NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
21987 |
2it8   |
7361 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 GLY 1 1H GLY 1 -9.386 -4.011 12.024
2 H2 GLY 1 2H GLY 1 -8.105 -5.014 11.842
3 H3 GLY 1 3H GLY 1 -8.014 -3.748 12.878
4 HA2 GLY 1 1HA GLY 1 -8.162 -2.164 11.084
5 HA3 GLY 1 2HA GLY 1 -6.771 -3.248 10.890
6 H VAL 2 H VAL 2 -7.436 -2.047 8.645
7 HA VAL 2 HA VAL 2 -8.293 -4.130 6.852
8 HB VAL 2 HB VAL 2 -10.520 -3.305 7.587
9 HG11 VAL 2 1HG1 VAL 2 -9.959 -0.931 8.059
10 HG12 VAL 2 2HG1 VAL 2 -9.772 -0.637 6.316
11 HG13 VAL 2 3HG1 VAL 2 -11.350 -1.096 6.980
12 HG21 VAL 2 3HG2 VAL 2 -11.537 -3.093 5.434
13 HG22 VAL 2 1HG2 VAL 2 -10.022 -2.569 4.687
14 HG23 VAL 2 2HG2 VAL 2 -10.186 -4.232 5.301
15 H CYS 3 H CYS 3 -7.787 -3.585 4.652
16 HA CYS 3 HA CYS 3 -5.902 -1.296 4.389
17 HB2 CYS 3 1HB CYS 3 -5.004 -3.413 3.709
18 HB3 CYS 3 2HB CYS 3 -6.396 -3.778 2.714
19 HA PRO 4 HA PRO 4 -9.382 0.875 2.390
20 HB2 PRO 4 1HB PRO 4 -7.108 2.737 1.685
21 HB3 PRO 4 2HB PRO 4 -8.760 3.140 2.249
22 HG2 PRO 4 1HG PRO 4 -6.687 3.208 3.983
23 HG3 PRO 4 2HG PRO 4 -8.234 2.446 4.484
24 HD2 PRO 4 1HD PRO 4 -5.710 1.108 3.496
25 HD3 PRO 4 2HD PRO 4 -6.753 0.674 4.882
26 H LYS 5 H LYS 5 -10.094 1.259 0.263
27 HA LYS 5 HA LYS 5 -8.916 -0.489 -1.725
28 HB2 LYS 5 1HB LYS 5 -11.375 1.315 -1.780
29 HB3 LYS 5 2HB LYS 5 -10.971 0.106 -3.006
30 HG2 LYS 5 1HG LYS 5 -11.073 -1.690 -1.290
31 HG3 LYS 5 2HG LYS 5 -11.568 -0.492 -0.077
32 HD2 LYS 5 1HD LYS 5 -13.570 0.064 -1.434
33 HD3 LYS 5 2HD LYS 5 -13.081 -1.144 -2.645
34 HE2 LYS 5 1HE LYS 5 -13.203 -2.925 -0.911
35 HE3 LYS 5 2HE LYS 5 -13.693 -1.724 0.293
36 HZ1 LYS 5 3HZ LYS 5 -15.607 -2.885 -0.629
37 HZ2 LYS 5 1HZ LYS 5 -15.689 -1.306 -1.036
38 HZ3 LYS 5 2HZ LYS 5 -15.235 -2.417 -2.148
39 H ILE 6 H ILE 6 -7.472 2.068 -1.080
40 HA ILE 6 HA ILE 6 -7.555 3.720 -3.523
41 HB ILE 6 HB ILE 6 -5.886 5.099 -2.430
42 HG12 ILE 6 1HG1 ILE 6 -5.773 2.976 -0.239
43 HG13 ILE 6 2HG1 ILE 6 -4.490 3.388 -1.373
44 HG21 ILE 6 1HG2 ILE 6 -8.323 5.308 -1.859
45 HG22 ILE 6 2HG2 ILE 6 -8.025 4.350 -0.391
46 HG23 ILE 6 3HG2 ILE 6 -7.237 5.925 -0.614
47 HD11 ILE 6 3HD1 ILE 6 -3.956 4.411 0.700
48 HD12 ILE 6 1HD1 ILE 6 -4.441 5.713 -0.402
49 HD13 ILE 6 2HD1 ILE 6 -5.562 5.140 0.861
50 H LEU 7 H LEU 7 -5.683 4.208 -4.817
51 HA LEU 7 HA LEU 7 -3.708 1.977 -5.077
52 HB2 LEU 7 1HB LEU 7 -5.196 2.387 -7.039
53 HB3 LEU 7 2HB LEU 7 -4.604 4.043 -7.126
54 HG LEU 7 HG LEU 7 -2.301 3.172 -7.571
55 HD11 LEU 7 1HD1 LEU 7 -2.443 0.929 -6.520
56 HD12 LEU 7 2HD1 LEU 7 -3.677 0.444 -7.701
57 HD13 LEU 7 3HD1 LEU 7 -2.014 0.787 -8.226
58 HD21 LEU 7 3HD2 LEU 7 -2.748 2.457 -9.880
59 HD22 LEU 7 1HD2 LEU 7 -4.451 2.149 -9.469
60 HD23 LEU 7 2HD2 LEU 7 -3.800 3.803 -9.415
61 H LYS 8 H LYS 8 -2.395 2.659 -3.424
62 HA LYS 8 HA LYS 8 -1.076 5.344 -3.624
63 HB2 LYS 8 1HB LYS 8 -2.371 4.762 -1.540
64 HB3 LYS 8 2HB LYS 8 -1.243 3.427 -1.241
65 HG2 LYS 8 1HG LYS 8 0.636 5.092 -1.175
66 HG3 LYS 8 2HG LYS 8 -0.534 6.398 -1.460
67 HD2 LYS 8 1HD LYS 8 -1.712 5.657 0.665
68 HD3 LYS 8 2HD LYS 8 -0.355 4.554 0.953
69 HE2 LYS 8 1HE LYS 8 -0.144 7.590 0.638
70 HE3 LYS 8 2HE LYS 8 -0.210 6.747 2.188
71 HZ1 LYS 8 3HZ LYS 8 2.065 7.244 1.569
72 HZ2 LYS 8 1HZ LYS 8 1.861 5.621 1.617
73 HZ3 LYS 8 2HZ LYS 8 1.946 6.404 0.172
74 H LYS 9 H LYS 9 1.068 5.379 -4.257
75 HA LYS 9 HA LYS 9 2.472 2.906 -4.822
76 HB2 LYS 9 1HB LYS 9 4.298 4.314 -5.565
77 HB3 LYS 9 2HB LYS 9 2.753 4.858 -6.220
78 HG2 LYS 9 1HG LYS 9 2.629 6.639 -4.525
79 HG3 LYS 9 2HG LYS 9 4.145 6.070 -3.810
80 HD2 LYS 9 1HD LYS 9 4.595 8.020 -5.178
81 HD3 LYS 9 2HD LYS 9 5.342 6.600 -5.926
82 HE2 LYS 9 1HE LYS 9 3.436 6.433 -7.520
83 HE3 LYS 9 2HE LYS 9 2.656 7.817 -6.740
84 HZ1 LYS 9 3HZ LYS 9 3.865 8.483 -8.729
85 HZ2 LYS 9 1HZ LYS 9 4.550 9.183 -7.422
86 HZ3 LYS 9 2HZ LYS 9 5.274 7.903 -8.140
87 H CYS 10 H CYS 10 4.568 2.278 -4.021
88 HA CYS 10 HA CYS 10 5.417 3.163 -1.334
89 HB2 CYS 10 1HB CYS 10 5.017 0.954 -0.282
90 HB3 CYS 10 2HB CYS 10 3.540 1.760 -0.776
91 H ARG 11 H ARG 11 7.335 2.415 -0.599
92 HA ARG 11 HA ARG 11 9.178 0.965 -2.444
93 HB2 ARG 11 1HB ARG 11 9.648 2.297 0.255
94 HB3 ARG 11 2HB ARG 11 10.892 1.687 -0.825
95 HG2 ARG 11 1HG ARG 11 10.525 3.403 -2.440
96 HG3 ARG 11 2HG ARG 11 9.005 3.925 -1.706
97 HD2 ARG 11 1HD ARG 11 11.707 4.134 -0.337
98 HD3 ARG 11 2HD ARG 11 10.910 5.445 -1.225
99 HE ARG 11 HE ARG 11 9.045 4.478 0.680
100 HH11 ARG 11 1HH1 ARG 11 12.164 6.166 0.756
101 HH12 ARG 11 2HH1 ARG 11 11.798 6.960 2.260
102 HH21 ARG 11 1HH2 ARG 11 8.612 5.561 2.557
103 HH22 ARG 11 2HH2 ARG 11 9.810 6.609 3.284
104 H ARG 12 H ARG 12 7.433 0.688 0.574
105 HA ARG 12 HA ARG 12 7.702 -2.143 0.949
106 HB2 ARG 12 1HB ARG 12 8.937 -2.036 3.109
107 HB3 ARG 12 2HB ARG 12 9.949 -1.566 1.755
108 HG2 ARG 12 1HG ARG 12 9.747 0.794 2.301
109 HG3 ARG 12 2HG ARG 12 8.538 0.472 3.546
110 HD2 ARG 12 1HD ARG 12 11.409 -0.549 3.645
111 HD3 ARG 12 2HD ARG 12 10.855 0.946 4.389
112 HE ARG 12 HE ARG 12 9.464 -0.244 5.915
113 HH11 ARG 12 1HH1 ARG 12 11.638 -2.450 4.171
114 HH12 ARG 12 2HH1 ARG 12 11.410 -3.714 5.341
115 HH21 ARG 12 1HH2 ARG 12 9.223 -1.892 7.341
116 HH22 ARG 12 2HH2 ARG 12 10.065 -3.399 7.125
117 H ASP 13 H ASP 13 6.808 -2.710 3.217
118 HA ASP 13 HA ASP 13 4.123 -1.922 3.196
119 HB2 ASP 13 1HB ASP 13 5.612 -3.086 5.578
120 HB3 ASP 13 2HB ASP 13 3.886 -3.208 5.249
121 H SER 14 H SER 14 6.761 -0.492 5.054
122 HA SER 14 HA SER 14 5.314 1.026 6.955
123 HB2 SER 14 1HB SER 14 7.908 1.779 5.557
124 HB3 SER 14 2HB SER 14 7.362 2.335 7.143
125 HG SER 14 HG SER 14 7.636 0.272 7.953
126 H ASP 15 H ASP 15 5.478 1.559 3.504
127 HA ASP 15 HA ASP 15 4.651 4.409 3.694
128 HB2 ASP 15 1HB ASP 15 5.053 2.526 1.343
129 HB3 ASP 15 2HB ASP 15 4.541 4.201 1.192
130 H CYS 16 H CYS 16 3.102 1.392 3.933
131 HA CYS 16 HA CYS 16 0.642 2.259 2.517
132 HB2 CYS 16 1HB CYS 16 1.569 -0.475 3.450
133 HB3 CYS 16 2HB CYS 16 0.071 -0.133 2.611
134 HA PRO 17 HA PRO 17 -1.276 3.066 6.351
135 HB2 PRO 17 1HB PRO 17 -3.659 3.975 5.538
136 HB3 PRO 17 2HB PRO 17 -2.133 4.724 4.939
137 HG2 PRO 17 1HG PRO 17 -3.791 2.603 3.524
138 HG3 PRO 17 2HG PRO 17 -3.271 4.205 2.901
139 HD2 PRO 17 1HD PRO 17 -1.801 1.938 2.451
140 HD3 PRO 17 2HD PRO 17 -1.045 3.538 2.721
141 H GLY 18 H GLY 18 -2.848 2.376 7.886
142 HA2 GLY 18 1HA GLY 18 -4.245 0.876 8.975
143 HA3 GLY 18 2HA GLY 18 -4.960 0.544 7.389
144 H ALA 19 H ALA 19 -4.977 -1.546 6.980
145 HA ALA 19 HA ALA 19 -2.781 -3.340 7.898
146 HB1 ALA 19 3HB ALA 19 -4.342 -5.141 7.483
147 HB2 ALA 19 1HB ALA 19 -5.163 -3.896 8.436
148 HB3 ALA 19 2HB ALA 19 -5.484 -4.051 6.687
149 H CYS 20 H CYS 20 -3.030 -1.430 5.240
150 HA CYS 20 HA CYS 20 -2.709 -3.300 3.061
151 HB2 CYS 20 1HB CYS 20 -1.804 -0.414 3.316
152 HB3 CYS 20 2HB CYS 20 -1.696 -1.361 1.866
153 H ILE 21 H ILE 21 -0.938 -4.082 2.052
154 HA ILE 21 HA ILE 21 1.806 -3.660 3.203
155 HB ILE 21 HB ILE 21 2.314 -5.971 2.402
156 HG12 ILE 21 1HG1 ILE 21 -0.698 -6.421 2.278
157 HG13 ILE 21 2HG1 ILE 21 0.316 -6.177 0.857
158 HG21 ILE 21 1HG2 ILE 21 1.883 -5.391 4.787
159 HG22 ILE 21 2HG2 ILE 21 0.178 -5.844 4.574
160 HG23 ILE 21 3HG2 ILE 21 1.460 -7.061 4.405
161 HD11 ILE 21 3HD1 ILE 21 -0.032 -8.538 1.156
162 HD12 ILE 21 1HD1 ILE 21 1.672 -8.178 1.499
163 HD13 ILE 21 2HD1 ILE 21 0.532 -8.476 2.834
164 H CYS 22 H CYS 22 3.532 -3.833 1.603
165 HA CYS 22 HA CYS 22 2.725 -2.473 -0.892
166 HB2 CYS 22 1HB CYS 22 4.693 -1.787 0.552
167 HB3 CYS 22 2HB CYS 22 5.511 -3.255 0.028
168 H ARG 23 H ARG 23 2.430 -3.449 -2.802
169 HA ARG 23 HA ARG 23 3.023 -6.353 -3.070
170 HB2 ARG 23 1HB ARG 23 1.264 -4.612 -4.822
171 HB3 ARG 23 2HB ARG 23 1.356 -6.368 -4.802
172 HG2 ARG 23 1HG ARG 23 0.147 -4.527 -2.717
173 HG3 ARG 23 2HG ARG 23 -0.663 -5.736 -3.699
174 HD2 ARG 23 1HD ARG 23 1.250 -6.234 -1.386
175 HD3 ARG 23 2HD ARG 23 -0.489 -6.483 -1.398
176 HE ARG 23 HE ARG 23 -0.160 -8.244 -3.120
177 HH11 ARG 23 1HH1 ARG 23 2.640 -7.550 -1.024
178 HH12 ARG 23 2HH1 ARG 23 3.247 -9.167 -1.193
179 HH21 ARG 23 1HH2 ARG 23 0.723 -10.274 -3.298
180 HH22 ARG 23 2HH2 ARG 23 2.195 -10.673 -2.469
181 H GLY 24 H GLY 24 3.554 -7.105 -5.324
182 HA2 GLY 24 1HA GLY 24 6.174 -6.214 -5.912
183 HA3 GLY 24 2HA GLY 24 5.235 -7.375 -6.872
184 H ASN 25 H ASN 25 3.206 -5.044 -7.296
185 HA ASN 25 HA ASN 25 4.426 -3.856 -9.666
186 HB2 ASN 25 1HB ASN 25 2.268 -2.879 -10.041
187 HB3 ASN 25 2HB ASN 25 2.058 -4.565 -9.598
188 HD21 ASN 25 1HD2 ASN 25 -0.132 -2.917 -9.458
189 HD22 ASN 25 2HD2 ASN 25 -0.527 -2.602 -7.776
190 H GLY 26 H GLY 26 4.635 -3.018 -6.381
191 HA2 GLY 26 1HA GLY 26 5.801 -1.212 -5.470
192 HA3 GLY 26 2HA GLY 26 5.645 -0.303 -6.993
193 H TYR 27 H TYR 27 2.726 -1.700 -5.673
194 HA TYR 27 HA TYR 27 1.943 0.886 -4.387
195 HB2 TYR 27 1HB TYR 27 0.409 -0.726 -6.469
196 HB3 TYR 27 2HB TYR 27 -0.377 0.374 -5.361
197 HD1 TYR 27 HD1 TYR 27 2.379 0.297 -7.933
198 HD2 TYR 27 HD2 TYR 27 -0.575 2.631 -5.851
199 HE1 TYR 27 HE1 TYR 27 3.036 2.286 -9.251
200 HE2 TYR 27 HE2 TYR 27 0.049 4.630 -7.190
201 HH TYR 27 HH TYR 27 2.613 4.500 -9.701
202 H CYS 28 H CYS 28 0.261 0.747 -2.851
203 HA CYS 28 HA CYS 28 0.473 -1.472 -1.024
204 HB2 CYS 28 1HB CYS 28 -1.318 0.986 -1.074
205 HB3 CYS 28 2HB CYS 28 -1.116 -0.054 0.331
206 H GLY 29 H GLY 29 -0.888 -3.117 -0.573
207 HA2 GLY 29 1HA GLY 29 -3.704 -3.185 -1.463
208 HA3 GLY 29 2HA GLY 29 -2.644 -4.349 -2.238
209 HN1 NH2 30 2HN NH2 30 -3.957 -6.328 0.486
210 HN2 NH2 30 1HN NH2 30 -4.353 -5.784 -1.133
Start of MODEL 2
1 H1 GLY 1 1H GLY 1 -9.099 -3.985 12.147
2 H2 GLY 1 2H GLY 1 -7.755 -4.910 12.020
3 H3 GLY 1 3H GLY 1 -7.747 -3.582 12.976
4 HA2 GLY 1 1HA GLY 1 -8.003 -2.121 11.092
5 HA3 GLY 1 2HA GLY 1 -6.542 -3.119 10.956
6 H VAL 2 H VAL 2 -7.344 -2.069 8.653
7 HA VAL 2 HA VAL 2 -8.011 -4.309 6.974
8 HB VAL 2 HB VAL 2 -10.301 -3.667 7.714
9 HG11 VAL 2 1HG1 VAL 2 -9.970 -1.227 8.039
10 HG12 VAL 2 2HG1 VAL 2 -9.841 -1.018 6.278
11 HG13 VAL 2 3HG1 VAL 2 -11.355 -1.591 7.000
12 HG21 VAL 2 3HG2 VAL 2 -11.363 -3.685 5.574
13 HG22 VAL 2 1HG2 VAL 2 -9.918 -3.060 4.767
14 HG23 VAL 2 2HG2 VAL 2 -9.907 -4.691 5.481
15 H CYS 3 H CYS 3 -7.604 -3.804 4.732
16 HA CYS 3 HA CYS 3 -5.918 -1.390 4.346
17 HB2 CYS 3 1HB CYS 3 -4.973 -3.488 3.614
18 HB3 CYS 3 2HB CYS 3 -6.397 -3.874 2.668
19 HA PRO 4 HA PRO 4 -9.673 0.470 2.537
20 HB2 PRO 4 1HB PRO 4 -7.744 2.665 1.829
21 HB3 PRO 4 2HB PRO 4 -9.359 2.780 2.586
22 HG2 PRO 4 1HG PRO 4 -7.110 3.056 4.080
23 HG3 PRO 4 2HG PRO 4 -8.494 2.097 4.703
24 HD2 PRO 4 1HD PRO 4 -5.970 1.099 3.361
25 HD3 PRO 4 2HD PRO 4 -6.761 0.521 4.856
26 H LYS 5 H LYS 5 -10.381 1.169 0.390
27 HA LYS 5 HA LYS 5 -9.177 -0.415 -1.729
28 HB2 LYS 5 1HB LYS 5 -11.617 1.407 -1.683
29 HB3 LYS 5 2HB LYS 5 -11.184 0.307 -3.000
30 HG2 LYS 5 1HG LYS 5 -11.290 -1.619 -1.394
31 HG3 LYS 5 2HG LYS 5 -11.914 -0.521 -0.157
32 HD2 LYS 5 1HD LYS 5 -13.231 -1.105 -2.846
33 HD3 LYS 5 2HD LYS 5 -13.698 -1.802 -1.288
34 HE2 LYS 5 1HE LYS 5 -14.206 0.482 -0.419
35 HE3 LYS 5 2HE LYS 5 -13.784 1.168 -1.996
36 HZ1 LYS 5 3HZ LYS 5 -16.170 0.841 -1.787
37 HZ2 LYS 5 1HZ LYS 5 -15.597 -0.127 -2.971
38 HZ3 LYS 5 2HZ LYS 5 -15.989 -0.758 -1.513
39 H ILE 6 H ILE 6 -7.453 1.651 -0.928
40 HA ILE 6 HA ILE 6 -7.426 3.786 -2.983
41 HB ILE 6 HB ILE 6 -5.377 4.559 -1.756
42 HG12 ILE 6 1HG1 ILE 6 -4.952 3.784 0.522
43 HG13 ILE 6 2HG1 ILE 6 -6.046 2.427 0.322
44 HG21 ILE 6 1HG2 ILE 6 -7.629 5.433 -1.321
45 HG22 ILE 6 2HG2 ILE 6 -7.887 4.195 -0.075
46 HG23 ILE 6 3HG2 ILE 6 -6.635 5.434 0.141
47 HD11 ILE 6 3HD1 ILE 6 -3.606 1.870 0.158
48 HD12 ILE 6 1HD1 ILE 6 -4.543 1.359 -1.246
49 HD13 ILE 6 2HD1 ILE 6 -3.526 2.822 -1.336
50 H LEU 7 H LEU 7 -5.241 4.312 -3.967
51 HA LEU 7 HA LEU 7 -3.603 1.956 -4.679
52 HB2 LEU 7 1HB LEU 7 -5.266 2.274 -6.515
53 HB3 LEU 7 2HB LEU 7 -4.711 3.932 -6.719
54 HG LEU 7 HG LEU 7 -2.442 3.068 -7.345
55 HD11 LEU 7 1HD1 LEU 7 -2.471 0.864 -6.199
56 HD12 LEU 7 2HD1 LEU 7 -3.787 0.324 -7.259
57 HD13 LEU 7 3HD1 LEU 7 -2.178 0.669 -7.928
58 HD21 LEU 7 3HD2 LEU 7 -3.095 2.263 -9.575
59 HD22 LEU 7 1HD2 LEU 7 -4.748 1.957 -8.996
60 HD23 LEU 7 2HD2 LEU 7 -4.115 3.617 -9.063
61 H LYS 8 H LYS 8 -2.145 2.695 -3.213
62 HA LYS 8 HA LYS 8 -0.885 5.388 -3.586
63 HB2 LYS 8 1HB LYS 8 -2.049 4.843 -1.390
64 HB3 LYS 8 2HB LYS 8 -0.863 3.551 -1.137
65 HG2 LYS 8 1HG LYS 8 0.958 5.320 -1.317
66 HG3 LYS 8 2HG LYS 8 -0.316 6.546 -1.432
67 HD2 LYS 8 1HD LYS 8 -1.142 5.809 0.829
68 HD3 LYS 8 2HD LYS 8 0.225 4.665 0.898
69 HE2 LYS 8 1HE LYS 8 1.802 6.597 0.569
70 HE3 LYS 8 2HE LYS 8 0.423 7.704 0.627
71 HZ1 LYS 8 3HZ LYS 8 1.494 7.539 2.780
72 HZ2 LYS 8 1HZ LYS 8 -0.007 6.905 2.904
73 HZ3 LYS 8 2HZ LYS 8 1.309 5.913 2.823
74 H LYS 9 H LYS 9 1.300 5.455 -4.175
75 HA LYS 9 HA LYS 9 2.663 2.972 -4.842
76 HB2 LYS 9 1HB LYS 9 2.874 5.347 -5.917
77 HB3 LYS 9 2HB LYS 9 4.023 5.651 -4.595
78 HG2 LYS 9 1HG LYS 9 5.451 3.818 -5.371
79 HG3 LYS 9 2HG LYS 9 4.260 3.381 -6.610
80 HD2 LYS 9 1HD LYS 9 4.575 5.599 -7.684
81 HD3 LYS 9 2HD LYS 9 5.770 6.025 -6.439
82 HE2 LYS 9 1HE LYS 9 7.171 4.083 -7.129
83 HE3 LYS 9 2HE LYS 9 5.983 3.667 -8.374
84 HZ1 LYS 9 3HZ LYS 9 7.817 4.954 -9.293
85 HZ2 LYS 9 1HZ LYS 9 6.439 5.817 -9.427
86 HZ3 LYS 9 2HZ LYS 9 7.535 6.199 -8.275
87 H CYS 10 H CYS 10 4.774 2.391 -4.010
88 HA CYS 10 HA CYS 10 5.541 3.155 -1.270
89 HB2 CYS 10 1HB CYS 10 5.085 0.936 -0.265
90 HB3 CYS 10 2HB CYS 10 3.638 1.791 -0.761
91 H ARG 11 H ARG 11 7.412 2.387 -0.489
92 HA ARG 11 HA ARG 11 9.322 0.980 -2.290
93 HB2 ARG 11 1HB ARG 11 9.668 2.225 0.470
94 HB3 ARG 11 2HB ARG 11 10.962 1.626 -0.559
95 HG2 ARG 11 1HG ARG 11 10.685 3.382 -2.154
96 HG3 ARG 11 2HG ARG 11 9.143 3.907 -1.473
97 HD2 ARG 11 1HD ARG 11 11.784 4.041 0.018
98 HD3 ARG 11 2HD ARG 11 11.055 5.385 -0.879
99 HE ARG 11 HE ARG 11 9.079 4.431 0.909
100 HH11 ARG 11 1HH1 ARG 11 12.244 6.010 1.191
101 HH12 ARG 11 2HH1 ARG 11 11.824 6.782 2.691
102 HH21 ARG 11 1HH2 ARG 11 8.581 5.493 2.782
103 HH22 ARG 11 2HH2 ARG 11 9.773 6.479 3.600
104 H ARG 12 H ARG 12 7.550 0.670 0.731
105 HA ARG 12 HA ARG 12 7.631 -2.190 0.913
106 HB2 ARG 12 1HB ARG 12 8.926 -2.437 2.943
107 HB3 ARG 12 2HB ARG 12 9.940 -1.674 1.729
108 HG2 ARG 12 1HG ARG 12 9.415 0.576 2.778
109 HG3 ARG 12 2HG ARG 12 8.535 -0.283 4.046
110 HD2 ARG 12 1HD ARG 12 11.496 -0.546 3.404
111 HD3 ARG 12 2HD ARG 12 10.812 0.338 4.764
112 HE ARG 12 HE ARG 12 11.222 -2.534 4.521
113 HH11 ARG 12 1HH1 ARG 12 9.288 -0.140 6.314
114 HH12 ARG 12 2HH1 ARG 12 9.109 -1.212 7.674
115 HH21 ARG 12 1HH2 ARG 12 10.873 -3.854 6.278
116 HH22 ARG 12 2HH2 ARG 12 9.952 -3.288 7.637
117 H ASP 13 H ASP 13 6.761 -2.766 3.276
118 HA ASP 13 HA ASP 13 4.088 -1.969 3.152
119 HB2 ASP 13 1HB ASP 13 5.498 -3.167 5.565
120 HB3 ASP 13 2HB ASP 13 3.776 -3.256 5.204
121 H SER 14 H SER 14 6.620 -0.442 5.101
122 HA SER 14 HA SER 14 4.870 0.921 6.941
123 HB2 SER 14 1HB SER 14 6.901 2.282 7.439
124 HB3 SER 14 2HB SER 14 7.135 0.538 7.547
125 HG SER 14 HG SER 14 8.041 2.314 5.529
126 H ASP 15 H ASP 15 5.408 1.556 3.596
127 HA ASP 15 HA ASP 15 4.627 4.417 3.768
128 HB2 ASP 15 1HB ASP 15 5.005 2.507 1.432
129 HB3 ASP 15 2HB ASP 15 4.513 4.188 1.263
130 H CYS 16 H CYS 16 3.038 1.351 3.772
131 HA CYS 16 HA CYS 16 0.651 2.295 2.336
132 HB2 CYS 16 1HB CYS 16 1.443 -0.431 3.403
133 HB3 CYS 16 2HB CYS 16 -0.009 -0.078 2.491
134 HA PRO 17 HA PRO 17 -1.536 3.355 5.917
135 HB2 PRO 17 1HB PRO 17 -3.925 4.030 4.899
136 HB3 PRO 17 2HB PRO 17 -2.408 4.811 4.319
137 HG2 PRO 17 1HG PRO 17 -3.869 2.486 3.017
138 HG3 PRO 17 2HG PRO 17 -3.376 4.046 2.273
139 HD2 PRO 17 1HD PRO 17 -1.794 1.819 2.131
140 HD3 PRO 17 2HD PRO 17 -1.122 3.469 2.279
141 H GLY 18 H GLY 18 -3.018 2.670 7.511
142 HA2 GLY 18 1HA GLY 18 -4.325 1.171 8.716
143 HA3 GLY 18 2HA GLY 18 -5.044 0.700 7.167
144 H ALA 19 H ALA 19 -4.955 -1.418 6.911
145 HA ALA 19 HA ALA 19 -2.594 -2.999 7.827
146 HB1 ALA 19 3HB ALA 19 -4.045 -4.923 7.685
147 HB2 ALA 19 1HB ALA 19 -4.890 -3.658 8.588
148 HB3 ALA 19 2HB ALA 19 -5.315 -3.989 6.886
149 H CYS 20 H CYS 20 -3.052 -1.300 5.115
150 HA CYS 20 HA CYS 20 -2.754 -3.231 2.985
151 HB2 CYS 20 1HB CYS 20 -1.905 -0.332 3.171
152 HB3 CYS 20 2HB CYS 20 -1.788 -1.290 1.733
153 H ILE 21 H ILE 21 -1.006 -4.007 1.936
154 HA ILE 21 HA ILE 21 1.744 -3.638 3.091
155 HB ILE 21 HB ILE 21 2.198 -5.968 2.311
156 HG12 ILE 21 1HG1 ILE 21 -0.824 -6.346 2.176
157 HG13 ILE 21 2HG1 ILE 21 0.199 -6.134 0.756
158 HG21 ILE 21 1HG2 ILE 21 1.768 -5.357 4.687
159 HG22 ILE 21 2HG2 ILE 21 0.053 -5.768 4.469
160 HG23 ILE 21 3HG2 ILE 21 1.305 -7.018 4.317
161 HD11 ILE 21 3HD1 ILE 21 -0.205 -8.485 1.071
162 HD12 ILE 21 1HD1 ILE 21 1.507 -8.161 1.411
163 HD13 ILE 21 2HD1 ILE 21 0.360 -8.424 2.748
164 H CYS 22 H CYS 22 3.474 -3.842 1.521
165 HA CYS 22 HA CYS 22 2.721 -2.481 -0.992
166 HB2 CYS 22 1HB CYS 22 4.650 -1.799 0.507
167 HB3 CYS 22 2HB CYS 22 5.485 -3.264 -0.012
168 H ARG 23 H ARG 23 2.405 -3.486 -2.874
169 HA ARG 23 HA ARG 23 2.989 -6.388 -3.120
170 HB2 ARG 23 1HB ARG 23 1.278 -4.631 -4.907
171 HB3 ARG 23 2HB ARG 23 1.344 -6.387 -4.881
172 HG2 ARG 23 1HG ARG 23 0.144 -4.529 -2.802
173 HG3 ARG 23 2HG ARG 23 -0.681 -5.709 -3.807
174 HD2 ARG 23 1HD ARG 23 1.202 -6.281 -1.485
175 HD3 ARG 23 2HD ARG 23 -0.544 -6.480 -1.507
176 HE ARG 23 HE ARG 23 -0.252 -8.223 -3.262
177 HH11 ARG 23 1HH1 ARG 23 2.518 -7.660 -1.092
178 HH12 ARG 23 2HH1 ARG 23 3.091 -9.285 -1.295
179 HH21 ARG 23 1HH2 ARG 23 0.580 -10.271 -3.476
180 HH22 ARG 23 2HH2 ARG 23 2.024 -10.731 -2.628
181 H GLY 24 H GLY 24 3.509 -7.148 -5.397
182 HA2 GLY 24 1HA GLY 24 6.157 -6.321 -5.965
183 HA3 GLY 24 2HA GLY 24 5.190 -7.446 -6.940
184 H ASN 25 H ASN 25 3.224 -5.064 -7.348
185 HA ASN 25 HA ASN 25 4.490 -3.871 -9.693
186 HB2 ASN 25 1HB ASN 25 2.348 -2.863 -10.087
187 HB3 ASN 25 2HB ASN 25 2.113 -4.552 -9.667
188 HD21 ASN 25 1HD2 ASN 25 -0.068 -2.909 -9.531
189 HD22 ASN 25 2HD2 ASN 25 -0.478 -2.597 -7.852
190 H GLY 26 H GLY 26 4.718 -3.090 -6.412
191 HA2 GLY 26 1HA GLY 26 5.891 -1.309 -5.465
192 HA3 GLY 26 2HA GLY 26 5.745 -0.373 -6.974
193 H TYR 27 H TYR 27 2.776 -1.728 -5.779
194 HA TYR 27 HA TYR 27 2.041 0.822 -4.415
195 HB2 TYR 27 1HB TYR 27 0.564 -0.644 -6.612
196 HB3 TYR 27 2HB TYR 27 -0.290 0.338 -5.446
197 HD1 TYR 27 HD2 TYR 27 2.581 0.557 -7.889
198 HD2 TYR 27 HD1 TYR 27 -0.592 2.597 -5.814
199 HE1 TYR 27 HE2 TYR 27 3.136 2.641 -9.105
200 HE2 TYR 27 HE1 TYR 27 -0.077 4.683 -7.063
201 HH TYR 27 HH TYR 27 2.565 4.839 -9.488
202 H CYS 28 H CYS 28 0.338 0.751 -2.946
203 HA CYS 28 HA CYS 28 0.458 -1.475 -1.124
204 HB2 CYS 28 1HB CYS 28 -1.257 1.035 -1.177
205 HB3 CYS 28 2HB CYS 28 -1.089 -0.020 0.226
206 H GLY 29 H GLY 29 -0.930 -3.086 -0.694
207 HA2 GLY 29 1HA GLY 29 -3.751 -3.087 -1.570
208 HA3 GLY 29 2HA GLY 29 -2.719 -4.271 -2.355
209 HN1 NH2 30 2HN NH2 30 -4.030 -6.250 0.364
210 HN2 NH2 30 1HN NH2 30 -4.412 -5.708 -1.259
Start of MODEL 3
1 H1 GLY 1 1H GLY 1 -9.254 -3.437 12.214
2 H2 GLY 1 2H GLY 1 -7.924 -4.387 12.116
3 H3 GLY 1 3H GLY 1 -7.895 -3.031 13.032
4 HA2 GLY 1 1HA GLY 1 -8.127 -1.623 11.105
5 HA3 GLY 1 2HA GLY 1 -6.683 -2.650 10.999
6 H VAL 2 H VAL 2 -7.401 -1.698 8.659
7 HA VAL 2 HA VAL 2 -8.169 -3.976 7.073
8 HB VAL 2 HB VAL 2 -10.428 -3.188 7.732
9 HG11 VAL 2 1HG1 VAL 2 -9.976 -0.759 7.986
10 HG12 VAL 2 2HG1 VAL 2 -9.801 -0.615 6.222
11 HG13 VAL 2 3HG1 VAL 2 -11.357 -1.083 6.929
12 HG21 VAL 2 3HG2 VAL 2 -11.451 -3.217 5.570
13 HG22 VAL 2 1HG2 VAL 2 -9.958 -2.698 4.775
14 HG23 VAL 2 2HG2 VAL 2 -10.052 -4.303 5.539
15 H CYS 3 H CYS 3 -7.672 -3.641 4.839
16 HA CYS 3 HA CYS 3 -5.839 -1.360 4.364
17 HB2 CYS 3 1HB CYS 3 -4.974 -3.532 3.819
18 HB3 CYS 3 2HB CYS 3 -6.385 -3.943 2.870
19 HA PRO 4 HA PRO 4 -9.432 0.516 2.264
20 HB2 PRO 4 1HB PRO 4 -8.332 2.937 1.571
21 HB3 PRO 4 2HB PRO 4 -8.888 2.533 3.222
22 HG2 PRO 4 1HG PRO 4 -6.068 2.346 2.117
23 HG3 PRO 4 2HG PRO 4 -6.607 3.129 3.640
24 HD2 PRO 4 1HD PRO 4 -5.600 0.638 3.662
25 HD3 PRO 4 2HD PRO 4 -7.015 1.030 4.676
26 H LYS 5 H LYS 5 -10.032 1.054 0.120
27 HA LYS 5 HA LYS 5 -8.594 -0.596 -1.790
28 HB2 LYS 5 1HB LYS 5 -11.206 0.932 -2.130
29 HB3 LYS 5 2HB LYS 5 -10.644 -0.430 -3.095
30 HG2 LYS 5 1HG LYS 5 -11.548 -0.502 -0.189
31 HG3 LYS 5 2HG LYS 5 -12.379 -1.162 -1.593
32 HD2 LYS 5 1HD LYS 5 -10.515 -2.790 -1.927
33 HD3 LYS 5 2HD LYS 5 -9.719 -2.155 -0.467
34 HE2 LYS 5 1HE LYS 5 -11.729 -2.731 0.878
35 HE3 LYS 5 2HE LYS 5 -12.507 -3.391 -0.568
36 HZ1 LYS 5 3HZ LYS 5 -11.465 -5.134 0.746
37 HZ2 LYS 5 1HZ LYS 5 -10.712 -5.032 -0.699
38 HZ3 LYS 5 2HZ LYS 5 -9.999 -4.421 0.643
39 H ILE 6 H ILE 6 -7.584 2.183 -1.135
40 HA ILE 6 HA ILE 6 -7.665 3.643 -3.705
41 HB ILE 6 HB ILE 6 -6.168 5.261 -2.577
42 HG12 ILE 6 1HG1 ILE 6 -6.518 3.587 -0.048
43 HG13 ILE 6 2HG1 ILE 6 -5.045 3.622 -1.010
44 HG21 ILE 6 1HG2 ILE 6 -8.663 5.411 -2.522
45 HG22 ILE 6 2HG2 ILE 6 -8.658 4.592 -0.945
46 HG23 ILE 6 3HG2 ILE 6 -7.896 6.184 -1.136
47 HD11 ILE 6 3HD1 ILE 6 -4.785 5.109 0.868
48 HD12 ILE 6 1HD1 ILE 6 -4.850 6.078 -0.616
49 HD13 ILE 6 2HD1 ILE 6 -6.266 5.986 0.463
50 H LEU 7 H LEU 7 -5.892 4.142 -5.026
51 HA LEU 7 HA LEU 7 -3.775 2.074 -5.133
52 HB2 LEU 7 1HB LEU 7 -5.135 2.627 -7.148
53 HB3 LEU 7 2HB LEU 7 -4.531 4.281 -7.088
54 HG LEU 7 HG LEU 7 -2.210 3.422 -7.445
55 HD11 LEU 7 1HD1 LEU 7 -2.419 1.119 -6.557
56 HD12 LEU 7 2HD1 LEU 7 -3.586 0.719 -7.836
57 HD13 LEU 7 3HD1 LEU 7 -1.894 1.081 -8.242
58 HD21 LEU 7 3HD2 LEU 7 -2.512 2.864 -9.821
59 HD22 LEU 7 1HD2 LEU 7 -4.238 2.542 -9.538
60 HD23 LEU 7 2HD2 LEU 7 -3.587 4.184 -9.335
61 H LYS 8 H LYS 8 -2.522 2.600 -3.411
62 HA LYS 8 HA LYS 8 -1.277 5.315 -3.227
63 HB2 LYS 8 1HB LYS 8 -2.796 4.177 -1.413
64 HB3 LYS 8 2HB LYS 8 -1.389 3.204 -1.030
65 HG2 LYS 8 1HG LYS 8 -1.535 6.258 -0.978
66 HG3 LYS 8 2HG LYS 8 -1.773 5.204 0.415
67 HD2 LYS 8 1HD LYS 8 0.566 4.348 0.153
68 HD3 LYS 8 2HD LYS 8 0.808 5.529 -1.161
69 HE2 LYS 8 1HE LYS 8 0.300 7.389 0.353
70 HE3 LYS 8 2HE LYS 8 -0.023 6.260 1.677
71 HZ1 LYS 8 3HZ LYS 8 2.228 7.191 1.774
72 HZ2 LYS 8 1HZ LYS 8 2.272 5.562 1.609
73 HZ3 LYS 8 2HZ LYS 8 2.605 6.533 0.322
74 H LYS 9 H LYS 9 0.879 5.454 -3.815
75 HA LYS 9 HA LYS 9 2.327 3.068 -4.591
76 HB2 LYS 9 1HB LYS 9 2.415 5.515 -5.533
77 HB3 LYS 9 2HB LYS 9 3.600 5.778 -4.238
78 HG2 LYS 9 1HG LYS 9 5.048 4.026 -5.175
79 HG3 LYS 9 2HG LYS 9 3.826 3.650 -6.403
80 HD2 LYS 9 1HD LYS 9 4.059 5.956 -7.316
81 HD3 LYS 9 2HD LYS 9 5.296 6.304 -6.086
82 HE2 LYS 9 1HE LYS 9 6.694 4.444 -6.979
83 HE3 LYS 9 2HE LYS 9 5.465 4.107 -8.207
84 HZ1 LYS 9 3HZ LYS 9 7.245 5.492 -9.092
85 HZ2 LYS 9 1HZ LYS 9 5.851 6.343 -9.101
86 HZ3 LYS 9 2HZ LYS 9 6.990 6.646 -7.966
87 H CYS 10 H CYS 10 4.476 2.523 -3.871
88 HA CYS 10 HA CYS 10 5.353 3.178 -1.140
89 HB2 CYS 10 1HB CYS 10 4.986 0.913 -0.207
90 HB3 CYS 10 2HB CYS 10 3.496 1.737 -0.617
91 H ARG 11 H ARG 11 7.292 2.394 -0.479
92 HA ARG 11 HA ARG 11 9.094 1.046 -2.439
93 HB2 ARG 11 1HB ARG 11 9.642 2.200 0.325
94 HB3 ARG 11 2HB ARG 11 10.849 1.653 -0.828
95 HG2 ARG 11 1HG ARG 11 10.452 3.475 -2.317
96 HG3 ARG 11 2HG ARG 11 8.965 3.965 -1.496
97 HD2 ARG 11 1HD ARG 11 11.716 4.044 -0.210
98 HD3 ARG 11 2HD ARG 11 10.910 5.425 -0.976
99 HE ARG 11 HE ARG 11 9.085 4.363 0.905
100 HH11 ARG 11 1HH1 ARG 11 12.257 5.945 1.043
101 HH12 ARG 11 2HH1 ARG 11 11.944 6.632 2.610
102 HH21 ARG 11 1HH2 ARG 11 8.714 5.324 2.852
103 HH22 ARG 11 2HH2 ARG 11 9.959 6.265 3.644
104 H ARG 12 H ARG 12 7.482 0.657 0.653
105 HA ARG 12 HA ARG 12 7.618 -2.211 0.779
106 HB2 ARG 12 1HB ARG 12 8.939 -2.405 2.834
107 HB3 ARG 12 2HB ARG 12 9.927 -1.689 1.570
108 HG2 ARG 12 1HG ARG 12 9.621 0.562 2.535
109 HG3 ARG 12 2HG ARG 12 8.497 -0.085 3.739
110 HD2 ARG 12 1HD ARG 12 10.353 -1.563 4.590
111 HD3 ARG 12 2HD ARG 12 11.468 -0.706 3.524
112 HE ARG 12 HE ARG 12 10.018 0.331 5.911
113 HH11 ARG 12 1HH1 ARG 12 12.289 1.168 3.315
114 HH12 ARG 12 2HH1 ARG 12 12.796 2.627 4.113
115 HH21 ARG 12 1HH2 ARG 12 10.747 2.185 6.892
116 HH22 ARG 12 2HH2 ARG 12 11.926 3.198 6.116
117 H ASP 13 H ASP 13 6.794 -2.862 3.117
118 HA ASP 13 HA ASP 13 4.118 -2.052 3.182
119 HB2 ASP 13 1HB ASP 13 5.653 -3.264 5.508
120 HB3 ASP 13 2HB ASP 13 3.920 -3.364 5.218
121 H SER 14 H SER 14 6.812 -0.663 5.016
122 HA SER 14 HA SER 14 5.452 0.819 6.988
123 HB2 SER 14 1HB SER 14 7.901 1.747 5.449
124 HB3 SER 14 2HB SER 14 7.461 2.148 7.112
125 HG SER 14 HG SER 14 7.850 -0.047 7.670
126 H ASP 15 H ASP 15 5.509 1.439 3.531
127 HA ASP 15 HA ASP 15 4.651 4.271 3.824
128 HB2 ASP 15 1HB ASP 15 5.098 2.496 1.400
129 HB3 ASP 15 2HB ASP 15 4.622 4.188 1.324
130 H CYS 16 H CYS 16 3.119 1.234 3.899
131 HA CYS 16 HA CYS 16 0.751 2.083 2.358
132 HB2 CYS 16 1HB CYS 16 1.622 -0.598 3.460
133 HB3 CYS 16 2HB CYS 16 0.096 -0.307 2.654
134 HA PRO 17 HA PRO 17 -1.527 3.263 5.818
135 HB2 PRO 17 1HB PRO 17 -3.927 3.790 4.723
136 HB3 PRO 17 2HB PRO 17 -2.428 4.601 4.136
137 HG2 PRO 17 1HG PRO 17 -3.756 2.147 2.931
138 HG3 PRO 17 2HG PRO 17 -3.326 3.683 2.108
139 HD2 PRO 17 1HD PRO 17 -1.643 1.541 2.107
140 HD3 PRO 17 2HD PRO 17 -1.039 3.223 2.214
141 H GLY 18 H GLY 18 -2.922 2.580 7.456
142 HA2 GLY 18 1HA GLY 18 -4.213 1.129 8.729
143 HA3 GLY 18 2HA GLY 18 -4.980 0.649 7.208
144 H ALA 19 H ALA 19 -4.938 -1.457 6.927
145 HA ALA 19 HA ALA 19 -2.727 -3.143 7.992
146 HB1 ALA 19 3HB ALA 19 -4.281 -4.984 7.721
147 HB2 ALA 19 1HB ALA 19 -5.105 -3.669 8.567
148 HB3 ALA 19 2HB ALA 19 -5.424 -3.965 6.837
149 H CYS 20 H CYS 20 -2.977 -1.482 5.187
150 HA CYS 20 HA CYS 20 -2.694 -3.493 3.143
151 HB2 CYS 20 1HB CYS 20 -1.799 -0.599 3.283
152 HB3 CYS 20 2HB CYS 20 -1.607 -1.581 1.868
153 H ILE 21 H ILE 21 -0.933 -4.245 2.044
154 HA ILE 21 HA ILE 21 1.834 -3.848 3.153
155 HB ILE 21 HB ILE 21 2.352 -6.101 2.249
156 HG12 ILE 21 1HG1 ILE 21 -0.651 -6.592 2.078
157 HG13 ILE 21 2HG1 ILE 21 0.359 -6.240 0.674
158 HG21 ILE 21 1HG2 ILE 21 1.893 -5.665 4.658
159 HG22 ILE 21 2HG2 ILE 21 0.196 -6.128 4.405
160 HG23 ILE 21 3HG2 ILE 21 1.496 -7.316 4.178
161 HD11 ILE 21 3HD1 ILE 21 0.045 -8.624 0.838
162 HD12 ILE 21 1HD1 ILE 21 1.747 -8.247 1.168
163 HD13 ILE 21 2HD1 ILE 21 0.641 -8.650 2.505
164 H CYS 22 H CYS 22 3.534 -3.967 1.508
165 HA CYS 22 HA CYS 22 2.682 -2.529 -0.940
166 HB2 CYS 22 1HB CYS 22 4.610 -1.803 0.527
167 HB3 CYS 22 2HB CYS 22 5.484 -3.233 -0.019
168 H ARG 23 H ARG 23 2.269 -3.551 -2.791
169 HA ARG 23 HA ARG 23 3.030 -6.385 -3.164
170 HB2 ARG 23 1HB ARG 23 1.302 -4.606 -4.920
171 HB3 ARG 23 2HB ARG 23 1.445 -6.357 -4.998
172 HG2 ARG 23 1HG ARG 23 0.136 -4.697 -2.813
173 HG3 ARG 23 2HG ARG 23 -0.643 -5.784 -3.948
174 HD2 ARG 23 1HD ARG 23 1.204 -6.558 -1.651
175 HD3 ARG 23 2HD ARG 23 -0.535 -6.781 -1.707
176 HE ARG 23 HE ARG 23 1.508 -8.469 -2.886
177 HH11 ARG 23 1HH1 ARG 23 -1.912 -7.609 -3.259
178 HH12 ARG 23 2HH1 ARG 23 -2.289 -9.114 -4.044
179 HH21 ARG 23 1HH2 ARG 23 0.951 -10.362 -3.926
180 HH22 ARG 23 2HH2 ARG 23 -0.690 -10.643 -4.419
181 H GLY 24 H GLY 24 3.694 -7.043 -5.422
182 HA2 GLY 24 1HA GLY 24 6.302 -6.043 -5.872
183 HA3 GLY 24 2HA GLY 24 5.445 -7.206 -6.905
184 H ASN 25 H ASN 25 3.360 -4.904 -7.320
185 HA ASN 25 HA ASN 25 4.626 -3.641 -9.627
186 HB2 ASN 25 1HB ASN 25 2.459 -2.720 -10.065
187 HB3 ASN 25 2HB ASN 25 2.273 -4.415 -9.645
188 HD21 ASN 25 1HD2 ASN 25 0.052 -2.777 -9.568
189 HD22 ASN 25 2HD2 ASN 25 -0.410 -2.503 -7.896
190 H GLY 26 H GLY 26 4.726 -2.861 -6.328
191 HA2 GLY 26 1HA GLY 26 5.809 -1.030 -5.355
192 HA3 GLY 26 2HA GLY 26 5.655 -0.098 -6.865
193 H TYR 27 H TYR 27 2.741 -1.610 -5.710
194 HA TYR 27 HA TYR 27 1.870 0.862 -4.291
195 HB2 TYR 27 1HB TYR 27 0.424 -0.583 -6.530
196 HB3 TYR 27 2HB TYR 27 -0.403 0.441 -5.380
197 HD1 TYR 27 HD1 TYR 27 2.343 0.475 -7.947
198 HD2 TYR 27 HD2 TYR 27 -0.506 2.754 -5.667
199 HE1 TYR 27 HE1 TYR 27 2.963 2.509 -9.220
200 HE2 TYR 27 HE2 TYR 27 0.096 4.800 -6.939
201 HH TYR 27 HH TYR 27 2.532 4.742 -9.576
202 H CYS 28 H CYS 28 0.130 0.643 -2.866
203 HA CYS 28 HA CYS 28 0.428 -1.651 -1.156
204 HB2 CYS 28 1HB CYS 28 -1.399 0.768 -1.026
205 HB3 CYS 28 2HB CYS 28 -1.121 -0.345 0.313
206 H GLY 29 H GLY 29 -0.971 -3.240 -0.561
207 HA2 GLY 29 1HA GLY 29 -3.775 -3.364 -1.428
208 HA3 GLY 29 2HA GLY 29 -2.726 -4.516 -2.234
209 HN1 NH2 30 2HN NH2 30 -3.936 -6.518 0.524
210 HN2 NH2 30 1HN NH2 30 -4.381 -5.981 -1.085
Start of MODEL 4
1 H1 GLY 1 1H GLY 1 -9.333 -3.323 12.255
2 H2 GLY 1 2H GLY 1 -8.028 -4.309 12.175
3 H3 GLY 1 3H GLY 1 -7.967 -2.943 13.076
4 HA2 GLY 1 1HA GLY 1 -8.152 -1.553 11.131
5 HA3 GLY 1 2HA GLY 1 -6.736 -2.619 11.046
6 H VAL 2 H VAL 2 -7.437 -1.660 8.693
7 HA VAL 2 HA VAL 2 -8.238 -3.940 7.123
8 HB VAL 2 HB VAL 2 -10.485 -3.113 7.773
9 HG11 VAL 2 1HG1 VAL 2 -9.997 -0.691 8.020
10 HG12 VAL 2 2HG1 VAL 2 -9.816 -0.555 6.255
11 HG13 VAL 2 3HG1 VAL 2 -11.381 -0.997 6.961
12 HG21 VAL 2 3HG2 VAL 2 -11.506 -3.132 5.608
13 HG22 VAL 2 1HG2 VAL 2 -10.003 -2.639 4.814
14 HG23 VAL 2 2HG2 VAL 2 -10.123 -4.241 5.583
15 H CYS 3 H CYS 3 -7.730 -3.631 4.889
16 HA CYS 3 HA CYS 3 -5.887 -1.356 4.392
17 HB2 CYS 3 1HB CYS 3 -4.988 -3.530 3.905
18 HB3 CYS 3 2HB CYS 3 -6.385 -3.981 2.951
19 HA PRO 4 HA PRO 4 -9.435 0.383 2.077
20 HB2 PRO 4 1HB PRO 4 -8.368 2.823 1.420
21 HB3 PRO 4 2HB PRO 4 -9.012 2.430 3.044
22 HG2 PRO 4 1HG PRO 4 -6.123 2.325 2.119
23 HG3 PRO 4 2HG PRO 4 -6.783 3.105 3.593
24 HD2 PRO 4 1HD PRO 4 -5.690 0.643 3.690
25 HD3 PRO 4 2HD PRO 4 -7.154 1.011 4.640
26 H LYS 5 H LYS 5 -9.924 0.584 -0.101
27 HA LYS 5 HA LYS 5 -8.131 -0.880 -1.851
28 HB2 LYS 5 1HB LYS 5 -10.938 0.228 -2.266
29 HB3 LYS 5 2HB LYS 5 -10.108 -0.884 -3.363
30 HG2 LYS 5 1HG LYS 5 -9.905 -2.543 -1.490
31 HG3 LYS 5 2HG LYS 5 -10.908 -1.493 -0.483
32 HD2 LYS 5 1HD LYS 5 -11.747 -2.746 -3.134
33 HD3 LYS 5 2HD LYS 5 -12.190 -3.331 -1.524
34 HE2 LYS 5 1HE LYS 5 -13.336 -1.163 -1.056
35 HE3 LYS 5 2HE LYS 5 -12.931 -0.604 -2.686
36 HZ1 LYS 5 3HZ LYS 5 -15.172 -1.509 -2.595
37 HZ2 LYS 5 1HZ LYS 5 -14.254 -2.440 -3.574
38 HZ3 LYS 5 2HZ LYS 5 -14.632 -2.956 -2.067
39 H ILE 6 H ILE 6 -7.474 1.987 -1.209
40 HA ILE 6 HA ILE 6 -7.609 3.455 -3.762
41 HB ILE 6 HB ILE 6 -6.258 5.165 -2.586
42 HG12 ILE 6 1HG1 ILE 6 -6.468 3.395 -0.105
43 HG13 ILE 6 2HG1 ILE 6 -5.001 3.596 -1.058
44 HG21 ILE 6 1HG2 ILE 6 -8.757 5.109 -2.536
45 HG22 ILE 6 2HG2 ILE 6 -8.688 4.263 -0.976
46 HG23 ILE 6 3HG2 ILE 6 -8.055 5.914 -1.133
47 HD11 ILE 6 3HD1 ILE 6 -4.879 5.038 0.866
48 HD12 ILE 6 1HD1 ILE 6 -5.036 6.047 -0.582
49 HD13 ILE 6 2HD1 ILE 6 -6.436 5.786 0.489
50 H LEU 7 H LEU 7 -5.839 4.143 -5.024
51 HA LEU 7 HA LEU 7 -3.643 2.176 -5.220
52 HB2 LEU 7 1HB LEU 7 -5.022 2.829 -7.202
53 HB3 LEU 7 2HB LEU 7 -4.438 4.483 -7.040
54 HG LEU 7 HG LEU 7 -2.102 3.658 -7.429
55 HD11 LEU 7 1HD1 LEU 7 -2.322 1.292 -6.719
56 HD12 LEU 7 2HD1 LEU 7 -3.477 0.994 -8.035
57 HD13 LEU 7 3HD1 LEU 7 -1.782 1.384 -8.397
58 HD21 LEU 7 3HD2 LEU 7 -2.386 3.279 -9.843
59 HD22 LEU 7 1HD2 LEU 7 -4.115 2.942 -9.597
60 HD23 LEU 7 2HD2 LEU 7 -3.462 4.562 -9.266
61 H LYS 8 H LYS 8 -2.460 2.654 -3.415
62 HA LYS 8 HA LYS 8 -1.216 5.363 -3.132
63 HB2 LYS 8 1HB LYS 8 -2.759 4.182 -1.361
64 HB3 LYS 8 2HB LYS 8 -1.354 3.204 -0.982
65 HG2 LYS 8 1HG LYS 8 -1.500 6.258 -0.887
66 HG3 LYS 8 2HG LYS 8 -1.756 5.188 0.490
67 HD2 LYS 8 1HD LYS 8 0.582 4.347 0.279
68 HD3 LYS 8 2HD LYS 8 0.851 5.503 -1.051
69 HE2 LYS 8 1HE LYS 8 0.308 7.392 0.423
70 HE3 LYS 8 2HE LYS 8 -0.028 6.284 1.760
71 HZ1 LYS 8 3HZ LYS 8 2.215 7.229 1.876
72 HZ2 LYS 8 1HZ LYS 8 2.272 5.598 1.739
73 HZ3 LYS 8 2HZ LYS 8 2.619 6.551 0.440
74 H LYS 9 H LYS 9 0.937 5.496 -3.727
75 HA LYS 9 HA LYS 9 2.341 3.105 -4.556
76 HB2 LYS 9 1HB LYS 9 2.439 5.594 -5.435
77 HB3 LYS 9 2HB LYS 9 3.706 5.766 -4.204
78 HG2 LYS 9 1HG LYS 9 5.025 3.997 -5.267
79 HG3 LYS 9 2HG LYS 9 3.713 3.672 -6.413
80 HD2 LYS 9 1HD LYS 9 3.939 6.052 -7.233
81 HD3 LYS 9 2HD LYS 9 5.371 6.229 -6.216
82 HE2 LYS 9 1HE LYS 9 5.006 4.140 -8.426
83 HE3 LYS 9 2HE LYS 9 5.828 5.687 -8.639
84 HZ1 LYS 9 3HZ LYS 9 7.420 3.943 -8.215
85 HZ2 LYS 9 1HZ LYS 9 7.453 4.991 -6.967
86 HZ3 LYS 9 2HZ LYS 9 6.719 3.533 -6.800
87 H CYS 10 H CYS 10 4.472 2.495 -3.897
88 HA CYS 10 HA CYS 10 5.448 3.103 -1.188
89 HB2 CYS 10 1HB CYS 10 5.053 0.860 -0.249
90 HB3 CYS 10 2HB CYS 10 3.561 1.689 -0.646
91 H ARG 11 H ARG 11 7.331 2.142 -0.545
92 HA ARG 11 HA ARG 11 9.017 0.716 -2.579
93 HB2 ARG 11 1HB ARG 11 9.825 2.177 -0.013
94 HB3 ARG 11 2HB ARG 11 10.895 1.297 -1.083
95 HG2 ARG 11 1HG ARG 11 11.263 3.526 -1.612
96 HG3 ARG 11 2HG ARG 11 10.315 2.886 -2.948
97 HD2 ARG 11 1HD ARG 11 9.648 5.183 -2.301
98 HD3 ARG 11 2HD ARG 11 8.322 4.054 -2.146
99 HE ARG 11 HE ARG 11 8.394 4.203 0.207
100 HH11 ARG 11 1HH1 ARG 11 11.096 6.112 -1.080
101 HH12 ARG 11 2HH1 ARG 11 11.319 6.946 0.430
102 HH21 ARG 11 1HH2 ARG 11 8.654 5.353 2.032
103 HH22 ARG 11 2HH2 ARG 11 9.968 6.498 2.198
104 H ARG 12 H ARG 12 7.615 0.649 0.662
105 HA ARG 12 HA ARG 12 7.667 -2.239 0.851
106 HB2 ARG 12 1HB ARG 12 8.975 -2.402 2.900
107 HB3 ARG 12 2HB ARG 12 9.973 -1.690 1.642
108 HG2 ARG 12 1HG ARG 12 9.652 0.564 2.593
109 HG3 ARG 12 2HG ARG 12 8.517 -0.079 3.789
110 HD2 ARG 12 1HD ARG 12 10.371 -1.558 4.656
111 HD3 ARG 12 2HD ARG 12 11.492 -0.688 3.607
112 HE ARG 12 HE ARG 12 9.995 0.332 5.976
113 HH11 ARG 12 1HH1 ARG 12 12.328 1.177 3.438
114 HH12 ARG 12 2HH1 ARG 12 12.823 2.627 4.259
115 HH21 ARG 12 1HH2 ARG 12 10.710 2.173 6.988
116 HH22 ARG 12 2HH2 ARG 12 11.911 3.187 6.245
117 H ASP 13 H ASP 13 6.836 -2.838 3.184
118 HA ASP 13 HA ASP 13 4.157 -2.029 3.197
119 HB2 ASP 13 1HB ASP 13 5.663 -3.244 5.543
120 HB3 ASP 13 2HB ASP 13 3.931 -3.341 5.237
121 H SER 14 H SER 14 6.822 -0.631 5.053
122 HA SER 14 HA SER 14 5.437 0.841 7.017
123 HB2 SER 14 1HB SER 14 7.895 1.777 5.495
124 HB3 SER 14 2HB SER 14 7.437 2.187 7.152
125 HG SER 14 HG SER 14 7.827 -0.004 7.725
126 H ASP 15 H ASP 15 5.487 1.443 3.564
127 HA ASP 15 HA ASP 15 4.663 4.281 3.807
128 HB2 ASP 15 1HB ASP 15 4.872 2.429 1.410
129 HB3 ASP 15 2HB ASP 15 4.560 4.157 1.337
130 H CYS 16 H CYS 16 3.093 1.230 3.922
131 HA CYS 16 HA CYS 16 0.717 2.094 2.418
132 HB2 CYS 16 1HB CYS 16 1.570 -0.586 3.540
133 HB3 CYS 16 2HB CYS 16 0.067 -0.292 2.691
134 HA PRO 17 HA PRO 17 -1.570 3.287 5.867
135 HB2 PRO 17 1HB PRO 17 -3.965 3.814 4.763
136 HB3 PRO 17 2HB PRO 17 -2.465 4.621 4.177
137 HG2 PRO 17 1HG PRO 17 -3.795 2.166 2.977
138 HG3 PRO 17 2HG PRO 17 -3.359 3.698 2.150
139 HD2 PRO 17 1HD PRO 17 -1.678 1.555 2.160
140 HD3 PRO 17 2HD PRO 17 -1.072 3.236 2.265
141 H GLY 18 H GLY 18 -2.972 2.610 7.502
142 HA2 GLY 18 1HA GLY 18 -4.269 1.166 8.774
143 HA3 GLY 18 2HA GLY 18 -5.030 0.680 7.252
144 H ALA 19 H ALA 19 -4.978 -1.426 6.966
145 HA ALA 19 HA ALA 19 -2.773 -3.107 8.052
146 HB1 ALA 19 3HB ALA 19 -4.321 -4.952 7.770
147 HB2 ALA 19 1HB ALA 19 -5.155 -3.636 8.610
148 HB3 ALA 19 2HB ALA 19 -5.461 -3.934 6.878
149 H CYS 20 H CYS 20 -3.014 -1.448 5.240
150 HA CYS 20 HA CYS 20 -2.703 -3.467 3.208
151 HB2 CYS 20 1HB CYS 20 -1.839 -0.565 3.319
152 HB3 CYS 20 2HB CYS 20 -1.645 -1.563 1.917
153 H ILE 21 H ILE 21 -0.936 -4.186 2.101
154 HA ILE 21 HA ILE 21 1.822 -3.777 3.221
155 HB ILE 21 HB ILE 21 2.336 -6.066 2.369
156 HG12 ILE 21 1HG1 ILE 21 -0.672 -6.544 2.265
157 HG13 ILE 21 2HG1 ILE 21 0.323 -6.256 0.838
158 HG21 ILE 21 1HG2 ILE 21 1.923 -5.544 4.771
159 HG22 ILE 21 2HG2 ILE 21 0.221 -6.008 4.564
160 HG23 ILE 21 3HG2 ILE 21 1.512 -7.209 4.355
161 HD11 ILE 21 3HD1 ILE 21 0.003 -8.627 1.087
162 HD12 ILE 21 1HD1 ILE 21 1.707 -8.254 1.412
163 HD13 ILE 21 2HD1 ILE 21 0.591 -8.597 2.757
164 H CYS 22 H CYS 22 3.522 -3.907 1.581
165 HA CYS 22 HA CYS 22 2.665 -2.505 -0.873
166 HB2 CYS 22 1HB CYS 22 4.661 -1.852 0.536
167 HB3 CYS 22 2HB CYS 22 5.462 -3.319 -0.020
168 H ARG 23 H ARG 23 2.466 -3.395 -2.866
169 HA ARG 23 HA ARG 23 3.094 -6.297 -3.209
170 HB2 ARG 23 1HB ARG 23 1.240 -4.605 -4.902
171 HB3 ARG 23 2HB ARG 23 1.394 -6.356 -4.878
172 HG2 ARG 23 1HG ARG 23 0.129 -4.549 -2.805
173 HG3 ARG 23 2HG ARG 23 -0.630 -5.812 -3.758
174 HD2 ARG 23 1HD ARG 23 1.284 -6.163 -1.419
175 HD3 ARG 23 2HD ARG 23 -0.432 -6.515 -1.458
176 HE ARG 23 HE ARG 23 0.013 -8.308 -3.093
177 HH11 ARG 23 1HH1 ARG 23 2.856 -7.326 -1.151
178 HH12 ARG 23 2HH1 ARG 23 3.504 -8.934 -1.197
179 HH21 ARG 23 1HH2 ARG 23 0.987 -10.299 -3.148
180 HH22 ARG 23 2HH2 ARG 23 2.501 -10.566 -2.342
181 H GLY 24 H GLY 24 3.612 -6.956 -5.482
182 HA2 GLY 24 1HA GLY 24 6.194 -5.959 -6.051
183 HA3 GLY 24 2HA GLY 24 5.296 -7.130 -7.038
184 H ASN 25 H ASN 25 3.197 -4.834 -7.396
185 HA ASN 25 HA ASN 25 4.367 -3.580 -9.754
186 HB2 ASN 25 1HB ASN 25 2.194 -2.624 -10.082
187 HB3 ASN 25 2HB ASN 25 2.009 -4.321 -9.664
188 HD21 ASN 25 1HD2 ASN 25 -0.182 -2.644 -9.472
189 HD22 ASN 25 2HD2 ASN 25 -0.564 -2.385 -7.778
190 H GLY 26 H GLY 26 4.602 -2.800 -6.456
191 HA2 GLY 26 1HA GLY 26 5.769 -0.988 -5.536
192 HA3 GLY 26 2HA GLY 26 5.536 -0.041 -7.026
193 H TYR 27 H TYR 27 2.675 -1.551 -5.748
194 HA TYR 27 HA TYR 27 1.881 0.910 -4.268
195 HB2 TYR 27 1HB TYR 27 0.315 -0.495 -6.457
196 HB3 TYR 27 2HB TYR 27 -0.415 0.594 -5.298
197 HD1 TYR 27 HD2 TYR 27 2.206 0.429 -7.983
198 HD2 TYR 27 HD1 TYR 27 -0.398 2.911 -5.626
199 HE1 TYR 27 HE2 TYR 27 2.891 2.407 -9.319
200 HE2 TYR 27 HE1 TYR 27 0.274 4.896 -6.949
201 HH TYR 27 HH TYR 27 1.532 5.673 -8.716
202 H CYS 28 H CYS 28 0.150 0.680 -2.809
203 HA CYS 28 HA CYS 28 0.469 -1.639 -1.130
204 HB2 CYS 28 1HB CYS 28 -1.357 0.780 -0.960
205 HB3 CYS 28 2HB CYS 28 -1.073 -0.347 0.365
206 H GLY 29 H GLY 29 -0.875 -3.273 -0.619
207 HA2 GLY 29 1HA GLY 29 -3.708 -3.380 -1.456
208 HA3 GLY 29 2HA GLY 29 -2.646 -4.551 -2.220
209 HN1 NH2 30 2HN NH2 30 -3.867 -6.505 0.554
210 HN2 NH2 30 1HN NH2 30 -4.271 -6.021 -1.082
Start of MODEL 5
1 H1 GLY 1 1H GLY 1 -8.937 -3.455 12.243
2 H2 GLY 1 2H GLY 1 -7.449 -4.131 12.144
3 H3 GLY 1 3H GLY 1 -7.670 -2.756 13.008
4 HA2 GLY 1 1HA GLY 1 -8.209 -1.506 11.033
5 HA3 GLY 1 2HA GLY 1 -6.593 -2.231 10.932
6 H VAL 2 H VAL 2 -7.649 -1.497 8.587
7 HA VAL 2 HA VAL 2 -8.081 -4.005 7.135
8 HB VAL 2 HB VAL 2 -9.924 -3.077 5.761
9 HG11 VAL 2 1HG1 VAL 2 -10.415 -4.696 7.573
10 HG12 VAL 2 2HG1 VAL 2 -10.780 -3.337 8.665
11 HG13 VAL 2 3HG1 VAL 2 -11.766 -3.608 7.218
12 HG21 VAL 2 3HG2 VAL 2 -11.341 -1.239 6.562
13 HG22 VAL 2 1HG2 VAL 2 -10.234 -0.939 7.914
14 HG23 VAL 2 2HG2 VAL 2 -9.702 -0.664 6.241
15 H CYS 3 H CYS 3 -7.696 -3.664 4.797
16 HA CYS 3 HA CYS 3 -5.862 -1.376 4.342
17 HB2 CYS 3 1HB CYS 3 -4.970 -3.544 3.792
18 HB3 CYS 3 2HB CYS 3 -6.375 -3.962 2.833
19 HA PRO 4 HA PRO 4 -9.458 0.433 2.184
20 HB2 PRO 4 1HB PRO 4 -8.391 2.874 1.514
21 HB3 PRO 4 2HB PRO 4 -8.974 2.459 3.155
22 HG2 PRO 4 1HG PRO 4 -6.126 2.336 2.112
23 HG3 PRO 4 2HG PRO 4 -6.716 3.100 3.624
24 HD2 PRO 4 1HD PRO 4 -5.653 0.628 3.650
25 HD3 PRO 4 2HD PRO 4 -7.087 0.990 4.647
26 H LYS 5 H LYS 5 -10.053 0.783 0.043
27 HA LYS 5 HA LYS 5 -8.498 -0.738 -1.836
28 HB2 LYS 5 1HB LYS 5 -10.498 -0.635 -3.209
29 HB3 LYS 5 2HB LYS 5 -10.926 -0.972 -1.535
30 HG2 LYS 5 1HG LYS 5 -11.590 1.411 -1.213
31 HG3 LYS 5 2HG LYS 5 -11.143 1.760 -2.894
32 HD2 LYS 5 1HD LYS 5 -12.840 0.132 -3.686
33 HD3 LYS 5 2HD LYS 5 -13.288 -0.218 -2.001
34 HE2 LYS 5 1HE LYS 5 -13.911 2.170 -1.676
35 HE3 LYS 5 2HE LYS 5 -13.462 2.519 -3.352
36 HZ1 LYS 5 3HZ LYS 5 -15.846 2.165 -3.129
37 HZ2 LYS 5 1HZ LYS 5 -15.213 0.989 -4.069
38 HZ3 LYS 5 2HZ LYS 5 -15.629 0.666 -2.519
39 H ILE 6 H ILE 6 -7.561 2.067 -1.164
40 HA ILE 6 HA ILE 6 -7.656 3.549 -3.718
41 HB ILE 6 HB ILE 6 -6.244 5.211 -2.556
42 HG12 ILE 6 1HG1 ILE 6 -6.509 3.463 -0.066
43 HG13 ILE 6 2HG1 ILE 6 -5.036 3.617 -1.019
44 HG21 ILE 6 1HG2 ILE 6 -8.745 5.242 -2.501
45 HG22 ILE 6 2HG2 ILE 6 -8.700 4.408 -0.933
46 HG23 ILE 6 3HG2 ILE 6 -8.012 6.035 -1.107
47 HD11 ILE 6 3HD1 ILE 6 -4.873 5.061 0.901
48 HD12 ILE 6 1HD1 ILE 6 -5.000 6.070 -0.552
49 HD13 ILE 6 2HD1 ILE 6 -6.407 5.853 0.521
50 H LEU 7 H LEU 7 -5.890 4.136 -5.010
51 HA LEU 7 HA LEU 7 -3.731 2.118 -5.158
52 HB2 LEU 7 1HB LEU 7 -5.114 2.701 -7.155
53 HB3 LEU 7 2HB LEU 7 -4.525 4.359 -7.061
54 HG LEU 7 HG LEU 7 -2.197 3.524 -7.444
55 HD11 LEU 7 1HD1 LEU 7 -2.397 1.193 -6.623
56 HD12 LEU 7 2HD1 LEU 7 -3.564 0.828 -7.911
57 HD13 LEU 7 3HD1 LEU 7 -1.874 1.209 -8.309
58 HD21 LEU 7 3HD2 LEU 7 -2.504 3.034 -9.833
59 HD22 LEU 7 1HD2 LEU 7 -4.228 2.699 -9.556
60 HD23 LEU 7 2HD2 LEU 7 -3.582 4.336 -9.306
61 H LYS 8 H LYS 8 -2.500 2.640 -3.408
62 HA LYS 8 HA LYS 8 -1.265 5.359 -3.205
63 HB2 LYS 8 1HB LYS 8 -2.783 4.231 -1.393
64 HB3 LYS 8 2HB LYS 8 -1.389 3.235 -1.018
65 HG2 LYS 8 1HG LYS 8 -1.491 6.292 -0.948
66 HG3 LYS 8 2HG LYS 8 -1.742 5.233 0.440
67 HD2 LYS 8 1HD LYS 8 0.586 4.351 0.178
68 HD3 LYS 8 2HD LYS 8 0.842 5.524 -1.139
69 HE2 LYS 8 1HE LYS 8 0.357 7.396 0.371
70 HE3 LYS 8 2HE LYS 8 0.032 6.272 1.700
71 HZ1 LYS 8 3HZ LYS 8 2.294 7.186 1.772
72 HZ2 LYS 8 1HZ LYS 8 2.321 5.557 1.621
73 HZ3 LYS 8 2HZ LYS 8 2.654 6.514 0.324
74 H LYS 9 H LYS 9 0.886 5.499 -3.801
75 HA LYS 9 HA LYS 9 2.313 3.111 -4.603
76 HB2 LYS 9 1HB LYS 9 2.388 5.571 -5.532
77 HB3 LYS 9 2HB LYS 9 3.625 5.805 -4.279
78 HG2 LYS 9 1HG LYS 9 5.010 4.042 -5.276
79 HG3 LYS 9 2HG LYS 9 3.733 3.670 -6.446
80 HD2 LYS 9 1HD LYS 9 3.944 5.990 -7.364
81 HD3 LYS 9 2HD LYS 9 5.279 6.289 -6.230
82 HE2 LYS 9 1HE LYS 9 6.547 4.395 -7.229
83 HE3 LYS 9 2HE LYS 9 5.209 4.081 -8.344
84 HZ1 LYS 9 3HZ LYS 9 6.942 5.407 -9.393
85 HZ2 LYS 9 1HZ LYS 9 5.570 6.287 -9.300
86 HZ3 LYS 9 2HZ LYS 9 6.807 6.582 -8.269
87 H CYS 10 H CYS 10 4.461 2.547 -3.933
88 HA CYS 10 HA CYS 10 5.436 3.165 -1.233
89 HB2 CYS 10 1HB CYS 10 4.999 0.948 -0.257
90 HB3 CYS 10 2HB CYS 10 3.511 1.774 -0.682
91 H ARG 11 H ARG 11 7.264 2.023 -0.539
92 HA ARG 11 HA ARG 11 8.834 0.503 -2.592
93 HB2 ARG 11 1HB ARG 11 9.793 2.695 -1.889
94 HB3 ARG 11 2HB ARG 11 9.813 2.143 -0.210
95 HG2 ARG 11 1HG ARG 11 11.419 0.352 -0.795
96 HG3 ARG 11 2HG ARG 11 11.288 0.779 -2.509
97 HD2 ARG 11 1HD ARG 11 13.336 1.699 -1.650
98 HD3 ARG 11 2HD ARG 11 12.224 3.029 -2.011
99 HE ARG 11 HE ARG 11 12.015 2.181 0.752
100 HH11 ARG 11 1HH1 ARG 11 14.120 4.087 -1.357
101 HH12 ARG 11 2HH1 ARG 11 14.710 5.063 -0.044
102 HH21 ARG 11 1HH2 ARG 11 12.804 3.483 2.403
103 HH22 ARG 11 2HH2 ARG 11 13.977 4.717 2.056
104 H ARG 12 H ARG 12 7.641 0.658 0.755
105 HA ARG 12 HA ARG 12 7.617 -2.242 0.952
106 HB2 ARG 12 1HB ARG 12 9.964 -1.379 1.706
107 HB3 ARG 12 2HB ARG 12 9.138 -0.677 3.082
108 HG2 ARG 12 1HG ARG 12 10.249 -2.747 3.634
109 HG3 ARG 12 2HG ARG 12 8.532 -2.937 3.887
110 HD2 ARG 12 1HD ARG 12 9.843 -3.832 1.289
111 HD3 ARG 12 2HD ARG 12 9.964 -4.821 2.738
112 HE ARG 12 HE ARG 12 7.508 -4.959 2.847
113 HH11 ARG 12 1HH1 ARG 12 8.963 -4.444 -0.357
114 HH12 ARG 12 2HH1 ARG 12 7.604 -5.171 -1.159
115 HH21 ARG 12 1HH2 ARG 12 5.735 -5.606 1.751
116 HH22 ARG 12 2HH2 ARG 12 5.771 -5.800 0.021
117 H ASP 13 H ASP 13 6.810 -2.793 3.318
118 HA ASP 13 HA ASP 13 4.101 -2.037 3.218
119 HB2 ASP 13 1HB ASP 13 5.532 -3.288 5.595
120 HB3 ASP 13 2HB ASP 13 3.825 -3.450 5.164
121 H SER 14 H SER 14 6.703 -0.671 5.194
122 HA SER 14 HA SER 14 5.186 0.805 7.084
123 HB2 SER 14 1HB SER 14 7.837 1.570 5.800
124 HB3 SER 14 2HB SER 14 7.208 2.130 7.358
125 HG SER 14 HG SER 14 8.717 0.434 7.627
126 H ASP 15 H ASP 15 5.503 1.375 3.653
127 HA ASP 15 HA ASP 15 4.741 4.236 3.796
128 HB2 ASP 15 1HB ASP 15 4.900 2.355 1.425
129 HB3 ASP 15 2HB ASP 15 4.752 4.103 1.353
130 H CYS 16 H CYS 16 3.091 1.234 3.944
131 HA CYS 16 HA CYS 16 0.744 2.126 2.394
132 HB2 CYS 16 1HB CYS 16 1.590 -0.566 3.489
133 HB3 CYS 16 2HB CYS 16 0.075 -0.262 2.665
134 HA PRO 17 HA PRO 17 -1.568 3.287 5.836
135 HB2 PRO 17 1HB PRO 17 -3.966 3.794 4.728
136 HB3 PRO 17 2HB PRO 17 -2.470 4.615 4.148
137 HG2 PRO 17 1HG PRO 17 -3.777 2.155 2.936
138 HG3 PRO 17 2HG PRO 17 -3.347 3.691 2.116
139 HD2 PRO 17 1HD PRO 17 -1.654 1.558 2.128
140 HD3 PRO 17 2HD PRO 17 -1.060 3.243 2.234
141 H GLY 18 H GLY 18 -2.936 2.580 7.479
142 HA2 GLY 18 1HA GLY 18 -4.209 1.113 8.753
143 HA3 GLY 18 2HA GLY 18 -4.987 0.639 7.236
144 H ALA 19 H ALA 19 -4.945 -1.472 6.971
145 HA ALA 19 HA ALA 19 -2.708 -3.146 7.990
146 HB1 ALA 19 3HB ALA 19 -4.250 -4.993 7.734
147 HB2 ALA 19 1HB ALA 19 -5.087 -3.681 8.577
148 HB3 ALA 19 2HB ALA 19 -5.405 -3.987 6.849
149 H CYS 20 H CYS 20 -3.000 -1.471 5.193
150 HA CYS 20 HA CYS 20 -2.697 -3.468 3.138
151 HB2 CYS 20 1HB CYS 20 -1.825 -0.569 3.292
152 HB3 CYS 20 2HB CYS 20 -1.621 -1.541 1.875
153 H ILE 21 H ILE 21 -0.937 -4.223 2.051
154 HA ILE 21 HA ILE 21 1.819 -3.817 3.173
155 HB ILE 21 HB ILE 21 2.339 -6.089 2.292
156 HG12 ILE 21 1HG1 ILE 21 -0.667 -6.566 2.151
157 HG13 ILE 21 2HG1 ILE 21 0.340 -6.252 0.737
158 HG21 ILE 21 1HG2 ILE 21 1.904 -5.607 4.696
159 HG22 ILE 21 2HG2 ILE 21 0.203 -6.062 4.467
160 HG23 ILE 21 3HG2 ILE 21 1.492 -7.264 4.250
161 HD11 ILE 21 3HD1 ILE 21 0.020 -8.627 0.943
162 HD12 ILE 21 1HD1 ILE 21 1.721 -8.260 1.292
163 HD13 ILE 21 2HD1 ILE 21 0.591 -8.626 2.619
164 H CYS 22 H CYS 22 3.540 -3.930 1.561
165 HA CYS 22 HA CYS 22 2.692 -2.493 -0.890
166 HB2 CYS 22 1HB CYS 22 4.623 -1.749 0.561
167 HB3 CYS 22 2HB CYS 22 5.499 -3.176 0.030
168 H ARG 23 H ARG 23 2.363 -3.452 -2.805
169 HA ARG 23 HA ARG 23 3.086 -6.308 -3.165
170 HB2 ARG 23 1HB ARG 23 1.307 -4.562 -4.898
171 HB3 ARG 23 2HB ARG 23 1.443 -6.314 -4.927
172 HG2 ARG 23 1HG ARG 23 0.178 -4.577 -2.779
173 HG3 ARG 23 2HG ARG 23 -0.614 -5.733 -3.837
174 HD2 ARG 23 1HD ARG 23 1.294 -6.363 -1.550
175 HD3 ARG 23 2HD ARG 23 -0.447 -6.601 -1.568
176 HE ARG 23 HE ARG 23 -0.129 -8.248 -3.411
177 HH11 ARG 23 1HH1 ARG 23 2.628 -7.743 -1.212
178 HH12 ARG 23 2HH1 ARG 23 3.245 -9.339 -1.513
179 HH21 ARG 23 1HH2 ARG 23 0.751 -10.259 -3.743
180 HH22 ARG 23 2HH2 ARG 23 2.207 -10.733 -2.923
181 H GLY 24 H GLY 24 3.676 -6.977 -5.430
182 HA2 GLY 24 1HA GLY 24 6.275 -5.987 -5.954
183 HA3 GLY 24 2HA GLY 24 5.389 -7.155 -6.956
184 H ASN 25 H ASN 25 3.295 -4.865 -7.347
185 HA ASN 25 HA ASN 25 4.508 -3.611 -9.685
186 HB2 ASN 25 1HB ASN 25 2.333 -2.691 -10.077
187 HB3 ASN 25 2HB ASN 25 2.154 -4.384 -9.643
188 HD21 ASN 25 1HD2 ASN 25 -0.058 -2.730 -9.524
189 HD22 ASN 25 2HD2 ASN 25 -0.482 -2.451 -7.844
190 H GLY 26 H GLY 26 4.676 -2.813 -6.390
191 HA2 GLY 26 1HA GLY 26 5.782 -0.976 -5.452
192 HA3 GLY 26 2HA GLY 26 5.588 -0.051 -6.960
193 H TYR 27 H TYR 27 2.705 -1.568 -5.728
194 HA TYR 27 HA TYR 27 1.865 0.906 -4.294
195 HB2 TYR 27 1HB TYR 27 0.360 -0.536 -6.496
196 HB3 TYR 27 2HB TYR 27 -0.422 0.521 -5.345
197 HD1 TYR 27 HD1 TYR 27 2.257 0.458 -7.979
198 HD2 TYR 27 HD2 TYR 27 -0.481 2.836 -5.663
199 HE1 TYR 27 HE1 TYR 27 2.891 2.465 -9.297
200 HE2 TYR 27 HE2 TYR 27 0.133 4.847 -6.976
201 HH TYR 27 HH TYR 27 1.396 5.676 -8.714
202 H CYS 28 H CYS 28 0.136 0.684 -2.845
203 HA CYS 28 HA CYS 28 0.447 -1.614 -1.138
204 HB2 CYS 28 1HB CYS 28 -1.383 0.804 -1.008
205 HB3 CYS 28 2HB CYS 28 -1.107 -0.307 0.331
206 H GLY 29 H GLY 29 -0.939 -3.217 -0.558
207 HA2 GLY 29 1HA GLY 29 -3.741 -3.360 -1.435
208 HA3 GLY 29 2HA GLY 29 -2.675 -4.490 -2.249
209 HN1 NH2 30 2HN NH2 30 -3.844 -6.560 0.463
210 HN2 NH2 30 1HN NH2 30 -4.260 -6.030 -1.155
Start of MODEL 6
1 H1 GLY 1 1H GLY 1 -9.373 -4.135 12.025
2 H2 GLY 1 2H GLY 1 -8.068 -5.117 11.906
3 H3 GLY 1 3H GLY 1 -8.027 -3.818 12.902
4 HA2 GLY 1 1HA GLY 1 -8.164 -2.294 11.056
5 HA3 GLY 1 2HA GLY 1 -6.747 -3.355 10.929
6 H VAL 2 H VAL 2 -7.453 -2.193 8.639
7 HA VAL 2 HA VAL 2 -8.159 -4.352 6.876
8 HB VAL 2 HB VAL 2 -10.443 -3.660 7.580
9 HG11 VAL 2 1HG1 VAL 2 -10.043 -1.243 7.994
10 HG12 VAL 2 2HG1 VAL 2 -9.864 -0.982 6.244
11 HG13 VAL 2 3HG1 VAL 2 -11.413 -1.528 6.913
12 HG21 VAL 2 3HG2 VAL 2 -11.451 -3.572 5.415
13 HG22 VAL 2 1HG2 VAL 2 -9.966 -2.971 4.666
14 HG23 VAL 2 2HG2 VAL 2 -10.028 -4.623 5.325
15 H CYS 3 H CYS 3 -7.668 -3.805 4.671
16 HA CYS 3 HA CYS 3 -5.878 -1.457 4.394
17 HB2 CYS 3 1HB CYS 3 -4.986 -3.544 3.627
18 HB3 CYS 3 2HB CYS 3 -6.412 -3.901 2.679
19 HA PRO 4 HA PRO 4 -9.455 0.718 2.585
20 HB2 PRO 4 1HB PRO 4 -7.271 2.676 1.867
21 HB3 PRO 4 2HB PRO 4 -8.900 2.998 2.539
22 HG2 PRO 4 1HG PRO 4 -6.729 3.054 4.154
23 HG3 PRO 4 2HG PRO 4 -8.229 2.237 4.708
24 HD2 PRO 4 1HD PRO 4 -5.739 0.999 3.524
25 HD3 PRO 4 2HD PRO 4 -6.684 0.494 4.953
26 H LYS 5 H LYS 5 -10.107 1.520 0.448
27 HA LYS 5 HA LYS 5 -9.103 -0.203 -1.686
28 HB2 LYS 5 1HB LYS 5 -11.427 1.768 -1.495
29 HB3 LYS 5 2HB LYS 5 -11.035 0.868 -2.945
30 HG2 LYS 5 1HG LYS 5 -12.713 -0.394 -2.017
31 HG3 LYS 5 2HG LYS 5 -11.244 -1.284 -1.666
32 HD2 LYS 5 1HD LYS 5 -12.785 -1.384 0.195
33 HD3 LYS 5 2HD LYS 5 -11.344 -0.508 0.702
34 HE2 LYS 5 1HE LYS 5 -12.543 1.655 0.387
35 HE3 LYS 5 2HE LYS 5 -13.951 0.789 -0.240
36 HZ1 LYS 5 3HZ LYS 5 -14.234 1.359 2.092
37 HZ2 LYS 5 1HZ LYS 5 -14.203 -0.264 1.931
38 HZ3 LYS 5 2HZ LYS 5 -12.898 0.525 2.524
39 H ILE 6 H ILE 6 -7.427 2.100 -0.741
40 HA ILE 6 HA ILE 6 -7.244 3.999 -2.966
41 HB ILE 6 HB ILE 6 -6.843 4.631 -0.606
42 HG12 ILE 6 1HG1 ILE 6 -4.771 5.943 -0.840
43 HG13 ILE 6 2HG1 ILE 6 -4.366 5.082 -2.318
44 HG21 ILE 6 1HG2 ILE 6 -5.654 2.526 0.129
45 HG22 ILE 6 2HG2 ILE 6 -4.219 3.083 -0.752
46 HG23 ILE 6 3HG2 ILE 6 -4.855 4.024 0.608
47 HD11 ILE 6 3HD1 ILE 6 -5.382 7.309 -2.723
48 HD12 ILE 6 1HD1 ILE 6 -6.376 6.022 -3.424
49 HD13 ILE 6 2HD1 ILE 6 -6.861 6.788 -1.889
50 H LEU 7 H LEU 7 -5.563 4.233 -4.415
51 HA LEU 7 HA LEU 7 -3.691 1.928 -4.783
52 HB2 LEU 7 1HB LEU 7 -5.291 2.300 -6.657
53 HB3 LEU 7 2HB LEU 7 -4.697 3.949 -6.830
54 HG LEU 7 HG LEU 7 -2.431 3.051 -7.402
55 HD11 LEU 7 1HD1 LEU 7 -2.509 0.847 -6.269
56 HD12 LEU 7 2HD1 LEU 7 -3.815 0.326 -7.354
57 HD13 LEU 7 3HD1 LEU 7 -2.189 0.649 -7.993
58 HD21 LEU 7 3HD2 LEU 7 -3.033 2.264 -9.652
59 HD22 LEU 7 1HD2 LEU 7 -4.705 1.975 -9.119
60 HD23 LEU 7 2HD2 LEU 7 -4.051 3.628 -9.162
61 H LYS 8 H LYS 8 -2.264 2.637 -3.245
62 HA LYS 8 HA LYS 8 -0.968 5.317 -3.569
63 HB2 LYS 8 1HB LYS 8 -2.149 4.704 -1.379
64 HB3 LYS 8 2HB LYS 8 -0.914 3.459 -1.141
65 HG2 LYS 8 1HG LYS 8 0.837 5.309 -1.345
66 HG3 LYS 8 2HG LYS 8 -0.490 6.477 -1.436
67 HD2 LYS 8 1HD LYS 8 -1.251 5.705 0.833
68 HD3 LYS 8 2HD LYS 8 0.162 4.614 0.880
69 HE2 LYS 8 1HE LYS 8 1.658 6.602 0.540
70 HE3 LYS 8 2HE LYS 8 0.241 7.659 0.610
71 HZ1 LYS 8 3HZ LYS 8 1.347 7.530 2.754
72 HZ2 LYS 8 1HZ LYS 8 -0.136 6.856 2.891
73 HZ3 LYS 8 2HZ LYS 8 1.204 5.900 2.800
74 H LYS 9 H LYS 9 1.195 5.389 -4.175
75 HA LYS 9 HA LYS 9 2.581 2.925 -4.863
76 HB2 LYS 9 1HB LYS 9 2.763 5.316 -5.910
77 HB3 LYS 9 2HB LYS 9 3.901 5.621 -4.580
78 HG2 LYS 9 1HG LYS 9 5.364 3.824 -5.380
79 HG3 LYS 9 2HG LYS 9 4.188 3.398 -6.639
80 HD2 LYS 9 1HD LYS 9 4.490 5.630 -7.682
81 HD3 LYS 9 2HD LYS 9 5.576 6.099 -6.371
82 HE2 LYS 9 1HE LYS 9 6.954 5.542 -8.229
83 HE3 LYS 9 2HE LYS 9 7.149 4.263 -7.029
84 HZ1 LYS 9 3HZ LYS 9 6.886 3.391 -9.283
85 HZ2 LYS 9 1HZ LYS 9 5.642 2.884 -8.357
86 HZ3 LYS 9 2HZ LYS 9 5.425 4.095 -9.445
87 H CYS 10 H CYS 10 4.706 2.366 -4.035
88 HA CYS 10 HA CYS 10 5.462 3.132 -1.292
89 HB2 CYS 10 1HB CYS 10 5.056 0.903 -0.292
90 HB3 CYS 10 2HB CYS 10 3.592 1.728 -0.783
91 H ARG 11 H ARG 11 7.360 2.446 -0.537
92 HA ARG 11 HA ARG 11 9.305 1.078 -2.328
93 HB2 ARG 11 1HB ARG 11 9.604 2.356 0.424
94 HB3 ARG 11 2HB ARG 11 10.921 1.775 -0.587
95 HG2 ARG 11 1HG ARG 11 10.611 3.497 -2.211
96 HG3 ARG 11 2HG ARG 11 9.052 3.995 -1.548
97 HD2 ARG 11 1HD ARG 11 11.678 4.215 -0.039
98 HD3 ARG 11 2HD ARG 11 10.928 5.527 -0.967
99 HE ARG 11 HE ARG 11 8.951 4.572 0.814
100 HH11 ARG 11 1HH1 ARG 11 12.097 6.183 1.124
101 HH12 ARG 11 2HH1 ARG 11 11.647 6.971 2.607
102 HH21 ARG 11 1HH2 ARG 11 8.409 5.665 2.654
103 HH22 ARG 11 2HH2 ARG 11 9.583 6.663 3.485
104 H ARG 12 H ARG 12 7.581 0.742 0.722
105 HA ARG 12 HA ARG 12 7.651 -2.121 0.840
106 HB2 ARG 12 1HB ARG 12 8.933 -2.433 2.859
107 HB3 ARG 12 2HB ARG 12 9.960 -1.618 1.691
108 HG2 ARG 12 1HG ARG 12 9.495 0.573 2.841
109 HG3 ARG 12 2HG ARG 12 8.499 -0.296 4.020
110 HD2 ARG 12 1HD ARG 12 10.551 -1.717 4.545
111 HD3 ARG 12 2HD ARG 12 11.483 -0.577 3.559
112 HE ARG 12 HE ARG 12 9.786 0.365 5.843
113 HH11 ARG 12 1HH1 ARG 12 13.088 0.043 4.578
114 HH12 ARG 12 2HH1 ARG 12 13.742 1.084 5.808
115 HH21 ARG 12 1HH2 ARG 12 10.686 1.682 7.363
116 HH22 ARG 12 2HH2 ARG 12 12.396 1.999 7.371
117 H ASP 13 H ASP 13 6.771 -2.716 3.223
118 HA ASP 13 HA ASP 13 4.104 -1.882 3.170
119 HB2 ASP 13 1HB ASP 13 5.550 -3.036 5.581
120 HB3 ASP 13 2HB ASP 13 3.825 -3.128 5.241
121 H SER 14 H SER 14 6.738 -0.424 5.011
122 HA SER 14 HA SER 14 5.352 1.086 6.934
123 HB2 SER 14 1HB SER 14 7.799 1.999 5.379
124 HB3 SER 14 2HB SER 14 7.345 2.452 7.025
125 HG SER 14 HG SER 14 7.733 0.272 7.651
126 H ASP 15 H ASP 15 5.422 1.651 3.460
127 HA ASP 15 HA ASP 15 4.536 4.473 3.687
128 HB2 ASP 15 1HB ASP 15 4.914 2.591 1.330
129 HB3 ASP 15 2HB ASP 15 4.361 4.254 1.182
130 H CYS 16 H CYS 16 3.030 1.373 3.750
131 HA CYS 16 HA CYS 16 0.606 2.244 2.335
132 HB2 CYS 16 1HB CYS 16 1.460 -0.453 3.429
133 HB3 CYS 16 2HB CYS 16 -0.008 -0.138 2.528
134 HA PRO 17 HA PRO 17 -1.543 3.296 5.954
135 HB2 PRO 17 1HB PRO 17 -3.916 4.039 4.947
136 HB3 PRO 17 2HB PRO 17 -2.382 4.797 4.380
137 HG2 PRO 17 1HG PRO 17 -3.904 2.539 3.033
138 HG3 PRO 17 2HG PRO 17 -3.354 4.094 2.321
139 HD2 PRO 17 1HD PRO 17 -1.854 1.801 2.160
140 HD3 PRO 17 2HD PRO 17 -1.134 3.431 2.298
141 H GLY 18 H GLY 18 -3.078 2.638 7.516
142 HA2 GLY 18 1HA GLY 18 -4.410 1.144 8.699
143 HA3 GLY 18 2HA GLY 18 -5.104 0.670 7.140
144 H ALA 19 H ALA 19 -5.033 -1.457 6.942
145 HA ALA 19 HA ALA 19 -2.682 -3.032 7.877
146 HB1 ALA 19 3HB ALA 19 -4.132 -4.954 7.706
147 HB2 ALA 19 1HB ALA 19 -4.993 -3.687 8.590
148 HB3 ALA 19 2HB ALA 19 -5.383 -4.019 6.880
149 H CYS 20 H CYS 20 -3.086 -1.341 5.144
150 HA CYS 20 HA CYS 20 -2.752 -3.295 3.039
151 HB2 CYS 20 1HB CYS 20 -1.905 -0.391 3.196
152 HB3 CYS 20 2HB CYS 20 -1.765 -1.378 1.776
153 H ILE 21 H ILE 21 -0.970 -4.045 2.007
154 HA ILE 21 HA ILE 21 1.765 -3.598 3.168
155 HB ILE 21 HB ILE 21 2.278 -5.934 2.437
156 HG12 ILE 21 1HG1 ILE 21 -0.733 -6.395 2.340
157 HG13 ILE 21 2HG1 ILE 21 0.271 -6.190 0.906
158 HG21 ILE 21 1HG2 ILE 21 1.852 -5.279 4.803
159 HG22 ILE 21 2HG2 ILE 21 0.148 -5.738 4.608
160 HG23 ILE 21 3HG2 ILE 21 1.429 -6.960 4.476
161 HD11 ILE 21 3HD1 ILE 21 -0.067 -8.543 1.279
162 HD12 ILE 21 1HD1 ILE 21 1.638 -8.165 1.594
163 HD13 ILE 21 2HD1 ILE 21 0.513 -8.428 2.949
164 H CYS 22 H CYS 22 3.496 -3.794 1.593
165 HA CYS 22 HA CYS 22 2.707 -2.499 -0.940
166 HB2 CYS 22 1HB CYS 22 4.656 -1.795 0.517
167 HB3 CYS 22 2HB CYS 22 5.481 -3.273 0.024
168 H ARG 23 H ARG 23 2.509 -3.489 -2.872
169 HA ARG 23 HA ARG 23 3.124 -6.405 -3.072
170 HB2 ARG 23 1HB ARG 23 1.304 -4.766 -4.853
171 HB3 ARG 23 2HB ARG 23 1.436 -6.516 -4.757
172 HG2 ARG 23 1HG ARG 23 0.176 -4.611 -2.772
173 HG3 ARG 23 2HG ARG 23 -0.585 -5.911 -3.671
174 HD2 ARG 23 1HD ARG 23 1.314 -6.164 -1.307
175 HD3 ARG 23 2HD ARG 23 -0.404 -6.509 -1.342
176 HE ARG 23 HE ARG 23 0.044 -8.377 -2.891
177 HH11 ARG 23 1HH1 ARG 23 2.870 -7.325 -0.965
178 HH12 ARG 23 2HH1 ARG 23 3.510 -8.937 -0.930
179 HH21 ARG 23 1HH2 ARG 23 1.005 -10.375 -2.844
180 HH22 ARG 23 2HH2 ARG 23 2.509 -10.615 -2.010
181 H GLY 24 H GLY 24 3.607 -7.168 -5.348
182 HA2 GLY 24 1HA GLY 24 6.217 -6.266 -5.963
183 HA3 GLY 24 2HA GLY 24 5.273 -7.435 -6.911
184 H ASN 25 H ASN 25 3.231 -5.114 -7.321
185 HA ASN 25 HA ASN 25 4.421 -3.916 -9.701
186 HB2 ASN 25 1HB ASN 25 2.252 -2.942 -10.045
187 HB3 ASN 25 2HB ASN 25 2.060 -4.635 -9.617
188 HD21 ASN 25 1HD2 ASN 25 -0.152 -3.042 -9.432
189 HD22 ASN 25 2HD2 ASN 25 -0.526 -2.733 -7.745
190 H GLY 26 H GLY 26 4.693 -3.099 -6.426
191 HA2 GLY 26 1HA GLY 26 5.855 -1.293 -5.515
192 HA3 GLY 26 2HA GLY 26 5.671 -0.373 -7.027
193 H TYR 27 H TYR 27 2.747 -1.772 -5.774
194 HA TYR 27 HA TYR 27 1.986 0.769 -4.411
195 HB2 TYR 27 1HB TYR 27 0.488 -0.721 -6.583
196 HB3 TYR 27 2HB TYR 27 -0.345 0.283 -5.420
197 HD1 TYR 27 HD2 TYR 27 2.467 0.429 -7.927
198 HD2 TYR 27 HD1 TYR 27 -0.616 2.551 -5.801
199 HE1 TYR 27 HE2 TYR 27 3.043 2.498 -9.167
200 HE2 TYR 27 HE1 TYR 27 -0.072 4.623 -7.059
201 HH TYR 27 HH TYR 27 1.285 5.584 -8.653
202 H CYS 28 H CYS 28 0.282 0.669 -2.938
203 HA CYS 28 HA CYS 28 0.462 -1.548 -1.108
204 HB2 CYS 28 1HB CYS 28 -1.296 0.931 -1.164
205 HB3 CYS 28 2HB CYS 28 -1.109 -0.114 0.243
206 H GLY 29 H GLY 29 -0.862 -3.202 -0.698
207 HA2 GLY 29 1HA GLY 29 -3.691 -3.273 -1.581
208 HA3 GLY 29 2HA GLY 29 -2.620 -4.467 -2.294
209 HN1 NH2 30 2HN NH2 30 -3.961 -6.347 0.480
210 HN2 NH2 30 1HN NH2 30 -4.331 -5.868 -1.165
Start of MODEL 7
1 H1 GLY 1 1H GLY 1 -9.528 -4.393 11.691
2 H2 GLY 1 2H GLY 1 -8.004 -4.989 11.722
3 H3 GLY 1 3H GLY 1 -8.384 -3.666 12.609
4 HA2 GLY 1 1HA GLY 1 -8.788 -2.359 10.640
5 HA3 GLY 1 2HA GLY 1 -7.133 -3.000 10.677
6 H VAL 2 H VAL 2 -7.983 -2.217 8.274
7 HA VAL 2 HA VAL 2 -7.917 -4.581 6.639
8 HB VAL 2 HB VAL 2 -10.328 -4.605 7.147
9 HG11 VAL 2 1HG1 VAL 2 -10.729 -2.177 7.505
10 HG12 VAL 2 2HG1 VAL 2 -10.535 -1.900 5.760
11 HG13 VAL 2 3HG1 VAL 2 -11.870 -2.895 6.362
12 HG21 VAL 2 3HG2 VAL 2 -11.178 -4.858 4.927
13 HG22 VAL 2 1HG2 VAL 2 -9.900 -3.840 4.247
14 HG23 VAL 2 2HG2 VAL 2 -9.498 -5.422 4.955
15 H CYS 3 H CYS 3 -7.339 -4.081 4.493
16 HA CYS 3 HA CYS 3 -6.317 -1.344 4.117
17 HB2 CYS 3 1HB CYS 3 -4.909 -3.261 3.536
18 HB3 CYS 3 2HB CYS 3 -6.103 -3.812 2.365
19 HA PRO 4 HA PRO 4 -10.220 -0.486 1.922
20 HB2 PRO 4 1HB PRO 4 -9.906 2.205 1.492
21 HB3 PRO 4 2HB PRO 4 -10.291 1.498 3.088
22 HG2 PRO 4 1HG PRO 4 -7.565 2.292 2.020
23 HG3 PRO 4 2HG PRO 4 -8.303 2.721 3.597
24 HD2 PRO 4 1HD PRO 4 -6.565 0.659 3.340
25 HD3 PRO 4 2HD PRO 4 -7.974 0.540 4.438
26 H LYS 5 H LYS 5 -10.815 0.720 -0.187
27 HA LYS 5 HA LYS 5 -9.335 -0.533 -2.329
28 HB2 LYS 5 1HB LYS 5 -11.883 -0.311 -1.933
29 HB3 LYS 5 2HB LYS 5 -11.730 1.317 -2.599
30 HG2 LYS 5 1HG LYS 5 -10.809 0.304 -4.717
31 HG3 LYS 5 2HG LYS 5 -10.961 -1.301 -3.983
32 HD2 LYS 5 1HD LYS 5 -13.425 -0.975 -3.793
33 HD3 LYS 5 2HD LYS 5 -13.256 0.652 -4.458
34 HE2 LYS 5 1HE LYS 5 -14.011 -0.743 -6.238
35 HE3 LYS 5 2HE LYS 5 -12.330 -0.321 -6.573
36 HZ1 LYS 5 3HZ LYS 5 -12.780 -2.677 -6.956
37 HZ2 LYS 5 1HZ LYS 5 -11.690 -2.526 -5.752
38 HZ3 LYS 5 2HZ LYS 5 -13.248 -2.898 -5.410
39 H ILE 6 H ILE 6 -7.725 1.382 -1.140
40 HA ILE 6 HA ILE 6 -7.484 3.783 -2.869
41 HB ILE 6 HB ILE 6 -5.563 4.341 -1.424
42 HG12 ILE 6 1HG1 ILE 6 -6.167 1.764 0.100
43 HG13 ILE 6 2HG1 ILE 6 -4.780 2.021 -0.958
44 HG21 ILE 6 1HG2 ILE 6 -7.860 5.042 -0.855
45 HG22 ILE 6 2HG2 ILE 6 -8.058 3.604 0.161
46 HG23 ILE 6 3HG2 ILE 6 -6.856 4.842 0.581
47 HD11 ILE 6 3HD1 ILE 6 -4.053 2.307 1.295
48 HD12 ILE 6 1HD1 ILE 6 -4.047 3.901 0.529
49 HD13 ILE 6 2HD1 ILE 6 -5.349 3.457 1.658
50 H LEU 7 H LEU 7 -5.269 4.332 -3.711
51 HA LEU 7 HA LEU 7 -3.578 2.055 -4.511
52 HB2 LEU 7 1HB LEU 7 -5.292 2.338 -6.315
53 HB3 LEU 7 2HB LEU 7 -4.777 4.006 -6.524
54 HG LEU 7 HG LEU 7 -2.509 3.191 -7.199
55 HD11 LEU 7 1HD1 LEU 7 -2.475 0.976 -6.063
56 HD12 LEU 7 2HD1 LEU 7 -3.803 0.421 -7.103
57 HD13 LEU 7 3HD1 LEU 7 -2.213 0.797 -7.800
58 HD21 LEU 7 3HD2 LEU 7 -3.191 2.382 -9.419
59 HD22 LEU 7 1HD2 LEU 7 -4.825 2.044 -8.807
60 HD23 LEU 7 2HD2 LEU 7 -4.224 3.715 -8.879
61 H LYS 8 H LYS 8 -2.043 2.792 -3.142
62 HA LYS 8 HA LYS 8 -0.814 5.499 -3.591
63 HB2 LYS 8 1HB LYS 8 -0.882 3.692 -1.117
64 HB3 LYS 8 2HB LYS 8 0.114 5.147 -1.278
65 HG2 LYS 8 1HG LYS 8 -2.007 6.470 -1.700
66 HG3 LYS 8 2HG LYS 8 -2.925 5.008 -1.273
67 HD2 LYS 8 1HD LYS 8 -1.806 4.955 0.932
68 HD3 LYS 8 2HD LYS 8 -0.907 6.421 0.540
69 HE2 LYS 8 1HE LYS 8 -3.959 6.232 0.657
70 HE3 LYS 8 2HE LYS 8 -2.942 6.769 1.997
71 HZ1 LYS 8 3HZ LYS 8 -3.780 8.654 0.764
72 HZ2 LYS 8 1HZ LYS 8 -2.158 8.599 0.600
73 HZ3 LYS 8 2HZ LYS 8 -3.126 8.130 -0.636
74 H LYS 9 H LYS 9 1.345 5.592 -4.163
75 HA LYS 9 HA LYS 9 2.781 3.223 -5.007
76 HB2 LYS 9 1HB LYS 9 3.672 6.097 -4.375
77 HB3 LYS 9 2HB LYS 9 4.748 4.870 -5.047
78 HG2 LYS 9 1HG LYS 9 3.439 4.696 -7.061
79 HG3 LYS 9 2HG LYS 9 2.191 5.782 -6.415
80 HD2 LYS 9 1HD LYS 9 3.554 6.997 -7.980
81 HD3 LYS 9 2HD LYS 9 3.848 7.631 -6.353
82 HE2 LYS 9 1HE LYS 9 5.947 6.304 -6.211
83 HE3 LYS 9 2HE LYS 9 5.627 5.614 -7.809
84 HZ1 LYS 9 3HZ LYS 9 7.173 7.473 -7.937
85 HZ2 LYS 9 1HZ LYS 9 5.802 7.855 -8.738
86 HZ3 LYS 9 2HZ LYS 9 6.093 8.495 -7.260
87 H CYS 10 H CYS 10 4.697 2.314 -4.107
88 HA CYS 10 HA CYS 10 5.627 3.104 -1.424
89 HB2 CYS 10 1HB CYS 10 5.134 0.945 -0.342
90 HB3 CYS 10 2HB CYS 10 3.680 1.795 -0.833
91 H ARG 11 H ARG 11 7.482 2.205 -0.687
92 HA ARG 11 HA ARG 11 9.231 0.670 -2.563
93 HB2 ARG 11 1HB ARG 11 9.810 2.002 0.117
94 HB3 ARG 11 2HB ARG 11 11.004 1.306 -0.970
95 HG2 ARG 11 1HG ARG 11 10.721 3.019 -2.601
96 HG3 ARG 11 2HG ARG 11 9.236 3.632 -1.867
97 HD2 ARG 11 1HD ARG 11 11.950 3.717 -0.510
98 HD3 ARG 11 2HD ARG 11 11.227 5.053 -1.423
99 HE ARG 11 HE ARG 11 9.316 4.227 0.507
100 HH11 ARG 11 1HH1 ARG 11 12.519 5.751 0.535
101 HH12 ARG 11 2HH1 ARG 11 12.199 6.602 2.018
102 HH21 ARG 11 1HH2 ARG 11 8.945 5.382 2.354
103 HH22 ARG 11 2HH2 ARG 11 10.198 6.382 3.053
104 H ARG 12 H ARG 12 7.688 0.587 0.609
105 HA ARG 12 HA ARG 12 7.658 -2.282 0.866
106 HB2 ARG 12 1HB ARG 12 10.039 -1.519 1.582
107 HB3 ARG 12 2HB ARG 12 9.262 -0.700 2.923
108 HG2 ARG 12 1HG ARG 12 10.270 -2.773 3.597
109 HG3 ARG 12 2HG ARG 12 8.546 -2.871 3.857
110 HD2 ARG 12 1HD ARG 12 9.822 -3.983 1.323
111 HD3 ARG 12 2HD ARG 12 9.891 -4.885 2.831
112 HE ARG 12 HE ARG 12 7.440 -4.926 2.932
113 HH11 ARG 12 1HH1 ARG 12 8.911 -4.631 -0.292
114 HH12 ARG 12 2HH1 ARG 12 7.513 -5.317 -1.060
115 HH21 ARG 12 1HH2 ARG 12 5.635 -5.542 1.866
116 HH22 ARG 12 2HH2 ARG 12 5.660 -5.804 0.143
117 H ASP 13 H ASP 13 6.838 -2.718 3.264
118 HA ASP 13 HA ASP 13 4.165 -1.844 3.192
119 HB2 ASP 13 1HB ASP 13 5.587 -3.052 5.591
120 HB3 ASP 13 2HB ASP 13 3.866 -3.151 5.204
121 H SER 14 H SER 14 6.860 -0.497 5.044
122 HA SER 14 HA SER 14 5.467 1.096 6.919
123 HB2 SER 14 1HB SER 14 8.081 1.745 5.505
124 HB3 SER 14 2HB SER 14 7.533 2.367 7.070
125 HG SER 14 HG SER 14 9.004 0.638 7.330
126 H ASP 15 H ASP 15 5.705 1.573 3.453
127 HA ASP 15 HA ASP 15 4.964 4.447 3.575
128 HB2 ASP 15 1HB ASP 15 5.233 2.485 1.274
129 HB3 ASP 15 2HB ASP 15 4.789 4.174 1.084
130 H CYS 16 H CYS 16 3.293 1.469 3.819
131 HA CYS 16 HA CYS 16 0.818 2.458 2.507
132 HB2 CYS 16 1HB CYS 16 1.599 -0.317 3.455
133 HB3 CYS 16 2HB CYS 16 0.126 0.118 2.613
134 HA PRO 17 HA PRO 17 -0.894 3.382 6.394
135 HB2 PRO 17 1HB PRO 17 -3.306 4.309 5.700
136 HB3 PRO 17 2HB PRO 17 -1.803 5.026 5.005
137 HG2 PRO 17 1HG PRO 17 -3.560 2.903 3.726
138 HG3 PRO 17 2HG PRO 17 -3.069 4.488 3.041
139 HD2 PRO 17 1HD PRO 17 -1.646 2.206 2.543
140 HD3 PRO 17 2HD PRO 17 -0.853 3.794 2.743
141 H GLY 18 H GLY 18 -2.263 2.645 8.059
142 HA2 GLY 18 1HA GLY 18 -3.580 1.156 9.256
143 HA3 GLY 18 2HA GLY 18 -4.495 0.935 7.758
144 H ALA 19 H ALA 19 -4.697 -1.127 7.275
145 HA ALA 19 HA ALA 19 -2.628 -3.127 7.991
146 HB1 ALA 19 3HB ALA 19 -4.390 -4.748 7.524
147 HB2 ALA 19 1HB ALA 19 -5.021 -3.481 8.590
148 HB3 ALA 19 2HB ALA 19 -5.431 -3.481 6.856
149 H CYS 20 H CYS 20 -2.925 -1.132 5.346
150 HA CYS 20 HA CYS 20 -2.681 -2.997 3.149
151 HB2 CYS 20 1HB CYS 20 -1.783 -0.108 3.380
152 HB3 CYS 20 2HB CYS 20 -1.749 -1.035 1.925
153 H ILE 21 H ILE 21 -0.979 -3.811 2.094
154 HA ILE 21 HA ILE 21 1.795 -3.495 3.204
155 HB ILE 21 HB ILE 21 2.195 -5.834 2.441
156 HG12 ILE 21 1HG1 ILE 21 -0.835 -6.154 2.318
157 HG13 ILE 21 2HG1 ILE 21 0.190 -5.973 0.893
158 HG21 ILE 21 1HG2 ILE 21 1.789 -5.205 4.816
159 HG22 ILE 21 2HG2 ILE 21 0.066 -5.587 4.609
160 HG23 ILE 21 3HG2 ILE 21 1.295 -6.860 4.456
161 HD11 ILE 21 3HD1 ILE 21 -0.264 -8.313 1.227
162 HD12 ILE 21 1HD1 ILE 21 1.456 -8.023 1.560
163 HD13 ILE 21 2HD1 ILE 21 0.307 -8.252 2.902
164 H CYS 22 H CYS 22 3.503 -3.779 1.612
165 HA CYS 22 HA CYS 22 2.728 -2.399 -0.891
166 HB2 CYS 22 1HB CYS 22 4.687 -1.700 0.536
167 HB3 CYS 22 2HB CYS 22 5.499 -3.189 0.070
168 H ARG 23 H ARG 23 2.181 -3.483 -2.660
169 HA ARG 23 HA ARG 23 2.772 -6.358 -2.947
170 HB2 ARG 23 1HB ARG 23 1.102 -4.526 -4.706
171 HB3 ARG 23 2HB ARG 23 1.124 -6.283 -4.736
172 HG2 ARG 23 1HG ARG 23 0.019 -4.474 -2.554
173 HG3 ARG 23 2HG ARG 23 -0.880 -5.540 -3.622
174 HD2 ARG 23 1HD ARG 23 1.018 -6.382 -1.396
175 HD3 ARG 23 2HD ARG 23 -0.739 -6.464 -1.365
176 HE ARG 23 HE ARG 23 -0.589 -8.065 -3.299
177 HH11 ARG 23 1HH1 ARG 23 2.119 -7.944 -0.996
178 HH12 ARG 23 2HH1 ARG 23 2.591 -9.576 -1.357
179 HH21 ARG 23 1HH2 ARG 23 0.094 -10.141 -3.700
180 HH22 ARG 23 2HH2 ARG 23 1.464 -10.797 -2.858
181 H GLY 24 H GLY 24 3.275 -7.155 -5.207
182 HA2 GLY 24 1HA GLY 24 5.931 -6.381 -5.819
183 HA3 GLY 24 2HA GLY 24 4.935 -7.508 -6.763
184 H ASN 25 H ASN 25 3.003 -5.086 -7.174
185 HA ASN 25 HA ASN 25 4.243 -3.974 -9.569
186 HB2 ASN 25 1HB ASN 25 2.126 -2.913 -9.933
187 HB3 ASN 25 2HB ASN 25 1.843 -4.579 -9.455
188 HD21 ASN 25 1HD2 ASN 25 -0.258 -2.805 -9.320
189 HD22 ASN 25 2HD2 ASN 25 -0.615 -2.446 -7.638
190 H GLY 26 H GLY 26 4.571 -3.126 -6.306
191 HA2 GLY 26 1HA GLY 26 5.803 -1.357 -5.417
192 HA3 GLY 26 2HA GLY 26 5.699 -0.474 -6.961
193 H TYR 27 H TYR 27 2.720 -1.699 -5.584
194 HA TYR 27 HA TYR 27 2.101 0.920 -4.308
195 HB2 TYR 27 1HB TYR 27 0.510 -0.530 -6.422
196 HB3 TYR 27 2HB TYR 27 -0.281 0.508 -5.265
197 HD1 TYR 27 HD1 TYR 27 2.562 0.577 -7.755
198 HD2 TYR 27 HD2 TYR 27 -0.641 2.710 -5.825
199 HE1 TYR 27 HE1 TYR 27 3.019 2.539 -9.180
200 HE2 TYR 27 HE2 TYR 27 -0.279 4.640 -7.339
201 HH TYR 27 HH TYR 27 0.943 5.477 -9.103
202 H CYS 28 H CYS 28 0.374 0.910 -2.820
203 HA CYS 28 HA CYS 28 0.468 -1.299 -0.973
204 HB2 CYS 28 1HB CYS 28 -1.215 1.234 -1.023
205 HB3 CYS 28 2HB CYS 28 -1.026 0.194 0.391
206 H GLY 29 H GLY 29 -0.935 -2.886 -0.519
207 HA2 GLY 29 1HA GLY 29 -3.760 -2.867 -1.369
208 HA3 GLY 29 2HA GLY 29 -2.747 -4.052 -2.176
209 HN1 NH2 30 2HN NH2 30 -4.026 -6.049 0.544
210 HN2 NH2 30 1HN NH2 30 -4.421 -5.497 -1.073
Start of MODEL 8
1 H1 GLY 1 1H GLY 1 -9.262 -4.034 12.107
2 H2 GLY 1 2H GLY 1 -8.016 -5.078 11.910
3 H3 GLY 1 3H GLY 1 -7.875 -3.823 12.952
4 HA2 GLY 1 1HA GLY 1 -7.983 -2.223 11.168
5 HA3 GLY 1 2HA GLY 1 -6.630 -3.353 10.958
6 H VAL 2 H VAL 2 -7.306 -2.091 8.731
7 HA VAL 2 HA VAL 2 -8.205 -4.137 6.919
8 HB VAL 2 HB VAL 2 -10.419 -3.318 7.689
9 HG11 VAL 2 1HG1 VAL 2 -9.844 -0.956 8.206
10 HG12 VAL 2 2HG1 VAL 2 -9.674 -0.626 6.468
11 HG13 VAL 2 3HG1 VAL 2 -11.246 -1.093 7.137
12 HG21 VAL 2 3HG2 VAL 2 -11.455 -3.053 5.549
13 HG22 VAL 2 1HG2 VAL 2 -9.943 -2.525 4.800
14 HG23 VAL 2 2HG2 VAL 2 -10.114 -4.197 5.382
15 H CYS 3 H CYS 3 -7.704 -3.573 4.732
16 HA CYS 3 HA CYS 3 -5.753 -1.348 4.482
17 HB2 CYS 3 1HB CYS 3 -4.976 -3.459 3.695
18 HB3 CYS 3 2HB CYS 3 -6.435 -3.765 2.784
19 HA PRO 4 HA PRO 4 -9.135 1.152 2.711
20 HB2 PRO 4 1HB PRO 4 -6.706 2.796 1.960
21 HB3 PRO 4 2HB PRO 4 -8.305 3.358 2.548
22 HG2 PRO 4 1HG PRO 4 -6.228 3.196 4.266
23 HG3 PRO 4 2HG PRO 4 -7.830 2.557 4.767
24 HD2 PRO 4 1HD PRO 4 -5.440 1.035 3.724
25 HD3 PRO 4 2HD PRO 4 -6.509 0.657 5.102
26 H LYS 5 H LYS 5 -9.971 1.497 0.660
27 HA LYS 5 HA LYS 5 -8.955 -0.305 -1.340
28 HB2 LYS 5 1HB LYS 5 -11.093 0.067 -2.429
29 HB3 LYS 5 2HB LYS 5 -11.327 -0.148 -0.697
30 HG2 LYS 5 1HG LYS 5 -11.566 2.321 -0.418
31 HG3 LYS 5 2HG LYS 5 -11.319 2.539 -2.160
32 HD2 LYS 5 1HD LYS 5 -13.338 1.173 -2.621
33 HD3 LYS 5 2HD LYS 5 -13.586 0.955 -0.873
34 HE2 LYS 5 1HE LYS 5 -13.788 3.420 -0.597
35 HE3 LYS 5 2HE LYS 5 -13.540 3.638 -2.337
36 HZ1 LYS 5 3HZ LYS 5 -15.892 3.670 -1.768
37 HZ2 LYS 5 1HZ LYS 5 -15.586 2.378 -2.719
38 HZ3 LYS 5 2HZ LYS 5 -15.816 2.176 -1.112
39 H ILE 6 H ILE 6 -7.595 2.398 -0.922
40 HA ILE 6 HA ILE 6 -7.726 3.671 -3.595
41 HB ILE 6 HB ILE 6 -6.113 5.277 -2.744
42 HG12 ILE 6 1HG1 ILE 6 -6.099 3.716 -0.121
43 HG13 ILE 6 2HG1 ILE 6 -4.771 3.775 -1.280
44 HG21 ILE 6 1HG2 ILE 6 -8.577 5.514 -2.334
45 HG22 ILE 6 2HG2 ILE 6 -8.338 4.848 -0.703
46 HG23 ILE 6 3HG2 ILE 6 -7.576 6.382 -1.170
47 HD11 ILE 6 3HD1 ILE 6 -4.273 5.304 0.494
48 HD12 ILE 6 1HD1 ILE 6 -4.625 6.253 -0.960
49 HD13 ILE 6 2HD1 ILE 6 -5.838 6.113 0.339
50 H LEU 7 H LEU 7 -5.961 3.932 -5.015
51 HA LEU 7 HA LEU 7 -3.939 1.744 -4.958
52 HB2 LEU 7 1HB LEU 7 -5.413 1.941 -6.943
53 HB3 LEU 7 2HB LEU 7 -4.851 3.589 -7.203
54 HG LEU 7 HG LEU 7 -2.561 2.747 -7.621
55 HD11 LEU 7 1HD1 LEU 7 -2.566 0.655 -6.288
56 HD12 LEU 7 2HD1 LEU 7 -3.806 -0.033 -7.357
57 HD13 LEU 7 3HD1 LEU 7 -2.176 0.310 -7.974
58 HD21 LEU 7 3HD2 LEU 7 -3.023 1.723 -9.806
59 HD22 LEU 7 1HD2 LEU 7 -4.698 1.393 -9.311
60 HD23 LEU 7 2HD2 LEU 7 -4.130 3.068 -9.484
61 H LYS 8 H LYS 8 -2.464 2.484 -3.525
62 HA LYS 8 HA LYS 8 -1.297 5.227 -3.831
63 HB2 LYS 8 1HB LYS 8 -2.422 4.582 -1.641
64 HB3 LYS 8 2HB LYS 8 -1.189 3.328 -1.435
65 HG2 LYS 8 1HG LYS 8 0.541 5.242 -1.704
66 HG3 LYS 8 2HG LYS 8 -0.815 6.357 -1.557
67 HD2 LYS 8 1HD LYS 8 -1.294 5.498 0.688
68 HD3 LYS 8 2HD LYS 8 -0.017 4.271 0.522
69 HE2 LYS 8 1HE LYS 8 0.513 7.266 0.283
70 HE3 LYS 8 2HE LYS 8 0.587 6.411 1.828
71 HZ1 LYS 8 3HZ LYS 8 2.769 6.602 0.702
72 HZ2 LYS 8 1HZ LYS 8 2.357 5.062 1.029
73 HZ3 LYS 8 2HZ LYS 8 2.256 5.620 -0.508
74 H LYS 9 H LYS 9 0.859 5.434 -4.398
75 HA LYS 9 HA LYS 9 2.518 3.189 -5.127
76 HB2 LYS 9 1HB LYS 9 3.128 6.119 -4.453
77 HB3 LYS 9 2HB LYS 9 4.360 4.993 -5.026
78 HG2 LYS 9 1HG LYS 9 3.165 4.622 -7.099
79 HG3 LYS 9 2HG LYS 9 1.860 5.719 -6.602
80 HD2 LYS 9 1HD LYS 9 4.782 6.501 -7.013
81 HD3 LYS 9 2HD LYS 9 3.484 6.730 -8.195
82 HE2 LYS 9 1HE LYS 9 2.261 8.178 -6.565
83 HE3 LYS 9 2HE LYS 9 3.597 7.998 -5.417
84 HZ1 LYS 9 3HZ LYS 9 3.800 10.041 -6.693
85 HZ2 LYS 9 1HZ LYS 9 5.055 9.060 -7.049
86 HZ3 LYS 9 2HZ LYS 9 3.820 9.229 -8.109
87 H CYS 10 H CYS 10 4.392 2.380 -4.141
88 HA CYS 10 HA CYS 10 5.248 3.219 -1.461
89 HB2 CYS 10 1HB CYS 10 4.797 1.101 -0.307
90 HB3 CYS 10 2HB CYS 10 3.320 1.809 -0.922
91 H ARG 11 H ARG 11 7.070 2.035 -0.614
92 HA ARG 11 HA ARG 11 8.540 0.264 -2.530
93 HB2 ARG 11 1HB ARG 11 9.717 2.437 -0.741
94 HB3 ARG 11 2HB ARG 11 10.670 1.257 -1.641
95 HG2 ARG 11 1HG ARG 11 8.820 3.333 -2.901
96 HG3 ARG 11 2HG ARG 11 10.571 3.454 -2.764
97 HD2 ARG 11 1HD ARG 11 10.870 1.470 -4.179
98 HD3 ARG 11 2HD ARG 11 9.129 1.255 -4.320
99 HE ARG 11 HE ARG 11 10.796 3.360 -5.566
100 HH11 ARG 11 1HH1 ARG 11 7.476 2.132 -5.164
101 HH12 ARG 11 2HH1 ARG 11 6.925 2.962 -6.591
102 HH21 ARG 11 1HH2 ARG 11 9.985 4.426 -7.342
103 HH22 ARG 11 2HH2 ARG 11 8.313 4.267 -7.782
104 H ARG 12 H ARG 12 7.159 0.559 0.547
105 HA ARG 12 HA ARG 12 7.662 -2.144 1.197
106 HB2 ARG 12 1HB ARG 12 8.862 -1.875 3.341
107 HB3 ARG 12 2HB ARG 12 9.871 -1.349 2.006
108 HG2 ARG 12 1HG ARG 12 9.405 1.008 2.495
109 HG3 ARG 12 2HG ARG 12 8.261 0.569 3.766
110 HD2 ARG 12 1HD ARG 12 11.233 -0.101 3.803
111 HD3 ARG 12 2HD ARG 12 10.498 1.281 4.604
112 HE ARG 12 HE ARG 12 9.290 -0.157 6.100
113 HH11 ARG 12 1HH1 ARG 12 11.779 -1.937 4.292
114 HH12 ARG 12 2HH1 ARG 12 11.758 -3.252 5.429
115 HH21 ARG 12 1HH2 ARG 12 9.312 -1.847 7.469
116 HH22 ARG 12 2HH2 ARG 12 10.384 -3.200 7.222
117 H ASP 13 H ASP 13 6.730 -2.758 3.319
118 HA ASP 13 HA ASP 13 4.015 -2.059 3.250
119 HB2 ASP 13 1HB ASP 13 5.502 -3.313 5.597
120 HB3 ASP 13 2HB ASP 13 3.784 -3.469 5.234
121 H SER 14 H SER 14 6.565 -0.771 5.351
122 HA SER 14 HA SER 14 5.023 0.622 7.267
123 HB2 SER 14 1HB SER 14 7.675 1.522 6.084
124 HB3 SER 14 2HB SER 14 7.058 1.854 7.706
125 HG SER 14 HG SER 14 7.307 -0.329 8.214
126 H ASP 15 H ASP 15 5.414 1.386 3.894
127 HA ASP 15 HA ASP 15 4.573 4.218 4.245
128 HB2 ASP 15 1HB ASP 15 6.527 3.566 2.784
129 HB3 ASP 15 2HB ASP 15 5.392 2.715 1.733
130 H CYS 16 H CYS 16 3.042 1.271 4.040
131 HA CYS 16 HA CYS 16 0.770 2.217 2.358
132 HB2 CYS 16 1HB CYS 16 1.581 -0.529 3.334
133 HB3 CYS 16 2HB CYS 16 0.066 -0.173 2.530
134 HA PRO 17 HA PRO 17 -1.464 3.317 5.869
135 HB2 PRO 17 1HB PRO 17 -3.858 3.948 4.823
136 HB3 PRO 17 2HB PRO 17 -2.343 4.739 4.254
137 HG2 PRO 17 1HG PRO 17 -3.751 2.376 2.959
138 HG3 PRO 17 2HG PRO 17 -3.286 3.934 2.202
139 HD2 PRO 17 1HD PRO 17 -1.648 1.762 2.085
140 HD3 PRO 17 2HD PRO 17 -1.009 3.421 2.280
141 H GLY 18 H GLY 18 -2.897 2.642 7.486
142 HA2 GLY 18 1HA GLY 18 -4.169 1.160 8.742
143 HA3 GLY 18 2HA GLY 18 -4.947 0.698 7.220
144 H ALA 19 H ALA 19 -4.908 -1.416 6.975
145 HA ALA 19 HA ALA 19 -2.593 -3.065 7.864
146 HB1 ALA 19 3HB ALA 19 -4.110 -4.940 7.668
147 HB2 ALA 19 1HB ALA 19 -4.916 -3.658 8.583
148 HB3 ALA 19 2HB ALA 19 -5.336 -3.945 6.872
149 H CYS 20 H CYS 20 -2.984 -1.341 5.134
150 HA CYS 20 HA CYS 20 -2.739 -3.295 3.023
151 HB2 CYS 20 1HB CYS 20 -1.825 -0.407 3.181
152 HB3 CYS 20 2HB CYS 20 -1.691 -1.378 1.759
153 H ILE 21 H ILE 21 -0.998 -4.116 1.973
154 HA ILE 21 HA ILE 21 1.755 -3.788 3.135
155 HB ILE 21 HB ILE 21 2.214 -6.065 2.234
156 HG12 ILE 21 1HG1 ILE 21 -0.804 -6.437 2.030
157 HG13 ILE 21 2HG1 ILE 21 0.237 -6.135 0.639
158 HG21 ILE 21 1HG2 ILE 21 1.745 -5.598 4.635
159 HG22 ILE 21 2HG2 ILE 21 0.034 -5.990 4.364
160 HG23 ILE 21 3HG2 ILE 21 1.284 -7.234 4.159
161 HD11 ILE 21 3HD1 ILE 21 -0.164 -8.503 0.804
162 HD12 ILE 21 1HD1 ILE 21 1.542 -8.197 1.185
163 HD13 ILE 21 2HD1 ILE 21 0.379 -8.545 2.488
164 H CYS 22 H CYS 22 3.501 -3.908 1.567
165 HA CYS 22 HA CYS 22 2.742 -2.479 -0.916
166 HB2 CYS 22 1HB CYS 22 4.653 -1.762 0.610
167 HB3 CYS 22 2HB CYS 22 5.524 -3.191 0.064
168 H ARG 23 H ARG 23 2.476 -3.458 -2.819
169 HA ARG 23 HA ARG 23 3.156 -6.331 -3.117
170 HB2 ARG 23 1HB ARG 23 1.445 -4.569 -4.901
171 HB3 ARG 23 2HB ARG 23 1.570 -6.322 -4.943
172 HG2 ARG 23 1HG ARG 23 0.266 -4.595 -2.809
173 HG3 ARG 23 2HG ARG 23 -0.510 -5.732 -3.901
174 HD2 ARG 23 1HD ARG 23 1.335 -6.404 -1.574
175 HD3 ARG 23 2HD ARG 23 -0.408 -6.631 -1.643
176 HE ARG 23 HE ARG 23 -0.047 -8.256 -3.499
177 HH11 ARG 23 1HH1 ARG 23 2.641 -7.800 -1.206
178 HH12 ARG 23 2HH1 ARG 23 3.258 -9.394 -1.510
179 HH21 ARG 23 1HH2 ARG 23 0.832 -10.268 -3.832
180 HH22 ARG 23 2HH2 ARG 23 2.258 -10.762 -2.972
181 H GLY 24 H GLY 24 3.825 -7.057 -5.329
182 HA2 GLY 24 1HA GLY 24 6.439 -6.082 -5.809
183 HA3 GLY 24 2HA GLY 24 5.578 -7.278 -6.802
184 H ASN 25 H ASN 25 3.497 -5.005 -7.311
185 HA ASN 25 HA ASN 25 4.770 -3.793 -9.640
186 HB2 ASN 25 1HB ASN 25 2.601 -2.889 -10.108
187 HB3 ASN 25 2HB ASN 25 2.420 -4.576 -9.651
188 HD21 ASN 25 1HD2 ASN 25 0.192 -2.944 -9.617
189 HD22 ASN 25 2HD2 ASN 25 -0.277 -2.637 -7.953
190 H GLY 26 H GLY 26 4.869 -2.940 -6.362
191 HA2 GLY 26 1HA GLY 26 5.914 -1.085 -5.410
192 HA3 GLY 26 2HA GLY 26 5.817 -0.203 -6.955
193 H TYR 27 H TYR 27 2.906 -1.688 -5.665
194 HA TYR 27 HA TYR 27 2.001 0.874 -4.451
195 HB2 TYR 27 1HB TYR 27 0.615 -0.734 -6.599
196 HB3 TYR 27 2HB TYR 27 -0.297 0.251 -5.485
197 HD1 TYR 27 HD2 TYR 27 2.593 0.505 -7.904
198 HD2 TYR 27 HD1 TYR 27 -0.791 2.425 -6.062
199 HE1 TYR 27 HE2 TYR 27 2.960 2.493 -9.320
200 HE2 TYR 27 HE1 TYR 27 -0.505 4.382 -7.559
201 HH TYR 27 HH TYR 27 0.710 5.300 -9.288
202 H CYS 28 H CYS 28 0.256 0.715 -2.994
203 HA CYS 28 HA CYS 28 0.487 -1.505 -1.159
204 HB2 CYS 28 1HB CYS 28 -1.365 0.907 -1.221
205 HB3 CYS 28 2HB CYS 28 -1.162 -0.146 0.177
206 H GLY 29 H GLY 29 -0.894 -3.140 -0.677
207 HA2 GLY 29 1HA GLY 29 -3.662 -3.278 -1.716
208 HA3 GLY 29 2HA GLY 29 -2.546 -4.479 -2.346
209 HN1 NH2 30 2HN NH2 30 -4.040 -6.270 0.424
210 HN2 NH2 30 1HN NH2 30 -4.360 -5.817 -1.240
Start of MODEL 9
1 H1 GLY 1 1H GLY 1 -9.270 -3.246 12.274
2 H2 GLY 1 2H GLY 1 -7.963 -4.231 12.229
3 H3 GLY 1 3H GLY 1 -7.910 -2.838 13.089
4 HA2 GLY 1 1HA GLY 1 -8.087 -1.508 11.102
5 HA3 GLY 1 2HA GLY 1 -6.667 -2.573 11.056
6 H VAL 2 H VAL 2 -7.390 -1.668 8.674
7 HA VAL 2 HA VAL 2 -8.148 -3.995 7.157
8 HB VAL 2 HB VAL 2 -10.412 -3.202 7.795
9 HG11 VAL 2 1HG1 VAL 2 -9.974 -0.765 7.987
10 HG12 VAL 2 2HG1 VAL 2 -9.800 -0.665 6.221
11 HG13 VAL 2 3HG1 VAL 2 -11.353 -1.124 6.941
12 HG21 VAL 2 3HG2 VAL 2 -11.437 -3.291 5.637
13 HG22 VAL 2 1HG2 VAL 2 -9.949 -2.783 4.827
14 HG23 VAL 2 2HG2 VAL 2 -10.032 -4.369 5.631
15 H CYS 3 H CYS 3 -7.658 -3.713 4.909
16 HA CYS 3 HA CYS 3 -5.850 -1.424 4.364
17 HB2 CYS 3 1HB CYS 3 -4.975 -3.601 3.846
18 HB3 CYS 3 2HB CYS 3 -6.395 -4.042 2.925
19 HA PRO 4 HA PRO 4 -9.533 0.327 2.311
20 HB2 PRO 4 1HB PRO 4 -8.595 2.828 1.730
21 HB3 PRO 4 2HB PRO 4 -9.062 2.318 3.379
22 HG2 PRO 4 1HG PRO 4 -6.277 2.333 2.164
23 HG3 PRO 4 2HG PRO 4 -6.801 3.041 3.729
24 HD2 PRO 4 1HD PRO 4 -5.673 0.597 3.629
25 HD3 PRO 4 2HD PRO 4 -7.056 0.900 4.716
26 H LYS 5 H LYS 5 -10.095 1.127 0.171
27 HA LYS 5 HA LYS 5 -8.740 -0.460 -1.855
28 HB2 LYS 5 1HB LYS 5 -11.164 1.358 -2.106
29 HB3 LYS 5 2HB LYS 5 -10.705 0.060 -3.198
30 HG2 LYS 5 1HG LYS 5 -11.763 -0.249 -0.358
31 HG3 LYS 5 2HG LYS 5 -12.593 -0.576 -1.864
32 HD2 LYS 5 1HD LYS 5 -12.048 -2.695 -1.206
33 HD3 LYS 5 2HD LYS 5 -10.713 -2.342 -2.308
34 HE2 LYS 5 1HE LYS 5 -9.260 -1.800 -0.354
35 HE3 LYS 5 2HE LYS 5 -10.630 -2.022 0.738
36 HZ1 LYS 5 3HZ LYS 5 -9.228 -3.977 0.679
37 HZ2 LYS 5 1HZ LYS 5 -10.697 -4.358 0.074
38 HZ3 LYS 5 2HZ LYS 5 -9.426 -4.156 -0.936
39 H ILE 6 H ILE 6 -7.387 2.054 -0.918
40 HA ILE 6 HA ILE 6 -7.385 3.922 -3.207
41 HB ILE 6 HB ILE 6 -5.590 3.828 -0.752
42 HG12 ILE 6 1HG1 ILE 6 -8.071 5.565 -1.185
43 HG13 ILE 6 2HG1 ILE 6 -8.065 4.104 -0.207
44 HG21 ILE 6 1HG2 ILE 6 -4.612 5.170 -2.582
45 HG22 ILE 6 2HG2 ILE 6 -6.120 6.097 -2.726
46 HG23 ILE 6 3HG2 ILE 6 -5.108 6.210 -1.269
47 HD11 ILE 6 3HD1 ILE 6 -7.885 5.941 1.285
48 HD12 ILE 6 1HD1 ILE 6 -6.320 5.106 1.280
49 HD13 ILE 6 2HD1 ILE 6 -6.525 6.642 0.401
50 H LEU 7 H LEU 7 -5.866 4.066 -4.783
51 HA LEU 7 HA LEU 7 -3.780 1.979 -5.030
52 HB2 LEU 7 1HB LEU 7 -5.232 2.532 -6.972
53 HB3 LEU 7 2HB LEU 7 -4.634 4.190 -6.942
54 HG LEU 7 HG LEU 7 -2.330 3.351 -7.428
55 HD11 LEU 7 1HD1 LEU 7 -2.462 1.055 -6.514
56 HD12 LEU 7 2HD1 LEU 7 -3.690 0.630 -7.725
57 HD13 LEU 7 3HD1 LEU 7 -2.028 1.014 -8.224
58 HD21 LEU 7 3HD2 LEU 7 -2.757 2.775 -9.779
59 HD22 LEU 7 1HD2 LEU 7 -4.460 2.432 -9.401
60 HD23 LEU 7 2HD2 LEU 7 -3.821 4.085 -9.242
61 H LYS 8 H LYS 8 -2.517 2.542 -3.307
62 HA LYS 8 HA LYS 8 -1.277 5.253 -3.170
63 HB2 LYS 8 1HB LYS 8 -2.744 4.065 -1.322
64 HB3 LYS 8 2HB LYS 8 -1.295 3.147 -0.967
65 HG2 LYS 8 1HG LYS 8 -1.529 6.197 -0.942
66 HG3 LYS 8 2HG LYS 8 -1.725 5.156 0.467
67 HD2 LYS 8 1HD LYS 8 0.628 4.352 0.193
68 HD3 LYS 8 2HD LYS 8 0.831 5.513 -1.144
69 HE2 LYS 8 1HE LYS 8 0.303 7.390 0.342
70 HE3 LYS 8 2HE LYS 8 0.005 6.279 1.687
71 HZ1 LYS 8 3HZ LYS 8 2.239 7.244 1.765
72 HZ2 LYS 8 1HZ LYS 8 2.311 5.615 1.614
73 HZ3 LYS 8 2HZ LYS 8 2.624 6.581 0.318
74 H LYS 9 H LYS 9 0.876 5.427 -3.771
75 HA LYS 9 HA LYS 9 2.328 3.071 -4.615
76 HB2 LYS 9 1HB LYS 9 2.404 5.547 -5.484
77 HB3 LYS 9 2HB LYS 9 3.605 5.768 -4.193
78 HG2 LYS 9 1HG LYS 9 5.038 4.044 -5.199
79 HG3 LYS 9 2HG LYS 9 3.804 3.711 -6.429
80 HD2 LYS 9 1HD LYS 9 4.030 6.039 -7.271
81 HD3 LYS 9 2HD LYS 9 5.275 6.354 -6.041
82 HE2 LYS 9 1HE LYS 9 6.671 4.524 -7.000
83 HE3 LYS 9 2HE LYS 9 5.434 4.223 -8.229
84 HZ1 LYS 9 3HZ LYS 9 7.203 5.638 -9.083
85 HZ2 LYS 9 1HZ LYS 9 5.807 6.485 -9.058
86 HZ3 LYS 9 2HZ LYS 9 6.952 6.757 -7.922
87 H CYS 10 H CYS 10 4.473 2.499 -3.925
88 HA CYS 10 HA CYS 10 5.392 3.078 -1.195
89 HB2 CYS 10 1HB CYS 10 5.002 0.833 -0.271
90 HB3 CYS 10 2HB CYS 10 3.502 1.627 -0.705
91 H ARG 11 H ARG 11 7.269 2.086 -0.519
92 HA ARG 11 HA ARG 11 8.880 0.564 -2.531
93 HB2 ARG 11 1HB ARG 11 9.853 2.744 -1.990
94 HB3 ARG 11 2HB ARG 11 9.730 2.422 -0.263
95 HG2 ARG 11 1HG ARG 11 12.031 2.174 -1.061
96 HG3 ARG 11 2HG ARG 11 11.418 0.662 -0.412
97 HD2 ARG 11 1HD ARG 11 10.944 -0.075 -2.824
98 HD3 ARG 11 2HD ARG 11 11.732 1.410 -3.351
99 HE ARG 11 HE ARG 11 13.798 0.520 -2.821
100 HH11 ARG 11 1HH1 ARG 11 11.359 -1.642 -1.374
101 HH12 ARG 11 2HH1 ARG 11 12.543 -2.877 -1.059
102 HH21 ARG 11 1HH2 ARG 11 15.243 -1.115 -2.349
103 HH22 ARG 11 2HH2 ARG 11 14.704 -2.577 -1.583
104 H ARG 12 H ARG 12 7.535 0.654 0.722
105 HA ARG 12 HA ARG 12 7.686 -2.212 0.982
106 HB2 ARG 12 1HB ARG 12 8.940 -2.362 3.039
107 HB3 ARG 12 2HB ARG 12 9.969 -1.653 1.822
108 HG2 ARG 12 1HG ARG 12 8.459 0.044 3.860
109 HG3 ARG 12 2HG ARG 12 10.009 -0.687 4.219
110 HD2 ARG 12 1HD ARG 12 11.178 0.872 3.108
111 HD3 ARG 12 2HD ARG 12 10.163 0.768 1.690
112 HE ARG 12 HE ARG 12 8.773 2.477 2.449
113 HH11 ARG 12 1HH1 ARG 12 11.173 1.797 4.983
114 HH12 ARG 12 2HH1 ARG 12 10.836 3.287 5.813
115 HH21 ARG 12 1HH2 ARG 12 8.391 4.333 3.552
116 HH22 ARG 12 2HH2 ARG 12 9.275 4.719 5.013
117 H ASP 13 H ASP 13 6.818 -2.818 3.302
118 HA ASP 13 HA ASP 13 4.117 -2.070 3.203
119 HB2 ASP 13 1HB ASP 13 5.580 -3.249 5.598
120 HB3 ASP 13 2HB ASP 13 3.853 -3.366 5.259
121 H SER 14 H SER 14 6.685 -0.625 5.151
122 HA SER 14 HA SER 14 5.163 0.876 7.008
123 HB2 SER 14 1HB SER 14 7.770 1.703 5.688
124 HB3 SER 14 2HB SER 14 7.186 2.185 7.284
125 HG SER 14 HG SER 14 7.496 0.054 7.996
126 H ASP 15 H ASP 15 5.417 1.390 3.565
127 HA ASP 15 HA ASP 15 4.652 4.254 3.682
128 HB2 ASP 15 1HB ASP 15 4.851 2.330 1.346
129 HB3 ASP 15 2HB ASP 15 4.643 4.071 1.228
130 H CYS 16 H CYS 16 3.031 1.233 3.857
131 HA CYS 16 HA CYS 16 0.686 2.080 2.290
132 HB2 CYS 16 1HB CYS 16 1.514 -0.578 3.482
133 HB3 CYS 16 2HB CYS 16 0.026 -0.296 2.602
134 HA PRO 17 HA PRO 17 -1.665 3.346 5.662
135 HB2 PRO 17 1HB PRO 17 -4.058 3.796 4.518
136 HB3 PRO 17 2HB PRO 17 -2.564 4.609 3.926
137 HG2 PRO 17 1HG PRO 17 -3.841 2.101 2.781
138 HG3 PRO 17 2HG PRO 17 -3.420 3.617 1.917
139 HD2 PRO 17 1HD PRO 17 -1.704 1.499 2.010
140 HD3 PRO 17 2HD PRO 17 -1.123 3.191 2.074
141 H GLY 18 H GLY 18 -3.041 2.682 7.317
142 HA2 GLY 18 1HA GLY 18 -4.297 1.243 8.635
143 HA3 GLY 18 2HA GLY 18 -5.061 0.702 7.134
144 H ALA 19 H ALA 19 -4.965 -1.410 6.911
145 HA ALA 19 HA ALA 19 -2.695 -3.007 7.994
146 HB1 ALA 19 3HB ALA 19 -4.207 -4.894 7.828
147 HB2 ALA 19 1HB ALA 19 -5.048 -3.567 8.643
148 HB3 ALA 19 2HB ALA 19 -5.397 -3.936 6.934
149 H CYS 20 H CYS 20 -3.015 -1.440 5.157
150 HA CYS 20 HA CYS 20 -2.717 -3.498 3.161
151 HB2 CYS 20 1HB CYS 20 -1.874 -0.587 3.217
152 HB3 CYS 20 2HB CYS 20 -1.669 -1.602 1.831
153 H ILE 21 H ILE 21 -0.942 -4.213 2.040
154 HA ILE 21 HA ILE 21 1.807 -3.820 3.188
155 HB ILE 21 HB ILE 21 2.317 -6.108 2.337
156 HG12 ILE 21 1HG1 ILE 21 -0.690 -6.572 2.186
157 HG13 ILE 21 2HG1 ILE 21 0.320 -6.273 0.773
158 HG21 ILE 21 1HG2 ILE 21 1.869 -5.596 4.733
159 HG22 ILE 21 2HG2 ILE 21 0.166 -6.044 4.496
160 HG23 ILE 21 3HG2 ILE 21 1.450 -7.255 4.303
161 HD11 ILE 21 3HD1 ILE 21 -0.009 -8.645 0.999
162 HD12 ILE 21 1HD1 ILE 21 1.694 -8.278 1.337
163 HD13 ILE 21 2HD1 ILE 21 0.571 -8.632 2.672
164 H CYS 22 H CYS 22 3.534 -3.933 1.585
165 HA CYS 22 HA CYS 22 2.713 -2.542 -0.890
166 HB2 CYS 22 1HB CYS 22 4.678 -1.864 0.551
167 HB3 CYS 22 2HB CYS 22 5.502 -3.326 0.012
168 H ARG 23 H ARG 23 2.575 -3.429 -2.890
169 HA ARG 23 HA ARG 23 3.265 -6.320 -3.228
170 HB2 ARG 23 1HB ARG 23 1.395 -4.670 -4.946
171 HB3 ARG 23 2HB ARG 23 1.593 -6.417 -4.924
172 HG2 ARG 23 1HG ARG 23 0.252 -4.651 -2.862
173 HG3 ARG 23 2HG ARG 23 -0.462 -5.923 -3.837
174 HD2 ARG 23 1HD ARG 23 1.413 -6.248 -1.465
175 HD3 ARG 23 2HD ARG 23 -0.291 -6.646 -1.545
176 HE ARG 23 HE ARG 23 0.238 -8.410 -3.184
177 HH11 ARG 23 1HH1 ARG 23 3.010 -7.370 -1.173
178 HH12 ARG 23 2HH1 ARG 23 3.701 -8.960 -1.215
179 HH21 ARG 23 1HH2 ARG 23 1.267 -10.375 -3.233
180 HH22 ARG 23 2HH2 ARG 23 2.769 -10.609 -2.396
181 H GLY 24 H GLY 24 3.848 -6.964 -5.482
182 HA2 GLY 24 1HA GLY 24 6.403 -5.878 -6.019
183 HA3 GLY 24 2HA GLY 24 5.562 -7.088 -7.009
184 H ASN 25 H ASN 25 3.389 -4.866 -7.407
185 HA ASN 25 HA ASN 25 4.543 -3.590 -9.763
186 HB2 ASN 25 1HB ASN 25 2.340 -2.714 -10.122
187 HB3 ASN 25 2HB ASN 25 2.209 -4.411 -9.691
188 HD21 ASN 25 1HD2 ASN 25 -0.044 -2.825 -9.535
189 HD22 ASN 25 2HD2 ASN 25 -0.449 -2.557 -7.847
190 H GLY 26 H GLY 26 4.751 -2.786 -6.477
191 HA2 GLY 26 1HA GLY 26 5.845 -0.930 -5.561
192 HA3 GLY 26 2HA GLY 26 5.594 -0.003 -7.062
193 H TYR 27 H TYR 27 2.762 -1.578 -5.816
194 HA TYR 27 HA TYR 27 1.889 0.861 -4.343
195 HB2 TYR 27 1HB TYR 27 0.428 -0.565 -6.583
196 HB3 TYR 27 2HB TYR 27 -0.403 0.413 -5.396
197 HD1 TYR 27 HD2 TYR 27 2.303 0.569 -8.001
198 HD2 TYR 27 HD1 TYR 27 -0.564 2.728 -5.629
199 HE1 TYR 27 HE2 TYR 27 2.872 2.649 -9.223
200 HE2 TYR 27 HE1 TYR 27 -0.010 4.822 -6.849
201 HH TYR 27 HH TYR 27 2.405 4.885 -9.503
202 H CYS 28 H CYS 28 0.163 0.592 -2.901
203 HA CYS 28 HA CYS 28 0.512 -1.718 -1.215
204 HB2 CYS 28 1HB CYS 28 -1.358 0.669 -1.066
205 HB3 CYS 28 2HB CYS 28 -1.063 -0.449 0.265
206 H GLY 29 H GLY 29 -0.814 -3.373 -0.717
207 HA2 GLY 29 1HA GLY 29 -3.630 -3.532 -1.645
208 HA3 GLY 29 2HA GLY 29 -2.517 -4.731 -2.287
209 HN1 NH2 30 2HN NH2 30 -3.876 -6.526 0.533
210 HN2 NH2 30 1HN NH2 30 -4.218 -6.125 -1.138
Start of MODEL 10
1 H1 GLY 1 1H GLY 1 -9.365 -3.233 12.261
2 H2 GLY 1 2H GLY 1 -8.071 -4.234 12.208
3 H3 GLY 1 3H GLY 1 -8.004 -2.856 13.089
4 HA2 GLY 1 1HA GLY 1 -8.154 -1.493 11.121
5 HA3 GLY 1 2HA GLY 1 -6.749 -2.575 11.066
6 H VAL 2 H VAL 2 -7.440 -1.630 8.694
7 HA VAL 2 HA VAL 2 -8.233 -3.925 7.143
8 HB VAL 2 HB VAL 2 -10.484 -3.093 7.779
9 HG11 VAL 2 1HG1 VAL 2 -9.999 -0.667 7.999
10 HG12 VAL 2 2HG1 VAL 2 -9.813 -0.552 6.235
11 HG13 VAL 2 3HG1 VAL 2 -11.379 -0.988 6.941
12 HG21 VAL 2 3HG2 VAL 2 -11.498 -3.140 5.613
13 HG22 VAL 2 1HG2 VAL 2 -9.995 -2.653 4.817
14 HG23 VAL 2 2HG2 VAL 2 -10.115 -4.246 5.605
15 H CYS 3 H CYS 3 -7.724 -3.630 4.903
16 HA CYS 3 HA CYS 3 -5.881 -1.358 4.395
17 HB2 CYS 3 1HB CYS 3 -4.979 -3.532 3.922
18 HB3 CYS 3 2HB CYS 3 -6.376 -3.990 2.969
19 HA PRO 4 HA PRO 4 -9.422 0.360 2.047
20 HB2 PRO 4 1HB PRO 4 -8.361 2.801 1.394
21 HB3 PRO 4 2HB PRO 4 -9.016 2.412 3.012
22 HG2 PRO 4 1HG PRO 4 -6.119 2.318 2.113
23 HG3 PRO 4 2HG PRO 4 -6.795 3.098 3.579
24 HD2 PRO 4 1HD PRO 4 -5.690 0.640 3.689
25 HD3 PRO 4 2HD PRO 4 -7.160 1.007 4.632
26 H LYS 5 H LYS 5 -9.888 0.505 -0.134
27 HA LYS 5 HA LYS 5 -8.043 -0.927 -1.856
28 HB2 LYS 5 1HB LYS 5 -10.884 0.097 -2.288
29 HB3 LYS 5 2HB LYS 5 -10.011 -0.978 -3.389
30 HG2 LYS 5 1HG LYS 5 -9.793 -2.672 -1.577
31 HG3 LYS 5 2HG LYS 5 -10.757 -1.635 -0.506
32 HD2 LYS 5 1HD LYS 5 -12.654 -1.744 -2.099
33 HD3 LYS 5 2HD LYS 5 -11.693 -2.789 -3.170
34 HE2 LYS 5 1HE LYS 5 -11.492 -4.468 -1.343
35 HE3 LYS 5 2HE LYS 5 -12.456 -3.432 -0.282
36 HZ1 LYS 5 3HZ LYS 5 -13.816 -5.143 -1.321
37 HZ2 LYS 5 1HZ LYS 5 -14.309 -3.675 -1.839
38 HZ3 LYS 5 2HZ LYS 5 -13.417 -4.635 -2.820
39 H ILE 6 H ILE 6 -7.457 1.956 -1.226
40 HA ILE 6 HA ILE 6 -7.606 3.417 -3.778
41 HB ILE 6 HB ILE 6 -6.273 5.141 -2.601
42 HG12 ILE 6 1HG1 ILE 6 -6.463 3.367 -0.122
43 HG13 ILE 6 2HG1 ILE 6 -5.000 3.582 -1.076
44 HG21 ILE 6 1HG2 ILE 6 -8.771 5.059 -2.550
45 HG22 ILE 6 2HG2 ILE 6 -8.693 4.210 -0.992
46 HG23 ILE 6 3HG2 ILE 6 -8.078 5.869 -1.146
47 HD11 ILE 6 3HD1 ILE 6 -4.891 5.021 0.851
48 HD12 ILE 6 1HD1 ILE 6 -5.056 6.032 -0.597
49 HD13 ILE 6 2HD1 ILE 6 -6.454 5.756 0.475
50 H LEU 7 H LEU 7 -5.838 4.139 -5.034
51 HA LEU 7 HA LEU 7 -3.626 2.192 -5.244
52 HB2 LEU 7 1HB LEU 7 -5.008 2.863 -7.221
53 HB3 LEU 7 2HB LEU 7 -4.428 4.516 -7.040
54 HG LEU 7 HG LEU 7 -2.086 3.696 -7.430
55 HD11 LEU 7 1HD1 LEU 7 -2.314 1.319 -6.756
56 HD12 LEU 7 2HD1 LEU 7 -3.464 1.044 -8.080
57 HD13 LEU 7 3HD1 LEU 7 -1.766 1.436 -8.430
58 HD21 LEU 7 3HD2 LEU 7 -2.364 3.354 -9.849
59 HD22 LEU 7 1HD2 LEU 7 -4.094 3.015 -9.615
60 HD23 LEU 7 2HD2 LEU 7 -3.440 4.629 -9.258
61 H LYS 8 H LYS 8 -2.465 2.664 -3.418
62 HA LYS 8 HA LYS 8 -1.220 5.371 -3.117
63 HB2 LYS 8 1HB LYS 8 -2.767 4.184 -1.353
64 HB3 LYS 8 2HB LYS 8 -1.364 3.201 -0.979
65 HG2 LYS 8 1HG LYS 8 -1.509 6.255 -0.865
66 HG3 LYS 8 2HG LYS 8 -1.757 5.175 0.506
67 HD2 LYS 8 1HD LYS 8 0.582 4.339 0.278
68 HD3 LYS 8 2HD LYS 8 0.842 5.506 -1.044
69 HE2 LYS 8 1HE LYS 8 0.299 7.383 0.447
70 HE3 LYS 8 2HE LYS 8 -0.023 6.262 1.779
71 HZ1 LYS 8 3HZ LYS 8 2.217 7.216 1.884
72 HZ2 LYS 8 1HZ LYS 8 2.280 5.587 1.734
73 HZ3 LYS 8 2HZ LYS 8 2.613 6.551 0.442
74 H LYS 9 H LYS 9 0.924 5.503 -3.726
75 HA LYS 9 HA LYS 9 2.334 3.122 -4.565
76 HB2 LYS 9 1HB LYS 9 2.436 5.602 -5.437
77 HB3 LYS 9 2HB LYS 9 3.669 5.794 -4.174
78 HG2 LYS 9 1HG LYS 9 5.041 4.041 -5.209
79 HG3 LYS 9 2HG LYS 9 3.769 3.725 -6.404
80 HD2 LYS 9 1HD LYS 9 4.019 6.046 -7.265
81 HD3 LYS 9 2HD LYS 9 5.308 6.337 -6.076
82 HE2 LYS 9 1HE LYS 9 6.632 4.473 -7.066
83 HE3 LYS 9 2HE LYS 9 5.349 4.189 -8.251
84 HZ1 LYS 9 3HZ LYS 9 7.119 5.558 -9.177
85 HZ2 LYS 9 1HZ LYS 9 5.743 6.436 -9.112
86 HZ3 LYS 9 2HZ LYS 9 6.932 6.692 -8.017
87 H CYS 10 H CYS 10 4.467 2.516 -3.906
88 HA CYS 10 HA CYS 10 5.447 3.095 -1.199
89 HB2 CYS 10 1HB CYS 10 5.040 0.858 -0.255
90 HB3 CYS 10 2HB CYS 10 3.550 1.691 -0.650
91 H ARG 11 H ARG 11 7.324 2.117 -0.569
92 HA ARG 11 HA ARG 11 8.981 0.668 -2.609
93 HB2 ARG 11 1HB ARG 11 9.830 2.138 -0.064
94 HB3 ARG 11 2HB ARG 11 10.880 1.254 -1.149
95 HG2 ARG 11 1HG ARG 11 11.244 3.485 -1.683
96 HG3 ARG 11 2HG ARG 11 10.277 2.845 -3.006
97 HD2 ARG 11 1HD ARG 11 9.627 5.145 -2.349
98 HD3 ARG 11 2HD ARG 11 8.299 4.021 -2.186
99 HE ARG 11 HE ARG 11 8.398 4.155 0.171
100 HH11 ARG 11 1HH1 ARG 11 11.070 6.087 -1.144
101 HH12 ARG 11 2HH1 ARG 11 11.306 6.919 0.364
102 HH21 ARG 11 1HH2 ARG 11 8.675 5.298 1.998
103 HH22 ARG 11 2HH2 ARG 11 9.981 6.455 2.148
104 H ARG 12 H ARG 12 7.593 0.632 0.634
105 HA ARG 12 HA ARG 12 7.666 -2.248 0.883
106 HB2 ARG 12 1HB ARG 12 9.014 -2.353 2.923
107 HB3 ARG 12 2HB ARG 12 9.973 -1.730 1.591
108 HG2 ARG 12 1HG ARG 12 9.623 0.604 2.439
109 HG3 ARG 12 2HG ARG 12 8.722 -0.043 3.813
110 HD2 ARG 12 1HD ARG 12 11.640 -0.643 3.156
111 HD3 ARG 12 2HD ARG 12 11.075 0.516 4.348
112 HE ARG 12 HE ARG 12 10.273 -1.213 5.753
113 HH11 ARG 12 1HH1 ARG 12 12.094 -2.570 3.026
114 HH12 ARG 12 2HH1 ARG 12 12.303 -4.099 3.823
115 HH21 ARG 12 1HH2 ARG 12 10.582 -3.207 6.705
116 HH22 ARG 12 2HH2 ARG 12 11.467 -4.448 5.874
117 H ASP 13 H ASP 13 6.862 -2.838 3.198
118 HA ASP 13 HA ASP 13 4.182 -2.053 3.191
119 HB2 ASP 13 1HB ASP 13 5.675 -3.279 5.539
120 HB3 ASP 13 2HB ASP 13 3.946 -3.387 5.218
121 H SER 14 H SER 14 6.789 -0.610 5.069
122 HA SER 14 HA SER 14 5.211 0.784 7.010
123 HB2 SER 14 1HB SER 14 7.707 0.352 7.048
124 HB3 SER 14 2HB SER 14 7.889 1.647 5.855
125 HG SER 14 HG SER 14 6.823 3.036 7.428
126 H ASP 15 H ASP 15 5.470 1.400 3.606
127 HA ASP 15 HA ASP 15 4.694 4.261 3.803
128 HB2 ASP 15 1HB ASP 15 4.896 2.374 1.433
129 HB3 ASP 15 2HB ASP 15 4.595 4.102 1.335
130 H CYS 16 H CYS 16 3.097 1.219 3.930
131 HA CYS 16 HA CYS 16 0.729 2.096 2.420
132 HB2 CYS 16 1HB CYS 16 1.574 -0.586 3.540
133 HB3 CYS 16 2HB CYS 16 0.069 -0.288 2.696
134 HA PRO 17 HA PRO 17 -1.566 3.293 5.863
135 HB2 PRO 17 1HB PRO 17 -3.961 3.813 4.755
136 HB3 PRO 17 2HB PRO 17 -2.461 4.620 4.168
137 HG2 PRO 17 1HG PRO 17 -3.787 2.160 2.974
138 HG3 PRO 17 2HG PRO 17 -3.352 3.690 2.143
139 HD2 PRO 17 1HD PRO 17 -1.668 1.549 2.161
140 HD3 PRO 17 2HD PRO 17 -1.064 3.231 2.260
141 H GLY 18 H GLY 18 -2.964 2.616 7.500
142 HA2 GLY 18 1HA GLY 18 -4.259 1.173 8.775
143 HA3 GLY 18 2HA GLY 18 -5.023 0.686 7.254
144 H ALA 19 H ALA 19 -4.970 -1.420 6.969
145 HA ALA 19 HA ALA 19 -2.768 -3.102 8.061
146 HB1 ALA 19 3HB ALA 19 -4.318 -4.945 7.779
147 HB2 ALA 19 1HB ALA 19 -5.153 -3.627 8.613
148 HB3 ALA 19 2HB ALA 19 -5.454 -3.929 6.880
149 H CYS 20 H CYS 20 -3.005 -1.448 5.245
150 HA CYS 20 HA CYS 20 -2.695 -3.470 3.216
151 HB2 CYS 20 1HB CYS 20 -1.836 -0.566 3.325
152 HB3 CYS 20 2HB CYS 20 -1.637 -1.565 1.922
153 H ILE 21 H ILE 21 -0.931 -4.190 2.107
154 HA ILE 21 HA ILE 21 1.829 -3.788 3.223
155 HB ILE 21 HB ILE 21 2.338 -6.074 2.358
156 HG12 ILE 21 1HG1 ILE 21 -0.671 -6.547 2.258
157 HG13 ILE 21 2HG1 ILE 21 0.320 -6.249 0.830
158 HG21 ILE 21 1HG2 ILE 21 1.931 -5.566 4.762
159 HG22 ILE 21 2HG2 ILE 21 0.226 -6.023 4.557
160 HG23 ILE 21 3HG2 ILE 21 1.513 -7.227 4.339
161 HD11 ILE 21 3HD1 ILE 21 -0.003 -8.622 1.064
162 HD12 ILE 21 1HD1 ILE 21 1.704 -8.253 1.384
163 HD13 ILE 21 2HD1 ILE 21 0.593 -8.604 2.732
164 H CYS 22 H CYS 22 3.529 -3.917 1.577
165 HA CYS 22 HA CYS 22 2.664 -2.503 -0.870
166 HB2 CYS 22 1HB CYS 22 4.668 -1.854 0.530
167 HB3 CYS 22 2HB CYS 22 5.465 -3.320 -0.038
168 H ARG 23 H ARG 23 2.462 -3.384 -2.867
169 HA ARG 23 HA ARG 23 3.093 -6.285 -3.225
170 HB2 ARG 23 1HB ARG 23 1.231 -4.591 -4.907
171 HB3 ARG 23 2HB ARG 23 1.391 -6.341 -4.891
172 HG2 ARG 23 1HG ARG 23 0.126 -4.547 -2.806
173 HG3 ARG 23 2HG ARG 23 -0.633 -5.807 -3.765
174 HD2 ARG 23 1HD ARG 23 1.284 -6.167 -1.430
175 HD3 ARG 23 2HD ARG 23 -0.429 -6.523 -1.470
176 HE ARG 23 HE ARG 23 0.020 -8.305 -3.115
177 HH11 ARG 23 1HH1 ARG 23 2.861 -7.326 -1.171
178 HH12 ARG 23 2HH1 ARG 23 3.514 -8.932 -1.227
179 HH21 ARG 23 1HH2 ARG 23 0.999 -10.293 -3.183
180 HH22 ARG 23 2HH2 ARG 23 2.515 -10.561 -2.380
181 H GLY 24 H GLY 24 3.617 -6.936 -5.494
182 HA2 GLY 24 1HA GLY 24 6.193 -5.922 -6.062
183 HA3 GLY 24 2HA GLY 24 5.301 -7.098 -7.050
184 H ASN 25 H ASN 25 3.190 -4.811 -7.406
185 HA ASN 25 HA ASN 25 4.353 -3.555 -9.766
186 HB2 ASN 25 1HB ASN 25 2.176 -2.609 -10.092
187 HB3 ASN 25 2HB ASN 25 1.996 -4.304 -9.671
188 HD21 ASN 25 1HD2 ASN 25 -0.195 -2.621 -9.479
189 HD22 ASN 25 2HD2 ASN 25 -0.576 -2.364 -7.784
190 H GLY 26 H GLY 26 4.591 -2.771 -6.469
191 HA2 GLY 26 1HA GLY 26 5.754 -0.953 -5.554
192 HA3 GLY 26 2HA GLY 26 5.510 -0.008 -7.043
193 H TYR 27 H TYR 27 2.663 -1.536 -5.752
194 HA TYR 27 HA TYR 27 1.863 0.921 -4.267
195 HB2 TYR 27 1HB TYR 27 0.292 -0.480 -6.454
196 HB3 TYR 27 2HB TYR 27 -0.431 0.613 -5.295
197 HD1 TYR 27 HD2 TYR 27 2.157 0.424 -8.006
198 HD2 TYR 27 HD1 TYR 27 -0.383 2.935 -5.611
199 HE1 TYR 27 HE2 TYR 27 2.851 2.390 -9.347
200 HE2 TYR 27 HE1 TYR 27 0.309 4.916 -6.937
201 HH TYR 27 HH TYR 27 2.578 4.645 -9.707
202 H CYS 28 H CYS 28 0.143 0.686 -2.803
203 HA CYS 28 HA CYS 28 0.470 -1.635 -1.130
204 HB2 CYS 28 1HB CYS 28 -1.364 0.778 -0.954
205 HB3 CYS 28 2HB CYS 28 -1.076 -0.349 0.368
206 H GLY 29 H GLY 29 -0.872 -3.272 -0.612
207 HA2 GLY 29 1HA GLY 29 -3.706 -3.385 -1.448
208 HA3 GLY 29 2HA GLY 29 -2.643 -4.553 -2.215
209 HN1 NH2 30 2HN NH2 30 -3.850 -6.517 0.556
210 HN2 NH2 30 1HN NH2 30 -4.254 -6.034 -1.080
Start of MODEL 11
1 H1 GLY 1 1H GLY 1 -9.114 -3.408 12.223
2 H2 GLY 1 2H GLY 1 -7.797 -4.379 12.161
3 H3 GLY 1 3H GLY 1 -7.759 -3.002 13.047
4 HA2 GLY 1 1HA GLY 1 -7.950 -1.637 11.084
5 HA3 GLY 1 2HA GLY 1 -6.519 -2.684 11.020
6 H VAL 2 H VAL 2 -7.300 -1.714 8.659
7 HA VAL 2 HA VAL 2 -7.991 -4.024 7.086
8 HB VAL 2 HB VAL 2 -10.274 -3.330 7.780
9 HG11 VAL 2 1HG1 VAL 2 -9.922 -0.881 8.008
10 HG12 VAL 2 2HG1 VAL 2 -9.781 -0.746 6.241
11 HG13 VAL 2 3HG1 VAL 2 -11.304 -1.274 6.977
12 HG21 VAL 2 3HG2 VAL 2 -11.326 -3.422 5.634
13 HG22 VAL 2 1HG2 VAL 2 -9.868 -2.846 4.813
14 HG23 VAL 2 2HG2 VAL 2 -9.882 -4.446 5.592
15 H CYS 3 H CYS 3 -7.553 -3.655 4.834
16 HA CYS 3 HA CYS 3 -5.779 -1.337 4.352
17 HB2 CYS 3 1HB CYS 3 -4.947 -3.500 3.692
18 HB3 CYS 3 2HB CYS 3 -6.394 -3.861 2.782
19 HA PRO 4 HA PRO 4 -9.466 0.598 2.480
20 HB2 PRO 4 1HB PRO 4 -8.385 3.034 1.791
21 HB3 PRO 4 2HB PRO 4 -8.886 2.596 3.454
22 HG2 PRO 4 1HG PRO 4 -6.106 2.438 2.246
23 HG3 PRO 4 2HG PRO 4 -6.592 3.175 3.808
24 HD2 PRO 4 1HD PRO 4 -5.582 0.687 3.722
25 HD3 PRO 4 2HD PRO 4 -6.959 1.047 4.797
26 H LYS 5 H LYS 5 -10.191 1.060 0.390
27 HA LYS 5 HA LYS 5 -8.853 -0.500 -1.606
28 HB2 LYS 5 1HB LYS 5 -10.915 -0.237 -2.858
29 HB3 LYS 5 2HB LYS 5 -11.269 -0.570 -1.166
30 HG2 LYS 5 1HG LYS 5 -11.739 1.856 -0.786
31 HG3 LYS 5 2HG LYS 5 -11.380 2.183 -2.492
32 HD2 LYS 5 1HD LYS 5 -13.251 0.681 -3.169
33 HD3 LYS 5 2HD LYS 5 -13.566 0.318 -1.469
34 HE2 LYS 5 1HE LYS 5 -15.184 1.935 -2.131
35 HE3 LYS 5 2HE LYS 5 -14.042 2.746 -1.055
36 HZ1 LYS 5 3HZ LYS 5 -14.568 4.080 -3.017
37 HZ2 LYS 5 1HZ LYS 5 -12.980 3.706 -3.030
38 HZ3 LYS 5 2HZ LYS 5 -14.018 2.919 -4.023
39 H ILE 6 H ILE 6 -7.696 2.229 -0.948
40 HA ILE 6 HA ILE 6 -7.748 3.684 -3.531
41 HB ILE 6 HB ILE 6 -6.260 5.297 -2.450
42 HG12 ILE 6 1HG1 ILE 6 -6.440 3.561 0.057
43 HG13 ILE 6 2HG1 ILE 6 -5.001 3.777 -0.942
44 HG21 ILE 6 1HG2 ILE 6 -8.761 5.412 -2.287
45 HG22 ILE 6 2HG2 ILE 6 -8.662 4.652 -0.685
46 HG23 ILE 6 3HG2 ILE 6 -7.929 6.243 -0.976
47 HD11 ILE 6 3HD1 ILE 6 -4.803 5.188 0.991
48 HD12 ILE 6 1HD1 ILE 6 -5.033 6.224 -0.429
49 HD13 ILE 6 2HD1 ILE 6 -6.380 5.930 0.702
50 H LEU 7 H LEU 7 -6.002 4.026 -4.900
51 HA LEU 7 HA LEU 7 -3.929 1.896 -4.886
52 HB2 LEU 7 1HB LEU 7 -5.404 2.188 -6.868
53 HB3 LEU 7 2HB LEU 7 -4.816 3.837 -7.057
54 HG LEU 7 HG LEU 7 -2.527 2.967 -7.477
55 HD11 LEU 7 1HD1 LEU 7 -2.610 0.807 -6.254
56 HD12 LEU 7 2HD1 LEU 7 -3.849 0.211 -7.377
57 HD13 LEU 7 3HD1 LEU 7 -2.200 0.541 -7.950
58 HD21 LEU 7 3HD2 LEU 7 -2.984 2.067 -9.718
59 HD22 LEU 7 1HD2 LEU 7 -4.674 1.758 -9.263
60 HD23 LEU 7 2HD2 LEU 7 -4.058 3.424 -9.343
61 H LYS 8 H LYS 8 -2.476 2.575 -3.403
62 HA LYS 8 HA LYS 8 -1.204 5.276 -3.689
63 HB2 LYS 8 1HB LYS 8 -2.356 4.680 -1.487
64 HB3 LYS 8 2HB LYS 8 -1.161 3.388 -1.281
65 HG2 LYS 8 1HG LYS 8 0.628 5.245 -1.603
66 HG3 LYS 8 2HG LYS 8 -0.689 6.404 -1.453
67 HD2 LYS 8 1HD LYS 8 -1.164 5.581 0.815
68 HD3 LYS 8 2HD LYS 8 0.091 4.332 0.647
69 HE2 LYS 8 1HE LYS 8 0.664 7.315 0.363
70 HE3 LYS 8 2HE LYS 8 0.750 6.474 1.915
71 HZ1 LYS 8 3HZ LYS 8 2.918 6.610 0.774
72 HZ2 LYS 8 1HZ LYS 8 2.476 5.075 1.084
73 HZ3 LYS 8 2HZ LYS 8 2.374 5.658 -0.445
74 H LYS 9 H LYS 9 0.924 5.334 -4.378
75 HA LYS 9 HA LYS 9 2.427 2.892 -4.870
76 HB2 LYS 9 1HB LYS 9 4.255 4.396 -5.536
77 HB3 LYS 9 2HB LYS 9 2.731 4.729 -6.351
78 HG2 LYS 9 1HG LYS 9 2.278 6.596 -4.819
79 HG3 LYS 9 2HG LYS 9 3.816 6.289 -3.987
80 HD2 LYS 9 1HD LYS 9 5.080 6.849 -5.992
81 HD3 LYS 9 2HD LYS 9 3.599 6.900 -6.976
82 HE2 LYS 9 1HE LYS 9 2.746 8.793 -5.665
83 HE3 LYS 9 2HE LYS 9 4.188 8.763 -4.634
84 HZ1 LYS 9 3HZ LYS 9 4.380 10.438 -6.375
85 HZ2 LYS 9 1HZ LYS 9 5.521 9.293 -6.602
86 HZ3 LYS 9 2HZ LYS 9 4.188 9.323 -7.551
87 H CYS 10 H CYS 10 4.497 2.363 -4.014
88 HA CYS 10 HA CYS 10 5.286 3.314 -1.335
89 HB2 CYS 10 1HB CYS 10 4.866 1.135 -0.222
90 HB3 CYS 10 2HB CYS 10 3.398 1.891 -0.805
91 H ARG 11 H ARG 11 7.162 2.308 -0.465
92 HA ARG 11 HA ARG 11 8.856 0.704 -2.367
93 HB2 ARG 11 1HB ARG 11 9.686 2.534 -0.077
94 HB3 ARG 11 2HB ARG 11 10.788 1.578 -1.058
95 HG2 ARG 11 1HG ARG 11 9.055 3.858 -2.120
96 HG3 ARG 11 2HG ARG 11 10.740 3.974 -1.643
97 HD2 ARG 11 1HD ARG 11 10.794 3.829 -3.977
98 HD3 ARG 11 2HD ARG 11 11.302 2.233 -3.403
99 HE ARG 11 HE ARG 11 8.475 2.223 -3.825
100 HH11 ARG 11 1HH1 ARG 11 11.384 2.333 -5.834
101 HH12 ARG 11 2HH1 ARG 11 10.588 1.541 -7.163
102 HH21 ARG 11 1HH2 ARG 11 7.536 1.221 -5.479
103 HH22 ARG 11 2HH2 ARG 11 8.396 0.924 -6.974
104 H ARG 12 H ARG 12 7.238 0.677 0.689
105 HA ARG 12 HA ARG 12 7.658 -2.101 1.133
106 HB2 ARG 12 1HB ARG 12 8.849 -1.982 3.300
107 HB3 ARG 12 2HB ARG 12 9.872 -1.408 1.997
108 HG2 ARG 12 1HG ARG 12 9.477 0.926 2.614
109 HG3 ARG 12 2HG ARG 12 8.295 0.458 3.841
110 HD2 ARG 12 1HD ARG 12 11.241 -0.323 3.901
111 HD3 ARG 12 2HD ARG 12 10.549 1.060 4.739
112 HE ARG 12 HE ARG 12 9.271 -0.366 6.172
113 HH11 ARG 12 1HH1 ARG 12 11.662 -2.219 4.305
114 HH12 ARG 12 2HH1 ARG 12 11.556 -3.575 5.386
115 HH21 ARG 12 1HH2 ARG 12 9.184 -2.111 7.472
116 HH22 ARG 12 2HH2 ARG 12 10.176 -3.513 7.174
117 H ASP 13 H ASP 13 6.737 -2.795 3.273
118 HA ASP 13 HA ASP 13 4.026 -2.099 3.235
119 HB2 ASP 13 1HB ASP 13 5.528 -3.391 5.553
120 HB3 ASP 13 2HB ASP 13 3.809 -3.546 5.199
121 H SER 14 H SER 14 6.575 -0.853 5.362
122 HA SER 14 HA SER 14 5.025 0.507 7.300
123 HB2 SER 14 1HB SER 14 7.691 1.404 6.147
124 HB3 SER 14 2HB SER 14 7.064 1.731 7.767
125 HG SER 14 HG SER 14 7.299 -0.446 8.273
126 H ASP 15 H ASP 15 5.418 1.323 3.945
127 HA ASP 15 HA ASP 15 4.565 4.148 4.348
128 HB2 ASP 15 1HB ASP 15 6.565 3.550 2.923
129 HB3 ASP 15 2HB ASP 15 5.465 2.721 1.819
130 H CYS 16 H CYS 16 3.050 1.219 4.087
131 HA CYS 16 HA CYS 16 0.809 2.166 2.366
132 HB2 CYS 16 1HB CYS 16 1.605 -0.580 3.351
133 HB3 CYS 16 2HB CYS 16 0.087 -0.225 2.553
134 HA PRO 17 HA PRO 17 -1.517 3.278 5.804
135 HB2 PRO 17 1HB PRO 17 -3.915 3.813 4.705
136 HB3 PRO 17 2HB PRO 17 -2.414 4.633 4.137
137 HG2 PRO 17 1HG PRO 17 -3.733 2.191 2.894
138 HG3 PRO 17 2HG PRO 17 -3.300 3.737 2.093
139 HD2 PRO 17 1HD PRO 17 -1.607 1.611 2.064
140 HD3 PRO 17 2HD PRO 17 -1.013 3.290 2.221
141 H GLY 18 H GLY 18 -2.889 2.578 7.442
142 HA2 GLY 18 1HA GLY 18 -4.167 1.115 8.714
143 HA3 GLY 18 2HA GLY 18 -4.953 0.649 7.198
144 H ALA 19 H ALA 19 -4.887 -1.449 6.863
145 HA ALA 19 HA ALA 19 -2.617 -3.123 7.835
146 HB1 ALA 19 3HB ALA 19 -4.145 -4.987 7.621
147 HB2 ALA 19 1HB ALA 19 -4.962 -3.695 8.511
148 HB3 ALA 19 2HB ALA 19 -5.346 -3.988 6.794
149 H CYS 20 H CYS 20 -2.975 -1.409 5.090
150 HA CYS 20 HA CYS 20 -2.707 -3.366 2.986
151 HB2 CYS 20 1HB CYS 20 -1.827 -0.473 3.168
152 HB3 CYS 20 2HB CYS 20 -1.647 -1.429 1.740
153 H ILE 21 H ILE 21 -0.963 -4.162 1.925
154 HA ILE 21 HA ILE 21 1.790 -3.817 3.079
155 HB ILE 21 HB ILE 21 2.255 -6.101 2.176
156 HG12 ILE 21 1HG1 ILE 21 -0.763 -6.492 2.041
157 HG13 ILE 21 2HG1 ILE 21 0.244 -6.191 0.625
158 HG21 ILE 21 1HG2 ILE 21 1.834 -5.615 4.582
159 HG22 ILE 21 2HG2 ILE 21 0.119 -6.012 4.349
160 HG23 ILE 21 3HG2 ILE 21 1.367 -7.256 4.130
161 HD11 ILE 21 3HD1 ILE 21 -0.136 -8.560 0.813
162 HD12 ILE 21 1HD1 ILE 21 1.576 -8.240 1.156
163 HD13 ILE 21 2HD1 ILE 21 0.443 -8.588 2.485
164 H CYS 22 H CYS 22 3.528 -3.902 1.514
165 HA CYS 22 HA CYS 22 2.754 -2.467 -0.959
166 HB2 CYS 22 1HB CYS 22 4.647 -1.750 0.595
167 HB3 CYS 22 2HB CYS 22 5.540 -3.154 0.025
168 H ARG 23 H ARG 23 2.468 -3.458 -2.854
169 HA ARG 23 HA ARG 23 3.171 -6.324 -3.150
170 HB2 ARG 23 1HB ARG 23 1.430 -4.578 -4.923
171 HB3 ARG 23 2HB ARG 23 1.560 -6.331 -4.954
172 HG2 ARG 23 1HG ARG 23 0.276 -4.592 -2.819
173 HG3 ARG 23 2HG ARG 23 -0.508 -5.742 -3.891
174 HD2 ARG 23 1HD ARG 23 1.364 -6.381 -1.577
175 HD3 ARG 23 2HD ARG 23 -0.378 -6.621 -1.630
176 HE ARG 23 HE ARG 23 -0.022 -8.262 -3.470
177 HH11 ARG 23 1HH1 ARG 23 2.688 -7.763 -1.215
178 HH12 ARG 23 2HH1 ARG 23 3.313 -9.356 -1.509
179 HH21 ARG 23 1HH2 ARG 23 0.866 -10.272 -3.791
180 HH22 ARG 23 2HH2 ARG 23 2.307 -10.746 -2.944
181 H GLY 24 H GLY 24 3.778 -7.051 -5.393
182 HA2 GLY 24 1HA GLY 24 6.386 -6.088 -5.942
183 HA3 GLY 24 2HA GLY 24 5.492 -7.274 -6.914
184 H ASN 25 H ASN 25 3.397 -5.010 -7.361
185 HA ASN 25 HA ASN 25 4.613 -3.772 -9.708
186 HB2 ASN 25 1HB ASN 25 2.431 -2.872 -10.120
187 HB3 ASN 25 2HB ASN 25 2.268 -4.564 -9.676
188 HD21 ASN 25 1HD2 ASN 25 0.013 -3.031 -9.569
189 HD22 ASN 25 2HD2 ASN 25 -0.414 -2.706 -7.897
190 H GLY 26 H GLY 26 4.773 -2.949 -6.427
191 HA2 GLY 26 1HA GLY 26 5.877 -1.117 -5.497
192 HA3 GLY 26 2HA GLY 26 5.701 -0.205 -7.019
193 H TYR 27 H TYR 27 2.785 -1.651 -5.807
194 HA TYR 27 HA TYR 27 1.938 0.894 -4.474
195 HB2 TYR 27 1HB TYR 27 0.493 -0.723 -6.609
196 HB3 TYR 27 2HB TYR 27 -0.370 0.274 -5.465
197 HD1 TYR 27 HD2 TYR 27 2.489 0.534 -7.923
198 HD2 TYR 27 HD1 TYR 27 -0.781 2.498 -5.925
199 HE1 TYR 27 HE2 TYR 27 2.987 2.612 -9.167
200 HE2 TYR 27 HE1 TYR 27 -0.329 4.576 -7.218
201 HH TYR 27 HH TYR 27 2.330 4.770 -9.621
202 H CYS 28 H CYS 28 0.221 0.692 -2.978
203 HA CYS 28 HA CYS 28 0.480 -1.537 -1.158
204 HB2 CYS 28 1HB CYS 28 -1.336 0.903 -1.207
205 HB3 CYS 28 2HB CYS 28 -1.156 -0.154 0.187
206 H GLY 29 H GLY 29 -0.890 -3.181 -0.693
207 HA2 GLY 29 1HA GLY 29 -3.679 -3.298 -1.666
208 HA3 GLY 29 2HA GLY 29 -2.580 -4.468 -2.376
209 HN1 NH2 30 2HN NH2 30 -3.958 -6.394 0.354
210 HN2 NH2 30 1HN NH2 30 -4.308 -5.895 -1.290
Start of MODEL 12
1 H1 GLY 1 1H GLY 1 -9.581 -4.112 11.669
2 H2 GLY 1 2H GLY 1 -7.988 -4.472 11.804
3 H3 GLY 1 3H GLY 1 -8.600 -3.160 12.571
4 HA2 GLY 1 1HA GLY 1 -9.092 -2.074 10.490
5 HA3 GLY 1 2HA GLY 1 -7.365 -2.452 10.642
6 H VAL 2 H VAL 2 -8.407 -1.973 8.149
7 HA VAL 2 HA VAL 2 -7.954 -4.485 6.721
8 HB VAL 2 HB VAL 2 -9.871 -4.136 5.174
9 HG11 VAL 2 1HG1 VAL 2 -9.970 -5.872 6.942
10 HG12 VAL 2 2HG1 VAL 2 -10.838 -4.725 7.993
11 HG13 VAL 2 3HG1 VAL 2 -11.562 -5.259 6.467
12 HG21 VAL 2 3HG2 VAL 2 -11.861 -2.866 5.860
13 HG22 VAL 2 1HG2 VAL 2 -11.010 -2.256 7.291
14 HG23 VAL 2 2HG2 VAL 2 -10.475 -1.794 5.658
15 H CYS 3 H CYS 3 -7.329 -4.072 4.503
16 HA CYS 3 HA CYS 3 -6.298 -1.342 4.125
17 HB2 CYS 3 1HB CYS 3 -4.862 -3.269 3.623
18 HB3 CYS 3 2HB CYS 3 -6.011 -3.835 2.415
19 HA PRO 4 HA PRO 4 -10.058 -0.504 1.681
20 HB2 PRO 4 1HB PRO 4 -9.661 2.149 1.143
21 HB3 PRO 4 2HB PRO 4 -10.138 1.538 2.754
22 HG2 PRO 4 1HG PRO 4 -7.341 2.202 1.780
23 HG3 PRO 4 2HG PRO 4 -8.142 2.746 3.289
24 HD2 PRO 4 1HD PRO 4 -6.457 0.627 3.246
25 HD3 PRO 4 2HD PRO 4 -7.924 0.601 4.270
26 H LYS 5 H LYS 5 -10.542 0.453 -0.514
27 HA LYS 5 HA LYS 5 -8.849 -0.841 -2.485
28 HB2 LYS 5 1HB LYS 5 -11.465 0.703 -2.733
29 HB3 LYS 5 2HB LYS 5 -10.706 -0.238 -4.024
30 HG2 LYS 5 1HG LYS 5 -10.875 -2.296 -2.639
31 HG3 LYS 5 2HG LYS 5 -11.718 -1.371 -1.381
32 HD2 LYS 5 1HD LYS 5 -13.511 -0.799 -2.996
33 HD3 LYS 5 2HD LYS 5 -12.674 -1.735 -4.255
34 HE2 LYS 5 1HE LYS 5 -12.860 -3.781 -2.850
35 HE3 LYS 5 2HE LYS 5 -13.698 -2.851 -1.600
36 HZ1 LYS 5 3HZ LYS 5 -15.262 -4.029 -3.022
37 HZ2 LYS 5 1HZ LYS 5 -15.475 -2.420 -3.205
38 HZ3 LYS 5 2HZ LYS 5 -14.701 -3.281 -4.361
39 H ILE 6 H ILE 6 -7.429 1.252 -1.367
40 HA ILE 6 HA ILE 6 -7.356 3.583 -3.186
41 HB ILE 6 HB ILE 6 -5.475 4.338 -1.784
42 HG12 ILE 6 1HG1 ILE 6 -5.838 1.745 -0.214
43 HG13 ILE 6 2HG1 ILE 6 -4.460 2.159 -1.231
44 HG21 ILE 6 1HG2 ILE 6 -7.829 4.853 -1.220
45 HG22 ILE 6 2HG2 ILE 6 -7.882 3.445 -0.144
46 HG23 ILE 6 3HG2 ILE 6 -6.797 4.806 0.209
47 HD11 ILE 6 3HD1 ILE 6 -3.830 2.515 1.041
48 HD12 ILE 6 1HD1 ILE 6 -3.995 4.115 0.292
49 HD13 ILE 6 2HD1 ILE 6 -5.263 3.499 1.375
50 H LEU 7 H LEU 7 -5.420 4.274 -4.286
51 HA LEU 7 HA LEU 7 -3.509 2.120 -5.062
52 HB2 LEU 7 1HB LEU 7 -5.140 2.602 -6.900
53 HB3 LEU 7 2HB LEU 7 -4.636 4.289 -6.880
54 HG LEU 7 HG LEU 7 -2.311 3.565 -7.503
55 HD11 LEU 7 1HD1 LEU 7 -2.316 1.232 -6.663
56 HD12 LEU 7 2HD1 LEU 7 -3.590 0.806 -7.824
57 HD13 LEU 7 3HD1 LEU 7 -1.970 1.267 -8.393
58 HD21 LEU 7 3HD2 LEU 7 -2.849 3.046 -9.846
59 HD22 LEU 7 1HD2 LEU 7 -4.516 2.634 -9.386
60 HD23 LEU 7 2HD2 LEU 7 -3.924 4.300 -9.208
61 H LYS 8 H LYS 8 -2.242 2.777 -3.366
62 HA LYS 8 HA LYS 8 -1.067 5.532 -3.393
63 HB2 LYS 8 1HB LYS 8 -2.538 4.620 -1.482
64 HB3 LYS 8 2HB LYS 8 -1.208 3.554 -1.064
65 HG2 LYS 8 1HG LYS 8 -1.071 6.608 -1.173
66 HG3 LYS 8 2HG LYS 8 -1.436 5.666 0.272
67 HD2 LYS 8 1HD LYS 8 0.807 4.559 0.099
68 HD3 LYS 8 2HD LYS 8 1.189 5.650 -1.257
69 HE2 LYS 8 1HE LYS 8 0.842 7.615 0.169
70 HE3 LYS 8 2HE LYS 8 0.389 6.579 1.531
71 HZ1 LYS 8 3HZ LYS 8 2.721 7.291 1.627
72 HZ2 LYS 8 1HZ LYS 8 2.608 5.661 1.540
73 HZ3 LYS 8 2HZ LYS 8 3.052 6.532 0.215
74 H LYS 9 H LYS 9 1.077 5.659 -3.984
75 HA LYS 9 HA LYS 9 2.544 3.368 -4.860
76 HB2 LYS 9 1HB LYS 9 3.433 6.219 -4.128
77 HB3 LYS 9 2HB LYS 9 4.482 5.049 -4.930
78 HG2 LYS 9 1HG LYS 9 3.053 4.970 -6.870
79 HG3 LYS 9 2HG LYS 9 1.862 6.053 -6.106
80 HD2 LYS 9 1HD LYS 9 3.574 7.846 -6.004
81 HD3 LYS 9 2HD LYS 9 4.752 6.762 -6.780
82 HE2 LYS 9 1HE LYS 9 3.268 6.574 -8.765
83 HE3 LYS 9 2HE LYS 9 2.088 7.642 -7.994
84 HZ1 LYS 9 3HZ LYS 9 3.506 8.857 -9.533
85 HZ2 LYS 9 1HZ LYS 9 3.766 9.403 -8.017
86 HZ3 LYS 9 2HZ LYS 9 4.858 8.416 -8.730
87 H CYS 10 H CYS 10 4.462 2.405 -4.099
88 HA CYS 10 HA CYS 10 5.591 3.089 -1.467
89 HB2 CYS 10 1HB CYS 10 5.106 0.954 -0.377
90 HB3 CYS 10 2HB CYS 10 3.622 1.787 -0.811
91 H ARG 11 H ARG 11 7.387 1.904 -0.797
92 HA ARG 11 HA ARG 11 8.827 0.243 -2.834
93 HB2 ARG 11 1HB ARG 11 9.876 2.442 -2.253
94 HB3 ARG 11 2HB ARG 11 9.966 1.934 -0.561
95 HG2 ARG 11 1HG ARG 11 11.463 0.064 -1.188
96 HG3 ARG 11 2HG ARG 11 11.301 0.497 -2.904
97 HD2 ARG 11 1HD ARG 11 12.330 2.703 -2.439
98 HD3 ARG 11 2HD ARG 11 12.487 2.267 -0.722
99 HE ARG 11 HE ARG 11 13.731 0.239 -2.269
100 HH11 ARG 11 1HH1 ARG 11 14.318 3.638 -1.476
101 HH12 ARG 11 2HH1 ARG 11 16.039 3.486 -1.680
102 HH21 ARG 11 1HH2 ARG 11 15.959 0.109 -2.516
103 HH22 ARG 11 2HH2 ARG 11 16.953 1.512 -2.261
104 H ARG 12 H ARG 12 7.763 0.587 0.548
105 HA ARG 12 HA ARG 12 7.665 -2.300 0.861
106 HB2 ARG 12 1HB ARG 12 10.062 -1.472 1.506
107 HB3 ARG 12 2HB ARG 12 9.299 -0.724 2.894
108 HG2 ARG 12 1HG ARG 12 10.376 -2.818 3.443
109 HG3 ARG 12 2HG ARG 12 8.663 -2.953 3.763
110 HD2 ARG 12 1HD ARG 12 9.845 -3.931 1.133
111 HD3 ARG 12 2HD ARG 12 9.998 -4.897 2.595
112 HE ARG 12 HE ARG 12 7.546 -4.964 2.808
113 HH11 ARG 12 1HH1 ARG 12 8.876 -4.537 -0.463
114 HH12 ARG 12 2HH1 ARG 12 7.465 -5.243 -1.194
115 HH21 ARG 12 1HH2 ARG 12 5.713 -5.588 1.797
116 HH22 ARG 12 2HH2 ARG 12 5.670 -5.802 0.069
117 H ASP 13 H ASP 13 6.921 -2.761 3.253
118 HA ASP 13 HA ASP 13 4.231 -1.920 3.231
119 HB2 ASP 13 1HB ASP 13 5.723 -3.175 5.568
120 HB3 ASP 13 2HB ASP 13 3.996 -3.278 5.225
121 H SER 14 H SER 14 6.939 -0.547 4.993
122 HA SER 14 HA SER 14 5.510 0.993 6.954
123 HB2 SER 14 1HB SER 14 7.673 2.285 7.015
124 HB3 SER 14 2HB SER 14 7.822 0.543 7.278
125 HG SER 14 HG SER 14 9.405 1.399 5.813
126 H ASP 15 H ASP 15 5.766 1.444 3.514
127 HA ASP 15 HA ASP 15 5.113 4.332 3.589
128 HB2 ASP 15 1HB ASP 15 5.055 2.345 1.301
129 HB3 ASP 15 2HB ASP 15 4.917 4.089 1.153
130 H CYS 16 H CYS 16 3.366 1.400 3.958
131 HA CYS 16 HA CYS 16 0.909 2.400 2.630
132 HB2 CYS 16 1HB CYS 16 1.712 -0.372 3.562
133 HB3 CYS 16 2HB CYS 16 0.202 0.047 2.782
134 HA PRO 17 HA PRO 17 -0.889 3.379 6.449
135 HB2 PRO 17 1HB PRO 17 -3.320 4.213 5.685
136 HB3 PRO 17 2HB PRO 17 -1.823 4.956 5.009
137 HG2 PRO 17 1HG PRO 17 -3.503 2.770 3.730
138 HG3 PRO 17 2HG PRO 17 -3.009 4.344 3.022
139 HD2 PRO 17 1HD PRO 17 -1.549 2.061 2.633
140 HD3 PRO 17 2HD PRO 17 -0.787 3.673 2.797
141 H GLY 18 H GLY 18 -2.171 2.611 8.138
142 HA2 GLY 18 1HA GLY 18 -3.460 1.136 9.379
143 HA3 GLY 18 2HA GLY 18 -4.423 0.927 7.912
144 H ALA 19 H ALA 19 -4.668 -1.125 7.421
145 HA ALA 19 HA ALA 19 -2.679 -3.185 8.155
146 HB1 ALA 19 3HB ALA 19 -4.487 -4.737 7.601
147 HB2 ALA 19 1HB ALA 19 -5.101 -3.460 8.665
148 HB3 ALA 19 2HB ALA 19 -5.454 -3.418 6.919
149 H CYS 20 H CYS 20 -2.877 -1.185 5.478
150 HA CYS 20 HA CYS 20 -2.635 -3.072 3.310
151 HB2 CYS 20 1HB CYS 20 -1.703 -0.192 3.545
152 HB3 CYS 20 2HB CYS 20 -1.642 -1.117 2.087
153 H ILE 21 H ILE 21 -0.942 -3.885 2.231
154 HA ILE 21 HA ILE 21 1.848 -3.578 3.302
155 HB ILE 21 HB ILE 21 2.246 -5.893 2.457
156 HG12 ILE 21 1HG1 ILE 21 -0.780 -6.230 2.381
157 HG13 ILE 21 2HG1 ILE 21 0.212 -5.989 0.943
158 HG21 ILE 21 1HG2 ILE 21 1.882 -5.341 4.857
159 HG22 ILE 21 2HG2 ILE 21 0.156 -5.721 4.669
160 HG23 ILE 21 3HG2 ILE 21 1.384 -6.986 4.455
161 HD11 ILE 21 3HD1 ILE 21 -0.216 -8.344 1.204
162 HD12 ILE 21 1HD1 ILE 21 1.508 -8.050 1.511
163 HD13 ILE 21 2HD1 ILE 21 0.392 -8.336 2.868
164 H CYS 22 H CYS 22 3.532 -3.826 1.649
165 HA CYS 22 HA CYS 22 2.694 -2.383 -0.801
166 HB2 CYS 22 1HB CYS 22 4.687 -1.694 0.566
167 HB3 CYS 22 2HB CYS 22 5.484 -3.183 0.081
168 H ARG 23 H ARG 23 2.172 -3.388 -2.628
169 HA ARG 23 HA ARG 23 2.757 -6.264 -2.990
170 HB2 ARG 23 1HB ARG 23 1.028 -4.416 -4.672
171 HB3 ARG 23 2HB ARG 23 1.071 -6.173 -4.731
172 HG2 ARG 23 1HG ARG 23 -0.018 -4.412 -2.505
173 HG3 ARG 23 2HG ARG 23 -0.918 -5.486 -3.564
174 HD2 ARG 23 1HD ARG 23 1.033 -6.305 -1.377
175 HD3 ARG 23 2HD ARG 23 -0.720 -6.429 -1.323
176 HE ARG 23 HE ARG 23 -0.569 -8.018 -3.258
177 HH11 ARG 23 1HH1 ARG 23 2.212 -7.824 -1.047
178 HH12 ARG 23 2HH1 ARG 23 2.714 -9.442 -1.425
179 HH21 ARG 23 1HH2 ARG 23 0.158 -10.073 -3.686
180 HH22 ARG 23 2HH2 ARG 23 1.573 -10.691 -2.892
181 H GLY 24 H GLY 24 3.259 -7.008 -5.246
182 HA2 GLY 24 1HA GLY 24 5.884 -6.157 -5.874
183 HA3 GLY 24 2HA GLY 24 4.911 -7.301 -6.820
184 H ASN 25 H ASN 25 2.918 -4.912 -7.192
185 HA ASN 25 HA ASN 25 4.104 -3.779 -9.601
186 HB2 ASN 25 1HB ASN 25 1.978 -2.736 -9.926
187 HB3 ASN 25 2HB ASN 25 1.707 -4.399 -9.433
188 HD21 ASN 25 1HD2 ASN 25 -0.357 -2.525 -9.283
189 HD22 ASN 25 2HD2 ASN 25 -0.698 -2.198 -7.592
190 H GLY 26 H GLY 26 4.419 -2.911 -6.321
191 HA2 GLY 26 1HA GLY 26 5.659 -1.127 -5.455
192 HA3 GLY 26 2HA GLY 26 5.515 -0.242 -6.993
193 H TYR 27 H TYR 27 2.621 -1.562 -5.484
194 HA TYR 27 HA TYR 27 1.962 1.031 -4.188
195 HB2 TYR 27 1HB TYR 27 0.259 -0.418 -6.224
196 HB3 TYR 27 2HB TYR 27 -0.382 0.777 -5.126
197 HD1 TYR 27 HD1 TYR 27 2.197 0.310 -7.829
198 HD2 TYR 27 HD2 TYR 27 -0.428 3.014 -5.760
199 HE1 TYR 27 HE1 TYR 27 2.832 2.112 -9.394
200 HE2 TYR 27 HE2 TYR 27 0.116 4.800 -7.375
201 HH TYR 27 HH TYR 27 2.407 4.261 -10.098
202 H CYS 28 H CYS 28 0.259 0.948 -2.668
203 HA CYS 28 HA CYS 28 0.444 -1.311 -0.898
204 HB2 CYS 28 1HB CYS 28 -1.286 1.186 -0.828
205 HB3 CYS 28 2HB CYS 28 -1.035 0.109 0.544
206 H GLY 29 H GLY 29 -0.949 -2.899 -0.376
207 HA2 GLY 29 1HA GLY 29 -3.773 -2.951 -1.211
208 HA3 GLY 29 2HA GLY 29 -2.740 -4.100 -2.041
209 HN1 NH2 30 2HN NH2 30 -3.931 -6.165 0.665
210 HN2 NH2 30 1HN NH2 30 -4.350 -5.612 -0.946
Start of MODEL 13
1 H1 GLY 1 1H GLY 1 -9.335 -3.721 12.056
2 H2 GLY 1 2H GLY 1 -7.905 -4.519 12.048
3 H3 GLY 1 3H GLY 1 -8.065 -3.132 12.904
4 HA2 GLY 1 1HA GLY 1 -8.373 -1.838 10.909
5 HA3 GLY 1 2HA GLY 1 -6.820 -2.696 10.902
6 H VAL 2 H VAL 2 -7.675 -1.867 8.507
7 HA VAL 2 HA VAL 2 -8.004 -4.270 6.957
8 HB VAL 2 HB VAL 2 -10.374 -3.904 7.590
9 HG11 VAL 2 1HG1 VAL 2 -10.383 -1.429 7.805
10 HG12 VAL 2 2HG1 VAL 2 -10.226 -1.285 6.040
11 HG13 VAL 2 3HG1 VAL 2 -11.673 -2.023 6.749
12 HG21 VAL 2 3HG2 VAL 2 -11.357 -4.157 5.425
13 HG22 VAL 2 1HG2 VAL 2 -9.980 -3.383 4.629
14 HG23 VAL 2 2HG2 VAL 2 -9.779 -4.964 5.420
15 H CYS 3 H CYS 3 -7.560 -3.879 4.714
16 HA CYS 3 HA CYS 3 -6.168 -1.311 4.223
17 HB2 CYS 3 1HB CYS 3 -4.990 -3.382 3.684
18 HB3 CYS 3 2HB CYS 3 -6.292 -3.887 2.617
19 HA PRO 4 HA PRO 4 -10.020 -0.138 2.079
20 HB2 PRO 4 1HB PRO 4 -9.459 2.481 1.527
21 HB3 PRO 4 2HB PRO 4 -9.864 1.890 3.166
22 HG2 PRO 4 1HG PRO 4 -7.102 2.354 1.994
23 HG3 PRO 4 2HG PRO 4 -7.748 2.937 3.562
24 HD2 PRO 4 1HD PRO 4 -6.238 0.698 3.383
25 HD3 PRO 4 2HD PRO 4 -7.622 0.778 4.512
26 H LYS 5 H LYS 5 -10.601 0.831 -0.059
27 HA LYS 5 HA LYS 5 -9.230 -0.573 -2.155
28 HB2 LYS 5 1HB LYS 5 -11.120 0.127 -3.519
29 HB3 LYS 5 2HB LYS 5 -11.652 -0.480 -1.956
30 HG2 LYS 5 1HG LYS 5 -12.003 1.845 -1.146
31 HG3 LYS 5 2HG LYS 5 -11.436 2.477 -2.702
32 HD2 LYS 5 1HD LYS 5 -13.299 1.314 -3.856
33 HD3 LYS 5 2HD LYS 5 -13.866 0.678 -2.295
34 HE2 LYS 5 1HE LYS 5 -14.176 3.003 -1.465
35 HE3 LYS 5 2HE LYS 5 -13.611 3.636 -3.019
36 HZ1 LYS 5 3HZ LYS 5 -16.029 3.581 -2.913
37 HZ2 LYS 5 1HZ LYS 5 -15.517 2.555 -4.076
38 HZ3 LYS 5 2HZ LYS 5 -16.040 1.971 -2.640
39 H ILE 6 H ILE 6 -7.596 1.541 -1.085
40 HA ILE 6 HA ILE 6 -7.401 3.746 -3.024
41 HB ILE 6 HB ILE 6 -5.461 4.451 -1.697
42 HG12 ILE 6 1HG1 ILE 6 -5.842 1.904 -0.055
43 HG13 ILE 6 2HG1 ILE 6 -4.520 2.212 -1.179
44 HG21 ILE 6 1HG2 ILE 6 -7.775 5.043 -1.017
45 HG22 ILE 6 2HG2 ILE 6 -7.790 3.665 0.101
46 HG23 ILE 6 3HG2 ILE 6 -6.651 5.004 0.342
47 HD11 ILE 6 3HD1 ILE 6 -3.720 2.598 1.030
48 HD12 ILE 6 1HD1 ILE 6 -3.828 4.175 0.220
49 HD13 ILE 6 2HD1 ILE 6 -5.058 3.694 1.414
50 H LEU 7 H LEU 7 -5.309 4.299 -4.036
51 HA LEU 7 HA LEU 7 -3.567 2.011 -4.772
52 HB2 LEU 7 1HB LEU 7 -5.207 2.400 -6.616
53 HB3 LEU 7 2HB LEU 7 -4.676 4.075 -6.725
54 HG LEU 7 HG LEU 7 -2.391 3.287 -7.366
55 HD11 LEU 7 1HD1 LEU 7 -2.374 1.032 -6.331
56 HD12 LEU 7 2HD1 LEU 7 -3.678 0.514 -7.419
57 HD13 LEU 7 3HD1 LEU 7 -2.074 0.922 -8.067
58 HD21 LEU 7 3HD2 LEU 7 -2.998 2.578 -9.640
59 HD22 LEU 7 1HD2 LEU 7 -4.650 2.207 -9.099
60 HD23 LEU 7 2HD2 LEU 7 -4.055 3.882 -9.076
61 H LYS 8 H LYS 8 -2.160 2.712 -3.217
62 HA LYS 8 HA LYS 8 -0.938 5.439 -3.452
63 HB2 LYS 8 1HB LYS 8 -2.103 4.836 -1.309
64 HB3 LYS 8 2HB LYS 8 -0.966 3.496 -1.087
65 HG2 LYS 8 1HG LYS 8 0.920 5.157 -1.097
66 HG3 LYS 8 2HG LYS 8 -0.267 6.464 -1.281
67 HD2 LYS 8 1HD LYS 8 -1.264 5.736 0.931
68 HD3 LYS 8 2HD LYS 8 0.080 4.566 1.064
69 HE2 LYS 8 1HE LYS 8 1.699 6.483 0.784
70 HE3 LYS 8 2HE LYS 8 0.330 7.604 0.798
71 HZ1 LYS 8 3HZ LYS 8 1.313 7.450 2.981
72 HZ2 LYS 8 1HZ LYS 8 -0.179 6.790 3.064
73 HZ3 LYS 8 2HZ LYS 8 1.162 5.824 3.022
74 H LYS 9 H LYS 9 1.207 5.584 -4.049
75 HA LYS 9 HA LYS 9 2.684 3.289 -4.971
76 HB2 LYS 9 1HB LYS 9 3.539 6.144 -4.221
77 HB3 LYS 9 2HB LYS 9 4.613 4.978 -4.996
78 HG2 LYS 9 1HG LYS 9 3.243 4.891 -6.973
79 HG3 LYS 9 2HG LYS 9 2.011 5.949 -6.239
80 HD2 LYS 9 1HD LYS 9 3.684 7.772 -6.078
81 HD3 LYS 9 2HD LYS 9 4.907 6.717 -6.822
82 HE2 LYS 9 1HE LYS 9 3.505 6.520 -8.859
83 HE3 LYS 9 2HE LYS 9 2.267 7.544 -8.119
84 HZ1 LYS 9 3HZ LYS 9 3.704 8.818 -9.593
85 HZ2 LYS 9 1HZ LYS 9 3.893 9.354 -8.062
86 HZ3 LYS 9 2HZ LYS 9 5.038 8.406 -8.746
87 H CYS 10 H CYS 10 4.585 2.328 -4.151
88 HA CYS 10 HA CYS 10 5.653 3.042 -1.505
89 HB2 CYS 10 1HB CYS 10 5.157 0.935 -0.383
90 HB3 CYS 10 2HB CYS 10 3.675 1.730 -0.876
91 H ARG 11 H ARG 11 7.458 1.916 -0.810
92 HA ARG 11 HA ARG 11 8.823 0.090 -2.756
93 HB2 ARG 11 1HB ARG 11 10.933 0.935 -2.149
94 HB3 ARG 11 2HB ARG 11 9.920 2.340 -2.469
95 HG2 ARG 11 1HG ARG 11 9.568 2.504 0.068
96 HG3 ARG 11 2HG ARG 11 10.813 1.255 0.240
97 HD2 ARG 11 1HD ARG 11 12.398 2.720 -1.023
98 HD3 ARG 11 2HD ARG 11 11.169 3.985 -1.078
99 HE ARG 11 HE ARG 11 12.911 3.311 1.115
100 HH11 ARG 11 1HH1 ARG 11 9.626 4.528 0.597
101 HH12 ARG 11 2HH1 ARG 11 9.638 5.458 2.055
102 HH21 ARG 11 1HH2 ARG 11 12.873 4.551 2.976
103 HH22 ARG 11 2HH2 ARG 11 11.475 5.511 3.361
104 H ARG 12 H ARG 12 7.518 0.515 0.403
105 HA ARG 12 HA ARG 12 7.820 -2.256 1.101
106 HB2 ARG 12 1HB ARG 12 9.112 -1.951 3.176
107 HB3 ARG 12 2HB ARG 12 10.071 -1.427 1.800
108 HG2 ARG 12 1HG ARG 12 9.464 0.961 2.307
109 HG3 ARG 12 2HG ARG 12 8.548 0.403 3.716
110 HD2 ARG 12 1HD ARG 12 10.618 -0.587 4.658
111 HD3 ARG 12 2HD ARG 12 11.533 0.015 3.258
112 HE ARG 12 HE ARG 12 10.182 2.228 4.345
113 HH11 ARG 12 1HH1 ARG 12 12.754 0.035 5.388
114 HH12 ARG 12 2HH1 ARG 12 13.441 1.203 6.478
115 HH21 ARG 12 1HH2 ARG 12 11.093 3.680 5.813
116 HH22 ARG 12 2HH2 ARG 12 12.519 3.240 6.699
117 H ASP 13 H ASP 13 6.915 -2.693 3.322
118 HA ASP 13 HA ASP 13 4.218 -1.914 3.199
119 HB2 ASP 13 1HB ASP 13 5.646 -3.080 5.618
120 HB3 ASP 13 2HB ASP 13 3.924 -3.182 5.259
121 H SER 14 H SER 14 6.814 -0.462 5.105
122 HA SER 14 HA SER 14 5.321 1.052 6.960
123 HB2 SER 14 1HB SER 14 7.926 1.876 5.631
124 HB3 SER 14 2HB SER 14 7.324 2.369 7.221
125 HG SER 14 HG SER 14 8.855 0.720 7.462
126 H ASP 15 H ASP 15 5.530 1.573 3.512
127 HA ASP 15 HA ASP 15 4.770 4.429 3.592
128 HB2 ASP 15 1HB ASP 15 4.701 2.377 1.348
129 HB3 ASP 15 2HB ASP 15 4.443 4.105 1.159
130 H CYS 16 H CYS 16 3.168 1.350 3.801
131 HA CYS 16 HA CYS 16 0.667 2.294 2.583
132 HB2 CYS 16 1HB CYS 16 1.513 -0.456 3.542
133 HB3 CYS 16 2HB CYS 16 0.066 -0.066 2.636
134 HA PRO 17 HA PRO 17 -1.153 3.118 6.483
135 HB2 PRO 17 1HB PRO 17 -3.490 4.159 5.712
136 HB3 PRO 17 2HB PRO 17 -1.937 4.853 5.113
137 HG2 PRO 17 1HG PRO 17 -3.703 2.839 3.673
138 HG3 PRO 17 2HG PRO 17 -3.126 4.433 3.075
139 HD2 PRO 17 1HD PRO 17 -1.759 2.108 2.566
140 HD3 PRO 17 2HD PRO 17 -0.936 3.673 2.827
141 H GLY 18 H GLY 18 -2.867 2.489 7.958
142 HA2 GLY 18 1HA GLY 18 -4.333 0.995 8.966
143 HA3 GLY 18 2HA GLY 18 -4.959 0.664 7.343
144 H ALA 19 H ALA 19 -4.968 -1.436 6.949
145 HA ALA 19 HA ALA 19 -2.781 -3.210 7.940
146 HB1 ALA 19 3HB ALA 19 -4.328 -5.028 7.560
147 HB2 ALA 19 1HB ALA 19 -5.162 -3.770 8.486
148 HB3 ALA 19 2HB ALA 19 -5.475 -3.960 6.740
149 H CYS 20 H CYS 20 -3.026 -1.340 5.274
150 HA CYS 20 HA CYS 20 -2.682 -3.222 3.104
151 HB2 CYS 20 1HB CYS 20 -1.825 -0.323 3.337
152 HB3 CYS 20 2HB CYS 20 -1.742 -1.273 1.889
153 H ILE 21 H ILE 21 -0.912 -3.947 2.065
154 HA ILE 21 HA ILE 21 1.825 -3.574 3.251
155 HB ILE 21 HB ILE 21 2.295 -5.906 2.468
156 HG12 ILE 21 1HG1 ILE 21 -0.723 -6.308 2.341
157 HG13 ILE 21 2HG1 ILE 21 0.290 -6.077 0.917
158 HG21 ILE 21 1HG2 ILE 21 1.865 -5.301 4.846
159 HG22 ILE 21 2HG2 ILE 21 0.152 -5.720 4.628
160 HG23 ILE 21 3HG2 ILE 21 1.408 -6.965 4.474
161 HD11 ILE 21 3HD1 ILE 21 -0.090 -8.434 1.223
162 HD12 ILE 21 1HD1 ILE 21 1.621 -8.094 1.546
163 HD13 ILE 21 2HD1 ILE 21 0.492 -8.377 2.894
164 H CYS 22 H CYS 22 3.564 -3.810 1.652
165 HA CYS 22 HA CYS 22 2.792 -2.443 -0.843
166 HB2 CYS 22 1HB CYS 22 4.813 -1.837 0.565
167 HB3 CYS 22 2HB CYS 22 5.555 -3.341 0.041
168 H ARG 23 H ARG 23 2.546 -3.358 -2.800
169 HA ARG 23 HA ARG 23 3.028 -6.291 -3.096
170 HB2 ARG 23 1HB ARG 23 1.247 -4.520 -4.790
171 HB3 ARG 23 2HB ARG 23 1.315 -6.277 -4.769
172 HG2 ARG 23 1HG ARG 23 0.170 -4.411 -2.674
173 HG3 ARG 23 2HG ARG 23 -0.670 -5.620 -3.631
174 HD2 ARG 23 1HD ARG 23 1.254 -6.107 -1.325
175 HD3 ARG 23 2HD ARG 23 -0.482 -6.357 -1.339
176 HE ARG 23 HE ARG 23 -0.163 -8.148 -3.013
177 HH11 ARG 23 1HH1 ARG 23 2.722 -7.373 -1.053
178 HH12 ARG 23 2HH1 ARG 23 3.304 -9.005 -1.163
179 HH21 ARG 23 1HH2 ARG 23 0.713 -10.182 -3.144
180 HH22 ARG 23 2HH2 ARG 23 2.214 -10.552 -2.354
181 H GLY 24 H GLY 24 3.514 -7.029 -5.342
182 HA2 GLY 24 1HA GLY 24 6.117 -6.134 -5.993
183 HA3 GLY 24 2HA GLY 24 5.160 -7.305 -6.923
184 H ASN 25 H ASN 25 3.123 -4.958 -7.301
185 HA ASN 25 HA ASN 25 4.273 -3.801 -9.717
186 HB2 ASN 25 1HB ASN 25 2.122 -2.795 -10.023
187 HB3 ASN 25 2HB ASN 25 1.892 -4.469 -9.543
188 HD21 ASN 25 1HD2 ASN 25 -0.232 -2.696 -9.357
189 HD22 ASN 25 2HD2 ASN 25 -0.561 -2.371 -7.663
190 H GLY 26 H GLY 26 4.629 -2.948 -6.451
191 HA2 GLY 26 1HA GLY 26 5.848 -1.150 -5.591
192 HA3 GLY 26 2HA GLY 26 5.665 -0.257 -7.120
193 H TYR 27 H TYR 27 2.801 -1.622 -5.612
194 HA TYR 27 HA TYR 27 2.110 0.956 -4.302
195 HB2 TYR 27 1HB TYR 27 0.485 -0.514 -6.381
196 HB3 TYR 27 2HB TYR 27 -0.258 0.565 -5.229
197 HD1 TYR 27 HD1 TYR 27 2.431 0.476 -7.867
198 HD2 TYR 27 HD2 TYR 27 -0.524 2.799 -5.774
199 HE1 TYR 27 HE1 TYR 27 2.922 2.396 -9.333
200 HE2 TYR 27 HE2 TYR 27 -0.115 4.708 -7.309
201 HH TYR 27 HH TYR 27 2.263 4.501 -9.994
202 H CYS 28 H CYS 28 0.415 0.853 -2.779
203 HA CYS 28 HA CYS 28 0.582 -1.410 -1.001
204 HB2 CYS 28 1HB CYS 28 -1.179 1.072 -0.984
205 HB3 CYS 28 2HB CYS 28 -0.975 -0.013 0.393
206 H GLY 29 H GLY 29 -0.800 -3.043 -0.596
207 HA2 GLY 29 1HA GLY 29 -3.628 -3.030 -1.469
208 HA3 GLY 29 2HA GLY 29 -2.597 -4.223 -2.239
209 HN1 NH2 30 2HN NH2 30 -3.947 -6.171 0.483
210 HN2 NH2 30 1HN NH2 30 -4.322 -5.629 -1.141
Start of MODEL 14
1 H1 GLY 1 1H GLY 1 -9.229 -3.688 12.217
2 H2 GLY 1 2H GLY 1 -7.895 -4.634 12.134
3 H3 GLY 1 3H GLY 1 -7.880 -3.274 13.047
4 HA2 GLY 1 1HA GLY 1 -8.099 -1.875 11.112
5 HA3 GLY 1 2HA GLY 1 -6.649 -2.895 11.025
6 H VAL 2 H VAL 2 -7.408 -1.917 8.681
7 HA VAL 2 HA VAL 2 -8.096 -4.203 7.072
8 HB VAL 2 HB VAL 2 -10.382 -3.510 7.754
9 HG11 VAL 2 1HG1 VAL 2 -10.023 -1.067 8.030
10 HG12 VAL 2 2HG1 VAL 2 -9.865 -0.901 6.267
11 HG13 VAL 2 3HG1 VAL 2 -11.397 -1.435 6.979
12 HG21 VAL 2 3HG2 VAL 2 -11.417 -3.559 5.599
13 HG22 VAL 2 1HG2 VAL 2 -9.950 -2.973 4.800
14 HG23 VAL 2 2HG2 VAL 2 -9.976 -4.588 5.549
15 H CYS 3 H CYS 3 -7.637 -3.806 4.828
16 HA CYS 3 HA CYS 3 -5.888 -1.455 4.384
17 HB2 CYS 3 1HB CYS 3 -4.978 -3.579 3.727
18 HB3 CYS 3 2HB CYS 3 -6.406 -3.994 2.805
19 HA PRO 4 HA PRO 4 -9.580 0.349 2.358
20 HB2 PRO 4 1HB PRO 4 -8.642 2.875 1.904
21 HB3 PRO 4 2HB PRO 4 -9.171 2.308 3.518
22 HG2 PRO 4 1HG PRO 4 -6.343 2.397 2.416
23 HG3 PRO 4 2HG PRO 4 -6.933 3.030 3.988
24 HD2 PRO 4 1HD PRO 4 -5.766 0.603 3.814
25 HD3 PRO 4 2HD PRO 4 -7.177 0.849 4.878
26 H LYS 5 H LYS 5 -10.104 0.951 0.205
27 HA LYS 5 HA LYS 5 -8.451 -0.440 -1.727
28 HB2 LYS 5 1HB LYS 5 -11.099 1.010 -2.115
29 HB3 LYS 5 2HB LYS 5 -10.396 -0.202 -3.183
30 HG2 LYS 5 1HG LYS 5 -11.483 -0.662 -0.377
31 HG3 LYS 5 2HG LYS 5 -12.185 -1.186 -1.903
32 HD2 LYS 5 1HD LYS 5 -10.201 -2.662 -2.296
33 HD3 LYS 5 2HD LYS 5 -9.559 -2.183 -0.705
34 HE2 LYS 5 1HE LYS 5 -11.621 -3.034 0.386
35 HE3 LYS 5 2HE LYS 5 -12.255 -3.528 -1.191
36 HZ1 LYS 5 3HZ LYS 5 -11.215 -5.383 -0.038
37 HZ2 LYS 5 1HZ LYS 5 -10.367 -5.052 -1.394
38 HZ3 LYS 5 2HZ LYS 5 -9.786 -4.597 0.069
39 H ILE 6 H ILE 6 -7.311 2.058 -0.798
40 HA ILE 6 HA ILE 6 -7.332 3.970 -3.066
41 HB ILE 6 HB ILE 6 -5.609 3.906 -0.563
42 HG12 ILE 6 1HG1 ILE 6 -8.111 5.588 -1.083
43 HG13 ILE 6 2HG1 ILE 6 -8.090 4.142 -0.080
44 HG21 ILE 6 1HG2 ILE 6 -4.588 5.245 -2.367
45 HG22 ILE 6 2HG2 ILE 6 -6.102 6.156 -2.564
46 HG23 ILE 6 3HG2 ILE 6 -5.139 6.291 -1.078
47 HD11 ILE 6 3HD1 ILE 6 -8.002 6.012 1.382
48 HD12 ILE 6 1HD1 ILE 6 -6.415 5.219 1.433
49 HD13 ILE 6 2HD1 ILE 6 -6.638 6.735 0.521
50 H LEU 7 H LEU 7 -5.802 4.102 -4.611
51 HA LEU 7 HA LEU 7 -3.721 1.995 -4.795
52 HB2 LEU 7 1HB LEU 7 -5.278 2.383 -6.701
53 HB3 LEU 7 2HB LEU 7 -4.689 4.038 -6.836
54 HG LEU 7 HG LEU 7 -2.408 3.161 -7.367
55 HD11 LEU 7 1HD1 LEU 7 -2.508 0.935 -6.274
56 HD12 LEU 7 2HD1 LEU 7 -3.784 0.430 -7.403
57 HD13 LEU 7 3HD1 LEU 7 -2.142 0.770 -7.994
58 HD21 LEU 7 3HD2 LEU 7 -2.951 2.412 -9.645
59 HD22 LEU 7 1HD2 LEU 7 -4.634 2.110 -9.157
60 HD23 LEU 7 2HD2 LEU 7 -3.984 3.765 -9.155
61 H LYS 8 H LYS 8 -2.298 2.672 -3.247
62 HA LYS 8 HA LYS 8 -1.002 5.359 -3.510
63 HB2 LYS 8 1HB LYS 8 -2.189 4.706 -1.338
64 HB3 LYS 8 2HB LYS 8 -0.956 3.454 -1.118
65 HG2 LYS 8 1HG LYS 8 0.802 5.299 -1.284
66 HG3 LYS 8 2HG LYS 8 -0.518 6.475 -1.363
67 HD2 LYS 8 1HD LYS 8 -1.292 5.669 0.893
68 HD3 LYS 8 2HD LYS 8 0.123 4.581 0.933
69 HE2 LYS 8 1HE LYS 8 1.616 6.579 0.623
70 HE3 LYS 8 2HE LYS 8 0.193 7.630 0.696
71 HZ1 LYS 8 3HZ LYS 8 1.282 7.488 2.844
72 HZ2 LYS 8 1HZ LYS 8 -0.195 6.798 2.967
73 HZ3 LYS 8 2HZ LYS 8 1.156 5.856 2.875
74 H LYS 9 H LYS 9 1.151 5.446 -4.131
75 HA LYS 9 HA LYS 9 2.528 2.986 -4.852
76 HB2 LYS 9 1HB LYS 9 2.679 5.387 -5.898
77 HB3 LYS 9 2HB LYS 9 3.878 5.670 -4.617
78 HG2 LYS 9 1HG LYS 9 5.281 3.860 -5.476
79 HG3 LYS 9 2HG LYS 9 4.035 3.418 -6.658
80 HD2 LYS 9 1HD LYS 9 4.277 5.652 -7.730
81 HD3 LYS 9 2HD LYS 9 5.553 6.061 -6.560
82 HE2 LYS 9 1HE LYS 9 6.902 4.131 -7.361
83 HE3 LYS 9 2HE LYS 9 5.623 3.704 -8.508
84 HZ1 LYS 9 3HZ LYS 9 7.375 4.990 -9.575
85 HZ2 LYS 9 1HZ LYS 9 5.983 5.844 -9.606
86 HZ3 LYS 9 2HZ LYS 9 7.165 6.241 -8.547
87 H CYS 10 H CYS 10 4.650 2.412 -4.083
88 HA CYS 10 HA CYS 10 5.519 3.152 -1.373
89 HB2 CYS 10 1HB CYS 10 5.063 0.975 -0.327
90 HB3 CYS 10 2HB CYS 10 3.593 1.780 -0.836
91 H ARG 11 H ARG 11 7.349 2.180 -0.601
92 HA ARG 11 HA ARG 11 9.060 0.593 -2.488
93 HB2 ARG 11 1HB ARG 11 9.815 2.372 -0.122
94 HB3 ARG 11 2HB ARG 11 10.941 1.388 -1.070
95 HG2 ARG 11 1HG ARG 11 10.335 2.672 -3.119
96 HG3 ARG 11 2HG ARG 11 9.262 3.698 -2.148
97 HD2 ARG 11 1HD ARG 11 11.221 4.386 -0.748
98 HD3 ARG 11 2HD ARG 11 12.266 3.382 -1.752
99 HE ARG 11 HE ARG 11 12.187 4.925 -3.469
100 HH11 ARG 11 1HH1 ARG 11 9.801 5.943 -1.052
101 HH12 ARG 11 2HH1 ARG 11 9.586 7.501 -1.795
102 HH21 ARG 11 1HH2 ARG 11 11.857 6.944 -4.368
103 HH22 ARG 11 2HH2 ARG 11 10.732 8.055 -3.648
104 H ARG 12 H ARG 12 7.489 0.741 0.654
105 HA ARG 12 HA ARG 12 7.700 -2.113 1.090
106 HB2 ARG 12 1HB ARG 12 8.860 -1.962 3.282
107 HB3 ARG 12 2HB ARG 12 9.911 -1.436 1.975
108 HG2 ARG 12 1HG ARG 12 9.542 0.921 2.534
109 HG3 ARG 12 2HG ARG 12 8.331 0.485 3.752
110 HD2 ARG 12 1HD ARG 12 10.037 -0.700 5.061
111 HD3 ARG 12 2HD ARG 12 11.271 -0.298 3.847
112 HE ARG 12 HE ARG 12 10.241 2.155 4.503
113 HH11 ARG 12 1HH1 ARG 12 11.651 -0.410 6.494
114 HH12 ARG 12 2HH1 ARG 12 12.198 0.706 7.709
115 HH21 ARG 12 1HH2 ARG 12 10.966 3.540 6.114
116 HH22 ARG 12 2HH2 ARG 12 11.816 2.912 7.491
117 H ASP 13 H ASP 13 6.753 -2.678 3.306
118 HA ASP 13 HA ASP 13 4.047 -1.950 3.184
119 HB2 ASP 13 1HB ASP 13 5.502 -3.112 5.594
120 HB3 ASP 13 2HB ASP 13 3.780 -3.250 5.240
121 H SER 14 H SER 14 6.606 -0.507 5.142
122 HA SER 14 HA SER 14 5.100 0.968 7.024
123 HB2 SER 14 1HB SER 14 7.684 1.854 5.694
124 HB3 SER 14 2HB SER 14 7.119 2.261 7.317
125 HG SER 14 HG SER 14 7.468 0.108 7.935
126 H ASP 15 H ASP 15 5.336 1.543 3.585
127 HA ASP 15 HA ASP 15 4.567 4.400 3.733
128 HB2 ASP 15 1HB ASP 15 4.664 2.469 1.387
129 HB3 ASP 15 2HB ASP 15 4.460 4.212 1.283
130 H CYS 16 H CYS 16 2.975 1.323 3.772
131 HA CYS 16 HA CYS 16 0.577 2.228 2.349
132 HB2 CYS 16 1HB CYS 16 1.414 -0.470 3.450
133 HB3 CYS 16 2HB CYS 16 -0.042 -0.156 2.527
134 HA PRO 17 HA PRO 17 -1.704 3.308 5.850
135 HB2 PRO 17 1HB PRO 17 -4.118 3.816 4.785
136 HB3 PRO 17 2HB PRO 17 -2.638 4.654 4.189
137 HG2 PRO 17 1HG PRO 17 -3.950 2.197 2.972
138 HG3 PRO 17 2HG PRO 17 -3.551 3.748 2.162
139 HD2 PRO 17 1HD PRO 17 -1.833 1.628 2.117
140 HD3 PRO 17 2HD PRO 17 -1.256 3.315 2.235
141 H GLY 18 H GLY 18 -3.085 2.575 7.486
142 HA2 GLY 18 1HA GLY 18 -4.327 1.071 8.746
143 HA3 GLY 18 2HA GLY 18 -5.095 0.594 7.224
144 H ALA 19 H ALA 19 -4.989 -1.507 6.902
145 HA ALA 19 HA ALA 19 -2.677 -3.125 7.860
146 HB1 ALA 19 3HB ALA 19 -4.156 -5.024 7.647
147 HB2 ALA 19 1HB ALA 19 -5.006 -3.753 8.536
148 HB3 ALA 19 2HB ALA 19 -5.382 -4.056 6.819
149 H CYS 20 H CYS 20 -3.073 -1.414 5.120
150 HA CYS 20 HA CYS 20 -2.738 -3.362 3.010
151 HB2 CYS 20 1HB CYS 20 -1.936 -0.450 3.179
152 HB3 CYS 20 2HB CYS 20 -1.768 -1.421 1.752
153 H ILE 21 H ILE 21 -0.964 -4.096 1.956
154 HA ILE 21 HA ILE 21 1.771 -3.678 3.127
155 HB ILE 21 HB ILE 21 2.275 -5.999 2.337
156 HG12 ILE 21 1HG1 ILE 21 -0.737 -6.440 2.217
157 HG13 ILE 21 2HG1 ILE 21 0.270 -6.197 0.792
158 HG21 ILE 21 1HG2 ILE 21 1.843 -5.402 4.716
159 HG22 ILE 21 2HG2 ILE 21 0.135 -5.841 4.502
160 HG23 ILE 21 3HG2 ILE 21 1.407 -7.070 4.344
161 HD11 ILE 21 3HD1 ILE 21 -0.079 -8.558 1.098
162 HD12 ILE 21 1HD1 ILE 21 1.627 -8.199 1.426
163 HD13 ILE 21 2HD1 ILE 21 0.499 -8.494 2.770
164 H CYS 22 H CYS 22 3.516 -3.830 1.567
165 HA CYS 22 HA CYS 22 2.751 -2.476 -0.942
166 HB2 CYS 22 1HB CYS 22 4.691 -1.788 0.546
167 HB3 CYS 22 2HB CYS 22 5.520 -3.250 0.034
168 H ARG 23 H ARG 23 2.482 -3.459 -2.857
169 HA ARG 23 HA ARG 23 3.117 -6.357 -3.116
170 HB2 ARG 23 1HB ARG 23 1.329 -4.653 -4.876
171 HB3 ARG 23 2HB ARG 23 1.450 -6.407 -4.845
172 HG2 ARG 23 1HG ARG 23 0.206 -4.576 -2.773
173 HG3 ARG 23 2HG ARG 23 -0.581 -5.802 -3.752
174 HD2 ARG 23 1HD ARG 23 1.327 -6.253 -1.425
175 HD3 ARG 23 2HD ARG 23 -0.406 -6.540 -1.452
176 HE ARG 23 HE ARG 23 -0.025 -8.302 -3.159
177 HH11 ARG 23 1HH1 ARG 23 2.749 -7.533 -1.054
178 HH12 ARG 23 2HH1 ARG 23 3.387 -9.140 -1.203
179 HH21 ARG 23 1HH2 ARG 23 0.899 -10.315 -3.315
180 HH22 ARG 23 2HH2 ARG 23 2.375 -10.677 -2.474
181 H GLY 24 H GLY 24 3.645 -7.103 -5.373
182 HA2 GLY 24 1HA GLY 24 6.250 -6.174 -5.980
183 HA3 GLY 24 2HA GLY 24 5.324 -7.356 -6.926
184 H ASN 25 H ASN 25 3.253 -5.057 -7.344
185 HA ASN 25 HA ASN 25 4.435 -3.860 -9.730
186 HB2 ASN 25 1HB ASN 25 2.262 -2.918 -10.092
187 HB3 ASN 25 2HB ASN 25 2.076 -4.603 -9.635
188 HD21 ASN 25 1HD2 ASN 25 -0.133 -2.981 -9.487
189 HD22 ASN 25 2HD2 ASN 25 -0.516 -2.655 -7.804
190 H GLY 26 H GLY 26 4.698 -3.021 -6.461
191 HA2 GLY 26 1HA GLY 26 5.855 -1.199 -5.570
192 HA3 GLY 26 2HA GLY 26 5.640 -0.285 -7.084
193 H TYR 27 H TYR 27 2.741 -1.714 -5.801
194 HA TYR 27 HA TYR 27 1.978 0.819 -4.420
195 HB2 TYR 27 1HB TYR 27 0.466 -0.670 -6.582
196 HB3 TYR 27 2HB TYR 27 -0.354 0.338 -5.414
197 HD1 TYR 27 HD2 TYR 27 2.416 0.472 -7.966
198 HD2 TYR 27 HD1 TYR 27 -0.610 2.613 -5.778
199 HE1 TYR 27 HE2 TYR 27 2.972 2.534 -9.228
200 HE2 TYR 27 HE1 TYR 27 -0.088 4.678 -7.058
201 HH TYR 27 HH TYR 27 1.219 5.622 -8.697
202 H CYS 28 H CYS 28 0.292 0.701 -2.926
203 HA CYS 28 HA CYS 28 0.491 -1.536 -1.122
204 HB2 CYS 28 1HB CYS 28 -1.286 0.930 -1.152
205 HB3 CYS 28 2HB CYS 28 -1.099 -0.132 0.244
206 H GLY 29 H GLY 29 -0.873 -3.176 -0.676
207 HA2 GLY 29 1HA GLY 29 -3.688 -3.247 -1.566
208 HA3 GLY 29 2HA GLY 29 -2.624 -4.404 -2.348
209 HN1 NH2 30 2HN NH2 30 -3.882 -6.434 0.350
210 HN2 NH2 30 1HN NH2 30 -4.254 -5.909 -1.281
Start of MODEL 15
1 H1 GLY 1 1H GLY 1 -8.811 -3.556 12.306
2 H2 GLY 1 2H GLY 1 -7.391 -4.364 12.208
3 H3 GLY 1 3H GLY 1 -7.484 -2.974 13.067
4 HA2 GLY 1 1HA GLY 1 -7.910 -1.684 11.091
5 HA3 GLY 1 2HA GLY 1 -6.368 -2.557 10.987
6 H VAL 2 H VAL 2 -7.284 -1.766 8.635
7 HA VAL 2 HA VAL 2 -7.806 -4.175 7.148
8 HB VAL 2 HB VAL 2 -10.125 -3.644 7.889
9 HG11 VAL 2 1HG1 VAL 2 -9.970 -1.167 8.007
10 HG12 VAL 2 2HG1 VAL 2 -9.887 -1.096 6.232
11 HG13 VAL 2 3HG1 VAL 2 -11.341 -1.715 7.034
12 HG21 VAL 2 3HG2 VAL 2 -11.218 -3.917 5.782
13 HG22 VAL 2 1HG2 VAL 2 -9.839 -3.255 4.894
14 HG23 VAL 2 2HG2 VAL 2 -9.693 -4.816 5.736
15 H CYS 3 H CYS 3 -7.484 -3.817 4.857
16 HA CYS 3 HA CYS 3 -5.996 -1.322 4.258
17 HB2 CYS 3 1HB CYS 3 -4.949 -3.436 3.643
18 HB3 CYS 3 2HB CYS 3 -6.355 -3.908 2.704
19 HA PRO 4 HA PRO 4 -9.965 -0.021 2.408
20 HB2 PRO 4 1HB PRO 4 -9.360 2.592 1.842
21 HB3 PRO 4 2HB PRO 4 -9.726 1.993 3.485
22 HG2 PRO 4 1HG PRO 4 -7.005 2.452 2.239
23 HG3 PRO 4 2HG PRO 4 -7.586 2.967 3.850
24 HD2 PRO 4 1HD PRO 4 -6.099 0.718 3.496
25 HD3 PRO 4 2HD PRO 4 -7.401 0.790 4.718
26 H LYS 5 H LYS 5 -10.621 1.023 0.291
27 HA LYS 5 HA LYS 5 -9.366 -0.458 -1.861
28 HB2 LYS 5 1HB LYS 5 -11.729 1.465 -1.881
29 HB3 LYS 5 2HB LYS 5 -11.326 0.317 -3.149
30 HG2 LYS 5 1HG LYS 5 -12.271 -0.339 -0.329
31 HG3 LYS 5 2HG LYS 5 -13.182 -0.506 -1.819
32 HD2 LYS 5 1HD LYS 5 -10.726 -2.141 -1.039
33 HD3 LYS 5 2HD LYS 5 -12.409 -2.671 -0.994
34 HE2 LYS 5 1HE LYS 5 -12.585 -2.318 -3.462
35 HE3 LYS 5 2HE LYS 5 -10.878 -1.861 -3.511
36 HZ1 LYS 5 3HZ LYS 5 -11.185 -4.192 -4.076
37 HZ2 LYS 5 1HZ LYS 5 -10.330 -4.089 -2.688
38 HZ3 LYS 5 2HZ LYS 5 -11.912 -4.507 -2.650
39 H ILE 6 H ILE 6 -7.607 1.497 -0.925
40 HA ILE 6 HA ILE 6 -7.471 3.748 -2.843
41 HB ILE 6 HB ILE 6 -5.454 4.410 -1.558
42 HG12 ILE 6 1HG1 ILE 6 -5.054 3.376 0.681
43 HG13 ILE 6 2HG1 ILE 6 -6.012 1.984 0.212
44 HG21 ILE 6 1HG2 ILE 6 -7.729 5.174 -0.972
45 HG22 ILE 6 2HG2 ILE 6 -7.883 3.834 0.184
46 HG23 ILE 6 3HG2 ILE 6 -6.659 5.092 0.434
47 HD11 ILE 6 3HD1 ILE 6 -3.523 1.687 0.071
48 HD12 ILE 6 1HD1 ILE 6 -4.357 1.332 -1.443
49 HD13 ILE 6 2HD1 ILE 6 -3.491 2.878 -1.241
50 H LEU 7 H LEU 7 -5.266 4.245 -3.793
51 HA LEU 7 HA LEU 7 -3.654 1.909 -4.565
52 HB2 LEU 7 1HB LEU 7 -5.354 2.172 -6.378
53 HB3 LEU 7 2HB LEU 7 -4.824 3.833 -6.620
54 HG LEU 7 HG LEU 7 -2.557 2.990 -7.272
55 HD11 LEU 7 1HD1 LEU 7 -2.531 0.809 -6.082
56 HD12 LEU 7 2HD1 LEU 7 -3.858 0.228 -7.108
57 HD13 LEU 7 3HD1 LEU 7 -2.266 0.584 -7.813
58 HD21 LEU 7 3HD2 LEU 7 -3.236 2.130 -9.474
59 HD22 LEU 7 1HD2 LEU 7 -4.873 1.811 -8.859
60 HD23 LEU 7 2HD2 LEU 7 -4.268 3.478 -8.969
61 H LYS 8 H LYS 8 -2.142 2.663 -3.186
62 HA LYS 8 HA LYS 8 -0.931 5.374 -3.613
63 HB2 LYS 8 1HB LYS 8 -2.007 4.814 -1.351
64 HB3 LYS 8 2HB LYS 8 -0.770 3.566 -1.146
65 HG2 LYS 8 1HG LYS 8 0.950 5.474 -1.543
66 HG3 LYS 8 2HG LYS 8 -0.410 6.589 -1.406
67 HD2 LYS 8 1HD LYS 8 -0.823 5.764 0.906
68 HD3 LYS 8 2HD LYS 8 0.538 4.622 0.721
69 HE2 LYS 8 1HE LYS 8 2.049 6.568 0.225
70 HE3 LYS 8 2HE LYS 8 0.705 7.672 0.546
71 HZ1 LYS 8 3HZ LYS 8 2.136 7.403 2.481
72 HZ2 LYS 8 1HZ LYS 8 0.651 6.811 2.830
73 HZ3 LYS 8 2HZ LYS 8 1.900 5.786 2.504
74 H LYS 9 H LYS 9 1.254 5.447 -4.243
75 HA LYS 9 HA LYS 9 2.653 2.976 -4.884
76 HB2 LYS 9 1HB LYS 9 2.883 5.363 -5.934
77 HB3 LYS 9 2HB LYS 9 3.993 5.659 -4.578
78 HG2 LYS 9 1HG LYS 9 5.452 3.844 -5.326
79 HG3 LYS 9 2HG LYS 9 4.296 3.397 -6.594
80 HD2 LYS 9 1HD LYS 9 4.618 5.615 -7.663
81 HD3 LYS 9 2HD LYS 9 5.779 6.054 -6.389
82 HE2 LYS 9 1HE LYS 9 7.215 4.127 -7.044
83 HE3 LYS 9 2HE LYS 9 6.059 3.691 -8.312
84 HZ1 LYS 9 3HZ LYS 9 7.898 4.994 -9.199
85 HZ2 LYS 9 1HZ LYS 9 6.512 5.839 -9.367
86 HZ3 LYS 9 2HZ LYS 9 7.580 6.240 -8.193
87 H CYS 10 H CYS 10 4.762 2.414 -3.974
88 HA CYS 10 HA CYS 10 5.337 3.196 -1.188
89 HB2 CYS 10 1HB CYS 10 4.956 0.946 -0.224
90 HB3 CYS 10 2HB CYS 10 3.509 1.738 -0.803
91 H ARG 11 H ARG 11 7.198 2.557 -0.290
92 HA ARG 11 HA ARG 11 9.283 1.293 -2.006
93 HB2 ARG 11 1HB ARG 11 9.504 2.631 0.733
94 HB3 ARG 11 2HB ARG 11 10.826 1.979 -0.222
95 HG2 ARG 11 1HG ARG 11 10.980 4.249 -0.597
96 HG3 ARG 11 2HG ARG 11 10.190 3.659 -2.062
97 HD2 ARG 11 1HD ARG 11 8.026 4.489 -1.266
98 HD3 ARG 11 2HD ARG 11 8.722 4.872 0.326
99 HE ARG 11 HE ARG 11 10.173 6.289 -1.650
100 HH11 ARG 11 1HH1 ARG 11 6.905 6.295 -0.251
101 HH12 ARG 11 2HH1 ARG 11 6.681 7.993 -0.577
102 HH21 ARG 11 1HH2 ARG 11 9.804 8.475 -2.037
103 HH22 ARG 11 2HH2 ARG 11 8.296 9.208 -1.576
104 H ARG 12 H ARG 12 7.297 0.709 0.809
105 HA ARG 12 HA ARG 12 7.659 -2.095 1.012
106 HB2 ARG 12 1HB ARG 12 8.792 -2.174 3.229
107 HB3 ARG 12 2HB ARG 12 9.865 -1.577 1.980
108 HG2 ARG 12 1HG ARG 12 9.603 0.725 2.726
109 HG3 ARG 12 2HG ARG 12 8.337 0.278 3.873
110 HD2 ARG 12 1HD ARG 12 11.211 -0.729 4.028
111 HD3 ARG 12 2HD ARG 12 10.605 0.691 4.872
112 HE ARG 12 HE ARG 12 9.169 -0.634 6.228
113 HH11 ARG 12 1HH1 ARG 12 11.402 -2.682 4.371
114 HH12 ARG 12 2HH1 ARG 12 11.120 -4.048 5.408
115 HH21 ARG 12 1HH2 ARG 12 8.857 -2.401 7.475
116 HH22 ARG 12 2HH2 ARG 12 9.702 -3.890 7.156
117 H ASP 13 H ASP 13 6.697 -2.856 3.205
118 HA ASP 13 HA ASP 13 3.995 -2.125 3.155
119 HB2 ASP 13 1HB ASP 13 5.473 -3.415 5.485
120 HB3 ASP 13 2HB ASP 13 3.751 -3.547 5.131
121 H SER 14 H SER 14 6.542 -0.878 5.285
122 HA SER 14 HA SER 14 4.970 0.524 7.180
123 HB2 SER 14 1HB SER 14 7.688 1.332 6.082
124 HB3 SER 14 2HB SER 14 7.025 1.725 7.672
125 HG SER 14 HG SER 14 7.203 -0.423 8.264
126 H ASP 15 H ASP 15 5.427 1.302 3.824
127 HA ASP 15 HA ASP 15 4.715 4.162 4.166
128 HB2 ASP 15 1HB ASP 15 6.544 3.220 2.603
129 HB3 ASP 15 2HB ASP 15 5.225 2.632 1.595
130 H CYS 16 H CYS 16 3.087 1.204 3.890
131 HA CYS 16 HA CYS 16 0.814 2.232 2.288
132 HB2 CYS 16 1HB CYS 16 1.507 -0.527 3.320
133 HB3 CYS 16 2HB CYS 16 0.037 -0.121 2.459
134 HA PRO 17 HA PRO 17 -1.432 3.405 5.775
135 HB2 PRO 17 1HB PRO 17 -3.795 4.091 4.699
136 HB3 PRO 17 2HB PRO 17 -2.254 4.840 4.138
137 HG2 PRO 17 1HG PRO 17 -3.716 2.507 2.851
138 HG3 PRO 17 2HG PRO 17 -3.194 4.046 2.084
139 HD2 PRO 17 1HD PRO 17 -1.630 1.810 2.011
140 HD3 PRO 17 2HD PRO 17 -0.939 3.453 2.160
141 H GLY 18 H GLY 18 -2.949 2.780 7.365
142 HA2 GLY 18 1HA GLY 18 -4.293 1.323 8.584
143 HA3 GLY 18 2HA GLY 18 -4.985 0.811 7.036
144 H ALA 19 H ALA 19 -4.882 -1.310 6.808
145 HA ALA 19 HA ALA 19 -2.524 -2.862 7.793
146 HB1 ALA 19 3HB ALA 19 -3.967 -4.793 7.735
147 HB2 ALA 19 1HB ALA 19 -4.810 -3.501 8.599
148 HB3 ALA 19 2HB ALA 19 -5.249 -3.892 6.914
149 H CYS 20 H CYS 20 -2.989 -1.248 5.051
150 HA CYS 20 HA CYS 20 -2.749 -3.219 2.956
151 HB2 CYS 20 1HB CYS 20 -1.884 -0.323 3.103
152 HB3 CYS 20 2HB CYS 20 -1.762 -1.284 1.673
153 H ILE 21 H ILE 21 -1.040 -4.011 1.855
154 HA ILE 21 HA ILE 21 1.724 -3.754 3.007
155 HB ILE 21 HB ILE 21 2.097 -6.074 2.152
156 HG12 ILE 21 1HG1 ILE 21 -0.933 -6.353 2.027
157 HG13 ILE 21 2HG1 ILE 21 0.081 -6.117 0.604
158 HG21 ILE 21 1HG2 ILE 21 1.695 -5.521 4.548
159 HG22 ILE 21 2HG2 ILE 21 -0.034 -5.855 4.322
160 HG23 ILE 21 3HG2 ILE 21 1.165 -7.151 4.131
161 HD11 ILE 21 3HD1 ILE 21 -0.388 -8.466 0.840
162 HD12 ILE 21 1HD1 ILE 21 1.337 -8.202 1.167
163 HD13 ILE 21 2HD1 ILE 21 0.202 -8.482 2.510
164 H CYS 22 H CYS 22 3.455 -3.934 1.455
165 HA CYS 22 HA CYS 22 2.750 -2.497 -1.034
166 HB2 CYS 22 1HB CYS 22 4.643 -1.839 0.528
167 HB3 CYS 22 2HB CYS 22 5.495 -3.285 -0.004
168 H ARG 23 H ARG 23 2.421 -3.495 -2.917
169 HA ARG 23 HA ARG 23 3.038 -6.381 -3.202
170 HB2 ARG 23 1HB ARG 23 1.343 -4.597 -4.979
171 HB3 ARG 23 2HB ARG 23 1.417 -6.353 -4.995
172 HG2 ARG 23 1HG ARG 23 0.192 -4.556 -2.874
173 HG3 ARG 23 2HG ARG 23 -0.625 -5.696 -3.929
174 HD2 ARG 23 1HD ARG 23 1.234 -6.359 -1.612
175 HD3 ARG 23 2HD ARG 23 -0.514 -6.552 -1.658
176 HE ARG 23 HE ARG 23 -0.205 -8.222 -3.484
177 HH11 ARG 23 1HH1 ARG 23 2.512 -7.777 -1.227
178 HH12 ARG 23 2HH1 ARG 23 3.089 -9.391 -1.497
179 HH21 ARG 23 1HH2 ARG 23 0.624 -10.262 -3.776
180 HH22 ARG 23 2HH2 ARG 23 2.046 -10.769 -2.918
181 H GLY 24 H GLY 24 3.590 -7.118 -5.475
182 HA2 GLY 24 1HA GLY 24 6.236 -6.262 -6.021
183 HA3 GLY 24 2HA GLY 24 5.287 -7.394 -7.006
184 H ASN 25 H ASN 25 3.295 -5.034 -7.415
185 HA ASN 25 HA ASN 25 4.564 -3.813 -9.746
186 HB2 ASN 25 1HB ASN 25 2.413 -2.832 -10.154
187 HB3 ASN 25 2HB ASN 25 2.194 -4.524 -9.739
188 HD21 ASN 25 1HD2 ASN 25 -0.011 -2.919 -9.617
189 HD22 ASN 25 2HD2 ASN 25 -0.435 -2.610 -7.941
190 H GLY 26 H GLY 26 4.770 -3.051 -6.464
191 HA2 GLY 26 1HA GLY 26 5.922 -1.266 -5.503
192 HA3 GLY 26 2HA GLY 26 5.764 -0.318 -7.003
193 H TYR 27 H TYR 27 2.793 -1.694 -5.873
194 HA TYR 27 HA TYR 27 2.040 0.828 -4.466
195 HB2 TYR 27 1HB TYR 27 0.579 -0.630 -6.680
196 HB3 TYR 27 2HB TYR 27 -0.292 0.306 -5.492
197 HD1 TYR 27 HD1 TYR 27 2.618 0.674 -7.876
198 HD2 TYR 27 HD2 TYR 27 -0.688 2.545 -5.849
199 HE1 TYR 27 HE1 TYR 27 3.129 2.804 -9.025
200 HE2 TYR 27 HE2 TYR 27 -0.229 4.673 -7.049
201 HH TYR 27 HH TYR 27 2.480 4.987 -9.383
202 H CYS 28 H CYS 28 0.338 0.739 -3.007
203 HA CYS 28 HA CYS 28 0.465 -1.489 -1.186
204 HB2 CYS 28 1HB CYS 28 -1.254 1.019 -1.255
205 HB3 CYS 28 2HB CYS 28 -1.113 -0.038 0.148
206 H GLY 29 H GLY 29 -0.933 -3.106 -0.772
207 HA2 GLY 29 1HA GLY 29 -3.739 -3.111 -1.711
208 HA3 GLY 29 2HA GLY 29 -2.686 -4.320 -2.429
209 HN1 NH2 30 2HN NH2 30 -4.089 -6.209 0.309
210 HN2 NH2 30 1HN NH2 30 -4.427 -5.712 -1.338
Start of MODEL 16
1 H1 GLY 1 1H GLY 1 -9.173 -4.065 12.082
2 H2 GLY 1 2H GLY 1 -7.770 -4.894 11.930
3 H3 GLY 1 3H GLY 1 -7.852 -3.599 12.928
4 HA2 GLY 1 1HA GLY 1 -8.203 -2.102 11.088
5 HA3 GLY 1 2HA GLY 1 -6.678 -2.994 10.929
6 H VAL 2 H VAL 2 -7.639 -1.889 8.669
7 HA VAL 2 HA VAL 2 -8.276 -4.171 6.950
8 HB VAL 2 HB VAL 2 -10.014 -2.938 5.683
9 HG11 VAL 2 1HG1 VAL 2 -10.669 -4.695 7.303
10 HG12 VAL 2 2HG1 VAL 2 -10.925 -3.436 8.538
11 HG13 VAL 2 3HG1 VAL 2 -11.914 -3.458 7.068
12 HG21 VAL 2 3HG2 VAL 2 -11.273 -1.080 6.679
13 HG22 VAL 2 1HG2 VAL 2 -10.159 -1.029 8.058
14 HG23 VAL 2 2HG2 VAL 2 -9.587 -0.621 6.424
15 H CYS 3 H CYS 3 -7.825 -3.612 4.670
16 HA CYS 3 HA CYS 3 -5.815 -1.428 4.468
17 HB2 CYS 3 1HB CYS 3 -4.970 -3.542 3.787
18 HB3 CYS 3 2HB CYS 3 -6.383 -3.908 2.823
19 HA PRO 4 HA PRO 4 -9.061 1.021 2.379
20 HB2 PRO 4 1HB PRO 4 -6.538 2.603 1.809
21 HB3 PRO 4 2HB PRO 4 -8.178 3.213 2.207
22 HG2 PRO 4 1HG PRO 4 -6.296 3.089 4.134
23 HG3 PRO 4 2HG PRO 4 -7.949 2.483 4.491
24 HD2 PRO 4 1HD PRO 4 -5.482 0.901 3.755
25 HD3 PRO 4 2HD PRO 4 -6.700 0.578 5.020
26 H LYS 5 H LYS 5 -9.743 1.202 0.266
27 HA LYS 5 HA LYS 5 -8.391 -0.555 -1.630
28 HB2 LYS 5 1HB LYS 5 -11.091 0.864 -1.703
29 HB3 LYS 5 2HB LYS 5 -10.543 -0.338 -2.880
30 HG2 LYS 5 1HG LYS 5 -10.328 -2.029 -1.066
31 HG3 LYS 5 2HG LYS 5 -10.968 -0.850 0.097
32 HD2 LYS 5 1HD LYS 5 -13.065 -0.684 -1.216
33 HD3 LYS 5 2HD LYS 5 -12.430 -1.874 -2.377
34 HE2 LYS 5 1HE LYS 5 -12.228 -3.546 -0.543
35 HE3 LYS 5 2HE LYS 5 -12.866 -2.364 0.608
36 HZ1 LYS 5 3HZ LYS 5 -14.601 -3.858 -0.178
37 HZ2 LYS 5 1HZ LYS 5 -14.937 -2.337 -0.669
38 HZ3 LYS 5 2HZ LYS 5 -14.346 -3.431 -1.734
39 H ILE 6 H ILE 6 -7.452 2.297 -1.148
40 HA ILE 6 HA ILE 6 -7.642 3.599 -3.802
41 HB ILE 6 HB ILE 6 -6.145 5.318 -2.808
42 HG12 ILE 6 1HG1 ILE 6 -6.473 3.854 -0.155
43 HG13 ILE 6 2HG1 ILE 6 -5.017 3.747 -1.136
44 HG21 ILE 6 1HG2 ILE 6 -8.632 5.455 -2.737
45 HG22 ILE 6 2HG2 ILE 6 -8.617 4.713 -1.124
46 HG23 ILE 6 3HG2 ILE 6 -7.868 6.301 -1.390
47 HD11 ILE 6 3HD1 ILE 6 -4.681 5.390 0.597
48 HD12 ILE 6 1HD1 ILE 6 -4.727 6.218 -0.971
49 HD13 ILE 6 2HD1 ILE 6 -6.134 6.282 0.121
50 H LEU 7 H LEU 7 -5.872 4.127 -5.149
51 HA LEU 7 HA LEU 7 -3.736 2.083 -5.237
52 HB2 LEU 7 1HB LEU 7 -5.101 2.633 -7.253
53 HB3 LEU 7 2HB LEU 7 -4.499 4.287 -7.196
54 HG LEU 7 HG LEU 7 -2.176 3.426 -7.551
55 HD11 LEU 7 1HD1 LEU 7 -2.394 1.118 -6.671
56 HD12 LEU 7 2HD1 LEU 7 -3.559 0.729 -7.954
57 HD13 LEU 7 3HD1 LEU 7 -1.866 1.088 -8.356
58 HD21 LEU 7 3HD2 LEU 7 -2.478 2.878 -9.928
59 HD22 LEU 7 1HD2 LEU 7 -4.206 2.561 -9.649
60 HD23 LEU 7 2HD2 LEU 7 -3.549 4.200 -9.437
61 H LYS 8 H LYS 8 -2.504 2.631 -3.496
62 HA LYS 8 HA LYS 8 -1.252 5.346 -3.336
63 HB2 LYS 8 1HB LYS 8 -2.781 4.245 -1.514
64 HB3 LYS 8 2HB LYS 8 -1.389 3.256 -1.118
65 HG2 LYS 8 1HG LYS 8 -1.489 6.313 -1.096
66 HG3 LYS 8 2HG LYS 8 -1.750 5.277 0.307
67 HD2 LYS 8 1HD LYS 8 0.576 4.387 0.074
68 HD3 LYS 8 2HD LYS 8 0.843 5.540 -1.259
69 HE2 LYS 8 1HE LYS 8 0.355 7.435 0.218
70 HE3 LYS 8 2HE LYS 8 0.011 6.334 1.561
71 HZ1 LYS 8 3HZ LYS 8 2.276 7.238 1.644
72 HZ2 LYS 8 1HZ LYS 8 2.296 5.606 1.521
73 HZ3 LYS 8 2HZ LYS 8 2.649 6.540 0.211
74 H LYS 9 H LYS 9 0.903 5.468 -3.930
75 HA LYS 9 HA LYS 9 2.323 3.057 -4.676
76 HB2 LYS 9 1HB LYS 9 2.415 5.498 -5.653
77 HB3 LYS 9 2HB LYS 9 3.646 5.751 -4.400
78 HG2 LYS 9 1HG LYS 9 5.030 3.964 -5.355
79 HG3 LYS 9 2HG LYS 9 3.754 3.569 -6.518
80 HD2 LYS 9 1HD LYS 9 3.973 5.868 -7.487
81 HD3 LYS 9 2HD LYS 9 5.310 6.185 -6.360
82 HE2 LYS 9 1HE LYS 9 6.571 4.268 -7.321
83 HE3 LYS 9 2HE LYS 9 5.228 3.929 -8.423
84 HZ1 LYS 9 3HZ LYS 9 6.959 5.225 -9.512
85 HZ2 LYS 9 1HZ LYS 9 5.589 6.109 -9.436
86 HZ3 LYS 9 2HZ LYS 9 6.830 6.428 -8.417
87 H CYS 10 H CYS 10 4.468 2.500 -3.982
88 HA CYS 10 HA CYS 10 5.414 3.177 -1.281
89 HB2 CYS 10 1HB CYS 10 5.012 0.954 -0.292
90 HB3 CYS 10 2HB CYS 10 3.519 1.769 -0.720
91 H ARG 11 H ARG 11 7.277 2.138 -0.575
92 HA ARG 11 HA ARG 11 8.910 0.631 -2.591
93 HB2 ARG 11 1HB ARG 11 9.770 2.326 -0.200
94 HB3 ARG 11 2HB ARG 11 10.850 1.356 -1.209
95 HG2 ARG 11 1HG ARG 11 10.210 2.697 -3.201
96 HG3 ARG 11 2HG ARG 11 9.160 3.705 -2.183
97 HD2 ARG 11 1HD ARG 11 11.114 4.373 -0.819
98 HD3 ARG 11 2HD ARG 11 12.169 3.370 -1.837
99 HE ARG 11 HE ARG 11 10.748 5.138 -3.532
100 HH11 ARG 11 1HH1 ARG 11 13.269 5.373 -1.062
101 HH12 ARG 11 2HH1 ARG 11 13.951 6.814 -1.759
102 HH21 ARG 11 1HH2 ARG 11 11.674 7.000 -4.384
103 HH22 ARG 11 2HH2 ARG 11 13.057 7.719 -3.617
104 H ARG 12 H ARG 12 7.589 0.722 0.694
105 HA ARG 12 HA ARG 12 7.627 -2.169 0.902
106 HB2 ARG 12 1HB ARG 12 8.979 -2.381 2.886
107 HB3 ARG 12 2HB ARG 12 9.947 -1.572 1.663
108 HG2 ARG 12 1HG ARG 12 9.358 0.648 2.743
109 HG3 ARG 12 2HG ARG 12 8.537 -0.256 4.020
110 HD2 ARG 12 1HD ARG 12 11.492 -0.391 3.318
111 HD3 ARG 12 2HD ARG 12 10.798 0.436 4.707
112 HE ARG 12 HE ARG 12 11.322 -2.413 4.395
113 HH11 ARG 12 1HH1 ARG 12 9.341 -0.134 6.285
114 HH12 ARG 12 2HH1 ARG 12 9.229 -1.244 7.621
115 HH21 ARG 12 1HH2 ARG 12 11.061 -3.785 6.127
116 HH22 ARG 12 2HH2 ARG 12 10.149 -3.285 7.519
117 H ASP 13 H ASP 13 6.844 -2.758 3.273
118 HA ASP 13 HA ASP 13 4.141 -2.039 3.193
119 HB2 ASP 13 1HB ASP 13 5.623 -3.238 5.561
120 HB3 ASP 13 2HB ASP 13 3.897 -3.366 5.225
121 H SER 14 H SER 14 6.677 -0.490 5.127
122 HA SER 14 HA SER 14 4.915 0.866 6.973
123 HB2 SER 14 1HB SER 14 6.931 2.239 7.469
124 HB3 SER 14 2HB SER 14 7.192 0.498 7.571
125 HG SER 14 HG SER 14 8.059 2.293 5.551
126 H ASP 15 H ASP 15 5.434 1.444 3.624
127 HA ASP 15 HA ASP 15 4.701 4.317 3.726
128 HB2 ASP 15 1HB ASP 15 4.880 2.400 1.384
129 HB3 ASP 15 2HB ASP 15 4.718 4.146 1.282
130 H CYS 16 H CYS 16 3.059 1.314 3.894
131 HA CYS 16 HA CYS 16 0.698 2.191 2.355
132 HB2 CYS 16 1HB CYS 16 1.569 -0.493 3.455
133 HB3 CYS 16 2HB CYS 16 0.058 -0.201 2.617
134 HA PRO 17 HA PRO 17 -1.560 3.333 5.846
135 HB2 PRO 17 1HB PRO 17 -3.963 3.881 4.777
136 HB3 PRO 17 2HB PRO 17 -2.466 4.694 4.190
137 HG2 PRO 17 1HG PRO 17 -3.821 2.274 2.949
138 HG3 PRO 17 2HG PRO 17 -3.377 3.820 2.154
139 HD2 PRO 17 1HD PRO 17 -1.715 1.652 2.118
140 HD3 PRO 17 2HD PRO 17 -1.096 3.329 2.230
141 H GLY 18 H GLY 18 -2.964 2.633 7.482
142 HA2 GLY 18 1HA GLY 18 -4.208 1.139 8.753
143 HA3 GLY 18 2HA GLY 18 -4.979 0.654 7.236
144 H ALA 19 H ALA 19 -4.934 -1.469 7.051
145 HA ALA 19 HA ALA 19 -2.642 -3.097 8.004
146 HB1 ALA 19 3HB ALA 19 -4.166 -4.968 7.771
147 HB2 ALA 19 1HB ALA 19 -5.001 -3.666 8.632
148 HB3 ALA 19 2HB ALA 19 -5.349 -3.973 6.909
149 H CYS 20 H CYS 20 -2.983 -1.430 5.213
150 HA CYS 20 HA CYS 20 -2.696 -3.415 3.149
151 HB2 CYS 20 1HB CYS 20 -1.809 -0.520 3.299
152 HB3 CYS 20 2HB CYS 20 -1.643 -1.495 1.874
153 H ILE 21 H ILE 21 -0.947 -4.206 2.077
154 HA ILE 21 HA ILE 21 1.824 -3.806 3.179
155 HB ILE 21 HB ILE 21 2.329 -6.060 2.255
156 HG12 ILE 21 1HG1 ILE 21 -0.675 -6.539 2.111
157 HG13 ILE 21 2HG1 ILE 21 0.313 -6.169 0.698
158 HG21 ILE 21 1HG2 ILE 21 1.892 -5.633 4.667
159 HG22 ILE 21 2HG2 ILE 21 0.189 -6.074 4.426
160 HG23 ILE 21 3HG2 ILE 21 1.472 -7.277 4.184
161 HD11 ILE 21 3HD1 ILE 21 0.000 -8.557 0.841
162 HD12 ILE 21 1HD1 ILE 21 1.708 -8.182 1.145
163 HD13 ILE 21 2HD1 ILE 21 0.625 -8.601 2.497
164 H CYS 22 H CYS 22 3.529 -3.920 1.541
165 HA CYS 22 HA CYS 22 2.689 -2.481 -0.912
166 HB2 CYS 22 1HB CYS 22 4.625 -1.752 0.538
167 HB3 CYS 22 2HB CYS 22 5.487 -3.198 0.021
168 H ARG 23 H ARG 23 2.222 -3.536 -2.734
169 HA ARG 23 HA ARG 23 2.964 -6.371 -3.090
170 HB2 ARG 23 1HB ARG 23 1.246 -4.588 -4.854
171 HB3 ARG 23 2HB ARG 23 1.373 -6.340 -4.923
172 HG2 ARG 23 1HG ARG 23 0.098 -4.661 -2.730
173 HG3 ARG 23 2HG ARG 23 -0.706 -5.729 -3.866
174 HD2 ARG 23 1HD ARG 23 1.148 -6.551 -1.590
175 HD3 ARG 23 2HD ARG 23 -0.597 -6.737 -1.628
176 HE ARG 23 HE ARG 23 1.397 -8.461 -2.838
177 HH11 ARG 23 1HH1 ARG 23 -2.008 -7.529 -3.168
178 HH12 ARG 23 2HH1 ARG 23 -2.425 -9.020 -3.955
179 HH21 ARG 23 1HH2 ARG 23 0.789 -10.337 -3.883
180 HH22 ARG 23 2HH2 ARG 23 -0.863 -10.579 -4.357
181 H GLY 24 H GLY 24 3.616 -7.073 -5.329
182 HA2 GLY 24 1HA GLY 24 6.226 -6.096 -5.821
183 HA3 GLY 24 2HA GLY 24 5.356 -7.277 -6.820
184 H ASN 25 H ASN 25 3.277 -4.975 -7.271
185 HA ASN 25 HA ASN 25 4.532 -3.768 -9.613
186 HB2 ASN 25 1HB ASN 25 2.371 -2.840 -10.052
187 HB3 ASN 25 2HB ASN 25 2.170 -4.522 -9.590
188 HD21 ASN 25 1HD2 ASN 25 -0.025 -2.834 -9.536
189 HD22 ASN 25 2HD2 ASN 25 -0.471 -2.523 -7.866
190 H GLY 26 H GLY 26 4.659 -2.921 -6.329
191 HA2 GLY 26 1HA GLY 26 5.770 -1.080 -5.404
192 HA3 GLY 26 2HA GLY 26 5.606 -0.177 -6.930
193 H TYR 27 H TYR 27 2.695 -1.650 -5.701
194 HA TYR 27 HA TYR 27 1.862 0.859 -4.324
195 HB2 TYR 27 1HB TYR 27 0.362 -0.619 -6.505
196 HB3 TYR 27 2HB TYR 27 -0.421 0.464 -5.378
197 HD1 TYR 27 HD1 TYR 27 2.278 0.341 -7.991
198 HD2 TYR 27 HD2 TYR 27 -0.475 2.768 -5.746
199 HE1 TYR 27 HE1 TYR 27 2.926 2.320 -9.344
200 HE2 TYR 27 HE2 TYR 27 0.152 4.752 -7.094
201 HH TYR 27 HH TYR 27 1.429 5.543 -8.839
202 H CYS 28 H CYS 28 0.143 0.682 -2.867
203 HA CYS 28 HA CYS 28 0.426 -1.585 -1.122
204 HB2 CYS 28 1HB CYS 28 -1.402 0.836 -1.031
205 HB3 CYS 28 2HB CYS 28 -1.118 -0.252 0.327
206 H GLY 29 H GLY 29 -0.981 -3.175 -0.522
207 HA2 GLY 29 1HA GLY 29 -3.785 -3.290 -1.386
208 HA3 GLY 29 2HA GLY 29 -2.743 -4.439 -2.204
209 HN1 NH2 30 2HN NH2 30 -3.959 -6.453 0.543
210 HN2 NH2 30 1HN NH2 30 -4.409 -5.898 -1.058
Start of MODEL 17
1 H1 GLY 1 1H GLY 1 -9.427 -3.785 12.098
2 H2 GLY 1 2H GLY 1 -8.153 -4.807 11.973
3 H3 GLY 1 3H GLY 1 -8.063 -3.502 12.957
4 HA2 GLY 1 1HA GLY 1 -8.173 -1.989 11.100
5 HA3 GLY 1 2HA GLY 1 -6.790 -3.093 10.968
6 H VAL 2 H VAL 2 -7.480 -1.934 8.677
7 HA VAL 2 HA VAL 2 -8.278 -4.091 6.943
8 HB VAL 2 HB VAL 2 -10.528 -3.323 7.642
9 HG11 VAL 2 1HG1 VAL 2 -10.048 -0.925 8.075
10 HG12 VAL 2 2HG1 VAL 2 -9.860 -0.654 6.329
11 HG13 VAL 2 3HG1 VAL 2 -11.426 -1.152 6.991
12 HG21 VAL 2 3HG2 VAL 2 -11.540 -3.177 5.479
13 HG22 VAL 2 1HG2 VAL 2 -10.037 -2.621 4.731
14 HG23 VAL 2 2HG2 VAL 2 -10.156 -4.277 5.374
15 H CYS 3 H CYS 3 -7.755 -3.631 4.744
16 HA CYS 3 HA CYS 3 -5.914 -1.329 4.415
17 HB2 CYS 3 1HB CYS 3 -5.017 -3.454 3.762
18 HB3 CYS 3 2HB CYS 3 -6.412 -3.840 2.786
19 HA PRO 4 HA PRO 4 -9.435 0.666 2.276
20 HB2 PRO 4 1HB PRO 4 -8.224 3.055 1.627
21 HB3 PRO 4 2HB PRO 4 -8.888 2.672 3.245
22 HG2 PRO 4 1HG PRO 4 -6.015 2.410 2.303
23 HG3 PRO 4 2HG PRO 4 -6.621 3.193 3.800
24 HD2 PRO 4 1HD PRO 4 -5.677 0.684 3.861
25 HD3 PRO 4 2HD PRO 4 -7.143 1.094 4.788
26 H LYS 5 H LYS 5 -9.981 1.068 0.125
27 HA LYS 5 HA LYS 5 -8.426 -0.548 -1.717
28 HB2 LYS 5 1HB LYS 5 -11.069 0.883 -2.184
29 HB3 LYS 5 2HB LYS 5 -10.425 -0.487 -3.083
30 HG2 LYS 5 1HG LYS 5 -11.457 -0.490 -0.222
31 HG3 LYS 5 2HG LYS 5 -12.179 -1.254 -1.633
32 HD2 LYS 5 1HD LYS 5 -10.244 -2.814 -1.789
33 HD3 LYS 5 2HD LYS 5 -9.529 -2.058 -0.345
34 HE2 LYS 5 1HE LYS 5 -11.581 -2.632 0.954
35 HE3 LYS 5 2HE LYS 5 -12.236 -3.457 -0.469
36 HZ1 LYS 5 3HZ LYS 5 -11.153 -5.015 1.032
37 HZ2 LYS 5 1HZ LYS 5 -10.326 -4.971 -0.376
38 HZ3 LYS 5 2HZ LYS 5 -9.735 -4.205 0.948
39 H ILE 6 H ILE 6 -7.435 2.213 -1.068
40 HA ILE 6 HA ILE 6 -7.507 3.736 -3.584
41 HB ILE 6 HB ILE 6 -5.917 5.245 -2.477
42 HG12 ILE 6 1HG1 ILE 6 -6.048 3.369 -0.067
43 HG13 ILE 6 2HG1 ILE 6 -4.652 3.577 -1.125
44 HG21 ILE 6 1HG2 ILE 6 -8.399 5.433 -2.190
45 HG22 ILE 6 2HG2 ILE 6 -8.260 4.559 -0.649
46 HG23 ILE 6 3HG2 ILE 6 -7.482 6.141 -0.860
47 HD11 ILE 6 3HD1 ILE 6 -4.280 4.864 0.853
48 HD12 ILE 6 1HD1 ILE 6 -4.555 5.997 -0.484
49 HD13 ILE 6 2HD1 ILE 6 -5.841 5.684 0.710
50 H LEU 7 H LEU 7 -5.777 4.161 -4.984
51 HA LEU 7 HA LEU 7 -3.713 2.029 -5.153
52 HB2 LEU 7 1HB LEU 7 -5.191 2.481 -7.110
53 HB3 LEU 7 2HB LEU 7 -4.579 4.131 -7.177
54 HG LEU 7 HG LEU 7 -2.287 3.242 -7.628
55 HD11 LEU 7 1HD1 LEU 7 -2.443 0.992 -6.598
56 HD12 LEU 7 2HD1 LEU 7 -3.685 0.527 -7.780
57 HD13 LEU 7 3HD1 LEU 7 -2.021 0.860 -8.306
58 HD21 LEU 7 3HD2 LEU 7 -2.737 2.551 -9.944
59 HD22 LEU 7 1HD2 LEU 7 -4.443 2.253 -9.538
60 HD23 LEU 7 2HD2 LEU 7 -3.780 3.901 -9.469
61 H LYS 8 H LYS 8 -2.423 2.685 -3.470
62 HA LYS 8 HA LYS 8 -1.073 5.357 -3.609
63 HB2 LYS 8 1HB LYS 8 -2.405 4.748 -1.560
64 HB3 LYS 8 2HB LYS 8 -1.315 3.379 -1.285
65 HG2 LYS 8 1HG LYS 8 0.606 4.994 -1.123
66 HG3 LYS 8 2HG LYS 8 -0.531 6.336 -1.379
67 HD2 LYS 8 1HD LYS 8 -1.744 5.646 0.709
68 HD3 LYS 8 2HD LYS 8 -0.588 4.317 0.888
69 HE2 LYS 8 1HE LYS 8 0.116 6.041 2.382
70 HE3 LYS 8 2HE LYS 8 1.279 5.970 1.058
71 HZ1 LYS 8 3HZ LYS 8 0.656 8.253 1.613
72 HZ2 LYS 8 1HZ LYS 8 0.183 7.924 0.087
73 HZ3 LYS 8 2HZ LYS 8 -0.919 7.962 1.299
74 H LYS 9 H LYS 9 1.055 5.370 -4.284
75 HA LYS 9 HA LYS 9 2.466 2.891 -4.812
76 HB2 LYS 9 1HB LYS 9 4.318 4.321 -5.539
77 HB3 LYS 9 2HB LYS 9 2.780 4.748 -6.282
78 HG2 LYS 9 1HG LYS 9 2.491 6.603 -4.698
79 HG3 LYS 9 2HG LYS 9 4.040 6.196 -3.932
80 HD2 LYS 9 1HD LYS 9 5.259 6.724 -5.973
81 HD3 LYS 9 2HD LYS 9 3.746 6.887 -6.896
82 HE2 LYS 9 1HE LYS 9 3.062 8.797 -5.513
83 HE3 LYS 9 2HE LYS 9 4.534 8.652 -4.535
84 HZ1 LYS 9 3HZ LYS 9 4.770 10.356 -6.242
85 HZ2 LYS 9 1HZ LYS 9 5.829 9.148 -6.536
86 HZ3 LYS 9 2HZ LYS 9 4.469 9.285 -7.437
87 H CYS 10 H CYS 10 4.559 2.290 -4.035
88 HA CYS 10 HA CYS 10 5.423 3.177 -1.347
89 HB2 CYS 10 1HB CYS 10 5.029 0.952 -0.319
90 HB3 CYS 10 2HB CYS 10 3.546 1.763 -0.794
91 H ARG 11 H ARG 11 7.344 2.343 -0.589
92 HA ARG 11 HA ARG 11 9.082 0.843 -2.507
93 HB2 ARG 11 1HB ARG 11 9.859 3.045 -1.641
94 HB3 ARG 11 2HB ARG 11 9.790 2.417 0.011
95 HG2 ARG 11 1HG ARG 11 11.520 0.738 -0.532
96 HG3 ARG 11 2HG ARG 11 11.488 1.229 -2.231
97 HD2 ARG 11 1HD ARG 11 13.431 2.215 -1.201
98 HD3 ARG 11 2HD ARG 11 12.287 3.490 -1.594
99 HE ARG 11 HE ARG 11 12.065 4.001 0.637
100 HH11 ARG 11 1HH1 ARG 11 13.647 0.835 0.498
101 HH12 ARG 11 2HH1 ARG 11 14.081 0.878 2.181
102 HH21 ARG 11 1HH2 ARG 11 12.687 4.004 2.789
103 HH22 ARG 11 2HH2 ARG 11 13.542 2.648 3.456
104 H ARG 12 H ARG 12 7.567 0.759 0.675
105 HA ARG 12 HA ARG 12 7.668 -2.098 0.889
106 HB2 ARG 12 1HB ARG 12 9.055 -2.432 2.765
107 HB3 ARG 12 2HB ARG 12 10.008 -1.492 1.647
108 HG2 ARG 12 1HG ARG 12 8.689 -0.523 4.213
109 HG3 ARG 12 2HG ARG 12 10.407 -0.732 3.887
110 HD2 ARG 12 1HD ARG 12 10.236 1.087 2.141
111 HD3 ARG 12 2HD ARG 12 8.556 1.339 2.676
112 HE ARG 12 HE ARG 12 10.513 1.440 4.830
113 HH11 ARG 12 1HH1 ARG 12 8.733 3.409 2.458
114 HH12 ARG 12 2HH1 ARG 12 9.120 4.885 3.278
115 HH21 ARG 12 1HH2 ARG 12 10.898 3.393 5.868
116 HH22 ARG 12 2HH2 ARG 12 10.298 4.877 5.197
117 H ASP 13 H ASP 13 6.858 -2.698 3.275
118 HA ASP 13 HA ASP 13 4.176 -1.908 3.194
119 HB2 ASP 13 1HB ASP 13 5.609 -3.086 5.601
120 HB3 ASP 13 2HB ASP 13 3.887 -3.185 5.247
121 H SER 14 H SER 14 6.754 -0.413 5.091
122 HA SER 14 HA SER 14 5.225 1.082 6.949
123 HB2 SER 14 1HB SER 14 7.782 1.995 5.599
124 HB3 SER 14 2HB SER 14 7.217 2.413 7.218
125 HG SER 14 HG SER 14 7.625 0.277 7.866
126 H ASP 15 H ASP 15 5.476 1.589 3.491
127 HA ASP 15 HA ASP 15 4.638 4.424 3.553
128 HB2 ASP 15 1HB ASP 15 4.833 2.352 1.341
129 HB3 ASP 15 2HB ASP 15 4.371 4.027 1.083
130 H CYS 16 H CYS 16 3.086 1.353 3.853
131 HA CYS 16 HA CYS 16 0.590 2.225 2.537
132 HB2 CYS 16 1HB CYS 16 1.540 -0.504 3.459
133 HB3 CYS 16 2HB CYS 16 0.040 -0.167 2.621
134 HA PRO 17 HA PRO 17 -1.325 3.012 6.377
135 HB2 PRO 17 1HB PRO 17 -3.733 3.860 5.564
136 HB3 PRO 17 2HB PRO 17 -2.228 4.641 4.953
137 HG2 PRO 17 1HG PRO 17 -3.826 2.454 3.569
138 HG3 PRO 17 2HG PRO 17 -3.370 4.065 2.920
139 HD2 PRO 17 1HD PRO 17 -1.820 1.862 2.477
140 HD3 PRO 17 2HD PRO 17 -1.113 3.483 2.772
141 H GLY 18 H GLY 18 -2.859 2.288 7.928
142 HA2 GLY 18 1HA GLY 18 -4.236 0.779 9.028
143 HA3 GLY 18 2HA GLY 18 -4.976 0.468 7.450
144 H ALA 19 H ALA 19 -4.990 -1.603 6.967
145 HA ALA 19 HA ALA 19 -2.830 -3.439 7.887
146 HB1 ALA 19 3HB ALA 19 -4.409 -5.213 7.430
147 HB2 ALA 19 1HB ALA 19 -5.226 -3.971 8.389
148 HB3 ALA 19 2HB ALA 19 -5.528 -4.098 6.636
149 H CYS 20 H CYS 20 -3.046 -1.493 5.241
150 HA CYS 20 HA CYS 20 -2.711 -3.356 3.054
151 HB2 CYS 20 1HB CYS 20 -1.836 -0.464 3.312
152 HB3 CYS 20 2HB CYS 20 -1.710 -1.413 1.864
153 H ILE 21 H ILE 21 -0.924 -4.109 2.043
154 HA ILE 21 HA ILE 21 1.813 -3.650 3.200
155 HB ILE 21 HB ILE 21 2.357 -5.953 2.399
156 HG12 ILE 21 1HG1 ILE 21 -0.648 -6.449 2.272
157 HG13 ILE 21 2HG1 ILE 21 0.364 -6.191 0.852
158 HG21 ILE 21 1HG2 ILE 21 1.915 -5.381 4.784
159 HG22 ILE 21 2HG2 ILE 21 0.218 -5.862 4.569
160 HG23 ILE 21 3HG2 ILE 21 1.520 -7.058 4.401
161 HD11 ILE 21 3HD1 ILE 21 0.051 -8.557 1.152
162 HD12 ILE 21 1HD1 ILE 21 1.749 -8.171 1.498
163 HD13 ILE 21 2HD1 ILE 21 0.611 -8.486 2.830
164 H CYS 22 H CYS 22 3.541 -3.811 1.592
165 HA CYS 22 HA CYS 22 2.715 -2.452 -0.897
166 HB2 CYS 22 1HB CYS 22 4.675 -1.747 0.535
167 HB3 CYS 22 2HB CYS 22 5.504 -3.218 0.028
168 H ARG 23 H ARG 23 2.411 -3.431 -2.806
169 HA ARG 23 HA ARG 23 3.015 -6.332 -3.075
170 HB2 ARG 23 1HB ARG 23 1.245 -4.594 -4.821
171 HB3 ARG 23 2HB ARG 23 1.344 -6.350 -4.805
172 HG2 ARG 23 1HG ARG 23 0.139 -4.520 -2.707
173 HG3 ARG 23 2HG ARG 23 -0.674 -5.724 -3.693
174 HD2 ARG 23 1HD ARG 23 1.254 -6.235 -1.395
175 HD3 ARG 23 2HD ARG 23 -0.484 -6.484 -1.396
176 HE ARG 23 HE ARG 23 -0.166 -8.232 -3.135
177 HH11 ARG 23 1HH1 ARG 23 2.639 -7.559 -1.042
178 HH12 ARG 23 2HH1 ARG 23 3.249 -9.172 -1.232
179 HH21 ARG 23 1HH2 ARG 23 0.718 -10.259 -3.339
180 HH22 ARG 23 2HH2 ARG 23 2.194 -10.666 -2.520
181 H GLY 24 H GLY 24 3.537 -7.085 -5.330
182 HA2 GLY 24 1HA GLY 24 6.153 -6.190 -5.933
183 HA3 GLY 24 2HA GLY 24 5.211 -7.356 -6.886
184 H ASN 25 H ASN 25 3.173 -5.031 -7.305
185 HA ASN 25 HA ASN 25 4.379 -3.844 -9.682
186 HB2 ASN 25 1HB ASN 25 2.221 -2.870 -10.049
187 HB3 ASN 25 2HB ASN 25 2.010 -4.555 -9.597
188 HD21 ASN 25 1HD2 ASN 25 -0.174 -2.893 -9.455
189 HD22 ASN 25 2HD2 ASN 25 -0.561 -2.572 -7.773
190 H GLY 26 H GLY 26 4.596 -3.001 -6.397
191 HA2 GLY 26 1HA GLY 26 5.769 -1.197 -5.494
192 HA3 GLY 26 2HA GLY 26 5.607 -0.288 -7.016
193 H TYR 27 H TYR 27 2.686 -1.678 -5.693
194 HA TYR 27 HA TYR 27 1.917 0.902 -4.389
195 HB2 TYR 27 1HB TYR 27 0.355 -0.691 -6.465
196 HB3 TYR 27 2HB TYR 27 -0.402 0.431 -5.358
197 HD1 TYR 27 HD1 TYR 27 2.345 0.291 -7.939
198 HD2 TYR 27 HD2 TYR 27 -0.574 2.686 -5.879
199 HE1 TYR 27 HE1 TYR 27 3.025 2.260 -9.278
200 HE2 TYR 27 HE2 TYR 27 0.069 4.662 -7.245
201 HH TYR 27 HH TYR 27 1.412 5.450 -8.934
202 H CYS 28 H CYS 28 0.229 0.751 -2.848
203 HA CYS 28 HA CYS 28 0.456 -1.479 -1.039
204 HB2 CYS 28 1HB CYS 28 -1.348 0.968 -1.065
205 HB3 CYS 28 2HB CYS 28 -1.142 -0.084 0.331
206 H GLY 29 H GLY 29 -0.901 -3.120 -0.565
207 HA2 GLY 29 1HA GLY 29 -3.717 -3.211 -1.430
208 HA3 GLY 29 2HA GLY 29 -2.662 -4.349 -2.247
209 HN1 NH2 30 2HN NH2 30 -3.888 -6.411 0.452
210 HN2 NH2 30 1HN NH2 30 -4.302 -5.851 -1.157
Start of MODEL 18
1 H1 GLY 1 1H GLY 1 -9.188 -5.437 11.188
2 H2 GLY 1 2H GLY 1 -7.608 -5.847 11.057
3 H3 GLY 1 3H GLY 1 -8.072 -4.709 12.139
4 HA2 GLY 1 1HA GLY 1 -8.752 -3.210 10.394
5 HA3 GLY 1 2HA GLY 1 -7.037 -3.643 10.260
6 H VAL 2 H VAL 2 -8.392 -2.644 8.061
7 HA VAL 2 HA VAL 2 -8.273 -4.880 6.131
8 HB VAL 2 HB VAL 2 -10.637 -2.949 6.192
9 HG11 VAL 2 1HG1 VAL 2 -10.057 -3.555 3.897
10 HG12 VAL 2 2HG1 VAL 2 -9.999 -5.280 4.330
11 HG13 VAL 2 3HG1 VAL 2 -11.536 -4.390 4.354
12 HG21 VAL 2 3HG2 VAL 2 -12.076 -4.940 6.585
13 HG22 VAL 2 1HG2 VAL 2 -10.623 -5.938 6.800
14 HG23 VAL 2 2HG2 VAL 2 -11.001 -4.627 7.945
15 H CYS 3 H CYS 3 -7.331 -4.179 4.243
16 HA CYS 3 HA CYS 3 -6.351 -1.421 4.156
17 HB2 CYS 3 1HB CYS 3 -4.881 -3.240 3.482
18 HB3 CYS 3 2HB CYS 3 -6.019 -3.752 2.241
19 HA PRO 4 HA PRO 4 -10.117 -0.283 1.897
20 HB2 PRO 4 1HB PRO 4 -9.638 2.403 1.523
21 HB3 PRO 4 2HB PRO 4 -10.114 1.679 3.087
22 HG2 PRO 4 1HG PRO 4 -7.309 2.328 2.120
23 HG3 PRO 4 2HG PRO 4 -8.071 2.769 3.683
24 HD2 PRO 4 1HD PRO 4 -6.469 0.616 3.477
25 HD3 PRO 4 2HD PRO 4 -7.958 0.528 4.465
26 H LYS 5 H LYS 5 -10.684 0.949 -0.156
27 HA LYS 5 HA LYS 5 -9.318 -0.327 -2.355
28 HB2 LYS 5 1HB LYS 5 -11.704 1.568 -2.260
29 HB3 LYS 5 2HB LYS 5 -11.193 0.634 -3.673
30 HG2 LYS 5 1HG LYS 5 -11.560 -1.483 -2.428
31 HG3 LYS 5 2HG LYS 5 -12.146 -0.555 -1.033
32 HD2 LYS 5 1HD LYS 5 -13.957 0.411 -2.429
33 HD3 LYS 5 2HD LYS 5 -13.383 -0.535 -3.822
34 HE2 LYS 5 1HE LYS 5 -13.771 -2.637 -2.549
35 HE3 LYS 5 2HE LYS 5 -14.338 -1.697 -1.161
36 HZ1 LYS 5 3HZ LYS 5 -16.187 -2.504 -2.499
37 HZ2 LYS 5 1HZ LYS 5 -16.158 -0.872 -2.548
38 HZ3 LYS 5 2HZ LYS 5 -15.634 -1.742 -3.832
39 H ILE 6 H ILE 6 -7.606 1.560 -1.158
40 HA ILE 6 HA ILE 6 -7.341 3.941 -2.899
41 HB ILE 6 HB ILE 6 -5.366 4.451 -1.534
42 HG12 ILE 6 1HG1 ILE 6 -5.909 1.879 0.018
43 HG13 ILE 6 2HG1 ILE 6 -4.599 2.093 -1.141
44 HG21 ILE 6 1HG2 ILE 6 -7.645 5.134 -0.825
45 HG22 ILE 6 2HG2 ILE 6 -7.752 3.691 0.201
46 HG23 ILE 6 3HG2 ILE 6 -6.539 4.942 0.535
47 HD11 ILE 6 3HD1 ILE 6 -3.706 2.378 1.057
48 HD12 ILE 6 1HD1 ILE 6 -3.696 3.962 0.259
49 HD13 ILE 6 2HD1 ILE 6 -4.934 3.580 1.484
50 H LEU 7 H LEU 7 -5.201 4.442 -3.874
51 HA LEU 7 HA LEU 7 -3.570 2.121 -4.701
52 HB2 LEU 7 1HB LEU 7 -5.255 2.546 -6.509
53 HB3 LEU 7 2HB LEU 7 -4.653 4.193 -6.657
54 HG LEU 7 HG LEU 7 -2.410 3.276 -7.321
55 HD11 LEU 7 1HD1 LEU 7 -2.516 1.027 -6.272
56 HD12 LEU 7 2HD1 LEU 7 -3.862 0.584 -7.343
57 HD13 LEU 7 3HD1 LEU 7 -2.245 0.893 -8.011
58 HD21 LEU 7 3HD2 LEU 7 -3.097 2.590 -9.581
59 HD22 LEU 7 1HD2 LEU 7 -4.759 2.323 -9.009
60 HD23 LEU 7 2HD2 LEU 7 -4.064 3.959 -9.009
61 H LYS 8 H LYS 8 -2.175 2.843 -3.125
62 HA LYS 8 HA LYS 8 -0.804 5.482 -3.500
63 HB2 LYS 8 1HB LYS 8 -1.953 5.036 -1.299
64 HB3 LYS 8 2HB LYS 8 -0.882 3.647 -1.049
65 HG2 LYS 8 1HG LYS 8 1.090 5.208 -1.203
66 HG3 LYS 8 2HG LYS 8 -0.038 6.564 -1.393
67 HD2 LYS 8 1HD LYS 8 -0.984 5.967 0.881
68 HD3 LYS 8 2HD LYS 8 0.307 4.740 1.013
69 HE2 LYS 8 1HE LYS 8 2.003 6.563 0.608
70 HE3 LYS 8 2HE LYS 8 0.691 7.749 0.618
71 HZ1 LYS 8 3HZ LYS 8 1.735 7.632 2.775
72 HZ2 LYS 8 1HZ LYS 8 0.216 7.050 2.928
73 HZ3 LYS 8 2HZ LYS 8 1.505 6.018 2.887
74 H LYS 9 H LYS 9 1.285 5.404 -4.303
75 HA LYS 9 HA LYS 9 2.554 2.857 -4.864
76 HB2 LYS 9 1HB LYS 9 4.415 4.191 -5.739
77 HB3 LYS 9 2HB LYS 9 2.851 4.668 -6.394
78 HG2 LYS 9 1HG LYS 9 2.738 6.561 -4.829
79 HG3 LYS 9 2HG LYS 9 4.322 6.109 -4.167
80 HD2 LYS 9 1HD LYS 9 5.408 6.553 -6.302
81 HD3 LYS 9 2HD LYS 9 3.838 6.757 -7.116
82 HE2 LYS 9 1HE LYS 9 3.329 8.715 -5.725
83 HE3 LYS 9 2HE LYS 9 4.862 8.533 -4.857
84 HZ1 LYS 9 3HZ LYS 9 5.032 10.195 -6.611
85 HZ2 LYS 9 1HZ LYS 9 6.022 8.944 -6.958
86 HZ3 LYS 9 2HZ LYS 9 4.605 9.115 -7.758
87 H CYS 10 H CYS 10 4.634 2.145 -4.182
88 HA CYS 10 HA CYS 10 5.724 3.067 -1.594
89 HB2 CYS 10 1HB CYS 10 5.215 0.970 -0.404
90 HB3 CYS 10 2HB CYS 10 3.759 1.823 -0.886
91 H ARG 11 H ARG 11 7.549 2.061 -0.871
92 HA ARG 11 HA ARG 11 9.065 0.285 -2.741
93 HB2 ARG 11 1HB ARG 11 10.156 2.431 -2.305
94 HB3 ARG 11 2HB ARG 11 9.966 2.227 -0.565
95 HG2 ARG 11 1HG ARG 11 12.270 1.809 -1.272
96 HG3 ARG 11 2HG ARG 11 11.556 0.381 -0.540
97 HD2 ARG 11 1HD ARG 11 11.115 -0.499 -2.909
98 HD3 ARG 11 2HD ARG 11 11.992 0.904 -3.513
99 HE ARG 11 HE ARG 11 13.994 -0.050 -2.865
100 HH11 ARG 11 1HH1 ARG 11 11.412 -1.971 -1.337
101 HH12 ARG 11 2HH1 ARG 11 12.520 -3.239 -0.898
102 HH21 ARG 11 1HH2 ARG 11 15.341 -1.715 -2.234
103 HH22 ARG 11 2HH2 ARG 11 14.707 -3.088 -1.379
104 H ARG 12 H ARG 12 7.645 0.632 0.458
105 HA ARG 12 HA ARG 12 7.791 -2.204 1.024
106 HB2 ARG 12 1HB ARG 12 9.092 -2.001 3.129
107 HB3 ARG 12 2HB ARG 12 10.072 -1.581 1.734
108 HG2 ARG 12 1HG ARG 12 9.782 0.828 2.200
109 HG3 ARG 12 2HG ARG 12 8.708 0.456 3.562
110 HD2 ARG 12 1HD ARG 12 10.542 -0.710 4.713
111 HD3 ARG 12 2HD ARG 12 11.628 -0.382 3.344
112 HE ARG 12 HE ARG 12 10.632 2.108 4.102
113 HH11 ARG 12 1HH1 ARG 12 12.584 -0.380 5.689
114 HH12 ARG 12 2HH1 ARG 12 13.387 0.771 6.715
115 HH21 ARG 12 1HH2 ARG 12 11.702 3.543 5.457
116 HH22 ARG 12 2HH2 ARG 12 12.893 2.964 6.580
117 H ASP 13 H ASP 13 6.942 -2.644 3.305
118 HA ASP 13 HA ASP 13 4.264 -1.802 3.265
119 HB2 ASP 13 1HB ASP 13 5.748 -2.962 5.655
120 HB3 ASP 13 2HB ASP 13 4.013 -3.032 5.358
121 H SER 14 H SER 14 6.952 -0.406 5.088
122 HA SER 14 HA SER 14 5.560 1.195 6.948
123 HB2 SER 14 1HB SER 14 8.152 1.900 5.524
124 HB3 SER 14 2HB SER 14 7.611 2.457 7.115
125 HG SER 14 HG SER 14 9.091 0.769 7.366
126 H ASP 15 H ASP 15 5.698 1.632 3.485
127 HA ASP 15 HA ASP 15 5.030 4.514 3.535
128 HB2 ASP 15 1HB ASP 15 4.913 2.467 1.293
129 HB3 ASP 15 2HB ASP 15 4.749 4.207 1.109
130 H CYS 16 H CYS 16 3.341 1.486 3.783
131 HA CYS 16 HA CYS 16 0.861 2.486 2.556
132 HB2 CYS 16 1HB CYS 16 1.622 -0.269 3.579
133 HB3 CYS 16 2HB CYS 16 0.160 0.148 2.709
134 HA PRO 17 HA PRO 17 -0.859 3.560 6.395
135 HB2 PRO 17 1HB PRO 17 -3.262 4.482 5.647
136 HB3 PRO 17 2HB PRO 17 -1.743 5.167 4.957
137 HG2 PRO 17 1HG PRO 17 -3.510 3.039 3.699
138 HG3 PRO 17 2HG PRO 17 -2.972 4.596 2.983
139 HD2 PRO 17 1HD PRO 17 -1.587 2.271 2.578
140 HD3 PRO 17 2HD PRO 17 -0.773 3.854 2.742
141 H GLY 18 H GLY 18 -2.164 2.845 8.088
142 HA2 GLY 18 1HA GLY 18 -3.485 1.412 9.343
143 HA3 GLY 18 2HA GLY 18 -4.460 1.216 7.881
144 H ALA 19 H ALA 19 -4.754 -0.828 7.404
145 HA ALA 19 HA ALA 19 -2.848 -2.944 8.174
146 HB1 ALA 19 3HB ALA 19 -4.699 -4.430 7.545
147 HB2 ALA 19 1HB ALA 19 -5.281 -3.140 8.611
148 HB3 ALA 19 2HB ALA 19 -5.594 -3.061 6.859
149 H CYS 20 H CYS 20 -2.965 -0.960 5.454
150 HA CYS 20 HA CYS 20 -2.661 -2.905 3.339
151 HB2 CYS 20 1HB CYS 20 -1.766 -0.010 3.480
152 HB3 CYS 20 2HB CYS 20 -1.727 -0.991 2.056
153 H ILE 21 H ILE 21 -0.918 -3.675 2.291
154 HA ILE 21 HA ILE 21 1.843 -3.300 3.407
155 HB ILE 21 HB ILE 21 2.255 -5.684 2.741
156 HG12 ILE 21 1HG1 ILE 21 -0.770 -6.038 2.740
157 HG13 ILE 21 2HG1 ILE 21 0.195 -5.905 1.271
158 HG21 ILE 21 1HG2 ILE 21 1.918 -4.933 5.092
159 HG22 ILE 21 2HG2 ILE 21 0.192 -5.329 4.956
160 HG23 ILE 21 3HG2 ILE 21 1.420 -6.606 4.833
161 HD11 ILE 21 3HD1 ILE 21 -0.210 -8.235 1.725
162 HD12 ILE 21 1HD1 ILE 21 1.517 -7.906 1.966
163 HD13 ILE 21 2HD1 ILE 21 0.435 -8.093 3.368
164 H CYS 22 H CYS 22 3.545 -3.651 1.780
165 HA CYS 22 HA CYS 22 2.729 -2.380 -0.754
166 HB2 CYS 22 1HB CYS 22 4.785 -1.748 0.600
167 HB3 CYS 22 2HB CYS 22 5.501 -3.276 0.099
168 H ARG 23 H ARG 23 2.455 -3.383 -2.677
169 HA ARG 23 HA ARG 23 2.912 -6.335 -2.829
170 HB2 ARG 23 1HB ARG 23 1.072 -4.659 -4.554
171 HB3 ARG 23 2HB ARG 23 1.140 -6.411 -4.431
172 HG2 ARG 23 1HG ARG 23 0.056 -4.422 -2.426
173 HG3 ARG 23 2HG ARG 23 -0.803 -5.699 -3.268
174 HD2 ARG 23 1HD ARG 23 1.179 -6.000 -0.982
175 HD3 ARG 23 2HD ARG 23 -0.550 -6.280 -0.946
176 HE ARG 23 HE ARG 23 -0.233 -8.185 -2.483
177 HH11 ARG 23 1HH1 ARG 23 2.707 -7.212 -0.688
178 HH12 ARG 23 2HH1 ARG 23 3.282 -8.848 -0.645
179 HH21 ARG 23 1HH2 ARG 23 0.651 -10.218 -2.435
180 HH22 ARG 23 2HH2 ARG 23 2.176 -10.503 -1.656
181 H GLY 24 H GLY 24 3.290 -7.177 -5.072
182 HA2 GLY 24 1HA GLY 24 5.876 -6.340 -5.861
183 HA3 GLY 24 2HA GLY 24 4.870 -7.535 -6.704
184 H ASN 25 H ASN 25 2.838 -5.194 -7.100
185 HA ASN 25 HA ASN 25 3.903 -4.134 -9.598
186 HB2 ASN 25 1HB ASN 25 1.747 -3.115 -9.853
187 HB3 ASN 25 2HB ASN 25 1.529 -4.774 -9.319
188 HD21 ASN 25 1HD2 ASN 25 -0.607 -3.076 -9.088
189 HD22 ASN 25 2HD2 ASN 25 -0.863 -2.669 -7.399
190 H GLY 26 H GLY 26 4.375 -3.165 -6.377
191 HA2 GLY 26 1HA GLY 26 5.662 -1.362 -5.638
192 HA3 GLY 26 2HA GLY 26 5.415 -0.512 -7.183
193 H TYR 27 H TYR 27 2.553 -1.753 -5.619
194 HA TYR 27 HA TYR 27 1.951 0.894 -4.360
195 HB2 TYR 27 1HB TYR 27 0.235 -0.695 -6.313
196 HB3 TYR 27 2HB TYR 27 -0.442 0.459 -5.186
197 HD1 TYR 27 HD1 TYR 27 2.138 0.208 -7.918
198 HD2 TYR 27 HD2 TYR 27 -0.560 2.723 -5.700
199 HE1 TYR 27 HE1 TYR 27 2.790 2.135 -9.327
200 HE2 TYR 27 HE2 TYR 27 0.062 4.663 -7.138
201 HH TYR 27 HH TYR 27 2.435 4.355 -9.809
202 H CYS 28 H CYS 28 0.327 0.851 -2.748
203 HA CYS 28 HA CYS 28 0.527 -1.336 -0.881
204 HB2 CYS 28 1HB CYS 28 -1.159 1.196 -0.919
205 HB3 CYS 28 2HB CYS 28 -0.956 0.169 0.500
206 H GLY 29 H GLY 29 -0.838 -2.954 -0.417
207 HA2 GLY 29 1HA GLY 29 -3.694 -2.957 -1.227
208 HA3 GLY 29 2HA GLY 29 -2.667 -4.184 -1.949
209 HN1 NH2 30 2HN NH2 30 -3.971 -6.014 0.870
210 HN2 NH2 30 1HN NH2 30 -4.360 -5.554 -0.776
Start of MODEL 19
1 H1 GLY 1 1H GLY 1 -9.175 -4.156 12.070
2 H2 GLY 1 2H GLY 1 -7.819 -5.061 11.924
3 H3 GLY 1 3H GLY 1 -7.830 -3.757 12.914
4 HA2 GLY 1 1HA GLY 1 -8.098 -2.253 11.067
5 HA3 GLY 1 2HA GLY 1 -6.626 -3.230 10.909
6 H VAL 2 H VAL 2 -7.398 -2.152 8.624
7 HA VAL 2 HA VAL 2 -8.064 -4.358 6.900
8 HB VAL 2 HB VAL 2 -10.356 -3.710 7.628
9 HG11 VAL 2 1HG1 VAL 2 -10.011 -1.277 7.995
10 HG12 VAL 2 2HG1 VAL 2 -9.865 -1.043 6.239
11 HG13 VAL 2 3HG1 VAL 2 -11.389 -1.616 6.938
12 HG21 VAL 2 3HG2 VAL 2 -11.396 -3.687 5.477
13 HG22 VAL 2 1HG2 VAL 2 -9.938 -3.061 4.697
14 HG23 VAL 2 2HG2 VAL 2 -9.947 -4.703 5.385
15 H CYS 3 H CYS 3 -7.623 -3.820 4.677
16 HA CYS 3 HA CYS 3 -5.922 -1.412 4.343
17 HB2 CYS 3 1HB CYS 3 -4.992 -3.494 3.565
18 HB3 CYS 3 2HB CYS 3 -6.419 -3.857 2.615
19 HA PRO 4 HA PRO 4 -9.674 0.536 2.649
20 HB2 PRO 4 1HB PRO 4 -7.723 2.714 1.933
21 HB3 PRO 4 2HB PRO 4 -9.324 2.844 2.717
22 HG2 PRO 4 1HG PRO 4 -7.054 3.050 4.185
23 HG3 PRO 4 2HG PRO 4 -8.442 2.093 4.806
24 HD2 PRO 4 1HD PRO 4 -5.948 1.100 3.406
25 HD3 PRO 4 2HD PRO 4 -6.731 0.491 4.894
26 H LYS 5 H LYS 5 -10.414 1.389 0.552
27 HA LYS 5 HA LYS 5 -9.440 -0.222 -1.650
28 HB2 LYS 5 1HB LYS 5 -11.691 1.825 -1.443
29 HB3 LYS 5 2HB LYS 5 -11.413 0.749 -2.818
30 HG2 LYS 5 1HG LYS 5 -11.742 -1.235 -1.376
31 HG3 LYS 5 2HG LYS 5 -12.010 -0.189 0.021
32 HD2 LYS 5 1HD LYS 5 -14.140 -0.936 -0.788
33 HD3 LYS 5 2HD LYS 5 -13.998 0.802 -1.088
34 HE2 LYS 5 1HE LYS 5 -13.421 0.347 -3.465
35 HE3 LYS 5 2HE LYS 5 -13.500 -1.394 -3.158
36 HZ1 LYS 5 3HZ LYS 5 -15.555 -0.568 -4.132
37 HZ2 LYS 5 1HZ LYS 5 -15.858 -1.124 -2.627
38 HZ3 LYS 5 2HZ LYS 5 -15.783 0.487 -2.906
39 H ILE 6 H ILE 6 -7.540 1.757 -0.836
40 HA ILE 6 HA ILE 6 -7.427 3.880 -2.900
41 HB ILE 6 HB ILE 6 -5.362 4.588 -1.676
42 HG12 ILE 6 1HG1 ILE 6 -4.961 3.785 0.609
43 HG13 ILE 6 2HG1 ILE 6 -6.066 2.441 0.378
44 HG21 ILE 6 1HG2 ILE 6 -7.593 5.514 -1.215
45 HG22 ILE 6 2HG2 ILE 6 -7.858 4.285 0.039
46 HG23 ILE 6 3HG2 ILE 6 -6.574 5.494 0.229
47 HD11 ILE 6 3HD1 ILE 6 -3.625 1.875 0.215
48 HD12 ILE 6 1HD1 ILE 6 -4.561 1.390 -1.200
49 HD13 ILE 6 2HD1 ILE 6 -3.536 2.848 -1.264
50 H LEU 7 H LEU 7 -5.221 4.310 -3.882
51 HA LEU 7 HA LEU 7 -3.651 1.905 -4.551
52 HB2 LEU 7 1HB LEU 7 -5.318 2.175 -6.387
53 HB3 LEU 7 2HB LEU 7 -4.755 3.822 -6.650
54 HG LEU 7 HG LEU 7 -2.503 2.933 -7.276
55 HD11 LEU 7 1HD1 LEU 7 -2.505 0.780 -6.041
56 HD12 LEU 7 2HD1 LEU 7 -3.837 0.192 -7.055
57 HD13 LEU 7 3HD1 LEU 7 -2.240 0.513 -7.766
58 HD21 LEU 7 3HD2 LEU 7 -3.181 2.036 -9.463
59 HD22 LEU 7 1HD2 LEU 7 -4.824 1.748 -8.849
60 HD23 LEU 7 2HD2 LEU 7 -4.200 3.406 -8.992
61 H LYS 8 H LYS 8 -2.141 2.652 -3.155
62 HA LYS 8 HA LYS 8 -0.896 5.344 -3.579
63 HB2 LYS 8 1HB LYS 8 -2.020 4.817 -1.367
64 HB3 LYS 8 2HB LYS 8 -0.839 3.521 -1.119
65 HG2 LYS 8 1HG LYS 8 0.992 5.259 -1.296
66 HG3 LYS 8 2HG LYS 8 -0.259 6.506 -1.457
67 HD2 LYS 8 1HD LYS 8 -1.128 5.834 0.807
68 HD3 LYS 8 2HD LYS 8 0.220 4.671 0.923
69 HE2 LYS 8 1HE LYS 8 1.832 6.569 0.576
70 HE3 LYS 8 2HE LYS 8 0.469 7.699 0.581
71 HZ1 LYS 8 3HZ LYS 8 1.501 7.573 2.757
72 HZ2 LYS 8 1HZ LYS 8 -0.012 6.967 2.869
73 HZ3 LYS 8 2HZ LYS 8 1.287 5.952 2.837
74 H LYS 9 H LYS 9 1.274 5.431 -4.201
75 HA LYS 9 HA LYS 9 2.651 2.982 -4.926
76 HB2 LYS 9 1HB LYS 9 2.852 5.405 -5.905
77 HB3 LYS 9 2HB LYS 9 4.007 5.647 -4.576
78 HG2 LYS 9 1HG LYS 9 5.356 3.726 -5.447
79 HG3 LYS 9 2HG LYS 9 4.234 3.581 -6.802
80 HD2 LYS 9 1HD LYS 9 5.935 6.025 -6.129
81 HD3 LYS 9 2HD LYS 9 6.326 4.807 -7.349
82 HE2 LYS 9 1HE LYS 9 4.262 5.373 -8.601
83 HE3 LYS 9 2HE LYS 9 3.855 6.603 -7.393
84 HZ1 LYS 9 3HZ LYS 9 4.960 7.585 -9.308
85 HZ2 LYS 9 1HZ LYS 9 5.904 7.771 -7.989
86 HZ3 LYS 9 2HZ LYS 9 6.277 6.639 -9.111
87 H CYS 10 H CYS 10 4.739 2.357 -4.119
88 HA CYS 10 HA CYS 10 5.601 3.084 -1.404
89 HB2 CYS 10 1HB CYS 10 5.128 0.919 -0.347
90 HB3 CYS 10 2HB CYS 10 3.662 1.723 -0.873
91 H ARG 11 H ARG 11 7.418 2.096 -0.621
92 HA ARG 11 HA ARG 11 9.104 0.459 -2.488
93 HB2 ARG 11 1HB ARG 11 9.951 2.236 -0.153
94 HB3 ARG 11 2HB ARG 11 11.025 1.318 -1.205
95 HG2 ARG 11 1HG ARG 11 9.292 3.691 -2.026
96 HG3 ARG 11 2HG ARG 11 11.039 3.684 -1.786
97 HD2 ARG 11 1HD ARG 11 11.289 2.066 -3.662
98 HD3 ARG 11 2HD ARG 11 9.534 2.133 -3.934
99 HE ARG 11 HE ARG 11 10.590 4.783 -3.940
100 HH11 ARG 11 1HH1 ARG 11 10.603 1.917 -6.017
101 HH12 ARG 11 2HH1 ARG 11 10.824 2.853 -7.466
102 HH21 ARG 11 1HH2 ARG 11 10.876 5.933 -5.845
103 HH22 ARG 11 2HH2 ARG 11 10.978 5.099 -7.366
104 H ARG 12 H ARG 12 7.553 0.690 0.649
105 HA ARG 12 HA ARG 12 7.731 -2.156 1.110
106 HB2 ARG 12 1HB ARG 12 8.877 -2.031 3.304
107 HB3 ARG 12 2HB ARG 12 9.943 -1.524 2.006
108 HG2 ARG 12 1HG ARG 12 9.622 0.847 2.586
109 HG3 ARG 12 2HG ARG 12 8.385 0.422 3.770
110 HD2 ARG 12 1HD ARG 12 10.415 0.901 4.947
111 HD3 ARG 12 2HD ARG 12 10.067 -0.829 5.093
112 HE ARG 12 HE ARG 12 11.810 -0.290 2.848
113 HH11 ARG 12 1HH1 ARG 12 11.919 -0.523 6.376
114 HH12 ARG 12 2HH1 ARG 12 13.606 -0.948 6.390
115 HH21 ARG 12 1HH2 ARG 12 13.984 -0.856 2.933
116 HH22 ARG 12 2HH2 ARG 12 14.756 -1.128 4.464
117 H ASP 13 H ASP 13 6.758 -2.689 3.335
118 HA ASP 13 HA ASP 13 4.063 -1.911 3.188
119 HB2 ASP 13 1HB ASP 13 5.474 -3.074 5.622
120 HB3 ASP 13 2HB ASP 13 3.755 -3.187 5.246
121 H SER 14 H SER 14 6.643 -0.484 5.121
122 HA SER 14 HA SER 14 5.197 1.038 7.001
123 HB2 SER 14 1HB SER 14 7.733 1.922 5.583
124 HB3 SER 14 2HB SER 14 7.227 2.313 7.229
125 HG SER 14 HG SER 14 7.624 0.167 7.823
126 H ASP 15 H ASP 15 5.391 1.571 3.543
127 HA ASP 15 HA ASP 15 4.635 4.428 3.662
128 HB2 ASP 15 1HB ASP 15 4.695 2.458 1.346
129 HB3 ASP 15 2HB ASP 15 4.490 4.199 1.214
130 H CYS 16 H CYS 16 3.015 1.363 3.744
131 HA CYS 16 HA CYS 16 0.608 2.294 2.352
132 HB2 CYS 16 1HB CYS 16 1.397 -0.422 3.448
133 HB3 CYS 16 2HB CYS 16 -0.030 -0.072 2.493
134 HA PRO 17 HA PRO 17 -1.552 3.349 5.960
135 HB2 PRO 17 1HB PRO 17 -3.931 4.069 4.951
136 HB3 PRO 17 2HB PRO 17 -2.404 4.837 4.378
137 HG2 PRO 17 1HG PRO 17 -3.896 2.544 3.052
138 HG3 PRO 17 2HG PRO 17 -3.385 4.106 2.326
139 HD2 PRO 17 1HD PRO 17 -1.832 1.859 2.158
140 HD3 PRO 17 2HD PRO 17 -1.140 3.500 2.318
141 H GLY 18 H GLY 18 -3.078 2.675 7.531
142 HA2 GLY 18 1HA GLY 18 -4.402 1.171 8.711
143 HA3 GLY 18 2HA GLY 18 -5.097 0.702 7.151
144 H ALA 19 H ALA 19 -5.006 -1.419 6.910
145 HA ALA 19 HA ALA 19 -2.634 -2.986 7.822
146 HB1 ALA 19 3HB ALA 19 -4.070 -4.919 7.694
147 HB2 ALA 19 1HB ALA 19 -4.921 -3.657 8.596
148 HB3 ALA 19 2HB ALA 19 -5.351 -3.998 6.897
149 H CYS 20 H CYS 20 -3.089 -1.289 5.118
150 HA CYS 20 HA CYS 20 -2.774 -3.222 2.988
151 HB2 CYS 20 1HB CYS 20 -1.924 -0.321 3.166
152 HB3 CYS 20 2HB CYS 20 -1.813 -1.290 1.734
153 H ILE 21 H ILE 21 -0.990 -3.955 1.934
154 HA ILE 21 HA ILE 21 1.734 -3.582 3.144
155 HB ILE 21 HB ILE 21 2.197 -5.931 2.404
156 HG12 ILE 21 1HG1 ILE 21 -0.824 -6.318 2.289
157 HG13 ILE 21 2HG1 ILE 21 0.184 -6.117 0.858
158 HG21 ILE 21 1HG2 ILE 21 1.770 -5.272 4.766
159 HG22 ILE 21 2HG2 ILE 21 0.054 -5.677 4.556
160 HG23 ILE 21 3HG2 ILE 21 1.297 -6.938 4.430
161 HD11 ILE 21 3HD1 ILE 21 -0.204 -8.467 1.210
162 HD12 ILE 21 1HD1 ILE 21 1.510 -8.127 1.516
163 HD13 ILE 21 2HD1 ILE 21 0.387 -8.381 2.876
164 H CYS 22 H CYS 22 3.493 -3.787 1.612
165 HA CYS 22 HA CYS 22 2.780 -2.477 -0.933
166 HB2 CYS 22 1HB CYS 22 4.729 -1.813 0.556
167 HB3 CYS 22 2HB CYS 22 5.524 -3.304 0.074
168 H ARG 23 H ARG 23 2.610 -3.452 -2.876
169 HA ARG 23 HA ARG 23 3.198 -6.375 -3.083
170 HB2 ARG 23 1HB ARG 23 1.387 -4.720 -4.857
171 HB3 ARG 23 2HB ARG 23 1.515 -6.471 -4.777
172 HG2 ARG 23 1HG ARG 23 0.251 -4.580 -2.780
173 HG3 ARG 23 2HG ARG 23 -0.510 -5.866 -3.700
174 HD2 ARG 23 1HD ARG 23 1.363 -6.153 -1.322
175 HD3 ARG 23 2HD ARG 23 -0.354 -6.497 -1.382
176 HE ARG 23 HE ARG 23 0.115 -8.347 -2.947
177 HH11 ARG 23 1HH1 ARG 23 2.919 -7.314 -0.979
178 HH12 ARG 23 2HH1 ARG 23 3.558 -8.927 -0.950
179 HH21 ARG 23 1HH2 ARG 23 1.074 -10.346 -2.907
180 HH22 ARG 23 2HH2 ARG 23 2.569 -10.594 -2.059
181 H GLY 24 H GLY 24 3.712 -7.138 -5.334
182 HA2 GLY 24 1HA GLY 24 6.307 -6.197 -5.964
183 HA3 GLY 24 2HA GLY 24 5.383 -7.393 -6.895
184 H ASN 25 H ASN 25 3.301 -5.104 -7.318
185 HA ASN 25 HA ASN 25 4.457 -3.921 -9.721
186 HB2 ASN 25 1HB ASN 25 2.277 -2.975 -10.059
187 HB3 ASN 25 2HB ASN 25 2.102 -4.661 -9.598
188 HD21 ASN 25 1HD2 ASN 25 -0.117 -3.070 -9.420
189 HD22 ASN 25 2HD2 ASN 25 -0.476 -2.735 -7.734
190 H GLY 26 H GLY 26 4.765 -3.063 -6.463
191 HA2 GLY 26 1HA GLY 26 5.929 -1.236 -5.593
192 HA3 GLY 26 2HA GLY 26 5.711 -0.336 -7.114
193 H TYR 27 H TYR 27 2.829 -1.753 -5.767
194 HA TYR 27 HA TYR 27 2.067 0.805 -4.434
195 HB2 TYR 27 1HB TYR 27 0.583 -0.704 -6.594
196 HB3 TYR 27 2HB TYR 27 -0.276 0.261 -5.420
197 HD1 TYR 27 HD1 TYR 27 2.519 0.523 -7.937
198 HD2 TYR 27 HD2 TYR 27 -0.614 2.521 -5.769
199 HE1 TYR 27 HE1 TYR 27 2.988 2.601 -9.194
200 HE2 TYR 27 HE2 TYR 27 -0.189 4.604 -7.055
201 HH TYR 27 HH TYR 27 2.294 4.757 -9.640
202 H CYS 28 H CYS 28 0.393 0.719 -2.938
203 HA CYS 28 HA CYS 28 0.533 -1.501 -1.104
204 HB2 CYS 28 1HB CYS 28 -1.197 0.999 -1.174
205 HB3 CYS 28 2HB CYS 28 -1.035 -0.052 0.233
206 H GLY 29 H GLY 29 -0.805 -3.168 -0.778
207 HA2 GLY 29 1HA GLY 29 -3.629 -3.177 -1.727
208 HA3 GLY 29 2HA GLY 29 -2.549 -4.416 -2.354
209 HN1 NH2 30 2HN NH2 30 -4.086 -6.146 0.428
210 HN2 NH2 30 1HN NH2 30 -4.402 -5.687 -1.234
Start of MODEL 20
1 H1 GLY 1 1H GLY 1 -9.443 -4.115 11.792
2 H2 GLY 1 2H GLY 1 -7.923 -4.723 11.815
3 H3 GLY 1 3H GLY 1 -8.285 -3.387 12.690
4 HA2 GLY 1 1HA GLY 1 -8.695 -2.101 10.709
5 HA3 GLY 1 2HA GLY 1 -7.045 -2.755 10.737
6 H VAL 2 H VAL 2 -7.867 -2.009 8.329
7 HA VAL 2 HA VAL 2 -7.874 -4.403 6.738
8 HB VAL 2 HB VAL 2 -10.288 -4.333 7.249
9 HG11 VAL 2 1HG1 VAL 2 -10.605 -1.883 7.544
10 HG12 VAL 2 2HG1 VAL 2 -10.401 -1.659 5.791
11 HG13 VAL 2 3HG1 VAL 2 -11.770 -2.593 6.418
12 HG21 VAL 2 3HG2 VAL 2 -11.143 -4.616 5.035
13 HG22 VAL 2 1HG2 VAL 2 -9.833 -3.658 4.330
14 HG23 VAL 2 2HG2 VAL 2 -9.483 -5.234 5.080
15 H CYS 3 H CYS 3 -7.290 -3.959 4.579
16 HA CYS 3 HA CYS 3 -6.192 -1.259 4.147
17 HB2 CYS 3 1HB CYS 3 -4.847 -3.222 3.576
18 HB3 CYS 3 2HB CYS 3 -6.076 -3.765 2.439
19 HA PRO 4 HA PRO 4 -10.105 -0.315 2.011
20 HB2 PRO 4 1HB PRO 4 -9.682 2.340 1.455
21 HB3 PRO 4 2HB PRO 4 -10.073 1.719 3.085
22 HG2 PRO 4 1HG PRO 4 -7.328 2.342 1.949
23 HG3 PRO 4 2HG PRO 4 -8.024 2.872 3.514
24 HD2 PRO 4 1HD PRO 4 -6.388 0.727 3.344
25 HD3 PRO 4 2HD PRO 4 -7.803 0.703 4.441
26 H LYS 5 H LYS 5 -10.739 0.728 -0.125
27 HA LYS 5 HA LYS 5 -9.317 -0.628 -2.251
28 HB2 LYS 5 1HB LYS 5 -11.817 1.117 -2.251
29 HB3 LYS 5 2HB LYS 5 -11.247 0.146 -3.617
30 HG2 LYS 5 1HG LYS 5 -11.457 -1.921 -2.250
31 HG3 LYS 5 2HG LYS 5 -12.118 -0.960 -0.912
32 HD2 LYS 5 1HD LYS 5 -13.990 -0.219 -2.360
33 HD3 LYS 5 2HD LYS 5 -13.336 -1.190 -3.699
34 HE2 LYS 5 1HE LYS 5 -13.563 -3.246 -2.313
35 HE3 LYS 5 2HE LYS 5 -14.219 -2.279 -0.983
36 HZ1 LYS 5 3HZ LYS 5 -15.983 -3.305 -2.285
37 HZ2 LYS 5 1HZ LYS 5 -16.085 -1.682 -2.426
38 HZ3 LYS 5 2HZ LYS 5 -15.478 -2.575 -3.656
39 H ILE 6 H ILE 6 -7.688 1.376 -1.201
40 HA ILE 6 HA ILE 6 -7.536 3.666 -3.075
41 HB ILE 6 HB ILE 6 -5.564 4.323 -1.765
42 HG12 ILE 6 1HG1 ILE 6 -6.006 1.818 -0.078
43 HG13 ILE 6 2HG1 ILE 6 -4.700 2.037 -1.240
44 HG21 ILE 6 1HG2 ILE 6 -7.850 4.984 -1.079
45 HG22 ILE 6 2HG2 ILE 6 -7.919 3.598 0.025
46 HG23 ILE 6 3HG2 ILE 6 -6.737 4.897 0.286
47 HD11 ILE 6 3HD1 ILE 6 -3.829 2.454 0.941
48 HD12 ILE 6 1HD1 ILE 6 -3.888 4.004 0.083
49 HD13 ILE 6 2HD1 ILE 6 -5.109 3.616 1.321
50 H LEU 7 H LEU 7 -5.440 4.182 -4.118
51 HA LEU 7 HA LEU 7 -3.725 1.877 -4.813
52 HB2 LEU 7 1HB LEU 7 -5.411 2.128 -6.638
53 HB3 LEU 7 2HB LEU 7 -4.901 3.796 -6.869
54 HG LEU 7 HG LEU 7 -2.627 2.995 -7.520
55 HD11 LEU 7 1HD1 LEU 7 -2.540 0.820 -6.326
56 HD12 LEU 7 2HD1 LEU 7 -3.864 0.204 -7.336
57 HD13 LEU 7 3HD1 LEU 7 -2.285 0.590 -8.056
58 HD21 LEU 7 3HD2 LEU 7 -3.282 2.112 -9.718
59 HD22 LEU 7 1HD2 LEU 7 -4.912 1.754 -9.104
60 HD23 LEU 7 2HD2 LEU 7 -4.347 3.436 -9.221
61 H LYS 8 H LYS 8 -2.296 2.678 -3.351
62 HA LYS 8 HA LYS 8 -1.104 5.401 -3.743
63 HB2 LYS 8 1HB LYS 8 -2.198 4.849 -1.526
64 HB3 LYS 8 2HB LYS 8 -1.042 3.523 -1.326
65 HG2 LYS 8 1HG LYS 8 0.793 5.338 -1.611
66 HG3 LYS 8 2HG LYS 8 -0.497 6.522 -1.415
67 HD2 LYS 8 1HD LYS 8 -0.972 5.668 0.820
68 HD3 LYS 8 2HD LYS 8 0.191 4.341 0.605
69 HE2 LYS 8 1HE LYS 8 0.969 7.283 0.401
70 HE3 LYS 8 2HE LYS 8 1.005 6.404 1.933
71 HZ1 LYS 8 3HZ LYS 8 3.168 6.447 0.709
72 HZ2 LYS 8 1HZ LYS 8 2.671 4.957 1.114
73 HZ3 LYS 8 2HZ LYS 8 2.538 5.466 -0.442
74 H LYS 9 H LYS 9 1.072 5.535 -4.342
75 HA LYS 9 HA LYS 9 2.641 3.226 -5.075
76 HB2 LYS 9 1HB LYS 9 3.395 6.123 -4.386
77 HB3 LYS 9 2HB LYS 9 4.552 4.940 -4.997
78 HG2 LYS 9 1HG LYS 9 3.329 4.708 -7.077
79 HG3 LYS 9 2HG LYS 9 2.075 5.843 -6.515
80 HD2 LYS 9 1HD LYS 9 3.791 7.631 -6.340
81 HD3 LYS 9 2HD LYS 9 5.034 6.490 -6.898
82 HE2 LYS 9 1HE LYS 9 3.773 6.176 -9.028
83 HE3 LYS 9 2HE LYS 9 2.558 7.337 -8.473
84 HZ1 LYS 9 3HZ LYS 9 4.191 8.389 -9.918
85 HZ2 LYS 9 1HZ LYS 9 4.300 9.036 -8.423
86 HZ3 LYS 9 2HZ LYS 9 5.423 7.963 -8.936
87 H CYS 10 H CYS 10 4.527 2.353 -4.070
88 HA CYS 10 HA CYS 10 5.229 3.206 -1.329
89 HB2 CYS 10 1HB CYS 10 4.899 0.994 -0.297
90 HB3 CYS 10 2HB CYS 10 3.417 1.720 -0.882
91 H ARG 11 H ARG 11 7.105 2.624 -0.524
92 HA ARG 11 HA ARG 11 9.142 1.273 -2.213
93 HB2 ARG 11 1HB ARG 11 10.716 2.173 -0.440
94 HB3 ARG 11 2HB ARG 11 9.891 3.361 -1.445
95 HG2 ARG 11 1HG ARG 11 8.309 3.884 0.329
96 HG3 ARG 11 2HG ARG 11 8.975 2.611 1.365
97 HD2 ARG 11 1HD ARG 11 11.066 3.809 1.580
98 HD3 ARG 11 2HD ARG 11 10.559 5.009 0.370
99 HE ARG 11 HE ARG 11 8.544 5.210 2.185
100 HH11 ARG 11 1HH1 ARG 11 12.055 5.468 2.640
101 HH12 ARG 11 2HH1 ARG 11 11.870 6.529 4.006
102 HH21 ARG 11 1HH2 ARG 11 8.382 6.525 3.893
103 HH22 ARG 11 2HH2 ARG 11 9.796 7.131 4.717
104 H ARG 12 H ARG 12 7.245 0.719 0.671
105 HA ARG 12 HA ARG 12 7.740 -2.042 0.888
106 HB2 ARG 12 1HB ARG 12 8.959 -2.144 3.048
107 HB3 ARG 12 2HB ARG 12 9.970 -1.460 1.795
108 HG2 ARG 12 1HG ARG 12 9.637 0.801 2.649
109 HG3 ARG 12 2HG ARG 12 8.424 0.238 3.812
110 HD2 ARG 12 1HD ARG 12 10.127 -1.119 4.955
111 HD3 ARG 12 2HD ARG 12 11.359 -0.572 3.798
112 HE ARG 12 HE ARG 12 10.355 1.786 4.759
113 HH11 ARG 12 1HH1 ARG 12 11.721 -1.026 6.418
114 HH12 ARG 12 2HH1 ARG 12 12.268 -0.078 7.770
115 HH21 ARG 12 1HH2 ARG 12 11.077 2.949 6.540
116 HH22 ARG 12 2HH2 ARG 12 11.912 2.140 7.830
117 H ASP 13 H ASP 13 6.886 -2.880 3.101
118 HA ASP 13 HA ASP 13 4.160 -2.182 3.187
119 HB2 ASP 13 1HB ASP 13 5.750 -3.544 5.398
120 HB3 ASP 13 2HB ASP 13 4.016 -3.675 5.111
121 H SER 14 H SER 14 6.801 -1.050 5.292
122 HA SER 14 HA SER 14 5.283 0.359 7.235
123 HB2 SER 14 1HB SER 14 8.005 1.158 6.148
124 HB3 SER 14 2HB SER 14 7.369 1.450 7.769
125 HG SER 14 HG SER 14 7.520 -0.779 8.181
126 H ASP 15 H ASP 15 5.709 1.141 3.895
127 HA ASP 15 HA ASP 15 5.163 4.037 4.240
128 HB2 ASP 15 1HB ASP 15 6.930 2.949 2.665
129 HB3 ASP 15 2HB ASP 15 5.559 2.528 1.641
130 H CYS 16 H CYS 16 3.389 1.177 3.984
131 HA CYS 16 HA CYS 16 1.091 2.349 2.494
132 HB2 CYS 16 1HB CYS 16 1.737 -0.470 3.381
133 HB3 CYS 16 2HB CYS 16 0.219 0.023 2.653
134 HA PRO 17 HA PRO 17 -0.791 3.465 6.220
135 HB2 PRO 17 1HB PRO 17 -3.158 4.406 5.372
136 HB3 PRO 17 2HB PRO 17 -1.604 5.069 4.742
137 HG2 PRO 17 1HG PRO 17 -3.328 2.938 3.430
138 HG3 PRO 17 2HG PRO 17 -2.764 4.491 2.723
139 HD2 PRO 17 1HD PRO 17 -1.355 2.186 2.369
140 HD3 PRO 17 2HD PRO 17 -0.543 3.761 2.611
141 H GLY 18 H GLY 18 -2.222 2.835 7.868
142 HA2 GLY 18 1HA GLY 18 -3.603 1.425 9.090
143 HA3 GLY 18 2HA GLY 18 -4.465 1.122 7.575
144 H ALA 19 H ALA 19 -4.650 -0.970 7.215
145 HA ALA 19 HA ALA 19 -2.557 -2.905 8.050
146 HB1 ALA 19 3HB ALA 19 -4.294 -4.574 7.691
147 HB2 ALA 19 1HB ALA 19 -4.946 -3.257 8.681
148 HB3 ALA 19 2HB ALA 19 -5.358 -3.368 6.949
149 H CYS 20 H CYS 20 -2.842 -1.048 5.330
150 HA CYS 20 HA CYS 20 -2.657 -2.994 3.208
151 HB2 CYS 20 1HB CYS 20 -1.708 -0.111 3.355
152 HB3 CYS 20 2HB CYS 20 -1.649 -1.063 1.926
153 H ILE 21 H ILE 21 -0.981 -3.815 2.094
154 HA ILE 21 HA ILE 21 1.813 -3.605 3.184
155 HB ILE 21 HB ILE 21 2.115 -5.944 2.336
156 HG12 ILE 21 1HG1 ILE 21 -0.921 -6.162 2.307
157 HG13 ILE 21 2HG1 ILE 21 0.053 -5.955 0.851
158 HG21 ILE 21 1HG2 ILE 21 1.803 -5.364 4.737
159 HG22 ILE 21 2HG2 ILE 21 0.060 -5.661 4.569
160 HG23 ILE 21 3HG2 ILE 21 1.223 -6.985 4.351
161 HD11 ILE 21 3HD1 ILE 21 -0.454 -8.294 1.120
162 HD12 ILE 21 1HD1 ILE 21 1.285 -8.061 1.392
163 HD13 ILE 21 2HD1 ILE 21 0.186 -8.308 2.772
164 H CYS 22 H CYS 22 3.498 -3.898 1.546
165 HA CYS 22 HA CYS 22 2.727 -2.434 -0.913
166 HB2 CYS 22 1HB CYS 22 4.693 -1.796 0.555
167 HB3 CYS 22 2HB CYS 22 5.494 -3.270 0.022
168 H ARG 23 H ARG 23 2.351 -3.415 -2.799
169 HA ARG 23 HA ARG 23 2.874 -6.326 -3.072
170 HB2 ARG 23 1HB ARG 23 1.164 -4.519 -4.811
171 HB3 ARG 23 2HB ARG 23 1.197 -6.277 -4.806
172 HG2 ARG 23 1HG ARG 23 0.080 -4.422 -2.680
173 HG3 ARG 23 2HG ARG 23 -0.791 -5.571 -3.680
174 HD2 ARG 23 1HD ARG 23 1.126 -6.208 -1.404
175 HD3 ARG 23 2HD ARG 23 -0.624 -6.379 -1.398
176 HE ARG 23 HE ARG 23 -0.389 -8.101 -3.182
177 HH11 ARG 23 1HH1 ARG 23 2.419 -7.618 -1.043
178 HH12 ARG 23 2HH1 ARG 23 2.961 -9.250 -1.277
179 HH21 ARG 23 1HH2 ARG 23 0.404 -10.160 -3.437
180 HH22 ARG 23 2HH2 ARG 23 1.850 -10.658 -2.615
181 H GLY 24 H GLY 24 3.342 -7.097 -5.348
182 HA2 GLY 24 1HA GLY 24 5.990 -6.313 -5.974
183 HA3 GLY 24 2HA GLY 24 4.987 -7.430 -6.923
184 H ASN 25 H ASN 25 3.046 -5.021 -7.302
185 HA ASN 25 HA ASN 25 4.278 -3.857 -9.679
186 HB2 ASN 25 1HB ASN 25 2.148 -2.812 -10.028
187 HB3 ASN 25 2HB ASN 25 1.890 -4.495 -9.593
188 HD21 ASN 25 1HD2 ASN 25 -0.250 -2.792 -9.419
189 HD22 ASN 25 2HD2 ASN 25 -0.617 -2.470 -7.732
190 H GLY 26 H GLY 26 4.587 -3.066 -6.404
191 HA2 GLY 26 1HA GLY 26 5.799 -1.305 -5.478
192 HA3 GLY 26 2HA GLY 26 5.677 -0.386 -6.999
193 H TYR 27 H TYR 27 2.705 -1.670 -5.686
194 HA TYR 27 HA TYR 27 2.034 0.926 -4.378
195 HB2 TYR 27 1HB TYR 27 0.474 -0.574 -6.486
196 HB3 TYR 27 2HB TYR 27 -0.332 0.460 -5.336
197 HD1 TYR 27 HD1 TYR 27 2.577 0.608 -7.762
198 HD2 TYR 27 HD2 TYR 27 -0.800 2.606 -5.993
199 HE1 TYR 27 HE1 TYR 27 3.012 2.576 -9.178
200 HE2 TYR 27 HE2 TYR 27 -0.455 4.543 -7.508
201 HH TYR 27 HH TYR 27 0.781 5.400 -9.242
202 H CYS 28 H CYS 28 0.306 0.868 -2.879
203 HA CYS 28 HA CYS 28 0.475 -1.347 -1.036
204 HB2 CYS 28 1HB CYS 28 -1.275 1.142 -1.074
205 HB3 CYS 28 2HB CYS 28 -1.088 0.089 0.325
206 H GLY 29 H GLY 29 -0.927 -2.942 -0.549
207 HA2 GLY 29 1HA GLY 29 -3.739 -2.980 -1.453
208 HA3 GLY 29 2HA GLY 29 -2.694 -4.195 -2.172
209 HN1 NH2 30 2HN NH2 30 -4.025 -6.062 0.614
210 HN2 NH2 30 1HN NH2 30 -4.388 -5.596 -1.037
Start of MODEL 21
1 H1 GLY 1 1H GLY 1 -8.626 -4.402 12.006
2 H2 GLY 1 2H GLY 1 -7.067 -4.859 11.793
3 H3 GLY 1 3H GLY 1 -7.424 -3.587 12.760
4 HA2 GLY 1 1HA GLY 1 -8.234 -2.299 10.907
5 HA3 GLY 1 2HA GLY 1 -6.543 -2.783 10.681
6 H VAL 2 H VAL 2 -8.030 -2.032 8.493
7 HA VAL 2 HA VAL 2 -8.126 -4.484 6.849
8 HB VAL 2 HB VAL 2 -10.443 -2.492 6.893
9 HG11 VAL 2 1HG1 VAL 2 -10.076 -3.327 4.627
10 HG12 VAL 2 2HG1 VAL 2 -10.002 -5.004 5.218
11 HG13 VAL 2 3HG1 VAL 2 -11.520 -4.082 5.287
12 HG21 VAL 2 3HG2 VAL 2 -11.873 -4.403 7.597
13 HG22 VAL 2 1HG2 VAL 2 -10.421 -5.408 7.788
14 HG23 VAL 2 2HG2 VAL 2 -10.683 -3.983 8.825
15 H CYS 3 H CYS 3 -7.392 -4.034 4.776
16 HA CYS 3 HA CYS 3 -6.273 -1.362 4.319
17 HB2 CYS 3 1HB CYS 3 -4.971 -3.328 3.714
18 HB3 CYS 3 2HB CYS 3 -6.254 -3.909 2.664
19 HA PRO 4 HA PRO 4 -10.119 -0.287 2.093
20 HB2 PRO 4 1HB PRO 4 -9.604 2.348 1.561
21 HB3 PRO 4 2HB PRO 4 -10.062 1.744 3.181
22 HG2 PRO 4 1HG PRO 4 -7.273 2.305 2.130
23 HG3 PRO 4 2HG PRO 4 -7.999 2.837 3.678
24 HD2 PRO 4 1HD PRO 4 -6.404 0.648 3.520
25 HD3 PRO 4 2HD PRO 4 -7.823 0.679 4.609
26 H LYS 5 H LYS 5 -10.640 0.677 -0.085
27 HA LYS 5 HA LYS 5 -9.036 -0.649 -2.112
28 HB2 LYS 5 1HB LYS 5 -11.622 0.955 -2.277
29 HB3 LYS 5 2HB LYS 5 -10.904 0.026 -3.602
30 HG2 LYS 5 1HG LYS 5 -11.097 -2.061 -2.263
31 HG3 LYS 5 2HG LYS 5 -11.840 -1.147 -0.947
32 HD2 LYS 5 1HD LYS 5 -13.579 -2.247 -2.171
33 HD3 LYS 5 2HD LYS 5 -13.717 -0.505 -2.453
34 HE2 LYS 5 1HE LYS 5 -12.593 -0.769 -4.655
35 HE3 LYS 5 2HE LYS 5 -12.386 -2.501 -4.352
36 HZ1 LYS 5 3HZ LYS 5 -14.323 -2.066 -5.738
37 HZ2 LYS 5 1HZ LYS 5 -14.808 -2.715 -4.321
38 HZ3 LYS 5 2HZ LYS 5 -15.000 -1.113 -4.597
39 H ILE 6 H ILE 6 -7.491 1.324 -1.040
40 HA ILE 6 HA ILE 6 -7.371 3.672 -2.843
41 HB ILE 6 HB ILE 6 -5.433 4.356 -1.457
42 HG12 ILE 6 1HG1 ILE 6 -5.076 3.265 0.759
43 HG13 ILE 6 2HG1 ILE 6 -5.967 1.855 0.212
44 HG21 ILE 6 1HG2 ILE 6 -7.744 5.031 -0.946
45 HG22 ILE 6 2HG2 ILE 6 -7.922 3.637 0.137
46 HG23 ILE 6 3HG2 ILE 6 -6.749 4.914 0.510
47 HD11 ILE 6 3HD1 ILE 6 -3.464 1.651 0.147
48 HD12 ILE 6 1HD1 ILE 6 -4.229 1.326 -1.408
49 HD13 ILE 6 2HD1 ILE 6 -3.428 2.893 -1.118
50 H LEU 7 H LEU 7 -5.150 4.288 -3.694
51 HA LEU 7 HA LEU 7 -3.486 2.030 -4.597
52 HB2 LEU 7 1HB LEU 7 -5.219 2.374 -6.368
53 HB3 LEU 7 2HB LEU 7 -4.712 4.053 -6.522
54 HG LEU 7 HG LEU 7 -2.445 3.273 -7.251
55 HD11 LEU 7 1HD1 LEU 7 -2.382 1.023 -6.197
56 HD12 LEU 7 2HD1 LEU 7 -3.722 0.494 -7.235
57 HD13 LEU 7 3HD1 LEU 7 -2.145 0.905 -7.943
58 HD21 LEU 7 3HD2 LEU 7 -3.149 2.542 -9.491
59 HD22 LEU 7 1HD2 LEU 7 -4.774 2.172 -8.874
60 HD23 LEU 7 2HD2 LEU 7 -4.184 3.848 -8.892
61 H LYS 8 H LYS 8 -2.007 2.754 -3.144
62 HA LYS 8 HA LYS 8 -0.800 5.477 -3.495
63 HB2 LYS 8 1HB LYS 8 -1.907 4.910 -1.284
64 HB3 LYS 8 2HB LYS 8 -0.721 3.613 -1.067
65 HG2 LYS 8 1HG LYS 8 1.107 5.362 -1.238
66 HG3 LYS 8 2HG LYS 8 -0.152 6.604 -1.356
67 HD2 LYS 8 1HD LYS 8 -0.985 5.887 0.907
68 HD3 LYS 8 2HD LYS 8 0.368 4.725 0.980
69 HE2 LYS 8 1HE LYS 8 1.967 6.637 0.642
70 HE3 LYS 8 2HE LYS 8 0.602 7.761 0.693
71 HZ1 LYS 8 3HZ LYS 8 1.672 7.597 2.847
72 HZ2 LYS 8 1HZ LYS 8 0.164 6.981 2.974
73 HZ3 LYS 8 2HZ LYS 8 1.468 5.974 2.900
74 H LYS 9 H LYS 9 1.369 5.593 -4.081
75 HA LYS 9 HA LYS 9 2.820 3.266 -4.974
76 HB2 LYS 9 1HB LYS 9 3.679 6.123 -4.248
77 HB3 LYS 9 2HB LYS 9 4.787 4.935 -4.938
78 HG2 LYS 9 1HG LYS 9 3.450 4.729 -6.940
79 HG3 LYS 9 2HG LYS 9 2.253 5.888 -6.326
80 HD2 LYS 9 1HD LYS 9 5.190 6.493 -6.894
81 HD3 LYS 9 2HD LYS 9 3.840 6.856 -7.980
82 HE2 LYS 9 1HE LYS 9 2.825 8.315 -6.226
83 HE3 LYS 9 2HE LYS 9 4.211 7.998 -5.171
84 HZ1 LYS 9 3HZ LYS 9 4.482 10.074 -6.381
85 HZ2 LYS 9 1HZ LYS 9 5.640 9.023 -6.851
86 HZ3 LYS 9 2HZ LYS 9 4.358 9.320 -7.824
87 H CYS 10 H CYS 10 4.701 2.285 -4.114
88 HA CYS 10 HA CYS 10 5.678 2.990 -1.426
89 HB2 CYS 10 1HB CYS 10 5.157 0.862 -0.350
90 HB3 CYS 10 2HB CYS 10 3.697 1.679 -0.869
91 H ARG 11 H ARG 11 7.471 1.973 -0.696
92 HA ARG 11 HA ARG 11 9.063 0.272 -2.571
93 HB2 ARG 11 1HB ARG 11 10.050 2.482 -2.026
94 HB3 ARG 11 2HB ARG 11 9.930 2.127 -0.309
95 HG2 ARG 11 1HG ARG 11 12.200 1.893 -1.072
96 HG3 ARG 11 2HG ARG 11 11.616 0.332 -0.526
97 HD2 ARG 11 1HD ARG 11 11.628 1.151 -3.463
98 HD3 ARG 11 2HD ARG 11 13.039 0.436 -2.669
99 HE ARG 11 HE ARG 11 10.952 -1.303 -2.077
100 HH11 ARG 11 1HH1 ARG 11 12.517 -0.225 -5.065
101 HH12 ARG 11 2HH1 ARG 11 12.125 -1.695 -5.907
102 HH21 ARG 11 1HH2 ARG 11 10.478 -3.160 -3.209
103 HH22 ARG 11 2HH2 ARG 11 10.988 -3.343 -4.861
104 H ARG 12 H ARG 12 7.606 0.603 0.627
105 HA ARG 12 HA ARG 12 7.731 -2.256 1.130
106 HB2 ARG 12 1HB ARG 12 8.902 -2.065 3.308
107 HB3 ARG 12 2HB ARG 12 9.957 -1.626 1.974
108 HG2 ARG 12 1HG ARG 12 9.690 0.755 2.436
109 HG3 ARG 12 2HG ARG 12 8.470 0.438 3.674
110 HD2 ARG 12 1HD ARG 12 11.367 -0.502 3.829
111 HD3 ARG 12 2HD ARG 12 10.752 0.981 4.550
112 HE ARG 12 HE ARG 12 9.376 -0.248 6.066
113 HH11 ARG 12 1HH1 ARG 12 11.669 -2.380 4.388
114 HH12 ARG 12 2HH1 ARG 12 11.471 -3.639 5.570
115 HH21 ARG 12 1HH2 ARG 12 9.173 -1.882 7.504
116 HH22 ARG 12 2HH2 ARG 12 10.080 -3.358 7.325
117 H ASP 13 H ASP 13 6.775 -2.757 3.345
118 HA ASP 13 HA ASP 13 4.089 -1.954 3.212
119 HB2 ASP 13 1HB ASP 13 5.507 -3.145 5.630
120 HB3 ASP 13 2HB ASP 13 3.783 -3.232 5.275
121 H SER 14 H SER 14 6.680 -0.576 5.173
122 HA SER 14 HA SER 14 5.186 0.974 7.013
123 HB2 SER 14 1HB SER 14 7.854 1.682 5.737
124 HB3 SER 14 2HB SER 14 7.253 2.221 7.309
125 HG SER 14 HG SER 14 7.442 0.126 8.083
126 H ASP 15 H ASP 15 5.480 1.487 3.576
127 HA ASP 15 HA ASP 15 4.837 4.374 3.665
128 HB2 ASP 15 1HB ASP 15 4.798 2.383 1.366
129 HB3 ASP 15 2HB ASP 15 4.667 4.129 1.223
130 H CYS 16 H CYS 16 3.111 1.365 3.779
131 HA CYS 16 HA CYS 16 0.719 2.373 2.410
132 HB2 CYS 16 1HB CYS 16 1.424 -0.364 3.510
133 HB3 CYS 16 2HB CYS 16 0.004 0.032 2.562
134 HA PRO 17 HA PRO 17 -1.394 3.549 5.981
135 HB2 PRO 17 1HB PRO 17 -3.814 4.178 4.996
136 HB3 PRO 17 2HB PRO 17 -2.313 4.951 4.366
137 HG2 PRO 17 1HG PRO 17 -3.781 2.583 3.153
138 HG3 PRO 17 2HG PRO 17 -3.319 4.125 2.357
139 HD2 PRO 17 1HD PRO 17 -1.715 1.920 2.236
140 HD3 PRO 17 2HD PRO 17 -1.051 3.576 2.354
141 H GLY 18 H GLY 18 -2.705 2.831 7.669
142 HA2 GLY 18 1HA GLY 18 -3.956 1.359 8.960
143 HA3 GLY 18 2HA GLY 18 -4.830 0.965 7.473
144 H ALA 19 H ALA 19 -4.872 -1.134 7.119
145 HA ALA 19 HA ALA 19 -2.649 -2.918 7.965
146 HB1 ALA 19 3HB ALA 19 -4.283 -4.703 7.670
147 HB2 ALA 19 1HB ALA 19 -4.979 -3.415 8.664
148 HB3 ALA 19 2HB ALA 19 -5.445 -3.575 6.950
149 H CYS 20 H CYS 20 -3.050 -1.131 5.237
150 HA CYS 20 HA CYS 20 -2.760 -3.072 3.115
151 HB2 CYS 20 1HB CYS 20 -1.911 -0.171 3.264
152 HB3 CYS 20 2HB CYS 20 -1.837 -1.141 1.835
153 H ILE 21 H ILE 21 -1.030 -3.828 2.034
154 HA ILE 21 HA ILE 21 1.720 -3.540 3.206
155 HB ILE 21 HB ILE 21 2.103 -5.894 2.446
156 HG12 ILE 21 1HG1 ILE 21 -0.927 -6.186 2.330
157 HG13 ILE 21 2HG1 ILE 21 0.089 -6.005 0.900
158 HG21 ILE 21 1HG2 ILE 21 1.701 -5.247 4.818
159 HG22 ILE 21 2HG2 ILE 21 -0.027 -5.603 4.607
160 HG23 ILE 21 3HG2 ILE 21 1.182 -6.896 4.464
161 HD11 ILE 21 3HD1 ILE 21 -0.376 -8.345 1.231
162 HD12 ILE 21 1HD1 ILE 21 1.349 -8.063 1.544
163 HD13 ILE 21 2HD1 ILE 21 0.217 -8.292 2.899
164 H CYS 22 H CYS 22 3.451 -3.826 1.638
165 HA CYS 22 HA CYS 22 2.746 -2.449 -0.871
166 HB2 CYS 22 1HB CYS 22 4.736 -1.869 0.579
167 HB3 CYS 22 2HB CYS 22 5.473 -3.388 0.083
168 H ARG 23 H ARG 23 2.486 -3.376 -2.817
169 HA ARG 23 HA ARG 23 2.925 -6.317 -3.092
170 HB2 ARG 23 1HB ARG 23 1.195 -4.523 -4.817
171 HB3 ARG 23 2HB ARG 23 1.223 -6.280 -4.775
172 HG2 ARG 23 1HG ARG 23 0.105 -4.367 -2.709
173 HG3 ARG 23 2HG ARG 23 -0.755 -5.565 -3.660
174 HD2 ARG 23 1HD ARG 23 1.139 -6.070 -1.334
175 HD3 ARG 23 2HD ARG 23 -0.602 -6.281 -1.358
176 HE ARG 23 HE ARG 23 -0.310 -8.096 -3.012
177 HH11 ARG 23 1HH1 ARG 23 2.570 -7.371 -1.025
178 HH12 ARG 23 2HH1 ARG 23 3.113 -9.016 -1.113
179 HH21 ARG 23 1HH2 ARG 23 0.516 -10.152 -3.110
180 HH22 ARG 23 2HH2 ARG 23 1.999 -10.550 -2.299
181 H GLY 24 H GLY 24 3.390 -7.071 -5.350
182 HA2 GLY 24 1HA GLY 24 6.021 -6.248 -5.994
183 HA3 GLY 24 2HA GLY 24 5.032 -7.389 -6.929
184 H ASN 25 H ASN 25 3.060 -4.989 -7.303
185 HA ASN 25 HA ASN 25 4.247 -3.852 -9.712
186 HB2 ASN 25 1HB ASN 25 2.118 -2.798 -10.023
187 HB3 ASN 25 2HB ASN 25 1.855 -4.470 -9.558
188 HD21 ASN 25 1HD2 ASN 25 -0.254 -2.710 -9.363
189 HD22 ASN 25 2HD2 ASN 25 -0.581 -2.373 -7.671
190 H GLY 26 H GLY 26 4.631 -3.025 -6.449
191 HA2 GLY 26 1HA GLY 26 5.878 -1.257 -5.575
192 HA3 GLY 26 2HA GLY 26 5.722 -0.356 -7.101
193 H TYR 27 H TYR 27 2.795 -1.635 -5.676
194 HA TYR 27 HA TYR 27 2.166 0.948 -4.336
195 HB2 TYR 27 1HB TYR 27 0.557 -0.461 -6.468
196 HB3 TYR 27 2HB TYR 27 -0.215 0.565 -5.289
197 HD1 TYR 27 HD2 TYR 27 2.578 0.638 -7.829
198 HD2 TYR 27 HD1 TYR 27 -0.551 2.787 -5.801
199 HE1 TYR 27 HE2 TYR 27 3.052 2.618 -9.218
200 HE2 TYR 27 HE1 TYR 27 -0.168 4.748 -7.276
201 HH TYR 27 HH TYR 27 2.349 4.728 -9.839
202 H CYS 28 H CYS 28 0.431 0.875 -2.849
203 HA CYS 28 HA CYS 28 0.542 -1.387 -1.064
204 HB2 CYS 28 1HB CYS 28 -1.152 1.137 -1.064
205 HB3 CYS 28 2HB CYS 28 -0.987 0.055 0.323
206 H GLY 29 H GLY 29 -0.877 -2.980 -0.650
207 HA2 GLY 29 1HA GLY 29 -3.703 -2.908 -1.529
208 HA3 GLY 29 2HA GLY 29 -2.699 -4.138 -2.279
209 HN1 NH2 30 2HN NH2 30 -4.078 -6.026 0.465
210 HN2 NH2 30 1HN NH2 30 -4.426 -5.513 -1.175
Start of MODEL 22
1 H1 GLY 1 1H GLY 1 -8.934 -3.479 12.293
2 H2 GLY 1 2H GLY 1 -7.454 -4.177 12.209
3 H3 GLY 1 3H GLY 1 -7.661 -2.796 13.063
4 HA2 GLY 1 1HA GLY 1 -8.167 -1.549 11.077
5 HA3 GLY 1 2HA GLY 1 -6.561 -2.298 10.992
6 H VAL 2 H VAL 2 -7.657 -1.541 8.643
7 HA VAL 2 HA VAL 2 -8.062 -4.048 7.185
8 HB VAL 2 HB VAL 2 -9.935 -3.149 5.835
9 HG11 VAL 2 1HG1 VAL 2 -10.381 -4.778 7.649
10 HG12 VAL 2 2HG1 VAL 2 -10.757 -3.427 8.746
11 HG13 VAL 2 3HG1 VAL 2 -11.754 -3.712 7.310
12 HG21 VAL 2 3HG2 VAL 2 -11.373 -1.335 6.653
13 HG22 VAL 2 1HG2 VAL 2 -10.256 -1.019 7.995
14 HG23 VAL 2 2HG2 VAL 2 -9.748 -0.734 6.314
15 H CYS 3 H CYS 3 -7.708 -3.681 4.836
16 HA CYS 3 HA CYS 3 -5.902 -1.376 4.390
17 HB2 CYS 3 1HB CYS 3 -5.037 -3.527 3.739
18 HB3 CYS 3 2HB CYS 3 -6.467 -3.909 2.811
19 HA PRO 4 HA PRO 4 -9.548 0.532 2.397
20 HB2 PRO 4 1HB PRO 4 -8.455 2.969 1.743
21 HB3 PRO 4 2HB PRO 4 -9.011 2.535 3.389
22 HG2 PRO 4 1HG PRO 4 -6.191 2.385 2.278
23 HG3 PRO 4 2HG PRO 4 -6.732 3.128 3.819
24 HD2 PRO 4 1HD PRO 4 -5.708 0.643 3.776
25 HD3 PRO 4 2HD PRO 4 -7.118 1.004 4.808
26 H LYS 5 H LYS 5 -10.173 1.019 0.263
27 HA LYS 5 HA LYS 5 -8.714 -0.564 -1.666
28 HB2 LYS 5 1HB LYS 5 -11.356 0.954 -1.841
29 HB3 LYS 5 2HB LYS 5 -10.765 -0.197 -3.047
30 HG2 LYS 5 1HG LYS 5 -10.743 -2.000 -1.334
31 HG3 LYS 5 2HG LYS 5 -11.421 -0.870 -0.145
32 HD2 LYS 5 1HD LYS 5 -13.411 -0.536 -1.590
33 HD3 LYS 5 2HD LYS 5 -12.739 -1.681 -2.774
34 HE2 LYS 5 1HE LYS 5 -12.735 -3.466 -1.040
35 HE3 LYS 5 2HE LYS 5 -13.405 -2.328 0.138
36 HZ1 LYS 5 3HZ LYS 5 -15.138 -3.695 -0.857
37 HZ2 LYS 5 1HZ LYS 5 -15.378 -2.134 -1.273
38 HZ3 LYS 5 2HZ LYS 5 -14.758 -3.187 -2.362
39 H ILE 6 H ILE 6 -7.654 2.182 -0.957
40 HA ILE 6 HA ILE 6 -7.674 3.665 -3.522
41 HB ILE 6 HB ILE 6 -6.239 5.291 -2.402
42 HG12 ILE 6 1HG1 ILE 6 -6.408 3.528 0.087
43 HG13 ILE 6 2HG1 ILE 6 -4.965 3.771 -0.902
44 HG21 ILE 6 1HG2 ILE 6 -8.743 5.354 -2.260
45 HG22 ILE 6 2HG2 ILE 6 -8.641 4.578 -0.664
46 HG23 ILE 6 3HG2 ILE 6 -7.938 6.187 -0.931
47 HD11 ILE 6 3HD1 ILE 6 -4.794 5.177 1.035
48 HD12 ILE 6 1HD1 ILE 6 -5.043 6.218 -0.378
49 HD13 ILE 6 2HD1 ILE 6 -6.385 5.892 0.749
50 H LEU 7 H LEU 7 -5.891 4.082 -4.830
51 HA LEU 7 HA LEU 7 -3.817 1.954 -4.848
52 HB2 LEU 7 1HB LEU 7 -5.275 2.298 -6.834
53 HB3 LEU 7 2HB LEU 7 -4.690 3.953 -6.972
54 HG LEU 7 HG LEU 7 -2.398 3.102 -7.401
55 HD11 LEU 7 1HD1 LEU 7 -2.481 0.909 -6.241
56 HD12 LEU 7 2HD1 LEU 7 -3.711 0.339 -7.387
57 HD13 LEU 7 3HD1 LEU 7 -2.060 0.691 -7.940
58 HD21 LEU 7 3HD2 LEU 7 -2.837 2.265 -9.670
59 HD22 LEU 7 1HD2 LEU 7 -4.530 1.937 -9.235
60 HD23 LEU 7 2HD2 LEU 7 -3.919 3.607 -9.264
61 H LYS 8 H LYS 8 -2.356 2.588 -3.351
62 HA LYS 8 HA LYS 8 -1.125 5.315 -3.527
63 HB2 LYS 8 1HB LYS 8 -2.326 4.580 -1.382
64 HB3 LYS 8 2HB LYS 8 -1.055 3.363 -1.174
65 HG2 LYS 8 1HG LYS 8 0.638 5.294 -1.315
66 HG3 LYS 8 2HG LYS 8 -0.740 6.405 -1.319
67 HD2 LYS 8 1HD LYS 8 -1.421 5.468 0.917
68 HD3 LYS 8 2HD LYS 8 0.046 4.448 0.875
69 HE2 LYS 8 1HE LYS 8 1.432 6.529 0.607
70 HE3 LYS 8 2HE LYS 8 -0.036 7.503 0.777
71 HZ1 LYS 8 3HZ LYS 8 1.132 7.320 2.877
72 HZ2 LYS 8 1HZ LYS 8 -0.302 6.551 3.018
73 HZ3 LYS 8 2HZ LYS 8 1.091 5.685 2.838
74 H LYS 9 H LYS 9 1.039 5.483 -4.047
75 HA LYS 9 HA LYS 9 2.599 3.218 -4.919
76 HB2 LYS 9 1HB LYS 9 3.349 6.088 -4.114
77 HB3 LYS 9 2HB LYS 9 4.498 4.939 -4.803
78 HG2 LYS 9 1HG LYS 9 3.275 4.813 -6.872
79 HG3 LYS 9 2HG LYS 9 1.955 5.809 -6.223
80 HD2 LYS 9 1HD LYS 9 3.317 7.160 -7.674
81 HD3 LYS 9 2HD LYS 9 3.517 7.726 -6.008
82 HE2 LYS 9 1HE LYS 9 5.670 6.494 -5.842
83 HE3 LYS 9 2HE LYS 9 5.449 5.870 -7.484
84 HZ1 LYS 9 3HZ LYS 9 6.905 7.805 -7.457
85 HZ2 LYS 9 1HZ LYS 9 5.549 8.161 -8.295
86 HZ3 LYS 9 2HZ LYS 9 5.749 8.738 -6.777
87 H CYS 10 H CYS 10 4.527 2.346 -4.005
88 HA CYS 10 HA CYS 10 5.348 3.064 -1.270
89 HB2 CYS 10 1HB CYS 10 4.969 0.849 -0.272
90 HB3 CYS 10 2HB CYS 10 3.477 1.621 -0.773
91 H ARG 11 H ARG 11 7.249 2.320 -0.549
92 HA ARG 11 HA ARG 11 9.130 0.932 -2.403
93 HB2 ARG 11 1HB ARG 11 9.557 2.223 0.324
94 HB3 ARG 11 2HB ARG 11 10.819 1.645 -0.753
95 HG2 ARG 11 1HG ARG 11 10.439 3.382 -2.348
96 HG3 ARG 11 2HG ARG 11 8.915 3.880 -1.607
97 HD2 ARG 11 1HD ARG 11 11.617 4.087 -0.237
98 HD3 ARG 11 2HD ARG 11 10.805 5.407 -1.098
99 HE ARG 11 HE ARG 11 8.942 4.408 0.778
100 HH11 ARG 11 1HH1 ARG 11 12.069 6.081 0.908
101 HH12 ARG 11 2HH1 ARG 11 11.702 6.833 2.433
102 HH21 ARG 11 1HH2 ARG 11 8.504 5.455 2.674
103 HH22 ARG 11 2HH2 ARG 11 9.708 6.470 3.438
104 H ARG 12 H ARG 12 7.390 0.616 0.621
105 HA ARG 12 HA ARG 12 7.646 -2.225 0.936
106 HB2 ARG 12 1HB ARG 12 8.918 -2.218 3.045
107 HB3 ARG 12 2HB ARG 12 9.899 -1.591 1.731
108 HG2 ARG 12 1HG ARG 12 9.426 0.753 2.509
109 HG3 ARG 12 2HG ARG 12 8.450 0.098 3.825
110 HD2 ARG 12 1HD ARG 12 10.612 0.648 4.721
111 HD3 ARG 12 2HD ARG 12 10.449 -1.102 4.700
112 HE ARG 12 HE ARG 12 12.154 -1.272 3.151
113 HH11 ARG 12 1HH1 ARG 12 11.302 2.162 3.351
114 HH12 ARG 12 2HH1 ARG 12 12.682 2.646 2.412
115 HH21 ARG 12 1HH2 ARG 12 13.885 -0.579 1.925
116 HH22 ARG 12 2HH2 ARG 12 14.116 1.112 1.603
117 H ASP 13 H ASP 13 6.735 -2.820 3.208
118 HA ASP 13 HA ASP 13 4.047 -2.028 3.181
119 HB2 ASP 13 1HB ASP 13 5.519 -3.208 5.563
120 HB3 ASP 13 2HB ASP 13 3.796 -3.323 5.221
121 H SER 14 H SER 14 6.684 -0.606 5.048
122 HA SER 14 HA SER 14 5.288 0.883 6.986
123 HB2 SER 14 1HB SER 14 7.776 1.791 5.500
124 HB3 SER 14 2HB SER 14 7.314 2.179 7.160
125 HG SER 14 HG SER 14 7.738 0.037 7.743
126 H ASP 15 H ASP 15 5.405 1.493 3.525
127 HA ASP 15 HA ASP 15 4.562 4.328 3.775
128 HB2 ASP 15 1HB ASP 15 4.897 2.470 1.390
129 HB3 ASP 15 2HB ASP 15 4.407 4.155 1.276
130 H CYS 16 H CYS 16 3.035 1.243 3.811
131 HA CYS 16 HA CYS 16 0.620 2.138 2.396
132 HB2 CYS 16 1HB CYS 16 1.483 -0.578 3.432
133 HB3 CYS 16 2HB CYS 16 -0.002 -0.251 2.563
134 HA PRO 17 HA PRO 17 -1.583 3.192 5.951
135 HB2 PRO 17 1HB PRO 17 -4.006 3.751 4.932
136 HB3 PRO 17 2HB PRO 17 -2.525 4.580 4.331
137 HG2 PRO 17 1HG PRO 17 -3.883 2.160 3.091
138 HG3 PRO 17 2HG PRO 17 -3.475 3.718 2.301
139 HD2 PRO 17 1HD PRO 17 -1.788 1.583 2.191
140 HD3 PRO 17 2HD PRO 17 -1.189 3.261 2.335
141 H GLY 18 H GLY 18 -2.930 2.450 7.598
142 HA2 GLY 18 1HA GLY 18 -4.185 0.958 8.857
143 HA3 GLY 18 2HA GLY 18 -5.003 0.541 7.344
144 H ALA 19 H ALA 19 -4.974 -1.550 6.966
145 HA ALA 19 HA ALA 19 -2.725 -3.280 7.872
146 HB1 ALA 19 3HB ALA 19 -4.275 -5.110 7.598
147 HB2 ALA 19 1HB ALA 19 -5.093 -3.827 8.504
148 HB3 ALA 19 2HB ALA 19 -5.451 -4.078 6.776
149 H CYS 20 H CYS 20 -3.077 -1.486 5.153
150 HA CYS 20 HA CYS 20 -2.774 -3.412 3.020
151 HB2 CYS 20 1HB CYS 20 -1.895 -0.521 3.218
152 HB3 CYS 20 2HB CYS 20 -1.750 -1.484 1.786
153 H ILE 21 H ILE 21 -1.005 -4.179 1.974
154 HA ILE 21 HA ILE 21 1.738 -3.789 3.145
155 HB ILE 21 HB ILE 21 2.248 -6.076 2.317
156 HG12 ILE 21 1HG1 ILE 21 -0.762 -6.513 2.086
157 HG13 ILE 21 2HG1 ILE 21 0.302 -6.250 0.705
158 HG21 ILE 21 1HG2 ILE 21 1.744 -5.555 4.701
159 HG22 ILE 21 2HG2 ILE 21 0.049 -6.010 4.427
160 HG23 ILE 21 3HG2 ILE 21 1.340 -7.217 4.266
161 HD11 ILE 21 3HD1 ILE 21 -0.071 -8.612 0.946
162 HD12 ILE 21 1HD1 ILE 21 1.622 -8.271 1.355
163 HD13 ILE 21 2HD1 ILE 21 0.434 -8.587 2.643
164 H CYS 22 H CYS 22 3.474 -3.951 1.556
165 HA CYS 22 HA CYS 22 2.702 -2.537 -0.917
166 HB2 CYS 22 1HB CYS 22 4.647 -1.884 0.547
167 HB3 CYS 22 2HB CYS 22 5.468 -3.358 0.033
168 H ARG 23 H ARG 23 2.445 -3.451 -2.859
169 HA ARG 23 HA ARG 23 3.038 -6.346 -3.216
170 HB2 ARG 23 1HB ARG 23 1.333 -4.551 -4.970
171 HB3 ARG 23 2HB ARG 23 1.418 -6.309 -4.982
172 HG2 ARG 23 1HG ARG 23 0.148 -4.508 -2.898
173 HG3 ARG 23 2HG ARG 23 -0.633 -5.696 -3.927
174 HD2 ARG 23 1HD ARG 23 1.209 -6.242 -1.564
175 HD3 ARG 23 2HD ARG 23 -0.528 -6.483 -1.632
176 HE ARG 23 HE ARG 23 -0.154 -8.216 -3.375
177 HH11 ARG 23 1HH1 ARG 23 2.590 -7.567 -1.190
178 HH12 ARG 23 2HH1 ARG 23 3.191 -9.186 -1.363
179 HH21 ARG 23 1HH2 ARG 23 0.722 -10.247 -3.557
180 HH22 ARG 23 2HH2 ARG 23 2.168 -10.666 -2.691
181 H GLY 24 H GLY 24 3.720 -7.047 -5.401
182 HA2 GLY 24 1HA GLY 24 6.332 -6.129 -5.828
183 HA3 GLY 24 2HA GLY 24 5.460 -7.251 -6.888
184 H ASN 25 H ASN 25 3.471 -4.936 -7.468
185 HA ASN 25 HA ASN 25 4.978 -3.736 -9.663
186 HB2 ASN 25 1HB ASN 25 2.952 -2.957 -10.492
187 HB3 ASN 25 2HB ASN 25 2.565 -4.520 -9.792
188 HD21 ASN 25 1HD2 ASN 25 1.224 -4.539 -7.779
189 HD22 ASN 25 2HD2 ASN 25 0.394 -3.072 -7.291
190 H GLY 26 H GLY 26 4.795 -2.882 -6.413
191 HA2 GLY 26 1HA GLY 26 5.901 -1.078 -5.426
192 HA3 GLY 26 2HA GLY 26 5.801 -0.144 -6.937
193 H TYR 27 H TYR 27 2.920 -1.658 -5.576
194 HA TYR 27 HA TYR 27 2.035 0.888 -4.329
195 HB2 TYR 27 1HB TYR 27 0.599 -0.604 -6.529
196 HB3 TYR 27 2HB TYR 27 -0.271 0.385 -5.388
197 HD1 TYR 27 HD1 TYR 27 2.574 0.568 -7.844
198 HD2 TYR 27 HD2 TYR 27 -0.642 2.616 -5.855
199 HE1 TYR 27 HE1 TYR 27 3.041 2.586 -9.191
200 HE2 TYR 27 HE2 TYR 27 -0.268 4.611 -7.286
201 HH TYR 27 HH TYR 27 2.306 4.691 -9.792
202 H CYS 28 H CYS 28 0.282 0.712 -2.893
203 HA CYS 28 HA CYS 28 0.469 -1.564 -1.133
204 HB2 CYS 28 1HB CYS 28 -1.336 0.882 -1.126
205 HB3 CYS 28 2HB CYS 28 -1.133 -0.201 0.250
206 H GLY 29 H GLY 29 -0.916 -3.185 -0.680
207 HA2 GLY 29 1HA GLY 29 -3.709 -3.251 -1.636
208 HA3 GLY 29 2HA GLY 29 -2.639 -4.440 -2.360
209 HN1 NH2 30 2HN NH2 30 -4.043 -6.337 0.382
210 HN2 NH2 30 1HN NH2 30 -4.408 -5.818 -1.252
Start of MODEL 23
1 H1 GLY 1 1H GLY 1 -8.966 -3.541 12.186
2 H2 GLY 1 2H GLY 1 -7.461 -4.186 12.181
3 H3 GLY 1 3H GLY 1 -7.749 -2.786 12.980
4 HA2 GLY 1 1HA GLY 1 -8.226 -1.624 10.937
5 HA3 GLY 1 2HA GLY 1 -6.590 -2.313 10.937
6 H VAL 2 H VAL 2 -7.709 -1.655 8.532
7 HA VAL 2 HA VAL 2 -7.900 -4.216 7.125
8 HB VAL 2 HB VAL 2 -9.818 -3.498 5.734
9 HG11 VAL 2 1HG1 VAL 2 -10.168 -5.107 7.587
10 HG12 VAL 2 2HG1 VAL 2 -10.660 -3.758 8.641
11 HG13 VAL 2 3HG1 VAL 2 -11.611 -4.157 7.200
12 HG21 VAL 2 3HG2 VAL 2 -11.399 -1.775 6.484
13 HG22 VAL 2 1HG2 VAL 2 -10.328 -1.340 7.828
14 HG23 VAL 2 2HG2 VAL 2 -9.819 -1.063 6.147
15 H CYS 3 H CYS 3 -7.590 -3.842 4.749
16 HA CYS 3 HA CYS 3 -5.983 -1.397 4.271
17 HB2 CYS 3 1HB CYS 3 -4.979 -3.509 3.614
18 HB3 CYS 3 2HB CYS 3 -6.377 -3.939 2.651
19 HA PRO 4 HA PRO 4 -9.836 0.169 2.394
20 HB2 PRO 4 1HB PRO 4 -9.024 2.717 1.769
21 HB3 PRO 4 2HB PRO 4 -9.428 2.185 3.430
22 HG2 PRO 4 1HG PRO 4 -6.682 2.343 2.144
23 HG3 PRO 4 2HG PRO 4 -7.197 3.001 3.731
24 HD2 PRO 4 1HD PRO 4 -5.944 0.626 3.556
25 HD3 PRO 4 2HD PRO 4 -7.302 0.838 4.693
26 H LYS 5 H LYS 5 -10.470 1.152 0.279
27 HA LYS 5 HA LYS 5 -9.265 -0.317 -1.896
28 HB2 LYS 5 1HB LYS 5 -11.749 0.139 -1.318
29 HB3 LYS 5 2HB LYS 5 -11.520 1.711 -2.086
30 HG2 LYS 5 1HG LYS 5 -10.865 0.518 -4.209
31 HG3 LYS 5 2HG LYS 5 -11.086 -1.031 -3.377
32 HD2 LYS 5 1HD LYS 5 -13.477 -0.488 -2.999
33 HD3 LYS 5 2HD LYS 5 -13.250 1.078 -3.812
34 HE2 LYS 5 1HE LYS 5 -12.566 -0.107 -5.892
35 HE3 LYS 5 2HE LYS 5 -12.799 -1.664 -5.083
36 HZ1 LYS 5 3HZ LYS 5 -14.733 -1.056 -6.404
37 HZ2 LYS 5 1HZ LYS 5 -15.152 -1.104 -4.827
38 HZ3 LYS 5 2HZ LYS 5 -14.938 0.336 -5.574
39 H ILE 6 H ILE 6 -7.466 1.607 -0.885
40 HA ILE 6 HA ILE 6 -7.249 3.878 -2.769
41 HB ILE 6 HB ILE 6 -6.781 4.024 -0.301
42 HG12 ILE 6 1HG1 ILE 6 -4.435 4.862 -2.043
43 HG13 ILE 6 2HG1 ILE 6 -5.988 5.698 -1.959
44 HG21 ILE 6 1HG2 ILE 6 -5.520 1.827 -0.116
45 HG22 ILE 6 2HG2 ILE 6 -4.145 2.614 -0.917
46 HG23 ILE 6 3HG2 ILE 6 -4.726 3.194 0.654
47 HD11 ILE 6 3HD1 ILE 6 -4.392 6.839 -0.551
48 HD12 ILE 6 1HD1 ILE 6 -5.620 6.086 0.485
49 HD13 ILE 6 2HD1 ILE 6 -4.004 5.353 0.328
50 H LEU 7 H LEU 7 -5.399 4.259 -4.073
51 HA LEU 7 HA LEU 7 -3.644 1.929 -4.690
52 HB2 LEU 7 1HB LEU 7 -5.318 2.267 -6.507
53 HB3 LEU 7 2HB LEU 7 -4.767 3.929 -6.696
54 HG LEU 7 HG LEU 7 -2.501 3.081 -7.345
55 HD11 LEU 7 1HD1 LEU 7 -2.496 0.872 -6.218
56 HD12 LEU 7 2HD1 LEU 7 -3.825 0.327 -7.262
57 HD13 LEU 7 3HD1 LEU 7 -2.227 0.687 -7.952
58 HD21 LEU 7 3HD2 LEU 7 -3.161 2.287 -9.577
59 HD22 LEU 7 1HD2 LEU 7 -4.807 1.963 -8.989
60 HD23 LEU 7 2HD2 LEU 7 -4.189 3.629 -9.048
61 H LYS 8 H LYS 8 -2.202 2.667 -3.193
62 HA LYS 8 HA LYS 8 -0.959 5.371 -3.543
63 HB2 LYS 8 1HB LYS 8 -2.136 4.808 -1.375
64 HB3 LYS 8 2HB LYS 8 -0.959 3.516 -1.106
65 HG2 LYS 8 1HG LYS 8 0.872 5.217 -1.142
66 HG3 LYS 8 2HG LYS 8 -0.326 6.492 -1.446
67 HD2 LYS 8 1HD LYS 8 -1.439 5.866 0.729
68 HD3 LYS 8 2HD LYS 8 -0.104 4.743 1.040
69 HE2 LYS 8 1HE LYS 8 0.204 7.751 0.582
70 HE3 LYS 8 2HE LYS 8 0.101 6.991 2.173
71 HZ1 LYS 8 3HZ LYS 8 2.395 7.351 1.554
72 HZ2 LYS 8 1HZ LYS 8 2.114 5.741 1.658
73 HZ3 LYS 8 2HZ LYS 8 2.245 6.466 0.187
74 H LYS 9 H LYS 9 1.221 5.480 -4.114
75 HA LYS 9 HA LYS 9 2.602 3.019 -4.825
76 HB2 LYS 9 1HB LYS 9 2.757 5.399 -5.890
77 HB3 LYS 9 2HB LYS 9 3.925 5.714 -4.587
78 HG2 LYS 9 1HG LYS 9 5.396 3.957 -5.411
79 HG3 LYS 9 2HG LYS 9 4.169 3.414 -6.561
80 HD2 LYS 9 1HD LYS 9 5.877 4.665 -7.724
81 HD3 LYS 9 2HD LYS 9 4.345 5.546 -7.790
82 HE2 LYS 9 1HE LYS 9 5.110 7.025 -5.939
83 HE3 LYS 9 2HE LYS 9 6.630 6.122 -5.842
84 HZ1 LYS 9 3HZ LYS 9 6.875 8.139 -7.162
85 HZ2 LYS 9 1HZ LYS 9 7.119 6.837 -8.117
86 HZ3 LYS 9 2HZ LYS 9 5.712 7.668 -8.207
87 H CYS 10 H CYS 10 4.724 2.451 -4.054
88 HA CYS 10 HA CYS 10 5.587 3.168 -1.335
89 HB2 CYS 10 1HB CYS 10 5.124 0.969 -0.321
90 HB3 CYS 10 2HB CYS 10 3.658 1.802 -0.806
91 H ARG 11 H ARG 11 7.413 2.153 -0.558
92 HA ARG 11 HA ARG 11 9.118 0.601 -2.478
93 HB2 ARG 11 1HB ARG 11 9.870 2.331 -0.075
94 HB3 ARG 11 2HB ARG 11 10.996 1.340 -1.013
95 HG2 ARG 11 1HG ARG 11 10.461 2.647 -3.058
96 HG3 ARG 11 2HG ARG 11 9.364 3.674 -2.113
97 HD2 ARG 11 1HD ARG 11 11.245 4.368 -0.666
98 HD3 ARG 11 2HD ARG 11 12.349 3.340 -1.605
99 HE ARG 11 HE ARG 11 11.031 5.071 -3.415
100 HH11 ARG 11 1HH1 ARG 11 13.403 5.370 -0.806
101 HH12 ARG 11 2HH1 ARG 11 14.123 6.795 -1.496
102 HH21 ARG 11 1HH2 ARG 11 12.004 6.913 -4.254
103 HH22 ARG 11 2HH2 ARG 11 13.338 7.654 -3.423
104 H ARG 12 H ARG 12 7.638 0.729 0.735
105 HA ARG 12 HA ARG 12 7.695 -2.152 1.009
106 HB2 ARG 12 1HB ARG 12 8.979 -2.316 3.043
107 HB3 ARG 12 2HB ARG 12 9.984 -1.526 1.838
108 HG2 ARG 12 1HG ARG 12 9.333 0.712 2.855
109 HG3 ARG 12 2HG ARG 12 8.490 -0.181 4.125
110 HD2 ARG 12 1HD ARG 12 11.465 -0.283 3.502
111 HD3 ARG 12 2HD ARG 12 10.722 0.553 4.862
112 HE ARG 12 HE ARG 12 11.295 -2.293 4.601
113 HH11 ARG 12 1HH1 ARG 12 9.241 -0.018 6.412
114 HH12 ARG 12 2HH1 ARG 12 9.115 -1.108 7.763
115 HH21 ARG 12 1HH2 ARG 12 11.017 -3.643 6.348
116 HH22 ARG 12 2HH2 ARG 12 10.067 -3.137 7.711
117 H ASP 13 H ASP 13 6.830 -2.700 3.362
118 HA ASP 13 HA ASP 13 4.131 -1.967 3.167
119 HB2 ASP 13 1HB ASP 13 5.521 -3.168 5.592
120 HB3 ASP 13 2HB ASP 13 3.806 -3.281 5.203
121 H SER 14 H SER 14 6.601 -0.416 5.173
122 HA SER 14 HA SER 14 4.786 0.948 6.959
123 HB2 SER 14 1HB SER 14 6.780 2.331 7.506
124 HB3 SER 14 2HB SER 14 7.050 0.592 7.619
125 HG SER 14 HG SER 14 7.959 2.388 5.617
126 H ASP 15 H ASP 15 5.377 1.504 3.623
127 HA ASP 15 HA ASP 15 4.641 4.373 3.673
128 HB2 ASP 15 1HB ASP 15 4.825 2.394 1.379
129 HB3 ASP 15 2HB ASP 15 4.630 4.133 1.223
130 H CYS 16 H CYS 16 2.988 1.375 3.885
131 HA CYS 16 HA CYS 16 0.593 2.277 2.397
132 HB2 CYS 16 1HB CYS 16 1.445 -0.448 3.424
133 HB3 CYS 16 2HB CYS 16 -0.008 -0.106 2.505
134 HA PRO 17 HA PRO 17 -1.536 3.200 6.063
135 HB2 PRO 17 1HB PRO 17 -3.938 3.911 5.112
136 HB3 PRO 17 2HB PRO 17 -2.433 4.710 4.525
137 HG2 PRO 17 1HG PRO 17 -3.922 2.425 3.183
138 HG3 PRO 17 2HG PRO 17 -3.444 4.007 2.479
139 HD2 PRO 17 1HD PRO 17 -1.866 1.781 2.239
140 HD3 PRO 17 2HD PRO 17 -1.193 3.428 2.416
141 H GLY 18 H GLY 18 -3.016 2.468 7.640
142 HA2 GLY 18 1HA GLY 18 -4.323 0.939 8.803
143 HA3 GLY 18 2HA GLY 18 -5.052 0.527 7.243
144 H ALA 19 H ALA 19 -4.973 -1.571 6.882
145 HA ALA 19 HA ALA 19 -2.671 -3.229 7.799
146 HB1 ALA 19 3HB ALA 19 -4.150 -5.113 7.543
147 HB2 ALA 19 1HB ALA 19 -5.019 -3.860 8.442
148 HB3 ALA 19 2HB ALA 19 -5.366 -4.134 6.714
149 H CYS 20 H CYS 20 -3.064 -1.430 5.108
150 HA CYS 20 HA CYS 20 -2.722 -3.319 2.948
151 HB2 CYS 20 1HB CYS 20 -1.892 -0.417 3.187
152 HB3 CYS 20 2HB CYS 20 -1.756 -1.357 1.737
153 H ILE 21 H ILE 21 -0.950 -4.075 1.921
154 HA ILE 21 HA ILE 21 1.786 -3.666 3.096
155 HB ILE 21 HB ILE 21 2.286 -5.978 2.289
156 HG12 ILE 21 1HG1 ILE 21 -0.725 -6.410 2.131
157 HG13 ILE 21 2HG1 ILE 21 0.300 -6.156 0.720
158 HG21 ILE 21 1HG2 ILE 21 1.832 -5.408 4.671
159 HG22 ILE 21 2HG2 ILE 21 0.127 -5.844 4.435
160 HG23 ILE 21 3HG2 ILE 21 1.400 -7.072 4.275
161 HD11 ILE 21 3HD1 ILE 21 -0.060 -8.519 0.998
162 HD12 ILE 21 1HD1 ILE 21 1.644 -8.167 1.349
163 HD13 ILE 21 2HD1 ILE 21 0.499 -8.474 2.678
164 H CYS 22 H CYS 22 3.533 -3.833 1.527
165 HA CYS 22 HA CYS 22 2.773 -2.457 -0.975
166 HB2 CYS 22 1HB CYS 22 4.709 -1.776 0.517
167 HB3 CYS 22 2HB CYS 22 5.542 -3.238 -0.007
168 H ARG 23 H ARG 23 2.440 -3.457 -2.859
169 HA ARG 23 HA ARG 23 3.050 -6.350 -3.133
170 HB2 ARG 23 1HB ARG 23 1.323 -4.583 -4.895
171 HB3 ARG 23 2HB ARG 23 1.406 -6.339 -4.903
172 HG2 ARG 23 1HG ARG 23 0.201 -4.538 -2.774
173 HG3 ARG 23 2HG ARG 23 -0.627 -5.687 -3.813
174 HD2 ARG 23 1HD ARG 23 1.272 -6.333 -1.523
175 HD3 ARG 23 2HD ARG 23 -0.476 -6.528 -1.535
176 HE ARG 23 HE ARG 23 -0.199 -8.208 -3.356
177 HH11 ARG 23 1HH1 ARG 23 2.566 -7.740 -1.162
178 HH12 ARG 23 2HH1 ARG 23 3.142 -9.354 -1.435
179 HH21 ARG 23 1HH2 ARG 23 0.630 -10.246 -3.657
180 HH22 ARG 23 2HH2 ARG 23 2.072 -10.744 -2.827
181 H GLY 24 H GLY 24 3.588 -7.098 -5.398
182 HA2 GLY 24 1HA GLY 24 6.220 -6.225 -5.976
183 HA3 GLY 24 2HA GLY 24 5.272 -7.374 -6.943
184 H ASN 25 H ASN 25 3.258 -5.028 -7.351
185 HA ASN 25 HA ASN 25 4.489 -3.830 -9.711
186 HB2 ASN 25 1HB ASN 25 2.333 -2.859 -10.100
187 HB3 ASN 25 2HB ASN 25 2.120 -4.545 -9.658
188 HD21 ASN 25 1HD2 ASN 25 -0.074 -2.908 -9.529
189 HD22 ASN 25 2HD2 ASN 25 -0.478 -2.588 -7.851
190 H GLY 26 H GLY 26 4.727 -3.027 -6.436
191 HA2 GLY 26 1HA GLY 26 5.887 -1.225 -5.511
192 HA3 GLY 26 2HA GLY 26 5.711 -0.300 -7.022
193 H TYR 27 H TYR 27 2.767 -1.685 -5.797
194 HA TYR 27 HA TYR 27 2.028 0.853 -4.413
195 HB2 TYR 27 1HB TYR 27 0.526 -0.611 -6.594
196 HB3 TYR 27 2HB TYR 27 -0.310 0.367 -5.414
197 HD1 TYR 27 HD2 TYR 27 2.522 0.595 -7.903
198 HD2 TYR 27 HD1 TYR 27 -0.631 2.622 -5.788
199 HE1 TYR 27 HE2 TYR 27 3.048 2.685 -9.132
200 HE2 TYR 27 HE1 TYR 27 -0.148 4.709 -7.047
201 HH TYR 27 HH TYR 27 1.172 5.706 -8.640
202 H CYS 28 H CYS 28 0.353 0.757 -2.915
203 HA CYS 28 HA CYS 28 0.505 -1.477 -1.110
204 HB2 CYS 28 1HB CYS 28 -1.256 1.000 -1.150
205 HB3 CYS 28 2HB CYS 28 -1.069 -0.058 0.247
206 H GLY 29 H GLY 29 -0.890 -3.100 -0.665
207 HA2 GLY 29 1HA GLY 29 -3.697 -3.134 -1.564
208 HA3 GLY 29 2HA GLY 29 -2.650 -4.290 -2.370
209 HN1 NH2 30 2HN NH2 30 -3.949 -6.333 0.309
210 HN2 NH2 30 1HN NH2 30 -4.334 -5.763 -1.303
Start of MODEL 24
1 H1 GLY 1 1H GLY 1 -8.915 -3.425 12.210
2 H2 GLY 1 2H GLY 1 -7.446 -4.149 12.153
3 H3 GLY 1 3H GLY 1 -7.644 -2.761 13.000
4 HA2 GLY 1 1HA GLY 1 -8.097 -1.511 11.004
5 HA3 GLY 1 2HA GLY 1 -6.501 -2.287 10.946
6 H VAL 2 H VAL 2 -7.577 -1.509 8.581
7 HA VAL 2 HA VAL 2 -7.974 -4.013 7.116
8 HB VAL 2 HB VAL 2 -9.839 -3.112 5.755
9 HG11 VAL 2 1HG1 VAL 2 -10.297 -4.747 7.560
10 HG12 VAL 2 2HG1 VAL 2 -10.683 -3.398 8.658
11 HG13 VAL 2 3HG1 VAL 2 -11.668 -3.681 7.213
12 HG21 VAL 2 3HG2 VAL 2 -11.285 -1.301 6.568
13 HG22 VAL 2 1HG2 VAL 2 -10.178 -0.988 7.917
14 HG23 VAL 2 2HG2 VAL 2 -9.657 -0.697 6.242
15 H CYS 3 H CYS 3 -7.610 -3.640 4.771
16 HA CYS 3 HA CYS 3 -5.796 -1.340 4.335
17 HB2 CYS 3 1HB CYS 3 -4.957 -3.500 3.666
18 HB3 CYS 3 2HB CYS 3 -6.396 -3.855 2.739
19 HA PRO 4 HA PRO 4 -9.442 0.628 2.421
20 HB2 PRO 4 1HB PRO 4 -8.315 3.040 1.711
21 HB3 PRO 4 2HB PRO 4 -8.841 2.628 3.372
22 HG2 PRO 4 1HG PRO 4 -6.050 2.411 2.199
23 HG3 PRO 4 2HG PRO 4 -6.542 3.175 3.746
24 HD2 PRO 4 1HD PRO 4 -5.572 0.673 3.706
25 HD3 PRO 4 2HD PRO 4 -6.959 1.063 4.755
26 H LYS 5 H LYS 5 -10.136 1.128 0.314
27 HA LYS 5 HA LYS 5 -8.797 -0.497 -1.666
28 HB2 LYS 5 1HB LYS 5 -11.403 1.089 -1.741
29 HB3 LYS 5 2HB LYS 5 -10.890 -0.079 -2.965
30 HG2 LYS 5 1HG LYS 5 -10.849 -1.879 -1.249
31 HG3 LYS 5 2HG LYS 5 -11.449 -0.727 -0.038
32 HD2 LYS 5 1HD LYS 5 -13.485 -0.343 -1.404
33 HD3 LYS 5 2HD LYS 5 -12.892 -1.507 -2.611
34 HE2 LYS 5 1HE LYS 5 -12.869 -3.289 -0.874
35 HE3 LYS 5 2HE LYS 5 -13.461 -2.132 0.326
36 HZ1 LYS 5 3HZ LYS 5 -15.267 -3.451 -0.598
37 HZ2 LYS 5 1HZ LYS 5 -15.481 -1.885 -1.008
38 HZ3 LYS 5 2HZ LYS 5 -14.933 -2.956 -2.116
39 H ILE 6 H ILE 6 -7.647 2.229 -1.009
40 HA ILE 6 HA ILE 6 -7.718 3.697 -3.583
41 HB ILE 6 HB ILE 6 -6.195 5.285 -2.521
42 HG12 ILE 6 1HG1 ILE 6 -6.336 3.542 -0.017
43 HG13 ILE 6 2HG1 ILE 6 -4.920 3.734 -1.053
44 HG21 ILE 6 1HG2 ILE 6 -8.689 5.429 -2.296
45 HG22 ILE 6 2HG2 ILE 6 -8.560 4.655 -0.702
46 HG23 ILE 6 3HG2 ILE 6 -7.815 6.240 -0.998
47 HD11 ILE 6 3HD1 ILE 6 -4.639 5.140 0.868
48 HD12 ILE 6 1HD1 ILE 6 -4.900 6.182 -0.543
49 HD13 ILE 6 2HD1 ILE 6 -6.214 5.908 0.631
50 H LEU 7 H LEU 7 -5.978 4.031 -4.971
51 HA LEU 7 HA LEU 7 -3.914 1.893 -4.974
52 HB2 LEU 7 1HB LEU 7 -5.381 2.195 -6.960
53 HB3 LEU 7 2HB LEU 7 -4.792 3.845 -7.139
54 HG LEU 7 HG LEU 7 -2.498 2.973 -7.553
55 HD11 LEU 7 1HD1 LEU 7 -2.593 0.806 -6.344
56 HD12 LEU 7 2HD1 LEU 7 -3.826 0.219 -7.478
57 HD13 LEU 7 3HD1 LEU 7 -2.174 0.552 -8.039
58 HD21 LEU 7 3HD2 LEU 7 -2.948 2.089 -9.802
59 HD22 LEU 7 1HD2 LEU 7 -4.641 1.782 -9.356
60 HD23 LEU 7 2HD2 LEU 7 -4.020 3.447 -9.423
61 H LYS 8 H LYS 8 -2.492 2.583 -3.459
62 HA LYS 8 HA LYS 8 -1.215 5.284 -3.722
63 HB2 LYS 8 1HB LYS 8 -2.402 4.677 -1.545
64 HB3 LYS 8 2HB LYS 8 -1.220 3.376 -1.328
65 HG2 LYS 8 1HG LYS 8 0.584 5.223 -1.590
66 HG3 LYS 8 2HG LYS 8 -0.729 6.389 -1.448
67 HD2 LYS 8 1HD LYS 8 -1.255 5.523 0.795
68 HD3 LYS 8 2HD LYS 8 0.006 4.280 0.630
69 HE2 LYS 8 1HE LYS 8 0.570 7.270 0.417
70 HE3 LYS 8 2HE LYS 8 0.638 6.398 1.952
71 HZ1 LYS 8 3HZ LYS 8 2.821 6.578 0.834
72 HZ2 LYS 8 1HZ LYS 8 2.392 5.035 1.128
73 HZ3 LYS 8 2HZ LYS 8 2.300 5.631 -0.398
74 H LYS 9 H LYS 9 0.936 5.343 -4.382
75 HA LYS 9 HA LYS 9 2.428 2.891 -4.871
76 HB2 LYS 9 1HB LYS 9 4.258 4.353 -5.530
77 HB3 LYS 9 2HB LYS 9 2.738 4.798 -6.304
78 HG2 LYS 9 1HG LYS 9 2.415 6.647 -4.750
79 HG3 LYS 9 2HG LYS 9 3.850 6.162 -3.833
80 HD2 LYS 9 1HD LYS 9 4.389 8.069 -5.243
81 HD3 LYS 9 2HD LYS 9 5.288 6.646 -5.791
82 HE2 LYS 9 1HE LYS 9 3.631 6.294 -7.613
83 HE3 LYS 9 2HE LYS 9 2.697 7.685 -7.040
84 HZ1 LYS 9 3HZ LYS 9 4.147 8.284 -8.885
85 HZ2 LYS 9 1HZ LYS 9 4.614 9.094 -7.546
86 HZ3 LYS 9 2HZ LYS 9 5.479 7.807 -8.070
87 H CYS 10 H CYS 10 4.526 2.368 -3.961
88 HA CYS 10 HA CYS 10 5.174 3.348 -1.252
89 HB2 CYS 10 1HB CYS 10 4.860 1.107 -0.195
90 HB3 CYS 10 2HB CYS 10 3.380 1.872 -0.736
91 H ARG 11 H ARG 11 7.090 2.765 -0.388
92 HA ARG 11 HA ARG 11 9.142 1.505 -2.111
93 HB2 ARG 11 1HB ARG 11 9.582 3.593 -0.846
94 HB3 ARG 11 2HB ARG 11 9.308 2.734 0.677
95 HG2 ARG 11 1HG ARG 11 11.257 1.269 0.215
96 HG3 ARG 11 2HG ARG 11 11.463 2.030 -1.371
97 HD2 ARG 11 1HD ARG 11 13.087 2.983 0.137
98 HD3 ARG 11 2HD ARG 11 11.895 4.212 -0.254
99 HE ARG 11 HE ARG 11 11.139 4.240 1.937
100 HH11 ARG 11 1HH1 ARG 11 13.410 1.540 1.638
101 HH12 ARG 11 2HH1 ARG 11 13.571 1.366 3.361
102 HH21 ARG 11 1HH2 ARG 11 11.353 3.935 4.138
103 HH22 ARG 11 2HH2 ARG 11 12.405 2.700 4.758
104 H ARG 12 H ARG 12 7.405 0.898 0.924
105 HA ARG 12 HA ARG 12 7.583 -1.957 0.789
106 HB2 ARG 12 1HB ARG 12 8.930 -2.417 2.736
107 HB3 ARG 12 2HB ARG 12 9.899 -1.465 1.625
108 HG2 ARG 12 1HG ARG 12 9.443 0.588 2.972
109 HG3 ARG 12 2HG ARG 12 8.437 -0.376 4.066
110 HD2 ARG 12 1HD ARG 12 10.469 -1.826 4.520
111 HD3 ARG 12 2HD ARG 12 11.428 -0.621 3.631
112 HE ARG 12 HE ARG 12 9.752 0.583 5.670
113 HH11 ARG 12 1HH1 ARG 12 12.786 -1.229 5.411
114 HH12 ARG 12 2HH1 ARG 12 13.413 -0.562 6.890
115 HH21 ARG 12 1HH2 ARG 12 10.607 1.395 7.549
116 HH22 ARG 12 2HH2 ARG 12 12.184 0.907 8.094
117 H ASP 13 H ASP 13 6.822 -2.820 3.126
118 HA ASP 13 HA ASP 13 4.107 -2.147 3.169
119 HB2 ASP 13 1HB ASP 13 5.639 -3.487 5.424
120 HB3 ASP 13 2HB ASP 13 3.923 -3.647 5.068
121 H SER 14 H SER 14 6.666 -0.791 5.239
122 HA SER 14 HA SER 14 4.961 0.387 7.226
123 HB2 SER 14 1HB SER 14 6.929 1.684 7.843
124 HB3 SER 14 2HB SER 14 7.362 -0.002 7.551
125 HG SER 14 HG SER 14 7.793 2.231 5.833
126 H ASP 15 H ASP 15 5.471 1.313 3.934
127 HA ASP 15 HA ASP 15 4.575 4.114 4.378
128 HB2 ASP 15 1HB ASP 15 6.566 3.539 2.927
129 HB3 ASP 15 2HB ASP 15 5.454 2.735 1.817
130 H CYS 16 H CYS 16 3.090 1.167 4.052
131 HA CYS 16 HA CYS 16 0.820 2.139 2.388
132 HB2 CYS 16 1HB CYS 16 1.643 -0.616 3.320
133 HB3 CYS 16 2HB CYS 16 0.101 -0.262 2.569
134 HA PRO 17 HA PRO 17 -1.448 3.201 5.884
135 HB2 PRO 17 1HB PRO 17 -3.852 3.786 4.828
136 HB3 PRO 17 2HB PRO 17 -2.349 4.603 4.260
137 HG2 PRO 17 1HG PRO 17 -3.705 2.204 2.978
138 HG3 PRO 17 2HG PRO 17 -3.273 3.767 2.209
139 HD2 PRO 17 1HD PRO 17 -1.593 1.631 2.103
140 HD3 PRO 17 2HD PRO 17 -0.985 3.302 2.300
141 H GLY 18 H GLY 18 -2.806 2.477 7.520
142 HA2 GLY 18 1HA GLY 18 -4.088 1.001 8.773
143 HA3 GLY 18 2HA GLY 18 -4.897 0.579 7.256
144 H ALA 19 H ALA 19 -4.883 -1.519 6.914
145 HA ALA 19 HA ALA 19 -2.638 -3.248 7.828
146 HB1 ALA 19 3HB ALA 19 -4.194 -5.075 7.560
147 HB2 ALA 19 1HB ALA 19 -5.010 -3.786 8.456
148 HB3 ALA 19 2HB ALA 19 -5.364 -4.044 6.728
149 H CYS 20 H CYS 20 -2.975 -1.468 5.102
150 HA CYS 20 HA CYS 20 -2.704 -3.396 2.974
151 HB2 CYS 20 1HB CYS 20 -1.806 -0.511 3.192
152 HB3 CYS 20 2HB CYS 20 -1.632 -1.453 1.753
153 H ILE 21 H ILE 21 -0.970 -4.215 1.932
154 HA ILE 21 HA ILE 21 1.799 -3.868 3.060
155 HB ILE 21 HB ILE 21 2.268 -6.122 2.110
156 HG12 ILE 21 1HG1 ILE 21 -0.747 -6.525 1.938
157 HG13 ILE 21 2HG1 ILE 21 0.276 -6.190 0.540
158 HG21 ILE 21 1HG2 ILE 21 1.828 -5.704 4.526
159 HG22 ILE 21 2HG2 ILE 21 0.118 -6.113 4.272
160 HG23 ILE 21 3HG2 ILE 21 1.381 -7.337 4.027
161 HD11 ILE 21 3HD1 ILE 21 -0.100 -8.564 0.671
162 HD12 ILE 21 1HD1 ILE 21 1.607 -8.247 1.044
163 HD13 ILE 21 2HD1 ILE 21 0.458 -8.626 2.350
164 H CYS 22 H CYS 22 3.514 -3.958 1.448
165 HA CYS 22 HA CYS 22 2.705 -2.473 -0.992
166 HB2 CYS 22 1HB CYS 22 4.569 -1.724 0.540
167 HB3 CYS 22 2HB CYS 22 5.494 -3.128 0.007
168 H ARG 23 H ARG 23 2.247 -3.547 -2.788
169 HA ARG 23 HA ARG 23 2.984 -6.373 -3.135
170 HB2 ARG 23 1HB ARG 23 1.316 -4.551 -4.909
171 HB3 ARG 23 2HB ARG 23 1.415 -6.304 -5.005
172 HG2 ARG 23 1HG ARG 23 0.163 -4.644 -2.779
173 HG3 ARG 23 2HG ARG 23 -0.667 -5.658 -3.950
174 HD2 ARG 23 1HD ARG 23 1.175 -6.615 -1.723
175 HD3 ARG 23 2HD ARG 23 -0.582 -6.717 -1.744
176 HE ARG 23 HE ARG 23 -0.369 -8.183 -3.771
177 HH11 ARG 23 1HH1 ARG 23 2.294 -8.189 -1.414
178 HH12 ARG 23 2HH1 ARG 23 2.799 -9.782 -1.883
179 HH21 ARG 23 1HH2 ARG 23 0.353 -10.215 -4.306
180 HH22 ARG 23 2HH2 ARG 23 1.718 -10.909 -3.487
181 H GLY 24 H GLY 24 3.624 -7.103 -5.378
182 HA2 GLY 24 1HA GLY 24 6.265 -6.201 -5.864
183 HA3 GLY 24 2HA GLY 24 5.360 -7.351 -6.869
184 H ASN 25 H ASN 25 3.337 -5.021 -7.327
185 HA ASN 25 HA ASN 25 4.637 -3.794 -9.636
186 HB2 ASN 25 1HB ASN 25 2.483 -2.846 -10.094
187 HB3 ASN 25 2HB ASN 25 2.279 -4.540 -9.674
188 HD21 ASN 25 1HD2 ASN 25 0.054 -2.948 -9.611
189 HD22 ASN 25 2HD2 ASN 25 -0.411 -2.640 -7.945
190 H GLY 26 H GLY 26 4.735 -3.001 -6.345
191 HA2 GLY 26 1HA GLY 26 5.836 -1.194 -5.368
192 HA3 GLY 26 2HA GLY 26 5.731 -0.270 -6.887
193 H TYR 27 H TYR 27 2.758 -1.680 -5.744
194 HA TYR 27 HA TYR 27 1.917 0.880 -4.440
195 HB2 TYR 27 1HB TYR 27 0.489 -0.721 -6.599
196 HB3 TYR 27 2HB TYR 27 -0.381 0.289 -5.472
197 HD1 TYR 27 HD2 TYR 27 2.543 0.519 -7.862
198 HD2 TYR 27 HD1 TYR 27 -0.778 2.503 -5.970
199 HE1 TYR 27 HE2 TYR 27 3.078 2.590 -9.107
200 HE2 TYR 27 HE1 TYR 27 -0.295 4.565 -7.269
201 HH TYR 27 HH TYR 27 1.041 5.540 -8.863
202 H CYS 28 H CYS 28 0.167 0.704 -2.971
203 HA CYS 28 HA CYS 28 0.399 -1.522 -1.150
204 HB2 CYS 28 1HB CYS 28 -1.399 0.927 -1.187
205 HB3 CYS 28 2HB CYS 28 -1.216 -0.135 0.202
206 H GLY 29 H GLY 29 -0.968 -3.148 -0.661
207 HA2 GLY 29 1HA GLY 29 -3.762 -3.273 -1.577
208 HA3 GLY 29 2HA GLY 29 -2.684 -4.407 -2.372
209 HN1 NH2 30 2HN NH2 30 -3.924 -6.464 0.323
210 HN2 NH2 30 1HN NH2 30 -4.318 -5.924 -1.298
Start of MODEL 25
1 H1 GLY 1 1H GLY 1 -9.203 -3.810 12.198
2 H2 GLY 1 2H GLY 1 -7.878 -4.759 12.045
3 H3 GLY 1 3H GLY 1 -7.836 -3.447 13.023
4 HA2 GLY 1 1HA GLY 1 -8.077 -1.951 11.166
5 HA3 GLY 1 2HA GLY 1 -6.638 -2.976 11.002
6 H VAL 2 H VAL 2 -7.407 -1.889 8.721
7 HA VAL 2 HA VAL 2 -8.164 -4.089 7.022
8 HB VAL 2 HB VAL 2 -10.425 -3.389 7.749
9 HG11 VAL 2 1HG1 VAL 2 -10.019 -0.975 8.164
10 HG12 VAL 2 2HG1 VAL 2 -9.868 -0.707 6.412
11 HG13 VAL 2 3HG1 VAL 2 -11.406 -1.254 7.102
12 HG21 VAL 2 3HG2 VAL 2 -11.477 -3.289 5.602
13 HG22 VAL 2 1HG2 VAL 2 -10.006 -2.688 4.827
14 HG23 VAL 2 2HG2 VAL 2 -10.058 -4.343 5.480
15 H CYS 3 H CYS 3 -7.693 -3.635 4.809
16 HA CYS 3 HA CYS 3 -5.911 -1.295 4.434
17 HB2 CYS 3 1HB CYS 3 -5.003 -3.420 3.773
18 HB3 CYS 3 2HB CYS 3 -6.406 -3.812 2.809
19 HA PRO 4 HA PRO 4 -9.437 0.608 2.185
20 HB2 PRO 4 1HB PRO 4 -8.268 3.019 1.576
21 HB3 PRO 4 2HB PRO 4 -8.969 2.632 3.178
22 HG2 PRO 4 1HG PRO 4 -6.063 2.446 2.325
23 HG3 PRO 4 2HG PRO 4 -6.735 3.218 3.798
24 HD2 PRO 4 1HD PRO 4 -5.718 0.726 3.880
25 HD3 PRO 4 2HD PRO 4 -7.199 1.116 4.794
26 H LYS 5 H LYS 5 -9.897 0.696 0.013
27 HA LYS 5 HA LYS 5 -8.000 -0.720 -1.682
28 HB2 LYS 5 1HB LYS 5 -10.845 0.180 -2.275
29 HB3 LYS 5 2HB LYS 5 -9.922 -1.045 -3.142
30 HG2 LYS 5 1HG LYS 5 -10.980 -1.226 -0.297
31 HG3 LYS 5 2HG LYS 5 -11.539 -2.117 -1.708
32 HD2 LYS 5 1HD LYS 5 -9.330 -3.258 -1.869
33 HD3 LYS 5 2HD LYS 5 -8.786 -2.425 -0.408
34 HE2 LYS 5 1HE LYS 5 -11.174 -4.318 -0.566
35 HE3 LYS 5 2HE LYS 5 -9.557 -4.758 -0.006
36 HZ1 LYS 5 3HZ LYS 5 -10.922 -4.252 1.879
37 HZ2 LYS 5 1HZ LYS 5 -9.808 -3.050 1.757
38 HZ3 LYS 5 2HZ LYS 5 -11.361 -2.794 1.292
39 H ILE 6 H ILE 6 -7.189 1.935 -1.153
40 HA ILE 6 HA ILE 6 -7.474 3.518 -3.643
41 HB ILE 6 HB ILE 6 -5.958 5.117 -2.543
42 HG12 ILE 6 1HG1 ILE 6 -5.992 3.246 -0.126
43 HG13 ILE 6 2HG1 ILE 6 -4.608 3.512 -1.187
44 HG21 ILE 6 1HG2 ILE 6 -8.444 5.171 -2.258
45 HG22 ILE 6 2HG2 ILE 6 -8.264 4.293 -0.723
46 HG23 ILE 6 3HG2 ILE 6 -7.573 5.917 -0.920
47 HD11 ILE 6 3HD1 ILE 6 -4.302 4.827 0.787
48 HD12 ILE 6 1HD1 ILE 6 -4.624 5.936 -0.559
49 HD13 ILE 6 2HD1 ILE 6 -5.898 5.573 0.634
50 H LEU 7 H LEU 7 -5.794 4.036 -5.075
51 HA LEU 7 HA LEU 7 -3.629 2.013 -5.277
52 HB2 LEU 7 1HB LEU 7 -5.140 2.428 -7.215
53 HB3 LEU 7 2HB LEU 7 -4.601 4.104 -7.264
54 HG LEU 7 HG LEU 7 -2.277 3.322 -7.745
55 HD11 LEU 7 1HD1 LEU 7 -2.318 1.056 -6.743
56 HD12 LEU 7 2HD1 LEU 7 -3.552 0.548 -7.915
57 HD13 LEU 7 3HD1 LEU 7 -1.911 0.963 -8.457
58 HD21 LEU 7 3HD2 LEU 7 -2.713 2.640 -10.066
59 HD22 LEU 7 1HD2 LEU 7 -4.400 2.260 -9.651
60 HD23 LEU 7 2HD2 LEU 7 -3.812 3.935 -9.566
61 H LYS 8 H LYS 8 -2.346 2.693 -3.607
62 HA LYS 8 HA LYS 8 -1.118 5.427 -3.699
63 HB2 LYS 8 1HB LYS 8 -2.438 4.779 -1.682
64 HB3 LYS 8 2HB LYS 8 -1.359 3.400 -1.419
65 HG2 LYS 8 1HG LYS 8 0.557 4.974 -1.132
66 HG3 LYS 8 2HG LYS 8 -0.534 6.347 -1.424
67 HD2 LYS 8 1HD LYS 8 -1.845 5.722 0.596
68 HD3 LYS 8 2HD LYS 8 -0.821 4.294 0.798
69 HE2 LYS 8 1HE LYS 8 -0.052 5.926 2.371
70 HE3 LYS 8 2HE LYS 8 1.173 5.769 1.112
71 HZ1 LYS 8 3HZ LYS 8 0.726 8.090 1.678
72 HZ2 LYS 8 1HZ LYS 8 0.314 7.828 0.121
73 HZ3 LYS 8 2HZ LYS 8 -0.848 7.949 1.271
74 H LYS 9 H LYS 9 1.039 5.584 -4.231
75 HA LYS 9 HA LYS 9 2.594 3.287 -5.012
76 HB2 LYS 9 1HB LYS 9 3.324 6.198 -4.369
77 HB3 LYS 9 2HB LYS 9 4.512 5.025 -4.939
78 HG2 LYS 9 1HG LYS 9 3.233 4.644 -6.979
79 HG3 LYS 9 2HG LYS 9 2.038 5.863 -6.497
80 HD2 LYS 9 1HD LYS 9 5.013 6.327 -6.992
81 HD3 LYS 9 2HD LYS 9 3.738 6.694 -8.145
82 HE2 LYS 9 1HE LYS 9 3.980 7.983 -5.383
83 HE3 LYS 9 2HE LYS 9 4.648 8.668 -6.864
84 HZ1 LYS 9 3HZ LYS 9 2.498 9.624 -6.385
85 HZ2 LYS 9 1HZ LYS 9 2.407 8.782 -7.778
86 HZ3 LYS 9 2HZ LYS 9 1.760 8.169 -6.402
87 H CYS 10 H CYS 10 4.481 2.405 -4.111
88 HA CYS 10 HA CYS 10 5.426 3.185 -1.431
89 HB2 CYS 10 1HB CYS 10 4.986 1.034 -0.342
90 HB3 CYS 10 2HB CYS 10 3.495 1.802 -0.853
91 H ARG 11 H ARG 11 7.262 2.068 -0.681
92 HA ARG 11 HA ARG 11 8.819 0.416 -2.651
93 HB2 ARG 11 1HB ARG 11 9.817 2.234 -0.412
94 HB3 ARG 11 2HB ARG 11 10.834 1.222 -1.427
95 HG2 ARG 11 1HG ARG 11 9.183 3.593 -2.421
96 HG3 ARG 11 2HG ARG 11 10.893 3.611 -2.022
97 HD2 ARG 11 1HD ARG 11 10.851 3.466 -4.346
98 HD3 ARG 11 2HD ARG 11 11.256 1.827 -3.808
99 HE ARG 11 HE ARG 11 8.446 1.945 -4.078
100 HH11 ARG 11 1HH1 ARG 11 11.184 2.176 -6.307
101 HH12 ARG 11 2HH1 ARG 11 10.239 1.593 -7.646
102 HH21 ARG 11 1HH2 ARG 11 7.316 1.226 -5.756
103 HH22 ARG 11 2HH2 ARG 11 8.038 1.061 -7.342
104 H ARG 12 H ARG 12 7.444 0.705 0.558
105 HA ARG 12 HA ARG 12 7.714 -2.130 1.096
106 HB2 ARG 12 1HB ARG 12 8.972 -1.837 3.237
107 HB3 ARG 12 2HB ARG 12 9.944 -1.425 1.831
108 HG2 ARG 12 1HG ARG 12 9.561 0.987 2.221
109 HG3 ARG 12 2HG ARG 12 8.504 0.611 3.593
110 HD2 ARG 12 1HD ARG 12 10.404 -0.443 4.772
111 HD3 ARG 12 2HD ARG 12 11.457 -0.109 3.378
112 HE ARG 12 HE ARG 12 10.217 2.315 4.239
113 HH11 ARG 12 1HH1 ARG 12 12.743 0.097 5.342
114 HH12 ARG 12 2HH1 ARG 12 13.586 1.340 6.217
115 HH21 ARG 12 1HH2 ARG 12 11.357 3.878 5.376
116 HH22 ARG 12 2HH2 ARG 12 12.806 3.454 6.237
117 H ASP 13 H ASP 13 6.857 -2.655 3.333
118 HA ASP 13 HA ASP 13 4.135 -1.978 3.192
119 HB2 ASP 13 1HB ASP 13 5.587 -3.197 5.571
120 HB3 ASP 13 2HB ASP 13 3.871 -3.339 5.202
121 H SER 14 H SER 14 6.625 -0.431 5.183
122 HA SER 14 HA SER 14 4.797 0.898 6.994
123 HB2 SER 14 1HB SER 14 6.802 2.248 7.584
124 HB3 SER 14 2HB SER 14 7.030 0.500 7.706
125 HG SER 14 HG SER 14 8.796 1.547 6.690
126 H ASP 15 H ASP 15 5.409 1.497 3.676
127 HA ASP 15 HA ASP 15 4.705 4.371 3.747
128 HB2 ASP 15 1HB ASP 15 4.731 2.394 1.441
129 HB3 ASP 15 2HB ASP 15 4.578 4.136 1.306
130 H CYS 16 H CYS 16 3.056 1.352 3.918
131 HA CYS 16 HA CYS 16 0.600 2.303 2.581
132 HB2 CYS 16 1HB CYS 16 1.518 -0.453 3.448
133 HB3 CYS 16 2HB CYS 16 0.021 -0.090 2.609
134 HA PRO 17 HA PRO 17 -1.384 3.057 6.380
135 HB2 PRO 17 1HB PRO 17 -3.804 3.853 5.539
136 HB3 PRO 17 2HB PRO 17 -2.306 4.664 4.949
137 HG2 PRO 17 1HG PRO 17 -3.844 2.449 3.542
138 HG3 PRO 17 2HG PRO 17 -3.408 4.068 2.899
139 HD2 PRO 17 1HD PRO 17 -1.812 1.897 2.474
140 HD3 PRO 17 2HD PRO 17 -1.135 3.527 2.788
141 H GLY 18 H GLY 18 -2.868 2.293 7.938
142 HA2 GLY 18 1HA GLY 18 -4.211 0.762 9.049
143 HA3 GLY 18 2HA GLY 18 -4.970 0.451 7.480
144 H ALA 19 H ALA 19 -4.951 -1.608 6.957
145 HA ALA 19 HA ALA 19 -2.766 -3.430 7.851
146 HB1 ALA 19 3HB ALA 19 -4.333 -5.218 7.399
147 HB2 ALA 19 1HB ALA 19 -5.151 -3.990 8.377
148 HB3 ALA 19 2HB ALA 19 -5.471 -4.107 6.626
149 H CYS 20 H CYS 20 -3.024 -1.469 5.225
150 HA CYS 20 HA CYS 20 -2.710 -3.302 3.013
151 HB2 CYS 20 1HB CYS 20 -1.844 -0.412 3.306
152 HB3 CYS 20 2HB CYS 20 -1.722 -1.332 1.841
153 H ILE 21 H ILE 21 -0.953 -4.089 2.003
154 HA ILE 21 HA ILE 21 1.798 -3.705 3.159
155 HB ILE 21 HB ILE 21 2.294 -5.980 2.261
156 HG12 ILE 21 1HG1 ILE 21 -0.717 -6.404 2.070
157 HG13 ILE 21 2HG1 ILE 21 0.315 -6.091 0.675
158 HG21 ILE 21 1HG2 ILE 21 1.829 -5.515 4.663
159 HG22 ILE 21 2HG2 ILE 21 0.124 -5.944 4.402
160 HG23 ILE 21 3HG2 ILE 21 1.400 -7.161 4.194
161 HD11 ILE 21 3HD1 ILE 21 -0.051 -8.464 0.853
162 HD12 ILE 21 1HD1 ILE 21 1.652 -8.130 1.227
163 HD13 ILE 21 2HD1 ILE 21 0.499 -8.490 2.535
164 H CYS 22 H CYS 22 3.532 -3.866 1.542
165 HA CYS 22 HA CYS 22 2.743 -2.412 -0.911
166 HB2 CYS 22 1HB CYS 22 4.711 -1.761 0.547
167 HB3 CYS 22 2HB CYS 22 5.525 -3.222 -0.002
168 H ARG 23 H ARG 23 2.241 -3.432 -2.733
169 HA ARG 23 HA ARG 23 2.817 -6.307 -3.079
170 HB2 ARG 23 1HB ARG 23 1.163 -4.423 -4.800
171 HB3 ARG 23 2HB ARG 23 1.199 -6.178 -4.901
172 HG2 ARG 23 1HG ARG 23 0.074 -4.481 -2.638
173 HG3 ARG 23 2HG ARG 23 -0.825 -5.469 -3.779
174 HD2 ARG 23 1HD ARG 23 1.054 -6.475 -1.605
175 HD3 ARG 23 2HD ARG 23 -0.705 -6.529 -1.576
176 HE ARG 23 HE ARG 23 -0.590 -8.007 -3.604
177 HH11 ARG 23 1HH1 ARG 23 2.140 -8.074 -1.325
178 HH12 ARG 23 2HH1 ARG 23 2.588 -9.683 -1.800
179 HH21 ARG 23 1HH2 ARG 23 0.062 -10.060 -4.149
180 HH22 ARG 23 2HH2 ARG 23 1.431 -10.787 -3.367
181 H GLY 24 H GLY 24 3.381 -7.069 -5.314
182 HA2 GLY 24 1HA GLY 24 6.031 -6.249 -5.882
183 HA3 GLY 24 2HA GLY 24 5.067 -7.385 -6.849
184 H ASN 25 H ASN 25 3.104 -4.992 -7.280
185 HA ASN 25 HA ASN 25 4.371 -3.846 -9.644
186 HB2 ASN 25 1HB ASN 25 2.256 -2.807 -10.041
187 HB3 ASN 25 2HB ASN 25 1.972 -4.476 -9.568
188 HD21 ASN 25 1HD2 ASN 25 -0.123 -2.661 -9.475
189 HD22 ASN 25 2HD2 ASN 25 -0.517 -2.326 -7.798
190 H GLY 26 H GLY 26 4.579 -3.003 -6.354
191 HA2 GLY 26 1HA GLY 26 5.797 -1.228 -5.441
192 HA3 GLY 26 2HA GLY 26 5.690 -0.331 -6.977
193 H TYR 27 H TYR 27 2.732 -1.632 -5.616
194 HA TYR 27 HA TYR 27 2.042 0.964 -4.331
195 HB2 TYR 27 1HB TYR 27 0.421 -0.529 -6.405
196 HB3 TYR 27 2HB TYR 27 -0.290 0.630 -5.314
197 HD1 TYR 27 HD2 TYR 27 2.490 0.345 -7.857
198 HD2 TYR 27 HD1 TYR 27 -0.516 2.818 -6.024
199 HE1 TYR 27 HE2 TYR 27 3.090 2.191 -9.382
200 HE2 TYR 27 HE1 TYR 27 -0.001 4.641 -7.624
201 HH TYR 27 HH TYR 27 1.265 5.287 -9.438
202 H CYS 28 H CYS 28 0.312 0.881 -2.824
203 HA CYS 28 HA CYS 28 0.478 -1.357 -1.024
204 HB2 CYS 28 1HB CYS 28 -1.350 1.072 -1.061
205 HB3 CYS 28 2HB CYS 28 -1.142 0.010 0.329
206 H GLY 29 H GLY 29 -0.956 -2.961 -0.516
207 HA2 GLY 29 1HA GLY 29 -3.740 -3.029 -1.416
208 HA3 GLY 29 2HA GLY 29 -2.708 -4.137 -2.298
209 HN1 NH2 30 2HN NH2 30 -3.902 -6.323 0.310
210 HN2 NH2 30 1HN NH2 30 -4.313 -5.703 -1.277
Start of MODEL 26
1 H1 GLY 1 1H GLY 1 -9.188 -4.154 12.070
2 H2 GLY 1 2H GLY 1 -7.887 -5.115 11.822
3 H3 GLY 1 3H GLY 1 -7.801 -3.881 12.896
4 HA2 GLY 1 1HA GLY 1 -8.038 -2.244 11.160
5 HA3 GLY 1 2HA GLY 1 -6.626 -3.285 10.893
6 H VAL 2 H VAL 2 -7.309 -2.078 8.694
7 HA VAL 2 HA VAL 2 -8.213 -4.120 6.878
8 HB VAL 2 HB VAL 2 -10.427 -3.314 7.633
9 HG11 VAL 2 1HG1 VAL 2 -9.863 -0.962 8.203
10 HG12 VAL 2 2HG1 VAL 2 -9.677 -0.596 6.474
11 HG13 VAL 2 3HG1 VAL 2 -11.256 -1.079 7.118
12 HG21 VAL 2 3HG2 VAL 2 -11.452 -3.003 5.493
13 HG22 VAL 2 1HG2 VAL 2 -9.937 -2.454 4.765
14 HG23 VAL 2 2HG2 VAL 2 -10.108 -4.140 5.307
15 H CYS 3 H CYS 3 -7.674 -3.591 4.713
16 HA CYS 3 HA CYS 3 -5.759 -1.340 4.441
17 HB2 CYS 3 1HB CYS 3 -4.954 -3.458 3.692
18 HB3 CYS 3 2HB CYS 3 -6.398 -3.787 2.767
19 HA PRO 4 HA PRO 4 -9.098 1.130 2.537
20 HB2 PRO 4 1HB PRO 4 -6.623 2.688 1.752
21 HB3 PRO 4 2HB PRO 4 -8.221 3.310 2.280
22 HG2 PRO 4 1HG PRO 4 -6.186 3.188 4.049
23 HG3 PRO 4 2HG PRO 4 -7.811 2.605 4.544
24 HD2 PRO 4 1HD PRO 4 -5.427 0.993 3.639
25 HD3 PRO 4 2HD PRO 4 -6.545 0.694 4.998
26 H LYS 5 H LYS 5 -9.899 1.414 0.455
27 HA LYS 5 HA LYS 5 -8.726 -0.436 -1.502
28 HB2 LYS 5 1HB LYS 5 -11.470 0.876 -1.220
29 HB3 LYS 5 2HB LYS 5 -11.011 -0.133 -2.586
30 HG2 LYS 5 1HG LYS 5 -12.100 -1.643 -1.253
31 HG3 LYS 5 2HG LYS 5 -10.404 -1.969 -0.918
32 HD2 LYS 5 1HD LYS 5 -10.666 -0.608 1.236
33 HD3 LYS 5 2HD LYS 5 -12.366 -0.399 0.822
34 HE2 LYS 5 1HE LYS 5 -12.202 -2.176 2.416
35 HE3 LYS 5 2HE LYS 5 -12.632 -2.900 0.863
36 HZ1 LYS 5 3HZ LYS 5 -10.850 -4.106 2.056
37 HZ2 LYS 5 1HZ LYS 5 -10.335 -3.589 0.597
38 HZ3 LYS 5 2HZ LYS 5 -9.862 -2.795 1.953
39 H ILE 6 H ILE 6 -7.846 2.444 -1.097
40 HA ILE 6 HA ILE 6 -7.977 3.545 -3.859
41 HB ILE 6 HB ILE 6 -6.471 5.347 -2.891
42 HG12 ILE 6 1HG1 ILE 6 -6.485 5.768 -0.510
43 HG13 ILE 6 2HG1 ILE 6 -7.321 4.261 -0.168
44 HG21 ILE 6 1HG2 ILE 6 -8.886 5.600 -3.283
45 HG22 ILE 6 2HG2 ILE 6 -9.231 4.962 -1.660
46 HG23 ILE 6 3HG2 ILE 6 -8.365 6.500 -1.853
47 HD11 ILE 6 3HD1 ILE 6 -4.843 4.280 0.317
48 HD12 ILE 6 1HD1 ILE 6 -5.361 2.964 -0.741
49 HD13 ILE 6 2HD1 ILE 6 -4.553 4.399 -1.431
50 H LEU 7 H LEU 7 -5.901 4.257 -4.888
51 HA LEU 7 HA LEU 7 -3.927 2.011 -4.831
52 HB2 LEU 7 1HB LEU 7 -5.340 2.277 -6.869
53 HB3 LEU 7 2HB LEU 7 -4.711 3.908 -7.077
54 HG LEU 7 HG LEU 7 -2.428 2.977 -7.388
55 HD11 LEU 7 1HD1 LEU 7 -2.614 0.841 -6.131
56 HD12 LEU 7 2HD1 LEU 7 -3.829 0.257 -7.288
57 HD13 LEU 7 3HD1 LEU 7 -2.152 0.530 -7.806
58 HD21 LEU 7 3HD2 LEU 7 -2.822 2.045 -9.629
59 HD22 LEU 7 1HD2 LEU 7 -4.537 1.788 -9.233
60 HD23 LEU 7 2HD2 LEU 7 -3.873 3.436 -9.319
61 H LYS 8 H LYS 8 -2.400 2.637 -3.437
62 HA LYS 8 HA LYS 8 -1.111 5.333 -3.721
63 HB2 LYS 8 1HB LYS 8 -2.270 4.770 -1.521
64 HB3 LYS 8 2HB LYS 8 -1.099 3.460 -1.302
65 HG2 LYS 8 1HG LYS 8 0.725 5.255 -1.559
66 HG3 LYS 8 2HG LYS 8 -0.560 6.463 -1.514
67 HD2 LYS 8 1HD LYS 8 -1.202 5.666 0.744
68 HD3 LYS 8 2HD LYS 8 0.089 4.447 0.681
69 HE2 LYS 8 1HE LYS 8 0.581 7.447 0.403
70 HE3 LYS 8 2HE LYS 8 0.629 6.602 1.953
71 HZ1 LYS 8 3HZ LYS 8 2.839 6.813 0.947
72 HZ2 LYS 8 1HZ LYS 8 2.432 5.250 1.163
73 HZ3 LYS 8 2HZ LYS 8 2.391 5.907 -0.340
74 H LYS 9 H LYS 9 1.042 5.382 -4.346
75 HA LYS 9 HA LYS 9 2.474 2.905 -4.915
76 HB2 LYS 9 1HB LYS 9 2.624 5.243 -6.079
77 HB3 LYS 9 2HB LYS 9 3.750 5.634 -4.763
78 HG2 LYS 9 1HG LYS 9 5.252 3.837 -5.454
79 HG3 LYS 9 2HG LYS 9 4.078 3.273 -6.656
80 HD2 LYS 9 1HD LYS 9 4.286 5.439 -7.862
81 HD3 LYS 9 2HD LYS 9 5.485 5.978 -6.664
82 HE2 LYS 9 1HE LYS 9 6.948 4.058 -7.271
83 HE3 LYS 9 2HE LYS 9 5.747 3.509 -8.450
84 HZ1 LYS 9 3HZ LYS 9 7.500 4.800 -9.509
85 HZ2 LYS 9 1HZ LYS 9 6.081 5.593 -9.662
86 HZ3 LYS 9 2HZ LYS 9 7.191 6.101 -8.572
87 H CYS 10 H CYS 10 4.616 2.446 -4.031
88 HA CYS 10 HA CYS 10 5.278 3.353 -1.310
89 HB2 CYS 10 1HB CYS 10 4.920 1.134 -0.233
90 HB3 CYS 10 2HB CYS 10 3.453 1.926 -0.768
91 H ARG 11 H ARG 11 7.182 2.745 -0.460
92 HA ARG 11 HA ARG 11 9.198 1.414 -2.172
93 HB2 ARG 11 1HB ARG 11 9.695 3.521 -0.967
94 HB3 ARG 11 2HB ARG 11 9.406 2.716 0.581
95 HG2 ARG 11 1HG ARG 11 11.308 1.188 0.154
96 HG3 ARG 11 2HG ARG 11 11.557 1.928 -1.442
97 HD2 ARG 11 1HD ARG 11 12.038 4.099 -0.358
98 HD3 ARG 11 2HD ARG 11 11.760 3.370 1.238
99 HE ARG 11 HE ARG 11 13.721 1.836 -0.141
100 HH11 ARG 11 1HH1 ARG 11 13.471 5.034 1.353
101 HH12 ARG 11 2HH1 ARG 11 15.174 5.109 1.699
102 HH21 ARG 11 1HH2 ARG 11 15.909 1.993 0.334
103 HH22 ARG 11 2HH2 ARG 11 16.535 3.408 1.127
104 H ARG 12 H ARG 12 7.441 0.904 0.867
105 HA ARG 12 HA ARG 12 7.594 -1.960 0.798
106 HB2 ARG 12 1HB ARG 12 8.875 -2.354 2.822
107 HB3 ARG 12 2HB ARG 12 9.888 -1.499 1.674
108 HG2 ARG 12 1HG ARG 12 9.570 0.621 2.886
109 HG3 ARG 12 2HG ARG 12 8.400 -0.146 3.971
110 HD2 ARG 12 1HD ARG 12 10.223 -1.751 4.683
111 HD3 ARG 12 2HD ARG 12 11.372 -0.762 3.783
112 HE ARG 12 HE ARG 12 9.780 -0.002 6.200
113 HH11 ARG 12 1HH1 ARG 12 12.383 0.969 3.989
114 HH12 ARG 12 2HH1 ARG 12 12.899 2.260 5.033
115 HH21 ARG 12 1HH2 ARG 12 10.517 1.635 7.492
116 HH22 ARG 12 2HH2 ARG 12 11.849 2.635 6.994
117 H ASP 13 H ASP 13 6.761 -2.791 3.087
118 HA ASP 13 HA ASP 13 4.065 -2.059 3.172
119 HB2 ASP 13 1HB ASP 13 5.615 -3.356 5.445
120 HB3 ASP 13 2HB ASP 13 3.891 -3.503 5.119
121 H SER 14 H SER 14 6.698 -0.799 5.200
122 HA SER 14 HA SER 14 5.245 0.551 7.202
123 HB2 SER 14 1HB SER 14 7.783 1.568 5.880
124 HB3 SER 14 2HB SER 14 7.263 1.820 7.549
125 HG SER 14 HG SER 14 7.609 -0.420 7.919
126 H ASP 15 H ASP 15 5.473 1.391 3.819
127 HA ASP 15 HA ASP 15 4.593 4.196 4.284
128 HB2 ASP 15 1HB ASP 15 6.564 3.634 2.805
129 HB3 ASP 15 2HB ASP 15 5.443 2.822 1.711
130 H CYS 16 H CYS 16 3.087 1.274 4.031
131 HA CYS 16 HA CYS 16 0.812 2.219 2.352
132 HB2 CYS 16 1HB CYS 16 1.631 -0.524 3.331
133 HB3 CYS 16 2HB CYS 16 0.101 -0.175 2.552
134 HA PRO 17 HA PRO 17 -1.434 3.298 5.867
135 HB2 PRO 17 1HB PRO 17 -3.821 3.941 4.816
136 HB3 PRO 17 2HB PRO 17 -2.303 4.729 4.253
137 HG2 PRO 17 1HG PRO 17 -3.721 2.381 2.945
138 HG3 PRO 17 2HG PRO 17 -3.237 3.937 2.195
139 HD2 PRO 17 1HD PRO 17 -1.627 1.735 2.089
140 HD3 PRO 17 2HD PRO 17 -0.971 3.390 2.261
141 H GLY 18 H GLY 18 -2.862 2.611 7.479
142 HA2 GLY 18 1HA GLY 18 -4.152 1.129 8.719
143 HA3 GLY 18 2HA GLY 18 -4.925 0.681 7.191
144 H ALA 19 H ALA 19 -4.899 -1.436 6.940
145 HA ALA 19 HA ALA 19 -2.609 -3.103 7.849
146 HB1 ALA 19 3HB ALA 19 -4.135 -4.967 7.610
147 HB2 ALA 19 1HB ALA 19 -4.948 -3.687 8.519
148 HB3 ALA 19 2HB ALA 19 -5.337 -3.955 6.798
149 H CYS 20 H CYS 20 -2.962 -1.367 5.115
150 HA CYS 20 HA CYS 20 -2.704 -3.308 2.997
151 HB2 CYS 20 1HB CYS 20 -1.801 -0.425 3.197
152 HB3 CYS 20 2HB CYS 20 -1.637 -1.378 1.760
153 H ILE 21 H ILE 21 -0.978 -4.140 1.955
154 HA ILE 21 HA ILE 21 1.794 -3.788 3.069
155 HB ILE 21 HB ILE 21 2.255 -6.062 2.163
156 HG12 ILE 21 1HG1 ILE 21 -0.762 -6.458 2.008
157 HG13 ILE 21 2HG1 ILE 21 0.259 -6.159 0.600
158 HG21 ILE 21 1HG2 ILE 21 1.823 -5.593 4.572
159 HG22 ILE 21 2HG2 ILE 21 0.111 -6.004 4.330
160 HG23 ILE 21 3HG2 ILE 21 1.372 -7.235 4.107
161 HD11 ILE 21 3HD1 ILE 21 -0.126 -8.527 0.785
162 HD12 ILE 21 1HD1 ILE 21 1.582 -8.210 1.148
163 HD13 ILE 21 2HD1 ILE 21 0.433 -8.555 2.464
164 H CYS 22 H CYS 22 3.504 -3.892 1.469
165 HA CYS 22 HA CYS 22 2.700 -2.457 -1.000
166 HB2 CYS 22 1HB CYS 22 4.577 -1.702 0.532
167 HB3 CYS 22 2HB CYS 22 5.489 -3.112 -0.000
168 H ARG 23 H ARG 23 2.175 -3.609 -2.735
169 HA ARG 23 HA ARG 23 2.938 -6.424 -3.042
170 HB2 ARG 23 1HB ARG 23 1.273 -4.631 -4.851
171 HB3 ARG 23 2HB ARG 23 1.377 -6.384 -4.926
172 HG2 ARG 23 1HG ARG 23 0.118 -4.707 -2.716
173 HG3 ARG 23 2HG ARG 23 -0.709 -5.727 -3.882
174 HD2 ARG 23 1HD ARG 23 1.131 -6.672 -1.649
175 HD3 ARG 23 2HD ARG 23 -0.626 -6.773 -1.669
176 HE ARG 23 HE ARG 23 -0.408 -8.246 -3.696
177 HH11 ARG 23 1HH1 ARG 23 2.225 -8.258 -1.307
178 HH12 ARG 23 2HH1 ARG 23 2.728 -9.856 -1.763
179 HH21 ARG 23 1HH2 ARG 23 0.308 -10.284 -4.215
180 HH22 ARG 23 2HH2 ARG 23 1.659 -10.984 -3.376
181 H GLY 24 H GLY 24 3.581 -7.199 -5.273
182 HA2 GLY 24 1HA GLY 24 6.228 -6.320 -5.759
183 HA3 GLY 24 2HA GLY 24 5.322 -7.480 -6.753
184 H ASN 25 H ASN 25 3.319 -5.146 -7.261
185 HA ASN 25 HA ASN 25 4.643 -3.958 -9.578
186 HB2 ASN 25 1HB ASN 25 2.497 -3.001 -10.061
187 HB3 ASN 25 2HB ASN 25 2.279 -4.688 -9.622
188 HD21 ASN 25 1HD2 ASN 25 0.069 -3.072 -9.591
189 HD22 ASN 25 2HD2 ASN 25 -0.407 -2.746 -7.932
190 H GLY 26 H GLY 26 4.728 -3.125 -6.299
191 HA2 GLY 26 1HA GLY 26 5.841 -1.310 -5.343
192 HA3 GLY 26 2HA GLY 26 5.722 -0.397 -6.867
193 H TYR 27 H TYR 27 2.748 -1.804 -5.726
194 HA TYR 27 HA TYR 27 1.922 0.760 -4.439
195 HB2 TYR 27 1HB TYR 27 0.510 -0.812 -6.610
196 HB3 TYR 27 2HB TYR 27 -0.373 0.195 -5.490
197 HD1 TYR 27 HD2 TYR 27 2.527 0.382 -7.904
198 HD2 TYR 27 HD1 TYR 27 -0.696 2.436 -5.927
199 HE1 TYR 27 HE2 TYR 27 3.064 2.442 -9.176
200 HE2 TYR 27 HE1 TYR 27 -0.216 4.483 -7.232
201 HH TYR 27 HH TYR 27 1.142 5.455 -8.825
202 H CYS 28 H CYS 28 0.222 0.694 -2.973
203 HA CYS 28 HA CYS 28 0.388 -1.496 -1.109
204 HB2 CYS 28 1HB CYS 28 -1.364 0.986 -1.193
205 HB3 CYS 28 2HB CYS 28 -1.190 -0.053 0.217
206 H GLY 29 H GLY 29 -0.969 -3.124 -0.648
207 HA2 GLY 29 1HA GLY 29 -3.784 -3.213 -1.514
208 HA3 GLY 29 2HA GLY 29 -2.727 -4.350 -2.332
209 HN1 NH2 30 2HN NH2 30 -3.920 -6.432 0.357
210 HN2 NH2 30 1HN NH2 30 -4.320 -5.888 -1.261
Start of MODEL 27
1 H1 GLY 1 1H GLY 1 -8.990 -4.428 11.997
2 H2 GLY 1 2H GLY 1 -7.498 -5.092 11.881
3 H3 GLY 1 3H GLY 1 -7.745 -3.796 12.852
4 HA2 GLY 1 1HA GLY 1 -8.237 -2.383 10.977
5 HA3 GLY 1 2HA GLY 1 -6.616 -3.094 10.857
6 H VAL 2 H VAL 2 -7.680 -2.147 8.563
7 HA VAL 2 HA VAL 2 -8.000 -4.512 6.874
8 HB VAL 2 HB VAL 2 -9.875 -3.541 5.577
9 HG11 VAL 2 1HG1 VAL 2 -10.308 -5.345 7.221
10 HG12 VAL 2 2HG1 VAL 2 -10.744 -4.112 8.430
11 HG13 VAL 2 3HG1 VAL 2 -11.704 -4.289 6.951
12 HG21 VAL 2 3HG2 VAL 2 -11.380 -1.851 6.533
13 HG22 VAL 2 1HG2 VAL 2 -10.295 -1.633 7.919
14 HG23 VAL 2 2HG2 VAL 2 -9.767 -1.177 6.283
15 H CYS 3 H CYS 3 -7.613 -3.912 4.582
16 HA CYS 3 HA CYS 3 -5.882 -1.518 4.366
17 HB2 CYS 3 1HB CYS 3 -4.963 -3.566 3.507
18 HB3 CYS 3 2HB CYS 3 -6.392 -3.896 2.551
19 HA PRO 4 HA PRO 4 -9.556 0.572 2.673
20 HB2 PRO 4 1HB PRO 4 -7.544 2.731 2.095
21 HB3 PRO 4 2HB PRO 4 -9.163 2.866 2.843
22 HG2 PRO 4 1HG PRO 4 -6.928 2.968 4.372
23 HG3 PRO 4 2HG PRO 4 -8.343 2.007 4.920
24 HD2 PRO 4 1HD PRO 4 -5.841 1.035 3.520
25 HD3 PRO 4 2HD PRO 4 -6.648 0.381 4.974
26 H LYS 5 H LYS 5 -10.186 1.605 0.585
27 HA LYS 5 HA LYS 5 -9.283 -0.108 -1.573
28 HB2 LYS 5 1HB LYS 5 -11.468 2.013 -1.419
29 HB3 LYS 5 2HB LYS 5 -11.245 0.872 -2.752
30 HG2 LYS 5 1HG LYS 5 -11.574 -1.036 -1.191
31 HG3 LYS 5 2HG LYS 5 -11.895 0.109 0.126
32 HD2 LYS 5 1HD LYS 5 -13.813 1.039 -1.142
33 HD3 LYS 5 2HD LYS 5 -13.500 -0.115 -2.458
34 HE2 LYS 5 1HE LYS 5 -13.844 -2.005 -0.875
35 HE3 LYS 5 2HE LYS 5 -14.161 -0.856 0.432
36 HZ1 LYS 5 3HZ LYS 5 -16.218 -1.672 -0.545
37 HZ2 LYS 5 1HZ LYS 5 -16.093 -0.068 -0.819
38 HZ3 LYS 5 2HZ LYS 5 -15.800 -1.132 -2.027
39 H ILE 6 H ILE 6 -7.392 2.063 -0.783
40 HA ILE 6 HA ILE 6 -7.345 3.971 -3.031
41 HB ILE 6 HB ILE 6 -5.581 5.067 -1.993
42 HG12 ILE 6 1HG1 ILE 6 -3.976 3.385 -1.501
43 HG13 ILE 6 2HG1 ILE 6 -4.274 4.351 -0.075
44 HG21 ILE 6 1HG2 ILE 6 -7.734 5.363 -0.883
45 HG22 ILE 6 2HG2 ILE 6 -7.329 4.096 0.290
46 HG23 ILE 6 3HG2 ILE 6 -6.373 5.586 0.230
47 HD11 ILE 6 3HD1 ILE 6 -3.968 2.011 0.503
48 HD12 ILE 6 1HD1 ILE 6 -5.624 2.498 0.897
49 HD13 ILE 6 2HD1 ILE 6 -5.289 1.518 -0.555
50 H LEU 7 H LEU 7 -5.305 4.387 -4.223
51 HA LEU 7 HA LEU 7 -3.642 1.973 -4.754
52 HB2 LEU 7 1HB LEU 7 -5.267 2.316 -6.613
53 HB3 LEU 7 2HB LEU 7 -4.662 3.956 -6.832
54 HG LEU 7 HG LEU 7 -2.414 3.029 -7.423
55 HD11 LEU 7 1HD1 LEU 7 -2.486 0.852 -6.237
56 HD12 LEU 7 2HD1 LEU 7 -3.815 0.314 -7.286
57 HD13 LEU 7 3HD1 LEU 7 -2.198 0.612 -7.961
58 HD21 LEU 7 3HD2 LEU 7 -3.060 2.192 -9.642
59 HD22 LEU 7 1HD2 LEU 7 -4.724 1.928 -9.074
60 HD23 LEU 7 2HD2 LEU 7 -4.060 3.575 -9.168
61 H LYS 8 H LYS 8 -2.191 2.697 -3.256
62 HA LYS 8 HA LYS 8 -0.887 5.370 -3.619
63 HB2 LYS 8 1HB LYS 8 -2.052 4.864 -1.443
64 HB3 LYS 8 2HB LYS 8 -0.932 3.514 -1.182
65 HG2 LYS 8 1HG LYS 8 0.973 5.155 -1.271
66 HG3 LYS 8 2HG LYS 8 -0.198 6.466 -1.505
67 HD2 LYS 8 1HD LYS 8 -1.202 5.858 0.733
68 HD3 LYS 8 2HD LYS 8 0.107 4.660 0.922
69 HE2 LYS 8 1HE LYS 8 1.781 6.513 0.591
70 HE3 LYS 8 2HE LYS 8 0.446 7.675 0.534
71 HZ1 LYS 8 3HZ LYS 8 1.397 7.573 2.742
72 HZ2 LYS 8 1HZ LYS 8 -0.125 6.980 2.820
73 HZ3 LYS 8 2HZ LYS 8 1.170 5.955 2.842
74 H LYS 9 H LYS 9 1.259 5.422 -4.278
75 HA LYS 9 HA LYS 9 2.614 2.936 -4.934
76 HB2 LYS 9 1HB LYS 9 2.787 5.301 -6.048
77 HB3 LYS 9 2HB LYS 9 3.983 5.614 -4.769
78 HG2 LYS 9 1HG LYS 9 5.370 3.757 -5.569
79 HG3 LYS 9 2HG LYS 9 4.139 3.325 -6.769
80 HD2 LYS 9 1HD LYS 9 4.442 5.534 -7.866
81 HD3 LYS 9 2HD LYS 9 5.679 5.955 -6.660
82 HE2 LYS 9 1HE LYS 9 7.038 3.993 -7.382
83 HE3 LYS 9 2HE LYS 9 5.808 3.585 -8.587
84 HZ1 LYS 9 3HZ LYS 9 7.628 4.847 -9.569
85 HZ2 LYS 9 1HZ LYS 9 6.254 5.725 -9.665
86 HZ3 LYS 9 2HZ LYS 9 7.390 6.099 -8.548
87 H CYS 10 H CYS 10 4.722 2.349 -4.156
88 HA CYS 10 HA CYS 10 5.603 3.148 -1.463
89 HB2 CYS 10 1HB CYS 10 5.112 1.007 -0.361
90 HB3 CYS 10 2HB CYS 10 3.654 1.818 -0.898
91 H ARG 11 H ARG 11 7.408 2.178 -0.658
92 HA ARG 11 HA ARG 11 9.110 0.536 -2.490
93 HB2 ARG 11 1HB ARG 11 10.009 2.768 -1.846
94 HB3 ARG 11 2HB ARG 11 9.839 2.351 -0.144
95 HG2 ARG 11 1HG ARG 11 12.152 2.164 -0.855
96 HG3 ARG 11 2HG ARG 11 11.545 0.582 -0.376
97 HD2 ARG 11 1HD ARG 11 11.248 -0.043 -2.755
98 HD3 ARG 11 2HD ARG 11 11.778 1.560 -3.265
99 HE ARG 11 HE ARG 11 13.411 -0.674 -2.284
100 HH11 ARG 11 1HH1 ARG 11 13.478 2.814 -2.921
101 HH12 ARG 11 2HH1 ARG 11 15.214 2.847 -3.022
102 HH21 ARG 11 1HH2 ARG 11 15.637 -0.551 -2.423
103 HH22 ARG 11 2HH2 ARG 11 16.415 0.970 -2.739
104 H ARG 12 H ARG 12 7.548 0.786 0.665
105 HA ARG 12 HA ARG 12 7.710 -2.074 1.150
106 HB2 ARG 12 1HB ARG 12 8.853 -1.876 3.347
107 HB3 ARG 12 2HB ARG 12 9.917 -1.414 2.028
108 HG2 ARG 12 1HG ARG 12 9.609 0.959 2.496
109 HG3 ARG 12 2HG ARG 12 8.374 0.622 3.711
110 HD2 ARG 12 1HD ARG 12 11.279 -0.282 3.916
111 HD3 ARG 12 2HD ARG 12 10.637 1.195 4.623
112 HE ARG 12 HE ARG 12 9.250 -0.046 6.120
113 HH11 ARG 12 1HH1 ARG 12 11.591 -2.159 4.479
114 HH12 ARG 12 2HH1 ARG 12 11.386 -3.418 5.658
115 HH21 ARG 12 1HH2 ARG 12 9.043 -1.682 7.556
116 HH22 ARG 12 2HH2 ARG 12 9.967 -3.149 7.392
117 H ASP 13 H ASP 13 6.752 -2.603 3.357
118 HA ASP 13 HA ASP 13 4.052 -1.869 3.198
119 HB2 ASP 13 1HB ASP 13 5.472 -3.018 5.635
120 HB3 ASP 13 2HB ASP 13 3.757 -3.156 5.257
121 H SER 14 H SER 14 6.583 -0.415 5.180
122 HA SER 14 HA SER 14 5.029 1.088 7.011
123 HB2 SER 14 1HB SER 14 7.686 1.868 5.755
124 HB3 SER 14 2HB SER 14 7.056 2.401 7.318
125 HG SER 14 HG SER 14 7.298 0.322 8.111
126 H ASP 15 H ASP 15 5.341 1.611 3.577
127 HA ASP 15 HA ASP 15 4.595 4.473 3.661
128 HB2 ASP 15 1HB ASP 15 4.660 2.486 1.361
129 HB3 ASP 15 2HB ASP 15 4.466 4.226 1.215
130 H CYS 16 H CYS 16 2.979 1.409 3.764
131 HA CYS 16 HA CYS 16 0.563 2.324 2.366
132 HB2 CYS 16 1HB CYS 16 1.392 -0.385 3.452
133 HB3 CYS 16 2HB CYS 16 -0.043 -0.053 2.502
134 HA PRO 17 HA PRO 17 -1.604 3.330 5.988
135 HB2 PRO 17 1HB PRO 17 -3.997 4.016 4.993
136 HB3 PRO 17 2HB PRO 17 -2.487 4.808 4.410
137 HG2 PRO 17 1HG PRO 17 -3.943 2.486 3.099
138 HG3 PRO 17 2HG PRO 17 -3.481 4.056 2.362
139 HD2 PRO 17 1HD PRO 17 -1.871 1.853 2.178
140 HD3 PRO 17 2HD PRO 17 -1.213 3.507 2.345
141 H GLY 18 H GLY 18 -3.108 2.616 7.562
142 HA2 GLY 18 1HA GLY 18 -4.393 1.076 8.740
143 HA3 GLY 18 2HA GLY 18 -5.097 0.616 7.183
144 H ALA 19 H ALA 19 -5.003 -1.513 6.966
145 HA ALA 19 HA ALA 19 -2.602 -3.057 7.822
146 HB1 ALA 19 3HB ALA 19 -4.021 -4.998 7.694
147 HB2 ALA 19 1HB ALA 19 -4.891 -3.747 8.594
148 HB3 ALA 19 2HB ALA 19 -5.309 -4.090 6.893
149 H CYS 20 H CYS 20 -3.088 -1.342 5.130
150 HA CYS 20 HA CYS 20 -2.753 -3.252 2.982
151 HB2 CYS 20 1HB CYS 20 -1.918 -0.350 3.191
152 HB3 CYS 20 2HB CYS 20 -1.799 -1.305 1.749
153 H ILE 21 H ILE 21 -0.970 -4.012 1.962
154 HA ILE 21 HA ILE 21 1.752 -3.558 3.141
155 HB ILE 21 HB ILE 21 2.282 -5.881 2.398
156 HG12 ILE 21 1HG1 ILE 21 0.133 -6.135 0.970
157 HG13 ILE 21 2HG1 ILE 21 0.838 -7.505 1.799
158 HG21 ILE 21 1HG2 ILE 21 2.048 -5.297 4.736
159 HG22 ILE 21 2HG2 ILE 21 0.300 -5.589 4.682
160 HG23 ILE 21 3HG2 ILE 21 1.440 -6.935 4.449
161 HD11 ILE 21 3HD1 ILE 21 -1.633 -7.468 1.909
162 HD12 ILE 21 1HD1 ILE 21 -0.876 -7.486 3.508
163 HD13 ILE 21 2HD1 ILE 21 -1.572 -5.983 2.872
164 H CYS 22 H CYS 22 3.506 -3.755 1.606
165 HA CYS 22 HA CYS 22 2.768 -2.449 -0.930
166 HB2 CYS 22 1HB CYS 22 4.710 -1.754 0.564
167 HB3 CYS 22 2HB CYS 22 5.525 -3.230 0.075
168 H ARG 23 H ARG 23 2.478 -3.472 -2.817
169 HA ARG 23 HA ARG 23 3.055 -6.384 -3.006
170 HB2 ARG 23 1HB ARG 23 1.311 -4.681 -4.810
171 HB3 ARG 23 2HB ARG 23 1.383 -6.435 -4.731
172 HG2 ARG 23 1HG ARG 23 0.196 -4.513 -2.707
173 HG3 ARG 23 2HG ARG 23 -0.630 -5.737 -3.657
174 HD2 ARG 23 1HD ARG 23 1.268 -6.196 -1.324
175 HD3 ARG 23 2HD ARG 23 -0.474 -6.419 -1.335
176 HE ARG 23 HE ARG 23 -0.157 -8.226 -3.024
177 HH11 ARG 23 1HH1 ARG 23 2.602 -7.540 -0.876
178 HH12 ARG 23 2HH1 ARG 23 3.185 -9.170 -0.995
179 HH21 ARG 23 1HH2 ARG 23 0.694 -10.275 -3.143
180 HH22 ARG 23 2HH2 ARG 23 2.137 -10.684 -2.269
181 H GLY 24 H GLY 24 3.555 -7.191 -5.262
182 HA2 GLY 24 1HA GLY 24 6.181 -6.341 -5.898
183 HA3 GLY 24 2HA GLY 24 5.215 -7.509 -6.824
184 H ASN 25 H ASN 25 3.206 -5.164 -7.262
185 HA ASN 25 HA ASN 25 4.412 -4.029 -9.666
186 HB2 ASN 25 1HB ASN 25 2.256 -3.055 -10.049
187 HB3 ASN 25 2HB ASN 25 2.040 -4.730 -9.564
188 HD21 ASN 25 1HD2 ASN 25 -0.143 -3.071 -9.446
189 HD22 ASN 25 2HD2 ASN 25 -0.521 -2.709 -7.770
190 H GLY 26 H GLY 26 4.690 -3.144 -6.412
191 HA2 GLY 26 1HA GLY 26 5.871 -1.325 -5.548
192 HA3 GLY 26 2HA GLY 26 5.681 -0.436 -7.078
193 H TYR 27 H TYR 27 2.756 -1.788 -5.764
194 HA TYR 27 HA TYR 27 2.035 0.789 -4.442
195 HB2 TYR 27 1HB TYR 27 0.496 -0.738 -6.558
196 HB3 TYR 27 2HB TYR 27 -0.312 0.298 -5.406
197 HD1 TYR 27 HD1 TYR 27 2.452 0.370 -7.969
198 HD2 TYR 27 HD2 TYR 27 -0.567 2.560 -5.821
199 HE1 TYR 27 HE1 TYR 27 3.005 2.398 -9.279
200 HE2 TYR 27 HE2 TYR 27 -0.049 4.595 -7.154
201 HH TYR 27 HH TYR 27 2.476 4.598 -9.704
202 H CYS 28 H CYS 28 0.378 0.735 -2.919
203 HA CYS 28 HA CYS 28 0.505 -1.478 -1.077
204 HB2 CYS 28 1HB CYS 28 -1.235 1.015 -1.161
205 HB3 CYS 28 2HB CYS 28 -1.064 -0.027 0.251
206 H GLY 29 H GLY 29 -0.880 -3.105 -0.668
207 HA2 GLY 29 1HA GLY 29 -3.687 -3.126 -1.599
208 HA3 GLY 29 2HA GLY 29 -2.629 -4.319 -2.334
209 HN1 NH2 30 2HN NH2 30 -3.996 -6.242 0.401
210 HN2 NH2 30 1HN NH2 30 -4.353 -5.736 -1.239
Start of MODEL 28
1 H1 GLY 1 1H GLY 1 -9.092 -3.644 12.067
2 H2 GLY 1 2H GLY 1 -7.564 -4.232 12.072
3 H3 GLY 1 3H GLY 1 -7.912 -2.851 12.879
4 HA2 GLY 1 1HA GLY 1 -8.410 -1.689 10.842
5 HA3 GLY 1 2HA GLY 1 -6.751 -2.317 10.852
6 H VAL 2 H VAL 2 -7.835 -1.685 8.438
7 HA VAL 2 HA VAL 2 -7.946 -4.242 7.015
8 HB VAL 2 HB VAL 2 -9.855 -3.560 5.596
9 HG11 VAL 2 1HG1 VAL 2 -10.205 -5.181 7.439
10 HG12 VAL 2 2HG1 VAL 2 -10.742 -3.844 8.487
11 HG13 VAL 2 3HG1 VAL 2 -11.658 -4.257 7.028
12 HG21 VAL 2 3HG2 VAL 2 -11.482 -1.871 6.320
13 HG22 VAL 2 1HG2 VAL 2 -10.443 -1.418 7.685
14 HG23 VAL 2 2HG2 VAL 2 -9.909 -1.127 6.014
15 H CYS 3 H CYS 3 -7.650 -3.834 4.632
16 HA CYS 3 HA CYS 3 -6.133 -1.317 4.178
17 HB2 CYS 3 1HB CYS 3 -4.987 -3.401 3.603
18 HB3 CYS 3 2HB CYS 3 -6.307 -3.876 2.544
19 HA PRO 4 HA PRO 4 -10.036 -0.094 2.192
20 HB2 PRO 4 1HB PRO 4 -9.495 2.540 1.678
21 HB3 PRO 4 2HB PRO 4 -9.832 1.906 3.316
22 HG2 PRO 4 1HG PRO 4 -7.124 2.405 2.043
23 HG3 PRO 4 2HG PRO 4 -7.702 2.940 3.652
24 HD2 PRO 4 1HD PRO 4 -6.199 0.709 3.339
25 HD3 PRO 4 2HD PRO 4 -7.527 0.757 4.535
26 H LYS 5 H LYS 5 -10.691 1.012 0.115
27 HA LYS 5 HA LYS 5 -9.525 -0.397 -2.089
28 HB2 LYS 5 1HB LYS 5 -11.430 0.473 -3.326
29 HB3 LYS 5 2HB LYS 5 -11.921 -0.134 -1.751
30 HG2 LYS 5 1HG LYS 5 -12.044 2.194 -0.872
31 HG3 LYS 5 2HG LYS 5 -11.527 2.814 -2.451
32 HD2 LYS 5 1HD LYS 5 -13.557 1.821 -3.502
33 HD3 LYS 5 2HD LYS 5 -14.036 1.160 -1.935
34 HE2 LYS 5 1HE LYS 5 -15.337 3.128 -2.274
35 HE3 LYS 5 2HE LYS 5 -14.160 3.487 -1.008
36 HZ1 LYS 5 3HZ LYS 5 -14.335 5.280 -2.639
37 HZ2 LYS 5 1HZ LYS 5 -12.828 4.657 -2.684
38 HZ3 LYS 5 2HZ LYS 5 -13.907 4.288 -3.861
39 H ILE 6 H ILE 6 -7.711 1.600 -1.039
40 HA ILE 6 HA ILE 6 -7.470 3.816 -2.974
41 HB ILE 6 HB ILE 6 -5.500 4.452 -1.663
42 HG12 ILE 6 1HG1 ILE 6 -5.943 1.918 -0.019
43 HG13 ILE 6 2HG1 ILE 6 -4.631 2.174 -1.166
44 HG21 ILE 6 1HG2 ILE 6 -7.784 5.115 -0.948
45 HG22 ILE 6 2HG2 ILE 6 -7.826 3.737 0.168
46 HG23 ILE 6 3HG2 ILE 6 -6.640 5.039 0.392
47 HD11 ILE 6 3HD1 ILE 6 -3.779 2.533 1.027
48 HD12 ILE 6 1HD1 ILE 6 -3.837 4.108 0.211
49 HD13 ILE 6 2HD1 ILE 6 -5.064 3.684 1.429
50 H LEU 7 H LEU 7 -5.324 4.280 -3.963
51 HA LEU 7 HA LEU 7 -3.668 1.931 -4.665
52 HB2 LEU 7 1HB LEU 7 -5.309 2.253 -6.514
53 HB3 LEU 7 2HB LEU 7 -4.769 3.917 -6.700
54 HG LEU 7 HG LEU 7 -2.501 3.098 -7.336
55 HD11 LEU 7 1HD1 LEU 7 -2.460 0.901 -6.183
56 HD12 LEU 7 2HD1 LEU 7 -3.776 0.320 -7.225
57 HD13 LEU 7 3HD1 LEU 7 -2.182 0.699 -7.914
58 HD21 LEU 7 3HD2 LEU 7 -3.134 2.267 -9.561
59 HD22 LEU 7 1HD2 LEU 7 -4.777 1.918 -8.979
60 HD23 LEU 7 2HD2 LEU 7 -4.190 3.594 -9.053
61 H LYS 8 H LYS 8 -2.199 2.653 -3.196
62 HA LYS 8 HA LYS 8 -0.987 5.377 -3.502
63 HB2 LYS 8 1HB LYS 8 -2.127 4.787 -1.333
64 HB3 LYS 8 2HB LYS 8 -0.968 3.468 -1.109
65 HG2 LYS 8 1HG LYS 8 0.889 5.179 -1.183
66 HG3 LYS 8 2HG LYS 8 -0.341 6.451 -1.317
67 HD2 LYS 8 1HD LYS 8 -1.244 5.686 0.916
68 HD3 LYS 8 2HD LYS 8 0.118 4.532 0.996
69 HE2 LYS 8 1HE LYS 8 1.703 6.472 0.691
70 HE3 LYS 8 2HE LYS 8 0.322 7.575 0.761
71 HZ1 LYS 8 3HZ LYS 8 1.377 7.403 2.911
72 HZ2 LYS 8 1HZ LYS 8 -0.107 6.732 3.030
73 HZ3 LYS 8 2HZ LYS 8 1.236 5.775 2.937
74 H LYS 9 H LYS 9 1.180 5.533 -4.060
75 HA LYS 9 HA LYS 9 2.682 3.236 -4.952
76 HB2 LYS 9 1HB LYS 9 3.472 6.113 -4.228
77 HB3 LYS 9 2HB LYS 9 4.613 4.950 -4.909
78 HG2 LYS 9 1HG LYS 9 3.287 4.704 -6.915
79 HG3 LYS 9 2HG LYS 9 2.062 5.839 -6.311
80 HD2 LYS 9 1HD LYS 9 4.988 6.506 -6.871
81 HD3 LYS 9 2HD LYS 9 3.634 6.837 -7.962
82 HE2 LYS 9 1HE LYS 9 2.582 8.279 -6.216
83 HE3 LYS 9 2HE LYS 9 3.971 7.995 -5.155
84 HZ1 LYS 9 3HZ LYS 9 4.202 10.072 -6.372
85 HZ2 LYS 9 1HZ LYS 9 5.384 9.045 -6.835
86 HZ3 LYS 9 2HZ LYS 9 4.099 9.311 -7.812
87 H CYS 10 H CYS 10 4.608 2.327 -4.102
88 HA CYS 10 HA CYS 10 5.566 3.048 -1.412
89 HB2 CYS 10 1HB CYS 10 5.140 0.879 -0.360
90 HB3 CYS 10 2HB CYS 10 3.647 1.663 -0.842
91 H ARG 11 H ARG 11 7.406 2.079 -0.695
92 HA ARG 11 HA ARG 11 9.084 0.523 -2.624
93 HB2 ARG 11 1HB ARG 11 9.935 2.756 -1.895
94 HB3 ARG 11 2HB ARG 11 9.890 2.215 -0.211
95 HG2 ARG 11 1HG ARG 11 11.562 0.461 -0.715
96 HG3 ARG 11 2HG ARG 11 11.548 0.927 -2.430
97 HD2 ARG 11 1HD ARG 11 12.376 3.180 -1.821
98 HD3 ARG 11 2HD ARG 11 12.378 2.716 -0.104
99 HE ARG 11 HE ARG 11 13.911 0.812 -1.551
100 HH11 ARG 11 1HH1 ARG 11 14.185 4.211 -0.611
101 HH12 ARG 11 2HH1 ARG 11 15.924 4.172 -0.621
102 HH21 ARG 11 1HH2 ARG 11 16.157 0.825 -1.546
103 HH22 ARG 11 2HH2 ARG 11 17.023 2.278 -1.145
104 H ARG 12 H ARG 12 7.706 0.692 0.647
105 HA ARG 12 HA ARG 12 7.768 -2.194 0.950
106 HB2 ARG 12 1HB ARG 12 9.110 -2.326 2.943
107 HB3 ARG 12 2HB ARG 12 10.072 -1.541 1.699
108 HG2 ARG 12 1HG ARG 12 9.433 0.703 2.713
109 HG3 ARG 12 2HG ARG 12 8.643 -0.186 4.019
110 HD2 ARG 12 1HD ARG 12 11.595 -0.258 3.297
111 HD3 ARG 12 2HD ARG 12 10.889 0.572 4.678
112 HE ARG 12 HE ARG 12 11.492 -2.266 4.408
113 HH11 ARG 12 1HH1 ARG 12 9.464 -0.013 6.279
114 HH12 ARG 12 2HH1 ARG 12 9.400 -1.102 7.636
115 HH21 ARG 12 1HH2 ARG 12 11.289 -3.613 6.166
116 HH22 ARG 12 2HH2 ARG 12 10.377 -3.117 7.559
117 H ASP 13 H ASP 13 6.950 -2.731 3.314
118 HA ASP 13 HA ASP 13 4.247 -1.985 3.189
119 HB2 ASP 13 1HB ASP 13 5.673 -3.188 5.585
120 HB3 ASP 13 2HB ASP 13 3.957 -3.295 5.218
121 H SER 14 H SER 14 6.773 -0.444 5.126
122 HA SER 14 HA SER 14 5.014 0.932 6.954
123 HB2 SER 14 1HB SER 14 7.022 2.306 7.451
124 HB3 SER 14 2HB SER 14 7.299 0.567 7.546
125 HG SER 14 HG SER 14 8.144 2.377 5.528
126 H ASP 15 H ASP 15 5.527 1.497 3.598
127 HA ASP 15 HA ASP 15 4.793 4.362 3.658
128 HB2 ASP 15 1HB ASP 15 4.818 2.342 1.387
129 HB3 ASP 15 2HB ASP 15 4.600 4.077 1.216
130 H CYS 16 H CYS 16 3.167 1.299 3.812
131 HA CYS 16 HA CYS 16 0.695 2.266 2.537
132 HB2 CYS 16 1HB CYS 16 1.525 -0.492 3.483
133 HB3 CYS 16 2HB CYS 16 0.072 -0.096 2.590
134 HA PRO 17 HA PRO 17 -1.153 3.083 6.427
135 HB2 PRO 17 1HB PRO 17 -3.471 4.157 5.642
136 HB3 PRO 17 2HB PRO 17 -1.905 4.833 5.057
137 HG2 PRO 17 1HG PRO 17 -3.683 2.844 3.600
138 HG3 PRO 17 2HG PRO 17 -3.085 4.433 3.008
139 HD2 PRO 17 1HD PRO 17 -1.740 2.093 2.502
140 HD3 PRO 17 2HD PRO 17 -0.901 3.648 2.773
141 H GLY 18 H GLY 18 -2.917 2.485 7.876
142 HA2 GLY 18 1HA GLY 18 -4.401 0.993 8.865
143 HA3 GLY 18 2HA GLY 18 -4.988 0.638 7.231
144 H ALA 19 H ALA 19 -4.995 -1.480 6.913
145 HA ALA 19 HA ALA 19 -2.755 -3.193 7.898
146 HB1 ALA 19 3HB ALA 19 -4.254 -5.049 7.591
147 HB2 ALA 19 1HB ALA 19 -5.131 -3.790 8.473
148 HB3 ALA 19 2HB ALA 19 -5.431 -4.049 6.734
149 H CYS 20 H CYS 20 -3.036 -1.358 5.226
150 HA CYS 20 HA CYS 20 -2.691 -3.246 3.064
151 HB2 CYS 20 1HB CYS 20 -1.817 -0.350 3.292
152 HB3 CYS 20 2HB CYS 20 -1.735 -1.299 1.846
153 H ILE 21 H ILE 21 -0.907 -3.962 2.022
154 HA ILE 21 HA ILE 21 1.827 -3.594 3.218
155 HB ILE 21 HB ILE 21 2.289 -5.933 2.441
156 HG12 ILE 21 1HG1 ILE 21 -0.729 -6.328 2.334
157 HG13 ILE 21 2HG1 ILE 21 0.274 -6.105 0.903
158 HG21 ILE 21 1HG2 ILE 21 1.875 -5.314 4.819
159 HG22 ILE 21 2HG2 ILE 21 0.160 -5.724 4.612
160 HG23 ILE 21 3HG2 ILE 21 1.408 -6.977 4.457
161 HD11 ILE 21 3HD1 ILE 21 -0.106 -8.460 1.221
162 HD12 ILE 21 1HD1 ILE 21 1.607 -8.120 1.530
163 HD13 ILE 21 2HD1 ILE 21 0.489 -8.397 2.888
164 H CYS 22 H CYS 22 3.565 -3.837 1.623
165 HA CYS 22 HA CYS 22 2.794 -2.475 -0.881
166 HB2 CYS 22 1HB CYS 22 4.776 -1.830 0.543
167 HB3 CYS 22 2HB CYS 22 5.556 -3.332 0.046
168 H ARG 23 H ARG 23 2.598 -3.401 -2.845
169 HA ARG 23 HA ARG 23 3.139 -6.329 -3.115
170 HB2 ARG 23 1HB ARG 23 1.315 -4.621 -4.826
171 HB3 ARG 23 2HB ARG 23 1.425 -6.376 -4.778
172 HG2 ARG 23 1HG ARG 23 0.223 -4.506 -2.725
173 HG3 ARG 23 2HG ARG 23 -0.574 -5.764 -3.653
174 HD2 ARG 23 1HD ARG 23 1.338 -6.120 -1.316
175 HD3 ARG 23 2HD ARG 23 -0.384 -6.442 -1.350
176 HE ARG 23 HE ARG 23 0.031 -8.267 -2.958
177 HH11 ARG 23 1HH1 ARG 23 2.886 -7.307 -1.026
178 HH12 ARG 23 2HH1 ARG 23 3.503 -8.929 -1.040
179 HH21 ARG 23 1HH2 ARG 23 0.965 -10.278 -2.976
180 HH22 ARG 23 2HH2 ARG 23 2.472 -10.561 -2.162
181 H GLY 24 H GLY 24 3.618 -7.059 -5.377
182 HA2 GLY 24 1HA GLY 24 6.208 -6.126 -6.030
183 HA3 GLY 24 2HA GLY 24 5.265 -7.305 -6.964
184 H ASN 25 H ASN 25 3.196 -4.986 -7.324
185 HA ASN 25 HA ASN 25 4.323 -3.793 -9.735
186 HB2 ASN 25 1HB ASN 25 2.154 -2.806 -10.018
187 HB3 ASN 25 2HB ASN 25 1.956 -4.493 -9.567
188 HD21 ASN 25 1HD2 ASN 25 -0.217 -2.827 -9.335
189 HD22 ASN 25 2HD2 ASN 25 -0.540 -2.515 -7.638
190 H GLY 26 H GLY 26 4.691 -2.967 -6.465
191 HA2 GLY 26 1HA GLY 26 5.889 -1.166 -5.591
192 HA3 GLY 26 2HA GLY 26 5.693 -0.260 -7.112
193 H TYR 27 H TYR 27 2.823 -1.648 -5.666
194 HA TYR 27 HA TYR 27 2.104 0.916 -4.333
195 HB2 TYR 27 1HB TYR 27 0.545 -0.559 -6.457
196 HB3 TYR 27 2HB TYR 27 -0.259 0.454 -5.287
197 HD1 TYR 27 HD2 TYR 27 2.523 0.581 -7.835
198 HD2 TYR 27 HD1 TYR 27 -0.640 2.671 -5.799
199 HE1 TYR 27 HE2 TYR 27 2.958 2.568 -9.225
200 HE2 TYR 27 HE1 TYR 27 -0.293 4.641 -7.273
201 HH TYR 27 HH TYR 27 2.217 4.667 -9.842
202 H CYS 28 H CYS 28 0.389 0.797 -2.838
203 HA CYS 28 HA CYS 28 0.565 -1.454 -1.044
204 HB2 CYS 28 1HB CYS 28 -1.202 1.021 -1.046
205 HB3 CYS 28 2HB CYS 28 -0.998 -0.054 0.337
206 H GLY 29 H GLY 29 -0.776 -3.113 -0.679
207 HA2 GLY 29 1HA GLY 29 -3.603 -3.134 -1.596
208 HA3 GLY 29 2HA GLY 29 -2.534 -4.352 -2.275
209 HN1 NH2 30 2HN NH2 30 -3.994 -6.155 0.502
210 HN2 NH2 30 1HN NH2 30 -4.347 -5.666 -1.144
Start of MODEL 29
1 H1 GLY 1 1H GLY 1 -9.067 -3.662 12.165
2 H2 GLY 1 2H GLY 1 -7.547 -4.269 12.169
3 H3 GLY 1 3H GLY 1 -7.877 -2.883 12.975
4 HA2 GLY 1 1HA GLY 1 -8.363 -1.716 10.937
5 HA3 GLY 1 2HA GLY 1 -6.711 -2.366 10.946
6 H VAL 2 H VAL 2 -7.801 -1.721 8.534
7 HA VAL 2 HA VAL 2 -7.934 -4.275 7.110
8 HB VAL 2 HB VAL 2 -9.848 -3.581 5.698
9 HG11 VAL 2 1HG1 VAL 2 -10.190 -5.214 7.532
10 HG12 VAL 2 2HG1 VAL 2 -10.723 -3.884 8.591
11 HG13 VAL 2 3HG1 VAL 2 -11.646 -4.288 7.133
12 HG21 VAL 2 3HG2 VAL 2 -11.471 -1.896 6.443
13 HG22 VAL 2 1HG2 VAL 2 -10.427 -1.453 7.805
14 HG23 VAL 2 2HG2 VAL 2 -9.900 -1.151 6.134
15 H CYS 3 H CYS 3 -7.600 -3.888 4.747
16 HA CYS 3 HA CYS 3 -6.028 -1.417 4.294
17 HB2 CYS 3 1HB CYS 3 -4.988 -3.513 3.641
18 HB3 CYS 3 2HB CYS 3 -6.372 -3.959 2.663
19 HA PRO 4 HA PRO 4 -9.867 0.102 2.333
20 HB2 PRO 4 1HB PRO 4 -9.068 2.654 1.719
21 HB3 PRO 4 2HB PRO 4 -9.501 2.127 3.373
22 HG2 PRO 4 1HG PRO 4 -6.730 2.309 2.147
23 HG3 PRO 4 2HG PRO 4 -7.288 2.969 3.719
24 HD2 PRO 4 1HD PRO 4 -6.005 0.605 3.579
25 HD3 PRO 4 2HD PRO 4 -7.385 0.811 4.692
26 H LYS 5 H LYS 5 -10.460 1.034 0.188
27 HA LYS 5 HA LYS 5 -9.117 -0.404 -1.934
28 HB2 LYS 5 1HB LYS 5 -11.639 -0.063 -1.461
29 HB3 LYS 5 2HB LYS 5 -11.452 1.518 -2.226
30 HG2 LYS 5 1HG LYS 5 -10.645 0.354 -4.312
31 HG3 LYS 5 2HG LYS 5 -10.827 -1.203 -3.485
32 HD2 LYS 5 1HD LYS 5 -13.257 -0.780 -3.220
33 HD3 LYS 5 2HD LYS 5 -13.072 0.793 -4.029
34 HE2 LYS 5 1HE LYS 5 -12.231 -0.361 -6.069
35 HE3 LYS 5 2HE LYS 5 -12.420 -1.926 -5.264
36 HZ1 LYS 5 3HZ LYS 5 -14.318 -1.424 -6.678
37 HZ2 LYS 5 1HZ LYS 5 -14.809 -1.489 -5.122
38 HZ3 LYS 5 2HZ LYS 5 -14.634 -0.042 -5.866
39 H ILE 6 H ILE 6 -7.411 1.547 -0.889
40 HA ILE 6 HA ILE 6 -7.205 3.838 -2.747
41 HB ILE 6 HB ILE 6 -6.753 3.984 -0.285
42 HG12 ILE 6 1HG1 ILE 6 -4.390 4.819 -2.006
43 HG13 ILE 6 2HG1 ILE 6 -5.941 5.659 -1.932
44 HG21 ILE 6 1HG2 ILE 6 -5.494 1.788 -0.082
45 HG22 ILE 6 2HG2 ILE 6 -4.110 2.573 -0.870
46 HG23 ILE 6 3HG2 ILE 6 -4.708 3.156 0.694
47 HD11 ILE 6 3HD1 ILE 6 -4.356 6.799 -0.513
48 HD12 ILE 6 1HD1 ILE 6 -5.583 6.037 0.521
49 HD13 ILE 6 2HD1 ILE 6 -3.963 5.312 0.359
50 H LEU 7 H LEU 7 -5.391 4.247 -4.065
51 HA LEU 7 HA LEU 7 -3.602 1.946 -4.714
52 HB2 LEU 7 1HB LEU 7 -5.280 2.317 -6.520
53 HB3 LEU 7 2HB LEU 7 -4.743 3.987 -6.667
54 HG LEU 7 HG LEU 7 -2.479 3.186 -7.350
55 HD11 LEU 7 1HD1 LEU 7 -2.422 0.957 -6.270
56 HD12 LEU 7 2HD1 LEU 7 -3.755 0.410 -7.308
57 HD13 LEU 7 3HD1 LEU 7 -2.172 0.808 -8.011
58 HD21 LEU 7 3HD2 LEU 7 -3.137 2.427 -9.593
59 HD22 LEU 7 1HD2 LEU 7 -4.774 2.062 -9.004
60 HD23 LEU 7 2HD2 LEU 7 -4.186 3.739 -9.032
61 H LYS 8 H LYS 8 -2.157 2.652 -3.202
62 HA LYS 8 HA LYS 8 -0.951 5.380 -3.478
63 HB2 LYS 8 1HB LYS 8 -2.085 4.712 -1.298
64 HB3 LYS 8 2HB LYS 8 -0.852 3.460 -1.098
65 HG2 LYS 8 1HG LYS 8 0.906 5.282 -1.214
66 HG3 LYS 8 2HG LYS 8 -0.398 6.477 -1.328
67 HD2 LYS 8 1HD LYS 8 -1.227 5.691 0.915
68 HD3 LYS 8 2HD LYS 8 0.175 4.589 0.986
69 HE2 LYS 8 1HE LYS 8 1.690 6.577 0.683
70 HE3 LYS 8 2HE LYS 8 0.273 7.636 0.746
71 HZ1 LYS 8 3HZ LYS 8 1.343 7.486 2.901
72 HZ2 LYS 8 1HZ LYS 8 -0.137 6.800 3.014
73 HZ3 LYS 8 2HZ LYS 8 1.213 5.855 2.927
74 H LYS 9 H LYS 9 1.200 5.543 -4.068
75 HA LYS 9 HA LYS 9 2.710 3.267 -4.990
76 HB2 LYS 9 1HB LYS 9 3.530 6.118 -4.187
77 HB3 LYS 9 2HB LYS 9 4.628 4.969 -4.954
78 HG2 LYS 9 1HG LYS 9 3.305 4.905 -6.964
79 HG3 LYS 9 2HG LYS 9 2.046 5.938 -6.242
80 HD2 LYS 9 1HD LYS 9 3.693 7.775 -6.010
81 HD3 LYS 9 2HD LYS 9 4.947 6.746 -6.742
82 HE2 LYS 9 1HE LYS 9 3.601 6.571 -8.817
83 HE3 LYS 9 2HE LYS 9 2.328 7.562 -8.091
84 HZ1 LYS 9 3HZ LYS 9 3.785 8.886 -9.502
85 HZ2 LYS 9 1HZ LYS 9 3.926 9.395 -7.958
86 HZ3 LYS 9 2HZ LYS 9 5.103 8.477 -8.629
87 H CYS 10 H CYS 10 4.614 2.320 -4.130
88 HA CYS 10 HA CYS 10 5.574 3.024 -1.437
89 HB2 CYS 10 1HB CYS 10 5.095 0.888 -0.367
90 HB3 CYS 10 2HB CYS 10 3.614 1.662 -0.897
91 H ARG 11 H ARG 11 7.380 1.999 -0.702
92 HA ARG 11 HA ARG 11 8.983 0.307 -2.595
93 HB2 ARG 11 1HB ARG 11 9.892 2.256 -0.425
94 HB3 ARG 11 2HB ARG 11 10.956 1.149 -1.307
95 HG2 ARG 11 1HG ARG 11 10.297 2.221 -3.457
96 HG3 ARG 11 2HG ARG 11 9.297 3.383 -2.560
97 HD2 ARG 11 1HD ARG 11 11.297 4.186 -1.351
98 HD3 ARG 11 2HD ARG 11 12.303 3.018 -2.236
99 HE ARG 11 HE ARG 11 10.864 4.581 -4.123
100 HH11 ARG 11 1HH1 ARG 11 13.519 5.037 -1.829
101 HH12 ARG 11 2HH1 ARG 11 14.229 6.321 -2.762
102 HH21 ARG 11 1HH2 ARG 11 11.829 6.245 -5.280
103 HH22 ARG 11 2HH2 ARG 11 13.282 6.995 -4.690
104 H ARG 12 H ARG 12 7.527 0.633 0.580
105 HA ARG 12 HA ARG 12 7.760 -2.195 1.133
106 HB2 ARG 12 1HB ARG 12 8.992 -1.997 3.259
107 HB3 ARG 12 2HB ARG 12 9.985 -1.457 1.916
108 HG2 ARG 12 1HG ARG 12 9.430 0.934 2.493
109 HG3 ARG 12 2HG ARG 12 8.471 0.355 3.858
110 HD2 ARG 12 1HD ARG 12 10.627 1.048 4.689
111 HD3 ARG 12 2HD ARG 12 10.500 -0.701 4.831
112 HE ARG 12 HE ARG 12 12.227 -0.971 3.329
113 HH11 ARG 12 1HH1 ARG 12 11.231 2.423 3.106
114 HH12 ARG 12 2HH1 ARG 12 12.602 2.850 2.125
115 HH21 ARG 12 1HH2 ARG 12 13.944 -0.358 2.041
116 HH22 ARG 12 2HH2 ARG 12 14.110 1.292 1.522
117 H ASP 13 H ASP 13 6.833 -2.693 3.369
118 HA ASP 13 HA ASP 13 4.128 -1.950 3.205
119 HB2 ASP 13 1HB ASP 13 5.537 -3.115 5.639
120 HB3 ASP 13 2HB ASP 13 3.820 -3.237 5.257
121 H SER 14 H SER 14 6.665 -0.494 5.192
122 HA SER 14 HA SER 14 5.117 1.006 7.013
123 HB2 SER 14 1HB SER 14 7.749 1.845 5.744
124 HB3 SER 14 2HB SER 14 7.105 2.341 7.316
125 HG SER 14 HG SER 14 8.637 0.708 7.606
126 H ASP 15 H ASP 15 5.409 1.526 3.574
127 HA ASP 15 HA ASP 15 4.660 4.385 3.640
128 HB2 ASP 15 1HB ASP 15 4.685 2.373 1.362
129 HB3 ASP 15 2HB ASP 15 4.495 4.112 1.200
130 H CYS 16 H CYS 16 3.031 1.327 3.792
131 HA CYS 16 HA CYS 16 0.602 2.252 2.425
132 HB2 CYS 16 1HB CYS 16 1.425 -0.467 3.489
133 HB3 CYS 16 2HB CYS 16 -0.013 -0.119 2.549
134 HA PRO 17 HA PRO 17 -1.513 3.240 6.091
135 HB2 PRO 17 1HB PRO 17 -3.894 3.996 5.121
136 HB3 PRO 17 2HB PRO 17 -2.372 4.764 4.538
137 HG2 PRO 17 1HG PRO 17 -3.893 2.497 3.201
138 HG3 PRO 17 2HG PRO 17 -3.393 4.070 2.490
139 HD2 PRO 17 1HD PRO 17 -1.842 1.823 2.264
140 HD3 PRO 17 2HD PRO 17 -1.146 3.462 2.437
141 H GLY 18 H GLY 18 -3.081 2.557 7.634
142 HA2 GLY 18 1HA GLY 18 -4.429 1.044 8.773
143 HA3 GLY 18 2HA GLY 18 -5.103 0.608 7.194
144 H ALA 19 H ALA 19 -5.028 -1.506 6.906
145 HA ALA 19 HA ALA 19 -2.711 -3.125 7.863
146 HB1 ALA 19 3HB ALA 19 -4.169 -5.029 7.656
147 HB2 ALA 19 1HB ALA 19 -5.053 -3.765 8.525
148 HB3 ALA 19 2HB ALA 19 -5.397 -4.085 6.804
149 H CYS 20 H CYS 20 -3.092 -1.378 5.153
150 HA CYS 20 HA CYS 20 -2.735 -3.299 3.021
151 HB2 CYS 20 1HB CYS 20 -1.908 -0.393 3.213
152 HB3 CYS 20 2HB CYS 20 -1.777 -1.359 1.781
153 H ILE 21 H ILE 21 -0.949 -4.015 1.981
154 HA ILE 21 HA ILE 21 1.773 -3.623 3.189
155 HB ILE 21 HB ILE 21 2.263 -5.957 2.419
156 HG12 ILE 21 1HG1 ILE 21 -0.752 -6.373 2.285
157 HG13 ILE 21 2HG1 ILE 21 0.263 -6.145 0.864
158 HG21 ILE 21 1HG2 ILE 21 1.822 -5.338 4.791
159 HG22 ILE 21 2HG2 ILE 21 0.111 -5.762 4.570
160 HG23 ILE 21 3HG2 ILE 21 1.371 -7.006 4.429
161 HD11 ILE 21 3HD1 ILE 21 -0.106 -8.503 1.181
162 HD12 ILE 21 1HD1 ILE 21 1.603 -8.151 1.506
163 HD13 ILE 21 2HD1 ILE 21 0.473 -8.433 2.853
164 H CYS 22 H CYS 22 3.531 -3.838 1.626
165 HA CYS 22 HA CYS 22 2.791 -2.474 -0.879
166 HB2 CYS 22 1HB CYS 22 4.765 -1.844 0.572
167 HB3 CYS 22 2HB CYS 22 5.541 -3.344 0.075
168 H ARG 23 H ARG 23 2.594 -3.393 -2.849
169 HA ARG 23 HA ARG 23 3.143 -6.318 -3.131
170 HB2 ARG 23 1HB ARG 23 1.327 -4.608 -4.849
171 HB3 ARG 23 2HB ARG 23 1.436 -6.363 -4.800
172 HG2 ARG 23 1HG ARG 23 0.226 -4.491 -2.753
173 HG3 ARG 23 2HG ARG 23 -0.570 -5.746 -3.687
174 HD2 ARG 23 1HD ARG 23 1.330 -6.112 -1.340
175 HD3 ARG 23 2HD ARG 23 -0.393 -6.427 -1.384
176 HE ARG 23 HE ARG 23 0.023 -8.252 -2.992
177 HH11 ARG 23 1HH1 ARG 23 2.874 -7.303 -1.048
178 HH12 ARG 23 2HH1 ARG 23 3.487 -8.926 -1.063
179 HH21 ARG 23 1HH2 ARG 23 0.952 -10.266 -3.008
180 HH22 ARG 23 2HH2 ARG 23 2.455 -10.554 -2.187
181 H GLY 24 H GLY 24 3.637 -7.044 -5.384
182 HA2 GLY 24 1HA GLY 24 6.223 -6.095 -6.036
183 HA3 GLY 24 2HA GLY 24 5.291 -7.288 -6.963
184 H ASN 25 H ASN 25 3.203 -4.980 -7.336
185 HA ASN 25 HA ASN 25 4.319 -3.804 -9.758
186 HB2 ASN 25 1HB ASN 25 2.150 -2.825 -10.046
187 HB3 ASN 25 2HB ASN 25 1.951 -4.505 -9.572
188 HD21 ASN 25 1HD2 ASN 25 -0.216 -2.820 -9.356
189 HD22 ASN 25 2HD2 ASN 25 -0.533 -2.490 -7.661
190 H GLY 26 H GLY 26 4.701 -2.954 -6.498
191 HA2 GLY 26 1HA GLY 26 5.906 -1.145 -5.646
192 HA3 GLY 26 2HA GLY 26 5.694 -0.248 -7.170
193 H TYR 27 H TYR 27 2.830 -1.630 -5.718
194 HA TYR 27 HA TYR 27 2.129 0.920 -4.355
195 HB2 TYR 27 1HB TYR 27 0.538 -0.512 -6.487
196 HB3 TYR 27 2HB TYR 27 -0.239 0.506 -5.304
197 HD1 TYR 27 HD1 TYR 27 2.524 0.599 -7.873
198 HD2 TYR 27 HD2 TYR 27 -0.594 2.729 -5.808
199 HE1 TYR 27 HE1 TYR 27 2.973 2.580 -9.266
200 HE2 TYR 27 HE2 TYR 27 -0.227 4.699 -7.280
201 HH TYR 27 HH TYR 27 2.230 4.668 -9.900
202 H CYS 28 H CYS 28 0.400 0.786 -2.868
203 HA CYS 28 HA CYS 28 0.574 -1.485 -1.100
204 HB2 CYS 28 1HB CYS 28 -1.212 0.977 -1.100
205 HB3 CYS 28 2HB CYS 28 -1.018 -0.107 0.280
206 H GLY 29 H GLY 29 -0.797 -3.126 -0.699
207 HA2 GLY 29 1HA GLY 29 -3.608 -3.154 -1.636
208 HA3 GLY 29 2HA GLY 29 -2.545 -4.356 -2.347
209 HN1 NH2 30 2HN NH2 30 -3.963 -6.238 0.390
210 HN2 NH2 30 1HN NH2 30 -4.305 -5.734 -1.253
Start of MODEL 30
1 H1 GLY 1 1H GLY 1 -8.969 -4.096 12.139
2 H2 GLY 1 2H GLY 1 -7.548 -4.890 11.959
3 H3 GLY 1 3H GLY 1 -7.638 -3.585 12.944
4 HA2 GLY 1 1HA GLY 1 -8.076 -2.117 11.099
5 HA3 GLY 1 2HA GLY 1 -6.534 -2.975 10.905
6 H VAL 2 H VAL 2 -7.346 -2.030 8.626
7 HA VAL 2 HA VAL 2 -7.965 -4.297 6.962
8 HB VAL 2 HB VAL 2 -10.267 -3.702 7.673
9 HG11 VAL 2 1HG1 VAL 2 -9.993 -1.256 8.012
10 HG12 VAL 2 2HG1 VAL 2 -9.851 -1.038 6.253
11 HG13 VAL 2 3HG1 VAL 2 -11.360 -1.644 6.958
12 HG21 VAL 2 3HG2 VAL 2 -11.313 -3.728 5.522
13 HG22 VAL 2 1HG2 VAL 2 -9.871 -3.074 4.732
14 HG23 VAL 2 2HG2 VAL 2 -9.839 -4.708 5.440
15 H CYS 3 H CYS 3 -7.520 -3.836 4.736
16 HA CYS 3 HA CYS 3 -5.828 -1.443 4.340
17 HB2 CYS 3 1HB CYS 3 -4.930 -3.549 3.592
18 HB3 CYS 3 2HB CYS 3 -6.372 -3.915 2.666
19 HA PRO 4 HA PRO 4 -9.581 0.439 2.543
20 HB2 PRO 4 1HB PRO 4 -8.580 2.949 1.994
21 HB3 PRO 4 2HB PRO 4 -9.097 2.401 3.618
22 HG2 PRO 4 1HG PRO 4 -6.290 2.440 2.472
23 HG3 PRO 4 2HG PRO 4 -6.843 3.040 4.068
24 HD2 PRO 4 1HD PRO 4 -5.706 0.613 3.802
25 HD3 PRO 4 2HD PRO 4 -7.091 0.843 4.904
26 H LYS 5 H LYS 5 -10.243 1.290 0.473
27 HA LYS 5 HA LYS 5 -9.093 -0.229 -1.660
28 HB2 LYS 5 1HB LYS 5 -11.049 0.489 -2.905
29 HB3 LYS 5 2HB LYS 5 -11.499 0.029 -1.266
30 HG2 LYS 5 1HG LYS 5 -11.622 2.432 -0.614
31 HG3 LYS 5 2HG LYS 5 -11.150 2.902 -2.258
32 HD2 LYS 5 1HD LYS 5 -13.177 1.790 -3.160
33 HD3 LYS 5 2HD LYS 5 -13.650 1.320 -1.511
34 HE2 LYS 5 1HE LYS 5 -13.734 3.719 -0.856
35 HE3 LYS 5 2HE LYS 5 -13.262 4.187 -2.495
36 HZ1 LYS 5 3HZ LYS 5 -15.660 4.318 -2.196
37 HZ2 LYS 5 1HZ LYS 5 -15.317 3.172 -3.307
38 HZ3 LYS 5 2HZ LYS 5 -15.756 2.739 -1.791
39 H ILE 6 H ILE 6 -7.473 2.132 -0.728
40 HA ILE 6 HA ILE 6 -7.302 3.979 -3.006
41 HB ILE 6 HB ILE 6 -6.945 4.747 -0.709
42 HG12 ILE 6 1HG1 ILE 6 -4.815 5.990 -0.932
43 HG13 ILE 6 2HG1 ILE 6 -4.400 5.042 -2.355
44 HG21 ILE 6 1HG2 ILE 6 -5.829 2.673 0.203
45 HG22 ILE 6 2HG2 ILE 6 -4.344 3.157 -0.638
46 HG23 ILE 6 3HG2 ILE 6 -5.033 4.186 0.633
47 HD11 ILE 6 3HD1 ILE 6 -5.337 7.265 -2.906
48 HD12 ILE 6 1HD1 ILE 6 -6.364 5.973 -3.550
49 HD13 ILE 6 2HD1 ILE 6 -6.845 6.843 -2.070
50 H LEU 7 H LEU 7 -5.703 4.135 -4.510
51 HA LEU 7 HA LEU 7 -3.769 1.870 -4.787
52 HB2 LEU 7 1HB LEU 7 -5.390 2.155 -6.654
53 HB3 LEU 7 2HB LEU 7 -4.818 3.804 -6.892
54 HG LEU 7 HG LEU 7 -2.552 2.918 -7.459
55 HD11 LEU 7 1HD1 LEU 7 -2.577 0.757 -6.240
56 HD12 LEU 7 2HD1 LEU 7 -3.888 0.174 -7.286
57 HD13 LEU 7 3HD1 LEU 7 -2.276 0.497 -7.959
58 HD21 LEU 7 3HD2 LEU 7 -3.166 2.032 -9.668
59 HD22 LEU 7 1HD2 LEU 7 -4.826 1.737 -9.104
60 HD23 LEU 7 2HD2 LEU 7 -4.200 3.397 -9.219
61 H LYS 8 H LYS 8 -2.306 2.615 -3.327
62 HA LYS 8 HA LYS 8 -1.036 5.300 -3.737
63 HB2 LYS 8 1HB LYS 8 -2.161 4.791 -1.510
64 HB3 LYS 8 2HB LYS 8 -0.990 3.485 -1.269
65 HG2 LYS 8 1HG LYS 8 0.848 5.233 -1.550
66 HG3 LYS 8 2HG LYS 8 -0.409 6.473 -1.605
67 HD2 LYS 8 1HD LYS 8 -1.132 5.815 0.676
68 HD3 LYS 8 2HD LYS 8 0.136 4.574 0.720
69 HE2 LYS 8 1HE LYS 8 0.685 7.549 0.300
70 HE3 LYS 8 2HE LYS 8 0.688 6.774 1.888
71 HZ1 LYS 8 3HZ LYS 8 2.922 6.895 0.951
72 HZ2 LYS 8 1HZ LYS 8 2.475 5.343 1.174
73 HZ3 LYS 8 2HZ LYS 8 2.494 5.981 -0.338
74 H LYS 9 H LYS 9 1.085 5.319 -4.477
75 HA LYS 9 HA LYS 9 2.545 2.853 -4.953
76 HB2 LYS 9 1HB LYS 9 4.364 4.280 -5.687
77 HB3 LYS 9 2HB LYS 9 2.833 4.769 -6.412
78 HG2 LYS 9 1HG LYS 9 2.584 6.558 -4.738
79 HG3 LYS 9 2HG LYS 9 4.150 6.119 -4.036
80 HD2 LYS 9 1HD LYS 9 3.680 7.105 -6.890
81 HD3 LYS 9 2HD LYS 9 4.270 8.095 -5.547
82 HE2 LYS 9 1HE LYS 9 6.264 6.605 -5.332
83 HE3 LYS 9 2HE LYS 9 5.694 5.658 -6.715
84 HZ1 LYS 9 3HZ LYS 9 7.323 7.312 -7.392
85 HZ2 LYS 9 1HZ LYS 9 5.883 7.662 -8.080
86 HZ3 LYS 9 2HZ LYS 9 6.414 8.536 -6.804
87 H CYS 10 H CYS 10 4.617 2.262 -4.052
88 HA CYS 10 HA CYS 10 5.322 3.287 -1.365
89 HB2 CYS 10 1HB CYS 10 4.926 1.096 -0.254
90 HB3 CYS 10 2HB CYS 10 3.471 1.879 -0.834
91 H ARG 11 H ARG 11 7.222 2.677 -0.502
92 HA ARG 11 HA ARG 11 9.199 1.254 -2.188
93 HB2 ARG 11 1HB ARG 11 9.756 3.415 -1.100
94 HB3 ARG 11 2HB ARG 11 9.451 2.709 0.483
95 HG2 ARG 11 1HG ARG 11 11.832 2.851 0.057
96 HG3 ARG 11 2HG ARG 11 11.357 1.157 0.179
97 HD2 ARG 11 1HD ARG 11 11.413 0.948 -2.286
98 HD3 ARG 11 2HD ARG 11 11.794 2.678 -2.431
99 HE ARG 11 HE ARG 11 13.724 1.472 -0.733
100 HH11 ARG 11 1HH1 ARG 11 12.853 1.400 -4.162
101 HH12 ARG 11 2HH1 ARG 11 14.471 1.002 -4.661
102 HH21 ARG 11 1HH2 ARG 11 15.790 0.959 -1.441
103 HH22 ARG 11 2HH2 ARG 11 16.111 0.757 -3.136
104 H ARG 12 H ARG 12 7.429 0.880 0.858
105 HA ARG 12 HA ARG 12 7.619 -1.981 0.913
106 HB2 ARG 12 1HB ARG 12 8.863 -2.281 2.972
107 HB3 ARG 12 2HB ARG 12 9.889 -1.445 1.820
108 HG2 ARG 12 1HG ARG 12 9.496 0.709 2.955
109 HG3 ARG 12 2HG ARG 12 8.321 -0.050 4.039
110 HD2 ARG 12 1HD ARG 12 10.170 -1.593 4.831
111 HD3 ARG 12 2HD ARG 12 11.313 -0.591 3.936
112 HE ARG 12 HE ARG 12 9.686 0.135 6.328
113 HH11 ARG 12 1HH1 ARG 12 12.118 1.295 4.018
114 HH12 ARG 12 2HH1 ARG 12 12.541 2.651 5.020
115 HH21 ARG 12 1HH2 ARG 12 10.310 1.859 7.571
116 HH22 ARG 12 2HH2 ARG 12 11.523 2.970 7.007
117 H ASP 13 H ASP 13 6.742 -2.751 3.186
118 HA ASP 13 HA ASP 13 4.038 -2.031 3.191
119 HB2 ASP 13 1HB ASP 13 5.547 -3.304 5.507
120 HB3 ASP 13 2HB ASP 13 3.828 -3.455 5.153
121 H SER 14 H SER 14 6.619 -0.737 5.265
122 HA SER 14 HA SER 14 5.105 0.621 7.220
123 HB2 SER 14 1HB SER 14 7.670 1.645 5.957
124 HB3 SER 14 2HB SER 14 7.105 1.904 7.610
125 HG SER 14 HG SER 14 7.461 -0.330 8.005
126 H ASP 15 H ASP 15 5.406 1.420 3.838
127 HA ASP 15 HA ASP 15 4.530 4.234 4.239
128 HB2 ASP 15 1HB ASP 15 6.516 3.623 2.797
129 HB3 ASP 15 2HB ASP 15 5.401 2.797 1.706
130 H CYS 16 H CYS 16 2.998 1.326 4.042
131 HA CYS 16 HA CYS 16 0.755 2.246 2.310
132 HB2 CYS 16 1HB CYS 16 1.539 -0.487 3.341
133 HB3 CYS 16 2HB CYS 16 0.039 -0.137 2.507
134 HA PRO 17 HA PRO 17 -1.555 3.366 5.771
135 HB2 PRO 17 1HB PRO 17 -3.918 4.009 4.664
136 HB3 PRO 17 2HB PRO 17 -2.383 4.787 4.131
137 HG2 PRO 17 1HG PRO 17 -3.795 2.450 2.799
138 HG3 PRO 17 2HG PRO 17 -3.257 3.996 2.057
139 HD2 PRO 17 1HD PRO 17 -1.695 1.750 2.017
140 HD3 PRO 17 2HD PRO 17 -1.017 3.398 2.161
141 H GLY 18 H GLY 18 -3.062 2.719 7.348
142 HA2 GLY 18 1HA GLY 18 -4.378 1.240 8.568
143 HA3 GLY 18 2HA GLY 18 -5.068 0.720 7.022
144 H ALA 19 H ALA 19 -4.957 -1.405 6.842
145 HA ALA 19 HA ALA 19 -2.583 -2.931 7.815
146 HB1 ALA 19 3HB ALA 19 -4.011 -4.876 7.713
147 HB2 ALA 19 1HB ALA 19 -4.873 -3.597 8.578
148 HB3 ALA 19 2HB ALA 19 -5.287 -3.976 6.884
149 H CYS 20 H CYS 20 -3.014 -1.310 5.063
150 HA CYS 20 HA CYS 20 -2.725 -3.282 2.975
151 HB2 CYS 20 1HB CYS 20 -1.878 -0.382 3.134
152 HB3 CYS 20 2HB CYS 20 -1.706 -1.347 1.709
153 H ILE 21 H ILE 21 -0.995 -4.097 1.941
154 HA ILE 21 HA ILE 21 1.763 -3.740 3.080
155 HB ILE 21 HB ILE 21 2.220 -6.035 2.217
156 HG12 ILE 21 1HG1 ILE 21 -0.799 -6.416 2.056
157 HG13 ILE 21 2HG1 ILE 21 0.227 -6.143 0.647
158 HG21 ILE 21 1HG2 ILE 21 1.778 -5.518 4.614
159 HG22 ILE 21 2HG2 ILE 21 0.064 -5.919 4.371
160 HG23 ILE 21 3HG2 ILE 21 1.315 -7.163 4.178
161 HD11 ILE 21 3HD1 ILE 21 -0.169 -8.507 0.867
162 HD12 ILE 21 1HD1 ILE 21 1.541 -8.191 1.227
163 HD13 ILE 21 2HD1 ILE 21 0.391 -8.511 2.548
164 H CYS 22 H CYS 22 3.493 -3.893 1.500
165 HA CYS 22 HA CYS 22 2.727 -2.466 -0.982
166 HB2 CYS 22 1HB CYS 22 4.607 -1.738 0.552
167 HB3 CYS 22 2HB CYS 22 5.500 -3.165 0.032
168 H ARG 23 H ARG 23 2.285 -3.542 -2.782
169 HA ARG 23 HA ARG 23 2.965 -6.395 -3.071
170 HB2 ARG 23 1HB ARG 23 1.296 -4.596 -4.865
171 HB3 ARG 23 2HB ARG 23 1.370 -6.351 -4.912
172 HG2 ARG 23 1HG ARG 23 0.159 -4.607 -2.732
173 HG3 ARG 23 2HG ARG 23 -0.689 -5.661 -3.852
174 HD2 ARG 23 1HD ARG 23 1.166 -6.531 -1.599
175 HD3 ARG 23 2HD ARG 23 -0.591 -6.634 -1.611
176 HE ARG 23 HE ARG 23 -0.389 -8.188 -3.571
177 HH11 ARG 23 1HH1 ARG 23 2.300 -8.082 -1.244
178 HH12 ARG 23 2HH1 ARG 23 2.802 -9.694 -1.645
179 HH21 ARG 23 1HH2 ARG 23 0.332 -10.240 -4.020
180 HH22 ARG 23 2HH2 ARG 23 1.706 -10.895 -3.185
181 H GLY 24 H GLY 24 3.564 -7.170 -5.309
182 HA2 GLY 24 1HA GLY 24 6.204 -6.299 -5.859
183 HA3 GLY 24 2HA GLY 24 5.274 -7.465 -6.822
184 H ASN 25 H ASN 25 3.258 -5.129 -7.291
185 HA ASN 25 HA ASN 25 4.521 -3.962 -9.650
186 HB2 ASN 25 1HB ASN 25 2.369 -3.005 -10.087
187 HB3 ASN 25 2HB ASN 25 2.154 -4.685 -9.621
188 HD21 ASN 25 1HD2 ASN 25 -0.054 -3.079 -9.549
189 HD22 ASN 25 2HD2 ASN 25 -0.480 -2.720 -7.884
190 H GLY 26 H GLY 26 4.703 -3.103 -6.383
191 HA2 GLY 26 1HA GLY 26 5.849 -1.289 -5.471
192 HA3 GLY 26 2HA GLY 26 5.714 -0.396 -7.005
193 H TYR 27 H TYR 27 2.746 -1.736 -5.791
194 HA TYR 27 HA TYR 27 1.974 0.851 -4.494
195 HB2 TYR 27 1HB TYR 27 0.483 -0.754 -6.609
196 HB3 TYR 27 2HB TYR 27 -0.359 0.262 -5.466
197 HD1 TYR 27 HD1 TYR 27 2.503 0.467 -7.924
198 HD2 TYR 27 HD2 TYR 27 -0.732 2.488 -5.927
199 HE1 TYR 27 HE1 TYR 27 3.038 2.534 -9.169
200 HE2 TYR 27 HE2 TYR 27 -0.241 4.557 -7.217
201 HH TYR 27 HH TYR 27 2.415 4.702 -9.627
202 H CYS 28 H CYS 28 0.260 0.718 -2.989
203 HA CYS 28 HA CYS 28 0.439 -1.491 -1.150
204 HB2 CYS 28 1HB CYS 28 -1.329 0.980 -1.235
205 HB3 CYS 28 2HB CYS 28 -1.164 -0.064 0.172
206 H GLY 29 H GLY 29 -0.960 -3.092 -0.649
207 HA2 GLY 29 1HA GLY 29 -3.751 -3.187 -1.564
208 HA3 GLY 29 2HA GLY 29 -2.693 -4.330 -2.370
209 HN1 NH2 30 2HN NH2 30 -3.916 -6.401 0.314
210 HN2 NH2 30 1HN NH2 30 -4.297 -5.863 -1.310
Contact the webmaster for help, if required. Saturday, May 18, 2024 11:48:20 PM GMT (wattos1)