Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
576839 | 2mel RC | 19524 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 GLY 1 H1 GLY 1 34.377 17.517 24.873
2 H2 GLY 1 H2 GLY 1 34.545 16.353 23.711
3 H3 GLY 1 H3 GLY 1 35.447 17.734 23.649
4 HA2 GLY 1 HA2 GLY 1 36.726 17.170 25.520
5 HA3 GLY 1 HA3 GLY 1 35.633 15.811 25.853
6 H SER 2 H SER 2 38.639 16.046 25.125
7 HA SER 2 HA SER 2 40.253 15.028 23.999
8 HB2 SER 2 HB2 SER 2 40.104 12.748 23.485
9 HB3 SER 2 HB3 SER 2 39.000 13.018 24.840
10 HG SER 2 HG SER 2 37.317 13.224 23.184
11 H ALA 3 H ALA 3 37.467 15.517 21.944
12 HA ALA 3 HA ALA 3 39.192 16.260 19.679
13 HB1 ALA 3 HB1 ALA 3 36.830 14.351 19.453
14 HB2 ALA 3 HB2 ALA 3 37.783 14.997 18.104
15 HB3 ALA 3 HB3 ALA 3 38.541 13.899 19.265
16 H PHE 4 H PHE 4 37.908 17.666 18.114
17 HA PHE 4 HA PHE 4 36.594 19.624 19.788
18 HB2 PHE 4 HB2 PHE 4 37.165 19.704 16.821
19 HB3 PHE 4 HB3 PHE 4 36.768 21.066 17.842
20 HD1 PHE 4 HD2 PHE 4 38.370 21.279 20.044
21 HD2 PHE 4 HD1 PHE 4 39.451 19.487 16.271
22 HE1 PHE 4 HE2 PHE 4 40.774 21.671 20.554
23 HE2 PHE 4 HE1 PHE 4 41.859 19.871 16.772
24 HZ PHE 4 HZ PHE 4 42.517 20.961 18.916
25 H CYS 5 H CYS 5 34.599 20.631 19.545
26 HA CYS 5 HA CYS 5 32.468 18.787 19.191
27 HB2 CYS 5 HB2 CYS 5 31.023 20.607 19.893
28 HB3 CYS 5 HB3 CYS 5 32.474 20.539 20.890
29 H ASN 6 H ASN 6 31.032 18.370 17.691
30 HA ASN 6 HA ASN 6 30.790 20.103 15.260
31 HB2 ASN 6 HB2 ASN 6 31.262 17.519 15.065
32 HB3 ASN 6 HB3 ASN 6 29.710 17.325 15.770
33 HD21 ASN 6 HD22 ASN 6 31.301 18.771 12.888
34 HD22 ASN 6 HD21 ASN 6 29.844 18.623 11.908
35 H LEU 7 H LEU 7 28.803 20.714 14.512
36 HA LEU 7 HA LEU 7 26.971 21.330 16.761
37 HB2 LEU 7 HB2 LEU 7 28.389 23.044 15.443
38 HB3 LEU 7 HB3 LEU 7 27.246 22.750 14.114
39 HG LEU 7 HG LEU 7 26.039 23.288 16.751
40 HD11 LEU 7 HD11 LEU 7 27.857 24.955 16.675
41 HD12 LEU 7 HD12 LEU 7 27.414 25.384 15.015
42 HD13 LEU 7 HD13 LEU 7 26.313 25.768 16.336
43 HD21 LEU 7 HD21 LEU 7 24.595 22.993 14.723
44 HD22 LEU 7 HD22 LEU 7 24.473 24.623 15.368
45 HD23 LEU 7 HD23 LEU 7 25.464 24.324 13.931
46 H ARG 8 H ARG 8 26.877 20.130 13.397
47 HA ARG 8 HA ARG 8 24.086 19.490 13.465
48 HB2 ARG 8 HB2 ARG 8 25.335 19.133 11.441
49 HB3 ARG 8 HB3 ARG 8 26.474 18.064 12.234
50 HG2 ARG 8 HG2 ARG 8 25.057 16.732 10.883
51 HG3 ARG 8 HG3 ARG 8 24.681 16.378 12.571
52 HD2 ARG 8 HD2 ARG 8 22.656 17.775 12.438
53 HD3 ARG 8 HD3 ARG 8 23.070 18.247 10.774
54 HE ARG 8 HE ARG 8 23.012 15.420 10.854
55 HH11 ARG 8 HH11 ARG 8 20.677 17.988 11.308
56 HH12 ARG 8 HH12 ARG 8 19.340 17.032 10.739
57 HH21 ARG 8 HH21 ARG 8 21.289 14.251 10.011
58 HH22 ARG 8 HH22 ARG 8 19.669 14.908 10.162
59 H ALA 9 H ALA 9 26.867 17.676 14.816
60 HA ALA 9 HA ALA 9 25.512 15.628 16.150
61 HB1 ALA 9 HB1 ALA 9 28.069 16.999 17.047
62 HB2 ALA 9 HB2 ALA 9 27.584 15.331 17.350
63 HB3 ALA 9 HB3 ALA 9 28.003 15.842 15.703
64 H CYS 10 H CYS 10 26.487 18.864 17.480
65 HA CYS 10 HA CYS 10 25.284 18.548 20.055
66 HB2 CYS 10 HB2 CYS 10 25.758 20.934 18.277
67 HB3 CYS 10 HB3 CYS 10 25.064 21.091 19.876
68 H GLU 11 H GLU 11 23.917 19.999 17.002
69 HA GLU 11 HA GLU 11 21.370 20.526 17.923
70 HB2 GLU 11 HB2 GLU 11 22.375 19.670 15.227
71 HB3 GLU 11 HB3 GLU 11 20.682 19.931 15.485
72 HG2 GLU 11 HG2 GLU 11 22.483 22.100 16.483
73 HG3 GLU 11 HG3 GLU 11 22.477 21.834 14.731
74 H LEU 12 H LEU 12 22.662 17.330 16.928
75 HA LEU 12 HA LEU 12 20.128 15.954 17.035
76 HB2 LEU 12 HB2 LEU 12 22.815 14.622 17.576
77 HB3 LEU 12 HB3 LEU 12 21.348 13.906 16.948
78 HG LEU 12 HG LEU 12 23.453 15.487 15.508
79 HD11 LEU 12 HD11 LEU 12 23.620 13.054 15.720
80 HD12 LEU 12 HD12 LEU 12 22.048 12.880 14.909
81 HD13 LEU 12 HD13 LEU 12 23.427 13.572 14.036
82 HD21 LEU 12 HD21 LEU 12 21.969 15.404 13.477
83 HD22 LEU 12 HD22 LEU 12 20.617 14.905 14.512
84 HD23 LEU 12 HD23 LEU 12 21.343 16.517 14.696
85 H SER 13 H SER 13 22.494 16.738 19.502
86 HA SER 13 HA SER 13 21.253 15.017 21.520
87 HB2 SER 13 HB2 SER 13 23.392 17.165 21.715
88 HB3 SER 13 HB3 SER 13 22.860 16.153 23.069
89 HG SER 13 HG SER 13 23.574 14.332 22.013
90 H CYS 14 H CYS 14 21.235 18.521 20.731
91 HA CYS 14 HA CYS 14 19.515 19.241 22.941
92 HB2 CYS 14 HB2 CYS 14 20.144 20.653 20.330
93 HB3 CYS 14 HB3 CYS 14 19.286 21.373 21.700
94 H ARG 15 H ARG 15 18.767 17.870 19.801
95 HA ARG 15 HA ARG 15 16.094 18.684 19.474
96 HB2 ARG 15 HB2 ARG 15 17.750 17.204 18.000
97 HB3 ARG 15 HB3 ARG 15 17.130 15.860 18.917
98 HG2 ARG 15 HG2 ARG 15 15.586 15.773 17.235
99 HG3 ARG 15 HG3 ARG 15 14.763 17.057 18.117
100 HD2 ARG 15 HD2 ARG 15 16.706 17.315 15.796
101 HD3 ARG 15 HD3 ARG 15 14.973 17.672 15.763
102 HE ARG 15 HE ARG 15 15.570 19.493 17.522
103 HH11 ARG 15 HH21 ARG 15 17.506 18.833 14.654
104 HH12 ARG 15 HH22 ARG 15 18.205 20.431 14.763
105 HH21 ARG 15 HH11 ARG 15 16.884 21.288 17.751
106 HH22 ARG 15 HH12 ARG 15 18.129 21.585 16.556
107 H SER 16 H SER 16 17.465 16.478 21.789
108 HA SER 16 HA SER 16 15.027 15.172 22.562
109 HB2 SER 16 HB2 SER 16 17.726 15.515 23.865
110 HB3 SER 16 HB3 SER 16 16.401 14.654 24.672
111 HG SER 16 HG SER 16 16.829 13.004 23.549
112 H LEU 17 H LEU 17 16.185 18.421 23.371
113 HA LEU 17 HA LEU 17 14.286 18.635 25.655
114 HB2 LEU 17 HB2 LEU 17 16.206 20.442 24.201
115 HB3 LEU 17 HB3 LEU 17 15.203 20.968 25.582
116 HG LEU 17 HG LEU 17 17.334 18.885 25.707
117 HD11 LEU 17 HD11 LEU 17 18.486 20.919 25.318
118 HD12 LEU 17 HD12 LEU 17 17.656 21.696 26.708
119 HD13 LEU 17 HD13 LEU 17 18.775 20.345 26.952
120 HD21 LEU 17 HD21 LEU 17 15.793 20.521 27.757
121 HD22 LEU 17 HD22 LEU 17 15.545 18.776 27.477
122 HD23 LEU 17 HD23 LEU 17 17.045 19.354 28.225
123 H GLY 18 H GLY 18 14.169 18.721 22.238
124 HA2 GLY 18 HA2 GLY 18 12.972 19.914 20.671
125 HA3 GLY 18 HA3 GLY 18 11.989 20.644 21.946
126 H LEU 19 H LEU 19 15.591 20.839 22.042
127 HA LEU 19 HA LEU 19 15.349 23.828 21.745
128 HB2 LEU 19 HB2 LEU 19 17.559 22.072 22.755
129 HB3 LEU 19 HB3 LEU 19 17.708 23.817 22.606
130 HG LEU 19 HG LEU 19 16.832 22.284 24.740
131 HD11 LEU 19 HD11 LEU 19 17.005 25.256 24.642
132 HD12 LEU 19 HD12 LEU 19 16.712 24.316 26.101
133 HD13 LEU 19 HD13 LEU 19 18.206 24.113 25.272
134 HD21 LEU 19 HD21 LEU 19 14.776 23.500 25.497
135 HD22 LEU 19 HD22 LEU 19 14.668 24.209 23.878
136 HD23 LEU 19 HD23 LEU 19 14.492 22.489 24.113
137 H LEU 20 H LEU 20 17.369 24.770 20.886
138 HA LEU 20 HA LEU 20 18.113 23.558 18.246
139 HB2 LEU 20 HB2 LEU 20 16.975 25.876 18.361
140 HB3 LEU 20 HB3 LEU 20 18.482 26.434 19.113
141 HG LEU 20 HG LEU 20 19.641 25.436 16.997
142 HD11 LEU 20 HD11 LEU 20 16.776 25.662 15.974
143 HD12 LEU 20 HD12 LEU 20 18.225 25.297 14.993
144 HD13 LEU 20 HD13 LEU 20 17.652 24.142 16.190
145 HD21 LEU 20 HD21 LEU 20 19.234 27.465 15.694
146 HD22 LEU 20 HD22 LEU 20 17.772 27.802 16.655
147 HD23 LEU 20 HD23 LEU 20 19.366 27.866 17.420
148 H GLY 21 H GLY 21 20.199 22.900 18.016
149 HA2 GLY 21 HA2 GLY 21 21.987 23.165 20.363
150 HA3 GLY 21 HA3 GLY 21 22.226 22.094 18.998
151 H LYS 22 H LYS 22 23.692 24.318 20.475
152 HA LYS 22 HA LYS 22 25.244 25.208 18.112
153 HB2 LYS 22 HB2 LYS 22 24.762 26.832 20.652
154 HB3 LYS 22 HB3 LYS 22 25.825 27.298 19.334
155 HG2 LYS 22 HG2 LYS 22 22.797 27.068 19.194
156 HG3 LYS 22 HG3 LYS 22 23.750 28.554 19.290
157 HD2 LYS 22 HD2 LYS 22 24.767 28.059 17.099
158 HD3 LYS 22 HD3 LYS 22 23.836 26.564 16.995
159 HE2 LYS 22 HE2 LYS 22 21.732 28.034 17.231
160 HE3 LYS 22 HE3 LYS 22 22.799 29.429 16.961
161 HZ1 LYS 22 HZ1 LYS 22 23.444 28.366 14.824
162 HZ2 LYS 22 HZ2 LYS 22 22.382 27.153 15.096
163 HZ3 LYS 22 HZ3 LYS 22 21.832 28.679 14.865
164 H CYS 23 H CYS 23 27.537 25.541 18.694
165 HA CYS 23 HA CYS 23 28.332 24.183 21.267
166 HB2 CYS 23 HB2 CYS 23 29.262 23.017 19.312
167 HB3 CYS 23 HB3 CYS 23 30.094 24.510 18.842
168 H ILE 24 H ILE 24 29.366 25.311 22.789
169 HA ILE 24 HA ILE 24 30.462 28.022 22.212
170 HB ILE 24 HB ILE 24 28.558 27.346 24.487
171 HG12 ILE 24 HG12 ILE 24 27.314 27.702 22.384
172 HG13 ILE 24 HG13 ILE 24 27.000 28.911 23.607
173 HG21 ILE 24 HG21 ILE 24 30.073 29.926 23.880
174 HG22 ILE 24 HG22 ILE 24 28.749 29.783 25.056
175 HG23 ILE 24 HG23 ILE 24 30.243 28.889 25.309
176 HD11 ILE 24 HD11 ILE 24 28.862 29.400 21.249
177 HD12 ILE 24 HD12 ILE 24 27.151 29.853 21.312
178 HD13 ILE 24 HD13 ILE 24 28.296 30.585 22.441
179 H GLY 25 H GLY 25 32.482 28.162 23.049
180 HA2 GLY 25 HA2 GLY 25 34.409 27.609 24.216
181 HA3 GLY 25 HA3 GLY 25 33.329 27.348 25.599
182 H GLU 26 H GLU 26 33.730 25.518 22.556
183 HA GLU 26 HA GLU 26 33.729 23.318 22.086
184 HB2 GLU 26 HB2 GLU 26 35.898 23.529 24.125
185 HB3 GLU 26 HB3 GLU 26 35.543 21.986 23.377
186 HG2 GLU 26 HG2 GLU 26 36.108 24.541 21.816
187 HG3 GLU 26 HG3 GLU 26 37.285 23.300 22.194
188 H GLU 27 H GLU 27 31.647 24.030 24.309
189 HA GLU 27 HA GLU 27 30.885 21.158 24.541
190 HB2 GLU 27 HB2 GLU 27 30.518 23.319 26.627
191 HB3 GLU 27 HB3 GLU 27 29.678 21.780 26.636
192 HG2 GLU 27 HG2 GLU 27 32.680 22.198 26.888
193 HG3 GLU 27 HG3 GLU 27 31.554 21.843 28.184
194 H CYS 28 H CYS 28 28.812 20.610 24.068
195 HA CYS 28 HA CYS 28 27.335 22.292 22.359
196 HB2 CYS 28 HB2 CYS 28 26.795 19.705 23.863
197 HB3 CYS 28 HB3 CYS 28 25.691 20.416 22.745
198 H LYS 29 H LYS 29 25.672 23.580 22.670
199 HA LYS 29 HA LYS 29 24.315 23.882 25.306
200 HB2 LYS 29 HB2 LYS 29 25.996 25.656 25.018
201 HB3 LYS 29 HB3 LYS 29 25.343 26.026 23.420
202 HG2 LYS 29 HG2 LYS 29 24.621 27.732 24.916
203 HG3 LYS 29 HG3 LYS 29 23.219 26.780 24.455
204 HD2 LYS 29 HD2 LYS 29 23.074 27.317 26.787
205 HD3 LYS 29 HD3 LYS 29 23.351 25.574 26.650
206 HE2 LYS 29 HE2 LYS 29 25.670 25.807 27.300
207 HE3 LYS 29 HE3 LYS 29 25.614 27.565 27.118
208 HZ1 LYS 29 HZ1 LYS 29 25.426 26.837 29.457
209 HZ2 LYS 29 HZ2 LYS 29 24.152 27.731 28.969
210 HZ3 LYS 29 HZ3 LYS 29 24.005 26.086 29.122
211 H CYS 30 H CYS 30 22.153 23.946 25.201
212 HA CYS 30 HA CYS 30 20.749 23.883 22.595
213 HB2 CYS 30 HB2 CYS 30 19.993 22.938 25.344
214 HB3 CYS 30 HB3 CYS 30 19.247 22.587 23.801
215 H VAL 31 H VAL 31 19.602 25.662 22.109
216 HA VAL 31 HA VAL 31 18.791 27.445 24.355
217 HB VAL 31 HB VAL 31 18.723 29.304 22.888
218 HG11 VAL 31 HG11 VAL 31 21.133 29.720 22.789
219 HG12 VAL 31 HG12 VAL 31 20.725 28.853 24.275
220 HG13 VAL 31 HG13 VAL 31 21.470 27.983 22.916
221 HG21 VAL 31 HG21 VAL 31 19.901 29.246 20.682
222 HG22 VAL 31 HG22 VAL 31 20.084 27.485 20.842
223 HG23 VAL 31 HG23 VAL 31 18.467 28.209 20.687
224 HA PRO 32 HA PRO 32 14.934 26.201 23.755
225 HB2 PRO 32 HB2 PRO 32 13.304 28.315 24.585
226 HB3 PRO 32 HB3 PRO 32 14.139 27.111 25.599
227 HG2 PRO 32 HG2 PRO 32 15.068 29.879 24.846
228 HG3 PRO 32 HG3 PRO 32 15.218 29.041 26.431
229 HD2 PRO 32 HD2 PRO 32 17.331 29.179 24.769
230 HD3 PRO 32 HD3 PRO 32 16.973 27.592 25.553
231 H TYR 33 H TYR 33 13.995 25.590 22.138
232 HA TYR 33 HA TYR 33 12.865 27.483 20.093
233 HB2 TYR 33 HB2 TYR 33 14.658 25.242 19.768
234 HB3 TYR 33 HB3 TYR 33 13.179 24.933 18.912
235 HD1 TYR 33 HD2 TYR 33 15.533 27.721 19.606
236 HD2 TYR 33 HD1 TYR 33 12.953 25.833 16.730
237 HE1 TYR 33 HE2 TYR 33 16.174 29.460 17.872
238 HE2 TYR 33 HE1 TYR 33 13.590 27.512 15.014
239 HH TYR 33 HH TYR 33 14.785 29.347 14.555
Start of MODEL 2
1 H1 GLY 1 H1 GLY 1 40.229 24.926 22.456
2 H2 GLY 1 H2 GLY 1 41.648 24.764 23.263
3 H3 GLY 1 H3 GLY 1 41.363 23.850 21.929
4 HA2 GLY 1 HA2 GLY 1 41.704 26.771 21.965
5 HA3 GLY 1 HA3 GLY 1 42.889 25.579 21.381
6 H SER 2 H SER 2 42.949 25.530 19.182
7 HA SER 2 HA SER 2 40.977 26.687 17.540
8 HB2 SER 2 HB2 SER 2 42.922 24.600 16.551
9 HB3 SER 2 HB3 SER 2 42.314 26.038 15.715
10 HG SER 2 HG SER 2 43.506 27.274 17.386
11 H ALA 3 H ALA 3 41.040 23.385 18.762
12 HA ALA 3 HA ALA 3 39.440 22.264 16.621
13 HB1 ALA 3 HB1 ALA 3 41.089 20.927 17.750
14 HB2 ALA 3 HB2 ALA 3 40.289 21.162 19.322
15 HB3 ALA 3 HB3 ALA 3 39.487 20.236 18.032
16 H PHE 4 H PHE 4 37.815 24.056 16.830
17 HA PHE 4 HA PHE 4 35.858 24.201 18.853
18 HB2 PHE 4 HB2 PHE 4 36.325 25.751 16.881
19 HB3 PHE 4 HB3 PHE 4 35.423 24.618 15.887
20 HD1 PHE 4 HD2 PHE 4 35.120 26.643 19.051
21 HD2 PHE 4 HD1 PHE 4 33.112 25.032 15.584
22 HE1 PHE 4 HE2 PHE 4 33.075 27.928 19.636
23 HE2 PHE 4 HE1 PHE 4 31.084 26.345 16.157
24 HZ PHE 4 HZ PHE 4 31.070 27.798 18.175
25 H CYS 5 H CYS 5 33.666 23.333 18.996
26 HA CYS 5 HA CYS 5 33.905 20.486 18.549
27 HB2 CYS 5 HB2 CYS 5 32.471 20.184 20.294
28 HB3 CYS 5 HB3 CYS 5 33.463 21.549 20.744
29 H ASN 6 H ASN 6 31.918 19.098 18.178
30 HA ASN 6 HA ASN 6 30.820 19.868 15.576
31 HB2 ASN 6 HB2 ASN 6 31.411 17.385 16.561
32 HB3 ASN 6 HB3 ASN 6 29.792 17.502 17.106
33 HD21 ASN 6 HD22 ASN 6 31.885 17.667 14.252
34 HD22 ASN 6 HD21 ASN 6 30.652 17.290 13.082
35 H LEU 7 H LEU 7 28.867 20.340 14.975
36 HA LEU 7 HA LEU 7 26.948 21.238 17.084
37 HB2 LEU 7 HB2 LEU 7 28.440 22.867 15.740
38 HB3 LEU 7 HB3 LEU 7 27.446 22.419 14.343
39 HG LEU 7 HG LEU 7 26.027 23.173 16.827
40 HD11 LEU 7 HD11 LEU 7 26.230 25.591 16.152
41 HD12 LEU 7 HD12 LEU 7 27.799 24.898 16.611
42 HD13 LEU 7 HD13 LEU 7 27.386 25.116 14.910
43 HD21 LEU 7 HD21 LEU 7 24.474 24.264 15.237
44 HD22 LEU 7 HD22 LEU 7 25.544 23.847 13.890
45 HD23 LEU 7 HD23 LEU 7 24.697 22.582 14.777
46 H ARG 8 H ARG 8 27.214 19.699 13.849
47 HA ARG 8 HA ARG 8 24.424 19.067 13.737
48 HB2 ARG 8 HB2 ARG 8 26.081 18.539 11.909
49 HB3 ARG 8 HB3 ARG 8 26.721 17.232 12.926
50 HG2 ARG 8 HG2 ARG 8 24.321 16.296 12.990
51 HG3 ARG 8 HG3 ARG 8 23.885 17.527 11.816
52 HD2 ARG 8 HD2 ARG 8 24.262 15.413 10.721
53 HD3 ARG 8 HD3 ARG 8 25.535 16.563 10.232
54 HE ARG 8 HE ARG 8 26.401 14.992 12.483
55 HH11 ARG 8 HH11 ARG 8 25.873 14.574 9.005
56 HH12 ARG 8 HH12 ARG 8 27.201 13.409 8.929
57 HH21 ARG 8 HH21 ARG 8 28.093 13.669 12.164
58 HH22 ARG 8 HH22 ARG 8 28.333 12.875 10.588
59 H ALA 9 H ALA 9 27.087 17.421 15.531
60 HA ALA 9 HA ALA 9 25.602 15.408 16.822
61 HB1 ALA 9 HB1 ALA 9 27.489 15.279 18.297
62 HB2 ALA 9 HB2 ALA 9 28.140 15.720 16.703
63 HB3 ALA 9 HB3 ALA 9 27.958 16.951 17.962
64 H CYS 10 H CYS 10 26.216 18.793 17.713
65 HA CYS 10 HA CYS 10 24.949 18.689 20.286
66 HB2 CYS 10 HB2 CYS 10 26.633 20.398 19.350
67 HB3 CYS 10 HB3 CYS 10 25.288 21.106 18.472
68 H GLU 11 H GLU 11 23.838 19.922 17.075
69 HA GLU 11 HA GLU 11 21.263 20.603 17.757
70 HB2 GLU 11 HB2 GLU 11 22.507 19.610 15.200
71 HB3 GLU 11 HB3 GLU 11 20.782 19.934 15.252
72 HG2 GLU 11 HG2 GLU 11 22.697 22.036 16.297
73 HG3 GLU 11 HG3 GLU 11 22.492 21.813 14.565
74 H LEU 12 H LEU 12 22.370 17.382 16.585
75 HA LEU 12 HA LEU 12 19.787 16.157 16.838
76 HB2 LEU 12 HB2 LEU 12 20.868 14.139 16.095
77 HB3 LEU 12 HB3 LEU 12 21.388 15.539 15.145
78 HG LEU 12 HG LEU 12 23.501 15.488 16.667
79 HD11 LEU 12 HD11 LEU 12 22.808 13.942 18.379
80 HD12 LEU 12 HD12 LEU 12 22.476 12.706 17.130
81 HD13 LEU 12 HD13 LEU 12 24.148 13.274 17.463
82 HD21 LEU 12 HD21 LEU 12 24.607 13.898 15.167
83 HD22 LEU 12 HD22 LEU 12 23.038 13.130 14.798
84 HD23 LEU 12 HD23 LEU 12 23.383 14.774 14.232
85 H SER 13 H SER 13 21.952 17.001 19.225
86 HA SER 13 HA SER 13 20.827 15.012 21.133
87 HB2 SER 13 HB2 SER 13 23.196 16.881 21.473
88 HB3 SER 13 HB3 SER 13 22.607 15.689 22.647
89 HG SER 13 HG SER 13 23.914 15.333 20.210
90 H CYS 14 H CYS 14 20.930 18.487 20.419
91 HA CYS 14 HA CYS 14 19.402 19.229 22.795
92 HB2 CYS 14 HB2 CYS 14 20.165 20.717 20.256
93 HB3 CYS 14 HB3 CYS 14 19.302 21.440 21.622
94 H ARG 15 H ARG 15 18.586 18.194 19.527
95 HA ARG 15 HA ARG 15 15.858 18.947 19.408
96 HB2 ARG 15 HB2 ARG 15 17.528 17.557 17.769
97 HB3 ARG 15 HB3 ARG 15 16.762 16.192 18.547
98 HG2 ARG 15 HG2 ARG 15 15.239 16.436 16.884
99 HG3 ARG 15 HG3 ARG 15 14.536 17.675 17.913
100 HD2 ARG 15 HD2 ARG 15 16.493 18.047 15.600
101 HD3 ARG 15 HD3 ARG 15 14.786 18.491 15.627
102 HE ARG 15 HE ARG 15 15.286 20.192 17.320
103 HH11 ARG 15 HH11 ARG 15 18.058 19.269 15.209
104 HH12 ARG 15 HH12 ARG 15 18.869 20.741 15.714
105 HH21 ARG 15 HH21 ARG 15 16.682 21.917 17.889
106 HH22 ARG 15 HH22 ARG 15 18.197 22.048 16.978
107 H SER 16 H SER 16 17.447 16.557 21.392
108 HA SER 16 HA SER 16 15.279 15.004 22.240
109 HB2 SER 16 HB2 SER 16 17.665 15.816 23.919
110 HB3 SER 16 HB3 SER 16 16.693 14.345 24.088
111 HG SER 16 HG SER 16 18.816 14.298 22.918
112 H LEU 17 H LEU 17 16.238 18.280 23.322
113 HA LEU 17 HA LEU 17 14.280 18.343 25.543
114 HB2 LEU 17 HB2 LEU 17 16.238 20.214 24.259
115 HB3 LEU 17 HB3 LEU 17 15.233 20.657 25.669
116 HG LEU 17 HG LEU 17 17.253 18.480 25.705
117 HD11 LEU 17 HD11 LEU 17 17.791 21.254 26.714
118 HD12 LEU 17 HD12 LEU 17 18.817 19.827 26.901
119 HD13 LEU 17 HD13 LEU 17 18.523 20.455 25.284
120 HD21 LEU 17 HD21 LEU 17 15.452 18.516 27.498
121 HD22 LEU 17 HD22 LEU 17 17.044 18.872 28.202
122 HD23 LEU 17 HD23 LEU 17 15.923 20.209 27.832
123 H GLY 18 H GLY 18 14.191 18.713 22.178
124 HA2 GLY 18 HA2 GLY 18 12.967 19.929 20.665
125 HA3 GLY 18 HA3 GLY 18 12.014 20.640 21.972
126 H LEU 19 H LEU 19 15.567 20.907 22.115
127 HA LEU 19 HA LEU 19 15.250 23.854 22.102
128 HB2 LEU 19 HB2 LEU 19 17.580 22.070 22.726
129 HB3 LEU 19 HB3 LEU 19 17.678 23.811 22.805
130 HG LEU 19 HG LEU 19 16.960 22.009 24.791
131 HD11 LEU 19 HD11 LEU 19 16.875 24.975 25.083
132 HD12 LEU 19 HD12 LEU 19 16.898 23.797 26.382
133 HD13 LEU 19 HD13 LEU 19 18.285 23.944 25.355
134 HD21 LEU 19 HD21 LEU 19 14.680 23.953 24.294
135 HD22 LEU 19 HD22 LEU 19 14.566 22.224 24.257
136 HD23 LEU 19 HD23 LEU 19 14.904 23.023 25.774
137 H LEU 20 H LEU 20 17.545 24.766 21.220
138 HA LEU 20 HA LEU 20 18.083 23.794 18.439
139 HB2 LEU 20 HB2 LEU 20 17.016 26.155 18.765
140 HB3 LEU 20 HB3 LEU 20 18.577 26.596 19.461
141 HG LEU 20 HG LEU 20 19.608 25.746 17.227
142 HD11 LEU 20 HD11 LEU 20 18.034 25.828 15.292
143 HD12 LEU 20 HD12 LEU 20 17.621 24.509 16.389
144 HD13 LEU 20 HD13 LEU 20 16.670 26.015 16.415
145 HD21 LEU 20 HD21 LEU 20 19.370 28.151 17.823
146 HD22 LEU 20 HD22 LEU 20 19.127 27.863 16.087
147 HD23 LEU 20 HD23 LEU 20 17.726 28.135 17.136
148 H GLY 21 H GLY 21 20.240 23.188 18.081
149 HA2 GLY 21 HA2 GLY 21 22.049 23.291 20.446
150 HA3 GLY 21 HA3 GLY 21 22.193 22.221 19.062
151 H LYS 22 H LYS 22 23.785 24.497 20.513
152 HA LYS 22 HA LYS 22 25.271 25.350 18.097
153 HB2 LYS 22 HB2 LYS 22 24.564 27.091 20.505
154 HB3 LYS 22 HB3 LYS 22 25.790 27.510 19.326
155 HG2 LYS 22 HG2 LYS 22 22.810 27.277 18.821
156 HG3 LYS 22 HG3 LYS 22 23.795 28.745 18.866
157 HD2 LYS 22 HD2 LYS 22 25.073 27.861 16.860
158 HD3 LYS 22 HD3 LYS 22 23.909 26.527 16.803
159 HE2 LYS 22 HE2 LYS 22 22.077 28.368 16.729
160 HE3 LYS 22 HE3 LYS 22 23.398 29.500 16.396
161 HZ1 LYS 22 HZ1 LYS 22 23.940 28.018 14.446
162 HZ2 LYS 22 HZ2 LYS 22 22.562 27.182 14.752
163 HZ3 LYS 22 HZ3 LYS 22 22.484 28.773 14.326
164 H CYS 23 H CYS 23 27.495 25.632 18.418
165 HA CYS 23 HA CYS 23 28.643 24.237 20.804
166 HB2 CYS 23 HB2 CYS 23 29.477 23.539 18.579
167 HB3 CYS 23 HB3 CYS 23 30.032 25.198 18.292
168 H ILE 24 H ILE 24 29.350 25.407 22.463
169 HA ILE 24 HA ILE 24 30.015 28.307 22.213
170 HB ILE 24 HB ILE 24 28.160 27.016 24.257
171 HG12 ILE 24 HG12 ILE 24 26.960 27.326 22.147
172 HG13 ILE 24 HG13 ILE 24 26.382 28.381 23.419
173 HG21 ILE 24 HG21 ILE 24 29.203 29.866 24.014
174 HG22 ILE 24 HG22 ILE 24 27.820 29.393 25.031
175 HG23 ILE 24 HG23 ILE 24 29.424 28.740 25.368
176 HD11 ILE 24 HD11 ILE 24 28.193 29.291 21.146
177 HD12 ILE 24 HD12 ILE 24 26.443 29.528 21.260
178 HD13 ILE 24 HD13 ILE 24 27.523 30.314 22.422
179 H GLY 25 H GLY 25 31.942 28.660 23.097
180 HA2 GLY 25 HA2 GLY 25 33.928 28.316 24.273
181 HA3 GLY 25 HA3 GLY 25 32.885 27.847 25.621
182 H GLU 26 H GLU 26 33.619 26.311 22.491
183 HA GLU 26 HA GLU 26 34.052 24.198 21.834
184 HB2 GLU 26 HB2 GLU 26 35.891 24.303 24.235
185 HB3 GLU 26 HB3 GLU 26 35.894 22.970 23.074
186 HG2 GLU 26 HG2 GLU 26 36.526 24.390 21.261
187 HG3 GLU 26 HG3 GLU 26 36.264 25.853 22.207
188 H GLU 27 H GLU 27 31.805 24.499 23.993
189 HA GLU 27 HA GLU 27 31.362 21.550 24.304
190 HB2 GLU 27 HB2 GLU 27 30.789 23.879 26.160
191 HB3 GLU 27 HB3 GLU 27 29.836 22.401 26.244
192 HG2 GLU 27 HG2 GLU 27 32.809 22.031 26.320
193 HG3 GLU 27 HG3 GLU 27 32.067 22.838 27.688
194 H CYS 28 H CYS 28 29.215 20.821 23.998
195 HA CYS 28 HA CYS 28 27.518 22.379 22.225
196 HB2 CYS 28 HB2 CYS 28 27.577 19.968 22.068
197 HB3 CYS 28 HB3 CYS 28 27.126 19.795 23.761
198 H LYS 29 H LYS 29 25.763 23.578 22.675
199 HA LYS 29 HA LYS 29 24.479 23.474 25.346
200 HB2 LYS 29 HB2 LYS 29 25.988 25.423 25.390
201 HB3 LYS 29 HB3 LYS 29 25.281 26.025 23.898
202 HG2 LYS 29 HG2 LYS 29 24.490 27.265 25.865
203 HG3 LYS 29 HG3 LYS 29 23.174 26.504 24.985
204 HD2 LYS 29 HD2 LYS 29 22.814 26.330 27.388
205 HD3 LYS 29 HD3 LYS 29 23.021 24.731 26.684
206 HE2 LYS 29 HE2 LYS 29 25.478 24.846 27.406
207 HE3 LYS 29 HE3 LYS 29 25.053 26.315 28.300
208 HZ1 LYS 29 HZ1 LYS 29 23.372 24.940 29.497
209 HZ2 LYS 29 HZ2 LYS 29 23.902 23.607 28.698
210 HZ3 LYS 29 HZ3 LYS 29 24.907 24.417 29.742
211 H CYS 30 H CYS 30 22.275 23.507 25.297
212 HA CYS 30 HA CYS 30 20.791 23.746 22.776
213 HB2 CYS 30 HB2 CYS 30 20.080 22.638 25.493
214 HB3 CYS 30 HB3 CYS 30 19.262 22.434 23.956
215 H VAL 31 H VAL 31 19.632 25.578 22.487
216 HA VAL 31 HA VAL 31 18.874 27.137 24.909
217 HB VAL 31 HB VAL 31 18.766 29.144 23.635
218 HG11 VAL 31 HG11 VAL 31 21.189 29.572 23.539
219 HG12 VAL 31 HG12 VAL 31 20.772 28.617 24.974
220 HG13 VAL 31 HG13 VAL 31 21.517 27.835 23.558
221 HG21 VAL 31 HG21 VAL 31 19.948 29.323 21.438
222 HG22 VAL 31 HG22 VAL 31 20.171 27.558 21.428
223 HG23 VAL 31 HG23 VAL 31 18.537 28.256 21.323
224 HA PRO 32 HA PRO 32 15.028 25.890 24.075
225 HB2 PRO 32 HB2 PRO 32 13.340 27.782 25.264
226 HB3 PRO 32 HB3 PRO 32 14.226 26.446 26.069
227 HG2 PRO 32 HG2 PRO 32 15.015 29.340 25.826
228 HG3 PRO 32 HG3 PRO 32 15.245 28.233 27.207
229 HD2 PRO 32 HD2 PRO 32 17.296 28.819 25.529
230 HD3 PRO 32 HD3 PRO 32 17.090 27.142 26.137
231 H TYR 33 H TYR 33 14.017 25.567 22.372
232 HA TYR 33 HA TYR 33 12.949 27.848 20.729
233 HB2 TYR 33 HB2 TYR 33 14.685 25.650 19.869
234 HB3 TYR 33 HB3 TYR 33 13.289 25.935 18.841
235 HD1 TYR 33 HD2 TYR 33 15.962 27.891 20.632
236 HD2 TYR 33 HD1 TYR 33 13.451 27.568 17.145
237 HE1 TYR 33 HE2 TYR 33 16.998 29.958 19.699
238 HE2 TYR 33 HE1 TYR 33 14.469 29.638 16.212
239 HH TYR 33 HH TYR 33 15.948 31.357 16.562
Start of MODEL 3
1 H1 GLY 1 H1 GLY 1 41.948 28.869 21.532
2 H2 GLY 1 H2 GLY 1 43.173 27.785 21.716
3 H3 GLY 1 H3 GLY 1 42.616 28.657 23.014
4 HA2 GLY 1 HA2 GLY 1 40.478 27.591 22.883
5 HA3 GLY 1 HA3 GLY 1 41.100 26.624 21.538
6 H SER 2 H SER 2 40.112 25.222 23.504
7 HA SER 2 HA SER 2 42.474 24.011 24.891
8 HB2 SER 2 HB2 SER 2 41.248 23.681 26.884
9 HB3 SER 2 HB3 SER 2 41.020 25.375 26.424
10 HG SER 2 HG SER 2 38.988 24.532 25.367
11 H ALA 3 H ALA 3 39.411 23.464 23.221
12 HA ALA 3 HA ALA 3 40.016 20.642 22.744
13 HB1 ALA 3 HB1 ALA 3 37.623 21.503 24.440
14 HB2 ALA 3 HB2 ALA 3 38.022 19.839 23.932
15 HB3 ALA 3 HB3 ALA 3 39.070 20.683 25.063
16 H PHE 4 H PHE 4 37.995 19.626 21.558
17 HA PHE 4 HA PHE 4 36.954 21.637 19.586
18 HB2 PHE 4 HB2 PHE 4 38.694 19.919 18.885
19 HB3 PHE 4 HB3 PHE 4 37.463 18.697 19.098
20 HD1 PHE 4 HD1 PHE 4 35.503 18.610 17.527
21 HD2 PHE 4 HD2 PHE 4 38.652 21.519 17.055
22 HE1 PHE 4 HE1 PHE 4 34.688 19.120 15.232
23 HE2 PHE 4 HE2 PHE 4 37.845 22.033 14.763
24 HZ PHE 4 HZ PHE 4 35.848 20.845 13.861
25 H CYS 5 H CYS 5 34.828 21.496 18.794
26 HA CYS 5 HA CYS 5 32.965 19.494 19.977
27 HB2 CYS 5 HB2 CYS 5 31.315 21.337 20.036
28 HB3 CYS 5 HB3 CYS 5 32.665 21.584 21.138
29 H ASN 6 H ASN 6 31.201 18.919 18.789
30 HA ASN 6 HA ASN 6 30.931 19.706 15.903
31 HB2 ASN 6 HB2 ASN 6 30.943 17.116 16.792
32 HB3 ASN 6 HB3 ASN 6 29.362 17.544 17.353
33 HD21 ASN 6 HD22 ASN 6 31.399 16.989 14.507
34 HD22 ASN 6 HD21 ASN 6 30.076 17.147 13.345
35 H LEU 7 H LEU 7 28.724 19.983 15.172
36 HA LEU 7 HA LEU 7 26.926 21.221 17.185
37 HB2 LEU 7 HB2 LEU 7 28.573 22.770 15.904
38 HB3 LEU 7 HB3 LEU 7 27.591 22.393 14.473
39 HG LEU 7 HG LEU 7 26.123 23.159 16.925
40 HD11 LEU 7 HD11 LEU 7 26.446 25.570 16.410
41 HD12 LEU 7 HD12 LEU 7 27.995 24.801 16.838
42 HD13 LEU 7 HD13 LEU 7 27.602 25.135 15.148
43 HD21 LEU 7 HD21 LEU 7 25.830 23.998 14.000
44 HD22 LEU 7 HD22 LEU 7 24.897 22.704 14.755
45 HD23 LEU 7 HD23 LEU 7 24.707 24.351 15.328
46 H ARG 8 H ARG 8 27.218 19.639 13.999
47 HA ARG 8 HA ARG 8 24.383 19.269 13.644
48 HB2 ARG 8 HB2 ARG 8 26.054 18.714 11.907
49 HB3 ARG 8 HB3 ARG 8 26.676 17.390 12.900
50 HG2 ARG 8 HG2 ARG 8 24.471 16.243 12.759
51 HG3 ARG 8 HG3 ARG 8 23.827 17.593 11.806
52 HD2 ARG 8 HD2 ARG 8 25.607 17.173 10.101
53 HD3 ARG 8 HD3 ARG 8 26.136 15.766 11.040
54 HE ARG 8 HE ARG 8 23.748 14.887 10.689
55 HH11 ARG 8 HH21 ARG 8 25.169 16.942 8.138
56 HH12 ARG 8 HH22 ARG 8 24.460 15.875 6.927
57 HH21 ARG 8 HH11 ARG 8 22.752 13.917 9.046
58 HH22 ARG 8 HH12 ARG 8 23.068 14.433 7.387
59 H ALA 9 H ALA 9 26.758 17.170 15.341
60 HA ALA 9 HA ALA 9 24.878 15.383 16.524
61 HB1 ALA 9 HB1 ALA 9 27.740 16.160 17.244
62 HB2 ALA 9 HB2 ALA 9 26.865 14.743 17.866
63 HB3 ALA 9 HB3 ALA 9 27.251 14.871 16.139
64 H CYS 10 H CYS 10 26.027 18.616 17.464
65 HA CYS 10 HA CYS 10 24.918 18.504 20.148
66 HB2 CYS 10 HB2 CYS 10 26.668 20.146 19.233
67 HB3 CYS 10 HB3 CYS 10 25.304 20.949 18.433
68 H GLU 11 H GLU 11 23.773 20.003 17.036
69 HA GLU 11 HA GLU 11 21.220 20.668 17.784
70 HB2 GLU 11 HB2 GLU 11 22.305 19.701 15.141
71 HB3 GLU 11 HB3 GLU 11 20.639 20.175 15.324
72 HG2 GLU 11 HG2 GLU 11 22.671 22.124 16.377
73 HG3 GLU 11 HG3 GLU 11 22.661 21.850 14.643
74 H LEU 12 H LEU 12 22.355 17.423 16.683
75 HA LEU 12 HA LEU 12 19.862 16.062 16.821
76 HB2 LEU 12 HB2 LEU 12 22.600 14.865 17.479
77 HB3 LEU 12 HB3 LEU 12 21.151 14.006 17.012
78 HG LEU 12 HG LEU 12 23.035 15.560 15.241
79 HD11 LEU 12 HD11 LEU 12 23.185 13.455 14.075
80 HD12 LEU 12 HD12 LEU 12 23.565 13.241 15.791
81 HD13 LEU 12 HD13 LEU 12 21.981 12.735 15.165
82 HD21 LEU 12 HD21 LEU 12 21.509 15.093 13.357
83 HD22 LEU 12 HD22 LEU 12 20.279 14.511 14.498
84 HD23 LEU 12 HD23 LEU 12 20.779 16.222 14.503
85 H SER 13 H SER 13 22.288 16.738 19.295
86 HA SER 13 HA SER 13 20.976 15.123 21.337
87 HB2 SER 13 HB2 SER 13 23.289 17.075 21.618
88 HB3 SER 13 HB3 SER 13 22.790 15.844 22.795
89 HG SER 13 HG SER 13 23.925 15.522 20.215
90 H CYS 14 H CYS 14 20.763 18.404 20.316
91 HA CYS 14 HA CYS 14 19.320 19.263 22.738
92 HB2 CYS 14 HB2 CYS 14 20.154 20.709 20.206
93 HB3 CYS 14 HB3 CYS 14 19.282 21.446 21.570
94 H ARG 15 H ARG 15 18.568 18.217 19.429
95 HA ARG 15 HA ARG 15 15.797 18.780 19.349
96 HB2 ARG 15 HB2 ARG 15 17.561 17.449 17.717
97 HB3 ARG 15 HB3 ARG 15 16.824 16.067 18.491
98 HG2 ARG 15 HG2 ARG 15 15.277 16.236 16.851
99 HG3 ARG 15 HG3 ARG 15 14.583 17.540 17.802
100 HD2 ARG 15 HD2 ARG 15 16.552 17.753 15.486
101 HD3 ARG 15 HD3 ARG 15 14.859 18.253 15.470
102 HE ARG 15 HE ARG 15 15.570 19.926 17.306
103 HH11 ARG 15 HH11 ARG 15 17.495 19.249 14.420
104 HH12 ARG 15 HH12 ARG 15 18.416 20.713 14.656
105 HH21 ARG 15 HH21 ARG 15 17.042 21.566 17.635
106 HH22 ARG 15 HH22 ARG 15 18.295 21.871 16.439
107 H SER 16 H SER 16 17.585 16.525 21.302
108 HA SER 16 HA SER 16 15.575 14.848 22.280
109 HB2 SER 16 HB2 SER 16 17.927 15.892 23.894
110 HB3 SER 16 HB3 SER 16 17.071 14.357 24.102
111 HG SER 16 HG SER 16 19.046 14.113 22.985
112 H LEU 17 H LEU 17 16.326 18.263 23.292
113 HA LEU 17 HA LEU 17 14.185 18.081 25.253
114 HB2 LEU 17 HB2 LEU 17 15.054 20.349 25.949
115 HB3 LEU 17 HB3 LEU 17 15.552 18.814 26.645
116 HG LEU 17 HG LEU 17 17.009 20.186 24.462
117 HD11 LEU 17 HD11 LEU 17 16.888 21.545 26.704
118 HD12 LEU 17 HD12 LEU 17 17.633 20.153 27.488
119 HD13 LEU 17 HD13 LEU 17 18.546 21.074 26.279
120 HD21 LEU 17 HD21 LEU 17 17.576 17.793 25.975
121 HD22 LEU 17 HD22 LEU 17 17.986 18.300 24.307
122 HD23 LEU 17 HD23 LEU 17 18.959 18.923 25.623
123 H GLY 18 H GLY 18 14.347 18.574 22.114
124 HA2 GLY 18 HA2 GLY 18 13.059 19.671 20.588
125 HA3 GLY 18 HA3 GLY 18 12.180 20.499 21.875
126 H LEU 19 H LEU 19 15.636 20.815 22.017
127 HA LEU 19 HA LEU 19 15.375 23.728 21.567
128 HB2 LEU 19 HB2 LEU 19 17.577 21.986 22.649
129 HB3 LEU 19 HB3 LEU 19 17.733 23.728 22.541
130 HG LEU 19 HG LEU 19 16.545 22.078 24.552
131 HD11 LEU 19 HD11 LEU 19 16.649 24.049 26.032
132 HD12 LEU 19 HD12 LEU 19 18.169 23.744 25.280
133 HD13 LEU 19 HD13 LEU 19 17.133 25.034 24.655
134 HD21 LEU 19 HD21 LEU 19 14.396 22.551 23.853
135 HD22 LEU 19 HD22 LEU 19 14.678 23.564 25.232
136 HD23 LEU 19 HD23 LEU 19 14.742 24.249 23.600
137 H LEU 20 H LEU 20 17.475 24.724 20.870
138 HA LEU 20 HA LEU 20 18.268 23.808 18.124
139 HB2 LEU 20 HB2 LEU 20 17.248 26.111 18.356
140 HB3 LEU 20 HB3 LEU 20 18.509 26.492 19.515
141 HG LEU 20 HG LEU 20 20.213 26.057 17.633
142 HD11 LEU 20 HD11 LEU 20 17.683 26.293 15.948
143 HD12 LEU 20 HD12 LEU 20 19.352 26.267 15.341
144 HD13 LEU 20 HD13 LEU 20 18.665 24.828 16.106
145 HD21 LEU 20 HD21 LEU 20 18.205 28.316 17.338
146 HD22 LEU 20 HD22 LEU 20 19.647 28.318 18.372
147 HD23 LEU 20 HD23 LEU 20 19.822 28.275 16.604
148 H GLY 21 H GLY 21 20.385 23.142 17.848
149 HA2 GLY 21 HA2 GLY 21 22.165 23.081 20.217
150 HA3 GLY 21 HA3 GLY 21 22.414 22.239 18.708
151 H LYS 22 H LYS 22 23.794 24.359 20.530
152 HA LYS 22 HA LYS 22 25.325 25.615 18.292
153 HB2 LYS 22 HB2 LYS 22 24.789 26.772 21.077
154 HB3 LYS 22 HB3 LYS 22 25.849 27.488 19.876
155 HG2 LYS 22 HG2 LYS 22 22.839 27.204 19.647
156 HG3 LYS 22 HG3 LYS 22 23.761 28.661 20.059
157 HD2 LYS 22 HD2 LYS 22 24.908 28.456 17.801
158 HD3 LYS 22 HD3 LYS 22 23.716 27.193 17.402
159 HE2 LYS 22 HE2 LYS 22 21.872 28.766 17.740
160 HE3 LYS 22 HE3 LYS 22 22.968 29.976 18.417
161 HZ1 LYS 22 HZ1 LYS 22 24.013 30.175 16.236
162 HZ2 LYS 22 HZ2 LYS 22 22.937 29.087 15.589
163 HZ3 LYS 22 HZ3 LYS 22 22.417 30.512 16.154
164 H CYS 23 H CYS 23 27.525 25.738 18.629
165 HA CYS 23 HA CYS 23 28.612 24.410 21.102
166 HB2 CYS 23 HB2 CYS 23 29.615 23.411 19.198
167 HB3 CYS 23 HB3 CYS 23 30.055 24.992 18.522
168 H ILE 24 H ILE 24 29.170 25.666 22.714
169 HA ILE 24 HA ILE 24 30.225 28.407 22.243
170 HB ILE 24 HB ILE 24 28.099 27.746 24.313
171 HG12 ILE 24 HG12 ILE 24 27.897 29.377 21.735
172 HG13 ILE 24 HG13 ILE 24 27.101 27.832 22.073
173 HG21 ILE 24 HG21 ILE 24 29.385 30.423 23.593
174 HG22 ILE 24 HG22 ILE 24 28.171 30.141 24.858
175 HG23 ILE 24 HG23 ILE 24 29.775 29.472 25.043
176 HD11 ILE 24 HD11 ILE 24 25.852 28.917 23.946
177 HD12 ILE 24 HD12 ILE 24 26.499 30.487 23.391
178 HD13 ILE 24 HD13 ILE 24 25.462 29.528 22.320
179 H GLY 25 H GLY 25 32.047 28.704 23.305
180 HA2 GLY 25 HA2 GLY 25 33.877 28.346 24.650
181 HA3 GLY 25 HA3 GLY 25 32.774 27.697 25.871
182 H GLU 26 H GLU 26 33.366 26.378 22.613
183 HA GLU 26 HA GLU 26 33.979 24.332 21.828
184 HB2 GLU 26 HB2 GLU 26 35.842 24.223 24.199
185 HB3 GLU 26 HB3 GLU 26 35.950 23.265 22.726
186 HG2 GLU 26 HG2 GLU 26 36.367 25.223 21.354
187 HG3 GLU 26 HG3 GLU 26 36.073 26.318 22.710
188 H GLU 27 H GLU 27 31.767 24.499 23.885
189 HA GLU 27 HA GLU 27 31.347 21.583 24.286
190 HB2 GLU 27 HB2 GLU 27 30.913 23.880 26.219
191 HB3 GLU 27 HB3 GLU 27 30.065 22.349 26.381
192 HG2 GLU 27 HG2 GLU 27 33.115 22.577 26.318
193 HG3 GLU 27 HG3 GLU 27 32.166 22.568 27.786
194 H CYS 28 H CYS 28 29.188 20.878 24.203
195 HA CYS 28 HA CYS 28 27.540 22.353 22.301
196 HB2 CYS 28 HB2 CYS 28 27.783 19.983 22.025
197 HB3 CYS 28 HB3 CYS 28 27.319 19.679 23.707
198 H LYS 29 H LYS 29 25.800 23.542 22.708
199 HA LYS 29 HA LYS 29 24.412 23.463 25.338
200 HB2 LYS 29 HB2 LYS 29 25.201 25.909 23.696
201 HB3 LYS 29 HB3 LYS 29 24.110 25.940 25.065
202 HG2 LYS 29 HG2 LYS 29 27.068 25.216 25.172
203 HG3 LYS 29 HG3 LYS 29 26.334 26.749 25.684
204 HD2 LYS 29 HD2 LYS 29 25.023 25.511 27.411
205 HD3 LYS 29 HD3 LYS 29 25.808 24.009 26.933
206 HE2 LYS 29 HE2 LYS 29 28.039 25.158 27.416
207 HE3 LYS 29 HE3 LYS 29 27.105 26.489 28.142
208 HZ1 LYS 29 HZ1 LYS 29 26.085 24.774 29.607
209 HZ2 LYS 29 HZ2 LYS 29 27.107 23.647 28.982
210 HZ3 LYS 29 HZ3 LYS 29 27.712 24.922 29.856
211 H CYS 30 H CYS 30 22.187 23.534 25.261
212 HA CYS 30 HA CYS 30 20.794 23.625 22.667
213 HB2 CYS 30 HB2 CYS 30 19.929 22.623 25.352
214 HB3 CYS 30 HB3 CYS 30 19.214 22.376 23.780
215 H VAL 31 H VAL 31 19.949 25.539 22.238
216 HA VAL 31 HA VAL 31 19.120 27.249 24.529
217 HB VAL 31 HB VAL 31 19.100 29.157 23.156
218 HG11 VAL 31 HG11 VAL 31 21.812 27.753 23.022
219 HG12 VAL 31 HG12 VAL 31 21.529 29.501 22.968
220 HG13 VAL 31 HG13 VAL 31 21.148 28.595 24.436
221 HG21 VAL 31 HG21 VAL 31 20.233 29.115 20.888
222 HG22 VAL 31 HG22 VAL 31 20.275 27.337 20.993
223 HG23 VAL 31 HG23 VAL 31 18.719 28.194 20.922
224 HA PRO 32 HA PRO 32 15.164 26.207 23.707
225 HB2 PRO 32 HB2 PRO 32 13.733 28.603 24.330
226 HB3 PRO 32 HB3 PRO 32 14.131 27.202 25.373
227 HG2 PRO 32 HG2 PRO 32 15.564 29.813 25.085
228 HG3 PRO 32 HG3 PRO 32 15.440 28.757 26.522
229 HD2 PRO 32 HD2 PRO 32 17.700 28.920 25.015
230 HD3 PRO 32 HD3 PRO 32 17.200 27.327 25.684
231 H TYR 33 H TYR 33 14.064 25.760 22.030
232 HA TYR 33 HA TYR 33 13.376 27.644 19.836
233 HB2 TYR 33 HB2 TYR 33 12.119 25.092 20.889
234 HB3 TYR 33 HB3 TYR 33 11.310 26.125 19.733
235 HD1 TYR 33 HD1 TYR 33 14.987 25.771 19.204
236 HD2 TYR 33 HD2 TYR 33 11.050 24.198 18.348
237 HE1 TYR 33 HE1 TYR 33 15.916 24.342 17.371
238 HE2 TYR 33 HE2 TYR 33 12.004 22.734 16.583
239 HH TYR 33 HH TYR 33 13.892 21.919 15.678
Start of MODEL 4
1 H1 GLY 1 H1 GLY 1 43.442 21.200 22.926
2 H2 GLY 1 H2 GLY 1 42.734 22.676 22.697
3 H3 GLY 1 H3 GLY 1 41.854 21.295 22.458
4 HA2 GLY 1 HA2 GLY 1 42.960 22.139 25.049
5 HA3 GLY 1 HA3 GLY 1 41.288 22.418 24.532
6 H SER 2 H SER 2 40.784 21.192 26.519
7 HA SER 2 HA SER 2 41.670 18.443 26.847
8 HB2 SER 2 HB2 SER 2 40.328 18.559 28.907
9 HB3 SER 2 HB3 SER 2 41.370 19.986 28.728
10 HG SER 2 HG SER 2 39.371 20.759 29.275
11 H ALA 3 H ALA 3 38.894 19.772 25.219
12 HA ALA 3 HA ALA 3 37.908 17.066 24.698
13 HB1 ALA 3 HB1 ALA 3 36.648 17.835 26.715
14 HB2 ALA 3 HB2 ALA 3 36.099 19.259 25.799
15 HB3 ALA 3 HB3 ALA 3 35.596 17.637 25.292
16 H PHE 4 H PHE 4 36.246 16.998 23.006
17 HA PHE 4 HA PHE 4 36.501 19.213 21.005
18 HB2 PHE 4 HB2 PHE 4 36.069 16.250 20.517
19 HB3 PHE 4 HB3 PHE 4 36.138 17.500 19.279
20 HD1 PHE 4 HD1 PHE 4 38.337 19.043 19.355
21 HD2 PHE 4 HD2 PHE 4 38.058 15.016 20.870
22 HE1 PHE 4 HE1 PHE 4 40.799 18.806 19.168
23 HE2 PHE 4 HE2 PHE 4 40.517 14.765 20.640
24 HZ PHE 4 HZ PHE 4 41.894 16.664 19.799
25 H CYS 5 H CYS 5 34.665 19.618 19.581
26 HA CYS 5 HA CYS 5 32.040 18.537 20.362
27 HB2 CYS 5 HB2 CYS 5 32.204 20.324 21.912
28 HB3 CYS 5 HB3 CYS 5 32.820 21.435 20.697
29 H ASN 6 H ASN 6 30.568 18.521 18.819
30 HA ASN 6 HA ASN 6 30.907 20.003 16.229
31 HB2 ASN 6 HB2 ASN 6 31.273 17.357 16.130
32 HB3 ASN 6 HB3 ASN 6 29.650 17.258 16.640
33 HD21 ASN 6 HD22 ASN 6 31.700 18.302 13.983
34 HD22 ASN 6 HD21 ASN 6 30.400 18.313 12.782
35 H LEU 7 H LEU 7 29.039 20.608 15.224
36 HA LEU 7 HA LEU 7 26.957 21.363 17.177
37 HB2 LEU 7 HB2 LEU 7 28.430 23.015 15.856
38 HB3 LEU 7 HB3 LEU 7 27.488 22.550 14.441
39 HG LEU 7 HG LEU 7 25.997 23.293 16.893
40 HD11 LEU 7 HD11 LEU 7 26.082 25.681 16.201
41 HD12 LEU 7 HD12 LEU 7 27.699 25.101 16.632
42 HD13 LEU 7 HD13 LEU 7 27.251 25.265 14.935
43 HD21 LEU 7 HD21 LEU 7 24.428 24.279 15.264
44 HD22 LEU 7 HD22 LEU 7 25.547 23.930 13.934
45 HD23 LEU 7 HD23 LEU 7 24.734 22.621 14.785
46 H ARG 8 H ARG 8 27.226 19.804 13.945
47 HA ARG 8 HA ARG 8 24.371 19.350 13.762
48 HB2 ARG 8 HB2 ARG 8 26.018 18.853 11.898
49 HB3 ARG 8 HB3 ARG 8 26.524 17.423 12.818
50 HG2 ARG 8 HG2 ARG 8 23.998 16.802 12.866
51 HG3 ARG 8 HG3 ARG 8 23.783 18.037 11.633
52 HD2 ARG 8 HD2 ARG 8 25.155 16.807 10.082
53 HD3 ARG 8 HD3 ARG 8 25.734 15.716 11.370
54 HE ARG 8 HE ARG 8 22.870 15.642 11.206
55 HH11 ARG 8 HH21 ARG 8 25.646 14.415 9.432
56 HH12 ARG 8 HH22 ARG 8 24.711 13.106 8.735
57 HH21 ARG 8 HH11 ARG 8 21.833 13.838 10.481
58 HH22 ARG 8 HH12 ARG 8 22.664 12.650 9.509
59 H ALA 9 H ALA 9 26.956 17.547 15.430
60 HA ALA 9 HA ALA 9 25.433 15.510 16.656
61 HB1 ALA 9 HB1 ALA 9 27.965 15.701 16.410
62 HB2 ALA 9 HB2 ALA 9 27.916 16.903 17.716
63 HB3 ALA 9 HB3 ALA 9 27.393 15.241 18.032
64 H CYS 10 H CYS 10 26.290 18.839 17.755
65 HA CYS 10 HA CYS 10 24.989 18.673 20.286
66 HB2 CYS 10 HB2 CYS 10 26.649 20.436 19.377
67 HB3 CYS 10 HB3 CYS 10 25.272 21.163 18.569
68 H GLU 11 H GLU 11 23.881 20.046 17.158
69 HA GLU 11 HA GLU 11 21.307 20.787 17.749
70 HB2 GLU 11 HB2 GLU 11 22.762 19.830 15.313
71 HB3 GLU 11 HB3 GLU 11 21.030 19.827 15.198
72 HG2 GLU 11 HG2 GLU 11 22.392 22.305 16.273
73 HG3 GLU 11 HG3 GLU 11 22.432 21.973 14.542
74 H LEU 12 H LEU 12 22.287 17.556 16.559
75 HA LEU 12 HA LEU 12 19.613 16.517 16.762
76 HB2 LEU 12 HB2 LEU 12 20.571 14.481 15.861
77 HB3 LEU 12 HB3 LEU 12 21.216 15.874 15.039
78 HG LEU 12 HG LEU 12 23.290 15.592 16.623
79 HD11 LEU 12 HD11 LEU 12 23.757 13.230 17.213
80 HD12 LEU 12 HD12 LEU 12 22.443 13.900 18.167
81 HD13 LEU 12 HD13 LEU 12 22.082 12.812 16.810
82 HD21 LEU 12 HD21 LEU 12 23.253 15.135 14.156
83 HD22 LEU 12 HD22 LEU 12 24.303 14.004 15.025
84 HD23 LEU 12 HD23 LEU 12 22.686 13.490 14.490
85 H SER 13 H SER 13 22.063 16.897 19.109
86 HA SER 13 HA SER 13 20.934 14.863 20.941
87 HB2 SER 13 HB2 SER 13 23.174 16.850 21.421
88 HB3 SER 13 HB3 SER 13 22.670 15.525 22.491
89 HG SER 13 HG SER 13 23.945 15.462 19.990
90 H CYS 14 H CYS 14 21.104 18.419 20.595
91 HA CYS 14 HA CYS 14 19.532 19.079 22.940
92 HB2 CYS 14 HB2 CYS 14 20.177 20.515 20.340
93 HB3 CYS 14 HB3 CYS 14 19.277 21.251 21.665
94 H ARG 15 H ARG 15 18.703 17.964 19.743
95 HA ARG 15 HA ARG 15 16.014 18.645 19.491
96 HB2 ARG 15 HB2 ARG 15 17.824 17.177 18.061
97 HB3 ARG 15 HB3 ARG 15 16.986 15.842 18.832
98 HG2 ARG 15 HG2 ARG 15 15.959 16.201 16.710
99 HG3 ARG 15 HG3 ARG 15 14.829 16.806 17.924
100 HD2 ARG 15 HD2 ARG 15 14.860 18.446 16.203
101 HD3 ARG 15 HD3 ARG 15 15.797 19.124 17.527
102 HE ARG 15 HE ARG 15 17.024 17.908 15.082
103 HH11 ARG 15 HH11 ARG 15 17.066 20.581 17.427
104 HH12 ARG 15 HH12 ARG 15 18.320 21.379 16.506
105 HH21 ARG 15 HH21 ARG 15 18.407 19.059 13.996
106 HH22 ARG 15 HH22 ARG 15 18.895 20.678 14.532
107 H SER 16 H SER 16 17.448 16.342 21.701
108 HA SER 16 HA SER 16 15.113 14.940 22.410
109 HB2 SER 16 HB2 SER 16 17.497 15.550 24.187
110 HB3 SER 16 HB3 SER 16 16.313 14.248 24.418
111 HG SER 16 HG SER 16 17.968 13.282 23.372
112 H LEU 17 H LEU 17 16.151 18.207 23.430
113 HA LEU 17 HA LEU 17 14.120 18.454 25.557
114 HB2 LEU 17 HB2 LEU 17 16.061 20.270 24.165
115 HB3 LEU 17 HB3 LEU 17 15.056 20.774 25.543
116 HG LEU 17 HG LEU 17 17.071 18.595 25.734
117 HD11 LEU 17 HD11 LEU 17 18.360 20.502 25.053
118 HD12 LEU 17 HD12 LEU 17 17.762 21.408 26.483
119 HD13 LEU 17 HD13 LEU 17 18.739 19.950 26.684
120 HD21 LEU 17 HD21 LEU 17 15.899 20.571 27.737
121 HD22 LEU 17 HD22 LEU 17 15.335 18.897 27.565
122 HD23 LEU 17 HD23 LEU 17 16.969 19.209 28.173
123 H GLY 18 H GLY 18 14.101 18.518 22.176
124 HA2 GLY 18 HA2 GLY 18 12.842 19.590 20.542
125 HA3 GLY 18 HA3 GLY 18 12.041 20.578 21.768
126 H LEU 19 H LEU 19 15.512 20.636 22.137
127 HA LEU 19 HA LEU 19 15.405 23.522 21.549
128 HB2 LEU 19 HB2 LEU 19 17.554 21.806 22.735
129 HB3 LEU 19 HB3 LEU 19 17.711 23.539 22.520
130 HG LEU 19 HG LEU 19 16.759 22.100 24.687
131 HD11 LEU 19 HD11 LEU 19 16.517 24.200 25.927
132 HD12 LEU 19 HD12 LEU 19 18.067 23.960 25.204
133 HD13 LEU 19 HD13 LEU 19 16.901 25.060 24.439
134 HD21 LEU 19 HD21 LEU 19 14.583 23.918 23.637
135 HD22 LEU 19 HD22 LEU 19 14.456 22.208 23.924
136 HD23 LEU 19 HD23 LEU 19 14.647 23.276 25.286
137 H LEU 20 H LEU 20 17.395 24.474 20.759
138 HA LEU 20 HA LEU 20 18.300 23.285 18.158
139 HB2 LEU 20 HB2 LEU 20 17.073 25.567 18.247
140 HB3 LEU 20 HB3 LEU 20 18.512 26.162 19.072
141 HG LEU 20 HG LEU 20 19.810 25.238 16.971
142 HD11 LEU 20 HD11 LEU 20 16.977 25.527 15.836
143 HD12 LEU 20 HD12 LEU 20 18.464 25.211 14.918
144 HD13 LEU 20 HD13 LEU 20 17.848 23.986 16.023
145 HD21 LEU 20 HD21 LEU 20 19.450 27.326 15.768
146 HD22 LEU 20 HD22 LEU 20 17.928 27.594 16.634
147 HD23 LEU 20 HD23 LEU 20 19.461 27.656 17.516
148 H GLY 21 H GLY 21 20.489 22.910 17.906
149 HA2 GLY 21 HA2 GLY 21 22.179 23.065 20.331
150 HA3 GLY 21 HA3 GLY 21 22.546 22.188 18.859
151 H LYS 22 H LYS 22 23.816 24.295 20.628
152 HA LYS 22 HA LYS 22 25.280 25.668 18.416
153 HB2 LYS 22 HB2 LYS 22 24.740 26.741 21.243
154 HB3 LYS 22 HB3 LYS 22 25.757 27.528 20.044
155 HG2 LYS 22 HG2 LYS 22 22.764 27.091 19.865
156 HG3 LYS 22 HG3 LYS 22 23.600 28.608 20.229
157 HD2 LYS 22 HD2 LYS 22 24.572 28.648 17.971
158 HD3 LYS 22 HD3 LYS 22 23.793 27.095 17.603
159 HE2 LYS 22 HE2 LYS 22 21.559 28.160 18.059
160 HE3 LYS 22 HE3 LYS 22 22.382 29.714 18.277
161 HZ1 LYS 22 HZ1 LYS 22 23.206 29.510 16.011
162 HZ2 LYS 22 HZ2 LYS 22 22.375 28.092 15.791
163 HZ3 LYS 22 HZ3 LYS 22 21.580 29.536 16.033
164 H CYS 23 H CYS 23 27.401 25.672 18.581
165 HA CYS 23 HA CYS 23 28.663 23.952 20.723
166 HB2 CYS 23 HB2 CYS 23 28.310 22.562 18.751
167 HB3 CYS 23 HB3 CYS 23 29.126 23.764 17.751
168 H ILE 24 H ILE 24 29.670 25.495 21.841
169 HA ILE 24 HA ILE 24 31.080 27.704 20.493
170 HB ILE 24 HB ILE 24 30.798 27.280 23.485
171 HG12 ILE 24 HG12 ILE 24 29.111 29.313 22.914
172 HG13 ILE 24 HG13 ILE 24 28.919 28.451 21.410
173 HG21 ILE 24 HG21 ILE 24 32.616 28.840 22.729
174 HG22 ILE 24 HG22 ILE 24 31.429 29.732 21.758
175 HG23 ILE 24 HG23 ILE 24 31.302 29.704 23.529
176 HD11 ILE 24 HD11 ILE 24 27.192 27.858 23.091
177 HD12 ILE 24 HD12 ILE 24 28.155 26.430 22.685
178 HD13 ILE 24 HD13 ILE 24 28.456 27.301 24.207
179 H GLY 25 H GLY 25 32.255 26.124 19.497
180 HA2 GLY 25 HA2 GLY 25 34.156 25.158 18.827
181 HA3 GLY 25 HA3 GLY 25 35.018 25.921 20.156
182 H GLU 26 H GLU 26 33.935 24.686 22.124
183 HA GLU 26 HA GLU 26 34.844 21.813 21.993
184 HB2 GLU 26 HB2 GLU 26 35.593 23.888 24.073
185 HB3 GLU 26 HB3 GLU 26 36.230 22.247 23.938
186 HG2 GLU 26 HG2 GLU 26 37.248 22.818 21.747
187 HG3 GLU 26 HG3 GLU 26 36.656 24.480 21.886
188 H GLU 27 H GLU 27 32.228 23.638 22.820
189 HA GLU 27 HA GLU 27 31.239 21.733 24.869
190 HB2 GLU 27 HB2 GLU 27 32.442 24.059 25.662
191 HB3 GLU 27 HB3 GLU 27 30.797 24.638 25.487
192 HG2 GLU 27 HG2 GLU 27 31.522 22.145 27.095
193 HG3 GLU 27 HG3 GLU 27 31.631 23.761 27.771
194 H CYS 28 H CYS 28 29.107 21.283 24.644
195 HA CYS 28 HA CYS 28 27.592 22.648 22.472
196 HB2 CYS 28 HB2 CYS 28 27.905 20.344 22.044
197 HB3 CYS 28 HB3 CYS 28 27.536 19.902 23.707
198 H LYS 29 H LYS 29 25.820 23.840 22.897
199 HA LYS 29 HA LYS 29 24.303 23.498 25.452
200 HB2 LYS 29 HB2 LYS 29 25.101 26.053 24.006
201 HB3 LYS 29 HB3 LYS 29 24.057 25.995 25.410
202 HG2 LYS 29 HG2 LYS 29 26.931 24.946 25.567
203 HG3 LYS 29 HG3 LYS 29 26.569 26.659 25.623
204 HD2 LYS 29 HD2 LYS 29 26.816 25.916 27.849
205 HD3 LYS 29 HD3 LYS 29 25.152 26.381 27.571
206 HE2 LYS 29 HE2 LYS 29 25.122 24.494 28.966
207 HE3 LYS 29 HE3 LYS 29 24.527 23.949 27.404
208 HZ1 LYS 29 HZ1 LYS 29 26.640 22.864 27.026
209 HZ2 LYS 29 HZ2 LYS 29 27.376 23.604 28.245
210 HZ3 LYS 29 HZ3 LYS 29 26.211 22.472 28.555
211 H CYS 30 H CYS 30 22.011 23.788 25.333
212 HA CYS 30 HA CYS 30 20.771 23.743 22.665
213 HB2 CYS 30 HB2 CYS 30 19.882 22.795 25.366
214 HB3 CYS 30 HB3 CYS 30 19.202 22.448 23.801
215 H VAL 31 H VAL 31 19.607 25.462 22.096
216 HA VAL 31 HA VAL 31 18.630 27.281 24.237
217 HB VAL 31 HB VAL 31 18.622 29.102 22.724
218 HG11 VAL 31 HG11 VAL 31 21.025 29.563 22.767
219 HG12 VAL 31 HG12 VAL 31 20.529 28.732 24.254
220 HG13 VAL 31 HG13 VAL 31 21.382 27.833 22.971
221 HG21 VAL 31 HG21 VAL 31 18.535 28.002 20.528
222 HG22 VAL 31 HG22 VAL 31 20.003 28.993 20.616
223 HG23 VAL 31 HG23 VAL 31 20.119 27.236 20.817
224 HA PRO 32 HA PRO 32 14.882 25.870 23.411
225 HB2 PRO 32 HB2 PRO 32 13.095 27.869 24.189
226 HB3 PRO 32 HB3 PRO 32 13.976 26.720 25.239
227 HG2 PRO 32 HG2 PRO 32 14.735 29.551 24.516
228 HG3 PRO 32 HG3 PRO 32 14.880 28.726 26.095
229 HD2 PRO 32 HD2 PRO 32 17.042 29.005 24.513
230 HD3 PRO 32 HD3 PRO 32 16.769 27.418 25.323
231 H TYR 33 H TYR 33 14.053 25.243 21.720
232 HA TYR 33 HA TYR 33 12.783 27.123 19.760
233 HB2 TYR 33 HB2 TYR 33 14.735 24.968 19.241
234 HB3 TYR 33 HB3 TYR 33 13.338 24.967 18.194
235 HD1 TYR 33 HD2 TYR 33 15.727 27.469 19.672
236 HD2 TYR 33 HD1 TYR 33 13.434 26.234 16.231
237 HE1 TYR 33 HE2 TYR 33 16.639 29.407 18.379
238 HE2 TYR 33 HE1 TYR 33 14.416 28.116 14.904
239 HH TYR 33 HH TYR 33 16.792 30.388 16.339
Start of MODEL 5
1 H1 GLY 1 H1 GLY 1 35.769 20.500 25.068
2 H2 GLY 1 H2 GLY 1 35.265 22.027 25.394
3 H3 GLY 1 H3 GLY 1 34.369 20.772 25.910
4 HA2 GLY 1 HA2 GLY 1 37.086 21.457 26.827
5 HA3 GLY 1 HA3 GLY 1 35.589 21.751 27.734
6 H SER 2 H SER 2 34.229 19.833 28.143
7 HA SER 2 HA SER 2 35.550 17.571 29.328
8 HB2 SER 2 HB2 SER 2 33.284 16.781 29.646
9 HB3 SER 2 HB3 SER 2 33.347 18.506 29.996
10 HG SER 2 HG SER 2 32.452 18.893 27.881
11 H ALA 3 H ALA 3 33.970 18.117 26.192
12 HA ALA 3 HA ALA 3 35.416 15.821 25.004
13 HB1 ALA 3 HB1 ALA 3 33.331 15.150 23.832
14 HB2 ALA 3 HB2 ALA 3 33.142 15.028 25.591
15 HB3 ALA 3 HB3 ALA 3 32.428 16.401 24.714
16 H PHE 4 H PHE 4 35.406 15.959 22.624
17 HA PHE 4 HA PHE 4 35.921 18.532 21.443
18 HB2 PHE 4 HB2 PHE 4 36.881 16.428 20.625
19 HB3 PHE 4 HB3 PHE 4 35.281 15.797 20.283
20 HD1 PHE 4 HD2 PHE 4 34.004 16.531 18.297
21 HD2 PHE 4 HD1 PHE 4 37.948 18.071 19.128
22 HE1 PHE 4 HE2 PHE 4 34.143 17.423 15.990
23 HE2 PHE 4 HE1 PHE 4 38.083 18.951 16.807
24 HZ PHE 4 HZ PHE 4 36.175 18.643 15.240
25 H CYS 5 H CYS 5 34.646 19.790 20.005
26 HA CYS 5 HA CYS 5 31.705 19.474 20.450
27 HB2 CYS 5 HB2 CYS 5 33.336 21.574 20.957
28 HB3 CYS 5 HB3 CYS 5 32.800 22.014 19.351
29 H ASN 6 H ASN 6 30.334 19.047 18.835
30 HA ASN 6 HA ASN 6 30.815 20.216 16.192
31 HB2 ASN 6 HB2 ASN 6 31.228 17.415 16.515
32 HB3 ASN 6 HB3 ASN 6 29.570 17.528 15.974
33 HD21 ASN 6 HD22 ASN 6 29.790 16.769 13.879
34 HD22 ASN 6 HD21 ASN 6 30.897 17.499 12.716
35 H LEU 7 H LEU 7 28.884 20.613 15.015
36 HA LEU 7 HA LEU 7 26.812 21.334 17.015
37 HB2 LEU 7 HB2 LEU 7 28.282 23.013 15.714
38 HB3 LEU 7 HB3 LEU 7 27.307 22.559 14.304
39 HG LEU 7 HG LEU 7 25.825 23.236 16.772
40 HD11 LEU 7 HD11 LEU 7 25.973 25.663 16.213
41 HD12 LEU 7 HD12 LEU 7 27.569 25.012 16.634
42 HD13 LEU 7 HD13 LEU 7 27.143 25.287 14.944
43 HD21 LEU 7 HD21 LEU 7 24.583 22.680 14.636
44 HD22 LEU 7 HD22 LEU 7 24.288 24.324 15.185
45 HD23 LEU 7 HD23 LEU 7 25.411 24.024 13.849
46 H ARG 8 H ARG 8 27.149 19.829 13.791
47 HA ARG 8 HA ARG 8 24.377 19.106 13.644
48 HB2 ARG 8 HB2 ARG 8 25.827 18.585 11.776
49 HB3 ARG 8 HB3 ARG 8 26.765 17.437 12.760
50 HG2 ARG 8 HG2 ARG 8 24.807 16.041 13.106
51 HG3 ARG 8 HG3 ARG 8 23.750 17.242 12.347
52 HD2 ARG 8 HD2 ARG 8 24.920 16.754 10.165
53 HD3 ARG 8 HD3 ARG 8 25.860 15.522 11.024
54 HE ARG 8 HE ARG 8 24.034 14.132 11.165
55 HH11 ARG 8 HH11 ARG 8 22.769 17.267 10.119
56 HH12 ARG 8 HH12 ARG 8 21.169 16.598 9.861
57 HH21 ARG 8 HH21 ARG 8 22.026 13.350 10.515
58 HH22 ARG 8 HH22 ARG 8 20.721 14.503 10.342
59 H ALA 9 H ALA 9 27.014 17.462 15.439
60 HA ALA 9 HA ALA 9 25.532 15.486 16.766
61 HB1 ALA 9 HB1 ALA 9 27.969 15.519 16.635
62 HB2 ALA 9 HB2 ALA 9 28.029 17.005 17.600
63 HB3 ALA 9 HB3 ALA 9 27.448 15.496 18.327
64 H CYS 10 H CYS 10 26.300 18.858 17.783
65 HA CYS 10 HA CYS 10 24.899 18.769 20.235
66 HB2 CYS 10 HB2 CYS 10 26.581 20.478 19.275
67 HB3 CYS 10 HB3 CYS 10 25.203 21.207 18.456
68 H GLU 11 H GLU 11 23.795 19.963 17.011
69 HA GLU 11 HA GLU 11 21.178 20.591 17.627
70 HB2 GLU 11 HB2 GLU 11 22.564 19.625 15.138
71 HB3 GLU 11 HB3 GLU 11 20.820 19.697 15.123
72 HG2 GLU 11 HG2 GLU 11 22.335 22.109 16.130
73 HG3 GLU 11 HG3 GLU 11 22.292 21.803 14.402
74 H LEU 12 H LEU 12 22.416 17.358 16.642
75 HA LEU 12 HA LEU 12 19.811 16.112 16.995
76 HB2 LEU 12 HB2 LEU 12 20.792 14.113 16.108
77 HB3 LEU 12 HB3 LEU 12 21.196 15.513 15.141
78 HG LEU 12 HG LEU 12 23.470 15.470 16.443
79 HD11 LEU 12 HD11 LEU 12 22.554 12.630 16.908
80 HD12 LEU 12 HD12 LEU 12 24.232 13.202 17.044
81 HD13 LEU 12 HD13 LEU 12 23.009 13.831 18.140
82 HD21 LEU 12 HD21 LEU 12 23.107 14.931 14.014
83 HD22 LEU 12 HD22 LEU 12 24.415 13.981 14.745
84 HD23 LEU 12 HD23 LEU 12 22.818 13.246 14.465
85 H SER 13 H SER 13 21.971 17.036 19.245
86 HA SER 13 HA SER 13 21.048 14.958 21.185
87 HB2 SER 13 HB2 SER 13 23.160 17.103 21.567
88 HB3 SER 13 HB3 SER 13 22.707 15.830 22.717
89 HG SER 13 HG SER 13 24.022 15.644 20.225
90 H CYS 14 H CYS 14 21.012 18.472 20.527
91 HA CYS 14 HA CYS 14 19.329 19.126 22.794
92 HB2 CYS 14 HB2 CYS 14 20.126 20.662 20.298
93 HB3 CYS 14 HB3 CYS 14 19.233 21.346 21.663
94 H ARG 15 H ARG 15 18.590 18.035 19.543
95 HA ARG 15 HA ARG 15 15.887 18.769 19.279
96 HB2 ARG 15 HB2 ARG 15 17.615 17.238 17.823
97 HB3 ARG 15 HB3 ARG 15 16.759 15.947 18.631
98 HG2 ARG 15 HG2 ARG 15 15.348 16.132 16.867
99 HG3 ARG 15 HG3 ARG 15 14.625 17.451 17.791
100 HD2 ARG 15 HD2 ARG 15 16.730 17.641 15.595
101 HD3 ARG 15 HD3 ARG 15 15.038 18.138 15.458
102 HE ARG 15 HE ARG 15 15.647 19.821 17.329
103 HH11 ARG 15 HH11 ARG 15 17.737 19.093 14.576
104 HH12 ARG 15 HH12 ARG 15 18.558 20.649 14.754
105 HH21 ARG 15 HH21 ARG 15 17.036 21.536 17.657
106 HH22 ARG 15 HH22 ARG 15 18.265 21.897 16.462
107 H SER 16 H SER 16 17.321 16.601 21.553
108 HA SER 16 HA SER 16 15.199 15.005 22.388
109 HB2 SER 16 HB2 SER 16 16.372 14.849 24.511
110 HB3 SER 16 HB3 SER 16 17.516 14.785 23.143
111 HG SER 16 HG SER 16 18.434 16.500 23.817
112 H LEU 17 H LEU 17 16.022 18.319 23.547
113 HA LEU 17 HA LEU 17 13.752 18.564 25.359
114 HB2 LEU 17 HB2 LEU 17 15.816 20.339 24.100
115 HB3 LEU 17 HB3 LEU 17 14.658 20.940 25.324
116 HG LEU 17 HG LEU 17 16.709 18.831 25.808
117 HD11 LEU 17 HD11 LEU 17 18.021 20.776 25.505
118 HD12 LEU 17 HD12 LEU 17 17.030 21.665 26.713
119 HD13 LEU 17 HD13 LEU 17 18.012 20.275 27.187
120 HD21 LEU 17 HD21 LEU 17 14.699 18.886 27.362
121 HD22 LEU 17 HD22 LEU 17 16.165 19.422 28.228
122 HD23 LEU 17 HD23 LEU 17 15.022 20.629 27.599
123 H GLY 18 H GLY 18 14.068 18.632 21.994
124 HA2 GLY 18 HA2 GLY 18 13.175 19.806 20.242
125 HA3 GLY 18 HA3 GLY 18 11.974 20.527 21.329
126 H LEU 19 H LEU 19 15.574 20.712 21.813
127 HA LEU 19 HA LEU 19 15.351 23.698 21.556
128 HB2 LEU 19 HB2 LEU 19 17.501 21.957 22.712
129 HB3 LEU 19 HB3 LEU 19 17.661 23.694 22.578
130 HG LEU 19 HG LEU 19 16.557 22.116 24.582
131 HD11 LEU 19 HD11 LEU 19 16.515 24.064 26.047
132 HD12 LEU 19 HD12 LEU 19 18.045 23.834 25.277
133 HD13 LEU 19 HD13 LEU 19 16.928 25.074 24.673
134 HD21 LEU 19 HD21 LEU 19 14.626 24.214 23.602
135 HD22 LEU 19 HD22 LEU 19 14.305 22.514 23.809
136 HD23 LEU 19 HD23 LEU 19 14.543 23.508 25.224
137 H LEU 20 H LEU 20 17.422 24.690 20.903
138 HA LEU 20 HA LEU 20 18.309 23.763 18.188
139 HB2 LEU 20 HB2 LEU 20 17.244 26.077 18.477
140 HB3 LEU 20 HB3 LEU 20 18.556 26.455 19.571
141 HG LEU 20 HG LEU 20 20.154 25.960 17.592
142 HD11 LEU 20 HD11 LEU 20 18.473 24.822 16.127
143 HD12 LEU 20 HD12 LEU 20 17.532 26.321 16.059
144 HD13 LEU 20 HD13 LEU 20 19.155 26.259 15.352
145 HD21 LEU 20 HD21 LEU 20 18.205 28.297 17.448
146 HD22 LEU 20 HD22 LEU 20 19.696 28.226 18.415
147 HD23 LEU 20 HD23 LEU 20 19.785 28.206 16.645
148 H GLY 21 H GLY 21 20.449 23.142 17.950
149 HA2 GLY 21 HA2 GLY 21 22.174 23.085 20.377
150 HA3 GLY 21 HA3 GLY 21 22.419 22.180 18.890
151 H LYS 22 H LYS 22 23.837 24.368 20.650
152 HA LYS 22 HA LYS 22 25.355 25.545 18.380
153 HB2 LYS 22 HB2 LYS 22 24.566 26.979 20.962
154 HB3 LYS 22 HB3 LYS 22 25.720 27.602 19.785
155 HG2 LYS 22 HG2 LYS 22 22.773 27.090 19.271
156 HG3 LYS 22 HG3 LYS 22 23.549 28.661 19.557
157 HD2 LYS 22 HD2 LYS 22 24.876 28.393 17.487
158 HD3 LYS 22 HD3 LYS 22 24.144 26.806 17.233
159 HE2 LYS 22 HE2 LYS 22 23.071 28.354 15.777
160 HE3 LYS 22 HE3 LYS 22 21.919 27.803 16.992
161 HZ1 LYS 22 HZ1 LYS 22 23.383 30.390 17.164
162 HZ2 LYS 22 HZ2 LYS 22 21.839 30.226 16.582
163 HZ3 LYS 22 HZ3 LYS 22 22.184 29.914 18.145
164 H CYS 23 H CYS 23 27.438 25.575 18.506
165 HA CYS 23 HA CYS 23 28.764 24.214 20.830
166 HB2 CYS 23 HB2 CYS 23 28.513 23.423 18.121
167 HB3 CYS 23 HB3 CYS 23 30.189 23.818 18.365
168 H ILE 24 H ILE 24 29.239 26.115 21.805
169 HA ILE 24 HA ILE 24 31.195 27.983 20.507
170 HB ILE 24 HB ILE 24 29.189 28.602 22.703
171 HG12 ILE 24 HG12 ILE 24 29.135 29.379 19.748
172 HG13 ILE 24 HG13 ILE 24 28.069 28.208 20.526
173 HG21 ILE 24 HG21 ILE 24 31.058 30.437 21.129
174 HG22 ILE 24 HG22 ILE 24 29.881 30.949 22.360
175 HG23 ILE 24 HG23 ILE 24 31.251 29.979 22.840
176 HD11 ILE 24 HD11 ILE 24 28.110 31.194 21.005
177 HD12 ILE 24 HD12 ILE 24 26.815 30.198 20.324
178 HD13 ILE 24 HD13 ILE 24 27.233 30.032 22.036
179 H GLY 25 H GLY 25 33.110 28.341 21.504
180 HA2 GLY 25 HA2 GLY 25 34.830 28.177 23.013
181 HA3 GLY 25 HA3 GLY 25 33.632 28.060 24.304
182 H GLU 26 H GLU 26 33.842 25.755 21.651
183 HA GLU 26 HA GLU 26 34.025 23.587 21.510
184 HB2 GLU 26 HB2 GLU 26 36.181 23.741 23.615
185 HB3 GLU 26 HB3 GLU 26 35.863 22.368 22.554
186 HG2 GLU 26 HG2 GLU 26 36.296 23.847 20.572
187 HG3 GLU 26 HG3 GLU 26 36.787 25.134 21.685
188 H GLU 27 H GLU 27 32.006 24.612 23.541
189 HA GLU 27 HA GLU 27 31.336 21.846 24.467
190 HB2 GLU 27 HB2 GLU 27 31.188 24.432 26.032
191 HB3 GLU 27 HB3 GLU 27 30.043 23.150 26.347
192 HG2 GLU 27 HG2 GLU 27 33.071 22.854 26.507
193 HG3 GLU 27 HG3 GLU 27 31.995 23.102 27.879
194 H CYS 28 H CYS 28 29.270 21.144 24.171
195 HA CYS 28 HA CYS 28 27.557 22.670 22.353
196 HB2 CYS 28 HB2 CYS 28 27.823 20.333 21.925
197 HB3 CYS 28 HB3 CYS 28 27.453 19.913 23.594
198 H LYS 29 H LYS 29 25.737 23.762 22.872
199 HA LYS 29 HA LYS 29 24.380 23.363 25.500
200 HB2 LYS 29 HB2 LYS 29 24.987 26.024 24.139
201 HB3 LYS 29 HB3 LYS 29 24.040 25.816 25.596
202 HG2 LYS 29 HG2 LYS 29 27.001 25.110 25.364
203 HG3 LYS 29 HG3 LYS 29 26.394 26.656 25.931
204 HD2 LYS 29 HD2 LYS 29 25.484 25.693 27.920
205 HD3 LYS 29 HD3 LYS 29 25.648 24.049 27.292
206 HE2 LYS 29 HE2 LYS 29 27.382 24.516 28.957
207 HE3 LYS 29 HE3 LYS 29 28.069 24.148 27.375
208 HZ1 LYS 29 HZ1 LYS 29 27.774 26.905 28.489
209 HZ2 LYS 29 HZ2 LYS 29 29.152 26.065 28.484
210 HZ3 LYS 29 HZ3 LYS 29 28.498 26.524 27.059
211 H CYS 30 H CYS 30 22.064 23.486 25.418
212 HA CYS 30 HA CYS 30 20.763 23.610 22.780
213 HB2 CYS 30 HB2 CYS 30 19.794 22.586 25.420
214 HB3 CYS 30 HB3 CYS 30 19.148 22.338 23.832
215 H VAL 31 H VAL 31 19.646 25.406 22.330
216 HA VAL 31 HA VAL 31 18.802 27.120 24.610
217 HB VAL 31 HB VAL 31 18.967 29.068 23.292
218 HG11 VAL 31 HG11 VAL 31 21.601 27.530 23.224
219 HG12 VAL 31 HG12 VAL 31 21.389 29.287 23.281
220 HG13 VAL 31 HG13 VAL 31 20.902 28.294 24.668
221 HG21 VAL 31 HG21 VAL 31 20.208 29.034 21.116
222 HG22 VAL 31 HG22 VAL 31 20.181 27.266 21.142
223 HG23 VAL 31 HG23 VAL 31 18.656 28.188 21.012
224 HA PRO 32 HA PRO 32 14.903 26.196 23.612
225 HB2 PRO 32 HB2 PRO 32 13.387 28.384 24.490
226 HB3 PRO 32 HB3 PRO 32 14.006 27.011 25.453
227 HG2 PRO 32 HG2 PRO 32 15.193 29.748 25.095
228 HG3 PRO 32 HG3 PRO 32 15.172 28.708 26.557
229 HD2 PRO 32 HD2 PRO 32 17.399 28.931 25.032
230 HD3 PRO 32 HD3 PRO 32 16.935 27.323 25.699
231 H TYR 33 H TYR 33 14.023 25.821 21.878
232 HA TYR 33 HA TYR 33 13.638 27.453 19.525
233 HB2 TYR 33 HB2 TYR 33 12.346 25.004 20.685
234 HB3 TYR 33 HB3 TYR 33 11.406 25.891 19.527
235 HD1 TYR 33 HD1 TYR 33 15.136 25.535 19.236
236 HD2 TYR 33 HD2 TYR 33 11.223 24.301 17.886
237 HE1 TYR 33 HE1 TYR 33 16.163 24.251 17.337
238 HE2 TYR 33 HE2 TYR 33 12.255 23.032 16.026
239 HH TYR 33 HH TYR 33 14.183 22.162 15.263
Start of MODEL 6
1 H1 GLY 1 H1 GLY 1 39.241 21.272 23.595
2 H2 GLY 1 H2 GLY 1 39.421 20.908 25.198
3 H3 GLY 1 H3 GLY 1 39.995 19.877 24.063
4 HA2 GLY 1 HA2 GLY 1 40.978 22.607 24.552
5 HA3 GLY 1 HA3 GLY 1 41.800 21.107 25.033
6 H SER 2 H SER 2 41.152 23.323 22.452
7 HA SER 2 HA SER 2 42.071 23.669 20.429
8 HB2 SER 2 HB2 SER 2 44.315 21.848 21.345
9 HB3 SER 2 HB3 SER 2 44.375 22.985 19.990
10 HG SER 2 HG SER 2 45.302 23.757 21.953
11 H ALA 3 H ALA 3 40.221 21.273 20.684
12 HA ALA 3 HA ALA 3 41.082 19.796 18.236
13 HB1 ALA 3 HB1 ALA 3 41.588 18.547 20.293
14 HB2 ALA 3 HB2 ALA 3 39.894 18.681 20.809
15 HB3 ALA 3 HB3 ALA 3 40.322 17.734 19.364
16 H PHE 4 H PHE 4 38.858 21.807 19.189
17 HA PHE 4 HA PHE 4 36.875 22.559 18.494
18 HB2 PHE 4 HB2 PHE 4 38.056 21.341 16.099
19 HB3 PHE 4 HB3 PHE 4 36.321 21.525 16.008
20 HD1 PHE 4 HD1 PHE 4 39.354 23.524 17.065
21 HD2 PHE 4 HD2 PHE 4 35.435 23.554 15.252
22 HE1 PHE 4 HE1 PHE 4 39.590 25.949 16.573
23 HE2 PHE 4 HE2 PHE 4 35.689 25.969 14.753
24 HZ PHE 4 HZ PHE 4 37.753 27.172 15.418
25 H CYS 5 H CYS 5 34.657 22.282 17.852
26 HA CYS 5 HA CYS 5 33.462 19.781 18.966
27 HB2 CYS 5 HB2 CYS 5 33.319 21.625 20.452
28 HB3 CYS 5 HB3 CYS 5 32.769 22.722 19.201
29 H ASN 6 H ASN 6 31.585 18.921 18.098
30 HA ASN 6 HA ASN 6 30.730 19.816 15.371
31 HB2 ASN 6 HB2 ASN 6 31.250 17.251 16.127
32 HB3 ASN 6 HB3 ASN 6 29.694 17.366 16.816
33 HD21 ASN 6 HD22 ASN 6 31.522 17.506 13.805
34 HD22 ASN 6 HD21 ASN 6 30.162 17.118 12.767
35 H LEU 7 H LEU 7 28.653 20.210 14.795
36 HA LEU 7 HA LEU 7 26.773 20.877 16.989
37 HB2 LEU 7 HB2 LEU 7 28.168 22.711 15.523
38 HB3 LEU 7 HB3 LEU 7 26.856 22.366 14.377
39 HG LEU 7 HG LEU 7 25.242 22.713 16.354
40 HD11 LEU 7 HD11 LEU 7 25.998 23.752 18.285
41 HD12 LEU 7 HD12 LEU 7 27.211 22.519 18.069
42 HD13 LEU 7 HD13 LEU 7 27.595 24.166 17.563
43 HD21 LEU 7 HD21 LEU 7 26.957 25.066 15.456
44 HD22 LEU 7 HD22 LEU 7 25.541 24.405 14.607
45 HD23 LEU 7 HD23 LEU 7 25.340 25.163 16.189
46 H ARG 8 H ARG 8 26.984 19.537 13.758
47 HA ARG 8 HA ARG 8 24.191 18.786 13.648
48 HB2 ARG 8 HB2 ARG 8 25.583 18.342 11.742
49 HB3 ARG 8 HB3 ARG 8 26.649 17.299 12.673
50 HG2 ARG 8 HG2 ARG 8 25.221 15.990 11.220
51 HG3 ARG 8 HG3 ARG 8 24.892 15.611 12.906
52 HD2 ARG 8 HD2 ARG 8 22.811 16.987 12.802
53 HD3 ARG 8 HD3 ARG 8 23.186 17.394 11.115
54 HE ARG 8 HE ARG 8 23.003 14.505 11.797
55 HH11 ARG 8 HH11 ARG 8 21.060 17.143 10.485
56 HH12 ARG 8 HH12 ARG 8 20.127 16.011 9.532
57 HH21 ARG 8 HH22 ARG 8 21.801 13.253 10.630
58 HH22 ARG 8 HH21 ARG 8 20.632 13.889 9.469
59 H ALA 9 H ALA 9 26.882 17.226 15.428
60 HA ALA 9 HA ALA 9 25.481 15.137 16.683
61 HB1 ALA 9 HB1 ALA 9 27.884 16.729 17.667
62 HB2 ALA 9 HB2 ALA 9 27.449 15.068 18.119
63 HB3 ALA 9 HB3 ALA 9 27.999 15.433 16.465
64 H CYS 10 H CYS 10 26.040 18.508 17.637
65 HA CYS 10 HA CYS 10 24.805 18.225 20.241
66 HB2 CYS 10 HB2 CYS 10 26.575 19.906 19.489
67 HB3 CYS 10 HB3 CYS 10 25.246 20.781 18.708
68 H GLU 11 H GLU 11 23.745 19.650 17.084
69 HA GLU 11 HA GLU 11 21.205 20.441 17.873
70 HB2 GLU 11 HB2 GLU 11 22.373 19.557 15.220
71 HB3 GLU 11 HB3 GLU 11 20.651 19.886 15.342
72 HG2 GLU 11 HG2 GLU 11 22.586 21.950 16.407
73 HG3 GLU 11 HG3 GLU 11 22.315 21.812 14.680
74 H LEU 12 H LEU 12 22.249 17.200 16.593
75 HA LEU 12 HA LEU 12 19.645 16.017 16.899
76 HB2 LEU 12 HB2 LEU 12 20.671 13.959 16.256
77 HB3 LEU 12 HB3 LEU 12 21.232 15.274 15.246
78 HG LEU 12 HG LEU 12 23.333 15.295 16.799
79 HD11 LEU 12 HD11 LEU 12 23.936 13.036 17.665
80 HD12 LEU 12 HD12 LEU 12 22.637 13.791 18.573
81 HD13 LEU 12 HD13 LEU 12 22.257 12.526 17.383
82 HD21 LEU 12 HD21 LEU 12 23.309 14.558 14.423
83 HD22 LEU 12 HD22 LEU 12 24.393 13.540 15.390
84 HD23 LEU 12 HD23 LEU 12 22.780 12.941 14.938
85 H SER 13 H SER 13 21.962 16.832 19.232
86 HA SER 13 HA SER 13 20.783 14.993 21.242
87 HB2 SER 13 HB2 SER 13 23.100 16.941 21.514
88 HB3 SER 13 HB3 SER 13 22.507 15.836 22.762
89 HG SER 13 HG SER 13 23.835 15.270 20.341
90 H CYS 14 H CYS 14 20.519 18.274 20.143
91 HA CYS 14 HA CYS 14 19.034 19.131 22.551
92 HB2 CYS 14 HB2 CYS 14 19.985 20.652 20.105
93 HB3 CYS 14 HB3 CYS 14 19.174 21.360 21.509
94 H ARG 15 H ARG 15 18.364 18.321 19.161
95 HA ARG 15 HA ARG 15 15.609 19.051 19.011
96 HB2 ARG 15 HB2 ARG 15 17.264 18.150 17.231
97 HB3 ARG 15 HB3 ARG 15 16.907 16.542 17.864
98 HG2 ARG 15 HG2 ARG 15 14.455 16.988 17.247
99 HG3 ARG 15 HG3 ARG 15 15.008 18.509 16.505
100 HD2 ARG 15 HD2 ARG 15 16.722 17.035 15.219
101 HD3 ARG 15 HD3 ARG 15 15.752 15.657 15.761
102 HE ARG 15 HE ARG 15 13.960 17.444 14.498
103 HH11 ARG 15 HH11 ARG 15 16.530 15.219 13.615
104 HH12 ARG 15 HH12 ARG 15 16.037 15.214 11.936
105 HH21 ARG 15 HH21 ARG 15 13.429 17.373 12.314
106 HH22 ARG 15 HH22 ARG 15 14.383 16.375 11.248
107 H SER 16 H SER 16 17.244 16.520 20.770
108 HA SER 16 HA SER 16 15.069 14.875 21.528
109 HB2 SER 16 HB2 SER 16 17.643 15.556 23.001
110 HB3 SER 16 HB3 SER 16 16.541 14.248 23.451
111 HG SER 16 HG SER 16 18.291 13.526 22.127
112 H LEU 17 H LEU 17 16.004 18.131 22.759
113 HA LEU 17 HA LEU 17 14.008 18.027 24.942
114 HB2 LEU 17 HB2 LEU 17 16.073 19.954 23.924
115 HB3 LEU 17 HB3 LEU 17 14.985 20.336 25.277
116 HG LEU 17 HG LEU 17 16.874 18.058 25.349
117 HD11 LEU 17 HD11 LEU 17 18.519 19.238 26.564
118 HD12 LEU 17 HD12 LEU 17 18.277 19.989 24.987
119 HD13 LEU 17 HD13 LEU 17 17.600 20.744 26.466
120 HD21 LEU 17 HD21 LEU 17 15.630 19.848 27.494
121 HD22 LEU 17 HD22 LEU 17 14.993 18.249 27.073
122 HD23 LEU 17 HD23 LEU 17 16.588 18.387 27.835
123 H GLY 18 H GLY 18 14.026 18.709 21.594
124 HA2 GLY 18 HA2 GLY 18 12.860 20.146 20.196
125 HA3 GLY 18 HA3 GLY 18 11.928 20.755 21.566
126 H LEU 19 H LEU 19 15.441 20.818 21.859
127 HA LEU 19 HA LEU 19 15.404 23.803 21.930
128 HB2 LEU 19 HB2 LEU 19 17.474 21.765 22.715
129 HB3 LEU 19 HB3 LEU 19 17.732 23.488 22.841
130 HG LEU 19 HG LEU 19 16.720 21.706 24.689
131 HD11 LEU 19 HD11 LEU 19 16.575 23.652 26.298
132 HD12 LEU 19 HD12 LEU 19 18.109 23.245 25.631
133 HD13 LEU 19 HD13 LEU 19 17.202 24.626 24.968
134 HD21 LEU 19 HD21 LEU 19 14.640 23.823 24.112
135 HD22 LEU 19 HD22 LEU 19 14.418 22.095 24.048
136 HD23 LEU 19 HD23 LEU 19 14.692 22.849 25.590
137 H LEU 20 H LEU 20 17.583 24.657 21.254
138 HA LEU 20 HA LEU 20 18.353 23.752 18.492
139 HB2 LEU 20 HB2 LEU 20 17.272 26.085 18.893
140 HB3 LEU 20 HB3 LEU 20 18.771 26.490 19.709
141 HG LEU 20 HG LEU 20 19.968 25.778 17.521
142 HD11 LEU 20 HD11 LEU 20 18.057 24.594 16.470
143 HD12 LEU 20 HD12 LEU 20 17.093 26.086 16.504
144 HD13 LEU 20 HD13 LEU 20 18.543 25.967 15.480
145 HD21 LEU 20 HD21 LEU 20 19.529 27.959 16.454
146 HD22 LEU 20 HD22 LEU 20 18.097 28.180 17.467
147 HD23 LEU 20 HD23 LEU 20 19.703 28.136 18.215
148 H GLY 21 H GLY 21 20.404 22.997 18.265
149 HA2 GLY 21 HA2 GLY 21 22.257 23.006 20.571
150 HA3 GLY 21 HA3 GLY 21 22.445 22.118 19.062
151 H LYS 22 H LYS 22 23.671 24.517 20.846
152 HA LYS 22 HA LYS 22 25.232 25.708 18.587
153 HB2 LYS 22 HB2 LYS 22 24.106 27.180 21.035
154 HB3 LYS 22 HB3 LYS 22 25.237 27.886 19.884
155 HG2 LYS 22 HG2 LYS 22 22.454 26.901 19.206
156 HG3 LYS 22 HG3 LYS 22 22.910 28.586 19.551
157 HD2 LYS 22 HD2 LYS 22 24.489 28.483 17.615
158 HD3 LYS 22 HD3 LYS 22 23.852 26.860 17.243
159 HE2 LYS 22 HE2 LYS 22 21.700 27.696 16.710
160 HE3 LYS 22 HE3 LYS 22 21.954 29.203 17.610
161 HZ1 LYS 22 HZ1 LYS 22 23.506 29.911 15.896
162 HZ2 LYS 22 HZ2 LYS 22 23.264 28.552 15.030
163 HZ3 LYS 22 HZ3 LYS 22 22.010 29.612 15.263
164 H CYS 23 H CYS 23 27.248 25.622 18.831
165 HA CYS 23 HA CYS 23 28.444 24.933 21.493
166 HB2 CYS 23 HB2 CYS 23 28.575 23.241 19.606
167 HB3 CYS 23 HB3 CYS 23 29.824 24.280 18.900
168 H ILE 24 H ILE 24 29.819 26.103 22.496
169 HA ILE 24 HA ILE 24 31.474 28.121 21.067
170 HB ILE 24 HB ILE 24 29.852 28.830 23.536
171 HG12 ILE 24 HG12 ILE 24 29.349 29.589 20.621
172 HG13 ILE 24 HG13 ILE 24 28.317 28.576 21.640
173 HG21 ILE 24 HG21 ILE 24 31.545 30.543 21.653
174 HG22 ILE 24 HG22 ILE 24 30.680 31.115 23.091
175 HG23 ILE 24 HG23 ILE 24 32.037 30.032 23.288
176 HD11 ILE 24 HD11 ILE 24 28.018 30.540 23.178
177 HD12 ILE 24 HD12 ILE 24 28.792 31.525 21.904
178 HD13 ILE 24 HD13 ILE 24 27.281 30.671 21.563
179 H GLY 25 H GLY 25 33.478 28.011 21.638
180 HA2 GLY 25 HA2 GLY 25 35.429 27.763 22.815
181 HA3 GLY 25 HA3 GLY 25 34.509 27.785 24.317
182 H GLU 26 H GLU 26 34.306 25.533 21.577
183 HA GLU 26 HA GLU 26 34.313 23.322 21.331
184 HB2 GLU 26 HB2 GLU 26 36.248 23.177 23.643
185 HB3 GLU 26 HB3 GLU 26 35.872 21.871 22.529
186 HG2 GLU 26 HG2 GLU 26 36.801 23.141 20.653
187 HG3 GLU 26 HG3 GLU 26 37.207 24.481 21.747
188 H GLU 27 H GLU 27 32.621 24.597 23.775
189 HA GLU 27 HA GLU 27 31.524 21.953 24.614
190 HB2 GLU 27 HB2 GLU 27 32.646 23.052 26.514
191 HB3 GLU 27 HB3 GLU 27 31.741 24.535 26.217
192 HG2 GLU 27 HG2 GLU 27 30.746 23.417 28.087
193 HG3 GLU 27 HG3 GLU 27 29.611 23.340 26.761
194 H CYS 28 H CYS 28 29.312 21.688 24.657
195 HA CYS 28 HA CYS 28 27.879 23.743 23.038
196 HB2 CYS 28 HB2 CYS 28 28.408 21.393 22.082
197 HB3 CYS 28 HB3 CYS 28 27.062 20.863 23.098
198 H LYS 29 H LYS 29 25.828 24.294 23.353
199 HA LYS 29 HA LYS 29 24.359 23.261 25.741
200 HB2 LYS 29 HB2 LYS 29 25.401 25.491 26.182
201 HB3 LYS 29 HB3 LYS 29 24.539 26.153 24.801
202 HG2 LYS 29 HG2 LYS 29 23.425 26.844 26.800
203 HG3 LYS 29 HG3 LYS 29 22.385 25.739 25.926
204 HD2 LYS 29 HD2 LYS 29 22.207 25.219 28.247
205 HD3 LYS 29 HD3 LYS 29 23.132 23.894 27.526
206 HE2 LYS 29 HE2 LYS 29 25.237 25.052 28.282
207 HE3 LYS 29 HE3 LYS 29 24.247 26.300 29.047
208 HZ1 LYS 29 HZ1 LYS 29 24.224 23.414 29.766
209 HZ2 LYS 29 HZ2 LYS 29 24.948 24.634 30.625
210 HZ3 LYS 29 HZ3 LYS 29 23.314 24.557 30.494
211 H CYS 30 H CYS 30 22.094 23.014 25.520
212 HA CYS 30 HA CYS 30 20.791 23.405 22.908
213 HB2 CYS 30 HB2 CYS 30 19.914 22.072 25.451
214 HB3 CYS 30 HB3 CYS 30 19.168 22.033 23.886
215 H VAL 31 H VAL 31 19.929 25.337 22.645
216 HA VAL 31 HA VAL 31 19.013 26.835 25.038
217 HB VAL 31 HB VAL 31 19.072 28.853 23.807
218 HG11 VAL 31 HG11 VAL 31 21.755 27.382 23.712
219 HG12 VAL 31 HG12 VAL 31 21.515 29.142 23.764
220 HG13 VAL 31 HG13 VAL 31 21.032 28.150 25.149
221 HG21 VAL 31 HG21 VAL 31 20.299 28.965 21.609
222 HG22 VAL 31 HG22 VAL 31 20.356 27.189 21.575
223 HG23 VAL 31 HG23 VAL 31 18.791 28.038 21.492
224 HA PRO 32 HA PRO 32 15.171 25.741 24.121
225 HB2 PRO 32 HB2 PRO 32 13.526 27.743 25.210
226 HB3 PRO 32 HB3 PRO 32 14.332 26.394 26.064
227 HG2 PRO 32 HG2 PRO 32 15.276 29.242 25.712
228 HG3 PRO 32 HG3 PRO 32 15.382 28.199 27.170
229 HD2 PRO 32 HD2 PRO 32 17.540 28.547 25.600
230 HD3 PRO 32 HD3 PRO 32 17.159 26.877 26.168
231 H TYR 33 H TYR 33 14.146 25.390 22.410
232 HA TYR 33 HA TYR 33 13.104 27.602 20.679
233 HB2 TYR 33 HB2 TYR 33 14.647 25.229 20.011
234 HB3 TYR 33 HB3 TYR 33 13.110 25.234 19.168
235 HD1 TYR 33 HD2 TYR 33 15.579 27.864 20.196
236 HD2 TYR 33 HD1 TYR 33 13.323 26.094 16.991
237 HE1 TYR 33 HE2 TYR 33 16.375 29.662 18.642
238 HE2 TYR 33 HE1 TYR 33 14.169 27.827 15.426
239 HH TYR 33 HH TYR 33 15.421 29.687 15.183
Start of MODEL 7
1 H1 GLY 1 H1 GLY 1 36.013 19.718 27.705
2 H2 GLY 1 H2 GLY 1 36.207 18.181 27.170
3 H3 GLY 1 H3 GLY 1 35.534 18.472 28.653
4 HA2 GLY 1 HA2 GLY 1 33.660 19.612 27.577
5 HA3 GLY 1 HA3 GLY 1 34.355 19.099 26.023
6 H SER 2 H SER 2 31.792 18.393 27.544
7 HA SER 2 HA SER 2 31.990 15.662 28.468
8 HB2 SER 2 HB2 SER 2 29.534 15.761 28.525
9 HB3 SER 2 HB3 SER 2 30.268 17.189 29.273
10 HG SER 2 HG SER 2 29.831 18.383 27.433
11 H ALA 3 H ALA 3 31.453 16.990 25.251
12 HA ALA 3 HA ALA 3 31.567 14.274 24.106
13 HB1 ALA 3 HB1 ALA 3 29.670 14.756 22.603
14 HB2 ALA 3 HB2 ALA 3 29.141 14.854 24.291
15 HB3 ALA 3 HB3 ALA 3 29.442 16.343 23.366
16 H PHE 4 H PHE 4 31.771 14.551 21.603
17 HA PHE 4 HA PHE 4 33.898 16.496 21.019
18 HB2 PHE 4 HB2 PHE 4 32.551 14.554 19.134
19 HB3 PHE 4 HB3 PHE 4 34.111 15.346 18.929
20 HD1 PHE 4 HD2 PHE 4 35.826 14.868 21.016
21 HD2 PHE 4 HD1 PHE 4 32.549 12.318 19.832
22 HE1 PHE 4 HE2 PHE 4 36.858 12.967 22.233
23 HE2 PHE 4 HE1 PHE 4 33.593 10.420 21.039
24 HZ PHE 4 HZ PHE 4 35.735 10.747 22.256
25 H CYS 5 H CYS 5 33.524 18.510 20.219
26 HA CYS 5 HA CYS 5 30.720 19.174 20.003
27 HB2 CYS 5 HB2 CYS 5 32.761 20.317 21.335
28 HB3 CYS 5 HB3 CYS 5 32.620 21.419 19.971
29 H ASN 6 H ASN 6 31.114 17.866 17.853
30 HA ASN 6 HA ASN 6 30.727 19.681 15.549
31 HB2 ASN 6 HB2 ASN 6 30.008 16.797 16.257
32 HB3 ASN 6 HB3 ASN 6 29.211 17.602 14.915
33 HD21 ASN 6 HD22 ASN 6 30.455 15.432 14.114
34 HD22 ASN 6 HD21 ASN 6 31.958 15.881 13.293
35 H LEU 7 H LEU 7 28.911 20.445 14.814
36 HA LEU 7 HA LEU 7 26.914 21.161 16.878
37 HB2 LEU 7 HB2 LEU 7 28.485 22.814 15.684
38 HB3 LEU 7 HB3 LEU 7 27.492 22.501 14.243
39 HG LEU 7 HG LEU 7 26.062 23.167 16.749
40 HD11 LEU 7 HD11 LEU 7 27.864 24.815 16.683
41 HD12 LEU 7 HD12 LEU 7 27.542 25.149 14.974
42 HD13 LEU 7 HD13 LEU 7 26.351 25.602 16.197
43 HD21 LEU 7 HD21 LEU 7 25.695 23.999 13.826
44 HD22 LEU 7 HD22 LEU 7 24.793 22.706 14.624
45 HD23 LEU 7 HD23 LEU 7 24.585 24.368 15.156
46 H ARG 8 H ARG 8 27.224 19.947 13.503
47 HA ARG 8 HA ARG 8 24.422 19.119 13.684
48 HB2 ARG 8 HB2 ARG 8 25.770 19.703 11.450
49 HB3 ARG 8 HB3 ARG 8 26.105 17.959 11.514
50 HG2 ARG 8 HG2 ARG 8 24.020 17.989 10.434
51 HG3 ARG 8 HG3 ARG 8 23.543 17.782 12.132
52 HD2 ARG 8 HD2 ARG 8 23.300 20.330 12.254
53 HD3 ARG 8 HD3 ARG 8 23.519 20.363 10.497
54 HE ARG 8 HE ARG 8 21.494 18.512 10.868
55 HH11 ARG 8 HH11 ARG 8 21.727 21.951 11.743
56 HH12 ARG 8 HH12 ARG 8 19.982 22.026 11.942
57 HH21 ARG 8 HH21 ARG 8 19.452 18.795 10.875
58 HH22 ARG 8 HH22 ARG 8 18.724 20.386 11.122
59 H ALA 9 H ALA 9 26.014 18.396 15.671
60 HA ALA 9 HA ALA 9 25.050 15.651 16.038
61 HB1 ALA 9 HB1 ALA 9 27.507 15.402 15.818
62 HB2 ALA 9 HB2 ALA 9 27.753 16.671 17.033
63 HB3 ALA 9 HB3 ALA 9 27.001 15.133 17.505
64 H CYS 10 H CYS 10 26.234 18.732 17.381
65 HA CYS 10 HA CYS 10 25.015 18.585 19.955
66 HB2 CYS 10 HB2 CYS 10 26.725 20.325 19.233
67 HB3 CYS 10 HB3 CYS 10 25.431 21.079 18.284
68 H GLU 11 H GLU 11 23.826 20.135 16.944
69 HA GLU 11 HA GLU 11 21.310 21.001 17.649
70 HB2 GLU 11 HB2 GLU 11 22.388 19.673 15.157
71 HB3 GLU 11 HB3 GLU 11 20.714 20.194 15.223
72 HG2 GLU 11 HG2 GLU 11 22.888 22.150 16.008
73 HG3 GLU 11 HG3 GLU 11 22.589 21.811 14.313
74 H LEU 12 H LEU 12 22.328 17.680 17.065
75 HA LEU 12 HA LEU 12 19.637 16.552 17.084
76 HB2 LEU 12 HB2 LEU 12 22.254 15.020 17.083
77 HB3 LEU 12 HB3 LEU 12 20.701 14.538 16.419
78 HG LEU 12 HG LEU 12 22.597 16.663 15.287
79 HD11 LEU 12 HD11 LEU 12 22.884 15.112 13.439
80 HD12 LEU 12 HD12 LEU 12 23.310 14.315 14.967
81 HD13 LEU 12 HD13 LEU 12 21.754 13.967 14.186
82 HD21 LEU 12 HD21 LEU 12 20.256 17.313 14.792
83 HD22 LEU 12 HD22 LEU 12 21.070 16.732 13.331
84 HD23 LEU 12 HD23 LEU 12 19.926 15.680 14.189
85 H SER 13 H SER 13 22.490 16.601 19.249
86 HA SER 13 HA SER 13 21.421 15.072 21.425
87 HB2 SER 13 HB2 SER 13 23.307 17.464 21.535
88 HB3 SER 13 HB3 SER 13 23.084 16.231 22.786
89 HG SER 13 HG SER 13 24.920 15.946 21.310
90 H CYS 14 H CYS 14 21.331 18.598 20.747
91 HA CYS 14 HA CYS 14 19.608 19.284 22.919
92 HB2 CYS 14 HB2 CYS 14 20.381 20.624 20.294
93 HB3 CYS 14 HB3 CYS 14 19.346 21.401 21.508
94 H ARG 15 H ARG 15 18.865 17.814 19.840
95 HA ARG 15 HA ARG 15 16.066 18.475 19.857
96 HB2 ARG 15 HB2 ARG 15 17.813 17.237 18.052
97 HB3 ARG 15 HB3 ARG 15 16.805 15.895 18.599
98 HG2 ARG 15 HG2 ARG 15 15.647 16.866 16.755
99 HG3 ARG 15 HG3 ARG 15 14.825 17.414 18.227
100 HD2 ARG 15 HD2 ARG 15 14.986 19.427 17.033
101 HD3 ARG 15 HD3 ARG 15 16.439 19.505 18.040
102 HE ARG 15 HE ARG 15 16.719 18.388 15.306
103 HH11 ARG 15 HH11 ARG 15 17.413 21.174 17.388
104 HH12 ARG 15 HH12 ARG 15 18.515 21.809 16.202
105 HH21 ARG 15 HH21 ARG 15 17.776 19.425 13.839
106 HH22 ARG 15 HH22 ARG 15 18.389 21.061 14.110
107 H SER 16 H SER 16 17.828 16.430 21.810
108 HA SER 16 HA SER 16 15.907 14.662 22.934
109 HB2 SER 16 HB2 SER 16 18.275 14.718 23.623
110 HB3 SER 16 HB3 SER 16 18.042 16.332 24.319
111 HG SER 16 HG SER 16 17.952 14.886 25.935
112 H LEU 17 H LEU 17 16.400 18.216 23.576
113 HA LEU 17 HA LEU 17 14.037 18.418 25.324
114 HB2 LEU 17 HB2 LEU 17 15.955 20.278 23.980
115 HB3 LEU 17 HB3 LEU 17 14.692 20.834 25.106
116 HG LEU 17 HG LEU 17 16.911 18.974 25.854
117 HD11 LEU 17 HD11 LEU 17 17.021 21.908 26.438
118 HD12 LEU 17 HD12 LEU 17 18.106 20.654 27.042
119 HD13 LEU 17 HD13 LEU 17 18.070 20.974 25.319
120 HD21 LEU 17 HD21 LEU 17 14.825 19.098 27.332
121 HD22 LEU 17 HD22 LEU 17 16.246 19.720 28.186
122 HD23 LEU 17 HD23 LEU 17 15.098 20.858 27.430
123 H GLY 18 H GLY 18 14.848 18.559 21.962
124 HA2 GLY 18 HA2 GLY 18 13.651 19.218 20.050
125 HA3 GLY 18 HA3 GLY 18 12.358 19.877 21.060
126 H LEU 19 H LEU 19 15.845 20.625 21.533
127 HA LEU 19 HA LEU 19 15.265 23.512 21.104
128 HB2 LEU 19 HB2 LEU 19 17.553 22.039 22.392
129 HB3 LEU 19 HB3 LEU 19 17.544 23.776 22.225
130 HG LEU 19 HG LEU 19 16.548 22.147 24.268
131 HD11 LEU 19 HD11 LEU 19 16.308 24.063 25.653
132 HD12 LEU 19 HD12 LEU 19 17.810 24.164 24.786
133 HD13 LEU 19 HD13 LEU 19 16.412 25.128 24.267
134 HD21 LEU 19 HD21 LEU 19 14.417 23.971 23.148
135 HD22 LEU 19 HD22 LEU 19 14.296 22.238 23.401
136 HD23 LEU 19 HD23 LEU 19 14.374 23.305 24.785
137 H LEU 20 H LEU 20 17.299 24.669 20.505
138 HA LEU 20 HA LEU 20 18.400 23.739 17.871
139 HB2 LEU 20 HB2 LEU 20 17.232 26.024 18.025
140 HB3 LEU 20 HB3 LEU 20 18.442 26.466 19.202
141 HG LEU 20 HG LEU 20 20.207 25.945 17.359
142 HD11 LEU 20 HD11 LEU 20 17.710 26.314 15.634
143 HD12 LEU 20 HD12 LEU 20 19.385 26.199 15.063
144 HD13 LEU 20 HD13 LEU 20 18.616 24.795 15.803
145 HD21 LEU 20 HD21 LEU 20 19.915 28.186 16.364
146 HD22 LEU 20 HD22 LEU 20 18.272 28.270 17.045
147 HD23 LEU 20 HD23 LEU 20 19.688 28.219 18.120
148 H GLY 21 H GLY 21 20.582 23.204 17.841
149 HA2 GLY 21 HA2 GLY 21 22.106 23.421 20.408
150 HA3 GLY 21 HA3 GLY 21 22.400 22.246 19.148
151 H LYS 22 H LYS 22 23.895 24.541 20.565
152 HA LYS 22 HA LYS 22 25.584 25.281 18.233
153 HB2 LYS 22 HB2 LYS 22 24.937 27.084 20.609
154 HB3 LYS 22 HB3 LYS 22 26.210 27.394 19.435
155 HG2 LYS 22 HG2 LYS 22 23.231 27.406 18.907
156 HG3 LYS 22 HG3 LYS 22 24.344 28.786 18.954
157 HD2 LYS 22 HD2 LYS 22 25.572 27.758 16.982
158 HD3 LYS 22 HD3 LYS 22 24.274 26.550 16.922
159 HE2 LYS 22 HE2 LYS 22 22.656 28.575 16.815
160 HE3 LYS 22 HE3 LYS 22 24.090 29.548 16.436
161 HZ1 LYS 22 HZ1 LYS 22 24.415 28.147 14.451
162 HZ2 LYS 22 HZ2 LYS 22 23.153 27.175 14.917
163 HZ3 LYS 22 HZ3 LYS 22 22.870 28.697 14.458
164 H CYS 23 H CYS 23 27.810 25.347 18.641
165 HA CYS 23 HA CYS 23 28.652 23.915 21.144
166 HB2 CYS 23 HB2 CYS 23 28.945 23.346 18.329
167 HB3 CYS 23 HB3 CYS 23 30.507 23.475 19.083
168 H ILE 24 H ILE 24 29.730 25.109 22.479
169 HA ILE 24 HA ILE 24 31.518 27.318 21.514
170 HB ILE 24 HB ILE 24 29.656 27.391 23.921
171 HG12 ILE 24 HG12 ILE 24 28.845 29.506 22.449
172 HG13 ILE 24 HG13 ILE 24 29.371 28.479 21.119
173 HG21 ILE 24 HG21 ILE 24 31.464 29.557 22.777
174 HG22 ILE 24 HG22 ILE 24 30.378 29.692 24.186
175 HG23 ILE 24 HG23 ILE 24 31.779 28.643 24.270
176 HD11 ILE 24 HD11 ILE 24 27.802 26.698 21.969
177 HD12 ILE 24 HD12 ILE 24 27.338 27.787 23.288
178 HD13 ILE 24 HD13 ILE 24 26.973 28.226 21.612
179 H GLY 25 H GLY 25 33.536 27.003 22.102
180 HA2 GLY 25 HA2 GLY 25 35.408 26.525 23.360
181 HA3 GLY 25 HA3 GLY 25 34.399 26.702 24.798
182 H GLU 26 H GLU 26 33.897 24.276 22.294
183 HA GLU 26 HA GLU 26 33.810 22.086 22.206
184 HB2 GLU 26 HB2 GLU 26 35.655 21.893 24.565
185 HB3 GLU 26 HB3 GLU 26 35.168 20.570 23.508
186 HG2 GLU 26 HG2 GLU 26 36.252 21.626 21.583
187 HG3 GLU 26 HG3 GLU 26 36.752 22.995 22.580
188 H GLU 27 H GLU 27 32.056 23.745 24.259
189 HA GLU 27 HA GLU 27 30.617 21.301 25.142
190 HB2 GLU 27 HB2 GLU 27 30.912 23.947 26.513
191 HB3 GLU 27 HB3 GLU 27 29.388 23.079 26.677
192 HG2 GLU 27 HG2 GLU 27 32.098 21.880 27.355
193 HG3 GLU 27 HG3 GLU 27 30.970 22.595 28.512
194 H CYS 28 H CYS 28 28.797 20.780 24.348
195 HA CYS 28 HA CYS 28 27.378 22.451 22.425
196 HB2 CYS 28 HB2 CYS 28 27.560 20.101 21.995
197 HB3 CYS 28 HB3 CYS 28 26.973 19.697 23.601
198 H LYS 29 H LYS 29 25.707 23.757 22.808
199 HA LYS 29 HA LYS 29 24.216 23.695 25.408
200 HB2 LYS 29 HB2 LYS 29 24.944 26.124 23.720
201 HB3 LYS 29 HB3 LYS 29 24.159 26.125 25.287
202 HG2 LYS 29 HG2 LYS 29 27.057 25.375 24.711
203 HG3 LYS 29 HG3 LYS 29 26.468 26.881 25.407
204 HD2 LYS 29 HD2 LYS 29 25.599 25.606 27.377
205 HD3 LYS 29 HD3 LYS 29 26.357 24.136 26.716
206 HE2 LYS 29 HE2 LYS 29 28.573 25.298 26.737
207 HE3 LYS 29 HE3 LYS 29 27.807 26.732 27.418
208 HZ1 LYS 29 HZ1 LYS 29 28.758 25.439 29.207
209 HZ2 LYS 29 HZ2 LYS 29 27.121 25.324 29.338
210 HZ3 LYS 29 HZ3 LYS 29 27.952 24.074 28.747
211 H CYS 30 H CYS 30 21.925 23.885 25.273
212 HA CYS 30 HA CYS 30 20.658 23.923 22.621
213 HB2 CYS 30 HB2 CYS 30 19.610 22.968 25.247
214 HB3 CYS 30 HB3 CYS 30 19.084 22.608 23.628
215 H VAL 31 H VAL 31 19.453 25.613 22.080
216 HA VAL 31 HA VAL 31 18.340 27.334 24.245
217 HB VAL 31 HB VAL 31 18.321 29.228 22.802
218 HG11 VAL 31 HG11 VAL 31 20.236 28.910 24.319
219 HG12 VAL 31 HG12 VAL 31 21.128 28.056 23.036
220 HG13 VAL 31 HG13 VAL 31 20.712 29.772 22.850
221 HG21 VAL 31 HG21 VAL 31 19.657 29.234 20.683
222 HG22 VAL 31 HG22 VAL 31 19.881 27.478 20.850
223 HG23 VAL 31 HG23 VAL 31 18.249 28.159 20.597
224 HA PRO 32 HA PRO 32 14.591 26.007 23.142
225 HB2 PRO 32 HB2 PRO 32 12.868 28.201 23.617
226 HB3 PRO 32 HB3 PRO 32 13.481 26.971 24.759
227 HG2 PRO 32 HG2 PRO 32 14.569 29.718 24.200
228 HG3 PRO 32 HG3 PRO 32 14.450 28.852 25.765
229 HD2 PRO 32 HD2 PRO 32 16.795 28.992 24.464
230 HD3 PRO 32 HD3 PRO 32 16.317 27.414 25.180
231 H TYR 33 H TYR 33 13.661 25.343 21.452
232 HA TYR 33 HA TYR 33 12.910 26.983 19.115
233 HB2 TYR 33 HB2 TYR 33 12.108 24.243 20.097
234 HB3 TYR 33 HB3 TYR 33 11.172 25.059 18.878
235 HD1 TYR 33 HD1 TYR 33 14.848 25.553 18.601
236 HD2 TYR 33 HD2 TYR 33 11.417 23.179 17.481
237 HE1 TYR 33 HE1 TYR 33 16.083 24.651 16.635
238 HE2 TYR 33 HE2 TYR 33 12.673 22.288 15.513
239 HH TYR 33 HH TYR 33 15.859 23.531 14.594
Start of MODEL 8
1 H1 GLY 1 H1 GLY 1 41.943 23.771 17.466
2 H2 GLY 1 H2 GLY 1 40.625 24.726 17.203
3 H3 GLY 1 H3 GLY 1 40.412 23.178 17.697
4 HA2 GLY 1 HA2 GLY 1 41.621 25.367 19.248
5 HA3 GLY 1 HA3 GLY 1 40.028 24.622 19.533
6 H SER 2 H SER 2 40.284 23.621 21.446
7 HA SER 2 HA SER 2 42.352 21.492 21.708
8 HB2 SER 2 HB2 SER 2 42.647 22.185 24.128
9 HB3 SER 2 HB3 SER 2 43.367 23.224 22.899
10 HG SER 2 HG SER 2 42.283 24.411 24.534
11 H ALA 3 H ALA 3 39.096 21.943 21.598
12 HA ALA 3 HA ALA 3 38.802 19.307 22.816
13 HB1 ALA 3 HB1 ALA 3 38.381 21.031 24.672
14 HB2 ALA 3 HB2 ALA 3 36.916 21.480 23.783
15 HB3 ALA 3 HB3 ALA 3 37.124 19.819 24.379
16 H PHE 4 H PHE 4 38.169 21.070 20.282
17 HA PHE 4 HA PHE 4 37.026 20.606 18.328
18 HB2 PHE 4 HB2 PHE 4 37.650 17.831 19.272
19 HB3 PHE 4 HB3 PHE 4 37.626 18.448 17.620
20 HD1 PHE 4 HD2 PHE 4 39.433 20.148 16.914
21 HD2 PHE 4 HD1 PHE 4 39.621 17.944 20.613
22 HE1 PHE 4 HE2 PHE 4 41.850 20.681 17.112
23 HE2 PHE 4 HE1 PHE 4 42.039 18.470 20.799
24 HZ PHE 4 HZ PHE 4 43.152 19.864 19.071
25 H CYS 5 H CYS 5 34.938 21.182 19.668
26 HA CYS 5 HA CYS 5 32.918 19.210 20.078
27 HB2 CYS 5 HB2 CYS 5 31.370 21.004 20.297
28 HB3 CYS 5 HB3 CYS 5 32.895 21.494 21.026
29 H ASN 6 H ASN 6 31.013 18.720 18.906
30 HA ASN 6 HA ASN 6 30.946 19.479 16.002
31 HB2 ASN 6 HB2 ASN 6 31.257 16.860 16.668
32 HB3 ASN 6 HB3 ASN 6 29.621 17.003 17.122
33 HD21 ASN 6 HD22 ASN 6 31.861 17.353 14.340
34 HD22 ASN 6 HD21 ASN 6 30.630 16.977 13.147
35 H LEU 7 H LEU 7 29.059 20.078 15.145
36 HA LEU 7 HA LEU 7 26.946 20.792 17.094
37 HB2 LEU 7 HB2 LEU 7 28.504 22.570 15.714
38 HB3 LEU 7 HB3 LEU 7 27.233 22.274 14.508
39 HG LEU 7 HG LEU 7 25.564 22.576 16.498
40 HD11 LEU 7 HD11 LEU 7 26.298 23.640 18.412
41 HD12 LEU 7 HD12 LEU 7 27.563 22.446 18.193
42 HD13 LEU 7 HD13 LEU 7 27.866 24.109 17.674
43 HD21 LEU 7 HD21 LEU 7 25.791 24.236 14.724
44 HD22 LEU 7 HD22 LEU 7 25.620 25.035 16.291
45 HD23 LEU 7 HD23 LEU 7 27.219 24.929 15.515
46 H ARG 8 H ARG 8 27.395 19.529 13.795
47 HA ARG 8 HA ARG 8 24.675 18.841 13.391
48 HB2 ARG 8 HB2 ARG 8 26.482 18.244 11.747
49 HB3 ARG 8 HB3 ARG 8 27.133 17.092 12.880
50 HG2 ARG 8 HG2 ARG 8 26.034 15.837 11.278
51 HG3 ARG 8 HG3 ARG 8 25.005 15.734 12.690
52 HD2 ARG 8 HD2 ARG 8 24.516 17.672 10.374
53 HD3 ARG 8 HD3 ARG 8 23.928 16.017 10.390
54 HE ARG 8 HE ARG 8 22.360 16.473 12.031
55 HH11 ARG 8 HH11 ARG 8 24.018 19.485 11.155
56 HH12 ARG 8 HH12 ARG 8 22.724 20.416 11.894
57 HH21 ARG 8 HH21 ARG 8 20.701 17.855 12.723
58 HH22 ARG 8 HH22 ARG 8 20.940 19.570 12.511
59 H ALA 9 H ALA 9 26.992 16.974 15.359
60 HA ALA 9 HA ALA 9 25.296 15.057 16.459
61 HB1 ALA 9 HB1 ALA 9 27.692 16.502 17.691
62 HB2 ALA 9 HB2 ALA 9 27.137 14.863 18.088
63 HB3 ALA 9 HB3 ALA 9 27.853 15.207 16.500
64 H CYS 10 H CYS 10 25.961 18.409 17.507
65 HA CYS 10 HA CYS 10 24.490 18.124 19.999
66 HB2 CYS 10 HB2 CYS 10 26.485 19.618 19.437
67 HB3 CYS 10 HB3 CYS 10 25.324 20.691 18.644
68 H GLU 11 H GLU 11 23.829 19.669 16.826
69 HA GLU 11 HA GLU 11 21.344 20.794 17.456
70 HB2 GLU 11 HB2 GLU 11 22.487 19.827 14.818
71 HB3 GLU 11 HB3 GLU 11 20.903 20.585 14.948
72 HG2 GLU 11 HG2 GLU 11 22.060 22.577 16.002
73 HG3 GLU 11 HG3 GLU 11 23.583 21.875 15.555
74 H LEU 12 H LEU 12 22.207 17.501 16.542
75 HA LEU 12 HA LEU 12 19.389 16.619 16.490
76 HB2 LEU 12 HB2 LEU 12 20.244 14.537 15.624
77 HB3 LEU 12 HB3 LEU 12 20.974 15.878 14.778
78 HG LEU 12 HG LEU 12 23.027 15.504 16.345
79 HD11 LEU 12 HD11 LEU 12 23.368 13.136 16.968
80 HD12 LEU 12 HD12 LEU 12 22.073 13.865 17.906
81 HD13 LEU 12 HD13 LEU 12 21.679 12.790 16.550
82 HD21 LEU 12 HD21 LEU 12 22.975 15.048 13.895
83 HD22 LEU 12 HD22 LEU 12 23.929 13.834 14.755
84 HD23 LEU 12 HD23 LEU 12 22.277 13.452 14.219
85 H SER 13 H SER 13 21.872 16.815 18.885
86 HA SER 13 HA SER 13 20.612 14.764 20.628
87 HB2 SER 13 HB2 SER 13 22.886 16.701 21.175
88 HB3 SER 13 HB3 SER 13 22.319 15.416 22.265
89 HG SER 13 HG SER 13 23.501 15.194 19.695
90 H CYS 14 H CYS 14 21.039 18.337 20.593
91 HA CYS 14 HA CYS 14 19.494 18.891 22.931
92 HB2 CYS 14 HB2 CYS 14 20.216 20.484 20.442
93 HB3 CYS 14 HB3 CYS 14 19.316 21.177 21.788
94 H ARG 15 H ARG 15 18.443 17.958 19.732
95 HA ARG 15 HA ARG 15 15.767 18.892 19.768
96 HB2 ARG 15 HB2 ARG 15 17.270 17.736 17.919
97 HB3 ARG 15 HB3 ARG 15 16.658 16.234 18.588
98 HG2 ARG 15 HG2 ARG 15 15.296 16.844 16.723
99 HG3 ARG 15 HG3 ARG 15 14.322 17.069 18.178
100 HD2 ARG 15 HD2 ARG 15 15.808 19.520 17.531
101 HD3 ARG 15 HD3 ARG 15 14.949 18.952 16.109
102 HE ARG 15 HE ARG 15 12.923 18.771 17.791
103 HH11 ARG 15 HH11 ARG 15 14.958 21.605 17.245
104 HH12 ARG 15 HH12 ARG 15 13.785 22.615 18.108
105 HH21 ARG 15 HH21 ARG 15 11.549 20.235 18.800
106 HH22 ARG 15 HH22 ARG 15 12.015 21.945 18.778
107 H SER 16 H SER 16 17.292 16.351 21.601
108 HA SER 16 HA SER 16 14.956 14.930 22.422
109 HB2 SER 16 HB2 SER 16 17.704 15.230 23.667
110 HB3 SER 16 HB3 SER 16 16.438 14.247 24.392
111 HG SER 16 HG SER 16 17.196 13.875 21.673
112 H LEU 17 H LEU 17 16.150 18.111 23.554
113 HA LEU 17 HA LEU 17 14.099 18.021 25.635
114 HB2 LEU 17 HB2 LEU 17 15.081 20.377 26.068
115 HB3 LEU 17 HB3 LEU 17 15.389 18.894 26.958
116 HG LEU 17 HG LEU 17 17.052 19.926 24.740
117 HD11 LEU 17 HD11 LEU 17 17.029 21.386 26.899
118 HD12 LEU 17 HD12 LEU 17 17.598 19.968 27.768
119 HD13 LEU 17 HD13 LEU 17 18.632 20.716 26.541
120 HD21 LEU 17 HD21 LEU 17 17.343 17.530 26.330
121 HD22 LEU 17 HD22 LEU 17 17.862 17.958 24.665
122 HD23 LEU 17 HD23 LEU 17 18.834 18.500 26.013
123 H GLY 18 H GLY 18 14.194 18.527 22.447
124 HA2 GLY 18 HA2 GLY 18 12.922 19.681 20.914
125 HA3 GLY 18 HA3 GLY 18 12.057 20.523 22.203
126 H LEU 19 H LEU 19 15.607 20.508 22.127
127 HA LEU 19 HA LEU 19 15.556 23.455 21.672
128 HB2 LEU 19 HB2 LEU 19 17.612 21.675 22.885
129 HB3 LEU 19 HB3 LEU 19 17.782 23.412 22.736
130 HG LEU 19 HG LEU 19 16.720 21.855 24.789
131 HD11 LEU 19 HD11 LEU 19 16.557 23.886 26.167
132 HD12 LEU 19 HD12 LEU 19 18.095 23.699 25.420
133 HD13 LEU 19 HD13 LEU 19 16.920 24.851 24.740
134 HD21 LEU 19 HD21 LEU 19 14.672 23.152 25.447
135 HD22 LEU 19 HD22 LEU 19 14.554 23.577 23.732
136 HD23 LEU 19 HD23 LEU 19 14.552 21.916 24.243
137 H LEU 20 H LEU 20 17.676 24.230 20.928
138 HA LEU 20 HA LEU 20 18.622 22.877 18.422
139 HB2 LEU 20 HB2 LEU 20 17.372 25.099 18.216
140 HB3 LEU 20 HB3 LEU 20 18.702 25.835 19.111
141 HG LEU 20 HG LEU 20 20.225 24.962 17.231
142 HD11 LEU 20 HD11 LEU 20 17.495 24.562 15.918
143 HD12 LEU 20 HD12 LEU 20 19.056 24.515 15.063
144 HD13 LEU 20 HD13 LEU 20 18.671 23.276 16.264
145 HD21 LEU 20 HD21 LEU 20 19.419 27.338 17.405
146 HD22 LEU 20 HD22 LEU 20 19.680 26.798 15.734
147 HD23 LEU 20 HD23 LEU 20 18.034 26.900 16.388
148 H GLY 21 H GLY 21 20.829 22.560 18.206
149 HA2 GLY 21 HA2 GLY 21 22.472 22.879 20.636
150 HA3 GLY 21 HA3 GLY 21 22.868 21.930 19.213
151 H LYS 22 H LYS 22 23.854 24.411 20.912
152 HA LYS 22 HA LYS 22 25.430 25.612 18.650
153 HB2 LYS 22 HB2 LYS 22 24.434 27.114 21.140
154 HB3 LYS 22 HB3 LYS 22 25.477 27.786 19.892
155 HG2 LYS 22 HG2 LYS 22 22.617 26.890 19.522
156 HG3 LYS 22 HG3 LYS 22 23.187 28.561 19.741
157 HD2 LYS 22 HD2 LYS 22 24.511 28.331 17.620
158 HD3 LYS 22 HD3 LYS 22 23.800 26.716 17.422
159 HE2 LYS 22 HE2 LYS 22 21.504 27.836 17.589
160 HE3 LYS 22 HE3 LYS 22 22.337 29.400 17.529
161 HZ1 LYS 22 HZ1 LYS 22 21.658 28.803 15.318
162 HZ2 LYS 22 HZ2 LYS 22 23.305 28.600 15.369
163 HZ3 LYS 22 HZ3 LYS 22 22.344 27.296 15.459
164 H CYS 23 H CYS 23 27.457 25.668 18.896
165 HA CYS 23 HA CYS 23 28.724 24.824 21.489
166 HB2 CYS 23 HB2 CYS 23 29.275 23.374 19.661
167 HB3 CYS 23 HB3 CYS 23 29.838 24.743 18.687
168 H ILE 24 H ILE 24 29.758 26.141 22.736
169 HA ILE 24 HA ILE 24 31.359 28.410 21.691
170 HB ILE 24 HB ILE 24 29.303 28.706 23.913
171 HG12 ILE 24 HG12 ILE 24 28.297 28.915 21.647
172 HG13 ILE 24 HG13 ILE 24 28.195 30.354 22.619
173 HG21 ILE 24 HG21 ILE 24 31.459 30.646 23.003
174 HG22 ILE 24 HG22 ILE 24 30.072 31.089 24.020
175 HG23 ILE 24 HG23 ILE 24 31.250 29.924 24.609
176 HD11 ILE 24 HD11 ILE 24 30.274 29.980 20.419
177 HD12 ILE 24 HD12 ILE 24 28.723 30.814 20.226
178 HD13 ILE 24 HD13 ILE 24 29.937 31.469 21.332
179 H GLY 25 H GLY 25 33.328 28.431 22.632
180 HA2 GLY 25 HA2 GLY 25 35.041 28.038 24.127
181 HA3 GLY 25 HA3 GLY 25 33.867 27.571 25.357
182 H GLU 26 H GLU 26 33.979 26.124 22.139
183 HA GLU 26 HA GLU 26 33.948 23.970 21.473
184 HB2 GLU 26 HB2 GLU 26 36.403 23.759 23.206
185 HB3 GLU 26 HB3 GLU 26 35.926 22.624 21.929
186 HG2 GLU 26 HG2 GLU 26 36.066 24.390 20.242
187 HG3 GLU 26 HG3 GLU 26 36.493 25.587 21.479
188 H GLU 27 H GLU 27 32.273 24.533 23.727
189 HA GLU 27 HA GLU 27 31.523 21.759 24.433
190 HB2 GLU 27 HB2 GLU 27 31.656 24.195 26.241
191 HB3 GLU 27 HB3 GLU 27 30.640 22.811 26.600
192 HG2 GLU 27 HG2 GLU 27 33.637 22.498 26.160
193 HG3 GLU 27 HG3 GLU 27 32.954 22.972 27.700
194 H CYS 28 H CYS 28 29.198 21.522 24.604
195 HA CYS 28 HA CYS 28 27.820 23.621 22.988
196 HB2 CYS 28 HB2 CYS 28 28.432 21.418 21.894
197 HB3 CYS 28 HB3 CYS 28 27.153 20.697 22.883
198 H LYS 29 H LYS 29 25.839 24.267 23.290
199 HA LYS 29 HA LYS 29 24.287 23.359 25.686
200 HB2 LYS 29 HB2 LYS 29 24.544 26.178 24.560
201 HB3 LYS 29 HB3 LYS 29 23.626 25.692 25.972
202 HG2 LYS 29 HG2 LYS 29 26.641 25.547 25.731
203 HG3 LYS 29 HG3 LYS 29 25.755 26.851 26.518
204 HD2 LYS 29 HD2 LYS 29 24.881 25.253 28.185
205 HD3 LYS 29 HD3 LYS 29 25.772 23.939 27.405
206 HE2 LYS 29 HE2 LYS 29 27.062 26.440 28.581
207 HE3 LYS 29 HE3 LYS 29 26.899 24.901 29.428
208 HZ1 LYS 29 HZ1 LYS 29 29.026 24.958 28.519
209 HZ2 LYS 29 HZ2 LYS 29 28.223 23.860 27.661
210 HZ3 LYS 29 HZ3 LYS 29 28.517 25.362 26.995
211 H CYS 30 H CYS 30 21.982 23.481 25.533
212 HA CYS 30 HA CYS 30 20.774 23.459 22.852
213 HB2 CYS 30 HB2 CYS 30 19.920 22.518 25.589
214 HB3 CYS 30 HB3 CYS 30 19.163 22.206 24.055
215 H VAL 31 H VAL 31 19.607 25.226 22.277
216 HA VAL 31 HA VAL 31 18.453 26.938 24.440
217 HB VAL 31 HB VAL 31 18.466 28.830 22.930
218 HG11 VAL 31 HG11 VAL 31 20.205 28.555 24.660
219 HG12 VAL 31 HG12 VAL 31 21.241 27.699 23.495
220 HG13 VAL 31 HG13 VAL 31 20.826 29.405 23.241
221 HG21 VAL 31 HG21 VAL 31 20.314 27.118 21.192
222 HG22 VAL 31 HG22 VAL 31 18.689 27.680 20.743
223 HG23 VAL 31 HG23 VAL 31 19.996 28.852 20.972
224 HA PRO 32 HA PRO 32 14.834 25.449 23.255
225 HB2 PRO 32 HB2 PRO 32 12.889 27.292 23.949
226 HB3 PRO 32 HB3 PRO 32 13.806 26.236 25.063
227 HG2 PRO 32 HG2 PRO 32 14.396 29.107 24.309
228 HG3 PRO 32 HG3 PRO 32 14.466 28.345 25.931
229 HD2 PRO 32 HD2 PRO 32 16.725 28.725 24.501
230 HD3 PRO 32 HD3 PRO 32 16.490 27.169 25.372
231 H TYR 33 H TYR 33 14.217 24.805 21.487
232 HA TYR 33 HA TYR 33 13.034 26.607 19.386
233 HB2 TYR 33 HB2 TYR 33 15.446 24.914 19.209
234 HB3 TYR 33 HB3 TYR 33 14.384 24.861 17.831
235 HD1 TYR 33 HD2 TYR 33 16.397 27.222 19.887
236 HD2 TYR 33 HD1 TYR 33 14.159 26.602 16.266
237 HE1 TYR 33 HE2 TYR 33 17.418 29.282 18.909
238 HE2 TYR 33 HE1 TYR 33 15.154 28.663 15.291
239 HH TYR 33 HH TYR 33 17.688 30.529 16.976
Start of MODEL 9
1 H1 GLY 1 H1 GLY 1 37.185 20.528 24.384
2 H2 GLY 1 H2 GLY 1 38.016 19.942 23.088
3 H3 GLY 1 H3 GLY 1 38.462 21.378 23.751
4 HA2 GLY 1 HA2 GLY 1 39.999 19.668 24.389
5 HA3 GLY 1 HA3 GLY 1 39.112 20.295 25.799
6 H SER 2 H SER 2 40.337 17.548 24.974
7 HA SER 2 HA SER 2 39.965 15.349 24.958
8 HB2 SER 2 HB2 SER 2 37.422 15.850 26.516
9 HB3 SER 2 HB3 SER 2 38.390 14.372 26.452
10 HG SER 2 HG SER 2 40.106 15.511 27.417
11 H ALA 3 H ALA 3 37.324 17.204 23.714
12 HA ALA 3 HA ALA 3 37.365 15.730 21.248
13 HB1 ALA 3 HB1 ALA 3 34.782 15.912 22.879
14 HB2 ALA 3 HB2 ALA 3 34.883 15.404 21.182
15 HB3 ALA 3 HB3 ALA 3 35.631 14.412 22.446
16 H PHE 4 H PHE 4 36.116 17.032 19.590
17 HA PHE 4 HA PHE 4 35.842 19.905 20.293
18 HB2 PHE 4 HB2 PHE 4 37.016 19.382 18.201
19 HB3 PHE 4 HB3 PHE 4 35.607 18.500 17.616
20 HD1 PHE 4 HD1 PHE 4 36.680 21.901 18.816
21 HD2 PHE 4 HD2 PHE 4 33.896 19.637 16.422
22 HE1 PHE 4 HE1 PHE 4 35.674 24.009 17.989
23 HE2 PHE 4 HE2 PHE 4 32.895 21.751 15.602
24 HZ PHE 4 HZ PHE 4 33.774 23.938 16.382
25 H CYS 5 H CYS 5 33.814 20.976 19.671
26 HA CYS 5 HA CYS 5 31.473 19.470 20.634
27 HB2 CYS 5 HB2 CYS 5 30.482 21.764 20.661
28 HB3 CYS 5 HB3 CYS 5 31.867 21.541 21.704
29 H ASN 6 H ASN 6 31.541 18.096 18.641
30 HA ASN 6 HA ASN 6 30.739 19.007 16.075
31 HB2 ASN 6 HB2 ASN 6 30.092 16.451 17.623
32 HB3 ASN 6 HB3 ASN 6 29.658 16.698 15.955
33 HD21 ASN 6 HD22 ASN 6 31.051 14.517 16.230
34 HD22 ASN 6 HD21 ASN 6 32.702 14.773 15.674
35 H LEU 7 H LEU 7 29.002 19.829 15.299
36 HA LEU 7 HA LEU 7 26.831 20.451 17.191
37 HB2 LEU 7 HB2 LEU 7 28.593 22.115 15.960
38 HB3 LEU 7 HB3 LEU 7 27.347 22.033 14.701
39 HG LEU 7 HG LEU 7 25.654 22.556 16.574
40 HD11 LEU 7 HD11 LEU 7 26.437 23.459 18.624
41 HD12 LEU 7 HD12 LEU 7 27.377 21.988 18.460
42 HD13 LEU 7 HD13 LEU 7 28.127 23.523 18.043
43 HD21 LEU 7 HD21 LEU 7 26.183 24.969 16.505
44 HD22 LEU 7 HD22 LEU 7 27.832 24.597 15.940
45 HD23 LEU 7 HD23 LEU 7 26.430 24.219 14.924
46 H ARG 8 H ARG 8 27.315 19.435 13.844
47 HA ARG 8 HA ARG 8 24.426 18.683 13.756
48 HB2 ARG 8 HB2 ARG 8 26.625 18.338 11.722
49 HB3 ARG 8 HB3 ARG 8 25.013 17.674 11.495
50 HG2 ARG 8 HG2 ARG 8 25.602 20.597 12.104
51 HG3 ARG 8 HG3 ARG 8 25.320 19.957 10.473
52 HD2 ARG 8 HD2 ARG 8 23.351 20.209 12.783
53 HD3 ARG 8 HD3 ARG 8 23.306 21.019 11.222
54 HE ARG 8 HE ARG 8 23.200 18.183 10.785
55 HH11 ARG 8 HH21 ARG 8 21.072 20.651 12.108
56 HH12 ARG 8 HH22 ARG 8 19.657 19.855 11.436
57 HH21 ARG 8 HH11 ARG 8 21.482 17.340 9.936
58 HH22 ARG 8 HH12 ARG 8 19.887 18.068 10.122
59 H ALA 9 H ALA 9 26.417 17.642 15.614
60 HA ALA 9 HA ALA 9 24.958 15.087 15.899
61 HB1 ALA 9 HB1 ALA 9 27.393 14.683 15.959
62 HB2 ALA 9 HB2 ALA 9 27.604 15.971 17.159
63 HB3 ALA 9 HB3 ALA 9 26.714 14.490 17.587
64 H CYS 10 H CYS 10 26.164 18.125 17.466
65 HA CYS 10 HA CYS 10 24.685 17.709 19.878
66 HB2 CYS 10 HB2 CYS 10 26.593 19.358 19.564
67 HB3 CYS 10 HB3 CYS 10 25.430 20.441 18.793
68 H GLU 11 H GLU 11 23.797 19.663 17.003
69 HA GLU 11 HA GLU 11 21.322 20.696 17.846
70 HB2 GLU 11 HB2 GLU 11 22.143 19.650 15.099
71 HB3 GLU 11 HB3 GLU 11 20.628 20.469 15.439
72 HG2 GLU 11 HG2 GLU 11 22.245 22.341 16.429
73 HG3 GLU 11 HG3 GLU 11 23.393 21.628 15.318
74 H LEU 12 H LEU 12 22.110 17.437 16.782
75 HA LEU 12 HA LEU 12 19.365 16.496 16.665
76 HB2 LEU 12 HB2 LEU 12 21.782 14.694 16.969
77 HB3 LEU 12 HB3 LEU 12 20.312 14.438 16.062
78 HG LEU 12 HG LEU 12 22.680 16.217 15.265
79 HD11 LEU 12 HD11 LEU 12 22.836 14.532 13.431
80 HD12 LEU 12 HD12 LEU 12 23.023 13.790 15.027
81 HD13 LEU 12 HD13 LEU 12 21.485 13.635 14.147
82 HD21 LEU 12 HD21 LEU 12 20.080 15.695 13.747
83 HD22 LEU 12 HD22 LEU 12 20.594 17.261 14.401
84 HD23 LEU 12 HD23 LEU 12 21.514 16.512 13.094
85 H SER 13 H SER 13 22.082 16.190 19.018
86 HA SER 13 HA SER 13 20.599 14.826 21.071
87 HB2 SER 13 HB2 SER 13 23.048 16.612 21.352
88 HB3 SER 13 HB3 SER 13 22.519 15.333 22.460
89 HG SER 13 HG SER 13 24.223 14.824 20.928
90 H CYS 14 H CYS 14 20.675 18.205 20.196
91 HA CYS 14 HA CYS 14 19.340 19.046 22.686
92 HB2 CYS 14 HB2 CYS 14 20.193 20.551 20.185
93 HB3 CYS 14 HB3 CYS 14 19.373 21.286 21.580
94 H ARG 15 H ARG 15 18.396 18.114 19.412
95 HA ARG 15 HA ARG 15 15.671 18.963 19.456
96 HB2 ARG 15 HB2 ARG 15 17.180 17.726 17.631
97 HB3 ARG 15 HB3 ARG 15 16.581 16.272 18.403
98 HG2 ARG 15 HG2 ARG 15 15.249 16.662 16.535
99 HG3 ARG 15 HG3 ARG 15 14.227 17.056 17.913
100 HD2 ARG 15 HD2 ARG 15 15.820 19.199 16.478
101 HD3 ARG 15 HD3 ARG 15 14.365 18.577 15.728
102 HE ARG 15 HE ARG 15 13.164 19.217 17.915
103 HH11 ARG 15 HH11 ARG 15 15.747 21.229 16.545
104 HH12 ARG 15 HH12 ARG 15 14.871 22.673 16.952
105 HH21 ARG 15 HH21 ARG 15 12.236 21.095 18.434
106 HH22 ARG 15 HH22 ARG 15 13.092 22.614 18.219
107 H SER 16 H SER 16 17.370 16.465 21.220
108 HA SER 16 HA SER 16 15.271 14.943 22.294
109 HB2 SER 16 HB2 SER 16 17.832 15.767 23.705
110 HB3 SER 16 HB3 SER 16 16.844 14.336 24.044
111 HG SER 16 HG SER 16 18.688 13.861 22.770
112 H LEU 17 H LEU 17 16.015 18.335 23.071
113 HA LEU 17 HA LEU 17 13.966 18.179 25.139
114 HB2 LEU 17 HB2 LEU 17 15.060 20.402 25.879
115 HB3 LEU 17 HB3 LEU 17 15.359 18.827 26.574
116 HG LEU 17 HG LEU 17 17.010 20.061 24.447
117 HD11 LEU 17 HD11 LEU 17 16.988 21.391 26.669
118 HD12 LEU 17 HD12 LEU 17 17.525 19.925 27.479
119 HD13 LEU 17 HD13 LEU 17 18.592 20.720 26.313
120 HD21 LEU 17 HD21 LEU 17 18.758 18.503 25.726
121 HD22 LEU 17 HD22 LEU 17 17.221 17.545 25.784
122 HD23 LEU 17 HD23 LEU 17 17.881 18.170 24.241
123 H GLY 18 H GLY 18 14.017 18.769 22.041
124 HA2 GLY 18 HA2 GLY 18 12.909 20.150 20.580
125 HA3 GLY 18 HA3 GLY 18 12.095 20.944 21.929
126 H LEU 19 H LEU 19 15.609 20.829 21.909
127 HA LEU 19 HA LEU 19 15.709 23.774 21.407
128 HB2 LEU 19 HB2 LEU 19 17.701 21.937 22.645
129 HB3 LEU 19 HB3 LEU 19 17.871 23.685 22.594
130 HG LEU 19 HG LEU 19 16.441 21.922 24.388
131 HD11 LEU 19 HD11 LEU 19 18.212 23.176 25.459
132 HD12 LEU 19 HD12 LEU 19 17.489 24.708 24.906
133 HD13 LEU 19 HD13 LEU 19 16.709 23.700 26.110
134 HD21 LEU 19 HD21 LEU 19 14.516 23.410 23.384
135 HD22 LEU 19 HD22 LEU 19 14.638 22.970 25.070
136 HD23 LEU 19 HD23 LEU 19 15.155 24.550 24.571
137 H LEU 20 H LEU 20 17.907 24.420 20.794
138 HA LEU 20 HA LEU 20 18.795 23.149 18.228
139 HB2 LEU 20 HB2 LEU 20 17.765 25.526 18.235
140 HB3 LEU 20 HB3 LEU 20 19.201 26.029 19.109
141 HG LEU 20 HG LEU 20 20.561 25.178 17.113
142 HD11 LEU 20 HD11 LEU 20 18.939 23.629 16.102
143 HD12 LEU 20 HD12 LEU 20 17.741 24.937 15.952
144 HD13 LEU 20 HD13 LEU 20 19.220 24.954 14.975
145 HD21 LEU 20 HD21 LEU 20 20.039 27.137 15.742
146 HD22 LEU 20 HD22 LEU 20 18.457 27.301 16.516
147 HD23 LEU 20 HD23 LEU 20 19.937 27.577 17.456
148 H GLY 21 H GLY 21 21.006 22.753 17.997
149 HA2 GLY 21 HA2 GLY 21 22.633 22.812 20.491
150 HA3 GLY 21 HA3 GLY 21 22.993 21.902 19.030
151 H LYS 22 H LYS 22 23.837 24.533 20.820
152 HA LYS 22 HA LYS 22 25.556 25.549 18.585
153 HB2 LYS 22 HB2 LYS 22 24.305 27.176 20.868
154 HB3 LYS 22 HB3 LYS 22 25.515 27.801 19.751
155 HG2 LYS 22 HG2 LYS 22 22.748 26.835 18.971
156 HG3 LYS 22 HG3 LYS 22 23.255 28.518 19.207
157 HD2 LYS 22 HD2 LYS 22 24.950 28.204 17.370
158 HD3 LYS 22 HD3 LYS 22 24.301 26.573 17.135
159 HE2 LYS 22 HE2 LYS 22 23.339 28.024 15.464
160 HE3 LYS 22 HE3 LYS 22 22.077 27.526 16.592
161 HZ1 LYS 22 HZ1 LYS 22 21.889 29.885 16.187
162 HZ2 LYS 22 HZ2 LYS 22 22.381 29.718 17.727
163 HZ3 LYS 22 HZ3 LYS 22 23.474 30.154 16.607
164 H CYS 23 H CYS 23 27.560 25.661 18.912
165 HA CYS 23 HA CYS 23 28.685 24.992 21.593
166 HB2 CYS 23 HB2 CYS 23 29.540 23.770 19.696
167 HB3 CYS 23 HB3 CYS 23 30.117 25.263 18.963
168 H ILE 24 H ILE 24 29.718 26.234 22.906
169 HA ILE 24 HA ILE 24 30.872 28.841 22.049
170 HB ILE 24 HB ILE 24 29.237 28.322 24.571
171 HG12 ILE 24 HG12 ILE 24 27.823 28.890 22.643
172 HG13 ILE 24 HG13 ILE 24 27.795 30.117 23.893
173 HG21 ILE 24 HG21 ILE 24 29.756 30.702 25.179
174 HG22 ILE 24 HG22 ILE 24 31.134 29.618 25.274
175 HG23 ILE 24 HG23 ILE 24 30.983 30.730 23.894
176 HD11 ILE 24 HD11 ILE 24 29.236 31.600 22.560
177 HD12 ILE 24 HD12 ILE 24 29.370 30.358 21.297
178 HD13 ILE 24 HD13 ILE 24 27.806 31.105 21.643
179 H GLY 25 H GLY 25 33.020 28.863 22.548
180 HA2 GLY 25 HA2 GLY 25 35.049 28.237 23.406
181 HA3 GLY 25 HA3 GLY 25 34.214 28.172 24.953
182 H GLU 26 H GLU 26 34.234 26.098 22.038
183 HA GLU 26 HA GLU 26 34.417 23.889 21.688
184 HB2 GLU 26 HB2 GLU 26 36.251 23.838 24.098
185 HB3 GLU 26 HB3 GLU 26 36.078 22.567 22.893
186 HG2 GLU 26 HG2 GLU 26 36.859 24.122 21.121
187 HG3 GLU 26 HG3 GLU 26 37.148 25.360 22.362
188 H GLU 27 H GLU 27 32.355 24.802 23.979
189 HA GLU 27 HA GLU 27 31.438 21.991 24.422
190 HB2 GLU 27 HB2 GLU 27 31.591 24.278 26.403
191 HB3 GLU 27 HB3 GLU 27 30.471 22.945 26.602
192 HG2 GLU 27 HG2 GLU 27 33.494 22.633 26.413
193 HG3 GLU 27 HG3 GLU 27 32.538 22.684 27.895
194 H CYS 28 H CYS 28 29.432 21.550 23.952
195 HA CYS 28 HA CYS 28 27.794 23.627 22.742
196 HB2 CYS 28 HB2 CYS 28 28.200 21.346 21.750
197 HB3 CYS 28 HB3 CYS 28 27.145 20.702 23.011
198 H LYS 29 H LYS 29 25.821 24.296 23.236
199 HA LYS 29 HA LYS 29 24.411 23.331 25.681
200 HB2 LYS 29 HB2 LYS 29 25.547 25.584 25.971
201 HB3 LYS 29 HB3 LYS 29 24.528 26.209 24.689
202 HG2 LYS 29 HG2 LYS 29 23.581 26.877 26.772
203 HG3 LYS 29 HG3 LYS 29 22.510 25.676 26.084
204 HD2 LYS 29 HD2 LYS 29 22.744 25.350 28.483
205 HD3 LYS 29 HD3 LYS 29 23.439 23.957 27.638
206 HE2 LYS 29 HE2 LYS 29 25.693 24.738 28.024
207 HE3 LYS 29 HE3 LYS 29 25.120 26.315 28.574
208 HZ1 LYS 29 HZ1 LYS 29 24.206 25.278 30.545
209 HZ2 LYS 29 HZ2 LYS 29 24.608 23.776 30.011
210 HZ3 LYS 29 HZ3 LYS 29 25.784 24.842 30.401
211 H CYS 30 H CYS 30 22.113 23.186 25.489
212 HA CYS 30 HA CYS 30 20.934 23.372 22.803
213 HB2 CYS 30 HB2 CYS 30 19.978 22.206 25.394
214 HB3 CYS 30 HB3 CYS 30 19.288 22.041 23.808
215 H VAL 31 H VAL 31 19.936 25.198 22.324
216 HA VAL 31 HA VAL 31 18.728 26.830 24.517
217 HB VAL 31 HB VAL 31 19.044 28.820 23.194
218 HG11 VAL 31 HG11 VAL 31 21.681 27.368 23.696
219 HG12 VAL 31 HG12 VAL 31 21.423 29.122 23.650
220 HG13 VAL 31 HG13 VAL 31 20.692 28.155 24.945
221 HG21 VAL 31 HG21 VAL 31 20.665 28.840 21.299
222 HG22 VAL 31 HG22 VAL 31 20.762 27.066 21.368
223 HG23 VAL 31 HG23 VAL 31 19.241 27.862 20.917
224 HA PRO 32 HA PRO 32 15.073 25.679 22.881
225 HB2 PRO 32 HB2 PRO 32 13.261 27.698 23.493
226 HB3 PRO 32 HB3 PRO 32 13.957 26.531 24.645
227 HG2 PRO 32 HG2 PRO 32 14.871 29.341 24.073
228 HG3 PRO 32 HG3 PRO 32 14.686 28.532 25.662
229 HD2 PRO 32 HD2 PRO 32 17.119 28.753 24.481
230 HD3 PRO 32 HD3 PRO 32 16.671 27.227 25.307
231 H TYR 33 H TYR 33 14.558 25.218 21.047
232 HA TYR 33 HA TYR 33 13.403 27.288 19.207
233 HB2 TYR 33 HB2 TYR 33 15.679 25.492 18.492
234 HB3 TYR 33 HB3 TYR 33 14.532 25.957 17.271
235 HD1 TYR 33 HD2 TYR 33 17.040 27.413 19.621
236 HD2 TYR 33 HD1 TYR 33 14.426 28.104 16.270
237 HE1 TYR 33 HE2 TYR 33 18.212 29.567 19.149
238 HE2 TYR 33 HE1 TYR 33 15.601 30.250 15.797
239 HH TYR 33 HH TYR 33 17.247 31.706 16.426
Start of MODEL 10
1 H1 GLY 1 H1 GLY 1 38.906 21.395 26.935
2 H2 GLY 1 H2 GLY 1 38.181 20.266 25.987
3 H3 GLY 1 H3 GLY 1 39.167 21.397 25.311
4 HA2 GLY 1 HA2 GLY 1 41.045 20.495 26.594
5 HA3 GLY 1 HA3 GLY 1 39.941 19.187 27.090
6 H SER 2 H SER 2 42.411 19.590 25.253
7 HA SER 2 HA SER 2 43.298 18.894 23.310
8 HB2 SER 2 HB2 SER 2 43.191 16.454 23.079
9 HB3 SER 2 HB3 SER 2 43.536 17.036 24.702
10 HG SER 2 HG SER 2 42.038 15.264 24.461
11 H ALA 3 H ALA 3 40.238 17.128 22.845
12 HA ALA 3 HA ALA 3 40.205 17.491 19.978
13 HB1 ALA 3 HB1 ALA 3 38.157 16.492 21.993
14 HB2 ALA 3 HB2 ALA 3 38.001 16.349 20.236
15 HB3 ALA 3 HB3 ALA 3 39.303 15.503 21.088
16 H PHE 4 H PHE 4 37.993 18.226 19.090
17 HA PHE 4 HA PHE 4 37.162 20.856 20.249
18 HB2 PHE 4 HB2 PHE 4 38.554 21.033 18.155
19 HB3 PHE 4 HB3 PHE 4 37.269 20.194 17.294
20 HD1 PHE 4 HD2 PHE 4 38.095 23.265 19.275
21 HD2 PHE 4 HD1 PHE 4 35.303 21.402 16.566
22 HE1 PHE 4 HE2 PHE 4 36.891 25.423 19.016
23 HE2 PHE 4 HE1 PHE 4 34.082 23.548 16.348
24 HZ PHE 4 HZ PHE 4 34.864 25.563 17.586
25 H CYS 5 H CYS 5 34.949 21.500 19.817
26 HA CYS 5 HA CYS 5 33.112 19.387 20.438
27 HB2 CYS 5 HB2 CYS 5 31.456 21.188 20.515
28 HB3 CYS 5 HB3 CYS 5 32.923 21.624 21.370
29 H ASN 6 H ASN 6 30.982 19.146 19.359
30 HA ASN 6 HA ASN 6 30.989 19.619 16.399
31 HB2 ASN 6 HB2 ASN 6 31.025 17.060 17.351
32 HB3 ASN 6 HB3 ASN 6 29.376 17.442 17.715
33 HD21 ASN 6 HD22 ASN 6 31.772 16.913 15.187
34 HD22 ASN 6 HD21 ASN 6 30.601 16.822 13.866
35 H LEU 7 H LEU 7 28.874 19.870 15.479
36 HA LEU 7 HA LEU 7 26.927 21.098 17.335
37 HB2 LEU 7 HB2 LEU 7 28.625 22.630 16.119
38 HB3 LEU 7 HB3 LEU 7 27.703 22.255 14.653
39 HG LEU 7 HG LEU 7 26.168 23.035 17.052
40 HD11 LEU 7 HD11 LEU 7 28.027 24.686 16.961
41 HD12 LEU 7 HD12 LEU 7 27.695 24.960 15.254
42 HD13 LEU 7 HD13 LEU 7 26.497 25.447 16.458
43 HD21 LEU 7 HD21 LEU 7 24.957 22.498 14.933
44 HD22 LEU 7 HD22 LEU 7 24.758 24.178 15.412
45 HD23 LEU 7 HD23 LEU 7 25.894 23.751 14.111
46 H ARG 8 H ARG 8 27.378 19.620 14.069
47 HA ARG 8 HA ARG 8 24.632 19.075 13.652
48 HB2 ARG 8 HB2 ARG 8 26.154 18.545 11.884
49 HB3 ARG 8 HB3 ARG 8 27.218 17.638 12.945
50 HG2 ARG 8 HG2 ARG 8 26.203 16.090 11.457
51 HG3 ARG 8 HG3 ARG 8 25.580 15.789 13.072
52 HD2 ARG 8 HD2 ARG 8 23.552 17.218 12.370
53 HD3 ARG 8 HD3 ARG 8 24.167 17.094 10.713
54 HE ARG 8 HE ARG 8 24.101 14.466 11.782
55 HH11 ARG 8 HH11 ARG 8 21.643 16.883 11.041
56 HH12 ARG 8 HH12 ARG 8 20.365 15.712 11.144
57 HH21 ARG 8 HH21 ARG 8 22.437 13.013 11.629
58 HH22 ARG 8 HH22 ARG 8 20.796 13.629 11.679
59 H ALA 9 H ALA 9 26.946 17.178 15.602
60 HA ALA 9 HA ALA 9 25.081 15.293 16.632
61 HB1 ALA 9 HB1 ALA 9 27.492 14.907 16.387
62 HB2 ALA 9 HB2 ALA 9 27.788 16.109 17.659
63 HB3 ALA 9 HB3 ALA 9 26.908 14.631 18.046
64 H CYS 10 H CYS 10 26.112 18.539 17.696
65 HA CYS 10 HA CYS 10 24.898 18.413 20.319
66 HB2 CYS 10 HB2 CYS 10 26.650 20.080 19.444
67 HB3 CYS 10 HB3 CYS 10 25.294 20.877 18.623
68 H GLU 11 H GLU 11 23.842 19.921 17.207
69 HA GLU 11 HA GLU 11 21.294 20.691 17.841
70 HB2 GLU 11 HB2 GLU 11 22.584 19.741 15.320
71 HB3 GLU 11 HB3 GLU 11 20.854 20.059 15.318
72 HG2 GLU 11 HG2 GLU 11 22.706 22.153 16.450
73 HG3 GLU 11 HG3 GLU 11 22.602 21.950 14.712
74 H LEU 12 H LEU 12 22.213 17.407 16.668
75 HA LEU 12 HA LEU 12 19.514 16.424 16.977
76 HB2 LEU 12 HB2 LEU 12 20.399 14.284 16.234
77 HB3 LEU 12 HB3 LEU 12 20.915 15.617 15.219
78 HG LEU 12 HG LEU 12 23.089 15.582 16.653
79 HD11 LEU 12 HD11 LEU 12 23.759 13.291 17.376
80 HD12 LEU 12 HD12 LEU 12 22.474 13.952 18.375
81 HD13 LEU 12 HD13 LEU 12 22.083 12.759 17.120
82 HD21 LEU 12 HD21 LEU 12 22.971 14.980 14.265
83 HD22 LEU 12 HD22 LEU 12 24.065 13.874 15.100
84 HD23 LEU 12 HD23 LEU 12 22.421 13.344 14.686
85 H SER 13 H SER 13 21.971 16.903 19.275
86 HA SER 13 HA SER 13 20.795 14.968 21.193
87 HB2 SER 13 HB2 SER 13 23.053 16.957 21.608
88 HB3 SER 13 HB3 SER 13 22.502 15.721 22.751
89 HG SER 13 HG SER 13 23.775 15.405 20.241
90 H CYS 14 H CYS 14 20.704 18.364 20.341
91 HA CYS 14 HA CYS 14 19.236 19.151 22.751
92 HB2 CYS 14 HB2 CYS 14 20.065 20.635 20.238
93 HB3 CYS 14 HB3 CYS 14 19.281 21.372 21.650
94 H ARG 15 H ARG 15 18.427 18.368 19.372
95 HA ARG 15 HA ARG 15 15.729 19.144 19.235
96 HB2 ARG 15 HB2 ARG 15 17.403 17.788 17.588
97 HB3 ARG 15 HB3 ARG 15 16.634 16.400 18.318
98 HG2 ARG 15 HG2 ARG 15 15.152 16.636 16.623
99 HG3 ARG 15 HG3 ARG 15 14.406 17.862 17.651
100 HD2 ARG 15 HD2 ARG 15 16.394 18.280 15.373
101 HD3 ARG 15 HD3 ARG 15 14.691 18.727 15.387
102 HE ARG 15 HE ARG 15 15.191 20.436 17.107
103 HH11 ARG 15 HH11 ARG 15 18.109 19.340 15.282
104 HH12 ARG 15 HH12 ARG 15 18.877 20.851 15.747
105 HH21 ARG 15 HH21 ARG 15 16.589 22.066 17.745
106 HH22 ARG 15 HH22 ARG 15 18.142 22.198 16.899
107 H SER 16 H SER 16 17.225 16.504 20.985
108 HA SER 16 HA SER 16 15.025 15.009 21.788
109 HB2 SER 16 HB2 SER 16 17.568 15.448 23.373
110 HB3 SER 16 HB3 SER 16 16.560 13.980 23.318
111 HG SER 16 HG SER 16 18.460 13.846 21.967
112 H LEU 17 H LEU 17 16.119 18.121 23.113
113 HA LEU 17 HA LEU 17 14.397 17.957 25.520
114 HB2 LEU 17 HB2 LEU 17 16.219 19.966 24.237
115 HB3 LEU 17 HB3 LEU 17 15.331 20.296 25.741
116 HG LEU 17 HG LEU 17 17.320 18.102 25.480
117 HD11 LEU 17 HD11 LEU 17 18.554 20.099 25.002
118 HD12 LEU 17 HD12 LEU 17 18.036 20.799 26.570
119 HD13 LEU 17 HD13 LEU 17 19.039 19.342 26.519
120 HD21 LEU 17 HD21 LEU 17 17.374 18.379 27.993
121 HD22 LEU 17 HD22 LEU 17 16.258 19.759 27.808
122 HD23 LEU 17 HD23 LEU 17 15.711 18.099 27.444
123 H GLY 18 H GLY 18 14.069 18.711 22.189
124 HA2 GLY 18 HA2 GLY 18 12.700 20.108 20.954
125 HA3 GLY 18 HA3 GLY 18 11.915 20.698 22.422
126 H LEU 19 H LEU 19 15.482 20.745 22.146
127 HA LEU 19 HA LEU 19 15.440 23.727 22.167
128 HB2 LEU 19 HB2 LEU 19 17.589 21.774 22.893
129 HB3 LEU 19 HB3 LEU 19 17.776 23.507 22.961
130 HG LEU 19 HG LEU 19 16.942 21.734 24.911
131 HD11 LEU 19 HD11 LEU 19 16.877 23.624 26.499
132 HD12 LEU 19 HD12 LEU 19 18.344 23.471 25.610
133 HD13 LEU 19 HD13 LEU 19 17.151 24.706 25.138
134 HD21 LEU 19 HD21 LEU 19 14.596 21.962 24.479
135 HD22 LEU 19 HD22 LEU 19 14.942 22.868 25.918
136 HD23 LEU 19 HD23 LEU 19 14.719 23.699 24.377
137 H LEU 20 H LEU 20 17.544 24.562 21.307
138 HA LEU 20 HA LEU 20 18.187 23.580 18.542
139 HB2 LEU 20 HB2 LEU 20 17.139 25.873 18.755
140 HB3 LEU 20 HB3 LEU 20 18.535 26.350 19.723
141 HG LEU 20 HG LEU 20 19.946 25.632 17.624
142 HD11 LEU 20 HD11 LEU 20 18.713 25.869 15.491
143 HD12 LEU 20 HD12 LEU 20 18.097 24.493 16.417
144 HD13 LEU 20 HD13 LEU 20 17.187 26.022 16.384
145 HD21 LEU 20 HD21 LEU 20 18.117 28.035 17.425
146 HD22 LEU 20 HD22 LEU 20 19.624 27.986 18.355
147 HD23 LEU 20 HD23 LEU 20 19.646 27.820 16.575
148 H GLY 21 H GLY 21 20.301 22.952 18.168
149 HA2 GLY 21 HA2 GLY 21 22.167 23.005 20.468
150 HA3 GLY 21 HA3 GLY 21 22.363 22.074 19.003
151 H LYS 22 H LYS 22 23.837 24.243 20.629
152 HA LYS 22 HA LYS 22 25.257 25.423 18.291
153 HB2 LYS 22 HB2 LYS 22 24.616 26.841 20.921
154 HB3 LYS 22 HB3 LYS 22 25.686 27.470 19.683
155 HG2 LYS 22 HG2 LYS 22 22.695 27.037 19.436
156 HG3 LYS 22 HG3 LYS 22 23.554 28.575 19.601
157 HD2 LYS 22 HD2 LYS 22 24.642 28.207 17.394
158 HD3 LYS 22 HD3 LYS 22 23.760 26.688 17.235
159 HE2 LYS 22 HE2 LYS 22 21.602 27.962 17.474
160 HE3 LYS 22 HE3 LYS 22 22.530 29.468 17.470
161 HZ1 LYS 22 HZ1 LYS 22 22.420 27.493 15.254
162 HZ2 LYS 22 HZ2 LYS 22 21.706 28.988 15.258
163 HZ3 LYS 22 HZ3 LYS 22 23.329 28.886 15.256
164 H CYS 23 H CYS 23 27.478 25.740 18.643
165 HA CYS 23 HA CYS 23 28.588 24.605 21.206
166 HB2 CYS 23 HB2 CYS 23 29.467 23.293 19.402
167 HB3 CYS 23 HB3 CYS 23 29.997 24.748 18.539
168 H ILE 24 H ILE 24 29.365 25.966 22.585
169 HA ILE 24 HA ILE 24 30.502 28.601 21.810
170 HB ILE 24 HB ILE 24 28.406 28.241 23.981
171 HG12 ILE 24 HG12 ILE 24 27.327 28.257 21.746
172 HG13 ILE 24 HG13 ILE 24 26.886 29.609 22.760
173 HG21 ILE 24 HG21 ILE 24 30.011 29.916 24.665
174 HG22 ILE 24 HG22 ILE 24 29.950 30.715 23.085
175 HG23 ILE 24 HG23 ILE 24 28.541 30.740 24.167
176 HD11 ILE 24 HD11 ILE 24 28.948 29.816 20.514
177 HD12 ILE 24 HD12 ILE 24 27.224 30.226 20.373
178 HD13 ILE 24 HD13 ILE 24 28.257 31.142 21.470
179 H GLY 25 H GLY 25 32.260 29.152 23.127
180 HA2 GLY 25 HA2 GLY 25 34.002 28.821 24.588
181 HA3 GLY 25 HA3 GLY 25 32.827 28.069 25.686
182 H GLU 26 H GLU 26 33.691 26.911 22.444
183 HA GLU 26 HA GLU 26 34.062 24.856 21.642
184 HB2 GLU 26 HB2 GLU 26 36.128 24.512 23.823
185 HB3 GLU 26 HB3 GLU 26 36.043 23.701 22.257
186 HG2 GLU 26 HG2 GLU 26 36.322 25.954 21.152
187 HG3 GLU 26 HG3 GLU 26 36.645 26.634 22.748
188 H GLU 27 H GLU 27 31.914 24.954 23.768
189 HA GLU 27 HA GLU 27 31.666 21.998 24.025
190 HB2 GLU 27 HB2 GLU 27 31.321 24.124 26.166
191 HB3 GLU 27 HB3 GLU 27 30.528 22.565 26.273
192 HG2 GLU 27 HG2 GLU 27 33.539 23.036 26.135
193 HG3 GLU 27 HG3 GLU 27 32.613 22.611 27.572
194 H CYS 28 H CYS 28 29.650 21.132 23.811
195 HA CYS 28 HA CYS 28 27.704 22.515 22.266
196 HB2 CYS 28 HB2 CYS 28 28.043 20.166 22.006
197 HB3 CYS 28 HB3 CYS 28 27.758 19.862 23.719
198 H LYS 29 H LYS 29 25.853 23.458 22.700
199 HA LYS 29 HA LYS 29 24.657 23.658 25.435
200 HB2 LYS 29 HB2 LYS 29 24.885 25.841 23.312
201 HB3 LYS 29 HB3 LYS 29 24.199 26.012 24.911
202 HG2 LYS 29 HG2 LYS 29 27.139 25.530 24.281
203 HG3 LYS 29 HG3 LYS 29 26.392 27.088 24.620
204 HD2 LYS 29 HD2 LYS 29 25.774 26.343 26.880
205 HD3 LYS 29 HD3 LYS 29 26.553 24.777 26.608
206 HE2 LYS 29 HE2 LYS 29 27.995 27.459 26.324
207 HE3 LYS 29 HE3 LYS 29 27.893 26.587 27.857
208 HZ1 LYS 29 HZ1 LYS 29 29.156 25.483 25.402
209 HZ2 LYS 29 HZ2 LYS 29 29.932 26.071 26.725
210 HZ3 LYS 29 HZ3 LYS 29 29.002 24.731 26.880
211 H CYS 30 H CYS 30 22.338 23.471 25.439
212 HA CYS 30 HA CYS 30 20.855 23.472 22.869
213 HB2 CYS 30 HB2 CYS 30 20.152 22.268 25.526
214 HB3 CYS 30 HB3 CYS 30 19.345 22.122 23.984
215 H VAL 31 H VAL 31 19.678 25.252 22.562
216 HA VAL 31 HA VAL 31 18.835 26.829 24.947
217 HB VAL 31 HB VAL 31 18.924 28.835 23.743
218 HG11 VAL 31 HG11 VAL 31 21.560 27.346 23.317
219 HG12 VAL 31 HG12 VAL 31 21.340 29.090 23.504
220 HG13 VAL 31 HG13 VAL 31 21.008 28.003 24.867
221 HG21 VAL 31 HG21 VAL 31 18.457 28.101 21.427
222 HG22 VAL 31 HG22 VAL 31 19.984 28.992 21.474
223 HG23 VAL 31 HG23 VAL 31 20.000 27.216 21.387
224 HA PRO 32 HA PRO 32 14.995 25.643 24.066
225 HB2 PRO 32 HB2 PRO 32 13.286 27.571 25.111
226 HB3 PRO 32 HB3 PRO 32 14.184 26.319 26.019
227 HG2 PRO 32 HG2 PRO 32 14.987 29.194 25.501
228 HG3 PRO 32 HG3 PRO 32 15.134 28.248 27.019
229 HD2 PRO 32 HD2 PRO 32 17.279 28.586 25.425
230 HD3 PRO 32 HD3 PRO 32 16.979 26.954 26.112
231 H TYR 33 H TYR 33 14.109 25.197 22.326
232 HA TYR 33 HA TYR 33 13.056 27.366 20.513
233 HB2 TYR 33 HB2 TYR 33 14.972 25.272 19.933
234 HB3 TYR 33 HB3 TYR 33 13.623 25.252 18.823
235 HD1 TYR 33 HD2 TYR 33 15.857 27.744 20.526
236 HD2 TYR 33 HD1 TYR 33 13.731 26.676 16.929
237 HE1 TYR 33 HE2 TYR 33 16.771 29.757 19.393
238 HE2 TYR 33 HE1 TYR 33 14.710 28.658 15.771
239 HH TYR 33 HH TYR 33 16.932 30.904 17.471
Start of MODEL 11
1 H1 GLY 1 H1 GLY 1 37.737 27.853 20.217
2 H2 GLY 1 H2 GLY 1 38.521 28.324 21.594
3 H3 GLY 1 H3 GLY 1 37.251 29.194 21.042
4 HA2 GLY 1 HA2 GLY 1 37.088 26.434 22.046
5 HA3 GLY 1 HA3 GLY 1 36.645 27.877 22.955
6 H SER 2 H SER 2 34.955 29.356 21.677
7 HA SER 2 HA SER 2 32.612 27.756 21.160
8 HB2 SER 2 HB2 SER 2 33.172 30.675 20.563
9 HB3 SER 2 HB3 SER 2 31.574 29.894 20.629
10 HG SER 2 HG SER 2 32.477 31.071 22.550
11 H ALA 3 H ALA 3 31.408 27.709 19.217
12 HA ALA 3 HA ALA 3 31.191 26.963 17.071
13 HB1 ALA 3 HB1 ALA 3 31.188 29.420 16.803
14 HB2 ALA 3 HB2 ALA 3 32.934 29.376 16.468
15 HB3 ALA 3 HB3 ALA 3 31.798 28.568 15.373
16 H PHE 4 H PHE 4 33.431 25.676 18.457
17 HA PHE 4 HA PHE 4 34.957 24.700 16.107
18 HB2 PHE 4 HB2 PHE 4 36.042 26.473 17.705
19 HB3 PHE 4 HB3 PHE 4 36.257 25.131 18.805
20 HD1 PHE 4 HD2 PHE 4 36.778 25.863 15.121
21 HD2 PHE 4 HD1 PHE 4 38.440 24.215 18.750
22 HE1 PHE 4 HE2 PHE 4 38.903 25.383 13.931
23 HE2 PHE 4 HE1 PHE 4 40.579 23.775 17.565
24 HZ PHE 4 HZ PHE 4 40.811 24.349 15.159
25 H CYS 5 H CYS 5 32.739 23.683 17.760
26 HA CYS 5 HA CYS 5 33.610 20.879 17.919
27 HB2 CYS 5 HB2 CYS 5 32.532 20.542 19.953
28 HB3 CYS 5 HB3 CYS 5 33.652 21.850 20.190
29 H ASN 6 H ASN 6 31.986 19.354 17.705
30 HA ASN 6 HA ASN 6 30.677 19.899 15.282
31 HB2 ASN 6 HB2 ASN 6 30.490 17.594 17.244
32 HB3 ASN 6 HB3 ASN 6 29.761 17.534 15.650
33 HD21 ASN 6 HD22 ASN 6 31.954 15.811 16.755
34 HD22 ASN 6 HD21 ASN 6 33.328 16.111 15.710
35 H LEU 7 H LEU 7 28.787 20.471 14.629
36 HA LEU 7 HA LEU 7 26.731 21.039 16.663
37 HB2 LEU 7 HB2 LEU 7 27.980 22.722 14.772
38 HB3 LEU 7 HB3 LEU 7 26.401 22.357 14.056
39 HG LEU 7 HG LEU 7 25.389 22.852 16.352
40 HD11 LEU 7 HD11 LEU 7 27.931 22.737 17.338
41 HD12 LEU 7 HD12 LEU 7 27.811 24.467 17.020
42 HD13 LEU 7 HD13 LEU 7 26.609 23.634 18.064
43 HD21 LEU 7 HD21 LEU 7 26.837 25.056 14.839
44 HD22 LEU 7 HD22 LEU 7 25.191 24.458 14.553
45 HD23 LEU 7 HD23 LEU 7 25.565 25.329 16.047
46 H ARG 8 H ARG 8 27.103 19.721 13.434
47 HA ARG 8 HA ARG 8 24.442 18.428 13.567
48 HB2 ARG 8 HB2 ARG 8 26.851 18.160 11.736
49 HB3 ARG 8 HB3 ARG 8 25.474 17.075 11.548
50 HG2 ARG 8 HG2 ARG 8 24.960 20.053 11.742
51 HG3 ARG 8 HG3 ARG 8 25.604 19.378 10.241
52 HD2 ARG 8 HD2 ARG 8 23.344 19.256 9.810
53 HD3 ARG 8 HD3 ARG 8 23.672 17.631 10.419
54 HE ARG 8 HE ARG 8 22.715 19.688 12.355
55 HH11 ARG 8 HH21 ARG 8 21.668 16.855 10.466
56 HH12 ARG 8 HH22 ARG 8 20.047 17.061 11.131
57 HH21 ARG 8 HH11 ARG 8 20.744 19.827 12.950
58 HH22 ARG 8 HH12 ARG 8 19.565 18.566 12.512
59 H ALA 9 H ALA 9 26.397 18.053 15.660
60 HA ALA 9 HA ALA 9 25.444 15.329 16.316
61 HB1 ALA 9 HB1 ALA 9 27.483 15.192 17.836
62 HB2 ALA 9 HB2 ALA 9 27.912 15.269 16.114
63 HB3 ALA 9 HB3 ALA 9 28.062 16.721 17.112
64 H CYS 10 H CYS 10 26.253 18.650 17.374
65 HA CYS 10 HA CYS 10 25.051 18.425 20.003
66 HB2 CYS 10 HB2 CYS 10 26.750 20.165 19.352
67 HB3 CYS 10 HB3 CYS 10 25.498 20.923 18.356
68 H GLU 11 H GLU 11 23.877 19.869 16.962
69 HA GLU 11 HA GLU 11 21.328 20.766 17.705
70 HB2 GLU 11 HB2 GLU 11 22.331 19.604 15.096
71 HB3 GLU 11 HB3 GLU 11 20.740 20.319 15.317
72 HG2 GLU 11 HG2 GLU 11 21.911 22.434 16.072
73 HG3 GLU 11 HG3 GLU 11 23.421 21.747 15.510
74 H LEU 12 H LEU 12 22.448 17.524 17.113
75 HA LEU 12 HA LEU 12 19.788 16.313 17.001
76 HB2 LEU 12 HB2 LEU 12 22.441 14.885 17.385
77 HB3 LEU 12 HB3 LEU 12 20.970 14.271 16.641
78 HG LEU 12 HG LEU 12 22.932 16.303 15.435
79 HD11 LEU 12 HD11 LEU 12 23.297 14.461 13.810
80 HD12 LEU 12 HD12 LEU 12 23.713 13.957 15.460
81 HD13 LEU 12 HD13 LEU 12 22.183 13.437 14.719
82 HD21 LEU 12 HD21 LEU 12 20.639 16.832 14.665
83 HD22 LEU 12 HD22 LEU 12 21.560 16.038 13.371
84 HD23 LEU 12 HD23 LEU 12 20.360 15.120 14.290
85 H SER 13 H SER 13 22.505 16.453 19.342
86 HA SER 13 HA SER 13 21.261 14.956 21.453
87 HB2 SER 13 HB2 SER 13 23.690 15.437 21.299
88 HB3 SER 13 HB3 SER 13 23.366 17.157 21.561
89 HG SER 13 HG SER 13 23.025 14.968 23.343
90 H CYS 14 H CYS 14 21.327 18.477 20.777
91 HA CYS 14 HA CYS 14 19.660 19.213 23.005
92 HB2 CYS 14 HB2 CYS 14 20.427 20.544 20.386
93 HB3 CYS 14 HB3 CYS 14 19.416 21.330 21.616
94 H ARG 15 H ARG 15 18.847 17.843 19.852
95 HA ARG 15 HA ARG 15 16.142 18.745 19.717
96 HB2 ARG 15 HB2 ARG 15 17.713 17.440 17.977
97 HB3 ARG 15 HB3 ARG 15 17.025 16.011 18.740
98 HG2 ARG 15 HG2 ARG 15 15.761 16.581 16.789
99 HG3 ARG 15 HG3 ARG 15 14.756 16.860 18.207
100 HD2 ARG 15 HD2 ARG 15 16.238 19.291 17.551
101 HD3 ARG 15 HD3 ARG 15 15.461 18.690 16.098
102 HE ARG 15 HE ARG 15 13.333 18.547 17.654
103 HH11 ARG 15 HH11 ARG 15 15.609 21.264 17.967
104 HH12 ARG 15 HH12 ARG 15 14.225 22.351 18.152
105 HH21 ARG 15 HH22 ARG 15 11.798 20.109 18.203
106 HH22 ARG 15 HH21 ARG 15 12.361 21.771 18.314
107 H SER 16 H SER 16 17.668 16.370 21.730
108 HA SER 16 HA SER 16 15.434 14.845 22.554
109 HB2 SER 16 HB2 SER 16 17.832 15.750 24.188
110 HB3 SER 16 HB3 SER 16 16.676 14.496 24.675
111 HG SER 16 HG SER 16 18.432 13.560 23.735
112 H LEU 17 H LEU 17 16.385 18.179 23.564
113 HA LEU 17 HA LEU 17 14.410 18.368 25.713
114 HB2 LEU 17 HB2 LEU 17 16.157 20.259 24.160
115 HB3 LEU 17 HB3 LEU 17 15.185 20.760 25.561
116 HG LEU 17 HG LEU 17 17.354 18.731 25.699
117 HD11 LEU 17 HD11 LEU 17 18.902 20.237 26.646
118 HD12 LEU 17 HD12 LEU 17 18.449 20.724 25.018
119 HD13 LEU 17 HD13 LEU 17 17.786 21.600 26.439
120 HD21 LEU 17 HD21 LEU 17 17.245 19.334 28.148
121 HD22 LEU 17 HD22 LEU 17 16.042 20.590 27.723
122 HD23 LEU 17 HD23 LEU 17 15.634 18.857 27.579
123 H GLY 18 H GLY 18 14.277 18.511 22.291
124 HA2 GLY 18 HA2 GLY 18 12.925 19.610 20.747
125 HA3 GLY 18 HA3 GLY 18 12.061 20.428 22.057
126 H LEU 19 H LEU 19 15.662 20.558 21.900
127 HA LEU 19 HA LEU 19 15.457 23.479 21.376
128 HB2 LEU 19 HB2 LEU 19 17.635 21.874 22.629
129 HB3 LEU 19 HB3 LEU 19 17.697 23.601 22.382
130 HG LEU 19 HG LEU 19 16.807 22.148 24.558
131 HD11 LEU 19 HD11 LEU 19 16.594 24.200 25.793
132 HD12 LEU 19 HD12 LEU 19 18.022 24.277 24.812
133 HD13 LEU 19 HD13 LEU 19 16.557 25.127 24.298
134 HD21 LEU 19 HD21 LEU 19 14.506 23.790 23.511
135 HD22 LEU 19 HD22 LEU 19 14.498 22.095 23.931
136 HD23 LEU 19 HD23 LEU 19 14.668 23.274 25.188
137 H LEU 20 H LEU 20 17.469 24.373 20.561
138 HA LEU 20 HA LEU 20 18.472 23.112 18.030
139 HB2 LEU 20 HB2 LEU 20 17.252 25.386 17.970
140 HB3 LEU 20 HB3 LEU 20 18.588 26.022 18.913
141 HG LEU 20 HG LEU 20 20.099 25.252 16.972
142 HD11 LEU 20 HD11 LEU 20 17.355 25.066 15.636
143 HD12 LEU 20 HD12 LEU 20 18.913 25.046 14.782
144 HD13 LEU 20 HD13 LEU 20 18.487 23.716 15.869
145 HD21 LEU 20 HD21 LEU 20 19.454 27.619 17.348
146 HD22 LEU 20 HD22 LEU 20 19.550 27.242 15.618
147 HD23 LEU 20 HD23 LEU 20 17.965 27.359 16.413
148 H GLY 21 H GLY 21 20.765 22.864 17.861
149 HA2 GLY 21 HA2 GLY 21 22.248 23.147 20.435
150 HA3 GLY 21 HA3 GLY 21 22.655 22.052 19.127
151 H LYS 22 H LYS 22 23.846 24.504 20.681
152 HA LYS 22 HA LYS 22 25.465 25.549 18.400
153 HB2 LYS 22 HB2 LYS 22 24.502 27.063 20.875
154 HB3 LYS 22 HB3 LYS 22 25.711 27.659 19.746
155 HG2 LYS 22 HG2 LYS 22 22.797 27.125 19.115
156 HG3 LYS 22 HG3 LYS 22 23.597 28.703 19.321
157 HD2 LYS 22 HD2 LYS 22 25.076 28.057 17.347
158 HD3 LYS 22 HD3 LYS 22 23.995 26.677 17.087
159 HE2 LYS 22 HE2 LYS 22 22.074 28.276 16.903
160 HE3 LYS 22 HE3 LYS 22 23.204 29.628 17.158
161 HZ1 LYS 22 HZ1 LYS 22 24.371 28.779 15.084
162 HZ2 LYS 22 HZ2 LYS 22 23.104 27.835 14.810
163 HZ3 LYS 22 HZ3 LYS 22 22.830 29.449 14.870
164 H CYS 23 H CYS 23 27.526 25.692 18.684
165 HA CYS 23 HA CYS 23 28.824 24.372 21.000
166 HB2 CYS 23 HB2 CYS 23 29.533 23.796 18.749
167 HB3 CYS 23 HB3 CYS 23 29.970 25.483 18.423
168 H ILE 24 H ILE 24 29.408 25.456 22.759
169 HA ILE 24 HA ILE 24 30.714 28.140 22.523
170 HB ILE 24 HB ILE 24 28.780 27.318 24.708
171 HG12 ILE 24 HG12 ILE 24 27.532 27.862 22.650
172 HG13 ILE 24 HG13 ILE 24 27.262 29.004 23.949
173 HG21 ILE 24 HG21 ILE 24 30.552 28.753 25.586
174 HG22 ILE 24 HG22 ILE 24 30.335 29.911 24.266
175 HG23 ILE 24 HG23 ILE 24 29.058 29.676 25.478
176 HD11 ILE 24 HD11 ILE 24 28.617 30.707 22.866
177 HD12 ILE 24 HD12 ILE 24 29.131 29.568 21.605
178 HD13 ILE 24 HD13 ILE 24 27.436 30.076 21.709
179 H GLY 25 H GLY 25 32.709 28.150 23.425
180 HA2 GLY 25 HA2 GLY 25 34.622 27.345 24.439
181 HA3 GLY 25 HA3 GLY 25 33.561 26.938 25.778
182 H GLU 26 H GLU 26 33.762 25.463 22.529
183 HA GLU 26 HA GLU 26 33.585 23.376 21.833
184 HB2 GLU 26 HB2 GLU 26 35.887 22.927 23.734
185 HB3 GLU 26 HB3 GLU 26 35.288 21.728 22.586
186 HG2 GLU 26 HG2 GLU 26 35.621 23.423 20.735
187 HG3 GLU 26 HG3 GLU 26 36.520 24.393 21.916
188 H GLU 27 H GLU 27 31.749 24.003 24.144
189 HA GLU 27 HA GLU 27 30.913 21.184 24.639
190 HB2 GLU 27 HB2 GLU 27 30.285 23.654 26.283
191 HB3 GLU 27 HB3 GLU 27 29.686 22.041 26.580
192 HG2 GLU 27 HG2 GLU 27 32.591 22.939 26.784
193 HG3 GLU 27 HG3 GLU 27 31.499 22.630 28.117
194 H CYS 28 H CYS 28 28.700 20.748 24.503
195 HA CYS 28 HA CYS 28 27.291 22.284 22.410
196 HB2 CYS 28 HB2 CYS 28 27.545 19.931 22.055
197 HB3 CYS 28 HB3 CYS 28 26.978 19.546 23.664
198 H LYS 29 H LYS 29 25.931 23.836 22.969
199 HA LYS 29 HA LYS 29 24.242 23.630 25.439
200 HB2 LYS 29 HB2 LYS 29 25.251 26.088 23.948
201 HB3 LYS 29 HB3 LYS 29 24.177 26.105 25.339
202 HG2 LYS 29 HG2 LYS 29 27.086 25.187 25.324
203 HG3 LYS 29 HG3 LYS 29 26.437 26.680 26.004
204 HD2 LYS 29 HD2 LYS 29 25.026 25.256 27.571
205 HD3 LYS 29 HD3 LYS 29 25.942 23.844 26.999
206 HE2 LYS 29 HE2 LYS 29 28.059 24.937 27.731
207 HE3 LYS 29 HE3 LYS 29 27.124 26.324 28.318
208 HZ1 LYS 29 HZ1 LYS 29 25.972 24.800 29.838
209 HZ2 LYS 29 HZ2 LYS 29 26.901 23.542 29.347
210 HZ3 LYS 29 HZ3 LYS 29 27.568 24.824 30.139
211 H CYS 30 H CYS 30 21.980 23.955 25.291
212 HA CYS 30 HA CYS 30 20.813 23.851 22.615
213 HB2 CYS 30 HB2 CYS 30 19.839 23.069 25.332
214 HB3 CYS 30 HB3 CYS 30 19.203 22.642 23.762
215 H VAL 31 H VAL 31 19.438 25.418 21.945
216 HA VAL 31 HA VAL 31 18.318 27.306 23.960
217 HB VAL 31 HB VAL 31 18.335 29.122 22.382
218 HG11 VAL 31 HG11 VAL 31 20.674 29.759 22.652
219 HG12 VAL 31 HG12 VAL 31 20.129 28.901 24.095
220 HG13 VAL 31 HG13 VAL 31 21.151 28.071 22.906
221 HG21 VAL 31 HG21 VAL 31 19.870 29.096 20.422
222 HG22 VAL 31 HG22 VAL 31 20.189 27.371 20.698
223 HG23 VAL 31 HG23 VAL 31 18.563 27.923 20.236
224 HA PRO 32 HA PRO 32 14.812 25.594 22.715
225 HB2 PRO 32 HB2 PRO 32 12.755 27.313 23.393
226 HB3 PRO 32 HB3 PRO 32 13.766 26.366 24.524
227 HG2 PRO 32 HG2 PRO 32 14.145 29.240 23.670
228 HG3 PRO 32 HG3 PRO 32 14.243 28.547 25.326
229 HD2 PRO 32 HD2 PRO 32 16.503 29.012 23.924
230 HD3 PRO 32 HD3 PRO 32 16.332 27.455 24.821
231 H TYR 33 H TYR 33 14.196 24.892 20.961
232 HA TYR 33 HA TYR 33 12.669 26.605 19.014
233 HB2 TYR 33 HB2 TYR 33 15.196 25.151 18.349
234 HB3 TYR 33 HB3 TYR 33 13.979 25.434 17.135
235 HD1 TYR 33 HD2 TYR 33 16.363 27.208 19.364
236 HD2 TYR 33 HD1 TYR 33 13.550 27.536 16.126
237 HE1 TYR 33 HE2 TYR 33 17.253 29.470 18.824
238 HE2 TYR 33 HE1 TYR 33 14.451 29.795 15.573
239 HH TYR 33 HH TYR 33 17.136 31.253 17.446
Start of MODEL 12
1 H1 GLY 1 H1 GLY 1 42.747 24.010 20.792
2 H2 GLY 1 H2 GLY 1 41.635 25.090 20.265
3 H3 GLY 1 H3 GLY 1 41.138 23.676 20.957
4 HA2 GLY 1 HA2 GLY 1 42.563 25.866 22.312
5 HA3 GLY 1 HA3 GLY 1 40.846 25.471 22.517
6 H SER 2 H SER 2 40.258 23.798 23.859
7 HA SER 2 HA SER 2 42.425 22.002 24.946
8 HB2 SER 2 HB2 SER 2 40.099 23.329 26.373
9 HB3 SER 2 HB3 SER 2 40.863 21.855 26.981
10 HG SER 2 HG SER 2 42.239 24.313 26.451
11 H ALA 3 H ALA 3 39.085 22.264 23.753
12 HA ALA 3 HA ALA 3 38.777 19.291 23.899
13 HB1 ALA 3 HB1 ALA 3 37.695 20.439 25.778
14 HB2 ALA 3 HB2 ALA 3 36.833 21.506 24.654
15 HB3 ALA 3 HB3 ALA 3 36.469 19.780 24.688
16 H PHE 4 H PHE 4 36.640 18.690 22.723
17 HA PHE 4 HA PHE 4 36.667 19.859 19.960
18 HB2 PHE 4 HB2 PHE 4 36.578 16.940 20.693
19 HB3 PHE 4 HB3 PHE 4 36.494 17.612 19.077
20 HD1 PHE 4 HD1 PHE 4 38.494 18.663 18.015
21 HD2 PHE 4 HD2 PHE 4 38.717 16.760 21.877
22 HE1 PHE 4 HE1 PHE 4 40.975 18.608 17.850
23 HE2 PHE 4 HE2 PHE 4 41.194 16.724 21.713
24 HZ PHE 4 HZ PHE 4 42.326 17.660 19.703
25 H CYS 5 H CYS 5 34.704 20.498 19.287
26 HA CYS 5 HA CYS 5 32.292 18.957 20.087
27 HB2 CYS 5 HB2 CYS 5 32.156 20.536 21.723
28 HB3 CYS 5 HB3 CYS 5 32.918 21.794 20.763
29 H ASN 6 H ASN 6 30.932 18.583 18.548
30 HA ASN 6 HA ASN 6 30.817 20.265 16.062
31 HB2 ASN 6 HB2 ASN 6 30.319 17.303 16.666
32 HB3 ASN 6 HB3 ASN 6 29.615 18.077 15.265
33 HD21 ASN 6 HD22 ASN 6 31.131 15.988 14.624
34 HD22 ASN 6 HD21 ASN 6 32.749 16.463 14.122
35 H LEU 7 H LEU 7 28.972 20.876 15.225
36 HA LEU 7 HA LEU 7 26.791 21.346 17.153
37 HB2 LEU 7 HB2 LEU 7 28.192 23.146 15.960
38 HB3 LEU 7 HB3 LEU 7 27.304 22.679 14.496
39 HG LEU 7 HG LEU 7 25.783 23.286 16.965
40 HD11 LEU 7 HD11 LEU 7 26.818 25.351 14.985
41 HD12 LEU 7 HD12 LEU 7 25.694 25.680 16.305
42 HD13 LEU 7 HD13 LEU 7 27.368 25.197 16.658
43 HD21 LEU 7 HD21 LEU 7 25.233 23.711 13.995
44 HD22 LEU 7 HD22 LEU 7 24.456 22.510 15.038
45 HD23 LEU 7 HD23 LEU 7 24.149 24.213 15.302
46 H ARG 8 H ARG 8 27.351 20.097 13.830
47 HA ARG 8 HA ARG 8 24.604 19.014 13.840
48 HB2 ARG 8 HB2 ARG 8 26.854 18.792 11.836
49 HB3 ARG 8 HB3 ARG 8 25.349 17.888 11.660
50 HG2 ARG 8 HG2 ARG 8 25.549 20.899 12.016
51 HG3 ARG 8 HG3 ARG 8 25.350 20.074 10.457
52 HD2 ARG 8 HD2 ARG 8 23.335 20.373 12.702
53 HD3 ARG 8 HD3 ARG 8 23.246 20.934 11.034
54 HE ARG 8 HE ARG 8 23.388 17.994 11.423
55 HH11 ARG 8 HH11 ARG 8 21.145 20.678 10.774
56 HH12 ARG 8 HH12 ARG 8 19.994 19.530 10.109
57 HH21 ARG 8 HH21 ARG 8 21.906 16.776 10.607
58 HH22 ARG 8 HH22 ARG 8 20.550 17.460 9.726
59 H ALA 9 H ALA 9 26.265 18.455 15.871
60 HA ALA 9 HA ALA 9 25.549 15.648 16.292
61 HB1 ALA 9 HB1 ALA 9 27.525 15.374 17.799
62 HB2 ALA 9 HB2 ALA 9 28.007 15.641 16.116
63 HB3 ALA 9 HB3 ALA 9 28.119 16.971 17.286
64 H CYS 10 H CYS 10 26.338 18.919 17.571
65 HA CYS 10 HA CYS 10 25.099 18.574 20.140
66 HB2 CYS 10 HB2 CYS 10 26.652 20.498 19.466
67 HB3 CYS 10 HB3 CYS 10 25.282 21.163 18.571
68 H GLU 11 H GLU 11 23.821 20.042 17.124
69 HA GLU 11 HA GLU 11 21.218 20.674 17.848
70 HB2 GLU 11 HB2 GLU 11 22.566 19.738 15.326
71 HB3 GLU 11 HB3 GLU 11 20.817 19.708 15.336
72 HG2 GLU 11 HG2 GLU 11 22.169 22.222 16.309
73 HG3 GLU 11 HG3 GLU 11 22.158 21.894 14.586
74 H LEU 12 H LEU 12 22.490 17.480 17.018
75 HA LEU 12 HA LEU 12 19.950 16.120 16.992
76 HB2 LEU 12 HB2 LEU 12 22.672 14.844 17.390
77 HB3 LEU 12 HB3 LEU 12 21.245 14.157 16.631
78 HG LEU 12 HG LEU 12 23.055 16.346 15.487
79 HD11 LEU 12 HD11 LEU 12 23.975 14.064 15.464
80 HD12 LEU 12 HD12 LEU 12 22.515 13.481 14.650
81 HD13 LEU 12 HD13 LEU 12 23.599 14.628 13.828
82 HD21 LEU 12 HD21 LEU 12 20.587 15.036 14.251
83 HD22 LEU 12 HD22 LEU 12 20.731 16.743 14.729
84 HD23 LEU 12 HD23 LEU 12 21.722 16.111 13.409
85 H SER 13 H SER 13 22.445 16.663 19.451
86 HA SER 13 HA SER 13 21.214 15.016 21.506
87 HB2 SER 13 HB2 SER 13 23.298 17.239 21.623
88 HB3 SER 13 HB3 SER 13 22.825 16.227 23.000
89 HG SER 13 HG SER 13 24.723 15.634 21.473
90 H CYS 14 H CYS 14 21.090 18.497 20.666
91 HA CYS 14 HA CYS 14 19.466 19.226 22.945
92 HB2 CYS 14 HB2 CYS 14 20.134 20.642 20.341
93 HB3 CYS 14 HB3 CYS 14 19.259 21.374 21.706
94 H ARG 15 H ARG 15 18.650 18.104 19.699
95 HA ARG 15 HA ARG 15 15.973 18.845 19.448
96 HB2 ARG 15 HB2 ARG 15 17.497 17.476 17.861
97 HB3 ARG 15 HB3 ARG 15 17.178 16.091 18.892
98 HG2 ARG 15 HG2 ARG 15 15.630 15.726 17.277
99 HG3 ARG 15 HG3 ARG 15 14.622 16.684 18.357
100 HD2 ARG 15 HD2 ARG 15 16.062 17.605 15.850
101 HD3 ARG 15 HD3 ARG 15 14.323 17.406 16.050
102 HE ARG 15 HE ARG 15 15.989 19.668 16.900
103 HH11 ARG 15 HH11 ARG 15 12.782 18.216 17.450
104 HH12 ARG 15 HH12 ARG 15 12.135 19.761 17.925
105 HH21 ARG 15 HH21 ARG 15 15.016 21.526 17.299
106 HH22 ARG 15 HH22 ARG 15 13.321 21.573 17.628
107 H SER 16 H SER 16 17.401 16.470 21.626
108 HA SER 16 HA SER 16 15.037 15.112 22.327
109 HB2 SER 16 HB2 SER 16 17.639 15.482 23.825
110 HB3 SER 16 HB3 SER 16 16.353 14.365 24.329
111 HG SER 16 HG SER 16 17.705 13.193 23.038
112 H LEU 17 H LEU 17 16.127 18.303 23.527
113 HA LEU 17 HA LEU 17 14.031 18.210 25.548
114 HB2 LEU 17 HB2 LEU 17 15.016 20.503 26.118
115 HB3 LEU 17 HB3 LEU 17 15.417 18.971 26.880
116 HG LEU 17 HG LEU 17 16.923 20.170 24.636
117 HD11 LEU 17 HD11 LEU 17 17.654 20.140 27.626
118 HD12 LEU 17 HD12 LEU 17 18.556 20.995 26.363
119 HD13 LEU 17 HD13 LEU 17 16.948 21.561 26.853
120 HD21 LEU 17 HD21 LEU 17 17.313 17.720 26.078
121 HD22 LEU 17 HD22 LEU 17 17.859 18.284 24.463
122 HD23 LEU 17 HD23 LEU 17 18.796 18.741 25.872
123 H GLY 18 H GLY 18 14.036 18.667 22.397
124 HA2 GLY 18 HA2 GLY 18 12.769 19.836 20.881
125 HA3 GLY 18 HA3 GLY 18 11.988 20.735 22.187
126 H LEU 19 H LEU 19 15.518 20.732 22.164
127 HA LEU 19 HA LEU 19 15.423 23.665 21.628
128 HB2 LEU 19 HB2 LEU 19 17.547 21.903 22.811
129 HB3 LEU 19 HB3 LEU 19 17.709 23.648 22.630
130 HG LEU 19 HG LEU 19 16.583 22.093 24.723
131 HD11 LEU 19 HD11 LEU 19 17.060 25.066 24.684
132 HD12 LEU 19 HD12 LEU 19 16.591 24.138 26.101
133 HD13 LEU 19 HD13 LEU 19 18.121 23.829 25.391
134 HD21 LEU 19 HD21 LEU 19 14.436 22.377 24.180
135 HD22 LEU 19 HD22 LEU 19 14.665 23.713 25.275
136 HD23 LEU 19 HD23 LEU 19 14.637 23.982 23.540
137 H LEU 20 H LEU 20 17.315 24.614 20.868
138 HA LEU 20 HA LEU 20 18.153 23.543 18.198
139 HB2 LEU 20 HB2 LEU 20 16.895 25.780 18.457
140 HB3 LEU 20 HB3 LEU 20 18.332 26.364 19.285
141 HG LEU 20 HG LEU 20 19.632 25.690 17.129
142 HD11 LEU 20 HD11 LEU 20 16.767 25.770 16.052
143 HD12 LEU 20 HD12 LEU 20 18.249 25.686 15.071
144 HD13 LEU 20 HD13 LEU 20 17.804 24.329 16.110
145 HD21 LEU 20 HD21 LEU 20 17.556 27.917 17.023
146 HD22 LEU 20 HD22 LEU 20 19.160 28.026 17.781
147 HD23 LEU 20 HD23 LEU 20 19.024 27.807 16.024
148 H GLY 21 H GLY 21 20.278 22.976 17.945
149 HA2 GLY 21 HA2 GLY 21 22.049 23.089 20.283
150 HA3 GLY 21 HA3 GLY 21 22.351 22.230 18.785
151 H LYS 22 H LYS 22 23.710 24.269 20.594
152 HA LYS 22 HA LYS 22 25.190 25.699 18.436
153 HB2 LYS 22 HB2 LYS 22 24.493 26.728 21.228
154 HB3 LYS 22 HB3 LYS 22 25.574 27.538 20.096
155 HG2 LYS 22 HG2 LYS 22 22.602 27.043 19.659
156 HG3 LYS 22 HG3 LYS 22 23.373 28.568 20.140
157 HD2 LYS 22 HD2 LYS 22 24.690 28.517 18.034
158 HD3 LYS 22 HD3 LYS 22 23.760 27.104 17.500
159 HE2 LYS 22 HE2 LYS 22 21.688 28.393 17.500
160 HE3 LYS 22 HE3 LYS 22 22.495 29.753 18.291
161 HZ1 LYS 22 HZ1 LYS 22 22.868 28.853 15.503
162 HZ2 LYS 22 HZ2 LYS 22 22.499 30.380 16.069
163 HZ3 LYS 22 HZ3 LYS 22 23.988 29.766 16.245
164 H CYS 23 H CYS 23 27.319 25.801 18.628
165 HA CYS 23 HA CYS 23 28.616 24.119 20.767
166 HB2 CYS 23 HB2 CYS 23 28.914 23.388 18.406
167 HB3 CYS 23 HB3 CYS 23 29.742 24.915 18.078
168 H ILE 24 H ILE 24 29.345 25.300 22.441
169 HA ILE 24 HA ILE 24 30.625 27.968 21.996
170 HB ILE 24 HB ILE 24 28.455 27.393 24.051
171 HG12 ILE 24 HG12 ILE 24 28.355 29.057 21.493
172 HG13 ILE 24 HG13 ILE 24 27.466 27.567 21.819
173 HG21 ILE 24 HG21 ILE 24 30.188 29.010 24.844
174 HG22 ILE 24 HG22 ILE 24 29.911 29.996 23.387
175 HG23 ILE 24 HG23 ILE 24 28.641 29.785 24.612
176 HD11 ILE 24 HD11 ILE 24 26.256 28.727 23.682
177 HD12 ILE 24 HD12 ILE 24 27.006 30.252 23.135
178 HD13 ILE 24 HD13 ILE 24 25.930 29.360 22.053
179 H GLY 25 H GLY 25 32.425 28.296 23.245
180 HA2 GLY 25 HA2 GLY 25 34.185 27.792 24.633
181 HA3 GLY 25 HA3 GLY 25 33.012 27.105 25.762
182 H GLU 26 H GLU 26 33.611 25.939 22.463
183 HA GLU 26 HA GLU 26 33.943 23.849 21.636
184 HB2 GLU 26 HB2 GLU 26 35.847 23.369 23.898
185 HB3 GLU 26 HB3 GLU 26 35.865 22.620 22.317
186 HG2 GLU 26 HG2 GLU 26 36.524 24.736 21.269
187 HG3 GLU 26 HG3 GLU 26 36.393 25.590 22.809
188 H GLU 27 H GLU 27 31.770 24.138 23.677
189 HA GLU 27 HA GLU 27 31.278 21.245 24.134
190 HB2 GLU 27 HB2 GLU 27 31.786 23.173 26.168
191 HB3 GLU 27 HB3 GLU 27 30.046 22.927 26.190
192 HG2 GLU 27 HG2 GLU 27 32.078 20.659 26.292
193 HG3 GLU 27 HG3 GLU 27 31.439 21.467 27.717
194 H CYS 28 H CYS 28 28.927 20.748 24.451
195 HA CYS 28 HA CYS 28 27.367 22.244 22.437
196 HB2 CYS 28 HB2 CYS 28 27.509 19.873 22.193
197 HB3 CYS 28 HB3 CYS 28 26.979 19.607 23.855
198 H LYS 29 H LYS 29 25.706 23.534 22.803
199 HA LYS 29 HA LYS 29 24.245 23.576 25.409
200 HB2 LYS 29 HB2 LYS 29 25.207 25.923 23.699
201 HB3 LYS 29 HB3 LYS 29 24.075 26.070 25.031
202 HG2 LYS 29 HG2 LYS 29 26.976 25.162 25.271
203 HG3 LYS 29 HG3 LYS 29 26.333 26.755 25.686
204 HD2 LYS 29 HD2 LYS 29 24.852 25.697 27.399
205 HD3 LYS 29 HD3 LYS 29 25.585 24.124 27.033
206 HE2 LYS 29 HE2 LYS 29 27.847 25.190 27.553
207 HE3 LYS 29 HE3 LYS 29 26.947 26.578 28.194
208 HZ1 LYS 29 HZ1 LYS 29 27.423 25.090 29.958
209 HZ2 LYS 29 HZ2 LYS 29 25.815 24.972 29.693
210 HZ3 LYS 29 HZ3 LYS 29 26.842 23.777 29.132
211 H CYS 30 H CYS 30 21.988 23.885 25.299
212 HA CYS 30 HA CYS 30 20.700 23.778 22.647
213 HB2 CYS 30 HB2 CYS 30 19.920 22.805 25.385
214 HB3 CYS 30 HB3 CYS 30 19.186 22.456 23.845
215 H VAL 31 H VAL 31 19.452 25.512 22.142
216 HA VAL 31 HA VAL 31 18.511 27.241 24.385
217 HB VAL 31 HB VAL 31 18.488 29.155 22.966
218 HG11 VAL 31 HG11 VAL 31 20.439 28.672 24.418
219 HG12 VAL 31 HG12 VAL 31 21.242 27.842 23.066
220 HG13 VAL 31 HG13 VAL 31 20.892 29.578 22.969
221 HG21 VAL 31 HG21 VAL 31 19.923 27.389 20.926
222 HG22 VAL 31 HG22 VAL 31 18.320 28.140 20.734
223 HG23 VAL 31 HG23 VAL 31 19.767 29.158 20.817
224 HA PRO 32 HA PRO 32 14.742 25.939 23.681
225 HB2 PRO 32 HB2 PRO 32 12.990 27.924 24.504
226 HB3 PRO 32 HB3 PRO 32 13.929 26.790 25.517
227 HG2 PRO 32 HG2 PRO 32 14.675 29.610 24.719
228 HG3 PRO 32 HG3 PRO 32 14.847 28.815 26.321
229 HD2 PRO 32 HD2 PRO 32 16.980 29.022 24.708
230 HD3 PRO 32 HD3 PRO 32 16.671 27.437 25.511
231 H TYR 33 H TYR 33 13.937 25.270 22.016
232 HA TYR 33 HA TYR 33 12.500 27.016 20.054
233 HB2 TYR 33 HB2 TYR 33 14.335 24.816 19.602
234 HB3 TYR 33 HB3 TYR 33 12.771 24.468 18.900
235 HD1 TYR 33 HD2 TYR 33 15.056 27.393 19.299
236 HD2 TYR 33 HD1 TYR 33 12.394 25.224 16.702
237 HE1 TYR 33 HE2 TYR 33 15.416 29.107 17.485
238 HE2 TYR 33 HE1 TYR 33 12.817 26.870 14.876
239 HH TYR 33 HH TYR 33 13.966 28.772 14.234
Start of MODEL 13
1 H1 GLY 1 H1 GLY 1 41.664 26.539 21.968
2 H2 GLY 1 H2 GLY 1 40.816 27.930 21.700
3 H3 GLY 1 H3 GLY 1 40.044 26.589 22.244
4 HA2 GLY 1 HA2 GLY 1 41.958 28.267 23.700
5 HA3 GLY 1 HA3 GLY 1 40.241 27.985 24.091
6 H SER 2 H SER 2 39.780 25.480 24.271
7 HA SER 2 HA SER 2 41.970 23.903 25.496
8 HB2 SER 2 HB2 SER 2 40.700 23.557 27.574
9 HB3 SER 2 HB3 SER 2 41.084 25.271 27.330
10 HG SER 2 HG SER 2 38.683 24.053 27.574
11 H ALA 3 H ALA 3 39.062 23.967 23.650
12 HA ALA 3 HA ALA 3 38.817 21.019 23.717
13 HB1 ALA 3 HB1 ALA 3 36.651 23.064 24.394
14 HB2 ALA 3 HB2 ALA 3 36.347 21.345 24.104
15 HB3 ALA 3 HB3 ALA 3 37.340 21.863 25.491
16 H PHE 4 H PHE 4 37.462 20.179 22.017
17 HA PHE 4 HA PHE 4 36.983 22.011 19.695
18 HB2 PHE 4 HB2 PHE 4 39.084 20.634 19.564
19 HB3 PHE 4 HB3 PHE 4 38.080 19.206 19.392
20 HD1 PHE 4 HD1 PHE 4 36.265 19.374 17.381
21 HD2 PHE 4 HD2 PHE 4 39.829 21.792 17.706
22 HE1 PHE 4 HE1 PHE 4 36.142 19.903 14.961
23 HE2 PHE 4 HE2 PHE 4 39.687 22.326 15.289
24 HZ PHE 4 HZ PHE 4 37.827 21.399 13.916
25 H CYS 5 H CYS 5 34.967 22.068 19.260
26 HA CYS 5 HA CYS 5 33.135 19.891 20.101
27 HB2 CYS 5 HB2 CYS 5 31.458 21.695 20.124
28 HB3 CYS 5 HB3 CYS 5 32.832 22.000 21.167
29 H ASN 6 H ASN 6 31.049 19.746 18.984
30 HA ASN 6 HA ASN 6 31.004 20.129 16.015
31 HB2 ASN 6 HB2 ASN 6 31.269 17.567 17.042
32 HB3 ASN 6 HB3 ASN 6 29.608 17.822 17.394
33 HD21 ASN 6 HD22 ASN 6 32.011 17.907 14.738
34 HD22 ASN 6 HD21 ASN 6 30.912 17.292 13.518
35 H LEU 7 H LEU 7 28.843 20.179 15.163
36 HA LEU 7 HA LEU 7 26.824 21.230 17.081
37 HB2 LEU 7 HB2 LEU 7 28.332 22.885 15.795
38 HB3 LEU 7 HB3 LEU 7 27.446 22.365 14.349
39 HG LEU 7 HG LEU 7 25.843 23.087 16.728
40 HD11 LEU 7 HD11 LEU 7 27.530 24.900 16.602
41 HD12 LEU 7 HD12 LEU 7 27.208 25.073 14.872
42 HD13 LEU 7 HD13 LEU 7 25.953 25.498 16.038
43 HD21 LEU 7 HD21 LEU 7 24.684 22.386 14.617
44 HD22 LEU 7 HD22 LEU 7 24.337 24.060 15.021
45 HD23 LEU 7 HD23 LEU 7 25.516 23.681 13.750
46 H ARG 8 H ARG 8 27.337 19.667 13.878
47 HA ARG 8 HA ARG 8 24.607 18.925 13.530
48 HB2 ARG 8 HB2 ARG 8 26.239 18.504 11.787
49 HB3 ARG 8 HB3 ARG 8 27.223 17.507 12.850
50 HG2 ARG 8 HG2 ARG 8 26.086 16.126 11.239
51 HG3 ARG 8 HG3 ARG 8 25.495 15.745 12.851
52 HD2 ARG 8 HD2 ARG 8 23.444 17.053 12.434
53 HD3 ARG 8 HD3 ARG 8 24.053 17.540 10.847
54 HE ARG 8 HE ARG 8 22.950 14.915 11.622
55 HH11 ARG 8 HH11 ARG 8 24.719 16.589 9.014
56 HH12 ARG 8 HH12 ARG 8 24.271 15.308 7.910
57 HH21 ARG 8 HH21 ARG 8 22.631 13.365 10.100
58 HH22 ARG 8 HH22 ARG 8 23.165 13.654 8.443
59 H ALA 9 H ALA 9 27.138 17.230 15.447
60 HA ALA 9 HA ALA 9 25.409 15.332 16.673
61 HB1 ALA 9 HB1 ALA 9 27.837 15.056 16.377
62 HB2 ALA 9 HB2 ALA 9 28.124 16.394 17.500
63 HB3 ALA 9 HB3 ALA 9 27.351 14.901 18.073
64 H CYS 10 H CYS 10 25.774 18.719 17.266
65 HA CYS 10 HA CYS 10 24.881 18.533 20.083
66 HB2 CYS 10 HB2 CYS 10 26.606 20.228 19.166
67 HB3 CYS 10 HB3 CYS 10 25.218 21.051 18.447
68 H GLU 11 H GLU 11 23.729 19.857 16.933
69 HA GLU 11 HA GLU 11 21.165 20.570 17.566
70 HB2 GLU 11 HB2 GLU 11 22.483 19.476 15.098
71 HB3 GLU 11 HB3 GLU 11 20.736 19.677 15.089
72 HG2 GLU 11 HG2 GLU 11 22.472 21.959 16.046
73 HG3 GLU 11 HG3 GLU 11 22.326 21.671 14.328
74 H LEU 12 H LEU 12 22.249 17.304 16.536
75 HA LEU 12 HA LEU 12 19.682 16.073 17.038
76 HB2 LEU 12 HB2 LEU 12 20.739 14.027 16.284
77 HB3 LEU 12 HB3 LEU 12 21.115 15.377 15.232
78 HG LEU 12 HG LEU 12 23.340 15.511 16.674
79 HD11 LEU 12 HD11 LEU 12 22.546 12.620 17.029
80 HD12 LEU 12 HD12 LEU 12 24.172 13.269 17.316
81 HD13 LEU 12 HD13 LEU 12 22.827 13.805 18.326
82 HD21 LEU 12 HD21 LEU 12 23.203 14.964 14.229
83 HD22 LEU 12 HD22 LEU 12 24.421 13.956 15.034
84 HD23 LEU 12 HD23 LEU 12 22.825 13.281 14.641
85 H SER 13 H SER 13 22.059 17.010 19.201
86 HA SER 13 HA SER 13 21.199 15.043 21.250
87 HB2 SER 13 HB2 SER 13 23.589 15.631 21.098
88 HB3 SER 13 HB3 SER 13 23.196 17.306 21.512
89 HG SER 13 HG SER 13 23.846 15.942 23.271
90 H CYS 14 H CYS 14 20.852 18.464 20.381
91 HA CYS 14 HA CYS 14 19.345 19.111 22.800
92 HB2 CYS 14 HB2 CYS 14 20.139 20.703 20.342
93 HB3 CYS 14 HB3 CYS 14 19.327 21.375 21.771
94 H ARG 15 H ARG 15 18.447 18.229 19.505
95 HA ARG 15 HA ARG 15 15.805 19.226 19.408
96 HB2 ARG 15 HB2 ARG 15 17.328 17.789 17.711
97 HB3 ARG 15 HB3 ARG 15 16.511 16.432 18.440
98 HG2 ARG 15 HG2 ARG 15 14.937 16.793 16.860
99 HG3 ARG 15 HG3 ARG 15 14.365 18.115 17.874
100 HD2 ARG 15 HD2 ARG 15 16.296 18.249 15.524
101 HD3 ARG 15 HD3 ARG 15 14.653 18.896 15.573
102 HE ARG 15 HE ARG 15 15.533 20.458 17.418
103 HH11 ARG 15 HH11 ARG 15 17.380 19.658 14.523
104 HH12 ARG 15 HH12 ARG 15 18.437 21.029 14.773
105 HH21 ARG 15 HH21 ARG 15 17.104 21.974 17.779
106 HH22 ARG 15 HH22 ARG 15 18.357 22.225 16.562
107 H SER 16 H SER 16 17.140 16.668 21.336
108 HA SER 16 HA SER 16 14.784 15.351 22.154
109 HB2 SER 16 HB2 SER 16 17.390 15.678 23.656
110 HB3 SER 16 HB3 SER 16 16.196 14.368 23.874
111 HG SER 16 HG SER 16 18.114 13.974 22.514
112 H LEU 17 H LEU 17 16.033 18.504 23.238
113 HA LEU 17 HA LEU 17 14.071 18.636 25.477
114 HB2 LEU 17 HB2 LEU 17 16.160 20.413 24.243
115 HB3 LEU 17 HB3 LEU 17 15.109 20.946 25.582
116 HG LEU 17 HG LEU 17 17.012 18.667 25.752
117 HD11 LEU 17 HD11 LEU 17 17.643 21.399 26.815
118 HD12 LEU 17 HD12 LEU 17 18.582 19.914 27.034
119 HD13 LEU 17 HD13 LEU 17 18.406 20.579 25.413
120 HD21 LEU 17 HD21 LEU 17 15.673 20.463 27.815
121 HD22 LEU 17 HD22 LEU 17 15.107 18.815 27.441
122 HD23 LEU 17 HD23 LEU 17 16.679 19.047 28.221
123 H GLY 18 H GLY 18 14.095 18.930 22.120
124 HA2 GLY 18 HA2 GLY 18 12.954 20.174 20.563
125 HA3 GLY 18 HA3 GLY 18 12.100 21.055 21.831
126 H LEU 19 H LEU 19 15.589 21.031 22.239
127 HA LEU 19 HA LEU 19 15.532 23.960 21.984
128 HB2 LEU 19 HB2 LEU 19 17.657 22.055 22.889
129 HB3 LEU 19 HB3 LEU 19 17.912 23.795 22.847
130 HG LEU 19 HG LEU 19 16.887 22.176 24.877
131 HD11 LEU 19 HD11 LEU 19 16.913 24.097 26.390
132 HD12 LEU 19 HD12 LEU 19 18.411 23.742 25.618
133 HD13 LEU 19 HD13 LEU 19 17.415 25.083 25.024
134 HD21 LEU 19 HD21 LEU 19 14.931 23.523 25.673
135 HD22 LEU 19 HD22 LEU 19 14.978 24.380 24.120
136 HD23 LEU 19 HD23 LEU 19 14.598 22.672 24.184
137 H LEU 20 H LEU 20 17.634 24.905 21.231
138 HA LEU 20 HA LEU 20 18.281 24.036 18.430
139 HB2 LEU 20 HB2 LEU 20 17.340 26.337 18.796
140 HB3 LEU 20 HB3 LEU 20 18.721 26.685 19.841
141 HG LEU 20 HG LEU 20 20.184 26.218 17.764
142 HD11 LEU 20 HD11 LEU 20 18.434 25.051 16.415
143 HD12 LEU 20 HD12 LEU 20 17.458 26.533 16.427
144 HD13 LEU 20 HD13 LEU 20 19.026 26.500 15.588
145 HD21 LEU 20 HD21 LEU 20 18.213 28.536 17.727
146 HD22 LEU 20 HD22 LEU 20 19.770 28.491 18.590
147 HD23 LEU 20 HD23 LEU 20 19.730 28.471 16.815
148 H GLY 21 H GLY 21 20.310 23.147 18.110
149 HA2 GLY 21 HA2 GLY 21 22.112 22.975 20.487
150 HA3 GLY 21 HA3 GLY 21 22.144 21.934 19.070
151 H LYS 22 H LYS 22 23.809 24.268 20.613
152 HA LYS 22 HA LYS 22 25.322 25.087 18.192
153 HB2 LYS 22 HB2 LYS 22 24.585 26.887 20.546
154 HB3 LYS 22 HB3 LYS 22 25.737 27.305 19.287
155 HG2 LYS 22 HG2 LYS 22 22.749 26.911 18.936
156 HG3 LYS 22 HG3 LYS 22 23.657 28.433 18.905
157 HD2 LYS 22 HD2 LYS 22 24.906 27.577 16.892
158 HD3 LYS 22 HD3 LYS 22 23.834 26.172 16.903
159 HE2 LYS 22 HE2 LYS 22 21.878 27.859 16.789
160 HE3 LYS 22 HE3 LYS 22 23.111 29.075 16.388
161 HZ1 LYS 22 HZ1 LYS 22 23.770 27.553 14.536
162 HZ2 LYS 22 HZ2 LYS 22 22.440 26.613 14.880
163 HZ3 LYS 22 HZ3 LYS 22 22.251 28.145 14.345
164 H CYS 23 H CYS 23 27.484 25.364 18.496
165 HA CYS 23 HA CYS 23 28.664 24.381 21.056
166 HB2 CYS 23 HB2 CYS 23 29.799 23.659 19.050
167 HB3 CYS 23 HB3 CYS 23 30.044 25.339 18.537
168 H ILE 24 H ILE 24 28.984 25.704 22.685
169 HA ILE 24 HA ILE 24 29.301 28.647 22.291
170 HB ILE 24 HB ILE 24 27.560 27.211 24.326
171 HG12 ILE 24 HG12 ILE 24 26.425 27.406 22.168
172 HG13 ILE 24 HG13 ILE 24 25.668 28.384 23.407
173 HG21 ILE 24 HG21 ILE 24 28.211 30.178 24.135
174 HG22 ILE 24 HG22 ILE 24 26.939 29.476 25.151
175 HG23 ILE 24 HG23 ILE 24 28.627 29.074 25.459
176 HD11 ILE 24 HD11 ILE 24 27.489 29.499 21.222
177 HD12 ILE 24 HD12 ILE 24 25.719 29.524 21.223
178 HD13 ILE 24 HD13 ILE 24 26.606 30.441 22.444
179 H GLY 25 H GLY 25 31.113 29.354 23.248
180 HA2 GLY 25 HA2 GLY 25 33.144 29.274 24.369
181 HA3 GLY 25 HA3 GLY 25 32.201 28.620 25.715
182 H GLU 26 H GLU 26 33.009 27.164 22.544
183 HA GLU 26 HA GLU 26 33.866 25.173 21.902
184 HB2 GLU 26 HB2 GLU 26 35.753 25.333 24.247
185 HB3 GLU 26 HB3 GLU 26 35.958 24.502 22.699
186 HG2 GLU 26 HG2 GLU 26 35.762 26.799 21.587
187 HG3 GLU 26 HG3 GLU 26 35.918 27.500 23.204
188 H GLU 27 H GLU 27 31.547 25.048 23.727
189 HA GLU 27 HA GLU 27 31.659 22.113 24.221
190 HB2 GLU 27 HB2 GLU 27 32.173 23.380 26.326
191 HB3 GLU 27 HB3 GLU 27 30.624 24.196 26.191
192 HG2 GLU 27 HG2 GLU 27 29.433 22.073 26.474
193 HG3 GLU 27 HG3 GLU 27 30.966 21.181 26.445
194 H CYS 28 H CYS 28 29.694 21.033 23.741
195 HA CYS 28 HA CYS 28 27.693 22.450 22.218
196 HB2 CYS 28 HB2 CYS 28 28.118 20.180 21.668
197 HB3 CYS 28 HB3 CYS 28 27.889 19.656 23.333
198 H LYS 29 H LYS 29 25.990 23.524 22.830
199 HA LYS 29 HA LYS 29 24.566 22.999 25.397
200 HB2 LYS 29 HB2 LYS 29 25.449 25.649 24.162
201 HB3 LYS 29 HB3 LYS 29 24.144 25.553 25.332
202 HG2 LYS 29 HG2 LYS 29 27.027 24.728 25.857
203 HG3 LYS 29 HG3 LYS 29 26.232 26.221 26.378
204 HD2 LYS 29 HD2 LYS 29 24.511 24.671 27.567
205 HD3 LYS 29 HD3 LYS 29 25.715 23.382 27.334
206 HE2 LYS 29 HE2 LYS 29 27.407 24.797 28.502
207 HE3 LYS 29 HE3 LYS 29 26.181 26.059 28.718
208 HZ1 LYS 29 HZ1 LYS 29 26.173 23.358 29.927
209 HZ2 LYS 29 HZ2 LYS 29 26.275 24.789 30.702
210 HZ3 LYS 29 HZ3 LYS 29 24.864 24.373 29.995
211 H CYS 30 H CYS 30 22.315 23.366 25.409
212 HA CYS 30 HA CYS 30 20.925 23.587 22.830
213 HB2 CYS 30 HB2 CYS 30 20.126 22.511 25.520
214 HB3 CYS 30 HB3 CYS 30 19.333 22.340 23.972
215 H VAL 31 H VAL 31 20.061 25.576 22.527
216 HA VAL 31 HA VAL 31 19.485 27.213 24.943
217 HB VAL 31 HB VAL 31 19.396 29.166 23.640
218 HG11 VAL 31 HG11 VAL 31 22.043 27.675 23.314
219 HG12 VAL 31 HG12 VAL 31 21.820 29.437 23.316
220 HG13 VAL 31 HG13 VAL 31 21.485 28.506 24.784
221 HG21 VAL 31 HG21 VAL 31 20.385 29.187 21.312
222 HG22 VAL 31 HG22 VAL 31 20.411 27.408 21.351
223 HG23 VAL 31 HG23 VAL 31 18.862 28.284 21.388
224 HA PRO 32 HA PRO 32 15.371 26.363 24.427
225 HB2 PRO 32 HB2 PRO 32 14.093 28.416 25.737
226 HB3 PRO 32 HB3 PRO 32 14.902 27.016 26.495
227 HG2 PRO 32 HG2 PRO 32 16.032 29.778 26.068
228 HG3 PRO 32 HG3 PRO 32 16.202 28.711 27.502
229 HD2 PRO 32 HD2 PRO 32 18.194 28.900 25.695
230 HD3 PRO 32 HD3 PRO 32 17.758 27.265 26.310
231 H TYR 33 H TYR 33 14.584 26.266 22.626
232 HA TYR 33 HA TYR 33 14.067 28.661 20.887
233 HB2 TYR 33 HB2 TYR 33 15.924 27.601 20.084
234 HB3 TYR 33 HB3 TYR 33 15.364 25.998 20.515
235 HD1 TYR 33 HD2 TYR 33 13.749 24.814 19.261
236 HD2 TYR 33 HD1 TYR 33 15.413 28.504 17.874
237 HE1 TYR 33 HE2 TYR 33 13.069 24.211 16.895
238 HE2 TYR 33 HE1 TYR 33 14.684 27.971 15.526
239 HH TYR 33 HH TYR 33 13.551 26.479 14.179
Start of MODEL 14
1 H1 GLY 1 H1 GLY 1 35.505 22.171 29.118
2 H2 GLY 1 H2 GLY 1 34.748 20.865 28.450
3 H3 GLY 1 H3 GLY 1 35.623 20.685 29.826
4 HA2 GLY 1 HA2 GLY 1 34.077 22.050 31.055
5 HA3 GLY 1 HA3 GLY 1 33.163 22.280 29.551
6 H SER 2 H SER 2 31.415 21.080 29.457
7 HA SER 2 HA SER 2 31.190 18.580 31.037
8 HB2 SER 2 HB2 SER 2 28.950 19.972 29.571
9 HB3 SER 2 HB3 SER 2 28.875 18.932 31.003
10 HG SER 2 HG SER 2 29.907 21.575 30.738
11 H ALA 3 H ALA 3 30.905 19.656 27.677
12 HA ALA 3 HA ALA 3 31.075 16.921 26.609
13 HB1 ALA 3 HB1 ALA 3 28.716 18.800 26.078
14 HB2 ALA 3 HB2 ALA 3 29.043 17.297 25.191
15 HB3 ALA 3 HB3 ALA 3 28.649 17.235 26.918
16 H PHE 4 H PHE 4 31.509 16.970 24.228
17 HA PHE 4 HA PHE 4 33.358 19.138 23.642
18 HB2 PHE 4 HB2 PHE 4 32.568 16.741 21.984
19 HB3 PHE 4 HB3 PHE 4 33.937 17.806 21.683
20 HD1 PHE 4 HD1 PHE 4 34.859 17.961 24.724
21 HD2 PHE 4 HD2 PHE 4 33.880 14.750 22.010
22 HE1 PHE 4 HE1 PHE 4 36.325 16.430 25.996
23 HE2 PHE 4 HE2 PHE 4 35.360 13.226 23.292
24 HZ PHE 4 HZ PHE 4 36.570 14.056 25.290
25 H CYS 5 H CYS 5 33.490 20.486 21.913
26 HA CYS 5 HA CYS 5 30.948 21.590 21.132
27 HB2 CYS 5 HB2 CYS 5 33.244 22.618 22.018
28 HB3 CYS 5 HB3 CYS 5 33.613 22.754 20.313
29 H ASN 6 H ASN 6 30.622 19.579 19.903
30 HA ASN 6 HA ASN 6 30.852 20.151 16.969
31 HB2 ASN 6 HB2 ASN 6 30.633 17.796 18.401
32 HB3 ASN 6 HB3 ASN 6 28.944 18.163 18.179
33 HD21 ASN 6 HD22 ASN 6 32.029 17.812 16.432
34 HD22 ASN 6 HD21 ASN 6 31.312 17.146 14.962
35 H LEU 7 H LEU 7 28.761 20.152 15.791
36 HA LEU 7 HA LEU 7 26.642 21.505 17.336
37 HB2 LEU 7 HB2 LEU 7 28.332 23.003 16.068
38 HB3 LEU 7 HB3 LEU 7 27.526 22.418 14.597
39 HG LEU 7 HG LEU 7 25.819 23.337 16.840
40 HD11 LEU 7 HD11 LEU 7 27.208 25.184 14.861
41 HD12 LEU 7 HD12 LEU 7 25.968 25.658 16.040
42 HD13 LEU 7 HD13 LEU 7 27.558 25.103 16.591
43 HD21 LEU 7 HD21 LEU 7 24.718 22.490 14.736
44 HD22 LEU 7 HD22 LEU 7 24.410 24.197 15.002
45 HD23 LEU 7 HD23 LEU 7 25.623 23.692 13.811
46 H ARG 8 H ARG 8 27.409 19.681 14.322
47 HA ARG 8 HA ARG 8 24.629 19.036 13.835
48 HB2 ARG 8 HB2 ARG 8 26.171 18.658 12.091
49 HB3 ARG 8 HB3 ARG 8 27.233 17.679 13.097
50 HG2 ARG 8 HG2 ARG 8 26.059 16.301 11.491
51 HG3 ARG 8 HG3 ARG 8 25.625 15.856 13.135
52 HD2 ARG 8 HD2 ARG 8 23.468 17.150 12.851
53 HD3 ARG 8 HD3 ARG 8 23.914 17.403 11.148
54 HE ARG 8 HE ARG 8 24.195 14.683 11.484
55 HH11 ARG 8 HH11 ARG 8 21.352 16.788 11.962
56 HH12 ARG 8 HH12 ARG 8 20.304 15.383 11.800
57 HH21 ARG 8 HH21 ARG 8 22.665 13.059 11.253
58 HH22 ARG 8 HH22 ARG 8 20.970 13.497 11.423
59 H ALA 9 H ALA 9 27.109 17.219 15.751
60 HA ALA 9 HA ALA 9 25.249 15.394 16.894
61 HB1 ALA 9 HB1 ALA 9 27.971 16.245 17.893
62 HB2 ALA 9 HB2 ALA 9 27.092 14.769 18.315
63 HB3 ALA 9 HB3 ALA 9 27.688 15.006 16.658
64 H CYS 10 H CYS 10 25.889 18.752 17.595
65 HA CYS 10 HA CYS 10 24.802 18.601 20.321
66 HB2 CYS 10 HB2 CYS 10 26.485 20.340 19.316
67 HB3 CYS 10 HB3 CYS 10 25.048 21.122 18.688
68 H GLU 11 H GLU 11 23.720 20.013 17.185
69 HA GLU 11 HA GLU 11 21.099 20.635 17.712
70 HB2 GLU 11 HB2 GLU 11 22.587 19.669 15.275
71 HB3 GLU 11 HB3 GLU 11 20.847 19.808 15.171
72 HG2 GLU 11 HG2 GLU 11 22.424 22.145 16.271
73 HG3 GLU 11 HG3 GLU 11 22.380 21.853 14.536
74 H LEU 12 H LEU 12 22.260 17.416 16.596
75 HA LEU 12 HA LEU 12 19.590 16.352 16.527
76 HB2 LEU 12 HB2 LEU 12 20.627 14.286 15.809
77 HB3 LEU 12 HB3 LEU 12 21.338 15.663 14.991
78 HG LEU 12 HG LEU 12 23.215 15.476 16.831
79 HD11 LEU 12 HD11 LEU 12 22.098 12.645 16.866
80 HD12 LEU 12 HD12 LEU 12 23.677 13.141 17.507
81 HD13 LEU 12 HD13 LEU 12 22.208 13.744 18.254
82 HD21 LEU 12 HD21 LEU 12 23.545 15.028 14.405
83 HD22 LEU 12 HD22 LEU 12 24.425 13.839 15.370
84 HD23 LEU 12 HD23 LEU 12 22.885 13.391 14.609
85 H SER 13 H SER 13 21.790 16.714 19.123
86 HA SER 13 HA SER 13 20.363 14.723 20.792
87 HB2 SER 13 HB2 SER 13 22.860 14.912 20.879
88 HB3 SER 13 HB3 SER 13 22.674 16.534 21.563
89 HG SER 13 HG SER 13 22.923 14.813 23.110
90 H CYS 14 H CYS 14 20.928 18.269 20.567
91 HA CYS 14 HA CYS 14 19.251 18.989 22.766
92 HB2 CYS 14 HB2 CYS 14 20.080 20.509 20.263
93 HB3 CYS 14 HB3 CYS 14 19.277 21.234 21.662
94 H ARG 15 H ARG 15 18.448 18.071 19.471
95 HA ARG 15 HA ARG 15 15.754 18.927 19.318
96 HB2 ARG 15 HB2 ARG 15 17.449 17.532 17.676
97 HB3 ARG 15 HB3 ARG 15 16.604 16.171 18.348
98 HG2 ARG 15 HG2 ARG 15 15.152 16.545 16.647
99 HG3 ARG 15 HG3 ARG 15 14.477 17.802 17.686
100 HD2 ARG 15 HD2 ARG 15 16.556 18.103 15.471
101 HD3 ARG 15 HD3 ARG 15 14.892 18.691 15.432
102 HE ARG 15 HE ARG 15 15.561 20.211 17.369
103 HH11 ARG 15 HH21 ARG 15 17.793 19.465 14.737
104 HH12 ARG 15 HH22 ARG 15 18.668 20.951 15.002
105 HH21 ARG 15 HH11 ARG 15 17.035 21.858 17.830
106 HH22 ARG 15 HH12 ARG 15 18.337 22.176 16.688
107 H SER 16 H SER 16 17.188 16.430 21.307
108 HA SER 16 HA SER 16 14.804 15.031 21.991
109 HB2 SER 16 HB2 SER 16 17.336 15.407 23.598
110 HB3 SER 16 HB3 SER 16 16.070 14.223 23.943
111 HG SER 16 HG SER 16 18.052 13.691 22.534
112 H LEU 17 H LEU 17 16.149 18.148 23.268
113 HA LEU 17 HA LEU 17 14.104 18.347 25.387
114 HB2 LEU 17 HB2 LEU 17 16.191 20.138 24.164
115 HB3 LEU 17 HB3 LEU 17 15.155 20.620 25.529
116 HG LEU 17 HG LEU 17 17.045 18.334 25.658
117 HD11 LEU 17 HD11 LEU 17 17.776 21.060 26.669
118 HD12 LEU 17 HD12 LEU 17 18.690 19.557 26.835
119 HD13 LEU 17 HD13 LEU 17 18.445 20.236 25.228
120 HD21 LEU 17 HD21 LEU 17 15.829 20.191 27.748
121 HD22 LEU 17 HD22 LEU 17 15.184 18.574 27.387
122 HD23 LEU 17 HD23 LEU 17 16.793 18.736 28.122
123 H GLY 18 H GLY 18 14.215 18.741 22.003
124 HA2 GLY 18 HA2 GLY 18 12.978 19.956 20.484
125 HA3 GLY 18 HA3 GLY 18 12.135 20.803 21.788
126 H LEU 19 H LEU 19 15.597 20.827 22.139
127 HA LEU 19 HA LEU 19 15.530 23.786 21.979
128 HB2 LEU 19 HB2 LEU 19 17.645 21.834 22.837
129 HB3 LEU 19 HB3 LEU 19 17.900 23.567 22.841
130 HG LEU 19 HG LEU 19 16.924 21.916 24.849
131 HD11 LEU 19 HD11 LEU 19 16.899 23.842 26.348
132 HD12 LEU 19 HD12 LEU 19 18.395 23.641 25.500
133 HD13 LEU 19 HD13 LEU 19 17.242 24.871 24.963
134 HD21 LEU 19 HD21 LEU 19 14.861 24.017 24.138
135 HD22 LEU 19 HD22 LEU 19 14.603 22.293 24.176
136 HD23 LEU 19 HD23 LEU 19 14.916 23.136 25.669
137 H LEU 20 H LEU 20 17.646 24.720 21.247
138 HA LEU 20 HA LEU 20 18.333 23.849 18.454
139 HB2 LEU 20 HB2 LEU 20 17.383 26.184 18.884
140 HB3 LEU 20 HB3 LEU 20 18.838 26.507 19.815
141 HG LEU 20 HG LEU 20 20.109 25.788 17.621
142 HD11 LEU 20 HD11 LEU 20 18.110 24.914 16.424
143 HD12 LEU 20 HD12 LEU 20 17.335 26.507 16.546
144 HD13 LEU 20 HD13 LEU 20 18.801 26.296 15.557
145 HD21 LEU 20 HD21 LEU 20 18.517 28.362 17.682
146 HD22 LEU 20 HD22 LEU 20 20.041 28.080 18.546
147 HD23 LEU 20 HD23 LEU 20 20.011 28.070 16.766
148 H GLY 21 H GLY 21 20.411 23.107 18.105
149 HA2 GLY 21 HA2 GLY 21 22.231 22.882 20.441
150 HA3 GLY 21 HA3 GLY 21 22.373 22.021 18.920
151 H LYS 22 H LYS 22 23.929 24.129 20.693
152 HA LYS 22 HA LYS 22 25.253 25.502 18.374
153 HB2 LYS 22 HB2 LYS 22 24.857 26.669 21.160
154 HB3 LYS 22 HB3 LYS 22 25.668 27.451 19.811
155 HG2 LYS 22 HG2 LYS 22 22.719 26.761 19.961
156 HG3 LYS 22 HG3 LYS 22 23.433 28.349 20.244
157 HD2 LYS 22 HD2 LYS 22 23.531 26.860 17.593
158 HD3 LYS 22 HD3 LYS 22 22.359 28.113 18.022
159 HE2 LYS 22 HE2 LYS 22 24.293 29.697 18.410
160 HE3 LYS 22 HE3 LYS 22 25.370 28.455 17.767
161 HZ1 LYS 22 HZ1 LYS 22 24.006 28.496 15.713
162 HZ2 LYS 22 HZ2 LYS 22 23.123 29.750 16.300
163 HZ3 LYS 22 HZ3 LYS 22 24.711 29.953 15.992
164 H CYS 23 H CYS 23 27.377 25.781 18.473
165 HA CYS 23 HA CYS 23 28.951 24.471 20.688
166 HB2 CYS 23 HB2 CYS 23 29.660 23.501 18.671
167 HB3 CYS 23 HB3 CYS 23 29.634 25.029 17.805
168 H ILE 24 H ILE 24 29.438 25.887 22.247
169 HA ILE 24 HA ILE 24 30.424 28.619 21.576
170 HB ILE 24 HB ILE 24 28.211 27.966 23.549
171 HG12 ILE 24 HG12 ILE 24 27.353 28.186 21.265
172 HG13 ILE 24 HG13 ILE 24 26.766 29.440 22.332
173 HG21 ILE 24 HG21 ILE 24 29.604 29.596 24.638
174 HG22 ILE 24 HG22 ILE 24 29.708 30.585 23.167
175 HG23 ILE 24 HG23 ILE 24 28.170 30.429 24.042
176 HD11 ILE 24 HD11 ILE 24 27.301 30.321 20.096
177 HD12 ILE 24 HD12 ILE 24 28.303 31.080 21.341
178 HD13 ILE 24 HD13 ILE 24 28.995 29.839 20.284
179 H GLY 25 H GLY 25 32.226 29.089 22.697
180 HA2 GLY 25 HA2 GLY 25 33.828 29.106 24.329
181 HA3 GLY 25 HA3 GLY 25 32.550 28.673 25.468
182 H GLU 26 H GLU 26 33.710 26.660 22.778
183 HA GLU 26 HA GLU 26 34.426 24.535 22.642
184 HB2 GLU 26 HB2 GLU 26 36.047 25.099 25.133
185 HB3 GLU 26 HB3 GLU 26 36.275 23.781 23.978
186 HG2 GLU 26 HG2 GLU 26 36.599 25.498 22.157
187 HG3 GLU 26 HG3 GLU 26 36.589 26.747 23.404
188 H GLU 27 H GLU 27 31.906 24.984 23.993
189 HA GLU 27 HA GLU 27 31.578 22.180 24.869
190 HB2 GLU 27 HB2 GLU 27 31.839 23.688 26.874
191 HB3 GLU 27 HB3 GLU 27 30.420 24.570 26.340
192 HG2 GLU 27 HG2 GLU 27 29.063 22.486 26.605
193 HG3 GLU 27 HG3 GLU 27 30.505 21.628 27.161
194 H CYS 28 H CYS 28 29.606 21.240 24.297
195 HA CYS 28 HA CYS 28 27.911 22.635 22.332
196 HB2 CYS 28 HB2 CYS 28 28.240 20.420 21.753
197 HB3 CYS 28 HB3 CYS 28 28.134 19.849 23.403
198 H LYS 29 H LYS 29 26.027 23.600 22.724
199 HA LYS 29 HA LYS 29 24.728 23.487 25.425
200 HB2 LYS 29 HB2 LYS 29 24.564 25.831 23.509
201 HB3 LYS 29 HB3 LYS 29 24.248 25.798 25.228
202 HG2 LYS 29 HG2 LYS 29 26.982 25.658 23.890
203 HG3 LYS 29 HG3 LYS 29 26.219 27.093 24.562
204 HD2 LYS 29 HD2 LYS 29 26.291 26.170 26.823
205 HD3 LYS 29 HD3 LYS 29 27.035 24.667 26.215
206 HE2 LYS 29 HE2 LYS 29 28.995 25.819 25.439
207 HE3 LYS 29 HE3 LYS 29 28.226 27.397 25.618
208 HZ1 LYS 29 HZ1 LYS 29 28.914 25.645 27.903
209 HZ2 LYS 29 HZ2 LYS 29 29.751 27.008 27.413
210 HZ3 LYS 29 HZ3 LYS 29 28.237 27.155 27.967
211 H CYS 30 H CYS 30 22.410 23.267 25.442
212 HA CYS 30 HA CYS 30 20.947 23.398 22.865
213 HB2 CYS 30 HB2 CYS 30 20.119 22.301 25.530
214 HB3 CYS 30 HB3 CYS 30 19.341 22.179 23.974
215 H VAL 31 H VAL 31 19.915 25.282 22.544
216 HA VAL 31 HA VAL 31 19.252 26.920 24.942
217 HB VAL 31 HB VAL 31 19.434 28.928 23.733
218 HG11 VAL 31 HG11 VAL 31 22.003 27.293 23.556
219 HG12 VAL 31 HG12 VAL 31 21.879 29.060 23.639
220 HG13 VAL 31 HG13 VAL 31 21.365 28.078 25.018
221 HG21 VAL 31 HG21 VAL 31 20.642 28.998 21.522
222 HG22 VAL 31 HG22 VAL 31 20.544 27.223 21.446
223 HG23 VAL 31 HG23 VAL 31 19.064 28.212 21.409
224 HA PRO 32 HA PRO 32 15.388 25.945 24.135
225 HB2 PRO 32 HB2 PRO 32 13.828 27.786 25.476
226 HB3 PRO 32 HB3 PRO 32 14.828 26.493 26.212
227 HG2 PRO 32 HG2 PRO 32 15.576 29.385 25.747
228 HG3 PRO 32 HG3 PRO 32 15.819 28.399 27.232
229 HD2 PRO 32 HD2 PRO 32 17.865 28.725 25.538
230 HD3 PRO 32 HD3 PRO 32 17.514 27.054 26.125
231 H TYR 33 H TYR 33 14.410 25.691 22.428
232 HA TYR 33 HA TYR 33 13.406 28.024 20.820
233 HB2 TYR 33 HB2 TYR 33 14.769 25.561 19.959
234 HB3 TYR 33 HB3 TYR 33 13.394 26.083 18.992
235 HD1 TYR 33 HD2 TYR 33 16.068 27.998 20.855
236 HD2 TYR 33 HD1 TYR 33 14.162 27.227 17.069
237 HE1 TYR 33 HE2 TYR 33 17.182 29.994 19.901
238 HE2 TYR 33 HE1 TYR 33 15.401 29.146 16.070
239 HH TYR 33 HH TYR 33 17.252 31.393 18.136
Start of MODEL 15
1 H1 GLY 1 H1 GLY 1 41.612 22.122 26.532
2 H2 GLY 1 H2 GLY 1 41.856 20.781 27.445
3 H3 GLY 1 H3 GLY 1 42.452 22.218 27.958
4 HA2 GLY 1 HA2 GLY 1 40.558 21.797 29.267
5 HA3 GLY 1 HA3 GLY 1 40.154 23.079 28.107
6 H SER 2 H SER 2 38.223 22.768 27.107
7 HA SER 2 HA SER 2 36.819 20.320 27.538
8 HB2 SER 2 HB2 SER 2 35.936 22.702 25.897
9 HB3 SER 2 HB3 SER 2 34.915 21.418 26.600
10 HG SER 2 HG SER 2 34.810 22.709 28.262
11 H ALA 3 H ALA 3 39.034 20.747 25.137
12 HA ALA 3 HA ALA 3 39.644 19.522 23.395
13 HB1 ALA 3 HB1 ALA 3 39.444 17.799 25.135
14 HB2 ALA 3 HB2 ALA 3 37.826 17.374 24.513
15 HB3 ALA 3 HB3 ALA 3 39.265 17.164 23.496
16 H PHE 4 H PHE 4 37.724 21.333 22.659
17 HA PHE 4 HA PHE 4 36.383 22.004 21.026
18 HB2 PHE 4 HB2 PHE 4 38.463 21.097 19.880
19 HB3 PHE 4 HB3 PHE 4 37.480 19.739 19.361
20 HD1 PHE 4 HD1 PHE 4 37.422 23.508 19.455
21 HD2 PHE 4 HD2 PHE 4 36.461 19.944 17.223
22 HE1 PHE 4 HE1 PHE 4 36.546 24.911 17.605
23 HE2 PHE 4 HE2 PHE 4 35.634 21.347 15.345
24 HZ PHE 4 HZ PHE 4 35.648 23.824 15.551
25 H CYS 5 H CYS 5 34.746 21.346 19.151
26 HA CYS 5 HA CYS 5 32.693 19.543 20.310
27 HB2 CYS 5 HB2 CYS 5 31.153 21.467 20.178
28 HB3 CYS 5 HB3 CYS 5 32.442 21.723 21.337
29 H ASN 6 H ASN 6 30.766 19.399 19.004
30 HA ASN 6 HA ASN 6 30.950 20.166 16.128
31 HB2 ASN 6 HB2 ASN 6 31.287 17.541 16.587
32 HB3 ASN 6 HB3 ASN 6 29.661 17.606 17.125
33 HD21 ASN 6 HD22 ASN 6 31.700 18.496 14.295
34 HD22 ASN 6 HD21 ASN 6 30.426 18.168 13.113
35 H LEU 7 H LEU 7 28.778 20.248 15.143
36 HA LEU 7 HA LEU 7 26.784 21.256 17.116
37 HB2 LEU 7 HB2 LEU 7 28.343 22.869 15.822
38 HB3 LEU 7 HB3 LEU 7 27.388 22.414 14.396
39 HG LEU 7 HG LEU 7 25.876 23.162 16.819
40 HD11 LEU 7 HD11 LEU 7 27.622 24.910 16.704
41 HD12 LEU 7 HD12 LEU 7 27.310 25.120 14.972
42 HD13 LEU 7 HD13 LEU 7 26.068 25.572 16.146
43 HD21 LEU 7 HD21 LEU 7 25.549 23.855 13.860
44 HD22 LEU 7 HD22 LEU 7 24.698 22.541 14.679
45 HD23 LEU 7 HD23 LEU 7 24.389 24.207 15.154
46 H ARG 8 H ARG 8 27.229 19.673 13.932
47 HA ARG 8 HA ARG 8 24.439 19.013 13.656
48 HB2 ARG 8 HB2 ARG 8 25.935 18.544 11.814
49 HB3 ARG 8 HB3 ARG 8 26.952 17.509 12.808
50 HG2 ARG 8 HG2 ARG 8 25.601 16.167 11.290
51 HG3 ARG 8 HG3 ARG 8 25.184 15.819 12.965
52 HD2 ARG 8 HD2 ARG 8 23.209 17.434 12.678
53 HD3 ARG 8 HD3 ARG 8 23.597 17.451 10.947
54 HE ARG 8 HE ARG 8 23.404 14.774 11.476
55 HH11 ARG 8 HH11 ARG 8 21.093 17.429 11.754
56 HH12 ARG 8 HH12 ARG 8 19.759 16.273 11.880
57 HH21 ARG 8 HH21 ARG 8 21.578 13.459 11.631
58 HH22 ARG 8 HH22 ARG 8 20.014 14.252 11.807
59 H ALA 9 H ALA 9 27.036 17.304 15.442
60 HA ALA 9 HA ALA 9 25.440 15.325 16.672
61 HB1 ALA 9 HB1 ALA 9 27.968 15.367 16.338
62 HB2 ALA 9 HB2 ALA 9 28.031 16.517 17.687
63 HB3 ALA 9 HB3 ALA 9 27.411 14.886 17.958
64 H CYS 10 H CYS 10 25.953 18.695 17.467
65 HA CYS 10 HA CYS 10 24.914 18.511 20.197
66 HB2 CYS 10 HB2 CYS 10 26.569 20.251 19.253
67 HB3 CYS 10 HB3 CYS 10 25.180 20.987 18.468
68 H GLU 11 H GLU 11 23.740 19.861 17.057
69 HA GLU 11 HA GLU 11 21.172 20.540 17.752
70 HB2 GLU 11 HB2 GLU 11 22.375 19.469 15.204
71 HB3 GLU 11 HB3 GLU 11 20.677 19.895 15.270
72 HG2 GLU 11 HG2 GLU 11 22.667 21.914 16.327
73 HG3 GLU 11 HG3 GLU 11 22.566 21.655 14.588
74 H LEU 12 H LEU 12 22.259 17.287 16.651
75 HA LEU 12 HA LEU 12 19.655 16.105 16.988
76 HB2 LEU 12 HB2 LEU 12 20.726 14.021 16.364
77 HB3 LEU 12 HB3 LEU 12 21.178 15.345 15.313
78 HG LEU 12 HG LEU 12 23.341 15.484 16.809
79 HD11 LEU 12 HD11 LEU 12 22.464 12.621 17.325
80 HD12 LEU 12 HD12 LEU 12 24.092 13.261 17.612
81 HD13 LEU 12 HD13 LEU 12 22.736 13.882 18.546
82 HD21 LEU 12 HD21 LEU 12 23.301 14.820 14.417
83 HD22 LEU 12 HD22 LEU 12 24.427 13.785 15.310
84 HD23 LEU 12 HD23 LEU 12 22.820 13.173 14.871
85 H SER 13 H SER 13 22.074 16.848 19.270
86 HA SER 13 HA SER 13 21.104 14.973 21.329
87 HB2 SER 13 HB2 SER 13 23.508 15.521 21.109
88 HB3 SER 13 HB3 SER 13 23.143 17.227 21.456
89 HG SER 13 HG SER 13 23.831 16.274 23.280
90 H CYS 14 H CYS 14 20.825 18.385 20.415
91 HA CYS 14 HA CYS 14 19.281 19.125 22.773
92 HB2 CYS 14 HB2 CYS 14 20.049 20.609 20.239
93 HB3 CYS 14 HB3 CYS 14 19.236 21.335 21.627
94 H ARG 15 H ARG 15 18.432 18.157 19.459
95 HA ARG 15 HA ARG 15 15.754 19.005 19.311
96 HB2 ARG 15 HB2 ARG 15 17.394 17.529 17.709
97 HB3 ARG 15 HB3 ARG 15 16.512 16.213 18.435
98 HG2 ARG 15 HG2 ARG 15 15.096 16.550 16.698
99 HG3 ARG 15 HG3 ARG 15 14.410 17.822 17.714
100 HD2 ARG 15 HD2 ARG 15 16.513 18.110 15.525
101 HD3 ARG 15 HD3 ARG 15 14.828 18.644 15.425
102 HE ARG 15 HE ARG 15 15.470 20.177 17.415
103 HH11 ARG 15 HH11 ARG 15 17.673 19.657 14.651
104 HH12 ARG 15 HH12 ARG 15 18.671 20.987 15.232
105 HH21 ARG 15 HH21 ARG 15 16.962 21.713 18.001
106 HH22 ARG 15 HH22 ARG 15 18.321 22.021 16.911
107 H SER 16 H SER 16 17.170 16.494 21.243
108 HA SER 16 HA SER 16 14.851 15.084 22.017
109 HB2 SER 16 HB2 SER 16 17.460 15.500 23.511
110 HB3 SER 16 HB3 SER 16 16.250 14.242 23.855
111 HG SER 16 HG SER 16 17.739 13.309 22.577
112 H LEU 17 H LEU 17 16.068 18.233 23.225
113 HA LEU 17 HA LEU 17 14.231 18.249 25.550
114 HB2 LEU 17 HB2 LEU 17 16.165 20.143 24.245
115 HB3 LEU 17 HB3 LEU 17 15.219 20.560 25.700
116 HG LEU 17 HG LEU 17 17.199 18.352 25.609
117 HD11 LEU 17 HD11 LEU 17 18.499 20.319 25.215
118 HD12 LEU 17 HD12 LEU 17 17.826 21.071 26.697
119 HD13 LEU 17 HD13 LEU 17 18.825 19.617 26.802
120 HD21 LEU 17 HD21 LEU 17 17.076 18.681 28.122
121 HD22 LEU 17 HD22 LEU 17 15.964 20.040 27.820
122 HD23 LEU 17 HD23 LEU 17 15.454 18.370 27.461
123 H GLY 18 H GLY 18 14.059 18.816 22.166
124 HA2 GLY 18 HA2 GLY 18 12.927 20.294 20.812
125 HA3 GLY 18 HA3 GLY 18 11.962 20.860 22.178
126 H LEU 19 H LEU 19 15.605 20.836 21.999
127 HA LEU 19 HA LEU 19 15.558 23.832 22.055
128 HB2 LEU 19 HB2 LEU 19 17.653 21.880 22.896
129 HB3 LEU 19 HB3 LEU 19 17.875 23.619 22.903
130 HG LEU 19 HG LEU 19 16.935 21.910 24.876
131 HD11 LEU 19 HD11 LEU 19 18.395 23.683 25.543
132 HD12 LEU 19 HD12 LEU 19 17.201 24.893 25.048
133 HD13 LEU 19 HD13 LEU 19 16.920 23.833 26.427
134 HD21 LEU 19 HD21 LEU 19 14.780 23.884 24.180
135 HD22 LEU 19 HD22 LEU 19 14.630 22.178 24.425
136 HD23 LEU 19 HD23 LEU 19 14.958 23.192 25.794
137 H LEU 20 H LEU 20 17.572 24.711 21.213
138 HA LEU 20 HA LEU 20 18.208 23.771 18.431
139 HB2 LEU 20 HB2 LEU 20 17.193 26.114 18.816
140 HB3 LEU 20 HB3 LEU 20 18.652 26.484 19.701
141 HG LEU 20 HG LEU 20 19.976 25.946 17.576
142 HD11 LEU 20 HD11 LEU 20 18.192 24.682 16.380
143 HD12 LEU 20 HD12 LEU 20 17.178 26.148 16.366
144 HD13 LEU 20 HD13 LEU 20 18.709 26.095 15.459
145 HD21 LEU 20 HD21 LEU 20 19.530 28.255 18.321
146 HD22 LEU 20 HD22 LEU 20 19.444 28.135 16.551
147 HD23 LEU 20 HD23 LEU 20 17.953 28.223 17.509
148 H GLY 21 H GLY 21 20.321 23.069 18.038
149 HA2 GLY 21 HA2 GLY 21 22.180 23.001 20.352
150 HA3 GLY 21 HA3 GLY 21 22.318 22.079 18.865
151 H LYS 22 H LYS 22 23.805 24.321 20.559
152 HA LYS 22 HA LYS 22 25.299 25.449 18.231
153 HB2 LYS 22 HB2 LYS 22 24.526 26.927 20.788
154 HB3 LYS 22 HB3 LYS 22 25.631 27.543 19.567
155 HG2 LYS 22 HG2 LYS 22 22.666 27.027 19.212
156 HG3 LYS 22 HG3 LYS 22 23.478 28.594 19.376
157 HD2 LYS 22 HD2 LYS 22 24.683 28.186 17.238
158 HD3 LYS 22 HD3 LYS 22 23.831 26.639 17.080
159 HE2 LYS 22 HE2 LYS 22 21.650 27.937 17.226
160 HE3 LYS 22 HE3 LYS 22 22.606 29.431 17.108
161 HZ1 LYS 22 HZ1 LYS 22 23.430 28.607 14.948
162 HZ2 LYS 22 HZ2 LYS 22 22.502 27.254 15.084
163 HZ3 LYS 22 HZ3 LYS 22 21.797 28.717 14.931
164 H CYS 23 H CYS 23 27.484 25.784 18.578
165 HA CYS 23 HA CYS 23 28.605 24.623 21.125
166 HB2 CYS 23 HB2 CYS 23 29.609 23.637 19.205
167 HB3 CYS 23 HB3 CYS 23 30.081 25.223 18.570
168 H ILE 24 H ILE 24 29.342 25.821 22.723
169 HA ILE 24 HA ILE 24 30.454 28.538 22.245
170 HB ILE 24 HB ILE 24 28.401 27.948 24.406
171 HG12 ILE 24 HG12 ILE 24 27.514 30.222 23.236
172 HG13 ILE 24 HG13 ILE 24 28.355 29.568 21.846
173 HG21 ILE 24 HG21 ILE 24 30.219 29.322 25.337
174 HG22 ILE 24 HG22 ILE 24 30.119 30.424 23.941
175 HG23 ILE 24 HG23 ILE 24 28.785 30.305 25.100
176 HD11 ILE 24 HD11 ILE 24 26.070 28.306 23.421
177 HD12 ILE 24 HD12 ILE 24 26.009 28.960 21.777
178 HD13 ILE 24 HD13 ILE 24 26.912 27.470 22.102
179 H GLY 25 H GLY 25 32.388 28.782 23.200
180 HA2 GLY 25 HA2 GLY 25 34.276 28.348 24.441
181 HA3 GLY 25 HA3 GLY 25 33.184 27.846 25.735
182 H GLU 26 H GLU 26 34.067 26.433 22.563
183 HA GLU 26 HA GLU 26 34.362 24.282 21.890
184 HB2 GLU 26 HB2 GLU 26 36.147 24.281 24.347
185 HB3 GLU 26 HB3 GLU 26 36.081 22.935 23.207
186 HG2 GLU 26 HG2 GLU 26 36.710 24.469 21.365
187 HG3 GLU 26 HG3 GLU 26 36.840 25.793 22.511
188 H GLU 27 H GLU 27 31.990 24.677 23.906
189 HA GLU 27 HA GLU 27 31.472 21.761 24.204
190 HB2 GLU 27 HB2 GLU 27 30.969 24.006 26.191
191 HB3 GLU 27 HB3 GLU 27 30.153 22.439 26.257
192 HG2 GLU 27 HG2 GLU 27 32.327 21.268 26.370
193 HG3 GLU 27 HG3 GLU 27 33.162 22.824 26.282
194 H CYS 28 H CYS 28 29.422 21.001 23.990
195 HA CYS 28 HA CYS 28 27.662 22.488 22.188
196 HB2 CYS 28 HB2 CYS 28 27.917 20.180 21.747
197 HB3 CYS 28 HB3 CYS 28 27.675 19.740 23.439
198 H LYS 29 H LYS 29 25.951 23.672 22.707
199 HA LYS 29 HA LYS 29 24.637 23.506 25.390
200 HB2 LYS 29 HB2 LYS 29 24.984 25.949 23.607
201 HB3 LYS 29 HB3 LYS 29 24.240 25.900 25.197
202 HG2 LYS 29 HG2 LYS 29 27.194 25.545 24.544
203 HG3 LYS 29 HG3 LYS 29 26.413 26.926 25.308
204 HD2 LYS 29 HD2 LYS 29 25.779 25.453 27.245
205 HD3 LYS 29 HD3 LYS 29 26.758 24.155 26.521
206 HE2 LYS 29 HE2 LYS 29 28.731 25.666 26.488
207 HE3 LYS 29 HE3 LYS 29 27.764 26.944 27.243
208 HZ1 LYS 29 HZ1 LYS 29 29.123 25.685 28.849
209 HZ2 LYS 29 HZ2 LYS 29 27.500 25.511 29.189
210 HZ3 LYS 29 HZ3 LYS 29 28.329 24.311 28.480
211 H CYS 30 H CYS 30 22.320 23.589 25.401
212 HA CYS 30 HA CYS 30 20.900 23.571 22.804
213 HB2 CYS 30 HB2 CYS 30 20.170 22.488 25.505
214 HB3 CYS 30 HB3 CYS 30 19.342 22.307 23.981
215 H VAL 31 H VAL 31 19.820 25.440 22.411
216 HA VAL 31 HA VAL 31 19.017 27.089 24.769
217 HB VAL 31 HB VAL 31 18.949 29.047 23.448
218 HG11 VAL 31 HG11 VAL 31 21.017 28.493 24.689
219 HG12 VAL 31 HG12 VAL 31 21.673 27.677 23.250
220 HG13 VAL 31 HG13 VAL 31 21.365 29.424 23.226
221 HG21 VAL 31 HG21 VAL 31 20.151 27.329 21.227
222 HG22 VAL 31 HG22 VAL 31 18.549 28.118 21.205
223 HG23 VAL 31 HG23 VAL 31 20.021 29.104 21.180
224 HA PRO 32 HA PRO 32 15.229 25.776 24.036
225 HB2 PRO 32 HB2 PRO 32 13.504 27.632 25.201
226 HB3 PRO 32 HB3 PRO 32 14.517 26.424 26.051
227 HG2 PRO 32 HG2 PRO 32 15.138 29.332 25.459
228 HG3 PRO 32 HG3 PRO 32 15.410 28.421 26.979
229 HD2 PRO 32 HD2 PRO 32 17.452 28.823 25.281
230 HD3 PRO 32 HD3 PRO 32 17.237 27.173 25.986
231 H TYR 33 H TYR 33 14.059 25.313 22.370
232 HA TYR 33 HA TYR 33 12.960 27.292 20.493
233 HB2 TYR 33 HB2 TYR 33 11.795 24.567 21.162
234 HB3 TYR 33 HB3 TYR 33 11.184 25.663 19.993
235 HD1 TYR 33 HD1 TYR 33 14.800 25.723 19.667
236 HD2 TYR 33 HD2 TYR 33 11.185 23.554 18.705
237 HE1 TYR 33 HE1 TYR 33 15.909 24.682 17.683
238 HE2 TYR 33 HE2 TYR 33 12.301 22.552 16.728
239 HH TYR 33 HH TYR 33 14.231 22.390 15.521
Start of MODEL 16
1 H1 GLY 1 H1 GLY 1 36.955 24.226 27.885
2 H2 GLY 1 H2 GLY 1 36.718 25.727 27.217
3 H3 GLY 1 H3 GLY 1 38.217 25.271 27.715
4 HA2 GLY 1 HA2 GLY 1 38.319 23.538 26.074
5 HA3 GLY 1 HA3 GLY 1 36.707 24.005 25.534
6 H SER 2 H SER 2 39.770 24.160 24.651
7 HA SER 2 HA SER 2 39.770 26.946 23.576
8 HB2 SER 2 HB2 SER 2 42.227 26.623 23.402
9 HB3 SER 2 HB3 SER 2 41.605 26.502 25.053
10 HG SER 2 HG SER 2 42.843 24.848 24.954
11 H ALA 3 H ALA 3 39.253 23.765 22.506
12 HA ALA 3 HA ALA 3 39.860 24.529 19.672
13 HB1 ALA 3 HB1 ALA 3 39.891 22.244 19.148
14 HB2 ALA 3 HB2 ALA 3 40.742 22.343 20.695
15 HB3 ALA 3 HB3 ALA 3 39.061 21.775 20.634
16 H PHE 4 H PHE 4 37.944 22.890 18.425
17 HA PHE 4 HA PHE 4 35.391 24.318 19.020
18 HB2 PHE 4 HB2 PHE 4 36.391 23.094 16.429
19 HB3 PHE 4 HB3 PHE 4 34.866 23.914 16.653
20 HD1 PHE 4 HD2 PHE 4 38.574 24.417 16.665
21 HD2 PHE 4 HD1 PHE 4 34.699 26.319 16.570
22 HE1 PHE 4 HE2 PHE 4 39.663 26.622 16.331
23 HE2 PHE 4 HE1 PHE 4 35.785 28.514 16.195
24 HZ PHE 4 HZ PHE 4 38.270 28.672 16.126
25 H CYS 5 H CYS 5 33.405 22.977 18.274
26 HA CYS 5 HA CYS 5 33.737 20.064 18.444
27 HB2 CYS 5 HB2 CYS 5 31.796 19.991 19.992
28 HB3 CYS 5 HB3 CYS 5 33.293 20.563 20.691
29 H ASN 6 H ASN 6 31.894 18.866 17.667
30 HA ASN 6 HA ASN 6 30.669 20.013 15.315
31 HB2 ASN 6 HB2 ASN 6 31.193 17.421 15.975
32 HB3 ASN 6 HB3 ASN 6 29.638 17.524 16.683
33 HD21 ASN 6 HD22 ASN 6 31.427 17.295 13.753
34 HD22 ASN 6 HD21 ASN 6 30.029 17.372 12.659
35 H LEU 7 H LEU 7 28.698 20.515 14.775
36 HA LEU 7 HA LEU 7 26.851 21.370 16.955
37 HB2 LEU 7 HB2 LEU 7 28.308 23.044 15.658
38 HB3 LEU 7 HB3 LEU 7 27.332 22.618 14.242
39 HG LEU 7 HG LEU 7 25.813 23.287 16.672
40 HD11 LEU 7 HD11 LEU 7 27.593 25.018 16.676
41 HD12 LEU 7 HD12 LEU 7 27.290 25.334 14.965
42 HD13 LEU 7 HD13 LEU 7 26.048 25.732 16.153
43 HD21 LEU 7 HD21 LEU 7 25.546 24.157 13.753
44 HD22 LEU 7 HD22 LEU 7 24.661 22.806 14.468
45 HD23 LEU 7 HD23 LEU 7 24.365 24.445 15.041
46 H ARG 8 H ARG 8 27.047 19.836 13.736
47 HA ARG 8 HA ARG 8 24.201 19.339 13.629
48 HB2 ARG 8 HB2 ARG 8 25.637 18.844 11.720
49 HB3 ARG 8 HB3 ARG 8 26.495 17.600 12.625
50 HG2 ARG 8 HG2 ARG 8 24.924 16.573 11.090
51 HG3 ARG 8 HG3 ARG 8 24.427 16.241 12.748
52 HD2 ARG 8 HD2 ARG 8 22.731 18.077 12.574
53 HD3 ARG 8 HD3 ARG 8 23.215 18.334 10.885
54 HE ARG 8 HE ARG 8 22.611 15.666 10.898
55 HH11 ARG 8 HH12 ARG 8 20.664 18.404 11.910
56 HH12 ARG 8 HH11 ARG 8 19.207 17.434 12.011
57 HH21 ARG 8 HH21 ARG 8 20.790 14.586 10.834
58 HH22 ARG 8 HH22 ARG 8 19.245 15.340 11.202
59 H ALA 9 H ALA 9 26.825 17.479 15.214
60 HA ALA 9 HA ALA 9 25.304 15.528 16.566
61 HB1 ALA 9 HB1 ALA 9 27.854 15.705 16.209
62 HB2 ALA 9 HB2 ALA 9 27.844 16.915 17.504
63 HB3 ALA 9 HB3 ALA 9 27.339 15.257 17.852
64 H CYS 10 H CYS 10 26.106 18.895 17.440
65 HA CYS 10 HA CYS 10 24.965 18.785 20.085
66 HB2 CYS 10 HB2 CYS 10 26.642 20.465 19.119
67 HB3 CYS 10 HB3 CYS 10 25.256 21.214 18.310
68 H GLU 11 H GLU 11 23.754 20.070 16.934
69 HA GLU 11 HA GLU 11 21.186 20.706 17.688
70 HB2 GLU 11 HB2 GLU 11 22.320 19.691 15.089
71 HB3 GLU 11 HB3 GLU 11 20.632 20.103 15.238
72 HG2 GLU 11 HG2 GLU 11 22.674 22.127 16.183
73 HG3 GLU 11 HG3 GLU 11 22.458 21.856 14.456
74 H LEU 12 H LEU 12 22.466 17.453 16.788
75 HA LEU 12 HA LEU 12 20.004 16.008 17.053
76 HB2 LEU 12 HB2 LEU 12 22.755 14.865 17.699
77 HB3 LEU 12 HB3 LEU 12 21.296 14.032 17.221
78 HG LEU 12 HG LEU 12 23.341 15.385 15.504
79 HD11 LEU 12 HD11 LEU 12 23.087 13.348 14.220
80 HD12 LEU 12 HD12 LEU 12 23.379 12.977 15.926
81 HD13 LEU 12 HD13 LEU 12 21.742 12.826 15.254
82 HD21 LEU 12 HD21 LEU 12 21.766 15.169 13.577
83 HD22 LEU 12 HD22 LEU 12 20.429 14.898 14.710
84 HD23 LEU 12 HD23 LEU 12 21.278 16.466 14.675
85 H SER 13 H SER 13 22.614 16.717 19.356
86 HA SER 13 HA SER 13 21.535 15.379 21.624
87 HB2 SER 13 HB2 SER 13 23.355 17.826 21.556
88 HB3 SER 13 HB3 SER 13 23.064 16.782 22.946
89 HG SER 13 HG SER 13 24.286 16.052 20.473
90 H CYS 14 H CYS 14 20.901 18.580 20.313
91 HA CYS 14 HA CYS 14 19.333 19.395 22.662
92 HB2 CYS 14 HB2 CYS 14 20.096 20.790 20.080
93 HB3 CYS 14 HB3 CYS 14 19.190 21.533 21.415
94 H ARG 15 H ARG 15 18.673 18.090 19.451
95 HA ARG 15 HA ARG 15 15.869 18.481 19.322
96 HB2 ARG 15 HB2 ARG 15 17.798 17.042 17.877
97 HB3 ARG 15 HB3 ARG 15 16.947 15.749 18.675
98 HG2 ARG 15 HG2 ARG 15 15.590 15.857 16.879
99 HG3 ARG 15 HG3 ARG 15 14.816 17.187 17.739
100 HD2 ARG 15 HD2 ARG 15 16.963 17.365 15.582
101 HD3 ARG 15 HD3 ARG 15 15.263 17.822 15.408
102 HE ARG 15 HE ARG 15 15.843 19.535 17.310
103 HH11 ARG 15 HH11 ARG 15 17.792 18.946 14.452
104 HH12 ARG 15 HH12 ARG 15 18.672 20.432 14.675
105 HH21 ARG 15 HH21 ARG 15 17.128 21.247 17.654
106 HH22 ARG 15 HH22 ARG 15 18.411 21.624 16.521
107 H SER 16 H SER 16 17.788 16.457 21.396
108 HA SER 16 HA SER 16 15.841 14.805 22.571
109 HB2 SER 16 HB2 SER 16 18.248 15.980 23.983
110 HB3 SER 16 HB3 SER 16 17.428 14.454 24.350
111 HG SER 16 HG SER 16 19.429 14.373 23.051
112 H LEU 17 H LEU 17 16.273 18.290 23.097
113 HA LEU 17 HA LEU 17 14.279 18.291 25.330
114 HB2 LEU 17 HB2 LEU 17 16.160 20.247 24.042
115 HB3 LEU 17 HB3 LEU 17 15.028 20.708 25.339
116 HG LEU 17 HG LEU 17 17.218 18.699 25.642
117 HD11 LEU 17 HD11 LEU 17 17.458 21.540 26.552
118 HD12 LEU 17 HD12 LEU 17 18.569 20.199 26.890
119 HD13 LEU 17 HD13 LEU 17 18.365 20.735 25.228
120 HD21 LEU 17 HD21 LEU 17 15.614 20.399 27.590
121 HD22 LEU 17 HD22 LEU 17 15.296 18.667 27.310
122 HD23 LEU 17 HD23 LEU 17 16.804 19.168 28.097
123 H GLY 18 H GLY 18 14.514 18.487 21.950
124 HA2 GLY 18 HA2 GLY 18 13.283 19.457 20.265
125 HA3 GLY 18 HA3 GLY 18 12.212 20.220 21.447
126 H LEU 19 H LEU 19 15.679 20.708 21.864
127 HA LEU 19 HA LEU 19 15.280 23.627 21.543
128 HB2 LEU 19 HB2 LEU 19 17.535 21.973 22.625
129 HB3 LEU 19 HB3 LEU 19 17.638 23.719 22.507
130 HG LEU 19 HG LEU 19 16.700 22.102 24.568
131 HD11 LEU 19 HD11 LEU 19 16.930 25.061 24.568
132 HD12 LEU 19 HD12 LEU 19 16.496 24.103 25.978
133 HD13 LEU 19 HD13 LEU 19 18.048 23.860 25.250
134 HD21 LEU 19 HD21 LEU 19 14.601 23.255 25.257
135 HD22 LEU 19 HD22 LEU 19 14.580 24.058 23.679
136 HD23 LEU 19 HD23 LEU 19 14.404 22.314 23.801
137 H LEU 20 H LEU 20 17.306 24.750 20.837
138 HA LEU 20 HA LEU 20 18.175 23.849 18.103
139 HB2 LEU 20 HB2 LEU 20 16.988 26.051 18.290
140 HB3 LEU 20 HB3 LEU 20 18.178 26.552 19.473
141 HG LEU 20 HG LEU 20 19.966 26.354 17.674
142 HD11 LEU 20 HD11 LEU 20 19.131 26.366 15.317
143 HD12 LEU 20 HD12 LEU 20 18.784 24.842 16.137
144 HD13 LEU 20 HD13 LEU 20 17.492 26.046 15.920
145 HD21 LEU 20 HD21 LEU 20 19.302 28.440 16.522
146 HD22 LEU 20 HD22 LEU 20 17.643 28.252 17.129
147 HD23 LEU 20 HD23 LEU 20 18.986 28.535 18.261
148 H GLY 21 H GLY 21 20.307 23.206 17.897
149 HA2 GLY 21 HA2 GLY 21 22.031 23.320 20.310
150 HA3 GLY 21 HA3 GLY 21 22.262 22.295 18.906
151 H LYS 22 H LYS 22 23.693 24.573 20.522
152 HA LYS 22 HA LYS 22 25.306 25.499 18.206
153 HB2 LYS 22 HB2 LYS 22 24.839 27.145 20.723
154 HB3 LYS 22 HB3 LYS 22 25.902 27.564 19.387
155 HG2 LYS 22 HG2 LYS 22 22.884 27.424 19.334
156 HG3 LYS 22 HG3 LYS 22 23.905 28.872 19.329
157 HD2 LYS 22 HD2 LYS 22 24.780 28.219 17.081
158 HD3 LYS 22 HD3 LYS 22 23.691 26.831 17.099
159 HE2 LYS 22 HE2 LYS 22 21.779 28.523 17.480
160 HE3 LYS 22 HE3 LYS 22 22.952 29.785 17.079
161 HZ1 LYS 22 HZ1 LYS 22 22.188 27.508 15.325
162 HZ2 LYS 22 HZ2 LYS 22 21.730 29.068 15.079
163 HZ3 LYS 22 HZ3 LYS 22 23.297 28.629 14.922
164 H CYS 23 H CYS 23 27.473 25.383 18.536
165 HA CYS 23 HA CYS 23 28.379 24.050 21.077
166 HB2 CYS 23 HB2 CYS 23 27.963 22.507 19.012
167 HB3 CYS 23 HB3 CYS 23 29.542 23.088 18.478
168 H ILE 24 H ILE 24 29.814 25.238 22.077
169 HA ILE 24 HA ILE 24 31.848 26.797 20.545
170 HB ILE 24 HB ILE 24 29.940 27.969 22.608
171 HG12 ILE 24 HG12 ILE 24 30.300 28.560 19.628
172 HG13 ILE 24 HG13 ILE 24 28.929 27.718 20.357
173 HG21 ILE 24 HG21 ILE 24 32.259 29.305 21.131
174 HG22 ILE 24 HG22 ILE 24 31.135 30.099 22.255
175 HG23 ILE 24 HG23 ILE 24 32.243 28.899 22.864
176 HD11 ILE 24 HD11 ILE 24 29.613 30.637 20.697
177 HD12 ILE 24 HD12 ILE 24 28.215 29.909 19.891
178 HD13 ILE 24 HD13 ILE 24 28.379 29.772 21.654
179 H GLY 25 H GLY 25 33.803 26.763 21.440
180 HA2 GLY 25 HA2 GLY 25 35.529 26.345 22.903
181 HA3 GLY 25 HA3 GLY 25 34.442 26.815 24.204
182 H GLU 26 H GLU 26 34.471 24.060 21.947
183 HA GLU 26 HA GLU 26 34.317 21.840 22.170
184 HB2 GLU 26 HB2 GLU 26 35.917 22.093 24.722
185 HB3 GLU 26 HB3 GLU 26 35.794 20.698 23.647
186 HG2 GLU 26 HG2 GLU 26 36.786 22.140 21.806
187 HG3 GLU 26 HG3 GLU 26 37.088 23.385 23.025
188 H GLU 27 H GLU 27 32.176 23.503 23.765
189 HA GLU 27 HA GLU 27 30.882 21.057 24.841
190 HB2 GLU 27 HB2 GLU 27 31.671 22.200 26.799
191 HB3 GLU 27 HB3 GLU 27 31.062 23.750 26.205
192 HG2 GLU 27 HG2 GLU 27 29.652 22.983 27.979
193 HG3 GLU 27 HG3 GLU 27 28.733 22.975 26.501
194 H CYS 28 H CYS 28 28.766 20.825 24.556
195 HA CYS 28 HA CYS 28 27.457 22.490 22.481
196 HB2 CYS 28 HB2 CYS 28 27.556 20.162 21.991
197 HB3 CYS 28 HB3 CYS 28 26.999 19.720 23.603
198 H LYS 29 H LYS 29 25.794 23.775 22.831
199 HA LYS 29 HA LYS 29 24.269 23.741 25.400
200 HB2 LYS 29 HB2 LYS 29 25.841 25.614 25.282
201 HB3 LYS 29 HB3 LYS 29 25.206 26.085 23.698
202 HG2 LYS 29 HG2 LYS 29 23.005 26.573 24.750
203 HG3 LYS 29 HG3 LYS 29 23.659 26.132 26.330
204 HD2 LYS 29 HD2 LYS 29 24.724 28.372 24.548
205 HD3 LYS 29 HD3 LYS 29 23.553 28.587 25.850
206 HE2 LYS 29 HE2 LYS 29 25.325 27.495 27.396
207 HE3 LYS 29 HE3 LYS 29 26.474 27.772 26.087
208 HZ1 LYS 29 HZ1 LYS 29 26.436 29.619 27.674
209 HZ2 LYS 29 HZ2 LYS 29 25.904 30.174 26.241
210 HZ3 LYS 29 HZ3 LYS 29 24.851 29.839 27.462
211 H CYS 30 H CYS 30 22.019 23.956 25.254
212 HA CYS 30 HA CYS 30 20.714 23.828 22.594
213 HB2 CYS 30 HB2 CYS 30 19.891 22.745 25.273
214 HB3 CYS 30 HB3 CYS 30 19.170 22.493 23.708
215 H VAL 31 H VAL 31 19.649 25.650 22.145
216 HA VAL 31 HA VAL 31 18.787 27.347 24.429
217 HB VAL 31 HB VAL 31 18.756 29.234 23.081
218 HG11 VAL 31 HG11 VAL 31 20.899 28.575 24.210
219 HG12 VAL 31 HG12 VAL 31 21.433 27.793 22.708
220 HG13 VAL 31 HG13 VAL 31 21.170 29.545 22.747
221 HG21 VAL 31 HG21 VAL 31 18.231 28.290 20.858
222 HG22 VAL 31 HG22 VAL 31 19.753 29.190 20.757
223 HG23 VAL 31 HG23 VAL 31 19.792 27.425 20.842
224 HA PRO 32 HA PRO 32 14.869 26.106 23.762
225 HB2 PRO 32 HB2 PRO 32 13.327 28.364 24.556
226 HB3 PRO 32 HB3 PRO 32 13.894 26.978 25.531
227 HG2 PRO 32 HG2 PRO 32 15.099 29.694 25.263
228 HG3 PRO 32 HG3 PRO 32 15.182 28.559 26.644
229 HD2 PRO 32 HD2 PRO 32 17.288 28.974 24.954
230 HD3 PRO 32 HD3 PRO 32 16.975 27.336 25.630
231 H TYR 33 H TYR 33 13.813 25.592 22.129
232 HA TYR 33 HA TYR 33 13.317 27.107 19.724
233 HB2 TYR 33 HB2 TYR 33 12.493 24.540 20.865
234 HB3 TYR 33 HB3 TYR 33 11.174 25.314 20.035
235 HD1 TYR 33 HD1 TYR 33 14.882 25.258 19.217
236 HD2 TYR 33 HD2 TYR 33 10.853 24.203 18.053
237 HE1 TYR 33 HE1 TYR 33 15.743 24.223 17.111
238 HE2 TYR 33 HE2 TYR 33 11.717 23.237 15.935
239 HH TYR 33 HH TYR 33 15.195 23.108 15.152
Start of MODEL 17
1 H1 GLY 1 H1 GLY 1 37.099 17.400 28.618
2 H2 GLY 1 H2 GLY 1 37.989 18.299 27.565
3 H3 GLY 1 H3 GLY 1 38.508 16.804 27.980
4 HA2 GLY 1 HA2 GLY 1 36.612 15.791 26.892
5 HA3 GLY 1 HA3 GLY 1 36.068 17.420 26.464
6 H SER 2 H SER 2 38.037 14.771 25.510
7 HA SER 2 HA SER 2 39.977 16.340 23.983
8 HB2 SER 2 HB2 SER 2 40.960 14.129 23.451
9 HB3 SER 2 HB3 SER 2 40.792 14.457 25.181
10 HG SER 2 HG SER 2 39.772 12.626 25.260
11 H ALA 3 H ALA 3 36.917 15.841 23.285
12 HA ALA 3 HA ALA 3 37.138 15.273 20.388
13 HB1 ALA 3 HB1 ALA 3 34.686 15.126 20.551
14 HB2 ALA 3 HB2 ALA 3 35.450 14.097 21.766
15 HB3 ALA 3 HB3 ALA 3 34.753 15.661 22.236
16 H PHE 4 H PHE 4 35.158 16.783 19.370
17 HA PHE 4 HA PHE 4 35.729 19.649 19.991
18 HB2 PHE 4 HB2 PHE 4 35.009 18.505 17.283
19 HB3 PHE 4 HB3 PHE 4 35.459 20.161 17.651
20 HD1 PHE 4 HD1 PHE 4 37.905 20.310 18.938
21 HD2 PHE 4 HD2 PHE 4 36.629 17.252 16.182
22 HE1 PHE 4 HE1 PHE 4 40.275 19.773 18.428
23 HE2 PHE 4 HE2 PHE 4 38.993 16.746 15.638
24 HZ PHE 4 HZ PHE 4 40.823 18.005 16.768
25 H CYS 5 H CYS 5 33.949 21.135 19.529
26 HA CYS 5 HA CYS 5 31.366 19.982 20.246
27 HB2 CYS 5 HB2 CYS 5 30.647 22.294 20.436
28 HB3 CYS 5 HB3 CYS 5 32.100 21.954 21.360
29 H ASN 6 H ASN 6 31.505 18.651 18.179
30 HA ASN 6 HA ASN 6 30.683 19.697 15.643
31 HB2 ASN 6 HB2 ASN 6 30.136 17.061 17.069
32 HB3 ASN 6 HB3 ASN 6 29.651 17.370 15.431
33 HD21 ASN 6 HD22 ASN 6 31.985 15.811 17.112
34 HD22 ASN 6 HD21 ASN 6 33.290 15.940 15.933
35 H LEU 7 H LEU 7 28.750 20.356 14.862
36 HA LEU 7 HA LEU 7 26.650 20.719 16.913
37 HB2 LEU 7 HB2 LEU 7 28.040 22.558 15.295
38 HB3 LEU 7 HB3 LEU 7 26.441 22.414 14.563
39 HG LEU 7 HG LEU 7 25.431 22.767 16.839
40 HD11 LEU 7 HD11 LEU 7 28.232 23.660 17.657
41 HD12 LEU 7 HD12 LEU 7 26.751 23.597 18.651
42 HD13 LEU 7 HD13 LEU 7 27.551 22.116 18.171
43 HD21 LEU 7 HD21 LEU 7 25.739 24.591 15.161
44 HD22 LEU 7 HD22 LEU 7 25.879 25.206 16.799
45 HD23 LEU 7 HD23 LEU 7 27.339 24.940 15.836
46 H ARG 8 H ARG 8 26.958 19.845 13.518
47 HA ARG 8 HA ARG 8 24.221 18.664 13.584
48 HB2 ARG 8 HB2 ARG 8 26.394 18.741 11.519
49 HB3 ARG 8 HB3 ARG 8 25.095 17.567 11.340
50 HG2 ARG 8 HG2 ARG 8 24.258 20.361 12.102
51 HG3 ARG 8 HG3 ARG 8 24.947 20.136 10.493
52 HD2 ARG 8 HD2 ARG 8 22.829 19.724 9.895
53 HD3 ARG 8 HD3 ARG 8 23.252 18.084 10.380
54 HE ARG 8 HE ARG 8 21.989 19.811 12.442
55 HH11 ARG 8 HH21 ARG 8 21.295 17.626 9.774
56 HH12 ARG 8 HH22 ARG 8 19.718 17.205 10.412
57 HH21 ARG 8 HH11 ARG 8 19.804 19.453 12.986
58 HH22 ARG 8 HH12 ARG 8 18.929 18.207 12.160
59 H ALA 9 H ALA 9 26.159 17.952 15.502
60 HA ALA 9 HA ALA 9 25.209 15.177 15.801
61 HB1 ALA 9 HB1 ALA 9 27.836 16.373 16.822
62 HB2 ALA 9 HB2 ALA 9 27.238 14.740 17.203
63 HB3 ALA 9 HB3 ALA 9 27.688 15.164 15.535
64 H CYS 10 H CYS 10 26.156 18.290 17.339
65 HA CYS 10 HA CYS 10 24.890 17.703 19.881
66 HB2 CYS 10 HB2 CYS 10 26.654 19.482 19.520
67 HB3 CYS 10 HB3 CYS 10 25.441 20.442 18.689
68 H GLU 11 H GLU 11 23.809 19.641 17.085
69 HA GLU 11 HA GLU 11 21.266 20.488 17.939
70 HB2 GLU 11 HB2 GLU 11 22.198 19.602 15.184
71 HB3 GLU 11 HB3 GLU 11 20.678 20.409 15.515
72 HG2 GLU 11 HG2 GLU 11 21.954 22.409 16.308
73 HG3 GLU 11 HG3 GLU 11 23.445 21.640 15.894
74 H LEU 12 H LEU 12 22.272 17.299 16.880
75 HA LEU 12 HA LEU 12 19.560 16.222 16.657
76 HB2 LEU 12 HB2 LEU 12 22.121 14.617 17.002
77 HB3 LEU 12 HB3 LEU 12 20.644 14.151 16.183
78 HG LEU 12 HG LEU 12 22.750 16.130 15.172
79 HD11 LEU 12 HD11 LEU 12 23.381 13.742 15.063
80 HD12 LEU 12 HD12 LEU 12 21.859 13.367 14.227
81 HD13 LEU 12 HD13 LEU 12 23.078 14.385 13.440
82 HD21 LEU 12 HD21 LEU 12 20.152 15.197 13.866
83 HD22 LEU 12 HD22 LEU 12 20.533 16.855 14.374
84 HD23 LEU 12 HD23 LEU 12 21.443 16.106 13.051
85 H SER 13 H SER 13 22.094 16.298 19.152
86 HA SER 13 HA SER 13 20.721 14.566 21.021
87 HB2 SER 13 HB2 SER 13 22.990 16.549 21.441
88 HB3 SER 13 HB3 SER 13 22.459 15.310 22.597
89 HG SER 13 HG SER 13 24.282 14.804 21.115
90 H CYS 14 H CYS 14 21.112 18.127 20.771
91 HA CYS 14 HA CYS 14 19.404 18.875 22.957
92 HB2 CYS 14 HB2 CYS 14 20.357 20.297 20.441
93 HB3 CYS 14 HB3 CYS 14 19.422 21.084 21.703
94 H ARG 15 H ARG 15 18.533 17.731 19.745
95 HA ARG 15 HA ARG 15 15.970 18.922 19.531
96 HB2 ARG 15 HB2 ARG 15 17.439 17.478 17.844
97 HB3 ARG 15 HB3 ARG 15 16.596 16.112 18.539
98 HG2 ARG 15 HG2 ARG 15 15.382 16.797 16.601
99 HG3 ARG 15 HG3 ARG 15 14.425 17.304 17.985
100 HD2 ARG 15 HD2 ARG 15 16.199 19.485 17.387
101 HD3 ARG 15 HD3 ARG 15 15.623 18.898 15.833
102 HE ARG 15 HE ARG 15 13.274 19.028 17.094
103 HH11 ARG 15 HH11 ARG 15 15.699 21.602 17.088
104 HH12 ARG 15 HH12 ARG 15 14.457 22.746 17.630
105 HH21 ARG 15 HH21 ARG 15 11.907 20.539 17.613
106 HH22 ARG 15 HH22 ARG 15 12.457 22.209 17.879
107 H SER 16 H SER 16 17.096 16.442 21.596
108 HA SER 16 HA SER 16 14.882 15.080 22.575
109 HB2 SER 16 HB2 SER 16 15.987 15.363 24.839
110 HB3 SER 16 HB3 SER 16 17.017 14.696 23.559
111 HG SER 16 HG SER 16 18.226 16.418 23.602
112 H LEU 17 H LEU 17 15.862 18.414 23.488
113 HA LEU 17 HA LEU 17 13.674 18.850 25.360
114 HB2 LEU 17 HB2 LEU 17 15.841 20.450 24.052
115 HB3 LEU 17 HB3 LEU 17 14.777 21.123 25.323
116 HG LEU 17 HG LEU 17 16.567 18.796 25.776
117 HD11 LEU 17 HD11 LEU 17 18.096 20.546 25.202
118 HD12 LEU 17 HD12 LEU 17 17.387 21.596 26.472
119 HD13 LEU 17 HD13 LEU 17 18.214 20.090 26.898
120 HD21 LEU 17 HD21 LEU 17 16.257 19.525 28.175
121 HD22 LEU 17 HD22 LEU 17 15.351 20.939 27.568
122 HD23 LEU 17 HD23 LEU 17 14.674 19.299 27.402
123 H GLY 18 H GLY 18 13.880 18.941 21.966
124 HA2 GLY 18 HA2 GLY 18 12.896 20.212 20.277
125 HA3 GLY 18 HA3 GLY 18 11.980 21.120 21.488
126 H LEU 19 H LEU 19 15.559 20.747 21.744
127 HA LEU 19 HA LEU 19 15.808 23.688 21.201
128 HB2 LEU 19 HB2 LEU 19 17.659 21.835 22.611
129 HB3 LEU 19 HB3 LEU 19 17.942 23.546 22.374
130 HG LEU 19 HG LEU 19 16.746 22.190 24.458
131 HD11 LEU 19 HD11 LEU 19 18.176 23.980 25.022
132 HD12 LEU 19 HD12 LEU 19 17.123 25.154 24.195
133 HD13 LEU 19 HD13 LEU 19 16.632 24.340 25.682
134 HD21 LEU 19 HD21 LEU 19 14.480 22.499 23.656
135 HD22 LEU 19 HD22 LEU 19 14.731 23.534 25.022
136 HD23 LEU 19 HD23 LEU 19 14.747 24.190 23.391
137 H LEU 20 H LEU 20 17.976 24.246 20.509
138 HA LEU 20 HA LEU 20 18.966 22.654 18.171
139 HB2 LEU 20 HB2 LEU 20 17.925 24.972 17.746
140 HB3 LEU 20 HB3 LEU 20 19.282 25.635 18.658
141 HG LEU 20 HG LEU 20 20.816 24.596 16.910
142 HD11 LEU 20 HD11 LEU 20 19.318 22.838 16.025
143 HD12 LEU 20 HD12 LEU 20 18.132 24.061 15.546
144 HD13 LEU 20 HD13 LEU 20 19.714 23.971 14.730
145 HD21 LEU 20 HD21 LEU 20 20.026 26.981 16.795
146 HD22 LEU 20 HD22 LEU 20 20.359 26.274 15.201
147 HD23 LEU 20 HD23 LEU 20 18.684 26.449 15.779
148 H GLY 21 H GLY 21 21.213 22.338 18.062
149 HA2 GLY 21 HA2 GLY 21 22.735 22.634 20.571
150 HA3 GLY 21 HA3 GLY 21 23.258 21.809 19.103
151 H LYS 22 H LYS 22 24.017 24.248 20.966
152 HA LYS 22 HA LYS 22 25.521 25.657 18.799
153 HB2 LYS 22 HB2 LYS 22 24.270 26.928 21.292
154 HB3 LYS 22 HB3 LYS 22 25.416 27.751 20.236
155 HG2 LYS 22 HG2 LYS 22 22.684 26.742 19.422
156 HG3 LYS 22 HG3 LYS 22 23.133 28.428 19.783
157 HD2 LYS 22 HD2 LYS 22 24.757 28.339 17.884
158 HD3 LYS 22 HD3 LYS 22 24.172 26.699 17.526
159 HE2 LYS 22 HE2 LYS 22 21.856 27.671 17.324
160 HE3 LYS 22 HE3 LYS 22 22.567 29.287 17.460
161 HZ1 LYS 22 HZ1 LYS 22 22.242 28.631 15.187
162 HZ2 LYS 22 HZ2 LYS 22 23.843 28.818 15.455
163 HZ3 LYS 22 HZ3 LYS 22 23.199 27.285 15.365
164 H CYS 23 H CYS 23 27.541 25.855 19.012
165 HA CYS 23 HA CYS 23 28.891 24.982 21.503
166 HB2 CYS 23 HB2 CYS 23 29.768 24.252 19.353
167 HB3 CYS 23 HB3 CYS 23 30.175 25.921 18.945
168 H ILE 24 H ILE 24 29.643 26.152 23.068
169 HA ILE 24 HA ILE 24 30.592 28.899 22.618
170 HB ILE 24 HB ILE 24 28.876 28.323 25.064
171 HG12 ILE 24 HG12 ILE 24 27.413 30.242 23.965
172 HG13 ILE 24 HG13 ILE 24 28.043 29.618 22.452
173 HG21 ILE 24 HG21 ILE 24 30.699 29.987 25.316
174 HG22 ILE 24 HG22 ILE 24 30.065 30.891 23.926
175 HG23 ILE 24 HG23 ILE 24 29.113 30.748 25.417
176 HD11 ILE 24 HD11 ILE 24 27.112 27.351 23.096
177 HD12 ILE 24 HD12 ILE 24 26.485 28.084 24.581
178 HD13 ILE 24 HD13 ILE 24 25.873 28.612 22.997
179 H GLY 25 H GLY 25 32.607 28.946 23.259
180 HA2 GLY 25 HA2 GLY 25 34.557 28.578 24.424
181 HA3 GLY 25 HA3 GLY 25 33.574 28.127 25.824
182 H GLU 26 H GLU 26 34.005 26.664 22.604
183 HA GLU 26 HA GLU 26 34.410 24.558 21.861
184 HB2 GLU 26 HB2 GLU 26 36.349 24.410 24.137
185 HB3 GLU 26 HB3 GLU 26 36.343 23.433 22.665
186 HG2 GLU 26 HG2 GLU 26 36.773 26.447 22.825
187 HG3 GLU 26 HG3 GLU 26 37.943 25.190 22.484
188 H GLU 27 H GLU 27 32.227 24.793 23.985
189 HA GLU 27 HA GLU 27 31.710 21.879 24.108
190 HB2 GLU 27 HB2 GLU 27 32.589 22.476 26.322
191 HB3 GLU 27 HB3 GLU 27 31.452 23.822 26.435
192 HG2 GLU 27 HG2 GLU 27 30.698 21.996 27.806
193 HG3 GLU 27 HG3 GLU 27 29.554 22.241 26.509
194 H CYS 28 H CYS 28 29.423 21.360 24.156
195 HA CYS 28 HA CYS 28 27.883 23.469 22.765
196 HB2 CYS 28 HB2 CYS 28 28.278 21.162 21.765
197 HB3 CYS 28 HB3 CYS 28 27.111 20.575 22.961
198 H LYS 29 H LYS 29 25.925 24.165 23.290
199 HA LYS 29 HA LYS 29 24.431 23.229 25.709
200 HB2 LYS 29 HB2 LYS 29 25.294 26.019 24.962
201 HB3 LYS 29 HB3 LYS 29 23.619 25.840 25.426
202 HG2 LYS 29 HG2 LYS 29 24.799 26.459 27.379
203 HG3 LYS 29 HG3 LYS 29 24.248 24.803 27.558
204 HD2 LYS 29 HD2 LYS 29 26.443 24.929 28.477
205 HD3 LYS 29 HD3 LYS 29 26.538 23.996 27.013
206 HE2 LYS 29 HE2 LYS 29 28.442 25.404 26.994
207 HE3 LYS 29 HE3 LYS 29 27.339 26.130 25.816
208 HZ1 LYS 29 HZ1 LYS 29 27.571 26.977 28.658
209 HZ2 LYS 29 HZ2 LYS 29 28.336 27.763 27.449
210 HZ3 LYS 29 HZ3 LYS 29 26.700 27.756 27.539
211 H CYS 30 H CYS 30 22.003 23.661 25.501
212 HA CYS 30 HA CYS 30 21.009 23.447 22.723
213 HB2 CYS 30 HB2 CYS 30 19.865 22.689 25.394
214 HB3 CYS 30 HB3 CYS 30 19.247 22.346 23.796
215 H VAL 31 H VAL 31 19.986 25.184 21.931
216 HA VAL 31 HA VAL 31 18.850 27.173 23.850
217 HB VAL 31 HB VAL 31 19.156 28.930 22.287
218 HG11 VAL 31 HG11 VAL 31 21.797 27.505 22.861
219 HG12 VAL 31 HG12 VAL 31 21.575 29.238 22.547
220 HG13 VAL 31 HG13 VAL 31 20.887 28.516 24.009
221 HG21 VAL 31 HG21 VAL 31 20.712 28.658 20.334
222 HG22 VAL 31 HG22 VAL 31 20.715 26.898 20.622
223 HG23 VAL 31 HG23 VAL 31 19.222 27.730 20.136
224 HA PRO 32 HA PRO 32 15.244 25.810 22.462
225 HB2 PRO 32 HB2 PRO 32 13.380 27.867 22.846
226 HB3 PRO 32 HB3 PRO 32 14.057 26.776 24.089
227 HG2 PRO 32 HG2 PRO 32 14.964 29.554 23.341
228 HG3 PRO 32 HG3 PRO 32 14.841 28.814 24.971
229 HD2 PRO 32 HD2 PRO 32 17.230 29.030 23.702
230 HD3 PRO 32 HD3 PRO 32 16.842 27.540 24.628
231 H TYR 33 H TYR 33 14.633 25.092 20.723
232 HA TYR 33 HA TYR 33 13.754 26.903 18.484
233 HB2 TYR 33 HB2 TYR 33 15.886 24.872 18.405
234 HB3 TYR 33 HB3 TYR 33 14.774 24.831 17.062
235 HD1 TYR 33 HD2 TYR 33 16.901 27.278 18.940
236 HD2 TYR 33 HD1 TYR 33 14.960 26.240 15.239
237 HE1 TYR 33 HE2 TYR 33 18.064 29.186 17.784
238 HE2 TYR 33 HE1 TYR 33 16.138 28.094 14.085
239 HH TYR 33 HH TYR 33 17.729 29.674 14.243
Start of MODEL 18
1 H1 GLY 1 H1 GLY 1 33.004 18.078 21.674
2 H2 GLY 1 H2 GLY 1 32.617 18.411 23.247
3 H3 GLY 1 H3 GLY 1 32.533 16.868 22.673
4 HA2 GLY 1 HA2 GLY 1 34.477 17.003 23.984
5 HA3 GLY 1 HA3 GLY 1 34.944 16.893 22.271
6 H SER 2 H SER 2 36.087 18.255 24.862
7 HA SER 2 HA SER 2 35.753 21.051 24.664
8 HB2 SER 2 HB2 SER 2 38.030 19.436 25.867
9 HB3 SER 2 HB3 SER 2 37.843 21.186 26.042
10 HG SER 2 HG SER 2 36.941 20.210 27.776
11 H ALA 3 H ALA 3 36.500 22.529 23.352
12 HA ALA 3 HA ALA 3 37.467 23.548 21.634
13 HB1 ALA 3 HB1 ALA 3 39.344 23.677 23.225
14 HB2 ALA 3 HB2 ALA 3 40.046 22.206 22.513
15 HB3 ALA 3 HB3 ALA 3 39.891 23.680 21.538
16 H PHE 4 H PHE 4 36.470 20.699 21.166
17 HA PHE 4 HA PHE 4 36.939 21.035 18.296
18 HB2 PHE 4 HB2 PHE 4 37.233 18.765 17.760
19 HB3 PHE 4 HB3 PHE 4 38.516 19.371 18.796
20 HD1 PHE 4 HD2 PHE 4 38.696 18.587 21.185
21 HD2 PHE 4 HD1 PHE 4 35.909 16.836 18.406
22 HE1 PHE 4 HE2 PHE 4 38.402 16.646 22.703
23 HE2 PHE 4 HE1 PHE 4 35.619 14.897 19.919
24 HZ PHE 4 HZ PHE 4 36.858 14.799 22.079
25 H CYS 5 H CYS 5 35.035 22.014 19.642
26 HA CYS 5 HA CYS 5 32.761 20.458 20.271
27 HB2 CYS 5 HB2 CYS 5 31.513 22.485 20.360
28 HB3 CYS 5 HB3 CYS 5 33.127 22.770 21.012
29 H ASN 6 H ASN 6 31.040 19.685 19.201
30 HA ASN 6 HA ASN 6 30.786 20.269 16.257
31 HB2 ASN 6 HB2 ASN 6 31.140 17.753 17.276
32 HB3 ASN 6 HB3 ASN 6 29.462 17.964 17.629
33 HD21 ASN 6 HD22 ASN 6 31.897 17.845 15.046
34 HD22 ASN 6 HD21 ASN 6 30.716 17.455 13.781
35 H LEU 7 H LEU 7 28.715 20.327 15.424
36 HA LEU 7 HA LEU 7 26.653 21.451 17.231
37 HB2 LEU 7 HB2 LEU 7 28.171 23.075 15.980
38 HB3 LEU 7 HB3 LEU 7 27.420 22.470 14.488
39 HG LEU 7 HG LEU 7 25.604 23.241 16.691
40 HD11 LEU 7 HD11 LEU 7 25.684 25.596 15.993
41 HD12 LEU 7 HD12 LEU 7 27.278 25.074 16.578
42 HD13 LEU 7 HD13 LEU 7 26.993 25.216 14.843
43 HD21 LEU 7 HD21 LEU 7 25.521 23.748 13.677
44 HD22 LEU 7 HD22 LEU 7 24.659 22.432 14.483
45 HD23 LEU 7 HD23 LEU 7 24.223 24.094 14.834
46 H ARG 8 H ARG 8 27.383 19.703 14.199
47 HA ARG 8 HA ARG 8 24.628 18.980 13.686
48 HB2 ARG 8 HB2 ARG 8 27.323 18.051 12.828
49 HB3 ARG 8 HB3 ARG 8 26.119 16.773 12.861
50 HG2 ARG 8 HG2 ARG 8 25.458 19.438 11.583
51 HG3 ARG 8 HG3 ARG 8 26.428 18.249 10.721
52 HD2 ARG 8 HD2 ARG 8 24.256 17.786 9.972
53 HD3 ARG 8 HD3 ARG 8 24.608 16.532 11.158
54 HE ARG 8 HE ARG 8 22.790 17.200 12.353
55 HH11 ARG 8 HH11 ARG 8 23.575 19.971 10.326
56 HH12 ARG 8 HH12 ARG 8 22.037 20.723 10.667
57 HH21 ARG 8 HH21 ARG 8 20.926 18.119 12.638
58 HH22 ARG 8 HH22 ARG 8 20.618 19.770 12.104
59 H ALA 9 H ALA 9 27.119 17.217 15.563
60 HA ALA 9 HA ALA 9 25.434 15.315 16.781
61 HB1 ALA 9 HB1 ALA 9 27.285 15.048 18.326
62 HB2 ALA 9 HB2 ALA 9 27.935 15.271 16.689
63 HB3 ALA 9 HB3 ALA 9 27.957 16.600 17.848
64 H CYS 10 H CYS 10 25.928 18.732 17.465
65 HA CYS 10 HA CYS 10 24.837 18.613 20.185
66 HB2 CYS 10 HB2 CYS 10 26.497 20.332 19.157
67 HB3 CYS 10 HB3 CYS 10 25.058 21.089 18.472
68 H GLU 11 H GLU 11 23.688 19.834 16.990
69 HA GLU 11 HA GLU 11 21.087 20.480 17.599
70 HB2 GLU 11 HB2 GLU 11 22.422 19.386 15.125
71 HB3 GLU 11 HB3 GLU 11 20.689 19.657 15.122
72 HG2 GLU 11 HG2 GLU 11 22.504 21.891 16.068
73 HG3 GLU 11 HG3 GLU 11 22.357 21.548 14.347
74 H LEU 12 H LEU 12 22.256 17.229 16.586
75 HA LEU 12 HA LEU 12 19.674 16.001 16.968
76 HB2 LEU 12 HB2 LEU 12 20.797 13.937 16.285
77 HB3 LEU 12 HB3 LEU 12 21.149 15.288 15.229
78 HG LEU 12 HG LEU 12 23.346 15.514 16.658
79 HD11 LEU 12 HD11 LEU 12 22.918 13.902 18.392
80 HD12 LEU 12 HD12 LEU 12 22.625 12.624 17.182
81 HD13 LEU 12 HD13 LEU 12 24.241 13.325 17.393
82 HD21 LEU 12 HD21 LEU 12 22.904 13.211 14.702
83 HD22 LEU 12 HD22 LEU 12 23.279 14.896 14.268
84 HD23 LEU 12 HD23 LEU 12 24.481 13.920 15.118
85 H SER 13 H SER 13 21.894 16.942 19.238
86 HA SER 13 HA SER 13 20.928 14.973 21.252
87 HB2 SER 13 HB2 SER 13 23.215 16.981 21.366
88 HB3 SER 13 HB3 SER 13 22.709 15.928 22.694
89 HG SER 13 HG SER 13 24.043 15.351 20.338
90 H CYS 14 H CYS 14 20.774 18.356 20.349
91 HA CYS 14 HA CYS 14 19.386 19.161 22.800
92 HB2 CYS 14 HB2 CYS 14 20.225 20.613 20.274
93 HB3 CYS 14 HB3 CYS 14 19.440 21.387 21.651
94 H ARG 15 H ARG 15 18.467 18.283 19.489
95 HA ARG 15 HA ARG 15 15.804 19.178 19.361
96 HB2 ARG 15 HB2 ARG 15 17.345 17.667 17.750
97 HB3 ARG 15 HB3 ARG 15 16.621 16.334 18.610
98 HG2 ARG 15 HG2 ARG 15 15.040 16.463 16.987
99 HG3 ARG 15 HG3 ARG 15 14.366 17.787 17.941
100 HD2 ARG 15 HD2 ARG 15 16.284 17.978 15.575
101 HD3 ARG 15 HD3 ARG 15 14.583 18.445 15.587
102 HE ARG 15 HE ARG 15 15.185 20.215 17.266
103 HH11 ARG 15 HH21 ARG 15 17.847 19.207 15.061
104 HH12 ARG 15 HH22 ARG 15 18.710 20.666 15.547
105 HH21 ARG 15 HH11 ARG 15 16.622 21.841 17.790
106 HH22 ARG 15 HH12 ARG 15 18.080 22.004 16.805
107 H SER 16 H SER 16 17.224 16.619 21.241
108 HA SER 16 HA SER 16 14.974 15.245 22.168
109 HB2 SER 16 HB2 SER 16 17.656 15.675 23.522
110 HB3 SER 16 HB3 SER 16 16.492 14.404 23.921
111 HG SER 16 HG SER 16 18.241 13.794 22.474
112 H LEU 17 H LEU 17 16.268 18.400 23.375
113 HA LEU 17 HA LEU 17 14.419 18.221 25.615
114 HB2 LEU 17 HB2 LEU 17 15.524 20.495 26.146
115 HB3 LEU 17 HB3 LEU 17 15.847 18.931 26.869
116 HG LEU 17 HG LEU 17 17.357 20.095 24.604
117 HD11 LEU 17 HD11 LEU 17 19.099 20.673 26.349
118 HD12 LEU 17 HD12 LEU 17 17.556 21.341 26.909
119 HD13 LEU 17 HD13 LEU 17 18.148 19.818 27.572
120 HD21 LEU 17 HD21 LEU 17 17.998 18.045 24.345
121 HD22 LEU 17 HD22 LEU 17 19.182 18.538 25.531
122 HD23 LEU 17 HD23 LEU 17 17.731 17.594 26.058
123 H GLY 18 H GLY 18 14.172 19.019 22.474
124 HA2 GLY 18 HA2 GLY 18 12.748 20.379 21.264
125 HA3 GLY 18 HA3 GLY 18 12.148 21.133 22.746
126 H LEU 19 H LEU 19 15.648 20.977 22.204
127 HA LEU 19 HA LEU 19 15.708 23.962 22.031
128 HB2 LEU 19 HB2 LEU 19 17.788 21.958 22.823
129 HB3 LEU 19 HB3 LEU 19 18.055 23.686 22.800
130 HG LEU 19 HG LEU 19 17.112 22.036 24.854
131 HD11 LEU 19 HD11 LEU 19 18.628 23.860 25.402
132 HD12 LEU 19 HD12 LEU 19 17.372 25.034 24.972
133 HD13 LEU 19 HD13 LEU 19 17.206 23.966 26.362
134 HD21 LEU 19 HD21 LEU 19 14.965 23.989 24.198
135 HD22 LEU 19 HD22 LEU 19 14.880 22.266 24.493
136 HD23 LEU 19 HD23 LEU 19 15.225 23.319 25.814
137 H LEU 20 H LEU 20 17.877 24.628 21.113
138 HA LEU 20 HA LEU 20 18.355 23.583 18.336
139 HB2 LEU 20 HB2 LEU 20 17.578 25.957 18.514
140 HB3 LEU 20 HB3 LEU 20 18.936 26.296 19.572
141 HG LEU 20 HG LEU 20 20.462 25.622 17.608
142 HD11 LEU 20 HD11 LEU 20 18.708 24.471 16.241
143 HD12 LEU 20 HD12 LEU 20 17.863 26.013 16.049
144 HD13 LEU 20 HD13 LEU 20 19.484 25.788 15.363
145 HD21 LEU 20 HD21 LEU 20 20.127 27.953 18.281
146 HD22 LEU 20 HD22 LEU 20 20.216 27.813 16.514
147 HD23 LEU 20 HD23 LEU 20 18.645 28.043 17.307
148 H GLY 21 H GLY 21 20.436 22.849 17.902
149 HA2 GLY 21 HA2 GLY 21 22.375 22.671 20.130
150 HA3 GLY 21 HA3 GLY 21 22.543 21.983 18.520
151 H LYS 22 H LYS 22 23.817 24.182 20.521
152 HA LYS 22 HA LYS 22 25.230 25.540 18.274
153 HB2 LYS 22 HB2 LYS 22 24.387 26.727 20.972
154 HB3 LYS 22 HB3 LYS 22 25.612 27.442 19.931
155 HG2 LYS 22 HG2 LYS 22 22.671 27.159 19.281
156 HG3 LYS 22 HG3 LYS 22 23.590 28.643 19.636
157 HD2 LYS 22 HD2 LYS 22 25.052 27.966 17.611
158 HD3 LYS 22 HD3 LYS 22 23.773 26.825 17.229
159 HE2 LYS 22 HE2 LYS 22 22.171 28.813 17.219
160 HE3 LYS 22 HE3 LYS 22 23.589 29.865 17.377
161 HZ1 LYS 22 HZ1 LYS 22 24.450 28.801 15.305
162 HZ2 LYS 22 HZ2 LYS 22 23.060 27.944 15.184
163 HZ3 LYS 22 HZ3 LYS 22 23.020 29.582 15.034
164 H CYS 23 H CYS 23 27.340 25.666 18.401
165 HA CYS 23 HA CYS 23 28.769 24.634 20.821
166 HB2 CYS 23 HB2 CYS 23 29.829 23.971 18.799
167 HB3 CYS 23 HB3 CYS 23 29.793 25.617 18.145
168 H ILE 24 H ILE 24 29.085 25.965 22.465
169 HA ILE 24 HA ILE 24 29.382 28.914 22.074
170 HB ILE 24 HB ILE 24 27.814 27.565 24.290
171 HG12 ILE 24 HG12 ILE 24 26.485 27.564 22.225
172 HG13 ILE 24 HG13 ILE 24 25.815 28.603 23.460
173 HG21 ILE 24 HG21 ILE 24 28.927 29.524 25.152
174 HG22 ILE 24 HG22 ILE 24 28.427 30.506 23.764
175 HG23 ILE 24 HG23 ILE 24 27.225 29.922 24.936
176 HD11 ILE 24 HD11 ILE 24 26.594 30.616 22.292
177 HD12 ILE 24 HD12 ILE 24 27.398 29.622 21.060
178 HD13 ILE 24 HD13 ILE 24 25.635 29.603 21.212
179 H GLY 25 H GLY 25 31.203 29.703 23.100
180 HA2 GLY 25 HA2 GLY 25 33.198 29.652 24.213
181 HA3 GLY 25 HA3 GLY 25 32.391 28.701 25.469
182 H GLU 26 H GLU 26 32.903 27.699 22.119
183 HA GLU 26 HA GLU 26 33.730 25.780 21.192
184 HB2 GLU 26 HB2 GLU 26 36.070 26.357 22.938
185 HB3 GLU 26 HB3 GLU 26 36.022 25.292 21.527
186 HG2 GLU 26 HG2 GLU 26 35.474 28.296 21.519
187 HG3 GLU 26 HG3 GLU 26 36.882 27.454 20.917
188 H GLU 27 H GLU 27 31.854 25.281 23.385
189 HA GLU 27 HA GLU 27 32.130 22.412 22.867
190 HB2 GLU 27 HB2 GLU 27 33.115 22.633 25.080
191 HB3 GLU 27 HB3 GLU 27 31.678 23.454 25.673
192 HG2 GLU 27 HG2 GLU 27 31.788 21.194 26.427
193 HG3 GLU 27 HG3 GLU 27 30.363 21.404 25.432
194 H CYS 28 H CYS 28 30.021 21.260 23.067
195 HA CYS 28 HA CYS 28 27.846 22.708 21.913
196 HB2 CYS 28 HB2 CYS 28 28.171 20.421 21.381
197 HB3 CYS 28 HB3 CYS 28 28.174 19.947 23.077
198 H LYS 29 H LYS 29 26.049 23.576 22.687
199 HA LYS 29 HA LYS 29 24.899 23.024 25.355
200 HB2 LYS 29 HB2 LYS 29 25.404 25.791 24.132
201 HB3 LYS 29 HB3 LYS 29 24.453 25.483 25.571
202 HG2 LYS 29 HG2 LYS 29 27.446 25.004 25.279
203 HG3 LYS 29 HG3 LYS 29 26.698 26.364 26.100
204 HD2 LYS 29 HD2 LYS 29 25.785 24.991 27.838
205 HD3 LYS 29 HD3 LYS 29 26.190 23.499 26.996
206 HE2 LYS 29 HE2 LYS 29 28.238 25.471 28.053
207 HE3 LYS 29 HE3 LYS 29 27.695 23.991 28.875
208 HZ1 LYS 29 HZ1 LYS 29 29.554 24.255 26.715
209 HZ2 LYS 29 HZ2 LYS 29 29.350 23.010 27.770
210 HZ3 LYS 29 HZ3 LYS 29 28.398 23.081 26.447
211 H CYS 30 H CYS 30 22.513 23.311 25.412
212 HA CYS 30 HA CYS 30 21.168 23.508 22.806
213 HB2 CYS 30 HB2 CYS 30 20.317 22.491 25.499
214 HB3 CYS 30 HB3 CYS 30 19.506 22.324 23.962
215 H VAL 31 H VAL 31 20.037 25.326 22.378
216 HA VAL 31 HA VAL 31 19.218 27.039 24.690
217 HB VAL 31 HB VAL 31 19.293 29.008 23.326
218 HG11 VAL 31 HG11 VAL 31 21.205 28.429 24.784
219 HG12 VAL 31 HG12 VAL 31 21.992 27.591 23.426
220 HG13 VAL 31 HG13 VAL 31 21.717 29.344 23.357
221 HG21 VAL 31 HG21 VAL 31 19.101 28.051 21.070
222 HG22 VAL 31 HG22 VAL 31 20.579 29.021 21.184
223 HG23 VAL 31 HG23 VAL 31 20.681 27.245 21.251
224 HA PRO 32 HA PRO 32 15.428 25.874 23.758
225 HB2 PRO 32 HB2 PRO 32 13.693 27.880 24.651
226 HB3 PRO 32 HB3 PRO 32 14.556 26.665 25.641
227 HG2 PRO 32 HG2 PRO 32 15.383 29.505 25.006
228 HG3 PRO 32 HG3 PRO 32 15.491 28.634 26.571
229 HD2 PRO 32 HD2 PRO 32 17.671 28.906 25.015
230 HD3 PRO 32 HD3 PRO 32 17.350 27.312 25.788
231 H TYR 33 H TYR 33 14.477 25.353 22.050
232 HA TYR 33 HA TYR 33 13.652 27.340 20.035
233 HB2 TYR 33 HB2 TYR 33 14.874 24.834 19.836
234 HB3 TYR 33 HB3 TYR 33 13.232 24.512 19.313
235 HD1 TYR 33 HD2 TYR 33 15.744 27.216 19.047
236 HD2 TYR 33 HD1 TYR 33 12.940 24.740 16.939
237 HE1 TYR 33 HE2 TYR 33 16.304 28.418 16.881
238 HE2 TYR 33 HE1 TYR 33 13.494 25.899 14.802
239 HH TYR 33 HH TYR 33 14.560 27.698 13.857
Start of MODEL 19
1 H1 GLY 1 H1 GLY 1 42.086 27.286 20.762
2 H2 GLY 1 H2 GLY 1 41.865 25.711 20.285
3 H3 GLY 1 H3 GLY 1 43.175 26.128 21.177
4 HA2 GLY 1 HA2 GLY 1 41.738 26.786 23.012
5 HA3 GLY 1 HA3 GLY 1 40.376 26.173 22.064
6 H SER 2 H SER 2 39.749 24.424 23.057
7 HA SER 2 HA SER 2 41.691 22.501 24.290
8 HB2 SER 2 HB2 SER 2 40.201 22.537 26.260
9 HB3 SER 2 HB3 SER 2 40.866 24.131 25.902
10 HG SER 2 HG SER 2 38.858 24.628 24.821
11 H ALA 3 H ALA 3 38.818 22.660 22.311
12 HA ALA 3 HA ALA 3 38.829 19.773 22.166
13 HB1 ALA 3 HB1 ALA 3 37.372 20.067 24.172
14 HB2 ALA 3 HB2 ALA 3 36.291 21.097 23.207
15 HB3 ALA 3 HB3 ALA 3 36.489 19.382 22.798
16 H PHE 4 H PHE 4 38.122 19.023 20.250
17 HA PHE 4 HA PHE 4 37.294 20.966 18.209
18 HB2 PHE 4 HB2 PHE 4 37.911 18.042 18.048
19 HB3 PHE 4 HB3 PHE 4 37.643 19.103 16.671
20 HD1 PHE 4 HD2 PHE 4 39.206 21.244 16.516
21 HD2 PHE 4 HD1 PHE 4 40.172 17.688 18.755
22 HE1 PHE 4 HE2 PHE 4 41.610 21.856 16.446
23 HE2 PHE 4 HE1 PHE 4 42.575 18.313 18.703
24 HZ PHE 4 HZ PHE 4 43.300 20.395 17.557
25 H CYS 5 H CYS 5 35.253 21.304 19.410
26 HA CYS 5 HA CYS 5 33.188 19.387 19.612
27 HB2 CYS 5 HB2 CYS 5 31.687 21.219 20.011
28 HB3 CYS 5 HB3 CYS 5 33.208 21.528 20.823
29 H ASN 6 H ASN 6 31.206 19.130 18.557
30 HA ASN 6 HA ASN 6 30.917 20.060 15.718
31 HB2 ASN 6 HB2 ASN 6 31.352 17.422 16.150
32 HB3 ASN 6 HB3 ASN 6 29.775 17.467 16.822
33 HD21 ASN 6 HD22 ASN 6 31.597 18.287 13.836
34 HD22 ASN 6 HD21 ASN 6 30.243 17.911 12.762
35 H LEU 7 H LEU 7 28.855 20.423 14.997
36 HA LEU 7 HA LEU 7 26.944 21.287 17.124
37 HB2 LEU 7 HB2 LEU 7 28.357 22.970 15.846
38 HB3 LEU 7 HB3 LEU 7 27.475 22.460 14.388
39 HG LEU 7 HG LEU 7 25.856 23.190 16.744
40 HD11 LEU 7 HD11 LEU 7 27.172 25.172 14.845
41 HD12 LEU 7 HD12 LEU 7 25.970 25.579 16.082
42 HD13 LEU 7 HD13 LEU 7 27.570 24.988 16.563
43 HD21 LEU 7 HD21 LEU 7 25.583 23.793 13.747
44 HD22 LEU 7 HD22 LEU 7 24.747 22.479 14.566
45 HD23 LEU 7 HD23 LEU 7 24.373 24.135 14.999
46 H ARG 8 H ARG 8 27.225 19.723 13.910
47 HA ARG 8 HA ARG 8 24.411 19.128 13.757
48 HB2 ARG 8 HB2 ARG 8 26.922 17.978 12.608
49 HB3 ARG 8 HB3 ARG 8 25.563 16.862 12.711
50 HG2 ARG 8 HG2 ARG 8 25.094 19.629 11.613
51 HG3 ARG 8 HG3 ARG 8 25.917 18.433 10.617
52 HD2 ARG 8 HD2 ARG 8 23.680 18.163 9.988
53 HD3 ARG 8 HD3 ARG 8 23.977 16.822 11.091
54 HE ARG 8 HE ARG 8 22.253 17.578 12.359
55 HH11 ARG 8 HH11 ARG 8 23.255 20.293 10.381
56 HH12 ARG 8 HH12 ARG 8 22.021 21.341 11.016
57 HH21 ARG 8 HH21 ARG 8 20.601 18.912 13.037
58 HH22 ARG 8 HH22 ARG 8 20.495 20.542 12.430
59 H ALA 9 H ALA 9 27.026 17.388 15.418
60 HA ALA 9 HA ALA 9 25.533 15.373 16.716
61 HB1 ALA 9 HB1 ALA 9 28.006 16.843 17.717
62 HB2 ALA 9 HB2 ALA 9 27.522 15.179 18.085
63 HB3 ALA 9 HB3 ALA 9 28.086 15.605 16.453
64 H CYS 10 H CYS 10 26.067 18.784 17.447
65 HA CYS 10 HA CYS 10 24.993 18.612 20.161
66 HB2 CYS 10 HB2 CYS 10 26.646 20.361 19.250
67 HB3 CYS 10 HB3 CYS 10 25.261 21.098 18.447
68 H GLU 11 H GLU 11 23.810 19.905 17.034
69 HA GLU 11 HA GLU 11 21.275 20.652 17.766
70 HB2 GLU 11 HB2 GLU 11 22.433 19.602 15.183
71 HB3 GLU 11 HB3 GLU 11 20.716 20.018 15.287
72 HG2 GLU 11 HG2 GLU 11 22.818 22.005 16.178
73 HG3 GLU 11 HG3 GLU 11 22.411 21.808 14.491
74 H LEU 12 H LEU 12 22.320 17.414 16.624
75 HA LEU 12 HA LEU 12 19.699 16.233 16.916
76 HB2 LEU 12 HB2 LEU 12 20.730 14.197 16.171
77 HB3 LEU 12 HB3 LEU 12 21.222 15.560 15.196
78 HG LEU 12 HG LEU 12 23.383 15.547 16.726
79 HD11 LEU 12 HD11 LEU 12 22.402 12.700 17.058
80 HD12 LEU 12 HD12 LEU 12 24.056 13.255 17.377
81 HD13 LEU 12 HD13 LEU 12 22.735 13.878 18.350
82 HD21 LEU 12 HD21 LEU 12 24.440 13.934 15.130
83 HD22 LEU 12 HD22 LEU 12 22.816 13.393 14.644
84 HD23 LEU 12 HD23 LEU 12 23.347 15.044 14.285
85 H SER 13 H SER 13 22.095 16.951 19.220
86 HA SER 13 HA SER 13 21.047 15.013 21.199
87 HB2 SER 13 HB2 SER 13 23.136 17.190 21.553
88 HB3 SER 13 HB3 SER 13 22.662 15.967 22.743
89 HG SER 13 HG SER 13 24.020 15.636 20.278
90 H CYS 14 H CYS 14 21.014 18.525 20.524
91 HA CYS 14 HA CYS 14 19.352 19.195 22.788
92 HB2 CYS 14 HB2 CYS 14 20.140 20.687 20.258
93 HB3 CYS 14 HB3 CYS 14 19.220 21.407 21.589
94 H ARG 15 H ARG 15 18.594 18.058 19.583
95 HA ARG 15 HA ARG 15 15.839 18.725 19.327
96 HB2 ARG 15 HB2 ARG 15 17.431 17.674 17.659
97 HB3 ARG 15 HB3 ARG 15 17.286 16.153 18.547
98 HG2 ARG 15 HG2 ARG 15 14.858 16.101 18.000
99 HG3 ARG 15 HG3 ARG 15 15.017 17.663 17.163
100 HD2 ARG 15 HD2 ARG 15 16.678 16.657 15.609
101 HD3 ARG 15 HD3 ARG 15 16.553 15.120 16.460
102 HE ARG 15 HE ARG 15 14.305 14.830 15.670
103 HH11 ARG 15 HH21 ARG 15 15.833 17.600 14.016
104 HH12 ARG 15 HH22 ARG 15 14.808 17.287 12.612
105 HH21 ARG 15 HH11 ARG 15 13.099 14.692 13.892
106 HH22 ARG 15 HH12 ARG 15 13.371 15.831 12.549
107 H SER 16 H SER 16 17.402 16.553 21.544
108 HA SER 16 HA SER 16 15.123 15.049 22.336
109 HB2 SER 16 HB2 SER 16 17.645 15.744 23.845
110 HB3 SER 16 HB3 SER 16 16.545 14.396 24.231
111 HG SER 16 HG SER 16 18.465 13.878 22.805
112 H LEU 17 H LEU 17 16.132 18.371 23.230
113 HA LEU 17 HA LEU 17 13.983 18.599 25.274
114 HB2 LEU 17 HB2 LEU 17 16.126 20.356 24.115
115 HB3 LEU 17 HB3 LEU 17 14.958 20.904 25.349
116 HG LEU 17 HG LEU 17 16.918 18.721 25.801
117 HD11 LEU 17 HD11 LEU 17 18.364 20.109 27.063
118 HD12 LEU 17 HD12 LEU 17 18.274 20.662 25.394
119 HD13 LEU 17 HD13 LEU 17 17.402 21.545 26.688
120 HD21 LEU 17 HD21 LEU 17 15.371 20.617 27.624
121 HD22 LEU 17 HD22 LEU 17 14.920 18.914 27.347
122 HD23 LEU 17 HD23 LEU 17 16.418 19.300 28.216
123 H GLY 18 H GLY 18 14.399 18.778 21.904
124 HA2 GLY 18 HA2 GLY 18 13.329 19.838 20.149
125 HA3 GLY 18 HA3 GLY 18 12.227 20.634 21.275
126 H LEU 19 H LEU 19 15.691 20.947 21.897
127 HA LEU 19 HA LEU 19 15.384 23.886 21.716
128 HB2 LEU 19 HB2 LEU 19 17.589 22.107 22.691
129 HB3 LEU 19 HB3 LEU 19 17.752 23.853 22.670
130 HG LEU 19 HG LEU 19 16.765 22.188 24.652
131 HD11 LEU 19 HD11 LEU 19 16.769 25.154 24.856
132 HD12 LEU 19 HD12 LEU 19 16.663 24.000 26.170
133 HD13 LEU 19 HD13 LEU 19 18.132 24.094 25.249
134 HD21 LEU 19 HD21 LEU 19 14.658 23.341 25.349
135 HD22 LEU 19 HD22 LEU 19 14.650 24.183 23.795
136 HD23 LEU 19 HD23 LEU 19 14.465 22.453 23.854
137 H LEU 20 H LEU 20 17.536 24.987 21.061
138 HA LEU 20 HA LEU 20 18.356 24.118 18.301
139 HB2 LEU 20 HB2 LEU 20 17.367 26.362 18.489
140 HB3 LEU 20 HB3 LEU 20 18.546 26.795 19.718
141 HG LEU 20 HG LEU 20 20.353 26.484 17.957
142 HD11 LEU 20 HD11 LEU 20 19.115 25.016 16.420
143 HD12 LEU 20 HD12 LEU 20 17.898 26.280 16.157
144 HD13 LEU 20 HD13 LEU 20 19.572 26.504 15.587
145 HD21 LEU 20 HD21 LEU 20 18.126 28.493 17.403
146 HD22 LEU 20 HD22 LEU 20 19.501 28.721 18.502
147 HD23 LEU 20 HD23 LEU 20 19.767 28.596 16.750
148 H GLY 21 H GLY 21 20.323 23.194 18.104
149 HA2 GLY 21 HA2 GLY 21 22.152 23.149 20.424
150 HA3 GLY 21 HA3 GLY 21 22.267 22.161 18.980
151 H LYS 22 H LYS 22 23.880 24.343 20.607
152 HA LYS 22 HA LYS 22 25.411 25.347 18.256
153 HB2 LYS 22 HB2 LYS 22 24.831 26.875 20.833
154 HB3 LYS 22 HB3 LYS 22 25.907 27.420 19.550
155 HG2 LYS 22 HG2 LYS 22 22.903 27.046 19.321
156 HG3 LYS 22 HG3 LYS 22 23.780 28.575 19.497
157 HD2 LYS 22 HD2 LYS 22 24.873 28.232 17.309
158 HD3 LYS 22 HD3 LYS 22 24.074 26.668 17.164
159 HE2 LYS 22 HE2 LYS 22 22.842 28.215 15.809
160 HE3 LYS 22 HE3 LYS 22 21.852 27.779 17.199
161 HZ1 LYS 22 HZ1 LYS 22 23.440 30.282 16.957
162 HZ2 LYS 22 HZ2 LYS 22 21.819 30.189 16.762
163 HZ3 LYS 22 HZ3 LYS 22 22.487 29.913 18.223
164 H CYS 23 H CYS 23 27.571 25.479 18.504
165 HA CYS 23 HA CYS 23 28.772 24.284 20.988
166 HB2 CYS 23 HB2 CYS 23 29.716 23.331 18.986
167 HB3 CYS 23 HB3 CYS 23 30.143 24.940 18.375
168 H ILE 24 H ILE 24 29.253 25.600 22.556
169 HA ILE 24 HA ILE 24 30.034 28.451 22.098
170 HB ILE 24 HB ILE 24 27.990 27.403 24.101
171 HG12 ILE 24 HG12 ILE 24 26.986 27.682 21.886
172 HG13 ILE 24 HG13 ILE 24 26.344 28.805 23.062
173 HG21 ILE 24 HG21 ILE 24 29.287 29.093 25.226
174 HG22 ILE 24 HG22 ILE 24 29.194 30.185 23.827
175 HG23 ILE 24 HG23 ILE 24 27.740 29.811 24.775
176 HD11 ILE 24 HD11 ILE 24 27.632 30.659 22.091
177 HD12 ILE 24 HD12 ILE 24 28.395 29.548 20.932
178 HD13 ILE 24 HD13 ILE 24 26.653 29.855 20.857
179 H GLY 25 H GLY 25 31.852 28.972 23.298
180 HA2 GLY 25 HA2 GLY 25 33.770 28.522 24.504
181 HA3 GLY 25 HA3 GLY 25 32.676 27.907 25.748
182 H GLU 26 H GLU 26 33.338 26.549 22.497
183 HA GLU 26 HA GLU 26 33.880 24.465 21.788
184 HB2 GLU 26 HB2 GLU 26 35.829 24.559 24.096
185 HB3 GLU 26 HB3 GLU 26 35.892 23.445 22.726
186 HG2 GLU 26 HG2 GLU 26 36.129 25.293 21.146
187 HG3 GLU 26 HG3 GLU 26 36.037 26.476 22.462
188 H GLU 27 H GLU 27 31.668 24.555 23.929
189 HA GLU 27 HA GLU 27 31.436 21.594 24.107
190 HB2 GLU 27 HB2 GLU 27 30.870 23.658 26.260
191 HB3 GLU 27 HB3 GLU 27 30.135 22.068 26.269
192 HG2 GLU 27 HG2 GLU 27 33.135 22.579 26.324
193 HG3 GLU 27 HG3 GLU 27 32.142 22.315 27.743
194 H CYS 28 H CYS 28 29.257 20.817 24.023
195 HA CYS 28 HA CYS 28 27.542 22.350 22.260
196 HB2 CYS 28 HB2 CYS 28 27.745 19.975 21.965
197 HB3 CYS 28 HB3 CYS 28 27.312 19.667 23.646
198 H LYS 29 H LYS 29 25.755 23.481 22.712
199 HA LYS 29 HA LYS 29 24.420 23.339 25.378
200 HB2 LYS 29 HB2 LYS 29 25.962 25.199 25.445
201 HB3 LYS 29 HB3 LYS 29 25.413 25.792 23.872
202 HG2 LYS 29 HG2 LYS 29 23.282 26.455 24.725
203 HG3 LYS 29 HG3 LYS 29 23.546 25.621 26.264
204 HD2 LYS 29 HD2 LYS 29 25.362 27.834 25.269
205 HD3 LYS 29 HD3 LYS 29 23.892 28.195 26.177
206 HE2 LYS 29 HE2 LYS 29 26.014 26.274 27.240
207 HE3 LYS 29 HE3 LYS 29 26.131 28.013 27.486
208 HZ1 LYS 29 HZ1 LYS 29 25.017 26.821 29.331
209 HZ2 LYS 29 HZ2 LYS 29 24.073 28.001 28.682
210 HZ3 LYS 29 HZ3 LYS 29 23.776 26.418 28.363
211 H CYS 30 H CYS 30 22.174 23.666 25.355
212 HA CYS 30 HA CYS 30 20.773 23.803 22.764
213 HB2 CYS 30 HB2 CYS 30 19.921 22.781 25.458
214 HB3 CYS 30 HB3 CYS 30 19.173 22.564 23.902
215 H VAL 31 H VAL 31 19.648 25.670 22.397
216 HA VAL 31 HA VAL 31 18.813 27.250 24.788
217 HB VAL 31 HB VAL 31 18.806 29.268 23.514
218 HG11 VAL 31 HG11 VAL 31 20.748 28.654 24.929
219 HG12 VAL 31 HG12 VAL 31 21.539 27.912 23.517
220 HG13 VAL 31 HG13 VAL 31 21.220 29.656 23.550
221 HG21 VAL 31 HG21 VAL 31 18.626 28.471 21.208
222 HG22 VAL 31 HG22 VAL 31 20.140 29.374 21.374
223 HG23 VAL 31 HG23 VAL 31 20.179 27.606 21.342
224 HA PRO 32 HA PRO 32 14.919 26.152 23.874
225 HB2 PRO 32 HB2 PRO 32 13.307 27.999 25.089
226 HB3 PRO 32 HB3 PRO 32 14.278 26.752 25.922
227 HG2 PRO 32 HG2 PRO 32 15.038 29.645 25.414
228 HG3 PRO 32 HG3 PRO 32 15.218 28.703 26.932
229 HD2 PRO 32 HD2 PRO 32 17.331 29.008 25.311
230 HD3 PRO 32 HD3 PRO 32 16.995 27.358 25.958
231 H TYR 33 H TYR 33 14.175 25.924 22.035
232 HA TYR 33 HA TYR 33 13.924 28.230 20.191
233 HB2 TYR 33 HB2 TYR 33 15.668 26.794 19.754
234 HB3 TYR 33 HB3 TYR 33 14.721 25.346 20.049
235 HD1 TYR 33 HD2 TYR 33 13.070 24.565 18.559
236 HD2 TYR 33 HD1 TYR 33 15.695 27.773 17.497
237 HE1 TYR 33 HE2 TYR 33 12.570 24.140 16.110
238 HE2 TYR 33 HE1 TYR 33 15.248 27.350 15.058
239 HH TYR 33 HH TYR 33 12.922 24.853 13.975
Start of MODEL 20
1 H1 GLY 1 H1 GLY 1 40.848 24.704 22.347
2 H2 GLY 1 H2 GLY 1 42.415 25.113 22.664
3 H3 GLY 1 H3 GLY 1 41.212 26.133 23.092
4 HA2 GLY 1 HA2 GLY 1 41.973 25.065 25.035
5 HA3 GLY 1 HA3 GLY 1 40.332 24.484 24.641
6 H SER 2 H SER 2 40.186 22.347 24.996
7 HA SER 2 HA SER 2 42.347 20.531 24.087
8 HB2 SER 2 HB2 SER 2 42.149 19.344 26.362
9 HB3 SER 2 HB3 SER 2 43.086 20.820 26.236
10 HG SER 2 HG SER 2 41.887 21.046 28.015
11 H ALA 3 H ALA 3 39.465 21.147 23.276
12 HA ALA 3 HA ALA 3 38.835 18.319 22.707
13 HB1 ALA 3 HB1 ALA 3 36.487 18.586 23.336
14 HB2 ALA 3 HB2 ALA 3 37.492 18.984 24.742
15 HB3 ALA 3 HB3 ALA 3 36.770 20.283 23.760
16 H PHE 4 H PHE 4 36.980 18.270 21.009
17 HA PHE 4 HA PHE 4 36.984 20.679 19.233
18 HB2 PHE 4 HB2 PHE 4 37.400 17.852 18.221
19 HB3 PHE 4 HB3 PHE 4 37.363 19.329 17.265
20 HD1 PHE 4 HD2 PHE 4 39.201 21.090 17.649
21 HD2 PHE 4 HD1 PHE 4 39.428 17.084 19.227
22 HE1 PHE 4 HE2 PHE 4 41.635 21.393 18.084
23 HE2 PHE 4 HE1 PHE 4 41.856 17.388 19.650
24 HZ PHE 4 HZ PHE 4 42.947 19.546 19.110
25 H CYS 5 H CYS 5 34.937 21.274 18.728
26 HA CYS 5 HA CYS 5 32.782 19.357 19.413
27 HB2 CYS 5 HB2 CYS 5 31.388 21.232 19.731
28 HB3 CYS 5 HB3 CYS 5 32.880 21.468 20.626
29 H ASN 6 H ASN 6 31.025 18.933 18.202
30 HA ASN 6 HA ASN 6 30.757 20.121 15.462
31 HB2 ASN 6 HB2 ASN 6 31.344 17.510 15.689
32 HB3 ASN 6 HB3 ASN 6 29.749 17.385 16.297
33 HD21 ASN 6 HD22 ASN 6 31.679 18.261 13.492
34 HD22 ASN 6 HD21 ASN 6 30.364 18.162 12.323
35 H LEU 7 H LEU 7 28.816 20.634 14.795
36 HA LEU 7 HA LEU 7 26.877 21.321 16.941
37 HB2 LEU 7 HB2 LEU 7 28.249 23.029 15.620
38 HB3 LEU 7 HB3 LEU 7 27.273 22.563 14.213
39 HG LEU 7 HG LEU 7 25.797 23.227 16.686
40 HD11 LEU 7 HD11 LEU 7 25.892 25.654 16.100
41 HD12 LEU 7 HD12 LEU 7 27.495 25.021 16.546
42 HD13 LEU 7 HD13 LEU 7 27.083 25.284 14.846
43 HD21 LEU 7 HD21 LEU 7 24.242 24.277 15.074
44 HD22 LEU 7 HD22 LEU 7 25.365 23.949 13.743
45 HD23 LEU 7 HD23 LEU 7 24.545 22.623 14.578
46 H ARG 8 H ARG 8 26.996 19.866 13.642
47 HA ARG 8 HA ARG 8 24.218 19.204 13.674
48 HB2 ARG 8 HB2 ARG 8 25.500 18.827 11.678
49 HB3 ARG 8 HB3 ARG 8 26.615 17.742 12.501
50 HG2 ARG 8 HG2 ARG 8 25.050 16.526 11.065
51 HG3 ARG 8 HG3 ARG 8 24.902 16.048 12.757
52 HD2 ARG 8 HD2 ARG 8 22.929 17.718 12.875
53 HD3 ARG 8 HD3 ARG 8 23.005 17.767 11.111
54 HE ARG 8 HE ARG 8 22.880 15.097 11.551
55 HH11 ARG 8 HH11 ARG 8 20.843 17.721 12.725
56 HH12 ARG 8 HH12 ARG 8 19.632 16.602 13.345
57 HH21 ARG 8 HH22 ARG 8 21.235 13.767 12.359
58 HH22 ARG 8 HH21 ARG 8 19.705 14.508 12.819
59 H ALA 9 H ALA 9 26.972 17.571 15.259
60 HA ALA 9 HA ALA 9 25.597 15.493 16.582
61 HB1 ALA 9 HB1 ALA 9 27.639 15.305 17.844
62 HB2 ALA 9 HB2 ALA 9 28.107 15.775 16.194
63 HB3 ALA 9 HB3 ALA 9 28.080 16.985 17.494
64 H CYS 10 H CYS 10 26.314 18.872 17.557
65 HA CYS 10 HA CYS 10 25.150 18.703 20.160
66 HB2 CYS 10 HB2 CYS 10 26.694 20.489 19.192
67 HB3 CYS 10 HB3 CYS 10 25.287 21.130 18.351
68 H GLU 11 H GLU 11 23.824 19.949 17.054
69 HA GLU 11 HA GLU 11 21.277 20.597 17.852
70 HB2 GLU 11 HB2 GLU 11 22.490 19.694 15.260
71 HB3 GLU 11 HB3 GLU 11 20.742 19.764 15.349
72 HG2 GLU 11 HG2 GLU 11 22.300 22.153 16.338
73 HG3 GLU 11 HG3 GLU 11 22.160 21.888 14.606
74 H LEU 12 H LEU 12 22.318 17.369 16.614
75 HA LEU 12 HA LEU 12 19.742 16.192 16.992
76 HB2 LEU 12 HB2 LEU 12 20.819 14.097 16.403
77 HB3 LEU 12 HB3 LEU 12 21.277 15.412 15.347
78 HG LEU 12 HG LEU 12 23.444 15.555 16.821
79 HD11 LEU 12 HD11 LEU 12 22.575 12.693 17.372
80 HD12 LEU 12 HD12 LEU 12 24.186 13.368 17.694
81 HD13 LEU 12 HD13 LEU 12 22.793 13.961 18.591
82 HD21 LEU 12 HD21 LEU 12 22.899 13.214 14.940
83 HD22 LEU 12 HD22 LEU 12 23.404 14.847 14.455
84 HD23 LEU 12 HD23 LEU 12 24.510 13.819 15.372
85 H SER 13 H SER 13 22.279 16.819 19.237
86 HA SER 13 HA SER 13 21.282 14.954 21.276
87 HB2 SER 13 HB2 SER 13 23.358 17.165 21.544
88 HB3 SER 13 HB3 SER 13 23.004 15.894 22.720
89 HG SER 13 HG SER 13 24.180 15.675 20.144
90 H CYS 14 H CYS 14 21.060 18.414 20.519
91 HA CYS 14 HA CYS 14 19.536 19.123 22.902
92 HB2 CYS 14 HB2 CYS 14 20.231 20.570 20.316
93 HB3 CYS 14 HB3 CYS 14 19.316 21.301 21.648
94 H ARG 15 H ARG 15 18.721 18.010 19.685
95 HA ARG 15 HA ARG 15 16.048 18.754 19.368
96 HB2 ARG 15 HB2 ARG 15 17.622 17.439 17.823
97 HB3 ARG 15 HB3 ARG 15 17.307 16.028 18.815
98 HG2 ARG 15 HG2 ARG 15 15.962 15.899 16.868
99 HG3 ARG 15 HG3 ARG 15 14.856 16.222 18.204
100 HD2 ARG 15 HD2 ARG 15 15.976 18.585 16.706
101 HD3 ARG 15 HD3 ARG 15 14.839 17.559 15.835
102 HE ARG 15 HE ARG 15 13.272 17.911 17.837
103 HH11 ARG 15 HH21 ARG 15 15.463 20.547 16.867
104 HH12 ARG 15 HH22 ARG 15 14.186 21.705 17.208
105 HH21 ARG 15 HH11 ARG 15 11.854 19.468 18.196
106 HH22 ARG 15 HH12 ARG 15 12.291 21.149 17.874
107 H SER 16 H SER 16 17.445 16.406 21.575
108 HA SER 16 HA SER 16 15.119 15.012 22.348
109 HB2 SER 16 HB2 SER 16 17.622 15.692 23.936
110 HB3 SER 16 HB3 SER 16 16.370 14.561 24.490
111 HG SER 16 HG SER 16 18.158 13.580 23.430
112 H LEU 17 H LEU 17 16.176 18.300 23.325
113 HA LEU 17 HA LEU 17 14.205 18.457 25.523
114 HB2 LEU 17 HB2 LEU 17 16.121 20.312 24.151
115 HB3 LEU 17 HB3 LEU 17 15.143 20.778 25.569
116 HG LEU 17 HG LEU 17 17.221 18.644 25.588
117 HD11 LEU 17 HD11 LEU 17 18.760 20.018 26.777
118 HD12 LEU 17 HD12 LEU 17 18.436 20.640 25.166
119 HD13 LEU 17 HD13 LEU 17 17.702 21.423 26.603
120 HD21 LEU 17 HD21 LEU 17 17.030 19.005 28.079
121 HD22 LEU 17 HD22 LEU 17 15.886 20.335 27.740
122 HD23 LEU 17 HD23 LEU 17 15.433 18.641 27.403
123 H GLY 18 H GLY 18 14.151 18.753 22.099
124 HA2 GLY 18 HA2 GLY 18 12.929 20.004 20.600
125 HA3 GLY 18 HA3 GLY 18 12.009 20.746 21.913
126 H LEU 19 H LEU 19 15.614 20.795 21.932
127 HA LEU 19 HA LEU 19 15.477 23.766 21.703
128 HB2 LEU 19 HB2 LEU 19 17.608 21.950 22.738
129 HB3 LEU 19 HB3 LEU 19 17.771 23.695 22.648
130 HG LEU 19 HG LEU 19 16.835 22.108 24.698
131 HD11 LEU 19 HD11 LEU 19 16.707 24.036 26.134
132 HD12 LEU 19 HD12 LEU 19 18.178 24.024 25.226
133 HD13 LEU 19 HD13 LEU 19 16.846 25.088 24.735
134 HD21 LEU 19 HD21 LEU 19 14.658 23.990 23.830
135 HD22 LEU 19 HD22 LEU 19 14.512 22.268 24.058
136 HD23 LEU 19 HD23 LEU 19 14.754 23.291 25.448
137 H LEU 20 H LEU 20 17.441 24.720 20.920
138 HA LEU 20 HA LEU 20 18.301 23.688 18.243
139 HB2 LEU 20 HB2 LEU 20 17.161 25.946 18.410
140 HB3 LEU 20 HB3 LEU 20 18.502 26.486 19.415
141 HG LEU 20 HG LEU 20 20.015 25.804 17.384
142 HD11 LEU 20 HD11 LEU 20 18.255 24.545 16.163
143 HD12 LEU 20 HD12 LEU 20 17.266 26.017 16.060
144 HD13 LEU 20 HD13 LEU 20 18.829 25.921 15.206
145 HD21 LEU 20 HD21 LEU 20 19.523 28.156 18.060
146 HD22 LEU 20 HD22 LEU 20 19.663 27.953 16.297
147 HD23 LEU 20 HD23 LEU 20 18.063 28.105 17.046
148 H GLY 21 H GLY 21 20.352 22.967 18.079
149 HA2 GLY 21 HA2 GLY 21 22.201 23.143 20.360
150 HA3 GLY 21 HA3 GLY 21 22.418 22.195 18.899
151 H LYS 22 H LYS 22 23.816 24.430 20.543
152 HA LYS 22 HA LYS 22 25.299 25.571 18.222
153 HB2 LYS 22 HB2 LYS 22 24.729 26.970 20.878
154 HB3 LYS 22 HB3 LYS 22 25.788 27.585 19.611
155 HG2 LYS 22 HG2 LYS 22 22.788 27.188 19.394
156 HG3 LYS 22 HG3 LYS 22 23.655 28.720 19.620
157 HD2 LYS 22 HD2 LYS 22 24.787 28.362 17.435
158 HD3 LYS 22 HD3 LYS 22 23.807 26.906 17.197
159 HE2 LYS 22 HE2 LYS 22 21.739 28.350 17.431
160 HE3 LYS 22 HE3 LYS 22 22.794 29.775 17.458
161 HZ1 LYS 22 HZ1 LYS 22 23.604 29.079 15.242
162 HZ2 LYS 22 HZ2 LYS 22 22.565 27.803 15.259
163 HZ3 LYS 22 HZ3 LYS 22 21.964 29.330 15.206
164 H CYS 23 H CYS 23 27.473 25.604 18.430
165 HA CYS 23 HA CYS 23 28.657 24.278 20.851
166 HB2 CYS 23 HB2 CYS 23 29.555 23.350 18.856
167 HB3 CYS 23 HB3 CYS 23 29.988 24.950 18.228
168 H ILE 24 H ILE 24 29.455 25.412 22.466
169 HA ILE 24 HA ILE 24 30.485 28.169 22.068
170 HB ILE 24 HB ILE 24 28.686 27.291 24.353
171 HG12 ILE 24 HG12 ILE 24 28.196 29.197 22.013
172 HG13 ILE 24 HG13 ILE 24 27.389 27.654 22.308
173 HG21 ILE 24 HG21 ILE 24 30.481 28.886 25.051
174 HG22 ILE 24 HG22 ILE 24 29.949 30.014 23.780
175 HG23 ILE 24 HG23 ILE 24 28.893 29.608 25.151
176 HD11 ILE 24 HD11 ILE 24 25.870 29.360 22.943
177 HD12 ILE 24 HD12 ILE 24 26.459 28.602 24.440
178 HD13 ILE 24 HD13 ILE 24 27.085 30.191 23.927
179 H GLY 25 H GLY 25 32.472 28.374 22.756
180 HA2 GLY 25 HA2 GLY 25 34.523 27.924 23.726
181 HA3 GLY 25 HA3 GLY 25 33.572 27.599 25.177
182 H GLU 26 H GLU 26 33.860 25.737 22.129
183 HA GLU 26 HA GLU 26 34.271 23.625 21.627
184 HB2 GLU 26 HB2 GLU 26 36.094 23.504 24.028
185 HB3 GLU 26 HB3 GLU 26 36.067 22.381 22.665
186 HG2 GLU 26 HG2 GLU 26 36.646 24.237 21.131
187 HG3 GLU 26 HG3 GLU 26 36.778 25.330 22.517
188 H GLU 27 H GLU 27 31.983 24.150 23.658
189 HA GLU 27 HA GLU 27 31.323 21.281 23.674
190 HB2 GLU 27 HB2 GLU 27 31.610 22.938 26.135
191 HB3 GLU 27 HB3 GLU 27 30.075 22.093 26.023
192 HG2 GLU 27 HG2 GLU 27 32.831 20.851 25.952
193 HG3 GLU 27 HG3 GLU 27 31.629 20.710 27.231
194 H CYS 28 H CYS 28 28.996 20.884 24.235
195 HA CYS 28 HA CYS 28 27.450 22.463 22.300
196 HB2 CYS 28 HB2 CYS 28 27.533 20.066 22.087
197 HB3 CYS 28 HB3 CYS 28 26.985 19.841 23.745
198 H LYS 29 H LYS 29 25.733 23.690 22.693
199 HA LYS 29 HA LYS 29 24.394 23.734 25.361
200 HB2 LYS 29 HB2 LYS 29 25.886 25.692 25.176
201 HB3 LYS 29 HB3 LYS 29 25.196 26.087 23.603
202 HG2 LYS 29 HG2 LYS 29 24.329 27.603 25.277
203 HG3 LYS 29 HG3 LYS 29 23.032 26.622 24.622
204 HD2 LYS 29 HD2 LYS 29 22.757 26.887 27.020
205 HD3 LYS 29 HD3 LYS 29 23.086 25.190 26.653
206 HE2 LYS 29 HE2 LYS 29 25.484 25.533 27.244
207 HE3 LYS 29 HE3 LYS 29 25.141 27.228 27.618
208 HZ1 LYS 29 HZ1 LYS 29 23.980 24.883 29.028
209 HZ2 LYS 29 HZ2 LYS 29 25.189 25.838 29.572
210 HZ3 LYS 29 HZ3 LYS 29 23.661 26.463 29.387
211 H CYS 30 H CYS 30 22.181 23.708 25.271
212 HA CYS 30 HA CYS 30 20.775 23.786 22.690
213 HB2 CYS 30 HB2 CYS 30 19.969 22.794 25.399
214 HB3 CYS 30 HB3 CYS 30 19.249 22.495 23.837
215 H VAL 31 H VAL 31 19.581 25.572 22.266
216 HA VAL 31 HA VAL 31 18.608 27.190 24.577
217 HB VAL 31 HB VAL 31 18.624 29.183 23.267
218 HG11 VAL 31 HG11 VAL 31 21.014 29.645 23.390
219 HG12 VAL 31 HG12 VAL 31 20.529 28.631 24.758
220 HG13 VAL 31 HG13 VAL 31 21.390 27.913 23.378
221 HG21 VAL 31 HG21 VAL 31 18.555 28.288 20.970
222 HG22 VAL 31 HG22 VAL 31 19.977 29.322 21.166
223 HG23 VAL 31 HG23 VAL 31 20.159 27.550 21.183
224 HA PRO 32 HA PRO 32 14.837 25.924 23.517
225 HB2 PRO 32 HB2 PRO 32 13.066 27.940 24.293
226 HB3 PRO 32 HB3 PRO 32 13.851 26.700 25.315
227 HG2 PRO 32 HG2 PRO 32 14.734 29.546 24.820
228 HG3 PRO 32 HG3 PRO 32 14.756 28.619 26.356
229 HD2 PRO 32 HD2 PRO 32 17.011 28.937 24.899
230 HD3 PRO 32 HD3 PRO 32 16.669 27.335 25.635
231 H TYR 33 H TYR 33 14.105 25.399 21.762
232 HA TYR 33 HA TYR 33 12.848 27.393 19.891
233 HB2 TYR 33 HB2 TYR 33 15.029 25.484 19.248
234 HB3 TYR 33 HB3 TYR 33 13.763 25.677 18.059
235 HD1 TYR 33 HD2 TYR 33 16.116 27.761 20.125
236 HD2 TYR 33 HD1 TYR 33 13.740 27.452 16.548
237 HE1 TYR 33 HE2 TYR 33 17.051 29.921 19.329
238 HE2 TYR 33 HE1 TYR 33 14.719 29.582 15.720
239 HH TYR 33 HH TYR 33 17.046 31.494 17.635