Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
650569 | 6vnz RC | 30719 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 ALA 1 H1 ALA 1 13.007 26.396 36.212
2 H2 ALA 1 H2 ALA 1 12.859 25.802 34.682
3 H3 ALA 1 H3 ALA 1 12.797 27.426 34.942
4 HA ALA 1 HA ALA 1 15.070 27.447 35.698
5 HB1 ALA 1 HB1 ALA 1 15.081 24.530 34.815
6 HB2 ALA 1 HB2 ALA 1 16.478 25.470 35.378
7 HB3 ALA 1 HB3 ALA 1 15.155 25.101 36.498
8 H PHE 2 H PHE 2 16.727 27.992 34.196
9 HA PHE 2 HA PHE 2 15.860 28.041 31.331
10 HB2 PHE 2 HB2 PHE 2 17.837 29.736 32.893
11 HB3 PHE 2 HB3 PHE 2 17.485 29.925 31.194
12 HD1 PHE 2 HD1 PHE 2 16.585 30.976 34.483
13 HD2 PHE 2 HD2 PHE 2 14.993 30.364 30.521
14 HE1 PHE 2 HE1 PHE 2 14.696 32.502 35.003
15 HE2 PHE 2 HE2 PHE 2 13.106 31.882 31.044
16 HZ PHE 2 HZ PHE 2 12.954 32.956 33.288
17 H CYS 3 H CYS 3 17.830 28.132 29.775
18 HA CYS 3 HA CYS 3 19.571 25.773 30.149
19 HB2 CYS 3 HB2 CYS 3 19.481 28.043 28.104
20 HB3 CYS 3 HB3 CYS 3 20.691 26.779 28.104
21 H ASN 4 H ASN 4 21.906 25.918 30.424
22 HA ASN 4 HA ASN 4 22.986 28.410 31.628
23 HB2 ASN 4 HB2 ASN 4 24.398 25.860 30.699
24 HB3 ASN 4 HB3 ASN 4 25.119 27.239 31.499
25 HD21 ASN 4 HD21 ASN 4 23.337 26.430 34.642
26 HD22 ASN 4 HD22 ASN 4 23.834 27.829 33.698
27 H LEU 5 H LEU 5 21.949 29.335 29.514
28 HA LEU 5 HA LEU 5 22.871 28.716 26.964
29 HB2 LEU 5 HB2 LEU 5 20.894 30.327 28.031
30 HB3 LEU 5 HB3 LEU 5 21.936 31.509 27.265
31 HG LEU 5 HG LEU 5 20.724 29.021 25.967
32 HD11 LEU 5 HD11 LEU 5 20.072 31.953 25.482
33 HD12 LEU 5 HD12 LEU 5 19.293 30.555 24.723
34 HD13 LEU 5 HD13 LEU 5 19.088 30.842 26.459
35 HD21 LEU 5 HD21 LEU 5 22.407 31.228 24.734
36 HD22 LEU 5 HD22 LEU 5 22.776 29.490 24.778
37 HD23 LEU 5 HD23 LEU 5 21.439 30.078 23.798
38 H ARG 6 H ARG 6 24.284 31.120 29.206
39 HA ARG 6 HA ARG 6 26.204 32.149 27.243
40 HB2 ARG 6 HB2 ARG 6 26.425 31.989 30.278
41 HB3 ARG 6 HB3 ARG 6 27.482 32.920 29.218
42 HG2 ARG 6 HG2 ARG 6 24.517 33.422 29.714
43 HG3 ARG 6 HG3 ARG 6 25.891 34.342 30.310
44 HD2 ARG 6 HD2 ARG 6 25.147 35.682 28.582
45 HD3 ARG 6 HD3 ARG 6 26.499 34.813 27.874
46 HE ARG 6 HE ARG 6 25.062 33.826 26.349
47 HH11 ARG 6 HH11 ARG 6 22.988 35.093 28.954
48 HH12 ARG 6 HH12 ARG 6 21.562 34.789 27.954
49 HH21 ARG 6 HH21 ARG 6 23.160 33.629 25.225
50 HH22 ARG 6 HH22 ARG 6 21.643 34.001 26.074
51 H ARG 7 H ARG 7 26.344 29.418 29.496
52 HA ARG 7 HA ARG 7 29.097 28.717 28.791
53 HB2 ARG 7 HB2 ARG 7 27.825 28.147 30.979
54 HB3 ARG 7 HB3 ARG 7 27.053 26.857 30.077
55 HG2 ARG 7 HG2 ARG 7 30.055 27.036 29.866
56 HG3 ARG 7 HG3 ARG 7 29.405 26.631 31.458
57 HD2 ARG 7 HD2 ARG 7 28.926 25.093 28.883
58 HD3 ARG 7 HD3 ARG 7 30.026 24.629 30.175
59 HE ARG 7 HE ARG 7 27.155 24.262 30.047
60 HH11 ARG 7 HH11 ARG 7 29.809 24.396 32.442
61 HH12 ARG 7 HH12 ARG 7 28.980 23.163 33.384
62 HH21 ARG 7 HH21 ARG 7 26.178 22.918 31.550
63 HH22 ARG 7 HH22 ARG 7 27.143 22.395 32.917
64 H CYS 8 H CYS 8 25.894 27.572 27.832
65 HA CYS 8 HA CYS 8 26.572 25.605 25.911
66 HB2 CYS 8 HB2 CYS 8 24.376 27.704 25.921
67 HB3 CYS 8 HB3 CYS 8 24.378 26.312 24.884
68 H GLU 9 H GLU 9 26.124 29.141 25.293
69 HA GLU 9 HA GLU 9 27.025 29.163 22.583
70 HB2 GLU 9 HB2 GLU 9 27.148 31.241 24.795
71 HB3 GLU 9 HB3 GLU 9 27.615 31.596 23.136
72 HG2 GLU 9 HG2 GLU 9 25.411 31.345 22.300
73 HG3 GLU 9 HG3 GLU 9 24.845 30.531 23.744
74 H LEU 10 H LEU 10 28.947 29.908 25.559
75 HA LEU 10 HA LEU 10 31.443 30.254 24.279
76 HB2 LEU 10 HB2 LEU 10 30.470 29.673 27.063
77 HB3 LEU 10 HB3 LEU 10 32.141 29.315 26.763
78 HG LEU 10 HG LEU 10 31.652 31.579 27.736
79 HD11 LEU 10 HD11 LEU 10 33.233 31.423 25.160
80 HD12 LEU 10 HD12 LEU 10 33.408 32.682 26.409
81 HD13 LEU 10 HD13 LEU 10 33.811 30.998 26.782
82 HD21 LEU 10 HD21 LEU 10 30.855 32.346 24.903
83 HD22 LEU 10 HD22 LEU 10 29.753 32.276 26.294
84 HD23 LEU 10 HD23 LEU 10 31.091 33.436 26.278
85 H SER 11 H SER 11 30.047 27.216 25.562
86 HA SER 11 HA SER 11 32.280 25.561 24.916
87 HB2 SER 11 HB2 SER 11 29.329 24.779 24.945
88 HB3 SER 11 HB3 SER 11 30.714 23.680 25.079
89 HG SER 11 HG SER 11 29.825 25.665 26.887
90 H CYS 12 H CYS 12 29.792 26.850 22.762
91 HA CYS 12 HA CYS 12 30.752 25.005 20.600
92 HB2 CYS 12 HB2 CYS 12 28.301 26.760 20.635
93 HB3 CYS 12 HB3 CYS 12 28.802 25.617 19.421
94 H ARG 13 H ARG 13 30.926 28.338 21.549
95 HA ARG 13 HA ARG 13 31.549 29.537 19.034
96 HB2 ARG 13 HB2 ARG 13 31.108 30.699 21.210
97 HB3 ARG 13 HB3 ARG 13 32.696 30.168 21.784
98 HG2 ARG 13 HG2 ARG 13 33.750 31.436 19.854
99 HG3 ARG 13 HG3 ARG 13 32.125 31.938 19.353
100 HD2 ARG 13 HD2 ARG 13 33.032 33.742 20.636
101 HD3 ARG 13 HD3 ARG 13 31.827 32.943 21.653
102 HE ARG 13 HE ARG 13 34.514 31.872 22.042
103 HH11 ARG 13 HH11 ARG 13 32.235 34.276 23.206
104 HH12 ARG 13 HH12 ARG 13 33.248 34.723 24.554
105 HH21 ARG 13 HH21 ARG 13 35.808 32.529 23.743
106 HH22 ARG 13 HH22 ARG 13 35.270 33.838 24.771
107 H SER 14 H SER 14 33.606 27.630 21.255
108 HA SER 14 HA SER 14 36.019 27.870 19.729
109 HB2 SER 14 HB2 SER 14 35.026 25.579 21.454
110 HB3 SER 14 HB3 SER 14 36.651 25.702 20.766
111 HG SER 14 HG SER 14 36.580 26.457 22.865
112 H LEU 15 H LEU 15 33.093 26.110 18.978
113 HA LEU 15 HA LEU 15 34.378 24.502 16.839
114 HB2 LEU 15 HB2 LEU 15 31.507 24.441 17.804
115 HB3 LEU 15 HB3 LEU 15 32.314 23.267 16.771
116 HG LEU 15 HG LEU 15 32.896 23.774 19.725
117 HD11 LEU 15 HD11 LEU 15 31.887 21.572 20.073
118 HD12 LEU 15 HD12 LEU 15 30.733 22.668 19.299
119 HD13 LEU 15 HD13 LEU 15 31.550 21.429 18.329
120 HD21 LEU 15 HD21 LEU 15 34.292 21.751 19.617
121 HD22 LEU 15 HD22 LEU 15 34.024 21.649 17.855
122 HD23 LEU 15 HD23 LEU 15 34.935 23.000 18.552
123 H GLY 16 H GLY 16 33.053 27.563 17.151
124 HA2 GLY 16 HA2 GLY 16 32.624 29.144 15.518
125 HA3 GLY 16 HA3 GLY 16 32.745 27.903 14.269
126 H LEU 17 H LEU 17 30.475 27.798 17.036
127 HA LEU 17 HA LEU 17 28.181 27.977 15.108
128 HB2 LEU 17 HB2 LEU 17 28.129 26.486 17.710
129 HB3 LEU 17 HB3 LEU 17 27.051 26.311 16.356
130 HG LEU 17 HG LEU 17 29.908 25.387 16.538
131 HD11 LEU 17 HD11 LEU 17 27.308 23.834 16.539
132 HD12 LEU 17 HD12 LEU 17 28.911 23.104 16.341
133 HD13 LEU 17 HD13 LEU 17 28.535 23.955 17.828
134 HD21 LEU 17 HD21 LEU 17 27.913 24.820 14.287
135 HD22 LEU 17 HD22 LEU 17 29.246 25.984 14.143
136 HD23 LEU 17 HD23 LEU 17 29.597 24.275 14.368
137 H LEU 18 H LEU 18 26.115 28.597 16.030
138 HA LEU 18 HA LEU 18 26.230 30.612 18.252
139 HB2 LEU 18 HB2 LEU 18 24.235 30.166 16.008
140 HB3 LEU 18 HB3 LEU 18 23.988 31.300 17.338
141 HG LEU 18 HG LEU 18 26.300 31.443 15.369
142 HD11 LEU 18 HD11 LEU 18 24.141 31.831 14.249
143 HD12 LEU 18 HD12 LEU 18 23.723 33.057 15.464
144 HD13 LEU 18 HD13 LEU 18 25.085 33.323 14.353
145 HD21 LEU 18 HD21 LEU 18 26.537 33.769 16.221
146 HD22 LEU 18 HD22 LEU 18 25.294 33.440 17.442
147 HD23 LEU 18 HD23 LEU 18 26.846 32.575 17.484
148 H GLY 19 H GLY 19 25.744 29.721 20.168
149 HA2 GLY 19 HA2 GLY 19 23.976 27.430 20.507
150 HA3 GLY 19 HA3 GLY 19 24.675 28.397 21.774
151 H ALA 20 H ALA 20 21.912 27.268 21.002
152 HA ALA 20 HA ALA 20 20.268 29.539 21.944
153 HB1 ALA 20 HB1 ALA 20 20.024 29.288 19.491
154 HB2 ALA 20 HB2 ALA 20 19.622 27.569 19.720
155 HB3 ALA 20 HB3 ALA 20 18.536 28.822 20.333
156 H CYS 21 H CYS 21 18.012 28.463 22.429
157 HA CYS 21 HA CYS 21 18.389 26.062 24.187
158 HB2 CYS 21 HB2 CYS 21 18.776 28.190 25.383
159 HB3 CYS 21 HB3 CYS 21 17.157 28.723 24.938
160 H ILE 22 H ILE 22 16.689 24.739 24.582
161 HA ILE 22 HA ILE 22 13.938 25.518 23.716
162 HB ILE 22 HB ILE 22 15.191 22.790 23.312
163 HG12 ILE 22 HG12 ILE 22 14.007 24.791 21.324
164 HG13 ILE 22 HG13 ILE 22 15.723 24.505 21.585
165 HG21 ILE 22 HG21 ILE 22 12.989 22.077 22.457
166 HG22 ILE 22 HG22 ILE 22 12.851 22.556 24.131
167 HG23 ILE 22 HG23 ILE 22 12.300 23.668 22.854
168 HD11 ILE 22 HD11 ILE 22 15.429 22.132 20.854
169 HD12 ILE 22 HD12 ILE 22 13.754 22.536 20.396
170 HD13 ILE 22 HD13 ILE 22 15.109 23.354 19.611
171 H GLY 23 H GLY 23 12.842 25.818 25.553
172 HA2 GLY 23 HA2 GLY 23 11.995 25.499 27.690
173 HA3 GLY 23 HA3 GLY 23 12.597 23.837 27.665
174 H GLU 24 H GLU 24 14.485 23.366 28.618
175 HA GLU 24 HA GLU 24 16.312 25.507 29.593
176 HB2 GLU 24 HB2 GLU 24 16.547 24.511 31.710
177 HB3 GLU 24 HB3 GLU 24 14.810 24.471 31.397
178 HG2 GLU 24 HG2 GLU 24 15.181 22.079 30.519
179 HG3 GLU 24 HG3 GLU 24 16.805 22.173 31.183
180 H GLU 25 H GLU 25 16.169 23.202 27.335
181 HA GLU 25 HA GLU 25 18.874 22.078 27.870
182 HB2 GLU 25 HB2 GLU 25 16.643 21.018 26.097
183 HB3 GLU 25 HB3 GLU 25 18.254 20.312 26.234
184 HG2 GLU 25 HG2 GLU 25 16.124 20.473 28.400
185 HG3 GLU 25 HG3 GLU 25 16.710 19.044 27.590
186 H CYS 26 H CYS 26 20.541 22.724 26.580
187 HA CYS 26 HA CYS 26 19.837 24.547 24.353
188 HB2 CYS 26 HB2 CYS 26 21.972 25.538 24.645
189 HB3 CYS 26 HB3 CYS 26 21.108 25.457 26.167
190 H LYS 27 H LYS 27 20.692 24.614 22.396
191 HA LYS 27 HA LYS 27 22.683 22.599 21.493
192 HB2 LYS 27 HB2 LYS 27 19.978 22.984 20.143
193 HB3 LYS 27 HB3 LYS 27 21.368 22.203 19.382
194 HG2 LYS 27 HG2 LYS 27 21.368 20.423 20.968
195 HG3 LYS 27 HG3 LYS 27 20.057 21.180 21.908
196 HD2 LYS 27 HD2 LYS 27 18.491 20.980 20.085
197 HD3 LYS 27 HD3 LYS 27 19.770 20.448 18.965
198 HE2 LYS 27 HE2 LYS 27 20.205 18.493 20.370
199 HE3 LYS 27 HE3 LYS 27 18.932 18.998 21.496
200 HZ1 LYS 27 HZ1 LYS 27 18.140 17.328 19.902
201 HZ2 LYS 27 HZ2 LYS 27 17.318 18.733 19.717
202 HZ3 LYS 27 HZ3 LYS 27 18.499 18.303 18.632
203 H CYS 28 H CYS 28 23.990 23.265 19.881
204 HA CYS 28 HA CYS 28 23.739 26.079 18.929
205 HB2 CYS 28 HB2 CYS 28 26.220 26.062 18.902
206 HB3 CYS 28 HB3 CYS 28 25.511 25.875 20.511
207 H VAL 29 H VAL 29 24.489 26.573 16.798
208 HA VAL 29 HA VAL 29 24.716 24.348 14.853
209 HB VAL 29 HB VAL 29 22.891 25.348 13.462
210 HG11 VAL 29 HG11 VAL 29 22.497 23.334 14.876
211 HG12 VAL 29 HG12 VAL 29 21.891 24.396 16.168
212 HG13 VAL 29 HG13 VAL 29 21.045 24.314 14.612
213 HG21 VAL 29 HG21 VAL 29 22.117 26.840 15.992
214 HG22 VAL 29 HG22 VAL 29 22.799 27.583 14.526
215 HG23 VAL 29 HG23 VAL 29 21.218 26.795 14.466
216 HA PRO 30 HA PRO 30 27.316 27.265 12.785
217 HB2 PRO 30 HB2 PRO 30 27.433 26.335 10.231
218 HB3 PRO 30 HB3 PRO 30 28.101 25.441 11.625
219 HG2 PRO 30 HG2 PRO 30 25.407 25.042 10.288
220 HG3 PRO 30 HG3 PRO 30 26.631 23.809 10.712
221 HD2 PRO 30 HD2 PRO 30 24.500 24.347 12.320
222 HD3 PRO 30 HD3 PRO 30 26.094 23.903 12.995
223 H TYR 31 H TYR 31 27.447 29.007 11.340
224 HA TYR 31 HA TYR 31 25.359 30.780 11.545
225 HB2 TYR 31 HB2 TYR 31 27.557 31.003 9.474
226 HB3 TYR 31 HB3 TYR 31 26.698 32.315 10.252
227 HD1 TYR 31 HD1 TYR 31 29.748 31.903 10.025
228 HD2 TYR 31 HD2 TYR 31 26.897 31.057 13.153
229 HE1 TYR 31 HE1 TYR 31 31.562 32.027 11.729
230 HE2 TYR 31 HE2 TYR 31 28.707 31.183 14.837
231 HH TYR 31 HH TYR 31 30.925 31.514 15.226
Start of MODEL 2
1 H1 ALA 1 H1 ALA 1 18.155 22.541 39.034
2 H2 ALA 1 H2 ALA 1 19.575 22.190 39.796
3 H3 ALA 1 H3 ALA 1 19.283 21.624 38.278
4 HA ALA 1 HA ALA 1 19.519 24.466 38.997
5 HB1 ALA 1 HB1 ALA 1 21.696 23.329 39.239
6 HB2 ALA 1 HB2 ALA 1 21.555 22.692 37.585
7 HB3 ALA 1 HB3 ALA 1 21.706 24.441 37.859
8 H PHE 2 H PHE 2 19.522 25.945 37.170
9 HA PHE 2 HA PHE 2 17.822 24.956 34.932
10 HB2 PHE 2 HB2 PHE 2 18.466 27.778 35.843
11 HB3 PHE 2 HB3 PHE 2 17.348 27.334 34.557
12 HD1 PHE 2 HD1 PHE 2 15.251 26.007 35.103
13 HD2 PHE 2 HD2 PHE 2 17.761 27.705 38.172
14 HE1 PHE 2 HE1 PHE 2 13.420 25.740 36.755
15 HE2 PHE 2 HE2 PHE 2 15.922 27.446 39.815
16 HZ PHE 2 HZ PHE 2 13.749 26.458 39.115
17 H CYS 3 H CYS 3 18.217 25.759 32.717
18 HA CYS 3 HA CYS 3 20.868 25.172 31.835
19 HB2 CYS 3 HB2 CYS 3 18.723 24.873 30.571
20 HB3 CYS 3 HB3 CYS 3 18.685 26.620 30.299
21 H ASN 4 H ASN 4 22.431 26.509 30.694
22 HA ASN 4 HA ASN 4 22.346 29.414 31.344
23 HB2 ASN 4 HB2 ASN 4 23.997 27.975 32.742
24 HB3 ASN 4 HB3 ASN 4 24.882 27.802 31.238
25 HD21 ASN 4 HD21 ASN 4 24.645 31.495 32.980
26 HD22 ASN 4 HD22 ASN 4 23.447 30.256 33.378
27 H LEU 5 H LEU 5 21.941 30.314 29.568
28 HA LEU 5 HA LEU 5 22.492 29.481 26.887
29 HB2 LEU 5 HB2 LEU 5 20.704 31.032 27.474
30 HB3 LEU 5 HB3 LEU 5 21.860 32.213 28.068
31 HG LEU 5 HG LEU 5 22.750 32.558 25.807
32 HD11 LEU 5 HD11 LEU 5 22.382 30.359 24.775
33 HD12 LEU 5 HD12 LEU 5 20.617 30.566 24.942
34 HD13 LEU 5 HD13 LEU 5 21.550 31.607 23.850
35 HD21 LEU 5 HD21 LEU 5 20.748 33.626 24.845
36 HD22 LEU 5 HD22 LEU 5 19.706 32.707 25.943
37 HD23 LEU 5 HD23 LEU 5 20.841 33.916 26.589
38 H ARG 6 H ARG 6 24.285 31.699 29.076
39 HA ARG 6 HA ARG 6 26.311 32.453 27.151
40 HB2 ARG 6 HB2 ARG 6 26.505 32.263 30.194
41 HB3 ARG 6 HB3 ARG 6 27.680 33.043 29.151
42 HG2 ARG 6 HG2 ARG 6 24.789 33.956 29.522
43 HG3 ARG 6 HG3 ARG 6 26.210 34.623 30.311
44 HD2 ARG 6 HD2 ARG 6 25.902 36.129 28.599
45 HD3 ARG 6 HD3 ARG 6 27.124 35.065 27.925
46 HE ARG 6 HE ARG 6 25.559 34.247 26.343
47 HH11 ARG 6 HH11 ARG 6 23.796 36.344 28.574
48 HH12 ARG 6 HH12 ARG 6 22.582 36.693 27.356
49 HH21 ARG 6 HH21 ARG 6 24.067 34.676 24.972
50 HH22 ARG 6 HH22 ARG 6 22.678 35.703 25.336
51 H ARG 7 H ARG 7 26.301 29.771 29.548
52 HA ARG 7 HA ARG 7 28.796 28.674 28.686
53 HB2 ARG 7 HB2 ARG 7 27.472 28.089 30.804
54 HB3 ARG 7 HB3 ARG 7 26.427 27.102 29.780
55 HG2 ARG 7 HG2 ARG 7 28.068 25.737 30.902
56 HG3 ARG 7 HG3 ARG 7 28.361 25.673 29.165
57 HD2 ARG 7 HD2 ARG 7 29.825 27.722 30.827
58 HD3 ARG 7 HD3 ARG 7 30.325 26.031 30.959
59 HE ARG 7 HE ARG 7 30.360 26.218 28.324
60 HH11 ARG 7 HH11 ARG 7 31.600 28.758 30.459
61 HH12 ARG 7 HH12 ARG 7 32.785 29.256 29.270
62 HH21 ARG 7 HH21 ARG 7 32.176 26.560 27.217
63 HH22 ARG 7 HH22 ARG 7 33.197 27.937 27.535
64 H CYS 8 H CYS 8 25.469 27.900 27.643
65 HA CYS 8 HA CYS 8 26.083 25.944 25.713
66 HB2 CYS 8 HB2 CYS 8 23.848 26.483 26.589
67 HB3 CYS 8 HB3 CYS 8 23.894 28.056 25.805
68 H GLU 9 H GLU 9 25.996 29.512 25.208
69 HA GLU 9 HA GLU 9 26.745 29.387 22.427
70 HB2 GLU 9 HB2 GLU 9 27.075 31.529 24.587
71 HB3 GLU 9 HB3 GLU 9 27.590 31.783 22.919
72 HG2 GLU 9 HG2 GLU 9 25.349 31.505 22.083
73 HG3 GLU 9 HG3 GLU 9 24.732 31.078 23.675
74 H LEU 10 H LEU 10 28.796 29.846 25.389
75 HA LEU 10 HA LEU 10 31.203 30.006 23.806
76 HB2 LEU 10 HB2 LEU 10 30.521 30.090 26.716
77 HB3 LEU 10 HB3 LEU 10 32.167 29.725 26.289
78 HG LEU 10 HG LEU 10 31.649 32.146 26.720
79 HD11 LEU 10 HD11 LEU 10 33.725 31.397 25.653
80 HD12 LEU 10 HD12 LEU 10 32.928 31.467 24.071
81 HD13 LEU 10 HD13 LEU 10 33.177 32.958 24.995
82 HD21 LEU 10 HD21 LEU 10 30.558 32.177 23.899
83 HD22 LEU 10 HD22 LEU 10 29.551 32.340 25.367
84 HD23 LEU 10 HD23 LEU 10 30.796 33.560 24.971
85 H SER 11 H SER 11 29.726 27.225 25.488
86 HA SER 11 HA SER 11 31.949 25.432 25.036
87 HB2 SER 11 HB2 SER 11 28.968 24.920 25.384
88 HB3 SER 11 HB3 SER 11 30.208 23.652 25.335
89 HG SER 11 HG SER 11 31.198 24.547 27.131
90 H CYS 12 H CYS 12 29.682 26.799 22.815
91 HA CYS 12 HA CYS 12 30.546 24.881 20.694
92 HB2 CYS 12 HB2 CYS 12 28.264 26.879 20.650
93 HB3 CYS 12 HB3 CYS 12 28.706 25.736 19.433
94 H ARG 13 H ARG 13 31.187 28.040 21.803
95 HA ARG 13 HA ARG 13 31.987 29.420 19.438
96 HB2 ARG 13 HB2 ARG 13 31.890 30.294 21.819
97 HB3 ARG 13 HB3 ARG 13 33.369 29.409 22.166
98 HG2 ARG 13 HG2 ARG 13 33.840 31.749 21.805
99 HG3 ARG 13 HG3 ARG 13 34.613 30.780 20.551
100 HD2 ARG 13 HD2 ARG 13 33.547 32.923 19.750
101 HD3 ARG 13 HD3 ARG 13 33.011 31.476 18.902
102 HE ARG 13 HE ARG 13 30.877 31.635 19.913
103 HH11 ARG 13 HH11 ARG 13 32.826 34.338 21.161
104 HH12 ARG 13 HH12 ARG 13 31.377 35.094 21.776
105 HH21 ARG 13 HH21 ARG 13 29.274 32.562 20.784
106 HH22 ARG 13 HH22 ARG 13 29.426 34.113 21.622
107 H SER 14 H SER 14 33.598 26.905 21.301
108 HA SER 14 HA SER 14 36.083 26.759 19.865
109 HB2 SER 14 HB2 SER 14 36.212 24.550 20.945
110 HB3 SER 14 HB3 SER 14 35.699 25.792 22.110
111 HG SER 14 HG SER 14 34.496 23.604 21.762
112 H LEU 15 H LEU 15 32.902 25.800 18.932
113 HA LEU 15 HA LEU 15 33.913 24.131 16.669
114 HB2 LEU 15 HB2 LEU 15 31.119 24.287 17.845
115 HB3 LEU 15 HB3 LEU 15 31.677 23.173 16.596
116 HG LEU 15 HG LEU 15 32.531 23.220 19.523
117 HD11 LEU 15 HD11 LEU 15 31.305 21.096 19.664
118 HD12 LEU 15 HD12 LEU 15 30.236 22.418 19.162
119 HD13 LEU 15 HD13 LEU 15 30.824 21.247 17.957
120 HD21 LEU 15 HD21 LEU 15 34.375 22.383 18.073
121 HD22 LEU 15 HD22 LEU 15 33.681 21.108 19.077
122 HD23 LEU 15 HD23 LEU 15 33.257 21.205 17.354
123 H GLY 16 H GLY 16 33.027 27.248 17.360
124 HA2 GLY 16 HA2 GLY 16 32.556 29.074 16.060
125 HA3 GLY 16 HA3 GLY 16 32.793 28.076 14.623
126 H LEU 17 H LEU 17 30.361 27.779 17.252
127 HA LEU 17 HA LEU 17 28.160 28.137 15.256
128 HB2 LEU 17 HB2 LEU 17 27.929 26.373 17.671
129 HB3 LEU 17 HB3 LEU 17 26.954 26.352 16.236
130 HG LEU 17 HG LEU 17 29.772 25.392 16.510
131 HD11 LEU 17 HD11 LEU 17 27.188 23.836 16.303
132 HD12 LEU 17 HD12 LEU 17 28.810 23.122 16.172
133 HD13 LEU 17 HD13 LEU 17 28.330 23.905 17.672
134 HD21 LEU 17 HD21 LEU 17 27.853 24.983 14.163
135 HD22 LEU 17 HD22 LEU 17 29.226 26.110 14.132
136 HD23 LEU 17 HD23 LEU 17 29.516 24.375 14.265
137 H LEU 18 H LEU 18 26.263 29.104 15.931
138 HA LEU 18 HA LEU 18 26.254 30.798 18.359
139 HB2 LEU 18 HB2 LEU 18 24.199 30.343 16.152
140 HB3 LEU 18 HB3 LEU 18 24.027 31.501 17.471
141 HG LEU 18 HG LEU 18 26.197 31.586 15.336
142 HD11 LEU 18 HD11 LEU 18 24.947 33.495 14.445
143 HD12 LEU 18 HD12 LEU 18 23.952 32.032 14.431
144 HD13 LEU 18 HD13 LEU 18 23.691 33.274 15.679
145 HD21 LEU 18 HD21 LEU 18 25.440 33.594 17.508
146 HD22 LEU 18 HD22 LEU 18 26.968 32.689 17.397
147 HD23 LEU 18 HD23 LEU 18 26.571 33.904 16.180
148 H GLY 19 H GLY 19 25.696 29.880 20.239
149 HA2 GLY 19 HA2 GLY 19 23.867 27.572 20.336
150 HA3 GLY 19 HA3 GLY 19 24.756 28.219 21.685
151 H ALA 20 H ALA 20 21.951 27.453 21.195
152 HA ALA 20 HA ALA 20 20.724 29.636 22.742
153 HB1 ALA 20 HB1 ALA 20 18.625 29.444 21.438
154 HB2 ALA 20 HB2 ALA 20 19.964 30.037 20.439
155 HB3 ALA 20 HB3 ALA 20 19.433 28.348 20.299
156 H CYS 21 H CYS 21 19.538 28.808 24.457
157 HA CYS 21 HA CYS 21 19.258 25.843 24.616
158 HB2 CYS 21 HB2 CYS 21 20.534 26.999 26.404
159 HB3 CYS 21 HB3 CYS 21 19.038 27.781 26.921
160 H ILE 22 H ILE 22 17.387 24.822 24.810
161 HA ILE 22 HA ILE 22 14.846 26.393 24.602
162 HB ILE 22 HB ILE 22 15.698 24.045 22.909
163 HG12 ILE 22 HG12 ILE 22 15.080 26.942 22.178
164 HG13 ILE 22 HG13 ILE 22 16.689 26.217 22.220
165 HG21 ILE 22 HG21 ILE 22 13.267 23.951 23.563
166 HG22 ILE 22 HG22 ILE 22 13.055 25.548 22.815
167 HG23 ILE 22 HG23 ILE 22 13.524 24.142 21.840
168 HD11 ILE 22 HD11 ILE 22 14.473 25.507 20.275
169 HD12 ILE 22 HD12 ILE 22 15.996 26.345 19.949
170 HD13 ILE 22 HD13 ILE 22 16.021 24.630 20.419
171 H GLY 23 H GLY 23 13.656 25.989 26.283
172 HA2 GLY 23 HA2 GLY 23 12.655 24.952 28.088
173 HA3 GLY 23 HA3 GLY 23 13.139 23.378 27.442
174 H GLU 24 H GLU 24 14.958 22.424 28.251
175 HA GLU 24 HA GLU 24 16.842 24.004 29.940
176 HB2 GLU 24 HB2 GLU 24 17.021 22.255 31.541
177 HB3 GLU 24 HB3 GLU 24 15.316 22.662 31.333
178 HG2 GLU 24 HG2 GLU 24 15.107 20.674 29.783
179 HG3 GLU 24 HG3 GLU 24 16.772 20.255 30.153
180 H GLU 25 H GLU 25 16.651 22.440 27.071
181 HA GLU 25 HA GLU 25 19.300 21.094 27.294
182 HB2 GLU 25 HB2 GLU 25 17.403 19.686 26.644
183 HB3 GLU 25 HB3 GLU 25 17.122 20.716 25.237
184 HG2 GLU 25 HG2 GLU 25 19.366 20.124 24.361
185 HG3 GLU 25 HG3 GLU 25 19.675 19.168 25.810
186 H CYS 26 H CYS 26 21.003 22.025 26.375
187 HA CYS 26 HA CYS 26 20.839 24.429 24.745
188 HB2 CYS 26 HB2 CYS 26 22.636 24.185 26.327
189 HB3 CYS 26 HB3 CYS 26 23.083 22.616 25.661
190 H LYS 27 H LYS 27 21.248 24.709 22.571
191 HA LYS 27 HA LYS 27 22.377 22.519 20.986
192 HB2 LYS 27 HB2 LYS 27 20.725 22.598 19.213
193 HB3 LYS 27 HB3 LYS 27 19.976 22.153 20.727
194 HG2 LYS 27 HG2 LYS 27 18.454 23.502 19.666
195 HG3 LYS 27 HG3 LYS 27 19.125 24.555 20.911
196 HD2 LYS 27 HD2 LYS 27 20.301 25.864 19.317
197 HD3 LYS 27 HD3 LYS 27 20.321 24.551 18.115
198 HE2 LYS 27 HE2 LYS 27 17.796 24.760 18.042
199 HE3 LYS 27 HE3 LYS 27 17.976 26.288 18.933
200 HZ1 LYS 27 HZ1 LYS 27 19.556 26.935 17.083
201 HZ2 LYS 27 HZ2 LYS 27 19.041 25.582 16.269
202 HZ3 LYS 27 HZ3 LYS 27 17.985 26.798 16.587
203 H CYS 28 H CYS 28 23.495 23.275 19.085
204 HA CYS 28 HA CYS 28 23.603 26.198 18.681
205 HB2 CYS 28 HB2 CYS 28 26.065 26.197 18.812
206 HB3 CYS 28 HB3 CYS 28 25.260 25.964 20.352
207 H VAL 29 H VAL 29 24.386 26.886 16.671
208 HA VAL 29 HA VAL 29 24.680 24.835 14.546
209 HB VAL 29 HB VAL 29 22.964 25.752 13.182
210 HG11 VAL 29 HG11 VAL 29 21.743 25.436 15.944
211 HG12 VAL 29 HG12 VAL 29 20.968 25.179 14.365
212 HG13 VAL 29 HG13 VAL 29 22.260 24.089 14.899
213 HG21 VAL 29 HG21 VAL 29 21.400 27.535 13.988
214 HG22 VAL 29 HG22 VAL 29 22.518 27.847 15.333
215 HG23 VAL 29 HG23 VAL 29 23.034 28.118 13.658
216 HA PRO 30 HA PRO 30 27.686 27.533 12.868
217 HB2 PRO 30 HB2 PRO 30 26.503 27.153 10.127
218 HB3 PRO 30 HB3 PRO 30 28.196 26.954 10.670
219 HG2 PRO 30 HG2 PRO 30 26.625 24.785 10.255
220 HG3 PRO 30 HG3 PRO 30 27.698 24.854 11.691
221 HD2 PRO 30 HD2 PRO 30 24.735 25.458 11.530
222 HD3 PRO 30 HD3 PRO 30 25.628 24.471 12.726
223 H TYR 31 H TYR 31 28.161 29.601 11.917
224 HA TYR 31 HA TYR 31 26.270 31.684 12.333
225 HB2 TYR 31 HB2 TYR 31 28.777 31.777 10.616
226 HB3 TYR 31 HB3 TYR 31 27.946 33.132 11.353
227 HD1 TYR 31 HD1 TYR 31 30.722 30.996 11.672
228 HD2 TYR 31 HD2 TYR 31 27.712 33.007 14.015
229 HE1 TYR 31 HE1 TYR 31 32.231 30.938 13.661
230 HE2 TYR 31 HE2 TYR 31 29.205 32.900 16.018
231 HH TYR 31 HH TYR 31 32.531 31.580 15.838
Start of MODEL 3
1 H1 ALA 1 H1 ALA 1 14.232 22.888 36.786
2 H2 ALA 1 H2 ALA 1 14.708 21.362 37.205
3 H3 ALA 1 H3 ALA 1 14.263 21.696 35.654
4 HA ALA 1 HA ALA 1 16.558 22.903 37.018
5 HB1 ALA 1 HB1 ALA 1 16.496 20.636 34.981
6 HB2 ALA 1 HB2 ALA 1 17.963 21.472 35.533
7 HB3 ALA 1 HB3 ALA 1 17.007 20.532 36.684
8 H PHE 2 H PHE 2 17.983 24.075 35.596
9 HA PHE 2 HA PHE 2 16.591 25.333 33.251
10 HB2 PHE 2 HB2 PHE 2 18.735 26.442 35.097
11 HB3 PHE 2 HB3 PHE 2 17.947 27.315 33.798
12 HD1 PHE 2 HD1 PHE 2 18.002 26.991 37.246
13 HD2 PHE 2 HD2 PHE 2 15.200 27.201 33.974
14 HE1 PHE 2 HE1 PHE 2 16.266 27.829 38.791
15 HE2 PHE 2 HE2 PHE 2 13.459 28.050 35.524
16 HZ PHE 2 HZ PHE 2 14.001 28.405 37.926
17 H CYS 3 H CYS 3 18.051 26.265 31.610
18 HA CYS 3 HA CYS 3 20.594 24.749 31.177
19 HB2 CYS 3 HB2 CYS 3 20.367 25.492 28.808
20 HB3 CYS 3 HB3 CYS 3 19.219 24.312 29.353
21 H ASN 4 H ASN 4 22.173 26.270 29.845
22 HA ASN 4 HA ASN 4 22.160 29.036 30.908
23 HB2 ASN 4 HB2 ASN 4 23.744 27.409 32.203
24 HB3 ASN 4 HB3 ASN 4 24.651 27.360 30.719
25 HD21 ASN 4 HD21 ASN 4 24.392 30.799 32.893
26 HD22 ASN 4 HD22 ASN 4 23.545 29.320 33.355
27 H LEU 5 H LEU 5 21.928 30.220 29.292
28 HA LEU 5 HA LEU 5 22.475 29.680 26.563
29 HB2 LEU 5 HB2 LEU 5 20.871 31.374 27.331
30 HB3 LEU 5 HB3 LEU 5 22.173 32.319 28.051
31 HG LEU 5 HG LEU 5 23.130 32.763 25.818
32 HD11 LEU 5 HD11 LEU 5 22.411 30.765 24.572
33 HD12 LEU 5 HD12 LEU 5 20.701 31.233 24.782
34 HD13 LEU 5 HD13 LEU 5 21.796 32.212 23.786
35 HD21 LEU 5 HD21 LEU 5 21.347 34.257 25.024
36 HD22 LEU 5 HD22 LEU 5 20.155 33.393 26.022
37 HD23 LEU 5 HD23 LEU 5 21.473 34.309 26.786
38 H ARG 6 H ARG 6 24.597 31.360 28.996
39 HA ARG 6 HA ARG 6 26.502 32.038 26.876
40 HB2 ARG 6 HB2 ARG 6 27.963 32.792 28.668
41 HB3 ARG 6 HB3 ARG 6 26.399 33.607 28.595
42 HG2 ARG 6 HG2 ARG 6 25.614 32.348 30.551
43 HG3 ARG 6 HG3 ARG 6 27.163 31.478 30.631
44 HD2 ARG 6 HD2 ARG 6 26.813 34.488 30.919
45 HD3 ARG 6 HD3 ARG 6 27.014 33.340 32.254
46 HE ARG 6 HE ARG 6 29.147 32.808 30.574
47 HH11 ARG 6 HH11 ARG 6 28.134 35.662 32.375
48 HH12 ARG 6 HH12 ARG 6 29.708 36.410 32.268
49 HH21 ARG 6 HH21 ARG 6 31.216 33.723 30.706
50 HH22 ARG 6 HH22 ARG 6 31.408 35.255 31.535
51 H ARG 7 H ARG 7 26.409 29.484 29.400
52 HA ARG 7 HA ARG 7 28.853 28.209 28.551
53 HB2 ARG 7 HB2 ARG 7 27.526 27.521 30.576
54 HB3 ARG 7 HB3 ARG 7 26.295 26.857 29.493
55 HG2 ARG 7 HG2 ARG 7 27.752 25.199 28.605
56 HG3 ARG 7 HG3 ARG 7 29.182 25.908 29.361
57 HD2 ARG 7 HD2 ARG 7 26.814 24.867 30.961
58 HD3 ARG 7 HD3 ARG 7 28.140 23.824 30.440
59 HE ARG 7 HE ARG 7 29.406 25.968 31.688
60 HH11 ARG 7 HH11 ARG 7 27.006 23.565 32.771
61 HH12 ARG 7 HH12 ARG 7 27.536 23.779 34.435
62 HH21 ARG 7 HH21 ARG 7 30.143 25.826 33.851
63 HH22 ARG 7 HH22 ARG 7 29.111 24.959 34.982
64 H CYS 8 H CYS 8 25.520 27.828 27.284
65 HA CYS 8 HA CYS 8 26.196 25.798 25.411
66 HB2 CYS 8 HB2 CYS 8 23.913 26.405 26.315
67 HB3 CYS 8 HB3 CYS 8 23.939 27.849 25.300
68 H GLU 9 H GLU 9 26.200 29.351 25.053
69 HA GLU 9 HA GLU 9 27.009 29.327 22.262
70 HB2 GLU 9 HB2 GLU 9 27.193 31.344 24.537
71 HB3 GLU 9 HB3 GLU 9 27.829 31.703 22.942
72 HG2 GLU 9 HG2 GLU 9 24.992 30.704 23.039
73 HG3 GLU 9 HG3 GLU 9 25.302 32.279 23.760
74 H LEU 10 H LEU 10 28.959 29.920 25.268
75 HA LEU 10 HA LEU 10 31.364 30.165 23.727
76 HB2 LEU 10 HB2 LEU 10 30.713 30.073 26.675
77 HB3 LEU 10 HB3 LEU 10 32.379 29.956 26.165
78 HG LEU 10 HG LEU 10 31.756 32.229 26.806
79 HD11 LEU 10 HD11 LEU 10 32.441 32.057 23.847
80 HD12 LEU 10 HD12 LEU 10 32.801 33.388 24.958
81 HD13 LEU 10 HD13 LEU 10 33.589 31.822 25.185
82 HD21 LEU 10 HD21 LEU 10 30.007 32.331 24.315
83 HD22 LEU 10 HD22 LEU 10 29.423 32.332 25.997
84 HD23 LEU 10 HD23 LEU 10 30.403 33.675 25.399
85 H SER 11 H SER 11 29.976 27.308 25.338
86 HA SER 11 HA SER 11 32.348 25.676 25.019
87 HB2 SER 11 HB2 SER 11 30.845 23.763 25.245
88 HB3 SER 11 HB3 SER 11 30.510 24.988 26.482
89 HG SER 11 HG SER 11 28.725 25.602 25.469
90 H CYS 12 H CYS 12 29.679 26.539 22.838
91 HA CYS 12 HA CYS 12 30.678 24.734 20.723
92 HB2 CYS 12 HB2 CYS 12 28.310 26.625 20.843
93 HB3 CYS 12 HB3 CYS 12 28.697 25.516 19.547
94 H ARG 13 H ARG 13 30.948 28.134 21.548
95 HA ARG 13 HA ARG 13 31.788 29.167 19.038
96 HB2 ARG 13 HB2 ARG 13 31.209 30.414 21.174
97 HB3 ARG 13 HB3 ARG 13 32.842 30.048 21.753
98 HG2 ARG 13 HG2 ARG 13 33.817 31.243 19.836
99 HG3 ARG 13 HG3 ARG 13 32.224 31.468 19.113
100 HD2 ARG 13 HD2 ARG 13 33.193 32.667 21.738
101 HD3 ARG 13 HD3 ARG 13 33.071 33.502 20.181
102 HE ARG 13 HE ARG 13 30.495 32.588 20.624
103 HH11 ARG 13 HH11 ARG 13 32.700 34.786 22.342
104 HH12 ARG 13 HH12 ARG 13 31.331 35.723 22.936
105 HH21 ARG 13 HH21 ARG 13 28.898 34.037 21.337
106 HH22 ARG 13 HH22 ARG 13 29.357 35.275 22.478
107 H SER 14 H SER 14 33.469 27.007 21.196
108 HA SER 14 HA SER 14 36.132 27.276 20.198
109 HB2 SER 14 HB2 SER 14 36.461 24.982 20.930
110 HB3 SER 14 HB3 SER 14 35.569 25.883 22.159
111 HG SER 14 HG SER 14 33.805 24.695 21.776
112 H LEU 15 H LEU 15 33.285 25.626 18.862
113 HA LEU 15 HA LEU 15 34.735 24.758 16.429
114 HB2 LEU 15 HB2 LEU 15 31.827 24.383 17.244
115 HB3 LEU 15 HB3 LEU 15 32.657 23.595 15.908
116 HG LEU 15 HG LEU 15 33.133 23.158 18.888
117 HD11 LEU 15 HD11 LEU 15 32.386 20.877 18.361
118 HD12 LEU 15 HD12 LEU 15 31.140 22.069 17.964
119 HD13 LEU 15 HD13 LEU 15 32.118 21.340 16.669
120 HD21 LEU 15 HD21 LEU 15 34.710 21.354 18.155
121 HD22 LEU 15 HD22 LEU 15 34.626 21.995 16.500
122 HD23 LEU 15 HD23 LEU 15 35.310 22.980 17.818
123 H GLY 16 H GLY 16 32.638 27.294 17.504
124 HA2 GLY 16 HA2 GLY 16 32.357 29.376 16.398
125 HA3 GLY 16 HA3 GLY 16 32.698 28.620 14.843
126 H LEU 17 H LEU 17 30.275 27.894 17.444
127 HA LEU 17 HA LEU 17 28.092 28.088 15.396
128 HB2 LEU 17 HB2 LEU 17 27.958 26.452 17.910
129 HB3 LEU 17 HB3 LEU 17 26.930 26.341 16.511
130 HG LEU 17 HG LEU 17 29.796 25.451 16.711
131 HD11 LEU 17 HD11 LEU 17 28.885 23.174 16.431
132 HD12 LEU 17 HD12 LEU 17 28.357 23.951 17.915
133 HD13 LEU 17 HD13 LEU 17 27.241 23.835 16.531
134 HD21 LEU 17 HD21 LEU 17 27.842 25.016 14.405
135 HD22 LEU 17 HD22 LEU 17 29.196 26.164 14.366
136 HD23 LEU 17 HD23 LEU 17 29.518 24.436 14.498
137 H LEU 18 H LEU 18 26.062 28.832 16.060
138 HA LEU 18 HA LEU 18 25.948 30.759 18.316
139 HB2 LEU 18 HB2 LEU 18 23.999 29.927 16.126
140 HB3 LEU 18 HB3 LEU 18 23.552 31.017 17.437
141 HG LEU 18 HG LEU 18 25.814 31.574 15.484
142 HD11 LEU 18 HD11 LEU 18 24.260 33.147 14.419
143 HD12 LEU 18 HD12 LEU 18 23.636 31.494 14.332
144 HD13 LEU 18 HD13 LEU 18 22.958 32.630 15.519
145 HD21 LEU 18 HD21 LEU 18 25.534 33.914 16.309
146 HD22 LEU 18 HD22 LEU 18 24.372 33.336 17.522
147 HD23 LEU 18 HD23 LEU 18 26.072 32.825 17.587
148 H GLY 19 H GLY 19 25.791 29.782 20.254
149 HA2 GLY 19 HA2 GLY 19 24.095 27.429 20.722
150 HA3 GLY 19 HA3 GLY 19 24.920 28.357 21.939
151 H ALA 20 H ALA 20 22.182 27.287 21.687
152 HA ALA 20 HA ALA 20 20.743 29.647 22.702
153 HB1 ALA 20 HB1 ALA 20 20.007 29.338 20.357
154 HB2 ALA 20 HB2 ALA 20 19.586 27.643 20.718
155 HB3 ALA 20 HB3 ALA 20 18.709 28.963 21.507
156 H CYS 21 H CYS 21 19.525 29.219 24.397
157 HA CYS 21 HA CYS 21 19.475 26.479 25.602
158 HB2 CYS 21 HB2 CYS 21 20.766 27.546 27.095
159 HB3 CYS 21 HB3 CYS 21 20.151 29.143 26.691
160 H ILE 22 H ILE 22 17.581 25.589 25.525
161 HA ILE 22 HA ILE 22 15.127 27.263 25.130
162 HB ILE 22 HB ILE 22 15.762 24.535 23.955
163 HG12 ILE 22 HG12 ILE 22 15.729 27.281 22.628
164 HG13 ILE 22 HG13 ILE 22 17.163 26.303 22.936
165 HG21 ILE 22 HG21 ILE 22 13.428 26.426 23.390
166 HG22 ILE 22 HG22 ILE 22 13.692 24.820 22.671
167 HG23 ILE 22 HG23 ILE 22 13.313 24.957 24.376
168 HD11 ILE 22 HD11 ILE 22 14.945 25.674 20.966
169 HD12 ILE 22 HD12 ILE 22 16.638 26.063 20.636
170 HD13 ILE 22 HD13 ILE 22 16.228 24.524 21.425
171 H GLY 23 H GLY 23 14.459 27.353 27.233
172 HA2 GLY 23 HA2 GLY 23 13.131 26.781 28.986
173 HA3 GLY 23 HA3 GLY 23 12.818 25.232 28.207
174 H GLU 24 H GLU 24 15.071 23.917 28.245
175 HA GLU 24 HA GLU 24 16.556 24.019 30.779
176 HB2 GLU 24 HB2 GLU 24 15.869 21.894 31.622
177 HB3 GLU 24 HB3 GLU 24 14.403 22.789 31.263
178 HG2 GLU 24 HG2 GLU 24 14.443 21.551 28.962
179 HG3 GLU 24 HG3 GLU 24 15.616 20.470 29.719
180 H GLU 25 H GLU 25 16.426 23.168 27.458
181 HA GLU 25 HA GLU 25 18.790 21.385 27.651
182 HB2 GLU 25 HB2 GLU 25 18.177 20.413 25.608
183 HB3 GLU 25 HB3 GLU 25 16.762 20.377 26.648
184 HG2 GLU 25 HG2 GLU 25 15.755 22.217 25.391
185 HG3 GLU 25 HG3 GLU 25 17.218 22.412 24.416
186 H CYS 26 H CYS 26 20.363 21.607 25.829
187 HA CYS 26 HA CYS 26 20.619 24.407 24.801
188 HB2 CYS 26 HB2 CYS 26 22.244 24.396 26.450
189 HB3 CYS 26 HB3 CYS 26 22.579 22.677 26.256
190 H LYS 27 H LYS 27 20.982 24.621 22.723
191 HA LYS 27 HA LYS 27 22.371 22.495 21.211
192 HB2 LYS 27 HB2 LYS 27 20.806 22.675 19.294
193 HB3 LYS 27 HB3 LYS 27 20.167 21.825 20.696
194 HG2 LYS 27 HG2 LYS 27 18.656 23.566 21.238
195 HG3 LYS 27 HG3 LYS 27 19.544 24.766 20.285
196 HD2 LYS 27 HD2 LYS 27 17.498 24.161 19.122
197 HD3 LYS 27 HD3 LYS 27 18.925 23.680 18.211
198 HE2 LYS 27 HE2 LYS 27 18.602 21.311 19.152
199 HE3 LYS 27 HE3 LYS 27 17.065 21.877 19.822
200 HZ1 LYS 27 HZ1 LYS 27 16.543 22.582 17.454
201 HZ2 LYS 27 HZ2 LYS 27 17.831 21.709 16.956
202 HZ3 LYS 27 HZ3 LYS 27 16.563 20.963 17.702
203 H CYS 28 H CYS 28 23.551 23.188 19.461
204 HA CYS 28 HA CYS 28 23.766 26.111 19.073
205 HB2 CYS 28 HB2 CYS 28 26.205 25.999 19.213
206 HB3 CYS 28 HB3 CYS 28 25.392 25.731 20.743
207 H VAL 29 H VAL 29 24.328 26.772 17.024
208 HA VAL 29 HA VAL 29 24.298 24.622 14.947
209 HB VAL 29 HB VAL 29 22.614 25.845 13.713
210 HG11 VAL 29 HG11 VAL 29 21.959 24.053 15.291
211 HG12 VAL 29 HG12 VAL 29 21.628 25.285 16.530
212 HG13 VAL 29 HG13 VAL 29 20.696 25.265 15.019
213 HG21 VAL 29 HG21 VAL 29 22.374 27.698 16.101
214 HG22 VAL 29 HG22 VAL 29 22.952 28.138 14.481
215 HG23 VAL 29 HG23 VAL 29 21.279 27.624 14.708
216 HA PRO 30 HA PRO 30 27.269 27.010 12.829
217 HB2 PRO 30 HB2 PRO 30 27.002 26.224 10.214
218 HB3 PRO 30 HB3 PRO 30 27.644 25.170 11.503
219 HG2 PRO 30 HG2 PRO 30 24.805 25.263 10.446
220 HG3 PRO 30 HG3 PRO 30 25.847 23.827 10.700
221 HD2 PRO 30 HD2 PRO 30 24.011 24.602 12.541
222 HD3 PRO 30 HD3 PRO 30 25.594 23.948 13.046
223 H TYR 31 H TYR 31 27.613 28.856 11.794
224 HA TYR 31 HA TYR 31 25.546 30.782 11.217
225 HB2 TYR 31 HB2 TYR 31 28.535 30.682 10.630
226 HB3 TYR 31 HB3 TYR 31 27.525 32.034 10.184
227 HD1 TYR 31 HD1 TYR 31 28.736 30.087 13.141
228 HD2 TYR 31 HD2 TYR 31 27.033 33.760 11.706
229 HE1 TYR 31 HE1 TYR 31 29.105 31.125 15.377
230 HE2 TYR 31 HE2 TYR 31 27.405 34.810 13.955
231 HH TYR 31 HH TYR 31 28.078 34.460 16.147
Start of MODEL 4
1 H1 ALA 1 H1 ALA 1 12.901 21.571 33.352
2 H2 ALA 1 H2 ALA 1 13.320 20.044 33.783
3 H3 ALA 1 H3 ALA 1 13.353 20.462 32.207
4 HA ALA 1 HA ALA 1 15.104 21.426 34.365
5 HB1 ALA 1 HB1 ALA 1 15.788 19.946 31.802
6 HB2 ALA 1 HB2 ALA 1 16.931 20.435 33.064
7 HB3 ALA 1 HB3 ALA 1 15.695 19.214 33.419
8 H PHE 2 H PHE 2 16.986 22.741 33.490
9 HA PHE 2 HA PHE 2 15.970 24.866 31.641
10 HB2 PHE 2 HB2 PHE 2 17.569 25.176 34.194
11 HB3 PHE 2 HB3 PHE 2 17.051 26.471 33.138
12 HD1 PHE 2 HD1 PHE 2 16.052 24.228 35.849
13 HD2 PHE 2 HD2 PHE 2 14.605 27.031 32.910
14 HE1 PHE 2 HE1 PHE 2 13.930 24.460 37.116
15 HE2 PHE 2 HE2 PHE 2 12.500 27.277 34.185
16 HZ PHE 2 HZ PHE 2 12.149 25.994 36.295
17 H CYS 3 H CYS 3 17.513 26.174 30.596
18 HA CYS 3 HA CYS 3 19.889 24.819 29.562
19 HB2 CYS 3 HB2 CYS 3 18.625 27.563 29.193
20 HB3 CYS 3 HB3 CYS 3 19.977 26.991 28.242
21 H ASN 4 H ASN 4 22.003 25.878 29.434
22 HA ASN 4 HA ASN 4 22.524 28.231 31.204
23 HB2 ASN 4 HB2 ASN 4 24.404 25.830 30.867
24 HB3 ASN 4 HB3 ASN 4 24.917 27.422 31.350
25 HD21 ASN 4 HD21 ASN 4 22.952 27.075 34.521
26 HD22 ASN 4 HD22 ASN 4 22.592 28.067 33.114
27 H LEU 5 H LEU 5 21.850 29.330 29.343
28 HA LEU 5 HA LEU 5 22.710 28.982 26.732
29 HB2 LEU 5 HB2 LEU 5 20.819 30.365 27.436
30 HB3 LEU 5 HB3 LEU 5 21.905 31.487 28.257
31 HG LEU 5 HG LEU 5 22.886 32.159 26.073
32 HD11 LEU 5 HD11 LEU 5 21.703 31.495 23.985
33 HD12 LEU 5 HD12 LEU 5 22.507 30.122 24.745
34 HD13 LEU 5 HD13 LEU 5 20.743 30.325 24.908
35 HD21 LEU 5 HD21 LEU 5 20.967 33.444 25.318
36 HD22 LEU 5 HD22 LEU 5 19.851 32.348 26.161
37 HD23 LEU 5 HD23 LEU 5 20.973 33.373 27.083
38 H ARG 6 H ARG 6 24.345 30.962 29.242
39 HA ARG 6 HA ARG 6 26.369 32.044 27.462
40 HB2 ARG 6 HB2 ARG 6 26.312 31.594 30.479
41 HB3 ARG 6 HB3 ARG 6 27.670 32.346 29.654
42 HG2 ARG 6 HG2 ARG 6 24.823 33.457 29.653
43 HG3 ARG 6 HG3 ARG 6 26.148 33.973 30.695
44 HD2 ARG 6 HD2 ARG 6 26.337 35.574 29.073
45 HD3 ARG 6 HD3 ARG 6 27.454 34.382 28.447
46 HE ARG 6 HE ARG 6 25.999 33.935 26.643
47 HH11 ARG 6 HH11 ARG 6 24.572 34.594 25.212
48 HH12 ARG 6 HH12 ARG 6 23.199 35.626 25.674
49 HH21 ARG 6 HH21 ARG 6 24.400 36.218 28.815
50 HH22 ARG 6 HH22 ARG 6 23.178 36.553 27.603
51 H ARG 7 H ARG 7 26.574 29.251 29.682
52 HA ARG 7 HA ARG 7 29.221 28.537 28.792
53 HB2 ARG 7 HB2 ARG 7 28.154 27.673 30.949
54 HB3 ARG 7 HB3 ARG 7 27.128 26.643 29.979
55 HG2 ARG 7 HG2 ARG 7 29.040 25.366 30.820
56 HG3 ARG 7 HG3 ARG 7 29.090 25.453 29.067
57 HD2 ARG 7 HD2 ARG 7 31.324 25.730 29.878
58 HD3 ARG 7 HD3 ARG 7 30.820 27.271 29.234
59 HE ARG 7 HE ARG 7 30.789 28.198 31.408
60 HH11 ARG 7 HH11 ARG 7 31.608 24.735 31.675
61 HH12 ARG 7 HH12 ARG 7 32.130 25.007 33.344
62 HH21 ARG 7 HH21 ARG 7 31.481 28.283 33.539
63 HH22 ARG 7 HH22 ARG 7 32.068 26.789 34.273
64 H CYS 8 H CYS 8 26.031 27.365 27.857
65 HA CYS 8 HA CYS 8 26.696 25.392 25.992
66 HB2 CYS 8 HB2 CYS 8 24.450 25.742 26.727
67 HB3 CYS 8 HB3 CYS 8 24.479 27.426 26.212
68 H GLU 9 H GLU 9 26.184 28.933 25.318
69 HA GLU 9 HA GLU 9 26.860 28.548 22.541
70 HB2 GLU 9 HB2 GLU 9 26.370 30.716 22.205
71 HB3 GLU 9 HB3 GLU 9 25.341 30.331 23.577
72 HG2 GLU 9 HG2 GLU 9 26.971 31.488 25.063
73 HG3 GLU 9 HG3 GLU 9 27.963 31.856 23.639
74 H LEU 10 H LEU 10 28.697 29.844 25.276
75 HA LEU 10 HA LEU 10 31.131 30.448 23.915
76 HB2 LEU 10 HB2 LEU 10 30.383 29.803 26.770
77 HB3 LEU 10 HB3 LEU 10 32.064 29.737 26.359
78 HG LEU 10 HG LEU 10 31.298 31.899 27.353
79 HD11 LEU 10 HD11 LEU 10 33.422 31.688 26.175
80 HD12 LEU 10 HD12 LEU 10 32.623 31.987 24.621
81 HD13 LEU 10 HD13 LEU 10 32.700 33.268 25.853
82 HD21 LEU 10 HD21 LEU 10 30.308 33.613 25.940
83 HD22 LEU 10 HD22 LEU 10 30.127 32.468 24.599
84 HD23 LEU 10 HD23 LEU 10 29.189 32.259 26.096
85 H SER 11 H SER 11 30.152 27.319 25.399
86 HA SER 11 HA SER 11 32.580 25.923 24.739
87 HB2 SER 11 HB2 SER 11 31.014 25.218 26.483
88 HB3 SER 11 HB3 SER 11 29.751 24.963 25.268
89 HG SER 11 HG SER 11 32.199 23.517 25.577
90 H CYS 12 H CYS 12 29.675 26.622 22.815
91 HA CYS 12 HA CYS 12 30.614 24.895 20.600
92 HB2 CYS 12 HB2 CYS 12 28.282 26.827 20.672
93 HB3 CYS 12 HB3 CYS 12 28.677 25.681 19.432
94 H ARG 13 H ARG 13 30.834 28.310 21.528
95 HA ARG 13 HA ARG 13 31.496 29.413 18.981
96 HB2 ARG 13 HB2 ARG 13 30.922 30.588 21.204
97 HB3 ARG 13 HB3 ARG 13 32.605 30.318 21.668
98 HG2 ARG 13 HG2 ARG 13 33.287 31.624 19.598
99 HG3 ARG 13 HG3 ARG 13 31.565 31.859 19.238
100 HD2 ARG 13 HD2 ARG 13 32.315 33.840 20.350
101 HD3 ARG 13 HD3 ARG 13 31.310 32.940 21.498
102 HE ARG 13 HE ARG 13 34.103 32.223 21.755
103 HH11 ARG 13 HH11 ARG 13 31.819 34.708 22.768
104 HH12 ARG 13 HH12 ARG 13 32.987 35.459 23.832
105 HH21 ARG 13 HH21 ARG 13 35.357 32.987 23.428
106 HH22 ARG 13 HH22 ARG 13 34.980 34.519 24.179
107 H SER 14 H SER 14 33.429 27.587 21.274
108 HA SER 14 HA SER 14 36.011 27.954 20.126
109 HB2 SER 14 HB2 SER 14 35.373 26.824 22.320
110 HB3 SER 14 HB3 SER 14 34.942 25.389 21.368
111 HG SER 14 HG SER 14 37.439 26.750 21.499
112 H LEU 15 H LEU 15 33.327 25.827 19.162
113 HA LEU 15 HA LEU 15 34.786 24.714 16.845
114 HB2 LEU 15 HB2 LEU 15 31.854 24.406 17.583
115 HB3 LEU 15 HB3 LEU 15 32.787 23.427 16.465
116 HG LEU 15 HG LEU 15 33.049 23.486 19.500
117 HD11 LEU 15 HD11 LEU 15 32.206 21.184 19.319
118 HD12 LEU 15 HD12 LEU 15 31.064 22.320 18.597
119 HD13 LEU 15 HD13 LEU 15 32.112 21.332 17.553
120 HD21 LEU 15 HD21 LEU 15 34.634 21.596 19.218
121 HD22 LEU 15 HD22 LEU 15 34.609 21.836 17.456
122 HD23 LEU 15 HD23 LEU 15 35.276 23.087 18.530
123 H GLY 16 H GLY 16 32.821 27.457 17.523
124 HA2 GLY 16 HA2 GLY 16 32.269 29.225 16.109
125 HA3 GLY 16 HA3 GLY 16 32.678 28.258 14.694
126 H LEU 17 H LEU 17 30.308 27.356 17.278
127 HA LEU 17 HA LEU 17 28.123 27.655 15.237
128 HB2 LEU 17 HB2 LEU 17 27.763 25.930 17.647
129 HB3 LEU 17 HB3 LEU 17 26.911 25.902 16.140
130 HG LEU 17 HG LEU 17 29.660 24.886 16.720
131 HD11 LEU 17 HD11 LEU 17 28.675 22.671 16.102
132 HD12 LEU 17 HD12 LEU 17 27.966 23.395 17.536
133 HD13 LEU 17 HD13 LEU 17 27.081 23.451 15.995
134 HD21 LEU 17 HD21 LEU 17 29.702 23.971 14.405
135 HD22 LEU 17 HD22 LEU 17 28.119 24.711 14.070
136 HD23 LEU 17 HD23 LEU 17 29.548 25.718 14.331
137 H LEU 18 H LEU 18 26.183 28.562 15.828
138 HA LEU 18 HA LEU 18 26.207 30.544 18.027
139 HB2 LEU 18 HB2 LEU 18 24.139 29.798 15.912
140 HB3 LEU 18 HB3 LEU 18 23.985 31.145 17.033
141 HG LEU 18 HG LEU 18 26.206 30.896 14.965
142 HD11 LEU 18 HD11 LEU 18 23.632 32.517 14.875
143 HD12 LEU 18 HD12 LEU 18 24.947 32.556 13.680
144 HD13 LEU 18 HD13 LEU 18 23.996 31.081 13.894
145 HD21 LEU 18 HD21 LEU 18 26.820 32.375 16.844
146 HD22 LEU 18 HD22 LEU 18 26.498 33.322 15.386
147 HD23 LEU 18 HD23 LEU 18 25.279 33.251 16.672
148 H GLY 19 H GLY 19 25.665 29.825 20.086
149 HA2 GLY 19 HA2 GLY 19 23.819 27.545 20.426
150 HA3 GLY 19 HA3 GLY 19 24.633 28.403 21.701
151 H ALA 20 H ALA 20 21.782 27.537 21.127
152 HA ALA 20 HA ALA 20 20.507 29.883 22.319
153 HB1 ALA 20 HB1 ALA 20 19.377 28.453 19.877
154 HB2 ALA 20 HB2 ALA 20 18.548 29.690 20.835
155 HB3 ALA 20 HB3 ALA 20 20.007 30.120 19.920
156 H CYS 21 H CYS 21 18.724 29.405 23.523
157 HA CYS 21 HA CYS 21 18.611 26.679 24.688
158 HB2 CYS 21 HB2 CYS 21 18.784 28.584 26.179
159 HB3 CYS 21 HB3 CYS 21 17.323 29.295 25.482
160 H ILE 22 H ILE 22 17.123 25.171 24.161
161 HA ILE 22 HA ILE 22 14.559 26.002 22.862
162 HB ILE 22 HB ILE 22 16.354 23.717 21.992
163 HG12 ILE 22 HG12 ILE 22 17.294 25.872 21.246
164 HG13 ILE 22 HG13 ILE 22 16.755 24.865 19.925
165 HG21 ILE 22 HG21 ILE 22 14.718 23.505 20.099
166 HG22 ILE 22 HG22 ILE 22 14.025 23.102 21.661
167 HG23 ILE 22 HG23 ILE 22 13.657 24.667 20.921
168 HD11 ILE 22 HD11 ILE 22 14.792 26.251 19.549
169 HD12 ILE 22 HD12 ILE 22 15.151 27.230 20.984
170 HD13 ILE 22 HD13 ILE 22 16.241 27.262 19.588
171 H GLY 23 H GLY 23 13.346 25.845 24.590
172 HA2 GLY 23 HA2 GLY 23 12.054 24.933 26.215
173 HA3 GLY 23 HA3 GLY 23 12.389 23.332 25.551
174 H GLU 24 H GLU 24 13.695 22.066 26.610
175 HA GLU 24 HA GLU 24 14.467 22.839 29.349
176 HB2 GLU 24 HB2 GLU 24 14.551 20.485 29.808
177 HB3 GLU 24 HB3 GLU 24 13.092 20.819 28.881
178 HG2 GLU 24 HG2 GLU 24 14.191 19.976 26.825
179 HG3 GLU 24 HG3 GLU 24 15.715 19.765 27.691
180 H GLU 25 H GLU 25 16.218 22.675 26.470
181 HA GLU 25 HA GLU 25 18.721 22.435 27.916
182 HB2 GLU 25 HB2 GLU 25 18.152 20.101 27.452
183 HB3 GLU 25 HB3 GLU 25 18.006 20.456 25.733
184 HG2 GLU 25 HG2 GLU 25 20.082 19.336 26.144
185 HG3 GLU 25 HG3 GLU 25 20.448 20.972 25.653
186 H CYS 26 H CYS 26 20.565 23.265 26.804
187 HA CYS 26 HA CYS 26 19.865 24.989 24.479
188 HB2 CYS 26 HB2 CYS 26 20.683 26.132 26.405
189 HB3 CYS 26 HB3 CYS 26 22.154 25.162 26.435
190 H LYS 27 H LYS 27 20.680 24.866 22.578
191 HA LYS 27 HA LYS 27 22.792 22.885 21.861
192 HB2 LYS 27 HB2 LYS 27 21.355 22.189 19.911
193 HB3 LYS 27 HB3 LYS 27 20.845 21.605 21.493
194 HG2 LYS 27 HG2 LYS 27 18.992 23.121 21.600
195 HG3 LYS 27 HG3 LYS 27 19.602 24.085 20.259
196 HD2 LYS 27 HD2 LYS 27 17.695 22.732 19.554
197 HD3 LYS 27 HD3 LYS 27 19.156 22.271 18.676
198 HE2 LYS 27 HE2 LYS 27 19.454 20.320 20.161
199 HE3 LYS 27 HE3 LYS 27 18.033 20.794 21.105
200 HZ1 LYS 27 HZ1 LYS 27 17.891 20.189 18.202
201 HZ2 LYS 27 HZ2 LYS 27 17.675 19.051 19.382
202 HZ3 LYS 27 HZ3 LYS 27 16.635 20.332 19.238
203 H CYS 28 H CYS 28 23.694 23.224 19.733
204 HA CYS 28 HA CYS 28 23.567 26.084 18.886
205 HB2 CYS 28 HB2 CYS 28 26.015 26.141 18.926
206 HB3 CYS 28 HB3 CYS 28 25.288 25.864 20.510
207 H VAL 29 H VAL 29 24.325 26.591 16.755
208 HA VAL 29 HA VAL 29 24.337 24.291 14.870
209 HB VAL 29 HB VAL 29 22.642 25.290 13.465
210 HG11 VAL 29 HG11 VAL 29 20.690 24.781 14.772
211 HG12 VAL 29 HG12 VAL 29 21.981 23.657 15.224
212 HG13 VAL 29 HG13 VAL 29 21.564 25.016 16.295
213 HG21 VAL 29 HG21 VAL 29 22.864 27.666 13.974
214 HG22 VAL 29 HG22 VAL 29 21.206 27.134 14.268
215 HG23 VAL 29 HG23 VAL 29 22.307 27.389 15.636
216 HA PRO 30 HA PRO 30 27.231 26.661 12.410
217 HB2 PRO 30 HB2 PRO 30 25.764 25.574 10.014
218 HB3 PRO 30 HB3 PRO 30 27.510 25.520 10.390
219 HG2 PRO 30 HG2 PRO 30 25.984 23.310 10.673
220 HG3 PRO 30 HG3 PRO 30 27.225 23.708 11.903
221 HD2 PRO 30 HD2 PRO 30 24.243 24.262 11.989
222 HD3 PRO 30 HD3 PRO 30 25.306 23.548 13.236
223 H TYR 31 H TYR 31 27.330 28.345 10.724
224 HA TYR 31 HA TYR 31 25.309 30.354 11.016
225 HB2 TYR 31 HB2 TYR 31 27.400 30.361 8.840
226 HB3 TYR 31 HB3 TYR 31 26.674 31.731 9.659
227 HD1 TYR 31 HD1 TYR 31 29.686 30.577 9.187
228 HD2 TYR 31 HD2 TYR 31 27.031 31.037 12.545
229 HE1 TYR 31 HE1 TYR 31 31.643 30.583 10.728
230 HE2 TYR 31 HE2 TYR 31 28.991 31.063 14.088
231 HH TYR 31 HH TYR 31 31.262 31.000 14.264
Start of MODEL 5
1 H1 ALA 1 H1 ALA 1 13.180 22.469 33.702
2 H2 ALA 1 H2 ALA 1 13.002 23.304 35.118
3 H3 ALA 1 H3 ALA 1 13.279 21.684 35.137
4 HA ALA 1 HA ALA 1 15.267 22.885 35.721
5 HB1 ALA 1 HB1 ALA 1 15.490 20.700 34.586
6 HB2 ALA 1 HB2 ALA 1 15.431 21.506 33.002
7 HB3 ALA 1 HB3 ALA 1 16.786 21.805 34.093
8 H PHE 2 H PHE 2 17.094 24.166 34.897
9 HA PHE 2 HA PHE 2 16.328 26.252 32.875
10 HB2 PHE 2 HB2 PHE 2 18.364 26.426 35.112
11 HB3 PHE 2 HB3 PHE 2 17.887 27.724 34.025
12 HD1 PHE 2 HD1 PHE 2 17.519 26.604 37.272
13 HD2 PHE 2 HD2 PHE 2 15.124 28.043 33.984
14 HE1 PHE 2 HE1 PHE 2 15.746 27.290 38.859
15 HE2 PHE 2 HE2 PHE 2 13.353 28.727 35.584
16 HZ PHE 2 HZ PHE 2 13.659 28.362 38.023
17 H CYS 3 H CYS 3 18.372 27.240 31.806
18 HA CYS 3 HA CYS 3 20.436 25.191 31.209
19 HB2 CYS 3 HB2 CYS 3 20.187 25.836 28.814
20 HB3 CYS 3 HB3 CYS 3 18.853 24.911 29.497
21 H ASN 4 H ASN 4 22.429 25.890 30.914
22 HA ASN 4 HA ASN 4 23.078 28.677 31.648
23 HB2 ASN 4 HB2 ASN 4 24.664 26.100 31.417
24 HB3 ASN 4 HB3 ASN 4 25.450 27.670 31.426
25 HD21 ASN 4 HD21 ASN 4 24.788 28.465 34.801
26 HD22 ASN 4 HD22 ASN 4 25.141 29.094 33.200
27 H LEU 5 H LEU 5 22.195 29.610 29.762
28 HA LEU 5 HA LEU 5 22.942 28.977 27.143
29 HB2 LEU 5 HB2 LEU 5 20.965 30.277 27.810
30 HB3 LEU 5 HB3 LEU 5 21.990 31.634 28.263
31 HG LEU 5 HG LEU 5 22.721 31.886 25.913
32 HD11 LEU 5 HD11 LEU 5 21.457 30.664 24.120
33 HD12 LEU 5 HD12 LEU 5 22.521 29.605 25.041
34 HD13 LEU 5 HD13 LEU 5 20.767 29.603 25.364
35 HD21 LEU 5 HD21 LEU 5 20.743 33.108 26.731
36 HD22 LEU 5 HD22 LEU 5 20.569 32.689 25.017
37 HD23 LEU 5 HD23 LEU 5 19.694 31.756 26.249
38 H ARG 6 H ARG 6 24.670 31.221 29.362
39 HA ARG 6 HA ARG 6 26.637 32.128 27.437
40 HB2 ARG 6 HB2 ARG 6 26.757 31.726 30.451
41 HB3 ARG 6 HB3 ARG 6 28.166 32.201 29.545
42 HG2 ARG 6 HG2 ARG 6 25.627 33.865 29.473
43 HG3 ARG 6 HG3 ARG 6 26.842 34.014 30.734
44 HD2 ARG 6 HD2 ARG 6 27.434 35.692 29.262
45 HD3 ARG 6 HD3 ARG 6 28.568 34.393 28.861
46 HE ARG 6 HE ARG 6 26.163 34.277 27.239
47 HH11 ARG 6 HH11 ARG 6 29.122 36.244 27.438
48 HH12 ARG 6 HH12 ARG 6 28.993 36.700 25.772
49 HH21 ARG 6 HH21 ARG 6 26.026 34.978 25.263
50 HH22 ARG 6 HH22 ARG 6 27.259 35.996 24.536
51 H ARG 7 H ARG 7 26.782 29.311 29.671
52 HA ARG 7 HA ARG 7 29.265 28.308 28.636
53 HB2 ARG 7 HB2 ARG 7 28.451 27.480 30.748
54 HB3 ARG 7 HB3 ARG 7 26.970 26.855 30.014
55 HG2 ARG 7 HG2 ARG 7 28.042 25.085 28.955
56 HG3 ARG 7 HG3 ARG 7 29.642 25.831 29.040
57 HD2 ARG 7 HD2 ARG 7 28.163 24.985 31.548
58 HD3 ARG 7 HD3 ARG 7 29.121 23.851 30.578
59 HE ARG 7 HE ARG 7 30.851 25.957 30.920
60 HH11 ARG 7 HH11 ARG 7 29.271 23.793 33.240
61 HH12 ARG 7 HH12 ARG 7 30.500 24.202 34.448
62 HH21 ARG 7 HH21 ARG 7 32.312 26.224 32.435
63 HH22 ARG 7 HH22 ARG 7 32.204 25.358 33.969
64 H CYS 8 H CYS 8 25.926 27.539 27.724
65 HA CYS 8 HA CYS 8 26.453 25.663 25.692
66 HB2 CYS 8 HB2 CYS 8 24.229 26.309 26.712
67 HB3 CYS 8 HB3 CYS 8 24.280 27.799 25.768
68 H GLU 9 H GLU 9 26.185 29.246 25.304
69 HA GLU 9 HA GLU 9 26.867 29.220 22.491
70 HB2 GLU 9 HB2 GLU 9 26.920 31.312 24.716
71 HB3 GLU 9 HB3 GLU 9 27.484 31.711 23.108
72 HG2 GLU 9 HG2 GLU 9 24.758 30.448 23.265
73 HG3 GLU 9 HG3 GLU 9 24.933 32.059 23.954
74 H LEU 10 H LEU 10 28.879 29.977 25.399
75 HA LEU 10 HA LEU 10 31.211 30.598 23.845
76 HB2 LEU 10 HB2 LEU 10 30.660 30.166 26.795
77 HB3 LEU 10 HB3 LEU 10 32.307 30.251 26.240
78 HG LEU 10 HG LEU 10 31.501 32.380 27.126
79 HD11 LEU 10 HD11 LEU 10 33.339 32.269 25.452
80 HD12 LEU 10 HD12 LEU 10 32.152 32.595 24.168
81 HD13 LEU 10 HD13 LEU 10 32.455 33.799 25.430
82 HD21 LEU 10 HD21 LEU 10 30.068 33.865 25.805
83 HD22 LEU 10 HD22 LEU 10 29.701 32.551 24.678
84 HD23 LEU 10 HD23 LEU 10 29.173 32.454 26.375
85 H SER 11 H SER 11 30.035 27.516 25.113
86 HA SER 11 HA SER 11 32.587 26.137 24.616
87 HB2 SER 11 HB2 SER 11 29.827 24.889 24.840
88 HB3 SER 11 HB3 SER 11 31.411 24.104 25.029
89 HG SER 11 HG SER 11 30.096 25.971 26.662
90 H CYS 12 H CYS 12 29.530 26.687 22.754
91 HA CYS 12 HA CYS 12 30.491 24.886 20.636
92 HB2 CYS 12 HB2 CYS 12 28.087 26.729 20.731
93 HB3 CYS 12 HB3 CYS 12 28.462 25.541 19.503
94 H ARG 13 H ARG 13 30.527 28.380 21.222
95 HA ARG 13 HA ARG 13 31.446 29.228 18.638
96 HB2 ARG 13 HB2 ARG 13 31.633 30.322 21.468
97 HB3 ARG 13 HB3 ARG 13 32.337 31.143 20.082
98 HG2 ARG 13 HG2 ARG 13 30.180 31.234 18.930
99 HG3 ARG 13 HG3 ARG 13 29.420 30.318 20.230
100 HD2 ARG 13 HD2 ARG 13 30.056 32.191 21.820
101 HD3 ARG 13 HD3 ARG 13 30.599 33.116 20.410
102 HE ARG 13 HE ARG 13 27.781 32.062 20.637
103 HH11 ARG 13 HH11 ARG 13 29.776 34.987 20.206
104 HH12 ARG 13 HH12 ARG 13 28.326 35.892 19.825
105 HH21 ARG 13 HH21 ARG 13 26.154 33.356 20.294
106 HH22 ARG 13 HH22 ARG 13 26.427 35.069 19.885
107 H SER 14 H SER 14 33.021 27.309 21.001
108 HA SER 14 HA SER 14 35.779 27.831 20.341
109 HB2 SER 14 HB2 SER 14 34.933 26.382 22.246
110 HB3 SER 14 HB3 SER 14 34.493 25.162 21.036
111 HG SER 14 HG SER 14 36.947 25.936 22.016
112 H LEU 15 H LEU 15 33.301 25.697 18.889
113 HA LEU 15 HA LEU 15 35.063 24.898 16.657
114 HB2 LEU 15 HB2 LEU 15 32.112 24.317 17.116
115 HB3 LEU 15 HB3 LEU 15 33.189 23.516 15.980
116 HG LEU 15 HG LEU 15 33.274 23.328 19.024
117 HD11 LEU 15 HD11 LEU 15 31.475 22.045 17.910
118 HD12 LEU 15 HD12 LEU 15 32.682 21.251 16.874
119 HD13 LEU 15 HD13 LEU 15 32.691 20.983 18.630
120 HD21 LEU 15 HD21 LEU 15 35.032 21.599 18.663
121 HD22 LEU 15 HD22 LEU 15 35.112 22.053 16.948
122 HD23 LEU 15 HD23 LEU 15 35.577 23.217 18.215
123 H GLY 16 H GLY 16 32.470 27.158 17.313
124 HA2 GLY 16 HA2 GLY 16 32.263 29.189 15.978
125 HA3 GLY 16 HA3 GLY 16 32.612 28.265 14.521
126 H LEU 17 H LEU 17 30.311 27.441 17.177
127 HA LEU 17 HA LEU 17 28.049 27.678 15.229
128 HB2 LEU 17 HB2 LEU 17 27.769 26.040 17.696
129 HB3 LEU 17 HB3 LEU 17 26.983 25.856 16.176
130 HG LEU 17 HG LEU 17 29.780 25.006 16.864
131 HD11 LEU 17 HD11 LEU 17 27.251 23.408 16.334
132 HD12 LEU 17 HD12 LEU 17 28.873 22.715 16.537
133 HD13 LEU 17 HD13 LEU 17 28.125 23.579 17.874
134 HD21 LEU 17 HD21 LEU 17 28.199 24.508 14.289
135 HD22 LEU 17 HD22 LEU 17 29.593 25.597 14.404
136 HD23 LEU 17 HD23 LEU 17 29.814 23.866 14.650
137 H LEU 18 H LEU 18 26.121 28.656 15.974
138 HA LEU 18 HA LEU 18 26.337 30.364 18.417
139 HB2 LEU 18 HB2 LEU 18 24.143 30.132 16.316
140 HB3 LEU 18 HB3 LEU 18 24.097 31.204 17.715
141 HG LEU 18 HG LEU 18 26.094 31.328 15.438
142 HD11 LEU 18 HD11 LEU 18 23.799 33.183 16.209
143 HD12 LEU 18 HD12 LEU 18 24.929 33.414 14.856
144 HD13 LEU 18 HD13 LEU 18 23.799 32.044 14.850
145 HD21 LEU 18 HD21 LEU 18 27.128 32.193 17.526
146 HD22 LEU 18 HD22 LEU 18 26.767 33.516 16.414
147 HD23 LEU 18 HD23 LEU 18 25.698 33.217 17.799
148 H GLY 19 H GLY 19 25.563 29.767 20.285
149 HA2 GLY 19 HA2 GLY 19 23.859 27.358 20.530
150 HA3 GLY 19 HA3 GLY 19 24.646 28.176 21.844
151 H ALA 20 H ALA 20 21.921 27.239 21.333
152 HA ALA 20 HA ALA 20 20.373 29.562 22.271
153 HB1 ALA 20 HB1 ALA 20 19.564 27.535 20.129
154 HB2 ALA 20 HB2 ALA 20 18.482 28.737 20.854
155 HB3 ALA 20 HB3 ALA 20 19.857 29.272 19.870
156 H CYS 21 H CYS 21 18.347 28.680 23.299
157 HA CYS 21 HA CYS 21 18.594 25.884 24.286
158 HB2 CYS 21 HB2 CYS 21 19.586 27.015 26.083
159 HB3 CYS 21 HB3 CYS 21 18.367 28.296 26.067
160 H ILE 22 H ILE 22 16.912 24.806 23.810
161 HA ILE 22 HA ILE 22 14.318 26.098 23.122
162 HB ILE 22 HB ILE 22 15.316 23.248 22.747
163 HG12 ILE 22 HG12 ILE 22 14.983 25.416 20.632
164 HG13 ILE 22 HG13 ILE 22 16.534 24.972 21.353
165 HG21 ILE 22 HG21 ILE 22 13.322 22.954 21.304
166 HG22 ILE 22 HG22 ILE 22 12.837 23.368 22.939
167 HG23 ILE 22 HG23 ILE 22 12.810 24.612 21.671
168 HD11 ILE 22 HD11 ILE 22 16.406 23.835 19.277
169 HD12 ILE 22 HD12 ILE 22 16.204 22.617 20.540
170 HD13 ILE 22 HD13 ILE 22 14.793 23.192 19.613
171 H GLY 23 H GLY 23 13.006 26.385 24.863
172 HA2 GLY 23 HA2 GLY 23 11.786 25.987 26.747
173 HA3 GLY 23 HA3 GLY 23 12.060 24.255 26.516
174 H GLU 24 H GLU 24 14.108 23.393 27.290
175 HA GLU 24 HA GLU 24 15.581 24.859 29.400
176 HB2 GLU 24 HB2 GLU 24 15.312 23.131 31.044
177 HB3 GLU 24 HB3 GLU 24 13.715 23.669 30.528
178 HG2 GLU 24 HG2 GLU 24 13.600 21.653 29.003
179 HG3 GLU 24 HG3 GLU 24 15.149 21.111 29.650
180 H GLU 25 H GLU 25 15.862 23.271 26.571
181 HA GLU 25 HA GLU 25 18.239 21.625 27.303
182 HB2 GLU 25 HB2 GLU 25 16.336 21.532 24.952
183 HB3 GLU 25 HB3 GLU 25 17.804 20.574 25.043
184 HG2 GLU 25 HG2 GLU 25 15.629 20.403 27.177
185 HG3 GLU 25 HG3 GLU 25 15.590 19.457 25.699
186 H CYS 26 H CYS 26 20.139 22.608 26.882
187 HA CYS 26 HA CYS 26 20.586 24.701 24.937
188 HB2 CYS 26 HB2 CYS 26 22.123 24.601 26.702
189 HB3 CYS 26 HB3 CYS 26 22.319 22.852 26.563
190 H LYS 27 H LYS 27 21.069 24.637 22.853
191 HA LYS 27 HA LYS 27 22.284 22.300 21.528
192 HB2 LYS 27 HB2 LYS 27 19.733 23.655 20.531
193 HB3 LYS 27 HB3 LYS 27 20.728 22.589 19.549
194 HG2 LYS 27 HG2 LYS 27 19.224 21.732 22.041
195 HG3 LYS 27 HG3 LYS 27 18.723 21.528 20.369
196 HD2 LYS 27 HD2 LYS 27 20.992 20.234 20.052
197 HD3 LYS 27 HD3 LYS 27 20.977 20.114 21.830
198 HE2 LYS 27 HE2 LYS 27 18.613 19.271 21.655
199 HE3 LYS 27 HE3 LYS 27 18.780 19.322 19.891
200 HZ1 LYS 27 HZ1 LYS 27 20.619 17.651 20.148
201 HZ2 LYS 27 HZ2 LYS 27 20.265 17.542 21.753
202 HZ3 LYS 27 HZ3 LYS 27 19.156 17.085 20.674
203 H CYS 28 H CYS 28 23.388 22.970 19.522
204 HA CYS 28 HA CYS 28 23.532 25.867 18.996
205 HB2 CYS 28 HB2 CYS 28 26.009 25.843 19.081
206 HB3 CYS 28 HB3 CYS 28 25.235 25.724 20.652
207 H VAL 29 H VAL 29 24.391 26.407 16.891
208 HA VAL 29 HA VAL 29 24.657 24.161 14.979
209 HB VAL 29 HB VAL 29 22.871 24.906 13.543
210 HG11 VAL 29 HG11 VAL 29 21.726 24.602 16.349
211 HG12 VAL 29 HG12 VAL 29 20.926 24.249 14.812
212 HG13 VAL 29 HG13 VAL 29 22.300 23.258 15.326
213 HG21 VAL 29 HG21 VAL 29 22.258 26.994 15.657
214 HG22 VAL 29 HG22 VAL 29 22.815 27.302 13.997
215 HG23 VAL 29 HG23 VAL 29 21.220 26.602 14.277
216 HA PRO 30 HA PRO 30 27.569 26.653 12.960
217 HB2 PRO 30 HB2 PRO 30 26.339 25.928 10.303
218 HB3 PRO 30 HB3 PRO 30 28.045 25.819 10.819
219 HG2 PRO 30 HG2 PRO 30 26.492 23.604 10.732
220 HG3 PRO 30 HG3 PRO 30 27.612 23.861 12.106
221 HD2 PRO 30 HD2 PRO 30 24.630 24.361 11.983
222 HD3 PRO 30 HD3 PRO 30 25.610 23.602 13.270
223 H TYR 31 H TYR 31 28.072 28.542 11.824
224 HA TYR 31 HA TYR 31 26.185 30.709 11.654
225 HB2 TYR 31 HB2 TYR 31 28.881 30.408 10.286
226 HB3 TYR 31 HB3 TYR 31 28.030 31.905 10.601
227 HD1 TYR 31 HD1 TYR 31 30.928 31.053 11.299
228 HD2 TYR 31 HD2 TYR 31 27.290 31.203 13.581
229 HE1 TYR 31 HE1 TYR 31 32.255 31.442 13.364
230 HE2 TYR 31 HE2 TYR 31 28.622 31.565 15.667
231 HH TYR 31 HH TYR 31 32.189 31.645 15.670
Start of MODEL 6
1 H1 ALA 1 H1 ALA 1 16.321 17.949 34.295
2 H2 ALA 1 H2 ALA 1 15.678 18.999 33.201
3 H3 ALA 1 H3 ALA 1 15.596 19.341 34.806
4 HA ALA 1 HA ALA 1 17.994 19.469 34.938
5 HB1 ALA 1 HB1 ALA 1 18.399 18.006 32.949
6 HB2 ALA 1 HB2 ALA 1 17.857 19.330 31.895
7 HB3 ALA 1 HB3 ALA 1 19.313 19.523 32.889
8 H PHE 2 H PHE 2 19.185 21.523 34.357
9 HA PHE 2 HA PHE 2 17.450 23.674 33.208
10 HB2 PHE 2 HB2 PHE 2 19.477 24.083 35.415
11 HB3 PHE 2 HB3 PHE 2 18.366 25.266 34.745
12 HD1 PHE 2 HD1 PHE 2 15.798 24.751 34.993
13 HD2 PHE 2 HD2 PHE 2 18.894 22.916 37.374
14 HE1 PHE 2 HE1 PHE 2 14.119 24.159 36.719
15 HE2 PHE 2 HE2 PHE 2 17.222 22.322 39.098
16 HZ PHE 2 HZ PHE 2 14.826 22.961 38.783
17 H CYS 3 H CYS 3 18.555 25.296 31.959
18 HA CYS 3 HA CYS 3 21.274 24.496 31.083
19 HB2 CYS 3 HB2 CYS 3 20.775 25.364 28.953
20 HB3 CYS 3 HB3 CYS 3 19.514 24.245 29.433
21 H ASN 4 H ASN 4 22.628 26.153 30.188
22 HA ASN 4 HA ASN 4 22.577 28.839 31.550
23 HB2 ASN 4 HB2 ASN 4 24.805 26.820 31.084
24 HB3 ASN 4 HB3 ASN 4 25.122 28.535 31.379
25 HD21 ASN 4 HD21 ASN 4 23.972 28.237 34.846
26 HD22 ASN 4 HD22 ASN 4 23.771 29.342 33.497
27 H LEU 5 H LEU 5 21.731 29.945 29.788
28 HA LEU 5 HA LEU 5 22.258 29.490 27.072
29 HB2 LEU 5 HB2 LEU 5 20.460 30.853 27.998
30 HB3 LEU 5 HB3 LEU 5 21.596 32.057 28.569
31 HG LEU 5 HG LEU 5 20.231 32.617 26.553
32 HD11 LEU 5 HD11 LEU 5 22.296 33.867 27.113
33 HD12 LEU 5 HD12 LEU 5 23.208 32.810 26.010
34 HD13 LEU 5 HD13 LEU 5 21.924 33.843 25.385
35 HD21 LEU 5 HD21 LEU 5 22.112 30.777 25.030
36 HD22 LEU 5 HD22 LEU 5 20.395 30.443 25.387
37 HD23 LEU 5 HD23 LEU 5 20.844 31.817 24.361
38 H ARG 6 H ARG 6 24.070 31.627 29.287
39 HA ARG 6 HA ARG 6 25.934 32.560 27.257
40 HB2 ARG 6 HB2 ARG 6 25.936 32.641 30.299
41 HB3 ARG 6 HB3 ARG 6 27.207 33.382 29.348
42 HG2 ARG 6 HG2 ARG 6 24.335 34.152 28.761
43 HG3 ARG 6 HG3 ARG 6 25.145 34.770 30.198
44 HD2 ARG 6 HD2 ARG 6 25.376 36.374 28.406
45 HD3 ARG 6 HD3 ARG 6 26.947 35.725 28.876
46 HE ARG 6 HE ARG 6 25.543 34.525 26.521
47 HH11 ARG 6 HH11 ARG 6 28.307 36.525 27.577
48 HH12 ARG 6 HH12 ARG 6 28.890 36.542 25.917
49 HH21 ARG 6 HH21 ARG 6 26.475 34.626 24.605
50 HH22 ARG 6 HH22 ARG 6 27.954 35.579 24.358
51 H ARG 7 H ARG 7 26.021 29.770 29.332
52 HA ARG 7 HA ARG 7 28.819 29.061 28.646
53 HB2 ARG 7 HB2 ARG 7 27.856 28.268 30.773
54 HB3 ARG 7 HB3 ARG 7 26.557 27.464 29.899
55 HG2 ARG 7 HG2 ARG 7 28.229 25.860 30.673
56 HG3 ARG 7 HG3 ARG 7 28.048 25.858 28.921
57 HD2 ARG 7 HD2 ARG 7 30.401 25.626 29.700
58 HD3 ARG 7 HD3 ARG 7 30.109 26.957 28.581
59 HE ARG 7 HE ARG 7 30.199 27.437 31.542
60 HH11 ARG 7 HH11 ARG 7 31.880 27.885 28.494
61 HH12 ARG 7 HH12 ARG 7 32.482 29.475 29.003
62 HH21 ARG 7 HH21 ARG 7 31.188 29.442 32.106
63 HH22 ARG 7 HH22 ARG 7 32.239 30.192 30.907
64 H CYS 8 H CYS 8 25.547 28.017 27.701
65 HA CYS 8 HA CYS 8 26.197 26.045 25.830
66 HB2 CYS 8 HB2 CYS 8 23.948 26.488 26.645
67 HB3 CYS 8 HB3 CYS 8 23.926 28.065 25.852
68 H GLU 9 H GLU 9 25.797 29.582 25.118
69 HA GLU 9 HA GLU 9 26.616 29.437 22.384
70 HB2 GLU 9 HB2 GLU 9 26.906 31.632 24.515
71 HB3 GLU 9 HB3 GLU 9 27.360 31.870 22.829
72 HG2 GLU 9 HG2 GLU 9 25.102 31.428 22.075
73 HG3 GLU 9 HG3 GLU 9 24.555 31.116 23.733
74 H LEU 10 H LEU 10 28.694 30.034 25.305
75 HA LEU 10 HA LEU 10 31.094 30.333 23.749
76 HB2 LEU 10 HB2 LEU 10 30.368 30.251 26.657
77 HB3 LEU 10 HB3 LEU 10 32.039 29.925 26.248
78 HG LEU 10 HG LEU 10 31.579 32.291 26.829
79 HD11 LEU 10 HD11 LEU 10 32.970 33.256 25.093
80 HD12 LEU 10 HD12 LEU 10 33.546 31.642 25.492
81 HD13 LEU 10 HD13 LEU 10 32.637 31.910 23.987
82 HD21 LEU 10 HD21 LEU 10 29.371 32.556 25.661
83 HD22 LEU 10 HD22 LEU 10 30.540 33.809 25.255
84 HD23 LEU 10 HD23 LEU 10 30.211 32.507 24.096
85 H SER 11 H SER 11 29.700 27.484 25.341
86 HA SER 11 HA SER 11 31.967 25.758 24.908
87 HB2 SER 11 HB2 SER 11 30.004 25.355 26.462
88 HB3 SER 11 HB3 SER 11 29.023 25.003 25.027
89 HG SER 11 HG SER 11 31.331 23.642 26.001
90 H CYS 12 H CYS 12 29.136 26.632 22.896
91 HA CYS 12 HA CYS 12 29.913 24.881 20.681
92 HB2 CYS 12 HB2 CYS 12 27.886 27.126 20.977
93 HB3 CYS 12 HB3 CYS 12 28.136 26.191 19.504
94 H ARG 13 H ARG 13 30.608 28.207 21.658
95 HA ARG 13 HA ARG 13 31.726 29.178 19.216
96 HB2 ARG 13 HB2 ARG 13 31.241 30.305 21.614
97 HB3 ARG 13 HB3 ARG 13 32.942 29.932 21.865
98 HG2 ARG 13 HG2 ARG 13 33.143 32.037 20.951
99 HG3 ARG 13 HG3 ARG 13 33.180 31.096 19.465
100 HD2 ARG 13 HD2 ARG 13 31.611 32.803 19.021
101 HD3 ARG 13 HD3 ARG 13 30.599 31.415 19.397
102 HE ARG 13 HE ARG 13 31.319 33.317 21.594
103 HH11 ARG 13 HH11 ARG 13 28.613 32.102 19.716
104 HH12 ARG 13 HH12 ARG 13 27.567 33.389 20.212
105 HH21 ARG 13 HH21 ARG 13 29.984 34.764 22.310
106 HH22 ARG 13 HH22 ARG 13 28.309 34.843 21.760
107 H SER 14 H SER 14 33.025 26.817 21.441
108 HA SER 14 HA SER 14 35.749 26.921 20.476
109 HB2 SER 14 HB2 SER 14 35.132 25.762 22.573
110 HB3 SER 14 HB3 SER 14 34.327 24.501 21.613
111 HG SER 14 HG SER 14 36.349 23.743 21.768
112 H LEU 15 H LEU 15 32.869 25.059 19.422
113 HA LEU 15 HA LEU 15 34.290 23.825 17.163
114 HB2 LEU 15 HB2 LEU 15 31.325 23.860 17.809
115 HB3 LEU 15 HB3 LEU 15 32.150 22.813 16.655
116 HG LEU 15 HG LEU 15 32.396 22.748 19.692
117 HD11 LEU 15 HD11 LEU 15 31.327 20.744 17.659
118 HD12 LEU 15 HD12 LEU 15 31.436 20.495 19.410
119 HD13 LEU 15 HD13 LEU 15 30.350 21.737 18.767
120 HD21 LEU 15 HD21 LEU 15 33.854 21.040 17.630
121 HD22 LEU 15 HD22 LEU 15 34.604 22.195 18.760
122 HD23 LEU 15 HD23 LEU 15 33.818 20.743 19.382
123 H GLY 16 H GLY 16 32.427 26.704 17.699
124 HA2 GLY 16 HA2 GLY 16 32.634 28.623 16.358
125 HA3 GLY 16 HA3 GLY 16 33.049 27.645 14.954
126 H LEU 17 H LEU 17 30.181 27.222 17.083
127 HA LEU 17 HA LEU 17 28.410 28.311 14.961
128 HB2 LEU 17 HB2 LEU 17 26.805 26.366 15.745
129 HB3 LEU 17 HB3 LEU 17 27.839 26.255 14.341
130 HG LEU 17 HG LEU 17 28.722 25.129 17.022
131 HD11 LEU 17 HD11 LEU 17 27.076 23.725 14.866
132 HD12 LEU 17 HD12 LEU 17 27.751 22.975 16.329
133 HD13 LEU 17 HD13 LEU 17 26.480 24.188 16.468
134 HD21 LEU 17 HD21 LEU 17 30.450 25.155 15.191
135 HD22 LEU 17 HD22 LEU 17 29.939 23.509 15.557
136 HD23 LEU 17 HD23 LEU 17 29.317 24.332 14.117
137 H LEU 18 H LEU 18 26.350 29.019 15.622
138 HA LEU 18 HA LEU 18 26.455 30.594 18.066
139 HB2 LEU 18 HB2 LEU 18 24.356 30.156 15.899
140 HB3 LEU 18 HB3 LEU 18 24.136 31.284 17.232
141 HG LEU 18 HG LEU 18 26.477 31.478 15.320
142 HD11 LEU 18 HD11 LEU 18 23.826 32.941 15.167
143 HD12 LEU 18 HD12 LEU 18 25.235 33.179 14.114
144 HD13 LEU 18 HD13 LEU 18 24.351 31.643 14.069
145 HD21 LEU 18 HD21 LEU 18 26.777 32.739 17.412
146 HD22 LEU 18 HD22 LEU 18 26.452 33.862 16.087
147 HD23 LEU 18 HD23 LEU 18 25.161 33.460 17.228
148 H GLY 19 H GLY 19 25.690 30.013 20.043
149 HA2 GLY 19 HA2 GLY 19 23.901 27.638 20.229
150 HA3 GLY 19 HA3 GLY 19 24.823 28.282 21.536
151 H ALA 20 H ALA 20 22.108 27.490 21.324
152 HA ALA 20 HA ALA 20 20.918 29.636 22.878
153 HB1 ALA 20 HB1 ALA 20 18.764 29.582 21.657
154 HB2 ALA 20 HB2 ALA 20 20.066 30.179 20.619
155 HB3 ALA 20 HB3 ALA 20 19.468 28.517 20.430
156 H CYS 21 H CYS 21 19.125 28.819 24.147
157 HA CYS 21 HA CYS 21 19.142 25.841 24.517
158 HB2 CYS 21 HB2 CYS 21 20.089 26.845 26.436
159 HB3 CYS 21 HB3 CYS 21 18.797 28.059 26.531
160 H ILE 22 H ILE 22 17.348 24.722 24.278
161 HA ILE 22 HA ILE 22 14.746 26.132 23.836
162 HB ILE 22 HB ILE 22 15.479 23.277 23.131
163 HG12 ILE 22 HG12 ILE 22 16.913 24.575 21.748
164 HG13 ILE 22 HG13 ILE 22 15.561 24.034 20.768
165 HG21 ILE 22 HG21 ILE 22 13.131 25.040 22.281
166 HG22 ILE 22 HG22 ILE 22 13.448 23.380 21.746
167 HG23 ILE 22 HG23 ILE 22 13.056 23.700 23.436
168 HD11 ILE 22 HD11 ILE 22 14.529 26.324 20.991
169 HD12 ILE 22 HD12 ILE 22 15.985 26.849 21.861
170 HD13 ILE 22 HD13 ILE 22 16.111 26.317 20.184
171 H GLY 23 H GLY 23 14.118 26.512 25.923
172 HA2 GLY 23 HA2 GLY 23 13.112 26.085 27.942
173 HA3 GLY 23 HA3 GLY 23 13.001 24.380 27.487
174 H GLU 24 H GLU 24 14.861 23.045 27.812
175 HA GLU 24 HA GLU 24 16.924 23.999 29.747
176 HB2 GLU 24 HB2 GLU 24 16.715 22.098 31.114
177 HB3 GLU 24 HB3 GLU 24 15.094 22.764 30.920
178 HG2 GLU 24 HG2 GLU 24 14.702 20.999 29.113
179 HG3 GLU 24 HG3 GLU 24 16.272 20.309 29.530
180 H GLU 25 H GLU 25 16.522 22.788 26.685
181 HA GLU 25 HA GLU 25 18.956 21.060 26.810
182 HB2 GLU 25 HB2 GLU 25 16.964 21.309 24.541
183 HB3 GLU 25 HB3 GLU 25 18.278 20.148 24.693
184 HG2 GLU 25 HG2 GLU 25 15.741 20.293 26.366
185 HG3 GLU 25 HG3 GLU 25 16.127 19.107 25.128
186 H CYS 26 H CYS 26 20.845 22.065 26.288
187 HA CYS 26 HA CYS 26 20.924 24.480 24.637
188 HB2 CYS 26 HB2 CYS 26 22.541 24.272 26.370
189 HB3 CYS 26 HB3 CYS 26 23.013 22.657 25.826
190 H LYS 27 H LYS 27 21.189 24.672 22.533
191 HA LYS 27 HA LYS 27 22.288 22.488 20.815
192 HB2 LYS 27 HB2 LYS 27 19.712 24.072 20.390
193 HB3 LYS 27 HB3 LYS 27 20.536 23.189 19.097
194 HG2 LYS 27 HG2 LYS 27 20.198 21.088 20.162
195 HG3 LYS 27 HG3 LYS 27 19.527 21.830 21.625
196 HD2 LYS 27 HD2 LYS 27 17.558 22.532 20.538
197 HD3 LYS 27 HD3 LYS 27 18.260 22.367 18.908
198 HE2 LYS 27 HE2 LYS 27 18.346 20.000 19.082
199 HE3 LYS 27 HE3 LYS 27 17.841 20.017 20.784
200 HZ1 LYS 27 HZ1 LYS 27 15.671 20.735 20.158
201 HZ2 LYS 27 HZ2 LYS 27 16.122 21.062 18.595
202 HZ3 LYS 27 HZ3 LYS 27 16.025 19.522 19.109
203 H CYS 28 H CYS 28 23.287 23.324 18.858
204 HA CYS 28 HA CYS 28 23.383 26.254 18.597
205 HB2 CYS 28 HB2 CYS 28 25.909 26.019 17.998
206 HB3 CYS 28 HB3 CYS 28 25.382 26.316 19.630
207 H VAL 29 H VAL 29 24.018 27.040 16.504
208 HA VAL 29 HA VAL 29 23.694 25.112 14.268
209 HB VAL 29 HB VAL 29 22.008 26.466 13.207
210 HG11 VAL 29 HG11 VAL 29 21.110 25.857 16.049
211 HG12 VAL 29 HG12 VAL 29 20.101 25.968 14.594
212 HG13 VAL 29 HG13 VAL 29 21.281 24.656 14.743
213 HG21 VAL 29 HG21 VAL 29 22.036 28.216 15.693
214 HG22 VAL 29 HG22 VAL 29 22.526 28.704 14.055
215 HG23 VAL 29 HG23 VAL 29 20.838 28.296 14.383
216 HA PRO 30 HA PRO 30 26.738 27.540 12.204
217 HB2 PRO 30 HB2 PRO 30 25.014 27.306 9.722
218 HB3 PRO 30 HB3 PRO 30 26.775 27.053 9.890
219 HG2 PRO 30 HG2 PRO 30 25.191 24.910 9.839
220 HG3 PRO 30 HG3 PRO 30 26.429 24.990 11.119
221 HD2 PRO 30 HD2 PRO 30 23.484 25.740 11.335
222 HD3 PRO 30 HD3 PRO 30 24.465 24.682 12.392
223 H TYR 31 H TYR 31 27.271 29.558 11.373
224 HA TYR 31 HA TYR 31 25.555 31.792 12.027
225 HB2 TYR 31 HB2 TYR 31 28.275 31.526 10.720
226 HB3 TYR 31 HB3 TYR 31 27.479 33.076 10.917
227 HD1 TYR 31 HD1 TYR 31 28.656 30.115 12.945
228 HD2 TYR 31 HD2 TYR 31 27.770 34.324 12.873
229 HE1 TYR 31 HE1 TYR 31 29.643 30.369 15.216
230 HE2 TYR 31 HE2 TYR 31 28.780 34.576 15.132
231 HH TYR 31 HH TYR 31 29.764 33.516 16.900
Start of MODEL 7
1 H1 ALA 1 H1 ALA 1 11.742 28.558 33.029
2 H2 ALA 1 H2 ALA 1 12.054 28.148 34.590
3 H3 ALA 1 H3 ALA 1 10.959 27.290 33.711
4 HA ALA 1 HA ALA 1 12.905 26.013 33.892
5 HB1 ALA 1 HB1 ALA 1 13.426 25.659 31.515
6 HB2 ALA 1 HB2 ALA 1 11.686 25.824 31.778
7 HB3 ALA 1 HB3 ALA 1 12.609 27.187 31.104
8 H PHE 2 H PHE 2 15.084 25.750 33.907
9 HA PHE 2 HA PHE 2 16.770 28.228 33.737
10 HB2 PHE 2 HB2 PHE 2 17.109 25.850 35.584
11 HB3 PHE 2 HB3 PHE 2 18.120 27.284 35.529
12 HD1 PHE 2 HD1 PHE 2 17.001 29.571 36.045
13 HD2 PHE 2 HD2 PHE 2 15.204 25.782 37.018
14 HE1 PHE 2 HE1 PHE 2 15.599 30.685 37.771
15 HE2 PHE 2 HE2 PHE 2 13.787 26.887 38.720
16 HZ PHE 2 HZ PHE 2 13.998 29.334 39.129
17 H CYS 3 H CYS 3 18.704 28.151 32.685
18 HA CYS 3 HA CYS 3 19.820 25.655 31.593
19 HB2 CYS 3 HB2 CYS 3 17.972 26.279 30.088
20 HB3 CYS 3 HB3 CYS 3 18.661 27.882 29.866
21 H ASN 4 H ASN 4 21.990 25.832 31.078
22 HA ASN 4 HA ASN 4 23.327 28.449 31.549
23 HB2 ASN 4 HB2 ASN 4 24.617 25.745 31.170
24 HB3 ASN 4 HB3 ASN 4 25.411 27.287 31.433
25 HD21 ASN 4 HD21 ASN 4 24.309 27.535 34.897
26 HD22 ASN 4 HD22 ASN 4 24.757 28.507 33.518
27 H LEU 5 H LEU 5 22.066 29.125 29.656
28 HA LEU 5 HA LEU 5 22.800 28.566 26.939
29 HB2 LEU 5 HB2 LEU 5 20.775 29.789 27.547
30 HB3 LEU 5 HB3 LEU 5 21.725 31.048 28.334
31 HG LEU 5 HG LEU 5 22.686 31.727 26.147
32 HD11 LEU 5 HD11 LEU 5 21.681 30.869 24.060
33 HD12 LEU 5 HD12 LEU 5 22.529 29.581 24.913
34 HD13 LEU 5 HD13 LEU 5 20.754 29.669 24.990
35 HD21 LEU 5 HD21 LEU 5 20.670 32.817 27.008
36 HD22 LEU 5 HD22 LEU 5 20.606 32.699 25.247
37 HD23 LEU 5 HD23 LEU 5 19.643 31.583 26.250
38 H ARG 6 H ARG 6 24.204 30.760 29.422
39 HA ARG 6 HA ARG 6 26.189 32.008 27.777
40 HB2 ARG 6 HB2 ARG 6 26.250 31.231 30.732
41 HB3 ARG 6 HB3 ARG 6 27.467 32.232 29.959
42 HG2 ARG 6 HG2 ARG 6 24.520 32.903 30.347
43 HG3 ARG 6 HG3 ARG 6 25.899 33.619 31.178
44 HD2 ARG 6 HD2 ARG 6 25.149 33.927 28.250
45 HD3 ARG 6 HD3 ARG 6 25.106 35.160 29.514
46 HE ARG 6 HE ARG 6 27.783 34.142 29.261
47 HH11 ARG 6 HH11 ARG 6 25.613 36.285 27.483
48 HH12 ARG 6 HH12 ARG 6 26.995 37.217 26.894
49 HH21 ARG 6 HH21 ARG 6 29.346 35.238 28.349
50 HH22 ARG 6 HH22 ARG 6 28.992 36.418 27.073
51 H ARG 7 H ARG 7 26.615 29.058 29.766
52 HA ARG 7 HA ARG 7 29.250 28.467 28.793
53 HB2 ARG 7 HB2 ARG 7 28.338 27.507 30.878
54 HB3 ARG 7 HB3 ARG 7 27.134 26.595 29.963
55 HG2 ARG 7 HG2 ARG 7 28.700 25.115 29.058
56 HG3 ARG 7 HG3 ARG 7 30.061 26.216 29.280
57 HD2 ARG 7 HD2 ARG 7 28.575 24.979 31.621
58 HD3 ARG 7 HD3 ARG 7 29.958 24.201 30.833
59 HE ARG 7 HE ARG 7 30.708 26.876 31.458
60 HH11 ARG 7 HH11 ARG 7 30.115 23.866 33.285
61 HH12 ARG 7 HH12 ARG 7 31.423 24.312 34.369
62 HH21 ARG 7 HH21 ARG 7 32.238 27.223 32.923
63 HH22 ARG 7 HH22 ARG 7 32.521 26.042 34.207
64 H CYS 8 H CYS 8 26.053 27.350 27.752
65 HA CYS 8 HA CYS 8 26.852 25.601 25.670
66 HB2 CYS 8 HB2 CYS 8 24.568 25.801 26.540
67 HB3 CYS 8 HB3 CYS 8 24.443 27.432 25.886
68 H GLU 9 H GLU 9 26.159 29.177 25.360
69 HA GLU 9 HA GLU 9 26.824 29.211 22.556
70 HB2 GLU 9 HB2 GLU 9 26.739 31.433 24.661
71 HB3 GLU 9 HB3 GLU 9 27.131 31.703 22.955
72 HG2 GLU 9 HG2 GLU 9 24.899 30.568 22.414
73 HG3 GLU 9 HG3 GLU 9 24.481 30.746 24.106
74 H LEU 10 H LEU 10 28.824 30.054 25.457
75 HA LEU 10 HA LEU 10 31.117 30.847 23.903
76 HB2 LEU 10 HB2 LEU 10 30.584 30.169 26.798
77 HB3 LEU 10 HB3 LEU 10 32.239 30.218 26.264
78 HG LEU 10 HG LEU 10 31.484 32.317 27.303
79 HD11 LEU 10 HD11 LEU 10 32.494 33.832 25.698
80 HD12 LEU 10 HD12 LEU 10 33.382 32.306 25.740
81 HD13 LEU 10 HD13 LEU 10 32.277 32.662 24.387
82 HD21 LEU 10 HD21 LEU 10 29.172 32.466 26.457
83 HD22 LEU 10 HD22 LEU 10 30.108 33.922 26.098
84 HD23 LEU 10 HD23 LEU 10 29.788 32.745 24.814
85 H SER 11 H SER 11 30.179 27.692 25.249
86 HA SER 11 HA SER 11 32.583 26.282 24.491
87 HB2 SER 11 HB2 SER 11 30.999 25.478 26.209
88 HB3 SER 11 HB3 SER 11 29.749 25.293 24.984
89 HG SER 11 HG SER 11 30.587 23.335 25.172
90 H CYS 12 H CYS 12 29.480 26.924 22.753
91 HA CYS 12 HA CYS 12 30.210 25.133 20.556
92 HB2 CYS 12 HB2 CYS 12 28.015 27.204 20.908
93 HB3 CYS 12 HB3 CYS 12 28.233 26.195 19.473
94 H ARG 13 H ARG 13 30.478 28.649 21.203
95 HA ARG 13 HA ARG 13 31.441 29.425 18.605
96 HB2 ARG 13 HB2 ARG 13 31.663 30.513 21.438
97 HB3 ARG 13 HB3 ARG 13 32.464 31.283 20.089
98 HG2 ARG 13 HG2 ARG 13 30.361 31.625 18.897
99 HG3 ARG 13 HG3 ARG 13 29.479 30.682 20.100
100 HD2 ARG 13 HD2 ARG 13 29.070 33.021 20.497
101 HD3 ARG 13 HD3 ARG 13 30.033 32.382 21.839
102 HE ARG 13 HE ARG 13 31.869 33.404 19.954
103 HH11 ARG 13 HH11 ARG 13 29.284 34.941 21.847
104 HH12 ARG 13 HH12 ARG 13 30.174 36.462 21.808
105 HH21 ARG 13 HH21 ARG 13 32.791 35.339 19.987
106 HH22 ARG 13 HH22 ARG 13 31.971 36.691 20.795
107 H SER 14 H SER 14 33.137 28.073 21.431
108 HA SER 14 HA SER 14 35.791 28.190 20.418
109 HB2 SER 14 HB2 SER 14 35.227 27.624 22.742
110 HB3 SER 14 HB3 SER 14 34.478 26.114 22.208
111 HG SER 14 HG SER 14 37.193 26.849 22.206
112 H LEU 15 H LEU 15 33.163 25.992 19.542
113 HA LEU 15 HA LEU 15 34.909 24.302 17.838
114 HB2 LEU 15 HB2 LEU 15 31.891 24.217 18.182
115 HB3 LEU 15 HB3 LEU 15 32.920 22.997 17.447
116 HG LEU 15 HG LEU 15 32.796 23.746 20.397
117 HD11 LEU 15 HD11 LEU 15 31.939 21.463 20.663
118 HD12 LEU 15 HD12 LEU 15 30.907 22.396 19.567
119 HD13 LEU 15 HD13 LEU 15 32.045 21.199 18.910
120 HD21 LEU 15 HD21 LEU 15 35.108 23.136 19.877
121 HD22 LEU 15 HD22 LEU 15 34.324 21.823 20.764
122 HD23 LEU 15 HD23 LEU 15 34.545 21.691 19.006
123 H GLY 16 H GLY 16 32.570 26.921 17.496
124 HA2 GLY 16 HA2 GLY 16 32.822 28.378 15.510
125 HA3 GLY 16 HA3 GLY 16 32.980 26.943 14.515
126 H LEU 17 H LEU 17 30.501 27.273 17.100
127 HA LEU 17 HA LEU 17 28.416 27.799 15.083
128 HB2 LEU 17 HB2 LEU 17 27.077 25.936 16.426
129 HB3 LEU 17 HB3 LEU 17 27.890 25.674 14.902
130 HG LEU 17 HG LEU 17 29.072 24.875 17.590
131 HD11 LEU 17 HD11 LEU 17 28.266 22.628 17.048
132 HD12 LEU 17 HD12 LEU 17 26.898 23.738 17.030
133 HD13 LEU 17 HD13 LEU 17 27.596 23.201 15.501
134 HD21 LEU 17 HD21 LEU 17 30.331 23.200 16.134
135 HD22 LEU 17 HD22 LEU 17 29.781 24.101 14.708
136 HD23 LEU 17 HD23 LEU 17 30.856 24.848 15.908
137 H LEU 18 H LEU 18 26.403 28.496 15.834
138 HA LEU 18 HA LEU 18 26.582 30.211 18.259
139 HB2 LEU 18 HB2 LEU 18 24.675 30.077 15.891
140 HB3 LEU 18 HB3 LEU 18 24.453 31.193 17.239
141 HG LEU 18 HG LEU 18 26.924 31.146 15.487
142 HD11 LEU 18 HD11 LEU 18 25.964 33.097 14.347
143 HD12 LEU 18 HD12 LEU 18 24.941 31.670 14.141
144 HD13 LEU 18 HD13 LEU 18 24.474 32.938 15.303
145 HD21 LEU 18 HD21 LEU 18 27.304 32.258 17.655
146 HD22 LEU 18 HD22 LEU 18 27.275 33.427 16.337
147 HD23 LEU 18 HD23 LEU 18 25.857 33.278 17.381
148 H GLY 19 H GLY 19 25.209 30.033 19.997
149 HA2 GLY 19 HA2 GLY 19 23.534 27.555 20.112
150 HA3 GLY 19 HA3 GLY 19 24.360 28.252 21.476
151 H ALA 20 H ALA 20 21.549 27.520 20.819
152 HA ALA 20 HA ALA 20 20.346 29.781 22.261
153 HB1 ALA 20 HB1 ALA 20 19.769 30.140 19.881
154 HB2 ALA 20 HB2 ALA 20 19.065 28.508 19.804
155 HB3 ALA 20 HB3 ALA 20 18.341 29.747 20.853
156 H CYS 21 H CYS 21 18.850 29.183 23.734
157 HA CYS 21 HA CYS 21 18.522 26.256 24.263
158 HB2 CYS 21 HB2 CYS 21 20.000 27.463 25.855
159 HB3 CYS 21 HB3 CYS 21 18.617 28.452 26.347
160 H ILE 22 H ILE 22 16.651 25.353 24.448
161 HA ILE 22 HA ILE 22 14.168 27.039 24.645
162 HB ILE 22 HB ILE 22 14.546 24.285 23.439
163 HG12 ILE 22 HG12 ILE 22 13.741 26.941 22.176
164 HG13 ILE 22 HG13 ILE 22 15.338 26.194 22.026
165 HG21 ILE 22 HG21 ILE 22 12.136 24.371 22.899
166 HG22 ILE 22 HG22 ILE 22 12.375 24.421 24.639
167 HG23 ILE 22 HG23 ILE 22 11.999 25.920 23.758
168 HD11 ILE 22 HD11 ILE 22 12.729 25.128 20.866
169 HD12 ILE 22 HD12 ILE 22 14.149 25.741 20.011
170 HD13 ILE 22 HD13 ILE 22 14.261 24.217 20.904
171 H GLY 23 H GLY 23 13.534 27.182 26.641
172 HA2 GLY 23 HA2 GLY 23 13.103 26.761 28.835
173 HA3 GLY 23 HA3 GLY 23 12.845 25.080 28.385
174 H GLU 24 H GLU 24 14.368 23.613 28.881
175 HA GLU 24 HA GLU 24 16.803 24.475 30.393
176 HB2 GLU 24 HB2 GLU 24 16.681 22.572 31.710
177 HB3 GLU 24 HB3 GLU 24 15.031 23.156 31.585
178 HG2 GLU 24 HG2 GLU 24 14.597 21.382 29.839
179 HG3 GLU 24 HG3 GLU 24 16.239 20.793 30.076
180 H GLU 25 H GLU 25 16.080 23.246 27.326
181 HA GLU 25 HA GLU 25 18.600 21.638 27.157
182 HB2 GLU 25 HB2 GLU 25 16.087 21.514 25.490
183 HB3 GLU 25 HB3 GLU 25 17.615 20.751 25.049
184 HG2 GLU 25 HG2 GLU 25 17.533 19.584 27.341
185 HG3 GLU 25 HG3 GLU 25 15.832 20.075 27.405
186 H CYS 26 H CYS 26 20.278 22.563 26.157
187 HA CYS 26 HA CYS 26 19.779 24.737 24.180
188 HB2 CYS 26 HB2 CYS 26 21.095 25.248 26.259
189 HB3 CYS 26 HB3 CYS 26 22.351 24.173 25.652
190 H LYS 27 H LYS 27 20.505 24.738 22.169
191 HA LYS 27 HA LYS 27 22.430 22.662 21.265
192 HB2 LYS 27 HB2 LYS 27 19.745 23.189 19.896
193 HB3 LYS 27 HB3 LYS 27 21.094 22.305 19.166
194 HG2 LYS 27 HG2 LYS 27 20.970 20.710 21.136
195 HG3 LYS 27 HG3 LYS 27 19.471 21.558 21.600
196 HD2 LYS 27 HD2 LYS 27 18.762 21.084 19.099
197 HD3 LYS 27 HD3 LYS 27 20.028 19.842 19.151
198 HE2 LYS 27 HE2 LYS 27 17.690 20.176 21.060
199 HE3 LYS 27 HE3 LYS 27 17.764 18.990 19.745
200 HZ1 LYS 27 HZ1 LYS 27 18.335 17.938 21.816
201 HZ2 LYS 27 HZ2 LYS 27 19.704 17.985 20.898
202 HZ3 LYS 27 HZ3 LYS 27 19.499 19.025 22.160
203 H CYS 28 H CYS 28 23.652 23.202 19.464
204 HA CYS 28 HA CYS 28 23.445 26.029 18.561
205 HB2 CYS 28 HB2 CYS 28 25.939 26.120 18.556
206 HB3 CYS 28 HB3 CYS 28 25.203 26.097 20.123
207 H VAL 29 H VAL 29 24.215 26.598 16.526
208 HA VAL 29 HA VAL 29 24.446 24.407 14.509
209 HB VAL 29 HB VAL 29 22.711 25.343 13.134
210 HG11 VAL 29 HG11 VAL 29 22.011 23.728 14.888
211 HG12 VAL 29 HG12 VAL 29 21.554 25.094 15.933
212 HG13 VAL 29 HG13 VAL 29 20.732 24.836 14.387
213 HG21 VAL 29 HG21 VAL 29 22.304 27.463 15.267
214 HG22 VAL 29 HG22 VAL 29 22.913 27.727 13.619
215 HG23 VAL 29 HG23 VAL 29 21.251 27.191 13.865
216 HA PRO 30 HA PRO 30 27.500 26.650 12.474
217 HB2 PRO 30 HB2 PRO 30 25.812 26.647 9.937
218 HB3 PRO 30 HB3 PRO 30 27.547 26.288 10.117
219 HG2 PRO 30 HG2 PRO 30 25.835 24.239 9.995
220 HG3 PRO 30 HG3 PRO 30 27.087 24.217 11.277
221 HD2 PRO 30 HD2 PRO 30 24.176 25.070 11.475
222 HD3 PRO 30 HD3 PRO 30 25.115 24.005 12.558
223 H TYR 31 H TYR 31 28.322 28.576 11.616
224 HA TYR 31 HA TYR 31 27.029 31.040 12.324
225 HB2 TYR 31 HB2 TYR 31 29.464 30.469 10.584
226 HB3 TYR 31 HB3 TYR 31 28.966 32.061 11.118
227 HD1 TYR 31 HD1 TYR 31 31.637 31.434 11.517
228 HD2 TYR 31 HD2 TYR 31 28.313 30.384 14.032
229 HE1 TYR 31 HE1 TYR 31 33.153 31.390 13.495
230 HE2 TYR 31 HE2 TYR 31 29.814 30.404 16.024
231 HH TYR 31 HH TYR 31 33.333 30.986 15.738
Start of MODEL 8
1 H1 ALA 1 H1 ALA 1 14.546 21.570 34.502
2 H2 ALA 1 H2 ALA 1 13.397 22.484 35.235
3 H3 ALA 1 H3 ALA 1 14.413 21.536 36.130
4 HA ALA 1 HA ALA 1 14.963 23.886 36.251
5 HB1 ALA 1 HB1 ALA 1 16.701 22.201 36.677
6 HB2 ALA 1 HB2 ALA 1 17.033 22.066 34.941
7 HB3 ALA 1 HB3 ALA 1 17.398 23.568 35.807
8 H PHE 2 H PHE 2 16.474 25.495 34.960
9 HA PHE 2 HA PHE 2 15.598 25.673 32.107
10 HB2 PHE 2 HB2 PHE 2 16.312 27.896 34.033
11 HB3 PHE 2 HB3 PHE 2 15.961 28.111 32.324
12 HD1 PHE 2 HD1 PHE 2 14.533 27.778 35.635
13 HD2 PHE 2 HD2 PHE 2 13.658 27.331 31.432
14 HE1 PHE 2 HE1 PHE 2 12.106 27.786 36.121
15 HE2 PHE 2 HE2 PHE 2 11.227 27.377 31.933
16 HZ PHE 2 HZ PHE 2 10.453 27.589 34.285
17 H CYS 3 H CYS 3 17.046 26.386 30.545
18 HA CYS 3 HA CYS 3 19.533 25.155 30.563
19 HB2 CYS 3 HB2 CYS 3 19.767 26.100 28.375
20 HB3 CYS 3 HB3 CYS 3 18.084 25.781 28.621
21 H ASN 4 H ASN 4 21.642 25.933 30.190
22 HA ASN 4 HA ASN 4 22.425 28.587 31.326
23 HB2 ASN 4 HB2 ASN 4 23.776 25.884 31.289
24 HB3 ASN 4 HB3 ASN 4 24.731 27.344 31.260
25 HD21 ASN 4 HD21 ASN 4 23.955 28.384 34.542
26 HD22 ASN 4 HD22 ASN 4 24.505 28.872 32.935
27 H LEU 5 H LEU 5 21.727 29.526 29.361
28 HA LEU 5 HA LEU 5 22.622 28.742 26.776
29 HB2 LEU 5 HB2 LEU 5 20.695 30.179 27.077
30 HB3 LEU 5 HB3 LEU 5 21.693 31.409 27.848
31 HG LEU 5 HG LEU 5 22.897 31.819 25.720
32 HD11 LEU 5 HD11 LEU 5 20.894 29.849 24.527
33 HD12 LEU 5 HD12 LEU 5 21.973 30.912 23.609
34 HD13 LEU 5 HD13 LEU 5 22.662 29.628 24.608
35 HD21 LEU 5 HD21 LEU 5 20.895 33.121 26.331
36 HD22 LEU 5 HD22 LEU 5 21.053 32.931 24.579
37 HD23 LEU 5 HD23 LEU 5 19.882 31.945 25.466
38 H ARG 6 H ARG 6 24.227 30.897 29.190
39 HA ARG 6 HA ARG 6 26.284 31.734 27.343
40 HB2 ARG 6 HB2 ARG 6 26.150 31.737 30.377
41 HB3 ARG 6 HB3 ARG 6 27.486 32.408 29.430
42 HG2 ARG 6 HG2 ARG 6 25.947 33.956 28.280
43 HG3 ARG 6 HG3 ARG 6 24.563 33.283 29.142
44 HD2 ARG 6 HD2 ARG 6 25.301 35.419 30.106
45 HD3 ARG 6 HD3 ARG 6 25.416 34.090 31.274
46 HE ARG 6 HE ARG 6 27.916 34.144 30.125
47 HH11 ARG 6 HH11 ARG 6 26.112 36.802 31.578
48 HH12 ARG 6 HH12 ARG 6 27.536 37.368 32.424
49 HH21 ARG 6 HH21 ARG 6 29.666 35.155 30.924
50 HH22 ARG 6 HH22 ARG 6 29.474 36.662 31.831
51 H ARG 7 H ARG 7 26.303 29.000 29.757
52 HA ARG 7 HA ARG 7 28.953 28.129 29.093
53 HB2 ARG 7 HB2 ARG 7 27.654 27.193 31.014
54 HB3 ARG 7 HB3 ARG 7 26.515 26.469 29.881
55 HG2 ARG 7 HG2 ARG 7 27.999 24.752 30.606
56 HG3 ARG 7 HG3 ARG 7 28.396 25.060 28.923
57 HD2 ARG 7 HD2 ARG 7 29.906 26.514 31.095
58 HD3 ARG 7 HD3 ARG 7 30.239 24.788 30.812
59 HE ARG 7 HE ARG 7 30.429 25.943 28.294
60 HH11 ARG 7 HH11 ARG 7 32.082 26.351 31.365
61 HH12 ARG 7 HH12 ARG 7 33.602 26.747 30.596
62 HH21 ARG 7 HH21 ARG 7 32.406 26.118 27.411
63 HH22 ARG 7 HH22 ARG 7 33.792 26.603 28.384
64 H CYS 8 H CYS 8 25.814 27.254 27.748
65 HA CYS 8 HA CYS 8 26.626 25.408 25.764
66 HB2 CYS 8 HB2 CYS 8 24.348 25.761 26.492
67 HB3 CYS 8 HB3 CYS 8 24.368 27.412 25.945
68 H GLU 9 H GLU 9 26.097 28.965 25.353
69 HA GLU 9 HA GLU 9 26.947 29.119 22.635
70 HB2 GLU 9 HB2 GLU 9 26.776 31.083 24.953
71 HB3 GLU 9 HB3 GLU 9 27.469 31.606 23.421
72 HG2 GLU 9 HG2 GLU 9 24.762 30.283 23.352
73 HG3 GLU 9 HG3 GLU 9 24.884 31.909 23.971
74 H LEU 10 H LEU 10 28.846 29.646 25.670
75 HA LEU 10 HA LEU 10 31.274 30.300 24.264
76 HB2 LEU 10 HB2 LEU 10 30.504 29.673 27.119
77 HB3 LEU 10 HB3 LEU 10 32.184 29.618 26.699
78 HG LEU 10 HG LEU 10 31.412 31.788 27.663
79 HD11 LEU 10 HD11 LEU 10 32.664 31.940 24.889
80 HD12 LEU 10 HD12 LEU 10 32.736 33.186 26.151
81 HD13 LEU 10 HD13 LEU 10 33.510 31.625 26.421
82 HD21 LEU 10 HD21 LEU 10 30.141 32.290 24.936
83 HD22 LEU 10 HD22 LEU 10 29.265 32.094 26.473
84 HD23 LEU 10 HD23 LEU 10 30.354 33.463 26.246
85 H SER 11 H SER 11 30.104 27.099 25.544
86 HA SER 11 HA SER 11 32.514 25.715 24.775
87 HB2 SER 11 HB2 SER 11 29.659 24.722 25.068
88 HB3 SER 11 HB3 SER 11 31.083 23.684 24.833
89 HG SER 11 HG SER 11 30.665 23.871 27.023
90 H CYS 12 H CYS 12 29.741 26.768 22.806
91 HA CYS 12 HA CYS 12 30.686 25.154 20.503
92 HB2 CYS 12 HB2 CYS 12 28.350 27.073 20.593
93 HB3 CYS 12 HB3 CYS 12 28.717 25.925 19.399
94 H ARG 13 H ARG 13 30.931 28.458 21.632
95 HA ARG 13 HA ARG 13 31.650 29.785 19.230
96 HB2 ARG 13 HB2 ARG 13 31.222 30.733 21.582
97 HB3 ARG 13 HB3 ARG 13 32.865 30.271 22.001
98 HG2 ARG 13 HG2 ARG 13 33.762 31.817 20.370
99 HG3 ARG 13 HG3 ARG 13 32.175 32.113 19.651
100 HD2 ARG 13 HD2 ARG 13 32.820 32.777 22.565
101 HD3 ARG 13 HD3 ARG 13 33.072 33.911 21.228
102 HE ARG 13 HE ARG 13 30.451 33.143 20.886
103 HH11 ARG 13 HH11 ARG 13 32.098 34.733 23.614
104 HH12 ARG 13 HH12 ARG 13 30.650 35.648 23.960
105 HH21 ARG 13 HH21 ARG 13 28.844 34.481 21.341
106 HH22 ARG 13 HH22 ARG 13 28.869 35.460 22.796
107 H SER 14 H SER 14 33.551 27.629 21.285
108 HA SER 14 HA SER 14 36.075 27.867 19.961
109 HB2 SER 14 HB2 SER 14 34.864 25.375 21.208
110 HB3 SER 14 HB3 SER 14 36.582 25.730 20.982
111 HG SER 14 HG SER 14 35.573 26.112 23.127
112 H LEU 15 H LEU 15 33.112 26.377 18.874
113 HA LEU 15 HA LEU 15 34.460 24.713 16.794
114 HB2 LEU 15 HB2 LEU 15 31.620 24.534 17.856
115 HB3 LEU 15 HB3 LEU 15 32.441 23.377 16.812
116 HG LEU 15 HG LEU 15 33.066 23.961 19.731
117 HD11 LEU 15 HD11 LEU 15 32.217 21.640 20.045
118 HD12 LEU 15 HD12 LEU 15 30.980 22.701 19.363
119 HD13 LEU 15 HD13 LEU 15 31.838 21.549 18.316
120 HD21 LEU 15 HD21 LEU 15 34.585 21.995 19.578
121 HD22 LEU 15 HD22 LEU 15 34.312 21.928 17.825
122 HD23 LEU 15 HD23 LEU 15 35.142 23.321 18.555
123 H GLY 16 H GLY 16 33.084 27.697 16.977
124 HA2 GLY 16 HA2 GLY 16 32.381 29.163 15.320
125 HA3 GLY 16 HA3 GLY 16 32.623 27.890 14.119
126 H LEU 17 H LEU 17 30.427 27.590 16.917
127 HA LEU 17 HA LEU 17 28.079 27.696 15.059
128 HB2 LEU 17 HB2 LEU 17 27.945 26.083 17.568
129 HB3 LEU 17 HB3 LEU 17 27.008 25.927 16.119
130 HG LEU 17 HG LEU 17 29.844 25.083 16.563
131 HD11 LEU 17 HD11 LEU 17 28.410 23.596 17.721
132 HD12 LEU 17 HD12 LEU 17 27.295 23.464 16.336
133 HD13 LEU 17 HD13 LEU 17 28.924 22.763 16.264
134 HD21 LEU 17 HD21 LEU 17 29.480 25.611 14.126
135 HD22 LEU 17 HD22 LEU 17 29.517 23.863 14.316
136 HD23 LEU 17 HD23 LEU 17 27.965 24.686 14.150
137 H LEU 18 H LEU 18 26.254 28.718 15.767
138 HA LEU 18 HA LEU 18 26.449 30.419 18.196
139 HB2 LEU 18 HB2 LEU 18 24.692 31.695 17.288
140 HB3 LEU 18 HB3 LEU 18 25.823 31.383 15.993
141 HG LEU 18 HG LEU 18 24.060 29.326 15.572
142 HD11 LEU 18 HD11 LEU 18 22.433 31.713 16.538
143 HD12 LEU 18 HD12 LEU 18 21.788 30.231 15.797
144 HD13 LEU 18 HD13 LEU 18 22.560 30.160 17.387
145 HD21 LEU 18 HD21 LEU 18 23.884 32.165 14.513
146 HD22 LEU 18 HD22 LEU 18 24.799 30.799 13.823
147 HD23 LEU 18 HD23 LEU 18 23.036 30.761 13.823
148 H GLY 19 H GLY 19 25.391 29.907 20.053
149 HA2 GLY 19 HA2 GLY 19 23.804 27.453 20.224
150 HA3 GLY 19 HA3 GLY 19 24.240 28.481 21.547
151 H ALA 20 H ALA 20 21.771 27.206 21.170
152 HA ALA 20 HA ALA 20 19.883 29.451 21.378
153 HB1 ALA 20 HB1 ALA 20 19.788 28.813 18.986
154 HB2 ALA 20 HB2 ALA 20 19.492 27.119 19.438
155 HB3 ALA 20 HB3 ALA 20 18.291 28.376 19.824
156 H CYS 21 H CYS 21 18.517 29.122 23.002
157 HA CYS 21 HA CYS 21 18.705 26.628 24.601
158 HB2 CYS 21 HB2 CYS 21 19.150 28.676 25.739
159 HB3 CYS 21 HB3 CYS 21 17.708 29.429 25.115
160 H ILE 22 H ILE 22 17.137 25.090 24.616
161 HA ILE 22 HA ILE 22 14.476 25.584 23.520
162 HB ILE 22 HB ILE 22 15.808 23.755 22.644
163 HG12 ILE 22 HG12 ILE 22 13.608 22.485 24.245
164 HG13 ILE 22 HG13 ILE 22 13.269 23.722 23.025
165 HG21 ILE 22 HG21 ILE 22 17.232 23.075 24.457
166 HG22 ILE 22 HG22 ILE 22 15.839 22.637 25.483
167 HG23 ILE 22 HG23 ILE 22 16.234 21.697 24.042
168 HD11 ILE 22 HD11 ILE 22 14.394 22.332 21.300
169 HD12 ILE 22 HD12 ILE 22 14.656 21.056 22.511
170 HD13 ILE 22 HD13 ILE 22 13.008 21.502 22.039
171 H GLY 23 H GLY 23 15.040 26.971 25.838
172 HA2 GLY 23 HA2 GLY 23 14.031 27.551 27.803
173 HA3 GLY 23 HA3 GLY 23 12.926 26.188 27.626
174 H GLU 24 H GLU 24 14.036 23.974 28.058
175 HA GLU 24 HA GLU 24 15.157 24.019 30.760
176 HB2 GLU 24 HB2 GLU 24 14.847 21.650 30.730
177 HB3 GLU 24 HB3 GLU 24 13.408 22.413 30.065
178 HG2 GLU 24 HG2 GLU 24 14.144 21.837 27.772
179 HG3 GLU 24 HG3 GLU 24 15.638 21.167 28.420
180 H GLU 25 H GLU 25 16.424 23.536 27.527
181 HA GLU 25 HA GLU 25 19.160 22.942 28.547
182 HB2 GLU 25 HB2 GLU 25 17.330 21.165 26.992
183 HB3 GLU 25 HB3 GLU 25 18.930 21.271 26.348
184 HG2 GLU 25 HG2 GLU 25 18.383 20.643 29.276
185 HG3 GLU 25 HG3 GLU 25 18.554 19.414 28.011
186 H CYS 26 H CYS 26 20.666 22.773 26.445
187 HA CYS 26 HA CYS 26 19.866 24.664 24.336
188 HB2 CYS 26 HB2 CYS 26 20.596 26.159 26.064
189 HB3 CYS 26 HB3 CYS 26 22.100 25.296 26.283
190 H LYS 27 H LYS 27 20.925 24.578 22.516
191 HA LYS 27 HA LYS 27 23.121 22.622 21.960
192 HB2 LYS 27 HB2 LYS 27 20.453 22.889 20.504
193 HB3 LYS 27 HB3 LYS 27 21.808 21.947 19.912
194 HG2 LYS 27 HG2 LYS 27 20.583 21.304 22.605
195 HG3 LYS 27 HG3 LYS 27 19.793 20.801 21.126
196 HD2 LYS 27 HD2 LYS 27 22.671 20.078 21.752
197 HD3 LYS 27 HD3 LYS 27 21.265 19.094 22.206
198 HE2 LYS 27 HE2 LYS 27 20.583 19.041 19.779
199 HE3 LYS 27 HE3 LYS 27 22.128 19.814 19.377
200 HZ1 LYS 27 HZ1 LYS 27 21.874 17.205 20.793
201 HZ2 LYS 27 HZ2 LYS 27 22.189 17.353 19.204
202 HZ3 LYS 27 HZ3 LYS 27 23.280 17.886 20.302
203 H CYS 28 H CYS 28 23.884 23.062 19.585
204 HA CYS 28 HA CYS 28 23.593 25.927 18.806
205 HB2 CYS 28 HB2 CYS 28 26.070 26.101 18.692
206 HB3 CYS 28 HB3 CYS 28 25.391 25.997 20.304
207 H VAL 29 H VAL 29 24.481 26.506 16.713
208 HA VAL 29 HA VAL 29 24.516 24.362 14.677
209 HB VAL 29 HB VAL 29 22.794 25.480 13.353
210 HG11 VAL 29 HG11 VAL 29 22.175 23.620 14.887
211 HG12 VAL 29 HG12 VAL 29 21.707 24.827 16.122
212 HG13 VAL 29 HG13 VAL 29 20.854 24.751 14.565
213 HG21 VAL 29 HG21 VAL 29 22.944 27.782 14.162
214 HG22 VAL 29 HG22 VAL 29 21.304 27.176 14.376
215 HG23 VAL 29 HG23 VAL 29 22.388 27.292 15.778
216 HA PRO 30 HA PRO 30 27.484 26.901 12.636
217 HB2 PRO 30 HB2 PRO 30 26.259 26.181 9.987
218 HB3 PRO 30 HB3 PRO 30 27.955 26.010 10.530
219 HG2 PRO 30 HG2 PRO 30 26.331 23.848 10.404
220 HG3 PRO 30 HG3 PRO 30 27.432 24.063 11.805
221 HD2 PRO 30 HD2 PRO 30 24.478 24.737 11.615
222 HD3 PRO 30 HD3 PRO 30 25.360 23.836 12.891
223 H TYR 31 H TYR 31 27.917 28.905 11.691
224 HA TYR 31 HA TYR 31 25.860 30.898 11.569
225 HB2 TYR 31 HB2 TYR 31 28.604 31.148 10.319
226 HB3 TYR 31 HB3 TYR 31 27.587 32.414 10.945
227 HD1 TYR 31 HD1 TYR 31 30.597 31.193 11.473
228 HD2 TYR 31 HD2 TYR 31 26.925 31.577 13.692
229 HE1 TYR 31 HE1 TYR 31 31.884 31.247 13.594
230 HE2 TYR 31 HE2 TYR 31 28.197 31.590 15.823
231 HH TYR 31 HH TYR 31 30.338 31.412 16.799
Start of MODEL 9
1 H1 ALA 1 H1 ALA 1 20.015 17.873 31.115
2 H2 ALA 1 H2 ALA 1 21.571 18.050 31.590
3 H3 ALA 1 H3 ALA 1 20.864 19.210 30.656
4 HA ALA 1 HA ALA 1 19.244 19.614 32.434
5 HB1 ALA 1 HB1 ALA 1 19.563 17.413 33.565
6 HB2 ALA 1 HB2 ALA 1 21.175 17.948 34.096
7 HB3 ALA 1 HB3 ALA 1 19.726 18.780 34.677
8 H PHE 2 H PHE 2 19.750 21.149 34.229
9 HA PHE 2 HA PHE 2 20.595 23.142 34.858
10 HB2 PHE 2 HB2 PHE 2 23.232 21.654 34.667
11 HB3 PHE 2 HB3 PHE 2 23.014 23.225 35.416
12 HD1 PHE 2 HD1 PHE 2 21.672 23.510 37.475
13 HD2 PHE 2 HD2 PHE 2 22.531 19.617 35.826
14 HE1 PHE 2 HE1 PHE 2 21.076 22.461 39.649
15 HE2 PHE 2 HE2 PHE 2 21.925 18.567 37.994
16 HZ PHE 2 HZ PHE 2 21.205 19.990 39.906
17 H CYS 3 H CYS 3 19.727 23.906 32.745
18 HA CYS 3 HA CYS 3 21.527 24.531 30.597
19 HB2 CYS 3 HB2 CYS 3 18.739 25.220 31.303
20 HB3 CYS 3 HB3 CYS 3 19.577 26.528 30.495
21 H ASN 4 H ASN 4 22.561 26.339 29.999
22 HA ASN 4 HA ASN 4 22.328 28.906 31.325
23 HB2 ASN 4 HB2 ASN 4 24.161 27.678 32.645
24 HB3 ASN 4 HB3 ASN 4 25.036 27.576 31.116
25 HD21 ASN 4 HD21 ASN 4 24.462 31.291 32.733
26 HD22 ASN 4 HD22 ASN 4 23.339 29.968 33.111
27 H LEU 5 H LEU 5 21.995 30.151 29.687
28 HA LEU 5 HA LEU 5 22.368 29.422 26.957
29 HB2 LEU 5 HB2 LEU 5 20.680 31.033 27.653
30 HB3 LEU 5 HB3 LEU 5 21.915 32.120 28.288
31 HG LEU 5 HG LEU 5 22.771 32.551 26.021
32 HD11 LEU 5 HD11 LEU 5 22.223 30.429 24.899
33 HD12 LEU 5 HD12 LEU 5 20.473 30.775 25.084
34 HD13 LEU 5 HD13 LEU 5 21.501 31.786 24.045
35 HD21 LEU 5 HD21 LEU 5 20.839 33.824 25.194
36 HD22 LEU 5 HD22 LEU 5 19.747 32.893 26.245
37 HD23 LEU 5 HD23 LEU 5 20.979 33.970 26.951
38 H ARG 6 H ARG 6 24.344 31.450 29.112
39 HA ARG 6 HA ARG 6 26.311 32.162 27.096
40 HB2 ARG 6 HB2 ARG 6 26.354 32.157 30.131
41 HB3 ARG 6 HB3 ARG 6 27.765 32.622 29.195
42 HG2 ARG 6 HG2 ARG 6 25.091 33.982 28.678
43 HG3 ARG 6 HG3 ARG 6 26.086 34.418 30.064
44 HD2 ARG 6 HD2 ARG 6 26.725 35.962 28.501
45 HD3 ARG 6 HD3 ARG 6 28.030 34.776 28.445
46 HE ARG 6 HE ARG 6 26.174 34.075 26.399
47 HH11 ARG 6 HH11 ARG 6 28.262 36.849 27.096
48 HH12 ARG 6 HH12 ARG 6 28.060 37.433 25.429
49 HH21 ARG 6 HH21 ARG 6 26.218 34.828 24.335
50 HH22 ARG 6 HH22 ARG 6 27.115 36.319 23.964
51 H ARG 7 H ARG 7 26.410 29.537 29.571
52 HA ARG 7 HA ARG 7 28.937 28.513 28.694
53 HB2 ARG 7 HB2 ARG 7 27.607 27.926 30.836
54 HB3 ARG 7 HB3 ARG 7 26.729 26.756 29.830
55 HG2 ARG 7 HG2 ARG 7 28.942 25.684 29.248
56 HG3 ARG 7 HG3 ARG 7 29.738 26.881 30.267
57 HD2 ARG 7 HD2 ARG 7 29.585 25.093 31.748
58 HD3 ARG 7 HD3 ARG 7 28.160 26.017 32.166
59 HE ARG 7 HE ARG 7 26.778 24.398 31.187
60 HH11 ARG 7 HH11 ARG 7 30.109 23.452 30.487
61 HH12 ARG 7 HH12 ARG 7 29.603 21.838 30.015
62 HH21 ARG 7 HH21 ARG 7 26.316 22.246 30.971
63 HH22 ARG 7 HH22 ARG 7 27.485 21.195 30.230
64 H CYS 8 H CYS 8 25.648 27.752 27.563
65 HA CYS 8 HA CYS 8 26.391 25.722 25.705
66 HB2 CYS 8 HB2 CYS 8 24.112 26.144 26.519
67 HB3 CYS 8 HB3 CYS 8 24.084 27.699 25.682
68 H GLU 9 H GLU 9 26.081 29.297 25.213
69 HA GLU 9 HA GLU 9 26.919 29.224 22.450
70 HB2 GLU 9 HB2 GLU 9 26.985 31.384 24.614
71 HB3 GLU 9 HB3 GLU 9 27.561 31.677 22.973
72 HG2 GLU 9 HG2 GLU 9 25.399 31.122 22.034
73 HG3 GLU 9 HG3 GLU 9 24.746 30.741 23.638
74 H LEU 10 H LEU 10 28.795 29.841 25.453
75 HA LEU 10 HA LEU 10 31.284 30.332 24.146
76 HB2 LEU 10 HB2 LEU 10 30.357 29.761 26.968
77 HB3 LEU 10 HB3 LEU 10 32.058 29.783 26.632
78 HG LEU 10 HG LEU 10 30.973 31.925 27.521
79 HD11 LEU 10 HD11 LEU 10 32.774 32.012 25.081
80 HD12 LEU 10 HD12 LEU 10 32.569 33.317 26.278
81 HD13 LEU 10 HD13 LEU 10 33.259 31.770 26.775
82 HD21 LEU 10 HD21 LEU 10 30.220 33.578 25.906
83 HD22 LEU 10 HD22 LEU 10 30.286 32.392 24.590
84 HD23 LEU 10 HD23 LEU 10 29.112 32.214 25.908
85 H SER 11 H SER 11 29.908 27.272 25.378
86 HA SER 11 HA SER 11 32.308 25.726 24.921
87 HB2 SER 11 HB2 SER 11 30.466 25.037 26.447
88 HB3 SER 11 HB3 SER 11 29.402 24.801 25.058
89 HG SER 11 HG SER 11 30.563 23.057 24.442
90 H CYS 12 H CYS 12 29.712 26.792 22.765
91 HA CYS 12 HA CYS 12 30.688 25.029 20.574
92 HB2 CYS 12 HB2 CYS 12 28.278 26.862 20.594
93 HB3 CYS 12 HB3 CYS 12 28.759 25.762 19.370
94 H ARG 13 H ARG 13 30.985 28.306 21.628
95 HA ARG 13 HA ARG 13 31.688 29.672 19.245
96 HB2 ARG 13 HB2 ARG 13 31.454 30.736 21.440
97 HB3 ARG 13 HB3 ARG 13 32.869 29.872 22.056
98 HG2 ARG 13 HG2 ARG 13 34.346 31.055 20.518
99 HG3 ARG 13 HG3 ARG 13 32.977 31.847 19.735
100 HD2 ARG 13 HD2 ARG 13 33.783 32.190 22.647
101 HD3 ARG 13 HD3 ARG 13 34.192 33.309 21.337
102 HE ARG 13 HE ARG 13 31.403 33.101 21.231
103 HH11 ARG 13 HH11 ARG 13 33.661 34.176 23.753
104 HH12 ARG 13 HH12 ARG 13 32.420 35.273 24.373
105 HH21 ARG 13 HH21 ARG 13 30.004 34.425 22.196
106 HH22 ARG 13 HH22 ARG 13 30.525 35.412 23.585
107 H SER 14 H SER 14 33.594 27.387 21.196
108 HA SER 14 HA SER 14 36.012 27.511 19.672
109 HB2 SER 14 HB2 SER 14 34.798 25.217 21.268
110 HB3 SER 14 HB3 SER 14 36.475 25.276 20.682
111 HG SER 14 HG SER 14 36.057 26.068 22.929
112 H LEU 15 H LEU 15 32.999 25.746 19.123
113 HA LEU 15 HA LEU 15 34.036 24.241 16.811
114 HB2 LEU 15 HB2 LEU 15 31.221 24.442 17.937
115 HB3 LEU 15 HB3 LEU 15 31.805 23.263 16.769
116 HG LEU 15 HG LEU 15 32.644 23.507 19.688
117 HD11 LEU 15 HD11 LEU 15 30.991 21.400 18.243
118 HD12 LEU 15 HD12 LEU 15 31.428 21.386 19.960
119 HD13 LEU 15 HD13 LEU 15 30.347 22.644 19.340
120 HD21 LEU 15 HD21 LEU 15 34.517 22.612 18.379
121 HD22 LEU 15 HD22 LEU 15 33.779 21.315 19.320
122 HD23 LEU 15 HD23 LEU 15 33.439 21.445 17.579
123 H GLY 16 H GLY 16 33.005 27.408 17.229
124 HA2 GLY 16 HA2 GLY 16 32.555 29.070 15.681
125 HA3 GLY 16 HA3 GLY 16 32.750 27.898 14.373
126 H LEU 17 H LEU 17 30.435 27.814 17.100
127 HA LEU 17 HA LEU 17 28.138 28.103 15.215
128 HB2 LEU 17 HB2 LEU 17 27.945 26.278 17.570
129 HB3 LEU 17 HB3 LEU 17 27.025 26.234 16.102
130 HG LEU 17 HG LEU 17 29.871 25.360 16.459
131 HD11 LEU 17 HD11 LEU 17 28.952 23.068 16.164
132 HD12 LEU 17 HD12 LEU 17 28.523 23.865 17.666
133 HD13 LEU 17 HD13 LEU 17 27.319 23.746 16.348
134 HD21 LEU 17 HD21 LEU 17 29.335 25.919 14.041
135 HD22 LEU 17 HD22 LEU 17 29.620 24.204 14.262
136 HD23 LEU 17 HD23 LEU 17 27.954 24.806 14.124
137 H LEU 18 H LEU 18 26.298 29.073 16.031
138 HA LEU 18 HA LEU 18 26.440 30.695 18.514
139 HB2 LEU 18 HB2 LEU 18 24.210 30.167 16.495
140 HB3 LEU 18 HB3 LEU 18 24.078 31.280 17.856
141 HG LEU 18 HG LEU 18 26.137 31.591 15.646
142 HD11 LEU 18 HD11 LEU 18 23.914 31.666 14.670
143 HD12 LEU 18 HD12 LEU 18 23.399 32.852 15.884
144 HD13 LEU 18 HD13 LEU 18 24.651 33.274 14.687
145 HD21 LEU 18 HD21 LEU 18 26.677 32.819 17.731
146 HD22 LEU 18 HD22 LEU 18 26.233 33.926 16.423
147 HD23 LEU 18 HD23 LEU 18 25.063 33.561 17.706
148 H GLY 19 H GLY 19 25.750 29.871 20.466
149 HA2 GLY 19 HA2 GLY 19 24.075 27.402 20.462
150 HA3 GLY 19 HA3 GLY 19 24.998 27.977 21.815
151 H ALA 20 H ALA 20 22.277 27.113 21.558
152 HA ALA 20 HA ALA 20 21.070 29.250 23.196
153 HB1 ALA 20 HB1 ALA 20 19.560 27.706 21.051
154 HB2 ALA 20 HB2 ALA 20 18.850 28.825 22.231
155 HB3 ALA 20 HB3 ALA 20 19.971 29.439 21.003
156 H CYS 21 H CYS 21 20.360 28.445 25.090
157 HA CYS 21 HA CYS 21 20.164 25.482 25.413
158 HB2 CYS 21 HB2 CYS 21 21.790 26.926 26.816
159 HB3 CYS 21 HB3 CYS 21 20.349 27.358 27.755
160 H ILE 22 H ILE 22 18.287 24.557 25.884
161 HA ILE 22 HA ILE 22 15.840 26.278 26.099
162 HB ILE 22 HB ILE 22 16.182 23.658 24.604
163 HG12 ILE 22 HG12 ILE 22 17.429 25.366 23.399
164 HG13 ILE 22 HG13 ILE 22 15.984 24.896 22.529
165 HG21 ILE 22 HG21 ILE 22 13.940 24.233 23.657
166 HG22 ILE 22 HG22 ILE 22 13.890 23.942 25.394
167 HG23 ILE 22 HG23 ILE 22 13.830 25.603 24.782
168 HD11 ILE 22 HD11 ILE 22 14.844 26.979 23.166
169 HD12 ILE 22 HD12 ILE 22 16.242 27.468 24.149
170 HD13 ILE 22 HD13 ILE 22 16.406 27.321 22.397
171 H GLY 23 H GLY 23 15.686 26.180 28.286
172 HA2 GLY 23 HA2 GLY 23 14.795 25.452 30.259
173 HA3 GLY 23 HA3 GLY 23 14.250 23.993 29.439
174 H GLU 24 H GLU 24 16.323 22.565 28.850
175 HA GLU 24 HA GLU 24 18.142 22.278 31.205
176 HB2 GLU 24 HB2 GLU 24 17.522 19.959 31.493
177 HB3 GLU 24 HB3 GLU 24 16.080 20.965 31.628
178 HG2 GLU 24 HG2 GLU 24 15.577 20.405 29.188
179 HG3 GLU 24 HG3 GLU 24 16.931 19.273 29.231
180 H GLU 25 H GLU 25 17.734 22.038 27.786
181 HA GLU 25 HA GLU 25 20.204 20.395 27.467
182 HB2 GLU 25 HB2 GLU 25 18.315 19.107 26.756
183 HB3 GLU 25 HB3 GLU 25 17.613 20.481 25.912
184 HG2 GLU 25 HG2 GLU 25 18.396 18.997 24.269
185 HG3 GLU 25 HG3 GLU 25 19.451 20.391 24.217
186 H CYS 26 H CYS 26 21.778 21.141 26.098
187 HA CYS 26 HA CYS 26 21.456 23.867 24.929
188 HB2 CYS 26 HB2 CYS 26 23.303 23.749 26.376
189 HB3 CYS 26 HB3 CYS 26 23.822 22.191 25.728
190 H LYS 27 H LYS 27 21.534 24.290 22.818
191 HA LYS 27 HA LYS 27 22.530 22.272 20.878
192 HB2 LYS 27 HB2 LYS 27 20.651 22.710 19.366
193 HB3 LYS 27 HB3 LYS 27 20.134 21.945 20.870
194 HG2 LYS 27 HG2 LYS 27 19.376 24.139 21.757
195 HG3 LYS 27 HG3 LYS 27 19.852 24.931 20.246
196 HD2 LYS 27 HD2 LYS 27 17.806 22.702 20.458
197 HD3 LYS 27 HD3 LYS 27 17.429 24.422 20.486
198 HE2 LYS 27 HE2 LYS 27 18.251 24.766 18.247
199 HE3 LYS 27 HE3 LYS 27 18.951 23.134 18.181
200 HZ1 LYS 27 HZ1 LYS 27 16.040 23.627 18.435
201 HZ2 LYS 27 HZ2 LYS 27 16.814 23.338 17.001
202 HZ3 LYS 27 HZ3 LYS 27 16.798 22.190 18.194
203 H CYS 28 H CYS 28 23.767 23.112 19.273
204 HA CYS 28 HA CYS 28 23.653 26.048 18.833
205 HB2 CYS 28 HB2 CYS 28 26.136 26.082 18.715
206 HB3 CYS 28 HB3 CYS 28 25.443 25.860 20.305
207 H VAL 29 H VAL 29 24.518 26.842 16.828
208 HA VAL 29 HA VAL 29 24.264 24.962 14.551
209 HB VAL 29 HB VAL 29 22.647 26.399 13.447
210 HG11 VAL 29 HG11 VAL 29 21.624 25.564 16.189
211 HG12 VAL 29 HG12 VAL 29 20.688 25.755 14.700
212 HG13 VAL 29 HG13 VAL 29 21.885 24.458 14.816
213 HG21 VAL 29 HG21 VAL 29 23.090 28.569 14.522
214 HG22 VAL 29 HG22 VAL 29 21.389 28.115 14.690
215 HG23 VAL 29 HG23 VAL 29 22.488 27.937 16.070
216 HA PRO 30 HA PRO 30 27.685 26.969 12.964
217 HB2 PRO 30 HB2 PRO 30 26.511 26.894 10.197
218 HB3 PRO 30 HB3 PRO 30 28.117 26.328 10.760
219 HG2 PRO 30 HG2 PRO 30 26.124 24.549 10.324
220 HG3 PRO 30 HG3 PRO 30 27.156 24.400 11.790
221 HD2 PRO 30 HD2 PRO 30 24.391 25.621 11.554
222 HD3 PRO 30 HD3 PRO 30 25.032 24.473 12.765
223 H TYR 31 H TYR 31 28.622 28.864 12.713
224 HA TYR 31 HA TYR 31 27.413 31.389 12.771
225 HB2 TYR 31 HB2 TYR 31 30.164 30.378 11.970
226 HB3 TYR 31 HB3 TYR 31 29.789 32.079 11.985
227 HD1 TYR 31 HD1 TYR 31 28.001 31.013 14.774
228 HD2 TYR 31 HD2 TYR 31 32.035 31.511 13.367
229 HE1 TYR 31 HE1 TYR 31 28.770 31.426 17.112
230 HE2 TYR 31 HE2 TYR 31 32.805 31.887 15.707
231 HH TYR 31 HH TYR 31 31.962 32.574 17.828
Start of MODEL 10
1 H1 ALA 1 H1 ALA 1 13.962 22.043 35.014
2 H2 ALA 1 H2 ALA 1 14.170 20.406 34.833
3 H3 ALA 1 H3 ALA 1 14.268 21.404 33.526
4 HA ALA 1 HA ALA 1 16.115 21.359 35.802
5 HB1 ALA 1 HB1 ALA 1 16.430 19.411 34.328
6 HB2 ALA 1 HB2 ALA 1 16.544 20.486 32.909
7 HB3 ALA 1 HB3 ALA 1 17.791 20.537 34.174
8 H PHE 2 H PHE 2 17.954 22.772 35.633
9 HA PHE 2 HA PHE 2 17.362 25.408 34.494
10 HB2 PHE 2 HB2 PHE 2 19.781 24.265 35.941
11 HB3 PHE 2 HB3 PHE 2 19.606 25.950 35.474
12 HD1 PHE 2 HD1 PHE 2 17.474 27.223 36.309
13 HD2 PHE 2 HD2 PHE 2 19.149 23.696 38.150
14 HE1 PHE 2 HE1 PHE 2 16.490 27.882 38.485
15 HE2 PHE 2 HE2 PHE 2 18.170 24.382 40.324
16 HZ PHE 2 HZ PHE 2 16.851 26.474 40.500
17 H CYS 3 H CYS 3 19.143 26.589 33.364
18 HA CYS 3 HA CYS 3 21.028 25.023 31.765
19 HB2 CYS 3 HB2 CYS 3 18.929 25.094 30.410
20 HB3 CYS 3 HB3 CYS 3 18.998 26.852 30.410
21 H ASN 4 H ASN 4 22.799 26.259 31.025
22 HA ASN 4 HA ASN 4 22.858 29.156 31.778
23 HB2 ASN 4 HB2 ASN 4 24.537 27.570 33.032
24 HB3 ASN 4 HB3 ASN 4 25.318 27.468 31.469
25 HD21 ASN 4 HD21 ASN 4 25.334 31.109 33.334
26 HD22 ASN 4 HD22 ASN 4 23.982 30.002 33.632
27 H LEU 5 H LEU 5 22.129 29.929 29.972
28 HA LEU 5 HA LEU 5 22.634 29.128 27.283
29 HB2 LEU 5 HB2 LEU 5 20.770 30.584 27.977
30 HB3 LEU 5 HB3 LEU 5 21.911 31.840 28.473
31 HG LEU 5 HG LEU 5 22.641 32.115 26.118
32 HD11 LEU 5 HD11 LEU 5 20.427 30.102 25.554
33 HD12 LEU 5 HD12 LEU 5 21.212 31.116 24.331
34 HD13 LEU 5 HD13 LEU 5 22.163 29.900 25.189
35 HD21 LEU 5 HD21 LEU 5 20.586 33.214 25.339
36 HD22 LEU 5 HD22 LEU 5 19.627 32.307 26.529
37 HD23 LEU 5 HD23 LEU 5 20.824 33.501 27.070
38 H ARG 6 H ARG 6 24.394 31.418 29.411
39 HA ARG 6 HA ARG 6 26.351 32.249 27.460
40 HB2 ARG 6 HB2 ARG 6 26.567 32.002 30.497
41 HB3 ARG 6 HB3 ARG 6 27.750 32.808 29.476
42 HG2 ARG 6 HG2 ARG 6 24.849 33.688 29.839
43 HG3 ARG 6 HG3 ARG 6 26.264 34.381 30.614
44 HD2 ARG 6 HD2 ARG 6 25.945 35.882 28.902
45 HD3 ARG 6 HD3 ARG 6 27.147 34.814 28.203
46 HE ARG 6 HE ARG 6 25.538 33.969 26.664
47 HH11 ARG 6 HH11 ARG 6 23.846 36.221 28.866
48 HH12 ARG 6 HH12 ARG 6 22.531 36.335 27.689
49 HH21 ARG 6 HH21 ARG 6 23.826 34.289 25.353
50 HH22 ARG 6 HH22 ARG 6 22.507 35.338 25.903
51 H ARG 7 H ARG 7 26.614 29.512 29.829
52 HA ARG 7 HA ARG 7 29.124 28.661 28.718
53 HB2 ARG 7 HB2 ARG 7 28.127 27.909 30.980
54 HB3 ARG 7 HB3 ARG 7 27.104 26.818 30.058
55 HG2 ARG 7 HG2 ARG 7 29.132 25.711 30.962
56 HG3 ARG 7 HG3 ARG 7 29.018 25.581 29.215
57 HD2 ARG 7 HD2 ARG 7 31.337 26.038 30.081
58 HD3 ARG 7 HD3 ARG 7 30.767 27.194 28.873
59 HE ARG 7 HE ARG 7 30.425 27.815 31.766
60 HH11 ARG 7 HH11 ARG 7 32.644 28.443 29.129
61 HH12 ARG 7 HH12 ARG 7 32.837 30.133 29.604
62 HH21 ARG 7 HH21 ARG 7 30.537 30.019 32.127
63 HH22 ARG 7 HH22 ARG 7 31.670 30.985 31.232
64 H CYS 8 H CYS 8 25.796 27.739 27.914
65 HA CYS 8 HA CYS 8 26.369 25.715 26.010
66 HB2 CYS 8 HB2 CYS 8 24.145 26.259 27.004
67 HB3 CYS 8 HB3 CYS 8 24.120 27.774 26.096
68 H GLU 9 H GLU 9 26.115 29.272 25.492
69 HA GLU 9 HA GLU 9 26.685 29.187 22.675
70 HB2 GLU 9 HB2 GLU 9 27.026 31.296 24.836
71 HB3 GLU 9 HB3 GLU 9 27.390 31.635 23.154
72 HG2 GLU 9 HG2 GLU 9 25.155 31.364 22.471
73 HG3 GLU 9 HG3 GLU 9 24.659 30.604 23.958
74 H LEU 10 H LEU 10 28.855 29.880 25.476
75 HA LEU 10 HA LEU 10 31.171 30.263 23.847
76 HB2 LEU 10 HB2 LEU 10 30.624 29.949 26.795
77 HB3 LEU 10 HB3 LEU 10 32.270 29.728 26.256
78 HG LEU 10 HG LEU 10 31.830 32.001 27.061
79 HD11 LEU 10 HD11 LEU 10 32.525 31.961 24.094
80 HD12 LEU 10 HD12 LEU 10 32.979 33.189 25.292
81 HD13 LEU 10 HD13 LEU 10 33.635 31.554 25.424
82 HD21 LEU 10 HD21 LEU 10 29.522 32.351 26.277
83 HD22 LEU 10 HD22 LEU 10 30.604 33.633 25.726
84 HD23 LEU 10 HD23 LEU 10 30.082 32.371 24.590
85 H SER 11 H SER 11 29.953 27.332 25.487
86 HA SER 11 HA SER 11 32.265 25.734 24.932
87 HB2 SER 11 HB2 SER 11 30.379 25.278 26.605
88 HB3 SER 11 HB3 SER 11 29.445 24.660 25.233
89 HG SER 11 HG SER 11 30.521 22.859 25.768
90 H CYS 12 H CYS 12 29.639 26.729 22.807
91 HA CYS 12 HA CYS 12 30.596 24.810 20.713
92 HB2 CYS 12 HB2 CYS 12 28.218 26.682 20.618
93 HB3 CYS 12 HB3 CYS 12 28.692 25.479 19.461
94 H ARG 13 H ARG 13 30.809 28.189 21.569
95 HA ARG 13 HA ARG 13 31.369 29.314 19.017
96 HB2 ARG 13 HB2 ARG 13 30.895 30.533 21.148
97 HB3 ARG 13 HB3 ARG 13 32.532 30.160 21.710
98 HG2 ARG 13 HG2 ARG 13 33.507 31.444 19.883
99 HG3 ARG 13 HG3 ARG 13 31.940 31.661 19.110
100 HD2 ARG 13 HD2 ARG 13 32.705 32.753 21.847
101 HD3 ARG 13 HD3 ARG 13 32.731 33.683 20.341
102 HE ARG 13 HE ARG 13 30.157 32.757 20.373
103 HH11 ARG 13 HH11 ARG 13 32.005 34.613 22.751
104 HH12 ARG 13 HH12 ARG 13 30.543 35.282 23.443
105 HH21 ARG 13 HH21 ARG 13 28.353 33.720 21.305
106 HH22 ARG 13 HH22 ARG 13 28.557 34.735 22.712
107 H SER 14 H SER 14 33.423 27.324 21.086
108 HA SER 14 HA SER 14 35.895 27.830 19.660
109 HB2 SER 14 HB2 SER 14 36.642 25.726 20.761
110 HB3 SER 14 HB3 SER 14 35.965 26.901 21.872
111 HG SER 14 HG SER 14 34.816 25.289 22.481
112 H LEU 15 H LEU 15 33.096 25.954 18.832
113 HA LEU 15 HA LEU 15 34.515 24.458 16.691
114 HB2 LEU 15 HB2 LEU 15 31.588 24.431 17.512
115 HB3 LEU 15 HB3 LEU 15 32.365 23.330 16.379
116 HG LEU 15 HG LEU 15 32.914 23.493 19.382
117 HD11 LEU 15 HD11 LEU 15 30.699 22.570 18.811
118 HD12 LEU 15 HD12 LEU 15 31.466 21.406 17.707
119 HD13 LEU 15 HD13 LEU 15 31.777 21.321 19.454
120 HD21 LEU 15 HD21 LEU 15 33.962 21.572 17.261
121 HD22 LEU 15 HD22 LEU 15 34.929 22.749 18.190
122 HD23 LEU 15 HD23 LEU 15 34.175 21.380 19.013
123 H GLY 16 H GLY 16 32.919 27.450 17.098
124 HA2 GLY 16 HA2 GLY 16 32.691 29.130 15.487
125 HA3 GLY 16 HA3 GLY 16 32.714 27.931 14.204
126 H LEU 17 H LEU 17 30.505 27.570 16.940
127 HA LEU 17 HA LEU 17 28.198 27.945 15.073
128 HB2 LEU 17 HB2 LEU 17 28.152 26.451 17.688
129 HB3 LEU 17 HB3 LEU 17 26.997 26.359 16.379
130 HG LEU 17 HG LEU 17 29.775 25.230 16.501
131 HD11 LEU 17 HD11 LEU 17 28.192 23.877 17.660
132 HD12 LEU 17 HD12 LEU 17 27.066 23.889 16.281
133 HD13 LEU 17 HD13 LEU 17 28.626 23.054 16.172
134 HD21 LEU 17 HD21 LEU 17 29.385 24.229 14.255
135 HD22 LEU 17 HD22 LEU 17 27.819 25.055 14.146
136 HD23 LEU 17 HD23 LEU 17 29.333 25.984 14.131
137 H LEU 18 H LEU 18 26.194 28.642 16.010
138 HA LEU 18 HA LEU 18 26.353 30.650 18.226
139 HB2 LEU 18 HB2 LEU 18 24.288 30.085 16.042
140 HB3 LEU 18 HB3 LEU 18 24.021 31.215 17.369
141 HG LEU 18 HG LEU 18 26.258 31.482 15.338
142 HD11 LEU 18 HD11 LEU 18 24.048 31.696 14.276
143 HD12 LEU 18 HD12 LEU 18 23.589 32.921 15.478
144 HD13 LEU 18 HD13 LEU 18 24.895 33.244 14.323
145 HD21 LEU 18 HD21 LEU 18 25.140 33.416 17.421
146 HD22 LEU 18 HD22 LEU 18 26.759 32.681 17.429
147 HD23 LEU 18 HD23 LEU 18 26.321 33.843 16.174
148 H GLY 19 H GLY 19 25.858 29.755 20.175
149 HA2 GLY 19 HA2 GLY 19 23.997 27.476 20.370
150 HA3 GLY 19 HA3 GLY 19 24.880 28.202 21.691
151 H ALA 20 H ALA 20 22.101 27.357 21.292
152 HA ALA 20 HA ALA 20 20.827 29.630 22.658
153 HB1 ALA 20 HB1 ALA 20 19.550 28.000 20.410
154 HB2 ALA 20 HB2 ALA 20 18.705 29.160 21.455
155 HB3 ALA 20 HB3 ALA 20 19.966 29.728 20.351
156 H CYS 21 H CYS 21 19.155 28.859 24.080
157 HA CYS 21 HA CYS 21 19.314 25.934 24.713
158 HB2 CYS 21 HB2 CYS 21 20.682 27.217 26.301
159 HB3 CYS 21 HB3 CYS 21 19.211 28.042 26.871
160 H ILE 22 H ILE 22 17.564 25.129 24.035
161 HA ILE 22 HA ILE 22 15.115 26.692 23.724
162 HB ILE 22 HB ILE 22 15.628 23.766 23.082
163 HG12 ILE 22 HG12 ILE 22 17.279 25.008 21.835
164 HG13 ILE 22 HG13 ILE 22 16.003 24.469 20.749
165 HG21 ILE 22 HG21 ILE 22 13.504 25.762 22.153
166 HG22 ILE 22 HG22 ILE 22 13.755 24.137 21.464
167 HG23 ILE 22 HG23 ILE 22 13.258 24.308 23.154
168 HD11 ILE 22 HD11 ILE 22 15.039 26.767 20.708
169 HD12 ILE 22 HD12 ILE 22 16.336 27.318 21.813
170 HD13 ILE 22 HD13 ILE 22 16.739 26.731 20.184
171 H GLY 23 H GLY 23 14.479 27.178 25.737
172 HA2 GLY 23 HA2 GLY 23 13.328 26.925 27.754
173 HA3 GLY 23 HA3 GLY 23 13.056 25.209 27.381
174 H GLU 24 H GLU 24 14.470 23.708 28.149
175 HA GLU 24 HA GLU 24 16.811 24.573 29.795
176 HB2 GLU 24 HB2 GLU 24 16.541 22.519 31.011
177 HB3 GLU 24 HB3 GLU 24 15.017 23.388 30.988
178 HG2 GLU 24 HG2 GLU 24 14.186 21.903 29.204
179 HG3 GLU 24 HG3 GLU 24 15.717 21.068 29.157
180 H GLU 25 H GLU 25 16.144 23.198 26.728
181 HA GLU 25 HA GLU 25 18.382 21.256 26.780
182 HB2 GLU 25 HB2 GLU 25 16.389 21.986 24.627
183 HB3 GLU 25 HB3 GLU 25 17.601 20.740 24.477
184 HG2 GLU 25 HG2 GLU 25 15.295 20.728 26.461
185 HG3 GLU 25 HG3 GLU 25 15.352 19.842 24.945
186 H CYS 26 H CYS 26 20.342 22.223 26.646
187 HA CYS 26 HA CYS 26 20.940 24.484 24.937
188 HB2 CYS 26 HB2 CYS 26 22.323 24.128 26.839
189 HB3 CYS 26 HB3 CYS 26 22.644 22.449 26.381
190 H LYS 27 H LYS 27 21.471 24.591 22.854
191 HA LYS 27 HA LYS 27 22.854 22.468 21.471
192 HB2 LYS 27 HB2 LYS 27 21.182 22.323 19.572
193 HB3 LYS 27 HB3 LYS 27 20.837 21.466 21.056
194 HG2 LYS 27 HG2 LYS 27 19.306 23.552 21.645
195 HG3 LYS 27 HG3 LYS 27 19.470 23.923 19.933
196 HD2 LYS 27 HD2 LYS 27 17.452 22.642 20.188
197 HD3 LYS 27 HD3 LYS 27 18.638 21.541 19.459
198 HE2 LYS 27 HE2 LYS 27 19.139 20.637 21.754
199 HE3 LYS 27 HE3 LYS 27 17.925 21.721 22.436
200 HZ1 LYS 27 HZ1 LYS 27 17.349 19.595 20.434
201 HZ2 LYS 27 HZ2 LYS 27 17.141 19.423 22.043
202 HZ3 LYS 27 HZ3 LYS 27 16.219 20.517 21.242
203 H CYS 28 H CYS 28 23.534 23.112 19.282
204 HA CYS 28 HA CYS 28 23.625 26.025 18.835
205 HB2 CYS 28 HB2 CYS 28 26.122 25.992 18.888
206 HB3 CYS 28 HB3 CYS 28 25.349 25.822 20.459
207 H VAL 29 H VAL 29 24.392 26.645 16.792
208 HA VAL 29 HA VAL 29 24.561 24.515 14.721
209 HB VAL 29 HB VAL 29 22.762 25.517 13.451
210 HG11 VAL 29 HG11 VAL 29 22.248 23.676 15.035
211 HG12 VAL 29 HG12 VAL 29 21.758 24.897 16.237
212 HG13 VAL 29 HG13 VAL 29 20.866 24.750 14.711
213 HG21 VAL 29 HG21 VAL 29 22.830 27.849 14.201
214 HG22 VAL 29 HG22 VAL 29 21.208 27.164 14.411
215 HG23 VAL 29 HG23 VAL 29 22.276 27.345 15.816
216 HA PRO 30 HA PRO 30 27.248 27.310 12.529
217 HB2 PRO 30 HB2 PRO 30 25.647 26.672 10.050
218 HB3 PRO 30 HB3 PRO 30 27.422 26.671 10.276
219 HG2 PRO 30 HG2 PRO 30 26.059 24.339 10.259
220 HG3 PRO 30 HG3 PRO 30 27.340 24.618 11.483
221 HD2 PRO 30 HD2 PRO 30 24.362 24.865 11.829
222 HD3 PRO 30 HD3 PRO 30 25.568 24.088 12.899
223 H TYR 31 H TYR 31 27.367 29.376 11.770
224 HA TYR 31 HA TYR 31 25.261 31.292 12.139
225 HB2 TYR 31 HB2 TYR 31 27.994 31.398 10.782
226 HB3 TYR 31 HB3 TYR 31 26.923 32.784 10.882
227 HD1 TYR 31 HD1 TYR 31 27.465 34.351 12.464
228 HD2 TYR 31 HD2 TYR 31 28.359 30.241 13.328
229 HE1 TYR 31 HE1 TYR 31 28.518 35.027 14.592
230 HE2 TYR 31 HE2 TYR 31 29.420 30.911 15.449
231 HH TYR 31 HH TYR 31 29.626 34.335 16.476
Start of MODEL 11
1 H1 ALA 1 H1 ALA 1 16.593 30.197 39.277
2 H2 ALA 1 H2 ALA 1 15.791 29.090 38.329
3 H3 ALA 1 H3 ALA 1 15.641 30.694 38.040
4 HA ALA 1 HA ALA 1 17.895 30.919 37.397
5 HB1 ALA 1 HB1 ALA 1 19.354 28.978 37.240
6 HB2 ALA 1 HB2 ALA 1 18.773 29.136 38.904
7 HB3 ALA 1 HB3 ALA 1 18.074 27.912 37.827
8 H PHE 2 H PHE 2 18.186 30.987 35.168
9 HA PHE 2 HA PHE 2 16.221 29.580 33.442
10 HB2 PHE 2 HB2 PHE 2 18.363 31.671 32.894
11 HB3 PHE 2 HB3 PHE 2 17.312 30.975 31.666
12 HD1 PHE 2 HD1 PHE 2 17.599 33.585 34.142
13 HD2 PHE 2 HD2 PHE 2 14.787 31.225 31.876
14 HE1 PHE 2 HE1 PHE 2 15.846 35.303 34.525
15 HE2 PHE 2 HE2 PHE 2 13.031 32.941 32.264
16 HZ PHE 2 HZ PHE 2 13.566 34.983 33.584
17 H CYS 3 H CYS 3 17.498 28.935 31.243
18 HA CYS 3 HA CYS 3 19.336 26.753 31.761
19 HB2 CYS 3 HB2 CYS 3 17.794 27.011 29.803
20 HB3 CYS 3 HB3 CYS 3 18.762 28.389 29.266
21 H ASN 4 H ASN 4 21.680 26.739 31.448
22 HA ASN 4 HA ASN 4 23.042 29.331 31.700
23 HB2 ASN 4 HB2 ASN 4 24.122 26.509 31.398
24 HB3 ASN 4 HB3 ASN 4 25.081 27.955 31.601
25 HD21 ASN 4 HD21 ASN 4 23.866 28.482 35.042
26 HD22 ASN 4 HD22 ASN 4 24.278 29.408 33.625
27 H LEU 5 H LEU 5 21.966 30.115 29.724
28 HA LEU 5 HA LEU 5 22.524 29.046 27.147
29 HB2 LEU 5 HB2 LEU 5 20.584 30.448 27.603
30 HB3 LEU 5 HB3 LEU 5 21.634 31.807 28.027
31 HG LEU 5 HG LEU 5 22.462 31.937 25.704
32 HD11 LEU 5 HD11 LEU 5 22.156 29.574 24.998
33 HD12 LEU 5 HD12 LEU 5 20.388 29.780 25.131
34 HD13 LEU 5 HD13 LEU 5 21.322 30.684 23.920
35 HD21 LEU 5 HD21 LEU 5 20.526 33.265 26.423
36 HD22 LEU 5 HD22 LEU 5 20.379 32.803 24.725
37 HD23 LEU 5 HD23 LEU 5 19.429 31.946 25.962
38 H ARG 6 H ARG 6 24.239 31.593 29.029
39 HA ARG 6 HA ARG 6 26.136 32.180 26.906
40 HB2 ARG 6 HB2 ARG 6 26.126 32.580 29.904
41 HB3 ARG 6 HB3 ARG 6 27.615 32.833 29.012
42 HG2 ARG 6 HG2 ARG 6 25.040 34.243 28.187
43 HG3 ARG 6 HG3 ARG 6 26.079 34.847 29.480
44 HD2 ARG 6 HD2 ARG 6 26.777 36.039 27.602
45 HD3 ARG 6 HD3 ARG 6 28.026 34.822 27.867
46 HE ARG 6 HE ARG 6 25.995 33.960 25.944
47 HH11 ARG 6 HH11 ARG 6 28.975 35.877 26.134
48 HH12 ARG 6 HH12 ARG 6 29.172 35.833 24.401
49 HH21 ARG 6 HH21 ARG 6 26.312 33.993 23.869
50 HH22 ARG 6 HH22 ARG 6 27.705 34.789 23.129
51 H ARG 7 H ARG 7 26.327 29.762 29.577
52 HA ARG 7 HA ARG 7 28.877 28.711 28.749
53 HB2 ARG 7 HB2 ARG 7 27.740 28.292 30.944
54 HB3 ARG 7 HB3 ARG 7 26.599 27.215 30.107
55 HG2 ARG 7 HG2 ARG 7 28.455 25.708 29.476
56 HG3 ARG 7 HG3 ARG 7 29.618 26.840 30.171
57 HD2 ARG 7 HD2 ARG 7 29.312 25.118 31.789
58 HD3 ARG 7 HD3 ARG 7 28.500 26.567 32.400
59 HE ARG 7 HE ARG 7 26.724 24.752 30.918
60 HH11 ARG 7 HH11 ARG 7 28.094 25.322 34.149
61 HH12 ARG 7 HH12 ARG 7 26.889 24.278 34.881
62 HH21 ARG 7 HH21 ARG 7 25.162 23.564 32.052
63 HH22 ARG 7 HH22 ARG 7 25.311 23.449 33.795
64 H CYS 8 H CYS 8 25.575 27.745 27.880
65 HA CYS 8 HA CYS 8 26.149 25.689 26.013
66 HB2 CYS 8 HB2 CYS 8 23.975 27.799 26.141
67 HB3 CYS 8 HB3 CYS 8 23.957 26.520 24.966
68 H GLU 9 H GLU 9 25.876 29.219 25.305
69 HA GLU 9 HA GLU 9 26.539 28.991 22.513
70 HB2 GLU 9 HB2 GLU 9 26.599 31.283 24.520
71 HB3 GLU 9 HB3 GLU 9 26.998 31.512 22.817
72 HG2 GLU 9 HG2 GLU 9 24.827 30.840 22.089
73 HG3 GLU 9 HG3 GLU 9 24.328 30.334 23.697
74 H LEU 10 H LEU 10 28.611 29.783 25.361
75 HA LEU 10 HA LEU 10 31.034 30.142 23.837
76 HB2 LEU 10 HB2 LEU 10 30.301 29.809 26.750
77 HB3 LEU 10 HB3 LEU 10 31.957 29.541 26.303
78 HG LEU 10 HG LEU 10 31.538 31.814 27.127
79 HD11 LEU 10 HD11 LEU 10 32.876 32.963 25.472
80 HD12 LEU 10 HD12 LEU 10 33.450 31.298 25.652
81 HD13 LEU 10 HD13 LEU 10 32.466 31.756 24.239
82 HD21 LEU 10 HD21 LEU 10 30.030 32.299 24.528
83 HD22 LEU 10 HD22 LEU 10 29.334 32.319 26.167
84 HD23 LEU 10 HD23 LEU 10 30.539 33.526 25.707
85 H SER 11 H SER 11 29.603 27.293 25.408
86 HA SER 11 HA SER 11 31.643 25.393 25.008
87 HB2 SER 11 HB2 SER 11 29.607 25.004 26.313
88 HB3 SER 11 HB3 SER 11 28.614 25.145 24.849
89 HG SER 11 HG SER 11 28.808 23.078 24.873
90 H CYS 12 H CYS 12 29.221 26.619 22.673
91 HA CYS 12 HA CYS 12 30.364 24.876 20.562
92 HB2 CYS 12 HB2 CYS 12 27.993 26.752 20.451
93 HB3 CYS 12 HB3 CYS 12 28.587 25.710 19.191
94 H ARG 13 H ARG 13 30.682 28.204 21.576
95 HA ARG 13 HA ARG 13 31.735 29.295 19.130
96 HB2 ARG 13 HB2 ARG 13 31.241 30.545 21.301
97 HB3 ARG 13 HB3 ARG 13 32.733 29.855 21.944
98 HG2 ARG 13 HG2 ARG 13 33.840 30.937 19.774
99 HG3 ARG 13 HG3 ARG 13 32.336 31.853 19.672
100 HD2 ARG 13 HD2 ARG 13 34.017 33.152 20.846
101 HD3 ARG 13 HD3 ARG 13 32.753 32.683 22.003
102 HE ARG 13 HE ARG 13 34.793 30.680 22.040
103 HH11 ARG 13 HH11 ARG 13 34.418 33.994 23.224
104 HH12 ARG 13 HH12 ARG 13 35.630 33.680 24.462
105 HH21 ARG 13 HH21 ARG 13 36.109 30.416 23.619
106 HH22 ARG 13 HH22 ARG 13 36.599 31.771 24.639
107 H SER 14 H SER 14 33.168 27.125 21.538
108 HA SER 14 HA SER 14 35.808 26.904 20.529
109 HB2 SER 14 HB2 SER 14 34.088 24.674 21.707
110 HB3 SER 14 HB3 SER 14 35.889 24.821 21.753
111 HG SER 14 HG SER 14 34.591 25.485 23.698
112 H LEU 15 H LEU 15 32.852 25.859 19.048
113 HA LEU 15 HA LEU 15 34.293 24.358 16.920
114 HB2 LEU 15 HB2 LEU 15 31.347 24.263 17.594
115 HB3 LEU 15 HB3 LEU 15 32.219 23.209 16.480
116 HG LEU 15 HG LEU 15 32.473 23.262 19.519
117 HD11 LEU 15 HD11 LEU 15 30.361 22.308 18.702
118 HD12 LEU 15 HD12 LEU 15 31.274 21.202 17.651
119 HD13 LEU 15 HD13 LEU 15 31.409 21.068 19.420
120 HD21 LEU 15 HD21 LEU 15 33.803 21.441 17.491
121 HD22 LEU 15 HD22 LEU 15 34.631 22.606 18.546
122 HD23 LEU 15 HD23 LEU 15 33.816 21.195 19.247
123 H GLY 16 H GLY 16 33.211 27.356 17.586
124 HA2 GLY 16 HA2 GLY 16 33.045 29.219 16.254
125 HA3 GLY 16 HA3 GLY 16 33.039 28.211 14.809
126 H LEU 17 H LEU 17 30.541 27.450 17.176
127 HA LEU 17 HA LEU 17 28.537 28.388 15.179
128 HB2 LEU 17 HB2 LEU 17 27.950 26.419 17.362
129 HB3 LEU 17 HB3 LEU 17 27.180 26.589 15.815
130 HG LEU 17 HG LEU 17 29.860 25.398 16.424
131 HD11 LEU 17 HD11 LEU 17 28.072 23.897 16.960
132 HD12 LEU 17 HD12 LEU 17 27.282 24.172 15.386
133 HD13 LEU 17 HD13 LEU 17 28.838 23.322 15.487
134 HD21 LEU 17 HD21 LEU 17 29.890 26.554 14.155
135 HD22 LEU 17 HD22 LEU 17 30.062 24.808 14.061
136 HD23 LEU 17 HD23 LEU 17 28.493 25.564 13.685
137 H LEU 18 H LEU 18 26.464 29.068 15.847
138 HA LEU 18 HA LEU 18 26.292 30.748 18.292
139 HB2 LEU 18 HB2 LEU 18 24.354 30.090 16.020
140 HB3 LEU 18 HB3 LEU 18 23.923 31.095 17.406
141 HG LEU 18 HG LEU 18 26.145 31.767 15.455
142 HD11 LEU 18 HD11 LEU 18 23.306 32.831 15.619
143 HD12 LEU 18 HD12 LEU 18 24.595 33.415 14.538
144 HD13 LEU 18 HD13 LEU 18 23.955 31.771 14.346
145 HD21 LEU 18 HD21 LEU 18 24.760 33.403 17.620
146 HD22 LEU 18 HD22 LEU 18 26.455 32.862 17.638
147 HD23 LEU 18 HD23 LEU 18 25.919 34.041 16.434
148 H GLY 19 H GLY 19 25.602 29.835 20.187
149 HA2 GLY 19 HA2 GLY 19 23.997 27.322 20.142
150 HA3 GLY 19 HA3 GLY 19 24.637 28.081 21.564
151 H ALA 20 H ALA 20 22.001 27.110 21.103
152 HA ALA 20 HA ALA 20 20.542 29.429 22.114
153 HB1 ALA 20 HB1 ALA 20 19.937 29.383 19.717
154 HB2 ALA 20 HB2 ALA 20 19.498 27.665 19.858
155 HB3 ALA 20 HB3 ALA 20 18.558 28.899 20.725
156 H CYS 21 H CYS 21 18.866 28.787 23.530
157 HA CYS 21 HA CYS 21 18.881 25.907 24.344
158 HB2 CYS 21 HB2 CYS 21 20.075 27.413 25.939
159 HB3 CYS 21 HB3 CYS 21 18.529 28.202 26.275
160 H ILE 22 H ILE 22 17.070 24.855 24.702
161 HA ILE 22 HA ILE 22 14.451 26.295 24.395
162 HB ILE 22 HB ILE 22 15.133 23.446 23.603
163 HG12 ILE 22 HG12 ILE 22 16.141 25.025 22.033
164 HG13 ILE 22 HG13 ILE 22 14.828 24.132 21.296
165 HG21 ILE 22 HG21 ILE 22 12.849 23.468 22.575
166 HG22 ILE 22 HG22 ILE 22 12.813 23.572 24.335
167 HG23 ILE 22 HG23 ILE 22 12.533 25.027 23.364
168 HD11 ILE 22 HD11 ILE 22 13.357 26.096 21.445
169 HD12 ILE 22 HD12 ILE 22 14.620 27.013 22.289
170 HD13 ILE 22 HD13 ILE 22 14.857 26.511 20.616
171 H GLY 23 H GLY 23 14.180 26.772 26.478
172 HA2 GLY 23 HA2 GLY 23 13.286 26.513 28.578
173 HA3 GLY 23 HA3 GLY 23 13.035 24.800 28.229
174 H GLU 24 H GLU 24 15.354 23.644 28.054
175 HA GLU 24 HA GLU 24 17.250 24.553 30.130
176 HB2 GLU 24 HB2 GLU 24 17.068 22.692 31.543
177 HB3 GLU 24 HB3 GLU 24 15.458 23.349 31.371
178 HG2 GLU 24 HG2 GLU 24 14.850 21.525 29.833
179 HG3 GLU 24 HG3 GLU 24 16.509 20.894 29.894
180 H GLU 25 H GLU 25 16.648 22.457 27.348
181 HA GLU 25 HA GLU 25 19.488 21.584 27.467
182 HB2 GLU 25 HB2 GLU 25 17.947 19.729 27.327
183 HB3 GLU 25 HB3 GLU 25 17.198 20.418 25.888
184 HG2 GLU 25 HG2 GLU 25 18.664 18.593 25.272
185 HG3 GLU 25 HG3 GLU 25 19.278 20.095 24.606
186 H CYS 26 H CYS 26 20.899 22.059 25.806
187 HA CYS 26 HA CYS 26 19.987 24.159 23.896
188 HB2 CYS 26 HB2 CYS 26 21.940 25.448 24.460
189 HB3 CYS 26 HB3 CYS 26 20.927 25.151 25.867
190 H LYS 27 H LYS 27 20.683 24.202 21.974
191 HA LYS 27 HA LYS 27 22.960 22.510 21.046
192 HB2 LYS 27 HB2 LYS 27 20.154 22.506 19.869
193 HB3 LYS 27 HB3 LYS 27 21.584 21.875 19.035
194 HG2 LYS 27 HG2 LYS 27 21.953 20.213 20.828
195 HG3 LYS 27 HG3 LYS 27 20.565 20.856 21.719
196 HD2 LYS 27 HD2 LYS 27 19.841 18.882 20.610
197 HD3 LYS 27 HD3 LYS 27 19.072 20.265 19.825
198 HE2 LYS 27 HE2 LYS 27 20.867 20.132 18.037
199 HE3 LYS 27 HE3 LYS 27 21.454 18.652 18.796
200 HZ1 LYS 27 HZ1 LYS 27 19.304 17.619 18.342
201 HZ2 LYS 27 HZ2 LYS 27 18.703 19.071 17.753
202 HZ3 LYS 27 HZ3 LYS 27 19.862 18.286 16.955
203 H CYS 28 H CYS 28 23.894 23.131 19.110
204 HA CYS 28 HA CYS 28 23.539 26.031 18.513
205 HB2 CYS 28 HB2 CYS 28 26.020 26.106 18.410
206 HB3 CYS 28 HB3 CYS 28 25.341 25.792 19.995
207 H VAL 29 H VAL 29 24.476 26.820 16.518
208 HA VAL 29 HA VAL 29 24.376 24.971 14.199
209 HB VAL 29 HB VAL 29 22.652 26.340 13.121
210 HG11 VAL 29 HG11 VAL 29 21.614 25.346 15.787
211 HG12 VAL 29 HG12 VAL 29 20.722 25.508 14.267
212 HG13 VAL 29 HG13 VAL 29 22.011 24.298 14.399
213 HG21 VAL 29 HG21 VAL 29 21.257 27.908 14.398
214 HG22 VAL 29 HG22 VAL 29 22.355 27.767 15.783
215 HG23 VAL 29 HG23 VAL 29 22.924 28.488 14.259
216 HA PRO 30 HA PRO 30 27.398 27.749 12.581
217 HB2 PRO 30 HB2 PRO 30 27.061 27.578 9.854
218 HB3 PRO 30 HB3 PRO 30 27.758 26.277 10.866
219 HG2 PRO 30 HG2 PRO 30 24.901 26.560 9.899
220 HG3 PRO 30 HG3 PRO 30 25.959 25.113 9.824
221 HD2 PRO 30 HD2 PRO 30 24.148 25.409 11.805
222 HD3 PRO 30 HD3 PRO 30 25.756 24.719 12.150
223 H TYR 31 H TYR 31 27.800 29.726 11.501
224 HA TYR 31 HA TYR 31 25.746 31.764 11.824
225 HB2 TYR 31 HB2 TYR 31 28.627 31.770 10.940
226 HB3 TYR 31 HB3 TYR 31 27.636 33.199 10.839
227 HD1 TYR 31 HD1 TYR 31 28.553 30.557 13.404
228 HD2 TYR 31 HD2 TYR 31 27.760 34.730 12.575
229 HE1 TYR 31 HE1 TYR 31 29.185 31.157 15.750
230 HE2 TYR 31 HE2 TYR 31 28.396 35.302 14.906
231 HH TYR 31 HH TYR 31 28.735 34.372 17.067
Start of MODEL 12
1 H1 ALA 1 H1 ALA 1 16.761 23.474 39.631
2 H2 ALA 1 H2 ALA 1 15.885 23.251 38.248
3 H3 ALA 1 H3 ALA 1 16.275 24.759 38.738
4 HA ALA 1 HA ALA 1 18.622 24.307 38.426
5 HB1 ALA 1 HB1 ALA 1 18.525 21.878 38.789
6 HB2 ALA 1 HB2 ALA 1 17.582 21.673 37.301
7 HB3 ALA 1 HB3 ALA 1 19.262 22.242 37.216
8 H PHE 2 H PHE 2 18.868 25.943 36.960
9 HA PHE 2 HA PHE 2 17.164 25.930 34.512
10 HB2 PHE 2 HB2 PHE 2 18.832 28.135 35.743
11 HB3 PHE 2 HB3 PHE 2 17.773 28.287 34.340
12 HD1 PHE 2 HD1 PHE 2 15.261 27.967 34.626
13 HD2 PHE 2 HD2 PHE 2 17.946 28.312 37.981
14 HE1 PHE 2 HE1 PHE 2 13.348 28.528 36.109
15 HE2 PHE 2 HE2 PHE 2 16.025 28.843 39.458
16 HZ PHE 2 HZ PHE 2 13.727 28.989 38.521
17 H CYS 3 H CYS 3 18.005 26.167 32.424
18 HA CYS 3 HA CYS 3 20.648 25.106 31.876
19 HB2 CYS 3 HB2 CYS 3 18.581 24.926 30.427
20 HB3 CYS 3 HB3 CYS 3 18.811 26.616 29.986
21 H ASN 4 H ASN 4 22.305 26.361 30.502
22 HA ASN 4 HA ASN 4 22.371 29.254 31.204
23 HB2 ASN 4 HB2 ASN 4 23.931 27.691 32.640
24 HB3 ASN 4 HB3 ASN 4 24.888 27.637 31.171
25 HD21 ASN 4 HD21 ASN 4 24.460 31.204 33.128
26 HD22 ASN 4 HD22 ASN 4 23.338 29.888 33.449
27 H LEU 5 H LEU 5 21.914 30.096 29.391
28 HA LEU 5 HA LEU 5 22.676 29.304 26.763
29 HB2 LEU 5 HB2 LEU 5 20.825 30.851 27.242
30 HB3 LEU 5 HB3 LEU 5 21.964 32.035 27.893
31 HG LEU 5 HG LEU 5 22.983 32.345 25.681
32 HD11 LEU 5 HD11 LEU 5 21.835 31.364 23.672
33 HD12 LEU 5 HD12 LEU 5 22.658 30.150 24.649
34 HD13 LEU 5 HD13 LEU 5 20.891 30.328 24.767
35 HD21 LEU 5 HD21 LEU 5 21.060 33.436 24.582
36 HD22 LEU 5 HD22 LEU 5 19.943 32.540 25.631
37 HD23 LEU 5 HD23 LEU 5 21.051 33.736 26.327
38 H ARG 6 H ARG 6 24.335 31.475 29.122
39 HA ARG 6 HA ARG 6 26.394 32.301 27.256
40 HB2 ARG 6 HB2 ARG 6 26.574 32.182 30.302
41 HB3 ARG 6 HB3 ARG 6 27.645 33.057 29.223
42 HG2 ARG 6 HG2 ARG 6 24.787 33.701 29.947
43 HG3 ARG 6 HG3 ARG 6 26.224 34.687 30.131
44 HD2 ARG 6 HD2 ARG 6 24.778 34.012 27.536
45 HD3 ARG 6 HD3 ARG 6 24.816 35.563 28.378
46 HE ARG 6 HE ARG 6 27.503 34.798 27.813
47 HH11 ARG 6 HH11 ARG 6 24.701 36.027 26.063
48 HH12 ARG 6 HH12 ARG 6 25.706 36.625 24.757
49 HH21 ARG 6 HH21 ARG 6 28.652 35.732 26.310
50 HH22 ARG 6 HH22 ARG 6 27.943 36.617 24.976
51 H ARG 7 H ARG 7 26.344 29.602 29.591
52 HA ARG 7 HA ARG 7 28.938 28.582 28.841
53 HB2 ARG 7 HB2 ARG 7 27.382 27.953 30.879
54 HB3 ARG 7 HB3 ARG 7 26.671 26.789 29.755
55 HG2 ARG 7 HG2 ARG 7 29.355 26.274 29.380
56 HG3 ARG 7 HG3 ARG 7 29.376 26.899 31.031
57 HD2 ARG 7 HD2 ARG 7 29.112 24.627 31.405
58 HD3 ARG 7 HD3 ARG 7 27.445 25.180 31.459
59 HE ARG 7 HE ARG 7 27.001 24.125 29.393
60 HH11 ARG 7 HH11 ARG 7 30.507 23.927 29.934
61 HH12 ARG 7 HH12 ARG 7 30.656 22.690 28.708
62 HH21 ARG 7 HH21 ARG 7 27.361 22.392 28.005
63 HH22 ARG 7 HH22 ARG 7 29.026 21.860 27.746
64 H CYS 8 H CYS 8 25.671 27.752 27.665
65 HA CYS 8 HA CYS 8 26.418 25.710 25.847
66 HB2 CYS 8 HB2 CYS 8 24.159 26.049 26.639
67 HB3 CYS 8 HB3 CYS 8 24.086 27.649 25.922
68 H GLU 9 H GLU 9 26.037 29.235 25.237
69 HA GLU 9 HA GLU 9 26.721 29.212 22.453
70 HB2 GLU 9 HB2 GLU 9 26.962 31.248 24.714
71 HB3 GLU 9 HB3 GLU 9 27.536 31.645 23.112
72 HG2 GLU 9 HG2 GLU 9 24.697 30.645 23.394
73 HG3 GLU 9 HG3 GLU 9 25.091 32.280 23.936
74 H LEU 10 H LEU 10 28.859 29.872 25.318
75 HA LEU 10 HA LEU 10 31.152 30.130 23.588
76 HB2 LEU 10 HB2 LEU 10 30.691 30.187 26.554
77 HB3 LEU 10 HB3 LEU 10 32.326 29.956 25.982
78 HG LEU 10 HG LEU 10 31.737 32.324 26.455
79 HD11 LEU 10 HD11 LEU 10 32.539 31.806 23.559
80 HD12 LEU 10 HD12 LEU 10 32.839 33.266 24.510
81 HD13 LEU 10 HD13 LEU 10 33.616 31.750 24.973
82 HD21 LEU 10 HD21 LEU 10 30.430 33.647 24.937
83 HD22 LEU 10 HD22 LEU 10 30.107 32.265 23.880
84 HD23 LEU 10 HD23 LEU 10 29.409 32.331 25.521
85 H SER 11 H SER 11 29.934 27.346 25.433
86 HA SER 11 HA SER 11 32.187 25.650 25.000
87 HB2 SER 11 HB2 SER 11 30.376 25.100 26.549
88 HB3 SER 11 HB3 SER 11 29.219 25.004 25.209
89 HG SER 11 HG SER 11 29.804 23.049 24.936
90 H CYS 12 H CYS 12 29.598 26.650 22.791
91 HA CYS 12 HA CYS 12 30.578 24.795 20.691
92 HB2 CYS 12 HB2 CYS 12 28.211 26.683 20.704
93 HB3 CYS 12 HB3 CYS 12 28.644 25.540 19.468
94 H ARG 13 H ARG 13 30.830 28.230 21.524
95 HA ARG 13 HA ARG 13 31.659 29.261 19.055
96 HB2 ARG 13 HB2 ARG 13 31.370 30.352 21.449
97 HB3 ARG 13 HB3 ARG 13 33.079 29.952 21.650
98 HG2 ARG 13 HG2 ARG 13 33.096 32.158 20.810
99 HG3 ARG 13 HG3 ARG 13 33.427 31.191 19.376
100 HD2 ARG 13 HD2 ARG 13 31.774 32.767 18.718
101 HD3 ARG 13 HD3 ARG 13 30.879 31.259 18.919
102 HE ARG 13 HE ARG 13 31.068 33.365 21.052
103 HH11 ARG 13 HH11 ARG 13 28.868 31.170 19.300
104 HH12 ARG 13 HH12 ARG 13 27.523 31.831 20.181
105 HH21 ARG 13 HH21 ARG 13 29.346 34.224 21.815
106 HH22 ARG 13 HH22 ARG 13 27.752 33.758 21.239
107 H SER 14 H SER 14 33.438 27.131 21.251
108 HA SER 14 HA SER 14 35.992 27.186 20.093
109 HB2 SER 14 HB2 SER 14 34.473 24.743 21.085
110 HB3 SER 14 HB3 SER 14 36.236 24.914 20.967
111 HG SER 14 HG SER 14 35.367 25.250 23.072
112 H LEU 15 H LEU 15 33.036 25.881 18.712
113 HA LEU 15 HA LEU 15 34.467 24.552 16.463
114 HB2 LEU 15 HB2 LEU 15 31.549 24.372 17.259
115 HB3 LEU 15 HB3 LEU 15 32.402 23.347 16.109
116 HG LEU 15 HG LEU 15 32.805 23.413 19.137
117 HD11 LEU 15 HD11 LEU 15 31.763 21.194 19.086
118 HD12 LEU 15 HD12 LEU 15 30.662 22.417 18.433
119 HD13 LEU 15 HD13 LEU 15 31.525 21.326 17.331
120 HD21 LEU 15 HD21 LEU 15 34.170 21.385 18.796
121 HD22 LEU 15 HD22 LEU 15 34.017 21.580 17.036
122 HD23 LEU 15 HD23 LEU 15 34.903 22.788 18.004
123 H GLY 16 H GLY 16 33.080 27.522 17.150
124 HA2 GLY 16 HA2 GLY 16 32.762 29.321 15.731
125 HA3 GLY 16 HA3 GLY 16 32.733 28.258 14.327
126 H LEU 17 H LEU 17 30.572 27.835 17.160
127 HA LEU 17 HA LEU 17 28.251 28.346 15.341
128 HB2 LEU 17 HB2 LEU 17 28.172 26.605 17.776
129 HB3 LEU 17 HB3 LEU 17 27.098 26.581 16.406
130 HG LEU 17 HG LEU 17 29.918 25.574 16.545
131 HD11 LEU 17 HD11 LEU 17 28.910 23.351 16.153
132 HD12 LEU 17 HD12 LEU 17 28.361 24.099 17.648
133 HD13 LEU 17 HD13 LEU 17 27.297 24.085 16.221
134 HD21 LEU 17 HD21 LEU 17 29.655 24.684 14.278
135 HD22 LEU 17 HD22 LEU 17 27.997 25.322 14.182
136 HD23 LEU 17 HD23 LEU 17 29.387 26.426 14.211
137 H LEU 18 H LEU 18 26.268 28.918 16.229
138 HA LEU 18 HA LEU 18 26.187 30.654 18.640
139 HB2 LEU 18 HB2 LEU 18 24.271 30.126 16.326
140 HB3 LEU 18 HB3 LEU 18 23.835 31.094 17.737
141 HG LEU 18 HG LEU 18 26.159 31.775 15.906
142 HD11 LEU 18 HD11 LEU 18 24.661 33.469 14.928
143 HD12 LEU 18 HD12 LEU 18 24.035 31.829 14.658
144 HD13 LEU 18 HD13 LEU 18 23.320 32.860 15.918
145 HD21 LEU 18 HD21 LEU 18 25.830 34.052 16.951
146 HD22 LEU 18 HD22 LEU 18 24.662 33.326 18.066
147 HD23 LEU 18 HD23 LEU 18 26.366 32.825 18.108
148 H GLY 19 H GLY 19 25.602 29.669 20.483
149 HA2 GLY 19 HA2 GLY 19 23.938 27.199 20.485
150 HA3 GLY 19 HA3 GLY 19 24.750 27.879 21.866
151 H ALA 20 H ALA 20 21.964 26.983 21.321
152 HA ALA 20 HA ALA 20 20.625 29.116 22.827
153 HB1 ALA 20 HB1 ALA 20 19.545 27.901 20.248
154 HB2 ALA 20 HB2 ALA 20 18.592 28.860 21.391
155 HB3 ALA 20 HB3 ALA 20 19.954 29.606 20.532
156 H CYS 21 H CYS 21 19.109 28.245 24.274
157 HA CYS 21 HA CYS 21 19.046 25.249 24.457
158 HB2 CYS 21 HB2 CYS 21 20.743 26.130 25.957
159 HB3 CYS 21 HB3 CYS 21 19.541 27.165 26.741
160 H ILE 22 H ILE 22 17.044 24.628 24.081
161 HA ILE 22 HA ILE 22 14.723 26.123 25.122
162 HB ILE 22 HB ILE 22 14.894 23.592 23.455
163 HG12 ILE 22 HG12 ILE 22 14.075 26.419 22.615
164 HG13 ILE 22 HG13 ILE 22 15.694 25.783 22.388
165 HG21 ILE 22 HG21 ILE 22 12.454 23.947 23.069
166 HG22 ILE 22 HG22 ILE 22 12.787 23.642 24.761
167 HG23 ILE 22 HG23 ILE 22 12.470 25.301 24.216
168 HD11 ILE 22 HD11 ILE 22 14.773 23.912 21.013
169 HD12 ILE 22 HD12 ILE 22 13.184 24.719 21.071
170 HD13 ILE 22 HD13 ILE 22 14.571 25.534 20.326
171 H GLY 23 H GLY 23 14.498 25.959 27.232
172 HA2 GLY 23 HA2 GLY 23 13.894 25.095 29.259
173 HA3 GLY 23 HA3 GLY 23 13.667 23.509 28.517
174 H GLU 24 H GLU 24 15.774 22.368 27.977
175 HA GLU 24 HA GLU 24 17.912 22.759 30.024
176 HB2 GLU 24 HB2 GLU 24 17.636 20.560 30.928
177 HB3 GLU 24 HB3 GLU 24 16.094 21.409 31.042
178 HG2 GLU 24 HG2 GLU 24 15.261 20.167 29.058
179 HG3 GLU 24 HG3 GLU 24 16.831 19.373 28.887
180 H GLU 25 H GLU 25 17.249 21.971 26.779
181 HA GLU 25 HA GLU 25 19.733 20.323 26.536
182 HB2 GLU 25 HB2 GLU 25 17.391 20.614 24.633
183 HB3 GLU 25 HB3 GLU 25 18.881 19.742 24.280
184 HG2 GLU 25 HG2 GLU 25 16.855 19.083 26.438
185 HG3 GLU 25 HG3 GLU 25 17.109 18.205 24.933
186 H CYS 26 H CYS 26 21.499 21.311 25.857
187 HA CYS 26 HA CYS 26 21.394 23.943 24.543
188 HB2 CYS 26 HB2 CYS 26 23.140 23.569 26.168
189 HB3 CYS 26 HB3 CYS 26 23.661 22.095 25.333
190 H LYS 27 H LYS 27 21.122 24.192 22.431
191 HA LYS 27 HA LYS 27 22.252 22.183 20.518
192 HB2 LYS 27 HB2 LYS 27 19.780 22.108 20.703
193 HB3 LYS 27 HB3 LYS 27 19.720 23.809 20.224
194 HG2 LYS 27 HG2 LYS 27 20.764 23.205 18.032
195 HG3 LYS 27 HG3 LYS 27 20.821 21.515 18.567
196 HD2 LYS 27 HD2 LYS 27 18.894 21.656 17.220
197 HD3 LYS 27 HD3 LYS 27 18.281 21.648 18.876
198 HE2 LYS 27 HE2 LYS 27 18.017 24.130 18.775
199 HE3 LYS 27 HE3 LYS 27 18.679 24.123 17.128
200 HZ1 LYS 27 HZ1 LYS 27 16.296 24.148 16.994
201 HZ2 LYS 27 HZ2 LYS 27 16.800 22.652 16.506
202 HZ3 LYS 27 HZ3 LYS 27 16.152 22.827 17.982
203 H CYS 28 H CYS 28 23.739 23.003 19.257
204 HA CYS 28 HA CYS 28 23.771 25.941 18.749
205 HB2 CYS 28 HB2 CYS 28 26.230 25.917 18.921
206 HB3 CYS 28 HB3 CYS 28 25.380 25.688 20.439
207 H VAL 29 H VAL 29 24.488 26.706 16.805
208 HA VAL 29 HA VAL 29 24.895 24.786 14.586
209 HB VAL 29 HB VAL 29 23.016 25.606 13.319
210 HG11 VAL 29 HG11 VAL 29 22.622 23.698 14.907
211 HG12 VAL 29 HG12 VAL 29 21.928 24.862 16.072
212 HG13 VAL 29 HG13 VAL 29 21.179 24.610 14.482
213 HG21 VAL 29 HG21 VAL 29 21.279 27.066 14.294
214 HG22 VAL 29 HG22 VAL 29 22.315 27.349 15.712
215 HG23 VAL 29 HG23 VAL 29 22.822 27.899 14.102
216 HA PRO 30 HA PRO 30 27.532 27.878 13.090
217 HB2 PRO 30 HB2 PRO 30 26.386 27.693 10.313
218 HB3 PRO 30 HB3 PRO 30 28.077 27.495 10.866
219 HG2 PRO 30 HG2 PRO 30 26.594 25.334 10.212
220 HG3 PRO 30 HG3 PRO 30 27.673 25.297 11.644
221 HD2 PRO 30 HD2 PRO 30 24.683 25.784 11.557
222 HD3 PRO 30 HD3 PRO 30 25.636 24.736 12.644
223 H TYR 31 H TYR 31 27.819 30.086 12.585
224 HA TYR 31 HA TYR 31 25.697 31.991 12.851
225 HB2 TYR 31 HB2 TYR 31 28.489 32.167 11.658
226 HB3 TYR 31 HB3 TYR 31 27.423 33.543 11.774
227 HD1 TYR 31 HD1 TYR 31 26.775 34.512 13.961
228 HD2 TYR 31 HD2 TYR 31 29.753 31.415 13.621
229 HE1 TYR 31 HE1 TYR 31 27.813 35.276 16.101
230 HE2 TYR 31 HE2 TYR 31 30.775 32.167 15.762
231 HH TYR 31 HH TYR 31 29.414 34.814 17.730
Start of MODEL 13
1 H1 ALA 1 H1 ALA 1 15.520 19.091 34.743
2 H2 ALA 1 H2 ALA 1 14.924 19.953 33.461
3 H3 ALA 1 H3 ALA 1 14.943 20.629 34.936
4 HA ALA 1 HA ALA 1 17.298 20.702 35.022
5 HB1 ALA 1 HB1 ALA 1 17.193 19.447 32.239
6 HB2 ALA 1 HB2 ALA 1 18.651 19.964 33.115
7 HB3 ALA 1 HB3 ALA 1 17.687 18.609 33.725
8 H PHE 2 H PHE 2 18.218 22.710 34.450
9 HA PHE 2 HA PHE 2 16.732 24.324 32.428
10 HB2 PHE 2 HB2 PHE 2 18.557 25.348 34.612
11 HB3 PHE 2 HB3 PHE 2 17.470 26.278 33.573
12 HD1 PHE 2 HD1 PHE 2 17.842 25.090 36.821
13 HD2 PHE 2 HD2 PHE 2 14.879 25.428 33.714
14 HE1 PHE 2 HE1 PHE 2 16.036 24.938 38.514
15 HE2 PHE 2 HE2 PHE 2 13.096 25.302 35.422
16 HZ PHE 2 HZ PHE 2 13.656 25.041 37.830
17 H CYS 3 H CYS 3 17.868 25.653 30.963
18 HA CYS 3 HA CYS 3 20.319 24.655 29.830
19 HB2 CYS 3 HB2 CYS 3 18.829 27.282 29.569
20 HB3 CYS 3 HB3 CYS 3 20.230 26.871 28.590
21 H ASN 4 H ASN 4 22.331 25.757 29.615
22 HA ASN 4 HA ASN 4 22.992 27.957 31.527
23 HB2 ASN 4 HB2 ASN 4 24.552 25.392 31.013
24 HB3 ASN 4 HB3 ASN 4 25.359 26.907 31.377
25 HD21 ASN 4 HD21 ASN 4 23.108 26.283 34.619
26 HD22 ASN 4 HD22 ASN 4 22.332 26.619 33.077
27 H LEU 5 H LEU 5 22.230 29.118 29.614
28 HA LEU 5 HA LEU 5 23.284 28.628 27.047
29 HB2 LEU 5 HB2 LEU 5 21.133 29.740 27.565
30 HB3 LEU 5 HB3 LEU 5 22.019 31.164 28.114
31 HG LEU 5 HG LEU 5 22.935 31.476 25.834
32 HD11 LEU 5 HD11 LEU 5 21.173 29.113 25.070
33 HD12 LEU 5 HD12 LEU 5 21.939 30.236 23.921
34 HD13 LEU 5 HD13 LEU 5 22.948 29.210 24.934
35 HD21 LEU 5 HD21 LEU 5 20.821 32.172 24.767
36 HD22 LEU 5 HD22 LEU 5 19.900 31.159 25.900
37 HD23 LEU 5 HD23 LEU 5 20.810 32.564 26.491
38 H ARG 6 H ARG 6 24.577 30.749 29.604
39 HA ARG 6 HA ARG 6 26.659 31.910 27.919
40 HB2 ARG 6 HB2 ARG 6 26.356 31.607 30.929
41 HB3 ARG 6 HB3 ARG 6 27.806 32.285 30.213
42 HG2 ARG 6 HG2 ARG 6 25.021 33.475 29.891
43 HG3 ARG 6 HG3 ARG 6 26.263 34.002 31.021
44 HD2 ARG 6 HD2 ARG 6 26.506 35.530 29.288
45 HD3 ARG 6 HD3 ARG 6 27.790 34.360 28.959
46 HE ARG 6 HE ARG 6 25.208 33.833 27.639
47 HH11 ARG 6 HH11 ARG 6 28.314 35.453 27.110
48 HH12 ARG 6 HH12 ARG 6 28.041 35.474 25.380
49 HH21 ARG 6 HH21 ARG 6 24.974 33.990 25.485
50 HH22 ARG 6 HH22 ARG 6 26.285 34.568 24.489
51 H ARG 7 H ARG 7 26.476 28.790 29.490
52 HA ARG 7 HA ARG 7 29.335 28.233 28.853
53 HB2 ARG 7 HB2 ARG 7 28.232 27.221 30.867
54 HB3 ARG 7 HB3 ARG 7 27.174 26.303 29.818
55 HG2 ARG 7 HG2 ARG 7 30.181 26.128 29.403
56 HG3 ARG 7 HG3 ARG 7 29.473 25.307 30.784
57 HD2 ARG 7 HD2 ARG 7 28.667 24.793 27.893
58 HD3 ARG 7 HD3 ARG 7 29.772 23.808 28.853
59 HE ARG 7 HE ARG 7 27.513 23.968 30.436
60 HH11 ARG 7 HH11 ARG 7 28.103 22.650 27.180
61 HH12 ARG 7 HH12 ARG 7 26.799 21.504 27.404
62 HH21 ARG 7 HH21 ARG 7 25.792 22.565 30.464
63 HH22 ARG 7 HH22 ARG 7 25.449 21.590 29.062
64 H CYS 8 H CYS 8 26.101 27.249 27.762
65 HA CYS 8 HA CYS 8 26.866 25.546 25.663
66 HB2 CYS 8 HB2 CYS 8 24.566 25.807 26.560
67 HB3 CYS 8 HB3 CYS 8 24.480 27.412 25.839
68 H GLU 9 H GLU 9 26.253 29.129 25.396
69 HA GLU 9 HA GLU 9 27.042 29.231 22.634
70 HB2 GLU 9 HB2 GLU 9 26.824 31.289 24.863
71 HB3 GLU 9 HB3 GLU 9 27.488 31.750 23.311
72 HG2 GLU 9 HG2 GLU 9 24.808 30.351 23.326
73 HG3 GLU 9 HG3 GLU 9 24.905 32.032 23.851
74 H LEU 10 H LEU 10 29.039 29.917 25.642
75 HA LEU 10 HA LEU 10 31.292 30.656 23.961
76 HB2 LEU 10 HB2 LEU 10 30.871 30.294 26.916
77 HB3 LEU 10 HB3 LEU 10 32.503 30.340 26.316
78 HG LEU 10 HG LEU 10 31.741 32.526 27.122
79 HD11 LEU 10 HD11 LEU 10 33.537 32.360 25.437
80 HD12 LEU 10 HD12 LEU 10 32.335 32.568 24.144
81 HD13 LEU 10 HD13 LEU 10 32.617 33.865 25.313
82 HD21 LEU 10 HD21 LEU 10 29.897 32.626 24.707
83 HD22 LEU 10 HD22 LEU 10 29.368 32.453 26.400
84 HD23 LEU 10 HD23 LEU 10 30.218 33.920 25.875
85 H SER 11 H SER 11 30.354 27.570 25.438
86 HA SER 11 HA SER 11 32.859 26.253 24.719
87 HB2 SER 11 HB2 SER 11 30.133 25.208 25.545
88 HB3 SER 11 HB3 SER 11 31.507 24.167 25.157
89 HG SER 11 HG SER 11 31.606 26.236 27.130
90 H CYS 12 H CYS 12 29.701 26.735 23.005
91 HA CYS 12 HA CYS 12 30.601 24.984 20.803
92 HB2 CYS 12 HB2 CYS 12 28.177 26.777 20.999
93 HB3 CYS 12 HB3 CYS 12 28.513 25.645 19.748
94 H ARG 13 H ARG 13 30.564 28.461 21.495
95 HA ARG 13 HA ARG 13 31.177 29.445 18.883
96 HB2 ARG 13 HB2 ARG 13 30.512 30.850 20.745
97 HB3 ARG 13 HB3 ARG 13 31.986 30.461 21.641
98 HG2 ARG 13 HG2 ARG 13 33.359 31.634 20.027
99 HG3 ARG 13 HG3 ARG 13 31.992 31.855 18.924
100 HD2 ARG 13 HD2 ARG 13 32.163 32.999 21.740
101 HD3 ARG 13 HD3 ARG 13 32.580 33.902 20.276
102 HE ARG 13 HE ARG 13 30.061 33.074 19.695
103 HH11 ARG 13 HH11 ARG 13 31.319 34.941 22.412
104 HH12 ARG 13 HH12 ARG 13 29.714 35.529 22.831
105 HH21 ARG 13 HH21 ARG 13 28.096 33.884 20.298
106 HH22 ARG 13 HH22 ARG 13 27.946 34.884 21.719
107 H SER 14 H SER 14 33.286 27.985 21.346
108 HA SER 14 HA SER 14 35.777 28.301 20.021
109 HB2 SER 14 HB2 SER 14 35.442 27.386 22.332
110 HB3 SER 14 HB3 SER 14 34.856 25.873 21.605
111 HG SER 14 HG SER 14 37.402 27.111 21.319
112 H LEU 15 H LEU 15 33.135 26.049 19.430
113 HA LEU 15 HA LEU 15 34.534 24.552 17.317
114 HB2 LEU 15 HB2 LEU 15 31.652 24.246 18.213
115 HB3 LEU 15 HB3 LEU 15 32.668 23.071 17.408
116 HG LEU 15 HG LEU 15 32.925 24.029 20.284
117 HD11 LEU 15 HD11 LEU 15 31.013 22.530 19.872
118 HD12 LEU 15 HD12 LEU 15 32.095 21.339 19.115
119 HD13 LEU 15 HD13 LEU 15 32.258 21.727 20.839
120 HD21 LEU 15 HD21 LEU 15 34.618 22.231 20.529
121 HD22 LEU 15 HD22 LEU 15 34.540 21.944 18.774
122 HD23 LEU 15 HD23 LEU 15 35.166 23.481 19.410
123 H GLY 16 H GLY 16 33.148 27.507 17.284
124 HA2 GLY 16 HA2 GLY 16 32.647 28.890 15.513
125 HA3 GLY 16 HA3 GLY 16 32.791 27.527 14.413
126 H LEU 17 H LEU 17 30.468 27.519 17.110
127 HA LEU 17 HA LEU 17 28.235 27.520 15.118
128 HB2 LEU 17 HB2 LEU 17 28.126 26.397 17.899
129 HB3 LEU 17 HB3 LEU 17 27.076 26.028 16.555
130 HG LEU 17 HG LEU 17 29.914 25.142 16.983
131 HD11 LEU 17 HD11 LEU 17 28.929 22.858 16.928
132 HD12 LEU 17 HD12 LEU 17 28.400 23.853 18.277
133 HD13 LEU 17 HD13 LEU 17 27.316 23.597 16.883
134 HD21 LEU 17 HD21 LEU 17 28.077 24.469 14.617
135 HD22 LEU 17 HD22 LEU 17 29.518 25.498 14.505
136 HD23 LEU 17 HD23 LEU 17 29.694 23.789 14.894
137 H LEU 18 H LEU 18 26.097 28.081 16.017
138 HA LEU 18 HA LEU 18 26.058 30.373 17.956
139 HB2 LEU 18 HB2 LEU 18 24.002 29.641 15.836
140 HB3 LEU 18 HB3 LEU 18 24.000 31.077 16.863
141 HG LEU 18 HG LEU 18 26.047 30.437 14.702
142 HD11 LEU 18 HD11 LEU 18 23.830 30.913 13.772
143 HD12 LEU 18 HD12 LEU 18 23.750 32.420 14.716
144 HD13 LEU 18 HD13 LEU 18 24.958 32.233 13.430
145 HD21 LEU 18 HD21 LEU 18 25.639 32.986 16.316
146 HD22 LEU 18 HD22 LEU 18 27.023 31.878 16.448
147 HD23 LEU 18 HD23 LEU 18 26.761 32.785 14.955
148 H GLY 19 H GLY 19 25.293 29.775 19.909
149 HA2 GLY 19 HA2 GLY 19 23.605 27.421 20.323
150 HA3 GLY 19 HA3 GLY 19 24.295 28.472 21.539
151 H ALA 20 H ALA 20 21.523 27.314 20.841
152 HA ALA 20 HA ALA 20 20.151 29.600 22.036
153 HB1 ALA 20 HB1 ALA 20 19.051 28.118 19.615
154 HB2 ALA 20 HB2 ALA 20 18.173 29.326 20.568
155 HB3 ALA 20 HB3 ALA 20 19.612 29.804 19.648
156 H CYS 21 H CYS 21 18.578 29.130 23.414
157 HA CYS 21 HA CYS 21 18.332 26.306 24.391
158 HB2 CYS 21 HB2 CYS 21 19.316 27.783 26.018
159 HB3 CYS 21 HB3 CYS 21 18.057 28.989 25.749
160 H ILE 22 H ILE 22 16.450 25.268 24.503
161 HA ILE 22 HA ILE 22 13.885 26.783 24.502
162 HB ILE 22 HB ILE 22 14.409 24.349 22.755
163 HG12 ILE 22 HG12 ILE 22 13.670 27.214 22.002
164 HG13 ILE 22 HG13 ILE 22 15.254 26.479 21.781
165 HG21 ILE 22 HG21 ILE 22 12.034 24.543 22.097
166 HG22 ILE 22 HG22 ILE 22 12.154 24.264 23.819
167 HG23 ILE 22 HG23 ILE 22 11.815 25.903 23.216
168 HD11 ILE 22 HD11 ILE 22 12.716 25.723 20.308
169 HD12 ILE 22 HD12 ILE 22 14.181 26.474 19.664
170 HD13 ILE 22 HD13 ILE 22 14.236 24.792 20.232
171 H GLY 23 H GLY 23 12.916 26.348 26.360
172 HA2 GLY 23 HA2 GLY 23 11.982 25.242 28.112
173 HA3 GLY 23 HA3 GLY 23 12.125 23.760 27.159
174 H GLU 24 H GLU 24 13.760 22.370 27.553
175 HA GLU 24 HA GLU 24 15.286 22.688 30.115
176 HB2 GLU 24 HB2 GLU 24 15.037 20.280 30.357
177 HB3 GLU 24 HB3 GLU 24 13.452 20.995 30.080
178 HG2 GLU 24 HG2 GLU 24 13.542 20.323 27.699
179 HG3 GLU 24 HG3 GLU 24 15.165 19.677 27.910
180 H GLU 25 H GLU 25 15.987 22.790 26.842
181 HA GLU 25 HA GLU 25 18.630 21.521 27.194
182 HB2 GLU 25 HB2 GLU 25 17.254 19.759 26.372
183 HB3 GLU 25 HB3 GLU 25 16.564 20.798 25.131
184 HG2 GLU 25 HG2 GLU 25 18.038 19.227 24.106
185 HG3 GLU 25 HG3 GLU 25 18.698 20.839 23.908
186 H CYS 26 H CYS 26 20.288 22.275 25.862
187 HA CYS 26 HA CYS 26 19.677 24.644 24.137
188 HB2 CYS 26 HB2 CYS 26 20.953 25.200 26.188
189 HB3 CYS 26 HB3 CYS 26 22.233 24.118 25.652
190 H LYS 27 H LYS 27 20.181 24.578 22.090
191 HA LYS 27 HA LYS 27 22.016 22.454 21.018
192 HB2 LYS 27 HB2 LYS 27 19.632 22.116 20.434
193 HB3 LYS 27 HB3 LYS 27 19.578 23.733 19.729
194 HG2 LYS 27 HG2 LYS 27 21.336 23.057 18.077
195 HG3 LYS 27 HG3 LYS 27 21.371 21.450 18.811
196 HD2 LYS 27 HD2 LYS 27 20.034 21.298 16.858
197 HD3 LYS 27 HD3 LYS 27 18.921 21.214 18.232
198 HE2 LYS 27 HE2 LYS 27 18.231 23.515 17.919
199 HE3 LYS 27 HE3 LYS 27 19.535 23.812 16.756
200 HZ1 LYS 27 HZ1 LYS 27 17.275 21.947 16.301
201 HZ2 LYS 27 HZ2 LYS 27 17.374 23.455 15.699
202 HZ3 LYS 27 HZ3 LYS 27 18.461 22.281 15.225
203 H CYS 28 H CYS 28 23.723 23.153 19.930
204 HA CYS 28 HA CYS 28 23.736 25.932 18.882
205 HB2 CYS 28 HB2 CYS 28 26.184 25.935 19.167
206 HB3 CYS 28 HB3 CYS 28 25.314 25.866 20.684
207 H VAL 29 H VAL 29 24.445 26.316 16.811
208 HA VAL 29 HA VAL 29 24.697 23.939 15.029
209 HB VAL 29 HB VAL 29 22.963 24.833 13.543
210 HG11 VAL 29 HG11 VAL 29 22.403 23.139 15.293
211 HG12 VAL 29 HG12 VAL 29 21.846 24.471 16.334
212 HG13 VAL 29 HG13 VAL 29 21.040 24.153 14.788
213 HG21 VAL 29 HG21 VAL 29 22.336 26.842 15.742
214 HG22 VAL 29 HG22 VAL 29 23.047 27.231 14.163
215 HG23 VAL 29 HG23 VAL 29 21.412 26.571 14.250
216 HA PRO 30 HA PRO 30 27.538 26.245 12.544
217 HB2 PRO 30 HB2 PRO 30 25.973 25.282 10.144
218 HB3 PRO 30 HB3 PRO 30 27.738 25.227 10.426
219 HG2 PRO 30 HG2 PRO 30 26.282 22.996 10.756
220 HG3 PRO 30 HG3 PRO 30 27.514 23.428 11.990
221 HD2 PRO 30 HD2 PRO 30 24.521 23.915 12.066
222 HD3 PRO 30 HD3 PRO 30 25.593 23.229 13.323
223 H TYR 31 H TYR 31 27.847 27.983 11.027
224 HA TYR 31 HA TYR 31 26.039 30.207 11.282
225 HB2 TYR 31 HB2 TYR 31 28.413 29.759 9.428
226 HB3 TYR 31 HB3 TYR 31 27.637 31.298 9.701
227 HD1 TYR 31 HD1 TYR 31 30.517 30.930 9.891
228 HD2 TYR 31 HD2 TYR 31 27.495 30.519 12.941
229 HE1 TYR 31 HE1 TYR 31 32.202 31.478 11.641
230 HE2 TYR 31 HE2 TYR 31 29.175 31.106 14.677
231 HH TYR 31 HH TYR 31 31.315 32.144 14.945
Start of MODEL 14
1 H1 ALA 1 H1 ALA 1 11.446 25.447 31.221
2 H2 ALA 1 H2 ALA 1 12.508 25.602 29.985
3 H3 ALA 1 H3 ALA 1 11.847 26.942 30.644
4 HA ALA 1 HA ALA 1 12.963 26.550 32.719
5 HB1 ALA 1 HB1 ALA 1 14.692 24.725 32.810
6 HB2 ALA 1 HB2 ALA 1 13.021 24.131 32.716
7 HB3 ALA 1 HB3 ALA 1 14.071 24.099 31.274
8 H PHE 2 H PHE 2 15.030 27.398 33.153
9 HA PHE 2 HA PHE 2 16.199 28.870 30.865
10 HB2 PHE 2 HB2 PHE 2 16.631 29.102 33.860
11 HB3 PHE 2 HB3 PHE 2 17.287 30.170 32.635
12 HD1 PHE 2 HD1 PHE 2 14.589 29.689 34.895
13 HD2 PHE 2 HD2 PHE 2 15.523 31.290 31.004
14 HE1 PHE 2 HE1 PHE 2 12.584 31.131 35.014
15 HE2 PHE 2 HE2 PHE 2 13.522 32.747 31.131
16 HZ PHE 2 HZ PHE 2 12.036 32.670 33.126
17 H CYS 3 H CYS 3 17.548 27.478 29.728
18 HA CYS 3 HA CYS 3 19.512 25.743 30.823
19 HB2 CYS 3 HB2 CYS 3 19.878 27.324 28.260
20 HB3 CYS 3 HB3 CYS 3 20.502 25.734 28.655
21 H ASN 4 H ASN 4 21.863 25.971 30.886
22 HA ASN 4 HA ASN 4 22.971 28.587 31.582
23 HB2 ASN 4 HB2 ASN 4 24.255 25.868 31.069
24 HB3 ASN 4 HB3 ASN 4 25.150 27.317 31.405
25 HD21 ASN 4 HD21 ASN 4 23.903 27.535 34.856
26 HD22 ASN 4 HD22 ASN 4 24.212 28.581 33.488
27 H LEU 5 H LEU 5 22.118 29.610 29.650
28 HA LEU 5 HA LEU 5 22.845 28.779 27.036
29 HB2 LEU 5 HB2 LEU 5 20.828 30.053 27.553
30 HB3 LEU 5 HB3 LEU 5 21.800 31.440 28.047
31 HG LEU 5 HG LEU 5 22.609 31.757 25.763
32 HD11 LEU 5 HD11 LEU 5 22.640 29.476 24.876
33 HD12 LEU 5 HD12 LEU 5 20.868 29.367 25.032
34 HD13 LEU 5 HD13 LEU 5 21.615 30.496 23.872
35 HD21 LEU 5 HD21 LEU 5 20.477 32.800 26.465
36 HD22 LEU 5 HD22 LEU 5 20.470 32.417 24.734
37 HD23 LEU 5 HD23 LEU 5 19.581 31.387 25.876
38 H ARG 6 H ARG 6 24.462 31.105 29.214
39 HA ARG 6 HA ARG 6 26.413 31.978 27.210
40 HB2 ARG 6 HB2 ARG 6 26.610 31.937 30.256
41 HB3 ARG 6 HB3 ARG 6 27.779 32.678 29.181
42 HG2 ARG 6 HG2 ARG 6 24.878 33.552 29.495
43 HG3 ARG 6 HG3 ARG 6 26.296 34.313 30.212
44 HD2 ARG 6 HD2 ARG 6 25.906 35.687 28.402
45 HD3 ARG 6 HD3 ARG 6 27.162 34.621 27.788
46 HE ARG 6 HE ARG 6 25.626 33.727 26.233
47 HH11 ARG 6 HH11 ARG 6 23.700 35.536 28.601
48 HH12 ARG 6 HH12 ARG 6 22.331 35.513 27.490
49 HH21 ARG 6 HH21 ARG 6 23.885 33.893 24.986
50 HH22 ARG 6 HH22 ARG 6 22.389 34.628 25.620
51 H ARG 7 H ARG 7 26.395 29.302 29.584
52 HA ARG 7 HA ARG 7 29.070 28.408 28.913
53 HB2 ARG 7 HB2 ARG 7 27.506 27.730 30.922
54 HB3 ARG 7 HB3 ARG 7 26.834 26.557 29.809
55 HG2 ARG 7 HG2 ARG 7 28.428 25.290 30.816
56 HG3 ARG 7 HG3 ARG 7 29.383 25.864 29.449
57 HD2 ARG 7 HD2 ARG 7 29.363 27.052 32.277
58 HD3 ARG 7 HD3 ARG 7 30.558 25.922 31.663
59 HE ARG 7 HE ARG 7 31.518 27.570 30.284
60 HH11 ARG 7 HH11 ARG 7 28.937 29.065 32.178
61 HH12 ARG 7 HH12 ARG 7 29.622 30.645 31.979
62 HH21 ARG 7 HH21 ARG 7 32.277 29.458 30.067
63 HH22 ARG 7 HH22 ARG 7 31.542 30.877 30.834
64 H CYS 8 H CYS 8 25.902 27.377 27.761
65 HA CYS 8 HA CYS 8 26.715 25.489 25.803
66 HB2 CYS 8 HB2 CYS 8 24.417 25.810 26.546
67 HB3 CYS 8 HB3 CYS 8 24.406 27.448 25.900
68 H GLU 9 H GLU 9 26.211 29.062 25.362
69 HA GLU 9 HA GLU 9 27.037 29.109 22.636
70 HB2 GLU 9 HB2 GLU 9 26.915 31.187 24.848
71 HB3 GLU 9 HB3 GLU 9 27.592 31.586 23.275
72 HG2 GLU 9 HG2 GLU 9 25.504 30.944 22.143
73 HG3 GLU 9 HG3 GLU 9 24.764 30.537 23.695
74 H LEU 10 H LEU 10 29.024 29.758 25.614
75 HA LEU 10 HA LEU 10 31.415 30.333 24.143
76 HB2 LEU 10 HB2 LEU 10 30.703 29.807 27.023
77 HB3 LEU 10 HB3 LEU 10 32.373 29.605 26.583
78 HG LEU 10 HG LEU 10 31.913 31.818 27.509
79 HD11 LEU 10 HD11 LEU 10 33.185 33.105 25.903
80 HD12 LEU 10 HD12 LEU 10 33.810 31.453 25.955
81 HD13 LEU 10 HD13 LEU 10 32.790 31.974 24.597
82 HD21 LEU 10 HD21 LEU 10 29.673 32.280 26.648
83 HD22 LEU 10 HD22 LEU 10 30.795 33.559 26.184
84 HD23 LEU 10 HD23 LEU 10 30.292 32.347 24.986
85 H SER 11 H SER 11 30.249 27.237 25.529
86 HA SER 11 HA SER 11 32.548 25.660 24.910
87 HB2 SER 11 HB2 SER 11 30.694 24.895 26.306
88 HB3 SER 11 HB3 SER 11 29.582 24.951 24.931
89 HG SER 11 HG SER 11 30.722 22.886 25.636
90 H CYS 12 H CYS 12 29.820 26.682 22.864
91 HA CYS 12 HA CYS 12 30.746 25.033 20.595
92 HB2 CYS 12 HB2 CYS 12 28.362 26.896 20.812
93 HB3 CYS 12 HB3 CYS 12 28.739 25.812 19.516
94 H ARG 13 H ARG 13 30.991 28.373 21.624
95 HA ARG 13 HA ARG 13 31.520 29.680 19.154
96 HB2 ARG 13 HB2 ARG 13 31.208 30.742 21.414
97 HB3 ARG 13 HB3 ARG 13 32.823 30.189 21.871
98 HG2 ARG 13 HG2 ARG 13 33.767 31.533 19.963
99 HG3 ARG 13 HG3 ARG 13 32.140 32.114 19.591
100 HD2 ARG 13 HD2 ARG 13 33.616 32.514 22.233
101 HD3 ARG 13 HD3 ARG 13 33.491 33.716 20.934
102 HE ARG 13 HE ARG 13 30.849 32.957 21.566
103 HH11 ARG 13 HH11 ARG 13 33.408 34.702 23.309
104 HH12 ARG 13 HH12 ARG 13 32.157 35.602 24.178
105 HH21 ARG 13 HH21 ARG 13 29.515 34.074 22.744
106 HH22 ARG 13 HH22 ARG 13 30.121 35.294 23.889
107 H SER 14 H SER 14 33.638 27.710 21.209
108 HA SER 14 HA SER 14 36.049 28.080 19.665
109 HB2 SER 14 HB2 SER 14 35.177 25.782 21.459
110 HB3 SER 14 HB3 SER 14 36.817 26.006 20.824
111 HG SER 14 HG SER 14 37.085 27.805 22.008
112 H LEU 15 H LEU 15 33.219 26.155 19.055
113 HA LEU 15 HA LEU 15 34.512 24.564 16.902
114 HB2 LEU 15 HB2 LEU 15 31.707 24.414 18.069
115 HB3 LEU 15 HB3 LEU 15 32.419 23.284 16.930
116 HG LEU 15 HG LEU 15 33.274 23.723 19.822
117 HD11 LEU 15 HD11 LEU 15 31.889 21.388 18.432
118 HD12 LEU 15 HD12 LEU 15 32.402 21.431 20.127
119 HD13 LEU 15 HD13 LEU 15 31.136 22.531 19.569
120 HD21 LEU 15 HD21 LEU 15 34.705 21.716 19.485
121 HD22 LEU 15 HD22 LEU 15 34.329 21.744 17.751
122 HD23 LEU 15 HD23 LEU 15 35.246 23.073 18.498
123 H GLY 16 H GLY 16 33.025 27.523 17.242
124 HA2 GLY 16 HA2 GLY 16 32.411 29.093 15.680
125 HA3 GLY 16 HA3 GLY 16 32.590 27.907 14.392
126 H LEU 17 H LEU 17 30.380 27.540 17.226
127 HA LEU 17 HA LEU 17 28.089 27.669 15.297
128 HB2 LEU 17 HB2 LEU 17 27.837 25.993 17.728
129 HB3 LEU 17 HB3 LEU 17 27.078 25.813 16.184
130 HG LEU 17 HG LEU 17 29.918 25.134 16.856
131 HD11 LEU 17 HD11 LEU 17 27.487 23.357 16.533
132 HD12 LEU 17 HD12 LEU 17 29.163 22.759 16.559
133 HD13 LEU 17 HD13 LEU 17 28.518 23.588 17.969
134 HD21 LEU 17 HD21 LEU 17 28.284 24.411 14.360
135 HD22 LEU 17 HD22 LEU 17 29.560 25.638 14.377
136 HD23 LEU 17 HD23 LEU 17 29.971 23.948 14.663
137 H LEU 18 H LEU 18 26.227 28.601 15.847
138 HA LEU 18 HA LEU 18 26.040 30.547 18.057
139 HB2 LEU 18 HB2 LEU 18 24.266 29.622 15.752
140 HB3 LEU 18 HB3 LEU 18 23.692 30.770 16.943
141 HG LEU 18 HG LEU 18 26.222 31.282 15.389
142 HD11 LEU 18 HD11 LEU 18 23.395 32.046 14.583
143 HD12 LEU 18 HD12 LEU 18 24.886 32.599 13.790
144 HD13 LEU 18 HD13 LEU 18 24.445 30.883 13.744
145 HD21 LEU 18 HD21 LEU 18 24.252 33.202 16.662
146 HD22 LEU 18 HD22 LEU 18 25.820 32.725 17.348
147 HD23 LEU 18 HD23 LEU 18 25.762 33.608 15.819
148 H GLY 19 H GLY 19 25.440 29.787 20.082
149 HA2 GLY 19 HA2 GLY 19 23.683 27.450 20.410
150 HA3 GLY 19 HA3 GLY 19 24.362 28.419 21.685
151 H ALA 20 H ALA 20 21.614 27.380 21.126
152 HA ALA 20 HA ALA 20 20.206 29.726 22.164
153 HB1 ALA 20 HB1 ALA 20 18.282 29.422 20.676
154 HB2 ALA 20 HB2 ALA 20 19.738 29.797 19.734
155 HB3 ALA 20 HB3 ALA 20 19.131 28.129 19.804
156 H CYS 21 H CYS 21 18.648 29.184 23.629
157 HA CYS 21 HA CYS 21 18.675 26.421 24.707
158 HB2 CYS 21 HB2 CYS 21 19.063 28.229 26.240
159 HB3 CYS 21 HB3 CYS 21 17.565 29.016 25.752
160 H ILE 22 H ILE 22 17.066 24.956 24.419
161 HA ILE 22 HA ILE 22 14.432 25.897 23.339
162 HB ILE 22 HB ILE 22 16.030 23.481 22.450
163 HG12 ILE 22 HG12 ILE 22 15.393 26.064 20.947
164 HG13 ILE 22 HG13 ILE 22 16.972 25.646 21.609
165 HG21 ILE 22 HG21 ILE 22 13.549 23.139 22.423
166 HG22 ILE 22 HG22 ILE 22 13.373 24.596 21.435
167 HG23 ILE 22 HG23 ILE 22 14.218 23.162 20.804
168 HD11 ILE 22 HD11 ILE 22 17.079 23.653 20.142
169 HD12 ILE 22 HD12 ILE 22 15.585 24.203 19.339
170 HD13 ILE 22 HD13 ILE 22 17.043 25.205 19.279
171 H GLY 23 H GLY 23 13.386 25.847 25.217
172 HA2 GLY 23 HA2 GLY 23 11.899 25.000 26.716
173 HA3 GLY 23 HA3 GLY 23 12.174 23.393 26.047
174 H GLU 24 H GLU 24 14.696 22.834 26.645
175 HA GLU 24 HA GLU 24 15.365 23.290 29.486
176 HB2 GLU 24 HB2 GLU 24 15.240 20.906 30.075
177 HB3 GLU 24 HB3 GLU 24 13.649 21.502 29.605
178 HG2 GLU 24 HG2 GLU 24 13.912 20.490 27.352
179 HG3 GLU 24 HG3 GLU 24 15.531 19.937 27.778
180 H GLU 25 H GLU 25 16.262 22.060 26.292
181 HA GLU 25 HA GLU 25 19.059 21.659 27.258
182 HB2 GLU 25 HB2 GLU 25 17.458 20.038 25.297
183 HB3 GLU 25 HB3 GLU 25 19.226 20.070 25.258
184 HG2 GLU 25 HG2 GLU 25 19.273 19.391 27.664
185 HG3 GLU 25 HG3 GLU 25 17.529 19.176 27.620
186 H CYS 26 H CYS 26 20.493 22.983 26.385
187 HA CYS 26 HA CYS 26 19.709 24.759 24.185
188 HB2 CYS 26 HB2 CYS 26 20.830 25.660 26.143
189 HB3 CYS 26 HB3 CYS 26 22.218 24.604 25.883
190 H LYS 27 H LYS 27 20.286 24.675 22.159
191 HA LYS 27 HA LYS 27 22.193 22.566 21.183
192 HB2 LYS 27 HB2 LYS 27 19.907 22.024 20.601
193 HB3 LYS 27 HB3 LYS 27 19.604 23.657 19.998
194 HG2 LYS 27 HG2 LYS 27 21.047 23.334 18.088
195 HG3 LYS 27 HG3 LYS 27 21.733 21.867 18.785
196 HD2 LYS 27 HD2 LYS 27 20.245 21.162 17.093
197 HD3 LYS 27 HD3 LYS 27 19.506 20.783 18.661
198 HE2 LYS 27 HE2 LYS 27 18.093 22.828 18.464
199 HE3 LYS 27 HE3 LYS 27 18.819 23.171 16.881
200 HZ1 LYS 27 HZ1 LYS 27 16.713 21.973 16.660
201 HZ2 LYS 27 HZ2 LYS 27 17.922 21.074 16.079
202 HZ3 LYS 27 HZ3 LYS 27 17.300 20.707 17.557
203 H CYS 28 H CYS 28 23.673 23.163 19.616
204 HA CYS 28 HA CYS 28 23.685 26.014 18.842
205 HB2 CYS 28 HB2 CYS 28 26.126 26.093 19.014
206 HB3 CYS 28 HB3 CYS 28 25.333 25.854 20.565
207 H VAL 29 H VAL 29 24.504 26.524 16.758
208 HA VAL 29 HA VAL 29 24.685 24.259 14.851
209 HB VAL 29 HB VAL 29 22.956 25.093 13.428
210 HG11 VAL 29 HG11 VAL 29 21.804 24.912 16.235
211 HG12 VAL 29 HG12 VAL 29 20.972 24.601 14.707
212 HG13 VAL 29 HG13 VAL 29 22.274 23.520 15.226
213 HG21 VAL 29 HG21 VAL 29 21.426 26.911 14.098
214 HG22 VAL 29 HG22 VAL 29 22.460 27.263 15.497
215 HG23 VAL 29 HG23 VAL 29 23.069 27.507 13.851
216 HA PRO 30 HA PRO 30 27.723 26.654 12.801
217 HB2 PRO 30 HB2 PRO 30 26.408 25.871 10.204
218 HB3 PRO 30 HB3 PRO 30 28.139 25.786 10.649
219 HG2 PRO 30 HG2 PRO 30 26.626 23.549 10.679
220 HG3 PRO 30 HG3 PRO 30 27.764 23.870 12.026
221 HD2 PRO 30 HD2 PRO 30 24.773 24.328 11.938
222 HD3 PRO 30 HD3 PRO 30 25.781 23.621 13.232
223 H TYR 31 H TYR 31 28.179 28.599 11.721
224 HA TYR 31 HA TYR 31 26.178 30.661 11.678
225 HB2 TYR 31 HB2 TYR 31 28.925 30.626 10.380
226 HB3 TYR 31 HB3 TYR 31 27.972 32.053 10.771
227 HD1 TYR 31 HD1 TYR 31 27.281 30.639 13.662
228 HD2 TYR 31 HD2 TYR 31 30.835 31.696 11.487
229 HE1 TYR 31 HE1 TYR 31 28.538 30.832 15.803
230 HE2 TYR 31 HE2 TYR 31 32.100 31.863 13.615
231 HH TYR 31 HH TYR 31 32.025 31.591 15.941
Start of MODEL 15
1 H1 ALA 1 H1 ALA 1 17.133 23.507 38.160
2 H2 ALA 1 H2 ALA 1 16.513 24.917 38.712
3 H3 ALA 1 H3 ALA 1 17.604 24.086 39.625
4 HA ALA 1 HA ALA 1 18.606 26.017 38.586
5 HB1 ALA 1 HB1 ALA 1 20.567 24.886 37.657
6 HB2 ALA 1 HB2 ALA 1 20.026 24.068 39.132
7 HB3 ALA 1 HB3 ALA 1 19.673 23.358 37.539
8 H PHE 2 H PHE 2 18.221 27.430 36.985
9 HA PHE 2 HA PHE 2 16.954 26.603 34.479
10 HB2 PHE 2 HB2 PHE 2 17.982 29.316 35.381
11 HB3 PHE 2 HB3 PHE 2 16.971 29.005 33.982
12 HD1 PHE 2 HD1 PHE 2 16.908 29.904 37.430
13 HD2 PHE 2 HD2 PHE 2 14.693 27.745 34.424
14 HE1 PHE 2 HE1 PHE 2 14.855 30.050 38.823
15 HE2 PHE 2 HE2 PHE 2 12.654 27.904 35.823
16 HZ PHE 2 HZ PHE 2 12.731 29.046 38.030
17 H CYS 3 H CYS 3 17.778 27.374 32.375
18 HA CYS 3 HA CYS 3 20.201 25.957 31.868
19 HB2 CYS 3 HB2 CYS 3 18.158 26.077 30.432
20 HB3 CYS 3 HB3 CYS 3 18.599 27.723 29.979
21 H ASN 4 H ASN 4 22.232 26.545 31.414
22 HA ASN 4 HA ASN 4 23.143 29.329 31.820
23 HB2 ASN 4 HB2 ASN 4 24.566 26.641 31.579
24 HB3 ASN 4 HB3 ASN 4 25.397 28.192 31.595
25 HD21 ASN 4 HD21 ASN 4 24.575 28.848 35.050
26 HD22 ASN 4 HD22 ASN 4 25.071 29.589 33.525
27 H LEU 5 H LEU 5 22.121 30.107 29.885
28 HA LEU 5 HA LEU 5 22.644 29.190 27.295
29 HB2 LEU 5 HB2 LEU 5 20.851 30.786 27.984
30 HB3 LEU 5 HB3 LEU 5 22.077 32.040 28.209
31 HG LEU 5 HG LEU 5 22.654 31.892 25.792
32 HD11 LEU 5 HD11 LEU 5 20.324 29.930 25.718
33 HD12 LEU 5 HD12 LEU 5 21.026 30.709 24.293
34 HD13 LEU 5 HD13 LEU 5 22.015 29.603 25.240
35 HD21 LEU 5 HD21 LEU 5 21.016 33.539 26.559
36 HD22 LEU 5 HD22 LEU 5 20.578 32.944 24.957
37 HD23 LEU 5 HD23 LEU 5 19.700 32.352 26.384
38 H ARG 6 H ARG 6 24.554 31.556 29.198
39 HA ARG 6 HA ARG 6 26.540 32.133 27.217
40 HB2 ARG 6 HB2 ARG 6 26.680 31.972 30.255
41 HB3 ARG 6 HB3 ARG 6 28.033 32.528 29.286
42 HG2 ARG 6 HG2 ARG 6 25.334 33.899 29.087
43 HG3 ARG 6 HG3 ARG 6 26.454 34.254 30.402
44 HD2 ARG 6 HD2 ARG 6 26.775 35.898 28.693
45 HD3 ARG 6 HD3 ARG 6 28.198 34.850 28.774
46 HE ARG 6 HE ARG 6 26.101 34.216 26.765
47 HH11 ARG 6 HH11 ARG 6 29.294 35.662 27.243
48 HH12 ARG 6 HH12 ARG 6 29.532 35.793 25.509
49 HH21 ARG 6 HH21 ARG 6 26.639 34.089 24.703
50 HH22 ARG 6 HH22 ARG 6 28.195 34.644 24.114
51 H ARG 7 H ARG 7 26.623 29.547 29.703
52 HA ARG 7 HA ARG 7 29.128 28.440 28.778
53 HB2 ARG 7 HB2 ARG 7 28.149 28.040 31.025
54 HB3 ARG 7 HB3 ARG 7 26.877 27.054 30.298
55 HG2 ARG 7 HG2 ARG 7 28.213 25.242 30.000
56 HG3 ARG 7 HG3 ARG 7 29.622 26.198 29.524
57 HD2 ARG 7 HD2 ARG 7 28.653 25.986 32.399
58 HD3 ARG 7 HD3 ARG 7 29.889 24.933 31.683
59 HE ARG 7 HE ARG 7 30.821 27.455 31.073
60 HH11 ARG 7 HH11 ARG 7 29.981 26.069 34.220
61 HH12 ARG 7 HH12 ARG 7 31.143 27.137 34.997
62 HH21 ARG 7 HH21 ARG 7 32.207 28.578 32.080
63 HH22 ARG 7 HH22 ARG 7 32.459 28.463 33.812
64 H CYS 8 H CYS 8 25.777 27.736 27.892
65 HA CYS 8 HA CYS 8 26.336 25.661 25.986
66 HB2 CYS 8 HB2 CYS 8 24.083 26.207 26.830
67 HB3 CYS 8 HB3 CYS 8 24.163 27.791 26.076
68 H GLU 9 H GLU 9 26.037 29.211 25.378
69 HA GLU 9 HA GLU 9 26.727 29.071 22.613
70 HB2 GLU 9 HB2 GLU 9 26.877 31.289 24.694
71 HB3 GLU 9 HB3 GLU 9 27.259 31.559 22.994
72 HG2 GLU 9 HG2 GLU 9 25.039 30.928 22.290
73 HG3 GLU 9 HG3 GLU 9 24.566 30.471 23.916
74 H LEU 10 H LEU 10 28.821 29.801 25.441
75 HA LEU 10 HA LEU 10 31.203 30.364 23.986
76 HB2 LEU 10 HB2 LEU 10 30.503 29.638 26.836
77 HB3 LEU 10 HB3 LEU 10 32.162 29.466 26.362
78 HG LEU 10 HG LEU 10 31.657 31.601 27.488
79 HD11 LEU 10 HD11 LEU 10 33.641 31.286 26.042
80 HD12 LEU 10 HD12 LEU 10 32.703 31.899 24.659
81 HD13 LEU 10 HD13 LEU 10 33.057 32.956 26.043
82 HD21 LEU 10 HD21 LEU 10 30.256 32.382 24.893
83 HD22 LEU 10 HD22 LEU 10 29.497 32.216 26.492
84 HD23 LEU 10 HD23 LEU 10 30.716 33.463 26.218
85 H SER 11 H SER 11 30.037 27.244 25.382
86 HA SER 11 HA SER 11 32.382 25.744 24.728
87 HB2 SER 11 HB2 SER 11 30.671 24.923 26.246
88 HB3 SER 11 HB3 SER 11 29.474 24.906 24.937
89 HG SER 11 HG SER 11 31.841 23.343 25.153
90 H CYS 12 H CYS 12 29.560 26.634 22.746
91 HA CYS 12 HA CYS 12 30.495 24.930 20.517
92 HB2 CYS 12 HB2 CYS 12 28.133 26.816 20.650
93 HB3 CYS 12 HB3 CYS 12 28.499 25.653 19.423
94 H ARG 13 H ARG 13 30.689 28.346 21.422
95 HA ARG 13 HA ARG 13 31.431 29.335 18.822
96 HB2 ARG 13 HB2 ARG 13 30.784 30.756 20.765
97 HB3 ARG 13 HB3 ARG 13 32.341 30.386 21.535
98 HG2 ARG 13 HG2 ARG 13 33.551 31.445 19.671
99 HG3 ARG 13 HG3 ARG 13 32.057 31.587 18.738
100 HD2 ARG 13 HD2 ARG 13 32.589 33.735 19.621
101 HD3 ARG 13 HD3 ARG 13 31.146 33.138 20.462
102 HE ARG 13 HE ARG 13 33.423 32.388 22.007
103 HH11 ARG 13 HH11 ARG 13 31.845 35.377 21.063
104 HH12 ARG 13 HH12 ARG 13 32.438 36.219 22.469
105 HH21 ARG 13 HH21 ARG 13 34.135 33.440 23.676
106 HH22 ARG 13 HH22 ARG 13 33.725 35.123 23.983
107 H SER 14 H SER 14 33.337 27.659 21.314
108 HA SER 14 HA SER 14 35.893 27.840 20.064
109 HB2 SER 14 HB2 SER 14 34.709 25.509 21.627
110 HB3 SER 14 HB3 SER 14 36.437 25.821 21.330
111 HG SER 14 HG SER 14 35.720 26.600 23.380
112 H LEU 15 H LEU 15 33.060 26.143 19.030
113 HA LEU 15 HA LEU 15 34.495 24.554 16.964
114 HB2 LEU 15 HB2 LEU 15 31.603 24.325 17.866
115 HB3 LEU 15 HB3 LEU 15 32.509 23.180 16.894
116 HG LEU 15 HG LEU 15 33.052 23.787 19.839
117 HD11 LEU 15 HD11 LEU 15 31.609 21.458 18.532
118 HD12 LEU 15 HD12 LEU 15 32.035 21.590 20.256
119 HD13 LEU 15 HD13 LEU 15 30.876 22.721 19.538
120 HD21 LEU 15 HD21 LEU 15 35.061 22.951 18.686
121 HD22 LEU 15 HD22 LEU 15 34.399 21.714 19.760
122 HD23 LEU 15 HD23 LEU 15 34.125 21.599 18.010
123 H GLY 16 H GLY 16 33.200 27.555 17.204
124 HA2 GLY 16 HA2 GLY 16 32.582 29.107 15.630
125 HA3 GLY 16 HA3 GLY 16 32.771 27.891 14.367
126 H LEU 17 H LEU 17 30.471 27.592 17.113
127 HA LEU 17 HA LEU 17 28.203 27.944 15.180
128 HB2 LEU 17 HB2 LEU 17 27.877 26.249 17.600
129 HB3 LEU 17 HB3 LEU 17 27.052 26.148 16.081
130 HG LEU 17 HG LEU 17 29.847 25.214 16.658
131 HD11 LEU 17 HD11 LEU 17 28.889 22.935 16.389
132 HD12 LEU 17 HD12 LEU 17 28.303 23.815 17.795
133 HD13 LEU 17 HD13 LEU 17 27.269 23.664 16.351
134 HD21 LEU 17 HD21 LEU 17 29.732 24.066 14.450
135 HD22 LEU 17 HD22 LEU 17 28.093 24.699 14.189
136 HD23 LEU 17 HD23 LEU 17 29.486 25.794 14.203
137 H LEU 18 H LEU 18 26.329 28.889 15.881
138 HA LEU 18 HA LEU 18 26.312 30.701 18.225
139 HB2 LEU 18 HB2 LEU 18 24.286 29.910 16.084
140 HB3 LEU 18 HB3 LEU 18 23.896 31.006 17.401
141 HG LEU 18 HG LEU 18 26.169 31.563 15.479
142 HD11 LEU 18 HD11 LEU 18 23.237 32.320 15.240
143 HD12 LEU 18 HD12 LEU 18 24.556 33.032 14.264
144 HD13 LEU 18 HD13 LEU 18 24.181 31.308 14.139
145 HD21 LEU 18 HD21 LEU 18 26.164 32.899 17.563
146 HD22 LEU 18 HD22 LEU 18 25.765 33.915 16.176
147 HD23 LEU 18 HD23 LEU 18 24.481 33.368 17.276
148 H GLY 19 H GLY 19 25.651 29.945 20.221
149 HA2 GLY 19 HA2 GLY 19 23.987 27.492 20.377
150 HA3 GLY 19 HA3 GLY 19 24.676 28.320 21.731
151 H ALA 20 H ALA 20 22.073 27.304 21.422
152 HA ALA 20 HA ALA 20 20.576 29.583 22.463
153 HB1 ALA 20 HB1 ALA 20 18.559 28.994 21.158
154 HB2 ALA 20 HB2 ALA 20 19.881 29.503 20.090
155 HB3 ALA 20 HB3 ALA 20 19.491 27.776 20.258
156 H CYS 21 H CYS 21 18.867 28.842 23.872
157 HA CYS 21 HA CYS 21 18.904 25.940 24.537
158 HB2 CYS 21 HB2 CYS 21 20.283 27.148 26.150
159 HB3 CYS 21 HB3 CYS 21 18.875 28.123 26.625
160 H ILE 22 H ILE 22 17.091 24.981 24.428
161 HA ILE 22 HA ILE 22 14.521 26.486 24.229
162 HB ILE 22 HB ILE 22 15.273 23.632 23.465
163 HG12 ILE 22 HG12 ILE 22 14.722 26.064 21.695
164 HG13 ILE 22 HG13 ILE 22 16.319 25.392 22.019
165 HG21 ILE 22 HG21 ILE 22 13.060 23.509 22.410
166 HG22 ILE 22 HG22 ILE 22 12.860 23.865 24.113
167 HG23 ILE 22 HG23 ILE 22 12.693 25.173 22.922
168 HD11 ILE 22 HD11 ILE 22 15.611 23.229 20.979
169 HD12 ILE 22 HD12 ILE 22 14.094 24.020 20.477
170 HD13 ILE 22 HD13 ILE 22 15.644 24.616 19.872
171 H GLY 23 H GLY 23 13.941 26.871 26.329
172 HA2 GLY 23 HA2 GLY 23 13.183 26.574 28.451
173 HA3 GLY 23 HA3 GLY 23 12.838 24.902 28.022
174 H GLU 24 H GLU 24 14.887 23.502 27.958
175 HA GLU 24 HA GLU 24 16.868 24.097 30.103
176 HB2 GLU 24 HB2 GLU 24 16.417 22.034 31.251
177 HB3 GLU 24 HB3 GLU 24 14.904 22.924 31.100
178 HG2 GLU 24 HG2 GLU 24 14.483 21.477 28.970
179 HG3 GLU 24 HG3 GLU 24 15.832 20.487 29.515
180 H GLU 25 H GLU 25 16.299 22.966 26.957
181 HA GLU 25 HA GLU 25 18.650 21.146 26.932
182 HB2 GLU 25 HB2 GLU 25 16.617 20.230 26.049
183 HB3 GLU 25 HB3 GLU 25 16.404 21.608 24.953
184 HG2 GLU 25 HG2 GLU 25 18.289 20.961 23.618
185 HG3 GLU 25 HG3 GLU 25 18.848 19.816 24.840
186 H CYS 26 H CYS 26 20.521 22.017 26.363
187 HA CYS 26 HA CYS 26 20.746 24.501 24.776
188 HB2 CYS 26 HB2 CYS 26 22.339 24.299 26.511
189 HB3 CYS 26 HB3 CYS 26 22.698 22.627 26.095
190 H LYS 27 H LYS 27 21.201 24.638 22.676
191 HA LYS 27 HA LYS 27 22.271 22.347 21.124
192 HB2 LYS 27 HB2 LYS 27 19.877 24.024 20.247
193 HB3 LYS 27 HB3 LYS 27 20.708 22.839 19.250
194 HG2 LYS 27 HG2 LYS 27 19.259 22.117 21.828
195 HG3 LYS 27 HG3 LYS 27 18.477 22.132 20.250
196 HD2 LYS 27 HD2 LYS 27 20.969 20.473 20.762
197 HD3 LYS 27 HD3 LYS 27 19.339 19.882 21.092
198 HE2 LYS 27 HE2 LYS 27 18.719 20.433 18.708
199 HE3 LYS 27 HE3 LYS 27 20.427 20.800 18.393
200 HZ1 LYS 27 HZ1 LYS 27 19.817 18.525 17.782
201 HZ2 LYS 27 HZ2 LYS 27 20.967 18.496 18.944
202 HZ3 LYS 27 HZ3 LYS 27 19.423 18.153 19.334
203 H CYS 28 H CYS 28 23.486 23.078 19.248
204 HA CYS 28 HA CYS 28 23.627 25.989 18.844
205 HB2 CYS 28 HB2 CYS 28 26.103 25.950 18.903
206 HB3 CYS 28 HB3 CYS 28 25.288 25.781 20.452
207 H VAL 29 H VAL 29 24.464 26.670 16.828
208 HA VAL 29 HA VAL 29 24.509 24.626 14.676
209 HB VAL 29 HB VAL 29 22.739 25.738 13.468
210 HG11 VAL 29 HG11 VAL 29 20.833 24.992 14.731
211 HG12 VAL 29 HG12 VAL 29 22.164 23.869 15.031
212 HG13 VAL 29 HG13 VAL 29 21.720 25.080 16.259
213 HG21 VAL 29 HG21 VAL 29 21.259 27.408 14.527
214 HG22 VAL 29 HG22 VAL 29 22.363 27.511 15.912
215 HG23 VAL 29 HG23 VAL 29 22.892 28.036 14.300
216 HA PRO 30 HA PRO 30 27.436 27.168 12.648
217 HB2 PRO 30 HB2 PRO 30 25.814 26.778 10.127
218 HB3 PRO 30 HB3 PRO 30 27.586 26.635 10.342
219 HG2 PRO 30 HG2 PRO 30 26.077 24.411 10.283
220 HG3 PRO 30 HG3 PRO 30 27.309 24.579 11.581
221 HD2 PRO 30 HD2 PRO 30 24.327 25.126 11.732
222 HD3 PRO 30 HD3 PRO 30 25.370 24.204 12.856
223 H TYR 31 H TYR 31 27.953 29.203 11.886
224 HA TYR 31 HA TYR 31 26.147 31.416 12.211
225 HB2 TYR 31 HB2 TYR 31 28.874 31.234 10.865
226 HB3 TYR 31 HB3 TYR 31 28.017 32.727 11.182
227 HD1 TYR 31 HD1 TYR 31 30.645 30.827 12.347
228 HD2 TYR 31 HD2 TYR 31 27.186 32.964 13.764
229 HE1 TYR 31 HE1 TYR 31 31.738 31.132 14.565
230 HE2 TYR 31 HE2 TYR 31 28.262 33.226 15.998
231 HH TYR 31 HH TYR 31 30.156 32.901 17.243
Start of MODEL 16
1 H1 ALA 1 H1 ALA 1 12.107 28.717 34.708
2 H2 ALA 1 H2 ALA 1 11.117 27.448 34.411
3 H3 ALA 1 H3 ALA 1 11.758 28.315 33.155
4 HA ALA 1 HA ALA 1 13.192 26.588 35.053
5 HB1 ALA 1 HB1 ALA 1 13.773 25.219 33.090
6 HB2 ALA 1 HB2 ALA 1 12.017 25.351 33.262
7 HB3 ALA 1 HB3 ALA 1 12.865 26.312 32.029
8 H PHE 2 H PHE 2 15.494 26.365 34.697
9 HA PHE 2 HA PHE 2 16.742 28.865 33.614
10 HB2 PHE 2 HB2 PHE 2 17.840 27.006 35.734
11 HB3 PHE 2 HB3 PHE 2 18.484 28.569 35.247
12 HD1 PHE 2 HD1 PHE 2 16.847 27.028 37.847
13 HD2 PHE 2 HD2 PHE 2 16.442 30.515 35.340
14 HE1 PHE 2 HE1 PHE 2 15.546 28.162 39.624
15 HE2 PHE 2 HE2 PHE 2 15.155 31.646 37.127
16 HZ PHE 2 HZ PHE 2 14.699 30.478 39.278
17 H CYS 3 H CYS 3 18.597 28.809 32.389
18 HA CYS 3 HA CYS 3 19.607 26.179 31.411
19 HB2 CYS 3 HB2 CYS 3 17.845 27.047 29.899
20 HB3 CYS 3 HB3 CYS 3 18.807 28.496 29.632
21 H ASN 4 H ASN 4 21.814 26.112 31.096
22 HA ASN 4 HA ASN 4 23.404 28.559 31.599
23 HB2 ASN 4 HB2 ASN 4 24.304 25.715 31.049
24 HB3 ASN 4 HB3 ASN 4 25.331 27.114 31.249
25 HD21 ASN 4 HD21 ASN 4 24.883 27.548 34.718
26 HD22 ASN 4 HD22 ASN 4 25.179 28.407 33.196
27 H LEU 5 H LEU 5 22.123 29.419 29.723
28 HA LEU 5 HA LEU 5 22.634 28.689 27.006
29 HB2 LEU 5 HB2 LEU 5 20.736 30.045 27.663
30 HB3 LEU 5 HB3 LEU 5 21.787 31.301 28.310
31 HG LEU 5 HG LEU 5 22.587 31.869 26.058
32 HD11 LEU 5 HD11 LEU 5 21.481 30.935 24.059
33 HD12 LEU 5 HD12 LEU 5 22.377 29.680 24.912
34 HD13 LEU 5 HD13 LEU 5 20.602 29.769 25.070
35 HD21 LEU 5 HD21 LEU 5 19.550 31.715 26.293
36 HD22 LEU 5 HD22 LEU 5 20.589 32.975 26.981
37 HD23 LEU 5 HD23 LEU 5 20.457 32.808 25.225
38 H ARG 6 H ARG 6 24.341 31.030 29.144
39 HA ARG 6 HA ARG 6 26.280 31.912 27.198
40 HB2 ARG 6 HB2 ARG 6 26.192 31.804 30.242
41 HB3 ARG 6 HB3 ARG 6 27.561 32.467 29.379
42 HG2 ARG 6 HG2 ARG 6 24.682 33.481 29.169
43 HG3 ARG 6 HG3 ARG 6 25.938 34.179 30.192
44 HD2 ARG 6 HD2 ARG 6 25.958 34.071 27.145
45 HD3 ARG 6 HD3 ARG 6 25.689 35.492 28.168
46 HE ARG 6 HE ARG 6 28.211 34.202 28.784
47 HH11 ARG 6 HH11 ARG 6 26.848 36.265 26.298
48 HH12 ARG 6 HH12 ARG 6 28.417 36.952 25.948
49 HH21 ARG 6 HH21 ARG 6 30.059 35.215 28.395
50 HH22 ARG 6 HH22 ARG 6 30.136 36.559 27.241
51 H ARG 7 H ARG 7 26.411 29.171 29.569
52 HA ARG 7 HA ARG 7 29.123 28.481 28.839
53 HB2 ARG 7 HB2 ARG 7 27.796 27.812 30.944
54 HB3 ARG 7 HB3 ARG 7 27.001 26.596 29.920
55 HG2 ARG 7 HG2 ARG 7 29.236 25.594 29.410
56 HG3 ARG 7 HG3 ARG 7 30.000 26.835 30.411
57 HD2 ARG 7 HD2 ARG 7 29.789 24.891 31.794
58 HD3 ARG 7 HD3 ARG 7 28.595 26.064 32.364
59 HE ARG 7 HE ARG 7 27.519 24.190 30.379
60 HH11 ARG 7 HH11 ARG 7 27.695 24.791 33.824
61 HH12 ARG 7 HH12 ARG 7 27.036 23.222 34.222
62 HH21 ARG 7 HH21 ARG 7 26.736 22.214 30.956
63 HH22 ARG 7 HH22 ARG 7 26.335 21.881 32.610
64 H CYS 8 H CYS 8 25.959 27.375 27.715
65 HA CYS 8 HA CYS 8 26.797 25.397 25.860
66 HB2 CYS 8 HB2 CYS 8 24.486 25.659 26.586
67 HB3 CYS 8 HB3 CYS 8 24.421 27.283 25.909
68 H GLU 9 H GLU 9 26.073 28.894 25.289
69 HA GLU 9 HA GLU 9 26.865 29.032 22.582
70 HB2 GLU 9 HB2 GLU 9 26.816 31.055 24.853
71 HB3 GLU 9 HB3 GLU 9 27.393 31.496 23.255
72 HG2 GLU 9 HG2 GLU 9 24.812 30.109 23.051
73 HG3 GLU 9 HG3 GLU 9 24.718 31.473 24.164
74 H LEU 10 H LEU 10 28.951 29.841 25.470
75 HA LEU 10 HA LEU 10 31.194 30.393 23.780
76 HB2 LEU 10 HB2 LEU 10 30.810 29.963 26.740
77 HB3 LEU 10 HB3 LEU 10 32.436 29.940 26.096
78 HG LEU 10 HG LEU 10 31.870 32.124 26.972
79 HD11 LEU 10 HD11 LEU 10 32.696 33.472 25.177
80 HD12 LEU 10 HD12 LEU 10 33.454 31.881 25.035
81 HD13 LEU 10 HD13 LEU 10 32.130 32.343 23.942
82 HD21 LEU 10 HD21 LEU 10 29.477 32.292 26.534
83 HD22 LEU 10 HD22 LEU 10 30.335 33.660 25.832
84 HD23 LEU 10 HD23 LEU 10 29.764 32.358 24.778
85 H SER 11 H SER 11 30.271 27.324 25.402
86 HA SER 11 HA SER 11 32.562 25.843 24.541
87 HB2 SER 11 HB2 SER 11 31.041 25.071 26.297
88 HB3 SER 11 HB3 SER 11 29.703 24.966 25.132
89 HG SER 11 HG SER 11 30.952 22.987 25.729
90 H CYS 12 H CYS 12 29.660 26.769 22.740
91 HA CYS 12 HA CYS 12 30.384 24.996 20.477
92 HB2 CYS 12 HB2 CYS 12 28.152 27.028 20.834
93 HB3 CYS 12 HB3 CYS 12 28.355 25.953 19.464
94 H ARG 13 H ARG 13 30.599 28.482 21.318
95 HA ARG 13 HA ARG 13 31.259 29.442 18.715
96 HB2 ARG 13 HB2 ARG 13 31.552 30.431 21.563
97 HB3 ARG 13 HB3 ARG 13 32.200 31.351 20.208
98 HG2 ARG 13 HG2 ARG 13 30.051 31.533 19.135
99 HG3 ARG 13 HG3 ARG 13 29.316 30.401 20.271
100 HD2 ARG 13 HD2 ARG 13 29.753 31.974 22.140
101 HD3 ARG 13 HD3 ARG 13 30.458 33.127 20.995
102 HE ARG 13 HE ARG 13 27.600 32.169 20.973
103 HH11 ARG 13 HH11 ARG 13 29.847 34.786 20.099
104 HH12 ARG 13 HH12 ARG 13 28.540 35.672 19.352
105 HH21 ARG 13 HH21 ARG 13 26.112 33.454 20.396
106 HH22 ARG 13 HH22 ARG 13 26.458 35.092 19.833
107 H SER 14 H SER 14 33.283 28.183 21.325
108 HA SER 14 HA SER 14 35.813 28.719 20.008
109 HB2 SER 14 HB2 SER 14 35.421 28.244 22.460
110 HB3 SER 14 HB3 SER 14 35.250 26.542 22.038
111 HG SER 14 HG SER 14 37.349 26.460 21.475
112 H LEU 15 H LEU 15 33.335 26.560 19.142
113 HA LEU 15 HA LEU 15 35.141 25.002 17.356
114 HB2 LEU 15 HB2 LEU 15 32.299 24.323 18.186
115 HB3 LEU 15 HB3 LEU 15 33.417 23.308 17.266
116 HG LEU 15 HG LEU 15 33.743 24.091 20.192
117 HD11 LEU 15 HD11 LEU 15 33.237 21.755 20.637
118 HD12 LEU 15 HD12 LEU 15 31.893 22.520 19.757
119 HD13 LEU 15 HD13 LEU 15 33.026 21.445 18.899
120 HD21 LEU 15 HD21 LEU 15 35.382 22.216 18.445
121 HD22 LEU 15 HD22 LEU 15 35.946 23.730 19.185
122 HD23 LEU 15 HD23 LEU 15 35.516 22.358 20.212
123 H GLY 16 H GLY 16 33.188 27.663 17.360
124 HA2 GLY 16 HA2 GLY 16 32.544 29.020 15.647
125 HA3 GLY 16 HA3 GLY 16 32.907 27.770 14.471
126 H LEU 17 H LEU 17 30.603 27.369 17.186
127 HA LEU 17 HA LEU 17 28.322 27.582 15.282
128 HB2 LEU 17 HB2 LEU 17 27.507 25.767 17.286
129 HB3 LEU 17 HB3 LEU 17 27.669 25.510 15.568
130 HG LEU 17 HG LEU 17 29.885 24.981 17.517
131 HD11 LEU 17 HD11 LEU 17 29.290 22.602 17.244
132 HD12 LEU 17 HD12 LEU 17 28.004 23.529 18.002
133 HD13 LEU 17 HD13 LEU 17 27.861 23.072 16.295
134 HD21 LEU 17 HD21 LEU 17 29.429 23.966 14.654
135 HD22 LEU 17 HD22 LEU 17 30.639 25.175 15.082
136 HD23 LEU 17 HD23 LEU 17 30.793 23.543 15.708
137 H LEU 18 H LEU 18 26.403 28.357 16.001
138 HA LEU 18 HA LEU 18 26.492 30.234 18.314
139 HB2 LEU 18 HB2 LEU 18 24.667 29.880 15.895
140 HB3 LEU 18 HB3 LEU 18 24.378 31.069 17.130
141 HG LEU 18 HG LEU 18 26.877 30.949 15.398
142 HD11 LEU 18 HD11 LEU 18 24.855 31.473 14.097
143 HD12 LEU 18 HD12 LEU 18 24.434 32.774 15.234
144 HD13 LEU 18 HD13 LEU 18 25.903 32.887 14.239
145 HD21 LEU 18 HD21 LEU 18 25.871 33.110 17.322
146 HD22 LEU 18 HD22 LEU 18 27.331 32.115 17.521
147 HD23 LEU 18 HD23 LEU 18 27.242 33.280 16.205
148 H GLY 19 H GLY 19 25.223 29.984 20.109
149 HA2 GLY 19 HA2 GLY 19 23.433 27.594 20.229
150 HA3 GLY 19 HA3 GLY 19 24.252 28.319 21.588
151 H ALA 20 H ALA 20 21.411 27.622 20.831
152 HA ALA 20 HA ALA 20 20.214 29.859 22.305
153 HB1 ALA 20 HB1 ALA 20 18.220 29.852 20.869
154 HB2 ALA 20 HB2 ALA 20 19.665 30.300 19.938
155 HB3 ALA 20 HB3 ALA 20 18.984 28.663 19.787
156 H CYS 21 H CYS 21 18.421 29.241 23.522
157 HA CYS 21 HA CYS 21 18.248 26.326 24.146
158 HB2 CYS 21 HB2 CYS 21 19.766 27.583 25.640
159 HB3 CYS 21 HB3 CYS 21 18.412 28.592 26.155
160 H ILE 22 H ILE 22 16.470 25.407 24.880
161 HA ILE 22 HA ILE 22 13.911 26.973 24.973
162 HB ILE 22 HB ILE 22 14.363 24.108 24.091
163 HG12 ILE 22 HG12 ILE 22 15.081 25.676 22.347
164 HG13 ILE 22 HG13 ILE 22 13.656 24.775 21.880
165 HG21 ILE 22 HG21 ILE 22 11.794 25.720 24.368
166 HG22 ILE 22 HG22 ILE 22 11.919 24.186 23.481
167 HG23 ILE 22 HG23 ILE 22 12.224 24.224 25.217
168 HD11 ILE 22 HD11 ILE 22 13.527 27.122 21.161
169 HD12 ILE 22 HD12 ILE 22 12.220 26.748 22.295
170 HD13 ILE 22 HD13 ILE 22 13.642 27.673 22.840
171 H GLY 23 H GLY 23 13.869 27.432 27.094
172 HA2 GLY 23 HA2 GLY 23 13.265 27.155 29.283
173 HA3 GLY 23 HA3 GLY 23 12.941 25.462 28.977
174 H GLU 24 H GLU 24 14.941 24.109 28.719
175 HA GLU 24 HA GLU 24 17.207 24.831 30.499
176 HB2 GLU 24 HB2 GLU 24 16.968 22.874 31.808
177 HB3 GLU 24 HB3 GLU 24 15.360 23.593 31.711
178 HG2 GLU 24 HG2 GLU 24 15.042 21.954 29.653
179 HG3 GLU 24 HG3 GLU 24 16.460 21.135 30.289
180 H GLU 25 H GLU 25 16.240 23.475 27.498
181 HA GLU 25 HA GLU 25 18.755 21.878 27.242
182 HB2 GLU 25 HB2 GLU 25 16.054 21.564 25.925
183 HB3 GLU 25 HB3 GLU 25 17.509 20.830 25.267
184 HG2 GLU 25 HG2 GLU 25 16.401 20.312 28.054
185 HG3 GLU 25 HG3 GLU 25 16.191 19.264 26.655
186 H CYS 26 H CYS 26 20.283 22.610 25.943
187 HA CYS 26 HA CYS 26 19.653 24.858 24.083
188 HB2 CYS 26 HB2 CYS 26 20.958 25.434 26.084
189 HB3 CYS 26 HB3 CYS 26 22.185 24.266 25.618
190 H LYS 27 H LYS 27 19.884 24.587 22.036
191 HA LYS 27 HA LYS 27 21.762 22.540 20.916
192 HB2 LYS 27 HB2 LYS 27 19.525 22.029 20.296
193 HB3 LYS 27 HB3 LYS 27 19.153 23.698 19.890
194 HG2 LYS 27 HG2 LYS 27 20.580 23.583 17.896
195 HG3 LYS 27 HG3 LYS 27 21.170 21.986 18.385
196 HD2 LYS 27 HD2 LYS 27 19.546 21.614 16.682
197 HD3 LYS 27 HD3 LYS 27 18.831 21.123 18.218
198 HE2 LYS 27 HE2 LYS 27 17.686 23.415 18.283
199 HE3 LYS 27 HE3 LYS 27 18.239 23.645 16.618
200 HZ1 LYS 27 HZ1 LYS 27 16.008 22.713 16.605
201 HZ2 LYS 27 HZ2 LYS 27 17.003 21.546 16.067
202 HZ3 LYS 27 HZ3 LYS 27 16.452 21.484 17.608
203 H CYS 28 H CYS 28 23.428 23.219 19.802
204 HA CYS 28 HA CYS 28 23.455 25.994 18.757
205 HB2 CYS 28 HB2 CYS 28 25.870 26.083 19.049
206 HB3 CYS 28 HB3 CYS 28 25.018 25.879 20.584
207 H VAL 29 H VAL 29 24.533 26.384 16.794
208 HA VAL 29 HA VAL 29 24.721 24.091 14.922
209 HB VAL 29 HB VAL 29 23.141 25.129 13.362
210 HG11 VAL 29 HG11 VAL 29 21.785 24.682 16.060
211 HG12 VAL 29 HG12 VAL 29 21.098 24.470 14.439
212 HG13 VAL 29 HG13 VAL 29 22.373 23.382 14.991
213 HG21 VAL 29 HG21 VAL 29 21.571 26.887 14.157
214 HG22 VAL 29 HG22 VAL 29 22.522 27.080 15.639
215 HG23 VAL 29 HG23 VAL 29 23.221 27.480 14.053
216 HA PRO 30 HA PRO 30 27.999 26.463 13.247
217 HB2 PRO 30 HB2 PRO 30 27.125 25.614 10.490
218 HB3 PRO 30 HB3 PRO 30 28.752 25.524 11.252
219 HG2 PRO 30 HG2 PRO 30 27.224 23.302 11.071
220 HG3 PRO 30 HG3 PRO 30 28.113 23.657 12.588
221 HD2 PRO 30 HD2 PRO 30 25.189 24.170 11.966
222 HD3 PRO 30 HD3 PRO 30 25.934 23.436 13.413
223 H TYR 31 H TYR 31 28.632 28.346 12.101
224 HA TYR 31 HA TYR 31 26.800 30.463 11.689
225 HB2 TYR 31 HB2 TYR 31 29.458 30.105 10.279
226 HB3 TYR 31 HB3 TYR 31 28.613 31.613 10.564
227 HD1 TYR 31 HD1 TYR 31 31.494 30.241 11.368
228 HD2 TYR 31 HD2 TYR 31 27.971 31.598 13.427
229 HE1 TYR 31 HE1 TYR 31 32.853 30.645 13.411
230 HE2 TYR 31 HE2 TYR 31 29.332 31.999 15.485
231 HH TYR 31 HH TYR 31 31.504 32.134 16.344
Start of MODEL 17
1 H1 ALA 1 H1 ALA 1 15.303 23.960 38.983
2 H2 ALA 1 H2 ALA 1 15.969 22.915 37.912
3 H3 ALA 1 H3 ALA 1 14.863 24.044 37.411
4 HA ALA 1 HA ALA 1 16.387 25.809 38.115
5 HB1 ALA 1 HB1 ALA 1 18.748 25.274 38.386
6 HB2 ALA 1 HB2 ALA 1 17.799 24.390 39.597
7 HB3 ALA 1 HB3 ALA 1 18.418 23.544 38.164
8 H PHE 2 H PHE 2 17.254 26.942 36.449
9 HA PHE 2 HA PHE 2 16.680 25.884 33.819
10 HB2 PHE 2 HB2 PHE 2 17.630 28.618 34.727
11 HB3 PHE 2 HB3 PHE 2 16.939 28.231 33.156
12 HD1 PHE 2 HD1 PHE 2 16.202 29.041 36.643
13 HD2 PHE 2 HD2 PHE 2 14.522 27.404 33.021
14 HE1 PHE 2 HE1 PHE 2 13.922 29.253 37.600
15 HE2 PHE 2 HE2 PHE 2 12.244 27.649 33.967
16 HZ PHE 2 HZ PHE 2 11.942 28.561 36.266
17 H CYS 3 H CYS 3 18.053 26.275 31.920
18 HA CYS 3 HA CYS 3 20.632 25.024 32.230
19 HB2 CYS 3 HB2 CYS 3 20.723 25.184 29.793
20 HB3 CYS 3 HB3 CYS 3 19.168 24.566 30.354
21 H ASN 4 H ASN 4 22.642 25.781 31.285
22 HA ASN 4 HA ASN 4 23.276 28.618 31.867
23 HB2 ASN 4 HB2 ASN 4 24.986 26.153 31.311
24 HB3 ASN 4 HB3 ASN 4 25.600 27.807 31.495
25 HD21 ASN 4 HD21 ASN 4 24.979 28.035 34.966
26 HD22 ASN 4 HD22 ASN 4 25.357 28.904 33.479
27 H LEU 5 H LEU 5 21.996 29.360 30.008
28 HA LEU 5 HA LEU 5 22.469 28.755 27.310
29 HB2 LEU 5 HB2 LEU 5 20.572 29.960 28.173
30 HB3 LEU 5 HB3 LEU 5 21.567 31.300 28.704
31 HG LEU 5 HG LEU 5 20.143 31.663 26.704
32 HD11 LEU 5 HD11 LEU 5 22.083 33.120 27.220
33 HD12 LEU 5 HD12 LEU 5 23.052 32.164 26.067
34 HD13 LEU 5 HD13 LEU 5 21.632 33.049 25.507
35 HD21 LEU 5 HD21 LEU 5 22.176 30.026 25.180
36 HD22 LEU 5 HD22 LEU 5 20.517 29.509 25.583
37 HD23 LEU 5 HD23 LEU 5 20.781 30.925 24.542
38 H ARG 6 H ARG 6 24.165 31.245 29.270
39 HA ARG 6 HA ARG 6 25.874 32.196 27.135
40 HB2 ARG 6 HB2 ARG 6 26.162 32.186 30.165
41 HB3 ARG 6 HB3 ARG 6 27.301 33.011 29.110
42 HG2 ARG 6 HG2 ARG 6 24.321 33.677 29.191
43 HG3 ARG 6 HG3 ARG 6 25.521 34.410 30.246
44 HD2 ARG 6 HD2 ARG 6 25.394 35.984 28.582
45 HD3 ARG 6 HD3 ARG 6 26.791 35.055 28.074
46 HE ARG 6 HE ARG 6 25.509 34.094 26.266
47 HH11 ARG 6 HH11 ARG 6 23.344 36.170 28.172
48 HH12 ARG 6 HH12 ARG 6 22.211 36.184 26.829
49 HH21 ARG 6 HH21 ARG 6 24.121 34.444 24.665
50 HH22 ARG 6 HH22 ARG 6 22.718 35.503 24.917
51 H ARG 7 H ARG 7 26.377 29.633 29.525
52 HA ARG 7 HA ARG 7 29.077 28.959 28.667
53 HB2 ARG 7 HB2 ARG 7 27.957 28.398 30.915
54 HB3 ARG 7 HB3 ARG 7 27.125 27.089 30.042
55 HG2 ARG 7 HG2 ARG 7 29.356 26.132 29.422
56 HG3 ARG 7 HG3 ARG 7 30.136 27.447 30.305
57 HD2 ARG 7 HD2 ARG 7 30.117 25.480 31.704
58 HD3 ARG 7 HD3 ARG 7 29.027 26.690 32.404
59 HE ARG 7 HE ARG 7 27.635 24.838 30.621
60 HH11 ARG 7 HH11 ARG 7 28.787 25.015 33.977
61 HH12 ARG 7 HH12 ARG 7 27.849 23.615 34.392
62 HH21 ARG 7 HH21 ARG 7 26.379 23.273 31.307
63 HH22 ARG 7 HH22 ARG 7 26.302 22.855 33.017
64 H CYS 8 H CYS 8 25.875 27.658 27.858
65 HA CYS 8 HA CYS 8 26.576 25.616 26.068
66 HB2 CYS 8 HB2 CYS 8 24.325 25.905 26.850
67 HB3 CYS 8 HB3 CYS 8 24.244 27.539 26.209
68 H GLU 9 H GLU 9 26.097 29.119 25.325
69 HA GLU 9 HA GLU 9 26.949 29.012 22.586
70 HB2 GLU 9 HB2 GLU 9 27.121 31.226 24.664
71 HB3 GLU 9 HB3 GLU 9 27.493 31.450 22.956
72 HG2 GLU 9 HG2 GLU 9 25.230 30.944 22.308
73 HG3 GLU 9 HG3 GLU 9 24.769 30.519 23.951
74 H LEU 10 H LEU 10 28.879 29.899 25.520
75 HA LEU 10 HA LEU 10 31.280 30.399 24.106
76 HB2 LEU 10 HB2 LEU 10 30.473 29.955 26.961
77 HB3 LEU 10 HB3 LEU 10 32.145 29.653 26.626
78 HG LEU 10 HG LEU 10 31.771 31.910 27.442
79 HD11 LEU 10 HD11 LEU 10 33.168 33.065 25.874
80 HD12 LEU 10 HD12 LEU 10 33.676 31.371 25.922
81 HD13 LEU 10 HD13 LEU 10 32.717 31.968 24.551
82 HD21 LEU 10 HD21 LEU 10 30.790 33.662 26.024
83 HD22 LEU 10 HD22 LEU 10 30.267 32.446 24.838
84 HD23 LEU 10 HD23 LEU 10 29.587 32.458 26.485
85 H SER 11 H SER 11 30.160 27.310 25.488
86 HA SER 11 HA SER 11 32.581 25.857 24.862
87 HB2 SER 11 HB2 SER 11 30.842 25.187 26.549
88 HB3 SER 11 HB3 SER 11 29.768 24.777 25.210
89 HG SER 11 HG SER 11 30.844 22.936 25.811
90 H CYS 12 H CYS 12 29.704 26.691 22.925
91 HA CYS 12 HA CYS 12 30.597 24.899 20.725
92 HB2 CYS 12 HB2 CYS 12 28.259 26.827 20.791
93 HB3 CYS 12 HB3 CYS 12 28.690 25.686 19.549
94 H ARG 13 H ARG 13 30.926 28.300 21.629
95 HA ARG 13 HA ARG 13 31.643 29.344 19.080
96 HB2 ARG 13 HB2 ARG 13 31.196 30.618 21.231
97 HB3 ARG 13 HB3 ARG 13 32.833 30.202 21.751
98 HG2 ARG 13 HG2 ARG 13 33.768 31.398 19.786
99 HG3 ARG 13 HG3 ARG 13 32.136 31.652 19.150
100 HD2 ARG 13 HD2 ARG 13 32.810 33.714 20.092
101 HD3 ARG 13 HD3 ARG 13 31.608 33.028 21.195
102 HE ARG 13 HE ARG 13 34.191 32.209 22.080
103 HH11 ARG 13 HH11 ARG 13 32.434 35.228 21.795
104 HH12 ARG 13 HH12 ARG 13 33.112 35.873 23.273
105 HH21 ARG 13 HH21 ARG 13 35.213 33.195 23.831
106 HH22 ARG 13 HH22 ARG 13 34.744 34.811 24.301
107 H SER 14 H SER 14 33.474 27.289 21.279
108 HA SER 14 HA SER 14 36.042 27.321 20.107
109 HB2 SER 14 HB2 SER 14 34.528 24.828 20.983
110 HB3 SER 14 HB3 SER 14 36.282 25.085 20.996
111 HG SER 14 HG SER 14 35.071 25.252 23.006
112 H LEU 15 H LEU 15 33.043 25.922 18.867
113 HA LEU 15 HA LEU 15 34.435 24.586 16.592
114 HB2 LEU 15 HB2 LEU 15 31.625 24.107 17.625
115 HB3 LEU 15 HB3 LEU 15 32.516 23.133 16.459
116 HG LEU 15 HG LEU 15 33.159 23.440 19.423
117 HD11 LEU 15 HD11 LEU 15 31.120 22.128 18.994
118 HD12 LEU 15 HD12 LEU 15 32.016 21.087 17.864
119 HD13 LEU 15 HD13 LEU 15 32.434 21.100 19.588
120 HD21 LEU 15 HD21 LEU 15 34.757 21.593 19.105
121 HD22 LEU 15 HD22 LEU 15 34.423 21.576 17.364
122 HD23 LEU 15 HD23 LEU 15 35.222 22.977 18.108
123 H GLY 16 H GLY 16 33.226 27.478 17.149
124 HA2 GLY 16 HA2 GLY 16 32.592 29.197 15.765
125 HA3 GLY 16 HA3 GLY 16 32.804 28.102 14.395
126 H LEU 17 H LEU 17 30.461 27.861 17.090
127 HA LEU 17 HA LEU 17 28.220 27.895 15.115
128 HB2 LEU 17 HB2 LEU 17 28.177 26.589 17.819
129 HB3 LEU 17 HB3 LEU 17 27.106 26.274 16.480
130 HG LEU 17 HG LEU 17 29.994 25.479 16.734
131 HD11 LEU 17 HD11 LEU 17 27.478 23.810 16.777
132 HD12 LEU 17 HD12 LEU 17 29.125 23.161 16.634
133 HD13 LEU 17 HD13 LEU 17 28.679 24.050 18.076
134 HD21 LEU 17 HD21 LEU 17 29.724 24.208 14.625
135 HD22 LEU 17 HD22 LEU 17 28.043 24.759 14.486
136 HD23 LEU 17 HD23 LEU 17 29.392 25.907 14.312
137 H LEU 18 H LEU 18 26.111 28.483 15.951
138 HA LEU 18 HA LEU 18 26.058 30.681 17.997
139 HB2 LEU 18 HB2 LEU 18 23.991 29.879 15.907
140 HB3 LEU 18 HB3 LEU 18 23.883 31.257 17.007
141 HG LEU 18 HG LEU 18 25.969 30.894 14.823
142 HD11 LEU 18 HD11 LEU 18 23.707 31.218 13.925
143 HD12 LEU 18 HD12 LEU 18 23.516 32.678 14.918
144 HD13 LEU 18 HD13 LEU 18 24.736 32.628 13.627
145 HD21 LEU 18 HD21 LEU 18 26.486 33.266 15.200
146 HD22 LEU 18 HD22 LEU 18 25.328 33.317 16.551
147 HD23 LEU 18 HD23 LEU 18 26.800 32.333 16.668
148 H GLY 19 H GLY 19 25.663 29.823 19.985
149 HA2 GLY 19 HA2 GLY 19 23.859 27.535 20.328
150 HA3 GLY 19 HA3 GLY 19 24.781 28.336 21.571
151 H ALA 20 H ALA 20 22.011 27.417 21.296
152 HA ALA 20 HA ALA 20 20.813 29.568 22.876
153 HB1 ALA 20 HB1 ALA 20 19.878 29.737 20.530
154 HB2 ALA 20 HB2 ALA 20 19.241 28.087 20.746
155 HB3 ALA 20 HB3 ALA 20 18.670 29.401 21.782
156 H CYS 21 H CYS 21 18.824 28.538 24.013
157 HA CYS 21 HA CYS 21 19.145 25.624 24.577
158 HB2 CYS 21 HB2 CYS 21 20.407 26.569 26.354
159 HB3 CYS 21 HB3 CYS 21 19.189 27.844 26.616
160 H ILE 22 H ILE 22 17.363 24.591 24.367
161 HA ILE 22 HA ILE 22 14.796 26.048 24.071
162 HB ILE 22 HB ILE 22 15.571 23.219 23.265
163 HG12 ILE 22 HG12 ILE 22 15.400 25.718 21.519
164 HG13 ILE 22 HG13 ILE 22 16.902 24.945 22.032
165 HG21 ILE 22 HG21 ILE 22 13.103 23.611 23.620
166 HG22 ILE 22 HG22 ILE 22 13.174 24.925 22.433
167 HG23 ILE 22 HG23 ILE 22 13.499 23.246 21.951
168 HD11 ILE 22 HD11 ILE 22 16.225 22.854 20.847
169 HD12 ILE 22 HD12 ILE 22 14.830 23.736 20.174
170 HD13 ILE 22 HD13 ILE 22 16.476 24.258 19.795
171 H GLY 23 H GLY 23 14.120 26.336 26.169
172 HA2 GLY 23 HA2 GLY 23 12.823 25.836 28.008
173 HA3 GLY 23 HA3 GLY 23 12.722 24.165 27.450
174 H GLU 24 H GLU 24 15.001 23.064 27.644
175 HA GLU 24 HA GLU 24 16.678 23.926 29.906
176 HB2 GLU 24 HB2 GLU 24 16.578 21.857 31.123
177 HB3 GLU 24 HB3 GLU 24 14.951 22.515 30.979
178 HG2 GLU 24 HG2 GLU 24 14.531 20.914 29.068
179 HG3 GLU 24 HG3 GLU 24 16.121 20.207 29.366
180 H GLU 25 H GLU 25 16.438 22.494 26.791
181 HA GLU 25 HA GLU 25 18.999 21.001 27.068
182 HB2 GLU 25 HB2 GLU 25 16.923 20.915 24.864
183 HB3 GLU 25 HB3 GLU 25 18.316 19.852 25.038
184 HG2 GLU 25 HG2 GLU 25 15.978 19.949 26.999
185 HG3 GLU 25 HG3 GLU 25 16.087 18.872 25.621
186 H CYS 26 H CYS 26 20.813 21.941 26.400
187 HA CYS 26 HA CYS 26 20.964 24.336 24.822
188 HB2 CYS 26 HB2 CYS 26 22.644 23.817 26.422
189 HB3 CYS 26 HB3 CYS 26 22.946 22.233 25.705
190 H LYS 27 H LYS 27 21.429 24.710 22.714
191 HA LYS 27 HA LYS 27 21.990 22.543 20.783
192 HB2 LYS 27 HB2 LYS 27 19.562 22.604 20.743
193 HB3 LYS 27 HB3 LYS 27 19.558 24.367 20.653
194 HG2 LYS 27 HG2 LYS 27 18.986 23.561 18.484
195 HG3 LYS 27 HG3 LYS 27 20.622 24.189 18.369
196 HD2 LYS 27 HD2 LYS 27 20.766 22.183 17.202
197 HD3 LYS 27 HD3 LYS 27 21.385 21.730 18.794
198 HE2 LYS 27 HE2 LYS 27 19.033 20.933 19.379
199 HE3 LYS 27 HE3 LYS 27 18.582 21.268 17.690
200 HZ1 LYS 27 HZ1 LYS 27 20.380 19.733 17.030
201 HZ2 LYS 27 HZ2 LYS 27 20.660 19.355 18.591
202 HZ3 LYS 27 HZ3 LYS 27 19.215 18.967 17.883
203 H CYS 28 H CYS 28 23.543 23.213 19.494
204 HA CYS 28 HA CYS 28 23.679 26.088 18.738
205 HB2 CYS 28 HB2 CYS 28 26.126 26.040 18.842
206 HB3 CYS 28 HB3 CYS 28 25.328 25.856 20.404
207 H VAL 29 H VAL 29 24.528 26.609 16.708
208 HA VAL 29 HA VAL 29 24.406 24.413 14.714
209 HB VAL 29 HB VAL 29 22.815 25.543 13.363
210 HG11 VAL 29 HG11 VAL 29 21.905 24.118 15.219
211 HG12 VAL 29 HG12 VAL 29 21.677 25.590 16.185
212 HG13 VAL 29 HG13 VAL 29 20.796 25.381 14.665
213 HG21 VAL 29 HG21 VAL 29 23.344 27.900 13.782
214 HG22 VAL 29 HG22 VAL 29 21.635 27.577 14.043
215 HG23 VAL 29 HG23 VAL 29 22.712 27.754 15.442
216 HA PRO 30 HA PRO 30 27.749 26.427 12.734
217 HB2 PRO 30 HB2 PRO 30 26.406 25.829 10.099
218 HB3 PRO 30 HB3 PRO 30 28.089 25.488 10.609
219 HG2 PRO 30 HG2 PRO 30 26.299 23.491 10.594
220 HG3 PRO 30 HG3 PRO 30 27.405 23.677 11.994
221 HD2 PRO 30 HD2 PRO 30 24.528 24.613 11.748
222 HD3 PRO 30 HD3 PRO 30 25.317 23.691 13.063
223 H TYR 31 H TYR 31 28.493 28.261 11.606
224 HA TYR 31 HA TYR 31 26.782 30.607 11.386
225 HB2 TYR 31 HB2 TYR 31 29.588 30.018 10.385
226 HB3 TYR 31 HB3 TYR 31 28.792 31.572 10.210
227 HD1 TYR 31 HD1 TYR 31 27.746 30.593 13.407
228 HD2 TYR 31 HD2 TYR 31 31.269 31.839 11.243
229 HE1 TYR 31 HE1 TYR 31 28.791 31.326 15.524
230 HE2 TYR 31 HE2 TYR 31 32.330 32.533 13.379
231 HH TYR 31 HH TYR 31 30.624 32.317 16.512
Start of MODEL 18
1 H1 ALA 1 H1 ALA 1 16.968 21.944 36.519
2 H2 ALA 1 H2 ALA 1 17.410 20.363 36.502
3 H3 ALA 1 H3 ALA 1 16.653 21.019 35.199
4 HA ALA 1 HA ALA 1 19.295 21.823 36.203
5 HB1 ALA 1 HB1 ALA 1 18.619 20.072 33.797
6 HB2 ALA 1 HB2 ALA 1 20.235 20.677 34.230
7 HB3 ALA 1 HB3 ALA 1 19.398 19.545 35.308
8 H PHE 2 H PHE 2 19.087 24.004 35.990
9 HA PHE 2 HA PHE 2 17.581 25.423 34.147
10 HB2 PHE 2 HB2 PHE 2 20.219 26.405 35.278
11 HB3 PHE 2 HB3 PHE 2 18.824 27.361 34.797
12 HD1 PHE 2 HD1 PHE 2 20.551 26.268 37.590
13 HD2 PHE 2 HD2 PHE 2 16.518 26.513 36.066
14 HE1 PHE 2 HE1 PHE 2 19.665 26.194 39.907
15 HE2 PHE 2 HE2 PHE 2 15.648 26.418 38.388
16 HZ PHE 2 HZ PHE 2 17.213 26.276 40.310
17 H CYS 3 H CYS 3 17.843 26.391 32.167
18 HA CYS 3 HA CYS 3 19.612 25.192 30.267
19 HB2 CYS 3 HB2 CYS 3 17.302 26.221 29.917
20 HB3 CYS 3 HB3 CYS 3 18.082 27.799 29.928
21 H ASN 4 H ASN 4 21.801 25.491 30.333
22 HA ASN 4 HA ASN 4 22.944 28.003 31.350
23 HB2 ASN 4 HB2 ASN 4 24.341 25.463 30.439
24 HB3 ASN 4 HB3 ASN 4 25.063 26.873 31.197
25 HD21 ASN 4 HD21 ASN 4 23.481 26.173 34.432
26 HD22 ASN 4 HD22 ASN 4 23.898 27.520 33.397
27 H LEU 5 H LEU 5 21.918 29.151 29.532
28 HA LEU 5 HA LEU 5 22.549 28.750 26.828
29 HB2 LEU 5 HB2 LEU 5 20.646 30.058 27.608
30 HB3 LEU 5 HB3 LEU 5 21.720 31.274 28.301
31 HG LEU 5 HG LEU 5 22.503 31.924 26.066
32 HD11 LEU 5 HD11 LEU 5 22.271 29.848 24.790
33 HD12 LEU 5 HD12 LEU 5 20.508 29.852 25.040
34 HD13 LEU 5 HD13 LEU 5 21.284 31.100 24.040
35 HD21 LEU 5 HD21 LEU 5 19.463 31.836 26.224
36 HD22 LEU 5 HD22 LEU 5 20.507 33.011 27.063
37 HD23 LEU 5 HD23 LEU 5 20.448 32.983 25.296
38 H ARG 6 H ARG 6 24.391 30.787 29.179
39 HA ARG 6 HA ARG 6 26.206 31.760 27.070
40 HB2 ARG 6 HB2 ARG 6 26.595 31.765 30.082
41 HB3 ARG 6 HB3 ARG 6 27.593 32.604 28.886
42 HG2 ARG 6 HG2 ARG 6 25.524 33.910 28.189
43 HG3 ARG 6 HG3 ARG 6 24.694 33.189 29.574
44 HD2 ARG 6 HD2 ARG 6 27.085 35.058 29.563
45 HD3 ARG 6 HD3 ARG 6 25.494 35.366 30.250
46 HE ARG 6 HE ARG 6 27.700 33.747 31.388
47 HH11 ARG 6 HH11 ARG 6 24.281 34.508 31.833
48 HH12 ARG 6 HH12 ARG 6 24.399 34.260 33.555
49 HH21 ARG 6 HH21 ARG 6 27.708 33.363 33.543
50 HH22 ARG 6 HH22 ARG 6 26.217 33.492 34.459
51 H ARG 7 H ARG 7 26.379 29.126 29.564
52 HA ARG 7 HA ARG 7 29.099 28.474 28.853
53 HB2 ARG 7 HB2 ARG 7 27.705 27.724 30.944
54 HB3 ARG 7 HB3 ARG 7 27.124 26.431 29.901
55 HG2 ARG 7 HG2 ARG 7 28.952 25.504 31.036
56 HG3 ARG 7 HG3 ARG 7 29.616 25.851 29.449
57 HD2 ARG 7 HD2 ARG 7 29.862 27.851 31.729
58 HD3 ARG 7 HD3 ARG 7 30.899 26.437 31.688
59 HE ARG 7 HE ARG 7 31.568 27.238 29.333
60 HH11 ARG 7 HH11 ARG 7 30.828 29.625 31.846
61 HH12 ARG 7 HH12 ARG 7 32.341 30.445 31.573
62 HH21 ARG 7 HH21 ARG 7 33.312 28.483 28.931
63 HH22 ARG 7 HH22 ARG 7 33.610 29.918 29.910
64 H CYS 8 H CYS 8 26.005 27.280 27.663
65 HA CYS 8 HA CYS 8 26.882 25.478 25.649
66 HB2 CYS 8 HB2 CYS 8 24.583 25.719 26.397
67 HB3 CYS 8 HB3 CYS 8 24.552 27.395 25.880
68 H GLU 9 H GLU 9 26.109 29.029 25.218
69 HA GLU 9 HA GLU 9 27.009 29.215 22.540
70 HB2 GLU 9 HB2 GLU 9 26.786 31.201 24.826
71 HB3 GLU 9 HB3 GLU 9 27.520 31.691 23.311
72 HG2 GLU 9 HG2 GLU 9 24.960 30.296 22.855
73 HG3 GLU 9 HG3 GLU 9 24.784 31.690 23.915
74 H LEU 10 H LEU 10 28.921 29.682 25.539
75 HA LEU 10 HA LEU 10 31.403 30.305 24.276
76 HB2 LEU 10 HB2 LEU 10 30.479 29.386 27.001
77 HB3 LEU 10 HB3 LEU 10 32.161 29.166 26.626
78 HG LEU 10 HG LEU 10 31.730 31.223 27.875
79 HD11 LEU 10 HD11 LEU 10 33.167 32.655 26.520
80 HD12 LEU 10 HD12 LEU 10 33.733 30.977 26.495
81 HD13 LEU 10 HD13 LEU 10 32.871 31.649 25.095
82 HD21 LEU 10 HD21 LEU 10 30.863 33.236 26.763
83 HD22 LEU 10 HD22 LEU 10 30.359 32.264 25.367
84 HD23 LEU 10 HD23 LEU 10 29.614 32.018 26.966
85 H SER 11 H SER 11 30.185 27.123 25.473
86 HA SER 11 HA SER 11 32.453 25.599 24.642
87 HB2 SER 11 HB2 SER 11 30.729 24.879 26.274
88 HB3 SER 11 HB3 SER 11 29.560 24.702 24.954
89 HG SER 11 HG SER 11 30.691 22.987 24.172
90 H CYS 12 H CYS 12 29.922 26.968 22.755
91 HA CYS 12 HA CYS 12 30.598 25.316 20.378
92 HB2 CYS 12 HB2 CYS 12 28.303 27.229 20.889
93 HB3 CYS 12 HB3 CYS 12 28.541 26.244 19.491
94 H ARG 13 H ARG 13 31.054 28.605 21.614
95 HA ARG 13 HA ARG 13 31.626 29.927 19.153
96 HB2 ARG 13 HB2 ARG 13 31.254 30.936 21.468
97 HB3 ARG 13 HB3 ARG 13 32.906 30.465 21.874
98 HG2 ARG 13 HG2 ARG 13 33.757 31.938 20.068
99 HG3 ARG 13 HG3 ARG 13 32.100 32.273 19.549
100 HD2 ARG 13 HD2 ARG 13 32.824 34.162 20.823
101 HD3 ARG 13 HD3 ARG 13 31.637 33.292 21.810
102 HE ARG 13 HE ARG 13 34.400 32.480 22.308
103 HH11 ARG 13 HH11 ARG 13 32.008 34.885 23.408
104 HH12 ARG 13 HH12 ARG 13 33.033 35.298 24.763
105 HH21 ARG 13 HH21 ARG 13 35.555 33.149 23.969
106 HH22 ARG 13 HH22 ARG 13 34.804 34.094 25.257
107 H SER 14 H SER 14 33.663 27.894 21.237
108 HA SER 14 HA SER 14 36.103 28.138 19.712
109 HB2 SER 14 HB2 SER 14 36.715 26.111 21.082
110 HB3 SER 14 HB3 SER 14 36.221 27.539 22.003
111 HG SER 14 HG SER 14 35.174 25.715 22.804
112 H LEU 15 H LEU 15 33.188 26.431 19.076
113 HA LEU 15 HA LEU 15 34.506 24.580 17.127
114 HB2 LEU 15 HB2 LEU 15 31.684 24.608 18.237
115 HB3 LEU 15 HB3 LEU 15 32.350 23.388 17.164
116 HG LEU 15 HG LEU 15 33.230 23.966 20.028
117 HD11 LEU 15 HD11 LEU 15 32.152 21.814 20.541
118 HD12 LEU 15 HD12 LEU 15 30.979 22.951 19.851
119 HD13 LEU 15 HD13 LEU 15 31.638 21.641 18.852
120 HD21 LEU 15 HD21 LEU 15 35.082 23.038 18.665
121 HD22 LEU 15 HD22 LEU 15 34.508 21.885 19.867
122 HD23 LEU 15 HD23 LEU 15 34.041 21.685 18.160
123 H GLY 16 H GLY 16 32.950 27.581 17.203
124 HA2 GLY 16 HA2 GLY 16 32.442 29.016 15.445
125 HA3 GLY 16 HA3 GLY 16 32.647 27.704 14.286
126 H LEU 17 H LEU 17 30.448 27.601 17.108
127 HA LEU 17 HA LEU 17 28.104 27.626 15.259
128 HB2 LEU 17 HB2 LEU 17 27.736 25.987 17.658
129 HB3 LEU 17 HB3 LEU 17 27.268 25.657 16.038
130 HG LEU 17 HG LEU 17 30.009 25.256 17.112
131 HD11 LEU 17 HD11 LEU 17 27.744 23.287 16.860
132 HD12 LEU 17 HD12 LEU 17 29.443 22.795 17.010
133 HD13 LEU 17 HD13 LEU 17 28.707 23.731 18.297
134 HD21 LEU 17 HD21 LEU 17 30.374 23.819 15.111
135 HD22 LEU 17 HD22 LEU 17 28.690 24.059 14.610
136 HD23 LEU 17 HD23 LEU 17 29.842 25.400 14.549
137 H LEU 18 H LEU 18 26.272 28.648 15.913
138 HA LEU 18 HA LEU 18 26.412 30.351 18.331
139 HB2 LEU 18 HB2 LEU 18 24.495 31.492 17.511
140 HB3 LEU 18 HB3 LEU 18 25.782 31.547 16.323
141 HG LEU 18 HG LEU 18 23.623 29.458 15.994
142 HD11 LEU 18 HD11 LEU 18 22.217 31.109 14.797
143 HD12 LEU 18 HD12 LEU 18 22.361 31.505 16.528
144 HD13 LEU 18 HD13 LEU 18 23.300 32.404 15.323
145 HD21 LEU 18 HD21 LEU 18 24.978 31.291 13.973
146 HD22 LEU 18 HD22 LEU 18 25.558 29.656 14.362
147 HD23 LEU 18 HD23 LEU 18 23.967 29.876 13.630
148 H GLY 19 H GLY 19 25.105 30.088 20.082
149 HA2 GLY 19 HA2 GLY 19 23.510 27.585 20.252
150 HA3 GLY 19 HA3 GLY 19 24.160 28.473 21.604
151 H ALA 20 H ALA 20 21.482 27.462 21.183
152 HA ALA 20 HA ALA 20 19.961 29.849 21.939
153 HB1 ALA 20 HB1 ALA 20 19.547 29.702 19.513
154 HB2 ALA 20 HB2 ALA 20 19.116 27.985 19.672
155 HB3 ALA 20 HB3 ALA 20 18.094 29.227 20.414
156 H CYS 21 H CYS 21 18.371 29.355 23.408
157 HA CYS 21 HA CYS 21 18.505 26.705 24.684
158 HB2 CYS 21 HB2 CYS 21 18.477 28.751 26.020
159 HB3 CYS 21 HB3 CYS 21 16.817 29.068 25.468
160 H ILE 22 H ILE 22 17.237 25.016 24.238
161 HA ILE 22 HA ILE 22 14.664 25.439 22.762
162 HB ILE 22 HB ILE 22 16.666 23.160 22.557
163 HG12 ILE 22 HG12 ILE 22 17.497 25.117 21.361
164 HG13 ILE 22 HG13 ILE 22 17.035 23.839 20.261
165 HG21 ILE 22 HG21 ILE 22 14.438 22.254 22.312
166 HG22 ILE 22 HG22 ILE 22 13.968 23.547 21.193
167 HG23 ILE 22 HG23 ILE 22 15.179 22.338 20.716
168 HD11 ILE 22 HD11 ILE 22 14.962 25.043 19.661
169 HD12 ILE 22 HD12 ILE 22 15.376 26.335 20.808
170 HD13 ILE 22 HD13 ILE 22 16.398 26.044 19.395
171 H GLY 23 H GLY 23 13.081 25.231 24.151
172 HA2 GLY 23 HA2 GLY 23 11.738 24.484 25.854
173 HA3 GLY 23 HA3 GLY 23 12.553 22.911 25.756
174 H GLU 24 H GLU 24 14.081 22.421 27.198
175 HA GLU 24 HA GLU 24 14.576 24.273 29.509
176 HB2 GLU 24 HB2 GLU 24 14.761 22.337 30.843
177 HB3 GLU 24 HB3 GLU 24 13.386 22.017 29.783
178 HG2 GLU 24 HG2 GLU 24 15.064 20.768 28.274
179 HG3 GLU 24 HG3 GLU 24 16.242 20.930 29.571
180 H GLU 25 H GLU 25 16.315 23.095 26.789
181 HA GLU 25 HA GLU 25 18.927 23.375 28.194
182 HB2 GLU 25 HB2 GLU 25 18.192 21.000 28.337
183 HB3 GLU 25 HB3 GLU 25 18.076 20.964 26.575
184 HG2 GLU 25 HG2 GLU 25 20.668 21.723 26.780
185 HG3 GLU 25 HG3 GLU 25 20.507 20.988 28.362
186 H CYS 26 H CYS 26 20.531 24.253 26.988
187 HA CYS 26 HA CYS 26 19.837 25.311 24.380
188 HB2 CYS 26 HB2 CYS 26 20.946 26.688 25.988
189 HB3 CYS 26 HB3 CYS 26 22.288 25.559 26.125
190 H LYS 27 H LYS 27 20.501 24.943 22.489
191 HA LYS 27 HA LYS 27 22.401 22.717 21.826
192 HB2 LYS 27 HB2 LYS 27 20.027 22.101 21.442
193 HB3 LYS 27 HB3 LYS 27 19.790 23.554 20.474
194 HG2 LYS 27 HG2 LYS 27 21.423 22.690 18.783
195 HG3 LYS 27 HG3 LYS 27 21.687 21.273 19.809
196 HD2 LYS 27 HD2 LYS 27 20.179 20.634 18.070
197 HD3 LYS 27 HD3 LYS 27 19.305 20.673 19.603
198 HE2 LYS 27 HE2 LYS 27 17.908 21.550 17.823
199 HE3 LYS 27 HE3 LYS 27 18.269 22.820 18.989
200 HZ1 LYS 27 HZ1 LYS 27 19.880 23.739 17.483
201 HZ2 LYS 27 HZ2 LYS 27 19.669 22.501 16.378
202 HZ3 LYS 27 HZ3 LYS 27 18.481 23.569 16.680
203 H CYS 28 H CYS 28 23.746 23.156 19.985
204 HA CYS 28 HA CYS 28 23.597 25.924 18.902
205 HB2 CYS 28 HB2 CYS 28 26.016 26.134 18.995
206 HB3 CYS 28 HB3 CYS 28 25.293 25.948 20.592
207 H VAL 29 H VAL 29 24.537 26.341 16.920
208 HA VAL 29 HA VAL 29 24.622 24.104 14.964
209 HB VAL 29 HB VAL 29 23.008 25.247 13.542
210 HG11 VAL 29 HG11 VAL 29 21.817 24.693 16.289
211 HG12 VAL 29 HG12 VAL 29 20.983 24.627 14.723
212 HG13 VAL 29 HG13 VAL 29 22.262 23.454 15.090
213 HG21 VAL 29 HG21 VAL 29 22.520 27.128 15.908
214 HG22 VAL 29 HG22 VAL 29 23.170 27.577 14.323
215 HG23 VAL 29 HG23 VAL 29 21.508 27.010 14.453
216 HA PRO 30 HA PRO 30 27.927 26.503 13.436
217 HB2 PRO 30 HB2 PRO 30 28.136 25.773 10.786
218 HB3 PRO 30 HB3 PRO 30 28.578 24.720 12.163
219 HG2 PRO 30 HG2 PRO 30 25.998 24.756 10.597
220 HG3 PRO 30 HG3 PRO 30 26.980 23.335 11.080
221 HD2 PRO 30 HD2 PRO 30 24.769 24.112 12.474
222 HD3 PRO 30 HD3 PRO 30 26.201 23.466 13.314
223 H TYR 31 H TYR 31 28.461 28.432 12.474
224 HA TYR 31 HA TYR 31 26.517 30.376 12.018
225 HB2 TYR 31 HB2 TYR 31 29.346 30.309 10.924
226 HB3 TYR 31 HB3 TYR 31 28.359 31.748 11.118
227 HD1 TYR 31 HD1 TYR 31 27.285 31.267 13.947
228 HD2 TYR 31 HD2 TYR 31 31.216 30.866 12.240
229 HE1 TYR 31 HE1 TYR 31 28.300 31.692 16.185
230 HE2 TYR 31 HE2 TYR 31 32.222 31.362 14.448
231 HH TYR 31 HH TYR 31 31.856 31.706 16.662
Start of MODEL 19
1 H1 ALA 1 H1 ALA 1 14.299 25.625 36.424
2 H2 ALA 1 H2 ALA 1 14.189 24.168 37.169
3 H3 ALA 1 H3 ALA 1 14.591 24.233 35.575
4 HA ALA 1 HA ALA 1 16.192 25.328 37.786
5 HB1 ALA 1 HB1 ALA 1 16.660 22.808 36.134
6 HB2 ALA 1 HB2 ALA 1 17.783 23.492 37.329
7 HB3 ALA 1 HB3 ALA 1 16.203 22.870 37.855
8 H PHE 2 H PHE 2 18.089 26.457 37.169
9 HA PHE 2 HA PHE 2 17.750 27.859 34.699
10 HB2 PHE 2 HB2 PHE 2 20.142 27.895 36.557
11 HB3 PHE 2 HB3 PHE 2 19.742 29.101 35.344
12 HD1 PHE 2 HD1 PHE 2 19.720 28.516 38.760
13 HD2 PHE 2 HD2 PHE 2 17.169 30.059 35.634
14 HE1 PHE 2 HE1 PHE 2 18.480 29.866 40.434
15 HE2 PHE 2 HE2 PHE 2 15.931 31.400 37.317
16 HZ PHE 2 HZ PHE 2 16.589 31.308 39.714
17 H CYS 3 H CYS 3 18.237 27.210 32.712
18 HA CYS 3 HA CYS 3 20.417 25.408 32.034
19 HB2 CYS 3 HB2 CYS 3 18.335 25.613 30.705
20 HB3 CYS 3 HB3 CYS 3 18.744 27.286 30.314
21 H ASN 4 H ASN 4 22.508 25.915 31.470
22 HA ASN 4 HA ASN 4 23.501 28.654 31.944
23 HB2 ASN 4 HB2 ASN 4 24.914 26.054 31.248
24 HB3 ASN 4 HB3 ASN 4 25.689 27.623 31.498
25 HD21 ASN 4 HD21 ASN 4 24.167 27.017 35.088
26 HD22 ASN 4 HD22 ASN 4 23.492 28.007 33.841
27 H LEU 5 H LEU 5 22.216 29.546 30.184
28 HA LEU 5 HA LEU 5 22.552 28.919 27.463
29 HB2 LEU 5 HB2 LEU 5 20.729 30.291 28.329
30 HB3 LEU 5 HB3 LEU 5 21.853 31.561 28.781
31 HG LEU 5 HG LEU 5 22.400 32.001 26.426
32 HD11 LEU 5 HD11 LEU 5 20.320 29.849 25.802
33 HD12 LEU 5 HD12 LEU 5 21.050 30.976 24.625
34 HD13 LEU 5 HD13 LEU 5 22.060 29.776 25.418
35 HD21 LEU 5 HD21 LEU 5 19.391 31.908 26.954
36 HD22 LEU 5 HD22 LEU 5 20.504 33.193 27.443
37 HD23 LEU 5 HD23 LEU 5 20.219 32.914 25.729
38 H ARG 6 H ARG 6 24.603 31.247 29.407
39 HA ARG 6 HA ARG 6 26.152 31.980 27.086
40 HB2 ARG 6 HB2 ARG 6 27.309 33.313 28.443
41 HB3 ARG 6 HB3 ARG 6 25.858 33.120 29.425
42 HG2 ARG 6 HG2 ARG 6 27.098 31.325 30.731
43 HG3 ARG 6 HG3 ARG 6 28.565 31.779 29.832
44 HD2 ARG 6 HD2 ARG 6 26.887 33.545 31.639
45 HD3 ARG 6 HD3 ARG 6 28.504 32.883 31.978
46 HE ARG 6 HE ARG 6 28.450 34.496 29.575
47 HH11 ARG 6 HH11 ARG 6 28.636 34.766 33.054
48 HH12 ARG 6 HH12 ARG 6 29.467 36.311 33.004
49 HH21 ARG 6 HH21 ARG 6 29.476 36.380 29.531
50 HH22 ARG 6 HH22 ARG 6 30.069 37.157 30.995
51 H ARG 7 H ARG 7 26.644 29.487 29.573
52 HA ARG 7 HA ARG 7 29.169 28.560 28.546
53 HB2 ARG 7 HB2 ARG 7 28.055 27.968 30.824
54 HB3 ARG 7 HB3 ARG 7 27.121 26.784 29.914
55 HG2 ARG 7 HG2 ARG 7 28.837 25.479 30.681
56 HG3 ARG 7 HG3 ARG 7 29.468 25.896 29.098
57 HD2 ARG 7 HD2 ARG 7 30.167 27.237 31.755
58 HD3 ARG 7 HD3 ARG 7 31.162 26.040 30.942
59 HE ARG 7 HE ARG 7 30.984 28.868 30.393
60 HH11 ARG 7 HH11 ARG 7 31.922 25.811 28.855
61 HH12 ARG 7 HH12 ARG 7 32.795 26.678 27.601
62 HH21 ARG 7 HH21 ARG 7 32.415 29.749 28.866
63 HH22 ARG 7 HH22 ARG 7 33.045 28.686 27.602
64 H CYS 8 H CYS 8 25.853 27.553 27.817
65 HA CYS 8 HA CYS 8 26.331 25.647 25.782
66 HB2 CYS 8 HB2 CYS 8 24.139 26.023 26.686
67 HB3 CYS 8 HB3 CYS 8 24.171 27.713 26.245
68 H GLU 9 H GLU 9 25.853 29.207 25.297
69 HA GLU 9 HA GLU 9 26.486 29.276 22.537
70 HB2 GLU 9 HB2 GLU 9 26.660 31.262 24.845
71 HB3 GLU 9 HB3 GLU 9 27.266 31.734 23.275
72 HG2 GLU 9 HG2 GLU 9 24.509 30.579 23.282
73 HG3 GLU 9 HG3 GLU 9 24.714 32.113 24.120
74 H LEU 10 H LEU 10 28.724 29.903 25.305
75 HA LEU 10 HA LEU 10 30.974 30.433 23.589
76 HB2 LEU 10 HB2 LEU 10 30.552 30.045 26.568
77 HB3 LEU 10 HB3 LEU 10 32.172 30.078 25.923
78 HG LEU 10 HG LEU 10 31.532 32.228 26.835
79 HD11 LEU 10 HD11 LEU 10 31.880 32.411 23.825
80 HD12 LEU 10 HD12 LEU 10 32.389 33.581 25.054
81 HD13 LEU 10 HD13 LEU 10 33.184 32.004 24.972
82 HD21 LEU 10 HD21 LEU 10 30.047 33.761 25.594
83 HD22 LEU 10 HD22 LEU 10 29.495 32.425 24.568
84 HD23 LEU 10 HD23 LEU 10 29.163 32.428 26.321
85 H SER 11 H SER 11 29.892 27.439 25.212
86 HA SER 11 HA SER 11 32.282 25.929 24.624
87 HB2 SER 11 HB2 SER 11 30.665 25.283 26.349
88 HB3 SER 11 HB3 SER 11 29.418 25.049 25.107
89 HG SER 11 HG SER 11 31.883 23.616 25.346
90 H CYS 12 H CYS 12 29.438 26.772 22.706
91 HA CYS 12 HA CYS 12 30.271 25.056 20.452
92 HB2 CYS 12 HB2 CYS 12 28.011 27.056 20.763
93 HB3 CYS 12 HB3 CYS 12 28.256 25.991 19.392
94 H ARG 13 H ARG 13 30.463 28.531 21.375
95 HA ARG 13 HA ARG 13 31.369 29.579 18.909
96 HB2 ARG 13 HB2 ARG 13 30.848 30.939 20.966
97 HB3 ARG 13 HB3 ARG 13 32.362 30.378 21.686
98 HG2 ARG 13 HG2 ARG 13 33.626 31.414 19.760
99 HG3 ARG 13 HG3 ARG 13 32.095 31.964 19.089
100 HD2 ARG 13 HD2 ARG 13 32.957 33.830 20.194
101 HD3 ARG 13 HD3 ARG 13 31.739 33.199 21.317
102 HE ARG 13 HE ARG 13 34.165 31.975 22.064
103 HH11 ARG 13 HH11 ARG 13 32.971 35.312 21.976
104 HH12 ARG 13 HH12 ARG 13 34.076 35.739 23.290
105 HH21 ARG 13 HH21 ARG 13 35.457 32.686 23.667
106 HH22 ARG 13 HH22 ARG 13 35.384 34.380 24.156
107 H SER 14 H SER 14 33.210 27.947 21.480
108 HA SER 14 HA SER 14 35.781 28.242 20.384
109 HB2 SER 14 HB2 SER 14 35.322 27.417 22.661
110 HB3 SER 14 HB3 SER 14 34.666 25.904 21.988
111 HG SER 14 HG SER 14 36.851 25.669 22.583
112 H LEU 15 H LEU 15 33.236 26.052 19.381
113 HA LEU 15 HA LEU 15 34.938 24.464 17.579
114 HB2 LEU 15 HB2 LEU 15 31.909 24.556 17.869
115 HB3 LEU 15 HB3 LEU 15 32.844 23.317 17.071
116 HG LEU 15 HG LEU 15 32.831 23.911 20.063
117 HD11 LEU 15 HD11 LEU 15 31.683 21.598 18.466
118 HD12 LEU 15 HD12 LEU 15 31.683 21.742 20.235
119 HD13 LEU 15 HD13 LEU 15 30.754 22.889 19.255
120 HD21 LEU 15 HD21 LEU 15 34.239 21.674 18.549
121 HD22 LEU 15 HD22 LEU 15 35.037 23.044 19.356
122 HD23 LEU 15 HD23 LEU 15 34.152 21.863 20.311
123 H GLY 16 H GLY 16 32.554 27.078 17.371
124 HA2 GLY 16 HA2 GLY 16 32.720 28.649 15.426
125 HA3 GLY 16 HA3 GLY 16 32.919 27.248 14.382
126 H LEU 17 H LEU 17 30.550 27.334 17.065
127 HA LEU 17 HA LEU 17 28.342 27.733 15.132
128 HB2 LEU 17 HB2 LEU 17 27.378 25.860 17.004
129 HB3 LEU 17 HB3 LEU 17 27.549 25.687 15.278
130 HG LEU 17 HG LEU 17 29.694 24.861 17.221
131 HD11 LEU 17 HD11 LEU 17 28.861 22.575 16.862
132 HD12 LEU 17 HD12 LEU 17 27.611 23.595 17.565
133 HD13 LEU 17 HD13 LEU 17 27.548 23.201 15.840
134 HD21 LEU 17 HD21 LEU 17 29.212 24.159 14.271
135 HD22 LEU 17 HD22 LEU 17 30.609 25.043 14.897
136 HD23 LEU 17 HD23 LEU 17 30.403 23.357 15.312
137 H LEU 18 H LEU 18 26.510 28.729 15.910
138 HA LEU 18 HA LEU 18 26.796 30.246 18.447
139 HB2 LEU 18 HB2 LEU 18 24.848 31.474 17.703
140 HB3 LEU 18 HB3 LEU 18 26.160 31.588 16.544
141 HG LEU 18 HG LEU 18 24.095 29.477 16.008
142 HD11 LEU 18 HD11 LEU 18 22.508 31.101 15.059
143 HD12 LEU 18 HD12 LEU 18 22.664 31.297 16.809
144 HD13 LEU 18 HD13 LEU 18 23.480 32.440 15.716
145 HD21 LEU 18 HD21 LEU 18 25.944 29.979 14.415
146 HD22 LEU 18 HD22 LEU 18 24.340 30.234 13.731
147 HD23 LEU 18 HD23 LEU 18 25.313 31.636 14.242
148 H GLY 19 H GLY 19 25.241 30.122 20.163
149 HA2 GLY 19 HA2 GLY 19 23.599 27.597 20.133
150 HA3 GLY 19 HA3 GLY 19 24.523 28.137 21.516
151 H ALA 20 H ALA 20 21.746 27.386 21.354
152 HA ALA 20 HA ALA 20 20.667 29.625 22.876
153 HB1 ALA 20 HB1 ALA 20 19.752 29.993 20.621
154 HB2 ALA 20 HB2 ALA 20 19.180 28.313 20.557
155 HB3 ALA 20 HB3 ALA 20 18.475 29.449 21.725
156 H CYS 21 H CYS 21 18.797 28.823 24.178
157 HA CYS 21 HA CYS 21 18.925 25.888 24.690
158 HB2 CYS 21 HB2 CYS 21 20.291 26.989 26.344
159 HB3 CYS 21 HB3 CYS 21 18.908 27.974 26.873
160 H ILE 22 H ILE 22 17.149 24.937 24.316
161 HA ILE 22 HA ILE 22 14.603 26.352 24.002
162 HB ILE 22 HB ILE 22 15.221 23.414 23.579
163 HG12 ILE 22 HG12 ILE 22 16.786 24.575 22.171
164 HG13 ILE 22 HG13 ILE 22 15.510 23.896 21.190
165 HG21 ILE 22 HG21 ILE 22 13.001 25.199 22.491
166 HG22 ILE 22 HG22 ILE 22 13.283 23.504 22.031
167 HG23 ILE 22 HG23 ILE 22 12.818 23.910 23.686
168 HD11 ILE 22 HD11 ILE 22 14.464 26.131 20.940
169 HD12 ILE 22 HD12 ILE 22 15.734 26.840 21.968
170 HD13 ILE 22 HD13 ILE 22 16.150 26.126 20.403
171 H GLY 23 H GLY 23 14.501 26.949 26.229
172 HA2 GLY 23 HA2 GLY 23 13.567 26.837 28.344
173 HA3 GLY 23 HA3 GLY 23 12.963 25.222 27.998
174 H GLU 24 H GLU 24 14.484 23.466 28.066
175 HA GLU 24 HA GLU 24 16.489 23.764 30.256
176 HB2 GLU 24 HB2 GLU 24 15.852 21.637 30.994
177 HB3 GLU 24 HB3 GLU 24 14.343 22.455 30.600
178 HG2 GLU 24 HG2 GLU 24 14.438 21.266 28.317
179 HG3 GLU 24 HG3 GLU 24 15.776 20.320 28.950
180 H GLU 25 H GLU 25 16.426 22.980 26.879
181 HA GLU 25 HA GLU 25 18.996 21.471 27.164
182 HB2 GLU 25 HB2 GLU 25 18.478 20.143 25.276
183 HB3 GLU 25 HB3 GLU 25 17.263 19.964 26.537
184 HG2 GLU 25 HG2 GLU 25 15.671 21.328 25.252
185 HG3 GLU 25 HG3 GLU 25 16.895 21.647 24.020
186 H CYS 26 H CYS 26 20.733 22.222 26.254
187 HA CYS 26 HA CYS 26 20.740 24.599 24.567
188 HB2 CYS 26 HB2 CYS 26 22.501 24.239 26.182
189 HB3 CYS 26 HB3 CYS 26 22.859 22.650 25.492
190 H LYS 27 H LYS 27 20.846 24.717 22.401
191 HA LYS 27 HA LYS 27 21.894 22.456 20.804
192 HB2 LYS 27 HB2 LYS 27 19.313 23.888 20.042
193 HB3 LYS 27 HB3 LYS 27 20.172 22.679 19.083
194 HG2 LYS 27 HG2 LYS 27 18.882 22.102 21.769
195 HG3 LYS 27 HG3 LYS 27 18.102 21.850 20.216
196 HD2 LYS 27 HD2 LYS 27 20.751 20.549 20.924
197 HD3 LYS 27 HD3 LYS 27 19.181 19.813 21.290
198 HE2 LYS 27 HE2 LYS 27 18.637 19.974 18.812
199 HE3 LYS 27 HE3 LYS 27 20.304 20.513 18.540
200 HZ1 LYS 27 HZ1 LYS 27 20.120 18.143 18.222
201 HZ2 LYS 27 HZ2 LYS 27 21.052 18.416 19.538
202 HZ3 LYS 27 HZ3 LYS 27 19.481 17.918 19.725
203 H CYS 28 H CYS 28 23.378 23.150 19.433
204 HA CYS 28 HA CYS 28 23.378 26.024 18.650
205 HB2 CYS 28 HB2 CYS 28 25.832 26.053 18.851
206 HB3 CYS 28 HB3 CYS 28 24.996 25.912 20.379
207 H VAL 29 H VAL 29 24.419 26.604 16.719
208 HA VAL 29 HA VAL 29 24.353 24.521 14.595
209 HB VAL 29 HB VAL 29 22.765 25.783 13.281
210 HG11 VAL 29 HG11 VAL 29 20.734 25.400 14.514
211 HG12 VAL 29 HG12 VAL 29 21.878 24.108 14.899
212 HG13 VAL 29 HG13 VAL 29 21.585 25.423 16.069
213 HG21 VAL 29 HG21 VAL 29 22.559 27.730 15.615
214 HG22 VAL 29 HG22 VAL 29 23.229 28.074 14.005
215 HG23 VAL 29 HG23 VAL 29 21.514 27.706 14.178
216 HA PRO 30 HA PRO 30 27.763 26.733 13.122
217 HB2 PRO 30 HB2 PRO 30 27.853 26.225 10.430
218 HB3 PRO 30 HB3 PRO 30 28.132 24.996 11.705
219 HG2 PRO 30 HG2 PRO 30 25.563 25.535 10.194
220 HG3 PRO 30 HG3 PRO 30 26.378 23.966 10.491
221 HD2 PRO 30 HD2 PRO 30 24.326 24.833 12.044
222 HD3 PRO 30 HD3 PRO 30 25.701 23.940 12.750
223 H TYR 31 H TYR 31 28.657 28.447 11.860
224 HA TYR 31 HA TYR 31 26.999 30.784 11.651
225 HB2 TYR 31 HB2 TYR 31 29.797 30.334 10.607
226 HB3 TYR 31 HB3 TYR 31 29.016 31.888 10.876
227 HD1 TYR 31 HD1 TYR 31 31.692 30.705 11.984
228 HD2 TYR 31 HD2 TYR 31 27.754 31.191 13.663
229 HE1 TYR 31 HE1 TYR 31 32.668 30.790 14.257
230 HE2 TYR 31 HE2 TYR 31 28.733 31.251 15.945
231 HH TYR 31 HH TYR 31 30.669 31.422 17.141
Start of MODEL 20
1 H1 ALA 1 H1 ALA 1 13.870 26.359 38.544
2 H2 ALA 1 H2 ALA 1 13.941 25.200 37.368
3 H3 ALA 1 H3 ALA 1 13.311 26.673 37.034
4 HA ALA 1 HA ALA 1 15.433 27.728 37.388
5 HB1 ALA 1 HB1 ALA 1 17.443 26.252 37.586
6 HB2 ALA 1 HB2 ALA 1 16.361 26.104 38.986
7 HB3 ALA 1 HB3 ALA 1 16.377 24.842 37.729
8 H PHE 2 H PHE 2 16.935 27.993 35.617
9 HA PHE 2 HA PHE 2 16.101 26.558 33.121
10 HB2 PHE 2 HB2 PHE 2 16.907 29.448 33.527
11 HB3 PHE 2 HB3 PHE 2 16.667 28.696 31.958
12 HD1 PHE 2 HD1 PHE 2 15.000 30.185 34.821
13 HD2 PHE 2 HD2 PHE 2 14.426 27.695 31.349
14 HE1 PHE 2 HE1 PHE 2 12.563 30.540 34.969
15 HE2 PHE 2 HE2 PHE 2 11.967 28.049 31.498
16 HZ PHE 2 HZ PHE 2 11.031 29.467 33.310
17 H CYS 3 H CYS 3 17.495 26.543 31.375
18 HA CYS 3 HA CYS 3 20.021 25.378 31.764
19 HB2 CYS 3 HB2 CYS 3 20.083 25.502 29.288
20 HB3 CYS 3 HB3 CYS 3 18.577 24.894 29.932
21 H ASN 4 H ASN 4 22.029 26.037 30.642
22 HA ASN 4 HA ASN 4 22.934 28.627 31.782
23 HB2 ASN 4 HB2 ASN 4 24.337 26.056 30.960
24 HB3 ASN 4 HB3 ASN 4 25.160 27.542 31.447
25 HD21 ASN 4 HD21 ASN 4 24.377 27.250 34.865
26 HD22 ASN 4 HD22 ASN 4 25.175 28.174 33.584
27 H LEU 5 H LEU 5 21.974 29.840 30.049
28 HA LEU 5 HA LEU 5 22.379 29.448 27.322
29 HB2 LEU 5 HB2 LEU 5 20.790 30.984 28.598
30 HB3 LEU 5 HB3 LEU 5 22.058 32.199 28.593
31 HG LEU 5 HG LEU 5 21.050 30.867 26.046
32 HD11 LEU 5 HD11 LEU 5 19.461 32.732 25.777
33 HD12 LEU 5 HD12 LEU 5 19.095 31.764 27.213
34 HD13 LEU 5 HD13 LEU 5 19.900 33.334 27.393
35 HD21 LEU 5 HD21 LEU 5 21.681 33.055 25.007
36 HD22 LEU 5 HD22 LEU 5 22.316 33.599 26.571
37 HD23 LEU 5 HD23 LEU 5 23.070 32.238 25.709
38 H ARG 6 H ARG 6 24.534 31.317 29.513
39 HA ARG 6 HA ARG 6 26.267 32.156 27.313
40 HB2 ARG 6 HB2 ARG 6 27.848 32.818 29.069
41 HB3 ARG 6 HB3 ARG 6 26.259 33.561 29.218
42 HG2 ARG 6 HG2 ARG 6 25.681 32.227 31.118
43 HG3 ARG 6 HG3 ARG 6 27.064 31.147 30.893
44 HD2 ARG 6 HD2 ARG 6 27.339 34.108 31.484
45 HD3 ARG 6 HD3 ARG 6 27.342 32.846 32.734
46 HE ARG 6 HE ARG 6 29.254 31.891 31.090
47 HH11 ARG 6 HH11 ARG 6 28.991 35.134 32.440
48 HH12 ARG 6 HH12 ARG 6 30.700 35.445 32.217
49 HH21 ARG 6 HH21 ARG 6 31.320 32.259 31.008
50 HH22 ARG 6 HH22 ARG 6 32.033 33.798 31.508
51 H ARG 7 H ARG 7 26.464 29.473 29.645
52 HA ARG 7 HA ARG 7 29.036 28.530 28.723
53 HB2 ARG 7 HB2 ARG 7 27.873 28.002 30.936
54 HB3 ARG 7 HB3 ARG 7 26.849 26.867 30.037
55 HG2 ARG 7 HG2 ARG 7 28.837 25.559 29.380
56 HG3 ARG 7 HG3 ARG 7 29.899 26.774 30.112
57 HD2 ARG 7 HD2 ARG 7 29.731 24.928 31.637
58 HD3 ARG 7 HD3 ARG 7 28.877 26.306 32.340
59 HE ARG 7 HE ARG 7 27.401 24.177 30.825
60 HH11 ARG 7 HH11 ARG 7 27.796 25.808 33.995
61 HH12 ARG 7 HH12 ARG 7 26.359 25.012 34.582
62 HH21 ARG 7 HH21 ARG 7 25.778 23.174 31.756
63 HH22 ARG 7 HH22 ARG 7 25.308 23.479 33.418
64 H CYS 8 H CYS 8 25.705 27.683 27.833
65 HA CYS 8 HA CYS 8 26.206 25.746 25.848
66 HB2 CYS 8 HB2 CYS 8 24.007 26.182 26.737
67 HB3 CYS 8 HB3 CYS 8 24.047 27.850 26.175
68 H GLU 9 H GLU 9 25.897 29.322 25.344
69 HA GLU 9 HA GLU 9 26.623 29.318 22.575
70 HB2 GLU 9 HB2 GLU 9 26.752 31.310 24.868
71 HB3 GLU 9 HB3 GLU 9 27.607 31.709 23.397
72 HG2 GLU 9 HG2 GLU 9 24.747 30.861 23.074
73 HG3 GLU 9 HG3 GLU 9 25.050 32.405 23.874
74 H LEU 10 H LEU 10 28.799 29.878 25.438
75 HA LEU 10 HA LEU 10 31.110 30.251 23.813
76 HB2 LEU 10 HB2 LEU 10 30.574 29.796 26.739
77 HB3 LEU 10 HB3 LEU 10 32.200 29.500 26.190
78 HG LEU 10 HG LEU 10 31.879 31.757 27.111
79 HD11 LEU 10 HD11 LEU 10 32.652 31.788 24.166
80 HD12 LEU 10 HD12 LEU 10 33.132 32.955 25.410
81 HD13 LEU 10 HD13 LEU 10 33.695 31.273 25.513
82 HD21 LEU 10 HD21 LEU 10 30.786 33.523 25.830
83 HD22 LEU 10 HD22 LEU 10 30.226 32.354 24.623
84 HD23 LEU 10 HD23 LEU 10 29.615 32.280 26.291
85 H SER 11 H SER 11 29.892 27.274 25.359
86 HA SER 11 HA SER 11 32.180 25.665 24.715
87 HB2 SER 11 HB2 SER 11 29.302 24.761 25.120
88 HB3 SER 11 HB3 SER 11 30.753 23.748 25.251
89 HG SER 11 HG SER 11 29.780 25.810 26.879
90 H CYS 12 H CYS 12 29.411 26.636 22.788
91 HA CYS 12 HA CYS 12 30.060 24.785 20.560
92 HB2 CYS 12 HB2 CYS 12 27.996 26.977 20.998
93 HB3 CYS 12 HB3 CYS 12 28.175 26.079 19.506
94 H ARG 13 H ARG 13 30.359 28.227 21.388
95 HA ARG 13 HA ARG 13 31.026 29.232 18.816
96 HB2 ARG 13 HB2 ARG 13 30.129 30.445 20.770
97 HB3 ARG 13 HB3 ARG 13 31.691 30.334 21.585
98 HG2 ARG 13 HG2 ARG 13 32.711 31.827 20.015
99 HG3 ARG 13 HG3 ARG 13 31.364 31.668 18.877
100 HD2 ARG 13 HD2 ARG 13 31.077 32.903 21.635
101 HD3 ARG 13 HD3 ARG 13 31.374 33.836 20.170
102 HE ARG 13 HE ARG 13 28.852 32.506 20.944
103 HH11 ARG 13 HH11 ARG 13 30.508 34.001 18.158
104 HH12 ARG 13 HH12 ARG 13 28.937 34.279 17.411
105 HH21 ARG 13 HH21 ARG 13 27.043 32.808 19.765
106 HH22 ARG 13 HH22 ARG 13 27.178 33.665 18.211
107 H SER 14 H SER 14 33.092 27.863 21.335
108 HA SER 14 HA SER 14 35.613 28.418 20.050
109 HB2 SER 14 HB2 SER 14 35.403 27.654 22.395
110 HB3 SER 14 HB3 SER 14 34.874 26.052 21.813
111 HG SER 14 HG SER 14 37.147 26.064 22.128
112 H LEU 15 H LEU 15 33.137 25.986 19.373
113 HA LEU 15 HA LEU 15 34.891 24.484 17.512
114 HB2 LEU 15 HB2 LEU 15 32.018 23.957 18.349
115 HB3 LEU 15 HB3 LEU 15 33.077 22.866 17.460
116 HG LEU 15 HG LEU 15 33.461 23.775 20.342
117 HD11 LEU 15 HD11 LEU 15 32.894 21.442 20.899
118 HD12 LEU 15 HD12 LEU 15 31.563 22.238 20.047
119 HD13 LEU 15 HD13 LEU 15 32.609 21.091 19.179
120 HD21 LEU 15 HD21 LEU 15 35.648 23.291 19.327
121 HD22 LEU 15 HD22 LEU 15 35.202 21.994 20.438
122 HD23 LEU 15 HD23 LEU 15 35.032 21.749 18.687
123 H GLY 16 H GLY 16 32.976 27.204 17.280
124 HA2 GLY 16 HA2 GLY 16 32.755 28.441 15.292
125 HA3 GLY 16 HA3 GLY 16 32.952 26.988 14.323
126 H LEU 17 H LEU 17 30.529 27.274 16.942
127 HA LEU 17 HA LEU 17 28.406 27.910 15.021
128 HB2 LEU 17 HB2 LEU 17 26.957 26.090 16.066
129 HB3 LEU 17 HB3 LEU 17 28.036 25.703 14.738
130 HG LEU 17 HG LEU 17 28.527 24.985 17.655
131 HD11 LEU 17 HD11 LEU 17 26.547 23.866 16.606
132 HD12 LEU 17 HD12 LEU 17 27.587 23.295 15.290
133 HD13 LEU 17 HD13 LEU 17 27.850 22.728 16.953
134 HD21 LEU 17 HD21 LEU 17 30.665 24.907 16.577
135 HD22 LEU 17 HD22 LEU 17 30.087 23.258 16.610
136 HD23 LEU 17 HD23 LEU 17 29.977 24.193 15.096
137 H LEU 18 H LEU 18 26.612 28.888 15.826
138 HA LEU 18 HA LEU 18 27.085 30.240 18.424
139 HB2 LEU 18 HB2 LEU 18 25.651 31.963 17.655
140 HB3 LEU 18 HB3 LEU 18 26.776 31.566 16.375
141 HG LEU 18 HG LEU 18 24.661 30.001 15.622
142 HD11 LEU 18 HD11 LEU 18 23.459 32.532 16.831
143 HD12 LEU 18 HD12 LEU 18 22.590 31.274 15.921
144 HD13 LEU 18 HD13 LEU 18 23.266 30.914 17.522
145 HD21 LEU 18 HD21 LEU 18 25.798 31.574 14.149
146 HD22 LEU 18 HD22 LEU 18 24.051 31.808 14.047
147 HD23 LEU 18 HD23 LEU 18 25.039 32.952 14.984
148 H GLY 19 H GLY 19 25.751 30.094 20.191
149 HA2 GLY 19 HA2 GLY 19 23.940 27.714 20.101
150 HA3 GLY 19 HA3 GLY 19 24.841 28.247 21.495
151 H ALA 20 H ALA 20 22.171 27.447 21.345
152 HA ALA 20 HA ALA 20 20.974 29.724 22.790
153 HB1 ALA 20 HB1 ALA 20 18.796 29.324 21.685
154 HB2 ALA 20 HB2 ALA 20 20.026 29.789 20.488
155 HB3 ALA 20 HB3 ALA 20 19.535 28.092 20.644
156 H CYS 21 H CYS 21 20.462 28.942 24.817
157 HA CYS 21 HA CYS 21 20.005 26.058 25.131
158 HB2 CYS 21 HB2 CYS 21 20.557 26.210 27.240
159 HB3 CYS 21 HB3 CYS 21 21.462 27.570 26.665
160 H ILE 22 H ILE 22 18.102 25.162 25.753
161 HA ILE 22 HA ILE 22 15.630 26.809 25.327
162 HB ILE 22 HB ILE 22 16.357 24.142 24.092
163 HG12 ILE 22 HG12 ILE 22 15.735 26.689 22.544
164 HG13 ILE 22 HG13 ILE 22 17.368 26.393 23.112
165 HG21 ILE 22 HG21 ILE 22 13.817 25.814 23.785
166 HG22 ILE 22 HG22 ILE 22 14.206 24.357 22.854
167 HG23 ILE 22 HG23 ILE 22 13.929 24.235 24.585
168 HD11 ILE 22 HD11 ILE 22 17.457 24.234 21.925
169 HD12 ILE 22 HD12 ILE 22 15.860 24.586 21.227
170 HD13 ILE 22 HD13 ILE 22 17.235 25.637 20.861
171 H GLY 23 H GLY 23 15.224 26.908 27.515
172 HA2 GLY 23 HA2 GLY 23 14.117 26.304 29.438
173 HA3 GLY 23 HA3 GLY 23 13.709 24.767 28.687
174 H GLU 24 H GLU 24 15.672 23.242 28.519
175 HA GLU 24 HA GLU 24 17.300 23.197 31.044
176 HB2 GLU 24 HB2 GLU 24 16.639 20.969 31.506
177 HB3 GLU 24 HB3 GLU 24 15.146 21.850 31.167
178 HG2 GLU 24 HG2 GLU 24 15.373 20.991 28.744
179 HG3 GLU 24 HG3 GLU 24 16.638 19.914 29.341
180 H GLU 25 H GLU 25 17.348 22.881 27.635
181 HA GLU 25 HA GLU 25 19.825 21.193 27.635
182 HB2 GLU 25 HB2 GLU 25 19.083 20.109 25.684
183 HB3 GLU 25 HB3 GLU 25 17.697 20.120 26.777
184 HG2 GLU 25 HG2 GLU 25 16.889 22.199 25.515
185 HG3 GLU 25 HG3 GLU 25 18.152 21.880 24.327
186 H CYS 26 H CYS 26 21.183 21.504 25.666
187 HA CYS 26 HA CYS 26 21.163 24.323 24.645
188 HB2 CYS 26 HB2 CYS 26 23.007 23.934 26.176
189 HB3 CYS 26 HB3 CYS 26 23.466 22.474 25.300
190 H LYS 27 H LYS 27 21.168 24.665 22.512
191 HA LYS 27 HA LYS 27 22.150 22.571 20.638
192 HB2 LYS 27 HB2 LYS 27 19.650 22.462 20.835
193 HB3 LYS 27 HB3 LYS 27 19.567 24.153 20.322
194 HG2 LYS 27 HG2 LYS 27 20.692 23.489 18.163
195 HG3 LYS 27 HG3 LYS 27 20.622 21.802 18.689
196 HD2 LYS 27 HD2 LYS 27 18.229 23.659 18.323
197 HD3 LYS 27 HD3 LYS 27 18.784 22.468 17.129
198 HE2 LYS 27 HE2 LYS 27 18.382 20.645 18.804
199 HE3 LYS 27 HE3 LYS 27 17.730 21.853 19.927
200 HZ1 LYS 27 HZ1 LYS 27 15.907 20.839 18.720
201 HZ2 LYS 27 HZ2 LYS 27 16.054 22.374 18.165
202 HZ3 LYS 27 HZ3 LYS 27 16.620 21.129 17.276
203 H CYS 28 H CYS 28 23.446 23.399 19.072
204 HA CYS 28 HA CYS 28 23.424 26.337 18.568
205 HB2 CYS 28 HB2 CYS 28 25.954 26.130 18.284
206 HB3 CYS 28 HB3 CYS 28 25.318 26.225 19.895
207 H VAL 29 H VAL 29 24.218 27.068 16.575
208 HA VAL 29 HA VAL 29 23.858 25.130 14.346
209 HB VAL 29 HB VAL 29 22.466 26.678 13.159
210 HG11 VAL 29 HG11 VAL 29 20.448 26.547 14.500
211 HG12 VAL 29 HG12 VAL 29 21.397 25.069 14.724
212 HG13 VAL 29 HG13 VAL 29 21.385 26.322 15.985
213 HG21 VAL 29 HG21 VAL 29 21.537 28.710 14.231
214 HG22 VAL 29 HG22 VAL 29 22.685 28.517 15.572
215 HG23 VAL 29 HG23 VAL 29 23.274 28.840 13.928
216 HA PRO 30 HA PRO 30 27.481 26.812 12.554
217 HB2 PRO 30 HB2 PRO 30 26.072 26.705 9.894
218 HB3 PRO 30 HB3 PRO 30 27.684 26.055 10.337
219 HG2 PRO 30 HG2 PRO 30 25.591 24.386 10.123
220 HG3 PRO 30 HG3 PRO 30 26.695 24.230 11.531
221 HD2 PRO 30 HD2 PRO 30 24.025 25.660 11.384
222 HD3 PRO 30 HD3 PRO 30 24.608 24.477 12.588
223 H TYR 31 H TYR 31 28.473 28.646 11.743
224 HA TYR 31 HA TYR 31 27.118 31.197 11.868
225 HB2 TYR 31 HB2 TYR 31 29.847 30.459 10.750
226 HB3 TYR 31 HB3 TYR 31 29.302 32.079 11.144
227 HD1 TYR 31 HD1 TYR 31 31.849 30.858 12.056
228 HD2 TYR 31 HD2 TYR 31 27.961 30.952 13.919
229 HE1 TYR 31 HE1 TYR 31 32.920 30.769 14.294
230 HE2 TYR 31 HE2 TYR 31 29.032 30.862 16.162
231 HH TYR 31 HH TYR 31 32.528 31.099 16.587