LEU 16 HD12 LEU 16 22.238 13.071 3.115
115 HD13 LEU 16 HD13 LEU 16 22.329 14.820 2.863
116 HD21 LEU 16 HD21 LEU 16 21.097 16.349 4.207
117 HD22 LEU 16 HD22 LEU 16 20.183 15.836 5.629
118 HD23 LEU 16 HD23 LEU 16 19.556 15.497 3.994
119 H GLU 17 H GLU 17 19.993 10.835 7.560
120 HA GLU 17 HA GLU 17 17.574 9.480 6.971
121 HB2 GLU 17 HB2 GLU 17 19.449 9.259 9.365
122 HB3 GLU 17 HB3 GLU 17 18.130 8.128 9.020
123 HG2 GLU 17 HG2 GLU 17 19.174 7.637 6.795
124 HG3 GLU 17 HG3 GLU 17 20.553 8.641 7.257
125 H ASN 18 H ASN 18 18.087 12.056 9.332
126 HA ASN 18 HA ASN 18 15.812 11.464 11.023
127 HB2 ASN 18 HB2 ASN 18 17.801 12.880 11.621
128 HB3 ASN 18 HB3 ASN 18 17.245 14.088 10.464
129 HD21 ASN 18 HD21 ASN 18 16.748 15.788 11.816
130 HD22 ASN 18 HD22 ASN 18 15.579 15.657 13.125
131 H TYR 19 H TYR 19 16.140 13.031 7.904
132 HA TYR 19 HA TYR 19 13.466 14.318 8.106
133 HB2 TYR 19 HB2 TYR 19 15.690 14.725 6.077
134 HB3 TYR 19 HB3 TYR 19 14.248 15.714 6.282
135 HD1 TYR 19 HD1 TYR 19 13.916 17.039 8.452
136 HD2 TYR 19 HD2 TYR 19 17.637 15.106 7.440
137 HE1 TYR 19 HE1 TYR 19 15.107 18.430 10.145
138 HE2 TYR 19 HE2 TYR 19 18.819 16.459 9.147
139 HH TYR 19 HH TYR 19 18.618 18.088 10.774
140 H CYS 20 H CYS 20 14.753 11.489 6.744
141 HA CYS 20 HA CYS 20 13.193 11.606 4.269
142 HB2 CYS 20 HB2 CYS 20 14.455 9.740 3.633
143 HB3 CYS 20 HB3 CYS 20 15.563 10.799 4.510
144 H ASN 21 H ASN 21 12.666 10.302 7.394
145 HA ASN 21 HA ASN 21 10.581 8.379 6.400
146 HB2 ASN 21 HB2 ASN 21 12.713 7.426 7.346
147 HB3 ASN 21 HB3 ASN 21 12.354 8.216 8.885
148 HD21 ASN 21 HD21 ASN 21 10.278 7.497 10.023
149 HD22 ASN 21 HD22 ASN 21 9.680 5.889 9.633
150 H GLY 22 H GLY 22 11.444 10.717 8.919
151 HA2 GLY 22 HA2 GLY 22 10.179 11.848 10.530
152 HA3 GLY 22 HA3 GLY 22 8.706 11.340 9.700
153 H1 PHE 101 H1 PHE 101 32.786 8.861 2.620
154 H2 PHE 101 H2 PHE 101 33.510 9.628 1.370
155 H3 PHE 101 H3 PHE 101 32.110 8.815 1.121
156 HA PHE 101 HA PHE 101 31.719 11.184 1.169
157 HB2 PHE 101 HB2 PHE 101 29.901 9.711 1.876
158 HB3 PHE 101 HB3 PHE 101 30.535 9.628 3.513
159 HD1 PHE 101 HD1 PHE 101 28.989 11.922 0.986
160 HD2 PHE 101 HD2 PHE 101 30.073 11.353 5.128
161 HE1 PHE 101 HE1 PHE 101 27.734 13.973 1.606
162 HE2 PHE 101 HE2 PHE 101 28.850 13.416 5.728
163 HZ PHE 101 HZ PHE 101 27.668 14.728 3.970
164 H VAL 102 H VAL 102 31.735 13.167 2.315
165 HA VAL 102 HA VAL 102 32.982 13.344 4.950
166 HB VAL 102 HB VAL 102 34.911 13.584 3.463
167 HG11 VAL 102 HG11 VAL 102 33.825 14.588 1.458
168 HG12 VAL 102 HG12 VAL 102 33.577 16.093 2.358
169 HG13 VAL 102 HG13 VAL 102 35.220 15.524 2.017
170 HG21 VAL 102 HG21 VAL 102 34.218 16.238 4.789
171 HG22 VAL 102 HG22 VAL 102 34.821 14.790 5.632
172 HG23 VAL 102 HG23 VAL 102 35.833 15.598 4.425
173 H ASN 103 H ASN 103 32.220 15.091 6.121
174 HA ASN 103 HA ASN 103 29.638 16.002 5.652
175 HB2 ASN 103 HB2 ASN 103 30.222 17.786 7.402
176 HB3 ASN 103 HB3 ASN 103 30.390 16.115 7.852
177 HD21 ASN 103 HD21 ASN 103 32.592 18.475 6.187
178 HD22 ASN 103 HD22 ASN 103 33.903 18.212 7.335
179 H GLN 104 H GLN 104 28.616 17.566 4.574
180 HA GLN 104 HA GLN 104 30.145 19.733 3.246
181 HB2 GLN 104 HB2 GLN 104 29.094 17.241 1.954
182 HB3 GLN 104 HB3 GLN 104 28.676 18.720 1.109
183 HG2 GLN 104 HG2 GLN 104 31.513 17.918 1.864
184 HG3 GLN 104 HG3 GLN 104 30.773 17.712 0.283
185 HE21 GLN 104 HE21 GLN 104 33.005 19.080 0.077
186 HE22 GLN 104 HE22 GLN 104 32.698 20.807 -0.065
187 H HIS 105 H HIS 105 28.796 21.151 1.922
188 HA HIS 105 HA HIS 105 26.194 21.770 3.201
189 HB2 HIS 105 HB2 HIS 105 27.850 23.208 1.100
190 HB3 HIS 105 HB3 HIS 105 26.250 23.720 1.601
191 HD1 HIS 105 HD1 HIS 105 26.212 25.436 3.525
192 HD2 HIS 105 HD2 HIS 105 29.745 23.162 3.278
193 HE1 HIS 105 HE1 HIS 105 27.832 26.445 5.215
194 H LEU 106 H LEU 106 24.262 21.486 2.243
195 HA LEU 106 HA LEU 106 23.954 20.767 -0.619
196 HB2 LEU 106 HB2 LEU 106 22.984 19.174 1.787
197 HB3 LEU 106 HB3 LEU 106 22.207 19.044 0.211
198 HG LEU 106 HG LEU 106 25.152 18.400 0.676
199 HD11 LEU 106 HD11 LEU 106 23.746 16.909 2.001
200 HD12 LEU 106 HD12 LEU 106 24.400 16.043 0.602
201 HD13 LEU 106 HD13 LEU 106 22.708 16.597 0.595
202 HD21 LEU 106 HD21 LEU 106 23.239 17.770 -1.614
203 HD22 LEU 106 HD22 LEU 106 24.906 17.182 -1.467
204 HD23 LEU 106 HD23 LEU 106 24.609 18.912 -1.673
205 H CYS 107 H CYS 107 22.130 21.680 -1.503
206 HA CYS 107 HA CYS 107 20.117 22.922 0.292
207 HB2 CYS 107 HB2 CYS 107 22.220 24.399 -0.574
208 HB3 CYS 107 HB3 CYS 107 21.167 24.584 -1.962
209 H GLY 108 H GLY 108 18.131 23.542 -0.765
210 HA2 GLY 108 HA2 GLY 108 16.329 23.166 -2.175
211 HA3 GLY 108 HA3 GLY 108 17.515 23.479 -3.440
212 H SER 109 H SER 109 16.948 22.040 -5.002
213 HA SER 109 HA SER 109 15.868 19.478 -4.662
214 HB2 SER 109 HB2 SER 109 17.567 20.457 -6.993
215 HB3 SER 109 HB3 SER 109 16.385 19.132 -7.022
216 HG SER 109 HG SER 109 15.480 21.095 -7.823
217 H HIS 110 H HIS 110 19.332 20.360 -4.574
218 HA HIS 110 HA HIS 110 20.282 17.656 -4.899
219 HB2 HIS 110 HB2 HIS 110 21.549 19.911 -5.197
220 HB3 HIS 110 HB3 HIS 110 21.757 19.873 -3.441
221 HD1 HIS 110 HD1 HIS 110 24.424 19.840 -4.546
222 HD2 HIS 110 HD2 HIS 110 22.065 16.355 -4.600
223 HE1 HIS 110 HE1 HIS 110 26.034 17.887 -4.814
224 H LEU 111 H LEU 111 19.322 19.637 -2.119
225 HA LEU 111 HA LEU 111 20.163 17.749 -0.075
226 HB2 LEU 111 HB2 LEU 111 19.943 20.162 0.306
227 HB3 LEU 111 HB3 LEU 111 18.223 20.097 -0.064
228 HG LEU 111 HG LEU 111 17.783 18.788 1.950
229 HD11 LEU 111 HD11 LEU 111 19.594 18.432 3.632
230 HD12 LEU 111 HD12 LEU 111 20.786 18.980 2.432
231 HD13 LEU 111 HD13 LEU 111 19.850 17.491 2.167
232 HD21 LEU 111 HD21 LEU 111 17.810 21.242 2.073
233 HD22 LEU 111 HD22 LEU 111 19.553 21.227 2.442
234 HD23 LEU 111 HD23 LEU 111 18.396 20.547 3.592
235 H VAL 112 H VAL 112 17.068 18.395 -1.767
236 HA VAL 112 HA VAL 112 15.557 16.337 -0.416
237 HB VAL 112 HB VAL 112 15.176 17.466 -3.218
238 HG11 VAL 112 HG11 VAL 112 13.271 15.897 -1.421
239 HG12 VAL 112 HG12 VAL 112 12.828 16.701 -2.940
240 HG13 VAL 112 HG13 VAL 112 13.949 15.341 -2.968
241 HG21 VAL 112 HG21 VAL 112 13.912 18.207 -0.547
242 HG22 VAL 112 HG22 VAL 112 15.012 19.226 -1.482
243 HG23 VAL 112 HG23 VAL 112 13.414 18.851 -2.131
244 H GLU 113 H GLU 113 17.391 16.262 -3.550
245 HA GLU 113 HA GLU 113 16.987 13.513 -4.079
246 HB2 GLU 113 HB2 GLU 113 17.943 15.119 -5.683
247 HB3 GLU 113 HB3 GLU 113 19.427 15.228 -4.718
248 HG2 GLU 113 HG2 GLU 113 19.916 12.859 -5.127
249 HG3 GLU 113 HG3 GLU 113 18.358 12.648 -5.929
250 H ALA 114 H ALA 114 19.573 15.051 -2.062
251 HA ALA 114 HA ALA 114 20.917 12.628 -1.479
252 HB1 ALA 114 HB1 ALA 114 21.882 14.878 -1.220
253 HB2 ALA 114 HB2 ALA 114 20.774 15.199 0.131
254 HB3 ALA 114 HB3 ALA 114 22.012 13.931 0.272
255 H LEU 115 H LEU 115 18.248 14.237 0.430
256 HA LEU 115 HA LEU 115 18.459 12.199 2.486
257 HB2 LEU 115 HB2 LEU 115 16.744 13.239 3.634
258 HB3 LEU 115 HB3 LEU 115 17.653 14.516 2.861
259 HG LEU 115 HG LEU 115 15.757 14.289 0.984
260 HD11 LEU 115 HD11 LEU 115 13.553 13.868 1.953
261 HD12 LEU 115 HD12 LEU 115 14.297 13.438 3.509
262 HD13 LEU 115 HD13 LEU 115 14.529 12.399 2.088
263 HD21 LEU 115 HD21 LEU 115 16.257 16.300 2.292
264 HD22 LEU 115 HD22 LEU 115 15.291 15.666 3.644
265 HD23 LEU 115 HD23 LEU 115 14.515 16.067 2.098
266 H TYR 116 H TYR 116 16.546 12.424 -0.477
267 HA TYR 116 HA TYR 116 15.011 9.998 0.000
268 HB2 TYR 116 HB2 TYR 116 15.696 11.716 -2.378
269 HB3 TYR 116 HB3 TYR 116 15.077 10.100 -2.656
270 HD1 TYR 116 HD1 TYR 116 14.207 13.128 -0.565
271 HD2 TYR 116 HD2 TYR 116 12.799 9.805 -2.925
272 HE1 TYR 116 HE1 TYR 116 11.883 13.965 -0.351
273 HE2 TYR 116 HE2 TYR 116 10.463 10.643 -2.704
274 HH TYR 116 HH TYR 116 9.098 12.273 -1.843
275 H LEU 117 H LEU 117 18.116 10.627 -1.730
276 HA LEU 117 HA LEU 117 18.546 7.957 -2.556
277 HB2 LEU 117 HB2 LEU 117 19.546 9.936 -3.526
278 HB3 LEU 117 HB3 LEU 117 20.494 10.256 -2.080
279 HG LEU 117 HG LEU 117 20.843 7.661 -3.617
280 HD11 LEU 117 HD11 LEU 117 21.018 9.486 -5.266
281 HD12 LEU 117 HD12 LEU 117 22.604 8.765 -4.944
282 HD13 LEU 117 HD13 LEU 117 22.184 10.334 -4.218
283 HD21 LEU 117 HD21 LEU 117 22.767 9.386 -1.969
284 HD22 LEU 117 HD22 LEU 117 23.199 7.890 -2.820
285 HD23 LEU 117 HD23 LEU 117 22.082 7.830 -1.462
286 H VAL 118 H VAL 118 19.662 9.641 0.416
287 HA VAL 118 HA VAL 118 21.194 7.519 1.529
288 HB VAL 118 HB VAL 118 19.710 9.880 2.718
289 HG11 VAL 118 HG11 VAL 118 19.688 8.208 4.519
290 HG12 VAL 118 HG12 VAL 118 21.428 7.919 4.290
291 HG13 VAL 118 HG13 VAL 118 20.825 9.498 4.859
292 HG21 VAL 118 HG21 VAL 118 21.825 10.264 1.429
293 HG22 VAL 118 HG22 VAL 118 21.999 10.680 3.138
294 HG23 VAL 118 HG23 VAL 118 22.667 9.151 2.518
295 H CYS 119 H CYS 119 17.671 8.076 1.610
296 HA CYS 119 HA CYS 119 17.336 5.576 3.197
297 HB2 CYS 119 HB2 CYS 119 15.449 7.863 2.681
298 HB3 CYS 119 HB3 CYS 119 15.110 6.441 3.680
299 H GLY 120 H GLY 120 17.695 5.889 0.099
300 HA2 GLY 120 HA2 GLY 120 17.204 4.493 -1.661
301 HA3 GLY 120 HA3 GLY 120 16.494 3.389 -0.488
302 H GLU 121 H GLU 121 14.312 3.171 -0.402
303 HA GLU 121 HA GLU 121 12.692 4.437 -2.509
304 HB2 GLU 121 HB2 GLU 121 11.038 2.784 -1.987
305 HB3 GLU 121 HB3 GLU 121 12.611 2.019 -2.173
306 HG2 GLU 121 HG2 GLU 121 12.844 1.886 0.309
307 HG3 GLU 121 HG3 GLU 121 11.258 2.652 0.488
308 H ARG 122 H ARG 122 13.328 5.188 0.771
309 HA ARG 122 HA ARG 122 10.718 6.611 1.087
310 HB2 ARG 122 HB2 ARG 122 12.786 5.764 3.153
311 HB3 ARG 122 HB3 ARG 122 11.419 6.838 3.490
312 HG2 ARG 122 HG2 ARG 122 9.859 5.054 2.643
313 HG3 ARG 122 HG3 ARG 122 11.245 3.959 2.513
314 HD2 ARG 122 HD2 ARG 122 11.650 4.177 4.944
315 HD3 ARG 122 HD3 ARG 122 10.290 5.312 5.071
316 HE ARG 122 HE ARG 122 9.405 2.886 3.837
317 HH11 ARG 122 HH21 ARG 122 10.243 4.058 7.051
318 HH12 ARG 122 HH22 ARG 122 9.233 2.864 7.819
319 HH21 ARG 122 HH11 ARG 122 8.144 1.418 4.905
320 HH22 ARG 122 HH12 ARG 122 8.109 1.407 6.642
321 H GLY 123 H GLY 123 10.578 8.681 1.739
322 HA2 GLY 123 HA2 GLY 123 12.751 10.527 2.034
323 HA3 GLY 123 HA3 GLY 123 12.039 10.664 0.427
324 H PHE 124 H PHE 124 12.005 12.516 2.788
325 HA PHE 124 HA PHE 124 10.714 13.578 4.298
326 HB2 PHE 124 HB2 PHE 124 8.948 13.741 1.874
327 HB3 PHE 124 HB3 PHE 124 8.639 14.619 3.368
328 HD1 PHE 124 HD1 PHE 124 11.144 15.686 4.302
329 HD2 PHE 124 HD2 PHE 124 9.721 15.256 0.242
330 HE1 PHE 124 HE1 PHE 124 12.530 17.608 3.614
331 HE2 PHE 124 HE2 PHE 124 11.120 17.198 -0.435
332 HZ PHE 124 HZ PHE 124 12.503 18.388 1.254
333 H PHE 125 H PHE 125 7.616 12.422 3.149
334 HA PHE 125 HA PHE 125 7.350 10.706 5.569
335 HB2 PHE 125 HB2 PHE 125 5.390 12.930 4.891
336 HB3 PHE 125 HB3 PHE 125 5.345 11.853 6.275
337 HD1 PHE 125 HD1 PHE 125 7.226 12.035 8.028
338 HD2 PHE 125 HD2 PHE 125 6.555 15.005 4.983
339 HE1 PHE 125 HE1 PHE 125 8.520 13.693 9.355
340 HE2 PHE 125 HE2 PHE 125 7.848 16.658 6.310
341 HZ PHE 125 HZ PHE 125 8.835 15.999 8.497
342 H TYR 126 H TYR 126 6.262 8.892 5.161
343 HA TYR 126 HA TYR 126 4.562 8.601 2.740
344 HB2 TYR 126 HB2 TYR 126 4.528 6.197 3.427
345 HB3 TYR 126 HB3 TYR 126 6.094 6.850 3.000
346 HD1 TYR 126 HD2 TYR 126 3.982 5.694 5.850
347 HD2 TYR 126 HD1 TYR 126 7.899 7.013 4.595
348 HE1 TYR 126 HE2 TYR 126 4.932 4.964 8.030
349 HE2 TYR 126 HE1 TYR 126 8.829 6.301 6.786
350 HH TYR 126 HH TYR 126 6.810 4.788 9.337
351 H THR 127 H THR 127 4.218 9.222 6.103
352 HA THR 127 HA THR 127 1.267 9.295 5.841
353 HB THR 127 HB THR 127 2.719 8.120 8.250
354 HG1 THR 127 HG1 THR 127 1.072 6.910 6.281
355 HG21 THR 127 HG21 THR 127 0.647 9.274 8.928
356 HG22 THR 127 HG22 THR 127 0.475 7.522 9.070
357 HG23 THR 127 HG23 THR 127 -0.274 8.371 7.699
358 HA PRO 128 HA PRO 128 2.474 13.326 7.291
359 HB2 PRO 128 HB2 PRO 128 0.057 14.462 7.951
360 HB3 PRO 128 HB3 PRO 128 0.609 14.173 6.276
361 HG2 PRO 128 HG2 PRO 128 -1.194 12.412 7.967
362 HG3 PRO 128 HG3 PRO 128 -1.457 12.973 6.284
363 HD2 PRO 128 HD2 PRO 128 -0.438 10.522 6.806
364 HD3 PRO 128 HD3 PRO 128 0.194 11.497 5.441
365 H LYS 129 H LYS 129 2.906 14.502 9.119
366 HA LYS 129 HA LYS 129 2.584 13.075 11.702
367 HB2 LYS 129 HB2 LYS 129 4.495 15.317 10.953
368 HB3 LYS 129 HB3 LYS 129 4.531 14.368 12.435
369 HG2 LYS 129 HG2 LYS 129 5.133 13.396 9.622
370 HG3 LYS 129 HG3 LYS 129 6.267 13.616 10.938
371 HD2 LYS 129 HD2 LYS 129 4.073 11.507 10.730
372 HD3 LYS 129 HD3 LYS 129 5.803 11.239 10.584
373 HE2 LYS 129 HE2 LYS 129 4.391 12.188 13.118
374 HE3 LYS 129 HE3 LYS 129 4.838 10.520 12.768
375 HZ1 LYS 129 HZ1 LYS 129 7.176 11.193 12.703
376 HZ2 LYS 129 HZ2 LYS 129 6.509 11.581 14.145
377 HZ3 LYS 129 HZ3 LYS 129 6.780 12.748 13.038
378 H THR 130 H THR 130 0.500 14.895 10.464
379 HA THR 130 HA THR 130 0.279 17.244 12.146
380 HB THR 130 HB THR 130 -2.033 17.356 11.134
381 HG1 THR 130 HG1 THR 130 -2.459 15.941 9.450
382 HG21 THR 130 HG21 THR 130 -1.238 17.953 8.900
383 HG22 THR 130 HG22 THR 130 0.271 17.046 9.151
384 HG23 THR 130 HG23 THR 130 -0.070 18.501 10.114
385 H ARG 131 H ARG 131 -1.523 17.728 13.528
386 HA ARG 131 HA ARG 131 -2.739 15.490 15.054
387 HB2 ARG 131 HB2 ARG 131 -0.548 16.122 16.094
388 HB3 ARG 131 HB3 ARG 131 -1.150 17.770 16.312
389 HG2 ARG 131 HG2 ARG 131 -2.974 16.917 17.764
390 HG3 ARG 131 HG3 ARG 131 -2.392 15.259 17.537
391 HD2 ARG 131 HD2 ARG 131 -0.790 17.541 18.771
392 HD3 ARG 131 HD3 ARG 131 -1.673 16.317 19.693
393 HE ARG 131 HE ARG 131 -0.039 14.798 18.099
394 HH11 ARG 131 HH21 ARG 131 0.631 17.338 20.415
395 HH12 ARG 131 HH22 ARG 131 2.218 16.716 20.780
396 HH21 ARG 131 HH11 ARG 131 1.979 14.049 18.615
397 HH22 ARG 131 HH12 ARG 131 2.944 14.885 19.799
Start of MODEL 14
1 H1 GLY 1 H1 GLY 1 14.245 23.617 10.216
2 H2 GLY 1 H2 GLY 1 13.337 22.415 10.881
3 H3 GLY 1 H3 GLY 1 12.683 23.897 10.623
4 HA2 GLY 1 HA2 GLY 1 11.872 22.437 8.929
5 HA3 GLY 1 HA3 GLY 1 12.964 23.642 8.221
6 H ILE 2 H ILE 2 14.672 22.927 7.087
7 HA ILE 2 HA ILE 2 15.996 20.402 7.565
8 HB ILE 2 HB ILE 2 14.150 19.443 6.371
9 HG12 ILE 2 HG12 ILE 2 16.635 19.577 4.611
10 HG13 ILE 2 HG13 ILE 2 16.388 18.541 6.011
11 HG21 ILE 2 HG21 ILE 2 14.712 21.132 3.917
12 HG22 ILE 2 HG22 ILE 2 13.403 19.974 4.189
13 HG23 ILE 2 HG23 ILE 2 13.408 21.497 5.075
14 HD11 ILE 2 HD11 ILE 2 16.055 17.232 4.033
15 HD12 ILE 2 HD12 ILE 2 14.443 17.481 4.744
16 HD13 ILE 2 HD13 ILE 2 14.959 18.422 3.324
17 H VAL 3 H VAL 3 15.520 23.046 5.175
18 HA VAL 3 HA VAL 3 18.064 22.696 3.909
19 HB VAL 3 HB VAL 3 16.326 25.198 4.011
20 HG11 VAL 3 HG11 VAL 3 17.394 25.721 1.828
21 HG12 VAL 3 HG12 VAL 3 18.563 25.710 3.145
22 HG13 VAL 3 HG13 VAL 3 18.474 24.326 2.028
23 HG21 VAL 3 HG21 VAL 3 16.325 22.845 2.063
24 HG22 VAL 3 HG22 VAL 3 15.002 23.340 3.138
25 HG23 VAL 3 HG23 VAL 3 15.466 24.380 1.799
26 H GLU 4 H GLU 4 17.027 24.914 6.494
27 HA GLU 4 HA GLU 4 19.433 26.372 6.813
28 HB2 GLU 4 HB2 GLU 4 18.088 25.786 9.367
29 HB3 GLU 4 HB3 GLU 4 18.449 27.310 8.579
30 HG2 GLU 4 HG2 GLU 4 16.102 27.212 8.871
31 HG3 GLU 4 HG3 GLU 4 16.392 26.968 7.149
32 H GLN 5 H GLN 5 18.782 23.086 7.671
33 HA GLN 5 HA GLN 5 20.804 22.892 9.796
34 HB2 GLN 5 HB2 GLN 5 19.139 20.710 8.493
35 HB3 GLN 5 HB3 GLN 5 19.975 20.636 10.035
36 HG2 GLN 5 HG2 GLN 5 17.529 22.329 9.341
37 HG3 GLN 5 HG3 GLN 5 17.579 20.917 10.371
38 HE21 GLN 5 HE21 GLN 5 16.966 24.013 10.750
39 HE22 GLN 5 HE22 GLN 5 17.837 24.331 12.255
40 H CYS 6 H CYS 6 20.613 22.247 6.392
41 HA CYS 6 HA CYS 6 23.333 20.981 6.408
42 HB2 CYS 6 HB2 CYS 6 20.739 20.120 5.188
43 HB3 CYS 6 HB3 CYS 6 22.197 19.873 4.238
44 H CYS 7 H CYS 7 21.573 23.626 5.061
45 HA CYS 7 HA CYS 7 23.187 23.779 2.608
46 HB2 CYS 7 HB2 CYS 7 20.792 24.219 2.590
47 HB3 CYS 7 HB3 CYS 7 20.997 25.515 3.772
48 H THR 8 H THR 8 22.940 25.625 5.666
49 HA THR 8 HA THR 8 25.356 27.217 4.915
50 HB THR 8 HB THR 8 24.815 28.499 7.013
51 HG1 THR 8 HG1 THR 8 22.699 28.270 7.791
52 HG21 THR 8 HG21 THR 8 24.177 29.324 4.763
53 HG22 THR 8 HG22 THR 8 23.003 29.801 5.995
54 HG23 THR 8 HG23 THR 8 22.625 28.464 4.881
55 H SER 9 H SER 9 24.082 25.543 7.822
56 HA SER 9 HA SER 9 26.666 24.749 8.839
57 HB2 SER 9 HB2 SER 9 23.874 23.641 9.329
58 HB3 SER 9 HB3 SER 9 25.323 23.156 10.231
59 HG SER 9 HG SER 9 24.127 24.832 11.281
60 H ILE 10 H ILE 10 27.619 22.653 8.851
61 HA ILE 10 HA ILE 10 27.633 21.426 6.265
62 HB ILE 10 HB ILE 10 29.323 19.921 7.172
63 HG12 ILE 10 HG12 ILE 10 28.904 21.302 9.863
64 HG13 ILE 10 HG13 ILE 10 28.390 19.659 9.475
65 HG21 ILE 10 HG21 ILE 10 31.006 21.683 7.565
66 HG22 ILE 10 HG22 ILE 10 29.873 22.176 6.304
67 HG23 ILE 10 HG23 ILE 10 29.736 22.845 7.943
68 HD11 ILE 10 HD11 ILE 10 31.263 20.655 9.579
69 HD12 ILE 10 HD12 ILE 10 30.458 19.547 10.703
70 HD13 ILE 10 HD13 ILE 10 30.763 19.034 9.038
71 H CYS 11 H CYS 11 27.406 19.190 5.717
72 HA CYS 11 HA CYS 11 25.025 17.968 7.040
73 HB2 CYS 11 HB2 CYS 11 24.776 19.354 4.878
74 HB3 CYS 11 HB3 CYS 11 25.562 18.002 4.073
75 H SER 12 H SER 12 24.668 15.776 6.868
76 HA SER 12 HA SER 12 26.807 13.908 5.997
77 HB2 SER 12 HB2 SER 12 27.428 14.514 8.292
78 HB3 SER 12 HB3 SER 12 25.772 14.184 8.851
79 HG SER 12 HG SER 12 27.330 12.445 9.171
80 H LEU 13 H LEU 13 26.106 11.730 5.912
81 HA LEU 13 HA LEU 13 23.389 11.183 5.198
82 HB2 LEU 13 HB2 LEU 13 24.058 8.802 5.449
83 HB3 LEU 13 HB3 LEU 13 25.036 9.730 4.343
84 HG LEU 13 HG LEU 13 26.140 9.660 7.124
85 HD11 LEU 13 HD11 LEU 13 26.985 7.349 6.927
86 HD12 LEU 13 HD12 LEU 13 26.021 7.115 5.451
87 HD13 LEU 13 HD13 LEU 13 25.220 7.372 7.014
88 HD21 LEU 13 HD21 LEU 13 28.227 9.223 5.943
89 HD22 LEU 13 HD22 LEU 13 27.386 10.570 5.166
90 HD23 LEU 13 HD23 LEU 13 27.358 8.960 4.421
91 H TYR 14 H TYR 14 25.042 11.133 8.338
92 HA TYR 14 HA TYR 14 22.968 9.837 9.853
93 HB2 TYR 14 HB2 TYR 14 25.310 10.105 10.572
94 HB3 TYR 14 HB3 TYR 14 25.113 11.854 10.622
95 HD1 TYR 14 HD2 TYR 14 23.849 8.663 12.155
96 HD2 TYR 14 HD1 TYR 14 24.343 12.932 12.592
97 HE1 TYR 14 HE2 TYR 14 23.105 8.516 14.526
98 HE2 TYR 14 HE1 TYR 14 23.604 12.776 14.959
99 HH TYR 14 HH TYR 14 22.909 11.396 16.649
100 H GLN 15 H GLN 15 23.309 13.135 8.673
101 HA GLN 15 HA GLN 15 21.117 14.225 10.353
102 HB2 GLN 15 HB2 GLN 15 22.840 15.421 8.153
103 HB3 GLN 15 HB3 GLN 15 21.549 16.283 8.962
104 HG2 GLN 15 HG2 GLN 15 22.676 16.281 11.061
105 HG3 GLN 15 HG3 GLN 15 23.843 15.057 10.536
106 HE21 GLN 15 HE21 GLN 15 22.802 18.458 9.684
107 HE22 GLN 15 HE22 GLN 15 24.431 18.915 9.197
108 H LEU 16 H LEU 16 21.797 13.414 6.931
109 HA LEU 16 HA LEU 16 19.312 14.181 5.825
110 HB2 LEU 16 HB2 LEU 16 21.373 12.115 5.031
111 HB3 LEU 16 HB3 LEU 16 20.012 12.527 4.000
112 HG LEU 16 HG LEU 16 22.025 14.616 4.957
113 HD11 LEU 16 HD11 LEU 16 23.220 12.932 3.657
114 HD12 LEU 16 HD12 LEU 16 23.037 14.402 2.707
115 HD13 LEU 16 HD13 LEU 16 21.984 12.995 2.381
116 HD21 LEU 16 HD21 LEU 16 20.029 14.592 2.656
117 HD22 LEU 16 HD22 LEU 16 21.197 15.874 3.027
118 HD23 LEU 16 HD23 LEU 16 19.875 15.538 4.152
119 H GLU 17 H GLU 17 20.258 11.022 7.245
120 HA GLU 17 HA GLU 17 17.894 9.644 6.512
121 HB2 GLU 17 HB2 GLU 17 20.190 8.796 7.465
122 HB3 GLU 17 HB3 GLU 17 19.421 9.009 9.042
123 HG2 GLU 17 HG2 GLU 17 17.541 7.510 8.177
124 HG3 GLU 17 HG3 GLU 17 18.486 7.295 6.702
125 H ASN 18 H ASN 18 18.396 11.950 9.123
126 HA ASN 18 HA ASN 18 16.127 11.138 10.731
127 HB2 ASN 18 HB2 ASN 18 18.155 12.445 11.521
128 HB3 ASN 18 HB3 ASN 18 17.554 13.835 10.610
129 HD21 ASN 18 HD21 ASN 18 17.231 15.170 12.422
130 HD22 ASN 18 HD22 ASN 18 16.015 14.801 13.638
131 H TYR 19 H TYR 19 16.520 13.333 7.952
132 HA TYR 19 HA TYR 19 13.965 14.653 8.254
133 HB2 TYR 19 HB2 TYR 19 15.589 14.393 5.716
134 HB3 TYR 19 HB3 TYR 19 14.445 15.657 6.140
135 HD1 TYR 19 HD1 TYR 19 15.336 16.375 8.937
136 HD2 TYR 19 HD2 TYR 19 17.590 15.558 5.348
137 HE1 TYR 19 HE1 TYR 19 17.245 17.671 9.842
138 HE2 TYR 19 HE2 TYR 19 19.513 16.871 6.270
139 HH TYR 19 HH TYR 19 19.400 18.359 9.521
140 H CYS 20 H CYS 20 14.855 11.559 6.983
141 HA CYS 20 HA CYS 20 12.761 11.195 5.096
142 HB2 CYS 20 HB2 CYS 20 14.326 9.137 6.678
143 HB3 CYS 20 HB3 CYS 20 13.409 8.842 5.194
144 H ASN 21 H ASN 21 12.451 11.409 8.490
145 HA ASN 21 HA ASN 21 10.019 9.763 8.607
146 HB2 ASN 21 HB2 ASN 21 11.764 9.951 10.469
147 HB3 ASN 21 HB3 ASN 21 11.122 11.568 10.767
148 HD21 ASN 21 HD21 ASN 21 10.251 11.080 12.835
149 HD22 ASN 21 HD22 ASN 21 8.945 9.916 13.031
150 H GLY 22 H GLY 22 10.659 12.817 7.415
151 HA2 GLY 22 HA2 GLY 22 9.305 14.514 6.653
152 HA3 GLY 22 HA3 GLY 22 7.900 13.510 7.018
153 H1 PHE 101 H1 PHE 101 29.640 15.236 2.552
154 H2 PHE 101 H2 PHE 101 28.689 16.027 3.631
155 H3 PHE 101 H3 PHE 101 28.216 14.569 3.049
156 HA PHE 101 HA PHE 101 29.064 14.479 5.340
157 HB2 PHE 101 HB2 PHE 101 29.121 12.497 3.799
158 HB3 PHE 101 HB3 PHE 101 30.754 12.948 3.317
159 HD1 PHE 101 HD2 PHE 101 28.857 12.507 6.580
160 HD2 PHE 101 HD1 PHE 101 32.409 11.592 4.302
161 HE1 PHE 101 HE2 PHE 101 29.728 11.185 8.473
162 HE2 PHE 101 HE1 PHE 101 33.285 10.275 6.212
163 HZ PHE 101 HZ PHE 101 31.950 10.075 8.305
164 H VAL 102 H VAL 102 30.927 14.619 6.763
165 HA VAL 102 HA VAL 102 32.465 15.982 7.728
166 HB VAL 102 HB VAL 102 34.167 16.047 5.253
167 HG11 VAL 102 HG11 VAL 102 34.788 15.518 8.196
168 HG12 VAL 102 HG12 VAL 102 35.965 15.769 6.889
169 HG13 VAL 102 HG13 VAL 102 34.949 17.106 7.430
170 HG21 VAL 102 HG21 VAL 102 33.465 13.736 5.227
171 HG22 VAL 102 HG22 VAL 102 35.080 13.812 5.904
172 HG23 VAL 102 HG23 VAL 102 33.685 13.589 6.988
173 H ASN 103 H ASN 103 34.088 18.006 5.966
174 HA ASN 103 HA ASN 103 32.312 20.209 6.582
175 HB2 ASN 103 HB2 ASN 103 34.791 20.079 7.052
176 HB3 ASN 103 HB3 ASN 103 35.082 20.307 5.332
177 HD21 ASN 103 HD21 ASN 103 34.074 22.361 4.380
178 HD22 ASN 103 HD22 ASN 103 34.083 23.785 5.427
179 H GLN 104 H GLN 104 30.704 19.308 4.992
180 HA GLN 104 HA GLN 104 30.828 20.781 2.395
181 HB2 GLN 104 HB2 GLN 104 29.883 17.926 2.865
182 HB3 GLN 104 HB3 GLN 104 29.600 18.834 1.378
183 HG2 GLN 104 HG2 GLN 104 32.006 18.941 0.921
184 HG3 GLN 104 HG3 GLN 104 32.368 18.108 2.434
185 HE21 GLN 104 HE21 GLN 104 33.358 17.007 0.111
186 HE22 GLN 104 HE22 GLN 104 32.455 15.538 -0.251
187 H HIS 105 H HIS 105 28.826 21.654 1.748
188 HA HIS 105 HA HIS 105 26.367 20.947 3.212
189 HB2 HIS 105 HB2 HIS 105 25.821 23.390 3.334
190 HB3 HIS 105 HB3 HIS 105 27.034 22.801 4.455
191 HD1 HIS 105 HD1 HIS 105 27.851 25.318 4.807
192 HD2 HIS 105 HD2 HIS 105 28.207 23.809 0.891
193 HE1 HIS 105 HE1 HIS 105 29.409 26.907 3.563
194 H LEU 106 H LEU 106 24.429 21.517 2.293
195 HA LEU 106 HA LEU 106 24.406 21.671 -0.657
196 HB2 LEU 106 HB2 LEU 106 24.968 19.331 0.245
197 HB3 LEU 106 HB3 LEU 106 23.389 19.325 1.017
198 HG LEU 106 HG LEU 106 22.319 19.497 -1.228
199 HD11 LEU 106 HD11 LEU 106 23.784 19.036 -3.233
200 HD12 LEU 106 HD12 LEU 106 25.204 19.324 -2.217
201 HD13 LEU 106 HD13 LEU 106 24.048 20.636 -2.545
202 HD21 LEU 106 HD21 LEU 106 22.892 17.215 -1.935
203 HD22 LEU 106 HD22 LEU 106 22.767 17.315 -0.171
204 HD23 LEU 106 HD23 LEU 106 24.368 17.259 -0.940
205 H CYS 107 H CYS 107 22.385 22.226 -1.536
206 HA CYS 107 HA CYS 107 20.294 23.106 0.422
207 HB2 CYS 107 HB2 CYS 107 21.372 24.602 -1.975
208 HB3 CYS 107 HB3 CYS 107 20.233 25.224 -0.788
209 H GLY 108 H GLY 108 18.220 23.637 -0.453
210 HA2 GLY 108 HA2 GLY 108 16.302 23.330 -1.677
211 HA3 GLY 108 HA3 GLY 108 17.357 23.571 -3.055
212 H SER 109 H SER 109 16.374 22.225 -4.485
213 HA SER 109 HA SER 109 15.285 19.683 -4.049
214 HB2 SER 109 HB2 SER 109 16.663 20.688 -6.577
215 HB3 SER 109 HB3 SER 109 15.457 19.388 -6.474
216 HG SER 109 HG SER 109 14.521 21.392 -7.105
217 H HIS 110 H HIS 110 18.726 20.498 -4.563
218 HA HIS 110 HA HIS 110 19.546 17.771 -5.040
219 HB2 HIS 110 HB2 HIS 110 20.681 20.032 -5.642
220 HB3 HIS 110 HB3 HIS 110 21.327 19.989 -3.997
221 HD1 HIS 110 HD1 HIS 110 21.924 16.737 -4.054
222 HD2 HIS 110 HD2 HIS 110 22.851 19.628 -6.958
223 HE1 HIS 110 HE1 HIS 110 23.900 15.796 -5.388
224 H LEU 111 H LEU 111 19.044 19.695 -2.100
225 HA LEU 111 HA LEU 111 20.269 17.759 -0.309
226 HB2 LEU 111 HB2 LEU 111 19.977 20.175 0.237
227 HB3 LEU 111 HB3 LEU 111 18.228 19.968 0.202
228 HG LEU 111 HG LEU 111 18.389 18.357 2.112
229 HD11 LEU 111 HD11 LEU 111 21.289 19.302 2.211
230 HD12 LEU 111 HD12 LEU 111 20.769 17.661 1.784
231 HD13 LEU 111 HD13 LEU 111 20.468 18.272 3.411
232 HD21 LEU 111 HD21 LEU 111 18.845 20.066 3.810
233 HD22 LEU 111 HD22 LEU 111 17.874 20.724 2.483
234 HD23 LEU 111 HD23 LEU 111 19.613 21.106 2.585
235 H VAL 112 H VAL 112 16.989 18.300 -1.609
236 HA VAL 112 HA VAL 112 15.737 16.099 -0.200
237 HB VAL 112 HB VAL 112 14.968 17.389 -2.841
238 HG11 VAL 112 HG11 VAL 112 13.915 15.184 -2.665
239 HG12 VAL 112 HG12 VAL 112 13.421 15.522 -0.995
240 HG13 VAL 112 HG13 VAL 112 12.712 16.431 -2.342
241 HG21 VAL 112 HG21 VAL 112 14.913 18.985 -0.954
242 HG22 VAL 112 HG22 VAL 112 13.278 18.572 -1.477
243 HG23 VAL 112 HG23 VAL 112 13.948 17.835 -0.003
244 H GLU 113 H GLU 113 17.344 16.286 -3.436
245 HA GLU 113 HA GLU 113 17.106 13.526 -4.046
246 HB2 GLU 113 HB2 GLU 113 17.876 15.318 -5.592
247 HB3 GLU 113 HB3 GLU 113 19.433 15.359 -4.748
248 HG2 GLU 113 HG2 GLU 113 19.866 13.027 -5.359
249 HG3 GLU 113 HG3 GLU 113 18.258 12.877 -6.078
250 H ALA 114 H ALA 114 19.597 15.161 -2.015
251 HA ALA 114 HA ALA 114 21.140 12.820 -1.552
252 HB1 ALA 114 HB1 ALA 114 22.163 14.102 0.240
253 HB2 ALA 114 HB2 ALA 114 21.942 15.107 -1.200
254 HB3 ALA 114 HB3 ALA 114 20.848 15.296 0.189
255 H LEU 115 H LEU 115 18.344 14.112 0.391
256 HA LEU 115 HA LEU 115 18.610 11.971 2.332
257 HB2 LEU 115 HB2 LEU 115 16.802 12.795 3.441
258 HB3 LEU 115 HB3 LEU 115 17.499 14.208 2.688
259 HG LEU 115 HG LEU 115 15.673 13.671 0.803
260 HD11 LEU 115 HD11 LEU 115 13.648 12.706 1.587
261 HD12 LEU 115 HD12 LEU 115 14.233 12.642 3.272
262 HD13 LEU 115 HD13 LEU 115 14.891 11.560 2.046
263 HD21 LEU 115 HD21 LEU 115 15.863 15.733 2.150
264 HD22 LEU 115 HD22 LEU 115 14.939 14.953 3.449
265 HD23 LEU 115 HD23 LEU 115 14.186 15.262 1.860
266 H TYR 116 H TYR 116 16.781 12.243 -0.711
267 HA TYR 116 HA TYR 116 15.480 9.676 -0.540
268 HB2 TYR 116 HB2 TYR 116 16.131 11.655 -2.705
269 HB3 TYR 116 HB3 TYR 116 15.794 10.011 -3.190
270 HD1 TYR 116 HD1 TYR 116 14.298 12.741 -1.048
271 HD2 TYR 116 HD2 TYR 116 13.621 9.276 -3.521
272 HE1 TYR 116 HE1 TYR 116 11.855 13.204 -1.005
273 HE2 TYR 116 HE2 TYR 116 11.167 9.732 -3.474
274 HH TYR 116 HH TYR 116 9.785 12.552 -1.731
275 H LEU 117 H LEU 117 18.771 10.592 -1.705
276 HA LEU 117 HA LEU 117 19.402 7.899 -2.503
277 HB2 LEU 117 HB2 LEU 117 20.828 10.497 -2.251
278 HB3 LEU 117 HB3 LEU 117 21.845 9.124 -1.916
279 HG LEU 117 HG LEU 117 21.971 9.862 -4.257
280 HD11 LEU 117 HD11 LEU 117 21.859 7.677 -5.294
281 HD12 LEU 117 HD12 LEU 117 20.791 7.067 -4.017
282 HD13 LEU 117 HD13 LEU 117 22.470 7.507 -3.644
283 HD21 LEU 117 HD21 LEU 117 20.196 9.419 -5.857
284 HD22 LEU 117 HD22 LEU 117 19.639 10.563 -4.627
285 HD23 LEU 117 HD23 LEU 117 19.108 8.870 -4.561
286 H VAL 118 H VAL 118 19.800 9.591 0.617
287 HA VAL 118 HA VAL 118 21.182 7.396 1.908
288 HB VAL 118 HB VAL 118 19.700 9.810 2.987
289 HG11 VAL 118 HG11 VAL 118 20.799 9.356 5.161
290 HG12 VAL 118 HG12 VAL 118 19.576 8.148 4.771
291 HG13 VAL 118 HG13 VAL 118 21.300 7.754 4.572
292 HG21 VAL 118 HG21 VAL 118 21.865 10.173 1.769
293 HG22 VAL 118 HG22 VAL 118 21.994 10.569 3.478
294 HG23 VAL 118 HG23 VAL 118 22.662 9.043 2.877
295 H CYS 119 H CYS 119 17.713 8.180 1.628
296 HA CYS 119 HA CYS 119 17.029 5.807 3.278
297 HB2 CYS 119 HB2 CYS 119 15.467 8.255 2.435
298 HB3 CYS 119 HB3 CYS 119 14.843 6.957 3.473
299 H GLY 120 H GLY 120 17.222 6.354 -0.045
300 HA2 GLY 120 HA2 GLY 120 16.581 5.065 -1.822
301 HA3 GLY 120 HA3 GLY 120 16.012 3.836 -0.689
302 H GLU 121 H GLU 121 14.082 3.309 -1.539
303 HA GLU 121 HA GLU 121 12.303 4.998 -2.942
304 HB2 GLU 121 HB2 GLU 121 11.768 2.368 -1.505
305 HB3 GLU 121 HB3 GLU 121 10.700 3.088 -2.707
306 HG2 GLU 121 HG2 GLU 121 13.544 2.121 -3.231
307 HG3 GLU 121 HG3 GLU 121 12.071 1.256 -3.625
308 H ARG 122 H ARG 122 12.679 4.825 0.478
309 HA ARG 122 HA ARG 122 10.003 5.455 1.343
310 HB2 ARG 122 HB2 ARG 122 11.749 4.567 2.842
311 HB3 ARG 122 HB3 ARG 122 12.719 6.033 2.610
312 HG2 ARG 122 HG2 ARG 122 10.985 7.397 3.704
313 HG3 ARG 122 HG3 ARG 122 9.943 5.973 3.857
314 HD2 ARG 122 HD2 ARG 122 11.550 4.917 5.359
315 HD3 ARG 122 HD3 ARG 122 12.691 6.261 5.138
316 HE ARG 122 HE ARG 122 10.702 7.704 6.051
317 HH11 ARG 122 HH11 ARG 122 11.724 4.617 7.445
318 HH12 ARG 122 HH12 ARG 122 10.941 5.021 8.962
319 HH21 ARG 122 HH21 ARG 122 9.586 7.934 7.895
320 HH22 ARG 122 HH22 ARG 122 9.870 6.833 9.235
321 H GLY 123 H GLY 123 12.684 7.567 0.262
322 HA2 GLY 123 HA2 GLY 123 12.820 9.898 0.085
323 HA3 GLY 123 HA3 GLY 123 11.062 9.892 -0.149
324 H PHE 124 H PHE 124 10.114 11.238 1.326
325 HA PHE 124 HA PHE 124 10.755 10.724 4.164
326 HB2 PHE 124 HB2 PHE 124 10.126 13.019 4.781
327 HB3 PHE 124 HB3 PHE 124 11.658 12.838 3.963
328 HD1 PHE 124 HD1 PHE 124 8.087 13.813 3.294
329 HD2 PHE 124 HD2 PHE 124 12.221 14.213 2.209
330 HE1 PHE 124 HE1 PHE 124 7.496 15.610 1.659
331 HE2 PHE 124 HE2 PHE 124 11.664 15.980 0.586
332 HZ PHE 124 HZ PHE 124 9.276 16.691 0.299
333 H PHE 125 H PHE 125 9.230 10.107 5.384
334 HA PHE 125 HA PHE 125 6.370 10.503 5.055
335 HB2 PHE 125 HB2 PHE 125 6.755 8.888 3.238
336 HB3 PHE 125 HB3 PHE 125 7.754 7.891 4.283
337 HD1 PHE 125 HD2 PHE 125 4.245 9.200 3.925
338 HD2 PHE 125 HD1 PHE 125 6.819 6.099 5.445
339 HE1 PHE 125 HE2 PHE 125 2.246 7.833 4.512
340 HE2 PHE 125 HE1 PHE 125 4.825 4.713 5.998
341 HZ PHE 125 HZ PHE 125 2.542 5.587 5.536
342 H TYR 126 H TYR 126 5.304 9.783 7.046
343 HA TYR 126 HA TYR 126 7.147 9.457 9.271
344 HB2 TYR 126 HB2 TYR 126 5.090 10.842 9.385
345 HB3 TYR 126 HB3 TYR 126 4.116 9.378 9.291
346 HD1 TYR 126 HD2 TYR 126 6.551 11.298 11.344
347 HD2 TYR 126 HD1 TYR 126 3.877 7.914 11.239
348 HE1 TYR 126 HE2 TYR 126 6.808 11.015 13.808
349 HE2 TYR 126 HE1 TYR 126 4.155 7.616 13.694
350 HH TYR 126 HH TYR 126 6.253 9.777 15.650
351 H THR 127 H THR 127 7.740 7.680 10.399
352 HA THR 127 HA THR 127 7.509 5.098 9.316
353 HB THR 127 HB THR 127 8.161 5.874 12.176
354 HG1 THR 127 HG1 THR 127 10.230 5.835 11.460
355 HG21 THR 127 HG21 THR 127 8.752 3.309 10.611
356 HG22 THR 127 HG22 THR 127 7.735 3.441 12.063
357 HG23 THR 127 HG23 THR 127 9.467 3.738 12.183
358 HA PRO 128 HA PRO 128 3.375 3.993 10.806
359 HB2 PRO 128 HB2 PRO 128 4.213 1.233 9.926
360 HB3 PRO 128 HB3 PRO 128 2.688 2.109 9.591
361 HG2 PRO 128 HG2 PRO 128 4.595 1.934 7.678
362 HG3 PRO 128 HG3 PRO 128 3.761 3.501 7.963
363 HD2 PRO 128 HD2 PRO 128 6.466 2.601 9.009
364 HD3 PRO 128 HD3 PRO 128 6.021 4.133 8.198
365 H LYS 129 H LYS 129 2.466 2.988 12.581
366 HA LYS 129 HA LYS 129 2.398 2.284 14.769
367 HB2 LYS 129 HB2 LYS 129 2.546 -0.131 14.913
368 HB3 LYS 129 HB3 LYS 129 1.731 0.409 13.454
369 HG2 LYS 129 HG2 LYS 129 3.687 -0.125 12.085
370 HG3 LYS 129 HG3 LYS 129 4.627 -0.535 13.532
371 HD2 LYS 129 HD2 LYS 129 3.054 -2.398 14.021
372 HD3 LYS 129 HD3 LYS 129 2.083 -1.943 12.619
373 HE2 LYS 129 HE2 LYS 129 3.415 -3.804 11.957
374 HE3 LYS 129 HE3 LYS 129 4.034 -2.375 11.125
375 HZ1 LYS 129 HZ1 LYS 129 5.834 -2.275 12.762
376 HZ2 LYS 129 HZ2 LYS 129 5.827 -3.736 12.046
377 HZ3 LYS 129 HZ3 LYS 129 5.241 -3.580 13.557
378 H THR 130 H THR 130 4.486 3.906 14.847
379 HA THR 130 HA THR 130 6.878 2.846 16.015
380 HB THR 130 HB THR 130 7.069 5.219 16.968
381 HG1 THR 130 HG1 THR 130 5.652 6.711 16.037
382 HG21 THR 130 HG21 THR 130 7.527 6.210 14.742
383 HG22 THR 130 HG22 THR 130 6.685 4.847 13.971
384 HG23 THR 130 HG23 THR 130 8.176 4.563 14.886
385 H ARG 131 H ARG 131 7.619 2.887 18.133
386 HA ARG 131 HA ARG 131 5.686 2.985 20.380
387 HB2 ARG 131 HB2 ARG 131 5.758 0.638 19.537
388 HB3 ARG 131 HB3 ARG 131 7.508 0.608 19.794
389 HG2 ARG 131 HG2 ARG 131 7.152 0.965 22.234
390 HG3 ARG 131 HG3 ARG 131 5.400 1.050 21.965
391 HD2 ARG 131 HD2 ARG 131 5.416 -1.272 21.108
392 HD3 ARG 131 HD3 ARG 131 7.171 -1.345 21.344
393 HE ARG 131 HE ARG 131 5.930 -0.621 23.809
394 HH11 ARG 131 HH11 ARG 131 6.250 -3.474 21.783
395 HH12 ARG 131 HH12 ARG 131 6.058 -4.552 23.142
396 HH21 ARG 131 HH21 ARG 131 5.672 -2.056 25.466
397 HH22 ARG 131 HH22 ARG 131 5.736 -3.768 25.158
Start of MODEL 15
1 H1 GLY 1 H1 GLY 1 15.830 25.189 11.936
2 H2 GLY 1 H2 GLY 1 16.730 25.463 10.604
3 H3 GLY 1 H3 GLY 1 17.164 24.275 11.657
4 HA2 GLY 1 HA2 GLY 1 15.079 23.084 11.166
5 HA3 GLY 1 HA3 GLY 1 14.778 24.305 9.918
6 H ILE 2 H ILE 2 14.714 21.927 8.957
7 HA ILE 2 HA ILE 2 17.015 20.399 8.516
8 HB ILE 2 HB ILE 2 14.417 20.651 6.952
9 HG12 ILE 2 HG12 ILE 2 15.465 18.604 8.963
10 HG13 ILE 2 HG13 ILE 2 14.274 19.856 9.297
11 HG21 ILE 2 HG21 ILE 2 14.974 18.470 5.870
12 HG22 ILE 2 HG22 ILE 2 16.050 19.755 5.362
13 HG23 ILE 2 HG23 ILE 2 16.610 18.580 6.561
14 HD11 ILE 2 HD11 ILE 2 12.733 18.787 7.621
15 HD12 ILE 2 HD12 ILE 2 13.885 17.431 7.511
16 HD13 ILE 2 HD13 ILE 2 13.098 17.795 9.052
17 H VAL 3 H VAL 3 15.669 22.879 6.288
18 HA VAL 3 HA VAL 3 17.637 22.489 4.265
19 HB VAL 3 HB VAL 3 16.067 25.028 4.835
20 HG11 VAL 3 HG11 VAL 3 17.935 25.468 3.291
21 HG12 VAL 3 HG12 VAL 3 17.478 24.054 2.308
22 HG13 VAL 3 HG13 VAL 3 16.408 25.465 2.403
23 HG21 VAL 3 HG21 VAL 3 15.436 22.657 3.010
24 HG22 VAL 3 HG22 VAL 3 14.552 23.117 4.485
25 HG23 VAL 3 HG23 VAL 3 14.527 24.185 3.080
26 H GLU 4 H GLU 4 17.606 24.782 7.007
27 HA GLU 4 HA GLU 4 20.009 26.168 6.337
28 HB2 GLU 4 HB2 GLU 4 18.776 25.615 9.060
29 HB3 GLU 4 HB3 GLU 4 20.008 26.836 8.731
30 HG2 GLU 4 HG2 GLU 4 18.472 28.080 7.298
31 HG3 GLU 4 HG3 GLU 4 17.235 26.833 7.453
32 H GLN 5 H GLN 5 19.504 23.205 8.258
33 HA GLN 5 HA GLN 5 22.082 22.999 9.371
34 HB2 GLN 5 HB2 GLN 5 20.064 21.737 10.079
35 HB3 GLN 5 HB3 GLN 5 20.156 20.768 8.607
36 HG2 GLN 5 HG2 GLN 5 21.052 19.547 10.530
37 HG3 GLN 5 HG3 GLN 5 22.312 19.803 9.330
38 HE21 GLN 5 HE21 GLN 5 24.187 21.072 9.950
39 HE22 GLN 5 HE22 GLN 5 24.361 21.662 11.596
40 H CYS 6 H CYS 6 20.984 21.951 6.154
41 HA CYS 6 HA CYS 6 23.769 21.032 5.530
42 HB2 CYS 6 HB2 CYS 6 21.179 20.727 3.999
43 HB3 CYS 6 HB3 CYS 6 22.740 20.189 3.421
44 H CYS 7 H CYS 7 21.541 23.716 4.736
45 HA CYS 7 HA CYS 7 23.131 24.357 2.367
46 HB2 CYS 7 HB2 CYS 7 20.671 24.323 2.374
47 HB3 CYS 7 HB3 CYS 7 20.661 25.683 3.484
48 H THR 8 H THR 8 22.803 25.792 5.607
49 HA THR 8 HA THR 8 24.911 27.777 4.802
50 HB THR 8 HB THR 8 22.896 28.940 5.396
51 HG1 THR 8 HG1 THR 8 23.893 30.320 6.832
52 HG21 THR 8 HG21 THR 8 21.838 27.493 7.037
53 HG22 THR 8 HG22 THR 8 22.125 29.082 7.736
54 HG23 THR 8 HG23 THR 8 23.189 27.734 8.177
55 H SER 9 H SER 9 23.922 25.394 7.229
56 HA SER 9 HA SER 9 26.708 25.327 8.338
57 HB2 SER 9 HB2 SER 9 24.131 23.973 9.206
58 HB3 SER 9 HB3 SER 9 25.720 23.671 9.931
59 HG SER 9 HG SER 9 24.395 26.192 9.800
60 H ILE 10 H ILE 10 27.565 23.020 8.634
61 HA ILE 10 HA ILE 10 27.077 21.383 6.197
62 HB ILE 10 HB ILE 10 28.956 19.958 7.111
63 HG12 ILE 10 HG12 ILE 10 30.718 21.026 8.389
64 HG13 ILE 10 HG13 ILE 10 29.752 22.466 8.652
65 HG21 ILE 10 HG21 ILE 10 30.629 21.319 6.007
66 HG22 ILE 10 HG22 ILE 10 29.102 21.405 5.133
67 HG23 ILE 10 HG23 ILE 10 29.598 22.765 6.154
68 HD11 ILE 10 HD11 ILE 10 28.985 19.709 9.712
69 HD12 ILE 10 HD12 ILE 10 29.939 20.902 10.616
70 HD13 ILE 10 HD13 ILE 10 28.274 21.282 10.162
71 H CYS 11 H CYS 11 26.547 19.190 6.309
72 HA CYS 11 HA CYS 11 25.295 18.267 8.845
73 HB2 CYS 11 HB2 CYS 11 23.296 17.637 7.708
74 HB3 CYS 11 HB3 CYS 11 23.626 19.310 7.380
75 H SER 12 H SER 12 24.324 15.869 8.010
76 HA SER 12 HA SER 12 26.732 14.253 7.257
77 HB2 SER 12 HB2 SER 12 26.680 14.371 9.673
78 HB3 SER 12 HB3 SER 12 24.952 14.003 9.713
79 HG SER 12 HG SER 12 26.427 12.206 10.142
80 H LEU 13 H LEU 13 26.241 12.088 6.545
81 HA LEU 13 HA LEU 13 23.791 11.691 5.030
82 HB2 LEU 13 HB2 LEU 13 25.782 9.617 6.016
83 HB3 LEU 13 HB3 LEU 13 24.572 9.417 4.759
84 HG LEU 13 HG LEU 13 27.068 11.153 4.647
85 HD11 LEU 13 HD11 LEU 13 27.742 9.643 2.873
86 HD12 LEU 13 HD12 LEU 13 26.187 8.776 2.960
87 HD13 LEU 13 HD13 LEU 13 27.336 8.698 4.312
88 HD21 LEU 13 HD21 LEU 13 26.468 11.655 2.304
89 HD22 LEU 13 HD22 LEU 13 25.303 12.354 3.433
90 HD23 LEU 13 HD23 LEU 13 24.893 10.876 2.536
91 H TYR 14 H TYR 14 24.777 10.871 8.380
92 HA TYR 14 HA TYR 14 22.462 9.273 9.008
93 HB2 TYR 14 HB2 TYR 14 24.502 9.296 10.368
94 HB3 TYR 14 HB3 TYR 14 24.269 11.000 10.745
95 HD1 TYR 14 HD1 TYR 14 22.763 7.603 11.192
96 HD2 TYR 14 HD2 TYR 14 22.907 11.681 12.590
97 HE1 TYR 14 HE1 TYR 14 21.397 6.968 13.175
98 HE2 TYR 14 HE2 TYR 14 21.550 11.040 14.581
99 HH TYR 14 HH TYR 14 20.394 7.689 15.114
100 H GLN 15 H GLN 15 22.975 12.790 8.934
101 HA GLN 15 HA GLN 15 20.409 13.411 10.233
102 HB2 GLN 15 HB2 GLN 15 22.445 15.129 8.780
103 HB3 GLN 15 HB3 GLN 15 20.950 15.743 9.490
104 HG2 GLN 15 HG2 GLN 15 21.594 15.013 11.717
105 HG3 GLN 15 HG3 GLN 15 23.064 14.251 11.108
106 HE21 GLN 15 HE21 GLN 15 23.252 16.149 13.159
107 HE22 GLN 15 HE22 GLN 15 24.009 17.589 12.486
108 H LEU 16 H LEU 16 21.674 13.346 6.869
109 HA LEU 16 HA LEU 16 19.232 14.066 5.565
110 HB2 LEU 16 HB2 LEU 16 21.675 12.463 4.764
111 HB3 LEU 16 HB3 LEU 16 20.381 12.792 3.632
112 HG LEU 16 HG LEU 16 21.762 15.071 5.108
113 HD11 LEU 16 HD11 LEU 16 23.201 15.332 3.103
114 HD12 LEU 16 HD12 LEU 16 22.609 13.767 2.495
115 HD13 LEU 16 HD13 LEU 16 23.536 13.855 4.011
116 HD21 LEU 16 HD21 LEU 16 19.640 15.587 3.910
117 HD22 LEU 16 HD22 LEU 16 20.334 14.918 2.421
118 HD23 LEU 16 HD23 LEU 16 21.025 16.379 3.158
119 H GLU 17 H GLU 17 20.388 10.878 6.740
120 HA GLU 17 HA GLU 17 18.099 9.406 5.831
121 HB2 GLU 17 HB2 GLU 17 20.380 8.557 6.763
122 HB3 GLU 17 HB3 GLU 17 19.669 8.780 8.360
123 HG2 GLU 17 HG2 GLU 17 17.764 7.282 7.652
124 HG3 GLU 17 HG3 GLU 17 18.582 7.035 6.104
125 H ASN 18 H ASN 18 18.683 11.223 8.884
126 HA ASN 18 HA ASN 18 16.188 10.412 10.094
127 HB2 ASN 18 HB2 ASN 18 18.369 12.401 10.752
128 HB3 ASN 18 HB3 ASN 18 16.819 12.543 11.568
129 HD21 ASN 18 HD21 ASN 18 19.566 10.300 11.065
130 HD22 ASN 18 HD22 ASN 18 19.198 9.353 12.503
131 H TYR 19 H TYR 19 16.843 13.005 7.786
132 HA TYR 19 HA TYR 19 14.347 14.406 8.250
133 HB2 TYR 19 HB2 TYR 19 15.893 14.181 5.663
134 HB3 TYR 19 HB3 TYR 19 14.746 15.439 6.096
135 HD1 TYR 19 HD1 TYR 19 15.976 15.777 9.049
136 HD2 TYR 19 HD2 TYR 19 17.575 15.781 5.040
137 HE1 TYR 19 HE1 TYR 19 17.901 17.130 9.815
138 HE2 TYR 19 HE2 TYR 19 19.516 17.144 5.826
139 HH TYR 19 HH TYR 19 19.850 18.164 9.233
140 H CYS 20 H CYS 20 14.980 11.315 6.831
141 HA CYS 20 HA CYS 20 12.720 11.142 5.067
142 HB2 CYS 20 HB2 CYS 20 14.832 9.742 5.121
143 HB3 CYS 20 HB3 CYS 20 14.159 8.907 6.519
144 H ASN 21 H ASN 21 10.674 10.252 5.382
145 HA ASN 21 HA ASN 21 9.624 10.379 8.154
146 HB2 ASN 21 HB2 ASN 21 8.777 11.927 6.443
147 HB3 ASN 21 HB3 ASN 21 8.282 10.561 5.432
148 HD21 ASN 21 HD21 ASN 21 6.368 12.106 5.670
149 HD22 ASN 21 HD22 ASN 21 5.219 11.679 6.946
150 H GLY 22 H GLY 22 10.719 8.245 8.454
151 HA2 GLY 22 HA2 GLY 22 9.815 5.803 7.217
152 HA3 GLY 22 HA3 GLY 22 10.717 5.943 8.720
153 H1 PHE 101 H1 PHE 101 32.586 8.036 4.790
154 H2 PHE 101 H2 PHE 101 32.329 8.707 6.266
155 H3 PHE 101 H3 PHE 101 33.801 8.811 5.562
156 HA PHE 101 HA PHE 101 32.957 10.181 3.803
157 HB2 PHE 101 HB2 PHE 101 30.689 11.004 3.796
158 HB3 PHE 101 HB3 PHE 101 30.670 9.264 3.783
159 HD1 PHE 101 HD1 PHE 101 29.917 12.288 5.783
160 HD2 PHE 101 HD2 PHE 101 29.748 7.976 5.677
161 HE1 PHE 101 HE1 PHE 101 28.406 12.298 7.745
162 HE2 PHE 101 HE2 PHE 101 28.219 7.998 7.630
163 HZ PHE 101 HZ PHE 101 27.540 10.160 8.663
164 H VAL 102 H VAL 102 32.423 12.584 4.084
165 HA VAL 102 HA VAL 102 33.237 13.596 6.779
166 HB VAL 102 HB VAL 102 34.360 15.481 5.698
167 HG11 VAL 102 HG11 VAL 102 36.391 14.319 5.037
168 HG12 VAL 102 HG12 VAL 102 35.648 13.513 6.425
169 HG13 VAL 102 HG13 VAL 102 35.490 12.807 4.804
170 HG21 VAL 102 HG21 VAL 102 34.981 15.431 3.336
171 HG22 VAL 102 HG22 VAL 102 34.018 13.961 3.074
172 HG23 VAL 102 HG23 VAL 102 33.223 15.492 3.496
173 H ASN 103 H ASN 103 32.442 15.732 7.350
174 HA ASN 103 HA ASN 103 29.646 16.016 6.700
175 HB2 ASN 103 HB2 ASN 103 31.552 17.789 8.291
176 HB3 ASN 103 HB3 ASN 103 29.821 18.082 8.121
177 HD21 ASN 103 HD21 ASN 103 28.372 16.162 8.704
178 HD22 ASN 103 HD22 ASN 103 28.865 15.280 10.157
179 H GLN 104 H GLN 104 28.584 17.455 5.470
180 HA GLN 104 HA GLN 104 30.060 19.250 3.630
181 HB2 GLN 104 HB2 GLN 104 29.343 18.004 1.648
182 HB3 GLN 104 HB3 GLN 104 30.378 17.041 2.691
183 HG2 GLN 104 HG2 GLN 104 28.178 16.013 3.655
184 HG3 GLN 104 HG3 GLN 104 27.369 16.780 2.287
185 HE21 GLN 104 HE21 GLN 104 29.988 14.453 3.186
186 HE22 GLN 104 HE22 GLN 104 29.874 13.554 1.675
187 H HIS 105 H HIS 105 28.554 20.192 1.965
188 HA HIS 105 HA HIS 105 26.001 20.969 3.292
189 HB2 HIS 105 HB2 HIS 105 26.534 23.273 2.347
190 HB3 HIS 105 HB3 HIS 105 27.475 22.711 3.721
191 HD1 HIS 105 HD1 HIS 105 28.088 22.246 -0.105
192 HD2 HIS 105 HD2 HIS 105 29.948 23.408 3.479
193 HE1 HIS 105 HE1 HIS 105 30.514 22.811 -0.704
194 H LEU 106 H LEU 106 24.237 21.356 2.126
195 HA LEU 106 HA LEU 106 24.127 21.159 -0.805
196 HB2 LEU 106 HB2 LEU 106 22.757 19.163 1.065
197 HB3 LEU 106 HB3 LEU 106 22.355 19.355 -0.639
198 HG LEU 106 HG LEU 106 25.054 18.392 0.417
199 HD11 LEU 106 HD11 LEU 106 24.324 16.215 -0.467
200 HD12 LEU 106 HD12 LEU 106 22.757 16.928 -0.914
201 HD13 LEU 106 HD13 LEU 106 23.221 16.794 0.793
202 HD21 LEU 106 HD21 LEU 106 25.434 17.747 -1.971
203 HD22 LEU 106 HD22 LEU 106 25.314 19.498 -1.770
204 HD23 LEU 106 HD23 LEU 106 23.939 18.600 -2.419
205 H CYS 107 H CYS 107 22.219 22.017 -1.656
206 HA CYS 107 HA CYS 107 20.291 23.295 0.247
207 HB2 CYS 107 HB2 CYS 107 21.633 24.474 -2.206
208 HB3 CYS 107 HB3 CYS 107 20.311 25.238 -1.337
209 H GLY 108 H GLY 108 18.191 23.638 -0.517
210 HA2 GLY 108 HA2 GLY 108 16.248 23.201 -1.674
211 HA3 GLY 108 HA3 GLY 108 17.222 23.621 -3.071
212 H SER 109 H SER 109 16.669 22.238 -4.635
213 HA SER 109 HA SER 109 15.583 19.688 -4.404
214 HB2 SER 109 HB2 SER 109 17.276 20.738 -6.706
215 HB3 SER 109 HB3 SER 109 16.083 19.426 -6.775
216 HG SER 109 HG SER 109 15.161 21.381 -7.491
217 H HIS 110 H HIS 110 19.083 20.501 -4.420
218 HA HIS 110 HA HIS 110 19.914 17.759 -4.833
219 HB2 HIS 110 HB2 HIS 110 21.139 19.986 -5.335
220 HB3 HIS 110 HB3 HIS 110 21.617 19.956 -3.636
221 HD1 HIS 110 HD1 HIS 110 22.127 16.663 -3.646
222 HD2 HIS 110 HD2 HIS 110 23.445 19.568 -6.388
223 HE1 HIS 110 HE1 HIS 110 24.212 15.682 -4.770
224 H LEU 111 H LEU 111 19.208 19.740 -1.988
225 HA LEU 111 HA LEU 111 20.191 17.866 0.019
226 HB2 LEU 111 HB2 LEU 111 19.685 20.376 0.233
227 HB3 LEU 111 HB3 LEU 111 17.983 19.945 0.296
228 HG LEU 111 HG LEU 111 20.149 19.146 2.290
229 HD11 LEU 111 HD11 LEU 111 19.504 21.527 2.332
230 HD12 LEU 111 HD12 LEU 111 18.914 20.692 3.781
231 HD13 LEU 111 HD13 LEU 111 17.789 21.066 2.452
232 HD21 LEU 111 HD21 LEU 111 17.150 18.581 2.343
233 HD22 LEU 111 HD22 LEU 111 18.218 18.476 3.763
234 HD23 LEU 111 HD23 LEU 111 18.476 17.396 2.408
235 H VAL 112 H VAL 112 17.003 18.509 -1.507
236 HA VAL 112 HA VAL 112 15.566 16.360 -0.266
237 HB VAL 112 HB VAL 112 15.109 17.703 -2.951
238 HG11 VAL 112 HG11 VAL 112 13.936 15.570 -2.978
239 HG12 VAL 112 HG12 VAL 112 13.306 15.844 -1.345
240 HG13 VAL 112 HG13 VAL 112 12.761 16.856 -2.703
241 HG21 VAL 112 HG21 VAL 112 14.937 19.259 -1.045
242 HG22 VAL 112 HG22 VAL 112 13.332 18.918 -1.689
243 HG23 VAL 112 HG23 VAL 112 13.879 18.129 -0.187
244 H GLU 113 H GLU 113 17.372 16.384 -3.419
245 HA GLU 113 HA GLU 113 16.932 13.648 -4.023
246 HB2 GLU 113 HB2 GLU 113 17.943 15.288 -5.585
247 HB3 GLU 113 HB3 GLU 113 19.418 15.325 -4.608
248 HG2 GLU 113 HG2 GLU 113 19.794 12.920 -5.057
249 HG3 GLU 113 HG3 GLU 113 18.267 12.833 -5.943
250 H ALA 114 H ALA 114 19.561 15.104 -2.000
251 HA ALA 114 HA ALA 114 20.841 12.609 -1.489
252 HB1 ALA 114 HB1 ALA 114 20.912 15.242 0.033
253 HB2 ALA 114 HB2 ALA 114 22.062 13.897 0.219
254 HB3 ALA 114 HB3 ALA 114 21.966 14.755 -1.320
255 H LEU 115 H LEU 115 18.270 14.324 0.404
256 HA LEU 115 HA LEU 115 18.439 12.432 2.576
257 HB2 LEU 115 HB2 LEU 115 16.785 13.577 3.620
258 HB3 LEU 115 HB3 LEU 115 17.573 14.794 2.655
259 HG LEU 115 HG LEU 115 15.586 14.271 0.953
260 HD11 LEU 115 HD11 LEU 115 14.224 13.598 3.593
261 HD12 LEU 115 HD12 LEU 115 14.677 12.358 2.423
262 HD13 LEU 115 HD13 LEU 115 13.527 13.598 1.955
263 HD21 LEU 115 HD21 LEU 115 16.019 16.415 2.092
264 HD22 LEU 115 HD22 LEU 115 15.170 15.825 3.532
265 HD23 LEU 115 HD23 LEU 115 14.291 16.058 2.004
266 H TYR 116 H TYR 116 16.506 12.527 -0.402
267 HA TYR 116 HA TYR 116 15.052 10.099 0.184
268 HB2 TYR 116 HB2 TYR 116 15.530 11.817 -2.230
269 HB3 TYR 116 HB3 TYR 116 15.008 10.171 -2.500
270 HD1 TYR 116 HD1 TYR 116 13.995 13.321 -0.711
271 HD2 TYR 116 HD2 TYR 116 12.758 9.511 -2.307
272 HE1 TYR 116 HE1 TYR 116 11.607 13.963 -0.383
273 HE2 TYR 116 HE2 TYR 116 10.377 10.138 -1.963
274 HH TYR 116 HH TYR 116 8.922 11.752 -1.263
275 H LEU 117 H LEU 117 18.107 10.728 -1.584
276 HA LEU 117 HA LEU 117 18.547 8.070 -2.422
277 HB2 LEU 117 HB2 LEU 117 19.580 10.086 -3.343
278 HB3 LEU 117 HB3 LEU 117 20.509 10.334 -1.872
279 HG LEU 117 HG LEU 117 21.727 9.496 -3.879
280 HD11 LEU 117 HD11 LEU 117 22.626 9.216 -1.564
281 HD12 LEU 117 HD12 LEU 117 23.212 8.035 -2.743
282 HD13 LEU 117 HD13 LEU 117 21.984 7.555 -1.566
283 HD21 LEU 117 HD21 LEU 117 21.639 7.171 -4.527
284 HD22 LEU 117 HD22 LEU 117 20.032 7.899 -4.710
285 HD23 LEU 117 HD23 LEU 117 20.379 6.826 -3.327
286 H VAL 118 H VAL 118 19.726 9.692 0.595
287 HA VAL 118 HA VAL 118 21.139 7.331 1.517
288 HB VAL 118 HB VAL 118 20.164 9.713 3.143
289 HG11 VAL 118 HG11 VAL 118 22.158 7.468 3.737
290 HG12 VAL 118 HG12 VAL 118 21.983 8.934 4.707
291 HG13 VAL 118 HG13 VAL 118 20.640 7.800 4.603
292 HG21 VAL 118 HG21 VAL 118 22.933 9.070 1.992
293 HG22 VAL 118 HG22 VAL 118 21.842 10.296 1.342
294 HG23 VAL 118 HG23 VAL 118 22.488 10.490 2.972
295 H CYS 119 H CYS 119 17.773 8.396 1.840
296 HA CYS 119 HA CYS 119 17.088 6.075 3.518
297 HB2 CYS 119 HB2 CYS 119 16.135 8.436 3.705
298 HB3 CYS 119 HB3 CYS 119 15.176 8.042 2.288
299 H GLY 120 H GLY 120 17.996 6.027 0.454
300 HA2 GLY 120 HA2 GLY 120 17.833 4.405 -1.154
301 HA3 GLY 120 HA3 GLY 120 16.724 3.519 -0.113
302 H GLU 121 H GLU 121 14.548 3.675 -0.438
303 HA GLU 121 HA GLU 121 13.631 4.881 -3.008
304 HB2 GLU 121 HB2 GLU 121 11.946 3.168 -3.051
305 HB3 GLU 121 HB3 GLU 121 13.536 2.446 -2.818
306 HG2 GLU 121 HG2 GLU 121 13.066 2.220 -0.366
307 HG3 GLU 121 HG3 GLU 121 11.464 2.913 -0.620
308 H ARG 122 H ARG 122 13.449 5.641 0.219
309 HA ARG 122 HA ARG 122 10.729 6.879 0.062
310 HB2 ARG 122 HB2 ARG 122 11.122 4.874 1.585
311 HB3 ARG 122 HB3 ARG 122 12.222 5.881 2.527
312 HG2 ARG 122 HG2 ARG 122 10.368 7.403 3.091
313 HG3 ARG 122 HG3 ARG 122 9.283 6.507 2.005
314 HD2 ARG 122 HD2 ARG 122 9.607 4.472 3.447
315 HD3 ARG 122 HD3 ARG 122 10.653 5.421 4.509
316 HE ARG 122 HE ARG 122 8.793 6.674 5.296
317 HH11 ARG 122 HH11 ARG 122 7.613 4.313 2.970
318 HH12 ARG 122 HH12 ARG 122 5.964 4.554 3.484
319 HH21 ARG 122 HH21 ARG 122 6.805 6.875 5.897
320 HH22 ARG 122 HH22 ARG 122 5.499 5.980 5.138
321 H GLY 123 H GLY 123 10.503 8.784 1.549
322 HA2 GLY 123 HA2 GLY 123 12.851 10.326 2.320
323 HA3 GLY 123 HA3 GLY 123 11.995 11.021 0.951
324 H PHE 124 H PHE 124 11.286 12.895 2.162
325 HA PHE 124 HA PHE 124 9.882 12.527 4.677
326 HB2 PHE 124 HB2 PHE 124 9.656 14.876 4.774
327 HB3 PHE 124 HB3 PHE 124 11.277 14.468 4.259
328 HD1 PHE 124 HD1 PHE 124 8.004 15.822 3.106
329 HD2 PHE 124 HD2 PHE 124 12.170 15.286 2.199
330 HE1 PHE 124 HE1 PHE 124 7.771 17.340 1.147
331 HE2 PHE 124 HE2 PHE 124 11.955 16.806 0.263
332 HZ PHE 124 HZ PHE 124 9.749 17.824 -0.284
333 H PHE 125 H PHE 125 8.897 12.834 1.380
334 HA PHE 125 HA PHE 125 7.004 12.697 0.222
335 HB2 PHE 125 HB2 PHE 125 6.710 10.609 1.457
336 HB3 PHE 125 HB3 PHE 125 5.806 11.451 2.698
337 HD1 PHE 125 HD2 PHE 125 5.780 10.568 -0.931
338 HD2 PHE 125 HD1 PHE 125 3.458 11.880 2.460
339 HE1 PHE 125 HE2 PHE 125 3.687 10.241 -2.237
340 HE2 PHE 125 HE1 PHE 125 1.372 11.544 1.156
341 HZ PHE 125 HZ PHE 125 1.488 10.735 -1.193
342 H TYR 126 H TYR 126 6.060 13.960 3.381
343 HA TYR 126 HA TYR 126 4.983 16.388 2.111
344 HB2 TYR 126 HB2 TYR 126 3.058 14.783 2.251
345 HB3 TYR 126 HB3 TYR 126 3.262 14.728 3.996
346 HD1 TYR 126 HD1 TYR 126 2.664 17.088 1.126
347 HD2 TYR 126 HD2 TYR 126 2.163 16.371 5.356
348 HE1 TYR 126 HE1 TYR 126 1.281 19.147 1.313
349 HE2 TYR 126 HE2 TYR 126 0.772 18.433 5.530
350 HH TYR 126 HH TYR 126 0.069 20.516 2.698
351 H THR 127 H THR 127 4.666 18.161 3.618
352 HA THR 127 HA THR 127 6.866 18.318 5.440
353 HB THR 127 HB THR 127 6.082 20.190 4.083
354 HG1 THR 127 HG1 THR 127 6.425 21.713 5.682
355 HG21 THR 127 HG21 THR 127 3.615 19.981 4.410
356 HG22 THR 127 HG22 THR 127 4.228 21.603 4.755
357 HG23 THR 127 HG23 THR 127 3.811 20.512 6.093
358 HA PRO 128 HA PRO 128 5.010 16.960 9.264
359 HB2 PRO 128 HB2 PRO 128 6.735 19.080 10.551
360 HB3 PRO 128 HB3 PRO 128 6.508 17.368 11.026
361 HG2 PRO 128 HG2 PRO 128 8.728 18.119 9.674
362 HG3 PRO 128 HG3 PRO 128 7.865 16.615 9.203
363 HD2 PRO 128 HD2 PRO 128 7.698 19.356 7.919
364 HD3 PRO 128 HD3 PRO 128 7.875 17.746 7.153
365 H LYS 129 H LYS 129 3.542 17.569 10.895
366 HA LYS 129 HA LYS 129 2.324 20.307 10.742
367 HB2 LYS 129 HB2 LYS 129 0.889 17.631 10.973
368 HB3 LYS 129 HB3 LYS 129 0.127 19.222 11.142
369 HG2 LYS 129 HG2 LYS 129 0.798 19.798 8.814
370 HG3 LYS 129 HG3 LYS 129 1.527 18.196 8.637
371 HD2 LYS 129 HD2 LYS 129 -0.614 18.140 7.579
372 HD3 LYS 129 HD3 LYS 129 -0.698 17.143 9.040
373 HE2 LYS 129 HE2 LYS 129 -1.816 19.009 10.243
374 HE3 LYS 129 HE3 LYS 129 -1.675 20.032 8.806
375 HZ1 LYS 129 HZ1 LYS 129 -3.121 18.470 7.629
376 HZ2 LYS 129 HZ2 LYS 129 -3.874 19.014 8.962
377 HZ3 LYS 129 HZ3 LYS 129 -3.240 17.510 8.953
378 H THR 130 H THR 130 1.253 21.057 12.614
379 HA THR 130 HA THR 130 2.647 20.419 15.085
380 HB THR 130 HB THR 130 1.961 22.710 14.466
381 HG1 THR 130 HG1 THR 130 1.410 23.234 16.566
382 HG21 THR 130 HG21 THR 130 -0.292 23.508 14.906
383 HG22 THR 130 HG22 THR 130 -0.848 21.873 15.323
384 HG23 THR 130 HG23 THR 130 -0.363 22.258 13.657
385 H ARG 131 H ARG 131 1.618 19.924 17.117
386 HA ARG 131 HA ARG 131 -0.856 18.382 17.163
387 HB2 ARG 131 HB2 ARG 131 -0.066 16.273 17.665
388 HB3 ARG 131 HB3 ARG 131 0.904 16.762 16.285
389 HG2 ARG 131 HG2 ARG 131 1.788 16.664 19.198
390 HG3 ARG 131 HG3 ARG 131 2.219 15.530 17.932
391 HD2 ARG 131 HD2 ARG 131 3.533 17.190 16.752
392 HD3 ARG 131 HD3 ARG 131 3.006 18.476 17.830
393 HE ARG 131 HE ARG 131 5.070 16.506 18.357
394 HH11 ARG 131 HH11 ARG 131 2.821 18.714 19.969
395 HH12 ARG 131 HH12 ARG 131 3.873 18.853 21.358
396 HH21 ARG 131 HH21 ARG 131 6.303 16.732 20.180
397 HH22 ARG 131 HH22 ARG 131 5.768 17.763 21.476
Start of MODEL 16
1 H1 GLY 1 H1 GLY 1 16.697 23.486 11.176
2 H2 GLY 1 H2 GLY 1 16.344 22.236 12.183
3 H3 GLY 1 H3 GLY 1 15.486 23.634 12.277
4 HA2 GLY 1 HA2 GLY 1 14.179 21.956 11.148
5 HA3 GLY 1 HA3 GLY 1 14.590 23.322 10.084
6 H ILE 2 H ILE 2 14.771 22.394 8.117
7 HA ILE 2 HA ILE 2 16.449 19.929 7.774
8 HB ILE 2 HB ILE 2 14.258 21.005 5.979
9 HG12 ILE 2 HG12 ILE 2 13.231 20.167 8.026
10 HG13 ILE 2 HG13 ILE 2 12.880 19.136 6.657
11 HG21 ILE 2 HG21 ILE 2 15.866 19.802 4.648
12 HG22 ILE 2 HG22 ILE 2 15.926 18.472 5.812
13 HG23 ILE 2 HG23 ILE 2 14.455 18.767 4.862
14 HD11 ILE 2 HD11 ILE 2 14.953 18.528 8.816
15 HD12 ILE 2 HD12 ILE 2 13.326 17.836 8.692
16 HD13 ILE 2 HD13 ILE 2 14.525 17.469 7.453
17 H VAL 3 H VAL 3 15.622 22.989 6.046
18 HA VAL 3 HA VAL 3 17.708 22.543 4.125
19 HB VAL 3 HB VAL 3 16.101 25.072 4.589
20 HG11 VAL 3 HG11 VAL 3 18.120 25.539 3.250
21 HG12 VAL 3 HG12 VAL 3 17.784 24.137 2.212
22 HG13 VAL 3 HG13 VAL 3 16.697 25.545 2.213
23 HG21 VAL 3 HG21 VAL 3 14.752 24.247 2.671
24 HG22 VAL 3 HG22 VAL 3 15.683 22.732 2.661
25 HG23 VAL 3 HG23 VAL 3 14.650 23.139 4.043
26 H GLU 4 H GLU 4 17.475 25.103 6.660
27 HA GLU 4 HA GLU 4 20.096 26.102 6.183
28 HB2 GLU 4 HB2 GLU 4 19.821 27.417 8.108
29 HB3 GLU 4 HB3 GLU 4 18.264 27.319 7.306
30 HG2 GLU 4 HG2 GLU 4 19.152 25.858 9.805
31 HG3 GLU 4 HG3 GLU 4 17.996 27.182 9.714
32 H GLN 5 H GLN 5 19.017 23.519 8.365
33 HA GLN 5 HA GLN 5 21.404 23.022 9.745
34 HB2 GLN 5 HB2 GLN 5 19.114 22.106 10.192
35 HB3 GLN 5 HB3 GLN 5 19.298 21.031 8.817
36 HG2 GLN 5 HG2 GLN 5 19.743 19.843 10.905
37 HG3 GLN 5 HG3 GLN 5 21.198 19.910 9.930
38 HE21 GLN 5 HE21 GLN 5 22.600 19.586 11.717
39 HE22 GLN 5 HE22 GLN 5 22.803 20.824 12.967
40 H CYS 6 H CYS 6 20.588 22.182 6.431
41 HA CYS 6 HA CYS 6 23.090 20.597 6.131
42 HB2 CYS 6 HB2 CYS 6 20.788 19.689 5.520
43 HB3 CYS 6 HB3 CYS 6 20.780 20.869 4.215
44 H CYS 7 H CYS 7 21.598 23.605 5.110
45 HA CYS 7 HA CYS 7 23.464 23.980 2.876
46 HB2 CYS 7 HB2 CYS 7 21.037 24.179 2.644
47 HB3 CYS 7 HB3 CYS 7 21.015 25.529 3.768
48 H THR 8 H THR 8 22.979 25.445 6.079
49 HA THR 8 HA THR 8 25.401 27.125 5.524
50 HB THR 8 HB THR 8 23.509 28.591 5.771
51 HG1 THR 8 HG1 THR 8 24.463 29.886 7.317
52 HG21 THR 8 HG21 THR 8 22.035 27.394 7.280
53 HG22 THR 8 HG22 THR 8 22.441 28.969 7.960
54 HG23 THR 8 HG23 THR 8 23.222 27.511 8.603
55 H SER 9 H SER 9 23.735 25.066 7.905
56 HA SER 9 HA SER 9 26.273 24.715 9.428
57 HB2 SER 9 HB2 SER 9 23.517 23.486 9.703
58 HB3 SER 9 HB3 SER 9 24.916 22.989 10.669
59 HG SER 9 HG SER 9 23.813 25.626 10.519
60 H ILE 10 H ILE 10 27.267 22.520 9.563
61 HA ILE 10 HA ILE 10 27.414 21.386 6.884
62 HB ILE 10 HB ILE 10 28.962 19.665 7.984
63 HG12 ILE 10 HG12 ILE 10 30.305 20.436 9.820
64 HG13 ILE 10 HG13 ILE 10 29.280 21.852 10.074
65 HG21 ILE 10 HG21 ILE 10 30.843 21.168 7.612
66 HG22 ILE 10 HG22 ILE 10 29.600 21.388 6.371
67 HG23 ILE 10 HG23 ILE 10 29.766 22.575 7.689
68 HD11 ILE 10 HD11 ILE 10 28.933 20.003 11.724
69 HD12 ILE 10 HD12 ILE 10 27.458 20.447 10.866
70 HD13 ILE 10 HD13 ILE 10 28.345 18.964 10.410
71 H CYS 11 H CYS 11 26.899 19.556 6.085
72 HA CYS 11 HA CYS 11 24.666 18.082 7.340
73 HB2 CYS 11 HB2 CYS 11 24.654 19.519 5.146
74 HB3 CYS 11 HB3 CYS 11 25.391 18.108 4.413
75 H SER 12 H SER 12 24.502 15.819 7.072
76 HA SER 12 HA SER 12 26.850 14.250 6.251
77 HB2 SER 12 HB2 SER 12 26.997 13.087 8.397
78 HB3 SER 12 HB3 SER 12 27.327 14.813 8.598
79 HG SER 12 HG SER 12 25.853 13.892 10.176
80 H LEU 13 H LEU 13 26.397 11.895 6.279
81 HA LEU 13 HA LEU 13 23.892 11.286 5.054
82 HB2 LEU 13 HB2 LEU 13 25.848 9.374 6.388
83 HB3 LEU 13 HB3 LEU 13 24.605 8.949 5.218
84 HG LEU 13 HG LEU 13 27.083 10.649 4.687
85 HD11 LEU 13 HD11 LEU 13 27.740 8.780 3.235
86 HD12 LEU 13 HD12 LEU 13 26.275 7.884 3.696
87 HD13 LEU 13 HD13 LEU 13 27.525 8.247 4.909
88 HD21 LEU 13 HD21 LEU 13 25.276 11.496 3.277
89 HD22 LEU 13 HD22 LEU 13 24.828 9.835 2.803
90 HD23 LEU 13 HD23 LEU 13 26.378 10.536 2.290
91 H TYR 14 H TYR 14 24.902 11.025 8.463
92 HA TYR 14 HA TYR 14 22.564 9.631 9.404
93 HB2 TYR 14 HB2 TYR 14 24.635 9.865 10.707
94 HB3 TYR 14 HB3 TYR 14 24.409 11.610 10.794
95 HD1 TYR 14 HD1 TYR 14 22.922 8.322 11.804
96 HD2 TYR 14 HD2 TYR 14 23.013 12.583 12.493
97 HE1 TYR 14 HE1 TYR 14 21.561 8.015 13.862
98 HE2 TYR 14 HE2 TYR 14 21.636 12.275 14.550
99 HH TYR 14 HH TYR 14 20.537 9.041 15.655
100 H GLN 15 H GLN 15 23.152 13.076 8.691
101 HA GLN 15 HA GLN 15 20.645 13.955 9.967
102 HB2 GLN 15 HB2 GLN 15 22.727 15.388 8.272
103 HB3 GLN 15 HB3 GLN 15 21.252 16.146 8.878
104 HG2 GLN 15 HG2 GLN 15 21.884 15.718 11.192
105 HG3 GLN 15 HG3 GLN 15 23.335 14.852 10.689
106 HE21 GLN 15 HE21 GLN 15 25.047 16.112 9.547
107 HE22 GLN 15 HE22 GLN 15 25.108 17.873 9.780
108 H LEU 16 H LEU 16 21.863 13.495 6.620
109 HA LEU 16 HA LEU 16 19.439 14.147 5.271
110 HB2 LEU 16 HB2 LEU 16 21.800 12.378 4.583
111 HB3 LEU 16 HB3 LEU 16 20.490 12.665 3.444
112 HG LEU 16 HG LEU 16 22.060 14.961 4.684
113 HD11 LEU 16 HD11 LEU 16 23.417 14.978 2.613
114 HD12 LEU 16 HD12 LEU 16 22.626 13.472 2.087
115 HD13 LEU 16 HD13 LEU 16 23.653 13.490 3.540
116 HD21 LEU 16 HD21 LEU 16 20.458 14.740 2.094
117 HD22 LEU 16 HD22 LEU 16 21.300 16.185 2.687
118 HD23 LEU 16 HD23 LEU 16 19.913 15.549 3.575
119 H GLU 17 H GLU 17 20.457 11.019 6.759
120 HA GLU 17 HA GLU 17 18.074 9.655 5.848
121 HB2 GLU 17 HB2 GLU 17 20.329 8.700 6.909
122 HB3 GLU 17 HB3 GLU 17 19.416 8.859 8.424
123 HG2 GLU 17 HG2 GLU 17 17.534 7.584 7.256
124 HG3 GLU 17 HG3 GLU 17 18.628 7.342 5.895
125 H ASN 18 H ASN 18 18.798 11.474 8.864
126 HA ASN 18 HA ASN 18 16.274 10.918 10.113
127 HB2 ASN 18 HB2 ASN 18 18.518 12.886 10.583
128 HB3 ASN 18 HB3 ASN 18 16.974 13.166 11.368
129 HD21 ASN 18 HD21 ASN 18 19.706 10.921 11.202
130 HD22 ASN 18 HD22 ASN 18 19.272 10.075 12.685
131 H TYR 19 H TYR 19 17.160 13.496 7.791
132 HA TYR 19 HA TYR 19 14.749 14.995 8.015
133 HB2 TYR 19 HB2 TYR 19 16.336 14.427 5.493
134 HB3 TYR 19 HB3 TYR 19 15.213 15.752 5.744
135 HD1 TYR 19 HD2 TYR 19 16.515 16.251 8.737
136 HD2 TYR 19 HD1 TYR 19 17.925 16.050 4.669
137 HE1 TYR 19 HE2 TYR 19 18.432 17.684 9.335
138 HE2 TYR 19 HE1 TYR 19 19.883 17.480 5.282
139 HH TYR 19 HH TYR 19 20.378 18.638 8.630
140 H CYS 20 H CYS 20 15.322 11.884 6.457
141 HA CYS 20 HA CYS 20 12.643 11.806 5.203
142 HB2 CYS 20 HB2 CYS 20 14.686 10.871 4.101
143 HB3 CYS 20 HB3 CYS 20 14.839 9.726 5.423
144 H ASN 21 H ASN 21 14.435 10.215 7.864
145 HA ASN 21 HA ASN 21 12.343 8.354 8.470
146 HB2 ASN 21 HB2 ASN 21 14.881 8.113 8.706
147 HB3 ASN 21 HB3 ASN 21 14.763 9.091 10.171
148 HD21 ASN 21 HD21 ASN 21 13.796 8.094 12.077
149 HD22 ASN 21 HD22 ASN 21 13.491 6.363 12.093
150 H GLY 22 H GLY 22 13.029 11.556 9.770
151 HA2 GLY 22 HA2 GLY 22 11.648 11.354 12.286
152 HA3 GLY 22 HA3 GLY 22 12.091 12.832 11.443
153 H1 PHE 101 H1 PHE 101 33.318 8.620 4.349
154 H2 PHE 101 H2 PHE 101 34.096 9.188 3.027
155 H3 PHE 101 H3 PHE 101 32.758 8.264 2.849
156 HA PHE 101 HA PHE 101 32.257 10.571 2.423
157 HB2 PHE 101 HB2 PHE 101 30.468 9.138 3.297
158 HB3 PHE 101 HB3 PHE 101 30.994 9.446 4.954
159 HD1 PHE 101 HD2 PHE 101 29.454 11.004 1.923
160 HD2 PHE 101 HD1 PHE 101 30.365 11.471 6.119
161 HE1 PHE 101 HE2 PHE 101 28.033 13.042 2.013
162 HE2 PHE 101 HE1 PHE 101 28.995 13.525 6.189
163 HZ PHE 101 HZ PHE 101 27.807 14.315 4.135
164 H VAL 102 H VAL 102 32.169 12.739 3.132
165 HA VAL 102 HA VAL 102 33.419 13.481 5.702
166 HB VAL 102 HB VAL 102 34.658 15.348 4.657
167 HG11 VAL 102 HG11 VAL 102 35.806 13.259 5.294
168 HG12 VAL 102 HG12 VAL 102 35.590 12.644 3.643
169 HG13 VAL 102 HG13 VAL 102 36.583 14.085 3.930
170 HG21 VAL 102 HG21 VAL 102 34.155 13.941 2.000
171 HG22 VAL 102 HG22 VAL 102 33.501 15.525 2.480
172 HG23 VAL 102 HG23 VAL 102 35.245 15.311 2.275
173 H ASN 103 H ASN 103 32.676 15.471 6.553
174 HA ASN 103 HA ASN 103 29.953 16.078 5.921
175 HB2 ASN 103 HB2 ASN 103 32.018 17.446 7.691
176 HB3 ASN 103 HB3 ASN 103 30.346 17.986 7.555
177 HD21 ASN 103 HD21 ASN 103 31.082 17.412 10.037
178 HD22 ASN 103 HD22 ASN 103 30.402 15.867 10.532
179 H GLN 104 H GLN 104 28.982 17.753 4.929
180 HA GLN 104 HA GLN 104 30.477 19.630 3.164
181 HB2 GLN 104 HB2 GLN 104 28.797 17.238 2.301
182 HB3 GLN 104 HB3 GLN 104 29.039 18.613 1.229
183 HG2 GLN 104 HG2 GLN 104 31.381 18.271 1.058
184 HG3 GLN 104 HG3 GLN 104 31.406 17.105 2.376
185 HE21 GLN 104 HE21 GLN 104 30.574 14.966 2.058
186 HE22 GLN 104 HE22 GLN 104 30.329 14.349 0.419
187 H HIS 105 H HIS 105 28.592 20.717 1.659
188 HA HIS 105 HA HIS 105 26.134 21.119 3.303
189 HB2 HIS 105 HB2 HIS 105 27.526 23.159 1.537
190 HB3 HIS 105 HB3 HIS 105 26.000 23.393 2.380
191 HD1 HIS 105 HD1 HIS 105 26.305 23.191 5.252
192 HD2 HIS 105 HD2 HIS 105 29.640 23.947 2.796
193 HE1 HIS 105 HE1 HIS 105 28.072 24.253 6.747
194 H LEU 106 H LEU 106 24.178 21.179 2.253
195 HA LEU 106 HA LEU 106 24.016 21.136 -0.698
196 HB2 LEU 106 HB2 LEU 106 22.576 19.096 1.048
197 HB3 LEU 106 HB3 LEU 106 22.276 19.351 -0.657
198 HG LEU 106 HG LEU 106 24.928 18.354 0.470
199 HD11 LEU 106 HD11 LEU 106 24.193 16.156 -0.361
200 HD12 LEU 106 HD12 LEU 106 22.627 16.855 -0.843
201 HD13 LEU 106 HD13 LEU 106 23.085 16.766 0.874
202 HD21 LEU 106 HD21 LEU 106 25.363 17.673 -1.863
203 HD22 LEU 106 HD22 LEU 106 25.128 19.428 -1.780
204 HD23 LEU 106 HD23 LEU 106 23.816 18.381 -2.367
205 H CYS 107 H CYS 107 21.983 21.879 -1.475
206 HA CYS 107 HA CYS 107 20.087 23.030 0.501
207 HB2 CYS 107 HB2 CYS 107 22.078 24.561 -0.676
208 HB3 CYS 107 HB3 CYS 107 20.748 24.794 -1.789
209 H GLY 108 H GLY 108 18.016 23.627 -0.428
210 HA2 GLY 108 HA2 GLY 108 16.138 23.294 -1.731
211 HA3 GLY 108 HA3 GLY 108 17.246 23.646 -3.052
212 H SER 109 H SER 109 16.602 22.296 -4.647
213 HA SER 109 HA SER 109 15.503 19.719 -4.370
214 HB2 SER 109 HB2 SER 109 17.055 20.843 -6.740
215 HB3 SER 109 HB3 SER 109 15.880 19.516 -6.782
216 HG SER 109 HG SER 109 14.256 20.980 -6.210
217 H HIS 110 H HIS 110 18.958 20.627 -4.460
218 HA HIS 110 HA HIS 110 19.894 17.950 -5.045
219 HB2 HIS 110 HB2 HIS 110 21.094 20.219 -5.401
220 HB3 HIS 110 HB3 HIS 110 21.457 20.179 -3.676
221 HD1 HIS 110 HD1 HIS 110 24.022 20.228 -4.974
222 HD2 HIS 110 HD2 HIS 110 21.749 16.691 -4.972
223 HE1 HIS 110 HE1 HIS 110 25.653 18.335 -5.458
224 H LEU 111 H LEU 111 19.262 19.798 -2.077
225 HA LEU 111 HA LEU 111 20.177 17.845 -0.157
226 HB2 LEU 111 HB2 LEU 111 19.671 20.299 0.166
227 HB3 LEU 111 HB3 LEU 111 17.959 19.928 0.091
228 HG LEU 111 HG LEU 111 19.927 18.974 2.208
229 HD11 LEU 111 HD11 LEU 111 19.412 21.377 2.291
230 HD12 LEU 111 HD12 LEU 111 18.643 20.537 3.643
231 HD13 LEU 111 HD13 LEU 111 17.668 21.024 2.239
232 HD21 LEU 111 HD21 LEU 111 17.821 18.392 3.497
233 HD22 LEU 111 HD22 LEU 111 18.208 17.310 2.179
234 HD23 LEU 111 HD23 LEU 111 16.926 18.540 1.969
235 H VAL 112 H VAL 112 16.933 18.498 -1.602
236 HA VAL 112 HA VAL 112 15.594 16.292 -0.380
237 HB VAL 112 HB VAL 112 14.963 17.765 -2.954
238 HG11 VAL 112 HG11 VAL 112 13.836 15.618 -3.108
239 HG12 VAL 112 HG12 VAL 112 13.304 15.727 -1.416
240 HG13 VAL 112 HG13 VAL 112 12.647 16.833 -2.638
241 HG21 VAL 112 HG21 VAL 112 13.775 17.932 -0.142
242 HG22 VAL 112 HG22 VAL 112 14.855 19.134 -0.883
243 HG23 VAL 112 HG23 VAL 112 13.252 18.862 -1.563
244 H GLU 113 H GLU 113 17.237 16.409 -3.601
245 HA GLU 113 HA GLU 113 16.704 13.699 -4.278
246 HB2 GLU 113 HB2 GLU 113 17.532 15.427 -5.840
247 HB3 GLU 113 HB3 GLU 113 19.105 15.421 -5.025
248 HG2 GLU 113 HG2 GLU 113 19.446 13.061 -5.668
249 HG3 GLU 113 HG3 GLU 113 17.833 13.005 -6.392
250 H ALA 114 H ALA 114 19.506 15.070 -2.439
251 HA ALA 114 HA ALA 114 20.832 12.564 -2.097
252 HB1 ALA 114 HB1 ALA 114 20.916 15.097 -0.406
253 HB2 ALA 114 HB2 ALA 114 22.083 13.755 -0.339
254 HB3 ALA 114 HB3 ALA 114 21.938 14.729 -1.816
255 H LEU 115 H LEU 115 18.469 14.271 0.064
256 HA LEU 115 HA LEU 115 18.590 12.254 2.082
257 HB2 LEU 115 HB2 LEU 115 17.180 13.514 3.267
258 HB3 LEU 115 HB3 LEU 115 17.782 14.709 2.165
259 HG LEU 115 HG LEU 115 15.570 14.120 0.792
260 HD11 LEU 115 HD11 LEU 115 14.764 12.247 2.179
261 HD12 LEU 115 HD12 LEU 115 13.697 13.638 2.366
262 HD13 LEU 115 HD13 LEU 115 14.871 13.270 3.634
263 HD21 LEU 115 HD21 LEU 115 14.387 15.862 2.067
264 HD22 LEU 115 HD22 LEU 115 16.080 16.286 1.812
265 HD23 LEU 115 HD23 LEU 115 15.562 15.686 3.395
266 H TYR 116 H TYR 116 16.582 12.483 -0.835
267 HA TYR 116 HA TYR 116 14.834 10.305 -0.335
268 HB2 TYR 116 HB2 TYR 116 15.203 12.084 -2.382
269 HB3 TYR 116 HB3 TYR 116 15.902 10.674 -3.118
270 HD1 TYR 116 HD2 TYR 116 14.178 8.437 -2.558
271 HD2 TYR 116 HD1 TYR 116 13.122 12.591 -3.119
272 HE1 TYR 116 HE2 TYR 116 11.885 7.772 -3.286
273 HE2 TYR 116 HE1 TYR 116 10.844 11.920 -3.827
274 HH TYR 116 HH TYR 116 9.427 10.182 -4.276
275 H LEU 117 H LEU 117 18.088 10.291 -1.835
276 HA LEU 117 HA LEU 117 18.130 7.406 -2.189
277 HB2 LEU 117 HB2 LEU 117 20.026 9.717 -2.604
278 HB3 LEU 117 HB3 LEU 117 20.714 8.111 -2.504
279 HG LEU 117 HG LEU 117 20.326 8.873 -4.815
280 HD11 LEU 117 HD11 LEU 117 19.412 6.785 -5.664
281 HD12 LEU 117 HD12 LEU 117 18.691 6.411 -4.085
282 HD13 LEU 117 HD13 LEU 117 20.456 6.468 -4.271
283 HD21 LEU 117 HD21 LEU 117 17.352 8.531 -4.254
284 HD22 LEU 117 HD22 LEU 117 18.115 8.868 -5.820
285 HD23 LEU 117 HD23 LEU 117 18.182 10.078 -4.540
286 H VAL 118 H VAL 118 19.457 9.594 0.300
287 HA VAL 118 HA VAL 118 20.992 7.538 1.655
288 HB VAL 118 HB VAL 118 20.024 10.268 2.566
289 HG11 VAL 118 HG11 VAL 118 21.730 10.059 4.369
290 HG12 VAL 118 HG12 VAL 118 20.379 8.953 4.595
291 HG13 VAL 118 HG13 VAL 118 21.930 8.339 3.983
292 HG21 VAL 118 HG21 VAL 118 22.788 9.195 1.795
293 HG22 VAL 118 HG22 VAL 118 21.780 10.180 0.739
294 HG23 VAL 118 HG23 VAL 118 22.397 10.874 2.240
295 H CYS 119 H CYS 119 17.602 8.490 1.859
296 HA CYS 119 HA CYS 119 16.929 7.116 4.254
297 HB2 CYS 119 HB2 CYS 119 15.646 8.824 2.888
298 HB3 CYS 119 HB3 CYS 119 15.131 7.504 1.838
299 H GLY 120 H GLY 120 17.924 5.723 1.271
300 HA2 GLY 120 HA2 GLY 120 18.289 3.461 0.802
301 HA3 GLY 120 HA3 GLY 120 17.282 2.990 2.164
302 H GLU 121 H GLU 121 16.562 1.411 0.479
303 HA GLU 121 HA GLU 121 15.299 2.139 -1.925
304 HB2 GLU 121 HB2 GLU 121 14.542 -0.150 -2.052
305 HB3 GLU 121 HB3 GLU 121 16.203 -0.078 -1.457
306 HG2 GLU 121 HG2 GLU 121 15.381 -0.436 0.869
307 HG3 GLU 121 HG3 GLU 121 13.715 -0.498 0.272
308 H ARG 122 H ARG 122 13.920 2.366 1.213
309 HA ARG 122 HA ARG 122 11.106 2.347 0.470
310 HB2 ARG 122 HB2 ARG 122 10.778 3.370 2.703
311 HB3 ARG 122 HB3 ARG 122 11.746 1.900 2.763
312 HG2 ARG 122 HG2 ARG 122 13.818 3.250 2.951
313 HG3 ARG 122 HG3 ARG 122 12.870 4.744 2.870
314 HD2 ARG 122 HD2 ARG 122 11.733 4.204 4.942
315 HD3 ARG 122 HD3 ARG 122 12.542 2.622 5.019
316 HE ARG 122 HE ARG 122 14.648 4.391 4.849
317 HH11 ARG 122 HH11 ARG 122 11.939 4.253 7.117
318 HH12 ARG 122 HH12 ARG 122 12.901 5.018 8.378
319 HH21 ARG 122 HH21 ARG 122 15.784 5.195 6.613
320 HH22 ARG 122 HH22 ARG 122 14.930 5.478 8.110
321 H GLY 123 H GLY 123 13.602 4.815 0.401
322 HA2 GLY 123 HA2 GLY 123 13.624 7.048 -0.232
323 HA3 GLY 123 HA3 GLY 123 12.246 6.649 -1.255
324 H PHE 124 H PHE 124 12.208 8.961 -0.708
325 HA PHE 124 HA PHE 124 11.162 9.748 1.913
326 HB2 PHE 124 HB2 PHE 124 12.988 10.913 0.815
327 HB3 PHE 124 HB3 PHE 124 12.010 11.155 -0.627
328 HD1 PHE 124 HD1 PHE 124 11.125 11.713 2.958
329 HD2 PHE 124 HD2 PHE 124 11.955 13.413 -0.885
330 HE1 PHE 124 HE1 PHE 124 10.511 13.983 3.845
331 HE2 PHE 124 HE2 PHE 124 11.418 15.708 -0.010
332 HZ PHE 124 HZ PHE 124 10.660 15.973 2.353
333 H PHE 125 H PHE 125 9.925 9.289 -1.331
334 HA PHE 125 HA PHE 125 7.865 9.316 -2.239
335 HB2 PHE 125 HB2 PHE 125 7.845 7.443 -0.583
336 HB3 PHE 125 HB3 PHE 125 6.962 8.477 0.523
337 HD1 PHE 125 HD1 PHE 125 6.796 7.405 -3.103
338 HD2 PHE 125 HD2 PHE 125 4.623 8.175 0.545
339 HE1 PHE 125 HE1 PHE 125 4.687 6.683 -4.204
340 HE2 PHE 125 HE2 PHE 125 2.514 7.449 -0.564
341 HZ PHE 125 HZ PHE 125 2.548 6.711 -2.936
342 H TYR 126 H TYR 126 8.529 11.806 -1.964
343 HA TYR 126 HA TYR 126 5.944 13.181 -1.441
344 HB2 TYR 126 HB2 TYR 126 7.385 13.634 0.488
345 HB3 TYR 126 HB3 TYR 126 8.682 14.183 -0.576
346 HD1 TYR 126 HD1 TYR 126 5.064 14.868 0.234
347 HD2 TYR 126 HD2 TYR 126 8.837 16.493 -1.097
348 HE1 TYR 126 HE1 TYR 126 4.061 17.147 0.154
349 HE2 TYR 126 HE2 TYR 126 7.831 18.778 -1.160
350 HH TYR 126 HH TYR 126 4.354 19.293 -0.407
351 H THR 127 H THR 127 5.471 14.878 -2.766
352 HA THR 127 HA THR 127 7.300 15.581 -5.008
353 HB THR 127 HB THR 127 4.317 15.100 -5.312
354 HG1 THR 127 HG1 THR 127 4.955 13.355 -6.549
355 HG21 THR 127 HG21 THR 127 4.810 15.356 -7.740
356 HG22 THR 127 HG22 THR 127 6.488 15.799 -7.350
357 HG23 THR 127 HG23 THR 127 5.137 16.849 -6.856
358 HA PRO 128 HA PRO 128 6.452 19.561 -3.170
359 HB2 PRO 128 HB2 PRO 128 7.126 20.573 -5.943
360 HB3 PRO 128 HB3 PRO 128 7.660 21.212 -4.358
361 HG2 PRO 128 HG2 PRO 128 9.315 19.631 -5.777
362 HG3 PRO 128 HG3 PRO 128 9.115 19.327 -4.014
363 HD2 PRO 128 HD2 PRO 128 7.803 17.885 -6.340
364 HD3 PRO 128 HD3 PRO 128 8.561 17.213 -4.863
365 H LYS 129 H LYS 129 4.975 21.212 -3.073
366 HA LYS 129 HA LYS 129 2.681 21.333 -4.969
367 HB2 LYS 129 HB2 LYS 129 2.203 19.631 -3.208
368 HB3 LYS 129 HB3 LYS 129 2.478 20.846 -1.960
369 HG2 LYS 129 HG2 LYS 129 0.537 22.145 -2.755
370 HG3 LYS 129 HG3 LYS 129 0.302 20.990 -4.092
371 HD2 LYS 129 HD2 LYS 129 -0.147 19.186 -2.434
372 HD3 LYS 129 HD3 LYS 129 0.178 20.316 -1.117
373 HE2 LYS 129 HE2 LYS 129 -2.186 20.135 -1.285
374 HE3 LYS 129 HE3 LYS 129 -1.731 21.741 -1.867
375 HZ1 LYS 129 HZ1 LYS 129 -2.368 19.415 -3.609
376 HZ2 LYS 129 HZ2 LYS 129 -1.983 20.915 -4.144
377 HZ3 LYS 129 HZ3 LYS 129 -3.366 20.670 -3.319
378 H THR 130 H THR 130 1.491 23.303 -4.850
379 HA THR 130 HA THR 130 2.935 25.644 -3.787
380 HB THR 130 HB THR 130 0.249 25.481 -5.202
381 HG1 THR 130 HG1 THR 130 2.004 24.895 -6.512
382 HG21 THR 130 HG21 THR 130 0.434 27.568 -3.885
383 HG22 THR 130 HG22 THR 130 0.619 27.902 -5.614
384 HG23 THR 130 HG23 THR 130 2.052 27.868 -4.567
385 H ARG 131 H ARG 131 2.823 26.089 -1.695
386 HA ARG 131 HA ARG 131 0.308 26.184 -0.188
387 HB2 ARG 131 HB2 ARG 131 1.109 24.676 1.590
388 HB3 ARG 131 HB3 ARG 131 0.855 23.842 0.063
389 HG2 ARG 131 HG2 ARG 131 3.331 23.931 -0.367
390 HG3 ARG 131 HG3 ARG 131 3.560 24.652 1.234
391 HD2 ARG 131 HD2 ARG 131 2.655 22.643 2.304
392 HD3 ARG 131 HD3 ARG 131 2.164 21.989 0.741
393 HE ARG 131 HE ARG 131 4.351 21.390 0.229
394 HH11 ARG 131 HH11 ARG 131 4.479 23.163 3.247
395 HH12 ARG 131 HH12 ARG 131 6.088 22.590 3.598
396 HH21 ARG 131 HH21 ARG 131 6.278 20.603 0.790
397 HH22 ARG 131 HH22 ARG 131 7.095 21.176 2.225
Start of MODEL 17
1 H1 GLY 1 H1 GLY 1 15.361 22.868 12.211
2 H2 GLY 1 H2 GLY 1 15.048 24.474 12.087
3 H3 GLY 1 H3 GLY 1 16.322 23.815 11.274
4 HA2 GLY 1 HA2 GLY 1 13.480 23.242 10.742
5 HA3 GLY 1 HA3 GLY 1 14.548 24.240 9.730
6 H ILE 2 H ILE 2 15.069 23.173 7.957
7 HA ILE 2 HA ILE 2 16.071 20.360 8.090
8 HB ILE 2 HB ILE 2 14.072 21.373 6.028
9 HG12 ILE 2 HG12 ILE 2 12.945 20.782 8.148
10 HG13 ILE 2 HG13 ILE 2 12.481 19.790 6.793
11 HG21 ILE 2 HG21 ILE 2 15.628 19.929 4.892
12 HG22 ILE 2 HG22 ILE 2 15.561 18.723 6.192
13 HG23 ILE 2 HG23 ILE 2 14.148 19.013 5.161
14 HD11 ILE 2 HD11 ILE 2 12.737 18.514 8.902
15 HD12 ILE 2 HD12 ILE 2 13.780 17.907 7.609
16 HD13 ILE 2 HD13 ILE 2 14.470 18.895 8.920
17 H VAL 3 H VAL 3 15.580 23.121 5.831
18 HA VAL 3 HA VAL 3 17.773 22.289 4.201
19 HB VAL 3 HB VAL 3 16.276 24.921 4.112
20 HG11 VAL 3 HG11 VAL 3 17.020 24.925 1.718
21 HG12 VAL 3 HG12 VAL 3 18.371 25.077 2.848
22 HG13 VAL 3 HG13 VAL 3 18.046 23.509 2.065
23 HG21 VAL 3 HG21 VAL 3 15.834 22.304 2.591
24 HG22 VAL 3 HG22 VAL 3 14.739 23.002 3.809
25 HG23 VAL 3 HG23 VAL 3 14.991 23.841 2.280
26 H GLU 4 H GLU 4 17.522 24.988 6.544
27 HA GLU 4 HA GLU 4 20.052 26.142 5.944
28 HB2 GLU 4 HB2 GLU 4 19.778 27.445 7.841
29 HB3 GLU 4 HB3 GLU 4 18.184 27.214 7.164
30 HG2 GLU 4 HG2 GLU 4 19.366 25.876 9.611
31 HG3 GLU 4 HG3 GLU 4 18.123 27.115 9.590
32 H GLN 5 H GLN 5 19.256 23.432 8.099
33 HA GLN 5 HA GLN 5 21.688 23.227 9.481
34 HB2 GLN 5 HB2 GLN 5 19.569 22.091 10.032
35 HB3 GLN 5 HB3 GLN 5 19.752 21.041 8.632
36 HG2 GLN 5 HG2 GLN 5 20.379 19.918 10.738
37 HG3 GLN 5 HG3 GLN 5 21.723 19.983 9.612
38 HE21 GLN 5 HE21 GLN 5 23.592 21.276 10.158
39 HE22 GLN 5 HE22 GLN 5 23.778 21.897 11.806
40 H CYS 6 H CYS 6 20.899 22.127 6.195
41 HA CYS 6 HA CYS 6 23.679 21.057 5.921
42 HB2 CYS 6 HB2 CYS 6 21.401 20.584 3.991
43 HB3 CYS 6 HB3 CYS 6 22.931 19.733 4.109
44 H CYS 7 H CYS 7 21.680 23.705 4.879
45 HA CYS 7 HA CYS 7 23.324 24.226 2.502
46 HB2 CYS 7 HB2 CYS 7 20.862 24.270 2.480
47 HB3 CYS 7 HB3 CYS 7 20.874 25.626 3.605
48 H THR 8 H THR 8 22.768 25.854 5.669
49 HA THR 8 HA THR 8 25.036 27.727 5.023
50 HB THR 8 HB THR 8 24.285 29.106 6.882
51 HG1 THR 8 HG1 THR 8 22.241 28.742 7.757
52 HG21 THR 8 HG21 THR 8 22.316 30.086 5.806
53 HG22 THR 8 HG22 THR 8 22.046 28.607 4.864
54 HG23 THR 8 HG23 THR 8 23.494 29.601 4.572
55 H SER 9 H SER 9 23.777 25.407 7.369
56 HA SER 9 HA SER 9 26.481 25.081 8.612
57 HB2 SER 9 HB2 SER 9 23.745 24.000 9.352
58 HB3 SER 9 HB3 SER 9 25.252 23.527 10.148
59 HG SER 9 HG SER 9 24.179 26.168 9.973
60 H ILE 10 H ILE 10 26.824 22.488 9.021
61 HA ILE 10 HA ILE 10 26.595 21.223 6.327
62 HB ILE 10 HB ILE 10 28.624 19.944 6.869
63 HG12 ILE 10 HG12 ILE 10 30.269 20.884 8.436
64 HG13 ILE 10 HG13 ILE 10 29.063 21.973 9.110
65 HG21 ILE 10 HG21 ILE 10 28.905 22.967 6.748
66 HG22 ILE 10 HG22 ILE 10 30.118 21.787 6.248
67 HG23 ILE 10 HG23 ILE 10 28.586 21.885 5.373
68 HD11 ILE 10 HD11 ILE 10 29.587 19.897 10.469
69 HD12 ILE 10 HD12 ILE 10 27.874 20.114 10.114
70 HD13 ILE 10 HD13 ILE 10 28.831 18.929 9.185
71 H CYS 11 H CYS 11 26.560 18.925 6.172
72 HA CYS 11 HA CYS 11 25.086 17.532 8.362
73 HB2 CYS 11 HB2 CYS 11 24.199 17.989 5.496
74 HB3 CYS 11 HB3 CYS 11 23.600 16.624 6.434
75 H SER 12 H SER 12 25.078 15.308 8.250
76 HA SER 12 HA SER 12 26.832 13.949 6.263
77 HB2 SER 12 HB2 SER 12 27.908 14.136 8.533
78 HB3 SER 12 HB3 SER 12 26.606 13.110 9.163
79 HG SER 12 HG SER 12 28.524 11.943 8.472
80 H LEU 13 H LEU 13 26.335 11.461 6.511
81 HA LEU 13 HA LEU 13 23.768 11.088 5.310
82 HB2 LEU 13 HB2 LEU 13 25.453 8.911 6.589
83 HB3 LEU 13 HB3 LEU 13 24.309 8.756 5.255
84 HG LEU 13 HG LEU 13 27.035 10.117 5.200
85 HD11 LEU 13 HD11 LEU 13 25.984 7.643 3.778
86 HD12 LEU 13 HD12 LEU 13 27.084 7.659 5.175
87 HD13 LEU 13 HD13 LEU 13 27.612 8.331 3.622
88 HD21 LEU 13 HD21 LEU 13 26.735 10.457 2.805
89 HD22 LEU 13 HD22 LEU 13 25.486 11.341 3.683
90 HD23 LEU 13 HD23 LEU 13 25.091 9.807 2.878
91 H TYR 14 H TYR 14 24.801 10.854 8.662
92 HA TYR 14 HA TYR 14 22.554 9.527 9.824
93 HB2 TYR 14 HB2 TYR 14 24.603 9.947 11.051
94 HB3 TYR 14 HB3 TYR 14 24.430 11.681 10.853
95 HD1 TYR 14 HD2 TYR 14 22.735 8.694 12.389
96 HD2 TYR 14 HD1 TYR 14 23.329 12.972 12.509
97 HE1 TYR 14 HE2 TYR 14 21.472 8.812 14.534
98 HE2 TYR 14 HE1 TYR 14 22.067 13.089 14.640
99 HH TYR 14 HH TYR 14 20.943 11.921 16.263
100 H GLN 15 H GLN 15 22.963 12.948 8.848
101 HA GLN 15 HA GLN 15 20.370 13.724 10.035
102 HB2 GLN 15 HB2 GLN 15 22.585 15.190 8.567
103 HB3 GLN 15 HB3 GLN 15 20.984 15.905 8.677
104 HG2 GLN 15 HG2 GLN 15 22.686 15.074 11.061
105 HG3 GLN 15 HG3 GLN 15 22.429 16.719 10.474
106 HE21 GLN 15 HE21 GLN 15 19.956 17.413 10.377
107 HE22 GLN 15 HE22 GLN 15 19.027 16.866 11.769
108 H LEU 16 H LEU 16 21.732 13.115 6.808
109 HA LEU 16 HA LEU 16 19.321 13.714 5.372
110 HB2 LEU 16 HB2 LEU 16 21.747 12.018 4.730
111 HB3 LEU 16 HB3 LEU 16 20.497 12.400 3.552
112 HG LEU 16 HG LEU 16 22.135 14.540 5.005
113 HD11 LEU 16 HD11 LEU 16 22.525 13.301 2.258
114 HD12 LEU 16 HD12 LEU 16 23.595 13.104 3.665
115 HD13 LEU 16 HD13 LEU 16 23.417 14.697 2.907
116 HD21 LEU 16 HD21 LEU 16 20.381 14.667 2.510
117 HD22 LEU 16 HD22 LEU 16 21.371 15.991 3.159
118 HD23 LEU 16 HD23 LEU 16 20.004 15.383 4.092
119 H GLU 17 H GLU 17 20.198 10.831 7.216
120 HA GLU 17 HA GLU 17 17.698 9.541 6.306
121 HB2 GLU 17 HB2 GLU 17 20.104 8.404 6.878
122 HB3 GLU 17 HB3 GLU 17 19.288 8.228 8.439
123 HG2 GLU 17 HG2 GLU 17 17.283 7.306 7.130
124 HG3 GLU 17 HG3 GLU 17 18.294 7.334 5.687
125 H ASN 18 H ASN 18 18.373 11.863 8.614
126 HA ASN 18 HA ASN 18 16.271 10.949 10.515
127 HB2 ASN 18 HB2 ASN 18 18.118 13.363 10.486
128 HB3 ASN 18 HB3 ASN 18 16.768 13.205 11.590
129 HD21 ASN 18 HD21 ASN 18 19.486 13.429 12.480
130 HD22 ASN 18 HD22 ASN 18 19.855 11.900 13.252
131 H TYR 19 H TYR 19 16.696 13.384 7.899
132 HA TYR 19 HA TYR 19 14.220 14.691 8.342
133 HB2 TYR 19 HB2 TYR 19 15.721 14.382 5.726
134 HB3 TYR 19 HB3 TYR 19 14.552 15.644 6.116
135 HD1 TYR 19 HD1 TYR 19 15.412 16.454 8.879
136 HD2 TYR 19 HD2 TYR 19 17.725 15.547 5.347
137 HE1 TYR 19 HE1 TYR 19 17.266 17.858 9.740
138 HE2 TYR 19 HE2 TYR 19 19.593 16.902 6.236
139 HH TYR 19 HH TYR 19 20.306 18.294 7.916
140 H CYS 20 H CYS 20 14.782 11.653 6.687
141 HA CYS 20 HA CYS 20 12.047 11.537 5.590
142 HB2 CYS 20 HB2 CYS 20 12.693 9.309 4.898
143 HB3 CYS 20 HB3 CYS 20 13.902 10.494 4.394
144 H ASN 21 H ASN 21 13.565 10.801 8.632
145 HA ASN 21 HA ASN 21 11.537 8.787 9.405
146 HB2 ASN 21 HB2 ASN 21 13.941 8.319 9.709
147 HB3 ASN 21 HB3 ASN 21 14.108 9.748 10.726
148 HD21 ASN 21 HD21 ASN 21 12.409 6.579 10.526
149 HD22 ASN 21 HD22 ASN 21 12.285 6.393 12.268
150 H GLY 22 H GLY 22 12.433 12.114 10.110
151 HA2 GLY 22 HA2 GLY 22 11.117 12.533 12.591
152 HA3 GLY 22 HA3 GLY 22 11.500 13.777 11.405
153 H1 PHE 101 H1 PHE 101 26.440 16.176 2.642
154 H2 PHE 101 H2 PHE 101 27.782 16.980 2.127
155 H3 PHE 101 H3 PHE 101 27.215 17.221 3.641
156 HA PHE 101 HA PHE 101 27.734 15.006 4.312
157 HB2 PHE 101 HB2 PHE 101 27.360 13.911 2.149
158 HB3 PHE 101 HB3 PHE 101 28.771 14.714 1.470
159 HD1 PHE 101 HD1 PHE 101 27.953 12.618 4.540
160 HD2 PHE 101 HD2 PHE 101 30.665 13.343 1.251
161 HE1 PHE 101 HE1 PHE 101 29.376 10.738 5.292
162 HE2 PHE 101 HE2 PHE 101 32.053 11.432 1.991
163 HZ PHE 101 HZ PHE 101 31.420 10.124 4.015
164 H VAL 102 H VAL 102 29.713 14.667 5.379
165 HA VAL 102 HA VAL 102 31.375 15.642 6.615
166 HB VAL 102 HB VAL 102 33.529 15.864 5.477
167 HG11 VAL 102 HG11 VAL 102 32.693 13.716 6.313
168 HG12 VAL 102 HG12 VAL 102 31.940 13.388 4.737
169 HG13 VAL 102 HG13 VAL 102 33.707 13.515 4.879
170 HG21 VAL 102 HG21 VAL 102 32.786 16.694 3.222
171 HG22 VAL 102 HG22 VAL 102 33.842 15.276 3.162
172 HG23 VAL 102 HG23 VAL 102 32.102 15.089 2.904
173 H ASN 103 H ASN 103 33.216 17.729 5.146
174 HA ASN 103 HA ASN 103 31.912 20.027 6.373
175 HB2 ASN 103 HB2 ASN 103 34.028 21.143 5.985
176 HB3 ASN 103 HB3 ASN 103 34.305 19.527 6.631
177 HD21 ASN 103 HD21 ASN 103 34.361 21.446 3.614
178 HD22 ASN 103 HD22 ASN 103 35.551 20.418 2.817
179 H GLN 104 H GLN 104 30.725 18.880 3.802
180 HA GLN 104 HA GLN 104 30.648 21.420 2.236
181 HB2 GLN 104 HB2 GLN 104 31.937 19.616 1.136
182 HB3 GLN 104 HB3 GLN 104 30.507 18.584 1.153
183 HG2 GLN 104 HG2 GLN 104 30.877 19.605 -1.043
184 HG3 GLN 104 HG3 GLN 104 29.340 20.125 -0.373
185 HE21 GLN 104 HE21 GLN 104 32.662 21.185 -1.178
186 HE22 GLN 104 HE22 GLN 104 32.306 22.899 -1.018
187 H HIS 105 H HIS 105 28.778 22.045 1.239
188 HA HIS 105 HA HIS 105 26.430 21.515 2.900
189 HB2 HIS 105 HB2 HIS 105 27.030 23.665 0.834
190 HB3 HIS 105 HB3 HIS 105 25.639 23.644 1.906
191 HD1 HIS 105 HD1 HIS 105 26.292 23.859 4.654
192 HD2 HIS 105 HD2 HIS 105 29.247 24.711 1.777
193 HE1 HIS 105 HE1 HIS 105 28.083 25.228 5.845
194 H LEU 106 H LEU 106 24.301 21.565 2.077
195 HA LEU 106 HA LEU 106 23.725 20.764 -0.720
196 HB2 LEU 106 HB2 LEU 106 22.779 19.315 1.788
197 HB3 LEU 106 HB3 LEU 106 22.007 19.135 0.224
198 HG LEU 106 HG LEU 106 24.942 18.450 0.671
199 HD11 LEU 106 HD11 LEU 106 23.632 17.083 2.163
200 HD12 LEU 106 HD12 LEU 106 24.136 16.091 0.780
201 HD13 LEU 106 HD13 LEU 106 22.473 16.708 0.876
202 HD21 LEU 106 HD21 LEU 106 24.286 18.789 -1.692
203 HD22 LEU 106 HD22 LEU 106 22.941 17.640 -1.484
204 HD23 LEU 106 HD23 LEU 106 24.623 17.092 -1.362
205 H CYS 107 H CYS 107 22.042 21.941 -1.479
206 HA CYS 107 HA CYS 107 20.222 23.352 0.434
207 HB2 CYS 107 HB2 CYS 107 21.548 24.404 -2.082
208 HB3 CYS 107 HB3 CYS 107 20.336 25.277 -1.148
209 H GLY 108 H GLY 108 18.082 23.531 -0.167
210 HA2 GLY 108 HA2 GLY 108 16.091 23.041 -1.226
211 HA3 GLY 108 HA3 GLY 108 16.947 23.594 -2.656
212 H SER 109 H SER 109 16.479 22.227 -4.274
213 HA SER 109 HA SER 109 15.589 19.588 -4.130
214 HB2 SER 109 HB2 SER 109 17.121 20.877 -6.424
215 HB3 SER 109 HB3 SER 109 16.029 19.482 -6.522
216 HG SER 109 HG SER 109 14.984 21.435 -7.115
217 H HIS 110 H HIS 110 18.990 20.676 -4.091
218 HA HIS 110 HA HIS 110 20.096 18.087 -4.723
219 HB2 HIS 110 HB2 HIS 110 21.198 20.427 -4.880
220 HB3 HIS 110 HB3 HIS 110 21.463 20.285 -3.135
221 HD1 HIS 110 HD1 HIS 110 24.098 20.536 -4.252
222 HD2 HIS 110 HD2 HIS 110 21.999 16.914 -4.624
223 HE1 HIS 110 HE1 HIS 110 25.850 18.745 -4.727
224 H LEU 111 H LEU 111 19.126 19.717 -1.722
225 HA LEU 111 HA LEU 111 20.161 17.718 0.109
226 HB2 LEU 111 HB2 LEU 111 19.528 20.210 0.482
227 HB3 LEU 111 HB3 LEU 111 17.869 19.639 0.613
228 HG LEU 111 HG LEU 111 20.215 18.848 2.410
229 HD11 LEU 111 HD11 LEU 111 19.416 21.170 2.663
230 HD12 LEU 111 HD12 LEU 111 19.006 20.193 4.078
231 HD13 LEU 111 HD13 LEU 111 17.752 20.561 2.875
232 HD21 LEU 111 HD21 LEU 111 17.263 18.089 2.579
233 HD22 LEU 111 HD22 LEU 111 18.403 17.954 3.929
234 HD23 LEU 111 HD23 LEU 111 18.661 16.985 2.485
235 H VAL 112 H VAL 112 16.951 18.323 -1.413
236 HA VAL 112 HA VAL 112 15.651 16.038 -0.265
237 HB VAL 112 HB VAL 112 15.034 17.415 -2.904
238 HG11 VAL 112 HG11 VAL 112 13.910 15.227 -2.787
239 HG12 VAL 112 HG12 VAL 112 13.330 15.586 -1.150
240 HG13 VAL 112 HG13 VAL 112 12.737 16.525 -2.537
241 HG21 VAL 112 HG21 VAL 112 13.953 17.870 -0.087
242 HG22 VAL 112 HG22 VAL 112 14.926 19.009 -1.033
243 HG23 VAL 112 HG23 VAL 112 13.296 18.604 -1.568
244 H GLU 113 H GLU 113 17.423 16.347 -3.407
245 HA GLU 113 HA GLU 113 17.112 13.623 -4.187
246 HB2 GLU 113 HB2 GLU 113 17.895 15.450 -5.649
247 HB3 GLU 113 HB3 GLU 113 19.406 15.557 -4.741
248 HG2 GLU 113 HG2 GLU 113 20.014 13.273 -5.428
249 HG3 GLU 113 HG3 GLU 113 18.439 13.066 -6.211
250 H ALA 114 H ALA 114 19.700 15.148 -2.175
251 HA ALA 114 HA ALA 114 21.194 12.765 -1.781
252 HB1 ALA 114 HB1 ALA 114 22.064 15.031 -1.434
253 HB2 ALA 114 HB2 ALA 114 20.959 15.256 -0.055
254 HB3 ALA 114 HB3 ALA 114 22.259 14.042 0.021
255 H LEU 115 H LEU 115 18.467 14.128 0.186
256 HA LEU 115 HA LEU 115 18.744 12.086 2.201
257 HB2 LEU 115 HB2 LEU 115 17.078 13.086 3.357
258 HB3 LEU 115 HB3 LEU 115 17.736 14.405 2.433
259 HG LEU 115 HG LEU 115 15.728 13.841 0.774
260 HD11 LEU 115 HD11 LEU 115 14.959 11.767 1.983
261 HD12 LEU 115 HD12 LEU 115 13.735 13.022 1.881
262 HD13 LEU 115 HD13 LEU 115 14.629 12.770 3.406
263 HD21 LEU 115 HD21 LEU 115 14.314 15.401 2.024
264 HD22 LEU 115 HD22 LEU 115 16.007 15.921 2.066
265 HD23 LEU 115 HD23 LEU 115 15.295 15.131 3.488
266 H TYR 116 H TYR 116 16.838 12.250 -0.797
267 HA TYR 116 HA TYR 116 15.566 9.674 -0.400
268 HB2 TYR 116 HB2 TYR 116 15.901 11.627 -2.628
269 HB3 TYR 116 HB3 TYR 116 15.663 9.957 -3.100
270 HD1 TYR 116 HD1 TYR 116 14.112 12.747 -1.159
271 HD2 TYR 116 HD2 TYR 116 13.576 8.819 -2.873
272 HE1 TYR 116 HE1 TYR 116 11.660 12.920 -0.790
273 HE2 TYR 116 HE2 TYR 116 11.114 9.006 -2.516
274 HH TYR 116 HH TYR 116 9.639 11.868 -0.965
275 H LEU 117 H LEU 117 18.705 10.590 -1.916
276 HA LEU 117 HA LEU 117 19.364 7.902 -2.726
277 HB2 LEU 117 HB2 LEU 117 21.015 10.383 -2.164
278 HB3 LEU 117 HB3 LEU 117 21.756 8.876 -2.671
279 HG LEU 117 HG LEU 117 19.613 10.262 -4.328
280 HD11 LEU 117 HD11 LEU 117 21.605 11.704 -4.094
281 HD12 LEU 117 HD12 LEU 117 21.464 11.058 -5.735
282 HD13 LEU 117 HD13 LEU 117 22.645 10.356 -4.603
283 HD21 LEU 117 HD21 LEU 117 19.864 7.870 -4.856
284 HD22 LEU 117 HD22 LEU 117 21.624 8.076 -5.000
285 HD23 LEU 117 HD23 LEU 117 20.522 8.868 -6.155
286 H VAL 118 H VAL 118 19.893 9.628 0.347
287 HA VAL 118 HA VAL 118 21.410 7.444 1.539
288 HB VAL 118 HB VAL 118 20.181 9.994 2.647
289 HG11 VAL 118 HG11 VAL 118 20.169 8.415 4.512
290 HG12 VAL 118 HG12 VAL 118 21.837 7.907 4.141
291 HG13 VAL 118 HG13 VAL 118 21.489 9.552 4.713
292 HG21 VAL 118 HG21 VAL 118 23.052 9.035 2.227
293 HG22 VAL 118 HG22 VAL 118 22.215 10.209 1.204
294 HG23 VAL 118 HG23 VAL 118 22.577 10.616 2.882
295 H CYS 119 H CYS 119 17.990 8.517 1.826
296 HA CYS 119 HA CYS 119 17.466 6.339 3.733
297 HB2 CYS 119 HB2 CYS 119 16.820 8.747 4.011
298 HB3 CYS 119 HB3 CYS 119 15.607 8.525 2.750
299 H GLY 120 H GLY 120 16.905 6.831 0.310
300 HA2 GLY 120 HA2 GLY 120 16.108 5.288 -1.247
301 HA3 GLY 120 HA3 GLY 120 15.567 4.224 0.049
302 H GLU 121 H GLU 121 13.560 3.899 -0.960
303 HA GLU 121 HA GLU 121 11.746 6.007 -1.719
304 HB2 GLU 121 HB2 GLU 121 10.089 4.243 -1.930
305 HB3 GLU 121 HB3 GLU 121 11.585 3.816 -2.742
306 HG2 GLU 121 HG2 GLU 121 11.085 2.808 0.083
307 HG3 GLU 121 HG3 GLU 121 10.240 2.075 -1.273
308 H ARG 122 H ARG 122 12.682 5.057 1.320
309 HA ARG 122 HA ARG 122 10.302 5.649 2.905
310 HB2 ARG 122 HB2 ARG 122 13.285 5.528 3.476
311 HB3 ARG 122 HB3 ARG 122 12.084 5.808 4.737
312 HG2 ARG 122 HG2 ARG 122 11.238 3.632 4.623
313 HG3 ARG 122 HG3 ARG 122 11.790 3.362 2.970
314 HD2 ARG 122 HD2 ARG 122 13.109 2.031 4.487
315 HD3 ARG 122 HD3 ARG 122 14.108 3.229 3.679
316 HE ARG 122 HE ARG 122 13.103 3.500 6.503
317 HH11 ARG 122 HH11 ARG 122 15.784 4.115 4.259
318 HH12 ARG 122 HH12 ARG 122 16.874 4.359 5.635
319 HH21 ARG 122 HH21 ARG 122 14.661 4.016 8.080
320 HH22 ARG 122 HH22 ARG 122 16.293 4.400 7.517
321 H GLY 123 H GLY 123 12.320 7.672 1.055
322 HA2 GLY 123 HA2 GLY 123 12.706 9.992 2.528
323 HA3 GLY 123 HA3 GLY 123 12.450 9.951 0.794
324 H PHE 124 H PHE 124 11.681 12.061 2.547
325 HA PHE 124 HA PHE 124 8.898 11.855 3.276
326 HB2 PHE 124 HB2 PHE 124 9.231 13.703 4.476
327 HB3 PHE 124 HB3 PHE 124 10.918 13.326 4.258
328 HD1 PHE 124 HD2 PHE 124 11.900 14.382 1.878
329 HD2 PHE 124 HD1 PHE 124 8.594 15.926 4.183
330 HE1 PHE 124 HE2 PHE 124 12.204 16.619 0.827
331 HE2 PHE 124 HE1 PHE 124 8.892 18.141 3.121
332 HZ PHE 124 HZ PHE 124 10.700 18.500 1.442
333 H PHE 125 H PHE 125 7.262 13.547 2.693
334 HA PHE 125 HA PHE 125 7.551 14.775 0.036
335 HB2 PHE 125 HB2 PHE 125 5.521 13.975 -0.866
336 HB3 PHE 125 HB3 PHE 125 6.425 12.564 -0.354
337 HD1 PHE 125 HD1 PHE 125 5.715 11.283 1.703
338 HD2 PHE 125 HD2 PHE 125 3.366 14.536 0.102
339 HE1 PHE 125 HE1 PHE 125 3.754 10.532 3.027
340 HE2 PHE 125 HE2 PHE 125 1.408 13.769 1.420
341 HZ PHE 125 HZ PHE 125 1.602 11.768 2.886
342 H TYR 126 H TYR 126 5.964 16.463 -0.363
343 HA TYR 126 HA TYR 126 4.729 17.645 2.074
344 HB2 TYR 126 HB2 TYR 126 5.340 19.834 1.162
345 HB3 TYR 126 HB3 TYR 126 6.740 18.863 1.560
346 HD1 TYR 126 HD1 TYR 126 4.750 20.354 -1.190
347 HD2 TYR 126 HD2 TYR 126 8.278 18.074 -0.181
348 HE1 TYR 126 HE1 TYR 126 5.628 20.688 -3.498
349 HE2 TYR 126 HE2 TYR 126 9.156 18.426 -2.489
350 HH TYR 126 HH TYR 126 8.787 19.348 -4.549
351 H THR 127 H THR 127 2.864 18.944 1.724
352 HA THR 127 HA THR 127 1.177 17.998 -0.503
353 HB THR 127 HB THR 127 -0.673 19.029 0.857
354 HG1 THR 127 HG1 THR 127 -0.077 19.429 3.065
355 HG21 THR 127 HG21 THR 127 -0.075 16.612 1.049
356 HG22 THR 127 HG22 THR 127 -0.690 17.283 2.563
357 HG23 THR 127 HG23 THR 127 1.055 17.008 2.359
358 HA PRO 128 HA PRO 128 1.065 21.800 -2.772
359 HB2 PRO 128 HB2 PRO 128 -1.948 21.568 -2.748
360 HB3 PRO 128 HB3 PRO 128 -0.853 21.870 -4.134
361 HG2 PRO 128 HG2 PRO 128 -1.884 19.401 -3.740
362 HG3 PRO 128 HG3 PRO 128 -0.144 19.579 -4.160
363 HD2 PRO 128 HD2 PRO 128 -1.388 19.155 -1.428
364 HD3 PRO 128 HD3 PRO 128 0.007 18.327 -2.181
365 H LYS 129 H LYS 129 0.397 24.038 -2.758
366 HA LYS 129 HA LYS 129 -0.938 25.107 -0.320
367 HB2 LYS 129 HB2 LYS 129 1.768 26.037 -1.394
368 HB3 LYS 129 HB3 LYS 129 0.861 26.840 -0.115
369 HG2 LYS 129 HG2 LYS 129 1.963 24.009 0.052
370 HG3 LYS 129 HG3 LYS 129 2.771 25.432 0.683
371 HD2 LYS 129 HD2 LYS 129 1.134 25.820 2.352
372 HD3 LYS 129 HD3 LYS 129 -0.042 24.730 1.624
373 HE2 LYS 129 HE2 LYS 129 2.604 23.838 2.841
374 HE3 LYS 129 HE3 LYS 129 1.039 23.806 3.664
375 HZ1 LYS 129 HZ1 LYS 129 1.333 21.642 2.739
376 HZ2 LYS 129 HZ2 LYS 129 1.788 22.209 1.277
377 HZ3 LYS 129 HZ3 LYS 129 0.251 22.378 1.756
378 H THR 130 H THR 130 -1.919 27.067 -0.530
379 HA THR 130 HA THR 130 -2.502 27.966 -3.312
380 HB THR 130 HB THR 130 -4.586 28.895 -2.285
381 HG1 THR 130 HG1 THR 130 -5.079 28.215 -0.184
382 HG21 THR 130 HG21 THR 130 -5.720 26.768 -1.993
383 HG22 THR 130 HG22 THR 130 -4.174 25.920 -1.740
384 HG23 THR 130 HG23 THR 130 -4.559 26.626 -3.324
385 H ARG 131 H ARG 131 -0.664 29.040 -0.733
386 HA ARG 131 HA ARG 131 -1.231 31.878 -0.816
387 HB2 ARG 131 HB2 ARG 131 -0.316 30.815 1.192
388 HB3 ARG 131 HB3 ARG 131 1.118 30.290 0.300
389 HG2 ARG 131 HG2 ARG 131 1.618 32.223 1.724
390 HG3 ARG 131 HG3 ARG 131 1.863 32.599 0.021
391 HD2 ARG 131 HD2 ARG 131 -0.483 33.680 0.049
392 HD3 ARG 131 HD3 ARG 131 -0.468 33.439 1.794
393 HE ARG 131 HE ARG 131 1.029 35.196 2.021
394 HH11 ARG 131 HH11 ARG 131 0.941 34.373 -1.426
395 HH12 ARG 131 HH12 ARG 131 1.768 35.850 -1.845
396 HH21 ARG 131 HH21 ARG 131 2.096 37.013 1.366
397 HH22 ARG 131 HH22 ARG 131 2.420 37.277 -0.324
Start of MODEL 18
1 H1 GLY 1 H1 GLY 1 13.998 25.610 7.398
2 H2 GLY 1 H2 GLY 1 12.403 25.888 7.643
3 H3 GLY 1 H3 GLY 1 12.931 25.436 6.154
4 HA2 GLY 1 HA2 GLY 1 13.130 23.746 8.557
5 HA3 GLY 1 HA3 GLY 1 11.836 23.610 7.353
6 H ILE 2 H ILE 2 14.456 22.097 8.290
7 HA ILE 2 HA ILE 2 15.749 20.449 7.583
8 HB ILE 2 HB ILE 2 13.924 20.399 5.174
9 HG12 ILE 2 HG12 ILE 2 12.630 20.132 7.231
10 HG13 ILE 2 HG13 ILE 2 12.689 18.639 6.323
11 HG21 ILE 2 HG21 ILE 2 15.859 19.108 4.607
12 HG22 ILE 2 HG22 ILE 2 15.892 18.309 6.192
13 HG23 ILE 2 HG23 ILE 2 14.582 17.974 5.029
14 HD11 ILE 2 HD11 ILE 2 12.896 18.210 8.722
15 HD12 ILE 2 HD12 ILE 2 14.387 17.726 7.898
16 HD13 ILE 2 HD13 ILE 2 14.336 19.238 8.825
17 H VAL 3 H VAL 3 15.361 22.600 4.771
18 HA VAL 3 HA VAL 3 17.744 21.845 3.423
19 HB VAL 3 HB VAL 3 16.141 24.421 3.389
20 HG11 VAL 3 HG11 VAL 3 17.193 24.776 1.112
21 HG12 VAL 3 HG12 VAL 3 18.312 24.986 2.454
22 HG13 VAL 3 HG13 VAL 3 18.350 23.475 1.516
23 HG21 VAL 3 HG21 VAL 3 14.899 22.419 2.654
24 HG22 VAL 3 HG22 VAL 3 15.216 23.499 1.299
25 HG23 VAL 3 HG23 VAL 3 16.188 22.025 1.500
26 H GLU 4 H GLU 4 17.262 24.403 5.826
27 HA GLU 4 HA GLU 4 19.764 25.684 5.769
28 HB2 GLU 4 HB2 GLU 4 19.186 26.466 7.991
29 HB3 GLU 4 HB3 GLU 4 17.765 26.434 6.954
30 HG2 GLU 4 HG2 GLU 4 17.352 24.042 8.065
31 HG3 GLU 4 HG3 GLU 4 18.454 24.643 9.305
32 H GLN 5 H GLN 5 18.997 22.533 7.178
33 HA GLN 5 HA GLN 5 21.173 22.258 8.987
34 HB2 GLN 5 HB2 GLN 5 19.721 20.126 7.368
35 HB3 GLN 5 HB3 GLN 5 20.713 19.846 8.784
36 HG2 GLN 5 HG2 GLN 5 18.171 21.537 8.846
37 HG3 GLN 5 HG3 GLN 5 18.230 19.819 9.186
38 HE21 GLN 5 HE21 GLN 5 19.706 19.117 11.034
39 HE22 GLN 5 HE22 GLN 5 19.856 20.246 12.387
40 H CYS 6 H CYS 6 21.105 21.965 5.484
41 HA CYS 6 HA CYS 6 24.045 21.462 5.606
42 HB2 CYS 6 HB2 CYS 6 22.347 19.567 4.746
43 HB3 CYS 6 HB3 CYS 6 22.615 20.420 3.231
44 H CYS 7 H CYS 7 21.592 23.586 4.455
45 HA CYS 7 HA CYS 7 23.260 24.690 2.314
46 HB2 CYS 7 HB2 CYS 7 20.820 24.423 2.161
47 HB3 CYS 7 HB3 CYS 7 20.599 25.620 3.436
48 H THR 8 H THR 8 22.447 25.632 5.672
49 HA THR 8 HA THR 8 24.457 27.853 5.461
50 HB THR 8 HB THR 8 23.381 28.856 7.436
51 HG1 THR 8 HG1 THR 8 21.331 28.168 8.014
52 HG21 THR 8 HG21 THR 8 22.807 29.648 5.149
53 HG22 THR 8 HG22 THR 8 21.447 29.810 6.270
54 HG23 THR 8 HG23 THR 8 21.464 28.480 5.088
55 H SER 9 H SER 9 23.341 25.083 7.357
56 HA SER 9 HA SER 9 25.962 24.964 8.800
57 HB2 SER 9 HB2 SER 9 23.782 24.736 10.055
58 HB3 SER 9 HB3 SER 9 23.524 23.210 9.202
59 HG SER 9 HG SER 9 24.603 23.020 11.277
60 H ILE 10 H ILE 10 26.325 22.253 8.997
61 HA ILE 10 HA ILE 10 26.229 21.145 6.244
62 HB ILE 10 HB ILE 10 28.439 20.010 6.591
63 HG12 ILE 10 HG12 ILE 10 30.165 21.245 7.846
64 HG13 ILE 10 HG13 ILE 10 28.925 22.226 8.635
65 HG21 ILE 10 HG21 ILE 10 29.655 21.881 5.621
66 HG22 ILE 10 HG22 ILE 10 28.003 21.824 4.984
67 HG23 ILE 10 HG23 ILE 10 28.436 23.020 6.228
68 HD11 ILE 10 HD11 ILE 10 29.108 19.187 8.856
69 HD12 ILE 10 HD12 ILE 10 29.870 20.319 9.992
70 HD13 ILE 10 HD13 ILE 10 28.112 20.290 9.852
71 H CYS 11 H CYS 11 26.250 18.905 6.030
72 HA CYS 11 HA CYS 11 24.897 17.529 8.308
73 HB2 CYS 11 HB2 CYS 11 23.363 16.598 6.699
74 HB3 CYS 11 HB3 CYS 11 23.310 18.349 6.660
75 H SER 12 H SER 12 24.686 15.104 7.891
76 HA SER 12 HA SER 12 26.729 13.845 6.212
77 HB2 SER 12 HB2 SER 12 27.842 14.229 8.439
78 HB3 SER 12 HB3 SER 12 26.622 13.174 9.171
79 HG SER 12 HG SER 12 28.604 12.104 8.534
80 H LEU 13 H LEU 13 26.443 11.390 6.409
81 HA LEU 13 HA LEU 13 23.883 10.613 5.468
82 HB2 LEU 13 HB2 LEU 13 25.990 8.897 6.849
83 HB3 LEU 13 HB3 LEU 13 24.717 8.314 5.789
84 HG LEU 13 HG LEU 13 27.064 10.075 4.948
85 HD11 LEU 13 HD11 LEU 13 26.432 7.157 4.369
86 HD12 LEU 13 HD12 LEU 13 27.678 7.750 5.489
87 HD13 LEU 13 HD13 LEU 13 27.820 8.073 3.749
88 HD21 LEU 13 HD21 LEU 13 25.078 10.528 3.534
89 HD22 LEU 13 HD22 LEU 13 24.869 8.779 3.277
90 HD23 LEU 13 HD23 LEU 13 26.294 9.612 2.630
91 H TYR 14 H TYR 14 25.216 10.557 8.728
92 HA TYR 14 HA TYR 14 23.153 9.048 9.999
93 HB2 TYR 14 HB2 TYR 14 25.076 11.059 11.219
94 HB3 TYR 14 HB3 TYR 14 24.214 9.782 12.065
95 HD1 TYR 14 HD2 TYR 14 24.672 7.317 11.376
96 HD2 TYR 14 HD1 TYR 14 27.222 10.624 10.263
97 HE1 TYR 14 HE2 TYR 14 26.528 5.729 10.899
98 HE2 TYR 14 HE1 TYR 14 29.073 9.030 9.781
99 HH TYR 14 HH TYR 14 28.696 5.487 10.204
100 H GLN 15 H GLN 15 23.119 12.320 8.938
101 HA GLN 15 HA GLN 15 20.669 12.918 10.563
102 HB2 GLN 15 HB2 GLN 15 22.591 14.824 9.169
103 HB3 GLN 15 HB3 GLN 15 21.072 15.254 9.938
104 HG2 GLN 15 HG2 GLN 15 22.641 15.779 11.567
105 HG3 GLN 15 HG3 GLN 15 21.938 14.259 12.105
106 HE21 GLN 15 HE21 GLN 15 23.890 13.942 13.450
107 HE22 GLN 15 HE22 GLN 15 25.397 13.453 12.683
108 H LEU 16 H LEU 16 22.006 12.903 7.239
109 HA LEU 16 HA LEU 16 19.676 13.763 5.858
110 HB2 LEU 16 HB2 LEU 16 21.976 11.922 5.108
111 HB3 LEU 16 HB3 LEU 16 20.731 12.373 3.959
112 HG LEU 16 HG LEU 16 22.451 14.442 5.389
113 HD11 LEU 16 HD11 LEU 16 23.877 12.972 4.034
114 HD12 LEU 16 HD12 LEU 16 23.725 14.559 3.276
115 HD13 LEU 16 HD13 LEU 16 22.801 13.180 2.640
116 HD21 LEU 16 HD21 LEU 16 20.365 15.365 4.480
117 HD22 LEU 16 HD22 LEU 16 20.668 14.582 2.919
118 HD23 LEU 16 HD23 LEU 16 21.730 15.882 3.494
119 H GLU 17 H GLU 17 20.440 10.513 7.164
120 HA GLU 17 HA GLU 17 18.192 9.217 5.914
121 HB2 GLU 17 HB2 GLU 17 20.303 8.229 7.129
122 HB3 GLU 17 HB3 GLU 17 19.341 8.402 8.595
123 HG2 GLU 17 HG2 GLU 17 17.535 7.019 7.501
124 HG3 GLU 17 HG3 GLU 17 18.571 6.857 6.078
125 H ASN 18 H ASN 18 18.421 11.266 8.777
126 HA ASN 18 HA ASN 18 15.913 10.329 9.972
127 HB2 ASN 18 HB2 ASN 18 17.787 12.629 10.693
128 HB3 ASN 18 HB3 ASN 18 16.392 12.130 11.636
129 HD21 ASN 18 HD21 ASN 18 18.663 12.191 13.005
130 HD22 ASN 18 HD22 ASN 18 19.298 10.569 13.238
131 H TYR 19 H TYR 19 16.886 13.097 7.948
132 HA TYR 19 HA TYR 19 14.519 14.627 8.349
133 HB2 TYR 19 HB2 TYR 19 16.351 14.585 5.940
134 HB3 TYR 19 HB3 TYR 19 15.233 15.877 6.385
135 HD1 TYR 19 HD1 TYR 19 15.790 16.032 9.394
136 HD2 TYR 19 HD2 TYR 19 18.409 15.762 5.967
137 HE1 TYR 19 HE1 TYR 19 17.615 17.075 10.704
138 HE2 TYR 19 HE2 TYR 19 20.238 16.806 7.292
139 HH TYR 19 HH TYR 19 20.868 17.645 9.338
140 H CYS 20 H CYS 20 14.720 11.673 6.674
141 HA CYS 20 HA CYS 20 12.424 12.117 4.920
142 HB2 CYS 20 HB2 CYS 20 13.932 9.642 5.802
143 HB3 CYS 20 HB3 CYS 20 12.562 9.616 4.700
144 H ASN 21 H ASN 21 11.565 13.136 7.199
145 HA ASN 21 HA ASN 21 10.459 11.344 9.129
146 HB2 ASN 21 HB2 ASN 21 11.086 13.649 9.622
147 HB3 ASN 21 HB3 ASN 21 9.900 14.263 8.471
148 HD21 ASN 21 HD21 ASN 21 7.619 14.129 9.017
149 HD22 ASN 21 HD22 ASN 21 7.131 13.826 10.678
150 H GLY 22 H GLY 22 8.697 10.143 9.096
151 HA2 GLY 22 HA2 GLY 22 6.599 10.310 7.036
152 HA3 GLY 22 HA3 GLY 22 6.741 9.118 8.326
153 H1 PHE 101 H1 PHE 101 31.070 10.982 5.529
154 H2 PHE 101 H2 PHE 101 31.568 12.315 6.352
155 H3 PHE 101 H3 PHE 101 32.462 11.745 5.113
156 HA PHE 101 HA PHE 101 30.748 12.273 3.529
157 HB2 PHE 101 HB2 PHE 101 28.939 11.966 5.318
158 HB3 PHE 101 HB3 PHE 101 29.290 13.612 5.825
159 HD1 PHE 101 HD1 PHE 101 28.009 11.451 3.079
160 HD2 PHE 101 HD2 PHE 101 28.464 15.501 4.493
161 HE1 PHE 101 HE1 PHE 101 26.369 12.237 1.385
162 HE2 PHE 101 HE2 PHE 101 26.820 16.279 2.808
163 HZ PHE 101 HZ PHE 101 25.755 14.641 1.261
164 H VAL 102 H VAL 102 30.480 14.535 2.638
165 HA VAL 102 HA VAL 102 32.965 15.943 3.117
166 HB VAL 102 HB VAL 102 32.017 15.509 0.878
167 HG11 VAL 102 HG11 VAL 102 30.314 16.936 -0.089
168 HG12 VAL 102 HG12 VAL 102 29.629 16.083 1.297
169 HG13 VAL 102 HG13 VAL 102 30.083 17.794 1.450
170 HG21 VAL 102 HG21 VAL 102 32.524 18.450 1.430
171 HG22 VAL 102 HG22 VAL 102 33.775 17.198 1.243
172 HG23 VAL 102 HG23 VAL 102 32.713 17.599 -0.111
173 H ASN 103 H ASN 103 33.357 18.001 3.845
174 HA ASN 103 HA ASN 103 31.326 19.212 5.611
175 HB2 ASN 103 HB2 ASN 103 33.155 20.411 6.614
176 HB3 ASN 103 HB3 ASN 103 33.492 18.689 6.549
177 HD21 ASN 103 HD21 ASN 103 35.567 20.418 7.019
178 HD22 ASN 103 HD22 ASN 103 36.599 20.480 5.598
179 H GLN 104 H GLN 104 30.632 19.481 3.033
180 HA GLN 104 HA GLN 104 30.844 22.404 2.507
181 HB2 GLN 104 HB2 GLN 104 31.081 20.195 0.415
182 HB3 GLN 104 HB3 GLN 104 30.821 21.904 0.053
183 HG2 GLN 104 HG2 GLN 104 32.954 22.481 1.222
184 HG3 GLN 104 HG3 GLN 104 33.253 20.767 1.508
185 HE21 GLN 104 HE21 GLN 104 32.949 23.259 -1.068
186 HE22 GLN 104 HE22 GLN 104 33.830 22.316 -2.261
187 H HIS 105 H HIS 105 29.046 23.325 1.386
188 HA HIS 105 HA HIS 105 26.652 22.357 2.588
189 HB2 HIS 105 HB2 HIS 105 27.145 24.693 0.713
190 HB3 HIS 105 HB3 HIS 105 25.641 24.404 1.589
191 HD1 HIS 105 HD1 HIS 105 26.202 24.118 4.482
192 HD2 HIS 105 HD2 HIS 105 28.684 26.398 1.941
193 HE1 HIS 105 HE1 HIS 105 27.527 25.693 5.988
194 H LEU 106 H LEU 106 24.660 21.910 1.763
195 HA LEU 106 HA LEU 106 24.250 21.398 -1.131
196 HB2 LEU 106 HB2 LEU 106 23.498 19.488 1.122
197 HB3 LEU 106 HB3 LEU 106 22.872 19.369 -0.520
198 HG LEU 106 HG LEU 106 25.800 19.066 0.275
199 HD11 LEU 106 HD11 LEU 106 25.430 16.688 -0.239
200 HD12 LEU 106 HD12 LEU 106 23.712 17.012 -0.569
201 HD13 LEU 106 HD13 LEU 106 24.360 17.222 1.069
202 HD21 LEU 106 HD21 LEU 106 24.394 18.658 -2.398
203 HD22 LEU 106 HD22 LEU 106 26.052 18.151 -2.037
204 HD23 LEU 106 HD23 LEU 106 25.638 19.868 -2.032
205 H CYS 107 H CYS 107 22.306 22.226 -1.818
206 HA CYS 107 HA CYS 107 20.380 23.164 0.248
207 HB2 CYS 107 HB2 CYS 107 22.208 24.856 -0.561
208 HB3 CYS 107 HB3 CYS 107 21.248 24.937 -2.032
209 H GLY 108 H GLY 108 18.281 23.645 -0.454
210 HA2 GLY 108 HA2 GLY 108 16.322 23.324 -1.623
211 HA3 GLY 108 HA3 GLY 108 17.290 23.715 -3.043
212 H SER 109 H SER 109 16.637 22.295 -4.556
213 HA SER 109 HA SER 109 15.653 19.707 -4.248
214 HB2 SER 109 HB2 SER 109 17.254 20.784 -6.605
215 HB3 SER 109 HB3 SER 109 16.115 19.423 -6.637
216 HG SER 109 HG SER 109 15.142 21.363 -7.361
217 H HIS 110 H HIS 110 19.120 20.658 -4.397
218 HA HIS 110 HA HIS 110 20.057 17.953 -4.790
219 HB2 HIS 110 HB2 HIS 110 21.226 20.272 -5.201
220 HB3 HIS 110 HB3 HIS 110 21.714 20.135 -3.510
221 HD1 HIS 110 HD1 HIS 110 22.341 16.924 -3.596
222 HD2 HIS 110 HD2 HIS 110 23.476 19.862 -6.377
223 HE1 HIS 110 HE1 HIS 110 24.389 15.993 -4.810
224 H LEU 111 H LEU 111 19.227 19.863 -1.939
225 HA LEU 111 HA LEU 111 20.388 17.992 -0.010
226 HB2 LEU 111 HB2 LEU 111 20.225 20.420 0.353
227 HB3 LEU 111 HB3 LEU 111 18.473 20.351 0.309
228 HG LEU 111 HG LEU 111 19.622 20.575 2.559
229 HD11 LEU 111 HD11 LEU 111 18.035 19.249 3.762
230 HD12 LEU 111 HD12 LEU 111 17.748 18.201 2.370
231 HD13 LEU 111 HD13 LEU 111 17.239 19.890 2.317
232 HD21 LEU 111 HD21 LEU 111 21.375 18.831 2.179
233 HD22 LEU 111 HD22 LEU 111 20.121 17.588 2.307
234 HD23 LEU 111 HD23 LEU 111 20.458 18.628 3.692
235 H VAL 112 H VAL 112 17.137 18.681 -1.345
236 HA VAL 112 HA VAL 112 15.742 16.586 0.060
237 HB VAL 112 HB VAL 112 15.152 17.805 -2.657
238 HG11 VAL 112 HG11 VAL 112 13.389 16.147 -0.797
239 HG12 VAL 112 HG12 VAL 112 12.824 17.011 -2.241
240 HG13 VAL 112 HG13 VAL 112 13.952 15.663 -2.409
241 HG21 VAL 112 HG21 VAL 112 13.479 19.145 -1.394
242 HG22 VAL 112 HG22 VAL 112 14.063 18.437 0.128
243 HG23 VAL 112 HG23 VAL 112 15.118 19.485 -0.833
244 H GLU 113 H GLU 113 17.445 16.577 -3.139
245 HA GLU 113 HA GLU 113 17.028 13.815 -3.678
246 HB2 GLU 113 HB2 GLU 113 17.791 15.477 -5.317
247 HB3 GLU 113 HB3 GLU 113 19.351 15.603 -4.495
248 HG2 GLU 113 HG2 GLU 113 19.853 13.259 -5.004
249 HG3 GLU 113 HG3 GLU 113 18.231 13.023 -5.667
250 H ALA 114 H ALA 114 19.673 15.401 -1.778
251 HA ALA 114 HA ALA 114 21.136 13.018 -1.311
252 HB1 ALA 114 HB1 ALA 114 20.919 15.515 0.414
253 HB2 ALA 114 HB2 ALA 114 22.177 14.272 0.521
254 HB3 ALA 114 HB3 ALA 114 22.039 15.270 -0.941
255 H LEU 115 H LEU 115 18.470 14.445 0.732
256 HA LEU 115 HA LEU 115 18.734 12.293 2.661
257 HB2 LEU 115 HB2 LEU 115 16.765 13.116 3.735
258 HB3 LEU 115 HB3 LEU 115 17.909 14.382 3.374
259 HG LEU 115 HG LEU 115 16.320 14.767 1.274
260 HD11 LEU 115 HD11 LEU 115 14.380 13.628 3.336
261 HD12 LEU 115 HD12 LEU 115 14.785 12.836 1.807
262 HD13 LEU 115 HD13 LEU 115 13.959 14.398 1.795
263 HD21 LEU 115 HD21 LEU 115 15.452 15.660 4.035
264 HD22 LEU 115 HD22 LEU 115 15.193 16.488 2.489
265 HD23 LEU 115 HD23 LEU 115 16.825 16.344 3.151
266 H TYR 116 H TYR 116 16.646 12.681 -0.216
267 HA TYR 116 HA TYR 116 15.242 10.198 0.087
268 HB2 TYR 116 HB2 TYR 116 15.812 12.107 -2.154
269 HB3 TYR 116 HB3 TYR 116 15.335 10.486 -2.590
270 HD1 TYR 116 HD2 TYR 116 14.212 13.354 -0.417
271 HD2 TYR 116 HD1 TYR 116 13.073 9.868 -2.672
272 HE1 TYR 116 HE2 TYR 116 11.816 13.911 -0.047
273 HE2 TYR 116 HE1 TYR 116 10.676 10.440 -2.344
274 HH TYR 116 HH TYR 116 9.173 11.919 -1.430
275 H LEU 117 H LEU 117 18.415 10.880 -1.504
276 HA LEU 117 HA LEU 117 18.795 8.176 -2.391
277 HB2 LEU 117 HB2 LEU 117 20.669 10.510 -1.881
278 HB3 LEU 117 HB3 LEU 117 21.286 8.941 -2.382
279 HG LEU 117 HG LEU 117 19.254 10.524 -4.018
280 HD11 LEU 117 HD11 LEU 117 21.174 11.064 -5.468
281 HD12 LEU 117 HD12 LEU 117 22.275 10.236 -4.354
282 HD13 LEU 117 HD13 LEU 117 21.418 11.711 -3.837
283 HD21 LEU 117 HD21 LEU 117 20.958 8.086 -4.678
284 HD22 LEU 117 HD22 LEU 117 19.971 9.004 -5.840
285 HD23 LEU 117 HD23 LEU 117 19.190 8.122 -4.528
286 H VAL 118 H VAL 118 19.704 9.782 0.681
287 HA VAL 118 HA VAL 118 21.118 7.460 1.697
288 HB VAL 118 HB VAL 118 20.065 9.940 3.094
289 HG11 VAL 118 HG11 VAL 118 21.907 7.756 4.158
290 HG12 VAL 118 HG12 VAL 118 21.569 9.310 4.953
291 HG13 VAL 118 HG13 VAL 118 20.283 8.121 4.759
292 HG21 VAL 118 HG21 VAL 118 22.849 9.015 2.234
293 HG22 VAL 118 HG22 VAL 118 21.929 10.295 1.452
294 HG23 VAL 118 HG23 VAL 118 22.484 10.523 3.115
295 H CYS 119 H CYS 119 17.736 8.633 2.272
296 HA CYS 119 HA CYS 119 17.252 6.343 4.037
297 HB2 CYS 119 HB2 CYS 119 15.320 7.448 4.678
298 HB3 CYS 119 HB3 CYS 119 16.483 8.733 4.377
299 H GLY 120 H GLY 120 16.718 6.965 0.664
300 HA2 GLY 120 HA2 GLY 120 16.065 5.387 -0.962
301 HA3 GLY 120 HA3 GLY 120 15.386 4.346 0.285
302 H GLU 121 H GLU 121 13.486 4.117 -0.968
303 HA GLU 121 HA GLU 121 11.998 6.216 -2.125
304 HB2 GLU 121 HB2 GLU 121 12.009 3.690 -2.589
305 HB3 GLU 121 HB3 GLU 121 10.873 3.530 -1.240
306 HG2 GLU 121 HG2 GLU 121 9.299 5.070 -2.447
307 HG3 GLU 121 HG3 GLU 121 10.457 5.192 -3.762
308 H ARG 122 H ARG 122 12.078 5.361 1.214
309 HA ARG 122 HA ARG 122 9.435 5.898 2.044
310 HB2 ARG 122 HB2 ARG 122 11.663 5.003 3.289
311 HB3 ARG 122 HB3 ARG 122 11.750 6.668 3.831
312 HG2 ARG 122 HG2 ARG 122 9.018 5.638 4.180
313 HG3 ARG 122 HG3 ARG 122 10.174 4.479 4.812
314 HD2 ARG 122 HD2 ARG 122 9.545 5.896 6.627
315 HD3 ARG 122 HD3 ARG 122 11.210 6.274 6.205
316 HE ARG 122 HE ARG 122 10.550 8.448 5.804
317 HH11 ARG 122 HH11 ARG 122 7.546 6.592 5.735
318 HH12 ARG 122 HH12 ARG 122 6.645 8.025 5.264
319 HH21 ARG 122 HH21 ARG 122 9.320 10.054 4.969
320 HH22 ARG 122 HH22 ARG 122 7.572 9.864 4.955
321 H GLY 123 H GLY 123 12.104 8.178 1.605
322 HA2 GLY 123 HA2 GLY 123 12.160 10.466 1.265
323 HA3 GLY 123 HA3 GLY 123 10.572 10.195 0.553
324 H PHE 124 H PHE 124 9.910 12.299 1.136
325 HA PHE 124 HA PHE 124 9.503 12.967 3.994
326 HB2 PHE 124 HB2 PHE 124 8.524 14.288 1.442
327 HB3 PHE 124 HB3 PHE 124 8.264 14.901 3.063
328 HD1 PHE 124 HD1 PHE 124 11.189 14.414 4.157
329 HD2 PHE 124 HD2 PHE 124 9.594 16.202 0.558
330 HE1 PHE 124 HE1 PHE 124 13.043 16.008 4.123
331 HE2 PHE 124 HE2 PHE 124 11.497 17.781 0.513
332 HZ PHE 124 HZ PHE 124 13.212 17.717 2.315
333 H PHE 125 H PHE 125 7.600 12.823 5.097
334 HA PHE 125 HA PHE 125 5.620 12.022 5.755
335 HB2 PHE 125 HB2 PHE 125 4.765 13.399 3.214
336 HB3 PHE 125 HB3 PHE 125 3.749 13.090 4.624
337 HD1 PHE 125 HD1 PHE 125 4.785 14.013 6.940
338 HD2 PHE 125 HD2 PHE 125 5.729 15.532 3.020
339 HE1 PHE 125 HE1 PHE 125 5.549 16.143 7.952
340 HE2 PHE 125 HE2 PHE 125 6.508 17.662 4.037
341 HZ PHE 125 HZ PHE 125 6.429 17.969 6.499
342 H TYR 126 H TYR 126 3.753 11.536 3.006
343 HA TYR 126 HA TYR 126 4.381 8.684 2.662
344 HB2 TYR 126 HB2 TYR 126 2.973 8.666 4.656
345 HB3 TYR 126 HB3 TYR 126 1.777 9.690 3.873
346 HD1 TYR 126 HD1 TYR 126 3.406 6.311 3.695
347 HD2 TYR 126 HD2 TYR 126 0.013 8.738 2.573
348 HE1 TYR 126 HE1 TYR 126 2.247 4.292 2.820
349 HE2 TYR 126 HE2 TYR 126 -1.139 6.706 1.693
350 HH TYR 126 HH TYR 126 0.363 3.461 1.819
351 H THR 127 H THR 127 3.263 7.720 0.879
352 HA THR 127 HA THR 127 1.499 9.380 -0.743
353 HB THR 127 HB THR 127 3.655 9.879 -1.723
354 HG1 THR 127 HG1 THR 127 3.028 9.401 -3.809
355 HG21 THR 127 HG21 THR 127 4.866 7.727 -1.286
356 HG22 THR 127 HG22 THR 127 4.955 8.267 -2.974
357 HG23 THR 127 HG23 THR 127 3.854 6.948 -2.527
358 HA PRO 128 HA PRO 128 -0.622 5.497 -0.665
359 HB2 PRO 128 HB2 PRO 128 -1.908 6.411 -3.241
360 HB3 PRO 128 HB3 PRO 128 -2.667 5.720 -1.771
361 HG2 PRO 128 HG2 PRO 128 -2.744 8.386 -2.201
362 HG3 PRO 128 HG3 PRO 128 -2.359 7.761 -0.564
363 HD2 PRO 128 HD2 PRO 128 -0.438 8.752 -2.694
364 HD3 PRO 128 HD3 PRO 128 -0.505 9.126 -0.943
365 H LYS 129 H LYS 129 -0.780 3.466 -1.599
366 HA LYS 129 HA LYS 129 0.606 2.882 -4.181
367 HB2 LYS 129 HB2 LYS 129 0.897 1.357 -1.554
368 HB3 LYS 129 HB3 LYS 129 1.438 0.746 -3.112
369 HG2 LYS 129 HG2 LYS 129 2.518 3.257 -1.764
370 HG3 LYS 129 HG3 LYS 129 3.265 1.663 -1.764
371 HD2 LYS 129 HD2 LYS 129 3.377 1.781 -4.305
372 HD3 LYS 129 HD3 LYS 129 2.781 3.438 -4.191
373 HE2 LYS 129 HE2 LYS 129 5.124 3.612 -4.420
374 HE3 LYS 129 HE3 LYS 129 4.760 4.014 -2.739
375 HZ1 LYS 129 HZ1 LYS 129 5.508 1.805 -2.098
376 HZ2 LYS 129 HZ2 LYS 129 6.680 2.483 -3.017
377 HZ3 LYS 129 HZ3 LYS 129 5.709 1.345 -3.658
378 H THR 130 H THR 130 -0.088 0.991 -5.260
379 HA THR 130 HA THR 130 -2.951 0.516 -5.132
380 HB THR 130 HB THR 130 -2.440 -1.186 -6.928
381 HG1 THR 130 HG1 THR 130 -0.360 -1.130 -7.796
382 HG21 THR 130 HG21 THR 130 -1.327 1.619 -7.394
383 HG22 THR 130 HG22 THR 130 -3.045 1.156 -7.470
384 HG23 THR 130 HG23 THR 130 -1.901 0.487 -8.639
385 H ARG 131 H ARG 131 -4.005 -1.478 -4.834
386 HA ARG 131 HA ARG 131 -2.682 -3.501 -3.059
387 HB2 ARG 131 HB2 ARG 131 -5.495 -2.366 -2.827
388 HB3 ARG 131 HB3 ARG 131 -4.868 -3.704 -1.880
389 HG2 ARG 131 HG2 ARG 131 -3.831 -0.828 -1.733
390 HG3 ARG 131 HG3 ARG 131 -5.013 -1.553 -0.658
391 HD2 ARG 131 HD2 ARG 131 -2.977 -1.617 0.519
392 HD3 ARG 131 HD3 ARG 131 -3.281 -3.284 0.003
393 HE ARG 131 HE ARG 131 -1.695 -1.969 -1.971
394 HH11 ARG 131 HH11 ARG 131 -1.229 -3.187 1.276
395 HH12 ARG 131 HH12 ARG 131 0.471 -3.469 1.000
396 HH21 ARG 131 HH21 ARG 131 0.348 -2.348 -2.271
397 HH22 ARG 131 HH22 ARG 131 1.372 -2.985 -0.998
Start of MODEL 19
1 H1 GLY 1 H1 GLY 1 12.687 26.009 6.535
2 H2 GLY 1 H2 GLY 1 13.858 25.945 7.680
3 H3 GLY 1 H3 GLY 1 12.302 26.256 8.111
4 HA2 GLY 1 HA2 GLY 1 12.862 24.002 8.677
5 HA3 GLY 1 HA3 GLY 1 11.624 24.045 7.405
6 H ILE 2 H ILE 2 14.227 22.457 8.289
7 HA ILE 2 HA ILE 2 15.768 21.157 7.582
8 HB ILE 2 HB ILE 2 14.019 19.897 6.627
9 HG12 ILE 2 HG12 ILE 2 15.218 18.544 4.983
10 HG13 ILE 2 HG13 ILE 2 16.416 19.818 4.761
11 HG21 ILE 2 HG21 ILE 2 14.455 21.356 3.990
12 HG22 ILE 2 HG22 ILE 2 13.514 19.864 4.203
13 HG23 ILE 2 HG23 ILE 2 12.979 21.339 4.988
14 HD11 ILE 2 HD11 ILE 2 17.245 19.483 7.042
15 HD12 ILE 2 HD12 ILE 2 15.879 18.425 7.407
16 HD13 ILE 2 HD13 ILE 2 17.123 17.911 6.245
17 H VAL 3 H VAL 3 15.368 23.647 5.075
18 HA VAL 3 HA VAL 3 17.894 23.358 3.816
19 HB VAL 3 HB VAL 3 16.266 25.883 4.286
20 HG11 VAL 3 HG11 VAL 3 18.446 25.285 2.225
21 HG12 VAL 3 HG12 VAL 3 17.398 26.721 2.218
22 HG13 VAL 3 HG13 VAL 3 18.536 26.481 3.542
23 HG21 VAL 3 HG21 VAL 3 14.964 24.158 3.103
24 HG22 VAL 3 HG22 VAL 3 15.429 25.436 1.977
25 HG23 VAL 3 HG23 VAL 3 16.311 23.894 1.972
26 H GLU 4 H GLU 4 17.082 25.161 6.802
27 HA GLU 4 HA GLU 4 19.713 26.255 7.159
28 HB2 GLU 4 HB2 GLU 4 18.957 27.064 9.206
29 HB3 GLU 4 HB3 GLU 4 17.613 27.195 8.096
30 HG2 GLU 4 HG2 GLU 4 18.005 25.059 10.235
31 HG3 GLU 4 HG3 GLU 4 16.955 26.462 10.371
32 H GLN 5 H GLN 5 18.824 22.998 7.472
33 HA GLN 5 HA GLN 5 20.726 22.374 9.648
34 HB2 GLN 5 HB2 GLN 5 19.269 20.476 7.781
35 HB3 GLN 5 HB3 GLN 5 20.056 20.079 9.294
36 HG2 GLN 5 HG2 GLN 5 17.558 21.792 8.968
37 HG3 GLN 5 HG3 GLN 5 17.603 20.141 9.539
38 HE21 GLN 5 HE21 GLN 5 16.790 22.886 10.787
39 HE22 GLN 5 HE22 GLN 5 17.587 22.792 12.363
40 H CYS 6 H CYS 6 20.705 22.485 6.152
41 HA CYS 6 HA CYS 6 23.439 21.242 6.018
42 HB2 CYS 6 HB2 CYS 6 20.977 20.829 4.306
43 HB3 CYS 6 HB3 CYS 6 22.577 20.277 3.850
44 H CYS 7 H CYS 7 21.474 23.934 4.821
45 HA CYS 7 HA CYS 7 23.264 24.357 2.539
46 HB2 CYS 7 HB2 CYS 7 20.807 24.602 2.442
47 HB3 CYS 7 HB3 CYS 7 20.912 25.983 3.526
48 H THR 8 H THR 8 22.544 26.077 5.604
49 HA THR 8 HA THR 8 24.541 28.138 5.107
50 HB THR 8 HB THR 8 22.448 28.514 6.371
51 HG1 THR 8 HG1 THR 8 24.081 29.969 6.629
52 HG21 THR 8 HG21 THR 8 23.819 27.074 8.684
53 HG22 THR 8 HG22 THR 8 22.445 26.429 7.759
54 HG23 THR 8 HG23 THR 8 22.255 27.914 8.706
55 H SER 9 H SER 9 24.597 25.032 6.699
56 HA SER 9 HA SER 9 27.519 25.210 7.179
57 HB2 SER 9 HB2 SER 9 25.477 24.292 9.246
58 HB3 SER 9 HB3 SER 9 27.237 24.076 9.371
59 HG SER 9 HG SER 9 26.487 25.942 10.509
60 H ILE 10 H ILE 10 28.545 23.121 7.231
61 HA ILE 10 HA ILE 10 27.521 21.260 5.396
62 HB ILE 10 HB ILE 10 29.351 19.838 5.891
63 HG12 ILE 10 HG12 ILE 10 29.399 19.692 8.294
64 HG13 ILE 10 HG13 ILE 10 30.968 20.091 7.640
65 HG21 ILE 10 HG21 ILE 10 29.887 21.775 4.594
66 HG22 ILE 10 HG22 ILE 10 30.214 22.754 6.040
67 HG23 ILE 10 HG23 ILE 10 31.259 21.384 5.641
68 HD11 ILE 10 HD11 ILE 10 30.644 22.475 8.334
69 HD12 ILE 10 HD12 ILE 10 29.109 21.996 9.107
70 HD13 ILE 10 HD13 ILE 10 30.635 21.323 9.676
71 H CYS 11 H CYS 11 26.830 19.087 5.539
72 HA CYS 11 HA CYS 11 26.066 18.006 8.164
73 HB2 CYS 11 HB2 CYS 11 23.775 17.813 7.800
74 HB3 CYS 11 HB3 CYS 11 24.151 19.445 7.269
75 H SER 12 H SER 12 25.058 15.753 7.879
76 HA SER 12 HA SER 12 26.629 14.237 5.837
77 HB2 SER 12 HB2 SER 12 26.198 13.506 8.749
78 HB3 SER 12 HB3 SER 12 27.151 12.595 7.557
79 HG SER 12 HG SER 12 28.405 13.976 8.961
80 H LEU 13 H LEU 13 25.865 12.126 5.255
81 HA LEU 13 HA LEU 13 23.074 11.934 4.803
82 HB2 LEU 13 HB2 LEU 13 25.182 9.747 4.845
83 HB3 LEU 13 HB3 LEU 13 23.559 9.568 4.187
84 HG LEU 13 HG LEU 13 25.682 11.475 3.138
85 HD11 LEU 13 HD11 LEU 13 26.150 9.092 2.677
86 HD12 LEU 13 HD12 LEU 13 25.739 9.972 1.197
87 HD13 LEU 13 HD13 LEU 13 24.539 8.909 1.960
88 HD21 LEU 13 HD21 LEU 13 23.469 12.423 2.703
89 HD22 LEU 13 HD22 LEU 13 22.893 10.871 2.066
90 HD23 LEU 13 HD23 LEU 13 24.150 11.791 1.205
91 H TYR 14 H TYR 14 24.970 10.572 7.476
92 HA TYR 14 HA TYR 14 22.980 9.048 8.786
93 HB2 TYR 14 HB2 TYR 14 25.369 9.057 9.345
94 HB3 TYR 14 HB3 TYR 14 25.264 10.728 9.899
95 HD1 TYR 14 HD2 TYR 14 24.085 7.244 10.596
96 HD2 TYR 14 HD1 TYR 14 24.625 11.238 12.149
97 HE1 TYR 14 HE2 TYR 14 23.538 6.437 12.894
98 HE2 TYR 14 HE1 TYR 14 24.083 10.431 14.426
99 HH TYR 14 HH TYR 14 23.497 8.630 15.729
100 H GLN 15 H GLN 15 23.389 12.573 8.722
101 HA GLN 15 HA GLN 15 21.319 13.025 10.793
102 HB2 GLN 15 HB2 GLN 15 22.855 15.002 9.063
103 HB3 GLN 15 HB3 GLN 15 21.786 15.414 10.391
104 HG2 GLN 15 HG2 GLN 15 24.394 13.843 10.653
105 HG3 GLN 15 HG3 GLN 15 24.197 15.554 10.981
106 HE21 GLN 15 HE21 GLN 15 25.266 14.123 12.993
107 HE22 GLN 15 HE22 GLN 15 24.082 13.889 14.274
108 H LEU 16 H LEU 16 21.692 13.157 7.242
109 HA LEU 16 HA LEU 16 19.159 14.412 6.716
110 HB2 LEU 16 HB2 LEU 16 21.108 12.765 5.098
111 HB3 LEU 16 HB3 LEU 16 19.606 13.324 4.395
112 HG LEU 16 HG LEU 16 21.442 15.334 5.763
113 HD11 LEU 16 HD11 LEU 16 21.622 14.269 2.930
114 HD12 LEU 16 HD12 LEU 16 22.886 14.228 4.183
115 HD13 LEU 16 HD13 LEU 16 22.393 15.775 3.488
116 HD21 LEU 16 HD21 LEU 16 19.488 15.511 3.424
117 HD22 LEU 16 HD22 LEU 16 20.370 16.856 4.148
118 HD23 LEU 16 HD23 LEU 16 19.130 16.027 5.091
119 H GLU 17 H GLU 17 20.098 11.078 7.328
120 HA GLU 17 HA GLU 17 17.792 9.709 6.530
121 HB2 GLU 17 HB2 GLU 17 20.024 8.826 7.412
122 HB3 GLU 17 HB3 GLU 17 19.392 9.114 9.039
123 HG2 GLU 17 HG2 GLU 17 17.495 7.554 8.520
124 HG3 GLU 17 HG3 GLU 17 18.166 7.305 6.908
125 H ASN 18 H ASN 18 18.092 11.957 9.200
126 HA ASN 18 HA ASN 18 15.883 11.065 10.795
127 HB2 ASN 18 HB2 ASN 18 17.827 12.619 11.411
128 HB3 ASN 18 HB3 ASN 18 16.995 13.889 10.515
129 HD21 ASN 18 HD21 ASN 18 16.752 11.671 13.297
130 HD22 ASN 18 HD22 ASN 18 15.600 12.665 14.171
131 H TYR 19 H TYR 19 15.993 12.857 7.800
132 HA TYR 19 HA TYR 19 13.210 13.870 8.130
133 HB2 TYR 19 HB2 TYR 19 15.302 14.723 6.105
134 HB3 TYR 19 HB3 TYR 19 13.810 15.557 6.513
135 HD1 TYR 19 HD2 TYR 19 13.507 16.357 8.981
136 HD2 TYR 19 HD1 TYR 19 17.305 15.244 7.275
137 HE1 TYR 19 HE2 TYR 19 14.688 17.558 10.824
138 HE2 TYR 19 HE1 TYR 19 18.488 16.431 9.122
139 HH TYR 19 HH TYR 19 16.711 18.130 11.738
140 H CYS 20 H CYS 20 14.529 11.165 6.826
141 HA CYS 20 HA CYS 20 12.641 11.114 4.517
142 HB2 CYS 20 HB2 CYS 20 14.140 9.814 3.306
143 HB3 CYS 20 HB3 CYS 20 15.030 11.167 3.957
144 H ASN 21 H ASN 21 11.930 8.973 3.871
145 HA ASN 21 HA ASN 21 10.408 7.775 6.009
146 HB2 ASN 21 HB2 ASN 21 9.559 8.314 3.748
147 HB3 ASN 21 HB3 ASN 21 10.718 7.196 3.045
148 HD21 ASN 21 HD21 ASN 21 8.716 6.383 2.048
149 HD22 ASN 21 HD22 ASN 21 7.775 5.185 2.942
150 H GLY 22 H GLY 22 12.242 6.964 7.294
151 HA2 GLY 22 HA2 GLY 22 13.651 4.524 6.474
152 HA3 GLY 22 HA3 GLY 22 13.653 5.256 8.076
153 H1 PHE 101 H1 PHE 101 32.455 12.292 8.130
154 H2 PHE 101 H2 PHE 101 33.544 11.502 7.210
155 H3 PHE 101 H3 PHE 101 32.176 10.738 7.684
156 HA PHE 101 HA PHE 101 32.001 11.349 5.384
157 HB2 PHE 101 HB2 PHE 101 29.974 11.366 6.897
158 HB3 PHE 101 HB3 PHE 101 30.198 13.100 7.091
159 HD1 PHE 101 HD1 PHE 101 29.667 10.417 4.508
160 HD2 PHE 101 HD2 PHE 101 29.186 14.591 5.508
161 HE1 PHE 101 HE1 PHE 101 28.364 10.777 2.419
162 HE2 PHE 101 HE2 PHE 101 27.885 14.939 3.429
163 HZ PHE 101 HZ PHE 101 27.480 13.035 1.874
164 H VAL 102 H VAL 102 31.603 13.225 3.849
165 HA VAL 102 HA VAL 102 33.887 15.012 3.953
166 HB VAL 102 HB VAL 102 32.977 15.881 1.793
167 HG11 VAL 102 HG11 VAL 102 33.295 12.856 1.968
168 HG12 VAL 102 HG12 VAL 102 33.494 13.864 0.518
169 HG13 VAL 102 HG13 VAL 102 34.613 14.047 1.879
170 HG21 VAL 102 HG21 VAL 102 30.919 13.637 2.013
171 HG22 VAL 102 HG22 VAL 102 30.541 15.356 2.220
172 HG23 VAL 102 HG23 VAL 102 31.160 14.768 0.668
173 H ASN 103 H ASN 103 33.903 17.284 3.746
174 HA ASN 103 HA ASN 103 31.995 18.654 5.496
175 HB2 ASN 103 HB2 ASN 103 33.569 20.494 5.391
176 HB3 ASN 103 HB3 ASN 103 34.358 18.986 5.823
177 HD21 ASN 103 HD21 ASN 103 35.779 21.260 4.915
178 HD22 ASN 103 HD22 ASN 103 36.491 20.836 3.366
179 H GLN 104 H GLN 104 30.362 18.002 3.772
180 HA GLN 104 HA GLN 104 30.237 19.891 1.480
181 HB2 GLN 104 HB2 GLN 104 30.311 17.472 1.032
182 HB3 GLN 104 HB3 GLN 104 28.829 17.243 1.965
183 HG2 GLN 104 HG2 GLN 104 28.365 17.225 -0.433
184 HG3 GLN 104 HG3 GLN 104 27.568 18.588 0.325
185 HE21 GLN 104 HE21 GLN 104 27.654 20.397 -1.010
186 HE22 GLN 104 HE22 GLN 104 29.045 20.791 -2.025
187 H HIS 105 H HIS 105 28.659 21.314 1.165
188 HA HIS 105 HA HIS 105 26.394 21.586 3.081
189 HB2 HIS 105 HB2 HIS 105 27.400 23.355 0.815
190 HB3 HIS 105 HB3 HIS 105 25.945 23.668 1.751
191 HD1 HIS 105 HD1 HIS 105 26.352 25.440 3.547
192 HD2 HIS 105 HD2 HIS 105 29.761 23.171 2.595
193 HE1 HIS 105 HE1 HIS 105 28.255 26.379 4.969
194 H LEU 106 H LEU 106 24.288 21.213 2.443
195 HA LEU 106 HA LEU 106 23.731 20.477 -0.402
196 HB2 LEU 106 HB2 LEU 106 22.594 19.045 2.045
197 HB3 LEU 106 HB3 LEU 106 21.976 18.929 0.418
198 HG LEU 106 HG LEU 106 23.130 16.968 0.784
199 HD11 LEU 106 HD11 LEU 106 25.113 18.619 -0.809
200 HD12 LEU 106 HD12 LEU 106 23.546 18.051 -1.418
201 HD13 LEU 106 HD13 LEU 106 24.784 16.882 -0.930
202 HD21 LEU 106 HD21 LEU 106 25.421 16.705 1.499
203 HD22 LEU 106 HD22 LEU 106 24.495 17.579 2.717
204 HD23 LEU 106 HD23 LEU 106 25.624 18.454 1.674
205 H CYS 107 H CYS 107 22.059 21.578 -1.283
206 HA CYS 107 HA CYS 107 20.171 23.030 0.484
207 HB2 CYS 107 HB2 CYS 107 22.343 24.325 -0.224
208 HB3 CYS 107 HB3 CYS 107 21.547 24.455 -1.787
209 H GLY 108 H GLY 108 18.198 23.621 -0.508
210 HA2 GLY 108 HA2 GLY 108 16.349 23.259 -1.851
211 HA3 GLY 108 HA3 GLY 108 17.467 23.562 -3.174
212 H SER 109 H SER 109 16.958 22.102 -4.694
213 HA SER 109 HA SER 109 15.864 19.549 -4.435
214 HB2 SER 109 HB2 SER 109 17.797 20.499 -6.587
215 HB3 SER 109 HB3 SER 109 16.612 19.182 -6.734
216 HG SER 109 HG SER 109 15.824 21.149 -7.638
217 H HIS 110 H HIS 110 19.350 20.412 -4.155
218 HA HIS 110 HA HIS 110 20.240 17.671 -4.412
219 HB2 HIS 110 HB2 HIS 110 21.475 19.956 -4.786
220 HB3 HIS 110 HB3 HIS 110 21.810 19.860 -3.051
221 HD1 HIS 110 HD1 HIS 110 22.289 16.539 -3.215
222 HD2 HIS 110 HD2 HIS 110 23.942 19.639 -5.511
223 HE1 HIS 110 HE1 HIS 110 24.475 15.610 -4.182
224 H LEU 111 H LEU 111 19.125 19.644 -1.741
225 HA LEU 111 HA LEU 111 20.011 17.891 0.415
226 HB2 LEU 111 HB2 LEU 111 19.363 20.440 0.379
227 HB3 LEU 111 HB3 LEU 111 17.715 19.869 0.533
228 HG LEU 111 HG LEU 111 20.005 19.352 2.482
229 HD11 LEU 111 HD11 LEU 111 18.712 20.870 3.953
230 HD12 LEU 111 HD12 LEU 111 17.530 21.131 2.651
231 HD13 LEU 111 HD13 LEU 111 19.210 21.690 2.457
232 HD21 LEU 111 HD21 LEU 111 18.416 17.506 2.630
233 HD22 LEU 111 HD22 LEU 111 17.051 18.646 2.712
234 HD23 LEU 111 HD23 LEU 111 18.253 18.544 4.027
235 H VAL 112 H VAL 112 16.956 18.438 -1.382
236 HA VAL 112 HA VAL 112 15.454 16.283 -0.250
237 HB VAL 112 HB VAL 112 15.266 17.439 -3.062
238 HG11 VAL 112 HG11 VAL 112 12.919 16.609 -2.973
239 HG12 VAL 112 HG12 VAL 112 14.069 15.280 -2.899
240 HG13 VAL 112 HG13 VAL 112 13.257 15.828 -1.416
241 HG21 VAL 112 HG21 VAL 112 14.940 19.191 -1.355
242 HG22 VAL 112 HG22 VAL 112 13.400 18.781 -2.107
243 HG23 VAL 112 HG23 VAL 112 13.791 18.146 -0.492
244 H GLU 113 H GLU 113 17.591 16.286 -3.189
245 HA GLU 113 HA GLU 113 17.327 13.524 -3.755
246 HB2 GLU 113 HB2 GLU 113 18.389 15.157 -5.269
247 HB3 GLU 113 HB3 GLU 113 19.764 15.301 -4.162
248 HG2 GLU 113 HG2 GLU 113 20.322 12.908 -4.506
249 HG3 GLU 113 HG3 GLU 113 18.875 12.700 -5.492
250 H ALA 114 H ALA 114 19.712 15.123 -1.526
251 HA ALA 114 HA ALA 114 21.062 12.692 -0.946
252 HB1 ALA 114 HB1 ALA 114 20.912 15.224 0.729
253 HB2 ALA 114 HB2 ALA 114 22.170 13.954 0.780
254 HB3 ALA 114 HB3 ALA 114 21.995 14.964 -0.655
255 H LEU 115 H LEU 115 18.245 14.194 0.755
256 HA LEU 115 HA LEU 115 18.291 12.097 2.792
257 HB2 LEU 115 HB2 LEU 115 16.439 13.076 3.795
258 HB3 LEU 115 HB3 LEU 115 17.496 14.357 3.263
259 HG LEU 115 HG LEU 115 15.851 14.381 1.148
260 HD11 LEU 115 HD11 LEU 115 13.522 13.996 1.814
261 HD12 LEU 115 HD12 LEU 115 14.047 13.407 3.406
262 HD13 LEU 115 HD13 LEU 115 14.417 12.479 1.948
263 HD21 LEU 115 HD21 LEU 115 15.107 15.600 3.833
264 HD22 LEU 115 HD22 LEU 115 14.598 16.154 2.224
265 HD23 LEU 115 HD23 LEU 115 16.297 16.249 2.688
266 H TYR 116 H TYR 116 16.652 12.478 -0.348
267 HA TYR 116 HA TYR 116 15.027 10.091 -0.111
268 HB2 TYR 116 HB2 TYR 116 16.094 11.753 -2.400
269 HB3 TYR 116 HB3 TYR 116 15.471 10.157 -2.729
270 HD1 TYR 116 HD1 TYR 116 14.218 12.896 -0.431
271 HD2 TYR 116 HD2 TYR 116 13.431 10.303 -3.786
272 HE1 TYR 116 HE1 TYR 116 11.896 13.749 -0.542
273 HE2 TYR 116 HE2 TYR 116 11.104 11.172 -3.908
274 HH TYR 116 HH TYR 116 9.543 12.590 -2.983
275 H LEU 117 H LEU 117 18.331 10.673 -1.329
276 HA LEU 117 HA LEU 117 18.837 8.038 -2.165
277 HB2 LEU 117 HB2 LEU 117 19.985 10.065 -2.967
278 HB3 LEU 117 HB3 LEU 117 20.726 10.284 -1.376
279 HG LEU 117 HG LEU 117 22.030 8.210 -1.692
280 HD11 LEU 117 HD11 LEU 117 20.752 8.153 -4.465
281 HD12 LEU 117 HD12 LEU 117 20.560 6.922 -3.192
282 HD13 LEU 117 HD13 LEU 117 22.142 7.165 -3.943
283 HD21 LEU 117 HD21 LEU 117 22.929 10.398 -2.398
284 HD22 LEU 117 HD22 LEU 117 22.243 10.163 -4.016
285 HD23 LEU 117 HD23 LEU 117 23.528 9.086 -3.427
286 H VAL 118 H VAL 118 19.572 9.557 1.051
287 HA VAL 118 HA VAL 118 20.907 7.166 1.983
288 HB VAL 118 HB VAL 118 21.245 9.405 2.985
289 HG11 VAL 118 HG11 VAL 118 18.675 8.883 4.512
290 HG12 VAL 118 HG12 VAL 118 19.798 10.252 4.693
291 HG13 VAL 118 HG13 VAL 118 18.858 10.073 3.213
292 HG21 VAL 118 HG21 VAL 118 21.559 8.557 5.253
293 HG22 VAL 118 HG22 VAL 118 20.475 7.201 4.940
294 HG23 VAL 118 HG23 VAL 118 22.014 7.329 4.069
295 H CYS 119 H CYS 119 17.503 8.100 1.845
296 HA CYS 119 HA CYS 119 16.693 5.517 3.069
297 HB2 CYS 119 HB2 CYS 119 15.218 7.992 2.200
298 HB3 CYS 119 HB3 CYS 119 14.379 6.463 2.393
299 H GLY 120 H GLY 120 18.145 5.902 0.333
300 HA2 GLY 120 HA2 GLY 120 18.293 4.660 -1.589
301 HA3 GLY 120 HA3 GLY 120 16.930 3.673 -1.051
302 H GLU 121 H GLU 121 14.826 4.355 -1.510
303 HA GLU 121 HA GLU 121 14.373 6.557 -3.477
304 HB2 GLU 121 HB2 GLU 121 13.385 3.690 -3.784
305 HB3 GLU 121 HB3 GLU 121 12.915 5.051 -4.806
306 HG2 GLU 121 HG2 GLU 121 15.284 5.338 -5.520
307 HG3 GLU 121 HG3 GLU 121 15.721 3.902 -4.579
308 H ARG 122 H ARG 122 13.598 5.511 -0.489
309 HA ARG 122 HA ARG 122 10.709 5.300 -0.632
310 HB2 ARG 122 HB2 ARG 122 12.615 5.455 1.729
311 HB3 ARG 122 HB3 ARG 122 10.893 5.105 1.850
312 HG2 ARG 122 HG2 ARG 122 11.105 3.052 0.619
313 HG3 ARG 122 HG3 ARG 122 12.769 3.406 0.163
314 HD2 ARG 122 HD2 ARG 122 12.786 1.765 1.933
315 HD3 ARG 122 HD3 ARG 122 13.517 3.270 2.477
316 HE ARG 122 HE ARG 122 11.833 3.581 4.033
317 HH11 ARG 122 HH11 ARG 122 10.652 1.084 1.857
318 HH12 ARG 122 HH12 ARG 122 9.395 0.610 2.968
319 HH21 ARG 122 HH21 ARG 122 10.430 2.732 5.474
320 HH22 ARG 122 HH22 ARG 122 9.214 1.591 4.943
321 H GLY 123 H GLY 123 12.626 8.081 -0.436
322 HA2 GLY 123 HA2 GLY 123 11.911 10.244 -0.727
323 HA3 GLY 123 HA3 GLY 123 10.252 9.741 -0.494
324 H PHE 124 H PHE 124 10.189 11.903 0.530
325 HA PHE 124 HA PHE 124 11.430 12.604 2.996
326 HB2 PHE 124 HB2 PHE 124 9.043 13.493 1.406
327 HB3 PHE 124 HB3 PHE 124 9.019 13.886 3.101
328 HD1 PHE 124 HD1 PHE 124 11.254 14.940 4.104
329 HD2 PHE 124 HD2 PHE 124 9.955 15.173 -0.003
330 HE1 PHE 124 HE1 PHE 124 12.539 17.041 3.817
331 HE2 PHE 124 HE2 PHE 124 11.255 17.265 -0.293
332 HZ PHE 124 HZ PHE 124 12.541 18.206 1.622
333 H PHE 125 H PHE 125 10.761 12.543 5.142
334 HA PHE 125 HA PHE 125 8.982 10.418 5.997
335 HB2 PHE 125 HB2 PHE 125 9.532 10.943 8.159
336 HB3 PHE 125 HB3 PHE 125 11.001 11.202 7.262
337 HD1 PHE 125 HD1 PHE 125 10.133 14.172 6.287
338 HD2 PHE 125 HD2 PHE 125 10.262 12.122 10.086
339 HE1 PHE 125 HE1 PHE 125 10.503 16.320 7.435
340 HE2 PHE 125 HE2 PHE 125 10.615 14.287 11.229
341 HZ PHE 125 HZ PHE 125 10.726 16.392 9.907
342 H TYR 126 H TYR 126 7.000 10.607 7.132
343 HA TYR 126 HA TYR 126 5.417 13.096 6.728
344 HB2 TYR 126 HB2 TYR 126 3.600 11.641 5.885
345 HB3 TYR 126 HB3 TYR 126 5.003 11.717 4.853
346 HD1 TYR 126 HD1 TYR 126 3.144 9.543 7.253
347 HD2 TYR 126 HD2 TYR 126 6.273 9.756 4.285
348 HE1 TYR 126 HE1 TYR 126 3.266 7.059 7.196
349 HE2 TYR 126 HE2 TYR 126 6.369 7.272 4.213
350 HH TYR 126 HH TYR 126 4.253 5.217 6.243
351 H THR 127 H THR 127 6.646 11.723 9.150
352 HA THR 127 HA THR 127 4.251 11.845 10.879
353 HB THR 127 HB THR 127 4.452 9.496 10.489
354 HG1 THR 127 HG1 THR 127 4.574 8.875 12.559
355 HG21 THR 127 HG21 THR 127 7.332 9.633 11.490
356 HG22 THR 127 HG22 THR 127 6.834 9.296 9.816
357 HG23 THR 127 HG23 THR 127 6.410 8.163 11.112
358 HA PRO 128 HA PRO 128 7.252 14.019 13.477
359 HB2 PRO 128 HB2 PRO 128 5.852 14.276 15.788
360 HB3 PRO 128 HB3 PRO 128 5.402 15.164 14.303
361 HG2 PRO 128 HG2 PRO 128 4.242 12.542 15.323
362 HG3 PRO 128 HG3 PRO 128 3.353 14.017 14.819
363 HD2 PRO 128 HD2 PRO 128 3.737 11.936 13.120
364 HD3 PRO 128 HD3 PRO 128 3.797 13.623 12.539
365 H LYS 129 H LYS 129 6.192 10.773 13.934
366 HA LYS 129 HA LYS 129 7.535 10.185 16.435
367 HB2 LYS 129 HB2 LYS 129 6.550 8.344 14.214
368 HB3 LYS 129 HB3 LYS 129 7.130 7.816 15.800
369 HG2 LYS 129 HG2 LYS 129 5.333 9.117 16.910
370 HG3 LYS 129 HG3 LYS 129 4.706 9.605 15.321
371 HD2 LYS 129 HD2 LYS 129 4.323 7.217 14.739
372 HD3 LYS 129 HD3 LYS 129 4.936 6.734 16.337
373 HE2 LYS 129 HE2 LYS 129 3.144 8.068 17.428
374 HE3 LYS 129 HE3 LYS 129 2.524 8.540 15.844
375 HZ1 LYS 129 HZ1 LYS 129 2.643 5.748 16.854
376 HZ2 LYS 129 HZ2 LYS 129 2.072 6.183 15.391
377 HZ3 LYS 129 HZ3 LYS 129 1.293 6.654 16.746
378 H THR 130 H THR 130 9.332 8.833 16.779
379 HA THR 130 HA THR 130 11.330 8.480 14.639
380 HB THR 130 HB THR 130 11.678 10.783 15.515
381 HG1 THR 130 HG1 THR 130 13.898 10.477 15.759
382 HG21 THR 130 HG21 THR 130 12.734 11.124 17.687
383 HG22 THR 130 HG22 THR 130 12.560 9.405 18.088
384 HG23 THR 130 HG23 THR 130 11.122 10.438 17.918
385 H ARG 131 H ARG 131 13.312 7.359 15.507
386 HA ARG 131 HA ARG 131 12.416 4.968 17.012
387 HB2 ARG 131 HB2 ARG 131 13.437 4.754 14.767
388 HB3 ARG 131 HB3 ARG 131 14.940 5.454 15.378
389 HG2 ARG 131 HG2 ARG 131 15.189 3.553 16.960
390 HG3 ARG 131 HG3 ARG 131 13.639 2.889 16.400
391 HD2 ARG 131 HD2 ARG 131 14.568 2.677 14.109
392 HD3 ARG 131 HD3 ARG 131 16.121 3.324 14.688
393 HE ARG 131 HE ARG 131 15.442 1.100 16.307
394 HH11 ARG 131 HH21 ARG 131 16.394 1.660 12.980
395 HH12 ARG 131 HH22 ARG 131 17.109 0.075 12.822
396 HH21 ARG 131 HH11 ARG 131 16.362 -0.902 16.037
397 HH22 ARG 131 HH12 ARG 131 17.089 -1.332 14.514
Start of MODEL 20
1 H1 GLY 1 H1 GLY 1 15.197 24.871 11.851
2 H2 GLY 1 H2 GLY 1 16.463 24.835 10.823
3 H3 GLY 1 H3 GLY 1 16.132 23.526 11.762
4 HA2 GLY 1 HA2 GLY 1 13.970 23.254 10.642
5 HA3 GLY 1 HA3 GLY 1 14.478 24.553 9.545
6 H ILE 2 H ILE 2 13.744 22.013 8.647
7 HA ILE 2 HA ILE 2 15.764 20.057 8.471
8 HB ILE 2 HB ILE 2 13.451 20.631 6.562
9 HG12 ILE 2 HG12 ILE 2 12.608 20.297 8.816
10 HG13 ILE 2 HG13 ILE 2 12.191 18.946 7.781
11 HG21 ILE 2 HG21 ILE 2 15.160 18.146 6.887
12 HG22 ILE 2 HG22 ILE 2 13.618 18.185 6.011
13 HG23 ILE 2 HG23 ILE 2 14.977 19.140 5.432
14 HD11 ILE 2 HD11 ILE 2 12.816 18.183 10.023
15 HD12 ILE 2 HD12 ILE 2 13.971 17.562 8.838
16 HD13 ILE 2 HD13 ILE 2 14.414 18.938 9.881
17 H VAL 3 H VAL 3 14.893 22.399 5.873
18 HA VAL 3 HA VAL 3 17.141 21.690 4.251
19 HB VAL 3 HB VAL 3 15.426 24.193 4.168
20 HG11 VAL 3 HG11 VAL 3 16.195 24.391 1.811
21 HG12 VAL 3 HG12 VAL 3 17.514 24.622 2.955
22 HG13 VAL 3 HG13 VAL 3 17.358 23.081 2.087
23 HG21 VAL 3 HG21 VAL 3 14.294 23.043 2.285
24 HG22 VAL 3 HG22 VAL 3 15.306 21.604 2.561
25 HG23 VAL 3 HG23 VAL 3 14.126 22.121 3.786
26 H GLU 4 H GLU 4 16.626 24.336 6.531
27 HA GLU 4 HA GLU 4 18.937 25.854 6.210
28 HB2 GLU 4 HB2 GLU 4 16.990 26.432 7.580
29 HB3 GLU 4 HB3 GLU 4 17.366 25.130 8.702
30 HG2 GLU 4 HG2 GLU 4 19.494 26.313 9.308
31 HG3 GLU 4 HG3 GLU 4 19.021 27.627 8.217
32 H GLN 5 H GLN 5 18.601 22.865 8.179
33 HA GLN 5 HA GLN 5 21.047 23.132 9.526
34 HB2 GLN 5 HB2 GLN 5 19.104 21.755 10.194
35 HB3 GLN 5 HB3 GLN 5 19.466 20.614 8.911
36 HG2 GLN 5 HG2 GLN 5 20.238 19.784 11.086
37 HG3 GLN 5 HG3 GLN 5 21.603 20.016 10.005
38 HE21 GLN 5 HE21 GLN 5 23.059 21.851 10.396
39 HE22 GLN 5 HE22 GLN 5 23.119 22.562 12.011
40 H CYS 6 H CYS 6 20.488 21.671 6.357
41 HA CYS 6 HA CYS 6 23.411 21.050 6.186
42 HB2 CYS 6 HB2 CYS 6 21.581 19.281 5.577
43 HB3 CYS 6 HB3 CYS 6 21.447 20.203 4.084
44 H CYS 7 H CYS 7 21.082 23.387 5.090
45 HA CYS 7 HA CYS 7 22.654 24.192 2.760
46 HB2 CYS 7 HB2 CYS 7 20.216 24.165 2.787
47 HB3 CYS 7 HB3 CYS 7 20.200 25.392 4.060
48 H THR 8 H THR 8 22.283 25.380 6.107
49 HA THR 8 HA THR 8 23.978 27.758 5.539
50 HB THR 8 HB THR 8 23.524 28.443 7.811
51 HG1 THR 8 HG1 THR 8 21.925 26.104 8.005
52 HG21 THR 8 HG21 THR 8 21.139 28.862 7.644
53 HG22 THR 8 HG22 THR 8 20.952 27.576 6.425
54 HG23 THR 8 HG23 THR 8 21.892 29.042 6.052
55 H SER 9 H SER 9 24.424 24.572 6.772
56 HA SER 9 HA SER 9 27.288 25.027 7.146
57 HB2 SER 9 HB2 SER 9 26.205 25.486 9.408
58 HB3 SER 9 HB3 SER 9 25.672 23.788 9.418
59 HG SER 9 HG SER 9 27.712 24.161 10.489
60 H ILE 10 H ILE 10 28.343 22.788 7.644
61 HA ILE 10 HA ILE 10 27.438 20.959 5.587
62 HB ILE 10 HB ILE 10 29.296 19.496 6.349
63 HG12 ILE 10 HG12 ILE 10 31.084 20.373 7.740
64 HG13 ILE 10 HG13 ILE 10 30.160 21.807 8.149
65 HG21 ILE 10 HG21 ILE 10 31.015 20.916 5.400
66 HG22 ILE 10 HG22 ILE 10 29.495 21.228 4.564
67 HG23 ILE 10 HG23 ILE 10 30.077 22.383 5.769
68 HD11 ILE 10 HD11 ILE 10 29.221 19.023 8.914
69 HD12 ILE 10 HD12 ILE 10 30.337 19.979 9.918
70 HD13 ILE 10 HD13 ILE 10 28.722 20.598 9.595
71 H CYS 11 H CYS 11 26.767 18.775 5.722
72 HA CYS 11 HA CYS 11 25.888 17.803 8.371
73 HB2 CYS 11 HB2 CYS 11 23.727 17.297 7.753
74 HB3 CYS 11 HB3 CYS 11 23.971 18.937 7.192
75 H SER 12 H SER 12 25.069 15.501 8.195
76 HA SER 12 HA SER 12 27.093 13.864 6.747
77 HB2 SER 12 HB2 SER 12 27.102 12.426 8.722
78 HB3 SER 12 HB3 SER 12 27.512 14.093 9.156
79 HG SER 12 HG SER 12 25.942 13.043 10.555
80 H LEU 13 H LEU 13 26.515 11.515 6.548
81 HA LEU 13 HA LEU 13 24.060 11.017 5.218
82 HB2 LEU 13 HB2 LEU 13 25.826 9.062 6.765
83 HB3 LEU 13 HB3 LEU 13 24.595 8.616 5.589
84 HG LEU 13 HG LEU 13 27.154 10.147 4.990
85 HD11 LEU 13 HD11 LEU 13 27.499 7.757 5.509
86 HD12 LEU 13 HD12 LEU 13 27.815 8.109 3.802
87 HD13 LEU 13 HD13 LEU 13 26.297 7.315 4.276
88 HD21 LEU 13 HD21 LEU 13 25.401 10.855 3.432
89 HD22 LEU 13 HD22 LEU 13 24.966 9.155 3.118
90 HD23 LEU 13 HD23 LEU 13 26.540 9.795 2.602
91 H TYR 14 H TYR 14 24.889 10.622 8.664
92 HA TYR 14 HA TYR 14 22.433 9.411 9.466
93 HB2 TYR 14 HB2 TYR 14 24.296 11.135 11.130
94 HB3 TYR 14 HB3 TYR 14 23.166 9.922 11.718
95 HD1 TYR 14 HD1 TYR 14 23.520 7.471 10.638
96 HD2 TYR 14 HD2 TYR 14 26.561 10.524 10.935
97 HE1 TYR 14 HE1 TYR 14 25.293 5.728 10.442
98 HE2 TYR 14 HE2 TYR 14 28.325 8.788 10.711
99 HH TYR 14 HH TYR 14 28.786 6.550 10.490
100 H GLN 15 H GLN 15 23.170 12.744 8.716
101 HA GLN 15 HA GLN 15 20.755 13.779 10.103
102 HB2 GLN 15 HB2 GLN 15 22.977 15.103 8.525
103 HB3 GLN 15 HB3 GLN 15 21.525 15.955 9.060
104 HG2 GLN 15 HG2 GLN 15 21.993 15.521 11.388
105 HG3 GLN 15 HG3 GLN 15 23.326 14.436 10.988
106 HE21 GLN 15 HE21 GLN 15 25.342 15.304 10.341
107 HE22 GLN 15 HE22 GLN 15 25.697 17.017 10.606
108 H LEU 16 H LEU 16 21.906 13.098 6.777
109 HA LEU 16 HA LEU 16 19.466 13.844 5.445
110 HB2 LEU 16 HB2 LEU 16 21.581 11.774 4.781
111 HB3 LEU 16 HB3 LEU 16 20.312 12.269 3.669
112 HG LEU 16 HG LEU 16 22.360 14.235 4.806
113 HD11 LEU 16 HD11 LEU 16 23.521 14.008 2.640
114 HD12 LEU 16 HD12 LEU 16 22.384 12.729 2.156
115 HD13 LEU 16 HD13 LEU 16 23.501 12.474 3.516
116 HD21 LEU 16 HD21 LEU 16 21.727 15.570 2.819
117 HD22 LEU 16 HD22 LEU 16 20.351 15.302 3.889
118 HD23 LEU 16 HD23 LEU 16 20.497 14.363 2.385
119 H GLU 17 H GLU 17 20.414 10.829 7.117
120 HA GLU 17 HA GLU 17 17.905 9.454 6.721
121 HB2 GLU 17 HB2 GLU 17 20.150 9.115 8.737
122 HB3 GLU 17 HB3 GLU 17 18.718 8.085 8.701
123 HG2 GLU 17 HG2 GLU 17 19.220 7.517 6.311
124 HG3 GLU 17 HG3 GLU 17 20.757 8.365 6.495
125 H ASN 18 H ASN 18 18.387 12.273 8.517
126 HA ASN 18 HA ASN 18 16.032 11.666 10.278
127 HB2 ASN 18 HB2 ASN 18 18.497 13.352 10.726
128 HB3 ASN 18 HB3 ASN 18 16.974 13.833 11.464
129 HD21 ASN 18 HD21 ASN 18 19.439 11.247 11.426
130 HD22 ASN 18 HD22 ASN 18 18.859 10.522 12.922
131 H TYR 19 H TYR 19 17.251 13.880 7.773
132 HA TYR 19 HA TYR 19 14.992 15.656 7.858
133 HB2 TYR 19 HB2 TYR 19 16.734 14.850 5.516
134 HB3 TYR 19 HB3 TYR 19 15.752 16.302 5.604
135 HD1 TYR 19 HD2 TYR 19 16.664 16.948 8.644
136 HD2 TYR 19 HD1 TYR 19 18.650 16.056 4.930
137 HE1 TYR 19 HE2 TYR 19 18.688 18.148 9.437
138 HE2 TYR 19 HE1 TYR 19 20.712 17.179 5.749
139 HH TYR 19 HH TYR 19 21.679 18.347 7.464
140 H CYS 20 H CYS 20 15.295 12.426 6.542
141 HA CYS 20 HA CYS 20 13.062 12.652 4.718
142 HB2 CYS 20 HB2 CYS 20 13.224 10.176 4.650
143 HB3 CYS 20 HB3 CYS 20 14.718 11.024 4.236
144 H ASN 21 H ASN 21 11.103 11.503 4.835
145 HA ASN 21 HA ASN 21 9.574 12.222 7.084
146 HB2 ASN 21 HB2 ASN 21 9.008 12.012 4.595
147 HB3 ASN 21 HB3 ASN 21 8.764 10.301 4.874
148 HD21 ASN 21 HD21 ASN 21 6.882 12.348 3.974
149 HD22 ASN 21 HD22 ASN 21 5.535 12.210 5.105
150 H GLY 22 H GLY 22 9.833 11.287 9.008
151 HA2 GLY 22 HA2 GLY 22 8.796 8.646 9.577
152 HA3 GLY 22 HA3 GLY 22 10.555 8.676 9.729
153 H1 PHE 101 H1 PHE 101 33.749 8.349 4.295
154 H2 PHE 101 H2 PHE 101 34.388 8.958 2.916
155 H3 PHE 101 H3 PHE 101 33.142 7.904 2.833
156 HA PHE 101 HA PHE 101 32.393 10.144 2.397
157 HB2 PHE 101 HB2 PHE 101 30.794 8.573 3.381
158 HB3 PHE 101 HB3 PHE 101 31.378 8.923 4.998
159 HD1 PHE 101 HD2 PHE 101 29.629 10.430 2.056
160 HD2 PHE 101 HD1 PHE 101 30.544 10.784 6.258
161 HE1 PHE 101 HE2 PHE 101 28.051 12.336 2.239
162 HE2 PHE 101 HE1 PHE 101 28.982 12.689 6.435
163 HZ PHE 101 HZ PHE 101 27.730 13.483 4.427
164 H VAL 102 H VAL 102 32.072 12.302 3.127
165 HA VAL 102 HA VAL 102 33.260 13.202 5.645
166 HB VAL 102 HB VAL 102 35.135 13.373 4.040
167 HG11 VAL 102 HG11 VAL 102 35.146 15.021 2.247
168 HG12 VAL 102 HG12 VAL 102 33.874 13.835 1.948
169 HG13 VAL 102 HG13 VAL 102 33.454 15.453 2.564
170 HG21 VAL 102 HG21 VAL 102 34.127 16.112 4.907
171 HG22 VAL 102 HG22 VAL 102 34.944 14.926 5.957
172 HG23 VAL 102 HG23 VAL 102 35.797 15.627 4.575
173 H ASN 103 H ASN 103 32.286 15.140 6.408
174 HA ASN 103 HA ASN 103 29.577 15.461 5.574
175 HB2 ASN 103 HB2 ASN 103 31.311 17.165 7.404
176 HB3 ASN 103 HB3 ASN 103 29.568 17.358 7.199
177 HD21 ASN 103 HD21 ASN 103 30.367 17.012 9.722
178 HD22 ASN 103 HD22 ASN 103 29.986 15.382 10.248
179 H GLN 104 H GLN 104 28.513 17.001 4.407
180 HA GLN 104 HA GLN 104 30.011 19.194 3.051
181 HB2 GLN 104 HB2 GLN 104 28.432 16.997 1.636
182 HB3 GLN 104 HB3 GLN 104 28.892 18.538 0.888
183 HG2 GLN 104 HG2 GLN 104 31.292 18.015 1.271
184 HG3 GLN 104 HG3 GLN 104 30.846 16.458 1.953
185 HE21 GLN 104 HE21 GLN 104 32.528 16.123 -0.019
186 HE22 GLN 104 HE22 GLN 104 31.724 15.681 -1.519
187 H HIS 105 H HIS 105 28.607 20.805 2.082
188 HA HIS 105 HA HIS 105 25.988 21.059 3.469
189 HB2 HIS 105 HB2 HIS 105 26.124 23.440 2.766
190 HB3 HIS 105 HB3 HIS 105 27.385 22.917 3.873
191 HD1 HIS 105 HD1 HIS 105 29.839 23.408 3.112
192 HD2 HIS 105 HD2 HIS 105 26.957 23.670 0.058
193 HE1 HIS 105 HE1 HIS 105 31.053 24.319 1.057
194 H LEU 106 H LEU 106 24.093 21.308 2.414
195 HA LEU 106 HA LEU 106 23.899 21.096 -0.534
196 HB2 LEU 106 HB2 LEU 106 22.742 19.085 1.429
197 HB3 LEU 106 HB3 LEU 106 22.300 19.160 -0.268
198 HG LEU 106 HG LEU 106 25.117 18.526 0.728
199 HD11 LEU 106 HD11 LEU 106 24.538 16.194 0.140
200 HD12 LEU 106 HD12 LEU 106 22.867 16.716 -0.170
201 HD13 LEU 106 HD13 LEU 106 23.547 16.816 1.470
202 HD21 LEU 106 HD21 LEU 106 23.806 18.144 -1.999
203 HD22 LEU 106 HD22 LEU 106 25.467 17.690 -1.545
204 HD23 LEU 106 HD23 LEU 106 25.009 19.397 -1.614
205 H CYS 107 H CYS 107 21.942 21.933 -1.321
206 HA CYS 107 HA CYS 107 19.879 22.783 0.649
207 HB2 CYS 107 HB2 CYS 107 21.746 24.534 0.106
208 HB3 CYS 107 HB3 CYS 107 20.914 24.716 -1.426
209 H GLY 108 H GLY 108 17.830 23.322 -0.304
210 HA2 GLY 108 HA2 GLY 108 16.039 23.019 -1.729
211 HA3 GLY 108 HA3 GLY 108 17.173 23.487 -2.993
212 H SER 109 H SER 109 16.724 22.145 -4.657
213 HA SER 109 HA SER 109 15.713 19.515 -4.547
214 HB2 SER 109 HB2 SER 109 16.546 19.384 -6.929
215 HB3 SER 109 HB3 SER 109 15.517 20.785 -6.556
216 HG SER 109 HG SER 109 17.383 21.375 -7.767
217 H HIS 110 H HIS 110 19.132 20.575 -4.435
218 HA HIS 110 HA HIS 110 20.162 17.939 -4.938
219 HB2 HIS 110 HB2 HIS 110 21.337 20.252 -5.173
220 HB3 HIS 110 HB3 HIS 110 21.647 20.119 -3.438
221 HD1 HIS 110 HD1 HIS 110 24.294 20.143 -4.383
222 HD2 HIS 110 HD2 HIS 110 21.932 16.756 -5.211
223 HE1 HIS 110 HE1 HIS 110 25.906 18.282 -5.046
224 H LEU 111 H LEU 111 19.264 19.681 -1.980
225 HA LEU 111 HA LEU 111 20.231 17.652 -0.132
226 HB2 LEU 111 HB2 LEU 111 19.959 19.996 0.517
227 HB3 LEU 111 HB3 LEU 111 18.241 19.937 0.144
228 HG LEU 111 HG LEU 111 17.846 18.359 1.991
229 HD11 LEU 111 HD11 LEU 111 19.658 17.938 3.633
230 HD12 LEU 111 HD12 LEU 111 20.828 18.665 2.517
231 HD13 LEU 111 HD13 LEU 111 19.980 17.164 2.081
232 HD21 LEU 111 HD21 LEU 111 17.730 20.753 2.378
233 HD22 LEU 111 HD22 LEU 111 19.460 20.813 2.784
234 HD23 LEU 111 HD23 LEU 111 18.329 19.901 3.819
235 H VAL 112 H VAL 112 17.074 18.379 -1.644
236 HA VAL 112 HA VAL 112 15.560 16.261 -0.433
237 HB VAL 112 HB VAL 112 15.263 17.595 -3.152
238 HG11 VAL 112 HG11 VAL 112 13.314 15.799 -1.654
239 HG12 VAL 112 HG12 VAL 112 12.886 16.818 -3.043
240 HG13 VAL 112 HG13 VAL 112 14.041 15.507 -3.257
241 HG21 VAL 112 HG21 VAL 112 13.586 18.973 -2.172
242 HG22 VAL 112 HG22 VAL 112 13.624 18.079 -0.651
243 HG23 VAL 112 HG23 VAL 112 14.993 19.095 -1.109
244 H GLU 113 H GLU 113 17.419 16.299 -3.548
245 HA GLU 113 HA GLU 113 17.003 13.552 -4.168
246 HB2 GLU 113 HB2 GLU 113 17.799 15.264 -5.751
247 HB3 GLU 113 HB3 GLU 113 19.342 15.372 -4.880
248 HG2 GLU 113 HG2 GLU 113 19.860 13.041 -5.440
249 HG3 GLU 113 HG3 GLU 113 18.258 12.813 -6.152
250 H ALA 114 H ALA 114 19.632 15.103 -2.229
251 HA ALA 114 HA ALA 114 21.088 12.717 -1.775
252 HB1 ALA 114 HB1 ALA 114 21.997 14.944 -1.417
253 HB2 ALA 114 HB2 ALA 114 20.867 15.224 -0.067
254 HB3 ALA 114 HB3 ALA 114 22.127 13.988 0.060
255 H LEU 115 H LEU 115 18.321 14.061 0.171
256 HA LEU 115 HA LEU 115 18.537 11.813 2.029
257 HB2 LEU 115 HB2 LEU 115 16.646 12.637 3.162
258 HB3 LEU 115 HB3 LEU 115 17.774 13.928 2.806
259 HG LEU 115 HG LEU 115 16.207 14.559 0.862
260 HD11 LEU 115 HD11 LEU 115 14.286 12.821 2.491
261 HD12 LEU 115 HD12 LEU 115 14.703 12.582 0.782
262 HD13 LEU 115 HD13 LEU 115 13.800 14.003 1.263
263 HD21 LEU 115 HD21 LEU 115 15.168 14.804 3.694
264 HD22 LEU 115 HD22 LEU 115 14.827 15.886 2.335
265 HD23 LEU 115 HD23 LEU 115 16.462 15.803 2.989
266 H TYR 116 H TYR 116 16.688 12.326 -0.980
267 HA TYR 116 HA TYR 116 15.261 9.819 -0.773
268 HB2 TYR 116 HB2 TYR 116 15.904 11.781 -2.931
269 HB3 TYR 116 HB3 TYR 116 15.547 10.152 -3.447
270 HD1 TYR 116 HD1 TYR 116 13.391 9.015 -2.461
271 HD2 TYR 116 HD2 TYR 116 14.068 13.267 -2.615
272 HE1 TYR 116 HE1 TYR 116 10.924 9.420 -2.403
273 HE2 TYR 116 HE2 TYR 116 11.621 13.672 -2.535
274 HH TYR 116 HH TYR 116 9.539 12.723 -2.481
275 H LEU 117 H LEU 117 18.586 10.532 -1.808
276 HA LEU 117 HA LEU 117 19.077 7.785 -2.705
277 HB2 LEU 117 HB2 LEU 117 20.839 10.207 -2.196
278 HB3 LEU 117 HB3 LEU 117 21.504 8.661 -2.689
279 HG LEU 117 HG LEU 117 19.427 10.181 -4.335
280 HD11 LEU 117 HD11 LEU 117 21.333 10.819 -5.767
281 HD12 LEU 117 HD12 LEU 117 22.462 10.038 -4.634
282 HD13 LEU 117 HD13 LEU 117 21.526 11.469 -4.131
283 HD21 LEU 117 HD21 LEU 117 20.221 8.711 -6.163
284 HD22 LEU 117 HD22 LEU 117 19.487 7.781 -4.857
285 HD23 LEU 117 HD23 LEU 117 21.260 7.842 -5.009
286 H VAL 118 H VAL 118 19.828 9.615 0.272
287 HA VAL 118 HA VAL 118 21.309 7.334 1.388
288 HB VAL 118 HB VAL 118 20.721 10.104 2.476
289 HG11 VAL 118 HG11 VAL 118 22.529 7.923 3.597
290 HG12 VAL 118 HG12 VAL 118 22.517 9.621 4.123
291 HG13 VAL 118 HG13 VAL 118 21.091 8.623 4.368
292 HG21 VAL 118 HG21 VAL 118 22.261 10.029 0.509
293 HG22 VAL 118 HG22 VAL 118 23.132 10.448 1.982
294 HG23 VAL 118 HG23 VAL 118 23.238 8.802 1.329
295 H CYS 119 H CYS 119 18.087 8.744 1.912
296 HA CYS 119 HA CYS 119 17.531 6.671 3.992
297 HB2 CYS 119 HB2 CYS 119 17.358 9.087 4.580
298 HB3 CYS 119 HB3 CYS 119 16.065 9.246 3.401
299 H GLY 120 H GLY 120 17.051 7.146 0.691
300 HA2 GLY 120 HA2 GLY 120 15.964 5.776 -0.814
301 HA3 GLY 120 HA3 GLY 120 15.454 4.784 0.541
302 H GLU 121 H GLU 121 13.415 4.396 -0.042
303 HA GLU 121 HA GLU 121 11.690 6.124 -1.441
304 HB2 GLU 121 HB2 GLU 121 11.766 3.610 -1.367
305 HB3 GLU 121 HB3 GLU 121 10.934 3.669 0.189
306 HG2 GLU 121 HG2 GLU 121 8.962 4.665 -0.873
307 HG3 GLU 121 HG3 GLU 121 9.833 4.850 -2.405
308 H ARG 122 H ARG 122 12.348 6.286 1.892
309 HA ARG 122 HA ARG 122 9.864 7.099 3.047
310 HB2 ARG 122 HB2 ARG 122 12.722 7.989 3.651
311 HB3 ARG 122 HB3 ARG 122 11.340 8.340 4.682
312 HG2 ARG 122 HG2 ARG 122 12.393 5.547 4.039
313 HG3 ARG 122 HG3 ARG 122 12.683 6.462 5.522
314 HD2 ARG 122 HD2 ARG 122 10.237 6.500 5.976
315 HD3 ARG 122 HD3 ARG 122 9.973 5.488 4.540
316 HE ARG 122 HE ARG 122 11.866 4.129 6.082
317 HH11 ARG 122 HH11 ARG 122 8.540 5.116 6.576
318 HH12 ARG 122 HH12 ARG 122 8.215 3.791 7.662
319 HH21 ARG 122 HH21 ARG 122 11.387 2.470 7.473
320 HH22 ARG 122 HH22 ARG 122 9.790 2.331 8.151
321 H GLY 123 H GLY 123 12.251 9.018 1.230
322 HA2 GLY 123 HA2 GLY 123 12.099 11.093 0.224
323 HA3 GLY 123 HA3 GLY 123 10.348 10.848 0.218
324 H PHE 124 H PHE 124 10.215 13.164 0.464
325 HA PHE 124 HA PHE 124 11.287 14.451 2.852
326 HB2 PHE 124 HB2 PHE 124 10.854 15.312 0.338
327 HB3 PHE 124 HB3 PHE 124 9.340 15.840 1.043
328 HD1 PHE 124 HD2 PHE 124 9.374 17.608 2.879
329 HD2 PHE 124 HD1 PHE 124 12.957 16.279 0.889
330 HE1 PHE 124 HE2 PHE 124 10.599 19.571 3.770
331 HE2 PHE 124 HE1 PHE 124 14.174 18.270 1.731
332 HZ PHE 124 HZ PHE 124 13.001 19.911 3.205
333 H PHE 125 H PHE 125 10.045 15.646 4.425
334 HA PHE 125 HA PHE 125 7.757 14.316 5.524
335 HB2 PHE 125 HB2 PHE 125 9.132 16.950 6.069
336 HB3 PHE 125 HB3 PHE 125 7.607 16.563 6.845
337 HD1 PHE 125 HD1 PHE 125 7.373 14.393 8.187
338 HD2 PHE 125 HD2 PHE 125 11.171 16.081 7.027
339 HE1 PHE 125 HE1 PHE 125 8.492 13.109 9.988
340 HE2 PHE 125 HE2 PHE 125 12.287 14.784 8.830
341 HZ PHE 125 HZ PHE 125 10.958 13.298 10.299
342 H TYR 126 H TYR 126 5.614 14.934 5.717
343 HA TYR 126 HA TYR 126 4.407 16.224 3.408
344 HB2 TYR 126 HB2 TYR 126 3.115 15.335 6.005
345 HB3 TYR 126 HB3 TYR 126 2.296 15.659 4.483
346 HD1 TYR 126 HD1 TYR 126 3.553 14.211 2.406
347 HD2 TYR 126 HD2 TYR 126 3.159 13.065 6.553
348 HE1 TYR 126 HE1 TYR 126 3.737 11.811 1.768
349 HE2 TYR 126 HE2 TYR 126 3.330 10.668 5.906
350 HH TYR 126 HH TYR 126 3.580 9.173 4.198
351 H THR 127 H THR 127 2.911 18.048 3.502
352 HA THR 127 HA THR 127 3.930 20.294 5.016
353 HB THR 127 HB THR 127 1.917 21.491 4.003
354 HG1 THR 127 HG1 THR 127 0.617 19.674 3.593
355 HG21 THR 127 HG21 THR 127 2.884 21.540 1.753
356 HG22 THR 127 HG22 THR 127 3.812 20.059 2.091
357 HG23 THR 127 HG23 THR 127 4.164 21.561 2.978
358 HA PRO 128 HA PRO 128 1.295 19.841 8.572
359 HB2 PRO 128 HB2 PRO 128 1.550 22.253 9.790
360 HB3 PRO 128 HB3 PRO 128 2.922 21.116 9.627
361 HG2 PRO 128 HG2 PRO 128 2.243 23.473 7.825
362 HG3 PRO 128 HG3 PRO 128 3.816 23.095 8.601
363 HD2 PRO 128 HD2 PRO 128 3.247 22.369 6.028
364 HD3 PRO 128 HD3 PRO 128 4.239 21.331 7.099
365 H LYS 129 H LYS 129 -0.703 20.484 9.486
366 HA LYS 129 HA LYS 129 -2.674 21.486 7.604
367 HB2 LYS 129 HB2 LYS 129 -4.307 20.837 9.259
368 HB3 LYS 129 HB3 LYS 129 -3.089 19.574 9.092
369 HG2 LYS 129 HG2 LYS 129 -1.969 20.370 11.175
370 HG3 LYS 129 HG3 LYS 129 -3.204 21.637 11.343
371 HD2 LYS 129 HD2 LYS 129 -4.967 19.885 11.492
372 HD3 LYS 129 HD3 LYS 129 -3.722 18.628 11.340
373 HE2 LYS 129 HE2 LYS 129 -2.623 19.471 13.413
374 HE3 LYS 129 HE3 LYS 129 -3.866 20.719 13.569
375 HZ1 LYS 129 HZ1 LYS 129 -4.387 18.797 14.949
376 HZ2 LYS 129 HZ2 LYS 129 -4.374 17.790 13.668
377 HZ3 LYS 129 HZ3 LYS 129 -5.525 18.933 13.785
378 H THR 130 H THR 130 -0.605 23.295 9.343
379 HA THR 130 HA THR 130 -2.362 25.268 10.554
380 HB THR 130 HB THR 130 -0.197 26.503 10.895
381 HG1 THR 130 HG1 THR 130 1.683 25.380 10.364
382 HG21 THR 130 HG21 THR 130 0.734 24.944 12.509
383 HG22 THR 130 HG22 THR 130 -0.104 23.572 11.744
384 HG23 THR 130 HG23 THR 130 -1.033 24.849 12.562
385 H ARG 131 H ARG 131 -1.330 24.825 7.331
386 HA ARG 131 HA ARG 131 -2.272 27.514 6.532
387 HB2 ARG 131 HB2 ARG 131 -0.326 27.913 5.108
388 HB3 ARG 131 HB3 ARG 131 0.090 27.869 6.819
389 HG2 ARG 131 HG2 ARG 131 1.011 25.579 6.561
390 HG3 ARG 131 HG3 ARG 131 0.570 25.586 4.838
391 HD2 ARG 131 HD2 ARG 131 2.048 27.509 4.449
392 HD3 ARG 131 HD3 ARG 131 2.460 27.592 6.157
393 HE ARG 131 HE ARG 131 3.396 25.624 4.162
394 HH11 ARG 131 HH11 ARG 131 3.418 26.449 7.577
395 HH12 ARG 131 HH12 ARG 131 4.852 25.507 7.875
396 HH21 ARG 131 HH21 ARG 131 5.195 24.444 4.629
397 HH22 ARG 131 HH22 ARG 131 5.812 24.385 6.252