Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
576833 | 2me7 RC | 19519 | 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 27.366 11.763 31.877
2 H2 GLY 1 H2 GLY 1 26.356 11.130 32.980
3 H3 GLY 1 H3 GLY 1 26.971 10.170 31.781
4 HA2 GLY 1 HA2 GLY 1 28.088 9.728 33.874
5 HA3 GLY 1 HA3 GLY 1 29.193 10.423 32.669
6 H SER 2 H SER 2 30.493 11.989 33.514
7 HA SER 2 HA SER 2 29.752 13.523 35.893
8 HB2 SER 2 HB2 SER 2 31.766 14.847 35.399
9 HB3 SER 2 HB3 SER 2 32.100 13.111 35.437
10 HG SER 2 HG SER 2 32.658 13.169 33.436
11 H ALA 3 H ALA 3 29.160 13.845 32.460
12 HA ALA 3 HA ALA 3 27.618 16.323 32.948
13 HB1 ALA 3 HB1 ALA 3 28.276 17.072 30.720
14 HB2 ALA 3 HB2 ALA 3 29.727 16.803 31.689
15 HB3 ALA 3 HB3 ALA 3 29.244 15.607 30.469
16 H PHE 4 H PHE 4 25.796 16.469 31.544
17 HA PHE 4 HA PHE 4 24.864 14.052 30.103
18 HB2 PHE 4 HB2 PHE 4 23.342 15.253 32.440
19 HB3 PHE 4 HB3 PHE 4 22.631 14.208 31.242
20 HD1 PHE 4 HD2 PHE 4 23.542 11.835 30.937
21 HD2 PHE 4 HD1 PHE 4 24.431 14.308 34.354
22 HE1 PHE 4 HE2 PHE 4 24.008 9.797 32.286
23 HE2 PHE 4 HE1 PHE 4 24.930 12.275 35.705
24 HZ PHE 4 HZ PHE 4 24.679 10.021 34.676
25 H CYS 5 H CYS 5 24.791 15.086 28.173
26 HA CYS 5 HA CYS 5 23.590 17.619 27.648
27 HB2 CYS 5 HB2 CYS 5 25.085 16.527 26.122
28 HB3 CYS 5 HB3 CYS 5 24.000 15.162 25.908
29 H ASN 6 H ASN 6 21.564 18.236 27.093
30 HA ASN 6 HA ASN 6 19.306 16.264 27.117
31 HB2 ASN 6 HB2 ASN 6 19.223 17.626 29.113
32 HB3 ASN 6 HB3 ASN 6 19.540 19.091 28.215
33 HD21 ASN 6 HD22 ASN 6 17.328 18.525 30.085
34 HD22 ASN 6 HD21 ASN 6 15.951 19.005 29.093
35 H LEU 7 H LEU 7 18.662 15.974 25.067
36 HA LEU 7 HA LEU 7 19.372 17.579 22.851
37 HB2 LEU 7 HB2 LEU 7 18.624 15.182 22.810
38 HB3 LEU 7 HB3 LEU 7 16.984 15.719 23.208
39 HG LEU 7 HG LEU 7 16.864 16.955 21.052
40 HD11 LEU 7 HD11 LEU 7 18.570 16.483 19.304
41 HD12 LEU 7 HD12 LEU 7 19.235 17.435 20.630
42 HD13 LEU 7 HD13 LEU 7 19.588 15.689 20.530
43 HD21 LEU 7 HD21 LEU 7 17.679 14.037 20.761
44 HD22 LEU 7 HD22 LEU 7 16.066 14.626 21.227
45 HD23 LEU 7 HD23 LEU 7 16.703 14.982 19.610
46 H ALA 8 H ALA 8 16.250 17.717 24.689
47 HA ALA 8 HA ALA 8 15.058 19.726 23.070
48 HB1 ALA 8 HB1 ALA 8 14.781 19.258 26.071
49 HB2 ALA 8 HB2 ALA 8 13.641 20.132 25.046
50 HB3 ALA 8 HB3 ALA 8 13.883 18.392 24.799
51 H ARG 9 H ARG 9 17.332 20.110 25.880
52 HA ARG 9 HA ARG 9 17.204 22.974 25.894
53 HB2 ARG 9 HB2 ARG 9 17.654 21.153 27.690
54 HB3 ARG 9 HB3 ARG 9 19.302 21.084 27.062
55 HG2 ARG 9 HG2 ARG 9 19.553 23.423 27.514
56 HG3 ARG 9 HG3 ARG 9 17.863 23.605 28.035
57 HD2 ARG 9 HD2 ARG 9 19.330 23.478 30.018
58 HD3 ARG 9 HD3 ARG 9 18.204 22.111 29.883
59 HE ARG 9 HE ARG 9 20.891 21.607 28.808
60 HH11 ARG 9 HH11 ARG 9 18.953 21.408 31.736
61 HH12 ARG 9 HH12 ARG 9 19.808 19.996 32.323
62 HH21 ARG 9 HH21 ARG 9 21.911 19.819 29.581
63 HH22 ARG 9 HH22 ARG 9 21.527 19.198 31.178
64 H CYS 10 H CYS 10 19.318 20.618 24.438
65 HA CYS 10 HA CYS 10 21.375 22.408 23.445
66 HB2 CYS 10 HB2 CYS 10 21.593 19.910 23.820
67 HB3 CYS 10 HB3 CYS 10 20.517 19.680 22.436
68 H GLU 11 H GLU 11 18.374 20.936 22.084
69 HA GLU 11 HA GLU 11 18.492 22.091 19.539
70 HB2 GLU 11 HB2 GLU 11 16.223 21.150 21.292
71 HB3 GLU 11 HB3 GLU 11 15.888 21.890 19.730
72 HG2 GLU 11 HG2 GLU 11 17.945 19.667 19.877
73 HG3 GLU 11 HG3 GLU 11 16.228 19.298 19.920
74 H LEU 12 H LEU 12 16.958 23.358 22.527
75 HA LEU 12 HA LEU 12 16.155 25.913 21.491
76 HB2 LEU 12 HB2 LEU 12 16.658 24.741 24.245
77 HB3 LEU 12 HB3 LEU 12 16.304 26.445 24.072
78 HG LEU 12 HG LEU 12 14.459 24.287 22.985
79 HD11 LEU 12 HD11 LEU 12 14.303 25.805 25.625
80 HD12 LEU 12 HD12 LEU 12 13.075 24.693 24.985
81 HD13 LEU 12 HD13 LEU 12 14.669 24.074 25.441
82 HD21 LEU 12 HD21 LEU 12 12.784 26.144 23.085
83 HD22 LEU 12 HD22 LEU 12 14.075 27.265 23.548
84 HD23 LEU 12 HD23 LEU 12 14.090 26.480 21.950
85 H SER 13 H SER 13 19.227 24.811 22.803
86 HA SER 13 HA SER 13 20.440 27.461 22.947
87 HB2 SER 13 HB2 SER 13 21.737 24.704 22.919
88 HB3 SER 13 HB3 SER 13 22.549 26.237 23.272
89 HG SER 13 HG SER 13 20.432 25.012 24.730
90 H CYS 14 H CYS 14 20.762 24.717 20.621
91 HA CYS 14 HA CYS 14 22.465 26.204 18.827
92 HB2 CYS 14 HB2 CYS 14 20.717 23.774 18.314
93 HB3 CYS 14 HB3 CYS 14 22.025 24.356 17.252
94 H ARG 15 H ARG 15 18.916 25.926 19.004
95 HA ARG 15 HA ARG 15 18.113 27.465 16.770
96 HB2 ARG 15 HB2 ARG 15 16.571 26.290 18.204
97 HB3 ARG 15 HB3 ARG 15 17.055 27.231 19.612
98 HG2 ARG 15 HG2 ARG 15 16.085 29.242 18.634
99 HG3 ARG 15 HG3 ARG 15 15.560 28.341 17.201
100 HD2 ARG 15 HD2 ARG 15 14.721 27.663 20.056
101 HD3 ARG 15 HD3 ARG 15 13.852 28.838 19.087
102 HE ARG 15 HE ARG 15 13.893 25.894 18.688
103 HH11 ARG 15 HH11 ARG 15 12.832 28.950 17.237
104 HH12 ARG 15 HH12 ARG 15 11.502 28.130 16.426
105 HH21 ARG 15 HH21 ARG 15 12.320 25.026 17.609
106 HH22 ARG 15 HH22 ARG 15 11.358 25.930 16.462
107 H SER 16 H SER 16 19.582 28.644 19.819
108 HA SER 16 HA SER 16 19.107 31.440 19.269
109 HB2 SER 16 HB2 SER 16 21.269 30.274 21.052
110 HB3 SER 16 HB3 SER 16 20.569 31.899 21.104
111 HG SER 16 HG SER 16 18.489 30.723 21.414
112 H LEU 17 H LEU 17 21.473 29.262 17.929
113 HA LEU 17 HA LEU 17 23.025 31.587 16.865
114 HB2 LEU 17 HB2 LEU 17 23.939 28.774 16.561
115 HB3 LEU 17 HB3 LEU 17 24.880 30.241 16.620
116 HG LEU 17 HG LEU 17 23.551 28.794 18.939
117 HD11 LEU 17 HD11 LEU 17 25.861 28.254 19.621
118 HD12 LEU 17 HD12 LEU 17 25.467 27.588 18.031
119 HD13 LEU 17 HD13 LEU 17 26.476 29.041 18.146
120 HD21 LEU 17 HD21 LEU 17 23.741 31.260 19.406
121 HD22 LEU 17 HD22 LEU 17 24.859 30.332 20.408
122 HD23 LEU 17 HD23 LEU 17 25.456 31.200 18.973
123 H GLY 18 H GLY 18 20.645 29.327 15.988
124 HA2 GLY 18 HA2 GLY 18 19.365 29.584 14.023
125 HA3 GLY 18 HA3 GLY 18 20.757 30.220 13.157
126 H LEU 19 H LEU 19 20.892 27.154 15.022
127 HA LEU 19 HA LEU 19 20.566 25.534 12.603
128 HB2 LEU 19 HB2 LEU 19 22.676 24.506 12.639
129 HB3 LEU 19 HB3 LEU 19 22.909 26.230 12.465
130 HG LEU 19 HG LEU 19 23.214 24.781 15.110
131 HD11 LEU 19 HD11 LEU 19 24.808 23.839 13.468
132 HD12 LEU 19 HD12 LEU 19 25.309 25.475 12.995
133 HD13 LEU 19 HD13 LEU 19 25.688 24.862 14.611
134 HD21 LEU 19 HD21 LEU 19 24.183 27.495 14.180
135 HD22 LEU 19 HD22 LEU 19 23.014 27.125 15.477
136 HD23 LEU 19 HD23 LEU 19 24.703 26.692 15.681
137 H LEU 20 H LEU 20 21.311 23.066 13.380
138 HA LEU 20 HA LEU 20 19.086 22.506 15.240
139 HB2 LEU 20 HB2 LEU 20 19.383 21.503 12.897
140 HB3 LEU 20 HB3 LEU 20 20.750 20.622 13.534
141 HG LEU 20 HG LEU 20 19.142 19.570 15.230
142 HD11 LEU 20 HD11 LEU 20 16.771 19.584 14.675
143 HD12 LEU 20 HD12 LEU 20 17.282 21.243 14.962
144 HD13 LEU 20 HD13 LEU 20 17.045 20.677 13.299
145 HD21 LEU 20 HD21 LEU 20 18.287 17.942 13.624
146 HD22 LEU 20 HD22 LEU 20 18.589 19.059 12.279
147 HD23 LEU 20 HD23 LEU 20 19.949 18.394 13.206
148 H GLY 21 H GLY 21 19.268 21.129 17.093
149 HA2 GLY 21 HA2 GLY 21 22.026 20.843 18.228
150 HA3 GLY 21 HA3 GLY 21 20.523 20.818 19.137
151 H LYS 22 H LYS 22 22.913 18.924 18.751
152 HA LYS 22 HA LYS 22 21.303 16.485 19.071
153 HB2 LYS 22 HB2 LYS 22 22.901 16.950 16.745
154 HB3 LYS 22 HB3 LYS 22 23.908 15.962 17.783
155 HG2 LYS 22 HG2 LYS 22 22.671 14.473 16.384
156 HG3 LYS 22 HG3 LYS 22 22.011 14.335 18.008
157 HD2 LYS 22 HD2 LYS 22 20.146 14.352 16.500
158 HD3 LYS 22 HD3 LYS 22 20.157 15.888 17.351
159 HE2 LYS 22 HE2 LYS 22 19.606 16.357 15.093
160 HE3 LYS 22 HE3 LYS 22 21.238 16.963 15.357
161 HZ1 LYS 22 HZ1 LYS 22 20.574 14.370 14.047
162 HZ2 LYS 22 HZ2 LYS 22 21.069 15.736 13.254
163 HZ3 LYS 22 HZ3 LYS 22 22.084 14.938 14.251
164 H CYS 23 H CYS 23 22.406 14.837 20.465
165 HA CYS 23 HA CYS 23 24.510 16.029 22.170
166 HB2 CYS 23 HB2 CYS 23 22.571 13.729 22.507
167 HB3 CYS 23 HB3 CYS 23 23.873 14.119 23.601
168 H ILE 24 H ILE 24 26.532 15.236 22.131
169 HA ILE 24 HA ILE 24 27.111 12.572 20.936
170 HB ILE 24 HB ILE 24 28.560 15.150 20.196
171 HG12 ILE 24 HG12 ILE 24 26.886 13.261 18.473
172 HG13 ILE 24 HG13 ILE 24 26.406 14.880 18.986
173 HG21 ILE 24 HG21 ILE 24 29.105 12.263 19.347
174 HG22 ILE 24 HG22 ILE 24 29.960 13.704 18.757
175 HG23 ILE 24 HG23 ILE 24 30.123 13.240 20.437
176 HD11 ILE 24 HD11 ILE 24 27.088 15.038 16.731
177 HD12 ILE 24 HD12 ILE 24 28.324 15.837 17.720
178 HD13 ILE 24 HD13 ILE 24 28.622 14.218 17.039
179 H GLY 25 H GLY 25 28.376 11.420 22.305
180 HA2 GLY 25 HA2 GLY 25 29.720 10.899 24.111
181 HA3 GLY 25 HA3 GLY 25 30.606 12.389 23.758
182 H GLU 26 H GLU 26 27.220 12.187 24.753
183 HA GLU 26 HA GLU 26 26.004 13.182 26.324
184 HB2 GLU 26 HB2 GLU 26 28.276 12.628 28.232
185 HB3 GLU 26 HB3 GLU 26 26.617 13.040 28.669
186 HG2 GLU 26 HG2 GLU 26 25.785 10.988 27.582
187 HG3 GLU 26 HG3 GLU 26 27.444 10.538 27.144
188 H GLU 27 H GLU 27 27.900 14.906 24.748
189 HA GLU 27 HA GLU 27 27.461 17.414 26.327
190 HB2 GLU 27 HB2 GLU 27 29.684 16.686 24.398
191 HB3 GLU 27 HB3 GLU 27 29.366 18.332 24.913
192 HG2 GLU 27 HG2 GLU 27 29.866 16.182 27.006
193 HG3 GLU 27 HG3 GLU 27 31.203 16.888 26.108
194 H CYS 28 H CYS 28 26.785 19.259 25.104
195 HA CYS 28 HA CYS 28 24.995 18.601 22.869
196 HB2 CYS 28 HB2 CYS 28 24.214 20.137 24.550
197 HB3 CYS 28 HB3 CYS 28 25.638 21.151 24.370
198 H LYS 29 H LYS 29 25.401 18.816 20.782
199 HA LYS 29 HA LYS 29 27.538 20.640 19.831
200 HB2 LYS 29 HB2 LYS 29 28.508 18.372 20.101
201 HB3 LYS 29 HB3 LYS 29 27.318 17.725 18.967
202 HG2 LYS 29 HG2 LYS 29 28.357 18.682 17.121
203 HG3 LYS 29 HG3 LYS 29 28.958 20.077 18.030
204 HD2 LYS 29 HD2 LYS 29 30.638 18.726 19.131
205 HD3 LYS 29 HD3 LYS 29 30.057 17.253 18.328
206 HE2 LYS 29 HE2 LYS 29 30.671 18.242 16.127
207 HE3 LYS 29 HE3 LYS 29 31.258 19.696 16.956
208 HZ1 LYS 29 HZ1 LYS 29 32.352 16.983 17.350
209 HZ2 LYS 29 HZ2 LYS 29 33.050 18.144 16.426
210 HZ3 LYS 29 HZ3 LYS 29 32.915 18.328 18.080
211 H CYS 30 H CYS 30 26.898 21.831 18.200
212 HA CYS 30 HA CYS 30 24.178 21.324 17.160
213 HB2 CYS 30 HB2 CYS 30 25.793 23.790 16.585
214 HB3 CYS 30 HB3 CYS 30 24.072 23.515 16.453
215 H VAL 31 H VAL 31 23.631 21.368 14.931
216 HA VAL 31 HA VAL 31 25.816 20.861 12.993
217 HB VAL 31 HB VAL 31 24.352 18.900 12.124
218 HG11 VAL 31 HG11 VAL 31 25.607 17.315 13.469
219 HG12 VAL 31 HG12 VAL 31 26.627 18.684 12.976
220 HG13 VAL 31 HG13 VAL 31 26.003 18.586 14.646
221 HG21 VAL 31 HG21 VAL 31 22.429 19.164 13.648
222 HG22 VAL 31 HG22 VAL 31 23.208 17.580 13.809
223 HG23 VAL 31 HG23 VAL 31 23.488 18.823 15.039
224 HA PRO 32 HA PRO 32 23.316 23.204 10.276
225 HB2 PRO 32 HB2 PRO 32 24.490 22.765 7.879
226 HB3 PRO 32 HB3 PRO 32 25.366 23.505 9.240
227 HG2 PRO 32 HG2 PRO 32 25.362 20.560 8.425
228 HG3 PRO 32 HG3 PRO 32 26.772 21.624 8.708
229 HD2 PRO 32 HD2 PRO 32 25.811 19.998 10.640
230 HD3 PRO 32 HD3 PRO 32 26.474 21.618 11.024
231 H TYR 33 H TYR 33 21.589 21.626 11.024
232 HA TYR 33 HA TYR 33 19.752 20.348 10.739
233 HB2 TYR 33 HB2 TYR 33 19.702 21.854 8.105
234 HB3 TYR 33 HB3 TYR 33 18.334 21.012 8.818
235 HD1 TYR 33 HD1 TYR 33 17.627 21.678 11.231
236 HD2 TYR 33 HD2 TYR 33 20.017 24.177 8.663
237 HE1 TYR 33 HE1 TYR 33 17.120 23.657 12.679
238 HE2 TYR 33 HE2 TYR 33 19.428 26.159 10.058
239 HH TYR 33 HH TYR 33 17.521 25.855 13.074
Start of MODEL 2
1 H1 GLY 1 H1 GLY 1 30.149 12.945 29.809
2 H2 GLY 1 H2 GLY 1 31.660 13.478 30.169
3 H3 GLY 1 H3 GLY 1 31.164 13.398 28.600
4 HA2 GLY 1 HA2 GLY 1 31.157 15.686 29.364
5 HA3 GLY 1 HA3 GLY 1 29.558 15.095 28.888
6 H SER 2 H SER 2 29.647 17.260 30.463
7 HA SER 2 HA SER 2 28.254 16.269 32.875
8 HB2 SER 2 HB2 SER 2 30.648 16.530 33.555
9 HB3 SER 2 HB3 SER 2 30.528 18.253 33.156
10 HG SER 2 HG SER 2 28.798 18.364 34.645
11 H ALA 3 H ALA 3 27.576 17.770 30.332
12 HA ALA 3 HA ALA 3 27.235 20.525 31.105
13 HB1 ALA 3 HB1 ALA 3 26.612 20.817 28.769
14 HB2 ALA 3 HB2 ALA 3 27.983 19.697 28.854
15 HB3 ALA 3 HB3 ALA 3 26.350 19.072 28.581
16 H PHE 4 H PHE 4 25.308 18.220 32.177
17 HA PHE 4 HA PHE 4 23.101 17.753 32.455
18 HB2 PHE 4 HB2 PHE 4 23.463 19.706 33.952
19 HB3 PHE 4 HB3 PHE 4 22.761 20.748 32.723
20 HD1 PHE 4 HD1 PHE 4 21.971 17.580 34.632
21 HD2 PHE 4 HD2 PHE 4 20.463 21.250 32.946
22 HE1 PHE 4 HE1 PHE 4 19.749 17.136 35.650
23 HE2 PHE 4 HE2 PHE 4 18.244 20.807 33.968
24 HZ PHE 4 HZ PHE 4 17.890 18.752 35.330
25 H CYS 5 H CYS 5 23.623 17.336 30.041
26 HA CYS 5 HA CYS 5 22.359 19.061 28.098
27 HB2 CYS 5 HB2 CYS 5 24.567 18.063 27.806
28 HB3 CYS 5 HB3 CYS 5 23.877 16.442 27.869
29 H ASN 6 H ASN 6 20.670 18.660 26.774
30 HA ASN 6 HA ASN 6 19.311 16.060 26.750
31 HB2 ASN 6 HB2 ASN 6 18.136 17.724 28.471
32 HB3 ASN 6 HB3 ASN 6 17.622 18.570 27.033
33 HD21 ASN 6 HD22 ASN 6 17.238 15.657 28.893
34 HD22 ASN 6 HD21 ASN 6 15.861 15.047 27.974
35 H LEU 7 H LEU 7 18.293 15.735 24.664
36 HA LEU 7 HA LEU 7 19.102 17.318 22.422
37 HB2 LEU 7 HB2 LEU 7 18.185 14.972 22.337
38 HB3 LEU 7 HB3 LEU 7 16.587 15.644 22.785
39 HG LEU 7 HG LEU 7 16.526 16.896 20.663
40 HD11 LEU 7 HD11 LEU 7 18.182 16.372 18.873
41 HD12 LEU 7 HD12 LEU 7 18.882 17.317 20.202
42 HD13 LEU 7 HD13 LEU 7 19.176 15.559 20.091
43 HD21 LEU 7 HD21 LEU 7 17.207 13.989 20.282
44 HD22 LEU 7 HD22 LEU 7 15.618 14.604 20.789
45 HD23 LEU 7 HD23 LEU 7 16.252 14.986 19.163
46 H ALA 8 H ALA 8 16.163 17.657 24.486
47 HA ALA 8 HA ALA 8 15.024 19.761 22.903
48 HB1 ALA 8 HB1 ALA 8 13.744 18.419 24.516
49 HB2 ALA 8 HB2 ALA 8 14.708 19.081 25.863
50 HB3 ALA 8 HB3 ALA 8 13.651 20.144 24.915
51 H ARG 9 H ARG 9 17.201 19.846 25.722
52 HA ARG 9 HA ARG 9 17.317 22.747 25.974
53 HB2 ARG 9 HB2 ARG 9 19.074 20.480 27.028
54 HB3 ARG 9 HB3 ARG 9 19.379 22.161 27.365
55 HG2 ARG 9 HG2 ARG 9 16.926 22.254 28.264
56 HG3 ARG 9 HG3 ARG 9 17.022 20.487 28.268
57 HD2 ARG 9 HD2 ARG 9 17.645 21.212 30.461
58 HD3 ARG 9 HD3 ARG 9 19.146 20.706 29.672
59 HE ARG 9 HE ARG 9 18.263 23.578 29.700
60 HH11 ARG 9 HH11 ARG 9 20.941 21.329 30.341
61 HH12 ARG 9 HH12 ARG 9 21.995 22.674 30.701
62 HH21 ARG 9 HH21 ARG 9 19.714 25.150 30.258
63 HH22 ARG 9 HH22 ARG 9 21.406 24.710 30.326
64 H CYS 10 H CYS 10 19.264 20.381 24.214
65 HA CYS 10 HA CYS 10 21.258 22.287 23.336
66 HB2 CYS 10 HB2 CYS 10 21.557 19.803 23.754
67 HB3 CYS 10 HB3 CYS 10 20.620 19.505 22.293
68 H GLU 11 H GLU 11 18.317 20.787 21.906
69 HA GLU 11 HA GLU 11 18.350 22.029 19.385
70 HB2 GLU 11 HB2 GLU 11 16.193 21.113 21.245
71 HB3 GLU 11 HB3 GLU 11 15.731 22.172 19.948
72 HG2 GLU 11 HG2 GLU 11 17.423 19.688 19.433
73 HG3 GLU 11 HG3 GLU 11 15.666 19.621 19.532
74 H LEU 12 H LEU 12 17.070 23.347 22.511
75 HA LEU 12 HA LEU 12 16.427 25.953 21.503
76 HB2 LEU 12 HB2 LEU 12 17.090 24.878 24.265
77 HB3 LEU 12 HB3 LEU 12 16.678 26.573 24.001
78 HG LEU 12 HG LEU 12 14.828 24.321 23.166
79 HD11 LEU 12 HD11 LEU 12 14.868 25.878 25.773
80 HD12 LEU 12 HD12 LEU 12 13.594 24.758 25.253
81 HD13 LEU 12 HD13 LEU 12 15.219 24.145 25.578
82 HD21 LEU 12 HD21 LEU 12 14.352 26.496 22.104
83 HD22 LEU 12 HD22 LEU 12 13.100 26.082 23.280
84 HD23 LEU 12 HD23 LEU 12 14.346 27.277 23.700
85 H SER 13 H SER 13 19.378 24.818 23.223
86 HA SER 13 HA SER 13 20.664 27.363 23.142
87 HB2 SER 13 HB2 SER 13 21.790 24.567 23.450
88 HB3 SER 13 HB3 SER 13 22.780 26.039 23.559
89 HG SER 13 HG SER 13 22.041 25.402 25.636
90 H CYS 14 H CYS 14 21.006 24.603 20.811
91 HA CYS 14 HA CYS 14 22.816 26.053 19.088
92 HB2 CYS 14 HB2 CYS 14 20.877 23.787 18.491
93 HB3 CYS 14 HB3 CYS 14 22.119 24.376 17.380
94 H ARG 15 H ARG 15 19.220 25.978 19.209
95 HA ARG 15 HA ARG 15 18.890 27.513 16.808
96 HB2 ARG 15 HB2 ARG 15 17.255 26.026 17.803
97 HB3 ARG 15 HB3 ARG 15 16.965 27.166 19.131
98 HG2 ARG 15 HG2 ARG 15 16.076 28.801 17.564
99 HG3 ARG 15 HG3 ARG 15 16.549 27.820 16.172
100 HD2 ARG 15 HD2 ARG 15 14.582 26.827 18.287
101 HD3 ARG 15 HD3 ARG 15 14.080 27.779 16.898
102 HE ARG 15 HE ARG 15 14.468 26.007 15.441
103 HH11 ARG 15 HH11 ARG 15 15.582 24.869 18.631
104 HH12 ARG 15 HH12 ARG 15 15.413 23.212 18.056
105 HH21 ARG 15 HH21 ARG 15 14.429 23.877 14.958
106 HH22 ARG 15 HH22 ARG 15 14.932 22.704 16.198
107 H SER 16 H SER 16 19.720 28.541 20.028
108 HA SER 16 HA SER 16 19.214 31.358 19.643
109 HB2 SER 16 HB2 SER 16 20.586 31.803 21.450
110 HB3 SER 16 HB3 SER 16 19.909 30.206 21.826
111 HG SER 16 HG SER 16 21.882 29.266 21.216
112 H LEU 17 H LEU 17 21.812 29.262 18.369
113 HA LEU 17 HA LEU 17 23.177 31.589 17.147
114 HB2 LEU 17 HB2 LEU 17 24.037 28.789 16.639
115 HB3 LEU 17 HB3 LEU 17 24.998 30.251 16.731
116 HG LEU 17 HG LEU 17 23.799 28.689 19.040
117 HD11 LEU 17 HD11 LEU 17 26.122 28.064 19.542
118 HD12 LEU 17 HD12 LEU 17 25.643 27.517 17.929
119 HD13 LEU 17 HD13 LEU 17 26.681 28.950 18.107
120 HD21 LEU 17 HD21 LEU 17 24.055 31.121 19.615
121 HD22 LEU 17 HD22 LEU 17 25.213 30.121 20.505
122 HD23 LEU 17 HD23 LEU 17 25.746 31.052 19.092
123 H GLY 18 H GLY 18 20.608 29.646 16.444
124 HA2 GLY 18 HA2 GLY 18 19.203 30.023 14.604
125 HA3 GLY 18 HA3 GLY 18 20.589 30.448 13.598
126 H LEU 19 H LEU 19 20.971 27.429 15.354
127 HA LEU 19 HA LEU 19 20.077 25.860 12.999
128 HB2 LEU 19 HB2 LEU 19 22.119 24.742 12.729
129 HB3 LEU 19 HB3 LEU 19 22.426 26.456 12.592
130 HG LEU 19 HG LEU 19 22.971 24.896 15.136
131 HD11 LEU 19 HD11 LEU 19 24.820 25.483 12.774
132 HD12 LEU 19 HD12 LEU 19 25.358 24.816 14.324
133 HD13 LEU 19 HD13 LEU 19 24.263 23.882 13.293
134 HD21 LEU 19 HD21 LEU 19 22.988 27.281 15.509
135 HD22 LEU 19 HD22 LEU 19 24.633 26.681 15.573
136 HD23 LEU 19 HD23 LEU 19 24.067 27.542 14.119
137 H LEU 20 H LEU 20 20.909 23.344 13.631
138 HA LEU 20 HA LEU 20 18.857 22.811 15.710
139 HB2 LEU 20 HB2 LEU 20 20.015 21.020 13.551
140 HB3 LEU 20 HB3 LEU 20 18.685 20.607 14.627
141 HG LEU 20 HG LEU 20 18.679 22.826 12.549
142 HD11 LEU 20 HD11 LEU 20 18.622 20.546 11.595
143 HD12 LEU 20 HD12 LEU 20 17.188 20.179 12.574
144 HD13 LEU 20 HD13 LEU 20 17.113 21.427 11.316
145 HD21 LEU 20 HD21 LEU 20 16.513 21.882 14.454
146 HD22 LEU 20 HD22 LEU 20 17.205 23.515 14.312
147 HD23 LEU 20 HD23 LEU 20 16.192 22.867 13.014
148 H GLY 21 H GLY 21 19.136 20.775 16.968
149 HA2 GLY 21 HA2 GLY 21 21.902 20.818 18.179
150 HA3 GLY 21 HA3 GLY 21 20.421 20.711 19.100
151 H LYS 22 H LYS 22 22.930 19.031 18.842
152 HA LYS 22 HA LYS 22 21.481 16.488 19.246
153 HB2 LYS 22 HB2 LYS 22 24.093 16.930 17.736
154 HB3 LYS 22 HB3 LYS 22 23.731 15.386 18.500
155 HG2 LYS 22 HG2 LYS 22 22.014 16.698 16.359
156 HG3 LYS 22 HG3 LYS 22 23.168 15.376 16.119
157 HD2 LYS 22 HD2 LYS 22 21.833 14.051 17.836
158 HD3 LYS 22 HD3 LYS 22 20.594 15.328 17.736
159 HE2 LYS 22 HE2 LYS 22 20.184 14.880 15.413
160 HE3 LYS 22 HE3 LYS 22 21.636 13.882 15.280
161 HZ1 LYS 22 HZ1 LYS 22 19.293 13.110 16.941
162 HZ2 LYS 22 HZ2 LYS 22 19.611 12.527 15.438
163 HZ3 LYS 22 HZ3 LYS 22 20.644 12.235 16.690
164 H CYS 23 H CYS 23 21.889 15.462 21.013
165 HA CYS 23 HA CYS 23 23.889 16.598 22.946
166 HB2 CYS 23 HB2 CYS 23 21.533 17.054 23.497
167 HB3 CYS 23 HB3 CYS 23 21.165 15.326 23.408
168 H ILE 24 H ILE 24 25.602 15.264 23.150
169 HA ILE 24 HA ILE 24 25.248 12.299 23.042
170 HB ILE 24 HB ILE 24 27.147 13.904 21.287
171 HG12 ILE 24 HG12 ILE 24 24.873 13.934 20.346
172 HG13 ILE 24 HG13 ILE 24 26.016 13.065 19.351
173 HG21 ILE 24 HG21 ILE 24 27.748 11.666 20.312
174 HG22 ILE 24 HG22 ILE 24 28.287 11.894 21.974
175 HG23 ILE 24 HG23 ILE 24 26.856 10.896 21.640
176 HD11 ILE 24 HD11 ILE 24 23.782 11.975 19.481
177 HD12 ILE 24 HD12 ILE 24 25.094 10.913 20.012
178 HD13 ILE 24 HD13 ILE 24 24.036 11.673 21.207
179 H GLY 25 H GLY 25 26.403 11.319 24.563
180 HA2 GLY 25 HA2 GLY 25 27.979 10.922 26.189
181 HA3 GLY 25 HA3 GLY 25 29.071 11.976 25.285
182 H GLU 26 H GLU 26 26.024 13.140 26.727
183 HA GLU 26 HA GLU 26 25.556 14.765 28.181
184 HB2 GLU 26 HB2 GLU 26 27.898 13.626 29.720
185 HB3 GLU 26 HB3 GLU 26 26.797 14.844 30.357
186 HG2 GLU 26 HG2 GLU 26 24.885 13.339 30.090
187 HG3 GLU 26 HG3 GLU 26 25.909 12.127 29.313
188 H GLU 27 H GLU 27 27.186 15.458 25.896
189 HA GLU 27 HA GLU 27 27.685 18.244 26.749
190 HB2 GLU 27 HB2 GLU 27 29.468 16.671 24.866
191 HB3 GLU 27 HB3 GLU 27 29.571 18.398 25.135
192 HG2 GLU 27 HG2 GLU 27 30.081 16.262 27.257
193 HG3 GLU 27 HG3 GLU 27 31.315 17.048 26.298
194 H CYS 28 H CYS 28 27.313 19.779 24.978
195 HA CYS 28 HA CYS 28 25.254 18.753 23.059
196 HB2 CYS 28 HB2 CYS 28 24.280 20.166 24.682
197 HB3 CYS 28 HB3 CYS 28 25.587 21.338 24.557
198 H LYS 29 H LYS 29 25.408 19.073 20.921
199 HA LYS 29 HA LYS 29 27.427 20.913 19.735
200 HB2 LYS 29 HB2 LYS 29 26.941 17.972 19.075
201 HB3 LYS 29 HB3 LYS 29 27.873 19.069 18.061
202 HG2 LYS 29 HG2 LYS 29 28.614 18.242 20.901
203 HG3 LYS 29 HG3 LYS 29 29.302 17.609 19.419
204 HD2 LYS 29 HD2 LYS 29 30.067 19.971 18.839
205 HD3 LYS 29 HD3 LYS 29 29.547 20.449 20.477
206 HE2 LYS 29 HE2 LYS 29 31.014 18.471 21.300
207 HE3 LYS 29 HE3 LYS 29 31.695 18.449 19.670
208 HZ1 LYS 29 HZ1 LYS 29 33.025 19.826 21.136
209 HZ2 LYS 29 HZ2 LYS 29 32.287 20.837 20.041
210 HZ3 LYS 29 HZ3 LYS 29 31.715 20.723 21.563
211 H CYS 30 H CYS 30 26.923 21.636 17.618
212 HA CYS 30 HA CYS 30 24.023 21.361 16.972
213 HB2 CYS 30 HB2 CYS 30 25.762 23.720 16.308
214 HB3 CYS 30 HB3 CYS 30 24.011 23.574 16.300
215 H VAL 31 H VAL 31 23.217 21.437 14.930
216 HA VAL 31 HA VAL 31 24.970 20.580 12.683
217 HB VAL 31 HB VAL 31 23.109 18.799 12.256
218 HG11 VAL 31 HG11 VAL 31 24.360 17.134 13.519
219 HG12 VAL 31 HG12 VAL 31 25.445 18.277 12.716
220 HG13 VAL 31 HG13 VAL 31 25.150 18.412 14.469
221 HG21 VAL 31 HG21 VAL 31 21.581 19.510 14.093
222 HG22 VAL 31 HG22 VAL 31 22.055 17.809 14.156
223 HG23 VAL 31 HG23 VAL 31 22.798 18.972 15.273
224 HA PRO 32 HA PRO 32 22.400 23.080 10.223
225 HB2 PRO 32 HB2 PRO 32 22.828 22.168 7.704
226 HB3 PRO 32 HB3 PRO 32 24.164 22.779 8.722
227 HG2 PRO 32 HG2 PRO 32 23.312 19.885 8.334
228 HG3 PRO 32 HG3 PRO 32 24.958 20.578 8.152
229 HD2 PRO 32 HD2 PRO 32 24.142 19.388 10.437
230 HD3 PRO 32 HD3 PRO 32 25.222 20.816 10.466
231 H TYR 33 H TYR 33 20.654 23.331 8.729
232 HA TYR 33 HA TYR 33 18.405 21.489 8.899
233 HB2 TYR 33 HB2 TYR 33 18.883 24.072 7.391
234 HB3 TYR 33 HB3 TYR 33 17.425 23.121 7.213
235 HD1 TYR 33 HD2 TYR 33 15.817 22.830 9.061
236 HD2 TYR 33 HD1 TYR 33 19.261 25.397 9.453
237 HE1 TYR 33 HE2 TYR 33 14.735 23.978 10.984
238 HE2 TYR 33 HE1 TYR 33 18.182 26.525 11.410
239 HH TYR 33 HH TYR 33 14.989 25.529 12.660
Start of MODEL 3
1 H1 GLY 1 H1 GLY 1 33.640 20.184 30.909
2 H2 GLY 1 H2 GLY 1 33.482 20.135 29.265
3 H3 GLY 1 H3 GLY 1 34.493 19.086 30.034
4 HA2 GLY 1 HA2 GLY 1 32.401 18.043 29.308
5 HA3 GLY 1 HA3 GLY 1 32.721 17.918 31.050
6 H SER 2 H SER 2 30.264 18.385 29.034
7 HA SER 2 HA SER 2 29.068 20.734 30.425
8 HB2 SER 2 HB2 SER 2 28.106 19.298 27.951
9 HB3 SER 2 HB3 SER 2 27.496 20.824 28.629
10 HG SER 2 HG SER 2 29.976 20.253 27.398
11 H ALA 3 H ALA 3 28.874 17.394 30.776
12 HA ALA 3 HA ALA 3 27.584 15.939 31.804
13 HB1 ALA 3 HB1 ALA 3 26.550 16.629 33.913
14 HB2 ALA 3 HB2 ALA 3 28.175 17.288 33.684
15 HB3 ALA 3 HB3 ALA 3 26.752 18.329 33.447
16 H PHE 4 H PHE 4 25.896 14.713 31.689
17 HA PHE 4 HA PHE 4 23.849 13.908 31.174
18 HB2 PHE 4 HB2 PHE 4 23.889 14.863 33.535
19 HB3 PHE 4 HB3 PHE 4 22.746 16.058 32.943
20 HD1 PHE 4 HD1 PHE 4 23.420 12.413 33.379
21 HD2 PHE 4 HD2 PHE 4 20.408 15.399 32.584
22 HE1 PHE 4 HE1 PHE 4 21.656 10.692 33.649
23 HE2 PHE 4 HE2 PHE 4 18.638 13.674 32.872
24 HZ PHE 4 HZ PHE 4 19.260 11.326 33.390
25 H CYS 5 H CYS 5 24.103 14.547 28.935
26 HA CYS 5 HA CYS 5 23.151 17.054 28.032
27 HB2 CYS 5 HB2 CYS 5 24.882 15.653 26.950
28 HB3 CYS 5 HB3 CYS 5 23.620 14.610 26.307
29 H ASN 6 H ASN 6 21.246 17.833 27.394
30 HA ASN 6 HA ASN 6 18.926 15.949 27.079
31 HB2 ASN 6 HB2 ASN 6 18.837 17.347 29.136
32 HB3 ASN 6 HB3 ASN 6 18.995 18.796 28.162
33 HD21 ASN 6 HD22 ASN 6 16.919 19.144 29.505
34 HD22 ASN 6 HD21 ASN 6 15.434 18.665 28.681
35 H LEU 7 H LEU 7 18.414 15.759 24.968
36 HA LEU 7 HA LEU 7 19.227 17.535 22.907
37 HB2 LEU 7 HB2 LEU 7 18.503 15.157 22.633
38 HB3 LEU 7 HB3 LEU 7 16.842 15.646 22.994
39 HG LEU 7 HG LEU 7 16.778 17.039 20.956
40 HD11 LEU 7 HD11 LEU 7 18.653 16.736 19.277
41 HD12 LEU 7 HD12 LEU 7 19.076 17.734 20.668
42 HD13 LEU 7 HD13 LEU 7 19.631 16.044 20.584
43 HD21 LEU 7 HD21 LEU 7 16.796 15.225 19.323
44 HD22 LEU 7 HD22 LEU 7 17.774 14.218 20.413
45 HD23 LEU 7 HD23 LEU 7 16.115 14.660 20.868
46 H ALA 8 H ALA 8 16.243 17.649 24.893
47 HA ALA 8 HA ALA 8 14.886 19.612 23.385
48 HB1 ALA 8 HB1 ALA 8 13.669 20.056 25.480
49 HB2 ALA 8 HB2 ALA 8 13.887 18.312 25.235
50 HB3 ALA 8 HB3 ALA 8 14.910 19.184 26.401
51 H ARG 9 H ARG 9 17.279 20.100 26.078
52 HA ARG 9 HA ARG 9 17.302 22.925 26.053
53 HB2 ARG 9 HB2 ARG 9 18.032 21.201 27.845
54 HB3 ARG 9 HB3 ARG 9 19.490 20.935 26.876
55 HG2 ARG 9 HG2 ARG 9 19.884 23.384 26.960
56 HG3 ARG 9 HG3 ARG 9 18.534 23.548 28.101
57 HD2 ARG 9 HD2 ARG 9 19.720 22.146 29.728
58 HD3 ARG 9 HD3 ARG 9 21.003 21.808 28.552
59 HE ARG 9 HE ARG 9 21.441 24.325 28.557
60 HH11 ARG 9 HH21 ARG 9 20.494 22.650 31.544
61 HH12 ARG 9 HH22 ARG 9 21.145 23.934 32.525
62 HH21 ARG 9 HH11 ARG 9 22.158 25.902 29.888
63 HH22 ARG 9 HH12 ARG 9 22.067 25.679 31.616
64 H CYS 10 H CYS 10 19.316 20.471 24.494
65 HA CYS 10 HA CYS 10 21.304 22.182 23.422
66 HB2 CYS 10 HB2 CYS 10 21.455 19.690 23.762
67 HB3 CYS 10 HB3 CYS 10 20.350 19.482 22.396
68 H GLU 11 H GLU 11 18.319 20.809 21.929
69 HA GLU 11 HA GLU 11 18.605 21.850 19.349
70 HB2 GLU 11 HB2 GLU 11 16.327 21.007 21.095
71 HB3 GLU 11 HB3 GLU 11 15.903 22.003 19.726
72 HG2 GLU 11 HG2 GLU 11 17.713 19.597 19.319
73 HG3 GLU 11 HG3 GLU 11 15.956 19.429 19.415
74 H LEU 12 H LEU 12 16.986 23.350 22.156
75 HA LEU 12 HA LEU 12 16.326 25.791 20.796
76 HB2 LEU 12 HB2 LEU 12 15.252 24.550 22.816
77 HB3 LEU 12 HB3 LEU 12 16.518 25.251 23.799
78 HG LEU 12 HG LEU 12 15.746 27.543 23.156
79 HD11 LEU 12 HD11 LEU 12 13.428 26.039 21.846
80 HD12 LEU 12 HD12 LEU 12 13.462 27.783 22.182
81 HD13 LEU 12 HD13 LEU 12 14.598 27.102 21.022
82 HD21 LEU 12 HD21 LEU 12 14.992 26.480 25.238
83 HD22 LEU 12 HD22 LEU 12 13.708 27.482 24.550
84 HD23 LEU 12 HD23 LEU 12 13.634 25.716 24.378
85 H SER 13 H SER 13 19.060 24.814 22.754
86 HA SER 13 HA SER 13 20.228 27.486 23.046
87 HB2 SER 13 HB2 SER 13 21.622 24.794 23.265
88 HB3 SER 13 HB3 SER 13 22.232 26.368 23.818
89 HG SER 13 HG SER 13 19.968 24.918 24.731
90 H CYS 14 H CYS 14 20.923 24.684 20.847
91 HA CYS 14 HA CYS 14 22.737 26.140 19.153
92 HB2 CYS 14 HB2 CYS 14 20.906 23.783 18.569
93 HB3 CYS 14 HB3 CYS 14 22.131 24.394 17.434
94 H ARG 15 H ARG 15 19.160 26.014 19.120
95 HA ARG 15 HA ARG 15 18.609 27.374 16.780
96 HB2 ARG 15 HB2 ARG 15 17.100 26.494 18.847
97 HB3 ARG 15 HB3 ARG 15 17.143 28.195 19.293
98 HG2 ARG 15 HG2 ARG 15 15.186 27.917 18.009
99 HG3 ARG 15 HG3 ARG 15 16.349 28.694 16.923
100 HD2 ARG 15 HD2 ARG 15 15.312 26.988 15.645
101 HD3 ARG 15 HD3 ARG 15 16.908 26.358 16.046
102 HE ARG 15 HE ARG 15 14.355 25.594 17.443
103 HH11 ARG 15 HH11 ARG 15 17.613 24.537 16.453
104 HH12 ARG 15 HH12 ARG 15 17.190 22.873 16.783
105 HH21 ARG 15 HH21 ARG 15 13.948 23.463 17.629
106 HH22 ARG 15 HH22 ARG 15 15.205 22.288 17.317
107 H SER 16 H SER 16 19.919 28.843 19.715
108 HA SER 16 HA SER 16 19.474 31.565 19.019
109 HB2 SER 16 HB2 SER 16 20.995 32.144 20.726
110 HB3 SER 16 HB3 SER 16 20.114 30.711 21.285
111 HG SER 16 HG SER 16 21.884 29.450 20.910
112 H LEU 17 H LEU 17 21.923 29.374 17.735
113 HA LEU 17 HA LEU 17 23.308 31.657 16.392
114 HB2 LEU 17 HB2 LEU 17 24.175 28.805 16.194
115 HB3 LEU 17 HB3 LEU 17 25.127 30.260 16.000
116 HG LEU 17 HG LEU 17 24.041 29.098 18.591
117 HD11 LEU 17 HD11 LEU 17 26.887 29.265 17.521
118 HD12 LEU 17 HD12 LEU 17 26.400 28.614 19.102
119 HD13 LEU 17 HD13 LEU 17 25.888 27.800 17.619
120 HD21 LEU 17 HD21 LEU 17 25.892 31.499 18.159
121 HD22 LEU 17 HD22 LEU 17 24.229 31.574 18.779
122 HD23 LEU 17 HD23 LEU 17 25.488 30.783 19.733
123 H GLY 18 H GLY 18 20.799 29.576 15.892
124 HA2 GLY 18 HA2 GLY 18 19.339 29.965 14.053
125 HA3 GLY 18 HA3 GLY 18 20.713 30.126 12.966
126 H LEU 19 H LEU 19 21.049 27.346 15.026
127 HA LEU 19 HA LEU 19 20.129 25.609 12.783
128 HB2 LEU 19 HB2 LEU 19 22.174 24.509 12.666
129 HB3 LEU 19 HB3 LEU 19 22.473 26.219 12.476
130 HG LEU 19 HG LEU 19 22.987 24.663 15.030
131 HD11 LEU 19 HD11 LEU 19 24.419 23.847 13.164
132 HD12 LEU 19 HD12 LEU 19 24.910 25.505 12.798
133 HD13 LEU 19 HD13 LEU 19 25.394 24.745 14.326
134 HD21 LEU 19 HD21 LEU 19 24.531 26.531 15.569
135 HD22 LEU 19 HD22 LEU 19 23.970 27.399 14.119
136 HD23 LEU 19 HD23 LEU 19 22.863 27.058 15.467
137 H LEU 20 H LEU 20 21.090 23.181 13.619
138 HA LEU 20 HA LEU 20 18.974 22.521 15.600
139 HB2 LEU 20 HB2 LEU 20 20.457 20.854 13.547
140 HB3 LEU 20 HB3 LEU 20 19.310 20.190 14.703
141 HG LEU 20 HG LEU 20 18.611 22.252 12.586
142 HD11 LEU 20 HD11 LEU 20 19.286 20.109 11.586
143 HD12 LEU 20 HD12 LEU 20 18.154 19.238 12.653
144 HD13 LEU 20 HD13 LEU 20 17.538 20.357 11.418
145 HD21 LEU 20 HD21 LEU 20 16.262 21.508 13.083
146 HD22 LEU 20 HD22 LEU 20 16.885 20.579 14.462
147 HD23 LEU 20 HD23 LEU 20 17.035 22.349 14.432
148 H GLY 21 H GLY 21 19.374 20.919 17.163
149 HA2 GLY 21 HA2 GLY 21 22.208 20.791 18.176
150 HA3 GLY 21 HA3 GLY 21 20.779 20.732 19.193
151 H LYS 22 H LYS 22 23.121 18.916 18.770
152 HA LYS 22 HA LYS 22 21.535 16.405 18.976
153 HB2 LYS 22 HB2 LYS 22 24.315 16.634 17.735
154 HB3 LYS 22 HB3 LYS 22 23.449 15.125 18.033
155 HG2 LYS 22 HG2 LYS 22 22.542 17.316 16.164
156 HG3 LYS 22 HG3 LYS 22 23.425 15.868 15.665
157 HD2 LYS 22 HD2 LYS 22 21.561 14.449 16.251
158 HD3 LYS 22 HD3 LYS 22 20.705 15.802 17.027
159 HE2 LYS 22 HE2 LYS 22 20.604 16.995 14.872
160 HE3 LYS 22 HE3 LYS 22 21.405 15.637 14.059
161 HZ1 LYS 22 HZ1 LYS 22 18.858 15.356 15.544
162 HZ2 LYS 22 HZ2 LYS 22 18.900 15.677 13.952
163 HZ3 LYS 22 HZ3 LYS 22 19.553 14.272 14.454
164 H CYS 23 H CYS 23 22.232 14.976 20.491
165 HA CYS 23 HA CYS 23 24.216 15.953 22.508
166 HB2 CYS 23 HB2 CYS 23 21.592 14.506 22.628
167 HB3 CYS 23 HB3 CYS 23 22.811 14.056 23.774
168 H ILE 24 H ILE 24 26.079 14.887 22.621
169 HA ILE 24 HA ILE 24 26.186 11.972 21.969
170 HB ILE 24 HB ILE 24 28.397 13.917 21.229
171 HG12 ILE 24 HG12 ILE 24 27.647 13.097 18.816
172 HG13 ILE 24 HG13 ILE 24 26.063 12.944 19.554
173 HG21 ILE 24 HG21 ILE 24 29.225 11.930 19.984
174 HG22 ILE 24 HG22 ILE 24 29.079 11.577 21.697
175 HG23 ILE 24 HG23 ILE 24 27.847 10.983 20.560
176 HD11 ILE 24 HD11 ILE 24 27.800 15.457 19.410
177 HD12 ILE 24 HD12 ILE 24 26.381 15.113 18.408
178 HD13 ILE 24 HD13 ILE 24 26.185 15.409 20.141
179 H GLY 25 H GLY 25 26.606 10.924 23.762
180 HA2 GLY 25 HA2 GLY 25 27.569 10.274 25.746
181 HA3 GLY 25 HA3 GLY 25 28.926 11.349 25.400
182 H GLU 26 H GLU 26 28.932 13.403 26.231
183 HA GLU 26 HA GLU 26 26.972 14.128 28.391
184 HB2 GLU 26 HB2 GLU 26 29.953 14.467 28.177
185 HB3 GLU 26 HB3 GLU 26 28.983 15.352 29.351
186 HG2 GLU 26 HG2 GLU 26 28.655 12.341 29.231
187 HG3 GLU 26 HG3 GLU 26 30.112 13.029 29.917
188 H GLU 27 H GLU 27 28.065 15.085 25.315
189 HA GLU 27 HA GLU 27 27.927 17.994 25.942
190 HB2 GLU 27 HB2 GLU 27 29.312 16.606 23.626
191 HB3 GLU 27 HB3 GLU 27 29.401 18.312 24.044
192 HG2 GLU 27 HG2 GLU 27 30.555 15.958 25.587
193 HG3 GLU 27 HG3 GLU 27 31.439 17.172 24.687
194 H CYS 28 H CYS 28 26.799 19.380 24.815
195 HA CYS 28 HA CYS 28 24.902 18.535 22.699
196 HB2 CYS 28 HB2 CYS 28 23.986 19.968 24.417
197 HB3 CYS 28 HB3 CYS 28 25.358 21.071 24.305
198 H LYS 29 H LYS 29 25.586 18.661 20.643
199 HA LYS 29 HA LYS 29 27.568 20.748 19.820
200 HB2 LYS 29 HB2 LYS 29 27.235 17.980 18.603
201 HB3 LYS 29 HB3 LYS 29 28.371 19.219 18.108
202 HG2 LYS 29 HG2 LYS 29 28.421 17.652 20.719
203 HG3 LYS 29 HG3 LYS 29 29.469 17.420 19.325
204 HD2 LYS 29 HD2 LYS 29 30.445 19.704 19.695
205 HD3 LYS 29 HD3 LYS 29 29.446 19.852 21.159
206 HE2 LYS 29 HE2 LYS 29 30.462 17.643 21.938
207 HE3 LYS 29 HE3 LYS 29 31.582 17.753 20.585
208 HZ1 LYS 29 HZ1 LYS 29 32.425 19.850 21.545
209 HZ2 LYS 29 HZ2 LYS 29 31.344 19.749 22.778
210 HZ3 LYS 29 HZ3 LYS 29 32.549 18.651 22.636
211 H CYS 30 H CYS 30 27.022 21.862 17.925
212 HA CYS 30 HA CYS 30 24.191 21.497 17.111
213 HB2 CYS 30 HB2 CYS 30 25.839 23.926 16.485
214 HB3 CYS 30 HB3 CYS 30 24.112 23.704 16.461
215 H VAL 31 H VAL 31 23.509 21.497 14.962
216 HA VAL 31 HA VAL 31 25.548 20.931 12.871
217 HB VAL 31 HB VAL 31 24.094 18.975 12.123
218 HG11 VAL 31 HG11 VAL 31 25.239 17.395 13.532
219 HG12 VAL 31 HG12 VAL 31 26.319 18.741 13.138
220 HG13 VAL 31 HG13 VAL 31 25.571 18.645 14.753
221 HG21 VAL 31 HG21 VAL 31 22.111 19.377 13.481
222 HG22 VAL 31 HG22 VAL 31 22.817 17.791 13.813
223 HG23 VAL 31 HG23 VAL 31 23.056 19.132 14.969
224 HA PRO 32 HA PRO 32 22.846 23.114 10.112
225 HB2 PRO 32 HB2 PRO 32 23.592 22.109 7.683
226 HB3 PRO 32 HB3 PRO 32 24.680 23.122 8.680
227 HG2 PRO 32 HG2 PRO 32 24.575 20.078 8.550
228 HG3 PRO 32 HG3 PRO 32 26.010 21.140 8.348
229 HD2 PRO 32 HD2 PRO 32 25.422 19.994 10.702
230 HD3 PRO 32 HD3 PRO 32 26.050 21.667 10.647
231 H TYR 33 H TYR 33 21.251 22.750 8.314
232 HA TYR 33 HA TYR 33 19.363 20.622 9.008
233 HB2 TYR 33 HB2 TYR 33 19.268 23.007 7.149
234 HB3 TYR 33 HB3 TYR 33 18.023 21.771 7.139
235 HD1 TYR 33 HD2 TYR 33 16.499 21.421 9.006
236 HD2 TYR 33 HD1 TYR 33 19.474 24.541 9.096
237 HE1 TYR 33 HE2 TYR 33 15.354 22.454 10.962
238 HE2 TYR 33 HE1 TYR 33 18.326 25.573 11.060
239 HH TYR 33 HH TYR 33 16.537 25.468 12.496
Start of MODEL 4
1 H1 GLY 1 H1 GLY 1 27.881 10.009 32.033
2 H2 GLY 1 H2 GLY 1 27.092 10.140 33.458
3 H3 GLY 1 H3 GLY 1 27.544 8.648 32.905
4 HA2 GLY 1 HA2 GLY 1 29.071 9.221 34.591
5 HA3 GLY 1 HA3 GLY 1 29.893 9.354 33.022
6 H SER 2 H SER 2 30.324 11.496 32.162
7 HA SER 2 HA SER 2 31.024 13.225 34.432
8 HB2 SER 2 HB2 SER 2 32.758 14.042 33.135
9 HB3 SER 2 HB3 SER 2 32.663 12.330 32.716
10 HG SER 2 HG SER 2 31.503 12.932 30.804
11 H ALA 3 H ALA 3 28.645 13.467 31.915
12 HA ALA 3 HA ALA 3 27.944 16.183 32.678
13 HB1 ALA 3 HB1 ALA 3 29.772 16.599 31.091
14 HB2 ALA 3 HB2 ALA 3 29.026 15.543 29.892
15 HB3 ALA 3 HB3 ALA 3 28.230 17.049 30.361
16 H PHE 4 H PHE 4 26.047 16.902 31.458
17 HA PHE 4 HA PHE 4 24.140 14.666 30.883
18 HB2 PHE 4 HB2 PHE 4 23.853 16.967 32.819
19 HB3 PHE 4 HB3 PHE 4 22.536 15.924 32.316
20 HD1 PHE 4 HD1 PHE 4 22.678 13.406 32.742
21 HD2 PHE 4 HD2 PHE 4 25.317 16.264 34.599
22 HE1 PHE 4 HE1 PHE 4 23.229 11.752 34.508
23 HE2 PHE 4 HE2 PHE 4 25.871 14.601 36.364
24 HZ PHE 4 HZ PHE 4 24.818 12.351 36.332
25 H CYS 5 H CYS 5 24.404 15.231 28.589
26 HA CYS 5 HA CYS 5 23.234 17.763 27.680
27 HB2 CYS 5 HB2 CYS 5 25.041 16.613 26.479
28 HB3 CYS 5 HB3 CYS 5 23.965 15.268 26.109
29 H ASN 6 H ASN 6 21.226 18.098 26.748
30 HA ASN 6 HA ASN 6 19.314 15.816 26.557
31 HB2 ASN 6 HB2 ASN 6 18.702 16.862 28.645
32 HB3 ASN 6 HB3 ASN 6 18.853 18.473 27.947
33 HD21 ASN 6 HD22 ASN 6 16.943 15.423 27.544
34 HD22 ASN 6 HD21 ASN 6 15.475 16.302 27.105
35 H LEU 7 H LEU 7 18.344 15.746 24.625
36 HA LEU 7 HA LEU 7 19.043 17.426 22.500
37 HB2 LEU 7 HB2 LEU 7 18.122 15.093 22.446
38 HB3 LEU 7 HB3 LEU 7 16.530 15.737 22.849
39 HG LEU 7 HG LEU 7 16.520 16.986 20.679
40 HD11 LEU 7 HD11 LEU 7 18.255 16.294 18.974
41 HD12 LEU 7 HD12 LEU 7 18.907 17.301 20.265
42 HD13 LEU 7 HD13 LEU 7 19.185 15.542 20.279
43 HD21 LEU 7 HD21 LEU 7 17.132 14.009 20.485
44 HD22 LEU 7 HD22 LEU 7 15.559 14.716 20.906
45 HD23 LEU 7 HD23 LEU 7 16.230 14.967 19.297
46 H ALA 8 H ALA 8 16.190 17.909 24.668
47 HA ALA 8 HA ALA 8 15.128 19.998 22.941
48 HB1 ALA 8 HB1 ALA 8 13.708 18.685 24.489
49 HB2 ALA 8 HB2 ALA 8 14.544 19.433 25.870
50 HB3 ALA 8 HB3 ALA 8 13.592 20.437 24.766
51 H ARG 9 H ARG 9 17.104 20.031 25.988
52 HA ARG 9 HA ARG 9 17.408 22.819 26.204
53 HB2 ARG 9 HB2 ARG 9 17.908 20.689 27.742
54 HB3 ARG 9 HB3 ARG 9 19.520 20.801 27.024
55 HG2 ARG 9 HG2 ARG 9 19.417 23.255 27.670
56 HG3 ARG 9 HG3 ARG 9 18.007 22.882 28.656
57 HD2 ARG 9 HD2 ARG 9 20.832 21.798 28.974
58 HD3 ARG 9 HD3 ARG 9 19.977 22.867 30.083
59 HE ARG 9 HE ARG 9 18.364 20.955 30.494
60 HH11 ARG 9 HH11 ARG 9 21.707 20.207 29.670
61 HH12 ARG 9 HH12 ARG 9 21.533 18.564 30.159
62 HH21 ARG 9 HH21 ARG 9 18.245 18.860 31.103
63 HH22 ARG 9 HH22 ARG 9 19.626 17.785 30.845
64 H CYS 10 H CYS 10 19.248 20.456 24.375
65 HA CYS 10 HA CYS 10 21.338 22.227 23.462
66 HB2 CYS 10 HB2 CYS 10 21.500 19.730 23.822
67 HB3 CYS 10 HB3 CYS 10 20.461 19.521 22.407
68 H GLU 11 H GLU 11 18.304 20.842 21.985
69 HA GLU 11 HA GLU 11 18.580 22.186 19.512
70 HB2 GLU 11 HB2 GLU 11 16.161 21.163 21.017
71 HB3 GLU 11 HB3 GLU 11 15.947 22.266 19.674
72 HG2 GLU 11 HG2 GLU 11 17.404 20.717 18.264
73 HG3 GLU 11 HG3 GLU 11 17.219 19.518 19.534
74 H LEU 12 H LEU 12 16.945 23.339 22.529
75 HA LEU 12 HA LEU 12 16.310 25.950 21.536
76 HB2 LEU 12 HB2 LEU 12 16.783 24.827 24.327
77 HB3 LEU 12 HB3 LEU 12 16.285 26.490 24.060
78 HG LEU 12 HG LEU 12 14.668 24.092 23.083
79 HD11 LEU 12 HD11 LEU 12 13.197 24.533 25.008
80 HD12 LEU 12 HD12 LEU 12 14.824 24.105 25.547
81 HD13 LEU 12 HD13 LEU 12 14.299 25.805 25.581
82 HD21 LEU 12 HD21 LEU 12 14.149 26.167 21.856
83 HD22 LEU 12 HD22 LEU 12 12.828 25.744 22.946
84 HD23 LEU 12 HD23 LEU 12 13.955 27.043 23.392
85 H SER 13 H SER 13 19.264 24.762 23.152
86 HA SER 13 HA SER 13 20.595 27.309 23.284
87 HB2 SER 13 HB2 SER 13 21.716 24.485 23.162
88 HB3 SER 13 HB3 SER 13 22.687 25.940 23.426
89 HG SER 13 HG SER 13 20.747 24.764 25.076
90 H CYS 14 H CYS 14 20.868 24.669 20.807
91 HA CYS 14 HA CYS 14 22.614 26.241 19.121
92 HB2 CYS 14 HB2 CYS 14 20.923 23.802 18.528
93 HB3 CYS 14 HB3 CYS 14 22.149 24.460 17.429
94 H ARG 15 H ARG 15 19.042 25.859 19.083
95 HA ARG 15 HA ARG 15 18.587 27.205 16.615
96 HB2 ARG 15 HB2 ARG 15 17.016 25.732 17.751
97 HB3 ARG 15 HB3 ARG 15 16.763 26.911 19.041
98 HG2 ARG 15 HG2 ARG 15 15.622 28.412 17.594
99 HG3 ARG 15 HG3 ARG 15 16.203 27.607 16.132
100 HD2 ARG 15 HD2 ARG 15 14.318 26.314 18.148
101 HD3 ARG 15 HD3 ARG 15 13.781 27.167 16.699
102 HE ARG 15 HE ARG 15 15.017 25.543 15.320
103 HH11 ARG 15 HH11 ARG 15 13.773 24.332 18.369
104 HH12 ARG 15 HH12 ARG 15 14.410 22.715 18.042
105 HH21 ARG 15 HH21 ARG 15 15.647 23.447 15.008
106 HH22 ARG 15 HH22 ARG 15 15.260 22.227 16.243
107 H SER 16 H SER 16 19.214 28.559 19.790
108 HA SER 16 HA SER 16 18.544 31.270 19.114
109 HB2 SER 16 HB2 SER 16 19.667 31.923 21.071
110 HB3 SER 16 HB3 SER 16 18.893 30.376 21.432
111 HG SER 16 HG SER 16 20.986 29.378 21.074
112 H LEU 17 H LEU 17 21.162 29.314 17.987
113 HA LEU 17 HA LEU 17 22.674 31.699 17.022
114 HB2 LEU 17 HB2 LEU 17 23.741 28.942 16.689
115 HB3 LEU 17 HB3 LEU 17 24.590 30.436 16.980
116 HG LEU 17 HG LEU 17 23.083 28.795 19.041
117 HD11 LEU 17 HD11 LEU 17 25.077 27.649 18.219
118 HD12 LEU 17 HD12 LEU 17 26.068 29.089 18.542
119 HD13 LEU 17 HD13 LEU 17 25.316 28.201 19.884
120 HD21 LEU 17 HD21 LEU 17 24.979 31.177 19.409
121 HD22 LEU 17 HD22 LEU 17 23.225 31.224 19.671
122 HD23 LEU 17 HD23 LEU 17 24.241 30.224 20.715
123 H GLY 18 H GLY 18 20.273 29.650 16.022
124 HA2 GLY 18 HA2 GLY 18 19.169 29.793 13.980
125 HA3 GLY 18 HA3 GLY 18 20.650 30.281 13.168
126 H LEU 19 H LEU 19 20.839 27.362 15.146
127 HA LEU 19 HA LEU 19 20.320 25.631 12.823
128 HB2 LEU 19 HB2 LEU 19 22.437 24.611 12.775
129 HB3 LEU 19 HB3 LEU 19 22.650 26.332 12.528
130 HG LEU 19 HG LEU 19 23.120 24.946 15.185
131 HD11 LEU 19 HD11 LEU 19 25.559 25.052 14.533
132 HD12 LEU 19 HD12 LEU 19 24.615 23.995 13.465
133 HD13 LEU 19 HD13 LEU 19 25.071 25.629 12.934
134 HD21 LEU 19 HD21 LEU 19 24.610 26.890 15.649
135 HD22 LEU 19 HD22 LEU 19 23.996 27.667 14.168
136 HD23 LEU 19 HD23 LEU 19 22.909 27.301 15.532
137 H LEU 20 H LEU 20 21.080 23.221 13.550
138 HA LEU 20 HA LEU 20 19.015 22.736 15.600
139 HB2 LEU 20 HB2 LEU 20 18.894 21.834 13.275
140 HB3 LEU 20 HB3 LEU 20 20.379 20.948 13.568
141 HG LEU 20 HG LEU 20 19.277 19.568 15.270
142 HD11 LEU 20 HD11 LEU 20 16.711 21.021 14.473
143 HD12 LEU 20 HD12 LEU 20 16.835 19.621 15.555
144 HD13 LEU 20 HD13 LEU 20 17.520 21.175 16.045
145 HD21 LEU 20 HD21 LEU 20 19.290 18.877 12.912
146 HD22 LEU 20 HD22 LEU 20 17.797 18.348 13.695
147 HD23 LEU 20 HD23 LEU 20 17.775 19.753 12.612
148 H GLY 21 H GLY 21 19.323 21.338 17.409
149 HA2 GLY 21 HA2 GLY 21 22.158 21.016 18.295
150 HA3 GLY 21 HA3 GLY 21 20.753 21.061 19.349
151 H LYS 22 H LYS 22 23.070 19.099 18.815
152 HA LYS 22 HA LYS 22 21.506 16.568 18.888
153 HB2 LYS 22 HB2 LYS 22 22.110 17.120 16.585
154 HB3 LYS 22 HB3 LYS 22 23.777 17.379 17.017
155 HG2 LYS 22 HG2 LYS 22 22.366 14.686 17.249
156 HG3 LYS 22 HG3 LYS 22 23.196 15.277 15.794
157 HD2 LYS 22 HD2 LYS 22 25.200 15.656 17.574
158 HD3 LYS 22 HD3 LYS 22 24.358 14.326 18.375
159 HE2 LYS 22 HE2 LYS 22 25.364 14.410 15.521
160 HE3 LYS 22 HE3 LYS 22 26.143 13.557 16.867
161 HZ1 LYS 22 HZ1 LYS 22 23.536 12.890 15.612
162 HZ2 LYS 22 HZ2 LYS 22 24.859 11.940 15.670
163 HZ3 LYS 22 HZ3 LYS 22 23.987 12.252 17.044
164 H CYS 23 H CYS 23 22.301 15.261 20.539
165 HA CYS 23 HA CYS 23 24.505 16.304 22.179
166 HB2 CYS 23 HB2 CYS 23 22.431 14.107 22.432
167 HB3 CYS 23 HB3 CYS 23 23.743 14.291 23.560
168 H ILE 24 H ILE 24 26.549 15.436 22.269
169 HA ILE 24 HA ILE 24 27.017 12.758 21.007
170 HB ILE 24 HB ILE 24 28.819 15.181 20.725
171 HG12 ILE 24 HG12 ILE 24 27.135 13.602 18.737
172 HG13 ILE 24 HG13 ILE 24 26.896 15.279 19.235
173 HG21 ILE 24 HG21 ILE 24 30.297 13.680 19.434
174 HG22 ILE 24 HG22 ILE 24 30.112 13.059 21.058
175 HG23 ILE 24 HG23 ILE 24 29.199 12.313 19.723
176 HD11 ILE 24 HD11 ILE 24 27.857 15.323 17.061
177 HD12 ILE 24 HD12 ILE 24 29.108 15.857 18.198
178 HD13 ILE 24 HD13 ILE 24 29.158 14.216 17.520
179 H GLY 25 H GLY 25 27.623 11.366 22.415
180 HA2 GLY 25 HA2 GLY 25 28.577 10.328 24.222
181 HA3 GLY 25 HA3 GLY 25 29.636 11.727 24.437
182 H GLU 26 H GLU 26 28.880 13.511 25.586
183 HA GLU 26 HA GLU 26 26.543 13.203 27.407
184 HB2 GLU 26 HB2 GLU 26 29.414 13.748 28.306
185 HB3 GLU 26 HB3 GLU 26 27.985 13.631 29.335
186 HG2 GLU 26 HG2 GLU 26 27.685 11.274 28.635
187 HG3 GLU 26 HG3 GLU 26 29.208 11.348 27.740
188 H GLU 27 H GLU 27 27.914 15.173 25.167
189 HA GLU 27 HA GLU 27 27.204 17.726 26.547
190 HB2 GLU 27 HB2 GLU 27 29.728 17.137 24.976
191 HB3 GLU 27 HB3 GLU 27 29.222 18.752 25.445
192 HG2 GLU 27 HG2 GLU 27 29.780 16.550 27.482
193 HG3 GLU 27 HG3 GLU 27 31.014 17.616 26.847
194 H CYS 28 H CYS 28 26.847 19.551 25.117
195 HA CYS 28 HA CYS 28 25.177 18.707 22.853
196 HB2 CYS 28 HB2 CYS 28 24.243 20.164 24.544
197 HB3 CYS 28 HB3 CYS 28 25.555 21.318 24.336
198 H LYS 29 H LYS 29 25.604 18.935 20.789
199 HA LYS 29 HA LYS 29 27.599 20.893 19.762
200 HB2 LYS 29 HB2 LYS 29 27.197 17.988 18.935
201 HB3 LYS 29 HB3 LYS 29 28.133 19.155 18.019
202 HG2 LYS 29 HG2 LYS 29 28.777 18.192 20.848
203 HG3 LYS 29 HG3 LYS 29 29.566 17.684 19.360
204 HD2 LYS 29 HD2 LYS 29 30.198 20.145 18.997
205 HD3 LYS 29 HD3 LYS 29 29.733 20.415 20.676
206 HE2 LYS 29 HE2 LYS 29 31.829 18.425 19.687
207 HE3 LYS 29 HE3 LYS 29 32.177 20.028 20.335
208 HZ1 LYS 29 HZ1 LYS 29 30.953 17.793 21.870
209 HZ2 LYS 29 HZ2 LYS 29 32.475 18.369 22.024
210 HZ3 LYS 29 HZ3 LYS 29 31.184 19.313 22.447
211 H CYS 30 H CYS 30 27.132 21.506 17.478
212 HA CYS 30 HA CYS 30 24.191 21.365 16.940
213 HB2 CYS 30 HB2 CYS 30 25.811 23.822 16.374
214 HB3 CYS 30 HB3 CYS 30 24.083 23.591 16.373
215 H VAL 31 H VAL 31 23.471 21.276 14.893
216 HA VAL 31 HA VAL 31 25.420 20.567 12.750
217 HB VAL 31 HB VAL 31 23.820 18.646 12.218
218 HG11 VAL 31 HG11 VAL 31 26.045 18.309 13.139
219 HG12 VAL 31 HG12 VAL 31 25.415 18.489 14.795
220 HG13 VAL 31 HG13 VAL 31 24.898 17.124 13.773
221 HG21 VAL 31 HG21 VAL 31 21.920 19.301 13.630
222 HG22 VAL 31 HG22 VAL 31 22.511 17.678 14.006
223 HG23 VAL 31 HG23 VAL 31 22.900 19.031 15.089
224 HA PRO 32 HA PRO 32 22.596 22.605 9.944
225 HB2 PRO 32 HB2 PRO 32 22.967 21.231 7.604
226 HB3 PRO 32 HB3 PRO 32 24.202 22.324 8.293
227 HG2 PRO 32 HG2 PRO 32 24.018 19.306 8.605
228 HG3 PRO 32 HG3 PRO 32 25.446 20.277 8.117
229 HD2 PRO 32 HD2 PRO 32 25.074 19.450 10.654
230 HD3 PRO 32 HD3 PRO 32 25.763 21.064 10.321
231 H TYR 33 H TYR 33 20.652 22.369 8.921
232 HA TYR 33 HA TYR 33 18.846 20.259 9.809
233 HB2 TYR 33 HB2 TYR 33 18.540 22.751 8.101
234 HB3 TYR 33 HB3 TYR 33 17.237 21.609 8.333
235 HD1 TYR 33 HD2 TYR 33 16.447 21.038 10.676
236 HD2 TYR 33 HD1 TYR 33 18.938 24.434 9.784
237 HE1 TYR 33 HE2 TYR 33 15.676 22.160 12.778
238 HE2 TYR 33 HE1 TYR 33 18.183 25.547 11.877
239 HH TYR 33 HH TYR 33 16.823 25.440 13.646
Start of MODEL 5
1 H1 GLY 1 H1 GLY 1 33.842 15.068 33.335
2 H2 GLY 1 H2 GLY 1 34.173 13.526 33.792
3 H3 GLY 1 H3 GLY 1 33.697 14.639 34.913
4 HA2 GLY 1 HA2 GLY 1 32.069 13.487 32.746
5 HA3 GLY 1 HA3 GLY 1 31.843 13.222 34.475
6 H SER 2 H SER 2 31.138 15.232 31.790
7 HA SER 2 HA SER 2 29.118 16.716 33.206
8 HB2 SER 2 HB3 SER 2 30.007 18.968 32.801
9 HB3 SER 2 HB2 SER 2 31.075 18.064 33.869
10 HG SER 2 HG SER 2 32.371 17.589 31.947
11 H ALA 3 H ALA 3 27.908 17.352 29.833
12 HA ALA 3 HA ALA 3 27.540 17.952 32.737
13 HB1 ALA 3 HB1 ALA 3 26.817 20.209 32.156
14 HB2 ALA 3 HB2 ALA 3 28.458 19.950 31.547
15 HB3 ALA 3 HB3 ALA 3 27.086 19.887 30.431
16 H PHE 4 H PHE 4 26.446 15.771 31.299
17 HA PHE 4 HA PHE 4 24.699 14.732 30.368
18 HB2 PHE 4 HB2 PHE 4 24.012 14.792 32.697
19 HB3 PHE 4 HB3 PHE 4 23.123 16.292 32.421
20 HD1 PHE 4 HD2 PHE 4 23.279 12.657 31.562
21 HD2 PHE 4 HD1 PHE 4 20.951 16.281 31.323
22 HE1 PHE 4 HE2 PHE 4 21.342 11.359 30.711
23 HE2 PHE 4 HE1 PHE 4 19.017 14.975 30.470
24 HZ PHE 4 HZ PHE 4 19.202 12.520 30.168
25 H CYS 5 H CYS 5 23.822 14.802 28.409
26 HA CYS 5 HA CYS 5 22.944 17.455 27.407
27 HB2 CYS 5 HB2 CYS 5 24.597 16.179 26.149
28 HB3 CYS 5 HB3 CYS 5 23.396 14.921 25.853
29 H ASN 6 H ASN 6 20.969 18.033 27.484
30 HA ASN 6 HA ASN 6 18.660 16.161 27.246
31 HB2 ASN 6 HB2 ASN 6 18.599 17.564 29.219
32 HB3 ASN 6 HB3 ASN 6 19.006 18.996 28.306
33 HD21 ASN 6 HD22 ASN 6 16.825 18.858 30.070
34 HD22 ASN 6 HD21 ASN 6 15.396 19.102 29.084
35 H LEU 7 H LEU 7 17.914 15.962 25.206
36 HA LEU 7 HA LEU 7 18.989 17.425 23.020
37 HB2 LEU 7 HB2 LEU 7 18.029 15.088 22.999
38 HB3 LEU 7 HB3 LEU 7 16.418 15.801 23.127
39 HG LEU 7 HG LEU 7 16.739 16.931 20.935
40 HD11 LEU 7 HD11 LEU 7 19.377 15.393 20.876
41 HD12 LEU 7 HD12 LEU 7 18.627 16.192 19.476
42 HD13 LEU 7 HD13 LEU 7 19.179 17.166 20.837
43 HD21 LEU 7 HD21 LEU 7 17.280 13.934 20.898
44 HD22 LEU 7 HD22 LEU 7 15.687 14.703 21.081
45 HD23 LEU 7 HD23 LEU 7 16.589 14.892 19.573
46 H ALA 8 H ALA 8 15.956 18.070 24.844
47 HA ALA 8 HA ALA 8 15.031 20.108 23.005
48 HB1 ALA 8 HB1 ALA 8 13.578 19.024 24.704
49 HB2 ALA 8 HB2 ALA 8 14.521 19.816 25.990
50 HB3 ALA 8 HB3 ALA 8 13.586 20.793 24.848
51 H ARG 9 H ARG 9 17.015 20.271 26.061
52 HA ARG 9 HA ARG 9 17.424 23.065 26.056
53 HB2 ARG 9 HB2 ARG 9 17.836 21.118 27.762
54 HB3 ARG 9 HB3 ARG 9 19.417 20.964 27.007
55 HG2 ARG 9 HG2 ARG 9 18.282 23.511 28.231
56 HG3 ARG 9 HG3 ARG 9 19.215 22.299 29.101
57 HD2 ARG 9 HD2 ARG 9 20.229 23.953 26.747
58 HD3 ARG 9 HD3 ARG 9 20.582 24.268 28.441
59 HE ARG 9 HE ARG 9 21.460 21.694 28.204
60 HH11 ARG 9 HH21 ARG 9 22.164 24.476 26.134
61 HH12 ARG 9 HH22 ARG 9 23.846 24.024 25.987
62 HH21 ARG 9 HH11 ARG 9 23.594 21.254 28.026
63 HH22 ARG 9 HH12 ARG 9 24.624 22.216 27.006
64 H CYS 10 H CYS 10 19.280 20.474 24.504
65 HA CYS 10 HA CYS 10 21.380 22.151 23.472
66 HB2 CYS 10 HB2 CYS 10 21.474 19.650 23.896
67 HB3 CYS 10 HB3 CYS 10 20.423 19.439 22.492
68 H GLU 11 H GLU 11 18.353 20.795 22.057
69 HA GLU 11 HA GLU 11 18.595 21.741 19.448
70 HB2 GLU 11 HB2 GLU 11 16.256 21.159 21.236
71 HB3 GLU 11 HB3 GLU 11 15.960 22.004 19.732
72 HG2 GLU 11 HG2 GLU 11 17.608 19.454 19.707
73 HG3 GLU 11 HG3 GLU 11 15.845 19.412 19.764
74 H LEU 12 H LEU 12 17.091 23.374 22.267
75 HA LEU 12 HA LEU 12 16.561 25.819 20.818
76 HB2 LEU 12 HB2 LEU 12 16.480 25.007 23.760
77 HB3 LEU 12 HB3 LEU 12 15.979 26.600 23.197
78 HG LEU 12 HG LEU 12 14.692 23.950 22.376
79 HD11 LEU 12 HD11 LEU 12 14.245 24.590 24.717
80 HD12 LEU 12 HD12 LEU 12 13.698 26.196 24.181
81 HD13 LEU 12 HD13 LEU 12 12.788 24.738 23.721
82 HD21 LEU 12 HD21 LEU 12 14.419 25.542 20.550
83 HD22 LEU 12 HD22 LEU 12 12.897 25.405 21.426
84 HD23 LEU 12 HD23 LEU 12 13.936 26.819 21.693
85 H SER 13 H SER 13 19.143 24.935 23.172
86 HA SER 13 HA SER 13 20.461 27.477 23.225
87 HB2 SER 13 HB2 SER 13 21.521 24.634 23.487
88 HB3 SER 13 HB3 SER 13 22.570 26.055 23.580
89 HG SER 13 HG SER 13 21.326 26.844 25.288
90 H CYS 14 H CYS 14 20.815 24.711 20.915
91 HA CYS 14 HA CYS 14 22.625 26.206 19.190
92 HB2 CYS 14 HB2 CYS 14 20.889 23.763 18.689
93 HB3 CYS 14 HB3 CYS 14 22.112 24.395 17.547
94 H ARG 15 H ARG 15 19.040 25.913 19.254
95 HA ARG 15 HA ARG 15 18.493 27.193 16.814
96 HB2 ARG 15 HB2 ARG 15 16.913 26.072 18.690
97 HB3 ARG 15 HB3 ARG 15 16.727 27.735 19.215
98 HG2 ARG 15 HG2 ARG 15 14.936 27.344 17.722
99 HG3 ARG 15 HG3 ARG 15 16.125 28.232 16.752
100 HD2 ARG 15 HD2 ARG 15 15.561 26.495 15.316
101 HD3 ARG 15 HD3 ARG 15 17.012 25.856 16.094
102 HE ARG 15 HE ARG 15 14.181 25.064 16.643
103 HH11 ARG 15 HH11 ARG 15 17.577 24.146 16.855
104 HH12 ARG 15 HH12 ARG 15 17.148 22.445 17.016
105 HH21 ARG 15 HH21 ARG 15 13.787 22.986 17.079
106 HH22 ARG 15 HH22 ARG 15 15.089 21.800 17.042
107 H SER 16 H SER 16 19.237 28.746 19.940
108 HA SER 16 HA SER 16 18.758 31.420 19.096
109 HB2 SER 16 HB2 SER 16 20.648 30.341 21.211
110 HB3 SER 16 HB3 SER 16 20.315 32.067 20.947
111 HG SER 16 HG SER 16 18.854 31.382 22.476
112 H LEU 17 H LEU 17 21.158 29.360 17.805
113 HA LEU 17 HA LEU 17 22.654 31.720 16.724
114 HB2 LEU 17 HB2 LEU 17 23.787 29.003 16.487
115 HB3 LEU 17 HB3 LEU 17 24.600 30.520 16.662
116 HG LEU 17 HG LEU 17 23.182 28.964 18.875
117 HD11 LEU 17 HD11 LEU 17 26.150 29.202 18.239
118 HD12 LEU 17 HD12 LEU 17 25.440 28.395 19.649
119 HD13 LEU 17 HD13 LEU 17 25.133 27.753 18.030
120 HD21 LEU 17 HD21 LEU 17 25.130 31.331 19.047
121 HD22 LEU 17 HD22 LEU 17 23.389 31.439 19.356
122 HD23 LEU 17 HD23 LEU 17 24.415 30.466 20.414
123 H GLY 18 H GLY 18 20.253 29.588 15.846
124 HA2 GLY 18 HA2 GLY 18 19.142 29.653 13.789
125 HA3 GLY 18 HA3 GLY 18 20.604 30.212 12.982
126 H LEU 19 H LEU 19 20.518 27.233 14.993
127 HA LEU 19 HA LEU 19 20.169 25.467 12.725
128 HB2 LEU 19 HB2 LEU 19 22.295 24.385 12.932
129 HB3 LEU 19 HB3 LEU 19 22.514 26.054 12.463
130 HG LEU 19 HG LEU 19 22.941 24.981 15.272
131 HD11 LEU 19 HD11 LEU 19 25.390 25.180 14.675
132 HD12 LEU 19 HD12 LEU 19 24.550 23.976 13.698
133 HD13 LEU 19 HD13 LEU 19 24.915 25.572 13.014
134 HD21 LEU 19 HD21 LEU 19 23.729 27.629 14.008
135 HD22 LEU 19 HD22 LEU 19 22.657 27.366 15.396
136 HD23 LEU 19 HD23 LEU 19 24.382 27.017 15.542
137 H LEU 20 H LEU 20 21.106 23.114 13.867
138 HA LEU 20 HA LEU 20 19.070 22.740 16.020
139 HB2 LEU 20 HB2 LEU 20 19.824 21.074 13.640
140 HB3 LEU 20 HB3 LEU 20 19.244 20.289 15.093
141 HG LEU 20 HG LEU 20 17.124 21.537 15.002
142 HD11 LEU 20 HD11 LEU 20 18.172 22.658 12.383
143 HD12 LEU 20 HD12 LEU 20 16.482 22.721 12.920
144 HD13 LEU 20 HD13 LEU 20 17.715 23.581 13.837
145 HD21 LEU 20 HD21 LEU 20 16.185 20.336 13.113
146 HD22 LEU 20 HD22 LEU 20 17.814 20.096 12.426
147 HD23 LEU 20 HD23 LEU 20 17.362 19.325 13.959
148 H GLY 21 H GLY 21 19.445 21.052 17.545
149 HA2 GLY 21 HA2 GLY 21 22.347 20.825 18.289
150 HA3 GLY 21 HA3 GLY 21 21.033 20.979 19.446
151 H LYS 22 H LYS 22 23.168 18.889 18.802
152 HA LYS 22 HA LYS 22 21.431 16.472 19.059
153 HB2 LYS 22 HB2 LYS 22 24.023 16.726 17.470
154 HB3 LYS 22 HB3 LYS 22 23.178 15.218 17.801
155 HG2 LYS 22 HG2 LYS 22 21.987 17.522 16.220
156 HG3 LYS 22 HG3 LYS 22 22.816 16.126 15.517
157 HD2 LYS 22 HD2 LYS 22 21.132 14.623 16.502
158 HD3 LYS 22 HD3 LYS 22 20.269 16.028 17.168
159 HE2 LYS 22 HE2 LYS 22 19.762 16.876 14.961
160 HE3 LYS 22 HE3 LYS 22 20.885 15.729 14.201
161 HZ1 LYS 22 HZ1 LYS 22 18.634 14.962 13.927
162 HZ2 LYS 22 HZ2 LYS 22 19.452 13.930 14.885
163 HZ3 LYS 22 HZ3 LYS 22 18.362 14.954 15.562
164 H CYS 23 H CYS 23 22.252 14.832 20.324
165 HA CYS 23 HA CYS 23 24.076 15.809 22.449
166 HB2 CYS 23 HB2 CYS 23 21.776 13.849 22.290
167 HB3 CYS 23 HB3 CYS 23 22.913 13.808 23.598
168 H ILE 24 H ILE 24 25.970 14.958 22.828
169 HA ILE 24 HA ILE 24 26.752 12.355 21.552
170 HB ILE 24 HB ILE 24 28.429 14.889 21.693
171 HG12 ILE 24 HG12 ILE 24 26.919 13.602 19.372
172 HG13 ILE 24 HG13 ILE 24 26.655 15.210 20.056
173 HG21 ILE 24 HG21 ILE 24 30.033 13.603 20.339
174 HG22 ILE 24 HG22 ILE 24 29.718 12.741 21.828
175 HG23 ILE 24 HG23 ILE 24 28.940 12.203 20.325
176 HD11 ILE 24 HD11 ILE 24 29.028 14.292 18.404
177 HD12 ILE 24 HD12 ILE 24 27.811 15.516 18.011
178 HD13 ILE 24 HD13 ILE 24 28.988 15.833 19.306
179 H GLY 25 H GLY 25 26.491 11.183 23.377
180 HA2 GLY 25 HA2 GLY 25 27.097 10.120 25.304
181 HA3 GLY 25 HA3 GLY 25 28.618 11.016 25.271
182 H GLU 26 H GLU 26 28.495 13.276 26.118
183 HA GLU 26 HA GLU 26 26.410 13.824 28.179
184 HB2 GLU 26 HB2 GLU 26 29.409 14.060 28.658
185 HB3 GLU 26 HB3 GLU 26 28.108 14.476 29.792
186 HG2 GLU 26 HG2 GLU 26 27.372 12.078 29.764
187 HG3 GLU 26 HG3 GLU 26 28.787 11.683 28.778
188 H GLU 27 H GLU 27 27.947 14.899 25.464
189 HA GLU 27 HA GLU 27 28.057 17.782 26.174
190 HB2 GLU 27 HB3 GLU 27 30.177 16.921 25.518
191 HB3 GLU 27 HB2 GLU 27 29.479 15.968 24.219
192 HG2 GLU 27 HG3 GLU 27 30.660 17.646 23.180
193 HG3 GLU 27 HG2 GLU 27 28.978 18.069 22.963
194 H CYS 28 H CYS 28 27.325 19.290 24.647
195 HA CYS 28 HA CYS 28 25.132 18.407 22.800
196 HB2 CYS 28 HB2 CYS 28 24.230 19.781 24.551
197 HB3 CYS 28 HB3 CYS 28 25.564 20.922 24.429
198 H LYS 29 H LYS 29 25.517 18.733 20.667
199 HA LYS 29 HA LYS 29 27.506 20.773 19.757
200 HB2 LYS 29 HB2 LYS 29 27.532 17.854 19.360
201 HB3 LYS 29 HB3 LYS 29 27.387 18.686 17.823
202 HG2 LYS 29 HG2 LYS 29 29.705 18.243 18.325
203 HG3 LYS 29 HG3 LYS 29 29.408 19.985 18.265
204 HD2 LYS 29 HD2 LYS 29 29.434 20.115 20.699
205 HD3 LYS 29 HD3 LYS 29 29.603 18.352 20.829
206 HE2 LYS 29 HE2 LYS 29 31.825 18.381 20.065
207 HE3 LYS 29 HE3 LYS 29 31.620 19.926 19.240
208 HZ1 LYS 29 HZ1 LYS 29 31.591 21.064 21.317
209 HZ2 LYS 29 HZ2 LYS 29 31.619 19.712 22.208
210 HZ3 LYS 29 HZ3 LYS 29 32.939 20.091 21.305
211 H CYS 30 H CYS 30 27.008 21.833 17.815
212 HA CYS 30 HA CYS 30 24.149 21.635 17.066
213 HB2 CYS 30 HB2 CYS 30 25.854 24.076 16.647
214 HB3 CYS 30 HB3 CYS 30 24.108 23.897 16.583
215 H VAL 31 H VAL 31 23.580 21.137 15.088
216 HA VAL 31 HA VAL 31 25.724 20.352 13.230
217 HB VAL 31 HB VAL 31 23.789 18.937 12.223
218 HG11 VAL 31 HG11 VAL 31 25.755 18.079 13.386
219 HG12 VAL 31 HG12 VAL 31 24.974 18.351 14.962
220 HG13 VAL 31 HG13 VAL 31 24.310 17.154 13.816
221 HG21 VAL 31 HG21 VAL 31 21.967 20.053 13.538
222 HG22 VAL 31 HG22 VAL 31 22.039 18.292 13.750
223 HG23 VAL 31 HG23 VAL 31 22.672 19.365 15.020
224 HA PRO 32 HA PRO 32 25.307 23.413 10.667
225 HB2 PRO 32 HB2 PRO 32 26.216 22.546 8.218
226 HB3 PRO 32 HB3 PRO 32 27.202 22.594 9.703
227 HG2 PRO 32 HG2 PRO 32 25.682 20.224 8.554
228 HG3 PRO 32 HG3 PRO 32 27.385 20.276 9.132
229 HD2 PRO 32 HD2 PRO 32 25.397 19.362 10.690
230 HD3 PRO 32 HD3 PRO 32 26.742 20.349 11.367
231 H TYR 33 H TYR 33 23.682 24.595 10.159
232 HA TYR 33 HA TYR 33 22.078 24.063 7.707
233 HB2 TYR 33 HB2 TYR 33 20.993 25.020 10.387
234 HB3 TYR 33 HB3 TYR 33 20.135 25.164 8.858
235 HD1 TYR 33 HD1 TYR 33 19.567 23.148 7.508
236 HD2 TYR 33 HD2 TYR 33 20.969 22.908 11.574
237 HE1 TYR 33 HE1 TYR 33 18.749 20.812 7.637
238 HE2 TYR 33 HE2 TYR 33 20.266 20.480 11.637
239 HH TYR 33 HH TYR 33 18.734 18.899 8.822
Start of MODEL 6
1 H1 GLY 1 H1 GLY 1 26.711 7.122 33.982
2 H2 GLY 1 H2 GLY 1 25.839 7.087 32.583
3 H3 GLY 1 H3 GLY 1 25.568 8.282 33.681
4 HA2 GLY 1 HA2 GLY 1 28.025 7.906 32.112
5 HA3 GLY 1 HA3 GLY 1 26.813 9.165 31.861
6 H SER 2 H SER 2 29.440 9.841 32.229
7 HA SER 2 HA SER 2 29.855 10.827 34.983
8 HB2 SER 2 HB2 SER 2 31.590 12.291 33.498
9 HB3 SER 2 HB3 SER 2 31.931 10.695 34.146
10 HG SER 2 HG SER 2 30.861 11.144 31.519
11 H ALA 3 H ALA 3 28.425 11.974 32.003
12 HA ALA 3 HA ALA 3 26.917 13.961 33.488
13 HB1 ALA 3 HB1 ALA 3 28.565 14.661 31.007
14 HB2 ALA 3 HB2 ALA 3 27.402 15.738 31.813
15 HB3 ALA 3 HB3 ALA 3 28.884 15.257 32.649
16 H PHE 4 H PHE 4 25.262 14.873 31.766
17 HA PHE 4 HA PHE 4 24.687 13.074 29.543
18 HB2 PHE 4 HB2 PHE 4 22.426 12.649 30.064
19 HB3 PHE 4 HB3 PHE 4 23.374 12.120 31.424
20 HD1 PHE 4 HD1 PHE 4 23.607 13.885 33.425
21 HD2 PHE 4 HD2 PHE 4 20.477 13.920 30.460
22 HE1 PHE 4 HE1 PHE 4 22.174 15.208 34.966
23 HE2 PHE 4 HE2 PHE 4 19.018 15.204 32.012
24 HZ PHE 4 HZ PHE 4 19.877 15.857 34.258
25 H CYS 5 H CYS 5 23.867 14.054 27.886
26 HA CYS 5 HA CYS 5 23.472 16.987 27.867
27 HB2 CYS 5 HB2 CYS 5 24.898 16.100 26.193
28 HB3 CYS 5 HB3 CYS 5 23.745 14.859 25.734
29 H ASN 6 H ASN 6 21.497 17.977 27.388
30 HA ASN 6 HA ASN 6 19.069 16.207 27.293
31 HB2 ASN 6 HB2 ASN 6 19.188 17.678 29.306
32 HB3 ASN 6 HB3 ASN 6 19.276 19.084 28.262
33 HD21 ASN 6 HD22 ASN 6 17.192 16.313 29.230
34 HD22 ASN 6 HD21 ASN 6 15.705 17.123 28.721
35 H LEU 7 H LEU 7 18.302 16.026 25.295
36 HA LEU 7 HA LEU 7 19.290 17.694 23.143
37 HB2 LEU 7 HB2 LEU 7 18.717 15.267 22.952
38 HB3 LEU 7 HB3 LEU 7 17.013 15.668 23.171
39 HG LEU 7 HG LEU 7 17.020 16.984 21.079
40 HD11 LEU 7 HD11 LEU 7 19.309 17.817 20.946
41 HD12 LEU 7 HD12 LEU 7 19.952 16.154 20.898
42 HD13 LEU 7 HD13 LEU 7 19.003 16.800 19.543
43 HD21 LEU 7 HD21 LEU 7 18.271 14.235 20.726
44 HD22 LEU 7 HD22 LEU 7 16.542 14.565 20.998
45 HD23 LEU 7 HD23 LEU 7 17.339 15.153 19.518
46 H ALA 8 H ALA 8 16.271 17.787 25.050
47 HA ALA 8 HA ALA 8 14.965 19.681 23.349
48 HB1 ALA 8 HB1 ALA 8 13.774 18.420 25.072
49 HB2 ALA 8 HB2 ALA 8 14.702 19.242 26.342
50 HB3 ALA 8 HB3 ALA 8 13.581 20.169 25.334
51 H ARG 9 H ARG 9 17.193 20.211 26.187
52 HA ARG 9 HA ARG 9 17.199 23.045 26.030
53 HB2 ARG 9 HB2 ARG 9 17.862 21.242 27.872
54 HB3 ARG 9 HB3 ARG 9 19.437 21.290 27.087
55 HG2 ARG 9 HG2 ARG 9 19.333 23.791 27.370
56 HG3 ARG 9 HG3 ARG 9 17.886 23.586 28.361
57 HD2 ARG 9 HD2 ARG 9 19.809 23.784 29.857
58 HD3 ARG 9 HD3 ARG 9 19.159 22.153 29.949
59 HE ARG 9 HE ARG 9 21.201 21.344 29.229
60 HH11 ARG 9 HH11 ARG 9 21.204 24.778 28.427
61 HH12 ARG 9 HH12 ARG 9 22.709 24.626 27.534
62 HH21 ARG 9 HH21 ARG 9 22.953 21.239 27.860
63 HH22 ARG 9 HH22 ARG 9 23.746 22.711 27.365
64 H CYS 10 H CYS 10 19.203 20.580 24.511
65 HA CYS 10 HA CYS 10 21.256 22.323 23.475
66 HB2 CYS 10 HB2 CYS 10 21.477 19.843 23.946
67 HB3 CYS 10 HB3 CYS 10 20.437 19.562 22.544
68 H GLU 11 H GLU 11 18.281 20.832 22.094
69 HA GLU 11 HA GLU 11 18.476 21.907 19.494
70 HB2 GLU 11 HB2 GLU 11 16.166 21.050 21.206
71 HB3 GLU 11 HB3 GLU 11 15.863 21.853 19.673
72 HG2 GLU 11 HG2 GLU 11 17.823 19.534 19.735
73 HG3 GLU 11 HG3 GLU 11 16.095 19.228 19.800
74 H LEU 12 H LEU 12 16.810 23.340 22.401
75 HA LEU 12 HA LEU 12 16.277 25.872 21.194
76 HB2 LEU 12 HB2 LEU 12 16.769 25.033 24.078
77 HB3 LEU 12 HB3 LEU 12 16.330 26.678 23.644
78 HG LEU 12 HG LEU 12 14.618 24.245 22.998
79 HD11 LEU 12 HD11 LEU 12 14.795 24.592 25.422
80 HD12 LEU 12 HD12 LEU 12 14.364 26.307 25.233
81 HD13 LEU 12 HD13 LEU 12 13.185 25.037 24.847
82 HD21 LEU 12 HD21 LEU 12 14.032 27.239 22.864
83 HD22 LEU 12 HD22 LEU 12 14.126 26.115 21.486
84 HD23 LEU 12 HD23 LEU 12 12.829 25.948 22.661
85 H SER 13 H SER 13 19.198 24.780 22.930
86 HA SER 13 HA SER 13 20.556 27.291 22.967
87 HB2 SER 13 HB2 SER 13 21.743 24.489 22.906
88 HB3 SER 13 HB3 SER 13 22.610 25.979 23.307
89 HG SER 13 HG SER 13 20.405 24.833 24.695
90 H CYS 14 H CYS 14 20.828 24.571 20.606
91 HA CYS 14 HA CYS 14 22.629 26.081 18.872
92 HB2 CYS 14 HB2 CYS 14 20.979 23.570 18.416
93 HB3 CYS 14 HB3 CYS 14 22.162 24.217 17.245
94 H ARG 15 H ARG 15 19.096 25.555 18.816
95 HA ARG 15 HA ARG 15 18.619 26.890 16.330
96 HB2 ARG 15 HB2 ARG 15 17.286 25.200 17.547
97 HB3 ARG 15 HB3 ARG 15 16.731 26.453 18.671
98 HG2 ARG 15 HG2 ARG 15 15.577 27.570 16.798
99 HG3 ARG 15 HG3 ARG 15 16.241 26.384 15.655
100 HD2 ARG 15 HD2 ARG 15 14.470 25.695 18.049
101 HD3 ARG 15 HD3 ARG 15 13.876 25.849 16.408
102 HE ARG 15 HE ARG 15 15.694 23.713 17.456
103 HH11 ARG 15 HH11 ARG 15 13.863 24.814 14.619
104 HH12 ARG 15 HH12 ARG 15 13.889 23.181 13.966
105 HH21 ARG 15 HH21 ARG 15 15.860 21.798 16.324
106 HH22 ARG 15 HH22 ARG 15 14.878 21.634 14.855
107 H SER 16 H SER 16 19.069 28.160 19.570
108 HA SER 16 HA SER 16 18.286 30.884 19.056
109 HB2 SER 16 HB2 SER 16 20.464 29.854 20.917
110 HB3 SER 16 HB3 SER 16 19.740 31.465 20.931
111 HG SER 16 HG SER 16 18.414 29.010 21.462
112 H LEU 17 H LEU 17 20.979 29.060 17.815
113 HA LEU 17 HA LEU 17 22.276 31.522 16.749
114 HB2 LEU 17 HB2 LEU 17 23.588 28.925 16.341
115 HB3 LEU 17 HB3 LEU 17 24.281 30.474 16.718
116 HG LEU 17 HG LEU 17 22.928 28.607 18.707
117 HD11 LEU 17 HD11 LEU 17 25.886 29.070 18.190
118 HD12 LEU 17 HD12 LEU 17 25.175 28.042 19.455
119 HD13 LEU 17 HD13 LEU 17 24.960 27.612 17.755
120 HD21 LEU 17 HD21 LEU 17 24.718 31.037 19.176
121 HD22 LEU 17 HD22 LEU 17 22.972 30.997 19.465
122 HD23 LEU 17 HD23 LEU 17 24.045 29.976 20.429
123 H GLY 18 H GLY 18 19.926 29.436 15.853
124 HA2 GLY 18 HA2 GLY 18 18.792 29.373 13.852
125 HA3 GLY 18 HA3 GLY 18 20.144 30.152 13.040
126 H LEU 19 H LEU 19 20.576 27.113 14.850
127 HA LEU 19 HA LEU 19 20.289 25.436 12.474
128 HB2 LEU 19 HB2 LEU 19 22.454 24.499 12.539
129 HB3 LEU 19 HB3 LEU 19 22.594 26.217 12.258
130 HG LEU 19 HG LEU 19 23.068 24.903 14.955
131 HD11 LEU 19 HD11 LEU 19 25.045 25.602 12.728
132 HD12 LEU 19 HD12 LEU 19 25.513 25.109 14.365
133 HD13 LEU 19 HD13 LEU 19 24.655 23.975 13.315
134 HD21 LEU 19 HD21 LEU 19 22.755 27.303 15.135
135 HD22 LEU 19 HD22 LEU 19 24.451 26.921 15.389
136 HD23 LEU 19 HD23 LEU 19 23.924 27.602 13.831
137 H LEU 20 H LEU 20 21.267 23.047 13.311
138 HA LEU 20 HA LEU 20 19.030 22.341 15.093
139 HB2 LEU 20 HB2 LEU 20 19.406 21.371 12.778
140 HB3 LEU 20 HB3 LEU 20 20.883 20.657 13.374
141 HG LEU 20 HG LEU 20 19.479 19.360 15.068
142 HD11 LEU 20 HD11 LEU 20 17.217 20.269 13.222
143 HD12 LEU 20 HD12 LEU 20 17.105 19.070 14.529
144 HD13 LEU 20 HD13 LEU 20 17.427 20.764 14.914
145 HD21 LEU 20 HD21 LEU 20 18.770 17.704 13.397
146 HD22 LEU 20 HD22 LEU 20 18.972 18.906 12.101
147 HD23 LEU 20 HD23 LEU 20 20.380 18.338 13.018
148 H GLY 21 H GLY 21 19.221 21.206 17.034
149 HA2 GLY 21 HA2 GLY 21 21.948 21.004 18.233
150 HA3 GLY 21 HA3 GLY 21 20.426 20.897 19.096
151 H LYS 22 H LYS 22 22.946 19.152 18.782
152 HA LYS 22 HA LYS 22 21.487 16.563 18.900
153 HB2 LYS 22 HB2 LYS 22 24.151 17.097 17.504
154 HB3 LYS 22 HB3 LYS 22 23.515 15.490 17.849
155 HG2 LYS 22 HG2 LYS 22 22.157 17.531 16.051
156 HG3 LYS 22 HG3 LYS 22 23.186 16.193 15.514
157 HD2 LYS 22 HD2 LYS 22 21.623 14.578 16.505
158 HD3 LYS 22 HD3 LYS 22 20.557 15.902 17.023
159 HE2 LYS 22 HE2 LYS 22 20.110 16.563 14.755
160 HE3 LYS 22 HE3 LYS 22 21.391 15.525 14.119
161 HZ1 LYS 22 HZ1 LYS 22 18.928 14.514 15.431
162 HZ2 LYS 22 HZ2 LYS 22 19.200 14.544 13.805
163 HZ3 LYS 22 HZ3 LYS 22 20.125 13.594 14.783
164 H CYS 23 H CYS 23 22.358 15.031 20.284
165 HA CYS 23 HA CYS 23 24.277 16.037 22.338
166 HB2 CYS 23 HB2 CYS 23 22.030 14.006 22.280
167 HB3 CYS 23 HB3 CYS 23 23.262 13.973 23.496
168 H ILE 24 H ILE 24 26.332 15.360 22.010
169 HA ILE 24 HA ILE 24 26.881 12.621 20.968
170 HB ILE 24 HB ILE 24 28.113 15.133 19.778
171 HG12 ILE 24 HG12 ILE 24 26.061 13.253 18.533
172 HG13 ILE 24 HG13 ILE 24 25.779 14.921 19.031
173 HG21 ILE 24 HG21 ILE 24 29.207 13.580 18.212
174 HG22 ILE 24 HG22 ILE 24 29.620 13.120 19.845
175 HG23 ILE 24 HG23 ILE 24 28.384 12.195 18.963
176 HD11 ILE 24 HD11 ILE 24 27.474 15.705 17.379
177 HD12 ILE 24 HD12 ILE 24 27.552 14.037 16.751
178 HD13 ILE 24 HD13 ILE 24 26.033 14.937 16.677
179 H GLY 25 H GLY 25 27.912 11.783 22.672
180 HA2 GLY 25 HA2 GLY 25 29.826 11.249 23.884
181 HA3 GLY 25 HA3 GLY 25 30.607 12.744 23.363
182 H GLU 26 H GLU 26 27.626 11.972 25.192
183 HA GLU 26 HA GLU 26 26.636 12.851 27.017
184 HB2 GLU 26 HB2 GLU 26 29.422 13.243 28.140
185 HB3 GLU 26 HB3 GLU 26 27.914 13.261 29.047
186 HG2 GLU 26 HG2 GLU 26 27.510 10.888 28.377
187 HG3 GLU 26 HG3 GLU 26 29.114 10.855 27.635
188 H GLU 27 H GLU 27 27.825 14.811 24.857
189 HA GLU 27 HA GLU 27 27.397 17.373 26.337
190 HB2 GLU 27 HB2 GLU 27 29.681 16.388 24.614
191 HB3 GLU 27 HB3 GLU 27 29.232 18.078 24.522
192 HG2 GLU 27 HG2 GLU 27 29.456 18.273 27.007
193 HG3 GLU 27 HG3 GLU 27 30.008 16.594 27.064
194 H CYS 28 H CYS 28 26.768 19.198 25.091
195 HA CYS 28 HA CYS 28 24.973 18.578 22.848
196 HB2 CYS 28 HB2 CYS 28 24.176 20.013 24.631
197 HB3 CYS 28 HB3 CYS 28 25.571 21.078 24.455
198 H LYS 29 H LYS 29 25.340 19.026 20.744
199 HA LYS 29 HA LYS 29 27.461 20.907 19.908
200 HB2 LYS 29 HB2 LYS 29 28.195 18.359 19.997
201 HB3 LYS 29 HB3 LYS 29 27.169 18.203 18.571
202 HG2 LYS 29 HG2 LYS 29 29.306 18.580 17.699
203 HG3 LYS 29 HG3 LYS 29 28.552 20.170 17.589
204 HD2 LYS 29 HD2 LYS 29 29.718 20.785 19.773
205 HD3 LYS 29 HD3 LYS 29 30.487 19.190 19.735
206 HE2 LYS 29 HE2 LYS 29 31.417 19.793 17.453
207 HE3 LYS 29 HE3 LYS 29 30.815 21.436 17.702
208 HZ1 LYS 29 HZ1 LYS 29 33.139 21.174 18.344
209 HZ2 LYS 29 HZ2 LYS 29 32.248 21.576 19.687
210 HZ3 LYS 29 HZ3 LYS 29 32.774 20.030 19.439
211 H CYS 30 H CYS 30 27.044 21.938 17.925
212 HA CYS 30 HA CYS 30 24.281 21.513 16.915
213 HB2 CYS 30 HB2 CYS 30 25.891 23.957 16.318
214 HB3 CYS 30 HB3 CYS 30 24.161 23.694 16.278
215 H VAL 31 H VAL 31 23.744 21.325 14.812
216 HA VAL 31 HA VAL 31 25.854 21.079 12.727
217 HB VAL 31 HB VAL 31 24.509 19.069 11.844
218 HG11 VAL 31 HG11 VAL 31 25.792 17.471 13.149
219 HG12 VAL 31 HG12 VAL 31 26.778 18.879 12.707
220 HG13 VAL 31 HG13 VAL 31 26.146 18.713 14.366
221 HG21 VAL 31 HG21 VAL 31 23.363 17.666 13.421
222 HG22 VAL 31 HG22 VAL 31 23.624 18.842 14.729
223 HG23 VAL 31 HG23 VAL 31 22.575 19.249 13.351
224 HA PRO 32 HA PRO 32 22.929 23.300 10.225
225 HB2 PRO 32 HB2 PRO 32 23.321 22.273 7.714
226 HB3 PRO 32 HB3 PRO 32 24.495 23.348 8.526
227 HG2 PRO 32 HG2 PRO 32 24.523 20.310 8.409
228 HG3 PRO 32 HG3 PRO 32 25.866 21.446 8.055
229 HD2 PRO 32 HD2 PRO 32 25.600 20.245 10.441
230 HD3 PRO 32 HD3 PRO 32 26.167 21.945 10.355
231 H TYR 33 H TYR 33 20.930 23.109 9.197
232 HA TYR 33 HA TYR 33 19.274 20.786 9.820
233 HB2 TYR 33 HB2 TYR 33 18.666 23.088 7.934
234 HB3 TYR 33 HB3 TYR 33 17.510 21.956 8.595
235 HD1 TYR 33 HD2 TYR 33 17.639 21.893 11.382
236 HD2 TYR 33 HD1 TYR 33 18.460 25.214 8.782
237 HE1 TYR 33 HE2 TYR 33 17.090 23.490 13.237
238 HE2 TYR 33 HE1 TYR 33 17.860 26.796 10.603
239 HH TYR 33 HH TYR 33 17.090 27.039 12.698
Start of MODEL 7
1 H1 GLY 1 H1 GLY 1 31.244 8.986 28.213
2 H2 GLY 1 H2 GLY 1 29.991 9.704 29.011
3 H3 GLY 1 H3 GLY 1 31.480 9.610 29.713
4 HA2 GLY 1 HA2 GLY 1 32.385 11.012 27.931
5 HA3 GLY 1 HA3 GLY 1 30.701 11.248 27.401
6 H SER 2 H SER 2 30.302 13.371 27.952
7 HA SER 2 HA SER 2 31.440 14.532 30.384
8 HB2 SER 2 HB2 SER 2 29.649 15.767 28.270
9 HB3 SER 2 HB3 SER 2 30.544 16.634 29.532
10 HG SER 2 HG SER 2 31.928 16.753 27.969
11 H ALA 3 H ALA 3 28.817 12.672 30.205
12 HA ALA 3 HA ALA 3 26.953 12.324 31.267
13 HB1 ALA 3 HB1 ALA 3 28.351 13.739 33.559
14 HB2 ALA 3 HB2 ALA 3 27.123 12.461 33.688
15 HB3 ALA 3 HB3 ALA 3 28.711 12.092 33.002
16 H PHE 4 H PHE 4 26.989 15.356 30.195
17 HA PHE 4 HA PHE 4 24.347 16.022 31.408
18 HB2 PHE 4 HB2 PHE 4 26.862 17.695 31.607
19 HB3 PHE 4 HB3 PHE 4 25.263 18.403 31.727
20 HD1 PHE 4 HD1 PHE 4 23.632 17.634 33.495
21 HD2 PHE 4 HD2 PHE 4 27.840 16.689 33.589
22 HE1 PHE 4 HE1 PHE 4 23.494 17.256 35.947
23 HE2 PHE 4 HE2 PHE 4 27.704 16.349 36.043
24 HZ PHE 4 HZ PHE 4 25.535 16.628 37.226
25 H CYS 5 H CYS 5 23.760 15.320 29.167
26 HA CYS 5 HA CYS 5 23.176 17.925 27.885
27 HB2 CYS 5 HB2 CYS 5 24.951 16.882 26.593
28 HB3 CYS 5 HB3 CYS 5 23.947 15.462 26.294
29 H ASN 6 H ASN 6 21.152 18.208 27.202
30 HA ASN 6 HA ASN 6 19.261 15.923 27.028
31 HB2 ASN 6 HB2 ASN 6 18.625 17.110 29.073
32 HB3 ASN 6 HB3 ASN 6 18.746 18.664 28.271
33 HD21 ASN 6 HD22 ASN 6 16.803 15.664 28.453
34 HD22 ASN 6 HD21 ASN 6 15.399 16.379 27.651
35 H LEU 7 H LEU 7 18.385 15.807 25.037
36 HA LEU 7 HA LEU 7 19.259 17.451 22.914
37 HB2 LEU 7 HB2 LEU 7 18.426 15.081 22.841
38 HB3 LEU 7 HB3 LEU 7 16.791 15.693 23.105
39 HG LEU 7 HG LEU 7 16.812 16.842 20.945
40 HD11 LEU 7 HD11 LEU 7 19.198 17.385 20.675
41 HD12 LEU 7 HD12 LEU 7 19.610 15.648 20.632
42 HD13 LEU 7 HD13 LEU 7 18.654 16.389 19.328
43 HD21 LEU 7 HD21 LEU 7 16.117 14.457 21.145
44 HD22 LEU 7 HD22 LEU 7 16.799 14.831 19.562
45 HD23 LEU 7 HD23 LEU 7 17.774 13.948 20.752
46 H ALA 8 H ALA 8 16.157 17.846 24.761
47 HA ALA 8 HA ALA 8 15.245 19.912 22.950
48 HB1 ALA 8 HB1 ALA 8 13.743 18.599 24.405
49 HB2 ALA 8 HB2 ALA 8 14.471 19.378 25.831
50 HB3 ALA 8 HB3 ALA 8 13.567 20.349 24.656
51 H ARG 9 H ARG 9 17.114 20.059 26.093
52 HA ARG 9 HA ARG 9 17.382 22.853 26.232
53 HB2 ARG 9 HB2 ARG 9 17.908 20.914 27.842
54 HB3 ARG 9 HB3 ARG 9 19.437 20.709 27.007
55 HG2 ARG 9 HG2 ARG 9 18.753 23.473 27.888
56 HG3 ARG 9 HG3 ARG 9 18.998 22.286 29.161
57 HD2 ARG 9 HD2 ARG 9 21.047 22.664 26.937
58 HD3 ARG 9 HD3 ARG 9 21.047 23.677 28.383
59 HE ARG 9 HE ARG 9 21.099 21.390 29.639
60 HH11 ARG 9 HH11 ARG 9 23.197 22.298 26.904
61 HH12 ARG 9 HH12 ARG 9 24.366 21.084 27.403
62 HH21 ARG 9 HH21 ARG 9 22.698 20.015 30.151
63 HH22 ARG 9 HH22 ARG 9 24.193 20.042 29.239
64 H CYS 10 H CYS 10 19.221 20.481 24.411
65 HA CYS 10 HA CYS 10 21.291 22.315 23.509
66 HB2 CYS 10 HB2 CYS 10 21.558 19.825 23.867
67 HB3 CYS 10 HB3 CYS 10 20.550 19.579 22.441
68 H GLU 11 H GLU 11 18.305 20.883 22.079
69 HA GLU 11 HA GLU 11 18.677 21.950 19.490
70 HB2 GLU 11 HB2 GLU 11 16.247 21.024 21.023
71 HB3 GLU 11 HB3 GLU 11 16.062 21.829 19.462
72 HG2 GLU 11 HG2 GLU 11 17.522 20.215 18.363
73 HG3 GLU 11 HG3 GLU 11 17.847 19.393 19.876
74 H LEU 12 H LEU 12 16.921 23.295 22.316
75 HA LEU 12 HA LEU 12 16.282 25.841 21.249
76 HB2 LEU 12 HB2 LEU 12 15.446 24.733 23.339
77 HB3 LEU 12 HB3 LEU 12 16.996 25.019 24.103
78 HG LEU 12 HG LEU 12 16.657 27.483 23.896
79 HD11 LEU 12 HD11 LEU 12 14.365 28.329 23.407
80 HD12 LEU 12 HD12 LEU 12 15.126 27.615 21.983
81 HD13 LEU 12 HD13 LEU 12 13.890 26.698 22.880
82 HD21 LEU 12 HD21 LEU 12 14.964 27.647 25.655
83 HD22 LEU 12 HD22 LEU 12 14.384 26.010 25.284
84 HD23 LEU 12 HD23 LEU 12 16.015 26.255 25.945
85 H SER 13 H SER 13 19.173 24.743 23.016
86 HA SER 13 HA SER 13 20.522 27.275 23.162
87 HB2 SER 13 HB2 SER 13 21.718 24.473 23.022
88 HB3 SER 13 HB3 SER 13 22.615 25.953 23.386
89 HG SER 13 HG SER 13 20.448 24.854 24.866
90 H CYS 14 H CYS 14 20.877 24.615 20.738
91 HA CYS 14 HA CYS 14 22.634 26.154 19.049
92 HB2 CYS 14 HB2 CYS 14 20.879 23.767 18.437
93 HB3 CYS 14 HB3 CYS 14 22.168 24.388 17.380
94 H ARG 15 H ARG 15 19.025 25.869 19.035
95 HA ARG 15 HA ARG 15 18.535 27.384 16.707
96 HB2 ARG 15 HB2 ARG 15 16.817 26.146 18.022
97 HB3 ARG 15 HB3 ARG 15 16.885 27.393 19.279
98 HG2 ARG 15 HG2 ARG 15 16.182 29.097 17.586
99 HG3 ARG 15 HG3 ARG 15 16.120 27.830 16.363
100 HD2 ARG 15 HD2 ARG 15 14.407 28.013 18.884
101 HD3 ARG 15 HD3 ARG 15 13.887 28.473 17.267
102 HE ARG 15 HE ARG 15 13.834 25.862 18.410
103 HH11 ARG 15 HH11 ARG 15 14.291 27.410 15.266
104 HH12 ARG 15 HH12 ARG 15 13.899 25.954 14.399
105 HH21 ARG 15 HH22 ARG 15 13.270 24.045 17.208
106 HH22 ARG 15 HH21 ARG 15 13.373 24.119 15.461
107 H SER 16 H SER 16 19.252 28.587 19.994
108 HA SER 16 HA SER 16 18.916 31.345 19.399
109 HB2 SER 16 HB2 SER 16 19.958 31.828 21.421
110 HB3 SER 16 HB3 SER 16 19.168 30.270 21.686
111 HG SER 16 HG SER 16 21.270 29.287 21.276
112 H LEU 17 H LEU 17 21.465 29.262 18.279
113 HA LEU 17 HA LEU 17 23.149 31.600 17.519
114 HB2 LEU 17 HB2 LEU 17 23.984 28.775 17.038
115 HB3 LEU 17 HB3 LEU 17 24.972 30.189 17.326
116 HG LEU 17 HG LEU 17 23.371 28.603 19.347
117 HD11 LEU 17 HD11 LEU 17 25.372 27.451 18.533
118 HD12 LEU 17 HD12 LEU 17 26.369 28.861 18.967
119 HD13 LEU 17 HD13 LEU 17 25.547 27.924 20.232
120 HD21 LEU 17 HD21 LEU 17 25.305 30.938 19.819
121 HD22 LEU 17 HD22 LEU 17 23.549 31.016 20.059
122 HD23 LEU 17 HD23 LEU 17 24.529 29.969 21.090
123 H GLY 18 H GLY 18 20.738 29.612 16.226
124 HA2 GLY 18 HA2 GLY 18 19.753 30.158 14.122
125 HA3 GLY 18 HA3 GLY 18 21.334 30.527 13.447
126 H LEU 19 H LEU 19 20.946 27.478 15.242
127 HA LEU 19 HA LEU 19 20.438 25.925 12.808
128 HB2 LEU 19 HB2 LEU 19 22.493 24.773 12.776
129 HB3 LEU 19 HB3 LEU 19 22.833 26.479 12.654
130 HG LEU 19 HG LEU 19 23.092 24.916 15.244
131 HD11 LEU 19 HD11 LEU 19 25.160 25.602 13.101
132 HD12 LEU 19 HD12 LEU 19 25.565 24.922 14.679
133 HD13 LEU 19 HD13 LEU 19 24.600 23.976 13.532
134 HD21 LEU 19 HD21 LEU 19 23.037 27.278 15.718
135 HD22 LEU 19 HD22 LEU 19 24.688 26.721 15.887
136 HD23 LEU 19 HD23 LEU 19 24.212 27.619 14.426
137 H LEU 20 H LEU 20 21.194 23.392 13.650
138 HA LEU 20 HA LEU 20 19.060 22.927 15.665
139 HB2 LEU 20 HB2 LEU 20 18.907 22.045 13.294
140 HB3 LEU 20 HB3 LEU 20 20.318 21.057 13.639
141 HG LEU 20 HG LEU 20 19.069 19.776 15.317
142 HD11 LEU 20 HD11 LEU 20 16.685 21.530 14.558
143 HD12 LEU 20 HD12 LEU 20 16.614 20.063 15.554
144 HD13 LEU 20 HD13 LEU 20 17.473 21.482 16.150
145 HD21 LEU 20 HD21 LEU 20 19.002 19.092 12.936
146 HD22 LEU 20 HD22 LEU 20 17.520 18.651 13.796
147 HD23 LEU 20 HD23 LEU 20 17.522 20.050 12.706
148 H GLY 21 H GLY 21 19.370 21.090 17.203
149 HA2 GLY 21 HA2 GLY 21 22.222 20.864 18.105
150 HA3 GLY 21 HA3 GLY 21 20.861 21.013 19.198
151 H LYS 22 H LYS 22 23.027 19.026 18.831
152 HA LYS 22 HA LYS 22 21.382 16.583 19.268
153 HB2 LYS 22 HB2 LYS 22 24.041 16.795 17.779
154 HB3 LYS 22 HB3 LYS 22 23.287 15.276 18.261
155 HG2 LYS 22 HG2 LYS 22 22.033 17.283 16.349
156 HG3 LYS 22 HG3 LYS 22 22.965 15.872 15.872
157 HD2 LYS 22 HD2 LYS 22 21.335 14.381 16.947
158 HD3 LYS 22 HD3 LYS 22 20.367 15.792 17.461
159 HE2 LYS 22 HE2 LYS 22 19.822 16.391 15.234
160 HE3 LYS 22 HE3 LYS 22 21.118 15.411 14.558
161 HZ1 LYS 22 HZ1 LYS 22 18.697 14.291 15.854
162 HZ2 LYS 22 HZ2 LYS 22 18.958 14.398 14.234
163 HZ3 LYS 22 HZ3 LYS 22 19.907 13.418 15.148
164 H CYS 23 H CYS 23 22.293 15.105 20.752
165 HA CYS 23 HA CYS 23 24.291 16.228 22.658
166 HB2 CYS 23 HB2 CYS 23 22.077 14.159 22.827
167 HB3 CYS 23 HB3 CYS 23 23.366 14.240 23.985
168 H ILE 24 H ILE 24 26.300 15.544 22.270
169 HA ILE 24 HA ILE 24 26.812 12.793 21.187
170 HB ILE 24 HB ILE 24 28.174 15.393 20.405
171 HG12 ILE 24 HG12 ILE 24 26.031 15.212 19.273
172 HG13 ILE 24 HG13 ILE 24 27.376 15.033 18.165
173 HG21 ILE 24 HG21 ILE 24 29.844 13.629 20.466
174 HG22 ILE 24 HG22 ILE 24 28.791 12.533 19.549
175 HG23 ILE 24 HG23 ILE 24 29.458 13.990 18.786
176 HD11 ILE 24 HD11 ILE 24 25.525 13.493 17.649
177 HD12 ILE 24 HD12 ILE 24 27.018 12.614 18.018
178 HD13 ILE 24 HD13 ILE 24 25.712 12.708 19.221
179 H GLY 25 H GLY 25 27.987 11.646 22.542
180 HA2 GLY 25 HA2 GLY 25 29.248 11.048 24.378
181 HA3 GLY 25 HA3 GLY 25 30.281 12.440 24.020
182 H GLU 26 H GLU 26 26.856 12.213 25.092
183 HA GLU 26 HA GLU 26 25.627 13.583 26.385
184 HB2 GLU 26 HB2 GLU 26 27.628 13.151 28.529
185 HB3 GLU 26 HB3 GLU 26 25.878 13.305 28.657
186 HG2 GLU 26 HG2 GLU 26 25.913 11.068 28.861
187 HG3 GLU 26 HG3 GLU 26 26.032 11.045 27.115
188 H GLU 27 H GLU 27 27.690 15.191 24.882
189 HA GLU 27 HA GLU 27 27.286 17.666 26.474
190 HB2 GLU 27 HB2 GLU 27 29.645 16.875 26.281
191 HB3 GLU 27 HB3 GLU 27 29.461 16.852 24.528
192 HG2 GLU 27 HG2 GLU 27 30.716 18.718 25.287
193 HG3 GLU 27 HG3 GLU 27 29.272 19.237 24.429
194 H CYS 28 H CYS 28 26.713 19.516 25.206
195 HA CYS 28 HA CYS 28 24.965 18.889 22.962
196 HB2 CYS 28 HB2 CYS 28 24.303 20.476 24.673
197 HB3 CYS 28 HB3 CYS 28 25.686 21.504 24.311
198 H LYS 29 H LYS 29 25.245 19.215 20.870
199 HA LYS 29 HA LYS 29 27.630 20.555 19.696
200 HB2 LYS 29 HB2 LYS 29 28.012 18.117 20.300
201 HB3 LYS 29 HB3 LYS 29 26.708 17.665 19.213
202 HG2 LYS 29 HG2 LYS 29 29.163 19.205 18.284
203 HG3 LYS 29 HG3 LYS 29 29.161 17.455 18.492
204 HD2 LYS 29 HD2 LYS 29 27.138 17.397 16.890
205 HD3 LYS 29 HD3 LYS 29 27.573 19.074 16.475
206 HE2 LYS 29 HE2 LYS 29 29.868 18.317 15.890
207 HE3 LYS 29 HE3 LYS 29 29.441 16.655 16.334
208 HZ1 LYS 29 HZ1 LYS 29 28.323 18.239 14.104
209 HZ2 LYS 29 HZ2 LYS 29 29.239 16.901 13.968
210 HZ3 LYS 29 HZ3 LYS 29 27.714 16.761 14.574
211 H CYS 30 H CYS 30 27.058 21.654 17.812
212 HA CYS 30 HA CYS 30 24.203 21.366 16.986
213 HB2 CYS 30 HB2 CYS 30 25.905 23.793 16.550
214 HB3 CYS 30 HB3 CYS 30 24.181 23.612 16.432
215 H VAL 31 H VAL 31 23.509 21.475 14.954
216 HA VAL 31 HA VAL 31 25.400 20.938 12.705
217 HB VAL 31 HB VAL 31 23.763 19.083 12.002
218 HG11 VAL 31 HG11 VAL 31 25.472 18.617 14.485
219 HG12 VAL 31 HG12 VAL 31 24.902 17.403 13.315
220 HG13 VAL 31 HG13 VAL 31 26.025 18.651 12.790
221 HG21 VAL 31 HG21 VAL 31 21.940 19.538 13.586
222 HG22 VAL 31 HG22 VAL 31 22.557 17.903 13.753
223 HG23 VAL 31 HG23 VAL 31 22.986 19.127 14.965
224 HA PRO 32 HA PRO 32 22.411 23.267 10.295
225 HB2 PRO 32 HB2 PRO 32 22.625 22.113 7.815
226 HB3 PRO 32 HB3 PRO 32 23.875 23.186 8.509
227 HG2 PRO 32 HG2 PRO 32 23.824 20.154 8.511
228 HG3 PRO 32 HG3 PRO 32 25.185 21.239 8.064
229 HD2 PRO 32 HD2 PRO 32 24.945 20.086 10.510
230 HD3 PRO 32 HD3 PRO 32 25.626 21.725 10.330
231 H TYR 33 H TYR 33 20.297 23.102 9.787
232 HA TYR 33 HA TYR 33 18.677 21.074 10.845
233 HB2 TYR 33 HB2 TYR 33 17.863 22.909 8.570
234 HB3 TYR 33 HB3 TYR 33 16.815 22.164 9.746
235 HD1 TYR 33 HD2 TYR 33 16.970 22.918 12.219
236 HD2 TYR 33 HD1 TYR 33 18.727 25.060 8.917
237 HE1 TYR 33 HE2 TYR 33 16.938 25.036 13.564
238 HE2 TYR 33 HE1 TYR 33 18.702 27.145 10.246
239 HH TYR 33 HH TYR 33 17.863 28.153 12.060
Start of MODEL 8
1 H1 GLY 1 H1 GLY 1 31.051 15.644 32.593
2 H2 GLY 1 H2 GLY 1 29.967 15.952 33.787
3 H3 GLY 1 H3 GLY 1 30.440 17.169 32.769
4 HA2 GLY 1 HA2 GLY 1 29.379 16.114 30.913
5 HA3 GLY 1 HA3 GLY 1 28.970 14.745 31.968
6 H SER 2 H SER 2 26.809 14.921 31.594
7 HA SER 2 HA SER 2 25.293 17.181 32.810
8 HB2 SER 2 HB2 SER 2 23.879 17.314 30.778
9 HB3 SER 2 HB3 SER 2 25.557 17.763 30.443
10 HG SER 2 HG SER 2 25.804 16.103 29.241
11 H ALA 3 H ALA 3 25.690 13.911 32.737
12 HA ALA 3 HA ALA 3 24.517 12.095 33.272
13 HB1 ALA 3 HB1 ALA 3 24.010 13.357 35.320
14 HB2 ALA 3 HB2 ALA 3 22.514 13.969 34.576
15 HB3 ALA 3 HB3 ALA 3 22.715 12.228 34.868
16 H PHE 4 H PHE 4 24.436 12.089 30.936
17 HA PHE 4 HA PHE 4 23.583 11.852 28.908
18 HB2 PHE 4 HB2 PHE 4 22.304 10.060 29.899
19 HB3 PHE 4 HB3 PHE 4 20.991 11.154 30.283
20 HD1 PHE 4 HD1 PHE 4 23.010 9.952 27.328
21 HD2 PHE 4 HD2 PHE 4 19.192 11.334 28.785
22 HE1 PHE 4 HE1 PHE 4 21.965 9.372 25.154
23 HE2 PHE 4 HE2 PHE 4 18.155 10.754 26.614
24 HZ PHE 4 HZ PHE 4 19.529 9.723 24.806
25 H CYS 5 H CYS 5 23.641 13.479 27.666
26 HA CYS 5 HA CYS 5 22.759 16.079 28.219
27 HB2 CYS 5 HB2 CYS 5 24.581 15.573 26.798
28 HB3 CYS 5 HB3 CYS 5 23.605 14.605 25.726
29 H ASN 6 H ASN 6 20.979 17.274 27.794
30 HA ASN 6 HA ASN 6 18.511 15.863 26.949
31 HB2 ASN 6 HB2 ASN 6 18.464 17.222 29.010
32 HB3 ASN 6 HB3 ASN 6 18.912 18.660 28.098
33 HD21 ASN 6 HD22 ASN 6 16.659 19.040 29.457
34 HD22 ASN 6 HD21 ASN 6 15.251 18.827 28.445
35 H LEU 7 H LEU 7 18.232 15.727 24.817
36 HA LEU 7 HA LEU 7 19.250 17.496 22.823
37 HB2 LEU 7 HB2 LEU 7 18.420 15.171 22.459
38 HB3 LEU 7 HB3 LEU 7 16.767 15.726 22.739
39 HG LEU 7 HG LEU 7 16.863 17.142 20.737
40 HD11 LEU 7 HD11 LEU 7 18.796 16.914 19.143
41 HD12 LEU 7 HD12 LEU 7 19.200 17.807 20.613
42 HD13 LEU 7 HD13 LEU 7 19.705 16.109 20.435
43 HD21 LEU 7 HD21 LEU 7 16.989 15.356 19.049
44 HD22 LEU 7 HD22 LEU 7 17.847 14.320 20.213
45 HD23 LEU 7 HD23 LEU 7 16.160 14.795 20.518
46 H ALA 8 H ALA 8 16.181 17.803 24.688
47 HA ALA 8 HA ALA 8 15.106 19.856 22.993
48 HB1 ALA 8 HB1 ALA 8 14.662 19.386 25.965
49 HB2 ALA 8 HB2 ALA 8 13.625 20.326 24.878
50 HB3 ALA 8 HB3 ALA 8 13.787 18.574 24.641
51 H ARG 9 H ARG 9 17.355 20.093 25.845
52 HA ARG 9 HA ARG 9 17.358 22.979 25.805
53 HB2 ARG 9 HB2 ARG 9 17.823 21.076 27.665
54 HB3 ARG 9 HB3 ARG 9 19.486 21.307 27.147
55 HG2 ARG 9 HG2 ARG 9 19.204 23.732 27.409
56 HG3 ARG 9 HG3 ARG 9 17.574 23.504 28.051
57 HD2 ARG 9 HD2 ARG 9 20.183 22.573 29.322
58 HD3 ARG 9 HD3 ARG 9 19.148 23.881 29.891
59 HE ARG 9 HE ARG 9 17.357 22.212 30.336
60 HH11 ARG 9 HH11 ARG 9 20.686 21.076 30.442
61 HH12 ARG 9 HH12 ARG 9 20.238 19.484 30.947
62 HH21 ARG 9 HH21 ARG 9 16.885 20.253 31.220
63 HH22 ARG 9 HH22 ARG 9 18.154 19.058 31.541
64 H CYS 10 H CYS 10 19.255 20.508 24.285
65 HA CYS 10 HA CYS 10 21.440 22.198 23.359
66 HB2 CYS 10 HB2 CYS 10 21.538 19.677 23.680
67 HB3 CYS 10 HB3 CYS 10 20.452 19.531 22.287
68 H GLU 11 H GLU 11 18.365 20.912 22.057
69 HA GLU 11 HA GLU 11 18.441 21.981 19.463
70 HB2 GLU 11 HB2 GLU 11 16.296 21.135 21.388
71 HB3 GLU 11 HB3 GLU 11 15.816 22.055 19.996
72 HG2 GLU 11 HG2 GLU 11 17.642 19.645 19.670
73 HG3 GLU 11 HG3 GLU 11 15.894 19.464 19.820
74 H LEU 12 H LEU 12 17.146 23.354 22.525
75 HA LEU 12 HA LEU 12 16.450 25.919 21.528
76 HB2 LEU 12 HB2 LEU 12 15.763 24.819 23.685
77 HB3 LEU 12 HB3 LEU 12 17.386 25.064 24.303
78 HG LEU 12 HG LEU 12 17.105 27.530 24.129
79 HD11 LEU 12 HD11 LEU 12 14.796 28.434 23.835
80 HD12 LEU 12 HD12 LEU 12 15.439 27.727 22.353
81 HD13 LEU 12 HD13 LEU 12 14.247 26.820 23.330
82 HD21 LEU 12 HD21 LEU 12 15.558 27.714 26.024
83 HD22 LEU 12 HD22 LEU 12 14.920 26.090 25.688
84 HD23 LEU 12 HD23 LEU 12 16.607 26.307 26.217
85 H SER 13 H SER 13 19.431 24.831 23.169
86 HA SER 13 HA SER 13 20.869 27.261 23.201
87 HB2 SER 13 HB2 SER 13 21.959 24.430 22.815
88 HB3 SER 13 HB3 SER 13 22.920 25.849 23.247
89 HG SER 13 HG SER 13 20.843 24.676 24.797
90 H CYS 14 H CYS 14 20.714 24.783 20.644
91 HA CYS 14 HA CYS 14 22.499 26.323 18.882
92 HB2 CYS 14 HB2 CYS 14 20.853 23.824 18.417
93 HB3 CYS 14 HB3 CYS 14 22.097 24.464 17.322
94 H ARG 15 H ARG 15 18.937 25.809 19.023
95 HA ARG 15 HA ARG 15 18.336 27.076 16.534
96 HB2 ARG 15 HB2 ARG 15 16.857 25.553 17.689
97 HB3 ARG 15 HB3 ARG 15 16.615 26.709 19.013
98 HG2 ARG 15 HG2 ARG 15 15.460 28.228 17.523
99 HG3 ARG 15 HG3 ARG 15 15.844 27.230 16.108
100 HD2 ARG 15 HD2 ARG 15 14.194 26.179 18.449
101 HD3 ARG 15 HD3 ARG 15 13.473 27.077 17.120
102 HE ARG 15 HE ARG 15 13.863 25.317 15.617
103 HH11 ARG 15 HH11 ARG 15 14.904 24.245 18.842
104 HH12 ARG 15 HH12 ARG 15 15.038 22.600 18.206
105 HH21 ARG 15 HH21 ARG 15 14.050 23.216 15.090
106 HH22 ARG 15 HH22 ARG 15 14.620 22.065 16.321
107 H SER 16 H SER 16 18.869 28.526 19.724
108 HA SER 16 HA SER 16 18.158 31.198 19.067
109 HB2 SER 16 HB2 SER 16 20.355 30.119 20.873
110 HB3 SER 16 HB3 SER 16 19.809 31.813 20.842
111 HG SER 16 HG SER 16 18.833 30.109 22.372
112 H LEU 17 H LEU 17 20.989 29.380 17.928
113 HA LEU 17 HA LEU 17 22.231 31.888 16.897
114 HB2 LEU 17 HB2 LEU 17 23.418 29.175 16.503
115 HB3 LEU 17 HB3 LEU 17 24.211 30.731 16.600
116 HG LEU 17 HG LEU 17 23.021 29.116 18.880
117 HD11 LEU 17 HD11 LEU 17 25.090 28.167 17.982
118 HD12 LEU 17 HD12 LEU 17 25.908 29.738 18.146
119 HD13 LEU 17 HD13 LEU 17 25.375 28.855 19.590
120 HD21 LEU 17 HD21 LEU 17 24.606 31.732 18.995
121 HD22 LEU 17 HD22 LEU 17 22.888 31.562 19.399
122 HD23 LEU 17 HD23 LEU 17 24.111 30.765 20.397
123 H GLY 18 H GLY 18 20.040 29.554 15.911
124 HA2 GLY 18 HA2 GLY 18 18.812 29.760 13.901
125 HA3 GLY 18 HA3 GLY 18 20.221 30.425 13.078
126 H LEU 19 H LEU 19 20.627 27.457 14.944
127 HA LEU 19 HA LEU 19 20.223 25.714 12.608
128 HB2 LEU 19 HB2 LEU 19 22.343 24.723 12.679
129 HB3 LEU 19 HB3 LEU 19 22.573 26.440 12.451
130 HG LEU 19 HG LEU 19 22.913 25.030 15.122
131 HD11 LEU 19 HD11 LEU 19 24.968 25.753 12.977
132 HD12 LEU 19 HD12 LEU 19 25.371 25.167 14.596
133 HD13 LEU 19 HD13 LEU 19 24.499 24.113 13.472
134 HD21 LEU 19 HD21 LEU 19 22.667 27.420 15.423
135 HD22 LEU 19 HD22 LEU 19 24.344 26.980 15.689
136 HD23 LEU 19 HD23 LEU 19 23.872 27.751 14.156
137 H LEU 20 H LEU 20 21.167 23.306 13.693
138 HA LEU 20 HA LEU 20 18.986 22.901 15.704
139 HB2 LEU 20 HB2 LEU 20 20.171 21.142 13.540
140 HB3 LEU 20 HB3 LEU 20 19.063 20.544 14.762
141 HG LEU 20 HG LEU 20 18.424 22.716 12.724
142 HD11 LEU 20 HD11 LEU 20 16.982 21.005 11.710
143 HD12 LEU 20 HD12 LEU 20 18.662 20.448 11.759
144 HD13 LEU 20 HD13 LEU 20 17.481 19.828 12.940
145 HD21 LEU 20 HD21 LEU 20 17.063 23.103 14.694
146 HD22 LEU 20 HD22 LEU 20 16.045 22.295 13.499
147 HD23 LEU 20 HD23 LEU 20 16.711 21.366 14.855
148 H GLY 21 H GLY 21 19.207 21.056 17.156
149 HA2 GLY 21 HA2 GLY 21 21.909 21.073 18.435
150 HA3 GLY 21 HA3 GLY 21 20.393 20.650 19.214
151 H LYS 22 H LYS 22 22.989 19.245 19.043
152 HA LYS 22 HA LYS 22 21.883 16.555 18.555
153 HB2 LYS 22 HB2 LYS 22 23.562 17.642 16.693
154 HB3 LYS 22 HB3 LYS 22 24.782 17.157 17.862
155 HG2 LYS 22 HG2 LYS 22 24.551 15.309 16.379
156 HG3 LYS 22 HG3 LYS 22 23.666 14.841 17.838
157 HD2 LYS 22 HD2 LYS 22 21.608 16.007 16.508
158 HD3 LYS 22 HD3 LYS 22 22.632 15.645 15.106
159 HE2 LYS 22 HE2 LYS 22 22.746 13.288 15.785
160 HE3 LYS 22 HE3 LYS 22 21.855 13.667 17.277
161 HZ1 LYS 22 HZ1 LYS 22 20.772 13.964 14.534
162 HZ2 LYS 22 HZ2 LYS 22 20.377 12.744 15.576
163 HZ3 LYS 22 HZ3 LYS 22 19.950 14.299 15.900
164 H CYS 23 H CYS 23 22.133 15.314 20.363
165 HA CYS 23 HA CYS 23 24.114 16.169 22.426
166 HB2 CYS 23 HB2 CYS 23 21.440 14.845 22.410
167 HB3 CYS 23 HB3 CYS 23 22.588 14.318 23.609
168 H ILE 24 H ILE 24 25.946 15.078 22.546
169 HA ILE 24 HA ILE 24 26.060 12.220 21.641
170 HB ILE 24 HB ILE 24 28.245 14.326 21.471
171 HG12 ILE 24 HG12 ILE 24 28.263 13.568 19.044
172 HG13 ILE 24 HG13 ILE 24 26.723 12.773 19.319
173 HG21 ILE 24 HG21 ILE 24 28.312 11.342 20.818
174 HG22 ILE 24 HG22 ILE 24 29.623 12.494 20.507
175 HG23 ILE 24 HG23 ILE 24 29.174 12.123 22.162
176 HD11 ILE 24 HD11 ILE 24 26.734 15.096 18.210
177 HD12 ILE 24 HD12 ILE 24 25.604 14.884 19.542
178 HD13 ILE 24 HD13 ILE 24 27.133 15.753 19.810
179 H GLY 25 H GLY 25 25.767 11.149 23.384
180 HA2 GLY 25 HA2 GLY 25 25.839 10.363 25.537
181 HA3 GLY 25 HA3 GLY 25 27.535 10.838 25.501
182 H GLU 26 H GLU 26 28.169 12.750 26.455
183 HA GLU 26 HA GLU 26 26.327 13.761 28.569
184 HB2 GLU 26 HB2 GLU 26 29.330 13.523 28.438
185 HB3 GLU 26 HB3 GLU 26 28.479 14.361 29.730
186 HG2 GLU 26 HG2 GLU 26 28.013 11.440 29.022
187 HG3 GLU 26 HG3 GLU 26 29.127 12.021 30.242
188 H GLU 27 H GLU 27 27.511 14.953 25.599
189 HA GLU 27 HA GLU 27 27.249 17.760 26.582
190 HB2 GLU 27 HB2 GLU 27 29.515 16.730 24.858
191 HB3 GLU 27 HB3 GLU 27 29.219 18.416 25.236
192 HG2 GLU 27 HG2 GLU 27 29.970 16.254 27.253
193 HG3 GLU 27 HG3 GLU 27 31.070 17.401 26.525
194 H CYS 28 H CYS 28 26.728 19.309 25.100
195 HA CYS 28 HA CYS 28 25.115 18.435 22.793
196 HB2 CYS 28 HB2 CYS 28 24.066 19.861 24.416
197 HB3 CYS 28 HB3 CYS 28 25.423 20.980 24.399
198 H LYS 29 H LYS 29 25.522 18.860 20.744
199 HA LYS 29 HA LYS 29 27.662 20.745 19.804
200 HB2 LYS 29 HB2 LYS 29 26.774 18.023 18.747
201 HB3 LYS 29 HB3 LYS 29 27.746 19.128 17.806
202 HG2 LYS 29 HG2 LYS 29 28.655 17.951 20.470
203 HG3 LYS 29 HG3 LYS 29 28.959 17.234 18.890
204 HD2 LYS 29 HD2 LYS 29 30.092 19.425 18.214
205 HD3 LYS 29 HD3 LYS 29 30.041 19.874 19.938
206 HE2 LYS 29 HE2 LYS 29 31.290 17.802 20.505
207 HE3 LYS 29 HE3 LYS 29 31.247 17.301 18.808
208 HZ1 LYS 29 HZ1 LYS 29 32.680 19.654 19.885
209 HZ2 LYS 29 HZ2 LYS 29 33.363 18.294 19.265
210 HZ3 LYS 29 HZ3 LYS 29 32.561 19.329 18.288
211 H CYS 30 H CYS 30 27.077 21.823 17.756
212 HA CYS 30 HA CYS 30 24.134 21.694 17.153
213 HB2 CYS 30 HB2 CYS 30 25.872 24.078 16.573
214 HB3 CYS 30 HB3 CYS 30 24.141 23.913 16.449
215 H VAL 31 H VAL 31 23.399 21.563 15.120
216 HA VAL 31 HA VAL 31 25.332 20.808 12.987
217 HB VAL 31 HB VAL 31 23.629 18.994 12.384
218 HG11 VAL 31 HG11 VAL 31 25.853 18.552 13.243
219 HG12 VAL 31 HG12 VAL 31 25.253 18.677 14.918
220 HG13 VAL 31 HG13 VAL 31 24.673 17.369 13.859
221 HG21 VAL 31 HG21 VAL 31 21.768 19.649 13.840
222 HG22 VAL 31 HG22 VAL 31 22.314 18.002 14.175
223 HG23 VAL 31 HG23 VAL 31 22.758 19.321 15.276
224 HA PRO 32 HA PRO 32 22.929 23.344 10.358
225 HB2 PRO 32 HB2 PRO 32 23.437 22.336 7.882
226 HB3 PRO 32 HB3 PRO 32 24.707 23.072 8.902
227 HG2 PRO 32 HG2 PRO 32 24.047 20.105 8.683
228 HG3 PRO 32 HG3 PRO 32 25.643 20.890 8.443
229 HD2 PRO 32 HD2 PRO 32 24.933 19.818 10.791
230 HD3 PRO 32 HD3 PRO 32 25.838 21.364 10.752
231 H TYR 33 H TYR 33 21.169 23.512 8.968
232 HA TYR 33 HA TYR 33 18.978 21.582 9.249
233 HB2 TYR 33 HB2 TYR 33 19.291 24.290 7.929
234 HB3 TYR 33 HB3 TYR 33 17.896 23.282 7.609
235 HD1 TYR 33 HD1 TYR 33 16.448 22.470 9.531
236 HD2 TYR 33 HD2 TYR 33 19.313 25.660 9.927
237 HE1 TYR 33 HE1 TYR 33 15.178 23.355 11.476
238 HE2 TYR 33 HE2 TYR 33 18.058 26.523 11.908
239 HH TYR 33 HH TYR 33 15.083 24.919 13.077
Start of MODEL 9
1 H1 GLY 1 H1 GLY 1 27.310 9.833 32.662
2 H2 GLY 1 H2 GLY 1 27.409 9.178 31.146
3 H3 GLY 1 H3 GLY 1 27.561 10.795 31.360
4 HA2 GLY 1 HA2 GLY 1 29.422 8.775 32.400
5 HA3 GLY 1 HA3 GLY 1 29.676 9.702 30.920
6 H SER 2 H SER 2 31.516 10.811 31.589
7 HA SER 2 HA SER 2 31.611 12.599 33.860
8 HB2 SER 2 HB2 SER 2 33.499 13.620 32.560
9 HB3 SER 2 HB3 SER 2 33.654 11.870 32.811
10 HG SER 2 HG SER 2 33.901 12.958 30.552
11 H ALA 3 H ALA 3 29.870 12.755 30.891
12 HA ALA 3 HA ALA 3 28.922 15.412 31.661
13 HB1 ALA 3 HB1 ALA 3 29.222 14.428 28.798
14 HB2 ALA 3 HB2 ALA 3 28.648 16.026 29.337
15 HB3 ALA 3 HB3 ALA 3 30.336 15.559 29.591
16 H PHE 4 H PHE 4 26.752 15.757 30.895
17 HA PHE 4 HA PHE 4 24.963 13.440 30.566
18 HB2 PHE 4 HB2 PHE 4 25.181 13.849 32.995
19 HB3 PHE 4 HB3 PHE 4 24.722 15.526 32.763
20 HD1 PHE 4 HD1 PHE 4 23.545 12.032 32.759
21 HD2 PHE 4 HD2 PHE 4 22.371 16.157 32.323
22 HE1 PHE 4 HE1 PHE 4 21.172 11.398 33.169
23 HE2 PHE 4 HE2 PHE 4 20.001 15.516 32.720
24 HZ PHE 4 HZ PHE 4 19.406 13.145 33.163
25 H CYS 5 H CYS 5 23.508 13.897 29.079
26 HA CYS 5 HA CYS 5 23.360 16.636 27.912
27 HB2 CYS 5 HB2 CYS 5 24.497 14.892 26.695
28 HB3 CYS 5 HB3 CYS 5 23.115 13.826 26.817
29 H ASN 6 H ASN 6 21.496 17.501 27.009
30 HA ASN 6 HA ASN 6 18.958 15.981 27.141
31 HB2 ASN 6 HB2 ASN 6 19.016 17.447 29.162
32 HB3 ASN 6 HB3 ASN 6 19.249 18.847 28.140
33 HD21 ASN 6 HD22 ASN 6 16.980 16.241 28.967
34 HD22 ASN 6 HD21 ASN 6 15.557 17.042 28.329
35 H LEU 7 H LEU 7 18.364 15.833 25.029
36 HA LEU 7 HA LEU 7 19.318 17.550 22.950
37 HB2 LEU 7 HB2 LEU 7 18.489 15.237 22.613
38 HB3 LEU 7 HB3 LEU 7 16.855 15.764 23.025
39 HG LEU 7 HG LEU 7 16.830 17.263 21.033
40 HD11 LEU 7 HD11 LEU 7 18.578 16.952 19.279
41 HD12 LEU 7 HD12 LEU 7 19.223 17.736 20.722
42 HD13 LEU 7 HD13 LEU 7 19.549 16.009 20.427
43 HD21 LEU 7 HD21 LEU 7 17.605 14.409 20.379
44 HD22 LEU 7 HD22 LEU 7 15.992 14.938 20.914
45 HD23 LEU 7 HD23 LEU 7 16.643 15.511 19.368
46 H ALA 8 H ALA 8 16.219 17.843 24.803
47 HA ALA 8 HA ALA 8 15.220 19.933 23.143
48 HB1 ALA 8 HB1 ALA 8 13.848 18.615 24.694
49 HB2 ALA 8 HB2 ALA 8 14.671 19.370 26.074
50 HB3 ALA 8 HB3 ALA 8 13.682 20.352 24.982
51 H ARG 9 H ARG 9 17.378 20.157 26.061
52 HA ARG 9 HA ARG 9 17.555 22.995 26.141
53 HB2 ARG 9 HB2 ARG 9 18.163 21.096 27.835
54 HB3 ARG 9 HB3 ARG 9 19.663 20.920 26.920
55 HG2 ARG 9 HG2 ARG 9 20.088 23.325 27.269
56 HG3 ARG 9 HG3 ARG 9 18.619 23.431 28.256
57 HD2 ARG 9 HD2 ARG 9 20.443 23.257 29.797
58 HD3 ARG 9 HD3 ARG 9 19.586 21.709 29.805
59 HE ARG 9 HE ARG 9 21.849 21.762 27.942
60 HH11 ARG 9 HH11 ARG 9 21.080 21.188 31.367
61 HH12 ARG 9 HH12 ARG 9 22.553 20.226 31.529
62 HH21 ARG 9 HH21 ARG 9 23.732 20.542 28.424
63 HH22 ARG 9 HH22 ARG 9 23.907 19.989 30.076
64 H CYS 10 H CYS 10 19.323 20.502 24.385
65 HA CYS 10 HA CYS 10 21.405 22.213 23.339
66 HB2 CYS 10 HB2 CYS 10 21.516 19.686 23.664
67 HB3 CYS 10 HB3 CYS 10 20.432 19.549 22.269
68 H GLU 11 H GLU 11 18.301 20.949 22.080
69 HA GLU 11 HA GLU 11 18.464 21.949 19.470
70 HB2 GLU 11 HB2 GLU 11 16.255 21.127 21.334
71 HB3 GLU 11 HB3 GLU 11 15.800 22.032 19.899
72 HG2 GLU 11 HG2 GLU 11 17.666 19.653 19.620
73 HG3 GLU 11 HG3 GLU 11 15.927 19.423 19.782
74 H LEU 12 H LEU 12 16.942 23.359 22.407
75 HA LEU 12 HA LEU 12 16.243 25.892 21.367
76 HB2 LEU 12 HB2 LEU 12 15.475 24.754 23.481
77 HB3 LEU 12 HB3 LEU 12 17.034 25.089 24.206
78 HG LEU 12 HG LEU 12 16.633 27.539 23.996
79 HD11 LEU 12 HD11 LEU 12 13.871 26.704 23.022
80 HD12 LEU 12 HD12 LEU 12 14.323 28.343 23.531
81 HD13 LEU 12 HD13 LEU 12 15.078 27.628 22.100
82 HD21 LEU 12 HD21 LEU 12 14.400 26.033 25.412
83 HD22 LEU 12 HD22 LEU 12 16.031 26.313 26.059
84 HD23 LEU 12 HD23 LEU 12 14.952 27.684 25.771
85 H SER 13 H SER 13 19.217 24.832 23.007
86 HA SER 13 HA SER 13 20.593 27.352 23.042
87 HB2 SER 13 HB2 SER 13 21.759 24.546 22.867
88 HB3 SER 13 HB3 SER 13 22.662 26.027 23.230
89 HG SER 13 HG SER 13 20.528 24.892 24.735
90 H CYS 14 H CYS 14 20.683 24.679 20.610
91 HA CYS 14 HA CYS 14 22.369 26.214 18.816
92 HB2 CYS 14 HB2 CYS 14 20.665 23.758 18.280
93 HB3 CYS 14 HB3 CYS 14 21.962 24.389 17.231
94 H ARG 15 H ARG 15 18.816 26.015 19.104
95 HA ARG 15 HA ARG 15 18.077 27.179 16.671
96 HB2 ARG 15 HB2 ARG 15 16.648 26.294 18.793
97 HB3 ARG 15 HB3 ARG 15 16.646 27.988 19.221
98 HG2 ARG 15 HG2 ARG 15 14.823 28.107 17.887
99 HG3 ARG 15 HG3 ARG 15 15.956 28.124 16.539
100 HD2 ARG 15 HD2 ARG 15 14.419 25.803 17.691
101 HD3 ARG 15 HD3 ARG 15 14.279 26.474 16.061
102 HE ARG 15 HE ARG 15 16.741 25.660 15.823
103 HH11 ARG 15 HH11 ARG 15 14.253 23.807 17.548
104 HH12 ARG 15 HH12 ARG 15 15.149 22.323 17.330
105 HH21 ARG 15 HH21 ARG 15 17.895 23.813 15.914
106 HH22 ARG 15 HH22 ARG 15 17.166 22.334 16.563
107 H SER 16 H SER 16 19.253 28.864 19.577
108 HA SER 16 HA SER 16 18.566 31.481 18.488
109 HB2 SER 16 HB2 SER 16 19.595 32.424 20.460
110 HB3 SER 16 HB3 SER 16 18.465 31.124 20.869
111 HG SER 16 HG SER 16 20.019 30.220 21.890
112 H LEU 17 H LEU 17 21.074 29.426 17.632
113 HA LEU 17 HA LEU 17 22.608 31.718 16.505
114 HB2 LEU 17 HB2 LEU 17 23.719 28.975 16.378
115 HB3 LEU 17 HB3 LEU 17 24.551 30.509 16.516
116 HG LEU 17 HG LEU 17 23.105 29.033 18.753
117 HD11 LEU 17 HD11 LEU 17 26.078 29.289 18.159
118 HD12 LEU 17 HD12 LEU 17 25.362 28.508 19.589
119 HD13 LEU 17 HD13 LEU 17 25.091 27.821 17.979
120 HD21 LEU 17 HD21 LEU 17 24.996 31.435 18.866
121 HD22 LEU 17 HD22 LEU 17 23.254 31.496 19.178
122 HD23 LEU 17 HD23 LEU 17 24.316 30.587 20.269
123 H GLY 18 H GLY 18 20.179 29.657 15.740
124 HA2 GLY 18 HA2 GLY 18 19.033 29.541 13.735
125 HA3 GLY 18 HA3 GLY 18 20.438 30.162 12.869
126 H LEU 19 H LEU 19 20.528 27.184 14.932
127 HA LEU 19 HA LEU 19 20.293 25.492 12.547
128 HB2 LEU 19 HB2 LEU 19 22.427 24.531 12.612
129 HB3 LEU 19 HB3 LEU 19 22.603 26.251 12.434
130 HG LEU 19 HG LEU 19 22.937 24.863 15.106
131 HD11 LEU 19 HD11 LEU 19 25.024 25.564 12.976
132 HD12 LEU 19 HD12 LEU 19 25.414 25.001 14.607
133 HD13 LEU 19 HD13 LEU 19 24.568 23.929 13.480
134 HD21 LEU 19 HD21 LEU 19 23.911 27.557 14.090
135 HD22 LEU 19 HD22 LEU 19 22.698 27.259 15.355
136 HD23 LEU 19 HD23 LEU 19 24.375 26.816 15.639
137 H LEU 20 H LEU 20 21.368 23.127 13.515
138 HA LEU 20 HA LEU 20 19.040 22.296 15.137
139 HB2 LEU 20 HB2 LEU 20 19.451 21.565 12.729
140 HB3 LEU 20 HB3 LEU 20 20.856 20.715 13.337
141 HG LEU 20 HG LEU 20 19.272 19.386 14.846
142 HD11 LEU 20 HD11 LEU 20 17.303 20.941 14.684
143 HD12 LEU 20 HD12 LEU 20 17.184 20.563 12.955
144 HD13 LEU 20 HD13 LEU 20 16.911 19.297 14.168
145 HD21 LEU 20 HD21 LEU 20 18.924 19.192 11.825
146 HD22 LEU 20 HD22 LEU 20 20.212 18.440 12.788
147 HD23 LEU 20 HD23 LEU 20 18.534 17.913 12.996
148 H GLY 21 H GLY 21 19.250 20.800 16.883
149 HA2 GLY 21 HA2 GLY 21 21.898 20.776 18.230
150 HA3 GLY 21 HA3 GLY 21 20.345 20.365 18.941
151 H LYS 22 H LYS 22 23.098 19.000 18.622
152 HA LYS 22 HA LYS 22 22.028 16.280 18.250
153 HB2 LYS 22 HB2 LYS 22 23.816 17.418 16.502
154 HB3 LYS 22 HB3 LYS 22 24.943 16.894 17.735
155 HG2 LYS 22 HG2 LYS 22 24.809 15.136 16.135
156 HG3 LYS 22 HG3 LYS 22 23.904 14.580 17.551
157 HD2 LYS 22 HD2 LYS 22 21.792 15.512 16.293
158 HD3 LYS 22 HD3 LYS 22 22.849 15.589 14.864
159 HE2 LYS 22 HE2 LYS 22 23.417 13.221 15.163
160 HE3 LYS 22 HE3 LYS 22 22.441 13.183 16.645
161 HZ1 LYS 22 HZ1 LYS 22 20.470 13.522 15.355
162 HZ2 LYS 22 HZ2 LYS 22 21.325 13.699 13.936
163 HZ3 LYS 22 HZ3 LYS 22 21.258 12.249 14.710
164 H CYS 23 H CYS 23 22.642 14.792 19.696
165 HA CYS 23 HA CYS 23 24.244 15.637 22.079
166 HB2 CYS 23 HB2 CYS 23 21.837 14.924 22.379
167 HB3 CYS 23 HB3 CYS 23 22.297 13.330 21.781
168 H ILE 24 H ILE 24 26.306 14.980 21.981
169 HA ILE 24 HA ILE 24 27.010 12.316 20.808
170 HB ILE 24 HB ILE 24 28.484 14.912 20.203
171 HG12 ILE 24 HG12 ILE 24 26.843 13.234 18.258
172 HG13 ILE 24 HG13 ILE 24 26.301 14.757 18.961
173 HG21 ILE 24 HG21 ILE 24 29.949 12.900 20.358
174 HG22 ILE 24 HG22 ILE 24 28.919 12.069 19.170
175 HG23 ILE 24 HG23 ILE 24 29.867 13.497 18.714
176 HD11 ILE 24 HD11 ILE 24 28.212 15.946 17.949
177 HD12 ILE 24 HD12 ILE 24 28.684 14.455 17.115
178 HD13 ILE 24 HD13 ILE 24 27.126 15.205 16.759
179 H GLY 25 H GLY 25 28.136 11.184 22.283
180 HA2 GLY 25 HA2 GLY 25 29.369 10.685 24.175
181 HA3 GLY 25 HA3 GLY 25 30.348 12.108 23.785
182 H GLU 26 H GLU 26 26.909 12.056 24.673
183 HA GLU 26 HA GLU 26 25.706 13.210 26.144
184 HB2 GLU 26 HB2 GLU 26 27.836 12.315 28.088
185 HB3 GLU 26 HB3 GLU 26 26.216 12.893 28.509
186 HG2 GLU 26 HG2 GLU 26 25.180 11.063 27.223
187 HG3 GLU 26 HG3 GLU 26 26.769 10.466 26.748
188 H GLU 27 H GLU 27 27.815 14.871 24.763
189 HA GLU 27 HA GLU 27 27.100 17.319 26.317
190 HB2 GLU 27 HB2 GLU 27 29.643 16.858 24.738
191 HB3 GLU 27 HB3 GLU 27 28.987 18.461 25.043
192 HG2 GLU 27 HG2 GLU 27 28.972 17.820 27.541
193 HG3 GLU 27 HG3 GLU 27 30.036 16.479 27.073
194 H CYS 28 H CYS 28 26.536 19.154 25.087
195 HA CYS 28 HA CYS 28 24.925 18.513 22.723
196 HB2 CYS 28 HB2 CYS 28 24.015 19.977 24.414
197 HB3 CYS 28 HB3 CYS 28 25.430 21.027 24.334
198 H LYS 29 H LYS 29 25.421 18.927 20.677
199 HA LYS 29 HA LYS 29 27.588 20.825 19.903
200 HB2 LYS 29 HB2 LYS 29 28.720 18.706 19.939
201 HB3 LYS 29 HB3 LYS 29 27.357 17.880 19.196
202 HG2 LYS 29 HG2 LYS 29 29.208 18.081 17.654
203 HG3 LYS 29 HG3 LYS 29 27.781 18.928 17.060
204 HD2 LYS 29 HD2 LYS 29 28.800 21.097 17.635
205 HD3 LYS 29 HD3 LYS 29 30.152 20.283 18.428
206 HE2 LYS 29 HE2 LYS 29 30.725 21.133 16.164
207 HE3 LYS 29 HE3 LYS 29 30.958 19.392 16.328
208 HZ1 LYS 29 HZ1 LYS 29 29.806 20.069 14.233
209 HZ2 LYS 29 HZ2 LYS 29 28.956 18.996 15.117
210 HZ3 LYS 29 HZ3 LYS 29 28.534 20.599 15.112
211 H CYS 30 H CYS 30 26.842 22.173 18.325
212 HA CYS 30 HA CYS 30 24.210 21.564 17.139
213 HB2 CYS 30 HB2 CYS 30 25.818 24.068 16.673
214 HB3 CYS 30 HB3 CYS 30 24.114 23.770 16.433
215 H VAL 31 H VAL 31 23.697 21.481 15.026
216 HA VAL 31 HA VAL 31 25.791 20.813 13.016
217 HB VAL 31 HB VAL 31 24.340 18.778 12.462
218 HG11 VAL 31 HG11 VAL 31 25.830 18.753 15.099
219 HG12 VAL 31 HG12 VAL 31 25.443 17.354 14.079
220 HG13 VAL 31 HG13 VAL 31 26.538 18.603 13.464
221 HG21 VAL 31 HG21 VAL 31 23.232 19.188 15.253
222 HG22 VAL 31 HG22 VAL 31 22.342 19.275 13.721
223 HG23 VAL 31 HG23 VAL 31 23.042 17.750 14.222
224 HA PRO 32 HA PRO 32 23.007 22.739 10.186
225 HB2 PRO 32 HB2 PRO 32 23.180 21.230 7.879
226 HB3 PRO 32 HB3 PRO 32 24.468 22.322 8.464
227 HG2 PRO 32 HG2 PRO 32 24.231 19.334 8.960
228 HG3 PRO 32 HG3 PRO 32 25.646 20.244 8.324
229 HD2 PRO 32 HD2 PRO 32 25.465 19.601 10.905
230 HD3 PRO 32 HD3 PRO 32 26.067 21.219 10.447
231 H TYR 33 H TYR 33 21.070 22.672 9.266
232 HA TYR 33 HA TYR 33 19.071 20.575 9.842
233 HB2 TYR 33 HB2 TYR 33 19.043 23.239 8.367
234 HB3 TYR 33 HB3 TYR 33 17.708 22.122 8.258
235 HD1 TYR 33 HD2 TYR 33 16.383 21.452 10.243
236 HD2 TYR 33 HD1 TYR 33 19.238 24.678 10.303
237 HE1 TYR 33 HE2 TYR 33 15.174 22.482 12.168
238 HE2 TYR 33 HE1 TYR 33 18.020 25.716 12.216
239 HH TYR 33 HH TYR 33 16.169 25.643 13.516
Start of MODEL 10
1 H1 GLY 1 H1 GLY 1 30.714 7.658 28.334
2 H2 GLY 1 H2 GLY 1 31.813 7.988 29.506
3 H3 GLY 1 H3 GLY 1 30.740 9.146 29.024
4 HA2 GLY 1 HA2 GLY 1 28.890 7.949 29.897
5 HA3 GLY 1 HA3 GLY 1 29.976 6.611 30.301
6 H SER 2 H SER 2 29.533 10.111 31.000
7 HA SER 2 HA SER 2 29.406 9.462 33.822
8 HB2 SER 2 HB2 SER 2 31.115 10.917 34.664
9 HB3 SER 2 HB3 SER 2 31.836 9.730 33.575
10 HG SER 2 HG SER 2 32.686 11.712 33.172
11 H ALA 3 H ALA 3 28.130 11.187 31.306
12 HA ALA 3 HA ALA 3 26.848 13.165 33.073
13 HB1 ALA 3 HB1 ALA 3 28.808 14.208 31.941
14 HB2 ALA 3 HB2 ALA 3 28.126 13.758 30.369
15 HB3 ALA 3 HB3 ALA 3 27.271 14.915 31.413
16 H PHE 4 H PHE 4 25.107 14.282 31.825
17 HA PHE 4 HA PHE 4 23.441 12.302 30.311
18 HB2 PHE 4 HB2 PHE 4 22.453 13.918 32.674
19 HB3 PHE 4 HB3 PHE 4 21.681 12.553 31.881
20 HD1 PHE 4 HD1 PHE 4 23.115 10.259 32.014
21 HD2 PHE 4 HD2 PHE 4 23.557 13.595 34.692
22 HE1 PHE 4 HE1 PHE 4 24.089 8.755 33.727
23 HE2 PHE 4 HE2 PHE 4 24.560 12.102 36.394
24 HZ PHE 4 HZ PHE 4 24.809 9.674 35.936
25 H CYS 5 H CYS 5 23.635 13.500 28.382
26 HA CYS 5 HA CYS 5 23.052 16.337 28.213
27 HB2 CYS 5 HB2 CYS 5 24.659 15.201 26.795
28 HB3 CYS 5 HB3 CYS 5 23.410 14.159 26.125
29 H ASN 6 H ASN 6 21.335 17.398 27.178
30 HA ASN 6 HA ASN 6 18.761 15.892 26.902
31 HB2 ASN 6 HB2 ASN 6 18.881 17.298 28.955
32 HB3 ASN 6 HB3 ASN 6 19.220 18.701 27.971
33 HD21 ASN 6 HD22 ASN 6 16.708 16.731 29.315
34 HD22 ASN 6 HD21 ASN 6 15.407 17.667 28.553
35 H LEU 7 H LEU 7 18.037 15.876 24.881
36 HA LEU 7 HA LEU 7 19.076 17.505 22.741
37 HB2 LEU 7 HB2 LEU 7 18.097 15.213 22.489
38 HB3 LEU 7 HB3 LEU 7 16.511 15.866 22.905
39 HG LEU 7 HG LEU 7 16.559 17.303 20.871
40 HD11 LEU 7 HD11 LEU 7 19.173 15.845 20.268
41 HD12 LEU 7 HD12 LEU 7 18.255 16.824 19.106
42 HD13 LEU 7 HD13 LEU 7 18.968 17.597 20.519
43 HD21 LEU 7 HD21 LEU 7 16.235 15.518 19.243
44 HD22 LEU 7 HD22 LEU 7 17.094 14.368 20.292
45 HD23 LEU 7 HD23 LEU 7 15.538 15.060 20.807
46 H ALA 8 H ALA 8 16.085 17.980 24.725
47 HA ALA 8 HA ALA 8 15.082 20.058 23.007
48 HB1 ALA 8 HB1 ALA 8 13.676 18.821 24.609
49 HB2 ALA 8 HB2 ALA 8 14.572 19.551 25.961
50 HB3 ALA 8 HB3 ALA 8 13.598 20.574 24.889
51 H ARG 9 H ARG 9 17.179 20.190 25.965
52 HA ARG 9 HA ARG 9 17.496 22.994 26.087
53 HB2 ARG 9 HB2 ARG 9 17.963 20.982 27.722
54 HB3 ARG 9 HB3 ARG 9 19.524 20.870 26.913
55 HG2 ARG 9 HG2 ARG 9 19.826 23.304 27.398
56 HG3 ARG 9 HG3 ARG 9 18.372 23.262 28.409
57 HD2 ARG 9 HD2 ARG 9 20.947 21.680 28.828
58 HD3 ARG 9 HD3 ARG 9 20.397 23.047 29.807
59 HE ARG 9 HE ARG 9 18.301 21.415 30.142
60 HH11 ARG 9 HH21 ARG 9 21.702 20.451 30.373
61 HH12 ARG 9 HH22 ARG 9 21.221 18.884 31.023
62 HH21 ARG 9 HH11 ARG 9 17.965 19.616 31.440
63 HH22 ARG 9 HH12 ARG 9 19.307 18.472 31.579
64 H CYS 10 H CYS 10 19.220 20.500 24.293
65 HA CYS 10 HA CYS 10 21.358 22.228 23.373
66 HB2 CYS 10 HB2 CYS 10 21.495 19.721 23.722
67 HB3 CYS 10 HB3 CYS 10 20.477 19.531 22.294
68 H GLU 11 H GLU 11 18.290 20.968 22.015
69 HA GLU 11 HA GLU 11 18.502 22.092 19.444
70 HB2 GLU 11 HB2 GLU 11 16.225 21.241 21.195
71 HB3 GLU 11 HB3 GLU 11 15.855 22.216 19.786
72 HG2 GLU 11 HG2 GLU 11 17.617 19.755 19.528
73 HG3 GLU 11 HG3 GLU 11 15.864 19.639 19.549
74 H LEU 12 H LEU 12 17.093 23.426 22.489
75 HA LEU 12 HA LEU 12 16.467 26.044 21.609
76 HB2 LEU 12 HB2 LEU 12 15.768 24.868 23.692
77 HB3 LEU 12 HB3 LEU 12 17.372 25.004 24.342
78 HG LEU 12 HG LEU 12 15.703 26.558 25.299
79 HD11 LEU 12 HD11 LEU 12 17.089 28.473 25.498
80 HD12 LEU 12 HD12 LEU 12 18.149 27.060 25.405
81 HD13 LEU 12 HD13 LEU 12 17.947 28.132 23.995
82 HD21 LEU 12 HD21 LEU 12 14.468 27.100 23.234
83 HD22 LEU 12 HD22 LEU 12 14.985 28.546 24.117
84 HD23 LEU 12 HD23 LEU 12 15.856 28.052 22.651
85 H SER 13 H SER 13 19.454 24.792 23.093
86 HA SER 13 HA SER 13 20.952 27.226 23.128
87 HB2 SER 13 HB2 SER 13 21.963 24.375 22.865
88 HB3 SER 13 HB3 SER 13 22.941 25.788 23.299
89 HG SER 13 HG SER 13 20.761 24.676 24.758
90 H CYS 14 H CYS 14 20.736 24.689 20.601
91 HA CYS 14 HA CYS 14 22.592 26.146 18.847
92 HB2 CYS 14 HB2 CYS 14 20.859 23.710 18.345
93 HB3 CYS 14 HB3 CYS 14 22.134 24.318 17.264
94 H ARG 15 H ARG 15 19.019 25.796 18.961
95 HA ARG 15 HA ARG 15 18.583 27.284 16.512
96 HB2 ARG 15 HB2 ARG 15 17.009 25.686 17.488
97 HB3 ARG 15 HB3 ARG 15 16.673 26.793 18.829
98 HG2 ARG 15 HG2 ARG 15 15.680 28.411 17.359
99 HG3 ARG 15 HG3 ARG 15 16.281 27.591 15.910
100 HD2 ARG 15 HD2 ARG 15 14.247 26.368 17.829
101 HD3 ARG 15 HD3 ARG 15 13.820 27.285 16.389
102 HE ARG 15 HE ARG 15 14.663 25.582 14.969
103 HH11 ARG 15 HH11 ARG 15 14.799 24.424 18.337
104 HH12 ARG 15 HH12 ARG 15 15.259 22.830 17.734
105 HH21 ARG 15 HH21 ARG 15 15.121 23.517 14.472
106 HH22 ARG 15 HH22 ARG 15 15.387 22.341 15.777
107 H SER 16 H SER 16 19.147 28.281 19.830
108 HA SER 16 HA SER 16 18.695 31.095 19.489
109 HB2 SER 16 HB2 SER 16 20.820 29.683 21.153
110 HB3 SER 16 HB3 SER 16 20.354 31.387 21.264
111 HG SER 16 HG SER 16 18.765 29.101 21.842
112 H LEU 17 H LEU 17 21.139 29.088 17.935
113 HA LEU 17 HA LEU 17 22.666 31.539 17.175
114 HB2 LEU 17 HB2 LEU 17 23.463 28.728 16.533
115 HB3 LEU 17 HB3 LEU 17 24.463 30.162 16.533
116 HG LEU 17 HG LEU 17 23.326 28.702 18.942
117 HD11 LEU 17 HD11 LEU 17 25.114 27.469 17.829
118 HD12 LEU 17 HD12 LEU 17 26.185 28.882 17.964
119 HD13 LEU 17 HD13 LEU 17 25.617 28.051 19.426
120 HD21 LEU 17 HD21 LEU 17 24.758 30.175 20.320
121 HD22 LEU 17 HD22 LEU 17 25.316 31.028 18.874
122 HD23 LEU 17 HD23 LEU 17 23.620 31.164 19.401
123 H GLY 18 H GLY 18 20.635 28.954 15.919
124 HA2 GLY 18 HA2 GLY 18 19.178 29.906 14.044
125 HA3 GLY 18 HA3 GLY 18 20.684 30.165 13.171
126 H LEU 19 H LEU 19 21.158 27.318 14.776
127 HA LEU 19 HA LEU 19 20.264 25.633 12.499
128 HB2 LEU 19 HB2 LEU 19 22.326 24.501 12.564
129 HB3 LEU 19 HB3 LEU 19 22.627 26.209 12.362
130 HG LEU 19 HG LEU 19 22.974 24.716 14.985
131 HD11 LEU 19 HD11 LEU 19 25.425 24.839 14.446
132 HD12 LEU 19 HD12 LEU 19 24.550 23.891 13.243
133 HD13 LEU 19 HD13 LEU 19 25.026 25.556 12.876
134 HD21 LEU 19 HD21 LEU 19 22.780 27.048 15.440
135 HD22 LEU 19 HD22 LEU 19 24.470 26.628 15.582
136 HD23 LEU 19 HD23 LEU 19 23.898 27.478 14.125
137 H LEU 20 H LEU 20 21.234 23.155 13.665
138 HA LEU 20 HA LEU 20 19.021 22.691 15.638
139 HB2 LEU 20 HB2 LEU 20 20.077 21.148 13.266
140 HB3 LEU 20 HB3 LEU 20 19.437 20.265 14.634
141 HG LEU 20 HG LEU 20 17.266 21.388 14.457
142 HD11 LEU 20 HD11 LEU 20 16.737 22.695 12.365
143 HD12 LEU 20 HD12 LEU 20 17.771 23.542 13.516
144 HD13 LEU 20 HD13 LEU 20 18.483 22.805 12.063
145 HD21 LEU 20 HD21 LEU 20 16.543 20.349 12.342
146 HD22 LEU 20 HD22 LEU 20 18.236 20.217 11.818
147 HD23 LEU 20 HD23 LEU 20 17.658 19.302 13.227
148 H GLY 21 H GLY 21 19.371 20.821 17.088
149 HA2 GLY 21 HA2 GLY 21 22.182 20.768 18.142
150 HA3 GLY 21 HA3 GLY 21 20.738 20.707 19.136
151 H LYS 22 H LYS 22 23.057 18.967 18.911
152 HA LYS 22 HA LYS 22 21.682 16.329 19.001
153 HB2 LYS 22 HB2 LYS 22 24.363 17.024 17.696
154 HB3 LYS 22 HB3 LYS 22 23.882 15.379 18.090
155 HG2 LYS 22 HG2 LYS 22 22.357 17.179 16.175
156 HG3 LYS 22 HG3 LYS 22 23.560 15.960 15.720
157 HD2 LYS 22 HD2 LYS 22 22.153 14.234 16.895
158 HD3 LYS 22 HD3 LYS 22 20.901 15.479 17.116
159 HE2 LYS 22 HE2 LYS 22 20.466 15.646 14.807
160 HE3 LYS 22 HE3 LYS 22 22.052 15.005 14.359
161 HZ1 LYS 22 HZ1 LYS 22 20.221 13.401 14.007
162 HZ2 LYS 22 HZ2 LYS 22 21.376 12.831 15.046
163 HZ3 LYS 22 HZ3 LYS 22 19.932 13.378 15.618
164 H CYS 23 H CYS 23 22.529 14.869 20.475
165 HA CYS 23 HA CYS 23 24.407 15.889 22.535
166 HB2 CYS 23 HB2 CYS 23 22.337 13.696 22.347
167 HB3 CYS 23 HB3 CYS 23 23.568 13.680 23.578
168 H ILE 24 H ILE 24 26.478 15.536 22.056
169 HA ILE 24 HA ILE 24 27.378 12.952 20.837
170 HB ILE 24 HB ILE 24 28.297 15.736 20.006
171 HG12 ILE 24 HG12 ILE 24 26.611 13.656 18.538
172 HG13 ILE 24 HG13 ILE 24 26.088 15.249 19.084
173 HG21 ILE 24 HG21 ILE 24 29.127 13.000 18.928
174 HG22 ILE 24 HG22 ILE 24 29.718 14.580 18.367
175 HG23 ILE 24 HG23 ILE 24 30.127 14.029 19.976
176 HD11 ILE 24 HD11 ILE 24 28.036 14.685 16.830
177 HD12 ILE 24 HD12 ILE 24 26.406 15.358 16.726
178 HD13 ILE 24 HD13 ILE 24 27.700 16.304 17.480
179 H GLY 25 H GLY 25 28.996 12.023 21.953
180 HA2 GLY 25 HA2 GLY 25 30.578 11.660 23.574
181 HA3 GLY 25 HA3 GLY 25 31.074 13.348 23.401
182 H GLU 26 H GLU 26 27.821 12.425 24.394
183 HA GLU 26 HA GLU 26 26.492 13.098 26.054
184 HB2 GLU 26 HB2 GLU 26 28.838 12.731 27.925
185 HB3 GLU 26 HB3 GLU 26 27.128 12.836 28.367
186 HG2 GLU 26 HG2 GLU 26 26.640 10.817 27.010
187 HG3 GLU 26 HG3 GLU 26 28.357 10.653 26.639
188 H GLU 27 H GLU 27 28.255 15.178 24.666
189 HA GLU 27 HA GLU 27 27.420 17.456 26.407
190 HB2 GLU 27 HB2 GLU 27 29.668 17.286 24.364
191 HB3 GLU 27 HB3 GLU 27 28.997 18.799 24.977
192 HG2 GLU 27 HG2 GLU 27 29.577 18.051 27.313
193 HG3 GLU 27 HG3 GLU 27 30.421 16.666 26.606
194 H CYS 28 H CYS 28 26.549 19.312 25.284
195 HA CYS 28 HA CYS 28 24.899 18.666 22.954
196 HB2 CYS 28 HB2 CYS 28 24.048 20.189 24.610
197 HB3 CYS 28 HB3 CYS 28 25.460 21.234 24.454
198 H LYS 29 H LYS 29 25.310 19.019 20.889
199 HA LYS 29 HA LYS 29 27.464 20.846 19.951
200 HB2 LYS 29 HB2 LYS 29 28.400 18.558 20.107
201 HB3 LYS 29 HB3 LYS 29 27.143 17.961 19.025
202 HG2 LYS 29 HG2 LYS 29 28.078 19.001 17.139
203 HG3 LYS 29 HG3 LYS 29 28.820 20.298 18.095
204 HD2 LYS 29 HD2 LYS 29 30.436 18.747 19.042
205 HD3 LYS 29 HD3 LYS 29 29.795 17.410 18.076
206 HE2 LYS 29 HE2 LYS 29 30.711 18.202 16.102
207 HE3 LYS 29 HE3 LYS 29 30.584 19.901 16.597
208 HZ1 LYS 29 HZ1 LYS 29 32.523 18.051 17.846
209 HZ2 LYS 29 HZ2 LYS 29 32.921 19.010 16.564
210 HZ3 LYS 29 HZ3 LYS 29 32.431 19.669 18.007
211 H CYS 30 H CYS 30 26.929 21.904 18.042
212 HA CYS 30 HA CYS 30 24.124 21.510 17.138
213 HB2 CYS 30 HB2 CYS 30 25.909 23.871 16.555
214 HB3 CYS 30 HB3 CYS 30 24.176 23.728 16.387
215 H VAL 31 H VAL 31 23.516 21.425 15.002
216 HA VAL 31 HA VAL 31 25.618 20.972 12.951
217 HB VAL 31 HB VAL 31 24.120 19.074 12.056
218 HG11 VAL 31 HG11 VAL 31 25.349 17.421 13.361
219 HG12 VAL 31 HG12 VAL 31 26.384 18.777 12.888
220 HG13 VAL 31 HG13 VAL 31 25.781 18.657 14.562
221 HG21 VAL 31 HG21 VAL 31 22.202 19.391 13.602
222 HG22 VAL 31 HG22 VAL 31 22.908 17.771 13.721
223 HG23 VAL 31 HG23 VAL 31 23.252 18.971 14.975
224 HA PRO 32 HA PRO 32 23.024 23.437 10.385
225 HB2 PRO 32 HB2 PRO 32 24.061 22.928 7.919
226 HB3 PRO 32 HB3 PRO 32 24.991 23.764 9.194
227 HG2 PRO 32 HG2 PRO 32 25.085 20.816 8.451
228 HG3 PRO 32 HG3 PRO 32 26.462 21.941 8.689
229 HD2 PRO 32 HD2 PRO 32 25.558 20.255 10.628
230 HD3 PRO 32 HD3 PRO 32 26.224 21.872 11.011
231 H TYR 33 H TYR 33 21.472 23.417 8.655
232 HA TYR 33 HA TYR 33 20.250 20.793 7.957
233 HB2 TYR 33 HB2 TYR 33 18.124 21.373 8.664
234 HB3 TYR 33 HB3 TYR 33 19.164 21.801 10.000
235 HD1 TYR 33 HD2 TYR 33 19.700 24.327 10.405
236 HD2 TYR 33 HD1 TYR 33 16.724 22.938 7.594
237 HE1 TYR 33 HE2 TYR 33 18.608 26.553 10.423
238 HE2 TYR 33 HE1 TYR 33 15.630 25.167 7.655
239 HH TYR 33 HH TYR 33 15.657 27.277 8.543
Start of MODEL 11
1 H1 GLY 1 H1 GLY 1 31.931 16.825 28.593
2 H2 GLY 1 H2 GLY 1 32.343 15.226 28.578
3 H3 GLY 1 H3 GLY 1 32.722 16.145 29.880
4 HA2 GLY 1 HA2 GLY 1 30.007 15.467 28.973
5 HA3 GLY 1 HA3 GLY 1 30.829 14.753 30.372
6 H SER 2 H SER 2 28.324 16.168 30.330
7 HA SER 2 HA SER 2 28.844 18.592 31.984
8 HB2 SER 2 HB2 SER 2 27.228 19.818 30.621
9 HB3 SER 2 HB3 SER 2 28.546 19.189 29.624
10 HG SER 2 HG SER 2 27.235 17.521 28.926
11 H ALA 3 H ALA 3 27.798 15.910 32.819
12 HA ALA 3 HA ALA 3 26.225 14.912 34.051
13 HB1 ALA 3 HB1 ALA 3 26.705 16.714 35.606
14 HB2 ALA 3 HB2 ALA 3 25.415 17.710 34.891
15 HB3 ALA 3 HB3 ALA 3 25.013 16.196 35.717
16 H PHE 4 H PHE 4 25.450 14.173 32.029
17 HA PHE 4 HA PHE 4 23.984 13.600 30.461
18 HB2 PHE 4 HB2 PHE 4 22.541 12.892 32.157
19 HB3 PHE 4 HB3 PHE 4 21.980 14.511 32.502
20 HD1 PHE 4 HD1 PHE 4 21.827 11.778 29.971
21 HD2 PHE 4 HD2 PHE 4 20.164 15.517 31.321
22 HE1 PHE 4 HE1 PHE 4 19.903 11.486 28.418
23 HE2 PHE 4 HE2 PHE 4 18.238 15.218 29.773
24 HZ PHE 4 HZ PHE 4 18.119 13.212 28.309
25 H CYS 5 H CYS 5 23.430 14.211 28.539
26 HA CYS 5 HA CYS 5 23.166 17.101 27.925
27 HB2 CYS 5 HB2 CYS 5 24.831 15.761 26.718
28 HB3 CYS 5 HB3 CYS 5 23.550 14.717 26.089
29 H ASN 6 H ASN 6 21.238 17.962 27.520
30 HA ASN 6 HA ASN 6 18.864 16.170 27.178
31 HB2 ASN 6 HB2 ASN 6 18.821 17.576 29.204
32 HB3 ASN 6 HB3 ASN 6 19.067 19.018 28.233
33 HD21 ASN 6 HD22 ASN 6 16.960 19.344 29.683
34 HD22 ASN 6 HD21 ASN 6 15.468 18.947 28.826
35 H LEU 7 H LEU 7 18.377 15.928 25.070
36 HA LEU 7 HA LEU 7 19.327 17.641 23.021
37 HB2 LEU 7 HB2 LEU 7 18.669 15.249 22.785
38 HB3 LEU 7 HB3 LEU 7 16.975 15.712 22.939
39 HG LEU 7 HG LEU 7 17.101 17.018 20.857
40 HD11 LEU 7 HD11 LEU 7 19.123 16.794 19.386
41 HD12 LEU 7 HD12 LEU 7 19.421 17.783 20.816
42 HD13 LEU 7 HD13 LEU 7 20.006 16.103 20.766
43 HD21 LEU 7 HD21 LEU 7 18.260 14.224 20.564
44 HD22 LEU 7 HD22 LEU 7 16.546 14.626 20.780
45 HD23 LEU 7 HD23 LEU 7 17.402 15.138 19.309
46 H ALA 8 H ALA 8 16.252 17.873 24.829
47 HA ALA 8 HA ALA 8 15.092 19.926 23.202
48 HB1 ALA 8 HB1 ALA 8 13.860 18.725 24.969
49 HB2 ALA 8 HB2 ALA 8 14.875 19.484 26.214
50 HB3 ALA 8 HB3 ALA 8 13.794 20.479 25.219
51 H ARG 9 H ARG 9 17.265 20.275 26.107
52 HA ARG 9 HA ARG 9 17.477 23.070 26.125
53 HB2 ARG 9 HB2 ARG 9 18.030 21.227 27.846
54 HB3 ARG 9 HB3 ARG 9 19.524 20.948 26.951
55 HG2 ARG 9 HG2 ARG 9 20.201 23.220 27.310
56 HG3 ARG 9 HG3 ARG 9 18.689 23.590 28.157
57 HD2 ARG 9 HD2 ARG 9 20.449 23.272 29.820
58 HD3 ARG 9 HD3 ARG 9 19.275 21.958 29.935
59 HE ARG 9 HE ARG 9 21.575 21.319 28.256
60 HH11 ARG 9 HH11 ARG 9 20.600 21.335 31.708
61 HH12 ARG 9 HH12 ARG 9 21.754 20.047 32.006
62 HH21 ARG 9 HH21 ARG 9 22.715 19.530 28.834
63 HH22 ARG 9 HH22 ARG 9 22.813 19.043 30.517
64 H CYS 10 H CYS 10 19.384 20.611 24.468
65 HA CYS 10 HA CYS 10 21.366 22.350 23.338
66 HB2 CYS 10 HB2 CYS 10 21.526 19.839 23.784
67 HB3 CYS 10 HB3 CYS 10 20.483 19.614 22.370
68 H GLU 11 H GLU 11 18.394 20.810 21.929
69 HA GLU 11 HA GLU 11 18.648 21.783 19.316
70 HB2 GLU 11 HB2 GLU 11 16.300 20.947 21.007
71 HB3 GLU 11 HB3 GLU 11 16.012 21.665 19.438
72 HG2 GLU 11 HG2 GLU 11 18.042 19.433 19.587
73 HG3 GLU 11 HG3 GLU 11 16.321 19.057 19.694
74 H LEU 12 H LEU 12 16.990 23.272 22.121
75 HA LEU 12 HA LEU 12 16.207 25.670 20.693
76 HB2 LEU 12 HB2 LEU 12 16.004 24.622 23.503
77 HB3 LEU 12 HB3 LEU 12 15.785 26.329 23.234
78 HG LEU 12 HG LEU 12 13.669 25.076 23.332
79 HD11 LEU 12 HD11 LEU 12 14.115 26.374 20.612
80 HD12 LEU 12 HD12 LEU 12 12.575 26.162 21.460
81 HD13 LEU 12 HD13 LEU 12 13.806 27.237 22.136
82 HD21 LEU 12 HD21 LEU 12 14.362 22.999 22.163
83 HD22 LEU 12 HD22 LEU 12 12.888 23.710 21.492
84 HD23 LEU 12 HD23 LEU 12 14.423 23.896 20.627
85 H SER 13 H SER 13 18.997 24.861 22.737
86 HA SER 13 HA SER 13 19.962 27.619 22.858
87 HB2 SER 13 HB2 SER 13 21.463 25.013 23.299
88 HB3 SER 13 HB3 SER 13 22.077 26.646 23.632
89 HG SER 13 HG SER 13 19.897 25.296 24.818
90 H CYS 14 H CYS 14 20.726 24.797 20.745
91 HA CYS 14 HA CYS 14 22.500 26.319 19.023
92 HB2 CYS 14 HB2 CYS 14 20.859 23.838 18.415
93 HB3 CYS 14 HB3 CYS 14 22.175 24.484 17.408
94 H ARG 15 H ARG 15 18.918 25.895 19.018
95 HA ARG 15 HA ARG 15 18.257 27.192 16.637
96 HB2 ARG 15 HB2 ARG 15 16.799 26.240 18.731
97 HB3 ARG 15 HB3 ARG 15 16.707 27.943 19.118
98 HG2 ARG 15 HG2 ARG 15 14.807 27.553 17.836
99 HG3 ARG 15 HG3 ARG 15 15.940 28.230 16.647
100 HD2 ARG 15 HD2 ARG 15 16.525 25.907 15.929
101 HD3 ARG 15 HD3 ARG 15 15.382 25.279 17.132
102 HE ARG 15 HE ARG 15 14.024 27.119 15.418
103 HH11 ARG 15 HH11 ARG 15 15.380 23.863 15.314
104 HH12 ARG 15 HH12 ARG 15 14.252 23.376 14.052
105 HH21 ARG 15 HH21 ARG 15 12.516 26.301 13.954
106 HH22 ARG 15 HH22 ARG 15 12.515 24.564 13.648
107 H SER 16 H SER 16 19.131 28.725 19.719
108 HA SER 16 HA SER 16 18.651 31.395 18.884
109 HB2 SER 16 HB2 SER 16 20.336 30.250 21.146
110 HB3 SER 16 HB3 SER 16 19.932 31.979 20.962
111 HG SER 16 HG SER 16 18.493 30.390 22.256
112 H LEU 17 H LEU 17 21.351 29.417 18.063
113 HA LEU 17 HA LEU 17 22.901 31.828 17.216
114 HB2 LEU 17 HB2 LEU 17 23.791 29.005 16.773
115 HB3 LEU 17 HB3 LEU 17 24.757 30.465 16.862
116 HG LEU 17 HG LEU 17 23.398 28.989 19.139
117 HD11 LEU 17 HD11 LEU 17 26.344 29.351 18.494
118 HD12 LEU 17 HD12 LEU 17 25.667 28.459 19.873
119 HD13 LEU 17 HD13 LEU 17 25.392 27.871 18.226
120 HD21 LEU 17 HD21 LEU 17 25.206 31.467 19.219
121 HD22 LEU 17 HD22 LEU 17 23.492 31.425 19.677
122 HD23 LEU 17 HD23 LEU 17 24.682 30.546 20.642
123 H GLY 18 H GLY 18 20.547 29.675 16.122
124 HA2 GLY 18 HA2 GLY 18 19.348 29.933 14.146
125 HA3 GLY 18 HA3 GLY 18 20.746 30.601 13.322
126 H LEU 19 H LEU 19 20.837 27.486 15.144
127 HA LEU 19 HA LEU 19 20.479 25.952 12.652
128 HB2 LEU 19 HB2 LEU 19 22.535 24.788 12.766
129 HB3 LEU 19 HB3 LEU 19 22.850 26.500 12.625
130 HG LEU 19 HG LEU 19 23.052 24.978 15.242
131 HD11 LEU 19 HD11 LEU 19 25.541 25.029 14.764
132 HD12 LEU 19 HD12 LEU 19 24.643 24.047 13.598
133 HD13 LEU 19 HD13 LEU 19 25.183 25.679 13.159
134 HD21 LEU 19 HD21 LEU 19 22.927 27.371 15.623
135 HD22 LEU 19 HD22 LEU 19 24.569 26.829 15.912
136 HD23 LEU 19 HD23 LEU 19 24.177 27.675 14.395
137 H LEU 20 H LEU 20 21.407 23.442 13.689
138 HA LEU 20 HA LEU 20 19.174 22.789 15.572
139 HB2 LEU 20 HB2 LEU 20 20.221 21.597 13.041
140 HB3 LEU 20 HB3 LEU 20 19.914 20.447 14.315
141 HG LEU 20 HG LEU 20 17.612 21.014 14.485
142 HD11 LEU 20 HD11 LEU 20 17.547 23.403 14.143
143 HD12 LEU 20 HD12 LEU 20 18.121 23.238 12.472
144 HD13 LEU 20 HD13 LEU 20 16.520 22.630 12.937
145 HD21 LEU 20 HD21 LEU 20 18.422 20.831 11.550
146 HD22 LEU 20 HD22 LEU 20 18.303 19.466 12.684
147 HD23 LEU 20 HD23 LEU 20 16.849 20.371 12.239
148 H GLY 21 H GLY 21 19.562 20.830 16.939
149 HA2 GLY 21 HA2 GLY 21 22.394 20.727 17.946
150 HA3 GLY 21 HA3 GLY 21 20.984 20.688 18.982
151 H LYS 22 H LYS 22 23.200 18.856 18.776
152 HA LYS 22 HA LYS 22 21.649 16.302 18.806
153 HB2 LYS 22 HB2 LYS 22 24.526 16.656 17.844
154 HB3 LYS 22 HB3 LYS 22 23.737 15.106 18.107
155 HG2 LYS 22 HG2 LYS 22 22.906 17.162 16.045
156 HG3 LYS 22 HG3 LYS 22 23.910 15.741 15.757
157 HD2 LYS 22 HD2 LYS 22 21.949 14.302 16.529
158 HD3 LYS 22 HD3 LYS 22 20.990 15.790 16.585
159 HE2 LYS 22 HE2 LYS 22 20.515 14.890 14.443
160 HE3 LYS 22 HE3 LYS 22 21.673 16.183 14.143
161 HZ1 LYS 22 HZ1 LYS 22 22.120 13.273 14.098
162 HZ2 LYS 22 HZ2 LYS 22 22.423 14.354 12.907
163 HZ3 LYS 22 HZ3 LYS 22 23.412 14.277 14.232
164 H CYS 23 H CYS 23 22.298 14.834 20.401
165 HA CYS 23 HA CYS 23 24.127 15.869 22.515
166 HB2 CYS 23 HB2 CYS 23 21.471 14.507 22.546
167 HB3 CYS 23 HB3 CYS 23 22.621 14.067 23.767
168 H ILE 24 H ILE 24 25.968 15.015 22.340
169 HA ILE 24 HA ILE 24 26.490 12.169 21.633
170 HB ILE 24 HB ILE 24 28.425 14.474 22.088
171 HG12 ILE 24 HG12 ILE 24 27.045 15.139 20.216
172 HG13 ILE 24 HG13 ILE 24 28.622 14.668 19.640
173 HG21 ILE 24 HG21 ILE 24 28.791 11.683 20.939
174 HG22 ILE 24 HG22 ILE 24 29.881 13.008 20.506
175 HG23 ILE 24 HG23 ILE 24 29.766 12.530 22.176
176 HD11 ILE 24 HD11 ILE 24 27.703 12.473 18.883
177 HD12 ILE 24 HD12 ILE 24 26.092 12.972 19.448
178 HD13 ILE 24 HD13 ILE 24 26.886 13.855 18.136
179 H GLY 25 H GLY 25 28.674 11.634 23.226
180 HA2 GLY 25 HA2 GLY 25 27.614 10.751 25.649
181 HA3 GLY 25 HA3 GLY 25 29.339 10.912 25.307
182 H GLU 26 H GLU 26 26.623 12.184 26.888
183 HA GLU 26 HA GLU 26 26.058 14.004 28.066
184 HB2 GLU 26 HB2 GLU 26 28.781 13.582 29.319
185 HB3 GLU 26 HB3 GLU 26 27.430 14.491 30.013
186 HG2 GLU 26 HG2 GLU 26 26.034 12.382 29.888
187 HG3 GLU 26 HG3 GLU 26 27.509 11.499 29.458
188 H GLU 27 H GLU 27 27.192 14.786 25.488
189 HA GLU 27 HA GLU 27 27.809 17.623 26.159
190 HB2 GLU 27 HB2 GLU 27 29.362 15.765 24.332
191 HB3 GLU 27 HB3 GLU 27 29.429 17.508 24.142
192 HG2 GLU 27 HG2 GLU 27 30.218 15.998 26.672
193 HG3 GLU 27 HG3 GLU 27 31.313 16.625 25.453
194 H CYS 28 H CYS 28 26.835 19.111 25.017
195 HA CYS 28 HA CYS 28 24.988 18.413 22.826
196 HB2 CYS 28 HB2 CYS 28 24.100 19.815 24.540
197 HB3 CYS 28 HB3 CYS 28 25.517 20.860 24.521
198 H LYS 29 H LYS 29 25.501 18.623 20.760
199 HA LYS 29 HA LYS 29 27.645 20.518 19.852
200 HB2 LYS 29 HB2 LYS 29 26.839 17.852 18.615
201 HB3 LYS 29 HB3 LYS 29 28.082 18.942 18.024
202 HG2 LYS 29 HG2 LYS 29 28.167 17.333 20.615
203 HG3 LYS 29 HG3 LYS 29 29.048 17.003 19.124
204 HD2 LYS 29 HD2 LYS 29 30.255 19.188 19.401
205 HD3 LYS 29 HD3 LYS 29 29.469 19.380 20.982
206 HE2 LYS 29 HE2 LYS 29 30.462 17.248 21.756
207 HE3 LYS 29 HE3 LYS 29 31.183 16.993 20.161
208 HZ1 LYS 29 HZ1 LYS 29 32.780 17.932 21.708
209 HZ2 LYS 29 HZ2 LYS 29 32.495 19.002 20.491
210 HZ3 LYS 29 HZ3 LYS 29 31.828 19.206 22.017
211 H CYS 30 H CYS 30 27.154 21.667 17.899
212 HA CYS 30 HA CYS 30 24.267 21.538 17.136
213 HB2 CYS 30 HB2 CYS 30 25.987 23.959 16.733
214 HB3 CYS 30 HB3 CYS 30 24.271 23.776 16.513
215 H VAL 31 H VAL 31 23.670 21.547 15.015
216 HA VAL 31 HA VAL 31 25.748 20.709 13.041
217 HB VAL 31 HB VAL 31 24.046 18.965 12.284
218 HG11 VAL 31 HG11 VAL 31 25.281 18.593 15.035
219 HG12 VAL 31 HG12 VAL 31 24.795 17.321 13.888
220 HG13 VAL 31 HG13 VAL 31 26.114 18.416 13.470
221 HG21 VAL 31 HG21 VAL 31 22.085 19.849 13.515
222 HG22 VAL 31 HG22 VAL 31 22.415 18.152 13.851
223 HG23 VAL 31 HG23 VAL 31 22.853 19.386 15.053
224 HA PRO 32 HA PRO 32 23.607 23.086 9.963
225 HB2 PRO 32 HB2 PRO 32 24.182 21.727 7.658
226 HB3 PRO 32 HB3 PRO 32 25.393 22.681 8.562
227 HG2 PRO 32 HG2 PRO 32 24.879 19.689 8.725
228 HG3 PRO 32 HG3 PRO 32 26.451 20.531 8.513
229 HD2 PRO 32 HD2 PRO 32 25.590 19.672 10.917
230 HD3 PRO 32 HD3 PRO 32 26.487 21.214 10.771
231 H TYR 33 H TYR 33 21.767 23.164 8.837
232 HA TYR 33 HA TYR 33 19.794 20.981 9.318
233 HB2 TYR 33 HB2 TYR 33 18.169 22.872 9.452
234 HB3 TYR 33 HB3 TYR 33 19.403 22.836 10.695
235 HD1 TYR 33 HD2 TYR 33 21.293 24.442 10.698
236 HD2 TYR 33 HD1 TYR 33 17.975 24.816 7.984
237 HE1 TYR 33 HE2 TYR 33 21.960 26.800 10.214
238 HE2 TYR 33 HE1 TYR 33 18.593 27.200 7.557
239 HH TYR 33 HH TYR 33 21.476 28.706 9.067
Start of MODEL 12
1 H1 GLY 1 H1 GLY 1 33.808 16.446 28.389
2 H2 GLY 1 H2 GLY 1 34.426 17.882 28.913
3 H3 GLY 1 H3 GLY 1 33.128 17.854 27.894
4 HA2 GLY 1 HA2 GLY 1 31.728 16.860 29.536
5 HA3 GLY 1 HA3 GLY 1 33.116 16.771 30.633
6 H SER 2 H SER 2 31.487 19.215 28.592
7 HA SER 2 HA SER 2 31.121 21.014 30.888
8 HB2 SER 2 HB2 SER 2 32.359 22.888 29.804
9 HB3 SER 2 HB3 SER 2 33.392 21.550 30.309
10 HG SER 2 HG SER 2 33.898 22.321 28.240
11 H ALA 3 H ALA 3 29.529 19.653 28.482
12 HA ALA 3 HA ALA 3 27.714 21.935 28.350
13 HB1 ALA 3 HB1 ALA 3 27.566 22.078 25.910
14 HB2 ALA 3 HB2 ALA 3 29.195 22.459 26.465
15 HB3 ALA 3 HB3 ALA 3 28.856 20.887 25.726
16 H PHE 4 H PHE 4 27.873 18.816 28.910
17 HA PHE 4 HA PHE 4 26.402 17.237 29.339
18 HB2 PHE 4 HB2 PHE 4 24.769 19.698 29.959
19 HB3 PHE 4 HB3 PHE 4 24.537 18.096 30.650
20 HD1 PHE 4 HD1 PHE 4 26.340 17.039 32.065
21 HD2 PHE 4 HD2 PHE 4 26.513 21.164 30.812
22 HE1 PHE 4 HE1 PHE 4 28.064 17.494 33.793
23 HE2 PHE 4 HE2 PHE 4 28.244 21.614 32.534
24 HZ PHE 4 HZ PHE 4 29.014 19.778 34.032
25 H CYS 5 H CYS 5 25.164 15.741 28.632
26 HA CYS 5 HA CYS 5 23.847 15.989 26.095
27 HB2 CYS 5 HB2 CYS 5 25.010 13.984 27.195
28 HB3 CYS 5 HB3 CYS 5 23.508 13.758 28.075
29 H ASN 6 H ASN 6 22.085 17.289 26.004
30 HA ASN 6 HA ASN 6 19.603 15.956 26.730
31 HB2 ASN 6 HB2 ASN 6 19.975 17.502 28.706
32 HB3 ASN 6 HB3 ASN 6 19.955 18.870 27.600
33 HD21 ASN 6 HD22 ASN 6 18.039 16.002 28.624
34 HD22 ASN 6 HD21 ASN 6 16.485 16.805 28.392
35 H LEU 7 H LEU 7 18.633 15.804 24.773
36 HA LEU 7 HA LEU 7 19.253 17.440 22.506
37 HB2 LEU 7 HB2 LEU 7 18.313 15.140 22.413
38 HB3 LEU 7 HB3 LEU 7 16.814 15.731 23.135
39 HG LEU 7 HG LEU 7 16.339 17.093 21.146
40 HD11 LEU 7 HD11 LEU 7 18.639 17.581 20.362
41 HD12 LEU 7 HD12 LEU 7 18.869 15.855 19.972
42 HD13 LEU 7 HD13 LEU 7 17.666 16.843 19.099
43 HD21 LEU 7 HD21 LEU 7 15.902 15.233 19.598
44 HD22 LEU 7 HD22 LEU 7 17.042 14.201 20.486
45 HD23 LEU 7 HD23 LEU 7 15.546 14.761 21.265
46 H ALA 8 H ALA 8 16.466 17.782 24.822
47 HA ALA 8 HA ALA 8 15.281 19.890 23.324
48 HB1 ALA 8 HB1 ALA 8 14.079 18.649 25.023
49 HB2 ALA 8 HB2 ALA 8 15.158 19.259 26.292
50 HB3 ALA 8 HB3 ALA 8 14.073 20.376 25.436
51 H ARG 9 H ARG 9 17.563 20.217 26.192
52 HA ARG 9 HA ARG 9 17.758 23.010 26.064
53 HB2 ARG 9 HB2 ARG 9 18.680 21.175 27.776
54 HB3 ARG 9 HB3 ARG 9 20.126 21.251 26.774
55 HG2 ARG 9 HG2 ARG 9 19.766 23.853 27.006
56 HG3 ARG 9 HG3 ARG 9 18.795 23.421 28.406
57 HD2 ARG 9 HD2 ARG 9 20.912 23.895 29.297
58 HD3 ARG 9 HD3 ARG 9 20.843 22.137 29.265
59 HE ARG 9 HE ARG 9 22.361 23.924 27.393
60 HH11 ARG 9 HH11 ARG 9 22.204 20.670 28.768
61 HH12 ARG 9 HH12 ARG 9 23.514 20.142 27.721
62 HH21 ARG 9 HH21 ARG 9 24.035 23.242 26.330
63 HH22 ARG 9 HH22 ARG 9 24.669 21.620 26.609
64 H CYS 10 H CYS 10 19.554 20.563 24.266
65 HA CYS 10 HA CYS 10 21.479 22.343 23.100
66 HB2 CYS 10 HB2 CYS 10 21.621 19.810 23.507
67 HB3 CYS 10 HB3 CYS 10 20.618 19.629 22.058
68 H GLU 11 H GLU 11 18.403 20.852 21.848
69 HA GLU 11 HA GLU 11 18.448 22.070 19.325
70 HB2 GLU 11 HB2 GLU 11 16.305 20.973 21.106
71 HB3 GLU 11 HB3 GLU 11 15.786 22.009 19.792
72 HG2 GLU 11 HG2 GLU 11 17.712 19.721 19.260
73 HG3 GLU 11 HG3 GLU 11 15.964 19.484 19.315
74 H LEU 12 H LEU 12 16.984 23.288 22.377
75 HA LEU 12 HA LEU 12 16.091 25.815 21.391
76 HB2 LEU 12 HB2 LEU 12 16.910 24.843 24.162
77 HB3 LEU 12 HB3 LEU 12 16.174 26.413 23.878
78 HG LEU 12 HG LEU 12 14.802 23.790 23.144
79 HD11 LEU 12 HD11 LEU 12 14.455 25.552 25.610
80 HD12 LEU 12 HD12 LEU 12 13.464 24.139 25.184
81 HD13 LEU 12 HD13 LEU 12 15.173 23.923 25.578
82 HD21 LEU 12 HD21 LEU 12 13.929 25.713 21.903
83 HD22 LEU 12 HD22 LEU 12 12.772 25.184 23.132
84 HD23 LEU 12 HD23 LEU 12 13.755 26.635 23.414
85 H SER 13 H SER 13 19.200 24.889 22.881
86 HA SER 13 HA SER 13 20.331 27.528 22.941
87 HB2 SER 13 HB2 SER 13 21.742 24.831 22.847
88 HB3 SER 13 HB3 SER 13 22.497 26.392 23.220
89 HG SER 13 HG SER 13 20.417 25.099 24.651
90 H CYS 14 H CYS 14 20.621 24.859 20.550
91 HA CYS 14 HA CYS 14 22.320 26.397 18.787
92 HB2 CYS 14 HB2 CYS 14 20.641 23.934 18.220
93 HB3 CYS 14 HB3 CYS 14 21.977 24.556 17.210
94 H ARG 15 H ARG 15 18.766 26.128 19.000
95 HA ARG 15 HA ARG 15 17.953 27.321 16.618
96 HB2 ARG 15 HB2 ARG 15 16.650 26.578 18.895
97 HB3 ARG 15 HB3 ARG 15 16.751 28.284 19.226
98 HG2 ARG 15 HG2 ARG 15 14.778 28.348 18.103
99 HG3 ARG 15 HG3 ARG 15 15.799 28.403 16.669
100 HD2 ARG 15 HD2 ARG 15 14.478 25.969 17.935
101 HD3 ARG 15 HD3 ARG 15 14.069 26.699 16.382
102 HE ARG 15 HE ARG 15 16.512 26.084 15.738
103 HH11 ARG 15 HH21 ARG 15 14.370 23.926 17.535
104 HH12 ARG 15 HH22 ARG 15 15.429 22.568 17.204
105 HH21 ARG 15 HH11 ARG 15 17.938 24.382 15.788
106 HH22 ARG 15 HH12 ARG 15 17.379 22.841 16.440
107 H SER 16 H SER 16 19.102 28.998 19.518
108 HA SER 16 HA SER 16 18.738 31.663 18.594
109 HB2 SER 16 HB2 SER 16 20.650 30.577 20.685
110 HB3 SER 16 HB3 SER 16 20.133 32.265 20.534
111 HG SER 16 HG SER 16 18.992 30.539 22.009
112 H LEU 17 H LEU 17 21.108 29.451 17.509
113 HA LEU 17 HA LEU 17 22.882 31.674 16.575
114 HB2 LEU 17 HB2 LEU 17 23.822 28.856 16.564
115 HB3 LEU 17 HB3 LEU 17 24.739 30.322 16.752
116 HG LEU 17 HG LEU 17 22.991 28.995 18.847
117 HD11 LEU 17 HD11 LEU 17 24.949 27.639 18.277
118 HD12 LEU 17 HD12 LEU 17 26.020 29.028 18.566
119 HD13 LEU 17 HD13 LEU 17 25.095 28.310 19.906
120 HD21 LEU 17 HD21 LEU 17 24.152 30.494 20.470
121 HD22 LEU 17 HD22 LEU 17 25.047 31.256 19.137
122 HD23 LEU 17 HD23 LEU 17 23.293 31.463 19.264
123 H GLY 18 H GLY 18 20.432 29.738 15.535
124 HA2 GLY 18 HA2 GLY 18 19.547 29.831 13.365
125 HA3 GLY 18 HA3 GLY 18 21.114 30.276 12.715
126 H LEU 19 H LEU 19 20.783 27.333 14.717
127 HA LEU 19 HA LEU 19 20.591 25.600 12.346
128 HB2 LEU 19 HB2 LEU 19 22.656 24.555 12.587
129 HB3 LEU 19 HB3 LEU 19 22.938 26.265 12.415
130 HG LEU 19 HG LEU 19 22.998 24.835 15.082
131 HD11 LEU 19 HD11 LEU 19 25.525 24.965 14.758
132 HD12 LEU 19 HD12 LEU 19 24.735 23.905 13.576
133 HD13 LEU 19 HD13 LEU 19 25.240 25.545 13.124
134 HD21 LEU 19 HD21 LEU 19 24.440 26.735 15.784
135 HD22 LEU 19 HD22 LEU 19 24.074 27.543 14.244
136 HD23 LEU 19 HD23 LEU 19 22.786 27.204 15.428
137 H LEU 20 H LEU 20 21.354 23.185 13.374
138 HA LEU 20 HA LEU 20 19.075 22.567 15.191
139 HB2 LEU 20 HB2 LEU 20 20.672 20.928 13.218
140 HB3 LEU 20 HB3 LEU 20 19.536 20.214 14.350
141 HG LEU 20 HG LEU 20 18.804 22.282 12.247
142 HD11 LEU 20 HD11 LEU 20 18.424 19.255 12.247
143 HD12 LEU 20 HD12 LEU 20 17.830 20.385 11.007
144 HD13 LEU 20 HD13 LEU 20 19.569 20.163 11.234
145 HD21 LEU 20 HD21 LEU 20 17.159 22.300 14.027
146 HD22 LEU 20 HD22 LEU 20 16.467 21.409 12.681
147 HD23 LEU 20 HD23 LEU 20 17.111 20.524 14.082
148 H GLY 21 H GLY 21 19.375 20.908 16.826
149 HA2 GLY 21 HA2 GLY 21 22.150 20.824 18.001
150 HA3 GLY 21 HA3 GLY 21 20.687 20.977 18.957
151 H LYS 22 H LYS 22 22.943 18.936 18.822
152 HA LYS 22 HA LYS 22 21.203 16.678 19.459
153 HB2 LYS 22 HB2 LYS 22 22.163 15.029 18.047
154 HB3 LYS 22 HB3 LYS 22 21.520 16.328 17.079
155 HG2 LYS 22 HG2 LYS 22 23.474 16.001 15.952
156 HG3 LYS 22 HG3 LYS 22 24.001 17.243 17.074
157 HD2 LYS 22 HD2 LYS 22 25.692 15.559 17.038
158 HD3 LYS 22 HD3 LYS 22 24.854 15.452 18.584
159 HE2 LYS 22 HE2 LYS 22 25.331 13.225 17.756
160 HE3 LYS 22 HE3 LYS 22 23.590 13.479 17.806
161 HZ1 LYS 22 HZ1 LYS 22 25.220 13.761 15.340
162 HZ2 LYS 22 HZ2 LYS 22 24.380 12.399 15.722
163 HZ3 LYS 22 HZ3 LYS 22 23.572 13.792 15.443
164 H CYS 23 H CYS 23 22.270 14.944 20.643
165 HA CYS 23 HA CYS 23 24.587 15.990 22.199
166 HB2 CYS 23 HB2 CYS 23 22.812 15.275 23.590
167 HB3 CYS 23 HB3 CYS 23 22.621 13.759 22.713
168 H ILE 24 H ILE 24 26.552 15.115 22.126
169 HA ILE 24 HA ILE 24 27.069 12.653 20.486
170 HB ILE 24 HB ILE 24 28.925 15.012 20.989
171 HG12 ILE 24 HG12 ILE 24 27.533 14.024 18.465
172 HG13 ILE 24 HG13 ILE 24 27.201 15.536 19.325
173 HG21 ILE 24 HG21 ILE 24 30.552 13.804 19.607
174 HG22 ILE 24 HG22 ILE 24 30.109 12.797 20.976
175 HG23 ILE 24 HG23 ILE 24 29.405 12.469 19.381
176 HD11 ILE 24 HD11 ILE 24 28.481 16.095 17.408
177 HD12 ILE 24 HD12 ILE 24 29.552 16.267 18.807
178 HD13 ILE 24 HD13 ILE 24 29.700 14.852 17.733
179 H GLY 25 H GLY 25 26.865 11.164 22.007
180 HA2 GLY 25 HA2 GLY 25 27.393 9.769 23.736
181 HA3 GLY 25 HA3 GLY 25 28.880 10.707 23.951
182 H GLU 26 H GLU 26 28.608 12.787 25.092
183 HA GLU 26 HA GLU 26 26.711 12.722 27.370
184 HB2 GLU 26 HB2 GLU 26 28.483 12.909 28.996
185 HB3 GLU 26 HB3 GLU 26 28.527 11.385 28.115
186 HG2 GLU 26 HG2 GLU 26 30.294 12.222 26.669
187 HG3 GLU 26 HG3 GLU 26 30.207 13.813 27.435
188 H GLU 27 H GLU 27 27.554 14.609 24.912
189 HA GLU 27 HA GLU 27 27.403 17.129 26.434
190 HB2 GLU 27 HB2 GLU 27 29.781 16.249 26.057
191 HB3 GLU 27 HB3 GLU 27 29.486 16.466 24.317
192 HG2 GLU 27 HG2 GLU 27 29.386 18.767 24.487
193 HG3 GLU 27 HG3 GLU 27 28.953 18.718 26.205
194 H CYS 28 H CYS 28 26.608 18.906 25.249
195 HA CYS 28 HA CYS 28 25.009 18.331 22.853
196 HB2 CYS 28 HB2 CYS 28 24.038 19.772 24.519
197 HB3 CYS 28 HB3 CYS 28 25.488 20.769 24.578
198 H LYS 29 H LYS 29 25.549 18.773 20.790
199 HA LYS 29 HA LYS 29 27.329 21.039 20.189
200 HB2 LYS 29 HB2 LYS 29 27.640 18.233 19.034
201 HB3 LYS 29 HB3 LYS 29 28.227 19.665 18.217
202 HG2 LYS 29 HG2 LYS 29 29.141 18.725 20.962
203 HG3 LYS 29 HG3 LYS 29 30.007 18.486 19.444
204 HD2 LYS 29 HD2 LYS 29 30.160 20.971 19.168
205 HD3 LYS 29 HD3 LYS 29 29.473 21.177 20.782
206 HE2 LYS 29 HE2 LYS 29 32.028 19.637 20.142
207 HE3 LYS 29 HE3 LYS 29 31.979 21.316 20.689
208 HZ1 LYS 29 HZ1 LYS 29 30.943 20.570 22.749
209 HZ2 LYS 29 HZ2 LYS 29 31.001 18.981 22.244
210 HZ3 LYS 29 HZ3 LYS 29 32.371 19.799 22.529
211 H CYS 30 H CYS 30 26.769 22.140 18.352
212 HA CYS 30 HA CYS 30 24.061 21.559 17.338
213 HB2 CYS 30 HB2 CYS 30 25.761 23.949 16.660
214 HB3 CYS 30 HB3 CYS 30 24.045 23.721 16.458
215 H VAL 31 H VAL 31 23.564 21.570 15.118
216 HA VAL 31 HA VAL 31 25.654 20.559 13.263
217 HB VAL 31 HB VAL 31 23.872 18.744 12.649
218 HG11 VAL 31 HG11 VAL 31 25.503 18.549 15.215
219 HG12 VAL 31 HG12 VAL 31 24.937 17.193 14.206
220 HG13 VAL 31 HG13 VAL 31 26.106 18.349 13.554
221 HG21 VAL 31 HG21 VAL 31 22.539 17.855 14.442
222 HG22 VAL 31 HG22 VAL 31 23.079 19.117 15.568
223 HG23 VAL 31 HG23 VAL 31 22.064 19.531 14.176
224 HA PRO 32 HA PRO 32 23.835 23.137 10.389
225 HB2 PRO 32 HB2 PRO 32 24.416 22.019 7.960
226 HB3 PRO 32 HB3 PRO 32 25.684 22.553 9.111
227 HG2 PRO 32 HG2 PRO 32 24.566 19.745 8.787
228 HG3 PRO 32 HG3 PRO 32 26.287 20.259 8.748
229 HD2 PRO 32 HD2 PRO 32 25.132 19.312 10.984
230 HD3 PRO 32 HD3 PRO 32 26.294 20.660 11.072
231 H TYR 33 H TYR 33 22.321 23.513 8.658
232 HA TYR 33 HA TYR 33 19.923 21.773 8.636
233 HB2 TYR 33 HB2 TYR 33 20.470 24.614 7.750
234 HB3 TYR 33 HB3 TYR 33 19.099 23.728 7.098
235 HD1 TYR 33 HD1 TYR 33 17.579 22.467 8.832
236 HD2 TYR 33 HD2 TYR 33 20.024 25.903 9.731
237 HE1 TYR 33 HE1 TYR 33 16.141 22.973 10.800
238 HE2 TYR 33 HE2 TYR 33 18.563 26.418 11.691
239 HH TYR 33 HH TYR 33 16.824 25.720 12.995
Start of MODEL 13
1 H1 GLY 1 H1 GLY 1 31.890 18.276 36.924
2 H2 GLY 1 H2 GLY 1 33.477 18.031 37.277
3 H3 GLY 1 H3 GLY 1 32.479 16.746 36.989
4 HA2 GLY 1 HA2 GLY 1 33.429 18.746 35.058
5 HA3 GLY 1 HA3 GLY 1 33.798 17.015 35.064
6 H SER 2 H SER 2 32.338 15.579 34.135
7 HA SER 2 HA SER 2 30.571 16.621 32.165
8 HB2 SER 2 HB2 SER 2 30.771 13.763 33.165
9 HB3 SER 2 HB3 SER 2 30.119 14.307 31.609
10 HG SER 2 HG SER 2 32.324 13.578 31.528
11 H ALA 3 H ALA 3 28.424 16.958 32.055
12 HA ALA 3 HA ALA 3 26.814 16.426 34.514
13 HB1 ALA 3 HB1 ALA 3 26.978 18.965 32.849
14 HB2 ALA 3 HB2 ALA 3 26.042 18.730 34.337
15 HB3 ALA 3 HB3 ALA 3 27.814 18.691 34.401
16 H PHE 4 H PHE 4 26.753 15.165 31.660
17 HA PHE 4 HA PHE 4 25.357 14.412 30.149
18 HB2 PHE 4 HB2 PHE 4 23.179 14.867 32.196
19 HB3 PHE 4 HB3 PHE 4 23.055 13.872 30.756
20 HD1 PHE 4 HD1 PHE 4 24.372 11.771 30.521
21 HD2 PHE 4 HD2 PHE 4 24.371 14.056 34.179
22 HE1 PHE 4 HE1 PHE 4 25.345 9.837 31.732
23 HE2 PHE 4 HE2 PHE 4 25.365 12.123 35.382
24 HZ PHE 4 HZ PHE 4 25.861 10.014 34.158
25 H CYS 5 H CYS 5 24.079 14.772 28.482
26 HA CYS 5 HA CYS 5 23.306 17.585 27.869
27 HB2 CYS 5 HB2 CYS 5 24.846 16.408 26.383
28 HB3 CYS 5 HB3 CYS 5 23.673 15.135 26.113
29 H ASN 6 H ASN 6 21.238 18.029 26.893
30 HA ASN 6 HA ASN 6 19.138 15.940 26.997
31 HB2 ASN 6 HB2 ASN 6 18.682 17.214 29.006
32 HB3 ASN 6 HB3 ASN 6 18.906 18.744 28.180
33 HD21 ASN 6 HD22 ASN 6 16.836 15.798 28.171
34 HD22 ASN 6 HD21 ASN 6 15.381 16.683 27.678
35 H LEU 7 H LEU 7 18.320 15.764 24.965
36 HA LEU 7 HA LEU 7 19.271 17.427 22.890
37 HB2 LEU 7 HB2 LEU 7 18.415 15.046 22.718
38 HB3 LEU 7 HB3 LEU 7 16.776 15.693 22.820
39 HG LEU 7 HG LEU 7 17.152 16.987 20.726
40 HD11 LEU 7 HD11 LEU 7 19.115 16.373 19.304
41 HD12 LEU 7 HD12 LEU 7 19.580 17.292 20.732
42 HD13 LEU 7 HD13 LEU 7 19.832 15.525 20.694
43 HD21 LEU 7 HD21 LEU 7 17.155 15.041 19.216
44 HD22 LEU 7 HD22 LEU 7 17.769 14.008 20.525
45 HD23 LEU 7 HD23 LEU 7 16.153 14.741 20.642
46 H ALA 8 H ALA 8 16.034 17.658 24.492
47 HA ALA 8 HA ALA 8 15.114 19.803 22.896
48 HB1 ALA 8 HB1 ALA 8 13.516 20.160 24.714
49 HB2 ALA 8 HB2 ALA 8 13.731 18.426 24.410
50 HB3 ALA 8 HB3 ALA 8 14.520 19.191 25.813
51 H ARG 9 H ARG 9 17.162 20.021 25.923
52 HA ARG 9 HA ARG 9 17.203 22.857 26.056
53 HB2 ARG 9 HB2 ARG 9 17.684 21.019 27.781
54 HB3 ARG 9 HB3 ARG 9 19.241 20.774 26.985
55 HG2 ARG 9 HG2 ARG 9 19.821 23.089 27.415
56 HG3 ARG 9 HG3 ARG 9 18.236 23.375 28.166
57 HD2 ARG 9 HD2 ARG 9 19.858 23.056 29.957
58 HD3 ARG 9 HD3 ARG 9 18.765 21.666 29.900
59 HE ARG 9 HE ARG 9 21.227 21.320 28.349
60 HH11 ARG 9 HH11 ARG 9 19.957 20.896 31.632
61 HH12 ARG 9 HH12 ARG 9 21.082 19.562 31.906
62 HH21 ARG 9 HH21 ARG 9 22.742 19.843 28.984
63 HH22 ARG 9 HH22 ARG 9 22.524 18.987 30.499
64 H CYS 10 H CYS 10 19.229 20.487 24.455
65 HA CYS 10 HA CYS 10 21.329 22.280 23.587
66 HB2 CYS 10 HB2 CYS 10 21.571 19.804 23.934
67 HB3 CYS 10 HB3 CYS 10 20.516 19.555 22.535
68 H GLU 11 H GLU 11 18.399 20.886 22.090
69 HA GLU 11 HA GLU 11 18.652 21.848 19.473
70 HB2 GLU 11 HB2 GLU 11 16.344 21.174 21.277
71 HB3 GLU 11 HB3 GLU 11 16.001 21.976 19.757
72 HG2 GLU 11 HG2 GLU 11 17.886 19.622 19.641
73 HG3 GLU 11 HG3 GLU 11 16.184 19.319 19.974
74 H LEU 12 H LEU 12 17.006 23.443 22.253
75 HA LEU 12 HA LEU 12 16.619 25.950 20.879
76 HB2 LEU 12 HB2 LEU 12 16.565 25.123 23.802
77 HB3 LEU 12 HB3 LEU 12 16.160 26.748 23.248
78 HG LEU 12 HG LEU 12 14.677 24.163 22.584
79 HD11 LEU 12 HD11 LEU 12 12.864 25.171 23.851
80 HD12 LEU 12 HD12 LEU 12 14.338 25.169 24.846
81 HD13 LEU 12 HD13 LEU 12 13.797 26.673 24.069
82 HD21 LEU 12 HD21 LEU 12 14.125 26.992 21.581
83 HD22 LEU 12 HD22 LEU 12 14.492 25.555 20.592
84 HD23 LEU 12 HD23 LEU 12 12.977 25.638 21.483
85 H SER 13 H SER 13 19.194 24.844 23.113
86 HA SER 13 HA SER 13 20.688 27.265 23.220
87 HB2 SER 13 HB2 SER 13 21.762 24.418 23.130
88 HB3 SER 13 HB3 SER 13 22.674 25.856 23.602
89 HG SER 13 HG SER 13 20.412 24.741 24.907
90 H CYS 14 H CYS 14 20.792 24.646 20.741
91 HA CYS 14 HA CYS 14 22.635 26.154 19.044
92 HB2 CYS 14 HB2 CYS 14 20.903 23.723 18.520
93 HB3 CYS 14 HB3 CYS 14 22.093 24.385 17.364
94 H ARG 15 H ARG 15 19.062 25.936 19.160
95 HA ARG 15 HA ARG 15 18.466 27.429 16.835
96 HB2 ARG 15 HB2 ARG 15 16.974 26.268 18.821
97 HB3 ARG 15 HB3 ARG 15 16.825 27.950 19.307
98 HG2 ARG 15 HG2 ARG 15 14.984 27.579 17.883
99 HG3 ARG 15 HG3 ARG 15 16.167 28.369 16.828
100 HD2 ARG 15 HD2 ARG 15 15.360 26.537 15.573
101 HD3 ARG 15 HD3 ARG 15 16.938 26.005 16.161
102 HE ARG 15 HE ARG 15 14.281 25.246 17.345
103 HH11 ARG 15 HH11 ARG 15 17.594 24.219 16.659
104 HH12 ARG 15 HH12 ARG 15 17.162 22.523 16.910
105 HH21 ARG 15 HH21 ARG 15 13.916 23.099 17.683
106 HH22 ARG 15 HH22 ARG 15 15.164 21.923 17.298
107 H SER 16 H SER 16 19.381 28.578 20.039
108 HA SER 16 HA SER 16 19.146 31.367 19.680
109 HB2 SER 16 HB2 SER 16 19.665 29.980 21.783
110 HB3 SER 16 HB3 SER 16 21.353 29.988 21.241
111 HG SER 16 HG SER 16 21.156 31.677 22.565
112 H LEU 17 H LEU 17 21.425 29.252 18.101
113 HA LEU 17 HA LEU 17 23.018 31.595 17.144
114 HB2 LEU 17 HB2 LEU 17 23.922 28.810 16.656
115 HB3 LEU 17 HB3 LEU 17 24.863 30.269 16.846
116 HG LEU 17 HG LEU 17 23.518 28.656 19.039
117 HD11 LEU 17 HD11 LEU 17 25.412 27.492 18.013
118 HD12 LEU 17 HD12 LEU 17 26.455 28.908 18.287
119 HD13 LEU 17 HD13 LEU 17 25.804 27.991 19.663
120 HD21 LEU 17 HD21 LEU 17 23.776 31.072 19.700
121 HD22 LEU 17 HD22 LEU 17 24.855 30.028 20.628
122 HD23 LEU 17 HD23 LEU 17 25.491 30.993 19.275
123 H GLY 18 H GLY 18 20.497 29.601 16.246
124 HA2 GLY 18 HA2 GLY 18 19.252 29.961 14.302
125 HA3 GLY 18 HA3 GLY 18 20.686 30.467 13.420
126 H LEU 19 H LEU 19 20.673 27.378 15.191
127 HA LEU 19 HA LEU 19 20.086 25.820 12.769
128 HB2 LEU 19 HB2 LEU 19 22.136 24.695 12.678
129 HB3 LEU 19 HB3 LEU 19 22.426 26.405 12.512
130 HG LEU 19 HG LEU 19 22.885 24.875 15.086
131 HD11 LEU 19 HD11 LEU 19 25.324 24.947 14.379
132 HD12 LEU 19 HD12 LEU 19 24.328 23.955 13.310
133 HD13 LEU 19 HD13 LEU 19 24.806 25.584 12.811
134 HD21 LEU 19 HD21 LEU 19 22.794 27.268 15.492
135 HD22 LEU 19 HD22 LEU 19 24.455 26.728 15.614
136 HD23 LEU 19 HD23 LEU 19 23.909 27.583 14.146
137 H LEU 20 H LEU 20 20.959 23.329 13.544
138 HA LEU 20 HA LEU 20 18.863 22.664 15.544
139 HB2 LEU 20 HB2 LEU 20 20.215 21.108 13.345
140 HB3 LEU 20 HB3 LEU 20 19.160 20.350 14.534
141 HG LEU 20 HG LEU 20 18.370 22.518 12.555
142 HD11 LEU 20 HD11 LEU 20 17.176 20.722 11.393
143 HD12 LEU 20 HD12 LEU 20 18.896 20.336 11.504
144 HD13 LEU 20 HD13 LEU 20 17.743 19.535 12.595
145 HD21 LEU 20 HD21 LEU 20 16.016 21.750 13.184
146 HD22 LEU 20 HD22 LEU 20 16.740 20.941 14.585
147 HD23 LEU 20 HD23 LEU 20 16.865 22.713 14.382
148 H GLY 21 H GLY 21 19.260 20.911 17.039
149 HA2 GLY 21 HA2 GLY 21 22.090 20.911 18.078
150 HA3 GLY 21 HA3 GLY 21 20.671 20.886 19.098
151 H LYS 22 H LYS 22 23.021 19.107 18.845
152 HA LYS 22 HA LYS 22 21.587 16.499 18.999
153 HB2 LYS 22 HB2 LYS 22 24.306 17.061 17.722
154 HB3 LYS 22 HB3 LYS 22 23.755 15.449 18.161
155 HG2 LYS 22 HG2 LYS 22 22.411 17.265 16.149
156 HG3 LYS 22 HG3 LYS 22 23.466 15.889 15.783
157 HD2 LYS 22 HD2 LYS 22 21.812 14.438 17.035
158 HD3 LYS 22 HD3 LYS 22 20.712 15.839 17.078
159 HE2 LYS 22 HE2 LYS 22 20.836 15.944 14.562
160 HE3 LYS 22 HE3 LYS 22 21.874 14.518 14.590
161 HZ1 LYS 22 HZ1 LYS 22 19.988 13.405 15.811
162 HZ2 LYS 22 HZ2 LYS 22 19.023 14.666 15.312
163 HZ3 LYS 22 HZ3 LYS 22 19.759 13.680 14.223
164 H CYS 23 H CYS 23 22.384 15.034 20.515
165 HA CYS 23 HA CYS 23 24.262 16.120 22.547
166 HB2 CYS 23 HB2 CYS 23 22.104 13.990 22.543
167 HB3 CYS 23 HB3 CYS 23 23.353 14.065 23.750
168 H ILE 24 H ILE 24 26.260 15.665 21.988
169 HA ILE 24 HA ILE 24 27.046 12.993 20.907
170 HB ILE 24 HB ILE 24 28.673 15.505 21.458
171 HG12 ILE 24 HG12 ILE 24 27.155 15.831 19.564
172 HG13 ILE 24 HG13 ILE 24 28.823 15.784 19.047
173 HG21 ILE 24 HG21 ILE 24 30.399 14.322 19.961
174 HG22 ILE 24 HG22 ILE 24 30.278 13.766 21.612
175 HG23 ILE 24 HG23 ILE 24 29.519 12.824 20.293
176 HD11 ILE 24 HD11 ILE 24 28.502 13.458 18.213
177 HD12 ILE 24 HD12 ILE 24 26.801 13.524 18.739
178 HD13 ILE 24 HD13 ILE 24 27.383 14.611 17.470
179 H GLY 25 H GLY 25 29.228 12.332 22.368
180 HA2 GLY 25 HA2 GLY 25 28.185 11.179 24.680
181 HA3 GLY 25 HA3 GLY 25 29.897 11.393 24.370
182 H GLU 26 H GLU 26 27.200 12.345 26.108
183 HA GLU 26 HA GLU 26 26.704 13.598 27.888
184 HB2 GLU 26 HB2 GLU 26 29.682 13.537 28.394
185 HB3 GLU 26 HB3 GLU 26 28.449 13.975 29.580
186 HG2 GLU 26 HG2 GLU 26 27.472 11.773 29.536
187 HG3 GLU 26 HG3 GLU 26 28.441 11.268 28.152
188 H GLU 27 H GLU 27 27.798 15.110 25.303
189 HA GLU 27 HA GLU 27 27.565 17.844 26.475
190 HB2 GLU 27 HB2 GLU 27 29.747 16.676 24.744
191 HB3 GLU 27 HB3 GLU 27 29.320 18.368 24.534
192 HG2 GLU 27 HG2 GLU 27 30.043 17.230 27.260
193 HG3 GLU 27 HG3 GLU 27 31.239 17.850 26.122
194 H CYS 28 H CYS 28 26.670 19.422 25.228
195 HA CYS 28 HA CYS 28 25.002 18.687 22.950
196 HB2 CYS 28 HB2 CYS 28 24.217 20.240 24.644
197 HB3 CYS 28 HB3 CYS 28 25.614 21.287 24.388
198 H LYS 29 H LYS 29 25.291 19.179 20.863
199 HA LYS 29 HA LYS 29 27.492 20.888 19.833
200 HB2 LYS 29 HB2 LYS 29 28.401 18.571 19.911
201 HB3 LYS 29 HB3 LYS 29 26.953 17.978 19.100
202 HG2 LYS 29 HG2 LYS 29 28.928 18.024 17.648
203 HG3 LYS 29 HG3 LYS 29 27.575 18.937 17.009
204 HD2 LYS 29 HD2 LYS 29 29.838 19.972 16.667
205 HD3 LYS 29 HD3 LYS 29 28.644 21.030 17.398
206 HE2 LYS 29 HE2 LYS 29 29.636 20.419 19.657
207 HE3 LYS 29 HE3 LYS 29 30.927 19.564 18.813
208 HZ1 LYS 29 HZ1 LYS 29 30.275 22.444 18.404
209 HZ2 LYS 29 HZ2 LYS 29 31.406 21.928 19.432
210 HZ3 LYS 29 HZ3 LYS 29 31.609 21.641 17.815
211 H CYS 30 H CYS 30 26.950 21.775 17.737
212 HA CYS 30 HA CYS 30 24.068 21.464 17.061
213 HB2 CYS 30 HB2 CYS 30 25.782 23.790 16.267
214 HB3 CYS 30 HB3 CYS 30 24.046 23.619 16.255
215 H VAL 31 H VAL 31 23.373 21.558 14.939
216 HA VAL 31 HA VAL 31 25.226 20.641 12.809
217 HB VAL 31 HB VAL 31 23.415 18.922 12.171
218 HG11 VAL 31 HG11 VAL 31 25.599 18.272 12.967
219 HG12 VAL 31 HG12 VAL 31 25.085 18.435 14.663
220 HG13 VAL 31 HG13 VAL 31 24.365 17.191 13.608
221 HG21 VAL 31 HG21 VAL 31 22.101 17.957 13.968
222 HG22 VAL 31 HG22 VAL 31 22.656 19.222 15.101
223 HG23 VAL 31 HG23 VAL 31 21.650 19.633 13.701
224 HA PRO 32 HA PRO 32 22.868 23.345 10.274
225 HB2 PRO 32 HB2 PRO 32 23.193 22.282 7.762
226 HB3 PRO 32 HB3 PRO 32 24.532 23.022 8.690
227 HG2 PRO 32 HG2 PRO 32 23.817 20.073 8.529
228 HG3 PRO 32 HG3 PRO 32 25.423 20.833 8.257
229 HD2 PRO 32 HD2 PRO 32 24.716 19.745 10.607
230 HD3 PRO 32 HD3 PRO 32 25.691 21.248 10.562
231 H TYR 33 H TYR 33 21.034 23.595 8.962
232 HA TYR 33 HA TYR 33 18.785 21.784 9.409
233 HB2 TYR 33 HB2 TYR 33 19.151 24.459 8.040
234 HB3 TYR 33 HB3 TYR 33 17.698 23.524 7.763
235 HD1 TYR 33 HD1 TYR 33 16.313 22.735 9.718
236 HD2 TYR 33 HD2 TYR 33 19.283 25.833 10.043
237 HE1 TYR 33 HE1 TYR 33 15.214 23.560 11.794
238 HE2 TYR 33 HE2 TYR 33 18.160 26.686 12.089
239 HH TYR 33 HH TYR 33 15.305 25.056 13.514
Start of MODEL 14
1 H1 GLY 1 H1 GLY 1 34.173 15.980 30.345
2 H2 GLY 1 H2 GLY 1 33.382 15.001 29.270
3 H3 GLY 1 H3 GLY 1 32.924 15.027 30.847
4 HA2 GLY 1 HA2 GLY 1 32.629 17.184 28.884
5 HA3 GLY 1 HA3 GLY 1 31.328 16.243 29.631
6 H SER 2 H SER 2 30.370 18.174 30.393
7 HA SER 2 HA SER 2 31.589 19.503 32.753
8 HB2 SER 2 HB2 SER 2 31.261 21.727 31.536
9 HB3 SER 2 HB3 SER 2 32.642 20.744 31.030
10 HG SER 2 HG SER 2 30.782 21.674 29.438
11 H ALA 3 H ALA 3 28.699 19.079 30.667
12 HA ALA 3 HA ALA 3 27.064 20.356 32.803
13 HB1 ALA 3 HB1 ALA 3 26.027 21.809 31.099
14 HB2 ALA 3 HB2 ALA 3 27.775 22.081 31.146
15 HB3 ALA 3 HB3 ALA 3 27.064 21.103 29.844
16 H PHE 4 H PHE 4 27.251 17.888 30.617
17 HA PHE 4 HA PHE 4 25.974 16.235 29.866
18 HB2 PHE 4 HB2 PHE 4 25.679 15.764 32.234
19 HB3 PHE 4 HB3 PHE 4 24.203 16.724 32.261
20 HD1 PHE 4 HD2 PHE 4 25.790 13.642 30.894
21 HD2 PHE 4 HD1 PHE 4 22.110 15.843 31.336
22 HE1 PHE 4 HE2 PHE 4 24.515 11.652 30.146
23 HE2 PHE 4 HE1 PHE 4 20.837 13.865 30.540
24 HZ PHE 4 HZ PHE 4 22.034 11.757 29.963
25 H CYS 5 H CYS 5 24.941 16.181 28.076
26 HA CYS 5 HA CYS 5 23.302 18.315 27.169
27 HB2 CYS 5 HB2 CYS 5 24.892 16.964 25.857
28 HB3 CYS 5 HB3 CYS 5 23.807 15.593 25.932
29 H ASN 6 H ASN 6 21.234 18.665 27.333
30 HA ASN 6 HA ASN 6 19.263 16.398 27.351
31 HB2 ASN 6 HB2 ASN 6 18.893 17.815 29.291
32 HB3 ASN 6 HB3 ASN 6 19.007 19.275 28.312
33 HD21 ASN 6 HD22 ASN 6 17.055 16.259 28.677
34 HD22 ASN 6 HD21 ASN 6 15.678 16.939 27.814
35 H LEU 7 H LEU 7 18.593 16.005 25.270
36 HA LEU 7 HA LEU 7 19.319 17.613 23.067
37 HB2 LEU 7 HB2 LEU 7 18.675 15.178 23.056
38 HB3 LEU 7 HB3 LEU 7 16.989 15.657 23.272
39 HG LEU 7 HG LEU 7 17.021 16.817 21.078
40 HD11 LEU 7 HD11 LEU 7 19.883 15.775 20.911
41 HD12 LEU 7 HD12 LEU 7 18.952 16.392 19.531
42 HD13 LEU 7 HD13 LEU 7 19.363 17.478 20.858
43 HD21 LEU 7 HD21 LEU 7 18.071 13.960 20.956
44 HD22 LEU 7 HD22 LEU 7 16.378 14.437 21.223
45 HD23 LEU 7 HD23 LEU 7 17.166 14.804 19.680
46 H ALA 8 H ALA 8 16.166 17.804 24.851
47 HA ALA 8 HA ALA 8 15.080 19.756 23.092
48 HB1 ALA 8 HB1 ALA 8 13.590 20.295 24.985
49 HB2 ALA 8 HB2 ALA 8 13.755 18.542 24.754
50 HB3 ALA 8 HB3 ALA 8 14.623 19.354 26.073
51 H ARG 9 H ARG 9 17.106 20.298 26.084
52 HA ARG 9 HA ARG 9 17.223 23.118 25.904
53 HB2 ARG 9 HB2 ARG 9 17.832 21.357 27.780
54 HB3 ARG 9 HB3 ARG 9 19.409 21.296 26.986
55 HG2 ARG 9 HG2 ARG 9 19.308 23.867 27.134
56 HG3 ARG 9 HG3 ARG 9 18.014 23.637 28.312
57 HD2 ARG 9 HD2 ARG 9 20.890 22.627 28.489
58 HD3 ARG 9 HD3 ARG 9 20.183 23.928 29.438
59 HE ARG 9 HE ARG 9 18.634 22.220 30.450
60 HH11 ARG 9 HH11 ARG 9 21.590 20.844 29.025
61 HH12 ARG 9 HH12 ARG 9 21.751 19.715 30.347
62 HH21 ARG 9 HH21 ARG 9 18.966 20.680 32.056
63 HH22 ARG 9 HH22 ARG 9 20.395 19.655 31.931
64 H CYS 10 H CYS 10 19.224 20.601 24.455
65 HA CYS 10 HA CYS 10 21.321 22.327 23.471
66 HB2 CYS 10 HB2 CYS 10 21.527 19.853 23.932
67 HB3 CYS 10 HB3 CYS 10 20.491 19.569 22.523
68 H GLU 11 H GLU 11 18.412 20.769 21.960
69 HA GLU 11 HA GLU 11 18.760 21.974 19.439
70 HB2 GLU 11 HB2 GLU 11 16.313 20.925 20.866
71 HB3 GLU 11 HB3 GLU 11 16.193 21.761 19.316
72 HG2 GLU 11 HG2 GLU 11 17.845 20.184 18.323
73 HG3 GLU 11 HG3 GLU 11 17.907 19.285 19.832
74 H LEU 12 H LEU 12 17.023 23.223 22.356
75 HA LEU 12 HA LEU 12 16.319 25.762 21.222
76 HB2 LEU 12 HB2 LEU 12 16.778 24.794 24.061
77 HB3 LEU 12 HB3 LEU 12 16.277 26.439 23.712
78 HG LEU 12 HG LEU 12 14.683 24.031 22.745
79 HD11 LEU 12 HD11 LEU 12 13.201 24.424 24.675
80 HD12 LEU 12 HD12 LEU 12 14.825 23.967 25.204
81 HD13 LEU 12 HD13 LEU 12 14.318 25.667 25.286
82 HD21 LEU 12 HD21 LEU 12 14.177 26.138 21.576
83 HD22 LEU 12 HD22 LEU 12 12.841 25.671 22.628
84 HD23 LEU 12 HD23 LEU 12 13.948 26.964 23.136
85 H SER 13 H SER 13 19.275 24.732 22.915
86 HA SER 13 HA SER 13 20.459 27.369 23.088
87 HB2 SER 13 HB2 SER 13 21.850 24.660 23.105
88 HB3 SER 13 HB3 SER 13 22.572 26.208 23.575
89 HG SER 13 HG SER 13 20.334 24.941 24.791
90 H CYS 14 H CYS 14 20.792 24.706 20.719
91 HA CYS 14 HA CYS 14 22.494 26.257 18.925
92 HB2 CYS 14 HB2 CYS 14 20.842 23.743 18.501
93 HB3 CYS 14 HB3 CYS 14 21.997 24.407 17.317
94 H ARG 15 H ARG 15 18.931 25.933 19.205
95 HA ARG 15 HA ARG 15 18.241 27.398 16.837
96 HB2 ARG 15 HB2 ARG 15 16.648 26.060 18.106
97 HB3 ARG 15 HB3 ARG 15 16.814 27.097 19.518
98 HG2 ARG 15 HG2 ARG 15 15.864 28.958 18.167
99 HG3 ARG 15 HG3 ARG 15 15.587 27.858 16.813
100 HD2 ARG 15 HD2 ARG 15 14.425 27.573 19.645
101 HD3 ARG 15 HD3 ARG 15 13.568 28.266 18.263
102 HE ARG 15 HE ARG 15 14.501 25.727 17.457
103 HH11 ARG 15 HH21 ARG 15 12.077 26.816 19.804
104 HH12 ARG 15 HH22 ARG 15 11.052 25.461 19.392
105 HH21 ARG 15 HH11 ARG 15 13.277 24.101 17.122
106 HH22 ARG 15 HH12 ARG 15 11.718 23.917 17.921
107 H SER 16 H SER 16 19.213 28.547 20.093
108 HA SER 16 HA SER 16 18.889 31.343 19.481
109 HB2 SER 16 HB2 SER 16 20.650 29.910 21.489
110 HB3 SER 16 HB3 SER 16 20.601 31.669 21.333
111 HG SER 16 HG SER 16 18.638 31.744 22.114
112 H LEU 17 H LEU 17 21.239 29.123 18.134
113 HA LEU 17 HA LEU 17 22.766 31.480 17.097
114 HB2 LEU 17 HB2 LEU 17 23.492 28.645 16.536
115 HB3 LEU 17 HB3 LEU 17 24.507 30.063 16.479
116 HG LEU 17 HG LEU 17 23.484 28.571 18.918
117 HD11 LEU 17 HD11 LEU 17 26.281 28.781 17.735
118 HD12 LEU 17 HD12 LEU 17 25.838 27.931 19.230
119 HD13 LEU 17 HD13 LEU 17 25.212 27.360 17.681
120 HD21 LEU 17 HD21 LEU 17 23.813 31.008 19.412
121 HD22 LEU 17 HD22 LEU 17 25.031 30.014 20.227
122 HD23 LEU 17 HD23 LEU 17 25.463 30.913 18.757
123 H GLY 18 H GLY 18 20.340 29.148 16.233
124 HA2 GLY 18 HA2 GLY 18 18.891 29.531 14.384
125 HA3 GLY 18 HA3 GLY 18 20.204 30.229 13.455
126 H LEU 19 H LEU 19 20.480 27.109 15.201
127 HA LEU 19 HA LEU 19 19.949 25.528 12.796
128 HB2 LEU 19 HB2 LEU 19 22.080 24.533 12.606
129 HB3 LEU 19 HB3 LEU 19 22.259 26.257 12.418
130 HG LEU 19 HG LEU 19 22.882 24.805 15.007
131 HD11 LEU 19 HD11 LEU 19 24.327 23.920 13.187
132 HD12 LEU 19 HD12 LEU 19 24.724 25.574 12.682
133 HD13 LEU 19 HD13 LEU 19 25.289 24.960 14.244
134 HD21 LEU 19 HD21 LEU 19 23.717 27.533 13.973
135 HD22 LEU 19 HD22 LEU 19 22.651 27.152 15.349
136 HD23 LEU 19 HD23 LEU 19 24.357 26.746 15.439
137 H LEU 20 H LEU 20 20.952 23.089 13.463
138 HA LEU 20 HA LEU 20 18.956 22.301 15.463
139 HB2 LEU 20 HB2 LEU 20 19.082 21.313 13.160
140 HB3 LEU 20 HB3 LEU 20 20.650 20.648 13.571
141 HG LEU 20 HG LEU 20 19.623 19.258 15.342
142 HD11 LEU 20 HD11 LEU 20 17.149 18.987 15.350
143 HD12 LEU 20 HD12 LEU 20 17.619 20.594 15.901
144 HD13 LEU 20 HD13 LEU 20 16.992 20.367 14.257
145 HD21 LEU 20 HD21 LEU 20 19.935 18.383 13.048
146 HD22 LEU 20 HD22 LEU 20 18.494 17.693 13.824
147 HD23 LEU 20 HD23 LEU 20 18.321 18.968 12.605
148 H GLY 21 H GLY 21 19.430 21.013 17.303
149 HA2 GLY 21 HA2 GLY 21 22.292 21.013 18.203
150 HA3 GLY 21 HA3 GLY 21 20.904 21.034 19.278
151 H LYS 22 H LYS 22 23.277 19.215 18.922
152 HA LYS 22 HA LYS 22 21.794 16.634 19.187
153 HB2 LYS 22 HB2 LYS 22 24.430 17.074 17.706
154 HB3 LYS 22 HB3 LYS 22 23.741 15.492 18.084
155 HG2 LYS 22 HG2 LYS 22 22.441 17.575 16.311
156 HG3 LYS 22 HG3 LYS 22 23.385 16.180 15.752
157 HD2 LYS 22 HD2 LYS 22 21.728 14.666 16.782
158 HD3 LYS 22 HD3 LYS 22 20.780 16.056 17.331
159 HE2 LYS 22 HE2 LYS 22 20.613 16.862 14.968
160 HE3 LYS 22 HE3 LYS 22 21.478 15.409 14.432
161 HZ1 LYS 22 HZ1 LYS 22 19.106 15.123 14.226
162 HZ2 LYS 22 HZ2 LYS 22 19.677 14.093 15.385
163 HZ3 LYS 22 HZ3 LYS 22 18.868 15.460 15.833
164 H CYS 23 H CYS 23 22.670 15.126 20.560
165 HA CYS 23 HA CYS 23 24.712 16.073 22.483
166 HB2 CYS 23 HB2 CYS 23 22.730 13.777 22.472
167 HB3 CYS 23 HB3 CYS 23 23.843 14.151 23.752
168 H ILE 24 H ILE 24 26.738 15.469 22.097
169 HA ILE 24 HA ILE 24 27.353 13.014 20.493
170 HB ILE 24 HB ILE 24 28.953 15.550 20.982
171 HG12 ILE 24 HG12 ILE 24 29.059 15.664 18.536
172 HG13 ILE 24 HG13 ILE 24 28.091 14.212 18.368
173 HG21 ILE 24 HG21 ILE 24 30.498 13.606 21.116
174 HG22 ILE 24 HG22 ILE 24 29.834 12.963 19.599
175 HG23 ILE 24 HG23 ILE 24 30.739 14.492 19.622
176 HD11 ILE 24 HD11 ILE 24 27.009 16.720 19.694
177 HD12 ILE 24 HD12 ILE 24 26.939 16.443 17.939
178 HD13 ILE 24 HD13 ILE 24 26.103 15.336 19.030
179 H GLY 25 H GLY 25 27.564 11.375 21.767
180 HA2 GLY 25 HA2 GLY 25 27.981 10.013 23.575
181 HA3 GLY 25 HA3 GLY 25 29.256 11.123 24.080
182 H GLU 26 H GLU 26 28.526 13.090 25.194
183 HA GLU 26 HA GLU 26 26.017 12.922 26.750
184 HB2 GLU 26 HB2 GLU 26 27.024 12.826 28.861
185 HB3 GLU 26 HB3 GLU 26 27.764 11.545 27.894
186 HG2 GLU 26 HG2 GLU 26 29.573 13.332 27.321
187 HG3 GLU 26 HG3 GLU 26 28.883 14.229 28.674
188 H GLU 27 H GLU 27 27.923 14.909 24.917
189 HA GLU 27 HA GLU 27 27.016 17.333 26.431
190 HB2 GLU 27 HB2 GLU 27 29.721 16.894 25.152
191 HB3 GLU 27 HB3 GLU 27 29.109 18.475 25.618
192 HG2 GLU 27 HG2 GLU 27 29.580 16.141 27.519
193 HG3 GLU 27 HG3 GLU 27 30.650 17.511 27.289
194 H CYS 28 H CYS 28 26.471 19.153 25.286
195 HA CYS 28 HA CYS 28 25.182 18.675 22.767
196 HB2 CYS 28 HB2 CYS 28 24.224 20.006 24.585
197 HB3 CYS 28 HB3 CYS 28 25.565 21.139 24.491
198 H LYS 29 H LYS 29 25.757 19.174 20.748
199 HA LYS 29 HA LYS 29 27.468 21.482 20.105
200 HB2 LYS 29 HB2 LYS 29 27.850 18.704 18.897
201 HB3 LYS 29 HB3 LYS 29 28.567 20.169 18.291
202 HG2 LYS 29 HG2 LYS 29 29.183 18.882 20.977
203 HG3 LYS 29 HG3 LYS 29 30.168 18.779 19.524
204 HD2 LYS 29 HD2 LYS 29 30.585 21.234 19.605
205 HD3 LYS 29 HD3 LYS 29 29.601 21.341 21.072
206 HE2 LYS 29 HE2 LYS 29 31.198 19.460 21.983
207 HE3 LYS 29 HE3 LYS 29 32.280 19.957 20.675
208 HZ1 LYS 29 HZ1 LYS 29 32.194 22.244 21.660
209 HZ2 LYS 29 HZ2 LYS 29 31.251 21.647 22.889
210 HZ3 LYS 29 HZ3 LYS 29 32.800 21.148 22.708
211 H CYS 30 H CYS 30 27.122 22.080 17.697
212 HA CYS 30 HA CYS 30 24.283 21.459 16.998
213 HB2 CYS 30 HB2 CYS 30 25.686 23.993 16.235
214 HB3 CYS 30 HB3 CYS 30 23.982 23.617 16.282
215 H VAL 31 H VAL 31 23.591 21.459 14.873
216 HA VAL 31 HA VAL 31 25.503 21.095 12.623
217 HB VAL 31 HB VAL 31 24.113 18.974 12.021
218 HG11 VAL 31 HG11 VAL 31 25.642 17.513 13.176
219 HG12 VAL 31 HG12 VAL 31 26.502 18.949 12.614
220 HG13 VAL 31 HG13 VAL 31 26.067 18.788 14.334
221 HG21 VAL 31 HG21 VAL 31 22.385 19.203 13.756
222 HG22 VAL 31 HG22 VAL 31 23.233 17.650 13.788
223 HG23 VAL 31 HG23 VAL 31 23.626 18.898 14.994
224 HA PRO 32 HA PRO 32 22.130 22.893 10.280
225 HB2 PRO 32 HB2 PRO 32 22.137 21.625 7.851
226 HB3 PRO 32 HB3 PRO 32 23.423 22.765 8.361
227 HG2 PRO 32 HG2 PRO 32 23.438 19.728 8.601
228 HG3 PRO 32 HG3 PRO 32 24.687 20.781 7.866
229 HD2 PRO 32 HD2 PRO 32 24.925 19.939 10.389
230 HD3 PRO 32 HD3 PRO 32 25.361 21.616 9.987
231 H TYR 33 H TYR 33 20.049 22.615 9.635
232 HA TYR 33 HA TYR 33 18.457 20.535 10.854
233 HB2 TYR 33 HB2 TYR 33 17.768 22.775 8.908
234 HB3 TYR 33 HB3 TYR 33 16.577 21.693 9.594
235 HD1 TYR 33 HD2 TYR 33 16.605 21.486 12.246
236 HD2 TYR 33 HD1 TYR 33 17.987 24.867 9.974
237 HE1 TYR 33 HE2 TYR 33 16.187 22.971 14.206
238 HE2 TYR 33 HE1 TYR 33 17.536 26.364 11.915
239 HH TYR 33 HH TYR 33 16.688 26.524 14.055
Start of MODEL 15
1 H1 GLY 1 H1 GLY 1 34.853 18.008 27.812
2 H2 GLY 1 H2 GLY 1 35.050 19.625 27.523
3 H3 GLY 1 H3 GLY 1 33.818 18.792 26.807
4 HA2 GLY 1 HA2 GLY 1 34.089 19.337 29.680
5 HA3 GLY 1 HA3 GLY 1 32.936 20.100 28.574
6 H SER 2 H SER 2 31.705 19.100 30.608
7 HA SER 2 HA SER 2 30.300 16.726 29.553
8 HB2 SER 2 HB2 SER 2 32.225 15.965 31.075
9 HB3 SER 2 HB3 SER 2 31.311 16.674 32.417
10 HG SER 2 HG SER 2 30.952 14.387 31.949
11 H ALA 3 H ALA 3 28.539 16.134 31.185
12 HA ALA 3 HA ALA 3 26.444 16.593 31.861
13 HB1 ALA 3 HB1 ALA 3 26.355 17.734 34.007
14 HB2 ALA 3 HB2 ALA 3 27.807 16.722 33.883
15 HB3 ALA 3 HB3 ALA 3 27.937 18.487 33.698
16 H PHE 4 H PHE 4 26.801 17.977 29.480
17 HA PHE 4 HA PHE 4 24.881 20.209 29.841
18 HB2 PHE 4 HB2 PHE 4 27.525 20.800 29.651
19 HB3 PHE 4 HB3 PHE 4 27.137 20.759 27.947
20 HD1 PHE 4 HD2 PHE 4 26.243 22.257 31.246
21 HD2 PHE 4 HD1 PHE 4 25.960 22.668 26.966
22 HE1 PHE 4 HE2 PHE 4 25.372 24.565 31.528
23 HE2 PHE 4 HE1 PHE 4 25.090 24.975 27.261
24 HZ PHE 4 HZ PHE 4 24.795 25.931 29.529
25 H CYS 5 H CYS 5 24.479 17.549 28.890
26 HA CYS 5 HA CYS 5 24.115 17.607 25.970
27 HB2 CYS 5 HB2 CYS 5 24.953 15.816 27.736
28 HB3 CYS 5 HB3 CYS 5 23.299 15.326 27.725
29 H ASN 6 H ASN 6 21.918 15.731 26.448
30 HA ASN 6 HA ASN 6 19.757 15.482 26.036
31 HB2 ASN 6 HB2 ASN 6 19.479 16.409 28.320
32 HB3 ASN 6 HB3 ASN 6 19.258 18.008 27.626
33 HD21 ASN 6 HD22 ASN 6 17.224 17.482 29.075
34 HD22 ASN 6 HD21 ASN 6 15.877 16.721 28.229
35 H LEU 7 H LEU 7 18.901 15.584 24.134
36 HA LEU 7 HA LEU 7 19.263 17.515 22.105
37 HB2 LEU 7 HB2 LEU 7 18.400 15.189 21.821
38 HB3 LEU 7 HB3 LEU 7 16.927 15.661 22.673
39 HG LEU 7 HG LEU 7 16.324 17.211 20.848
40 HD11 LEU 7 HD11 LEU 7 18.547 17.751 19.967
41 HD12 LEU 7 HD12 LEU 7 18.803 16.050 19.513
42 HD13 LEU 7 HD13 LEU 7 17.565 17.025 18.695
43 HD21 LEU 7 HD21 LEU 7 15.502 14.885 20.839
44 HD22 LEU 7 HD22 LEU 7 15.773 15.477 19.192
45 HD23 LEU 7 HD23 LEU 7 16.947 14.373 19.937
46 H ALA 8 H ALA 8 16.704 17.309 24.611
47 HA ALA 8 HA ALA 8 15.034 19.342 23.551
48 HB1 ALA 8 HB1 ALA 8 15.365 18.433 26.436
49 HB2 ALA 8 HB2 ALA 8 13.943 19.226 25.730
50 HB3 ALA 8 HB3 ALA 8 14.392 17.591 25.206
51 H ARG 9 H ARG 9 17.818 19.592 25.813
52 HA ARG 9 HA ARG 9 17.494 22.385 26.399
53 HB2 ARG 9 HB2 ARG 9 18.486 20.393 27.763
54 HB3 ARG 9 HB3 ARG 9 19.906 20.553 26.730
55 HG2 ARG 9 HG2 ARG 9 20.106 22.891 27.399
56 HG3 ARG 9 HG3 ARG 9 18.673 22.725 28.443
57 HD2 ARG 9 HD2 ARG 9 19.871 20.929 29.730
58 HD3 ARG 9 HD3 ARG 9 21.319 21.232 28.759
59 HE ARG 9 HE ARG 9 20.372 23.671 30.019
60 HH11 ARG 9 HH11 ARG 9 22.179 20.742 30.796
61 HH12 ARG 9 HH12 ARG 9 22.906 21.481 32.188
62 HH21 ARG 9 HH21 ARG 9 21.324 24.507 31.754
63 HH22 ARG 9 HH22 ARG 9 22.603 23.634 32.613
64 H CYS 10 H CYS 10 19.441 20.376 24.269
65 HA CYS 10 HA CYS 10 21.277 22.324 23.351
66 HB2 CYS 10 HB2 CYS 10 21.524 19.817 23.513
67 HB3 CYS 10 HB3 CYS 10 20.443 19.664 22.131
68 H GLU 11 H GLU 11 18.257 20.971 21.863
69 HA GLU 11 HA GLU 11 18.416 22.214 19.351
70 HB2 GLU 11 HB2 GLU 11 16.192 21.338 21.174
71 HB3 GLU 11 HB3 GLU 11 15.757 22.338 19.799
72 HG2 GLU 11 HG2 GLU 11 17.570 19.942 19.367
73 HG3 GLU 11 HG3 GLU 11 15.829 19.728 19.535
74 H LEU 12 H LEU 12 17.127 23.641 22.368
75 HA LEU 12 HA LEU 12 16.378 26.144 21.145
76 HB2 LEU 12 HB2 LEU 12 15.520 24.800 23.269
77 HB3 LEU 12 HB3 LEU 12 16.768 25.680 24.117
78 HG LEU 12 HG LEU 12 14.556 26.654 24.378
79 HD11 LEU 12 HD11 LEU 12 16.551 28.178 24.393
80 HD12 LEU 12 HD12 LEU 12 16.168 28.604 22.703
81 HD13 LEU 12 HD13 LEU 12 15.011 28.958 23.991
82 HD21 LEU 12 HD21 LEU 12 13.306 27.692 22.610
83 HD22 LEU 12 HD22 LEU 12 14.548 27.316 21.407
84 HD23 LEU 12 HD23 LEU 12 13.613 26.006 22.168
85 H SER 13 H SER 13 19.213 25.052 23.005
86 HA SER 13 HA SER 13 20.545 27.623 23.052
87 HB2 SER 13 HB2 SER 13 21.602 24.794 23.331
88 HB3 SER 13 HB3 SER 13 22.544 26.267 23.623
89 HG SER 13 HG SER 13 21.508 25.227 25.464
90 H CYS 14 H CYS 14 20.706 24.841 20.729
91 HA CYS 14 HA CYS 14 22.628 26.185 19.017
92 HB2 CYS 14 HB2 CYS 14 20.605 24.023 18.340
93 HB3 CYS 14 HB3 CYS 14 21.958 24.524 17.307
94 H ARG 15 H ARG 15 19.096 26.455 19.227
95 HA ARG 15 HA ARG 15 18.450 27.437 16.736
96 HB2 ARG 15 HB2 ARG 15 17.031 27.021 18.991
97 HB3 ARG 15 HB3 ARG 15 17.223 28.752 19.171
98 HG2 ARG 15 HG2 ARG 15 15.329 28.848 17.932
99 HG3 ARG 15 HG3 ARG 15 16.398 28.641 16.547
100 HD2 ARG 15 HD2 ARG 15 14.838 26.500 18.042
101 HD3 ARG 15 HD3 ARG 15 14.498 27.101 16.413
102 HE ARG 15 HE ARG 15 16.920 26.147 15.946
103 HH11 ARG 15 HH11 ARG 15 14.217 24.538 17.484
104 HH12 ARG 15 HH12 ARG 15 14.988 22.958 17.323
105 HH21 ARG 15 HH22 ARG 15 17.890 24.172 15.980
106 HH22 ARG 15 HH21 ARG 15 16.983 22.753 16.501
107 H SER 16 H SER 16 19.911 29.386 19.336
108 HA SER 16 HA SER 16 19.413 31.921 18.101
109 HB2 SER 16 HB2 SER 16 20.937 32.817 19.796
110 HB3 SER 16 HB3 SER 16 19.770 31.679 20.488
111 HG SER 16 HG SER 16 21.713 31.130 21.314
112 H LEU 17 H LEU 17 21.759 29.569 17.223
113 HA LEU 17 HA LEU 17 23.341 31.615 15.718
114 HB2 LEU 17 HB2 LEU 17 24.218 28.778 15.969
115 HB3 LEU 17 HB3 LEU 17 25.182 30.220 15.733
116 HG LEU 17 HG LEU 17 23.786 29.331 18.273
117 HD11 LEU 17 HD11 LEU 17 25.686 27.898 17.668
118 HD12 LEU 17 HD12 LEU 17 26.738 29.324 17.522
119 HD13 LEU 17 HD13 LEU 17 26.064 28.864 19.102
120 HD21 LEU 17 HD21 LEU 17 25.216 31.110 19.384
121 HD22 LEU 17 HD22 LEU 17 25.769 31.633 17.784
122 HD23 LEU 17 HD23 LEU 17 24.067 31.821 18.247
123 H GLY 18 H GLY 18 20.738 29.754 15.296
124 HA2 GLY 18 HA2 GLY 18 19.475 29.732 13.363
125 HA3 GLY 18 HA3 GLY 18 20.916 29.953 12.374
126 H LEU 19 H LEU 19 20.957 27.256 14.652
127 HA LEU 19 HA LEU 19 20.350 25.366 12.431
128 HB2 LEU 19 HB2 LEU 19 22.383 24.267 12.586
129 HB3 LEU 19 HB3 LEU 19 22.712 25.959 12.331
130 HG LEU 19 HG LEU 19 22.920 24.605 15.033
131 HD11 LEU 19 HD11 LEU 19 24.499 23.556 13.440
132 HD12 LEU 19 HD12 LEU 19 25.043 25.151 12.893
133 HD13 LEU 19 HD13 LEU 19 25.413 24.606 14.533
134 HD21 LEU 19 HD21 LEU 19 22.820 27.024 15.253
135 HD22 LEU 19 HD22 LEU 19 24.453 26.466 15.576
136 HD23 LEU 19 HD23 LEU 19 24.077 27.219 14.008
137 H LEU 20 H LEU 20 21.127 23.001 13.433
138 HA LEU 20 HA LEU 20 18.902 22.411 15.314
139 HB2 LEU 20 HB2 LEU 20 20.447 20.777 13.294
140 HB3 LEU 20 HB3 LEU 20 19.336 20.053 14.439
141 HG LEU 20 HG LEU 20 18.507 22.197 12.452
142 HD11 LEU 20 HD11 LEU 20 19.387 20.228 11.257
143 HD12 LEU 20 HD12 LEU 20 18.296 19.172 12.179
144 HD13 LEU 20 HD13 LEU 20 17.632 20.375 11.055
145 HD21 LEU 20 HD21 LEU 20 16.925 20.159 14.085
146 HD22 LEU 20 HD22 LEU 20 16.920 21.920 14.304
147 HD23 LEU 20 HD23 LEU 20 16.235 21.211 12.840
148 H GLY 21 H GLY 21 19.220 20.865 17.005
149 HA2 GLY 21 HA2 GLY 21 22.033 20.764 18.085
150 HA3 GLY 21 HA3 GLY 21 20.586 20.822 19.078
151 H LYS 22 H LYS 22 22.854 18.925 18.953
152 HA LYS 22 HA LYS 22 21.261 16.467 19.312
153 HB2 LYS 22 HB2 LYS 22 23.817 16.690 17.653
154 HB3 LYS 22 HB3 LYS 22 23.258 15.170 18.334
155 HG2 LYS 22 HG2 LYS 22 21.746 16.839 16.290
156 HG3 LYS 22 HG3 LYS 22 22.628 15.338 15.997
157 HD2 LYS 22 HD2 LYS 22 21.071 14.227 17.687
158 HD3 LYS 22 HD3 LYS 22 20.104 15.717 17.632
159 HE2 LYS 22 HE2 LYS 22 19.918 15.428 15.150
160 HE3 LYS 22 HE3 LYS 22 20.775 13.886 15.300
161 HZ1 LYS 22 HZ1 LYS 22 18.913 13.174 16.830
162 HZ2 LYS 22 HZ2 LYS 22 18.129 14.576 16.445
163 HZ3 LYS 22 HZ3 LYS 22 18.433 13.503 15.272
164 H CYS 23 H CYS 23 22.170 14.965 20.721
165 HA CYS 23 HA CYS 23 24.151 16.064 22.683
166 HB2 CYS 23 HB2 CYS 23 22.103 16.195 23.758
167 HB3 CYS 23 HB3 CYS 23 21.466 14.757 22.973
168 H ILE 24 H ILE 24 25.935 15.005 22.845
169 HA ILE 24 HA ILE 24 26.059 12.060 22.558
170 HB ILE 24 HB ILE 24 28.172 13.770 21.222
171 HG12 ILE 24 HG12 ILE 24 27.067 12.977 19.006
172 HG13 ILE 24 HG13 ILE 24 25.566 12.955 19.913
173 HG21 ILE 24 HG21 ILE 24 27.231 10.896 20.817
174 HG22 ILE 24 HG22 ILE 24 28.625 11.664 20.031
175 HG23 ILE 24 HG23 ILE 24 28.645 11.397 21.772
176 HD11 ILE 24 HD11 ILE 24 25.873 15.056 18.667
177 HD12 ILE 24 HD12 ILE 24 25.941 15.437 20.394
178 HD13 ILE 24 HD13 ILE 24 27.440 15.333 19.449
179 H GLY 25 H GLY 25 27.207 11.227 24.219
180 HA2 GLY 25 HA2 GLY 25 28.756 10.951 25.886
181 HA3 GLY 25 HA3 GLY 25 29.809 11.995 24.925
182 H GLU 26 H GLU 26 26.794 12.691 26.762
183 HA GLU 26 HA GLU 26 26.211 14.283 28.212
184 HB2 GLU 26 HB2 GLU 26 28.933 13.815 29.350
185 HB3 GLU 26 HB3 GLU 26 27.686 14.778 30.134
186 HG2 GLU 26 HG2 GLU 26 26.836 12.042 29.238
187 HG3 GLU 26 HG3 GLU 26 28.009 12.134 30.521
188 H GLU 27 H GLU 27 27.568 15.256 25.627
189 HA GLU 27 HA GLU 27 27.547 18.128 26.460
190 HB2 GLU 27 HB2 GLU 27 29.366 16.887 24.386
191 HB3 GLU 27 HB3 GLU 27 29.185 18.613 24.680
192 HG2 GLU 27 HG2 GLU 27 30.104 18.310 26.960
193 HG3 GLU 27 HG3 GLU 27 30.310 16.581 26.642
194 H CYS 28 H CYS 28 26.392 19.509 25.202
195 HA CYS 28 HA CYS 28 24.808 18.609 22.912
196 HB2 CYS 28 HB2 CYS 28 23.848 20.209 24.395
197 HB3 CYS 28 HB3 CYS 28 25.283 21.223 24.363
198 H LYS 29 H LYS 29 25.342 18.800 20.807
199 HA LYS 29 HA LYS 29 27.288 20.853 19.946
200 HB2 LYS 29 HB2 LYS 29 28.651 18.856 20.145
201 HB3 LYS 29 HB3 LYS 29 27.582 17.967 19.050
202 HG2 LYS 29 HG2 LYS 29 28.258 19.224 17.166
203 HG3 LYS 29 HG3 LYS 29 28.738 20.615 18.138
204 HD2 LYS 29 HD2 LYS 29 30.703 19.570 17.212
205 HD3 LYS 29 HD3 LYS 29 30.680 19.481 18.982
206 HE2 LYS 29 HE2 LYS 29 29.865 17.125 18.837
207 HE3 LYS 29 HE3 LYS 29 29.902 17.219 17.073
208 HZ1 LYS 29 HZ1 LYS 29 31.857 16.159 18.054
209 HZ2 LYS 29 HZ2 LYS 29 32.297 17.487 17.181
210 HZ3 LYS 29 HZ3 LYS 29 32.279 17.538 18.834
211 H CYS 30 H CYS 30 26.753 21.818 18.052
212 HA CYS 30 HA CYS 30 24.010 21.241 17.155
213 HB2 CYS 30 HB2 CYS 30 25.653 23.704 16.575
214 HB3 CYS 30 HB3 CYS 30 23.926 23.477 16.430
215 H VAL 31 H VAL 31 23.377 21.115 15.033
216 HA VAL 31 HA VAL 31 25.445 20.316 13.042
217 HB VAL 31 HB VAL 31 23.706 18.512 12.379
218 HG11 VAL 31 HG11 VAL 31 25.420 18.327 14.873
219 HG12 VAL 31 HG12 VAL 31 24.734 16.930 14.003
220 HG13 VAL 31 HG13 VAL 31 25.895 17.983 13.188
221 HG21 VAL 31 HG21 VAL 31 22.910 18.772 15.304
222 HG22 VAL 31 HG22 VAL 31 21.890 19.246 13.927
223 HG23 VAL 31 HG23 VAL 31 22.368 17.561 14.119
224 HA PRO 32 HA PRO 32 23.319 22.837 10.238
225 HB2 PRO 32 HB2 PRO 32 23.871 21.749 7.786
226 HB3 PRO 32 HB3 PRO 32 25.125 22.491 8.825
227 HG2 PRO 32 HG2 PRO 32 24.420 19.543 8.594
228 HG3 PRO 32 HG3 PRO 32 26.041 20.304 8.510
229 HD2 PRO 32 HD2 PRO 32 25.077 19.214 10.784
230 HD3 PRO 32 HD3 PRO 32 26.090 20.688 10.818
231 H TYR 33 H TYR 33 21.511 23.126 9.032
232 HA TYR 33 HA TYR 33 19.349 21.144 8.995
233 HB2 TYR 33 HB2 TYR 33 19.694 23.946 7.890
234 HB3 TYR 33 HB3 TYR 33 18.360 22.933 7.378
235 HD1 TYR 33 HD2 TYR 33 16.701 22.032 9.021
236 HD2 TYR 33 HD1 TYR 33 19.537 25.117 10.018
237 HE1 TYR 33 HE2 TYR 33 15.317 22.661 10.995
238 HE2 TYR 33 HE1 TYR 33 18.141 25.755 11.988
239 HH TYR 33 HH TYR 33 16.260 25.348 13.167
Start of MODEL 16
1 H1 GLY 1 H1 GLY 1 30.153 17.917 29.351
2 H2 GLY 1 H2 GLY 1 31.401 17.838 30.434
3 H3 GLY 1 H3 GLY 1 31.273 16.699 29.269
4 HA2 GLY 1 HA2 GLY 1 33.028 18.215 28.768
5 HA3 GLY 1 HA3 GLY 1 31.730 18.330 27.563
6 H SER 2 H SER 2 32.128 20.487 26.984
7 HA SER 2 HA SER 2 32.168 22.676 28.929
8 HB2 SER 2 HB2 SER 2 31.886 24.098 26.911
9 HB3 SER 2 HB3 SER 2 33.292 23.032 26.835
10 HG SER 2 HG SER 2 31.912 23.169 24.926
11 H ALA 3 H ALA 3 29.820 20.921 27.028
12 HA ALA 3 HA ALA 3 27.663 21.993 28.753
13 HB1 ALA 3 HB1 ALA 3 27.388 22.873 26.436
14 HB2 ALA 3 HB2 ALA 3 27.402 21.210 25.813
15 HB3 ALA 3 HB3 ALA 3 26.090 21.756 26.879
16 H PHE 4 H PHE 4 25.791 20.087 28.011
17 HA PHE 4 HA PHE 4 26.881 17.427 28.440
18 HB2 PHE 4 HB2 PHE 4 25.216 17.019 30.251
19 HB3 PHE 4 HB3 PHE 4 26.540 18.073 30.710
20 HD1 PHE 4 HD1 PHE 4 22.919 18.073 29.682
21 HD2 PHE 4 HD2 PHE 4 26.100 20.197 31.672
22 HE1 PHE 4 HE1 PHE 4 21.285 19.743 30.513
23 HE2 PHE 4 HE2 PHE 4 24.455 21.842 32.531
24 HZ PHE 4 HZ PHE 4 22.048 21.632 31.933
25 H CYS 5 H CYS 5 25.294 15.838 27.958
26 HA CYS 5 HA CYS 5 23.446 16.577 25.837
27 HB2 CYS 5 HB2 CYS 5 24.589 14.411 25.758
28 HB3 CYS 5 HB3 CYS 5 23.690 13.921 27.197
29 H ASN 6 H ASN 6 21.910 17.783 26.345
30 HA ASN 6 HA ASN 6 19.593 16.235 27.138
31 HB2 ASN 6 HB2 ASN 6 19.760 17.749 29.088
32 HB3 ASN 6 HB3 ASN 6 19.861 19.146 28.036
33 HD21 ASN 6 HD22 ASN 6 17.858 18.777 30.090
34 HD22 ASN 6 HD21 ASN 6 16.317 18.672 29.239
35 H LEU 7 H LEU 7 18.725 15.973 25.154
36 HA LEU 7 HA LEU 7 19.517 17.457 22.862
37 HB2 LEU 7 HB2 LEU 7 18.568 15.136 22.910
38 HB3 LEU 7 HB3 LEU 7 16.999 15.821 23.356
39 HG LEU 7 HG LEU 7 16.856 16.983 21.187
40 HD11 LEU 7 HD11 LEU 7 18.468 16.387 19.373
41 HD12 LEU 7 HD12 LEU 7 19.221 17.349 20.642
42 HD13 LEU 7 HD13 LEU 7 19.504 15.592 20.577
43 HD21 LEU 7 HD21 LEU 7 15.972 14.684 21.466
44 HD22 LEU 7 HD22 LEU 7 16.513 15.001 19.813
45 HD23 LEU 7 HD23 LEU 7 17.525 14.028 20.902
46 H ALA 8 H ALA 8 16.738 18.049 25.067
47 HA ALA 8 HA ALA 8 15.512 19.961 23.276
48 HB1 ALA 8 HB1 ALA 8 14.079 20.449 25.224
49 HB2 ALA 8 HB2 ALA 8 14.220 18.708 24.921
50 HB3 ALA 8 HB3 ALA 8 15.136 19.449 26.248
51 H ARG 9 H ARG 9 17.565 20.383 26.259
52 HA ARG 9 HA ARG 9 17.711 23.187 26.327
53 HB2 ARG 9 HB2 ARG 9 18.550 21.176 27.842
54 HB3 ARG 9 HB3 ARG 9 20.029 21.289 26.911
55 HG2 ARG 9 HG2 ARG 9 18.771 23.330 28.750
56 HG3 ARG 9 HG3 ARG 9 20.199 22.356 29.006
57 HD2 ARG 9 HD2 ARG 9 19.902 24.686 27.056
58 HD3 ARG 9 HD3 ARG 9 20.720 24.715 28.617
59 HE ARG 9 HE ARG 9 21.911 22.709 26.899
60 HH11 ARG 9 HH11 ARG 9 22.056 26.143 27.743
61 HH12 ARG 9 HH12 ARG 9 23.658 26.291 27.086
62 HH21 ARG 9 HH21 ARG 9 23.862 23.089 25.855
63 HH22 ARG 9 HH22 ARG 9 24.582 24.674 25.969
64 H CYS 10 H CYS 10 19.624 20.857 24.522
65 HA CYS 10 HA CYS 10 21.571 22.642 23.409
66 HB2 CYS 10 HB2 CYS 10 21.795 20.213 23.955
67 HB3 CYS 10 HB3 CYS 10 20.638 19.858 22.665
68 H GLU 11 H GLU 11 18.680 20.900 22.012
69 HA GLU 11 HA GLU 11 18.845 21.823 19.398
70 HB2 GLU 11 HB2 GLU 11 16.582 21.001 21.194
71 HB3 GLU 11 HB3 GLU 11 16.181 21.733 19.658
72 HG2 GLU 11 HG2 GLU 11 18.232 19.538 19.555
73 HG3 GLU 11 HG3 GLU 11 16.567 19.094 19.936
74 H LEU 12 H LEU 12 17.104 23.342 22.148
75 HA LEU 12 HA LEU 12 16.108 25.579 20.611
76 HB2 LEU 12 HB2 LEU 12 16.344 24.924 23.587
77 HB3 LEU 12 HB3 LEU 12 15.517 26.363 23.007
78 HG LEU 12 HG LEU 12 14.719 23.513 22.244
79 HD11 LEU 12 HD11 LEU 12 14.451 23.900 24.658
80 HD12 LEU 12 HD12 LEU 12 13.510 25.371 24.328
81 HD13 LEU 12 HD13 LEU 12 12.887 23.772 23.842
82 HD21 LEU 12 HD21 LEU 12 12.580 24.569 21.567
83 HD22 LEU 12 HD22 LEU 12 13.262 26.173 21.915
84 HD23 LEU 12 HD23 LEU 12 13.929 25.172 20.607
85 H SER 13 H SER 13 18.907 25.193 22.770
86 HA SER 13 HA SER 13 19.755 27.963 22.666
87 HB2 SER 13 HB2 SER 13 21.473 25.491 23.094
88 HB3 SER 13 HB3 SER 13 21.919 27.176 23.433
89 HG SER 13 HG SER 13 20.057 25.498 24.713
90 H CYS 14 H CYS 14 20.679 25.046 20.736
91 HA CYS 14 HA CYS 14 22.266 26.444 18.810
92 HB2 CYS 14 HB2 CYS 14 20.555 23.938 18.498
93 HB3 CYS 14 HB3 CYS 14 21.787 24.498 17.338
94 H ARG 15 H ARG 15 18.695 25.960 18.916
95 HA ARG 15 HA ARG 15 18.078 27.180 16.471
96 HB2 ARG 15 HB2 ARG 15 16.593 26.054 18.492
97 HB3 ARG 15 HB3 ARG 15 16.244 27.755 18.791
98 HG2 ARG 15 HG2 ARG 15 14.549 26.980 17.314
99 HG3 ARG 15 HG3 ARG 15 15.667 27.916 16.311
100 HD2 ARG 15 HD2 ARG 15 15.407 26.004 15.005
101 HD3 ARG 15 HD3 ARG 15 16.847 25.580 15.931
102 HE ARG 15 HE ARG 15 14.072 24.602 16.511
103 HH11 ARG 15 HH11 ARG 15 17.541 23.859 16.639
104 HH12 ARG 15 HH12 ARG 15 17.175 22.152 16.881
105 HH21 ARG 15 HH21 ARG 15 13.788 22.581 16.852
106 HH22 ARG 15 HH22 ARG 15 15.123 21.457 17.125
107 H SER 16 H SER 16 18.816 28.803 19.507
108 HA SER 16 HA SER 16 18.172 31.451 18.617
109 HB2 SER 16 HB2 SER 16 19.220 32.262 20.528
110 HB3 SER 16 HB3 SER 16 18.604 30.675 21.011
111 HG SER 16 HG SER 16 20.769 29.850 20.579
112 H LEU 17 H LEU 17 20.840 29.461 17.619
113 HA LEU 17 HA LEU 17 22.196 31.831 16.401
114 HB2 LEU 17 HB2 LEU 17 23.322 29.063 16.282
115 HB3 LEU 17 HB3 LEU 17 24.148 30.612 16.209
116 HG LEU 17 HG LEU 17 22.961 29.277 18.661
117 HD11 LEU 17 HD11 LEU 17 25.300 28.973 19.358
118 HD12 LEU 17 HD12 LEU 17 24.976 28.166 17.818
119 HD13 LEU 17 HD13 LEU 17 25.857 29.710 17.838
120 HD21 LEU 17 HD21 LEU 17 24.657 31.817 18.476
121 HD22 LEU 17 HD22 LEU 17 22.937 31.774 18.899
122 HD23 LEU 17 HD23 LEU 17 24.126 31.030 19.980
123 H GLY 18 H GLY 18 19.930 29.486 15.750
124 HA2 GLY 18 HA2 GLY 18 18.666 29.840 13.724
125 HA3 GLY 18 HA3 GLY 18 20.162 29.831 12.793
126 H LEU 19 H LEU 19 20.620 27.319 14.885
127 HA LEU 19 HA LEU 19 19.804 25.414 12.761
128 HB2 LEU 19 HB2 LEU 19 21.956 24.531 12.677
129 HB3 LEU 19 HB3 LEU 19 22.071 26.258 12.488
130 HG LEU 19 HG LEU 19 22.650 24.853 15.121
131 HD11 LEU 19 HD11 LEU 19 24.176 23.981 13.377
132 HD12 LEU 19 HD12 LEU 19 24.577 25.633 12.882
133 HD13 LEU 19 HD13 LEU 19 25.065 25.040 14.475
134 HD21 LEU 19 HD21 LEU 19 24.033 26.822 15.626
135 HD22 LEU 19 HD22 LEU 19 23.569 27.563 14.081
136 HD23 LEU 19 HD23 LEU 19 22.370 27.290 15.350
137 H LEU 20 H LEU 20 20.986 23.099 13.628
138 HA LEU 20 HA LEU 20 18.929 22.265 15.588
139 HB2 LEU 20 HB2 LEU 20 20.492 20.696 13.525
140 HB3 LEU 20 HB3 LEU 20 19.374 19.989 14.682
141 HG LEU 20 HG LEU 20 18.678 21.941 12.481
142 HD11 LEU 20 HD11 LEU 20 17.444 20.002 11.538
143 HD12 LEU 20 HD12 LEU 20 19.170 19.666 11.693
144 HD13 LEU 20 HD13 LEU 20 18.017 18.990 12.873
145 HD21 LEU 20 HD21 LEU 20 17.110 22.387 14.222
146 HD22 LEU 20 HD22 LEU 20 16.283 21.342 13.073
147 HD23 LEU 20 HD23 LEU 20 16.905 20.649 14.581
148 H GLY 21 H GLY 21 19.469 20.560 17.082
149 HA2 GLY 21 HA2 GLY 21 22.319 20.589 18.076
150 HA3 GLY 21 HA3 GLY 21 20.928 20.518 19.140
151 H LYS 22 H LYS 22 23.308 18.678 18.411
152 HA LYS 22 HA LYS 22 21.811 16.096 18.563
153 HB2 LYS 22 HB2 LYS 22 23.821 16.894 16.500
154 HB3 LYS 22 HB3 LYS 22 24.199 15.399 17.317
155 HG2 LYS 22 HG2 LYS 22 22.998 15.046 15.231
156 HG3 LYS 22 HG3 LYS 22 22.184 14.329 16.631
157 HD2 LYS 22 HD2 LYS 22 20.469 15.925 16.629
158 HD3 LYS 22 HD3 LYS 22 21.393 17.074 15.636
159 HE2 LYS 22 HE2 LYS 22 21.315 15.186 13.823
160 HE3 LYS 22 HE3 LYS 22 19.987 14.532 14.795
161 HZ1 LYS 22 HZ1 LYS 22 20.135 17.135 13.384
162 HZ2 LYS 22 HZ2 LYS 22 19.010 15.984 13.190
163 HZ3 LYS 22 HZ3 LYS 22 19.021 16.892 14.580
164 H CYS 23 H CYS 23 22.531 14.734 20.104
165 HA CYS 23 HA CYS 23 24.588 15.685 21.931
166 HB2 CYS 23 HB2 CYS 23 22.679 13.358 21.892
167 HB3 CYS 23 HB3 CYS 23 24.023 13.434 22.999
168 H ILE 24 H ILE 24 26.428 14.613 22.524
169 HA ILE 24 HA ILE 24 27.597 12.561 20.692
170 HB ILE 24 HB ILE 24 29.167 14.877 21.872
171 HG12 ILE 24 HG12 ILE 24 28.169 14.417 19.019
172 HG13 ILE 24 HG13 ILE 24 27.682 15.726 20.105
173 HG21 ILE 24 HG21 ILE 24 31.017 13.963 20.534
174 HG22 ILE 24 HG22 ILE 24 30.390 12.678 21.551
175 HG23 ILE 24 HG23 ILE 24 29.944 12.728 19.836
176 HD11 ILE 24 HD11 ILE 24 30.407 15.356 18.838
177 HD12 ILE 24 HD12 ILE 24 29.220 16.635 18.540
178 HD13 ILE 24 HD13 ILE 24 30.043 16.550 20.115
179 H GLY 25 H GLY 25 26.617 11.184 22.118
180 HA2 GLY 25 HA2 GLY 25 26.461 9.770 23.937
181 HA3 GLY 25 HA3 GLY 25 28.124 10.225 24.336
182 H GLU 26 H GLU 26 28.500 11.754 25.857
183 HA GLU 26 HA GLU 26 26.248 12.529 27.639
184 HB2 GLU 26 HB2 GLU 26 27.720 12.553 29.444
185 HB3 GLU 26 HB3 GLU 26 27.996 11.063 28.523
186 HG2 GLU 26 HG2 GLU 26 29.886 12.252 27.355
187 HG3 GLU 26 HG3 GLU 26 29.660 13.587 28.497
188 H GLU 27 H GLU 27 27.870 13.972 25.232
189 HA GLU 27 HA GLU 27 27.752 16.742 26.366
190 HB2 GLU 27 HB2 GLU 27 29.728 15.282 24.764
191 HB3 GLU 27 HB3 GLU 27 29.188 16.704 23.903
192 HG2 GLU 27 HG2 GLU 27 30.058 16.845 26.822
193 HG3 GLU 27 HG3 GLU 27 31.219 16.882 25.494
194 H CYS 28 H CYS 28 27.162 18.430 24.628
195 HA CYS 28 HA CYS 28 25.769 17.357 22.313
196 HB2 CYS 28 HB2 CYS 28 24.054 17.456 24.107
197 HB3 CYS 28 HB3 CYS 28 24.182 19.212 24.116
198 H LYS 29 H LYS 29 25.747 18.565 20.584
199 HA LYS 29 HA LYS 29 26.806 21.344 20.614
200 HB2 LYS 29 HB2 LYS 29 27.954 18.929 19.133
201 HB3 LYS 29 HB3 LYS 29 28.419 20.592 18.820
202 HG2 LYS 29 HG2 LYS 29 28.803 19.193 21.512
203 HG3 LYS 29 HG3 LYS 29 30.022 19.304 20.253
204 HD2 LYS 29 HD2 LYS 29 30.164 21.655 20.397
205 HD3 LYS 29 HD3 LYS 29 28.762 21.811 21.452
206 HE2 LYS 29 HE2 LYS 29 31.168 20.183 22.328
207 HE3 LYS 29 HE3 LYS 29 31.187 21.950 22.422
208 HZ1 LYS 29 HZ1 LYS 29 29.148 20.262 23.787
209 HZ2 LYS 29 HZ2 LYS 29 30.411 20.949 24.497
210 HZ3 LYS 29 HZ3 LYS 29 29.253 21.902 23.825
211 H CYS 30 H CYS 30 26.681 22.330 18.415
212 HA CYS 30 HA CYS 30 24.027 21.672 17.351
213 HB2 CYS 30 HB2 CYS 30 25.601 24.117 16.590
214 HB3 CYS 30 HB3 CYS 30 23.896 23.805 16.466
215 H VAL 31 H VAL 31 23.552 21.700 15.115
216 HA VAL 31 HA VAL 31 25.682 21.006 13.203
217 HB VAL 31 HB VAL 31 24.240 18.979 12.488
218 HG11 VAL 31 HG11 VAL 31 26.499 18.829 13.425
219 HG12 VAL 31 HG12 VAL 31 25.811 18.790 15.071
220 HG13 VAL 31 HG13 VAL 31 25.472 17.476 13.932
221 HG21 VAL 31 HG21 VAL 31 22.310 19.409 14.017
222 HG22 VAL 31 HG22 VAL 31 23.028 17.802 14.201
223 HG23 VAL 31 HG23 VAL 31 23.358 19.062 15.405
224 HA PRO 32 HA PRO 32 22.808 22.934 10.383
225 HB2 PRO 32 HB2 PRO 32 23.730 22.049 7.974
226 HB3 PRO 32 HB3 PRO 32 24.649 23.189 9.002
227 HG2 PRO 32 HG2 PRO 32 24.985 20.179 8.788
228 HG3 PRO 32 HG3 PRO 32 26.257 21.444 8.744
229 HD2 PRO 32 HD2 PRO 32 25.618 20.032 10.988
230 HD3 PRO 32 HD3 PRO 32 26.170 21.726 11.060
231 H TYR 33 H TYR 33 21.226 22.427 8.704
232 HA TYR 33 HA TYR 33 19.534 20.185 9.424
233 HB2 TYR 33 HB2 TYR 33 19.249 22.326 7.281
234 HB3 TYR 33 HB3 TYR 33 17.998 21.201 7.766
235 HD1 TYR 33 HD1 TYR 33 19.927 24.198 8.781
236 HD2 TYR 33 HD2 TYR 33 16.705 21.527 9.807
237 HE1 TYR 33 HE1 TYR 33 19.134 25.814 10.495
238 HE2 TYR 33 HE2 TYR 33 15.891 23.164 11.494
239 HH TYR 33 HH TYR 33 17.611 26.250 12.117
Start of MODEL 17
1 H1 GLY 1 H1 GLY 1 33.701 15.513 29.858
2 H2 GLY 1 H2 GLY 1 32.786 14.252 30.392
3 H3 GLY 1 H3 GLY 1 33.220 15.454 31.432
4 HA2 GLY 1 HA2 GLY 1 31.454 15.765 29.099
5 HA3 GLY 1 HA3 GLY 1 30.917 15.698 30.786
6 H SER 2 H SER 2 31.132 17.817 28.472
7 HA SER 2 HA SER 2 31.942 20.072 30.269
8 HB2 SER 2 HB2 SER 2 32.726 21.225 28.183
9 HB3 SER 2 HB3 SER 2 33.696 19.838 28.693
10 HG SER 2 HG SER 2 32.027 20.139 26.458
11 H ALA 3 H ALA 3 29.549 18.821 28.009
12 HA ALA 3 HA ALA 3 27.956 21.301 28.486
13 HB1 ALA 3 HB1 ALA 3 26.990 20.970 26.255
14 HB2 ALA 3 HB2 ALA 3 28.747 21.143 26.185
15 HB3 ALA 3 HB3 ALA 3 28.025 19.528 26.031
16 H PHE 4 H PHE 4 27.965 18.214 29.465
17 HA PHE 4 HA PHE 4 26.387 16.776 30.352
18 HB2 PHE 4 HB2 PHE 4 25.521 19.419 31.538
19 HB3 PHE 4 HB3 PHE 4 25.397 17.826 32.282
20 HD1 PHE 4 HD1 PHE 4 27.532 16.584 32.920
21 HD2 PHE 4 HD2 PHE 4 27.573 20.677 31.559
22 HE1 PHE 4 HE1 PHE 4 29.853 16.851 33.765
23 HE2 PHE 4 HE2 PHE 4 29.899 20.925 32.369
24 HZ PHE 4 HZ PHE 4 31.040 19.025 33.489
25 H CYS 5 H CYS 5 25.360 16.294 28.294
26 HA CYS 5 HA CYS 5 23.610 18.044 27.084
27 HB2 CYS 5 HB2 CYS 5 24.869 16.245 25.950
28 HB3 CYS 5 HB3 CYS 5 23.773 15.062 26.661
29 H ASN 6 H ASN 6 21.698 18.701 27.582
30 HA ASN 6 HA ASN 6 19.556 16.636 27.694
31 HB2 ASN 6 HB2 ASN 6 19.258 18.230 29.567
32 HB3 ASN 6 HB3 ASN 6 19.342 19.585 28.436
33 HD21 ASN 6 HD22 ASN 6 17.536 16.551 29.087
34 HD22 ASN 6 HD21 ASN 6 16.011 17.186 28.434
35 H LEU 7 H LEU 7 18.741 16.264 25.699
36 HA LEU 7 HA LEU 7 19.489 17.779 23.369
37 HB2 LEU 7 HB2 LEU 7 18.905 15.377 23.374
38 HB3 LEU 7 HB3 LEU 7 17.267 15.777 23.883
39 HG LEU 7 HG LEU 7 16.860 16.961 21.744
40 HD11 LEU 7 HD11 LEU 7 19.588 15.866 20.918
41 HD12 LEU 7 HD12 LEU 7 18.404 16.648 19.857
42 HD13 LEU 7 HD13 LEU 7 19.185 17.590 21.125
43 HD21 LEU 7 HD21 LEU 7 16.650 14.972 20.421
44 HD22 LEU 7 HD22 LEU 7 17.887 14.130 21.394
45 HD23 LEU 7 HD23 LEU 7 16.316 14.566 22.108
46 H ALA 8 H ALA 8 16.490 18.018 25.381
47 HA ALA 8 HA ALA 8 15.155 19.721 23.505
48 HB1 ALA 8 HB1 ALA 8 13.685 20.297 25.356
49 HB2 ALA 8 HB2 ALA 8 14.021 18.555 25.378
50 HB3 ALA 8 HB3 ALA 8 14.827 19.642 26.532
51 H ARG 9 H ARG 9 17.210 20.611 26.392
52 HA ARG 9 HA ARG 9 17.279 23.396 25.880
53 HB2 ARG 9 HB2 ARG 9 17.966 21.789 27.888
54 HB3 ARG 9 HB3 ARG 9 19.554 21.833 27.156
55 HG2 ARG 9 HG2 ARG 9 17.952 24.337 27.861
56 HG3 ARG 9 HG3 ARG 9 18.942 23.473 29.019
57 HD2 ARG 9 HD2 ARG 9 19.969 24.754 26.467
58 HD3 ARG 9 HD3 ARG 9 20.081 25.464 28.073
59 HE ARG 9 HE ARG 9 21.374 23.253 28.641
60 HH11 ARG 9 HH11 ARG 9 21.774 25.097 25.631
61 HH12 ARG 9 HH12 ARG 9 23.418 24.478 25.457
62 HH21 ARG 9 HH21 ARG 9 23.575 22.742 28.304
63 HH22 ARG 9 HH22 ARG 9 24.300 23.231 26.780
64 H CYS 10 H CYS 10 19.367 20.795 24.688
65 HA CYS 10 HA CYS 10 21.387 22.399 23.458
66 HB2 CYS 10 HB2 CYS 10 21.445 19.885 23.971
67 HB3 CYS 10 HB3 CYS 10 20.400 19.670 22.557
68 H GLU 11 H GLU 11 18.413 20.845 22.134
69 HA GLU 11 HA GLU 11 18.590 21.892 19.534
70 HB2 GLU 11 HB2 GLU 11 16.379 20.835 21.247
71 HB3 GLU 11 HB3 GLU 11 15.977 21.600 19.726
72 HG2 GLU 11 HG2 GLU 11 18.200 19.560 19.648
73 HG3 GLU 11 HG3 GLU 11 16.588 18.966 19.988
74 H LEU 12 H LEU 12 16.883 23.258 22.428
75 HA LEU 12 HA LEU 12 15.924 25.638 21.158
76 HB2 LEU 12 HB2 LEU 12 16.629 24.941 24.035
77 HB3 LEU 12 HB3 LEU 12 16.011 26.517 23.602
78 HG LEU 12 HG LEU 12 14.502 23.961 22.964
79 HD11 LEU 12 HD11 LEU 12 13.137 24.421 24.943
80 HD12 LEU 12 HD12 LEU 12 14.820 24.153 25.405
81 HD13 LEU 12 HD13 LEU 12 14.168 25.808 25.360
82 HD21 LEU 12 HD21 LEU 12 13.786 25.923 21.651
83 HD22 LEU 12 HD22 LEU 12 12.560 25.482 22.839
84 HD23 LEU 12 HD23 LEU 12 13.615 26.877 23.143
85 H SER 13 H SER 13 19.000 25.055 22.890
86 HA SER 13 HA SER 13 19.927 27.791 22.660
87 HB2 SER 13 HB2 SER 13 21.397 25.204 23.271
88 HB3 SER 13 HB3 SER 13 22.152 26.802 23.295
89 HG SER 13 HG SER 13 19.987 27.048 24.777
90 H CYS 14 H CYS 14 20.663 24.800 20.735
91 HA CYS 14 HA CYS 14 22.435 26.204 18.916
92 HB2 CYS 14 HB2 CYS 14 20.720 23.739 18.439
93 HB3 CYS 14 HB3 CYS 14 22.021 24.317 17.375
94 H ARG 15 H ARG 15 18.878 25.698 18.874
95 HA ARG 15 HA ARG 15 18.426 26.985 16.373
96 HB2 ARG 15 HB2 ARG 15 16.988 25.414 17.527
97 HB3 ARG 15 HB3 ARG 15 16.543 26.614 18.735
98 HG2 ARG 15 HG2 ARG 15 15.277 27.872 17.171
99 HG3 ARG 15 HG3 ARG 15 16.090 27.146 15.777
100 HD2 ARG 15 HD2 ARG 15 14.294 25.566 17.672
101 HD3 ARG 15 HD3 ARG 15 13.726 26.329 16.189
102 HE ARG 15 HE ARG 15 15.100 24.856 14.863
103 HH11 ARG 15 HH21 ARG 15 14.976 23.691 18.238
104 HH12 ARG 15 HH22 ARG 15 16.010 22.338 17.751
105 HH21 ARG 15 HH11 ARG 15 16.342 23.071 14.547
106 HH22 ARG 15 HH12 ARG 15 16.564 21.933 15.904
107 H SER 16 H SER 16 18.716 28.428 19.623
108 HA SER 16 HA SER 16 18.066 31.097 18.852
109 HB2 SER 16 HB2 SER 16 19.903 30.030 21.016
110 HB3 SER 16 HB3 SER 16 19.499 31.743 20.825
111 HG SER 16 HG SER 16 17.327 31.260 21.104
112 H LEU 17 H LEU 17 20.787 29.266 17.765
113 HA LEU 17 HA LEU 17 22.012 31.781 16.690
114 HB2 LEU 17 HB2 LEU 17 23.496 29.223 16.547
115 HB3 LEU 17 HB3 LEU 17 24.102 30.848 16.699
116 HG LEU 17 HG LEU 17 22.824 29.201 18.914
117 HD11 LEU 17 HD11 LEU 17 25.080 28.871 19.767
118 HD12 LEU 17 HD12 LEU 17 24.946 28.227 18.128
119 HD13 LEU 17 HD13 LEU 17 25.761 29.784 18.400
120 HD21 LEU 17 HD21 LEU 17 22.710 31.670 19.343
121 HD22 LEU 17 HD22 LEU 17 23.848 30.885 20.442
122 HD23 LEU 17 HD23 LEU 17 24.452 31.799 19.045
123 H GLY 18 H GLY 18 19.856 29.524 15.859
124 HA2 GLY 18 HA2 GLY 18 18.731 29.410 13.834
125 HA3 GLY 18 HA3 GLY 18 20.118 30.093 12.991
126 H LEU 19 H LEU 19 20.691 27.241 14.997
127 HA LEU 19 HA LEU 19 20.563 25.456 12.643
128 HB2 LEU 19 HB2 LEU 19 22.753 24.731 12.774
129 HB3 LEU 19 HB3 LEU 19 22.789 26.468 12.631
130 HG LEU 19 HG LEU 19 23.167 25.046 15.275
131 HD11 LEU 19 HD11 LEU 19 25.636 25.365 14.862
132 HD12 LEU 19 HD12 LEU 19 24.898 24.235 13.722
133 HD13 LEU 19 HD13 LEU 19 25.258 25.895 13.214
134 HD21 LEU 19 HD21 LEU 19 24.400 27.094 15.894
135 HD22 LEU 19 HD22 LEU 19 24.032 27.796 14.301
136 HD23 LEU 19 HD23 LEU 19 22.732 27.454 15.458
137 H LEU 20 H LEU 20 21.575 23.169 13.459
138 HA LEU 20 HA LEU 20 19.239 22.297 15.001
139 HB2 LEU 20 HB2 LEU 20 19.784 21.690 12.635
140 HB3 LEU 20 HB3 LEU 20 21.198 20.830 13.176
141 HG LEU 20 HG LEU 20 19.058 19.574 12.494
142 HD11 LEU 20 HD11 LEU 20 19.495 17.747 14.065
143 HD12 LEU 20 HD12 LEU 20 20.965 18.420 13.371
144 HD13 LEU 20 HD13 LEU 20 20.519 18.817 15.051
145 HD21 LEU 20 HD21 LEU 20 18.293 19.965 15.402
146 HD22 LEU 20 HD22 LEU 20 17.532 20.841 14.050
147 HD23 LEU 20 HD23 LEU 20 17.440 19.086 14.128
148 H GLY 21 H GLY 21 19.304 21.123 16.921
149 HA2 GLY 21 HA2 GLY 21 21.952 20.874 18.248
150 HA3 GLY 21 HA3 GLY 21 20.381 20.746 19.017
151 H LYS 22 H LYS 22 23.012 19.030 18.527
152 HA LYS 22 HA LYS 22 21.615 16.417 18.362
153 HB2 LYS 22 HB2 LYS 22 23.285 17.187 16.451
154 HB3 LYS 22 HB3 LYS 22 24.539 16.911 17.657
155 HG2 LYS 22 HG2 LYS 22 24.391 14.876 16.428
156 HG3 LYS 22 HG3 LYS 22 23.549 14.547 17.938
157 HD2 LYS 22 HD2 LYS 22 21.937 13.755 16.525
158 HD3 LYS 22 HD3 LYS 22 21.433 15.459 16.486
159 HE2 LYS 22 HE2 LYS 22 22.597 15.832 14.400
160 HE3 LYS 22 HE3 LYS 22 23.430 14.277 14.523
161 HZ1 LYS 22 HZ1 LYS 22 21.569 14.233 12.973
162 HZ2 LYS 22 HZ2 LYS 22 21.373 13.140 14.193
163 HZ3 LYS 22 HZ3 LYS 22 20.503 14.546 14.202
164 H CYS 23 H CYS 23 22.026 14.915 19.874
165 HA CYS 23 HA CYS 23 23.768 15.695 22.179
166 HB2 CYS 23 HB2 CYS 23 21.244 15.324 22.442
167 HB3 CYS 23 HB3 CYS 23 21.575 13.616 22.163
168 H ILE 24 H ILE 24 25.602 14.564 22.464
169 HA ILE 24 HA ILE 24 25.981 11.925 21.071
170 HB ILE 24 HB ILE 24 28.160 13.971 21.576
171 HG12 ILE 24 HG12 ILE 24 26.491 13.497 19.077
172 HG13 ILE 24 HG13 ILE 24 26.642 15.000 20.001
173 HG21 ILE 24 HG21 ILE 24 29.485 12.509 20.131
174 HG22 ILE 24 HG22 ILE 24 28.789 11.516 21.404
175 HG23 ILE 24 HG23 ILE 24 28.065 11.495 19.789
176 HD11 ILE 24 HD11 ILE 24 29.096 15.028 19.386
177 HD12 ILE 24 HD12 ILE 24 28.751 13.696 18.254
178 HD13 ILE 24 HD13 ILE 24 27.949 15.263 18.047
179 H GLY 25 H GLY 25 25.233 10.828 22.802
180 HA2 GLY 25 HA2 GLY 25 25.092 9.881 24.898
181 HA3 GLY 25 HA3 GLY 25 26.845 10.096 25.025
182 H GLU 26 H GLU 26 27.658 11.875 26.038
183 HA GLU 26 HA GLU 26 25.901 13.292 27.960
184 HB2 GLU 26 HB2 GLU 26 27.798 13.541 29.353
185 HB3 GLU 26 HB3 GLU 26 27.680 11.858 28.836
186 HG2 GLU 26 HG2 GLU 26 29.302 12.419 26.987
187 HG3 GLU 26 HG3 GLU 26 29.519 13.999 27.767
188 H GLU 27 H GLU 27 27.546 14.075 25.003
189 HA GLU 27 HA GLU 27 27.887 16.885 25.837
190 HB2 GLU 27 HB2 GLU 27 29.458 15.061 24.349
191 HB3 GLU 27 HB3 GLU 27 28.815 16.176 23.153
192 HG2 GLU 27 HG2 GLU 27 30.842 17.074 23.907
193 HG3 GLU 27 HG3 GLU 27 29.575 18.079 24.634
194 H CYS 28 H CYS 28 27.164 18.639 24.697
195 HA CYS 28 HA CYS 28 24.953 18.214 22.723
196 HB2 CYS 28 HB2 CYS 28 24.057 19.347 24.604
197 HB3 CYS 28 HB3 CYS 28 25.472 20.391 24.751
198 H LYS 29 H LYS 29 25.460 18.626 20.704
199 HA LYS 29 HA LYS 29 27.507 20.692 19.983
200 HB2 LYS 29 HB2 LYS 29 27.006 17.995 18.640
201 HB3 LYS 29 HB3 LYS 29 28.107 19.233 18.075
202 HG2 LYS 29 HG2 LYS 29 28.385 17.632 20.654
203 HG3 LYS 29 HG3 LYS 29 29.293 17.381 19.148
204 HD2 LYS 29 HD2 LYS 29 30.361 19.582 19.381
205 HD3 LYS 29 HD3 LYS 29 29.432 19.904 20.850
206 HE2 LYS 29 HE2 LYS 29 30.444 17.838 21.877
207 HE3 LYS 29 HE3 LYS 29 31.457 17.664 20.439
208 HZ1 LYS 29 HZ1 LYS 29 32.609 18.857 22.230
209 HZ2 LYS 29 HZ2 LYS 29 32.438 19.813 20.916
210 HZ3 LYS 29 HZ3 LYS 29 31.471 20.036 22.241
211 H CYS 30 H CYS 30 27.035 21.914 18.176
212 HA CYS 30 HA CYS 30 24.285 21.566 17.067
213 HB2 CYS 30 HB2 CYS 30 25.854 24.117 16.846
214 HB3 CYS 30 HB3 CYS 30 24.157 23.823 16.605
215 H VAL 31 H VAL 31 23.907 21.504 14.910
216 HA VAL 31 HA VAL 31 26.212 21.582 13.048
217 HB VAL 31 HB VAL 31 25.060 19.595 11.836
218 HG11 VAL 31 HG11 VAL 31 26.481 18.027 13.066
219 HG12 VAL 31 HG12 VAL 31 27.294 19.577 12.773
220 HG13 VAL 31 HG13 VAL 31 26.639 19.208 14.394
221 HG21 VAL 31 HG21 VAL 31 23.974 17.947 13.224
222 HG22 VAL 31 HG22 VAL 31 24.115 18.975 14.663
223 HG23 VAL 31 HG23 VAL 31 23.061 19.463 13.320
224 HA PRO 32 HA PRO 32 23.561 24.045 10.670
225 HB2 PRO 32 HB2 PRO 32 24.909 24.269 8.334
226 HB3 PRO 32 HB3 PRO 32 25.642 24.732 9.893
227 HG2 PRO 32 HG2 PRO 32 25.952 22.060 8.457
228 HG3 PRO 32 HG3 PRO 32 27.246 23.149 9.055
229 HD2 PRO 32 HD2 PRO 32 26.338 21.051 10.509
230 HD3 PRO 32 HD3 PRO 32 26.842 22.589 11.266
231 H TYR 33 H TYR 33 22.059 21.954 10.914
232 HA TYR 33 HA TYR 33 20.549 20.447 10.080
233 HB2 TYR 33 HB2 TYR 33 20.139 22.849 8.281
234 HB3 TYR 33 HB3 TYR 33 19.043 21.477 8.321
235 HD1 TYR 33 HD2 TYR 33 17.886 20.838 10.507
236 HD2 TYR 33 HD1 TYR 33 19.866 24.610 9.874
237 HE1 TYR 33 HE2 TYR 33 16.484 21.878 12.282
238 HE2 TYR 33 HE1 TYR 33 18.460 25.643 11.649
239 HH TYR 33 HH TYR 33 16.750 25.361 13.071
Start of MODEL 18
1 H1 GLY 1 H1 GLY 1 31.221 16.313 34.304
2 H2 GLY 1 H2 GLY 1 29.769 17.099 34.441
3 H3 GLY 1 H3 GLY 1 31.162 17.946 34.194
4 HA2 GLY 1 HA2 GLY 1 31.441 16.810 32.039
5 HA3 GLY 1 HA3 GLY 1 29.818 16.144 32.303
6 H SER 2 H SER 2 31.607 18.746 31.072
7 HA SER 2 HA SER 2 29.735 20.891 31.624
8 HB2 SER 2 HB2 SER 2 32.220 20.861 29.879
9 HB3 SER 2 HB3 SER 2 31.337 22.296 30.443
10 HG SER 2 HG SER 2 33.012 21.965 31.878
11 H ALA 3 H ALA 3 29.466 18.487 29.331
12 HA ALA 3 HA ALA 3 27.653 20.227 27.740
13 HB1 ALA 3 HB1 ALA 3 29.595 18.194 26.579
14 HB2 ALA 3 HB2 ALA 3 28.405 19.147 25.663
15 HB3 ALA 3 HB3 ALA 3 29.753 19.952 26.488
16 H PHE 4 H PHE 4 27.567 17.920 29.859
17 HA PHE 4 HA PHE 4 26.473 15.614 29.163
18 HB2 PHE 4 HB2 PHE 4 27.046 16.313 31.420
19 HB3 PHE 4 HB3 PHE 4 25.661 17.395 31.473
20 HD1 PHE 4 HD2 PHE 4 26.266 13.752 30.589
21 HD2 PHE 4 HD1 PHE 4 23.935 16.609 32.832
22 HE1 PHE 4 HE2 PHE 4 24.938 11.901 31.576
23 HE2 PHE 4 HE1 PHE 4 22.639 14.755 33.840
24 HZ PHE 4 HZ PHE 4 23.130 12.395 33.209
25 H CYS 5 H CYS 5 25.102 15.181 27.763
26 HA CYS 5 HA CYS 5 23.542 17.003 26.479
27 HB2 CYS 5 HB2 CYS 5 24.471 14.976 25.495
28 HB3 CYS 5 HB3 CYS 5 23.295 14.007 26.384
29 H ASN 6 H ASN 6 21.757 17.972 26.761
30 HA ASN 6 HA ASN 6 19.310 16.372 27.263
31 HB2 ASN 6 HB2 ASN 6 19.551 18.048 29.140
32 HB3 ASN 6 HB3 ASN 6 19.623 19.337 27.960
33 HD21 ASN 6 HD22 ASN 6 17.517 17.409 29.885
34 HD22 ASN 6 HD21 ASN 6 16.044 17.828 29.007
35 H LEU 7 H LEU 7 18.715 15.977 25.158
36 HA LEU 7 HA LEU 7 19.540 17.643 22.976
37 HB2 LEU 7 HB2 LEU 7 18.971 15.212 22.864
38 HB3 LEU 7 HB3 LEU 7 17.277 15.611 23.119
39 HG LEU 7 HG LEU 7 17.203 16.841 20.980
40 HD11 LEU 7 HD11 LEU 7 19.121 16.633 19.388
41 HD12 LEU 7 HD12 LEU 7 19.468 17.686 20.753
42 HD13 LEU 7 HD13 LEU 7 20.128 16.033 20.720
43 HD21 LEU 7 HD21 LEU 7 17.485 14.904 19.483
44 HD22 LEU 7 HD22 LEU 7 18.415 14.055 20.752
45 HD23 LEU 7 HD23 LEU 7 16.702 14.446 20.999
46 H ALA 8 H ALA 8 16.545 17.815 24.916
47 HA ALA 8 HA ALA 8 15.204 19.584 23.082
48 HB1 ALA 8 HB1 ALA 8 13.668 19.978 24.933
49 HB2 ALA 8 HB2 ALA 8 14.040 18.248 24.805
50 HB3 ALA 8 HB3 ALA 8 14.803 19.234 26.075
51 H ARG 9 H ARG 9 17.214 20.317 26.053
52 HA ARG 9 HA ARG 9 16.985 23.149 25.657
53 HB2 ARG 9 HB2 ARG 9 17.624 21.493 27.778
54 HB3 ARG 9 HB3 ARG 9 19.233 22.014 27.283
55 HG2 ARG 9 HG2 ARG 9 18.236 24.379 27.160
56 HG3 ARG 9 HG3 ARG 9 16.837 23.750 28.020
57 HD2 ARG 9 HD2 ARG 9 18.299 24.815 29.614
58 HD3 ARG 9 HD3 ARG 9 18.313 23.064 29.904
59 HE ARG 9 HE ARG 9 20.471 23.971 28.130
60 HH11 ARG 9 HH11 ARG 9 19.702 23.754 31.566
61 HH12 ARG 9 HH12 ARG 9 21.392 23.350 31.925
62 HH21 ARG 9 HH21 ARG 9 22.515 23.736 28.780
63 HH22 ARG 9 HH22 ARG 9 22.882 23.477 30.493
64 H CYS 10 H CYS 10 19.303 20.757 24.610
65 HA CYS 10 HA CYS 10 21.329 22.544 23.589
66 HB2 CYS 10 HB2 CYS 10 21.652 20.113 24.067
67 HB3 CYS 10 HB3 CYS 10 20.525 19.739 22.755
68 H GLU 11 H GLU 11 18.459 20.853 22.100
69 HA GLU 11 HA GLU 11 18.627 22.054 19.565
70 HB2 GLU 11 HB2 GLU 11 16.377 20.946 21.201
71 HB3 GLU 11 HB3 GLU 11 15.973 21.891 19.784
72 HG2 GLU 11 HG2 GLU 11 18.063 19.736 19.461
73 HG3 GLU 11 HG3 GLU 11 16.373 19.273 19.647
74 H LEU 12 H LEU 12 16.916 23.271 22.521
75 HA LEU 12 HA LEU 12 15.981 25.719 21.459
76 HB2 LEU 12 HB2 LEU 12 15.641 24.449 23.762
77 HB3 LEU 12 HB3 LEU 12 16.967 25.458 24.315
78 HG LEU 12 HG LEU 12 14.255 26.351 23.253
79 HD11 LEU 12 HD11 LEU 12 15.504 26.523 26.026
80 HD12 LEU 12 HD12 LEU 12 13.884 27.090 25.569
81 HD13 LEU 12 HD13 LEU 12 14.257 25.360 25.521
82 HD21 LEU 12 HD21 LEU 12 16.581 28.058 24.231
83 HD22 LEU 12 HD22 LEU 12 15.779 28.115 22.636
84 HD23 LEU 12 HD23 LEU 12 14.910 28.637 24.073
85 H SER 13 H SER 13 19.105 25.028 23.054
86 HA SER 13 HA SER 13 20.147 27.693 22.856
87 HB2 SER 13 HB2 SER 13 21.616 25.051 23.198
88 HB3 SER 13 HB3 SER 13 22.290 26.670 23.479
89 HG SER 13 HG SER 13 20.294 25.276 24.915
90 H CYS 14 H CYS 14 20.803 24.781 20.810
91 HA CYS 14 HA CYS 14 22.563 26.151 18.976
92 HB2 CYS 14 HB2 CYS 14 20.781 23.716 18.558
93 HB3 CYS 14 HB3 CYS 14 22.056 24.244 17.454
94 H ARG 15 H ARG 15 19.005 25.594 18.901
95 HA ARG 15 HA ARG 15 18.665 26.873 16.346
96 HB2 ARG 15 HB2 ARG 15 17.306 25.071 17.425
97 HB3 ARG 15 HB3 ARG 15 16.520 26.316 18.417
98 HG2 ARG 15 HG2 ARG 15 15.615 27.366 16.409
99 HG3 ARG 15 HG3 ARG 15 16.569 26.298 15.362
100 HD2 ARG 15 HD2 ARG 15 14.367 25.411 17.274
101 HD3 ARG 15 HD3 ARG 15 14.194 25.604 15.528
102 HE ARG 15 HE ARG 15 16.043 23.594 16.819
103 HH11 ARG 15 HH21 ARG 15 13.778 24.241 14.129
104 HH12 ARG 15 HH22 ARG 15 14.218 22.687 13.442
105 HH21 ARG 15 HH11 ARG 15 16.319 21.665 15.870
106 HH22 ARG 15 HH12 ARG 15 15.529 21.365 14.313
107 H SER 16 H SER 16 18.724 28.161 19.595
108 HA SER 16 HA SER 16 17.801 30.820 18.892
109 HB2 SER 16 HB2 SER 16 19.553 29.892 21.200
110 HB3 SER 16 HB3 SER 16 18.857 31.511 21.004
111 HG SER 16 HG SER 16 17.519 29.059 21.400
112 H LEU 17 H LEU 17 20.864 29.202 18.252
113 HA LEU 17 HA LEU 17 22.075 31.783 17.370
114 HB2 LEU 17 HB2 LEU 17 23.208 29.042 16.877
115 HB3 LEU 17 HB3 LEU 17 24.022 30.592 16.801
116 HG LEU 17 HG LEU 17 23.149 29.014 19.220
117 HD11 LEU 17 HD11 LEU 17 25.889 29.906 18.260
118 HD12 LEU 17 HD12 LEU 17 25.548 28.969 19.733
119 HD13 LEU 17 HD13 LEU 17 25.209 28.269 18.143
120 HD21 LEU 17 HD21 LEU 17 24.248 30.819 20.600
121 HD22 LEU 17 HD22 LEU 17 24.408 31.808 19.130
122 HD23 LEU 17 HD23 LEU 17 22.802 31.408 19.779
123 H GLY 18 H GLY 18 20.414 28.940 16.161
124 HA2 GLY 18 HA2 GLY 18 18.921 29.524 14.230
125 HA3 GLY 18 HA3 GLY 18 20.355 30.083 13.380
126 H LEU 19 H LEU 19 20.835 27.150 15.245
127 HA LEU 19 HA LEU 19 20.524 25.477 12.818
128 HB2 LEU 19 HB2 LEU 19 22.701 24.659 12.890
129 HB3 LEU 19 HB3 LEU 19 22.767 26.398 12.749
130 HG LEU 19 HG LEU 19 23.121 25.011 15.421
131 HD11 LEU 19 HD11 LEU 19 24.753 24.047 13.835
132 HD12 LEU 19 HD12 LEU 19 25.227 25.672 13.304
133 HD13 LEU 19 HD13 LEU 19 25.582 25.136 14.953
134 HD21 LEU 19 HD21 LEU 19 24.233 27.664 14.417
135 HD22 LEU 19 HD22 LEU 19 22.825 27.482 15.476
136 HD23 LEU 19 HD23 LEU 19 24.394 26.979 16.054
137 H LEU 20 H LEU 20 21.358 23.089 13.404
138 HA LEU 20 HA LEU 20 19.098 22.226 15.086
139 HB2 LEU 20 HB2 LEU 20 19.336 21.401 12.808
140 HB3 LEU 20 HB3 LEU 20 20.975 20.866 13.131
141 HG LEU 20 HG LEU 20 20.108 19.133 14.702
142 HD11 LEU 20 HD11 LEU 20 17.949 20.154 15.305
143 HD12 LEU 20 HD12 LEU 20 17.388 20.007 13.627
144 HD13 LEU 20 HD13 LEU 20 17.701 18.556 14.602
145 HD21 LEU 20 HD21 LEU 20 18.878 19.040 11.922
146 HD22 LEU 20 HD22 LEU 20 20.566 18.626 12.313
147 HD23 LEU 20 HD23 LEU 20 19.239 17.657 12.969
148 H GLY 21 H GLY 21 19.249 21.162 17.047
149 HA2 GLY 21 HA2 GLY 21 21.924 20.675 18.248
150 HA3 GLY 21 HA3 GLY 21 20.366 20.477 19.034
151 H LYS 22 H LYS 22 22.906 18.731 18.482
152 HA LYS 22 HA LYS 22 21.429 16.195 18.034
153 HB2 LYS 22 HB2 LYS 22 22.772 17.174 15.987
154 HB3 LYS 22 HB3 LYS 22 24.207 16.675 16.881
155 HG2 LYS 22 HG2 LYS 22 23.685 14.870 15.418
156 HG3 LYS 22 HG3 LYS 22 23.123 14.339 17.005
157 HD2 LYS 22 HD2 LYS 22 21.108 13.942 16.014
158 HD3 LYS 22 HD3 LYS 22 20.895 15.694 16.014
159 HE2 LYS 22 HE2 LYS 22 20.448 15.050 13.796
160 HE3 LYS 22 HE3 LYS 22 22.074 15.734 13.743
161 HZ1 LYS 22 HZ1 LYS 22 22.921 13.410 13.830
162 HZ2 LYS 22 HZ2 LYS 22 21.404 12.841 13.833
163 HZ3 LYS 22 HZ3 LYS 22 21.979 13.660 12.510
164 H CYS 23 H CYS 23 21.823 14.629 19.423
165 HA CYS 23 HA CYS 23 23.842 15.014 21.558
166 HB2 CYS 23 HB2 CYS 23 21.325 14.491 21.857
167 HB3 CYS 23 HB3 CYS 23 21.728 12.865 21.325
168 H ILE 24 H ILE 24 25.677 13.759 21.768
169 HA ILE 24 HA ILE 24 25.977 11.274 20.155
170 HB ILE 24 HB ILE 24 28.096 13.452 20.241
171 HG12 ILE 24 HG12 ILE 24 26.047 12.868 18.058
172 HG13 ILE 24 HG13 ILE 24 26.243 14.369 18.971
173 HG21 ILE 24 HG21 ILE 24 29.182 12.075 18.515
174 HG22 ILE 24 HG22 ILE 24 28.885 11.093 19.938
175 HG23 ILE 24 HG23 ILE 24 27.818 10.938 18.522
176 HD11 ILE 24 HD11 ILE 24 28.555 14.578 17.934
177 HD12 ILE 24 HD12 ILE 24 28.048 13.279 16.825
178 HD13 ILE 24 HD13 ILE 24 27.155 14.802 16.858
179 H GLY 25 H GLY 25 26.423 9.677 21.463
180 HA2 GLY 25 HA2 GLY 25 27.111 8.495 23.329
181 HA3 GLY 25 HA3 GLY 25 28.377 9.700 23.587
182 H GLU 26 H GLU 26 28.058 11.287 25.032
183 HA GLU 26 HA GLU 26 25.489 11.627 26.491
184 HB2 GLU 26 HB2 GLU 26 26.566 11.743 28.637
185 HB3 GLU 26 HB3 GLU 26 26.806 10.157 27.889
186 HG2 GLU 26 HG2 GLU 26 29.019 10.697 27.222
187 HG3 GLU 26 HG3 GLU 26 28.831 12.400 27.628
188 H GLU 27 H GLU 27 27.370 13.213 24.458
189 HA GLU 27 HA GLU 27 27.104 15.820 25.891
190 HB2 GLU 27 HB2 GLU 27 29.384 14.868 24.132
191 HB3 GLU 27 HB3 GLU 27 29.134 16.555 24.606
192 HG2 GLU 27 HG2 GLU 27 29.371 15.972 26.980
193 HG3 GLU 27 HG3 GLU 27 29.534 14.267 26.579
194 H CYS 28 H CYS 28 26.522 17.618 24.547
195 HA CYS 28 HA CYS 28 25.243 16.758 21.988
196 HB2 CYS 28 HB2 CYS 28 23.839 17.661 23.905
197 HB3 CYS 28 HB3 CYS 28 24.555 19.233 23.545
198 H LYS 29 H LYS 29 25.456 17.870 20.125
199 HA LYS 29 HA LYS 29 27.468 20.067 19.854
200 HB2 LYS 29 HB2 LYS 29 26.820 17.921 17.800
201 HB3 LYS 29 HB3 LYS 29 28.095 19.123 17.719
202 HG2 LYS 29 HG2 LYS 29 27.980 16.718 19.584
203 HG3 LYS 29 HG3 LYS 29 28.957 16.875 18.129
204 HD2 LYS 29 HD2 LYS 29 30.354 18.578 19.121
205 HD3 LYS 29 HD3 LYS 29 29.303 18.680 20.548
206 HE2 LYS 29 HE2 LYS 29 29.753 16.249 21.004
207 HE3 LYS 29 HE3 LYS 29 30.894 16.228 19.657
208 HZ1 LYS 29 HZ1 LYS 29 31.891 16.548 21.890
209 HZ2 LYS 29 HZ2 LYS 29 32.293 17.757 20.841
210 HZ3 LYS 29 HZ3 LYS 29 31.156 18.013 22.012
211 H CYS 30 H CYS 30 26.999 21.474 17.953
212 HA CYS 30 HA CYS 30 24.158 21.323 17.050
213 HB2 CYS 30 HB2 CYS 30 25.817 23.781 16.681
214 HB3 CYS 30 HB3 CYS 30 24.097 23.557 16.554
215 H VAL 31 H VAL 31 23.715 21.411 14.835
216 HA VAL 31 HA VAL 31 25.978 21.051 12.947
217 HB VAL 31 HB VAL 31 24.601 19.071 11.986
218 HG11 VAL 31 HG11 VAL 31 26.831 18.920 13.003
219 HG12 VAL 31 HG12 VAL 31 26.084 18.704 14.603
220 HG13 VAL 31 HG13 VAL 31 25.828 17.493 13.327
221 HG21 VAL 31 HG21 VAL 31 23.360 17.735 13.577
222 HG22 VAL 31 HG22 VAL 31 23.567 18.965 14.842
223 HG23 VAL 31 HG23 VAL 31 22.596 19.321 13.399
224 HA PRO 32 HA PRO 32 23.579 23.363 10.152
225 HB2 PRO 32 HB2 PRO 32 24.843 22.973 7.797
226 HB3 PRO 32 HB3 PRO 32 25.707 23.588 9.230
227 HG2 PRO 32 HG2 PRO 32 25.567 20.701 8.271
228 HG3 PRO 32 HG3 PRO 32 27.031 21.657 8.666
229 HD2 PRO 32 HD2 PRO 32 25.835 19.980 10.444
230 HD3 PRO 32 HD3 PRO 32 26.638 21.487 10.953
231 H TYR 33 H TYR 33 21.917 21.406 10.836
232 HA TYR 33 HA TYR 33 20.194 20.013 10.299
233 HB2 TYR 33 HB2 TYR 33 19.892 21.870 7.937
234 HB3 TYR 33 HB3 TYR 33 18.636 20.875 8.646
235 HD1 TYR 33 HD1 TYR 33 20.752 23.873 9.109
236 HD2 TYR 33 HD2 TYR 33 17.431 21.586 10.635
237 HE1 TYR 33 HE1 TYR 33 20.070 25.810 10.515
238 HE2 TYR 33 HE2 TYR 33 16.767 23.512 12.074
239 HH TYR 33 HH TYR 33 18.647 26.568 12.092
Start of MODEL 19
1 H1 GLY 1 H1 GLY 1 34.472 20.788 26.229
2 H2 GLY 1 H2 GLY 1 33.359 20.076 25.246
3 H3 GLY 1 H3 GLY 1 34.955 19.964 24.880
4 HA2 GLY 1 HA2 GLY 1 34.202 17.890 25.743
5 HA3 GLY 1 HA3 GLY 1 35.356 18.658 26.855
6 H SER 2 H SER 2 32.494 17.068 26.741
7 HA SER 2 HA SER 2 30.706 16.776 28.075
8 HB2 SER 2 HB2 SER 2 32.473 17.808 30.311
9 HB3 SER 2 HB3 SER 2 30.996 16.848 30.489
10 HG SER 2 HG SER 2 32.691 15.472 30.612
11 H ALA 3 H ALA 3 30.677 19.367 26.713
12 HA ALA 3 HA ALA 3 29.369 21.189 28.559
13 HB1 ALA 3 HB1 ALA 3 29.121 22.639 26.630
14 HB2 ALA 3 HB2 ALA 3 30.773 22.003 26.738
15 HB3 ALA 3 HB3 ALA 3 29.639 21.340 25.547
16 H PHE 4 H PHE 4 27.999 19.204 29.143
17 HA PHE 4 HA PHE 4 25.953 18.273 29.420
18 HB2 PHE 4 HB2 PHE 4 26.031 20.421 30.515
19 HB3 PHE 4 HB3 PHE 4 25.345 21.204 29.120
20 HD1 PHE 4 HD1 PHE 4 23.641 18.018 29.734
21 HD2 PHE 4 HD2 PHE 4 23.949 22.098 31.109
22 HE1 PHE 4 HE1 PHE 4 21.362 17.881 30.652
23 HE2 PHE 4 HE2 PHE 4 21.705 21.892 32.152
24 HZ PHE 4 HZ PHE 4 20.367 19.827 31.823
25 H CYS 5 H CYS 5 25.703 16.876 27.734
26 HA CYS 5 HA CYS 5 24.000 17.314 25.428
27 HB2 CYS 5 HB2 CYS 5 25.390 15.368 25.511
28 HB3 CYS 5 HB3 CYS 5 24.778 14.922 27.100
29 H ASN 6 H ASN 6 21.910 17.504 25.304
30 HA ASN 6 HA ASN 6 19.957 16.016 26.602
31 HB2 ASN 6 HB2 ASN 6 20.272 17.437 28.611
32 HB3 ASN 6 HB3 ASN 6 20.156 18.889 27.657
33 HD21 ASN 6 HD22 ASN 6 18.366 16.025 28.791
34 HD22 ASN 6 HD21 ASN 6 16.769 16.770 28.579
35 H LEU 7 H LEU 7 18.635 15.862 24.742
36 HA LEU 7 HA LEU 7 18.994 17.627 22.563
37 HB2 LEU 7 HB2 LEU 7 18.185 15.305 22.380
38 HB3 LEU 7 HB3 LEU 7 16.675 15.749 23.172
39 HG LEU 7 HG LEU 7 15.998 17.135 21.301
40 HD11 LEU 7 HD11 LEU 7 18.702 16.503 20.052
41 HD12 LEU 7 HD12 LEU 7 17.338 17.265 19.213
42 HD13 LEU 7 HD13 LEU 7 18.122 18.103 20.544
43 HD21 LEU 7 HD21 LEU 7 15.584 14.718 21.144
44 HD22 LEU 7 HD22 LEU 7 15.857 15.418 19.540
45 HD23 LEU 7 HD23 LEU 7 17.145 14.484 20.328
46 H ALA 8 H ALA 8 16.373 17.745 25.051
47 HA ALA 8 HA ALA 8 14.925 19.821 23.784
48 HB1 ALA 8 HB1 ALA 8 14.039 18.472 25.625
49 HB2 ALA 8 HB2 ALA 8 15.212 19.214 26.741
50 HB3 ALA 8 HB3 ALA 8 13.934 20.205 26.002
51 H ARG 9 H ARG 9 17.554 20.182 26.323
52 HA ARG 9 HA ARG 9 17.770 22.982 26.303
53 HB2 ARG 9 HB2 ARG 9 18.728 21.176 27.850
54 HB3 ARG 9 HB3 ARG 9 19.874 20.782 26.581
55 HG2 ARG 9 HG2 ARG 9 20.107 23.545 26.905
56 HG3 ARG 9 HG3 ARG 9 19.888 22.922 28.541
57 HD2 ARG 9 HD2 ARG 9 21.833 21.472 28.334
58 HD3 ARG 9 HD3 ARG 9 21.905 21.734 26.582
59 HE ARG 9 HE ARG 9 22.215 24.211 28.086
60 HH11 ARG 9 HH21 ARG 9 24.148 21.461 26.935
61 HH12 ARG 9 HH22 ARG 9 25.534 22.477 26.728
62 HH21 ARG 9 HH11 ARG 9 23.969 25.350 27.803
63 HH22 ARG 9 HH12 ARG 9 25.442 24.637 27.152
64 H CYS 10 H CYS 10 19.306 20.528 24.262
65 HA CYS 10 HA CYS 10 21.214 22.330 23.118
66 HB2 CYS 10 HB2 CYS 10 21.430 19.816 23.554
67 HB3 CYS 10 HB3 CYS 10 20.486 19.578 22.087
68 H GLU 11 H GLU 11 18.188 20.816 21.786
69 HA GLU 11 HA GLU 11 18.382 22.106 19.248
70 HB2 GLU 11 HB2 GLU 11 16.199 20.843 20.831
71 HB3 GLU 11 HB3 GLU 11 15.686 21.998 19.615
72 HG2 GLU 11 HG2 GLU 11 17.680 19.818 18.907
73 HG3 GLU 11 HG3 GLU 11 15.942 19.516 18.911
74 H LEU 12 H LEU 12 16.888 23.256 22.331
75 HA LEU 12 HA LEU 12 16.104 25.824 21.335
76 HB2 LEU 12 HB2 LEU 12 16.746 24.784 24.123
77 HB3 LEU 12 HB3 LEU 12 16.182 26.426 23.836
78 HG LEU 12 HG LEU 12 14.606 23.940 23.064
79 HD11 LEU 12 HD11 LEU 12 14.861 24.149 25.510
80 HD12 LEU 12 HD12 LEU 12 14.270 25.824 25.429
81 HD13 LEU 12 HD13 LEU 12 13.193 24.473 25.005
82 HD21 LEU 12 HD21 LEU 12 13.814 26.875 23.157
83 HD22 LEU 12 HD22 LEU 12 13.947 25.867 21.697
84 HD23 LEU 12 HD23 LEU 12 12.698 25.520 22.898
85 H SER 13 H SER 13 19.166 24.781 22.817
86 HA SER 13 HA SER 13 20.320 27.456 22.860
87 HB2 SER 13 HB2 SER 13 21.647 24.732 23.150
88 HB3 SER 13 HB3 SER 13 22.404 26.299 23.487
89 HG SER 13 HG SER 13 20.198 25.093 24.784
90 H CYS 14 H CYS 14 20.561 24.706 20.574
91 HA CYS 14 HA CYS 14 22.396 26.143 18.820
92 HB2 CYS 14 HB2 CYS 14 20.581 23.809 18.160
93 HB3 CYS 14 HB3 CYS 14 21.954 24.396 17.206
94 H ARG 15 H ARG 15 18.810 26.088 19.152
95 HA ARG 15 HA ARG 15 18.204 27.673 16.872
96 HB2 ARG 15 HB2 ARG 15 16.682 26.632 18.921
97 HB3 ARG 15 HB3 ARG 15 16.774 28.302 19.440
98 HG2 ARG 15 HG2 ARG 15 14.977 28.577 18.091
99 HG3 ARG 15 HG3 ARG 15 16.153 28.675 16.795
100 HD2 ARG 15 HD2 ARG 15 14.584 26.239 17.715
101 HD3 ARG 15 HD3 ARG 15 14.378 27.116 16.196
102 HE ARG 15 HE ARG 15 16.751 26.384 15.619
103 HH11 ARG 15 HH11 ARG 15 14.564 24.263 17.444
104 HH12 ARG 15 HH12 ARG 15 15.562 22.872 17.056
105 HH21 ARG 15 HH21 ARG 15 18.111 24.541 15.612
106 HH22 ARG 15 HH22 ARG 15 17.454 23.042 16.213
107 H SER 16 H SER 16 19.430 28.702 20.062
108 HA SER 16 HA SER 16 19.336 31.500 19.636
109 HB2 SER 16 HB2 SER 16 21.522 30.090 21.191
110 HB3 SER 16 HB3 SER 16 20.823 31.689 21.478
111 HG SER 16 HG SER 16 18.821 30.588 21.969
112 H LEU 17 H LEU 17 21.465 29.146 18.204
113 HA LEU 17 HA LEU 17 23.270 31.251 17.081
114 HB2 LEU 17 HB2 LEU 17 23.401 28.252 16.834
115 HB3 LEU 17 HB3 LEU 17 24.658 29.408 16.371
116 HG LEU 17 HG LEU 17 23.746 28.440 19.054
117 HD11 LEU 17 HD11 LEU 17 26.085 27.748 19.334
118 HD12 LEU 17 HD12 LEU 17 25.343 27.026 17.903
119 HD13 LEU 17 HD13 LEU 17 26.468 28.389 17.724
120 HD21 LEU 17 HD21 LEU 17 25.748 30.705 18.541
121 HD22 LEU 17 HD22 LEU 17 24.173 30.883 19.347
122 HD23 LEU 17 HD23 LEU 17 25.453 29.942 20.122
123 H GLY 18 H GLY 18 20.716 28.988 16.207
124 HA2 GLY 18 HA2 GLY 18 19.229 29.479 14.375
125 HA3 GLY 18 HA3 GLY 18 20.578 30.121 13.443
126 H LEU 19 H LEU 19 21.062 27.051 15.117
127 HA LEU 19 HA LEU 19 20.643 25.527 12.604
128 HB2 LEU 19 HB2 LEU 19 22.819 24.543 12.660
129 HB3 LEU 19 HB3 LEU 19 22.931 26.270 12.449
130 HG LEU 19 HG LEU 19 23.244 25.132 15.229
131 HD11 LEU 19 HD11 LEU 19 25.716 24.909 14.758
132 HD12 LEU 19 HD12 LEU 19 24.713 23.726 13.895
133 HD13 LEU 19 HD13 LEU 19 25.364 25.125 13.037
134 HD21 LEU 19 HD21 LEU 19 24.726 26.985 15.584
135 HD22 LEU 19 HD22 LEU 19 24.771 27.375 13.845
136 HD23 LEU 19 HD23 LEU 19 23.296 27.636 14.774
137 H LEU 20 H LEU 20 21.565 23.061 13.243
138 HA LEU 20 HA LEU 20 19.234 22.219 14.828
139 HB2 LEU 20 HB2 LEU 20 19.669 21.537 12.453
140 HB3 LEU 20 HB3 LEU 20 21.136 20.736 12.989
141 HG LEU 20 HG LEU 20 19.729 19.189 14.403
142 HD11 LEU 20 HD11 LEU 20 17.439 20.411 12.784
143 HD12 LEU 20 HD12 LEU 20 17.341 18.993 13.853
144 HD13 LEU 20 HD13 LEU 20 17.660 20.587 14.537
145 HD21 LEU 20 HD21 LEU 20 19.000 17.850 12.469
146 HD22 LEU 20 HD22 LEU 20 19.160 19.268 11.410
147 HD23 LEU 20 HD23 LEU 20 20.596 18.560 12.178
148 H GLY 21 H GLY 21 19.266 20.909 16.636
149 HA2 GLY 21 HA2 GLY 21 21.799 20.674 18.108
150 HA3 GLY 21 HA3 GLY 21 20.181 20.406 18.729
151 H LYS 22 H LYS 22 22.861 18.943 18.704
152 HA LYS 22 HA LYS 22 21.756 16.214 18.619
153 HB2 LYS 22 HB2 LYS 22 23.435 17.212 16.615
154 HB3 LYS 22 HB3 LYS 22 24.602 16.560 17.746
155 HG2 LYS 22 HG2 LYS 22 24.101 14.821 16.180
156 HG3 LYS 22 HG3 LYS 22 23.309 14.369 17.689
157 HD2 LYS 22 HD2 LYS 22 21.729 13.923 16.002
158 HD3 LYS 22 HD3 LYS 22 21.170 15.441 16.737
159 HE2 LYS 22 HE2 LYS 22 21.905 16.751 14.904
160 HE3 LYS 22 HE3 LYS 22 22.939 15.447 14.285
161 HZ1 LYS 22 HZ1 LYS 22 19.949 15.381 14.256
162 HZ2 LYS 22 HZ2 LYS 22 20.917 15.595 12.965
163 HZ3 LYS 22 HZ3 LYS 22 20.958 14.179 13.751
164 H CYS 23 H CYS 23 23.402 14.642 19.618
165 HA CYS 23 HA CYS 23 24.800 15.813 21.988
166 HB2 CYS 23 HB2 CYS 23 22.741 14.797 22.754
167 HB3 CYS 23 HB3 CYS 23 23.047 13.347 21.814
168 H ILE 24 H ILE 24 26.784 14.949 22.461
169 HA ILE 24 HA ILE 24 27.562 12.343 21.251
170 HB ILE 24 HB ILE 24 29.443 14.734 21.336
171 HG12 ILE 24 HG12 ILE 24 28.197 13.414 18.885
172 HG13 ILE 24 HG13 ILE 24 27.785 15.011 19.512
173 HG21 ILE 24 HG21 ILE 24 30.511 12.481 21.718
174 HG22 ILE 24 HG22 ILE 24 29.836 11.938 20.167
175 HG23 ILE 24 HG23 ILE 24 31.049 13.236 20.233
176 HD11 ILE 24 HD11 ILE 24 30.135 15.758 19.132
177 HD12 ILE 24 HD12 ILE 24 30.441 14.217 18.291
178 HD13 ILE 24 HD13 ILE 24 29.232 15.340 17.663
179 H GLY 25 H GLY 25 27.876 11.029 22.992
180 HA2 GLY 25 HA2 GLY 25 28.885 10.211 24.901
181 HA3 GLY 25 HA3 GLY 25 29.888 11.643 24.946
182 H GLU 26 H GLU 26 29.012 13.519 25.869
183 HA GLU 26 HA GLU 26 26.695 13.515 27.618
184 HB2 GLU 26 HB2 GLU 26 27.837 13.989 29.688
185 HB3 GLU 26 HB3 GLU 26 28.216 12.378 29.073
186 HG2 GLU 26 HG2 GLU 26 30.318 13.286 28.091
187 HG3 GLU 26 HG3 GLU 26 29.927 14.848 28.824
188 H GLU 27 H GLU 27 28.014 14.985 25.256
189 HA GLU 27 HA GLU 27 27.880 17.784 26.259
190 HB2 GLU 27 HB2 GLU 27 30.130 17.098 25.601
191 HB3 GLU 27 HB3 GLU 27 29.502 16.509 24.048
192 HG2 GLU 27 HG2 GLU 27 29.083 18.618 23.200
193 HG3 GLU 27 HG3 GLU 27 29.103 19.357 24.807
194 H CYS 28 H CYS 28 26.854 19.276 25.026
195 HA CYS 28 HA CYS 28 24.890 18.412 22.969
196 HB2 CYS 28 HB2 CYS 28 23.909 19.844 24.550
197 HB3 CYS 28 HB3 CYS 28 25.328 20.882 24.629
198 H LYS 29 H LYS 29 25.190 18.772 20.848
199 HA LYS 29 HA LYS 29 27.397 20.539 19.914
200 HB2 LYS 29 HB2 LYS 29 27.958 17.951 20.159
201 HB3 LYS 29 HB3 LYS 29 26.883 17.760 18.782
202 HG2 LYS 29 HG2 LYS 29 28.864 17.912 17.683
203 HG3 LYS 29 HG3 LYS 29 28.468 19.627 17.695
204 HD2 LYS 29 HD2 LYS 29 30.267 18.200 19.719
205 HD3 LYS 29 HD3 LYS 29 30.846 19.093 18.307
206 HE2 LYS 29 HE2 LYS 29 29.886 21.168 19.170
207 HE3 LYS 29 HE3 LYS 29 29.219 20.322 20.575
208 HZ1 LYS 29 HZ1 LYS 29 32.119 20.446 19.997
209 HZ2 LYS 29 HZ2 LYS 29 31.311 21.493 20.982
210 HZ3 LYS 29 HZ3 LYS 29 31.389 19.903 21.380
211 H CYS 30 H CYS 30 26.841 21.797 18.243
212 HA CYS 30 HA CYS 30 24.203 21.297 16.978
213 HB2 CYS 30 HB2 CYS 30 25.783 23.837 16.726
214 HB3 CYS 30 HB3 CYS 30 24.088 23.543 16.426
215 H VAL 31 H VAL 31 23.883 21.201 14.813
216 HA VAL 31 HA VAL 31 26.230 21.022 12.981
217 HB VAL 31 HB VAL 31 25.007 19.028 11.909
218 HG11 VAL 31 HG11 VAL 31 26.152 17.438 13.359
219 HG12 VAL 31 HG12 VAL 31 27.148 18.865 13.066
220 HG13 VAL 31 HG13 VAL 31 26.316 18.668 14.626
221 HG21 VAL 31 HG21 VAL 31 23.666 17.612 13.323
222 HG22 VAL 31 HG22 VAL 31 23.752 18.766 14.668
223 HG23 VAL 31 HG23 VAL 31 22.884 19.193 13.177
224 HA PRO 32 HA PRO 32 23.637 23.187 10.092
225 HB2 PRO 32 HB2 PRO 32 24.693 22.473 7.676
226 HB3 PRO 32 HB3 PRO 32 25.586 23.483 8.853
227 HG2 PRO 32 HG2 PRO 32 25.795 20.470 8.467
228 HG3 PRO 32 HG3 PRO 32 27.127 21.674 8.521
229 HD2 PRO 32 HD2 PRO 32 26.384 20.236 10.686
230 HD3 PRO 32 HD3 PRO 32 26.898 21.943 10.851
231 H TYR 33 H TYR 33 22.096 22.913 8.380
232 HA TYR 33 HA TYR 33 20.379 20.622 8.838
233 HB2 TYR 33 HB2 TYR 33 20.115 23.050 7.034
234 HB3 TYR 33 HB3 TYR 33 18.861 21.848 7.271
235 HD1 TYR 33 HD2 TYR 33 17.995 21.403 9.658
236 HD2 TYR 33 HD1 TYR 33 20.251 24.909 8.548
237 HE1 TYR 33 HE2 TYR 33 17.025 22.647 11.594
238 HE2 TYR 33 HE1 TYR 33 19.247 26.157 10.455
239 HH TYR 33 HH TYR 33 17.732 26.098 12.138
Start of MODEL 20
1 H1 GLY 1 H1 GLY 1 29.981 16.205 29.863
2 H2 GLY 1 H2 GLY 1 29.178 17.347 28.988
3 H3 GLY 1 H3 GLY 1 29.029 17.276 30.645
4 HA2 GLY 1 HA2 GLY 1 31.357 17.834 30.920
5 HA3 GLY 1 HA3 GLY 1 31.483 17.931 29.157
6 H SER 2 H SER 2 31.859 19.999 28.802
7 HA SER 2 HA SER 2 30.924 22.273 30.209
8 HB2 SER 2 HB2 SER 2 31.971 23.517 28.458
9 HB3 SER 2 HB3 SER 2 32.950 22.068 28.710
10 HG SER 2 HG SER 2 31.610 21.163 26.859
11 H ALA 3 H ALA 3 29.359 20.502 27.604
12 HA ALA 3 HA ALA 3 27.406 22.711 27.235
13 HB1 ALA 3 HB1 ALA 3 28.986 22.418 25.350
14 HB2 ALA 3 HB2 ALA 3 28.459 20.726 25.177
15 HB3 ALA 3 HB3 ALA 3 27.324 22.057 24.866
16 H PHE 4 H PHE 4 27.665 19.483 28.036
17 HA PHE 4 HA PHE 4 26.250 18.003 28.955
18 HB2 PHE 4 HB2 PHE 4 25.624 20.123 30.125
19 HB3 PHE 4 HB3 PHE 4 24.223 20.242 29.070
20 HD1 PHE 4 HD2 PHE 4 22.473 18.349 29.123
21 HD2 PHE 4 HD1 PHE 4 25.598 18.784 32.067
22 HE1 PHE 4 HE2 PHE 4 21.225 16.867 30.677
23 HE2 PHE 4 HE1 PHE 4 24.307 17.361 33.632
24 HZ PHE 4 HZ PHE 4 22.113 16.428 32.948
25 H CYS 5 H CYS 5 25.145 16.289 28.363
26 HA CYS 5 HA CYS 5 23.773 16.211 25.775
27 HB2 CYS 5 HB2 CYS 5 25.258 14.407 26.609
28 HB3 CYS 5 HB3 CYS 5 24.064 14.104 27.879
29 H ASN 6 H ASN 6 22.011 17.461 25.988
30 HA ASN 6 HA ASN 6 19.678 15.845 26.614
31 HB2 ASN 6 HB2 ASN 6 19.828 17.145 28.720
32 HB3 ASN 6 HB3 ASN 6 19.880 18.646 27.818
33 HD21 ASN 6 HD22 ASN 6 18.013 18.655 29.629
34 HD22 ASN 6 HD21 ASN 6 16.421 18.356 28.922
35 H LEU 7 H LEU 7 18.923 15.726 24.576
36 HA LEU 7 HA LEU 7 19.229 17.539 22.474
37 HB2 LEU 7 HB2 LEU 7 18.378 15.180 22.356
38 HB3 LEU 7 HB3 LEU 7 16.850 15.736 23.053
39 HG LEU 7 HG LEU 7 16.491 17.195 21.042
40 HD11 LEU 7 HD11 LEU 7 17.846 16.739 19.014
41 HD12 LEU 7 HD12 LEU 7 18.816 17.491 20.277
42 HD13 LEU 7 HD13 LEU 7 18.956 15.740 19.976
43 HD21 LEU 7 HD21 LEU 7 16.961 14.245 20.446
44 HD22 LEU 7 HD22 LEU 7 15.501 14.944 21.185
45 HD23 LEU 7 HD23 LEU 7 15.928 15.357 19.520
46 H ALA 8 H ALA 8 16.613 17.601 24.955
47 HA ALA 8 HA ALA 8 15.021 19.571 23.625
48 HB1 ALA 8 HB1 ALA 8 15.215 18.849 26.580
49 HB2 ALA 8 HB2 ALA 8 13.871 19.699 25.796
50 HB3 ALA 8 HB3 ALA 8 14.206 18.011 25.373
51 H ARG 9 H ARG 9 17.631 19.933 26.116
52 HA ARG 9 HA ARG 9 17.466 22.775 26.338
53 HB2 ARG 9 HB2 ARG 9 18.384 20.942 27.932
54 HB3 ARG 9 HB3 ARG 9 19.798 20.858 26.874
55 HG2 ARG 9 HG2 ARG 9 20.164 23.238 27.193
56 HG3 ARG 9 HG3 ARG 9 18.760 23.336 28.278
57 HD2 ARG 9 HD2 ARG 9 19.853 21.891 29.918
58 HD3 ARG 9 HD3 ARG 9 21.199 21.572 28.801
59 HE ARG 9 HE ARG 9 20.898 24.407 29.295
60 HH11 ARG 9 HH11 ARG 9 22.217 21.614 31.057
61 HH12 ARG 9 HH12 ARG 9 23.604 22.535 31.562
62 HH21 ARG 9 HH21 ARG 9 22.401 25.491 30.197
63 HH22 ARG 9 HH22 ARG 9 23.528 24.763 31.357
64 H CYS 10 H CYS 10 19.399 20.525 24.440
65 HA CYS 10 HA CYS 10 21.251 22.350 23.322
66 HB2 CYS 10 HB2 CYS 10 21.449 19.846 23.624
67 HB3 CYS 10 HB3 CYS 10 20.342 19.646 22.266
68 H GLU 11 H GLU 11 18.165 20.979 22.020
69 HA GLU 11 HA GLU 11 18.350 22.109 19.456
70 HB2 GLU 11 HB2 GLU 11 16.043 21.287 21.205
71 HB3 GLU 11 HB3 GLU 11 15.732 22.085 19.665
72 HG2 GLU 11 HG2 GLU 11 17.622 19.707 19.782
73 HG3 GLU 11 HG3 GLU 11 15.881 19.489 19.739
74 H LEU 12 H LEU 12 16.948 23.616 22.405
75 HA LEU 12 HA LEU 12 16.312 26.120 21.067
76 HB2 LEU 12 HB2 LEU 12 16.248 25.054 23.882
77 HB3 LEU 12 HB3 LEU 12 16.259 26.800 23.648
78 HG LEU 12 HG LEU 12 14.266 26.685 22.237
79 HD11 LEU 12 HD11 LEU 12 12.889 24.597 22.206
80 HD12 LEU 12 HD12 LEU 12 14.372 24.469 21.257
81 HD13 LEU 12 HD13 LEU 12 14.281 23.709 22.861
82 HD21 LEU 12 HD21 LEU 12 13.927 25.257 24.907
83 HD22 LEU 12 HD22 LEU 12 14.086 27.013 24.684
84 HD23 LEU 12 HD23 LEU 12 12.677 26.172 24.030
85 H SER 13 H SER 13 19.125 24.971 22.940
86 HA SER 13 HA SER 13 20.520 27.498 22.992
87 HB2 SER 13 HB2 SER 13 21.447 24.621 23.126
88 HB3 SER 13 HB3 SER 13 22.570 25.988 23.198
89 HG SER 13 HG SER 13 21.563 24.998 25.203
90 H CYS 14 H CYS 14 20.735 24.718 20.663
91 HA CYS 14 HA CYS 14 22.523 26.176 18.912
92 HB2 CYS 14 HB2 CYS 14 20.777 23.781 18.295
93 HB3 CYS 14 HB3 CYS 14 22.121 24.375 17.304
94 H ARG 15 H ARG 15 18.927 25.882 18.886
95 HA ARG 15 HA ARG 15 18.371 27.419 16.568
96 HB2 ARG 15 HB2 ARG 15 16.647 26.287 17.898
97 HB3 ARG 15 HB3 ARG 15 16.973 27.340 19.279
98 HG2 ARG 15 HG2 ARG 15 16.195 29.296 17.922
99 HG3 ARG 15 HG3 ARG 15 15.779 28.190 16.608
100 HD2 ARG 15 HD2 ARG 15 14.653 28.125 19.450
101 HD3 ARG 15 HD3 ARG 15 13.860 28.883 18.064
102 HE ARG 15 HE ARG 15 14.135 26.395 17.101
103 HH11 ARG 15 HH11 ARG 15 12.689 27.570 20.125
104 HH12 ARG 15 HH12 ARG 15 11.583 26.213 20.160
105 HH21 ARG 15 HH21 ARG 15 12.845 24.556 17.508
106 HH22 ARG 15 HH22 ARG 15 11.609 24.687 18.752
107 H SER 16 H SER 16 19.472 28.451 19.755
108 HA SER 16 HA SER 16 19.271 31.294 19.174
109 HB2 SER 16 HB2 SER 16 20.734 29.969 21.475
110 HB3 SER 16 HB3 SER 16 20.251 31.660 21.327
111 HG SER 16 HG SER 16 18.539 29.377 21.498
112 H LEU 17 H LEU 17 21.485 29.077 17.960
113 HA LEU 17 HA LEU 17 23.335 31.343 17.327
114 HB2 LEU 17 HB2 LEU 17 24.185 28.555 16.806
115 HB3 LEU 17 HB3 LEU 17 25.153 29.954 17.159
116 HG LEU 17 HG LEU 17 23.536 28.349 19.175
117 HD11 LEU 17 HD11 LEU 17 25.331 27.004 18.209
118 HD12 LEU 17 HD12 LEU 17 26.511 28.283 18.555
119 HD13 LEU 17 HD13 LEU 17 25.707 27.420 19.888
120 HD21 LEU 17 HD21 LEU 17 24.043 30.704 19.915
121 HD22 LEU 17 HD22 LEU 17 24.881 29.485 20.890
122 HD23 LEU 17 HD23 LEU 17 25.765 30.382 19.642
123 H GLY 18 H GLY 18 20.803 29.541 16.163
124 HA2 GLY 18 HA2 GLY 18 19.745 29.961 14.113
125 HA3 GLY 18 HA3 GLY 18 21.274 30.436 13.383
126 H LEU 19 H LEU 19 21.163 27.338 15.087
127 HA LEU 19 HA LEU 19 20.631 25.804 12.643
128 HB2 LEU 19 HB2 LEU 19 22.678 24.630 12.633
129 HB3 LEU 19 HB3 LEU 19 23.037 26.343 12.499
130 HG LEU 19 HG LEU 19 23.275 24.708 15.039
131 HD11 LEU 19 HD11 LEU 19 24.868 23.931 13.274
132 HD12 LEU 19 HD12 LEU 19 25.433 25.595 13.059
133 HD13 LEU 19 HD13 LEU 19 25.736 24.741 14.582
134 HD21 LEU 19 HD21 LEU 19 23.140 26.998 15.646
135 HD22 LEU 19 HD22 LEU 19 24.829 26.527 15.769
136 HD23 LEU 19 HD23 LEU 19 24.286 27.479 14.369
137 H LEU 20 H LEU 20 21.490 23.297 13.509
138 HA LEU 20 HA LEU 20 19.140 22.728 15.218
139 HB2 LEU 20 HB2 LEU 20 19.450 21.873 12.851
140 HB3 LEU 20 HB3 LEU 20 20.849 20.997 13.409
141 HG LEU 20 HG LEU 20 19.273 19.732 15.006
142 HD11 LEU 20 HD11 LEU 20 17.396 21.408 14.879
143 HD12 LEU 20 HD12 LEU 20 17.170 20.982 13.172
144 HD13 LEU 20 HD13 LEU 20 16.901 19.772 14.448
145 HD21 LEU 20 HD21 LEU 20 20.107 18.751 12.903
146 HD22 LEU 20 HD22 LEU 20 18.435 18.261 13.220
147 HD23 LEU 20 HD23 LEU 20 18.776 19.515 12.010
148 H GLY 21 H GLY 21 19.232 21.187 16.997
149 HA2 GLY 21 HA2 GLY 21 21.957 20.875 18.214
150 HA3 GLY 21 HA3 GLY 21 20.436 20.909 19.088
151 H LYS 22 H LYS 22 22.774 18.979 18.805
152 HA LYS 22 HA LYS 22 21.162 16.515 19.103
153 HB2 LYS 22 HB2 LYS 22 23.732 16.731 17.462
154 HB3 LYS 22 HB3 LYS 22 22.994 15.213 17.960
155 HG2 LYS 22 HG2 LYS 22 21.737 17.249 16.088
156 HG3 LYS 22 HG3 LYS 22 22.526 15.740 15.619
157 HD2 LYS 22 HD2 LYS 22 20.788 14.455 16.865
158 HD3 LYS 22 HD3 LYS 22 20.001 15.985 17.297
159 HE2 LYS 22 HE2 LYS 22 19.941 16.490 14.770
160 HE3 LYS 22 HE3 LYS 22 20.390 14.799 14.527
161 HZ1 LYS 22 HZ1 LYS 22 18.360 14.236 15.894
162 HZ2 LYS 22 HZ2 LYS 22 17.947 15.830 15.871
163 HZ3 LYS 22 HZ3 LYS 22 18.002 14.973 14.473
164 H CYS 23 H CYS 23 22.319 14.871 20.343
165 HA CYS 23 HA CYS 23 24.427 16.004 22.148
166 HB2 CYS 23 HB2 CYS 23 22.711 15.231 23.519
167 HB3 CYS 23 HB3 CYS 23 22.427 13.790 22.538
168 H ILE 24 H ILE 24 26.449 15.201 22.136
169 HA ILE 24 HA ILE 24 27.010 12.593 20.805
170 HB ILE 24 HB ILE 24 28.733 15.088 20.581
171 HG12 ILE 24 HG12 ILE 24 27.119 13.535 18.499
172 HG13 ILE 24 HG13 ILE 24 26.792 15.172 19.070
173 HG21 ILE 24 HG21 ILE 24 29.190 12.280 19.473
174 HG22 ILE 24 HG22 ILE 24 30.253 13.682 19.240
175 HG23 ILE 24 HG23 ILE 24 30.078 12.991 20.840
176 HD11 ILE 24 HD11 ILE 24 28.998 15.901 18.100
177 HD12 ILE 24 HD12 ILE 24 29.126 14.293 17.343
178 HD13 ILE 24 HD13 ILE 24 27.782 15.366 16.924
179 H GLY 25 H GLY 25 27.606 11.216 22.275
180 HA2 GLY 25 HA2 GLY 25 28.472 10.258 24.171
181 HA3 GLY 25 HA3 GLY 25 29.659 11.561 24.223
182 H GLU 26 H GLU 26 29.316 13.296 25.531
183 HA GLU 26 HA GLU 26 26.969 13.339 27.346
184 HB2 GLU 26 HB2 GLU 26 28.310 13.849 29.275
185 HB3 GLU 26 HB3 GLU 26 28.631 12.242 28.617
186 HG2 GLU 26 HG2 GLU 26 30.632 12.979 27.552
187 HG3 GLU 26 HG3 GLU 26 30.299 14.674 27.923
188 H GLU 27 H GLU 27 27.896 14.965 24.912
189 HA GLU 27 HA GLU 27 27.672 17.692 26.119
190 HB2 GLU 27 HB2 GLU 27 29.420 16.702 23.830
191 HB3 GLU 27 HB3 GLU 27 29.125 18.405 24.152
192 HG2 GLU 27 HG2 GLU 27 30.388 16.533 26.199
193 HG3 GLU 27 HG3 GLU 27 31.301 17.487 25.035
194 H CYS 28 H CYS 28 26.414 19.194 25.098
195 HA CYS 28 HA CYS 28 24.734 18.487 22.790
196 HB2 CYS 28 HB2 CYS 28 23.796 19.989 24.409
197 HB3 CYS 28 HB3 CYS 28 25.241 20.997 24.406
198 H LYS 29 H LYS 29 25.367 18.706 20.708
199 HA LYS 29 HA LYS 29 27.509 20.652 19.966
200 HB2 LYS 29 HB2 LYS 29 27.214 17.757 19.083
201 HB3 LYS 29 HB3 LYS 29 28.200 18.922 18.225
202 HG2 LYS 29 HG2 LYS 29 28.624 18.184 21.159
203 HG3 LYS 29 HG3 LYS 29 29.423 17.369 19.835
204 HD2 LYS 29 HD2 LYS 29 29.751 20.340 20.419
205 HD3 LYS 29 HD3 LYS 29 30.832 19.060 20.974
206 HE2 LYS 29 HE2 LYS 29 31.171 18.371 18.559
207 HE3 LYS 29 HE3 LYS 29 30.262 19.810 18.077
208 HZ1 LYS 29 HZ1 LYS 29 32.831 19.773 19.576
209 HZ2 LYS 29 HZ2 LYS 29 32.607 20.255 18.031
210 HZ3 LYS 29 HZ3 LYS 29 31.974 21.144 19.267
211 H CYS 30 H CYS 30 26.950 21.934 18.293
212 HA CYS 30 HA CYS 30 24.214 21.534 17.211
213 HB2 CYS 30 HB2 CYS 30 25.925 23.982 16.820
214 HB3 CYS 30 HB3 CYS 30 24.209 23.773 16.598
215 H VAL 31 H VAL 31 23.676 21.411 15.089
216 HA VAL 31 HA VAL 31 25.850 20.633 13.200
217 HB VAL 31 HB VAL 31 24.177 18.802 12.455
218 HG11 VAL 31 HG11 VAL 31 26.337 18.339 13.518
219 HG12 VAL 31 HG12 VAL 31 25.588 18.505 15.127
220 HG13 VAL 31 HG13 VAL 31 25.081 17.195 14.036
221 HG21 VAL 31 HG21 VAL 31 22.259 19.522 13.836
222 HG22 VAL 31 HG22 VAL 31 22.734 17.844 14.079
223 HG23 VAL 31 HG23 VAL 31 23.159 19.072 15.299
224 HA PRO 32 HA PRO 32 23.968 23.191 10.248
225 HB2 PRO 32 HB2 PRO 32 24.255 21.801 7.870
226 HB3 PRO 32 HB3 PRO 32 25.617 22.577 8.737
227 HG2 PRO 32 HG2 PRO 32 24.706 19.681 8.849
228 HG3 PRO 32 HG3 PRO 32 26.373 20.305 8.601
229 HD2 PRO 32 HD2 PRO 32 25.503 19.510 11.001
230 HD3 PRO 32 HD3 PRO 32 26.549 20.946 10.862
231 H TYR 33 H TYR 33 22.222 23.539 8.920
232 HA TYR 33 HA TYR 33 19.937 21.644 8.887
233 HB2 TYR 33 HB2 TYR 33 20.342 24.389 7.642
234 HB3 TYR 33 HB3 TYR 33 18.873 23.445 7.527
235 HD1 TYR 33 HD1 TYR 33 18.955 22.557 10.613
236 HD2 TYR 33 HD2 TYR 33 19.203 26.292 8.490
237 HE1 TYR 33 HE1 TYR 33 17.940 23.739 12.564
238 HE2 TYR 33 HE2 TYR 33 18.198 27.476 10.449
239 HH TYR 33 HH TYR 33 17.232 25.712 13.414