Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
510947 | 2ky3 RC | 17227 | 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 9.351 12.149 30.390
2 H2 GLY 1 H2 GLY 1 10.749 11.471 30.945
3 H3 GLY 1 H3 GLY 1 10.417 11.451 29.338
4 HA2 GLY 1 HA2 GLY 1 10.933 13.853 30.936
5 HA3 GLY 1 HA3 GLY 1 12.084 13.094 29.830
6 H SER 2 H SER 2 12.310 14.474 28.172
7 HA SER 2 HA SER 2 11.892 15.846 26.444
8 HB2 SER 2 HB2 SER 2 9.834 13.696 25.979
9 HB3 SER 2 HB3 SER 2 10.184 14.958 24.789
10 HG SER 2 HG SER 2 11.422 12.815 24.836
11 H ALA 3 H ALA 3 10.833 16.957 28.755
12 HA ALA 3 HA ALA 3 8.298 18.256 27.935
13 HB1 ALA 3 HB1 ALA 3 9.725 18.325 30.605
14 HB2 ALA 3 HB2 ALA 3 8.110 18.938 30.236
15 HB3 ALA 3 HB3 ALA 3 8.423 17.197 30.154
16 H PHE 4 H PHE 4 7.968 20.400 27.944
17 HA PHE 4 HA PHE 4 8.195 22.554 27.636
18 HB2 PHE 4 HB2 PHE 4 10.791 22.452 29.153
19 HB3 PHE 4 HB3 PHE 4 9.747 23.848 28.922
20 HD1 PHE 4 HD1 PHE 4 7.239 23.566 29.792
21 HD2 PHE 4 HD2 PHE 4 10.569 21.168 31.125
22 HE1 PHE 4 HE1 PHE 4 5.987 22.962 31.851
23 HE2 PHE 4 HE2 PHE 4 9.312 20.564 33.175
24 HZ PHE 4 HZ PHE 4 7.018 21.456 33.544
25 H CYS 5 H CYS 5 11.328 21.047 26.711
26 HA CYS 5 HA CYS 5 11.840 23.217 24.778
27 HB2 CYS 5 HB2 CYS 5 13.632 21.926 26.038
28 HB3 CYS 5 HB3 CYS 5 13.243 20.558 24.995
29 H ASN 6 H ASN 6 11.203 23.253 22.671
30 HA ASN 6 HA ASN 6 10.334 20.684 21.371
31 HB2 ASN 6 HB2 ASN 6 8.713 22.629 21.300
32 HB3 ASN 6 HB3 ASN 6 9.888 23.506 20.311
33 HD21 ASN 6 HD21 ASN 6 7.291 22.954 19.415
34 HD22 ASN 6 HD22 ASN 6 7.442 21.812 18.075
35 H LEU 7 H LEU 7 11.766 19.752 19.923
36 HA LEU 7 HA LEU 7 14.365 20.872 19.457
37 HB2 LEU 7 HB2 LEU 7 14.039 18.515 19.147
38 HB3 LEU 7 HB3 LEU 7 12.843 18.767 17.876
39 HG LEU 7 HG LEU 7 15.608 19.967 17.469
40 HD11 LEU 7 HD11 LEU 7 16.100 17.703 18.307
41 HD12 LEU 7 HD12 LEU 7 14.915 17.010 17.188
42 HD13 LEU 7 HD13 LEU 7 16.370 17.780 16.547
43 HD21 LEU 7 HD21 LEU 7 13.755 18.397 15.593
44 HD22 LEU 7 HD22 LEU 7 13.752 20.160 15.693
45 HD23 LEU 7 HD23 LEU 7 15.202 19.321 15.139
46 H ARG 8 H ARG 8 11.305 21.265 17.678
47 HA ARG 8 HA ARG 8 12.285 22.617 15.388
48 HB2 ARG 8 HB2 ARG 8 9.807 21.870 16.410
49 HB3 ARG 8 HB3 ARG 8 9.711 23.622 16.546
50 HG2 ARG 8 HG2 ARG 8 10.400 22.004 14.046
51 HG3 ARG 8 HG3 ARG 8 8.804 22.654 14.442
52 HD2 ARG 8 HD2 ARG 8 9.416 24.339 13.124
53 HD3 ARG 8 HD3 ARG 8 10.227 24.949 14.572
54 HE ARG 8 HE ARG 8 12.095 23.252 13.321
55 HH11 ARG 8 HH11 ARG 8 10.356 26.087 12.166
56 HH12 ARG 8 HH12 ARG 8 11.467 26.274 10.824
57 HH21 ARG 8 HH21 ARG 8 13.460 23.632 11.709
58 HH22 ARG 8 HH22 ARG 8 13.321 25.068 10.709
59 H ARG 9 H ARG 9 11.821 23.827 18.647
60 HA ARG 9 HA ARG 9 12.276 26.635 17.809
61 HB2 ARG 9 HB2 ARG 9 10.485 26.053 19.374
62 HB3 ARG 9 HB3 ARG 9 11.668 25.458 20.551
63 HG2 ARG 9 HG2 ARG 9 12.502 27.628 20.977
64 HG3 ARG 9 HG3 ARG 9 11.927 28.248 19.417
65 HD2 ARG 9 HD2 ARG 9 10.614 29.151 21.285
66 HD3 ARG 9 HD3 ARG 9 9.667 28.243 20.125
67 HE ARG 9 HE ARG 9 10.376 27.364 22.888
68 HH11 ARG 9 HH11 ARG 9 8.255 26.860 20.082
69 HH12 ARG 9 HH12 ARG 9 7.409 25.563 20.886
70 HH21 ARG 9 HH21 ARG 9 8.994 26.000 23.910
71 HH22 ARG 9 HH22 ARG 9 7.811 25.099 23.018
72 H CYS 10 H CYS 10 14.016 24.041 19.516
73 HA CYS 10 HA CYS 10 16.427 25.602 19.926
74 HB2 CYS 10 HB2 CYS 10 16.133 23.529 21.064
75 HB3 CYS 10 HB3 CYS 10 15.915 22.660 19.545
76 H GLU 11 H GLU 11 15.170 23.760 17.029
77 HA GLU 11 HA GLU 11 17.383 23.919 15.397
78 HB2 GLU 11 HB2 GLU 11 14.499 24.285 14.637
79 HB3 GLU 11 HB3 GLU 11 15.842 24.342 13.484
80 HG2 GLU 11 HG2 GLU 11 16.448 22.064 14.007
81 HG3 GLU 11 HG3 GLU 11 15.046 21.933 15.086
82 H LEU 12 H LEU 12 14.894 26.410 15.874
83 HA LEU 12 HA LEU 12 16.210 28.428 14.256
84 HB2 LEU 12 HB2 LEU 12 13.793 28.254 16.050
85 HB3 LEU 12 HB3 LEU 12 14.193 29.744 15.163
86 HG LEU 12 HG LEU 12 13.634 27.019 13.879
87 HD11 LEU 12 HD11 LEU 12 11.942 29.544 14.099
88 HD12 LEU 12 HD12 LEU 12 11.523 28.101 13.156
89 HD13 LEU 12 HD13 LEU 12 11.642 27.993 14.918
90 HD21 LEU 12 HD21 LEU 12 15.095 28.386 12.423
91 HD22 LEU 12 HD22 LEU 12 13.462 28.317 11.766
92 HD23 LEU 12 HD23 LEU 12 14.014 29.775 12.623
93 H SER 13 H SER 13 16.686 27.595 17.560
94 HA SER 13 HA SER 13 17.932 30.203 18.225
95 HB2 SER 13 HB2 SER 13 17.678 27.524 19.549
96 HB3 SER 13 HB3 SER 13 19.166 28.423 19.859
97 HG SER 13 HG SER 13 16.493 29.266 20.353
98 H CYS 14 H CYS 14 18.742 27.301 16.478
99 HA CYS 14 HA CYS 14 21.657 27.809 16.618
100 HB2 CYS 14 HB2 CYS 14 19.839 25.510 15.972
101 HB3 CYS 14 HB3 CYS 14 21.573 25.424 15.752
102 H ARG 15 H ARG 15 19.077 27.800 14.226
103 HA ARG 15 HA ARG 15 20.766 27.212 11.962
104 HB2 ARG 15 HB2 ARG 15 18.060 28.169 12.578
105 HB3 ARG 15 HB3 ARG 15 18.530 28.176 10.857
106 HG2 ARG 15 HG2 ARG 15 19.152 25.813 10.950
107 HG3 ARG 15 HG3 ARG 15 18.708 25.685 12.639
108 HD2 ARG 15 HD2 ARG 15 16.349 26.204 12.089
109 HD3 ARG 15 HD3 ARG 15 16.759 26.513 10.407
110 HE ARG 15 HE ARG 15 16.205 23.957 11.574
111 HH11 ARG 15 HH11 ARG 15 18.046 25.342 8.915
112 HH12 ARG 15 HH12 ARG 15 18.484 23.741 8.337
113 HH21 ARG 15 HH21 ARG 15 16.399 22.145 10.558
114 HH22 ARG 15 HH22 ARG 15 17.347 21.991 9.079
115 H SER 16 H SER 16 19.589 30.200 13.373
116 HA SER 16 HA SER 16 20.441 32.287 11.799
117 HB2 SER 16 HB2 SER 16 20.874 31.822 14.785
118 HB3 SER 16 HB3 SER 16 20.810 33.417 13.984
119 HG SER 16 HG SER 16 18.827 32.870 14.922
120 H LEU 17 H LEU 17 22.433 29.793 12.836
121 HA LEU 17 HA LEU 17 24.973 31.305 12.975
122 HB2 LEU 17 HB2 LEU 17 24.459 28.499 13.929
123 HB3 LEU 17 HB3 LEU 17 25.648 29.649 14.498
124 HG LEU 17 HG LEU 17 22.619 29.776 15.075
125 HD11 LEU 17 HD11 LEU 17 23.338 29.238 17.370
126 HD12 LEU 17 HD12 LEU 17 23.861 27.960 16.259
127 HD13 LEU 17 HD13 LEU 17 25.031 29.155 16.848
128 HD21 LEU 17 HD21 LEU 17 24.909 31.484 16.140
129 HD22 LEU 17 HD22 LEU 17 23.655 32.052 15.026
130 HD23 LEU 17 HD23 LEU 17 23.214 31.548 16.659
131 H GLY 18 H GLY 18 23.241 29.271 10.826
132 HA2 GLY 18 HA2 GLY 18 23.942 28.254 8.832
133 HA3 GLY 18 HA3 GLY 18 25.635 28.524 9.246
134 H LEU 19 H LEU 19 23.537 27.065 11.585
135 HA LEU 19 HA LEU 19 24.724 24.343 11.235
136 HB2 LEU 19 HB2 LEU 19 23.821 25.686 13.818
137 HB3 LEU 19 HB3 LEU 19 24.684 24.175 13.669
138 HG LEU 19 HG LEU 19 25.837 26.938 13.088
139 HD11 LEU 19 HD11 LEU 19 26.374 24.957 15.341
140 HD12 LEU 19 HD12 LEU 19 27.182 26.515 15.089
141 HD13 LEU 19 HD13 LEU 19 25.460 26.478 15.485
142 HD21 LEU 19 HD21 LEU 19 26.905 25.188 11.674
143 HD22 LEU 19 HD22 LEU 19 28.004 25.770 12.927
144 HD23 LEU 19 HD23 LEU 19 27.194 24.203 13.125
145 H LEU 20 H LEU 20 23.304 22.761 12.561
146 HA LEU 20 HA LEU 20 20.374 23.299 12.242
147 HB2 LEU 20 HB2 LEU 20 20.863 21.240 11.204
148 HB3 LEU 20 HB3 LEU 20 22.012 20.768 12.450
149 HG LEU 20 HG LEU 20 20.074 20.564 14.065
150 HD11 LEU 20 HD11 LEU 20 17.825 20.414 13.165
151 HD12 LEU 20 HD12 LEU 20 18.453 21.991 12.660
152 HD13 LEU 20 HD13 LEU 20 18.409 20.654 11.507
153 HD21 LEU 20 HD21 LEU 20 19.358 18.446 13.439
154 HD22 LEU 20 HD22 LEU 20 19.710 18.722 11.736
155 HD23 LEU 20 HD23 LEU 20 21.040 18.582 12.913
156 H GLY 21 H GLY 21 19.126 22.702 14.172
157 HA2 GLY 21 HA2 GLY 21 20.592 22.806 16.768
158 HA3 GLY 21 HA3 GLY 21 19.065 23.640 16.603
159 H LYS 22 H LYS 22 20.119 21.215 18.133
160 HA LYS 22 HA LYS 22 17.874 19.332 17.558
161 HB2 LYS 22 HB2 LYS 22 19.999 18.728 16.407
162 HB3 LYS 22 HB3 LYS 22 20.800 18.571 17.966
163 HG2 LYS 22 HG2 LYS 22 19.525 16.622 18.522
164 HG3 LYS 22 HG3 LYS 22 18.297 16.978 17.312
165 HD2 LYS 22 HD2 LYS 22 19.627 15.130 16.524
166 HD3 LYS 22 HD3 LYS 22 19.894 16.538 15.492
167 HE2 LYS 22 HE2 LYS 22 22.007 17.023 16.772
168 HE3 LYS 22 HE3 LYS 22 21.741 15.537 17.699
169 HZ1 LYS 22 HZ1 LYS 22 21.876 14.300 15.587
170 HZ2 LYS 22 HZ2 LYS 22 22.172 15.696 14.758
171 HZ3 LYS 22 HZ3 LYS 22 23.241 15.165 15.876
172 H CYS 23 H CYS 23 16.704 19.906 19.343
173 HA CYS 23 HA CYS 23 17.921 19.452 22.053
174 HB2 CYS 23 HB2 CYS 23 17.043 21.695 21.833
175 HB3 CYS 23 HB3 CYS 23 15.489 21.080 21.307
176 H ILE 24 H ILE 24 17.789 17.257 21.616
177 HA ILE 24 HA ILE 24 15.166 15.937 21.903
178 HB ILE 24 HB ILE 24 17.890 14.644 22.230
179 HG12 ILE 24 HG12 ILE 24 16.430 14.909 19.559
180 HG13 ILE 24 HG13 ILE 24 17.836 15.885 20.002
181 HG21 ILE 24 HG21 ILE 24 15.890 13.348 22.922
182 HG22 ILE 24 HG22 ILE 24 15.147 13.620 21.332
183 HG23 ILE 24 HG23 ILE 24 16.602 12.627 21.488
184 HD11 ILE 24 HD11 ILE 24 17.864 12.888 19.707
185 HD12 ILE 24 HD12 ILE 24 18.575 14.115 18.637
186 HD13 ILE 24 HD13 ILE 24 19.217 13.897 20.275
187 H GLY 25 H GLY 25 14.393 15.168 23.810
188 HA2 GLY 25 HA2 GLY 25 14.054 15.076 26.108
189 HA3 GLY 25 HA3 GLY 25 15.769 15.431 26.378
190 H GLU 26 H GLU 26 16.189 17.354 27.193
191 HA GLU 26 HA GLU 26 14.618 19.711 26.356
192 HB2 GLU 26 HB2 GLU 26 14.292 20.602 28.504
193 HB3 GLU 26 HB3 GLU 26 13.647 18.974 28.486
194 HG2 GLU 26 HG2 GLU 26 16.292 19.826 29.732
195 HG3 GLU 26 HG3 GLU 26 14.794 19.553 30.600
196 H GLU 27 H GLU 27 17.394 18.527 25.900
197 HA GLU 27 HA GLU 27 19.072 20.810 26.857
198 HB2 GLU 27 HB2 GLU 27 20.880 19.169 26.989
199 HB3 GLU 27 HB3 GLU 27 19.557 18.897 28.106
200 HG2 GLU 27 HG2 GLU 27 18.672 17.070 26.684
201 HG3 GLU 27 HG3 GLU 27 20.007 17.289 25.554
202 H CYS 28 H CYS 28 18.895 22.146 25.092
203 HA CYS 28 HA CYS 28 19.120 21.327 22.400
204 HB2 CYS 28 HB2 CYS 28 17.992 23.347 23.226
205 HB3 CYS 28 HB3 CYS 28 19.529 24.026 23.698
206 H LYS 29 H LYS 29 20.680 20.822 21.115
207 HA LYS 29 HA LYS 29 23.488 21.817 21.455
208 HB2 LYS 29 HB2 LYS 29 23.381 19.387 21.531
209 HB3 LYS 29 HB3 LYS 29 22.296 19.333 20.142
210 HG2 LYS 29 HG2 LYS 29 24.071 20.155 18.664
211 HG3 LYS 29 HG3 LYS 29 25.195 20.246 20.021
212 HD2 LYS 29 HD2 LYS 29 23.831 17.693 19.057
213 HD3 LYS 29 HD3 LYS 29 25.402 18.227 18.473
214 HE2 LYS 29 HE2 LYS 29 24.783 17.646 21.397
215 HE3 LYS 29 HE3 LYS 29 25.475 16.475 20.264
216 HZ1 LYS 29 HZ1 LYS 29 27.369 17.926 19.958
217 HZ2 LYS 29 HZ2 LYS 29 26.769 19.049 21.001
218 HZ3 LYS 29 HZ3 LYS 29 27.184 17.571 21.560
219 H CYS 30 H CYS 30 24.441 22.804 19.590
220 HA CYS 30 HA CYS 30 22.744 22.850 17.149
221 HB2 CYS 30 HB2 CYS 30 24.862 24.939 17.402
222 HB3 CYS 30 HB3 CYS 30 23.457 24.858 16.318
223 H VAL 31 H VAL 31 23.762 22.285 15.285
224 HA VAL 31 HA VAL 31 26.325 20.821 15.680
225 HB VAL 31 HB VAL 31 24.376 19.488 16.345
226 HG11 VAL 31 HG11 VAL 31 23.581 19.407 13.423
227 HG12 VAL 31 HG12 VAL 31 22.851 18.520 14.767
228 HG13 VAL 31 HG13 VAL 31 22.690 20.281 14.703
229 HG21 VAL 31 HG21 VAL 31 26.449 18.468 15.636
230 HG22 VAL 31 HG22 VAL 31 25.063 17.485 15.138
231 HG23 VAL 31 HG23 VAL 31 25.911 18.466 13.935
232 HA PRO 32 HA PRO 32 27.006 22.347 11.526
233 HB2 PRO 32 HB2 PRO 32 29.173 20.255 11.413
234 HB3 PRO 32 HB3 PRO 32 29.243 21.999 11.017
235 HG2 PRO 32 HG2 PRO 32 30.262 21.066 13.347
236 HG3 PRO 32 HG3 PRO 32 29.296 22.582 13.336
237 HD2 PRO 32 HD2 PRO 32 28.363 19.775 14.031
238 HD3 PRO 32 HD3 PRO 32 28.144 21.304 14.934
239 H TYR 33 H TYR 33 24.965 21.561 10.803
240 HA TYR 33 HA TYR 33 24.328 19.072 9.823
241 HB2 TYR 33 HB2 TYR 33 22.932 21.225 10.109
242 HB3 TYR 33 HB3 TYR 33 23.397 21.610 8.463
243 HD1 TYR 33 HD2 TYR 33 21.752 19.101 10.639
244 HD2 TYR 33 HD1 TYR 33 22.304 20.487 6.609
245 HE1 TYR 33 HE2 TYR 33 19.908 17.572 9.857
246 HE2 TYR 33 HE1 TYR 33 20.469 18.972 5.827
247 HH TYR 33 HH TYR 33 18.568 16.982 8.137
Start of MODEL 2
1 H1 GLY 1 H1 GLY 1 6.507 16.567 35.881
2 H2 GLY 1 H2 GLY 1 5.649 17.936 35.583
3 H3 GLY 1 H3 GLY 1 6.845 17.949 36.718
4 HA2 GLY 1 HA2 GLY 1 8.542 17.646 35.084
5 HA3 GLY 1 HA3 GLY 1 7.280 17.484 33.848
6 H SER 2 H SER 2 9.411 19.646 35.323
7 HA SER 2 HA SER 2 7.855 22.030 34.386
8 HB2 SER 2 HB2 SER 2 9.667 22.049 36.796
9 HB3 SER 2 HB3 SER 2 8.547 23.287 36.264
10 HG SER 2 HG SER 2 7.721 22.120 38.000
11 H ALA 3 H ALA 3 10.333 20.380 33.277
12 HA ALA 3 HA ALA 3 11.902 22.809 32.508
13 HB1 ALA 3 HB1 ALA 3 12.995 20.030 33.107
14 HB2 ALA 3 HB2 ALA 3 13.921 21.385 32.445
15 HB3 ALA 3 HB3 ALA 3 13.233 21.495 34.073
16 H PHE 4 H PHE 4 12.332 23.089 30.375
17 HA PHE 4 HA PHE 4 11.090 21.206 28.434
18 HB2 PHE 4 HB2 PHE 4 10.141 24.072 28.720
19 HB3 PHE 4 HB3 PHE 4 9.502 22.836 27.657
20 HD1 PHE 4 HD1 PHE 4 8.206 20.865 28.674
21 HD2 PHE 4 HD2 PHE 4 9.367 24.343 30.930
22 HE1 PHE 4 HE1 PHE 4 6.466 20.347 30.380
23 HE2 PHE 4 HE2 PHE 4 7.590 23.862 32.598
24 HZ PHE 4 HZ PHE 4 6.141 21.870 32.317
25 H CYS 5 H CYS 5 11.737 21.362 26.446
26 HA CYS 5 HA CYS 5 12.472 23.765 25.090
27 HB2 CYS 5 HB2 CYS 5 14.671 23.461 25.952
28 HB3 CYS 5 HB3 CYS 5 14.621 21.724 25.731
29 H ASN 6 H ASN 6 12.258 23.405 22.760
30 HA ASN 6 HA ASN 6 11.486 20.609 21.994
31 HB2 ASN 6 HB2 ASN 6 9.444 21.949 22.095
32 HB3 ASN 6 HB3 ASN 6 10.181 23.186 21.059
33 HD21 ASN 6 HD22 ASN 6 9.331 19.669 21.081
34 HD22 ASN 6 HD21 ASN 6 9.097 19.608 19.342
35 H LEU 7 H LEU 7 12.283 19.788 20.136
36 HA LEU 7 HA LEU 7 14.710 20.784 19.154
37 HB2 LEU 7 HB2 LEU 7 13.884 18.453 18.969
38 HB3 LEU 7 HB3 LEU 7 12.835 18.930 17.649
39 HG LEU 7 HG LEU 7 15.772 19.688 17.456
40 HD11 LEU 7 HD11 LEU 7 15.846 17.357 18.272
41 HD12 LEU 7 HD12 LEU 7 14.633 16.875 17.076
42 HD13 LEU 7 HD13 LEU 7 16.237 17.377 16.543
43 HD21 LEU 7 HD21 LEU 7 13.794 18.567 15.410
44 HD22 LEU 7 HD22 LEU 7 14.245 20.275 15.576
45 HD23 LEU 7 HD23 LEU 7 15.456 19.107 15.089
46 H ARG 8 H ARG 8 11.480 21.214 17.626
47 HA ARG 8 HA ARG 8 12.501 22.238 15.194
48 HB2 ARG 8 HB2 ARG 8 9.863 22.909 16.560
49 HB3 ARG 8 HB3 ARG 8 10.204 23.132 14.858
50 HG2 ARG 8 HG2 ARG 8 10.235 20.781 14.409
51 HG3 ARG 8 HG3 ARG 8 10.366 20.365 16.129
52 HD2 ARG 8 HD2 ARG 8 8.096 19.949 15.329
53 HD3 ARG 8 HD3 ARG 8 8.147 21.182 16.597
54 HE ARG 8 HE ARG 8 8.068 21.943 13.705
55 HH11 ARG 8 HH11 ARG 8 6.250 21.891 16.738
56 HH12 ARG 8 HH12 ARG 8 5.145 23.120 16.123
57 HH21 ARG 8 HH21 ARG 8 6.949 23.898 13.403
58 HH22 ARG 8 HH22 ARG 8 5.537 24.189 14.364
59 H ARG 9 H ARG 9 11.661 23.969 18.149
60 HA ARG 9 HA ARG 9 12.287 26.579 16.987
61 HB2 ARG 9 HB2 ARG 9 10.468 26.164 18.693
62 HB3 ARG 9 HB3 ARG 9 11.740 25.952 19.916
63 HG2 ARG 9 HG2 ARG 9 12.568 28.219 19.489
64 HG3 ARG 9 HG3 ARG 9 11.489 28.392 18.090
65 HD2 ARG 9 HD2 ARG 9 9.535 28.189 19.640
66 HD3 ARG 9 HD3 ARG 9 10.656 28.163 21.019
67 HE ARG 9 HE ARG 9 11.371 30.425 19.513
68 HH11 ARG 9 HH11 ARG 9 8.500 29.567 21.365
69 HH12 ARG 9 HH12 ARG 9 7.934 31.228 21.310
70 HH21 ARG 9 HH21 ARG 9 10.635 32.397 19.587
71 HH22 ARG 9 HH22 ARG 9 9.056 32.757 20.313
72 H CYS 10 H CYS 10 14.094 24.215 18.997
73 HA CYS 10 HA CYS 10 16.325 26.070 19.371
74 HB2 CYS 10 HB2 CYS 10 16.081 23.926 20.678
75 HB3 CYS 10 HB3 CYS 10 16.453 23.044 19.176
76 H GLU 11 H GLU 11 15.302 23.744 16.857
77 HA GLU 11 HA GLU 11 17.501 23.663 15.291
78 HB2 GLU 11 HB2 GLU 11 15.064 22.550 15.023
79 HB3 GLU 11 HB3 GLU 11 14.976 23.773 13.754
80 HG2 GLU 11 HG2 GLU 11 17.360 22.866 13.126
81 HG3 GLU 11 HG3 GLU 11 16.914 21.466 14.076
82 H LEU 12 H LEU 12 14.786 25.879 14.868
83 HA LEU 12 HA LEU 12 15.929 27.534 12.831
84 HB2 LEU 12 HB2 LEU 12 13.626 27.695 14.781
85 HB3 LEU 12 HB3 LEU 12 13.919 29.008 13.622
86 HG LEU 12 HG LEU 12 13.606 26.098 12.750
87 HD11 LEU 12 HD11 LEU 12 11.479 28.263 12.938
88 HD12 LEU 12 HD12 LEU 12 11.281 26.670 12.173
89 HD13 LEU 12 HD13 LEU 12 11.564 26.785 13.918
90 HD21 LEU 12 HD21 LEU 12 13.040 27.109 10.576
91 HD22 LEU 12 HD22 LEU 12 13.281 28.735 11.246
92 HD23 LEU 12 HD23 LEU 12 14.653 27.626 11.073
93 H SER 13 H SER 13 15.770 27.975 16.389
94 HA SER 13 HA SER 13 16.937 30.579 16.426
95 HB2 SER 13 HB2 SER 13 17.163 28.352 18.495
96 HB3 SER 13 HB3 SER 13 17.538 30.069 18.756
97 HG SER 13 HG SER 13 15.055 28.821 18.299
98 H CYS 14 H CYS 14 18.405 27.356 16.221
99 HA CYS 14 HA CYS 14 21.126 28.419 16.243
100 HB2 CYS 14 HB2 CYS 14 19.861 25.692 16.183
101 HB3 CYS 14 HB3 CYS 14 21.523 25.898 15.677
102 H ARG 15 H ARG 15 18.827 27.719 13.683
103 HA ARG 15 HA ARG 15 20.874 27.382 11.689
104 HB2 ARG 15 HB2 ARG 15 18.025 28.153 11.853
105 HB3 ARG 15 HB3 ARG 15 18.779 28.238 10.243
106 HG2 ARG 15 HG2 ARG 15 19.411 25.905 10.262
107 HG3 ARG 15 HG3 ARG 15 18.881 25.682 11.927
108 HD2 ARG 15 HD2 ARG 15 16.553 26.140 11.287
109 HD3 ARG 15 HD3 ARG 15 17.028 26.551 9.643
110 HE ARG 15 HE ARG 15 16.682 23.881 10.810
111 HH11 ARG 15 HH11 ARG 15 18.088 25.545 8.013
112 HH12 ARG 15 HH12 ARG 15 17.898 24.112 7.031
113 HH21 ARG 15 HH21 ARG 15 16.427 22.267 9.548
114 HH22 ARG 15 HH22 ARG 15 16.888 22.346 7.834
115 H SER 16 H SER 16 19.384 30.237 13.081
116 HA SER 16 HA SER 16 20.365 32.376 11.599
117 HB2 SER 16 HB2 SER 16 20.382 32.021 14.625
118 HB3 SER 16 HB3 SER 16 20.318 33.566 13.753
119 HG SER 16 HG SER 16 18.259 32.562 14.593
120 H LEU 17 H LEU 17 22.280 29.934 12.825
121 HA LEU 17 HA LEU 17 24.778 31.523 13.195
122 HB2 LEU 17 HB2 LEU 17 24.284 28.758 14.253
123 HB3 LEU 17 HB3 LEU 17 25.348 29.989 14.867
124 HG LEU 17 HG LEU 17 22.273 30.017 15.155
125 HD11 LEU 17 HD11 LEU 17 22.781 29.489 17.508
126 HD12 LEU 17 HD12 LEU 17 23.423 28.221 16.453
127 HD13 LEU 17 HD13 LEU 17 24.519 29.429 17.149
128 HD21 LEU 17 HD21 LEU 17 24.425 31.767 16.430
129 HD22 LEU 17 HD22 LEU 17 23.279 32.303 15.193
130 HD23 LEU 17 HD23 LEU 17 22.678 31.806 16.775
131 H GLY 18 H GLY 18 23.257 29.483 10.974
132 HA2 GLY 18 HA2 GLY 18 24.027 28.139 9.250
133 HA3 GLY 18 HA3 GLY 18 25.694 28.337 9.795
134 H LEU 19 H LEU 19 23.369 27.293 12.214
135 HA LEU 19 HA LEU 19 24.527 24.536 12.161
136 HB2 LEU 19 HB2 LEU 19 23.794 26.201 14.594
137 HB3 LEU 19 HB3 LEU 19 24.542 24.607 14.589
138 HG LEU 19 HG LEU 19 25.840 27.166 13.567
139 HD11 LEU 19 HD11 LEU 19 25.567 27.092 16.018
140 HD12 LEU 19 HD12 LEU 19 26.362 25.503 16.065
141 HD13 LEU 19 HD13 LEU 19 27.264 26.944 15.547
142 HD21 LEU 19 HD21 LEU 19 26.960 24.342 13.928
143 HD22 LEU 19 HD22 LEU 19 26.723 25.177 12.372
144 HD23 LEU 19 HD23 LEU 19 27.914 25.785 13.516
145 H LEU 20 H LEU 20 23.242 22.972 13.488
146 HA LEU 20 HA LEU 20 20.300 23.341 13.012
147 HB2 LEU 20 HB2 LEU 20 21.516 21.913 11.441
148 HB3 LEU 20 HB3 LEU 20 22.080 20.899 12.765
149 HG LEU 20 HG LEU 20 19.471 20.638 13.253
150 HD11 LEU 20 HD11 LEU 20 18.129 20.793 11.206
151 HD12 LEU 20 HD12 LEU 20 18.841 22.389 11.522
152 HD13 LEU 20 HD13 LEU 20 19.526 21.350 10.273
153 HD21 LEU 20 HD21 LEU 20 20.956 18.808 12.503
154 HD22 LEU 20 HD22 LEU 20 19.383 18.752 11.671
155 HD23 LEU 20 HD23 LEU 20 20.811 19.364 10.825
156 H GLY 21 H GLY 21 19.524 23.767 14.929
157 HA2 GLY 21 HA2 GLY 21 20.310 22.593 17.436
158 HA3 GLY 21 HA3 GLY 21 18.843 23.510 17.162
159 H LYS 22 H LYS 22 20.198 20.522 17.788
160 HA LYS 22 HA LYS 22 17.806 18.870 17.174
161 HB2 LYS 22 HB2 LYS 22 20.704 18.189 17.786
162 HB3 LYS 22 HB3 LYS 22 19.436 16.970 17.732
163 HG2 LYS 22 HG2 LYS 22 20.167 18.720 15.349
164 HG3 LYS 22 HG3 LYS 22 20.835 17.128 15.692
165 HD2 LYS 22 HD2 LYS 22 18.391 16.272 15.732
166 HD3 LYS 22 HD3 LYS 22 17.975 17.821 14.951
167 HE2 LYS 22 HE2 LYS 22 19.591 17.304 13.131
168 HE3 LYS 22 HE3 LYS 22 20.028 15.798 13.932
169 HZ1 LYS 22 HZ1 LYS 22 17.334 16.430 12.861
170 HZ2 LYS 22 HZ2 LYS 22 18.423 15.422 12.172
171 HZ3 LYS 22 HZ3 LYS 22 17.774 15.016 13.622
172 H CYS 23 H CYS 23 16.893 20.300 19.103
173 HA CYS 23 HA CYS 23 17.808 19.473 21.755
174 HB2 CYS 23 HB2 CYS 23 17.004 21.706 21.496
175 HB3 CYS 23 HB3 CYS 23 15.471 21.158 20.922
176 H ILE 24 H ILE 24 17.703 17.327 21.791
177 HA ILE 24 HA ILE 24 15.094 15.948 21.949
178 HB ILE 24 HB ILE 24 17.903 14.859 22.351
179 HG12 ILE 24 HG12 ILE 24 16.136 14.991 19.855
180 HG13 ILE 24 HG13 ILE 24 17.719 15.738 20.084
181 HG21 ILE 24 HG21 ILE 24 15.253 13.412 21.821
182 HG22 ILE 24 HG22 ILE 24 16.848 12.652 22.040
183 HG23 ILE 24 HG23 ILE 24 16.099 13.477 23.388
184 HD11 ILE 24 HD11 ILE 24 17.988 13.867 18.649
185 HD12 ILE 24 HD12 ILE 24 18.758 13.474 20.195
186 HD13 ILE 24 HD13 ILE 24 17.173 12.772 19.773
187 H GLY 25 H GLY 25 14.016 15.481 23.786
188 HA2 GLY 25 HA2 GLY 25 13.545 15.287 26.046
189 HA3 GLY 25 HA3 GLY 25 15.257 15.465 26.428
190 H GLU 26 H GLU 26 15.945 17.365 27.211
191 HA GLU 26 HA GLU 26 14.248 19.819 26.971
192 HB2 GLU 26 HB2 GLU 26 14.535 20.277 29.365
193 HB3 GLU 26 HB3 GLU 26 13.583 18.830 29.059
194 HG2 GLU 26 HG2 GLU 26 16.574 18.613 29.635
195 HG3 GLU 26 HG3 GLU 26 15.417 18.836 30.936
196 H GLU 27 H GLU 27 17.277 18.736 26.249
197 HA GLU 27 HA GLU 27 18.319 21.473 26.445
198 HB2 GLU 27 HB2 GLU 27 20.531 20.790 27.206
199 HB3 GLU 27 HB3 GLU 27 19.275 20.556 28.426
200 HG2 GLU 27 HG2 GLU 27 19.280 18.123 27.973
201 HG3 GLU 27 HG3 GLU 27 20.496 18.346 26.712
202 H CYS 28 H CYS 28 19.901 22.037 24.928
203 HA CYS 28 HA CYS 28 19.495 20.416 22.471
204 HB2 CYS 28 HB2 CYS 28 18.459 22.726 22.775
205 HB3 CYS 28 HB3 CYS 28 20.089 23.369 22.610
206 H LYS 29 H LYS 29 20.953 20.110 20.942
207 HA LYS 29 HA LYS 29 23.769 21.082 21.196
208 HB2 LYS 29 HB2 LYS 29 23.551 18.547 21.275
209 HB3 LYS 29 HB3 LYS 29 22.706 18.610 19.718
210 HG2 LYS 29 HG2 LYS 29 24.724 19.630 18.677
211 HG3 LYS 29 HG3 LYS 29 25.552 19.603 20.231
212 HD2 LYS 29 HD2 LYS 29 26.236 17.804 18.686
213 HD3 LYS 29 HD3 LYS 29 25.638 17.206 20.245
214 HE2 LYS 29 HE2 LYS 29 23.524 16.543 19.277
215 HE3 LYS 29 HE3 LYS 29 23.909 17.320 17.739
216 HZ1 LYS 29 HZ1 LYS 29 25.335 15.007 18.910
217 HZ2 LYS 29 HZ2 LYS 29 24.331 14.950 17.612
218 HZ3 LYS 29 HZ3 LYS 29 25.759 15.737 17.497
219 H CYS 30 H CYS 30 24.485 22.208 19.225
220 HA CYS 30 HA CYS 30 22.542 22.152 16.996
221 HB2 CYS 30 HB2 CYS 30 23.885 24.754 17.630
222 HB3 CYS 30 HB3 CYS 30 22.706 24.390 16.331
223 H VAL 31 H VAL 31 23.250 21.453 15.335
224 HA VAL 31 HA VAL 31 26.039 20.652 15.362
225 HB VAL 31 HB VAL 31 23.681 19.586 13.750
226 HG11 VAL 31 HG11 VAL 31 25.058 17.506 13.811
227 HG12 VAL 31 HG12 VAL 31 25.916 18.820 13.004
228 HG13 VAL 31 HG13 VAL 31 26.321 18.394 14.688
229 HG21 VAL 31 HG21 VAL 31 24.693 18.773 16.509
230 HG22 VAL 31 HG22 VAL 31 23.078 19.443 16.152
231 HG23 VAL 31 HG23 VAL 31 23.521 17.850 15.541
232 HA PRO 32 HA PRO 32 26.945 22.871 11.460
233 HB2 PRO 32 HB2 PRO 32 29.289 20.980 11.397
234 HB3 PRO 32 HB3 PRO 32 29.242 22.746 11.177
235 HG2 PRO 32 HG2 PRO 32 30.134 21.649 13.499
236 HG3 PRO 32 HG3 PRO 32 29.119 23.120 13.524
237 HD2 PRO 32 HD2 PRO 32 28.274 20.235 13.949
238 HD3 PRO 32 HD3 PRO 32 27.871 21.694 14.916
239 H TYR 33 H TYR 33 25.090 22.002 10.511
240 HA TYR 33 HA TYR 33 24.798 19.245 9.957
241 HB2 TYR 33 HB2 TYR 33 22.644 19.729 9.170
242 HB3 TYR 33 HB3 TYR 33 23.020 20.621 10.619
243 HD1 TYR 33 HD2 TYR 33 23.147 23.123 10.566
244 HD2 TYR 33 HD1 TYR 33 22.135 20.799 7.078
245 HE1 TYR 33 HE2 TYR 33 22.179 25.151 9.481
246 HE2 TYR 33 HE1 TYR 33 21.137 22.809 6.020
247 HH TYR 33 HH TYR 33 20.549 24.982 6.289
Start of MODEL 3
1 H1 GLY 1 H1 GLY 1 21.974 25.694 27.898
2 H2 GLY 1 H2 GLY 1 21.790 25.367 26.299
3 H3 GLY 1 H3 GLY 1 23.300 25.515 26.921
4 HA2 GLY 1 HA2 GLY 1 22.791 23.219 26.519
5 HA3 GLY 1 HA3 GLY 1 23.006 23.531 28.253
6 H SER 2 H SER 2 21.156 23.443 29.652
7 HA SER 2 HA SER 2 19.025 21.764 28.594
8 HB2 SER 2 HB2 SER 2 18.255 21.653 30.954
9 HB3 SER 2 HB3 SER 2 19.943 21.118 30.660
10 HG SER 2 HG SER 2 20.051 22.354 32.402
11 H ALA 3 H ALA 3 16.824 22.115 28.559
12 HA ALA 3 HA ALA 3 15.772 24.810 29.104
13 HB1 ALA 3 HB1 ALA 3 14.991 25.089 26.758
14 HB2 ALA 3 HB2 ALA 3 16.764 24.960 26.827
15 HB3 ALA 3 HB3 ALA 3 15.803 23.565 26.318
16 H PHE 4 H PHE 4 13.508 25.015 28.822
17 HA PHE 4 HA PHE 4 11.809 22.607 29.184
18 HB2 PHE 4 HB2 PHE 4 11.590 24.652 30.585
19 HB3 PHE 4 HB3 PHE 4 11.221 25.575 29.157
20 HD1 PHE 4 HD1 PHE 4 10.020 22.876 31.397
21 HD2 PHE 4 HD2 PHE 4 8.991 25.628 28.240
22 HE1 PHE 4 HE1 PHE 4 7.605 22.431 31.814
23 HE2 PHE 4 HE2 PHE 4 6.580 25.186 28.629
24 HZ PHE 4 HZ PHE 4 5.890 23.599 30.434
25 H CYS 5 H CYS 5 12.148 21.624 27.068
26 HA CYS 5 HA CYS 5 12.639 23.627 25.010
27 HB2 CYS 5 HB2 CYS 5 14.172 21.736 25.992
28 HB3 CYS 5 HB3 CYS 5 13.345 20.716 24.817
29 H ASN 6 H ASN 6 12.152 23.503 22.818
30 HA ASN 6 HA ASN 6 10.468 21.230 21.891
31 HB2 ASN 6 HB2 ASN 6 9.019 23.252 22.020
32 HB3 ASN 6 HB3 ASN 6 10.163 24.127 20.983
33 HD21 ASN 6 HD22 ASN 6 7.771 24.209 19.865
34 HD22 ASN 6 HD21 ASN 6 7.504 22.858 18.748
35 H LEU 7 H LEU 7 11.728 20.038 20.503
36 HA LEU 7 HA LEU 7 14.217 21.009 19.489
37 HB2 LEU 7 HB2 LEU 7 13.787 18.641 19.737
38 HB3 LEU 7 HB3 LEU 7 12.551 18.667 18.497
39 HG LEU 7 HG LEU 7 15.340 19.643 17.785
40 HD11 LEU 7 HD11 LEU 7 14.441 16.721 17.793
41 HD12 LEU 7 HD12 LEU 7 16.024 17.334 17.296
42 HD13 LEU 7 HD13 LEU 7 15.523 17.382 18.998
43 HD21 LEU 7 HD21 LEU 7 13.223 18.091 16.208
44 HD22 LEU 7 HD22 LEU 7 13.629 19.799 15.984
45 HD23 LEU 7 HD23 LEU 7 14.821 18.576 15.604
46 H ARG 8 H ARG 8 10.971 21.061 17.958
47 HA ARG 8 HA ARG 8 11.706 21.984 15.393
48 HB2 ARG 8 HB2 ARG 8 9.438 21.248 16.298
49 HB3 ARG 8 HB3 ARG 8 9.276 22.858 17.009
50 HG2 ARG 8 HG2 ARG 8 9.433 23.862 14.729
51 HG3 ARG 8 HG3 ARG 8 9.592 22.231 14.048
52 HD2 ARG 8 HD2 ARG 8 7.359 21.653 15.004
53 HD3 ARG 8 HD3 ARG 8 7.223 23.285 15.657
54 HE ARG 8 HE ARG 8 7.028 24.188 13.475
55 HH11 ARG 8 HH11 ARG 8 7.102 20.667 13.251
56 HH12 ARG 8 HH12 ARG 8 6.847 20.709 11.527
57 HH21 ARG 8 HH21 ARG 8 6.352 24.106 11.390
58 HH22 ARG 8 HH22 ARG 8 6.544 22.639 10.481
59 H ARG 9 H ARG 9 11.894 23.734 18.369
60 HA ARG 9 HA ARG 9 12.230 26.377 17.011
61 HB2 ARG 9 HB2 ARG 9 10.507 25.882 18.876
62 HB3 ARG 9 HB3 ARG 9 11.890 25.867 19.982
63 HG2 ARG 9 HG2 ARG 9 12.416 28.206 19.355
64 HG3 ARG 9 HG3 ARG 9 11.177 28.164 18.093
65 HD2 ARG 9 HD2 ARG 9 10.203 29.279 19.968
66 HD3 ARG 9 HD3 ARG 9 9.441 27.711 19.834
67 HE ARG 9 HE ARG 9 11.621 28.395 21.800
68 HH11 ARG 9 HH11 ARG 9 8.647 26.465 21.248
69 HH12 ARG 9 HH12 ARG 9 8.739 25.907 22.912
70 HH21 ARG 9 HH21 ARG 9 11.360 27.772 23.859
71 HH22 ARG 9 HH22 ARG 9 10.189 26.498 24.234
72 H CYS 10 H CYS 10 13.914 24.098 19.186
73 HA CYS 10 HA CYS 10 16.419 25.523 19.334
74 HB2 CYS 10 HB2 CYS 10 15.860 23.501 20.641
75 HB3 CYS 10 HB3 CYS 10 15.824 22.557 19.151
76 H GLU 11 H GLU 11 15.106 23.238 16.886
77 HA GLU 11 HA GLU 11 17.192 23.097 15.077
78 HB2 GLU 11 HB2 GLU 11 15.249 21.733 15.208
79 HB3 GLU 11 HB3 GLU 11 14.240 23.025 14.517
80 HG2 GLU 11 HG2 GLU 11 16.634 22.145 12.959
81 HG3 GLU 11 HG3 GLU 11 15.446 20.892 13.230
82 H LEU 12 H LEU 12 15.282 25.847 15.703
83 HA LEU 12 HA LEU 12 15.840 27.009 13.059
84 HB2 LEU 12 HB2 LEU 12 13.448 26.500 13.963
85 HB3 LEU 12 HB3 LEU 12 13.645 27.957 14.920
86 HG LEU 12 HG LEU 12 13.894 27.756 11.878
87 HD11 LEU 12 HD11 LEU 12 11.611 27.291 12.668
88 HD12 LEU 12 HD12 LEU 12 11.620 28.796 13.614
89 HD13 LEU 12 HD13 LEU 12 11.685 28.847 11.838
90 HD21 LEU 12 HD21 LEU 12 15.111 29.718 12.580
91 HD22 LEU 12 HD22 LEU 12 13.564 30.253 11.952
92 HD23 LEU 12 HD23 LEU 12 13.815 30.191 13.710
93 H SER 13 H SER 13 15.634 27.873 16.570
94 HA SER 13 HA SER 13 17.010 30.363 16.387
95 HB2 SER 13 HB2 SER 13 17.284 30.146 18.806
96 HB3 SER 13 HB3 SER 13 15.651 29.727 18.299
97 HG SER 13 HG SER 13 16.022 27.645 18.624
98 H CYS 14 H CYS 14 18.317 27.123 16.292
99 HA CYS 14 HA CYS 14 21.144 27.868 16.575
100 HB2 CYS 14 HB2 CYS 14 19.584 25.482 15.587
101 HB3 CYS 14 HB3 CYS 14 21.320 25.564 15.535
102 H ARG 15 H ARG 15 18.944 28.220 13.879
103 HA ARG 15 HA ARG 15 21.033 27.798 11.855
104 HB2 ARG 15 HB2 ARG 15 18.237 28.750 11.974
105 HB3 ARG 15 HB3 ARG 15 19.079 28.716 10.397
106 HG2 ARG 15 HG2 ARG 15 19.581 26.327 10.681
107 HG3 ARG 15 HG3 ARG 15 18.727 26.282 12.221
108 HD2 ARG 15 HD2 ARG 15 16.616 26.931 11.010
109 HD3 ARG 15 HD3 ARG 15 17.498 26.979 9.488
110 HE ARG 15 HE ARG 15 16.590 24.625 10.976
111 HH11 ARG 15 HH11 ARG 15 18.992 25.559 8.518
112 HH12 ARG 15 HH12 ARG 15 19.251 23.856 8.131
113 HH21 ARG 15 HH21 ARG 15 16.818 22.675 10.162
114 HH22 ARG 15 HH22 ARG 15 18.144 22.322 9.013
115 H SER 16 H SER 16 19.810 30.529 13.546
116 HA SER 16 HA SER 16 20.747 32.829 12.316
117 HB2 SER 16 HB2 SER 16 21.166 31.899 15.198
118 HB3 SER 16 HB3 SER 16 21.006 33.580 14.647
119 HG SER 16 HG SER 16 19.082 32.639 15.586
120 H LEU 17 H LEU 17 22.522 30.134 13.453
121 HA LEU 17 HA LEU 17 25.177 31.369 13.708
122 HB2 LEU 17 HB2 LEU 17 24.402 28.531 14.346
123 HB3 LEU 17 HB3 LEU 17 25.583 29.557 15.140
124 HG LEU 17 HG LEU 17 22.520 29.785 15.439
125 HD11 LEU 17 HD11 LEU 17 24.708 28.858 17.348
126 HD12 LEU 17 HD12 LEU 17 22.971 28.965 17.701
127 HD13 LEU 17 HD13 LEU 17 23.564 27.797 16.501
128 HD21 LEU 17 HD21 LEU 17 23.618 31.998 15.710
129 HD22 LEU 17 HD22 LEU 17 23.067 31.354 17.263
130 HD23 LEU 17 HD23 LEU 17 24.783 31.273 16.824
131 H GLY 18 H GLY 18 23.486 29.926 11.214
132 HA2 GLY 18 HA2 GLY 18 24.066 28.799 9.307
133 HA3 GLY 18 HA3 GLY 18 25.775 28.888 9.754
134 H LEU 19 H LEU 19 23.548 27.440 12.066
135 HA LEU 19 HA LEU 19 24.647 24.725 11.485
136 HB2 LEU 19 HB2 LEU 19 23.773 25.902 14.148
137 HB3 LEU 19 HB3 LEU 19 24.467 24.313 13.891
138 HG LEU 19 HG LEU 19 25.861 26.972 13.567
139 HD11 LEU 19 HD11 LEU 19 26.233 24.732 15.579
140 HD12 LEU 19 HD12 LEU 19 27.244 26.185 15.446
141 HD13 LEU 19 HD13 LEU 19 25.543 26.354 15.874
142 HD21 LEU 19 HD21 LEU 19 26.805 25.368 11.921
143 HD22 LEU 19 HD22 LEU 19 27.944 25.599 13.253
144 HD23 LEU 19 HD23 LEU 19 26.948 24.134 13.193
145 H LEU 20 H LEU 20 23.334 22.994 12.459
146 HA LEU 20 HA LEU 20 20.395 23.247 12.012
147 HB2 LEU 20 HB2 LEU 20 21.437 21.246 11.111
148 HB3 LEU 20 HB3 LEU 20 22.276 20.928 12.633
149 HG LEU 20 HG LEU 20 20.098 20.397 13.715
150 HD11 LEU 20 HD11 LEU 20 18.982 20.557 10.874
151 HD12 LEU 20 HD12 LEU 20 18.099 20.111 12.350
152 HD13 LEU 20 HD13 LEU 20 18.655 21.776 12.113
153 HD21 LEU 20 HD21 LEU 20 21.445 18.609 12.790
154 HD22 LEU 20 HD22 LEU 20 19.722 18.278 12.525
155 HD23 LEU 20 HD23 LEU 20 20.729 18.855 11.183
156 H GLY 21 H GLY 21 19.067 22.471 13.882
157 HA2 GLY 21 HA2 GLY 21 20.443 22.513 16.519
158 HA3 GLY 21 HA3 GLY 21 18.918 23.354 16.378
159 H LYS 22 H LYS 22 19.718 21.037 18.015
160 HA LYS 22 HA LYS 22 17.395 19.318 17.496
161 HB2 LYS 22 HB2 LYS 22 20.260 18.328 17.766
162 HB3 LYS 22 HB3 LYS 22 18.846 17.331 18.144
163 HG2 LYS 22 HG2 LYS 22 18.020 17.805 15.756
164 HG3 LYS 22 HG3 LYS 22 19.653 18.450 15.450
165 HD2 LYS 22 HD2 LYS 22 20.608 16.269 16.285
166 HD3 LYS 22 HD3 LYS 22 18.952 15.658 16.444
167 HE2 LYS 22 HE2 LYS 22 18.604 16.129 14.003
168 HE3 LYS 22 HE3 LYS 22 20.318 16.566 13.901
169 HZ1 LYS 22 HZ1 LYS 22 20.042 14.297 13.270
170 HZ2 LYS 22 HZ2 LYS 22 20.847 14.296 14.686
171 HZ3 LYS 22 HZ3 LYS 22 19.227 13.901 14.647
172 H CYS 23 H CYS 23 16.419 18.811 19.440
173 HA CYS 23 HA CYS 23 17.924 19.320 21.954
174 HB2 CYS 23 HB2 CYS 23 16.650 21.324 21.376
175 HB3 CYS 23 HB3 CYS 23 15.174 20.393 21.386
176 H ILE 24 H ILE 24 18.101 17.010 21.533
177 HA ILE 24 HA ILE 24 15.710 15.367 22.129
178 HB ILE 24 HB ILE 24 18.504 14.455 21.386
179 HG12 ILE 24 HG12 ILE 24 16.131 15.005 19.552
180 HG13 ILE 24 HG13 ILE 24 17.631 15.954 19.601
181 HG21 ILE 24 HG21 ILE 24 15.782 13.097 21.144
182 HG22 ILE 24 HG22 ILE 24 17.366 12.349 20.822
183 HG23 ILE 24 HG23 ILE 24 16.924 12.787 22.466
184 HD11 ILE 24 HD11 ILE 24 18.924 14.106 18.755
185 HD12 ILE 24 HD12 ILE 24 17.487 13.046 18.724
186 HD13 ILE 24 HD13 ILE 24 17.561 14.465 17.682
187 H GLY 25 H GLY 25 15.314 14.633 24.134
188 HA2 GLY 25 HA2 GLY 25 15.591 14.206 26.400
189 HA3 GLY 25 HA3 GLY 25 17.343 14.105 26.171
190 H GLU 26 H GLU 26 15.195 16.823 25.385
191 HA GLU 26 HA GLU 26 15.131 18.999 25.993
192 HB2 GLU 26 HB2 GLU 26 15.368 17.764 28.740
193 HB3 GLU 26 HB3 GLU 26 14.710 19.349 28.382
194 HG2 GLU 26 HG2 GLU 26 13.524 16.733 27.374
195 HG3 GLU 26 HG3 GLU 26 12.967 17.648 28.773
196 H GLU 27 H GLU 27 17.932 18.231 25.417
197 HA GLU 27 HA GLU 27 19.091 20.748 26.550
198 HB2 GLU 27 HB2 GLU 27 20.545 18.154 25.933
199 HB3 GLU 27 HB3 GLU 27 21.351 19.711 26.152
200 HG2 GLU 27 HG2 GLU 27 20.531 19.892 28.442
201 HG3 GLU 27 HG3 GLU 27 19.607 18.390 28.271
202 H CYS 28 H CYS 28 19.307 22.258 25.006
203 HA CYS 28 HA CYS 28 18.863 21.480 22.204
204 HB2 CYS 28 HB2 CYS 28 17.593 23.348 23.033
205 HB3 CYS 28 HB3 CYS 28 19.055 24.174 23.565
206 H LYS 29 H LYS 29 20.457 20.824 21.032
207 HA LYS 29 HA LYS 29 23.214 21.926 21.251
208 HB2 LYS 29 HB2 LYS 29 22.444 19.323 21.295
209 HB3 LYS 29 HB3 LYS 29 22.418 19.546 19.542
210 HG2 LYS 29 HG2 LYS 29 24.823 20.549 19.831
211 HG3 LYS 29 HG3 LYS 29 24.751 19.914 21.461
212 HD2 LYS 29 HD2 LYS 29 24.767 18.416 18.841
213 HD3 LYS 29 HD3 LYS 29 25.936 18.303 20.161
214 HE2 LYS 29 HE2 LYS 29 23.062 17.280 20.150
215 HE3 LYS 29 HE3 LYS 29 24.513 16.297 19.995
216 HZ1 LYS 29 HZ1 LYS 29 23.697 16.190 22.201
217 HZ2 LYS 29 HZ2 LYS 29 25.110 17.025 22.289
218 HZ3 LYS 29 HZ3 LYS 29 23.682 17.821 22.408
219 H CYS 30 H CYS 30 23.924 23.287 19.598
220 HA CYS 30 HA CYS 30 22.456 23.062 17.007
221 HB2 CYS 30 HB2 CYS 30 24.482 25.198 17.473
222 HB3 CYS 30 HB3 CYS 30 23.188 25.109 16.271
223 H VAL 31 H VAL 31 23.513 22.569 15.188
224 HA VAL 31 HA VAL 31 25.876 20.845 15.728
225 HB VAL 31 HB VAL 31 23.664 19.840 13.976
226 HG11 VAL 31 HG11 VAL 31 24.379 17.733 15.006
227 HG12 VAL 31 HG12 VAL 31 25.774 18.611 14.378
228 HG13 VAL 31 HG13 VAL 31 25.428 18.617 16.125
229 HG21 VAL 31 HG21 VAL 31 22.462 18.840 15.890
230 HG22 VAL 31 HG22 VAL 31 23.413 19.836 17.013
231 HG23 VAL 31 HG23 VAL 31 22.282 20.595 15.862
232 HA PRO 32 HA PRO 32 27.019 22.237 11.545
233 HB2 PRO 32 HB2 PRO 32 29.413 20.794 11.381
234 HB3 PRO 32 HB3 PRO 32 29.212 22.446 12.012
235 HG2 PRO 32 HG2 PRO 32 29.778 20.007 13.526
236 HG3 PRO 32 HG3 PRO 32 29.824 21.719 14.048
237 HD2 PRO 32 HD2 PRO 32 27.774 19.735 14.554
238 HD3 PRO 32 HD3 PRO 32 27.927 21.400 15.186
239 H TYR 33 H TYR 33 25.271 21.226 10.721
240 HA TYR 33 HA TYR 33 24.891 18.417 10.297
241 HB2 TYR 33 HB2 TYR 33 23.090 19.011 8.856
242 HB3 TYR 33 HB3 TYR 33 23.085 20.014 10.285
243 HD1 TYR 33 HD1 TYR 33 23.866 19.917 6.654
244 HD2 TYR 33 HD2 TYR 33 23.279 22.405 10.113
245 HE1 TYR 33 HE1 TYR 33 24.008 21.944 5.203
246 HE2 TYR 33 HE2 TYR 33 23.428 24.459 8.657
247 HH TYR 33 HH TYR 33 23.828 25.256 6.500
Start of MODEL 4
1 H1 GLY 1 H1 GLY 1 14.346 19.019 35.276
2 H2 GLY 1 H2 GLY 1 14.105 18.082 33.944
3 H3 GLY 1 H3 GLY 1 14.679 17.414 35.347
4 HA2 GLY 1 HA2 GLY 1 12.376 16.849 35.080
5 HA3 GLY 1 HA3 GLY 1 12.640 17.896 36.491
6 H SER 2 H SER 2 10.912 17.456 33.667
7 HA SER 2 HA SER 2 9.291 18.498 32.584
8 HB2 SER 2 HB2 SER 2 8.891 20.076 35.125
9 HB3 SER 2 HB3 SER 2 7.705 19.833 33.832
10 HG SER 2 HG SER 2 7.304 18.365 35.421
11 H ALA 3 H ALA 3 12.012 20.237 32.720
12 HA ALA 3 HA ALA 3 10.914 22.793 31.753
13 HB1 ALA 3 HB1 ALA 3 13.220 23.526 31.746
14 HB2 ALA 3 HB2 ALA 3 12.879 22.706 33.278
15 HB3 ALA 3 HB3 ALA 3 13.794 21.871 31.999
16 H PHE 4 H PHE 4 9.920 20.865 30.199
17 HA PHE 4 HA PHE 4 11.464 19.763 28.150
18 HB2 PHE 4 HB2 PHE 4 8.522 20.492 27.968
19 HB3 PHE 4 HB3 PHE 4 9.356 19.247 27.053
20 HD1 PHE 4 HD1 PHE 4 10.753 17.536 28.810
21 HD2 PHE 4 HD2 PHE 4 7.065 19.638 29.569
22 HE1 PHE 4 HE1 PHE 4 10.130 15.839 30.514
23 HE2 PHE 4 HE2 PHE 4 6.442 17.939 31.267
24 HZ PHE 4 HZ PHE 4 7.966 16.025 31.729
25 H CYS 5 H CYS 5 11.915 20.209 26.060
26 HA CYS 5 HA CYS 5 11.417 22.970 25.042
27 HB2 CYS 5 HB2 CYS 5 13.541 22.873 23.925
28 HB3 CYS 5 HB3 CYS 5 13.783 22.549 25.626
29 H ASN 6 H ASN 6 11.372 23.150 22.689
30 HA ASN 6 HA ASN 6 10.443 20.697 21.236
31 HB2 ASN 6 HB2 ASN 6 8.836 22.583 21.152
32 HB3 ASN 6 HB3 ASN 6 10.103 23.646 20.522
33 HD21 ASN 6 HD22 ASN 6 8.191 23.827 18.846
34 HD22 ASN 6 HD21 ASN 6 8.310 22.639 17.548
35 H LEU 7 H LEU 7 12.005 19.754 19.962
36 HA LEU 7 HA LEU 7 14.581 20.833 19.439
37 HB2 LEU 7 HB2 LEU 7 14.126 18.514 19.061
38 HB3 LEU 7 HB3 LEU 7 12.946 18.860 17.807
39 HG LEU 7 HG LEU 7 15.747 19.961 17.364
40 HD11 LEU 7 HD11 LEU 7 16.447 17.734 16.454
41 HD12 LEU 7 HD12 LEU 7 16.107 17.605 18.194
42 HD13 LEU 7 HD13 LEU 7 14.929 17.026 17.009
43 HD21 LEU 7 HD21 LEU 7 15.307 19.243 15.046
44 HD22 LEU 7 HD22 LEU 7 13.726 18.595 15.530
45 HD23 LEU 7 HD23 LEU 7 14.056 20.337 15.605
46 H ARG 8 H ARG 8 11.615 21.133 17.437
47 HA ARG 8 HA ARG 8 12.858 22.466 15.275
48 HB2 ARG 8 HB2 ARG 8 10.469 21.351 15.678
49 HB3 ARG 8 HB3 ARG 8 9.972 22.983 16.118
50 HG2 ARG 8 HG2 ARG 8 11.300 22.225 13.488
51 HG3 ARG 8 HG3 ARG 8 9.554 22.205 13.738
52 HD2 ARG 8 HD2 ARG 8 9.410 24.345 13.229
53 HD3 ARG 8 HD3 ARG 8 10.392 24.773 14.624
54 HE ARG 8 HE ARG 8 12.418 24.342 13.119
55 HH11 ARG 8 HH22 ARG 8 9.452 25.321 11.452
56 HH12 ARG 8 HH21 ARG 8 10.359 25.407 9.936
57 HH21 ARG 8 HH11 ARG 8 13.366 24.664 11.269
58 HH22 ARG 8 HH12 ARG 8 12.429 25.200 9.858
59 H ARG 9 H ARG 9 11.640 23.796 18.261
60 HA ARG 9 HA ARG 9 11.922 26.575 17.360
61 HB2 ARG 9 HB2 ARG 9 10.152 25.641 18.900
62 HB3 ARG 9 HB3 ARG 9 11.395 25.534 20.156
63 HG2 ARG 9 HG2 ARG 9 11.689 27.957 20.124
64 HG3 ARG 9 HG3 ARG 9 10.702 28.096 18.662
65 HD2 ARG 9 HD2 ARG 9 9.347 28.699 20.637
66 HD3 ARG 9 HD3 ARG 9 8.736 27.234 19.860
67 HE ARG 9 HE ARG 9 10.538 27.091 22.263
68 HH11 ARG 9 HH11 ARG 9 7.269 26.530 21.086
69 HH12 ARG 9 HH12 ARG 9 6.970 25.318 22.315
70 HH21 ARG 9 HH21 ARG 9 10.021 25.591 23.824
71 HH22 ARG 9 HH22 ARG 9 8.519 24.727 23.746
72 H CYS 10 H CYS 10 13.969 24.259 19.098
73 HA CYS 10 HA CYS 10 15.950 26.363 19.739
74 HB2 CYS 10 HB2 CYS 10 15.723 24.267 21.135
75 HB3 CYS 10 HB3 CYS 10 16.360 23.372 19.729
76 H GLU 11 H GLU 11 15.426 23.834 17.267
77 HA GLU 11 HA GLU 11 17.657 23.875 15.690
78 HB2 GLU 11 HB2 GLU 11 15.775 22.476 15.372
79 HB3 GLU 11 HB3 GLU 11 14.767 23.825 14.923
80 HG2 GLU 11 HG2 GLU 11 17.177 23.587 13.258
81 HG3 GLU 11 HG3 GLU 11 16.206 22.128 13.252
82 H LEU 12 H LEU 12 14.933 26.159 15.441
83 HA LEU 12 HA LEU 12 16.148 27.819 13.544
84 HB2 LEU 12 HB2 LEU 12 13.927 28.084 15.565
85 HB3 LEU 12 HB3 LEU 12 14.285 29.432 14.473
86 HG LEU 12 HG LEU 12 13.615 26.598 13.538
87 HD11 LEU 12 HD11 LEU 12 11.698 27.621 14.669
88 HD12 LEU 12 HD12 LEU 12 11.881 29.103 13.698
89 HD13 LEU 12 HD13 LEU 12 11.422 27.569 12.923
90 HD21 LEU 12 HD21 LEU 12 13.848 29.255 12.036
91 HD22 LEU 12 HD22 LEU 12 14.875 27.816 11.820
92 HD23 LEU 12 HD23 LEU 12 13.184 27.759 11.356
93 H SER 13 H SER 13 16.469 27.954 17.055
94 HA SER 13 HA SER 13 17.766 30.565 17.209
95 HB2 SER 13 HB2 SER 13 16.696 29.550 19.178
96 HB3 SER 13 HB3 SER 13 17.783 28.162 19.081
97 HG SER 13 HG SER 13 18.646 29.453 20.578
98 H CYS 14 H CYS 14 18.858 27.175 17.064
99 HA CYS 14 HA CYS 14 21.683 27.656 16.840
100 HB2 CYS 14 HB2 CYS 14 19.786 25.436 16.071
101 HB3 CYS 14 HB3 CYS 14 21.518 25.331 15.838
102 H ARG 15 H ARG 15 19.088 27.755 14.374
103 HA ARG 15 HA ARG 15 20.929 27.578 12.140
104 HB2 ARG 15 HB2 ARG 15 18.177 28.508 12.675
105 HB3 ARG 15 HB3 ARG 15 18.752 28.515 10.998
106 HG2 ARG 15 HG2 ARG 15 19.204 25.899 12.378
107 HG3 ARG 15 HG3 ARG 15 17.492 26.364 12.249
108 HD2 ARG 15 HD2 ARG 15 17.785 26.813 9.830
109 HD3 ARG 15 HD3 ARG 15 19.423 26.153 9.918
110 HE ARG 15 HE ARG 15 16.856 24.701 10.524
111 HH11 ARG 15 HH21 ARG 15 20.231 24.300 9.730
112 HH12 ARG 15 HH22 ARG 15 19.897 22.853 8.757
113 HH21 ARG 15 HH11 ARG 15 16.525 22.855 9.367
114 HH22 ARG 15 HH12 ARG 15 17.896 21.856 8.943
115 H SER 16 H SER 16 19.912 30.244 14.141
116 HA SER 16 HA SER 16 20.543 32.489 12.505
117 HB2 SER 16 HB2 SER 16 19.585 32.343 14.911
118 HB3 SER 16 HB3 SER 16 21.265 32.228 15.441
119 HG SER 16 HG SER 16 20.593 34.405 15.391
120 H LEU 17 H LEU 17 22.482 29.991 13.735
121 HA LEU 17 HA LEU 17 25.109 31.261 13.525
122 HB2 LEU 17 HB2 LEU 17 24.547 28.398 14.238
123 HB3 LEU 17 HB3 LEU 17 25.792 29.459 14.857
124 HG LEU 17 HG LEU 17 22.803 29.559 15.623
125 HD11 LEU 17 HD11 LEU 17 24.025 27.562 16.454
126 HD12 LEU 17 HD12 LEU 17 25.284 28.615 17.122
127 HD13 LEU 17 HD13 LEU 17 23.635 28.685 17.775
128 HD21 LEU 17 HD21 LEU 17 23.537 31.093 17.388
129 HD22 LEU 17 HD22 LEU 17 25.199 31.056 16.761
130 HD23 LEU 17 HD23 LEU 17 23.902 31.791 15.808
131 H GLY 18 H GLY 18 23.136 29.989 11.203
132 HA2 GLY 18 HA2 GLY 18 23.487 29.005 9.145
133 HA3 GLY 18 HA3 GLY 18 25.229 29.025 9.440
134 H LEU 19 H LEU 19 23.429 27.426 11.915
135 HA LEU 19 HA LEU 19 24.428 24.788 10.956
136 HB2 LEU 19 HB2 LEU 19 23.761 25.678 13.783
137 HB3 LEU 19 HB3 LEU 19 24.532 24.183 13.310
138 HG LEU 19 HG LEU 19 25.742 26.944 13.142
139 HD11 LEU 19 HD11 LEU 19 27.321 26.018 14.769
140 HD12 LEU 19 HD12 LEU 19 25.665 25.929 15.380
141 HD13 LEU 19 HD13 LEU 19 26.466 24.464 14.751
142 HD21 LEU 19 HD21 LEU 19 26.547 25.706 11.200
143 HD22 LEU 19 HD22 LEU 19 27.813 25.748 12.421
144 HD23 LEU 19 HD23 LEU 19 26.848 24.274 12.207
145 H LEU 20 H LEU 20 23.203 23.089 12.479
146 HA LEU 20 HA LEU 20 20.240 23.281 12.183
147 HB2 LEU 20 HB2 LEU 20 21.230 21.325 11.113
148 HB3 LEU 20 HB3 LEU 20 22.159 20.956 12.578
149 HG LEU 20 HG LEU 20 20.179 20.273 13.761
150 HD11 LEU 20 HD11 LEU 20 18.007 20.101 12.646
151 HD12 LEU 20 HD12 LEU 20 18.505 21.796 12.586
152 HD13 LEU 20 HD13 LEU 20 18.672 20.783 11.151
153 HD21 LEU 20 HD21 LEU 20 19.641 18.308 12.337
154 HD22 LEU 20 HD22 LEU 20 20.395 19.099 10.951
155 HD23 LEU 20 HD23 LEU 20 21.395 18.648 12.339
156 H GLY 21 H GLY 21 19.144 22.453 14.137
157 HA2 GLY 21 HA2 GLY 21 20.737 22.377 16.628
158 HA3 GLY 21 HA3 GLY 21 19.320 23.384 16.670
159 H LYS 22 H LYS 22 20.019 21.035 18.157
160 HA LYS 22 HA LYS 22 17.739 19.227 17.593
161 HB2 LYS 22 HB2 LYS 22 20.639 18.428 18.033
162 HB3 LYS 22 HB3 LYS 22 19.261 17.313 18.143
163 HG2 LYS 22 HG2 LYS 22 18.684 18.067 15.733
164 HG3 LYS 22 HG3 LYS 22 20.292 18.811 15.718
165 HD2 LYS 22 HD2 LYS 22 21.241 16.526 16.346
166 HD3 LYS 22 HD3 LYS 22 19.603 15.870 16.097
167 HE2 LYS 22 HE2 LYS 22 19.603 16.707 13.769
168 HE3 LYS 22 HE3 LYS 22 21.188 17.457 14.032
169 HZ1 LYS 22 HZ1 LYS 22 22.072 15.183 14.404
170 HZ2 LYS 22 HZ2 LYS 22 20.607 14.564 13.940
171 HZ3 LYS 22 HZ3 LYS 22 21.530 15.454 12.893
172 H CYS 23 H CYS 23 16.526 19.904 19.285
173 HA CYS 23 HA CYS 23 17.722 19.718 22.002
174 HB2 CYS 23 HB2 CYS 23 16.866 21.923 21.443
175 HB3 CYS 23 HB3 CYS 23 15.257 21.280 21.323
176 H ILE 24 H ILE 24 17.684 17.510 21.766
177 HA ILE 24 HA ILE 24 15.094 16.112 22.056
178 HB ILE 24 HB ILE 24 17.886 14.937 22.127
179 HG12 ILE 24 HG12 ILE 24 16.101 15.481 19.718
180 HG13 ILE 24 HG13 ILE 24 17.724 16.135 20.024
181 HG21 ILE 24 HG21 ILE 24 15.990 13.541 23.025
182 HG22 ILE 24 HG22 ILE 24 15.175 13.693 21.453
183 HG23 ILE 24 HG23 ILE 24 16.725 12.839 21.595
184 HD11 ILE 24 HD11 ILE 24 17.907 14.445 18.367
185 HD12 ILE 24 HD12 ILE 24 18.662 13.836 19.857
186 HD13 ILE 24 HD13 ILE 24 17.049 13.252 19.356
187 H GLY 25 H GLY 25 14.238 16.504 24.021
188 HA2 GLY 25 HA2 GLY 25 13.799 16.095 26.224
189 HA3 GLY 25 HA3 GLY 25 15.199 15.039 26.231
190 H GLU 26 H GLU 26 14.053 18.300 26.761
191 HA GLU 26 HA GLU 26 14.752 20.099 27.936
192 HB2 GLU 26 HB2 GLU 26 16.078 18.074 29.755
193 HB3 GLU 26 HB3 GLU 26 15.684 19.741 30.160
194 HG2 GLU 26 HG2 GLU 26 13.266 19.242 29.848
195 HG3 GLU 26 HG3 GLU 26 13.669 17.545 29.576
196 H GLU 27 H GLU 27 16.951 18.943 25.898
197 HA GLU 27 HA GLU 27 19.068 20.876 26.717
198 HB2 GLU 27 HB2 GLU 27 19.583 18.832 27.920
199 HB3 GLU 27 HB3 GLU 27 19.472 17.874 26.440
200 HG2 GLU 27 HG2 GLU 27 21.439 19.100 25.524
201 HG3 GLU 27 HG3 GLU 27 21.523 20.054 27.016
202 H CYS 28 H CYS 28 19.926 21.870 25.008
203 HA CYS 28 HA CYS 28 19.464 20.734 22.310
204 HB2 CYS 28 HB2 CYS 28 18.340 22.880 23.034
205 HB3 CYS 28 HB3 CYS 28 19.930 23.625 23.023
206 H LYS 29 H LYS 29 20.960 20.302 20.951
207 HA LYS 29 HA LYS 29 23.751 21.361 21.233
208 HB2 LYS 29 HB2 LYS 29 23.234 18.781 21.225
209 HB3 LYS 29 HB3 LYS 29 22.848 19.002 19.524
210 HG2 LYS 29 HG2 LYS 29 25.234 20.099 19.370
211 HG3 LYS 29 HG3 LYS 29 25.510 19.383 20.958
212 HD2 LYS 29 HD2 LYS 29 24.870 17.952 18.349
213 HD3 LYS 29 HD3 LYS 29 26.411 17.949 19.180
214 HE2 LYS 29 HE2 LYS 29 23.854 16.731 20.331
215 HE3 LYS 29 HE3 LYS 29 25.000 15.849 19.317
216 HZ1 LYS 29 HZ1 LYS 29 25.528 15.429 21.596
217 HZ2 LYS 29 HZ2 LYS 29 26.737 16.339 20.985
218 HZ3 LYS 29 HZ3 LYS 29 25.602 17.008 21.983
219 H CYS 30 H CYS 30 24.512 22.631 19.466
220 HA CYS 30 HA CYS 30 22.749 22.740 17.041
221 HB2 CYS 30 HB2 CYS 30 24.846 24.832 17.474
222 HB3 CYS 30 HB3 CYS 30 23.447 24.839 16.379
223 H VAL 31 H VAL 31 23.655 22.420 15.107
224 HA VAL 31 HA VAL 31 26.021 20.609 15.309
225 HB VAL 31 HB VAL 31 23.452 19.783 13.961
226 HG11 VAL 31 HG11 VAL 31 25.555 18.517 13.580
227 HG12 VAL 31 HG12 VAL 31 25.722 18.297 15.338
228 HG13 VAL 31 HG13 VAL 31 24.363 17.559 14.465
229 HG21 VAL 31 HG21 VAL 31 22.630 20.252 16.181
230 HG22 VAL 31 HG22 VAL 31 22.889 18.508 16.050
231 HG23 VAL 31 HG23 VAL 31 24.069 19.512 16.918
232 HA PRO 32 HA PRO 32 26.752 22.307 11.144
233 HB2 PRO 32 HB2 PRO 32 29.251 20.665 11.554
234 HB3 PRO 32 HB3 PRO 32 29.064 22.316 10.882
235 HG2 PRO 32 HG2 PRO 32 29.950 22.022 13.414
236 HG3 PRO 32 HG3 PRO 32 28.698 23.242 13.072
237 HD2 PRO 32 HD2 PRO 32 28.300 20.409 14.096
238 HD3 PRO 32 HD3 PRO 32 27.691 21.950 14.778
239 H TYR 33 H TYR 33 25.051 21.178 10.369
240 HA TYR 33 HA TYR 33 24.700 18.392 10.241
241 HB2 TYR 33 HB2 TYR 33 22.779 18.879 8.833
242 HB3 TYR 33 HB3 TYR 33 22.872 19.903 10.245
243 HD1 TYR 33 HD1 TYR 33 23.295 19.781 6.571
244 HD2 TYR 33 HD2 TYR 33 23.085 22.308 10.043
245 HE1 TYR 33 HE1 TYR 33 23.258 21.786 5.087
246 HE2 TYR 33 HE2 TYR 33 23.104 24.346 8.545
247 HH TYR 33 HH TYR 33 23.210 24.046 4.969
Start of MODEL 5
1 H1 GLY 1 H1 GLY 1 13.612 17.070 23.218
2 H2 GLY 1 H2 GLY 1 12.279 17.763 23.893
3 H3 GLY 1 H3 GLY 1 12.505 17.830 22.256
4 HA2 GLY 1 HA2 GLY 1 12.210 15.495 22.021
5 HA3 GLY 1 HA3 GLY 1 12.080 15.361 23.789
6 H SER 2 H SER 2 10.091 15.335 24.574
7 HA SER 2 HA SER 2 8.003 17.105 23.430
8 HB2 SER 2 HB2 SER 2 7.673 14.118 23.906
9 HB3 SER 2 HB3 SER 2 6.306 15.232 23.739
10 HG SER 2 HG SER 2 7.126 15.872 21.734
11 H ALA 3 H ALA 3 9.774 16.589 26.066
12 HA ALA 3 HA ALA 3 7.492 16.770 27.986
13 HB1 ALA 3 HB1 ALA 3 10.384 16.004 28.505
14 HB2 ALA 3 HB2 ALA 3 9.014 15.908 29.625
15 HB3 ALA 3 HB3 ALA 3 9.057 14.852 28.209
16 H PHE 4 H PHE 4 10.476 18.496 26.999
17 HA PHE 4 HA PHE 4 9.619 20.822 28.641
18 HB2 PHE 4 HB2 PHE 4 10.992 19.272 30.046
19 HB3 PHE 4 HB3 PHE 4 12.330 19.480 28.922
20 HD1 PHE 4 HD1 PHE 4 10.062 21.327 31.263
21 HD2 PHE 4 HD2 PHE 4 13.847 21.310 29.197
22 HE1 PHE 4 HE1 PHE 4 10.791 23.311 32.560
23 HE2 PHE 4 HE2 PHE 4 14.552 23.302 30.498
24 HZ PHE 4 HZ PHE 4 13.034 24.310 32.177
25 H CYS 5 H CYS 5 11.282 19.680 25.782
26 HA CYS 5 HA CYS 5 11.658 22.520 24.942
27 HB2 CYS 5 HB2 CYS 5 13.795 21.596 25.905
28 HB3 CYS 5 HB3 CYS 5 13.740 20.318 24.699
29 H ASN 6 H ASN 6 10.989 22.871 22.849
30 HA ASN 6 HA ASN 6 10.533 20.583 21.004
31 HB2 ASN 6 HB2 ASN 6 10.243 23.603 20.655
32 HB3 ASN 6 HB3 ASN 6 9.971 22.423 19.373
33 HD21 ASN 6 HD22 ASN 6 8.042 21.191 19.357
34 HD22 ASN 6 HD21 ASN 6 6.803 21.394 20.595
35 H LEU 7 H LEU 7 12.079 19.834 19.644
36 HA LEU 7 HA LEU 7 14.721 20.981 19.421
37 HB2 LEU 7 HB2 LEU 7 14.577 18.709 18.941
38 HB3 LEU 7 HB3 LEU 7 13.227 18.907 17.823
39 HG LEU 7 HG LEU 7 15.981 20.057 17.193
40 HD11 LEU 7 HD11 LEU 7 16.129 17.573 17.693
41 HD12 LEU 7 HD12 LEU 7 14.819 17.292 16.542
42 HD13 LEU 7 HD13 LEU 7 16.372 17.908 15.968
43 HD21 LEU 7 HD21 LEU 7 15.287 19.632 14.833
44 HD22 LEU 7 HD22 LEU 7 13.679 19.138 15.403
45 HD23 LEU 7 HD23 LEU 7 14.245 20.804 15.590
46 H ARG 8 H ARG 8 11.820 21.330 17.262
47 HA ARG 8 HA ARG 8 12.830 22.982 15.338
48 HB2 ARG 8 HB2 ARG 8 10.562 22.246 15.297
49 HB3 ARG 8 HB3 ARG 8 10.174 23.075 16.802
50 HG2 ARG 8 HG2 ARG 8 9.186 24.169 14.829
51 HG3 ARG 8 HG3 ARG 8 10.232 25.231 15.759
52 HD2 ARG 8 HD2 ARG 8 10.620 25.658 13.440
53 HD3 ARG 8 HD3 ARG 8 12.055 24.896 14.077
54 HE ARG 8 HE ARG 8 11.568 22.871 12.900
55 HH11 ARG 8 HH11 ARG 8 9.013 25.218 12.232
56 HH12 ARG 8 HH12 ARG 8 8.834 24.586 10.588
57 HH21 ARG 8 HH21 ARG 8 11.380 22.424 10.719
58 HH22 ARG 8 HH22 ARG 8 9.999 23.050 9.854
59 H ARG 9 H ARG 9 11.897 24.214 18.579
60 HA ARG 9 HA ARG 9 12.635 26.947 17.767
61 HB2 ARG 9 HB2 ARG 9 11.438 25.766 20.277
62 HB3 ARG 9 HB3 ARG 9 12.049 27.437 20.236
63 HG2 ARG 9 HG2 ARG 9 10.683 27.933 18.281
64 HG3 ARG 9 HG3 ARG 9 10.063 26.278 18.213
65 HD2 ARG 9 HD2 ARG 9 9.637 28.062 20.631
66 HD3 ARG 9 HD3 ARG 9 8.607 28.159 19.209
67 HE ARG 9 HE ARG 9 8.577 26.096 21.237
68 HH11 ARG 9 HH11 ARG 9 7.636 26.706 17.845
69 HH12 ARG 9 HH12 ARG 9 6.284 25.606 18.005
70 HH21 ARG 9 HH21 ARG 9 7.026 24.562 21.170
71 HH22 ARG 9 HH22 ARG 9 5.833 24.598 19.892
72 H CYS 10 H CYS 10 14.356 24.366 19.299
73 HA CYS 10 HA CYS 10 16.683 26.045 19.983
74 HB2 CYS 10 HB2 CYS 10 16.461 24.014 21.185
75 HB3 CYS 10 HB3 CYS 10 16.042 23.120 19.735
76 H GLU 11 H GLU 11 15.566 23.989 17.273
77 HA GLU 11 HA GLU 11 17.767 24.098 15.594
78 HB2 GLU 11 HB2 GLU 11 15.567 22.747 15.390
79 HB3 GLU 11 HB3 GLU 11 14.994 24.137 14.452
80 HG2 GLU 11 HG2 GLU 11 17.306 23.732 13.188
81 HG3 GLU 11 HG3 GLU 11 17.163 22.143 13.905
82 H LEU 12 H LEU 12 14.986 26.358 15.626
83 HA LEU 12 HA LEU 12 16.134 27.998 13.608
84 HB2 LEU 12 HB2 LEU 12 13.814 28.078 15.457
85 HB3 LEU 12 HB3 LEU 12 14.283 29.637 14.748
86 HG LEU 12 HG LEU 12 13.895 27.136 13.044
87 HD11 LEU 12 HD11 LEU 12 11.659 27.966 12.503
88 HD12 LEU 12 HD12 LEU 12 11.790 27.665 14.247
89 HD13 LEU 12 HD13 LEU 12 11.865 29.325 13.629
90 HD21 LEU 12 HD21 LEU 12 15.157 28.994 11.952
91 HD22 LEU 12 HD22 LEU 12 13.549 28.822 11.238
92 HD23 LEU 12 HD23 LEU 12 13.867 30.124 12.394
93 H SER 13 H SER 13 16.414 28.275 17.165
94 HA SER 13 HA SER 13 17.904 30.762 17.044
95 HB2 SER 13 HB2 SER 13 17.765 28.591 19.172
96 HB3 SER 13 HB3 SER 13 18.586 30.156 19.369
97 HG SER 13 HG SER 13 16.373 30.127 20.132
98 H CYS 14 H CYS 14 18.821 27.342 16.870
99 HA CYS 14 HA CYS 14 21.672 27.757 16.687
100 HB2 CYS 14 HB2 CYS 14 19.758 25.539 15.946
101 HB3 CYS 14 HB3 CYS 14 21.495 25.433 15.720
102 H ARG 15 H ARG 15 19.088 27.985 14.327
103 HA ARG 15 HA ARG 15 20.893 27.749 12.032
104 HB2 ARG 15 HB2 ARG 15 18.055 28.277 12.647
105 HB3 ARG 15 HB3 ARG 15 18.547 28.544 10.962
106 HG2 ARG 15 HG2 ARG 15 19.256 26.281 10.662
107 HG3 ARG 15 HG3 ARG 15 19.108 25.905 12.377
108 HD2 ARG 15 HD2 ARG 15 17.306 24.905 11.069
109 HD3 ARG 15 HD3 ARG 15 16.657 26.082 12.226
110 HE ARG 15 HE ARG 15 17.128 27.237 9.596
111 HH11 ARG 15 HH11 ARG 15 14.824 25.058 11.094
112 HH12 ARG 15 HH12 ARG 15 13.494 25.735 10.181
113 HH21 ARG 15 HH21 ARG 15 15.358 28.057 8.510
114 HH22 ARG 15 HH22 ARG 15 13.762 27.478 8.907
115 H SER 16 H SER 16 19.742 30.374 14.013
116 HA SER 16 HA SER 16 20.406 32.696 12.527
117 HB2 SER 16 HB2 SER 16 21.148 31.894 15.376
118 HB3 SER 16 HB3 SER 16 21.135 33.557 14.751
119 HG SER 16 HG SER 16 18.893 33.367 14.436
120 H LEU 17 H LEU 17 22.358 30.006 13.375
121 HA LEU 17 HA LEU 17 24.977 31.362 13.289
122 HB2 LEU 17 HB2 LEU 17 24.482 28.504 14.048
123 HB3 LEU 17 HB3 LEU 17 25.684 29.619 14.657
124 HG LEU 17 HG LEU 17 22.692 29.664 15.388
125 HD11 LEU 17 HD11 LEU 17 23.522 28.863 17.572
126 HD12 LEU 17 HD12 LEU 17 23.956 27.715 16.289
127 HD13 LEU 17 HD13 LEU 17 25.182 28.817 16.944
128 HD21 LEU 17 HD21 LEU 17 23.768 31.921 15.531
129 HD22 LEU 17 HD22 LEU 17 23.353 31.251 17.114
130 HD23 LEU 17 HD23 LEU 17 25.037 31.223 16.547
131 H GLY 18 H GLY 18 23.064 29.903 11.018
132 HA2 GLY 18 HA2 GLY 18 23.481 28.843 9.002
133 HA3 GLY 18 HA3 GLY 18 25.208 28.820 9.360
134 H LEU 19 H LEU 19 23.658 27.413 12.009
135 HA LEU 19 HA LEU 19 24.470 24.706 11.113
136 HB2 LEU 19 HB2 LEU 19 23.831 25.725 13.899
137 HB3 LEU 19 HB3 LEU 19 24.587 24.202 13.492
138 HG LEU 19 HG LEU 19 25.819 26.954 13.087
139 HD11 LEU 19 HD11 LEU 19 27.359 26.229 14.849
140 HD12 LEU 19 HD12 LEU 19 25.691 26.241 15.434
141 HD13 LEU 19 HD13 LEU 19 26.479 24.698 15.017
142 HD21 LEU 19 HD21 LEU 19 26.981 24.171 12.587
143 HD22 LEU 19 HD22 LEU 19 26.647 25.409 11.346
144 HD23 LEU 19 HD23 LEU 19 27.894 25.694 12.556
145 H LEU 20 H LEU 20 23.214 22.985 12.536
146 HA LEU 20 HA LEU 20 20.255 23.240 12.217
147 HB2 LEU 20 HB2 LEU 20 21.212 21.243 11.211
148 HB3 LEU 20 HB3 LEU 20 22.159 20.912 12.668
149 HG LEU 20 HG LEU 20 20.016 20.396 13.875
150 HD11 LEU 20 HD11 LEU 20 18.819 20.381 11.065
151 HD12 LEU 20 HD12 LEU 20 17.977 20.105 12.604
152 HD13 LEU 20 HD13 LEU 20 18.563 21.725 12.171
153 HD21 LEU 20 HD21 LEU 20 20.588 18.806 11.365
154 HD22 LEU 20 HD22 LEU 20 21.405 18.624 12.930
155 HD23 LEU 20 HD23 LEU 20 19.675 18.246 12.777
156 H GLY 21 H GLY 21 19.054 22.409 14.197
157 HA2 GLY 21 HA2 GLY 21 20.664 22.355 16.674
158 HA3 GLY 21 HA3 GLY 21 19.163 23.233 16.753
159 H LYS 22 H LYS 22 19.937 20.986 18.270
160 HA LYS 22 HA LYS 22 17.799 19.031 17.732
161 HB2 LYS 22 HB2 LYS 22 20.738 18.324 18.005
162 HB3 LYS 22 HB3 LYS 22 19.416 17.187 18.291
163 HG2 LYS 22 HG2 LYS 22 18.610 17.795 15.896
164 HG3 LYS 22 HG3 LYS 22 20.218 18.508 15.675
165 HD2 LYS 22 HD2 LYS 22 21.205 16.302 16.377
166 HD3 LYS 22 HD3 LYS 22 19.560 15.648 16.500
167 HE2 LYS 22 HE2 LYS 22 19.200 16.169 14.093
168 HE3 LYS 22 HE3 LYS 22 20.897 16.697 13.977
169 HZ1 LYS 22 HZ1 LYS 22 20.489 14.315 13.308
170 HZ2 LYS 22 HZ2 LYS 22 21.580 14.454 14.575
171 HZ3 LYS 22 HZ3 LYS 22 20.043 13.991 14.834
172 H CYS 23 H CYS 23 16.649 19.651 19.473
173 HA CYS 23 HA CYS 23 17.936 19.749 22.137
174 HB2 CYS 23 HB2 CYS 23 16.581 21.651 21.221
175 HB3 CYS 23 HB3 CYS 23 15.174 20.655 21.460
176 H ILE 24 H ILE 24 17.953 17.361 21.264
177 HA ILE 24 HA ILE 24 15.908 15.805 22.741
178 HB ILE 24 HB ILE 24 17.018 13.852 21.492
179 HG12 ILE 24 HG12 ILE 24 17.631 16.096 19.530
180 HG13 ILE 24 HG13 ILE 24 18.847 15.357 20.517
181 HG21 ILE 24 HG21 ILE 24 15.186 15.815 20.039
182 HG22 ILE 24 HG22 ILE 24 15.361 14.085 19.671
183 HG23 ILE 24 HG23 ILE 24 14.679 14.587 21.217
184 HD11 ILE 24 HD11 ILE 24 17.276 14.030 18.293
185 HD12 ILE 24 HD12 ILE 24 19.020 14.354 18.385
186 HD13 ILE 24 HD13 ILE 24 18.293 13.123 19.439
187 H GLY 25 H GLY 25 18.499 14.629 24.950
188 HA2 GLY 25 HA2 GLY 25 15.889 13.775 24.232
189 HA3 GLY 25 HA3 GLY 25 16.535 13.918 25.870
190 H GLU 26 H GLU 26 16.729 16.450 26.553
191 HA GLU 26 HA GLU 26 14.624 18.107 25.232
192 HB2 GLU 26 HB2 GLU 26 14.863 18.039 28.243
193 HB3 GLU 26 HB3 GLU 26 13.723 18.955 27.271
194 HG2 GLU 26 HG3 GLU 26 13.770 15.936 27.610
195 HG3 GLU 26 HG2 GLU 26 12.694 17.051 28.428
196 H GLU 27 H GLU 27 17.582 17.969 25.171
197 HA GLU 27 HA GLU 27 18.362 20.630 26.323
198 HB2 GLU 27 HB2 GLU 27 20.528 19.512 26.874
199 HB3 GLU 27 HB3 GLU 27 19.125 18.961 27.784
200 HG2 GLU 27 HG2 GLU 27 19.415 17.223 25.471
201 HG3 GLU 27 HG3 GLU 27 20.980 17.428 26.212
202 H CYS 28 H CYS 28 19.366 22.026 25.037
203 HA CYS 28 HA CYS 28 19.261 21.386 22.202
204 HB2 CYS 28 HB2 CYS 28 18.259 23.386 23.177
205 HB3 CYS 28 HB3 CYS 28 19.812 23.957 23.678
206 H LYS 29 H LYS 29 20.886 20.488 21.125
207 HA LYS 29 HA LYS 29 23.632 21.691 21.278
208 HB2 LYS 29 HB2 LYS 29 23.370 19.149 21.266
209 HB3 LYS 29 HB3 LYS 29 22.703 19.266 19.627
210 HG2 LYS 29 HG2 LYS 29 24.881 20.458 18.998
211 HG3 LYS 29 HG3 LYS 29 25.497 20.137 20.598
212 HD2 LYS 29 HD2 LYS 29 24.890 18.155 18.353
213 HD3 LYS 29 HD3 LYS 29 26.436 18.557 19.103
214 HE2 LYS 29 HE2 LYS 29 25.373 17.650 21.296
215 HE3 LYS 29 HE3 LYS 29 24.136 16.973 20.223
216 HZ1 LYS 29 HZ1 LYS 29 25.880 15.738 19.075
217 HZ2 LYS 29 HZ2 LYS 29 27.059 16.441 20.002
218 HZ3 LYS 29 HZ3 LYS 29 25.990 15.411 20.673
219 H CYS 30 H CYS 30 24.417 22.857 19.457
220 HA CYS 30 HA CYS 30 22.644 22.924 17.062
221 HB2 CYS 30 HB2 CYS 30 24.813 24.966 17.428
222 HB3 CYS 30 HB3 CYS 30 23.443 24.949 16.283
223 H VAL 31 H VAL 31 23.466 22.276 15.193
224 HA VAL 31 HA VAL 31 25.845 20.522 15.578
225 HB VAL 31 HB VAL 31 23.399 19.671 14.052
226 HG11 VAL 31 HG11 VAL 31 25.493 18.329 13.976
227 HG12 VAL 31 HG12 VAL 31 25.440 18.183 15.747
228 HG13 VAL 31 HG13 VAL 31 24.165 17.457 14.746
229 HG21 VAL 31 HG21 VAL 31 22.591 18.535 16.146
230 HG22 VAL 31 HG22 VAL 31 23.675 19.584 17.071
231 HG23 VAL 31 HG23 VAL 31 22.346 20.286 16.123
232 HA PRO 32 HA PRO 32 26.898 21.939 11.382
233 HB2 PRO 32 HB2 PRO 32 29.057 19.879 11.634
234 HB3 PRO 32 HB3 PRO 32 29.170 21.599 11.164
235 HG2 PRO 32 HG2 PRO 32 29.996 20.746 13.621
236 HG3 PRO 32 HG3 PRO 32 29.103 22.297 13.440
237 HD2 PRO 32 HD2 PRO 32 27.983 19.584 14.218
238 HD3 PRO 32 HD3 PRO 32 27.767 21.174 15.022
239 H TYR 33 H TYR 33 25.009 21.090 10.488
240 HA TYR 33 HA TYR 33 24.531 18.268 10.200
241 HB2 TYR 33 HB2 TYR 33 22.626 18.766 8.903
242 HB3 TYR 33 HB3 TYR 33 22.706 19.767 10.329
243 HD1 TYR 33 HD1 TYR 33 22.930 19.715 6.638
244 HD2 TYR 33 HD2 TYR 33 22.953 22.175 10.161
245 HE1 TYR 33 HE1 TYR 33 22.585 21.739 5.215
246 HE2 TYR 33 HE2 TYR 33 22.562 24.210 8.748
247 HH TYR 33 HH TYR 33 22.224 25.011 6.618
Start of MODEL 6
1 H1 GLY 1 H1 GLY 1 10.267 22.566 32.688
2 H2 GLY 1 H2 GLY 1 9.554 23.754 31.794
3 H3 GLY 1 H3 GLY 1 9.742 23.957 33.422
4 HA2 GLY 1 HA2 GLY 1 12.070 24.110 33.269
5 HA3 GLY 1 HA3 GLY 1 11.974 23.674 31.549
6 H SER 2 H SER 2 12.919 26.155 33.073
7 HA SER 2 HA SER 2 11.156 28.314 32.368
8 HB2 SER 2 HB2 SER 2 13.132 29.730 33.063
9 HB3 SER 2 HB3 SER 2 12.552 28.575 34.261
10 HG SER 2 HG SER 2 14.249 27.313 33.980
11 H ALA 3 H ALA 3 12.929 26.546 30.176
12 HA ALA 3 HA ALA 3 13.094 28.871 28.307
13 HB1 ALA 3 HB1 ALA 3 14.968 26.483 28.479
14 HB2 ALA 3 HB2 ALA 3 15.077 27.826 27.327
15 HB3 ALA 3 HB3 ALA 3 15.323 28.126 29.055
16 H PHE 4 H PHE 4 11.378 26.027 28.815
17 HA PHE 4 HA PHE 4 10.106 24.659 27.496
18 HB2 PHE 4 HB2 PHE 4 9.722 27.274 26.012
19 HB3 PHE 4 HB3 PHE 4 8.632 25.899 25.994
20 HD1 PHE 4 HD2 PHE 4 7.235 25.335 27.946
21 HD2 PHE 4 HD1 PHE 4 9.814 28.792 27.950
22 HE1 PHE 4 HE2 PHE 4 5.985 26.266 29.876
23 HE2 PHE 4 HE1 PHE 4 8.571 29.711 29.894
24 HZ PHE 4 HZ PHE 4 6.645 28.464 30.844
25 H CYS 5 H CYS 5 12.447 23.800 26.810
26 HA CYS 5 HA CYS 5 13.201 24.270 24.049
27 HB2 CYS 5 HB2 CYS 5 14.743 23.799 26.002
28 HB3 CYS 5 HB3 CYS 5 14.278 22.111 25.884
29 H ASN 6 H ASN 6 12.125 23.506 22.434
30 HA ASN 6 HA ASN 6 11.626 20.563 22.178
31 HB2 ASN 6 HB2 ASN 6 10.312 22.919 20.710
32 HB3 ASN 6 HB3 ASN 6 10.148 21.253 20.219
33 HD21 ASN 6 HD22 ASN 6 7.885 22.647 20.718
34 HD22 ASN 6 HD21 ASN 6 7.154 21.980 22.187
35 H LEU 7 H LEU 7 12.504 19.654 20.107
36 HA LEU 7 HA LEU 7 14.973 20.813 19.243
37 HB2 LEU 7 HB2 LEU 7 14.484 18.467 18.964
38 HB3 LEU 7 HB3 LEU 7 13.200 18.813 17.809
39 HG LEU 7 HG LEU 7 15.965 19.911 17.257
40 HD11 LEU 7 HD11 LEU 7 16.373 17.573 17.948
41 HD12 LEU 7 HD12 LEU 7 15.115 17.020 16.834
42 HD13 LEU 7 HD13 LEU 7 16.595 17.753 16.195
43 HD21 LEU 7 HD21 LEU 7 13.809 18.710 15.463
44 HD22 LEU 7 HD22 LEU 7 14.211 20.436 15.604
45 HD23 LEU 7 HD23 LEU 7 15.381 19.324 14.913
46 H ARG 8 H ARG 8 11.778 20.959 17.636
47 HA ARG 8 HA ARG 8 12.395 22.470 15.432
48 HB2 ARG 8 HB2 ARG 8 10.132 21.521 16.162
49 HB3 ARG 8 HB3 ARG 8 9.981 22.851 17.293
50 HG2 ARG 8 HG2 ARG 8 8.631 23.377 15.443
51 HG3 ARG 8 HG3 ARG 8 10.001 24.466 15.300
52 HD2 ARG 8 HD2 ARG 8 9.978 21.754 13.949
53 HD3 ARG 8 HD3 ARG 8 9.078 23.096 13.235
54 HE ARG 8 HE ARG 8 12.025 22.829 13.358
55 HH11 ARG 8 HH21 ARG 8 9.378 24.955 12.384
56 HH12 ARG 8 HH22 ARG 8 10.430 25.745 11.228
57 HH21 ARG 8 HH11 ARG 8 13.151 23.813 11.918
58 HH22 ARG 8 HH12 ARG 8 12.537 25.163 10.980
59 H ARG 9 H ARG 9 11.817 23.812 18.621
60 HA ARG 9 HA ARG 9 12.223 26.568 17.609
61 HB2 ARG 9 HB2 ARG 9 10.195 25.826 18.846
62 HB3 ARG 9 HB3 ARG 9 11.196 25.615 20.290
63 HG2 ARG 9 HG2 ARG 9 11.701 28.038 20.305
64 HG3 ARG 9 HG3 ARG 9 10.908 28.239 18.729
65 HD2 ARG 9 HD2 ARG 9 9.471 28.968 20.640
66 HD3 ARG 9 HD3 ARG 9 8.763 27.682 19.646
67 HE ARG 9 HE ARG 9 10.242 26.944 22.128
68 HH11 ARG 9 HH11 ARG 9 7.071 27.084 20.542
69 HH12 ARG 9 HH12 ARG 9 6.468 25.792 21.583
70 HH21 ARG 9 HH21 ARG 9 9.256 25.396 23.448
71 HH22 ARG 9 HH22 ARG 9 7.594 24.931 23.077
72 H CYS 10 H CYS 10 14.152 24.192 19.159
73 HA CYS 10 HA CYS 10 16.193 26.220 19.899
74 HB2 CYS 10 HB2 CYS 10 16.122 23.912 20.930
75 HB3 CYS 10 HB3 CYS 10 16.519 23.262 19.326
76 H GLU 11 H GLU 11 15.239 24.103 17.203
77 HA GLU 11 HA GLU 11 17.353 24.060 15.616
78 HB2 GLU 11 HB2 GLU 11 14.925 23.093 15.313
79 HB3 GLU 11 HB3 GLU 11 14.747 24.495 14.231
80 HG2 GLU 11 HG2 GLU 11 16.958 23.598 13.177
81 HG3 GLU 11 HG3 GLU 11 16.597 22.126 14.054
82 H LEU 12 H LEU 12 14.969 26.634 15.518
83 HA LEU 12 HA LEU 12 16.057 28.080 13.320
84 HB2 LEU 12 HB2 LEU 12 14.025 28.581 15.493
85 HB3 LEU 12 HB3 LEU 12 14.263 29.734 14.161
86 HG LEU 12 HG LEU 12 13.622 26.778 13.674
87 HD11 LEU 12 HD11 LEU 12 11.293 27.459 13.348
88 HD12 LEU 12 HD12 LEU 12 11.808 27.778 15.008
89 HD13 LEU 12 HD13 LEU 12 11.689 29.118 13.848
90 HD21 LEU 12 HD21 LEU 12 14.530 27.994 11.715
91 HD22 LEU 12 HD22 LEU 12 12.804 27.659 11.511
92 HD23 LEU 12 HD23 LEU 12 13.330 29.281 11.971
93 H SER 13 H SER 13 16.366 28.684 16.853
94 HA SER 13 HA SER 13 17.884 31.133 16.573
95 HB2 SER 13 HB2 SER 13 18.104 29.139 18.856
96 HB3 SER 13 HB3 SER 13 18.383 30.890 18.894
97 HG SER 13 HG SER 13 16.050 30.999 18.220
98 H CYS 14 H CYS 14 18.703 27.714 16.538
99 HA CYS 14 HA CYS 14 21.598 28.079 16.420
100 HB2 CYS 14 HB2 CYS 14 19.614 25.861 16.044
101 HB3 CYS 14 HB3 CYS 14 21.322 25.622 15.707
102 H ARG 15 H ARG 15 19.016 28.079 13.985
103 HA ARG 15 HA ARG 15 20.842 27.532 11.786
104 HB2 ARG 15 HB2 ARG 15 18.090 28.459 12.235
105 HB3 ARG 15 HB3 ARG 15 18.683 28.499 10.560
106 HG2 ARG 15 HG2 ARG 15 19.252 26.158 10.580
107 HG3 ARG 15 HG3 ARG 15 18.799 25.958 12.256
108 HD2 ARG 15 HD2 ARG 15 16.451 26.350 11.757
109 HD3 ARG 15 HD3 ARG 15 16.815 26.867 10.116
110 HE ARG 15 HE ARG 15 16.524 24.139 11.055
111 HH11 ARG 15 HH12 ARG 15 18.018 25.980 8.450
112 HH12 ARG 15 HH11 ARG 15 18.388 24.515 7.563
113 HH21 ARG 15 HH21 ARG 15 16.951 22.461 9.957
114 HH22 ARG 15 HH22 ARG 15 17.975 22.488 8.526
115 H SER 16 H SER 16 19.856 30.480 13.381
116 HA SER 16 HA SER 16 20.806 32.545 11.753
117 HB2 SER 16 HB2 SER 16 21.314 31.976 14.717
118 HB3 SER 16 HB3 SER 16 21.504 33.566 13.952
119 HG SER 16 HG SER 16 19.488 33.094 15.093
120 H LEU 17 H LEU 17 22.580 29.840 12.717
121 HA LEU 17 HA LEU 17 25.257 31.120 12.758
122 HB2 LEU 17 HB2 LEU 17 24.529 28.419 13.865
123 HB3 LEU 17 HB3 LEU 17 25.768 29.530 14.404
124 HG LEU 17 HG LEU 17 22.739 29.832 14.922
125 HD11 LEU 17 HD11 LEU 17 23.879 27.968 16.126
126 HD12 LEU 17 HD12 LEU 17 25.106 29.106 16.715
127 HD13 LEU 17 HD13 LEU 17 23.418 29.277 17.228
128 HD21 LEU 17 HD21 LEU 17 23.908 32.042 14.815
129 HD22 LEU 17 HD22 LEU 17 23.424 31.628 16.457
130 HD23 LEU 17 HD23 LEU 17 25.112 31.439 15.943
131 H GLY 18 H GLY 18 23.360 29.325 10.654
132 HA2 GLY 18 HA2 GLY 18 23.841 27.877 8.895
133 HA3 GLY 18 HA3 GLY 18 25.560 27.972 9.277
134 H LEU 19 H LEU 19 23.372 27.069 11.872
135 HA LEU 19 HA LEU 19 24.272 24.223 11.732
136 HB2 LEU 19 HB2 LEU 19 23.864 25.878 14.236
137 HB3 LEU 19 HB3 LEU 19 24.479 24.240 14.136
138 HG LEU 19 HG LEU 19 25.905 26.735 13.156
139 HD11 LEU 19 HD11 LEU 19 26.397 24.922 15.550
140 HD12 LEU 19 HD12 LEU 19 27.417 26.270 15.036
141 HD13 LEU 19 HD13 LEU 19 25.776 26.593 15.598
142 HD21 LEU 19 HD21 LEU 19 27.863 25.303 12.881
143 HD22 LEU 19 HD22 LEU 19 26.959 23.894 13.416
144 HD23 LEU 19 HD23 LEU 19 26.563 24.678 11.862
145 H LEU 20 H LEU 20 22.956 22.844 13.261
146 HA LEU 20 HA LEU 20 20.014 23.358 12.986
147 HB2 LEU 20 HB2 LEU 20 20.810 21.519 11.595
148 HB3 LEU 20 HB3 LEU 20 21.730 20.856 12.939
149 HG LEU 20 HG LEU 20 19.324 20.643 14.089
150 HD11 LEU 20 HD11 LEU 20 18.248 21.908 12.180
151 HD12 LEU 20 HD12 LEU 20 18.652 20.548 11.124
152 HD13 LEU 20 HD13 LEU 20 17.551 20.302 12.492
153 HD21 LEU 20 HD21 LEU 20 20.738 18.731 13.582
154 HD22 LEU 20 HD22 LEU 20 19.072 18.408 13.068
155 HD23 LEU 20 HD23 LEU 20 20.309 18.826 11.865
156 H GLY 21 H GLY 21 19.200 23.917 14.912
157 HA2 GLY 21 HA2 GLY 21 20.373 23.180 17.495
158 HA3 GLY 21 HA3 GLY 21 18.826 23.983 17.247
159 H LYS 22 H LYS 22 20.367 21.136 18.129
160 HA LYS 22 HA LYS 22 18.082 19.359 17.485
161 HB2 LYS 22 HB2 LYS 22 20.192 18.983 16.361
162 HB3 LYS 22 HB3 LYS 22 21.040 18.820 17.905
163 HG2 LYS 22 HG2 LYS 22 20.031 16.766 18.386
164 HG3 LYS 22 HG3 LYS 22 18.667 17.038 17.295
165 HD2 LYS 22 HD2 LYS 22 20.161 15.333 16.409
166 HD3 LYS 22 HD3 LYS 22 20.077 16.745 15.348
167 HE2 LYS 22 HE2 LYS 22 22.237 17.548 16.132
168 HE3 LYS 22 HE3 LYS 22 22.306 16.305 17.388
169 HZ1 LYS 22 HZ1 LYS 22 22.587 14.638 15.803
170 HZ2 LYS 22 HZ2 LYS 22 22.164 15.581 14.518
171 HZ3 LYS 22 HZ3 LYS 22 23.601 15.810 15.260
172 H CYS 23 H CYS 23 16.921 20.135 19.298
173 HA CYS 23 HA CYS 23 17.919 19.458 22.003
174 HB2 CYS 23 HB2 CYS 23 17.041 21.650 21.737
175 HB3 CYS 23 HB3 CYS 23 15.544 21.073 21.111
176 H ILE 24 H ILE 24 17.939 17.209 21.479
177 HA ILE 24 HA ILE 24 15.487 15.701 21.141
178 HB ILE 24 HB ILE 24 18.172 14.585 22.009
179 HG12 ILE 24 HG12 ILE 24 17.359 15.429 19.200
180 HG13 ILE 24 HG13 ILE 24 18.739 16.007 20.159
181 HG21 ILE 24 HG21 ILE 24 16.146 13.080 21.998
182 HG22 ILE 24 HG22 ILE 24 15.957 13.411 20.262
183 HG23 ILE 24 HG23 ILE 24 17.391 12.562 20.880
184 HD11 ILE 24 HD11 ILE 24 18.428 13.255 18.933
185 HD12 ILE 24 HD12 ILE 24 19.591 14.515 18.520
186 HD13 ILE 24 HD13 ILE 24 19.716 13.708 20.088
187 H GLY 25 H GLY 25 17.833 15.880 23.856
188 HA2 GLY 25 HA2 GLY 25 16.128 14.378 25.665
189 HA3 GLY 25 HA3 GLY 25 17.710 15.082 26.012
190 H GLU 26 H GLU 26 15.153 17.133 24.781
191 HA GLU 26 HA GLU 26 14.432 19.148 25.541
192 HB2 GLU 26 HB2 GLU 26 13.966 17.646 28.130
193 HB3 GLU 26 HB3 GLU 26 13.298 19.233 27.711
194 HG2 GLU 26 HG2 GLU 26 12.024 18.357 25.888
195 HG3 GLU 26 HG3 GLU 26 12.833 16.792 25.957
196 H GLU 27 H GLU 27 17.118 18.821 25.424
197 HA GLU 27 HA GLU 27 18.002 21.279 26.597
198 HB2 GLU 27 HB2 GLU 27 20.168 20.332 27.460
199 HB3 GLU 27 HB3 GLU 27 18.749 20.074 28.448
200 HG2 GLU 27 HG2 GLU 27 19.917 18.092 28.637
201 HG3 GLU 27 HG3 GLU 27 18.616 17.700 27.536
202 H CYS 28 H CYS 28 19.916 22.081 25.306
203 HA CYS 28 HA CYS 28 19.812 20.717 22.638
204 HB2 CYS 28 HB2 CYS 28 18.315 22.754 23.034
205 HB3 CYS 28 HB3 CYS 28 19.797 23.701 22.982
206 H LYS 29 H LYS 29 21.454 20.457 21.419
207 HA LYS 29 HA LYS 29 23.856 22.212 21.461
208 HB2 LYS 29 HB2 LYS 29 24.154 19.748 21.862
209 HB3 LYS 29 HB3 LYS 29 23.293 19.398 20.366
210 HG2 LYS 29 HG2 LYS 29 25.060 20.722 19.137
211 HG3 LYS 29 HG3 LYS 29 25.950 20.883 20.647
212 HD2 LYS 29 HD2 LYS 29 25.168 18.152 19.490
213 HD3 LYS 29 HD3 LYS 29 26.587 19.057 18.957
214 HE2 LYS 29 HE2 LYS 29 27.507 17.710 20.379
215 HE3 LYS 29 HE3 LYS 29 27.343 19.211 21.316
216 HZ1 LYS 29 HZ1 LYS 29 26.783 17.010 22.434
217 HZ2 LYS 29 HZ2 LYS 29 25.672 18.198 22.649
218 HZ3 LYS 29 HZ3 LYS 29 25.416 16.950 21.566
219 H CYS 30 H CYS 30 24.024 23.616 19.636
220 HA CYS 30 HA CYS 30 22.473 22.989 17.175
221 HB2 CYS 30 HB2 CYS 30 24.677 25.004 17.189
222 HB3 CYS 30 HB3 CYS 30 23.224 24.898 16.175
223 H VAL 31 H VAL 31 23.326 21.898 15.467
224 HA VAL 31 HA VAL 31 26.239 21.205 15.547
225 HB VAL 31 HB VAL 31 25.604 19.059 14.571
226 HG11 VAL 31 HG11 VAL 31 24.237 19.559 17.229
227 HG12 VAL 31 HG12 VAL 31 24.846 18.008 16.595
228 HG13 VAL 31 HG13 VAL 31 25.985 19.315 16.947
229 HG21 VAL 31 HG21 VAL 31 22.722 19.706 15.251
230 HG22 VAL 31 HG22 VAL 31 23.401 19.636 13.597
231 HG23 VAL 31 HG23 VAL 31 23.383 18.195 14.582
232 HA PRO 32 HA PRO 32 26.329 22.422 11.222
233 HB2 PRO 32 HB2 PRO 32 28.721 21.393 10.425
234 HB3 PRO 32 HB3 PRO 32 28.565 22.823 11.477
235 HG2 PRO 32 HG2 PRO 32 29.177 19.979 12.282
236 HG3 PRO 32 HG3 PRO 32 29.889 21.514 12.880
237 HD2 PRO 32 HD2 PRO 32 27.890 20.106 14.190
238 HD3 PRO 32 HD3 PRO 32 28.147 21.871 14.351
239 H TYR 33 H TYR 33 24.533 21.280 10.716
240 HA TYR 33 HA TYR 33 24.154 18.534 10.428
241 HB2 TYR 33 HB2 TYR 33 22.148 19.144 9.180
242 HB3 TYR 33 HB3 TYR 33 22.363 19.980 10.703
243 HD1 TYR 33 HD1 TYR 33 22.365 20.379 7.015
244 HD2 TYR 33 HD2 TYR 33 22.720 22.352 10.824
245 HE1 TYR 33 HE1 TYR 33 21.938 22.578 5.906
246 HE2 TYR 33 HE2 TYR 33 22.216 24.567 9.715
247 HH TYR 33 HH TYR 33 21.711 25.643 7.741
Start of MODEL 7
1 H1 GLY 1 H1 GLY 1 13.914 13.634 23.224
2 H2 GLY 1 H2 GLY 1 12.929 14.700 23.994
3 H3 GLY 1 H3 GLY 1 13.103 14.767 22.364
4 HA2 GLY 1 HA2 GLY 1 12.020 12.702 22.037
5 HA3 GLY 1 HA3 GLY 1 11.941 12.477 23.789
6 H SER 2 H SER 2 11.331 15.688 22.382
7 HA SER 2 HA SER 2 9.610 17.067 22.679
8 HB2 SER 2 HB2 SER 2 7.955 14.711 21.717
9 HB3 SER 2 HB3 SER 2 7.448 16.408 21.729
10 HG SER 2 HG SER 2 8.204 16.113 19.744
11 H ALA 3 H ALA 3 10.378 15.735 25.182
12 HA ALA 3 HA ALA 3 7.860 15.117 26.556
13 HB1 ALA 3 HB1 ALA 3 10.013 13.944 27.072
14 HB2 ALA 3 HB2 ALA 3 10.619 15.459 27.767
15 HB3 ALA 3 HB3 ALA 3 9.216 14.662 28.475
16 H PHE 4 H PHE 4 10.220 17.815 26.554
17 HA PHE 4 HA PHE 4 7.963 19.628 26.907
18 HB2 PHE 4 HB2 PHE 4 8.936 20.940 28.732
19 HB3 PHE 4 HB3 PHE 4 8.444 19.333 29.219
20 HD1 PHE 4 HD1 PHE 4 11.384 21.522 28.559
21 HD2 PHE 4 HD2 PHE 4 10.032 17.709 30.062
22 HE1 PHE 4 HE1 PHE 4 13.596 21.148 29.614
23 HE2 PHE 4 HE2 PHE 4 12.249 17.346 31.124
24 HZ PHE 4 HZ PHE 4 14.029 19.067 30.907
25 H CYS 5 H CYS 5 11.291 19.115 25.848
26 HA CYS 5 HA CYS 5 11.529 21.893 24.886
27 HB2 CYS 5 HB2 CYS 5 13.461 20.555 25.791
28 HB3 CYS 5 HB3 CYS 5 13.338 19.533 24.346
29 H ASN 6 H ASN 6 10.769 22.575 22.945
30 HA ASN 6 HA ASN 6 9.963 20.641 20.845
31 HB2 ASN 6 HB2 ASN 6 9.893 23.690 21.017
32 HB3 ASN 6 HB3 ASN 6 9.557 22.798 19.542
33 HD21 ASN 6 HD22 ASN 6 7.506 23.976 19.659
34 HD22 ASN 6 HD21 ASN 6 6.211 23.330 20.665
35 H LEU 7 H LEU 7 11.618 19.713 19.717
36 HA LEU 7 HA LEU 7 14.247 20.768 19.513
37 HB2 LEU 7 HB2 LEU 7 13.897 18.483 18.985
38 HB3 LEU 7 HB3 LEU 7 12.750 18.851 17.700
39 HG LEU 7 HG LEU 7 15.573 19.959 17.398
40 HD11 LEU 7 HD11 LEU 7 15.946 17.621 18.141
41 HD12 LEU 7 HD12 LEU 7 14.732 17.048 16.987
42 HD13 LEU 7 HD13 LEU 7 16.229 17.765 16.390
43 HD21 LEU 7 HD21 LEU 7 13.839 20.378 15.619
44 HD22 LEU 7 HD22 LEU 7 15.201 19.429 15.049
45 HD23 LEU 7 HD23 LEU 7 13.662 18.629 15.421
46 H ARG 8 H ARG 8 11.436 21.425 17.367
47 HA ARG 8 HA ARG 8 12.817 22.840 15.386
48 HB2 ARG 8 HB2 ARG 8 10.195 22.159 15.849
49 HB3 ARG 8 HB3 ARG 8 10.122 23.896 16.074
50 HG2 ARG 8 HG2 ARG 8 11.083 22.375 13.619
51 HG3 ARG 8 HG3 ARG 8 9.577 23.276 13.801
52 HD2 ARG 8 HD2 ARG 8 11.107 25.324 14.225
53 HD3 ARG 8 HD3 ARG 8 12.405 24.345 13.519
54 HE ARG 8 HE ARG 8 10.152 25.628 12.170
55 HH11 ARG 8 HH11 ARG 8 12.563 23.052 11.571
56 HH12 ARG 8 HH12 ARG 8 12.026 22.952 9.913
57 HH21 ARG 8 HH21 ARG 8 9.762 25.532 10.175
58 HH22 ARG 8 HH22 ARG 8 10.581 24.426 9.073
59 H ARG 9 H ARG 9 11.969 24.051 18.607
60 HA ARG 9 HA ARG 9 12.611 26.851 17.857
61 HB2 ARG 9 HB2 ARG 9 11.805 25.578 20.498
62 HB3 ARG 9 HB3 ARG 9 12.288 27.271 20.310
63 HG2 ARG 9 HG2 ARG 9 10.511 27.468 18.472
64 HG3 ARG 9 HG3 ARG 9 9.934 25.875 18.967
65 HD2 ARG 9 HD2 ARG 9 8.568 27.544 20.027
66 HD3 ARG 9 HD3 ARG 9 9.543 26.772 21.287
67 HE ARG 9 HE ARG 9 11.128 28.847 20.804
68 HH11 ARG 9 HH11 ARG 9 7.619 29.028 21.157
69 HH12 ARG 9 HH12 ARG 9 7.676 30.782 21.182
70 HH21 ARG 9 HH21 ARG 9 11.134 30.934 21.258
71 HH22 ARG 9 HH22 ARG 9 9.643 31.802 21.550
72 H CYS 10 H CYS 10 14.279 24.170 19.470
73 HA CYS 10 HA CYS 10 16.722 25.720 19.930
74 HB2 CYS 10 HB2 CYS 10 16.357 23.665 21.131
75 HB3 CYS 10 HB3 CYS 10 16.115 22.772 19.629
76 H GLU 11 H GLU 11 15.459 23.665 17.276
77 HA GLU 11 HA GLU 11 17.520 23.699 15.453
78 HB2 GLU 11 HB2 GLU 11 15.338 22.443 15.402
79 HB3 GLU 11 HB3 GLU 11 14.627 23.893 14.687
80 HG2 GLU 11 HG2 GLU 11 16.822 23.407 13.099
81 HG3 GLU 11 HG3 GLU 11 16.334 21.788 13.565
82 H LEU 12 H LEU 12 14.800 26.037 15.461
83 HA LEU 12 HA LEU 12 15.950 27.673 13.462
84 HB2 LEU 12 HB2 LEU 12 13.800 27.918 15.542
85 HB3 LEU 12 HB3 LEU 12 14.227 29.373 14.621
86 HG LEU 12 HG LEU 12 13.495 26.736 13.272
87 HD11 LEU 12 HD11 LEU 12 11.604 27.560 14.652
88 HD12 LEU 12 HD12 LEU 12 11.739 29.158 13.892
89 HD13 LEU 12 HD13 LEU 12 11.269 27.748 12.921
90 HD21 LEU 12 HD21 LEU 12 14.733 28.398 11.846
91 HD22 LEU 12 HD22 LEU 12 13.053 28.200 11.328
92 HD23 LEU 12 HD23 LEU 12 13.529 29.627 12.267
93 H SER 13 H SER 13 16.142 27.983 17.019
94 HA SER 13 HA SER 13 17.573 30.480 17.033
95 HB2 SER 13 HB2 SER 13 17.711 28.233 19.076
96 HB3 SER 13 HB3 SER 13 18.082 29.948 19.309
97 HG SER 13 HG SER 13 15.629 28.625 19.058
98 H CYS 14 H CYS 14 18.622 27.175 16.555
99 HA CYS 14 HA CYS 14 21.496 27.740 16.556
100 HB2 CYS 14 HB2 CYS 14 19.682 25.403 15.951
101 HB3 CYS 14 HB3 CYS 14 21.402 25.339 15.672
102 H ARG 15 H ARG 15 18.939 27.792 14.123
103 HA ARG 15 HA ARG 15 20.774 27.494 11.864
104 HB2 ARG 15 HB2 ARG 15 17.982 28.279 12.409
105 HB3 ARG 15 HB3 ARG 15 18.571 28.407 10.739
106 HG2 ARG 15 HG2 ARG 15 19.104 26.060 10.599
107 HG3 ARG 15 HG3 ARG 15 18.811 25.793 12.301
108 HD2 ARG 15 HD2 ARG 15 16.993 24.959 10.767
109 HD3 ARG 15 HD3 ARG 15 16.415 26.065 12.008
110 HE ARG 15 HE ARG 15 17.019 27.617 9.690
111 HH11 ARG 15 HH11 ARG 15 14.596 25.130 10.491
112 HH12 ARG 15 HH12 ARG 15 13.475 25.887 9.341
113 HH21 ARG 15 HH21 ARG 15 15.462 28.460 8.493
114 HH22 ARG 15 HH22 ARG 15 13.928 27.580 8.258
115 H SER 16 H SER 16 19.669 30.195 13.770
116 HA SER 16 HA SER 16 20.401 32.504 12.365
117 HB2 SER 16 HB2 SER 16 21.111 31.714 15.225
118 HB3 SER 16 HB3 SER 16 21.046 33.378 14.590
119 HG SER 16 HG SER 16 19.186 32.703 15.766
120 H LEU 17 H LEU 17 22.379 29.848 12.861
121 HA LEU 17 HA LEU 17 24.973 31.262 13.065
122 HB2 LEU 17 HB2 LEU 17 24.352 28.430 13.894
123 HB3 LEU 17 HB3 LEU 17 25.599 29.496 14.511
124 HG LEU 17 HG LEU 17 22.582 29.709 15.130
125 HD11 LEU 17 HD11 LEU 17 24.982 28.842 16.810
126 HD12 LEU 17 HD12 LEU 17 23.303 28.980 17.368
127 HD13 LEU 17 HD13 LEU 17 23.738 27.761 16.154
128 HD21 LEU 17 HD21 LEU 17 24.976 31.206 16.296
129 HD22 LEU 17 HD22 LEU 17 23.779 31.933 15.224
130 HD23 LEU 17 HD23 LEU 17 23.289 31.346 16.814
131 H GLY 18 H GLY 18 23.137 29.552 10.810
132 HA2 GLY 18 HA2 GLY 18 23.648 28.416 8.878
133 HA3 GLY 18 HA3 GLY 18 25.371 28.681 9.151
134 H LEU 19 H LEU 19 23.289 27.086 11.522
135 HA LEU 19 HA LEU 19 24.582 24.422 11.030
136 HB2 LEU 19 HB2 LEU 19 23.732 25.610 13.703
137 HB3 LEU 19 HB3 LEU 19 24.606 24.121 13.450
138 HG LEU 19 HG LEU 19 25.703 26.918 12.985
139 HD11 LEU 19 HD11 LEU 19 27.129 26.408 14.919
140 HD12 LEU 19 HD12 LEU 19 25.419 26.370 15.348
141 HD13 LEU 19 HD13 LEU 19 26.312 24.845 15.125
142 HD21 LEU 19 HD21 LEU 19 26.775 25.275 11.454
143 HD22 LEU 19 HD22 LEU 19 27.891 25.791 12.718
144 HD23 LEU 19 HD23 LEU 19 27.100 24.207 12.836
145 H LEU 20 H LEU 20 23.281 22.761 12.416
146 HA LEU 20 HA LEU 20 20.338 23.084 12.101
147 HB2 LEU 20 HB2 LEU 20 21.183 20.987 11.205
148 HB3 LEU 20 HB3 LEU 20 22.085 20.658 12.699
149 HG LEU 20 HG LEU 20 19.954 20.375 13.925
150 HD11 LEU 20 HD11 LEU 20 17.823 20.249 12.686
151 HD12 LEU 20 HD12 LEU 20 18.499 21.867 12.452
152 HD13 LEU 20 HD13 LEU 20 18.647 20.666 11.170
153 HD21 LEU 20 HD21 LEU 20 19.226 18.325 13.018
154 HD22 LEU 20 HD22 LEU 20 19.929 18.671 11.452
155 HD23 LEU 20 HD23 LEU 20 20.998 18.416 12.860
156 H GLY 21 H GLY 21 19.162 22.336 14.104
157 HA2 GLY 21 HA2 GLY 21 20.696 22.492 16.619
158 HA3 GLY 21 HA3 GLY 21 19.199 23.382 16.583
159 H LYS 22 H LYS 22 19.988 21.161 18.233
160 HA LYS 22 HA LYS 22 17.903 19.111 17.706
161 HB2 LYS 22 HB2 LYS 22 20.866 18.744 18.377
162 HB3 LYS 22 HB3 LYS 22 19.684 17.471 18.582
163 HG2 LYS 22 HG2 LYS 22 20.506 18.734 15.939
164 HG3 LYS 22 HG3 LYS 22 20.966 17.154 16.572
165 HD2 LYS 22 HD2 LYS 22 18.329 16.749 16.622
166 HD3 LYS 22 HD3 LYS 22 18.332 18.062 15.425
167 HE2 LYS 22 HE2 LYS 22 20.093 16.737 14.156
168 HE3 LYS 22 HE3 LYS 22 19.855 15.411 15.300
169 HZ1 LYS 22 HZ1 LYS 22 17.532 15.286 14.585
170 HZ2 LYS 22 HZ2 LYS 22 17.698 16.546 13.582
171 HZ3 LYS 22 HZ3 LYS 22 18.507 15.155 13.262
172 H CYS 23 H CYS 23 16.684 18.895 19.522
173 HA CYS 23 HA CYS 23 17.953 19.304 22.168
174 HB2 CYS 23 HB2 CYS 23 16.795 21.362 21.549
175 HB3 CYS 23 HB3 CYS 23 15.297 20.485 21.400
176 H ILE 24 H ILE 24 17.931 17.019 21.189
177 HA ILE 24 HA ILE 24 15.620 15.313 21.372
178 HB ILE 24 HB ILE 24 18.569 14.561 21.414
179 HG12 ILE 24 HG12 ILE 24 16.820 15.245 19.007
180 HG13 ILE 24 HG13 ILE 24 18.278 16.094 19.550
181 HG21 ILE 24 HG21 ILE 24 17.805 12.455 20.420
182 HG22 ILE 24 HG22 ILE 24 16.862 12.744 21.875
183 HG23 ILE 24 HG23 ILE 24 16.153 13.079 20.285
184 HD11 ILE 24 HD11 ILE 24 19.629 14.065 19.053
185 HD12 ILE 24 HD12 ILE 24 18.170 13.324 18.325
186 HD13 ILE 24 HD13 ILE 24 18.855 14.803 17.641
187 H GLY 25 H GLY 25 18.490 15.839 23.505
188 HA2 GLY 25 HA2 GLY 25 17.583 13.958 25.530
189 HA3 GLY 25 HA3 GLY 25 18.926 15.097 25.664
190 H GLU 26 H GLU 26 15.916 16.566 24.838
191 HA GLU 26 HA GLU 26 14.918 18.350 25.731
192 HB2 GLU 26 HB2 GLU 26 15.087 17.217 28.500
193 HB3 GLU 26 HB3 GLU 26 13.888 18.307 27.824
194 HG2 GLU 26 HG2 GLU 26 14.232 15.358 27.145
195 HG3 GLU 26 HG3 GLU 26 13.050 16.026 28.248
196 H GLU 27 H GLU 27 17.851 18.260 25.532
197 HA GLU 27 HA GLU 27 18.183 20.948 26.639
198 HB2 GLU 27 HB2 GLU 27 20.456 20.684 27.310
199 HB3 GLU 27 HB3 GLU 27 19.438 19.629 28.277
200 HG2 GLU 27 HG2 GLU 27 20.232 17.653 27.168
201 HG3 GLU 27 HG3 GLU 27 20.982 18.580 25.867
202 H CYS 28 H CYS 28 19.442 22.327 25.286
203 HA CYS 28 HA CYS 28 19.197 21.437 22.509
204 HB2 CYS 28 HB2 CYS 28 18.169 23.495 23.290
205 HB3 CYS 28 HB3 CYS 28 19.737 24.132 23.757
206 H LYS 29 H LYS 29 20.707 21.372 20.955
207 HA LYS 29 HA LYS 29 23.501 22.286 21.371
208 HB2 LYS 29 HB2 LYS 29 23.355 19.744 21.745
209 HB3 LYS 29 HB3 LYS 29 22.771 19.602 20.086
210 HG2 LYS 29 HG2 LYS 29 24.927 20.918 19.422
211 HG3 LYS 29 HG3 LYS 29 25.483 20.614 21.059
212 HD2 LYS 29 HD2 LYS 29 24.733 18.508 18.982
213 HD3 LYS 29 HD3 LYS 29 26.372 19.090 19.268
214 HE2 LYS 29 HE2 LYS 29 24.628 17.603 21.259
215 HE3 LYS 29 HE3 LYS 29 25.914 16.914 20.274
216 HZ1 LYS 29 HZ1 LYS 29 27.495 18.441 21.419
217 HZ2 LYS 29 HZ2 LYS 29 26.279 18.925 22.427
218 HZ3 LYS 29 HZ3 LYS 29 26.786 17.375 22.416
219 H CYS 30 H CYS 30 24.329 23.255 19.477
220 HA CYS 30 HA CYS 30 22.696 22.983 16.980
221 HB2 CYS 30 HB2 CYS 30 24.773 25.124 17.227
222 HB3 CYS 30 HB3 CYS 30 23.360 25.016 16.159
223 H VAL 31 H VAL 31 23.661 22.371 15.140
224 HA VAL 31 HA VAL 31 26.129 20.765 15.628
225 HB VAL 31 HB VAL 31 23.691 19.616 14.284
226 HG11 VAL 31 HG11 VAL 31 25.878 18.419 14.280
227 HG12 VAL 31 HG12 VAL 31 25.891 18.473 16.060
228 HG13 VAL 31 HG13 VAL 31 24.649 17.542 15.200
229 HG21 VAL 31 HG21 VAL 31 23.023 18.638 16.511
230 HG22 VAL 31 HG22 VAL 31 24.061 19.842 17.289
231 HG23 VAL 31 HG23 VAL 31 22.656 20.356 16.333
232 HA PRO 32 HA PRO 32 27.018 22.280 11.471
233 HB2 PRO 32 HB2 PRO 32 29.276 20.277 11.575
234 HB3 PRO 32 HB3 PRO 32 29.296 22.002 11.104
235 HG2 PRO 32 HG2 PRO 32 30.180 21.228 13.535
236 HG3 PRO 32 HG3 PRO 32 29.139 22.686 13.395
237 HD2 PRO 32 HD2 PRO 32 28.311 19.855 14.138
238 HD3 PRO 32 HD3 PRO 32 27.944 21.406 14.962
239 H TYR 33 H TYR 33 25.012 21.296 10.816
240 HA TYR 33 HA TYR 33 24.295 18.873 9.996
241 HB2 TYR 33 HB2 TYR 33 23.081 21.129 9.883
242 HB3 TYR 33 HB3 TYR 33 23.774 21.339 8.293
243 HD1 TYR 33 HD2 TYR 33 21.803 18.942 10.340
244 HD2 TYR 33 HD1 TYR 33 22.494 20.590 6.434
245 HE1 TYR 33 HE2 TYR 33 19.926 17.538 9.409
246 HE2 TYR 33 HE1 TYR 33 20.595 19.254 5.515
247 HH TYR 33 HH TYR 33 18.893 17.745 5.996
Start of MODEL 8
1 H1 GLY 1 H1 GLY 1 10.365 21.711 32.529
2 H2 GLY 1 H2 GLY 1 9.494 20.357 32.946
3 H3 GLY 1 H3 GLY 1 9.307 21.800 33.758
4 HA2 GLY 1 HA2 GLY 1 8.589 21.292 30.954
5 HA3 GLY 1 HA3 GLY 1 7.451 21.443 32.313
6 H SER 2 H SER 2 6.370 23.314 31.950
7 HA SER 2 HA SER 2 5.844 25.347 31.164
8 HB2 SER 2 HB2 SER 2 8.472 26.196 32.417
9 HB3 SER 2 HB3 SER 2 7.201 27.280 31.837
10 HG SER 2 HG SER 2 6.856 26.983 33.965
11 H ALA 3 H ALA 3 6.830 23.639 29.276
12 HA ALA 3 HA ALA 3 7.716 23.419 27.226
13 HB1 ALA 3 HB1 ALA 3 5.642 24.648 26.888
14 HB2 ALA 3 HB2 ALA 3 6.505 26.196 27.010
15 HB3 ALA 3 HB3 ALA 3 6.831 25.092 25.654
16 H PHE 4 H PHE 4 9.902 23.908 28.790
17 HA PHE 4 HA PHE 4 11.347 26.281 28.157
18 HB2 PHE 4 HB2 PHE 4 11.627 24.955 30.200
19 HB3 PHE 4 HB3 PHE 4 12.285 23.615 29.272
20 HD1 PHE 4 HD1 PHE 4 12.878 27.224 30.137
21 HD2 PHE 4 HD2 PHE 4 14.633 23.492 28.849
22 HE1 PHE 4 HE1 PHE 4 15.153 28.183 30.436
23 HE2 PHE 4 HE2 PHE 4 16.901 24.444 29.180
24 HZ PHE 4 HZ PHE 4 17.158 26.790 29.966
25 H CYS 5 H CYS 5 11.311 23.164 26.480
26 HA CYS 5 HA CYS 5 12.791 24.382 24.281
27 HB2 CYS 5 HB2 CYS 5 14.540 23.336 25.899
28 HB3 CYS 5 HB3 CYS 5 13.868 21.787 25.420
29 H ASN 6 H ASN 6 12.106 23.646 22.347
30 HA ASN 6 HA ASN 6 11.433 20.761 22.091
31 HB2 ASN 6 HB2 ASN 6 9.291 22.154 21.723
32 HB3 ASN 6 HB3 ASN 6 10.082 22.825 20.284
33 HD21 ASN 6 HD22 ASN 6 8.585 19.898 21.642
34 HD22 ASN 6 HD21 ASN 6 8.927 18.915 20.227
35 H LEU 7 H LEU 7 12.454 19.766 20.257
36 HA LEU 7 HA LEU 7 14.807 20.944 19.258
37 HB2 LEU 7 HB2 LEU 7 14.248 18.536 19.254
38 HB3 LEU 7 HB3 LEU 7 13.151 18.795 17.898
39 HG LEU 7 HG LEU 7 16.011 19.789 17.647
40 HD11 LEU 7 HD11 LEU 7 16.667 17.481 16.868
41 HD12 LEU 7 HD12 LEU 7 16.251 17.501 18.596
42 HD13 LEU 7 HD13 LEU 7 15.100 16.881 17.402
43 HD21 LEU 7 HD21 LEU 7 15.740 19.070 15.314
44 HD22 LEU 7 HD22 LEU 7 14.180 18.314 15.687
45 HD23 LEU 7 HD23 LEU 7 14.351 20.071 15.728
46 H ARG 8 H ARG 8 11.516 21.228 17.939
47 HA ARG 8 HA ARG 8 12.057 22.440 15.464
48 HB2 ARG 8 HB2 ARG 8 9.808 21.745 16.467
49 HB3 ARG 8 HB3 ARG 8 9.870 23.185 17.474
50 HG2 ARG 8 HG2 ARG 8 8.439 23.633 15.632
51 HG3 ARG 8 HG3 ARG 8 9.883 24.605 15.362
52 HD2 ARG 8 HD2 ARG 8 9.765 21.831 14.232
53 HD3 ARG 8 HD3 ARG 8 8.723 23.058 13.500
54 HE ARG 8 HE ARG 8 10.684 24.402 12.916
55 HH11 ARG 8 HH11 ARG 8 11.320 20.931 13.279
56 HH12 ARG 8 HH12 ARG 8 13.007 21.145 12.884
57 HH21 ARG 8 HH21 ARG 8 12.707 24.434 11.968
58 HH22 ARG 8 HH22 ARG 8 13.668 22.975 11.934
59 H ARG 9 H ARG 9 12.069 23.905 18.640
60 HA ARG 9 HA ARG 9 12.539 26.623 17.512
61 HB2 ARG 9 HB2 ARG 9 10.569 26.101 18.916
62 HB3 ARG 9 HB3 ARG 9 11.636 25.731 20.271
63 HG2 ARG 9 HG2 ARG 9 12.490 28.116 20.169
64 HG3 ARG 9 HG3 ARG 9 11.380 28.414 18.824
65 HD2 ARG 9 HD2 ARG 9 10.240 29.245 20.710
66 HD3 ARG 9 HD3 ARG 9 9.477 27.701 20.382
67 HE ARG 9 HE ARG 9 10.581 26.733 22.309
68 HH11 ARG 9 HH11 ARG 9 11.124 30.238 22.182
69 HH12 ARG 9 HH12 ARG 9 11.660 30.244 23.843
70 HH21 ARG 9 HH21 ARG 9 11.255 26.862 24.277
71 HH22 ARG 9 HH22 ARG 9 11.813 28.373 24.998
72 H CYS 10 H CYS 10 14.152 24.117 19.358
73 HA CYS 10 HA CYS 10 16.587 25.628 19.864
74 HB2 CYS 10 HB2 CYS 10 16.226 23.532 20.965
75 HB3 CYS 10 HB3 CYS 10 15.936 22.716 19.421
76 H GLU 11 H GLU 11 15.320 23.721 17.038
77 HA GLU 11 HA GLU 11 17.536 23.890 15.435
78 HB2 GLU 11 HB2 GLU 11 14.647 23.655 14.800
79 HB3 GLU 11 HB3 GLU 11 15.704 24.263 13.526
80 HG2 GLU 11 HG2 GLU 11 17.210 22.283 13.885
81 HG3 GLU 11 HG3 GLU 11 15.942 21.608 14.934
82 H LEU 12 H LEU 12 14.849 26.268 15.483
83 HA LEU 12 HA LEU 12 16.159 28.236 13.885
84 HB2 LEU 12 HB2 LEU 12 13.830 28.101 15.778
85 HB3 LEU 12 HB3 LEU 12 14.301 29.686 15.133
86 HG LEU 12 HG LEU 12 13.825 27.290 13.307
87 HD11 LEU 12 HD11 LEU 12 11.563 28.206 12.919
88 HD12 LEU 12 HD12 LEU 12 11.769 27.672 14.590
89 HD13 LEU 12 HD13 LEU 12 11.822 29.409 14.204
90 HD21 LEU 12 HD21 LEU 12 13.746 30.315 12.842
91 HD22 LEU 12 HD22 LEU 12 15.039 29.218 12.306
92 HD23 LEU 12 HD23 LEU 12 13.421 29.065 11.626
93 H SER 13 H SER 13 16.293 27.753 17.407
94 HA SER 13 HA SER 13 17.745 30.208 17.955
95 HB2 SER 13 HB2 SER 13 17.653 27.593 19.513
96 HB3 SER 13 HB3 SER 13 18.295 29.133 20.097
97 HG SER 13 HG SER 13 15.623 28.443 19.467
98 H CYS 14 H CYS 14 18.689 27.294 16.413
99 HA CYS 14 HA CYS 14 21.601 27.799 16.784
100 HB2 CYS 14 HB2 CYS 14 19.873 25.454 16.012
101 HB3 CYS 14 HB3 CYS 14 21.616 25.464 15.771
102 H ARG 15 H ARG 15 19.095 27.675 14.266
103 HA ARG 15 HA ARG 15 20.864 27.205 12.050
104 HB2 ARG 15 HB2 ARG 15 18.161 28.284 12.559
105 HB3 ARG 15 HB3 ARG 15 18.754 28.244 10.871
106 HG2 ARG 15 HG2 ARG 15 19.087 25.900 10.854
107 HG3 ARG 15 HG3 ARG 15 18.770 25.710 12.568
108 HD2 ARG 15 HD2 ARG 15 16.405 26.325 12.234
109 HD3 ARG 15 HD3 ARG 15 16.712 26.855 10.585
110 HE ARG 15 HE ARG 15 16.272 24.109 11.482
111 HH11 ARG 15 HH12 ARG 15 17.429 26.015 8.714
112 HH12 ARG 15 HH11 ARG 15 17.529 24.538 7.769
113 HH21 ARG 15 HH21 ARG 15 16.096 22.559 10.130
114 HH22 ARG 15 HH22 ARG 15 16.495 22.766 8.418
115 H SER 16 H SER 16 19.643 30.169 13.480
116 HA SER 16 HA SER 16 20.526 32.221 11.819
117 HB2 SER 16 HB2 SER 16 20.562 31.841 14.846
118 HB3 SER 16 HB3 SER 16 20.758 33.428 14.045
119 HG SER 16 HG SER 16 18.624 33.332 14.293
120 H LEU 17 H LEU 17 22.460 29.894 13.366
121 HA LEU 17 HA LEU 17 24.988 31.409 13.441
122 HB2 LEU 17 HB2 LEU 17 24.542 28.575 14.340
123 HB3 LEU 17 HB3 LEU 17 25.666 29.761 14.960
124 HG LEU 17 HG LEU 17 22.616 29.775 15.459
125 HD11 LEU 17 HD11 LEU 17 23.865 27.966 16.624
126 HD12 LEU 17 HD12 LEU 17 24.996 29.172 17.272
127 HD13 LEU 17 HD13 LEU 17 23.283 29.205 17.753
128 HD21 LEU 17 HD21 LEU 17 23.542 32.071 15.469
129 HD22 LEU 17 HD22 LEU 17 23.133 31.527 17.097
130 HD23 LEU 17 HD23 LEU 17 24.828 31.545 16.568
131 H GLY 18 H GLY 18 23.326 29.643 11.157
132 HA2 GLY 18 HA2 GLY 18 23.964 28.673 9.172
133 HA3 GLY 18 HA3 GLY 18 25.666 28.812 9.623
134 H LEU 19 H LEU 19 23.262 27.232 11.683
135 HA LEU 19 HA LEU 19 24.568 24.567 11.240
136 HB2 LEU 19 HB2 LEU 19 23.636 25.763 13.870
137 HB3 LEU 19 HB3 LEU 19 24.462 24.249 13.665
138 HG LEU 19 HG LEU 19 25.696 26.975 13.152
139 HD11 LEU 19 HD11 LEU 19 25.250 26.453 15.544
140 HD12 LEU 19 HD12 LEU 19 26.214 24.963 15.374
141 HD13 LEU 19 HD13 LEU 19 26.971 26.553 15.164
142 HD21 LEU 19 HD21 LEU 19 26.741 25.215 11.734
143 HD22 LEU 19 HD22 LEU 19 27.830 25.739 13.019
144 HD23 LEU 19 HD23 LEU 19 26.965 24.196 13.174
145 H LEU 20 H LEU 20 23.225 22.921 12.628
146 HA LEU 20 HA LEU 20 20.268 23.151 12.266
147 HB2 LEU 20 HB2 LEU 20 21.575 20.996 11.534
148 HB3 LEU 20 HB3 LEU 20 21.936 20.789 13.230
149 HG LEU 20 HG LEU 20 19.442 20.618 13.676
150 HD11 LEU 20 HD11 LEU 20 19.363 20.613 10.618
151 HD12 LEU 20 HD12 LEU 20 18.009 20.172 11.680
152 HD13 LEU 20 HD13 LEU 20 18.605 21.833 11.662
153 HD21 LEU 20 HD21 LEU 20 19.257 18.368 12.736
154 HD22 LEU 20 HD22 LEU 20 20.599 18.699 11.617
155 HD23 LEU 20 HD23 LEU 20 20.898 18.636 13.362
156 H GLY 21 H GLY 21 19.040 22.557 14.310
157 HA2 GLY 21 HA2 GLY 21 20.645 22.623 16.826
158 HA3 GLY 21 HA3 GLY 21 19.042 23.309 16.779
159 H LYS 22 H LYS 22 20.359 20.912 18.147
160 HA LYS 22 HA LYS 22 18.057 19.083 17.728
161 HB2 LYS 22 HB2 LYS 22 20.935 18.194 18.074
162 HB3 LYS 22 HB3 LYS 22 19.523 17.160 18.345
163 HG2 LYS 22 HG2 LYS 22 18.788 17.774 15.954
164 HG3 LYS 22 HG3 LYS 22 20.414 18.423 15.727
165 HD2 LYS 22 HD2 LYS 22 21.374 16.183 16.257
166 HD3 LYS 22 HD3 LYS 22 19.747 15.581 16.615
167 HE2 LYS 22 HE2 LYS 22 19.202 16.415 14.168
168 HE3 LYS 22 HE3 LYS 22 20.962 16.302 13.933
169 HZ1 LYS 22 HZ1 LYS 22 20.784 13.936 14.611
170 HZ2 LYS 22 HZ2 LYS 22 19.170 14.131 14.867
171 HZ3 LYS 22 HZ3 LYS 22 19.771 14.234 13.350
172 H CYS 23 H CYS 23 16.857 19.577 19.401
173 HA CYS 23 HA CYS 23 18.003 19.400 22.153
174 HB2 CYS 23 HB2 CYS 23 17.167 21.607 21.749
175 HB3 CYS 23 HB3 CYS 23 15.630 20.981 21.178
176 H ILE 24 H ILE 24 17.935 17.192 21.950
177 HA ILE 24 HA ILE 24 15.353 15.780 21.848
178 HB ILE 24 HB ILE 24 18.136 14.677 22.384
179 HG12 ILE 24 HG12 ILE 24 16.705 15.092 19.702
180 HG13 ILE 24 HG13 ILE 24 18.196 15.876 20.228
181 HG21 ILE 24 HG21 ILE 24 15.611 13.357 21.266
182 HG22 ILE 24 HG22 ILE 24 17.139 12.553 21.681
183 HG23 ILE 24 HG23 ILE 24 16.143 13.229 22.955
184 HD11 ILE 24 HD11 ILE 24 17.876 12.966 19.522
185 HD12 ILE 24 HD12 ILE 24 18.797 14.208 18.672
186 HD13 ILE 24 HD13 ILE 24 19.338 13.655 20.276
187 H GLY 25 H GLY 25 14.148 15.439 23.645
188 HA2 GLY 25 HA2 GLY 25 13.576 15.328 25.917
189 HA3 GLY 25 HA3 GLY 25 15.272 15.422 26.377
190 H GLU 26 H GLU 26 16.142 17.431 26.905
191 HA GLU 26 HA GLU 26 14.438 19.867 26.538
192 HB2 GLU 26 HB2 GLU 26 14.083 18.531 28.654
193 HB3 GLU 26 HB3 GLU 26 15.711 18.988 29.156
194 HG2 GLU 26 HG3 GLU 26 15.077 21.181 29.598
195 HG3 GLU 26 HG2 GLU 26 13.852 21.203 28.313
196 H GLU 27 H GLU 27 17.554 18.674 26.166
197 HA GLU 27 HA GLU 27 18.851 21.314 26.717
198 HB2 GLU 27 HB2 GLU 27 19.654 19.438 28.048
199 HB3 GLU 27 HB3 GLU 27 20.042 18.528 26.587
200 HG2 GLU 27 HG2 GLU 27 21.685 20.237 25.919
201 HG3 GLU 27 HG3 GLU 27 21.230 21.232 27.308
202 H CYS 28 H CYS 28 19.098 22.538 24.974
203 HA CYS 28 HA CYS 28 19.202 21.488 22.278
204 HB2 CYS 28 HB2 CYS 28 18.042 23.565 22.963
205 HB3 CYS 28 HB3 CYS 28 19.587 24.275 23.399
206 H LYS 29 H LYS 29 20.873 20.655 21.317
207 HA LYS 29 HA LYS 29 23.605 21.865 21.528
208 HB2 LYS 29 HB2 LYS 29 23.111 19.229 21.593
209 HB3 LYS 29 HB3 LYS 29 22.882 19.442 19.853
210 HG2 LYS 29 HG2 LYS 29 25.253 20.654 20.029
211 HG3 LYS 29 HG3 LYS 29 25.393 19.731 21.521
212 HD2 LYS 29 HD2 LYS 29 24.866 18.634 18.725
213 HD3 LYS 29 HD3 LYS 29 26.426 18.641 19.511
214 HE2 LYS 29 HE2 LYS 29 24.004 17.126 20.605
215 HE3 LYS 29 HE3 LYS 29 25.159 16.447 19.455
216 HZ1 LYS 29 HZ1 LYS 29 25.781 17.281 22.240
217 HZ2 LYS 29 HZ2 LYS 29 25.863 15.785 21.598
218 HZ3 LYS 29 HZ3 LYS 29 26.935 16.975 21.155
219 H CYS 30 H CYS 30 24.553 22.601 19.460
220 HA CYS 30 HA CYS 30 22.671 22.623 17.127
221 HB2 CYS 30 HB2 CYS 30 24.918 24.608 17.312
222 HB3 CYS 30 HB3 CYS 30 23.486 24.627 16.245
223 H VAL 31 H VAL 31 23.751 22.383 15.057
224 HA VAL 31 HA VAL 31 26.094 20.557 15.285
225 HB VAL 31 HB VAL 31 23.794 19.632 13.598
226 HG11 VAL 31 HG11 VAL 31 25.837 18.287 15.419
227 HG12 VAL 31 HG12 VAL 31 24.696 17.458 14.343
228 HG13 VAL 31 HG13 VAL 31 25.960 18.458 13.648
229 HG21 VAL 31 HG21 VAL 31 22.820 18.341 15.468
230 HG22 VAL 31 HG22 VAL 31 23.812 19.251 16.624
231 HG23 VAL 31 HG23 VAL 31 22.549 20.075 15.674
232 HA PRO 32 HA PRO 32 27.068 22.516 11.335
233 HB2 PRO 32 HB2 PRO 32 28.940 20.202 10.994
234 HB3 PRO 32 HB3 PRO 32 29.261 21.955 10.792
235 HG2 PRO 32 HG2 PRO 32 30.089 20.670 13.018
236 HG3 PRO 32 HG3 PRO 32 29.291 22.276 13.165
237 HD2 PRO 32 HD2 PRO 32 28.050 19.529 13.513
238 HD3 PRO 32 HD3 PRO 32 27.953 20.969 14.575
239 H TYR 33 H TYR 33 24.764 20.936 11.271
240 HA TYR 33 HA TYR 33 23.285 19.766 10.009
241 HB2 TYR 33 HB2 TYR 33 24.646 21.671 8.367
242 HB3 TYR 33 HB3 TYR 33 24.358 20.283 7.367
243 HD1 TYR 33 HD2 TYR 33 22.423 22.128 9.977
244 HD2 TYR 33 HD1 TYR 33 22.568 20.587 5.968
245 HE1 TYR 33 HE2 TYR 33 20.167 23.164 9.483
246 HE2 TYR 33 HE1 TYR 33 20.357 21.602 5.472
247 HH TYR 33 HH TYR 33 18.783 23.017 6.177
Start of MODEL 9
1 H1 GLY 1 H1 GLY 1 11.474 15.496 25.306
2 H2 GLY 1 H2 GLY 1 12.212 16.083 23.971
3 H3 GLY 1 H3 GLY 1 10.631 15.613 23.890
4 HA2 GLY 1 HA2 GLY 1 11.688 17.864 25.486
5 HA3 GLY 1 HA3 GLY 1 10.850 18.025 23.925
6 H SER 2 H SER 2 10.507 17.728 27.312
7 HA SER 2 HA SER 2 7.520 17.680 27.136
8 HB2 SER 2 HB2 SER 2 9.220 15.710 28.711
9 HB3 SER 2 HB3 SER 2 7.473 15.897 28.899
10 HG SER 2 HG SER 2 7.232 15.366 26.720
11 H ALA 3 H ALA 3 10.233 19.113 28.596
12 HA ALA 3 HA ALA 3 8.622 19.921 31.003
13 HB1 ALA 3 HB1 ALA 3 10.499 18.452 31.591
14 HB2 ALA 3 HB2 ALA 3 11.631 19.540 30.754
15 HB3 ALA 3 HB3 ALA 3 10.753 20.100 32.193
16 H PHE 4 H PHE 4 10.956 20.996 28.532
17 HA PHE 4 HA PHE 4 10.005 23.785 28.829
18 HB2 PHE 4 HB2 PHE 4 11.845 23.248 30.554
19 HB3 PHE 4 HB3 PHE 4 12.941 23.069 29.196
20 HD1 PHE 4 HD1 PHE 4 10.446 25.477 30.675
21 HD2 PHE 4 HD2 PHE 4 14.149 24.997 28.519
22 HE1 PHE 4 HE1 PHE 4 10.831 27.924 30.790
23 HE2 PHE 4 HE2 PHE 4 14.535 27.441 28.642
24 HZ PHE 4 HZ PHE 4 12.871 28.915 29.777
25 H CYS 5 H CYS 5 11.277 21.303 26.792
26 HA CYS 5 HA CYS 5 12.025 23.309 24.706
27 HB2 CYS 5 HB2 CYS 5 13.814 21.844 25.999
28 HB3 CYS 5 HB3 CYS 5 13.254 20.578 24.916
29 H ASN 6 H ASN 6 11.735 22.876 22.612
30 HA ASN 6 HA ASN 6 10.598 20.311 21.649
31 HB2 ASN 6 HB2 ASN 6 8.822 22.150 21.677
32 HB3 ASN 6 HB3 ASN 6 9.825 23.072 20.550
33 HD21 ASN 6 HD22 ASN 6 7.175 22.337 20.071
34 HD22 ASN 6 HD21 ASN 6 7.249 21.361 18.601
35 H LEU 7 H LEU 7 11.948 19.506 19.949
36 HA LEU 7 HA LEU 7 14.441 20.839 19.420
37 HB2 LEU 7 HB2 LEU 7 14.293 18.450 19.152
38 HB3 LEU 7 HB3 LEU 7 13.062 18.603 17.895
39 HG LEU 7 HG LEU 7 15.785 19.915 17.493
40 HD11 LEU 7 HD11 LEU 7 15.086 16.960 17.136
41 HD12 LEU 7 HD12 LEU 7 16.537 17.742 16.505
42 HD13 LEU 7 HD13 LEU 7 16.281 17.618 18.264
43 HD21 LEU 7 HD21 LEU 7 13.991 18.349 15.557
44 HD22 LEU 7 HD22 LEU 7 13.895 20.098 15.718
45 HD23 LEU 7 HD23 LEU 7 15.391 19.356 15.145
46 H ARG 8 H ARG 8 11.311 21.060 17.824
47 HA ARG 8 HA ARG 8 11.817 22.449 15.487
48 HB2 ARG 8 HB2 ARG 8 9.569 21.785 16.485
49 HB3 ARG 8 HB3 ARG 8 9.749 23.083 17.656
50 HG2 ARG 8 HG2 ARG 8 8.303 23.992 16.117
51 HG3 ARG 8 HG3 ARG 8 9.832 24.712 15.621
52 HD2 ARG 8 HD2 ARG 8 8.578 22.209 14.486
53 HD3 ARG 8 HD3 ARG 8 8.392 23.809 13.764
54 HE ARG 8 HE ARG 8 10.723 22.024 13.606
55 HH11 ARG 8 HH21 ARG 8 9.715 25.349 13.038
56 HH12 ARG 8 HH22 ARG 8 11.042 25.638 11.944
57 HH21 ARG 8 HH11 ARG 8 12.514 22.544 12.420
58 HH22 ARG 8 HH12 ARG 8 12.598 24.123 11.652
59 H ARG 9 H ARG 9 11.701 23.879 18.725
60 HA ARG 9 HA ARG 9 12.210 26.581 17.653
61 HB2 ARG 9 HB2 ARG 9 10.465 26.091 19.301
62 HB3 ARG 9 HB3 ARG 9 11.690 25.572 20.475
63 HG2 ARG 9 HG2 ARG 9 12.638 27.835 20.544
64 HG3 ARG 9 HG3 ARG 9 11.557 28.363 19.237
65 HD2 ARG 9 HD2 ARG 9 10.677 29.163 21.314
66 HD3 ARG 9 HD3 ARG 9 9.588 27.934 20.667
67 HE ARG 9 HE ARG 9 11.377 26.583 22.397
68 HH11 ARG 9 HH11 ARG 9 9.062 29.202 22.893
69 HH12 ARG 9 HH12 ARG 9 9.097 28.965 24.622
70 HH21 ARG 9 HH21 ARG 9 10.919 26.082 24.473
71 HH22 ARG 9 HH22 ARG 9 10.287 27.337 25.523
72 H CYS 10 H CYS 10 13.984 24.070 19.366
73 HA CYS 10 HA CYS 10 16.413 25.587 19.786
74 HB2 CYS 10 HB2 CYS 10 16.010 23.464 20.879
75 HB3 CYS 10 HB3 CYS 10 15.879 22.644 19.316
76 H GLU 11 H GLU 11 15.159 23.708 16.917
77 HA GLU 11 HA GLU 11 17.389 23.884 15.291
78 HB2 GLU 11 HB2 GLU 11 14.499 24.090 14.481
79 HB3 GLU 11 HB3 GLU 11 15.846 24.217 13.342
80 HG2 GLU 11 HG2 GLU 11 16.660 22.007 14.106
81 HG3 GLU 11 HG3 GLU 11 15.147 21.819 15.003
82 H LEU 12 H LEU 12 14.988 26.409 15.907
83 HA LEU 12 HA LEU 12 16.177 28.264 14.021
84 HB2 LEU 12 HB2 LEU 12 13.906 28.262 15.990
85 HB3 LEU 12 HB3 LEU 12 14.285 29.718 15.044
86 HG LEU 12 HG LEU 12 13.712 26.976 13.790
87 HD11 LEU 12 HD11 LEU 12 11.772 27.819 15.052
88 HD12 LEU 12 HD12 LEU 12 11.879 29.373 14.191
89 HD13 LEU 12 HD13 LEU 12 11.481 27.880 13.318
90 HD21 LEU 12 HD21 LEU 12 13.840 29.786 12.602
91 HD22 LEU 12 HD22 LEU 12 14.979 28.462 12.271
92 HD23 LEU 12 HD23 LEU 12 13.309 28.335 11.742
93 H SER 13 H SER 13 16.402 27.997 17.603
94 HA SER 13 HA SER 13 18.014 30.374 17.940
95 HB2 SER 13 HB2 SER 13 18.211 27.678 19.346
96 HB3 SER 13 HB3 SER 13 18.994 29.173 19.875
97 HG SER 13 HG SER 13 16.940 30.100 20.206
98 H CYS 14 H CYS 14 18.685 27.236 16.514
99 HA CYS 14 HA CYS 14 21.596 27.600 16.549
100 HB2 CYS 14 HB2 CYS 14 19.677 25.418 15.778
101 HB3 CYS 14 HB3 CYS 14 21.418 25.289 15.578
102 H ARG 15 H ARG 15 19.079 27.922 14.126
103 HA ARG 15 HA ARG 15 20.865 27.465 11.882
104 HB2 ARG 15 HB2 ARG 15 18.146 28.445 12.425
105 HB3 ARG 15 HB3 ARG 15 18.700 28.482 10.723
106 HG2 ARG 15 HG2 ARG 15 19.187 26.128 10.691
107 HG3 ARG 15 HG3 ARG 15 18.849 25.922 12.393
108 HD2 ARG 15 HD2 ARG 15 16.456 26.429 12.001
109 HD3 ARG 15 HD3 ARG 15 16.775 26.769 10.296
110 HE ARG 15 HE ARG 15 16.407 24.163 11.504
111 HH11 ARG 15 HH11 ARG 15 17.863 25.716 8.680
112 HH12 ARG 15 HH12 ARG 15 18.001 24.142 7.887
113 HH21 ARG 15 HH21 ARG 15 16.574 22.367 10.384
114 HH22 ARG 15 HH22 ARG 15 17.323 22.373 8.774
115 H SER 16 H SER 16 19.807 30.362 13.537
116 HA SER 16 HA SER 16 20.769 32.514 12.027
117 HB2 SER 16 HB2 SER 16 21.094 31.757 14.968
118 HB3 SER 16 HB3 SER 16 21.375 33.401 14.323
119 HG SER 16 HG SER 16 19.304 33.080 15.209
120 H LEU 17 H LEU 17 22.534 29.858 13.303
121 HA LEU 17 HA LEU 17 25.175 31.136 13.445
122 HB2 LEU 17 HB2 LEU 17 24.501 28.312 14.212
123 HB3 LEU 17 HB3 LEU 17 25.673 29.395 14.916
124 HG LEU 17 HG LEU 17 22.632 29.550 15.337
125 HD11 LEU 17 HD11 LEU 17 23.838 27.658 16.451
126 HD12 LEU 17 HD12 LEU 17 24.961 28.818 17.181
127 HD13 LEU 17 HD13 LEU 17 23.244 28.856 17.618
128 HD21 LEU 17 HD21 LEU 17 23.697 31.813 15.452
129 HD22 LEU 17 HD22 LEU 17 23.174 31.235 17.036
130 HD23 LEU 17 HD23 LEU 17 24.891 31.173 16.594
131 H GLY 18 H GLY 18 23.467 29.492 11.049
132 HA2 GLY 18 HA2 GLY 18 24.168 28.402 9.116
133 HA3 GLY 18 HA3 GLY 18 25.860 28.583 9.604
134 H LEU 19 H LEU 19 23.479 27.121 11.730
135 HA LEU 19 HA LEU 19 24.621 24.390 11.307
136 HB2 LEU 19 HB2 LEU 19 23.832 25.658 13.958
137 HB3 LEU 19 HB3 LEU 19 24.527 24.073 13.735
138 HG LEU 19 HG LEU 19 25.946 26.703 13.203
139 HD11 LEU 19 HD11 LEU 19 27.276 26.131 15.175
140 HD12 LEU 19 HD12 LEU 19 25.565 26.290 15.581
141 HD13 LEU 19 HD13 LEU 19 26.297 24.672 15.436
142 HD21 LEU 19 HD21 LEU 19 26.831 24.844 11.764
143 HD22 LEU 19 HD22 LEU 19 27.990 25.360 12.987
144 HD23 LEU 19 HD23 LEU 19 27.070 23.864 13.226
145 H LEU 20 H LEU 20 23.166 22.808 12.573
146 HA LEU 20 HA LEU 20 20.245 23.307 12.191
147 HB2 LEU 20 HB2 LEU 20 20.922 21.305 11.065
148 HB3 LEU 20 HB3 LEU 20 21.990 20.847 12.390
149 HG LEU 20 HG LEU 20 19.987 20.362 13.808
150 HD11 LEU 20 HD11 LEU 20 17.796 20.195 12.749
151 HD12 LEU 20 HD12 LEU 20 18.362 21.849 12.478
152 HD13 LEU 20 HD13 LEU 20 18.464 20.660 11.175
153 HD21 LEU 20 HD21 LEU 20 21.113 18.561 12.597
154 HD22 LEU 20 HD22 LEU 20 19.363 18.299 12.653
155 HD23 LEU 20 HD23 LEU 20 20.122 18.887 11.161
156 H GLY 21 H GLY 21 18.976 22.573 14.073
157 HA2 GLY 21 HA2 GLY 21 20.449 22.650 16.685
158 HA3 GLY 21 HA3 GLY 21 18.860 23.347 16.553
159 H LYS 22 H LYS 22 20.088 21.127 18.097
160 HA LYS 22 HA LYS 22 18.052 19.004 17.660
161 HB2 LYS 22 HB2 LYS 22 21.040 18.875 18.098
162 HB3 LYS 22 HB3 LYS 22 20.026 17.512 18.482
163 HG2 LYS 22 HG2 LYS 22 20.264 18.777 15.718
164 HG3 LYS 22 HG3 LYS 22 21.237 17.444 16.299
165 HD2 LYS 22 HD2 LYS 22 18.522 16.653 16.742
166 HD3 LYS 22 HD3 LYS 22 18.584 17.394 15.126
167 HE2 LYS 22 HE2 LYS 22 20.655 15.947 14.711
168 HE3 LYS 22 HE3 LYS 22 20.287 15.121 16.229
169 HZ1 LYS 22 HZ1 LYS 22 18.645 15.177 13.763
170 HZ2 LYS 22 HZ2 LYS 22 19.346 13.883 14.414
171 HZ3 LYS 22 HZ3 LYS 22 18.047 14.574 15.175
172 H CYS 23 H CYS 23 16.729 19.621 19.347
173 HA CYS 23 HA CYS 23 17.910 19.443 22.097
174 HB2 CYS 23 HB2 CYS 23 16.940 21.635 21.697
175 HB3 CYS 23 HB3 CYS 23 15.405 20.900 21.264
176 H ILE 24 H ILE 24 17.964 17.261 21.669
177 HA ILE 24 HA ILE 24 15.753 15.897 20.543
178 HB ILE 24 HB ILE 24 18.194 14.545 21.731
179 HG12 ILE 24 HG12 ILE 24 18.033 16.213 19.195
180 HG13 ILE 24 HG13 ILE 24 19.205 16.374 20.517
181 HG21 ILE 24 HG21 ILE 24 16.486 13.962 19.260
182 HG22 ILE 24 HG22 ILE 24 17.783 12.939 19.927
183 HG23 ILE 24 HG23 ILE 24 16.297 13.166 20.839
184 HD11 ILE 24 HD11 ILE 24 20.064 14.070 19.880
185 HD12 ILE 24 HD12 ILE 24 19.070 14.234 18.394
186 HD13 ILE 24 HD13 ILE 24 20.370 15.388 18.742
187 H GLY 25 H GLY 25 17.312 15.226 23.717
188 HA2 GLY 25 HA2 GLY 25 14.754 14.320 24.876
189 HA3 GLY 25 HA3 GLY 25 16.266 14.632 25.733
190 H GLU 26 H GLU 26 16.901 16.887 25.993
191 HA GLU 26 HA GLU 26 14.721 18.902 26.021
192 HB2 GLU 26 HB2 GLU 26 14.755 17.175 28.126
193 HB3 GLU 26 HB3 GLU 26 15.939 18.335 28.698
194 HG2 GLU 26 HG2 GLU 26 13.909 19.069 29.603
195 HG3 GLU 26 HG3 GLU 26 14.160 20.159 28.244
196 H GLU 27 H GLU 27 18.010 18.252 25.818
197 HA GLU 27 HA GLU 27 18.848 20.966 26.671
198 HB2 GLU 27 HB2 GLU 27 21.057 20.129 26.885
199 HB3 GLU 27 HB3 GLU 27 19.947 19.222 27.886
200 HG2 GLU 27 HG2 GLU 27 21.140 18.223 25.257
201 HG3 GLU 27 HG3 GLU 27 21.755 17.893 26.855
202 H CYS 28 H CYS 28 19.110 22.444 25.091
203 HA CYS 28 HA CYS 28 19.047 21.572 22.297
204 HB2 CYS 28 HB2 CYS 28 17.771 23.515 23.064
205 HB3 CYS 28 HB3 CYS 28 19.262 24.310 23.552
206 H LYS 29 H LYS 29 20.761 20.880 21.242
207 HA LYS 29 HA LYS 29 23.342 22.388 21.460
208 HB2 LYS 29 HB2 LYS 29 24.506 20.476 20.632
209 HB3 LYS 29 HB3 LYS 29 23.549 19.971 22.047
210 HG2 LYS 29 HG2 LYS 29 22.016 18.759 20.716
211 HG3 LYS 29 HG3 LYS 29 22.701 19.442 19.213
212 HD2 LYS 29 HD2 LYS 29 24.746 18.290 19.455
213 HD3 LYS 29 HD3 LYS 29 24.379 17.849 21.136
214 HE2 LYS 29 HE2 LYS 29 22.598 16.346 20.422
215 HE3 LYS 29 HE3 LYS 29 22.851 16.782 18.719
216 HZ1 LYS 29 HZ1 LYS 29 24.983 15.751 18.761
217 HZ2 LYS 29 HZ2 LYS 29 25.033 15.684 20.378
218 HZ3 LYS 29 HZ3 LYS 29 24.008 14.682 19.558
219 H CYS 30 H CYS 30 24.298 23.139 19.540
220 HA CYS 30 HA CYS 30 22.626 22.819 17.065
221 HB2 CYS 30 HB2 CYS 30 24.702 24.974 17.371
222 HB3 CYS 30 HB3 CYS 30 23.350 24.844 16.208
223 H VAL 31 H VAL 31 23.512 22.090 15.299
224 HA VAL 31 HA VAL 31 26.192 20.815 15.558
225 HB VAL 31 HB VAL 31 25.223 18.794 14.677
226 HG11 VAL 31 HG11 VAL 31 24.093 18.047 16.664
227 HG12 VAL 31 HG12 VAL 31 25.366 19.182 17.128
228 HG13 VAL 31 HG13 VAL 31 23.663 19.712 17.118
229 HG21 VAL 31 HG21 VAL 31 23.333 19.458 13.395
230 HG22 VAL 31 HG22 VAL 31 22.786 18.392 14.673
231 HG23 VAL 31 HG23 VAL 31 22.505 20.142 14.828
232 HA PRO 32 HA PRO 32 26.567 22.114 11.237
233 HB2 PRO 32 HB2 PRO 32 28.980 20.915 10.652
234 HB3 PRO 32 HB3 PRO 32 28.786 22.482 11.487
235 HG2 PRO 32 HG2 PRO 32 29.492 19.823 12.658
236 HG3 PRO 32 HG3 PRO 32 29.944 21.475 13.196
237 HD2 PRO 32 HD2 PRO 32 27.921 19.847 14.309
238 HD3 PRO 32 HD3 PRO 32 28.130 21.600 14.567
239 H TYR 33 H TYR 33 24.819 21.018 10.613
240 HA TYR 33 HA TYR 33 24.554 18.176 10.350
241 HB2 TYR 33 HB2 TYR 33 22.466 18.515 9.334
242 HB3 TYR 33 HB3 TYR 33 22.656 19.525 10.738
243 HD1 TYR 33 HD2 TYR 33 23.322 22.010 10.327
244 HD2 TYR 33 HD1 TYR 33 21.565 19.429 7.374
245 HE1 TYR 33 HE2 TYR 33 22.761 24.014 8.907
246 HE2 TYR 33 HE1 TYR 33 20.881 21.417 6.029
247 HH TYR 33 HH TYR 33 21.941 24.719 6.881
Start of MODEL 10
1 H1 GLY 1 H1 GLY 1 14.335 16.218 32.171
2 H2 GLY 1 H2 GLY 1 13.193 16.169 30.989
3 H3 GLY 1 H3 GLY 1 13.111 15.118 32.258
4 HA2 GLY 1 HA2 GLY 1 12.710 16.900 33.780
5 HA3 GLY 1 HA3 GLY 1 12.797 18.038 32.417
6 H SER 2 H SER 2 10.849 18.680 31.789
7 HA SER 2 HA SER 2 8.505 16.852 31.954
8 HB2 SER 2 HB2 SER 2 7.167 18.699 32.843
9 HB3 SER 2 HB3 SER 2 8.512 18.274 33.914
10 HG SER 2 HG SER 2 8.291 20.514 33.646
11 H ALA 3 H ALA 3 10.044 17.360 29.646
12 HA ALA 3 HA ALA 3 9.911 17.858 27.471
13 HB1 ALA 3 HB1 ALA 3 7.940 16.408 27.630
14 HB2 ALA 3 HB2 ALA 3 6.902 17.828 27.892
15 HB3 ALA 3 HB3 ALA 3 7.761 17.622 26.353
16 H PHE 4 H PHE 4 10.578 20.065 28.982
17 HA PHE 4 HA PHE 4 9.008 22.320 27.867
18 HB2 PHE 4 HB2 PHE 4 9.345 21.995 30.358
19 HB3 PHE 4 HB3 PHE 4 11.014 22.503 30.109
20 HD1 PHE 4 HD1 PHE 4 7.535 23.596 29.079
21 HD2 PHE 4 HD2 PHE 4 11.410 24.804 30.538
22 HE1 PHE 4 HE1 PHE 4 6.789 25.958 29.107
23 HE2 PHE 4 HE2 PHE 4 10.646 27.162 30.582
24 HZ PHE 4 HZ PHE 4 8.338 27.746 29.853
25 H CYS 5 H CYS 5 11.005 20.922 26.212
26 HA CYS 5 HA CYS 5 11.944 23.412 24.981
27 HB2 CYS 5 HB2 CYS 5 13.941 22.644 26.255
28 HB3 CYS 5 HB3 CYS 5 13.785 21.075 25.474
29 H ASN 6 H ASN 6 11.543 23.322 22.826
30 HA ASN 6 HA ASN 6 10.666 20.715 21.642
31 HB2 ASN 6 HB2 ASN 6 8.932 22.448 21.761
32 HB3 ASN 6 HB3 ASN 6 9.988 23.601 20.934
33 HD21 ASN 6 HD22 ASN 6 8.099 20.599 20.501
34 HD22 ASN 6 HD21 ASN 6 8.211 20.629 18.746
35 H LEU 7 H LEU 7 12.022 19.774 20.141
36 HA LEU 7 HA LEU 7 14.501 20.971 19.472
37 HB2 LEU 7 HB2 LEU 7 14.121 18.557 19.461
38 HB3 LEU 7 HB3 LEU 7 13.086 18.695 18.042
39 HG LEU 7 HG LEU 7 15.907 19.777 17.857
40 HD11 LEU 7 HD11 LEU 7 15.066 16.841 17.657
41 HD12 LEU 7 HD12 LEU 7 16.646 17.461 17.179
42 HD13 LEU 7 HD13 LEU 7 16.143 17.521 18.882
43 HD21 LEU 7 HD21 LEU 7 14.143 18.319 15.842
44 HD22 LEU 7 HD22 LEU 7 14.479 20.062 15.854
45 HD23 LEU 7 HD23 LEU 7 15.781 18.930 15.550
46 H ARG 8 H ARG 8 11.571 20.682 17.416
47 HA ARG 8 HA ARG 8 12.557 21.961 15.100
48 HB2 ARG 8 HB2 ARG 8 10.379 20.731 15.464
49 HB3 ARG 8 HB3 ARG 8 9.738 22.165 16.244
50 HG2 ARG 8 HG2 ARG 8 10.678 22.021 13.349
51 HG3 ARG 8 HG3 ARG 8 9.020 21.814 13.919
52 HD2 ARG 8 HD2 ARG 8 9.410 24.180 15.049
53 HD3 ARG 8 HD3 ARG 8 10.658 24.339 13.802
54 HE ARG 8 HE ARG 8 7.733 24.235 13.444
55 HH11 ARG 8 HH11 ARG 8 10.758 23.854 11.601
56 HH12 ARG 8 HH12 ARG 8 9.897 24.305 10.139
57 HH21 ARG 8 HH21 ARG 8 6.875 24.804 11.559
58 HH22 ARG 8 HH22 ARG 8 7.878 24.805 10.100
59 H ARG 9 H ARG 9 11.208 23.507 18.011
60 HA ARG 9 HA ARG 9 11.514 26.168 16.918
61 HB2 ARG 9 HB2 ARG 9 9.881 25.265 18.720
62 HB3 ARG 9 HB3 ARG 9 11.199 25.563 19.873
63 HG2 ARG 9 HG2 ARG 9 11.220 27.943 19.266
64 HG3 ARG 9 HG3 ARG 9 10.141 27.634 17.893
65 HD2 ARG 9 HD2 ARG 9 8.614 28.420 19.400
66 HD3 ARG 9 HD3 ARG 9 8.492 26.695 19.690
67 HE ARG 9 HE ARG 9 9.464 26.965 21.810
68 HH11 ARG 9 HH11 ARG 9 9.467 30.083 20.150
69 HH12 ARG 9 HH12 ARG 9 9.411 30.950 21.654
70 HH21 ARG 9 HH21 ARG 9 9.749 28.127 23.630
71 HH22 ARG 9 HH22 ARG 9 9.534 29.867 23.601
72 H CYS 10 H CYS 10 13.677 24.156 18.895
73 HA CYS 10 HA CYS 10 15.621 26.325 19.214
74 HB2 CYS 10 HB2 CYS 10 15.497 24.249 20.689
75 HB3 CYS 10 HB3 CYS 10 16.155 23.346 19.307
76 H GLU 11 H GLU 11 14.945 23.837 16.795
77 HA GLU 11 HA GLU 11 17.236 23.629 15.414
78 HB2 GLU 11 HB2 GLU 11 14.796 22.647 14.976
79 HB3 GLU 11 HB3 GLU 11 14.775 23.903 13.737
80 HG2 GLU 11 HG2 GLU 11 17.212 22.741 13.285
81 HG3 GLU 11 HG3 GLU 11 16.348 21.376 13.948
82 H LEU 12 H LEU 12 14.990 26.247 15.146
83 HA LEU 12 HA LEU 12 16.236 27.576 12.887
84 HB2 LEU 12 HB2 LEU 12 14.073 28.280 14.883
85 HB3 LEU 12 HB3 LEU 12 14.376 29.208 13.392
86 HG LEU 12 HG LEU 12 13.522 26.266 13.516
87 HD11 LEU 12 HD11 LEU 12 11.342 27.079 12.783
88 HD12 LEU 12 HD12 LEU 12 11.783 27.785 14.341
89 HD13 LEU 12 HD13 LEU 12 11.919 28.762 12.863
90 HD21 LEU 12 HD21 LEU 12 12.996 26.523 11.137
91 HD22 LEU 12 HD22 LEU 12 13.663 28.171 11.149
92 HD23 LEU 12 HD23 LEU 12 14.718 26.758 11.426
93 H SER 13 H SER 13 16.221 28.080 16.432
94 HA SER 13 HA SER 13 17.464 30.690 16.401
95 HB2 SER 13 HB2 SER 13 17.706 28.608 18.601
96 HB3 SER 13 HB3 SER 13 17.768 30.376 18.747
97 HG SER 13 HG SER 13 15.498 30.090 17.697
98 H CYS 14 H CYS 14 18.650 27.387 16.376
99 HA CYS 14 HA CYS 14 21.475 27.950 16.445
100 HB2 CYS 14 HB2 CYS 14 19.739 25.661 15.513
101 HB3 CYS 14 HB3 CYS 14 21.490 25.623 15.452
102 H ARG 15 H ARG 15 19.093 28.092 13.741
103 HA ARG 15 HA ARG 15 21.213 27.732 11.783
104 HB2 ARG 15 HB2 ARG 15 18.383 28.540 11.828
105 HB3 ARG 15 HB3 ARG 15 19.238 28.589 10.258
106 HG2 ARG 15 HG2 ARG 15 19.901 26.223 10.498
107 HG3 ARG 15 HG3 ARG 15 19.066 26.115 12.033
108 HD2 ARG 15 HD2 ARG 15 16.915 26.586 10.932
109 HD3 ARG 15 HD3 ARG 15 17.732 26.751 9.371
110 HE ARG 15 HE ARG 15 17.020 24.283 10.773
111 HH11 ARG 15 HH21 ARG 15 19.182 25.521 8.262
112 HH12 ARG 15 HH22 ARG 15 19.294 23.938 7.524
113 HH21 ARG 15 HH12 ARG 15 17.146 22.457 9.757
114 HH22 ARG 15 HH11 ARG 15 18.163 22.271 8.304
115 H SER 16 H SER 16 20.014 30.562 13.396
116 HA SER 16 HA SER 16 21.096 32.732 11.948
117 HB2 SER 16 HB2 SER 16 21.320 32.007 14.893
118 HB3 SER 16 HB3 SER 16 21.528 33.646 14.230
119 HG SER 16 HG SER 16 19.449 33.053 15.167
120 H LEU 17 H LEU 17 22.737 29.968 13.104
121 HA LEU 17 HA LEU 17 25.409 31.225 13.367
122 HB2 LEU 17 HB2 LEU 17 24.637 28.488 14.329
123 HB3 LEU 17 HB3 LEU 17 25.803 29.600 14.998
124 HG LEU 17 HG LEU 17 22.739 29.898 15.273
125 HD11 LEU 17 HD11 LEU 17 23.709 27.964 16.508
126 HD12 LEU 17 HD12 LEU 17 24.885 29.055 17.268
127 HD13 LEU 17 HD13 LEU 17 23.148 29.249 17.596
128 HD21 LEU 17 HD21 LEU 17 25.008 31.391 16.634
129 HD22 LEU 17 HD22 LEU 17 23.964 32.076 15.384
130 HD23 LEU 17 HD23 LEU 17 23.269 31.591 16.934
131 H GLY 18 H GLY 18 23.657 29.533 11.074
132 HA2 GLY 18 HA2 GLY 18 24.212 28.200 9.270
133 HA3 GLY 18 HA3 GLY 18 25.924 28.304 9.705
134 H LEU 19 H LEU 19 23.373 27.114 11.912
135 HA LEU 19 HA LEU 19 24.396 24.300 11.747
136 HB2 LEU 19 HB2 LEU 19 23.769 25.890 14.273
137 HB3 LEU 19 HB3 LEU 19 24.400 24.255 14.195
138 HG LEU 19 HG LEU 19 25.923 26.753 13.345
139 HD11 LEU 19 HD11 LEU 19 25.499 26.652 15.798
140 HD12 LEU 19 HD12 LEU 19 26.288 25.053 15.839
141 HD13 LEU 19 HD13 LEU 19 27.204 26.498 15.372
142 HD21 LEU 19 HD21 LEU 19 26.669 24.625 12.235
143 HD22 LEU 19 HD22 LEU 19 27.882 25.268 13.351
144 HD23 LEU 19 HD23 LEU 19 26.873 23.889 13.833
145 H LEU 20 H LEU 20 23.030 22.739 12.496
146 HA LEU 20 HA LEU 20 20.108 23.140 12.428
147 HB2 LEU 20 HB2 LEU 20 21.342 21.102 11.623
148 HB3 LEU 20 HB3 LEU 20 21.908 20.813 13.261
149 HG LEU 20 HG LEU 20 19.419 20.622 13.938
150 HD11 LEU 20 HD11 LEU 20 17.844 20.041 12.196
151 HD12 LEU 20 HD12 LEU 20 18.517 21.643 11.813
152 HD13 LEU 20 HD13 LEU 20 19.080 20.221 10.943
153 HD21 LEU 20 HD21 LEU 20 20.966 18.718 13.736
154 HD22 LEU 20 HD22 LEU 20 19.263 18.341 13.376
155 HD23 LEU 20 HD23 LEU 20 20.437 18.486 12.066
156 H GLY 21 H GLY 21 18.858 22.534 14.410
157 HA2 GLY 21 HA2 GLY 21 20.354 22.746 17.000
158 HA3 GLY 21 HA3 GLY 21 18.748 23.419 16.846
159 H LYS 22 H LYS 22 20.080 21.133 18.397
160 HA LYS 22 HA LYS 22 17.948 19.102 18.001
161 HB2 LYS 22 HB2 LYS 22 20.905 18.539 18.379
162 HB3 LYS 22 HB3 LYS 22 19.617 17.364 18.651
163 HG2 LYS 22 HG2 LYS 22 18.833 17.884 16.236
164 HG3 LYS 22 HG3 LYS 22 20.409 18.674 16.030
165 HD2 LYS 22 HD2 LYS 22 21.516 16.523 16.729
166 HD3 LYS 22 HD3 LYS 22 19.910 15.807 16.929
167 HE2 LYS 22 HE2 LYS 22 19.484 16.369 14.477
168 HE3 LYS 22 HE3 LYS 22 21.221 16.713 14.340
169 HZ1 LYS 22 HZ1 LYS 22 20.087 14.174 15.326
170 HZ2 LYS 22 HZ2 LYS 22 20.540 14.385 13.784
171 HZ3 LYS 22 HZ3 LYS 22 21.685 14.446 14.984
172 H CYS 23 H CYS 23 16.722 19.607 19.651
173 HA CYS 23 HA CYS 23 17.845 19.453 22.419
174 HB2 CYS 23 HB2 CYS 23 16.894 21.678 21.677
175 HB3 CYS 23 HB3 CYS 23 15.347 20.908 21.532
176 H ILE 24 H ILE 24 17.725 17.153 22.128
177 HA ILE 24 HA ILE 24 15.160 15.816 21.582
178 HB ILE 24 HB ILE 24 17.916 14.706 22.261
179 HG12 ILE 24 HG12 ILE 24 16.669 15.188 19.515
180 HG13 ILE 24 HG13 ILE 24 18.027 16.088 20.208
181 HG21 ILE 24 HG21 ILE 24 17.065 12.600 21.250
182 HG22 ILE 24 HG22 ILE 24 16.092 13.068 22.623
183 HG23 ILE 24 HG23 ILE 24 15.484 13.366 20.976
184 HD11 ILE 24 HD11 ILE 24 19.355 13.957 20.278
185 HD12 ILE 24 HD12 ILE 24 18.055 13.190 19.328
186 HD13 ILE 24 HD13 ILE 24 18.945 14.560 18.662
187 H GLY 25 H GLY 25 17.484 16.088 24.251
188 HA2 GLY 25 HA2 GLY 25 15.551 14.898 26.208
189 HA3 GLY 25 HA3 GLY 25 17.307 14.856 26.344
190 H GLU 26 H GLU 26 15.060 17.504 25.562
191 HA GLU 26 HA GLU 26 14.770 19.560 26.266
192 HB2 GLU 26 HB2 GLU 26 14.994 18.374 29.021
193 HB3 GLU 26 HB3 GLU 26 14.234 19.915 28.606
194 HG2 GLU 26 HG2 GLU 26 12.555 18.832 27.244
195 HG3 GLU 26 HG3 GLU 26 13.310 17.251 27.502
196 H GLU 27 H GLU 27 17.640 18.946 25.831
197 HA GLU 27 HA GLU 27 18.521 21.628 26.632
198 HB2 GLU 27 HB2 GLU 27 20.721 20.850 27.424
199 HB3 GLU 27 HB3 GLU 27 19.373 20.336 28.441
200 HG2 GLU 27 HG2 GLU 27 19.475 18.063 27.254
201 HG3 GLU 27 HG3 GLU 27 20.984 18.619 26.532
202 H CYS 28 H CYS 28 19.857 22.608 25.059
203 HA CYS 28 HA CYS 28 19.537 21.123 22.499
204 HB2 CYS 28 HB2 CYS 28 18.067 23.097 22.962
205 HB3 CYS 28 HB3 CYS 28 19.501 24.112 22.840
206 H LYS 29 H LYS 29 21.284 20.368 21.604
207 HA LYS 29 HA LYS 29 23.843 21.798 21.397
208 HB2 LYS 29 HB2 LYS 29 23.396 19.250 21.503
209 HB3 LYS 29 HB3 LYS 29 22.766 19.384 19.857
210 HG2 LYS 29 HG2 LYS 29 25.013 20.296 19.149
211 HG3 LYS 29 HG3 LYS 29 25.553 20.129 20.826
212 HD2 LYS 29 HD2 LYS 29 24.815 17.606 20.558
213 HD3 LYS 29 HD3 LYS 29 24.895 17.953 18.805
214 HE2 LYS 29 HE2 LYS 29 27.199 18.742 19.045
215 HE3 LYS 29 HE3 LYS 29 27.076 18.622 20.807
216 HZ1 LYS 29 HZ1 LYS 29 28.304 16.758 19.934
217 HZ2 LYS 29 HZ2 LYS 29 26.915 16.189 20.577
218 HZ3 LYS 29 HZ3 LYS 29 27.072 16.272 18.955
219 H CYS 30 H CYS 30 24.444 23.009 19.516
220 HA CYS 30 HA CYS 30 22.549 22.812 17.211
221 HB2 CYS 30 HB2 CYS 30 24.618 24.984 17.355
222 HB3 CYS 30 HB3 CYS 30 23.261 24.835 16.228
223 H VAL 31 H VAL 31 23.413 22.232 15.250
224 HA VAL 31 HA VAL 31 25.967 20.704 15.533
225 HB VAL 31 HB VAL 31 23.623 19.437 14.174
226 HG11 VAL 31 HG11 VAL 31 25.802 18.414 16.062
227 HG12 VAL 31 HG12 VAL 31 24.679 17.426 15.101
228 HG13 VAL 31 HG13 VAL 31 25.902 18.403 14.292
229 HG21 VAL 31 HG21 VAL 31 22.877 18.407 16.304
230 HG22 VAL 31 HG22 VAL 31 23.857 19.572 17.207
231 HG23 VAL 31 HG23 VAL 31 22.481 20.123 16.214
232 HA PRO 32 HA PRO 32 26.635 22.350 11.412
233 HB2 PRO 32 HB2 PRO 32 28.798 20.233 11.229
234 HB3 PRO 32 HB3 PRO 32 28.874 21.983 10.874
235 HG2 PRO 32 HG2 PRO 32 29.882 21.000 13.178
236 HG3 PRO 32 HG3 PRO 32 28.934 22.523 13.207
237 HD2 PRO 32 HD2 PRO 32 27.993 19.708 13.840
238 HD3 PRO 32 HD3 PRO 32 27.774 21.215 14.774
239 H TYR 33 H TYR 33 24.618 21.628 10.493
240 HA TYR 33 HA TYR 33 23.979 19.087 9.635
241 HB2 TYR 33 HB2 TYR 33 22.644 21.363 9.560
242 HB3 TYR 33 HB3 TYR 33 23.190 21.428 7.903
243 HD1 TYR 33 HD2 TYR 33 21.362 19.491 10.391
244 HD2 TYR 33 HD1 TYR 33 22.214 19.872 6.207
245 HE1 TYR 33 HE2 TYR 33 19.488 17.880 9.896
246 HE2 TYR 33 HE1 TYR 33 20.401 18.218 5.689
247 HH TYR 33 HH TYR 33 18.794 16.761 6.580
Start of MODEL 11
1 H1 GLY 1 H1 GLY 1 12.269 19.048 26.937
2 H2 GLY 1 H2 GLY 1 11.385 20.171 26.043
3 H3 GLY 1 H3 GLY 1 12.562 19.263 25.342
4 HA2 GLY 1 HA2 GLY 1 10.518 18.340 24.688
5 HA3 GLY 1 HA3 GLY 1 11.376 17.235 25.761
6 H SER 2 H SER 2 10.779 17.289 28.096
7 HA SER 2 HA SER 2 7.942 18.002 28.587
8 HB2 SER 2 HB2 SER 2 8.129 16.838 30.621
9 HB3 SER 2 HB3 SER 2 8.838 15.819 29.369
10 HG SER 2 HG SER 2 10.882 16.391 30.079
11 H ALA 3 H ALA 3 11.240 18.951 29.449
12 HA ALA 3 HA ALA 3 10.450 21.385 30.863
13 HB1 ALA 3 HB1 ALA 3 13.120 20.477 29.724
14 HB2 ALA 3 HB2 ALA 3 12.855 21.836 30.847
15 HB3 ALA 3 HB3 ALA 3 12.549 20.167 31.385
16 H PHE 4 H PHE 4 11.196 23.475 30.023
17 HA PHE 4 HA PHE 4 9.489 24.148 27.959
18 HB2 PHE 4 HB2 PHE 4 10.236 25.543 29.862
19 HB3 PHE 4 HB3 PHE 4 11.804 25.768 29.102
20 HD1 PHE 4 HD2 PHE 4 8.119 26.287 28.494
21 HD2 PHE 4 HD1 PHE 4 12.129 27.660 27.719
22 HE1 PHE 4 HE2 PHE 4 7.220 28.284 27.330
23 HE2 PHE 4 HE1 PHE 4 11.215 29.650 26.554
24 HZ PHE 4 HZ PHE 4 8.757 29.968 26.350
25 H CYS 5 H CYS 5 12.852 23.255 27.364
26 HA CYS 5 HA CYS 5 13.168 24.525 24.805
27 HB2 CYS 5 HB2 CYS 5 14.947 23.326 26.179
28 HB3 CYS 5 HB3 CYS 5 14.215 21.802 25.674
29 H ASN 6 H ASN 6 12.733 23.790 22.683
30 HA ASN 6 HA ASN 6 11.609 21.071 22.355
31 HB2 ASN 6 HB2 ASN 6 9.651 22.777 22.302
32 HB3 ASN 6 HB3 ASN 6 10.340 23.377 20.814
33 HD21 ASN 6 HD22 ASN 6 8.881 20.596 22.400
34 HD22 ASN 6 HD21 ASN 6 8.754 19.607 20.936
35 H LEU 7 H LEU 7 12.510 20.033 20.501
36 HA LEU 7 HA LEU 7 14.785 21.229 19.287
37 HB2 LEU 7 HB2 LEU 7 14.453 18.806 19.421
38 HB3 LEU 7 HB3 LEU 7 13.084 18.906 18.299
39 HG LEU 7 HG LEU 7 15.807 19.954 17.453
40 HD11 LEU 7 HD11 LEU 7 16.317 17.652 16.615
41 HD12 LEU 7 HD12 LEU 7 16.164 17.649 18.387
42 HD13 LEU 7 HD13 LEU 7 14.839 17.059 17.377
43 HD21 LEU 7 HD21 LEU 7 15.100 19.101 15.224
44 HD22 LEU 7 HD22 LEU 7 13.568 18.546 15.918
45 HD23 LEU 7 HD23 LEU 7 13.935 20.275 15.808
46 H ARG 8 H ARG 8 11.380 21.174 18.138
47 HA ARG 8 HA ARG 8 12.011 22.229 15.569
48 HB2 ARG 8 HB2 ARG 8 9.783 21.116 16.517
49 HB3 ARG 8 HB3 ARG 8 9.365 22.762 17.027
50 HG2 ARG 8 HG2 ARG 8 9.673 23.423 14.567
51 HG3 ARG 8 HG3 ARG 8 9.876 21.710 14.191
52 HD2 ARG 8 HD2 ARG 8 7.586 21.295 15.098
53 HD3 ARG 8 HD3 ARG 8 7.402 23.033 15.403
54 HE ARG 8 HE ARG 8 8.164 22.350 12.639
55 HH11 ARG 8 HH12 ARG 8 5.224 22.794 14.580
56 HH12 ARG 8 HH11 ARG 8 4.375 23.421 13.197
57 HH21 ARG 8 HH21 ARG 8 7.023 22.972 11.032
58 HH22 ARG 8 HH22 ARG 8 5.345 23.502 11.216
59 H ARG 9 H ARG 9 11.808 23.775 18.564
60 HA ARG 9 HA ARG 9 11.711 26.525 17.435
61 HB2 ARG 9 HB2 ARG 9 10.288 25.611 19.416
62 HB3 ARG 9 HB3 ARG 9 11.780 25.718 20.364
63 HG2 ARG 9 HG2 ARG 9 11.896 28.179 19.761
64 HG3 ARG 9 HG3 ARG 9 10.402 27.971 18.836
65 HD2 ARG 9 HD2 ARG 9 9.672 28.793 20.942
66 HD3 ARG 9 HD3 ARG 9 9.337 27.056 20.982
67 HE ARG 9 HE ARG 9 11.824 28.261 22.170
68 HH11 ARG 9 HH11 ARG 9 9.150 25.995 22.734
69 HH12 ARG 9 HH12 ARG 9 9.803 25.637 24.325
70 HH21 ARG 9 HH21 ARG 9 12.493 27.657 24.162
71 HH22 ARG 9 HH22 ARG 9 11.505 26.532 25.075
72 H CYS 10 H CYS 10 13.879 24.306 19.196
73 HA CYS 10 HA CYS 10 15.970 26.268 19.508
74 HB2 CYS 10 HB2 CYS 10 15.646 24.125 20.871
75 HB3 CYS 10 HB3 CYS 10 16.308 23.268 19.454
76 H GLU 11 H GLU 11 15.141 23.927 16.910
77 HA GLU 11 HA GLU 11 17.385 23.956 15.358
78 HB2 GLU 11 HB2 GLU 11 14.486 24.024 14.633
79 HB3 GLU 11 HB3 GLU 11 15.668 24.459 13.382
80 HG2 GLU 11 HG2 GLU 11 16.883 22.325 13.825
81 HG3 GLU 11 HG3 GLU 11 15.511 21.819 14.822
82 H LEU 12 H LEU 12 14.989 26.544 15.601
83 HA LEU 12 HA LEU 12 16.285 28.335 13.739
84 HB2 LEU 12 HB2 LEU 12 14.040 28.509 15.737
85 HB3 LEU 12 HB3 LEU 12 14.449 29.862 14.656
86 HG LEU 12 HG LEU 12 13.647 27.052 13.731
87 HD11 LEU 12 HD11 LEU 12 11.531 28.070 13.140
88 HD12 LEU 12 HD12 LEU 12 11.814 28.229 14.876
89 HD13 LEU 12 HD13 LEU 12 12.042 29.635 13.805
90 HD21 LEU 12 HD21 LEU 12 14.990 28.200 12.009
91 HD22 LEU 12 HD22 LEU 12 13.295 28.184 11.533
92 HD23 LEU 12 HD23 LEU 12 14.010 29.664 12.201
93 H SER 13 H SER 13 16.256 28.193 17.347
94 HA SER 13 HA SER 13 17.830 30.524 17.819
95 HB2 SER 13 HB2 SER 13 17.947 27.846 19.279
96 HB3 SER 13 HB3 SER 13 18.552 29.401 19.881
97 HG SER 13 HG SER 13 16.522 29.039 20.749
98 H CYS 14 H CYS 14 18.708 27.375 16.547
99 HA CYS 14 HA CYS 14 21.613 27.866 16.663
100 HB2 CYS 14 HB2 CYS 14 19.801 25.598 15.868
101 HB3 CYS 14 HB3 CYS 14 21.538 25.553 15.679
102 H ARG 15 H ARG 15 19.097 28.067 14.194
103 HA ARG 15 HA ARG 15 20.892 27.533 11.976
104 HB2 ARG 15 HB2 ARG 15 18.163 28.484 12.485
105 HB3 ARG 15 HB3 ARG 15 18.726 28.585 10.797
106 HG2 ARG 15 HG2 ARG 15 19.253 26.245 10.668
107 HG3 ARG 15 HG3 ARG 15 18.908 25.971 12.363
108 HD2 ARG 15 HD2 ARG 15 16.519 26.527 11.979
109 HD3 ARG 15 HD3 ARG 15 16.852 26.946 10.300
110 HE ARG 15 HE ARG 15 16.380 24.301 11.374
111 HH11 ARG 15 HH11 ARG 15 18.005 25.901 8.655
112 HH12 ARG 15 HH12 ARG 15 18.108 24.375 7.809
113 HH21 ARG 15 HH21 ARG 15 16.428 22.582 10.197
114 HH22 ARG 15 HH22 ARG 15 17.293 22.519 8.661
115 H SER 16 H SER 16 19.888 30.464 13.560
116 HA SER 16 HA SER 16 20.855 32.561 11.970
117 HB2 SER 16 HB2 SER 16 21.176 31.971 14.945
118 HB3 SER 16 HB3 SER 16 21.353 33.593 14.186
119 HG SER 16 HG SER 16 19.269 33.481 14.899
120 H LEU 17 H LEU 17 22.585 29.888 13.228
121 HA LEU 17 HA LEU 17 25.238 31.158 13.266
122 HB2 LEU 17 HB2 LEU 17 24.568 28.406 14.218
123 HB3 LEU 17 HB3 LEU 17 25.782 29.491 14.813
124 HG LEU 17 HG LEU 17 22.743 29.771 15.319
125 HD11 LEU 17 HD11 LEU 17 25.061 28.975 17.143
126 HD12 LEU 17 HD12 LEU 17 23.356 29.142 17.608
127 HD13 LEU 17 HD13 LEU 17 23.850 27.859 16.484
128 HD21 LEU 17 HD21 LEU 17 23.414 31.465 16.946
129 HD22 LEU 17 HD22 LEU 17 25.116 31.319 16.456
130 HD23 LEU 17 HD23 LEU 17 23.911 31.976 15.333
131 H GLY 18 H GLY 18 23.429 29.473 10.973
132 HA2 GLY 18 HA2 GLY 18 24.049 28.295 9.057
133 HA3 GLY 18 HA3 GLY 18 25.752 28.457 9.482
134 H LEU 19 H LEU 19 23.458 27.120 11.742
135 HA LEU 19 HA LEU 19 24.587 24.368 11.441
136 HB2 LEU 19 HB2 LEU 19 23.768 25.807 13.999
137 HB3 LEU 19 HB3 LEU 19 24.453 24.211 13.895
138 HG LEU 19 HG LEU 19 25.882 26.808 13.249
139 HD11 LEU 19 HD11 LEU 19 26.283 24.820 15.516
140 HD12 LEU 19 HD12 LEU 19 27.196 26.315 15.236
141 HD13 LEU 19 HD13 LEU 19 25.488 26.411 15.647
142 HD21 LEU 19 HD21 LEU 19 26.986 23.959 13.302
143 HD22 LEU 19 HD22 LEU 19 26.788 24.960 11.847
144 HD23 LEU 19 HD23 LEU 19 27.935 25.447 13.091
145 H LEU 20 H LEU 20 23.190 22.758 12.563
146 HA LEU 20 HA LEU 20 20.265 23.157 12.278
147 HB2 LEU 20 HB2 LEU 20 21.523 20.940 11.643
148 HB3 LEU 20 HB3 LEU 20 21.792 20.761 13.364
149 HG LEU 20 HG LEU 20 19.294 20.683 13.712
150 HD11 LEU 20 HD11 LEU 20 19.317 20.742 10.655
151 HD12 LEU 20 HD12 LEU 20 17.914 20.330 11.648
152 HD13 LEU 20 HD13 LEU 20 18.560 21.967 11.707
153 HD21 LEU 20 HD21 LEU 20 19.019 18.461 12.753
154 HD22 LEU 20 HD22 LEU 20 20.367 18.739 11.629
155 HD23 LEU 20 HD23 LEU 20 20.678 18.634 13.372
156 H GLY 21 H GLY 21 18.958 22.641 14.307
157 HA2 GLY 21 HA2 GLY 21 20.515 22.723 16.853
158 HA3 GLY 21 HA3 GLY 21 18.958 23.516 16.746
159 H LYS 22 H LYS 22 20.147 21.028 18.175
160 HA LYS 22 HA LYS 22 17.795 19.271 17.763
161 HB2 LYS 22 HB2 LYS 22 20.688 18.387 18.036
162 HB3 LYS 22 HB3 LYS 22 19.297 17.352 18.342
163 HG2 LYS 22 HG2 LYS 22 18.510 17.925 15.935
164 HG3 LYS 22 HG3 LYS 22 20.167 18.535 15.707
165 HD2 LYS 22 HD2 LYS 22 21.056 16.305 16.485
166 HD3 LYS 22 HD3 LYS 22 19.388 15.763 16.656
167 HE2 LYS 22 HE2 LYS 22 19.042 16.207 14.199
168 HE3 LYS 22 HE3 LYS 22 20.803 16.485 14.096
169 HZ1 LYS 22 HZ1 LYS 22 21.038 14.207 15.098
170 HZ2 LYS 22 HZ2 LYS 22 19.430 13.989 14.967
171 HZ3 LYS 22 HZ3 LYS 22 20.344 14.177 13.598
172 H CYS 23 H CYS 23 16.662 19.355 19.569
173 HA CYS 23 HA CYS 23 18.050 19.449 22.210
174 HB2 CYS 23 HB2 CYS 23 16.994 21.587 21.617
175 HB3 CYS 23 HB3 CYS 23 15.463 20.782 21.430
176 H ILE 24 H ILE 24 18.026 17.152 21.553
177 HA ILE 24 HA ILE 24 15.615 15.594 21.786
178 HB ILE 24 HB ILE 24 18.492 14.686 22.098
179 HG12 ILE 24 HG12 ILE 24 16.870 15.179 19.552
180 HG13 ILE 24 HG13 ILE 24 18.384 15.963 20.034
181 HG21 ILE 24 HG21 ILE 24 15.988 13.219 21.119
182 HG22 ILE 24 HG22 ILE 24 17.605 12.503 21.320
183 HG23 ILE 24 HG23 ILE 24 16.709 13.032 22.729
184 HD11 ILE 24 HD11 ILE 24 19.565 13.787 19.835
185 HD12 ILE 24 HD12 ILE 24 18.063 13.092 19.149
186 HD13 ILE 24 HD13 ILE 24 18.881 14.415 18.322
187 H GLY 25 H GLY 25 14.540 15.128 23.589
188 HA2 GLY 25 HA2 GLY 25 14.119 14.691 25.855
189 HA3 GLY 25 HA3 GLY 25 15.848 14.754 26.219
190 H GLU 26 H GLU 26 16.640 16.613 27.129
191 HA GLU 26 HA GLU 26 14.697 18.897 27.427
192 HB2 GLU 26 HB2 GLU 26 16.326 17.726 29.679
193 HB3 GLU 26 HB3 GLU 26 15.000 18.872 29.786
194 HG2 GLU 26 HG2 GLU 26 14.819 15.917 29.091
195 HG3 GLU 26 HG3 GLU 26 14.340 16.679 30.584
196 H GLU 27 H GLU 27 17.649 18.493 26.125
197 HA GLU 27 HA GLU 27 18.455 21.252 26.850
198 HB2 GLU 27 HB2 GLU 27 19.543 19.813 28.546
199 HB3 GLU 27 HB3 GLU 27 20.309 18.876 27.279
200 HG2 GLU 27 HG2 GLU 27 21.610 20.828 26.551
201 HG3 GLU 27 HG3 GLU 27 20.706 21.870 27.675
202 H CYS 28 H CYS 28 19.523 22.320 25.206
203 HA CYS 28 HA CYS 28 19.462 20.883 22.644
204 HB2 CYS 28 HB2 CYS 28 18.226 23.029 23.108
205 HB3 CYS 28 HB3 CYS 28 19.781 23.848 23.032
206 H LYS 29 H LYS 29 20.911 20.976 21.039
207 HA LYS 29 HA LYS 29 23.660 22.036 21.436
208 HB2 LYS 29 HB2 LYS 29 23.488 19.446 21.702
209 HB3 LYS 29 HB3 LYS 29 23.009 19.420 20.005
210 HG2 LYS 29 HG2 LYS 29 25.285 20.872 19.746
211 HG3 LYS 29 HG3 LYS 29 25.680 20.072 21.257
212 HD2 LYS 29 HD2 LYS 29 24.928 18.747 18.616
213 HD3 LYS 29 HD3 LYS 29 26.550 18.847 19.290
214 HE2 LYS 29 HE2 LYS 29 24.227 17.402 20.651
215 HE3 LYS 29 HE3 LYS 29 25.369 16.620 19.554
216 HZ1 LYS 29 HZ1 LYS 29 27.169 17.186 21.066
217 HZ2 LYS 29 HZ2 LYS 29 26.115 17.955 22.101
218 HZ3 LYS 29 HZ3 LYS 29 26.032 16.355 21.863
219 H CYS 30 H CYS 30 24.431 23.040 19.492
220 HA CYS 30 HA CYS 30 22.670 22.804 17.076
221 HB2 CYS 30 HB2 CYS 30 24.796 24.912 17.360
222 HB3 CYS 30 HB3 CYS 30 23.402 24.874 16.244
223 H VAL 31 H VAL 31 23.635 22.420 15.092
224 HA VAL 31 HA VAL 31 26.007 20.630 15.400
225 HB VAL 31 HB VAL 31 23.734 19.706 13.688
226 HG11 VAL 31 HG11 VAL 31 25.798 18.398 13.988
227 HG12 VAL 31 HG12 VAL 31 25.589 18.440 15.760
228 HG13 VAL 31 HG13 VAL 31 24.444 17.554 14.741
229 HG21 VAL 31 HG21 VAL 31 23.552 19.590 16.740
230 HG22 VAL 31 HG22 VAL 31 22.399 20.408 15.658
231 HG23 VAL 31 HG23 VAL 31 22.566 18.653 15.602
232 HA PRO 32 HA PRO 32 27.208 22.282 11.374
233 HB2 PRO 32 HB2 PRO 32 28.863 19.768 11.229
234 HB3 PRO 32 HB3 PRO 32 29.335 21.460 10.858
235 HG2 PRO 32 HG2 PRO 32 30.050 20.352 13.211
236 HG3 PRO 32 HG3 PRO 32 29.359 22.013 13.202
237 HD2 PRO 32 HD2 PRO 32 27.928 19.393 13.760
238 HD3 PRO 32 HD3 PRO 32 27.931 20.905 14.717
239 H TYR 33 H TYR 33 24.763 20.885 11.375
240 HA TYR 33 HA TYR 33 23.203 19.809 10.186
241 HB2 TYR 33 HB2 TYR 33 24.498 21.678 8.598
242 HB3 TYR 33 HB3 TYR 33 24.406 20.292 7.561
243 HD1 TYR 33 HD2 TYR 33 22.242 22.076 10.010
244 HD2 TYR 33 HD1 TYR 33 22.560 20.319 6.099
245 HE1 TYR 33 HE2 TYR 33 19.947 22.930 9.427
246 HE2 TYR 33 HE1 TYR 33 20.265 21.103 5.538
247 HH TYR 33 HH TYR 33 18.398 22.240 6.263
Start of MODEL 12
1 H1 GLY 1 H1 GLY 1 11.667 15.601 27.316
2 H2 GLY 1 H2 GLY 1 11.834 17.187 26.894
3 H3 GLY 1 H3 GLY 1 10.340 16.482 26.953
4 HA2 GLY 1 HA2 GLY 1 10.443 16.206 29.295
5 HA3 GLY 1 HA3 GLY 1 12.093 16.851 29.286
6 H SER 2 H SER 2 12.034 18.768 30.276
7 HA SER 2 HA SER 2 9.889 20.484 30.679
8 HB2 SER 2 HB2 SER 2 12.850 21.150 30.502
9 HB3 SER 2 HB3 SER 2 11.615 22.180 31.244
10 HG SER 2 HG SER 2 12.513 19.609 32.069
11 H ALA 3 H ALA 3 9.114 22.412 29.794
12 HA ALA 3 HA ALA 3 9.110 22.499 26.961
13 HB1 ALA 3 HB1 ALA 3 7.578 24.420 27.291
14 HB2 ALA 3 HB2 ALA 3 7.166 23.030 28.308
15 HB3 ALA 3 HB3 ALA 3 7.994 24.433 29.017
16 H PHE 4 H PHE 4 11.241 24.334 29.129
17 HA PHE 4 HA PHE 4 12.063 26.300 27.250
18 HB2 PHE 4 HB2 PHE 4 13.967 26.628 28.512
19 HB3 PHE 4 HB3 PHE 4 12.777 26.118 29.684
20 HD1 PHE 4 HD1 PHE 4 15.847 25.175 27.823
21 HD2 PHE 4 HD2 PHE 4 13.088 23.995 30.915
22 HE1 PHE 4 HE1 PHE 4 17.422 23.396 28.546
23 HE2 PHE 4 HE2 PHE 4 14.688 22.240 31.660
24 HZ PHE 4 HZ PHE 4 16.845 21.933 30.464
25 H CYS 5 H CYS 5 12.625 22.835 27.232
26 HA CYS 5 HA CYS 5 14.274 23.063 24.768
27 HB2 CYS 5 HB2 CYS 5 15.088 21.493 26.406
28 HB3 CYS 5 HB3 CYS 5 13.514 20.717 26.521
29 H ASN 6 H ASN 6 13.165 23.308 22.960
30 HA ASN 6 HA ASN 6 11.174 21.234 22.304
31 HB2 ASN 6 HB2 ASN 6 9.884 23.346 22.851
32 HB3 ASN 6 HB3 ASN 6 10.727 24.167 21.540
33 HD21 ASN 6 HD22 ASN 6 7.899 23.789 21.830
34 HD22 ASN 6 HD21 ASN 6 7.410 22.981 20.340
35 H LEU 7 H LEU 7 12.186 20.135 20.679
36 HA LEU 7 HA LEU 7 14.490 21.035 19.327
37 HB2 LEU 7 HB2 LEU 7 13.781 18.691 19.432
38 HB3 LEU 7 HB3 LEU 7 12.413 19.013 18.365
39 HG LEU 7 HG LEU 7 15.168 19.781 17.405
40 HD11 LEU 7 HD11 LEU 7 15.559 17.483 16.570
41 HD12 LEU 7 HD12 LEU 7 15.455 17.471 18.341
42 HD13 LEU 7 HD13 LEU 7 14.078 16.939 17.370
43 HD21 LEU 7 HD21 LEU 7 14.300 18.983 15.219
44 HD22 LEU 7 HD22 LEU 7 12.777 18.517 15.992
45 HD23 LEU 7 HD23 LEU 7 13.243 20.222 15.880
46 H ARG 8 H ARG 8 11.087 21.462 18.410
47 HA ARG 8 HA ARG 8 11.503 22.424 15.796
48 HB2 ARG 8 HB2 ARG 8 9.382 21.636 17.132
49 HB3 ARG 8 HB3 ARG 8 9.280 23.320 17.704
50 HG2 ARG 8 HG2 ARG 8 9.033 24.110 15.418
51 HG3 ARG 8 HG3 ARG 8 9.372 22.486 14.774
52 HD2 ARG 8 HD2 ARG 8 7.371 21.632 15.945
53 HD3 ARG 8 HD3 ARG 8 7.013 23.268 16.540
54 HE ARG 8 HE ARG 8 7.059 23.885 14.009
55 HH11 ARG 8 HH11 ARG 8 5.569 20.889 15.176
56 HH12 ARG 8 HH12 ARG 8 4.907 20.581 13.565
57 HH21 ARG 8 HH21 ARG 8 6.290 23.275 12.066
58 HH22 ARG 8 HH22 ARG 8 5.149 21.919 11.974
59 H ARG 9 H ARG 9 12.125 24.022 18.706
60 HA ARG 9 HA ARG 9 12.200 26.759 17.480
61 HB2 ARG 9 HB2 ARG 9 10.867 26.289 19.552
62 HB3 ARG 9 HB3 ARG 9 12.364 25.853 20.383
63 HG2 ARG 9 HG2 ARG 9 13.222 28.143 20.116
64 HG3 ARG 9 HG3 ARG 9 11.852 28.555 19.070
65 HD2 ARG 9 HD2 ARG 9 11.388 29.373 21.333
66 HD3 ARG 9 HD3 ARG 9 10.275 28.062 20.910
67 HE ARG 9 HE ARG 9 12.755 27.505 22.517
68 HH11 ARG 9 HH11 ARG 9 9.219 27.127 22.334
69 HH12 ARG 9 HH12 ARG 9 9.174 26.545 23.981
70 HH21 ARG 9 HH21 ARG 9 12.565 26.367 24.379
71 HH22 ARG 9 HH22 ARG 9 10.975 25.883 24.950
72 H CYS 10 H CYS 10 14.181 24.331 19.215
73 HA CYS 10 HA CYS 10 16.652 25.813 19.127
74 HB2 CYS 10 HB2 CYS 10 15.910 22.883 19.297
75 HB3 CYS 10 HB3 CYS 10 17.592 23.450 19.413
76 H GLU 11 H GLU 11 15.127 23.501 16.848
77 HA GLU 11 HA GLU 11 16.994 23.267 14.802
78 HB2 GLU 11 HB2 GLU 11 14.931 22.086 15.073
79 HB3 GLU 11 HB3 GLU 11 13.978 23.545 14.687
80 HG2 GLU 11 HG2 GLU 11 15.948 22.469 12.669
81 HG3 GLU 11 HG3 GLU 11 14.530 21.492 13.005
82 H LEU 12 H LEU 12 15.474 26.168 15.775
83 HA LEU 12 HA LEU 12 15.783 27.347 13.096
84 HB2 LEU 12 HB2 LEU 12 13.464 26.895 13.838
85 HB3 LEU 12 HB3 LEU 12 13.723 27.928 15.249
86 HG LEU 12 HG LEU 12 13.980 29.890 13.855
87 HD11 LEU 12 HD11 LEU 12 15.095 29.038 11.857
88 HD12 LEU 12 HD12 LEU 12 13.720 27.971 11.486
89 HD13 LEU 12 HD13 LEU 12 13.557 29.732 11.370
90 HD21 LEU 12 HD21 LEU 12 11.612 28.220 12.884
91 HD22 LEU 12 HD22 LEU 12 11.677 29.126 14.409
92 HD23 LEU 12 HD23 LEU 12 11.741 29.993 12.874
93 H SER 13 H SER 13 15.847 28.165 16.647
94 HA SER 13 HA SER 13 17.163 30.672 16.469
95 HB2 SER 13 HB2 SER 13 17.603 28.504 18.565
96 HB3 SER 13 HB3 SER 13 17.966 30.227 18.733
97 HG SER 13 HG SER 13 16.080 29.801 19.721
98 H CYS 14 H CYS 14 18.511 27.378 16.428
99 HA CYS 14 HA CYS 14 21.281 28.034 16.494
100 HB2 CYS 14 HB2 CYS 14 19.654 25.707 15.476
101 HB3 CYS 14 HB3 CYS 14 21.404 25.705 15.501
102 H ARG 15 H ARG 15 19.067 28.321 13.777
103 HA ARG 15 HA ARG 15 21.101 27.631 11.781
104 HB2 ARG 15 HB2 ARG 15 18.406 28.851 11.861
105 HB3 ARG 15 HB3 ARG 15 19.213 28.622 10.272
106 HG2 ARG 15 HG2 ARG 15 19.498 26.171 10.847
107 HG3 ARG 15 HG3 ARG 15 18.501 26.411 12.266
108 HD2 ARG 15 HD2 ARG 15 16.644 27.240 10.737
109 HD3 ARG 15 HD3 ARG 15 17.680 26.966 9.339
110 HE ARG 15 HE ARG 15 16.367 24.941 11.064
111 HH11 ARG 15 HH21 ARG 15 18.494 25.323 8.234
112 HH12 ARG 15 HH22 ARG 15 18.443 23.578 7.987
113 HH21 ARG 15 HH11 ARG 15 16.099 22.953 10.300
114 HH22 ARG 15 HH12 ARG 15 17.140 22.310 9.027
115 H SER 16 H SER 16 19.975 30.639 13.156
116 HA SER 16 HA SER 16 21.240 32.642 11.608
117 HB2 SER 16 HB2 SER 16 20.713 32.158 14.561
118 HB3 SER 16 HB3 SER 16 21.568 33.621 14.025
119 HG SER 16 HG SER 16 18.964 32.771 13.236
120 H LEU 17 H LEU 17 22.711 30.025 13.248
121 HA LEU 17 HA LEU 17 25.329 31.293 13.682
122 HB2 LEU 17 HB2 LEU 17 24.501 28.494 14.427
123 HB3 LEU 17 HB3 LEU 17 25.662 29.548 15.217
124 HG LEU 17 HG LEU 17 22.599 29.854 15.347
125 HD11 LEU 17 HD11 LEU 17 24.690 29.019 17.408
126 HD12 LEU 17 HD12 LEU 17 22.943 29.172 17.683
127 HD13 LEU 17 HD13 LEU 17 23.561 27.920 16.594
128 HD21 LEU 17 HD21 LEU 17 23.744 32.054 15.516
129 HD22 LEU 17 HD22 LEU 17 23.082 31.535 17.072
130 HD23 LEU 17 HD23 LEU 17 24.821 31.383 16.754
131 H GLY 18 H GLY 18 23.858 29.646 11.160
132 HA2 GLY 18 HA2 GLY 18 24.734 28.625 9.271
133 HA3 GLY 18 HA3 GLY 18 26.352 28.698 9.939
134 H LEU 19 H LEU 19 23.570 27.194 11.594
135 HA LEU 19 HA LEU 19 24.802 24.469 11.351
136 HB2 LEU 19 HB2 LEU 19 23.640 25.743 13.865
137 HB3 LEU 19 HB3 LEU 19 24.432 24.191 13.762
138 HG LEU 19 HG LEU 19 25.803 26.885 13.448
139 HD11 LEU 19 HD11 LEU 19 26.844 26.318 15.600
140 HD12 LEU 19 HD12 LEU 19 25.087 26.421 15.744
141 HD13 LEU 19 HD13 LEU 19 25.891 24.828 15.680
142 HD21 LEU 19 HD21 LEU 19 26.985 24.072 13.629
143 HD22 LEU 19 HD22 LEU 19 26.946 25.051 12.154
144 HD23 LEU 19 HD23 LEU 19 27.900 25.592 13.539
145 H LEU 20 H LEU 20 23.285 22.869 12.475
146 HA LEU 20 HA LEU 20 20.388 23.401 11.966
147 HB2 LEU 20 HB2 LEU 20 20.973 21.301 10.976
148 HB3 LEU 20 HB3 LEU 20 21.945 20.827 12.370
149 HG LEU 20 HG LEU 20 19.872 20.613 13.725
150 HD11 LEU 20 HD11 LEU 20 18.411 22.189 12.287
151 HD12 LEU 20 HD12 LEU 20 18.434 20.942 11.044
152 HD13 LEU 20 HD13 LEU 20 17.683 20.610 12.616
153 HD21 LEU 20 HD21 LEU 20 20.824 18.648 12.583
154 HD22 LEU 20 HD22 LEU 20 19.072 18.578 12.859
155 HD23 LEU 20 HD23 LEU 20 19.675 18.945 11.249
156 H GLY 21 H GLY 21 19.068 22.642 13.837
157 HA2 GLY 21 HA2 GLY 21 20.416 22.700 16.478
158 HA3 GLY 21 HA3 GLY 21 18.924 23.592 16.288
159 H LYS 22 H LYS 22 19.621 21.237 17.978
160 HA LYS 22 HA LYS 22 17.216 19.667 17.377
161 HB2 LYS 22 HB2 LYS 22 19.963 18.407 17.661
162 HB3 LYS 22 HB3 LYS 22 18.461 17.533 17.994
163 HG2 LYS 22 HG2 LYS 22 17.665 18.164 15.672
164 HG3 LYS 22 HG3 LYS 22 19.303 18.755 15.340
165 HD2 LYS 22 HD2 LYS 22 18.640 15.888 16.166
166 HD3 LYS 22 HD3 LYS 22 18.797 16.443 14.502
167 HE2 LYS 22 HE2 LYS 22 21.125 17.218 15.003
168 HE3 LYS 22 HE3 LYS 22 20.983 16.505 16.626
169 HZ1 LYS 22 HZ1 LYS 22 20.811 15.015 14.049
170 HZ2 LYS 22 HZ2 LYS 22 22.078 15.026 15.048
171 HZ3 LYS 22 HZ3 LYS 22 20.688 14.333 15.555
172 H CYS 23 H CYS 23 16.283 18.773 19.304
173 HA CYS 23 HA CYS 23 17.607 19.224 21.850
174 HB2 CYS 23 HB2 CYS 23 16.677 21.426 21.259
175 HB3 CYS 23 HB3 CYS 23 15.062 20.781 21.356
176 H ILE 24 H ILE 24 17.448 17.018 21.421
177 HA ILE 24 HA ILE 24 14.954 15.616 22.134
178 HB ILE 24 HB ILE 24 17.783 14.532 21.891
179 HG12 ILE 24 HG12 ILE 24 15.685 14.624 19.660
180 HG13 ILE 24 HG13 ILE 24 17.090 15.685 19.737
181 HG21 ILE 24 HG21 ILE 24 15.047 13.182 21.629
182 HG22 ILE 24 HG22 ILE 24 16.618 12.363 21.507
183 HG23 ILE 24 HG23 ILE 24 16.120 13.056 23.039
184 HD11 ILE 24 HD11 ILE 24 17.575 13.946 18.194
185 HD12 ILE 24 HD12 ILE 24 18.613 13.761 19.618
186 HD13 ILE 24 HD13 ILE 24 17.213 12.689 19.383
187 H GLY 25 H GLY 25 14.530 14.734 24.172
188 HA2 GLY 25 HA2 GLY 25 14.703 14.459 26.470
189 HA3 GLY 25 HA3 GLY 25 16.420 14.839 26.382
190 H GLU 26 H GLU 26 17.074 16.744 27.139
191 HA GLU 26 HA GLU 26 15.175 19.029 27.422
192 HB2 GLU 26 HB2 GLU 26 16.909 17.987 29.691
193 HB3 GLU 26 HB3 GLU 26 15.921 19.449 29.716
194 HG2 GLU 26 HG2 GLU 26 13.915 17.938 29.198
195 HG3 GLU 26 HG3 GLU 26 14.957 16.577 29.642
196 H GLU 27 H GLU 27 18.064 18.231 26.015
197 HA GLU 27 HA GLU 27 19.332 20.849 26.773
198 HB2 GLU 27 HB2 GLU 27 20.617 18.834 27.422
199 HB3 GLU 27 HB3 GLU 27 20.730 18.378 25.716
200 HG2 GLU 27 HG2 GLU 27 21.918 20.518 25.236
201 HG3 GLU 27 HG3 GLU 27 21.747 20.992 26.927
202 H CYS 28 H CYS 28 19.359 22.397 25.341
203 HA CYS 28 HA CYS 28 18.543 21.963 22.558
204 HB2 CYS 28 HB2 CYS 28 17.710 23.787 24.079
205 HB3 CYS 28 HB3 CYS 28 19.309 24.504 24.014
206 H LYS 29 H LYS 29 20.024 21.022 21.371
207 HA LYS 29 HA LYS 29 22.864 21.811 21.343
208 HB2 LYS 29 HB2 LYS 29 22.096 19.406 21.383
209 HB3 LYS 29 HB3 LYS 29 21.335 19.636 19.817
210 HG2 LYS 29 HG2 LYS 29 23.553 20.211 18.827
211 HG3 LYS 29 HG3 LYS 29 24.316 19.966 20.395
212 HD2 LYS 29 HD2 LYS 29 22.844 17.869 18.752
213 HD3 LYS 29 HD3 LYS 29 24.592 18.055 18.832
214 HE2 LYS 29 HE2 LYS 29 22.765 17.251 21.140
215 HE3 LYS 29 HE3 LYS 29 23.825 16.184 20.210
216 HZ1 LYS 29 HZ1 LYS 29 24.673 18.367 22.019
217 HZ2 LYS 29 HZ2 LYS 29 24.920 16.770 22.232
218 HZ3 LYS 29 HZ3 LYS 29 25.722 17.555 21.035
219 H CYS 30 H CYS 30 23.865 22.811 19.610
220 HA CYS 30 HA CYS 30 22.354 22.892 17.058
221 HB2 CYS 30 HB2 CYS 30 24.417 25.007 17.482
222 HB3 CYS 30 HB3 CYS 30 23.108 24.915 16.276
223 H VAL 31 H VAL 31 23.485 22.314 15.296
224 HA VAL 31 HA VAL 31 25.970 20.806 15.913
225 HB VAL 31 HB VAL 31 23.942 19.534 16.455
226 HG11 VAL 31 HG11 VAL 31 22.538 18.583 14.745
227 HG12 VAL 31 HG12 VAL 31 22.414 20.341 14.674
228 HG13 VAL 31 HG13 VAL 31 23.382 19.450 13.461
229 HG21 VAL 31 HG21 VAL 31 26.053 18.440 15.870
230 HG22 VAL 31 HG22 VAL 31 24.657 17.479 15.387
231 HG23 VAL 31 HG23 VAL 31 25.571 18.368 14.155
232 HA PRO 32 HA PRO 32 27.059 22.194 11.820
233 HB2 PRO 32 HB2 PRO 32 29.079 19.949 11.881
234 HB3 PRO 32 HB3 PRO 32 29.295 21.681 11.480
235 HG2 PRO 32 HG2 PRO 32 30.064 20.734 13.887
236 HG3 PRO 32 HG3 PRO 32 29.199 22.302 13.780
237 HD2 PRO 32 HD2 PRO 32 28.035 19.569 14.400
238 HD3 PRO 32 HD3 PRO 32 27.858 21.104 15.301
239 H TYR 33 H TYR 33 25.063 21.568 10.901
240 HA TYR 33 HA TYR 33 24.371 19.078 9.925
241 HB2 TYR 33 HB2 TYR 33 23.064 21.313 10.086
242 HB3 TYR 33 HB3 TYR 33 23.655 21.642 8.474
243 HD1 TYR 33 HD2 TYR 33 21.992 18.979 10.491
244 HD2 TYR 33 HD1 TYR 33 22.302 20.912 6.673
245 HE1 TYR 33 HE2 TYR 33 20.241 17.419 9.559
246 HE2 TYR 33 HE1 TYR 33 20.495 19.448 5.757
247 HH TYR 33 HH TYR 33 18.941 17.839 6.253
Start of MODEL 13
1 H1 GLY 1 H1 GLY 1 18.237 19.946 34.319
2 H2 GLY 1 H2 GLY 1 17.001 19.456 33.336
3 H3 GLY 1 H3 GLY 1 16.965 19.119 34.957
4 HA2 GLY 1 HA2 GLY 1 16.775 21.432 35.486
5 HA3 GLY 1 HA3 GLY 1 16.843 21.808 33.760
6 H SER 2 H SER 2 14.975 21.674 32.538
7 HA SER 2 HA SER 2 12.433 21.280 33.973
8 HB2 SER 2 HB2 SER 2 11.444 22.279 31.998
9 HB3 SER 2 HB3 SER 2 12.860 23.239 32.484
10 HG SER 2 HG SER 2 12.815 22.779 30.223
11 H ALA 3 H ALA 3 14.417 19.316 31.962
12 HA ALA 3 HA ALA 3 14.174 17.547 30.651
13 HB1 ALA 3 HB1 ALA 3 11.666 16.907 32.236
14 HB2 ALA 3 HB2 ALA 3 12.611 15.777 31.250
15 HB3 ALA 3 HB3 ALA 3 13.320 16.468 32.702
16 H PHE 4 H PHE 4 12.817 20.129 29.849
17 HA PHE 4 HA PHE 4 11.119 19.025 27.657
18 HB2 PHE 4 HB2 PHE 4 9.685 20.006 29.370
19 HB3 PHE 4 HB3 PHE 4 10.617 21.500 29.347
20 HD1 PHE 4 HD2 PHE 4 10.489 23.050 27.400
21 HD2 PHE 4 HD1 PHE 4 8.060 19.495 27.602
22 HE1 PHE 4 HE2 PHE 4 9.096 23.899 25.537
23 HE2 PHE 4 HE1 PHE 4 6.656 20.359 25.742
24 HZ PHE 4 HZ PHE 4 7.173 22.559 24.705
25 H CYS 5 H CYS 5 11.224 19.969 25.727
26 HA CYS 5 HA CYS 5 12.317 22.575 25.242
27 HB2 CYS 5 HB2 CYS 5 14.414 21.161 25.288
28 HB3 CYS 5 HB3 CYS 5 13.731 20.150 24.022
29 H ASN 6 H ASN 6 11.688 23.230 22.938
30 HA ASN 6 HA ASN 6 10.026 21.147 21.546
31 HB2 ASN 6 HB2 ASN 6 8.740 23.236 21.994
32 HB3 ASN 6 HB3 ASN 6 9.941 24.140 21.053
33 HD21 ASN 6 HD22 ASN 6 7.485 21.557 20.879
34 HD22 ASN 6 HD21 ASN 6 7.358 21.601 19.121
35 H LEU 7 H LEU 7 11.274 20.041 20.118
36 HA LEU 7 HA LEU 7 13.864 20.918 19.557
37 HB2 LEU 7 HB2 LEU 7 13.148 18.575 19.415
38 HB3 LEU 7 HB3 LEU 7 12.355 18.893 17.879
39 HG LEU 7 HG LEU 7 15.276 19.664 18.198
40 HD11 LEU 7 HD11 LEU 7 15.951 17.376 17.567
41 HD12 LEU 7 HD12 LEU 7 15.097 17.362 19.102
42 HD13 LEU 7 HD13 LEU 7 14.269 16.850 17.634
43 HD21 LEU 7 HD21 LEU 7 13.727 18.472 15.856
44 HD22 LEU 7 HD22 LEU 7 14.179 20.169 16.007
45 HD23 LEU 7 HD23 LEU 7 15.423 18.961 15.832
46 H ARG 8 H ARG 8 11.032 21.277 17.361
47 HA ARG 8 HA ARG 8 12.455 22.492 15.238
48 HB2 ARG 8 HB2 ARG 8 10.076 21.695 15.207
49 HB3 ARG 8 HB3 ARG 8 9.589 23.107 16.147
50 HG2 ARG 8 HG2 ARG 8 11.111 23.470 13.568
51 HG3 ARG 8 HG3 ARG 8 9.412 23.008 13.484
52 HD2 ARG 8 HD2 ARG 8 8.687 25.004 14.594
53 HD3 ARG 8 HD3 ARG 8 10.338 25.473 15.013
54 HE ARG 8 HE ARG 8 10.284 25.163 12.213
55 HH11 ARG 8 HH11 ARG 8 8.803 27.453 14.512
56 HH12 ARG 8 HH12 ARG 8 8.905 28.739 13.362
57 HH21 ARG 8 HH21 ARG 8 10.046 26.778 10.772
58 HH22 ARG 8 HH22 ARG 8 9.447 28.350 11.284
59 H ARG 9 H ARG 9 11.208 24.002 18.178
60 HA ARG 9 HA ARG 9 11.773 26.708 17.374
61 HB2 ARG 9 HB2 ARG 9 10.225 25.650 19.251
62 HB3 ARG 9 HB3 ARG 9 11.652 25.839 20.273
63 HG2 ARG 9 HG2 ARG 9 11.650 28.261 19.863
64 HG3 ARG 9 HG3 ARG 9 10.453 28.077 18.579
65 HD2 ARG 9 HD2 ARG 9 9.271 28.834 20.504
66 HD3 ARG 9 HD3 ARG 9 8.821 27.149 20.229
67 HE ARG 9 HE ARG 9 10.880 27.985 22.254
68 HH11 ARG 9 HH11 ARG 9 7.785 26.303 21.770
69 HH12 ARG 9 HH12 ARG 9 7.646 26.080 23.509
70 HH21 ARG 9 HH21 ARG 9 10.623 27.398 24.383
71 HH22 ARG 9 HH22 ARG 9 9.122 26.633 24.858
72 H CYS 10 H CYS 10 13.674 24.283 19.137
73 HA CYS 10 HA CYS 10 15.962 26.101 19.440
74 HB2 CYS 10 HB2 CYS 10 15.282 23.339 20.200
75 HB3 CYS 10 HB3 CYS 10 16.980 23.610 19.775
76 H GLU 11 H GLU 11 14.913 23.702 17.000
77 HA GLU 11 HA GLU 11 17.188 23.375 15.528
78 HB2 GLU 11 HB2 GLU 11 14.821 22.498 15.125
79 HB3 GLU 11 HB3 GLU 11 14.620 23.897 14.065
80 HG2 GLU 11 HG2 GLU 11 17.056 22.126 13.757
81 HG3 GLU 11 HG3 GLU 11 15.502 21.503 13.242
82 H LEU 12 H LEU 12 14.788 25.883 15.140
83 HA LEU 12 HA LEU 12 16.120 27.627 13.388
84 HB2 LEU 12 HB2 LEU 12 13.710 27.290 13.692
85 HB3 LEU 12 HB3 LEU 12 13.800 27.889 15.343
86 HG LEU 12 HG LEU 12 14.234 30.132 14.626
87 HD11 LEU 12 HD11 LEU 12 14.240 30.771 12.223
88 HD12 LEU 12 HD12 LEU 12 15.656 29.824 12.658
89 HD13 LEU 12 HD13 LEU 12 14.309 29.055 11.777
90 HD21 LEU 12 HD21 LEU 12 11.881 29.270 14.580
91 HD22 LEU 12 HD22 LEU 12 12.155 30.598 13.443
92 HD23 LEU 12 HD23 LEU 12 12.065 28.927 12.849
93 H SER 13 H SER 13 15.956 27.618 16.990
94 HA SER 13 HA SER 13 17.262 30.154 17.397
95 HB2 SER 13 HB2 SER 13 17.433 27.668 19.148
96 HB3 SER 13 HB3 SER 13 17.834 29.322 19.623
97 HG SER 13 HG SER 13 15.250 28.391 18.810
98 H CYS 14 H CYS 14 18.541 26.897 16.848
99 HA CYS 14 HA CYS 14 21.362 27.495 17.106
100 HB2 CYS 14 HB2 CYS 14 19.598 25.291 16.068
101 HB3 CYS 14 HB3 CYS 14 21.332 25.210 15.885
102 H ARG 15 H ARG 15 19.251 28.322 14.526
103 HA ARG 15 HA ARG 15 21.261 27.919 12.399
104 HB2 ARG 15 HB2 ARG 15 18.642 29.243 12.749
105 HB3 ARG 15 HB3 ARG 15 19.470 29.323 11.162
106 HG2 ARG 15 HG2 ARG 15 19.523 26.821 11.088
107 HG3 ARG 15 HG3 ARG 15 18.621 26.764 12.595
108 HD2 ARG 15 HD2 ARG 15 16.970 28.440 11.363
109 HD3 ARG 15 HD3 ARG 15 17.804 27.947 9.887
110 HE ARG 15 HE ARG 15 16.844 25.607 11.265
111 HH11 ARG 15 HH21 ARG 15 15.618 28.449 9.526
112 HH12 ARG 15 HH22 ARG 15 14.154 27.584 9.075
113 HH21 ARG 15 HH11 ARG 15 14.915 24.634 10.573
114 HH22 ARG 15 HH12 ARG 15 13.735 25.619 9.716
115 H SER 16 H SER 16 20.401 30.494 14.537
116 HA SER 16 HA SER 16 21.444 32.846 13.497
117 HB2 SER 16 HB2 SER 16 21.601 31.586 16.271
118 HB3 SER 16 HB3 SER 16 21.856 33.308 15.936
119 HG SER 16 HG SER 16 19.790 33.049 16.560
120 H LEU 17 H LEU 17 23.183 30.202 13.394
121 HA LEU 17 HA LEU 17 25.846 31.041 14.400
122 HB2 LEU 17 HB2 LEU 17 24.627 28.283 14.664
123 HB3 LEU 17 HB3 LEU 17 25.928 28.987 15.606
124 HG LEU 17 HG LEU 17 22.921 29.586 15.893
125 HD11 LEU 17 HD11 LEU 17 23.703 27.335 16.688
126 HD12 LEU 17 HD12 LEU 17 24.935 28.123 17.677
127 HD13 LEU 17 HD13 LEU 17 23.224 28.389 18.035
128 HD21 LEU 17 HD21 LEU 17 24.403 31.548 16.590
129 HD22 LEU 17 HD22 LEU 17 23.560 30.788 17.942
130 HD23 LEU 17 HD23 LEU 17 25.278 30.455 17.651
131 H GLY 18 H GLY 18 24.021 29.904 11.756
132 HA2 GLY 18 HA2 GLY 18 24.582 28.935 9.739
133 HA3 GLY 18 HA3 GLY 18 26.230 28.650 10.299
134 H LEU 19 H LEU 19 23.781 27.402 12.445
135 HA LEU 19 HA LEU 19 24.506 24.631 11.591
136 HB2 LEU 19 HB2 LEU 19 23.858 25.588 14.393
137 HB3 LEU 19 HB3 LEU 19 24.507 24.042 13.928
138 HG LEU 19 HG LEU 19 25.918 26.706 13.835
139 HD11 LEU 19 HD11 LEU 19 25.734 25.821 16.061
140 HD12 LEU 19 HD12 LEU 19 26.329 24.220 15.533
141 HD13 LEU 19 HD13 LEU 19 27.400 25.630 15.511
142 HD21 LEU 19 HD21 LEU 19 26.746 25.286 11.946
143 HD22 LEU 19 HD22 LEU 19 27.961 25.421 13.210
144 HD23 LEU 19 HD23 LEU 19 26.988 23.943 13.080
145 H LEU 20 H LEU 20 23.050 23.033 12.916
146 HA LEU 20 HA LEU 20 20.129 23.623 12.602
147 HB2 LEU 20 HB2 LEU 20 20.673 21.951 11.016
148 HB3 LEU 20 HB3 LEU 20 21.792 21.128 12.104
149 HG LEU 20 HG LEU 20 18.922 21.228 12.961
150 HD11 LEU 20 HD11 LEU 20 19.919 19.424 10.734
151 HD12 LEU 20 HD12 LEU 20 18.352 19.297 11.568
152 HD13 LEU 20 HD13 LEU 20 18.713 20.720 10.585
153 HD21 LEU 20 HD21 LEU 20 19.372 18.948 13.714
154 HD22 LEU 20 HD22 LEU 20 20.965 18.955 12.921
155 HD23 LEU 20 HD23 LEU 20 20.658 19.985 14.327
156 H GLY 21 H GLY 21 18.902 23.239 14.384
157 HA2 GLY 21 HA2 GLY 21 20.298 22.459 16.889
158 HA3 GLY 21 HA3 GLY 21 18.722 23.174 16.831
159 H LYS 22 H LYS 22 20.040 20.594 17.923
160 HA LYS 22 HA LYS 22 17.814 18.749 17.156
161 HB2 LYS 22 HB2 LYS 22 20.062 18.107 16.129
162 HB3 LYS 22 HB3 LYS 22 20.655 17.855 17.765
163 HG2 LYS 22 HG2 LYS 22 20.015 15.700 17.040
164 HG3 LYS 22 HG3 LYS 22 18.701 16.201 18.074
165 HD2 LYS 22 HD2 LYS 22 17.544 15.311 16.268
166 HD3 LYS 22 HD3 LYS 22 17.520 17.022 15.880
167 HE2 LYS 22 HE2 LYS 22 18.044 15.828 13.886
168 HE3 LYS 22 HE3 LYS 22 19.514 16.683 14.383
169 HZ1 LYS 22 HZ1 LYS 22 20.432 14.641 15.166
170 HZ2 LYS 22 HZ2 LYS 22 18.986 13.840 15.065
171 HZ3 LYS 22 HZ3 LYS 22 19.784 14.314 13.703
172 H CYS 23 H CYS 23 17.054 20.175 18.991
173 HA CYS 23 HA CYS 23 18.016 19.642 21.659
174 HB2 CYS 23 HB2 CYS 23 16.969 21.747 20.794
175 HB3 CYS 23 HB3 CYS 23 15.407 20.931 20.880
176 H ILE 24 H ILE 24 17.908 17.416 21.878
177 HA ILE 24 HA ILE 24 15.209 16.160 22.164
178 HB ILE 24 HB ILE 24 17.956 14.876 21.995
179 HG12 ILE 24 HG12 ILE 24 15.630 14.988 20.006
180 HG13 ILE 24 HG13 ILE 24 17.133 15.903 19.864
181 HG21 ILE 24 HG21 ILE 24 15.174 13.610 22.110
182 HG22 ILE 24 HG22 ILE 24 16.714 12.735 21.906
183 HG23 ILE 24 HG23 ILE 24 16.383 13.557 23.415
184 HD11 ILE 24 HD11 ILE 24 18.419 13.800 19.695
185 HD12 ILE 24 HD12 ILE 24 16.880 12.895 19.694
186 HD13 ILE 24 HD13 ILE 24 17.237 14.031 18.389
187 H GLY 25 H GLY 25 14.411 15.643 24.125
188 HA2 GLY 25 HA2 GLY 25 14.202 15.690 26.435
189 HA3 GLY 25 HA3 GLY 25 15.963 15.660 26.603
190 H GLU 26 H GLU 26 17.111 17.609 26.700
191 HA GLU 26 HA GLU 26 15.514 20.138 26.977
192 HB2 GLU 26 HB2 GLU 26 15.947 18.751 29.080
193 HB3 GLU 26 HB3 GLU 26 17.659 19.132 28.881
194 HG2 GLU 26 HG2 GLU 26 17.091 21.567 29.079
195 HG3 GLU 26 HG3 GLU 26 15.393 21.127 29.303
196 H GLU 27 H GLU 27 18.465 18.739 25.678
197 HA GLU 27 HA GLU 27 20.002 20.820 26.745
198 HB2 GLU 27 HB2 GLU 27 21.814 19.567 26.417
199 HB3 GLU 27 HB3 GLU 27 20.620 18.308 26.239
200 HG2 GLU 27 HG2 GLU 27 22.116 19.722 23.984
201 HG3 GLU 27 HG3 GLU 27 22.472 18.142 24.648
202 H CYS 28 H CYS 28 18.509 21.023 23.793
203 HA CYS 28 HA CYS 28 18.738 22.271 21.922
204 HB2 CYS 28 HB2 CYS 28 18.222 23.886 23.870
205 HB3 CYS 28 HB3 CYS 28 19.864 24.455 23.639
206 H LYS 29 H LYS 29 20.703 20.466 21.923
207 HA LYS 29 HA LYS 29 23.329 21.413 21.324
208 HB2 LYS 29 HB2 LYS 29 22.648 18.972 21.492
209 HB3 LYS 29 HB3 LYS 29 21.813 19.152 19.926
210 HG2 LYS 29 HG2 LYS 29 23.900 19.716 18.833
211 HG3 LYS 29 HG3 LYS 29 24.778 19.682 20.348
212 HD2 LYS 29 HD2 LYS 29 25.099 17.692 18.875
213 HD3 LYS 29 HD3 LYS 29 24.603 17.334 20.537
214 HE2 LYS 29 HE2 LYS 29 22.286 16.943 19.790
215 HE3 LYS 29 HE3 LYS 29 22.735 17.340 18.118
216 HZ1 LYS 29 HZ1 LYS 29 22.694 14.899 18.593
217 HZ2 LYS 29 HZ2 LYS 29 24.140 15.408 18.067
218 HZ3 LYS 29 HZ3 LYS 29 23.916 15.105 19.669
219 H CYS 30 H CYS 30 24.196 22.381 19.517
220 HA CYS 30 HA CYS 30 22.513 22.500 17.085
221 HB2 CYS 30 HB2 CYS 30 24.566 24.633 17.550
222 HB3 CYS 30 HB3 CYS 30 23.181 24.621 16.418
223 H VAL 31 H VAL 31 23.500 21.996 15.286
224 HA VAL 31 HA VAL 31 26.090 20.553 15.473
225 HB VAL 31 HB VAL 31 23.602 19.580 14.015
226 HG11 VAL 31 HG11 VAL 31 25.999 18.218 15.322
227 HG12 VAL 31 HG12 VAL 31 24.721 17.401 14.400
228 HG13 VAL 31 HG13 VAL 31 25.817 18.512 13.579
229 HG21 VAL 31 HG21 VAL 31 23.039 18.141 15.907
230 HG22 VAL 31 HG22 VAL 31 24.302 18.910 16.883
231 HG23 VAL 31 HG23 VAL 31 22.849 19.825 16.375
232 HA PRO 32 HA PRO 32 26.602 22.296 11.263
233 HB2 PRO 32 HB2 PRO 32 28.873 20.346 11.117
234 HB3 PRO 32 HB3 PRO 32 28.846 22.087 10.755
235 HG2 PRO 32 HG2 PRO 32 29.996 21.148 13.027
236 HG3 PRO 32 HG3 PRO 32 29.065 22.670 13.046
237 HD2 PRO 32 HD2 PRO 32 28.142 19.883 13.850
238 HD3 PRO 32 HD3 PRO 32 27.946 21.439 14.721
239 H TYR 33 H TYR 33 24.765 21.470 10.408
240 HA TYR 33 HA TYR 33 24.196 18.673 10.009
241 HB2 TYR 33 HB2 TYR 33 22.363 19.439 8.570
242 HB3 TYR 33 HB3 TYR 33 22.386 20.185 10.150
243 HD1 TYR 33 HD1 TYR 33 22.874 20.731 6.530
244 HD2 TYR 33 HD2 TYR 33 22.872 22.545 10.428
245 HE1 TYR 33 HE1 TYR 33 22.761 22.982 5.466
246 HE2 TYR 33 HE2 TYR 33 22.716 24.825 9.361
247 HH TYR 33 HH TYR 33 22.495 25.974 7.410
Start of MODEL 14
1 H1 GLY 1 H1 GLY 1 14.437 18.095 34.384
2 H2 GLY 1 H2 GLY 1 13.277 18.585 33.300
3 H3 GLY 1 H3 GLY 1 13.622 19.506 34.602
4 HA2 GLY 1 HA2 GLY 1 15.894 19.842 33.792
5 HA3 GLY 1 HA3 GLY 1 15.397 18.991 32.318
6 H SER 2 H SER 2 16.314 21.531 31.912
7 HA SER 2 HA SER 2 14.762 23.730 32.380
8 HB2 SER 2 HB2 SER 2 16.323 23.090 29.861
9 HB3 SER 2 HB3 SER 2 15.661 24.712 30.259
10 HG SER 2 HG SER 2 17.766 24.605 30.959
11 H ALA 3 H ALA 3 13.046 24.856 31.583
12 HA ALA 3 HA ALA 3 10.926 23.132 30.774
13 HB1 ALA 3 HB1 ALA 3 10.947 26.147 31.167
14 HB2 ALA 3 HB2 ALA 3 9.518 25.086 31.177
15 HB3 ALA 3 HB3 ALA 3 10.747 24.938 32.449
16 H PHE 4 H PHE 4 9.450 23.259 29.097
17 HA PHE 4 HA PHE 4 8.889 23.146 26.907
18 HB2 PHE 4 HB2 PHE 4 9.309 26.123 27.262
19 HB3 PHE 4 HB3 PHE 4 8.353 25.385 25.998
20 HD1 PHE 4 HD2 PHE 4 6.396 23.828 26.662
21 HD2 PHE 4 HD1 PHE 4 8.218 26.691 29.325
22 HE1 PHE 4 HE2 PHE 4 4.369 23.784 28.094
23 HE2 PHE 4 HE1 PHE 4 6.175 26.668 30.738
24 HZ PHE 4 HZ PHE 4 4.255 25.209 30.135
25 H CYS 5 H CYS 5 11.742 22.562 27.002
26 HA CYS 5 HA CYS 5 12.979 23.905 24.749
27 HB2 CYS 5 HB2 CYS 5 14.205 22.851 26.644
28 HB3 CYS 5 HB3 CYS 5 13.776 21.272 26.015
29 H ASN 6 H ASN 6 11.980 23.777 22.853
30 HA ASN 6 HA ASN 6 10.876 21.200 21.830
31 HB2 ASN 6 HB2 ASN 6 9.467 23.254 21.820
32 HB3 ASN 6 HB3 ASN 6 10.659 24.070 20.810
33 HD21 ASN 6 HD22 ASN 6 8.343 24.195 19.636
34 HD22 ASN 6 HD21 ASN 6 8.083 22.863 18.508
35 H LEU 7 H LEU 7 11.998 20.059 20.197
36 HA LEU 7 HA LEU 7 14.619 20.948 19.369
37 HB2 LEU 7 HB2 LEU 7 14.042 18.595 19.287
38 HB3 LEU 7 HB3 LEU 7 12.804 18.886 18.071
39 HG LEU 7 HG LEU 7 15.584 19.900 17.375
40 HD11 LEU 7 HD11 LEU 7 16.270 17.618 16.661
41 HD12 LEU 7 HD12 LEU 7 16.046 17.653 18.422
42 HD13 LEU 7 HD13 LEU 7 14.805 16.938 17.385
43 HD21 LEU 7 HD21 LEU 7 14.995 19.044 15.174
44 HD22 LEU 7 HD22 LEU 7 13.546 18.256 15.811
45 HD23 LEU 7 HD23 LEU 7 13.658 20.026 15.754
46 H ARG 8 H ARG 8 11.371 21.402 17.912
47 HA ARG 8 HA ARG 8 12.303 22.451 15.421
48 HB2 ARG 8 HB2 ARG 8 9.924 21.716 16.357
49 HB3 ARG 8 HB3 ARG 8 9.753 23.418 16.771
50 HG2 ARG 8 HG2 ARG 8 10.400 22.305 14.020
51 HG3 ARG 8 HG3 ARG 8 8.773 22.712 14.591
52 HD2 ARG 8 HD2 ARG 8 9.101 24.726 13.637
53 HD3 ARG 8 HD3 ARG 8 10.074 25.092 15.052
54 HE ARG 8 HE ARG 8 12.035 24.890 13.774
55 HH11 ARG 8 HH11 ARG 8 9.346 23.625 11.825
56 HH12 ARG 8 HH12 ARG 8 10.391 23.475 10.428
57 HH21 ARG 8 HH21 ARG 8 13.250 24.504 11.827
58 HH22 ARG 8 HH22 ARG 8 12.328 24.057 10.416
59 H ARG 9 H ARG 9 11.743 24.097 18.506
60 HA ARG 9 HA ARG 9 12.436 26.733 17.376
61 HB2 ARG 9 HB2 ARG 9 10.578 26.234 19.069
62 HB3 ARG 9 HB3 ARG 9 11.861 26.112 20.287
63 HG2 ARG 9 HG2 ARG 9 12.518 28.438 19.861
64 HG3 ARG 9 HG3 ARG 9 11.459 28.519 18.455
65 HD2 ARG 9 HD2 ARG 9 10.379 29.678 20.239
66 HD3 ARG 9 HD3 ARG 9 9.465 28.213 19.928
67 HE ARG 9 HE ARG 9 11.187 28.832 22.281
68 HH11 ARG 9 HH11 ARG 9 8.811 26.568 20.931
69 HH12 ARG 9 HH12 ARG 9 8.646 25.767 22.474
70 HH21 ARG 9 HH21 ARG 9 10.970 27.681 24.096
71 HH22 ARG 9 HH22 ARG 9 10.043 26.193 24.112
72 H CYS 10 H CYS 10 14.047 24.234 19.294
73 HA CYS 10 HA CYS 10 16.477 25.753 19.788
74 HB2 CYS 10 HB2 CYS 10 16.011 23.723 21.019
75 HB3 CYS 10 HB3 CYS 10 15.817 22.809 19.526
76 H GLU 11 H GLU 11 15.286 23.654 17.070
77 HA GLU 11 HA GLU 11 17.562 23.648 15.518
78 HB2 GLU 11 HB2 GLU 11 15.558 22.280 15.177
79 HB3 GLU 11 HB3 GLU 11 14.748 23.665 14.444
80 HG2 GLU 11 HG2 GLU 11 17.301 23.285 13.179
81 HG3 GLU 11 HG3 GLU 11 16.612 21.700 13.381
82 H LEU 12 H LEU 12 14.851 25.950 15.349
83 HA LEU 12 HA LEU 12 16.146 27.633 13.472
84 HB2 LEU 12 HB2 LEU 12 13.792 27.827 15.318
85 HB3 LEU 12 HB3 LEU 12 14.268 29.272 14.402
86 HG LEU 12 HG LEU 12 13.743 26.579 13.067
87 HD11 LEU 12 HD11 LEU 12 11.534 27.470 12.460
88 HD12 LEU 12 HD12 LEU 12 11.700 27.366 14.223
89 HD13 LEU 12 HD13 LEU 12 11.844 28.935 13.413
90 HD21 LEU 12 HD21 LEU 12 13.788 29.430 11.961
91 HD22 LEU 12 HD22 LEU 12 15.061 28.226 11.709
92 HD23 LEU 12 HD23 LEU 12 13.450 27.953 11.038
93 H SER 13 H SER 13 16.112 27.824 17.053
94 HA SER 13 HA SER 13 17.418 30.384 17.228
95 HB2 SER 13 HB2 SER 13 17.523 28.078 19.209
96 HB3 SER 13 HB3 SER 13 17.925 29.776 19.532
97 HG SER 13 HG SER 13 15.435 28.561 19.021
98 H CYS 14 H CYS 14 18.680 27.107 16.859
99 HA CYS 14 HA CYS 14 21.524 27.807 16.870
100 HB2 CYS 14 HB2 CYS 14 19.821 25.424 16.128
101 HB3 CYS 14 HB3 CYS 14 21.549 25.455 15.907
102 H ARG 15 H ARG 15 19.002 27.720 14.340
103 HA ARG 15 HA ARG 15 20.969 27.630 12.202
104 HB2 ARG 15 HB2 ARG 15 18.105 28.195 12.553
105 HB3 ARG 15 HB3 ARG 15 18.792 28.431 10.930
106 HG2 ARG 15 HG2 ARG 15 19.464 26.147 10.722
107 HG3 ARG 15 HG3 ARG 15 19.114 25.777 12.403
108 HD2 ARG 15 HD2 ARG 15 17.383 24.911 10.832
109 HD3 ARG 15 HD3 ARG 15 16.713 26.040 12.014
110 HE ARG 15 HE ARG 15 17.277 27.675 9.859
111 HH11 ARG 15 HH12 ARG 15 15.169 24.889 10.224
112 HH12 ARG 15 HH11 ARG 15 14.310 25.342 8.728
113 HH21 ARG 15 HH21 ARG 15 16.035 28.236 8.283
114 HH22 ARG 15 HH22 ARG 15 14.691 27.247 7.744
115 H SER 16 H SER 16 19.902 30.193 14.178
116 HA SER 16 HA SER 16 20.552 32.546 12.774
117 HB2 SER 16 HB2 SER 16 21.505 31.740 15.558
118 HB3 SER 16 HB3 SER 16 21.232 33.383 14.966
119 HG SER 16 HG SER 16 19.552 31.908 16.247
120 H LEU 17 H LEU 17 22.532 29.809 13.100
121 HA LEU 17 HA LEU 17 25.115 31.224 13.172
122 HB2 LEU 17 HB2 LEU 17 24.461 28.401 14.024
123 HB3 LEU 17 HB3 LEU 17 25.802 29.408 14.555
124 HG LEU 17 HG LEU 17 22.847 29.797 15.371
125 HD11 LEU 17 HD11 LEU 17 25.222 28.748 16.950
126 HD12 LEU 17 HD12 LEU 17 23.573 28.985 17.555
127 HD13 LEU 17 HD13 LEU 17 23.900 27.748 16.328
128 HD21 LEU 17 HD21 LEU 17 25.367 31.107 16.426
129 HD22 LEU 17 HD22 LEU 17 24.178 31.914 15.400
130 HD23 LEU 17 HD23 LEU 17 23.713 31.357 17.015
131 H GLY 18 H GLY 18 23.129 29.788 10.960
132 HA2 GLY 18 HA2 GLY 18 23.471 28.925 8.853
133 HA3 GLY 18 HA3 GLY 18 25.219 29.025 9.092
134 H LEU 19 H LEU 19 23.379 27.193 11.448
135 HA LEU 19 HA LEU 19 24.025 24.606 10.216
136 HB2 LEU 19 HB2 LEU 19 25.430 23.933 12.087
137 HB3 LEU 19 HB3 LEU 19 26.069 25.273 11.176
138 HG LEU 19 HG LEU 19 25.416 26.843 12.969
139 HD11 LEU 19 HD11 LEU 19 23.615 25.646 14.095
140 HD12 LEU 19 HD12 LEU 19 24.729 24.320 14.494
141 HD13 LEU 19 HD13 LEU 19 24.951 25.935 15.208
142 HD21 LEU 19 HD21 LEU 19 27.689 25.851 12.866
143 HD22 LEU 19 HD22 LEU 19 27.183 26.165 14.527
144 HD23 LEU 19 HD23 LEU 19 27.144 24.507 13.886
145 H LEU 20 H LEU 20 23.527 22.898 12.345
146 HA LEU 20 HA LEU 20 20.581 23.062 12.245
147 HB2 LEU 20 HB2 LEU 20 22.157 20.980 11.807
148 HB3 LEU 20 HB3 LEU 20 22.296 20.928 13.528
149 HG LEU 20 HG LEU 20 19.854 20.521 13.766
150 HD11 LEU 20 HD11 LEU 20 19.859 20.291 10.726
151 HD12 LEU 20 HD12 LEU 20 18.509 19.941 11.808
152 HD13 LEU 20 HD13 LEU 20 19.069 21.606 11.626
153 HD21 LEU 20 HD21 LEU 20 19.900 18.245 12.879
154 HD22 LEU 20 HD22 LEU 20 21.286 18.643 11.850
155 HD23 LEU 20 HD23 LEU 20 21.463 18.671 13.613
156 H GLY 21 H GLY 21 19.285 22.537 14.149
157 HA2 GLY 21 HA2 GLY 21 20.700 22.527 16.757
158 HA3 GLY 21 HA3 GLY 21 19.217 23.422 16.677
159 H LYS 22 H LYS 22 20.014 21.090 18.230
160 HA LYS 22 HA LYS 22 17.635 19.397 17.726
161 HB2 LYS 22 HB2 LYS 22 20.424 18.369 18.397
162 HB3 LYS 22 HB3 LYS 22 18.937 17.415 18.506
163 HG2 LYS 22 HG2 LYS 22 18.529 17.892 16.062
164 HG3 LYS 22 HG3 LYS 22 20.146 18.610 15.982
165 HD2 LYS 22 HD2 LYS 22 21.100 16.427 16.769
166 HD3 LYS 22 HD3 LYS 22 19.455 15.743 16.776
167 HE2 LYS 22 HE2 LYS 22 19.276 16.396 14.325
168 HE3 LYS 22 HE3 LYS 22 20.986 16.839 14.379
169 HZ1 LYS 22 HZ1 LYS 22 21.506 14.550 14.974
170 HZ2 LYS 22 HZ2 LYS 22 19.904 14.123 14.857
171 HZ3 LYS 22 HZ3 LYS 22 20.709 14.632 13.542
172 H CYS 23 H CYS 23 16.376 19.381 19.476
173 HA CYS 23 HA CYS 23 17.650 19.189 22.141
174 HB2 CYS 23 HB2 CYS 23 16.968 21.453 22.157
175 HB3 CYS 23 HB3 CYS 23 15.394 21.082 21.488
176 H ILE 24 H ILE 24 17.455 17.038 21.829
177 HA ILE 24 HA ILE 24 14.846 15.707 21.568
178 HB ILE 24 HB ILE 24 17.598 14.541 22.136
179 HG12 ILE 24 HG12 ILE 24 16.222 15.018 19.447
180 HG13 ILE 24 HG13 ILE 24 17.687 15.816 20.031
181 HG21 ILE 24 HG21 ILE 24 16.612 12.428 21.307
182 HG22 ILE 24 HG22 ILE 24 15.669 13.027 22.655
183 HG23 ILE 24 HG23 ILE 24 15.067 13.246 21.000
184 HD11 ILE 24 HD11 ILE 24 18.860 13.606 20.053
185 HD12 ILE 24 HD12 ILE 24 17.435 12.900 19.244
186 HD13 ILE 24 HD13 ILE 24 18.359 14.180 18.450
187 H GLY 25 H GLY 25 17.349 16.095 24.107
188 HA2 GLY 25 HA2 GLY 25 15.475 14.998 26.190
189 HA3 GLY 25 HA3 GLY 25 17.223 14.794 26.180
190 H GLU 26 H GLU 26 14.807 17.445 26.104
191 HA GLU 26 HA GLU 26 14.695 19.494 27.056
192 HB2 GLU 26 HB2 GLU 26 16.082 18.170 29.404
193 HB3 GLU 26 HB3 GLU 26 15.085 19.625 29.449
194 HG2 GLU 26 HG2 GLU 26 13.112 18.338 28.717
195 HG3 GLU 26 HG3 GLU 26 14.073 16.860 28.645
196 H GLU 27 H GLU 27 17.455 18.730 25.775
197 HA GLU 27 HA GLU 27 19.112 21.009 26.780
198 HB2 GLU 27 HB2 GLU 27 19.630 18.767 27.725
199 HB3 GLU 27 HB3 GLU 27 19.860 18.140 26.092
200 HG2 GLU 27 HG2 GLU 27 21.729 19.812 25.797
201 HG3 GLU 27 HG3 GLU 27 21.533 20.252 27.499
202 H CYS 28 H CYS 28 19.455 22.414 25.139
203 HA CYS 28 HA CYS 28 19.106 21.587 22.347
204 HB2 CYS 28 HB2 CYS 28 17.948 23.550 23.233
205 HB3 CYS 28 HB3 CYS 28 19.493 24.298 23.640
206 H LYS 29 H LYS 29 20.711 20.698 21.376
207 HA LYS 29 HA LYS 29 23.533 21.675 21.493
208 HB2 LYS 29 HB2 LYS 29 22.940 19.194 21.622
209 HB3 LYS 29 HB3 LYS 29 22.224 19.331 20.023
210 HG2 LYS 29 HG2 LYS 29 24.582 20.183 19.274
211 HG3 LYS 29 HG3 LYS 29 25.157 19.554 20.811
212 HD2 LYS 29 HD2 LYS 29 23.730 18.012 18.597
213 HD3 LYS 29 HD3 LYS 29 25.458 17.952 18.917
214 HE2 LYS 29 HE2 LYS 29 23.344 17.090 20.936
215 HE3 LYS 29 HE3 LYS 29 23.975 16.012 19.693
216 HZ1 LYS 29 HZ1 LYS 29 25.156 15.800 21.819
217 HZ2 LYS 29 HZ2 LYS 29 26.177 16.223 20.609
218 HZ3 LYS 29 HZ3 LYS 29 25.684 17.338 21.727
219 H CYS 30 H CYS 30 24.361 22.865 19.717
220 HA CYS 30 HA CYS 30 22.722 22.797 17.219
221 HB2 CYS 30 HB2 CYS 30 24.863 24.842 17.430
222 HB3 CYS 30 HB3 CYS 30 23.412 24.795 16.433
223 H VAL 31 H VAL 31 23.755 22.354 15.289
224 HA VAL 31 HA VAL 31 26.077 20.516 15.704
225 HB VAL 31 HB VAL 31 23.844 19.529 13.990
226 HG11 VAL 31 HG11 VAL 31 25.939 18.301 14.354
227 HG12 VAL 31 HG12 VAL 31 25.622 18.268 16.104
228 HG13 VAL 31 HG13 VAL 31 24.546 17.421 14.978
229 HG21 VAL 31 HG21 VAL 31 22.432 20.267 15.846
230 HG22 VAL 31 HG22 VAL 31 22.667 18.517 15.952
231 HG23 VAL 31 HG23 VAL 31 23.581 19.602 17.021
232 HA PRO 32 HA PRO 32 27.161 22.101 11.567
233 HB2 PRO 32 HB2 PRO 32 29.357 20.049 11.816
234 HB3 PRO 32 HB3 PRO 32 29.444 21.767 11.316
235 HG2 PRO 32 HG2 PRO 32 30.236 21.004 13.791
236 HG3 PRO 32 HG3 PRO 32 29.245 22.491 13.591
237 HD2 PRO 32 HD2 PRO 32 28.283 19.702 14.330
238 HD3 PRO 32 HD3 PRO 32 27.964 21.265 15.148
239 H TYR 33 H TYR 33 25.032 20.519 11.598
240 HA TYR 33 HA TYR 33 23.784 18.770 10.872
241 HB2 TYR 33 HB2 TYR 33 25.274 19.401 8.315
242 HB3 TYR 33 HB3 TYR 33 23.716 18.611 8.433
243 HD1 TYR 33 HD2 TYR 33 21.923 19.982 9.880
244 HD2 TYR 33 HD1 TYR 33 25.288 21.727 7.843
245 HE1 TYR 33 HE2 TYR 33 20.659 22.122 9.608
246 HE2 TYR 33 HE1 TYR 33 24.052 23.890 7.657
247 HH TYR 33 HH TYR 33 20.654 24.187 8.784
Start of MODEL 15
1 H1 GLY 1 H1 GLY 1 11.358 17.339 23.692
2 H2 GLY 1 H2 GLY 1 10.604 17.602 22.244
3 H3 GLY 1 H3 GLY 1 9.846 16.730 23.418
4 HA2 GLY 1 HA2 GLY 1 10.546 19.583 23.545
5 HA3 GLY 1 HA3 GLY 1 8.916 18.924 23.304
6 H SER 2 H SER 2 9.749 20.700 25.367
7 HA SER 2 HA SER 2 8.811 19.351 27.802
8 HB2 SER 2 HB2 SER 2 10.827 20.102 29.076
9 HB3 SER 2 HB3 SER 2 11.186 18.835 27.899
10 HG SER 2 HG SER 2 12.156 20.274 26.596
11 H ALA 3 H ALA 3 8.850 21.061 29.667
12 HA ALA 3 HA ALA 3 7.638 23.533 28.868
13 HB1 ALA 3 HB1 ALA 3 9.014 22.753 31.479
14 HB2 ALA 3 HB2 ALA 3 7.884 24.107 31.256
15 HB3 ALA 3 HB3 ALA 3 7.315 22.437 31.060
16 H PHE 4 H PHE 4 11.003 22.664 29.012
17 HA PHE 4 HA PHE 4 11.981 25.470 29.022
18 HB2 PHE 4 HB2 PHE 4 12.996 23.929 30.584
19 HB3 PHE 4 HB3 PHE 4 13.285 22.745 29.319
20 HD1 PHE 4 HD1 PHE 4 14.221 26.262 30.318
21 HD2 PHE 4 HD2 PHE 4 15.366 22.664 28.231
22 HE1 PHE 4 HE1 PHE 4 16.478 27.213 29.905
23 HE2 PHE 4 HE2 PHE 4 17.621 23.607 27.836
24 HZ PHE 4 HZ PHE 4 18.182 25.890 28.660
25 H CYS 5 H CYS 5 11.540 22.780 26.733
26 HA CYS 5 HA CYS 5 12.759 24.437 24.600
27 HB2 CYS 5 HB2 CYS 5 14.495 22.955 25.744
28 HB3 CYS 5 HB3 CYS 5 13.581 21.569 25.154
29 H ASN 6 H ASN 6 12.186 23.899 22.491
30 HA ASN 6 HA ASN 6 10.755 21.322 22.042
31 HB2 ASN 6 HB2 ASN 6 9.095 23.206 21.804
32 HB3 ASN 6 HB3 ASN 6 10.131 23.943 20.594
33 HD21 ASN 6 HD22 ASN 6 7.699 23.566 19.588
34 HD22 ASN 6 HD21 ASN 6 7.610 22.049 18.695
35 H LEU 7 H LEU 7 11.988 20.047 20.606
36 HA LEU 7 HA LEU 7 14.375 21.018 19.452
37 HB2 LEU 7 HB2 LEU 7 13.830 18.619 19.679
38 HB3 LEU 7 HB3 LEU 7 12.692 18.737 18.339
39 HG LEU 7 HG LEU 7 15.571 19.652 17.932
40 HD11 LEU 7 HD11 LEU 7 14.571 16.766 17.804
41 HD12 LEU 7 HD12 LEU 7 16.177 17.314 17.319
42 HD13 LEU 7 HD13 LEU 7 15.681 17.392 19.024
43 HD21 LEU 7 HD21 LEU 7 15.281 18.820 15.661
44 HD22 LEU 7 HD22 LEU 7 13.689 18.152 16.056
45 HD23 LEU 7 HD23 LEU 7 13.942 19.903 16.004
46 H ARG 8 H ARG 8 11.062 21.137 18.035
47 HA ARG 8 HA ARG 8 11.870 22.130 15.477
48 HB2 ARG 8 HB2 ARG 8 9.589 21.286 16.170
49 HB3 ARG 8 HB3 ARG 8 9.295 22.825 16.977
50 HG2 ARG 8 HG2 ARG 8 10.119 22.767 14.078
51 HG3 ARG 8 HG3 ARG 8 8.466 22.349 14.497
52 HD2 ARG 8 HD2 ARG 8 7.970 24.484 15.371
53 HD3 ARG 8 HD3 ARG 8 9.645 24.990 15.445
54 HE ARG 8 HE ARG 8 7.875 25.180 13.183
55 HH11 ARG 8 HH11 ARG 8 11.329 24.759 13.852
56 HH12 ARG 8 HH12 ARG 8 11.717 25.053 12.167
57 HH21 ARG 8 HH21 ARG 8 8.598 26.080 11.285
58 HH22 ARG 8 HH22 ARG 8 10.301 26.012 10.886
59 H ARG 9 H ARG 9 11.767 23.832 18.543
60 HA ARG 9 HA ARG 9 12.177 26.489 17.249
61 HB2 ARG 9 HB2 ARG 9 11.762 25.629 20.141
62 HB3 ARG 9 HB3 ARG 9 12.267 27.254 19.686
63 HG2 ARG 9 HG2 ARG 9 10.264 27.392 18.157
64 HG3 ARG 9 HG3 ARG 9 9.683 25.874 18.852
65 HD2 ARG 9 HD2 ARG 9 10.192 28.482 20.350
66 HD3 ARG 9 HD3 ARG 9 8.623 27.874 19.852
67 HE ARG 9 HE ARG 9 8.793 26.050 21.446
68 HH11 ARG 9 HH11 ARG 9 11.080 28.691 22.088
69 HH12 ARG 9 HH12 ARG 9 11.105 28.277 23.787
70 HH21 ARG 9 HH21 ARG 9 9.010 25.576 23.534
71 HH22 ARG 9 HH22 ARG 9 10.055 26.520 24.551
72 H CYS 10 H CYS 10 14.006 24.163 19.292
73 HA CYS 10 HA CYS 10 16.471 25.586 19.308
74 HB2 CYS 10 HB2 CYS 10 15.998 23.578 20.646
75 HB3 CYS 10 HB3 CYS 10 15.893 22.613 19.173
76 H GLU 11 H GLU 11 15.115 23.357 16.832
77 HA GLU 11 HA GLU 11 17.245 23.179 15.087
78 HB2 GLU 11 HB2 GLU 11 14.949 22.020 15.153
79 HB3 GLU 11 HB3 GLU 11 14.409 23.301 14.077
80 HG2 GLU 11 HG2 GLU 11 16.910 22.155 13.156
81 HG3 GLU 11 HG3 GLU 11 15.834 20.846 13.580
82 H LEU 12 H LEU 12 15.602 25.953 15.778
83 HA LEU 12 HA LEU 12 15.855 27.255 13.152
84 HB2 LEU 12 HB2 LEU 12 13.597 26.562 13.648
85 HB3 LEU 12 HB3 LEU 12 13.677 27.297 15.246
86 HG LEU 12 HG LEU 12 13.772 29.534 14.270
87 HD11 LEU 12 HD11 LEU 12 13.188 29.804 11.829
88 HD12 LEU 12 HD12 LEU 12 14.817 29.217 12.118
89 HD13 LEU 12 HD13 LEU 12 13.544 28.079 11.599
90 HD21 LEU 12 HD21 LEU 12 11.468 29.598 13.505
91 HD22 LEU 12 HD22 LEU 12 11.491 27.856 13.164
92 HD23 LEU 12 HD23 LEU 12 11.626 28.451 14.841
93 H SER 13 H SER 13 15.926 27.808 16.764
94 HA SER 13 HA SER 13 17.054 30.478 16.503
95 HB2 SER 13 HB2 SER 13 17.589 30.203 18.916
96 HB3 SER 13 HB3 SER 13 15.895 29.884 18.507
97 HG SER 13 HG SER 13 17.905 28.101 19.332
98 H CYS 14 H CYS 14 18.462 27.225 16.865
99 HA CYS 14 HA CYS 14 21.238 27.842 16.913
100 HB2 CYS 14 HB2 CYS 14 19.581 25.585 15.745
101 HB3 CYS 14 HB3 CYS 14 21.319 25.604 15.678
102 H ARG 15 H ARG 15 19.013 28.383 14.269
103 HA ARG 15 HA ARG 15 21.026 28.095 12.179
104 HB2 ARG 15 HB2 ARG 15 18.421 29.477 12.482
105 HB3 ARG 15 HB3 ARG 15 19.193 29.291 10.877
106 HG2 ARG 15 HG2 ARG 15 19.178 26.766 11.258
107 HG3 ARG 15 HG3 ARG 15 18.191 27.030 12.683
108 HD2 ARG 15 HD2 ARG 15 16.550 28.356 11.206
109 HD3 ARG 15 HD3 ARG 15 17.546 27.953 9.814
110 HE ARG 15 HE ARG 15 16.577 25.628 11.313
111 HH11 ARG 15 HH11 ARG 15 15.593 27.874 8.757
112 HH12 ARG 15 HH12 ARG 15 14.944 26.554 7.790
113 HH21 ARG 15 HH21 ARG 15 15.471 24.094 10.070
114 HH22 ARG 15 HH22 ARG 15 14.700 24.604 8.585
115 H SER 16 H SER 16 20.200 30.713 14.320
116 HA SER 16 HA SER 16 21.175 33.057 13.114
117 HB2 SER 16 HB2 SER 16 21.573 31.925 15.922
118 HB3 SER 16 HB3 SER 16 21.965 33.593 15.462
119 HG SER 16 HG SER 16 19.473 32.360 15.773
120 H LEU 17 H LEU 17 22.823 30.201 13.652
121 HA LEU 17 HA LEU 17 25.577 31.212 13.955
122 HB2 LEU 17 HB2 LEU 17 24.550 28.462 14.644
123 HB3 LEU 17 HB3 LEU 17 25.824 29.377 15.420
124 HG LEU 17 HG LEU 17 22.795 29.887 15.752
125 HD11 LEU 17 HD11 LEU 17 24.853 28.642 17.623
126 HD12 LEU 17 HD12 LEU 17 23.142 28.941 17.980
127 HD13 LEU 17 HD13 LEU 17 23.596 27.756 16.740
128 HD21 LEU 17 HD21 LEU 17 24.231 31.939 16.110
129 HD22 LEU 17 HD22 LEU 17 23.507 31.341 17.608
130 HD23 LEU 17 HD23 LEU 17 25.210 31.012 17.251
131 H GLY 18 H GLY 18 23.643 29.942 11.535
132 HA2 GLY 18 HA2 GLY 18 24.053 28.812 9.570
133 HA3 GLY 18 HA3 GLY 18 25.770 28.749 9.975
134 H LEU 19 H LEU 19 23.337 27.339 12.145
135 HA LEU 19 HA LEU 19 24.384 24.610 11.489
136 HB2 LEU 19 HB2 LEU 19 23.566 25.680 14.201
137 HB3 LEU 19 HB3 LEU 19 24.325 24.137 13.843
138 HG LEU 19 HG LEU 19 25.634 26.844 13.554
139 HD11 LEU 19 HD11 LEU 19 25.337 26.271 15.874
140 HD12 LEU 19 HD12 LEU 19 26.071 24.663 15.610
141 HD13 LEU 19 HD13 LEU 19 27.037 26.142 15.435
142 HD21 LEU 19 HD21 LEU 19 26.817 24.038 13.277
143 HD22 LEU 19 HD22 LEU 19 26.589 25.189 11.944
144 HD23 LEU 19 HD23 LEU 19 27.735 25.557 13.229
145 H LEU 20 H LEU 20 23.094 22.905 12.588
146 HA LEU 20 HA LEU 20 20.139 23.050 12.271
147 HB2 LEU 20 HB2 LEU 20 21.521 20.984 11.570
148 HB3 LEU 20 HB3 LEU 20 21.995 20.838 13.242
149 HG LEU 20 HG LEU 20 19.570 20.378 13.832
150 HD11 LEU 20 HD11 LEU 20 18.551 21.504 11.819
151 HD12 LEU 20 HD12 LEU 20 19.259 20.251 10.797
152 HD13 LEU 20 HD13 LEU 20 18.031 19.825 12.006
153 HD21 LEU 20 HD21 LEU 20 19.564 18.140 12.836
154 HD22 LEU 20 HD22 LEU 20 20.860 18.626 11.730
155 HD23 LEU 20 HD23 LEU 20 21.167 18.567 13.479
156 H GLY 21 H GLY 21 18.922 22.278 14.244
157 HA2 GLY 21 HA2 GLY 21 20.407 22.417 16.807
158 HA3 GLY 21 HA3 GLY 21 18.841 23.185 16.721
159 H LYS 22 H LYS 22 19.949 20.799 18.215
160 HA LYS 22 HA LYS 22 17.664 18.978 17.807
161 HB2 LYS 22 HB2 LYS 22 20.571 18.092 17.991
162 HB3 LYS 22 HB3 LYS 22 19.195 17.045 18.335
163 HG2 LYS 22 HG2 LYS 22 18.322 17.649 15.975
164 HG3 LYS 22 HG3 LYS 22 19.950 18.293 15.675
165 HD2 LYS 22 HD2 LYS 22 20.907 16.060 16.293
166 HD3 LYS 22 HD3 LYS 22 19.258 15.466 16.580
167 HE2 LYS 22 HE2 LYS 22 18.702 16.000 14.194
168 HE3 LYS 22 HE3 LYS 22 20.407 16.413 13.935
169 HZ1 LYS 22 HZ1 LYS 22 19.900 14.071 13.315
170 HZ2 LYS 22 HZ2 LYS 22 20.987 14.117 14.563
171 HZ3 LYS 22 HZ3 LYS 22 19.426 13.737 14.830
172 H CYS 23 H CYS 23 16.601 19.024 19.626
173 HA CYS 23 HA CYS 23 18.012 19.455 22.218
174 HB2 CYS 23 HB2 CYS 23 16.735 21.366 21.296
175 HB3 CYS 23 HB3 CYS 23 15.275 20.408 21.385
176 H ILE 24 H ILE 24 18.026 16.933 21.673
177 HA ILE 24 HA ILE 24 15.512 15.514 22.061
178 HB ILE 24 HB ILE 24 18.356 14.467 21.868
179 HG12 ILE 24 HG12 ILE 24 16.294 15.011 19.669
180 HG13 ILE 24 HG13 ILE 24 17.837 15.849 19.889
181 HG21 ILE 24 HG21 ILE 24 15.665 13.109 21.314
182 HG22 ILE 24 HG22 ILE 24 17.264 12.349 21.172
183 HG23 ILE 24 HG23 ILE 24 16.671 12.823 22.751
184 HD11 ILE 24 HD11 ILE 24 19.055 13.748 19.416
185 HD12 ILE 24 HD12 ILE 24 17.496 12.966 19.027
186 HD13 ILE 24 HD13 ILE 24 18.054 14.338 18.072
187 H GLY 25 H GLY 25 18.477 16.028 24.002
188 HA2 GLY 25 HA2 GLY 25 17.419 14.621 26.369
189 HA3 GLY 25 HA3 GLY 25 18.916 15.551 26.248
190 H GLU 26 H GLU 26 16.290 17.264 24.950
191 HA GLU 26 HA GLU 26 15.488 19.296 25.397
192 HB2 GLU 26 HB2 GLU 26 15.298 18.576 28.311
193 HB3 GLU 26 HB3 GLU 26 14.397 19.801 27.440
194 HG2 GLU 26 HG2 GLU 26 14.186 16.772 27.027
195 HG3 GLU 26 HG3 GLU 26 13.045 17.797 27.864
196 H GLU 27 H GLU 27 18.255 18.954 25.200
197 HA GLU 27 HA GLU 27 19.472 20.890 27.104
198 HB2 GLU 27 HB2 GLU 27 21.467 19.778 26.820
199 HB3 GLU 27 HB3 GLU 27 20.287 18.488 26.945
200 HG2 GLU 27 HG2 GLU 27 21.552 19.475 24.334
201 HG3 GLU 27 HG3 GLU 27 22.118 18.118 25.284
202 H CYS 28 H CYS 28 18.623 20.569 23.838
203 HA CYS 28 HA CYS 28 19.066 21.538 21.887
204 HB2 CYS 28 HB2 CYS 28 17.813 23.340 22.991
205 HB3 CYS 28 HB3 CYS 28 19.335 24.082 23.483
206 H LYS 29 H LYS 29 20.831 20.408 21.325
207 HA LYS 29 HA LYS 29 23.493 21.729 21.327
208 HB2 LYS 29 HB2 LYS 29 23.104 19.172 21.411
209 HB3 LYS 29 HB3 LYS 29 22.523 19.276 19.753
210 HG2 LYS 29 HG2 LYS 29 24.749 20.385 19.135
211 HG3 LYS 29 HG3 LYS 29 25.290 20.094 20.780
212 HD2 LYS 29 HD2 LYS 29 24.755 18.108 18.572
213 HD3 LYS 29 HD3 LYS 29 26.243 18.372 19.477
214 HE2 LYS 29 HE2 LYS 29 23.663 17.121 20.487
215 HE3 LYS 29 HE3 LYS 29 25.157 16.266 20.111
216 HZ1 LYS 29 HZ1 LYS 29 24.795 16.742 22.518
217 HZ2 LYS 29 HZ2 LYS 29 26.240 17.308 21.970
218 HZ3 LYS 29 HZ3 LYS 29 24.990 18.340 22.254
219 H CYS 30 H CYS 30 24.180 22.984 19.537
220 HA CYS 30 HA CYS 30 22.463 22.822 17.109
221 HB2 CYS 30 HB2 CYS 30 24.481 25.000 17.485
222 HB3 CYS 30 HB3 CYS 30 23.119 24.909 16.316
223 H VAL 31 H VAL 31 23.412 22.334 15.193
224 HA VAL 31 HA VAL 31 25.870 20.672 15.599
225 HB VAL 31 HB VAL 31 23.607 19.601 13.968
226 HG11 VAL 31 HG11 VAL 31 24.437 17.490 14.898
227 HG12 VAL 31 HG12 VAL 31 25.750 18.407 14.148
228 HG13 VAL 31 HG13 VAL 31 25.585 18.377 15.922
229 HG21 VAL 31 HG21 VAL 31 22.597 18.516 15.966
230 HG22 VAL 31 HG22 VAL 31 23.568 19.563 17.011
231 HG23 VAL 31 HG23 VAL 31 22.323 20.261 15.948
232 HA PRO 32 HA PRO 32 27.031 22.185 11.495
233 HB2 PRO 32 HB2 PRO 32 28.888 19.795 11.641
234 HB3 PRO 32 HB3 PRO 32 29.233 21.471 11.091
235 HG2 PRO 32 HG2 PRO 32 29.973 20.738 13.563
236 HG3 PRO 32 HG3 PRO 32 29.106 22.294 13.358
237 HD2 PRO 32 HD2 PRO 32 27.933 19.600 14.143
238 HD3 PRO 32 HD3 PRO 32 27.765 21.178 14.957
239 H TYR 33 H TYR 33 24.690 20.873 11.429
240 HA TYR 33 HA TYR 33 23.197 19.611 10.301
241 HB2 TYR 33 HB2 TYR 33 24.697 21.349 8.612
242 HB3 TYR 33 HB3 TYR 33 24.245 19.961 7.644
243 HD1 TYR 33 HD2 TYR 33 22.825 22.249 10.213
244 HD2 TYR 33 HD1 TYR 33 22.118 20.143 6.542
245 HE1 TYR 33 HE2 TYR 33 20.569 23.331 10.030
246 HE2 TYR 33 HE1 TYR 33 19.865 21.181 6.366
247 HH TYR 33 HH TYR 33 18.597 23.296 8.984
Start of MODEL 16
1 H1 GLY 1 H1 GLY 1 16.302 29.480 28.423
2 H2 GLY 1 H2 GLY 1 16.786 29.690 29.979
3 H3 GLY 1 H3 GLY 1 15.417 28.815 29.651
4 HA2 GLY 1 HA2 GLY 1 18.148 28.076 28.859
5 HA3 GLY 1 HA3 GLY 1 17.251 27.366 30.224
6 H SER 2 H SER 2 17.102 25.313 29.499
7 HA SER 2 HA SER 2 15.857 24.756 26.834
8 HB2 SER 2 HB2 SER 2 17.434 22.834 28.558
9 HB3 SER 2 HB3 SER 2 17.041 22.703 26.833
10 HG SER 2 HG SER 2 19.247 23.378 27.634
11 H ALA 3 H ALA 3 14.773 25.075 29.907
12 HA ALA 3 HA ALA 3 13.705 22.543 30.585
13 HB1 ALA 3 HB1 ALA 3 12.768 25.327 31.392
14 HB2 ALA 3 HB2 ALA 3 12.313 23.814 32.182
15 HB3 ALA 3 HB3 ALA 3 13.999 24.346 32.204
16 H PHE 4 H PHE 4 11.972 21.450 30.024
17 HA PHE 4 HA PHE 4 10.546 20.616 28.483
18 HB2 PHE 4 HB2 PHE 4 9.027 23.146 29.139
19 HB3 PHE 4 HB3 PHE 4 8.350 21.671 28.435
20 HD1 PHE 4 HD1 PHE 4 8.778 19.427 29.780
21 HD2 PHE 4 HD2 PHE 4 9.057 23.369 31.508
22 HE1 PHE 4 HE1 PHE 4 8.551 18.455 32.043
23 HE2 PHE 4 HE2 PHE 4 8.817 22.377 33.760
24 HZ PHE 4 HZ PHE 4 8.561 19.925 34.048
25 H CYS 5 H CYS 5 12.557 21.314 27.078
26 HA CYS 5 HA CYS 5 12.403 23.198 25.086
27 HB2 CYS 5 HB2 CYS 5 14.346 21.725 25.684
28 HB3 CYS 5 HB3 CYS 5 13.566 20.409 24.803
29 H ASN 6 H ASN 6 11.725 23.351 22.982
30 HA ASN 6 HA ASN 6 10.330 21.023 21.703
31 HB2 ASN 6 HB2 ASN 6 8.739 22.884 22.044
32 HB3 ASN 6 HB3 ASN 6 9.842 23.995 21.221
33 HD21 ASN 6 HD22 ASN 6 7.573 24.167 20.056
34 HD22 ASN 6 HD21 ASN 6 7.341 23.023 18.732
35 H LEU 7 H LEU 7 11.637 20.126 20.164
36 HA LEU 7 HA LEU 7 14.139 21.337 19.454
37 HB2 LEU 7 HB2 LEU 7 13.771 18.912 19.388
38 HB3 LEU 7 HB3 LEU 7 12.629 19.089 18.063
39 HG LEU 7 HG LEU 7 15.493 20.116 17.736
40 HD11 LEU 7 HD11 LEU 7 15.986 17.798 16.816
41 HD12 LEU 7 HD12 LEU 7 15.656 17.773 18.568
42 HD13 LEU 7 HD13 LEU 7 14.424 17.262 17.417
43 HD21 LEU 7 HD21 LEU 7 15.129 19.504 15.385
44 HD22 LEU 7 HD22 LEU 7 13.576 18.739 15.771
45 HD23 LEU 7 HD23 LEU 7 13.754 20.485 15.870
46 H ARG 8 H ARG 8 10.975 21.537 17.847
47 HA ARG 8 HA ARG 8 11.823 22.690 15.412
48 HB2 ARG 8 HB2 ARG 8 9.504 21.914 15.907
49 HB3 ARG 8 HB3 ARG 8 9.308 23.228 17.082
50 HG2 ARG 8 HG2 ARG 8 9.322 24.910 15.360
51 HG3 ARG 8 HG3 ARG 8 9.743 23.723 14.111
52 HD2 ARG 8 HD2 ARG 8 7.197 23.561 15.772
53 HD3 ARG 8 HD3 ARG 8 7.288 24.450 14.253
54 HE ARG 8 HE ARG 8 8.109 22.241 13.227
55 HH11 ARG 8 HH11 ARG 8 5.566 22.238 15.687
56 HH12 ARG 8 HH12 ARG 8 5.435 20.490 15.558
57 HH21 ARG 8 HH21 ARG 8 7.702 20.216 12.995
58 HH22 ARG 8 HH22 ARG 8 6.376 19.419 13.854
59 H ARG 9 H ARG 9 11.571 24.165 18.541
60 HA ARG 9 HA ARG 9 11.887 26.909 17.467
61 HB2 ARG 9 HB2 ARG 9 10.298 26.179 19.335
62 HB3 ARG 9 HB3 ARG 9 11.719 26.008 20.374
63 HG2 ARG 9 HG2 ARG 9 12.262 28.396 20.051
64 HG3 ARG 9 HG3 ARG 9 10.976 28.539 18.831
65 HD2 ARG 9 HD2 ARG 9 10.093 29.409 20.889
66 HD3 ARG 9 HD3 ARG 9 9.301 27.866 20.567
67 HE ARG 9 HE ARG 9 11.594 28.198 22.506
68 HH11 ARG 9 HH11 ARG 9 8.609 26.405 21.793
69 HH12 ARG 9 HH12 ARG 9 8.501 25.897 23.460
70 HH21 ARG 9 HH21 ARG 9 11.208 27.634 24.553
71 HH22 ARG 9 HH22 ARG 9 10.010 26.418 24.939
72 H CYS 10 H CYS 10 13.764 24.531 19.388
73 HA CYS 10 HA CYS 10 16.125 26.184 19.672
74 HB2 CYS 10 HB2 CYS 10 15.418 23.288 19.876
75 HB3 CYS 10 HB3 CYS 10 17.126 23.696 19.700
76 H GLU 11 H GLU 11 14.943 24.089 16.986
77 HA GLU 11 HA GLU 11 17.178 24.101 15.338
78 HB2 GLU 11 HB2 GLU 11 14.263 24.329 14.701
79 HB3 GLU 11 HB3 GLU 11 15.487 24.477 13.427
80 HG2 GLU 11 HG2 GLU 11 16.398 22.288 14.008
81 HG3 GLU 11 HG3 GLU 11 15.116 22.077 15.209
82 H LEU 12 H LEU 12 14.761 26.680 15.731
83 HA LEU 12 HA LEU 12 15.882 28.276 13.576
84 HB2 LEU 12 HB2 LEU 12 13.543 28.430 15.475
85 HB3 LEU 12 HB3 LEU 12 13.828 29.698 14.257
86 HG LEU 12 HG LEU 12 13.483 26.730 13.601
87 HD11 LEU 12 HD11 LEU 12 11.433 27.668 14.602
88 HD12 LEU 12 HD12 LEU 12 11.480 29.020 13.449
89 HD13 LEU 12 HD13 LEU 12 11.217 27.362 12.873
90 HD21 LEU 12 HD21 LEU 12 13.370 29.206 11.819
91 HD22 LEU 12 HD22 LEU 12 14.671 28.009 11.814
92 HD23 LEU 12 HD23 LEU 12 13.049 27.535 11.313
93 H SER 13 H SER 13 16.179 28.425 17.068
94 HA SER 13 HA SER 13 17.522 31.048 16.952
95 HB2 SER 13 HB2 SER 13 17.621 28.905 19.092
96 HB3 SER 13 HB3 SER 13 18.234 30.567 19.235
97 HG SER 13 HG SER 13 16.184 31.352 19.275
98 H CYS 14 H CYS 14 18.349 27.742 16.155
99 HA CYS 14 HA CYS 14 21.231 28.336 16.348
100 HB2 CYS 14 HB2 CYS 14 19.602 25.828 16.290
101 HB3 CYS 14 HB3 CYS 14 21.305 25.802 15.887
102 H ARG 15 H ARG 15 18.903 27.681 13.745
103 HA ARG 15 HA ARG 15 20.926 26.879 11.859
104 HB2 ARG 15 HB2 ARG 15 18.276 28.190 11.783
105 HB3 ARG 15 HB3 ARG 15 19.047 27.777 10.238
106 HG2 ARG 15 HG2 ARG 15 19.082 25.409 10.703
107 HG3 ARG 15 HG3 ARG 15 18.489 25.628 12.349
108 HD2 ARG 15 HD2 ARG 15 16.363 26.507 11.506
109 HD3 ARG 15 HD3 ARG 15 16.960 26.560 9.864
110 HE ARG 15 HE ARG 15 16.197 24.089 11.398
111 HH11 ARG 15 HH11 ARG 15 17.145 25.295 8.171
112 HH12 ARG 15 HH12 ARG 15 16.038 24.131 7.446
113 HH21 ARG 15 HH21 ARG 15 15.043 22.653 10.273
114 HH22 ARG 15 HH22 ARG 15 15.095 22.693 8.496
115 H SER 16 H SER 16 19.634 30.046 12.692
116 HA SER 16 HA SER 16 20.885 31.868 11.013
117 HB2 SER 16 HB2 SER 16 20.363 31.911 14.013
118 HB3 SER 16 HB3 SER 16 20.668 33.366 13.021
119 HG SER 16 HG SER 16 18.829 32.940 11.837
120 H LEU 17 H LEU 17 22.618 29.600 12.510
121 HA LEU 17 HA LEU 17 25.060 31.190 13.167
122 HB2 LEU 17 HB2 LEU 17 24.343 28.477 14.259
123 HB3 LEU 17 HB3 LEU 17 25.475 29.642 14.894
124 HG LEU 17 HG LEU 17 22.406 29.893 15.019
125 HD11 LEU 17 HD11 LEU 17 23.408 28.139 16.498
126 HD12 LEU 17 HD12 LEU 17 24.545 29.331 17.135
127 HD13 LEU 17 HD13 LEU 17 22.812 29.522 17.439
128 HD21 LEU 17 HD21 LEU 17 24.613 31.615 16.232
129 HD22 LEU 17 HD22 LEU 17 23.508 32.117 14.948
130 HD23 LEU 17 HD23 LEU 17 22.878 31.762 16.556
131 H GLY 18 H GLY 18 23.711 29.143 10.848
132 HA2 GLY 18 HA2 GLY 18 24.699 27.880 9.141
133 HA3 GLY 18 HA3 GLY 18 26.279 28.024 9.932
134 H LEU 19 H LEU 19 24.233 27.119 12.341
135 HA LEU 19 HA LEU 19 25.067 24.278 12.240
136 HB2 LEU 19 HB2 LEU 19 23.803 25.884 14.501
137 HB3 LEU 19 HB3 LEU 19 24.543 24.296 14.625
138 HG LEU 19 HG LEU 19 26.015 26.903 14.061
139 HD11 LEU 19 HD11 LEU 19 26.971 26.546 16.285
140 HD12 LEU 19 HD12 LEU 19 25.209 26.630 16.393
141 HD13 LEU 19 HD13 LEU 19 26.027 25.055 16.483
142 HD21 LEU 19 HD21 LEU 19 27.163 25.032 12.941
143 HD22 LEU 19 HD22 LEU 19 28.073 25.582 14.353
144 HD23 LEU 19 HD23 LEU 19 27.110 24.097 14.460
145 H LEU 20 H LEU 20 23.185 22.993 13.609
146 HA LEU 20 HA LEU 20 20.448 23.767 12.733
147 HB2 LEU 20 HB2 LEU 20 20.962 22.114 11.100
148 HB3 LEU 20 HB3 LEU 20 21.838 21.113 12.273
149 HG LEU 20 HG LEU 20 19.663 20.627 13.441
150 HD11 LEU 20 HD11 LEU 20 17.561 21.087 12.293
151 HD12 LEU 20 HD12 LEU 20 18.364 22.652 12.530
152 HD13 LEU 20 HD13 LEU 20 18.409 21.874 10.955
153 HD21 LEU 20 HD21 LEU 20 20.608 19.061 11.800
154 HD22 LEU 20 HD22 LEU 20 18.842 19.033 11.895
155 HD23 LEU 20 HD23 LEU 20 19.623 19.846 10.534
156 H GLY 21 H GLY 21 18.857 22.910 14.179
157 HA2 GLY 21 HA2 GLY 21 19.902 22.480 16.973
158 HA3 GLY 21 HA3 GLY 21 18.279 22.989 16.617
159 H LYS 22 H LYS 22 19.897 20.586 17.826
160 HA LYS 22 HA LYS 22 17.983 18.440 17.029
161 HB2 LYS 22 HB2 LYS 22 20.336 18.183 16.116
162 HB3 LYS 22 HB3 LYS 22 20.903 18.067 17.767
163 HG2 LYS 22 HG2 LYS 22 20.789 15.861 16.913
164 HG3 LYS 22 HG3 LYS 22 19.483 16.006 18.074
165 HD2 LYS 22 HD2 LYS 22 18.732 14.742 16.169
166 HD3 LYS 22 HD3 LYS 22 17.857 16.281 16.177
167 HE2 LYS 22 HE2 LYS 22 19.424 17.149 14.452
168 HE3 LYS 22 HE3 LYS 22 20.314 15.619 14.486
169 HZ1 LYS 22 HZ1 LYS 22 18.748 15.718 12.656
170 HZ2 LYS 22 HZ2 LYS 22 18.303 14.510 13.638
171 HZ3 LYS 22 HZ3 LYS 22 17.470 15.940 13.663
172 H CYS 23 H CYS 23 17.070 19.989 18.943
173 HA CYS 23 HA CYS 23 18.054 19.467 21.590
174 HB2 CYS 23 HB2 CYS 23 16.847 21.559 20.947
175 HB3 CYS 23 HB3 CYS 23 15.354 20.606 20.905
176 H ILE 24 H ILE 24 17.993 17.043 21.263
177 HA ILE 24 HA ILE 24 15.345 15.776 21.624
178 HB ILE 24 HB ILE 24 18.106 14.581 21.410
179 HG12 ILE 24 HG12 ILE 24 15.798 15.005 19.425
180 HG13 ILE 24 HG13 ILE 24 17.401 15.727 19.333
181 HG21 ILE 24 HG21 ILE 24 16.482 13.100 22.641
182 HG22 ILE 24 HG22 ILE 24 15.314 13.308 21.312
183 HG23 ILE 24 HG23 ILE 24 16.845 12.429 21.066
184 HD11 ILE 24 HD11 ILE 24 16.731 12.799 18.870
185 HD12 ILE 24 HD12 ILE 24 17.170 14.006 17.671
186 HD13 ILE 24 HD13 ILE 24 18.378 13.491 18.871
187 H GLY 25 H GLY 25 18.405 15.909 23.568
188 HA2 GLY 25 HA2 GLY 25 17.181 14.565 25.842
189 HA3 GLY 25 HA3 GLY 25 18.802 15.258 25.755
190 H GLU 26 H GLU 26 16.026 17.229 24.998
191 HA GLU 26 HA GLU 26 15.470 19.320 25.708
192 HB2 GLU 26 HB2 GLU 26 15.775 18.233 28.517
193 HB3 GLU 26 HB3 GLU 26 14.824 19.621 28.022
194 HG2 GLU 26 HG2 GLU 26 13.123 18.352 27.107
195 HG3 GLU 26 HG3 GLU 26 14.119 16.919 26.854
196 H GLU 27 H GLU 27 18.237 18.901 25.070
197 HA GLU 27 HA GLU 27 19.716 20.517 27.086
198 HB2 GLU 27 HB2 GLU 27 21.647 19.395 26.479
199 HB3 GLU 27 HB3 GLU 27 20.417 18.145 26.539
200 HG2 GLU 27 HG2 GLU 27 21.584 19.404 24.023
201 HG3 GLU 27 HG3 GLU 27 22.020 17.850 24.703
202 H CYS 28 H CYS 28 18.242 21.019 24.229
203 HA CYS 28 HA CYS 28 18.410 22.246 22.380
204 HB2 CYS 28 HB2 CYS 28 18.114 23.962 24.272
205 HB3 CYS 28 HB3 CYS 28 19.768 24.428 23.900
206 H LYS 29 H LYS 29 20.193 20.327 22.283
207 HA LYS 29 HA LYS 29 22.895 20.987 21.604
208 HB2 LYS 29 HB2 LYS 29 21.123 18.684 21.363
209 HB3 LYS 29 HB3 LYS 29 21.789 19.000 19.773
210 HG2 LYS 29 HG2 LYS 29 24.091 19.125 21.054
211 HG3 LYS 29 HG3 LYS 29 23.223 18.204 22.290
212 HD2 LYS 29 HD2 LYS 29 23.771 17.486 19.387
213 HD3 LYS 29 HD3 LYS 29 24.368 16.654 20.805
214 HE2 LYS 29 HE2 LYS 29 21.459 16.705 19.848
215 HE3 LYS 29 HE3 LYS 29 22.627 15.407 19.584
216 HZ1 LYS 29 HZ1 LYS 29 21.365 16.165 22.152
217 HZ2 LYS 29 HZ2 LYS 29 21.432 14.709 21.402
218 HZ3 LYS 29 HZ3 LYS 29 22.771 15.319 22.117
219 H CYS 30 H CYS 30 23.790 21.991 19.791
220 HA CYS 30 HA CYS 30 22.153 21.840 17.364
221 HB2 CYS 30 HB2 CYS 30 23.482 24.480 17.994
222 HB3 CYS 30 HB3 CYS 30 22.475 24.059 16.561
223 H VAL 31 H VAL 31 23.085 21.132 15.776
224 HA VAL 31 HA VAL 31 25.800 20.093 16.080
225 HB VAL 31 HB VAL 31 25.107 18.439 14.465
226 HG11 VAL 31 HG11 VAL 31 24.555 18.160 16.892
227 HG12 VAL 31 HG12 VAL 31 22.926 18.787 16.569
228 HG13 VAL 31 HG13 VAL 31 23.476 17.275 15.810
229 HG21 VAL 31 HG21 VAL 31 22.384 19.799 14.351
230 HG22 VAL 31 HG22 VAL 31 23.565 19.697 13.019
231 HG23 VAL 31 HG23 VAL 31 22.816 18.230 13.645
232 HA PRO 32 HA PRO 32 27.340 22.661 12.699
233 HB2 PRO 32 HB2 PRO 32 29.341 20.405 12.398
234 HB3 PRO 32 HB3 PRO 32 29.614 22.179 12.417
235 HG2 PRO 32 HG2 PRO 32 30.107 20.711 14.620
236 HG3 PRO 32 HG3 PRO 32 29.224 22.270 14.788
237 HD2 PRO 32 HD2 PRO 32 28.075 19.449 14.672
238 HD3 PRO 32 HD3 PRO 32 27.715 20.801 15.804
239 H TYR 33 H TYR 33 25.185 21.936 11.698
240 HA TYR 33 HA TYR 33 24.561 20.095 9.924
241 HB2 TYR 33 HB2 TYR 33 23.300 22.146 10.625
242 HB3 TYR 33 HB3 TYR 33 24.121 23.046 9.356
243 HD1 TYR 33 HD2 TYR 33 21.935 20.118 10.070
244 HD2 TYR 33 HD1 TYR 33 23.300 22.932 7.099
245 HE1 TYR 33 HE2 TYR 33 20.413 19.071 8.342
246 HE2 TYR 33 HE1 TYR 33 21.702 21.980 5.443
247 HH TYR 33 HH TYR 33 20.037 20.505 5.095
Start of MODEL 17
1 H1 GLY 1 H1 GLY 1 7.819 17.561 24.796
2 H2 GLY 1 H2 GLY 1 7.800 17.444 23.160
3 H3 GLY 1 H3 GLY 1 6.773 16.516 24.074
4 HA2 GLY 1 HA2 GLY 1 5.510 18.275 23.106
5 HA3 GLY 1 HA3 GLY 1 5.638 18.501 24.860
6 H SER 2 H SER 2 5.603 20.694 25.025
7 HA SER 2 HA SER 2 7.879 22.242 23.834
8 HB2 SER 2 HB2 SER 2 4.982 23.138 24.157
9 HB3 SER 2 HB3 SER 2 6.327 24.133 23.573
10 HG SER 2 HG SER 2 5.129 21.864 22.362
11 H ALA 3 H ALA 3 6.356 21.326 26.735
12 HA ALA 3 HA ALA 3 6.109 23.642 28.212
13 HB1 ALA 3 HB1 ALA 3 6.875 20.848 29.174
14 HB2 ALA 3 HB2 ALA 3 6.135 22.127 30.158
15 HB3 ALA 3 HB3 ALA 3 5.229 21.418 28.816
16 H PHE 4 H PHE 4 9.156 21.992 27.577
17 HA PHE 4 HA PHE 4 10.614 24.183 29.014
18 HB2 PHE 4 HB2 PHE 4 10.455 22.101 30.389
19 HB3 PHE 4 HB3 PHE 4 11.314 21.226 29.129
20 HD1 PHE 4 HD2 PHE 4 11.585 24.107 31.523
21 HD2 PHE 4 HD1 PHE 4 13.729 21.227 29.131
22 HE1 PHE 4 HE2 PHE 4 13.704 24.736 32.648
23 HE2 PHE 4 HE1 PHE 4 15.825 21.837 30.279
24 HZ PHE 4 HZ PHE 4 15.828 23.595 32.036
25 H CYS 5 H CYS 5 10.655 21.749 26.420
26 HA CYS 5 HA CYS 5 12.062 23.649 24.732
27 HB2 CYS 5 HB2 CYS 5 13.904 22.254 25.875
28 HB3 CYS 5 HB3 CYS 5 13.274 20.873 24.975
29 H ASN 6 H ASN 6 11.564 23.328 22.548
30 HA ASN 6 HA ASN 6 10.710 20.610 21.738
31 HB2 ASN 6 HB2 ASN 6 8.705 22.157 21.563
32 HB3 ASN 6 HB3 ASN 6 9.620 23.132 20.407
33 HD21 ASN 6 HD22 ASN 6 7.975 20.106 20.954
34 HD22 ASN 6 HD21 ASN 6 8.062 19.552 19.263
35 H LEU 7 H LEU 7 11.964 19.804 20.055
36 HA LEU 7 HA LEU 7 14.430 20.998 19.476
37 HB2 LEU 7 HB2 LEU 7 14.101 18.692 19.128
38 HB3 LEU 7 HB3 LEU 7 12.854 18.925 17.905
39 HG LEU 7 HG LEU 7 15.638 20.055 17.384
40 HD11 LEU 7 HD11 LEU 7 16.320 17.855 16.489
41 HD12 LEU 7 HD12 LEU 7 15.938 17.675 18.212
42 HD13 LEU 7 HD13 LEU 7 14.778 17.143 16.990
43 HD21 LEU 7 HD21 LEU 7 13.619 18.690 15.552
44 HD22 LEU 7 HD22 LEU 7 13.851 20.443 15.674
45 HD23 LEU 7 HD23 LEU 7 15.166 19.441 15.086
46 H ARG 8 H ARG 8 11.403 21.400 17.541
47 HA ARG 8 HA ARG 8 12.654 22.733 15.363
48 HB2 ARG 8 HB2 ARG 8 10.328 21.787 15.501
49 HB3 ARG 8 HB3 ARG 8 9.849 23.184 16.484
50 HG2 ARG 8 HG2 ARG 8 10.476 24.686 14.569
51 HG3 ARG 8 HG3 ARG 8 10.875 23.254 13.610
52 HD2 ARG 8 HD2 ARG 8 8.158 23.923 14.810
53 HD3 ARG 8 HD3 ARG 8 8.594 24.138 13.119
54 HE ARG 8 HE ARG 8 7.989 21.615 14.542
55 HH11 ARG 8 HH11 ARG 8 9.478 22.804 11.600
56 HH12 ARG 8 HH12 ARG 8 8.899 21.470 10.641
57 HH21 ARG 8 HH21 ARG 8 7.263 19.945 13.278
58 HH22 ARG 8 HH22 ARG 8 7.695 19.880 11.587
59 H ARG 9 H ARG 9 11.438 24.068 18.412
60 HA ARG 9 HA ARG 9 11.956 26.811 17.589
61 HB2 ARG 9 HB2 ARG 9 10.125 25.952 19.169
62 HB3 ARG 9 HB3 ARG 9 11.364 25.910 20.434
63 HG2 ARG 9 HG2 ARG 9 11.715 28.308 20.247
64 HG3 ARG 9 HG3 ARG 9 10.853 28.366 18.703
65 HD2 ARG 9 HD2 ARG 9 9.352 29.286 20.203
66 HD3 ARG 9 HD3 ARG 9 8.749 27.650 19.951
67 HE ARG 9 HE ARG 9 10.026 27.130 22.179
68 HH11 ARG 9 HH11 ARG 9 8.535 30.330 21.623
69 HH12 ARG 9 HH12 ARG 9 8.141 30.440 23.325
70 HH21 ARG 9 HH21 ARG 9 9.370 27.488 24.336
71 HH22 ARG 9 HH22 ARG 9 8.649 29.038 24.716
72 H CYS 10 H CYS 10 13.972 24.370 18.990
73 HA CYS 10 HA CYS 10 16.087 26.384 19.560
74 HB2 CYS 10 HB2 CYS 10 15.826 24.330 21.020
75 HB3 CYS 10 HB3 CYS 10 16.373 23.386 19.613
76 H GLU 11 H GLU 11 15.334 23.825 17.166
77 HA GLU 11 HA GLU 11 17.533 23.811 15.516
78 HB2 GLU 11 HB2 GLU 11 15.301 22.553 15.310
79 HB3 GLU 11 HB3 GLU 11 14.747 23.944 14.368
80 HG2 GLU 11 HG2 GLU 11 16.989 23.425 13.043
81 HG3 GLU 11 HG3 GLU 11 16.840 21.864 13.809
82 H LEU 12 H LEU 12 14.882 26.182 15.478
83 HA LEU 12 HA LEU 12 15.974 27.802 13.440
84 HB2 LEU 12 HB2 LEU 12 13.917 28.087 15.617
85 HB3 LEU 12 HB3 LEU 12 14.266 29.483 14.578
86 HG LEU 12 HG LEU 12 13.631 26.749 13.374
87 HD11 LEU 12 HD11 LEU 12 11.748 27.364 14.839
88 HD12 LEU 12 HD12 LEU 12 11.672 28.973 14.090
89 HD13 LEU 12 HD13 LEU 12 11.305 27.518 13.133
90 HD21 LEU 12 HD21 LEU 12 14.618 28.514 11.875
91 HD22 LEU 12 HD22 LEU 12 12.943 28.124 11.448
92 HD23 LEU 12 HD23 LEU 12 13.306 29.605 12.345
93 H SER 13 H SER 13 16.395 28.191 17.027
94 HA SER 13 HA SER 13 17.918 30.660 16.665
95 HB2 SER 13 HB2 SER 13 18.429 30.448 19.067
96 HB3 SER 13 HB3 SER 13 16.710 30.406 18.681
97 HG SER 13 HG SER 13 18.387 28.318 19.569
98 H CYS 14 H CYS 14 18.644 27.294 16.560
99 HA CYS 14 HA CYS 14 21.544 27.591 16.503
100 HB2 CYS 14 HB2 CYS 14 19.539 25.426 15.883
101 HB3 CYS 14 HB3 CYS 14 21.261 25.212 15.666
102 H ARG 15 H ARG 15 18.974 27.662 14.042
103 HA ARG 15 HA ARG 15 20.790 27.242 11.793
104 HB2 ARG 15 HB2 ARG 15 18.019 28.099 12.339
105 HB3 ARG 15 HB3 ARG 15 18.580 28.190 10.649
106 HG2 ARG 15 HG2 ARG 15 19.026 25.857 10.512
107 HG3 ARG 15 HG3 ARG 15 18.874 25.608 12.239
108 HD2 ARG 15 HD2 ARG 15 16.966 24.703 10.911
109 HD3 ARG 15 HD3 ARG 15 16.469 25.873 12.138
110 HE ARG 15 HE ARG 15 16.810 27.301 9.701
111 HH11 ARG 15 HH11 ARG 15 14.620 24.812 10.930
112 HH12 ARG 15 HH12 ARG 15 13.255 25.561 10.131
113 HH21 ARG 15 HH21 ARG 15 15.115 28.070 8.691
114 HH22 ARG 15 HH22 ARG 15 13.545 27.260 8.749
115 H SER 16 H SER 16 19.504 30.099 13.416
116 HA SER 16 HA SER 16 20.501 32.230 11.926
117 HB2 SER 16 HB2 SER 16 20.564 31.689 14.926
118 HB3 SER 16 HB3 SER 16 20.693 33.309 14.172
119 HG SER 16 HG SER 16 18.498 32.661 14.834
120 H LEU 17 H LEU 17 22.327 29.677 13.260
121 HA LEU 17 HA LEU 17 24.919 31.099 13.374
122 HB2 LEU 17 HB2 LEU 17 24.421 28.235 14.122
123 HB3 LEU 17 HB3 LEU 17 25.593 29.357 14.767
124 HG LEU 17 HG LEU 17 22.571 29.391 15.352
125 HD11 LEU 17 HD11 LEU 17 23.868 27.525 16.378
126 HD12 LEU 17 HD12 LEU 17 25.011 28.696 17.062
127 HD13 LEU 17 HD13 LEU 17 23.320 28.695 17.594
128 HD21 LEU 17 HD21 LEU 17 23.139 31.059 17.058
129 HD22 LEU 17 HD22 LEU 17 24.831 31.075 16.519
130 HD23 LEU 17 HD23 LEU 17 23.544 31.684 15.460
131 H GLY 18 H GLY 18 23.197 29.513 10.982
132 HA2 GLY 18 HA2 GLY 18 23.856 28.525 8.978
133 HA3 GLY 18 HA3 GLY 18 25.553 28.646 9.455
134 H LEU 19 H LEU 19 23.562 27.150 11.841
135 HA LEU 19 HA LEU 19 24.632 24.444 11.150
136 HB2 LEU 19 HB2 LEU 19 23.832 25.592 13.851
137 HB3 LEU 19 HB3 LEU 19 24.577 24.043 13.563
138 HG LEU 19 HG LEU 19 25.876 26.750 13.152
139 HD11 LEU 19 HD11 LEU 19 26.431 24.522 15.149
140 HD12 LEU 19 HD12 LEU 19 27.321 26.052 14.996
141 HD13 LEU 19 HD13 LEU 19 25.630 26.077 15.495
142 HD21 LEU 19 HD21 LEU 19 26.781 25.179 11.479
143 HD22 LEU 19 HD22 LEU 19 27.967 25.491 12.742
144 HD23 LEU 19 HD23 LEU 19 27.056 23.971 12.755
145 H LEU 20 H LEU 20 23.265 22.811 12.591
146 HA LEU 20 HA LEU 20 20.318 23.133 12.175
147 HB2 LEU 20 HB2 LEU 20 21.188 21.070 11.191
148 HB3 LEU 20 HB3 LEU 20 22.091 20.713 12.662
149 HG LEU 20 HG LEU 20 19.913 20.334 13.865
150 HD11 LEU 20 HD11 LEU 20 18.518 21.726 12.215
151 HD12 LEU 20 HD12 LEU 20 18.749 20.435 11.038
152 HD13 LEU 20 HD13 LEU 20 17.878 20.102 12.545
153 HD21 LEU 20 HD21 LEU 20 20.402 18.680 11.366
154 HD22 LEU 20 HD22 LEU 20 21.184 18.462 12.946
155 HD23 LEU 20 HD23 LEU 20 19.441 18.191 12.774
156 H GLY 21 H GLY 21 19.105 22.396 14.155
157 HA2 GLY 21 HA2 GLY 21 20.651 22.434 16.697
158 HA3 GLY 21 HA3 GLY 21 19.160 23.339 16.634
159 H LYS 22 H LYS 22 20.070 20.929 18.185
160 HA LYS 22 HA LYS 22 17.677 19.253 17.740
161 HB2 LYS 22 HB2 LYS 22 20.505 18.171 18.048
162 HB3 LYS 22 HB3 LYS 22 19.022 17.208 18.087
163 HG2 LYS 22 HG2 LYS 22 18.526 18.112 15.735
164 HG3 LYS 22 HG3 LYS 22 20.184 18.719 15.722
165 HD2 LYS 22 HD2 LYS 22 19.307 15.809 15.977
166 HD3 LYS 22 HD3 LYS 22 20.030 16.578 14.566
167 HE2 LYS 22 HE2 LYS 22 22.079 17.079 15.955
168 HE3 LYS 22 HE3 LYS 22 21.356 16.159 17.272
169 HZ1 LYS 22 HZ1 LYS 22 21.955 15.053 14.586
170 HZ2 LYS 22 HZ2 LYS 22 22.913 14.856 15.912
171 HZ3 LYS 22 HZ3 LYS 22 21.420 14.190 15.901
172 H CYS 23 H CYS 23 16.603 19.032 19.582
173 HA CYS 23 HA CYS 23 17.990 19.475 22.182
174 HB2 CYS 23 HB2 CYS 23 16.763 21.453 21.374
175 HB3 CYS 23 HB3 CYS 23 15.298 20.509 21.340
176 H ILE 24 H ILE 24 17.857 17.026 21.248
177 HA ILE 24 HA ILE 24 15.502 15.541 21.429
178 HB ILE 24 HB ILE 24 18.334 14.493 21.745
179 HG12 ILE 24 HG12 ILE 24 16.806 15.343 19.243
180 HG13 ILE 24 HG13 ILE 24 18.347 15.968 19.839
181 HG21 ILE 24 HG21 ILE 24 17.452 12.451 20.720
182 HG22 ILE 24 HG22 ILE 24 16.466 12.835 22.119
183 HG23 ILE 24 HG23 ILE 24 15.863 13.207 20.489
184 HD11 ILE 24 HD11 ILE 24 17.879 13.251 18.593
185 HD12 ILE 24 HD12 ILE 24 18.789 14.615 17.942
186 HD13 ILE 24 HD13 ILE 24 19.406 13.759 19.370
187 H GLY 25 H GLY 25 18.115 15.782 23.882
188 HA2 GLY 25 HA2 GLY 25 16.656 14.165 25.846
189 HA3 GLY 25 HA3 GLY 25 18.208 14.975 26.074
190 H GLU 26 H GLU 26 15.479 16.831 24.916
191 HA GLU 26 HA GLU 26 14.527 18.713 25.643
192 HB2 GLU 26 HB2 GLU 26 13.909 16.990 27.667
193 HB3 GLU 26 HB3 GLU 26 14.811 18.207 28.561
194 HG2 GLU 26 HG2 GLU 26 12.679 19.032 28.735
195 HG3 GLU 26 HG3 GLU 26 13.205 19.911 27.306
196 H GLU 27 H GLU 27 17.669 18.239 25.814
197 HA GLU 27 HA GLU 27 18.206 21.059 26.593
198 HB2 GLU 27 HB2 GLU 27 20.181 20.618 27.630
199 HB3 GLU 27 HB3 GLU 27 19.121 19.390 28.280
200 HG2 GLU 27 HG2 GLU 27 21.230 18.953 26.106
201 HG3 GLU 27 HG3 GLU 27 21.482 18.692 27.815
202 H CYS 28 H CYS 28 19.634 22.233 25.179
203 HA CYS 28 HA CYS 28 19.506 20.922 22.532
204 HB2 CYS 28 HB2 CYS 28 18.203 22.988 23.062
205 HB3 CYS 28 HB3 CYS 28 19.740 23.859 23.002
206 H LYS 29 H LYS 29 20.929 20.740 21.061
207 HA LYS 29 HA LYS 29 23.681 21.909 21.263
208 HB2 LYS 29 HB2 LYS 29 23.725 19.459 21.533
209 HB3 LYS 29 HB3 LYS 29 22.696 19.255 20.112
210 HG2 LYS 29 HG2 LYS 29 24.503 20.256 18.698
211 HG3 LYS 29 HG3 LYS 29 25.543 20.345 20.108
212 HD2 LYS 29 HD2 LYS 29 24.318 17.811 18.938
213 HD3 LYS 29 HD3 LYS 29 25.962 18.357 18.627
214 HE2 LYS 29 HE2 LYS 29 24.914 17.723 21.427
215 HE3 LYS 29 HE3 LYS 29 25.670 16.529 20.372
216 HZ1 LYS 29 HZ1 LYS 29 27.668 17.789 20.331
217 HZ2 LYS 29 HZ2 LYS 29 27.021 19.050 21.176
218 HZ3 LYS 29 HZ3 LYS 29 27.286 17.605 21.907
219 H CYS 30 H CYS 30 24.179 23.230 19.564
220 HA CYS 30 HA CYS 30 22.635 22.907 17.031
221 HB2 CYS 30 HB2 CYS 30 24.586 25.150 17.425
222 HB3 CYS 30 HB3 CYS 30 23.232 25.004 16.282
223 H VAL 31 H VAL 31 23.748 22.417 15.199
224 HA VAL 31 HA VAL 31 26.409 21.187 15.695
225 HB VAL 31 HB VAL 31 24.539 19.790 16.509
226 HG11 VAL 31 HG11 VAL 31 23.782 19.378 13.601
227 HG12 VAL 31 HG12 VAL 31 23.138 18.531 15.008
228 HG13 VAL 31 HG13 VAL 31 22.810 20.257 14.818
229 HG21 VAL 31 HG21 VAL 31 25.382 17.728 15.558
230 HG22 VAL 31 HG22 VAL 31 26.171 18.618 14.238
231 HG23 VAL 31 HG23 VAL 31 26.689 18.858 15.929
232 HA PRO 32 HA PRO 32 26.859 21.999 11.239
233 HB2 PRO 32 HB2 PRO 32 29.424 21.107 10.930
234 HB3 PRO 32 HB3 PRO 32 28.998 22.687 11.640
235 HG2 PRO 32 HG2 PRO 32 29.767 20.140 13.054
236 HG3 PRO 32 HG3 PRO 32 30.261 21.823 13.421
237 HD2 PRO 32 HD2 PRO 32 28.244 20.478 14.753
238 HD3 PRO 32 HD3 PRO 32 28.306 22.257 14.581
239 H TYR 33 H TYR 33 25.197 20.562 11.162
240 HA TYR 33 HA TYR 33 24.858 17.925 11.493
241 HB2 TYR 33 HB2 TYR 33 23.110 17.978 9.702
242 HB3 TYR 33 HB3 TYR 33 23.008 19.165 10.976
243 HD1 TYR 33 HD2 TYR 33 23.399 21.547 10.559
244 HD2 TYR 33 HD1 TYR 33 23.469 18.670 7.367
245 HE1 TYR 33 HE2 TYR 33 23.265 23.396 8.898
246 HE2 TYR 33 HE1 TYR 33 23.284 20.522 5.696
247 HH TYR 33 HH TYR 33 23.176 23.955 6.697