Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
16023 | 1za8 RC | 6596 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 1H CYS 1 H CYS 1 2.836 2.850 -3.853
2 HA CYS 1 HA CYS 1 5.190 1.285 -4.549
3 1HB CYS 1 2HB CYS 1 2.811 0.636 -2.800
4 2HB CYS 1 1HB CYS 1 4.205 -0.414 -3.024
5 H GLY 2 H GLY 2 2.491 2.014 -6.136
6 1HA GLY 2 2HA GLY 2 1.410 1.094 -7.945
7 2HA GLY 2 1HA GLY 2 2.728 -0.063 -8.023
8 H GLU 3 H GLU 3 0.462 0.403 -5.373
9 HA GLU 3 HA GLU 3 -1.028 -1.982 -6.056
10 1HB GLU 3 2HB GLU 3 0.935 -2.847 -4.805
11 2HB GLU 3 1HB GLU 3 0.535 -1.786 -3.463
12 1HG GLU 3 2HG GLU 3 -1.507 -2.981 -3.056
13 2HG GLU 3 1HG GLU 3 -1.265 -3.964 -4.499
14 H SER 4 H SER 4 -2.996 -2.145 -4.759
15 HA SER 4 HA SER 4 -3.598 0.285 -3.230
16 1HB SER 4 2HB SER 4 -5.854 0.329 -4.334
17 2HB SER 4 1HB SER 4 -4.511 0.696 -5.416
18 HG SER 4 HG SER 4 -5.236 -1.974 -5.233
19 H CYS 5 H CYS 5 -4.698 -0.017 -1.420
20 HA CYS 5 HA CYS 5 -5.522 -2.727 -0.705
21 1HB CYS 5 2HB CYS 5 -5.801 -1.535 1.602
22 2HB CYS 5 1HB CYS 5 -4.183 -1.886 1.011
23 H ALA 6 H ALA 6 -7.043 -1.319 -2.569
24 HA ALA 6 HA ALA 6 -9.257 0.057 -1.576
25 1HB ALA 6 1HB ALA 6 -9.640 -1.642 -3.968
26 2HB ALA 6 2HB ALA 6 -8.359 -0.430 -4.031
27 3HB ALA 6 3HB ALA 6 -10.023 0.060 -3.713
28 H MET 7 H MET 7 -8.721 -3.366 -1.994
29 HA MET 7 HA MET 7 -11.444 -4.031 -1.230
30 1HB MET 7 2HB MET 7 -10.169 -5.316 -2.971
31 2HB MET 7 1HB MET 7 -9.112 -5.890 -1.695
32 1HG MET 7 2HG MET 7 -11.025 -6.943 -0.588
33 2HG MET 7 1HG MET 7 -12.071 -6.395 -1.897
34 1HE MET 7 1HE MET 7 -8.703 -9.517 -2.357
35 2HE MET 7 2HE MET 7 -9.079 -8.646 -0.870
36 3HE MET 7 3HE MET 7 -8.349 -7.793 -2.230
37 H ILE 8 H ILE 8 -8.237 -4.937 -0.104
38 HA ILE 8 HA ILE 8 -9.297 -5.073 2.640
39 HB ILE 8 HB ILE 8 -7.445 -6.689 3.119
40 1HG1 ILE 8 2HG1 ILE 8 -7.207 -6.818 0.102
41 2HG1 ILE 8 1HG1 ILE 8 -6.019 -6.085 1.176
42 1HG2 ILE 8 1HG2 ILE 8 -8.713 -8.364 1.261
43 2HG2 ILE 8 2HG2 ILE 8 -9.898 -7.137 1.706
44 3HG2 ILE 8 3HG2 ILE 8 -9.134 -8.117 2.956
45 1HD1 ILE 8 1HD1 ILE 8 -5.229 -8.240 0.590
46 2HD1 ILE 8 2HD1 ILE 8 -6.778 -8.986 0.983
47 3HD1 ILE 8 3HD1 ILE 8 -5.766 -8.323 2.267
48 H SER 9 H SER 9 -8.212 -3.964 4.199
49 HA SER 9 HA SER 9 -6.378 -1.939 3.350
50 1HB SER 9 2HB SER 9 -8.128 -1.584 5.089
51 2HB SER 9 1HB SER 9 -7.241 -2.663 6.163
52 HG SER 9 HG SER 9 -5.432 -1.170 5.869
53 H PHE 10 H PHE 10 -5.175 -4.222 2.727
54 HA PHE 10 HA PHE 10 -2.770 -4.121 4.327
55 1HB PHE 10 2HB PHE 10 -4.004 -5.919 5.435
56 2HB PHE 10 1HB PHE 10 -4.252 -6.728 3.892
57 HD1 PHE 10 1HD PHE 10 -1.269 -5.209 5.550
58 HD2 PHE 10 2HD PHE 10 -3.031 -8.665 3.802
59 HE1 PHE 10 1HE PHE 10 0.839 -6.435 5.861
60 HE2 PHE 10 2HE PHE 10 -0.926 -9.899 4.111
61 HZ PHE 10 HZ PHE 10 1.012 -8.785 5.141
62 H CYS 11 H CYS 11 -1.255 -3.800 2.899
63 HA CYS 11 HA CYS 11 -1.634 -4.705 0.144
64 1HB CYS 11 2HB CYS 11 0.539 -2.935 1.272
65 2HB CYS 11 1HB CYS 11 0.131 -3.160 -0.418
66 H PHE 12 H PHE 12 -0.059 -5.937 -0.973
67 HA PHE 12 HA PHE 12 1.261 -7.902 0.625
68 1HB PHE 12 2HB PHE 12 0.387 -8.384 -1.648
69 2HB PHE 12 1HB PHE 12 1.587 -7.291 -2.328
70 HD1 PHE 12 1HD PHE 12 3.162 -8.482 -3.487
71 HD2 PHE 12 2HD PHE 12 1.772 -9.998 0.239
72 HE1 PHE 12 1HE PHE 12 4.765 -10.341 -3.650
73 HE2 PHE 12 2HE PHE 12 3.374 -11.859 0.084
74 HZ PHE 12 HZ PHE 12 4.873 -12.031 -1.862
75 H THR 13 H THR 13 2.209 -5.008 -1.128
76 HA THR 13 HA THR 13 5.013 -5.353 -0.585
77 HB THR 13 HB THR 13 4.175 -4.173 -2.614
78 HG1 THR 13 1HG THR 13 5.609 -2.135 -1.508
79 1HG2 THR 13 1HG2 THR 13 2.374 -2.935 -1.238
80 2HG2 THR 13 2HG2 THR 13 3.173 -2.074 -2.555
81 3HG2 THR 13 3HG2 THR 13 3.662 -1.780 -0.886
82 H GLU 14 H GLU 14 2.490 -4.526 1.353
83 HA GLU 14 HA GLU 14 3.524 -2.325 2.827
84 1HB GLU 14 2HB GLU 14 1.130 -3.351 2.803
85 2HB GLU 14 1HB GLU 14 1.757 -4.446 4.019
86 1HG GLU 14 2HG GLU 14 1.852 -2.850 5.611
87 2HG GLU 14 1HG GLU 14 2.200 -1.563 4.456
88 H VAL 15 H VAL 15 3.788 -5.789 3.095
89 HA VAL 15 HA VAL 15 5.022 -6.027 5.575
90 HB VAL 15 HB VAL 15 5.519 -7.792 3.176
91 1HG1 VAL 15 1HG1 VAL 15 5.425 -8.676 6.036
92 2HG1 VAL 15 2HG1 VAL 15 6.905 -8.019 5.341
93 3HG1 VAL 15 3HG1 VAL 15 6.172 -9.467 4.647
94 1HG2 VAL 15 1HG2 VAL 15 3.535 -8.892 3.526
95 2HG2 VAL 15 2HG2 VAL 15 3.065 -7.237 3.909
96 3HG2 VAL 15 3HG2 VAL 15 3.417 -8.376 5.209
97 H ILE 16 H ILE 16 6.441 -5.206 2.438
98 HA ILE 16 HA ILE 16 9.108 -5.509 3.501
99 HB ILE 16 HB ILE 16 9.960 -4.909 1.335
100 1HG1 ILE 16 2HG1 ILE 16 7.097 -4.410 0.494
101 2HG1 ILE 16 1HG1 ILE 16 8.274 -3.143 0.824
102 1HG2 ILE 16 1HG2 ILE 16 8.448 -6.608 -0.036
103 2HG2 ILE 16 2HG2 ILE 16 7.822 -6.945 1.580
104 3HG2 ILE 16 3HG2 ILE 16 9.542 -7.139 1.243
105 1HD1 ILE 16 1HD1 ILE 16 7.765 -4.281 -1.616
106 2HD1 ILE 16 2HD1 ILE 16 9.234 -5.104 -1.093
107 3HD1 ILE 16 3HD1 ILE 16 9.196 -3.344 -1.189
108 H GLY 17 H GLY 17 6.832 -3.024 3.545
109 1HA GLY 17 2HA GLY 17 8.159 -1.252 5.034
110 2HA GLY 17 1HA GLY 17 8.851 -0.920 3.458
111 H CYS 18 H CYS 18 6.308 -1.415 2.049
112 HA CYS 18 HA CYS 18 5.334 1.226 2.084
113 1HB CYS 18 2HB CYS 18 4.110 -1.278 0.928
114 2HB CYS 18 1HB CYS 18 3.501 0.346 0.637
115 H SER 19 H SER 19 2.930 1.726 2.319
116 HA SER 19 HA SER 19 1.643 0.271 4.486
117 1HB SER 19 2HB SER 19 1.275 2.495 5.692
118 2HB SER 19 1HB SER 19 2.903 1.822 5.778
119 HG SER 19 HG SER 19 2.793 3.324 3.607
120 H CYS 20 H CYS 20 -0.552 0.393 4.439
121 HA CYS 20 HA CYS 20 -1.774 1.353 2.046
122 1HB CYS 20 2HB CYS 20 -2.680 -0.610 3.107
123 2HB CYS 20 1HB CYS 20 -2.930 0.260 4.617
124 H LYS 21 H LYS 21 -2.739 3.257 1.632
125 HA LYS 21 HA LYS 21 -3.628 4.955 3.816
126 1HB LYS 21 2HB LYS 21 -1.237 5.542 3.478
127 2HB LYS 21 1HB LYS 21 -1.587 5.908 1.794
128 1HG LYS 21 2HG LYS 21 -3.215 7.633 2.613
129 2HG LYS 21 1HG LYS 21 -2.577 7.353 4.235
130 1HD LYS 21 2HD LYS 21 -0.373 8.033 3.533
131 2HD LYS 21 1HD LYS 21 -0.910 8.172 1.858
132 1HE LYS 21 2HE LYS 21 -2.496 9.937 2.560
133 2HE LYS 21 1HE LYS 21 -1.839 9.837 4.193
134 1HZ LYS 21 1HZ LYS 21 0.230 10.171 2.276
135 2HZ LYS 21 2HZ LYS 21 -0.149 11.129 3.618
136 3HZ LYS 21 3HZ LYS 21 -0.915 11.409 2.137
137 H ASN 22 H ASN 22 -5.523 5.745 3.268
138 HA ASN 22 HA ASN 22 -7.410 6.087 2.075
139 1HB ASN 22 2HB ASN 22 -7.253 7.882 0.364
140 2HB ASN 22 1HB ASN 22 -6.484 8.283 1.889
141 1HD2 ASN 22 1HD2 ASN 22 -6.063 7.786 -1.480
142 2HD2 ASN 22 2HD2 ASN 22 -4.400 8.242 -1.563
143 H LYS 23 H LYS 23 -6.601 3.651 1.444
144 HA LYS 23 HA LYS 23 -7.189 1.988 0.026
145 1HB LYS 23 2HB LYS 23 -9.083 3.040 -0.793
146 2HB LYS 23 1HB LYS 23 -8.171 4.320 -1.576
147 1HG LYS 23 2HG LYS 23 -7.395 2.650 -3.245
148 2HG LYS 23 1HG LYS 23 -8.460 1.465 -2.485
149 1HD LYS 23 2HD LYS 23 -9.546 2.443 -4.422
150 2HD LYS 23 1HD LYS 23 -10.386 2.928 -2.947
151 1HE LYS 23 2HE LYS 23 -9.229 5.080 -2.994
152 2HE LYS 23 1HE LYS 23 -8.367 4.593 -4.452
153 1HZ LYS 23 1HZ LYS 23 -11.257 4.405 -4.588
154 2HZ LYS 23 2HZ LYS 23 -10.154 4.973 -5.735
155 3HZ LYS 23 3HZ LYS 23 -10.642 5.977 -4.466
156 H VAL 24 H VAL 24 -4.756 4.261 -0.741
157 HA VAL 24 HA VAL 24 -3.715 2.367 -2.744
158 HB VAL 24 HB VAL 24 -4.152 4.631 -3.638
159 1HG1 VAL 24 1HG1 VAL 24 -1.836 5.954 -2.590
160 2HG1 VAL 24 2HG1 VAL 24 -2.928 5.503 -1.280
161 3HG1 VAL 24 3HG1 VAL 24 -3.516 6.489 -2.618
162 1HG2 VAL 24 1HG2 VAL 24 -1.937 4.908 -4.725
163 2HG2 VAL 24 2HG2 VAL 24 -2.545 3.253 -4.750
164 3HG2 VAL 24 3HG2 VAL 24 -1.287 3.713 -3.603
165 H CYS 25 H CYS 25 -1.716 1.514 -2.526
166 HA CYS 25 HA CYS 25 -0.522 1.688 0.102
167 1HB CYS 25 2HB CYS 25 0.476 0.099 -2.263
168 2HB CYS 25 1HB CYS 25 0.773 -0.209 -0.553
169 H TYR 26 H TYR 26 0.909 3.197 0.589
170 HA TYR 26 HA TYR 26 2.830 4.050 -1.475
171 1HB TYR 26 2HB TYR 26 1.095 5.693 0.282
172 2HB TYR 26 1HB TYR 26 2.735 6.263 0.033
173 HD1 TYR 26 1HD TYR 26 2.289 8.211 -1.208
174 HD2 TYR 26 2HD TYR 26 0.664 4.499 -2.491
175 HE1 TYR 26 1HE TYR 26 1.648 9.239 -3.347
176 HE2 TYR 26 2HE TYR 26 0.017 5.516 -4.631
177 HH TYR 26 HH TYR 26 0.613 8.949 -5.294
178 H LEU 27 H LEU 27 4.810 4.853 -0.727
179 HA LEU 27 HA LEU 27 5.593 4.136 2.009
180 1HB LEU 27 2HB LEU 27 6.302 2.267 0.636
181 2HB LEU 27 1HB LEU 27 7.011 3.349 -0.542
182 HG LEU 27 HG LEU 27 8.738 4.003 1.050
183 1HD1 LEU 27 1HD1 LEU 27 7.194 3.604 3.056
184 2HD1 LEU 27 2HD1 LEU 27 8.904 3.210 3.233
185 3HD1 LEU 27 3HD1 LEU 27 7.726 1.926 2.957
186 1HD2 LEU 27 1HD2 LEU 27 9.741 1.648 1.381
187 2HD2 LEU 27 2HD2 LEU 27 9.443 2.225 -0.258
188 3HD2 LEU 27 3HD2 LEU 27 8.321 1.093 0.496
189 H ASN 28 H ASN 28 5.983 6.136 2.760
190 HA ASN 28 HA ASN 28 6.856 8.223 3.000
191 1HB ASN 28 2HB ASN 28 8.992 6.879 2.774
192 2HB ASN 28 1HB ASN 28 9.012 7.328 1.072
193 1HD2 ASN 28 1HD2 ASN 28 10.340 8.933 0.668
194 2HD2 ASN 28 2HD2 ASN 28 10.686 10.262 1.713
195 H SER 29 H SER 29 4.814 8.015 1.269
196 HA SER 29 HA SER 29 3.630 9.217 -0.225
197 1HB SER 29 2HB SER 29 6.105 10.940 -0.457
198 2HB SER 29 1HB SER 29 4.504 11.346 -1.079
199 HG SER 29 HG SER 29 5.453 11.784 1.341
200 H ILE 30 H ILE 30 6.012 7.218 -0.969
201 HA ILE 30 HA ILE 30 6.061 7.744 -3.844
202 HB ILE 30 HB ILE 30 7.484 5.608 -2.237
203 1HG1 ILE 30 2HG1 ILE 30 8.320 7.846 -1.722
204 2HG1 ILE 30 1HG1 ILE 30 9.512 6.950 -2.656
205 1HG2 ILE 30 1HG2 ILE 30 8.567 4.903 -4.160
206 2HG2 ILE 30 2HG2 ILE 30 8.194 6.387 -5.038
207 3HG2 ILE 30 3HG2 ILE 30 6.924 5.201 -4.732
208 1HD1 ILE 30 1HD1 ILE 30 7.623 8.721 -4.110
209 2HD1 ILE 30 2HD1 ILE 30 9.294 8.297 -4.482
210 3HD1 ILE 30 3HD1 ILE 30 8.941 9.453 -3.196
211 H SER 31 H SER 31 4.893 6.583 -5.280
212 HA SER 31 HA SER 31 2.766 4.933 -4.398
213 1HB SER 31 2HB SER 31 3.816 5.097 -7.222
214 2HB SER 31 1HB SER 31 2.159 4.807 -6.689
215 HG SER 31 HG SER 31 1.895 6.905 -6.279
Start of MODEL 2
1 1H CYS 1 H CYS 1 2.709 2.775 -3.853
2 HA CYS 1 HA CYS 1 5.095 1.316 -4.658
3 1HB CYS 1 2HB CYS 1 2.816 0.602 -2.804
4 2HB CYS 1 1HB CYS 1 4.190 -0.450 -3.123
5 H GLY 2 H GLY 2 2.379 1.974 -6.195
6 1HA GLY 2 2HA GLY 2 1.274 1.013 -7.971
7 2HA GLY 2 1HA GLY 2 2.592 -0.146 -8.043
8 H GLU 3 H GLU 3 0.392 0.392 -5.358
9 HA GLU 3 HA GLU 3 -1.101 -2.023 -5.933
10 1HB GLU 3 2HB GLU 3 0.853 -2.854 -4.686
11 2HB GLU 3 1HB GLU 3 0.530 -1.703 -3.400
12 1HG GLU 3 2HG GLU 3 -1.529 -2.820 -2.855
13 2HG GLU 3 1HG GLU 3 -1.341 -3.909 -4.227
14 H SER 4 H SER 4 -3.085 -2.098 -4.760
15 HA SER 4 HA SER 4 -3.682 0.334 -3.229
16 1HB SER 4 2HB SER 4 -5.940 0.338 -4.342
17 2HB SER 4 1HB SER 4 -4.592 0.720 -5.413
18 HG SER 4 HG SER 4 -5.332 -1.958 -5.202
19 H CYS 5 H CYS 5 -4.719 0.041 -1.397
20 HA CYS 5 HA CYS 5 -5.569 -2.645 -0.639
21 1HB CYS 5 2HB CYS 5 -5.870 -1.339 1.632
22 2HB CYS 5 1HB CYS 5 -4.262 -1.792 1.080
23 H ALA 6 H ALA 6 -7.080 -1.163 -2.537
24 HA ALA 6 HA ALA 6 -9.341 0.093 -1.407
25 1HB ALA 6 1HB ALA 6 -8.654 -0.971 -4.101
26 2HB ALA 6 2HB ALA 6 -9.042 0.677 -3.606
27 3HB ALA 6 3HB ALA 6 -10.324 -0.525 -3.751
28 H MET 7 H MET 7 -8.589 -3.206 -2.113
29 HA MET 7 HA MET 7 -11.316 -4.114 -1.688
30 1HB MET 7 2HB MET 7 -9.724 -5.155 -3.362
31 2HB MET 7 1HB MET 7 -8.828 -5.793 -1.999
32 1HG MET 7 2HG MET 7 -10.828 -7.010 -1.266
33 2HG MET 7 1HG MET 7 -11.696 -6.406 -2.676
34 1HE MET 7 1HE MET 7 -8.695 -9.373 -1.851
35 2HE MET 7 2HE MET 7 -8.350 -7.647 -1.723
36 3HE MET 7 3HE MET 7 -7.781 -8.559 -3.122
37 H ILE 8 H ILE 8 -8.152 -4.648 -0.267
38 HA ILE 8 HA ILE 8 -9.417 -5.018 2.359
39 HB ILE 8 HB ILE 8 -7.651 -6.707 2.908
40 1HG1 ILE 8 2HG1 ILE 8 -7.225 -6.770 -0.090
41 2HG1 ILE 8 1HG1 ILE 8 -6.088 -6.094 1.073
42 1HG2 ILE 8 1HG2 ILE 8 -9.772 -7.602 2.551
43 2HG2 ILE 8 2HG2 ILE 8 -8.730 -8.552 1.491
44 3HG2 ILE 8 3HG2 ILE 8 -9.727 -7.261 0.822
45 1HD1 ILE 8 1HD1 ILE 8 -6.490 -8.616 2.046
46 2HD1 ILE 8 2HD1 ILE 8 -5.141 -8.106 1.030
47 3HD1 ILE 8 3HD1 ILE 8 -6.560 -8.860 0.301
48 H SER 9 H SER 9 -8.328 -4.098 4.057
49 HA SER 9 HA SER 9 -6.421 -2.062 3.411
50 1HB SER 9 2HB SER 9 -8.196 -1.738 5.110
51 2HB SER 9 1HB SER 9 -7.438 -2.965 6.121
52 HG SER 9 HG SER 9 -5.546 -1.601 6.119
53 H PHE 10 H PHE 10 -5.226 -4.233 2.628
54 HA PHE 10 HA PHE 10 -2.915 -4.433 4.360
55 1HB PHE 10 2HB PHE 10 -4.198 -6.326 5.154
56 2HB PHE 10 1HB PHE 10 -4.517 -6.861 3.510
57 HD1 PHE 10 1HD PHE 10 -1.489 -5.946 5.505
58 HD2 PHE 10 2HD PHE 10 -3.374 -8.745 2.913
59 HE1 PHE 10 1HE PHE 10 0.526 -7.358 5.570
60 HE2 PHE 10 2HE PHE 10 -1.363 -10.164 2.976
61 HZ PHE 10 HZ PHE 10 0.590 -9.469 4.305
62 H CYS 11 H CYS 11 -1.285 -3.991 3.078
63 HA CYS 11 HA CYS 11 -1.515 -4.529 0.206
64 1HB CYS 11 2HB CYS 11 0.602 -2.974 1.702
65 2HB CYS 11 1HB CYS 11 0.385 -3.029 -0.039
66 H PHE 12 H PHE 12 -0.064 -5.862 -0.892
67 HA PHE 12 HA PHE 12 1.179 -7.900 0.676
68 1HB PHE 12 2HB PHE 12 1.237 -7.270 -2.276
69 2HB PHE 12 1HB PHE 12 2.146 -8.607 -1.581
70 HD1 PHE 12 1HD PHE 12 -1.332 -7.330 -1.040
71 HD2 PHE 12 2HD PHE 12 1.169 -10.595 -2.133
72 HE1 PHE 12 1HE PHE 12 -3.311 -8.778 -1.220
73 HE2 PHE 12 2HE PHE 12 -0.807 -12.049 -2.315
74 HZ PHE 12 HZ PHE 12 -3.050 -11.141 -1.860
75 H THR 13 H THR 13 2.198 -4.925 -0.819
76 HA THR 13 HA THR 13 5.000 -5.521 -0.306
77 HB THR 13 HB THR 13 4.405 -4.465 -2.444
78 HG1 THR 13 1HG THR 13 5.800 -2.394 -1.234
79 1HG2 THR 13 1HG2 THR 13 3.552 -2.136 -0.729
80 2HG2 THR 13 2HG2 THR 13 2.513 -3.122 -1.755
81 3HG2 THR 13 3HG2 THR 13 3.741 -2.088 -2.482
82 H GLU 14 H GLU 14 2.592 -4.434 1.668
83 HA GLU 14 HA GLU 14 3.934 -2.169 2.794
84 1HB GLU 14 2HB GLU 14 2.350 -2.197 4.585
85 2HB GLU 14 1HB GLU 14 1.503 -2.471 3.079
86 1HG GLU 14 2HG GLU 14 1.369 -4.852 3.589
87 2HG GLU 14 1HG GLU 14 2.228 -4.569 5.105
88 H VAL 15 H VAL 15 3.995 -5.602 3.405
89 HA VAL 15 HA VAL 15 5.359 -5.534 5.872
90 HB VAL 15 HB VAL 15 6.042 -7.858 5.373
91 1HG1 VAL 15 1HG1 VAL 15 4.029 -8.164 6.285
92 2HG1 VAL 15 2HG1 VAL 15 3.461 -8.457 4.642
93 3HG1 VAL 15 3HG1 VAL 15 3.310 -6.851 5.353
94 1HG2 VAL 15 1HG2 VAL 15 4.523 -7.761 2.802
95 2HG2 VAL 15 2HG2 VAL 15 5.753 -8.904 3.339
96 3HG2 VAL 15 3HG2 VAL 15 6.219 -7.282 2.829
97 H ILE 16 H ILE 16 6.369 -4.974 2.639
98 HA ILE 16 HA ILE 16 9.169 -5.412 3.090
99 HB ILE 16 HB ILE 16 7.807 -3.994 0.796
100 1HG1 ILE 16 2HG1 ILE 16 7.033 -6.308 0.994
101 2HG1 ILE 16 1HG1 ILE 16 8.058 -6.119 -0.423
102 1HG2 ILE 16 1HG2 ILE 16 9.831 -4.241 -0.428
103 2HG2 ILE 16 2HG2 ILE 16 10.549 -5.234 0.840
104 3HG2 ILE 16 3HG2 ILE 16 10.247 -3.521 1.128
105 1HD1 ILE 16 1HD1 ILE 16 9.012 -7.994 0.346
106 2HD1 ILE 16 2HD1 ILE 16 8.448 -7.731 1.995
107 3HD1 ILE 16 3HD1 ILE 16 9.882 -6.889 1.408
108 H GLY 17 H GLY 17 6.952 -2.764 3.192
109 1HA GLY 17 2HA GLY 17 8.293 -1.124 4.887
110 2HA GLY 17 1HA GLY 17 8.983 -0.722 3.321
111 H CYS 18 H CYS 18 6.420 -1.275 1.959
112 HA CYS 18 HA CYS 18 5.383 1.331 1.933
113 1HB CYS 18 2HB CYS 18 4.175 -1.251 0.933
114 2HB CYS 18 1HB CYS 18 3.557 0.347 0.551
115 H SER 19 H SER 19 2.985 1.801 2.237
116 HA SER 19 HA SER 19 1.722 0.361 4.417
117 1HB SER 19 2HB SER 19 2.382 3.311 4.653
118 2HB SER 19 1HB SER 19 1.476 2.352 5.824
119 HG SER 19 HG SER 19 3.755 1.089 5.409
120 H CYS 20 H CYS 20 -0.475 0.484 4.315
121 HA CYS 20 HA CYS 20 -1.669 1.503 1.954
122 1HB CYS 20 2HB CYS 20 -2.632 -0.440 2.987
123 2HB CYS 20 1HB CYS 20 -2.851 0.403 4.514
124 H LYS 21 H LYS 21 -2.560 3.435 1.533
125 HA LYS 21 HA LYS 21 -3.404 5.160 3.724
126 1HB LYS 21 2HB LYS 21 -1.013 5.717 3.295
127 2HB LYS 21 1HB LYS 21 -1.424 6.086 1.626
128 1HG LYS 21 2HG LYS 21 -2.892 7.888 2.384
129 2HG LYS 21 1HG LYS 21 -2.480 7.516 4.058
130 1HD LYS 21 2HD LYS 21 -1.160 9.393 3.343
131 2HD LYS 21 1HD LYS 21 -0.098 7.995 3.519
132 1HE LYS 21 2HE LYS 21 -0.144 7.634 1.114
133 2HE LYS 21 1HE LYS 21 -1.265 8.979 0.917
134 1HZ LYS 21 1HZ LYS 21 0.395 10.512 1.579
135 2HZ LYS 21 2HZ LYS 21 1.115 9.499 0.435
136 3HZ LYS 21 3HZ LYS 21 1.449 9.288 2.079
137 H ASN 22 H ASN 22 -5.333 5.852 3.231
138 HA ASN 22 HA ASN 22 -7.253 6.218 2.112
139 1HB ASN 22 2HB ASN 22 -7.208 8.052 0.495
140 2HB ASN 22 1HB ASN 22 -6.233 8.407 1.909
141 1HD2 ASN 22 1HD2 ASN 22 -4.419 9.397 1.477
142 2HD2 ASN 22 2HD2 ASN 22 -3.500 9.269 0.021
143 H LYS 23 H LYS 23 -6.474 3.771 1.442
144 HA LYS 23 HA LYS 23 -7.182 2.144 0.017
145 1HB LYS 23 2HB LYS 23 -9.016 3.058 -0.927
146 2HB LYS 23 1HB LYS 23 -8.196 4.552 -1.342
147 1HG LYS 23 2HG LYS 23 -7.077 3.183 -3.202
148 2HG LYS 23 1HG LYS 23 -8.339 1.992 -2.883
149 1HD LYS 23 2HD LYS 23 -8.844 3.647 -4.720
150 2HD LYS 23 1HD LYS 23 -10.057 3.529 -3.445
151 1HE LYS 23 2HE LYS 23 -9.528 5.867 -4.156
152 2HE LYS 23 1HE LYS 23 -9.301 5.559 -2.436
153 1HZ LYS 23 1HZ LYS 23 -7.494 6.755 -4.009
154 2HZ LYS 23 2HZ LYS 23 -6.943 5.157 -4.068
155 3HZ LYS 23 3HZ LYS 23 -7.108 5.939 -2.574
156 H VAL 24 H VAL 24 -4.674 4.349 -0.772
157 HA VAL 24 HA VAL 24 -3.657 2.388 -2.733
158 HB VAL 24 HB VAL 24 -2.797 5.275 -2.529
159 1HG1 VAL 24 1HG1 VAL 24 -2.429 3.752 -5.018
160 2HG1 VAL 24 2HG1 VAL 24 -1.455 3.211 -3.650
161 3HG1 VAL 24 3HG1 VAL 24 -1.346 4.882 -4.205
162 1HG2 VAL 24 1HG2 VAL 24 -4.277 4.520 -4.915
163 2HG2 VAL 24 2HG2 VAL 24 -4.464 5.925 -3.864
164 3HG2 VAL 24 3HG2 VAL 24 -5.244 4.399 -3.445
165 H CYS 25 H CYS 25 -1.682 1.480 -2.432
166 HA CYS 25 HA CYS 25 -0.500 1.751 0.189
167 1HB CYS 25 2HB CYS 25 0.427 0.077 -2.153
168 2HB CYS 25 1HB CYS 25 0.865 -0.145 -0.462
169 H TYR 26 H TYR 26 1.093 3.115 0.691
170 HA TYR 26 HA TYR 26 2.878 4.034 -1.472
171 1HB TYR 26 2HB TYR 26 1.707 5.687 0.764
172 2HB TYR 26 1HB TYR 26 3.013 6.229 -0.274
173 HD1 TYR 26 1HD TYR 26 2.581 6.714 -2.651
174 HD2 TYR 26 2HD TYR 26 -0.568 5.720 0.026
175 HE1 TYR 26 1HE TYR 26 0.955 7.666 -4.227
176 HE2 TYR 26 2HE TYR 26 -2.207 6.663 -1.546
177 HH TYR 26 HH TYR 26 -1.410 7.498 -4.757
178 H LEU 27 H LEU 27 4.966 4.417 -0.980
179 HA LEU 27 HA LEU 27 5.937 3.565 1.669
180 1HB LEU 27 2HB LEU 27 6.697 1.991 -0.007
181 2HB LEU 27 1HB LEU 27 7.195 3.291 -1.069
182 HG LEU 27 HG LEU 27 8.999 3.889 0.471
183 1HD1 LEU 27 1HD1 LEU 27 8.500 1.425 2.073
184 2HD1 LEU 27 2HD1 LEU 27 7.641 2.911 2.474
185 3HD1 LEU 27 3HD1 LEU 27 9.404 2.879 2.494
186 1HD2 LEU 27 1HD2 LEU 27 9.133 2.022 -1.317
187 2HD2 LEU 27 2HD2 LEU 27 9.209 0.933 0.068
188 3HD2 LEU 27 3HD2 LEU 27 10.438 2.181 -0.141
189 H ASN 28 H ASN 28 6.096 5.498 2.650
190 HA ASN 28 HA ASN 28 6.807 7.603 3.159
191 1HB ASN 28 2HB ASN 28 9.065 6.602 2.614
192 2HB ASN 28 1HB ASN 28 8.882 7.230 0.980
193 1HD2 ASN 28 1HD2 ASN 28 10.013 9.003 0.687
194 2HD2 ASN 28 2HD2 ASN 28 10.268 10.257 1.846
195 H SER 29 H SER 29 4.702 7.234 1.489
196 HA SER 29 HA SER 29 3.215 8.415 0.285
197 1HB SER 29 2HB SER 29 5.371 10.524 0.259
198 2HB SER 29 1HB SER 29 3.774 10.748 -0.461
199 HG SER 29 HG SER 29 4.485 11.028 2.083
200 H ILE 30 H ILE 30 5.876 7.008 -0.902
201 HA ILE 30 HA ILE 30 5.544 7.852 -3.675
202 HB ILE 30 HB ILE 30 7.339 5.723 -2.484
203 1HG1 ILE 30 2HG1 ILE 30 7.960 7.971 -1.743
204 2HG1 ILE 30 1HG1 ILE 30 9.159 7.338 -2.864
205 1HG2 ILE 30 1HG2 ILE 30 7.523 6.925 -5.236
206 2HG2 ILE 30 2HG2 ILE 30 6.678 5.414 -4.895
207 3HG2 ILE 30 3HG2 ILE 30 8.411 5.546 -4.589
208 1HD1 ILE 30 1HD1 ILE 30 7.381 9.656 -3.104
209 2HD1 ILE 30 2HD1 ILE 30 7.536 8.675 -4.562
210 3HD1 ILE 30 3HD1 ILE 30 8.973 9.362 -3.803
211 H SER 31 H SER 31 4.420 6.696 -5.185
212 HA SER 31 HA SER 31 2.493 4.825 -4.363
213 1HB SER 31 2HB SER 31 3.510 5.337 -7.166
214 2HB SER 31 1HB SER 31 1.961 4.612 -6.726
215 HG SER 31 HG SER 31 2.257 6.959 -5.461
Start of MODEL 3
1 1H CYS 1 H CYS 1 2.868 2.835 -3.799
2 HA CYS 1 HA CYS 1 5.231 1.305 -4.546
3 1HB CYS 1 2HB CYS 1 2.859 0.612 -2.803
4 2HB CYS 1 1HB CYS 1 4.233 -0.452 -3.077
5 H GLY 2 H GLY 2 2.508 2.068 -6.082
6 1HA GLY 2 2HA GLY 2 1.427 1.195 -7.914
7 2HA GLY 2 1HA GLY 2 2.739 0.034 -8.025
8 H GLU 3 H GLU 3 0.539 0.438 -5.315
9 HA GLU 3 HA GLU 3 -0.928 -1.969 -6.038
10 1HB GLU 3 2HB GLU 3 1.158 -2.458 -4.518
11 2HB GLU 3 1HB GLU 3 0.158 -1.772 -3.245
12 1HG GLU 3 2HG GLU 3 -1.618 -3.456 -4.021
13 2HG GLU 3 1HG GLU 3 -0.288 -4.254 -4.855
14 H SER 4 H SER 4 -2.862 -2.218 -4.624
15 HA SER 4 HA SER 4 -3.591 0.239 -3.218
16 1HB SER 4 2HB SER 4 -5.807 0.246 -4.392
17 2HB SER 4 1HB SER 4 -4.437 0.615 -5.441
18 HG SER 4 HG SER 4 -5.078 -2.061 -5.269
19 H CYS 5 H CYS 5 -4.676 -0.092 -1.428
20 HA CYS 5 HA CYS 5 -5.519 -2.794 -0.725
21 1HB CYS 5 2HB CYS 5 -5.878 -1.569 1.562
22 2HB CYS 5 1HB CYS 5 -4.242 -1.935 1.031
23 H ALA 6 H ALA 6 -6.952 -1.491 -2.656
24 HA ALA 6 HA ALA 6 -9.188 -0.037 -1.865
25 1HB ALA 6 1HB ALA 6 -9.956 -1.560 -4.089
26 2HB ALA 6 2HB ALA 6 -8.222 -1.280 -4.255
27 3HB ALA 6 3HB ALA 6 -9.324 0.087 -4.072
28 H MET 7 H MET 7 -8.681 -3.483 -1.958
29 HA MET 7 HA MET 7 -11.465 -4.056 -1.354
30 1HB MET 7 2HB MET 7 -10.016 -5.489 -2.860
31 2HB MET 7 1HB MET 7 -9.157 -5.994 -1.419
32 1HG MET 7 2HG MET 7 -10.780 -7.658 -1.988
33 2HG MET 7 1HG MET 7 -11.264 -6.863 -0.491
34 1HE MET 7 1HE MET 7 -13.926 -7.677 -0.706
35 2HE MET 7 2HE MET 7 -13.142 -8.666 -1.938
36 3HE MET 7 3HE MET 7 -14.628 -7.797 -2.320
37 H ILE 8 H ILE 8 -8.347 -4.762 0.105
38 HA ILE 8 HA ILE 8 -9.584 -4.542 2.754
39 HB ILE 8 HB ILE 8 -7.685 -6.320 3.354
40 1HG1 ILE 8 2HG1 ILE 8 -7.866 -8.160 1.573
41 2HG1 ILE 8 1HG1 ILE 8 -8.411 -6.894 0.481
42 1HG2 ILE 8 1HG2 ILE 8 -10.524 -6.635 2.541
43 2HG2 ILE 8 2HG2 ILE 8 -9.768 -6.833 4.122
44 3HG2 ILE 8 3HG2 ILE 8 -9.580 -8.084 2.893
45 1HD1 ILE 8 1HD1 ILE 8 -5.746 -7.597 1.305
46 2HD1 ILE 8 2HD1 ILE 8 -6.082 -5.893 1.611
47 3HD1 ILE 8 3HD1 ILE 8 -6.283 -6.554 -0.011
48 H SER 9 H SER 9 -8.296 -3.679 4.366
49 HA SER 9 HA SER 9 -6.296 -1.849 3.477
50 1HB SER 9 2HB SER 9 -7.927 -1.292 5.251
51 2HB SER 9 1HB SER 9 -7.194 -2.507 6.295
52 HG SER 9 HG SER 9 -5.229 -1.299 6.135
53 H PHE 10 H PHE 10 -5.254 -4.091 2.749
54 HA PHE 10 HA PHE 10 -2.883 -4.343 4.403
55 1HB PHE 10 2HB PHE 10 -4.240 -6.148 5.283
56 2HB PHE 10 1HB PHE 10 -4.609 -6.721 3.662
57 HD1 PHE 10 1HD PHE 10 -1.496 -5.848 5.543
58 HD2 PHE 10 2HD PHE 10 -3.570 -8.691 3.151
59 HE1 PHE 10 1HE PHE 10 0.456 -7.344 5.633
60 HE2 PHE 10 2HE PHE 10 -1.623 -10.190 3.237
61 HZ PHE 10 HZ PHE 10 0.394 -9.518 4.480
62 H CYS 11 H CYS 11 -1.328 -3.917 3.033
63 HA CYS 11 HA CYS 11 -1.668 -4.570 0.201
64 1HB CYS 11 2HB CYS 11 0.496 -2.949 1.550
65 2HB CYS 11 1HB CYS 11 0.236 -3.097 -0.180
66 H PHE 12 H PHE 12 -0.197 -5.825 -0.937
67 HA PHE 12 HA PHE 12 1.066 -7.906 0.565
68 1HB PHE 12 2HB PHE 12 0.139 -8.258 -1.710
69 2HB PHE 12 1HB PHE 12 1.374 -7.187 -2.364
70 HD1 PHE 12 1HD PHE 12 2.893 -8.387 -3.587
71 HD2 PHE 12 2HD PHE 12 1.469 -10.010 0.080
72 HE1 PHE 12 1HE PHE 12 4.415 -10.302 -3.849
73 HE2 PHE 12 2HE PHE 12 2.990 -11.927 -0.174
74 HZ PHE 12 HZ PHE 12 4.466 -12.075 -2.140
75 H THR 13 H THR 13 2.119 -4.993 -1.091
76 HA THR 13 HA THR 13 4.905 -5.507 -0.552
77 HB THR 13 HB THR 13 4.209 -4.394 -2.637
78 HG1 THR 13 1HG THR 13 5.656 -2.392 -1.326
79 1HG2 THR 13 1HG2 THR 13 2.695 -2.767 -2.598
80 2HG2 THR 13 2HG2 THR 13 3.852 -1.733 -1.758
81 3HG2 THR 13 3HG2 THR 13 2.734 -2.737 -0.835
82 H GLU 14 H GLU 14 2.512 -4.429 1.491
83 HA GLU 14 HA GLU 14 3.912 -2.211 2.625
84 1HB GLU 14 2HB GLU 14 2.334 -2.184 4.400
85 2HB GLU 14 1HB GLU 14 1.470 -2.502 2.911
86 1HG GLU 14 2HG GLU 14 1.310 -4.854 3.494
87 2HG GLU 14 1HG GLU 14 2.217 -4.550 4.979
88 H VAL 15 H VAL 15 4.011 -5.649 3.163
89 HA VAL 15 HA VAL 15 5.320 -5.618 5.656
90 HB VAL 15 HB VAL 15 4.297 -7.652 4.725
91 1HG1 VAL 15 1HG1 VAL 15 5.080 -7.272 2.380
92 2HG1 VAL 15 2HG1 VAL 15 5.267 -8.924 2.973
93 3HG1 VAL 15 3HG1 VAL 15 6.667 -7.855 2.885
94 1HG2 VAL 15 1HG2 VAL 15 5.995 -9.232 5.434
95 2HG2 VAL 15 2HG2 VAL 15 5.982 -7.825 6.498
96 3HG2 VAL 15 3HG2 VAL 15 7.241 -7.994 5.275
97 H ILE 16 H ILE 16 6.438 -5.026 2.427
98 HA ILE 16 HA ILE 16 9.221 -5.352 2.976
99 HB ILE 16 HB ILE 16 7.788 -4.005 0.687
100 1HG1 ILE 16 2HG1 ILE 16 9.017 -5.980 -0.522
101 2HG1 ILE 16 1HG1 ILE 16 9.078 -6.681 1.090
102 1HG2 ILE 16 1HG2 ILE 16 10.469 -4.565 -0.019
103 2HG2 ILE 16 2HG2 ILE 16 10.492 -3.644 1.486
104 3HG2 ILE 16 3HG2 ILE 16 9.661 -3.000 0.069
105 1HD1 ILE 16 1HD1 ILE 16 6.800 -6.963 1.194
106 2HD1 ILE 16 2HD1 ILE 16 7.131 -7.266 -0.512
107 3HD1 ILE 16 3HD1 ILE 16 6.483 -5.707 -0.002
108 H GLY 17 H GLY 17 6.938 -2.752 3.090
109 1HA GLY 17 2HA GLY 17 8.153 -1.193 4.958
110 2HA GLY 17 1HA GLY 17 8.909 -0.684 3.456
111 H CYS 18 H CYS 18 6.308 -1.331 2.053
112 HA CYS 18 HA CYS 18 5.250 1.275 2.014
113 1HB CYS 18 2HB CYS 18 4.072 -1.319 1.002
114 2HB CYS 18 1HB CYS 18 3.466 0.281 0.600
115 H SER 19 H SER 19 2.829 1.683 2.287
116 HA SER 19 HA SER 19 1.594 0.222 4.471
117 1HB SER 19 2HB SER 19 2.162 3.192 4.688
118 2HB SER 19 1HB SER 19 1.285 2.211 5.862
119 HG SER 19 HG SER 19 3.601 1.018 5.464
120 H CYS 20 H CYS 20 -0.621 0.347 4.421
121 HA CYS 20 HA CYS 20 -1.833 1.290 2.027
122 1HB CYS 20 2HB CYS 20 -2.761 -0.652 3.118
123 2HB CYS 20 1HB CYS 20 -3.016 0.246 4.609
124 H LYS 21 H LYS 21 -2.805 3.192 1.595
125 HA LYS 21 HA LYS 21 -3.632 4.936 3.771
126 1HB LYS 21 2HB LYS 21 -1.302 5.568 3.459
127 2HB LYS 21 1HB LYS 21 -1.547 5.726 1.725
128 1HG LYS 21 2HG LYS 21 -3.176 7.560 2.203
129 2HG LYS 21 1HG LYS 21 -2.690 7.465 3.897
130 1HD LYS 21 2HD LYS 21 -1.507 9.243 2.640
131 2HD LYS 21 1HD LYS 21 -0.417 8.038 3.326
132 1HE LYS 21 2HE LYS 21 0.184 8.672 1.016
133 2HE LYS 21 1HE LYS 21 -0.189 6.957 1.181
134 1HZ LYS 21 1HZ LYS 21 -2.585 8.101 0.539
135 2HZ LYS 21 2HZ LYS 21 -1.565 7.263 -0.521
136 3HZ LYS 21 3HZ LYS 21 -1.473 8.948 -0.418
137 H ASN 22 H ASN 22 -5.569 5.608 3.254
138 HA ASN 22 HA ASN 22 -7.477 5.926 2.096
139 1HB ASN 22 2HB ASN 22 -7.479 7.793 0.553
140 2HB ASN 22 1HB ASN 22 -6.451 8.144 1.930
141 1HD2 ASN 22 1HD2 ASN 22 -6.678 7.941 -1.444
142 2HD2 ASN 22 2HD2 ASN 22 -5.035 8.305 -1.820
143 H LYS 23 H LYS 23 -6.604 3.524 1.428
144 HA LYS 23 HA LYS 23 -7.161 1.860 0.009
145 1HB LYS 23 2HB LYS 23 -9.099 2.854 -0.765
146 2HB LYS 23 1HB LYS 23 -8.245 4.172 -1.550
147 1HG LYS 23 2HG LYS 23 -7.582 2.734 -3.347
148 2HG LYS 23 1HG LYS 23 -8.224 1.320 -2.509
149 1HD LYS 23 2HD LYS 23 -9.838 3.678 -3.485
150 2HD LYS 23 1HD LYS 23 -9.751 2.096 -4.262
151 1HE LYS 23 2HE LYS 23 -10.687 1.072 -2.224
152 2HE LYS 23 1HE LYS 23 -10.822 2.673 -1.500
153 1HZ LYS 23 1HZ LYS 23 -12.128 2.026 -4.069
154 2HZ LYS 23 2HZ LYS 23 -12.475 3.291 -2.999
155 3HZ LYS 23 3HZ LYS 23 -12.879 1.700 -2.588
156 H VAL 24 H VAL 24 -4.814 4.208 -0.779
157 HA VAL 24 HA VAL 24 -3.734 2.360 -2.804
158 HB VAL 24 HB VAL 24 -4.200 4.608 -3.689
159 1HG1 VAL 24 1HG1 VAL 24 -2.510 5.435 -1.411
160 2HG1 VAL 24 2HG1 VAL 24 -3.877 6.252 -2.173
161 3HG1 VAL 24 3HG1 VAL 24 -2.283 6.304 -2.929
162 1HG2 VAL 24 1HG2 VAL 24 -1.769 5.015 -4.511
163 2HG2 VAL 24 2HG2 VAL 24 -2.604 3.522 -4.941
164 3HG2 VAL 24 3HG2 VAL 24 -1.421 3.526 -3.632
165 H CYS 25 H CYS 25 -1.750 1.496 -2.563
166 HA CYS 25 HA CYS 25 -0.549 1.692 0.062
167 1HB CYS 25 2HB CYS 25 0.378 0.058 -2.303
168 2HB CYS 25 1HB CYS 25 0.794 -0.192 -0.611
169 H TYR 26 H TYR 26 0.962 3.102 0.570
170 HA TYR 26 HA TYR 26 2.845 4.006 -1.514
171 1HB TYR 26 2HB TYR 26 1.208 5.593 0.393
172 2HB TYR 26 1HB TYR 26 2.843 6.148 0.087
173 HD1 TYR 26 1HD TYR 26 0.728 4.528 -2.478
174 HD2 TYR 26 2HD TYR 26 2.250 8.193 -0.956
175 HE1 TYR 26 1HE TYR 26 -0.033 5.681 -4.508
176 HE2 TYR 26 2HE TYR 26 1.493 9.356 -2.983
177 HH TYR 26 HH TYR 26 0.990 8.750 -5.371
178 H LEU 27 H LEU 27 4.876 4.732 -0.753
179 HA LEU 27 HA LEU 27 5.668 3.856 1.938
180 1HB LEU 27 2HB LEU 27 6.254 2.211 -0.006
181 2HB LEU 27 1HB LEU 27 7.437 3.418 -0.462
182 HG LEU 27 HG LEU 27 7.373 2.029 2.224
183 1HD1 LEU 27 1HD1 LEU 27 9.136 1.510 -0.165
184 2HD1 LEU 27 2HD1 LEU 27 7.835 0.463 0.398
185 3HD1 LEU 27 3HD1 LEU 27 9.255 0.727 1.412
186 1HD2 LEU 27 1HD2 LEU 27 8.480 4.357 1.920
187 2HD2 LEU 27 2HD2 LEU 27 9.720 3.458 1.043
188 3HD2 LEU 27 3HD2 LEU 27 9.377 3.072 2.731
189 H ASN 28 H ASN 28 6.046 5.826 2.785
190 HA ASN 28 HA ASN 28 6.890 7.912 3.116
191 1HB ASN 28 2HB ASN 28 9.036 6.594 2.876
192 2HB ASN 28 1HB ASN 28 9.083 7.103 1.192
193 1HD2 ASN 28 1HD2 ASN 28 10.385 8.746 0.857
194 2HD2 ASN 28 2HD2 ASN 28 10.715 10.032 1.960
195 H SER 29 H SER 29 4.863 7.867 1.411
196 HA SER 29 HA SER 29 3.716 9.189 -0.012
197 1HB SER 29 2HB SER 29 6.287 10.754 -0.291
198 2HB SER 29 1HB SER 29 4.695 11.276 -0.846
199 HG SER 29 HG SER 29 5.751 11.592 1.550
200 H ILE 30 H ILE 30 6.244 7.252 -0.926
201 HA ILE 30 HA ILE 30 6.041 7.806 -3.777
202 HB ILE 30 HB ILE 30 7.596 5.638 -2.349
203 1HG1 ILE 30 2HG1 ILE 30 8.567 8.280 -3.469
204 2HG1 ILE 30 1HG1 ILE 30 8.304 7.954 -1.758
205 1HG2 ILE 30 1HG2 ILE 30 6.911 5.701 -4.980
206 2HG2 ILE 30 2HG2 ILE 30 8.354 4.917 -4.338
207 3HG2 ILE 30 3HG2 ILE 30 8.459 6.547 -5.003
208 1HD1 ILE 30 1HD1 ILE 30 10.605 7.718 -2.090
209 2HD1 ILE 30 2HD1 ILE 30 10.384 6.800 -3.579
210 3HD1 ILE 30 3HD1 ILE 30 9.985 6.067 -2.025
211 H SER 31 H SER 31 4.848 6.638 -5.189
212 HA SER 31 HA SER 31 2.791 4.931 -4.256
213 1HB SER 31 2HB SER 31 3.773 5.253 -7.101
214 2HB SER 31 1HB SER 31 2.170 4.733 -6.578
215 HG SER 31 HG SER 31 1.629 6.752 -6.472
Start of MODEL 4
1 1H CYS 1 H CYS 1 2.755 2.869 -3.914
2 HA CYS 1 HA CYS 1 5.118 1.342 -4.664
3 1HB CYS 1 2HB CYS 1 2.673 0.511 -3.091
4 2HB CYS 1 1HB CYS 1 4.149 -0.430 -3.268
5 H GLY 2 H GLY 2 2.180 2.082 -6.007
6 1HA GLY 2 2HA GLY 2 1.171 1.318 -7.940
7 2HA GLY 2 1HA GLY 2 2.491 0.170 -8.114
8 H GLU 3 H GLU 3 0.453 0.421 -5.290
9 HA GLU 3 HA GLU 3 -1.013 -1.994 -6.046
10 1HB GLU 3 2HB GLU 3 1.042 -2.462 -4.520
11 2HB GLU 3 1HB GLU 3 0.088 -1.700 -3.256
12 1HG GLU 3 2HG GLU 3 -1.738 -3.382 -3.903
13 2HG GLU 3 1HG GLU 3 -0.451 -4.241 -4.745
14 H SER 4 H SER 4 -2.998 -2.233 -4.777
15 HA SER 4 HA SER 4 -3.803 0.252 -3.443
16 1HB SER 4 2HB SER 4 -6.037 0.035 -4.574
17 2HB SER 4 1HB SER 4 -4.703 0.426 -5.661
18 HG SER 4 HG SER 4 -5.267 -2.272 -5.270
19 H CYS 5 H CYS 5 -4.676 -0.046 -1.548
20 HA CYS 5 HA CYS 5 -5.452 -2.721 -0.686
21 1HB CYS 5 2HB CYS 5 -5.703 -1.434 1.564
22 2HB CYS 5 1HB CYS 5 -4.089 -1.754 0.946
23 H ALA 6 H ALA 6 -7.055 -1.400 -2.577
24 HA ALA 6 HA ALA 6 -9.298 -0.091 -1.509
25 1HB ALA 6 1HB ALA 6 -8.918 0.148 -3.817
26 2HB ALA 6 2HB ALA 6 -10.393 -0.809 -3.683
27 3HB ALA 6 3HB ALA 6 -8.865 -1.598 -4.068
28 H MET 7 H MET 7 -8.553 -3.461 -1.877
29 HA MET 7 HA MET 7 -11.252 -4.312 -1.215
30 1HB MET 7 2HB MET 7 -9.772 -5.542 -2.848
31 2HB MET 7 1HB MET 7 -8.769 -6.006 -1.488
32 1HG MET 7 2HG MET 7 -10.679 -7.157 -0.476
33 2HG MET 7 1HG MET 7 -11.667 -6.720 -1.867
34 1HE MET 7 1HE MET 7 -7.921 -9.374 -2.238
35 2HE MET 7 2HE MET 7 -8.634 -9.105 -0.648
36 3HE MET 7 3HE MET 7 -7.984 -7.745 -1.564
37 H ILE 8 H ILE 8 -8.028 -4.804 0.088
38 HA ILE 8 HA ILE 8 -9.170 -4.874 2.798
39 HB ILE 8 HB ILE 8 -7.329 -6.454 3.430
40 1HG1 ILE 8 2HG1 ILE 8 -7.033 -6.802 0.436
41 2HG1 ILE 8 1HG1 ILE 8 -5.867 -5.989 1.474
42 1HG2 ILE 8 1HG2 ILE 8 -9.515 -7.230 1.545
43 2HG2 ILE 8 2HG2 ILE 8 -9.397 -7.478 3.287
44 3HG2 ILE 8 3HG2 ILE 8 -8.416 -8.450 2.189
45 1HD1 ILE 8 1HD1 ILE 8 -4.906 -8.036 1.366
46 2HD1 ILE 8 2HD1 ILE 8 -6.445 -8.874 1.159
47 3HD1 ILE 8 3HD1 ILE 8 -5.960 -8.303 2.754
48 H SER 9 H SER 9 -8.094 -3.668 4.304
49 HA SER 9 HA SER 9 -6.259 -1.699 3.333
50 1HB SER 9 2HB SER 9 -8.008 -1.223 5.035
51 2HB SER 9 1HB SER 9 -7.144 -2.243 6.180
52 HG SER 9 HG SER 9 -5.332 -0.799 5.881
53 H PHE 10 H PHE 10 -5.052 -4.022 2.874
54 HA PHE 10 HA PHE 10 -2.640 -3.796 4.447
55 1HB PHE 10 2HB PHE 10 -3.850 -5.519 5.689
56 2HB PHE 10 1HB PHE 10 -4.124 -6.429 4.209
57 HD1 PHE 10 1HD PHE 10 -1.113 -4.813 5.720
58 HD2 PHE 10 2HD PHE 10 -2.908 -8.369 4.222
59 HE1 PHE 10 1HE PHE 10 0.999 -6.025 6.078
60 HE2 PHE 10 2HE PHE 10 -0.801 -9.588 4.579
61 HZ PHE 10 HZ PHE 10 1.155 -8.415 5.507
62 H CYS 11 H CYS 11 -1.163 -3.548 2.960
63 HA CYS 11 HA CYS 11 -1.583 -4.605 0.277
64 1HB CYS 11 2HB CYS 11 0.688 -2.870 1.253
65 2HB CYS 11 1HB CYS 11 0.174 -3.125 -0.406
66 H PHE 12 H PHE 12 -0.070 -5.962 -0.802
67 HA PHE 12 HA PHE 12 1.253 -7.782 0.973
68 1HB PHE 12 2HB PHE 12 2.048 -8.950 -1.051
69 2HB PHE 12 1HB PHE 12 0.315 -8.685 -1.069
70 HD1 PHE 12 1HD PHE 12 3.467 -7.125 -2.344
71 HD2 PHE 12 2HD PHE 12 -0.659 -7.935 -2.996
72 HE1 PHE 12 1HE PHE 12 3.643 -6.180 -4.608
73 HE2 PHE 12 2HE PHE 12 -0.491 -6.986 -5.258
74 HZ PHE 12 HZ PHE 12 1.662 -6.107 -6.067
75 H THR 13 H THR 13 2.173 -5.029 -0.943
76 HA THR 13 HA THR 13 5.003 -5.433 -0.496
77 HB THR 13 HB THR 13 4.207 -4.350 -2.573
78 HG1 THR 13 1HG THR 13 5.587 -2.254 -1.392
79 1HG2 THR 13 1HG2 THR 13 3.329 -2.105 -2.567
80 2HG2 THR 13 2HG2 THR 13 3.466 -2.015 -0.811
81 3HG2 THR 13 3HG2 THR 13 2.309 -3.121 -1.550
82 H GLU 14 H GLU 14 2.518 -4.455 1.415
83 HA GLU 14 HA GLU 14 3.547 -2.190 2.749
84 1HB GLU 14 2HB GLU 14 1.197 -2.949 2.906
85 2HB GLU 14 1HB GLU 14 1.724 -4.343 3.833
86 1HG GLU 14 2HG GLU 14 2.180 -3.087 5.705
87 2HG GLU 14 1HG GLU 14 2.367 -1.593 4.786
88 H VAL 15 H VAL 15 3.906 -5.648 3.302
89 HA VAL 15 HA VAL 15 5.324 -5.535 5.726
90 HB VAL 15 HB VAL 15 5.643 -7.619 3.555
91 1HG1 VAL 15 1HG1 VAL 15 7.312 -7.772 5.323
92 2HG1 VAL 15 2HG1 VAL 15 6.185 -9.125 5.406
93 3HG1 VAL 15 3HG1 VAL 15 6.037 -7.783 6.541
94 1HG2 VAL 15 1HG2 VAL 15 3.435 -7.925 3.830
95 2HG2 VAL 15 2HG2 VAL 15 3.394 -7.010 5.337
96 3HG2 VAL 15 3HG2 VAL 15 3.904 -8.698 5.344
97 H ILE 16 H ILE 16 6.306 -5.121 2.409
98 HA ILE 16 HA ILE 16 9.102 -5.355 2.817
99 HB ILE 16 HB ILE 16 7.666 -3.918 0.587
100 1HG1 ILE 16 2HG1 ILE 16 8.605 -6.793 0.723
101 2HG1 ILE 16 1HG1 ILE 16 6.929 -6.273 0.858
102 1HG2 ILE 16 1HG2 ILE 16 9.654 -4.095 -0.671
103 2HG2 ILE 16 2HG2 ILE 16 10.386 -5.197 0.493
104 3HG2 ILE 16 3HG2 ILE 16 10.147 -3.501 0.914
105 1HD1 ILE 16 1HD1 ILE 16 8.611 -5.671 -1.551
106 2HD1 ILE 16 2HD1 ILE 16 6.857 -5.589 -1.388
107 3HD1 ILE 16 3HD1 ILE 16 7.673 -7.155 -1.387
108 H GLY 17 H GLY 17 6.843 -2.737 3.025
109 1HA GLY 17 2HA GLY 17 8.182 -1.107 4.714
110 2HA GLY 17 1HA GLY 17 8.892 -0.699 3.160
111 H CYS 18 H CYS 18 6.150 -1.378 1.971
112 HA CYS 18 HA CYS 18 5.200 1.290 1.866
113 1HB CYS 18 2HB CYS 18 3.973 -1.301 0.925
114 2HB CYS 18 1HB CYS 18 3.306 0.288 0.573
115 H SER 19 H SER 19 2.829 1.782 2.211
116 HA SER 19 HA SER 19 1.575 0.396 4.426
117 1HB SER 19 2HB SER 19 2.204 3.352 4.634
118 2HB SER 19 1HB SER 19 1.418 2.346 5.849
119 HG SER 19 HG SER 19 3.642 1.127 5.422
120 H CYS 20 H CYS 20 -0.575 0.390 4.162
121 HA CYS 20 HA CYS 20 -1.799 1.413 1.866
122 1HB CYS 20 2HB CYS 20 -2.765 -0.452 3.064
123 2HB CYS 20 1HB CYS 20 -3.002 0.537 4.500
124 H LYS 21 H LYS 21 -2.847 3.278 1.380
125 HA LYS 21 HA LYS 21 -3.535 5.155 3.484
126 1HB LYS 21 2HB LYS 21 -1.077 5.471 2.713
127 2HB LYS 21 1HB LYS 21 -1.785 6.138 1.251
128 1HG LYS 21 2HG LYS 21 -2.846 7.889 2.480
129 2HG LYS 21 1HG LYS 21 -2.374 7.159 4.017
130 1HD LYS 21 2HD LYS 21 -0.549 8.352 1.931
131 2HD LYS 21 1HD LYS 21 -0.893 8.998 3.536
132 1HE LYS 21 2HE LYS 21 0.562 6.437 2.880
133 2HE LYS 21 1HE LYS 21 1.260 7.907 3.558
134 1HZ LYS 21 1HZ LYS 21 -0.574 7.422 5.382
135 2HZ LYS 21 2HZ LYS 21 0.968 6.735 5.457
136 3HZ LYS 21 3HZ LYS 21 -0.330 5.832 4.857
137 H ASN 22 H ASN 22 -5.517 5.730 3.012
138 HA ASN 22 HA ASN 22 -7.458 6.072 1.914
139 1HB ASN 22 2HB ASN 22 -7.464 7.914 0.336
140 2HB ASN 22 1HB ASN 22 -6.380 8.261 1.670
141 1HD2 ASN 22 1HD2 ASN 22 -4.511 9.118 1.135
142 2HD2 ASN 22 2HD2 ASN 22 -3.727 8.988 -0.397
143 H LYS 23 H LYS 23 -6.418 3.631 1.185
144 HA LYS 23 HA LYS 23 -7.125 1.960 -0.188
145 1HB LYS 23 2HB LYS 23 -9.055 2.930 -1.012
146 2HB LYS 23 1HB LYS 23 -8.201 4.261 -1.770
147 1HG LYS 23 2HG LYS 23 -7.817 1.514 -2.843
148 2HG LYS 23 1HG LYS 23 -9.331 2.354 -3.171
149 1HD LYS 23 2HD LYS 23 -6.575 3.421 -3.803
150 2HD LYS 23 1HD LYS 23 -7.655 2.654 -4.965
151 1HE LYS 23 2HE LYS 23 -8.236 4.796 -5.396
152 2HE LYS 23 1HE LYS 23 -9.301 4.548 -4.015
153 1HZ LYS 23 1HZ LYS 23 -8.086 6.616 -3.806
154 2HZ LYS 23 2HZ LYS 23 -6.609 5.807 -3.931
155 3HZ LYS 23 3HZ LYS 23 -7.602 5.547 -2.585
156 H VAL 24 H VAL 24 -4.786 4.315 -1.011
157 HA VAL 24 HA VAL 24 -3.649 2.440 -2.989
158 HB VAL 24 HB VAL 24 -2.868 5.339 -2.652
159 1HG1 VAL 24 1HG1 VAL 24 -1.147 4.744 -3.929
160 2HG1 VAL 24 2HG1 VAL 24 -2.300 4.448 -5.230
161 3HG1 VAL 24 3HG1 VAL 24 -1.808 3.127 -4.171
162 1HG2 VAL 24 1HG2 VAL 24 -4.742 5.898 -3.708
163 2HG2 VAL 24 2HG2 VAL 24 -5.184 4.204 -3.932
164 3HG2 VAL 24 3HG2 VAL 24 -4.149 5.008 -5.112
165 H CYS 25 H CYS 25 -1.684 1.553 -2.644
166 HA CYS 25 HA CYS 25 -0.561 1.795 0.005
167 1HB CYS 25 2HB CYS 25 0.454 0.179 -2.336
168 2HB CYS 25 1HB CYS 25 0.832 -0.069 -0.634
169 H TYR 26 H TYR 26 1.083 3.079 0.588
170 HA TYR 26 HA TYR 26 2.944 4.022 -1.495
171 1HB TYR 26 2HB TYR 26 1.801 5.707 0.735
172 2HB TYR 26 1HB TYR 26 3.075 6.212 -0.356
173 HD1 TYR 26 1HD TYR 26 -0.504 5.745 0.065
174 HD2 TYR 26 2HD TYR 26 2.571 6.712 -2.709
175 HE1 TYR 26 1HE TYR 26 -2.185 6.690 -1.460
176 HE2 TYR 26 2HE TYR 26 0.899 7.655 -4.245
177 HH TYR 26 HH TYR 26 -1.397 8.632 -4.088
178 H LEU 27 H LEU 27 5.045 4.173 -0.913
179 HA LEU 27 HA LEU 27 5.758 3.302 1.795
180 1HB LEU 27 2HB LEU 27 7.830 2.433 0.925
181 2HB LEU 27 1HB LEU 27 6.517 1.766 -0.018
182 HG LEU 27 HG LEU 27 7.293 3.993 -1.482
183 1HD1 LEU 27 1HD1 LEU 27 9.538 3.008 0.116
184 2HD1 LEU 27 2HD1 LEU 27 9.347 4.526 -0.763
185 3HD1 LEU 27 3HD1 LEU 27 9.854 3.068 -1.617
186 1HD2 LEU 27 1HD2 LEU 27 8.313 2.288 -2.998
187 2HD2 LEU 27 2HD2 LEU 27 6.666 1.920 -2.486
188 3HD2 LEU 27 3HD2 LEU 27 8.030 1.085 -1.742
189 H ASN 28 H ASN 28 5.973 5.119 2.878
190 HA ASN 28 HA ASN 28 6.673 7.184 3.540
191 1HB ASN 28 2HB ASN 28 8.930 6.110 3.144
192 2HB ASN 28 1HB ASN 28 8.927 6.847 1.545
193 1HD2 ASN 28 1HD2 ASN 28 10.112 8.602 1.462
194 2HD2 ASN 28 2HD2 ASN 28 10.315 9.762 2.724
195 H SER 29 H SER 29 4.682 7.090 1.738
196 HA SER 29 HA SER 29 3.383 8.475 0.519
197 1HB SER 29 2HB SER 29 5.750 10.353 0.461
198 2HB SER 29 1HB SER 29 4.101 10.750 -0.026
199 HG SER 29 HG SER 29 5.120 10.937 2.372
200 H ILE 30 H ILE 30 6.039 6.899 -0.615
201 HA ILE 30 HA ILE 30 5.820 7.823 -3.372
202 HB ILE 30 HB ILE 30 7.505 5.592 -2.211
203 1HG1 ILE 30 2HG1 ILE 30 8.289 8.403 -3.018
204 2HG1 ILE 30 1HG1 ILE 30 8.087 7.850 -1.359
205 1HG2 ILE 30 1HG2 ILE 30 7.813 6.936 -4.887
206 2HG2 ILE 30 2HG2 ILE 30 6.929 5.426 -4.656
207 3HG2 ILE 30 3HG2 ILE 30 8.653 5.505 -4.288
208 1HD1 ILE 30 1HD1 ILE 30 10.446 7.976 -2.199
209 2HD1 ILE 30 2HD1 ILE 30 10.058 6.624 -3.263
210 3HD1 ILE 30 3HD1 ILE 30 9.965 6.424 -1.514
211 H SER 31 H SER 31 4.671 6.802 -4.932
212 HA SER 31 HA SER 31 2.667 4.958 -4.281
213 1HB SER 31 2HB SER 31 3.802 5.517 -7.026
214 2HB SER 31 1HB SER 31 2.189 4.913 -6.645
215 HG SER 31 HG SER 31 2.304 7.067 -5.284
Start of MODEL 5
1 1H CYS 1 H CYS 1 2.733 2.894 -3.795
2 HA CYS 1 HA CYS 1 5.109 1.365 -4.483
3 1HB CYS 1 2HB CYS 1 2.723 0.784 -2.728
4 2HB CYS 1 1HB CYS 1 4.015 -0.376 -3.006
5 H GLY 2 H GLY 2 2.354 2.028 -6.078
6 1HA GLY 2 2HA GLY 2 1.243 1.013 -7.834
7 2HA GLY 2 1HA GLY 2 2.637 -0.053 -7.965
8 H GLU 3 H GLU 3 0.560 0.350 -5.211
9 HA GLU 3 HA GLU 3 -0.718 -2.244 -5.591
10 1HB GLU 3 2HB GLU 3 1.169 -2.858 -4.275
11 2HB GLU 3 1HB GLU 3 1.058 -1.405 -3.299
12 1HG GLU 3 2HG GLU 3 0.376 -3.179 -1.931
13 2HG GLU 3 1HG GLU 3 -1.090 -2.315 -2.379
14 H SER 4 H SER 4 -2.741 -2.365 -4.434
15 HA SER 4 HA SER 4 -3.534 0.146 -3.134
16 1HB SER 4 2HB SER 4 -5.727 0.025 -4.362
17 2HB SER 4 1HB SER 4 -4.332 0.409 -5.371
18 HG SER 4 HG SER 4 -4.621 -2.242 -5.284
19 H CYS 5 H CYS 5 -4.675 -0.059 -1.372
20 HA CYS 5 HA CYS 5 -5.544 -2.728 -0.541
21 1HB CYS 5 2HB CYS 5 -5.875 -1.457 1.697
22 2HB CYS 5 1HB CYS 5 -4.233 -1.789 1.163
23 H ALA 6 H ALA 6 -6.973 -1.382 -2.531
24 HA ALA 6 HA ALA 6 -9.209 0.053 -1.644
25 1HB ALA 6 1HB ALA 6 -8.541 -1.454 -4.122
26 2HB ALA 6 2HB ALA 6 -8.862 0.267 -3.901
27 3HB ALA 6 3HB ALA 6 -10.194 -0.891 -3.875
28 H MET 7 H MET 7 -8.708 -3.379 -2.084
29 HA MET 7 HA MET 7 -11.453 -4.002 -1.361
30 1HB MET 7 2HB MET 7 -10.177 -5.278 -3.114
31 2HB MET 7 1HB MET 7 -9.160 -5.905 -1.832
32 1HG MET 7 2HG MET 7 -11.119 -6.930 -0.781
33 2HG MET 7 1HG MET 7 -12.127 -6.326 -2.095
34 1HE MET 7 1HE MET 7 -9.054 -8.193 -1.140
35 2HE MET 7 2HE MET 7 -8.382 -8.169 -2.770
36 3HE MET 7 3HE MET 7 -9.056 -9.661 -2.117
37 H ILE 8 H ILE 8 -8.268 -4.965 -0.219
38 HA ILE 8 HA ILE 8 -9.372 -5.187 2.502
39 HB ILE 8 HB ILE 8 -7.500 -6.784 2.965
40 1HG1 ILE 8 2HG1 ILE 8 -7.191 -6.795 -0.048
41 2HG1 ILE 8 1HG1 ILE 8 -6.043 -6.082 1.078
42 1HG2 ILE 8 1HG2 ILE 8 -9.920 -7.348 2.196
43 2HG2 ILE 8 2HG2 ILE 8 -8.707 -8.625 2.286
44 3HG2 ILE 8 3HG2 ILE 8 -9.123 -7.911 0.727
45 1HD1 ILE 8 1HD1 ILE 8 -5.440 -8.345 0.201
46 2HD1 ILE 8 2HD1 ILE 8 -6.800 -8.988 1.120
47 3HD1 ILE 8 3HD1 ILE 8 -5.463 -8.202 1.957
48 H SER 9 H SER 9 -8.308 -4.150 4.137
49 HA SER 9 HA SER 9 -6.512 -2.046 3.397
50 1HB SER 9 2HB SER 9 -8.275 -1.782 5.129
51 2HB SER 9 1HB SER 9 -7.407 -2.918 6.158
52 HG SER 9 HG SER 9 -5.598 -1.415 5.988
53 H PHE 10 H PHE 10 -5.254 -4.244 2.668
54 HA PHE 10 HA PHE 10 -2.878 -4.216 4.311
55 1HB PHE 10 2HB PHE 10 -4.110 -6.103 5.276
56 2HB PHE 10 1HB PHE 10 -4.309 -6.811 3.678
57 HD1 PHE 10 1HD PHE 10 -1.400 -5.368 5.526
58 HD2 PHE 10 2HD PHE 10 -3.040 -8.707 3.458
59 HE1 PHE 10 1HE PHE 10 0.726 -6.576 5.798
60 HE2 PHE 10 2HE PHE 10 -0.918 -9.922 3.729
61 HZ PHE 10 HZ PHE 10 0.969 -8.856 4.899
62 H CYS 11 H CYS 11 -1.297 -3.865 2.965
63 HA CYS 11 HA CYS 11 -1.618 -4.534 0.129
64 1HB CYS 11 2HB CYS 11 0.625 -2.986 1.420
65 2HB CYS 11 1HB CYS 11 0.168 -2.994 -0.275
66 H PHE 12 H PHE 12 -0.246 -5.927 -0.964
67 HA PHE 12 HA PHE 12 1.056 -7.939 0.554
68 1HB PHE 12 2HB PHE 12 0.166 -8.305 -1.735
69 2HB PHE 12 1HB PHE 12 1.415 -7.243 -2.375
70 HD1 PHE 12 1HD PHE 12 2.944 -8.464 -3.568
71 HD2 PHE 12 2HD PHE 12 1.470 -10.040 0.101
72 HE1 PHE 12 1HE PHE 12 4.465 -10.385 -3.787
73 HE2 PHE 12 2HE PHE 12 2.990 -11.962 -0.111
74 HZ PHE 12 HZ PHE 12 4.490 -12.137 -2.056
75 H THR 13 H THR 13 2.125 -5.019 -1.048
76 HA THR 13 HA THR 13 4.910 -5.518 -0.501
77 HB THR 13 HB THR 13 4.248 -4.394 -2.576
78 HG1 THR 13 1HG THR 13 5.588 -2.334 -1.263
79 1HG2 THR 13 1HG2 THR 13 2.676 -2.802 -0.792
80 2HG2 THR 13 2HG2 THR 13 2.657 -2.845 -2.555
81 3HG2 THR 13 3HG2 THR 13 3.760 -1.758 -1.711
82 H GLU 14 H GLU 14 2.469 -4.552 1.488
83 HA GLU 14 HA GLU 14 3.570 -2.292 2.787
84 1HB GLU 14 2HB GLU 14 1.465 -4.256 3.409
85 2HB GLU 14 1HB GLU 14 2.217 -3.488 4.806
86 1HG GLU 14 2HG GLU 14 1.795 -1.305 3.739
87 2HG GLU 14 1HG GLU 14 0.885 -2.138 2.488
88 H VAL 15 H VAL 15 3.818 -5.711 3.455
89 HA VAL 15 HA VAL 15 5.353 -5.622 5.774
90 HB VAL 15 HB VAL 15 4.294 -7.675 4.913
91 1HG1 VAL 15 1HG1 VAL 15 4.648 -7.705 2.617
92 2HG1 VAL 15 2HG1 VAL 15 5.700 -8.991 3.211
93 3HG1 VAL 15 3HG1 VAL 15 6.381 -7.421 2.781
94 1HG2 VAL 15 1HG2 VAL 15 7.129 -7.577 5.758
95 2HG2 VAL 15 2HG2 VAL 15 6.516 -9.126 5.178
96 3HG2 VAL 15 3HG2 VAL 15 5.735 -8.323 6.540
97 H ILE 16 H ILE 16 6.269 -5.060 2.483
98 HA ILE 16 HA ILE 16 9.080 -5.391 2.841
99 HB ILE 16 HB ILE 16 7.619 -3.904 0.658
100 1HG1 ILE 16 2HG1 ILE 16 6.868 -6.229 0.790
101 2HG1 ILE 16 1HG1 ILE 16 7.844 -5.977 -0.653
102 1HG2 ILE 16 1HG2 ILE 16 9.564 -3.637 -0.440
103 2HG2 ILE 16 2HG2 ILE 16 10.201 -5.193 0.093
104 3HG2 ILE 16 3HG2 ILE 16 10.270 -3.797 1.169
105 1HD1 ILE 16 1HD1 ILE 16 9.778 -6.955 0.564
106 2HD1 ILE 16 2HD1 ILE 16 8.436 -8.073 0.319
107 3HD1 ILE 16 3HD1 ILE 16 8.686 -7.328 1.899
108 H GLY 17 H GLY 17 6.828 -2.795 3.180
109 1HA GLY 17 2HA GLY 17 8.150 -1.195 4.886
110 2HA GLY 17 1HA GLY 17 8.882 -0.751 3.351
111 H CYS 18 H CYS 18 6.200 -1.372 2.066
112 HA CYS 18 HA CYS 18 5.231 1.283 1.999
113 1HB CYS 18 2HB CYS 18 3.989 -1.287 1.013
114 2HB CYS 18 1HB CYS 18 3.396 0.323 0.627
115 H SER 19 H SER 19 2.843 1.774 2.297
116 HA SER 19 HA SER 19 1.581 0.349 4.491
117 1HB SER 19 2HB SER 19 1.261 2.459 5.790
118 2HB SER 19 1HB SER 19 2.951 1.963 5.689
119 HG SER 19 HG SER 19 3.085 3.456 3.854
120 H CYS 20 H CYS 20 -0.586 0.349 4.314
121 HA CYS 20 HA CYS 20 -1.841 1.308 1.981
122 1HB CYS 20 2HB CYS 20 -2.805 -0.552 3.167
123 2HB CYS 20 1HB CYS 20 -2.975 0.397 4.638
124 H LYS 21 H LYS 21 -2.897 3.201 1.507
125 HA LYS 21 HA LYS 21 -3.500 5.058 3.659
126 1HB LYS 21 2HB LYS 21 -1.035 5.227 2.646
127 2HB LYS 21 1HB LYS 21 -1.878 6.166 1.423
128 1HG LYS 21 2HG LYS 21 -2.504 7.811 2.947
129 2HG LYS 21 1HG LYS 21 -2.195 6.768 4.339
130 1HD LYS 21 2HD LYS 21 -0.225 8.167 2.556
131 2HD LYS 21 1HD LYS 21 -0.376 8.244 4.312
132 1HE LYS 21 2HE LYS 21 0.634 5.929 2.663
133 2HE LYS 21 1HE LYS 21 1.567 6.938 3.763
134 1HZ LYS 21 1HZ LYS 21 -0.602 5.052 4.529
135 2HZ LYS 21 2HZ LYS 21 0.234 6.057 5.603
136 3HZ LYS 21 3HZ LYS 21 1.058 4.825 4.782
137 H ASN 22 H ASN 22 -5.495 5.650 3.230
138 HA ASN 22 HA ASN 22 -7.448 5.961 2.127
139 1HB ASN 22 2HB ASN 22 -7.373 7.818 0.421
140 2HB ASN 22 1HB ASN 22 -6.709 8.202 1.998
141 1HD2 ASN 22 1HD2 ASN 22 -6.153 8.086 -1.342
142 2HD2 ASN 22 2HD2 ASN 22 -4.495 8.567 -1.322
143 H LYS 23 H LYS 23 -6.598 3.602 1.383
144 HA LYS 23 HA LYS 23 -7.206 1.975 -0.074
145 1HB LYS 23 2HB LYS 23 -9.072 3.046 -0.937
146 2HB LYS 23 1HB LYS 23 -8.129 4.333 -1.675
147 1HG LYS 23 2HG LYS 23 -7.311 2.712 -3.348
148 2HG LYS 23 1HG LYS 23 -8.349 1.484 -2.623
149 1HD LYS 23 2HD LYS 23 -9.431 2.453 -4.568
150 2HD LYS 23 1HD LYS 23 -10.313 2.885 -3.102
151 1HE LYS 23 2HE LYS 23 -9.220 5.076 -3.094
152 2HE LYS 23 1HE LYS 23 -8.334 4.642 -4.554
153 1HZ LYS 23 1HZ LYS 23 -10.466 4.414 -5.707
154 2HZ LYS 23 2HZ LYS 23 -10.244 5.979 -5.103
155 3HZ LYS 23 3HZ LYS 23 -11.282 4.906 -4.308
156 H VAL 24 H VAL 24 -4.841 4.358 -0.873
157 HA VAL 24 HA VAL 24 -3.663 2.453 -2.795
158 HB VAL 24 HB VAL 24 -2.926 5.369 -2.535
159 1HG1 VAL 24 1HG1 VAL 24 -1.536 5.082 -4.307
160 2HG1 VAL 24 2HG1 VAL 24 -2.527 3.809 -5.023
161 3HG1 VAL 24 3HG1 VAL 24 -1.469 3.443 -3.659
162 1HG2 VAL 24 1HG2 VAL 24 -5.364 4.530 -3.389
163 2HG2 VAL 24 2HG2 VAL 24 -4.451 4.522 -4.898
164 3HG2 VAL 24 3HG2 VAL 24 -4.562 6.001 -3.943
165 H CYS 25 H CYS 25 -1.698 1.591 -2.407
166 HA CYS 25 HA CYS 25 -0.583 1.986 0.231
167 1HB CYS 25 2HB CYS 25 0.423 0.203 -1.987
168 2HB CYS 25 1HB CYS 25 0.750 0.049 -0.261
169 H TYR 26 H TYR 26 1.016 3.314 0.727
170 HA TYR 26 HA TYR 26 2.855 4.186 -1.407
171 1HB TYR 26 2HB TYR 26 1.661 5.871 0.799
172 2HB TYR 26 1HB TYR 26 2.997 6.390 -0.215
173 HD1 TYR 26 1HD TYR 26 -0.594 5.914 0.007
174 HD2 TYR 26 2HD TYR 26 2.625 6.845 -2.611
175 HE1 TYR 26 1HE TYR 26 -2.192 6.819 -1.628
176 HE2 TYR 26 2HE TYR 26 1.038 7.750 -4.254
177 HH TYR 26 HH TYR 26 -2.459 7.644 -3.677
178 H LEU 27 H LEU 27 4.948 4.633 -0.837
179 HA LEU 27 HA LEU 27 5.831 3.855 1.861
180 1HB LEU 27 2HB LEU 27 6.295 2.174 -0.084
181 2HB LEU 27 1HB LEU 27 7.474 3.352 -0.615
182 HG LEU 27 HG LEU 27 7.519 2.030 2.103
183 1HD1 LEU 27 1HD1 LEU 27 9.577 1.353 0.122
184 2HD1 LEU 27 2HD1 LEU 27 7.963 0.742 -0.239
185 3HD1 LEU 27 3HD1 LEU 27 8.738 0.330 1.289
186 1HD2 LEU 27 1HD2 LEU 27 8.826 4.312 1.185
187 2HD2 LEU 27 2HD2 LEU 27 10.027 3.026 1.071
188 3HD2 LEU 27 3HD2 LEU 27 9.233 3.357 2.610
189 H ASN 28 H ASN 28 6.322 5.797 2.671
190 HA ASN 28 HA ASN 28 7.238 7.858 2.958
191 1HB ASN 28 2HB ASN 28 9.340 6.539 2.449
192 2HB ASN 28 1HB ASN 28 9.198 7.085 0.781
193 1HD2 ASN 28 1HD2 ASN 28 10.486 8.714 0.348
194 2HD2 ASN 28 2HD2 ASN 28 10.931 9.984 1.429
195 H SER 29 H SER 29 5.037 7.739 1.419
196 HA SER 29 HA SER 29 3.714 9.039 0.134
197 1HB SER 29 2HB SER 29 6.161 10.756 -0.323
198 2HB SER 29 1HB SER 29 4.490 11.207 -0.667
199 HG SER 29 HG SER 29 5.810 11.470 1.608
200 H ILE 30 H ILE 30 6.228 7.241 -1.016
201 HA ILE 30 HA ILE 30 5.835 7.883 -3.827
202 HB ILE 30 HB ILE 30 7.535 5.717 -2.573
203 1HG1 ILE 30 2HG1 ILE 30 8.355 8.427 -3.645
204 2HG1 ILE 30 1HG1 ILE 30 8.209 8.027 -1.937
205 1HG2 ILE 30 1HG2 ILE 30 8.694 5.787 -4.803
206 2HG2 ILE 30 2HG2 ILE 30 7.353 6.772 -5.389
207 3HG2 ILE 30 3HG2 ILE 30 7.059 5.127 -4.829
208 1HD1 ILE 30 1HD1 ILE 30 10.401 7.599 -3.736
209 2HD1 ILE 30 2HD1 ILE 30 9.885 6.075 -3.013
210 3HD1 ILE 30 3HD1 ILE 30 10.338 7.433 -1.981
211 H SER 31 H SER 31 4.641 6.702 -5.231
212 HA SER 31 HA SER 31 2.634 4.960 -4.290
213 1HB SER 31 2HB SER 31 2.282 4.551 -6.773
214 2HB SER 31 1HB SER 31 2.203 6.238 -6.259
215 HG SER 31 HG SER 31 4.608 5.075 -7.188
Start of MODEL 6
1 1H CYS 1 H CYS 1 2.673 2.861 -3.691
2 HA CYS 1 HA CYS 1 5.022 1.370 -4.539
3 1HB CYS 1 2HB CYS 1 2.695 0.651 -2.748
4 2HB CYS 1 1HB CYS 1 4.043 -0.425 -3.084
5 H GLY 2 H GLY 2 2.144 2.130 -5.867
6 1HA GLY 2 2HA GLY 2 1.014 1.325 -7.700
7 2HA GLY 2 1HA GLY 2 2.340 0.195 -7.929
8 H GLU 3 H GLU 3 0.478 0.313 -4.985
9 HA GLU 3 HA GLU 3 -1.011 -2.073 -5.793
10 1HB GLU 3 2HB GLU 3 1.026 -2.708 -4.461
11 2HB GLU 3 1HB GLU 3 0.360 -1.816 -3.111
12 1HG GLU 3 2HG GLU 3 -1.367 -3.334 -2.799
13 2HG GLU 3 1HG GLU 3 -1.210 -3.995 -4.425
14 H SER 4 H SER 4 -3.052 -2.140 -5.036
15 HA SER 4 HA SER 4 -3.911 0.206 -3.488
16 1HB SER 4 2HB SER 4 -6.144 -0.193 -4.590
17 2HB SER 4 1HB SER 4 -4.840 0.271 -5.687
18 HG SER 4 HG SER 4 -5.332 -2.453 -5.209
19 H CYS 5 H CYS 5 -4.784 -0.054 -1.585
20 HA CYS 5 HA CYS 5 -5.524 -2.739 -0.675
21 1HB CYS 5 2HB CYS 5 -5.543 -1.567 1.598
22 2HB CYS 5 1HB CYS 5 -3.975 -1.725 0.814
23 H ALA 6 H ALA 6 -7.172 -1.359 -2.483
24 HA ALA 6 HA ALA 6 -9.286 0.072 -1.337
25 1HB ALA 6 1HB ALA 6 -10.017 -1.549 -3.653
26 2HB ALA 6 2HB ALA 6 -8.548 -0.599 -3.873
27 3HB ALA 6 3HB ALA 6 -10.057 0.200 -3.432
28 H MET 7 H MET 7 -8.851 -3.359 -1.841
29 HA MET 7 HA MET 7 -11.514 -3.980 -0.865
30 1HB MET 7 2HB MET 7 -10.346 -5.253 -2.721
31 2HB MET 7 1HB MET 7 -9.282 -5.908 -1.494
32 1HG MET 7 2HG MET 7 -11.005 -7.499 -1.974
33 2HG MET 7 1HG MET 7 -11.230 -6.869 -0.342
34 1HE MET 7 1HE MET 7 -13.627 -8.442 -1.948
35 2HE MET 7 2HE MET 7 -14.922 -7.423 -1.318
36 3HE MET 7 3HE MET 7 -13.573 -7.878 -0.278
37 H ILE 8 H ILE 8 -8.212 -4.811 0.006
38 HA ILE 8 HA ILE 8 -9.057 -4.999 2.817
39 HB ILE 8 HB ILE 8 -7.241 -6.697 3.133
40 1HG1 ILE 8 2HG1 ILE 8 -7.291 -6.828 0.107
41 2HG1 ILE 8 1HG1 ILE 8 -5.975 -6.157 1.065
42 1HG2 ILE 8 1HG2 ILE 8 -9.706 -7.171 1.541
43 2HG2 ILE 8 2HG2 ILE 8 -9.293 -7.696 3.173
44 3HG2 ILE 8 3HG2 ILE 8 -8.587 -8.513 1.779
45 1HD1 ILE 8 1HD1 ILE 8 -5.821 -8.448 2.156
46 2HD1 ILE 8 2HD1 ILE 8 -5.280 -8.309 0.483
47 3HD1 ILE 8 3HD1 ILE 8 -6.858 -9.011 0.845
48 H SER 9 H SER 9 -7.836 -3.925 4.268
49 HA SER 9 HA SER 9 -5.920 -2.028 3.292
50 1HB SER 9 2HB SER 9 -7.547 -1.480 5.076
51 2HB SER 9 1HB SER 9 -6.765 -2.647 6.137
52 HG SER 9 HG SER 9 -4.809 -1.353 5.800
53 H PHE 10 H PHE 10 -4.896 -4.390 2.661
54 HA PHE 10 HA PHE 10 -2.454 -4.472 4.204
55 1HB PHE 10 2HB PHE 10 -3.842 -6.111 5.359
56 2HB PHE 10 1HB PHE 10 -4.161 -6.945 3.844
57 HD1 PHE 10 1HD PHE 10 -1.084 -5.665 5.536
58 HD2 PHE 10 2HD PHE 10 -3.098 -8.966 3.759
59 HE1 PHE 10 1HE PHE 10 0.896 -7.071 5.915
60 HE2 PHE 10 2HE PHE 10 -1.119 -10.379 4.135
61 HZ PHE 10 HZ PHE 10 0.881 -9.432 5.215
62 H CYS 11 H CYS 11 -1.135 -4.024 2.619
63 HA CYS 11 HA CYS 11 -1.503 -5.273 -0.010
64 1HB CYS 11 2HB CYS 11 0.266 -3.016 0.915
65 2HB CYS 11 1HB CYS 11 0.336 -3.694 -0.702
66 H PHE 12 H PHE 12 0.286 -6.273 -1.113
67 HA PHE 12 HA PHE 12 1.768 -8.033 0.575
68 1HB PHE 12 2HB PHE 12 1.864 -7.502 -2.401
69 2HB PHE 12 1HB PHE 12 2.887 -8.694 -1.611
70 HD1 PHE 12 1HD PHE 12 2.188 -10.835 -1.954
71 HD2 PHE 12 2HD PHE 12 -0.746 -7.792 -1.456
72 HE1 PHE 12 1HE PHE 12 0.409 -12.519 -2.180
73 HE2 PHE 12 2HE PHE 12 -2.529 -9.472 -1.678
74 HZ PHE 12 HZ PHE 12 -1.953 -11.838 -2.040
75 H THR 13 H THR 13 2.564 -5.190 -1.387
76 HA THR 13 HA THR 13 5.350 -5.275 -0.694
77 HB THR 13 HB THR 13 4.595 -4.268 -2.817
78 HG1 THR 13 1HG THR 13 5.722 -2.121 -1.392
79 1HG2 THR 13 1HG2 THR 13 3.721 -1.798 -1.407
80 2HG2 THR 13 2HG2 THR 13 2.582 -3.139 -1.529
81 3HG2 THR 13 3HG2 THR 13 3.257 -2.420 -2.991
82 H GLU 14 H GLU 14 2.607 -4.332 0.930
83 HA GLU 14 HA GLU 14 3.608 -2.116 2.412
84 1HB GLU 14 2HB GLU 14 1.254 -2.383 2.214
85 2HB GLU 14 1HB GLU 14 1.315 -4.025 2.832
86 1HG GLU 14 2HG GLU 14 1.706 -3.273 5.032
87 2HG GLU 14 1HG GLU 14 2.040 -1.628 4.486
88 H VAL 15 H VAL 15 3.595 -5.579 2.844
89 HA VAL 15 HA VAL 15 4.410 -5.754 5.505
90 HB VAL 15 HB VAL 15 5.247 -7.639 3.299
91 1HG1 VAL 15 1HG1 VAL 15 4.543 -8.972 5.688
92 2HG1 VAL 15 2HG1 VAL 15 5.620 -7.645 6.124
93 3HG1 VAL 15 3HG1 VAL 15 6.133 -8.842 4.935
94 1HG2 VAL 15 1HG2 VAL 15 3.166 -8.875 3.795
95 2HG2 VAL 15 2HG2 VAL 15 2.871 -7.281 3.100
96 3HG2 VAL 15 3HG2 VAL 15 2.652 -7.542 4.831
97 H ILE 16 H ILE 16 6.292 -5.155 2.580
98 HA ILE 16 HA ILE 16 8.772 -5.387 4.075
99 HB ILE 16 HB ILE 16 9.920 -5.040 1.937
100 1HG1 ILE 16 2HG1 ILE 16 7.138 -4.949 0.749
101 2HG1 ILE 16 1HG1 ILE 16 8.223 -3.571 0.888
102 1HG2 ILE 16 1HG2 ILE 16 8.068 -7.208 2.541
103 2HG2 ILE 16 2HG2 ILE 16 9.758 -7.264 2.038
104 3HG2 ILE 16 3HG2 ILE 16 8.484 -7.101 0.830
105 1HD1 ILE 16 1HD1 ILE 16 8.373 -4.322 -1.335
106 2HD1 ILE 16 2HD1 ILE 16 8.534 -6.006 -0.837
107 3HD1 ILE 16 3HD1 ILE 16 9.847 -4.868 -0.538
108 H GLY 17 H GLY 17 6.632 -2.900 3.849
109 1HA GLY 17 2HA GLY 17 8.070 -0.974 4.998
110 2HA GLY 17 1HA GLY 17 8.662 -0.854 3.353
111 H CYS 18 H CYS 18 6.071 -1.413 2.128
112 HA CYS 18 HA CYS 18 5.121 1.244 2.005
113 1HB CYS 18 2HB CYS 18 3.865 -1.318 1.016
114 2HB CYS 18 1HB CYS 18 3.296 0.294 0.607
115 H SER 19 H SER 19 2.732 1.777 2.263
116 HA SER 19 HA SER 19 1.438 0.438 4.491
117 1HB SER 19 2HB SER 19 1.148 2.732 5.620
118 2HB SER 19 1HB SER 19 2.729 1.961 5.760
119 HG SER 19 HG SER 19 2.997 3.305 3.625
120 H CYS 20 H CYS 20 -0.730 0.530 4.372
121 HA CYS 20 HA CYS 20 -1.945 1.493 1.994
122 1HB CYS 20 2HB CYS 20 -2.834 -0.453 3.120
123 2HB CYS 20 1HB CYS 20 -3.146 0.480 4.579
124 H LYS 21 H LYS 21 -2.797 3.400 1.518
125 HA LYS 21 HA LYS 21 -3.835 5.141 3.595
126 1HB LYS 21 2HB LYS 21 -1.425 5.704 3.459
127 2HB LYS 21 1HB LYS 21 -1.614 6.030 1.743
128 1HG LYS 21 2HG LYS 21 -3.295 7.792 2.379
129 2HG LYS 21 1HG LYS 21 -2.773 7.561 4.050
130 1HD LYS 21 2HD LYS 21 -0.528 8.206 3.499
131 2HD LYS 21 1HD LYS 21 -0.915 8.249 1.777
132 1HE LYS 21 2HE LYS 21 -2.543 10.063 2.245
133 2HE LYS 21 1HE LYS 21 -2.001 10.066 3.924
134 1HZ LYS 21 1HZ LYS 21 0.128 10.281 1.992
135 2HZ LYS 21 2HZ LYS 21 -0.151 11.179 3.398
136 3HZ LYS 21 3HZ LYS 21 -0.954 11.582 1.965
137 H ASN 22 H ASN 22 -5.634 6.091 2.854
138 HA ASN 22 HA ASN 22 -7.396 6.473 1.480
139 1HB ASN 22 2HB ASN 22 -6.925 8.038 -0.428
140 2HB ASN 22 1HB ASN 22 -6.346 8.572 1.139
141 1HD2 ASN 22 1HD2 ASN 22 -5.469 7.583 -2.052
142 2HD2 ASN 22 2HD2 ASN 22 -3.787 7.967 -1.946
143 H LYS 23 H LYS 23 -6.642 3.911 1.132
144 HA LYS 23 HA LYS 23 -7.188 2.146 -0.164
145 1HB LYS 23 2HB LYS 23 -9.053 3.135 -1.105
146 2HB LYS 23 1HB LYS 23 -8.123 4.364 -1.944
147 1HG LYS 23 2HG LYS 23 -7.821 1.531 -2.791
148 2HG LYS 23 1HG LYS 23 -9.306 2.382 -3.207
149 1HD LYS 23 2HD LYS 23 -6.557 3.451 -3.828
150 2HD LYS 23 1HD LYS 23 -7.476 2.446 -4.945
151 1HE LYS 23 2HE LYS 23 -7.901 4.650 -5.625
152 2HE LYS 23 1HE LYS 23 -9.335 4.171 -4.722
153 1HZ LYS 23 1HZ LYS 23 -7.707 6.378 -4.285
154 2HZ LYS 23 2HZ LYS 23 -7.462 5.346 -2.965
155 3HZ LYS 23 3HZ LYS 23 -9.024 5.868 -3.355
156 H VAL 24 H VAL 24 -4.701 4.294 -0.957
157 HA VAL 24 HA VAL 24 -3.555 2.285 -2.796
158 HB VAL 24 HB VAL 24 -2.802 5.211 -2.656
159 1HG1 VAL 24 1HG1 VAL 24 -1.462 2.995 -3.746
160 2HG1 VAL 24 2HG1 VAL 24 -1.075 4.702 -3.953
161 3HG1 VAL 24 3HG1 VAL 24 -2.132 3.891 -5.109
162 1HG2 VAL 24 1HG2 VAL 24 -5.158 4.487 -3.575
163 2HG2 VAL 24 2HG2 VAL 24 -4.217 4.038 -4.998
164 3HG2 VAL 24 3HG2 VAL 24 -4.190 5.701 -4.411
165 H CYS 25 H CYS 25 -1.614 1.384 -2.252
166 HA CYS 25 HA CYS 25 -0.595 2.064 0.375
167 1HB CYS 25 2HB CYS 25 -0.114 -0.194 -1.540
168 2HB CYS 25 1HB CYS 25 1.005 0.086 -0.208
169 H TYR 26 H TYR 26 1.013 3.380 0.760
170 HA TYR 26 HA TYR 26 2.879 4.029 -1.436
171 1HB TYR 26 2HB TYR 26 2.021 5.870 0.807
172 2HB TYR 26 1HB TYR 26 3.102 6.273 -0.516
173 HD1 TYR 26 1HD TYR 26 2.217 6.735 -2.746
174 HD2 TYR 26 2HD TYR 26 -0.369 5.792 0.494
175 HE1 TYR 26 1HE TYR 26 0.309 7.631 -4.015
176 HE2 TYR 26 2HE TYR 26 -2.285 6.673 -0.767
177 HH TYR 26 HH TYR 26 -1.862 8.123 -3.979
178 H LEU 27 H LEU 27 5.005 4.616 -0.823
179 HA LEU 27 HA LEU 27 5.881 3.763 1.847
180 1HB LEU 27 2HB LEU 27 6.336 2.118 -0.156
181 2HB LEU 27 1HB LEU 27 7.561 3.285 -0.602
182 HG LEU 27 HG LEU 27 7.471 1.869 2.067
183 1HD1 LEU 27 1HD1 LEU 27 9.626 1.190 0.228
184 2HD1 LEU 27 2HD1 LEU 27 8.031 0.708 -0.353
185 3HD1 LEU 27 3HD1 LEU 27 8.604 0.147 1.217
186 1HD2 LEU 27 1HD2 LEU 27 8.693 4.155 1.697
187 2HD2 LEU 27 2HD2 LEU 27 9.890 3.149 0.879
188 3HD2 LEU 27 3HD2 LEU 27 9.491 2.847 2.570
189 H ASN 28 H ASN 28 6.430 5.667 2.694
190 HA ASN 28 HA ASN 28 7.370 7.715 3.005
191 1HB ASN 28 2HB ASN 28 9.452 6.396 2.415
192 2HB ASN 28 1HB ASN 28 9.268 6.979 0.763
193 1HD2 ASN 28 1HD2 ASN 28 10.559 8.605 0.329
194 2HD2 ASN 28 2HD2 ASN 28 11.039 9.850 1.422
195 H SER 29 H SER 29 5.130 7.641 1.516
196 HA SER 29 HA SER 29 3.785 8.984 0.300
197 1HB SER 29 2HB SER 29 6.248 10.682 -0.139
198 2HB SER 29 1HB SER 29 4.593 11.154 -0.525
199 HG SER 29 HG SER 29 5.874 11.318 1.814
200 H ILE 30 H ILE 30 6.294 7.226 -0.972
201 HA ILE 30 HA ILE 30 5.778 7.905 -3.757
202 HB ILE 30 HB ILE 30 7.537 5.726 -2.607
203 1HG1 ILE 30 2HG1 ILE 30 8.307 8.462 -3.654
204 2HG1 ILE 30 1HG1 ILE 30 8.231 8.024 -1.951
205 1HG2 ILE 30 1HG2 ILE 30 8.560 5.665 -4.823
206 2HG2 ILE 30 2HG2 ILE 30 7.427 6.892 -5.389
207 3HG2 ILE 30 3HG2 ILE 30 6.837 5.300 -4.913
208 1HD1 ILE 30 1HD1 ILE 30 9.979 6.535 -3.873
209 2HD1 ILE 30 2HD1 ILE 30 10.085 6.618 -2.115
210 3HD1 ILE 30 3HD1 ILE 30 10.511 8.024 -3.091
211 H SER 31 H SER 31 4.473 6.749 -5.094
212 HA SER 31 HA SER 31 2.587 4.949 -4.017
213 1HB SER 31 2HB SER 31 2.163 6.397 -5.996
214 2HB SER 31 1HB SER 31 3.274 5.397 -6.931
215 HG SER 31 HG SER 31 1.151 4.706 -7.260
Start of MODEL 7
1 1H CYS 1 H CYS 1 2.704 2.906 -3.614
2 HA CYS 1 HA CYS 1 5.080 1.359 -4.275
3 1HB CYS 1 2HB CYS 1 2.610 0.590 -2.700
4 2HB CYS 1 1HB CYS 1 4.057 -0.393 -2.857
5 H GLY 2 H GLY 2 2.194 2.071 -5.697
6 1HA GLY 2 2HA GLY 2 1.174 1.261 -7.596
7 2HA GLY 2 1HA GLY 2 2.525 0.150 -7.770
8 H GLU 3 H GLU 3 0.465 0.311 -4.945
9 HA GLU 3 HA GLU 3 -0.937 -2.112 -5.769
10 1HB GLU 3 2HB GLU 3 1.054 -2.778 -4.420
11 2HB GLU 3 1HB GLU 3 0.420 -1.843 -3.081
12 1HG GLU 3 2HG GLU 3 -1.341 -3.310 -2.726
13 2HG GLU 3 1HG GLU 3 -1.213 -4.007 -4.339
14 H SER 4 H SER 4 -2.996 -2.214 -5.033
15 HA SER 4 HA SER 4 -3.907 0.132 -3.520
16 1HB SER 4 2HB SER 4 -6.124 -0.321 -4.630
17 2HB SER 4 1HB SER 4 -4.821 0.150 -5.723
18 HG SER 4 HG SER 4 -5.250 -2.575 -5.217
19 H CYS 5 H CYS 5 -4.883 -0.079 -1.665
20 HA CYS 5 HA CYS 5 -5.586 -2.760 -0.691
21 1HB CYS 5 2HB CYS 5 -5.631 -1.478 1.558
22 2HB CYS 5 1HB CYS 5 -4.061 -1.780 0.819
23 H ALA 6 H ALA 6 -7.236 -1.462 -2.522
24 HA ALA 6 HA ALA 6 -9.326 0.047 -1.436
25 1HB ALA 6 1HB ALA 6 -8.817 -1.387 -3.939
26 2HB ALA 6 2HB ALA 6 -9.464 0.231 -3.667
27 3HB ALA 6 3HB ALA 6 -10.519 -1.178 -3.532
28 H MET 7 H MET 7 -8.965 -3.414 -1.813
29 HA MET 7 HA MET 7 -11.621 -3.931 -0.759
30 1HB MET 7 2HB MET 7 -10.549 -5.298 -2.597
31 2HB MET 7 1HB MET 7 -9.454 -5.933 -1.386
32 1HG MET 7 2HG MET 7 -11.226 -7.503 -1.745
33 2HG MET 7 1HG MET 7 -11.379 -6.812 -0.132
34 1HE MET 7 1HE MET 7 -13.750 -7.748 0.068
35 2HE MET 7 2HE MET 7 -13.848 -8.395 -1.569
36 3HE MET 7 3HE MET 7 -15.115 -7.326 -0.966
37 H ILE 8 H ILE 8 -8.332 -4.872 0.064
38 HA ILE 8 HA ILE 8 -9.137 -4.966 2.895
39 HB ILE 8 HB ILE 8 -7.291 -6.625 3.228
40 1HG1 ILE 8 2HG1 ILE 8 -7.355 -6.809 0.206
41 2HG1 ILE 8 1HG1 ILE 8 -6.042 -6.109 1.147
42 1HG2 ILE 8 1HG2 ILE 8 -8.655 -8.441 1.781
43 2HG2 ILE 8 2HG2 ILE 8 -9.813 -7.110 1.786
44 3HG2 ILE 8 3HG2 ILE 8 -9.226 -7.773 3.311
45 1HD1 ILE 8 1HD1 ILE 8 -5.111 -8.100 1.347
46 2HD1 ILE 8 2HD1 ILE 8 -6.407 -8.793 0.371
47 3HD1 ILE 8 3HD1 ILE 8 -6.563 -8.726 2.127
48 H SER 9 H SER 9 -7.933 -3.835 4.311
49 HA SER 9 HA SER 9 -6.047 -1.933 3.283
50 1HB SER 9 2HB SER 9 -7.685 -1.374 5.060
51 2HB SER 9 1HB SER 9 -6.868 -2.492 6.147
52 HG SER 9 HG SER 9 -4.948 -1.165 5.769
53 H PHE 10 H PHE 10 -5.001 -4.305 2.715
54 HA PHE 10 HA PHE 10 -2.541 -4.303 4.227
55 1HB PHE 10 2HB PHE 10 -3.829 -5.940 5.474
56 2HB PHE 10 1HB PHE 10 -4.241 -6.799 3.994
57 HD1 PHE 10 1HD PHE 10 -3.193 -8.833 3.916
58 HD2 PHE 10 2HD PHE 10 -1.053 -5.480 5.429
59 HE1 PHE 10 1HE PHE 10 -1.189 -10.236 4.181
60 HE2 PHE 10 2HE PHE 10 0.953 -6.876 5.695
61 HZ PHE 10 HZ PHE 10 0.888 -9.257 5.070
62 H CYS 11 H CYS 11 -1.169 -3.992 2.662
63 HA CYS 11 HA CYS 11 -1.607 -5.234 0.041
64 1HB CYS 11 2HB CYS 11 0.342 -3.101 0.915
65 2HB CYS 11 1HB CYS 11 0.225 -3.735 -0.717
66 H PHE 12 H PHE 12 0.246 -6.202 -1.100
67 HA PHE 12 HA PHE 12 1.604 -8.087 0.576
68 1HB PHE 12 2HB PHE 12 0.869 -8.652 -1.723
69 2HB PHE 12 1HB PHE 12 2.008 -7.473 -2.366
70 HD1 PHE 12 1HD PHE 12 2.301 -10.130 0.242
71 HD2 PHE 12 2HD PHE 12 3.717 -8.556 -3.450
72 HE1 PHE 12 1HE PHE 12 4.053 -11.858 0.182
73 HE2 PHE 12 2HE PHE 12 5.470 -10.281 -3.517
74 HZ PHE 12 HZ PHE 12 5.640 -11.933 -1.700
75 H THR 13 H THR 13 2.520 -5.212 -1.282
76 HA THR 13 HA THR 13 5.292 -5.380 -0.544
77 HB THR 13 HB THR 13 4.603 -4.282 -2.644
78 HG1 THR 13 1HG THR 13 5.722 -2.202 -1.108
79 1HG2 THR 13 1HG2 THR 13 2.688 -3.033 -1.086
80 2HG2 THR 13 2HG2 THR 13 3.077 -2.654 -2.764
81 3HG2 THR 13 3HG2 THR 13 3.835 -1.745 -1.456
82 H GLU 14 H GLU 14 2.576 -4.510 1.125
83 HA GLU 14 HA GLU 14 3.406 -2.256 2.587
84 1HB GLU 14 2HB GLU 14 1.085 -3.065 2.478
85 2HB GLU 14 1HB GLU 14 1.532 -4.472 3.423
86 1HG GLU 14 2HG GLU 14 1.595 -3.316 5.366
87 2HG GLU 14 1HG GLU 14 2.098 -1.813 4.586
88 H VAL 15 H VAL 15 3.635 -5.725 3.357
89 HA VAL 15 HA VAL 15 5.031 -5.303 5.799
90 HB VAL 15 HB VAL 15 5.611 -7.715 5.682
91 1HG1 VAL 15 1HG1 VAL 15 3.033 -8.387 5.363
92 2HG1 VAL 15 2HG1 VAL 15 2.871 -6.639 5.532
93 3HG1 VAL 15 3HG1 VAL 15 3.658 -7.579 6.801
94 1HG2 VAL 15 1HG2 VAL 15 5.484 -7.501 3.012
95 2HG2 VAL 15 2HG2 VAL 15 3.869 -8.133 3.333
96 3HG2 VAL 15 3HG2 VAL 15 5.290 -9.030 3.870
97 H ILE 16 H ILE 16 5.983 -5.232 2.531
98 HA ILE 16 HA ILE 16 8.741 -5.877 2.949
99 HB ILE 16 HB ILE 16 7.450 -4.483 0.602
100 1HG1 ILE 16 2HG1 ILE 16 6.477 -6.698 0.952
101 2HG1 ILE 16 1HG1 ILE 16 7.491 -6.697 -0.486
102 1HG2 ILE 16 1HG2 ILE 16 10.112 -5.891 0.777
103 2HG2 ILE 16 2HG2 ILE 16 9.879 -4.143 0.748
104 3HG2 ILE 16 3HG2 ILE 16 9.427 -5.116 -0.652
105 1HD1 ILE 16 1HD1 ILE 16 9.168 -7.947 0.563
106 2HD1 ILE 16 2HD1 ILE 16 7.653 -8.702 1.060
107 3HD1 ILE 16 3HD1 ILE 16 8.512 -7.634 2.170
108 H GLY 17 H GLY 17 6.791 -3.016 2.722
109 1HA GLY 17 2HA GLY 17 8.111 -1.357 4.381
110 2HA GLY 17 1HA GLY 17 9.060 -1.224 2.909
111 H CYS 18 H CYS 18 5.557 -1.538 3.374
112 HA CYS 18 HA CYS 18 5.215 1.169 2.287
113 1HB CYS 18 2HB CYS 18 3.981 -1.358 1.202
114 2HB CYS 18 1HB CYS 18 3.272 0.217 0.912
115 H SER 19 H SER 19 2.799 1.765 2.402
116 HA SER 19 HA SER 19 1.392 0.523 4.624
117 1HB SER 19 2HB SER 19 2.133 3.463 4.665
118 2HB SER 19 1HB SER 19 1.173 2.612 5.875
119 HG SER 19 HG SER 19 3.333 1.221 5.738
120 H CYS 20 H CYS 20 -0.747 0.564 4.322
121 HA CYS 20 HA CYS 20 -1.850 1.471 1.892
122 1HB CYS 20 2HB CYS 20 -2.849 -0.382 3.069
123 2HB CYS 20 1HB CYS 20 -3.169 0.619 4.479
124 H LYS 21 H LYS 21 -2.724 3.365 1.283
125 HA LYS 21 HA LYS 21 -3.586 5.273 3.310
126 1HB LYS 21 2HB LYS 21 -1.213 5.777 2.935
127 2HB LYS 21 1HB LYS 21 -1.502 5.897 1.206
128 1HG LYS 21 2HG LYS 21 -1.334 8.095 2.137
129 2HG LYS 21 1HG LYS 21 -2.997 7.812 1.623
130 1HD LYS 21 2HD LYS 21 -3.524 7.201 4.000
131 2HD LYS 21 1HD LYS 21 -1.904 7.755 4.431
132 1HE LYS 21 2HE LYS 21 -4.151 9.374 3.246
133 2HE LYS 21 1HE LYS 21 -3.426 9.549 4.843
134 1HZ LYS 21 1HZ LYS 21 -2.400 11.215 3.673
135 2HZ LYS 21 2HZ LYS 21 -2.360 10.344 2.224
136 3HZ LYS 21 3HZ LYS 21 -1.279 9.962 3.468
137 H ASN 22 H ASN 22 -5.534 5.858 2.754
138 HA ASN 22 HA ASN 22 -7.437 6.101 1.571
139 1HB ASN 22 2HB ASN 22 -7.318 7.845 -0.256
140 2HB ASN 22 1HB ASN 22 -6.756 8.334 1.331
141 1HD2 ASN 22 1HD2 ASN 22 -5.872 7.689 -1.950
142 2HD2 ASN 22 2HD2 ASN 22 -4.281 8.355 -1.868
143 H LYS 23 H LYS 23 -6.655 3.720 1.008
144 HA LYS 23 HA LYS 23 -7.235 2.018 -0.373
145 1HB LYS 23 2HB LYS 23 -9.052 3.100 -1.328
146 2HB LYS 23 1HB LYS 23 -8.054 4.304 -2.128
147 1HG LYS 23 2HG LYS 23 -7.264 2.532 -3.674
148 2HG LYS 23 1HG LYS 23 -8.394 1.416 -2.906
149 1HD LYS 23 2HD LYS 23 -9.317 2.366 -4.971
150 2HD LYS 23 1HD LYS 23 -10.265 2.832 -3.557
151 1HE LYS 23 2HE LYS 23 -9.932 4.717 -5.088
152 2HE LYS 23 1HE LYS 23 -9.175 5.008 -3.522
153 1HZ LYS 23 1HZ LYS 23 -7.128 5.007 -4.415
154 2HZ LYS 23 2HZ LYS 23 -7.944 5.384 -5.848
155 3HZ LYS 23 3HZ LYS 23 -7.477 3.789 -5.537
156 H VAL 24 H VAL 24 -4.693 4.176 -1.049
157 HA VAL 24 HA VAL 24 -3.526 2.124 -2.826
158 HB VAL 24 HB VAL 24 -2.739 5.031 -2.938
159 1HG1 VAL 24 1HG1 VAL 24 -1.057 4.012 -4.045
160 2HG1 VAL 24 2HG1 VAL 24 -2.220 3.992 -5.372
161 3HG1 VAL 24 3HG1 VAL 24 -2.004 2.559 -4.365
162 1HG2 VAL 24 1HG2 VAL 24 -4.754 5.437 -3.834
163 2HG2 VAL 24 2HG2 VAL 24 -5.098 3.724 -4.078
164 3HG2 VAL 24 3HG2 VAL 24 -4.119 4.603 -5.252
165 H CYS 25 H CYS 25 -1.657 1.242 -2.149
166 HA CYS 25 HA CYS 25 -0.592 2.078 0.383
167 1HB CYS 25 2HB CYS 25 -0.108 -0.198 -1.478
168 2HB CYS 25 1HB CYS 25 1.126 0.175 -0.279
169 H TYR 26 H TYR 26 1.082 3.305 0.810
170 HA TYR 26 HA TYR 26 2.912 4.063 -1.377
171 1HB TYR 26 2HB TYR 26 1.453 5.805 0.584
172 2HB TYR 26 1HB TYR 26 3.009 6.317 -0.047
173 HD1 TYR 26 1HD TYR 26 2.833 7.890 -1.690
174 HD2 TYR 26 2HD TYR 26 -0.103 4.821 -1.524
175 HE1 TYR 26 1HE TYR 26 1.731 8.847 -3.667
176 HE2 TYR 26 2HE TYR 26 -1.208 5.768 -3.503
177 HH TYR 26 HH TYR 26 -0.531 8.837 -4.703
178 H LEU 27 H LEU 27 4.990 4.812 -0.696
179 HA LEU 27 HA LEU 27 5.785 4.074 2.018
180 1HB LEU 27 2HB LEU 27 7.738 2.944 1.319
181 2HB LEU 27 1HB LEU 27 6.433 2.259 0.381
182 HG LEU 27 HG LEU 27 8.234 4.390 -0.751
183 1HD1 LEU 27 1HD1 LEU 27 9.540 2.540 -1.758
184 2HD1 LEU 27 2HD1 LEU 27 8.673 1.409 -0.717
185 3HD1 LEU 27 3HD1 LEU 27 9.710 2.647 -0.007
186 1HD2 LEU 27 1HD2 LEU 27 6.365 2.336 -1.888
187 2HD2 LEU 27 2HD2 LEU 27 7.626 3.091 -2.863
188 3HD2 LEU 27 3HD2 LEU 27 6.367 4.083 -2.129
189 H ASN 28 H ASN 28 6.278 5.963 2.863
190 HA ASN 28 HA ASN 28 7.123 8.058 3.178
191 1HB ASN 28 2HB ASN 28 9.248 6.699 2.699
192 2HB ASN 28 1HB ASN 28 9.190 7.380 1.081
193 1HD2 ASN 28 1HD2 ASN 28 7.954 9.680 3.112
194 2HD2 ASN 28 2HD2 ASN 28 9.394 10.579 3.412
195 H SER 29 H SER 29 4.989 7.944 1.537
196 HA SER 29 HA SER 29 3.734 9.258 0.199
197 1HB SER 29 2HB SER 29 6.224 10.943 -0.116
198 2HB SER 29 1HB SER 29 4.595 11.411 -0.607
199 HG SER 29 HG SER 29 5.285 12.193 1.499
200 H ILE 30 H ILE 30 6.080 7.297 -0.816
201 HA ILE 30 HA ILE 30 5.868 7.951 -3.663
202 HB ILE 30 HB ILE 30 7.493 5.788 -2.293
203 1HG1 ILE 30 2HG1 ILE 30 8.393 8.447 -3.439
204 2HG1 ILE 30 1HG1 ILE 30 8.194 8.111 -1.721
205 1HG2 ILE 30 1HG2 ILE 30 8.210 5.088 -4.310
206 2HG2 ILE 30 2HG2 ILE 30 8.251 6.720 -4.979
207 3HG2 ILE 30 3HG2 ILE 30 6.725 5.835 -4.900
208 1HD1 ILE 30 1HD1 ILE 30 9.855 6.097 -2.486
209 2HD1 ILE 30 2HD1 ILE 30 10.371 7.632 -1.786
210 3HD1 ILE 30 3HD1 ILE 30 10.371 7.415 -3.538
211 H SER 31 H SER 31 4.675 6.708 -5.077
212 HA SER 31 HA SER 31 2.664 5.009 -4.036
213 1HB SER 31 2HB SER 31 3.532 5.245 -6.921
214 2HB SER 31 1HB SER 31 1.946 4.770 -6.312
215 HG SER 31 HG SER 31 1.456 6.811 -5.950
Start of MODEL 8
1 1H CYS 1 H CYS 1 2.849 2.844 -3.760
2 HA CYS 1 HA CYS 1 5.193 1.330 -4.579
3 1HB CYS 1 2HB CYS 1 2.868 0.567 -2.800
4 2HB CYS 1 1HB CYS 1 4.306 -0.412 -3.067
5 H GLY 2 H GLY 2 2.443 2.116 -6.042
6 1HA GLY 2 2HA GLY 2 1.317 1.263 -7.860
7 2HA GLY 2 1HA GLY 2 2.631 0.109 -8.018
8 H GLU 3 H GLU 3 0.380 0.502 -5.329
9 HA GLU 3 HA GLU 3 -1.056 -1.910 -6.061
10 1HB GLU 3 2HB GLU 3 0.941 -2.644 -4.695
11 2HB GLU 3 1HB GLU 3 0.294 -1.704 -3.357
12 1HG GLU 3 2HG GLU 3 -1.776 -3.080 -3.481
13 2HG GLU 3 1HG GLU 3 -0.977 -4.083 -4.688
14 H SER 4 H SER 4 -3.041 -2.132 -4.818
15 HA SER 4 HA SER 4 -3.751 0.288 -3.322
16 1HB SER 4 2HB SER 4 -5.974 0.277 -4.451
17 2HB SER 4 1HB SER 4 -4.636 0.605 -5.551
18 HG SER 4 HG SER 4 -5.283 -2.062 -5.287
19 H CYS 5 H CYS 5 -4.723 -0.067 -1.480
20 HA CYS 5 HA CYS 5 -5.533 -2.772 -0.747
21 1HB CYS 5 2HB CYS 5 -5.802 -1.566 1.549
22 2HB CYS 5 1HB CYS 5 -4.182 -1.883 0.946
23 H ALA 6 H ALA 6 -7.082 -1.394 -2.608
24 HA ALA 6 HA ALA 6 -9.283 -0.002 -1.639
25 1HB ALA 6 1HB ALA 6 -8.555 -1.347 -4.116
26 2HB ALA 6 2HB ALA 6 -9.382 0.188 -3.860
27 3HB ALA 6 3HB ALA 6 -10.292 -1.321 -3.811
28 H MET 7 H MET 7 -8.802 -3.452 -1.972
29 HA MET 7 HA MET 7 -11.499 -4.029 -1.049
30 1HB MET 7 2HB MET 7 -10.385 -5.380 -2.843
31 2HB MET 7 1HB MET 7 -9.250 -5.956 -1.637
32 1HG MET 7 2HG MET 7 -10.975 -7.598 -2.023
33 2HG MET 7 1HG MET 7 -11.082 -6.966 -0.382
34 1HE MET 7 1HE MET 7 -12.433 -5.095 -3.697
35 2HE MET 7 2HE MET 7 -13.972 -5.948 -3.827
36 3HE MET 7 3HE MET 7 -12.456 -6.837 -3.975
37 H ILE 8 H ILE 8 -8.272 -5.084 -0.107
38 HA ILE 8 HA ILE 8 -9.187 -5.204 2.686
39 HB ILE 8 HB ILE 8 -7.218 -6.711 3.067
40 1HG1 ILE 8 2HG1 ILE 8 -7.117 -6.801 0.040
41 2HG1 ILE 8 1HG1 ILE 8 -5.923 -6.008 1.062
42 1HG2 ILE 8 1HG2 ILE 8 -8.731 -8.323 2.912
43 2HG2 ILE 8 2HG2 ILE 8 -8.552 -8.356 1.157
44 3HG2 ILE 8 3HG2 ILE 8 -9.728 -7.275 1.903
45 1HD1 ILE 8 1HD1 ILE 8 -5.349 -8.309 0.181
46 2HD1 ILE 8 2HD1 ILE 8 -6.552 -8.928 1.312
47 3HD1 ILE 8 3HD1 ILE 8 -5.147 -8.051 1.914
48 H SER 9 H SER 9 -8.196 -3.949 4.171
49 HA SER 9 HA SER 9 -6.436 -1.883 3.257
50 1HB SER 9 2HB SER 9 -8.214 -1.506 4.950
51 2HB SER 9 1HB SER 9 -7.330 -2.526 6.082
52 HG SER 9 HG SER 9 -5.560 -1.012 5.825
53 H PHE 10 H PHE 10 -5.135 -4.133 2.748
54 HA PHE 10 HA PHE 10 -2.753 -3.874 4.368
55 1HB PHE 10 2HB PHE 10 -3.911 -5.693 5.525
56 2HB PHE 10 1HB PHE 10 -4.137 -6.547 4.003
57 HD1 PHE 10 1HD PHE 10 -2.836 -8.428 3.900
58 HD2 PHE 10 2HD PHE 10 -1.216 -4.910 5.665
59 HE1 PHE 10 1HE PHE 10 -0.692 -9.587 4.236
60 HE2 PHE 10 2HE PHE 10 0.931 -6.062 6.002
61 HZ PHE 10 HZ PHE 10 1.195 -8.405 5.287
62 H CYS 11 H CYS 11 -1.177 -3.629 2.958
63 HA CYS 11 HA CYS 11 -1.584 -4.521 0.212
64 1HB CYS 11 2HB CYS 11 0.654 -2.840 1.348
65 2HB CYS 11 1HB CYS 11 0.262 -3.063 -0.348
66 H PHE 12 H PHE 12 -0.089 -5.784 -0.936
67 HA PHE 12 HA PHE 12 1.133 -7.870 0.572
68 1HB PHE 12 2HB PHE 12 0.276 -8.196 -1.730
69 2HB PHE 12 1HB PHE 12 1.525 -7.116 -2.341
70 HD1 PHE 12 1HD PHE 12 3.065 -8.302 -3.548
71 HD2 PHE 12 2HD PHE 12 1.576 -9.962 0.076
72 HE1 PHE 12 1HE PHE 12 4.597 -10.213 -3.798
73 HE2 PHE 12 2HE PHE 12 3.105 -11.874 -0.166
74 HZ PHE 12 HZ PHE 12 4.618 -12.000 -2.105
75 H THR 13 H THR 13 2.281 -4.969 -1.060
76 HA THR 13 HA THR 13 5.045 -5.495 -0.405
77 HB THR 13 HB THR 13 4.457 -4.300 -2.480
78 HG1 THR 13 1HG THR 13 5.781 -2.242 -1.288
79 1HG2 THR 13 1HG2 THR 13 2.515 -3.059 -1.459
80 2HG2 THR 13 2HG2 THR 13 3.566 -2.101 -2.501
81 3HG2 THR 13 3HG2 THR 13 3.696 -1.957 -0.749
82 H GLU 14 H GLU 14 2.514 -4.595 1.446
83 HA GLU 14 HA GLU 14 3.477 -2.384 2.916
84 1HB GLU 14 2HB GLU 14 1.127 -3.340 2.924
85 2HB GLU 14 1HB GLU 14 1.728 -4.585 3.999
86 1HG GLU 14 2HG GLU 14 2.011 -3.126 5.751
87 2HG GLU 14 1HG GLU 14 2.123 -1.717 4.693
88 H VAL 15 H VAL 15 3.819 -5.867 3.362
89 HA VAL 15 HA VAL 15 5.213 -5.781 5.810
90 HB VAL 15 HB VAL 15 4.143 -7.824 4.902
91 1HG1 VAL 15 1HG1 VAL 15 5.286 -7.312 2.562
92 2HG1 VAL 15 2HG1 VAL 15 4.813 -8.941 3.045
93 3HG1 VAL 15 3HG1 VAL 15 6.492 -8.428 3.203
94 1HG2 VAL 15 1HG2 VAL 15 6.105 -9.384 5.430
95 2HG2 VAL 15 2HG2 VAL 15 5.597 -8.247 6.679
96 3HG2 VAL 15 3HG2 VAL 15 7.030 -7.909 5.708
97 H ILE 16 H ILE 16 6.198 -5.188 2.554
98 HA ILE 16 HA ILE 16 8.997 -5.589 2.970
99 HB ILE 16 HB ILE 16 7.614 -4.066 0.760
100 1HG1 ILE 16 2HG1 ILE 16 8.536 -6.949 0.838
101 2HG1 ILE 16 1HG1 ILE 16 6.861 -6.417 0.931
102 1HG2 ILE 16 1HG2 ILE 16 9.947 -5.159 -0.236
103 2HG2 ILE 16 2HG2 ILE 16 10.407 -4.586 1.368
104 3HG2 ILE 16 3HG2 ILE 16 9.692 -3.470 0.204
105 1HD1 ILE 16 1HD1 ILE 16 6.894 -5.641 -1.304
106 2HD1 ILE 16 2HD1 ILE 16 7.625 -7.247 -1.307
107 3HD1 ILE 16 3HD1 ILE 16 8.647 -5.812 -1.407
108 H GLY 17 H GLY 17 6.777 -2.953 3.220
109 1HA GLY 17 2HA GLY 17 8.091 -1.400 4.994
110 2HA GLY 17 1HA GLY 17 8.842 -0.945 3.473
111 H CYS 18 H CYS 18 6.278 -1.425 2.034
112 HA CYS 18 HA CYS 18 5.294 1.220 2.111
113 1HB CYS 18 2HB CYS 18 4.111 -1.276 0.890
114 2HB CYS 18 1HB CYS 18 3.515 0.351 0.600
115 H SER 19 H SER 19 2.880 1.681 2.340
116 HA SER 19 HA SER 19 1.555 0.097 4.384
117 1HB SER 19 2HB SER 19 2.145 3.037 4.815
118 2HB SER 19 1HB SER 19 1.244 1.982 5.902
119 HG SER 19 HG SER 19 3.521 0.773 5.514
120 H CYS 20 H CYS 20 -0.624 0.198 4.245
121 HA CYS 20 HA CYS 20 -1.827 1.222 1.917
122 1HB CYS 20 2HB CYS 20 -2.800 -0.670 3.044
123 2HB CYS 20 1HB CYS 20 -3.007 0.254 4.527
124 H LYS 21 H LYS 21 -2.762 3.150 1.457
125 HA LYS 21 HA LYS 21 -3.441 4.950 3.652
126 1HB LYS 21 2HB LYS 21 -1.142 5.547 3.044
127 2HB LYS 21 1HB LYS 21 -1.609 5.683 1.355
128 1HG LYS 21 2HG LYS 21 -3.338 7.421 2.503
129 2HG LYS 21 1HG LYS 21 -1.938 7.580 3.566
130 1HD LYS 21 2HD LYS 21 -1.834 9.192 1.731
131 2HD LYS 21 1HD LYS 21 -0.514 8.022 1.619
132 1HE LYS 21 2HE LYS 21 -1.670 6.796 -0.093
133 2HE LYS 21 1HE LYS 21 -3.110 7.793 0.104
134 1HZ LYS 21 1HZ LYS 21 -1.545 9.707 -0.533
135 2HZ LYS 21 2HZ LYS 21 -2.096 8.676 -1.753
136 3HZ LYS 21 3HZ LYS 21 -0.533 8.495 -1.137
137 H ASN 22 H ASN 22 -5.481 5.338 3.325
138 HA ASN 22 HA ASN 22 -7.494 5.494 2.319
139 1HB ASN 22 2HB ASN 22 -7.660 7.506 0.755
140 2HB ASN 22 1HB ASN 22 -7.131 7.782 2.405
141 1HD2 ASN 22 1HD2 ASN 22 -5.556 9.151 2.593
142 2HD2 ASN 22 2HD2 ASN 22 -4.339 9.490 1.420
143 H LYS 23 H LYS 23 -6.569 3.340 1.348
144 HA LYS 23 HA LYS 23 -7.203 1.827 -0.232
145 1HB LYS 23 2HB LYS 23 -9.064 2.988 -1.015
146 2HB LYS 23 1HB LYS 23 -8.097 4.283 -1.704
147 1HG LYS 23 2HG LYS 23 -7.289 2.662 -3.416
148 2HG LYS 23 1HG LYS 23 -8.432 1.486 -2.764
149 1HD LYS 23 2HD LYS 23 -10.287 2.957 -3.285
150 2HD LYS 23 1HD LYS 23 -9.172 4.205 -3.843
151 1HE LYS 23 2HE LYS 23 -8.392 2.688 -5.615
152 2HE LYS 23 1HE LYS 23 -9.549 1.475 -5.068
153 1HZ LYS 23 1HZ LYS 23 -10.115 4.107 -6.299
154 2HZ LYS 23 2HZ LYS 23 -11.302 3.215 -5.489
155 3HZ LYS 23 3HZ LYS 23 -10.554 2.575 -6.864
156 H VAL 24 H VAL 24 -4.818 4.257 -0.858
157 HA VAL 24 HA VAL 24 -3.660 2.406 -2.837
158 HB VAL 24 HB VAL 24 -4.173 4.565 -3.835
159 1HG1 VAL 24 1HG1 VAL 24 -3.152 5.615 -1.417
160 2HG1 VAL 24 2HG1 VAL 24 -3.888 6.478 -2.769
161 3HG1 VAL 24 3HG1 VAL 24 -2.144 6.214 -2.735
162 1HG2 VAL 24 1HG2 VAL 24 -2.086 3.145 -4.384
163 2HG2 VAL 24 2HG2 VAL 24 -1.193 4.472 -3.642
164 3HG2 VAL 24 3HG2 VAL 24 -2.216 4.774 -5.047
165 H CYS 25 H CYS 25 -1.734 1.542 -2.513
166 HA CYS 25 HA CYS 25 -0.524 1.786 0.080
167 1HB CYS 25 2HB CYS 25 0.500 0.254 -2.312
168 2HB CYS 25 1HB CYS 25 0.872 -0.039 -0.616
169 H TYR 26 H TYR 26 0.991 3.183 0.644
170 HA TYR 26 HA TYR 26 2.822 4.209 -1.426
171 1HB TYR 26 2HB TYR 26 1.179 5.699 0.542
172 2HB TYR 26 1HB TYR 26 2.811 6.282 0.269
173 HD1 TYR 26 1HD TYR 26 0.520 4.796 -2.266
174 HD2 TYR 26 2HD TYR 26 2.413 8.309 -0.798
175 HE1 TYR 26 1HE TYR 26 -0.238 6.032 -4.252
176 HE2 TYR 26 2HE TYR 26 1.661 9.551 -2.778
177 HH TYR 26 HH TYR 26 0.979 8.720 -5.329
178 H LEU 27 H LEU 27 4.832 4.925 -0.712
179 HA LEU 27 HA LEU 27 5.731 4.048 1.934
180 1HB LEU 27 2HB LEU 27 6.345 2.244 0.421
181 2HB LEU 27 1HB LEU 27 7.052 3.386 -0.703
182 HG LEU 27 HG LEU 27 8.821 3.908 0.893
183 1HD1 LEU 27 1HD1 LEU 27 7.492 3.545 2.944
184 2HD1 LEU 27 2HD1 LEU 27 9.058 2.733 2.980
185 3HD1 LEU 27 3HD1 LEU 27 7.590 1.806 2.665
186 1HD2 LEU 27 1HD2 LEU 27 8.758 0.932 0.848
187 2HD2 LEU 27 2HD2 LEU 27 10.079 2.040 0.475
188 3HD2 LEU 27 3HD2 LEU 27 8.765 1.811 -0.680
189 H ASN 28 H ASN 28 6.093 6.049 2.726
190 HA ASN 28 HA ASN 28 6.958 8.135 3.003
191 1HB ASN 28 2HB ASN 28 9.072 6.622 2.655
192 2HB ASN 28 1HB ASN 28 9.194 7.464 1.113
193 1HD2 ASN 28 1HD2 ASN 28 10.487 7.446 4.004
194 2HD2 ASN 28 2HD2 ASN 28 10.807 9.125 4.249
195 H SER 29 H SER 29 4.957 8.168 1.305
196 HA SER 29 HA SER 29 3.895 9.509 -0.173
197 1HB SER 29 2HB SER 29 6.565 10.867 -0.587
198 2HB SER 29 1HB SER 29 4.991 11.482 -1.094
199 HG SER 29 HG SER 29 6.194 11.651 1.313
200 H ILE 30 H ILE 30 6.337 7.396 -1.015
201 HA ILE 30 HA ILE 30 6.110 7.801 -3.888
202 HB ILE 30 HB ILE 30 7.569 5.642 -2.348
203 1HG1 ILE 30 2HG1 ILE 30 8.488 7.857 -1.867
204 2HG1 ILE 30 1HG1 ILE 30 9.607 6.934 -2.865
205 1HG2 ILE 30 1HG2 ILE 30 8.542 6.242 -5.013
206 2HG2 ILE 30 2HG2 ILE 30 6.874 5.672 -5.024
207 3HG2 ILE 30 3HG2 ILE 30 8.136 4.690 -4.279
208 1HD1 ILE 30 1HD1 ILE 30 7.710 9.022 -3.912
209 2HD1 ILE 30 2HD1 ILE 30 8.973 8.183 -4.815
210 3HD1 ILE 30 3HD1 ILE 30 9.408 9.302 -3.524
211 H SER 31 H SER 31 4.887 6.571 -5.246
212 HA SER 31 HA SER 31 2.810 4.946 -4.129
213 1HB SER 31 2HB SER 31 2.489 6.387 -6.148
214 2HB SER 31 1HB SER 31 3.563 5.309 -7.039
215 HG SER 31 HG SER 31 1.227 4.899 -7.218
Start of MODEL 9
1 1H CYS 1 H CYS 1 2.811 2.671 -3.614
2 HA CYS 1 HA CYS 1 5.123 1.150 -4.512
3 1HB CYS 1 2HB CYS 1 2.854 0.444 -2.643
4 2HB CYS 1 1HB CYS 1 4.200 -0.626 -3.013
5 H GLY 2 H GLY 2 2.326 1.942 -5.889
6 1HA GLY 2 2HA GLY 2 1.126 1.077 -7.657
7 2HA GLY 2 1HA GLY 2 2.427 -0.089 -7.855
8 H GLU 3 H GLU 3 0.487 0.290 -4.977
9 HA GLU 3 HA GLU 3 -0.907 -2.230 -5.543
10 1HB GLU 3 2HB GLU 3 0.932 -2.768 -4.036
11 2HB GLU 3 1HB GLU 3 0.480 -1.453 -2.962
12 1HG GLU 3 2HG GLU 3 -0.224 -3.557 -2.034
13 2HG GLU 3 1HG GLU 3 -1.634 -2.595 -2.474
14 H SER 4 H SER 4 -3.007 -2.358 -4.641
15 HA SER 4 HA SER 4 -3.967 0.180 -3.490
16 1HB SER 4 2HB SER 4 -6.118 -0.240 -4.726
17 2HB SER 4 1HB SER 4 -4.735 0.130 -5.757
18 HG SER 4 HG SER 4 -4.963 -2.538 -5.282
19 H CYS 5 H CYS 5 -4.792 -0.035 -1.568
20 HA CYS 5 HA CYS 5 -5.696 -2.658 -0.641
21 1HB CYS 5 2HB CYS 5 -5.765 -1.458 1.607
22 2HB CYS 5 1HB CYS 5 -4.174 -1.672 0.891
23 H ALA 6 H ALA 6 -7.237 -1.281 -2.527
24 HA ALA 6 HA ALA 6 -9.349 0.227 -1.472
25 1HB ALA 6 1HB ALA 6 -10.485 -0.943 -3.634
26 2HB ALA 6 2HB ALA 6 -8.772 -1.147 -3.996
27 3HB ALA 6 3HB ALA 6 -9.425 0.464 -3.704
28 H MET 7 H MET 7 -8.993 -3.217 -1.954
29 HA MET 7 HA MET 7 -11.656 -3.759 -0.923
30 1HB MET 7 2HB MET 7 -10.665 -5.052 -2.832
31 2HB MET 7 1HB MET 7 -9.504 -5.724 -1.705
32 1HG MET 7 2HG MET 7 -11.296 -7.290 -2.085
33 2HG MET 7 1HG MET 7 -11.326 -6.722 -0.417
34 1HE MET 7 1HE MET 7 -13.678 -4.594 -3.554
35 2HE MET 7 2HE MET 7 -13.884 -6.310 -3.904
36 3HE MET 7 3HE MET 7 -12.264 -5.617 -3.810
37 H ILE 8 H ILE 8 -8.411 -4.923 -0.189
38 HA ILE 8 HA ILE 8 -9.206 -5.162 2.633
39 HB ILE 8 HB ILE 8 -7.326 -6.792 2.856
40 1HG1 ILE 8 2HG1 ILE 8 -7.322 -6.724 -0.171
41 2HG1 ILE 8 1HG1 ILE 8 -6.058 -6.048 0.851
42 1HG2 ILE 8 1HG2 ILE 8 -9.864 -7.164 1.527
43 2HG2 ILE 8 2HG2 ILE 8 -9.076 -8.156 2.754
44 3HG2 ILE 8 3HG2 ILE 8 -8.693 -8.394 1.050
45 1HD1 ILE 8 1HD1 ILE 8 -6.295 -8.674 -0.140
46 2HD1 ILE 8 2HD1 ILE 8 -6.485 -8.753 1.612
47 3HD1 ILE 8 3HD1 ILE 8 -5.047 -8.009 0.914
48 H SER 9 H SER 9 -8.017 -4.168 4.171
49 HA SER 9 HA SER 9 -6.195 -2.113 3.330
50 1HB SER 9 2HB SER 9 -7.846 -1.712 5.114
51 2HB SER 9 1HB SER 9 -7.069 -2.937 6.114
52 HG SER 9 HG SER 9 -5.156 -1.624 6.019
53 H PHE 10 H PHE 10 -5.006 -4.265 2.525
54 HA PHE 10 HA PHE 10 -2.637 -4.432 4.202
55 1HB PHE 10 2HB PHE 10 -3.915 -6.384 4.925
56 2HB PHE 10 1HB PHE 10 -4.139 -6.890 3.254
57 HD1 PHE 10 1HD PHE 10 -1.189 -5.811 5.285
58 HD2 PHE 10 2HD PHE 10 -2.933 -8.773 2.775
59 HE1 PHE 10 1HE PHE 10 0.884 -7.129 5.405
60 HE2 PHE 10 2HE PHE 10 -0.863 -10.097 2.891
61 HZ PHE 10 HZ PHE 10 1.049 -9.275 4.208
62 H CYS 11 H CYS 11 -1.008 -3.968 2.940
63 HA CYS 11 HA CYS 11 -1.292 -4.185 0.053
64 1HB CYS 11 2HB CYS 11 0.968 -3.048 1.704
65 2HB CYS 11 1HB CYS 11 0.738 -2.841 -0.023
66 H PHE 12 H PHE 12 -0.024 -5.446 -1.285
67 HA PHE 12 HA PHE 12 0.997 -7.859 -0.263
68 1HB PHE 12 2HB PHE 12 0.252 -7.598 -2.599
69 2HB PHE 12 1HB PHE 12 1.596 -6.504 -2.908
70 HD1 PHE 12 1HD PHE 12 3.145 -7.478 -4.277
71 HD2 PHE 12 2HD PHE 12 1.309 -9.842 -1.253
72 HE1 PHE 12 1HE PHE 12 4.551 -9.389 -4.923
73 HE2 PHE 12 2HE PHE 12 2.716 -11.757 -1.891
74 HZ PHE 12 HZ PHE 12 4.339 -11.532 -3.729
75 H THR 13 H THR 13 2.524 -4.808 -1.151
76 HA THR 13 HA THR 13 5.143 -5.800 -0.339
77 HB THR 13 HB THR 13 5.942 -3.567 -1.127
78 HG1 THR 13 1HG THR 13 4.526 -2.071 -1.589
79 1HG2 THR 13 1HG2 THR 13 5.067 -4.016 -3.594
80 2HG2 THR 13 2HG2 THR 13 4.516 -5.521 -2.859
81 3HG2 THR 13 3HG2 THR 13 6.227 -5.091 -2.812
82 H GLU 14 H GLU 14 2.718 -5.003 1.489
83 HA GLU 14 HA GLU 14 3.451 -2.735 2.979
84 1HB GLU 14 2HB GLU 14 1.272 -4.097 3.050
85 2HB GLU 14 1HB GLU 14 2.116 -5.155 4.168
86 1HG GLU 14 2HG GLU 14 2.191 -3.574 5.828
87 2HG GLU 14 1HG GLU 14 2.046 -2.227 4.697
88 H VAL 15 H VAL 15 4.286 -6.130 3.348
89 HA VAL 15 HA VAL 15 5.704 -5.997 5.752
90 HB VAL 15 HB VAL 15 6.305 -7.843 3.435
91 1HG1 VAL 15 1HG1 VAL 15 7.062 -9.397 5.156
92 2HG1 VAL 15 2HG1 VAL 15 6.710 -8.199 6.402
93 3HG1 VAL 15 3HG1 VAL 15 7.978 -7.890 5.214
94 1HG2 VAL 15 1HG2 VAL 15 4.405 -8.431 5.683
95 2HG2 VAL 15 2HG2 VAL 15 4.617 -9.299 4.164
96 3HG2 VAL 15 3HG2 VAL 15 3.868 -7.702 4.169
97 H ILE 16 H ILE 16 6.618 -5.118 2.505
98 HA ILE 16 HA ILE 16 9.424 -5.028 2.966
99 HB ILE 16 HB ILE 16 7.813 -3.660 0.808
100 1HG1 ILE 16 2HG1 ILE 16 9.270 -6.315 0.788
101 2HG1 ILE 16 1HG1 ILE 16 7.523 -6.106 0.822
102 1HG2 ILE 16 1HG2 ILE 16 10.189 -2.837 1.299
103 2HG2 ILE 16 2HG2 ILE 16 9.803 -3.280 -0.363
104 3HG2 ILE 16 3HG2 ILE 16 10.721 -4.390 0.654
105 1HD1 ILE 16 1HD1 ILE 16 9.092 -6.422 -1.415
106 2HD1 ILE 16 2HD1 ILE 16 8.756 -4.691 -1.386
107 3HD1 ILE 16 3HD1 ILE 16 7.425 -5.849 -1.380
108 H GLY 17 H GLY 17 6.802 -2.811 3.359
109 1HA GLY 17 2HA GLY 17 7.735 -1.179 5.234
110 2HA GLY 17 1HA GLY 17 8.596 -0.563 3.832
111 H CYS 18 H CYS 18 6.109 -1.369 2.210
112 HA CYS 18 HA CYS 18 4.959 1.195 2.119
113 1HB CYS 18 2HB CYS 18 3.771 -1.375 1.082
114 2HB CYS 18 1HB CYS 18 3.315 0.250 0.596
115 H SER 19 H SER 19 2.753 1.788 2.507
116 HA SER 19 HA SER 19 1.337 0.214 4.518
117 1HB SER 19 2HB SER 19 2.718 1.761 5.817
118 2HB SER 19 1HB SER 19 2.123 3.122 4.871
119 HG SER 19 HG SER 19 0.647 1.465 6.645
120 H CYS 20 H CYS 20 -0.818 0.278 4.267
121 HA CYS 20 HA CYS 20 -1.986 1.313 1.943
122 1HB CYS 20 2HB CYS 20 -3.016 -0.540 3.089
123 2HB CYS 20 1HB CYS 20 -3.215 0.411 4.558
124 H LYS 21 H LYS 21 -2.885 3.265 1.452
125 HA LYS 21 HA LYS 21 -3.619 5.081 3.609
126 1HB LYS 21 2HB LYS 21 -1.094 5.291 2.735
127 2HB LYS 21 1HB LYS 21 -1.884 6.242 1.484
128 1HG LYS 21 2HG LYS 21 -1.152 7.732 3.190
129 2HG LYS 21 1HG LYS 21 -2.914 7.624 3.290
130 1HD LYS 21 2HD LYS 21 -1.888 7.515 5.516
131 2HD LYS 21 1HD LYS 21 -2.719 6.009 5.115
132 1HE LYS 21 2HE LYS 21 -0.248 5.454 4.185
133 2HE LYS 21 1HE LYS 21 0.158 6.543 5.510
134 1HZ LYS 21 1HZ LYS 21 -1.521 4.102 5.745
135 2HZ LYS 21 2HZ LYS 21 -1.074 5.126 7.018
136 3HZ LYS 21 3HZ LYS 21 0.104 4.216 6.211
137 H ASN 22 H ASN 22 -5.551 5.821 3.070
138 HA ASN 22 HA ASN 22 -7.432 6.188 1.867
139 1HB ASN 22 2HB ASN 22 -7.160 7.971 0.074
140 2HB ASN 22 1HB ASN 22 -6.628 8.385 1.695
141 1HD2 ASN 22 1HD2 ASN 22 -5.774 8.166 -1.571
142 2HD2 ASN 22 2HD2 ASN 22 -4.103 8.568 -1.413
143 H LYS 23 H LYS 23 -6.661 3.761 1.226
144 HA LYS 23 HA LYS 23 -7.269 2.119 -0.220
145 1HB LYS 23 2HB LYS 23 -9.075 3.256 -1.135
146 2HB LYS 23 1HB LYS 23 -8.065 4.486 -1.876
147 1HG LYS 23 2HG LYS 23 -7.225 2.580 -3.380
148 2HG LYS 23 1HG LYS 23 -8.642 1.703 -2.804
149 1HD LYS 23 2HD LYS 23 -9.347 2.728 -4.793
150 2HD LYS 23 1HD LYS 23 -9.987 3.755 -3.511
151 1HE LYS 23 2HE LYS 23 -7.398 4.296 -4.962
152 2HE LYS 23 1HE LYS 23 -8.948 4.978 -5.444
153 1HZ LYS 23 1HZ LYS 23 -7.791 6.565 -4.117
154 2HZ LYS 23 2HZ LYS 23 -7.517 5.444 -2.880
155 3HZ LYS 23 3HZ LYS 23 -9.089 5.986 -3.201
156 H VAL 24 H VAL 24 -4.791 4.390 -0.956
157 HA VAL 24 HA VAL 24 -3.643 2.449 -2.858
158 HB VAL 24 HB VAL 24 -2.888 5.364 -2.617
159 1HG1 VAL 24 1HG1 VAL 24 -1.314 5.001 -4.167
160 2HG1 VAL 24 2HG1 VAL 24 -2.353 3.933 -5.110
161 3HG1 VAL 24 3HG1 VAL 24 -1.470 3.302 -3.719
162 1HG2 VAL 24 1HG2 VAL 24 -5.203 4.221 -3.799
163 2HG2 VAL 24 2HG2 VAL 24 -4.149 4.789 -5.094
164 3HG2 VAL 24 3HG2 VAL 24 -4.668 5.902 -3.827
165 H CYS 25 H CYS 25 -1.698 1.555 -2.439
166 HA CYS 25 HA CYS 25 -0.621 1.915 0.211
167 1HB CYS 25 2HB CYS 25 0.302 0.186 -2.088
168 2HB CYS 25 1HB CYS 25 0.920 0.102 -0.437
169 H TYR 26 H TYR 26 0.890 3.314 0.767
170 HA TYR 26 HA TYR 26 2.746 4.277 -1.308
171 1HB TYR 26 2HB TYR 26 1.470 5.847 0.934
172 2HB TYR 26 1HB TYR 26 2.821 6.438 -0.022
173 HD1 TYR 26 1HD TYR 26 2.496 6.904 -2.449
174 HD2 TYR 26 2HD TYR 26 -0.757 5.944 0.117
175 HE1 TYR 26 1HE TYR 26 0.931 7.852 -4.090
176 HE2 TYR 26 2HE TYR 26 -2.332 6.881 -1.520
177 HH TYR 26 HH TYR 26 -1.459 8.875 -3.979
178 H LEU 27 H LEU 27 4.807 4.812 -0.689
179 HA LEU 27 HA LEU 27 5.716 3.978 1.974
180 1HB LEU 27 2HB LEU 27 6.250 2.146 0.461
181 2HB LEU 27 1HB LEU 27 6.958 3.258 -0.689
182 HG LEU 27 HG LEU 27 8.783 3.745 0.854
183 1HD1 LEU 27 1HD1 LEU 27 7.308 3.289 2.904
184 2HD1 LEU 27 2HD1 LEU 27 9.008 2.828 2.979
185 3HD1 LEU 27 3HD1 LEU 27 7.773 1.603 2.687
186 1HD2 LEU 27 1HD2 LEU 27 9.623 2.066 -0.369
187 2HD2 LEU 27 2HD2 LEU 27 8.189 1.061 -0.158
188 3HD2 LEU 27 3HD2 LEU 27 9.422 1.113 1.102
189 H ASN 28 H ASN 28 6.111 5.998 2.713
190 HA ASN 28 HA ASN 28 7.032 8.063 2.950
191 1HB ASN 28 2HB ASN 28 9.111 6.505 2.603
192 2HB ASN 28 1HB ASN 28 9.227 7.307 1.042
193 1HD2 ASN 28 1HD2 ASN 28 10.554 7.329 3.922
194 2HD2 ASN 28 2HD2 ASN 28 10.913 9.007 4.120
195 H SER 29 H SER 29 5.008 8.091 1.275
196 HA SER 29 HA SER 29 3.945 9.430 -0.205
197 1HB SER 29 2HB SER 29 6.627 10.721 -0.746
198 2HB SER 29 1HB SER 29 5.041 11.366 -1.171
199 HG SER 29 HG SER 29 6.381 11.507 1.176
200 H ILE 30 H ILE 30 6.379 7.280 -1.048
201 HA ILE 30 HA ILE 30 6.078 7.607 -3.924
202 HB ILE 30 HB ILE 30 7.561 5.469 -2.378
203 1HG1 ILE 30 2HG1 ILE 30 8.634 7.972 -3.704
204 2HG1 ILE 30 1HG1 ILE 30 8.414 7.771 -1.969
205 1HG2 ILE 30 1HG2 ILE 30 7.962 6.268 -5.251
206 2HG2 ILE 30 2HG2 ILE 30 6.872 4.970 -4.765
207 3HG2 ILE 30 3HG2 ILE 30 8.595 4.853 -4.411
208 1HD1 ILE 30 1HD1 ILE 30 10.642 7.315 -2.200
209 2HD1 ILE 30 2HD1 ILE 30 10.436 6.554 -3.778
210 3HD1 ILE 30 3HD1 ILE 30 9.957 5.694 -2.314
211 H SER 31 H SER 31 4.745 6.415 -5.191
212 HA SER 31 HA SER 31 2.756 4.764 -3.974
213 1HB SER 31 2HB SER 31 2.305 6.188 -5.969
214 2HB SER 31 1HB SER 31 3.363 5.142 -6.917
215 HG SER 31 HG SER 31 0.877 4.792 -6.707
Start of MODEL 10
1 1H CYS 1 H CYS 1 2.807 2.857 -3.839
2 HA CYS 1 HA CYS 1 5.178 1.314 -4.529
3 1HB CYS 1 2HB CYS 1 2.791 0.661 -2.791
4 2HB CYS 1 1HB CYS 1 4.169 -0.409 -3.026
5 H GLY 2 H GLY 2 2.468 2.028 -6.117
6 1HA GLY 2 2HA GLY 2 1.406 1.108 -7.937
7 2HA GLY 2 1HA GLY 2 2.729 -0.045 -8.013
8 H GLU 3 H GLU 3 0.471 0.408 -5.360
9 HA GLU 3 HA GLU 3 -1.018 -1.979 -6.038
10 1HB GLU 3 2HB GLU 3 0.961 -2.829 -4.793
11 2HB GLU 3 1HB GLU 3 0.548 -1.780 -3.449
12 1HG GLU 3 2HG GLU 3 -1.462 -3.000 -3.025
13 2HG GLU 3 1HG GLU 3 -1.252 -3.952 -4.494
14 H SER 4 H SER 4 -2.969 -2.161 -4.685
15 HA SER 4 HA SER 4 -3.549 0.270 -3.156
16 1HB SER 4 2HB SER 4 -5.808 0.365 -4.231
17 2HB SER 4 1HB SER 4 -4.475 0.714 -5.330
18 HG SER 4 HG SER 4 -5.082 -1.939 -5.256
19 H CYS 5 H CYS 5 -4.649 -0.018 -1.360
20 HA CYS 5 HA CYS 5 -5.451 -2.721 -0.603
21 1HB CYS 5 2HB CYS 5 -5.722 -1.496 1.682
22 2HB CYS 5 1HB CYS 5 -4.101 -1.811 1.076
23 H ALA 6 H ALA 6 -6.996 -1.374 -2.486
24 HA ALA 6 HA ALA 6 -9.223 -0.012 -1.469
25 1HB ALA 6 1HB ALA 6 -10.230 -0.335 -3.614
26 2HB ALA 6 2HB ALA 6 -9.145 -1.680 -3.969
27 3HB ALA 6 3HB ALA 6 -8.507 -0.040 -3.845
28 H MET 7 H MET 7 -8.645 -3.425 -1.937
29 HA MET 7 HA MET 7 -11.368 -4.104 -1.181
30 1HB MET 7 2HB MET 7 -9.859 -5.301 -2.947
31 2HB MET 7 1HB MET 7 -9.165 -6.106 -1.550
32 1HG MET 7 2HG MET 7 -12.111 -6.116 -2.133
33 2HG MET 7 1HG MET 7 -11.004 -7.332 -2.764
34 1HE MET 7 1HE MET 7 -12.431 -9.592 -1.025
35 2HE MET 7 2HE MET 7 -13.295 -8.177 -1.626
36 3HE MET 7 3HE MET 7 -13.411 -8.624 0.076
37 H ILE 8 H ILE 8 -8.123 -4.899 -0.040
38 HA ILE 8 HA ILE 8 -9.201 -5.071 2.689
39 HB ILE 8 HB ILE 8 -7.463 -6.704 3.264
40 1HG1 ILE 8 2HG1 ILE 8 -5.876 -6.021 1.402
41 2HG1 ILE 8 1HG1 ILE 8 -6.021 -7.748 1.697
42 1HG2 ILE 8 1HG2 ILE 8 -9.306 -7.932 2.922
43 2HG2 ILE 8 2HG2 ILE 8 -8.396 -8.537 1.538
44 3HG2 ILE 8 3HG2 ILE 8 -9.591 -7.259 1.315
45 1HD1 ILE 8 1HD1 ILE 8 -6.056 -6.678 -0.737
46 2HD1 ILE 8 2HD1 ILE 8 -7.782 -6.598 -0.380
47 3HD1 ILE 8 3HD1 ILE 8 -6.941 -8.148 -0.328
48 H SER 9 H SER 9 -8.095 -3.989 4.260
49 HA SER 9 HA SER 9 -6.271 -1.954 3.401
50 1HB SER 9 2HB SER 9 -8.002 -1.587 5.147
51 2HB SER 9 1HB SER 9 -7.136 -2.690 6.211
52 HG SER 9 HG SER 9 -5.308 -1.227 5.955
53 H PHE 10 H PHE 10 -5.082 -4.256 2.775
54 HA PHE 10 HA PHE 10 -2.661 -4.167 4.354
55 1HB PHE 10 2HB PHE 10 -3.954 -5.925 5.473
56 2HB PHE 10 1HB PHE 10 -4.170 -6.761 3.944
57 HD1 PHE 10 1HD PHE 10 -1.217 -5.242 5.655
58 HD2 PHE 10 2HD PHE 10 -2.975 -8.711 3.927
59 HE1 PHE 10 1HE PHE 10 0.861 -6.494 6.063
60 HE2 PHE 10 2HE PHE 10 -0.902 -9.969 4.332
61 HZ PHE 10 HZ PHE 10 1.019 -8.862 5.404
62 H CYS 11 H CYS 11 -1.187 -3.827 2.869
63 HA CYS 11 HA CYS 11 -1.614 -4.841 0.152
64 1HB CYS 11 2HB CYS 11 0.610 -3.019 1.036
65 2HB CYS 11 1HB CYS 11 -0.022 -3.253 -0.582
66 H PHE 12 H PHE 12 0.042 -5.963 -1.002
67 HA PHE 12 HA PHE 12 1.440 -7.876 0.600
68 1HB PHE 12 2HB PHE 12 1.458 -7.291 -2.366
69 2HB PHE 12 1HB PHE 12 2.444 -8.556 -1.641
70 HD1 PHE 12 1HD PHE 12 1.603 -10.628 -2.098
71 HD2 PHE 12 2HD PHE 12 -1.117 -7.476 -1.216
72 HE1 PHE 12 1HE PHE 12 -0.277 -12.204 -2.278
73 HE2 PHE 12 2HE PHE 12 -3.001 -9.047 -1.393
74 HZ PHE 12 HZ PHE 12 -2.582 -11.415 -1.924
75 H THR 13 H THR 13 2.318 -5.009 -1.270
76 HA THR 13 HA THR 13 5.126 -5.280 -0.701
77 HB THR 13 HB THR 13 4.312 -4.156 -2.761
78 HG1 THR 13 1HG THR 13 5.671 -2.105 -1.458
79 1HG2 THR 13 1HG2 THR 13 2.421 -2.969 -1.521
80 2HG2 THR 13 2HG2 THR 13 3.284 -2.045 -2.750
81 3HG2 THR 13 3HG2 THR 13 3.638 -1.786 -1.043
82 H GLU 14 H GLU 14 2.506 -4.303 1.079
83 HA GLU 14 HA GLU 14 3.634 -2.165 2.588
84 1HB GLU 14 2HB GLU 14 1.260 -2.399 2.484
85 2HB GLU 14 1HB GLU 14 1.327 -4.048 3.075
86 1HG GLU 14 2HG GLU 14 1.799 -3.337 5.264
87 2HG GLU 14 1HG GLU 14 2.178 -1.696 4.729
88 H VAL 15 H VAL 15 3.612 -5.636 2.836
89 HA VAL 15 HA VAL 15 4.532 -5.958 5.457
90 HB VAL 15 HB VAL 15 5.217 -7.748 3.124
91 1HG1 VAL 15 1HG1 VAL 15 4.710 -8.549 5.974
92 2HG1 VAL 15 2HG1 VAL 15 6.313 -8.100 5.392
93 3HG1 VAL 15 3HG1 VAL 15 5.476 -9.482 4.687
94 1HG2 VAL 15 1HG2 VAL 15 2.722 -7.759 4.816
95 2HG2 VAL 15 2HG2 VAL 15 3.145 -8.946 3.582
96 3HG2 VAL 15 3HG2 VAL 15 2.823 -7.274 3.123
97 H ILE 16 H ILE 16 6.282 -5.230 2.478
98 HA ILE 16 HA ILE 16 8.826 -5.601 3.831
99 HB ILE 16 HB ILE 16 9.886 -5.150 1.677
100 1HG1 ILE 16 2HG1 ILE 16 7.066 -4.872 0.610
101 2HG1 ILE 16 1HG1 ILE 16 8.203 -3.544 0.815
102 1HG2 ILE 16 1HG2 ILE 16 7.768 -7.079 0.941
103 2HG2 ILE 16 2HG2 ILE 16 8.653 -7.393 2.434
104 3HG2 ILE 16 3HG2 ILE 16 9.524 -7.248 0.907
105 1HD1 ILE 16 1HD1 ILE 16 9.452 -5.580 -0.729
106 2HD1 ILE 16 2HD1 ILE 16 9.035 -3.931 -1.193
107 3HD1 ILE 16 3HD1 ILE 16 7.864 -5.231 -1.414
108 H GLY 17 H GLY 17 6.700 -3.080 3.780
109 1HA GLY 17 2HA GLY 17 8.137 -1.240 5.048
110 2HA GLY 17 1HA GLY 17 8.756 -1.032 3.422
111 H CYS 18 H CYS 18 6.233 -1.444 2.070
112 HA CYS 18 HA CYS 18 5.295 1.211 2.105
113 1HB CYS 18 2HB CYS 18 4.029 -1.274 0.951
114 2HB CYS 18 1HB CYS 18 3.455 0.360 0.648
115 H SER 19 H SER 19 2.904 1.762 2.354
116 HA SER 19 HA SER 19 1.587 0.314 4.510
117 1HB SER 19 2HB SER 19 2.209 3.270 4.734
118 2HB SER 19 1HB SER 19 1.361 2.278 5.921
119 HG SER 19 HG SER 19 3.599 1.038 5.543
120 H CYS 20 H CYS 20 -0.591 0.448 4.431
121 HA CYS 20 HA CYS 20 -1.818 1.407 2.057
122 1HB CYS 20 2HB CYS 20 -2.740 -0.499 3.232
123 2HB CYS 20 1HB CYS 20 -2.999 0.466 4.681
124 H LYS 21 H LYS 21 -2.780 3.312 1.594
125 HA LYS 21 HA LYS 21 -3.566 5.114 3.733
126 1HB LYS 21 2HB LYS 21 -1.157 5.601 3.287
127 2HB LYS 21 1HB LYS 21 -1.572 5.960 1.619
128 1HG LYS 21 2HG LYS 21 -2.953 7.824 2.342
129 2HG LYS 21 1HG LYS 21 -2.595 7.447 4.029
130 1HD LYS 21 2HD LYS 21 -0.206 7.841 3.589
131 2HD LYS 21 1HD LYS 21 -0.595 8.262 1.921
132 1HE LYS 21 2HE LYS 21 -1.954 10.131 2.704
133 2HE LYS 21 1HE LYS 21 -1.593 9.702 4.375
134 1HZ LYS 21 1HZ LYS 21 -0.214 11.511 3.044
135 2HZ LYS 21 2HZ LYS 21 0.683 10.146 2.607
136 3HZ LYS 21 3HZ LYS 21 0.489 10.541 4.240
137 H ASN 22 H ASN 22 -5.512 5.763 3.202
138 HA ASN 22 HA ASN 22 -7.416 6.079 2.034
139 1HB ASN 22 2HB ASN 22 -7.346 7.908 0.380
140 2HB ASN 22 1HB ASN 22 -6.506 8.295 1.870
141 1HD2 ASN 22 1HD2 ASN 22 -4.690 9.335 1.604
142 2HD2 ASN 22 2HD2 ASN 22 -3.654 9.258 0.226
143 H LYS 23 H LYS 23 -6.577 3.671 1.384
144 HA LYS 23 HA LYS 23 -7.184 2.013 -0.036
145 1HB LYS 23 2HB LYS 23 -9.059 2.974 -0.937
146 2HB LYS 23 1HB LYS 23 -8.189 4.364 -1.564
147 1HG LYS 23 2HG LYS 23 -7.246 2.897 -3.332
148 2HG LYS 23 1HG LYS 23 -8.268 1.591 -2.730
149 1HD LYS 23 2HD LYS 23 -10.255 2.802 -3.264
150 2HD LYS 23 1HD LYS 23 -9.334 4.264 -3.624
151 1HE LYS 23 2HE LYS 23 -9.183 1.668 -5.156
152 2HE LYS 23 1HE LYS 23 -10.069 3.106 -5.663
153 1HZ LYS 23 1HZ LYS 23 -7.558 2.569 -6.388
154 2HZ LYS 23 2HZ LYS 23 -7.274 3.533 -5.028
155 3HZ LYS 23 3HZ LYS 23 -8.198 4.134 -6.311
156 H VAL 24 H VAL 24 -4.766 4.323 -0.830
157 HA VAL 24 HA VAL 24 -3.684 2.401 -2.784
158 HB VAL 24 HB VAL 24 -4.088 4.672 -3.686
159 1HG1 VAL 24 1HG1 VAL 24 -1.717 5.753 -2.283
160 2HG1 VAL 24 2HG1 VAL 24 -3.236 5.690 -1.389
161 3HG1 VAL 24 3HG1 VAL 24 -3.143 6.581 -2.909
162 1HG2 VAL 24 1HG2 VAL 24 -1.400 4.869 -4.232
163 2HG2 VAL 24 2HG2 VAL 24 -2.569 3.873 -5.098
164 3HG2 VAL 24 3HG2 VAL 24 -1.607 3.173 -3.797
165 H CYS 25 H CYS 25 -1.702 1.532 -2.527
166 HA CYS 25 HA CYS 25 -0.542 1.714 0.117
167 1HB CYS 25 2HB CYS 25 0.442 0.088 -2.230
168 2HB CYS 25 1HB CYS 25 0.743 -0.206 -0.519
169 H TYR 26 H TYR 26 0.909 3.205 0.605
170 HA TYR 26 HA TYR 26 2.781 4.104 -1.490
171 1HB TYR 26 2HB TYR 26 1.162 5.648 0.463
172 2HB TYR 26 1HB TYR 26 2.783 6.229 0.133
173 HD1 TYR 26 1HD TYR 26 1.804 8.309 -0.736
174 HD2 TYR 26 2HD TYR 26 0.991 4.555 -2.560
175 HE1 TYR 26 1HE TYR 26 1.005 9.468 -2.751
176 HE2 TYR 26 2HE TYR 26 0.190 5.704 -4.578
177 HH TYR 26 HH TYR 26 -0.824 8.539 -4.802
178 H LEU 27 H LEU 27 4.803 4.862 -0.782
179 HA LEU 27 HA LEU 27 5.710 3.978 1.867
180 1HB LEU 27 2HB LEU 27 6.350 2.207 0.320
181 2HB LEU 27 1HB LEU 27 7.041 3.378 -0.782
182 HG LEU 27 HG LEU 27 8.793 3.904 0.847
183 1HD1 LEU 27 1HD1 LEU 27 7.558 1.728 2.527
184 2HD1 LEU 27 2HD1 LEU 27 7.515 3.455 2.887
185 3HD1 LEU 27 3HD1 LEU 27 9.055 2.596 2.873
186 1HD2 LEU 27 1HD2 LEU 27 10.095 2.119 0.305
187 2HD2 LEU 27 2HD2 LEU 27 8.747 1.828 -0.797
188 3HD2 LEU 27 3HD2 LEU 27 8.851 0.941 0.723
189 H ASN 28 H ASN 28 6.092 5.953 2.704
190 HA ASN 28 HA ASN 28 6.958 8.036 3.015
191 1HB ASN 28 2HB ASN 28 9.101 6.735 2.642
192 2HB ASN 28 1HB ASN 28 9.048 7.262 0.963
193 1HD2 ASN 28 1HD2 ASN 28 10.344 8.900 0.585
194 2HD2 ASN 28 2HD2 ASN 28 10.712 10.186 1.677
195 H SER 29 H SER 29 4.857 7.841 1.335
196 HA SER 29 HA SER 29 3.586 9.107 -0.035
197 1HB SER 29 2HB SER 29 6.032 10.856 -0.358
198 2HB SER 29 1HB SER 29 4.392 11.267 -0.862
199 HG SER 29 HG SER 29 5.499 11.623 1.510
200 H ILE 30 H ILE 30 6.110 7.270 -0.985
201 HA ILE 30 HA ILE 30 5.928 7.843 -3.834
202 HB ILE 30 HB ILE 30 7.486 5.686 -2.387
203 1HG1 ILE 30 2HG1 ILE 30 8.279 7.919 -1.787
204 2HG1 ILE 30 1HG1 ILE 30 9.454 7.113 -2.819
205 1HG2 ILE 30 1HG2 ILE 30 6.805 5.544 -4.951
206 2HG2 ILE 30 2HG2 ILE 30 8.379 5.009 -4.366
207 3HG2 ILE 30 3HG2 ILE 30 8.211 6.596 -5.116
208 1HD1 ILE 30 1HD1 ILE 30 7.670 8.611 -4.456
209 2HD1 ILE 30 2HD1 ILE 30 9.407 8.813 -4.226
210 3HD1 ILE 30 3HD1 ILE 30 8.274 9.643 -3.159
211 H SER 31 H SER 31 4.799 6.624 -5.279
212 HA SER 31 HA SER 31 2.722 4.936 -4.354
213 1HB SER 31 2HB SER 31 2.402 4.526 -6.839
214 2HB SER 31 1HB SER 31 2.348 6.216 -6.337
215 HG SER 31 HG SER 31 4.743 5.001 -7.220
Start of MODEL 11
1 1H CYS 1 H CYS 1 2.712 2.719 -3.839
2 HA CYS 1 HA CYS 1 5.073 1.248 -4.690
3 1HB CYS 1 2HB CYS 1 2.760 0.493 -2.895
4 2HB CYS 1 1HB CYS 1 4.145 -0.543 -3.210
5 H GLY 2 H GLY 2 2.322 1.991 -6.174
6 1HA GLY 2 2HA GLY 2 1.209 1.108 -7.987
7 2HA GLY 2 1HA GLY 2 2.517 -0.060 -8.112
8 H GLU 3 H GLU 3 0.417 0.380 -5.350
9 HA GLU 3 HA GLU 3 -1.125 -2.002 -5.974
10 1HB GLU 3 2HB GLU 3 0.868 -2.826 -4.745
11 2HB GLU 3 1HB GLU 3 0.494 -1.729 -3.425
12 1HG GLU 3 2HG GLU 3 -1.587 -2.909 -3.008
13 2HG GLU 3 1HG GLU 3 -1.262 -3.987 -4.362
14 H SER 4 H SER 4 -3.079 -2.109 -4.686
15 HA SER 4 HA SER 4 -3.606 0.306 -3.116
16 1HB SER 4 2HB SER 4 -5.849 0.486 -4.212
17 2HB SER 4 1HB SER 4 -4.495 0.811 -5.293
18 HG SER 4 HG SER 4 -5.176 -1.824 -5.270
19 H CYS 5 H CYS 5 -4.688 0.006 -1.321
20 HA CYS 5 HA CYS 5 -5.578 -2.681 -0.618
21 1HB CYS 5 2HB CYS 5 -5.873 -1.461 1.674
22 2HB CYS 5 1HB CYS 5 -4.250 -1.829 1.103
23 H ALA 6 H ALA 6 -7.058 -1.203 -2.508
24 HA ALA 6 HA ALA 6 -9.299 0.121 -1.454
25 1HB ALA 6 1HB ALA 6 -9.192 0.612 -3.643
26 2HB ALA 6 2HB ALA 6 -10.233 -0.801 -3.808
27 3HB ALA 6 3HB ALA 6 -8.495 -0.952 -4.066
28 H MET 7 H MET 7 -8.667 -3.242 -2.046
29 HA MET 7 HA MET 7 -11.419 -4.014 -1.531
30 1HB MET 7 2HB MET 7 -9.899 -5.164 -3.207
31 2HB MET 7 1HB MET 7 -9.027 -5.822 -1.839
32 1HG MET 7 2HG MET 7 -10.502 -7.509 -2.534
33 2HG MET 7 1HG MET 7 -11.202 -6.827 -1.070
34 1HE MET 7 1HE MET 7 -12.705 -4.823 -1.161
35 2HE MET 7 2HE MET 7 -14.113 -5.877 -1.283
36 3HE MET 7 3HE MET 7 -13.934 -4.514 -2.386
37 H ILE 8 H ILE 8 -8.254 -4.666 -0.158
38 HA ILE 8 HA ILE 8 -9.491 -4.928 2.494
39 HB ILE 8 HB ILE 8 -7.790 -6.678 3.045
40 1HG1 ILE 8 2HG1 ILE 8 -7.400 -6.791 0.044
41 2HG1 ILE 8 1HG1 ILE 8 -6.223 -6.157 1.189
42 1HG2 ILE 8 1HG2 ILE 8 -10.252 -6.977 2.044
43 2HG2 ILE 8 2HG2 ILE 8 -9.233 -8.336 2.515
44 3HG2 ILE 8 3HG2 ILE 8 -9.335 -7.857 0.821
45 1HD1 ILE 8 1HD1 ILE 8 -7.172 -8.898 1.697
46 2HD1 ILE 8 2HD1 ILE 8 -5.555 -8.206 1.834
47 3HD1 ILE 8 3HD1 ILE 8 -6.188 -8.663 0.252
48 H SER 9 H SER 9 -8.306 -4.086 4.180
49 HA SER 9 HA SER 9 -6.353 -2.108 3.494
50 1HB SER 9 2HB SER 9 -8.064 -1.732 5.249
51 2HB SER 9 1HB SER 9 -7.327 -2.999 6.226
52 HG SER 9 HG SER 9 -5.389 -1.714 6.200
53 H PHE 10 H PHE 10 -5.233 -4.255 2.635
54 HA PHE 10 HA PHE 10 -2.921 -4.611 4.345
55 1HB PHE 10 2HB PHE 10 -4.273 -6.496 5.045
56 2HB PHE 10 1HB PHE 10 -4.589 -6.946 3.373
57 HD1 PHE 10 1HD PHE 10 -1.538 -6.170 5.393
58 HD2 PHE 10 2HD PHE 10 -3.506 -8.855 2.741
59 HE1 PHE 10 1HE PHE 10 0.441 -7.631 5.410
60 HE2 PHE 10 2HE PHE 10 -1.530 -10.322 2.754
61 HZ PHE 10 HZ PHE 10 0.446 -9.711 4.090
62 H CYS 11 H CYS 11 -1.298 -4.128 3.097
63 HA CYS 11 HA CYS 11 -1.484 -4.564 0.203
64 1HB CYS 11 2HB CYS 11 0.559 -3.023 1.808
65 2HB CYS 11 1HB CYS 11 0.437 -3.060 0.057
66 H PHE 12 H PHE 12 -0.048 -5.897 -0.887
67 HA PHE 12 HA PHE 12 1.235 -7.918 0.677
68 1HB PHE 12 2HB PHE 12 1.247 -7.311 -2.281
69 2HB PHE 12 1HB PHE 12 2.162 -8.643 -1.585
70 HD1 PHE 12 1HD PHE 12 1.181 -10.649 -2.051
71 HD2 PHE 12 2HD PHE 12 -1.314 -7.342 -1.077
72 HE1 PHE 12 1HE PHE 12 -0.798 -12.101 -2.207
73 HE2 PHE 12 2HE PHE 12 -3.297 -8.790 -1.229
74 HZ PHE 12 HZ PHE 12 -3.041 -11.173 -1.794
75 H THR 13 H THR 13 2.191 -4.945 -0.861
76 HA THR 13 HA THR 13 5.004 -5.508 -0.357
77 HB THR 13 HB THR 13 4.462 -4.563 -2.531
78 HG1 THR 13 1HG THR 13 5.715 -2.408 -1.232
79 1HG2 THR 13 1HG2 THR 13 2.487 -3.212 -1.515
80 2HG2 THR 13 2HG2 THR 13 3.371 -2.557 -2.893
81 3HG2 THR 13 3HG2 THR 13 3.706 -1.961 -1.266
82 H GLU 14 H GLU 14 2.599 -4.335 1.596
83 HA GLU 14 HA GLU 14 3.979 -2.034 2.598
84 1HB GLU 14 2HB GLU 14 2.442 -1.986 4.445
85 2HB GLU 14 1HB GLU 14 1.570 -2.238 2.950
86 1HG GLU 14 2HG GLU 14 1.275 -4.575 3.483
87 2HG GLU 14 1HG GLU 14 2.245 -4.380 4.945
88 H VAL 15 H VAL 15 4.139 -5.422 3.237
89 HA VAL 15 HA VAL 15 5.453 -5.382 5.725
90 HB VAL 15 HB VAL 15 5.846 -7.398 3.502
91 1HG1 VAL 15 1HG1 VAL 15 6.659 -7.270 6.329
92 2HG1 VAL 15 2HG1 VAL 15 7.380 -8.141 4.976
93 3HG1 VAL 15 3HG1 VAL 15 5.969 -8.804 5.801
94 1HG2 VAL 15 1HG2 VAL 15 3.846 -7.601 5.737
95 2HG2 VAL 15 2HG2 VAL 15 3.975 -8.595 4.285
96 3HG2 VAL 15 3HG2 VAL 15 3.442 -6.918 4.161
97 H ILE 16 H ILE 16 6.538 -4.868 2.460
98 HA ILE 16 HA ILE 16 9.329 -5.056 2.975
99 HB ILE 16 HB ILE 16 7.916 -3.692 0.684
100 1HG1 ILE 16 2HG1 ILE 16 7.279 -6.050 0.856
101 2HG1 ILE 16 1HG1 ILE 16 8.300 -5.785 -0.553
102 1HG2 ILE 16 1HG2 ILE 16 10.522 -4.840 0.131
103 2HG2 ILE 16 2HG2 ILE 16 10.590 -3.580 1.363
104 3HG2 ILE 16 3HG2 ILE 16 9.898 -3.228 -0.219
105 1HD1 ILE 16 1HD1 ILE 16 8.631 -7.693 1.444
106 2HD1 ILE 16 2HD1 ILE 16 9.892 -6.494 1.735
107 3HD1 ILE 16 3HD1 ILE 16 9.768 -7.280 0.161
108 H GLY 17 H GLY 17 6.982 -2.519 3.094
109 1HA GLY 17 2HA GLY 17 8.217 -0.831 4.810
110 2HA GLY 17 1HA GLY 17 8.934 -0.396 3.267
111 H CYS 18 H CYS 18 6.270 -1.193 2.013
112 HA CYS 18 HA CYS 18 5.189 1.402 1.824
113 1HB CYS 18 2HB CYS 18 3.989 -1.263 1.043
114 2HB CYS 18 1HB CYS 18 3.376 0.304 0.538
115 H SER 19 H SER 19 2.795 1.831 2.200
116 HA SER 19 HA SER 19 1.645 0.493 4.506
117 1HB SER 19 2HB SER 19 2.170 3.477 4.555
118 2HB SER 19 1HB SER 19 1.430 2.513 5.832
119 HG SER 19 HG SER 19 3.711 1.359 5.390
120 H CYS 20 H CYS 20 -0.555 0.500 4.399
121 HA CYS 20 HA CYS 20 -1.822 1.435 2.042
122 1HB CYS 20 2HB CYS 20 -2.713 -0.508 3.144
123 2HB CYS 20 1HB CYS 20 -2.945 0.375 4.645
124 H LYS 21 H LYS 21 -2.670 3.370 1.577
125 HA LYS 21 HA LYS 21 -3.677 5.088 3.688
126 1HB LYS 21 2HB LYS 21 -1.161 5.506 3.396
127 2HB LYS 21 1HB LYS 21 -1.571 6.173 1.823
128 1HG LYS 21 2HG LYS 21 -2.935 7.874 2.854
129 2HG LYS 21 1HG LYS 21 -2.657 7.170 4.448
130 1HD LYS 21 2HD LYS 21 -0.575 8.395 2.637
131 2HD LYS 21 1HD LYS 21 -1.217 9.097 4.122
132 1HE LYS 21 2HE LYS 21 0.374 6.542 3.901
133 2HE LYS 21 1HE LYS 21 0.971 8.088 4.501
134 1HZ LYS 21 1HZ LYS 21 0.453 6.946 6.421
135 2HZ LYS 21 2HZ LYS 21 -0.927 6.220 5.765
136 3HZ LYS 21 3HZ LYS 21 -0.950 7.859 6.179
137 H ASN 22 H ASN 22 -5.441 6.099 2.977
138 HA ASN 22 HA ASN 22 -7.191 6.586 1.640
139 1HB ASN 22 2HB ASN 22 -6.762 8.201 -0.154
140 2HB ASN 22 1HB ASN 22 -5.884 8.602 1.311
141 1HD2 ASN 22 1HD2 ASN 22 -3.903 9.276 0.997
142 2HD2 ASN 22 2HD2 ASN 22 -2.883 8.886 -0.339
143 H LYS 23 H LYS 23 -6.502 3.983 1.296
144 HA LYS 23 HA LYS 23 -7.169 2.236 0.019
145 1HB LYS 23 2HB LYS 23 -9.004 3.104 -0.987
146 2HB LYS 23 1HB LYS 23 -8.154 4.525 -1.568
147 1HG LYS 23 2HG LYS 23 -7.131 3.075 -3.335
148 2HG LYS 23 1HG LYS 23 -8.215 1.786 -2.805
149 1HD LYS 23 2HD LYS 23 -10.134 3.004 -3.437
150 2HD LYS 23 1HD LYS 23 -9.220 4.505 -3.604
151 1HE LYS 23 2HE LYS 23 -8.917 2.058 -5.342
152 2HE LYS 23 1HE LYS 23 -9.784 3.529 -5.783
153 1HZ LYS 23 1HZ LYS 23 -7.880 4.355 -6.514
154 2HZ LYS 23 2HZ LYS 23 -7.033 2.981 -6.008
155 3HZ LYS 23 3HZ LYS 23 -7.238 4.285 -4.948
156 H VAL 24 H VAL 24 -4.638 4.319 -0.861
157 HA VAL 24 HA VAL 24 -3.626 2.290 -2.749
158 HB VAL 24 HB VAL 24 -2.732 5.169 -2.573
159 1HG1 VAL 24 1HG1 VAL 24 -1.074 4.561 -3.913
160 2HG1 VAL 24 2HG1 VAL 24 -2.241 3.975 -5.098
161 3HG1 VAL 24 3HG1 VAL 24 -1.628 2.888 -3.853
162 1HG2 VAL 24 1HG2 VAL 24 -4.253 4.238 -4.923
163 2HG2 VAL 24 2HG2 VAL 24 -4.265 5.801 -4.107
164 3HG2 VAL 24 3HG2 VAL 24 -5.174 4.448 -3.435
165 H CYS 25 H CYS 25 -1.625 1.411 -2.450
166 HA CYS 25 HA CYS 25 -0.494 1.662 0.201
167 1HB CYS 25 2HB CYS 25 0.451 -0.011 -2.138
168 2HB CYS 25 1HB CYS 25 0.886 -0.233 -0.446
169 H TYR 26 H TYR 26 1.051 3.101 0.701
170 HA TYR 26 HA TYR 26 2.887 3.977 -1.444
171 1HB TYR 26 2HB TYR 26 1.899 5.675 0.850
172 2HB TYR 26 1HB TYR 26 3.026 6.177 -0.394
173 HD1 TYR 26 1HD TYR 26 -0.445 5.734 0.496
174 HD2 TYR 26 2HD TYR 26 2.218 6.531 -2.720
175 HE1 TYR 26 1HE TYR 26 -2.319 6.611 -0.828
176 HE2 TYR 26 2HE TYR 26 0.350 7.409 -4.058
177 HH TYR 26 HH TYR 26 -2.968 7.457 -2.763
178 H LEU 27 H LEU 27 4.996 4.104 -0.974
179 HA LEU 27 HA LEU 27 5.876 3.244 1.698
180 1HB LEU 27 2HB LEU 27 6.500 1.912 -0.457
181 2HB LEU 27 1HB LEU 27 7.582 3.248 -0.792
182 HG LEU 27 HG LEU 27 7.724 1.612 1.743
183 1HD1 LEU 27 1HD1 LEU 27 8.290 -0.019 0.254
184 2HD1 LEU 27 2HD1 LEU 27 9.855 0.773 0.427
185 3HD1 LEU 27 3HD1 LEU 27 8.838 1.128 -0.968
186 1HD2 LEU 27 1HD2 LEU 27 10.005 3.102 0.539
187 2HD2 LEU 27 2HD2 LEU 27 9.671 2.719 2.228
188 3HD2 LEU 27 3HD2 LEU 27 8.774 4.006 1.423
189 H ASN 28 H ASN 28 6.014 5.143 2.735
190 HA ASN 28 HA ASN 28 6.729 7.216 3.346
191 1HB ASN 28 2HB ASN 28 8.983 6.149 2.926
192 2HB ASN 28 1HB ASN 28 8.942 6.846 1.309
193 1HD2 ASN 28 1HD2 ASN 28 10.125 8.599 1.162
194 2HD2 ASN 28 2HD2 ASN 28 10.345 9.792 2.389
195 H SER 29 H SER 29 4.697 7.097 1.625
196 HA SER 29 HA SER 29 3.363 8.444 0.404
197 1HB SER 29 2HB SER 29 5.725 10.323 0.234
198 2HB SER 29 1HB SER 29 4.062 10.707 -0.215
199 HG SER 29 HG SER 29 5.183 10.872 2.176
200 H ILE 30 H ILE 30 6.004 6.849 -0.761
201 HA ILE 30 HA ILE 30 5.695 7.712 -3.531
202 HB ILE 30 HB ILE 30 7.429 5.516 -2.373
203 1HG1 ILE 30 2HG1 ILE 30 8.185 8.308 -3.268
204 2HG1 ILE 30 1HG1 ILE 30 8.011 7.807 -1.590
205 1HG2 ILE 30 1HG2 ILE 30 6.651 5.708 -4.947
206 2HG2 ILE 30 2HG2 ILE 30 8.212 5.060 -4.439
207 3HG2 ILE 30 3HG2 ILE 30 8.083 6.736 -4.975
208 1HD1 ILE 30 1HD1 ILE 30 10.356 7.891 -2.766
209 2HD1 ILE 30 2HD1 ILE 30 9.878 6.287 -3.328
210 3HD1 ILE 30 3HD1 ILE 30 9.962 6.628 -1.598
211 H SER 31 H SER 31 4.462 6.675 -5.008
212 HA SER 31 HA SER 31 2.531 4.794 -4.254
213 1HB SER 31 2HB SER 31 3.521 5.316 -7.060
214 2HB SER 31 1HB SER 31 1.925 4.739 -6.577
215 HG SER 31 HG SER 31 1.581 6.760 -5.563
Start of MODEL 12
1 1H CYS 1 H CYS 1 2.798 2.892 -3.950
2 HA CYS 1 HA CYS 1 5.146 1.306 -4.627
3 1HB CYS 1 2HB CYS 1 2.663 0.487 -3.107
4 2HB CYS 1 1HB CYS 1 4.177 -0.408 -3.195
5 H GLY 2 H GLY 2 2.297 2.092 -6.089
6 1HA GLY 2 2HA GLY 2 1.273 1.282 -7.993
7 2HA GLY 2 1HA GLY 2 2.602 0.142 -8.144
8 H GLU 3 H GLU 3 0.486 0.444 -5.382
9 HA GLU 3 HA GLU 3 -1.005 -1.957 -6.093
10 1HB GLU 3 2HB GLU 3 1.128 -2.494 -4.685
11 2HB GLU 3 1HB GLU 3 0.244 -1.756 -3.358
12 1HG GLU 3 2HG GLU 3 -1.627 -3.406 -3.950
13 2HG GLU 3 1HG GLU 3 -0.393 -4.252 -4.881
14 H SER 4 H SER 4 -2.886 -2.213 -4.568
15 HA SER 4 HA SER 4 -3.509 0.227 -3.100
16 1HB SER 4 2HB SER 4 -5.741 0.395 -4.195
17 2HB SER 4 1HB SER 4 -4.399 0.707 -5.292
18 HG SER 4 HG SER 4 -4.997 -1.915 -5.286
19 H CYS 5 H CYS 5 -4.610 -0.081 -1.321
20 HA CYS 5 HA CYS 5 -5.437 -2.776 -0.587
21 1HB CYS 5 2HB CYS 5 -5.854 -1.507 1.665
22 2HB CYS 5 1HB CYS 5 -4.205 -1.853 1.167
23 H ALA 6 H ALA 6 -6.912 -1.445 -2.549
24 HA ALA 6 HA ALA 6 -9.198 -0.110 -1.658
25 1HB ALA 6 1HB ALA 6 -9.962 -1.474 -3.962
26 2HB ALA 6 2HB ALA 6 -8.229 -1.203 -4.135
27 3HB ALA 6 3HB ALA 6 -9.311 0.162 -3.857
28 H MET 7 H MET 7 -8.548 -3.520 -1.977
29 HA MET 7 HA MET 7 -11.293 -4.233 -1.334
30 1HB MET 7 2HB MET 7 -9.910 -5.532 -2.985
31 2HB MET 7 1HB MET 7 -8.908 -6.058 -1.645
32 1HG MET 7 2HG MET 7 -10.864 -7.107 -0.606
33 2HG MET 7 1HG MET 7 -11.846 -6.615 -1.983
34 1HE MET 7 1HE MET 7 -11.265 -10.490 -1.804
35 2HE MET 7 2HE MET 7 -12.414 -9.613 -2.816
36 3HE MET 7 3HE MET 7 -12.166 -9.127 -1.139
37 H ILE 8 H ILE 8 -8.120 -5.040 -0.047
38 HA ILE 8 HA ILE 8 -9.295 -5.143 2.652
39 HB ILE 8 HB ILE 8 -7.418 -6.692 3.245
40 1HG1 ILE 8 2HG1 ILE 8 -7.043 -6.865 0.244
41 2HG1 ILE 8 1HG1 ILE 8 -5.928 -6.076 1.355
42 1HG2 ILE 8 1HG2 ILE 8 -9.822 -7.312 2.428
43 2HG2 ILE 8 2HG2 ILE 8 -8.609 -8.569 2.664
44 3HG2 ILE 8 3HG2 ILE 8 -8.962 -7.977 1.040
45 1HD1 ILE 8 1HD1 ILE 8 -4.989 -8.007 1.957
46 2HD1 ILE 8 2HD1 ILE 8 -5.747 -8.653 0.500
47 3HD1 ILE 8 3HD1 ILE 8 -6.541 -8.841 2.064
48 H SER 9 H SER 9 -8.276 -4.004 4.255
49 HA SER 9 HA SER 9 -6.501 -1.914 3.435
50 1HB SER 9 2HB SER 9 -8.295 -1.616 5.138
51 2HB SER 9 1HB SER 9 -7.394 -2.660 6.233
52 HG SER 9 HG SER 9 -5.638 -1.111 5.993
53 H PHE 10 H PHE 10 -5.213 -4.176 2.861
54 HA PHE 10 HA PHE 10 -2.828 -3.954 4.473
55 1HB PHE 10 2HB PHE 10 -3.991 -5.778 5.616
56 2HB PHE 10 1HB PHE 10 -4.215 -6.622 4.088
57 HD1 PHE 10 1HD PHE 10 -2.920 -8.510 4.002
58 HD2 PHE 10 2HD PHE 10 -1.288 -4.979 5.730
59 HE1 PHE 10 1HE PHE 10 -0.773 -9.665 4.326
60 HE2 PHE 10 2HE PHE 10 0.863 -6.127 6.055
61 HZ PHE 10 HZ PHE 10 1.122 -8.474 5.353
62 H CYS 11 H CYS 11 -1.294 -3.643 3.046
63 HA CYS 11 HA CYS 11 -1.687 -4.523 0.298
64 1HB CYS 11 2HB CYS 11 0.508 -2.824 1.499
65 2HB CYS 11 1HB CYS 11 0.214 -3.081 -0.216
66 H PHE 12 H PHE 12 -0.201 -5.776 -0.845
67 HA PHE 12 HA PHE 12 1.031 -7.864 0.656
68 1HB PHE 12 2HB PHE 12 1.225 -7.093 -2.266
69 2HB PHE 12 1HB PHE 12 2.020 -8.508 -1.589
70 HD1 PHE 12 1HD PHE 12 0.970 -10.470 -2.067
71 HD2 PHE 12 2HD PHE 12 -1.406 -7.003 -1.399
72 HE1 PHE 12 1HE PHE 12 -1.067 -11.798 -2.438
73 HE2 PHE 12 2HE PHE 12 -3.447 -8.327 -1.764
74 HZ PHE 12 HZ PHE 12 -3.279 -10.728 -2.285
75 H THR 13 H THR 13 2.159 -5.001 -1.043
76 HA THR 13 HA THR 13 4.924 -5.469 -0.386
77 HB THR 13 HB THR 13 4.292 -4.319 -2.471
78 HG1 THR 13 1HG THR 13 5.593 -2.217 -1.343
79 1HG2 THR 13 1HG2 THR 13 2.948 -2.532 -2.580
80 2HG2 THR 13 2HG2 THR 13 3.756 -1.731 -1.232
81 3HG2 THR 13 3HG2 THR 13 2.501 -2.932 -0.921
82 H GLU 14 H GLU 14 2.436 -4.624 1.545
83 HA GLU 14 HA GLU 14 3.393 -2.344 2.923
84 1HB GLU 14 2HB GLU 14 1.062 -3.451 3.045
85 2HB GLU 14 1HB GLU 14 1.783 -4.528 4.229
86 1HG GLU 14 2HG GLU 14 1.715 -2.990 5.838
87 2HG GLU 14 1HG GLU 14 2.302 -1.715 4.772
88 H VAL 15 H VAL 15 3.899 -5.796 3.341
89 HA VAL 15 HA VAL 15 5.376 -5.682 5.746
90 HB VAL 15 HB VAL 15 5.629 -7.757 3.560
91 1HG1 VAL 15 1HG1 VAL 15 5.798 -8.764 6.240
92 2HG1 VAL 15 2HG1 VAL 15 6.971 -7.467 6.008
93 3HG1 VAL 15 3HG1 VAL 15 6.977 -8.865 4.932
94 1HG2 VAL 15 1HG2 VAL 15 3.807 -8.032 5.915
95 2HG2 VAL 15 2HG2 VAL 15 3.772 -8.878 4.369
96 3HG2 VAL 15 3HG2 VAL 15 3.265 -7.191 4.461
97 H ILE 16 H ILE 16 6.212 -5.166 2.415
98 HA ILE 16 HA ILE 16 9.024 -5.425 2.684
99 HB ILE 16 HB ILE 16 7.471 -3.919 0.580
100 1HG1 ILE 16 2HG1 ILE 16 6.761 -6.258 0.700
101 2HG1 ILE 16 1HG1 ILE 16 7.683 -5.968 -0.772
102 1HG2 ILE 16 1HG2 ILE 16 10.219 -3.992 1.042
103 2HG2 ILE 16 2HG2 ILE 16 9.396 -3.439 -0.419
104 3HG2 ILE 16 3HG2 ILE 16 9.946 -5.111 -0.294
105 1HD1 ILE 16 1HD1 ILE 16 9.539 -6.793 1.162
106 2HD1 ILE 16 2HD1 ILE 16 8.958 -7.692 -0.240
107 3HD1 ILE 16 3HD1 ILE 16 8.146 -7.864 1.315
108 H GLY 17 H GLY 17 6.779 -2.810 3.049
109 1HA GLY 17 2HA GLY 17 8.138 -1.232 4.761
110 2HA GLY 17 1HA GLY 17 8.853 -0.793 3.215
111 H CYS 18 H CYS 18 6.137 -1.411 1.984
112 HA CYS 18 HA CYS 18 5.178 1.267 1.989
113 1HB CYS 18 2HB CYS 18 4.023 -1.281 0.861
114 2HB CYS 18 1HB CYS 18 3.316 0.307 0.606
115 H SER 19 H SER 19 2.770 1.690 2.287
116 HA SER 19 HA SER 19 1.514 0.143 4.383
117 1HB SER 19 2HB SER 19 2.985 1.776 5.581
118 2HB SER 19 1HB SER 19 2.097 3.085 4.803
119 HG SER 19 HG SER 19 0.696 1.112 6.236
120 H CYS 20 H CYS 20 -0.686 0.369 4.413
121 HA CYS 20 HA CYS 20 -1.927 1.296 2.045
122 1HB CYS 20 2HB CYS 20 -2.866 -0.548 3.325
123 2HB CYS 20 1HB CYS 20 -3.107 0.502 4.717
124 H LYS 21 H LYS 21 -2.846 3.217 1.537
125 HA LYS 21 HA LYS 21 -3.516 5.104 3.647
126 1HB LYS 21 2HB LYS 21 -1.020 5.297 2.745
127 2HB LYS 21 1HB LYS 21 -1.814 6.158 1.432
128 1HG LYS 21 2HG LYS 21 -2.745 7.750 3.002
129 2HG LYS 21 1HG LYS 21 -2.030 6.862 4.351
130 1HD LYS 21 2HD LYS 21 0.208 7.237 3.150
131 2HD LYS 21 1HD LYS 21 -0.657 8.455 2.209
132 1HE LYS 21 2HE LYS 21 0.442 9.514 4.076
133 2HE LYS 21 1HE LYS 21 -1.304 9.571 4.313
134 1HZ LYS 21 1HZ LYS 21 -1.171 8.296 6.132
135 2HZ LYS 21 2HZ LYS 21 0.468 8.711 6.147
136 3HZ LYS 21 3HZ LYS 21 -0.027 7.249 5.456
137 H ASN 22 H ASN 22 -5.484 5.737 3.143
138 HA ASN 22 HA ASN 22 -7.402 6.068 2.002
139 1HB ASN 22 2HB ASN 22 -7.334 7.872 0.319
140 2HB ASN 22 1HB ASN 22 -6.458 8.269 1.785
141 1HD2 ASN 22 1HD2 ASN 22 -4.602 9.238 1.487
142 2HD2 ASN 22 2HD2 ASN 22 -3.603 9.128 0.083
143 H LYS 23 H LYS 23 -6.529 3.641 1.372
144 HA LYS 23 HA LYS 23 -7.156 1.954 0.008
145 1HB LYS 23 2HB LYS 23 -9.070 2.819 -0.874
146 2HB LYS 23 1HB LYS 23 -8.275 4.250 -1.506
147 1HG LYS 23 2HG LYS 23 -7.714 1.618 -2.781
148 2HG LYS 23 1HG LYS 23 -9.261 2.408 -3.091
149 1HD LYS 23 2HD LYS 23 -8.105 4.403 -3.879
150 2HD LYS 23 1HD LYS 23 -6.546 3.663 -3.513
151 1HE LYS 23 2HE LYS 23 -7.033 3.503 -5.889
152 2HE LYS 23 1HE LYS 23 -7.006 1.902 -5.152
153 1HZ LYS 23 1HZ LYS 23 -9.172 3.293 -6.432
154 2HZ LYS 23 2HZ LYS 23 -9.603 2.621 -4.941
155 3HZ LYS 23 3HZ LYS 23 -8.963 1.636 -6.158
156 H VAL 24 H VAL 24 -4.791 4.271 -0.892
157 HA VAL 24 HA VAL 24 -3.721 2.325 -2.830
158 HB VAL 24 HB VAL 24 -4.162 4.596 -3.735
159 1HG1 VAL 24 1HG1 VAL 24 -2.132 5.378 -1.682
160 2HG1 VAL 24 2HG1 VAL 24 -3.696 6.111 -2.038
161 3HG1 VAL 24 3HG1 VAL 24 -2.350 6.319 -3.157
162 1HG2 VAL 24 1HG2 VAL 24 -2.293 2.921 -4.453
163 2HG2 VAL 24 2HG2 VAL 24 -1.215 4.182 -3.853
164 3HG2 VAL 24 3HG2 VAL 24 -2.356 4.541 -5.148
165 H CYS 25 H CYS 25 -1.702 1.505 -2.616
166 HA CYS 25 HA CYS 25 -0.522 1.695 0.020
167 1HB CYS 25 2HB CYS 25 0.456 0.091 -2.345
168 2HB CYS 25 1HB CYS 25 0.824 -0.179 -0.643
169 H TYR 26 H TYR 26 1.003 3.099 0.542
170 HA TYR 26 HA TYR 26 2.913 3.975 -1.527
171 1HB TYR 26 2HB TYR 26 1.200 5.639 0.243
172 2HB TYR 26 1HB TYR 26 2.847 6.184 -0.015
173 HD1 TYR 26 1HD TYR 26 0.481 4.563 -2.406
174 HD2 TYR 26 2HD TYR 26 2.672 8.052 -1.363
175 HE1 TYR 26 1HE TYR 26 -0.171 5.602 -4.534
176 HE2 TYR 26 2HE TYR 26 2.023 9.104 -3.488
177 HH TYR 26 HH TYR 26 -0.210 8.590 -5.195
178 H LEU 27 H LEU 27 4.929 4.724 -0.737
179 HA LEU 27 HA LEU 27 5.575 4.017 2.025
180 1HB LEU 27 2HB LEU 27 7.499 2.786 1.492
181 2HB LEU 27 1HB LEU 27 6.257 2.140 0.449
182 HG LEU 27 HG LEU 27 8.277 4.167 -0.503
183 1HD1 LEU 27 1HD1 LEU 27 8.666 1.378 0.167
184 2HD1 LEU 27 2HD1 LEU 27 9.846 2.607 -0.285
185 3HD1 LEU 27 3HD1 LEU 27 8.994 1.701 -1.534
186 1HD2 LEU 27 1HD2 LEU 27 7.268 2.189 -2.373
187 2HD2 LEU 27 2HD2 LEU 27 7.342 3.946 -2.512
188 3HD2 LEU 27 3HD2 LEU 27 5.986 3.182 -1.680
189 H ASN 28 H ASN 28 6.184 5.848 2.885
190 HA ASN 28 HA ASN 28 7.076 7.923 3.203
191 1HB ASN 28 2HB ASN 28 9.174 6.545 2.846
192 2HB ASN 28 1HB ASN 28 9.163 7.094 1.173
193 1HD2 ASN 28 1HD2 ASN 28 10.492 8.709 0.819
194 2HD2 ASN 28 2HD2 ASN 28 10.902 9.961 1.935
195 H SER 29 H SER 29 4.987 7.850 1.500
196 HA SER 29 HA SER 29 3.804 9.124 0.064
197 1HB SER 29 2HB SER 29 6.258 10.892 -0.043
198 2HB SER 29 1HB SER 29 4.631 11.330 -0.569
199 HG SER 29 HG SER 29 5.648 11.595 1.831
200 H ILE 30 H ILE 30 5.825 7.020 -0.825
201 HA ILE 30 HA ILE 30 6.034 7.819 -3.651
202 HB ILE 30 HB ILE 30 7.505 5.610 -2.181
203 1HG1 ILE 30 2HG1 ILE 30 8.537 8.243 -3.271
204 2HG1 ILE 30 1HG1 ILE 30 8.218 7.915 -1.572
205 1HG2 ILE 30 1HG2 ILE 30 7.003 5.227 -4.632
206 2HG2 ILE 30 2HG2 ILE 30 8.708 5.199 -4.186
207 3HG2 ILE 30 3HG2 ILE 30 8.026 6.621 -4.974
208 1HD1 ILE 30 1HD1 ILE 30 10.383 7.389 -1.493
209 2HD1 ILE 30 2HD1 ILE 30 10.496 7.171 -3.239
210 3HD1 ILE 30 3HD1 ILE 30 9.881 5.865 -2.225
211 H SER 31 H SER 31 4.928 6.675 -5.173
212 HA SER 31 HA SER 31 2.790 4.998 -4.376
213 1HB SER 31 2HB SER 31 3.845 5.187 -7.190
214 2HB SER 31 1HB SER 31 2.176 5.013 -6.645
215 HG SER 31 HG SER 31 2.074 7.122 -6.183
Start of MODEL 13
1 1H CYS 1 H CYS 1 2.748 2.799 -3.774
2 HA CYS 1 HA CYS 1 5.157 1.378 -4.571
3 1HB CYS 1 2HB CYS 1 2.825 0.535 -2.837
4 2HB CYS 1 1HB CYS 1 4.278 -0.422 -3.098
5 H GLY 2 H GLY 2 2.485 2.071 -6.154
6 1HA GLY 2 2HA GLY 2 1.427 1.160 -7.987
7 2HA GLY 2 1HA GLY 2 2.752 0.009 -8.063
8 H GLU 3 H GLU 3 0.511 0.444 -5.401
9 HA GLU 3 HA GLU 3 -0.988 -1.947 -6.081
10 1HB GLU 3 2HB GLU 3 1.143 -2.524 -4.670
11 2HB GLU 3 1HB GLU 3 0.249 -1.800 -3.341
12 1HG GLU 3 2HG GLU 3 -1.633 -3.423 -4.016
13 2HG GLU 3 1HG GLU 3 -0.370 -4.273 -4.903
14 H SER 4 H SER 4 -2.863 -2.175 -4.558
15 HA SER 4 HA SER 4 -3.439 0.249 -3.051
16 1HB SER 4 2HB SER 4 -5.659 0.495 -4.150
17 2HB SER 4 1HB SER 4 -4.307 0.789 -5.241
18 HG SER 4 HG SER 4 -4.938 -1.809 -5.309
19 H CYS 5 H CYS 5 -4.580 -0.072 -1.292
20 HA CYS 5 HA CYS 5 -5.438 -2.772 -0.619
21 1HB CYS 5 2HB CYS 5 -5.871 -1.529 1.651
22 2HB CYS 5 1HB CYS 5 -4.221 -1.892 1.163
23 H ALA 6 H ALA 6 -6.874 -1.408 -2.578
24 HA ALA 6 HA ALA 6 -9.180 -0.085 -1.687
25 1HB ALA 6 1HB ALA 6 -10.084 -0.943 -3.976
26 2HB ALA 6 2HB ALA 6 -8.416 -1.468 -4.211
27 3HB ALA 6 3HB ALA 6 -8.771 0.235 -3.924
28 H MET 7 H MET 7 -8.460 -3.467 -1.988
29 HA MET 7 HA MET 7 -11.228 -4.256 -1.573
30 1HB MET 7 2HB MET 7 -9.648 -5.518 -3.075
31 2HB MET 7 1HB MET 7 -8.772 -6.007 -1.639
32 1HG MET 7 2HG MET 7 -10.783 -7.113 -0.789
33 2HG MET 7 1HG MET 7 -11.646 -6.649 -2.254
34 1HE MET 7 1HE MET 7 -10.960 -10.514 -2.014
35 2HE MET 7 2HE MET 7 -12.056 -9.662 -3.103
36 3HE MET 7 3HE MET 7 -11.947 -9.185 -1.408
37 H ILE 8 H ILE 8 -8.143 -4.836 0.006
38 HA ILE 8 HA ILE 8 -9.507 -4.824 2.608
39 HB ILE 8 HB ILE 8 -8.055 -6.569 3.464
40 1HG1 ILE 8 2HG1 ILE 8 -6.125 -6.087 1.899
41 2HG1 ILE 8 1HG1 ILE 8 -6.462 -7.788 2.180
42 1HG2 ILE 8 1HG2 ILE 8 -10.058 -7.466 2.729
43 2HG2 ILE 8 2HG2 ILE 8 -8.850 -8.489 1.952
44 3HG2 ILE 8 3HG2 ILE 8 -9.659 -7.226 1.028
45 1HD1 ILE 8 1HD1 ILE 8 -5.939 -7.415 -0.137
46 2HD1 ILE 8 2HD1 ILE 8 -7.205 -6.194 -0.262
47 3HD1 ILE 8 3HD1 ILE 8 -7.632 -7.882 0.018
48 H SER 9 H SER 9 -8.321 -3.912 4.302
49 HA SER 9 HA SER 9 -6.402 -1.945 3.507
50 1HB SER 9 2HB SER 9 -8.099 -1.505 5.247
51 2HB SER 9 1HB SER 9 -7.348 -2.718 6.281
52 HG SER 9 HG SER 9 -5.420 -1.415 6.181
53 H PHE 10 H PHE 10 -5.275 -4.190 2.786
54 HA PHE 10 HA PHE 10 -2.894 -4.318 4.428
55 1HB PHE 10 2HB PHE 10 -4.179 -6.142 5.377
56 2HB PHE 10 1HB PHE 10 -4.545 -6.775 3.778
57 HD1 PHE 10 1HD PHE 10 -1.449 -5.750 5.609
58 HD2 PHE 10 2HD PHE 10 -3.442 -8.716 3.299
59 HE1 PHE 10 1HE PHE 10 0.554 -7.175 5.719
60 HE2 PHE 10 2HE PHE 10 -1.444 -10.147 3.406
61 HZ PHE 10 HZ PHE 10 0.556 -9.377 4.617
62 H CYS 11 H CYS 11 -1.352 -3.912 3.034
63 HA CYS 11 HA CYS 11 -1.712 -4.611 0.217
64 1HB CYS 11 2HB CYS 11 0.422 -2.946 1.558
65 2HB CYS 11 1HB CYS 11 0.234 -3.163 -0.174
66 H PHE 12 H PHE 12 -0.184 -5.801 -0.945
67 HA PHE 12 HA PHE 12 1.085 -7.899 0.537
68 1HB PHE 12 2HB PHE 12 0.173 -8.235 -1.745
69 2HB PHE 12 1HB PHE 12 1.389 -7.135 -2.381
70 HD1 PHE 12 1HD PHE 12 2.920 -8.298 -3.628
71 HD2 PHE 12 2HD PHE 12 1.542 -9.984 0.029
72 HE1 PHE 12 1HE PHE 12 4.475 -10.183 -3.915
73 HE2 PHE 12 2HE PHE 12 3.094 -11.871 -0.251
74 HZ PHE 12 HZ PHE 12 4.565 -11.972 -2.225
75 H THR 13 H THR 13 2.110 -4.967 -1.103
76 HA THR 13 HA THR 13 4.899 -5.441 -0.567
77 HB THR 13 HB THR 13 4.178 -4.304 -2.630
78 HG1 THR 13 1HG THR 13 5.590 -2.275 -1.357
79 1HG2 THR 13 1HG2 THR 13 3.404 -2.037 -0.792
80 2HG2 THR 13 2HG2 THR 13 2.287 -3.048 -1.708
81 3HG2 THR 13 3HG2 THR 13 3.411 -1.986 -2.555
82 H GLU 14 H GLU 14 2.460 -4.348 1.447
83 HA GLU 14 HA GLU 14 3.908 -2.191 2.645
84 1HB GLU 14 2HB GLU 14 2.268 -2.089 4.352
85 2HB GLU 14 1HB GLU 14 1.441 -2.379 2.837
86 1HG GLU 14 2HG GLU 14 1.139 -4.708 3.419
87 2HG GLU 14 1HG GLU 14 2.042 -4.462 4.917
88 H VAL 15 H VAL 15 3.800 -5.635 3.178
89 HA VAL 15 HA VAL 15 5.064 -5.665 5.702
90 HB VAL 15 HB VAL 15 5.666 -7.993 5.227
91 1HG1 VAL 15 1HG1 VAL 15 2.902 -7.044 4.590
92 2HG1 VAL 15 2HG1 VAL 15 3.504 -7.847 6.039
93 3HG1 VAL 15 3HG1 VAL 15 3.288 -8.764 4.548
94 1HG2 VAL 15 1HG2 VAL 15 4.358 -7.966 2.570
95 2HG2 VAL 15 2HG2 VAL 15 5.674 -8.971 3.178
96 3HG2 VAL 15 3HG2 VAL 15 5.994 -7.314 2.667
97 H ILE 16 H ILE 16 6.208 -5.055 2.531
98 HA ILE 16 HA ILE 16 8.978 -5.584 3.065
99 HB ILE 16 HB ILE 16 7.771 -4.050 0.762
100 1HG1 ILE 16 2HG1 ILE 16 8.489 -6.988 0.916
101 2HG1 ILE 16 1HG1 ILE 16 6.848 -6.350 0.974
102 1HG2 ILE 16 1HG2 ILE 16 10.444 -4.440 1.524
103 2HG2 ILE 16 2HG2 ILE 16 9.842 -3.780 0.003
104 3HG2 ILE 16 3HG2 ILE 16 10.165 -5.507 0.148
105 1HD1 ILE 16 1HD1 ILE 16 7.073 -5.493 -1.276
106 2HD1 ILE 16 2HD1 ILE 16 7.442 -7.218 -1.233
107 3HD1 ILE 16 3HD1 ILE 16 8.749 -6.038 -1.337
108 H GLY 17 H GLY 17 6.825 -2.887 3.191
109 1HA GLY 17 2HA GLY 17 8.202 -1.325 4.940
110 2HA GLY 17 1HA GLY 17 8.891 -0.891 3.384
111 H CYS 18 H CYS 18 6.312 -1.343 2.015
112 HA CYS 18 HA CYS 18 5.324 1.283 2.077
113 1HB CYS 18 2HB CYS 18 4.074 -1.245 0.993
114 2HB CYS 18 1HB CYS 18 3.479 0.377 0.665
115 H SER 19 H SER 19 2.906 1.751 2.359
116 HA SER 19 HA SER 19 1.652 0.286 4.539
117 1HB SER 19 2HB SER 19 2.282 3.242 4.766
118 2HB SER 19 1HB SER 19 1.369 2.285 5.931
119 HG SER 19 HG SER 19 3.678 1.050 5.519
120 H CYS 20 H CYS 20 -0.535 0.336 4.402
121 HA CYS 20 HA CYS 20 -1.763 1.344 2.061
122 1HB CYS 20 2HB CYS 20 -2.685 -0.609 3.105
123 2HB CYS 20 1HB CYS 20 -2.900 0.237 4.633
124 H LYS 21 H LYS 21 -2.678 3.265 1.628
125 HA LYS 21 HA LYS 21 -3.640 4.973 3.775
126 1HB LYS 21 2HB LYS 21 -1.084 5.372 3.170
127 2HB LYS 21 1HB LYS 21 -1.777 6.255 1.819
128 1HG LYS 21 2HG LYS 21 -1.512 7.931 3.356
129 2HG LYS 21 1HG LYS 21 -3.174 7.438 3.685
130 1HD LYS 21 2HD LYS 21 -0.795 6.356 5.185
131 2HD LYS 21 1HD LYS 21 -1.718 7.761 5.717
132 1HE LYS 21 2HE LYS 21 -3.619 6.497 6.161
133 2HE LYS 21 1HE LYS 21 -3.095 5.168 5.129
134 1HZ LYS 21 1HZ LYS 21 -2.037 4.213 6.810
135 2HZ LYS 21 2HZ LYS 21 -2.833 5.296 7.839
136 3HZ LYS 21 3HZ LYS 21 -1.276 5.651 7.279
137 H ASN 22 H ASN 22 -5.476 5.904 3.115
138 HA ASN 22 HA ASN 22 -7.283 6.329 1.829
139 1HB ASN 22 2HB ASN 22 -6.955 7.983 0.040
140 2HB ASN 22 1HB ASN 22 -6.085 8.404 1.502
141 1HD2 ASN 22 1HD2 ASN 22 -4.129 9.155 1.197
142 2HD2 ASN 22 2HD2 ASN 22 -3.107 8.831 -0.154
143 H LYS 23 H LYS 23 -6.476 3.769 1.423
144 HA LYS 23 HA LYS 23 -7.067 2.004 0.151
145 1HB LYS 23 2HB LYS 23 -9.014 2.798 -0.714
146 2HB LYS 23 1HB LYS 23 -8.268 4.230 -1.400
147 1HG LYS 23 2HG LYS 23 -7.682 1.592 -2.642
148 2HG LYS 23 1HG LYS 23 -9.268 2.317 -2.903
149 1HD LYS 23 2HD LYS 23 -8.224 4.333 -3.782
150 2HD LYS 23 1HD LYS 23 -6.624 3.662 -3.463
151 1HE LYS 23 2HE LYS 23 -7.192 3.424 -5.810
152 2HE LYS 23 1HE LYS 23 -7.082 1.843 -5.041
153 1HZ LYS 23 1HZ LYS 23 -9.040 1.541 -6.072
154 2HZ LYS 23 2HZ LYS 23 -9.384 3.194 -6.179
155 3HZ LYS 23 3HZ LYS 23 -9.671 2.364 -4.735
156 H VAL 24 H VAL 24 -4.702 4.226 -0.765
157 HA VAL 24 HA VAL 24 -3.647 2.335 -2.771
158 HB VAL 24 HB VAL 24 -2.821 5.219 -2.401
159 1HG1 VAL 24 1HG1 VAL 24 -1.256 4.887 -3.959
160 2HG1 VAL 24 2HG1 VAL 24 -2.351 3.961 -4.984
161 3HG1 VAL 24 3HG1 VAL 24 -1.494 3.165 -3.664
162 1HG2 VAL 24 1HG2 VAL 24 -5.212 4.850 -3.173
163 2HG2 VAL 24 2HG2 VAL 24 -4.520 4.153 -4.639
164 3HG2 VAL 24 3HG2 VAL 24 -4.185 5.833 -4.219
165 H CYS 25 H CYS 25 -1.615 1.471 -2.510
166 HA CYS 25 HA CYS 25 -0.500 1.624 0.156
167 1HB CYS 25 2HB CYS 25 0.598 0.121 -2.223
168 2HB CYS 25 1HB CYS 25 0.896 -0.207 -0.519
169 H TYR 26 H TYR 26 0.951 3.128 0.729
170 HA TYR 26 HA TYR 26 2.707 4.236 -1.370
171 1HB TYR 26 2HB TYR 26 1.599 5.621 1.076
172 2HB TYR 26 1HB TYR 26 2.809 6.312 0.005
173 HD1 TYR 26 1HD TYR 26 -0.707 5.631 0.515
174 HD2 TYR 26 2HD TYR 26 2.183 6.948 -2.311
175 HE1 TYR 26 1HE TYR 26 -2.500 6.594 -0.858
176 HE2 TYR 26 2HE TYR 26 0.395 7.916 -3.696
177 HH TYR 26 HH TYR 26 -3.023 7.575 -2.779
178 H LEU 27 H LEU 27 4.781 4.863 -0.797
179 HA LEU 27 HA LEU 27 5.870 3.846 1.733
180 1HB LEU 27 2HB LEU 27 6.412 2.187 0.020
181 2HB LEU 27 1HB LEU 27 7.033 3.441 -1.032
182 HG LEU 27 HG LEU 27 8.870 3.867 0.536
183 1HD1 LEU 27 1HD1 LEU 27 9.258 2.294 2.396
184 2HD1 LEU 27 2HD1 LEU 27 7.664 1.596 2.108
185 3HD1 LEU 27 3HD1 LEU 27 7.810 3.277 2.621
186 1HD2 LEU 27 1HD2 LEU 27 8.605 0.954 -0.194
187 2HD2 LEU 27 2HD2 LEU 27 10.107 1.818 0.137
188 3HD2 LEU 27 3HD2 LEU 27 9.141 2.236 -1.278
189 H ASN 28 H ASN 28 6.178 5.832 2.621
190 HA ASN 28 HA ASN 28 7.012 7.917 2.980
191 1HB ASN 28 2HB ASN 28 9.172 6.664 2.560
192 2HB ASN 28 1HB ASN 28 9.095 7.226 0.893
193 1HD2 ASN 28 1HD2 ASN 28 10.362 8.893 0.540
194 2HD2 ASN 28 2HD2 ASN 28 10.720 10.160 1.656
195 H SER 29 H SER 29 4.881 7.840 1.394
196 HA SER 29 HA SER 29 3.599 9.177 0.100
197 1HB SER 29 2HB SER 29 6.093 10.812 -0.400
198 2HB SER 29 1HB SER 29 4.433 11.305 -0.739
199 HG SER 29 HG SER 29 5.801 11.485 1.556
200 H ILE 30 H ILE 30 6.144 7.353 -1.030
201 HA ILE 30 HA ILE 30 5.711 7.920 -3.851
202 HB ILE 30 HB ILE 30 7.430 5.788 -2.561
203 1HG1 ILE 30 2HG1 ILE 30 8.234 8.488 -3.677
204 2HG1 ILE 30 1HG1 ILE 30 8.100 8.110 -1.963
205 1HG2 ILE 30 1HG2 ILE 30 8.589 6.101 -4.900
206 2HG2 ILE 30 2HG2 ILE 30 6.984 6.651 -5.379
207 3HG2 ILE 30 3HG2 ILE 30 7.198 5.031 -4.716
208 1HD1 ILE 30 1HD1 ILE 30 9.990 6.778 -3.887
209 2HD1 ILE 30 2HD1 ILE 30 9.889 6.495 -2.150
210 3HD1 ILE 30 3HD1 ILE 30 10.413 8.065 -2.760
211 H SER 31 H SER 31 4.510 6.687 -5.221
212 HA SER 31 HA SER 31 2.584 4.888 -4.171
213 1HB SER 31 2HB SER 31 3.376 5.277 -7.064
214 2HB SER 31 1HB SER 31 1.840 4.661 -6.453
215 HG SER 31 HG SER 31 1.795 6.836 -5.326
Start of MODEL 14
1 1H CYS 1 H CYS 1 2.851 2.735 -3.607
2 HA CYS 1 HA CYS 1 5.208 1.257 -4.462
3 1HB CYS 1 2HB CYS 1 2.901 0.460 -2.669
4 2HB CYS 1 1HB CYS 1 4.323 -0.531 -2.982
5 H GLY 2 H GLY 2 2.464 2.056 -5.916
6 1HA GLY 2 2HA GLY 2 1.344 1.235 -7.749
7 2HA GLY 2 1HA GLY 2 2.644 0.067 -7.911
8 H GLU 3 H GLU 3 0.310 0.473 -5.279
9 HA GLU 3 HA GLU 3 -1.114 -1.925 -6.058
10 1HB GLU 3 2HB GLU 3 0.777 -2.811 -4.753
11 2HB GLU 3 1HB GLU 3 0.366 -1.744 -3.422
12 1HG GLU 3 2HG GLU 3 -1.709 -2.912 -3.063
13 2HG GLU 3 1HG GLU 3 -1.426 -3.916 -4.485
14 H SER 4 H SER 4 -3.164 -2.084 -5.016
15 HA SER 4 HA SER 4 -3.891 0.316 -3.482
16 1HB SER 4 2HB SER 4 -6.147 0.140 -4.586
17 2HB SER 4 1HB SER 4 -4.827 0.574 -5.671
18 HG SER 4 HG SER 4 -5.481 -2.132 -5.349
19 H CYS 5 H CYS 5 -4.765 -0.019 -1.590
20 HA CYS 5 HA CYS 5 -5.545 -2.711 -0.776
21 1HB CYS 5 2HB CYS 5 -5.736 -1.510 1.505
22 2HB CYS 5 1HB CYS 5 -4.129 -1.732 0.830
23 H ALA 6 H ALA 6 -7.167 -1.339 -2.616
24 HA ALA 6 HA ALA 6 -9.363 0.007 -1.549
25 1HB ALA 6 1HB ALA 6 -8.796 -1.416 -4.079
26 2HB ALA 6 2HB ALA 6 -9.315 0.247 -3.803
27 3HB ALA 6 3HB ALA 6 -10.484 -1.070 -3.703
28 H MET 7 H MET 7 -8.731 -3.403 -1.815
29 HA MET 7 HA MET 7 -11.437 -4.123 -1.049
30 1HB MET 7 2HB MET 7 -10.020 -5.444 -2.682
31 2HB MET 7 1HB MET 7 -9.056 -5.949 -1.312
32 1HG MET 7 2HG MET 7 -10.552 -7.706 -1.714
33 2HG MET 7 1HG MET 7 -11.174 -6.862 -0.298
34 1HE MET 7 1HE MET 7 -13.722 -5.907 -0.200
35 2HE MET 7 2HE MET 7 -14.308 -5.032 -1.615
36 3HE MET 7 3HE MET 7 -12.759 -4.602 -0.892
37 H ILE 8 H ILE 8 -8.198 -4.686 0.202
38 HA ILE 8 HA ILE 8 -9.287 -4.632 2.931
39 HB ILE 8 HB ILE 8 -7.583 -6.348 3.577
40 1HG1 ILE 8 2HG1 ILE 8 -7.363 -6.797 0.590
41 2HG1 ILE 8 1HG1 ILE 8 -6.117 -6.055 1.589
42 1HG2 ILE 8 1HG2 ILE 8 -8.868 -8.270 2.748
43 2HG2 ILE 8 2HG2 ILE 8 -9.667 -7.218 1.579
44 3HG2 ILE 8 3HG2 ILE 8 -9.910 -6.961 3.306
45 1HD1 ILE 8 1HD1 ILE 8 -6.634 -8.821 1.086
46 2HD1 ILE 8 2HD1 ILE 8 -6.739 -8.496 2.816
47 3HD1 ILE 8 3HD1 ILE 8 -5.277 -8.070 1.926
48 H SER 9 H SER 9 -8.018 -3.613 4.442
49 HA SER 9 HA SER 9 -6.063 -1.776 3.435
50 1HB SER 9 2HB SER 9 -7.676 -1.121 5.183
51 2HB SER 9 1HB SER 9 -6.969 -2.300 6.284
52 HG SER 9 HG SER 9 -4.987 -1.120 6.093
53 H PHE 10 H PHE 10 -5.028 -4.052 2.821
54 HA PHE 10 HA PHE 10 -2.620 -4.194 4.424
55 1HB PHE 10 2HB PHE 10 -3.950 -5.967 5.439
56 2HB PHE 10 1HB PHE 10 -4.318 -6.641 3.857
57 HD1 PHE 10 1HD PHE 10 -1.169 -5.548 5.552
58 HD2 PHE 10 2HD PHE 10 -3.277 -8.653 3.544
59 HE1 PHE 10 1HE PHE 10 0.820 -6.990 5.703
60 HE2 PHE 10 2HE PHE 10 -1.293 -10.101 3.694
61 HZ PHE 10 HZ PHE 10 0.758 -9.271 4.774
62 H CYS 11 H CYS 11 -1.085 -3.909 3.003
63 HA CYS 11 HA CYS 11 -1.564 -4.575 0.206
64 1HB CYS 11 2HB CYS 11 0.705 -3.044 1.491
65 2HB CYS 11 1HB CYS 11 0.380 -3.162 -0.233
66 H PHE 12 H PHE 12 -0.129 -5.844 -1.047
67 HA PHE 12 HA PHE 12 1.076 -8.028 0.356
68 1HB PHE 12 2HB PHE 12 0.102 -8.249 -1.927
69 2HB PHE 12 1HB PHE 12 1.379 -7.213 -2.551
70 HD1 PHE 12 1HD PHE 12 2.810 -8.442 -3.848
71 HD2 PHE 12 2HD PHE 12 1.383 -10.118 -0.204
72 HE1 PHE 12 1HE PHE 12 4.234 -10.416 -4.204
73 HE2 PHE 12 2HE PHE 12 2.808 -12.095 -0.554
74 HZ PHE 12 HZ PHE 12 4.234 -12.245 -2.554
75 H THR 13 H THR 13 2.153 -5.063 -1.173
76 HA THR 13 HA THR 13 4.955 -5.617 -0.682
77 HB THR 13 HB THR 13 4.281 -4.357 -2.689
78 HG1 THR 13 1HG THR 13 5.668 -2.441 -1.188
79 1HG2 THR 13 1HG2 THR 13 2.797 -2.706 -2.614
80 2HG2 THR 13 2HG2 THR 13 3.846 -1.781 -1.540
81 3HG2 THR 13 3HG2 THR 13 2.674 -2.915 -0.866
82 H GLU 14 H GLU 14 2.570 -4.922 1.373
83 HA GLU 14 HA GLU 14 3.493 -2.692 2.850
84 1HB GLU 14 2HB GLU 14 1.226 -3.865 2.959
85 2HB GLU 14 1HB GLU 14 2.007 -5.053 3.986
86 1HG GLU 14 2HG GLU 14 2.144 -3.648 5.752
87 2HG GLU 14 1HG GLU 14 2.280 -2.210 4.740
88 H VAL 15 H VAL 15 4.239 -6.097 2.920
89 HA VAL 15 HA VAL 15 5.626 -6.286 5.323
90 HB VAL 15 HB VAL 15 4.936 -8.230 3.999
91 1HG1 VAL 15 1HG1 VAL 15 6.428 -8.965 2.114
92 2HG1 VAL 15 2HG1 VAL 15 7.101 -7.335 2.116
93 3HG1 VAL 15 3HG1 VAL 15 5.391 -7.582 1.768
94 1HG2 VAL 15 1HG2 VAL 15 6.529 -8.708 5.669
95 2HG2 VAL 15 2HG2 VAL 15 7.849 -8.030 4.715
96 3HG2 VAL 15 3HG2 VAL 15 7.089 -9.544 4.219
97 H ILE 16 H ILE 16 6.734 -5.046 2.209
98 HA ILE 16 HA ILE 16 9.488 -5.040 3.016
99 HB ILE 16 HB ILE 16 8.617 -5.189 0.596
100 1HG1 ILE 16 2HG1 ILE 16 10.639 -4.024 -0.263
101 2HG1 ILE 16 1HG1 ILE 16 10.867 -3.301 1.326
102 1HG2 ILE 16 1HG2 ILE 16 8.933 -2.489 -0.081
103 2HG2 ILE 16 2HG2 ILE 16 7.794 -2.523 1.266
104 3HG2 ILE 16 3HG2 ILE 16 7.465 -3.463 -0.190
105 1HD1 ILE 16 1HD1 ILE 16 12.243 -5.048 1.618
106 2HD1 ILE 16 2HD1 ILE 16 11.446 -6.019 0.380
107 3HD1 ILE 16 3HD1 ILE 16 10.749 -5.906 1.995
108 H GLY 17 H GLY 17 6.846 -2.975 3.532
109 1HA GLY 17 2HA GLY 17 7.690 -1.336 5.373
110 2HA GLY 17 1HA GLY 17 8.598 -0.673 4.027
111 H CYS 18 H CYS 18 6.224 -1.368 2.237
112 HA CYS 18 HA CYS 18 5.055 1.173 2.196
113 1HB CYS 18 2HB CYS 18 3.971 -1.406 1.063
114 2HB CYS 18 1HB CYS 18 3.391 0.197 0.653
115 H SER 19 H SER 19 2.766 1.705 2.490
116 HA SER 19 HA SER 19 1.331 0.089 4.444
117 1HB SER 19 2HB SER 19 1.934 3.008 4.966
118 2HB SER 19 1HB SER 19 1.056 1.903 6.022
119 HG SER 19 HG SER 19 3.349 0.742 5.583
120 H CYS 20 H CYS 20 -0.816 0.187 4.190
121 HA CYS 20 HA CYS 20 -1.968 1.285 1.898
122 1HB CYS 20 2HB CYS 20 -3.001 -0.572 3.044
123 2HB CYS 20 1HB CYS 20 -3.229 0.394 4.497
124 H LYS 21 H LYS 21 -2.919 3.193 1.414
125 HA LYS 21 HA LYS 21 -3.681 5.046 3.512
126 1HB LYS 21 2HB LYS 21 -1.182 5.370 2.887
127 2HB LYS 21 1HB LYS 21 -1.801 6.035 1.384
128 1HG LYS 21 2HG LYS 21 -1.324 7.819 2.919
129 2HG LYS 21 1HG LYS 21 -3.066 7.710 2.668
130 1HD LYS 21 2HD LYS 21 -2.767 8.033 4.990
131 2HD LYS 21 1HD LYS 21 -3.153 6.325 4.788
132 1HE LYS 21 2HE LYS 21 -0.340 7.383 5.024
133 2HE LYS 21 1HE LYS 21 -1.290 6.837 6.402
134 1HZ LYS 21 1HZ LYS 21 -0.092 4.969 5.851
135 2HZ LYS 21 2HZ LYS 21 -0.159 5.262 4.188
136 3HZ LYS 21 3HZ LYS 21 -1.529 4.686 4.999
137 H ASN 22 H ASN 22 -5.609 5.752 2.934
138 HA ASN 22 HA ASN 22 -7.481 6.068 1.702
139 1HB ASN 22 2HB ASN 22 -7.255 7.848 -0.065
140 2HB ASN 22 1HB ASN 22 -6.651 8.277 1.526
141 1HD2 ASN 22 1HD2 ASN 22 -5.943 7.992 -1.774
142 2HD2 ASN 22 2HD2 ASN 22 -4.272 8.413 -1.696
143 H LYS 23 H LYS 23 -6.684 3.654 1.103
144 HA LYS 23 HA LYS 23 -7.203 1.982 -0.322
145 1HB LYS 23 2HB LYS 23 -9.078 3.052 -1.192
146 2HB LYS 23 1HB LYS 23 -8.132 4.292 -1.996
147 1HG LYS 23 2HG LYS 23 -7.834 1.489 -2.930
148 2HG LYS 23 1HG LYS 23 -9.337 2.334 -3.303
149 1HD LYS 23 2HD LYS 23 -6.555 3.302 -3.975
150 2HD LYS 23 1HD LYS 23 -7.689 2.564 -5.107
151 1HE LYS 23 2HE LYS 23 -9.246 4.400 -4.774
152 2HE LYS 23 1HE LYS 23 -8.164 5.125 -3.585
153 1HZ LYS 23 1HZ LYS 23 -8.075 6.061 -5.908
154 2HZ LYS 23 2HZ LYS 23 -7.330 4.618 -6.380
155 3HZ LYS 23 3HZ LYS 23 -6.590 5.616 -5.232
156 H VAL 24 H VAL 24 -4.746 4.234 -0.957
157 HA VAL 24 HA VAL 24 -3.578 2.366 -2.927
158 HB VAL 24 HB VAL 24 -2.789 5.259 -2.586
159 1HG1 VAL 24 1HG1 VAL 24 -2.312 3.685 -5.061
160 2HG1 VAL 24 2HG1 VAL 24 -1.290 3.365 -3.659
161 3HG1 VAL 24 3HG1 VAL 24 -1.362 4.987 -4.345
162 1HG2 VAL 24 1HG2 VAL 24 -4.209 5.909 -4.281
163 2HG2 VAL 24 2HG2 VAL 24 -5.198 4.724 -3.428
164 3HG2 VAL 24 3HG2 VAL 24 -4.370 4.272 -4.919
165 H CYS 25 H CYS 25 -1.644 1.453 -2.510
166 HA CYS 25 HA CYS 25 -0.564 1.694 0.149
167 1HB CYS 25 2HB CYS 25 0.517 0.146 -2.215
168 2HB CYS 25 1HB CYS 25 0.915 -0.111 -0.519
169 H TYR 26 H TYR 26 0.935 3.139 0.757
170 HA TYR 26 HA TYR 26 2.782 4.183 -1.295
171 1HB TYR 26 2HB TYR 26 1.369 5.708 0.890
172 2HB TYR 26 1HB TYR 26 2.774 6.338 0.046
173 HD1 TYR 26 1HD TYR 26 2.613 6.769 -2.427
174 HD2 TYR 26 2HD TYR 26 -0.788 5.856 -0.047
175 HE1 TYR 26 1HE TYR 26 1.152 7.728 -4.157
176 HE2 TYR 26 2HE TYR 26 -2.260 6.805 -1.769
177 HH TYR 26 HH TYR 26 -1.414 8.819 -3.999
178 H LEU 27 H LEU 27 4.811 4.852 -0.605
179 HA LEU 27 HA LEU 27 5.678 4.085 2.087
180 1HB LEU 27 2HB LEU 27 6.197 2.252 0.421
181 2HB LEU 27 1HB LEU 27 7.202 3.398 -0.435
182 HG LEU 27 HG LEU 27 8.294 1.692 1.197
183 1HD1 LEU 27 1HD1 LEU 27 8.922 4.564 0.797
184 2HD1 LEU 27 2HD1 LEU 27 9.823 3.126 0.314
185 3HD1 LEU 27 3HD1 LEU 27 9.859 3.669 1.993
186 1HD2 LEU 27 1HD2 LEU 27 7.573 1.816 3.297
187 2HD2 LEU 27 2HD2 LEU 27 6.752 3.349 3.007
188 3HD2 LEU 27 3HD2 LEU 27 8.468 3.332 3.415
189 H ASN 28 H ASN 28 6.158 6.063 2.833
190 HA ASN 28 HA ASN 28 7.046 8.148 3.035
191 1HB ASN 28 2HB ASN 28 9.132 6.617 2.611
192 2HB ASN 28 1HB ASN 28 9.183 7.427 1.049
193 1HD2 ASN 28 1HD2 ASN 28 10.654 7.452 3.835
194 2HD2 ASN 28 2HD2 ASN 28 10.985 9.133 4.043
195 H SER 29 H SER 29 4.964 8.145 1.406
196 HA SER 29 HA SER 29 3.844 9.459 -0.056
197 1HB SER 29 2HB SER 29 6.476 10.847 -0.591
198 2HB SER 29 1HB SER 29 4.865 11.450 -0.984
199 HG SER 29 HG SER 29 6.229 11.585 1.347
200 H ILE 30 H ILE 30 6.329 7.403 -0.946
201 HA ILE 30 HA ILE 30 6.014 7.767 -3.814
202 HB ILE 30 HB ILE 30 7.573 5.658 -2.303
203 1HG1 ILE 30 2HG1 ILE 30 8.428 7.900 -1.828
204 2HG1 ILE 30 1HG1 ILE 30 9.557 7.019 -2.850
205 1HG2 ILE 30 1HG2 ILE 30 8.420 6.344 -5.012
206 2HG2 ILE 30 2HG2 ILE 30 6.812 5.624 -4.936
207 3HG2 ILE 30 3HG2 ILE 30 8.196 4.766 -4.258
208 1HD1 ILE 30 1HD1 ILE 30 8.390 8.234 -4.798
209 2HD1 ILE 30 2HD1 ILE 30 9.518 9.135 -3.784
210 3HD1 ILE 30 3HD1 ILE 30 7.780 9.316 -3.547
211 H SER 31 H SER 31 4.744 6.543 -5.101
212 HA SER 31 HA SER 31 2.783 4.835 -3.931
213 1HB SER 31 2HB SER 31 2.327 6.255 -5.921
214 2HB SER 31 1HB SER 31 3.438 5.258 -6.857
215 HG SER 31 HG SER 31 0.976 4.817 -6.739
Start of MODEL 15
1 1H CYS 1 H CYS 1 2.807 2.906 -3.786
2 HA CYS 1 HA CYS 1 5.142 1.415 -4.672
3 1HB CYS 1 2HB CYS 1 2.798 0.555 -2.962
4 2HB CYS 1 1HB CYS 1 4.260 -0.387 -3.244
5 H GLY 2 H GLY 2 2.268 2.202 -6.014
6 1HA GLY 2 2HA GLY 2 1.159 1.415 -7.877
7 2HA GLY 2 1HA GLY 2 2.499 0.302 -8.109
8 H GLU 3 H GLU 3 0.334 0.532 -5.347
9 HA GLU 3 HA GLU 3 -1.069 -1.895 -6.107
10 1HB GLU 3 2HB GLU 3 0.898 -2.716 -4.862
11 2HB GLU 3 1HB GLU 3 0.496 -1.657 -3.519
12 1HG GLU 3 2HG GLU 3 -1.545 -2.887 -3.113
13 2HG GLU 3 1HG GLU 3 -1.238 -3.906 -4.519
14 H SER 4 H SER 4 -3.064 -2.130 -4.901
15 HA SER 4 HA SER 4 -3.769 0.266 -3.355
16 1HB SER 4 2HB SER 4 -6.026 0.174 -4.453
17 2HB SER 4 1HB SER 4 -4.703 0.597 -5.540
18 HG SER 4 HG SER 4 -5.312 -2.105 -5.310
19 H CYS 5 H CYS 5 -4.766 -0.062 -1.518
20 HA CYS 5 HA CYS 5 -5.530 -2.777 -0.747
21 1HB CYS 5 2HB CYS 5 -5.793 -1.563 1.543
22 2HB CYS 5 1HB CYS 5 -4.173 -1.860 0.928
23 H ALA 6 H ALA 6 -7.118 -1.428 -2.605
24 HA ALA 6 HA ALA 6 -9.329 -0.065 -1.593
25 1HB ALA 6 1HB ALA 6 -8.592 -0.328 -4.011
26 2HB ALA 6 2HB ALA 6 -10.327 -0.354 -3.694
27 3HB ALA 6 3HB ALA 6 -9.462 -1.863 -3.989
28 H MET 7 H MET 7 -8.767 -3.495 -1.939
29 HA MET 7 HA MET 7 -11.462 -4.162 -1.083
30 1HB MET 7 2HB MET 7 -10.204 -5.484 -2.820
31 2HB MET 7 1HB MET 7 -9.132 -6.025 -1.543
32 1HG MET 7 2HG MET 7 -10.768 -7.721 -1.975
33 2HG MET 7 1HG MET 7 -11.052 -7.026 -0.380
34 1HE MET 7 1HE MET 7 -13.961 -7.798 -0.310
35 2HE MET 7 2HE MET 7 -12.940 -8.786 -1.355
36 3HE MET 7 3HE MET 7 -14.475 -8.158 -1.957
37 H ILE 8 H ILE 8 -8.216 -4.998 -0.013
38 HA ILE 8 HA ILE 8 -9.212 -5.088 2.756
39 HB ILE 8 HB ILE 8 -7.309 -6.643 3.233
40 1HG1 ILE 8 2HG1 ILE 8 -7.126 -6.838 0.217
41 2HG1 ILE 8 1HG1 ILE 8 -5.940 -6.040 1.245
42 1HG2 ILE 8 1HG2 ILE 8 -9.308 -7.762 3.136
43 2HG2 ILE 8 2HG2 ILE 8 -8.405 -8.588 1.865
44 3HG2 ILE 8 3HG2 ILE 8 -9.585 -7.347 1.443
45 1HD1 ILE 8 1HD1 ILE 8 -6.455 -8.754 2.101
46 2HD1 ILE 8 2HD1 ILE 8 -4.931 -7.960 1.704
47 3HD1 ILE 8 3HD1 ILE 8 -5.913 -8.674 0.425
48 H SER 9 H SER 9 -8.161 -3.876 4.248
49 HA SER 9 HA SER 9 -6.361 -1.858 3.309
50 1HB SER 9 2HB SER 9 -8.114 -1.417 5.010
51 2HB SER 9 1HB SER 9 -7.263 -2.467 6.140
52 HG SER 9 HG SER 9 -5.450 -1.016 5.901
53 H PHE 10 H PHE 10 -5.107 -4.105 2.783
54 HA PHE 10 HA PHE 10 -2.721 -3.922 4.410
55 1HB PHE 10 2HB PHE 10 -3.926 -5.736 5.531
56 2HB PHE 10 1HB PHE 10 -4.153 -6.563 3.995
57 HD1 PHE 10 1HD PHE 10 -2.885 -8.467 3.884
58 HD2 PHE 10 2HD PHE 10 -1.218 -4.996 5.698
59 HE1 PHE 10 1HE PHE 10 -0.763 -9.666 4.220
60 HE2 PHE 10 2HE PHE 10 0.906 -6.188 6.035
61 HZ PHE 10 HZ PHE 10 1.137 -8.526 5.295
62 H CYS 11 H CYS 11 -1.163 -3.646 3.005
63 HA CYS 11 HA CYS 11 -1.549 -4.470 0.239
64 1HB CYS 11 2HB CYS 11 0.666 -2.847 1.504
65 2HB CYS 11 1HB CYS 11 0.383 -3.049 -0.218
66 H PHE 12 H PHE 12 -0.052 -5.761 -0.925
67 HA PHE 12 HA PHE 12 1.097 -7.887 0.593
68 1HB PHE 12 2HB PHE 12 0.251 -8.201 -1.716
69 2HB PHE 12 1HB PHE 12 1.531 -7.154 -2.317
70 HD1 PHE 12 1HD PHE 12 3.057 -8.382 -3.505
71 HD2 PHE 12 2HD PHE 12 1.488 -9.993 0.109
72 HE1 PHE 12 1HE PHE 12 4.542 -10.329 -3.732
73 HE2 PHE 12 2HE PHE 12 2.974 -11.941 -0.110
74 HZ PHE 12 HZ PHE 12 4.503 -12.111 -2.033
75 H THR 13 H THR 13 2.296 -5.005 -1.014
76 HA THR 13 HA THR 13 5.047 -5.573 -0.307
77 HB THR 13 HB THR 13 4.585 -4.460 -2.432
78 HG1 THR 13 1HG THR 13 5.775 -2.337 -1.122
79 1HG2 THR 13 1HG2 THR 13 2.584 -3.164 -1.312
80 2HG2 THR 13 2HG2 THR 13 3.445 -2.492 -2.696
81 3HG2 THR 13 3HG2 THR 13 3.818 -1.928 -1.068
82 H GLU 14 H GLU 14 2.552 -4.724 1.542
83 HA GLU 14 HA GLU 14 3.405 -2.414 2.925
84 1HB GLU 14 2HB GLU 14 1.124 -3.588 3.005
85 2HB GLU 14 1HB GLU 14 1.856 -4.670 4.177
86 1HG GLU 14 2HG GLU 14 2.019 -3.043 5.783
87 2HG GLU 14 1HG GLU 14 2.015 -1.731 4.604
88 H VAL 15 H VAL 15 3.944 -5.856 3.496
89 HA VAL 15 HA VAL 15 5.401 -5.595 5.891
90 HB VAL 15 HB VAL 15 6.245 -7.874 5.434
91 1HG1 VAL 15 1HG1 VAL 15 3.583 -8.527 4.761
92 2HG1 VAL 15 2HG1 VAL 15 3.530 -7.048 5.718
93 3HG1 VAL 15 3HG1 VAL 15 4.325 -8.485 6.360
94 1HG2 VAL 15 1HG2 VAL 15 4.583 -8.105 2.990
95 2HG2 VAL 15 2HG2 VAL 15 6.058 -8.958 3.443
96 3HG2 VAL 15 3HG2 VAL 15 6.147 -7.306 2.832
97 H ILE 16 H ILE 16 6.273 -5.056 2.611
98 HA ILE 16 HA ILE 16 9.098 -5.342 2.968
99 HB ILE 16 HB ILE 16 7.598 -3.987 0.724
100 1HG1 ILE 16 2HG1 ILE 16 8.662 -6.816 0.915
101 2HG1 ILE 16 1HG1 ILE 16 6.965 -6.361 1.024
102 1HG2 ILE 16 1HG2 ILE 16 9.710 -3.252 0.322
103 2HG2 ILE 16 2HG2 ILE 16 9.849 -4.842 -0.428
104 3HG2 ILE 16 3HG2 ILE 16 10.460 -4.582 1.206
105 1HD1 ILE 16 1HD1 ILE 16 7.723 -5.230 -1.347
106 2HD1 ILE 16 2HD1 ILE 16 6.910 -6.786 -1.160
107 3HD1 ILE 16 3HD1 ILE 16 8.666 -6.719 -1.311
108 H GLY 17 H GLY 17 6.785 -2.776 3.152
109 1HA GLY 17 2HA GLY 17 8.096 -1.094 4.815
110 2HA GLY 17 1HA GLY 17 8.775 -0.681 3.248
111 H CYS 18 H CYS 18 6.153 -1.365 1.967
112 HA CYS 18 HA CYS 18 5.064 1.253 1.978
113 1HB CYS 18 2HB CYS 18 3.945 -1.316 0.845
114 2HB CYS 18 1HB CYS 18 3.334 0.294 0.492
115 H SER 19 H SER 19 2.679 1.635 2.295
116 HA SER 19 HA SER 19 1.410 -0.005 4.318
117 1HB SER 19 2HB SER 19 2.868 1.592 5.587
118 2HB SER 19 1HB SER 19 1.977 2.925 4.853
119 HG SER 19 HG SER 19 0.813 0.872 6.435
120 H CYS 20 H CYS 20 -0.809 0.209 4.300
121 HA CYS 20 HA CYS 20 -2.006 1.188 1.957
122 1HB CYS 20 2HB CYS 20 -3.001 -0.623 3.250
123 2HB CYS 20 1HB CYS 20 -3.253 0.457 4.617
124 H LYS 21 H LYS 21 -2.687 3.160 1.399
125 HA LYS 21 HA LYS 21 -3.343 5.088 3.497
126 1HB LYS 21 2HB LYS 21 -0.939 5.365 2.748
127 2HB LYS 21 1HB LYS 21 -1.557 5.767 1.153
128 1HG LYS 21 2HG LYS 21 -1.013 7.779 2.346
129 2HG LYS 21 1HG LYS 21 -2.762 7.678 2.129
130 1HD LYS 21 2HD LYS 21 -3.003 6.855 4.417
131 2HD LYS 21 1HD LYS 21 -1.252 6.934 4.634
132 1HE LYS 21 2HE LYS 21 -1.332 9.357 4.241
133 2HE LYS 21 1HE LYS 21 -3.083 9.264 4.066
134 1HZ LYS 21 1HZ LYS 21 -3.313 9.357 6.252
135 2HZ LYS 21 2HZ LYS 21 -1.648 9.610 6.403
136 3HZ LYS 21 3HZ LYS 21 -2.274 8.041 6.484
137 H ASN 22 H ASN 22 -5.367 5.564 3.109
138 HA ASN 22 HA ASN 22 -7.350 5.830 2.065
139 1HB ASN 22 2HB ASN 22 -7.342 7.663 0.288
140 2HB ASN 22 1HB ASN 22 -6.777 8.086 1.894
141 1HD2 ASN 22 1HD2 ASN 22 -6.007 7.866 -1.424
142 2HD2 ASN 22 2HD2 ASN 22 -4.397 8.482 -1.323
143 H LYS 23 H LYS 23 -6.510 3.501 1.318
144 HA LYS 23 HA LYS 23 -7.097 1.854 -0.114
145 1HB LYS 23 2HB LYS 23 -9.050 2.902 -0.834
146 2HB LYS 23 1HB LYS 23 -8.185 4.176 -1.673
147 1HG LYS 23 2HG LYS 23 -7.872 1.405 -2.681
148 2HG LYS 23 1HG LYS 23 -9.426 2.199 -2.928
149 1HD LYS 23 2HD LYS 23 -6.739 3.285 -3.777
150 2HD LYS 23 1HD LYS 23 -7.924 2.526 -4.840
151 1HE LYS 23 2HE LYS 23 -9.525 4.296 -4.330
152 2HE LYS 23 1HE LYS 23 -8.361 5.045 -3.237
153 1HZ LYS 23 1HZ LYS 23 -8.191 4.796 -6.183
154 2HZ LYS 23 2HZ LYS 23 -6.855 5.206 -5.229
155 3HZ LYS 23 3HZ LYS 23 -8.216 6.210 -5.255
156 H VAL 24 H VAL 24 -4.753 4.198 -0.846
157 HA VAL 24 HA VAL 24 -3.656 2.401 -2.918
158 HB VAL 24 HB VAL 24 -2.883 5.295 -2.568
159 1HG1 VAL 24 1HG1 VAL 24 -2.073 3.102 -4.326
160 2HG1 VAL 24 2HG1 VAL 24 -1.226 4.592 -3.905
161 3HG1 VAL 24 3HG1 VAL 24 -2.451 4.602 -5.174
162 1HG2 VAL 24 1HG2 VAL 24 -4.361 5.010 -4.933
163 2HG2 VAL 24 2HG2 VAL 24 -4.809 5.911 -3.485
164 3HG2 VAL 24 3HG2 VAL 24 -5.309 4.230 -3.666
165 H CYS 25 H CYS 25 -1.727 1.468 -2.558
166 HA CYS 25 HA CYS 25 -0.544 1.711 0.043
167 1HB CYS 25 2HB CYS 25 0.477 0.192 -2.362
168 2HB CYS 25 1HB CYS 25 0.913 -0.079 -0.676
169 H TYR 26 H TYR 26 0.976 3.084 0.650
170 HA TYR 26 HA TYR 26 2.790 4.196 -1.393
171 1HB TYR 26 2HB TYR 26 1.307 5.592 0.802
172 2HB TYR 26 1HB TYR 26 2.857 6.216 0.269
173 HD1 TYR 26 1HD TYR 26 2.875 7.807 -1.375
174 HD2 TYR 26 2HD TYR 26 -0.422 5.128 -1.185
175 HE1 TYR 26 1HE TYR 26 1.773 9.047 -3.187
176 HE2 TYR 26 2HE TYR 26 -1.527 6.359 -3.002
177 HH TYR 26 HH TYR 26 -0.434 9.411 -4.089
178 H LEU 27 H LEU 27 4.849 4.784 -0.700
179 HA LEU 27 HA LEU 27 5.750 3.786 1.909
180 1HB LEU 27 2HB LEU 27 6.187 2.174 -0.097
181 2HB LEU 27 1HB LEU 27 7.380 3.356 -0.589
182 HG LEU 27 HG LEU 27 7.414 1.911 2.067
183 1HD1 LEU 27 1HD1 LEU 27 8.215 0.159 0.975
184 2HD1 LEU 27 2HD1 LEU 27 9.593 1.146 0.488
185 3HD1 LEU 27 3HD1 LEU 27 8.175 1.034 -0.555
186 1HD2 LEU 27 1HD2 LEU 27 9.741 3.297 0.796
187 2HD2 LEU 27 2HD2 LEU 27 9.473 2.883 2.489
188 3HD2 LEU 27 3HD2 LEU 27 8.575 4.212 1.753
189 H ASN 28 H ASN 28 6.251 5.710 2.794
190 HA ASN 28 HA ASN 28 7.188 7.756 3.137
191 1HB ASN 28 2HB ASN 28 9.244 6.296 2.674
192 2HB ASN 28 1HB ASN 28 9.246 6.995 1.061
193 1HD2 ASN 28 1HD2 ASN 28 8.102 9.349 3.075
194 2HD2 ASN 28 2HD2 ASN 28 9.582 10.163 3.418
195 H SER 29 H SER 29 5.070 7.815 1.509
196 HA SER 29 HA SER 29 3.911 9.234 0.189
197 1HB SER 29 2HB SER 29 6.523 10.711 -0.181
198 2HB SER 29 1HB SER 29 4.922 11.311 -0.619
199 HG SER 29 HG SER 29 5.373 12.131 1.380
200 H ILE 30 H ILE 30 6.358 7.264 -0.900
201 HA ILE 30 HA ILE 30 6.012 7.892 -3.722
202 HB ILE 30 HB ILE 30 7.618 5.683 -2.420
203 1HG1 ILE 30 2HG1 ILE 30 8.471 7.889 -1.804
204 2HG1 ILE 30 1HG1 ILE 30 9.580 7.092 -2.914
205 1HG2 ILE 30 1HG2 ILE 30 8.246 4.957 -4.445
206 2HG2 ILE 30 2HG2 ILE 30 8.353 6.588 -5.106
207 3HG2 ILE 30 3HG2 ILE 30 6.789 5.777 -5.010
208 1HD1 ILE 30 1HD1 ILE 30 9.318 9.460 -3.426
209 2HD1 ILE 30 2HD1 ILE 30 7.585 9.222 -3.658
210 3HD1 ILE 30 3HD1 ILE 30 8.737 8.446 -4.747
211 H SER 31 H SER 31 4.752 6.752 -5.110
212 HA SER 31 HA SER 31 2.741 5.019 -4.096
213 1HB SER 31 2HB SER 31 2.225 4.744 -6.574
214 2HB SER 31 1HB SER 31 2.175 6.396 -5.956
215 HG SER 31 HG SER 31 4.510 5.301 -7.122
Start of MODEL 16
1 1H CYS 1 H CYS 1 2.851 2.699 -3.634
2 HA CYS 1 HA CYS 1 5.158 1.091 -4.384
3 1HB CYS 1 2HB CYS 1 2.822 0.617 -2.533
4 2HB CYS 1 1HB CYS 1 4.021 -0.623 -2.882
5 H GLY 2 H GLY 2 2.432 1.902 -5.899
6 1HA GLY 2 2HA GLY 2 1.231 0.982 -7.640
7 2HA GLY 2 1HA GLY 2 2.538 -0.187 -7.794
8 H GLU 3 H GLU 3 0.576 0.314 -4.963
9 HA GLU 3 HA GLU 3 -0.794 -2.242 -5.388
10 1HB GLU 3 2HB GLU 3 1.020 -2.744 -3.893
11 2HB GLU 3 1HB GLU 3 0.701 -1.312 -2.931
12 1HG GLU 3 2HG GLU 3 -0.031 -3.243 -1.733
13 2HG GLU 3 1HG GLU 3 -1.438 -2.304 -2.220
14 H SER 4 H SER 4 -2.882 -2.337 -4.536
15 HA SER 4 HA SER 4 -3.878 0.189 -3.394
16 1HB SER 4 2HB SER 4 -5.994 -0.216 -4.714
17 2HB SER 4 1HB SER 4 -4.580 0.214 -5.676
18 HG SER 4 HG SER 4 -4.755 -2.468 -5.327
19 H CYS 5 H CYS 5 -4.792 -0.064 -1.518
20 HA CYS 5 HA CYS 5 -5.738 -2.711 -0.695
21 1HB CYS 5 2HB CYS 5 -5.786 -1.607 1.600
22 2HB CYS 5 1HB CYS 5 -4.197 -1.816 0.880
23 H ALA 6 H ALA 6 -7.233 -1.268 -2.538
24 HA ALA 6 HA ALA 6 -9.304 0.273 -1.438
25 1HB ALA 6 1HB ALA 6 -10.468 -0.688 -3.656
26 2HB ALA 6 2HB ALA 6 -8.776 -1.030 -4.021
27 3HB ALA 6 3HB ALA 6 -9.286 0.620 -3.663
28 H MET 7 H MET 7 -9.052 -3.167 -2.010
29 HA MET 7 HA MET 7 -11.773 -3.617 -1.095
30 1HB MET 7 2HB MET 7 -10.528 -4.895 -2.990
31 2HB MET 7 1HB MET 7 -9.783 -5.789 -1.677
32 1HG MET 7 2HG MET 7 -12.760 -5.552 -1.986
33 2HG MET 7 1HG MET 7 -11.818 -6.826 -2.754
34 1HE MET 7 1HE MET 7 -13.336 -9.043 -0.566
35 2HE MET 7 2HE MET 7 -13.910 -7.730 -1.593
36 3HE MET 7 3HE MET 7 -14.196 -7.678 0.147
37 H ILE 8 H ILE 8 -8.556 -4.764 -0.203
38 HA ILE 8 HA ILE 8 -9.478 -4.977 2.584
39 HB ILE 8 HB ILE 8 -7.649 -6.690 2.877
40 1HG1 ILE 8 2HG1 ILE 8 -7.731 -6.766 -0.148
41 2HG1 ILE 8 1HG1 ILE 8 -6.402 -6.115 0.806
42 1HG2 ILE 8 1HG2 ILE 8 -9.947 -7.332 1.039
43 2HG2 ILE 8 2HG2 ILE 8 -9.945 -7.379 2.802
44 3HG2 ILE 8 3HG2 ILE 8 -8.977 -8.535 1.889
45 1HD1 ILE 8 1HD1 ILE 8 -6.924 -8.738 1.731
46 2HD1 ILE 8 2HD1 ILE 8 -5.497 -8.125 0.893
47 3HD1 ILE 8 3HD1 ILE 8 -6.850 -8.783 -0.031
48 H SER 9 H SER 9 -8.214 -4.053 4.141
49 HA SER 9 HA SER 9 -6.283 -2.114 3.271
50 1HB SER 9 2HB SER 9 -8.010 -1.891 5.191
51 2HB SER 9 1HB SER 9 -6.851 -2.810 6.149
52 HG SER 9 HG SER 9 -5.795 -0.677 4.744
53 H PHE 10 H PHE 10 -5.251 -4.317 2.437
54 HA PHE 10 HA PHE 10 -2.913 -4.758 4.133
55 1HB PHE 10 2HB PHE 10 -4.312 -6.666 4.649
56 2HB PHE 10 1HB PHE 10 -4.641 -6.946 2.944
57 HD1 PHE 10 1HD PHE 10 -1.612 -6.561 5.107
58 HD2 PHE 10 2HD PHE 10 -3.595 -8.763 2.053
59 HE1 PHE 10 1HE PHE 10 0.296 -8.111 4.989
60 HE2 PHE 10 2HE PHE 10 -1.691 -10.317 1.930
61 HZ PHE 10 HZ PHE 10 0.258 -9.992 3.401
62 H CYS 11 H CYS 11 -1.204 -4.300 2.947
63 HA CYS 11 HA CYS 11 -1.426 -4.358 0.022
64 1HB CYS 11 2HB CYS 11 0.880 -3.322 1.656
65 2HB CYS 11 1HB CYS 11 0.492 -2.943 -0.011
66 H PHE 12 H PHE 12 -0.239 -5.731 -1.247
67 HA PHE 12 HA PHE 12 0.857 -8.058 -0.076
68 1HB PHE 12 2HB PHE 12 -0.028 -7.984 -2.382
69 2HB PHE 12 1HB PHE 12 1.298 -6.928 -2.855
70 HD1 PHE 12 1HD PHE 12 2.780 -8.014 -4.210
71 HD2 PHE 12 2HD PHE 12 1.083 -10.123 -0.927
72 HE1 PHE 12 1HE PHE 12 4.146 -9.980 -4.774
73 HE2 PHE 12 2HE PHE 12 2.449 -12.093 -1.483
74 HZ PHE 12 HZ PHE 12 3.983 -12.023 -3.408
75 H THR 13 H THR 13 2.242 -4.992 -1.039
76 HA THR 13 HA THR 13 4.913 -5.987 -0.368
77 HB THR 13 HB THR 13 5.732 -3.907 -1.457
78 HG1 THR 13 1HG THR 13 4.346 -2.426 -2.065
79 1HG2 THR 13 1HG2 THR 13 4.395 -6.150 -2.724
80 2HG2 THR 13 2HG2 THR 13 5.916 -5.362 -3.147
81 3HG2 THR 13 3HG2 THR 13 4.390 -4.716 -3.752
82 H GLU 14 H GLU 14 2.648 -4.841 1.576
83 HA GLU 14 HA GLU 14 3.811 -2.448 2.589
84 1HB GLU 14 2HB GLU 14 2.492 -2.826 4.637
85 2HB GLU 14 1HB GLU 14 1.531 -2.928 3.178
86 1HG GLU 14 2HG GLU 14 1.645 -5.388 3.320
87 2HG GLU 14 1HG GLU 14 2.523 -5.224 4.842
88 H VAL 15 H VAL 15 4.512 -5.784 3.062
89 HA VAL 15 HA VAL 15 5.901 -5.739 5.467
90 HB VAL 15 HB VAL 15 7.101 -7.746 4.631
91 1HG1 VAL 15 1HG1 VAL 15 4.841 -7.854 5.645
92 2HG1 VAL 15 2HG1 VAL 15 5.153 -9.153 4.492
93 3HG1 VAL 15 3HG1 VAL 15 4.148 -7.781 4.024
94 1HG2 VAL 15 1HG2 VAL 15 7.495 -7.543 2.380
95 2HG2 VAL 15 2HG2 VAL 15 5.914 -6.831 2.056
96 3HG2 VAL 15 3HG2 VAL 15 6.057 -8.564 2.351
97 H ILE 16 H ILE 16 6.906 -4.567 2.328
98 HA ILE 16 HA ILE 16 9.692 -4.463 3.107
99 HB ILE 16 HB ILE 16 8.876 -4.898 0.723
100 1HG1 ILE 16 2HG1 ILE 16 10.780 -3.642 -0.272
101 2HG1 ILE 16 1HG1 ILE 16 10.945 -2.748 1.235
102 1HG2 ILE 16 1HG2 ILE 16 8.949 -2.147 -0.073
103 2HG2 ILE 16 2HG2 ILE 16 7.657 -2.400 1.100
104 3HG2 ILE 16 3HG2 ILE 16 7.710 -3.367 -0.375
105 1HD1 ILE 16 1HD1 ILE 16 11.203 -5.083 2.309
106 2HD1 ILE 16 2HD1 ILE 16 12.557 -4.384 1.422
107 3HD1 ILE 16 3HD1 ILE 16 11.547 -5.614 0.663
108 H GLY 17 H GLY 17 7.019 -2.560 3.705
109 1HA GLY 17 2HA GLY 17 7.827 -0.692 5.281
110 2HA GLY 17 1HA GLY 17 8.633 -0.099 3.838
111 H CYS 18 H CYS 18 6.204 -1.125 2.275
112 HA CYS 18 HA CYS 18 4.894 1.328 2.018
113 1HB CYS 18 2HB CYS 18 3.793 -1.378 1.275
114 2HB CYS 18 1HB CYS 18 3.263 0.171 0.642
115 H SER 19 H SER 19 2.709 1.882 2.449
116 HA SER 19 HA SER 19 1.390 0.438 4.619
117 1HB SER 19 2HB SER 19 1.897 3.422 4.720
118 2HB SER 19 1HB SER 19 1.106 2.441 5.952
119 HG SER 19 HG SER 19 3.480 1.362 5.466
120 H CYS 20 H CYS 20 -0.793 0.484 4.479
121 HA CYS 20 HA CYS 20 -2.001 1.402 2.074
122 1HB CYS 20 2HB CYS 20 -2.869 -0.579 3.125
123 2HB CYS 20 1HB CYS 20 -3.151 0.278 4.636
124 H LYS 21 H LYS 21 -2.967 3.312 1.641
125 HA LYS 21 HA LYS 21 -3.977 4.948 3.814
126 1HB LYS 21 2HB LYS 21 -1.557 5.539 3.582
127 2HB LYS 21 1HB LYS 21 -1.875 6.023 1.924
128 1HG LYS 21 2HG LYS 21 -3.274 7.814 2.632
129 2HG LYS 21 1HG LYS 21 -3.250 7.245 4.302
130 1HD LYS 21 2HD LYS 21 -0.850 8.231 2.758
131 2HD LYS 21 1HD LYS 21 -1.752 9.168 3.954
132 1HE LYS 21 2HE LYS 21 -1.185 7.513 5.670
133 2HE LYS 21 1HE LYS 21 -0.283 6.584 4.476
134 1HZ LYS 21 1HZ LYS 21 1.119 8.611 4.165
135 2HZ LYS 21 2HZ LYS 21 1.266 7.872 5.680
136 3HZ LYS 21 3HZ LYS 21 0.352 9.286 5.514
137 H ASN 22 H ASN 22 -5.870 5.648 3.199
138 HA ASN 22 HA ASN 22 -7.703 6.001 1.936
139 1HB ASN 22 2HB ASN 22 -7.572 7.914 0.421
140 2HB ASN 22 1HB ASN 22 -6.711 8.219 1.918
141 1HD2 ASN 22 1HD2 ASN 22 -4.805 9.131 1.727
142 2HD2 ASN 22 2HD2 ASN 22 -3.807 9.126 0.317
143 H LYS 23 H LYS 23 -6.794 3.611 1.245
144 HA LYS 23 HA LYS 23 -7.343 2.017 -0.280
145 1HB LYS 23 2HB LYS 23 -9.103 2.936 -1.359
146 2HB LYS 23 1HB LYS 23 -8.266 4.445 -1.676
147 1HG LYS 23 2HG LYS 23 -6.963 3.116 -3.444
148 2HG LYS 23 1HG LYS 23 -8.238 1.909 -3.264
149 1HD LYS 23 2HD LYS 23 -8.593 3.580 -5.113
150 2HD LYS 23 1HD LYS 23 -9.913 3.450 -3.951
151 1HE LYS 23 2HE LYS 23 -9.312 5.795 -4.600
152 2HE LYS 23 1HE LYS 23 -9.267 5.474 -2.868
153 1HZ LYS 23 1HZ LYS 23 -7.283 6.633 -4.304
154 2HZ LYS 23 2HZ LYS 23 -6.741 5.036 -4.170
155 3HZ LYS 23 3HZ LYS 23 -7.098 5.928 -2.773
156 H VAL 24 H VAL 24 -4.845 4.336 -0.849
157 HA VAL 24 HA VAL 24 -3.618 2.419 -2.725
158 HB VAL 24 HB VAL 24 -2.129 4.295 -3.455
159 1HG1 VAL 24 1HG1 VAL 24 -3.957 3.632 -4.852
160 2HG1 VAL 24 2HG1 VAL 24 -3.884 5.393 -4.840
161 3HG1 VAL 24 3HG1 VAL 24 -5.101 4.556 -3.878
162 1HG2 VAL 24 1HG2 VAL 24 -3.945 6.404 -2.678
163 2HG2 VAL 24 2HG2 VAL 24 -2.191 6.316 -2.524
164 3HG2 VAL 24 3HG2 VAL 24 -3.222 5.624 -1.272
165 H CYS 25 H CYS 25 -1.695 1.531 -2.309
166 HA CYS 25 HA CYS 25 -0.596 1.947 0.355
167 1HB CYS 25 2HB CYS 25 0.107 -0.058 -1.795
168 2HB CYS 25 1HB CYS 25 0.767 -0.051 -0.163
169 H TYR 26 H TYR 26 0.986 3.322 0.713
170 HA TYR 26 HA TYR 26 2.922 3.857 -1.447
171 1HB TYR 26 2HB TYR 26 1.470 5.769 0.336
172 2HB TYR 26 1HB TYR 26 3.082 6.178 -0.224
173 HD1 TYR 26 1HD TYR 26 2.757 7.924 -1.713
174 HD2 TYR 26 2HD TYR 26 0.327 4.455 -2.068
175 HE1 TYR 26 1HE TYR 26 1.832 8.796 -3.815
176 HE2 TYR 26 2HE TYR 26 -0.604 5.316 -4.171
177 HH TYR 26 HH TYR 26 -0.463 8.391 -5.125
178 H LEU 27 H LEU 27 5.004 4.527 -0.780
179 HA LEU 27 HA LEU 27 5.779 3.844 1.972
180 1HB LEU 27 2HB LEU 27 6.258 2.046 0.136
181 2HB LEU 27 1HB LEU 27 7.492 3.160 -0.410
182 HG LEU 27 HG LEU 27 7.392 1.948 2.359
183 1HD1 LEU 27 1HD1 LEU 27 9.540 1.184 0.519
184 2HD1 LEU 27 2HD1 LEU 27 7.938 0.601 0.064
185 3HD1 LEU 27 3HD1 LEU 27 8.604 0.204 1.648
186 1HD2 LEU 27 1HD2 LEU 27 8.801 4.174 1.394
187 2HD2 LEU 27 2HD2 LEU 27 9.968 2.854 1.468
188 3HD2 LEU 27 3HD2 LEU 27 9.061 3.309 2.910
189 H ASN 28 H ASN 28 6.380 5.772 2.719
190 HA ASN 28 HA ASN 28 7.368 7.814 2.931
191 1HB ASN 28 2HB ASN 28 9.387 6.291 2.500
192 2HB ASN 28 1HB ASN 28 9.362 6.903 0.852
193 1HD2 ASN 28 1HD2 ASN 28 8.310 9.363 2.809
194 2HD2 ASN 28 2HD2 ASN 28 9.812 10.173 3.053
195 H SER 29 H SER 29 5.220 7.765 1.301
196 HA SER 29 HA SER 29 4.047 9.111 -0.082
197 1HB SER 29 2HB SER 29 6.646 10.602 -0.501
198 2HB SER 29 1HB SER 29 5.042 11.163 -0.978
199 HG SER 29 HG SER 29 5.694 12.034 1.037
200 H ILE 30 H ILE 30 6.492 7.103 -1.057
201 HA ILE 30 HA ILE 30 6.183 7.591 -3.914
202 HB ILE 30 HB ILE 30 7.736 5.413 -2.494
203 1HG1 ILE 30 2HG1 ILE 30 8.734 8.007 -3.695
204 2HG1 ILE 30 1HG1 ILE 30 8.537 7.708 -1.972
205 1HG2 ILE 30 1HG2 ILE 30 8.510 4.697 -4.505
206 2HG2 ILE 30 2HG2 ILE 30 8.410 6.297 -5.240
207 3HG2 ILE 30 3HG2 ILE 30 6.952 5.324 -5.044
208 1HD1 ILE 30 1HD1 ILE 30 10.638 7.015 -1.958
209 2HD1 ILE 30 2HD1 ILE 30 10.720 7.032 -3.719
210 3HD1 ILE 30 3HD1 ILE 30 10.110 5.607 -2.878
211 H SER 31 H SER 31 4.865 6.410 -5.224
212 HA SER 31 HA SER 31 2.851 4.776 -4.085
213 1HB SER 31 2HB SER 31 2.598 6.162 -6.173
214 2HB SER 31 1HB SER 31 3.594 4.972 -7.010
215 HG SER 31 HG SER 31 1.007 4.884 -6.635
Start of MODEL 17
1 1H CYS 1 H CYS 1 2.717 2.995 -3.737
2 HA CYS 1 HA CYS 1 5.062 1.534 -4.637
3 1HB CYS 1 2HB CYS 1 2.766 0.839 -2.803
4 2HB CYS 1 1HB CYS 1 4.021 -0.315 -3.229
5 H GLY 2 H GLY 2 2.241 2.280 -6.058
6 1HA GLY 2 2HA GLY 2 1.039 1.377 -7.814
7 2HA GLY 2 1HA GLY 2 2.422 0.317 -8.080
8 H GLU 3 H GLU 3 0.573 0.537 -5.166
9 HA GLU 3 HA GLU 3 -0.688 -2.069 -5.611
10 1HB GLU 3 2HB GLU 3 1.233 -2.625 -4.333
11 2HB GLU 3 1HB GLU 3 1.095 -1.180 -3.347
12 1HG GLU 3 2HG GLU 3 0.463 -2.905 -1.943
13 2HG GLU 3 1HG GLU 3 -1.059 -2.190 -2.462
14 H SER 4 H SER 4 -2.728 -2.245 -4.583
15 HA SER 4 HA SER 4 -3.578 0.166 -3.131
16 1HB SER 4 2HB SER 4 -5.769 0.045 -4.326
17 2HB SER 4 1HB SER 4 -4.405 0.448 -5.367
18 HG SER 4 HG SER 4 -4.719 -2.217 -5.273
19 H CYS 5 H CYS 5 -4.592 -0.156 -1.335
20 HA CYS 5 HA CYS 5 -5.375 -2.850 -0.531
21 1HB CYS 5 2HB CYS 5 -5.718 -1.599 1.712
22 2HB CYS 5 1HB CYS 5 -4.069 -1.826 1.142
23 H ALA 6 H ALA 6 -6.881 -1.515 -2.500
24 HA ALA 6 HA ALA 6 -9.155 -0.176 -1.578
25 1HB ALA 6 1HB ALA 6 -8.700 0.016 -3.857
26 2HB ALA 6 2HB ALA 6 -10.156 -0.978 -3.787
27 3HB ALA 6 3HB ALA 6 -8.586 -1.731 -4.072
28 H MET 7 H MET 7 -8.502 -3.583 -1.883
29 HA MET 7 HA MET 7 -11.252 -4.315 -1.286
30 1HB MET 7 2HB MET 7 -9.782 -5.606 -2.880
31 2HB MET 7 1HB MET 7 -8.844 -6.122 -1.493
32 1HG MET 7 2HG MET 7 -10.830 -7.186 -0.543
33 2HG MET 7 1HG MET 7 -11.762 -6.691 -1.955
34 1HE MET 7 1HE MET 7 -7.985 -8.069 -1.951
35 2HE MET 7 2HE MET 7 -8.354 -9.794 -1.967
36 3HE MET 7 3HE MET 7 -8.839 -8.802 -0.591
37 H ILE 8 H ILE 8 -8.087 -4.926 0.100
38 HA ILE 8 HA ILE 8 -9.295 -4.956 2.783
39 HB ILE 8 HB ILE 8 -7.552 -6.626 3.449
40 1HG1 ILE 8 2HG1 ILE 8 -7.189 -6.956 0.461
41 2HG1 ILE 8 1HG1 ILE 8 -6.014 -6.218 1.545
42 1HG2 ILE 8 1HG2 ILE 8 -9.712 -7.296 1.493
43 2HG2 ILE 8 2HG2 ILE 8 -9.666 -7.546 3.237
44 3HG2 ILE 8 3HG2 ILE 8 -8.694 -8.565 2.175
45 1HD1 ILE 8 1HD1 ILE 8 -6.653 -8.753 2.605
46 2HD1 ILE 8 2HD1 ILE 8 -5.131 -8.209 1.899
47 3HD1 ILE 8 3HD1 ILE 8 -6.360 -8.957 0.878
48 H SER 9 H SER 9 -8.117 -3.913 4.372
49 HA SER 9 HA SER 9 -6.248 -1.949 3.474
50 1HB SER 9 2HB SER 9 -7.926 -1.522 5.250
51 2HB SER 9 1HB SER 9 -7.082 -2.656 6.300
52 HG SER 9 HG SER 9 -5.206 -1.253 6.004
53 H PHE 10 H PHE 10 -5.140 -4.313 2.855
54 HA PHE 10 HA PHE 10 -2.665 -4.227 4.327
55 1HB PHE 10 2HB PHE 10 -3.886 -5.917 5.596
56 2HB PHE 10 1HB PHE 10 -4.251 -6.800 4.119
57 HD1 PHE 10 1HD PHE 10 -1.134 -5.303 5.534
58 HD2 PHE 10 2HD PHE 10 -3.096 -8.778 4.055
59 HE1 PHE 10 1HE PHE 10 0.949 -6.585 5.795
60 HE2 PHE 10 2HE PHE 10 -1.016 -10.066 4.315
61 HZ PHE 10 HZ PHE 10 1.009 -8.970 5.186
62 H CYS 11 H CYS 11 -1.281 -3.945 2.768
63 HA CYS 11 HA CYS 11 -1.804 -5.036 0.106
64 1HB CYS 11 2HB CYS 11 0.305 -3.123 1.109
65 2HB CYS 11 1HB CYS 11 0.128 -3.626 -0.566
66 H PHE 12 H PHE 12 -0.109 -6.115 -1.111
67 HA PHE 12 HA PHE 12 1.159 -8.171 0.423
68 1HB PHE 12 2HB PHE 12 0.365 -8.529 -1.899
69 2HB PHE 12 1HB PHE 12 1.579 -7.395 -2.478
70 HD1 PHE 12 1HD PHE 12 1.711 -10.226 -0.050
71 HD2 PHE 12 2HD PHE 12 3.188 -8.523 -3.659
72 HE1 PHE 12 1HE PHE 12 3.334 -12.064 -0.247
73 HE2 PHE 12 2HE PHE 12 4.814 -10.359 -3.864
74 HZ PHE 12 HZ PHE 12 4.888 -12.132 -2.157
75 H THR 13 H THR 13 2.222 -5.261 -1.244
76 HA THR 13 HA THR 13 4.986 -5.616 -0.484
77 HB THR 13 HB THR 13 4.441 -4.574 -2.632
78 HG1 THR 13 1HG THR 13 5.526 -2.427 -1.181
79 1HG2 THR 13 1HG2 THR 13 3.512 -2.282 -2.689
80 2HG2 THR 13 2HG2 THR 13 3.200 -2.393 -0.957
81 3HG2 THR 13 3HG2 THR 13 2.365 -3.472 -2.075
82 H GLU 14 H GLU 14 2.433 -4.875 1.333
83 HA GLU 14 HA GLU 14 3.188 -2.475 2.641
84 1HB GLU 14 2HB GLU 14 0.922 -3.664 2.670
85 2HB GLU 14 1HB GLU 14 1.615 -4.711 3.897
86 1HG GLU 14 2HG GLU 14 1.800 -2.983 5.439
87 2HG GLU 14 1HG GLU 14 1.634 -1.740 4.199
88 H VAL 15 H VAL 15 3.695 -5.889 3.403
89 HA VAL 15 HA VAL 15 5.095 -5.512 5.811
90 HB VAL 15 HB VAL 15 5.957 -7.810 5.483
91 1HG1 VAL 15 1HG1 VAL 15 4.014 -8.586 6.244
92 2HG1 VAL 15 2HG1 VAL 15 3.203 -8.277 4.708
93 3HG1 VAL 15 3HG1 VAL 15 3.348 -6.989 5.904
94 1HG2 VAL 15 1HG2 VAL 15 4.386 -7.950 2.932
95 2HG2 VAL 15 2HG2 VAL 15 5.600 -9.068 3.551
96 3HG2 VAL 15 3HG2 VAL 15 6.089 -7.492 2.929
97 H ILE 16 H ILE 16 6.045 -5.082 2.548
98 HA ILE 16 HA ILE 16 8.856 -5.389 2.946
99 HB ILE 16 HB ILE 16 7.404 -4.008 0.686
100 1HG1 ILE 16 2HG1 ILE 16 8.413 -6.855 0.897
101 2HG1 ILE 16 1HG1 ILE 16 6.724 -6.367 0.965
102 1HG2 ILE 16 1HG2 ILE 16 9.676 -3.320 0.656
103 2HG2 ILE 16 2HG2 ILE 16 9.514 -4.575 -0.573
104 3HG2 ILE 16 3HG2 ILE 16 10.246 -4.956 0.986
105 1HD1 ILE 16 1HD1 ILE 16 7.533 -7.287 -1.231
106 2HD1 ILE 16 2HD1 ILE 16 8.484 -5.810 -1.403
107 3HD1 ILE 16 3HD1 ILE 16 6.724 -5.722 -1.304
108 H GLY 17 H GLY 17 6.571 -2.808 3.174
109 1HA GLY 17 2HA GLY 17 7.873 -1.154 4.841
110 2HA GLY 17 1HA GLY 17 8.609 -0.750 3.300
111 H CYS 18 H CYS 18 5.991 -1.357 1.945
112 HA CYS 18 HA CYS 18 5.012 1.289 1.893
113 1HB CYS 18 2HB CYS 18 3.688 -1.225 0.878
114 2HB CYS 18 1HB CYS 18 3.261 0.414 0.424
115 H SER 19 H SER 19 2.795 1.954 2.337
116 HA SER 19 HA SER 19 1.475 0.467 4.483
117 1HB SER 19 2HB SER 19 1.144 2.755 5.636
118 2HB SER 19 1HB SER 19 2.725 1.985 5.781
119 HG SER 19 HG SER 19 3.213 3.310 3.799
120 H CYS 20 H CYS 20 -0.711 0.561 4.427
121 HA CYS 20 HA CYS 20 -1.969 1.467 2.062
122 1HB CYS 20 2HB CYS 20 -2.825 -0.462 3.240
123 2HB CYS 20 1HB CYS 20 -3.115 0.494 4.688
124 H LYS 21 H LYS 21 -2.771 3.404 1.550
125 HA LYS 21 HA LYS 21 -3.831 5.145 3.624
126 1HB LYS 21 2HB LYS 21 -1.233 5.501 3.108
127 2HB LYS 21 1HB LYS 21 -1.879 6.412 1.751
128 1HG LYS 21 2HG LYS 21 -1.478 7.953 3.502
129 2HG LYS 21 1HG LYS 21 -3.227 7.732 3.410
130 1HD LYS 21 2HD LYS 21 -3.240 6.324 5.321
131 2HD LYS 21 1HD LYS 21 -1.483 6.173 5.305
132 1HE LYS 21 2HE LYS 21 -2.124 7.672 7.072
133 2HE LYS 21 1HE LYS 21 -1.315 8.591 5.806
134 1HZ LYS 21 1HZ LYS 21 -4.011 8.624 5.195
135 2HZ LYS 21 2HZ LYS 21 -3.076 9.910 5.769
136 3HZ LYS 21 3HZ LYS 21 -3.916 8.924 6.857
137 H ASN 22 H ASN 22 -5.661 5.992 2.842
138 HA ASN 22 HA ASN 22 -7.379 6.424 1.447
139 1HB ASN 22 2HB ASN 22 -6.971 8.033 -0.349
140 2HB ASN 22 1HB ASN 22 -6.129 8.485 1.118
141 1HD2 ASN 22 1HD2 ASN 22 -4.169 9.234 0.810
142 2HD2 ASN 22 2HD2 ASN 22 -3.117 8.851 -0.503
143 H LYS 23 H LYS 23 -6.540 3.844 1.163
144 HA LYS 23 HA LYS 23 -7.111 2.046 -0.090
145 1HB LYS 23 2HB LYS 23 -8.953 2.856 -1.158
146 2HB LYS 23 1HB LYS 23 -8.102 4.236 -1.834
147 1HG LYS 23 2HG LYS 23 -7.022 2.642 -3.446
148 2HG LYS 23 1HG LYS 23 -8.125 1.404 -2.843
149 1HD LYS 23 2HD LYS 23 -10.034 2.720 -3.529
150 2HD LYS 23 1HD LYS 23 -8.980 4.045 -4.025
151 1HE LYS 23 2HE LYS 23 -7.953 2.558 -5.702
152 2HE LYS 23 1HE LYS 23 -9.075 1.282 -5.232
153 1HZ LYS 23 1HZ LYS 23 -9.795 2.504 -7.217
154 2HZ LYS 23 2HZ LYS 23 -9.878 3.929 -6.311
155 3HZ LYS 23 3HZ LYS 23 -10.909 2.638 -5.950
156 H VAL 24 H VAL 24 -4.670 4.243 -0.988
157 HA VAL 24 HA VAL 24 -3.465 2.178 -2.720
158 HB VAL 24 HB VAL 24 -2.829 5.136 -2.706
159 1HG1 VAL 24 1HG1 VAL 24 -2.056 3.814 -5.099
160 2HG1 VAL 24 2HG1 VAL 24 -1.411 2.906 -3.731
161 3HG1 VAL 24 3HG1 VAL 24 -1.037 4.621 -3.906
162 1HG2 VAL 24 1HG2 VAL 24 -4.488 5.494 -4.142
163 2HG2 VAL 24 2HG2 VAL 24 -5.062 3.861 -3.804
164 3HG2 VAL 24 3HG2 VAL 24 -3.970 4.149 -5.159
165 H CYS 25 H CYS 25 -1.471 1.368 -2.172
166 HA CYS 25 HA CYS 25 -0.475 2.166 0.433
167 1HB CYS 25 2HB CYS 25 -0.010 -0.162 -1.355
168 2HB CYS 25 1HB CYS 25 1.290 0.286 -0.253
169 H TYR 26 H TYR 26 1.163 3.435 0.836
170 HA TYR 26 HA TYR 26 2.931 4.195 -1.399
171 1HB TYR 26 2HB TYR 26 2.038 5.955 0.895
172 2HB TYR 26 1HB TYR 26 3.124 6.426 -0.402
173 HD1 TYR 26 1HD TYR 26 -0.333 5.896 0.582
174 HD2 TYR 26 2HD TYR 26 2.245 6.797 -2.677
175 HE1 TYR 26 1HE TYR 26 -2.261 6.699 -0.712
176 HE2 TYR 26 2HE TYR 26 0.322 7.601 -3.983
177 HH TYR 26 HH TYR 26 -2.983 7.348 -2.735
178 H LEU 27 H LEU 27 5.059 4.656 -0.927
179 HA LEU 27 HA LEU 27 6.073 3.737 1.678
180 1HB LEU 27 2HB LEU 27 6.638 2.107 -0.053
181 2HB LEU 27 1HB LEU 27 7.271 3.376 -1.078
182 HG LEU 27 HG LEU 27 9.093 3.771 0.520
183 1HD1 LEU 27 1HD1 LEU 27 7.432 2.222 2.247
184 2HD1 LEU 27 2HD1 LEU 27 8.907 3.111 2.624
185 3HD1 LEU 27 3HD1 LEU 27 9.001 1.434 2.086
186 1HD2 LEU 27 1HD2 LEU 27 10.004 2.362 -0.965
187 2HD2 LEU 27 2HD2 LEU 27 8.641 1.245 -0.893
188 3HD2 LEU 27 3HD2 LEU 27 9.898 1.183 0.342
189 H ASN 28 H ASN 28 6.383 5.683 2.614
190 HA ASN 28 HA ASN 28 7.218 7.753 3.049
191 1HB ASN 28 2HB ASN 28 9.381 6.521 2.596
192 2HB ASN 28 1HB ASN 28 9.309 7.135 0.947
193 1HD2 ASN 28 1HD2 ASN 28 10.583 8.805 0.653
194 2HD2 ASN 28 2HD2 ASN 28 10.931 10.042 1.807
195 H SER 29 H SER 29 5.089 7.751 1.486
196 HA SER 29 HA SER 29 3.810 9.140 0.245
197 1HB SER 29 2HB SER 29 6.320 10.755 -0.243
198 2HB SER 29 1HB SER 29 4.663 11.277 -0.551
199 HG SER 29 HG SER 29 6.067 11.326 1.753
200 H ILE 30 H ILE 30 6.306 7.300 -0.973
201 HA ILE 30 HA ILE 30 5.843 7.977 -3.767
202 HB ILE 30 HB ILE 30 7.551 5.787 -2.564
203 1HG1 ILE 30 2HG1 ILE 30 8.352 8.011 -1.933
204 2HG1 ILE 30 1HG1 ILE 30 9.451 7.267 -3.088
205 1HG2 ILE 30 1HG2 ILE 30 8.552 5.553 -4.735
206 2HG2 ILE 30 2HG2 ILE 30 7.581 6.879 -5.374
207 3HG2 ILE 30 3HG2 ILE 30 6.806 5.370 -4.894
208 1HD1 ILE 30 1HD1 ILE 30 7.578 8.757 -4.576
209 2HD1 ILE 30 2HD1 ILE 30 9.297 9.074 -4.348
210 3HD1 ILE 30 3HD1 ILE 30 8.117 9.774 -3.240
211 H SER 31 H SER 31 4.484 6.909 -5.095
212 HA SER 31 HA SER 31 2.577 5.091 -4.099
213 1HB SER 31 2HB SER 31 3.328 5.560 -6.991
214 2HB SER 31 1HB SER 31 1.786 4.962 -6.375
215 HG SER 31 HG SER 31 1.454 6.985 -5.400
Start of MODEL 18
1 1H CYS 1 H CYS 1 2.808 2.798 -3.730
2 HA CYS 1 HA CYS 1 5.171 1.165 -4.218
3 1HB CYS 1 2HB CYS 1 2.683 0.677 -2.573
4 2HB CYS 1 1HB CYS 1 4.021 -0.457 -2.690
5 H GLY 2 H GLY 2 2.507 1.828 -5.956
6 1HA GLY 2 2HA GLY 2 1.435 0.772 -7.709
7 2HA GLY 2 1HA GLY 2 2.785 -0.358 -7.722
8 H GLU 3 H GLU 3 0.480 0.317 -5.170
9 HA GLU 3 HA GLU 3 -0.839 -2.255 -5.487
10 1HB GLU 3 2HB GLU 3 0.923 -2.947 -4.080
11 2HB GLU 3 1HB GLU 3 0.913 -1.444 -3.178
12 1HG GLU 3 2HG GLU 3 0.055 -3.057 -1.733
13 2HG GLU 3 1HG GLU 3 -1.339 -2.140 -2.290
14 H SER 4 H SER 4 -2.888 -2.298 -4.454
15 HA SER 4 HA SER 4 -3.694 0.221 -3.177
16 1HB SER 4 2HB SER 4 -5.858 0.105 -4.446
17 2HB SER 4 1HB SER 4 -4.448 0.455 -5.444
18 HG SER 4 HG SER 4 -4.802 -2.199 -5.293
19 H CYS 5 H CYS 5 -4.737 -0.040 -1.370
20 HA CYS 5 HA CYS 5 -5.642 -2.705 -0.583
21 1HB CYS 5 2HB CYS 5 -5.895 -1.492 1.686
22 2HB CYS 5 1HB CYS 5 -4.267 -1.794 1.091
23 H ALA 6 H ALA 6 -7.097 -1.349 -2.513
24 HA ALA 6 HA ALA 6 -9.281 0.136 -1.618
25 1HB ALA 6 1HB ALA 6 -8.355 -0.755 -4.053
26 2HB ALA 6 2HB ALA 6 -9.803 0.214 -3.778
27 3HB ALA 6 3HB ALA 6 -9.924 -1.543 -3.887
28 H MET 7 H MET 7 -8.965 -3.329 -2.076
29 HA MET 7 HA MET 7 -11.671 -3.790 -1.123
30 1HB MET 7 2HB MET 7 -10.629 -5.109 -3.005
31 2HB MET 7 1HB MET 7 -9.575 -5.848 -1.815
32 1HG MET 7 2HG MET 7 -11.414 -7.319 -2.285
33 2HG MET 7 1HG MET 7 -11.544 -6.718 -0.632
34 1HE MET 7 1HE MET 7 -15.286 -7.102 -1.723
35 2HE MET 7 2HE MET 7 -14.166 -7.336 -0.380
36 3HE MET 7 3HE MET 7 -13.887 -8.159 -1.915
37 H ILE 8 H ILE 8 -8.469 -4.993 -0.279
38 HA ILE 8 HA ILE 8 -9.380 -5.287 2.503
39 HB ILE 8 HB ILE 8 -7.502 -6.912 2.769
40 1HG1 ILE 8 2HG1 ILE 8 -7.352 -6.749 -0.251
41 2HG1 ILE 8 1HG1 ILE 8 -6.140 -6.111 0.854
42 1HG2 ILE 8 1HG2 ILE 8 -8.675 -8.607 1.052
43 2HG2 ILE 8 2HG2 ILE 8 -9.882 -7.322 1.076
44 3HG2 ILE 8 3HG2 ILE 8 -9.405 -8.111 2.580
45 1HD1 ILE 8 1HD1 ILE 8 -5.163 -8.090 1.038
46 2HD1 ILE 8 2HD1 ILE 8 -6.201 -8.634 -0.281
47 3HD1 ILE 8 3HD1 ILE 8 -6.694 -8.891 1.393
48 H SER 9 H SER 9 -8.241 -4.334 4.119
49 HA SER 9 HA SER 9 -6.413 -2.239 3.396
50 1HB SER 9 2HB SER 9 -8.120 -1.944 5.170
51 2HB SER 9 1HB SER 9 -7.308 -3.169 6.140
52 HG SER 9 HG SER 9 -5.425 -1.774 6.042
53 H PHE 10 H PHE 10 -5.215 -4.375 2.539
54 HA PHE 10 HA PHE 10 -2.857 -4.587 4.205
55 1HB PHE 10 2HB PHE 10 -4.162 -6.488 4.986
56 2HB PHE 10 1HB PHE 10 -4.427 -7.026 3.332
57 HD1 PHE 10 1HD PHE 10 -1.436 -5.999 5.328
58 HD2 PHE 10 2HD PHE 10 -3.266 -8.930 2.844
59 HE1 PHE 10 1HE PHE 10 0.604 -7.369 5.447
60 HE2 PHE 10 2HE PHE 10 -1.231 -10.307 2.961
61 HZ PHE 10 HZ PHE 10 0.709 -9.526 4.263
62 H CYS 11 H CYS 11 -1.282 -4.094 2.905
63 HA CYS 11 HA CYS 11 -1.513 -4.622 0.025
64 1HB CYS 11 2HB CYS 11 0.765 -3.151 1.310
65 2HB CYS 11 1HB CYS 11 0.107 -2.969 -0.307
66 H PHE 12 H PHE 12 -0.172 -6.067 -1.035
67 HA PHE 12 HA PHE 12 1.248 -7.936 0.590
68 1HB PHE 12 2HB PHE 12 2.068 -8.882 -1.598
69 2HB PHE 12 1HB PHE 12 0.325 -8.813 -1.416
70 HD1 PHE 12 1HD PHE 12 -0.725 -8.438 -3.394
71 HD2 PHE 12 2HD PHE 12 2.935 -6.406 -2.636
72 HE1 PHE 12 1HE PHE 12 -0.902 -7.312 -5.574
73 HE2 PHE 12 2HE PHE 12 2.759 -5.270 -4.809
74 HZ PHE 12 HZ PHE 12 0.839 -5.723 -6.283
75 H THR 13 H THR 13 2.079 -4.960 -0.844
76 HA THR 13 HA THR 13 4.936 -5.482 -0.597
77 HB THR 13 HB THR 13 4.283 -4.469 -2.689
78 HG1 THR 13 1HG THR 13 5.466 -2.373 -1.162
79 1HG2 THR 13 1HG2 THR 13 3.464 -1.889 -1.555
80 2HG2 THR 13 2HG2 THR 13 2.326 -3.208 -1.286
81 3HG2 THR 13 3HG2 THR 13 2.814 -2.785 -2.927
82 H GLU 14 H GLU 14 2.506 -4.222 1.351
83 HA GLU 14 HA GLU 14 3.999 -2.041 2.419
84 1HB GLU 14 2HB GLU 14 2.347 -1.752 4.061
85 2HB GLU 14 1HB GLU 14 1.514 -2.216 2.593
86 1HG GLU 14 2HG GLU 14 1.227 -4.467 3.451
87 2HG GLU 14 1HG GLU 14 2.111 -4.027 4.916
88 H VAL 15 H VAL 15 3.827 -5.431 3.160
89 HA VAL 15 HA VAL 15 5.121 -5.331 5.666
90 HB VAL 15 HB VAL 15 5.666 -7.720 5.287
91 1HG1 VAL 15 1HG1 VAL 15 2.830 -7.114 4.472
92 2HG1 VAL 15 2HG1 VAL 15 3.434 -6.919 6.117
93 3HG1 VAL 15 3HG1 VAL 15 3.423 -8.515 5.365
94 1HG2 VAL 15 1HG2 VAL 15 5.473 -8.790 3.295
95 2HG2 VAL 15 2HG2 VAL 15 5.777 -7.170 2.668
96 3HG2 VAL 15 3HG2 VAL 15 4.127 -7.785 2.759
97 H ILE 16 H ILE 16 6.256 -4.998 2.443
98 HA ILE 16 HA ILE 16 9.002 -5.613 3.004
99 HB ILE 16 HB ILE 16 7.846 -4.163 0.620
100 1HG1 ILE 16 2HG1 ILE 16 8.496 -7.106 0.911
101 2HG1 ILE 16 1HG1 ILE 16 6.871 -6.434 0.983
102 1HG2 ILE 16 1HG2 ILE 16 10.311 -3.939 1.029
103 2HG2 ILE 16 2HG2 ILE 16 9.876 -4.671 -0.515
104 3HG2 ILE 16 3HG2 ILE 16 10.438 -5.684 0.814
105 1HD1 ILE 16 1HD1 ILE 16 6.762 -6.109 -1.254
106 2HD1 ILE 16 2HD1 ILE 16 7.905 -7.451 -1.235
107 3HD1 ILE 16 3HD1 ILE 16 8.490 -5.797 -1.407
108 H GLY 17 H GLY 17 6.989 -2.807 2.816
109 1HA GLY 17 2HA GLY 17 8.187 -1.152 4.550
110 2HA GLY 17 1HA GLY 17 9.201 -0.956 3.128
111 H CYS 18 H CYS 18 5.695 -1.377 3.415
112 HA CYS 18 HA CYS 18 5.309 1.331 2.317
113 1HB CYS 18 2HB CYS 18 4.056 -1.236 1.327
114 2HB CYS 18 1HB CYS 18 3.397 0.344 0.953
115 H SER 19 H SER 19 2.822 1.815 2.418
116 HA SER 19 HA SER 19 1.524 0.587 4.709
117 1HB SER 19 2HB SER 19 2.101 3.560 4.653
118 2HB SER 19 1HB SER 19 1.218 2.689 5.906
119 HG SER 19 HG SER 19 3.471 1.432 5.737
120 H CYS 20 H CYS 20 -0.643 0.555 4.479
121 HA CYS 20 HA CYS 20 -1.818 1.454 2.046
122 1HB CYS 20 2HB CYS 20 -2.749 -0.509 3.014
123 2HB CYS 20 1HB CYS 20 -2.957 0.265 4.580
124 H LYS 21 H LYS 21 -2.900 3.319 1.591
125 HA LYS 21 HA LYS 21 -3.850 4.997 3.763
126 1HB LYS 21 2HB LYS 21 -1.396 5.549 3.303
127 2HB LYS 21 1HB LYS 21 -1.932 6.154 1.743
128 1HG LYS 21 2HG LYS 21 -1.698 7.983 3.284
129 2HG LYS 21 1HG LYS 21 -3.403 7.754 2.897
130 1HD LYS 21 2HD LYS 21 -3.073 8.171 5.288
131 2HD LYS 21 1HD LYS 21 -3.737 6.563 5.000
132 1HE LYS 21 2HE LYS 21 -1.970 6.534 6.702
133 2HE LYS 21 1HE LYS 21 -1.535 5.578 5.286
134 1HZ LYS 21 1HZ LYS 21 0.374 6.743 5.559
135 2HZ LYS 21 2HZ LYS 21 -0.386 8.079 6.264
136 3HZ LYS 21 3HZ LYS 21 -0.447 7.859 4.588
137 H ASN 22 H ASN 22 -5.772 5.705 3.192
138 HA ASN 22 HA ASN 22 -7.645 5.997 1.958
139 1HB ASN 22 2HB ASN 22 -7.479 7.845 0.276
140 2HB ASN 22 1HB ASN 22 -6.849 8.232 1.868
141 1HD2 ASN 22 1HD2 ASN 22 -6.182 7.976 -1.466
142 2HD2 ASN 22 2HD2 ASN 22 -4.529 8.468 -1.406
143 H LYS 23 H LYS 23 -6.801 3.625 1.282
144 HA LYS 23 HA LYS 23 -7.334 2.011 -0.222
145 1HB LYS 23 2HB LYS 23 -9.129 3.145 -1.171
146 2HB LYS 23 1HB LYS 23 -8.109 4.396 -1.864
147 1HG LYS 23 2HG LYS 23 -7.235 2.680 -3.456
148 2HG LYS 23 1HG LYS 23 -8.450 1.566 -2.824
149 1HD LYS 23 2HD LYS 23 -10.228 3.062 -3.514
150 2HD LYS 23 1HD LYS 23 -9.047 4.256 -4.055
151 1HE LYS 23 2HE LYS 23 -8.209 2.644 -5.714
152 2HE LYS 23 1HE LYS 23 -9.435 1.489 -5.191
153 1HZ LYS 23 1HZ LYS 23 -10.284 4.165 -6.046
154 2HZ LYS 23 2HZ LYS 23 -11.109 2.691 -6.149
155 3HZ LYS 23 3HZ LYS 23 -9.851 3.034 -7.228
156 H VAL 24 H VAL 24 -4.862 4.341 -0.866
157 HA VAL 24 HA VAL 24 -3.653 2.387 -2.710
158 HB VAL 24 HB VAL 24 -4.118 4.566 -3.760
159 1HG1 VAL 24 1HG1 VAL 24 -3.647 6.506 -2.805
160 2HG1 VAL 24 2HG1 VAL 24 -1.943 6.070 -2.667
161 3HG1 VAL 24 3HG1 VAL 24 -3.073 5.629 -1.387
162 1HG2 VAL 24 1HG2 VAL 24 -1.150 4.223 -3.583
163 2HG2 VAL 24 2HG2 VAL 24 -2.138 4.653 -4.979
164 3HG2 VAL 24 3HG2 VAL 24 -2.174 3.008 -4.345
165 H CYS 25 H CYS 25 -1.697 1.570 -2.314
166 HA CYS 25 HA CYS 25 -0.580 2.065 0.322
167 1HB CYS 25 2HB CYS 25 0.277 0.060 -1.771
168 2HB CYS 25 1HB CYS 25 0.694 0.043 -0.059
169 H TYR 26 H TYR 26 1.060 3.365 0.698
170 HA TYR 26 HA TYR 26 2.949 3.992 -1.479
171 1HB TYR 26 2HB TYR 26 1.392 5.829 0.264
172 2HB TYR 26 1HB TYR 26 3.051 6.279 -0.092
173 HD1 TYR 26 1HD TYR 26 2.805 8.129 -1.476
174 HD2 TYR 26 2HD TYR 26 0.609 4.596 -2.348
175 HE1 TYR 26 1HE TYR 26 2.115 9.099 -3.625
176 HE2 TYR 26 2HE TYR 26 -0.087 5.556 -4.499
177 HH TYR 26 HH TYR 26 0.486 8.868 -5.315
178 H LEU 27 H LEU 27 5.014 4.746 -0.801
179 HA LEU 27 HA LEU 27 5.793 4.058 1.935
180 1HB LEU 27 2HB LEU 27 7.743 2.901 1.229
181 2HB LEU 27 1HB LEU 27 6.415 2.215 0.323
182 HG LEU 27 HG LEU 27 7.354 4.113 -1.421
183 1HD1 LEU 27 1HD1 LEU 27 9.867 3.527 -1.430
184 2HD1 LEU 27 2HD1 LEU 27 9.622 3.131 0.271
185 3HD1 LEU 27 3HD1 LEU 27 9.290 4.763 -0.311
186 1HD2 LEU 27 1HD2 LEU 27 8.294 2.256 -2.655
187 2HD2 LEU 27 2HD2 LEU 27 6.766 1.776 -1.915
188 3HD2 LEU 27 3HD2 LEU 27 8.294 1.258 -1.201
189 H ASN 28 H ASN 28 6.342 5.939 2.765
190 HA ASN 28 HA ASN 28 7.144 8.062 3.025
191 1HB ASN 28 2HB ASN 28 9.265 6.587 2.509
192 2HB ASN 28 1HB ASN 28 9.287 7.499 1.004
193 1HD2 ASN 28 1HD2 ASN 28 10.779 7.383 3.776
194 2HD2 ASN 28 2HD2 ASN 28 11.058 9.056 4.097
195 H SER 29 H SER 29 5.066 7.950 1.325
196 HA SER 29 HA SER 29 3.883 9.199 -0.135
197 1HB SER 29 2HB SER 29 6.358 10.925 -0.359
198 2HB SER 29 1HB SER 29 4.720 11.372 -0.842
199 HG SER 29 HG SER 29 5.874 11.508 1.585
200 H ILE 30 H ILE 30 5.888 7.044 -0.994
201 HA ILE 30 HA ILE 30 5.989 7.744 -3.854
202 HB ILE 30 HB ILE 30 7.618 5.671 -2.362
203 1HG1 ILE 30 2HG1 ILE 30 8.471 8.296 -3.608
204 2HG1 ILE 30 1HG1 ILE 30 8.260 8.020 -1.884
205 1HG2 ILE 30 1HG2 ILE 30 8.693 5.134 -4.369
206 2HG2 ILE 30 2HG2 ILE 30 8.067 6.561 -5.194
207 3HG2 ILE 30 3HG2 ILE 30 6.987 5.223 -4.807
208 1HD1 ILE 30 1HD1 ILE 30 10.040 6.318 -1.977
209 2HD1 ILE 30 2HD1 ILE 30 10.593 7.926 -2.448
210 3HD1 ILE 30 3HD1 ILE 30 10.282 6.704 -3.681
211 H SER 31 H SER 31 4.843 6.516 -5.268
212 HA SER 31 HA SER 31 2.781 4.842 -4.374
213 1HB SER 31 2HB SER 31 3.901 4.821 -7.171
214 2HB SER 31 1HB SER 31 2.228 4.592 -6.658
215 HG SER 31 HG SER 31 2.007 6.728 -6.340
Start of MODEL 19
1 1H CYS 1 H CYS 1 2.809 2.761 -3.727
2 HA CYS 1 HA CYS 1 5.207 1.276 -4.441
3 1HB CYS 1 2HB CYS 1 2.855 0.691 -2.646
4 2HB CYS 1 1HB CYS 1 4.108 -0.499 -2.973
5 H GLY 2 H GLY 2 2.531 1.960 -6.078
6 1HA GLY 2 2HA GLY 2 1.413 0.957 -7.835
7 2HA GLY 2 1HA GLY 2 2.779 -0.149 -7.933
8 H GLU 3 H GLU 3 0.647 0.339 -5.226
9 HA GLU 3 HA GLU 3 -0.672 -2.233 -5.618
10 1HB GLU 3 2HB GLU 3 1.169 -2.867 -4.247
11 2HB GLU 3 1HB GLU 3 1.048 -1.411 -3.278
12 1HG GLU 3 2HG GLU 3 0.301 -3.198 -1.943
13 2HG GLU 3 1HG GLU 3 -1.124 -2.275 -2.405
14 H SER 4 H SER 4 -2.691 -2.352 -4.475
15 HA SER 4 HA SER 4 -3.522 0.164 -3.212
16 1HB SER 4 2HB SER 4 -5.700 0.008 -4.461
17 2HB SER 4 1HB SER 4 -4.303 0.394 -5.465
18 HG SER 4 HG SER 4 -4.608 -2.270 -5.318
19 H CYS 5 H CYS 5 -4.621 -0.075 -1.435
20 HA CYS 5 HA CYS 5 -5.494 -2.738 -0.611
21 1HB CYS 5 2HB CYS 5 -5.821 -1.499 1.626
22 2HB CYS 5 1HB CYS 5 -4.167 -1.734 1.071
23 H ALA 6 H ALA 6 -6.851 -1.571 -2.627
24 HA ALA 6 HA ALA 6 -9.037 0.018 -2.065
25 1HB ALA 6 1HB ALA 6 -8.735 -0.182 -4.304
26 2HB ALA 6 2HB ALA 6 -10.020 -1.371 -4.098
27 3HB ALA 6 3HB ALA 6 -8.341 -1.898 -4.209
28 H MET 7 H MET 7 -8.803 -3.476 -1.903
29 HA MET 7 HA MET 7 -11.582 -3.708 -1.085
30 1HB MET 7 2HB MET 7 -10.455 -5.349 -2.628
31 2HB MET 7 1HB MET 7 -9.500 -5.884 -1.262
32 1HG MET 7 2HG MET 7 -11.246 -7.435 -1.473
33 2HG MET 7 1HG MET 7 -11.667 -6.422 -0.096
34 1HE MET 7 1HE MET 7 -13.040 -3.957 -0.855
35 2HE MET 7 2HE MET 7 -13.923 -5.138 0.112
36 3HE MET 7 3HE MET 7 -14.695 -4.389 -1.286
37 H ILE 8 H ILE 8 -8.509 -4.867 0.202
38 HA ILE 8 HA ILE 8 -9.576 -4.463 2.918
39 HB ILE 8 HB ILE 8 -8.046 -6.283 3.664
40 1HG1 ILE 8 2HG1 ILE 8 -7.753 -6.809 0.695
41 2HG1 ILE 8 1HG1 ILE 8 -6.485 -6.201 1.753
42 1HG2 ILE 8 1HG2 ILE 8 -9.547 -7.947 1.963
43 2HG2 ILE 8 2HG2 ILE 8 -10.515 -6.501 2.243
44 3HG2 ILE 8 3HG2 ILE 8 -9.930 -7.447 3.611
45 1HD1 ILE 8 1HD1 ILE 8 -6.030 -8.232 2.584
46 2HD1 ILE 8 2HD1 ILE 8 -6.808 -8.791 1.102
47 3HD1 ILE 8 3HD1 ILE 8 -7.725 -8.721 2.608
48 H SER 9 H SER 9 -8.135 -3.710 4.494
49 HA SER 9 HA SER 9 -6.140 -1.906 3.520
50 1HB SER 9 2HB SER 9 -7.617 -1.303 5.390
51 2HB SER 9 1HB SER 9 -6.932 -2.603 6.360
52 HG SER 9 HG SER 9 -4.889 -1.525 6.137
53 H PHE 10 H PHE 10 -5.236 -4.163 2.671
54 HA PHE 10 HA PHE 10 -2.843 -4.660 4.266
55 1HB PHE 10 2HB PHE 10 -4.191 -6.486 4.976
56 2HB PHE 10 1HB PHE 10 -4.797 -6.774 3.351
57 HD1 PHE 10 1HD PHE 10 -4.047 -8.701 2.398
58 HD2 PHE 10 2HD PHE 10 -1.439 -6.572 5.000
59 HE1 PHE 10 1HE PHE 10 -2.315 -10.412 2.053
60 HE2 PHE 10 2HE PHE 10 0.300 -8.278 4.656
61 HZ PHE 10 HZ PHE 10 -0.136 -10.202 3.181
62 H CYS 11 H CYS 11 -1.271 -4.111 2.941
63 HA CYS 11 HA CYS 11 -1.592 -4.491 0.050
64 1HB CYS 11 2HB CYS 11 0.695 -3.153 1.487
65 2HB CYS 11 1HB CYS 11 0.277 -3.011 -0.207
66 H PHE 12 H PHE 12 -0.341 -5.915 -1.125
67 HA PHE 12 HA PHE 12 0.922 -8.041 0.268
68 1HB PHE 12 2HB PHE 12 -0.063 -8.261 -2.005
69 2HB PHE 12 1HB PHE 12 1.225 -7.246 -2.640
70 HD1 PHE 12 1HD PHE 12 2.656 -8.491 -3.919
71 HD2 PHE 12 2HD PHE 12 1.178 -10.147 -0.288
72 HE1 PHE 12 1HE PHE 12 4.055 -10.485 -4.262
73 HE2 PHE 12 2HE PHE 12 2.575 -12.142 -0.624
74 HZ PHE 12 HZ PHE 12 4.017 -12.313 -2.614
75 H THR 13 H THR 13 2.024 -5.037 -1.085
76 HA THR 13 HA THR 13 4.820 -5.712 -0.632
77 HB THR 13 HB THR 13 4.265 -4.629 -2.741
78 HG1 THR 13 1HG THR 13 5.616 -2.660 -1.208
79 1HG2 THR 13 1HG2 THR 13 2.491 -3.131 -1.239
80 2HG2 THR 13 2HG2 THR 13 2.886 -2.885 -2.940
81 3HG2 THR 13 3HG2 THR 13 3.740 -1.973 -1.695
82 H GLU 14 H GLU 14 2.527 -4.693 1.470
83 HA GLU 14 HA GLU 14 3.847 -2.382 2.527
84 1HB GLU 14 2HB GLU 14 2.368 -2.474 4.397
85 2HB GLU 14 1HB GLU 14 1.451 -2.810 2.948
86 1HG GLU 14 2HG GLU 14 1.686 -5.258 3.529
87 2HG GLU 14 1HG GLU 14 2.292 -4.716 5.097
88 H VAL 15 H VAL 15 4.278 -5.766 2.913
89 HA VAL 15 HA VAL 15 5.563 -5.873 5.386
90 HB VAL 15 HB VAL 15 6.634 -7.954 4.567
91 1HG1 VAL 15 1HG1 VAL 15 4.524 -9.178 4.158
92 2HG1 VAL 15 2HG1 VAL 15 3.697 -7.633 3.965
93 3HG1 VAL 15 3HG1 VAL 15 4.420 -8.058 5.516
94 1HG2 VAL 15 1HG2 VAL 15 6.863 -7.067 2.184
95 2HG2 VAL 15 2HG2 VAL 15 5.173 -7.526 1.974
96 3HG2 VAL 15 3HG2 VAL 15 6.377 -8.754 2.370
97 H ILE 16 H ILE 16 6.767 -4.781 2.288
98 HA ILE 16 HA ILE 16 9.520 -4.876 3.151
99 HB ILE 16 HB ILE 16 8.780 -5.238 0.751
100 1HG1 ILE 16 2HG1 ILE 16 10.879 -3.114 1.237
101 2HG1 ILE 16 1HG1 ILE 16 11.132 -4.846 1.419
102 1HG2 ILE 16 1HG2 ILE 16 7.260 -3.534 0.299
103 2HG2 ILE 16 2HG2 ILE 16 8.715 -3.028 -0.560
104 3HG2 ILE 16 3HG2 ILE 16 8.302 -2.290 0.988
105 1HD1 ILE 16 1HD1 ILE 16 11.660 -4.999 -0.720
106 2HD1 ILE 16 2HD1 ILE 16 11.431 -3.259 -0.893
107 3HD1 ILE 16 3HD1 ILE 16 10.082 -4.357 -1.177
108 H GLY 17 H GLY 17 6.949 -2.707 3.481
109 1HA GLY 17 2HA GLY 17 7.920 -0.929 5.168
110 2HA GLY 17 1HA GLY 17 8.696 -0.371 3.695
111 H CYS 18 H CYS 18 6.287 -1.203 2.125
112 HA CYS 18 HA CYS 18 5.005 1.270 1.988
113 1HB CYS 18 2HB CYS 18 3.977 -1.418 1.073
114 2HB CYS 18 1HB CYS 18 3.366 0.137 0.546
115 H SER 19 H SER 19 2.670 1.680 2.292
116 HA SER 19 HA SER 19 1.359 0.157 4.384
117 1HB SER 19 2HB SER 19 0.977 2.352 5.678
118 2HB SER 19 1HB SER 19 2.567 1.603 5.812
119 HG SER 19 HG SER 19 3.013 3.077 3.883
120 H CYS 20 H CYS 20 -0.864 0.460 4.447
121 HA CYS 20 HA CYS 20 -2.074 1.370 2.043
122 1HB CYS 20 2HB CYS 20 -3.037 -0.475 3.318
123 2HB CYS 20 1HB CYS 20 -3.300 0.581 4.698
124 H LYS 21 H LYS 21 -2.885 3.318 1.532
125 HA LYS 21 HA LYS 21 -3.584 5.216 3.630
126 1HB LYS 21 2HB LYS 21 -1.147 5.520 3.120
127 2HB LYS 21 1HB LYS 21 -1.584 5.885 1.459
128 1HG LYS 21 2HG LYS 21 -2.680 7.892 2.099
129 2HG LYS 21 1HG LYS 21 -2.563 7.478 3.813
130 1HD LYS 21 2HD LYS 21 -0.121 7.605 3.675
131 2HD LYS 21 1HD LYS 21 -0.236 8.012 1.963
132 1HE LYS 21 2HE LYS 21 -1.479 9.659 4.157
133 2HE LYS 21 1HE LYS 21 0.134 9.955 3.513
134 1HZ LYS 21 1HZ LYS 21 -0.687 10.867 1.658
135 2HZ LYS 21 2HZ LYS 21 -2.107 11.067 2.558
136 3HZ LYS 21 3HZ LYS 21 -1.944 9.740 1.517
137 H ASN 22 H ASN 22 -5.566 5.745 3.084
138 HA ASN 22 HA ASN 22 -7.454 6.113 1.929
139 1HB ASN 22 2HB ASN 22 -7.407 7.899 0.238
140 2HB ASN 22 1HB ASN 22 -6.527 8.320 1.694
141 1HD2 ASN 22 1HD2 ASN 22 -4.822 9.477 1.265
142 2HD2 ASN 22 2HD2 ASN 22 -3.794 9.326 -0.115
143 H LYS 23 H LYS 23 -6.547 3.683 1.331
144 HA LYS 23 HA LYS 23 -7.150 1.972 -0.019
145 1HB LYS 23 2HB LYS 23 -9.087 2.858 -0.854
146 2HB LYS 23 1HB LYS 23 -8.286 4.240 -1.580
147 1HG LYS 23 2HG LYS 23 -7.518 2.869 -3.411
148 2HG LYS 23 1HG LYS 23 -8.188 1.427 -2.647
149 1HD LYS 23 2HD LYS 23 -9.979 3.755 -3.183
150 2HD LYS 23 1HD LYS 23 -9.521 2.705 -4.523
151 1HE LYS 23 2HE LYS 23 -11.658 2.036 -3.519
152 2HE LYS 23 1HE LYS 23 -10.437 0.777 -3.367
153 1HZ LYS 23 1HZ LYS 23 -10.277 2.336 -1.071
154 2HZ LYS 23 2HZ LYS 23 -10.855 0.747 -1.205
155 3HZ LYS 23 3HZ LYS 23 -11.926 2.052 -1.339
156 H VAL 24 H VAL 24 -4.844 4.320 -0.900
157 HA VAL 24 HA VAL 24 -3.691 2.438 -2.859
158 HB VAL 24 HB VAL 24 -2.914 5.338 -2.526
159 1HG1 VAL 24 1HG1 VAL 24 -2.463 4.240 -5.127
160 2HG1 VAL 24 2HG1 VAL 24 -1.744 3.181 -3.914
161 3HG1 VAL 24 3HG1 VAL 24 -1.295 4.887 -3.975
162 1HG2 VAL 24 1HG2 VAL 24 -4.209 5.704 -4.632
163 2HG2 VAL 24 2HG2 VAL 24 -5.203 5.346 -3.220
164 3HG2 VAL 24 3HG2 VAL 24 -4.899 4.094 -4.425
165 H CYS 25 H CYS 25 -1.688 1.575 -2.487
166 HA CYS 25 HA CYS 25 -0.628 1.931 0.190
167 1HB CYS 25 2HB CYS 25 0.276 0.082 -2.021
168 2HB CYS 25 1HB CYS 25 0.758 -0.010 -0.329
169 H TYR 26 H TYR 26 0.995 3.216 0.708
170 HA TYR 26 HA TYR 26 2.857 4.066 -1.416
171 1HB TYR 26 2HB TYR 26 1.721 5.747 0.824
172 2HB TYR 26 1HB TYR 26 3.039 6.253 -0.220
173 HD1 TYR 26 1HD TYR 26 -0.562 5.688 0.020
174 HD2 TYR 26 2HD TYR 26 2.621 6.891 -2.526
175 HE1 TYR 26 1HE TYR 26 -2.190 6.657 -1.545
176 HE2 TYR 26 2HE TYR 26 1.003 7.859 -4.103
177 HH TYR 26 HH TYR 26 -2.461 7.456 -3.657
178 H LEU 27 H LEU 27 4.933 4.614 -0.796
179 HA LEU 27 HA LEU 27 5.840 3.689 1.845
180 1HB LEU 27 2HB LEU 27 6.527 2.014 0.231
181 2HB LEU 27 1HB LEU 27 7.121 3.247 -0.858
182 HG LEU 27 HG LEU 27 8.920 3.794 0.715
183 1HD1 LEU 27 1HD1 LEU 27 8.301 1.395 2.358
184 2HD1 LEU 27 2HD1 LEU 27 7.446 2.902 2.693
185 3HD1 LEU 27 3HD1 LEU 27 9.208 2.850 2.772
186 1HD2 LEU 27 1HD2 LEU 27 10.088 1.523 0.605
187 2HD2 LEU 27 2HD2 LEU 27 9.562 2.246 -0.915
188 3HD2 LEU 27 3HD2 LEU 27 8.620 0.947 -0.185
189 H ASN 28 H ASN 28 6.092 5.668 2.749
190 HA ASN 28 HA ASN 28 6.890 7.760 3.162
191 1HB ASN 28 2HB ASN 28 9.079 6.404 2.614
192 2HB ASN 28 1HB ASN 28 9.078 7.369 1.141
193 1HD2 ASN 28 1HD2 ASN 28 10.484 7.209 3.983
194 2HD2 ASN 28 2HD2 ASN 28 10.717 8.882 4.343
195 H SER 29 H SER 29 4.835 7.652 1.475
196 HA SER 29 HA SER 29 3.592 8.969 0.125
197 1HB SER 29 2HB SER 29 6.083 10.651 -0.196
198 2HB SER 29 1HB SER 29 4.454 11.111 -0.696
199 HG SER 29 HG SER 29 5.601 11.285 1.733
200 H ILE 30 H ILE 30 6.171 7.156 -0.898
201 HA ILE 30 HA ILE 30 5.880 7.766 -3.731
202 HB ILE 30 HB ILE 30 7.517 5.604 -2.385
203 1HG1 ILE 30 2HG1 ILE 30 8.387 8.299 -3.461
204 2HG1 ILE 30 1HG1 ILE 30 8.197 7.910 -1.755
205 1HG2 ILE 30 1HG2 ILE 30 8.366 6.542 -5.012
206 2HG2 ILE 30 2HG2 ILE 30 6.773 5.784 -5.028
207 3HG2 ILE 30 3HG2 ILE 30 8.164 4.898 -4.405
208 1HD1 ILE 30 1HD1 ILE 30 10.387 7.478 -1.852
209 2HD1 ILE 30 2HD1 ILE 30 10.373 7.278 -3.605
210 3HD1 ILE 30 3HD1 ILE 30 9.881 5.944 -2.560
211 H SER 31 H SER 31 4.651 6.608 -5.134
212 HA SER 31 HA SER 31 2.684 4.825 -4.173
213 1HB SER 31 2HB SER 31 2.428 6.249 -6.212
214 2HB SER 31 1HB SER 31 3.581 5.202 -7.039
215 HG SER 31 HG SER 31 1.059 4.844 -7.007
Start of MODEL 20
1 1H CYS 1 H CYS 1 2.682 2.999 -3.806
2 HA CYS 1 HA CYS 1 5.024 1.507 -4.667
3 1HB CYS 1 2HB CYS 1 2.676 0.844 -2.887
4 2HB CYS 1 1HB CYS 1 3.907 -0.339 -3.304
5 H GLY 2 H GLY 2 2.191 2.293 -6.093
6 1HA GLY 2 2HA GLY 2 1.009 1.420 -7.880
7 2HA GLY 2 1HA GLY 2 2.388 0.356 -8.147
8 H GLU 3 H GLU 3 0.577 0.554 -5.223
9 HA GLU 3 HA GLU 3 -0.732 -2.025 -5.678
10 1HB GLU 3 2HB GLU 3 1.158 -2.680 -4.445
11 2HB GLU 3 1HB GLU 3 1.174 -1.202 -3.504
12 1HG GLU 3 2HG GLU 3 0.555 -2.917 -2.040
13 2HG GLU 3 1HG GLU 3 -0.917 -2.016 -2.387
14 H SER 4 H SER 4 -2.731 -2.206 -4.571
15 HA SER 4 HA SER 4 -3.533 0.188 -3.072
16 1HB SER 4 2HB SER 4 -5.743 0.116 -4.267
17 2HB SER 4 1HB SER 4 -4.373 0.582 -5.276
18 HG SER 4 HG SER 4 -4.679 -2.089 -5.315
19 H CYS 5 H CYS 5 -4.588 -0.163 -1.302
20 HA CYS 5 HA CYS 5 -5.403 -2.870 -0.579
21 1HB CYS 5 2HB CYS 5 -5.794 -1.660 1.687
22 2HB CYS 5 1HB CYS 5 -4.135 -1.906 1.153
23 H ALA 6 H ALA 6 -6.821 -1.560 -2.558
24 HA ALA 6 HA ALA 6 -9.097 -0.155 -1.791
25 1HB ALA 6 1HB ALA 6 -9.850 -1.582 -4.044
26 2HB ALA 6 2HB ALA 6 -8.099 -1.433 -4.180
27 3HB ALA 6 3HB ALA 6 -9.095 0.012 -4.006
28 H MET 7 H MET 7 -8.553 -3.598 -1.980
29 HA MET 7 HA MET 7 -11.333 -4.204 -1.393
30 1HB MET 7 2HB MET 7 -9.912 -5.579 -2.957
31 2HB MET 7 1HB MET 7 -9.000 -6.110 -1.559
32 1HG MET 7 2HG MET 7 -10.526 -7.828 -2.015
33 2HG MET 7 1HG MET 7 -11.163 -6.978 -0.612
34 1HE MET 7 1HE MET 7 -12.680 -5.124 -0.726
35 2HE MET 7 2HE MET 7 -14.201 -5.978 -0.974
36 3HE MET 7 3HE MET 7 -13.740 -4.666 -2.058
37 H ILE 8 H ILE 8 -8.214 -4.984 0.022
38 HA ILE 8 HA ILE 8 -9.449 -4.918 2.692
39 HB ILE 8 HB ILE 8 -7.788 -6.638 3.404
40 1HG1 ILE 8 2HG1 ILE 8 -7.330 -6.987 0.429
41 2HG1 ILE 8 1HG1 ILE 8 -6.174 -6.279 1.552
42 1HG2 ILE 8 1HG2 ILE 8 -10.094 -7.253 2.910
43 2HG2 ILE 8 2HG2 ILE 8 -8.985 -8.547 2.455
44 3HG2 ILE 8 3HG2 ILE 8 -9.675 -7.502 1.215
45 1HD1 ILE 8 1HD1 ILE 8 -6.181 -8.864 0.806
46 2HD1 ILE 8 2HD1 ILE 8 -7.150 -8.952 2.278
47 3HD1 ILE 8 3HD1 ILE 8 -5.522 -8.277 2.333
48 H SER 9 H SER 9 -8.217 -3.973 4.319
49 HA SER 9 HA SER 9 -6.308 -2.030 3.453
50 1HB SER 9 2HB SER 9 -7.957 -1.594 5.248
51 2HB SER 9 1HB SER 9 -7.151 -2.785 6.264
52 HG SER 9 HG SER 9 -5.231 -1.445 6.016
53 H PHE 10 H PHE 10 -5.242 -4.359 2.740
54 HA PHE 10 HA PHE 10 -2.791 -4.431 4.266
55 1HB PHE 10 2HB PHE 10 -4.069 -6.156 5.401
56 2HB PHE 10 1HB PHE 10 -4.466 -6.921 3.867
57 HD1 PHE 10 1HD PHE 10 -3.384 -8.923 3.612
58 HD2 PHE 10 2HD PHE 10 -1.309 -5.693 5.450
59 HE1 PHE 10 1HE PHE 10 -1.373 -10.325 3.799
60 HE2 PHE 10 2HE PHE 10 0.706 -7.089 5.638
61 HZ PHE 10 HZ PHE 10 0.677 -9.409 4.812
62 H CYS 11 H CYS 11 -1.385 -4.047 2.758
63 HA CYS 11 HA CYS 11 -1.789 -5.052 0.035
64 1HB CYS 11 2HB CYS 11 0.223 -3.108 1.176
65 2HB CYS 11 1HB CYS 11 0.137 -3.575 -0.516
66 H PHE 12 H PHE 12 -0.215 -6.309 -1.052
67 HA PHE 12 HA PHE 12 1.169 -8.130 0.663
68 1HB PHE 12 2HB PHE 12 2.076 -9.082 -1.492
69 2HB PHE 12 1HB PHE 12 0.327 -9.060 -1.348
70 HD1 PHE 12 1HD PHE 12 3.032 -6.815 -2.653
71 HD2 PHE 12 2HD PHE 12 -0.832 -8.504 -3.223
72 HE1 PHE 12 1HE PHE 12 2.865 -5.689 -4.833
73 HE2 PHE 12 2HE PHE 12 -1.006 -7.378 -5.402
74 HZ PHE 12 HZ PHE 12 0.844 -5.968 -6.211
75 H THR 13 H THR 13 2.022 -5.184 -0.890
76 HA THR 13 HA THR 13 4.873 -5.672 -0.446
77 HB THR 13 HB THR 13 4.295 -4.843 -2.657
78 HG1 THR 13 1HG THR 13 5.478 -2.650 -1.287
79 1HG2 THR 13 1HG2 THR 13 3.498 -2.394 -2.760
80 2HG2 THR 13 2HG2 THR 13 2.942 -2.664 -1.109
81 3HG2 THR 13 3HG2 THR 13 2.308 -3.651 -2.425
82 H GLU 14 H GLU 14 2.452 -4.539 1.444
83 HA GLU 14 HA GLU 14 3.755 -2.134 2.347
84 1HB GLU 14 2HB GLU 14 2.030 -1.899 3.963
85 2HB GLU 14 1HB GLU 14 1.285 -2.425 2.463
86 1HG GLU 14 2HG GLU 14 1.063 -4.667 3.318
87 2HG GLU 14 1HG GLU 14 1.912 -4.214 4.798
88 H VAL 15 H VAL 15 3.655 -5.470 3.335
89 HA VAL 15 HA VAL 15 4.760 -5.260 5.880
90 HB VAL 15 HB VAL 15 3.787 -7.330 4.995
91 1HG1 VAL 15 1HG1 VAL 15 4.922 -8.746 3.441
92 2HG1 VAL 15 2HG1 VAL 15 6.313 -7.665 3.392
93 3HG1 VAL 15 3HG1 VAL 15 4.768 -7.146 2.718
94 1HG2 VAL 15 1HG2 VAL 15 5.975 -8.788 5.628
95 2HG2 VAL 15 2HG2 VAL 15 4.922 -8.012 6.812
96 3HG2 VAL 15 3HG2 VAL 15 6.415 -7.221 6.307
97 H ILE 16 H ILE 16 6.304 -4.971 2.754
98 HA ILE 16 HA ILE 16 8.944 -5.144 3.973
99 HB ILE 16 HB ILE 16 9.833 -4.975 1.682
100 1HG1 ILE 16 2HG1 ILE 16 6.928 -5.062 0.838
101 2HG1 ILE 16 1HG1 ILE 16 7.968 -3.647 0.720
102 1HG2 ILE 16 1HG2 ILE 16 9.566 -7.158 2.497
103 2HG2 ILE 16 2HG2 ILE 16 8.841 -7.181 0.890
104 3HG2 ILE 16 3HG2 ILE 16 7.813 -7.101 2.321
105 1HD1 ILE 16 1HD1 ILE 16 9.468 -5.037 -0.760
106 2HD1 ILE 16 2HD1 ILE 16 7.896 -4.598 -1.427
107 3HD1 ILE 16 3HD1 ILE 16 8.164 -6.225 -0.802
108 H GLY 17 H GLY 17 6.794 -2.688 3.821
109 1HA GLY 17 2HA GLY 17 8.295 -0.654 4.608
110 2HA GLY 17 1HA GLY 17 8.731 -0.683 2.911
111 H CYS 18 H CYS 18 6.136 -1.315 1.888
112 HA CYS 18 HA CYS 18 5.080 1.289 1.684
113 1HB CYS 18 2HB CYS 18 3.839 -1.357 0.922
114 2HB CYS 18 1HB CYS 18 3.239 0.212 0.419
115 H SER 19 H SER 19 2.727 1.805 2.092
116 HA SER 19 HA SER 19 1.584 0.499 4.424
117 1HB SER 19 2HB SER 19 1.303 2.797 5.520
118 2HB SER 19 1HB SER 19 2.922 2.101 5.556
119 HG SER 19 HG SER 19 3.126 3.388 3.461
120 H CYS 20 H CYS 20 -0.606 0.547 4.416
121 HA CYS 20 HA CYS 20 -1.932 1.454 2.070
122 1HB CYS 20 2HB CYS 20 -2.722 -0.544 3.161
123 2HB CYS 20 1HB CYS 20 -2.987 0.321 4.670
124 H LYS 21 H LYS 21 -2.772 3.385 1.644
125 HA LYS 21 HA LYS 21 -3.855 5.026 3.785
126 1HB LYS 21 2HB LYS 21 -1.270 5.459 3.253
127 2HB LYS 21 1HB LYS 21 -1.955 6.400 1.937
128 1HG LYS 21 2HG LYS 21 -1.561 7.885 3.740
129 2HG LYS 21 1HG LYS 21 -3.307 7.636 3.647
130 1HD LYS 21 2HD LYS 21 -3.288 6.169 5.510
131 2HD LYS 21 1HD LYS 21 -1.530 6.040 5.480
132 1HE LYS 21 2HE LYS 21 -2.181 7.469 7.300
133 2HE LYS 21 1HE LYS 21 -1.386 8.439 6.064
134 1HZ LYS 21 1HZ LYS 21 -4.095 8.453 5.476
135 2HZ LYS 21 2HZ LYS 21 -3.161 9.737 6.056
136 3HZ LYS 21 3HZ LYS 21 -3.975 8.727 7.141
137 H ASN 22 H ASN 22 -5.689 5.911 3.054
138 HA ASN 22 HA ASN 22 -7.432 6.373 1.704
139 1HB ASN 22 2HB ASN 22 -7.070 7.983 -0.090
140 2HB ASN 22 1HB ASN 22 -6.147 8.417 1.335
141 1HD2 ASN 22 1HD2 ASN 22 -4.222 9.185 0.889
142 2HD2 ASN 22 2HD2 ASN 22 -3.234 8.764 -0.463
143 H LYS 23 H LYS 23 -6.487 3.783 1.387
144 HA LYS 23 HA LYS 23 -7.069 1.966 0.173
145 1HB LYS 23 2HB LYS 23 -9.025 2.759 -0.714
146 2HB LYS 23 1HB LYS 23 -8.251 4.106 -1.531
147 1HG LYS 23 2HG LYS 23 -7.444 2.611 -3.259
148 2HG LYS 23 1HG LYS 23 -8.126 1.226 -2.401
149 1HD LYS 23 2HD LYS 23 -9.686 3.555 -3.522
150 2HD LYS 23 1HD LYS 23 -9.581 1.946 -4.236
151 1HE LYS 23 2HE LYS 23 -10.609 1.000 -2.214
152 2HE LYS 23 1HE LYS 23 -10.741 2.621 -1.533
153 1HZ LYS 23 1HZ LYS 23 -11.973 1.929 -4.128
154 2HZ LYS 23 2HZ LYS 23 -12.335 3.225 -3.102
155 3HZ LYS 23 3HZ LYS 23 -12.778 1.652 -2.666
156 H VAL 24 H VAL 24 -4.759 4.221 -0.806
157 HA VAL 24 HA VAL 24 -3.604 2.255 -2.682
158 HB VAL 24 HB VAL 24 -2.979 5.212 -2.546
159 1HG1 VAL 24 1HG1 VAL 24 -2.180 3.082 -4.526
160 2HG1 VAL 24 2HG1 VAL 24 -1.121 3.921 -3.392
161 3HG1 VAL 24 3HG1 VAL 24 -1.874 4.808 -4.717
162 1HG2 VAL 24 1HG2 VAL 24 -4.646 5.660 -3.958
163 2HG2 VAL 24 2HG2 VAL 24 -5.285 4.068 -3.546
164 3HG2 VAL 24 3HG2 VAL 24 -4.266 4.265 -4.971
165 H CYS 25 H CYS 25 -1.563 1.453 -2.246
166 HA CYS 25 HA CYS 25 -0.502 2.185 0.358
167 1HB CYS 25 2HB CYS 25 -0.142 -0.147 -1.441
168 2HB CYS 25 1HB CYS 25 1.205 0.272 -0.388
169 H TYR 26 H TYR 26 1.163 3.405 0.741
170 HA TYR 26 HA TYR 26 2.934 4.138 -1.502
171 1HB TYR 26 2HB TYR 26 2.174 5.931 0.813
172 2HB TYR 26 1HB TYR 26 3.149 6.367 -0.581
173 HD1 TYR 26 1HD TYR 26 2.098 6.826 -2.736
174 HD2 TYR 26 2HD TYR 26 -0.234 5.815 0.675
175 HE1 TYR 26 1HE TYR 26 0.086 7.682 -3.864
176 HE2 TYR 26 2HE TYR 26 -2.252 6.659 -0.447
177 HH TYR 26 HH TYR 26 -3.119 7.282 -2.470
178 H LEU 27 H LEU 27 5.096 4.509 -1.006
179 HA LEU 27 HA LEU 27 6.017 3.587 1.630
180 1HB LEU 27 2HB LEU 27 6.426 2.056 -0.447
181 2HB LEU 27 1HB LEU 27 7.608 3.262 -0.909
182 HG LEU 27 HG LEU 27 7.697 1.777 1.719
183 1HD1 LEU 27 1HD1 LEU 27 9.055 0.167 0.805
184 2HD1 LEU 27 2HD1 LEU 27 9.520 1.180 -0.562
185 3HD1 LEU 27 3HD1 LEU 27 7.919 0.441 -0.517
186 1HD2 LEU 27 1HD2 LEU 27 10.160 2.475 1.465
187 2HD2 LEU 27 2HD2 LEU 27 8.993 3.701 1.961
188 3HD2 LEU 27 3HD2 LEU 27 9.559 3.646 0.290
189 H ASN 28 H ASN 28 6.513 5.458 2.572
190 HA ASN 28 HA ASN 28 7.439 7.489 3.005
191 1HB ASN 28 2HB ASN 28 9.532 6.196 2.401
192 2HB ASN 28 1HB ASN 28 9.393 6.862 0.779
193 1HD2 ASN 28 1HD2 ASN 28 10.697 8.506 0.463
194 2HD2 ASN 28 2HD2 ASN 28 11.148 9.693 1.633
195 H SER 29 H SER 29 5.230 7.551 1.517
196 HA SER 29 HA SER 29 3.929 8.991 0.363
197 1HB SER 29 2HB SER 29 6.436 10.606 -0.137
198 2HB SER 29 1HB SER 29 4.773 11.153 -0.358
199 HG SER 29 HG SER 29 6.261 11.098 1.887
200 H ILE 30 H ILE 30 6.407 7.211 -1.009
201 HA ILE 30 HA ILE 30 5.834 7.993 -3.756
202 HB ILE 30 HB ILE 30 7.606 5.767 -2.728
203 1HG1 ILE 30 2HG1 ILE 30 8.357 8.544 -3.673
204 2HG1 ILE 30 1HG1 ILE 30 8.323 8.028 -1.989
205 1HG2 ILE 30 1HG2 ILE 30 7.559 7.060 -5.451
206 2HG2 ILE 30 2HG2 ILE 30 6.794 5.517 -5.066
207 3HG2 ILE 30 3HG2 ILE 30 8.544 5.691 -4.936
208 1HD1 ILE 30 1HD1 ILE 30 9.931 6.155 -3.237
209 2HD1 ILE 30 2HD1 ILE 30 10.461 7.506 -2.235
210 3HD1 ILE 30 3HD1 ILE 30 10.377 7.687 -3.988
211 H SER 31 H SER 31 4.489 6.921 -5.108
212 HA SER 31 HA SER 31 2.589 5.098 -4.133
213 1HB SER 31 2HB SER 31 3.352 5.572 -7.019
214 2HB SER 31 1HB SER 31 1.809 4.970 -6.412
215 HG SER 31 HG SER 31 1.633 7.034 -5.296