Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
576851 | 2meo RC | 19528 | 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 39.553 14.293 15.761
2 H2 GLY 1 H2 GLY 1 38.002 14.832 15.551
3 H3 GLY 1 H3 GLY 1 38.915 15.439 16.767
4 HA2 GLY 1 HA2 GLY 1 38.755 17.003 14.965
5 HA3 GLY 1 HA3 GLY 1 40.421 16.485 15.286
6 H SER 2 H SER 2 39.289 15.975 11.572
7 HA SER 2 HA SER 2 37.757 17.723 13.394
8 HB2 SER 2 HB2 SER 2 40.153 18.671 11.767
9 HB3 SER 2 HB3 SER 2 38.874 19.758 12.331
10 HG SER 2 HG SER 2 39.577 19.658 14.279
11 H ALA 3 H ALA 3 35.726 17.891 10.419
12 HA ALA 3 HA ALA 3 35.823 16.571 12.987
13 HB1 ALA 3 HB1 ALA 3 34.497 19.315 12.682
14 HB2 ALA 3 HB2 ALA 3 34.273 18.223 14.057
15 HB3 ALA 3 HB3 ALA 3 35.864 18.929 13.752
16 H PHE 4 H PHE 4 33.571 15.880 13.590
17 HA PHE 4 HA PHE 4 31.716 15.746 11.276
18 HB2 PHE 4 HB2 PHE 4 33.404 13.828 11.287
19 HB3 PHE 4 HB3 PHE 4 32.654 13.310 12.796
20 HD1 PHE 4 HD2 PHE 4 31.822 14.170 9.215
21 HD2 PHE 4 HD1 PHE 4 30.858 11.758 12.653
22 HE1 PHE 4 HE2 PHE 4 30.085 12.983 7.898
23 HE2 PHE 4 HE1 PHE 4 29.080 10.624 11.361
24 HZ PHE 4 HZ PHE 4 28.682 11.231 8.971
25 H CYS 5 H CYS 5 31.508 17.166 13.769
26 HA CYS 5 HA CYS 5 29.186 15.821 15.097
27 HB2 CYS 5 HB2 CYS 5 30.570 16.888 16.706
28 HB3 CYS 5 HB3 CYS 5 30.622 18.385 15.782
29 H ASN 6 H ASN 6 27.202 16.080 14.352
30 HA ASN 6 HA ASN 6 26.469 18.478 12.737
31 HB2 ASN 6 HB2 ASN 6 25.704 16.247 11.977
32 HB3 ASN 6 HB3 ASN 6 24.850 16.011 13.503
33 HD21 ASN 6 HD22 ASN 6 23.187 15.724 11.603
34 HD22 ASN 6 HD21 ASN 6 22.297 17.191 11.163
35 H LEU 7 H LEU 7 26.574 20.169 14.232
36 HA LEU 7 HA LEU 7 25.766 20.028 16.954
37 HB2 LEU 7 HB2 LEU 7 27.284 21.733 16.052
38 HB3 LEU 7 HB3 LEU 7 25.985 22.390 15.046
39 HG LEU 7 HG LEU 7 24.749 23.092 17.074
40 HD11 LEU 7 HD11 LEU 7 25.899 23.062 19.286
41 HD12 LEU 7 HD12 LEU 7 25.494 21.439 18.726
42 HD13 LEU 7 HD13 LEU 7 27.166 22.030 18.593
43 HD21 LEU 7 HD21 LEU 7 26.353 24.628 16.001
44 HD22 LEU 7 HD22 LEU 7 26.259 24.893 17.752
45 HD23 LEU 7 HD23 LEU 7 27.642 24.017 17.061
46 H ALA 8 H ALA 8 23.930 20.836 14.020
47 HA ALA 8 HA ALA 8 21.510 21.656 15.306
48 HB1 ALA 8 HB1 ALA 8 22.115 22.159 12.967
49 HB2 ALA 8 HB2 ALA 8 21.962 20.443 12.547
50 HB3 ALA 8 HB3 ALA 8 20.541 21.359 13.065
51 H ALA 9 H ALA 9 22.794 18.405 14.828
52 HA ALA 9 HA ALA 9 20.234 17.124 15.570
53 HB1 ALA 9 HB1 ALA 9 22.959 15.925 15.005
54 HB2 ALA 9 HB2 ALA 9 21.461 15.033 15.291
55 HB3 ALA 9 HB3 ALA 9 21.609 16.054 13.856
56 H CYS 10 H CYS 10 23.046 18.398 17.137
57 HA CYS 10 HA CYS 10 22.634 16.897 19.632
58 HB2 CYS 10 HB2 CYS 10 24.889 17.546 18.830
59 HB3 CYS 10 HB3 CYS 10 24.461 19.240 18.996
60 H GLU 11 H GLU 11 22.218 20.289 18.496
61 HA GLU 11 HA GLU 11 21.031 21.452 20.752
62 HB2 GLU 11 HB2 GLU 11 20.812 21.908 17.776
63 HB3 GLU 11 HB3 GLU 11 19.765 22.820 18.857
64 HG2 GLU 11 HG2 GLU 11 22.735 22.765 19.432
65 HG3 GLU 11 HG3 GLU 11 22.110 23.770 18.129
66 H LEU 12 H LEU 12 19.325 19.487 18.226
67 HA LEU 12 HA LEU 12 16.754 19.988 19.407
68 HB2 LEU 12 HB2 LEU 12 15.889 18.270 17.934
69 HB3 LEU 12 HB3 LEU 12 16.923 19.431 17.118
70 HG LEU 12 HG LEU 12 18.781 17.739 17.152
71 HD11 LEU 12 HD11 LEU 12 18.139 16.174 18.894
72 HD12 LEU 12 HD12 LEU 12 16.577 15.862 18.099
73 HD13 LEU 12 HD13 LEU 12 18.097 15.329 17.361
74 HD21 LEU 12 HD21 LEU 12 16.200 16.919 15.767
75 HD22 LEU 12 HD22 LEU 12 17.365 18.125 15.176
76 HD23 LEU 12 HD23 LEU 12 17.835 16.422 15.291
77 H SER 13 H SER 13 19.209 18.247 20.790
78 HA SER 13 HA SER 13 17.341 16.678 22.499
79 HB2 SER 13 HB2 SER 13 19.116 15.298 23.146
80 HB3 SER 13 HB3 SER 13 19.220 15.448 21.392
81 HG SER 13 HG SER 13 20.837 17.208 21.903
82 H CYS 14 H CYS 14 18.604 19.694 22.475
83 HA CYS 14 HA CYS 14 18.849 19.897 25.462
84 HB2 CYS 14 HB2 CYS 14 20.539 21.142 23.266
85 HB3 CYS 14 HB3 CYS 14 20.637 21.609 24.935
86 H ARG 15 H ARG 15 18.194 21.716 22.427
87 HA ARG 15 HA ARG 15 17.723 24.201 23.557
88 HB2 ARG 15 HB2 ARG 15 18.217 23.667 21.185
89 HB3 ARG 15 HB3 ARG 15 16.610 22.982 20.988
90 HG2 ARG 15 HG2 ARG 15 16.803 25.229 20.009
91 HG3 ARG 15 HG3 ARG 15 15.569 25.159 21.258
92 HD2 ARG 15 HD2 ARG 15 16.878 27.232 21.362
93 HD3 ARG 15 HD3 ARG 15 17.031 26.294 22.852
94 HE ARG 15 HE ARG 15 19.224 25.560 21.209
95 HH11 ARG 15 HH12 ARG 15 18.158 28.481 22.898
96 HH12 ARG 15 HH11 ARG 15 19.849 28.917 23.198
97 HH21 ARG 15 HH21 ARG 15 21.172 26.409 21.326
98 HH22 ARG 15 HH22 ARG 15 21.460 27.907 22.217
99 H SER 16 H SER 16 15.309 21.606 23.242
100 HA SER 16 HA SER 16 13.098 23.399 23.970
101 HB2 SER 16 HB2 SER 16 12.940 20.394 24.084
102 HB3 SER 16 HB3 SER 16 11.649 21.572 23.835
103 HG SER 16 HG SER 16 13.630 20.639 22.090
104 H LEU 17 H LEU 17 15.586 22.064 25.793
105 HA LEU 17 HA LEU 17 13.996 21.682 28.269
106 HB2 LEU 17 HB2 LEU 17 16.979 21.301 27.995
107 HB3 LEU 17 HB3 LEU 17 15.878 20.569 29.144
108 HG LEU 17 HG LEU 17 16.138 19.891 26.193
109 HD11 LEU 17 HD11 LEU 17 17.999 19.101 27.618
110 HD12 LEU 17 HD12 LEU 17 16.832 18.302 28.693
111 HD13 LEU 17 HD13 LEU 17 17.019 17.756 27.013
112 HD21 LEU 17 HD21 LEU 17 14.383 18.621 28.346
113 HD22 LEU 17 HD22 LEU 17 13.796 19.540 26.944
114 HD23 LEU 17 HD23 LEU 17 14.620 17.995 26.700
115 H GLY 18 H GLY 18 15.387 24.259 26.726
116 HA2 GLY 18 HA2 GLY 18 15.833 26.408 27.476
117 HA3 GLY 18 HA3 GLY 18 15.621 25.879 29.145
118 H LEU 19 H LEU 19 17.984 24.159 27.124
119 HA LEU 19 HA LEU 19 20.112 26.030 27.844
120 HB2 LEU 19 HB2 LEU 19 21.659 24.319 28.671
121 HB3 LEU 19 HB3 LEU 19 20.355 24.685 29.739
122 HG LEU 19 HG LEU 19 21.260 22.223 29.354
123 HD11 LEU 19 HD11 LEU 19 19.537 22.824 30.964
124 HD12 LEU 19 HD12 LEU 19 18.305 22.852 29.674
125 HD13 LEU 19 HD13 LEU 19 19.107 21.328 30.123
126 HD21 LEU 19 HD21 LEU 19 20.709 22.153 26.940
127 HD22 LEU 19 HD22 LEU 19 19.924 20.869 27.895
128 HD23 LEU 19 HD23 LEU 19 19.000 22.275 27.356
129 H LEU 20 H LEU 20 22.264 25.252 26.905
130 HA LEU 20 HA LEU 20 21.804 25.129 23.992
131 HB2 LEU 20 HB2 LEU 20 23.027 27.019 24.785
132 HB3 LEU 20 HB3 LEU 20 24.035 26.031 25.828
133 HG LEU 20 HG LEU 20 25.210 25.085 23.882
134 HD11 LEU 20 HD11 LEU 20 23.457 25.371 22.129
135 HD12 LEU 20 HD12 LEU 20 23.619 27.127 22.285
136 HD13 LEU 20 HD13 LEU 20 24.969 26.153 21.671
137 HD21 LEU 20 HD21 LEU 20 26.454 27.129 23.319
138 HD22 LEU 20 HD22 LEU 20 25.133 28.120 23.995
139 HD23 LEU 20 HD23 LEU 20 26.088 27.053 25.050
140 H GLY 21 H GLY 21 22.428 23.497 22.688
141 HA2 GLY 21 HA2 GLY 21 23.650 21.048 23.655
142 HA3 GLY 21 HA3 GLY 21 23.387 21.509 21.973
143 H LYS 22 H LYS 22 25.649 20.452 23.833
144 HA LYS 22 HA LYS 22 27.877 22.005 22.574
145 HB2 LYS 22 HB2 LYS 22 27.698 22.345 25.040
146 HB3 LYS 22 HB3 LYS 22 27.817 20.608 25.275
147 HG2 LYS 22 HG2 LYS 22 29.933 21.725 25.775
148 HG3 LYS 22 HG3 LYS 22 30.109 20.573 24.457
149 HD2 LYS 22 HD2 LYS 22 31.388 22.630 24.046
150 HD3 LYS 22 HD3 LYS 22 30.161 22.383 22.818
151 HE2 LYS 22 HE2 LYS 22 28.659 23.983 24.156
152 HE3 LYS 22 HE3 LYS 22 30.070 24.315 25.171
153 HZ1 LYS 22 HZ1 LYS 22 31.221 25.041 23.101
154 HZ2 LYS 22 HZ2 LYS 22 29.792 24.841 22.269
155 HZ3 LYS 22 HZ3 LYS 22 29.905 25.953 23.450
156 H CYS 23 H CYS 23 29.245 20.874 21.312
157 HA CYS 23 HA CYS 23 29.634 18.017 21.928
158 HB2 CYS 23 HB2 CYS 23 29.683 17.323 19.636
159 HB3 CYS 23 HB3 CYS 23 28.110 17.993 20.070
160 H ILE 24 H ILE 24 31.577 17.378 22.150
161 HA ILE 24 HA ILE 24 33.866 18.691 20.801
162 HB ILE 24 HB ILE 24 33.745 18.028 23.771
163 HG12 ILE 24 HG12 ILE 24 33.969 20.741 22.369
164 HG13 ILE 24 HG13 ILE 24 32.580 20.143 23.253
165 HG21 ILE 24 HG21 ILE 24 36.046 19.190 22.120
166 HG22 ILE 24 HG22 ILE 24 36.065 18.854 23.862
167 HG23 ILE 24 HG23 ILE 24 35.968 17.534 22.745
168 HD11 ILE 24 HD11 ILE 24 35.242 20.848 24.455
169 HD12 ILE 24 HD12 ILE 24 33.707 21.675 24.671
170 HD13 ILE 24 HD13 ILE 24 33.934 20.045 25.341
171 H GLY 25 H GLY 25 35.148 17.189 19.886
172 HA2 GLY 25 HA2 GLY 25 35.966 15.139 19.214
173 HA3 GLY 25 HA3 GLY 25 35.752 14.606 20.879
174 H GLU 26 H GLU 26 33.273 15.609 18.529
175 HA GLU 26 HA GLU 26 31.270 14.831 18.016
176 HB2 GLU 26 HB2 GLU 26 32.907 12.342 17.481
177 HB3 GLU 26 HB3 GLU 26 31.180 12.420 17.172
178 HG2 GLU 26 HG2 GLU 26 31.975 12.954 15.127
179 HG3 GLU 26 HG3 GLU 26 31.592 14.529 15.813
180 H GLU 27 H GLU 27 31.943 14.662 20.946
181 HA GLU 27 HA GLU 27 29.842 12.727 21.802
182 HB2 GLU 27 HB2 GLU 27 32.324 12.939 22.693
183 HB3 GLU 27 HB3 GLU 27 31.662 14.229 23.679
184 HG2 GLU 27 HG2 GLU 27 30.617 11.369 23.573
185 HG3 GLU 27 HG3 GLU 27 31.795 11.959 24.742
186 H CYS 28 H CYS 28 27.827 13.595 21.881
187 HA CYS 28 HA CYS 28 27.437 16.494 22.234
188 HB2 CYS 28 HB2 CYS 28 26.267 15.558 20.365
189 HB3 CYS 28 HB3 CYS 28 25.596 14.266 21.367
190 H LYS 29 H LYS 29 26.868 17.370 23.966
191 HA LYS 29 HA LYS 29 25.218 16.148 26.119
192 HB2 LYS 29 HB2 LYS 29 27.913 17.552 26.387
193 HB3 LYS 29 HB3 LYS 29 26.822 17.367 27.748
194 HG2 LYS 29 HG2 LYS 29 27.917 14.992 26.182
195 HG3 LYS 29 HG3 LYS 29 28.694 15.684 27.596
196 HD2 LYS 29 HD2 LYS 29 26.686 15.270 28.965
197 HD3 LYS 29 HD3 LYS 29 25.885 14.508 27.588
198 HE2 LYS 29 HE2 LYS 29 28.546 13.566 28.760
199 HE3 LYS 29 HE3 LYS 29 26.965 12.944 29.267
200 HZ1 LYS 29 HZ1 LYS 29 27.844 11.495 27.637
201 HZ2 LYS 29 HZ2 LYS 29 26.591 12.297 26.924
202 HZ3 LYS 29 HZ3 LYS 29 28.136 12.708 26.549
203 H CYS 30 H CYS 30 24.688 18.146 27.727
204 HA CYS 30 HA CYS 30 24.383 20.635 26.138
205 HB2 CYS 30 HB2 CYS 30 22.645 19.935 28.481
206 HB3 CYS 30 HB3 CYS 30 22.460 21.141 27.241
207 H VAL 31 H VAL 31 24.621 22.615 27.341
208 HA VAL 31 HA VAL 31 26.895 22.574 29.104
209 HB VAL 31 HB VAL 31 26.665 25.004 29.202
210 HG11 VAL 31 HG11 VAL 31 26.929 25.503 26.863
211 HG12 VAL 31 HG12 VAL 31 27.662 23.928 27.194
212 HG13 VAL 31 HG13 VAL 31 26.083 24.015 26.384
213 HG21 VAL 31 HG21 VAL 31 24.022 24.641 27.763
214 HG22 VAL 31 HG22 VAL 31 24.241 25.245 29.421
215 HG23 VAL 31 HG23 VAL 31 24.857 26.187 28.062
216 HA PRO 32 HA PRO 32 24.934 22.475 33.122
217 HB2 PRO 32 HB2 PRO 32 26.772 23.601 34.763
218 HB3 PRO 32 HB3 PRO 32 27.115 22.088 33.871
219 HG2 PRO 32 HG2 PRO 32 27.858 24.931 33.059
220 HG3 PRO 32 HG3 PRO 32 28.933 23.509 33.180
221 HD2 PRO 32 HD2 PRO 32 27.817 24.258 30.821
222 HD3 PRO 32 HD3 PRO 32 28.028 22.529 31.228
223 H TYR 33 H TYR 33 25.550 25.516 31.621
224 HA TYR 33 HA TYR 33 24.643 27.355 33.596
225 HB2 TYR 33 HB2 TYR 33 24.534 27.600 30.574
226 HB3 TYR 33 HB3 TYR 33 24.476 28.918 31.728
227 HD1 TYR 33 HD2 TYR 33 26.864 27.715 33.519
228 HD2 TYR 33 HD1 TYR 33 26.326 28.563 29.324
229 HE1 TYR 33 HE2 TYR 33 29.306 28.086 33.278
230 HE2 TYR 33 HE1 TYR 33 28.775 28.967 29.098
231 HH TYR 33 HH TYR 33 31.034 28.493 31.809
Start of MODEL 2
1 H1 GLY 1 H1 GLY 1 39.665 24.137 10.049
2 H2 GLY 1 H2 GLY 1 39.883 24.267 11.676
3 H3 GLY 1 H3 GLY 1 39.131 25.470 10.849
4 HA2 GLY 1 HA2 GLY 1 37.297 24.010 10.292
5 HA3 GLY 1 HA3 GLY 1 38.118 22.726 11.198
6 H SER 2 H SER 2 36.766 23.943 14.280
7 HA SER 2 HA SER 2 37.471 21.568 12.655
8 HB2 SER 2 HB2 SER 2 39.235 22.635 14.902
9 HB3 SER 2 HB3 SER 2 39.351 20.993 14.233
10 HG SER 2 HG SER 2 40.827 22.340 13.248
11 H ALA 3 H ALA 3 37.543 19.585 13.958
12 HA ALA 3 HA ALA 3 36.401 18.067 15.250
13 HB1 ALA 3 HB1 ALA 3 38.632 18.581 16.127
14 HB2 ALA 3 HB2 ALA 3 37.940 19.812 17.201
15 HB3 ALA 3 HB3 ALA 3 37.520 18.101 17.426
16 H PHE 4 H PHE 4 34.128 18.813 14.846
17 HA PHE 4 HA PHE 4 32.821 19.266 17.450
18 HB2 PHE 4 HB2 PHE 4 33.300 21.502 16.058
19 HB3 PHE 4 HB3 PHE 4 31.837 21.027 15.231
20 HD1 PHE 4 HD1 PHE 4 33.367 21.983 18.471
21 HD2 PHE 4 HD2 PHE 4 29.656 21.206 16.417
22 HE1 PHE 4 HE1 PHE 4 32.112 23.011 20.348
23 HE2 PHE 4 HE2 PHE 4 28.405 22.217 18.303
24 HZ PHE 4 HZ PHE 4 29.632 23.142 20.263
25 H CYS 5 H CYS 5 30.855 18.263 17.665
26 HA CYS 5 HA CYS 5 30.027 16.236 15.834
27 HB2 CYS 5 HB2 CYS 5 28.187 16.044 17.435
28 HB3 CYS 5 HB3 CYS 5 29.734 16.071 18.242
29 H ASN 6 H ASN 6 27.798 16.102 14.817
30 HA ASN 6 HA ASN 6 27.164 18.420 13.258
31 HB2 ASN 6 HB2 ASN 6 26.626 16.140 12.517
32 HB3 ASN 6 HB3 ASN 6 25.461 15.968 13.839
33 HD21 ASN 6 HD22 ASN 6 24.134 15.485 11.639
34 HD22 ASN 6 HD21 ASN 6 23.387 16.936 10.972
35 H LEU 7 H LEU 7 26.265 20.276 13.905
36 HA LEU 7 HA LEU 7 25.274 20.634 16.545
37 HB2 LEU 7 HB2 LEU 7 26.364 22.355 15.006
38 HB3 LEU 7 HB3 LEU 7 24.826 22.448 14.146
39 HG LEU 7 HG LEU 7 23.745 23.123 16.365
40 HD11 LEU 7 HD11 LEU 7 25.277 24.084 18.082
41 HD12 LEU 7 HD12 LEU 7 25.489 22.339 17.948
42 HD13 LEU 7 HD13 LEU 7 26.668 23.442 17.193
43 HD21 LEU 7 HD21 LEU 7 24.558 25.446 16.225
44 HD22 LEU 7 HD22 LEU 7 25.938 24.906 15.246
45 HD23 LEU 7 HD23 LEU 7 24.280 24.758 14.621
46 H ALA 8 H ALA 8 23.546 20.079 13.496
47 HA ALA 8 HA ALA 8 20.878 20.569 14.498
48 HB1 ALA 8 HB1 ALA 8 21.537 20.706 12.123
49 HB2 ALA 8 HB2 ALA 8 21.907 18.970 12.116
50 HB3 ALA 8 HB3 ALA 8 20.237 19.525 12.355
51 H ALA 9 H ALA 9 23.049 17.867 14.902
52 HA ALA 9 HA ALA 9 20.861 16.040 15.744
53 HB1 ALA 9 HB1 ALA 9 22.625 14.382 15.932
54 HB2 ALA 9 HB2 ALA 9 22.726 15.172 14.348
55 HB3 ALA 9 HB3 ALA 9 23.867 15.607 15.641
56 H CYS 10 H CYS 10 22.537 18.603 17.133
57 HA CYS 10 HA CYS 10 22.628 17.312 19.827
58 HB2 CYS 10 HB2 CYS 10 24.805 17.688 18.751
59 HB3 CYS 10 HB3 CYS 10 24.468 19.404 18.610
60 H GLU 11 H GLU 11 22.377 20.676 18.419
61 HA GLU 11 HA GLU 11 21.383 21.851 20.852
62 HB2 GLU 11 HB2 GLU 11 21.114 22.594 17.922
63 HB3 GLU 11 HB3 GLU 11 20.411 23.584 19.197
64 HG2 GLU 11 HG2 GLU 11 23.357 22.854 19.262
65 HG3 GLU 11 HG3 GLU 11 22.754 24.178 18.266
66 H LEU 12 H LEU 12 19.675 20.361 18.102
67 HA LEU 12 HA LEU 12 17.042 20.895 19.111
68 HB2 LEU 12 HB2 LEU 12 17.951 18.789 17.107
69 HB3 LEU 12 HB3 LEU 12 16.294 19.332 17.370
70 HG LEU 12 HG LEU 12 18.581 20.994 16.236
71 HD11 LEU 12 HD11 LEU 12 17.563 19.351 14.684
72 HD12 LEU 12 HD12 LEU 12 15.963 20.051 15.001
73 HD13 LEU 12 HD13 LEU 12 17.225 21.018 14.201
74 HD21 LEU 12 HD21 LEU 12 16.849 22.745 15.826
75 HD22 LEU 12 HD22 LEU 12 15.699 21.812 16.810
76 HD23 LEU 12 HD23 LEU 12 17.164 22.505 17.544
77 H SER 13 H SER 13 19.316 18.613 20.323
78 HA SER 13 HA SER 13 17.186 16.965 21.598
79 HB2 SER 13 HB2 SER 13 20.212 16.935 21.864
80 HB3 SER 13 HB3 SER 13 19.097 15.884 22.759
81 HG SER 13 HG SER 13 20.010 14.969 20.893
82 H CYS 14 H CYS 14 19.158 19.793 22.253
83 HA CYS 14 HA CYS 14 18.797 19.548 25.186
84 HB2 CYS 14 HB2 CYS 14 20.547 21.238 23.390
85 HB3 CYS 14 HB3 CYS 14 20.538 21.383 25.126
86 H ARG 15 H ARG 15 17.976 21.876 22.549
87 HA ARG 15 HA ARG 15 17.498 24.054 24.262
88 HB2 ARG 15 HB2 ARG 15 16.474 23.438 21.463
89 HB3 ARG 15 HB3 ARG 15 16.208 24.996 22.246
90 HG2 ARG 15 HG2 ARG 15 18.986 23.811 21.810
91 HG3 ARG 15 HG3 ARG 15 18.187 24.911 20.687
92 HD2 ARG 15 HD2 ARG 15 18.058 26.631 22.446
93 HD3 ARG 15 HD3 ARG 15 18.847 25.543 23.598
94 HE ARG 15 HE ARG 15 20.748 25.479 21.816
95 HH11 ARG 15 HH11 ARG 15 18.928 28.454 22.508
96 HH12 ARG 15 HH12 ARG 15 20.405 29.394 22.331
97 HH21 ARG 15 HH21 ARG 15 22.392 26.869 21.334
98 HH22 ARG 15 HH22 ARG 15 22.196 28.587 21.708
99 H SER 16 H SER 16 15.035 21.645 23.322
100 HA SER 16 HA SER 16 12.884 23.076 24.611
101 HB2 SER 16 HB2 SER 16 13.183 20.152 23.889
102 HB3 SER 16 HB3 SER 16 11.694 20.876 24.523
103 HG SER 16 HG SER 16 11.948 20.702 22.186
104 H LEU 17 H LEU 17 15.557 21.717 26.128
105 HA LEU 17 HA LEU 17 14.108 21.241 28.686
106 HB2 LEU 17 HB2 LEU 17 17.070 20.951 28.169
107 HB3 LEU 17 HB3 LEU 17 16.140 20.308 29.511
108 HG LEU 17 HG LEU 17 16.050 19.394 26.618
109 HD11 LEU 17 HD11 LEU 17 17.074 18.029 29.141
110 HD12 LEU 17 HD12 LEU 17 17.026 17.316 27.514
111 HD13 LEU 17 HD13 LEU 17 18.069 18.713 27.837
112 HD21 LEU 17 HD21 LEU 17 14.551 18.305 29.054
113 HD22 LEU 17 HD22 LEU 17 13.810 19.091 27.642
114 HD23 LEU 17 HD23 LEU 17 14.615 17.528 27.457
115 H GLY 18 H GLY 18 15.489 23.827 27.012
116 HA2 GLY 18 HA2 GLY 18 15.767 26.025 27.763
117 HA3 GLY 18 HA3 GLY 18 15.776 25.482 29.439
118 H LEU 19 H LEU 19 18.020 23.594 27.663
119 HA LEU 19 HA LEU 19 20.213 25.556 28.163
120 HB2 LEU 19 HB2 LEU 19 21.697 23.770 28.876
121 HB3 LEU 19 HB3 LEU 19 20.411 24.134 29.991
122 HG LEU 19 HG LEU 19 21.216 21.672 29.561
123 HD11 LEU 19 HD11 LEU 19 19.400 22.215 31.088
124 HD12 LEU 19 HD12 LEU 19 18.250 22.355 29.752
125 HD13 LEU 19 HD13 LEU 19 18.989 20.783 30.143
126 HD21 LEU 19 HD21 LEU 19 20.024 20.420 27.927
127 HD22 LEU 19 HD22 LEU 19 19.068 21.825 27.434
128 HD23 LEU 19 HD23 LEU 19 20.802 21.783 27.108
129 H LEU 20 H LEU 20 22.300 24.895 27.083
130 HA LEU 20 HA LEU 20 21.645 24.711 24.205
131 HB2 LEU 20 HB2 LEU 20 24.278 25.541 25.480
132 HB3 LEU 20 HB3 LEU 20 23.808 25.631 23.797
133 HG LEU 20 HG LEU 20 22.001 27.312 24.492
134 HD11 LEU 20 HD11 LEU 20 23.705 27.367 27.027
135 HD12 LEU 20 HD12 LEU 20 22.603 28.660 26.525
136 HD13 LEU 20 HD13 LEU 20 21.946 27.084 26.918
137 HD21 LEU 20 HD21 LEU 20 23.642 29.148 24.470
138 HD22 LEU 20 HD22 LEU 20 24.944 28.022 24.914
139 HD23 LEU 20 HD23 LEU 20 24.133 27.888 23.336
140 H GLY 21 H GLY 21 22.585 23.317 22.794
141 HA2 GLY 21 HA2 GLY 21 23.852 20.844 23.876
142 HA3 GLY 21 HA3 GLY 21 23.142 21.048 22.272
143 H LYS 22 H LYS 22 25.926 20.721 23.930
144 HA LYS 22 HA LYS 22 27.647 21.700 21.704
145 HB2 LYS 22 HB2 LYS 22 28.247 22.249 24.639
146 HB3 LYS 22 HB3 LYS 22 29.246 22.713 23.271
147 HG2 LYS 22 HG2 LYS 22 26.485 23.818 23.895
148 HG3 LYS 22 HG3 LYS 22 28.011 24.614 24.234
149 HD2 LYS 22 HD2 LYS 22 28.475 25.025 21.929
150 HD3 LYS 22 HD3 LYS 22 27.258 23.878 21.381
151 HE2 LYS 22 HE2 LYS 22 25.600 25.431 22.764
152 HE3 LYS 22 HE3 LYS 22 26.879 26.633 22.564
153 HZ1 LYS 22 HZ1 LYS 22 25.384 26.876 20.762
154 HZ2 LYS 22 HZ2 LYS 22 26.662 26.116 20.083
155 HZ3 LYS 22 HZ3 LYS 22 25.248 25.308 20.472
156 H CYS 23 H CYS 23 30.039 20.947 22.143
157 HA CYS 23 HA CYS 23 30.349 18.342 23.407
158 HB2 CYS 23 HB2 CYS 23 30.825 17.172 21.229
159 HB3 CYS 23 HB3 CYS 23 29.144 17.598 21.507
160 H ILE 24 H ILE 24 32.523 17.570 23.364
161 HA ILE 24 HA ILE 24 34.651 19.478 22.382
162 HB ILE 24 HB ILE 24 34.547 17.951 25.007
163 HG12 ILE 24 HG12 ILE 24 33.146 19.978 25.025
164 HG13 ILE 24 HG13 ILE 24 34.484 20.013 26.142
165 HG21 ILE 24 HG21 ILE 24 36.853 17.942 24.306
166 HG22 ILE 24 HG22 ILE 24 36.792 19.653 23.849
167 HG23 ILE 24 HG23 ILE 24 36.680 19.167 25.556
168 HD11 ILE 24 HD11 ILE 24 34.461 21.476 23.466
169 HD12 ILE 24 HD12 ILE 24 34.121 22.204 25.049
170 HD13 ILE 24 HD13 ILE 24 35.732 21.569 24.705
171 H GLY 25 H GLY 25 33.820 16.117 23.156
172 HA2 GLY 25 HA2 GLY 25 36.097 15.101 21.497
173 HA3 GLY 25 HA3 GLY 25 35.220 14.176 22.725
174 H GLU 26 H GLU 26 33.699 16.337 20.326
175 HA GLU 26 HA GLU 26 31.896 15.975 19.027
176 HB2 GLU 26 HB2 GLU 26 33.609 13.694 18.016
177 HB3 GLU 26 HB3 GLU 26 32.204 14.370 17.177
178 HG2 GLU 26 HG2 GLU 26 33.286 16.577 17.071
179 HG3 GLU 26 HG3 GLU 26 34.718 15.946 17.881
180 H GLU 27 H GLU 27 31.479 14.817 21.641
181 HA GLU 27 HA GLU 27 29.151 13.145 20.827
182 HB2 GLU 27 HB3 GLU 27 30.757 11.722 22.040
183 HB3 GLU 27 HB2 GLU 27 30.716 12.860 23.428
184 HG2 GLU 27 HG2 GLU 27 28.360 12.348 23.802
185 HG3 GLU 27 HG3 GLU 27 28.254 11.435 22.321
186 H CYS 28 H CYS 28 27.191 14.027 21.375
187 HA CYS 28 HA CYS 28 27.257 16.773 22.257
188 HB2 CYS 28 HB2 CYS 28 25.796 15.995 20.435
189 HB3 CYS 28 HB3 CYS 28 24.962 14.911 21.556
190 H LYS 29 H LYS 29 27.292 17.409 24.242
191 HA LYS 29 HA LYS 29 25.614 16.155 26.374
192 HB2 LYS 29 HB2 LYS 29 28.535 17.005 26.604
193 HB3 LYS 29 HB3 LYS 29 27.528 16.473 27.938
194 HG2 LYS 29 HG2 LYS 29 28.299 14.756 25.527
195 HG3 LYS 29 HG3 LYS 29 29.120 14.743 27.067
196 HD2 LYS 29 HD2 LYS 29 26.149 14.098 26.868
197 HD3 LYS 29 HD3 LYS 29 27.378 12.874 26.584
198 HE2 LYS 29 HE2 LYS 29 27.433 14.581 29.089
199 HE3 LYS 29 HE3 LYS 29 26.390 13.155 28.996
200 HZ1 LYS 29 HZ1 LYS 29 28.773 12.889 29.893
201 HZ2 LYS 29 HZ2 LYS 29 28.214 11.750 28.843
202 HZ3 LYS 29 HZ3 LYS 29 29.254 12.908 28.322
203 H CYS 30 H CYS 30 24.306 17.647 27.288
204 HA CYS 30 HA CYS 30 24.524 20.343 26.270
205 HB2 CYS 30 HB2 CYS 30 22.580 19.516 28.390
206 HB3 CYS 30 HB3 CYS 30 22.478 20.769 27.174
207 H VAL 31 H VAL 31 24.589 22.310 27.445
208 HA VAL 31 HA VAL 31 26.647 22.202 29.490
209 HB VAL 31 HB VAL 31 26.935 24.554 29.169
210 HG11 VAL 31 HG11 VAL 31 27.438 24.673 26.821
211 HG12 VAL 31 HG12 VAL 31 27.795 23.037 27.391
212 HG13 VAL 31 HG13 VAL 31 26.320 23.344 26.445
213 HG21 VAL 31 HG21 VAL 31 24.660 25.377 29.129
214 HG22 VAL 31 HG22 VAL 31 25.498 25.882 27.662
215 HG23 VAL 31 HG23 VAL 31 24.337 24.528 27.600
216 HA PRO 32 HA PRO 32 24.176 23.320 33.089
217 HB2 PRO 32 HB2 PRO 32 25.990 24.559 34.695
218 HB3 PRO 32 HB3 PRO 32 26.017 22.798 34.374
219 HG2 PRO 32 HG2 PRO 32 27.648 24.966 33.015
220 HG3 PRO 32 HG3 PRO 32 28.227 23.411 33.690
221 HD2 PRO 32 HD2 PRO 32 27.679 23.738 31.035
222 HD3 PRO 32 HD3 PRO 32 27.362 22.189 31.870
223 H TYR 33 H TYR 33 22.847 24.967 33.546
224 HA TYR 33 HA TYR 33 23.282 27.647 32.314
225 HB2 TYR 33 HB2 TYR 33 21.387 26.110 31.642
226 HB3 TYR 33 HB3 TYR 33 20.710 26.329 33.240
227 HD1 TYR 33 HD2 TYR 33 21.370 27.872 29.954
228 HD2 TYR 33 HD1 TYR 33 19.646 28.466 33.862
229 HE1 TYR 33 HE2 TYR 33 20.086 29.824 29.086
230 HE2 TYR 33 HE1 TYR 33 18.372 30.430 32.994
231 HH TYR 33 HH TYR 33 18.516 31.460 29.574
Start of MODEL 3
1 H1 GLY 1 H1 GLY 1 39.194 11.570 10.941
2 H2 GLY 1 H2 GLY 1 37.861 11.523 9.971
3 H3 GLY 1 H3 GLY 1 38.080 10.388 11.151
4 HA2 GLY 1 HA2 GLY 1 37.857 12.004 12.872
5 HA3 GLY 1 HA3 GLY 1 37.680 13.260 11.628
6 H SER 2 H SER 2 35.652 13.725 12.758
7 HA SER 2 HA SER 2 33.370 11.904 12.173
8 HB2 SER 2 HB2 SER 2 32.075 13.492 13.538
9 HB3 SER 2 HB3 SER 2 33.462 12.840 14.426
10 HG SER 2 HG SER 2 34.490 14.719 14.301
11 H ALA 3 H ALA 3 31.473 12.714 11.072
12 HA ALA 3 HA ALA 3 31.883 14.934 9.146
13 HB1 ALA 3 HB1 ALA 3 29.689 14.221 8.286
14 HB2 ALA 3 HB2 ALA 3 30.814 12.853 8.377
15 HB3 ALA 3 HB3 ALA 3 29.542 13.042 9.604
16 H PHE 4 H PHE 4 32.247 16.418 10.946
17 HA PHE 4 HA PHE 4 31.817 17.943 12.513
18 HB2 PHE 4 HB2 PHE 4 30.026 18.551 10.708
19 HB3 PHE 4 HB3 PHE 4 28.886 18.041 11.943
20 HD1 PHE 4 HD2 PHE 4 31.666 20.388 11.141
21 HD2 PHE 4 HD1 PHE 4 28.435 19.488 13.857
22 HE1 PHE 4 HE2 PHE 4 31.944 22.610 12.216
23 HE2 PHE 4 HE1 PHE 4 28.749 21.705 14.941
24 HZ PHE 4 HZ PHE 4 30.490 23.262 14.124
25 H CYS 5 H CYS 5 30.848 18.360 14.723
26 HA CYS 5 HA CYS 5 30.716 15.885 16.111
27 HB2 CYS 5 HB2 CYS 5 30.835 17.318 18.060
28 HB3 CYS 5 HB3 CYS 5 31.972 17.849 16.836
29 H ASN 6 H ASN 6 28.477 16.092 14.493
30 HA ASN 6 HA ASN 6 26.250 16.168 14.283
31 HB2 ASN 6 HB2 ASN 6 25.343 14.253 14.936
32 HB3 ASN 6 HB3 ASN 6 27.034 13.914 15.252
33 HD21 ASN 6 HD22 ASN 6 27.290 15.124 17.877
34 HD22 ASN 6 HD21 ASN 6 26.370 14.006 18.896
35 H LEU 7 H LEU 7 26.979 18.462 15.506
36 HA LEU 7 HA LEU 7 25.435 19.294 17.710
37 HB2 LEU 7 HB2 LEU 7 27.454 20.397 16.742
38 HB3 LEU 7 HB3 LEU 7 26.481 20.920 15.365
39 HG LEU 7 HG LEU 7 25.096 22.320 16.864
40 HD11 LEU 7 HD11 LEU 7 25.256 21.081 18.988
41 HD12 LEU 7 HD12 LEU 7 27.004 21.410 19.067
42 HD13 LEU 7 HD13 LEU 7 25.828 22.731 19.198
43 HD21 LEU 7 HD21 LEU 7 26.850 23.981 17.408
44 HD22 LEU 7 HD22 LEU 7 28.100 22.744 17.183
45 HD23 LEU 7 HD23 LEU 7 27.098 23.276 15.810
46 H ALA 8 H ALA 8 24.569 19.007 14.306
47 HA ALA 8 HA ALA 8 22.164 20.549 14.308
48 HB1 ALA 8 HB1 ALA 8 21.739 19.310 12.207
49 HB2 ALA 8 HB2 ALA 8 23.403 19.914 12.313
50 HB3 ALA 8 HB3 ALA 8 23.064 18.192 12.602
51 H ALA 9 H ALA 9 22.764 17.278 15.508
52 HA ALA 9 HA ALA 9 19.844 16.828 15.957
53 HB1 ALA 9 HB1 ALA 9 22.256 15.000 16.336
54 HB2 ALA 9 HB2 ALA 9 20.552 14.555 16.573
55 HB3 ALA 9 HB3 ALA 9 21.135 14.984 14.953
56 H CYS 10 H CYS 10 22.850 17.614 17.584
57 HA CYS 10 HA CYS 10 22.077 16.963 20.233
58 HB2 CYS 10 HB2 CYS 10 24.382 17.235 19.335
59 HB3 CYS 10 HB3 CYS 10 24.106 18.978 19.248
60 H GLU 11 H GLU 11 22.108 20.246 18.631
61 HA GLU 11 HA GLU 11 21.131 21.590 20.990
62 HB2 GLU 11 HB2 GLU 11 21.241 22.313 18.077
63 HB3 GLU 11 HB3 GLU 11 20.526 23.408 19.249
64 HG2 GLU 11 HG2 GLU 11 23.283 22.337 19.856
65 HG3 GLU 11 HG3 GLU 11 23.115 23.529 18.571
66 H LEU 12 H LEU 12 19.327 20.358 18.097
67 HA LEU 12 HA LEU 12 16.782 21.091 19.183
68 HB2 LEU 12 HB2 LEU 12 15.779 19.744 17.482
69 HB3 LEU 12 HB3 LEU 12 17.094 20.707 16.851
70 HG LEU 12 HG LEU 12 18.546 18.618 16.881
71 HD11 LEU 12 HD11 LEU 12 15.842 17.258 17.324
72 HD12 LEU 12 HD12 LEU 12 17.306 16.438 16.738
73 HD13 LEU 12 HD13 LEU 12 17.275 17.104 18.360
74 HD21 LEU 12 HD21 LEU 12 17.537 17.766 14.798
75 HD22 LEU 12 HD22 LEU 12 16.006 18.576 15.192
76 HD23 LEU 12 HD23 LEU 12 17.456 19.533 14.846
77 H SER 13 H SER 13 18.889 18.702 20.316
78 HA SER 13 HA SER 13 16.745 17.260 21.789
79 HB2 SER 13 HB2 SER 13 19.743 16.747 21.695
80 HB3 SER 13 HB3 SER 13 18.539 15.780 22.554
81 HG SER 13 HG SER 13 18.943 16.092 19.777
82 H CYS 14 H CYS 14 18.610 20.042 22.185
83 HA CYS 14 HA CYS 14 18.624 19.866 25.173
84 HB2 CYS 14 HB2 CYS 14 20.359 21.370 23.191
85 HB3 CYS 14 HB3 CYS 14 20.412 21.647 24.908
86 H ARG 15 H ARG 15 17.982 22.182 22.456
87 HA ARG 15 HA ARG 15 17.332 24.344 24.168
88 HB2 ARG 15 HB2 ARG 15 16.576 23.817 21.261
89 HB3 ARG 15 HB3 ARG 15 16.332 25.367 22.068
90 HG2 ARG 15 HG2 ARG 15 19.048 24.021 21.751
91 HG3 ARG 15 HG3 ARG 15 18.404 25.248 20.665
92 HD2 ARG 15 HD2 ARG 15 18.386 26.914 22.439
93 HD3 ARG 15 HD3 ARG 15 18.853 25.705 23.650
94 HE ARG 15 HE ARG 15 20.886 25.408 21.937
95 HH11 ARG 15 HH11 ARG 15 19.735 28.424 23.500
96 HH12 ARG 15 HH12 ARG 15 21.362 29.077 23.322
97 HH21 ARG 15 HH21 ARG 15 22.684 26.512 21.588
98 HH22 ARG 15 HH22 ARG 15 22.879 28.115 22.332
99 H SER 16 H SER 16 15.203 21.735 23.243
100 HA SER 16 HA SER 16 12.695 22.969 23.928
101 HB2 SER 16 HB2 SER 16 12.016 20.573 24.377
102 HB3 SER 16 HB3 SER 16 12.666 20.890 22.759
103 HG SER 16 HG SER 16 13.510 18.987 23.822
104 H LEU 17 H LEU 17 15.325 21.648 25.874
105 HA LEU 17 HA LEU 17 13.819 21.705 28.390
106 HB2 LEU 17 HB2 LEU 17 16.783 21.243 28.062
107 HB3 LEU 17 HB3 LEU 17 15.718 20.640 29.326
108 HG LEU 17 HG LEU 17 15.861 19.721 26.424
109 HD11 LEU 17 HD11 LEU 17 16.618 18.312 29.003
110 HD12 LEU 17 HD12 LEU 17 16.693 17.633 27.359
111 HD13 LEU 17 HD13 LEU 17 17.745 18.999 27.802
112 HD21 LEU 17 HD21 LEU 17 13.532 19.489 27.272
113 HD22 LEU 17 HD22 LEU 17 14.305 17.915 27.077
114 HD23 LEU 17 HD23 LEU 17 14.145 18.622 28.699
115 H GLY 18 H GLY 18 15.328 24.076 26.584
116 HA2 GLY 18 HA2 GLY 18 15.878 26.252 27.057
117 HA3 GLY 18 HA3 GLY 18 15.484 25.983 28.756
118 H LEU 19 H LEU 19 17.910 23.884 27.291
119 HA LEU 19 HA LEU 19 20.095 25.678 28.188
120 HB2 LEU 19 HB2 LEU 19 21.462 23.822 28.964
121 HB3 LEU 19 HB3 LEU 19 20.083 24.147 29.965
122 HG LEU 19 HG LEU 19 20.943 21.674 29.373
123 HD11 LEU 19 HD11 LEU 19 19.145 22.181 30.956
124 HD12 LEU 19 HD12 LEU 19 18.011 22.473 29.629
125 HD13 LEU 19 HD13 LEU 19 18.666 20.841 29.910
126 HD21 LEU 19 HD21 LEU 19 18.858 22.086 27.246
127 HD22 LEU 19 HD22 LEU 19 20.598 21.888 26.963
128 HD23 LEU 19 HD23 LEU 19 19.656 20.576 27.694
129 H LEU 20 H LEU 20 22.244 24.835 27.389
130 HA LEU 20 HA LEU 20 22.149 24.994 24.440
131 HB2 LEU 20 HB2 LEU 20 23.411 26.715 25.460
132 HB3 LEU 20 HB3 LEU 20 24.075 25.642 26.677
133 HG LEU 20 HG LEU 20 25.534 24.571 24.947
134 HD11 LEU 20 HD11 LEU 20 24.230 25.249 22.903
135 HD12 LEU 20 HD12 LEU 20 24.710 26.937 23.222
136 HD13 LEU 20 HD13 LEU 20 25.932 25.717 22.844
137 HD21 LEU 20 HD21 LEU 20 26.365 26.335 26.448
138 HD22 LEU 20 HD22 LEU 20 27.113 26.456 24.849
139 HD23 LEU 20 HD23 LEU 20 25.817 27.581 25.307
140 H GLY 21 H GLY 21 22.761 23.356 23.125
141 HA2 GLY 21 HA2 GLY 21 23.918 20.835 24.145
142 HA3 GLY 21 HA3 GLY 21 23.499 21.234 22.478
143 H LYS 22 H LYS 22 26.032 20.607 24.474
144 HA LYS 22 HA LYS 22 27.968 22.266 22.877
145 HB2 LYS 22 HB2 LYS 22 27.732 22.819 25.328
146 HB3 LYS 22 HB3 LYS 22 28.393 21.213 25.688
147 HG2 LYS 22 HG2 LYS 22 30.448 21.836 24.336
148 HG3 LYS 22 HG3 LYS 22 29.735 23.431 24.080
149 HD2 LYS 22 HD2 LYS 22 31.335 23.627 25.799
150 HD3 LYS 22 HD3 LYS 22 29.763 23.782 26.581
151 HE2 LYS 22 HE2 LYS 22 29.897 21.523 27.480
152 HE3 LYS 22 HE3 LYS 22 31.253 21.128 26.416
153 HZ1 LYS 22 HZ1 LYS 22 32.586 22.779 27.607
154 HZ2 LYS 22 HZ2 LYS 22 31.369 23.065 28.658
155 HZ3 LYS 22 HZ3 LYS 22 32.094 21.574 28.614
156 H CYS 23 H CYS 23 29.494 21.335 21.712
157 HA CYS 23 HA CYS 23 29.832 18.438 21.693
158 HB2 CYS 23 HB2 CYS 23 31.056 20.682 20.082
159 HB3 CYS 23 HB3 CYS 23 31.450 18.982 19.874
160 H ILE 24 H ILE 24 31.422 17.309 22.623
161 HA ILE 24 HA ILE 24 34.052 18.527 23.278
162 HB ILE 24 HB ILE 24 32.323 16.789 25.088
163 HG12 ILE 24 HG12 ILE 24 31.815 19.233 25.178
164 HG13 ILE 24 HG13 ILE 24 32.330 18.517 26.668
165 HG21 ILE 24 HG21 ILE 24 34.558 15.907 25.287
166 HG22 ILE 24 HG22 ILE 24 35.261 17.531 25.430
167 HG23 ILE 24 HG23 ILE 24 34.223 16.870 26.716
168 HD11 ILE 24 HD11 ILE 24 33.332 20.780 26.274
169 HD12 ILE 24 HD12 ILE 24 34.574 19.542 26.445
170 HD13 ILE 24 HD13 ILE 24 34.149 20.162 24.831
171 H GLY 25 H GLY 25 35.603 17.346 22.287
172 HA2 GLY 25 HA2 GLY 25 36.699 15.574 21.299
173 HA3 GLY 25 HA3 GLY 25 35.841 14.510 22.420
174 H GLU 26 H GLU 26 34.360 16.567 19.934
175 HA GLU 26 HA GLU 26 32.919 16.202 18.293
176 HB2 GLU 26 HB2 GLU 26 34.775 13.895 17.717
177 HB3 GLU 26 HB3 GLU 26 33.488 14.405 16.618
178 HG2 GLU 26 HG2 GLU 26 34.442 16.538 16.252
179 HG3 GLU 26 HG3 GLU 26 35.494 16.440 17.656
180 H GLU 27 H GLU 27 32.494 14.464 20.928
181 HA GLU 27 HA GLU 27 29.876 13.344 20.052
182 HB2 GLU 27 HB2 GLU 27 31.289 13.411 22.748
183 HB3 GLU 27 HB3 GLU 27 29.706 12.726 22.444
184 HG2 GLU 27 HG2 GLU 27 30.700 11.028 20.939
185 HG3 GLU 27 HG3 GLU 27 32.312 11.690 21.252
186 H CYS 28 H CYS 28 27.950 14.251 21.390
187 HA CYS 28 HA CYS 28 28.455 16.972 22.457
188 HB2 CYS 28 HB2 CYS 28 27.903 17.105 20.061
189 HB3 CYS 28 HB3 CYS 28 26.351 16.346 20.365
190 H LYS 29 H LYS 29 27.271 17.619 24.092
191 HA LYS 29 HA LYS 29 24.958 16.096 25.192
192 HB2 LYS 29 HB2 LYS 29 27.200 15.051 25.934
193 HB3 LYS 29 HB3 LYS 29 27.577 16.579 26.698
194 HG2 LYS 29 HG2 LYS 29 26.836 15.241 28.451
195 HG3 LYS 29 HG3 LYS 29 25.455 16.266 28.110
196 HD2 LYS 29 HD2 LYS 29 24.658 14.037 28.508
197 HD3 LYS 29 HD3 LYS 29 24.459 14.335 26.772
198 HE2 LYS 29 HE2 LYS 29 26.507 13.068 26.289
199 HE3 LYS 29 HE3 LYS 29 26.831 12.864 28.016
200 HZ1 LYS 29 HZ1 LYS 29 24.421 11.781 26.654
201 HZ2 LYS 29 HZ2 LYS 29 25.772 10.935 26.907
202 HZ3 LYS 29 HZ3 LYS 29 24.882 11.477 28.200
203 H CYS 30 H CYS 30 23.699 17.487 26.757
204 HA CYS 30 HA CYS 30 24.163 20.289 26.228
205 HB2 CYS 30 HB2 CYS 30 22.255 19.337 28.316
206 HB3 CYS 30 HB3 CYS 30 22.209 20.735 27.284
207 H VAL 31 H VAL 31 24.179 21.945 28.002
208 HA VAL 31 HA VAL 31 25.955 21.132 30.284
209 HB VAL 31 HB VAL 31 26.796 23.456 30.291
210 HG11 VAL 31 HG11 VAL 31 28.032 21.718 29.092
211 HG12 VAL 31 HG12 VAL 31 27.125 22.085 27.606
212 HG13 VAL 31 HG13 VAL 31 28.202 23.304 28.329
213 HG21 VAL 31 HG21 VAL 31 24.854 24.572 29.256
214 HG22 VAL 31 HG22 VAL 31 26.401 24.991 28.519
215 HG23 VAL 31 HG23 VAL 31 25.308 23.859 27.688
216 HA PRO 32 HA PRO 32 22.996 23.247 33.072
217 HB2 PRO 32 HB2 PRO 32 24.602 24.042 35.102
218 HB3 PRO 32 HB3 PRO 32 24.201 22.323 34.828
219 HG2 PRO 32 HG2 PRO 32 26.716 23.798 33.954
220 HG3 PRO 32 HG3 PRO 32 26.587 22.224 34.798
221 HD2 PRO 32 HD2 PRO 32 26.883 22.426 32.089
222 HD3 PRO 32 HD3 PRO 32 25.947 21.106 32.845
223 H TYR 33 H TYR 33 22.702 24.692 31.275
224 HA TYR 33 HA TYR 33 24.365 26.854 30.526
225 HB2 TYR 33 HB2 TYR 33 22.725 25.810 29.078
226 HB3 TYR 33 HB3 TYR 33 21.412 26.320 30.135
227 HD1 TYR 33 HD2 TYR 33 24.320 28.033 28.395
228 HD2 TYR 33 HD1 TYR 33 20.084 27.980 29.221
229 HE1 TYR 33 HE2 TYR 33 24.013 30.048 26.973
230 HE2 TYR 33 HE1 TYR 33 19.771 29.959 27.742
231 HH TYR 33 HH TYR 33 22.535 31.640 26.231
Start of MODEL 4
1 H1 GLY 1 H1 GLY 1 40.100 15.122 14.343
2 H2 GLY 1 H2 GLY 1 40.936 14.325 13.137
3 H3 GLY 1 H3 GLY 1 41.071 13.841 14.710
4 HA2 GLY 1 HA2 GLY 1 39.678 12.329 13.500
5 HA3 GLY 1 HA3 GLY 1 38.812 13.165 14.813
6 H SER 2 H SER 2 36.830 13.553 14.169
7 HA SER 2 HA SER 2 36.038 13.536 11.428
8 HB2 SER 2 HB2 SER 2 34.429 14.198 13.923
9 HB3 SER 2 HB3 SER 2 33.777 13.732 12.324
10 HG SER 2 HG SER 2 33.883 11.834 13.247
11 H ALA 3 H ALA 3 34.297 15.067 10.577
12 HA ALA 3 HA ALA 3 35.457 17.767 10.404
13 HB1 ALA 3 HB1 ALA 3 34.795 16.535 8.367
14 HB2 ALA 3 HB2 ALA 3 33.109 16.505 8.922
15 HB3 ALA 3 HB3 ALA 3 33.896 18.046 8.553
16 H PHE 4 H PHE 4 35.061 18.234 12.605
17 HA PHE 4 HA PHE 4 34.104 19.306 14.311
18 HB2 PHE 4 HB2 PHE 4 32.939 20.557 12.281
19 HB3 PHE 4 HB3 PHE 4 31.497 19.821 12.932
20 HD1 PHE 4 HD1 PHE 4 30.657 20.524 15.202
21 HD2 PHE 4 HD2 PHE 4 34.171 22.290 13.430
22 HE1 PHE 4 HE1 PHE 4 30.514 22.422 16.793
23 HE2 PHE 4 HE2 PHE 4 34.025 24.179 15.028
24 HZ PHE 4 HZ PHE 4 32.187 24.252 16.710
25 H CYS 5 H CYS 5 32.803 18.943 16.138
26 HA CYS 5 HA CYS 5 32.239 16.280 16.698
27 HB2 CYS 5 HB2 CYS 5 31.549 17.141 18.808
28 HB3 CYS 5 HB3 CYS 5 32.879 18.135 18.248
29 H ASN 6 H ASN 6 30.224 15.371 17.609
30 HA ASN 6 HA ASN 6 27.953 15.519 15.804
31 HB2 ASN 6 HB2 ASN 6 28.577 13.445 16.961
32 HB3 ASN 6 HB3 ASN 6 28.345 14.214 18.532
33 HD21 ASN 6 HD22 ASN 6 26.965 12.144 18.646
34 HD22 ASN 6 HD21 ASN 6 25.300 12.316 18.106
35 H LEU 7 H LEU 7 26.687 17.249 15.728
36 HA LEU 7 HA LEU 7 25.714 18.499 18.226
37 HB2 LEU 7 HB2 LEU 7 27.983 19.465 17.394
38 HB3 LEU 7 HB3 LEU 7 27.048 20.192 16.101
39 HG LEU 7 HG LEU 7 25.666 21.397 17.847
40 HD11 LEU 7 HD11 LEU 7 27.733 20.191 19.750
41 HD12 LEU 7 HD12 LEU 7 26.637 21.532 20.151
42 HD13 LEU 7 HD13 LEU 7 25.976 19.935 19.809
43 HD21 LEU 7 HD21 LEU 7 27.631 22.451 16.774
44 HD22 LEU 7 HD22 LEU 7 27.414 22.992 18.442
45 HD23 LEU 7 HD23 LEU 7 28.677 21.796 18.060
46 H ALA 8 H ALA 8 25.207 17.917 14.804
47 HA ALA 8 HA ALA 8 23.724 20.156 14.107
48 HB1 ALA 8 HB1 ALA 8 22.977 18.819 12.185
49 HB2 ALA 8 HB2 ALA 8 24.695 18.549 12.525
50 HB3 ALA 8 HB3 ALA 8 23.493 17.324 12.998
51 H ALA 9 H ALA 9 22.329 17.039 15.264
52 HA ALA 9 HA ALA 9 19.673 18.324 15.608
53 HB1 ALA 9 HB1 ALA 9 18.853 16.030 15.917
54 HB2 ALA 9 HB2 ALA 9 19.737 16.193 14.380
55 HB3 ALA 9 HB3 ALA 9 20.513 15.412 15.775
56 H CYS 10 H CYS 10 22.470 17.829 17.331
57 HA CYS 10 HA CYS 10 21.539 17.085 19.937
58 HB2 CYS 10 HB2 CYS 10 23.931 17.033 19.010
59 HB3 CYS 10 HB3 CYS 10 23.951 18.775 19.282
60 H GLU 11 H GLU 11 22.399 20.331 18.565
61 HA GLU 11 HA GLU 11 21.461 21.986 20.665
62 HB2 GLU 11 HB2 GLU 11 21.727 22.239 17.670
63 HB3 GLU 11 HB3 GLU 11 20.830 23.495 18.516
64 HG2 GLU 11 HG2 GLU 11 23.576 22.707 19.524
65 HG3 GLU 11 HG3 GLU 11 23.416 23.737 18.114
66 H LEU 12 H LEU 12 19.583 20.613 17.954
67 HA LEU 12 HA LEU 12 17.089 21.818 18.585
68 HB2 LEU 12 HB2 LEU 12 17.486 19.092 17.284
69 HB3 LEU 12 HB3 LEU 12 16.124 20.187 17.088
70 HG LEU 12 HG LEU 12 18.960 20.623 16.044
71 HD11 LEU 12 HD11 LEU 12 17.582 18.937 14.822
72 HD12 LEU 12 HD12 LEU 12 16.320 20.161 14.593
73 HD13 LEU 12 HD13 LEU 12 17.921 20.374 13.846
74 HD21 LEU 12 HD21 LEU 12 17.992 22.591 14.868
75 HD22 LEU 12 HD22 LEU 12 16.475 22.376 15.767
76 HD23 LEU 12 HD23 LEU 12 17.975 22.806 16.621
77 H SER 13 H SER 13 18.706 19.093 19.996
78 HA SER 13 HA SER 13 16.322 18.061 21.423
79 HB2 SER 13 HB2 SER 13 19.185 17.035 21.418
80 HB3 SER 13 HB3 SER 13 17.739 16.206 22.004
81 HG SER 13 HG SER 13 18.406 16.926 19.331
82 H CYS 14 H CYS 14 19.371 19.833 22.119
83 HA CYS 14 HA CYS 14 19.195 19.782 24.959
84 HB2 CYS 14 HB2 CYS 14 20.264 21.955 23.119
85 HB3 CYS 14 HB3 CYS 14 20.643 21.758 24.826
86 H ARG 15 H ARG 15 17.399 21.627 22.578
87 HA ARG 15 HA ARG 15 16.445 23.789 24.059
88 HB2 ARG 15 HB2 ARG 15 16.005 22.739 21.523
89 HB3 ARG 15 HB3 ARG 15 14.446 22.480 22.279
90 HG2 ARG 15 HG2 ARG 15 14.111 24.563 21.402
91 HG3 ARG 15 HG3 ARG 15 14.704 25.041 22.993
92 HD2 ARG 15 HD2 ARG 15 16.257 24.874 20.382
93 HD3 ARG 15 HD3 ARG 15 15.764 26.362 21.205
94 HE ARG 15 HE ARG 15 17.291 25.421 23.135
95 HH11 ARG 15 HH11 ARG 15 18.183 25.369 19.700
96 HH12 ARG 15 HH12 ARG 15 19.834 24.922 20.147
97 HH21 ARG 15 HH21 ARG 15 19.401 24.755 23.464
98 HH22 ARG 15 HH22 ARG 15 20.450 24.640 22.042
99 H SER 16 H SER 16 14.940 20.540 23.974
100 HA SER 16 HA SER 16 12.991 21.286 26.002
101 HB2 SER 16 HB2 SER 16 12.400 18.876 26.014
102 HB3 SER 16 HB3 SER 16 12.291 19.673 24.442
103 HG SER 16 HG SER 16 14.091 18.688 23.745
104 H LEU 17 H LEU 17 16.262 20.716 26.397
105 HA LEU 17 HA LEU 17 15.923 19.947 29.256
106 HB2 LEU 17 HB2 LEU 17 18.501 20.578 27.784
107 HB3 LEU 17 HB3 LEU 17 18.315 19.816 29.364
108 HG LEU 17 HG LEU 17 17.540 18.570 26.692
109 HD11 LEU 17 HD11 LEU 17 19.824 17.920 28.584
110 HD12 LEU 17 HD12 LEU 17 19.451 17.108 27.050
111 HD13 LEU 17 HD13 LEU 17 19.980 18.801 27.047
112 HD21 LEU 17 HD21 LEU 17 16.125 17.711 28.533
113 HD22 LEU 17 HD22 LEU 17 17.272 16.478 27.991
114 HD23 LEU 17 HD23 LEU 17 17.573 17.377 29.497
115 H GLY 18 H GLY 18 16.223 22.734 27.200
116 HA2 GLY 18 HA2 GLY 18 16.220 24.998 27.723
117 HA3 GLY 18 HA3 GLY 18 16.409 24.635 29.447
118 H LEU 19 H LEU 19 18.598 23.084 27.214
119 HA LEU 19 HA LEU 19 20.848 24.839 28.138
120 HB2 LEU 19 HB2 LEU 19 20.771 21.931 27.332
121 HB3 LEU 19 HB3 LEU 19 22.272 22.878 27.374
122 HG LEU 19 HG LEU 19 22.437 22.845 29.639
123 HD11 LEU 19 HD11 LEU 19 19.473 22.293 30.019
124 HD12 LEU 19 HD12 LEU 19 20.678 22.510 31.304
125 HD13 LEU 19 HD13 LEU 19 20.267 23.869 30.270
126 HD21 LEU 19 HD21 LEU 19 21.790 20.637 30.551
127 HD22 LEU 19 HD22 LEU 19 20.973 20.309 28.999
128 HD23 LEU 19 HD23 LEU 19 22.728 20.647 29.077
129 H LEU 20 H LEU 20 22.494 25.211 26.680
130 HA LEU 20 HA LEU 20 21.849 25.463 23.795
131 HB2 LEU 20 HB2 LEU 20 24.198 26.304 25.560
132 HB3 LEU 20 HB3 LEU 20 24.228 26.371 23.797
133 HG LEU 20 HG LEU 20 22.268 27.948 23.859
134 HD11 LEU 20 HD11 LEU 20 21.248 27.570 26.027
135 HD12 LEU 20 HD12 LEU 20 22.781 27.952 26.852
136 HD13 LEU 20 HD13 LEU 20 21.874 29.211 25.987
137 HD21 LEU 20 HD21 LEU 20 24.718 28.795 25.415
138 HD22 LEU 20 HD22 LEU 20 24.594 28.746 23.657
139 HD23 LEU 20 HD23 LEU 20 23.599 29.890 24.579
140 H GLY 21 H GLY 21 22.860 24.023 22.253
141 HA2 GLY 21 HA2 GLY 21 24.104 21.568 23.293
142 HA3 GLY 21 HA3 GLY 21 23.915 22.014 21.604
143 H LYS 22 H LYS 22 26.098 21.513 24.074
144 HA LYS 22 HA LYS 22 28.258 22.513 22.308
145 HB2 LYS 22 HB2 LYS 22 27.969 24.312 23.950
146 HB3 LYS 22 HB3 LYS 22 28.238 23.169 25.261
147 HG2 LYS 22 HG2 LYS 22 30.520 22.734 24.473
148 HG3 LYS 22 HG3 LYS 22 30.276 23.816 23.083
149 HD2 LYS 22 HD2 LYS 22 30.054 24.754 25.982
150 HD3 LYS 22 HD3 LYS 22 31.570 24.741 25.089
151 HE2 LYS 22 HE2 LYS 22 30.685 26.259 23.400
152 HE3 LYS 22 HE3 LYS 22 29.096 26.254 24.175
153 HZ1 LYS 22 HZ1 LYS 22 30.519 28.198 24.748
154 HZ2 LYS 22 HZ2 LYS 22 30.005 27.374 26.066
155 HZ3 LYS 22 HZ3 LYS 22 31.553 27.211 25.563
156 H CYS 23 H CYS 23 29.504 20.929 21.878
157 HA CYS 23 HA CYS 23 29.049 18.321 23.022
158 HB2 CYS 23 HB2 CYS 23 30.575 17.630 21.142
159 HB3 CYS 23 HB3 CYS 23 29.147 18.540 20.676
160 H ILE 24 H ILE 24 30.502 16.835 23.846
161 HA ILE 24 HA ILE 24 33.070 17.821 25.020
162 HB ILE 24 HB ILE 24 30.864 16.298 26.448
163 HG12 ILE 24 HG12 ILE 24 30.298 18.707 26.225
164 HG13 ILE 24 HG13 ILE 24 30.483 18.155 27.864
165 HG21 ILE 24 HG21 ILE 24 32.294 16.587 28.494
166 HG22 ILE 24 HG22 ILE 24 32.962 15.489 27.288
167 HG23 ILE 24 HG23 ILE 24 33.613 17.134 27.437
168 HD11 ILE 24 HD11 ILE 24 32.658 19.258 28.064
169 HD12 ILE 24 HD12 ILE 24 32.630 19.701 26.342
170 HD13 ILE 24 HD13 ILE 24 31.457 20.410 27.466
171 H GLY 25 H GLY 25 34.718 16.358 24.826
172 HA2 GLY 25 HA2 GLY 25 35.850 14.507 24.037
173 HA3 GLY 25 HA3 GLY 25 34.472 13.506 24.525
174 H GLU 26 H GLU 26 34.382 16.155 22.203
175 HA GLU 26 HA GLU 26 33.343 16.439 20.281
176 HB2 GLU 26 HB2 GLU 26 34.804 13.973 19.330
177 HB3 GLU 26 HB3 GLU 26 34.226 15.349 18.367
178 HG2 GLU 26 HG2 GLU 26 35.704 16.796 19.950
179 HG3 GLU 26 HG3 GLU 26 36.482 15.280 20.404
180 H GLU 27 H GLU 27 31.943 14.440 22.200
181 HA GLU 27 HA GLU 27 29.901 13.302 20.378
182 HB2 GLU 27 HB2 GLU 27 30.436 12.992 23.351
183 HB3 GLU 27 HB3 GLU 27 29.179 12.162 22.473
184 HG2 GLU 27 HG2 GLU 27 32.079 11.793 21.644
185 HG3 GLU 27 HG3 GLU 27 31.447 10.967 23.052
186 H CYS 28 H CYS 28 27.604 13.642 20.931
187 HA CYS 28 HA CYS 28 26.893 16.359 21.373
188 HB2 CYS 28 HB2 CYS 28 25.516 15.029 19.976
189 HB3 CYS 28 HB3 CYS 28 25.337 13.770 21.206
190 H LYS 29 H LYS 29 26.743 17.426 23.129
191 HA LYS 29 HA LYS 29 25.419 16.505 25.571
192 HB2 LYS 29 HB2 LYS 29 28.289 17.557 25.501
193 HB3 LYS 29 HB3 LYS 29 27.285 17.673 26.930
194 HG2 LYS 29 HG2 LYS 29 28.240 15.109 25.617
195 HG3 LYS 29 HG3 LYS 29 28.768 15.798 27.151
196 HD2 LYS 29 HD2 LYS 29 26.425 15.540 28.028
197 HD3 LYS 29 HD3 LYS 29 26.006 14.639 26.565
198 HE2 LYS 29 HE2 LYS 29 28.089 13.872 28.651
199 HE3 LYS 29 HE3 LYS 29 26.497 13.153 28.435
200 HZ1 LYS 29 HZ1 LYS 29 28.747 13.027 26.509
201 HZ2 LYS 29 HZ2 LYS 29 28.158 11.798 27.406
202 HZ3 LYS 29 HZ3 LYS 29 27.228 12.419 26.199
203 H CYS 30 H CYS 30 24.937 18.426 27.044
204 HA CYS 30 HA CYS 30 24.688 20.944 25.504
205 HB2 CYS 30 HB2 CYS 30 22.607 19.678 27.280
206 HB3 CYS 30 HB3 CYS 30 22.430 21.068 26.212
207 H VAL 31 H VAL 31 24.304 22.823 26.882
208 HA VAL 31 HA VAL 31 25.460 22.779 29.643
209 HB VAL 31 HB VAL 31 26.945 24.640 28.961
210 HG11 VAL 31 HG11 VAL 31 27.395 22.218 27.190
211 HG12 VAL 31 HG12 VAL 31 28.603 23.394 27.731
212 HG13 VAL 31 HG13 VAL 31 27.819 22.325 28.905
213 HG21 VAL 31 HG21 VAL 31 27.230 25.016 26.437
214 HG22 VAL 31 HG22 VAL 31 25.642 24.188 26.274
215 HG23 VAL 31 HG23 VAL 31 25.773 25.664 27.199
216 HA PRO 32 HA PRO 32 22.284 25.720 30.311
217 HB2 PRO 32 HB2 PRO 32 23.083 27.224 32.446
218 HB3 PRO 32 HB3 PRO 32 22.745 25.470 32.552
219 HG2 PRO 32 HG2 PRO 32 25.440 26.822 32.212
220 HG3 PRO 32 HG3 PRO 32 24.980 25.550 33.395
221 HD2 PRO 32 HD2 PRO 32 26.234 24.964 31.028
222 HD3 PRO 32 HD3 PRO 32 24.997 23.874 31.732
223 H TYR 33 H TYR 33 25.323 27.105 29.287
224 HA TYR 33 HA TYR 33 24.091 29.633 28.446
225 HB2 TYR 33 HB2 TYR 33 25.207 31.043 29.848
226 HB3 TYR 33 HB3 TYR 33 24.864 29.739 30.958
227 HD1 TYR 33 HD1 TYR 33 27.024 27.782 30.559
228 HD2 TYR 33 HD2 TYR 33 27.194 32.076 30.339
229 HE1 TYR 33 HE1 TYR 33 29.431 27.732 31.215
230 HE2 TYR 33 HE2 TYR 33 29.592 32.014 30.953
231 HH TYR 33 HH TYR 33 31.380 30.725 31.447
Start of MODEL 5
1 H1 GLY 1 H1 GLY 1 33.487 14.756 6.001
2 H2 GLY 1 H2 GLY 1 31.944 15.258 5.719
3 H3 GLY 1 H3 GLY 1 32.383 14.836 7.237
4 HA2 GLY 1 HA2 GLY 1 33.471 17.115 5.741
5 HA3 GLY 1 HA3 GLY 1 32.237 17.213 7.014
6 H SER 2 H SER 2 33.393 18.385 8.527
7 HA SER 2 HA SER 2 36.169 17.587 9.183
8 HB2 SER 2 HB2 SER 2 36.291 19.772 10.262
9 HB3 SER 2 HB3 SER 2 35.778 19.884 8.575
10 HG SER 2 HG SER 2 34.604 20.971 10.542
11 H ALA 3 H ALA 3 33.004 17.371 10.661
12 HA ALA 3 HA ALA 3 34.300 16.469 13.204
13 HB1 ALA 3 HB1 ALA 3 33.289 18.713 13.452
14 HB2 ALA 3 HB2 ALA 3 31.726 18.059 12.918
15 HB3 ALA 3 HB3 ALA 3 32.460 17.491 14.434
16 H PHE 4 H PHE 4 33.575 14.677 14.134
17 HA PHE 4 HA PHE 4 31.578 12.997 12.754
18 HB2 PHE 4 HB2 PHE 4 33.842 12.145 13.482
19 HB3 PHE 4 HB3 PHE 4 33.322 12.371 15.149
20 HD1 PHE 4 HD2 PHE 4 32.164 10.723 11.957
21 HD2 PHE 4 HD1 PHE 4 32.454 10.461 16.249
22 HE1 PHE 4 HE2 PHE 4 31.179 8.431 11.892
23 HE2 PHE 4 HE1 PHE 4 31.460 8.192 16.177
24 HZ PHE 4 HZ PHE 4 30.825 7.169 14.001
25 H CYS 5 H CYS 5 30.812 15.420 14.118
26 HA CYS 5 HA CYS 5 28.505 14.382 15.586
27 HB2 CYS 5 HB2 CYS 5 30.281 14.696 17.314
28 HB3 CYS 5 HB3 CYS 5 30.386 16.397 16.876
29 H ASN 6 H ASN 6 26.775 15.415 14.860
30 HA ASN 6 HA ASN 6 27.014 17.979 13.402
31 HB2 ASN 6 HB2 ASN 6 25.789 16.086 12.394
32 HB3 ASN 6 HB3 ASN 6 24.678 16.058 13.768
33 HD21 ASN 6 HD22 ASN 6 25.834 18.054 11.047
34 HD22 ASN 6 HD21 ASN 6 24.335 18.984 10.919
35 H LEU 7 H LEU 7 26.429 19.944 14.253
36 HA LEU 7 HA LEU 7 25.813 19.964 17.099
37 HB2 LEU 7 HB2 LEU 7 27.473 21.484 15.961
38 HB3 LEU 7 HB3 LEU 7 26.113 22.312 15.197
39 HG LEU 7 HG LEU 7 25.246 22.921 17.475
40 HD11 LEU 7 HD11 LEU 7 26.220 21.162 18.879
41 HD12 LEU 7 HD12 LEU 7 27.868 21.676 18.430
42 HD13 LEU 7 HD13 LEU 7 26.825 22.729 19.407
43 HD21 LEU 7 HD21 LEU 7 26.666 24.470 16.216
44 HD22 LEU 7 HD22 LEU 7 26.973 24.608 17.951
45 HD23 LEU 7 HD23 LEU 7 28.128 23.731 16.915
46 H ALA 8 H ALA 8 23.980 20.677 14.122
47 HA ALA 8 HA ALA 8 21.689 21.818 15.411
48 HB1 ALA 8 HB1 ALA 8 21.902 20.245 12.807
49 HB2 ALA 8 HB2 ALA 8 20.521 21.233 13.323
50 HB3 ALA 8 HB3 ALA 8 22.086 22.001 13.001
51 H ALA 9 H ALA 9 22.401 18.364 14.566
52 HA ALA 9 HA ALA 9 20.103 17.242 15.796
53 HB1 ALA 9 HB1 ALA 9 22.885 16.067 15.424
54 HB2 ALA 9 HB2 ALA 9 21.394 15.149 15.720
55 HB3 ALA 9 HB3 ALA 9 21.579 16.066 14.216
56 H CYS 10 H CYS 10 22.672 18.833 17.345
57 HA CYS 10 HA CYS 10 22.339 17.433 19.947
58 HB2 CYS 10 HB2 CYS 10 24.628 17.831 19.111
59 HB3 CYS 10 HB3 CYS 10 24.332 19.565 19.131
60 H GLU 11 H GLU 11 21.924 20.724 18.448
61 HA GLU 11 HA GLU 11 20.475 21.881 20.646
62 HB2 GLU 11 HB2 GLU 11 20.099 22.253 17.650
63 HB3 GLU 11 HB3 GLU 11 19.321 23.223 18.907
64 HG2 GLU 11 HG2 GLU 11 22.334 23.049 18.670
65 HG3 GLU 11 HG3 GLU 11 21.361 24.232 17.795
66 H LEU 12 H LEU 12 19.321 19.813 17.918
67 HA LEU 12 HA LEU 12 16.608 19.626 18.775
68 HB2 LEU 12 HB2 LEU 12 18.367 17.693 17.229
69 HB3 LEU 12 HB3 LEU 12 16.626 17.504 17.412
70 HG LEU 12 HG LEU 12 17.988 19.850 16.010
71 HD11 LEU 12 HD11 LEU 12 17.053 18.876 13.976
72 HD12 LEU 12 HD12 LEU 12 18.097 17.688 14.767
73 HD13 LEU 12 HD13 LEU 12 16.334 17.546 14.910
74 HD21 LEU 12 HD21 LEU 12 15.058 19.178 16.419
75 HD22 LEU 12 HD22 LEU 12 15.913 20.637 16.966
76 HD23 LEU 12 HD23 LEU 12 15.672 20.361 15.244
77 H SER 13 H SER 13 19.369 18.280 20.325
78 HA SER 13 HA SER 13 17.711 16.364 21.914
79 HB2 SER 13 HB2 SER 13 20.721 16.757 21.943
80 HB3 SER 13 HB3 SER 13 19.788 15.480 22.743
81 HG SER 13 HG SER 13 20.022 15.943 19.935
82 H CYS 14 H CYS 14 19.450 19.424 22.198
83 HA CYS 14 HA CYS 14 19.114 19.480 25.145
84 HB2 CYS 14 HB2 CYS 14 20.791 21.050 23.163
85 HB3 CYS 14 HB3 CYS 14 20.774 21.368 24.882
86 H ARG 15 H ARG 15 18.260 21.537 22.311
87 HA ARG 15 HA ARG 15 17.798 23.904 23.723
88 HB2 ARG 15 HB2 ARG 15 18.201 23.637 21.279
89 HB3 ARG 15 HB3 ARG 15 16.583 22.966 21.083
90 HG2 ARG 15 HG2 ARG 15 16.731 25.311 20.366
91 HG3 ARG 15 HG3 ARG 15 15.553 25.074 21.648
92 HD2 ARG 15 HD2 ARG 15 16.817 27.132 21.999
93 HD3 ARG 15 HD3 ARG 15 17.125 25.988 23.312
94 HE ARG 15 HE ARG 15 19.130 25.742 21.235
95 HH11 ARG 15 HH21 ARG 15 18.288 28.005 23.815
96 HH12 ARG 15 HH22 ARG 15 19.945 28.640 23.788
97 HH21 ARG 15 HH11 ARG 15 21.088 26.483 21.443
98 HH22 ARG 15 HH12 ARG 15 21.423 27.853 22.544
99 H SER 16 H SER 16 15.486 21.310 23.153
100 HA SER 16 HA SER 16 13.088 22.598 23.994
101 HB2 SER 16 HB2 SER 16 12.355 20.228 24.509
102 HB3 SER 16 HB3 SER 16 12.950 20.510 22.866
103 HG SER 16 HG SER 16 14.805 19.490 23.302
104 H LEU 17 H LEU 17 15.815 21.557 25.914
105 HA LEU 17 HA LEU 17 14.351 21.650 28.475
106 HB2 LEU 17 HB2 LEU 17 17.333 21.393 28.090
107 HB3 LEU 17 HB3 LEU 17 16.366 20.880 29.463
108 HG LEU 17 HG LEU 17 16.484 19.616 26.704
109 HD11 LEU 17 HD11 LEU 17 17.521 17.726 27.868
110 HD12 LEU 17 HD12 LEU 17 18.457 19.206 28.112
111 HD13 LEU 17 HD13 LEU 17 17.417 18.600 29.418
112 HD21 LEU 17 HD21 LEU 17 15.098 17.783 27.674
113 HD22 LEU 17 HD22 LEU 17 14.890 18.737 29.163
114 HD23 LEU 17 HD23 LEU 17 14.212 19.306 27.621
115 H GLY 18 H GLY 18 15.634 23.999 26.427
116 HA2 GLY 18 HA2 GLY 18 15.852 26.271 26.784
117 HA3 GLY 18 HA3 GLY 18 15.654 26.040 28.519
118 H LEU 19 H LEU 19 18.168 24.046 27.234
119 HA LEU 19 HA LEU 19 20.229 26.149 27.719
120 HB2 LEU 19 HB2 LEU 19 21.798 24.451 28.517
121 HB3 LEU 19 HB3 LEU 19 20.474 24.784 29.587
122 HG LEU 19 HG LEU 19 21.419 22.336 29.179
123 HD11 LEU 19 HD11 LEU 19 19.239 21.420 29.912
124 HD12 LEU 19 HD12 LEU 19 19.690 22.882 30.801
125 HD13 LEU 19 HD13 LEU 19 18.463 22.973 29.525
126 HD21 LEU 19 HD21 LEU 19 20.914 22.321 26.756
127 HD22 LEU 19 HD22 LEU 19 20.154 20.999 27.659
128 HD23 LEU 19 HD23 LEU 19 19.190 22.384 27.141
129 H LEU 20 H LEU 20 22.396 25.459 26.750
130 HA LEU 20 HA LEU 20 21.957 25.331 23.839
131 HB2 LEU 20 HB2 LEU 20 23.200 27.211 24.778
132 HB3 LEU 20 HB3 LEU 20 24.260 26.120 25.654
133 HG LEU 20 HG LEU 20 25.147 25.279 23.460
134 HD11 LEU 20 HD11 LEU 20 23.739 27.770 22.389
135 HD12 LEU 20 HD12 LEU 20 24.885 26.753 21.497
136 HD13 LEU 20 HD13 LEU 20 23.325 26.087 21.982
137 HD21 LEU 20 HD21 LEU 20 25.508 28.235 24.066
138 HD22 LEU 20 HD22 LEU 20 26.371 26.888 24.852
139 HD23 LEU 20 HD23 LEU 20 26.621 27.215 23.132
140 H GLY 21 H GLY 21 22.588 23.648 22.545
141 HA2 GLY 21 HA2 GLY 21 23.820 21.239 23.679
142 HA3 GLY 21 HA3 GLY 21 23.406 21.540 21.989
143 H LYS 22 H LYS 22 25.897 20.742 23.727
144 HA LYS 22 HA LYS 22 27.885 22.065 21.914
145 HB2 LYS 22 HB2 LYS 22 27.813 23.096 24.237
146 HB3 LYS 22 HB3 LYS 22 28.356 21.544 24.877
147 HG2 LYS 22 HG2 LYS 22 30.447 21.740 23.560
148 HG3 LYS 22 HG3 LYS 22 29.868 23.261 22.845
149 HD2 LYS 22 HD2 LYS 22 29.747 24.289 25.106
150 HD3 LYS 22 HD3 LYS 22 30.364 22.791 25.822
151 HE2 LYS 22 HE2 LYS 22 32.453 23.023 24.499
152 HE3 LYS 22 HE3 LYS 22 31.827 24.503 23.760
153 HZ1 LYS 22 HZ1 LYS 22 31.767 25.511 25.976
154 HZ2 LYS 22 HZ2 LYS 22 32.343 24.138 26.663
155 HZ3 LYS 22 HZ3 LYS 22 33.292 24.984 25.607
156 H CYS 23 H CYS 23 29.664 20.637 21.307
157 HA CYS 23 HA CYS 23 29.193 17.783 22.115
158 HB2 CYS 23 HB2 CYS 23 28.234 18.351 19.889
159 HB3 CYS 23 HB3 CYS 23 29.880 18.602 19.299
160 H ILE 24 H ILE 24 30.785 16.796 22.991
161 HA ILE 24 HA ILE 24 33.602 17.727 22.624
162 HB ILE 24 HB ILE 24 32.128 17.450 25.277
163 HG12 ILE 24 HG12 ILE 24 33.334 19.893 23.895
164 HG13 ILE 24 HG13 ILE 24 31.614 19.567 24.122
165 HG21 ILE 24 HG21 ILE 24 34.410 16.580 25.492
166 HG22 ILE 24 HG22 ILE 24 35.057 18.017 24.668
167 HG23 ILE 24 HG23 ILE 24 34.323 18.133 26.279
168 HD11 ILE 24 HD11 ILE 24 31.944 19.655 26.603
169 HD12 ILE 24 HD12 ILE 24 33.607 20.227 26.304
170 HD13 ILE 24 HD13 ILE 24 32.234 21.179 25.745
171 H GLY 25 H GLY 25 35.038 16.071 22.504
172 HA2 GLY 25 HA2 GLY 25 35.845 13.917 22.450
173 HA3 GLY 25 HA3 GLY 25 34.763 13.510 23.792
174 H GLU 26 H GLU 26 33.840 14.736 20.595
175 HA GLU 26 HA GLU 26 32.338 14.088 19.058
176 HB2 GLU 26 HB2 GLU 26 33.519 11.363 19.619
177 HB3 GLU 26 HB3 GLU 26 32.460 11.720 18.256
178 HG2 GLU 26 HG2 GLU 26 34.002 13.183 17.245
179 HG3 GLU 26 HG3 GLU 26 34.950 13.380 18.711
180 H GLU 27 H GLU 27 31.406 13.945 22.041
181 HA GLU 27 HA GLU 27 28.753 12.734 21.380
182 HB2 GLU 27 HB2 GLU 27 30.016 11.340 22.951
183 HB3 GLU 27 HB3 GLU 27 30.184 12.702 24.058
184 HG2 GLU 27 HG2 GLU 27 27.778 12.773 24.433
185 HG3 GLU 27 HG3 GLU 27 27.501 11.575 23.162
186 H CYS 28 H CYS 28 26.974 13.889 21.755
187 HA CYS 28 HA CYS 28 27.110 16.717 22.301
188 HB2 CYS 28 HB2 CYS 28 25.535 15.802 20.704
189 HB3 CYS 28 HB3 CYS 28 24.862 14.742 21.928
190 H LYS 29 H LYS 29 27.138 17.635 24.118
191 HA LYS 29 HA LYS 29 26.008 16.571 26.689
192 HB2 LYS 29 HB2 LYS 29 28.803 17.617 26.100
193 HB3 LYS 29 HB3 LYS 29 28.180 17.423 27.731
194 HG2 LYS 29 HG2 LYS 29 28.308 15.139 27.718
195 HG3 LYS 29 HG3 LYS 29 28.127 14.987 25.964
196 HD2 LYS 29 HD2 LYS 29 30.390 15.802 25.596
197 HD3 LYS 29 HD3 LYS 29 30.627 16.004 27.351
198 HE2 LYS 29 HE2 LYS 29 30.360 13.619 27.726
199 HE3 LYS 29 HE3 LYS 29 29.846 13.353 26.056
200 HZ1 LYS 29 HZ1 LYS 29 32.173 12.737 26.392
201 HZ2 LYS 29 HZ2 LYS 29 32.053 13.959 25.312
202 HZ3 LYS 29 HZ3 LYS 29 32.536 14.292 26.854
203 H CYS 30 H CYS 30 24.518 18.125 27.191
204 HA CYS 30 HA CYS 30 24.654 20.764 26.000
205 HB2 CYS 30 HB2 CYS 30 22.796 20.108 28.252
206 HB3 CYS 30 HB3 CYS 30 22.592 21.166 26.879
207 H VAL 31 H VAL 31 24.688 22.798 27.210
208 HA VAL 31 HA VAL 31 26.734 22.728 29.299
209 HB VAL 31 HB VAL 31 26.829 25.089 29.185
210 HG11 VAL 31 HG11 VAL 31 27.365 25.422 26.863
211 HG12 VAL 31 HG12 VAL 31 27.811 23.761 27.300
212 HG13 VAL 31 HG13 VAL 31 26.339 24.061 26.356
213 HG21 VAL 31 HG21 VAL 31 25.279 26.418 27.774
214 HG22 VAL 31 HG22 VAL 31 24.238 24.975 27.617
215 HG23 VAL 31 HG23 VAL 31 24.501 25.737 29.200
216 HA PRO 32 HA PRO 32 23.859 23.299 32.750
217 HB2 PRO 32 HB2 PRO 32 25.543 24.024 34.736
218 HB3 PRO 32 HB3 PRO 32 25.603 22.404 33.996
219 HG2 PRO 32 HG2 PRO 32 27.400 24.777 33.440
220 HG3 PRO 32 HG3 PRO 32 27.855 23.065 33.693
221 HD2 PRO 32 HD2 PRO 32 27.497 24.263 31.194
222 HD3 PRO 32 HD3 PRO 32 27.320 22.508 31.504
223 H TYR 33 H TYR 33 22.427 24.989 32.729
224 HA TYR 33 HA TYR 33 23.477 27.763 32.341
225 HB2 TYR 33 HB2 TYR 33 22.566 26.718 30.279
226 HB3 TYR 33 HB3 TYR 33 21.001 26.584 31.072
227 HD1 TYR 33 HD1 TYR 33 23.677 29.190 30.477
228 HD2 TYR 33 HD2 TYR 33 19.453 28.302 30.589
229 HE1 TYR 33 HE1 TYR 33 23.167 31.531 29.814
230 HE2 TYR 33 HE2 TYR 33 18.953 30.653 29.920
231 HH TYR 33 HH TYR 33 21.547 33.063 29.387
Start of MODEL 6
1 H1 GLY 1 H1 GLY 1 45.143 15.668 13.698
2 H2 GLY 1 H2 GLY 1 44.250 17.038 13.845
3 H3 GLY 1 H3 GLY 1 44.082 16.087 12.508
4 HA2 GLY 1 HA2 GLY 1 43.255 14.272 13.882
5 HA3 GLY 1 HA3 GLY 1 43.358 15.377 15.264
6 H SER 2 H SER 2 41.080 13.951 13.959
7 HA SER 2 HA SER 2 39.246 16.076 13.045
8 HB2 SER 2 HB2 SER 2 39.237 13.843 11.994
9 HB3 SER 2 HB3 SER 2 38.873 13.100 13.558
10 HG SER 2 HG SER 2 37.241 14.875 12.032
11 H ALA 3 H ALA 3 38.003 17.231 14.409
12 HA ALA 3 HA ALA 3 37.180 16.102 17.040
13 HB1 ALA 3 HB1 ALA 3 39.211 17.573 17.301
14 HB2 ALA 3 HB2 ALA 3 38.274 18.922 16.634
15 HB3 ALA 3 HB3 ALA 3 37.795 18.174 18.171
16 H PHE 4 H PHE 4 35.897 16.990 14.302
17 HA PHE 4 HA PHE 4 34.067 19.094 14.996
18 HB2 PHE 4 HB2 PHE 4 33.279 18.955 12.873
19 HB3 PHE 4 HB3 PHE 4 34.832 18.191 12.622
20 HD1 PHE 4 HD1 PHE 4 34.840 15.517 12.891
21 HD2 PHE 4 HD2 PHE 4 31.308 17.892 12.168
22 HE1 PHE 4 HE1 PHE 4 33.608 13.487 12.204
23 HE2 PHE 4 HE2 PHE 4 30.081 15.850 11.465
24 HZ PHE 4 HZ PHE 4 31.228 13.644 11.494
25 H CYS 5 H CYS 5 31.674 18.883 14.880
26 HA CYS 5 HA CYS 5 30.485 16.244 15.292
27 HB2 CYS 5 HB2 CYS 5 30.864 17.049 17.583
28 HB3 CYS 5 HB3 CYS 5 30.081 18.580 17.204
29 H ASN 6 H ASN 6 28.285 16.207 14.513
30 HA ASN 6 HA ASN 6 27.300 18.652 13.137
31 HB2 ASN 6 HB2 ASN 6 26.897 16.443 12.156
32 HB3 ASN 6 HB3 ASN 6 25.921 15.975 13.555
33 HD21 ASN 6 HD22 ASN 6 25.044 16.085 10.812
34 HD22 ASN 6 HD21 ASN 6 23.776 17.316 10.724
35 H LEU 7 H LEU 7 27.107 20.198 14.689
36 HA LEU 7 HA LEU 7 26.102 19.680 17.326
37 HB2 LEU 7 HB2 LEU 7 27.732 21.450 16.775
38 HB3 LEU 7 HB3 LEU 7 26.519 22.281 15.811
39 HG LEU 7 HG LEU 7 25.146 22.675 17.849
40 HD11 LEU 7 HD11 LEU 7 27.521 21.432 19.313
41 HD12 LEU 7 HD12 LEU 7 26.199 22.337 20.076
42 HD13 LEU 7 HD13 LEU 7 25.852 20.800 19.280
43 HD21 LEU 7 HD21 LEU 7 28.038 23.589 18.094
44 HD22 LEU 7 HD22 LEU 7 26.794 24.340 17.075
45 HD23 LEU 7 HD23 LEU 7 26.620 24.363 18.835
46 H ALA 8 H ALA 8 24.513 20.872 14.352
47 HA ALA 8 HA ALA 8 22.064 21.675 15.485
48 HB1 ALA 8 HB1 ALA 8 22.839 22.087 13.138
49 HB2 ALA 8 HB2 ALA 8 22.530 20.376 12.763
50 HB3 ALA 8 HB3 ALA 8 21.198 21.444 13.225
51 H ALA 9 H ALA 9 23.096 18.395 14.490
52 HA ALA 9 HA ALA 9 20.601 17.087 15.115
53 HB1 ALA 9 HB1 ALA 9 23.445 16.004 14.883
54 HB2 ALA 9 HB2 ALA 9 21.954 15.042 14.846
55 HB3 ALA 9 HB3 ALA 9 22.289 16.195 13.543
56 H CYS 10 H CYS 10 23.108 18.308 17.146
57 HA CYS 10 HA CYS 10 22.374 16.599 19.457
58 HB2 CYS 10 HB2 CYS 10 24.737 16.939 18.972
59 HB3 CYS 10 HB3 CYS 10 24.534 18.689 19.023
60 H GLU 11 H GLU 11 22.312 20.059 18.474
61 HA GLU 11 HA GLU 11 21.404 21.310 20.773
62 HB2 GLU 11 HB2 GLU 11 20.781 21.775 17.836
63 HB3 GLU 11 HB3 GLU 11 20.138 22.825 19.089
64 HG2 GLU 11 HG2 GLU 11 22.995 22.529 19.530
65 HG3 GLU 11 HG3 GLU 11 22.701 22.946 17.840
66 H LEU 12 H LEU 12 19.323 19.605 18.414
67 HA LEU 12 HA LEU 12 16.870 20.355 19.673
68 HB2 LEU 12 HB2 LEU 12 15.862 18.599 18.262
69 HB3 LEU 12 HB3 LEU 12 16.825 19.800 17.423
70 HG LEU 12 HG LEU 12 18.668 18.183 17.128
71 HD11 LEU 12 HD11 LEU 12 18.135 15.740 17.490
72 HD12 LEU 12 HD12 LEU 12 18.485 16.639 18.954
73 HD13 LEU 12 HD13 LEU 12 16.791 16.245 18.535
74 HD21 LEU 12 HD21 LEU 12 15.952 17.142 16.227
75 HD22 LEU 12 HD22 LEU 12 16.902 18.414 15.421
76 HD23 LEU 12 HD23 LEU 12 17.516 16.767 15.486
77 H SER 13 H SER 13 19.178 18.142 20.829
78 HA SER 13 HA SER 13 17.228 16.703 22.548
79 HB2 SER 13 HB2 SER 13 18.996 15.307 23.215
80 HB3 SER 13 HB3 SER 13 19.164 15.501 21.466
81 HG SER 13 HG SER 13 20.795 17.126 21.932
82 H CYS 14 H CYS 14 18.915 19.628 22.620
83 HA CYS 14 HA CYS 14 18.991 19.779 25.599
84 HB2 CYS 14 HB2 CYS 14 20.464 21.226 23.372
85 HB3 CYS 14 HB3 CYS 14 20.604 21.652 25.058
86 H ARG 15 H ARG 15 17.806 21.459 22.656
87 HA ARG 15 HA ARG 15 16.914 23.841 23.870
88 HB2 ARG 15 HB2 ARG 15 17.252 23.305 21.439
89 HB3 ARG 15 HB3 ARG 15 15.727 22.439 21.431
90 HG2 ARG 15 HG2 ARG 15 14.474 24.350 21.385
91 HG3 ARG 15 HG3 ARG 15 15.517 25.211 22.521
92 HD2 ARG 15 HD2 ARG 15 16.223 24.716 19.610
93 HD3 ARG 15 HD3 ARG 15 15.494 26.213 20.223
94 HE ARG 15 HE ARG 15 17.531 26.213 21.841
95 HH11 ARG 15 HH11 ARG 15 17.971 25.165 18.486
96 HH12 ARG 15 HH12 ARG 15 19.718 25.318 18.678
97 HH21 ARG 15 HH21 ARG 15 19.564 26.229 21.963
98 HH22 ARG 15 HH22 ARG 15 20.618 25.740 20.630
99 H SER 16 H SER 16 15.304 20.741 23.888
100 HA SER 16 HA SER 16 12.719 21.600 24.866
101 HB2 SER 16 HB2 SER 16 12.605 19.146 25.499
102 HB3 SER 16 HB3 SER 16 12.923 19.475 23.784
103 HG SER 16 HG SER 16 14.298 17.869 24.903
104 H LEU 17 H LEU 17 15.826 21.432 26.365
105 HA LEU 17 HA LEU 17 14.699 21.134 29.100
106 HB2 LEU 17 HB2 LEU 17 17.632 21.081 28.438
107 HB3 LEU 17 HB3 LEU 17 16.785 20.330 29.780
108 HG LEU 17 HG LEU 17 16.761 19.432 26.883
109 HD11 LEU 17 HD11 LEU 17 18.055 17.512 27.702
110 HD12 LEU 17 HD12 LEU 17 18.900 19.032 28.019
111 HD13 LEU 17 HD13 LEU 17 18.057 18.192 29.340
112 HD21 LEU 17 HD21 LEU 17 15.552 18.086 29.360
113 HD22 LEU 17 HD22 LEU 17 14.621 18.805 28.029
114 HD23 LEU 17 HD23 LEU 17 15.621 17.384 27.731
115 H GLY 18 H GLY 18 15.352 23.647 27.110
116 HA2 GLY 18 HA2 GLY 18 15.296 25.922 27.665
117 HA3 GLY 18 HA3 GLY 18 15.796 25.549 29.310
118 H LEU 19 H LEU 19 18.131 23.908 27.880
119 HA LEU 19 HA LEU 19 19.932 26.287 27.643
120 HB2 LEU 19 HB2 LEU 19 21.766 24.888 28.386
121 HB3 LEU 19 HB3 LEU 19 20.531 25.144 29.574
122 HG LEU 19 HG LEU 19 21.766 22.799 29.170
123 HD11 LEU 19 HD11 LEU 19 18.844 23.064 29.960
124 HD12 LEU 19 HD12 LEU 19 19.913 21.680 30.331
125 HD13 LEU 19 HD13 LEU 19 20.248 23.271 31.024
126 HD21 LEU 19 HD21 LEU 19 20.885 22.469 26.910
127 HD22 LEU 19 HD22 LEU 19 20.398 21.182 28.031
128 HD23 LEU 19 HD23 LEU 19 19.237 22.418 27.545
129 H LEU 20 H LEU 20 22.099 25.561 26.472
130 HA LEU 20 HA LEU 20 21.253 25.135 23.651
131 HB2 LEU 20 HB2 LEU 20 23.944 26.074 24.681
132 HB3 LEU 20 HB3 LEU 20 23.356 26.153 23.038
133 HG LEU 20 HG LEU 20 22.230 27.783 25.362
134 HD11 LEU 20 HD11 LEU 20 24.539 28.421 24.808
135 HD12 LEU 20 HD12 LEU 20 24.100 28.571 23.094
136 HD13 LEU 20 HD13 LEU 20 23.395 29.672 24.297
137 HD21 LEU 20 HD21 LEU 20 21.740 27.954 22.353
138 HD22 LEU 20 HD22 LEU 20 20.563 27.454 23.595
139 HD23 LEU 20 HD23 LEU 20 21.156 29.115 23.566
140 H GLY 21 H GLY 21 22.486 23.736 22.215
141 HA2 GLY 21 HA2 GLY 21 23.500 21.262 23.373
142 HA3 GLY 21 HA3 GLY 21 23.573 21.740 21.676
143 H LYS 22 H LYS 22 25.551 20.499 23.534
144 HA LYS 22 HA LYS 22 27.885 22.192 22.718
145 HB2 LYS 22 HB2 LYS 22 27.528 22.368 25.181
146 HB3 LYS 22 HB3 LYS 22 27.636 20.608 25.309
147 HG2 LYS 22 HG2 LYS 22 29.960 20.698 24.407
148 HG3 LYS 22 HG3 LYS 22 29.835 22.467 24.301
149 HD2 LYS 22 HD2 LYS 22 29.560 22.596 26.762
150 HD3 LYS 22 HD3 LYS 22 29.633 20.818 26.867
151 HE2 LYS 22 HE2 LYS 22 31.889 20.882 25.781
152 HE3 LYS 22 HE3 LYS 22 31.812 22.649 25.760
153 HZ1 LYS 22 HZ1 LYS 22 31.756 20.997 28.229
154 HZ2 LYS 22 HZ2 LYS 22 33.072 21.798 27.658
155 HZ3 LYS 22 HZ3 LYS 22 31.764 22.641 28.163
156 H CYS 23 H CYS 23 29.392 21.052 21.536
157 HA CYS 23 HA CYS 23 29.574 18.156 21.795
158 HB2 CYS 23 HB2 CYS 23 27.449 18.567 20.423
159 HB3 CYS 23 HB3 CYS 23 28.511 19.138 19.133
160 H ILE 24 H ILE 24 31.611 17.704 21.616
161 HA ILE 24 HA ILE 24 33.238 18.594 19.281
162 HB ILE 24 HB ILE 24 34.216 18.431 22.165
163 HG12 ILE 24 HG12 ILE 24 33.768 20.874 20.389
164 HG13 ILE 24 HG13 ILE 24 32.878 20.458 21.853
165 HG21 ILE 24 HG21 ILE 24 36.377 19.223 21.282
166 HG22 ILE 24 HG22 ILE 24 35.936 17.723 20.496
167 HG23 ILE 24 HG23 ILE 24 35.717 19.268 19.640
168 HD11 ILE 24 HD11 ILE 24 35.752 21.388 21.689
169 HD12 ILE 24 HD12 ILE 24 34.375 22.174 22.465
170 HD13 ILE 24 HD13 ILE 24 35.036 20.681 23.154
171 H GLY 25 H GLY 25 34.387 16.877 18.357
172 HA2 GLY 25 HA2 GLY 25 35.066 14.700 17.984
173 HA3 GLY 25 HA3 GLY 25 35.000 14.412 19.719
174 H GLU 26 H GLU 26 32.325 15.309 17.556
175 HA GLU 26 HA GLU 26 30.178 14.637 17.432
176 HB2 GLU 26 HB2 GLU 26 31.810 12.264 16.832
177 HB3 GLU 26 HB3 GLU 26 30.138 11.897 17.192
178 HG2 GLU 26 HG3 GLU 26 30.921 14.032 15.176
179 HG3 GLU 26 HG2 GLU 26 30.756 12.334 14.754
180 H GLU 27 H GLU 27 31.444 14.339 20.380
181 HA GLU 27 HA GLU 27 29.396 12.585 21.561
182 HB2 GLU 27 HB2 GLU 27 31.770 12.539 22.272
183 HB3 GLU 27 HB3 GLU 27 31.607 14.189 22.877
184 HG2 GLU 27 HG2 GLU 27 29.799 13.423 24.436
185 HG3 GLU 27 HG3 GLU 27 29.979 11.779 23.815
186 H CYS 28 H CYS 28 27.411 13.357 21.836
187 HA CYS 28 HA CYS 28 26.917 16.209 22.016
188 HB2 CYS 28 HB2 CYS 28 25.600 14.813 20.546
189 HB3 CYS 28 HB3 CYS 28 25.061 13.833 21.914
190 H LYS 29 H LYS 29 26.701 17.333 23.628
191 HA LYS 29 HA LYS 29 25.592 16.537 26.292
192 HB2 LYS 29 HB2 LYS 29 28.210 17.932 25.578
193 HB3 LYS 29 HB3 LYS 29 27.445 18.179 27.146
194 HG2 LYS 29 HG2 LYS 29 27.661 15.919 27.787
195 HG3 LYS 29 HG3 LYS 29 28.086 15.379 26.153
196 HD2 LYS 29 HD2 LYS 29 30.249 16.309 26.240
197 HD3 LYS 29 HD3 LYS 29 29.835 17.402 27.563
198 HE2 LYS 29 HE2 LYS 29 31.283 15.609 28.369
199 HE3 LYS 29 HE3 LYS 29 29.704 15.581 29.150
200 HZ1 LYS 29 HZ1 LYS 29 30.585 13.768 26.981
201 HZ2 LYS 29 HZ2 LYS 29 30.397 13.381 28.554
202 HZ3 LYS 29 HZ3 LYS 29 29.067 13.742 27.692
203 H CYS 30 H CYS 30 25.219 18.741 27.546
204 HA CYS 30 HA CYS 30 24.448 20.923 25.670
205 HB2 CYS 30 HB2 CYS 30 23.117 20.383 28.315
206 HB3 CYS 30 HB3 CYS 30 22.671 21.472 27.036
207 H VAL 31 H VAL 31 24.600 23.087 26.604
208 HA VAL 31 HA VAL 31 27.139 23.433 27.925
209 HB VAL 31 HB VAL 31 26.756 25.819 27.802
210 HG11 VAL 31 HG11 VAL 31 27.518 24.665 25.784
211 HG12 VAL 31 HG12 VAL 31 25.836 24.432 25.258
212 HG13 VAL 31 HG13 VAL 31 26.518 26.065 25.388
213 HG21 VAL 31 HG21 VAL 31 24.417 26.008 28.417
214 HG22 VAL 31 HG22 VAL 31 24.689 26.763 26.848
215 HG23 VAL 31 HG23 VAL 31 23.937 25.150 26.938
216 HA PRO 32 HA PRO 32 25.861 23.512 32.140
217 HB2 PRO 32 HB2 PRO 32 27.955 24.707 33.396
218 HB3 PRO 32 HB3 PRO 32 28.139 23.179 32.484
219 HG2 PRO 32 HG2 PRO 32 28.690 26.001 31.508
220 HG3 PRO 32 HG3 PRO 32 29.784 24.582 31.443
221 HD2 PRO 32 HD2 PRO 32 28.205 25.317 29.332
222 HD3 PRO 32 HD3 PRO 32 28.562 23.597 29.695
223 H TYR 33 H TYR 33 25.296 26.126 30.360
224 HA TYR 33 HA TYR 33 25.129 28.220 32.425
225 HB2 TYR 33 HB2 TYR 33 24.761 28.417 29.429
226 HB3 TYR 33 HB3 TYR 33 25.036 29.738 30.558
227 HD1 TYR 33 HD2 TYR 33 27.314 28.899 32.173
228 HD2 TYR 33 HD1 TYR 33 26.583 28.371 27.963
229 HE1 TYR 33 HE2 TYR 33 29.762 28.833 31.764
230 HE2 TYR 33 HE1 TYR 33 29.037 28.241 27.560
231 HH TYR 33 HH TYR 33 31.414 28.695 30.194
Start of MODEL 7
1 H1 GLY 1 H1 GLY 1 31.686 18.182 10.743
2 H2 GLY 1 H2 GLY 1 31.125 17.560 12.153
3 H3 GLY 1 H3 GLY 1 31.258 16.591 10.822
4 HA2 GLY 1 HA2 GLY 1 33.507 17.866 12.257
5 HA3 GLY 1 HA3 GLY 1 33.026 16.167 12.415
6 H SER 2 H SER 2 35.291 15.617 9.625
7 HA SER 2 HA SER 2 35.753 13.941 10.960
8 HB2 SER 2 HB2 SER 2 36.414 14.330 13.104
9 HB3 SER 2 HB3 SER 2 36.460 15.953 12.403
10 HG SER 2 HG SER 2 35.423 15.948 14.422
11 H ALA 3 H ALA 3 35.128 12.247 12.441
12 HA ALA 3 HA ALA 3 32.241 11.701 12.299
13 HB1 ALA 3 HB1 ALA 3 34.569 9.969 13.229
14 HB2 ALA 3 HB2 ALA 3 32.910 9.427 12.898
15 HB3 ALA 3 HB3 ALA 3 33.913 10.030 11.575
16 H PHE 4 H PHE 4 33.341 13.764 14.289
17 HA PHE 4 HA PHE 4 32.002 12.707 16.727
18 HB2 PHE 4 HB2 PHE 4 34.752 14.000 16.581
19 HB3 PHE 4 HB3 PHE 4 33.831 13.851 18.066
20 HD1 PHE 4 HD1 PHE 4 32.949 11.391 18.642
21 HD2 PHE 4 HD2 PHE 4 36.355 12.314 16.155
22 HE1 PHE 4 HE1 PHE 4 33.947 9.182 19.182
23 HE2 PHE 4 HE2 PHE 4 37.344 10.104 16.692
24 HZ PHE 4 HZ PHE 4 36.153 8.542 18.217
25 H CYS 5 H CYS 5 31.354 14.304 18.235
26 HA CYS 5 HA CYS 5 30.206 16.128 18.846
27 HB2 CYS 5 HB2 CYS 5 32.579 16.645 19.180
28 HB3 CYS 5 HB3 CYS 5 32.620 17.433 17.615
29 H ASN 6 H ASN 6 28.771 15.303 16.849
30 HA ASN 6 HA ASN 6 28.303 17.187 14.730
31 HB2 ASN 6 HB2 ASN 6 26.347 15.869 14.286
32 HB3 ASN 6 HB3 ASN 6 27.637 14.771 14.729
33 HD21 ASN 6 HD22 ASN 6 24.456 15.858 15.546
34 HD22 ASN 6 HD21 ASN 6 24.293 14.831 16.978
35 H LEU 7 H LEU 7 26.481 18.630 14.476
36 HA LEU 7 HA LEU 7 25.897 20.076 17.035
37 HB2 LEU 7 HB2 LEU 7 27.541 21.144 15.621
38 HB3 LEU 7 HB3 LEU 7 26.476 21.045 14.217
39 HG LEU 7 HG LEU 7 24.900 22.637 15.310
40 HD11 LEU 7 HD11 LEU 7 25.418 22.201 17.691
41 HD12 LEU 7 HD12 LEU 7 27.066 22.823 17.455
42 HD13 LEU 7 HD13 LEU 7 25.667 23.902 17.287
43 HD21 LEU 7 HD21 LEU 7 27.788 23.605 15.163
44 HD22 LEU 7 HD22 LEU 7 26.672 23.441 13.789
45 HD23 LEU 7 HD23 LEU 7 26.331 24.618 15.064
46 H ALA 8 H ALA 8 24.510 19.434 13.771
47 HA ALA 8 HA ALA 8 22.256 21.047 14.082
48 HB1 ALA 8 HB1 ALA 8 22.497 18.513 12.417
49 HB2 ALA 8 HB2 ALA 8 21.352 19.835 12.154
50 HB3 ALA 8 HB3 ALA 8 23.094 20.105 11.940
51 H ALA 9 H ALA 9 22.326 17.470 14.589
52 HA ALA 9 HA ALA 9 19.664 17.354 15.686
53 HB1 ALA 9 HB1 ALA 9 21.975 15.385 15.846
54 HB2 ALA 9 HB2 ALA 9 20.275 15.035 16.223
55 HB3 ALA 9 HB3 ALA 9 20.741 15.463 14.570
56 H CYS 10 H CYS 10 22.558 18.463 17.125
57 HA CYS 10 HA CYS 10 21.953 17.488 19.872
58 HB2 CYS 10 HB2 CYS 10 24.257 17.373 19.062
59 HB3 CYS 10 HB3 CYS 10 24.263 19.102 18.746
60 H GLU 11 H GLU 11 22.247 20.597 18.075
61 HA GLU 11 HA GLU 11 21.046 22.256 20.123
62 HB2 GLU 11 HB2 GLU 11 21.359 22.457 17.113
63 HB3 GLU 11 HB3 GLU 11 20.602 23.735 18.058
64 HG2 GLU 11 HG2 GLU 11 23.351 22.714 18.873
65 HG3 GLU 11 HG3 GLU 11 23.184 23.797 17.501
66 H LEU 12 H LEU 12 19.672 20.067 17.756
67 HA LEU 12 HA LEU 12 16.890 20.846 18.320
68 HB2 LEU 12 HB2 LEU 12 18.126 18.554 16.759
69 HB3 LEU 12 HB3 LEU 12 16.397 18.824 16.888
70 HG LEU 12 HG LEU 12 18.306 20.872 15.698
71 HD11 LEU 12 HD11 LEU 12 17.441 20.124 13.523
72 HD12 LEU 12 HD12 LEU 12 18.228 18.774 14.352
73 HD13 LEU 12 HD13 LEU 12 16.459 18.874 14.321
74 HD21 LEU 12 HD21 LEU 12 16.263 21.915 16.499
75 HD22 LEU 12 HD22 LEU 12 16.233 21.822 14.738
76 HD23 LEU 12 HD23 LEU 12 15.280 20.671 15.695
77 H SER 13 H SER 13 19.109 19.151 20.182
78 HA SER 13 HA SER 13 16.922 17.644 21.549
79 HB2 SER 13 HB2 SER 13 19.705 16.532 21.110
80 HB3 SER 13 HB3 SER 13 18.304 15.709 21.823
81 HG SER 13 HG SER 13 18.892 16.390 19.181
82 H CYS 14 H CYS 14 18.386 20.268 22.176
83 HA CYS 14 HA CYS 14 19.131 19.515 24.979
84 HB2 CYS 14 HB2 CYS 14 20.619 21.305 23.061
85 HB3 CYS 14 HB3 CYS 14 20.853 21.387 24.804
86 H ARG 15 H ARG 15 17.593 22.039 22.914
87 HA ARG 15 HA ARG 15 17.077 23.760 25.244
88 HB2 ARG 15 HB2 ARG 15 16.067 23.798 22.372
89 HB3 ARG 15 HB3 ARG 15 15.472 24.910 23.597
90 HG2 ARG 15 HG2 ARG 15 18.410 24.665 22.829
91 HG3 ARG 15 HG3 ARG 15 17.271 25.854 22.172
92 HD2 ARG 15 HD2 ARG 15 16.884 26.784 24.420
93 HD3 ARG 15 HD3 ARG 15 18.007 25.601 25.110
94 HE ARG 15 HE ARG 15 19.191 27.184 22.973
95 HH11 ARG 15 HH11 ARG 15 18.623 27.167 26.471
96 HH12 ARG 15 HH12 ARG 15 20.188 27.906 26.775
97 HH21 ARG 15 HH21 ARG 15 20.799 28.600 23.471
98 HH22 ARG 15 HH22 ARG 15 21.337 28.736 25.142
99 H SER 16 H SER 16 15.461 21.066 23.761
100 HA SER 16 HA SER 16 12.964 21.123 25.143
101 HB2 SER 16 HB2 SER 16 13.233 18.599 24.999
102 HB3 SER 16 HB3 SER 16 13.378 19.469 23.458
103 HG SER 16 HG SER 16 15.038 17.865 23.835
104 H LEU 17 H LEU 17 16.240 20.340 26.220
105 HA LEU 17 HA LEU 17 15.404 19.622 28.955
106 HB2 LEU 17 HB2 LEU 17 18.245 19.826 27.945
107 HB3 LEU 17 HB3 LEU 17 17.620 18.861 29.265
108 HG LEU 17 HG LEU 17 17.207 18.357 26.292
109 HD11 LEU 17 HD11 LEU 17 18.841 16.855 28.375
110 HD12 LEU 17 HD12 LEU 17 18.645 16.408 26.664
111 HD13 LEU 17 HD13 LEU 17 19.486 17.901 27.091
112 HD21 LEU 17 HD21 LEU 17 15.248 17.533 27.597
113 HD22 LEU 17 HD22 LEU 17 16.212 16.193 26.973
114 HD23 LEU 17 HD23 LEU 17 16.342 16.656 28.686
115 H GLY 18 H GLY 18 16.156 22.480 27.338
116 HA2 GLY 18 HA2 GLY 18 16.264 24.638 28.223
117 HA3 GLY 18 HA3 GLY 18 16.743 24.014 29.793
118 H LEU 19 H LEU 19 18.696 22.719 27.218
119 HA LEU 19 HA LEU 19 20.948 24.498 28.091
120 HB2 LEU 19 HB2 LEU 19 20.926 21.657 27.040
121 HB3 LEU 19 HB3 LEU 19 22.382 22.622 27.308
122 HG LEU 19 HG LEU 19 22.377 22.349 29.570
123 HD11 LEU 19 HD11 LEU 19 20.138 23.143 30.187
124 HD12 LEU 19 HD12 LEU 19 19.431 21.607 29.620
125 HD13 LEU 19 HD13 LEU 19 20.534 21.641 31.011
126 HD21 LEU 19 HD21 LEU 19 20.866 19.857 28.685
127 HD22 LEU 19 HD22 LEU 19 22.588 20.145 28.419
128 HD23 LEU 19 HD23 LEU 19 21.977 20.004 30.065
129 H LEU 20 H LEU 20 22.600 25.024 26.607
130 HA LEU 20 HA LEU 20 21.887 25.349 23.752
131 HB2 LEU 20 HB2 LEU 20 23.036 27.184 24.836
132 HB3 LEU 20 HB3 LEU 20 24.239 26.114 25.503
133 HG LEU 20 HG LEU 20 25.068 25.653 23.168
134 HD11 LEU 20 HD11 LEU 20 24.485 27.267 21.421
135 HD12 LEU 20 HD12 LEU 20 23.047 26.370 21.921
136 HD13 LEU 20 HD13 LEU 20 23.292 28.030 22.493
137 HD21 LEU 20 HD21 LEU 20 26.268 27.785 22.996
138 HD22 LEU 20 HD22 LEU 20 25.124 28.534 24.130
139 HD23 LEU 20 HD23 LEU 20 26.201 27.224 24.671
140 H GLY 21 H GLY 21 22.468 23.882 22.181
141 HA2 GLY 21 HA2 GLY 21 23.524 21.308 22.822
142 HA3 GLY 21 HA3 GLY 21 23.265 21.963 21.215
143 H LYS 22 H LYS 22 25.554 20.820 23.312
144 HA LYS 22 HA LYS 22 27.864 21.594 21.665
145 HB2 LYS 22 HB2 LYS 22 27.695 22.144 24.673
146 HB3 LYS 22 HB3 LYS 22 29.187 22.205 23.746
147 HG2 LYS 22 HG2 LYS 22 26.809 24.056 23.335
148 HG3 LYS 22 HG3 LYS 22 28.269 24.431 24.235
149 HD2 LYS 22 HD2 LYS 22 29.656 24.295 22.269
150 HD3 LYS 22 HD3 LYS 22 28.318 23.688 21.274
151 HE2 LYS 22 HE2 LYS 22 27.083 25.755 21.550
152 HE3 LYS 22 HE3 LYS 22 28.303 26.392 22.661
153 HZ1 LYS 22 HZ1 LYS 22 28.915 25.652 19.850
154 HZ2 LYS 22 HZ2 LYS 22 28.482 27.170 20.329
155 HZ3 LYS 22 HZ3 LYS 22 29.879 26.486 20.891
156 H CYS 23 H CYS 23 29.797 20.360 22.242
157 HA CYS 23 HA CYS 23 29.280 17.779 23.668
158 HB2 CYS 23 HB2 CYS 23 30.866 16.724 22.250
159 HB3 CYS 23 HB3 CYS 23 29.786 17.613 21.193
160 H ILE 24 H ILE 24 31.567 16.840 24.529
161 HA ILE 24 HA ILE 24 33.079 19.077 25.853
162 HB ILE 24 HB ILE 24 33.018 16.108 26.444
163 HG12 ILE 24 HG12 ILE 24 32.098 18.573 28.006
164 HG13 ILE 24 HG13 ILE 24 31.048 17.401 27.210
165 HG21 ILE 24 HG21 ILE 24 34.682 18.304 27.760
166 HG22 ILE 24 HG22 ILE 24 34.569 16.614 28.302
167 HG23 ILE 24 HG23 ILE 24 35.318 16.972 26.766
168 HD11 ILE 24 HD11 ILE 24 32.008 15.616 28.724
169 HD12 ILE 24 HD12 ILE 24 32.768 16.927 29.659
170 HD13 ILE 24 HD13 ILE 24 31.010 16.856 29.509
171 H GLY 25 H GLY 25 33.622 16.133 23.941
172 HA2 GLY 25 HA2 GLY 25 35.316 17.560 22.044
173 HA3 GLY 25 HA3 GLY 25 36.250 16.448 23.049
174 H GLU 26 H GLU 26 33.052 15.351 22.504
175 HA GLU 26 HA GLU 26 33.827 13.394 20.422
176 HB2 GLU 26 HB2 GLU 26 32.729 11.866 22.476
177 HB3 GLU 26 HB3 GLU 26 34.390 11.925 21.966
178 HG2 GLU 26 HG2 GLU 26 34.363 12.057 24.315
179 HG3 GLU 26 HG3 GLU 26 34.907 13.606 23.733
180 H GLU 27 H GLU 27 31.210 14.204 22.811
181 HA GLU 27 HA GLU 27 29.182 13.938 20.662
182 HB2 GLU 27 HB2 GLU 27 27.969 12.193 21.818
183 HB3 GLU 27 HB3 GLU 27 29.573 11.629 21.379
184 HG2 GLU 27 HG2 GLU 27 30.370 11.782 23.652
185 HG3 GLU 27 HG3 GLU 27 28.944 12.681 24.169
186 H CYS 28 H CYS 28 26.952 14.266 21.487
187 HA CYS 28 HA CYS 28 26.781 16.838 22.546
188 HB2 CYS 28 HB2 CYS 28 25.237 15.670 20.937
189 HB3 CYS 28 HB3 CYS 28 24.539 14.816 22.307
190 H LYS 29 H LYS 29 27.134 17.465 24.438
191 HA LYS 29 HA LYS 29 26.007 16.376 26.955
192 HB2 LYS 29 HB2 LYS 29 28.943 16.714 26.297
193 HB3 LYS 29 HB3 LYS 29 28.343 16.666 27.956
194 HG2 LYS 29 HG2 LYS 29 27.447 14.400 27.614
195 HG3 LYS 29 HG3 LYS 29 28.017 14.399 25.935
196 HD2 LYS 29 HD2 LYS 29 30.339 14.572 26.661
197 HD3 LYS 29 HD3 LYS 29 29.824 14.659 28.366
198 HE2 LYS 29 HE2 LYS 29 28.851 12.414 28.240
199 HE3 LYS 29 HE3 LYS 29 29.211 12.323 26.511
200 HZ1 LYS 29 HZ1 LYS 29 31.562 12.465 27.035
201 HZ2 LYS 29 HZ2 LYS 29 31.258 12.541 28.651
202 HZ3 LYS 29 HZ3 LYS 29 30.903 11.173 27.825
203 H CYS 30 H CYS 30 24.747 18.184 26.790
204 HA CYS 30 HA CYS 30 25.931 20.780 26.087
205 HB2 CYS 30 HB2 CYS 30 23.439 21.372 25.829
206 HB3 CYS 30 HB3 CYS 30 24.284 20.358 24.679
207 H VAL 31 H VAL 31 24.705 22.748 26.972
208 HA VAL 31 HA VAL 31 25.734 22.774 29.763
209 HB VAL 31 HB VAL 31 26.825 24.962 28.866
210 HG11 VAL 31 HG11 VAL 31 28.145 22.969 29.301
211 HG12 VAL 31 HG12 VAL 31 27.699 22.300 27.710
212 HG13 VAL 31 HG13 VAL 31 28.681 23.775 27.822
213 HG21 VAL 31 HG21 VAL 31 26.916 25.390 26.619
214 HG22 VAL 31 HG22 VAL 31 26.426 23.738 26.160
215 HG23 VAL 31 HG23 VAL 31 25.227 24.831 26.844
216 HA PRO 32 HA PRO 32 22.791 25.870 31.051
217 HB2 PRO 32 HB2 PRO 32 24.092 27.109 33.091
218 HB3 PRO 32 HB3 PRO 32 23.681 25.381 33.137
219 HG2 PRO 32 HG2 PRO 32 26.328 26.595 32.268
220 HG3 PRO 32 HG3 PRO 32 26.055 25.323 33.505
221 HD2 PRO 32 HD2 PRO 32 26.676 24.711 30.914
222 HD3 PRO 32 HD3 PRO 32 25.539 23.716 31.870
223 H TYR 33 H TYR 33 23.512 26.650 28.685
224 HA TYR 33 HA TYR 33 23.734 29.612 28.886
225 HB2 TYR 33 HB2 TYR 33 25.254 27.834 26.963
226 HB3 TYR 33 HB3 TYR 33 24.911 29.511 26.599
227 HD1 TYR 33 HD1 TYR 33 25.626 31.346 28.215
228 HD2 TYR 33 HD2 TYR 33 27.173 27.313 28.347
229 HE1 TYR 33 HE1 TYR 33 27.604 32.150 29.501
230 HE2 TYR 33 HE2 TYR 33 29.168 28.130 29.616
231 HH TYR 33 HH TYR 33 29.543 31.538 30.642
Start of MODEL 8
1 H1 GLY 1 H1 GLY 1 33.275 10.843 19.353
2 H2 GLY 1 H2 GLY 1 33.060 12.275 20.126
3 H3 GLY 1 H3 GLY 1 31.860 11.164 20.128
4 HA2 GLY 1 HA2 GLY 1 34.496 10.884 21.426
5 HA3 GLY 1 HA3 GLY 1 32.974 11.239 22.261
6 H SER 2 H SER 2 32.387 9.483 23.391
7 HA SER 2 HA SER 2 32.929 6.728 22.540
8 HB2 SER 2 HB2 SER 2 31.219 7.876 24.781
9 HB3 SER 2 HB3 SER 2 31.527 6.155 24.486
10 HG SER 2 HG SER 2 32.972 6.814 25.988
11 H ALA 3 H ALA 3 30.389 9.090 22.164
12 HA ALA 3 HA ALA 3 29.211 7.333 20.095
13 HB1 ALA 3 HB1 ALA 3 27.632 9.211 21.910
14 HB2 ALA 3 HB2 ALA 3 26.984 8.324 20.514
15 HB3 ALA 3 HB3 ALA 3 27.568 7.435 21.931
16 H PHE 4 H PHE 4 28.274 8.646 18.299
17 HA PHE 4 HA PHE 4 30.064 10.852 17.572
18 HB2 PHE 4 HB2 PHE 4 29.545 9.129 15.948
19 HB3 PHE 4 HB3 PHE 4 27.818 9.411 16.139
20 HD1 PHE 4 HD2 PHE 4 30.957 11.227 15.106
21 HD2 PHE 4 HD1 PHE 4 26.698 10.821 14.624
22 HE1 PHE 4 HE2 PHE 4 31.008 12.875 13.256
23 HE2 PHE 4 HE1 PHE 4 26.752 12.483 12.779
24 HZ PHE 4 HZ PHE 4 28.904 13.513 12.093
25 H CYS 5 H CYS 5 29.536 12.972 17.093
26 HA CYS 5 HA CYS 5 26.802 13.929 17.824
27 HB2 CYS 5 HB2 CYS 5 28.613 14.361 19.486
28 HB3 CYS 5 HB3 CYS 5 29.364 15.456 18.329
29 H ASN 6 H ASN 6 25.794 15.153 16.497
30 HA ASN 6 HA ASN 6 27.229 16.873 14.540
31 HB2 ASN 6 HB2 ASN 6 26.076 15.020 13.338
32 HB3 ASN 6 HB3 ASN 6 24.563 15.453 14.136
33 HD21 ASN 6 HD22 ASN 6 23.620 15.773 12.019
34 HD22 ASN 6 HD21 ASN 6 24.021 17.210 11.089
35 H LEU 7 H LEU 7 27.038 18.909 15.203
36 HA LEU 7 HA LEU 7 25.584 19.738 17.409
37 HB2 LEU 7 HB2 LEU 7 27.592 20.812 16.349
38 HB3 LEU 7 HB3 LEU 7 26.544 21.439 15.078
39 HG LEU 7 HG LEU 7 25.265 22.725 16.835
40 HD11 LEU 7 HD11 LEU 7 26.417 23.047 19.042
41 HD12 LEU 7 HD12 LEU 7 25.763 21.421 18.851
42 HD13 LEU 7 HD13 LEU 7 27.509 21.710 18.643
43 HD21 LEU 7 HD21 LEU 7 27.094 23.732 15.498
44 HD22 LEU 7 HD22 LEU 7 26.994 24.424 17.119
45 HD23 LEU 7 HD23 LEU 7 28.266 23.239 16.742
46 H ALA 8 H ALA 8 24.680 20.082 13.995
47 HA ALA 8 HA ALA 8 22.267 21.427 14.088
48 HB1 ALA 8 HB1 ALA 8 21.804 20.205 11.985
49 HB2 ALA 8 HB2 ALA 8 23.482 20.752 12.064
50 HB3 ALA 8 HB3 ALA 8 23.092 19.051 12.375
51 H ALA 9 H ALA 9 22.785 18.119 15.231
52 HA ALA 9 HA ALA 9 19.847 17.776 15.690
53 HB1 ALA 9 HB1 ALA 9 20.925 16.124 14.196
54 HB2 ALA 9 HB2 ALA 9 22.062 15.694 15.494
55 HB3 ALA 9 HB3 ALA 9 20.325 15.384 15.684
56 H CYS 10 H CYS 10 22.703 18.557 17.308
57 HA CYS 10 HA CYS 10 22.048 17.219 19.864
58 HB2 CYS 10 HB2 CYS 10 24.357 17.169 19.139
59 HB3 CYS 10 HB3 CYS 10 24.392 18.931 19.003
60 H GLU 11 H GLU 11 22.300 20.601 18.570
61 HA GLU 11 HA GLU 11 21.210 21.951 20.876
62 HB2 GLU 11 HB2 GLU 11 21.091 22.409 17.883
63 HB3 GLU 11 HB3 GLU 11 20.174 23.442 18.977
64 HG2 GLU 11 HG2 GLU 11 23.124 23.001 19.512
65 HG3 GLU 11 HG3 GLU 11 22.612 24.092 18.224
66 H LEU 12 H LEU 12 19.602 20.279 18.158
67 HA LEU 12 HA LEU 12 16.939 20.601 19.192
68 HB2 LEU 12 HB2 LEU 12 17.975 18.565 17.182
69 HB3 LEU 12 HB3 LEU 12 16.306 19.079 17.399
70 HG LEU 12 HG LEU 12 18.597 20.802 16.354
71 HD11 LEU 12 HD11 LEU 12 17.692 19.110 14.766
72 HD12 LEU 12 HD12 LEU 12 16.066 19.783 15.002
73 HD13 LEU 12 HD13 LEU 12 17.343 20.771 14.261
74 HD21 LEU 12 HD21 LEU 12 16.851 22.500 15.878
75 HD22 LEU 12 HD22 LEU 12 15.658 21.518 16.754
76 HD23 LEU 12 HD23 LEU 12 17.042 22.242 17.610
77 H SER 13 H SER 13 19.353 18.762 20.514
78 HA SER 13 HA SER 13 17.453 16.833 21.784
79 HB2 SER 13 HB2 SER 13 20.462 16.605 21.385
80 HB3 SER 13 HB3 SER 13 19.458 15.483 22.307
81 HG SER 13 HG SER 13 19.485 15.991 19.540
82 H CYS 14 H CYS 14 18.971 19.725 22.348
83 HA CYS 14 HA CYS 14 19.125 19.303 25.322
84 HB2 CYS 14 HB2 CYS 14 20.780 20.987 23.417
85 HB3 CYS 14 HB3 CYS 14 20.790 21.244 25.146
86 H ARG 15 H ARG 15 18.464 21.729 22.734
87 HA ARG 15 HA ARG 15 17.583 23.721 24.573
88 HB2 ARG 15 HB2 ARG 15 18.715 23.912 22.304
89 HB3 ARG 15 HB3 ARG 15 17.127 23.650 21.577
90 HG2 ARG 15 HG2 ARG 15 16.285 25.688 22.686
91 HG3 ARG 15 HG3 ARG 15 17.812 25.897 23.549
92 HD2 ARG 15 HD2 ARG 15 17.669 25.759 20.515
93 HD3 ARG 15 HD3 ARG 15 17.392 27.260 21.372
94 HE ARG 15 HE ARG 15 19.970 25.697 21.393
95 HH11 ARG 15 HH11 ARG 15 18.366 28.791 22.111
96 HH12 ARG 15 HH12 ARG 15 19.932 29.571 22.283
97 HH21 ARG 15 HH21 ARG 15 21.783 26.887 21.373
98 HH22 ARG 15 HH22 ARG 15 21.742 28.578 21.892
99 H SER 16 H SER 16 15.817 21.088 23.300
100 HA SER 16 HA SER 16 13.119 22.073 23.698
101 HB2 SER 16 HB2 SER 16 12.640 19.587 23.911
102 HB3 SER 16 HB3 SER 16 13.483 20.079 22.391
103 HG SER 16 HG SER 16 14.347 18.176 23.609
104 H LEU 17 H LEU 17 15.677 21.051 25.882
105 HA LEU 17 HA LEU 17 13.852 20.733 28.185
106 HB2 LEU 17 HB2 LEU 17 16.873 20.641 28.262
107 HB3 LEU 17 HB3 LEU 17 15.718 19.871 29.339
108 HG LEU 17 HG LEU 17 16.411 19.064 26.487
109 HD11 LEU 17 HD11 LEU 17 16.838 17.659 29.155
110 HD12 LEU 17 HD12 LEU 17 17.294 17.038 27.549
111 HD13 LEU 17 HD13 LEU 17 18.082 18.483 28.190
112 HD21 LEU 17 HD21 LEU 17 14.420 17.752 28.383
113 HD22 LEU 17 HD22 LEU 17 14.017 18.571 26.865
114 HD23 LEU 17 HD23 LEU 17 14.969 17.090 26.817
115 H GLY 18 H GLY 18 15.656 23.216 26.701
116 HA2 GLY 18 HA2 GLY 18 15.382 25.497 27.307
117 HA3 GLY 18 HA3 GLY 18 15.352 25.057 29.009
118 H LEU 19 H LEU 19 17.940 23.367 27.625
119 HA LEU 19 HA LEU 19 19.842 25.602 28.140
120 HB2 LEU 19 HB2 LEU 19 21.501 23.981 28.932
121 HB3 LEU 19 HB3 LEU 19 20.166 24.276 29.998
122 HG LEU 19 HG LEU 19 21.188 21.876 29.685
123 HD11 LEU 19 HD11 LEU 19 19.043 20.845 30.310
124 HD12 LEU 19 HD12 LEU 19 19.286 22.369 31.164
125 HD13 LEU 19 HD13 LEU 19 18.163 22.299 29.791
126 HD21 LEU 19 HD21 LEU 19 20.758 21.829 27.205
127 HD22 LEU 19 HD22 LEU 19 20.141 20.436 28.120
128 HD23 LEU 19 HD23 LEU 19 19.041 21.710 27.573
129 H LEU 20 H LEU 20 22.008 25.319 27.155
130 HA LEU 20 HA LEU 20 21.516 25.185 24.263
131 HB2 LEU 20 HB2 LEU 20 22.546 27.154 24.760
132 HB3 LEU 20 HB3 LEU 20 23.393 26.518 26.137
133 HG LEU 20 HG LEU 20 25.042 25.401 24.562
134 HD11 LEU 20 HD11 LEU 20 25.241 26.273 22.314
135 HD12 LEU 20 HD12 LEU 20 23.637 25.549 22.473
136 HD13 LEU 20 HD13 LEU 20 23.825 27.313 22.531
137 HD21 LEU 20 HD21 LEU 20 26.223 27.549 24.102
138 HD22 LEU 20 HD22 LEU 20 24.740 28.425 24.519
139 HD23 LEU 20 HD23 LEU 20 25.582 27.469 25.751
140 H GLY 21 H GLY 21 22.327 23.744 22.837
141 HA2 GLY 21 HA2 GLY 21 23.639 21.318 23.892
142 HA3 GLY 21 HA3 GLY 21 22.995 21.545 22.273
143 H LYS 22 H LYS 22 25.687 20.832 23.747
144 HA LYS 22 HA LYS 22 27.392 21.905 21.545
145 HB2 LYS 22 HB2 LYS 22 28.185 21.816 24.489
146 HB3 LYS 22 HB3 LYS 22 29.309 22.046 23.141
147 HG2 LYS 22 HG2 LYS 22 28.004 24.089 22.448
148 HG3 LYS 22 HG3 LYS 22 27.054 23.922 23.935
149 HD2 LYS 22 HD2 LYS 22 29.163 24.109 25.273
150 HD3 LYS 22 HD3 LYS 22 30.082 24.304 23.766
151 HE2 LYS 22 HE2 LYS 22 28.742 26.327 23.224
152 HE3 LYS 22 HE3 LYS 22 27.848 26.148 24.743
153 HZ1 LYS 22 HZ1 LYS 22 29.665 27.750 24.909
154 HZ2 LYS 22 HZ2 LYS 22 29.928 26.489 25.944
155 HZ3 LYS 22 HZ3 LYS 22 30.762 26.617 24.499
156 H CYS 23 H CYS 23 29.161 20.625 20.930
157 HA CYS 23 HA CYS 23 28.834 17.713 21.454
158 HB2 CYS 23 HB2 CYS 23 30.082 19.316 19.216
159 HB3 CYS 23 HB3 CYS 23 30.294 17.587 19.385
160 H ILE 24 H ILE 24 29.889 18.185 23.615
161 HA ILE 24 HA ILE 24 32.734 18.934 23.668
162 HB ILE 24 HB ILE 24 31.031 17.809 25.909
163 HG12 ILE 24 HG12 ILE 24 29.874 19.796 25.177
164 HG13 ILE 24 HG13 ILE 24 30.664 20.081 26.712
165 HG21 ILE 24 HG21 ILE 24 32.696 18.983 27.361
166 HG22 ILE 24 HG22 ILE 24 33.397 17.676 26.404
167 HG23 ILE 24 HG23 ILE 24 33.646 19.360 25.909
168 HD11 ILE 24 HD11 ILE 24 31.692 21.054 24.010
169 HD12 ILE 24 HD12 ILE 24 30.867 22.027 25.242
170 HD13 ILE 24 HD13 ILE 24 32.466 21.355 25.587
171 H GLY 25 H GLY 25 34.443 17.541 23.531
172 HA2 GLY 25 HA2 GLY 25 35.581 15.546 23.182
173 HA3 GLY 25 HA3 GLY 25 34.357 14.712 24.160
174 H GLU 26 H GLU 26 33.684 16.573 21.221
175 HA GLU 26 HA GLU 26 32.318 16.157 19.498
176 HB2 GLU 26 HB2 GLU 26 33.841 13.578 19.202
177 HB3 GLU 26 HB3 GLU 26 32.977 14.469 17.949
178 HG2 GLU 26 HG2 GLU 26 34.614 16.314 18.139
179 HG3 GLU 26 HG3 GLU 26 35.477 15.399 19.387
180 H GLU 27 H GLU 27 31.183 15.382 22.020
181 HA GLU 27 HA GLU 27 29.149 13.389 21.133
182 HB2 GLU 27 HB2 GLU 27 30.972 12.334 22.394
183 HB3 GLU 27 HB3 GLU 27 30.628 13.377 23.770
184 HG2 GLU 27 HG2 GLU 27 28.358 12.417 23.934
185 HG3 GLU 27 HG3 GLU 27 28.649 11.436 22.481
186 H CYS 28 H CYS 28 27.039 13.834 21.898
187 HA CYS 28 HA CYS 28 26.629 16.616 22.426
188 HB2 CYS 28 HB2 CYS 28 25.196 15.187 20.987
189 HB3 CYS 28 HB3 CYS 28 24.587 14.381 22.429
190 H LYS 29 H LYS 29 27.111 17.487 24.288
191 HA LYS 29 HA LYS 29 25.925 16.488 26.851
192 HB2 LYS 29 HB2 LYS 29 28.781 17.433 26.429
193 HB3 LYS 29 HB3 LYS 29 28.051 16.994 27.969
194 HG2 LYS 29 HG2 LYS 29 27.749 14.649 27.146
195 HG3 LYS 29 HG3 LYS 29 28.522 15.104 25.625
196 HD2 LYS 29 HD2 LYS 29 30.588 15.747 26.961
197 HD3 LYS 29 HD3 LYS 29 29.817 14.972 28.368
198 HE2 LYS 29 HE2 LYS 29 29.592 12.862 27.037
199 HE3 LYS 29 HE3 LYS 29 30.312 13.689 25.652
200 HZ1 LYS 29 HZ1 LYS 29 32.347 13.985 27.027
201 HZ2 LYS 29 HZ2 LYS 29 31.693 12.998 28.180
202 HZ3 LYS 29 HZ3 LYS 29 32.008 12.429 26.678
203 H CYS 30 H CYS 30 24.530 18.058 27.380
204 HA CYS 30 HA CYS 30 24.685 20.663 26.179
205 HB2 CYS 30 HB2 CYS 30 22.824 19.992 28.434
206 HB3 CYS 30 HB3 CYS 30 22.613 21.051 27.050
207 H VAL 31 H VAL 31 24.516 22.754 27.369
208 HA VAL 31 HA VAL 31 26.739 22.831 29.248
209 HB VAL 31 HB VAL 31 26.775 25.170 29.009
210 HG11 VAL 31 HG11 VAL 31 26.006 24.017 26.298
211 HG12 VAL 31 HG12 VAL 31 27.036 25.426 26.630
212 HG13 VAL 31 HG13 VAL 31 27.575 23.799 27.089
213 HG21 VAL 31 HG21 VAL 31 24.437 25.749 29.234
214 HG22 VAL 31 HG22 VAL 31 25.085 26.438 27.753
215 HG23 VAL 31 HG23 VAL 31 24.059 24.974 27.683
216 HA PRO 32 HA PRO 32 24.341 23.293 32.984
217 HB2 PRO 32 HB2 PRO 32 26.192 24.160 34.758
218 HB3 PRO 32 HB3 PRO 32 26.297 22.552 33.992
219 HG2 PRO 32 HG2 PRO 32 27.722 25.092 33.140
220 HG3 PRO 32 HG3 PRO 32 28.425 23.467 33.420
221 HD2 PRO 32 HD2 PRO 32 27.690 24.360 30.923
222 HD3 PRO 32 HD3 PRO 32 27.558 22.640 31.402
223 H TYR 33 H TYR 33 23.088 24.940 31.771
224 HA TYR 33 HA TYR 33 23.334 27.759 32.634
225 HB2 TYR 33 HB2 TYR 33 21.179 26.145 31.227
226 HB3 TYR 33 HB3 TYR 33 20.873 27.754 31.842
227 HD1 TYR 33 HD2 TYR 33 24.199 28.054 30.718
228 HD2 TYR 33 HD1 TYR 33 20.149 27.624 29.285
229 HE1 TYR 33 HE2 TYR 33 24.815 29.203 28.626
230 HE2 TYR 33 HE1 TYR 33 20.783 28.759 27.171
231 HH TYR 33 HH TYR 33 22.382 30.001 26.136
Start of MODEL 9
1 H1 GLY 1 H1 GLY 1 29.897 8.122 22.232
2 H2 GLY 1 H2 GLY 1 31.072 7.556 21.220
3 H3 GLY 1 H3 GLY 1 31.439 7.958 22.773
4 HA2 GLY 1 HA2 GLY 1 31.324 5.557 22.464
5 HA3 GLY 1 HA3 GLY 1 30.172 6.184 23.660
6 H SER 2 H SER 2 28.032 5.913 23.352
7 HA SER 2 HA SER 2 27.038 4.162 21.289
8 HB2 SER 2 HB2 SER 2 24.888 4.475 22.327
9 HB3 SER 2 HB3 SER 2 26.115 4.258 23.581
10 HG SER 2 HG SER 2 26.108 6.527 23.911
11 H ALA 3 H ALA 3 27.497 7.606 21.269
12 HA ALA 3 HA ALA 3 26.323 7.661 18.545
13 HB1 ALA 3 HB1 ALA 3 24.633 8.654 20.045
14 HB2 ALA 3 HB2 ALA 3 25.853 9.766 20.706
15 HB3 ALA 3 HB3 ALA 3 25.347 9.893 19.005
16 H PHE 4 H PHE 4 27.041 9.807 17.479
17 HA PHE 4 HA PHE 4 29.721 10.760 18.397
18 HB2 PHE 4 HB2 PHE 4 29.882 9.174 16.444
19 HB3 PHE 4 HB3 PHE 4 28.907 10.294 15.501
20 HD1 PHE 4 HD2 PHE 4 32.079 10.085 17.526
21 HD2 PHE 4 HD1 PHE 4 30.022 12.004 14.261
22 HE1 PHE 4 HE2 PHE 4 34.181 11.223 16.864
23 HE2 PHE 4 HE1 PHE 4 32.125 13.127 13.601
24 HZ PHE 4 HZ PHE 4 34.212 12.748 14.901
25 H CYS 5 H CYS 5 30.119 12.994 17.975
26 HA CYS 5 HA CYS 5 27.900 14.671 18.453
27 HB2 CYS 5 HB2 CYS 5 30.173 15.262 19.103
28 HB3 CYS 5 HB3 CYS 5 30.671 15.308 17.414
29 H ASN 6 H ASN 6 26.373 15.527 17.189
30 HA ASN 6 HA ASN 6 27.301 16.848 14.726
31 HB2 ASN 6 HB2 ASN 6 26.058 14.935 13.820
32 HB3 ASN 6 HB3 ASN 6 24.689 15.277 14.883
33 HD21 ASN 6 HD22 ASN 6 23.505 15.298 12.743
34 HD22 ASN 6 HD21 ASN 6 23.513 16.787 11.821
35 H LEU 7 H LEU 7 27.107 18.974 15.212
36 HA LEU 7 HA LEU 7 25.736 20.067 17.424
37 HB2 LEU 7 HB2 LEU 7 27.607 21.110 16.154
38 HB3 LEU 7 HB3 LEU 7 26.541 21.343 14.772
39 HG LEU 7 HG LEU 7 25.121 22.883 16.167
40 HD11 LEU 7 HD11 LEU 7 26.079 23.777 18.272
41 HD12 LEU 7 HD12 LEU 7 25.697 22.064 18.430
42 HD13 LEU 7 HD13 LEU 7 27.383 22.574 18.195
43 HD21 LEU 7 HD21 LEU 7 28.077 23.601 15.996
44 HD22 LEU 7 HD22 LEU 7 26.885 23.758 14.685
45 HD23 LEU 7 HD23 LEU 7 26.732 24.751 16.142
46 H ALA 8 H ALA 8 24.733 19.761 14.039
47 HA ALA 8 HA ALA 8 22.150 20.998 14.329
48 HB1 ALA 8 HB1 ALA 8 21.908 20.332 11.991
49 HB2 ALA 8 HB2 ALA 8 23.518 21.014 12.264
50 HB3 ALA 8 HB3 ALA 8 23.317 19.257 12.117
51 H ALA 9 H ALA 9 22.997 18.261 15.752
52 HA ALA 9 HA ALA 9 20.145 17.415 15.853
53 HB1 ALA 9 HB1 ALA 9 22.555 15.555 16.013
54 HB2 ALA 9 HB2 ALA 9 20.861 15.091 16.253
55 HB3 ALA 9 HB3 ALA 9 21.404 15.656 14.661
56 H CYS 10 H CYS 10 23.146 18.191 17.502
57 HA CYS 10 HA CYS 10 22.376 17.242 20.104
58 HB2 CYS 10 HB2 CYS 10 24.729 17.516 19.277
59 HB3 CYS 10 HB3 CYS 10 24.514 19.271 19.326
60 H GLU 11 H GLU 11 22.451 20.530 18.621
61 HA GLU 11 HA GLU 11 21.317 22.007 20.769
62 HB2 GLU 11 HB2 GLU 11 21.008 22.227 17.753
63 HB3 GLU 11 HB3 GLU 11 20.451 23.469 18.870
64 HG2 GLU 11 HG2 GLU 11 23.365 22.557 18.787
65 HG3 GLU 11 HG3 GLU 11 22.730 23.797 17.719
66 H LEU 12 H LEU 12 19.766 20.123 18.206
67 HA LEU 12 HA LEU 12 17.043 20.613 18.987
68 HB2 LEU 12 HB2 LEU 12 18.040 18.275 17.332
69 HB3 LEU 12 HB3 LEU 12 16.484 19.078 17.257
70 HG LEU 12 HG LEU 12 19.173 20.150 16.287
71 HD11 LEU 12 HD11 LEU 12 18.035 18.477 14.853
72 HD12 LEU 12 HD12 LEU 12 16.582 19.504 14.809
73 HD13 LEU 12 HD13 LEU 12 18.108 20.069 14.094
74 HD21 LEU 12 HD21 LEU 12 17.862 22.054 17.207
75 HD22 LEU 12 HD22 LEU 12 17.938 22.118 15.455
76 HD23 LEU 12 HD23 LEU 12 16.452 21.550 16.251
77 H SER 13 H SER 13 19.357 18.669 20.449
78 HA SER 13 HA SER 13 17.393 16.812 21.706
79 HB2 SER 13 HB2 SER 13 20.422 16.655 21.740
80 HB3 SER 13 HB3 SER 13 19.277 15.441 22.335
81 HG SER 13 HG SER 13 19.642 16.312 19.640
82 H CYS 14 H CYS 14 18.952 19.745 22.290
83 HA CYS 14 HA CYS 14 18.896 19.401 25.272
84 HB2 CYS 14 HB2 CYS 14 20.594 21.074 23.412
85 HB3 CYS 14 HB3 CYS 14 20.516 21.371 25.133
86 H ARG 15 H ARG 15 17.940 21.623 22.600
87 HA ARG 15 HA ARG 15 17.424 23.814 24.337
88 HB2 ARG 15 HB2 ARG 15 16.695 23.247 21.451
89 HB3 ARG 15 HB3 ARG 15 16.216 24.761 22.269
90 HG2 ARG 15 HG2 ARG 15 18.527 25.295 22.820
91 HG3 ARG 15 HG3 ARG 15 19.096 23.772 22.160
92 HD2 ARG 15 HD2 ARG 15 18.297 24.411 19.904
93 HD3 ARG 15 HD3 ARG 15 17.722 25.959 20.561
94 HE ARG 15 HE ARG 15 20.601 25.068 20.546
95 HH11 ARG 15 HH11 ARG 15 18.421 27.824 20.785
96 HH12 ARG 15 HH12 ARG 15 19.747 28.918 20.380
97 HH21 ARG 15 HH21 ARG 15 22.136 26.551 20.050
98 HH22 ARG 15 HH22 ARG 15 21.693 28.259 20.049
99 H SER 16 H SER 16 15.252 21.174 23.725
100 HA SER 16 HA SER 16 12.875 22.569 24.597
101 HB2 SER 16 HB2 SER 16 11.930 20.391 25.022
102 HB3 SER 16 HB3 SER 16 12.723 20.427 23.463
103 HG SER 16 HG SER 16 13.108 18.545 24.826
104 H LEU 17 H LEU 17 15.680 21.496 26.358
105 HA LEU 17 HA LEU 17 14.340 21.548 28.993
106 HB2 LEU 17 HB2 LEU 17 17.315 21.399 28.426
107 HB3 LEU 17 HB3 LEU 17 16.458 20.871 29.861
108 HG LEU 17 HG LEU 17 16.394 19.594 27.103
109 HD11 LEU 17 HD11 LEU 17 17.583 18.640 29.744
110 HD12 LEU 17 HD12 LEU 17 17.557 17.735 28.217
111 HD13 LEU 17 HD13 LEU 17 18.481 19.232 28.328
112 HD21 LEU 17 HD21 LEU 17 15.135 17.735 28.196
113 HD22 LEU 17 HD22 LEU 17 15.031 18.685 29.695
114 HD23 LEU 17 HD23 LEU 17 14.207 19.232 28.216
115 H GLY 18 H GLY 18 15.571 23.931 26.930
116 HA2 GLY 18 HA2 GLY 18 15.620 26.232 27.316
117 HA3 GLY 18 HA3 GLY 18 15.707 25.971 29.053
118 H LEU 19 H LEU 19 18.078 23.973 27.852
119 HA LEU 19 HA LEU 19 20.155 26.108 27.873
120 HB2 LEU 19 HB2 LEU 19 21.779 24.448 28.567
121 HB3 LEU 19 HB3 LEU 19 20.575 24.798 29.772
122 HG LEU 19 HG LEU 19 21.475 22.349 29.343
123 HD11 LEU 19 HD11 LEU 19 19.822 22.878 31.044
124 HD12 LEU 19 HD12 LEU 19 18.521 22.925 29.843
125 HD13 LEU 19 HD13 LEU 19 19.365 21.398 30.204
126 HD21 LEU 19 HD21 LEU 19 20.821 22.268 26.967
127 HD22 LEU 19 HD22 LEU 19 20.100 20.974 27.933
128 HD23 LEU 19 HD23 LEU 19 19.115 22.352 27.428
129 H LEU 20 H LEU 20 22.220 25.188 26.628
130 HA LEU 20 HA LEU 20 21.197 24.713 23.859
131 HB2 LEU 20 HB2 LEU 20 23.842 25.954 24.611
132 HB3 LEU 20 HB3 LEU 20 23.020 25.967 23.045
133 HG LEU 20 HG LEU 20 22.248 27.513 25.561
134 HD11 LEU 20 HD11 LEU 20 22.715 29.470 24.176
135 HD12 LEU 20 HD12 LEU 20 24.137 28.410 24.254
136 HD13 LEU 20 HD13 LEU 20 23.119 28.432 22.793
137 HD21 LEU 20 HD21 LEU 20 20.151 26.859 24.410
138 HD22 LEU 20 HD22 LEU 20 20.474 28.583 24.215
139 HD23 LEU 20 HD23 LEU 20 20.813 27.464 22.884
140 H GLY 21 H GLY 21 22.476 23.406 22.402
141 HA2 GLY 21 HA2 GLY 21 23.792 21.086 23.791
142 HA3 GLY 21 HA3 GLY 21 22.977 21.035 22.241
143 H LYS 22 H LYS 22 25.904 21.540 23.869
144 HA LYS 22 HA LYS 22 27.370 21.892 21.290
145 HB2 LYS 22 HB2 LYS 22 27.961 23.494 23.809
146 HB3 LYS 22 HB3 LYS 22 29.111 23.228 22.520
147 HG2 LYS 22 HG2 LYS 22 28.293 25.325 22.070
148 HG3 LYS 22 HG3 LYS 22 27.477 24.293 20.896
149 HD2 LYS 22 HD2 LYS 22 25.372 24.497 22.086
150 HD3 LYS 22 HD3 LYS 22 26.183 25.143 23.516
151 HE2 LYS 22 HE2 LYS 22 25.082 26.961 22.444
152 HE3 LYS 22 HE3 LYS 22 26.820 27.175 22.210
153 HZ1 LYS 22 HZ1 LYS 22 24.976 26.026 20.174
154 HZ2 LYS 22 HZ2 LYS 22 25.461 27.584 20.206
155 HZ3 LYS 22 HZ3 LYS 22 26.576 26.393 19.947
156 H CYS 23 H CYS 23 28.813 20.380 20.984
157 HA CYS 23 HA CYS 23 28.803 18.101 22.687
158 HB2 CYS 23 HB2 CYS 23 30.519 18.825 20.290
159 HB3 CYS 23 HB3 CYS 23 30.440 17.226 21.010
160 H ILE 24 H ILE 24 30.529 16.951 23.619
161 HA ILE 24 HA ILE 24 33.121 18.290 24.083
162 HB ILE 24 HB ILE 24 31.466 17.119 26.360
163 HG12 ILE 24 HG12 ILE 24 32.380 19.978 25.807
164 HG13 ILE 24 HG13 ILE 24 30.720 19.386 25.796
165 HG21 ILE 24 HG21 ILE 24 33.886 16.550 26.560
166 HG22 ILE 24 HG22 ILE 24 34.296 18.275 26.393
167 HG23 ILE 24 HG23 ILE 24 33.396 17.674 27.799
168 HD11 ILE 24 HD11 ILE 24 30.891 18.877 28.235
169 HD12 ILE 24 HD12 ILE 24 32.494 19.663 28.243
170 HD13 ILE 24 HD13 ILE 24 31.063 20.596 27.819
171 H GLY 25 H GLY 25 34.756 16.838 23.754
172 HA2 GLY 25 HA2 GLY 25 35.855 14.826 23.481
173 HA3 GLY 25 HA3 GLY 25 34.666 14.103 24.572
174 H GLU 26 H GLU 26 34.150 15.560 21.379
175 HA GLU 26 HA GLU 26 33.094 14.914 19.518
176 HB2 GLU 26 HB2 GLU 26 34.415 12.241 19.971
177 HB3 GLU 26 HB3 GLU 26 33.904 12.958 18.434
178 HG2 GLU 26 HG2 GLU 26 35.539 14.783 18.696
179 HG3 GLU 26 HG3 GLU 26 36.067 14.105 20.237
180 H GLU 27 H GLU 27 31.532 14.217 22.137
181 HA GLU 27 HA GLU 27 29.287 13.088 20.555
182 HB2 GLU 27 HB2 GLU 27 30.381 11.394 22.217
183 HB3 GLU 27 HB3 GLU 27 29.562 12.350 23.467
184 HG2 GLU 27 HG3 GLU 27 27.388 11.939 22.210
185 HG3 GLU 27 HG2 GLU 27 28.276 10.933 21.080
186 H CYS 28 H CYS 28 27.110 13.702 21.388
187 HA CYS 28 HA CYS 28 26.993 16.489 21.991
188 HB2 CYS 28 HB2 CYS 28 25.340 15.410 20.594
189 HB3 CYS 28 HB3 CYS 28 24.855 14.345 21.913
190 H LYS 29 H LYS 29 27.009 17.474 23.739
191 HA LYS 29 HA LYS 29 25.752 16.524 26.256
192 HB2 LYS 29 HB2 LYS 29 28.412 18.011 25.961
193 HB3 LYS 29 HB3 LYS 29 27.506 17.949 27.461
194 HG2 LYS 29 HG2 LYS 29 28.679 15.517 26.039
195 HG3 LYS 29 HG3 LYS 29 29.386 16.371 27.417
196 HD2 LYS 29 HD2 LYS 29 27.206 15.878 28.684
197 HD3 LYS 29 HD3 LYS 29 26.814 14.749 27.388
198 HE2 LYS 29 HE2 LYS 29 29.290 14.653 29.190
199 HE3 LYS 29 HE3 LYS 29 27.832 13.672 29.366
200 HZ1 LYS 29 HZ1 LYS 29 29.361 12.317 28.219
201 HZ2 LYS 29 HZ2 LYS 29 28.312 12.810 27.076
202 HZ3 LYS 29 HZ3 LYS 29 29.795 13.483 27.148
203 H CYS 30 H CYS 30 24.724 18.250 27.431
204 HA CYS 30 HA CYS 30 24.259 20.737 25.878
205 HB2 CYS 30 HB2 CYS 30 22.955 19.968 28.476
206 HB3 CYS 30 HB3 CYS 30 22.486 21.160 27.302
207 H VAL 31 H VAL 31 24.282 22.829 27.122
208 HA VAL 31 HA VAL 31 26.756 22.980 28.753
209 HB VAL 31 HB VAL 31 26.933 25.269 28.148
210 HG11 VAL 31 HG11 VAL 31 27.218 25.147 25.769
211 HG12 VAL 31 HG12 VAL 31 27.697 23.610 26.491
212 HG13 VAL 31 HG13 VAL 31 26.136 23.743 25.654
213 HG21 VAL 31 HG21 VAL 31 25.329 26.399 26.636
214 HG22 VAL 31 HG22 VAL 31 24.217 25.030 26.834
215 HG23 VAL 31 HG23 VAL 31 24.644 26.048 28.226
216 HA PRO 32 HA PRO 32 24.646 24.875 32.339
217 HB2 PRO 32 HB2 PRO 32 27.043 26.652 32.538
218 HB3 PRO 32 HB3 PRO 32 26.322 25.600 33.772
219 HG2 PRO 32 HG2 PRO 32 28.658 24.932 32.555
220 HG3 PRO 32 HG3 PRO 32 27.412 23.678 32.881
221 HD2 PRO 32 HD2 PRO 32 27.867 25.215 30.289
222 HD3 PRO 32 HD3 PRO 32 27.740 23.441 30.550
223 H TYR 33 H TYR 33 23.206 26.632 32.413
224 HA TYR 33 HA TYR 33 23.839 29.091 30.942
225 HB2 TYR 33 HB2 TYR 33 22.724 27.207 29.406
226 HB3 TYR 33 HB3 TYR 33 21.241 27.755 30.172
227 HD1 TYR 33 HD2 TYR 33 24.382 29.370 28.844
228 HD2 TYR 33 HD1 TYR 33 20.069 29.268 28.738
229 HE1 TYR 33 HE2 TYR 33 24.381 31.322 27.336
230 HE2 TYR 33 HE1 TYR 33 20.075 31.187 27.147
231 HH TYR 33 HH TYR 33 21.367 32.776 26.052
Start of MODEL 10
1 H1 GLY 1 H1 GLY 1 36.436 12.902 22.013
2 H2 GLY 1 H2 GLY 1 36.367 12.218 20.523
3 H3 GLY 1 H3 GLY 1 37.587 11.818 21.572
4 HA2 GLY 1 HA2 GLY 1 36.106 10.712 23.038
5 HA3 GLY 1 HA3 GLY 1 34.748 11.293 22.056
6 H SER 2 H SER 2 34.182 9.034 21.958
7 HA SER 2 HA SER 2 35.449 7.616 19.653
8 HB2 SER 2 HB2 SER 2 34.910 6.320 22.332
9 HB3 SER 2 HB3 SER 2 35.438 5.479 20.860
10 HG SER 2 HG SER 2 36.990 6.462 22.620
11 H ALA 3 H ALA 3 32.914 9.143 20.104
12 HA ALA 3 HA ALA 3 31.291 7.282 18.542
13 HB1 ALA 3 HB1 ALA 3 29.211 7.854 19.708
14 HB2 ALA 3 HB2 ALA 3 30.351 7.097 20.834
15 HB3 ALA 3 HB3 ALA 3 30.106 8.859 20.861
16 H PHE 4 H PHE 4 29.690 8.449 17.176
17 HA PHE 4 HA PHE 4 30.819 10.818 15.987
18 HB2 PHE 4 HB2 PHE 4 28.024 9.685 15.625
19 HB3 PHE 4 HB3 PHE 4 28.858 10.786 14.539
20 HD1 PHE 4 HD2 PHE 4 31.299 9.844 13.739
21 HD2 PHE 4 HD1 PHE 4 27.918 7.449 14.899
22 HE1 PHE 4 HE2 PHE 4 32.230 7.926 12.490
23 HE2 PHE 4 HE1 PHE 4 28.876 5.517 13.690
24 HZ PHE 4 HZ PHE 4 31.057 5.737 12.498
25 H CYS 5 H CYS 5 29.868 12.981 15.775
26 HA CYS 5 HA CYS 5 27.618 13.662 17.506
27 HB2 CYS 5 HB2 CYS 5 29.607 13.900 18.980
28 HB3 CYS 5 HB3 CYS 5 30.200 15.190 17.931
29 H ASN 6 H ASN 6 26.501 14.132 15.729
30 HA ASN 6 HA ASN 6 27.169 16.445 14.033
31 HB2 ASN 6 HB2 ASN 6 25.828 14.638 13.151
32 HB3 ASN 6 HB3 ASN 6 24.654 14.768 14.461
33 HD21 ASN 6 HD22 ASN 6 24.040 14.829 11.702
34 HD22 ASN 6 HD21 ASN 6 23.446 16.466 11.351
35 H LEU 7 H LEU 7 27.187 18.398 14.893
36 HA LEU 7 HA LEU 7 26.218 19.024 17.518
37 HB2 LEU 7 HB2 LEU 7 28.252 19.974 16.487
38 HB3 LEU 7 HB3 LEU 7 27.275 20.754 15.245
39 HG LEU 7 HG LEU 7 26.183 22.163 16.995
40 HD11 LEU 7 HD11 LEU 7 28.223 20.874 18.856
41 HD12 LEU 7 HD12 LEU 7 27.232 22.304 19.229
42 HD13 LEU 7 HD13 LEU 7 26.447 20.743 18.983
43 HD21 LEU 7 HD21 LEU 7 28.176 22.952 15.751
44 HD22 LEU 7 HD22 LEU 7 28.153 23.585 17.404
45 HD23 LEU 7 HD23 LEU 7 29.234 22.242 16.989
46 H ALA 8 H ALA 8 25.028 19.919 14.227
47 HA ALA 8 HA ALA 8 22.879 21.578 15.111
48 HB1 ALA 8 HB1 ALA 8 23.231 19.905 12.588
49 HB2 ALA 8 HB2 ALA 8 22.019 21.187 12.807
50 HB3 ALA 8 HB3 ALA 8 23.750 21.591 12.821
51 H ALA 9 H ALA 9 23.089 18.042 14.735
52 HA ALA 9 HA ALA 9 20.288 17.595 15.437
53 HB1 ALA 9 HB1 ALA 9 20.936 15.253 15.447
54 HB2 ALA 9 HB2 ALA 9 21.599 16.050 14.010
55 HB3 ALA 9 HB3 ALA 9 22.653 15.685 15.398
56 H CYS 10 H CYS 10 23.214 18.097 17.276
57 HA CYS 10 HA CYS 10 22.329 16.805 19.741
58 HB2 CYS 10 HB2 CYS 10 24.711 17.076 19.113
59 HB3 CYS 10 HB3 CYS 10 24.543 18.821 19.237
60 H GLU 11 H GLU 11 22.361 20.173 18.498
61 HA GLU 11 HA GLU 11 21.122 21.572 20.600
62 HB2 GLU 11 HB2 GLU 11 20.623 21.704 17.611
63 HB3 GLU 11 HB3 GLU 11 20.041 22.906 18.739
64 HG2 GLU 11 HG2 GLU 11 23.007 22.287 18.735
65 HG3 GLU 11 HG3 GLU 11 22.316 23.197 17.386
66 H LEU 12 H LEU 12 19.547 19.354 18.261
67 HA LEU 12 HA LEU 12 16.842 19.886 19.033
68 HB2 LEU 12 HB2 LEU 12 17.904 17.298 17.851
69 HB3 LEU 12 HB3 LEU 12 16.280 17.927 17.736
70 HG LEU 12 HG LEU 12 18.748 19.134 16.413
71 HD11 LEU 12 HD11 LEU 12 16.357 17.654 15.229
72 HD12 LEU 12 HD12 LEU 12 17.723 18.353 14.330
73 HD13 LEU 12 HD13 LEU 12 17.990 16.985 15.421
74 HD21 LEU 12 HD21 LEU 12 17.103 20.892 16.920
75 HD22 LEU 12 HD22 LEU 12 17.069 20.537 15.194
76 HD23 LEU 12 HD23 LEU 12 15.791 19.902 16.246
77 H SER 13 H SER 13 19.251 18.138 20.717
78 HA SER 13 HA SER 13 17.284 16.670 22.418
79 HB2 SER 13 HB2 SER 13 20.292 16.397 22.085
80 HB3 SER 13 HB3 SER 13 19.340 15.556 23.318
81 HG SER 13 HG SER 13 19.089 14.137 21.850
82 H CYS 14 H CYS 14 18.876 19.635 22.369
83 HA CYS 14 HA CYS 14 19.021 19.793 25.365
84 HB2 CYS 14 HB2 CYS 14 20.734 21.003 23.188
85 HB3 CYS 14 HB3 CYS 14 20.812 21.515 24.858
86 H ARG 15 H ARG 15 18.229 21.769 22.411
87 HA ARG 15 HA ARG 15 17.533 24.139 23.824
88 HB2 ARG 15 HB2 ARG 15 16.535 23.051 21.159
89 HB3 ARG 15 HB3 ARG 15 16.237 24.700 21.723
90 HG2 ARG 15 HG2 ARG 15 19.036 23.558 21.276
91 HG3 ARG 15 HG3 ARG 15 18.116 24.447 20.071
92 HD2 ARG 15 HD2 ARG 15 18.007 26.394 21.601
93 HD3 ARG 15 HD3 ARG 15 18.997 25.519 22.788
94 HE ARG 15 HE ARG 15 20.700 25.366 20.796
95 HH11 ARG 15 HH11 ARG 15 18.796 28.243 21.547
96 HH12 ARG 15 HH12 ARG 15 19.977 29.299 20.826
97 HH21 ARG 15 HH21 ARG 15 22.006 26.708 19.733
98 HH22 ARG 15 HH22 ARG 15 21.896 28.440 19.954
99 H SER 16 H SER 16 15.607 21.291 23.237
100 HA SER 16 HA SER 16 13.047 22.220 24.130
101 HB2 SER 16 HB2 SER 16 12.658 19.717 24.337
102 HB3 SER 16 HB3 SER 16 13.242 20.261 22.767
103 HG SER 16 HG SER 16 14.404 18.418 23.543
104 H LEU 17 H LEU 17 15.911 21.485 25.933
105 HA LEU 17 HA LEU 17 14.455 20.988 28.468
106 HB2 LEU 17 HB2 LEU 17 17.452 21.052 28.093
107 HB3 LEU 17 HB3 LEU 17 16.518 20.233 29.337
108 HG LEU 17 HG LEU 17 16.762 19.430 26.417
109 HD11 LEU 17 HD11 LEU 17 17.991 17.505 27.335
110 HD12 LEU 17 HD12 LEU 17 18.770 19.023 27.784
111 HD13 LEU 17 HD13 LEU 17 17.793 18.146 28.983
112 HD21 LEU 17 HD21 LEU 17 15.290 18.025 28.702
113 HD22 LEU 17 HD22 LEU 17 14.526 18.771 27.281
114 HD23 LEU 17 HD23 LEU 17 15.561 17.356 27.077
115 H GLY 18 H GLY 18 15.618 23.662 26.777
116 HA2 GLY 18 HA2 GLY 18 15.534 25.898 27.528
117 HA3 GLY 18 HA3 GLY 18 15.712 25.373 29.199
118 H LEU 19 H LEU 19 18.057 23.929 27.054
119 HA LEU 19 HA LEU 19 19.997 26.135 27.450
120 HB2 LEU 19 HB2 LEU 19 21.732 24.613 28.333
121 HB3 LEU 19 HB3 LEU 19 20.417 24.957 29.433
122 HG LEU 19 HG LEU 19 21.510 22.556 29.208
123 HD11 LEU 19 HD11 LEU 19 19.752 23.151 30.814
124 HD12 LEU 19 HD12 LEU 19 18.502 22.951 29.573
125 HD13 LEU 19 HD13 LEU 19 19.460 21.559 30.119
126 HD21 LEU 19 HD21 LEU 19 20.274 21.008 27.872
127 HD22 LEU 19 HD22 LEU 19 19.197 22.268 27.289
128 HD23 LEU 19 HD23 LEU 19 20.895 22.281 26.808
129 H LEU 20 H LEU 20 22.240 25.349 26.488
130 HA LEU 20 HA LEU 20 21.641 24.903 23.596
131 HB2 LEU 20 HB2 LEU 20 23.811 26.287 25.182
132 HB3 LEU 20 HB3 LEU 20 24.233 25.605 23.653
133 HG LEU 20 HG LEU 20 22.512 26.897 22.510
134 HD11 LEU 20 HD11 LEU 20 21.992 28.163 25.241
135 HD12 LEU 20 HD12 LEU 20 21.407 28.803 23.689
136 HD13 LEU 20 HD13 LEU 20 20.831 27.238 24.251
137 HD21 LEU 20 HD21 LEU 20 23.603 29.090 22.740
138 HD22 LEU 20 HD22 LEU 20 24.334 28.582 24.285
139 HD23 LEU 20 HD23 LEU 20 24.795 27.791 22.759
140 H GLY 21 H GLY 21 22.622 23.336 22.353
141 HA2 GLY 21 HA2 GLY 21 23.806 21.012 23.811
142 HA3 GLY 21 HA3 GLY 21 23.126 20.985 22.176
143 H LYS 22 H LYS 22 25.862 20.473 23.657
144 HA LYS 22 HA LYS 22 27.513 21.382 21.349
145 HB2 LYS 22 HB2 LYS 22 28.176 22.070 24.229
146 HB3 LYS 22 HB3 LYS 22 29.387 22.046 22.940
147 HG2 LYS 22 HG2 LYS 22 27.861 23.607 21.618
148 HG3 LYS 22 HG3 LYS 22 26.902 23.806 23.092
149 HD2 LYS 22 HD2 LYS 22 28.855 24.780 24.241
150 HD3 LYS 22 HD3 LYS 22 29.861 24.500 22.796
151 HE2 LYS 22 HE2 LYS 22 28.264 25.890 21.455
152 HE3 LYS 22 HE3 LYS 22 27.343 26.243 22.919
153 HZ1 LYS 22 HZ1 LYS 22 30.175 26.992 22.440
154 HZ2 LYS 22 HZ2 LYS 22 28.903 28.017 22.361
155 HZ3 LYS 22 HZ3 LYS 22 29.371 27.330 23.807
156 H CYS 23 H CYS 23 29.451 20.280 20.921
157 HA CYS 23 HA CYS 23 29.264 17.428 21.639
158 HB2 CYS 23 HB2 CYS 23 30.870 18.967 19.587
159 HB3 CYS 23 HB3 CYS 23 31.038 17.250 19.856
160 H ILE 24 H ILE 24 29.904 17.843 23.916
161 HA ILE 24 HA ILE 24 32.629 18.789 24.496
162 HB ILE 24 HB ILE 24 30.597 17.569 26.399
163 HG12 ILE 24 HG12 ILE 24 29.491 19.486 25.452
164 HG13 ILE 24 HG13 ILE 24 30.003 19.864 27.086
165 HG21 ILE 24 HG21 ILE 24 32.847 17.592 27.335
166 HG22 ILE 24 HG22 ILE 24 33.080 19.294 26.888
167 HG23 ILE 24 HG23 ILE 24 31.890 18.834 28.123
168 HD11 ILE 24 HD11 ILE 24 31.377 20.816 24.530
169 HD12 ILE 24 HD12 ILE 24 30.356 21.777 25.611
170 HD13 ILE 24 HD13 ILE 24 31.920 21.187 26.184
171 H GLY 25 H GLY 25 34.419 17.483 24.981
172 HA2 GLY 25 HA2 GLY 25 35.725 15.569 24.777
173 HA3 GLY 25 HA3 GLY 25 34.321 14.608 25.286
174 H GLU 26 H GLU 26 34.160 16.740 22.529
175 HA GLU 26 HA GLU 26 33.442 16.512 20.450
176 HB2 GLU 26 HB2 GLU 26 35.077 13.982 20.395
177 HB3 GLU 26 HB3 GLU 26 34.384 14.779 18.997
178 HG2 GLU 26 HG2 GLU 26 36.564 15.478 18.925
179 HG3 GLU 26 HG3 GLU 26 35.715 16.852 19.614
180 H GLU 27 H GLU 27 31.838 15.057 22.725
181 HA GLU 27 HA GLU 27 29.987 13.509 20.974
182 HB2 GLU 27 HB2 GLU 27 31.224 12.866 23.657
183 HB3 GLU 27 HB3 GLU 27 29.688 12.171 23.149
184 HG2 GLU 27 HG2 GLU 27 30.698 11.154 21.187
185 HG3 GLU 27 HG3 GLU 27 32.234 11.969 21.485
186 H CYS 28 H CYS 28 27.703 13.588 21.594
187 HA CYS 28 HA CYS 28 27.051 16.265 22.228
188 HB2 CYS 28 HB2 CYS 28 25.798 14.918 20.631
189 HB3 CYS 28 HB3 CYS 28 25.265 13.853 21.928
190 H LYS 29 H LYS 29 26.854 17.240 24.004
191 HA LYS 29 HA LYS 29 25.183 16.280 26.239
192 HB2 LYS 29 HB2 LYS 29 28.040 17.322 26.494
193 HB3 LYS 29 HB3 LYS 29 26.900 17.463 27.807
194 HG2 LYS 29 HG2 LYS 29 27.808 14.834 26.589
195 HG3 LYS 29 HG3 LYS 29 28.418 15.560 28.081
196 HD2 LYS 29 HD2 LYS 29 26.077 15.473 29.015
197 HD3 LYS 29 HD3 LYS 29 25.576 14.526 27.614
198 HE2 LYS 29 HE2 LYS 29 27.881 13.729 29.448
199 HE3 LYS 29 HE3 LYS 29 26.209 13.264 29.770
200 HZ1 LYS 29 HZ1 LYS 29 27.656 12.536 27.282
201 HZ2 LYS 29 HZ2 LYS 29 27.517 11.577 28.582
202 HZ3 LYS 29 HZ3 LYS 29 26.161 11.984 27.761
203 H CYS 30 H CYS 30 24.809 18.348 27.753
204 HA CYS 30 HA CYS 30 24.480 20.712 25.967
205 HB2 CYS 30 HB2 CYS 30 22.844 20.173 28.419
206 HB3 CYS 30 HB3 CYS 30 22.587 21.263 27.075
207 H VAL 31 H VAL 31 24.628 22.820 26.980
208 HA VAL 31 HA VAL 31 26.883 22.962 28.831
209 HB VAL 31 HB VAL 31 26.927 25.317 28.508
210 HG11 VAL 31 HG11 VAL 31 27.795 23.885 26.672
211 HG12 VAL 31 HG12 VAL 31 26.234 24.042 25.828
212 HG13 VAL 31 HG13 VAL 31 27.241 25.475 26.126
213 HG21 VAL 31 HG21 VAL 31 25.263 26.516 27.119
214 HG22 VAL 31 HG22 VAL 31 24.227 25.061 27.147
215 HG23 VAL 31 HG23 VAL 31 24.601 25.942 28.646
216 HA PRO 32 HA PRO 32 24.567 23.595 32.579
217 HB2 PRO 32 HB2 PRO 32 26.423 24.703 34.242
218 HB3 PRO 32 HB3 PRO 32 26.496 23.008 33.671
219 HG2 PRO 32 HG2 PRO 32 27.995 25.416 32.596
220 HG3 PRO 32 HG3 PRO 32 28.623 23.777 32.938
221 HD2 PRO 32 HD2 PRO 32 27.861 24.623 30.424
222 HD3 PRO 32 HD3 PRO 32 27.749 22.923 30.953
223 H TYR 33 H TYR 33 23.111 25.016 33.206
224 HA TYR 33 HA TYR 33 23.734 27.894 33.519
225 HB2 TYR 33 HB2 TYR 33 21.181 26.727 32.343
226 HB3 TYR 33 HB3 TYR 33 21.325 28.374 32.925
227 HD1 TYR 33 HD1 TYR 33 24.014 29.181 31.785
228 HD2 TYR 33 HD2 TYR 33 20.642 27.105 30.103
229 HE1 TYR 33 HE1 TYR 33 24.566 30.098 29.540
230 HE2 TYR 33 HE2 TYR 33 21.231 27.983 27.847
231 HH TYR 33 HH TYR 33 23.868 30.327 27.388
Start of MODEL 11
1 H1 GLY 1 H1 GLY 1 36.558 13.608 14.376
2 H2 GLY 1 H2 GLY 1 36.834 12.992 12.882
3 H3 GLY 1 H3 GLY 1 37.554 14.401 13.319
4 HA2 GLY 1 HA2 GLY 1 39.140 12.624 13.354
5 HA3 GLY 1 HA3 GLY 1 38.881 13.268 14.980
6 H SER 2 H SER 2 36.995 12.116 16.212
7 HA SER 2 HA SER 2 37.518 9.200 16.000
8 HB2 SER 2 HB2 SER 2 36.665 9.035 18.244
9 HB3 SER 2 HB3 SER 2 37.930 10.265 18.162
10 HG SER 2 HG SER 2 36.326 11.865 18.150
11 H ALA 3 H ALA 3 34.793 11.480 15.812
12 HA ALA 3 HA ALA 3 33.130 9.464 14.540
13 HB1 ALA 3 HB1 ALA 3 32.323 10.505 17.299
14 HB2 ALA 3 HB2 ALA 3 31.368 9.406 16.281
15 HB3 ALA 3 HB3 ALA 3 32.900 8.859 16.966
16 H PHE 4 H PHE 4 33.965 12.534 14.615
17 HA PHE 4 HA PHE 4 33.252 14.557 14.057
18 HB2 PHE 4 HB2 PHE 4 32.798 13.510 11.943
19 HB3 PHE 4 HB3 PHE 4 31.188 13.036 12.474
20 HD1 PHE 4 HD1 PHE 4 33.280 16.135 11.994
21 HD2 PHE 4 HD2 PHE 4 29.352 14.366 11.878
22 HE1 PHE 4 HE1 PHE 4 32.353 18.240 11.082
23 HE2 PHE 4 HE2 PHE 4 28.432 16.477 10.970
24 HZ PHE 4 HZ PHE 4 29.925 18.419 10.561
25 H CYS 5 H CYS 5 32.159 16.289 14.746
26 HA CYS 5 HA CYS 5 30.506 15.955 17.083
27 HB2 CYS 5 HB2 CYS 5 32.063 17.719 17.035
28 HB3 CYS 5 HB3 CYS 5 31.529 18.283 15.464
29 H ASN 6 H ASN 6 28.407 15.638 17.237
30 HA ASN 6 HA ASN 6 26.664 15.917 14.908
31 HB2 ASN 6 HB2 ASN 6 25.136 14.489 16.123
32 HB3 ASN 6 HB3 ASN 6 26.745 13.785 16.096
33 HD21 ASN 6 HD22 ASN 6 24.648 13.073 17.916
34 HD22 ASN 6 HD21 ASN 6 25.445 13.299 19.484
35 H LEU 7 H LEU 7 27.324 18.421 15.836
36 HA LEU 7 HA LEU 7 25.650 19.446 17.860
37 HB2 LEU 7 HB2 LEU 7 27.747 20.478 17.035
38 HB3 LEU 7 HB3 LEU 7 26.916 20.993 15.575
39 HG LEU 7 HG LEU 7 25.434 22.447 16.947
40 HD11 LEU 7 HD11 LEU 7 25.382 21.257 19.094
41 HD12 LEU 7 HD12 LEU 7 27.139 21.483 19.295
42 HD13 LEU 7 HD13 LEU 7 26.033 22.873 19.337
43 HD21 LEU 7 HD21 LEU 7 28.400 22.820 17.553
44 HD22 LEU 7 HD22 LEU 7 27.575 23.328 16.065
45 HD23 LEU 7 HD23 LEU 7 27.152 24.082 17.606
46 H ALA 8 H ALA 8 25.065 19.291 14.363
47 HA ALA 8 HA ALA 8 22.740 20.821 14.138
48 HB1 ALA 8 HB1 ALA 8 23.620 18.319 12.634
49 HB2 ALA 8 HB2 ALA 8 22.406 19.482 12.068
50 HB3 ALA 8 HB3 ALA 8 24.087 19.989 12.269
51 H ALA 9 H ALA 9 22.970 17.671 15.660
52 HA ALA 9 HA ALA 9 19.979 17.576 15.934
53 HB1 ALA 9 HB1 ALA 9 20.355 15.193 16.567
54 HB2 ALA 9 HB2 ALA 9 20.840 15.565 14.908
55 HB3 ALA 9 HB3 ALA 9 22.077 15.403 16.173
56 H CYS 10 H CYS 10 22.991 18.018 17.618
57 HA CYS 10 HA CYS 10 22.084 17.378 20.274
58 HB2 CYS 10 HB2 CYS 10 24.472 17.492 19.509
59 HB3 CYS 10 HB3 CYS 10 24.308 19.241 19.401
60 H GLU 11 H GLU 11 22.362 20.511 18.495
61 HA GLU 11 HA GLU 11 21.442 22.306 20.452
62 HB2 GLU 11 HB2 GLU 11 20.946 22.195 17.455
63 HB3 GLU 11 HB3 GLU 11 20.540 23.595 18.448
64 HG2 GLU 11 HG2 GLU 11 23.375 22.506 18.410
65 HG3 GLU 11 HG3 GLU 11 22.778 23.538 17.115
66 H LEU 12 H LEU 12 19.404 20.644 18.020
67 HA LEU 12 HA LEU 12 16.954 21.521 19.234
68 HB2 LEU 12 HB2 LEU 12 15.865 20.198 17.486
69 HB3 LEU 12 HB3 LEU 12 17.078 21.320 16.908
70 HG LEU 12 HG LEU 12 18.685 19.362 16.650
71 HD11 LEU 12 HD11 LEU 12 17.622 17.108 16.384
72 HD12 LEU 12 HD12 LEU 12 17.577 17.641 18.060
73 HD13 LEU 12 HD13 LEU 12 16.121 17.753 17.073
74 HD21 LEU 12 HD21 LEU 12 17.659 18.662 14.546
75 HD22 LEU 12 HD22 LEU 12 16.065 19.230 15.095
76 HD23 LEU 12 HD23 LEU 12 17.372 20.387 14.789
77 H SER 13 H SER 13 18.953 18.945 20.159
78 HA SER 13 HA SER 13 16.731 17.448 21.477
79 HB2 SER 13 HB2 SER 13 19.720 16.891 21.505
80 HB3 SER 13 HB3 SER 13 18.435 15.875 22.185
81 HG SER 13 HG SER 13 19.001 16.476 19.478
82 H CYS 14 H CYS 14 19.615 19.438 22.302
83 HA CYS 14 HA CYS 14 19.172 19.488 25.140
84 HB2 CYS 14 HB2 CYS 14 20.619 21.226 23.122
85 HB3 CYS 14 HB3 CYS 14 20.559 21.664 24.803
86 H ARG 15 H ARG 15 17.937 21.559 22.465
87 HA ARG 15 HA ARG 15 16.846 23.594 23.997
88 HB2 ARG 15 HB2 ARG 15 17.138 23.696 21.637
89 HB3 ARG 15 HB3 ARG 15 15.901 22.482 21.337
90 HG2 ARG 15 HG2 ARG 15 14.136 23.950 22.042
91 HG3 ARG 15 HG3 ARG 15 15.259 25.095 22.778
92 HD2 ARG 15 HD2 ARG 15 15.049 24.504 19.805
93 HD3 ARG 15 HD3 ARG 15 14.339 25.898 20.620
94 HE ARG 15 HE ARG 15 16.683 26.534 21.311
95 HH11 ARG 15 HH12 ARG 15 16.472 24.499 18.429
96 HH12 ARG 15 HH11 ARG 15 18.117 24.851 17.995
97 HH21 ARG 15 HH22 ARG 15 18.468 27.304 20.403
98 HH22 ARG 15 HH21 ARG 15 19.211 26.431 19.060
99 H SER 16 H SER 16 15.231 20.419 23.562
100 HA SER 16 HA SER 16 12.719 21.104 24.688
101 HB2 SER 16 HB2 SER 16 14.302 18.535 25.128
102 HB3 SER 16 HB3 SER 16 12.562 18.755 25.388
103 HG SER 16 HG SER 16 12.542 19.415 23.075
104 H LEU 17 H LEU 17 15.799 20.970 26.292
105 HA LEU 17 HA LEU 17 14.654 20.739 29.007
106 HB2 LEU 17 HB2 LEU 17 17.549 21.079 28.201
107 HB3 LEU 17 HB3 LEU 17 16.913 20.397 29.691
108 HG LEU 17 HG LEU 17 16.885 19.164 26.918
109 HD11 LEU 17 HD11 LEU 17 18.412 17.520 27.899
110 HD12 LEU 17 HD12 LEU 17 19.068 19.157 28.041
111 HD13 LEU 17 HD13 LEU 17 18.347 18.366 29.463
112 HD21 LEU 17 HD21 LEU 17 16.023 17.099 28.044
113 HD22 LEU 17 HD22 LEU 17 15.843 18.021 29.559
114 HD23 LEU 17 HD23 LEU 17 14.852 18.420 28.143
115 H GLY 18 H GLY 18 15.333 23.246 26.836
116 HA2 GLY 18 HA2 GLY 18 15.042 25.530 27.216
117 HA3 GLY 18 HA3 GLY 18 15.297 25.297 28.942
118 H LEU 19 H LEU 19 17.792 23.842 27.129
119 HA LEU 19 HA LEU 19 19.523 26.280 27.241
120 HB2 LEU 19 HB2 LEU 19 21.400 24.899 28.041
121 HB3 LEU 19 HB3 LEU 19 20.129 25.137 29.193
122 HG LEU 19 HG LEU 19 21.344 22.822 28.985
123 HD11 LEU 19 HD11 LEU 19 18.317 22.965 29.258
124 HD12 LEU 19 HD12 LEU 19 19.383 21.674 29.858
125 HD13 LEU 19 HD13 LEU 19 19.478 23.305 30.536
126 HD21 LEU 19 HD21 LEU 19 20.205 21.210 27.592
127 HD22 LEU 19 HD22 LEU 19 19.193 22.470 26.897
128 HD23 LEU 19 HD23 LEU 19 20.949 22.500 26.624
129 H LEU 20 H LEU 20 21.834 25.039 26.212
130 HA LEU 20 HA LEU 20 21.056 24.534 23.365
131 HB2 LEU 20 HB2 LEU 20 23.138 26.456 24.469
132 HB3 LEU 20 HB3 LEU 20 23.085 25.968 22.785
133 HG LEU 20 HG LEU 20 20.739 27.333 24.175
134 HD11 LEU 20 HD11 LEU 20 22.734 28.805 24.166
135 HD12 LEU 20 HD12 LEU 20 22.900 28.551 22.417
136 HD13 LEU 20 HD13 LEU 20 21.473 29.385 23.060
137 HD21 LEU 20 HD21 LEU 20 20.060 27.837 21.853
138 HD22 LEU 20 HD22 LEU 20 21.445 26.909 21.229
139 HD23 LEU 20 HD23 LEU 20 20.139 26.092 22.115
140 H GLY 21 H GLY 21 22.905 23.706 22.031
141 HA2 GLY 21 HA2 GLY 21 23.965 21.327 23.403
142 HA3 GLY 21 HA3 GLY 21 23.907 21.630 21.674
143 H LYS 22 H LYS 22 25.998 20.712 23.601
144 HA LYS 22 HA LYS 22 28.183 22.081 22.100
145 HB2 LYS 22 HB2 LYS 22 28.277 22.974 24.346
146 HB3 LYS 22 HB3 LYS 22 28.182 21.360 25.064
147 HG2 LYS 22 HG2 LYS 22 30.367 20.773 24.222
148 HG3 LYS 22 HG3 LYS 22 30.480 22.259 23.280
149 HD2 LYS 22 HD2 LYS 22 30.307 22.137 26.322
150 HD3 LYS 22 HD3 LYS 22 31.823 22.198 25.415
151 HE2 LYS 22 HE2 LYS 22 31.179 24.369 24.417
152 HE3 LYS 22 HE3 LYS 22 29.657 24.339 25.325
153 HZ1 LYS 22 HZ1 LYS 22 31.357 25.646 26.491
154 HZ2 LYS 22 HZ2 LYS 22 30.952 24.310 27.369
155 HZ3 LYS 22 HZ3 LYS 22 32.370 24.377 26.516
156 H CYS 23 H CYS 23 29.821 20.738 21.342
157 HA CYS 23 HA CYS 23 29.494 17.802 21.661
158 HB2 CYS 23 HB2 CYS 23 31.148 19.583 19.876
159 HB3 CYS 23 HB3 CYS 23 31.460 17.856 20.016
160 H ILE 24 H ILE 24 30.648 16.660 23.080
161 HA ILE 24 HA ILE 24 33.377 17.564 23.840
162 HB ILE 24 HB ILE 24 31.412 16.414 25.853
163 HG12 ILE 24 HG12 ILE 24 32.503 19.242 25.508
164 HG13 ILE 24 HG13 ILE 24 30.816 18.724 25.406
165 HG21 ILE 24 HG21 ILE 24 33.799 15.695 26.168
166 HG22 ILE 24 HG22 ILE 24 34.285 17.404 26.190
167 HG23 ILE 24 HG23 ILE 24 33.252 16.731 27.467
168 HD11 ILE 24 HD11 ILE 24 32.529 18.854 27.903
169 HD12 ILE 24 HD12 ILE 24 31.104 19.822 27.498
170 HD13 ILE 24 HD13 ILE 24 30.919 18.088 27.839
171 H GLY 25 H GLY 25 34.757 16.068 23.255
172 HA2 GLY 25 HA2 GLY 25 35.644 14.064 22.490
173 HA3 GLY 25 HA3 GLY 25 34.413 13.190 23.413
174 H GLU 26 H GLU 26 33.758 15.581 20.855
175 HA GLU 26 HA GLU 26 32.479 15.558 19.030
176 HB2 GLU 26 HB2 GLU 26 33.786 12.872 18.601
177 HB3 GLU 26 HB3 GLU 26 32.746 13.625 17.401
178 HG2 GLU 26 HG2 GLU 26 34.204 15.424 17.022
179 HG3 GLU 26 HG3 GLU 26 35.099 15.162 18.522
180 H GLU 27 H GLU 27 31.259 14.363 21.599
181 HA GLU 27 HA GLU 27 28.734 13.517 20.245
182 HB2 GLU 27 HB2 GLU 27 30.257 11.822 21.788
183 HB3 GLU 27 HB3 GLU 27 29.194 12.493 23.002
184 HG2 GLU 27 HG2 GLU 27 28.324 11.138 20.405
185 HG3 GLU 27 HG3 GLU 27 28.418 10.346 21.972
186 H CYS 28 H CYS 28 26.784 14.064 21.372
187 HA CYS 28 HA CYS 28 26.743 16.765 22.144
188 HB2 CYS 28 HB2 CYS 28 25.007 15.550 20.889
189 HB3 CYS 28 HB3 CYS 28 24.640 14.582 22.315
190 H LYS 29 H LYS 29 26.880 17.725 23.956
191 HA LYS 29 HA LYS 29 25.666 16.736 26.473
192 HB2 LYS 29 HB2 LYS 29 28.419 18.063 26.244
193 HB3 LYS 29 HB3 LYS 29 27.549 17.804 27.746
194 HG2 LYS 29 HG2 LYS 29 28.653 15.631 25.914
195 HG3 LYS 29 HG3 LYS 29 29.330 16.158 27.453
196 HD2 LYS 29 HD2 LYS 29 27.282 15.382 28.638
197 HD3 LYS 29 HD3 LYS 29 26.614 14.813 27.106
198 HE2 LYS 29 HE2 LYS 29 28.727 13.391 26.833
199 HE3 LYS 29 HE3 LYS 29 29.119 13.828 28.505
200 HZ1 LYS 29 HZ1 LYS 29 26.820 12.955 29.039
201 HZ2 LYS 29 HZ2 LYS 29 26.815 12.238 27.536
202 HZ3 LYS 29 HZ3 LYS 29 27.935 11.831 28.667
203 H CYS 30 H CYS 30 24.682 18.506 27.681
204 HA CYS 30 HA CYS 30 24.339 20.917 26.004
205 HB2 CYS 30 HB2 CYS 30 22.820 20.051 28.437
206 HB3 CYS 30 HB3 CYS 30 22.452 21.331 27.320
207 H VAL 31 H VAL 31 24.356 23.024 26.775
208 HA VAL 31 HA VAL 31 26.519 23.599 28.669
209 HB VAL 31 HB VAL 31 26.437 25.855 27.891
210 HG11 VAL 31 HG11 VAL 31 26.882 25.576 25.547
211 HG12 VAL 31 HG12 VAL 31 27.487 24.159 26.417
212 HG13 VAL 31 HG13 VAL 31 25.975 24.056 25.484
213 HG21 VAL 31 HG21 VAL 31 24.807 26.668 26.237
214 HG22 VAL 31 HG22 VAL 31 23.852 25.187 26.468
215 HG23 VAL 31 HG23 VAL 31 24.065 26.335 27.803
216 HA PRO 32 HA PRO 32 23.886 25.240 32.017
217 HB2 PRO 32 HB2 PRO 32 25.452 27.194 33.081
218 HB3 PRO 32 HB3 PRO 32 25.785 25.451 33.327
219 HG2 PRO 32 HG2 PRO 32 27.036 27.320 31.280
220 HG3 PRO 32 HG3 PRO 32 27.859 26.188 32.391
221 HD2 PRO 32 HD2 PRO 32 27.324 25.535 29.809
222 HD3 PRO 32 HD3 PRO 32 27.233 24.312 31.102
223 H TYR 33 H TYR 33 22.256 26.675 31.864
224 HA TYR 33 HA TYR 33 22.554 29.195 30.320
225 HB2 TYR 33 HB2 TYR 33 21.660 27.219 28.932
226 HB3 TYR 33 HB3 TYR 33 20.188 27.361 29.885
227 HD1 TYR 33 HD1 TYR 33 18.954 29.641 29.863
228 HD2 TYR 33 HD2 TYR 33 22.068 28.593 27.071
229 HE1 TYR 33 HE1 TYR 33 18.197 31.458 28.339
230 HE2 TYR 33 HE2 TYR 33 21.277 30.397 25.525
231 HH TYR 33 HH TYR 33 18.648 32.628 26.404
Start of MODEL 12
1 H1 GLY 1 H1 GLY 1 33.077 11.574 18.026
2 H2 GLY 1 H2 GLY 1 33.163 12.364 19.473
3 H3 GLY 1 H3 GLY 1 33.513 10.759 19.393
4 HA2 GLY 1 HA2 GLY 1 35.543 11.956 19.585
5 HA3 GLY 1 HA3 GLY 1 35.417 11.186 17.995
6 H SER 2 H SER 2 37.123 13.411 18.452
7 HA SER 2 HA SER 2 36.108 15.955 18.053
8 HB2 SER 2 HB2 SER 2 38.321 16.574 17.213
9 HB3 SER 2 HB3 SER 2 38.445 15.495 18.608
10 HG SER 2 HG SER 2 38.951 13.796 17.261
11 H ALA 3 H ALA 3 36.472 13.547 15.453
12 HA ALA 3 HA ALA 3 35.799 15.621 13.443
13 HB1 ALA 3 HB1 ALA 3 36.494 13.945 11.787
14 HB2 ALA 3 HB2 ALA 3 37.761 14.189 12.999
15 HB3 ALA 3 HB3 ALA 3 36.726 12.744 13.073
16 H PHE 4 H PHE 4 34.182 13.552 15.346
17 HA PHE 4 HA PHE 4 31.702 13.582 13.712
18 HB2 PHE 4 HB2 PHE 4 32.929 11.084 14.942
19 HB3 PHE 4 HB3 PHE 4 31.243 11.225 14.460
20 HD1 PHE 4 HD2 PHE 4 34.738 11.100 13.195
21 HD2 PHE 4 HD1 PHE 4 30.550 11.046 12.159
22 HE1 PHE 4 HE2 PHE 4 35.312 10.384 10.886
23 HE2 PHE 4 HE1 PHE 4 31.132 10.318 9.861
24 HZ PHE 4 HZ PHE 4 33.512 9.990 9.221
25 H CYS 5 H CYS 5 31.174 15.256 15.109
26 HA CYS 5 HA CYS 5 29.998 14.430 17.691
27 HB2 CYS 5 HB2 CYS 5 32.391 15.424 17.965
28 HB3 CYS 5 HB3 CYS 5 31.657 16.964 17.545
29 H ASN 6 H ASN 6 28.286 14.507 15.943
30 HA ASN 6 HA ASN 6 27.854 16.880 14.441
31 HB2 ASN 6 HB2 ASN 6 27.290 14.588 13.688
32 HB3 ASN 6 HB3 ASN 6 25.998 14.513 14.891
33 HD21 ASN 6 HD22 ASN 6 24.830 14.028 12.799
34 HD22 ASN 6 HD21 ASN 6 24.273 15.410 11.848
35 H LEU 7 H LEU 7 26.945 18.694 14.953
36 HA LEU 7 HA LEU 7 25.570 19.021 17.492
37 HB2 LEU 7 HB2 LEU 7 27.462 20.414 16.614
38 HB3 LEU 7 HB3 LEU 7 26.375 21.066 15.392
39 HG LEU 7 HG LEU 7 25.001 22.105 17.178
40 HD11 LEU 7 HD11 LEU 7 25.288 20.579 19.052
41 HD12 LEU 7 HD12 LEU 7 27.053 20.832 19.045
42 HD13 LEU 7 HD13 LEU 7 25.960 22.144 19.514
43 HD21 LEU 7 HD21 LEU 7 26.700 23.742 17.939
44 HD22 LEU 7 HD22 LEU 7 27.990 22.634 17.450
45 HD23 LEU 7 HD23 LEU 7 26.912 23.339 16.225
46 H ALA 8 H ALA 8 24.549 18.675 14.216
47 HA ALA 8 HA ALA 8 22.769 20.646 13.753
48 HB1 ALA 8 HB1 ALA 8 23.542 19.019 12.097
49 HB2 ALA 8 HB2 ALA 8 22.550 17.748 12.835
50 HB3 ALA 8 HB3 ALA 8 21.773 19.144 12.061
51 H ALA 9 H ALA 9 21.610 17.448 14.955
52 HA ALA 9 HA ALA 9 19.123 18.738 15.960
53 HB1 ALA 9 HB1 ALA 9 18.191 16.480 15.986
54 HB2 ALA 9 HB2 ALA 9 18.848 16.864 14.384
55 HB3 ALA 9 HB3 ALA 9 19.750 15.801 15.480
56 H CYS 10 H CYS 10 22.129 17.963 17.103
57 HA CYS 10 HA CYS 10 21.507 16.916 19.757
58 HB2 CYS 10 HB2 CYS 10 23.702 16.578 18.793
59 HB3 CYS 10 HB3 CYS 10 23.909 18.307 18.563
60 H GLU 11 H GLU 11 22.270 20.212 18.458
61 HA GLU 11 HA GLU 11 21.688 21.700 20.825
62 HB2 GLU 11 HB2 GLU 11 21.851 22.209 17.876
63 HB3 GLU 11 HB3 GLU 11 20.899 23.376 18.786
64 HG2 GLU 11 HG2 GLU 11 23.617 22.588 19.850
65 HG3 GLU 11 HG3 GLU 11 23.500 23.696 18.486
66 H LEU 12 H LEU 12 19.441 20.531 18.297
67 HA LEU 12 HA LEU 12 17.101 21.806 19.347
68 HB2 LEU 12 HB2 LEU 12 17.243 19.156 17.853
69 HB3 LEU 12 HB3 LEU 12 15.858 20.232 17.974
70 HG LEU 12 HG LEU 12 18.471 20.851 16.524
71 HD11 LEU 12 HD11 LEU 12 17.253 20.570 14.491
72 HD12 LEU 12 HD12 LEU 12 16.941 19.126 15.460
73 HD13 LEU 12 HD13 LEU 12 15.703 20.387 15.353
74 HD21 LEU 12 HD21 LEU 12 15.879 22.447 16.673
75 HD22 LEU 12 HD22 LEU 12 17.450 22.929 17.363
76 HD23 LEU 12 HD23 LEU 12 17.260 22.811 15.611
77 H SER 13 H SER 13 18.555 18.618 20.043
78 HA SER 13 HA SER 13 16.526 17.763 21.893
79 HB2 SER 13 HB2 SER 13 17.928 15.939 22.364
80 HB3 SER 13 HB3 SER 13 18.208 16.305 20.661
81 HG SER 13 HG SER 13 20.087 17.613 21.559
82 H CYS 14 H CYS 14 19.170 19.940 22.249
83 HA CYS 14 HA CYS 14 19.024 19.927 25.214
84 HB2 CYS 14 HB2 CYS 14 20.692 21.446 23.195
85 HB3 CYS 14 HB3 CYS 14 20.775 21.720 24.923
86 H ARG 15 H ARG 15 17.989 22.016 22.453
87 HA ARG 15 HA ARG 15 16.867 24.063 24.102
88 HB2 ARG 15 HB2 ARG 15 17.321 23.871 21.451
89 HB3 ARG 15 HB3 ARG 15 15.647 23.332 21.435
90 HG2 ARG 15 HG2 ARG 15 15.614 25.692 21.078
91 HG3 ARG 15 HG3 ARG 15 15.053 25.433 22.728
92 HD2 ARG 15 HD2 ARG 15 16.513 27.308 22.761
93 HD3 ARG 15 HD3 ARG 15 17.404 26.014 23.543
94 HE ARG 15 HE ARG 15 17.882 27.239 20.874
95 HH11 ARG 15 HH11 ARG 15 19.240 24.983 23.301
96 HH12 ARG 15 HH12 ARG 15 20.629 24.749 22.245
97 HH21 ARG 15 HH21 ARG 15 19.831 26.996 19.882
98 HH22 ARG 15 HH22 ARG 15 21.041 25.966 20.638
99 H SER 16 H SER 16 15.527 20.948 23.098
100 HA SER 16 HA SER 16 12.942 21.045 24.188
101 HB2 SER 16 HB2 SER 16 14.989 18.792 24.377
102 HB3 SER 16 HB3 SER 16 13.241 18.617 24.590
103 HG SER 16 HG SER 16 14.117 18.118 22.426
104 H LEU 17 H LEU 17 15.904 21.404 25.979
105 HA LEU 17 HA LEU 17 14.532 20.876 28.583
106 HB2 LEU 17 HB2 LEU 17 17.508 21.025 28.115
107 HB3 LEU 17 HB3 LEU 17 16.657 20.324 29.484
108 HG LEU 17 HG LEU 17 16.886 19.223 26.666
109 HD11 LEU 17 HD11 LEU 17 18.932 19.008 27.982
110 HD12 LEU 17 HD12 LEU 17 18.031 18.272 29.326
111 HD13 LEU 17 HD13 LEU 17 18.184 17.421 27.774
112 HD21 LEU 17 HD21 LEU 17 15.542 17.960 29.118
113 HD22 LEU 17 HD22 LEU 17 14.692 18.534 27.672
114 HD23 LEU 17 HD23 LEU 17 15.794 17.163 27.548
115 H GLY 18 H GLY 18 15.566 23.455 26.630
116 HA2 GLY 18 HA2 GLY 18 15.582 25.726 27.110
117 HA3 GLY 18 HA3 GLY 18 15.426 25.385 28.828
118 H LEU 19 H LEU 19 18.097 23.767 27.304
119 HA LEU 19 HA LEU 19 19.994 25.987 27.928
120 HB2 LEU 19 HB2 LEU 19 21.639 24.434 28.825
121 HB3 LEU 19 HB3 LEU 19 20.232 24.592 29.811
122 HG LEU 19 HG LEU 19 21.502 22.242 29.295
123 HD11 LEU 19 HD11 LEU 19 19.750 22.571 30.984
124 HD12 LEU 19 HD12 LEU 19 18.499 22.571 29.730
125 HD13 LEU 19 HD13 LEU 19 19.447 21.099 30.055
126 HD21 LEU 19 HD21 LEU 19 19.236 22.234 27.312
127 HD22 LEU 19 HD22 LEU 19 20.964 22.248 26.919
128 HD23 LEU 19 HD23 LEU 19 20.241 20.876 27.782
129 H LEU 20 H LEU 20 22.329 25.064 27.083
130 HA LEU 20 HA LEU 20 21.949 24.980 24.135
131 HB2 LEU 20 HB2 LEU 20 24.307 25.758 25.883
132 HB3 LEU 20 HB3 LEU 20 24.345 25.733 24.129
133 HG LEU 20 HG LEU 20 22.469 27.510 25.758
134 HD11 LEU 20 HD11 LEU 20 24.839 28.097 26.123
135 HD12 LEU 20 HD12 LEU 20 25.101 28.182 24.363
136 HD13 LEU 20 HD13 LEU 20 24.008 29.331 25.168
137 HD21 LEU 20 HD21 LEU 20 21.612 27.110 23.512
138 HD22 LEU 20 HD22 LEU 20 22.274 28.741 23.623
139 HD23 LEU 20 HD23 LEU 20 23.206 27.469 22.799
140 H GLY 21 H GLY 21 22.794 23.483 22.850
141 HA2 GLY 21 HA2 GLY 21 24.079 21.054 23.987
142 HA3 GLY 21 HA3 GLY 21 23.450 21.247 22.347
143 H LYS 22 H LYS 22 26.124 20.719 23.880
144 HA LYS 22 HA LYS 22 27.846 21.962 21.763
145 HB2 LYS 22 HB2 LYS 22 28.452 21.984 24.748
146 HB3 LYS 22 HB3 LYS 22 29.609 22.437 23.499
147 HG2 LYS 22 HG2 LYS 22 27.000 23.896 24.087
148 HG3 LYS 22 HG3 LYS 22 28.599 24.386 24.634
149 HD2 LYS 22 HD2 LYS 22 29.356 24.850 22.401
150 HD3 LYS 22 HD3 LYS 22 27.919 24.110 21.679
151 HE2 LYS 22 HE2 LYS 22 26.483 25.808 22.796
152 HE3 LYS 22 HE3 LYS 22 27.946 26.617 23.406
153 HZ1 LYS 22 HZ1 LYS 22 28.635 26.998 21.158
154 HZ2 LYS 22 HZ2 LYS 22 27.345 26.143 20.543
155 HZ3 LYS 22 HZ3 LYS 22 27.092 27.573 21.314
156 H CYS 23 H CYS 23 29.903 20.980 21.433
157 HA CYS 23 HA CYS 23 29.993 18.075 21.967
158 HB2 CYS 23 HB2 CYS 23 30.718 19.095 19.783
159 HB3 CYS 23 HB3 CYS 23 32.068 19.848 20.645
160 H ILE 24 H ILE 24 30.538 17.440 23.965
161 HA ILE 24 HA ILE 24 32.676 18.862 25.518
162 HB ILE 24 HB ILE 24 30.102 17.678 26.560
163 HG12 ILE 24 HG12 ILE 24 29.573 19.774 25.410
164 HG13 ILE 24 HG13 ILE 24 29.305 19.864 27.130
165 HG21 ILE 24 HG21 ILE 24 31.863 17.448 28.205
166 HG22 ILE 24 HG22 ILE 24 32.311 19.152 28.008
167 HG23 ILE 24 HG23 ILE 24 30.748 18.714 28.726
168 HD11 ILE 24 HD11 ILE 24 31.372 21.175 27.432
169 HD12 ILE 24 HD12 ILE 24 31.730 21.037 25.696
170 HD13 ILE 24 HD13 ILE 24 30.307 21.937 26.252
171 H GLY 25 H GLY 25 34.270 17.508 26.308
172 HA2 GLY 25 HA2 GLY 25 35.544 15.592 26.387
173 HA3 GLY 25 HA3 GLY 25 34.070 14.731 26.852
174 H GLU 26 H GLU 26 34.633 16.390 23.764
175 HA GLU 26 HA GLU 26 34.306 15.796 21.633
176 HB2 GLU 26 HB2 GLU 26 35.895 13.386 22.511
177 HB3 GLU 26 HB3 GLU 26 35.442 13.675 20.833
178 HG2 GLU 26 HG2 GLU 26 36.627 15.760 20.740
179 HG3 GLU 26 HG3 GLU 26 36.956 15.719 22.474
180 H GLU 27 H GLU 27 32.120 14.945 23.568
181 HA GLU 27 HA GLU 27 30.564 13.349 21.576
182 HB2 GLU 27 HB2 GLU 27 31.343 11.875 23.366
183 HB3 GLU 27 HB3 GLU 27 30.740 12.987 24.590
184 HG2 GLU 27 HG2 GLU 27 29.265 11.091 24.426
185 HG3 GLU 27 HG3 GLU 27 28.415 12.530 23.871
186 H CYS 28 H CYS 28 28.490 14.185 21.160
187 HA CYS 28 HA CYS 28 28.108 16.867 22.118
188 HB2 CYS 28 HB2 CYS 28 27.736 15.996 19.769
189 HB3 CYS 28 HB3 CYS 28 26.175 15.392 20.334
190 H LYS 29 H LYS 29 27.081 17.538 23.752
191 HA LYS 29 HA LYS 29 24.641 16.365 24.923
192 HB2 LYS 29 HB2 LYS 29 25.605 15.939 27.107
193 HB3 LYS 29 HB3 LYS 29 26.411 14.955 25.901
194 HG2 LYS 29 HG2 LYS 29 28.347 16.479 25.896
195 HG3 LYS 29 HG3 LYS 29 27.523 17.569 27.018
196 HD2 LYS 29 HD2 LYS 29 29.064 16.312 28.337
197 HD3 LYS 29 HD3 LYS 29 27.454 15.721 28.708
198 HE2 LYS 29 HE2 LYS 29 28.708 13.766 28.548
199 HE3 LYS 29 HE3 LYS 29 27.905 13.845 26.977
200 HZ1 LYS 29 HZ1 LYS 29 30.250 13.304 26.755
201 HZ2 LYS 29 HZ2 LYS 29 30.055 14.810 26.097
202 HZ3 LYS 29 HZ3 LYS 29 30.722 14.616 27.573
203 H CYS 30 H CYS 30 24.191 17.734 27.145
204 HA CYS 30 HA CYS 30 24.354 20.517 26.167
205 HB2 CYS 30 HB2 CYS 30 22.504 19.624 28.317
206 HB3 CYS 30 HB3 CYS 30 22.430 20.930 27.165
207 H VAL 31 H VAL 31 24.620 22.306 27.573
208 HA VAL 31 HA VAL 31 26.800 21.759 29.445
209 HB VAL 31 HB VAL 31 27.372 24.078 29.287
210 HG11 VAL 31 HG11 VAL 31 27.859 24.257 26.948
211 HG12 VAL 31 HG12 VAL 31 28.013 22.559 27.425
212 HG13 VAL 31 HG13 VAL 31 26.580 23.104 26.520
213 HG21 VAL 31 HG21 VAL 31 24.749 24.460 27.798
214 HG22 VAL 31 HG22 VAL 31 25.223 25.181 29.347
215 HG23 VAL 31 HG23 VAL 31 26.061 25.652 27.873
216 HA PRO 32 HA PRO 32 24.701 22.996 33.217
217 HB2 PRO 32 HB2 PRO 32 27.176 24.020 34.426
218 HB3 PRO 32 HB3 PRO 32 26.287 22.518 34.795
219 HG2 PRO 32 HG2 PRO 32 28.759 22.540 33.556
220 HG3 PRO 32 HG3 PRO 32 27.514 21.291 33.229
221 HD2 PRO 32 HD2 PRO 32 28.068 23.827 31.640
222 HD3 PRO 32 HD3 PRO 32 27.930 22.141 31.070
223 H TYR 33 H TYR 33 26.085 25.421 31.268
224 HA TYR 33 HA TYR 33 25.342 27.657 33.079
225 HB2 TYR 33 HB2 TYR 33 26.803 29.029 31.744
226 HB3 TYR 33 HB3 TYR 33 27.636 27.654 32.414
227 HD1 TYR 33 HD2 TYR 33 26.134 28.992 29.279
228 HD2 TYR 33 HD1 TYR 33 28.898 26.176 31.002
229 HE1 TYR 33 HE2 TYR 33 27.160 28.656 27.051
230 HE2 TYR 33 HE1 TYR 33 29.932 25.832 28.749
231 HH TYR 33 HH TYR 33 28.945 27.816 25.943
Start of MODEL 13
1 H1 GLY 1 H1 GLY 1 36.221 8.501 18.820
2 H2 GLY 1 H2 GLY 1 34.674 8.322 18.281
3 H3 GLY 1 H3 GLY 1 35.668 9.404 17.558
4 HA2 GLY 1 HA2 GLY 1 37.119 7.629 16.796
5 HA3 GLY 1 HA3 GLY 1 35.955 6.477 17.502
6 H SER 2 H SER 2 36.386 9.031 15.103
7 HA SER 2 HA SER 2 35.259 9.697 13.279
8 HB2 SER 2 HB2 SER 2 35.130 6.724 12.802
9 HB3 SER 2 HB3 SER 2 34.930 7.990 11.573
10 HG SER 2 HG SER 2 37.032 8.797 12.239
11 H ALA 3 H ALA 3 33.546 9.966 15.394
12 HA ALA 3 HA ALA 3 30.947 9.820 14.002
13 HB1 ALA 3 HB1 ALA 3 31.030 7.701 15.196
14 HB2 ALA 3 HB2 ALA 3 31.441 8.523 16.709
15 HB3 ALA 3 HB3 ALA 3 29.842 8.766 15.965
16 H PHE 4 H PHE 4 32.373 12.086 14.261
17 HA PHE 4 HA PHE 4 31.819 13.685 16.580
18 HB2 PHE 4 HB2 PHE 4 33.675 14.128 15.060
19 HB3 PHE 4 HB3 PHE 4 32.565 14.386 13.716
20 HD1 PHE 4 HD1 PHE 4 33.344 15.704 17.162
21 HD2 PHE 4 HD2 PHE 4 31.978 16.604 13.175
22 HE1 PHE 4 HE1 PHE 4 33.331 18.122 17.708
23 HE2 PHE 4 HE2 PHE 4 31.961 19.019 13.730
24 HZ PHE 4 HZ PHE 4 32.649 19.789 15.993
25 H CYS 5 H CYS 5 30.412 15.473 16.864
26 HA CYS 5 HA CYS 5 27.808 15.119 15.543
27 HB2 CYS 5 HB2 CYS 5 27.224 16.241 17.901
28 HB3 CYS 5 HB3 CYS 5 27.253 14.524 17.561
29 H ASN 6 H ASN 6 27.114 16.609 14.289
30 HA ASN 6 HA ASN 6 27.871 19.401 14.230
31 HB2 ASN 6 HB2 ASN 6 27.109 18.107 12.285
32 HB3 ASN 6 HB3 ASN 6 25.562 17.782 13.059
33 HD21 ASN 6 HD22 ASN 6 25.317 18.621 10.658
34 HD22 ASN 6 HD21 ASN 6 24.867 20.334 10.586
35 H LEU 7 H LEU 7 26.942 21.126 15.165
36 HA LEU 7 HA LEU 7 25.493 21.125 17.570
37 HB2 LEU 7 HB2 LEU 7 26.805 23.000 16.708
38 HB3 LEU 7 HB3 LEU 7 25.756 23.143 15.300
39 HG LEU 7 HG LEU 7 23.886 23.886 16.763
40 HD11 LEU 7 HD11 LEU 7 24.578 22.827 18.891
41 HD12 LEU 7 HD12 LEU 7 25.998 23.893 18.967
42 HD13 LEU 7 HD13 LEU 7 24.358 24.570 19.079
43 HD21 LEU 7 HD21 LEU 7 25.378 25.509 15.670
44 HD22 LEU 7 HD22 LEU 7 24.810 26.106 17.238
45 HD23 LEU 7 HD23 LEU 7 26.464 25.472 17.082
46 H ALA 8 H ALA 8 24.273 21.278 14.227
47 HA ALA 8 HA ALA 8 21.568 21.863 14.719
48 HB1 ALA 8 HB1 ALA 8 21.269 21.058 12.425
49 HB2 ALA 8 HB2 ALA 8 22.820 21.925 12.548
50 HB3 ALA 8 HB3 ALA 8 22.793 20.153 12.511
51 H ALA 9 H ALA 9 23.204 18.751 15.113
52 HA ALA 9 HA ALA 9 20.631 17.284 15.335
53 HB1 ALA 9 HB1 ALA 9 22.064 15.307 15.370
54 HB2 ALA 9 HB2 ALA 9 22.445 16.330 13.971
55 HB3 ALA 9 HB3 ALA 9 23.520 16.324 15.392
56 H CYS 10 H CYS 10 23.093 18.701 17.376
57 HA CYS 10 HA CYS 10 22.240 17.163 19.752
58 HB2 CYS 10 HB2 CYS 10 24.629 17.584 19.215
59 HB3 CYS 10 HB3 CYS 10 24.358 19.311 19.443
60 H GLU 11 H GLU 11 21.862 20.461 18.439
61 HA GLU 11 HA GLU 11 20.528 21.708 20.624
62 HB2 GLU 11 HB2 GLU 11 20.200 21.878 17.613
63 HB3 GLU 11 HB3 GLU 11 19.272 22.901 18.708
64 HG2 GLU 11 HG2 GLU 11 22.287 22.809 18.966
65 HG3 GLU 11 HG3 GLU 11 21.545 23.749 17.677
66 H LEU 12 H LEU 12 19.415 19.138 18.474
67 HA LEU 12 HA LEU 12 16.625 19.236 19.004
68 HB2 LEU 12 HB2 LEU 12 18.343 16.784 18.510
69 HB3 LEU 12 HB3 LEU 12 16.603 16.900 18.297
70 HG LEU 12 HG LEU 12 18.703 18.365 16.648
71 HD11 LEU 12 HD11 LEU 12 18.554 15.942 16.219
72 HD12 LEU 12 HD12 LEU 12 16.808 16.093 15.922
73 HD13 LEU 12 HD13 LEU 12 17.974 16.888 14.838
74 HD21 LEU 12 HD21 LEU 12 16.792 18.983 15.170
75 HD22 LEU 12 HD22 LEU 12 15.669 18.335 16.390
76 HD23 LEU 12 HD23 LEU 12 16.684 19.746 16.757
77 H SER 13 H SER 13 19.284 17.995 20.977
78 HA SER 13 HA SER 13 17.415 16.811 22.961
79 HB2 SER 13 HB2 SER 13 20.431 16.669 23.042
80 HB3 SER 13 HB3 SER 13 19.251 15.592 23.805
81 HG SER 13 HG SER 13 18.657 15.029 21.540
82 H CYS 14 H CYS 14 19.155 19.696 22.532
83 HA CYS 14 HA CYS 14 19.309 20.207 25.487
84 HB2 CYS 14 HB2 CYS 14 21.057 21.209 23.225
85 HB3 CYS 14 HB3 CYS 14 21.204 21.699 24.905
86 H ARG 15 H ARG 15 18.482 21.806 22.332
87 HA ARG 15 HA ARG 15 17.684 24.246 23.680
88 HB2 ARG 15 HB2 ARG 15 18.598 23.914 21.271
89 HB3 ARG 15 HB3 ARG 15 16.967 23.416 20.853
90 HG2 ARG 15 HG2 ARG 15 17.256 25.722 20.291
91 HG3 ARG 15 HG3 ARG 15 16.094 25.605 21.605
92 HD2 ARG 15 HD2 ARG 15 17.602 27.505 21.909
93 HD3 ARG 15 HD3 ARG 15 17.810 26.349 23.227
94 HE ARG 15 HE ARG 15 19.753 25.602 21.381
95 HH11 ARG 15 HH11 ARG 15 19.159 28.783 22.839
96 HH12 ARG 15 HH12 ARG 15 20.884 29.118 22.814
97 HH21 ARG 15 HH21 ARG 15 21.683 26.205 21.190
98 HH22 ARG 15 HH22 ARG 15 22.166 27.881 21.508
99 H SER 16 H SER 16 16.170 21.229 23.164
100 HA SER 16 HA SER 16 13.413 21.874 23.685
101 HB2 SER 16 HB2 SER 16 13.443 19.493 24.549
102 HB3 SER 16 HB3 SER 16 14.038 19.671 22.901
103 HG SER 16 HG SER 16 15.360 18.359 24.394
104 H LEU 17 H LEU 17 16.275 21.968 25.651
105 HA LEU 17 HA LEU 17 14.703 22.414 28.150
106 HB2 LEU 17 HB2 LEU 17 17.649 21.854 27.996
107 HB3 LEU 17 HB3 LEU 17 16.574 21.619 29.365
108 HG LEU 17 HG LEU 17 16.760 19.938 26.828
109 HD11 LEU 17 HD11 LEU 17 18.705 19.708 28.273
110 HD12 LEU 17 HD12 LEU 17 17.658 19.358 29.675
111 HD13 LEU 17 HD13 LEU 17 17.730 18.231 28.303
112 HD21 LEU 17 HD21 LEU 17 15.306 18.314 28.024
113 HD22 LEU 17 HD22 LEU 17 15.152 19.440 29.392
114 HD23 LEU 17 HD23 LEU 17 14.456 19.849 27.812
115 H GLY 18 H GLY 18 15.696 24.227 25.748
116 HA2 GLY 18 HA2 GLY 18 16.237 26.411 25.458
117 HA3 GLY 18 HA3 GLY 18 16.124 26.642 27.193
118 H LEU 19 H LEU 19 18.597 24.291 26.405
119 HA LEU 19 HA LEU 19 20.643 26.473 26.442
120 HB2 LEU 19 HB2 LEU 19 21.850 25.678 28.138
121 HB3 LEU 19 HB3 LEU 19 20.233 25.338 28.695
122 HG LEU 19 HG LEU 19 22.312 23.353 27.657
123 HD11 LEU 19 HD11 LEU 19 22.500 24.162 30.012
124 HD12 LEU 19 HD12 LEU 19 20.849 23.612 30.322
125 HD13 LEU 19 HD13 LEU 19 22.111 22.433 29.913
126 HD21 LEU 19 HD21 LEU 19 19.432 22.875 28.430
127 HD22 LEU 19 HD22 LEU 19 20.177 22.563 26.837
128 HD23 LEU 19 HD23 LEU 19 20.640 21.587 28.230
129 H LEU 20 H LEU 20 22.977 25.438 26.032
130 HA LEU 20 HA LEU 20 22.669 25.191 23.217
131 HB2 LEU 20 HB2 LEU 20 24.286 26.663 24.285
132 HB3 LEU 20 HB3 LEU 20 25.077 25.293 25.062
133 HG LEU 20 HG LEU 20 25.752 24.432 22.840
134 HD11 LEU 20 HD11 LEU 20 24.045 25.491 21.389
135 HD12 LEU 20 HD12 LEU 20 24.682 27.099 21.808
136 HD13 LEU 20 HD13 LEU 20 25.671 25.956 20.878
137 HD21 LEU 20 HD21 LEU 20 26.623 27.287 23.428
138 HD22 LEU 20 HD22 LEU 20 27.286 25.812 24.167
139 HD23 LEU 20 HD23 LEU 20 27.512 26.107 22.439
140 H GLY 21 H GLY 21 22.810 23.578 21.863
141 HA2 GLY 21 HA2 GLY 21 23.282 20.813 22.457
142 HA3 GLY 21 HA3 GLY 21 23.223 21.573 20.874
143 H LYS 22 H LYS 22 25.387 21.652 23.627
144 HA LYS 22 HA LYS 22 27.810 21.998 22.098
145 HB2 LYS 22 HB2 LYS 22 27.656 22.815 24.343
146 HB3 LYS 22 HB3 LYS 22 27.307 21.213 24.972
147 HG2 LYS 22 HG2 LYS 22 29.632 20.481 24.258
148 HG3 LYS 22 HG3 LYS 22 29.929 22.134 23.705
149 HD2 LYS 22 HD2 LYS 22 30.928 21.857 25.889
150 HD3 LYS 22 HD3 LYS 22 29.558 22.944 26.030
151 HE2 LYS 22 HE2 LYS 22 29.473 21.466 27.912
152 HE3 LYS 22 HE3 LYS 22 28.159 20.977 26.844
153 HZ1 LYS 22 HZ1 LYS 22 29.478 19.114 27.724
154 HZ2 LYS 22 HZ2 LYS 22 29.539 19.133 26.073
155 HZ3 LYS 22 HZ3 LYS 22 30.812 19.662 26.993
156 H CYS 23 H CYS 23 29.115 20.662 21.133
157 HA CYS 23 HA CYS 23 29.368 17.833 22.037
158 HB2 CYS 23 HB2 CYS 23 28.107 17.653 20.028
159 HB3 CYS 23 HB3 CYS 23 29.082 18.871 19.218
160 H ILE 24 H ILE 24 31.270 17.785 23.003
161 HA ILE 24 HA ILE 24 33.683 18.574 21.448
162 HB ILE 24 HB ILE 24 33.407 18.941 24.457
163 HG12 ILE 24 HG12 ILE 24 33.558 21.078 22.283
164 HG13 ILE 24 HG13 ILE 24 32.123 20.680 23.228
165 HG21 ILE 24 HG21 ILE 24 35.695 20.008 24.206
166 HG22 ILE 24 HG22 ILE 24 35.698 18.311 23.761
167 HG23 ILE 24 HG23 ILE 24 35.679 19.565 22.500
168 HD11 ILE 24 HD11 ILE 24 33.021 22.636 24.188
169 HD12 ILE 24 HD12 ILE 24 33.370 21.320 25.321
170 HD13 ILE 24 HD13 ILE 24 34.656 21.972 24.269
171 H GLY 25 H GLY 25 35.148 16.954 21.304
172 HA2 GLY 25 HA2 GLY 25 36.122 14.887 21.556
173 HA3 GLY 25 HA3 GLY 25 35.454 14.793 23.194
174 H GLU 26 H GLU 26 33.697 15.111 20.119
175 HA GLU 26 HA GLU 26 32.014 13.930 19.171
176 HB2 GLU 26 HB2 GLU 26 33.762 11.569 19.908
177 HB3 GLU 26 HB3 GLU 26 32.567 11.634 18.608
178 HG2 GLU 26 HG2 GLU 26 33.864 13.338 17.424
179 HG3 GLU 26 HG3 GLU 26 35.037 13.411 18.741
180 H GLU 27 H GLU 27 31.305 14.495 21.948
181 HA GLU 27 HA GLU 27 29.005 12.656 21.827
182 HB2 GLU 27 HB2 GLU 27 28.849 12.214 24.144
183 HB3 GLU 27 HB3 GLU 27 30.434 11.716 23.568
184 HG2 GLU 27 HG2 GLU 27 31.317 13.951 24.513
185 HG3 GLU 27 HG3 GLU 27 29.747 14.099 25.324
186 H CYS 28 H CYS 28 27.117 13.609 21.869
187 HA CYS 28 HA CYS 28 26.816 16.478 22.191
188 HB2 CYS 28 HB2 CYS 28 25.495 15.329 20.537
189 HB3 CYS 28 HB3 CYS 28 24.915 14.160 21.719
190 H LYS 29 H LYS 29 26.913 17.352 24.152
191 HA LYS 29 HA LYS 29 25.212 16.374 26.380
192 HB2 LYS 29 HB2 LYS 29 27.319 15.123 26.494
193 HB3 LYS 29 HB3 LYS 29 28.254 16.613 26.523
194 HG2 LYS 29 HG2 LYS 29 27.512 17.194 28.693
195 HG3 LYS 29 HG3 LYS 29 26.156 16.060 28.651
196 HD2 LYS 29 HD2 LYS 29 29.049 15.147 28.477
197 HD3 LYS 29 HD3 LYS 29 28.219 15.347 30.036
198 HE2 LYS 29 HE2 LYS 29 26.591 13.672 29.537
199 HE3 LYS 29 HE3 LYS 29 26.998 13.659 27.824
200 HZ1 LYS 29 HZ1 LYS 29 27.927 11.750 28.867
201 HZ2 LYS 29 HZ2 LYS 29 29.170 12.700 28.394
202 HZ3 LYS 29 HZ3 LYS 29 28.711 12.611 30.000
203 H CYS 30 H CYS 30 24.219 18.124 27.202
204 HA CYS 30 HA CYS 30 24.844 20.684 26.108
205 HB2 CYS 30 HB2 CYS 30 22.932 20.407 28.385
206 HB3 CYS 30 HB3 CYS 30 22.830 21.379 26.930
207 H VAL 31 H VAL 31 24.669 22.709 27.672
208 HA VAL 31 HA VAL 31 27.144 22.611 29.186
209 HB VAL 31 HB VAL 31 26.928 25.057 29.271
210 HG11 VAL 31 HG11 VAL 31 27.933 23.945 27.343
211 HG12 VAL 31 HG12 VAL 31 26.350 23.796 26.550
212 HG13 VAL 31 HG13 VAL 31 27.057 25.394 26.838
213 HG21 VAL 31 HG21 VAL 31 24.281 24.682 27.818
214 HG22 VAL 31 HG22 VAL 31 24.483 25.295 29.482
215 HG23 VAL 31 HG23 VAL 31 25.136 26.200 28.112
216 HA PRO 32 HA PRO 32 25.677 22.159 33.220
217 HB2 PRO 32 HB2 PRO 32 27.621 23.161 34.808
218 HB3 PRO 32 HB3 PRO 32 27.940 21.859 33.627
219 HG2 PRO 32 HG2 PRO 32 28.396 24.841 33.257
220 HG3 PRO 32 HG3 PRO 32 29.563 23.506 32.977
221 HD2 PRO 32 HD2 PRO 32 28.075 24.585 30.971
222 HD3 PRO 32 HD3 PRO 32 28.479 22.842 31.006
223 H TYR 33 H TYR 33 25.275 25.230 32.045
224 HA TYR 33 HA TYR 33 24.881 26.788 34.406
225 HB2 TYR 33 HB2 TYR 33 23.811 27.270 31.619
226 HB3 TYR 33 HB3 TYR 33 24.059 28.476 32.875
227 HD1 TYR 33 HD1 TYR 33 26.739 27.924 33.899
228 HD2 TYR 33 HD2 TYR 33 25.268 27.781 29.849
229 HE1 TYR 33 HE1 TYR 33 29.026 28.278 33.066
230 HE2 TYR 33 HE2 TYR 33 27.598 28.154 28.996
231 HH TYR 33 HH TYR 33 30.316 28.687 31.275
Start of MODEL 14
1 H1 GLY 1 H1 GLY 1 34.585 5.543 16.985
2 H2 GLY 1 H2 GLY 1 32.948 5.737 17.009
3 H3 GLY 1 H3 GLY 1 33.924 6.819 17.775
4 HA2 GLY 1 HA2 GLY 1 33.872 6.336 14.872
5 HA3 GLY 1 HA3 GLY 1 33.067 7.689 15.680
6 H SER 2 H SER 2 34.598 8.610 13.913
7 HA SER 2 HA SER 2 37.168 9.484 15.132
8 HB2 SER 2 HB2 SER 2 38.365 8.957 13.050
9 HB3 SER 2 HB3 SER 2 37.702 7.507 13.808
10 HG SER 2 HG SER 2 37.416 7.746 11.480
11 H ALA 3 H ALA 3 34.341 10.550 13.694
12 HA ALA 3 HA ALA 3 35.623 12.791 12.209
13 HB1 ALA 3 HB1 ALA 3 34.290 11.165 10.879
14 HB2 ALA 3 HB2 ALA 3 32.871 11.534 11.886
15 HB3 ALA 3 HB3 ALA 3 33.597 12.786 10.864
16 H PHE 4 H PHE 4 34.166 14.728 12.068
17 HA PHE 4 HA PHE 4 33.657 15.763 14.739
18 HB2 PHE 4 HB2 PHE 4 34.691 17.004 12.759
19 HB3 PHE 4 HB3 PHE 4 33.075 17.121 12.088
20 HD1 PHE 4 HD1 PHE 4 31.391 18.614 13.158
21 HD2 PHE 4 HD2 PHE 4 35.404 18.298 14.690
22 HE1 PHE 4 HE1 PHE 4 31.016 20.636 14.545
23 HE2 PHE 4 HE2 PHE 4 35.050 20.363 16.024
24 HZ PHE 4 HZ PHE 4 32.843 21.516 15.981
25 H CYS 5 H CYS 5 31.676 16.825 15.383
26 HA CYS 5 HA CYS 5 29.449 15.019 15.200
27 HB2 CYS 5 HB2 CYS 5 30.260 16.401 17.193
28 HB3 CYS 5 HB3 CYS 5 29.512 17.795 16.411
29 H ASN 6 H ASN 6 27.392 15.246 14.368
30 HA ASN 6 HA ASN 6 26.780 17.451 12.465
31 HB2 ASN 6 HB2 ASN 6 26.069 15.164 11.910
32 HB3 ASN 6 HB3 ASN 6 25.147 15.067 13.416
33 HD21 ASN 6 HD22 ASN 6 23.476 14.494 11.774
34 HD22 ASN 6 HD21 ASN 6 22.556 15.809 11.055
35 H LEU 7 H LEU 7 27.090 19.142 14.038
36 HA LEU 7 HA LEU 7 25.935 19.143 16.617
37 HB2 LEU 7 HB2 LEU 7 27.870 20.468 15.910
38 HB3 LEU 7 HB3 LEU 7 26.855 21.433 14.837
39 HG LEU 7 HG LEU 7 25.690 22.420 16.744
40 HD11 LEU 7 HD11 LEU 7 26.465 22.073 19.050
41 HD12 LEU 7 HD12 LEU 7 25.789 20.583 18.402
42 HD13 LEU 7 HD13 LEU 7 27.563 20.780 18.505
43 HD21 LEU 7 HD21 LEU 7 27.827 23.400 15.910
44 HD22 LEU 7 HD22 LEU 7 27.583 23.710 17.631
45 HD23 LEU 7 HD23 LEU 7 28.724 22.454 17.113
46 H ALA 8 H ALA 8 24.567 20.242 13.544
47 HA ALA 8 HA ALA 8 22.236 21.510 14.569
48 HB1 ALA 8 HB1 ALA 8 21.453 21.303 12.249
49 HB2 ALA 8 HB2 ALA 8 23.159 21.802 12.298
50 HB3 ALA 8 HB3 ALA 8 22.738 20.120 11.913
51 H ALA 9 H ALA 9 23.010 18.181 14.760
52 HA ALA 9 HA ALA 9 20.162 17.414 15.167
53 HB1 ALA 9 HB1 ALA 9 21.433 16.126 13.495
54 HB2 ALA 9 HB2 ALA 9 22.609 15.665 14.748
55 HB3 ALA 9 HB3 ALA 9 20.920 15.129 14.858
56 H CYS 10 H CYS 10 22.491 18.711 16.985
57 HA CYS 10 HA CYS 10 21.953 17.108 19.449
58 HB2 CYS 10 HB2 CYS 10 24.238 16.958 18.739
59 HB3 CYS 10 HB3 CYS 10 24.351 18.693 18.511
60 H GLU 11 H GLU 11 22.400 20.512 18.246
61 HA GLU 11 HA GLU 11 22.023 21.822 20.656
62 HB2 GLU 11 HB2 GLU 11 21.064 22.721 17.916
63 HB3 GLU 11 HB3 GLU 11 21.210 23.755 19.341
64 HG2 GLU 11 HG2 GLU 11 23.657 23.253 19.416
65 HG3 GLU 11 HG3 GLU 11 23.492 22.324 17.940
66 H LEU 12 H LEU 12 19.376 21.293 18.311
67 HA LEU 12 HA LEU 12 17.222 22.042 19.994
68 HB2 LEU 12 HB2 LEU 12 15.839 21.259 18.282
69 HB3 LEU 12 HB3 LEU 12 17.273 21.862 17.467
70 HG LEU 12 HG LEU 12 16.602 18.924 18.008
71 HD11 LEU 12 HD11 LEU 12 16.186 18.774 15.635
72 HD12 LEU 12 HD12 LEU 12 15.160 20.033 16.336
73 HD13 LEU 12 HD13 LEU 12 16.612 20.488 15.411
74 HD21 LEU 12 HD21 LEU 12 18.921 20.140 16.458
75 HD22 LEU 12 HD22 LEU 12 19.034 19.079 17.883
76 HD23 LEU 12 HD23 LEU 12 18.429 18.439 16.366
77 H SER 13 H SER 13 19.051 19.121 19.971
78 HA SER 13 HA SER 13 17.027 17.414 21.231
79 HB2 SER 13 HB2 SER 13 19.973 16.837 20.799
80 HB3 SER 13 HB3 SER 13 18.667 15.678 21.081
81 HG SER 13 HG SER 13 19.497 16.196 18.793
82 H CYS 14 H CYS 14 19.010 19.865 22.327
83 HA CYS 14 HA CYS 14 18.543 18.927 25.114
84 HB2 CYS 14 HB2 CYS 14 21.043 19.555 23.932
85 HB3 CYS 14 HB3 CYS 14 20.658 20.890 25.022
86 H ARG 15 H ARG 15 18.226 21.658 22.802
87 HA ARG 15 HA ARG 15 17.288 23.515 24.733
88 HB2 ARG 15 HB2 ARG 15 18.012 24.056 22.423
89 HB3 ARG 15 HB3 ARG 15 16.542 23.312 21.801
90 HG2 ARG 15 HG2 ARG 15 16.337 25.727 21.843
91 HG3 ARG 15 HG3 ARG 15 15.156 24.987 22.907
92 HD2 ARG 15 HD2 ARG 15 16.034 27.000 23.931
93 HD3 ARG 15 HD3 ARG 15 16.537 25.609 24.877
94 HE ARG 15 HE ARG 15 18.496 26.480 22.850
95 HH11 ARG 15 HH11 ARG 15 17.442 27.367 26.116
96 HH12 ARG 15 HH12 ARG 15 19.084 27.789 26.573
97 HH21 ARG 15 HH21 ARG 15 20.510 27.067 23.625
98 HH22 ARG 15 HH22 ARG 15 20.723 27.419 25.344
99 H SER 16 H SER 16 15.671 20.742 23.415
100 HA SER 16 HA SER 16 13.005 21.210 24.357
101 HB2 SER 16 HB2 SER 16 12.908 18.706 24.290
102 HB3 SER 16 HB3 SER 16 13.526 19.441 22.799
103 HG SER 16 HG SER 16 14.831 17.706 23.414
104 H LEU 17 H LEU 17 15.940 20.722 26.135
105 HA LEU 17 HA LEU 17 14.483 20.233 28.688
106 HB2 LEU 17 HB2 LEU 17 17.474 20.454 28.392
107 HB3 LEU 17 HB3 LEU 17 16.543 19.684 29.661
108 HG LEU 17 HG LEU 17 16.977 18.664 26.828
109 HD11 LEU 17 HD11 LEU 17 18.916 18.474 28.361
110 HD12 LEU 17 HD12 LEU 17 17.905 17.593 29.526
111 HD13 LEU 17 HD13 LEU 17 18.254 16.889 27.928
112 HD21 LEU 17 HD21 LEU 17 14.750 17.928 27.573
113 HD22 LEU 17 HD22 LEU 17 15.873 16.560 27.672
114 HD23 LEU 17 HD23 LEU 17 15.411 17.429 29.142
115 H GLY 18 H GLY 18 15.641 22.816 26.774
116 HA2 GLY 18 HA2 GLY 18 15.439 25.091 27.307
117 HA3 GLY 18 HA3 GLY 18 15.520 24.735 29.027
118 H LEU 19 H LEU 19 18.074 23.239 27.115
119 HA LEU 19 HA LEU 19 19.813 25.610 27.326
120 HB2 LEU 19 HB2 LEU 19 21.633 24.334 28.314
121 HB3 LEU 19 HB3 LEU 19 20.354 24.773 29.402
122 HG LEU 19 HG LEU 19 21.549 22.456 29.584
123 HD11 LEU 19 HD11 LEU 19 19.656 23.133 30.992
124 HD12 LEU 19 HD12 LEU 19 18.509 22.621 29.741
125 HD13 LEU 19 HD13 LEU 19 19.541 21.426 30.546
126 HD21 LEU 19 HD21 LEU 19 20.619 20.608 28.460
127 HD22 LEU 19 HD22 LEU 19 19.381 21.598 27.666
128 HD23 LEU 19 HD23 LEU 19 21.070 21.780 27.206
129 H LEU 20 H LEU 20 22.012 25.258 26.280
130 HA LEU 20 HA LEU 20 21.410 24.215 23.619
131 HB2 LEU 20 HB2 LEU 20 22.898 26.367 24.639
132 HB3 LEU 20 HB3 LEU 20 24.124 25.300 23.994
133 HG LEU 20 HG LEU 20 21.702 26.300 22.445
134 HD11 LEU 20 HD11 LEU 20 23.258 28.124 23.025
135 HD12 LEU 20 HD12 LEU 20 24.610 27.197 22.339
136 HD13 LEU 20 HD13 LEU 20 23.297 27.772 21.290
137 HD21 LEU 20 HD21 LEU 20 22.547 24.180 21.528
138 HD22 LEU 20 HD22 LEU 20 22.938 25.528 20.457
139 HD23 LEU 20 HD23 LEU 20 24.199 24.833 21.492
140 H GLY 21 H GLY 21 21.879 22.230 22.886
141 HA2 GLY 21 HA2 GLY 21 23.838 20.462 24.155
142 HA3 GLY 21 HA3 GLY 21 22.921 20.140 22.682
143 H LYS 22 H LYS 22 25.962 20.567 23.843
144 HA LYS 22 HA LYS 22 27.051 21.585 21.238
145 HB2 LYS 22 HB2 LYS 22 27.740 22.557 24.026
146 HB3 LYS 22 HB3 LYS 22 28.791 22.794 22.626
147 HG2 LYS 22 HG2 LYS 22 26.685 23.760 21.436
148 HG3 LYS 22 HG3 LYS 22 25.971 23.837 23.040
149 HD2 LYS 22 HD2 LYS 22 26.892 25.992 22.352
150 HD3 LYS 22 HD3 LYS 22 27.706 25.386 23.789
151 HE2 LYS 22 HE2 LYS 22 29.221 26.482 22.150
152 HE3 LYS 22 HE3 LYS 22 29.697 24.837 22.556
153 HZ1 LYS 22 HZ1 LYS 22 29.761 25.473 20.140
154 HZ2 LYS 22 HZ2 LYS 22 29.011 24.070 20.465
155 HZ3 LYS 22 HZ3 LYS 22 28.094 25.394 20.122
156 H CYS 23 H CYS 23 27.640 19.738 20.430
157 HA CYS 23 HA CYS 23 29.708 18.066 21.752
158 HB2 CYS 23 HB2 CYS 23 29.289 16.541 19.845
159 HB3 CYS 23 HB3 CYS 23 27.860 16.833 20.815
160 H ILE 24 H ILE 24 31.617 17.544 20.775
161 HA ILE 24 HA ILE 24 32.457 18.811 18.212
162 HB ILE 24 HB ILE 24 33.950 19.059 20.848
163 HG12 ILE 24 HG12 ILE 24 32.971 20.947 18.679
164 HG13 ILE 24 HG13 ILE 24 32.490 20.878 20.366
165 HG21 ILE 24 HG21 ILE 24 35.613 18.137 19.311
166 HG22 ILE 24 HG22 ILE 24 35.174 19.340 18.075
167 HG23 ILE 24 HG23 ILE 24 35.951 19.819 19.598
168 HD11 ILE 24 HD11 ILE 24 35.108 21.945 19.265
169 HD12 ILE 24 HD12 ILE 24 33.821 22.831 20.094
170 HD13 ILE 24 HD13 ILE 24 34.810 21.667 20.998
171 H GLY 25 H GLY 25 33.184 16.399 20.744
172 HA2 GLY 25 HA2 GLY 25 34.489 14.595 18.760
173 HA3 GLY 25 HA3 GLY 25 34.559 14.445 20.521
174 H GLU 26 H GLU 26 31.726 15.057 18.521
175 HA GLU 26 HA GLU 26 29.632 14.261 18.518
176 HB2 GLU 26 HB2 GLU 26 30.871 11.514 18.593
177 HB3 GLU 26 HB3 GLU 26 29.265 11.971 18.014
178 HG2 GLU 26 HG2 GLU 26 30.528 13.496 16.335
179 HG3 GLU 26 HG3 GLU 26 31.958 12.535 16.753
180 H GLU 27 H GLU 27 30.792 14.761 21.263
181 HA GLU 27 HA GLU 27 28.886 13.102 22.848
182 HB2 GLU 27 HB2 GLU 27 30.200 14.408 24.756
183 HB3 GLU 27 HB3 GLU 27 30.650 12.847 24.105
184 HG2 GLU 27 HG2 GLU 27 32.524 14.211 24.445
185 HG3 GLU 27 HG3 GLU 27 32.411 13.786 22.751
186 H CYS 28 H CYS 28 27.011 13.921 22.806
187 HA CYS 28 HA CYS 28 26.538 16.809 22.595
188 HB2 CYS 28 HB2 CYS 28 25.302 15.123 21.225
189 HB3 CYS 28 HB3 CYS 28 24.488 14.584 22.691
190 H LYS 29 H LYS 29 27.776 16.725 24.722
191 HA LYS 29 HA LYS 29 26.214 16.868 27.198
192 HB2 LYS 29 HB2 LYS 29 28.244 17.867 28.101
193 HB3 LYS 29 HB3 LYS 29 28.712 16.482 27.110
194 HG2 LYS 29 HG2 LYS 29 29.112 18.158 25.189
195 HG3 LYS 29 HG3 LYS 29 28.901 19.443 26.387
196 HD2 LYS 29 HD2 LYS 29 30.778 18.440 27.709
197 HD3 LYS 29 HD3 LYS 29 31.041 17.274 26.400
198 HE2 LYS 29 HE2 LYS 29 31.243 20.319 26.223
199 HE3 LYS 29 HE3 LYS 29 32.590 19.188 26.283
200 HZ1 LYS 29 HZ1 LYS 29 30.601 19.392 24.095
201 HZ2 LYS 29 HZ2 LYS 29 32.170 19.867 24.047
202 HZ3 LYS 29 HZ3 LYS 29 31.822 18.256 24.169
203 H CYS 30 H CYS 30 25.625 18.917 28.201
204 HA CYS 30 HA CYS 30 25.209 21.099 26.234
205 HB2 CYS 30 HB2 CYS 30 23.149 20.185 28.237
206 HB3 CYS 30 HB3 CYS 30 22.996 21.239 26.834
207 H VAL 31 H VAL 31 24.791 23.163 26.993
208 HA VAL 31 HA VAL 31 26.641 23.860 29.185
209 HB VAL 31 HB VAL 31 26.678 26.070 28.172
210 HG11 VAL 31 HG11 VAL 31 27.770 25.519 26.132
211 HG12 VAL 31 HG12 VAL 31 28.114 24.224 27.282
212 HG13 VAL 31 HG13 VAL 31 26.913 23.968 25.994
213 HG21 VAL 31 HG21 VAL 31 25.488 26.408 25.959
214 HG22 VAL 31 HG22 VAL 31 24.515 24.987 26.329
215 HG23 VAL 31 HG23 VAL 31 24.427 26.407 27.367
216 HA PRO 32 HA PRO 32 23.594 25.514 31.931
217 HB2 PRO 32 HB2 PRO 32 25.066 28.122 32.173
218 HB3 PRO 32 HB3 PRO 32 24.535 26.995 33.461
219 HG2 PRO 32 HG2 PRO 32 27.129 27.052 32.707
220 HG3 PRO 32 HG3 PRO 32 26.315 25.468 32.945
221 HD2 PRO 32 HD2 PRO 32 26.758 26.970 30.339
222 HD3 PRO 32 HD3 PRO 32 27.127 25.265 30.732
223 H TYR 33 H TYR 33 23.531 26.810 28.892
224 HA TYR 33 HA TYR 33 21.508 28.877 29.498
225 HB2 TYR 33 HB2 TYR 33 22.649 30.481 28.069
226 HB3 TYR 33 HB3 TYR 33 23.610 30.026 29.459
227 HD1 TYR 33 HD2 TYR 33 23.290 29.751 25.779
228 HD2 TYR 33 HD1 TYR 33 25.765 28.918 29.207
229 HE1 TYR 33 HE2 TYR 33 25.239 29.331 24.277
230 HE2 TYR 33 HE1 TYR 33 27.708 28.484 27.700
231 HH TYR 33 HH TYR 33 28.452 28.342 25.515
Start of MODEL 15
1 H1 GLY 1 H1 GLY 1 38.721 9.787 19.762
2 H2 GLY 1 H2 GLY 1 37.807 10.614 18.666
3 H3 GLY 1 H3 GLY 1 37.106 9.962 20.007
4 HA2 GLY 1 HA2 GLY 1 37.301 12.309 20.304
5 HA3 GLY 1 HA3 GLY 1 38.369 11.447 21.435
6 H SER 2 H SER 2 38.211 13.135 18.332
7 HA SER 2 HA SER 2 40.942 14.217 18.811
8 HB2 SER 2 HB2 SER 2 39.958 13.223 16.115
9 HB3 SER 2 HB3 SER 2 41.383 14.241 16.359
10 HG SER 2 HG SER 2 41.843 11.986 16.210
11 H ALA 3 H ALA 3 38.743 15.334 19.771
12 HA ALA 3 HA ALA 3 37.470 17.139 19.905
13 HB1 ALA 3 HB1 ALA 3 39.769 18.015 20.046
14 HB2 ALA 3 HB2 ALA 3 39.701 18.436 18.322
15 HB3 ALA 3 HB3 ALA 3 38.606 19.227 19.477
16 H PHE 4 H PHE 4 36.657 15.536 17.476
17 HA PHE 4 HA PHE 4 35.709 17.685 15.667
18 HB2 PHE 4 HB2 PHE 4 36.668 15.786 14.581
19 HB3 PHE 4 HB3 PHE 4 35.589 14.682 15.416
20 HD1 PHE 4 HD2 PHE 4 35.446 17.741 13.211
21 HD2 PHE 4 HD1 PHE 4 33.626 13.979 14.288
22 HE1 PHE 4 HE2 PHE 4 33.702 18.076 11.466
23 HE2 PHE 4 HE1 PHE 4 31.913 14.307 12.524
24 HZ PHE 4 HZ PHE 4 31.945 16.357 11.118
25 H CYS 5 H CYS 5 33.552 18.067 15.150
26 HA CYS 5 HA CYS 5 31.930 17.985 17.592
27 HB2 CYS 5 HB2 CYS 5 32.556 20.070 16.362
28 HB3 CYS 5 HB3 CYS 5 31.500 19.557 15.053
29 H ASN 6 H ASN 6 30.878 16.099 17.769
30 HA ASN 6 HA ASN 6 28.918 15.094 15.818
31 HB2 ASN 6 HB2 ASN 6 29.891 13.608 17.487
32 HB3 ASN 6 HB3 ASN 6 29.414 14.684 18.807
33 HD21 ASN 6 HD22 ASN 6 28.827 12.082 19.028
34 HD22 ASN 6 HD21 ASN 6 27.090 11.831 18.822
35 H LEU 7 H LEU 7 27.074 16.265 15.344
36 HA LEU 7 HA LEU 7 25.840 17.935 17.466
37 HB2 LEU 7 HB2 LEU 7 27.723 19.125 16.055
38 HB3 LEU 7 HB3 LEU 7 26.526 19.148 14.773
39 HG LEU 7 HG LEU 7 25.004 20.479 16.331
40 HD11 LEU 7 HD11 LEU 7 25.979 19.834 18.520
41 HD12 LEU 7 HD12 LEU 7 27.510 20.591 18.073
42 HD13 LEU 7 HD13 LEU 7 26.044 21.578 18.289
43 HD21 LEU 7 HD21 LEU 7 27.758 21.651 15.775
44 HD22 LEU 7 HD22 LEU 7 26.397 21.585 14.644
45 HD23 LEU 7 HD23 LEU 7 26.266 22.572 16.106
46 H ALA 8 H ALA 8 25.172 15.790 14.913
47 HA ALA 8 HA ALA 8 23.419 17.245 13.318
48 HB1 ALA 8 HB1 ALA 8 23.453 14.244 13.819
49 HB2 ALA 8 HB2 ALA 8 22.804 15.068 12.393
50 HB3 ALA 8 HB3 ALA 8 24.544 15.132 12.722
51 H ALA 9 H ALA 9 22.558 15.667 16.367
52 HA ALA 9 HA ALA 9 19.852 16.887 16.097
53 HB1 ALA 9 HB1 ALA 9 20.402 14.115 17.234
54 HB2 ALA 9 HB2 ALA 9 18.821 14.926 17.137
55 HB3 ALA 9 HB3 ALA 9 19.664 14.454 15.649
56 H CYS 10 H CYS 10 22.552 17.431 17.582
57 HA CYS 10 HA CYS 10 21.964 16.991 20.389
58 HB2 CYS 10 HB2 CYS 10 24.239 16.978 19.403
59 HB3 CYS 10 HB3 CYS 10 24.097 18.707 19.103
60 H GLU 11 H GLU 11 22.042 19.986 18.368
61 HA GLU 11 HA GLU 11 21.279 21.765 20.527
62 HB2 GLU 11 HB2 GLU 11 21.081 22.029 17.511
63 HB3 GLU 11 HB3 GLU 11 20.789 23.343 18.633
64 HG2 GLU 11 HG2 GLU 11 23.455 21.866 18.691
65 HG3 GLU 11 HG3 GLU 11 23.112 23.075 17.461
66 H LEU 12 H LEU 12 19.460 20.041 17.990
67 HA LEU 12 HA LEU 12 16.876 21.109 18.419
68 HB2 LEU 12 HB2 LEU 12 17.599 18.224 17.725
69 HB3 LEU 12 HB3 LEU 12 16.063 19.017 17.413
70 HG LEU 12 HG LEU 12 18.731 19.687 16.095
71 HD11 LEU 12 HD11 LEU 12 16.193 18.425 14.981
72 HD12 LEU 12 HD12 LEU 12 17.688 18.769 14.085
73 HD13 LEU 12 HD13 LEU 12 17.686 17.551 15.371
74 HD21 LEU 12 HD21 LEU 12 17.366 21.135 14.594
75 HD22 LEU 12 HD22 LEU 12 15.953 20.862 15.631
76 HD23 LEU 12 HD23 LEU 12 17.376 21.731 16.253
77 H SER 13 H SER 13 18.490 18.407 20.060
78 HA SER 13 HA SER 13 16.256 17.775 21.828
79 HB2 SER 13 HB2 SER 13 17.843 16.082 21.064
80 HB3 SER 13 HB3 SER 13 19.181 16.947 21.836
81 HG SER 13 HG SER 13 18.731 15.881 23.517
82 H CYS 14 H CYS 14 19.486 19.365 22.274
83 HA CYS 14 HA CYS 14 19.187 19.881 25.033
84 HB2 CYS 14 HB2 CYS 14 20.805 21.268 22.873
85 HB3 CYS 14 HB3 CYS 14 20.993 21.598 24.584
86 H ARG 15 H ARG 15 18.306 22.057 22.266
87 HA ARG 15 HA ARG 15 17.253 24.179 23.874
88 HB2 ARG 15 HB2 ARG 15 16.571 23.180 21.075
89 HB3 ARG 15 HB3 ARG 15 15.858 24.637 21.748
90 HG2 ARG 15 HG2 ARG 15 18.877 24.398 21.749
91 HG3 ARG 15 HG3 ARG 15 18.040 24.715 20.235
92 HD2 ARG 15 HD2 ARG 15 18.712 26.826 21.207
93 HD3 ARG 15 HD3 ARG 15 16.958 26.703 21.164
94 HE ARG 15 HE ARG 15 16.867 26.660 23.501
95 HH11 ARG 15 HH11 ARG 15 20.321 26.458 22.666
96 HH12 ARG 15 HH12 ARG 15 20.718 27.008 24.301
97 HH21 ARG 15 HH21 ARG 15 17.586 27.316 25.456
98 HH22 ARG 15 HH22 ARG 15 19.314 27.448 25.729
99 H SER 16 H SER 16 15.814 21.098 22.957
100 HA SER 16 HA SER 16 13.140 21.743 23.908
101 HB2 SER 16 HB2 SER 16 14.351 19.016 23.339
102 HB3 SER 16 HB3 SER 16 12.647 19.413 23.567
103 HG SER 16 HG SER 16 14.331 19.954 21.392
104 H LEU 17 H LEU 17 16.077 20.435 25.453
105 HA LEU 17 HA LEU 17 14.610 19.946 27.977
106 HB2 LEU 17 HB2 LEU 17 17.592 20.148 27.953
107 HB3 LEU 17 HB3 LEU 17 16.541 19.156 28.922
108 HG LEU 17 HG LEU 17 17.391 18.738 26.061
109 HD11 LEU 17 HD11 LEU 17 19.087 18.216 27.749
110 HD12 LEU 17 HD12 LEU 17 17.953 17.134 28.584
111 HD13 LEU 17 HD13 LEU 17 18.523 16.745 26.945
112 HD21 LEU 17 HD21 LEU 17 16.228 16.533 26.165
113 HD22 LEU 17 HD22 LEU 17 15.580 16.942 27.768
114 HD23 LEU 17 HD23 LEU 17 15.065 17.845 26.326
115 H GLY 18 H GLY 18 16.230 22.616 26.459
116 HA2 GLY 18 HA2 GLY 18 15.433 24.825 27.214
117 HA3 GLY 18 HA3 GLY 18 15.755 24.327 28.870
118 H LEU 19 H LEU 19 18.283 23.369 26.651
119 HA LEU 19 HA LEU 19 19.936 25.737 27.329
120 HB2 LEU 19 HB2 LEU 19 21.500 24.545 28.618
121 HB3 LEU 19 HB3 LEU 19 19.918 24.346 29.306
122 HG LEU 19 HG LEU 19 21.839 22.336 28.325
123 HD11 LEU 19 HD11 LEU 19 19.421 22.081 30.168
124 HD12 LEU 19 HD12 LEU 19 20.806 20.969 30.057
125 HD13 LEU 19 HD13 LEU 19 21.030 22.598 30.698
126 HD21 LEU 19 HD21 LEU 19 20.342 21.821 26.583
127 HD22 LEU 19 HD22 LEU 19 20.193 20.585 27.820
128 HD23 LEU 19 HD23 LEU 19 18.944 21.819 27.706
129 H LEU 20 H LEU 20 22.416 25.064 26.767
130 HA LEU 20 HA LEU 20 22.307 24.950 23.838
131 HB2 LEU 20 HB2 LEU 20 23.487 26.771 24.827
132 HB3 LEU 20 HB3 LEU 20 24.353 25.723 25.925
133 HG LEU 20 HG LEU 20 25.592 24.745 23.934
134 HD11 LEU 20 HD11 LEU 20 24.403 27.170 22.511
135 HD12 LEU 20 HD12 LEU 20 25.645 26.078 21.868
136 HD13 LEU 20 HD13 LEU 20 24.008 25.481 22.145
137 HD21 LEU 20 HD21 LEU 20 25.894 27.721 24.476
138 HD22 LEU 20 HD22 LEU 20 26.624 26.388 25.404
139 HD23 LEU 20 HD23 LEU 20 27.109 26.667 23.727
140 H GLY 21 H GLY 21 23.091 23.388 22.492
141 HA2 GLY 21 HA2 GLY 21 24.191 20.880 23.585
142 HA3 GLY 21 HA3 GLY 21 23.823 21.256 21.903
143 H LYS 22 H LYS 22 26.171 21.176 24.352
144 HA LYS 22 HA LYS 22 28.313 22.337 22.599
145 HB2 LYS 22 HB2 LYS 22 28.410 23.199 24.790
146 HB3 LYS 22 HB3 LYS 22 28.229 21.599 25.506
147 HG2 LYS 22 HG2 LYS 22 30.463 22.492 25.825
148 HG3 LYS 22 HG3 LYS 22 30.442 20.955 24.983
149 HD2 LYS 22 HD2 LYS 22 32.177 22.345 24.099
150 HD3 LYS 22 HD3 LYS 22 30.963 22.119 22.852
151 HE2 LYS 22 HE2 LYS 22 30.050 24.365 23.301
152 HE3 LYS 22 HE3 LYS 22 31.219 24.589 24.615
153 HZ1 LYS 22 HZ1 LYS 22 33.011 24.467 22.993
154 HZ2 LYS 22 HZ2 LYS 22 31.974 24.113 21.775
155 HZ3 LYS 22 HZ3 LYS 22 31.957 25.595 22.485
156 H CYS 23 H CYS 23 29.528 21.165 21.360
157 HA CYS 23 HA CYS 23 29.596 18.218 21.652
158 HB2 CYS 23 HB2 CYS 23 30.467 18.156 19.414
159 HB3 CYS 23 HB3 CYS 23 28.975 19.078 19.505
160 H ILE 24 H ILE 24 31.293 17.033 22.160
161 HA ILE 24 HA ILE 24 34.021 18.167 22.550
162 HB ILE 24 HB ILE 24 32.558 16.432 24.570
163 HG12 ILE 24 HG12 ILE 24 31.562 18.704 24.644
164 HG13 ILE 24 HG13 ILE 24 32.309 18.138 26.107
165 HG21 ILE 24 HG21 ILE 24 34.931 16.007 24.612
166 HG22 ILE 24 HG22 ILE 24 35.300 17.741 24.649
167 HG23 ILE 24 HG23 ILE 24 34.515 16.954 26.037
168 HD11 ILE 24 HD11 ILE 24 34.286 19.581 25.708
169 HD12 ILE 24 HD12 ILE 24 33.538 20.155 24.200
170 HD13 ILE 24 HD13 ILE 24 32.780 20.503 25.760
171 H GLY 25 H GLY 25 35.184 16.891 21.121
172 HA2 GLY 25 HA2 GLY 25 36.276 14.993 20.364
173 HA3 GLY 25 HA3 GLY 25 35.988 14.378 21.994
174 H GLU 26 H GLU 26 33.848 14.942 19.180
175 HA GLU 26 HA GLU 26 32.273 13.804 18.177
176 HB2 GLU 26 HB2 GLU 26 33.905 11.323 18.723
177 HB3 GLU 26 HB3 GLU 26 32.640 11.541 17.501
178 HG2 GLU 26 HG2 GLU 26 34.412 11.945 16.171
179 HG3 GLU 26 HG3 GLU 26 34.151 13.574 16.720
180 H GLU 27 H GLU 27 32.056 13.963 21.271
181 HA GLU 27 HA GLU 27 29.367 12.675 21.282
182 HB2 GLU 27 HB2 GLU 27 31.416 13.051 23.479
183 HB3 GLU 27 HB3 GLU 27 29.719 13.137 23.857
184 HG2 GLU 27 HG2 GLU 27 29.704 10.802 22.441
185 HG3 GLU 27 HG3 GLU 27 31.351 10.759 23.060
186 H CYS 28 H CYS 28 27.762 13.990 22.615
187 HA CYS 28 HA CYS 28 28.321 16.859 22.843
188 HB2 CYS 28 HB2 CYS 28 27.699 16.367 20.469
189 HB3 CYS 28 HB3 CYS 28 26.097 15.888 21.009
190 H LYS 29 H LYS 29 27.868 16.910 24.954
191 HA LYS 29 HA LYS 29 25.095 16.194 25.872
192 HB2 LYS 29 HB2 LYS 29 27.589 16.298 27.590
193 HB3 LYS 29 HB3 LYS 29 25.958 15.832 28.083
194 HG2 LYS 29 HG2 LYS 29 26.175 13.972 26.298
195 HG3 LYS 29 HG3 LYS 29 27.890 14.355 26.224
196 HD2 LYS 29 HD2 LYS 29 27.908 13.959 28.791
197 HD3 LYS 29 HD3 LYS 29 26.252 13.318 28.593
198 HE2 LYS 29 HE2 LYS 29 27.471 11.354 28.368
199 HE3 LYS 29 HE3 LYS 29 27.365 11.851 26.683
200 HZ1 LYS 29 HZ1 LYS 29 29.622 11.360 27.059
201 HZ2 LYS 29 HZ2 LYS 29 29.607 13.004 27.157
202 HZ3 LYS 29 HZ3 LYS 29 29.641 12.052 28.526
203 H CYS 30 H CYS 30 23.939 17.667 27.017
204 HA CYS 30 HA CYS 30 24.544 20.374 26.205
205 HB2 CYS 30 HB2 CYS 30 22.267 19.679 28.007
206 HB3 CYS 30 HB3 CYS 30 22.371 20.873 26.722
207 H VAL 31 H VAL 31 24.538 22.293 27.555
208 HA VAL 31 HA VAL 31 26.017 21.825 30.103
209 HB VAL 31 HB VAL 31 26.936 24.061 29.797
210 HG11 VAL 31 HG11 VAL 31 28.251 23.660 27.769
211 HG12 VAL 31 HG12 VAL 31 28.050 22.156 28.684
212 HG13 VAL 31 HG13 VAL 31 27.083 22.448 27.222
213 HG21 VAL 31 HG21 VAL 31 26.483 25.379 27.773
214 HG22 VAL 31 HG22 VAL 31 25.254 24.200 27.266
215 HG23 VAL 31 HG23 VAL 31 24.999 25.180 28.717
216 HA PRO 32 HA PRO 32 22.905 23.480 32.692
217 HB2 PRO 32 HB2 PRO 32 24.864 25.337 34.035
218 HB3 PRO 32 HB3 PRO 32 23.793 24.100 34.754
219 HG2 PRO 32 HG2 PRO 32 26.432 23.640 34.445
220 HG3 PRO 32 HG3 PRO 32 25.238 22.343 34.103
221 HD2 PRO 32 HD2 PRO 32 26.648 24.176 32.134
222 HD3 PRO 32 HD3 PRO 32 26.392 22.414 32.064
223 H TYR 33 H TYR 33 23.526 25.362 30.266
224 HA TYR 33 HA TYR 33 22.572 27.986 31.318
225 HB2 TYR 33 HB2 TYR 33 24.891 27.663 29.406
226 HB3 TYR 33 HB3 TYR 33 24.386 29.105 30.270
227 HD1 TYR 33 HD1 TYR 33 24.398 28.768 32.989
228 HD2 TYR 33 HD2 TYR 33 26.827 26.611 30.159
229 HE1 TYR 33 HE1 TYR 33 26.045 28.254 34.787
230 HE2 TYR 33 HE2 TYR 33 28.481 26.109 31.949
231 HH TYR 33 HH TYR 33 29.108 26.523 34.156
Start of MODEL 16
1 H1 GLY 1 H1 GLY 1 31.580 7.350 9.491
2 H2 GLY 1 H2 GLY 1 30.435 8.024 10.459
3 H3 GLY 1 H3 GLY 1 30.969 6.491 10.771
4 HA2 GLY 1 HA2 GLY 1 31.983 7.891 12.352
5 HA3 GLY 1 HA3 GLY 1 33.215 7.387 11.164
6 H SER 2 H SER 2 33.175 9.816 12.876
7 HA SER 2 HA SER 2 33.813 11.745 10.769
8 HB2 SER 2 HB2 SER 2 31.294 11.973 11.157
9 HB3 SER 2 HB3 SER 2 31.675 12.557 12.776
10 HG SER 2 HG SER 2 31.643 13.841 10.494
11 H ALA 3 H ALA 3 35.309 13.200 11.413
12 HA ALA 3 HA ALA 3 36.327 13.159 14.163
13 HB1 ALA 3 HB1 ALA 3 38.132 14.527 13.241
14 HB2 ALA 3 HB2 ALA 3 37.818 13.146 12.180
15 HB3 ALA 3 HB3 ALA 3 37.226 14.761 11.732
16 H PHE 4 H PHE 4 33.602 14.405 13.410
17 HA PHE 4 HA PHE 4 33.821 16.884 15.005
18 HB2 PHE 4 HB2 PHE 4 33.975 17.321 12.457
19 HB3 PHE 4 HB3 PHE 4 32.298 16.802 12.387
20 HD1 PHE 4 HD1 PHE 4 34.639 19.340 13.798
21 HD2 PHE 4 HD2 PHE 4 30.524 18.344 12.984
22 HE1 PHE 4 HE1 PHE 4 33.975 21.677 14.320
23 HE2 PHE 4 HE2 PHE 4 29.854 20.671 13.529
24 HZ PHE 4 HZ PHE 4 31.578 22.334 14.203
25 H CYS 5 H CYS 5 31.633 17.638 15.768
26 HA CYS 5 HA CYS 5 30.146 15.309 16.675
27 HB2 CYS 5 HB2 CYS 5 30.883 17.338 18.057
28 HB3 CYS 5 HB3 CYS 5 29.556 18.206 17.289
29 H ASN 6 H ASN 6 27.812 15.115 16.663
30 HA ASN 6 HA ASN 6 26.428 16.100 14.265
31 HB2 ASN 6 HB2 ASN 6 24.633 14.671 14.911
32 HB3 ASN 6 HB3 ASN 6 26.141 13.778 15.050
33 HD21 ASN 6 HD22 ASN 6 23.539 13.215 16.295
34 HD22 ASN 6 HD21 ASN 6 23.864 13.184 18.017
35 H LEU 7 H LEU 7 27.203 18.321 15.531
36 HA LEU 7 HA LEU 7 25.682 19.263 17.691
37 HB2 LEU 7 HB2 LEU 7 27.827 20.191 16.964
38 HB3 LEU 7 HB3 LEU 7 27.089 20.817 15.494
39 HG LEU 7 HG LEU 7 25.674 22.350 16.836
40 HD11 LEU 7 HD11 LEU 7 27.228 21.205 19.202
41 HD12 LEU 7 HD12 LEU 7 26.266 22.694 19.238
42 HD13 LEU 7 HD13 LEU 7 25.462 21.153 18.952
43 HD21 LEU 7 HD21 LEU 7 28.644 22.507 17.504
44 HD22 LEU 7 HD22 LEU 7 27.883 23.075 15.999
45 HD23 LEU 7 HD23 LEU 7 27.483 23.851 17.538
46 H ALA 8 H ALA 8 25.019 19.614 14.218
47 HA ALA 8 HA ALA 8 22.722 21.161 14.183
48 HB1 ALA 8 HB1 ALA 8 23.543 18.746 12.497
49 HB2 ALA 8 HB2 ALA 8 22.255 19.877 12.054
50 HB3 ALA 8 HB3 ALA 8 23.920 20.457 12.188
51 H ALA 9 H ALA 9 22.861 17.937 15.537
52 HA ALA 9 HA ALA 9 19.875 17.856 15.737
53 HB1 ALA 9 HB1 ALA 9 20.887 15.918 14.612
54 HB2 ALA 9 HB2 ALA 9 21.929 15.631 16.032
55 HB3 ALA 9 HB3 ALA 9 20.165 15.462 16.168
56 H CYS 10 H CYS 10 22.859 18.060 17.503
57 HA CYS 10 HA CYS 10 21.923 17.483 20.164
58 HB2 CYS 10 HB2 CYS 10 24.287 17.383 19.299
59 HB3 CYS 10 HB3 CYS 10 24.265 19.149 19.193
60 H GLU 11 H GLU 11 22.318 20.516 18.295
61 HA GLU 11 HA GLU 11 21.350 22.491 20.088
62 HB2 GLU 11 HB2 GLU 11 21.076 22.020 17.108
63 HB3 GLU 11 HB3 GLU 11 20.426 23.464 17.868
64 HG2 GLU 11 HG2 GLU 11 23.314 22.791 18.454
65 HG3 GLU 11 HG3 GLU 11 22.909 23.329 16.830
66 H LEU 12 H LEU 12 19.591 19.861 18.589
67 HA LEU 12 HA LEU 12 16.972 21.088 19.197
68 HB2 LEU 12 HB2 LEU 12 17.439 18.465 17.780
69 HB3 LEU 12 HB3 LEU 12 16.051 19.538 17.685
70 HG LEU 12 HG LEU 12 18.820 20.049 16.485
71 HD11 LEU 12 HD11 LEU 12 17.675 19.801 14.345
72 HD12 LEU 12 HD12 LEU 12 17.468 18.332 15.318
73 HD13 LEU 12 HD13 LEU 12 16.136 19.497 15.171
74 HD21 LEU 12 HD21 LEU 12 17.772 22.001 15.383
75 HD22 LEU 12 HD22 LEU 12 16.271 21.718 16.288
76 HD23 LEU 12 HD23 LEU 12 17.751 22.202 17.136
77 H SER 13 H SER 13 18.883 18.117 20.006
78 HA SER 13 HA SER 13 16.769 17.061 21.696
79 HB2 SER 13 HB2 SER 13 18.328 15.289 22.215
80 HB3 SER 13 HB3 SER 13 18.305 15.609 20.476
81 HG SER 13 HG SER 13 20.321 16.097 22.380
82 H CYS 14 H CYS 14 19.691 19.005 22.325
83 HA CYS 14 HA CYS 14 19.551 18.809 25.193
84 HB2 CYS 14 HB2 CYS 14 20.702 20.895 23.317
85 HB3 CYS 14 HB3 CYS 14 20.955 20.912 25.058
86 H ARG 15 H ARG 15 17.808 20.871 22.888
87 HA ARG 15 HA ARG 15 16.707 22.635 24.905
88 HB2 ARG 15 HB2 ARG 15 16.041 22.136 21.993
89 HB3 ARG 15 HB3 ARG 15 15.047 23.191 23.011
90 HG2 ARG 15 HG2 ARG 15 16.993 24.576 23.574
91 HG3 ARG 15 HG3 ARG 15 18.056 23.546 22.604
92 HD2 ARG 15 HD2 ARG 15 16.884 24.186 20.552
93 HD3 ARG 15 HD3 ARG 15 15.657 25.039 21.471
94 HE ARG 15 HE ARG 15 17.078 26.863 21.809
95 HH11 ARG 15 HH21 ARG 15 18.967 24.284 20.373
96 HH12 ARG 15 HH22 ARG 15 20.305 25.344 19.987
97 HH21 ARG 15 HH12 ARG 15 18.709 28.224 21.045
98 HH22 ARG 15 HH11 ARG 15 20.092 27.506 20.265
99 H SER 16 H SER 16 15.827 19.376 24.014
100 HA SER 16 HA SER 16 13.226 19.323 25.277
101 HB2 SER 16 HB2 SER 16 15.274 17.082 25.222
102 HB3 SER 16 HB3 SER 16 13.516 16.938 25.362
103 HG SER 16 HG SER 16 14.483 16.490 23.288
104 H LEU 17 H LEU 17 16.419 19.638 26.590
105 HA LEU 17 HA LEU 17 15.632 18.653 29.288
106 HB2 LEU 17 HB2 LEU 17 18.383 19.391 28.226
107 HB3 LEU 17 HB3 LEU 17 18.008 18.492 29.687
108 HG LEU 17 HG LEU 17 17.573 17.515 26.823
109 HD11 LEU 17 HD11 LEU 17 19.397 15.951 27.337
110 HD12 LEU 17 HD12 LEU 17 19.937 17.630 27.438
111 HD13 LEU 17 HD13 LEU 17 19.619 16.712 28.930
112 HD21 LEU 17 HD21 LEU 17 15.913 16.507 28.353
113 HD22 LEU 17 HD22 LEU 17 17.132 15.315 27.892
114 HD23 LEU 17 HD23 LEU 17 17.215 16.089 29.494
115 H GLY 18 H GLY 18 15.829 21.560 27.606
116 HA2 GLY 18 HA2 GLY 18 15.645 23.777 28.400
117 HA3 GLY 18 HA3 GLY 18 16.143 23.268 30.013
118 H LEU 19 H LEU 19 18.173 22.054 27.438
119 HA LEU 19 HA LEU 19 20.292 23.996 28.218
120 HB2 LEU 19 HB2 LEU 19 20.451 21.141 27.209
121 HB3 LEU 19 HB3 LEU 19 21.854 22.216 27.323
122 HG LEU 19 HG LEU 19 21.975 22.078 29.630
123 HD11 LEU 19 HD11 LEU 19 19.728 22.577 30.388
124 HD12 LEU 19 HD12 LEU 19 19.165 20.974 29.848
125 HD13 LEU 19 HD13 LEU 19 20.334 21.121 31.173
126 HD21 LEU 19 HD21 LEU 19 20.848 19.380 28.843
127 HD22 LEU 19 HD22 LEU 19 22.481 19.953 28.466
128 HD23 LEU 19 HD23 LEU 19 22.001 19.728 30.149
129 H LEU 20 H LEU 20 21.857 24.608 26.577
130 HA LEU 20 HA LEU 20 20.773 24.819 23.830
131 HB2 LEU 20 HB2 LEU 20 21.413 26.880 24.975
132 HB3 LEU 20 HB3 LEU 20 23.046 26.275 25.267
133 HG LEU 20 HG LEU 20 22.091 26.196 22.454
134 HD11 LEU 20 HD11 LEU 20 21.173 28.370 23.126
135 HD12 LEU 20 HD12 LEU 20 22.749 28.847 23.792
136 HD13 LEU 20 HD13 LEU 20 22.559 28.597 22.046
137 HD21 LEU 20 HD21 LEU 20 24.375 26.954 21.954
138 HD22 LEU 20 HD22 LEU 20 24.672 27.258 23.679
139 HD23 LEU 20 HD23 LEU 20 24.442 25.600 23.089
140 H GLY 21 H GLY 21 21.931 23.892 22.076
141 HA2 GLY 21 HA2 GLY 21 23.229 21.410 22.706
142 HA3 GLY 21 HA3 GLY 21 23.085 22.119 21.108
143 H LYS 22 H LYS 22 25.252 21.111 23.329
144 HA LYS 22 HA LYS 22 27.458 22.160 21.709
145 HB2 LYS 22 HB2 LYS 22 27.580 22.364 24.753
146 HB3 LYS 22 HB3 LYS 22 28.899 22.666 23.618
147 HG2 LYS 22 HG2 LYS 22 27.505 24.534 22.612
148 HG3 LYS 22 HG3 LYS 22 26.375 24.315 23.963
149 HD2 LYS 22 HD2 LYS 22 28.275 24.772 25.547
150 HD3 LYS 22 HD3 LYS 22 29.316 25.108 24.155
151 HE2 LYS 22 HE2 LYS 22 27.724 26.905 23.424
152 HE3 LYS 22 HE3 LYS 22 26.718 26.550 24.831
153 HZ1 LYS 22 HZ1 LYS 22 27.961 28.270 25.609
154 HZ2 LYS 22 HZ2 LYS 22 28.903 27.039 26.125
155 HZ3 LYS 22 HZ3 LYS 22 29.342 27.871 24.785
156 H CYS 23 H CYS 23 29.343 20.793 21.841
157 HA CYS 23 HA CYS 23 28.830 18.063 22.912
158 HB2 CYS 23 HB2 CYS 23 30.457 19.044 20.548
159 HB3 CYS 23 HB3 CYS 23 30.315 17.381 21.079
160 H ILE 24 H ILE 24 30.676 16.811 23.573
161 HA ILE 24 HA ILE 24 33.231 18.205 23.994
162 HB ILE 24 HB ILE 24 31.952 16.633 26.274
163 HG12 ILE 24 HG12 ILE 24 32.545 19.622 25.998
164 HG13 ILE 24 HG13 ILE 24 30.960 18.859 26.135
165 HG21 ILE 24 HG21 ILE 24 34.032 17.199 27.498
166 HG22 ILE 24 HG22 ILE 24 34.427 16.303 26.066
167 HG23 ILE 24 HG23 ILE 24 34.664 18.065 26.083
168 HD11 ILE 24 HD11 ILE 24 33.050 19.050 28.305
169 HD12 ILE 24 HD12 ILE 24 31.467 19.822 28.250
170 HD13 ILE 24 HD13 ILE 24 31.575 18.051 28.426
171 H GLY 25 H GLY 25 34.759 17.006 23.096
172 HA2 GLY 25 HA2 GLY 25 35.938 15.223 22.290
173 HA3 GLY 25 HA3 GLY 25 35.045 14.163 23.377
174 H GLU 26 H GLU 26 33.651 16.168 20.775
175 HA GLU 26 HA GLU 26 32.342 15.742 19.042
176 HB2 GLU 26 HB2 GLU 26 34.238 13.430 18.583
177 HB3 GLU 26 HB3 GLU 26 32.986 13.935 17.453
178 HG2 GLU 26 HG2 GLU 26 34.853 14.956 16.621
179 HG3 GLU 26 HG3 GLU 26 33.994 16.251 17.439
180 H GLU 27 H GLU 27 31.412 14.721 21.587
181 HA GLU 27 HA GLU 27 29.067 13.311 20.464
182 HB2 GLU 27 HB2 GLU 27 30.801 12.483 22.771
183 HB3 GLU 27 HB3 GLU 27 29.076 12.382 23.004
184 HG2 GLU 27 HG2 GLU 27 30.250 11.132 20.505
185 HG3 GLU 27 HG3 GLU 27 30.531 10.353 22.044
186 H CYS 28 H CYS 28 27.121 13.961 21.380
187 HA CYS 28 HA CYS 28 26.979 16.676 22.222
188 HB2 CYS 28 HB2 CYS 28 25.394 15.536 20.739
189 HB3 CYS 28 HB3 CYS 28 24.904 14.475 22.047
190 H LYS 29 H LYS 29 27.365 17.426 24.140
191 HA LYS 29 HA LYS 29 26.111 16.401 26.604
192 HB2 LYS 29 HB2 LYS 29 28.280 15.237 26.616
193 HB3 LYS 29 HB3 LYS 29 29.127 16.746 26.310
194 HG2 LYS 29 HG2 LYS 29 29.444 16.333 28.604
195 HG3 LYS 29 HG3 LYS 29 28.249 17.611 28.542
196 HD2 LYS 29 HD2 LYS 29 27.493 16.142 30.229
197 HD3 LYS 29 HD3 LYS 29 26.462 15.751 28.840
198 HE2 LYS 29 HE2 LYS 29 28.080 13.892 28.274
199 HE3 LYS 29 HE3 LYS 29 28.974 14.265 29.744
200 HZ1 LYS 29 HZ1 LYS 29 27.424 12.424 30.007
201 HZ2 LYS 29 HZ2 LYS 29 26.997 13.636 31.035
202 HZ3 LYS 29 HZ3 LYS 29 26.136 13.361 29.674
203 H CYS 30 H CYS 30 25.076 18.155 27.300
204 HA CYS 30 HA CYS 30 26.096 20.821 26.392
205 HB2 CYS 30 HB2 CYS 30 23.631 21.184 25.835
206 HB3 CYS 30 HB3 CYS 30 24.630 20.168 24.822
207 H VAL 31 H VAL 31 24.391 22.591 27.037
208 HA VAL 31 HA VAL 31 25.132 22.938 29.894
209 HB VAL 31 HB VAL 31 26.000 25.100 29.221
210 HG11 VAL 31 HG11 VAL 31 27.446 23.066 28.821
211 HG12 VAL 31 HG12 VAL 31 26.979 23.147 27.112
212 HG13 VAL 31 HG13 VAL 31 27.853 24.495 27.867
213 HG21 VAL 31 HG21 VAL 31 24.580 24.470 26.625
214 HG22 VAL 31 HG22 VAL 31 24.549 25.937 27.604
215 HG23 VAL 31 HG23 VAL 31 25.989 25.588 26.641
216 HA PRO 32 HA PRO 32 21.203 25.152 30.420
217 HB2 PRO 32 HB2 PRO 32 21.645 26.573 32.678
218 HB3 PRO 32 HB3 PRO 32 21.529 24.787 32.696
219 HG2 PRO 32 HG2 PRO 32 24.036 26.489 32.625
220 HG3 PRO 32 HG3 PRO 32 23.673 25.110 33.709
221 HD2 PRO 32 HD2 PRO 32 25.141 24.870 31.362
222 HD3 PRO 32 HD3 PRO 32 24.120 23.539 32.016
223 H TYR 33 H TYR 33 20.349 27.229 30.175
224 HA TYR 33 HA TYR 33 22.098 29.527 29.529
225 HB2 TYR 33 HB2 TYR 33 20.932 30.048 27.506
226 HB3 TYR 33 HB3 TYR 33 21.612 28.440 27.369
227 HD1 TYR 33 HD1 TYR 33 18.512 30.418 27.602
228 HD2 TYR 33 HD2 TYR 33 20.146 26.467 27.202
229 HE1 TYR 33 HE1 TYR 33 16.263 29.560 26.963
230 HE2 TYR 33 HE2 TYR 33 17.897 25.606 26.500
231 HH TYR 33 HH TYR 33 15.653 26.118 26.192
Start of MODEL 17
1 H1 GLY 1 H1 GLY 1 32.097 8.918 20.064
2 H2 GLY 1 H2 GLY 1 31.782 9.742 21.456
3 H3 GLY 1 H3 GLY 1 30.536 9.263 20.513
4 HA2 GLY 1 HA2 GLY 1 32.377 7.496 21.988
5 HA3 GLY 1 HA3 GLY 1 30.703 7.856 22.439
6 H SER 2 H SER 2 28.993 7.105 21.069
7 HA SER 2 HA SER 2 29.542 4.572 19.607
8 HB2 SER 2 HB2 SER 2 27.071 4.340 19.702
9 HB3 SER 2 HB3 SER 2 27.797 4.508 21.302
10 HG SER 2 HG SER 2 26.881 6.427 21.557
11 H ALA 3 H ALA 3 28.766 7.888 18.992
12 HA ALA 3 HA ALA 3 29.215 7.610 16.151
13 HB1 ALA 3 HB1 ALA 3 26.801 7.126 16.194
14 HB2 ALA 3 HB2 ALA 3 26.508 8.565 17.190
15 HB3 ALA 3 HB3 ALA 3 27.070 8.735 15.507
16 H PHE 4 H PHE 4 28.834 10.079 15.221
17 HA PHE 4 HA PHE 4 30.492 11.781 17.004
18 HB2 PHE 4 HB2 PHE 4 29.862 12.048 14.048
19 HB3 PHE 4 HB3 PHE 4 31.028 12.992 14.955
20 HD1 PHE 4 HD2 PHE 4 32.949 11.674 16.169
21 HD2 PHE 4 HD1 PHE 4 30.613 10.106 12.902
22 HE1 PHE 4 HE2 PHE 4 34.769 10.059 15.635
23 HE2 PHE 4 HE1 PHE 4 32.432 8.495 12.383
24 HZ PHE 4 HZ PHE 4 34.507 8.474 13.744
25 H CYS 5 H CYS 5 30.150 14.243 16.640
26 HA CYS 5 HA CYS 5 27.302 14.882 17.213
27 HB2 CYS 5 HB2 CYS 5 29.001 15.576 18.831
28 HB3 CYS 5 HB3 CYS 5 29.840 16.490 17.571
29 H ASN 6 H ASN 6 26.044 16.025 15.864
30 HA ASN 6 HA ASN 6 27.269 17.904 13.887
31 HB2 ASN 6 HB2 ASN 6 26.194 16.042 12.656
32 HB3 ASN 6 HB3 ASN 6 24.718 16.249 13.598
33 HD21 ASN 6 HD22 ASN 6 26.622 17.522 10.924
34 HD22 ASN 6 HD21 ASN 6 25.437 18.759 10.477
35 H LEU 7 H LEU 7 26.641 20.039 14.292
36 HA LEU 7 HA LEU 7 25.435 20.596 16.801
37 HB2 LEU 7 HB2 LEU 7 27.102 22.029 15.641
38 HB3 LEU 7 HB3 LEU 7 25.902 22.424 14.411
39 HG LEU 7 HG LEU 7 24.488 23.513 16.172
40 HD11 LEU 7 HD11 LEU 7 25.325 22.360 18.194
41 HD12 LEU 7 HD12 LEU 7 26.938 23.064 17.935
42 HD13 LEU 7 HD13 LEU 7 25.554 24.107 18.321
43 HD21 LEU 7 HD21 LEU 7 25.906 25.508 16.384
44 HD22 LEU 7 HD22 LEU 7 27.337 24.556 15.934
45 HD23 LEU 7 HD23 LEU 7 26.028 24.819 14.757
46 H ALA 8 H ALA 8 24.089 20.874 13.513
47 HA ALA 8 HA ALA 8 21.480 21.774 14.276
48 HB1 ALA 8 HB1 ALA 8 22.509 22.171 12.090
49 HB2 ALA 8 HB2 ALA 8 22.515 20.431 11.748
50 HB3 ALA 8 HB3 ALA 8 20.975 21.299 11.899
51 H ALA 9 H ALA 9 22.774 18.742 14.887
52 HA ALA 9 HA ALA 9 20.040 17.527 15.126
53 HB1 ALA 9 HB1 ALA 9 21.572 16.268 13.643
54 HB2 ALA 9 HB2 ALA 9 22.753 16.156 14.967
55 HB3 ALA 9 HB3 ALA 9 21.180 15.359 15.116
56 H CYS 10 H CYS 10 23.102 18.199 16.819
57 HA CYS 10 HA CYS 10 22.307 16.884 19.266
58 HB2 CYS 10 HB2 CYS 10 24.616 16.992 18.506
59 HB3 CYS 10 HB3 CYS 10 24.615 18.749 18.659
60 H GLU 11 H GLU 11 22.246 20.292 18.190
61 HA GLU 11 HA GLU 11 21.525 21.627 20.563
62 HB2 GLU 11 HB2 GLU 11 20.744 21.881 17.647
63 HB3 GLU 11 HB3 GLU 11 19.941 22.885 18.831
64 HG2 GLU 11 HG2 GLU 11 22.974 22.768 18.673
65 HG3 GLU 11 HG3 GLU 11 22.021 23.851 17.652
66 H LEU 12 H LEU 12 19.482 19.535 18.534
67 HA LEU 12 HA LEU 12 16.952 20.173 19.663
68 HB2 LEU 12 HB2 LEU 12 17.779 17.499 18.478
69 HB3 LEU 12 HB3 LEU 12 16.180 18.242 18.465
70 HG LEU 12 HG LEU 12 18.619 19.188 16.874
71 HD11 LEU 12 HD11 LEU 12 16.022 17.888 15.994
72 HD12 LEU 12 HD12 LEU 12 17.329 18.456 14.931
73 HD13 LEU 12 HD13 LEU 12 17.620 17.104 16.046
74 HD21 LEU 12 HD21 LEU 12 17.192 21.117 17.477
75 HD22 LEU 12 HD22 LEU 12 17.066 20.735 15.759
76 HD23 LEU 12 HD23 LEU 12 15.766 20.247 16.871
77 H SER 13 H SER 13 19.410 17.827 20.630
78 HA SER 13 HA SER 13 17.763 16.525 22.669
79 HB2 SER 13 HB2 SER 13 20.709 16.314 21.969
80 HB3 SER 13 HB3 SER 13 19.885 15.342 23.201
81 HG SER 13 HG SER 13 19.901 14.997 20.511
82 H CYS 14 H CYS 14 19.426 19.479 22.596
83 HA CYS 14 HA CYS 14 19.512 19.641 25.585
84 HB2 CYS 14 HB2 CYS 14 20.911 21.238 23.421
85 HB3 CYS 14 HB3 CYS 14 21.010 21.590 25.142
86 H ARG 15 H ARG 15 18.151 21.196 22.670
87 HA ARG 15 HA ARG 15 16.636 23.308 23.743
88 HB2 ARG 15 HB2 ARG 15 16.933 22.442 21.294
89 HB3 ARG 15 HB3 ARG 15 15.688 21.273 21.666
90 HG2 ARG 15 HG2 ARG 15 14.530 22.992 20.595
91 HG3 ARG 15 HG3 ARG 15 14.191 23.275 22.303
92 HD2 ARG 15 HD2 ARG 15 14.672 25.395 21.311
93 HD3 ARG 15 HD3 ARG 15 16.059 24.992 22.313
94 HE ARG 15 HE ARG 15 15.892 25.011 19.334
95 HH11 ARG 15 HH11 ARG 15 18.141 24.928 22.091
96 HH12 ARG 15 HH12 ARG 15 19.491 24.975 20.947
97 HH21 ARG 15 HH21 ARG 15 17.793 24.947 18.087
98 HH22 ARG 15 HH22 ARG 15 19.300 25.019 18.981
99 H SER 16 H SER 16 15.890 19.873 23.620
100 HA SER 16 HA SER 16 13.354 19.955 24.935
101 HB2 SER 16 HB2 SER 16 13.926 17.430 25.251
102 HB3 SER 16 HB3 SER 16 13.670 18.081 23.629
103 HG SER 16 HG SER 16 15.770 17.952 23.175
104 H LEU 17 H LEU 17 16.374 20.535 26.338
105 HA LEU 17 HA LEU 17 15.340 19.968 29.091
106 HB2 LEU 17 HB2 LEU 17 18.182 20.668 28.356
107 HB3 LEU 17 HB3 LEU 17 17.589 19.947 29.848
108 HG LEU 17 HG LEU 17 17.824 18.648 27.115
109 HD11 LEU 17 HD11 LEU 17 19.324 18.113 29.706
110 HD12 LEU 17 HD12 LEU 17 19.562 17.280 28.152
111 HD13 LEU 17 HD13 LEU 17 19.955 19.000 28.303
112 HD21 LEU 17 HD21 LEU 17 15.894 17.643 28.331
113 HD22 LEU 17 HD22 LEU 17 17.247 16.508 28.298
114 HD23 LEU 17 HD23 LEU 17 16.905 17.432 29.775
115 H GLY 18 H GLY 18 16.453 22.457 26.868
116 HA2 GLY 18 HA2 GLY 18 15.530 24.681 27.083
117 HA3 GLY 18 HA3 GLY 18 15.705 24.596 28.832
118 H LEU 19 H LEU 19 18.483 23.386 27.113
119 HA LEU 19 HA LEU 19 19.806 26.059 27.123
120 HB2 LEU 19 HB2 LEU 19 21.572 25.481 28.460
121 HB3 LEU 19 HB3 LEU 19 20.174 24.858 29.306
122 HG LEU 19 HG LEU 19 22.347 23.333 27.838
123 HD11 LEU 19 HD11 LEU 19 22.709 24.066 30.185
124 HD12 LEU 19 HD12 LEU 19 21.259 23.170 30.674
125 HD13 LEU 19 HD13 LEU 19 22.664 22.297 30.031
126 HD21 LEU 19 HD21 LEU 19 20.351 22.117 27.220
127 HD22 LEU 19 HD22 LEU 19 21.160 21.234 28.512
128 HD23 LEU 19 HD23 LEU 19 19.737 22.212 28.900
129 H LEU 20 H LEU 20 22.348 25.476 26.264
130 HA LEU 20 HA LEU 20 21.656 24.664 23.478
131 HB2 LEU 20 HB2 LEU 20 23.983 26.317 24.486
132 HB3 LEU 20 HB3 LEU 20 23.666 25.901 22.817
133 HG LEU 20 HG LEU 20 21.987 27.715 24.594
134 HD11 LEU 20 HD11 LEU 20 24.035 28.683 23.525
135 HD12 LEU 20 HD12 LEU 20 23.415 28.213 21.935
136 HD13 LEU 20 HD13 LEU 20 22.545 29.409 22.925
137 HD21 LEU 20 HD21 LEU 20 20.403 26.469 23.210
138 HD22 LEU 20 HD22 LEU 20 20.566 28.100 22.579
139 HD23 LEU 20 HD23 LEU 20 21.391 26.756 21.756
140 H GLY 21 H GLY 21 23.016 23.473 22.161
141 HA2 GLY 21 HA2 GLY 21 24.154 21.125 23.570
142 HA3 GLY 21 HA3 GLY 21 23.693 21.211 21.875
143 H LYS 22 H LYS 22 26.047 22.094 24.263
144 HA LYS 22 HA LYS 22 28.159 22.432 22.139
145 HB2 LYS 22 HB2 LYS 22 28.193 23.268 25.039
146 HB3 LYS 22 HB3 LYS 22 29.620 23.279 24.002
147 HG2 LYS 22 HG2 LYS 22 27.059 24.809 23.399
148 HG3 LYS 22 HG3 LYS 22 28.505 25.500 24.147
149 HD2 LYS 22 HD2 LYS 22 29.798 24.781 22.068
150 HD3 LYS 22 HD3 LYS 22 28.248 24.414 21.309
151 HE2 LYS 22 HE2 LYS 22 29.175 27.128 22.328
152 HE3 LYS 22 HE3 LYS 22 29.068 26.610 20.643
153 HZ1 LYS 22 HZ1 LYS 22 26.832 27.096 22.511
154 HZ2 LYS 22 HZ2 LYS 22 27.143 27.851 21.086
155 HZ3 LYS 22 HZ3 LYS 22 26.611 26.288 21.090
156 H CYS 23 H CYS 23 28.315 20.479 21.504
157 HA CYS 23 HA CYS 23 28.880 18.213 23.234
158 HB2 CYS 23 HB2 CYS 23 29.104 16.985 21.110
159 HB3 CYS 23 HB3 CYS 23 27.604 17.901 21.251
160 H ILE 24 H ILE 24 30.748 17.259 23.731
161 HA ILE 24 HA ILE 24 33.342 18.373 22.786
162 HB ILE 24 HB ILE 24 32.525 18.168 25.717
163 HG12 ILE 24 HG12 ILE 24 33.151 20.628 24.027
164 HG13 ILE 24 HG13 ILE 24 31.561 20.165 24.626
165 HG21 ILE 24 HG21 ILE 24 35.173 19.075 24.503
166 HG22 ILE 24 HG22 ILE 24 34.771 19.058 26.231
167 HG23 ILE 24 HG23 ILE 24 34.913 17.547 25.376
168 HD11 ILE 24 HD11 ILE 24 33.900 21.131 26.296
169 HD12 ILE 24 HD12 ILE 24 32.335 21.904 26.027
170 HD13 ILE 24 HD13 ILE 24 32.419 20.412 26.980
171 H GLY 25 H GLY 25 34.938 16.859 22.688
172 HA2 GLY 25 HA2 GLY 25 35.983 14.809 22.723
173 HA3 GLY 25 HA3 GLY 25 35.071 14.412 24.188
174 H GLU 26 H GLU 26 33.897 15.134 20.886
175 HA GLU 26 HA GLU 26 32.426 14.131 19.536
176 HB2 GLU 26 HB2 GLU 26 33.992 11.629 20.186
177 HB3 GLU 26 HB3 GLU 26 32.963 11.892 18.768
178 HG2 GLU 26 HG2 GLU 26 34.448 13.833 18.134
179 HG3 GLU 26 HG3 GLU 26 35.555 13.349 19.433
180 H GLU 27 H GLU 27 31.386 14.405 22.202
181 HA GLU 27 HA GLU 27 29.261 12.311 22.077
182 HB2 GLU 27 HB2 GLU 27 31.055 12.168 24.018
183 HB3 GLU 27 HB3 GLU 27 30.149 13.513 24.696
184 HG2 GLU 27 HG2 GLU 27 29.287 11.501 25.665
185 HG3 GLU 27 HG3 GLU 27 28.055 12.102 24.551
186 H CYS 28 H CYS 28 27.186 13.103 22.035
187 HA CYS 28 HA CYS 28 26.843 15.997 21.945
188 HB2 CYS 28 HB2 CYS 28 25.634 14.657 20.351
189 HB3 CYS 28 HB3 CYS 28 24.861 13.738 21.641
190 H LYS 29 H LYS 29 26.801 17.125 23.666
191 HA LYS 29 HA LYS 29 24.944 16.670 25.864
192 HB2 LYS 29 HB2 LYS 29 26.643 16.865 27.634
193 HB3 LYS 29 HB3 LYS 29 26.815 15.399 26.689
194 HG2 LYS 29 HG2 LYS 29 28.731 16.422 25.449
195 HG3 LYS 29 HG3 LYS 29 28.586 17.869 26.483
196 HD2 LYS 29 HD2 LYS 29 29.028 16.527 28.491
197 HD3 LYS 29 HD3 LYS 29 28.985 15.035 27.541
198 HE2 LYS 29 HE2 LYS 29 30.953 15.825 26.225
199 HE3 LYS 29 HE3 LYS 29 31.037 17.262 27.269
200 HZ1 LYS 29 HZ1 LYS 29 32.525 15.433 27.958
201 HZ2 LYS 29 HZ2 LYS 29 31.510 15.869 29.141
202 HZ3 LYS 29 HZ3 LYS 29 31.225 14.472 28.292
203 H CYS 30 H CYS 30 25.099 18.551 27.461
204 HA CYS 30 HA CYS 30 24.956 20.959 25.760
205 HB2 CYS 30 HB2 CYS 30 23.464 20.470 28.322
206 HB3 CYS 30 HB3 CYS 30 23.053 21.512 26.963
207 H VAL 31 H VAL 31 24.807 23.035 27.305
208 HA VAL 31 HA VAL 31 27.494 23.285 28.340
209 HB VAL 31 HB VAL 31 26.959 25.629 28.710
210 HG11 VAL 31 HG11 VAL 31 26.495 26.188 26.363
211 HG12 VAL 31 HG12 VAL 31 27.661 24.867 26.522
212 HG13 VAL 31 HG13 VAL 31 25.984 24.515 26.053
213 HG21 VAL 31 HG21 VAL 31 24.782 26.548 28.050
214 HG22 VAL 31 HG22 VAL 31 24.126 24.915 27.885
215 HG23 VAL 31 HG23 VAL 31 24.664 25.517 29.477
216 HA PRO 32 HA PRO 32 26.765 22.538 32.636
217 HB2 PRO 32 HB2 PRO 32 28.925 23.677 33.818
218 HB3 PRO 32 HB3 PRO 32 29.078 22.316 32.666
219 HG2 PRO 32 HG2 PRO 32 29.374 25.287 32.080
220 HG3 PRO 32 HG3 PRO 32 30.517 23.965 31.669
221 HD2 PRO 32 HD2 PRO 32 28.636 24.903 29.888
222 HD3 PRO 32 HD3 PRO 32 29.128 23.178 29.940
223 H TYR 33 H TYR 33 26.256 25.604 31.382
224 HA TYR 33 HA TYR 33 26.462 27.335 33.578
225 HB2 TYR 33 HB2 TYR 33 24.548 27.679 31.268
226 HB3 TYR 33 HB3 TYR 33 25.304 28.938 32.231
227 HD1 TYR 33 HD2 TYR 33 28.212 27.559 32.052
228 HD2 TYR 33 HD1 TYR 33 25.188 28.723 29.202
229 HE1 TYR 33 HE2 TYR 33 29.926 27.616 30.238
230 HE2 TYR 33 HE1 TYR 33 26.909 28.826 27.419
231 HH TYR 33 HH TYR 33 29.082 28.525 26.876
Start of MODEL 18
1 H1 GLY 1 H1 GLY 1 43.264 15.571 18.562
2 H2 GLY 1 H2 GLY 1 41.748 14.947 18.431
3 H3 GLY 1 H3 GLY 1 42.480 15.007 19.892
4 HA2 GLY 1 HA2 GLY 1 40.811 16.707 19.761
5 HA3 GLY 1 HA3 GLY 1 42.430 17.415 19.890
6 H SER 2 H SER 2 40.332 18.912 18.895
7 HA SER 2 HA SER 2 39.754 20.321 17.266
8 HB2 SER 2 HB2 SER 2 42.508 19.770 16.140
9 HB3 SER 2 HB3 SER 2 41.487 21.170 15.772
10 HG SER 2 HG SER 2 41.602 21.836 17.877
11 H ALA 3 H ALA 3 39.000 17.494 16.712
12 HA ALA 3 HA ALA 3 38.263 17.895 13.868
13 HB1 ALA 3 HB1 ALA 3 38.979 15.622 13.277
14 HB2 ALA 3 HB2 ALA 3 40.350 16.577 13.877
15 HB3 ALA 3 HB3 ALA 3 39.585 15.359 14.920
16 H PHE 4 H PHE 4 36.287 17.532 13.502
17 HA PHE 4 HA PHE 4 34.186 16.962 13.461
18 HB2 PHE 4 HB2 PHE 4 35.454 14.657 13.297
19 HB3 PHE 4 HB3 PHE 4 34.604 14.319 14.800
20 HD1 PHE 4 HD2 PHE 4 34.119 15.572 11.298
21 HD2 PHE 4 HD1 PHE 4 32.312 13.569 14.665
22 HE1 PHE 4 HE2 PHE 4 32.057 15.211 9.973
23 HE2 PHE 4 HE1 PHE 4 30.270 13.172 13.322
24 HZ PHE 4 HZ PHE 4 30.116 14.005 10.987
25 H CYS 5 H CYS 5 32.121 16.347 14.526
26 HA CYS 5 HA CYS 5 31.822 16.649 17.390
27 HB2 CYS 5 HB2 CYS 5 32.417 18.979 16.581
28 HB3 CYS 5 HB3 CYS 5 30.988 18.935 15.565
29 H ASN 6 H ASN 6 29.552 16.572 18.030
30 HA ASN 6 HA ASN 6 27.510 16.267 15.871
31 HB2 ASN 6 HB2 ASN 6 27.626 14.232 17.255
32 HB3 ASN 6 HB3 ASN 6 27.402 15.188 18.719
33 HD21 ASN 6 HD22 ASN 6 25.631 13.400 18.745
34 HD22 ASN 6 HD21 ASN 6 24.096 13.818 17.987
35 H LEU 7 H LEU 7 26.548 18.164 15.595
36 HA LEU 7 HA LEU 7 26.061 19.978 17.938
37 HB2 LEU 7 HB2 LEU 7 28.065 20.642 16.595
38 HB3 LEU 7 HB3 LEU 7 27.058 20.759 15.175
39 HG LEU 7 HG LEU 7 25.676 22.534 16.384
40 HD11 LEU 7 HD11 LEU 7 26.378 22.057 18.694
41 HD12 LEU 7 HD12 LEU 7 28.069 22.428 18.288
42 HD13 LEU 7 HD13 LEU 7 26.831 23.702 18.250
43 HD21 LEU 7 HD21 LEU 7 27.336 23.085 14.661
44 HD22 LEU 7 HD22 LEU 7 27.335 24.303 15.938
45 HD23 LEU 7 HD23 LEU 7 28.631 23.085 15.870
46 H ALA 8 H ALA 8 25.196 19.746 14.415
47 HA ALA 8 HA ALA 8 22.836 21.257 14.835
48 HB1 ALA 8 HB1 ALA 8 23.657 19.549 12.466
49 HB2 ALA 8 HB2 ALA 8 22.442 20.849 12.460
50 HB3 ALA 8 HB3 ALA 8 24.144 21.233 12.763
51 H ALA 9 H ALA 9 23.194 17.848 15.335
52 HA ALA 9 HA ALA 9 20.225 17.527 15.511
53 HB1 ALA 9 HB1 ALA 9 21.520 15.701 14.467
54 HB2 ALA 9 HB2 ALA 9 22.479 15.533 15.960
55 HB3 ALA 9 HB3 ALA 9 20.752 15.179 15.978
56 H CYS 10 H CYS 10 23.091 18.002 17.470
57 HA CYS 10 HA CYS 10 22.052 17.099 19.992
58 HB2 CYS 10 HB2 CYS 10 24.461 17.196 19.391
59 HB3 CYS 10 HB3 CYS 10 24.375 18.957 19.328
60 H GLU 11 H GLU 11 22.437 20.372 18.557
61 HA GLU 11 HA GLU 11 21.324 22.063 20.492
62 HB2 GLU 11 HB2 GLU 11 21.150 21.869 17.470
63 HB3 GLU 11 HB3 GLU 11 20.218 23.104 18.293
64 HG2 GLU 11 HG2 GLU 11 23.198 22.829 18.816
65 HG3 GLU 11 HG3 GLU 11 22.566 23.695 17.412
66 H LEU 12 H LEU 12 19.584 19.878 18.296
67 HA LEU 12 HA LEU 12 16.945 20.813 19.000
68 HB2 LEU 12 HB2 LEU 12 17.540 18.135 17.731
69 HB3 LEU 12 HB3 LEU 12 16.167 19.204 17.482
70 HG LEU 12 HG LEU 12 19.008 19.643 16.452
71 HD11 LEU 12 HD11 LEU 12 16.411 18.950 15.042
72 HD12 LEU 12 HD12 LEU 12 17.968 19.269 14.252
73 HD13 LEU 12 HD13 LEU 12 17.784 17.851 15.301
74 HD21 LEU 12 HD21 LEU 12 17.888 21.824 16.885
75 HD22 LEU 12 HD22 LEU 12 18.059 21.511 15.150
76 HD23 LEU 12 HD23 LEU 12 16.486 21.277 15.946
77 H SER 13 H SER 13 18.928 17.997 19.942
78 HA SER 13 HA SER 13 16.998 16.824 21.764
79 HB2 SER 13 HB2 SER 13 20.012 16.506 21.467
80 HB3 SER 13 HB3 SER 13 19.009 15.539 22.560
81 HG SER 13 HG SER 13 19.489 14.700 20.341
82 H CYS 14 H CYS 14 19.234 19.486 22.062
83 HA CYS 14 HA CYS 14 19.024 19.554 25.017
84 HB2 CYS 14 HB2 CYS 14 20.591 21.090 22.933
85 HB3 CYS 14 HB3 CYS 14 20.580 21.539 24.631
86 H ARG 15 H ARG 15 17.284 21.021 22.363
87 HA ARG 15 HA ARG 15 16.991 23.596 23.332
88 HB2 ARG 15 HB2 ARG 15 16.323 22.502 21.043
89 HB3 ARG 15 HB3 ARG 15 14.783 22.166 21.822
90 HG2 ARG 15 HG2 ARG 15 14.291 24.175 20.870
91 HG3 ARG 15 HG3 ARG 15 14.882 24.784 22.411
92 HD2 ARG 15 HD2 ARG 15 16.381 24.585 19.794
93 HD3 ARG 15 HD3 ARG 15 15.762 26.072 20.509
94 HE ARG 15 HE ARG 15 17.465 25.658 22.384
95 HH11 ARG 15 HH21 ARG 15 18.044 25.212 18.989
96 HH12 ARG 15 HH22 ARG 15 19.783 25.300 19.220
97 HH21 ARG 15 HH11 ARG 15 19.678 25.401 22.624
98 HH22 ARG 15 HH12 ARG 15 20.675 25.258 21.174
99 H SER 16 H SER 16 15.063 20.814 24.411
100 HA SER 16 HA SER 16 12.976 22.449 25.600
101 HB2 SER 16 HB2 SER 16 13.622 19.573 26.321
102 HB3 SER 16 HB3 SER 16 12.105 20.440 26.548
103 HG SER 16 HG SER 16 13.293 19.546 24.138
104 H LEU 17 H LEU 17 16.172 21.794 26.640
105 HA LEU 17 HA LEU 17 15.507 22.101 29.507
106 HB2 LEU 17 HB2 LEU 17 18.331 22.022 28.673
107 HB3 LEU 17 HB3 LEU 17 17.537 21.264 30.027
108 HG LEU 17 HG LEU 17 17.607 20.289 27.148
109 HD11 LEU 17 HD11 LEU 17 19.016 18.515 28.019
110 HD12 LEU 17 HD12 LEU 17 19.720 20.080 28.437
111 HD13 LEU 17 HD13 LEU 17 18.858 19.150 29.674
112 HD21 LEU 17 HD21 LEU 17 16.461 18.816 29.545
113 HD22 LEU 17 HD22 LEU 17 15.478 19.527 28.259
114 HD23 LEU 17 HD23 LEU 17 16.589 18.206 27.888
115 H GLY 18 H GLY 18 15.749 24.229 27.024
116 HA2 GLY 18 HA2 GLY 18 15.884 26.524 26.979
117 HA3 GLY 18 HA3 GLY 18 16.036 26.524 28.739
118 H LEU 19 H LEU 19 18.331 24.915 26.519
119 HA LEU 19 HA LEU 19 20.310 27.076 26.810
120 HB2 LEU 19 HB2 LEU 19 21.918 25.867 27.975
121 HB3 LEU 19 HB3 LEU 19 20.449 25.726 28.864
122 HG LEU 19 HG LEU 19 22.234 23.659 27.851
123 HD11 LEU 19 HD11 LEU 19 19.842 23.543 29.721
124 HD12 LEU 19 HD12 LEU 19 21.115 22.310 29.562
125 HD13 LEU 19 HD13 LEU 19 21.513 23.919 30.177
126 HD21 LEU 19 HD21 LEU 19 19.331 23.265 27.078
127 HD22 LEU 19 HD22 LEU 19 20.797 23.096 26.078
128 HD23 LEU 19 HD23 LEU 19 20.450 21.946 27.354
129 H LEU 20 H LEU 20 22.547 25.908 25.945
130 HA LEU 20 HA LEU 20 21.945 25.308 23.093
131 HB2 LEU 20 HB2 LEU 20 24.493 26.217 24.467
132 HB3 LEU 20 HB3 LEU 20 24.344 25.869 22.746
133 HG LEU 20 HG LEU 20 22.867 28.078 24.242
134 HD11 LEU 20 HD11 LEU 20 25.131 28.217 22.210
135 HD12 LEU 20 HD12 LEU 20 24.332 29.584 23.011
136 HD13 LEU 20 HD13 LEU 20 25.298 28.459 23.971
137 HD21 LEU 20 HD21 LEU 20 22.306 28.879 21.920
138 HD22 LEU 20 HD22 LEU 20 22.912 27.341 21.274
139 HD23 LEU 20 HD23 LEU 20 21.497 27.382 22.356
140 H GLY 21 H GLY 21 22.760 23.566 22.016
141 HA2 GLY 21 HA2 GLY 21 23.901 21.295 23.612
142 HA3 GLY 21 HA3 GLY 21 23.202 21.181 21.998
143 H LYS 22 H LYS 22 26.054 21.047 23.573
144 HA LYS 22 HA LYS 22 27.640 21.653 21.139
145 HB2 LYS 22 HB2 LYS 22 28.238 23.033 23.795
146 HB3 LYS 22 HB3 LYS 22 29.355 22.930 22.431
147 HG2 LYS 22 HG2 LYS 22 27.551 24.045 21.006
148 HG3 LYS 22 HG3 LYS 22 26.701 24.400 22.529
149 HD2 LYS 22 HD2 LYS 22 28.793 25.574 23.328
150 HD3 LYS 22 HD3 LYS 22 29.499 25.317 21.728
151 HE2 LYS 22 HE2 LYS 22 27.024 26.972 22.404
152 HE3 LYS 22 HE3 LYS 22 28.612 27.566 21.906
153 HZ1 LYS 22 HZ1 LYS 22 27.234 27.618 20.011
154 HZ2 LYS 22 HZ2 LYS 22 28.259 26.395 19.766
155 HZ3 LYS 22 HZ3 LYS 22 26.688 26.079 20.203
156 H CYS 23 H CYS 23 29.382 20.362 20.859
157 HA CYS 23 HA CYS 23 29.533 18.027 22.599
158 HB2 CYS 23 HB2 CYS 23 30.898 17.065 20.870
159 HB3 CYS 23 HB3 CYS 23 29.481 17.818 20.144
160 H ILE 24 H ILE 24 31.386 17.182 23.655
161 HA ILE 24 HA ILE 24 33.522 19.188 24.322
162 HB ILE 24 HB ILE 24 32.296 17.023 26.071
163 HG12 ILE 24 HG12 ILE 24 30.666 18.776 25.842
164 HG13 ILE 24 HG13 ILE 24 31.375 18.843 27.442
165 HG21 ILE 24 HG21 ILE 24 34.417 19.106 26.728
166 HG22 ILE 24 HG22 ILE 24 33.591 18.044 27.908
167 HG23 ILE 24 HG23 ILE 24 34.627 17.350 26.676
168 HD11 ILE 24 HD11 ILE 24 31.078 21.079 26.549
169 HD12 ILE 24 HD12 ILE 24 32.814 20.769 26.706
170 HD13 ILE 24 HD13 ILE 24 32.031 20.715 25.120
171 H GLY 25 H GLY 25 32.852 15.717 24.008
172 HA2 GLY 25 HA2 GLY 25 35.567 15.335 22.806
173 HA3 GLY 25 HA3 GLY 25 34.833 14.101 23.846
174 H GLU 26 H GLU 26 33.837 16.219 21.160
175 HA GLU 26 HA GLU 26 32.565 16.053 19.379
176 HB2 GLU 26 HB2 GLU 26 33.608 13.251 19.030
177 HB3 GLU 26 HB3 GLU 26 33.076 14.393 17.798
178 HG2 GLU 26 HG2 GLU 26 35.270 14.765 17.560
179 HG3 GLU 26 HG3 GLU 26 35.038 15.907 18.869
180 H GLU 27 H GLU 27 31.494 14.319 21.922
181 HA GLU 27 HA GLU 27 29.052 13.238 20.601
182 HB2 GLU 27 HB2 GLU 27 30.172 11.653 21.984
183 HB3 GLU 27 HB3 GLU 27 30.382 12.815 23.292
184 HG2 GLU 27 HG2 GLU 27 27.981 12.831 23.747
185 HG3 GLU 27 HG3 GLU 27 27.688 11.755 22.373
186 H CYS 28 H CYS 28 26.952 13.855 21.299
187 HA CYS 28 HA CYS 28 26.573 16.552 21.984
188 HB2 CYS 28 HB2 CYS 28 24.972 15.159 20.740
189 HB3 CYS 28 HB3 CYS 28 24.639 14.224 22.200
190 H LYS 29 H LYS 29 26.651 17.587 23.713
191 HA LYS 29 HA LYS 29 25.410 16.733 26.228
192 HB2 LYS 29 HB2 LYS 29 28.122 18.127 25.975
193 HB3 LYS 29 HB3 LYS 29 27.224 18.044 27.474
194 HG2 LYS 29 HG2 LYS 29 28.114 15.510 26.039
195 HG3 LYS 29 HG3 LYS 29 29.207 16.427 27.046
196 HD2 LYS 29 HD2 LYS 29 28.241 14.543 28.243
197 HD3 LYS 29 HD3 LYS 29 27.890 16.092 29.013
198 HE2 LYS 29 HE2 LYS 29 25.597 16.048 28.198
199 HE3 LYS 29 HE3 LYS 29 25.923 14.596 27.233
200 HZ1 LYS 29 HZ1 LYS 29 24.815 14.057 29.317
201 HZ2 LYS 29 HZ2 LYS 29 26.279 13.368 29.273
202 HZ3 LYS 29 HZ3 LYS 29 26.056 14.695 30.211
203 H CYS 30 H CYS 30 24.575 18.648 27.409
204 HA CYS 30 HA CYS 30 24.435 21.091 25.722
205 HB2 CYS 30 HB2 CYS 30 22.616 20.723 28.034
206 HB3 CYS 30 HB3 CYS 30 22.428 21.565 26.514
207 H VAL 31 H VAL 31 24.588 23.155 26.757
208 HA VAL 31 HA VAL 31 26.991 23.183 28.185
209 HB VAL 31 HB VAL 31 26.903 25.603 28.199
210 HG11 VAL 31 HG11 VAL 31 26.790 25.937 25.806
211 HG12 VAL 31 HG12 VAL 31 27.485 24.339 26.134
212 HG13 VAL 31 HG13 VAL 31 25.812 24.472 25.591
213 HG21 VAL 31 HG21 VAL 31 24.555 25.997 28.774
214 HG22 VAL 31 HG22 VAL 31 24.997 26.837 27.287
215 HG23 VAL 31 HG23 VAL 31 24.051 25.335 27.199
216 HA PRO 32 HA PRO 32 25.928 22.690 32.241
217 HB2 PRO 32 HB2 PRO 32 28.283 23.040 33.492
218 HB3 PRO 32 HB3 PRO 32 28.146 21.955 32.074
219 HG2 PRO 32 HG2 PRO 32 29.087 24.846 32.116
220 HG3 PRO 32 HG3 PRO 32 29.886 23.416 31.376
221 HD2 PRO 32 HD2 PRO 32 28.222 25.171 29.993
222 HD3 PRO 32 HD3 PRO 32 28.469 23.455 29.559
223 H TYR 33 H TYR 33 25.925 25.913 31.489
224 HA TYR 33 HA TYR 33 26.592 27.261 33.858
225 HB2 TYR 33 HB2 TYR 33 24.581 28.121 31.766
226 HB3 TYR 33 HB3 TYR 33 25.470 29.169 32.845
227 HD1 TYR 33 HD2 TYR 33 28.270 28.195 32.640
228 HD2 TYR 33 HD1 TYR 33 25.233 28.677 29.603
229 HE1 TYR 33 HE2 TYR 33 30.038 28.572 30.919
230 HE2 TYR 33 HE1 TYR 33 26.991 29.045 27.903
231 HH TYR 33 HH TYR 33 29.194 29.018 27.470
Start of MODEL 19
1 H1 GLY 1 H1 GLY 1 41.123 19.562 20.946
2 H2 GLY 1 H2 GLY 1 41.661 20.787 19.993
3 H3 GLY 1 H3 GLY 1 42.095 19.242 19.657
4 HA2 GLY 1 HA2 GLY 1 40.411 20.012 18.120
5 HA3 GLY 1 HA3 GLY 1 39.858 18.637 19.090
6 H SER 2 H SER 2 38.034 18.853 20.197
7 HA SER 2 HA SER 2 36.157 19.613 21.126
8 HB2 SER 2 HB2 SER 2 37.424 22.255 21.779
9 HB3 SER 2 HB3 SER 2 36.259 21.311 22.715
10 HG SER 2 HG SER 2 37.959 19.755 23.052
11 H ALA 3 H ALA 3 37.310 21.975 18.727
12 HA ALA 3 HA ALA 3 34.799 23.452 18.825
13 HB1 ALA 3 HB1 ALA 3 35.927 24.999 17.301
14 HB2 ALA 3 HB2 ALA 3 36.926 24.619 18.700
15 HB3 ALA 3 HB3 ALA 3 37.283 23.868 17.123
16 H PHE 4 H PHE 4 34.625 20.675 17.798
17 HA PHE 4 HA PHE 4 32.829 21.326 15.572
18 HB2 PHE 4 HB2 PHE 4 34.880 20.695 14.384
19 HB3 PHE 4 HB3 PHE 4 34.989 19.205 15.307
20 HD1 PHE 4 HD1 PHE 4 33.048 21.006 12.691
21 HD2 PHE 4 HD2 PHE 4 33.626 17.262 14.757
22 HE1 PHE 4 HE1 PHE 4 31.653 19.848 10.994
23 HE2 PHE 4 HE2 PHE 4 32.242 16.108 13.046
24 HZ PHE 4 HZ PHE 4 31.266 17.396 11.160
25 H CYS 5 H CYS 5 31.037 20.078 15.535
26 HA CYS 5 HA CYS 5 30.631 17.716 17.238
27 HB2 CYS 5 HB2 CYS 5 30.442 19.680 18.781
28 HB3 CYS 5 HB3 CYS 5 29.264 20.407 17.707
29 H ASN 6 H ASN 6 28.449 16.763 16.779
30 HA ASN 6 HA ASN 6 27.229 17.468 14.207
31 HB2 ASN 6 HB2 ASN 6 27.372 15.135 15.089
32 HB3 ASN 6 HB3 ASN 6 26.212 15.567 16.341
33 HD21 ASN 6 HD22 ASN 6 25.317 13.603 15.069
34 HD22 ASN 6 HD21 ASN 6 24.177 13.979 13.782
35 H LEU 7 H LEU 7 27.188 19.764 15.088
36 HA LEU 7 HA LEU 7 25.733 20.519 17.338
37 HB2 LEU 7 HB2 LEU 7 27.488 21.834 16.126
38 HB3 LEU 7 HB3 LEU 7 26.352 22.130 14.816
39 HG LEU 7 HG LEU 7 24.869 23.370 16.432
40 HD11 LEU 7 HD11 LEU 7 27.267 23.095 18.314
41 HD12 LEU 7 HD12 LEU 7 25.803 24.071 18.587
42 HD13 LEU 7 HD13 LEU 7 25.687 22.321 18.535
43 HD21 LEU 7 HD21 LEU 7 26.286 25.364 16.544
44 HD22 LEU 7 HD22 LEU 7 27.743 24.383 16.261
45 HD23 LEU 7 HD23 LEU 7 26.509 24.540 14.996
46 H ALA 8 H ALA 8 24.643 20.548 13.952
47 HA ALA 8 HA ALA 8 22.086 21.614 14.264
48 HB1 ALA 8 HB1 ALA 8 23.153 19.520 12.312
49 HB2 ALA 8 HB2 ALA 8 21.679 20.495 12.071
50 HB3 ALA 8 HB3 ALA 8 23.265 21.285 12.138
51 H ALA 9 H ALA 9 23.134 18.347 15.105
52 HA ALA 9 HA ALA 9 20.342 17.410 15.501
53 HB1 ALA 9 HB1 ALA 9 22.990 15.932 15.737
54 HB2 ALA 9 HB2 ALA 9 21.368 15.224 15.791
55 HB3 ALA 9 HB3 ALA 9 21.954 15.956 14.289
56 H CYS 10 H CYS 10 23.331 18.142 17.334
57 HA CYS 10 HA CYS 10 22.319 17.093 19.823
58 HB2 CYS 10 HB2 CYS 10 24.713 17.266 19.175
59 HB3 CYS 10 HB3 CYS 10 24.615 19.024 19.305
60 H GLU 11 H GLU 11 22.347 20.363 18.410
61 HA GLU 11 HA GLU 11 21.188 21.820 20.568
62 HB2 GLU 11 HB2 GLU 11 21.020 22.035 17.543
63 HB3 GLU 11 HB3 GLU 11 20.280 23.211 18.604
64 HG2 GLU 11 HG2 GLU 11 23.248 22.538 18.783
65 HG3 GLU 11 HG3 GLU 11 22.614 23.731 17.657
66 H LEU 12 H LEU 12 19.735 19.390 18.529
67 HA LEU 12 HA LEU 12 16.966 20.153 19.091
68 HB2 LEU 12 HB2 LEU 12 17.880 17.381 18.298
69 HB3 LEU 12 HB3 LEU 12 16.325 18.134 18.038
70 HG LEU 12 HG LEU 12 18.919 18.881 16.622
71 HD11 LEU 12 HD11 LEU 12 17.994 16.670 15.999
72 HD12 LEU 12 HD12 LEU 12 16.431 17.429 15.629
73 HD13 LEU 12 HD13 LEU 12 17.870 17.831 14.667
74 HD21 LEU 12 HD21 LEU 12 16.088 19.873 16.155
75 HD22 LEU 12 HD22 LEU 12 17.438 20.841 16.777
76 HD23 LEU 12 HD23 LEU 12 17.485 20.223 15.122
77 H SER 13 H SER 13 19.294 17.786 20.455
78 HA SER 13 HA SER 13 17.382 16.585 22.271
79 HB2 SER 13 HB2 SER 13 20.431 16.516 22.318
80 HB3 SER 13 HB3 SER 13 19.346 15.456 23.220
81 HG SER 13 HG SER 13 20.106 14.444 21.423
82 H CYS 14 H CYS 14 19.987 18.999 22.668
83 HA CYS 14 HA CYS 14 19.652 19.189 25.531
84 HB2 CYS 14 HB2 CYS 14 21.027 20.887 23.448
85 HB3 CYS 14 HB3 CYS 14 21.094 21.266 25.169
86 H ARG 15 H ARG 15 18.077 20.973 22.871
87 HA ARG 15 HA ARG 15 16.974 23.060 24.505
88 HB2 ARG 15 HB2 ARG 15 17.157 22.758 21.886
89 HB3 ARG 15 HB3 ARG 15 15.641 21.905 22.034
90 HG2 ARG 15 HG2 ARG 15 15.044 24.139 21.538
91 HG3 ARG 15 HG3 ARG 15 14.786 24.005 23.280
92 HD2 ARG 15 HD2 ARG 15 15.918 26.091 22.888
93 HD3 ARG 15 HD3 ARG 15 17.117 25.027 23.610
94 HE ARG 15 HE ARG 15 16.901 25.893 20.757
95 HH11 ARG 15 HH11 ARG 15 19.038 24.250 23.133
96 HH12 ARG 15 HH12 ARG 15 20.296 24.241 21.878
97 HH21 ARG 15 HH21 ARG 15 18.741 25.825 19.464
98 HH22 ARG 15 HH22 ARG 15 20.193 25.156 20.169
99 H SER 16 H SER 16 15.885 19.763 23.848
100 HA SER 16 HA SER 16 13.401 19.939 25.267
101 HB2 SER 16 HB2 SER 16 15.118 17.498 24.747
102 HB3 SER 16 HB3 SER 16 13.381 17.530 25.092
103 HG SER 16 HG SER 16 14.154 17.426 22.780
104 H LEU 17 H LEU 17 16.568 20.090 26.500
105 HA LEU 17 HA LEU 17 15.653 19.441 29.275
106 HB2 LEU 17 HB2 LEU 17 18.491 20.030 28.424
107 HB3 LEU 17 HB3 LEU 17 17.928 19.305 29.924
108 HG LEU 17 HG LEU 17 17.975 18.082 27.164
109 HD11 LEU 17 HD11 LEU 17 19.634 16.541 28.194
110 HD12 LEU 17 HD12 LEU 17 20.163 18.231 28.281
111 HD13 LEU 17 HD13 LEU 17 19.508 17.435 29.722
112 HD21 LEU 17 HD21 LEU 17 17.009 16.915 29.842
113 HD22 LEU 17 HD22 LEU 17 16.028 17.141 28.380
114 HD23 LEU 17 HD23 LEU 17 17.316 15.931 28.401
115 H GLY 18 H GLY 18 15.517 21.966 27.258
116 HA2 GLY 18 HA2 GLY 18 15.043 24.162 27.693
117 HA3 GLY 18 HA3 GLY 18 15.575 23.971 29.363
118 H LEU 19 H LEU 19 18.183 22.904 27.380
119 HA LEU 19 HA LEU 19 19.280 25.687 27.307
120 HB2 LEU 19 HB2 LEU 19 21.158 25.274 28.509
121 HB3 LEU 19 HB3 LEU 19 19.900 24.463 29.414
122 HG LEU 19 HG LEU 19 22.146 23.252 27.758
123 HD11 LEU 19 HD11 LEU 19 22.636 24.010 30.051
124 HD12 LEU 19 HD12 LEU 19 21.355 22.951 30.677
125 HD13 LEU 19 HD13 LEU 19 22.785 22.255 29.886
126 HD21 LEU 19 HD21 LEU 19 21.223 21.020 28.568
127 HD22 LEU 19 HD22 LEU 19 19.710 21.870 28.910
128 HD23 LEU 19 HD23 LEU 19 20.363 21.795 27.238
129 H LEU 20 H LEU 20 21.771 25.392 26.516
130 HA LEU 20 HA LEU 20 21.366 25.073 23.622
131 HB2 LEU 20 HB2 LEU 20 23.478 26.330 25.380
132 HB3 LEU 20 HB3 LEU 20 23.737 26.066 23.665
133 HG LEU 20 HG LEU 20 21.910 27.524 23.055
134 HD11 LEU 20 HD11 LEU 20 21.468 27.971 26.045
135 HD12 LEU 20 HD12 LEU 20 20.790 28.973 24.745
136 HD13 LEU 20 HD13 LEU 20 20.299 27.293 24.873
137 HD21 LEU 20 HD21 LEU 20 23.691 28.801 25.183
138 HD22 LEU 20 HD22 LEU 20 24.184 28.437 23.516
139 HD23 LEU 20 HD23 LEU 20 22.910 29.622 23.812
140 H GLY 21 H GLY 21 22.417 23.597 22.309
141 HA2 GLY 21 HA2 GLY 21 23.734 21.300 23.694
142 HA3 GLY 21 HA3 GLY 21 22.931 21.246 22.128
143 H LYS 22 H LYS 22 25.813 21.777 23.835
144 HA LYS 22 HA LYS 22 27.351 21.982 21.271
145 HB2 LYS 22 HB2 LYS 22 27.817 23.788 23.680
146 HB3 LYS 22 HB3 LYS 22 29.042 23.432 22.474
147 HG2 LYS 22 HG2 LYS 22 28.255 25.412 21.697
148 HG3 LYS 22 HG3 LYS 22 27.364 24.274 20.697
149 HD2 LYS 22 HD2 LYS 22 25.318 24.692 21.969
150 HD3 LYS 22 HD3 LYS 22 26.231 25.536 23.224
151 HE2 LYS 22 HE2 LYS 22 25.094 27.185 21.921
152 HE3 LYS 22 HE3 LYS 22 26.821 27.322 21.588
153 HZ1 LYS 22 HZ1 LYS 22 26.456 26.153 19.505
154 HZ2 LYS 22 HZ2 LYS 22 24.835 25.937 19.861
155 HZ3 LYS 22 HZ3 LYS 22 25.418 27.430 19.599
156 H CYS 23 H CYS 23 28.812 20.425 21.109
157 HA CYS 23 HA CYS 23 29.420 18.866 23.576
158 HB2 CYS 23 HB2 CYS 23 29.187 16.880 22.502
159 HB3 CYS 23 HB3 CYS 23 27.815 17.846 21.990
160 H ILE 24 H ILE 24 31.353 17.463 23.524
161 HA ILE 24 HA ILE 24 33.595 19.345 22.875
162 HB ILE 24 HB ILE 24 33.052 17.696 25.369
163 HG12 ILE 24 HG12 ILE 24 31.441 19.504 25.306
164 HG13 ILE 24 HG13 ILE 24 32.634 19.795 26.549
165 HG21 ILE 24 HG21 ILE 24 35.290 19.665 24.759
166 HG22 ILE 24 HG22 ILE 24 34.882 19.093 26.391
167 HG23 ILE 24 HG23 ILE 24 35.420 17.941 25.180
168 HD11 ILE 24 HD11 ILE 24 32.075 21.864 25.373
169 HD12 ILE 24 HD12 ILE 24 33.774 21.459 25.093
170 HD13 ILE 24 HD13 ILE 24 32.564 21.167 23.823
171 H GLY 25 H GLY 25 32.692 15.938 23.064
172 HA2 GLY 25 HA2 GLY 25 35.302 15.181 21.781
173 HA3 GLY 25 HA3 GLY 25 34.525 14.191 23.023
174 H GLU 26 H GLU 26 32.768 15.884 20.447
175 HA GLU 26 HA GLU 26 31.117 15.181 19.106
176 HB2 GLU 26 HB2 GLU 26 33.173 13.114 18.332
177 HB3 GLU 26 HB3 GLU 26 31.695 13.435 17.429
178 HG2 GLU 26 HG2 GLU 26 32.392 15.760 17.034
179 HG3 GLU 26 HG3 GLU 26 33.850 15.514 17.996
180 H GLU 27 H GLU 27 30.634 14.415 21.691
181 HA GLU 27 HA GLU 27 28.629 12.310 21.136
182 HB2 GLU 27 HB2 GLU 27 30.630 11.265 22.247
183 HB3 GLU 27 HB3 GLU 27 30.314 12.250 23.674
184 HG2 GLU 27 HG2 GLU 27 28.242 10.364 22.441
185 HG3 GLU 27 HG3 GLU 27 29.456 9.810 23.579
186 H CYS 28 H CYS 28 26.734 13.304 21.451
187 HA CYS 28 HA CYS 28 26.681 15.924 21.908
188 HB2 CYS 28 HB2 CYS 28 24.985 14.858 20.651
189 HB3 CYS 28 HB3 CYS 28 24.381 13.987 22.058
190 H LYS 29 H LYS 29 26.504 17.335 23.321
191 HA LYS 29 HA LYS 29 25.945 16.887 26.184
192 HB2 LYS 29 HB2 LYS 29 28.567 16.831 25.150
193 HB3 LYS 29 HB3 LYS 29 28.366 18.522 25.550
194 HG2 LYS 29 HG2 LYS 29 29.408 17.268 27.356
195 HG3 LYS 29 HG3 LYS 29 27.885 17.995 27.848
196 HD2 LYS 29 HD2 LYS 29 28.277 15.669 28.743
197 HD3 LYS 29 HD3 LYS 29 26.756 15.876 27.883
198 HE2 LYS 29 HE2 LYS 29 27.920 14.954 25.806
199 HE3 LYS 29 HE3 LYS 29 29.298 14.546 26.839
200 HZ1 LYS 29 HZ1 LYS 29 26.514 13.566 27.222
201 HZ2 LYS 29 HZ2 LYS 29 27.728 12.722 26.518
202 HZ3 LYS 29 HZ3 LYS 29 27.839 13.112 28.110
203 H CYS 30 H CYS 30 25.588 18.880 27.364
204 HA CYS 30 HA CYS 30 24.741 21.127 25.622
205 HB2 CYS 30 HB2 CYS 30 23.578 20.477 28.310
206 HB3 CYS 30 HB3 CYS 30 22.916 21.421 26.983
207 H VAL 31 H VAL 31 24.618 23.287 26.965
208 HA VAL 31 HA VAL 31 27.372 23.712 27.551
209 HB VAL 31 HB VAL 31 26.829 26.067 27.935
210 HG11 VAL 31 HG11 VAL 31 27.210 25.177 25.697
211 HG12 VAL 31 HG12 VAL 31 25.490 24.796 25.524
212 HG13 VAL 31 HG13 VAL 31 26.019 26.492 25.667
213 HG21 VAL 31 HG21 VAL 31 24.711 25.897 29.083
214 HG22 VAL 31 HG22 VAL 31 24.555 26.891 27.635
215 HG23 VAL 31 HG23 VAL 31 23.928 25.223 27.628
216 HA PRO 32 HA PRO 32 27.573 23.245 31.928
217 HB2 PRO 32 HB2 PRO 32 29.936 24.401 32.539
218 HB3 PRO 32 HB3 PRO 32 29.847 23.009 31.417
219 HG2 PRO 32 HG2 PRO 32 29.985 25.962 30.709
220 HG3 PRO 32 HG3 PRO 32 30.995 24.624 30.065
221 HD2 PRO 32 HD2 PRO 32 28.731 25.568 28.786
222 HD3 PRO 32 HD3 PRO 32 29.268 23.858 28.692
223 H TYR 33 H TYR 33 27.278 26.454 30.640
224 HA TYR 33 HA TYR 33 27.044 27.760 33.284
225 HB2 TYR 33 HB2 TYR 33 27.051 29.843 31.888
226 HB3 TYR 33 HB3 TYR 33 28.509 28.878 31.845
227 HD1 TYR 33 HD1 TYR 33 25.336 29.471 29.901
228 HD2 TYR 33 HD2 TYR 33 29.498 28.350 29.780
229 HE1 TYR 33 HE1 TYR 33 25.296 29.569 27.411
230 HE2 TYR 33 HE2 TYR 33 29.451 28.440 27.302
231 HH TYR 33 HH TYR 33 28.229 28.896 25.460
Start of MODEL 20
1 H1 GLY 1 H1 GLY 1 35.102 9.921 23.612
2 H2 GLY 1 H2 GLY 1 35.002 11.557 23.791
3 H3 GLY 1 H3 GLY 1 34.451 10.845 22.415
4 HA2 GLY 1 HA2 GLY 1 33.306 10.521 25.101
5 HA3 GLY 1 HA3 GLY 1 32.596 11.447 23.759
6 H SER 2 H SER 2 30.828 9.814 24.520
7 HA SER 2 HA SER 2 31.267 7.069 23.746
8 HB2 SER 2 HB2 SER 2 29.200 6.568 24.695
9 HB3 SER 2 HB3 SER 2 29.939 7.791 25.727
10 HG SER 2 HG SER 2 28.539 9.355 24.804
11 H ALA 3 H ALA 3 29.824 9.726 21.978
12 HA ALA 3 HA ALA 3 29.219 7.990 19.684
13 HB1 ALA 3 HB1 ALA 3 26.880 8.752 19.553
14 HB2 ALA 3 HB2 ALA 3 27.169 7.850 21.056
15 HB3 ALA 3 HB3 ALA 3 27.062 9.619 21.096
16 H PHE 4 H PHE 4 29.418 9.063 17.757
17 HA PHE 4 HA PHE 4 30.997 11.342 17.754
18 HB2 PHE 4 HB2 PHE 4 29.563 9.824 15.592
19 HB3 PHE 4 HB3 PHE 4 30.372 11.323 15.188
20 HD1 PHE 4 HD1 PHE 4 32.807 11.593 15.360
21 HD2 PHE 4 HD2 PHE 4 30.899 7.822 16.198
22 HE1 PHE 4 HE1 PHE 4 35.006 10.458 15.232
23 HE2 PHE 4 HE2 PHE 4 33.104 6.688 16.067
24 HZ PHE 4 HZ PHE 4 35.155 8.002 15.579
25 H CYS 5 H CYS 5 30.901 13.396 16.938
26 HA CYS 5 HA CYS 5 28.710 14.939 17.898
27 HB2 CYS 5 HB2 CYS 5 31.007 15.669 18.090
28 HB3 CYS 5 HB3 CYS 5 31.205 15.648 16.339
29 H ASN 6 H ASN 6 26.932 15.637 16.967
30 HA ASN 6 HA ASN 6 26.959 16.687 14.190
31 HB2 ASN 6 HB2 ASN 6 25.966 14.402 14.071
32 HB3 ASN 6 HB3 ASN 6 24.791 14.847 15.308
33 HD21 ASN 6 HD22 ASN 6 23.537 13.968 13.244
34 HD22 ASN 6 HD21 ASN 6 23.038 15.254 12.139
35 H LEU 7 H LEU 7 27.002 18.822 14.998
36 HA LEU 7 HA LEU 7 25.745 19.542 17.454
37 HB2 LEU 7 HB2 LEU 7 27.732 20.621 16.592
38 HB3 LEU 7 HB3 LEU 7 26.864 21.211 15.183
39 HG LEU 7 HG LEU 7 25.477 22.678 16.633
40 HD11 LEU 7 HD11 LEU 7 27.248 21.596 18.870
41 HD12 LEU 7 HD12 LEU 7 26.211 23.030 19.000
42 HD13 LEU 7 HD13 LEU 7 25.478 21.447 18.748
43 HD21 LEU 7 HD21 LEU 7 27.252 24.262 17.203
44 HD22 LEU 7 HD22 LEU 7 28.473 22.979 17.094
45 HD23 LEU 7 HD23 LEU 7 27.588 23.500 15.642
46 H ALA 8 H ALA 8 24.654 19.988 14.092
47 HA ALA 8 HA ALA 8 22.335 21.555 14.697
48 HB1 ALA 8 HB1 ALA 8 22.931 19.764 12.309
49 HB2 ALA 8 HB2 ALA 8 21.759 21.099 12.361
50 HB3 ALA 8 HB3 ALA 8 23.496 21.441 12.497
51 H ALA 9 H ALA 9 22.865 18.184 15.210
52 HA ALA 9 HA ALA 9 19.932 17.693 15.529
53 HB1 ALA 9 HB1 ALA 9 20.572 15.338 15.758
54 HB2 ALA 9 HB2 ALA 9 21.190 16.012 14.238
55 HB3 ALA 9 HB3 ALA 9 22.289 15.766 15.616
56 H CYS 10 H CYS 10 22.967 18.033 17.278
57 HA CYS 10 HA CYS 10 22.102 17.077 19.833
58 HB2 CYS 10 HB2 CYS 10 24.450 17.188 19.147
59 HB3 CYS 10 HB3 CYS 10 24.353 18.946 19.016
60 H GLU 11 H GLU 11 22.273 20.422 18.480
61 HA GLU 11 HA GLU 11 21.238 21.851 20.719
62 HB2 GLU 11 HB2 GLU 11 21.069 22.173 17.713
63 HB3 GLU 11 HB3 GLU 11 20.116 23.233 18.744
64 HG2 GLU 11 HG2 GLU 11 23.092 22.925 19.252
65 HG3 GLU 11 HG3 GLU 11 22.491 23.986 17.977
66 H LEU 12 H LEU 12 19.495 19.929 18.253
67 HA LEU 12 HA LEU 12 16.862 20.624 19.169
68 HB2 LEU 12 HB2 LEU 12 17.546 18.043 17.758
69 HB3 LEU 12 HB3 LEU 12 16.064 18.976 17.676
70 HG LEU 12 HG LEU 12 18.747 19.705 16.436
71 HD11 LEU 12 HD11 LEU 12 17.575 19.282 14.312
72 HD12 LEU 12 HD12 LEU 12 17.525 17.841 15.337
73 HD13 LEU 12 HD13 LEU 12 16.088 18.875 15.192
74 HD21 LEU 12 HD21 LEU 12 17.483 21.533 15.300
75 HD22 LEU 12 HD22 LEU 12 16.064 21.151 16.294
76 HD23 LEU 12 HD23 LEU 12 17.547 21.770 17.051
77 H SER 13 H SER 13 19.134 18.087 20.151
78 HA SER 13 HA SER 13 17.232 16.620 21.812
79 HB2 SER 13 HB2 SER 13 20.277 16.581 21.814
80 HB3 SER 13 HB3 SER 13 19.201 15.394 22.578
81 HG SER 13 HG SER 13 20.054 14.857 20.428
82 H CYS 14 H CYS 14 19.837 19.010 22.434
83 HA CYS 14 HA CYS 14 19.419 19.064 25.289
84 HB2 CYS 14 HB2 CYS 14 20.955 20.724 23.292
85 HB3 CYS 14 HB3 CYS 14 20.920 21.162 24.985
86 H ARG 15 H ARG 15 18.149 21.220 22.645
87 HA ARG 15 HA ARG 15 17.186 23.215 24.389
88 HB2 ARG 15 HB2 ARG 15 17.408 23.266 21.815
89 HB3 ARG 15 HB3 ARG 15 15.892 22.400 21.753
90 HG2 ARG 15 HG2 ARG 15 15.422 24.717 21.437
91 HG3 ARG 15 HG3 ARG 15 14.828 24.282 23.032
92 HD2 ARG 15 HD2 ARG 15 15.846 26.356 23.366
93 HD3 ARG 15 HD3 ARG 15 17.077 25.251 23.956
94 HE ARG 15 HE ARG 15 17.102 26.937 21.530
95 HH11 ARG 15 HH11 ARG 15 19.001 24.476 23.268
96 HH12 ARG 15 HH12 ARG 15 20.274 24.618 22.053
97 HH21 ARG 15 HH21 ARG 15 18.970 27.308 20.500
98 HH22 ARG 15 HH22 ARG 15 20.313 26.178 20.632
99 H SER 16 H SER 16 15.630 20.145 23.530
100 HA SER 16 HA SER 16 13.082 20.640 24.683
101 HB2 SER 16 HB2 SER 16 14.631 18.024 24.503
102 HB3 SER 16 HB3 SER 16 12.886 18.192 24.808
103 HG SER 16 HG SER 16 13.231 17.842 22.603
104 H LEU 17 H LEU 17 16.127 20.278 26.311
105 HA LEU 17 HA LEU 17 14.881 19.594 28.915
106 HB2 LEU 17 HB2 LEU 17 17.797 20.199 28.473
107 HB3 LEU 17 HB3 LEU 17 17.054 19.195 29.704
108 HG LEU 17 HG LEU 17 17.395 18.547 26.755
109 HD11 LEU 17 HD11 LEU 17 19.477 18.474 28.046
110 HD12 LEU 17 HD12 LEU 17 18.727 17.374 29.222
111 HD13 LEU 17 HD13 LEU 17 18.979 16.847 27.545
112 HD21 LEU 17 HD21 LEU 17 16.624 16.254 27.338
113 HD22 LEU 17 HD22 LEU 17 16.278 16.787 28.996
114 HD23 LEU 17 HD23 LEU 17 15.342 17.435 27.633
115 H GLY 18 H GLY 18 15.679 22.393 27.122
116 HA2 GLY 18 HA2 GLY 18 14.965 24.544 27.886
117 HA3 GLY 18 HA3 GLY 18 15.438 24.139 29.518
118 H LEU 19 H LEU 19 17.931 23.248 27.300
119 HA LEU 19 HA LEU 19 19.332 25.852 27.632
120 HB2 LEU 19 HB2 LEU 19 21.107 25.017 28.840
121 HB3 LEU 19 HB3 LEU 19 19.691 24.356 29.612
122 HG LEU 19 HG LEU 19 21.946 23.015 28.189
123 HD11 LEU 19 HD11 LEU 19 21.705 21.399 30.029
124 HD12 LEU 19 HD12 LEU 19 21.766 23.046 30.649
125 HD13 LEU 19 HD13 LEU 19 20.209 22.198 30.548
126 HD21 LEU 19 HD21 LEU 19 19.142 21.884 28.116
127 HD22 LEU 19 HD22 LEU 19 20.348 22.019 26.799
128 HD23 LEU 19 HD23 LEU 19 20.558 20.849 28.085
129 H LEU 20 H LEU 20 21.822 25.311 26.791
130 HA LEU 20 HA LEU 20 21.369 24.942 23.890
131 HB2 LEU 20 HB2 LEU 20 23.875 25.990 25.181
132 HB3 LEU 20 HB3 LEU 20 23.375 26.118 23.512
133 HG LEU 20 HG LEU 20 22.081 27.550 25.875
134 HD11 LEU 20 HD11 LEU 20 23.019 29.575 24.863
135 HD12 LEU 20 HD12 LEU 20 24.302 28.426 25.277
136 HD13 LEU 20 HD13 LEU 20 23.781 28.603 23.587
137 HD21 LEU 20 HD21 LEU 20 21.476 27.756 22.894
138 HD22 LEU 20 HD22 LEU 20 20.388 27.112 24.145
139 HD23 LEU 20 HD23 LEU 20 20.832 28.823 24.156
140 H GLY 21 H GLY 21 22.544 23.551 22.597
141 HA2 GLY 21 HA2 GLY 21 23.825 21.247 24.013
142 HA3 GLY 21 HA3 GLY 21 23.074 21.190 22.417
143 H LYS 22 H LYS 22 25.862 20.827 23.811
144 HA LYS 22 HA LYS 22 27.385 21.765 21.373
145 HB2 LYS 22 HB2 LYS 22 28.283 21.973 24.272
146 HB3 LYS 22 HB3 LYS 22 29.372 22.167 22.904
147 HG2 LYS 22 HG2 LYS 22 26.966 23.949 23.454
148 HG3 LYS 22 HG3 LYS 22 28.636 24.305 23.886
149 HD2 LYS 22 HD2 LYS 22 29.283 24.261 21.478
150 HD3 LYS 22 HD3 LYS 22 27.586 23.972 21.040
151 HE2 LYS 22 HE2 LYS 22 26.947 26.066 22.247
152 HE3 LYS 22 HE3 LYS 22 28.658 26.370 22.590
153 HZ1 LYS 22 HZ1 LYS 22 27.892 27.609 20.655
154 HZ2 LYS 22 HZ2 LYS 22 29.015 26.541 20.149
155 HZ3 LYS 22 HZ3 LYS 22 27.413 26.278 19.880
156 H CYS 23 H CYS 23 29.362 20.650 20.870
157 HA CYS 23 HA CYS 23 29.351 17.796 21.635
158 HB2 CYS 23 HB2 CYS 23 30.843 19.356 19.532
159 HB3 CYS 23 HB3 CYS 23 31.124 17.663 19.891
160 H ILE 24 H ILE 24 30.200 17.561 23.641
161 HA ILE 24 HA ILE 24 32.795 18.895 24.353
162 HB ILE 24 HB ILE 24 30.562 18.104 26.230
163 HG12 ILE 24 HG12 ILE 24 29.783 20.005 24.933
164 HG13 ILE 24 HG13 ILE 24 30.110 20.462 26.588
165 HG21 ILE 24 HG21 ILE 24 32.696 17.975 27.352
166 HG22 ILE 24 HG22 ILE 24 33.187 19.560 26.720
167 HG23 ILE 24 HG23 ILE 24 31.864 19.431 27.899
168 HD11 ILE 24 HD11 ILE 24 31.929 21.068 24.217
169 HD12 ILE 24 HD12 ILE 24 30.854 22.206 25.046
170 HD13 ILE 24 HD13 ILE 24 32.243 21.532 25.905
171 H GLY 25 H GLY 25 34.449 17.541 24.542
172 HA2 GLY 25 HA2 GLY 25 35.637 15.545 24.585
173 HA3 GLY 25 HA3 GLY 25 34.322 14.772 25.484
174 H GLU 26 H GLU 26 34.217 16.450 22.391
175 HA GLU 26 HA GLU 26 33.042 16.049 20.530
176 HB2 GLU 26 HB2 GLU 26 34.187 14.613 18.992
177 HB3 GLU 26 HB3 GLU 26 35.221 15.606 19.969
178 HG2 GLU 26 HG2 GLU 26 36.451 13.720 19.916
179 HG3 GLU 26 HG3 GLU 26 35.624 13.497 21.438
180 H GLU 27 H GLU 27 31.448 15.074 22.635
181 HA GLU 27 HA GLU 27 29.561 13.611 20.886
182 HB2 GLU 27 HB2 GLU 27 28.781 12.170 22.603
183 HB3 GLU 27 HB3 GLU 27 30.529 11.984 22.569
184 HG2 GLU 27 HG2 GLU 27 30.675 13.596 24.505
185 HG3 GLU 27 HG3 GLU 27 28.904 13.569 24.599
186 H CYS 28 H CYS 28 27.243 13.990 21.510
187 HA CYS 28 HA CYS 28 26.746 16.718 22.142
188 HB2 CYS 28 HB2 CYS 28 25.266 15.325 20.735
189 HB3 CYS 28 HB3 CYS 28 24.813 14.371 22.146
190 H LYS 29 H LYS 29 26.925 17.642 23.999
191 HA LYS 29 HA LYS 29 25.510 16.661 26.419
192 HB2 LYS 29 HB2 LYS 29 28.453 17.399 26.248
193 HB3 LYS 29 HB3 LYS 29 27.541 17.605 27.745
194 HG2 LYS 29 HG2 LYS 29 26.979 15.220 27.800
195 HG3 LYS 29 HG3 LYS 29 27.844 14.952 26.272
196 HD2 LYS 29 HD2 LYS 29 29.962 15.561 27.261
197 HD3 LYS 29 HD3 LYS 29 29.165 16.057 28.773
198 HE2 LYS 29 HE2 LYS 29 28.439 13.798 29.236
199 HE3 LYS 29 HE3 LYS 29 29.036 13.220 27.675
200 HZ1 LYS 29 HZ1 LYS 29 31.267 13.635 28.374
201 HZ2 LYS 29 HZ2 LYS 29 30.804 14.412 29.743
202 HZ3 LYS 29 HZ3 LYS 29 30.535 12.796 29.592
203 H CYS 30 H CYS 30 24.873 18.402 27.843
204 HA CYS 30 HA CYS 30 24.595 20.901 26.257
205 HB2 CYS 30 HB2 CYS 30 22.851 20.145 28.533
206 HB3 CYS 30 HB3 CYS 30 22.547 21.154 27.121
207 H VAL 31 H VAL 31 24.448 22.959 27.284
208 HA VAL 31 HA VAL 31 26.864 23.240 28.819
209 HB VAL 31 HB VAL 31 26.803 25.581 28.327
210 HG11 VAL 31 HG11 VAL 31 26.832 25.515 25.921
211 HG12 VAL 31 HG12 VAL 31 27.497 24.000 26.542
212 HG13 VAL 31 HG13 VAL 31 25.846 24.039 25.884
213 HG21 VAL 31 HG21 VAL 31 24.962 26.630 27.104
214 HG22 VAL 31 HG22 VAL 31 23.983 25.145 27.300
215 HG23 VAL 31 HG23 VAL 31 24.460 26.106 28.707
216 HA PRO 32 HA PRO 32 25.234 24.451 32.839
217 HB2 PRO 32 HB2 PRO 32 27.495 25.176 34.098
218 HB3 PRO 32 HB3 PRO 32 27.332 23.534 33.425
219 HG2 PRO 32 HG2 PRO 32 28.673 25.936 32.124
220 HG3 PRO 32 HG3 PRO 32 29.353 24.295 32.376
221 HD2 PRO 32 HD2 PRO 32 28.092 25.097 30.034
222 HD3 PRO 32 HD3 PRO 32 28.096 23.405 30.625
223 H TYR 33 H TYR 33 24.566 26.251 30.842
224 HA TYR 33 HA TYR 33 24.810 28.969 32.006
225 HB2 TYR 33 HB2 TYR 33 26.544 28.902 30.333
226 HB3 TYR 33 HB3 TYR 33 25.512 28.086 29.187
227 HD1 TYR 33 HD1 TYR 33 23.742 29.271 27.944
228 HD2 TYR 33 HD2 TYR 33 26.431 31.351 30.592
229 HE1 TYR 33 HE1 TYR 33 23.189 31.422 26.822
230 HE2 TYR 33 HE2 TYR 33 25.871 33.502 29.479
231 HH TYR 33 HH TYR 33 24.663 34.538 27.848