Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
21942 | 2ikd RC | 15105 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H GLN 11 H GLN 11 -11.137 -10.801 -5.260
2 HA GLN 11 HA GLN 11 -10.981 -13.599 -4.404
3 HB2 GLN 11 2HB GLN 11 -9.425 -12.095 -6.053
4 HB3 GLN 11 1HB GLN 11 -8.651 -11.785 -4.505
5 HG2 GLN 11 2HG GLN 11 -7.484 -13.625 -5.022
6 HG3 GLN 11 1HG GLN 11 -8.897 -14.457 -4.373
7 HE21 GLN 11 1HE2 GLN 11 -9.795 -15.933 -5.617
8 HE22 GLN 11 2HE2 GLN 11 -9.608 -16.072 -7.328
9 H ALA 12 H ALA 12 -9.882 -14.001 -2.396
10 HA ALA 12 HA ALA 12 -10.622 -12.065 -0.351
11 HB1 ALA 12 3HB ALA 12 -11.318 -14.256 0.166
12 HB2 ALA 12 1HB ALA 12 -9.925 -13.948 1.203
13 HB3 ALA 12 2HB ALA 12 -9.745 -14.938 -0.244
14 H CYS 13 H CYS 13 -9.221 -10.673 0.486
15 HA CYS 13 HA CYS 13 -6.344 -11.285 0.271
16 HB2 CYS 13 2HB CYS 13 -5.919 -8.893 0.159
17 HB3 CYS 13 1HB CYS 13 -7.048 -9.360 -1.107
18 H THR 14 H THR 14 -4.997 -10.160 1.950
19 HA THR 14 HA THR 14 -6.341 -10.376 4.559
20 HB THR 14 HB THR 14 -4.598 -12.003 4.359
21 HG1 THR 14 1HG THR 14 -3.407 -11.451 6.109
22 HG21 THR 14 3HG2 THR 14 -2.279 -11.450 3.907
23 HG22 THR 14 1HG2 THR 14 -2.724 -9.768 3.619
24 HG23 THR 14 2HG2 THR 14 -3.307 -11.033 2.537
25 H LEU 15 H LEU 15 -6.782 -8.507 5.493
26 HA LEU 15 HA LEU 15 -5.813 -6.014 4.666
27 HB2 LEU 15 2HB LEU 15 -6.668 -5.288 6.997
28 HB3 LEU 15 1HB LEU 15 -7.815 -5.900 5.821
29 HG LEU 15 HG LEU 15 -6.696 -7.955 7.601
30 HD11 LEU 15 1HD1 LEU 15 -8.787 -6.360 8.920
31 HD12 LEU 15 2HD1 LEU 15 -7.179 -5.635 8.887
32 HD13 LEU 15 3HD1 LEU 15 -7.414 -7.226 9.606
33 HD21 LEU 15 3HD2 LEU 15 -8.446 -8.865 6.530
34 HD22 LEU 15 1HD2 LEU 15 -9.189 -7.301 6.199
35 HD23 LEU 15 2HD2 LEU 15 -9.405 -8.065 7.773
36 HA PRO 16 HA PRO 16 -1.900 -5.242 6.519
37 HB2 PRO 16 2HB PRO 16 -2.478 -3.052 8.174
38 HB3 PRO 16 1HB PRO 16 -1.975 -2.977 6.483
39 HG2 PRO 16 2HG PRO 16 -4.710 -2.814 7.659
40 HG3 PRO 16 1HG PRO 16 -4.035 -1.966 6.255
41 HD2 PRO 16 2HD PRO 16 -5.712 -4.025 5.948
42 HD3 PRO 16 1HD PRO 16 -4.334 -3.797 4.852
43 H ASN 17 H ASN 17 -4.696 -5.497 8.596
44 HA ASN 17 HA ASN 17 -3.111 -5.962 10.977
45 HB2 ASN 17 2HB ASN 17 -5.695 -5.051 10.519
46 HB3 ASN 17 1HB ASN 17 -5.933 -6.666 11.177
47 HD21 ASN 17 1HD2 ASN 17 -4.815 -7.158 13.202
48 HD22 ASN 17 2HD2 ASN 17 -4.613 -5.894 14.363
49 H ASN 18 H ASN 18 -4.183 -7.806 8.365
50 HA ASN 18 HA ASN 18 -4.137 -10.025 7.895
51 HB2 ASN 18 2HB ASN 18 -2.379 -9.830 10.293
52 HB3 ASN 18 1HB ASN 18 -2.914 -11.435 9.805
53 HD21 ASN 18 1HD2 ASN 18 -1.251 -8.539 8.720
54 HD22 ASN 18 2HD2 ASN 18 -0.309 -9.314 7.496
55 H ASP 19 H ASP 19 -6.442 -10.021 8.145
56 HA ASP 19 HA ASP 19 -7.301 -11.888 10.198
57 HB2 ASP 19 2HB ASP 19 -8.019 -9.036 10.188
58 HB3 ASP 19 1HB ASP 19 -9.397 -10.125 10.304
59 H LYS 20 H LYS 20 -6.987 -11.733 7.223
60 HA LYS 20 HA LYS 20 -8.039 -12.529 5.374
61 HB2 LYS 20 2HB LYS 20 -10.110 -13.449 7.375
62 HB3 LYS 20 1HB LYS 20 -10.026 -13.963 5.696
63 HG2 LYS 20 2HG LYS 20 -8.842 -15.681 6.480
64 HG3 LYS 20 1HG LYS 20 -7.509 -14.530 6.579
65 HD2 LYS 20 2HD LYS 20 -8.647 -14.006 8.924
66 HD3 LYS 20 1HD LYS 20 -9.207 -15.668 8.733
67 HE2 LYS 20 2HE LYS 20 -7.144 -16.533 9.017
68 HE3 LYS 20 1HE LYS 20 -6.360 -15.219 8.140
69 HZ1 LYS 20 3HZ LYS 20 -5.943 -15.438 10.643
70 HZ2 LYS 20 1HZ LYS 20 -7.489 -14.773 10.829
71 HZ3 LYS 20 2HZ LYS 20 -6.282 -13.900 10.024
72 H GLY 21 H GLY 21 -9.405 -11.763 3.809
73 HA2 GLY 21 2HA GLY 21 -11.808 -10.344 4.372
74 HA3 GLY 21 1HA GLY 21 -10.488 -9.232 4.049
75 H THR 22 H THR 22 -12.143 -8.719 2.302
76 HA THR 22 HA THR 22 -11.672 -10.435 -0.046
77 HB THR 22 HB THR 22 -13.970 -8.512 0.355
78 HG1 THR 22 1HG THR 22 -15.183 -10.263 0.936
79 HG21 THR 22 3HG2 THR 22 -14.795 -9.139 -1.625
80 HG22 THR 22 1HG2 THR 22 -14.259 -10.809 -1.439
81 HG23 THR 22 2HG2 THR 22 -13.122 -9.574 -1.980
82 H CYS 23 H CYS 23 -11.118 -9.456 -2.012
83 HA CYS 23 HA CYS 23 -10.292 -6.636 -1.783
84 HB2 CYS 23 2HB CYS 23 -8.551 -8.628 -2.026
85 HB3 CYS 23 1HB CYS 23 -8.949 -8.447 -3.731
86 H LYS 24 H LYS 24 -11.296 -5.292 -3.085
87 HA LYS 24 HA LYS 24 -12.054 -6.132 -5.773
88 HB2 LYS 24 2HB LYS 24 -14.327 -5.185 -5.519
89 HB3 LYS 24 1HB LYS 24 -14.061 -6.587 -4.491
90 HG2 LYS 24 2HG LYS 24 -13.580 -5.002 -2.611
91 HG3 LYS 24 1HG LYS 24 -14.115 -3.696 -3.670
92 HD2 LYS 24 2HD LYS 24 -16.087 -4.151 -2.614
93 HD3 LYS 24 1HD LYS 24 -16.214 -5.287 -3.959
94 HE2 LYS 24 2HE LYS 24 -16.008 -7.087 -2.620
95 HE3 LYS 24 1HE LYS 24 -14.803 -6.311 -1.593
96 HZ1 LYS 24 3HZ LYS 24 -17.214 -6.845 -0.731
97 HZ2 LYS 24 1HZ LYS 24 -17.558 -5.342 -1.430
98 HZ3 LYS 24 2HZ LYS 24 -16.382 -5.464 -0.219
99 H SER 25 H SER 25 -12.887 -4.188 -7.044
100 HA SER 25 HA SER 25 -10.962 -2.166 -7.025
101 HB2 SER 25 2HB SER 25 -13.730 -1.848 -8.190
102 HB3 SER 25 1HB SER 25 -12.225 -1.121 -8.750
103 HG SER 25 HG SER 25 -11.535 -3.356 -9.154
104 H LEU 26 H LEU 26 -11.827 0.273 -7.077
105 HA LEU 26 HA LEU 26 -12.788 0.752 -4.363
106 HB2 LEU 26 2HB LEU 26 -11.926 2.963 -4.587
107 HB3 LEU 26 1HB LEU 26 -10.716 1.849 -5.196
108 HG LEU 26 HG LEU 26 -12.198 2.552 -7.451
109 HD11 LEU 26 1HD1 LEU 26 -11.413 5.175 -6.403
110 HD12 LEU 26 2HD1 LEU 26 -12.837 4.471 -5.640
111 HD13 LEU 26 3HD1 LEU 26 -12.800 4.710 -7.387
112 HD21 LEU 26 3HD2 LEU 26 -10.149 3.734 -8.102
113 HD22 LEU 26 1HD2 LEU 26 -9.802 2.162 -7.380
114 HD23 LEU 26 2HD2 LEU 26 -9.572 3.636 -6.438
115 H LEU 27 H LEU 27 -14.623 -0.111 -6.485
116 HA LEU 27 HA LEU 27 -16.553 2.062 -6.205
117 HB2 LEU 27 2HB LEU 27 -16.238 0.670 -8.850
118 HB3 LEU 27 1HB LEU 27 -17.151 2.122 -8.486
119 HG LEU 27 HG LEU 27 -14.160 2.081 -8.228
120 HD11 LEU 27 1HD1 LEU 27 -14.495 3.283 -10.594
121 HD12 LEU 27 2HD1 LEU 27 -15.796 2.096 -10.687
122 HD13 LEU 27 3HD1 LEU 27 -14.134 1.564 -10.428
123 HD21 LEU 27 3HD2 LEU 27 -15.424 3.941 -7.229
124 HD22 LEU 27 1HD2 LEU 27 -16.133 4.288 -8.806
125 HD23 LEU 27 2HD2 LEU 27 -14.396 4.470 -8.561
126 H GLN 28 H GLN 28 -16.183 -0.587 -4.990
127 HA GLN 28 HA GLN 28 -18.755 -1.771 -5.796
128 HB2 GLN 28 2HB GLN 28 -16.158 -3.149 -5.152
129 HB3 GLN 28 1HB GLN 28 -17.699 -3.982 -5.008
130 HG2 GLN 28 2HG GLN 28 -17.940 -2.980 -7.490
131 HG3 GLN 28 1HG GLN 28 -16.192 -3.183 -7.403
132 HE21 GLN 28 1HE2 GLN 28 -18.592 -4.605 -8.735
133 HE22 GLN 28 2HE2 GLN 28 -18.255 -6.276 -8.456
134 H CYS 29 H CYS 29 -16.344 -1.588 -3.184
135 HA CYS 29 HA CYS 29 -17.977 -2.541 -1.124
136 HB2 CYS 29 2HB CYS 29 -15.379 -1.825 -1.278
137 HB3 CYS 29 1HB CYS 29 -16.022 -0.421 -0.433
138 H ASP 30 H ASP 30 -19.537 -1.654 0.102
139 HA ASP 30 HA ASP 30 -20.856 0.678 -0.720
140 HB2 ASP 30 2HB ASP 30 -21.051 -1.114 1.663
141 HB3 ASP 30 1HB ASP 30 -21.903 0.427 1.689
142 H VAL 31 H VAL 31 -18.611 0.098 1.941
143 HA VAL 31 HA VAL 31 -18.767 2.711 3.029
144 HB VAL 31 HB VAL 31 -17.909 0.822 4.337
145 HG11 VAL 31 1HG1 VAL 31 -15.503 0.931 2.523
146 HG12 VAL 31 2HG1 VAL 31 -16.739 -0.327 2.502
147 HG13 VAL 31 3HG1 VAL 31 -15.717 -0.120 3.925
148 HG21 VAL 31 3HG2 VAL 31 -15.482 2.445 4.313
149 HG22 VAL 31 1HG2 VAL 31 -16.663 2.188 5.597
150 HG23 VAL 31 2HG2 VAL 31 -16.966 3.397 4.350
151 H ALA 32 H ALA 32 -16.610 1.175 0.705
152 HA ALA 32 HA ALA 32 -14.841 3.354 0.396
153 HB1 ALA 32 3HB ALA 32 -14.004 2.215 -1.528
154 HB2 ALA 32 1HB ALA 32 -15.481 1.262 -1.675
155 HB3 ALA 32 2HB ALA 32 -14.393 0.997 -0.313
156 H SER 33 H SER 33 -17.863 2.472 -1.161
157 HA SER 33 HA SER 33 -17.760 4.378 -3.243
158 HB2 SER 33 2HB SER 33 -20.192 3.117 -1.957
159 HB3 SER 33 1HB SER 33 -20.147 3.920 -3.526
160 HG SER 33 HG SER 33 -19.334 1.394 -2.816
161 H LYS 34 H LYS 34 -18.973 4.517 0.061
162 HA LYS 34 HA LYS 34 -20.292 7.016 -0.238
163 HB2 LYS 34 2HB LYS 34 -20.582 7.002 2.125
164 HB3 LYS 34 1HB LYS 34 -20.760 5.344 1.575
165 HG2 LYS 34 2HG LYS 34 -19.090 4.643 2.857
166 HG3 LYS 34 1HG LYS 34 -18.025 5.938 2.316
167 HD2 LYS 34 2HD LYS 34 -18.397 7.152 4.157
168 HD3 LYS 34 1HD LYS 34 -20.138 6.888 4.075
169 HE2 LYS 34 2HE LYS 34 -20.067 5.069 5.442
170 HE3 LYS 34 1HE LYS 34 -18.454 4.597 4.908
171 HZ1 LYS 34 3HZ LYS 34 -17.862 6.842 6.151
172 HZ2 LYS 34 1HZ LYS 34 -17.941 5.358 6.961
173 HZ3 LYS 34 2HZ LYS 34 -19.247 6.433 7.031
174 H ILE 35 H ILE 35 -17.017 6.081 0.573
175 HA ILE 35 HA ILE 35 -16.184 8.630 1.525
176 HB ILE 35 HB ILE 35 -14.531 6.374 0.380
177 HG12 ILE 35 2HG1 ILE 35 -15.871 5.817 2.409
178 HG13 ILE 35 1HG1 ILE 35 -14.133 5.725 2.674
179 HG21 ILE 35 1HG2 ILE 35 -13.215 8.341 0.253
180 HG22 ILE 35 2HG2 ILE 35 -12.684 7.476 1.695
181 HG23 ILE 35 3HG2 ILE 35 -13.741 8.880 1.848
182 HD11 ILE 35 3HD1 ILE 35 -14.231 7.229 4.297
183 HD12 ILE 35 1HD1 ILE 35 -15.986 7.083 4.214
184 HD13 ILE 35 2HD1 ILE 35 -15.161 8.348 3.301
185 H ILE 36 H ILE 36 -16.259 7.101 -1.636
186 HA ILE 36 HA ILE 36 -14.734 9.126 -2.956
187 HB ILE 36 HB ILE 36 -16.644 7.116 -4.154
188 HG12 ILE 36 2HG1 ILE 36 -14.734 6.189 -2.767
189 HG13 ILE 36 1HG1 ILE 36 -14.788 5.651 -4.442
190 HG21 ILE 36 1HG2 ILE 36 -15.498 7.496 -6.237
191 HG22 ILE 36 2HG2 ILE 36 -14.383 8.620 -5.461
192 HG23 ILE 36 3HG2 ILE 36 -16.089 9.036 -5.614
193 HD11 ILE 36 3HD1 ILE 36 -12.618 6.720 -3.104
194 HD12 ILE 36 1HD1 ILE 36 -13.180 8.030 -4.143
195 HD13 ILE 36 2HD1 ILE 36 -12.768 6.465 -4.843
196 H SER 37 H SER 37 -18.109 8.648 -2.211
197 HA SER 37 HA SER 37 -18.837 10.988 -3.824
198 HB2 SER 37 2HB SER 37 -20.805 9.214 -2.400
199 HB3 SER 37 1HB SER 37 -21.053 10.216 -3.829
200 HG SER 37 HG SER 37 -20.421 8.614 -5.022
201 H LYS 38 H LYS 38 -17.819 10.388 -0.769
202 HA LYS 38 HA LYS 38 -19.682 11.763 0.836
203 HB2 LYS 38 2HB LYS 38 -17.013 10.652 1.137
204 HB3 LYS 38 1HB LYS 38 -17.202 12.152 2.035
205 HG2 LYS 38 2HG LYS 38 -19.514 10.750 2.606
206 HG3 LYS 38 1HG LYS 38 -18.257 9.511 2.584
207 HD2 LYS 38 2HD LYS 38 -17.948 10.155 4.723
208 HD3 LYS 38 1HD LYS 38 -17.009 11.455 3.987
209 HE2 LYS 38 2HE LYS 38 -19.928 11.607 4.730
210 HE3 LYS 38 1HE LYS 38 -18.598 12.289 5.667
211 HZ1 LYS 38 3HZ LYS 38 -19.528 13.107 2.976
212 HZ2 LYS 38 1HZ LYS 38 -18.042 13.603 3.618
213 HZ3 LYS 38 2HZ LYS 38 -19.484 14.035 4.389
214 H LYS 39 H LYS 39 -16.408 13.007 0.384
215 HA LYS 39 HA LYS 39 -16.967 15.316 -1.041
216 HB2 LYS 39 2HB LYS 39 -18.069 15.453 1.551
217 HB3 LYS 39 1HB LYS 39 -16.647 16.486 1.572
218 HG2 LYS 39 2HG LYS 39 -18.156 16.940 -0.827
219 HG3 LYS 39 1HG LYS 39 -19.196 17.093 0.591
220 HD2 LYS 39 2HD LYS 39 -18.259 19.034 1.174
221 HD3 LYS 39 1HD LYS 39 -16.630 18.380 0.998
222 HE2 LYS 39 2HE LYS 39 -18.283 19.158 -1.384
223 HE3 LYS 39 1HE LYS 39 -17.313 20.342 -0.508
224 HZ1 LYS 39 3HZ LYS 39 -15.442 18.606 -0.863
225 HZ2 LYS 39 1HZ LYS 39 -15.872 19.640 -2.133
226 HZ3 LYS 39 2HZ LYS 39 -16.429 18.043 -2.115
227 HA PRO 40 HA PRO 40 -12.804 16.045 1.311
228 HB2 PRO 40 2HB PRO 40 -12.130 14.223 3.227
229 HB3 PRO 40 1HB PRO 40 -12.995 15.725 3.571
230 HG2 PRO 40 2HG PRO 40 -14.073 12.955 3.227
231 HG3 PRO 40 1HG PRO 40 -14.504 14.182 4.433
232 HD2 PRO 40 2HD PRO 40 -16.031 13.712 2.266
233 HD3 PRO 40 1HD PRO 40 -15.855 15.338 2.957
234 H ARG 41 H ARG 41 -10.900 15.363 0.458
235 HA ARG 41 HA ARG 41 -10.339 12.591 -0.042
236 HB2 ARG 41 2HB ARG 41 -11.873 13.260 -1.929
237 HB3 ARG 41 1HB ARG 41 -10.635 14.399 -2.442
238 HG2 ARG 41 2HG ARG 41 -9.082 12.333 -2.473
239 HG3 ARG 41 1HG ARG 41 -10.586 11.412 -2.490
240 HD2 ARG 41 2HD ARG 41 -10.546 13.617 -4.405
241 HD3 ARG 41 1HD ARG 41 -9.290 12.416 -4.693
242 HE ARG 41 HE ARG 41 -10.910 10.890 -5.276
243 HH11 ARG 41 1HH1 ARG 41 -12.418 13.694 -3.844
244 HH12 ARG 41 2HH1 ARG 41 -14.019 13.221 -4.304
245 HH21 ARG 41 1HH2 ARG 41 -13.015 10.267 -5.878
246 HH22 ARG 41 2HH2 ARG 41 -14.358 11.276 -5.458
247 H THR 42 H THR 42 -8.642 13.437 1.400
248 HA THR 42 HA THR 42 -6.669 15.166 0.125
249 HB THR 42 HB THR 42 -6.152 14.011 2.809
250 HG1 THR 42 1HG THR 42 -7.681 15.230 3.801
251 HG21 THR 42 3HG2 THR 42 -5.864 16.590 3.187
252 HG22 THR 42 1HG2 THR 42 -5.728 16.603 1.428
253 HG23 THR 42 2HG2 THR 42 -4.614 15.634 2.393
254 H ALA 43 H ALA 43 -4.299 14.443 0.818
255 HA ALA 43 HA ALA 43 -3.692 12.181 -0.754
256 HB1 ALA 43 3HB ALA 43 -1.574 12.903 -0.615
257 HB2 ALA 43 1HB ALA 43 -1.619 13.005 1.146
258 HB3 ALA 43 2HB ALA 43 -2.277 14.318 0.169
259 H GLN 44 H GLN 44 -4.139 12.631 2.689
260 HA GLN 44 HA GLN 44 -2.955 10.277 3.622
261 HB2 GLN 44 2HB GLN 44 -5.187 11.999 4.667
262 HB3 GLN 44 1HB GLN 44 -4.698 10.537 5.511
263 HG2 GLN 44 2HG GLN 44 -3.201 11.780 6.568
264 HG3 GLN 44 1HG GLN 44 -2.317 11.860 5.047
265 HE21 GLN 44 1HE2 GLN 44 -5.194 13.398 6.454
266 HE22 GLN 44 2HE2 GLN 44 -4.744 15.013 6.037
267 H ASP 45 H ASP 45 -6.084 10.862 2.168
268 HA ASP 45 HA ASP 45 -7.235 8.357 2.864
269 HB2 ASP 45 2HB ASP 45 -7.910 10.524 0.907
270 HB3 ASP 45 1HB ASP 45 -8.746 8.977 0.814
271 H GLU 46 H GLU 46 -5.337 9.512 0.146
272 HA GLU 46 HA GLU 46 -5.733 7.248 -1.512
273 HB2 GLU 46 2HB GLU 46 -3.624 9.399 -1.466
274 HB3 GLU 46 1HB GLU 46 -3.625 8.108 -2.658
275 HG2 GLU 46 2HG GLU 46 -6.056 9.797 -2.266
276 HG3 GLU 46 1HG GLU 46 -4.702 10.386 -3.231
277 H LYS 47 H LYS 47 -3.313 8.067 0.915
278 HA LYS 47 HA LYS 47 -1.618 5.856 0.374
279 HB2 LYS 47 2HB LYS 47 -0.623 6.338 2.585
280 HB3 LYS 47 1HB LYS 47 -0.767 7.777 1.585
281 HG2 LYS 47 2HG LYS 47 -2.595 8.582 2.841
282 HG3 LYS 47 1HG LYS 47 -2.793 7.041 3.676
283 HD2 LYS 47 2HD LYS 47 -0.139 8.281 3.950
284 HD3 LYS 47 1HD LYS 47 -1.465 9.177 4.692
285 HE2 LYS 47 2HE LYS 47 -0.706 7.750 6.384
286 HE3 LYS 47 1HE LYS 47 -2.144 6.953 5.749
287 HZ1 LYS 47 3HZ LYS 47 -0.944 5.263 4.895
288 HZ2 LYS 47 1HZ LYS 47 0.154 5.700 6.106
289 HZ3 LYS 47 2HZ LYS 47 0.391 6.229 4.516
290 H PHE 48 H PHE 48 -4.369 6.356 2.501
291 HA PHE 48 HA PHE 48 -4.141 3.940 3.937
292 HB2 PHE 48 2HB PHE 48 -6.105 6.083 3.658
293 HB3 PHE 48 1HB PHE 48 -6.852 4.506 3.897
294 HD1 PHE 48 2HD PHE 48 -5.180 3.117 5.724
295 HD2 PHE 48 1HD PHE 48 -6.123 7.267 5.617
296 HE1 PHE 48 2HE PHE 48 -4.742 3.275 8.139
297 HE2 PHE 48 1HE PHE 48 -5.685 7.432 8.033
298 HZ PHE 48 HZ PHE 48 -4.994 5.435 9.298
299 H LEU 49 H LEU 49 -5.960 4.802 1.024
300 HA LEU 49 HA LEU 49 -7.078 2.189 0.716
301 HB2 LEU 49 2HB LEU 49 -7.694 2.974 -1.565
302 HB3 LEU 49 1HB LEU 49 -8.256 4.015 -0.272
303 HG LEU 49 HG LEU 49 -6.027 5.332 -0.816
304 HD11 LEU 49 1HD1 LEU 49 -5.050 4.977 -2.802
305 HD12 LEU 49 2HD1 LEU 49 -6.584 4.659 -3.612
306 HD13 LEU 49 3HD1 LEU 49 -5.790 3.381 -2.693
307 HD21 LEU 49 3HD2 LEU 49 -8.046 6.481 -0.952
308 HD22 LEU 49 1HD2 LEU 49 -8.678 5.417 -2.208
309 HD23 LEU 49 2HD2 LEU 49 -7.410 6.581 -2.593
310 H ARG 50 H ARG 50 -4.226 3.848 -0.455
311 HA ARG 50 HA ARG 50 -3.445 1.910 -2.367
312 HB2 ARG 50 2HB ARG 50 -2.142 4.211 -0.999
313 HB3 ARG 50 1HB ARG 50 -1.096 3.017 -1.755
314 HG2 ARG 50 2HG ARG 50 -2.618 3.361 -3.823
315 HG3 ARG 50 1HG ARG 50 -3.079 4.859 -3.014
316 HD2 ARG 50 2HD ARG 50 -0.233 4.572 -2.933
317 HD3 ARG 50 1HD ARG 50 -0.794 4.363 -4.592
318 HE ARG 50 HE ARG 50 -0.813 6.785 -3.047
319 HH11 ARG 50 1HH1 ARG 50 -2.272 5.090 -5.725
320 HH12 ARG 50 2HH1 ARG 50 -2.811 6.536 -6.509
321 HH21 ARG 50 1HH2 ARG 50 -1.523 8.688 -4.076
322 HH22 ARG 50 2HH2 ARG 50 -2.386 8.579 -5.574
323 H GLU 51 H GLU 51 -2.856 2.320 1.071
324 HA GLU 51 HA GLU 51 -0.903 0.244 1.266
325 HB2 GLU 51 2HB GLU 51 -1.221 2.177 2.881
326 HB3 GLU 51 1HB GLU 51 -2.616 1.311 3.508
327 HG2 GLU 51 2HG GLU 51 -1.359 -0.107 4.680
328 HG3 GLU 51 1HG GLU 51 -0.206 -0.322 3.364
329 H SER 52 H SER 52 -4.390 0.412 1.566
330 HA SER 52 HA SER 52 -4.510 -2.402 2.361
331 HB2 SER 52 2HB SER 52 -6.898 -0.605 2.003
332 HB3 SER 52 1HB SER 52 -6.731 -2.027 3.033
333 HG SER 52 HG SER 52 -5.488 -0.863 4.436
334 H ALA 53 H ALA 53 -3.594 -1.805 -0.258
335 HA ALA 53 HA ALA 53 -5.830 -2.840 -1.879
336 HB1 ALA 53 3HB ALA 53 -4.850 -1.758 -3.816
337 HB2 ALA 53 1HB ALA 53 -3.508 -1.170 -2.834
338 HB3 ALA 53 2HB ALA 53 -5.141 -0.574 -2.541
339 H CYS 54 H CYS 54 -5.555 -4.750 -2.855
340 HA CYS 54 HA CYS 54 -3.017 -6.126 -2.484
341 HB2 CYS 54 2HB CYS 54 -4.213 -8.146 -3.065
342 HB3 CYS 54 1HB CYS 54 -5.160 -7.242 -1.890
343 H GLY 55 H GLY 55 -2.603 -4.163 -4.259
344 HA2 GLY 55 2HA GLY 55 -1.965 -5.652 -6.662
345 HA3 GLY 55 1HA GLY 55 -3.106 -4.335 -6.898
346 H PHE 56 H PHE 56 -0.290 -4.797 -7.829
347 HA PHE 56 HA PHE 56 0.958 -2.393 -6.674
348 HB2 PHE 56 2HB PHE 56 2.103 -4.886 -7.894
349 HB3 PHE 56 1HB PHE 56 3.044 -3.397 -7.874
350 HD1 PHE 56 2HD PHE 56 0.828 -5.128 -5.416
351 HD2 PHE 56 1HD PHE 56 4.637 -3.416 -6.233
352 HE1 PHE 56 2HE PHE 56 1.537 -5.616 -3.111
353 HE2 PHE 56 1HE PHE 56 5.354 -3.902 -3.931
354 HZ PHE 56 HZ PHE 56 3.803 -5.002 -2.365
355 H ASP 57 H ASP 57 -1.112 -2.371 -8.715
356 HA ASP 57 HA ASP 57 0.399 -1.408 -11.048
357 HB2 ASP 57 2HB ASP 57 -1.669 -3.181 -10.998
358 HB3 ASP 57 1HB ASP 57 -2.528 -1.672 -11.285
359 H GLY 58 H GLY 58 -0.319 0.557 -12.088
360 HA2 GLY 58 2HA GLY 58 -1.355 2.483 -10.116
361 HA3 GLY 58 1HA GLY 58 -0.344 2.886 -11.495
362 H GLN 59 H GLN 59 -1.989 1.110 -13.250
363 HA GLN 59 HA GLN 59 -3.962 3.106 -13.942
364 HB2 GLN 59 2HB GLN 59 -2.984 0.577 -15.238
365 HB3 GLN 59 1HB GLN 59 -4.420 1.399 -15.832
366 HG2 GLN 59 2HG GLN 59 -3.240 3.060 -16.772
367 HG3 GLN 59 1HG GLN 59 -2.070 3.117 -15.455
368 HE21 GLN 59 1HE2 GLN 59 -0.586 1.174 -15.371
369 HE22 GLN 59 2HE2 GLN 59 0.049 0.624 -16.881
370 H THR 60 H THR 60 -3.909 -0.219 -12.766
371 HA THR 60 HA THR 60 -6.838 -0.170 -12.552
372 HB THR 60 HB THR 60 -5.209 -2.626 -12.040
373 HG1 THR 60 1HG THR 60 -4.490 -2.608 -13.994
374 HG21 THR 60 3HG2 THR 60 -7.075 -3.806 -12.571
375 HG22 THR 60 1HG2 THR 60 -7.688 -2.565 -13.664
376 HG23 THR 60 2HG2 THR 60 -7.818 -2.347 -11.918
377 HA PRO 61 HA PRO 61 -5.586 0.574 -8.198
378 HB2 PRO 61 2HB PRO 61 -7.844 1.912 -7.521
379 HB3 PRO 61 1HB PRO 61 -6.474 2.691 -8.321
380 HG2 PRO 61 2HG PRO 61 -9.033 1.680 -9.503
381 HG3 PRO 61 1HG PRO 61 -8.174 3.196 -9.828
382 HD2 PRO 61 2HD PRO 61 -8.009 1.050 -11.471
383 HD3 PRO 61 1HD PRO 61 -6.661 2.182 -11.243
384 H LYS 62 H LYS 62 -6.192 -0.509 -6.359
385 HA LYS 62 HA LYS 62 -8.688 -2.044 -6.404
386 HB2 LYS 62 2HB LYS 62 -6.355 -3.269 -7.030
387 HB3 LYS 62 1HB LYS 62 -6.348 -3.462 -5.283
388 HG2 LYS 62 2HG LYS 62 -7.768 -5.149 -5.435
389 HG3 LYS 62 1HG LYS 62 -8.940 -4.121 -6.261
390 HD2 LYS 62 2HD LYS 62 -7.224 -4.602 -8.283
391 HD3 LYS 62 1HD LYS 62 -7.038 -6.094 -7.357
392 HE2 LYS 62 2HE LYS 62 -9.135 -6.801 -7.820
393 HE3 LYS 62 1HE LYS 62 -9.806 -5.171 -7.774
394 HZ1 LYS 62 3HZ LYS 62 -8.341 -5.004 -9.970
395 HZ2 LYS 62 1HZ LYS 62 -9.951 -5.523 -9.983
396 HZ3 LYS 62 2HZ LYS 62 -8.696 -6.658 -10.016
397 H VAL 63 H VAL 63 -9.230 -2.943 -4.248
398 HA VAL 63 HA VAL 63 -7.938 -1.660 -1.978
399 HB VAL 63 HB VAL 63 -10.897 -1.275 -2.431
400 HG11 VAL 63 1HG1 VAL 63 -10.470 -1.259 -0.123
401 HG12 VAL 63 2HG1 VAL 63 -10.509 0.442 -0.586
402 HG13 VAL 63 3HG1 VAL 63 -8.963 -0.365 -0.320
403 HG21 VAL 63 3HG2 VAL 63 -8.600 0.617 -2.902
404 HG22 VAL 63 1HG2 VAL 63 -10.280 1.135 -2.761
405 HG23 VAL 63 2HG2 VAL 63 -9.796 0.059 -4.072
406 H CYS 64 H CYS 64 -8.353 -2.665 -0.002
407 HA CYS 64 HA CYS 64 -9.582 -5.316 -0.238
408 HB2 CYS 64 2HB CYS 64 -7.419 -4.163 1.451
409 HB3 CYS 64 1HB CYS 64 -8.391 -5.456 2.146
410 H CYS 65 H CYS 65 -11.477 -5.722 0.668
411 HA CYS 65 HA CYS 65 -12.398 -3.985 2.860
412 HB2 CYS 65 2HB CYS 65 -13.681 -4.650 0.295
413 HB3 CYS 65 1HB CYS 65 -14.728 -4.820 1.698
414 HA PRO 66 HA PRO 66 -12.524 -8.001 4.887
415 HB2 PRO 66 2HB PRO 66 -13.666 -7.049 7.209
416 HB3 PRO 66 1HB PRO 66 -11.934 -7.049 6.869
417 HG2 PRO 66 2HG PRO 66 -13.911 -4.825 6.643
418 HG3 PRO 66 1HG PRO 66 -12.227 -4.782 7.192
419 HD2 PRO 66 2HD PRO 66 -12.964 -3.947 4.736
420 HD3 PRO 66 1HD PRO 66 -11.394 -4.711 5.043
Start of MODEL 2
1 H GLN 11 H GLN 11 -10.866 -10.832 -5.164
2 HA GLN 11 HA GLN 11 -10.509 -13.563 -4.168
3 HB2 GLN 11 2HB GLN 11 -9.015 -12.467 -5.909
4 HB3 GLN 11 1HB GLN 11 -8.535 -11.331 -4.656
5 HG2 GLN 11 2HG GLN 11 -7.600 -13.097 -3.331
6 HG3 GLN 11 1HG GLN 11 -8.219 -14.315 -4.445
7 HE21 GLN 11 1HE2 GLN 11 -5.554 -12.589 -3.570
8 HE22 GLN 11 2HE2 GLN 11 -4.624 -12.745 -5.016
9 H ALA 12 H ALA 12 -9.415 -13.790 -2.132
10 HA ALA 12 HA ALA 12 -10.424 -11.954 -0.146
11 HB1 ALA 12 3HB ALA 12 -9.233 -14.659 -0.144
12 HB2 ALA 12 1HB ALA 12 -10.624 -14.028 0.739
13 HB3 ALA 12 2HB ALA 12 -8.990 -13.689 1.309
14 H CYS 13 H CYS 13 -9.345 -10.332 0.753
15 HA CYS 13 HA CYS 13 -6.411 -10.270 0.473
16 HB2 CYS 13 2HB CYS 13 -7.096 -8.555 -0.940
17 HB3 CYS 13 1HB CYS 13 -8.473 -8.129 0.069
18 H THR 14 H THR 14 -5.211 -9.441 2.195
19 HA THR 14 HA THR 14 -6.610 -9.523 4.768
20 HB THR 14 HB THR 14 -4.691 -11.039 4.459
21 HG1 THR 14 1HG THR 14 -4.061 -10.719 6.450
22 HG21 THR 14 3HG2 THR 14 -3.453 -9.105 3.075
23 HG22 THR 14 1HG2 THR 14 -2.611 -10.442 3.860
24 HG23 THR 14 2HG2 THR 14 -2.711 -8.873 4.658
25 H LEU 15 H LEU 15 -7.178 -7.653 5.634
26 HA LEU 15 HA LEU 15 -6.405 -5.132 4.748
27 HB2 LEU 15 2HB LEU 15 -7.195 -4.426 7.126
28 HB3 LEU 15 1HB LEU 15 -8.347 -5.085 5.982
29 HG LEU 15 HG LEU 15 -7.077 -7.084 7.731
30 HD11 LEU 15 1HD1 LEU 15 -8.446 -4.714 8.828
31 HD12 LEU 15 2HD1 LEU 15 -7.281 -5.805 9.577
32 HD13 LEU 15 3HD1 LEU 15 -8.975 -6.277 9.451
33 HD21 LEU 15 3HD2 LEU 15 -9.013 -8.192 7.397
34 HD22 LEU 15 1HD2 LEU 15 -9.179 -7.070 6.047
35 HD23 LEU 15 2HD2 LEU 15 -9.999 -6.741 7.573
36 HA PRO 16 HA PRO 16 -2.484 -4.012 6.385
37 HB2 PRO 16 2HB PRO 16 -3.162 -1.812 7.994
38 HB3 PRO 16 1HB PRO 16 -2.731 -1.762 6.283
39 HG2 PRO 16 2HG PRO 16 -5.423 -1.755 7.561
40 HG3 PRO 16 1HG PRO 16 -4.867 -0.919 6.100
41 HD2 PRO 16 2HD PRO 16 -6.396 -3.105 5.942
42 HD3 PRO 16 1HD PRO 16 -5.083 -2.820 4.780
43 H ASN 17 H ASN 17 -5.156 -4.315 8.633
44 HA ASN 17 HA ASN 17 -3.413 -4.625 10.925
45 HB2 ASN 17 2HB ASN 17 -5.994 -3.765 10.657
46 HB3 ASN 17 1HB ASN 17 -6.233 -5.418 11.214
47 HD21 ASN 17 1HD2 ASN 17 -3.796 -2.948 11.949
48 HD22 ASN 17 2HD2 ASN 17 -4.045 -2.968 13.659
49 H ASN 18 H ASN 18 -4.641 -6.618 8.470
50 HA ASN 18 HA ASN 18 -4.416 -8.844 8.062
51 HB2 ASN 18 2HB ASN 18 -2.301 -8.338 9.685
52 HB3 ASN 18 1HB ASN 18 -3.171 -9.518 10.659
53 HD21 ASN 18 1HD2 ASN 18 -3.574 -11.595 9.769
54 HD22 ASN 18 2HD2 ASN 18 -2.561 -12.229 8.523
55 H ASP 19 H ASP 19 -6.688 -9.023 8.241
56 HA ASP 19 HA ASP 19 -7.509 -10.774 10.405
57 HB2 ASP 19 2HB ASP 19 -8.015 -8.130 10.757
58 HB3 ASP 19 1HB ASP 19 -9.469 -8.622 9.894
59 H LYS 20 H LYS 20 -7.119 -10.794 7.427
60 HA LYS 20 HA LYS 20 -8.075 -11.771 5.612
61 HB2 LYS 20 2HB LYS 20 -10.137 -12.698 7.619
62 HB3 LYS 20 1HB LYS 20 -9.956 -13.322 5.986
63 HG2 LYS 20 2HG LYS 20 -8.788 -14.909 7.095
64 HG3 LYS 20 1HG LYS 20 -7.480 -13.755 6.833
65 HD2 LYS 20 2HD LYS 20 -8.873 -13.048 9.225
66 HD3 LYS 20 1HD LYS 20 -8.466 -14.763 9.287
67 HE2 LYS 20 2HE LYS 20 -6.290 -13.097 8.292
68 HE3 LYS 20 1HE LYS 20 -6.789 -12.680 9.930
69 HZ1 LYS 20 3HZ LYS 20 -6.379 -15.507 9.264
70 HZ2 LYS 20 1HZ LYS 20 -6.159 -14.704 10.737
71 HZ3 LYS 20 2HZ LYS 20 -5.018 -14.530 9.500
72 H GLY 21 H GLY 21 -9.437 -11.186 3.974
73 HA2 GLY 21 2HA GLY 21 -11.948 -9.905 4.398
74 HA3 GLY 21 1HA GLY 21 -10.696 -8.729 4.026
75 H THR 22 H THR 22 -12.119 -8.308 2.166
76 HA THR 22 HA THR 22 -11.569 -10.191 -0.035
77 HB THR 22 HB THR 22 -13.879 -8.332 -0.238
78 HG1 THR 22 1HG THR 22 -14.147 -9.183 1.841
79 HG21 THR 22 3HG2 THR 22 -14.044 -11.226 -0.835
80 HG22 THR 22 1HG2 THR 22 -13.053 -10.217 -1.891
81 HG23 THR 22 2HG2 THR 22 -14.764 -9.848 -1.669
82 H CYS 23 H CYS 23 -10.979 -9.312 -2.035
83 HA CYS 23 HA CYS 23 -10.299 -6.445 -1.965
84 HB2 CYS 23 2HB CYS 23 -8.560 -8.603 -2.210
85 HB3 CYS 23 1HB CYS 23 -8.730 -8.004 -3.856
86 H LYS 24 H LYS 24 -11.321 -5.245 -3.391
87 HA LYS 24 HA LYS 24 -11.915 -6.290 -6.045
88 HB2 LYS 24 2HB LYS 24 -14.250 -5.346 -5.901
89 HB3 LYS 24 1HB LYS 24 -13.967 -6.801 -4.955
90 HG2 LYS 24 2HG LYS 24 -13.625 -5.329 -2.960
91 HG3 LYS 24 1HG LYS 24 -14.158 -3.973 -3.955
92 HD2 LYS 24 2HD LYS 24 -16.228 -4.487 -3.283
93 HD3 LYS 24 1HD LYS 24 -16.115 -5.866 -4.379
94 HE2 LYS 24 2HE LYS 24 -15.143 -5.996 -1.539
95 HE3 LYS 24 1HE LYS 24 -16.819 -6.331 -1.970
96 HZ1 LYS 24 3HZ LYS 24 -14.442 -7.926 -2.408
97 HZ2 LYS 24 1HZ LYS 24 -15.513 -7.870 -3.718
98 HZ3 LYS 24 2HZ LYS 24 -16.050 -8.411 -2.208
99 H SER 25 H SER 25 -12.812 -4.471 -7.466
100 HA SER 25 HA SER 25 -10.996 -2.346 -7.488
101 HB2 SER 25 2HB SER 25 -12.979 -1.350 -9.021
102 HB3 SER 25 1HB SER 25 -11.865 -2.596 -9.583
103 HG SER 25 HG SER 25 -13.607 -3.727 -9.879
104 H LEU 26 H LEU 26 -11.881 0.030 -7.663
105 HA LEU 26 HA LEU 26 -13.132 0.588 -5.084
106 HB2 LEU 26 2HB LEU 26 -12.292 2.822 -5.319
107 HB3 LEU 26 1HB LEU 26 -11.001 1.693 -5.682
108 HG LEU 26 HG LEU 26 -12.078 2.187 -8.170
109 HD11 LEU 26 1HD1 LEU 26 -12.581 4.492 -6.405
110 HD12 LEU 26 2HD1 LEU 26 -13.377 4.010 -7.902
111 HD13 LEU 26 3HD1 LEU 26 -11.829 4.853 -7.959
112 HD21 LEU 26 3HD2 LEU 26 -9.740 2.044 -7.801
113 HD22 LEU 26 1HD2 LEU 26 -9.756 3.437 -6.720
114 HD23 LEU 26 2HD2 LEU 26 -10.054 3.656 -8.445
115 H LEU 27 H LEU 27 -14.763 -0.404 -7.248
116 HA LEU 27 HA LEU 27 -16.664 1.816 -7.384
117 HB2 LEU 27 2HB LEU 27 -17.184 0.943 -9.777
118 HB3 LEU 27 1HB LEU 27 -15.857 2.061 -9.527
119 HG LEU 27 HG LEU 27 -14.289 0.122 -9.522
120 HD11 LEU 27 1HD1 LEU 27 -15.270 -1.970 -10.626
121 HD12 LEU 27 2HD1 LEU 27 -16.835 -1.354 -10.093
122 HD13 LEU 27 3HD1 LEU 27 -15.581 -1.720 -8.908
123 HD21 LEU 27 3HD2 LEU 27 -15.276 1.509 -11.607
124 HD22 LEU 27 1HD2 LEU 27 -15.703 -0.132 -12.096
125 HD23 LEU 27 2HD2 LEU 27 -14.021 0.278 -11.756
126 H GLN 28 H GLN 28 -16.614 -0.468 -5.691
127 HA GLN 28 HA GLN 28 -19.210 -1.575 -6.360
128 HB2 GLN 28 2HB GLN 28 -16.749 -3.294 -6.041
129 HB3 GLN 28 1HB GLN 28 -18.385 -3.920 -5.889
130 HG2 GLN 28 2HG GLN 28 -18.586 -2.693 -8.268
131 HG3 GLN 28 1HG GLN 28 -16.875 -3.117 -8.285
132 HE21 GLN 28 1HE2 GLN 28 -18.166 -4.289 -10.177
133 HE22 GLN 28 2HE2 GLN 28 -18.547 -5.938 -9.828
134 H CYS 29 H CYS 29 -16.459 -1.620 -4.126
135 HA CYS 29 HA CYS 29 -17.750 -2.596 -1.867
136 HB2 CYS 29 2HB CYS 29 -15.336 -0.940 -2.373
137 HB3 CYS 29 1HB CYS 29 -15.969 -0.944 -0.733
138 H ASP 30 H ASP 30 -19.449 -1.838 -0.802
139 HA ASP 30 HA ASP 30 -20.668 0.623 -1.253
140 HB2 ASP 30 2HB ASP 30 -20.943 -1.540 0.748
141 HB3 ASP 30 1HB ASP 30 -21.594 0.029 1.216
142 H VAL 31 H VAL 31 -18.352 -0.344 1.217
143 HA VAL 31 HA VAL 31 -18.454 2.015 2.753
144 HB VAL 31 HB VAL 31 -16.181 1.338 3.563
145 HG11 VAL 31 1HG1 VAL 31 -17.825 -1.125 3.673
146 HG12 VAL 31 2HG1 VAL 31 -18.562 0.371 4.245
147 HG13 VAL 31 3HG1 VAL 31 -17.065 -0.208 4.975
148 HG21 VAL 31 3HG2 VAL 31 -16.568 -1.022 1.726
149 HG22 VAL 31 1HG2 VAL 31 -15.229 -0.759 2.841
150 HG23 VAL 31 2HG2 VAL 31 -15.434 0.298 1.445
151 H ALA 32 H ALA 32 -16.534 1.095 -0.051
152 HA ALA 32 HA ALA 32 -14.780 3.294 -0.041
153 HB1 ALA 32 3HB ALA 32 -15.717 1.880 -2.522
154 HB2 ALA 32 1HB ALA 32 -14.579 1.153 -1.388
155 HB3 ALA 32 2HB ALA 32 -14.159 2.649 -2.221
156 H SER 33 H SER 33 -17.996 2.839 -1.379
157 HA SER 33 HA SER 33 -18.095 5.203 -2.912
158 HB2 SER 33 2HB SER 33 -20.306 3.559 -1.668
159 HB3 SER 33 1HB SER 33 -20.580 4.884 -2.797
160 HG SER 33 HG SER 33 -20.525 2.866 -3.862
161 H LYS 34 H LYS 34 -19.086 4.500 0.411
162 HA LYS 34 HA LYS 34 -20.211 7.019 0.952
163 HB2 LYS 34 2HB LYS 34 -20.168 6.408 3.262
164 HB3 LYS 34 1HB LYS 34 -20.526 4.958 2.339
165 HG2 LYS 34 2HG LYS 34 -18.613 3.934 2.942
166 HG3 LYS 34 1HG LYS 34 -17.681 5.429 2.961
167 HD2 LYS 34 2HD LYS 34 -17.752 5.004 5.202
168 HD3 LYS 34 1HD LYS 34 -19.236 5.947 5.039
169 HE2 LYS 34 2HE LYS 34 -19.958 3.303 4.474
170 HE3 LYS 34 1HE LYS 34 -18.881 3.209 5.866
171 HZ1 LYS 34 3HZ LYS 34 -20.317 5.048 6.833
172 HZ2 LYS 34 1HZ LYS 34 -20.998 3.501 6.760
173 HZ3 LYS 34 2HZ LYS 34 -21.437 4.673 5.623
174 H ILE 35 H ILE 35 -16.907 5.876 1.004
175 HA ILE 35 HA ILE 35 -15.830 8.084 2.445
176 HB ILE 35 HB ILE 35 -14.405 6.241 0.522
177 HG12 ILE 35 2HG1 ILE 35 -14.299 5.941 3.497
178 HG13 ILE 35 1HG1 ILE 35 -15.703 5.322 2.634
179 HG21 ILE 35 1HG2 ILE 35 -13.490 8.565 1.692
180 HG22 ILE 35 2HG2 ILE 35 -12.492 7.259 1.055
181 HG23 ILE 35 3HG2 ILE 35 -12.896 7.302 2.771
182 HD11 ILE 35 3HD1 ILE 35 -13.296 4.024 3.055
183 HD12 ILE 35 1HD1 ILE 35 -13.245 4.510 1.360
184 HD13 ILE 35 2HD1 ILE 35 -14.586 3.533 1.958
185 H ILE 36 H ILE 36 -16.383 7.401 -0.959
186 HA ILE 36 HA ILE 36 -14.912 9.592 -1.990
187 HB ILE 36 HB ILE 36 -17.240 8.103 -3.213
188 HG12 ILE 36 2HG1 ILE 36 -15.209 6.747 -2.647
189 HG13 ILE 36 1HG1 ILE 36 -15.588 6.785 -4.364
190 HG21 ILE 36 1HG2 ILE 36 -15.791 9.030 -5.307
191 HG22 ILE 36 2HG2 ILE 36 -15.616 10.359 -4.162
192 HG23 ILE 36 3HG2 ILE 36 -17.222 9.827 -4.657
193 HD11 ILE 36 3HD1 ILE 36 -13.772 8.906 -3.628
194 HD12 ILE 36 1HD1 ILE 36 -13.608 7.651 -4.857
195 HD13 ILE 36 2HD1 ILE 36 -13.146 7.318 -3.187
196 H SER 37 H SER 37 -18.211 9.217 -0.860
197 HA SER 37 HA SER 37 -19.013 11.842 -1.762
198 HB2 SER 37 2HB SER 37 -20.328 9.549 -0.397
199 HB3 SER 37 1HB SER 37 -21.017 11.150 -0.124
200 HG SER 37 HG SER 37 -21.010 11.345 -2.482
201 H LYS 38 H LYS 38 -17.658 10.434 1.095
202 HA LYS 38 HA LYS 38 -18.346 12.728 2.747
203 HB2 LYS 38 2HB LYS 38 -17.315 10.007 3.213
204 HB3 LYS 38 1HB LYS 38 -16.673 11.241 4.288
205 HG2 LYS 38 2HG LYS 38 -19.254 11.860 4.467
206 HG3 LYS 38 1HG LYS 38 -19.410 10.147 4.073
207 HD2 LYS 38 2HD LYS 38 -17.788 11.297 6.342
208 HD3 LYS 38 1HD LYS 38 -19.357 10.505 6.492
209 HE2 LYS 38 2HE LYS 38 -17.020 9.114 5.228
210 HE3 LYS 38 1HE LYS 38 -17.238 9.128 6.977
211 HZ1 LYS 38 3HZ LYS 38 -18.977 7.919 4.918
212 HZ2 LYS 38 1HZ LYS 38 -19.564 8.268 6.467
213 HZ3 LYS 38 2HZ LYS 38 -18.279 7.187 6.274
214 H LYS 39 H LYS 39 -15.417 11.095 1.606
215 HA LYS 39 HA LYS 39 -14.001 13.664 1.780
216 HB2 LYS 39 2HB LYS 39 -13.302 11.080 3.048
217 HB3 LYS 39 1HB LYS 39 -11.979 11.951 2.288
218 HG2 LYS 39 2HG LYS 39 -11.928 12.698 4.478
219 HG3 LYS 39 1HG LYS 39 -12.811 13.974 3.637
220 HD2 LYS 39 2HD LYS 39 -14.823 12.273 4.365
221 HD3 LYS 39 1HD LYS 39 -13.705 12.121 5.722
222 HE2 LYS 39 2HE LYS 39 -15.011 14.617 4.665
223 HE3 LYS 39 1HE LYS 39 -15.209 13.881 6.255
224 HZ1 LYS 39 3HZ LYS 39 -13.761 15.631 6.632
225 HZ2 LYS 39 1HZ LYS 39 -12.906 15.389 5.192
226 HZ3 LYS 39 2HZ LYS 39 -12.708 14.315 6.483
227 HA PRO 40 HA PRO 40 -13.785 11.873 -2.517
228 HB2 PRO 40 2HB PRO 40 -13.417 14.787 -2.997
229 HB3 PRO 40 1HB PRO 40 -14.428 13.623 -3.860
230 HG2 PRO 40 2HG PRO 40 -15.524 15.383 -2.193
231 HG3 PRO 40 1HG PRO 40 -16.121 13.713 -2.269
232 HD2 PRO 40 2HD PRO 40 -14.367 15.010 -0.224
233 HD3 PRO 40 1HD PRO 40 -15.671 13.824 -0.005
234 H ARG 41 H ARG 41 -11.749 10.951 -1.857
235 HA ARG 41 HA ARG 41 -9.499 10.678 -2.018
236 HB2 ARG 41 2HB ARG 41 -10.240 12.101 -4.266
237 HB3 ARG 41 1HB ARG 41 -8.924 13.063 -3.608
238 HG2 ARG 41 2HG ARG 41 -7.600 10.895 -3.506
239 HG3 ARG 41 1HG ARG 41 -8.872 10.204 -4.515
240 HD2 ARG 41 2HD ARG 41 -8.467 12.103 -6.122
241 HD3 ARG 41 1HD ARG 41 -7.041 12.505 -5.164
242 HE ARG 41 HE ARG 41 -6.722 9.868 -5.752
243 HH11 ARG 41 1HH1 ARG 41 -7.269 12.738 -7.661
244 HH12 ARG 41 2HH1 ARG 41 -6.412 12.135 -9.039
245 HH21 ARG 41 1HH2 ARG 41 -5.594 9.074 -7.566
246 HH22 ARG 41 2HH2 ARG 41 -5.461 10.056 -8.986
247 H THR 42 H THR 42 -8.387 11.028 -0.221
248 HA THR 42 HA THR 42 -7.594 13.769 0.434
249 HB THR 42 HB THR 42 -7.914 12.743 2.933
250 HG1 THR 42 1HG THR 42 -10.145 11.829 1.445
251 HG21 THR 42 3HG2 THR 42 -8.926 14.864 1.626
252 HG22 THR 42 1HG2 THR 42 -9.404 14.383 3.253
253 HG23 THR 42 2HG2 THR 42 -10.389 13.910 1.869
254 H ALA 43 H ALA 43 -5.803 13.792 2.080
255 HA ALA 43 HA ALA 43 -3.668 12.211 1.208
256 HB1 ALA 43 3HB ALA 43 -2.728 13.043 3.566
257 HB2 ALA 43 1HB ALA 43 -4.107 14.133 3.414
258 HB3 ALA 43 2HB ALA 43 -2.863 14.104 2.163
259 H GLN 44 H GLN 44 -5.809 11.865 3.987
260 HA GLN 44 HA GLN 44 -4.397 9.633 5.088
261 HB2 GLN 44 2HB GLN 44 -6.916 11.084 5.672
262 HB3 GLN 44 1HB GLN 44 -6.845 9.408 6.200
263 HG2 GLN 44 2HG GLN 44 -4.458 10.318 7.083
264 HG3 GLN 44 1HG GLN 44 -5.445 11.773 7.220
265 HE21 GLN 44 1HE2 GLN 44 -4.297 9.454 9.023
266 HE22 GLN 44 2HE2 GLN 44 -5.601 9.184 10.125
267 H ASP 45 H ASP 45 -7.007 10.068 2.813
268 HA ASP 45 HA ASP 45 -7.869 7.358 2.798
269 HB2 ASP 45 2HB ASP 45 -9.057 9.530 1.913
270 HB3 ASP 45 1HB ASP 45 -8.204 9.148 0.421
271 H GLU 46 H GLU 46 -5.489 9.203 1.002
272 HA GLU 46 HA GLU 46 -4.971 7.240 -0.971
273 HB2 GLU 46 2HB GLU 46 -4.229 9.841 -0.609
274 HB3 GLU 46 1HB GLU 46 -2.730 8.999 -0.238
275 HG2 GLU 46 2HG GLU 46 -2.455 9.272 -2.469
276 HG3 GLU 46 1HG GLU 46 -3.308 7.730 -2.481
277 H LYS 47 H LYS 47 -3.438 7.982 2.128
278 HA LYS 47 HA LYS 47 -1.413 6.008 1.867
279 HB2 LYS 47 2HB LYS 47 -1.173 6.296 4.365
280 HB3 LYS 47 1HB LYS 47 -0.984 7.757 3.410
281 HG2 LYS 47 2HG LYS 47 -2.420 8.688 4.825
282 HG3 LYS 47 1HG LYS 47 -3.664 7.750 4.004
283 HD2 LYS 47 2HD LYS 47 -4.033 7.147 6.193
284 HD3 LYS 47 1HD LYS 47 -2.930 5.873 5.673
285 HE2 LYS 47 2HE LYS 47 -1.825 8.378 6.861
286 HE3 LYS 47 1HE LYS 47 -2.521 7.153 7.920
287 HZ1 LYS 47 3HZ LYS 47 -0.998 5.531 6.830
288 HZ2 LYS 47 1HZ LYS 47 -0.213 6.722 7.739
289 HZ3 LYS 47 2HZ LYS 47 -0.242 6.828 6.052
290 H PHE 48 H PHE 48 -4.651 6.019 3.231
291 HA PHE 48 HA PHE 48 -4.470 3.444 4.419
292 HB2 PHE 48 2HB PHE 48 -6.397 5.529 4.275
293 HB3 PHE 48 1HB PHE 48 -7.179 4.047 3.735
294 HD1 PHE 48 1HD PHE 48 -7.094 2.026 5.242
295 HD2 PHE 48 2HD PHE 48 -5.992 5.926 6.542
296 HE1 PHE 48 1HE PHE 48 -7.375 1.320 7.583
297 HE2 PHE 48 2HE PHE 48 -6.270 5.227 8.886
298 HZ PHE 48 HZ PHE 48 -6.962 2.922 9.408
299 H LEU 49 H LEU 49 -5.657 4.606 1.292
300 HA LEU 49 HA LEU 49 -6.573 2.032 0.459
301 HB2 LEU 49 2HB LEU 49 -6.812 3.020 -1.752
302 HB3 LEU 49 1HB LEU 49 -7.498 4.061 -0.520
303 HG LEU 49 HG LEU 49 -5.252 5.324 -0.623
304 HD11 LEU 49 1HD1 LEU 49 -4.833 3.305 -2.628
305 HD12 LEU 49 2HD1 LEU 49 -3.703 4.492 -1.978
306 HD13 LEU 49 3HD1 LEU 49 -4.740 4.915 -3.339
307 HD21 LEU 49 3HD2 LEU 49 -6.098 6.391 -2.884
308 HD22 LEU 49 1HD2 LEU 49 -7.010 6.567 -1.385
309 HD23 LEU 49 2HD2 LEU 49 -7.494 5.359 -2.575
310 H ARG 50 H ARG 50 -3.575 3.819 0.180
311 HA ARG 50 HA ARG 50 -2.331 2.122 -1.716
312 HB2 ARG 50 2HB ARG 50 -1.482 4.286 0.113
313 HB3 ARG 50 1HB ARG 50 -0.228 3.148 -0.359
314 HG2 ARG 50 2HG ARG 50 -1.221 3.627 -2.768
315 HG3 ARG 50 1HG ARG 50 -1.701 5.135 -1.988
316 HD2 ARG 50 2HD ARG 50 0.374 5.919 -2.112
317 HD3 ARG 50 1HD ARG 50 1.008 4.493 -1.293
318 HE ARG 50 HE ARG 50 0.612 3.627 -3.824
319 HH11 ARG 50 1HH1 ARG 50 2.297 6.370 -2.474
320 HH12 ARG 50 2HH1 ARG 50 3.464 6.439 -3.751
321 HH21 ARG 50 1HH2 ARG 50 2.148 3.716 -5.505
322 HH22 ARG 50 2HH2 ARG 50 3.380 4.932 -5.471
323 H GLU 51 H GLU 51 -2.495 2.140 1.800
324 HA GLU 51 HA GLU 51 -0.632 0.004 2.159
325 HB2 GLU 51 2HB GLU 51 -1.649 1.865 3.821
326 HB3 GLU 51 1HB GLU 51 -2.678 0.503 4.242
327 HG2 GLU 51 2HG GLU 51 -0.749 0.642 5.709
328 HG3 GLU 51 1HG GLU 51 -0.720 -0.842 4.757
329 H SER 52 H SER 52 -4.099 0.237 1.743
330 HA SER 52 HA SER 52 -4.303 -2.690 1.980
331 HB2 SER 52 2HB SER 52 -6.715 -0.917 1.983
332 HB3 SER 52 1HB SER 52 -6.472 -2.478 2.767
333 HG SER 52 HG SER 52 -6.412 -0.937 4.354
334 H ALA 53 H ALA 53 -3.256 -1.732 -0.361
335 HA ALA 53 HA ALA 53 -5.491 -2.013 -2.264
336 HB1 ALA 53 3HB ALA 53 -3.111 -0.260 -2.267
337 HB2 ALA 53 1HB ALA 53 -4.731 0.021 -2.906
338 HB3 ALA 53 2HB ALA 53 -3.581 -0.960 -3.817
339 H CYS 54 H CYS 54 -5.531 -3.874 -3.323
340 HA CYS 54 HA CYS 54 -3.451 -5.788 -3.149
341 HB2 CYS 54 2HB CYS 54 -6.044 -5.606 -4.630
342 HB3 CYS 54 1HB CYS 54 -4.897 -6.866 -5.071
343 H GLY 55 H GLY 55 -1.682 -4.411 -3.943
344 HA2 GLY 55 2HA GLY 55 -0.079 -4.100 -5.571
345 HA3 GLY 55 1HA GLY 55 -1.093 -5.014 -6.677
346 H PHE 56 H PHE 56 0.459 -2.461 -6.963
347 HA PHE 56 HA PHE 56 -1.457 -0.361 -7.252
348 HB2 PHE 56 2HB PHE 56 1.223 -0.371 -7.042
349 HB3 PHE 56 1HB PHE 56 1.079 -0.257 -8.794
350 HD1 PHE 56 1HD PHE 56 -0.134 1.333 -5.658
351 HD2 PHE 56 2HD PHE 56 0.756 1.803 -9.794
352 HE1 PHE 56 1HE PHE 56 -0.528 3.754 -5.464
353 HE2 PHE 56 2HE PHE 56 0.367 4.225 -9.607
354 HZ PHE 56 HZ PHE 56 -0.277 5.204 -7.441
355 H ASP 57 H ASP 57 -0.111 -2.812 -9.363
356 HA ASP 57 HA ASP 57 -0.751 -3.565 -11.413
357 HB2 ASP 57 2HB ASP 57 -3.099 -2.800 -10.299
358 HB3 ASP 57 1HB ASP 57 -3.058 -1.733 -11.701
359 H GLY 58 H GLY 58 -1.837 -0.166 -11.495
360 HA2 GLY 58 2HA GLY 58 -0.172 1.424 -12.521
361 HA3 GLY 58 1HA GLY 58 -0.028 0.226 -13.798
362 H GLN 59 H GLN 59 -2.939 -0.358 -13.664
363 HA GLN 59 HA GLN 59 -4.026 2.145 -14.749
364 HB2 GLN 59 2HB GLN 59 -3.671 -0.449 -16.140
365 HB3 GLN 59 1HB GLN 59 -5.198 0.380 -16.408
366 HG2 GLN 59 2HG GLN 59 -2.731 1.990 -16.666
367 HG3 GLN 59 1HG GLN 59 -3.046 0.786 -17.915
368 HE21 GLN 59 1HE2 GLN 59 -3.164 2.728 -19.270
369 HE22 GLN 59 2HE2 GLN 59 -4.675 3.558 -19.393
370 H THR 60 H THR 60 -4.724 -1.150 -13.642
371 HA THR 60 HA THR 60 -7.467 -0.359 -13.004
372 HB THR 60 HB THR 60 -6.202 -3.096 -12.814
373 HG1 THR 60 1HG THR 60 -7.783 -2.014 -14.903
374 HG21 THR 60 3HG2 THR 60 -8.351 -3.998 -12.694
375 HG22 THR 60 1HG2 THR 60 -9.113 -2.472 -13.142
376 HG23 THR 60 2HG2 THR 60 -8.361 -2.651 -11.557
377 HA PRO 61 HA PRO 61 -5.722 0.207 -8.832
378 HB2 PRO 61 2HB PRO 61 -7.787 1.692 -7.893
379 HB3 PRO 61 1HB PRO 61 -6.488 2.376 -8.876
380 HG2 PRO 61 2HG PRO 61 -9.235 1.517 -9.700
381 HG3 PRO 61 1HG PRO 61 -8.334 2.974 -10.159
382 HD2 PRO 61 2HD PRO 61 -8.515 0.808 -11.774
383 HD3 PRO 61 1HD PRO 61 -7.082 1.855 -11.740
384 H LYS 62 H LYS 62 -6.207 -0.737 -6.860
385 HA LYS 62 HA LYS 62 -8.740 -2.204 -6.644
386 HB2 LYS 62 2HB LYS 62 -5.994 -3.327 -6.675
387 HB3 LYS 62 1HB LYS 62 -7.103 -3.990 -5.483
388 HG2 LYS 62 2HG LYS 62 -7.609 -5.398 -7.162
389 HG3 LYS 62 1HG LYS 62 -8.676 -4.082 -7.651
390 HD2 LYS 62 2HD LYS 62 -7.459 -3.617 -9.483
391 HD3 LYS 62 1HD LYS 62 -5.927 -3.829 -8.634
392 HE2 LYS 62 2HE LYS 62 -7.111 -6.379 -8.824
393 HE3 LYS 62 1HE LYS 62 -7.275 -5.625 -10.408
394 HZ1 LYS 62 3HZ LYS 62 -4.901 -5.193 -10.411
395 HZ2 LYS 62 1HZ LYS 62 -5.201 -6.846 -10.214
396 HZ3 LYS 62 2HZ LYS 62 -4.740 -5.905 -8.887
397 H VAL 63 H VAL 63 -9.296 -2.821 -4.463
398 HA VAL 63 HA VAL 63 -7.808 -1.459 -2.340
399 HB VAL 63 HB VAL 63 -10.799 -1.164 -2.619
400 HG11 VAL 63 1HG1 VAL 63 -10.472 0.575 -0.880
401 HG12 VAL 63 2HG1 VAL 63 -8.780 0.088 -0.764
402 HG13 VAL 63 3HG1 VAL 63 -10.056 -1.051 -0.334
403 HG21 VAL 63 3HG2 VAL 63 -9.905 0.099 -4.403
404 HG22 VAL 63 1HG2 VAL 63 -8.574 0.698 -3.413
405 HG23 VAL 63 2HG2 VAL 63 -10.220 1.253 -3.106
406 H CYS 64 H CYS 64 -8.315 -2.219 -0.201
407 HA CYS 64 HA CYS 64 -9.276 -4.990 -0.229
408 HB2 CYS 64 2HB CYS 64 -6.957 -4.258 0.689
409 HB3 CYS 64 1HB CYS 64 -7.866 -3.699 2.088
410 H CYS 65 H CYS 65 -11.193 -5.475 0.598
411 HA CYS 65 HA CYS 65 -12.428 -3.580 2.486
412 HB2 CYS 65 2HB CYS 65 -13.531 -5.048 0.141
413 HB3 CYS 65 1HB CYS 65 -14.589 -4.812 1.528
414 HA PRO 66 HA PRO 66 -12.180 -7.176 5.175
415 HB2 PRO 66 2HB PRO 66 -13.239 -5.999 7.374
416 HB3 PRO 66 1HB PRO 66 -11.574 -5.721 6.851
417 HG2 PRO 66 2HG PRO 66 -14.002 -4.022 6.423
418 HG3 PRO 66 1HG PRO 66 -12.363 -3.532 6.891
419 HD2 PRO 66 2HD PRO 66 -13.284 -3.313 4.352
420 HD3 PRO 66 1HD PRO 66 -11.578 -3.636 4.726
Start of MODEL 3
1 H GLN 11 H GLN 11 -11.689 -10.524 -5.046
2 HA GLN 11 HA GLN 11 -9.924 -12.878 -5.037
3 HB2 GLN 11 2HB GLN 11 -9.644 -10.043 -5.714
4 HB3 GLN 11 1HB GLN 11 -8.470 -10.584 -4.523
5 HG2 GLN 11 2HG GLN 11 -8.753 -12.428 -6.752
6 HG3 GLN 11 1HG GLN 11 -8.239 -10.816 -7.245
7 HE21 GLN 11 1HE2 GLN 11 -6.669 -13.148 -7.445
8 HE22 GLN 11 2HE2 GLN 11 -5.298 -12.961 -6.411
9 H ALA 12 H ALA 12 -8.641 -13.094 -3.122
10 HA ALA 12 HA ALA 12 -9.952 -11.976 -0.730
11 HB1 ALA 12 3HB ALA 12 -8.921 -14.679 -1.360
12 HB2 ALA 12 1HB ALA 12 -10.322 -14.191 -0.407
13 HB3 ALA 12 2HB ALA 12 -8.705 -14.097 0.290
14 H CYS 13 H CYS 13 -8.782 -10.537 0.346
15 HA CYS 13 HA CYS 13 -5.844 -10.800 0.294
16 HB2 CYS 13 2HB CYS 13 -5.642 -8.382 0.322
17 HB3 CYS 13 1HB CYS 13 -6.618 -8.876 -1.057
18 H THR 14 H THR 14 -4.783 -9.627 2.145
19 HA THR 14 HA THR 14 -6.295 -10.190 4.599
20 HB THR 14 HB THR 14 -4.263 -11.471 4.433
21 HG1 THR 14 1HG THR 14 -3.776 -9.311 6.201
22 HG21 THR 14 3HG2 THR 14 -3.175 -9.144 3.231
23 HG22 THR 14 1HG2 THR 14 -2.454 -10.743 3.406
24 HG23 THR 14 2HG2 THR 14 -2.227 -9.531 4.666
25 H LEU 15 H LEU 15 -7.133 -8.492 5.592
26 HA LEU 15 HA LEU 15 -6.596 -5.822 4.988
27 HB2 LEU 15 2HB LEU 15 -7.675 -5.426 7.308
28 HB3 LEU 15 1HB LEU 15 -8.634 -6.151 6.031
29 HG LEU 15 HG LEU 15 -7.242 -8.092 7.744
30 HD11 LEU 15 1HD1 LEU 15 -8.988 -6.006 8.891
31 HD12 LEU 15 2HD1 LEU 15 -7.716 -6.966 9.645
32 HD13 LEU 15 3HD1 LEU 15 -9.312 -7.668 9.384
33 HD21 LEU 15 3HD2 LEU 15 -9.883 -8.707 7.754
34 HD22 LEU 15 1HD2 LEU 15 -8.744 -9.218 6.509
35 HD23 LEU 15 2HD2 LEU 15 -9.751 -7.793 6.251
36 HA PRO 16 HA PRO 16 -2.981 -4.473 7.096
37 HB2 PRO 16 2HB PRO 16 -4.030 -2.511 8.804
38 HB3 PRO 16 1HB PRO 16 -3.466 -2.259 7.151
39 HG2 PRO 16 2HG PRO 16 -6.240 -2.650 8.170
40 HG3 PRO 16 1HG PRO 16 -5.660 -1.623 6.845
41 HD2 PRO 16 2HD PRO 16 -6.919 -3.932 6.360
42 HD3 PRO 16 1HD PRO 16 -5.554 -3.401 5.352
43 H ASN 17 H ASN 17 -5.784 -5.331 8.993
44 HA ASN 17 HA ASN 17 -4.242 -5.652 11.431
45 HB2 ASN 17 2HB ASN 17 -7.041 -5.421 10.744
46 HB3 ASN 17 1HB ASN 17 -6.774 -6.813 11.787
47 HD21 ASN 17 1HD2 ASN 17 -6.236 -3.352 11.479
48 HD22 ASN 17 2HD2 ASN 17 -6.172 -3.025 13.174
49 H ASN 18 H ASN 18 -4.901 -7.498 8.689
50 HA ASN 18 HA ASN 18 -4.471 -9.653 8.123
51 HB2 ASN 18 2HB ASN 18 -2.866 -9.264 10.580
52 HB3 ASN 18 1HB ASN 18 -3.189 -10.937 10.132
53 HD21 ASN 18 1HD2 ASN 18 -1.049 -11.338 9.637
54 HD22 ASN 18 2HD2 ASN 18 -0.289 -10.698 8.223
55 H ASP 19 H ASP 19 -6.722 -10.096 8.170
56 HA ASP 19 HA ASP 19 -7.411 -12.166 10.067
57 HB2 ASP 19 2HB ASP 19 -8.974 -9.586 9.902
58 HB3 ASP 19 1HB ASP 19 -9.616 -11.065 10.611
59 H LYS 20 H LYS 20 -6.990 -11.769 7.137
60 HA LYS 20 HA LYS 20 -7.838 -12.578 5.190
61 HB2 LYS 20 2HB LYS 20 -9.986 -13.855 6.888
62 HB3 LYS 20 1HB LYS 20 -9.473 -14.344 5.277
63 HG2 LYS 20 2HG LYS 20 -7.980 -15.716 6.152
64 HG3 LYS 20 1HG LYS 20 -7.194 -14.363 6.969
65 HD2 LYS 20 2HD LYS 20 -9.212 -14.675 8.651
66 HD3 LYS 20 1HD LYS 20 -9.188 -16.316 8.003
67 HE2 LYS 20 2HE LYS 20 -6.657 -15.026 8.937
68 HE3 LYS 20 1HE LYS 20 -7.770 -15.739 10.104
69 HZ1 LYS 20 3HZ LYS 20 -5.843 -17.110 8.910
70 HZ2 LYS 20 1HZ LYS 20 -7.094 -17.385 7.804
71 HZ3 LYS 20 2HZ LYS 20 -7.288 -17.819 9.426
72 H GLY 21 H GLY 21 -9.134 -11.788 3.604
73 HA2 GLY 21 2HA GLY 21 -11.744 -10.715 4.157
74 HA3 GLY 21 1HA GLY 21 -10.539 -9.470 3.869
75 H THR 22 H THR 22 -11.726 -8.819 2.018
76 HA THR 22 HA THR 22 -11.214 -10.531 -0.316
77 HB THR 22 HB THR 22 -13.683 -8.818 -0.064
78 HG1 THR 22 1HG THR 22 -13.326 -11.537 0.638
79 HG21 THR 22 3HG2 THR 22 -12.772 -9.777 -2.308
80 HG22 THR 22 1HG2 THR 22 -14.492 -9.861 -1.930
81 HG23 THR 22 2HG2 THR 22 -13.472 -11.283 -1.715
82 H CYS 23 H CYS 23 -10.688 -9.452 -2.233
83 HA CYS 23 HA CYS 23 -10.137 -6.575 -1.903
84 HB2 CYS 23 2HB CYS 23 -8.167 -8.252 -2.048
85 HB3 CYS 23 1HB CYS 23 -8.571 -8.342 -3.758
86 H LYS 24 H LYS 24 -11.189 -5.282 -3.221
87 HA LYS 24 HA LYS 24 -11.792 -6.126 -5.947
88 HB2 LYS 24 2HB LYS 24 -14.140 -5.306 -5.727
89 HB3 LYS 24 1HB LYS 24 -13.807 -6.760 -4.795
90 HG2 LYS 24 2HG LYS 24 -13.615 -5.442 -2.764
91 HG3 LYS 24 1HG LYS 24 -13.883 -3.962 -3.685
92 HD2 LYS 24 2HD LYS 24 -16.036 -4.267 -3.102
93 HD3 LYS 24 1HD LYS 24 -16.041 -5.432 -4.425
94 HE2 LYS 24 2HE LYS 24 -15.073 -6.933 -2.364
95 HE3 LYS 24 1HE LYS 24 -16.198 -5.861 -1.530
96 HZ1 LYS 24 3HZ LYS 24 -17.763 -6.550 -3.476
97 HZ2 LYS 24 1HZ LYS 24 -17.570 -7.566 -2.137
98 HZ3 LYS 24 2HZ LYS 24 -16.742 -7.894 -3.573
99 H SER 25 H SER 25 -12.703 -4.241 -7.229
100 HA SER 25 HA SER 25 -10.949 -2.077 -7.117
101 HB2 SER 25 2HB SER 25 -13.493 -2.645 -8.569
102 HB3 SER 25 1HB SER 25 -12.896 -0.986 -8.564
103 HG SER 25 HG SER 25 -11.030 -1.661 -9.544
104 H LEU 26 H LEU 26 -12.013 0.286 -7.187
105 HA LEU 26 HA LEU 26 -13.097 0.668 -4.503
106 HB2 LEU 26 2HB LEU 26 -12.475 3.006 -4.780
107 HB3 LEU 26 1HB LEU 26 -11.116 1.947 -5.109
108 HG LEU 26 HG LEU 26 -12.001 2.241 -7.614
109 HD11 LEU 26 1HD1 LEU 26 -13.016 4.617 -6.101
110 HD12 LEU 26 2HD1 LEU 26 -13.831 3.644 -7.327
111 HD13 LEU 26 3HD1 LEU 26 -12.539 4.749 -7.793
112 HD21 LEU 26 3HD2 LEU 26 -10.154 3.553 -7.966
113 HD22 LEU 26 1HD2 LEU 26 -9.775 2.875 -6.383
114 HD23 LEU 26 2HD2 LEU 26 -10.422 4.512 -6.510
115 H LEU 27 H LEU 27 -14.677 -0.210 -6.940
116 HA LEU 27 HA LEU 27 -16.818 1.766 -6.618
117 HB2 LEU 27 2HB LEU 27 -17.353 1.269 -9.100
118 HB3 LEU 27 1HB LEU 27 -16.098 2.428 -8.710
119 HG LEU 27 HG LEU 27 -14.564 0.248 -8.928
120 HD11 LEU 27 1HD1 LEU 27 -15.363 -1.433 -10.193
121 HD12 LEU 27 2HD1 LEU 27 -16.350 -0.360 -11.185
122 HD13 LEU 27 3HD1 LEU 27 -16.924 -0.869 -9.598
123 HD21 LEU 27 3HD2 LEU 27 -15.485 2.304 -10.843
124 HD22 LEU 27 1HD2 LEU 27 -14.600 0.933 -11.512
125 HD23 LEU 27 2HD2 LEU 27 -13.861 1.935 -10.262
126 H GLN 28 H GLN 28 -16.260 -0.919 -5.508
127 HA GLN 28 HA GLN 28 -18.710 -2.254 -6.450
128 HB2 GLN 28 2HB GLN 28 -16.044 -3.459 -5.738
129 HB3 GLN 28 1HB GLN 28 -17.522 -4.410 -5.711
130 HG2 GLN 28 2HG GLN 28 -17.176 -2.907 -8.179
131 HG3 GLN 28 1HG GLN 28 -15.872 -4.052 -7.870
132 HE21 GLN 28 1HE2 GLN 28 -16.631 -6.267 -7.200
133 HE22 GLN 28 2HE2 GLN 28 -17.984 -6.918 -8.055
134 H CYS 29 H CYS 29 -16.442 -1.857 -3.750
135 HA CYS 29 HA CYS 29 -18.199 -2.975 -1.803
136 HB2 CYS 29 2HB CYS 29 -15.542 -2.392 -1.839
137 HB3 CYS 29 1HB CYS 29 -16.157 -1.053 -0.877
138 H ASP 30 H ASP 30 -19.848 -2.059 -0.761
139 HA ASP 30 HA ASP 30 -20.912 0.413 -1.461
140 HB2 ASP 30 2HB ASP 30 -21.472 -1.653 0.527
141 HB3 ASP 30 1HB ASP 30 -21.903 -0.038 1.084
142 H VAL 31 H VAL 31 -18.775 -0.458 1.197
143 HA VAL 31 HA VAL 31 -18.857 2.062 2.496
144 HB VAL 31 HB VAL 31 -18.098 0.030 3.648
145 HG11 VAL 31 1HG1 VAL 31 -15.571 0.226 2.023
146 HG12 VAL 31 2HG1 VAL 31 -16.878 -0.899 1.661
147 HG13 VAL 31 3HG1 VAL 31 -16.012 -1.018 3.192
148 HG21 VAL 31 3HG2 VAL 31 -17.419 2.024 4.693
149 HG22 VAL 31 1HG2 VAL 31 -16.182 2.339 3.477
150 HG23 VAL 31 2HG2 VAL 31 -15.968 1.023 4.631
151 H ALA 32 H ALA 32 -16.767 0.663 0.031
152 HA ALA 32 HA ALA 32 -14.861 2.744 -0.036
153 HB1 ALA 32 3HB ALA 32 -14.557 0.464 -1.008
154 HB2 ALA 32 1HB ALA 32 -14.094 1.782 -2.084
155 HB3 ALA 32 2HB ALA 32 -15.626 0.942 -2.326
156 H SER 33 H SER 33 -17.924 2.250 -1.684
157 HA SER 33 HA SER 33 -17.670 4.377 -3.530
158 HB2 SER 33 2HB SER 33 -20.344 4.147 -3.302
159 HB3 SER 33 1HB SER 33 -19.359 3.015 -4.229
160 HG SER 33 HG SER 33 -20.399 2.717 -1.617
161 H LYS 34 H LYS 34 -18.922 4.199 -0.243
162 HA LYS 34 HA LYS 34 -20.072 6.798 -0.247
163 HB2 LYS 34 2HB LYS 34 -20.373 6.520 2.108
164 HB3 LYS 34 1HB LYS 34 -20.691 4.970 1.344
165 HG2 LYS 34 2HG LYS 34 -18.930 3.968 2.333
166 HG3 LYS 34 1HG LYS 34 -17.934 5.421 2.303
167 HD2 LYS 34 2HD LYS 34 -18.345 5.503 4.508
168 HD3 LYS 34 1HD LYS 34 -19.920 6.140 4.030
169 HE2 LYS 34 2HE LYS 34 -19.322 3.213 4.435
170 HE3 LYS 34 1HE LYS 34 -20.020 4.260 5.669
171 HZ1 LYS 34 3HZ LYS 34 -21.365 4.282 3.098
172 HZ2 LYS 34 1HZ LYS 34 -22.013 4.263 4.660
173 HZ3 LYS 34 2HZ LYS 34 -21.466 2.826 3.953
174 H ILE 35 H ILE 35 -16.874 5.563 0.463
175 HA ILE 35 HA ILE 35 -15.899 7.929 1.718
176 HB ILE 35 HB ILE 35 -14.302 5.778 0.325
177 HG12 ILE 35 2HG1 ILE 35 -14.698 5.905 3.288
178 HG13 ILE 35 1HG1 ILE 35 -15.963 5.196 2.289
179 HG21 ILE 35 1HG2 ILE 35 -13.147 7.146 2.634
180 HG22 ILE 35 2HG2 ILE 35 -13.434 8.200 1.250
181 HG23 ILE 35 3HG2 ILE 35 -12.433 6.760 1.069
182 HD11 ILE 35 3HD1 ILE 35 -13.892 3.825 3.332
183 HD12 ILE 35 1HD1 ILE 35 -13.252 4.223 1.738
184 HD13 ILE 35 2HD1 ILE 35 -14.773 3.342 1.882
185 H ILE 36 H ILE 36 -15.965 6.742 -1.591
186 HA ILE 36 HA ILE 36 -14.287 8.805 -2.645
187 HB ILE 36 HB ILE 36 -16.231 7.011 -4.103
188 HG12 ILE 36 2HG1 ILE 36 -14.413 5.880 -2.737
189 HG13 ILE 36 1HG1 ILE 36 -14.434 5.493 -4.453
190 HG21 ILE 36 1HG2 ILE 36 -14.430 9.131 -4.976
191 HG22 ILE 36 2HG2 ILE 36 -15.773 8.363 -5.821
192 HG23 ILE 36 3HG2 ILE 36 -14.180 7.606 -5.825
193 HD11 ILE 36 3HD1 ILE 36 -12.334 6.147 -4.646
194 HD12 ILE 36 1HD1 ILE 36 -12.293 6.452 -2.909
195 HD13 ILE 36 2HD1 ILE 36 -12.740 7.746 -4.022
196 H SER 37 H SER 37 -17.679 8.495 -1.970
197 HA SER 37 HA SER 37 -18.238 10.976 -3.441
198 HB2 SER 37 2HB SER 37 -20.419 9.362 -2.198
199 HB3 SER 37 1HB SER 37 -20.424 10.295 -3.694
200 HG SER 37 HG SER 37 -19.525 7.692 -3.215
201 H LYS 38 H LYS 38 -17.339 10.086 -0.418
202 HA LYS 38 HA LYS 38 -19.174 11.466 1.224
203 HB2 LYS 38 2HB LYS 38 -16.912 9.880 1.614
204 HB3 LYS 38 1HB LYS 38 -16.481 11.441 2.298
205 HG2 LYS 38 2HG LYS 38 -19.098 10.187 2.988
206 HG3 LYS 38 1HG LYS 38 -17.615 9.649 3.782
207 HD2 LYS 38 2HD LYS 38 -17.203 12.147 4.241
208 HD3 LYS 38 1HD LYS 38 -18.910 12.356 3.844
209 HE2 LYS 38 2HE LYS 38 -18.603 10.162 5.660
210 HE3 LYS 38 1HE LYS 38 -17.783 11.583 6.306
211 HZ1 LYS 38 3HZ LYS 38 -19.918 11.849 7.077
212 HZ2 LYS 38 1HZ LYS 38 -20.635 11.211 5.683
213 HZ3 LYS 38 2HZ LYS 38 -19.973 12.767 5.657
214 H LYS 39 H LYS 39 -15.790 12.450 0.870
215 HA LYS 39 HA LYS 39 -16.162 14.931 -0.304
216 HB2 LYS 39 2HB LYS 39 -17.329 14.983 2.188
217 HB3 LYS 39 1HB LYS 39 -15.734 15.649 2.506
218 HG2 LYS 39 2HG LYS 39 -17.251 17.438 2.034
219 HG3 LYS 39 1HG LYS 39 -16.101 17.296 0.702
220 HD2 LYS 39 2HD LYS 39 -18.061 17.501 -0.467
221 HD3 LYS 39 1HD LYS 39 -17.975 15.746 -0.309
222 HE2 LYS 39 2HE LYS 39 -20.215 16.668 0.207
223 HE3 LYS 39 1HE LYS 39 -19.494 15.787 1.554
224 HZ1 LYS 39 3HZ LYS 39 -18.974 18.644 1.484
225 HZ2 LYS 39 1HZ LYS 39 -19.342 17.640 2.796
226 HZ3 LYS 39 2HZ LYS 39 -20.577 18.201 1.788
227 HA PRO 40 HA PRO 40 -11.927 15.061 2.144
228 HB2 PRO 40 2HB PRO 40 -11.380 12.665 3.430
229 HB3 PRO 40 1HB PRO 40 -11.947 14.138 4.223
230 HG2 PRO 40 2HG PRO 40 -13.497 11.737 3.352
231 HG3 PRO 40 1HG PRO 40 -13.671 12.716 4.821
232 HD2 PRO 40 2HD PRO 40 -15.367 12.982 2.773
233 HD3 PRO 40 1HD PRO 40 -14.841 14.391 3.717
234 H ARG 41 H ARG 41 -10.287 14.727 0.793
235 HA ARG 41 HA ARG 41 -9.557 12.176 -0.219
236 HB2 ARG 41 2HB ARG 41 -11.538 12.646 -1.646
237 HB3 ARG 41 1HB ARG 41 -10.742 14.104 -2.225
238 HG2 ARG 41 2HG ARG 41 -8.841 12.226 -2.721
239 HG3 ARG 41 1HG ARG 41 -10.324 11.303 -2.969
240 HD2 ARG 41 2HD ARG 41 -10.388 13.961 -4.177
241 HD3 ARG 41 1HD ARG 41 -9.115 12.927 -4.822
242 HE ARG 41 HE ARG 41 -11.686 11.648 -4.669
243 HH11 ARG 41 1HH1 ARG 41 -9.594 13.651 -6.616
244 HH12 ARG 41 2HH1 ARG 41 -10.363 13.222 -8.106
245 HH21 ARG 41 1HH2 ARG 41 -12.699 11.082 -6.630
246 HH22 ARG 41 2HH2 ARG 41 -12.125 11.763 -8.115
247 H THR 42 H THR 42 -7.684 13.131 0.868
248 HA THR 42 HA THR 42 -6.227 15.005 -0.880
249 HB THR 42 HB THR 42 -4.895 15.123 1.510
250 HG1 THR 42 1HG THR 42 -6.213 14.263 2.908
251 HG21 THR 42 3HG2 THR 42 -7.119 16.821 0.446
252 HG22 THR 42 1HG2 THR 42 -5.384 17.136 0.442
253 HG23 THR 42 2HG2 THR 42 -6.288 17.204 1.955
254 H ALA 43 H ALA 43 -3.703 14.761 -0.028
255 HA ALA 43 HA ALA 43 -2.756 12.466 -1.285
256 HB1 ALA 43 3HB ALA 43 -0.956 13.768 -1.198
257 HB2 ALA 43 1HB ALA 43 -0.729 13.229 0.466
258 HB3 ALA 43 2HB ALA 43 -1.624 14.710 0.134
259 H GLN 44 H GLN 44 -3.557 13.042 2.077
260 HA GLN 44 HA GLN 44 -2.310 10.749 3.158
261 HB2 GLN 44 2HB GLN 44 -4.008 12.874 4.092
262 HB3 GLN 44 1HB GLN 44 -4.598 11.338 4.710
263 HG2 GLN 44 2HG GLN 44 -2.868 11.091 6.104
264 HG3 GLN 44 1HG GLN 44 -1.701 11.682 4.922
265 HE21 GLN 44 1HE2 GLN 44 -0.814 12.709 6.880
266 HE22 GLN 44 2HE2 GLN 44 -1.428 14.257 7.338
267 H ASP 45 H ASP 45 -5.382 11.286 1.587
268 HA ASP 45 HA ASP 45 -6.598 8.838 2.370
269 HB2 ASP 45 2HB ASP 45 -7.584 11.058 1.268
270 HB3 ASP 45 1HB ASP 45 -7.349 10.127 -0.209
271 H GLU 46 H GLU 46 -4.570 9.826 -0.318
272 HA GLU 46 HA GLU 46 -4.911 7.518 -1.904
273 HB2 GLU 46 2HB GLU 46 -3.273 9.898 -1.936
274 HB3 GLU 46 1HB GLU 46 -2.322 8.491 -2.387
275 HG2 GLU 46 2HG GLU 46 -4.955 8.698 -3.674
276 HG3 GLU 46 1HG GLU 46 -3.794 9.951 -4.106
277 H LYS 47 H LYS 47 -2.544 8.373 0.578
278 HA LYS 47 HA LYS 47 -0.991 6.015 0.309
279 HB2 LYS 47 2HB LYS 47 -0.051 6.647 2.516
280 HB3 LYS 47 1HB LYS 47 -0.043 7.973 1.362
281 HG2 LYS 47 2HG LYS 47 -1.947 8.979 2.418
282 HG3 LYS 47 1HG LYS 47 -2.130 7.594 3.495
283 HD2 LYS 47 2HD LYS 47 -1.052 9.307 4.745
284 HD3 LYS 47 1HD LYS 47 0.175 8.097 4.365
285 HE2 LYS 47 2HE LYS 47 -0.144 10.301 2.425
286 HE3 LYS 47 1HE LYS 47 0.525 10.736 3.996
287 HZ1 LYS 47 3HZ LYS 47 2.437 10.132 3.007
288 HZ2 LYS 47 1HZ LYS 47 1.682 9.135 1.867
289 HZ3 LYS 47 2HZ LYS 47 1.955 8.569 3.438
290 H PHE 48 H PHE 48 -3.751 6.895 2.299
291 HA PHE 48 HA PHE 48 -3.721 4.574 3.931
292 HB2 PHE 48 2HB PHE 48 -4.906 6.637 4.574
293 HB3 PHE 48 1HB PHE 48 -6.033 6.404 3.242
294 HD1 PHE 48 2HD PHE 48 -7.610 4.496 3.285
295 HD2 PHE 48 1HD PHE 48 -5.148 5.466 6.616
296 HE1 PHE 48 2HE PHE 48 -9.054 3.138 4.743
297 HE2 PHE 48 1HE PHE 48 -6.586 4.110 8.081
298 HZ PHE 48 HZ PHE 48 -8.542 2.944 7.144
299 H LEU 49 H LEU 49 -5.204 5.372 0.851
300 HA LEU 49 HA LEU 49 -6.867 3.084 0.687
301 HB2 LEU 49 2HB LEU 49 -7.652 4.257 -1.030
302 HB3 LEU 49 1HB LEU 49 -6.319 5.382 -0.881
303 HG LEU 49 HG LEU 49 -4.986 3.793 -2.360
304 HD11 LEU 49 1HD1 LEU 49 -6.860 2.577 -3.871
305 HD12 LEU 49 2HD1 LEU 49 -7.589 2.425 -2.273
306 HD13 LEU 49 3HD1 LEU 49 -5.974 1.782 -2.570
307 HD21 LEU 49 3HD2 LEU 49 -5.798 5.868 -3.233
308 HD22 LEU 49 1HD2 LEU 49 -7.426 5.215 -3.413
309 HD23 LEU 49 2HD2 LEU 49 -6.115 4.610 -4.428
310 H ARG 50 H ARG 50 -3.569 3.769 -0.319
311 HA ARG 50 HA ARG 50 -3.158 1.377 -1.775
312 HB2 ARG 50 2HB ARG 50 -1.266 3.324 -0.466
313 HB3 ARG 50 1HB ARG 50 -0.699 1.911 -1.345
314 HG2 ARG 50 2HG ARG 50 -2.186 2.842 -3.265
315 HG3 ARG 50 1HG ARG 50 -2.057 4.358 -2.371
316 HD2 ARG 50 2HD ARG 50 0.260 2.684 -3.334
317 HD3 ARG 50 1HD ARG 50 -0.330 4.154 -4.107
318 HE ARG 50 HE ARG 50 0.382 4.505 -1.345
319 HH11 ARG 50 1HH1 ARG 50 1.570 4.486 -4.626
320 HH12 ARG 50 2HH1 ARG 50 2.927 5.503 -4.275
321 HH21 ARG 50 1HH2 ARG 50 2.165 5.845 -0.880
322 HH22 ARG 50 2HH2 ARG 50 3.264 6.275 -2.148
323 H GLU 51 H GLU 51 -2.731 2.257 1.601
324 HA GLU 51 HA GLU 51 -1.333 -0.037 2.433
325 HB2 GLU 51 2HB GLU 51 -2.897 2.107 3.756
326 HB3 GLU 51 1HB GLU 51 -2.684 0.620 4.669
327 HG2 GLU 51 2HG GLU 51 -0.741 1.452 5.336
328 HG3 GLU 51 1HG GLU 51 -0.156 1.150 3.700
329 H SER 52 H SER 52 -4.751 0.629 2.012
330 HA SER 52 HA SER 52 -5.420 -2.073 2.934
331 HB2 SER 52 2HB SER 52 -7.428 0.027 2.146
332 HB3 SER 52 1HB SER 52 -7.636 -1.341 3.239
333 HG SER 52 HG SER 52 -6.402 -0.295 4.763
334 H ALA 53 H ALA 53 -4.047 -1.867 0.504
335 HA ALA 53 HA ALA 53 -6.110 -2.842 -1.346
336 HB1 ALA 53 3HB ALA 53 -3.784 -1.265 -2.380
337 HB2 ALA 53 1HB ALA 53 -5.248 -0.454 -1.824
338 HB3 ALA 53 2HB ALA 53 -5.330 -1.612 -3.154
339 H CYS 54 H CYS 54 -5.632 -4.728 -2.294
340 HA CYS 54 HA CYS 54 -3.248 -6.117 -1.527
341 HB2 CYS 54 2HB CYS 54 -4.179 -7.993 -2.804
342 HB3 CYS 54 1HB CYS 54 -5.387 -7.295 -1.734
343 H GLY 55 H GLY 55 -2.003 -4.228 -2.634
344 HA2 GLY 55 2HA GLY 55 -0.167 -4.413 -4.212
345 HA3 GLY 55 1HA GLY 55 -1.284 -5.173 -5.336
346 H PHE 56 H PHE 56 0.024 -3.294 -6.501
347 HA PHE 56 HA PHE 56 -1.918 -1.152 -6.828
348 HB2 PHE 56 2HB PHE 56 0.011 -0.534 -5.152
349 HB3 PHE 56 1HB PHE 56 0.954 -0.333 -6.624
350 HD1 PHE 56 2HD PHE 56 -2.321 0.686 -5.165
351 HD2 PHE 56 1HD PHE 56 0.980 1.728 -7.639
352 HE1 PHE 56 2HE PHE 56 -3.252 2.947 -5.446
353 HE2 PHE 56 1HE PHE 56 0.057 3.990 -7.925
354 HZ PHE 56 HZ PHE 56 -2.061 4.603 -6.829
355 H ASP 57 H ASP 57 -2.263 -0.807 -8.919
356 HA ASP 57 HA ASP 57 -0.164 -1.606 -10.829
357 HB2 ASP 57 2HB ASP 57 -3.093 -2.087 -10.786
358 HB3 ASP 57 1HB ASP 57 -2.376 -1.725 -12.353
359 H GLY 58 H GLY 58 -2.753 0.698 -10.137
360 HA2 GLY 58 2HA GLY 58 -2.292 3.058 -10.520
361 HA3 GLY 58 1HA GLY 58 -1.422 2.588 -11.973
362 H GLN 59 H GLN 59 -2.946 1.151 -13.466
363 HA GLN 59 HA GLN 59 -5.030 2.914 -14.303
364 HB2 GLN 59 2HB GLN 59 -3.502 1.270 -15.682
365 HB3 GLN 59 1HB GLN 59 -4.788 0.120 -15.346
366 HG2 GLN 59 2HG GLN 59 -5.839 0.911 -17.124
367 HG3 GLN 59 1HG GLN 59 -6.108 2.400 -16.219
368 HE21 GLN 59 1HE2 GLN 59 -5.719 1.974 -19.086
369 HE22 GLN 59 2HE2 GLN 59 -4.365 2.951 -19.531
370 H THR 60 H THR 60 -4.995 -0.390 -12.986
371 HA THR 60 HA THR 60 -7.885 -0.174 -12.508
372 HB THR 60 HB THR 60 -6.101 -2.616 -12.468
373 HG1 THR 60 1HG THR 60 -8.044 -1.857 -14.383
374 HG21 THR 60 3HG2 THR 60 -8.116 -3.930 -12.453
375 HG22 THR 60 1HG2 THR 60 -9.104 -2.469 -12.422
376 HG23 THR 60 2HG2 THR 60 -8.084 -2.873 -11.041
377 HA PRO 61 HA PRO 61 -6.191 0.537 -8.292
378 HB2 PRO 61 2HB PRO 61 -8.366 1.927 -7.423
379 HB3 PRO 61 1HB PRO 61 -7.026 2.675 -8.300
380 HG2 PRO 61 2HG PRO 61 -9.692 1.777 -9.321
381 HG3 PRO 61 1HG PRO 61 -8.794 3.261 -9.690
382 HD2 PRO 61 2HD PRO 61 -8.831 1.144 -11.366
383 HD3 PRO 61 1HD PRO 61 -7.411 2.197 -11.203
384 H LYS 62 H LYS 62 -6.555 -0.684 -6.512
385 HA LYS 62 HA LYS 62 -9.106 -2.136 -6.327
386 HB2 LYS 62 2HB LYS 62 -7.838 -4.123 -5.534
387 HB3 LYS 62 1HB LYS 62 -7.505 -3.704 -7.209
388 HG2 LYS 62 2HG LYS 62 -5.720 -2.641 -5.077
389 HG3 LYS 62 1HG LYS 62 -5.569 -4.330 -5.565
390 HD2 LYS 62 2HD LYS 62 -5.737 -2.419 -7.788
391 HD3 LYS 62 1HD LYS 62 -4.304 -2.244 -6.773
392 HE2 LYS 62 2HE LYS 62 -4.375 -4.929 -7.078
393 HE3 LYS 62 1HE LYS 62 -5.080 -4.414 -8.609
394 HZ1 LYS 62 3HZ LYS 62 -2.467 -4.628 -8.200
395 HZ2 LYS 62 1HZ LYS 62 -2.681 -3.005 -7.773
396 HZ3 LYS 62 2HZ LYS 62 -3.141 -3.542 -9.309
397 H VAL 63 H VAL 63 -9.618 -2.918 -4.176
398 HA VAL 63 HA VAL 63 -8.167 -1.643 -1.981
399 HB VAL 63 HB VAL 63 -11.164 -1.391 -2.244
400 HG11 VAL 63 1HG1 VAL 63 -10.471 -1.395 0.042
401 HG12 VAL 63 2HG1 VAL 63 -10.843 0.270 -0.406
402 HG13 VAL 63 3HG1 VAL 63 -9.165 -0.260 -0.296
403 HG21 VAL 63 3HG2 VAL 63 -10.825 0.948 -2.772
404 HG22 VAL 63 1HG2 VAL 63 -10.005 -0.060 -3.964
405 HG23 VAL 63 2HG2 VAL 63 -9.076 0.739 -2.695
406 H CYS 64 H CYS 64 -8.725 -2.523 0.125
407 HA CYS 64 HA CYS 64 -9.588 -5.318 -0.099
408 HB2 CYS 64 2HB CYS 64 -7.716 -3.860 1.704
409 HB3 CYS 64 1HB CYS 64 -8.552 -5.269 2.349
410 H CYS 65 H CYS 65 -11.483 -5.917 0.665
411 HA CYS 65 HA CYS 65 -12.766 -4.281 2.748
412 HB2 CYS 65 2HB CYS 65 -13.796 -5.222 0.137
413 HB3 CYS 65 1HB CYS 65 -14.902 -5.369 1.497
414 HA PRO 66 HA PRO 66 -12.509 -8.280 4.808
415 HB2 PRO 66 2HB PRO 66 -13.722 -7.465 7.121
416 HB3 PRO 66 1HB PRO 66 -12.014 -7.196 6.761
417 HG2 PRO 66 2HG PRO 66 -14.327 -5.318 6.484
418 HG3 PRO 66 1HG PRO 66 -12.695 -5.002 7.103
419 HD2 PRO 66 2HD PRO 66 -13.439 -4.299 4.612
420 HD3 PRO 66 1HD PRO 66 -11.788 -4.838 4.982
Start of MODEL 4
1 H GLN 11 H GLN 11 -11.114 -10.879 -5.299
2 HA GLN 11 HA GLN 11 -10.159 -13.636 -4.999
3 HB2 GLN 11 2HB GLN 11 -8.824 -12.407 -6.697
4 HB3 GLN 11 1HB GLN 11 -8.531 -11.137 -5.516
5 HG2 GLN 11 2HG GLN 11 -7.602 -13.115 -4.076
6 HG3 GLN 11 1HG GLN 11 -7.432 -13.899 -5.647
7 HE21 GLN 11 1HE2 GLN 11 -5.197 -13.509 -4.271
8 HE22 GLN 11 2HE2 GLN 11 -4.258 -12.223 -4.940
9 H ALA 12 H ALA 12 -9.195 -13.988 -2.985
10 HA ALA 12 HA ALA 12 -10.189 -12.322 -0.866
11 HB1 ALA 12 3HB ALA 12 -10.229 -14.689 -0.530
12 HB2 ALA 12 1HB ALA 12 -9.071 -13.999 0.607
13 HB3 ALA 12 2HB ALA 12 -8.499 -14.818 -0.847
14 H CYS 13 H CYS 13 -9.158 -10.745 0.157
15 HA CYS 13 HA CYS 13 -6.234 -10.547 -0.126
16 HB2 CYS 13 2HB CYS 13 -6.945 -8.834 -1.528
17 HB3 CYS 13 1HB CYS 13 -8.355 -8.471 -0.542
18 H THR 14 H THR 14 -5.128 -9.482 1.601
19 HA THR 14 HA THR 14 -6.485 -9.847 4.167
20 HB THR 14 HB THR 14 -4.383 -11.014 3.948
21 HG1 THR 14 1HG THR 14 -3.964 -8.724 5.562
22 HG21 THR 14 3HG2 THR 14 -3.522 -8.717 2.540
23 HG22 THR 14 1HG2 THR 14 -2.671 -10.238 2.798
24 HG23 THR 14 2HG2 THR 14 -2.484 -8.917 3.951
25 H LEU 15 H LEU 15 -7.371 -8.130 5.077
26 HA LEU 15 HA LEU 15 -7.006 -5.481 4.257
27 HB2 LEU 15 2HB LEU 15 -8.029 -4.988 6.593
28 HB3 LEU 15 1HB LEU 15 -8.991 -5.818 5.385
29 HG LEU 15 HG LEU 15 -7.470 -7.598 7.168
30 HD11 LEU 15 1HD1 LEU 15 -9.525 -7.178 8.828
31 HD12 LEU 15 2HD1 LEU 15 -9.296 -5.534 8.232
32 HD13 LEU 15 3HD1 LEU 15 -7.961 -6.384 9.010
33 HD21 LEU 15 3HD2 LEU 15 -8.943 -8.872 6.052
34 HD22 LEU 15 1HD2 LEU 15 -10.007 -7.509 5.701
35 HD23 LEU 15 2HD2 LEU 15 -10.093 -8.315 7.268
36 HA PRO 16 HA PRO 16 -3.416 -3.787 6.143
37 HB2 PRO 16 2HB PRO 16 -4.538 -1.812 7.799
38 HB3 PRO 16 1HB PRO 16 -4.029 -1.606 6.121
39 HG2 PRO 16 2HG PRO 16 -6.748 -2.106 7.232
40 HG3 PRO 16 1HG PRO 16 -6.264 -1.126 5.837
41 HD2 PRO 16 2HD PRO 16 -7.394 -3.527 5.514
42 HD3 PRO 16 1HD PRO 16 -6.090 -2.977 4.441
43 H ASN 17 H ASN 17 -6.084 -4.704 8.208
44 HA ASN 17 HA ASN 17 -4.458 -4.766 10.599
45 HB2 ASN 17 2HB ASN 17 -7.181 -4.556 10.117
46 HB3 ASN 17 1HB ASN 17 -7.001 -6.191 10.748
47 HD21 ASN 17 1HD2 ASN 17 -8.139 -5.581 12.613
48 HD22 ASN 17 2HD2 ASN 17 -7.387 -4.654 13.862
49 H ASN 18 H ASN 18 -5.168 -6.873 8.005
50 HA ASN 18 HA ASN 18 -4.462 -8.980 7.522
51 HB2 ASN 18 2HB ASN 18 -2.400 -8.185 8.830
52 HB3 ASN 18 1HB ASN 18 -3.062 -9.093 10.188
53 HD21 ASN 18 1HD2 ASN 18 -3.324 -11.367 9.959
54 HD22 ASN 18 2HD2 ASN 18 -2.342 -12.254 8.850
55 H ASP 19 H ASP 19 -6.614 -9.700 7.668
56 HA ASP 19 HA ASP 19 -7.011 -11.734 9.662
57 HB2 ASP 19 2HB ASP 19 -8.501 -9.160 9.758
58 HB3 ASP 19 1HB ASP 19 -9.422 -10.634 10.042
59 H LYS 20 H LYS 20 -6.794 -11.437 6.734
60 HA LYS 20 HA LYS 20 -7.687 -12.373 4.864
61 HB2 LYS 20 2HB LYS 20 -9.721 -13.675 6.675
62 HB3 LYS 20 1HB LYS 20 -9.188 -14.223 5.091
63 HG2 LYS 20 2HG LYS 20 -7.346 -15.221 5.908
64 HG3 LYS 20 1HG LYS 20 -7.069 -13.963 7.115
65 HD2 LYS 20 2HD LYS 20 -9.002 -14.902 8.406
66 HD3 LYS 20 1HD LYS 20 -9.035 -16.245 7.260
67 HE2 LYS 20 2HE LYS 20 -6.389 -15.693 8.387
68 HE3 LYS 20 1HE LYS 20 -7.591 -16.181 9.580
69 HZ1 LYS 20 3HZ LYS 20 -6.498 -18.117 8.750
70 HZ2 LYS 20 1HZ LYS 20 -6.793 -17.676 7.144
71 HZ3 LYS 20 2HZ LYS 20 -8.079 -18.121 8.149
72 H GLY 21 H GLY 21 -9.200 -11.845 3.312
73 HA2 GLY 21 2HA GLY 21 -11.798 -10.861 3.933
74 HA3 GLY 21 1HA GLY 21 -10.692 -9.534 3.616
75 H THR 22 H THR 22 -11.780 -8.886 1.770
76 HA THR 22 HA THR 22 -11.390 -10.641 -0.554
77 HB THR 22 HB THR 22 -13.722 -8.784 -0.512
78 HG1 THR 22 1HG THR 22 -14.838 -9.953 0.833
79 HG21 THR 22 3HG2 THR 22 -14.763 -10.750 -1.710
80 HG22 THR 22 1HG2 THR 22 -13.142 -11.442 -1.766
81 HG23 THR 22 2HG2 THR 22 -13.470 -9.900 -2.555
82 H CYS 23 H CYS 23 -10.861 -9.616 -2.495
83 HA CYS 23 HA CYS 23 -10.164 -6.764 -2.232
84 HB2 CYS 23 2HB CYS 23 -8.054 -7.468 -2.544
85 HB3 CYS 23 1HB CYS 23 -8.574 -9.074 -3.029
86 H LYS 24 H LYS 24 -11.224 -5.456 -3.535
87 HA LYS 24 HA LYS 24 -11.931 -6.316 -6.230
88 HB2 LYS 24 2HB LYS 24 -14.249 -5.524 -5.990
89 HB3 LYS 24 1HB LYS 24 -13.909 -6.879 -4.922
90 HG2 LYS 24 2HG LYS 24 -13.566 -5.259 -3.070
91 HG3 LYS 24 1HG LYS 24 -14.086 -3.974 -4.162
92 HD2 LYS 24 2HD LYS 24 -16.134 -4.410 -3.340
93 HD3 LYS 24 1HD LYS 24 -16.103 -5.774 -4.460
94 HE2 LYS 24 2HE LYS 24 -15.211 -7.200 -2.667
95 HE3 LYS 24 1HE LYS 24 -15.294 -5.835 -1.554
96 HZ1 LYS 24 3HZ LYS 24 -17.697 -5.764 -1.905
97 HZ2 LYS 24 1HZ LYS 24 -17.206 -7.262 -1.291
98 HZ3 LYS 24 2HZ LYS 24 -17.599 -7.107 -2.929
99 H SER 25 H SER 25 -12.871 -4.408 -7.485
100 HA SER 25 HA SER 25 -11.054 -2.254 -7.348
101 HB2 SER 25 2HB SER 25 -12.211 -3.007 -9.429
102 HB3 SER 25 1HB SER 25 -13.713 -2.329 -8.799
103 HG SER 25 HG SER 25 -11.342 -0.813 -9.135
104 H LEU 26 H LEU 26 -12.239 0.089 -7.591
105 HA LEU 26 HA LEU 26 -13.406 0.522 -4.949
106 HB2 LEU 26 2HB LEU 26 -12.915 2.883 -5.324
107 HB3 LEU 26 1HB LEU 26 -11.492 1.888 -5.557
108 HG LEU 26 HG LEU 26 -12.247 2.004 -8.095
109 HD11 LEU 26 1HD1 LEU 26 -14.200 3.223 -8.066
110 HD12 LEU 26 2HD1 LEU 26 -13.003 4.478 -8.392
111 HD13 LEU 26 3HD1 LEU 26 -13.649 4.277 -6.763
112 HD21 LEU 26 3HD2 LEU 26 -10.964 4.452 -6.948
113 HD22 LEU 26 1HD2 LEU 26 -10.571 3.574 -8.425
114 HD23 LEU 26 2HD2 LEU 26 -10.157 2.888 -6.855
115 H LEU 27 H LEU 27 -14.952 -0.603 -7.230
116 HA LEU 27 HA LEU 27 -17.090 1.419 -7.261
117 HB2 LEU 27 2HB LEU 27 -16.302 -0.432 -9.512
118 HB3 LEU 27 1HB LEU 27 -17.724 0.594 -9.511
119 HG LEU 27 HG LEU 27 -14.928 1.690 -9.279
120 HD11 LEU 27 1HD1 LEU 27 -14.665 1.735 -11.519
121 HD12 LEU 27 2HD1 LEU 27 -16.389 1.937 -11.827
122 HD13 LEU 27 3HD1 LEU 27 -15.741 0.339 -11.455
123 HD21 LEU 27 3HD2 LEU 27 -17.656 2.813 -9.461
124 HD22 LEU 27 1HD2 LEU 27 -16.401 3.623 -10.398
125 HD23 LEU 27 2HD2 LEU 27 -16.219 3.440 -8.654
126 H GLN 28 H GLN 28 -16.676 -0.773 -5.424
127 HA GLN 28 HA GLN 28 -19.270 -2.024 -5.696
128 HB2 GLN 28 2HB GLN 28 -16.702 -3.587 -5.803
129 HB3 GLN 28 1HB GLN 28 -18.190 -4.315 -5.215
130 HG2 GLN 28 2HG GLN 28 -19.223 -3.571 -7.423
131 HG3 GLN 28 1HG GLN 28 -17.569 -3.292 -7.961
132 HE21 GLN 28 1HE2 GLN 28 -19.740 -5.269 -8.686
133 HE22 GLN 28 2HE2 GLN 28 -18.948 -6.804 -8.627
134 H CYS 29 H CYS 29 -16.237 -1.863 -3.869
135 HA CYS 29 HA CYS 29 -17.090 -2.862 -1.436
136 HB2 CYS 29 2HB CYS 29 -14.962 -0.987 -2.309
137 HB3 CYS 29 1HB CYS 29 -15.367 -0.975 -0.596
138 H ASP 30 H ASP 30 -18.534 -2.223 0.018
139 HA ASP 30 HA ASP 30 -20.107 0.094 -0.333
140 HB2 ASP 30 2HB ASP 30 -19.903 -2.065 1.695
141 HB3 ASP 30 1HB ASP 30 -20.674 -0.568 2.210
142 H VAL 31 H VAL 31 -17.329 -0.625 1.692
143 HA VAL 31 HA VAL 31 -17.465 1.710 3.293
144 HB VAL 31 HB VAL 31 -14.993 0.110 2.623
145 HG11 VAL 31 1HG1 VAL 31 -13.910 1.236 4.245
146 HG12 VAL 31 2HG1 VAL 31 -15.339 1.338 5.275
147 HG13 VAL 31 3HG1 VAL 31 -15.132 2.468 3.937
148 HG21 VAL 31 3HG2 VAL 31 -16.373 -0.406 5.164
149 HG22 VAL 31 1HG2 VAL 31 -15.603 -1.527 4.038
150 HG23 VAL 31 2HG2 VAL 31 -17.239 -0.945 3.726
151 H ALA 32 H ALA 32 -15.860 0.939 0.257
152 HA ALA 32 HA ALA 32 -14.335 3.303 0.054
153 HB1 ALA 32 3HB ALA 32 -14.658 2.643 -2.523
154 HB2 ALA 32 1HB ALA 32 -15.134 1.121 -1.769
155 HB3 ALA 32 2HB ALA 32 -13.541 1.806 -1.445
156 H SER 33 H SER 33 -17.611 2.480 -0.907
157 HA SER 33 HA SER 33 -18.121 4.795 -2.443
158 HB2 SER 33 2HB SER 33 -19.911 2.806 -1.063
159 HB3 SER 33 1HB SER 33 -20.564 4.188 -1.941
160 HG SER 33 HG SER 33 -19.801 1.875 -2.931
161 H LYS 34 H LYS 34 -18.535 4.066 0.985
162 HA LYS 34 HA LYS 34 -19.961 6.432 1.614
163 HB2 LYS 34 2HB LYS 34 -19.602 5.879 3.916
164 HB3 LYS 34 1HB LYS 34 -19.904 4.384 3.044
165 HG2 LYS 34 2HG LYS 34 -17.832 3.580 3.424
166 HG3 LYS 34 1HG LYS 34 -17.076 5.170 3.362
167 HD2 LYS 34 2HD LYS 34 -17.234 5.450 5.580
168 HD3 LYS 34 1HD LYS 34 -18.891 4.845 5.622
169 HE2 LYS 34 2HE LYS 34 -16.915 2.770 5.077
170 HE3 LYS 34 1HE LYS 34 -16.681 3.562 6.634
171 HZ1 LYS 34 3HZ LYS 34 -18.614 2.748 7.444
172 HZ2 LYS 34 1HZ LYS 34 -18.312 1.523 6.316
173 HZ3 LYS 34 2HZ LYS 34 -19.401 2.763 5.947
174 H ILE 35 H ILE 35 -16.557 5.681 1.347
175 HA ILE 35 HA ILE 35 -15.610 8.028 2.656
176 HB ILE 35 HB ILE 35 -14.164 6.354 0.601
177 HG12 ILE 35 2HG1 ILE 35 -13.713 6.034 3.529
178 HG13 ILE 35 1HG1 ILE 35 -15.163 5.311 2.841
179 HG21 ILE 35 1HG2 ILE 35 -12.299 7.519 1.050
180 HG22 ILE 35 2HG2 ILE 35 -12.668 7.640 2.770
181 HG23 ILE 35 3HG2 ILE 35 -13.414 8.758 1.627
182 HD11 ILE 35 3HD1 ILE 35 -13.171 4.537 1.104
183 HD12 ILE 35 1HD1 ILE 35 -13.891 3.554 2.379
184 HD13 ILE 35 2HD1 ILE 35 -12.405 4.450 2.690
185 H ILE 36 H ILE 36 -16.306 7.183 -0.691
186 HA ILE 36 HA ILE 36 -15.290 9.581 -1.827
187 HB ILE 36 HB ILE 36 -17.362 7.689 -2.948
188 HG12 ILE 36 2HG1 ILE 36 -15.121 6.692 -2.334
189 HG13 ILE 36 1HG1 ILE 36 -15.572 6.536 -4.029
190 HG21 ILE 36 1HG2 ILE 36 -16.073 8.733 -5.089
191 HG22 ILE 36 2HG2 ILE 36 -16.073 10.115 -3.993
192 HG23 ILE 36 3HG2 ILE 36 -17.595 9.349 -4.447
193 HD11 ILE 36 3HD1 ILE 36 -13.247 7.113 -3.847
194 HD12 ILE 36 1HD1 ILE 36 -13.637 8.520 -2.858
195 HD13 ILE 36 2HD1 ILE 36 -14.131 8.466 -4.551
196 H SER 37 H SER 37 -18.358 8.650 -0.444
197 HA SER 37 HA SER 37 -19.751 10.978 -1.426
198 HB2 SER 37 2HB SER 37 -20.980 8.889 -1.080
199 HB3 SER 37 1HB SER 37 -20.563 8.911 0.632
200 HG SER 37 HG SER 37 -21.802 10.762 0.881
201 H LYS 38 H LYS 38 -17.935 10.079 1.390
202 HA LYS 38 HA LYS 38 -18.948 12.033 3.167
203 HB2 LYS 38 2HB LYS 38 -16.580 10.243 3.080
204 HB3 LYS 38 1HB LYS 38 -16.493 11.635 4.150
205 HG2 LYS 38 2HG LYS 38 -18.890 9.867 4.251
206 HG3 LYS 38 1HG LYS 38 -17.389 9.348 5.020
207 HD2 LYS 38 2HD LYS 38 -18.344 10.457 6.772
208 HD3 LYS 38 1HD LYS 38 -17.481 11.798 6.018
209 HE2 LYS 38 2HE LYS 38 -19.390 12.885 5.701
210 HE3 LYS 38 1HE LYS 38 -20.033 11.532 4.772
211 HZ1 LYS 38 3HZ LYS 38 -20.390 10.566 7.178
212 HZ2 LYS 38 1HZ LYS 38 -21.528 11.593 6.461
213 HZ3 LYS 38 2HZ LYS 38 -20.428 12.207 7.589
214 H LYS 39 H LYS 39 -15.604 12.017 2.018
215 HA LYS 39 HA LYS 39 -15.760 14.566 0.762
216 HB2 LYS 39 2HB LYS 39 -15.741 14.810 3.452
217 HB3 LYS 39 1HB LYS 39 -14.012 14.766 3.142
218 HG2 LYS 39 2HG LYS 39 -15.547 16.565 1.400
219 HG3 LYS 39 1HG LYS 39 -15.512 17.007 3.106
220 HD2 LYS 39 2HD LYS 39 -12.905 16.375 2.665
221 HD3 LYS 39 1HD LYS 39 -13.368 17.041 1.099
222 HE2 LYS 39 2HE LYS 39 -12.542 18.840 2.425
223 HE3 LYS 39 1HE LYS 39 -14.291 19.025 2.313
224 HZ1 LYS 39 3HZ LYS 39 -14.576 18.326 4.504
225 HZ2 LYS 39 1HZ LYS 39 -13.213 19.326 4.582
226 HZ3 LYS 39 2HZ LYS 39 -13.032 17.646 4.603
227 HA PRO 40 HA PRO 40 -12.046 11.967 -0.243
228 HB2 PRO 40 2HB PRO 40 -12.565 11.541 -2.837
229 HB3 PRO 40 1HB PRO 40 -13.331 10.571 -1.572
230 HG2 PRO 40 2HG PRO 40 -14.437 12.888 -3.114
231 HG3 PRO 40 1HG PRO 40 -15.218 11.356 -2.687
232 HD2 PRO 40 2HD PRO 40 -15.595 13.700 -1.312
233 HD3 PRO 40 1HD PRO 40 -15.779 12.089 -0.589
234 H ARG 41 H ARG 41 -10.739 13.819 0.051
235 HA ARG 41 HA ARG 41 -9.580 14.889 -2.257
236 HB2 ARG 41 2HB ARG 41 -11.941 16.131 -1.900
237 HB3 ARG 41 1HB ARG 41 -10.928 17.143 -0.878
238 HG2 ARG 41 2HG ARG 41 -9.467 17.628 -2.737
239 HG3 ARG 41 1HG ARG 41 -10.375 16.524 -3.773
240 HD2 ARG 41 2HD ARG 41 -11.985 18.597 -2.454
241 HD3 ARG 41 1HD ARG 41 -10.801 19.203 -3.612
242 HE ARG 41 HE ARG 41 -12.308 17.030 -4.673
243 HH11 ARG 41 1HH1 ARG 41 -12.429 20.454 -4.018
244 HH12 ARG 41 2HH1 ARG 41 -13.586 20.780 -5.264
245 HH21 ARG 41 1HH2 ARG 41 -13.833 17.454 -6.312
246 HH22 ARG 41 2HH2 ARG 41 -14.383 19.077 -6.567
247 H THR 42 H THR 42 -8.066 13.890 -0.606
248 HA THR 42 HA THR 42 -6.536 15.953 0.588
249 HB THR 42 HB THR 42 -6.757 14.667 2.931
250 HG1 THR 42 1HG THR 42 -9.390 14.600 1.891
251 HG21 THR 42 3HG2 THR 42 -7.349 17.159 2.132
252 HG22 THR 42 1HG2 THR 42 -7.671 16.544 3.754
253 HG23 THR 42 2HG2 THR 42 -8.961 16.574 2.552
254 H ALA 43 H ALA 43 -4.495 15.228 1.323
255 HA ALA 43 HA ALA 43 -3.410 13.062 -0.051
256 HB1 ALA 43 3HB ALA 43 -2.483 14.886 2.080
257 HB2 ALA 43 1HB ALA 43 -1.744 14.478 0.532
258 HB3 ALA 43 2HB ALA 43 -1.596 13.372 1.897
259 H GLN 44 H GLN 44 -4.815 13.254 3.150
260 HA GLN 44 HA GLN 44 -3.866 10.847 4.212
261 HB2 GLN 44 2HB GLN 44 -6.391 12.415 4.714
262 HB3 GLN 44 1HB GLN 44 -6.003 10.950 5.607
263 HG2 GLN 44 2HG GLN 44 -3.744 12.195 6.059
264 HG3 GLN 44 1HG GLN 44 -4.707 13.626 5.691
265 HE21 GLN 44 1HE2 GLN 44 -5.685 14.538 7.343
266 HE22 GLN 44 2HE2 GLN 44 -6.108 13.768 8.831
267 H ASP 45 H ASP 45 -6.441 11.517 1.957
268 HA ASP 45 HA ASP 45 -7.723 8.987 2.141
269 HB2 ASP 45 2HB ASP 45 -8.325 11.378 0.935
270 HB3 ASP 45 1HB ASP 45 -7.923 10.363 -0.447
271 H GLU 46 H GLU 46 -5.107 10.274 0.186
272 HA GLU 46 HA GLU 46 -4.953 8.111 -1.635
273 HB2 GLU 46 2HB GLU 46 -3.273 10.440 -0.923
274 HB3 GLU 46 1HB GLU 46 -2.433 9.083 -1.663
275 HG2 GLU 46 2HG GLU 46 -4.218 9.183 -3.476
276 HG3 GLU 46 1HG GLU 46 -4.646 10.755 -2.800
277 H LYS 47 H LYS 47 -3.285 8.820 1.401
278 HA LYS 47 HA LYS 47 -1.586 6.551 1.316
279 HB2 LYS 47 2HB LYS 47 -1.118 7.028 3.654
280 HB3 LYS 47 1HB LYS 47 -1.112 8.517 2.720
281 HG2 LYS 47 2HG LYS 47 -3.271 9.122 3.553
282 HG3 LYS 47 1HG LYS 47 -3.453 7.559 4.350
283 HD2 LYS 47 2HD LYS 47 -1.059 8.529 5.344
284 HD3 LYS 47 1HD LYS 47 -2.082 9.963 5.246
285 HE2 LYS 47 2HE LYS 47 -3.695 9.047 6.679
286 HE3 LYS 47 1HE LYS 47 -3.069 7.411 6.477
287 HZ1 LYS 47 3HZ LYS 47 -2.531 8.553 8.638
288 HZ2 LYS 47 1HZ LYS 47 -1.493 9.562 7.763
289 HZ3 LYS 47 2HZ LYS 47 -1.213 7.895 7.808
290 H PHE 48 H PHE 48 -4.781 7.151 2.650
291 HA PHE 48 HA PHE 48 -5.031 4.729 4.080
292 HB2 PHE 48 2HB PHE 48 -6.620 7.013 3.614
293 HB3 PHE 48 1HB PHE 48 -7.578 5.637 3.080
294 HD1 PHE 48 2HD PHE 48 -5.397 6.612 5.947
295 HD2 PHE 48 1HD PHE 48 -8.918 4.617 4.632
296 HE1 PHE 48 2HE PHE 48 -5.990 6.124 8.285
297 HE2 PHE 48 1HE PHE 48 -9.518 4.127 6.967
298 HZ PHE 48 HZ PHE 48 -8.052 4.881 8.797
299 H LEU 49 H LEU 49 -5.668 5.624 0.745
300 HA LEU 49 HA LEU 49 -7.001 3.203 0.053
301 HB2 LEU 49 2HB LEU 49 -7.546 4.828 -1.450
302 HB3 LEU 49 1HB LEU 49 -5.974 5.593 -1.358
303 HG LEU 49 HG LEU 49 -5.060 3.756 -2.780
304 HD11 LEU 49 1HD1 LEU 49 -6.964 2.591 -4.127
305 HD12 LEU 49 2HD1 LEU 49 -7.920 2.906 -2.680
306 HD13 LEU 49 3HD1 LEU 49 -6.454 1.933 -2.572
307 HD21 LEU 49 3HD2 LEU 49 -7.072 5.748 -3.631
308 HD22 LEU 49 1HD2 LEU 49 -6.608 4.529 -4.818
309 HD23 LEU 49 2HD2 LEU 49 -5.381 5.570 -4.098
310 H ARG 50 H ARG 50 -3.680 4.356 -0.111
311 HA ARG 50 HA ARG 50 -2.633 2.160 -1.558
312 HB2 ARG 50 2HB ARG 50 -1.498 4.386 0.058
313 HB3 ARG 50 1HB ARG 50 -0.462 3.002 -0.259
314 HG2 ARG 50 2HG ARG 50 -1.204 3.356 -2.726
315 HG3 ARG 50 1HG ARG 50 -1.624 4.975 -2.170
316 HD2 ARG 50 2HD ARG 50 1.072 3.641 -2.157
317 HD3 ARG 50 1HD ARG 50 0.586 5.109 -3.000
318 HE ARG 50 HE ARG 50 0.711 6.293 -0.986
319 HH11 ARG 50 1HH1 ARG 50 1.504 2.918 -0.532
320 HH12 ARG 50 2HH1 ARG 50 2.246 3.176 1.010
321 HH21 ARG 50 1HH2 ARG 50 1.681 6.623 1.043
322 HH22 ARG 50 2HH2 ARG 50 2.344 5.275 1.904
323 H GLU 51 H GLU 51 -3.137 2.781 1.858
324 HA GLU 51 HA GLU 51 -1.647 0.580 2.835
325 HB2 GLU 51 2HB GLU 51 -2.887 2.723 3.983
326 HB3 GLU 51 1HB GLU 51 -3.979 1.420 4.428
327 HG2 GLU 51 2HG GLU 51 -2.558 0.586 5.926
328 HG3 GLU 51 1HG GLU 51 -1.176 0.754 4.845
329 H SER 52 H SER 52 -4.921 0.949 1.672
330 HA SER 52 HA SER 52 -5.351 -1.936 2.104
331 HB2 SER 52 2HB SER 52 -7.736 -0.215 1.763
332 HB3 SER 52 1HB SER 52 -7.478 -1.588 2.840
333 HG SER 52 HG SER 52 -6.920 1.120 3.228
334 H ALA 53 H ALA 53 -4.064 -0.859 -0.168
335 HA ALA 53 HA ALA 53 -6.092 -0.997 -2.280
336 HB1 ALA 53 3HB ALA 53 -3.415 0.223 -2.051
337 HB2 ALA 53 1HB ALA 53 -4.854 0.793 -2.892
338 HB3 ALA 53 2HB ALA 53 -3.837 -0.445 -3.626
339 H CYS 54 H CYS 54 -6.403 -2.831 -3.340
340 HA CYS 54 HA CYS 54 -4.644 -5.075 -2.941
341 HB2 CYS 54 2HB CYS 54 -7.024 -5.484 -2.980
342 HB3 CYS 54 1HB CYS 54 -7.169 -4.746 -4.570
343 H GLY 55 H GLY 55 -2.802 -3.871 -3.959
344 HA2 GLY 55 2HA GLY 55 -2.811 -3.424 -6.781
345 HA3 GLY 55 1HA GLY 55 -1.400 -3.428 -5.735
346 H PHE 56 H PHE 56 -1.508 -4.518 -8.353
347 HA PHE 56 HA PHE 56 -0.259 -6.992 -7.935
348 HB2 PHE 56 2HB PHE 56 -2.554 -7.766 -7.456
349 HB3 PHE 56 1HB PHE 56 -3.065 -7.212 -9.048
350 HD1 PHE 56 1HD PHE 56 -0.712 -9.543 -7.365
351 HD2 PHE 56 2HD PHE 56 -2.929 -8.628 -10.881
352 HE1 PHE 56 1HE PHE 56 -0.096 -11.726 -8.317
353 HE2 PHE 56 2HE PHE 56 -2.317 -10.810 -11.839
354 HZ PHE 56 HZ PHE 56 -0.899 -12.362 -10.556
355 H ASP 57 H ASP 57 -2.145 -5.023 -10.176
356 HA ASP 57 HA ASP 57 -0.433 -5.889 -12.391
357 HB2 ASP 57 2HB ASP 57 -3.172 -5.354 -12.230
358 HB3 ASP 57 1HB ASP 57 -2.503 -3.983 -13.108
359 H GLY 58 H GLY 58 -1.131 -3.168 -10.349
360 HA2 GLY 58 2HA GLY 58 0.356 -1.371 -10.009
361 HA3 GLY 58 1HA GLY 58 1.110 -1.732 -11.556
362 H GLN 59 H GLN 59 -0.201 0.723 -10.218
363 HA GLN 59 HA GLN 59 -1.127 2.637 -11.047
364 HB2 GLN 59 2HB GLN 59 -0.294 1.370 -13.345
365 HB3 GLN 59 1HB GLN 59 -2.011 1.606 -13.645
366 HG2 GLN 59 2HG GLN 59 -0.906 4.005 -12.560
367 HG3 GLN 59 1HG GLN 59 0.080 3.466 -13.918
368 HE21 GLN 59 1HE2 GLN 59 -0.963 3.136 -15.956
369 HE22 GLN 59 2HE2 GLN 59 -2.395 4.018 -16.352
370 H THR 60 H THR 60 -2.928 -0.138 -12.404
371 HA THR 60 HA THR 60 -5.461 0.873 -12.384
372 HB THR 60 HB THR 60 -5.060 -1.921 -11.391
373 HG1 THR 60 1HG THR 60 -4.262 -0.907 -13.903
374 HG21 THR 60 3HG2 THR 60 -6.617 -2.132 -13.553
375 HG22 THR 60 1HG2 THR 60 -7.015 -0.485 -13.062
376 HG23 THR 60 2HG2 THR 60 -7.241 -1.822 -11.932
377 HA PRO 61 HA PRO 61 -6.261 1.664 -8.072
378 HB2 PRO 61 2HB PRO 61 -8.863 2.330 -8.268
379 HB3 PRO 61 1HB PRO 61 -7.574 3.394 -8.842
380 HG2 PRO 61 2HG PRO 61 -9.324 1.528 -10.397
381 HG3 PRO 61 1HG PRO 61 -8.832 3.186 -10.788
382 HD2 PRO 61 2HD PRO 61 -7.647 0.981 -11.867
383 HD3 PRO 61 1HD PRO 61 -6.794 2.517 -11.613
384 H LYS 62 H LYS 62 -6.591 0.235 -6.504
385 HA LYS 62 HA LYS 62 -8.816 -1.659 -6.719
386 HB2 LYS 62 2HB LYS 62 -6.001 -2.320 -6.831
387 HB3 LYS 62 1HB LYS 62 -6.762 -3.080 -5.442
388 HG2 LYS 62 2HG LYS 62 -7.626 -4.642 -6.746
389 HG3 LYS 62 1HG LYS 62 -8.472 -3.413 -7.688
390 HD2 LYS 62 2HD LYS 62 -6.724 -3.236 -9.237
391 HD3 LYS 62 1HD LYS 62 -5.571 -4.021 -8.157
392 HE2 LYS 62 2HE LYS 62 -7.921 -5.633 -8.890
393 HE3 LYS 62 1HE LYS 62 -6.821 -5.256 -10.215
394 HZ1 LYS 62 3HZ LYS 62 -6.464 -7.347 -8.696
395 HZ2 LYS 62 1HZ LYS 62 -5.668 -6.227 -7.706
396 HZ3 LYS 62 2HZ LYS 62 -5.149 -6.470 -9.297
397 H VAL 63 H VAL 63 -9.322 -2.697 -4.606
398 HA VAL 63 HA VAL 63 -8.336 -1.282 -2.257
399 HB VAL 63 HB VAL 63 -11.298 -1.384 -2.823
400 HG11 VAL 63 1HG1 VAL 63 -10.965 0.513 -0.949
401 HG12 VAL 63 2HG1 VAL 63 -9.619 -0.552 -0.542
402 HG13 VAL 63 3HG1 VAL 63 -11.267 -1.182 -0.573
403 HG21 VAL 63 3HG2 VAL 63 -9.297 0.815 -3.255
404 HG22 VAL 63 1HG2 VAL 63 -11.016 1.140 -3.025
405 HG23 VAL 63 2HG2 VAL 63 -10.479 0.163 -4.391
406 H CYS 64 H CYS 64 -8.524 -2.425 -0.362
407 HA CYS 64 HA CYS 64 -9.399 -5.210 -0.649
408 HB2 CYS 64 2HB CYS 64 -7.036 -4.598 0.127
409 HB3 CYS 64 1HB CYS 64 -7.784 -4.074 1.632
410 H CYS 65 H CYS 65 -11.230 -5.856 0.271
411 HA CYS 65 HA CYS 65 -12.358 -4.207 2.437
412 HB2 CYS 65 2HB CYS 65 -13.562 -5.396 0.015
413 HB3 CYS 65 1HB CYS 65 -14.520 -5.539 1.484
414 HA PRO 66 HA PRO 66 -11.946 -7.952 4.836
415 HB2 PRO 66 2HB PRO 66 -13.091 -7.074 7.110
416 HB3 PRO 66 1HB PRO 66 -11.490 -6.528 6.597
417 HG2 PRO 66 2HG PRO 66 -14.135 -5.156 6.321
418 HG3 PRO 66 1HG PRO 66 -12.571 -4.480 6.810
419 HD2 PRO 66 2HD PRO 66 -13.586 -4.236 4.291
420 HD3 PRO 66 1HD PRO 66 -11.847 -4.267 4.640
Start of MODEL 5
1 H GLN 11 H GLN 11 -12.131 -10.973 -4.691
2 HA GLN 11 HA GLN 11 -10.143 -13.111 -4.442
3 HB2 GLN 11 2HB GLN 11 -10.169 -10.759 -5.823
4 HB3 GLN 11 1HB GLN 11 -9.464 -10.244 -4.297
5 HG2 GLN 11 2HG GLN 11 -7.749 -11.980 -4.519
6 HG3 GLN 11 1HG GLN 11 -8.447 -12.456 -6.066
7 HE21 GLN 11 1HE2 GLN 11 -6.019 -10.773 -4.710
8 HE22 GLN 11 2HE2 GLN 11 -5.702 -9.626 -5.963
9 H ALA 12 H ALA 12 -8.700 -12.967 -2.629
10 HA ALA 12 HA ALA 12 -10.003 -11.851 -0.234
11 HB1 ALA 12 3HB ALA 12 -9.039 -13.604 1.053
12 HB2 ALA 12 1HB ALA 12 -8.023 -14.119 -0.294
13 HB3 ALA 12 2HB ALA 12 -9.770 -14.346 -0.370
14 H CYS 13 H CYS 13 -9.023 -10.187 0.696
15 HA CYS 13 HA CYS 13 -6.126 -9.845 0.277
16 HB2 CYS 13 2HB CYS 13 -7.438 -8.115 -0.863
17 HB3 CYS 13 1HB CYS 13 -8.231 -7.704 0.652
18 H THR 14 H THR 14 -4.916 -8.913 2.010
19 HA THR 14 HA THR 14 -6.107 -9.483 4.635
20 HB THR 14 HB THR 14 -4.156 -10.823 4.202
21 HG1 THR 14 1HG THR 14 -3.400 -8.687 5.903
22 HG21 THR 14 3HG2 THR 14 -3.134 -8.453 2.952
23 HG22 THR 14 1HG2 THR 14 -2.549 -10.114 2.865
24 HG23 THR 14 2HG2 THR 14 -2.004 -9.054 4.166
25 H LEU 15 H LEU 15 -6.753 -7.768 5.738
26 HA LEU 15 HA LEU 15 -6.157 -5.110 5.077
27 HB2 LEU 15 2HB LEU 15 -7.021 -4.674 7.470
28 HB3 LEU 15 1HB LEU 15 -8.116 -5.360 6.287
29 HG LEU 15 HG LEU 15 -6.664 -7.356 7.882
30 HD11 LEU 15 1HD1 LEU 15 -7.475 -6.915 9.954
31 HD12 LEU 15 2HD1 LEU 15 -8.893 -6.064 9.342
32 HD13 LEU 15 3HD1 LEU 15 -7.327 -5.256 9.377
33 HD21 LEU 15 3HD2 LEU 15 -8.318 -8.413 6.786
34 HD22 LEU 15 1HD2 LEU 15 -9.285 -6.948 6.620
35 HD23 LEU 15 2HD2 LEU 15 -9.317 -7.857 8.129
36 HA PRO 16 HA PRO 16 -2.305 -3.969 6.863
37 HB2 PRO 16 2HB PRO 16 -3.115 -1.985 8.680
38 HB3 PRO 16 1HB PRO 16 -2.662 -1.735 6.993
39 HG2 PRO 16 2HG PRO 16 -5.368 -1.993 8.213
40 HG3 PRO 16 1HG PRO 16 -4.836 -0.986 6.854
41 HD2 PRO 16 2HD PRO 16 -6.250 -3.217 6.448
42 HD3 PRO 16 1HD PRO 16 -4.937 -2.754 5.345
43 H ASN 17 H ASN 17 -4.975 -4.706 8.993
44 HA ASN 17 HA ASN 17 -3.252 -5.133 11.287
45 HB2 ASN 17 2HB ASN 17 -5.786 -4.312 11.172
46 HB3 ASN 17 1HB ASN 17 -6.088 -6.043 11.284
47 HD21 ASN 17 1HD2 ASN 17 -6.483 -3.725 13.153
48 HD22 ASN 17 2HD2 ASN 17 -5.744 -4.233 14.631
49 H ASN 18 H ASN 18 -4.301 -6.925 8.608
50 HA ASN 18 HA ASN 18 -3.995 -9.084 7.981
51 HB2 ASN 18 2HB ASN 18 -2.103 -8.742 10.200
52 HB3 ASN 18 1HB ASN 18 -2.602 -10.410 9.942
53 HD21 ASN 18 1HD2 ASN 18 -0.671 -11.119 9.155
54 HD22 ASN 18 2HD2 ASN 18 -0.020 -10.619 7.636
55 H ASP 19 H ASP 19 -6.235 -9.467 8.214
56 HA ASP 19 HA ASP 19 -6.834 -11.459 10.240
57 HB2 ASP 19 2HB ASP 19 -8.448 -8.918 9.952
58 HB3 ASP 19 1HB ASP 19 -8.975 -10.332 10.859
59 H LYS 20 H LYS 20 -6.560 -11.178 7.251
60 HA LYS 20 HA LYS 20 -7.496 -12.091 5.392
61 HB2 LYS 20 2HB LYS 20 -9.571 -13.364 7.164
62 HB3 LYS 20 1HB LYS 20 -8.936 -13.952 5.633
63 HG2 LYS 20 2HG LYS 20 -7.343 -13.741 8.179
64 HG3 LYS 20 1HG LYS 20 -8.116 -15.212 7.587
65 HD2 LYS 20 2HD LYS 20 -6.136 -15.592 6.594
66 HD3 LYS 20 1HD LYS 20 -6.707 -14.428 5.397
67 HE2 LYS 20 2HE LYS 20 -5.616 -12.917 7.497
68 HE3 LYS 20 1HE LYS 20 -4.486 -14.240 7.209
69 HZ1 LYS 20 3HZ LYS 20 -5.487 -12.303 5.193
70 HZ2 LYS 20 1HZ LYS 20 -4.495 -13.629 4.841
71 HZ3 LYS 20 2HZ LYS 20 -3.921 -12.380 5.826
72 H GLY 21 H GLY 21 -8.832 -11.301 3.865
73 HA2 GLY 21 2HA GLY 21 -11.460 -10.288 4.564
74 HA3 GLY 21 1HA GLY 21 -10.303 -9.066 4.061
75 H THR 22 H THR 22 -11.756 -8.612 2.313
76 HA THR 22 HA THR 22 -11.426 -10.491 0.071
77 HB THR 22 HB THR 22 -13.879 -8.798 0.583
78 HG1 THR 22 1HG THR 22 -13.436 -11.566 0.996
79 HG21 THR 22 3HG2 THR 22 -13.556 -9.278 -1.774
80 HG22 THR 22 1HG2 THR 22 -14.931 -10.172 -1.129
81 HG23 THR 22 2HG2 THR 22 -13.399 -10.997 -1.413
82 H CYS 23 H CYS 23 -11.094 -9.556 -1.972
83 HA CYS 23 HA CYS 23 -10.547 -6.659 -1.906
84 HB2 CYS 23 2HB CYS 23 -8.658 -8.555 -2.242
85 HB3 CYS 23 1HB CYS 23 -9.139 -8.312 -3.918
86 H LYS 24 H LYS 24 -11.686 -5.454 -3.233
87 HA LYS 24 HA LYS 24 -12.561 -6.503 -5.807
88 HB2 LYS 24 2HB LYS 24 -14.868 -5.481 -5.352
89 HB3 LYS 24 1HB LYS 24 -14.504 -7.025 -4.591
90 HG2 LYS 24 2HG LYS 24 -14.160 -6.007 -2.481
91 HG3 LYS 24 1HG LYS 24 -14.169 -4.390 -3.187
92 HD2 LYS 24 2HD LYS 24 -16.308 -4.450 -2.402
93 HD3 LYS 24 1HD LYS 24 -16.577 -5.173 -3.989
94 HE2 LYS 24 2HE LYS 24 -17.708 -6.537 -2.411
95 HE3 LYS 24 1HE LYS 24 -16.262 -7.416 -2.906
96 HZ1 LYS 24 3HZ LYS 24 -16.902 -6.190 -0.329
97 HZ2 LYS 24 1HZ LYS 24 -15.280 -6.194 -0.814
98 HZ3 LYS 24 2HZ LYS 24 -16.123 -7.653 -0.665
99 H SER 25 H SER 25 -13.594 -4.692 -7.129
100 HA SER 25 HA SER 25 -11.810 -2.540 -7.303
101 HB2 SER 25 2HB SER 25 -14.623 -2.706 -8.414
102 HB3 SER 25 1HB SER 25 -13.357 -1.607 -8.956
103 HG SER 25 HG SER 25 -12.699 -3.144 -10.207
104 H LEU 26 H LEU 26 -12.723 -0.178 -7.376
105 HA LEU 26 HA LEU 26 -13.789 0.335 -4.708
106 HB2 LEU 26 2HB LEU 26 -13.116 2.682 -5.153
107 HB3 LEU 26 1HB LEU 26 -11.792 1.536 -5.224
108 HG LEU 26 HG LEU 26 -12.755 1.751 -7.860
109 HD11 LEU 26 1HD1 LEU 26 -12.442 4.204 -8.233
110 HD12 LEU 26 2HD1 LEU 26 -12.550 4.421 -6.486
111 HD13 LEU 26 3HD1 LEU 26 -13.923 3.769 -7.380
112 HD21 LEU 26 3HD2 LEU 26 -10.319 2.675 -6.385
113 HD22 LEU 26 1HD2 LEU 26 -10.524 3.022 -8.101
114 HD23 LEU 26 2HD2 LEU 26 -10.490 1.351 -7.536
115 H LEU 27 H LEU 27 -15.513 -0.620 -6.881
116 HA LEU 27 HA LEU 27 -17.458 1.575 -6.816
117 HB2 LEU 27 2HB LEU 27 -16.841 -0.135 -9.227
118 HB3 LEU 27 1HB LEU 27 -18.149 1.027 -9.119
119 HG LEU 27 HG LEU 27 -15.205 1.689 -8.988
120 HD11 LEU 27 1HD1 LEU 27 -17.183 1.586 -11.186
121 HD12 LEU 27 2HD1 LEU 27 -15.443 1.305 -11.209
122 HD13 LEU 27 3HD1 LEU 27 -16.070 2.952 -11.164
123 HD21 LEU 27 3HD2 LEU 27 -16.007 3.473 -7.869
124 HD22 LEU 27 1HD2 LEU 27 -17.656 3.227 -8.444
125 HD23 LEU 27 2HD2 LEU 27 -16.470 4.019 -9.481
126 H GLN 28 H GLN 28 -17.073 -0.953 -5.295
127 HA GLN 28 HA GLN 28 -19.725 -2.101 -5.831
128 HB2 GLN 28 2HB GLN 28 -17.204 -3.625 -5.155
129 HB3 GLN 28 1HB GLN 28 -18.815 -4.327 -5.155
130 HG2 GLN 28 2HG GLN 28 -19.038 -3.891 -7.524
131 HG3 GLN 28 1HG GLN 28 -17.467 -3.094 -7.546
132 HE21 GLN 28 1HE2 GLN 28 -18.750 -6.142 -6.248
133 HE22 GLN 28 2HE2 GLN 28 -17.531 -7.148 -6.945
134 H CYS 29 H CYS 29 -17.073 -1.970 -3.454
135 HA CYS 29 HA CYS 29 -18.596 -2.655 -1.209
136 HB2 CYS 29 2HB CYS 29 -15.938 -1.994 -1.709
137 HB3 CYS 29 1HB CYS 29 -16.485 -0.745 -0.598
138 H ASP 30 H ASP 30 -20.298 -1.634 -0.403
139 HA ASP 30 HA ASP 30 -21.170 0.906 -1.115
140 HB2 ASP 30 2HB ASP 30 -21.842 -1.019 1.048
141 HB3 ASP 30 1HB ASP 30 -22.396 0.640 1.251
142 H VAL 31 H VAL 31 -18.980 -0.092 1.422
143 HA VAL 31 HA VAL 31 -19.014 2.346 2.879
144 HB VAL 31 HB VAL 31 -16.925 1.538 3.917
145 HG11 VAL 31 1HG1 VAL 31 -18.022 0.067 5.239
146 HG12 VAL 31 2HG1 VAL 31 -18.588 -0.902 3.878
147 HG13 VAL 31 3HG1 VAL 31 -19.412 0.601 4.294
148 HG21 VAL 31 3HG2 VAL 31 -17.021 -0.331 1.622
149 HG22 VAL 31 1HG2 VAL 31 -16.467 -0.981 3.164
150 HG23 VAL 31 2HG2 VAL 31 -15.637 0.395 2.438
151 H ALA 32 H ALA 32 -17.038 1.106 0.242
152 HA ALA 32 HA ALA 32 -15.115 3.172 0.244
153 HB1 ALA 32 3HB ALA 32 -16.002 1.154 -1.778
154 HB2 ALA 32 1HB ALA 32 -14.457 1.293 -0.938
155 HB3 ALA 32 2HB ALA 32 -14.865 2.427 -2.226
156 H SER 33 H SER 33 -18.251 2.831 -1.307
157 HA SER 33 HA SER 33 -18.048 5.084 -3.000
158 HB2 SER 33 2HB SER 33 -19.703 3.343 -3.411
159 HB3 SER 33 1HB SER 33 -20.498 3.707 -1.879
160 HG SER 33 HG SER 33 -21.591 4.742 -3.544
161 H LYS 34 H LYS 34 -19.184 4.682 0.311
162 HA LYS 34 HA LYS 34 -20.291 7.283 0.550
163 HB2 LYS 34 2HB LYS 34 -20.462 6.844 2.897
164 HB3 LYS 34 1HB LYS 34 -20.849 5.359 2.041
165 HG2 LYS 34 2HG LYS 34 -19.077 4.257 2.874
166 HG3 LYS 34 1HG LYS 34 -18.031 5.675 2.842
167 HD2 LYS 34 2HD LYS 34 -19.609 6.497 4.766
168 HD3 LYS 34 1HD LYS 34 -19.953 4.775 4.936
169 HE2 LYS 34 2HE LYS 34 -18.172 4.888 6.334
170 HE3 LYS 34 1HE LYS 34 -17.294 4.650 4.825
171 HZ1 LYS 34 3HZ LYS 34 -17.293 7.198 4.726
172 HZ2 LYS 34 1HZ LYS 34 -16.228 6.439 5.801
173 HZ3 LYS 34 2HZ LYS 34 -17.661 7.132 6.374
174 H ILE 35 H ILE 35 -17.082 5.970 1.002
175 HA ILE 35 HA ILE 35 -15.990 8.196 2.387
176 HB ILE 35 HB ILE 35 -14.525 6.197 0.660
177 HG12 ILE 35 2HG1 ILE 35 -14.625 5.989 3.632
178 HG13 ILE 35 1HG1 ILE 35 -16.045 5.474 2.727
179 HG21 ILE 35 1HG2 ILE 35 -13.564 7.993 2.886
180 HG22 ILE 35 2HG2 ILE 35 -13.192 8.161 1.169
181 HG23 ILE 35 3HG2 ILE 35 -12.594 6.767 2.069
182 HD11 ILE 35 3HD1 ILE 35 -13.927 4.288 1.397
183 HD12 ILE 35 1HD1 ILE 35 -15.046 3.509 2.515
184 HD13 ILE 35 2HD1 ILE 35 -13.512 4.146 3.106
185 H ILE 36 H ILE 36 -16.242 7.340 -1.021
186 HA ILE 36 HA ILE 36 -14.614 9.433 -2.013
187 HB ILE 36 HB ILE 36 -16.868 7.991 -3.417
188 HG12 ILE 36 2HG1 ILE 36 -15.031 6.546 -2.459
189 HG13 ILE 36 1HG1 ILE 36 -15.245 6.424 -4.201
190 HG21 ILE 36 1HG2 ILE 36 -16.387 9.892 -4.700
191 HG22 ILE 36 2HG2 ILE 36 -15.457 8.597 -5.455
192 HG23 ILE 36 3HG2 ILE 36 -14.653 9.761 -4.403
193 HD11 ILE 36 3HD1 ILE 36 -12.867 6.569 -3.238
194 HD12 ILE 36 1HD1 ILE 36 -13.216 8.286 -3.039
195 HD13 ILE 36 2HD1 ILE 36 -13.272 7.555 -4.643
196 H SER 37 H SER 37 -18.013 9.209 -1.188
197 HA SER 37 HA SER 37 -18.738 11.706 -2.389
198 HB2 SER 37 2HB SER 37 -20.457 10.045 -2.126
199 HB3 SER 37 1HB SER 37 -20.153 9.930 -0.393
200 HG SER 37 HG SER 37 -21.075 12.258 -1.729
201 H LYS 38 H LYS 38 -17.497 10.698 0.696
202 HA LYS 38 HA LYS 38 -18.195 13.137 2.053
203 HB2 LYS 38 2HB LYS 38 -16.885 10.591 2.745
204 HB3 LYS 38 1HB LYS 38 -16.287 11.991 3.626
205 HG2 LYS 38 2HG LYS 38 -19.201 11.844 3.491
206 HG3 LYS 38 1HG LYS 38 -18.449 10.482 4.326
207 HD2 LYS 38 2HD LYS 38 -18.837 12.086 6.000
208 HD3 LYS 38 1HD LYS 38 -17.119 12.224 5.625
209 HE2 LYS 38 2HE LYS 38 -17.478 14.404 5.339
210 HE3 LYS 38 1HE LYS 38 -18.332 13.978 3.858
211 HZ1 LYS 38 3HZ LYS 38 -19.385 14.851 6.417
212 HZ2 LYS 38 1HZ LYS 38 -20.253 13.611 5.660
213 HZ3 LYS 38 2HZ LYS 38 -20.001 15.078 4.857
214 H LYS 39 H LYS 39 -15.267 11.726 0.672
215 HA LYS 39 HA LYS 39 -14.154 14.367 0.286
216 HB2 LYS 39 2HB LYS 39 -13.046 12.426 2.278
217 HB3 LYS 39 1HB LYS 39 -11.945 13.465 1.384
218 HG2 LYS 39 2HG LYS 39 -13.899 15.202 2.270
219 HG3 LYS 39 1HG LYS 39 -13.685 14.082 3.617
220 HD2 LYS 39 2HD LYS 39 -12.107 15.731 4.056
221 HD3 LYS 39 1HD LYS 39 -11.157 14.485 3.242
222 HE2 LYS 39 2HE LYS 39 -10.732 15.800 1.472
223 HE3 LYS 39 1HE LYS 39 -12.377 16.434 1.431
224 HZ1 LYS 39 3HZ LYS 39 -10.335 17.939 2.062
225 HZ2 LYS 39 1HZ LYS 39 -10.629 17.313 3.607
226 HZ3 LYS 39 2HZ LYS 39 -11.846 18.159 2.789
227 HA PRO 40 HA PRO 40 -13.317 11.480 -3.216
228 HB2 PRO 40 2HB PRO 40 -12.966 14.133 -4.510
229 HB3 PRO 40 1HB PRO 40 -13.883 12.723 -5.056
230 HG2 PRO 40 2HG PRO 40 -15.131 14.868 -4.088
231 HG3 PRO 40 1HG PRO 40 -15.713 13.232 -3.728
232 HD2 PRO 40 2HD PRO 40 -14.167 15.121 -2.000
233 HD3 PRO 40 1HD PRO 40 -15.479 14.007 -1.562
234 H ARG 41 H ARG 41 -11.330 10.687 -2.675
235 HA ARG 41 HA ARG 41 -9.071 10.457 -2.694
236 HB2 ARG 41 2HB ARG 41 -9.574 12.535 -4.737
237 HB3 ARG 41 1HB ARG 41 -7.926 12.435 -4.135
238 HG2 ARG 41 2HG ARG 41 -7.655 10.892 -5.722
239 HG3 ARG 41 1HG ARG 41 -8.494 9.815 -4.602
240 HD2 ARG 41 2HD ARG 41 -10.613 10.933 -5.786
241 HD3 ARG 41 1HD ARG 41 -9.448 11.085 -7.102
242 HE ARG 41 HE ARG 41 -9.441 8.460 -6.013
243 HH11 ARG 41 1HH1 ARG 41 -11.244 10.584 -8.114
244 HH12 ARG 41 2HH1 ARG 41 -11.931 9.290 -9.039
245 HH21 ARG 41 1HH2 ARG 41 -10.340 6.758 -7.230
246 HH22 ARG 41 2HH2 ARG 41 -11.416 7.119 -8.538
247 H THR 42 H THR 42 -7.625 10.887 -1.170
248 HA THR 42 HA THR 42 -7.016 13.565 -0.321
249 HB THR 42 HB THR 42 -7.533 12.559 2.161
250 HG1 THR 42 1HG THR 42 -9.283 11.346 2.157
251 HG21 THR 42 3HG2 THR 42 -9.007 14.383 0.367
252 HG22 THR 42 1HG2 THR 42 -8.330 14.661 1.971
253 HG23 THR 42 2HG2 THR 42 -9.857 13.797 1.797
254 H ALA 43 H ALA 43 -5.158 13.636 1.085
255 HA ALA 43 HA ALA 43 -3.173 11.800 0.459
256 HB1 ALA 43 3HB ALA 43 -2.097 12.797 2.648
257 HB2 ALA 43 1HB ALA 43 -3.448 13.924 2.527
258 HB3 ALA 43 2HB ALA 43 -2.296 13.783 1.199
259 H GLN 44 H GLN 44 -5.367 11.885 3.204
260 HA GLN 44 HA GLN 44 -4.118 9.676 4.535
261 HB2 GLN 44 2HB GLN 44 -6.494 11.386 4.977
262 HB3 GLN 44 1HB GLN 44 -6.596 9.756 5.630
263 HG2 GLN 44 2HG GLN 44 -4.234 10.333 6.604
264 HG3 GLN 44 1HG GLN 44 -4.787 11.993 6.382
265 HE21 GLN 44 1HE2 GLN 44 -4.695 12.233 8.662
266 HE22 GLN 44 2HE2 GLN 44 -5.960 11.618 9.666
267 H ASP 45 H ASP 45 -6.801 10.138 2.335
268 HA ASP 45 HA ASP 45 -7.809 7.491 2.500
269 HB2 ASP 45 2HB ASP 45 -9.160 9.399 1.699
270 HB3 ASP 45 1HB ASP 45 -8.128 9.515 0.275
271 H GLU 46 H GLU 46 -5.446 9.076 0.413
272 HA GLU 46 HA GLU 46 -5.210 6.877 -1.379
273 HB2 GLU 46 2HB GLU 46 -3.089 8.014 -2.103
274 HB3 GLU 46 1HB GLU 46 -4.536 9.007 -2.201
275 HG2 GLU 46 2HG GLU 46 -3.401 10.553 -1.100
276 HG3 GLU 46 1HG GLU 46 -3.566 9.527 0.320
277 H LYS 47 H LYS 47 -3.453 7.890 1.512
278 HA LYS 47 HA LYS 47 -1.468 5.861 1.320
279 HB2 LYS 47 2HB LYS 47 -0.868 6.460 3.586
280 HB3 LYS 47 1HB LYS 47 -1.183 7.925 2.664
281 HG2 LYS 47 2HG LYS 47 -3.325 8.187 3.699
282 HG3 LYS 47 1HG LYS 47 -3.178 6.624 4.503
283 HD2 LYS 47 2HD LYS 47 -2.698 8.462 6.043
284 HD3 LYS 47 1HD LYS 47 -1.275 7.452 5.788
285 HE2 LYS 47 2HE LYS 47 -0.487 9.100 4.098
286 HE3 LYS 47 1HE LYS 47 -1.850 10.130 4.529
287 HZ1 LYS 47 3HZ LYS 47 -0.243 10.984 5.874
288 HZ2 LYS 47 1HZ LYS 47 0.568 9.511 6.059
289 HZ3 LYS 47 2HZ LYS 47 -0.859 9.804 6.917
290 H PHE 48 H PHE 48 -4.613 6.077 2.869
291 HA PHE 48 HA PHE 48 -4.407 3.635 4.301
292 HB2 PHE 48 2HB PHE 48 -6.001 5.499 4.837
293 HB3 PHE 48 1HB PHE 48 -6.936 5.032 3.422
294 HD1 PHE 48 2HD PHE 48 -7.691 2.535 3.342
295 HD2 PHE 48 1HD PHE 48 -6.521 4.584 6.885
296 HE1 PHE 48 2HE PHE 48 -8.921 0.889 4.696
297 HE2 PHE 48 1HE PHE 48 -7.748 2.940 8.244
298 HZ PHE 48 HZ PHE 48 -8.951 1.091 7.149
299 H LEU 49 H LEU 49 -5.755 4.486 1.145
300 HA LEU 49 HA LEU 49 -6.810 1.888 0.653
301 HB2 LEU 49 2HB LEU 49 -7.069 2.622 -1.667
302 HB3 LEU 49 1HB LEU 49 -7.701 3.799 -0.533
303 HG LEU 49 HG LEU 49 -5.468 5.020 -0.818
304 HD11 LEU 49 1HD1 LEU 49 -5.068 2.770 -2.577
305 HD12 LEU 49 2HD1 LEU 49 -3.921 3.997 -2.041
306 HD13 LEU 49 3HD1 LEU 49 -4.932 4.295 -3.453
307 HD21 LEU 49 3HD2 LEU 49 -6.281 5.866 -3.144
308 HD22 LEU 49 1HD2 LEU 49 -7.286 6.116 -1.717
309 HD23 LEU 49 2HD2 LEU 49 -7.655 4.806 -2.838
310 H ARG 50 H ARG 50 -3.718 3.432 0.096
311 HA ARG 50 HA ARG 50 -2.652 1.527 -1.690
312 HB2 ARG 50 2HB ARG 50 -1.780 3.903 -0.652
313 HB3 ARG 50 1HB ARG 50 -0.743 2.754 0.181
314 HG2 ARG 50 2HG ARG 50 0.220 1.999 -1.798
315 HG3 ARG 50 1HG ARG 50 -1.089 2.643 -2.790
316 HD2 ARG 50 2HD ARG 50 -0.364 4.897 -2.379
317 HD3 ARG 50 1HD ARG 50 0.842 4.342 -1.218
318 HE ARG 50 HE ARG 50 1.170 3.237 -3.853
319 HH11 ARG 50 1HH1 ARG 50 1.924 5.926 -1.761
320 HH12 ARG 50 2HH1 ARG 50 3.340 6.381 -2.648
321 HH21 ARG 50 1HH2 ARG 50 3.030 3.836 -5.022
322 HH22 ARG 50 2HH2 ARG 50 3.967 5.196 -4.500
323 H GLU 51 H GLU 51 -2.795 1.702 1.818
324 HA GLU 51 HA GLU 51 -1.114 -0.564 2.264
325 HB2 GLU 51 2HB GLU 51 -2.770 1.247 3.910
326 HB3 GLU 51 1HB GLU 51 -2.544 -0.372 4.558
327 HG2 GLU 51 2HG GLU 51 -0.326 -0.069 4.928
328 HG3 GLU 51 1HG GLU 51 -0.139 1.053 3.579
329 H SER 52 H SER 52 -4.535 -0.067 1.768
330 HA SER 52 HA SER 52 -4.980 -2.957 2.134
331 HB2 SER 52 2HB SER 52 -7.116 -0.823 2.201
332 HB3 SER 52 1HB SER 52 -7.245 -2.501 2.727
333 HG SER 52 HG SER 52 -6.818 -0.628 4.314
334 H ALA 53 H ALA 53 -3.889 -2.153 -0.256
335 HA ALA 53 HA ALA 53 -6.160 -2.517 -2.098
336 HB1 ALA 53 3HB ALA 53 -5.592 -0.348 -2.616
337 HB2 ALA 53 1HB ALA 53 -4.598 -1.250 -3.759
338 HB3 ALA 53 2HB ALA 53 -3.878 -0.604 -2.285
339 H CYS 54 H CYS 54 -5.894 -3.960 -3.752
340 HA CYS 54 HA CYS 54 -3.593 -5.741 -3.517
341 HB2 CYS 54 2HB CYS 54 -6.169 -6.032 -5.075
342 HB3 CYS 54 1HB CYS 54 -4.907 -7.254 -4.977
343 H GLY 55 H GLY 55 -3.462 -3.050 -4.827
344 HA2 GLY 55 2HA GLY 55 -2.670 -3.945 -7.528
345 HA3 GLY 55 1HA GLY 55 -3.246 -2.325 -7.165
346 H PHE 56 H PHE 56 -0.694 -3.407 -8.333
347 HA PHE 56 HA PHE 56 1.206 -2.260 -6.401
348 HB2 PHE 56 2HB PHE 56 1.530 -4.265 -8.621
349 HB3 PHE 56 1HB PHE 56 2.916 -3.388 -7.983
350 HD1 PHE 56 1HD PHE 56 0.267 -5.807 -7.178
351 HD2 PHE 56 2HD PHE 56 3.846 -3.919 -5.862
352 HE1 PHE 56 1HE PHE 56 0.457 -7.449 -5.354
353 HE2 PHE 56 2HE PHE 56 4.044 -5.557 -4.036
354 HZ PHE 56 HZ PHE 56 2.348 -7.325 -3.782
355 H ASP 57 H ASP 57 -0.115 -1.982 -9.606
356 HA ASP 57 HA ASP 57 1.771 0.147 -10.294
357 HB2 ASP 57 2HB ASP 57 0.430 -1.851 -11.792
358 HB3 ASP 57 1HB ASP 57 -0.206 -0.299 -12.327
359 H GLY 58 H GLY 58 0.815 2.105 -11.384
360 HA2 GLY 58 2HA GLY 58 -1.343 3.112 -9.694
361 HA3 GLY 58 1HA GLY 58 -0.287 4.076 -10.715
362 H GLN 59 H GLN 59 -1.570 1.317 -12.249
363 HA GLN 59 HA GLN 59 -3.564 2.999 -13.616
364 HB2 GLN 59 2HB GLN 59 -1.441 1.344 -14.624
365 HB3 GLN 59 1HB GLN 59 -2.985 0.743 -15.211
366 HG2 GLN 59 2HG GLN 59 -3.286 2.486 -16.576
367 HG3 GLN 59 1HG GLN 59 -2.684 3.646 -15.391
368 HE21 GLN 59 1HE2 GLN 59 -2.085 3.813 -18.092
369 HE22 GLN 59 2HE2 GLN 59 -0.397 3.521 -18.312
370 H THR 60 H THR 60 -3.072 0.170 -11.752
371 HA THR 60 HA THR 60 -5.697 -0.911 -12.496
372 HB THR 60 HB THR 60 -3.456 -2.139 -10.878
373 HG1 THR 60 1HG THR 60 -4.330 -2.481 -13.543
374 HG21 THR 60 3HG2 THR 60 -5.479 -3.914 -11.994
375 HG22 THR 60 1HG2 THR 60 -6.079 -2.862 -10.712
376 HG23 THR 60 2HG2 THR 60 -4.703 -3.922 -10.410
377 HA PRO 61 HA PRO 61 -6.807 1.137 -8.568
378 HB2 PRO 61 2HB PRO 61 -9.383 1.587 -9.179
379 HB3 PRO 61 1HB PRO 61 -8.085 2.601 -9.819
380 HG2 PRO 61 2HG PRO 61 -9.556 0.351 -11.138
381 HG3 PRO 61 1HG PRO 61 -9.105 1.933 -11.802
382 HD2 PRO 61 2HD PRO 61 -7.694 -0.355 -12.280
383 HD3 PRO 61 1HD PRO 61 -6.962 1.262 -12.270
384 H LYS 62 H LYS 62 -6.911 -0.339 -6.976
385 HA LYS 62 HA LYS 62 -9.244 -2.110 -6.898
386 HB2 LYS 62 2HB LYS 62 -6.477 -2.945 -7.151
387 HB3 LYS 62 1HB LYS 62 -7.204 -3.586 -5.685
388 HG2 LYS 62 2HG LYS 62 -8.811 -4.788 -6.856
389 HG3 LYS 62 1HG LYS 62 -8.600 -3.827 -8.320
390 HD2 LYS 62 2HD LYS 62 -6.116 -4.834 -8.057
391 HD3 LYS 62 1HD LYS 62 -7.054 -6.136 -7.322
392 HE2 LYS 62 2HE LYS 62 -7.759 -4.957 -9.995
393 HE3 LYS 62 1HE LYS 62 -6.614 -6.287 -9.827
394 HZ1 LYS 62 3HZ LYS 62 -9.384 -6.372 -8.768
395 HZ2 LYS 62 1HZ LYS 62 -8.292 -7.660 -8.898
396 HZ3 LYS 62 2HZ LYS 62 -8.951 -6.964 -10.293
397 H VAL 63 H VAL 63 -9.628 -2.993 -4.681
398 HA VAL 63 HA VAL 63 -8.375 -1.525 -2.508
399 HB VAL 63 HB VAL 63 -11.366 -1.357 -2.870
400 HG11 VAL 63 1HG1 VAL 63 -11.222 0.287 -1.056
401 HG12 VAL 63 2HG1 VAL 63 -9.486 -0.001 -0.940
402 HG13 VAL 63 3HG1 VAL 63 -10.622 -1.294 -0.555
403 HG21 VAL 63 3HG2 VAL 63 -10.399 -0.022 -4.599
404 HG22 VAL 63 1HG2 VAL 63 -9.227 0.676 -3.480
405 HG23 VAL 63 2HG2 VAL 63 -10.939 1.067 -3.321
406 H CYS 64 H CYS 64 -8.652 -2.470 -0.487
407 HA CYS 64 HA CYS 64 -9.702 -5.208 -0.568
408 HB2 CYS 64 2HB CYS 64 -7.870 -3.896 1.453
409 HB3 CYS 64 1HB CYS 64 -8.349 -5.589 1.449
410 H CYS 65 H CYS 65 -11.553 -5.681 0.401
411 HA CYS 65 HA CYS 65 -12.550 -3.874 2.504
412 HB2 CYS 65 2HB CYS 65 -13.867 -5.024 0.117
413 HB3 CYS 65 1HB CYS 65 -14.820 -5.042 1.597
414 HA PRO 66 HA PRO 66 -12.157 -7.692 4.873
415 HB2 PRO 66 2HB PRO 66 -12.951 -6.634 7.251
416 HB3 PRO 66 1HB PRO 66 -11.320 -6.435 6.600
417 HG2 PRO 66 2HG PRO 66 -13.638 -4.541 6.518
418 HG3 PRO 66 1HG PRO 66 -11.931 -4.205 6.863
419 HD2 PRO 66 2HD PRO 66 -13.033 -3.709 4.449
420 HD3 PRO 66 1HD PRO 66 -11.343 -4.224 4.629
Start of MODEL 6
1 H GLN 11 H GLN 11 -11.334 -12.411 -5.994
2 HA GLN 11 HA GLN 11 -9.976 -13.548 -4.479
3 HB2 GLN 11 2HB GLN 11 -9.301 -10.800 -5.388
4 HB3 GLN 11 1HB GLN 11 -8.181 -11.556 -4.263
5 HG2 GLN 11 2HG GLN 11 -9.024 -13.228 -6.530
6 HG3 GLN 11 1HG GLN 11 -8.052 -11.814 -6.938
7 HE21 GLN 11 1HE2 GLN 11 -6.003 -11.569 -5.801
8 HE22 GLN 11 2HE2 GLN 11 -5.123 -12.985 -5.347
9 H ALA 12 H ALA 12 -8.780 -13.588 -2.490
10 HA ALA 12 HA ALA 12 -10.095 -12.042 -0.357
11 HB1 ALA 12 3HB ALA 12 -9.180 -13.933 1.113
12 HB2 ALA 12 1HB ALA 12 -8.914 -14.798 -0.401
13 HB3 ALA 12 2HB ALA 12 -10.543 -14.296 0.055
14 H CYS 13 H CYS 13 -8.918 -10.481 0.528
15 HA CYS 13 HA CYS 13 -5.988 -10.808 0.588
16 HB2 CYS 13 2HB CYS 13 -5.716 -8.443 0.295
17 HB3 CYS 13 1HB CYS 13 -6.799 -9.018 -0.968
18 H THR 14 H THR 14 -4.927 -9.480 2.326
19 HA THR 14 HA THR 14 -6.472 -9.777 4.804
20 HB THR 14 HB THR 14 -4.373 -11.059 4.643
21 HG1 THR 14 1HG THR 14 -5.104 -10.182 6.676
22 HG21 THR 14 3HG2 THR 14 -2.239 -10.077 4.562
23 HG22 THR 14 1HG2 THR 14 -2.898 -8.448 4.714
24 HG23 THR 14 2HG2 THR 14 -3.153 -9.366 3.231
25 H LEU 15 H LEU 15 -7.312 -7.988 5.615
26 HA LEU 15 HA LEU 15 -6.733 -5.387 4.765
27 HB2 LEU 15 2HB LEU 15 -7.876 -4.768 7.007
28 HB3 LEU 15 1HB LEU 15 -8.806 -5.590 5.770
29 HG LEU 15 HG LEU 15 -7.495 -7.383 7.702
30 HD11 LEU 15 1HD1 LEU 15 -9.276 -5.193 8.579
31 HD12 LEU 15 2HD1 LEU 15 -8.032 -6.073 9.467
32 HD13 LEU 15 3HD1 LEU 15 -9.618 -6.802 9.216
33 HD21 LEU 15 3HD2 LEU 15 -10.406 -7.400 7.237
34 HD22 LEU 15 1HD2 LEU 15 -9.242 -8.724 7.215
35 HD23 LEU 15 2HD2 LEU 15 -9.395 -7.662 5.817
36 HA PRO 16 HA PRO 16 -3.172 -3.876 6.856
37 HB2 PRO 16 2HB PRO 16 -4.253 -1.771 8.363
38 HB3 PRO 16 1HB PRO 16 -3.642 -1.664 6.710
39 HG2 PRO 16 2HG PRO 16 -6.444 -1.952 7.680
40 HG3 PRO 16 1HG PRO 16 -5.822 -1.043 6.291
41 HD2 PRO 16 2HD PRO 16 -7.083 -3.376 5.963
42 HD3 PRO 16 1HD PRO 16 -5.686 -2.942 4.955
43 H ASN 17 H ASN 17 -6.032 -4.559 8.739
44 HA ASN 17 HA ASN 17 -4.569 -4.665 11.241
45 HB2 ASN 17 2HB ASN 17 -7.226 -4.209 10.580
46 HB3 ASN 17 1HB ASN 17 -7.244 -5.823 11.280
47 HD21 ASN 17 1HD2 ASN 17 -7.405 -5.945 13.396
48 HD22 ASN 17 2HD2 ASN 17 -7.032 -4.685 14.517
49 H ASN 18 H ASN 18 -5.123 -6.745 8.647
50 HA ASN 18 HA ASN 18 -4.665 -8.937 8.283
51 HB2 ASN 18 2HB ASN 18 -3.146 -8.339 10.760
52 HB3 ASN 18 1HB ASN 18 -3.416 -10.041 10.399
53 HD21 ASN 18 1HD2 ASN 18 -0.902 -8.806 10.450
54 HD22 ASN 18 2HD2 ASN 18 -0.242 -8.854 8.855
55 H ASP 19 H ASP 19 -6.920 -9.388 8.316
56 HA ASP 19 HA ASP 19 -7.636 -11.299 10.366
57 HB2 ASP 19 2HB ASP 19 -9.141 -8.715 9.984
58 HB3 ASP 19 1HB ASP 19 -9.901 -10.144 10.681
59 H LYS 20 H LYS 20 -7.161 -11.124 7.409
60 HA LYS 20 HA LYS 20 -7.964 -12.096 5.517
61 HB2 LYS 20 2HB LYS 20 -10.062 -13.297 7.332
62 HB3 LYS 20 1HB LYS 20 -9.615 -13.866 5.730
63 HG2 LYS 20 2HG LYS 20 -7.718 -14.873 6.463
64 HG3 LYS 20 1HG LYS 20 -7.462 -13.699 7.755
65 HD2 LYS 20 2HD LYS 20 -9.726 -15.673 7.828
66 HD3 LYS 20 1HD LYS 20 -8.117 -16.077 8.432
67 HE2 LYS 20 2HE LYS 20 -9.592 -13.628 9.351
68 HE3 LYS 20 1HE LYS 20 -9.831 -15.198 10.115
69 HZ1 LYS 20 3HZ LYS 20 -8.017 -13.497 10.949
70 HZ2 LYS 20 1HZ LYS 20 -7.081 -14.279 9.776
71 HZ3 LYS 20 2HZ LYS 20 -7.777 -15.168 11.035
72 H GLY 21 H GLY 21 -9.300 -11.515 3.857
73 HA2 GLY 21 2HA GLY 21 -11.929 -10.458 4.298
74 HA3 GLY 21 1HA GLY 21 -10.757 -9.199 3.943
75 H THR 22 H THR 22 -11.898 -8.698 2.029
76 HA THR 22 HA THR 22 -11.338 -10.572 -0.166
77 HB THR 22 HB THR 22 -13.783 -8.822 -0.171
78 HG1 THR 22 1HG THR 22 -14.935 -10.395 0.801
79 HG21 THR 22 3HG2 THR 22 -13.207 -9.810 -2.296
80 HG22 THR 22 1HG2 THR 22 -14.671 -10.554 -1.655
81 HG23 THR 22 2HG2 THR 22 -13.132 -11.411 -1.558
82 H CYS 23 H CYS 23 -10.766 -9.640 -2.144
83 HA CYS 23 HA CYS 23 -10.204 -6.749 -2.022
84 HB2 CYS 23 2HB CYS 23 -8.330 -8.716 -2.159
85 HB3 CYS 23 1HB CYS 23 -8.583 -8.380 -3.870
86 H LYS 24 H LYS 24 -11.216 -5.554 -3.464
87 HA LYS 24 HA LYS 24 -11.794 -6.621 -6.118
88 HB2 LYS 24 2HB LYS 24 -14.129 -5.684 -5.978
89 HB3 LYS 24 1HB LYS 24 -13.842 -7.120 -5.002
90 HG2 LYS 24 2HG LYS 24 -13.721 -5.828 -3.003
91 HG3 LYS 24 1HG LYS 24 -13.743 -4.317 -3.914
92 HD2 LYS 24 2HD LYS 24 -15.948 -4.352 -3.469
93 HD3 LYS 24 1HD LYS 24 -16.017 -5.498 -4.810
94 HE2 LYS 24 2HE LYS 24 -15.985 -7.358 -3.323
95 HE3 LYS 24 1HE LYS 24 -15.612 -6.325 -1.943
96 HZ1 LYS 24 3HZ LYS 24 -18.149 -6.373 -3.485
97 HZ2 LYS 24 1HZ LYS 24 -17.797 -5.263 -2.256
98 HZ3 LYS 24 2HZ LYS 24 -17.921 -6.910 -1.897
99 H SER 25 H SER 25 -12.699 -4.821 -7.551
100 HA SER 25 HA SER 25 -10.892 -2.687 -7.598
101 HB2 SER 25 2HB SER 25 -13.587 -2.918 -8.959
102 HB3 SER 25 1HB SER 25 -12.334 -1.748 -9.373
103 HG SER 25 HG SER 25 -10.968 -3.552 -9.855
104 H LEU 26 H LEU 26 -11.871 -0.326 -7.874
105 HA LEU 26 HA LEU 26 -13.108 0.278 -5.293
106 HB2 LEU 26 2HB LEU 26 -12.316 2.535 -5.613
107 HB3 LEU 26 1HB LEU 26 -11.003 1.404 -5.870
108 HG LEU 26 HG LEU 26 -12.128 1.835 -8.409
109 HD11 LEU 26 1HD1 LEU 26 -11.912 4.366 -6.802
110 HD12 LEU 26 2HD1 LEU 26 -13.280 3.787 -7.752
111 HD13 LEU 26 3HD1 LEU 26 -11.813 4.335 -8.562
112 HD21 LEU 26 3HD2 LEU 26 -9.680 3.215 -7.356
113 HD22 LEU 26 1HD2 LEU 26 -9.981 2.580 -8.973
114 HD23 LEU 26 2HD2 LEU 26 -9.722 1.473 -7.626
115 H LEU 27 H LEU 27 -14.660 -0.758 -7.557
116 HA LEU 27 HA LEU 27 -16.624 1.413 -7.683
117 HB2 LEU 27 2HB LEU 27 -15.775 -0.240 -10.063
118 HB3 LEU 27 1HB LEU 27 -17.073 0.939 -10.048
119 HG LEU 27 HG LEU 27 -14.365 1.884 -9.266
120 HD11 LEU 27 1HD1 LEU 27 -14.079 2.329 -11.822
121 HD12 LEU 27 2HD1 LEU 27 -15.116 0.912 -11.984
122 HD13 LEU 27 3HD1 LEU 27 -13.581 0.787 -11.128
123 HD21 LEU 27 3HD2 LEU 27 -15.182 3.917 -9.820
124 HD22 LEU 27 1HD2 LEU 27 -16.731 3.115 -9.559
125 HD23 LEU 27 2HD2 LEU 27 -16.097 3.297 -11.194
126 H GLN 28 H GLN 28 -16.519 -0.938 -6.045
127 HA GLN 28 HA GLN 28 -19.037 -2.160 -6.888
128 HB2 GLN 28 2HB GLN 28 -16.585 -3.725 -6.068
129 HB3 GLN 28 1HB GLN 28 -18.193 -4.413 -6.246
130 HG2 GLN 28 2HG GLN 28 -18.199 -3.883 -8.602
131 HG3 GLN 28 1HG GLN 28 -16.637 -3.080 -8.450
132 HE21 GLN 28 1HE2 GLN 28 -17.967 -5.724 -9.634
133 HE22 GLN 28 2HE2 GLN 28 -16.699 -6.874 -9.400
134 H CYS 29 H CYS 29 -16.589 -1.925 -4.326
135 HA CYS 29 HA CYS 29 -18.332 -2.728 -2.235
136 HB2 CYS 29 2HB CYS 29 -15.611 -2.256 -2.476
137 HB3 CYS 29 1HB CYS 29 -16.154 -0.976 -1.398
138 H ASP 30 H ASP 30 -20.040 -1.630 -1.548
139 HA ASP 30 HA ASP 30 -20.551 1.072 -2.151
140 HB2 ASP 30 2HB ASP 30 -22.012 -1.046 -1.116
141 HB3 ASP 30 1HB ASP 30 -21.948 0.096 0.223
142 H VAL 31 H VAL 31 -18.975 -0.495 0.538
143 HA VAL 31 HA VAL 31 -19.048 1.624 2.384
144 HB VAL 31 HB VAL 31 -18.420 -0.665 3.019
145 HG11 VAL 31 1HG1 VAL 31 -16.554 -1.770 2.292
146 HG12 VAL 31 2HG1 VAL 31 -15.669 -0.282 1.952
147 HG13 VAL 31 3HG1 VAL 31 -16.935 -0.826 0.851
148 HG21 VAL 31 3HG2 VAL 31 -16.363 -0.041 4.379
149 HG22 VAL 31 1HG2 VAL 31 -17.792 0.971 4.589
150 HG23 VAL 31 2HG2 VAL 31 -16.452 1.534 3.591
151 H ALA 32 H ALA 32 -16.815 0.839 -0.225
152 HA ALA 32 HA ALA 32 -14.844 2.753 0.387
153 HB1 ALA 32 3HB ALA 32 -14.572 2.538 -2.272
154 HB2 ALA 32 1HB ALA 32 -15.546 1.100 -1.957
155 HB3 ALA 32 2HB ALA 32 -13.998 1.314 -1.139
156 H SER 33 H SER 33 -17.820 2.936 -1.473
157 HA SER 33 HA SER 33 -17.372 5.482 -2.609
158 HB2 SER 33 2HB SER 33 -19.150 3.676 -3.206
159 HB3 SER 33 1HB SER 33 -20.123 4.467 -1.964
160 HG SER 33 HG SER 33 -20.337 6.187 -3.201
161 H LYS 34 H LYS 34 -18.970 4.456 0.372
162 HA LYS 34 HA LYS 34 -19.915 7.003 1.118
163 HB2 LYS 34 2HB LYS 34 -20.336 6.078 3.281
164 HB3 LYS 34 1HB LYS 34 -20.693 4.836 2.092
165 HG2 LYS 34 2HG LYS 34 -19.023 3.489 2.792
166 HG3 LYS 34 1HG LYS 34 -17.965 4.829 3.227
167 HD2 LYS 34 2HD LYS 34 -18.487 4.374 5.350
168 HD3 LYS 34 1HD LYS 34 -20.072 5.066 4.998
169 HE2 LYS 34 2HE LYS 34 -20.331 2.515 4.047
170 HE3 LYS 34 1HE LYS 34 -19.285 2.282 5.447
171 HZ1 LYS 34 3HZ LYS 34 -20.904 2.934 6.881
172 HZ2 LYS 34 1HZ LYS 34 -21.890 2.299 5.661
173 HZ3 LYS 34 2HZ LYS 34 -21.653 3.970 5.773
174 H ILE 35 H ILE 35 -16.814 5.437 1.502
175 HA ILE 35 HA ILE 35 -15.762 7.218 3.447
176 HB ILE 35 HB ILE 35 -14.255 5.575 1.408
177 HG12 ILE 35 2HG1 ILE 35 -14.550 4.758 4.261
178 HG13 ILE 35 1HG1 ILE 35 -15.923 4.510 3.189
179 HG21 ILE 35 1HG2 ILE 35 -12.564 6.850 2.188
180 HG22 ILE 35 2HG2 ILE 35 -12.625 5.723 3.543
181 HG23 ILE 35 3HG2 ILE 35 -13.429 7.287 3.661
182 HD11 ILE 35 3HD1 ILE 35 -13.693 3.546 1.807
183 HD12 ILE 35 1HD1 ILE 35 -14.991 2.612 2.551
184 HD13 ILE 35 2HD1 ILE 35 -13.528 2.972 3.466
185 H ILE 36 H ILE 36 -15.682 7.152 -0.081
186 HA ILE 36 HA ILE 36 -13.932 9.323 -0.454
187 HB ILE 36 HB ILE 36 -16.161 8.417 -2.278
188 HG12 ILE 36 2HG1 ILE 36 -14.497 6.648 -1.606
189 HG13 ILE 36 1HG1 ILE 36 -14.566 6.973 -3.334
190 HG21 ILE 36 1HG2 ILE 36 -14.624 9.386 -4.044
191 HG22 ILE 36 2HG2 ILE 36 -13.757 10.167 -2.723
192 HG23 ILE 36 3HG2 ILE 36 -15.456 10.546 -3.009
193 HD11 ILE 36 3HD1 ILE 36 -12.574 8.473 -3.014
194 HD12 ILE 36 1HD1 ILE 36 -12.289 6.750 -2.760
195 HD13 ILE 36 2HD1 ILE 36 -12.459 7.831 -1.375
196 H SER 37 H SER 37 -17.409 9.146 0.018
197 HA SER 37 HA SER 37 -17.895 11.905 -0.545
198 HB2 SER 37 2HB SER 37 -19.682 10.133 1.117
199 HB3 SER 37 1HB SER 37 -20.137 11.490 0.086
200 HG SER 37 HG SER 37 -20.190 9.012 -0.593
201 H LYS 38 H LYS 38 -17.031 10.067 2.286
202 HA LYS 38 HA LYS 38 -17.760 11.952 4.251
203 HB2 LYS 38 2HB LYS 38 -16.094 9.527 4.121
204 HB3 LYS 38 1HB LYS 38 -15.640 10.667 5.378
205 HG2 LYS 38 2HG LYS 38 -18.515 10.086 5.192
206 HG3 LYS 38 1HG LYS 38 -17.492 8.732 5.676
207 HD2 LYS 38 2HD LYS 38 -18.280 9.965 7.626
208 HD3 LYS 38 1HD LYS 38 -16.529 10.102 7.464
209 HE2 LYS 38 2HE LYS 38 -16.684 12.313 6.637
210 HE3 LYS 38 1HE LYS 38 -18.425 12.174 6.388
211 HZ1 LYS 38 3HZ LYS 38 -17.237 11.941 9.083
212 HZ2 LYS 38 1HZ LYS 38 -18.835 12.307 8.660
213 HZ3 LYS 38 2HZ LYS 38 -17.611 13.450 8.419
214 H LYS 39 H LYS 39 -14.746 11.420 2.488
215 HA LYS 39 HA LYS 39 -13.953 14.164 3.120
216 HB2 LYS 39 2HB LYS 39 -12.147 11.764 3.472
217 HB3 LYS 39 1HB LYS 39 -11.645 13.444 3.613
218 HG2 LYS 39 2HG LYS 39 -13.847 13.114 5.336
219 HG3 LYS 39 1HG LYS 39 -12.785 11.728 5.590
220 HD2 LYS 39 2HD LYS 39 -10.908 13.196 6.005
221 HD3 LYS 39 1HD LYS 39 -11.893 14.611 5.631
222 HE2 LYS 39 2HE LYS 39 -13.337 13.278 7.587
223 HE3 LYS 39 1HE LYS 39 -11.658 13.110 8.102
224 HZ1 LYS 39 3HZ LYS 39 -13.291 15.521 7.838
225 HZ2 LYS 39 1HZ LYS 39 -11.637 15.658 7.512
226 HZ3 LYS 39 2HZ LYS 39 -12.158 15.109 9.024
227 HA PRO 40 HA PRO 40 -13.632 13.010 -1.420
228 HB2 PRO 40 2HB PRO 40 -14.306 15.906 -1.516
229 HB3 PRO 40 1HB PRO 40 -14.938 14.571 -2.485
230 HG2 PRO 40 2HG PRO 40 -16.404 15.654 -0.544
231 HG3 PRO 40 1HG PRO 40 -16.427 13.905 -0.836
232 HD2 PRO 40 2HD PRO 40 -15.049 15.453 1.316
233 HD3 PRO 40 1HD PRO 40 -15.842 13.867 1.398
234 H ARG 41 H ARG 41 -11.570 12.908 -2.034
235 HA ARG 41 HA ARG 41 -9.419 13.474 -2.505
236 HB2 ARG 41 2HB ARG 41 -10.981 15.916 -2.945
237 HB3 ARG 41 1HB ARG 41 -9.281 16.222 -2.618
238 HG2 ARG 41 2HG ARG 41 -8.612 14.857 -4.464
239 HG3 ARG 41 1HG ARG 41 -10.273 14.320 -4.727
240 HD2 ARG 41 2HD ARG 41 -10.189 15.958 -6.300
241 HD3 ARG 41 1HD ARG 41 -10.677 16.938 -4.919
242 HE ARG 41 HE ARG 41 -8.696 18.043 -5.092
243 HH11 ARG 41 1HH1 ARG 41 -8.331 14.923 -6.613
244 HH12 ARG 41 2HH1 ARG 41 -6.723 15.243 -7.168
245 HH21 ARG 41 1HH2 ARG 41 -6.581 18.465 -5.821
246 HH22 ARG 41 2HH2 ARG 41 -5.728 17.253 -6.718
247 H THR 42 H THR 42 -8.075 13.025 -0.877
248 HA THR 42 HA THR 42 -7.273 15.106 0.921
249 HB THR 42 HB THR 42 -7.676 13.331 2.885
250 HG1 THR 42 1HG THR 42 -9.897 12.962 1.162
251 HG21 THR 42 3HG2 THR 42 -8.893 14.973 3.714
252 HG22 THR 42 1HG2 THR 42 -10.191 14.639 2.569
253 HG23 THR 42 2HG2 THR 42 -8.888 15.743 2.128
254 H ALA 43 H ALA 43 -5.211 14.815 1.598
255 HA ALA 43 HA ALA 43 -3.540 13.010 0.315
256 HB1 ALA 43 3HB ALA 43 -3.268 14.858 2.607
257 HB2 ALA 43 1HB ALA 43 -2.305 14.724 1.136
258 HB3 ALA 43 2HB ALA 43 -2.049 13.592 2.463
259 H GLN 44 H GLN 44 -5.298 12.704 3.317
260 HA GLN 44 HA GLN 44 -3.924 10.375 4.235
261 HB2 GLN 44 2HB GLN 44 -5.522 12.127 5.469
262 HB3 GLN 44 1HB GLN 44 -6.723 10.897 5.094
263 HG2 GLN 44 2HG GLN 44 -5.877 9.421 6.572
264 HG3 GLN 44 1HG GLN 44 -4.212 9.935 6.301
265 HE21 GLN 44 1HE2 GLN 44 -6.886 10.098 8.344
266 HE22 GLN 44 2HE2 GLN 44 -6.302 11.307 9.429
267 H ASP 45 H ASP 45 -6.654 10.968 2.151
268 HA ASP 45 HA ASP 45 -7.693 8.324 2.199
269 HB2 ASP 45 2HB ASP 45 -8.967 10.360 1.467
270 HB3 ASP 45 1HB ASP 45 -7.996 10.374 -0.002
271 H GLU 46 H GLU 46 -5.300 9.983 0.242
272 HA GLU 46 HA GLU 46 -5.048 7.981 -1.741
273 HB2 GLU 46 2HB GLU 46 -3.041 10.053 -0.840
274 HB3 GLU 46 1HB GLU 46 -2.934 9.109 -2.320
275 HG2 GLU 46 2HG GLU 46 -5.079 10.123 -3.052
276 HG3 GLU 46 1HG GLU 46 -5.024 11.156 -1.624
277 H LYS 47 H LYS 47 -3.281 8.612 1.260
278 HA LYS 47 HA LYS 47 -1.431 6.489 0.901
279 HB2 LYS 47 2HB LYS 47 -0.855 6.814 3.258
280 HB3 LYS 47 1HB LYS 47 -0.929 8.345 2.400
281 HG2 LYS 47 2HG LYS 47 -2.592 9.119 3.673
282 HG3 LYS 47 1HG LYS 47 -3.436 7.573 3.692
283 HD2 LYS 47 2HD LYS 47 -0.901 7.736 5.210
284 HD3 LYS 47 1HD LYS 47 -2.283 8.618 5.862
285 HE2 LYS 47 2HE LYS 47 -3.471 6.283 5.293
286 HE3 LYS 47 1HE LYS 47 -1.833 5.707 5.598
287 HZ1 LYS 47 3HZ LYS 47 -3.585 7.221 7.449
288 HZ2 LYS 47 1HZ LYS 47 -1.938 6.968 7.735
289 HZ3 LYS 47 2HZ LYS 47 -2.993 5.649 7.643
290 H PHE 48 H PHE 48 -4.573 6.739 2.444
291 HA PHE 48 HA PHE 48 -4.538 4.206 3.703
292 HB2 PHE 48 2HB PHE 48 -6.205 6.354 3.795
293 HB3 PHE 48 1HB PHE 48 -7.159 5.239 2.822
294 HD1 PHE 48 1HD PHE 48 -5.053 5.124 5.905
295 HD2 PHE 48 2HD PHE 48 -8.647 3.931 3.962
296 HE1 PHE 48 1HE PHE 48 -5.769 3.961 7.952
297 HE2 PHE 48 2HE PHE 48 -9.371 2.768 6.007
298 HZ PHE 48 HZ PHE 48 -7.931 2.783 8.006
299 H LEU 49 H LEU 49 -5.482 5.305 0.503
300 HA LEU 49 HA LEU 49 -6.769 2.926 -0.315
301 HB2 LEU 49 2HB LEU 49 -7.328 4.613 -1.730
302 HB3 LEU 49 1HB LEU 49 -5.763 5.389 -1.597
303 HG LEU 49 HG LEU 49 -4.810 3.786 -3.170
304 HD11 LEU 49 1HD1 LEU 49 -6.771 2.097 -2.434
305 HD12 LEU 49 2HD1 LEU 49 -5.838 1.927 -3.920
306 HD13 LEU 49 3HD1 LEU 49 -7.427 2.691 -3.958
307 HD21 LEU 49 3HD2 LEU 49 -5.826 4.625 -5.144
308 HD22 LEU 49 1HD2 LEU 49 -5.952 5.896 -3.927
309 HD23 LEU 49 2HD2 LEU 49 -7.358 4.905 -4.316
310 H ARG 50 H ARG 50 -3.439 4.058 -0.529
311 HA ARG 50 HA ARG 50 -2.470 1.916 -2.105
312 HB2 ARG 50 2HB ARG 50 -0.827 3.493 -0.135
313 HB3 ARG 50 1HB ARG 50 -0.292 2.731 -1.625
314 HG2 ARG 50 2HG ARG 50 -2.328 4.574 -2.301
315 HG3 ARG 50 1HG ARG 50 -1.210 5.388 -1.205
316 HD2 ARG 50 2HD ARG 50 0.664 4.745 -2.630
317 HD3 ARG 50 1HD ARG 50 -0.440 3.900 -3.714
318 HE ARG 50 HE ARG 50 -1.031 5.915 -4.631
319 HH11 ARG 50 1HH1 ARG 50 0.678 6.487 -1.643
320 HH12 ARG 50 2HH1 ARG 50 0.790 8.197 -1.888
321 HH21 ARG 50 1HH2 ARG 50 -0.883 8.164 -4.957
322 HH22 ARG 50 2HH2 ARG 50 -0.096 9.150 -3.770
323 H GLU 51 H GLU 51 -2.694 2.442 1.371
324 HA GLU 51 HA GLU 51 -1.296 0.057 2.081
325 HB2 GLU 51 2HB GLU 51 -3.169 1.784 3.708
326 HB3 GLU 51 1HB GLU 51 -2.148 0.507 4.359
327 HG2 GLU 51 2HG GLU 51 -1.058 2.882 2.876
328 HG3 GLU 51 1HG GLU 51 -1.292 2.856 4.623
329 H SER 52 H SER 52 -4.627 0.867 1.422
330 HA SER 52 HA SER 52 -5.512 -1.782 2.295
331 HB2 SER 52 2HB SER 52 -7.337 0.326 1.172
332 HB3 SER 52 1HB SER 52 -7.698 -0.951 2.334
333 HG SER 52 HG SER 52 -7.537 1.109 3.327
334 H ALA 53 H ALA 53 -3.832 -1.671 0.033
335 HA ALA 53 HA ALA 53 -5.695 -2.627 -2.035
336 HB1 ALA 53 3HB ALA 53 -4.741 -0.368 -2.578
337 HB2 ALA 53 1HB ALA 53 -4.425 -1.623 -3.776
338 HB3 ALA 53 2HB ALA 53 -3.154 -1.135 -2.654
339 H CYS 54 H CYS 54 -5.347 -4.684 -2.508
340 HA CYS 54 HA CYS 54 -2.968 -6.030 -1.599
341 HB2 CYS 54 2HB CYS 54 -4.058 -8.062 -2.466
342 HB3 CYS 54 1HB CYS 54 -5.140 -7.139 -1.429
343 H GLY 55 H GLY 55 -1.778 -4.412 -3.133
344 HA2 GLY 55 2HA GLY 55 -0.149 -5.439 -4.857
345 HA3 GLY 55 1HA GLY 55 -1.599 -5.539 -5.845
346 H PHE 56 H PHE 56 0.077 -4.204 -7.155
347 HA PHE 56 HA PHE 56 -0.702 -1.409 -6.843
348 HB2 PHE 56 2HB PHE 56 2.019 -2.457 -6.486
349 HB3 PHE 56 1HB PHE 56 1.911 -1.114 -7.619
350 HD1 PHE 56 2HD PHE 56 0.433 0.906 -6.752
351 HD2 PHE 56 1HD PHE 56 2.336 -1.977 -4.268
352 HE1 PHE 56 2HE PHE 56 0.366 2.491 -4.869
353 HE2 PHE 56 1HE PHE 56 2.273 -0.399 -2.380
354 HZ PHE 56 HZ PHE 56 1.288 1.838 -2.681
355 H ASP 57 H ASP 57 -1.875 -1.307 -8.681
356 HA ASP 57 HA ASP 57 -0.583 -2.156 -11.186
357 HB2 ASP 57 2HB ASP 57 -3.419 -2.088 -10.269
358 HB3 ASP 57 1HB ASP 57 -3.103 -1.796 -11.977
359 H GLY 58 H GLY 58 -1.322 -0.810 -13.128
360 HA2 GLY 58 2HA GLY 58 -1.184 2.042 -12.366
361 HA3 GLY 58 1HA GLY 58 -0.427 1.373 -13.803
362 H GLN 59 H GLN 59 -2.886 -0.328 -14.245
363 HA GLN 59 HA GLN 59 -4.578 1.808 -15.364
364 HB2 GLN 59 2HB GLN 59 -3.620 -0.780 -16.477
365 HB3 GLN 59 1HB GLN 59 -5.241 -0.260 -16.916
366 HG2 GLN 59 2HG GLN 59 -3.824 0.524 -18.614
367 HG3 GLN 59 1HG GLN 59 -4.221 1.931 -17.626
368 HE21 GLN 59 1HE2 GLN 59 -1.789 -0.652 -17.785
369 HE22 GLN 59 2HE2 GLN 59 -0.437 0.365 -17.441
370 H THR 60 H THR 60 -4.543 -1.348 -13.796
371 HA THR 60 HA THR 60 -7.441 -1.106 -13.337
372 HB THR 60 HB THR 60 -5.697 -3.571 -13.161
373 HG1 THR 60 1HG THR 60 -6.004 -2.804 -15.303
374 HG21 THR 60 3HG2 THR 60 -7.404 -4.688 -12.320
375 HG22 THR 60 1HG2 THR 60 -8.495 -4.061 -13.556
376 HG23 THR 60 2HG2 THR 60 -8.226 -3.147 -12.073
377 HA PRO 61 HA PRO 61 -5.701 -0.199 -9.189
378 HB2 PRO 61 2HB PRO 61 -7.824 1.274 -8.360
379 HB3 PRO 61 1HB PRO 61 -6.514 1.948 -9.336
380 HG2 PRO 61 2HG PRO 61 -9.221 1.000 -10.195
381 HG3 PRO 61 1HG PRO 61 -8.333 2.452 -10.695
382 HD2 PRO 61 2HD PRO 61 -8.438 0.213 -12.214
383 HD3 PRO 61 1HD PRO 61 -7.025 1.289 -12.196
384 H LYS 62 H LYS 62 -6.227 -1.054 -7.175
385 HA LYS 62 HA LYS 62 -8.730 -2.566 -6.959
386 HB2 LYS 62 2HB LYS 62 -6.566 -3.921 -7.656
387 HB3 LYS 62 1HB LYS 62 -6.235 -3.840 -5.933
388 HG2 LYS 62 2HG LYS 62 -7.356 -5.897 -6.418
389 HG3 LYS 62 1HG LYS 62 -8.447 -4.857 -5.503
390 HD2 LYS 62 2HD LYS 62 -9.803 -4.448 -7.332
391 HD3 LYS 62 1HD LYS 62 -8.525 -4.825 -8.490
392 HE2 LYS 62 2HE LYS 62 -8.692 -7.182 -7.947
393 HE3 LYS 62 1HE LYS 62 -9.900 -6.835 -6.710
394 HZ1 LYS 62 3HZ LYS 62 -10.226 -6.340 -9.621
395 HZ2 LYS 62 1HZ LYS 62 -11.389 -6.036 -8.429
396 HZ3 LYS 62 2HZ LYS 62 -10.912 -7.624 -8.760
397 H VAL 63 H VAL 63 -9.240 -3.210 -4.749
398 HA VAL 63 HA VAL 63 -7.833 -1.764 -2.638
399 HB VAL 63 HB VAL 63 -10.818 -1.474 -2.988
400 HG11 VAL 63 1HG1 VAL 63 -10.472 0.336 -1.283
401 HG12 VAL 63 2HG1 VAL 63 -8.830 -0.270 -1.075
402 HG13 VAL 63 3HG1 VAL 63 -10.207 -1.306 -0.697
403 HG21 VAL 63 3HG2 VAL 63 -10.418 0.808 -3.688
404 HG22 VAL 63 1HG2 VAL 63 -9.586 -0.302 -4.777
405 HG23 VAL 63 2HG2 VAL 63 -8.676 0.575 -3.548
406 H CYS 64 H CYS 64 -8.496 -2.448 -0.474
407 HA CYS 64 HA CYS 64 -9.375 -5.247 -0.500
408 HB2 CYS 64 2HB CYS 64 -7.530 -3.665 1.199
409 HB3 CYS 64 1HB CYS 64 -8.468 -4.913 2.011
410 H CYS 65 H CYS 65 -11.310 -5.771 0.215
411 HA CYS 65 HA CYS 65 -12.675 -3.967 2.100
412 HB2 CYS 65 2HB CYS 65 -13.503 -4.850 -0.546
413 HB3 CYS 65 1HB CYS 65 -14.690 -5.274 0.682
414 HA PRO 66 HA PRO 66 -12.716 -7.882 4.341
415 HB2 PRO 66 2HB PRO 66 -13.668 -6.897 6.672
416 HB3 PRO 66 1HB PRO 66 -11.987 -6.684 6.169
417 HG2 PRO 66 2HG PRO 66 -14.279 -4.767 5.974
418 HG3 PRO 66 1HG PRO 66 -12.608 -4.463 6.483
419 HD2 PRO 66 2HD PRO 66 -13.521 -3.876 3.994
420 HD3 PRO 66 1HD PRO 66 -11.839 -4.343 4.317
Start of MODEL 7
1 H GLN 11 H GLN 11 -12.392 -10.529 -4.746
2 HA GLN 11 HA GLN 11 -10.758 -12.978 -4.718
3 HB2 GLN 11 2HB GLN 11 -10.185 -10.063 -5.184
4 HB3 GLN 11 1HB GLN 11 -8.942 -11.132 -4.546
5 HG2 GLN 11 2HG GLN 11 -9.927 -12.516 -6.716
6 HG3 GLN 11 1HG GLN 11 -9.940 -10.837 -7.252
7 HE21 GLN 11 1HE2 GLN 11 -7.851 -13.155 -5.566
8 HE22 GLN 11 2HE2 GLN 11 -6.380 -12.627 -6.301
9 H ALA 12 H ALA 12 -9.408 -13.154 -2.838
10 HA ALA 12 HA ALA 12 -10.572 -11.828 -0.478
11 HB1 ALA 12 3HB ALA 12 -9.496 -14.593 -0.879
12 HB2 ALA 12 1HB ALA 12 -11.047 -14.086 -0.210
13 HB3 ALA 12 2HB ALA 12 -9.570 -13.874 0.730
14 H CYS 13 H CYS 13 -9.301 -10.361 0.429
15 HA CYS 13 HA CYS 13 -6.382 -10.766 0.308
16 HB2 CYS 13 2HB CYS 13 -6.170 -8.281 0.343
17 HB3 CYS 13 1HB CYS 13 -6.945 -8.900 -1.110
18 H THR 14 H THR 14 -5.205 -9.543 2.054
19 HA THR 14 HA THR 14 -6.681 -9.834 4.582
20 HB THR 14 HB THR 14 -4.835 -11.354 4.496
21 HG1 THR 14 1HG THR 14 -3.559 -10.539 6.222
22 HG21 THR 14 3HG2 THR 14 -2.531 -10.667 4.173
23 HG22 THR 14 1HG2 THR 14 -3.057 -9.016 3.851
24 HG23 THR 14 2HG2 THR 14 -3.503 -10.313 2.744
25 H LEU 15 H LEU 15 -7.285 -7.992 5.477
26 HA LEU 15 HA LEU 15 -6.452 -5.447 4.685
27 HB2 LEU 15 2HB LEU 15 -7.438 -4.764 6.965
28 HB3 LEU 15 1HB LEU 15 -8.499 -5.496 5.777
29 HG LEU 15 HG LEU 15 -7.254 -7.409 7.633
30 HD11 LEU 15 1HD1 LEU 15 -7.953 -5.124 8.861
31 HD12 LEU 15 2HD1 LEU 15 -8.115 -6.718 9.599
32 HD13 LEU 15 3HD1 LEU 15 -9.512 -5.950 8.845
33 HD21 LEU 15 3HD2 LEU 15 -9.300 -7.465 5.858
34 HD22 LEU 15 1HD2 LEU 15 -10.171 -7.190 7.367
35 HD23 LEU 15 2HD2 LEU 15 -9.116 -8.593 7.203
36 HA PRO 16 HA PRO 16 -2.649 -4.411 6.634
37 HB2 PRO 16 2HB PRO 16 -3.431 -2.237 8.233
38 HB3 PRO 16 1HB PRO 16 -2.861 -2.155 6.564
39 HG2 PRO 16 2HG PRO 16 -5.648 -2.144 7.620
40 HG3 PRO 16 1HG PRO 16 -4.968 -1.284 6.226
41 HD2 PRO 16 2HD PRO 16 -6.502 -3.448 5.901
42 HD3 PRO 16 1HD PRO 16 -5.096 -3.157 4.854
43 H ASN 17 H ASN 17 -5.491 -4.798 8.628
44 HA ASN 17 HA ASN 17 -3.964 -5.127 11.065
45 HB2 ASN 17 2HB ASN 17 -6.584 -4.404 10.508
46 HB3 ASN 17 1HB ASN 17 -6.737 -6.031 11.165
47 HD21 ASN 17 1HD2 ASN 17 -5.823 -6.449 13.254
48 HD22 ASN 17 2HD2 ASN 17 -5.692 -5.169 14.407
49 H ASN 18 H ASN 18 -4.989 -7.090 8.471
50 HA ASN 18 HA ASN 18 -4.704 -9.301 8.025
51 HB2 ASN 18 2HB ASN 18 -2.780 -8.752 10.039
52 HB3 ASN 18 1HB ASN 18 -3.526 -10.295 10.444
53 HD21 ASN 18 1HD2 ASN 18 -2.191 -11.825 9.806
54 HD22 ASN 18 2HD2 ASN 18 -1.432 -11.928 8.257
55 H ASP 19 H ASP 19 -6.961 -9.592 8.129
56 HA ASP 19 HA ASP 19 -7.780 -11.436 10.197
57 HB2 ASP 19 2HB ASP 19 -9.173 -8.779 9.831
58 HB3 ASP 19 1HB ASP 19 -9.863 -10.139 10.712
59 H LYS 20 H LYS 20 -7.386 -11.303 7.236
60 HA LYS 20 HA LYS 20 -8.335 -12.192 5.372
61 HB2 LYS 20 2HB LYS 20 -10.565 -13.161 7.159
62 HB3 LYS 20 1HB LYS 20 -10.055 -13.835 5.618
63 HG2 LYS 20 2HG LYS 20 -8.330 -14.976 6.527
64 HG3 LYS 20 1HG LYS 20 -8.016 -13.743 7.749
65 HD2 LYS 20 2HD LYS 20 -10.506 -14.708 8.443
66 HD3 LYS 20 1HD LYS 20 -9.649 -16.151 7.898
67 HE2 LYS 20 2HE LYS 20 -8.043 -15.982 9.549
68 HE3 LYS 20 1HE LYS 20 -8.302 -14.251 9.766
69 HZ1 LYS 20 3HZ LYS 20 -10.204 -16.379 10.586
70 HZ2 LYS 20 1HZ LYS 20 -10.400 -14.718 10.836
71 HZ3 LYS 20 2HZ LYS 20 -9.158 -15.552 11.626
72 H GLY 21 H GLY 21 -9.609 -11.436 3.747
73 HA2 GLY 21 2HA GLY 21 -12.127 -10.155 4.232
74 HA3 GLY 21 1HA GLY 21 -10.849 -8.997 3.894
75 H THR 22 H THR 22 -12.169 -8.429 2.041
76 HA THR 22 HA THR 22 -11.740 -10.271 -0.217
77 HB THR 22 HB THR 22 -14.025 -8.309 0.034
78 HG1 THR 22 1HG THR 22 -15.288 -10.132 0.506
79 HG21 THR 22 3HG2 THR 22 -14.887 -9.127 -1.895
80 HG22 THR 22 1HG2 THR 22 -14.122 -10.704 -1.704
81 HG23 THR 22 2HG2 THR 22 -13.171 -9.322 -2.246
82 H CYS 23 H CYS 23 -11.108 -9.360 -2.189
83 HA CYS 23 HA CYS 23 -10.232 -6.550 -2.011
84 HB2 CYS 23 2HB CYS 23 -8.579 -8.686 -2.220
85 HB3 CYS 23 1HB CYS 23 -8.845 -8.328 -3.923
86 H LYS 24 H LYS 24 -11.159 -5.218 -3.378
87 HA LYS 24 HA LYS 24 -11.865 -6.105 -6.064
88 HB2 LYS 24 2HB LYS 24 -14.110 -4.981 -5.846
89 HB3 LYS 24 1HB LYS 24 -13.937 -6.480 -4.943
90 HG2 LYS 24 2HG LYS 24 -13.708 -5.313 -2.887
91 HG3 LYS 24 1HG LYS 24 -13.565 -3.762 -3.714
92 HD2 LYS 24 2HD LYS 24 -15.763 -3.572 -3.297
93 HD3 LYS 24 1HD LYS 24 -15.954 -4.674 -4.662
94 HE2 LYS 24 2HE LYS 24 -15.691 -5.545 -1.788
95 HE3 LYS 24 1HE LYS 24 -17.226 -5.344 -2.629
96 HZ1 LYS 24 3HZ LYS 24 -16.298 -6.977 -4.304
97 HZ2 LYS 24 1HZ LYS 24 -16.716 -7.607 -2.790
98 HZ3 LYS 24 2HZ LYS 24 -15.093 -7.321 -3.169
99 H SER 25 H SER 25 -12.623 -4.161 -7.399
100 HA SER 25 HA SER 25 -10.636 -2.215 -7.424
101 HB2 SER 25 2HB SER 25 -12.482 -0.932 -8.825
102 HB3 SER 25 1HB SER 25 -11.705 -2.381 -9.463
103 HG SER 25 HG SER 25 -14.167 -2.355 -8.051
104 H LEU 26 H LEU 26 -11.400 0.256 -7.508
105 HA LEU 26 HA LEU 26 -12.352 0.814 -4.800
106 HB2 LEU 26 2HB LEU 26 -11.416 3.045 -5.125
107 HB3 LEU 26 1HB LEU 26 -10.222 1.797 -5.427
108 HG LEU 26 HG LEU 26 -11.098 2.176 -7.942
109 HD11 LEU 26 1HD1 LEU 26 -12.597 3.897 -7.772
110 HD12 LEU 26 2HD1 LEU 26 -11.107 4.798 -8.055
111 HD13 LEU 26 3HD1 LEU 26 -11.751 4.649 -6.420
112 HD21 LEU 26 3HD2 LEU 26 -9.083 4.045 -6.734
113 HD22 LEU 26 1HD2 LEU 26 -9.087 3.317 -8.340
114 HD23 LEU 26 2HD2 LEU 26 -8.768 2.320 -6.920
115 H LEU 27 H LEU 27 -14.186 0.050 -6.940
116 HA LEU 27 HA LEU 27 -16.000 2.316 -6.701
117 HB2 LEU 27 2HB LEU 27 -16.621 1.932 -9.177
118 HB3 LEU 27 1HB LEU 27 -15.213 2.903 -8.796
119 HG LEU 27 HG LEU 27 -13.988 0.549 -9.060
120 HD11 LEU 27 1HD1 LEU 27 -16.482 -0.257 -9.679
121 HD12 LEU 27 2HD1 LEU 27 -15.020 -1.008 -10.317
122 HD13 LEU 27 3HD1 LEU 27 -15.890 0.186 -11.279
123 HD21 LEU 27 3HD2 LEU 27 -14.015 2.864 -10.424
124 HD22 LEU 27 1HD2 LEU 27 -14.661 1.778 -11.655
125 HD23 LEU 27 2HD2 LEU 27 -13.090 1.449 -10.924
126 H GLN 28 H GLN 28 -15.812 -0.386 -5.577
127 HA GLN 28 HA GLN 28 -18.416 -1.390 -6.506
128 HB2 GLN 28 2HB GLN 28 -15.979 -3.027 -5.796
129 HB3 GLN 28 1HB GLN 28 -17.588 -3.703 -6.008
130 HG2 GLN 28 2HG GLN 28 -16.546 -2.049 -8.220
131 HG3 GLN 28 1HG GLN 28 -15.767 -3.608 -7.955
132 HE21 GLN 28 1HE2 GLN 28 -18.955 -2.117 -8.317
133 HE22 GLN 28 2HE2 GLN 28 -19.679 -3.451 -9.143
134 H CYS 29 H CYS 29 -16.043 -1.381 -3.866
135 HA CYS 29 HA CYS 29 -17.687 -2.451 -1.874
136 HB2 CYS 29 2HB CYS 29 -15.090 -1.622 -1.985
137 HB3 CYS 29 1HB CYS 29 -15.805 -0.362 -0.986
138 H ASP 30 H ASP 30 -19.542 -1.712 -1.111
139 HA ASP 30 HA ASP 30 -20.622 0.801 -1.661
140 HB2 ASP 30 2HB ASP 30 -21.518 -1.550 -0.478
141 HB3 ASP 30 1HB ASP 30 -21.660 -0.354 0.804
142 H VAL 31 H VAL 31 -18.867 -0.360 1.167
143 HA VAL 31 HA VAL 31 -19.231 1.952 2.750
144 HB VAL 31 HB VAL 31 -18.514 -0.206 3.698
145 HG11 VAL 31 1HG1 VAL 31 -16.954 -0.738 1.791
146 HG12 VAL 31 2HG1 VAL 31 -16.337 -1.089 3.407
147 HG13 VAL 31 3HG1 VAL 31 -15.792 0.352 2.546
148 HG21 VAL 31 3HG2 VAL 31 -18.085 1.422 5.238
149 HG22 VAL 31 1HG2 VAL 31 -16.991 2.301 4.169
150 HG23 VAL 31 2HG2 VAL 31 -16.443 0.832 4.975
151 H ALA 32 H ALA 32 -16.769 1.008 0.418
152 HA ALA 32 HA ALA 32 -14.984 3.138 0.912
153 HB1 ALA 32 3HB ALA 32 -14.051 2.592 -1.311
154 HB2 ALA 32 1HB ALA 32 -15.408 1.497 -1.582
155 HB3 ALA 32 2HB ALA 32 -14.258 1.172 -0.285
156 H SER 33 H SER 33 -17.782 2.797 -1.183
157 HA SER 33 HA SER 33 -17.428 5.181 -2.650
158 HB2 SER 33 2HB SER 33 -19.103 3.075 -2.884
159 HB3 SER 33 1HB SER 33 -20.199 4.258 -2.171
160 HG SER 33 HG SER 33 -20.275 5.213 -4.030
161 H LYS 34 H LYS 34 -19.109 4.472 0.371
162 HA LYS 34 HA LYS 34 -20.350 7.005 0.615
163 HB2 LYS 34 2HB LYS 34 -20.893 6.376 2.859
164 HB3 LYS 34 1HB LYS 34 -21.053 4.949 1.848
165 HG2 LYS 34 2HG LYS 34 -19.398 3.853 2.901
166 HG3 LYS 34 1HG LYS 34 -18.430 5.305 3.138
167 HD2 LYS 34 2HD LYS 34 -19.326 5.725 5.162
168 HD3 LYS 34 1HD LYS 34 -20.943 5.227 4.660
169 HE2 LYS 34 2HE LYS 34 -18.682 3.321 5.246
170 HE3 LYS 34 1HE LYS 34 -19.917 3.782 6.416
171 HZ1 LYS 34 3HZ LYS 34 -20.883 2.812 3.853
172 HZ2 LYS 34 1HZ LYS 34 -21.467 2.514 5.413
173 HZ3 LYS 34 2HZ LYS 34 -20.124 1.663 4.834
174 H ILE 35 H ILE 35 -17.191 5.789 1.493
175 HA ILE 35 HA ILE 35 -16.475 7.964 3.190
176 HB ILE 35 HB ILE 35 -14.629 6.127 1.661
177 HG12 ILE 35 2HG1 ILE 35 -15.310 5.753 4.547
178 HG13 ILE 35 1HG1 ILE 35 -16.446 5.182 3.331
179 HG21 ILE 35 1HG2 ILE 35 -12.901 7.041 2.755
180 HG22 ILE 35 2HG2 ILE 35 -13.799 7.162 4.268
181 HG23 ILE 35 3HG2 ILE 35 -13.991 8.401 3.029
182 HD11 ILE 35 3HD1 ILE 35 -15.201 3.401 2.882
183 HD12 ILE 35 1HD1 ILE 35 -14.283 3.805 4.333
184 HD13 ILE 35 2HD1 ILE 35 -13.729 4.364 2.754
185 H ILE 36 H ILE 36 -16.176 7.321 -0.248
186 HA ILE 36 HA ILE 36 -14.504 9.572 -0.807
187 HB ILE 36 HB ILE 36 -16.247 7.986 -2.696
188 HG12 ILE 36 2HG1 ILE 36 -14.532 6.670 -1.406
189 HG13 ILE 36 1HG1 ILE 36 -14.332 6.623 -3.153
190 HG21 ILE 36 1HG2 ILE 36 -15.547 10.199 -3.546
191 HG22 ILE 36 2HG2 ILE 36 -14.862 8.858 -4.466
192 HG23 ILE 36 3HG2 ILE 36 -13.864 9.730 -3.302
193 HD11 ILE 36 3HD1 ILE 36 -12.623 7.847 -1.069
194 HD12 ILE 36 1HD1 ILE 36 -12.706 8.653 -2.635
195 HD13 ILE 36 2HD1 ILE 36 -12.180 6.973 -2.535
196 H SER 37 H SER 37 -17.956 8.987 -0.713
197 HA SER 37 HA SER 37 -18.491 11.684 -1.722
198 HB2 SER 37 2HB SER 37 -19.760 9.723 -2.644
199 HB3 SER 37 1HB SER 37 -20.491 9.515 -1.054
200 HG SER 37 HG SER 37 -21.908 10.795 -2.053
201 H LYS 38 H LYS 38 -17.931 10.217 1.199
202 HA LYS 38 HA LYS 38 -19.909 11.213 2.891
203 HB2 LYS 38 2HB LYS 38 -17.398 9.913 3.161
204 HB3 LYS 38 1HB LYS 38 -17.386 11.308 4.231
205 HG2 LYS 38 2HG LYS 38 -19.869 10.179 4.664
206 HG3 LYS 38 1HG LYS 38 -18.797 8.790 4.473
207 HD2 LYS 38 2HD LYS 38 -18.151 11.103 6.286
208 HD3 LYS 38 1HD LYS 38 -19.069 9.696 6.828
209 HE2 LYS 38 2HE LYS 38 -16.475 9.257 5.436
210 HE3 LYS 38 1HE LYS 38 -16.449 9.820 7.107
211 HZ1 LYS 38 3HZ LYS 38 -16.459 7.298 6.599
212 HZ2 LYS 38 1HZ LYS 38 -18.123 7.514 6.377
213 HZ3 LYS 38 2HZ LYS 38 -17.412 7.893 7.864
214 H LYS 39 H LYS 39 -16.634 12.550 2.876
215 HA LYS 39 HA LYS 39 -17.549 15.223 2.368
216 HB2 LYS 39 2HB LYS 39 -17.099 14.278 5.127
217 HB3 LYS 39 1HB LYS 39 -16.311 15.796 4.722
218 HG2 LYS 39 2HG LYS 39 -19.250 15.222 4.409
219 HG3 LYS 39 1HG LYS 39 -18.513 16.134 5.727
220 HD2 LYS 39 2HD LYS 39 -17.620 17.727 4.024
221 HD3 LYS 39 1HD LYS 39 -18.554 16.864 2.800
222 HE2 LYS 39 2HE LYS 39 -19.884 17.923 5.263
223 HE3 LYS 39 1HE LYS 39 -19.556 18.987 3.897
224 HZ1 LYS 39 3HZ LYS 39 -21.700 18.188 3.533
225 HZ2 LYS 39 1HZ LYS 39 -21.306 16.607 3.992
226 HZ3 LYS 39 2HZ LYS 39 -20.742 17.227 2.524
227 HA PRO 40 HA PRO 40 -12.796 15.404 2.878
228 HB2 PRO 40 2HB PRO 40 -11.472 13.357 4.037
229 HB3 PRO 40 1HB PRO 40 -12.197 14.666 4.978
230 HG2 PRO 40 2HG PRO 40 -13.251 11.917 4.433
231 HG3 PRO 40 1HG PRO 40 -13.235 12.827 5.955
232 HD2 PRO 40 2HD PRO 40 -15.433 12.644 4.373
233 HD3 PRO 40 1HD PRO 40 -15.090 14.061 5.383
234 H ARG 41 H ARG 41 -11.091 14.713 1.515
235 HA ARG 41 HA ARG 41 -10.842 12.208 0.320
236 HB2 ARG 41 2HB ARG 41 -11.711 12.774 -1.979
237 HB3 ARG 41 1HB ARG 41 -12.945 12.506 -0.755
238 HG2 ARG 41 2HG ARG 41 -13.123 14.968 -0.478
239 HG3 ARG 41 1HG ARG 41 -12.005 15.155 -1.831
240 HD2 ARG 41 2HD ARG 41 -13.673 13.648 -3.109
241 HD3 ARG 41 1HD ARG 41 -14.800 14.078 -1.825
242 HE ARG 41 HE ARG 41 -14.969 16.182 -2.717
243 HH11 ARG 41 1HH1 ARG 41 -12.220 14.563 -4.132
244 HH12 ARG 41 2HH1 ARG 41 -11.957 15.788 -5.327
245 HH21 ARG 41 1HH2 ARG 41 -14.625 17.793 -4.290
246 HH22 ARG 41 2HH2 ARG 41 -13.321 17.621 -5.417
247 H THR 42 H THR 42 -8.725 13.043 0.927
248 HA THR 42 HA THR 42 -7.592 14.784 -1.164
249 HB THR 42 HB THR 42 -6.059 15.703 0.424
250 HG1 THR 42 1HG THR 42 -7.141 13.939 2.359
251 HG21 THR 42 3HG2 THR 42 -7.869 16.131 2.428
252 HG22 THR 42 1HG2 THR 42 -8.900 15.784 1.040
253 HG23 THR 42 2HG2 THR 42 -7.714 17.087 0.953
254 H ALA 43 H ALA 43 -4.939 14.475 -0.666
255 HA ALA 43 HA ALA 43 -4.287 12.119 -1.996
256 HB1 ALA 43 3HB ALA 43 -2.274 13.399 -0.213
257 HB2 ALA 43 1HB ALA 43 -2.930 14.321 -1.564
258 HB3 ALA 43 2HB ALA 43 -2.099 12.794 -1.861
259 H GLN 44 H GLN 44 -4.554 12.785 1.432
260 HA GLN 44 HA GLN 44 -3.186 10.565 2.440
261 HB2 GLN 44 2HB GLN 44 -4.507 12.684 3.539
262 HB3 GLN 44 1HB GLN 44 -5.598 11.361 3.932
263 HG2 GLN 44 2HG GLN 44 -3.288 10.242 4.671
264 HG3 GLN 44 1HG GLN 44 -2.876 11.939 4.918
265 HE21 GLN 44 1HE2 GLN 44 -3.047 10.034 6.969
266 HE22 GLN 44 2HE2 GLN 44 -4.347 10.477 8.015
267 H ASP 45 H ASP 45 -6.404 10.875 1.114
268 HA ASP 45 HA ASP 45 -7.392 8.380 2.059
269 HB2 ASP 45 2HB ASP 45 -8.447 10.586 0.696
270 HB3 ASP 45 1HB ASP 45 -8.624 9.236 -0.420
271 H GLU 46 H GLU 46 -5.679 9.403 -0.833
272 HA GLU 46 HA GLU 46 -6.034 6.992 -2.280
273 HB2 GLU 46 2HB GLU 46 -4.959 9.500 -2.806
274 HB3 GLU 46 1HB GLU 46 -3.581 8.416 -2.931
275 HG2 GLU 46 2HG GLU 46 -5.873 7.318 -4.284
276 HG3 GLU 46 1HG GLU 46 -5.508 8.939 -4.870
277 H LYS 47 H LYS 47 -3.553 8.123 -0.051
278 HA LYS 47 HA LYS 47 -1.765 5.968 -0.503
279 HB2 LYS 47 2HB LYS 47 -0.701 6.672 1.613
280 HB3 LYS 47 1HB LYS 47 -0.969 8.020 0.518
281 HG2 LYS 47 2HG LYS 47 -2.779 8.825 1.796
282 HG3 LYS 47 1HG LYS 47 -2.858 7.343 2.750
283 HD2 LYS 47 2HD LYS 47 -0.332 8.928 2.752
284 HD3 LYS 47 1HD LYS 47 -1.703 9.510 3.700
285 HE2 LYS 47 2HE LYS 47 -0.836 6.659 3.930
286 HE3 LYS 47 1HE LYS 47 0.057 7.917 4.782
287 HZ1 LYS 47 3HZ LYS 47 -2.628 6.898 5.260
288 HZ2 LYS 47 1HZ LYS 47 -2.408 8.562 5.479
289 HZ3 LYS 47 2HZ LYS 47 -1.473 7.461 6.359
290 H PHE 48 H PHE 48 -4.444 6.503 1.703
291 HA PHE 48 HA PHE 48 -4.052 4.252 3.340
292 HB2 PHE 48 2HB PHE 48 -6.298 6.104 2.765
293 HB3 PHE 48 1HB PHE 48 -6.723 4.548 3.474
294 HD1 PHE 48 1HD PHE 48 -4.726 3.958 5.383
295 HD2 PHE 48 2HD PHE 48 -6.338 7.758 4.344
296 HE1 PHE 48 1HE PHE 48 -4.136 4.813 7.613
297 HE2 PHE 48 2HE PHE 48 -5.749 8.620 6.572
298 HZ PHE 48 HZ PHE 48 -4.648 7.147 8.210
299 H LEU 49 H LEU 49 -5.995 4.701 0.411
300 HA LEU 49 HA LEU 49 -6.918 2.000 0.372
301 HB2 LEU 49 2HB LEU 49 -7.596 2.529 -1.980
302 HB3 LEU 49 1HB LEU 49 -8.256 3.602 -0.763
303 HG LEU 49 HG LEU 49 -6.146 5.071 -1.427
304 HD11 LEU 49 1HD1 LEU 49 -5.570 3.132 -3.092
305 HD12 LEU 49 2HD1 LEU 49 -5.340 4.817 -3.558
306 HD13 LEU 49 3HD1 LEU 49 -6.765 3.935 -4.109
307 HD21 LEU 49 3HD2 LEU 49 -8.810 4.848 -2.780
308 HD22 LEU 49 1HD2 LEU 49 -7.655 6.107 -3.217
309 HD23 LEU 49 2HD2 LEU 49 -8.276 6.013 -1.568
310 H ARG 50 H ARG 50 -4.178 3.714 -0.946
311 HA ARG 50 HA ARG 50 -3.300 1.698 -2.732
312 HB2 ARG 50 2HB ARG 50 -1.957 4.045 -1.415
313 HB3 ARG 50 1HB ARG 50 -1.043 2.918 -2.407
314 HG2 ARG 50 2HG ARG 50 -3.506 3.973 -3.623
315 HG3 ARG 50 1HG ARG 50 -2.214 5.145 -3.350
316 HD2 ARG 50 2HD ARG 50 -1.870 2.517 -4.788
317 HD3 ARG 50 1HD ARG 50 -2.131 4.068 -5.587
318 HE ARG 50 HE ARG 50 0.024 4.542 -4.030
319 HH11 ARG 50 1HH1 ARG 50 -0.725 2.049 -6.355
320 HH12 ARG 50 2HH1 ARG 50 0.926 1.816 -6.824
321 HH21 ARG 50 1HH2 ARG 50 2.196 4.237 -4.646
322 HH22 ARG 50 2HH2 ARG 50 2.584 3.057 -5.854
323 H GLU 51 H GLU 51 -2.754 2.334 0.679
324 HA GLU 51 HA GLU 51 -0.683 0.393 0.993
325 HB2 GLU 51 2HB GLU 51 -2.166 2.250 2.698
326 HB3 GLU 51 1HB GLU 51 -1.787 0.732 3.502
327 HG2 GLU 51 2HG GLU 51 0.568 1.452 2.218
328 HG3 GLU 51 1HG GLU 51 -0.074 2.962 2.861
329 H SER 52 H SER 52 -4.175 0.369 1.272
330 HA SER 52 HA SER 52 -4.139 -2.401 2.213
331 HB2 SER 52 2HB SER 52 -6.570 -0.664 1.766
332 HB3 SER 52 1HB SER 52 -6.453 -2.128 2.741
333 HG SER 52 HG SER 52 -5.075 -0.984 4.156
334 H ALA 53 H ALA 53 -3.226 -1.908 -0.424
335 HA ALA 53 HA ALA 53 -5.413 -3.018 -2.054
336 HB1 ALA 53 3HB ALA 53 -2.957 -1.942 -3.332
337 HB2 ALA 53 1HB ALA 53 -4.097 -0.795 -2.629
338 HB3 ALA 53 2HB ALA 53 -4.632 -1.910 -3.887
339 H CYS 54 H CYS 54 -5.272 -5.083 -2.620
340 HA CYS 54 HA CYS 54 -2.987 -6.657 -1.950
341 HB2 CYS 54 2HB CYS 54 -4.269 -8.516 -3.007
342 HB3 CYS 54 1HB CYS 54 -5.187 -7.641 -1.786
343 H GLY 55 H GLY 55 -1.454 -5.370 -3.267
344 HA2 GLY 55 2HA GLY 55 -0.173 -6.511 -5.221
345 HA3 GLY 55 1HA GLY 55 -1.571 -5.972 -6.140
346 H PHE 56 H PHE 56 0.522 -5.002 -7.203
347 HA PHE 56 HA PHE 56 0.640 -2.219 -6.296
348 HB2 PHE 56 2HB PHE 56 3.074 -3.821 -7.111
349 HB3 PHE 56 1HB PHE 56 3.054 -2.120 -6.655
350 HD1 PHE 56 1HD PHE 56 2.428 -5.541 -5.379
351 HD2 PHE 56 2HD PHE 56 3.243 -1.477 -4.417
352 HE1 PHE 56 1HE PHE 56 2.788 -6.173 -3.029
353 HE2 PHE 56 2HE PHE 56 3.607 -2.102 -2.065
354 HZ PHE 56 HZ PHE 56 3.379 -4.454 -1.368
355 H ASP 57 H ASP 57 -0.995 -2.402 -8.155
356 HA ASP 57 HA ASP 57 0.379 -2.242 -10.750
357 HB2 ASP 57 2HB ASP 57 -1.980 -3.570 -9.973
358 HB3 ASP 57 1HB ASP 57 -2.499 -2.211 -10.966
359 H GLY 58 H GLY 58 -0.256 -0.559 -12.236
360 HA2 GLY 58 2HA GLY 58 -0.982 1.911 -10.802
361 HA3 GLY 58 1HA GLY 58 -0.037 1.838 -12.282
362 H GLN 59 H GLN 59 -1.591 0.200 -13.857
363 HA GLN 59 HA GLN 59 -3.704 2.021 -14.584
364 HB2 GLN 59 2HB GLN 59 -2.267 -0.209 -15.839
365 HB3 GLN 59 1HB GLN 59 -3.971 -0.133 -16.264
366 HG2 GLN 59 2HG GLN 59 -1.927 2.043 -16.620
367 HG3 GLN 59 1HG GLN 59 -2.676 1.073 -17.886
368 HE21 GLN 59 1HE2 GLN 59 -2.627 4.022 -17.200
369 HE22 GLN 59 2HE2 GLN 59 -4.288 4.491 -17.252
370 H THR 60 H THR 60 -3.418 -1.065 -13.000
371 HA THR 60 HA THR 60 -6.342 -1.365 -13.004
372 HB THR 60 HB THR 60 -4.597 -3.506 -11.908
373 HG1 THR 60 1HG THR 60 -3.508 -3.712 -13.668
374 HG21 THR 60 3HG2 THR 60 -7.258 -3.322 -12.684
375 HG22 THR 60 1HG2 THR 60 -6.368 -4.781 -12.251
376 HG23 THR 60 2HG2 THR 60 -6.476 -4.283 -13.939
377 HA PRO 61 HA PRO 61 -5.505 0.235 -8.765
378 HB2 PRO 61 2HB PRO 61 -7.911 1.470 -8.509
379 HB3 PRO 61 1HB PRO 61 -6.523 2.224 -9.300
380 HG2 PRO 61 2HG PRO 61 -8.878 0.839 -10.523
381 HG3 PRO 61 1HG PRO 61 -8.089 2.348 -11.017
382 HD2 PRO 61 2HD PRO 61 -7.624 -0.006 -12.266
383 HD3 PRO 61 1HD PRO 61 -6.377 1.245 -12.101
384 H LYS 62 H LYS 62 -5.933 -0.914 -6.982
385 HA LYS 62 HA LYS 62 -8.470 -2.370 -6.788
386 HB2 LYS 62 2HB LYS 62 -5.708 -3.538 -6.573
387 HB3 LYS 62 1HB LYS 62 -7.077 -4.289 -5.764
388 HG2 LYS 62 2HG LYS 62 -8.217 -4.494 -7.936
389 HG3 LYS 62 1HG LYS 62 -6.795 -3.809 -8.723
390 HD2 LYS 62 2HD LYS 62 -5.609 -5.720 -8.533
391 HD3 LYS 62 1HD LYS 62 -6.273 -6.092 -6.940
392 HE2 LYS 62 2HE LYS 62 -7.283 -7.751 -8.114
393 HE3 LYS 62 1HE LYS 62 -8.471 -6.477 -8.391
394 HZ1 LYS 62 3HZ LYS 62 -6.221 -6.892 -10.256
395 HZ2 LYS 62 1HZ LYS 62 -7.698 -6.116 -10.536
396 HZ3 LYS 62 2HZ LYS 62 -7.641 -7.800 -10.390
397 H VAL 63 H VAL 63 -9.006 -3.035 -4.604
398 HA VAL 63 HA VAL 63 -7.491 -1.757 -2.460
399 HB VAL 63 HB VAL 63 -10.459 -1.292 -2.755
400 HG11 VAL 63 1HG1 VAL 63 -9.705 0.567 -1.041
401 HG12 VAL 63 2HG1 VAL 63 -8.400 -0.578 -0.731
402 HG13 VAL 63 3HG1 VAL 63 -10.079 -1.072 -0.510
403 HG21 VAL 63 3HG2 VAL 63 -8.117 0.408 -3.546
404 HG22 VAL 63 1HG2 VAL 63 -9.676 1.123 -3.132
405 HG23 VAL 63 2HG2 VAL 63 -9.554 -0.005 -4.483
406 H CYS 64 H CYS 64 -8.080 -2.517 -0.332
407 HA CYS 64 HA CYS 64 -9.236 -5.216 -0.431
408 HB2 CYS 64 2HB CYS 64 -6.839 -4.812 0.391
409 HB3 CYS 64 1HB CYS 64 -7.575 -4.098 1.822
410 H CYS 65 H CYS 65 -11.148 -5.562 0.452
411 HA CYS 65 HA CYS 65 -12.145 -3.652 2.462
412 HB2 CYS 65 2HB CYS 65 -13.444 -4.878 0.080
413 HB3 CYS 65 1HB CYS 65 -14.438 -4.645 1.515
414 HA PRO 66 HA PRO 66 -12.177 -7.331 5.029
415 HB2 PRO 66 2HB PRO 66 -13.355 -6.196 7.203
416 HB3 PRO 66 1HB PRO 66 -11.647 -5.974 6.805
417 HG2 PRO 66 2HG PRO 66 -13.966 -4.155 6.278
418 HG3 PRO 66 1HG PRO 66 -12.341 -3.756 6.867
419 HD2 PRO 66 2HD PRO 66 -13.072 -3.399 4.290
420 HD3 PRO 66 1HD PRO 66 -11.417 -3.847 4.753
Start of MODEL 8
1 H GLN 11 H GLN 11 -11.854 -11.113 -5.050
2 HA GLN 11 HA GLN 11 -10.497 -13.197 -5.143
3 HB2 GLN 11 2HB GLN 11 -8.798 -11.461 -6.509
4 HB3 GLN 11 1HB GLN 11 -8.042 -11.646 -4.933
5 HG2 GLN 11 2HG GLN 11 -7.861 -13.990 -5.190
6 HG3 GLN 11 1HG GLN 11 -8.916 -13.984 -6.603
7 HE21 GLN 11 1HE2 GLN 11 -5.735 -13.292 -5.390
8 HE22 GLN 11 2HE2 GLN 11 -4.959 -13.138 -6.927
9 H ALA 12 H ALA 12 -9.529 -13.841 -3.145
10 HA ALA 12 HA ALA 12 -10.398 -12.256 -0.923
11 HB1 ALA 12 3HB ALA 12 -8.640 -14.619 -0.526
12 HB2 ALA 12 1HB ALA 12 -10.236 -14.874 -1.231
13 HB3 ALA 12 2HB ALA 12 -10.084 -14.121 0.356
14 H CYS 13 H CYS 13 -9.281 -10.785 0.161
15 HA CYS 13 HA CYS 13 -6.344 -10.790 -0.075
16 HB2 CYS 13 2HB CYS 13 -6.857 -8.879 -1.250
17 HB3 CYS 13 1HB CYS 13 -8.333 -8.584 -0.341
18 H THR 14 H THR 14 -5.161 -9.998 1.742
19 HA THR 14 HA THR 14 -6.593 -10.413 4.273
20 HB THR 14 HB THR 14 -4.731 -11.940 3.887
21 HG1 THR 14 1HG THR 14 -3.548 -11.442 5.792
22 HG21 THR 14 3HG2 THR 14 -2.546 -10.108 4.230
23 HG22 THR 14 1HG2 THR 14 -3.432 -9.762 2.746
24 HG23 THR 14 2HG2 THR 14 -2.778 -11.376 3.025
25 H LEU 15 H LEU 15 -7.138 -8.639 5.331
26 HA LEU 15 HA LEU 15 -6.276 -6.051 4.741
27 HB2 LEU 15 2HB LEU 15 -7.187 -5.547 7.096
28 HB3 LEU 15 1HB LEU 15 -8.295 -6.169 5.887
29 HG LEU 15 HG LEU 15 -7.019 -8.237 7.544
30 HD11 LEU 15 1HD1 LEU 15 -7.675 -6.039 8.960
31 HD12 LEU 15 2HD1 LEU 15 -7.784 -7.685 9.584
32 HD13 LEU 15 3HD1 LEU 15 -9.222 -6.887 8.948
33 HD21 LEU 15 3HD2 LEU 15 -9.909 -8.112 7.505
34 HD22 LEU 15 1HD2 LEU 15 -8.825 -9.370 6.909
35 HD23 LEU 15 2HD2 LEU 15 -9.231 -7.995 5.882
36 HA PRO 16 HA PRO 16 -2.404 -5.259 6.668
37 HB2 PRO 16 2HB PRO 16 -3.087 -3.216 8.467
38 HB3 PRO 16 1HB PRO 16 -2.577 -3.002 6.791
39 HG2 PRO 16 2HG PRO 16 -5.324 -3.040 7.948
40 HG3 PRO 16 1HG PRO 16 -4.677 -2.066 6.615
41 HD2 PRO 16 2HD PRO 16 -6.259 -4.167 6.146
42 HD3 PRO 16 1HD PRO 16 -4.883 -3.804 5.083
43 H ASN 17 H ASN 17 -5.199 -5.770 8.700
44 HA ASN 17 HA ASN 17 -3.614 -6.333 11.057
45 HB2 ASN 17 2HB ASN 17 -6.400 -5.811 10.474
46 HB3 ASN 17 1HB ASN 17 -6.236 -7.245 11.483
47 HD21 ASN 17 1HD2 ASN 17 -4.715 -4.044 11.242
48 HD22 ASN 17 2HD2 ASN 17 -4.813 -3.685 12.929
49 H ASN 18 H ASN 18 -4.748 -8.048 8.333
50 HA ASN 18 HA ASN 18 -4.504 -10.216 7.691
51 HB2 ASN 18 2HB ASN 18 -2.319 -10.004 8.975
52 HB3 ASN 18 1HB ASN 18 -3.147 -10.758 10.333
53 HD21 ASN 18 1HD2 ASN 18 -1.398 -11.272 7.523
54 HD22 ASN 18 2HD2 ASN 18 -1.652 -12.973 7.368
55 H ASP 19 H ASP 19 -6.760 -10.486 7.805
56 HA ASP 19 HA ASP 19 -7.578 -12.466 9.752
57 HB2 ASP 19 2HB ASP 19 -8.803 -9.719 9.621
58 HB3 ASP 19 1HB ASP 19 -9.725 -11.106 10.196
59 H LYS 20 H LYS 20 -7.187 -12.141 6.800
60 HA LYS 20 HA LYS 20 -8.139 -12.915 4.887
61 HB2 LYS 20 2HB LYS 20 -10.367 -13.986 6.617
62 HB3 LYS 20 1HB LYS 20 -9.872 -14.562 5.032
63 HG2 LYS 20 2HG LYS 20 -8.177 -15.792 5.857
64 HG3 LYS 20 1HG LYS 20 -7.794 -14.618 7.118
65 HD2 LYS 20 2HD LYS 20 -9.897 -15.363 8.290
66 HD3 LYS 20 1HD LYS 20 -9.990 -16.679 7.117
67 HE2 LYS 20 2HE LYS 20 -7.671 -16.151 8.971
68 HE3 LYS 20 1HE LYS 20 -8.918 -17.370 9.222
69 HZ1 LYS 20 3HZ LYS 20 -8.116 -18.037 6.797
70 HZ2 LYS 20 1HZ LYS 20 -7.393 -18.656 8.197
71 HZ3 LYS 20 2HZ LYS 20 -6.673 -17.367 7.370
72 H GLY 21 H GLY 21 -9.364 -11.997 3.322
73 HA2 GLY 21 2HA GLY 21 -11.903 -10.784 3.856
74 HA3 GLY 21 1HA GLY 21 -10.630 -9.589 3.669
75 H THR 22 H THR 22 -11.939 -8.867 1.853
76 HA THR 22 HA THR 22 -11.405 -10.453 -0.571
77 HB THR 22 HB THR 22 -13.722 -8.552 -0.356
78 HG1 THR 22 1HG THR 22 -13.821 -11.316 0.262
79 HG21 THR 22 3HG2 THR 22 -14.481 -10.715 -1.855
80 HG22 THR 22 1HG2 THR 22 -12.787 -10.503 -2.295
81 HG23 THR 22 2HG2 THR 22 -13.921 -9.165 -2.482
82 H CYS 23 H CYS 23 -10.771 -9.325 -2.426
83 HA CYS 23 HA CYS 23 -10.013 -6.514 -1.956
84 HB2 CYS 23 2HB CYS 23 -8.342 -8.679 -2.507
85 HB3 CYS 23 1HB CYS 23 -8.475 -7.829 -4.041
86 H LYS 24 H LYS 24 -10.995 -5.101 -3.206
87 HA LYS 24 HA LYS 24 -11.607 -5.761 -5.978
88 HB2 LYS 24 2HB LYS 24 -13.916 -4.810 -5.720
89 HB3 LYS 24 1HB LYS 24 -13.668 -6.360 -4.926
90 HG2 LYS 24 2HG LYS 24 -13.122 -4.819 -2.857
91 HG3 LYS 24 1HG LYS 24 -14.120 -3.671 -3.751
92 HD2 LYS 24 2HD LYS 24 -16.016 -4.921 -3.506
93 HD3 LYS 24 1HD LYS 24 -15.133 -6.447 -3.445
94 HE2 LYS 24 2HE LYS 24 -14.552 -6.148 -1.193
95 HE3 LYS 24 1HE LYS 24 -14.941 -4.429 -1.232
96 HZ1 LYS 24 3HZ LYS 24 -17.224 -4.883 -1.241
97 HZ2 LYS 24 1HZ LYS 24 -16.586 -5.946 -0.089
98 HZ3 LYS 24 2HZ LYS 24 -17.002 -6.515 -1.627
99 H SER 25 H SER 25 -12.447 -3.752 -7.142
100 HA SER 25 HA SER 25 -10.582 -1.688 -6.900
101 HB2 SER 25 2HB SER 25 -12.532 -0.439 -8.265
102 HB3 SER 25 1HB SER 25 -11.487 -1.655 -9.000
103 HG SER 25 HG SER 25 -14.083 -2.049 -7.923
104 H LEU 26 H LEU 26 -11.632 0.726 -6.891
105 HA LEU 26 HA LEU 26 -12.658 1.005 -4.168
106 HB2 LEU 26 2HB LEU 26 -11.955 3.311 -4.304
107 HB3 LEU 26 1HB LEU 26 -10.640 2.259 -4.791
108 HG LEU 26 HG LEU 26 -12.325 3.265 -6.994
109 HD11 LEU 26 1HD1 LEU 26 -10.836 5.409 -6.893
110 HD12 LEU 26 2HD1 LEU 26 -10.822 5.072 -5.162
111 HD13 LEU 26 3HD1 LEU 26 -12.353 5.333 -5.998
112 HD21 LEU 26 3HD2 LEU 26 -10.508 2.125 -7.781
113 HD22 LEU 26 1HD2 LEU 26 -9.470 2.634 -6.448
114 HD23 LEU 26 2HD2 LEU 26 -9.852 3.763 -7.750
115 H LEU 27 H LEU 27 -14.433 0.135 -6.268
116 HA LEU 27 HA LEU 27 -16.476 2.176 -5.942
117 HB2 LEU 27 2HB LEU 27 -17.079 1.847 -8.427
118 HB3 LEU 27 1HB LEU 27 -15.775 2.944 -8.012
119 HG LEU 27 HG LEU 27 -14.309 0.752 -8.401
120 HD11 LEU 27 1HD1 LEU 27 -16.238 0.294 -10.591
121 HD12 LEU 27 2HD1 LEU 27 -16.686 -0.323 -9.000
122 HD13 LEU 27 3HD1 LEU 27 -15.177 -0.839 -9.753
123 HD21 LEU 27 3HD2 LEU 27 -13.624 2.482 -9.690
124 HD22 LEU 27 1HD2 LEU 27 -15.263 2.907 -10.184
125 HD23 LEU 27 2HD2 LEU 27 -14.435 1.552 -10.951
126 H GLN 28 H GLN 28 -15.953 -0.550 -4.967
127 HA GLN 28 HA GLN 28 -18.424 -1.815 -5.949
128 HB2 GLN 28 2HB GLN 28 -15.763 -3.081 -5.332
129 HB3 GLN 28 1HB GLN 28 -17.252 -4.016 -5.335
130 HG2 GLN 28 2HG GLN 28 -16.358 -2.380 -7.688
131 HG3 GLN 28 1HG GLN 28 -15.885 -4.062 -7.453
132 HE21 GLN 28 1HE2 GLN 28 -17.267 -3.282 -9.684
133 HE22 GLN 28 2HE2 GLN 28 -18.865 -3.937 -9.637
134 H CYS 29 H CYS 29 -16.108 -1.649 -3.261
135 HA CYS 29 HA CYS 29 -17.827 -2.848 -1.352
136 HB2 CYS 29 2HB CYS 29 -15.218 -2.373 -1.340
137 HB3 CYS 29 1HB CYS 29 -15.723 -0.906 -0.505
138 H ASP 30 H ASP 30 -19.253 -1.978 0.083
139 HA ASP 30 HA ASP 30 -20.587 0.387 -0.559
140 HB2 ASP 30 2HB ASP 30 -20.580 -1.417 1.829
141 HB3 ASP 30 1HB ASP 30 -21.431 0.122 1.920
142 H VAL 31 H VAL 31 -18.081 -0.247 1.838
143 HA VAL 31 HA VAL 31 -18.114 2.325 3.020
144 HB VAL 31 HB VAL 31 -15.876 1.750 3.901
145 HG11 VAL 31 1HG1 VAL 31 -17.353 0.933 5.400
146 HG12 VAL 31 2HG1 VAL 31 -16.743 -0.619 4.829
147 HG13 VAL 31 3HG1 VAL 31 -18.251 0.025 4.183
148 HG21 VAL 31 3HG2 VAL 31 -16.088 -0.357 1.832
149 HG22 VAL 31 1HG2 VAL 31 -15.336 -0.807 3.362
150 HG23 VAL 31 2HG2 VAL 31 -14.675 0.525 2.414
151 H ALA 32 H ALA 32 -16.330 0.930 0.326
152 HA ALA 32 HA ALA 32 -14.552 3.070 -0.094
153 HB1 ALA 32 3HB ALA 32 -13.901 1.981 -2.006
154 HB2 ALA 32 1HB ALA 32 -15.542 1.468 -2.402
155 HB3 ALA 32 2HB ALA 32 -14.647 0.650 -1.119
156 H SER 33 H SER 33 -17.831 2.458 -1.196
157 HA SER 33 HA SER 33 -17.995 4.529 -3.092
158 HB2 SER 33 2HB SER 33 -20.209 3.298 -1.437
159 HB3 SER 33 1HB SER 33 -20.430 4.256 -2.901
160 HG SER 33 HG SER 33 -19.022 2.583 -3.901
161 H LYS 34 H LYS 34 -18.810 4.429 0.350
162 HA LYS 34 HA LYS 34 -19.854 7.035 0.517
163 HB2 LYS 34 2HB LYS 34 -19.705 6.809 2.889
164 HB3 LYS 34 1HB LYS 34 -20.123 5.231 2.239
165 HG2 LYS 34 2HG LYS 34 -18.274 4.285 3.046
166 HG3 LYS 34 1HG LYS 34 -17.248 5.624 2.534
167 HD2 LYS 34 2HD LYS 34 -17.915 6.912 4.480
168 HD3 LYS 34 1HD LYS 34 -19.019 5.628 4.975
169 HE2 LYS 34 2HE LYS 34 -16.523 4.403 4.616
170 HE3 LYS 34 1HE LYS 34 -16.200 5.909 5.474
171 HZ1 LYS 34 3HZ LYS 34 -16.627 4.144 7.030
172 HZ2 LYS 34 1HZ LYS 34 -18.112 3.792 6.300
173 HZ3 LYS 34 2HZ LYS 34 -17.892 5.263 7.104
174 H ILE 35 H ILE 35 -16.584 5.818 0.606
175 HA ILE 35 HA ILE 35 -15.378 8.202 1.596
176 HB ILE 35 HB ILE 35 -14.165 5.919 0.027
177 HG12 ILE 35 2HG1 ILE 35 -15.158 5.363 2.258
178 HG13 ILE 35 1HG1 ILE 35 -13.426 5.072 2.155
179 HG21 ILE 35 1HG2 ILE 35 -12.100 6.971 1.399
180 HG22 ILE 35 2HG2 ILE 35 -13.028 8.434 1.061
181 HG23 ILE 35 3HG2 ILE 35 -12.490 7.403 -0.265
182 HD11 ILE 35 3HD1 ILE 35 -12.937 6.970 3.463
183 HD12 ILE 35 1HD1 ILE 35 -14.264 6.141 4.275
184 HD13 ILE 35 2HD1 ILE 35 -14.582 7.586 3.317
185 H ILE 36 H ILE 36 -16.165 6.991 -1.608
186 HA ILE 36 HA ILE 36 -14.693 9.010 -3.002
187 HB ILE 36 HB ILE 36 -16.925 7.240 -4.003
188 HG12 ILE 36 2HG1 ILE 36 -14.875 6.081 -3.091
189 HG13 ILE 36 1HG1 ILE 36 -15.234 5.739 -4.780
190 HG21 ILE 36 1HG2 ILE 36 -16.722 9.058 -5.503
191 HG22 ILE 36 2HG2 ILE 36 -15.849 7.714 -6.237
192 HG23 ILE 36 3HG2 ILE 36 -14.961 9.011 -5.436
193 HD11 ILE 36 3HD1 ILE 36 -13.251 7.826 -3.931
194 HD12 ILE 36 1HD1 ILE 36 -13.466 7.108 -5.527
195 HD13 ILE 36 2HD1 ILE 36 -12.817 6.139 -4.203
196 H SER 37 H SER 37 -17.980 8.682 -1.821
197 HA SER 37 HA SER 37 -18.677 11.264 -3.033
198 HB2 SER 37 2HB SER 37 -20.964 10.657 -2.846
199 HB3 SER 37 1HB SER 37 -20.129 9.221 -3.436
200 HG SER 37 HG SER 37 -21.499 8.629 -1.767
201 H LYS 38 H LYS 38 -17.475 10.209 -0.151
202 HA LYS 38 HA LYS 38 -19.084 11.243 1.825
203 HB2 LYS 38 2HB LYS 38 -16.864 11.730 3.043
204 HB3 LYS 38 1HB LYS 38 -17.224 10.077 2.592
205 HG2 LYS 38 2HG LYS 38 -15.427 9.941 1.324
206 HG3 LYS 38 1HG LYS 38 -15.765 11.464 0.515
207 HD2 LYS 38 2HD LYS 38 -13.840 12.065 1.558
208 HD3 LYS 38 1HD LYS 38 -14.950 12.396 2.887
209 HE2 LYS 38 2HE LYS 38 -14.273 10.583 4.089
210 HE3 LYS 38 1HE LYS 38 -13.876 9.643 2.651
211 HZ1 LYS 38 3HZ LYS 38 -12.046 10.710 4.241
212 HZ2 LYS 38 1HZ LYS 38 -12.230 11.988 3.148
213 HZ3 LYS 38 2HZ LYS 38 -11.791 10.453 2.590
214 H LYS 39 H LYS 39 -16.177 13.149 1.241
215 HA LYS 39 HA LYS 39 -17.291 15.415 0.118
216 HB2 LYS 39 2HB LYS 39 -18.002 15.092 2.896
217 HB3 LYS 39 1HB LYS 39 -17.028 16.541 2.685
218 HG2 LYS 39 2HG LYS 39 -18.573 17.470 1.157
219 HG3 LYS 39 1HG LYS 39 -19.439 15.940 0.994
220 HD2 LYS 39 2HD LYS 39 -20.786 17.232 2.412
221 HD3 LYS 39 1HD LYS 39 -19.911 16.150 3.500
222 HE2 LYS 39 2HE LYS 39 -18.487 18.638 2.991
223 HE3 LYS 39 1HE LYS 39 -20.076 18.897 3.712
224 HZ1 LYS 39 3HZ LYS 39 -19.425 17.226 5.425
225 HZ2 LYS 39 1HZ LYS 39 -18.520 18.654 5.464
226 HZ3 LYS 39 2HZ LYS 39 -17.858 17.251 4.792
227 HA PRO 40 HA PRO 40 -13.170 16.821 2.206
228 HB2 PRO 40 2HB PRO 40 -12.048 15.112 4.020
229 HB3 PRO 40 1HB PRO 40 -13.134 16.432 4.466
230 HG2 PRO 40 2HG PRO 40 -13.740 13.521 4.104
231 HG3 PRO 40 1HG PRO 40 -14.284 14.627 5.380
232 HD2 PRO 40 2HD PRO 40 -15.879 13.960 3.324
233 HD3 PRO 40 1HD PRO 40 -15.905 15.586 4.033
234 H ARG 41 H ARG 41 -11.832 16.543 0.531
235 HA ARG 41 HA ARG 41 -10.834 13.827 -0.024
236 HB2 ARG 41 2HB ARG 41 -10.602 14.498 -2.378
237 HB3 ARG 41 1HB ARG 41 -12.270 14.602 -1.832
238 HG2 ARG 41 2HG ARG 41 -11.417 17.121 -1.334
239 HG3 ARG 41 1HG ARG 41 -10.443 16.708 -2.746
240 HD2 ARG 41 2HD ARG 41 -12.869 15.780 -3.512
241 HD3 ARG 41 1HD ARG 41 -13.343 17.147 -2.504
242 HE ARG 41 HE ARG 41 -11.432 18.199 -4.099
243 HH11 ARG 41 1HH1 ARG 41 -14.334 16.370 -4.744
244 HH12 ARG 41 2HH1 ARG 41 -14.608 17.110 -6.285
245 HH21 ARG 41 1HH2 ARG 41 -11.792 19.173 -6.125
246 HH22 ARG 41 2HH2 ARG 41 -13.164 18.702 -7.070
247 H THR 42 H THR 42 -8.912 13.840 1.020
248 HA THR 42 HA THR 42 -6.986 15.918 0.217
249 HB THR 42 HB THR 42 -6.992 14.525 2.896
250 HG1 THR 42 1HG THR 42 -8.051 17.058 2.190
251 HG21 THR 42 3HG2 THR 42 -4.875 15.381 2.681
252 HG22 THR 42 1HG2 THR 42 -5.726 16.721 3.448
253 HG23 THR 42 2HG2 THR 42 -5.411 16.755 1.713
254 H ALA 43 H ALA 43 -4.699 15.213 0.427
255 HA ALA 43 HA ALA 43 -4.176 12.938 -1.082
256 HB1 ALA 43 3HB ALA 43 -2.183 14.127 0.826
257 HB2 ALA 43 1HB ALA 43 -2.674 14.950 -0.653
258 HB3 ALA 43 2HB ALA 43 -1.893 13.371 -0.742
259 H GLN 44 H GLN 44 -4.428 13.334 2.387
260 HA GLN 44 HA GLN 44 -3.186 10.973 3.215
261 HB2 GLN 44 2HB GLN 44 -5.286 12.748 4.385
262 HB3 GLN 44 1HB GLN 44 -4.948 11.205 5.156
263 HG2 GLN 44 2HG GLN 44 -2.631 11.825 5.459
264 HG3 GLN 44 1HG GLN 44 -2.903 13.341 4.603
265 HE21 GLN 44 1HE2 GLN 44 -2.028 14.272 6.581
266 HE22 GLN 44 2HE2 GLN 44 -3.093 14.565 7.909
267 H ASP 45 H ASP 45 -6.341 11.541 1.846
268 HA ASP 45 HA ASP 45 -7.497 9.055 2.595
269 HB2 ASP 45 2HB ASP 45 -8.187 11.160 0.568
270 HB3 ASP 45 1HB ASP 45 -9.067 9.636 0.610
271 H GLU 46 H GLU 46 -5.653 10.153 -0.191
272 HA GLU 46 HA GLU 46 -6.091 7.840 -1.777
273 HB2 GLU 46 2HB GLU 46 -5.215 10.199 -2.456
274 HB3 GLU 46 1HB GLU 46 -3.640 9.547 -2.030
275 HG2 GLU 46 2HG GLU 46 -3.497 8.387 -3.916
276 HG3 GLU 46 1HG GLU 46 -5.135 7.756 -3.748
277 H LYS 47 H LYS 47 -3.595 8.760 0.531
278 HA LYS 47 HA LYS 47 -1.909 6.530 0.025
279 HB2 LYS 47 2HB LYS 47 -0.867 7.105 2.204
280 HB3 LYS 47 1HB LYS 47 -1.012 8.489 1.128
281 HG2 LYS 47 2HG LYS 47 -2.798 9.391 2.366
282 HG3 LYS 47 1HG LYS 47 -3.029 7.896 3.272
283 HD2 LYS 47 2HD LYS 47 -1.918 9.351 4.752
284 HD3 LYS 47 1HD LYS 47 -0.672 8.250 4.160
285 HE2 LYS 47 2HE LYS 47 0.019 9.942 2.518
286 HE3 LYS 47 1HE LYS 47 -1.206 11.042 3.149
287 HZ1 LYS 47 3HZ LYS 47 1.380 10.336 4.239
288 HZ2 LYS 47 1HZ LYS 47 0.128 10.397 5.376
289 HZ3 LYS 47 2HZ LYS 47 0.476 11.753 4.427
290 H PHE 48 H PHE 48 -4.588 7.139 2.205
291 HA PHE 48 HA PHE 48 -4.351 4.832 3.787
292 HB2 PHE 48 2HB PHE 48 -5.904 7.007 3.934
293 HB3 PHE 48 1HB PHE 48 -7.065 5.896 3.215
294 HD1 PHE 48 1HD PHE 48 -7.663 3.802 4.414
295 HD2 PHE 48 2HD PHE 48 -5.298 6.852 6.209
296 HE1 PHE 48 1HE PHE 48 -8.134 2.857 6.637
297 HE2 PHE 48 2HE PHE 48 -5.766 5.912 8.434
298 HZ PHE 48 HZ PHE 48 -7.185 3.911 8.649
299 H LEU 49 H LEU 49 -6.211 5.438 0.826
300 HA LEU 49 HA LEU 49 -7.358 2.834 0.763
301 HB2 LEU 49 2HB LEU 49 -7.921 3.381 -1.602
302 HB3 LEU 49 1HB LEU 49 -8.484 4.557 -0.432
303 HG LEU 49 HG LEU 49 -6.249 5.793 -1.062
304 HD11 LEU 49 1HD1 LEU 49 -6.010 3.622 -2.728
305 HD12 LEU 49 2HD1 LEU 49 -5.162 5.158 -2.905
306 HD13 LEU 49 3HD1 LEU 49 -6.657 4.870 -3.792
307 HD21 LEU 49 3HD2 LEU 49 -7.596 6.744 -3.101
308 HD22 LEU 49 1HD2 LEU 49 -8.161 6.995 -1.448
309 HD23 LEU 49 2HD2 LEU 49 -8.883 5.732 -2.445
310 H ARG 50 H ARG 50 -4.468 4.277 -0.608
311 HA ARG 50 HA ARG 50 -3.741 2.080 -2.245
312 HB2 ARG 50 2HB ARG 50 -2.722 4.654 -1.675
313 HB3 ARG 50 1HB ARG 50 -1.431 3.516 -1.312
314 HG2 ARG 50 2HG ARG 50 -1.437 2.664 -3.517
315 HG3 ARG 50 1HG ARG 50 -2.951 3.483 -3.901
316 HD2 ARG 50 2HD ARG 50 -1.941 5.554 -4.071
317 HD3 ARG 50 1HD ARG 50 -0.579 5.087 -3.054
318 HE ARG 50 HE ARG 50 -0.711 3.665 -5.551
319 HH11 ARG 50 1HH1 ARG 50 0.448 6.540 -3.947
320 HH12 ARG 50 2HH1 ARG 50 1.717 6.818 -5.090
321 HH21 ARG 50 1HH2 ARG 50 0.957 4.030 -7.058
322 HH22 ARG 50 2HH2 ARG 50 2.007 5.393 -6.857
323 H GLU 51 H GLU 51 -3.076 2.960 1.090
324 HA GLU 51 HA GLU 51 -1.129 0.981 1.607
325 HB2 GLU 51 2HB GLU 51 -2.573 2.984 3.099
326 HB3 GLU 51 1HB GLU 51 -2.494 1.484 4.015
327 HG2 GLU 51 2HG GLU 51 0.002 1.504 3.504
328 HG3 GLU 51 1HG GLU 51 -0.237 3.177 3.003
329 H SER 52 H SER 52 -4.614 0.928 1.563
330 HA SER 52 HA SER 52 -4.667 -1.752 2.737
331 HB2 SER 52 2HB SER 52 -6.981 0.020 1.914
332 HB3 SER 52 1HB SER 52 -7.084 -1.475 2.845
333 HG SER 52 HG SER 52 -5.648 0.826 3.676
334 H ALA 53 H ALA 53 -3.574 -1.196 0.049
335 HA ALA 53 HA ALA 53 -5.512 -2.634 -1.628
336 HB1 ALA 53 3HB ALA 53 -3.121 -0.959 -2.372
337 HB2 ALA 53 1HB ALA 53 -4.823 -0.569 -2.621
338 HB3 ALA 53 2HB ALA 53 -4.079 -1.886 -3.526
339 H CYS 54 H CYS 54 -5.022 -4.572 -2.554
340 HA CYS 54 HA CYS 54 -2.736 -5.981 -1.440
341 HB2 CYS 54 2HB CYS 54 -3.802 -7.983 -2.529
342 HB3 CYS 54 1HB CYS 54 -4.804 -7.174 -1.331
343 H GLY 55 H GLY 55 -1.748 -4.127 -3.091
344 HA2 GLY 55 2HA GLY 55 -0.507 -3.747 -4.994
345 HA3 GLY 55 1HA GLY 55 -0.052 -5.432 -4.793
346 H PHE 56 H PHE 56 0.102 -5.765 -7.021
347 HA PHE 56 HA PHE 56 -0.629 -6.423 -9.069
348 HB2 PHE 56 2HB PHE 56 -2.709 -7.187 -7.225
349 HB3 PHE 56 1HB PHE 56 -3.416 -6.737 -8.772
350 HD1 PHE 56 2HD PHE 56 -1.537 -7.644 -10.733
351 HD2 PHE 56 1HD PHE 56 -2.668 -9.476 -7.063
352 HE1 PHE 56 2HE PHE 56 -0.931 -9.845 -11.650
353 HE2 PHE 56 1HE PHE 56 -2.065 -11.681 -7.973
354 HZ PHE 56 HZ PHE 56 -1.194 -11.868 -10.270
355 H ASP 57 H ASP 57 -1.554 -5.598 -10.962
356 HA ASP 57 HA ASP 57 -2.316 -3.978 -12.363
357 HB2 ASP 57 2HB ASP 57 -4.175 -3.809 -10.048
358 HB3 ASP 57 1HB ASP 57 -4.193 -2.470 -11.191
359 H GLY 58 H GLY 58 -0.989 -2.384 -12.903
360 HA2 GLY 58 2HA GLY 58 0.098 -0.633 -10.845
361 HA3 GLY 58 1HA GLY 58 0.630 -0.731 -12.516
362 H GLN 59 H GLN 59 -2.221 -0.511 -13.431
363 HA GLN 59 HA GLN 59 -2.426 2.406 -13.128
364 HB2 GLN 59 2HB GLN 59 -2.266 0.937 -15.419
365 HB3 GLN 59 1HB GLN 59 -4.007 1.099 -15.243
366 HG2 GLN 59 2HG GLN 59 -3.527 3.604 -14.916
367 HG3 GLN 59 1HG GLN 59 -1.947 3.236 -15.606
368 HE21 GLN 59 1HE2 GLN 59 -1.802 3.519 -17.702
369 HE22 GLN 59 2HE2 GLN 59 -3.093 3.407 -18.843
370 H THR 60 H THR 60 -4.290 -0.590 -13.064
371 HA THR 60 HA THR 60 -6.750 0.750 -12.397
372 HB THR 60 HB THR 60 -6.383 -2.175 -11.948
373 HG1 THR 60 1HG THR 60 -6.526 -0.993 -14.522
374 HG21 THR 60 3HG2 THR 60 -8.583 -2.230 -12.115
375 HG22 THR 60 1HG2 THR 60 -8.534 -1.424 -13.683
376 HG23 THR 60 2HG2 THR 60 -8.577 -0.468 -12.201
377 HA PRO 61 HA PRO 61 -5.497 0.930 -8.059
378 HB2 PRO 61 2HB PRO 61 -7.638 2.374 -7.217
379 HB3 PRO 61 1HB PRO 61 -6.244 3.101 -8.024
380 HG2 PRO 61 2HG PRO 61 -8.906 2.336 -9.161
381 HG3 PRO 61 1HG PRO 61 -7.951 3.804 -9.439
382 HD2 PRO 61 2HD PRO 61 -7.998 1.754 -11.200
383 HD3 PRO 61 1HD PRO 61 -6.557 2.762 -10.954
384 H LYS 62 H LYS 62 -5.946 -0.413 -6.410
385 HA LYS 62 HA LYS 62 -8.586 -1.706 -6.332
386 HB2 LYS 62 2HB LYS 62 -5.994 -3.150 -5.777
387 HB3 LYS 62 1HB LYS 62 -7.604 -3.849 -5.888
388 HG2 LYS 62 2HG LYS 62 -6.640 -2.410 -8.276
389 HG3 LYS 62 1HG LYS 62 -5.818 -3.920 -7.879
390 HD2 LYS 62 2HD LYS 62 -8.751 -4.022 -7.728
391 HD3 LYS 62 1HD LYS 62 -8.097 -3.748 -9.343
392 HE2 LYS 62 2HE LYS 62 -8.030 -6.013 -9.359
393 HE3 LYS 62 1HE LYS 62 -6.482 -5.728 -8.565
394 HZ1 LYS 62 3HZ LYS 62 -9.059 -6.422 -7.272
395 HZ2 LYS 62 1HZ LYS 62 -7.687 -5.934 -6.413
396 HZ3 LYS 62 2HZ LYS 62 -7.651 -7.358 -7.323
397 H VAL 63 H VAL 63 -9.099 -2.668 -4.215
398 HA VAL 63 HA VAL 63 -7.565 -1.635 -1.958
399 HB VAL 63 HB VAL 63 -10.524 -1.077 -2.180
400 HG11 VAL 63 1HG1 VAL 63 -9.870 -1.277 0.094
401 HG12 VAL 63 2HG1 VAL 63 -9.995 0.448 -0.249
402 HG13 VAL 63 3HG1 VAL 63 -8.411 -0.323 -0.172
403 HG21 VAL 63 3HG2 VAL 63 -8.193 0.793 -2.597
404 HG22 VAL 63 1HG2 VAL 63 -9.884 1.283 -2.478
405 HG23 VAL 63 2HG2 VAL 63 -9.352 0.268 -3.820
406 H CYS 64 H CYS 64 -8.125 -2.609 0.069
407 HA CYS 64 HA CYS 64 -9.290 -5.278 -0.274
408 HB2 CYS 64 2HB CYS 64 -6.922 -4.838 0.692
409 HB3 CYS 64 1HB CYS 64 -7.775 -4.366 2.157
410 H CYS 65 H CYS 65 -11.121 -5.877 0.718
411 HA CYS 65 HA CYS 65 -12.206 -4.144 2.830
412 HB2 CYS 65 2HB CYS 65 -13.299 -4.609 0.200
413 HB3 CYS 65 1HB CYS 65 -14.412 -5.193 1.432
414 HA PRO 66 HA PRO 66 -12.354 -8.235 4.711
415 HB2 PRO 66 2HB PRO 66 -13.188 -7.387 7.164
416 HB3 PRO 66 1HB PRO 66 -11.505 -7.324 6.630
417 HG2 PRO 66 2HG PRO 66 -13.544 -5.146 6.740
418 HG3 PRO 66 1HG PRO 66 -11.815 -5.087 7.118
419 HD2 PRO 66 2HD PRO 66 -12.868 -4.175 4.775
420 HD3 PRO 66 1HD PRO 66 -11.217 -4.813 4.922
Start of MODEL 9
1 H GLN 11 H GLN 11 -12.537 -11.070 -4.652
2 HA GLN 11 HA GLN 11 -10.618 -12.630 -4.939
3 HB2 GLN 11 2HB GLN 11 -9.608 -10.791 -6.534
4 HB3 GLN 11 1HB GLN 11 -8.990 -10.119 -5.033
5 HG2 GLN 11 2HG GLN 11 -8.263 -12.707 -4.757
6 HG3 GLN 11 1HG GLN 11 -8.177 -12.523 -6.508
7 HE21 GLN 11 1HE2 GLN 11 -6.290 -12.561 -3.975
8 HE22 GLN 11 2HE2 GLN 11 -5.116 -11.364 -4.390
9 H ALA 12 H ALA 12 -9.595 -13.107 -3.001
10 HA ALA 12 HA ALA 12 -10.420 -11.449 -0.746
11 HB1 ALA 12 3HB ALA 12 -10.122 -13.332 0.619
12 HB2 ALA 12 1HB ALA 12 -9.067 -14.121 -0.552
13 HB3 ALA 12 2HB ALA 12 -10.793 -13.972 -0.882
14 H CYS 13 H CYS 13 -9.069 -10.064 0.181
15 HA CYS 13 HA CYS 13 -6.175 -10.548 -0.079
16 HB2 CYS 13 2HB CYS 13 -6.106 -8.580 -1.148
17 HB3 CYS 13 1HB CYS 13 -7.781 -8.237 -0.756
18 H THR 14 H THR 14 -4.847 -9.652 1.672
19 HA THR 14 HA THR 14 -6.247 -9.884 4.248
20 HB THR 14 HB THR 14 -4.499 -11.570 3.815
21 HG1 THR 14 1HG THR 14 -3.346 -11.201 5.759
22 HG21 THR 14 3HG2 THR 14 -2.210 -11.065 3.631
23 HG22 THR 14 1HG2 THR 14 -2.484 -9.353 3.947
24 HG23 THR 14 2HG2 THR 14 -3.030 -10.068 2.431
25 H LEU 15 H LEU 15 -6.609 -8.036 5.251
26 HA LEU 15 HA LEU 15 -5.511 -5.559 4.545
27 HB2 LEU 15 2HB LEU 15 -6.381 -4.879 6.871
28 HB3 LEU 15 1HB LEU 15 -7.537 -5.436 5.677
29 HG LEU 15 HG LEU 15 -6.476 -7.552 7.424
30 HD11 LEU 15 1HD1 LEU 15 -8.520 -5.838 8.715
31 HD12 LEU 15 2HD1 LEU 15 -6.840 -5.307 8.792
32 HD13 LEU 15 3HD1 LEU 15 -7.297 -6.885 9.433
33 HD21 LEU 15 3HD2 LEU 15 -8.392 -8.526 6.843
34 HD22 LEU 15 1HD2 LEU 15 -8.634 -7.180 5.729
35 HD23 LEU 15 2HD2 LEU 15 -9.343 -7.128 7.344
36 HA PRO 16 HA PRO 16 -1.596 -5.051 6.490
37 HB2 PRO 16 2HB PRO 16 -2.110 -2.915 8.237
38 HB3 PRO 16 1HB PRO 16 -1.568 -2.784 6.563
39 HG2 PRO 16 2HG PRO 16 -4.316 -2.553 7.692
40 HG3 PRO 16 1HG PRO 16 -3.576 -1.672 6.342
41 HD2 PRO 16 2HD PRO 16 -5.335 -3.633 5.904
42 HD3 PRO 16 1HD PRO 16 -3.922 -3.421 4.849
43 H ASN 17 H ASN 17 -4.440 -5.265 8.506
44 HA ASN 17 HA ASN 17 -2.944 -5.892 10.900
45 HB2 ASN 17 2HB ASN 17 -5.395 -4.805 10.519
46 HB3 ASN 17 1HB ASN 17 -5.840 -6.485 10.807
47 HD21 ASN 17 1HD2 ASN 17 -6.540 -6.599 12.816
48 HD22 ASN 17 2HD2 ASN 17 -5.735 -5.962 14.207
49 H ASN 18 H ASN 18 -4.100 -7.594 8.190
50 HA ASN 18 HA ASN 18 -4.073 -9.789 7.615
51 HB2 ASN 18 2HB ASN 18 -2.236 -9.686 9.934
52 HB3 ASN 18 1HB ASN 18 -2.865 -11.278 9.521
53 HD21 ASN 18 1HD2 ASN 18 -2.085 -12.319 7.779
54 HD22 ASN 18 2HD2 ASN 18 -0.871 -11.685 6.727
55 H ASP 19 H ASP 19 -6.341 -9.897 7.817
56 HA ASP 19 HA ASP 19 -7.206 -11.784 9.837
57 HB2 ASP 19 2HB ASP 19 -8.238 -8.966 9.686
58 HB3 ASP 19 1HB ASP 19 -9.267 -10.267 10.275
59 H LYS 20 H LYS 20 -6.902 -11.522 6.855
60 HA LYS 20 HA LYS 20 -7.963 -12.271 4.989
61 HB2 LYS 20 2HB LYS 20 -10.156 -13.251 6.815
62 HB3 LYS 20 1HB LYS 20 -9.728 -13.865 5.224
63 HG2 LYS 20 2HG LYS 20 -7.995 -15.092 6.009
64 HG3 LYS 20 1HG LYS 20 -7.625 -13.950 7.303
65 HD2 LYS 20 2HD LYS 20 -10.220 -15.322 7.529
66 HD3 LYS 20 1HD LYS 20 -8.801 -16.358 7.686
67 HE2 LYS 20 2HE LYS 20 -7.925 -14.705 9.372
68 HE3 LYS 20 1HE LYS 20 -9.510 -13.936 9.326
69 HZ1 LYS 20 3HZ LYS 20 -9.058 -15.682 11.120
70 HZ2 LYS 20 1HZ LYS 20 -9.248 -16.822 9.883
71 HZ3 LYS 20 2HZ LYS 20 -10.519 -15.778 10.275
72 H GLY 21 H GLY 21 -9.181 -11.279 3.474
73 HA2 GLY 21 2HA GLY 21 -11.660 -9.974 4.133
74 HA3 GLY 21 1HA GLY 21 -10.351 -8.849 3.806
75 H THR 22 H THR 22 -12.059 -8.297 2.124
76 HA THR 22 HA THR 22 -11.511 -9.843 -0.326
77 HB THR 22 HB THR 22 -14.036 -8.267 0.051
78 HG1 THR 22 1HG THR 22 -14.839 -9.711 1.330
79 HG21 THR 22 3HG2 THR 22 -13.008 -9.864 -2.019
80 HG22 THR 22 1HG2 THR 22 -14.597 -9.108 -1.909
81 HG23 THR 22 2HG2 THR 22 -14.357 -10.749 -1.309
82 H CYS 23 H CYS 23 -10.681 -8.672 -1.986
83 HA CYS 23 HA CYS 23 -10.793 -5.743 -1.716
84 HB2 CYS 23 2HB CYS 23 -8.618 -5.597 -2.764
85 HB3 CYS 23 1HB CYS 23 -8.529 -6.634 -1.349
86 H LYS 24 H LYS 24 -11.647 -4.627 -3.298
87 HA LYS 24 HA LYS 24 -11.690 -5.665 -6.018
88 HB2 LYS 24 2HB LYS 24 -14.211 -4.731 -5.959
89 HB3 LYS 24 1HB LYS 24 -13.809 -6.419 -5.677
90 HG2 LYS 24 2HG LYS 24 -15.377 -5.695 -4.019
91 HG3 LYS 24 1HG LYS 24 -13.817 -5.978 -3.245
92 HD2 LYS 24 2HD LYS 24 -13.896 -3.266 -4.092
93 HD3 LYS 24 1HD LYS 24 -15.403 -3.614 -3.248
94 HE2 LYS 24 2HE LYS 24 -14.359 -3.529 -1.290
95 HE3 LYS 24 1HE LYS 24 -13.239 -4.789 -1.802
96 HZ1 LYS 24 3HZ LYS 24 -12.258 -2.648 -3.074
97 HZ2 LYS 24 1HZ LYS 24 -11.726 -3.174 -1.557
98 HZ3 LYS 24 2HZ LYS 24 -12.860 -1.925 -1.670
99 H SER 25 H SER 25 -12.627 -3.920 -7.529
100 HA SER 25 HA SER 25 -11.116 -1.616 -7.352
101 HB2 SER 25 2HB SER 25 -12.445 -2.577 -9.358
102 HB3 SER 25 1HB SER 25 -13.789 -1.617 -8.739
103 HG SER 25 HG SER 25 -11.222 -0.617 -9.429
104 H LEU 26 H LEU 26 -12.194 0.676 -7.403
105 HA LEU 26 HA LEU 26 -13.461 0.998 -4.813
106 HB2 LEU 26 2HB LEU 26 -13.091 3.401 -5.179
107 HB3 LEU 26 1HB LEU 26 -11.620 2.461 -5.347
108 HG LEU 26 HG LEU 26 -12.731 2.659 -7.936
109 HD11 LEU 26 1HD1 LEU 26 -13.249 4.863 -8.319
110 HD12 LEU 26 2HD1 LEU 26 -12.390 5.428 -6.885
111 HD13 LEU 26 3HD1 LEU 26 -13.951 4.625 -6.719
112 HD21 LEU 26 3HD2 LEU 26 -10.658 3.564 -8.488
113 HD22 LEU 26 1HD2 LEU 26 -10.314 2.595 -7.056
114 HD23 LEU 26 2HD2 LEU 26 -10.473 4.346 -6.917
115 H LEU 27 H LEU 27 -15.147 -0.259 -6.662
116 HA LEU 27 HA LEU 27 -17.329 1.670 -6.729
117 HB2 LEU 27 2HB LEU 27 -16.365 0.158 -9.155
118 HB3 LEU 27 1HB LEU 27 -17.929 0.941 -9.057
119 HG LEU 27 HG LEU 27 -15.514 2.595 -8.517
120 HD11 LEU 27 1HD1 LEU 27 -16.147 1.291 -11.094
121 HD12 LEU 27 2HD1 LEU 27 -14.601 1.836 -10.444
122 HD13 LEU 27 3HD1 LEU 27 -15.725 3.002 -11.142
123 HD21 LEU 27 3HD2 LEU 27 -17.335 3.934 -8.332
124 HD22 LEU 27 1HD2 LEU 27 -18.309 2.947 -9.423
125 HD23 LEU 27 2HD2 LEU 27 -17.107 4.061 -10.077
126 H GLN 28 H GLN 28 -16.673 -0.729 -5.169
127 HA GLN 28 HA GLN 28 -19.083 -2.281 -5.814
128 HB2 GLN 28 2HB GLN 28 -16.319 -3.304 -5.258
129 HB3 GLN 28 1HB GLN 28 -17.725 -4.285 -4.866
130 HG2 GLN 28 2HG GLN 28 -18.417 -3.821 -7.319
131 HG3 GLN 28 1HG GLN 28 -16.715 -3.407 -7.533
132 HE21 GLN 28 1HE2 GLN 28 -18.296 -5.614 -8.642
133 HE22 GLN 28 2HE2 GLN 28 -17.475 -7.061 -8.175
134 H CYS 29 H CYS 29 -16.583 -1.877 -3.296
135 HA CYS 29 HA CYS 29 -18.107 -2.769 -1.148
136 HB2 CYS 29 2HB CYS 29 -15.551 -1.919 -1.433
137 HB3 CYS 29 1HB CYS 29 -16.244 -0.547 -0.573
138 H ASP 30 H ASP 30 -19.653 -1.911 0.106
139 HA ASP 30 HA ASP 30 -21.091 0.372 -0.741
140 HB2 ASP 30 2HB ASP 30 -22.452 -0.009 1.222
141 HB3 ASP 30 1HB ASP 30 -22.043 -1.557 0.504
142 H VAL 31 H VAL 31 -18.936 -0.247 1.932
143 HA VAL 31 HA VAL 31 -19.092 2.232 3.219
144 HB VAL 31 HB VAL 31 -18.032 0.253 4.236
145 HG11 VAL 31 1HG1 VAL 31 -15.511 0.771 2.735
146 HG12 VAL 31 2HG1 VAL 31 -16.772 -0.202 1.976
147 HG13 VAL 31 3HG1 VAL 31 -16.079 -0.705 3.517
148 HG21 VAL 31 3HG2 VAL 31 -17.347 1.951 5.539
149 HG22 VAL 31 1HG2 VAL 31 -16.814 2.925 4.169
150 HG23 VAL 31 2HG2 VAL 31 -15.773 1.650 4.803
151 H ALA 32 H ALA 32 -17.067 1.149 0.552
152 HA ALA 32 HA ALA 32 -15.399 3.423 0.431
153 HB1 ALA 32 3HB ALA 32 -14.672 2.614 -1.672
154 HB2 ALA 32 1HB ALA 32 -16.165 1.708 -1.920
155 HB3 ALA 32 2HB ALA 32 -15.013 1.190 -0.690
156 H SER 33 H SER 33 -18.530 2.667 -0.972
157 HA SER 33 HA SER 33 -18.700 4.853 -2.737
158 HB2 SER 33 2HB SER 33 -20.901 3.302 -1.357
159 HB3 SER 33 1HB SER 33 -21.145 4.421 -2.698
160 HG SER 33 HG SER 33 -20.782 1.966 -3.022
161 H LYS 34 H LYS 34 -19.777 4.457 0.614
162 HA LYS 34 HA LYS 34 -21.023 6.951 0.867
163 HB2 LYS 34 2HB LYS 34 -20.951 6.622 3.237
164 HB3 LYS 34 1HB LYS 34 -21.235 5.060 2.488
165 HG2 LYS 34 2HG LYS 34 -19.329 4.193 3.272
166 HG3 LYS 34 1HG LYS 34 -18.412 5.670 2.981
167 HD2 LYS 34 2HD LYS 34 -18.694 6.394 5.083
168 HD3 LYS 34 1HD LYS 34 -20.395 5.930 5.109
169 HE2 LYS 34 2HE LYS 34 -19.948 3.820 5.896
170 HE3 LYS 34 1HE LYS 34 -18.327 3.791 5.204
171 HZ1 LYS 34 3HZ LYS 34 -19.194 5.316 7.601
172 HZ2 LYS 34 1HZ LYS 34 -17.652 5.407 6.908
173 HZ3 LYS 34 2HZ LYS 34 -18.192 3.954 7.582
174 H ILE 35 H ILE 35 -17.665 5.992 1.165
175 HA ILE 35 HA ILE 35 -16.702 8.427 2.270
176 HB ILE 35 HB ILE 35 -15.179 6.428 0.589
177 HG12 ILE 35 2HG1 ILE 35 -15.121 6.509 3.585
178 HG13 ILE 35 1HG1 ILE 35 -16.437 5.671 2.767
179 HG21 ILE 35 1HG2 ILE 35 -14.177 8.408 2.629
180 HG22 ILE 35 2HG2 ILE 35 -14.090 8.628 0.882
181 HG23 ILE 35 3HG2 ILE 35 -13.202 7.313 1.652
182 HD11 ILE 35 3HD1 ILE 35 -14.035 4.818 1.561
183 HD12 ILE 35 1HD1 ILE 35 -15.144 3.892 2.575
184 HD13 ILE 35 2HD1 ILE 35 -13.798 4.764 3.309
185 H ILE 36 H ILE 36 -17.247 7.277 -1.003
186 HA ILE 36 HA ILE 36 -15.916 9.442 -2.294
187 HB ILE 36 HB ILE 36 -18.021 7.556 -3.361
188 HG12 ILE 36 2HG1 ILE 36 -15.905 6.491 -2.603
189 HG13 ILE 36 1HG1 ILE 36 -16.170 6.332 -4.335
190 HG21 ILE 36 1HG2 ILE 36 -16.656 8.350 -5.541
191 HG22 ILE 36 2HG2 ILE 36 -16.584 9.826 -4.578
192 HG23 ILE 36 3HG2 ILE 36 -18.145 9.115 -4.988
193 HD11 ILE 36 3HD1 ILE 36 -14.013 6.956 -4.419
194 HD12 ILE 36 1HD1 ILE 36 -14.075 7.775 -2.859
195 HD13 ILE 36 2HD1 ILE 36 -14.700 8.575 -4.300
196 H SER 37 H SER 37 -19.069 8.981 -0.938
197 HA SER 37 HA SER 37 -20.188 11.291 -2.293
198 HB2 SER 37 2HB SER 37 -22.259 10.676 -1.376
199 HB3 SER 37 1HB SER 37 -21.461 9.132 -1.666
200 HG SER 37 HG SER 37 -22.468 9.414 0.455
201 H LYS 38 H LYS 38 -18.981 10.405 0.886
202 HA LYS 38 HA LYS 38 -19.851 12.759 2.209
203 HB2 LYS 38 2HB LYS 38 -17.952 12.090 3.857
204 HB3 LYS 38 1HB LYS 38 -19.370 11.072 3.718
205 HG2 LYS 38 2HG LYS 38 -18.085 9.362 3.254
206 HG3 LYS 38 1HG LYS 38 -17.451 10.203 1.839
207 HD2 LYS 38 2HD LYS 38 -15.507 9.876 3.004
208 HD3 LYS 38 1HD LYS 38 -15.992 11.443 3.650
209 HE2 LYS 38 2HE LYS 38 -16.647 8.795 4.934
210 HE3 LYS 38 1HE LYS 38 -15.272 9.803 5.382
211 HZ1 LYS 38 3HZ LYS 38 -16.800 10.523 6.881
212 HZ2 LYS 38 1HZ LYS 38 -18.124 10.227 5.872
213 HZ3 LYS 38 2HZ LYS 38 -17.158 11.594 5.622
214 H LYS 39 H LYS 39 -16.531 11.831 1.311
215 HA LYS 39 HA LYS 39 -15.896 14.249 0.053
216 HB2 LYS 39 2HB LYS 39 -15.764 14.299 2.962
217 HB3 LYS 39 1HB LYS 39 -14.221 14.700 2.222
218 HG2 LYS 39 2HG LYS 39 -16.466 16.058 0.965
219 HG3 LYS 39 1HG LYS 39 -16.297 16.434 2.680
220 HD2 LYS 39 2HD LYS 39 -13.727 16.627 1.914
221 HD3 LYS 39 1HD LYS 39 -14.526 17.085 0.407
222 HE2 LYS 39 2HE LYS 39 -14.644 19.139 1.277
223 HE3 LYS 39 1HE LYS 39 -15.929 18.500 2.301
224 HZ1 LYS 39 3HZ LYS 39 -13.815 19.694 3.293
225 HZ2 LYS 39 1HZ LYS 39 -13.176 18.130 3.205
226 HZ3 LYS 39 2HZ LYS 39 -14.579 18.422 4.105
227 HA PRO 40 HA PRO 40 -12.748 10.908 -0.360
228 HB2 PRO 40 2HB PRO 40 -12.894 10.595 -3.013
229 HB3 PRO 40 1HB PRO 40 -14.083 9.860 -1.934
230 HG2 PRO 40 2HG PRO 40 -14.305 12.336 -3.594
231 HG3 PRO 40 1HG PRO 40 -15.510 11.070 -3.311
232 HD2 PRO 40 2HD PRO 40 -15.446 13.495 -1.994
233 HD3 PRO 40 1HD PRO 40 -16.225 12.030 -1.366
234 H ARG 41 H ARG 41 -11.020 10.894 -2.383
235 HA ARG 41 HA ARG 41 -9.103 11.872 -3.122
236 HB2 ARG 41 2HB ARG 41 -11.111 13.099 -4.373
237 HB3 ARG 41 1HB ARG 41 -10.478 14.486 -3.495
238 HG2 ARG 41 2HG ARG 41 -8.414 14.383 -4.588
239 HG3 ARG 41 1HG ARG 41 -8.699 12.736 -5.157
240 HD2 ARG 41 2HD ARG 41 -10.722 13.818 -6.398
241 HD3 ARG 41 1HD ARG 41 -9.820 15.316 -6.166
242 HE ARG 41 HE ARG 41 -7.999 13.591 -7.233
243 HH11 ARG 41 1HH1 ARG 41 -11.156 14.724 -8.197
244 HH12 ARG 41 2HH1 ARG 41 -10.829 14.581 -9.891
245 HH21 ARG 41 1HH2 ARG 41 -7.566 13.401 -9.462
246 HH22 ARG 41 2HH2 ARG 41 -8.790 13.830 -10.609
247 H THR 42 H THR 42 -7.884 11.914 -1.257
248 HA THR 42 HA THR 42 -7.229 14.511 -0.248
249 HB THR 42 HB THR 42 -8.144 12.597 1.872
250 HG1 THR 42 1HG THR 42 -9.774 14.486 0.526
251 HG21 THR 42 3HG2 THR 42 -7.359 14.249 3.131
252 HG22 THR 42 1HG2 THR 42 -8.787 15.153 2.628
253 HG23 THR 42 2HG2 THR 42 -7.263 15.361 1.766
254 H ALA 43 H ALA 43 -5.320 14.502 1.063
255 HA ALA 43 HA ALA 43 -3.379 12.666 0.268
256 HB1 ALA 43 3HB ALA 43 -3.048 14.116 2.849
257 HB2 ALA 43 1HB ALA 43 -3.200 15.049 1.360
258 HB3 ALA 43 2HB ALA 43 -1.897 13.873 1.536
259 H GLN 44 H GLN 44 -5.491 12.691 3.067
260 HA GLN 44 HA GLN 44 -4.159 10.557 4.429
261 HB2 GLN 44 2HB GLN 44 -5.827 12.396 5.321
262 HB3 GLN 44 1HB GLN 44 -7.043 11.198 4.901
263 HG2 GLN 44 2HG GLN 44 -4.920 9.958 6.374
264 HG3 GLN 44 1HG GLN 44 -5.525 11.364 7.248
265 HE21 GLN 44 1HE2 GLN 44 -6.732 8.563 5.434
266 HE22 GLN 44 2HE2 GLN 44 -8.049 8.223 6.498
267 H ASP 45 H ASP 45 -6.801 10.811 2.144
268 HA ASP 45 HA ASP 45 -7.704 8.127 2.399
269 HB2 ASP 45 2HB ASP 45 -8.229 10.413 0.601
270 HB3 ASP 45 1HB ASP 45 -8.487 8.821 -0.108
271 H GLU 46 H GLU 46 -5.317 9.746 0.399
272 HA GLU 46 HA GLU 46 -4.854 7.618 -1.399
273 HB2 GLU 46 2HB GLU 46 -3.255 10.023 -0.580
274 HB3 GLU 46 1HB GLU 46 -2.590 8.829 -1.686
275 HG2 GLU 46 2HG GLU 46 -4.345 9.235 -3.269
276 HG3 GLU 46 1HG GLU 46 -5.176 10.299 -2.136
277 H LYS 47 H LYS 47 -3.343 8.526 1.662
278 HA LYS 47 HA LYS 47 -1.336 6.521 1.579
279 HB2 LYS 47 2HB LYS 47 -1.126 6.974 4.031
280 HB3 LYS 47 1HB LYS 47 -1.004 8.406 3.019
281 HG2 LYS 47 2HG LYS 47 -3.203 9.097 3.594
282 HG3 LYS 47 1HG LYS 47 -3.542 7.560 4.392
283 HD2 LYS 47 2HD LYS 47 -3.076 9.305 6.030
284 HD3 LYS 47 1HD LYS 47 -1.830 8.056 6.071
285 HE2 LYS 47 2HE LYS 47 -0.740 10.174 6.200
286 HE3 LYS 47 1HE LYS 47 -0.434 9.511 4.596
287 HZ1 LYS 47 3HZ LYS 47 -2.383 11.630 5.312
288 HZ2 LYS 47 1HZ LYS 47 -2.299 10.905 3.785
289 HZ3 LYS 47 2HZ LYS 47 -0.990 11.800 4.370
290 H PHE 48 H PHE 48 -4.601 6.646 2.863
291 HA PHE 48 HA PHE 48 -4.509 4.177 4.244
292 HB2 PHE 48 2HB PHE 48 -6.213 6.121 4.449
293 HB3 PHE 48 1HB PHE 48 -7.035 5.337 3.104
294 HD1 PHE 48 2HD PHE 48 -7.395 2.726 3.451
295 HD2 PHE 48 1HD PHE 48 -6.866 5.570 6.572
296 HE1 PHE 48 2HE PHE 48 -8.513 1.201 5.025
297 HE2 PHE 48 1HE PHE 48 -7.983 4.050 8.152
298 HZ PHE 48 HZ PHE 48 -8.809 1.862 7.378
299 H LEU 49 H LEU 49 -5.434 5.075 0.962
300 HA LEU 49 HA LEU 49 -6.436 2.505 0.263
301 HB2 LEU 49 2HB LEU 49 -6.863 3.378 -1.800
302 HB3 LEU 49 1HB LEU 49 -6.747 4.861 -0.875
303 HG LEU 49 HG LEU 49 -4.224 4.773 -1.635
304 HD11 LEU 49 1HD1 LEU 49 -5.283 3.618 -4.128
305 HD12 LEU 49 2HD1 LEU 49 -4.994 2.481 -2.812
306 HD13 LEU 49 3HD1 LEU 49 -3.679 3.495 -3.406
307 HD21 LEU 49 3HD2 LEU 49 -6.111 5.512 -3.813
308 HD22 LEU 49 1HD2 LEU 49 -4.737 6.402 -3.155
309 HD23 LEU 49 2HD2 LEU 49 -6.254 6.334 -2.258
310 H ARG 50 H ARG 50 -3.292 4.038 0.120
311 HA ARG 50 HA ARG 50 -2.021 2.102 -1.508
312 HB2 ARG 50 2HB ARG 50 -1.282 4.481 -0.073
313 HB3 ARG 50 1HB ARG 50 -0.101 3.216 0.242
314 HG2 ARG 50 2HG ARG 50 0.403 2.984 -2.057
315 HG3 ARG 50 1HG ARG 50 -0.979 3.973 -2.529
316 HD2 ARG 50 2HD ARG 50 0.131 5.852 -1.210
317 HD3 ARG 50 1HD ARG 50 1.573 4.838 -1.199
318 HE ARG 50 HE ARG 50 0.915 4.927 -3.816
319 HH11 ARG 50 1HH1 ARG 50 1.378 7.402 -1.398
320 HH12 ARG 50 2HH1 ARG 50 1.929 8.585 -2.535
321 HH21 ARG 50 1HH2 ARG 50 1.639 6.483 -5.314
322 HH22 ARG 50 2HH2 ARG 50 2.077 8.064 -4.758
323 H GLU 51 H GLU 51 -2.525 2.397 1.957
324 HA GLU 51 HA GLU 51 -0.839 0.206 2.665
325 HB2 GLU 51 2HB GLU 51 -2.887 1.856 4.099
326 HB3 GLU 51 1HB GLU 51 -2.293 0.375 4.838
327 HG2 GLU 51 2HG GLU 51 0.024 1.270 4.573
328 HG3 GLU 51 1HG GLU 51 -0.692 2.796 4.053
329 H SER 52 H SER 52 -4.198 0.564 1.784
330 HA SER 52 HA SER 52 -4.552 -2.342 2.120
331 HB2 SER 52 2HB SER 52 -6.835 -0.374 2.107
332 HB3 SER 52 1HB SER 52 -6.812 -2.033 2.712
333 HG SER 52 HG SER 52 -6.661 -0.156 4.265
334 H ALA 53 H ALA 53 -3.385 -1.476 -0.175
335 HA ALA 53 HA ALA 53 -5.522 -1.368 -2.183
336 HB1 ALA 53 3HB ALA 53 -2.699 -0.470 -2.117
337 HB2 ALA 53 1HB ALA 53 -4.122 0.310 -2.807
338 HB3 ALA 53 2HB ALA 53 -3.340 -1.017 -3.667
339 H CYS 54 H CYS 54 -5.806 -2.942 -3.683
340 HA CYS 54 HA CYS 54 -4.251 -5.404 -3.300
341 HB2 CYS 54 2HB CYS 54 -6.941 -5.058 -3.262
342 HB3 CYS 54 1HB CYS 54 -6.699 -5.489 -4.950
343 H GLY 55 H GLY 55 -3.337 -3.125 -4.903
344 HA2 GLY 55 2HA GLY 55 -3.704 -3.719 -7.666
345 HA3 GLY 55 1HA GLY 55 -2.477 -2.662 -6.990
346 H PHE 56 H PHE 56 -2.475 -4.831 -9.090
347 HA PHE 56 HA PHE 56 -0.050 -6.156 -8.123
348 HB2 PHE 56 2HB PHE 56 -2.544 -7.479 -8.508
349 HB3 PHE 56 1HB PHE 56 -1.453 -8.013 -9.782
350 HD1 PHE 56 2HD PHE 56 0.603 -9.205 -9.239
351 HD2 PHE 56 1HD PHE 56 -2.149 -8.035 -6.211
352 HE1 PHE 56 2HE PHE 56 1.688 -10.749 -7.660
353 HE2 PHE 56 1HE PHE 56 -1.068 -9.576 -4.627
354 HZ PHE 56 HZ PHE 56 0.853 -10.936 -5.352
355 H ASP 57 H ASP 57 -0.634 -3.930 -9.959
356 HA ASP 57 HA ASP 57 0.769 -4.999 -12.302
357 HB2 ASP 57 2HB ASP 57 -1.902 -3.874 -12.258
358 HB3 ASP 57 1HB ASP 57 -0.838 -2.928 -13.292
359 H GLY 58 H GLY 58 -0.257 -2.078 -10.556
360 HA2 GLY 58 2HA GLY 58 1.567 -0.628 -9.745
361 HA3 GLY 58 1HA GLY 58 2.326 -0.857 -11.312
362 H GLN 59 H GLN 59 -1.112 -0.305 -10.835
363 HA GLN 59 HA GLN 59 -1.164 2.469 -11.147
364 HB2 GLN 59 2HB GLN 59 -0.380 1.221 -13.512
365 HB3 GLN 59 1HB GLN 59 -2.088 1.563 -13.752
366 HG2 GLN 59 2HG GLN 59 -1.657 3.920 -13.141
367 HG3 GLN 59 1HG GLN 59 0.063 3.543 -13.041
368 HE21 GLN 59 1HE2 GLN 59 -2.091 4.974 -14.929
369 HE22 GLN 59 2HE2 GLN 59 -1.421 4.662 -16.491
370 H THR 60 H THR 60 -2.732 -0.587 -11.939
371 HA THR 60 HA THR 60 -5.361 0.277 -12.180
372 HB THR 60 HB THR 60 -4.691 -1.988 -12.746
373 HG1 THR 60 1HG THR 60 -6.537 -2.057 -10.597
374 HG21 THR 60 3HG2 THR 60 -3.073 -2.333 -10.898
375 HG22 THR 60 1HG2 THR 60 -4.192 -3.674 -11.139
376 HG23 THR 60 2HG2 THR 60 -4.440 -2.548 -9.804
377 HA PRO 61 HA PRO 61 -5.990 1.687 -7.955
378 HB2 PRO 61 2HB PRO 61 -8.513 2.600 -8.299
379 HB3 PRO 61 1HB PRO 61 -7.095 3.488 -8.869
380 HG2 PRO 61 2HG PRO 61 -8.965 1.721 -10.400
381 HG3 PRO 61 1HG PRO 61 -8.280 3.291 -10.861
382 HD2 PRO 61 2HD PRO 61 -7.293 0.932 -11.769
383 HD3 PRO 61 1HD PRO 61 -6.278 2.366 -11.517
384 H LYS 62 H LYS 62 -6.269 0.124 -6.483
385 HA LYS 62 HA LYS 62 -8.840 -1.284 -6.431
386 HB2 LYS 62 2HB LYS 62 -6.121 -2.505 -6.559
387 HB3 LYS 62 1HB LYS 62 -7.338 -3.291 -5.563
388 HG2 LYS 62 2HG LYS 62 -8.144 -2.553 -8.307
389 HG3 LYS 62 1HG LYS 62 -6.975 -3.863 -8.139
390 HD2 LYS 62 2HD LYS 62 -8.482 -5.074 -6.689
391 HD3 LYS 62 1HD LYS 62 -9.626 -3.730 -6.704
392 HE2 LYS 62 2HE LYS 62 -10.187 -4.092 -8.956
393 HE3 LYS 62 1HE LYS 62 -8.776 -5.113 -9.229
394 HZ1 LYS 62 3HZ LYS 62 -10.289 -6.741 -8.980
395 HZ2 LYS 62 1HZ LYS 62 -11.356 -5.785 -8.080
396 HZ3 LYS 62 2HZ LYS 62 -10.017 -6.494 -7.329
397 H VAL 63 H VAL 63 -9.409 -2.137 -4.334
398 HA VAL 63 HA VAL 63 -7.835 -1.134 -2.077
399 HB VAL 63 HB VAL 63 -10.802 -0.617 -2.298
400 HG11 VAL 63 1HG1 VAL 63 -8.729 0.229 -0.282
401 HG12 VAL 63 2HG1 VAL 63 -10.084 -0.868 -0.018
402 HG13 VAL 63 3HG1 VAL 63 -10.381 0.841 -0.335
403 HG21 VAL 63 3HG2 VAL 63 -8.570 1.394 -2.536
404 HG22 VAL 63 1HG2 VAL 63 -10.301 1.688 -2.706
405 HG23 VAL 63 2HG2 VAL 63 -9.448 0.722 -3.911
406 H CYS 64 H CYS 64 -8.218 -2.209 -0.105
407 HA CYS 64 HA CYS 64 -9.494 -4.833 -0.431
408 HB2 CYS 64 2HB CYS 64 -7.041 -4.507 0.345
409 HB3 CYS 64 1HB CYS 64 -7.749 -4.052 1.890
410 H CYS 65 H CYS 65 -11.324 -5.317 0.582
411 HA CYS 65 HA CYS 65 -12.234 -3.542 2.749
412 HB2 CYS 65 2HB CYS 65 -13.578 -4.568 0.339
413 HB3 CYS 65 1HB CYS 65 -14.529 -4.701 1.814
414 HA PRO 66 HA PRO 66 -11.980 -7.421 5.028
415 HB2 PRO 66 2HB PRO 66 -12.546 -6.397 7.464
416 HB3 PRO 66 1HB PRO 66 -10.966 -6.197 6.700
417 HG2 PRO 66 2HG PRO 66 -13.258 -4.275 6.840
418 HG3 PRO 66 1HG PRO 66 -11.527 -3.971 7.078
419 HD2 PRO 66 2HD PRO 66 -12.815 -3.415 4.753
420 HD3 PRO 66 1HD PRO 66 -11.103 -3.882 4.817
Start of MODEL 10
1 H GLN 11 H GLN 11 -11.751 -12.029 -5.847
2 HA GLN 11 HA GLN 11 -10.373 -13.256 -4.487
3 HB2 GLN 11 2HB GLN 11 -9.542 -11.105 -5.911
4 HB3 GLN 11 1HB GLN 11 -8.881 -10.704 -4.332
5 HG2 GLN 11 2HG GLN 11 -7.134 -11.879 -5.141
6 HG3 GLN 11 1HG GLN 11 -8.056 -13.222 -4.468
7 HE21 GLN 11 1HE2 GLN 11 -9.111 -14.638 -5.843
8 HE22 GLN 11 2HE2 GLN 11 -8.781 -14.703 -7.537
9 H ALA 12 H ALA 12 -9.107 -13.498 -2.556
10 HA ALA 12 HA ALA 12 -10.234 -11.998 -0.290
11 HB1 ALA 12 3HB ALA 12 -10.760 -14.123 0.281
12 HB2 ALA 12 1HB ALA 12 -9.111 -14.111 0.910
13 HB3 ALA 12 2HB ALA 12 -9.448 -14.821 -0.670
14 H CYS 13 H CYS 13 -8.946 -10.539 0.610
15 HA CYS 13 HA CYS 13 -6.035 -11.008 0.542
16 HB2 CYS 13 2HB CYS 13 -5.683 -8.618 0.409
17 HB3 CYS 13 1HB CYS 13 -6.748 -9.119 -0.899
18 H THR 14 H THR 14 -4.853 -9.798 2.297
19 HA THR 14 HA THR 14 -6.344 -10.102 4.812
20 HB THR 14 HB THR 14 -4.460 -11.578 4.717
21 HG1 THR 14 1HG THR 14 -4.018 -11.062 6.684
22 HG21 THR 14 3HG2 THR 14 -2.160 -10.101 4.719
23 HG22 THR 14 1HG2 THR 14 -3.119 -9.331 3.454
24 HG23 THR 14 2HG2 THR 14 -2.772 -11.058 3.370
25 H LEU 15 H LEU 15 -6.989 -8.277 5.720
26 HA LEU 15 HA LEU 15 -6.197 -5.710 4.950
27 HB2 LEU 15 2HB LEU 15 -7.220 -5.062 7.227
28 HB3 LEU 15 1HB LEU 15 -8.255 -5.795 6.016
29 HG LEU 15 HG LEU 15 -7.008 -7.702 7.882
30 HD11 LEU 15 1HD1 LEU 15 -7.865 -5.408 9.067
31 HD12 LEU 15 2HD1 LEU 15 -7.853 -6.995 9.833
32 HD13 LEU 15 3HD1 LEU 15 -9.331 -6.387 9.086
33 HD21 LEU 15 3HD2 LEU 15 -8.818 -8.927 7.378
34 HD22 LEU 15 1HD2 LEU 15 -9.022 -7.775 6.059
35 HD23 LEU 15 2HD2 LEU 15 -9.920 -7.563 7.563
36 HA PRO 16 HA PRO 16 -2.439 -4.618 6.954
37 HB2 PRO 16 2HB PRO 16 -3.281 -2.480 8.570
38 HB3 PRO 16 1HB PRO 16 -2.696 -2.367 6.910
39 HG2 PRO 16 2HG PRO 16 -5.492 -2.420 7.937
40 HG3 PRO 16 1HG PRO 16 -4.814 -1.532 6.558
41 HD2 PRO 16 2HD PRO 16 -6.304 -3.723 6.197
42 HD3 PRO 16 1HD PRO 16 -4.896 -3.394 5.165
43 H ASN 17 H ASN 17 -5.289 -5.091 8.918
44 HA ASN 17 HA ASN 17 -3.768 -5.420 11.362
45 HB2 ASN 17 2HB ASN 17 -6.639 -5.320 10.627
46 HB3 ASN 17 1HB ASN 17 -6.225 -6.284 12.041
47 HD21 ASN 17 1HD2 ASN 17 -7.378 -4.802 13.331
48 HD22 ASN 17 2HD2 ASN 17 -6.693 -3.277 13.766
49 H ASN 18 H ASN 18 -4.708 -7.364 8.735
50 HA ASN 18 HA ASN 18 -4.412 -9.569 8.276
51 HB2 ASN 18 2HB ASN 18 -2.636 -9.090 10.535
52 HB3 ASN 18 1HB ASN 18 -3.237 -10.745 10.509
53 HD21 ASN 18 1HD2 ASN 18 -1.825 -12.030 9.590
54 HD22 ASN 18 2HD2 ASN 18 -0.887 -11.679 8.182
55 H ASP 19 H ASP 19 -6.674 -9.864 8.356
56 HA ASP 19 HA ASP 19 -7.498 -11.755 10.378
57 HB2 ASP 19 2HB ASP 19 -8.471 -8.965 10.338
58 HB3 ASP 19 1HB ASP 19 -9.719 -10.198 10.484
59 H LYS 20 H LYS 20 -7.081 -11.571 7.433
60 HA LYS 20 HA LYS 20 -8.011 -12.431 5.545
61 HB2 LYS 20 2HB LYS 20 -10.339 -13.406 7.181
62 HB3 LYS 20 1HB LYS 20 -9.630 -14.127 5.743
63 HG2 LYS 20 2HG LYS 20 -8.111 -13.920 8.320
64 HG3 LYS 20 1HG LYS 20 -9.192 -15.269 7.972
65 HD2 LYS 20 2HD LYS 20 -7.221 -16.131 7.195
66 HD3 LYS 20 1HD LYS 20 -7.812 -15.351 5.727
67 HE2 LYS 20 2HE LYS 20 -6.491 -13.292 6.629
68 HE3 LYS 20 1HE LYS 20 -5.634 -14.499 7.588
69 HZ1 LYS 20 3HZ LYS 20 -4.662 -15.397 5.761
70 HZ2 LYS 20 1HZ LYS 20 -4.841 -13.814 5.186
71 HZ3 LYS 20 2HZ LYS 20 -5.944 -15.013 4.726
72 H GLY 21 H GLY 21 -9.266 -11.652 3.917
73 HA2 GLY 21 2HA GLY 21 -11.785 -10.374 4.370
74 HA3 GLY 21 1HA GLY 21 -10.500 -9.207 4.092
75 H THR 22 H THR 22 -11.994 -8.709 2.256
76 HA THR 22 HA THR 22 -11.370 -10.427 -0.056
77 HB THR 22 HB THR 22 -13.802 -8.658 0.262
78 HG1 THR 22 1HG THR 22 -14.898 -10.411 0.875
79 HG21 THR 22 3HG2 THR 22 -13.383 -10.887 -1.704
80 HG22 THR 22 1HG2 THR 22 -13.050 -9.196 -2.075
81 HG23 THR 22 2HG2 THR 22 -14.687 -9.701 -1.657
82 H CYS 23 H CYS 23 -10.783 -9.411 -1.994
83 HA CYS 23 HA CYS 23 -10.143 -6.544 -1.722
84 HB2 CYS 23 2HB CYS 23 -8.262 -8.403 -1.874
85 HB3 CYS 23 1HB CYS 23 -8.602 -8.285 -3.596
86 H LYS 24 H LYS 24 -11.165 -5.258 -3.070
87 HA LYS 24 HA LYS 24 -11.770 -6.153 -5.782
88 HB2 LYS 24 2HB LYS 24 -14.086 -5.070 -5.501
89 HB3 LYS 24 1HB LYS 24 -13.842 -6.671 -4.816
90 HG2 LYS 24 2HG LYS 24 -13.676 -5.799 -2.617
91 HG3 LYS 24 1HG LYS 24 -13.587 -4.143 -3.212
92 HD2 LYS 24 2HD LYS 24 -15.795 -4.337 -2.499
93 HD3 LYS 24 1HD LYS 24 -15.905 -4.621 -4.237
94 HE2 LYS 24 2HE LYS 24 -16.411 -6.825 -3.987
95 HE3 LYS 24 1HE LYS 24 -15.469 -6.983 -2.504
96 HZ1 LYS 24 3HZ LYS 24 -18.227 -6.026 -2.857
97 HZ2 LYS 24 1HZ LYS 24 -17.323 -5.476 -1.537
98 HZ3 LYS 24 2HZ LYS 24 -17.613 -7.132 -1.735
99 H SER 25 H SER 25 -12.445 -4.325 -7.186
100 HA SER 25 HA SER 25 -10.660 -2.203 -7.060
101 HB2 SER 25 2HB SER 25 -13.334 -2.241 -8.481
102 HB3 SER 25 1HB SER 25 -11.977 -1.175 -8.847
103 HG SER 25 HG SER 25 -10.779 -3.226 -9.191
104 H LEU 26 H LEU 26 -11.681 0.187 -7.311
105 HA LEU 26 HA LEU 26 -12.873 0.716 -4.694
106 HB2 LEU 26 2HB LEU 26 -12.187 3.041 -5.072
107 HB3 LEU 26 1HB LEU 26 -10.841 1.924 -5.200
108 HG LEU 26 HG LEU 26 -11.645 2.114 -7.809
109 HD11 LEU 26 1HD1 LEU 26 -12.719 4.001 -8.262
110 HD12 LEU 26 2HD1 LEU 26 -11.537 4.950 -7.361
111 HD13 LEU 26 3HD1 LEU 26 -12.924 4.248 -6.528
112 HD21 LEU 26 3HD2 LEU 26 -9.625 3.819 -6.354
113 HD22 LEU 26 1HD2 LEU 26 -9.676 3.552 -8.097
114 HD23 LEU 26 2HD2 LEU 26 -9.354 2.203 -7.008
115 H LEU 27 H LEU 27 -14.440 -0.293 -6.981
116 HA LEU 27 HA LEU 27 -16.482 1.801 -6.968
117 HB2 LEU 27 2HB LEU 27 -15.687 0.297 -9.459
118 HB3 LEU 27 1HB LEU 27 -16.936 1.520 -9.332
119 HG LEU 27 HG LEU 27 -14.041 2.121 -8.766
120 HD11 LEU 27 1HD1 LEU 27 -14.416 3.226 -11.172
121 HD12 LEU 27 2HD1 LEU 27 -15.444 1.805 -11.347
122 HD13 LEU 27 3HD1 LEU 27 -13.736 1.614 -10.949
123 HD21 LEU 27 3HD2 LEU 27 -16.220 3.574 -8.172
124 HD22 LEU 27 1HD2 LEU 27 -15.931 4.128 -9.822
125 HD23 LEU 27 2HD2 LEU 27 -14.666 4.285 -8.604
126 H GLN 28 H GLN 28 -16.123 -0.748 -5.560
127 HA GLN 28 HA GLN 28 -18.614 -2.034 -6.438
128 HB2 GLN 28 2HB GLN 28 -15.995 -3.352 -5.766
129 HB3 GLN 28 1HB GLN 28 -17.517 -4.219 -5.614
130 HG2 GLN 28 2HG GLN 28 -17.324 -2.908 -8.174
131 HG3 GLN 28 1HG GLN 28 -15.940 -3.962 -7.889
132 HE21 GLN 28 1HE2 GLN 28 -16.483 -5.533 -9.327
133 HE22 GLN 28 2HE2 GLN 28 -17.868 -6.551 -9.159
134 H CYS 29 H CYS 29 -16.227 -1.917 -3.790
135 HA CYS 29 HA CYS 29 -17.986 -2.790 -1.775
136 HB2 CYS 29 2HB CYS 29 -15.313 -2.280 -1.894
137 HB3 CYS 29 1HB CYS 29 -15.871 -0.907 -0.944
138 H ASP 30 H ASP 30 -19.604 -1.804 -0.764
139 HA ASP 30 HA ASP 30 -20.533 0.732 -1.494
140 HB2 ASP 30 2HB ASP 30 -21.207 -1.221 0.655
141 HB3 ASP 30 1HB ASP 30 -21.837 0.417 0.800
142 H VAL 31 H VAL 31 -18.629 -0.321 1.283
143 HA VAL 31 HA VAL 31 -18.643 2.143 2.655
144 HB VAL 31 HB VAL 31 -16.666 1.280 3.865
145 HG11 VAL 31 1HG1 VAL 31 -17.894 -1.051 4.400
146 HG12 VAL 31 2HG1 VAL 31 -19.194 -0.209 3.555
147 HG13 VAL 31 3HG1 VAL 31 -18.466 0.510 4.993
148 HG21 VAL 31 3HG2 VAL 31 -16.860 -1.002 1.904
149 HG22 VAL 31 1HG2 VAL 31 -15.859 -0.997 3.355
150 HG23 VAL 31 2HG2 VAL 31 -15.531 0.147 2.053
151 H ALA 32 H ALA 32 -16.462 0.771 0.249
152 HA ALA 32 HA ALA 32 -14.505 2.804 0.365
153 HB1 ALA 32 3HB ALA 32 -14.421 0.459 -0.744
154 HB2 ALA 32 1HB ALA 32 -13.527 1.793 -1.470
155 HB3 ALA 32 2HB ALA 32 -15.075 1.295 -2.151
156 H SER 33 H SER 33 -17.476 2.449 -1.477
157 HA SER 33 HA SER 33 -17.060 4.629 -3.226
158 HB2 SER 33 2HB SER 33 -19.757 4.468 -3.131
159 HB3 SER 33 1HB SER 33 -18.753 3.368 -4.073
160 HG SER 33 HG SER 33 -19.792 1.936 -2.906
161 H LYS 34 H LYS 34 -18.488 4.387 -0.016
162 HA LYS 34 HA LYS 34 -19.566 7.009 0.003
163 HB2 LYS 34 2HB LYS 34 -19.958 6.694 2.342
164 HB3 LYS 34 1HB LYS 34 -20.286 5.169 1.535
165 HG2 LYS 34 2HG LYS 34 -18.649 4.094 2.621
166 HG3 LYS 34 1HG LYS 34 -17.547 5.465 2.550
167 HD2 LYS 34 2HD LYS 34 -18.594 6.509 4.413
168 HD3 LYS 34 1HD LYS 34 -19.935 5.362 4.379
169 HE2 LYS 34 2HE LYS 34 -18.805 3.843 5.569
170 HE3 LYS 34 1HE LYS 34 -17.331 4.074 4.626
171 HZ1 LYS 34 3HZ LYS 34 -17.062 4.682 6.970
172 HZ2 LYS 34 1HZ LYS 34 -18.250 5.874 6.803
173 HZ3 LYS 34 2HZ LYS 34 -16.798 5.999 5.945
174 H ILE 35 H ILE 35 -16.451 5.667 0.905
175 HA ILE 35 HA ILE 35 -15.431 7.965 2.212
176 HB ILE 35 HB ILE 35 -13.847 5.850 0.744
177 HG12 ILE 35 2HG1 ILE 35 -14.307 5.795 3.697
178 HG13 ILE 35 1HG1 ILE 35 -15.578 5.198 2.637
179 HG21 ILE 35 1HG2 ILE 35 -13.087 7.717 2.986
180 HG22 ILE 35 2HG2 ILE 35 -12.551 7.829 1.309
181 HG23 ILE 35 3HG2 ILE 35 -12.058 6.459 2.302
182 HD11 ILE 35 3HD1 ILE 35 -13.091 3.962 3.428
183 HD12 ILE 35 1HD1 ILE 35 -13.285 3.992 1.676
184 HD13 ILE 35 2HD1 ILE 35 -14.525 3.250 2.686
185 H ILE 36 H ILE 36 -15.503 6.934 -1.148
186 HA ILE 36 HA ILE 36 -13.702 8.890 -2.132
187 HB ILE 36 HB ILE 36 -15.921 7.427 -3.571
188 HG12 ILE 36 2HG1 ILE 36 -14.119 6.019 -2.543
189 HG13 ILE 36 1HG1 ILE 36 -14.226 5.884 -4.294
190 HG21 ILE 36 1HG2 ILE 36 -15.355 9.392 -4.824
191 HG22 ILE 36 2HG2 ILE 36 -14.633 7.996 -5.624
192 HG23 ILE 36 3HG2 ILE 36 -13.631 9.066 -4.644
193 HD11 ILE 36 3HD1 ILE 36 -12.059 6.311 -4.383
194 HD12 ILE 36 1HD1 ILE 36 -12.008 6.657 -2.655
195 HD13 ILE 36 2HD1 ILE 36 -12.398 7.940 -3.800
196 H SER 37 H SER 37 -17.172 8.834 -1.581
197 HA SER 37 HA SER 37 -17.645 11.363 -2.855
198 HB2 SER 37 2HB SER 37 -19.893 11.103 -1.547
199 HB3 SER 37 1HB SER 37 -19.541 10.010 -2.885
200 HG SER 37 HG SER 37 -19.732 9.497 -0.182
201 H LYS 38 H LYS 38 -17.142 10.242 0.441
202 HA LYS 38 HA LYS 38 -17.727 12.779 1.640
203 HB2 LYS 38 2HB LYS 38 -16.642 11.700 3.672
204 HB3 LYS 38 1HB LYS 38 -18.069 10.904 3.039
205 HG2 LYS 38 2HG LYS 38 -16.930 9.036 2.922
206 HG3 LYS 38 1HG LYS 38 -15.846 9.789 1.754
207 HD2 LYS 38 2HD LYS 38 -14.214 9.534 3.253
208 HD3 LYS 38 1HD LYS 38 -15.010 10.781 4.214
209 HE2 LYS 38 2HE LYS 38 -15.223 7.796 4.458
210 HE3 LYS 38 1HE LYS 38 -14.736 8.969 5.679
211 HZ1 LYS 38 3HZ LYS 38 -17.130 9.849 5.356
212 HZ2 LYS 38 1HZ LYS 38 -16.877 8.467 6.300
213 HZ3 LYS 38 2HZ LYS 38 -17.436 8.316 4.711
214 H LYS 39 H LYS 39 -14.930 11.358 0.192
215 HA LYS 39 HA LYS 39 -13.465 13.806 0.530
216 HB2 LYS 39 2HB LYS 39 -12.984 11.562 2.315
217 HB3 LYS 39 1HB LYS 39 -11.539 11.998 1.415
218 HG2 LYS 39 2HG LYS 39 -11.232 13.855 2.602
219 HG3 LYS 39 1HG LYS 39 -12.932 14.314 2.486
220 HD2 LYS 39 2HD LYS 39 -12.355 12.025 4.248
221 HD3 LYS 39 1HD LYS 39 -11.710 13.578 4.785
222 HE2 LYS 39 2HE LYS 39 -14.145 14.395 4.159
223 HE3 LYS 39 1HE LYS 39 -14.531 12.699 4.445
224 HZ1 LYS 39 3HZ LYS 39 -12.944 14.167 6.435
225 HZ2 LYS 39 1HZ LYS 39 -13.988 12.853 6.652
226 HZ3 LYS 39 2HZ LYS 39 -14.618 14.400 6.384
227 HA PRO 40 HA PRO 40 -12.342 11.455 -3.258
228 HB2 PRO 40 2HB PRO 40 -13.170 13.235 -5.080
229 HB3 PRO 40 1HB PRO 40 -14.299 12.133 -4.289
230 HG2 PRO 40 2HG PRO 40 -13.822 15.028 -3.801
231 HG3 PRO 40 1HG PRO 40 -15.330 14.104 -3.699
232 HD2 PRO 40 2HD PRO 40 -13.700 14.858 -1.545
233 HD3 PRO 40 1HD PRO 40 -14.997 13.649 -1.502
234 H ARG 41 H ARG 41 -10.778 13.405 -1.539
235 HA ARG 41 HA ARG 41 -8.529 13.688 -3.140
236 HB2 ARG 41 2HB ARG 41 -10.339 15.534 -3.972
237 HB3 ARG 41 1HB ARG 41 -9.485 16.455 -2.741
238 HG2 ARG 41 2HG ARG 41 -7.346 15.791 -3.901
239 HG3 ARG 41 1HG ARG 41 -8.354 15.187 -5.217
240 HD2 ARG 41 2HD ARG 41 -8.655 17.240 -6.021
241 HD3 ARG 41 1HD ARG 41 -9.158 17.846 -4.444
242 HE ARG 41 HE ARG 41 -7.049 18.684 -4.128
243 HH11 ARG 41 1HH1 ARG 41 -6.991 16.449 -6.807
244 HH12 ARG 41 2HH1 ARG 41 -5.374 16.855 -7.274
245 HH21 ARG 41 1HH2 ARG 41 -4.921 19.220 -4.740
246 HH22 ARG 41 2HH2 ARG 41 -4.198 18.428 -6.100
247 H THR 42 H THR 42 -7.719 12.882 -1.153
248 HA THR 42 HA THR 42 -6.760 14.930 0.599
249 HB THR 42 HB THR 42 -8.369 12.815 1.991
250 HG1 THR 42 1HG THR 42 -9.917 13.757 0.751
251 HG21 THR 42 3HG2 THR 42 -8.484 15.403 3.173
252 HG22 THR 42 1HG2 THR 42 -6.802 14.981 2.851
253 HG23 THR 42 2HG2 THR 42 -7.810 13.907 3.823
254 H ALA 43 H ALA 43 -4.956 14.294 1.724
255 HA ALA 43 HA ALA 43 -3.452 12.166 0.775
256 HB1 ALA 43 3HB ALA 43 -2.137 13.731 1.792
257 HB2 ALA 43 1HB ALA 43 -2.223 12.535 3.084
258 HB3 ALA 43 2HB ALA 43 -3.258 13.962 3.134
259 H GLN 44 H GLN 44 -5.731 12.305 3.425
260 HA GLN 44 HA GLN 44 -5.028 9.928 4.740
261 HB2 GLN 44 2HB GLN 44 -7.705 11.307 4.501
262 HB3 GLN 44 1HB GLN 44 -7.373 9.976 5.603
263 HG2 GLN 44 2HG GLN 44 -5.765 11.297 6.800
264 HG3 GLN 44 1HG GLN 44 -5.915 12.607 5.630
265 HE21 GLN 44 1HE2 GLN 44 -8.310 10.598 7.302
266 HE22 GLN 44 2HE2 GLN 44 -9.178 11.915 8.006
267 H ASP 45 H ASP 45 -6.929 10.529 1.871
268 HA ASP 45 HA ASP 45 -8.128 7.956 1.720
269 HB2 ASP 45 2HB ASP 45 -8.465 10.334 0.386
270 HB3 ASP 45 1HB ASP 45 -7.694 9.329 -0.837
271 H GLU 46 H GLU 46 -5.134 9.339 0.515
272 HA GLU 46 HA GLU 46 -4.442 7.171 -1.179
273 HB2 GLU 46 2HB GLU 46 -2.921 9.461 0.021
274 HB3 GLU 46 1HB GLU 46 -2.069 8.185 -0.839
275 HG2 GLU 46 2HG GLU 46 -3.301 8.649 -2.850
276 HG3 GLU 46 1HG GLU 46 -4.304 9.827 -2.005
277 H LYS 47 H LYS 47 -3.652 7.983 2.161
278 HA LYS 47 HA LYS 47 -1.884 5.802 2.567
279 HB2 LYS 47 2HB LYS 47 -2.174 6.298 4.977
280 HB3 LYS 47 1HB LYS 47 -1.797 7.732 4.031
281 HG2 LYS 47 2HG LYS 47 -4.176 8.337 4.033
282 HG3 LYS 47 1HG LYS 47 -4.518 6.923 5.034
283 HD2 LYS 47 2HD LYS 47 -4.372 8.744 6.528
284 HD3 LYS 47 1HD LYS 47 -2.847 7.872 6.691
285 HE2 LYS 47 2HE LYS 47 -1.634 9.564 5.817
286 HE3 LYS 47 1HE LYS 47 -2.888 10.003 4.657
287 HZ1 LYS 47 3HZ LYS 47 -3.391 10.539 7.490
288 HZ2 LYS 47 1HZ LYS 47 -3.886 11.404 6.124
289 HZ3 LYS 47 2HZ LYS 47 -2.295 11.542 6.682
290 H PHE 48 H PHE 48 -5.337 6.262 2.999
291 HA PHE 48 HA PHE 48 -5.805 3.800 4.333
292 HB2 PHE 48 2HB PHE 48 -7.303 5.943 4.137
293 HB3 PHE 48 1HB PHE 48 -7.913 5.149 2.690
294 HD1 PHE 48 2HD PHE 48 -7.366 4.594 6.322
295 HD2 PHE 48 1HD PHE 48 -9.605 3.576 2.851
296 HE1 PHE 48 2HE PHE 48 -8.900 3.261 7.709
297 HE2 PHE 48 1HE PHE 48 -11.145 2.242 4.230
298 HZ PHE 48 HZ PHE 48 -10.792 2.082 6.662
299 H LEU 49 H LEU 49 -5.962 4.796 0.942
300 HA LEU 49 HA LEU 49 -6.953 2.276 0.037
301 HB2 LEU 49 2HB LEU 49 -6.429 3.082 -2.214
302 HB3 LEU 49 1HB LEU 49 -7.328 4.268 -1.288
303 HG LEU 49 HG LEU 49 -5.045 5.340 -0.793
304 HD11 LEU 49 1HD1 LEU 49 -3.781 4.676 -3.187
305 HD12 LEU 49 2HD1 LEU 49 -4.255 3.135 -2.474
306 HD13 LEU 49 3HD1 LEU 49 -3.258 4.263 -1.555
307 HD21 LEU 49 3HD2 LEU 49 -5.079 6.237 -3.295
308 HD22 LEU 49 1HD2 LEU 49 -6.324 6.668 -2.123
309 HD23 LEU 49 2HD2 LEU 49 -6.626 5.390 -3.299
310 H ARG 50 H ARG 50 -3.784 3.674 0.525
311 HA ARG 50 HA ARG 50 -2.307 1.699 -0.871
312 HB2 ARG 50 2HB ARG 50 -1.404 3.925 -0.234
313 HB3 ARG 50 1HB ARG 50 -1.416 3.420 1.449
314 HG2 ARG 50 2HG ARG 50 0.406 2.094 1.212
315 HG3 ARG 50 1HG ARG 50 0.035 1.694 -0.467
316 HD2 ARG 50 2HD ARG 50 0.726 4.510 0.108
317 HD3 ARG 50 1HD ARG 50 2.032 3.333 0.249
318 HE ARG 50 HE ARG 50 0.524 3.106 -2.187
319 HH11 ARG 50 1HH1 ARG 50 3.193 4.709 -0.613
320 HH12 ARG 50 2HH1 ARG 50 4.008 5.078 -2.095
321 HH21 ARG 50 1HH2 ARG 50 1.595 3.590 -4.138
322 HH22 ARG 50 2HH2 ARG 50 3.102 4.444 -4.097
323 H GLU 51 H GLU 51 -3.422 2.015 2.449
324 HA GLU 51 HA GLU 51 -2.054 -0.301 3.413
325 HB2 GLU 51 2HB GLU 51 -4.308 1.371 4.512
326 HB3 GLU 51 1HB GLU 51 -3.686 -0.040 5.355
327 HG2 GLU 51 2HG GLU 51 -1.419 1.420 4.757
328 HG3 GLU 51 1HG GLU 51 -2.617 2.644 5.181
329 H SER 52 H SER 52 -5.163 0.343 1.972
330 HA SER 52 HA SER 52 -5.902 -2.485 2.296
331 HB2 SER 52 2HB SER 52 -7.702 -1.344 3.190
332 HB3 SER 52 1HB SER 52 -7.506 0.034 2.112
333 HG SER 52 HG SER 52 -9.213 -1.910 1.867
334 H ALA 53 H ALA 53 -4.014 -1.968 0.404
335 HA ALA 53 HA ALA 53 -5.544 -2.336 -2.087
336 HB1 ALA 53 3HB ALA 53 -3.255 -0.518 -1.548
337 HB2 ALA 53 1HB ALA 53 -4.674 -0.281 -2.569
338 HB3 ALA 53 2HB ALA 53 -3.346 -1.297 -3.128
339 H CYS 54 H CYS 54 -5.290 -4.372 -2.719
340 HA CYS 54 HA CYS 54 -2.833 -5.804 -2.058
341 HB2 CYS 54 2HB CYS 54 -4.028 -7.819 -2.663
342 HB3 CYS 54 1HB CYS 54 -5.040 -6.855 -1.593
343 H GLY 55 H GLY 55 -2.360 -3.856 -3.905
344 HA2 GLY 55 2HA GLY 55 -0.973 -5.088 -5.916
345 HA3 GLY 55 1HA GLY 55 -2.576 -4.837 -6.593
346 H PHE 56 H PHE 56 -1.122 -3.558 -8.105
347 HA PHE 56 HA PHE 56 -1.384 -0.767 -7.402
348 HB2 PHE 56 2HB PHE 56 1.243 -2.133 -7.526
349 HB3 PHE 56 1HB PHE 56 1.137 -0.583 -8.353
350 HD1 PHE 56 2HD PHE 56 -0.209 1.243 -6.859
351 HD2 PHE 56 1HD PHE 56 2.031 -2.061 -5.385
352 HE1 PHE 56 2HE PHE 56 0.091 2.409 -4.713
353 HE2 PHE 56 1HE PHE 56 2.335 -0.901 -3.237
354 HZ PHE 56 HZ PHE 56 1.365 1.337 -2.899
355 H ASP 57 H ASP 57 -1.965 0.387 -9.135
356 HA ASP 57 HA ASP 57 -1.032 -0.199 -11.778
357 HB2 ASP 57 2HB ASP 57 -3.787 -1.021 -10.935
358 HB3 ASP 57 1HB ASP 57 -3.515 -0.459 -12.582
359 H GLY 58 H GLY 58 -1.524 1.441 -13.271
360 HA2 GLY 58 2HA GLY 58 -2.412 3.926 -11.998
361 HA3 GLY 58 1HA GLY 58 -1.500 3.801 -13.495
362 H GLN 59 H GLN 59 -4.311 1.826 -12.906
363 HA GLN 59 HA GLN 59 -6.173 3.574 -14.190
364 HB2 GLN 59 2HB GLN 59 -4.646 1.649 -15.799
365 HB3 GLN 59 1HB GLN 59 -6.388 1.529 -16.005
366 HG2 GLN 59 2HG GLN 59 -5.585 4.279 -16.065
367 HG3 GLN 59 1HG GLN 59 -4.627 3.343 -17.211
368 HE21 GLN 59 1HE2 GLN 59 -7.173 5.238 -17.103
369 HE22 GLN 59 2HE2 GLN 59 -8.188 4.521 -18.303
370 H THR 60 H THR 60 -5.377 0.197 -13.445
371 HA THR 60 HA THR 60 -8.175 -0.210 -12.624
372 HB THR 60 HB THR 60 -6.151 -2.374 -13.193
373 HG1 THR 60 1HG THR 60 -6.460 -1.157 -15.079
374 HG21 THR 60 3HG2 THR 60 -7.804 -3.879 -13.017
375 HG22 THR 60 1HG2 THR 60 -9.018 -2.786 -13.681
376 HG23 THR 60 2HG2 THR 60 -8.534 -2.644 -11.990
377 HA PRO 61 HA PRO 61 -5.598 -0.126 -8.730
378 HB2 PRO 61 2HB PRO 61 -7.348 1.398 -7.311
379 HB3 PRO 61 1HB PRO 61 -6.078 2.084 -8.330
380 HG2 PRO 61 2HG PRO 61 -8.985 1.691 -8.933
381 HG3 PRO 61 1HG PRO 61 -7.953 3.094 -9.270
382 HD2 PRO 61 2HD PRO 61 -8.581 1.277 -11.167
383 HD3 PRO 61 1HD PRO 61 -7.014 2.111 -11.137
384 H LYS 62 H LYS 62 -6.268 -0.845 -6.536
385 HA LYS 62 HA LYS 62 -8.747 -2.408 -6.509
386 HB2 LYS 62 2HB LYS 62 -6.017 -3.489 -5.788
387 HB3 LYS 62 1HB LYS 62 -7.538 -4.333 -5.525
388 HG2 LYS 62 2HG LYS 62 -6.768 -3.413 -8.263
389 HG3 LYS 62 1HG LYS 62 -6.119 -4.912 -7.595
390 HD2 LYS 62 2HD LYS 62 -9.067 -4.342 -7.611
391 HD3 LYS 62 1HD LYS 62 -8.256 -5.051 -9.009
392 HE2 LYS 62 2HE LYS 62 -7.657 -6.317 -6.421
393 HE3 LYS 62 1HE LYS 62 -9.325 -6.480 -6.971
394 HZ1 LYS 62 3HZ LYS 62 -7.139 -7.047 -8.850
395 HZ2 LYS 62 1HZ LYS 62 -8.702 -7.693 -8.792
396 HZ3 LYS 62 2HZ LYS 62 -7.534 -8.205 -7.682
397 H VAL 63 H VAL 63 -9.377 -3.107 -4.334
398 HA VAL 63 HA VAL 63 -8.127 -1.626 -2.148
399 HB VAL 63 HB VAL 63 -11.105 -1.520 -2.616
400 HG11 VAL 63 1HG1 VAL 63 -10.890 0.337 -0.901
401 HG12 VAL 63 2HG1 VAL 63 -9.262 -0.270 -0.596
402 HG13 VAL 63 3HG1 VAL 63 -10.658 -1.309 -0.311
403 HG21 VAL 63 3HG2 VAL 63 -8.916 0.250 -3.538
404 HG22 VAL 63 1HG2 VAL 63 -10.367 1.028 -2.906
405 HG23 VAL 63 2HG2 VAL 63 -10.486 -0.088 -4.267
406 H CYS 64 H CYS 64 -8.453 -2.530 -0.088
407 HA CYS 64 HA CYS 64 -9.478 -5.280 -0.159
408 HB2 CYS 64 2HB CYS 64 -7.408 -3.862 1.439
409 HB3 CYS 64 1HB CYS 64 -8.289 -5.161 2.236
410 H CYS 65 H CYS 65 -11.351 -5.752 0.739
411 HA CYS 65 HA CYS 65 -12.453 -3.941 2.783
412 HB2 CYS 65 2HB CYS 65 -13.672 -5.139 0.354
413 HB3 CYS 65 1HB CYS 65 -14.684 -5.064 1.793
414 HA PRO 66 HA PRO 66 -12.144 -7.747 5.183
415 HB2 PRO 66 2HB PRO 66 -13.175 -6.697 7.485
416 HB3 PRO 66 1HB PRO 66 -11.493 -6.491 6.985
417 HG2 PRO 66 2HG PRO 66 -13.801 -4.609 6.689
418 HG3 PRO 66 1HG PRO 66 -12.131 -4.264 7.176
419 HD2 PRO 66 2HD PRO 66 -13.018 -3.778 4.680
420 HD3 PRO 66 1HD PRO 66 -11.354 -4.309 4.998
Start of MODEL 11
1 H GLN 11 H GLN 11 -13.118 -12.345 -3.665
2 HA GLN 11 HA GLN 11 -10.922 -13.454 -4.070
3 HB2 GLN 11 2HB GLN 11 -10.609 -10.866 -5.378
4 HB3 GLN 11 1HB GLN 11 -9.341 -11.170 -4.200
5 HG2 GLN 11 2HG GLN 11 -9.406 -13.542 -5.494
6 HG3 GLN 11 1HG GLN 11 -9.861 -12.438 -6.793
7 HE21 GLN 11 1HE2 GLN 11 -7.342 -14.015 -5.712
8 HE22 GLN 11 2HE2 GLN 11 -6.068 -12.889 -6.014
9 H ALA 12 H ALA 12 -9.411 -13.348 -2.308
10 HA ALA 12 HA ALA 12 -10.430 -11.758 -0.049
11 HB1 ALA 12 3HB ALA 12 -10.123 -13.516 1.335
12 HB2 ALA 12 1HB ALA 12 -8.671 -14.063 0.496
13 HB3 ALA 12 2HB ALA 12 -10.263 -14.436 -0.163
14 H CYS 13 H CYS 13 -9.201 -10.103 0.532
15 HA CYS 13 HA CYS 13 -6.295 -10.276 0.074
16 HB2 CYS 13 2HB CYS 13 -7.133 -8.537 -1.303
17 HB3 CYS 13 1HB CYS 13 -8.179 -7.922 -0.030
18 H THR 14 H THR 14 -4.895 -9.500 1.667
19 HA THR 14 HA THR 14 -6.042 -9.527 4.359
20 HB THR 14 HB THR 14 -4.233 -11.089 3.994
21 HG1 THR 14 1HG THR 14 -3.935 -10.454 5.993
22 HG21 THR 14 3HG2 THR 14 -2.595 -10.653 2.581
23 HG22 THR 14 1HG2 THR 14 -1.942 -9.516 3.760
24 HG23 THR 14 2HG2 THR 14 -3.045 -8.949 2.507
25 H LEU 15 H LEU 15 -6.483 -7.643 5.274
26 HA LEU 15 HA LEU 15 -5.675 -5.149 4.290
27 HB2 LEU 15 2HB LEU 15 -6.395 -4.354 6.632
28 HB3 LEU 15 1HB LEU 15 -7.597 -5.077 5.582
29 HG LEU 15 HG LEU 15 -6.246 -6.975 7.381
30 HD11 LEU 15 1HD1 LEU 15 -8.336 -5.423 8.750
31 HD12 LEU 15 2HD1 LEU 15 -6.780 -4.612 8.568
32 HD13 LEU 15 3HD1 LEU 15 -6.871 -6.171 9.387
33 HD21 LEU 15 3HD2 LEU 15 -8.935 -7.204 7.739
34 HD22 LEU 15 1HD2 LEU 15 -8.008 -8.042 6.496
35 HD23 LEU 15 2HD2 LEU 15 -8.849 -6.543 6.106
36 HA PRO 16 HA PRO 16 -1.680 -4.122 5.798
37 HB2 PRO 16 2HB PRO 16 -2.929 -1.991 7.475
38 HB3 PRO 16 1HB PRO 16 -1.582 -1.881 6.336
39 HG2 PRO 16 2HG PRO 16 -3.993 -0.980 5.666
40 HG3 PRO 16 1HG PRO 16 -2.977 -1.826 4.484
41 HD2 PRO 16 2HD PRO 16 -5.378 -2.795 5.959
42 HD3 PRO 16 1HD PRO 16 -4.827 -3.184 4.317
43 H ASN 17 H ASN 17 -4.260 -4.418 8.154
44 HA ASN 17 HA ASN 17 -2.454 -4.787 10.376
45 HB2 ASN 17 2HB ASN 17 -5.412 -4.724 10.011
46 HB3 ASN 17 1HB ASN 17 -4.774 -5.561 11.423
47 HD21 ASN 17 1HD2 ASN 17 -4.039 -4.408 13.111
48 HD22 ASN 17 2HD2 ASN 17 -4.010 -2.683 13.178
49 H ASN 18 H ASN 18 -3.807 -6.757 7.938
50 HA ASN 18 HA ASN 18 -3.585 -8.972 7.476
51 HB2 ASN 18 2HB ASN 18 -1.289 -8.619 8.509
52 HB3 ASN 18 1HB ASN 18 -1.964 -9.248 10.008
53 HD21 ASN 18 1HD2 ASN 18 -0.454 -10.017 7.134
54 HD22 ASN 18 2HD2 ASN 18 -0.703 -11.727 7.153
55 H ASP 19 H ASP 19 -5.817 -9.241 7.843
56 HA ASP 19 HA ASP 19 -6.406 -11.063 10.009
57 HB2 ASP 19 2HB ASP 19 -8.010 -8.513 9.742
58 HB3 ASP 19 1HB ASP 19 -8.276 -9.804 10.909
59 H LYS 20 H LYS 20 -6.342 -10.975 7.026
60 HA LYS 20 HA LYS 20 -7.499 -11.880 5.290
61 HB2 LYS 20 2HB LYS 20 -9.580 -12.779 7.277
62 HB3 LYS 20 1HB LYS 20 -9.157 -13.518 5.738
63 HG2 LYS 20 2HG LYS 20 -7.406 -13.428 8.186
64 HG3 LYS 20 1HG LYS 20 -8.327 -14.823 7.618
65 HD2 LYS 20 2HD LYS 20 -6.442 -15.382 6.540
66 HD3 LYS 20 1HD LYS 20 -6.913 -14.135 5.385
67 HE2 LYS 20 2HE LYS 20 -5.432 -12.581 6.268
68 HE3 LYS 20 1HE LYS 20 -5.325 -13.417 7.818
69 HZ1 LYS 20 3HZ LYS 20 -3.326 -13.622 6.364
70 HZ2 LYS 20 1HZ LYS 20 -4.258 -14.536 5.286
71 HZ3 LYS 20 2HZ LYS 20 -3.985 -15.099 6.857
72 H GLY 21 H GLY 21 -8.931 -11.122 3.800
73 HA2 GLY 21 2HA GLY 21 -11.304 -9.684 4.619
74 HA3 GLY 21 1HA GLY 21 -10.051 -8.671 3.920
75 H THR 22 H THR 22 -11.476 -8.125 2.227
76 HA THR 22 HA THR 22 -11.677 -10.207 0.160
77 HB THR 22 HB THR 22 -13.770 -8.071 0.479
78 HG1 THR 22 1HG THR 22 -13.699 -10.622 1.707
79 HG21 THR 22 3HG2 THR 22 -13.601 -10.670 -0.980
80 HG22 THR 22 1HG2 THR 22 -14.072 -9.078 -1.577
81 HG23 THR 22 2HG2 THR 22 -15.161 -9.983 -0.526
82 H CYS 23 H CYS 23 -11.403 -9.508 -1.980
83 HA CYS 23 HA CYS 23 -10.383 -6.755 -2.241
84 HB2 CYS 23 2HB CYS 23 -8.499 -8.115 -2.532
85 HB3 CYS 23 1HB CYS 23 -9.402 -9.347 -3.401
86 H LYS 24 H LYS 24 -11.523 -5.496 -3.506
87 HA LYS 24 HA LYS 24 -12.766 -6.545 -5.923
88 HB2 LYS 24 2HB LYS 24 -14.915 -5.446 -5.418
89 HB3 LYS 24 1HB LYS 24 -14.546 -6.729 -4.274
90 HG2 LYS 24 2HG LYS 24 -13.766 -5.037 -2.665
91 HG3 LYS 24 1HG LYS 24 -14.224 -3.772 -3.807
92 HD2 LYS 24 2HD LYS 24 -16.063 -3.888 -2.391
93 HD3 LYS 24 1HD LYS 24 -16.553 -4.895 -3.755
94 HE2 LYS 24 2HE LYS 24 -16.090 -6.893 -2.560
95 HE3 LYS 24 1HE LYS 24 -15.261 -6.011 -1.278
96 HZ1 LYS 24 3HZ LYS 24 -17.519 -6.725 -0.664
97 HZ2 LYS 24 1HZ LYS 24 -18.154 -5.751 -1.895
98 HZ3 LYS 24 2HZ LYS 24 -17.332 -5.045 -0.598
99 H SER 25 H SER 25 -13.701 -4.668 -7.241
100 HA SER 25 HA SER 25 -11.677 -2.764 -7.675
101 HB2 SER 25 2HB SER 25 -14.526 -2.977 -8.640
102 HB3 SER 25 1HB SER 25 -13.489 -1.630 -9.108
103 HG SER 25 HG SER 25 -11.978 -3.298 -9.836
104 H LEU 26 H LEU 26 -12.516 -0.303 -7.909
105 HA LEU 26 HA LEU 26 -13.173 0.474 -5.170
106 HB2 LEU 26 2HB LEU 26 -12.337 2.663 -5.747
107 HB3 LEU 26 1HB LEU 26 -11.170 1.439 -6.205
108 HG LEU 26 HG LEU 26 -12.490 1.699 -8.543
109 HD11 LEU 26 1HD1 LEU 26 -12.946 4.192 -6.998
110 HD12 LEU 26 2HD1 LEU 26 -13.951 3.416 -8.223
111 HD13 LEU 26 3HD1 LEU 26 -12.529 4.340 -8.705
112 HD21 LEU 26 3HD2 LEU 26 -10.311 3.611 -7.747
113 HD22 LEU 26 1HD2 LEU 26 -10.606 2.882 -9.326
114 HD23 LEU 26 2HD2 LEU 26 -10.024 1.888 -7.990
115 H LEU 27 H LEU 27 -15.197 -0.516 -7.087
116 HA LEU 27 HA LEU 27 -17.054 1.724 -6.818
117 HB2 LEU 27 2HB LEU 27 -16.787 0.107 -9.352
118 HB3 LEU 27 1HB LEU 27 -17.939 1.396 -9.059
119 HG LEU 27 HG LEU 27 -14.974 1.888 -8.985
120 HD11 LEU 27 1HD1 LEU 27 -15.672 2.877 -11.374
121 HD12 LEU 27 2HD1 LEU 27 -16.741 1.475 -11.313
122 HD13 LEU 27 3HD1 LEU 27 -14.997 1.262 -11.154
123 HD21 LEU 27 3HD2 LEU 27 -16.065 4.160 -9.837
124 HD22 LEU 27 1HD2 LEU 27 -15.913 3.771 -8.124
125 HD23 LEU 27 2HD2 LEU 27 -17.449 3.518 -8.952
126 H GLN 28 H GLN 28 -16.618 -0.832 -5.416
127 HA GLN 28 HA GLN 28 -19.288 -1.991 -5.862
128 HB2 GLN 28 2HB GLN 28 -16.705 -3.435 -5.265
129 HB3 GLN 28 1HB GLN 28 -18.287 -4.182 -5.094
130 HG2 GLN 28 2HG GLN 28 -18.699 -3.670 -7.503
131 HG3 GLN 28 1HG GLN 28 -17.020 -3.147 -7.616
132 HE21 GLN 28 1HE2 GLN 28 -15.594 -4.619 -8.197
133 HE22 GLN 28 2HE2 GLN 28 -15.804 -6.332 -8.103
134 H CYS 29 H CYS 29 -16.619 -1.673 -3.530
135 HA CYS 29 HA CYS 29 -18.044 -2.412 -1.242
136 HB2 CYS 29 2HB CYS 29 -15.469 -1.774 -1.713
137 HB3 CYS 29 1HB CYS 29 -16.001 -0.282 -0.945
138 H ASP 30 H ASP 30 -19.806 -1.519 -0.422
139 HA ASP 30 HA ASP 30 -20.866 0.953 -1.167
140 HB2 ASP 30 2HB ASP 30 -21.487 -1.126 0.799
141 HB3 ASP 30 1HB ASP 30 -21.974 0.486 1.317
142 H VAL 31 H VAL 31 -18.669 0.087 1.416
143 HA VAL 31 HA VAL 31 -18.877 2.518 2.865
144 HB VAL 31 HB VAL 31 -16.507 0.652 2.802
145 HG11 VAL 31 1HG1 VAL 31 -17.320 2.080 5.256
146 HG12 VAL 31 2HG1 VAL 31 -16.636 3.067 3.963
147 HG13 VAL 31 3HG1 VAL 31 -15.711 1.722 4.629
148 HG21 VAL 31 3HG2 VAL 31 -17.567 -0.439 4.759
149 HG22 VAL 31 1HG2 VAL 31 -18.479 -0.654 3.265
150 HG23 VAL 31 2HG2 VAL 31 -19.019 0.519 4.467
151 H ALA 32 H ALA 32 -16.656 1.358 0.375
152 HA ALA 32 HA ALA 32 -14.962 3.616 0.380
153 HB1 ALA 32 3HB ALA 32 -14.319 2.791 -1.922
154 HB2 ALA 32 1HB ALA 32 -15.508 1.507 -1.693
155 HB3 ALA 32 2HB ALA 32 -14.127 1.635 -0.603
156 H SER 33 H SER 33 -17.921 2.848 -1.351
157 HA SER 33 HA SER 33 -17.827 5.029 -3.152
158 HB2 SER 33 2HB SER 33 -20.470 4.508 -3.021
159 HB3 SER 33 1HB SER 33 -19.338 3.519 -3.944
160 HG SER 33 HG SER 33 -19.940 1.949 -2.703
161 H LYS 34 H LYS 34 -19.144 4.639 0.090
162 HA LYS 34 HA LYS 34 -20.573 7.096 0.102
163 HB2 LYS 34 2HB LYS 34 -20.906 6.736 2.441
164 HB3 LYS 34 1HB LYS 34 -21.029 5.177 1.639
165 HG2 LYS 34 2HG LYS 34 -19.136 4.374 2.604
166 HG3 LYS 34 1HG LYS 34 -18.390 5.963 2.745
167 HD2 LYS 34 2HD LYS 34 -19.486 6.454 4.704
168 HD3 LYS 34 1HD LYS 34 -20.835 5.377 4.340
169 HE2 LYS 34 2HE LYS 34 -18.461 3.817 4.530
170 HE3 LYS 34 1HE LYS 34 -18.549 4.869 5.942
171 HZ1 LYS 34 3HZ LYS 34 -20.848 3.231 5.051
172 HZ2 LYS 34 1HZ LYS 34 -20.618 3.981 6.550
173 HZ3 LYS 34 2HZ LYS 34 -19.682 2.638 6.123
174 H ILE 35 H ILE 35 -17.285 6.190 0.910
175 HA ILE 35 HA ILE 35 -16.605 8.639 2.200
176 HB ILE 35 HB ILE 35 -14.737 6.683 0.857
177 HG12 ILE 35 2HG1 ILE 35 -15.221 6.711 3.804
178 HG13 ILE 35 1HG1 ILE 35 -16.408 5.921 2.770
179 HG21 ILE 35 1HG2 ILE 35 -13.859 8.168 3.227
180 HG22 ILE 35 2HG2 ILE 35 -14.157 9.164 1.804
181 HG23 ILE 35 3HG2 ILE 35 -13.010 7.828 1.720
182 HD11 ILE 35 3HD1 ILE 35 -13.888 4.956 3.693
183 HD12 ILE 35 1HD1 ILE 35 -13.889 5.009 1.930
184 HD13 ILE 35 2HD1 ILE 35 -15.144 4.112 2.786
185 H ILE 36 H ILE 36 -16.293 7.411 -1.090
186 HA ILE 36 HA ILE 36 -14.896 9.699 -2.081
187 HB ILE 36 HB ILE 36 -16.446 7.624 -3.635
188 HG12 ILE 36 2HG1 ILE 36 -14.602 6.771 -2.102
189 HG13 ILE 36 1HG1 ILE 36 -14.448 6.352 -3.805
190 HG21 ILE 36 1HG2 ILE 36 -15.023 8.281 -5.512
191 HG22 ILE 36 2HG2 ILE 36 -14.269 9.521 -4.509
192 HG23 ILE 36 3HG2 ILE 36 -15.980 9.641 -4.922
193 HD11 ILE 36 3HD1 ILE 36 -13.101 8.827 -3.247
194 HD12 ILE 36 1HD1 ILE 36 -12.464 7.323 -3.914
195 HD13 ILE 36 2HD1 ILE 36 -12.542 7.550 -2.166
196 H SER 37 H SER 37 -18.256 8.724 -1.860
197 HA SER 37 HA SER 37 -19.198 10.920 -3.481
198 HB2 SER 37 2HB SER 37 -20.539 8.728 -1.916
199 HB3 SER 37 1HB SER 37 -21.472 10.082 -2.555
200 HG SER 37 HG SER 37 -19.762 8.460 -4.132
201 H LYS 38 H LYS 38 -18.417 10.408 -0.181
202 HA LYS 38 HA LYS 38 -20.160 12.106 1.144
203 HB2 LYS 38 2HB LYS 38 -17.570 10.896 1.673
204 HB3 LYS 38 1HB LYS 38 -17.716 12.479 2.422
205 HG2 LYS 38 2HG LYS 38 -20.083 10.834 2.804
206 HG3 LYS 38 1HG LYS 38 -18.618 10.099 3.459
207 HD2 LYS 38 2HD LYS 38 -19.490 12.928 4.032
208 HD3 LYS 38 1HD LYS 38 -19.857 11.552 5.073
209 HE2 LYS 38 2HE LYS 38 -17.035 12.149 4.268
210 HE3 LYS 38 1HE LYS 38 -17.791 13.026 5.598
211 HZ1 LYS 38 3HZ LYS 38 -18.074 11.053 6.815
212 HZ2 LYS 38 1HZ LYS 38 -16.496 10.972 6.206
213 HZ3 LYS 38 2HZ LYS 38 -17.729 10.068 5.483
214 H LYS 39 H LYS 39 -16.811 13.171 0.801
215 HA LYS 39 HA LYS 39 -17.088 15.309 -0.904
216 HB2 LYS 39 2HB LYS 39 -18.556 15.794 1.459
217 HB3 LYS 39 1HB LYS 39 -17.121 16.804 1.557
218 HG2 LYS 39 2HG LYS 39 -18.057 18.264 0.189
219 HG3 LYS 39 1HG LYS 39 -18.130 17.034 -1.073
220 HD2 LYS 39 2HD LYS 39 -20.351 17.147 -0.944
221 HD3 LYS 39 1HD LYS 39 -20.235 16.427 0.664
222 HE2 LYS 39 2HE LYS 39 -21.289 18.307 1.310
223 HE3 LYS 39 1HE LYS 39 -19.674 19.009 1.231
224 HZ1 LYS 39 3HZ LYS 39 -21.181 18.993 -1.253
225 HZ2 LYS 39 1HZ LYS 39 -20.181 20.192 -0.599
226 HZ3 LYS 39 2HZ LYS 39 -21.769 20.020 -0.045
227 HA PRO 40 HA PRO 40 -13.330 16.331 1.996
228 HB2 PRO 40 2HB PRO 40 -12.977 14.611 4.110
229 HB3 PRO 40 1HB PRO 40 -13.793 16.174 4.224
230 HG2 PRO 40 2HG PRO 40 -14.969 13.437 3.956
231 HG3 PRO 40 1HG PRO 40 -15.498 14.790 4.972
232 HD2 PRO 40 2HD PRO 40 -16.741 14.187 2.671
233 HD3 PRO 40 1HD PRO 40 -16.549 15.866 3.212
234 H ARG 41 H ARG 41 -11.251 15.513 1.767
235 HA ARG 41 HA ARG 41 -10.673 12.746 1.452
236 HB2 ARG 41 2HB ARG 41 -11.797 13.868 -0.798
237 HB3 ARG 41 1HB ARG 41 -10.076 14.025 -1.119
238 HG2 ARG 41 2HG ARG 41 -10.523 11.414 -0.122
239 HG3 ARG 41 1HG ARG 41 -11.737 11.733 -1.363
240 HD2 ARG 41 2HD ARG 41 -9.685 12.657 -2.700
241 HD3 ARG 41 1HD ARG 41 -8.761 11.649 -1.589
242 HE ARG 41 HE ARG 41 -9.543 9.786 -2.674
243 HH11 ARG 41 1HH1 ARG 41 -11.435 12.552 -3.650
244 HH12 ARG 41 2HH1 ARG 41 -12.262 11.700 -4.909
245 HH21 ARG 41 1HH2 ARG 41 -10.630 8.664 -4.332
246 HH22 ARG 41 2HH2 ARG 41 -11.806 9.492 -5.297
247 H THR 42 H THR 42 -8.813 12.810 2.548
248 HA THR 42 HA THR 42 -6.863 14.908 1.867
249 HB THR 42 HB THR 42 -6.540 13.273 4.331
250 HG1 THR 42 1HG THR 42 -8.220 14.077 5.316
251 HG21 THR 42 3HG2 THR 42 -6.408 16.083 4.740
252 HG22 THR 42 1HG2 THR 42 -5.455 15.665 3.317
253 HG23 THR 42 2HG2 THR 42 -5.124 14.880 4.860
254 H ALA 43 H ALA 43 -4.535 14.090 2.508
255 HA ALA 43 HA ALA 43 -3.820 12.132 0.615
256 HB1 ALA 43 3HB ALA 43 -1.599 12.274 2.101
257 HB2 ALA 43 1HB ALA 43 -2.407 13.743 2.650
258 HB3 ALA 43 2HB ALA 43 -2.059 13.515 0.936
259 H GLN 44 H GLN 44 -4.456 11.974 4.053
260 HA GLN 44 HA GLN 44 -3.280 9.510 4.638
261 HB2 GLN 44 2HB GLN 44 -5.732 10.812 5.829
262 HB3 GLN 44 1HB GLN 44 -4.922 9.410 6.515
263 HG2 GLN 44 2HG GLN 44 -2.954 10.671 6.964
264 HG3 GLN 44 1HG GLN 44 -3.563 12.052 6.052
265 HE21 GLN 44 1HE2 GLN 44 -4.411 13.623 7.204
266 HE22 GLN 44 2HE2 GLN 44 -5.073 13.483 8.793
267 H ASP 45 H ASP 45 -6.329 10.295 3.109
268 HA ASP 45 HA ASP 45 -7.467 7.697 3.306
269 HB2 ASP 45 2HB ASP 45 -8.081 9.900 1.326
270 HB3 ASP 45 1HB ASP 45 -9.094 8.497 1.659
271 H GLU 46 H GLU 46 -5.435 9.305 0.935
272 HA GLU 46 HA GLU 46 -5.688 7.317 -1.079
273 HB2 GLU 46 2HB GLU 46 -4.747 9.812 -1.123
274 HB3 GLU 46 1HB GLU 46 -3.219 8.966 -0.918
275 HG2 GLU 46 2HG GLU 46 -3.648 7.667 -2.926
276 HG3 GLU 46 1HG GLU 46 -5.205 8.470 -3.123
277 H LYS 47 H LYS 47 -3.413 7.831 1.561
278 HA LYS 47 HA LYS 47 -1.620 5.770 0.794
279 HB2 LYS 47 2HB LYS 47 -0.763 5.949 3.111
280 HB3 LYS 47 1HB LYS 47 -0.889 7.510 2.314
281 HG2 LYS 47 2HG LYS 47 -2.869 8.048 3.530
282 HG3 LYS 47 1HG LYS 47 -2.956 6.421 4.208
283 HD2 LYS 47 2HD LYS 47 -0.391 7.426 4.822
284 HD3 LYS 47 1HD LYS 47 -1.541 8.714 5.185
285 HE2 LYS 47 2HE LYS 47 -2.471 7.578 6.898
286 HE3 LYS 47 1HE LYS 47 -2.332 6.023 6.079
287 HZ1 LYS 47 3HZ LYS 47 -0.925 6.309 8.115
288 HZ2 LYS 47 1HZ LYS 47 -0.005 7.435 7.249
289 HZ3 LYS 47 2HZ LYS 47 -0.087 5.829 6.727
290 H PHE 48 H PHE 48 -4.486 5.893 2.823
291 HA PHE 48 HA PHE 48 -4.263 3.311 3.924
292 HB2 PHE 48 2HB PHE 48 -5.806 5.247 4.637
293 HB3 PHE 48 1HB PHE 48 -6.891 4.670 3.376
294 HD1 PHE 48 1HD PHE 48 -7.282 2.018 3.480
295 HD2 PHE 48 2HD PHE 48 -6.195 4.498 6.763
296 HE1 PHE 48 1HE PHE 48 -8.214 0.358 5.038
297 HE2 PHE 48 2HE PHE 48 -7.124 2.843 8.327
298 HZ PHE 48 HZ PHE 48 -8.136 0.769 7.465
299 H LEU 49 H LEU 49 -5.940 4.504 1.038
300 HA LEU 49 HA LEU 49 -6.966 1.931 0.338
301 HB2 LEU 49 2HB LEU 49 -7.530 2.967 -1.820
302 HB3 LEU 49 1HB LEU 49 -8.092 3.914 -0.457
303 HG LEU 49 HG LEU 49 -5.919 5.281 -0.796
304 HD11 LEU 49 1HD1 LEU 49 -4.574 4.575 -2.419
305 HD12 LEU 49 2HD1 LEU 49 -5.811 5.076 -3.572
306 HD13 LEU 49 3HD1 LEU 49 -5.772 3.411 -2.987
307 HD21 LEU 49 3HD2 LEU 49 -7.088 6.562 -2.684
308 HD22 LEU 49 1HD2 LEU 49 -7.953 6.366 -1.159
309 HD23 LEU 49 2HD2 LEU 49 -8.355 5.345 -2.540
310 H ARG 50 H ARG 50 -4.096 3.778 -0.446
311 HA ARG 50 HA ARG 50 -3.158 2.106 -2.531
312 HB2 ARG 50 2HB ARG 50 -2.342 4.399 -2.213
313 HB3 ARG 50 1HB ARG 50 -1.616 3.934 -0.680
314 HG2 ARG 50 2HG ARG 50 0.221 3.780 -1.990
315 HG3 ARG 50 1HG ARG 50 -0.409 2.150 -2.236
316 HD2 ARG 50 2HD ARG 50 -1.712 3.748 -4.125
317 HD3 ARG 50 1HD ARG 50 -0.030 4.279 -4.141
318 HE ARG 50 HE ARG 50 -1.060 1.797 -5.111
319 HH11 ARG 50 1HH1 ARG 50 1.750 3.325 -3.715
320 HH12 ARG 50 2HH1 ARG 50 2.862 2.186 -4.396
321 HH21 ARG 50 1HH2 ARG 50 0.403 0.298 -6.007
322 HH22 ARG 50 2HH2 ARG 50 2.098 0.468 -5.698
323 H GLU 51 H GLU 51 -2.757 2.101 0.965
324 HA GLU 51 HA GLU 51 -0.767 0.054 1.002
325 HB2 GLU 51 2HB GLU 51 -1.545 1.843 2.827
326 HB3 GLU 51 1HB GLU 51 -2.518 0.480 3.364
327 HG2 GLU 51 2HG GLU 51 -0.546 -0.874 3.646
328 HG3 GLU 51 1HG GLU 51 0.466 0.409 2.980
329 H SER 52 H SER 52 -4.268 0.127 1.339
330 HA SER 52 HA SER 52 -4.327 -2.793 1.582
331 HB2 SER 52 2HB SER 52 -6.663 -0.883 1.783
332 HB3 SER 52 1HB SER 52 -6.603 -2.568 2.305
333 HG SER 52 HG SER 52 -5.692 -0.293 3.562
334 H ALA 53 H ALA 53 -3.539 -1.730 -0.902
335 HA ALA 53 HA ALA 53 -5.892 -2.139 -2.611
336 HB1 ALA 53 3HB ALA 53 -4.005 -0.177 -2.720
337 HB2 ALA 53 1HB ALA 53 -5.030 -0.667 -4.067
338 HB3 ALA 53 2HB ALA 53 -3.399 -1.323 -3.915
339 H CYS 54 H CYS 54 -6.135 -4.254 -3.005
340 HA CYS 54 HA CYS 54 -4.056 -6.151 -3.097
341 HB2 CYS 54 2HB CYS 54 -5.828 -7.570 -4.298
342 HB3 CYS 54 1HB CYS 54 -6.197 -7.024 -2.668
343 H GLY 55 H GLY 55 -2.515 -5.068 -4.488
344 HA2 GLY 55 2HA GLY 55 -2.288 -6.142 -7.013
345 HA3 GLY 55 1HA GLY 55 -3.094 -4.600 -7.245
346 H PHE 56 H PHE 56 -0.374 -5.633 -7.994
347 HA PHE 56 HA PHE 56 1.239 -3.566 -6.650
348 HB2 PHE 56 2HB PHE 56 2.121 -6.136 -7.979
349 HB3 PHE 56 1HB PHE 56 3.218 -4.915 -7.340
350 HD1 PHE 56 2HD PHE 56 2.677 -4.234 -4.816
351 HD2 PHE 56 1HD PHE 56 1.661 -7.939 -6.647
352 HE1 PHE 56 2HE PHE 56 2.572 -5.294 -2.599
353 HE2 PHE 56 1HE PHE 56 1.552 -9.007 -4.432
354 HZ PHE 56 HZ PHE 56 2.009 -7.684 -2.405
355 H ASP 57 H ASP 57 -0.174 -4.488 -9.602
356 HA ASP 57 HA ASP 57 1.615 -3.570 -11.511
357 HB2 ASP 57 2HB ASP 57 -1.400 -3.589 -11.441
358 HB3 ASP 57 1HB ASP 57 -0.501 -3.035 -12.853
359 H GLY 58 H GLY 58 -0.864 -1.743 -9.731
360 HA2 GLY 58 2HA GLY 58 -0.443 0.492 -8.974
361 HA3 GLY 58 1HA GLY 58 0.659 0.703 -10.325
362 H GLN 59 H GLN 59 -0.726 0.043 -12.501
363 HA GLN 59 HA GLN 59 -2.514 2.239 -12.807
364 HB2 GLN 59 2HB GLN 59 -1.010 0.642 -14.512
365 HB3 GLN 59 1HB GLN 59 -2.672 0.235 -14.916
366 HG2 GLN 59 2HG GLN 59 -2.993 2.822 -14.967
367 HG3 GLN 59 1HG GLN 59 -1.241 2.838 -15.168
368 HE21 GLN 59 1HE2 GLN 59 -4.283 1.879 -16.570
369 HE22 GLN 59 2HE2 GLN 59 -3.690 1.621 -18.172
370 H THR 60 H THR 60 -2.903 -1.186 -12.239
371 HA THR 60 HA THR 60 -5.666 -1.324 -12.892
372 HB THR 60 HB THR 60 -4.052 -3.116 -11.071
373 HG1 THR 60 1HG THR 60 -3.104 -3.151 -13.060
374 HG21 THR 60 3HG2 THR 60 -6.792 -3.166 -11.626
375 HG22 THR 60 1HG2 THR 60 -5.820 -4.414 -10.848
376 HG23 THR 60 2HG2 THR 60 -6.069 -4.450 -12.594
377 HA PRO 61 HA PRO 61 -6.894 0.822 -9.109
378 HB2 PRO 61 2HB PRO 61 -9.492 1.137 -9.769
379 HB3 PRO 61 1HB PRO 61 -8.213 2.148 -10.454
380 HG2 PRO 61 2HG PRO 61 -9.593 -0.229 -11.643
381 HG3 PRO 61 1HG PRO 61 -9.173 1.317 -12.404
382 HD2 PRO 61 2HD PRO 61 -7.692 -0.943 -12.722
383 HD3 PRO 61 1HD PRO 61 -6.992 0.687 -12.766
384 H LYS 62 H LYS 62 -6.751 -0.756 -7.551
385 HA LYS 62 HA LYS 62 -9.167 -2.364 -7.148
386 HB2 LYS 62 2HB LYS 62 -6.332 -3.371 -7.200
387 HB3 LYS 62 1HB LYS 62 -7.588 -4.218 -6.310
388 HG2 LYS 62 2HG LYS 62 -8.851 -4.041 -8.623
389 HG3 LYS 62 1HG LYS 62 -7.199 -3.926 -9.236
390 HD2 LYS 62 2HD LYS 62 -7.470 -6.032 -7.261
391 HD3 LYS 62 1HD LYS 62 -8.585 -6.253 -8.610
392 HE2 LYS 62 2HE LYS 62 -6.724 -6.058 -10.183
393 HE3 LYS 62 1HE LYS 62 -5.609 -5.824 -8.839
394 HZ1 LYS 62 3HZ LYS 62 -6.083 -8.185 -9.943
395 HZ2 LYS 62 1HZ LYS 62 -7.261 -8.212 -8.729
396 HZ3 LYS 62 2HZ LYS 62 -5.633 -8.003 -8.324
397 H VAL 63 H VAL 63 -9.526 -3.006 -4.950
398 HA VAL 63 HA VAL 63 -7.835 -1.788 -2.912
399 HB VAL 63 HB VAL 63 -10.796 -1.207 -2.988
400 HG11 VAL 63 1HG1 VAL 63 -9.849 0.598 -1.311
401 HG12 VAL 63 2HG1 VAL 63 -8.574 -0.604 -1.105
402 HG13 VAL 63 3HG1 VAL 63 -10.252 -1.032 -0.775
403 HG21 VAL 63 3HG2 VAL 63 -9.867 0.024 -4.789
404 HG22 VAL 63 1HG2 VAL 63 -8.455 0.484 -3.837
405 HG23 VAL 63 2HG2 VAL 63 -10.039 1.156 -3.448
406 H CYS 64 H CYS 64 -8.308 -2.550 -0.753
407 HA CYS 64 HA CYS 64 -9.589 -5.195 -0.791
408 HB2 CYS 64 2HB CYS 64 -7.547 -4.101 1.155
409 HB3 CYS 64 1HB CYS 64 -8.195 -5.737 1.147
410 H CYS 65 H CYS 65 -11.438 -5.454 0.256
411 HA CYS 65 HA CYS 65 -12.132 -3.539 2.386
412 HB2 CYS 65 2HB CYS 65 -13.661 -4.504 0.052
413 HB3 CYS 65 1HB CYS 65 -14.556 -4.449 1.566
414 HA PRO 66 HA PRO 66 -12.117 -7.380 4.746
415 HB2 PRO 66 2HB PRO 66 -12.610 -6.240 7.161
416 HB3 PRO 66 1HB PRO 66 -11.011 -6.237 6.406
417 HG2 PRO 66 2HG PRO 66 -13.079 -4.073 6.471
418 HG3 PRO 66 1HG PRO 66 -11.325 -3.953 6.702
419 HD2 PRO 66 2HD PRO 66 -12.529 -3.318 4.364
420 HD3 PRO 66 1HD PRO 66 -10.896 -4.012 4.437
Start of MODEL 12
1 H GLN 11 H GLN 11 -11.642 -12.175 -4.255
2 HA GLN 11 HA GLN 11 -10.013 -14.029 -3.903
3 HB2 GLN 11 2HB GLN 11 -8.398 -13.125 -5.556
4 HB3 GLN 11 1HB GLN 11 -8.132 -11.737 -4.510
5 HG2 GLN 11 2HG GLN 11 -6.925 -12.936 -2.985
6 HG3 GLN 11 1HG GLN 11 -7.718 -14.457 -3.389
7 HE21 GLN 11 1HE2 GLN 11 -4.950 -14.149 -3.107
8 HE22 GLN 11 2HE2 GLN 11 -4.210 -14.436 -4.642
9 H ALA 12 H ALA 12 -9.057 -14.127 -1.790
10 HA ALA 12 HA ALA 12 -10.154 -12.107 -0.005
11 HB1 ALA 12 3HB ALA 12 -10.304 -13.727 1.543
12 HB2 ALA 12 1HB ALA 12 -8.701 -14.366 1.178
13 HB3 ALA 12 2HB ALA 12 -10.079 -14.813 0.172
14 H CYS 13 H CYS 13 -8.966 -10.477 0.722
15 HA CYS 13 HA CYS 13 -6.041 -10.816 0.836
16 HB2 CYS 13 2HB CYS 13 -5.808 -8.444 0.417
17 HB3 CYS 13 1HB CYS 13 -6.818 -9.151 -0.838
18 H THR 14 H THR 14 -4.979 -9.344 2.464
19 HA THR 14 HA THR 14 -6.509 -9.472 4.967
20 HB THR 14 HB THR 14 -4.452 -10.758 4.991
21 HG1 THR 14 1HG THR 14 -4.953 -9.707 6.921
22 HG21 THR 14 3HG2 THR 14 -2.442 -8.794 5.030
23 HG22 THR 14 1HG2 THR 14 -3.367 -8.559 3.546
24 HG23 THR 14 2HG2 THR 14 -2.645 -10.129 3.896
25 H LEU 15 H LEU 15 -7.354 -7.630 5.651
26 HA LEU 15 HA LEU 15 -6.783 -5.100 4.598
27 HB2 LEU 15 2HB LEU 15 -7.965 -4.284 6.716
28 HB3 LEU 15 1HB LEU 15 -8.868 -5.313 5.621
29 HG LEU 15 HG LEU 15 -7.462 -6.765 7.754
30 HD11 LEU 15 1HD1 LEU 15 -8.577 -5.996 9.586
31 HD12 LEU 15 2HD1 LEU 15 -9.931 -5.375 8.643
32 HD13 LEU 15 3HD1 LEU 15 -8.408 -4.484 8.693
33 HD21 LEU 15 3HD2 LEU 15 -9.127 -8.239 7.442
34 HD22 LEU 15 1HD2 LEU 15 -9.424 -7.326 5.964
35 HD23 LEU 15 2HD2 LEU 15 -10.368 -6.988 7.415
36 HA PRO 16 HA PRO 16 -3.248 -3.381 6.567
37 HB2 PRO 16 2HB PRO 16 -5.021 -1.356 7.858
38 HB3 PRO 16 1HB PRO 16 -3.550 -1.120 6.905
39 HG2 PRO 16 2HG PRO 16 -5.942 -0.643 5.839
40 HG3 PRO 16 1HG PRO 16 -4.656 -1.405 4.883
41 HD2 PRO 16 2HD PRO 16 -7.082 -2.626 6.115
42 HD3 PRO 16 1HD PRO 16 -6.261 -3.030 4.593
43 H ASN 17 H ASN 17 -6.096 -3.912 8.539
44 HA ASN 17 HA ASN 17 -4.625 -3.861 11.025
45 HB2 ASN 17 2HB ASN 17 -7.177 -3.309 10.523
46 HB3 ASN 17 1HB ASN 17 -7.363 -5.029 10.852
47 HD21 ASN 17 1HD2 ASN 17 -8.468 -2.950 12.394
48 HD22 ASN 17 2HD2 ASN 17 -7.760 -3.018 13.968
49 H ASN 18 H ASN 18 -5.296 -6.156 8.594
50 HA ASN 18 HA ASN 18 -4.705 -8.340 8.359
51 HB2 ASN 18 2HB ASN 18 -2.727 -7.508 9.840
52 HB3 ASN 18 1HB ASN 18 -3.545 -8.387 11.128
53 HD21 ASN 18 1HD2 ASN 18 -2.632 -8.875 7.732
54 HD22 ASN 18 2HD2 ASN 18 -2.047 -10.487 7.945
55 H ASP 19 H ASP 19 -6.952 -8.824 8.414
56 HA ASP 19 HA ASP 19 -7.639 -10.638 10.556
57 HB2 ASP 19 2HB ASP 19 -8.440 -8.114 10.999
58 HB3 ASP 19 1HB ASP 19 -9.779 -8.654 9.992
59 H LYS 20 H LYS 20 -7.159 -10.630 7.615
60 HA LYS 20 HA LYS 20 -7.948 -11.694 5.770
61 HB2 LYS 20 2HB LYS 20 -9.940 -12.816 7.748
62 HB3 LYS 20 1HB LYS 20 -9.744 -13.389 6.098
63 HG2 LYS 20 2HG LYS 20 -7.904 -14.567 6.590
64 HG3 LYS 20 1HG LYS 20 -7.268 -13.321 7.664
65 HD2 LYS 20 2HD LYS 20 -9.640 -14.555 8.768
66 HD3 LYS 20 1HD LYS 20 -8.400 -15.758 8.403
67 HE2 LYS 20 2HE LYS 20 -7.613 -13.252 9.811
68 HE3 LYS 20 1HE LYS 20 -8.447 -14.511 10.720
69 HZ1 LYS 20 3HZ LYS 20 -6.031 -15.053 9.095
70 HZ2 LYS 20 1HZ LYS 20 -6.734 -16.041 10.277
71 HZ3 LYS 20 2HZ LYS 20 -5.950 -14.611 10.726
72 H GLY 21 H GLY 21 -9.356 -11.315 4.083
73 HA2 GLY 21 2HA GLY 21 -11.962 -10.211 4.443
74 HA3 GLY 21 1HA GLY 21 -10.797 -8.962 4.031
75 H THR 22 H THR 22 -11.984 -8.593 2.095
76 HA THR 22 HA THR 22 -11.368 -10.561 -0.004
77 HB THR 22 HB THR 22 -13.856 -8.863 -0.037
78 HG1 THR 22 1HG THR 22 -13.480 -11.437 1.071
79 HG21 THR 22 3HG2 THR 22 -12.795 -10.256 -2.055
80 HG22 THR 22 1HG2 THR 22 -14.531 -10.035 -1.832
81 HG23 THR 22 2HG2 THR 22 -13.756 -11.524 -1.292
82 H CYS 23 H CYS 23 -10.801 -9.720 -2.023
83 HA CYS 23 HA CYS 23 -10.305 -6.812 -2.051
84 HB2 CYS 23 2HB CYS 23 -8.324 -8.539 -1.958
85 HB3 CYS 23 1HB CYS 23 -8.655 -8.706 -3.679
86 H LYS 24 H LYS 24 -11.383 -5.735 -3.539
87 HA LYS 24 HA LYS 24 -11.868 -6.928 -6.155
88 HB2 LYS 24 2HB LYS 24 -14.265 -6.094 -6.053
89 HB3 LYS 24 1HB LYS 24 -13.901 -7.528 -5.103
90 HG2 LYS 24 2HG LYS 24 -13.846 -6.252 -3.078
91 HG3 LYS 24 1HG LYS 24 -13.994 -4.740 -3.976
92 HD2 LYS 24 2HD LYS 24 -16.216 -4.906 -4.017
93 HD3 LYS 24 1HD LYS 24 -16.133 -6.545 -4.664
94 HE2 LYS 24 2HE LYS 24 -15.457 -6.295 -1.814
95 HE3 LYS 24 1HE LYS 24 -17.126 -5.895 -2.221
96 HZ1 LYS 24 3HZ LYS 24 -17.301 -8.129 -1.908
97 HZ2 LYS 24 1HZ LYS 24 -15.725 -8.458 -2.430
98 HZ3 LYS 24 2HZ LYS 24 -16.938 -8.124 -3.559
99 H SER 25 H SER 25 -12.862 -5.246 -7.663
100 HA SER 25 HA SER 25 -11.203 -2.986 -7.738
101 HB2 SER 25 2HB SER 25 -13.815 -3.497 -9.184
102 HB3 SER 25 1HB SER 25 -12.667 -2.221 -9.589
103 HG SER 25 HG SER 25 -11.106 -3.994 -9.843
104 H LEU 26 H LEU 26 -12.426 -0.730 -8.189
105 HA LEU 26 HA LEU 26 -13.750 -0.119 -5.652
106 HB2 LEU 26 2HB LEU 26 -13.229 2.225 -6.173
107 HB3 LEU 26 1HB LEU 26 -11.798 1.211 -6.147
108 HG LEU 26 HG LEU 26 -12.537 1.169 -8.811
109 HD11 LEU 26 1HD1 LEU 26 -13.476 3.086 -9.469
110 HD12 LEU 26 2HD1 LEU 26 -12.505 4.052 -8.359
111 HD13 LEU 26 3HD1 LEU 26 -13.974 3.261 -7.787
112 HD21 LEU 26 3HD2 LEU 26 -10.555 2.489 -9.163
113 HD22 LEU 26 1HD2 LEU 26 -10.272 1.366 -7.833
114 HD23 LEU 26 2HD2 LEU 26 -10.597 3.066 -7.497
115 H LEU 27 H LEU 27 -15.147 -1.406 -7.888
116 HA LEU 27 HA LEU 27 -17.262 0.605 -8.238
117 HB2 LEU 27 2HB LEU 27 -16.600 -1.409 -10.367
118 HB3 LEU 27 1HB LEU 27 -17.614 0.015 -10.495
119 HG LEU 27 HG LEU 27 -14.770 0.501 -9.834
120 HD11 LEU 27 1HD1 LEU 27 -15.669 -0.491 -12.532
121 HD12 LEU 27 2HD1 LEU 27 -14.466 -1.223 -11.471
122 HD13 LEU 27 3HD1 LEU 27 -14.140 0.336 -12.230
123 HD21 LEU 27 3HD2 LEU 27 -16.168 1.862 -12.047
124 HD22 LEU 27 1HD2 LEU 27 -15.177 2.525 -10.747
125 HD23 LEU 27 2HD2 LEU 27 -16.857 2.086 -10.437
126 H GLN 28 H GLN 28 -16.962 -1.537 -6.297
127 HA GLN 28 HA GLN 28 -19.457 -2.945 -6.879
128 HB2 GLN 28 2HB GLN 28 -16.805 -4.206 -6.339
129 HB3 GLN 28 1HB GLN 28 -18.252 -4.982 -5.708
130 HG2 GLN 28 2HG GLN 28 -19.180 -4.992 -8.010
131 HG3 GLN 28 1HG GLN 28 -17.635 -4.369 -8.587
132 HE21 GLN 28 1HE2 GLN 28 -17.609 -6.308 -9.891
133 HE22 GLN 28 2HE2 GLN 28 -17.041 -7.787 -9.202
134 H CYS 29 H CYS 29 -16.942 -2.266 -4.464
135 HA CYS 29 HA CYS 29 -18.614 -2.870 -2.236
136 HB2 CYS 29 2HB CYS 29 -15.897 -2.392 -2.617
137 HB3 CYS 29 1HB CYS 29 -16.437 -1.035 -1.637
138 H ASP 30 H ASP 30 -20.492 -1.699 -2.270
139 HA ASP 30 HA ASP 30 -20.785 0.996 -2.903
140 HB2 ASP 30 2HB ASP 30 -22.381 -1.044 -1.507
141 HB3 ASP 30 1HB ASP 30 -22.736 0.608 -1.017
142 H VAL 31 H VAL 31 -19.708 -0.554 0.025
143 HA VAL 31 HA VAL 31 -19.975 1.645 1.775
144 HB VAL 31 HB VAL 31 -18.341 0.465 3.209
145 HG11 VAL 31 1HG1 VAL 31 -20.897 -0.238 2.665
146 HG12 VAL 31 2HG1 VAL 31 -19.909 -0.980 3.923
147 HG13 VAL 31 3HG1 VAL 31 -20.061 -1.757 2.347
148 HG21 VAL 31 3HG2 VAL 31 -17.879 -1.966 2.193
149 HG22 VAL 31 1HG2 VAL 31 -16.765 -0.615 1.987
150 HG23 VAL 31 2HG2 VAL 31 -17.892 -1.032 0.698
151 H ALA 32 H ALA 32 -17.382 0.579 -0.362
152 HA ALA 32 HA ALA 32 -15.409 2.373 0.546
153 HB1 ALA 32 3HB ALA 32 -14.404 1.978 -1.751
154 HB2 ALA 32 1HB ALA 32 -15.789 0.931 -2.062
155 HB3 ALA 32 2HB ALA 32 -14.673 0.552 -0.750
156 H SER 33 H SER 33 -17.922 2.665 -1.902
157 HA SER 33 HA SER 33 -17.060 5.121 -2.992
158 HB2 SER 33 2HB SER 33 -19.474 3.435 -3.149
159 HB3 SER 33 1HB SER 33 -19.748 5.154 -3.440
160 HG SER 33 HG SER 33 -17.685 3.710 -4.730
161 H LYS 34 H LYS 34 -19.221 4.340 -0.316
162 HA LYS 34 HA LYS 34 -20.146 6.983 0.087
163 HB2 LYS 34 2HB LYS 34 -21.090 6.213 2.128
164 HB3 LYS 34 1HB LYS 34 -21.233 4.895 0.976
165 HG2 LYS 34 2HG LYS 34 -20.054 3.526 2.263
166 HG3 LYS 34 1HG LYS 34 -18.779 4.718 2.499
167 HD2 LYS 34 2HD LYS 34 -20.196 5.818 4.215
168 HD3 LYS 34 1HD LYS 34 -21.366 4.510 4.031
169 HE2 LYS 34 2HE LYS 34 -19.973 2.947 5.002
170 HE3 LYS 34 1HE LYS 34 -18.513 3.861 4.619
171 HZ1 LYS 34 3HZ LYS 34 -20.486 4.935 6.529
172 HZ2 LYS 34 1HZ LYS 34 -18.834 5.277 6.397
173 HZ3 LYS 34 2HZ LYS 34 -19.342 3.797 7.035
174 H ILE 35 H ILE 35 -17.318 5.242 1.194
175 HA ILE 35 HA ILE 35 -16.549 7.066 3.223
176 HB ILE 35 HB ILE 35 -14.764 5.241 1.608
177 HG12 ILE 35 2HG1 ILE 35 -15.712 4.548 4.345
178 HG13 ILE 35 1HG1 ILE 35 -16.852 4.357 3.018
179 HG21 ILE 35 1HG2 ILE 35 -13.620 7.031 2.896
180 HG22 ILE 35 2HG2 ILE 35 -13.213 5.400 3.432
181 HG23 ILE 35 3HG2 ILE 35 -14.345 6.379 4.366
182 HD11 ILE 35 3HD1 ILE 35 -14.490 3.188 2.119
183 HD12 ILE 35 1HD1 ILE 35 -15.957 2.367 2.659
184 HD13 ILE 35 2HD1 ILE 35 -14.651 2.686 3.802
185 H ILE 36 H ILE 36 -15.770 6.796 -0.207
186 HA ILE 36 HA ILE 36 -13.843 8.857 -0.289
187 HB ILE 36 HB ILE 36 -15.650 7.934 -2.528
188 HG12 ILE 36 2HG1 ILE 36 -14.318 6.123 -1.381
189 HG13 ILE 36 1HG1 ILE 36 -13.974 6.323 -3.096
190 HG21 ILE 36 1HG2 ILE 36 -14.006 8.823 -4.026
191 HG22 ILE 36 2HG2 ILE 36 -12.937 9.234 -2.686
192 HG23 ILE 36 3HG2 ILE 36 -14.463 10.091 -2.889
193 HD11 ILE 36 3HD1 ILE 36 -11.906 6.008 -2.006
194 HD12 ILE 36 1HD1 ILE 36 -12.301 7.190 -0.759
195 HD13 ILE 36 2HD1 ILE 36 -11.999 7.722 -2.413
196 H SER 37 H SER 37 -17.336 8.847 -0.451
197 HA SER 37 HA SER 37 -17.366 11.718 -1.037
198 HB2 SER 37 2HB SER 37 -18.857 10.416 -2.418
199 HB3 SER 37 1HB SER 37 -19.584 9.663 -0.998
200 HG SER 37 HG SER 37 -20.706 11.436 -0.610
201 H LYS 38 H LYS 38 -17.158 9.856 1.655
202 HA LYS 38 HA LYS 38 -18.983 11.501 3.248
203 HB2 LYS 38 2HB LYS 38 -17.689 8.846 3.643
204 HB3 LYS 38 1HB LYS 38 -18.066 9.800 5.069
205 HG2 LYS 38 2HG LYS 38 -20.231 9.525 3.089
206 HG3 LYS 38 1HG LYS 38 -19.769 8.059 3.954
207 HD2 LYS 38 2HD LYS 38 -21.418 8.969 5.314
208 HD3 LYS 38 1HD LYS 38 -19.928 9.536 6.068
209 HE2 LYS 38 2HE LYS 38 -20.341 11.691 5.560
210 HE3 LYS 38 1HE LYS 38 -21.017 11.296 3.981
211 HZ1 LYS 38 3HZ LYS 38 -22.611 10.517 6.282
212 HZ2 LYS 38 1HZ LYS 38 -23.095 11.178 4.801
213 HZ3 LYS 38 2HZ LYS 38 -22.473 12.181 6.013
214 H LYS 39 H LYS 39 -15.589 10.528 3.079
215 HA LYS 39 HA LYS 39 -14.864 13.008 4.442
216 HB2 LYS 39 2HB LYS 39 -14.176 10.239 5.388
217 HB3 LYS 39 1HB LYS 39 -13.136 11.605 5.762
218 HG2 LYS 39 2HG LYS 39 -14.524 12.391 7.326
219 HG3 LYS 39 1HG LYS 39 -15.959 12.074 6.350
220 HD2 LYS 39 2HD LYS 39 -16.412 10.327 7.648
221 HD3 LYS 39 1HD LYS 39 -14.924 9.560 7.090
222 HE2 LYS 39 2HE LYS 39 -13.938 11.270 8.935
223 HE3 LYS 39 1HE LYS 39 -15.521 10.927 9.632
224 HZ1 LYS 39 3HZ LYS 39 -13.601 9.416 10.277
225 HZ2 LYS 39 1HZ LYS 39 -13.730 8.758 8.723
226 HZ3 LYS 39 2HZ LYS 39 -15.037 8.665 9.791
227 HA PRO 40 HA PRO 40 -12.320 12.295 0.641
228 HB2 PRO 40 2HB PRO 40 -12.092 15.236 0.995
229 HB3 PRO 40 1HB PRO 40 -12.454 14.303 -0.460
230 HG2 PRO 40 2HG PRO 40 -14.373 15.659 0.792
231 HG3 PRO 40 1HG PRO 40 -14.696 14.062 0.091
232 HD2 PRO 40 2HD PRO 40 -14.248 14.824 2.950
233 HD3 PRO 40 1HD PRO 40 -15.391 13.653 2.259
234 H ARG 41 H ARG 41 -10.077 13.390 0.177
235 HA ARG 41 HA ARG 41 -8.436 14.455 2.088
236 HB2 ARG 41 2HB ARG 41 -9.091 11.836 2.848
237 HB3 ARG 41 1HB ARG 41 -7.476 11.719 2.168
238 HG2 ARG 41 2HG ARG 41 -7.127 12.096 4.436
239 HG3 ARG 41 1HG ARG 41 -6.870 13.672 3.684
240 HD2 ARG 41 2HD ARG 41 -9.050 14.413 4.357
241 HD3 ARG 41 1HD ARG 41 -9.471 12.800 4.929
242 HE ARG 41 HE ARG 41 -7.299 13.422 6.409
243 HH11 ARG 41 1HH1 ARG 41 -10.296 15.092 5.768
244 HH12 ARG 41 2HH1 ARG 41 -10.322 15.896 7.302
245 HH21 ARG 41 1HH2 ARG 41 -7.331 14.478 8.426
246 HH22 ARG 41 2HH2 ARG 41 -8.637 15.548 8.811
247 H THR 42 H THR 42 -6.398 14.771 1.289
248 HA THR 42 HA THR 42 -6.043 14.109 -1.505
249 HB THR 42 HB THR 42 -4.376 15.836 0.333
250 HG1 THR 42 1HG THR 42 -6.176 16.962 0.098
251 HG21 THR 42 3HG2 THR 42 -2.879 15.739 -1.321
252 HG22 THR 42 1HG2 THR 42 -3.995 16.809 -2.169
253 HG23 THR 42 2HG2 THR 42 -4.039 15.071 -2.469
254 H ALA 43 H ALA 43 -3.097 14.515 0.233
255 HA ALA 43 HA ALA 43 -1.989 12.123 -0.699
256 HB1 ALA 43 3HB ALA 43 -1.044 13.694 1.693
257 HB2 ALA 43 1HB ALA 43 -0.720 14.154 0.022
258 HB3 ALA 43 2HB ALA 43 -0.088 12.634 0.656
259 H GLN 44 H GLN 44 -3.698 12.925 2.241
260 HA GLN 44 HA GLN 44 -3.013 10.631 3.736
261 HB2 GLN 44 2HB GLN 44 -5.146 12.699 3.871
262 HB3 GLN 44 1HB GLN 44 -5.408 11.207 4.763
263 HG2 GLN 44 2HG GLN 44 -3.171 11.578 5.839
264 HG3 GLN 44 1HG GLN 44 -3.162 13.175 5.091
265 HE21 GLN 44 1HE2 GLN 44 -3.381 14.484 6.796
266 HE22 GLN 44 2HE2 GLN 44 -4.695 14.441 7.916
267 H ASP 45 H ASP 45 -5.565 11.280 1.401
268 HA ASP 45 HA ASP 45 -6.962 8.834 1.803
269 HB2 ASP 45 2HB ASP 45 -8.071 10.736 0.746
270 HB3 ASP 45 1HB ASP 45 -6.914 10.703 -0.580
271 H GLU 46 H GLU 46 -4.332 9.874 -0.266
272 HA GLU 46 HA GLU 46 -4.258 7.618 -1.953
273 HB2 GLU 46 2HB GLU 46 -2.540 9.917 -1.383
274 HB3 GLU 46 1HB GLU 46 -1.644 8.476 -1.843
275 HG2 GLU 46 2HG GLU 46 -3.975 9.134 -3.520
276 HG3 GLU 46 1HG GLU 46 -2.622 10.262 -3.592
277 H LYS 47 H LYS 47 -2.603 8.342 1.085
278 HA LYS 47 HA LYS 47 -1.080 5.946 1.129
279 HB2 LYS 47 2HB LYS 47 -0.723 6.478 3.527
280 HB3 LYS 47 1HB LYS 47 -0.380 7.836 2.463
281 HG2 LYS 47 2HG LYS 47 -2.439 8.898 3.045
282 HG3 LYS 47 1HG LYS 47 -2.972 7.480 3.949
283 HD2 LYS 47 2HD LYS 47 -0.391 8.422 4.868
284 HD3 LYS 47 1HD LYS 47 -1.613 9.691 4.955
285 HE2 LYS 47 2HE LYS 47 -3.087 7.895 6.063
286 HE3 LYS 47 1HE LYS 47 -1.581 7.009 6.294
287 HZ1 LYS 47 3HZ LYS 47 -0.789 9.248 7.302
288 HZ2 LYS 47 1HZ LYS 47 -1.736 8.198 8.233
289 HZ3 LYS 47 2HZ LYS 47 -2.442 9.549 7.497
290 H PHE 48 H PHE 48 -4.235 6.863 2.359
291 HA PHE 48 HA PHE 48 -4.688 4.499 3.857
292 HB2 PHE 48 2HB PHE 48 -6.101 6.929 3.275
293 HB3 PHE 48 1HB PHE 48 -7.182 5.558 3.048
294 HD1 PHE 48 1HD PHE 48 -7.421 3.899 4.948
295 HD2 PHE 48 2HD PHE 48 -5.589 7.711 5.410
296 HE1 PHE 48 1HE PHE 48 -7.763 3.764 7.381
297 HE2 PHE 48 2HE PHE 48 -5.926 7.584 7.843
298 HZ PHE 48 HZ PHE 48 -7.016 5.609 8.832
299 H LEU 49 H LEU 49 -5.521 5.472 0.556
300 HA LEU 49 HA LEU 49 -7.014 3.098 0.016
301 HB2 LEU 49 2HB LEU 49 -6.938 3.807 -2.327
302 HB3 LEU 49 1HB LEU 49 -7.436 5.108 -1.264
303 HG LEU 49 HG LEU 49 -4.984 5.875 -1.362
304 HD11 LEU 49 1HD1 LEU 49 -4.413 5.025 -3.954
305 HD12 LEU 49 2HD1 LEU 49 -4.897 3.566 -3.086
306 HD13 LEU 49 3HD1 LEU 49 -3.578 4.563 -2.471
307 HD21 LEU 49 3HD2 LEU 49 -5.438 6.850 -3.724
308 HD22 LEU 49 1HD2 LEU 49 -6.501 7.283 -2.387
309 HD23 LEU 49 2HD2 LEU 49 -7.005 6.061 -3.554
310 H ARG 50 H ARG 50 -3.665 4.055 -0.309
311 HA ARG 50 HA ARG 50 -2.833 1.895 -1.943
312 HB2 ARG 50 2HB ARG 50 -1.534 3.997 -1.595
313 HB3 ARG 50 1HB ARG 50 -1.182 3.464 0.044
314 HG2 ARG 50 2HG ARG 50 -0.145 1.403 -0.994
315 HG3 ARG 50 1HG ARG 50 -0.268 2.242 -2.541
316 HD2 ARG 50 2HD ARG 50 0.927 4.172 -1.211
317 HD3 ARG 50 1HD ARG 50 1.447 2.840 -0.179
318 HE ARG 50 HE ARG 50 1.896 2.400 -2.990
319 HH11 ARG 50 1HH1 ARG 50 3.212 3.728 -0.042
320 HH12 ARG 50 2HH1 ARG 50 4.854 3.612 -0.578
321 HH21 ARG 50 1HH2 ARG 50 4.056 2.248 -3.695
322 HH22 ARG 50 2HH2 ARG 50 5.334 2.774 -2.650
323 H GLU 51 H GLU 51 -3.197 2.327 1.519
324 HA GLU 51 HA GLU 51 -1.859 -0.089 2.248
325 HB2 GLU 51 2HB GLU 51 -3.475 1.979 3.637
326 HB3 GLU 51 1HB GLU 51 -3.389 0.396 4.399
327 HG2 GLU 51 2HG GLU 51 -0.945 1.913 3.544
328 HG3 GLU 51 1HG GLU 51 -1.684 2.106 5.132
329 H SER 52 H SER 52 -5.167 0.794 1.497
330 HA SER 52 HA SER 52 -6.036 -1.955 2.055
331 HB2 SER 52 2HB SER 52 -7.962 0.213 1.330
332 HB3 SER 52 1HB SER 52 -8.178 -1.164 2.409
333 HG SER 52 HG SER 52 -7.231 1.355 2.938
334 H ALA 53 H ALA 53 -4.449 -1.493 -0.219
335 HA ALA 53 HA ALA 53 -6.372 -2.198 -2.320
336 HB1 ALA 53 3HB ALA 53 -5.986 -0.043 -3.021
337 HB2 ALA 53 1HB ALA 53 -4.717 -0.910 -3.886
338 HB3 ALA 53 2HB ALA 53 -4.332 -0.025 -2.409
339 H CYS 54 H CYS 54 -5.824 -3.992 -3.388
340 HA CYS 54 HA CYS 54 -3.567 -5.514 -2.648
341 HB2 CYS 54 2HB CYS 54 -5.612 -5.766 -4.841
342 HB3 CYS 54 1HB CYS 54 -4.256 -6.884 -4.734
343 H GLY 55 H GLY 55 -1.823 -4.015 -3.003
344 HA2 GLY 55 2HA GLY 55 0.069 -3.449 -4.189
345 HA3 GLY 55 1HA GLY 55 -0.534 -4.428 -5.518
346 H PHE 56 H PHE 56 0.774 -2.107 -6.070
347 HA PHE 56 HA PHE 56 -1.409 -0.371 -7.016
348 HB2 PHE 56 2HB PHE 56 0.340 0.445 -5.148
349 HB3 PHE 56 1HB PHE 56 1.270 0.839 -6.590
350 HD1 PHE 56 2HD PHE 56 -1.722 1.598 -4.634
351 HD2 PHE 56 1HD PHE 56 0.530 2.559 -8.116
352 HE1 PHE 56 2HE PHE 56 -3.008 3.680 -4.887
353 HE2 PHE 56 1HE PHE 56 -0.753 4.643 -8.373
354 HZ PHE 56 HZ PHE 56 -2.524 5.205 -6.757
355 H ASP 57 H ASP 57 -1.457 -1.426 -9.019
356 HA ASP 57 HA ASP 57 0.949 -1.599 -10.614
357 HB2 ASP 57 2HB ASP 57 -1.316 -3.089 -10.559
358 HB3 ASP 57 1HB ASP 57 -1.674 -2.021 -11.913
359 H GLY 58 H GLY 58 -2.174 0.106 -10.879
360 HA2 GLY 58 2HA GLY 58 -1.804 2.572 -11.390
361 HA3 GLY 58 1HA GLY 58 -0.880 1.976 -12.760
362 H GLN 59 H GLN 59 -2.093 0.516 -14.271
363 HA GLN 59 HA GLN 59 -4.520 1.817 -15.048
364 HB2 GLN 59 2HB GLN 59 -2.598 0.029 -16.240
365 HB3 GLN 59 1HB GLN 59 -4.230 -0.542 -16.557
366 HG2 GLN 59 2HG GLN 59 -4.779 1.754 -17.382
367 HG3 GLN 59 1HG GLN 59 -3.064 2.142 -17.245
368 HE21 GLN 59 1HE2 GLN 59 -2.990 2.534 -19.485
369 HE22 GLN 59 2HE2 GLN 59 -2.953 1.235 -20.623
370 H THR 60 H THR 60 -3.748 -0.956 -13.156
371 HA THR 60 HA THR 60 -6.527 -1.902 -13.312
372 HB THR 60 HB THR 60 -4.457 -3.477 -11.870
373 HG1 THR 60 1HG THR 60 -4.547 -3.203 -14.689
374 HG21 THR 60 3HG2 THR 60 -6.958 -3.983 -13.317
375 HG22 THR 60 1HG2 THR 60 -6.252 -4.811 -11.929
376 HG23 THR 60 2HG2 THR 60 -5.684 -5.178 -13.557
377 HA PRO 61 HA PRO 61 -6.389 0.223 -9.231
378 HB2 PRO 61 2HB PRO 61 -8.950 1.086 -9.296
379 HB3 PRO 61 1HB PRO 61 -7.637 1.955 -10.097
380 HG2 PRO 61 2HG PRO 61 -9.655 0.076 -11.265
381 HG3 PRO 61 1HG PRO 61 -9.069 1.625 -11.900
382 HD2 PRO 61 2HD PRO 61 -8.158 -0.773 -12.793
383 HD3 PRO 61 1HD PRO 61 -7.153 0.689 -12.763
384 H LYS 62 H LYS 62 -6.685 -0.944 -7.443
385 HA LYS 62 HA LYS 62 -9.055 -2.655 -7.222
386 HB2 LYS 62 2HB LYS 62 -6.199 -3.502 -7.079
387 HB3 LYS 62 1HB LYS 62 -7.345 -4.268 -5.987
388 HG2 LYS 62 2HG LYS 62 -7.752 -5.692 -7.640
389 HG3 LYS 62 1HG LYS 62 -8.635 -4.374 -8.413
390 HD2 LYS 62 2HD LYS 62 -7.129 -4.232 -10.050
391 HD3 LYS 62 1HD LYS 62 -5.796 -4.147 -8.898
392 HE2 LYS 62 2HE LYS 62 -7.154 -6.691 -9.780
393 HE3 LYS 62 1HE LYS 62 -5.639 -6.078 -10.445
394 HZ1 LYS 62 3HZ LYS 62 -5.383 -7.795 -8.684
395 HZ2 LYS 62 1HZ LYS 62 -6.035 -6.700 -7.571
396 HZ3 LYS 62 2HZ LYS 62 -4.578 -6.345 -8.353
397 H VAL 63 H VAL 63 -9.543 -3.291 -5.006
398 HA VAL 63 HA VAL 63 -8.231 -1.759 -2.903
399 HB VAL 63 HB VAL 63 -11.219 -1.571 -3.290
400 HG11 VAL 63 1HG1 VAL 63 -9.289 -0.282 -1.371
401 HG12 VAL 63 2HG1 VAL 63 -10.640 -1.351 -0.995
402 HG13 VAL 63 3HG1 VAL 63 -10.947 0.274 -1.604
403 HG21 VAL 63 3HG2 VAL 63 -10.680 0.862 -3.806
404 HG22 VAL 63 1HG2 VAL 63 -10.329 -0.315 -5.071
405 HG23 VAL 63 2HG2 VAL 63 -9.022 0.325 -4.075
406 H CYS 64 H CYS 64 -8.818 -2.462 -0.754
407 HA CYS 64 HA CYS 64 -9.725 -5.258 -0.742
408 HB2 CYS 64 2HB CYS 64 -7.748 -3.720 0.854
409 HB3 CYS 64 1HB CYS 64 -8.648 -4.974 1.700
410 H CYS 65 H CYS 65 -11.629 -5.735 0.103
411 HA CYS 65 HA CYS 65 -12.845 -3.848 2.009
412 HB2 CYS 65 2HB CYS 65 -13.908 -5.084 -0.446
413 HB3 CYS 65 1HB CYS 65 -14.991 -5.151 0.940
414 HA PRO 66 HA PRO 66 -12.702 -7.614 4.488
415 HB2 PRO 66 2HB PRO 66 -13.262 -6.475 6.856
416 HB3 PRO 66 1HB PRO 66 -11.680 -6.292 6.088
417 HG2 PRO 66 2HG PRO 66 -13.989 -4.386 6.145
418 HG3 PRO 66 1HG PRO 66 -12.261 -4.056 6.365
419 HD2 PRO 66 2HD PRO 66 -13.591 -3.644 4.012
420 HD3 PRO 66 1HD PRO 66 -11.857 -4.011 4.108
Start of MODEL 13
1 H GLN 11 H GLN 11 -10.544 -10.801 -5.527
2 HA GLN 11 HA GLN 11 -10.308 -13.565 -4.589
3 HB2 GLN 11 2HB GLN 11 -8.697 -11.668 -5.994
4 HB3 GLN 11 1HB GLN 11 -7.947 -11.972 -4.433
5 HG2 GLN 11 2HG GLN 11 -7.699 -14.259 -4.869
6 HG3 GLN 11 1HG GLN 11 -8.825 -14.207 -6.224
7 HE21 GLN 11 1HE2 GLN 11 -5.973 -15.067 -5.957
8 HE22 GLN 11 2HE2 GLN 11 -5.138 -14.211 -7.204
9 H ALA 12 H ALA 12 -9.301 -13.881 -2.520
10 HA ALA 12 HA ALA 12 -10.285 -12.004 -0.537
11 HB1 ALA 12 3HB ALA 12 -8.929 -14.676 -0.188
12 HB2 ALA 12 1HB ALA 12 -10.670 -14.392 -0.216
13 HB3 ALA 12 2HB ALA 12 -9.688 -13.725 1.090
14 H CYS 13 H CYS 13 -9.086 -10.448 0.314
15 HA CYS 13 HA CYS 13 -6.152 -10.724 0.227
16 HB2 CYS 13 2HB CYS 13 -6.084 -8.238 0.221
17 HB3 CYS 13 1HB CYS 13 -6.883 -8.908 -1.196
18 H THR 14 H THR 14 -5.024 -9.415 1.951
19 HA THR 14 HA THR 14 -6.421 -9.831 4.502
20 HB THR 14 HB THR 14 -4.330 -11.094 4.195
21 HG1 THR 14 1HG THR 14 -3.342 -10.382 6.134
22 HG21 THR 14 3HG2 THR 14 -3.193 -9.379 2.755
23 HG22 THR 14 1HG2 THR 14 -2.204 -10.095 4.027
24 HG23 THR 14 2HG2 THR 14 -2.868 -8.475 4.234
25 H LEU 15 H LEU 15 -7.226 -8.076 5.407
26 HA LEU 15 HA LEU 15 -6.626 -5.442 4.611
27 HB2 LEU 15 2HB LEU 15 -7.823 -4.883 6.837
28 HB3 LEU 15 1HB LEU 15 -8.728 -5.661 5.553
29 HG LEU 15 HG LEU 15 -7.480 -7.510 7.474
30 HD11 LEU 15 1HD1 LEU 15 -8.096 -6.325 9.279
31 HD12 LEU 15 2HD1 LEU 15 -9.710 -6.919 8.886
32 HD13 LEU 15 3HD1 LEU 15 -9.212 -5.311 8.363
33 HD21 LEU 15 3HD2 LEU 15 -9.109 -8.851 6.751
34 HD22 LEU 15 1HD2 LEU 15 -9.432 -7.619 5.532
35 HD23 LEU 15 2HD2 LEU 15 -10.353 -7.633 7.035
36 HA PRO 16 HA PRO 16 -3.101 -4.045 6.837
37 HB2 PRO 16 2HB PRO 16 -4.212 -2.000 8.412
38 HB3 PRO 16 1HB PRO 16 -3.546 -1.823 6.788
39 HG2 PRO 16 2HG PRO 16 -6.381 -2.126 7.653
40 HG3 PRO 16 1HG PRO 16 -5.705 -1.170 6.320
41 HD2 PRO 16 2HD PRO 16 -6.978 -3.474 5.859
42 HD3 PRO 16 1HD PRO 16 -5.544 -3.017 4.916
43 H ASN 17 H ASN 17 -6.008 -4.776 8.634
44 HA ASN 17 HA ASN 17 -4.617 -4.984 11.164
45 HB2 ASN 17 2HB ASN 17 -7.345 -4.775 10.312
46 HB3 ASN 17 1HB ASN 17 -7.174 -6.204 11.328
47 HD21 ASN 17 1HD2 ASN 17 -7.849 -5.702 13.280
48 HD22 ASN 17 2HD2 ASN 17 -7.424 -4.283 14.169
49 H ASN 18 H ASN 18 -5.148 -6.985 8.478
50 HA ASN 18 HA ASN 18 -4.661 -9.157 8.037
51 HB2 ASN 18 2HB ASN 18 -3.117 -8.633 10.525
52 HB3 ASN 18 1HB ASN 18 -3.331 -10.313 10.050
53 HD21 ASN 18 1HD2 ASN 18 -0.849 -9.576 10.091
54 HD22 ASN 18 2HD2 ASN 18 -0.215 -9.264 8.514
55 H ASP 19 H ASP 19 -6.906 -9.646 8.107
56 HA ASP 19 HA ASP 19 -7.539 -11.657 10.078
57 HB2 ASP 19 2HB ASP 19 -8.832 -8.980 10.074
58 HB3 ASP 19 1HB ASP 19 -9.880 -10.376 10.312
59 H LYS 20 H LYS 20 -7.157 -11.369 7.148
60 HA LYS 20 HA LYS 20 -8.016 -12.251 5.238
61 HB2 LYS 20 2HB LYS 20 -10.103 -13.466 7.056
62 HB3 LYS 20 1HB LYS 20 -9.730 -13.975 5.415
63 HG2 LYS 20 2HG LYS 20 -7.897 -15.124 6.040
64 HG3 LYS 20 1HG LYS 20 -7.466 -13.965 7.300
65 HD2 LYS 20 2HD LYS 20 -9.938 -15.471 7.802
66 HD3 LYS 20 1HD LYS 20 -8.472 -16.451 7.759
67 HE2 LYS 20 2HE LYS 20 -8.006 -14.046 9.259
68 HE3 LYS 20 1HE LYS 20 -9.434 -14.875 9.878
69 HZ1 LYS 20 3HZ LYS 20 -6.649 -15.810 9.769
70 HZ2 LYS 20 1HZ LYS 20 -7.904 -16.945 9.754
71 HZ3 LYS 20 2HZ LYS 20 -7.749 -15.871 11.052
72 H GLY 21 H GLY 21 -9.342 -11.548 3.629
73 HA2 GLY 21 2HA GLY 21 -11.942 -10.450 4.144
74 HA3 GLY 21 1HA GLY 21 -10.742 -9.206 3.827
75 H THR 22 H THR 22 -12.050 -8.664 1.975
76 HA THR 22 HA THR 22 -11.520 -10.445 -0.314
77 HB THR 22 HB THR 22 -13.897 -8.606 -0.195
78 HG1 THR 22 1HG THR 22 -14.806 -9.877 1.177
79 HG21 THR 22 3HG2 THR 22 -14.602 -10.890 -1.535
80 HG22 THR 22 1HG2 THR 22 -12.926 -10.643 -2.022
81 HG23 THR 22 2HG2 THR 22 -14.113 -9.364 -2.270
82 H CYS 23 H CYS 23 -10.945 -9.466 -2.261
83 HA CYS 23 HA CYS 23 -10.304 -6.595 -2.063
84 HB2 CYS 23 2HB CYS 23 -8.485 -8.616 -2.299
85 HB3 CYS 23 1HB CYS 23 -8.746 -8.192 -3.987
86 H LYS 24 H LYS 24 -11.346 -5.348 -3.438
87 HA LYS 24 HA LYS 24 -11.927 -6.299 -6.131
88 HB2 LYS 24 2HB LYS 24 -14.280 -5.142 -5.762
89 HB3 LYS 24 1HB LYS 24 -14.024 -6.840 -5.384
90 HG2 LYS 24 2HG LYS 24 -15.214 -5.955 -3.567
91 HG3 LYS 24 1HG LYS 24 -13.545 -6.095 -3.009
92 HD2 LYS 24 2HD LYS 24 -13.762 -3.549 -4.168
93 HD3 LYS 24 1HD LYS 24 -15.220 -3.764 -3.197
94 HE2 LYS 24 2HE LYS 24 -14.058 -3.901 -1.233
95 HE3 LYS 24 1HE LYS 24 -12.610 -4.543 -2.008
96 HZ1 LYS 24 3HZ LYS 24 -12.361 -2.262 -3.021
97 HZ2 LYS 24 1HZ LYS 24 -12.081 -2.369 -1.356
98 HZ3 LYS 24 2HZ LYS 24 -13.540 -1.735 -1.929
99 H SER 25 H SER 25 -12.857 -4.453 -7.482
100 HA SER 25 HA SER 25 -11.076 -2.319 -7.499
101 HB2 SER 25 2HB SER 25 -12.520 -3.112 -9.418
102 HB3 SER 25 1HB SER 25 -13.859 -2.237 -8.674
103 HG SER 25 HG SER 25 -11.391 -1.003 -9.301
104 H LEU 26 H LEU 26 -12.195 0.058 -7.674
105 HA LEU 26 HA LEU 26 -13.096 0.577 -4.945
106 HB2 LEU 26 2HB LEU 26 -12.466 2.859 -5.318
107 HB3 LEU 26 1HB LEU 26 -11.163 1.821 -5.864
108 HG LEU 26 HG LEU 26 -12.806 2.289 -8.114
109 HD11 LEU 26 1HD1 LEU 26 -13.182 4.547 -8.259
110 HD12 LEU 26 2HD1 LEU 26 -11.969 4.938 -7.041
111 HD13 LEU 26 3HD1 LEU 26 -13.521 4.260 -6.551
112 HD21 LEU 26 3HD2 LEU 26 -10.714 3.694 -8.743
113 HD22 LEU 26 1HD2 LEU 26 -10.554 1.954 -8.504
114 HD23 LEU 26 2HD2 LEU 26 -10.060 3.070 -7.228
115 H LEU 27 H LEU 27 -14.990 -0.594 -6.691
116 HA LEU 27 HA LEU 27 -17.068 1.424 -6.533
117 HB2 LEU 27 2HB LEU 27 -16.327 0.059 -9.120
118 HB3 LEU 27 1HB LEU 27 -17.845 0.898 -8.862
119 HG LEU 27 HG LEU 27 -15.179 2.265 -8.561
120 HD11 LEU 27 1HD1 LEU 27 -15.133 1.575 -10.799
121 HD12 LEU 27 2HD1 LEU 27 -15.765 3.221 -10.848
122 HD13 LEU 27 3HD1 LEU 27 -16.861 1.849 -11.009
123 HD21 LEU 27 3HD2 LEU 27 -16.897 4.171 -9.279
124 HD22 LEU 27 1HD2 LEU 27 -16.646 3.703 -7.598
125 HD23 LEU 27 2HD2 LEU 27 -18.027 3.070 -8.492
126 H GLN 28 H GLN 28 -16.405 -1.102 -5.203
127 HA GLN 28 HA GLN 28 -18.863 -2.585 -5.856
128 HB2 GLN 28 2HB GLN 28 -16.238 -3.752 -4.914
129 HB3 GLN 28 1HB GLN 28 -17.721 -4.658 -5.184
130 HG2 GLN 28 2HG GLN 28 -17.409 -3.434 -7.583
131 HG3 GLN 28 1HG GLN 28 -15.732 -3.670 -7.094
132 HE21 GLN 28 1HE2 GLN 28 -18.687 -5.591 -6.684
133 HE22 GLN 28 2HE2 GLN 28 -18.053 -7.036 -7.388
134 H CYS 29 H CYS 29 -16.460 -1.937 -3.313
135 HA CYS 29 HA CYS 29 -18.171 -2.817 -1.204
136 HB2 CYS 29 2HB CYS 29 -15.456 -2.104 -1.466
137 HB3 CYS 29 1HB CYS 29 -16.137 -0.989 -0.286
138 H ASP 30 H ASP 30 -19.757 -1.760 -0.227
139 HA ASP 30 HA ASP 30 -20.687 0.735 -1.068
140 HB2 ASP 30 2HB ASP 30 -21.406 -1.235 0.950
141 HB3 ASP 30 1HB ASP 30 -21.709 0.410 1.502
142 H VAL 31 H VAL 31 -18.429 -0.135 1.450
143 HA VAL 31 HA VAL 31 -18.471 2.323 2.853
144 HB VAL 31 HB VAL 31 -16.158 0.391 2.656
145 HG11 VAL 31 1HG1 VAL 31 -15.273 1.382 4.546
146 HG12 VAL 31 2HG1 VAL 31 -16.819 2.076 5.034
147 HG13 VAL 31 3HG1 VAL 31 -15.928 2.773 3.682
148 HG21 VAL 31 3HG2 VAL 31 -18.427 0.402 4.645
149 HG22 VAL 31 1HG2 VAL 31 -17.062 -0.714 4.611
150 HG23 VAL 31 2HG2 VAL 31 -18.253 -0.740 3.311
151 H ALA 32 H ALA 32 -16.478 1.103 0.205
152 HA ALA 32 HA ALA 32 -14.725 3.313 0.074
153 HB1 ALA 32 3HB ALA 32 -13.799 2.294 -1.743
154 HB2 ALA 32 1HB ALA 32 -15.360 1.799 -2.400
155 HB3 ALA 32 2HB ALA 32 -14.651 0.916 -1.047
156 H SER 33 H SER 33 -17.831 2.637 -1.420
157 HA SER 33 HA SER 33 -17.814 4.819 -3.223
158 HB2 SER 33 2HB SER 33 -19.296 2.874 -3.507
159 HB3 SER 33 1HB SER 33 -20.175 3.332 -2.050
160 HG SER 33 HG SER 33 -21.212 4.077 -3.948
161 H LYS 34 H LYS 34 -18.883 4.461 0.111
162 HA LYS 34 HA LYS 34 -20.247 6.950 0.236
163 HB2 LYS 34 2HB LYS 34 -20.378 6.600 2.605
164 HB3 LYS 34 1HB LYS 34 -20.637 5.056 1.809
165 HG2 LYS 34 2HG LYS 34 -18.720 4.158 2.610
166 HG3 LYS 34 1HG LYS 34 -17.873 5.703 2.649
167 HD2 LYS 34 2HD LYS 34 -18.707 6.263 4.710
168 HD3 LYS 34 1HD LYS 34 -20.170 5.298 4.497
169 HE2 LYS 34 2HE LYS 34 -19.153 3.355 5.161
170 HE3 LYS 34 1HE LYS 34 -17.554 3.887 4.638
171 HZ1 LYS 34 3HZ LYS 34 -17.233 4.179 6.823
172 HZ2 LYS 34 1HZ LYS 34 -18.885 4.255 7.182
173 HZ3 LYS 34 2HZ LYS 34 -18.081 5.627 6.602
174 H ILE 35 H ILE 35 -16.921 5.980 0.753
175 HA ILE 35 HA ILE 35 -16.095 8.394 2.022
176 HB ILE 35 HB ILE 35 -14.412 6.392 0.506
177 HG12 ILE 35 2HG1 ILE 35 -14.686 6.556 3.496
178 HG13 ILE 35 1HG1 ILE 35 -15.839 5.629 2.540
179 HG21 ILE 35 1HG2 ILE 35 -13.787 8.828 2.045
180 HG22 ILE 35 2HG2 ILE 35 -12.899 8.050 0.733
181 HG23 ILE 35 3HG2 ILE 35 -12.775 7.422 2.377
182 HD11 ILE 35 3HD1 ILE 35 -14.163 4.146 1.791
183 HD12 ILE 35 1HD1 ILE 35 -13.925 4.337 3.528
184 HD13 ILE 35 2HD1 ILE 35 -12.874 5.187 2.396
185 H ILE 36 H ILE 36 -16.228 7.282 -1.309
186 HA ILE 36 HA ILE 36 -14.809 9.524 -2.385
187 HB ILE 36 HB ILE 36 -16.641 7.596 -3.814
188 HG12 ILE 36 2HG1 ILE 36 -14.685 6.592 -2.530
189 HG13 ILE 36 1HG1 ILE 36 -14.754 6.226 -4.250
190 HG21 ILE 36 1HG2 ILE 36 -14.933 8.287 -5.699
191 HG22 ILE 36 2HG2 ILE 36 -14.794 9.745 -4.715
192 HG23 ILE 36 3HG2 ILE 36 -16.363 9.260 -5.356
193 HD11 ILE 36 3HD1 ILE 36 -12.489 6.784 -3.342
194 HD12 ILE 36 1HD1 ILE 36 -13.069 8.431 -3.099
195 HD13 ILE 36 2HD1 ILE 36 -13.005 7.749 -4.726
196 H SER 37 H SER 37 -18.125 8.838 -1.590
197 HA SER 37 HA SER 37 -19.006 11.273 -2.970
198 HB2 SER 37 2HB SER 37 -20.153 8.827 -3.001
199 HB3 SER 37 1HB SER 37 -21.009 9.547 -1.638
200 HG SER 37 HG SER 37 -21.765 9.850 -3.986
201 H LYS 38 H LYS 38 -17.856 10.460 -0.009
202 HA LYS 38 HA LYS 38 -19.769 11.876 1.618
203 HB2 LYS 38 2HB LYS 38 -17.352 10.271 2.066
204 HB3 LYS 38 1HB LYS 38 -17.525 11.625 3.175
205 HG2 LYS 38 2HG LYS 38 -19.940 9.992 2.762
206 HG3 LYS 38 1HG LYS 38 -18.598 9.200 3.590
207 HD2 LYS 38 2HD LYS 38 -20.096 10.259 5.193
208 HD3 LYS 38 1HD LYS 38 -18.515 11.045 5.204
209 HE2 LYS 38 2HE LYS 38 -19.310 12.970 4.259
210 HE3 LYS 38 1HE LYS 38 -20.614 12.142 3.408
211 HZ1 LYS 38 3HZ LYS 38 -20.504 12.952 6.249
212 HZ2 LYS 38 1HZ LYS 38 -21.600 11.783 5.705
213 HZ3 LYS 38 2HZ LYS 38 -21.663 13.354 5.083
214 H LYS 39 H LYS 39 -16.276 12.419 1.604
215 HA LYS 39 HA LYS 39 -16.197 14.936 0.451
216 HB2 LYS 39 2HB LYS 39 -17.562 15.066 2.879
217 HB3 LYS 39 1HB LYS 39 -15.946 15.646 3.259
218 HG2 LYS 39 2HG LYS 39 -16.536 16.953 0.913
219 HG3 LYS 39 1HG LYS 39 -18.085 16.919 1.759
220 HD2 LYS 39 2HD LYS 39 -17.054 18.897 2.485
221 HD3 LYS 39 1HD LYS 39 -16.791 17.750 3.799
222 HE2 LYS 39 2HE LYS 39 -14.686 17.715 1.773
223 HE3 LYS 39 1HE LYS 39 -14.854 19.269 2.588
224 HZ1 LYS 39 3HZ LYS 39 -14.943 17.644 4.672
225 HZ2 LYS 39 1HZ LYS 39 -13.493 18.263 4.059
226 HZ3 LYS 39 2HZ LYS 39 -13.986 16.700 3.646
227 HA PRO 40 HA PRO 40 -12.340 14.337 3.523
228 HB2 PRO 40 2HB PRO 40 -12.872 11.436 3.984
229 HB3 PRO 40 1HB PRO 40 -12.126 12.627 5.056
230 HG2 PRO 40 2HG PRO 40 -14.633 11.843 5.455
231 HG3 PRO 40 1HG PRO 40 -14.167 13.539 5.682
232 HD2 PRO 40 2HD PRO 40 -15.683 12.270 3.450
233 HD3 PRO 40 1HD PRO 40 -15.859 13.887 4.161
234 H ARG 41 H ARG 41 -11.070 14.552 1.753
235 HA ARG 41 HA ARG 41 -10.092 12.127 0.506
236 HB2 ARG 41 2HB ARG 41 -11.995 12.714 -0.926
237 HB3 ARG 41 1HB ARG 41 -11.345 14.333 -1.142
238 HG2 ARG 41 2HG ARG 41 -9.511 13.530 -2.403
239 HG3 ARG 41 1HG ARG 41 -9.858 11.857 -1.966
240 HD2 ARG 41 2HD ARG 41 -11.401 11.637 -3.577
241 HD3 ARG 41 1HD ARG 41 -12.095 13.225 -3.256
242 HE ARG 41 HE ARG 41 -9.780 13.826 -4.498
243 HH11 ARG 41 1HH1 ARG 41 -12.396 11.657 -5.299
244 HH12 ARG 41 2HH1 ARG 41 -12.176 11.823 -7.008
245 HH21 ARG 41 1HH2 ARG 41 -9.490 14.045 -6.747
246 HH22 ARG 41 2HH2 ARG 41 -10.526 13.176 -7.831
247 H THR 42 H THR 42 -8.391 13.115 1.967
248 HA THR 42 HA THR 42 -6.883 15.212 0.554
249 HB THR 42 HB THR 42 -5.639 15.255 2.857
250 HG1 THR 42 1HG THR 42 -6.876 13.373 3.584
251 HG21 THR 42 3HG2 THR 42 -6.708 17.156 3.254
252 HG22 THR 42 1HG2 THR 42 -8.264 16.343 3.414
253 HG23 THR 42 2HG2 THR 42 -7.665 16.792 1.817
254 H ALA 43 H ALA 43 -4.391 14.933 1.378
255 HA ALA 43 HA ALA 43 -3.324 12.868 -0.139
256 HB1 ALA 43 3HB ALA 43 -1.666 13.774 2.123
257 HB2 ALA 43 1HB ALA 43 -2.291 15.045 1.071
258 HB3 ALA 43 2HB ALA 43 -1.314 13.742 0.394
259 H GLN 44 H GLN 44 -4.246 12.931 3.238
260 HA GLN 44 HA GLN 44 -2.940 10.569 4.052
261 HB2 GLN 44 2HB GLN 44 -4.256 12.471 5.383
262 HB3 GLN 44 1HB GLN 44 -5.555 11.292 5.273
263 HG2 GLN 44 2HG GLN 44 -3.886 9.617 6.221
264 HG3 GLN 44 1HG GLN 44 -2.894 11.019 6.622
265 HE21 GLN 44 1HE2 GLN 44 -6.139 9.679 7.035
266 HE22 GLN 44 2HE2 GLN 44 -6.411 10.353 8.602
267 H ASP 45 H ASP 45 -5.955 11.169 2.400
268 HA ASP 45 HA ASP 45 -7.068 8.578 2.763
269 HB2 ASP 45 2HB ASP 45 -7.774 11.029 1.385
270 HB3 ASP 45 1HB ASP 45 -8.121 9.621 0.385
271 H GLU 46 H GLU 46 -4.973 10.037 0.355
272 HA GLU 46 HA GLU 46 -5.110 7.959 -1.551
273 HB2 GLU 46 2HB GLU 46 -4.122 10.397 -1.695
274 HB3 GLU 46 1HB GLU 46 -2.632 9.597 -1.215
275 HG2 GLU 46 2HG GLU 46 -2.387 8.552 -3.202
276 HG3 GLU 46 1HG GLU 46 -4.123 8.366 -3.444
277 H LYS 47 H LYS 47 -2.928 8.572 1.158
278 HA LYS 47 HA LYS 47 -1.222 6.363 0.641
279 HB2 LYS 47 2HB LYS 47 -0.408 6.715 2.942
280 HB3 LYS 47 1HB LYS 47 -0.478 8.217 2.031
281 HG2 LYS 47 2HG LYS 47 -2.428 8.922 3.179
282 HG3 LYS 47 1HG LYS 47 -2.639 7.336 3.924
283 HD2 LYS 47 2HD LYS 47 -1.711 8.723 5.598
284 HD3 LYS 47 1HD LYS 47 -0.389 7.705 5.025
285 HE2 LYS 47 2HE LYS 47 0.269 9.581 3.499
286 HE3 LYS 47 1HE LYS 47 -0.929 10.582 4.317
287 HZ1 LYS 47 3HZ LYS 47 1.064 9.189 5.950
288 HZ2 LYS 47 1HZ LYS 47 0.307 10.679 6.212
289 HZ3 LYS 47 2HZ LYS 47 1.558 10.554 5.082
290 H PHE 48 H PHE 48 -4.135 6.807 2.547
291 HA PHE 48 HA PHE 48 -4.074 4.293 3.844
292 HB2 PHE 48 2HB PHE 48 -5.678 6.580 3.945
293 HB3 PHE 48 1HB PHE 48 -6.762 5.294 3.424
294 HD1 PHE 48 2HD PHE 48 -5.923 2.967 4.837
295 HD2 PHE 48 1HD PHE 48 -6.001 7.007 6.172
296 HE1 PHE 48 2HE PHE 48 -6.116 2.190 7.163
297 HE2 PHE 48 1HE PHE 48 -6.194 6.238 8.500
298 HZ PHE 48 HZ PHE 48 -6.252 3.826 8.999
299 H LEU 49 H LEU 49 -5.571 5.424 0.849
300 HA LEU 49 HA LEU 49 -6.918 2.975 0.314
301 HB2 LEU 49 2HB LEU 49 -7.678 3.960 -1.606
302 HB3 LEU 49 1HB LEU 49 -7.288 5.382 -0.663
303 HG LEU 49 HG LEU 49 -4.976 5.199 -1.912
304 HD11 LEU 49 1HD1 LEU 49 -6.763 3.382 -3.408
305 HD12 LEU 49 2HD1 LEU 49 -5.008 3.368 -3.240
306 HD13 LEU 49 3HD1 LEU 49 -5.778 4.492 -4.360
307 HD21 LEU 49 3HD2 LEU 49 -7.318 6.158 -3.517
308 HD22 LEU 49 1HD2 LEU 49 -5.706 6.857 -3.380
309 HD23 LEU 49 2HD2 LEU 49 -6.833 6.969 -2.029
310 H ARG 50 H ARG 50 -3.791 4.311 -0.575
311 HA ARG 50 HA ARG 50 -3.076 2.285 -2.419
312 HB2 ARG 50 2HB ARG 50 -1.543 4.345 -0.867
313 HB3 ARG 50 1HB ARG 50 -0.688 3.113 -1.786
314 HG2 ARG 50 2HG ARG 50 -2.354 3.947 -3.687
315 HG3 ARG 50 1HG ARG 50 -2.273 5.425 -2.724
316 HD2 ARG 50 2HD ARG 50 -0.469 5.821 -4.028
317 HD3 ARG 50 1HD ARG 50 0.333 4.821 -2.818
318 HE ARG 50 HE ARG 50 -0.510 3.015 -4.642
319 HH11 ARG 50 1HH1 ARG 50 1.326 5.972 -4.897
320 HH12 ARG 50 2HH1 ARG 50 2.226 5.441 -6.278
321 HH21 ARG 50 1HH2 ARG 50 0.672 2.315 -6.458
322 HH22 ARG 50 2HH2 ARG 50 1.855 3.365 -7.165
323 H GLU 51 H GLU 51 -2.699 2.651 1.054
324 HA GLU 51 HA GLU 51 -1.016 0.369 1.392
325 HB2 GLU 51 2HB GLU 51 -1.596 2.476 2.964
326 HB3 GLU 51 1HB GLU 51 -2.695 1.290 3.655
327 HG2 GLU 51 2HG GLU 51 -0.842 -0.219 4.072
328 HG3 GLU 51 1HG GLU 51 0.274 0.922 3.324
329 H SER 52 H SER 52 -4.445 0.905 1.233
330 HA SER 52 HA SER 52 -5.009 -1.806 2.170
331 HB2 SER 52 2HB SER 52 -7.095 0.175 1.291
332 HB3 SER 52 1HB SER 52 -7.243 -1.147 2.450
333 HG SER 52 HG SER 52 -7.002 0.492 3.790
334 H ALA 53 H ALA 53 -3.622 -1.555 -0.281
335 HA ALA 53 HA ALA 53 -5.665 -2.550 -2.163
336 HB1 ALA 53 3HB ALA 53 -4.559 -1.550 -3.986
337 HB2 ALA 53 1HB ALA 53 -3.124 -1.192 -3.025
338 HB3 ALA 53 2HB ALA 53 -4.621 -0.304 -2.737
339 H CYS 54 H CYS 54 -5.353 -4.555 -2.911
340 HA CYS 54 HA CYS 54 -2.988 -6.004 -2.065
341 HB2 CYS 54 2HB CYS 54 -4.183 -7.985 -2.975
342 HB3 CYS 54 1HB CYS 54 -5.126 -7.101 -1.780
343 H GLY 55 H GLY 55 -1.509 -4.804 -3.452
344 HA2 GLY 55 2HA GLY 55 -0.027 -5.398 -5.244
345 HA3 GLY 55 1HA GLY 55 -1.410 -6.018 -6.132
346 H PHE 56 H PHE 56 0.028 -4.538 -7.655
347 HA PHE 56 HA PHE 56 -1.576 -2.213 -8.153
348 HB2 PHE 56 2HB PHE 56 1.240 -1.929 -7.139
349 HB3 PHE 56 1HB PHE 56 0.537 -0.717 -8.205
350 HD1 PHE 56 1HD PHE 56 -1.926 0.028 -7.432
351 HD2 PHE 56 2HD PHE 56 1.119 -1.521 -4.895
352 HE1 PHE 56 1HE PHE 56 -2.992 1.112 -5.496
353 HE2 PHE 56 2HE PHE 56 0.059 -0.441 -2.956
354 HZ PHE 56 HZ PHE 56 -1.999 0.877 -3.256
355 H ASP 57 H ASP 57 -1.940 -3.287 -10.121
356 HA ASP 57 HA ASP 57 0.083 -4.202 -11.847
357 HB2 ASP 57 2HB ASP 57 -2.599 -4.421 -11.857
358 HB3 ASP 57 1HB ASP 57 -2.412 -3.148 -13.060
359 H GLY 58 H GLY 58 -1.274 -1.040 -11.287
360 HA2 GLY 58 2HA GLY 58 0.330 0.788 -11.847
361 HA3 GLY 58 1HA GLY 58 0.461 0.031 -13.427
362 H GLN 59 H GLN 59 -2.252 -0.551 -13.870
363 HA GLN 59 HA GLN 59 -3.388 2.163 -14.047
364 HB2 GLN 59 2HB GLN 59 -2.807 0.234 -16.099
365 HB3 GLN 59 1HB GLN 59 -4.532 0.565 -16.069
366 HG2 GLN 59 2HG GLN 59 -2.653 2.863 -15.991
367 HG3 GLN 59 1HG GLN 59 -2.874 2.003 -17.514
368 HE21 GLN 59 1HE2 GLN 59 -3.996 3.488 -18.640
369 HE22 GLN 59 2HE2 GLN 59 -5.548 4.095 -18.185
370 H THR 60 H THR 60 -3.900 -1.081 -13.043
371 HA THR 60 HA THR 60 -6.792 -0.743 -12.893
372 HB THR 60 HB THR 60 -5.820 -2.887 -13.700
373 HG1 THR 60 1HG THR 60 -7.168 -4.189 -12.377
374 HG21 THR 60 3HG2 THR 60 -4.565 -4.306 -12.461
375 HG22 THR 60 1HG2 THR 60 -5.184 -3.698 -10.926
376 HG23 THR 60 2HG2 THR 60 -3.977 -2.774 -11.818
377 HA PRO 61 HA PRO 61 -6.063 0.531 -8.611
378 HB2 PRO 61 2HB PRO 61 -8.345 1.879 -8.272
379 HB3 PRO 61 1HB PRO 61 -7.032 2.539 -9.256
380 HG2 PRO 61 2HG PRO 61 -9.551 1.181 -10.124
381 HG3 PRO 61 1HG PRO 61 -8.755 2.608 -10.810
382 HD2 PRO 61 2HD PRO 61 -8.531 0.051 -11.825
383 HD3 PRO 61 1HD PRO 61 -7.347 1.345 -12.089
384 H LYS 62 H LYS 62 -6.418 -0.778 -6.920
385 HA LYS 62 HA LYS 62 -9.051 -2.032 -6.622
386 HB2 LYS 62 2HB LYS 62 -6.418 -3.412 -6.866
387 HB3 LYS 62 1HB LYS 62 -7.611 -4.083 -5.761
388 HG2 LYS 62 2HG LYS 62 -9.111 -3.677 -7.993
389 HG3 LYS 62 1HG LYS 62 -7.539 -4.082 -8.687
390 HD2 LYS 62 2HD LYS 62 -7.643 -6.224 -7.988
391 HD3 LYS 62 1HD LYS 62 -8.392 -5.791 -6.451
392 HE2 LYS 62 2HE LYS 62 -10.545 -5.556 -7.517
393 HE3 LYS 62 1HE LYS 62 -9.826 -5.841 -9.102
394 HZ1 LYS 62 3HZ LYS 62 -9.427 -7.895 -7.066
395 HZ2 LYS 62 1HZ LYS 62 -9.662 -8.056 -8.734
396 HZ3 LYS 62 2HZ LYS 62 -10.981 -7.752 -7.720
397 H VAL 63 H VAL 63 -9.539 -2.736 -4.470
398 HA VAL 63 HA VAL 63 -7.792 -1.665 -2.367
399 HB VAL 63 HB VAL 63 -10.783 -1.249 -2.379
400 HG11 VAL 63 1HG1 VAL 63 -10.176 0.384 -0.555
401 HG12 VAL 63 2HG1 VAL 63 -8.564 -0.334 -0.563
402 HG13 VAL 63 3HG1 VAL 63 -9.968 -1.321 -0.156
403 HG21 VAL 63 3HG2 VAL 63 -9.788 1.242 -2.545
404 HG22 VAL 63 1HG2 VAL 63 -10.295 0.302 -3.949
405 HG23 VAL 63 2HG2 VAL 63 -8.590 0.372 -3.504
406 H CYS 64 H CYS 64 -8.278 -2.536 -0.220
407 HA CYS 64 HA CYS 64 -9.317 -5.279 -0.413
408 HB2 CYS 64 2HB CYS 64 -6.909 -4.871 0.293
409 HB3 CYS 64 1HB CYS 64 -7.552 -4.167 1.770
410 H CYS 65 H CYS 65 -11.176 -5.749 0.552
411 HA CYS 65 HA CYS 65 -12.140 -3.954 2.679
412 HB2 CYS 65 2HB CYS 65 -13.429 -5.021 0.290
413 HB3 CYS 65 1HB CYS 65 -14.360 -5.335 1.750
414 HA PRO 66 HA PRO 66 -11.864 -7.550 5.290
415 HB2 PRO 66 2HB PRO 66 -13.212 -6.591 7.433
416 HB3 PRO 66 1HB PRO 66 -11.572 -6.069 7.029
417 HG2 PRO 66 2HG PRO 66 -14.183 -4.713 6.471
418 HG3 PRO 66 1HG PRO 66 -12.663 -4.014 7.060
419 HD2 PRO 66 2HD PRO 66 -13.444 -3.856 4.466
420 HD3 PRO 66 1HD PRO 66 -11.738 -3.936 4.952
Start of MODEL 14
1 H GLN 11 H GLN 11 -11.241 -12.040 -6.251
2 HA GLN 11 HA GLN 11 -10.906 -13.658 -4.468
3 HB2 GLN 11 2HB GLN 11 -9.222 -12.941 -6.216
4 HB3 GLN 11 1HB GLN 11 -8.531 -11.869 -5.004
5 HG2 GLN 11 2HG GLN 11 -7.197 -13.588 -4.532
6 HG3 GLN 11 1HG GLN 11 -8.589 -14.235 -3.668
7 HE21 GLN 11 1HE2 GLN 11 -10.201 -15.279 -5.391
8 HE22 GLN 11 2HE2 GLN 11 -9.446 -16.462 -6.398
9 H ALA 12 H ALA 12 -10.126 -14.095 -2.390
10 HA ALA 12 HA ALA 12 -10.677 -12.074 -0.446
11 HB1 ALA 12 3HB ALA 12 -9.593 -14.023 1.036
12 HB2 ALA 12 1HB ALA 12 -9.995 -14.948 -0.411
13 HB3 ALA 12 2HB ALA 12 -11.256 -14.069 0.453
14 H CYS 13 H CYS 13 -9.320 -10.572 0.267
15 HA CYS 13 HA CYS 13 -6.427 -11.109 0.094
16 HB2 CYS 13 2HB CYS 13 -6.052 -8.747 -0.251
17 HB3 CYS 13 1HB CYS 13 -7.221 -9.317 -1.435
18 H THR 14 H THR 14 -5.125 -9.790 1.676
19 HA THR 14 HA THR 14 -6.415 -9.977 4.301
20 HB THR 14 HB THR 14 -4.429 -11.308 4.131
21 HG1 THR 14 1HG THR 14 -3.734 -8.936 5.513
22 HG21 THR 14 3HG2 THR 14 -3.305 -10.239 2.272
23 HG22 THR 14 1HG2 THR 14 -2.227 -10.371 3.662
24 HG23 THR 14 2HG2 THR 14 -2.973 -8.822 3.268
25 H LEU 15 H LEU 15 -7.139 -8.160 5.161
26 HA LEU 15 HA LEU 15 -6.577 -5.588 4.186
27 HB2 LEU 15 2HB LEU 15 -7.590 -4.863 6.428
28 HB3 LEU 15 1HB LEU 15 -8.597 -5.788 5.330
29 HG LEU 15 HG LEU 15 -7.115 -7.414 7.283
30 HD11 LEU 15 1HD1 LEU 15 -7.790 -5.266 8.507
31 HD12 LEU 15 2HD1 LEU 15 -8.278 -6.809 9.208
32 HD13 LEU 15 3HD1 LEU 15 -9.446 -5.837 8.310
33 HD21 LEU 15 3HD2 LEU 15 -10.065 -7.444 6.964
34 HD22 LEU 15 1HD2 LEU 15 -8.926 -8.783 7.116
35 HD23 LEU 15 2HD2 LEU 15 -9.083 -7.930 5.580
36 HA PRO 16 HA PRO 16 -2.880 -4.073 6.023
37 HB2 PRO 16 2HB PRO 16 -4.499 -2.099 7.566
38 HB3 PRO 16 1HB PRO 16 -3.097 -1.834 6.524
39 HG2 PRO 16 2HG PRO 16 -5.543 -1.231 5.673
40 HG3 PRO 16 1HG PRO 16 -4.353 -1.958 4.577
41 HD2 PRO 16 2HD PRO 16 -6.714 -3.201 5.907
42 HD3 PRO 16 1HD PRO 16 -6.025 -3.519 4.303
43 H ASN 17 H ASN 17 -5.597 -4.708 8.140
44 HA ASN 17 HA ASN 17 -3.958 -4.840 10.518
45 HB2 ASN 17 2HB ASN 17 -6.577 -4.281 10.156
46 HB3 ASN 17 1HB ASN 17 -6.685 -5.992 10.559
47 HD21 ASN 17 1HD2 ASN 17 -7.879 -4.435 12.266
48 HD22 ASN 17 2HD2 ASN 17 -6.968 -4.217 13.718
49 H ASN 18 H ASN 18 -4.718 -6.934 7.970
50 HA ASN 18 HA ASN 18 -4.258 -9.119 7.568
51 HB2 ASN 18 2HB ASN 18 -2.505 -8.458 9.853
52 HB3 ASN 18 1HB ASN 18 -2.820 -10.174 9.618
53 HD21 ASN 18 1HD2 ASN 18 -1.908 -7.273 7.800
54 HD22 ASN 18 2HD2 ASN 18 -0.797 -8.073 6.747
55 H ASP 19 H ASP 19 -6.509 -9.565 7.821
56 HA ASP 19 HA ASP 19 -7.012 -11.529 9.877
57 HB2 ASP 19 2HB ASP 19 -8.708 -9.026 9.724
58 HB3 ASP 19 1HB ASP 19 -9.080 -10.448 10.695
59 H LYS 20 H LYS 20 -6.867 -11.317 6.925
60 HA LYS 20 HA LYS 20 -7.901 -12.214 5.110
61 HB2 LYS 20 2HB LYS 20 -9.969 -13.327 7.002
62 HB3 LYS 20 1HB LYS 20 -9.493 -13.959 5.432
63 HG2 LYS 20 2HG LYS 20 -8.142 -15.343 6.514
64 HG3 LYS 20 1HG LYS 20 -7.140 -13.942 6.899
65 HD2 LYS 20 2HD LYS 20 -8.967 -13.701 8.835
66 HD3 LYS 20 1HD LYS 20 -9.046 -15.447 8.597
67 HE2 LYS 20 2HE LYS 20 -6.440 -15.282 8.706
68 HE3 LYS 20 1HE LYS 20 -6.766 -13.754 9.525
69 HZ1 LYS 20 3HZ LYS 20 -7.674 -16.453 10.362
70 HZ2 LYS 20 1HZ LYS 20 -8.184 -15.015 11.094
71 HZ3 LYS 20 2HZ LYS 20 -6.554 -15.464 11.155
72 H GLY 21 H GLY 21 -9.430 -11.614 3.606
73 HA2 GLY 21 2HA GLY 21 -11.915 -10.400 4.321
74 HA3 GLY 21 1HA GLY 21 -10.721 -9.196 3.860
75 H THR 22 H THR 22 -11.957 -8.586 2.060
76 HA THR 22 HA THR 22 -11.796 -10.485 -0.181
77 HB THR 22 HB THR 22 -14.014 -8.482 -0.075
78 HG1 THR 22 1HG THR 22 -14.306 -9.483 1.867
79 HG21 THR 22 3HG2 THR 22 -14.484 -9.526 -1.973
80 HG22 THR 22 1HG2 THR 22 -14.995 -10.885 -0.972
81 HG23 THR 22 2HG2 THR 22 -13.357 -10.839 -1.626
82 H CYS 23 H CYS 23 -11.322 -9.604 -2.206
83 HA CYS 23 HA CYS 23 -10.445 -6.790 -2.150
84 HB2 CYS 23 2HB CYS 23 -8.827 -8.966 -2.479
85 HB3 CYS 23 1HB CYS 23 -9.190 -8.550 -4.149
86 H LYS 24 H LYS 24 -11.500 -5.492 -3.475
87 HA LYS 24 HA LYS 24 -12.480 -6.524 -6.036
88 HB2 LYS 24 2HB LYS 24 -14.636 -5.388 -5.737
89 HB3 LYS 24 1HB LYS 24 -14.387 -6.629 -4.515
90 HG2 LYS 24 2HG LYS 24 -13.638 -4.823 -2.955
91 HG3 LYS 24 1HG LYS 24 -14.143 -3.651 -4.175
92 HD2 LYS 24 2HD LYS 24 -16.118 -3.726 -3.099
93 HD3 LYS 24 1HD LYS 24 -16.353 -5.223 -4.003
94 HE2 LYS 24 2HE LYS 24 -15.246 -6.407 -2.057
95 HE3 LYS 24 1HE LYS 24 -15.401 -4.893 -1.169
96 HZ1 LYS 24 3HZ LYS 24 -17.507 -6.726 -2.091
97 HZ2 LYS 24 1HZ LYS 24 -17.867 -5.085 -1.885
98 HZ3 LYS 24 2HZ LYS 24 -17.306 -6.000 -0.578
99 H SER 25 H SER 25 -13.205 -4.694 -7.483
100 HA SER 25 HA SER 25 -11.130 -2.860 -7.829
101 HB2 SER 25 2HB SER 25 -13.825 -3.258 -9.011
102 HB3 SER 25 1HB SER 25 -13.093 -1.670 -9.236
103 HG SER 25 HG SER 25 -12.644 -3.575 -10.772
104 H LEU 26 H LEU 26 -11.964 -0.377 -8.232
105 HA LEU 26 HA LEU 26 -12.617 0.540 -5.533
106 HB2 LEU 26 2HB LEU 26 -11.689 2.651 -6.164
107 HB3 LEU 26 1HB LEU 26 -10.581 1.390 -6.673
108 HG LEU 26 HG LEU 26 -12.217 1.825 -8.897
109 HD11 LEU 26 1HD1 LEU 26 -11.760 4.323 -7.354
110 HD12 LEU 26 2HD1 LEU 26 -13.113 3.859 -8.384
111 HD13 LEU 26 3HD1 LEU 26 -11.592 4.380 -9.108
112 HD21 LEU 26 3HD2 LEU 26 -9.933 1.292 -9.137
113 HD22 LEU 26 1HD2 LEU 26 -9.426 2.687 -8.183
114 HD23 LEU 26 2HD2 LEU 26 -10.116 2.921 -9.788
115 H LEU 27 H LEU 27 -14.683 -0.523 -7.275
116 HA LEU 27 HA LEU 27 -16.496 1.753 -7.168
117 HB2 LEU 27 2HB LEU 27 -16.050 0.102 -9.656
118 HB3 LEU 27 1HB LEU 27 -17.401 1.196 -9.428
119 HG LEU 27 HG LEU 27 -14.549 2.142 -9.282
120 HD11 LEU 27 1HD1 LEU 27 -14.968 1.053 -11.466
121 HD12 LEU 27 2HD1 LEU 27 -14.684 2.789 -11.594
122 HD13 LEU 27 3HD1 LEU 27 -16.324 2.151 -11.717
123 HD21 LEU 27 3HD2 LEU 27 -16.506 3.487 -8.357
124 HD22 LEU 27 1HD2 LEU 27 -17.013 3.681 -10.036
125 HD23 LEU 27 2HD2 LEU 27 -15.446 4.295 -9.511
126 H GLN 28 H GLN 28 -16.329 -0.432 -5.460
127 HA GLN 28 HA GLN 28 -18.972 -1.570 -5.825
128 HB2 GLN 28 2HB GLN 28 -16.496 -3.286 -5.608
129 HB3 GLN 28 1HB GLN 28 -18.130 -3.888 -5.363
130 HG2 GLN 28 2HG GLN 28 -18.708 -3.297 -7.649
131 HG3 GLN 28 1HG GLN 28 -17.088 -2.649 -7.901
132 HE21 GLN 28 1HE2 GLN 28 -16.102 -3.973 -9.254
133 HE22 GLN 28 2HE2 GLN 28 -16.023 -5.693 -9.113
134 H CYS 29 H CYS 29 -16.037 -1.432 -3.849
135 HA CYS 29 HA CYS 29 -16.975 -2.375 -1.443
136 HB2 CYS 29 2HB CYS 29 -14.891 -0.408 -2.241
137 HB3 CYS 29 1HB CYS 29 -15.355 -0.447 -0.545
138 H ASP 30 H ASP 30 -18.688 -1.818 -0.282
139 HA ASP 30 HA ASP 30 -20.239 0.465 -0.690
140 HB2 ASP 30 2HB ASP 30 -20.148 -1.722 1.283
141 HB3 ASP 30 1HB ASP 30 -20.886 -0.234 1.867
142 H VAL 31 H VAL 31 -17.601 -0.149 1.547
143 HA VAL 31 HA VAL 31 -17.928 2.201 3.097
144 HB VAL 31 HB VAL 31 -15.607 1.807 3.852
145 HG11 VAL 31 1HG1 VAL 31 -17.727 -0.245 3.911
146 HG12 VAL 31 2HG1 VAL 31 -16.925 0.600 5.234
147 HG13 VAL 31 3HG1 VAL 31 -16.127 -0.760 4.443
148 HG21 VAL 31 3HG2 VAL 31 -14.319 0.982 2.169
149 HG22 VAL 31 1HG2 VAL 31 -15.621 -0.009 1.507
150 HG23 VAL 31 2HG2 VAL 31 -14.749 -0.544 2.943
151 H ALA 32 H ALA 32 -16.053 1.446 0.213
152 HA ALA 32 HA ALA 32 -14.608 3.867 0.093
153 HB1 ALA 32 3HB ALA 32 -13.729 3.058 -1.827
154 HB2 ALA 32 1HB ALA 32 -15.294 2.545 -2.454
155 HB3 ALA 32 2HB ALA 32 -14.457 1.555 -1.259
156 H SER 33 H SER 33 -17.757 2.896 -1.125
157 HA SER 33 HA SER 33 -18.224 5.161 -2.745
158 HB2 SER 33 2HB SER 33 -19.479 2.993 -2.878
159 HB3 SER 33 1HB SER 33 -20.308 3.444 -1.389
160 HG SER 33 HG SER 33 -20.630 4.400 -3.961
161 H LYS 34 H LYS 34 -18.862 4.487 0.655
162 HA LYS 34 HA LYS 34 -20.449 6.796 1.109
163 HB2 LYS 34 2HB LYS 34 -20.262 6.299 3.444
164 HB3 LYS 34 1HB LYS 34 -20.425 4.778 2.581
165 HG2 LYS 34 2HG LYS 34 -18.398 4.053 3.208
166 HG3 LYS 34 1HG LYS 34 -17.660 5.645 3.059
167 HD2 LYS 34 2HD LYS 34 -18.502 6.321 5.184
168 HD3 LYS 34 1HD LYS 34 -19.518 4.884 5.300
169 HE2 LYS 34 2HE LYS 34 -16.711 4.239 4.900
170 HE3 LYS 34 1HE LYS 34 -16.984 5.190 6.359
171 HZ1 LYS 34 3HZ LYS 34 -17.173 2.593 6.378
172 HZ2 LYS 34 1HZ LYS 34 -18.746 2.909 5.840
173 HZ3 LYS 34 2HZ LYS 34 -18.213 3.545 7.314
174 H ILE 35 H ILE 35 -17.009 6.179 1.162
175 HA ILE 35 HA ILE 35 -16.252 8.567 2.504
176 HB ILE 35 HB ILE 35 -14.605 6.945 0.560
177 HG12 ILE 35 2HG1 ILE 35 -14.334 6.664 3.514
178 HG13 ILE 35 1HG1 ILE 35 -15.708 5.881 2.742
179 HG21 ILE 35 1HG2 ILE 35 -12.856 7.922 2.358
180 HG22 ILE 35 2HG2 ILE 35 -14.041 9.227 2.337
181 HG23 ILE 35 3HG2 ILE 35 -13.253 8.728 0.841
182 HD11 ILE 35 3HD1 ILE 35 -14.358 4.172 2.343
183 HD12 ILE 35 1HD1 ILE 35 -12.934 5.103 2.805
184 HD13 ILE 35 2HD1 ILE 35 -13.547 5.191 1.154
185 H ILE 36 H ILE 36 -16.726 7.717 -0.879
186 HA ILE 36 HA ILE 36 -15.693 10.141 -1.950
187 HB ILE 36 HB ILE 36 -17.665 8.227 -3.205
188 HG12 ILE 36 2HG1 ILE 36 -15.464 7.240 -2.429
189 HG13 ILE 36 1HG1 ILE 36 -15.807 7.067 -4.147
190 HG21 ILE 36 1HG2 ILE 36 -15.814 10.210 -4.519
191 HG22 ILE 36 2HG2 ILE 36 -17.544 10.453 -4.273
192 HG23 ILE 36 3HG2 ILE 36 -16.976 9.152 -5.320
193 HD11 ILE 36 3HD1 ILE 36 -14.295 8.863 -4.670
194 HD12 ILE 36 1HD1 ILE 36 -13.469 7.669 -3.668
195 HD13 ILE 36 2HD1 ILE 36 -14.030 9.182 -2.956
196 H SER 37 H SER 37 -18.837 9.122 -0.798
197 HA SER 37 HA SER 37 -20.060 11.614 -1.714
198 HB2 SER 37 2HB SER 37 -21.451 9.394 -0.221
199 HB3 SER 37 1HB SER 37 -22.164 10.622 -1.266
200 HG SER 37 HG SER 37 -21.012 8.218 -1.910
201 H LYS 38 H LYS 38 -18.294 10.692 0.887
202 HA LYS 38 HA LYS 38 -19.859 11.734 3.029
203 HB2 LYS 38 2HB LYS 38 -17.163 10.631 2.675
204 HB3 LYS 38 1HB LYS 38 -17.269 11.873 3.916
205 HG2 LYS 38 2HG LYS 38 -19.387 9.846 4.020
206 HG3 LYS 38 1HG LYS 38 -17.757 9.242 4.319
207 HD2 LYS 38 2HD LYS 38 -18.128 11.700 5.737
208 HD3 LYS 38 1HD LYS 38 -19.467 10.612 6.102
209 HE2 LYS 38 2HE LYS 38 -16.890 9.262 6.109
210 HE3 LYS 38 1HE LYS 38 -16.968 10.582 7.275
211 HZ1 LYS 38 3HZ LYS 38 -18.457 9.497 8.536
212 HZ2 LYS 38 1HZ LYS 38 -17.848 8.118 7.767
213 HZ3 LYS 38 2HZ LYS 38 -19.278 8.831 7.216
214 H LYS 39 H LYS 39 -16.649 12.979 2.247
215 HA LYS 39 HA LYS 39 -17.302 15.486 1.290
216 HB2 LYS 39 2HB LYS 39 -18.042 15.236 4.011
217 HB3 LYS 39 1HB LYS 39 -16.620 16.270 3.967
218 HG2 LYS 39 2HG LYS 39 -17.703 17.949 2.902
219 HG3 LYS 39 1HG LYS 39 -18.752 16.850 2.003
220 HD2 LYS 39 2HD LYS 39 -19.841 16.366 4.287
221 HD3 LYS 39 1HD LYS 39 -19.030 17.839 4.823
222 HE2 LYS 39 2HE LYS 39 -20.589 17.954 2.299
223 HE3 LYS 39 1HE LYS 39 -21.486 17.859 3.813
224 HZ1 LYS 39 3HZ LYS 39 -20.788 19.904 4.465
225 HZ2 LYS 39 1HZ LYS 39 -20.746 20.149 2.791
226 HZ3 LYS 39 2HZ LYS 39 -19.319 19.814 3.634
227 HA PRO 40 HA PRO 40 -12.862 15.806 3.196
228 HB2 PRO 40 2HB PRO 40 -12.016 13.671 4.682
229 HB3 PRO 40 1HB PRO 40 -12.761 15.115 5.375
230 HG2 PRO 40 2HG PRO 40 -13.994 12.462 4.748
231 HG3 PRO 40 1HG PRO 40 -14.219 13.493 6.173
232 HD2 PRO 40 2HD PRO 40 -16.025 13.403 4.180
233 HD3 PRO 40 1HD PRO 40 -15.696 14.898 5.078
234 H ARG 41 H ARG 41 -11.044 15.218 2.086
235 HA ARG 41 HA ARG 41 -10.396 12.660 1.169
236 HB2 ARG 41 2HB ARG 41 -12.394 14.019 -0.420
237 HB3 ARG 41 1HB ARG 41 -10.941 13.738 -1.366
238 HG2 ARG 41 2HG ARG 41 -11.072 11.330 -0.553
239 HG3 ARG 41 1HG ARG 41 -12.706 11.725 -0.015
240 HD2 ARG 41 2HD ARG 41 -11.754 12.202 -2.829
241 HD3 ARG 41 1HD ARG 41 -12.495 10.687 -2.317
242 HE ARG 41 HE ARG 41 -14.256 12.624 -1.528
243 HH11 ARG 41 1HH1 ARG 41 -12.799 11.697 -4.561
244 HH12 ARG 41 2HH1 ARG 41 -14.146 12.225 -5.512
245 HH21 ARG 41 1HH2 ARG 41 -16.030 13.318 -2.778
246 HH22 ARG 41 2HH2 ARG 41 -15.979 13.145 -4.501
247 H THR 42 H THR 42 -8.307 13.176 1.615
248 HA THR 42 HA THR 42 -7.075 15.230 -0.098
249 HB THR 42 HB THR 42 -5.425 15.230 2.063
250 HG1 THR 42 1HG THR 42 -6.501 14.243 3.584
251 HG21 THR 42 3HG2 THR 42 -5.924 17.353 1.576
252 HG22 THR 42 1HG2 THR 42 -7.140 17.168 2.839
253 HG23 THR 42 2HG2 THR 42 -7.591 16.974 1.145
254 H ALA 43 H ALA 43 -4.476 14.895 0.366
255 HA ALA 43 HA ALA 43 -3.753 12.671 -1.125
256 HB1 ALA 43 3HB ALA 43 -2.320 14.624 -0.873
257 HB2 ALA 43 1HB ALA 43 -1.451 13.150 -0.447
258 HB3 ALA 43 2HB ALA 43 -2.048 14.219 0.822
259 H GLN 44 H GLN 44 -4.122 13.019 2.340
260 HA GLN 44 HA GLN 44 -2.767 10.718 3.175
261 HB2 GLN 44 2HB GLN 44 -5.207 12.017 4.399
262 HB3 GLN 44 1HB GLN 44 -4.164 10.852 5.204
263 HG2 GLN 44 2HG GLN 44 -3.195 13.497 4.158
264 HG3 GLN 44 1HG GLN 44 -3.776 13.251 5.804
265 HE21 GLN 44 1HE2 GLN 44 -1.077 13.572 4.098
266 HE22 GLN 44 2HE2 GLN 44 0.009 12.589 5.013
267 H ASP 45 H ASP 45 -5.957 11.163 1.818
268 HA ASP 45 HA ASP 45 -6.963 8.585 2.472
269 HB2 ASP 45 2HB ASP 45 -7.777 10.719 0.518
270 HB3 ASP 45 1HB ASP 45 -8.572 9.147 0.514
271 H GLU 46 H GLU 46 -5.178 9.914 -0.240
272 HA GLU 46 HA GLU 46 -5.464 7.718 -1.989
273 HB2 GLU 46 2HB GLU 46 -4.044 10.214 -1.940
274 HB3 GLU 46 1HB GLU 46 -2.961 8.939 -2.484
275 HG2 GLU 46 2HG GLU 46 -5.660 9.024 -3.691
276 HG3 GLU 46 1HG GLU 46 -4.531 10.303 -4.135
277 H LYS 47 H LYS 47 -3.061 8.515 0.462
278 HA LYS 47 HA LYS 47 -1.345 6.323 -0.101
279 HB2 LYS 47 2HB LYS 47 -1.100 7.024 2.655
280 HB3 LYS 47 1HB LYS 47 0.003 7.375 1.334
281 HG2 LYS 47 2HG LYS 47 -1.235 9.434 0.858
282 HG3 LYS 47 1HG LYS 47 -2.325 9.079 2.200
283 HD2 LYS 47 2HD LYS 47 0.657 9.485 2.429
284 HD3 LYS 47 1HD LYS 47 -0.571 10.691 2.822
285 HE2 LYS 47 2HE LYS 47 -0.378 9.861 4.904
286 HE3 LYS 47 1HE LYS 47 -1.437 8.591 4.292
287 HZ1 LYS 47 3HZ LYS 47 0.441 7.618 5.398
288 HZ2 LYS 47 1HZ LYS 47 1.529 8.496 4.444
289 HZ3 LYS 47 2HZ LYS 47 0.564 7.297 3.742
290 H PHE 48 H PHE 48 -4.045 6.788 2.102
291 HA PHE 48 HA PHE 48 -3.781 4.330 3.477
292 HB2 PHE 48 2HB PHE 48 -5.321 6.538 3.830
293 HB3 PHE 48 1HB PHE 48 -6.507 5.425 3.157
294 HD1 PHE 48 2HD PHE 48 -6.262 2.946 4.246
295 HD2 PHE 48 1HD PHE 48 -5.239 6.633 6.110
296 HE1 PHE 48 2HE PHE 48 -6.538 1.900 6.456
297 HE2 PHE 48 1HE PHE 48 -5.513 5.593 8.323
298 HZ PHE 48 HZ PHE 48 -6.164 3.225 8.498
299 H LEU 49 H LEU 49 -5.425 5.280 0.526
300 HA LEU 49 HA LEU 49 -6.870 2.856 0.185
301 HB2 LEU 49 2HB LEU 49 -7.836 4.486 -1.074
302 HB3 LEU 49 1HB LEU 49 -6.312 5.286 -1.401
303 HG LEU 49 HG LEU 49 -5.794 3.539 -3.084
304 HD11 LEU 49 1HD1 LEU 49 -6.913 1.616 -2.860
305 HD12 LEU 49 2HD1 LEU 49 -8.211 2.432 -3.730
306 HD13 LEU 49 3HD1 LEU 49 -8.230 2.377 -1.967
307 HD21 LEU 49 3HD2 LEU 49 -6.583 5.360 -4.184
308 HD22 LEU 49 1HD2 LEU 49 -8.087 5.404 -3.264
309 HD23 LEU 49 2HD2 LEU 49 -7.887 4.241 -4.575
310 H ARG 50 H ARG 50 -3.694 3.991 -0.757
311 HA ARG 50 HA ARG 50 -3.090 1.915 -2.582
312 HB2 ARG 50 2HB ARG 50 -1.851 4.244 -1.731
313 HB3 ARG 50 1HB ARG 50 -0.786 2.976 -1.141
314 HG2 ARG 50 2HG ARG 50 0.133 3.037 -3.166
315 HG3 ARG 50 1HG ARG 50 -1.300 2.162 -3.703
316 HD2 ARG 50 2HD ARG 50 -1.911 3.876 -4.977
317 HD3 ARG 50 1HD ARG 50 -1.901 4.952 -3.580
318 HE ARG 50 HE ARG 50 0.085 4.768 -5.628
319 HH11 ARG 50 1HH1 ARG 50 -0.434 5.546 -2.266
320 HH12 ARG 50 2HH1 ARG 50 0.943 6.593 -2.167
321 HH21 ARG 50 1HH2 ARG 50 1.895 6.145 -5.500
322 HH22 ARG 50 2HH2 ARG 50 2.263 6.934 -4.002
323 H GLU 51 H GLU 51 -2.699 2.277 0.889
324 HA GLU 51 HA GLU 51 -1.136 -0.068 1.274
325 HB2 GLU 51 2HB GLU 51 -2.767 1.670 3.112
326 HB3 GLU 51 1HB GLU 51 -1.982 0.208 3.692
327 HG2 GLU 51 2HG GLU 51 0.102 1.092 3.536
328 HG3 GLU 51 1HG GLU 51 -0.322 2.141 2.184
329 H SER 52 H SER 52 -4.570 0.592 1.145
330 HA SER 52 HA SER 52 -5.187 -2.168 1.904
331 HB2 SER 52 2HB SER 52 -7.251 -0.076 1.265
332 HB3 SER 52 1HB SER 52 -7.381 -1.472 2.335
333 HG SER 52 HG SER 52 -6.141 1.008 2.781
334 H ALA 53 H ALA 53 -3.894 -1.651 -0.602
335 HA ALA 53 HA ALA 53 -6.035 -2.426 -2.476
336 HB1 ALA 53 3HB ALA 53 -5.346 -0.533 -3.507
337 HB2 ALA 53 1HB ALA 53 -4.110 -1.614 -4.154
338 HB3 ALA 53 2HB ALA 53 -3.744 -0.583 -2.771
339 H CYS 54 H CYS 54 -5.783 -4.254 -3.664
340 HA CYS 54 HA CYS 54 -4.100 -6.284 -2.770
341 HB2 CYS 54 2HB CYS 54 -5.953 -5.891 -5.017
342 HB3 CYS 54 1HB CYS 54 -4.675 -7.059 -5.334
343 H GLY 55 H GLY 55 -1.949 -5.756 -2.693
344 HA2 GLY 55 2HA GLY 55 0.201 -5.570 -3.474
345 HA3 GLY 55 1HA GLY 55 -0.402 -6.181 -5.007
346 H PHE 56 H PHE 56 1.510 -4.521 -5.406
347 HA PHE 56 HA PHE 56 0.368 -1.836 -5.753
348 HB2 PHE 56 2HB PHE 56 2.635 -2.304 -4.546
349 HB3 PHE 56 1HB PHE 56 3.266 -2.483 -6.179
350 HD1 PHE 56 1HD PHE 56 0.798 -0.116 -4.690
351 HD2 PHE 56 2HD PHE 56 4.516 -0.629 -6.698
352 HE1 PHE 56 1HE PHE 56 1.040 2.328 -4.859
353 HE2 PHE 56 2HE PHE 56 4.763 1.812 -6.870
354 HZ PHE 56 HZ PHE 56 3.025 3.295 -5.950
355 H ASP 57 H ASP 57 -0.698 -1.836 -7.654
356 HA ASP 57 HA ASP 57 0.757 -2.800 -10.029
357 HB2 ASP 57 2HB ASP 57 -2.102 -2.942 -9.234
358 HB3 ASP 57 1HB ASP 57 -1.766 -2.648 -10.939
359 H GLY 58 H GLY 58 0.138 -1.625 -12.075
360 HA2 GLY 58 2HA GLY 58 -0.346 1.237 -11.537
361 HA3 GLY 58 1HA GLY 58 0.977 0.718 -12.571
362 H GLN 59 H GLN 59 -2.364 -0.469 -12.380
363 HA GLN 59 HA GLN 59 -3.299 0.866 -14.675
364 HB2 GLN 59 2HB GLN 59 -1.627 -1.373 -15.221
365 HB3 GLN 59 1HB GLN 59 -3.272 -1.816 -15.652
366 HG2 GLN 59 2HG GLN 59 -3.100 0.658 -16.743
367 HG3 GLN 59 1HG GLN 59 -1.437 0.094 -16.907
368 HE21 GLN 59 1HE2 GLN 59 -1.558 -0.057 -19.130
369 HE22 GLN 59 2HE2 GLN 59 -2.475 -1.282 -19.933
370 H THR 60 H THR 60 -3.475 -2.095 -12.752
371 HA THR 60 HA THR 60 -6.404 -2.035 -12.990
372 HB THR 60 HB THR 60 -4.864 -4.310 -11.782
373 HG1 THR 60 1HG THR 60 -5.181 -3.720 -14.526
374 HG21 THR 60 3HG2 THR 60 -6.889 -5.188 -11.673
375 HG22 THR 60 1HG2 THR 60 -6.889 -5.245 -13.434
376 HG23 THR 60 2HG2 THR 60 -7.584 -3.857 -12.598
377 HA PRO 61 HA PRO 61 -5.716 -0.383 -8.751
378 HB2 PRO 61 2HB PRO 61 -7.973 1.126 -8.722
379 HB3 PRO 61 1HB PRO 61 -6.455 1.685 -9.430
380 HG2 PRO 61 2HG PRO 61 -8.860 0.527 -10.783
381 HG3 PRO 61 1HG PRO 61 -7.864 1.913 -11.264
382 HD2 PRO 61 2HD PRO 61 -7.594 -0.532 -12.392
383 HD3 PRO 61 1HD PRO 61 -6.223 0.577 -12.181
384 H LYS 62 H LYS 62 -6.342 -1.509 -7.025
385 HA LYS 62 HA LYS 62 -9.069 -2.583 -6.926
386 HB2 LYS 62 2HB LYS 62 -6.520 -4.110 -6.822
387 HB3 LYS 62 1HB LYS 62 -7.799 -4.607 -5.721
388 HG2 LYS 62 2HG LYS 62 -9.090 -4.307 -8.150
389 HG3 LYS 62 1HG LYS 62 -7.536 -5.029 -8.572
390 HD2 LYS 62 2HD LYS 62 -9.072 -6.149 -6.275
391 HD3 LYS 62 1HD LYS 62 -9.591 -6.532 -7.917
392 HE2 LYS 62 2HE LYS 62 -6.759 -6.897 -6.974
393 HE3 LYS 62 1HE LYS 62 -7.981 -8.161 -6.836
394 HZ1 LYS 62 3HZ LYS 62 -7.958 -8.548 -9.043
395 HZ2 LYS 62 1HZ LYS 62 -6.397 -7.901 -8.940
396 HZ3 LYS 62 2HZ LYS 62 -7.682 -6.931 -9.456
397 H VAL 63 H VAL 63 -9.808 -3.100 -4.775
398 HA VAL 63 HA VAL 63 -8.252 -1.819 -2.629
399 HB VAL 63 HB VAL 63 -11.245 -1.557 -2.913
400 HG11 VAL 63 1HG1 VAL 63 -10.693 -1.346 -0.648
401 HG12 VAL 63 2HG1 VAL 63 -10.782 0.316 -1.233
402 HG13 VAL 63 3HG1 VAL 63 -9.212 -0.454 -1.000
403 HG21 VAL 63 3HG2 VAL 63 -10.804 0.797 -3.518
404 HG22 VAL 63 1HG2 VAL 63 -10.204 -0.342 -4.725
405 HG23 VAL 63 2HG2 VAL 63 -9.082 0.429 -3.602
406 H CYS 64 H CYS 64 -8.590 -2.644 -0.531
407 HA CYS 64 HA CYS 64 -9.663 -5.373 -0.524
408 HB2 CYS 64 2HB CYS 64 -7.525 -3.967 0.990
409 HB3 CYS 64 1HB CYS 64 -8.412 -5.228 1.840
410 H CYS 65 H CYS 65 -11.521 -5.799 0.433
411 HA CYS 65 HA CYS 65 -12.490 -3.989 2.541
412 HB2 CYS 65 2HB CYS 65 -13.817 -4.907 0.053
413 HB3 CYS 65 1HB CYS 65 -14.814 -4.893 1.505
414 HA PRO 66 HA PRO 66 -12.472 -7.831 4.844
415 HB2 PRO 66 2HB PRO 66 -13.934 -6.861 6.978
416 HB3 PRO 66 1HB PRO 66 -12.186 -6.696 6.797
417 HG2 PRO 66 2HG PRO 66 -14.350 -4.724 6.208
418 HG3 PRO 66 1HG PRO 66 -12.749 -4.458 6.921
419 HD2 PRO 66 2HD PRO 66 -13.279 -3.864 4.351
420 HD3 PRO 66 1HD PRO 66 -11.691 -4.472 4.863
Start of MODEL 15
1 H GLN 11 H GLN 11 -10.832 -10.881 -5.401
2 HA GLN 11 HA GLN 11 -10.774 -13.665 -4.479
3 HB2 GLN 11 2HB GLN 11 -8.913 -11.674 -5.639
4 HB3 GLN 11 1HB GLN 11 -8.261 -12.668 -4.343
5 HG2 GLN 11 2HG GLN 11 -9.493 -14.530 -5.901
6 HG3 GLN 11 1HG GLN 11 -8.931 -13.366 -7.099
7 HE21 GLN 11 1HE2 GLN 11 -7.578 -14.522 -4.031
8 HE22 GLN 11 2HE2 GLN 11 -6.067 -15.035 -4.691
9 H ALA 12 H ALA 12 -9.750 -14.035 -2.429
10 HA ALA 12 HA ALA 12 -10.645 -12.206 -0.409
11 HB1 ALA 12 3HB ALA 12 -9.575 -14.939 -0.502
12 HB2 ALA 12 1HB ALA 12 -10.852 -14.251 0.499
13 HB3 ALA 12 2HB ALA 12 -9.163 -14.027 0.951
14 H CYS 13 H CYS 13 -9.546 -10.590 0.465
15 HA CYS 13 HA CYS 13 -6.613 -10.568 0.186
16 HB2 CYS 13 2HB CYS 13 -7.261 -8.804 -1.173
17 HB3 CYS 13 1HB CYS 13 -8.652 -8.406 -0.175
18 H THR 14 H THR 14 -5.404 -9.614 1.894
19 HA THR 14 HA THR 14 -6.742 -9.861 4.490
20 HB THR 14 HB THR 14 -4.736 -11.239 4.117
21 HG1 THR 14 1HG THR 14 -4.793 -10.854 6.200
22 HG21 THR 14 3HG2 THR 14 -3.662 -9.170 2.763
23 HG22 THR 14 1HG2 THR 14 -2.733 -10.505 3.445
24 HG23 THR 14 2HG2 THR 14 -2.873 -8.986 4.330
25 H LEU 15 H LEU 15 -7.411 -8.054 5.415
26 HA LEU 15 HA LEU 15 -6.798 -5.466 4.570
27 HB2 LEU 15 2HB LEU 15 -7.671 -4.839 6.918
28 HB3 LEU 15 1HB LEU 15 -8.760 -5.622 5.790
29 HG LEU 15 HG LEU 15 -7.298 -7.464 7.564
30 HD11 LEU 15 1HD1 LEU 15 -9.534 -5.882 8.777
31 HD12 LEU 15 2HD1 LEU 15 -7.853 -5.381 8.960
32 HD13 LEU 15 3HD1 LEU 15 -8.377 -6.955 9.563
33 HD21 LEU 15 3HD2 LEU 15 -8.921 -8.706 6.679
34 HD22 LEU 15 1HD2 LEU 15 -9.803 -7.288 6.112
35 HD23 LEU 15 2HD2 LEU 15 -10.032 -7.867 7.762
36 HA PRO 16 HA PRO 16 -2.957 -4.164 6.268
37 HB2 PRO 16 2HB PRO 16 -3.782 -2.041 7.914
38 HB3 PRO 16 1HB PRO 16 -3.325 -1.928 6.212
39 HG2 PRO 16 2HG PRO 16 -6.034 -2.099 7.443
40 HG3 PRO 16 1HG PRO 16 -5.503 -1.204 6.007
41 HD2 PRO 16 2HD PRO 16 -6.905 -3.468 5.784
42 HD3 PRO 16 1HD PRO 16 -5.592 -3.090 4.650
43 H ASN 17 H ASN 17 -5.630 -4.729 8.445
44 HA ASN 17 HA ASN 17 -3.923 -4.948 10.775
45 HB2 ASN 17 2HB ASN 17 -6.685 -4.510 10.326
46 HB3 ASN 17 1HB ASN 17 -6.550 -6.022 11.218
47 HD21 ASN 17 1HD2 ASN 17 -5.907 -5.997 13.317
48 HD22 ASN 17 2HD2 ASN 17 -5.644 -4.549 14.221
49 H ASN 18 H ASN 18 -4.993 -6.979 8.258
50 HA ASN 18 HA ASN 18 -4.586 -9.168 7.794
51 HB2 ASN 18 2HB ASN 18 -2.516 -8.517 9.448
52 HB3 ASN 18 1HB ASN 18 -3.266 -9.834 10.346
53 HD21 ASN 18 1HD2 ASN 18 -1.351 -8.957 7.667
54 HD22 ASN 18 2HD2 ASN 18 -1.097 -10.543 7.034
55 H ASP 19 H ASP 19 -6.813 -9.593 7.966
56 HA ASP 19 HA ASP 19 -7.464 -11.474 10.061
57 HB2 ASP 19 2HB ASP 19 -8.176 -8.842 10.498
58 HB3 ASP 19 1HB ASP 19 -9.638 -9.532 9.804
59 H LYS 20 H LYS 20 -7.175 -11.317 7.085
60 HA LYS 20 HA LYS 20 -8.132 -12.257 5.250
61 HB2 LYS 20 2HB LYS 20 -10.221 -13.363 7.129
62 HB3 LYS 20 1HB LYS 20 -9.763 -13.993 5.552
63 HG2 LYS 20 2HG LYS 20 -7.952 -15.067 6.354
64 HG3 LYS 20 1HG LYS 20 -7.597 -13.810 7.541
65 HD2 LYS 20 2HD LYS 20 -9.920 -15.705 7.809
66 HD3 LYS 20 1HD LYS 20 -8.322 -16.048 8.472
67 HE2 LYS 20 2HE LYS 20 -9.227 -15.055 10.299
68 HE3 LYS 20 1HE LYS 20 -8.665 -13.602 9.474
69 HZ1 LYS 20 3HZ LYS 20 -10.754 -12.949 9.012
70 HZ2 LYS 20 1HZ LYS 20 -11.153 -13.923 10.337
71 HZ3 LYS 20 2HZ LYS 20 -11.328 -14.520 8.764
72 H GLY 21 H GLY 21 -9.542 -11.621 3.675
73 HA2 GLY 21 2HA GLY 21 -12.103 -10.489 4.244
74 HA3 GLY 21 1HA GLY 21 -10.917 -9.247 3.882
75 H THR 22 H THR 22 -12.184 -8.685 2.046
76 HA THR 22 HA THR 22 -11.772 -10.504 -0.232
77 HB THR 22 HB THR 22 -14.121 -8.632 0.033
78 HG1 THR 22 1HG THR 22 -15.314 -10.460 0.637
79 HG21 THR 22 3HG2 THR 22 -14.930 -9.479 -1.877
80 HG22 THR 22 1HG2 THR 22 -14.302 -11.095 -1.553
81 HG23 THR 22 2HG2 THR 22 -13.232 -9.847 -2.193
82 H CYS 23 H CYS 23 -11.225 -9.546 -2.208
83 HA CYS 23 HA CYS 23 -10.487 -6.697 -2.025
84 HB2 CYS 23 2HB CYS 23 -8.779 -8.840 -2.381
85 HB3 CYS 23 1HB CYS 23 -9.019 -8.250 -4.022
86 H LYS 24 H LYS 24 -11.516 -5.410 -3.362
87 HA LYS 24 HA LYS 24 -12.229 -6.319 -6.039
88 HB2 LYS 24 2HB LYS 24 -14.527 -5.257 -5.726
89 HB3 LYS 24 1HB LYS 24 -14.267 -6.814 -4.955
90 HG2 LYS 24 2HG LYS 24 -14.031 -5.810 -2.815
91 HG3 LYS 24 1HG LYS 24 -13.978 -4.190 -3.516
92 HD2 LYS 24 2HD LYS 24 -16.161 -4.280 -2.807
93 HD3 LYS 24 1HD LYS 24 -16.329 -4.865 -4.464
94 HE2 LYS 24 2HE LYS 24 -17.066 -6.849 -3.769
95 HE3 LYS 24 1HE LYS 24 -15.723 -7.025 -2.640
96 HZ1 LYS 24 3HZ LYS 24 -16.943 -6.241 -0.927
97 HZ2 LYS 24 1HZ LYS 24 -18.236 -6.813 -1.858
98 HZ3 LYS 24 2HZ LYS 24 -17.836 -5.169 -1.881
99 H SER 25 H SER 25 -13.123 -4.413 -7.343
100 HA SER 25 HA SER 25 -11.248 -2.338 -7.331
101 HB2 SER 25 2HB SER 25 -13.783 -2.901 -8.771
102 HB3 SER 25 1HB SER 25 -13.241 -1.222 -8.760
103 HG SER 25 HG SER 25 -12.452 -2.848 -10.459
104 H LEU 26 H LEU 26 -12.091 0.063 -7.389
105 HA LEU 26 HA LEU 26 -13.254 0.541 -4.750
106 HB2 LEU 26 2HB LEU 26 -12.450 2.863 -5.078
107 HB3 LEU 26 1HB LEU 26 -11.176 1.662 -5.141
108 HG LEU 26 HG LEU 26 -12.020 2.016 -7.803
109 HD11 LEU 26 1HD1 LEU 26 -11.787 4.387 -8.179
110 HD12 LEU 26 2HD1 LEU 26 -11.560 4.671 -6.453
111 HD13 LEU 26 3HD1 LEU 26 -13.114 4.097 -7.055
112 HD21 LEU 26 3HD2 LEU 26 -9.604 2.891 -6.240
113 HD22 LEU 26 1HD2 LEU 26 -9.741 3.104 -7.985
114 HD23 LEU 26 2HD2 LEU 26 -9.781 1.483 -7.289
115 H LEU 27 H LEU 27 -14.936 -0.294 -6.964
116 HA LEU 27 HA LEU 27 -16.815 1.943 -6.896
117 HB2 LEU 27 2HB LEU 27 -16.207 0.469 -9.453
118 HB3 LEU 27 1HB LEU 27 -17.288 1.832 -9.248
119 HG LEU 27 HG LEU 27 -14.343 2.073 -8.697
120 HD11 LEU 27 1HD1 LEU 27 -15.203 1.302 -11.125
121 HD12 LEU 27 2HD1 LEU 27 -13.812 2.354 -10.867
122 HD13 LEU 27 3HD1 LEU 27 -15.380 3.050 -11.273
123 HD21 LEU 27 3HD2 LEU 27 -16.597 3.988 -9.221
124 HD22 LEU 27 1HD2 LEU 27 -14.904 4.463 -9.354
125 HD23 LEU 27 2HD2 LEU 27 -15.541 3.892 -7.813
126 H GLN 28 H GLN 28 -16.668 -0.619 -5.535
127 HA GLN 28 HA GLN 28 -19.260 -1.676 -6.394
128 HB2 GLN 28 2HB GLN 28 -16.848 -3.385 -5.758
129 HB3 GLN 28 1HB GLN 28 -18.475 -3.992 -6.036
130 HG2 GLN 28 2HG GLN 28 -18.382 -3.018 -8.318
131 HG3 GLN 28 1HG GLN 28 -16.697 -2.593 -8.020
132 HE21 GLN 28 1HE2 GLN 28 -16.230 -3.931 -9.862
133 HE22 GLN 28 2HE2 GLN 28 -16.115 -5.643 -9.676
134 H CYS 29 H CYS 29 -16.730 -1.778 -3.901
135 HA CYS 29 HA CYS 29 -18.368 -2.758 -1.831
136 HB2 CYS 29 2HB CYS 29 -15.697 -2.237 -2.102
137 HB3 CYS 29 1HB CYS 29 -16.195 -0.948 -1.012
138 H ASP 30 H ASP 30 -19.911 -1.820 -0.673
139 HA ASP 30 HA ASP 30 -20.838 0.775 -1.190
140 HB2 ASP 30 2HB ASP 30 -21.640 -1.460 0.402
141 HB3 ASP 30 1HB ASP 30 -21.716 -0.013 1.402
142 H VAL 31 H VAL 31 -18.671 -0.483 1.268
143 HA VAL 31 HA VAL 31 -18.598 1.796 2.925
144 HB VAL 31 HB VAL 31 -16.454 0.892 3.767
145 HG11 VAL 31 1HG1 VAL 31 -18.280 -1.452 3.489
146 HG12 VAL 31 2HG1 VAL 31 -18.847 -0.003 4.319
147 HG13 VAL 31 3HG1 VAL 31 -17.420 -0.856 4.910
148 HG21 VAL 31 3HG2 VAL 31 -16.710 -0.785 1.326
149 HG22 VAL 31 1HG2 VAL 31 -15.993 -1.509 2.765
150 HG23 VAL 31 2HG2 VAL 31 -15.278 -0.062 2.056
151 H ALA 32 H ALA 32 -16.641 0.823 0.150
152 HA ALA 32 HA ALA 32 -14.796 2.956 0.295
153 HB1 ALA 32 3HB ALA 32 -14.922 0.694 -1.165
154 HB2 ALA 32 1HB ALA 32 -13.861 2.049 -1.549
155 HB3 ALA 32 2HB ALA 32 -15.406 1.878 -2.380
156 H SER 33 H SER 33 -17.912 2.599 -1.291
157 HA SER 33 HA SER 33 -17.777 5.003 -2.791
158 HB2 SER 33 2HB SER 33 -20.033 4.609 -3.363
159 HB3 SER 33 1HB SER 33 -19.339 3.001 -3.157
160 HG SER 33 HG SER 33 -20.182 3.141 -0.944
161 H LYS 34 H LYS 34 -18.978 4.219 0.423
162 HA LYS 34 HA LYS 34 -20.233 6.727 0.873
163 HB2 LYS 34 2HB LYS 34 -20.465 6.035 3.159
164 HB3 LYS 34 1HB LYS 34 -20.761 4.641 2.132
165 HG2 LYS 34 2HG LYS 34 -18.764 3.628 2.715
166 HG3 LYS 34 1HG LYS 34 -18.056 5.128 3.310
167 HD2 LYS 34 2HD LYS 34 -19.884 5.084 5.087
168 HD3 LYS 34 1HD LYS 34 -20.170 3.417 4.586
169 HE2 LYS 34 2HE LYS 34 -17.628 4.579 5.704
170 HE3 LYS 34 1HE LYS 34 -18.689 3.401 6.469
171 HZ1 LYS 34 3HZ LYS 34 -17.213 2.912 3.944
172 HZ2 LYS 34 1HZ LYS 34 -18.097 1.784 4.841
173 HZ3 LYS 34 2HZ LYS 34 -16.666 2.429 5.469
174 H ILE 35 H ILE 35 -16.978 5.516 1.342
175 HA ILE 35 HA ILE 35 -16.074 7.652 2.988
176 HB ILE 35 HB ILE 35 -14.542 5.728 1.234
177 HG12 ILE 35 2HG1 ILE 35 -15.800 4.795 3.188
178 HG13 ILE 35 1HG1 ILE 35 -14.059 4.553 3.280
179 HG21 ILE 35 1HG2 ILE 35 -12.722 6.571 3.038
180 HG22 ILE 35 2HG2 ILE 35 -13.642 8.055 2.797
181 HG23 ILE 35 3HG2 ILE 35 -12.890 7.250 1.421
182 HD11 ILE 35 3HD1 ILE 35 -14.732 7.007 4.565
183 HD12 ILE 35 1HD1 ILE 35 -14.001 5.554 5.246
184 HD13 ILE 35 2HD1 ILE 35 -15.756 5.715 5.189
185 H ILE 36 H ILE 36 -16.219 7.133 -0.484
186 HA ILE 36 HA ILE 36 -14.644 9.404 -1.190
187 HB ILE 36 HB ILE 36 -16.685 7.913 -2.846
188 HG12 ILE 36 2HG1 ILE 36 -14.733 6.585 -1.905
189 HG13 ILE 36 1HG1 ILE 36 -14.905 6.563 -3.656
190 HG21 ILE 36 1HG2 ILE 36 -16.404 9.721 -4.169
191 HG22 ILE 36 2HG2 ILE 36 -14.923 8.882 -4.630
192 HG23 ILE 36 3HG2 ILE 36 -14.869 10.164 -3.422
193 HD11 ILE 36 3HD1 ILE 36 -12.583 6.799 -2.995
194 HD12 ILE 36 1HD1 ILE 36 -12.976 8.259 -2.088
195 HD13 ILE 36 2HD1 ILE 36 -13.143 8.240 -3.844
196 H SER 37 H SER 37 -18.025 8.869 -0.503
197 HA SER 37 HA SER 37 -18.718 11.572 -1.370
198 HB2 SER 37 2HB SER 37 -20.999 10.918 -1.211
199 HB3 SER 37 1HB SER 37 -20.155 9.545 -1.927
200 HG SER 37 HG SER 37 -21.585 8.927 -0.235
201 H LYS 38 H LYS 38 -17.775 9.937 1.439
202 HA LYS 38 HA LYS 38 -19.274 11.097 3.456
203 HB2 LYS 38 2HB LYS 38 -16.791 9.670 3.241
204 HB3 LYS 38 1HB LYS 38 -16.611 10.988 4.391
205 HG2 LYS 38 2HG LYS 38 -18.984 9.959 5.178
206 HG3 LYS 38 1HG LYS 38 -18.174 8.510 4.579
207 HD2 LYS 38 2HD LYS 38 -16.436 10.186 6.211
208 HD3 LYS 38 1HD LYS 38 -17.866 9.629 7.082
209 HE2 LYS 38 2HE LYS 38 -17.060 7.366 5.764
210 HE3 LYS 38 1HE LYS 38 -15.526 8.141 6.156
211 HZ1 LYS 38 3HZ LYS 38 -15.933 6.890 8.023
212 HZ2 LYS 38 1HZ LYS 38 -17.607 7.127 7.969
213 HZ3 LYS 38 2HZ LYS 38 -16.592 8.376 8.487
214 H LYS 39 H LYS 39 -15.975 12.181 2.759
215 HA LYS 39 HA LYS 39 -16.599 14.869 2.263
216 HB2 LYS 39 2HB LYS 39 -16.518 14.099 5.074
217 HB3 LYS 39 1HB LYS 39 -15.372 15.378 4.699
218 HG2 LYS 39 2HG LYS 39 -16.991 16.899 4.277
219 HG3 LYS 39 1HG LYS 39 -18.108 15.694 3.631
220 HD2 LYS 39 2HD LYS 39 -18.833 15.052 5.752
221 HD3 LYS 39 1HD LYS 39 -17.417 15.743 6.547
222 HE2 LYS 39 2HE LYS 39 -19.335 17.500 5.066
223 HE3 LYS 39 1HE LYS 39 -19.701 16.968 6.708
224 HZ1 LYS 39 3HZ LYS 39 -17.712 18.864 5.774
225 HZ2 LYS 39 1HZ LYS 39 -17.200 17.825 7.008
226 HZ3 LYS 39 2HZ LYS 39 -18.556 18.811 7.239
227 HA PRO 40 HA PRO 40 -11.826 14.390 3.303
228 HB2 PRO 40 2HB PRO 40 -11.692 11.433 3.519
229 HB3 PRO 40 1HB PRO 40 -10.850 12.671 4.457
230 HG2 PRO 40 2HG PRO 40 -12.867 11.289 5.520
231 HG3 PRO 40 1HG PRO 40 -12.652 13.014 5.874
232 HD2 PRO 40 2HD PRO 40 -14.585 11.684 4.017
233 HD3 PRO 40 1HD PRO 40 -14.831 13.071 5.099
234 H ARG 41 H ARG 41 -10.708 14.583 1.469
235 HA ARG 41 HA ARG 41 -10.559 12.488 -0.477
236 HB2 ARG 41 2HB ARG 41 -11.467 13.899 -2.351
237 HB3 ARG 41 1HB ARG 41 -12.672 13.312 -1.213
238 HG2 ARG 41 2HG ARG 41 -12.493 15.549 -0.059
239 HG3 ARG 41 1HG ARG 41 -11.552 16.088 -1.452
240 HD2 ARG 41 2HD ARG 41 -13.612 15.074 -2.769
241 HD3 ARG 41 1HD ARG 41 -14.440 15.409 -1.250
242 HE ARG 41 HE ARG 41 -13.146 17.729 -1.789
243 HH11 ARG 41 1HH1 ARG 41 -15.328 15.713 -3.621
244 HH12 ARG 41 2HH1 ARG 41 -15.988 17.033 -4.525
245 HH21 ARG 41 1HH2 ARG 41 -14.015 19.466 -2.978
246 HH22 ARG 41 2HH2 ARG 41 -15.244 19.164 -4.162
247 H THR 42 H THR 42 -8.412 13.161 0.589
248 HA THR 42 HA THR 42 -7.126 15.153 -1.157
249 HB THR 42 HB THR 42 -5.519 15.425 0.879
250 HG1 THR 42 1HG THR 42 -7.876 14.537 2.179
251 HG21 THR 42 3HG2 THR 42 -6.445 17.420 1.036
252 HG22 THR 42 1HG2 THR 42 -7.852 16.736 1.851
253 HG23 THR 42 2HG2 THR 42 -7.815 16.838 0.090
254 H ALA 43 H ALA 43 -4.552 14.815 -0.727
255 HA ALA 43 HA ALA 43 -3.853 12.502 -2.089
256 HB1 ALA 43 3HB ALA 43 -2.246 14.151 -2.189
257 HB2 ALA 43 1HB ALA 43 -1.515 13.015 -1.055
258 HB3 ALA 43 2HB ALA 43 -2.314 14.470 -0.457
259 H GLN 44 H GLN 44 -4.175 13.071 1.351
260 HA GLN 44 HA GLN 44 -2.840 10.772 2.276
261 HB2 GLN 44 2HB GLN 44 -5.036 12.454 3.480
262 HB3 GLN 44 1HB GLN 44 -4.296 11.106 4.332
263 HG2 GLN 44 2HG GLN 44 -2.399 12.235 4.758
264 HG3 GLN 44 1HG GLN 44 -2.425 13.077 3.209
265 HE21 GLN 44 1HE2 GLN 44 -2.870 13.371 6.501
266 HE22 GLN 44 2HE2 GLN 44 -3.668 14.903 6.527
267 H ASP 45 H ASP 45 -6.064 11.289 1.042
268 HA ASP 45 HA ASP 45 -7.185 8.850 1.972
269 HB2 ASP 45 2HB ASP 45 -7.971 10.904 -0.058
270 HB3 ASP 45 1HB ASP 45 -8.816 9.359 -0.026
271 H GLU 46 H GLU 46 -5.474 9.796 -0.945
272 HA GLU 46 HA GLU 46 -6.002 7.418 -2.401
273 HB2 GLU 46 2HB GLU 46 -4.811 9.864 -2.949
274 HB3 GLU 46 1HB GLU 46 -3.485 8.717 -3.085
275 HG2 GLU 46 2HG GLU 46 -5.719 7.606 -4.419
276 HG3 GLU 46 1HG GLU 46 -5.556 9.281 -4.942
277 H LYS 47 H LYS 47 -3.376 8.429 -0.278
278 HA LYS 47 HA LYS 47 -1.749 6.150 -0.734
279 HB2 LYS 47 2HB LYS 47 -0.595 6.843 1.364
280 HB3 LYS 47 1HB LYS 47 -0.747 8.138 0.186
281 HG2 LYS 47 2HG LYS 47 -2.627 9.060 1.421
282 HG3 LYS 47 1HG LYS 47 -2.511 7.748 2.594
283 HD2 LYS 47 2HD LYS 47 -1.436 9.720 3.484
284 HD3 LYS 47 1HD LYS 47 -0.217 8.491 3.142
285 HE2 LYS 47 2HE LYS 47 0.855 9.874 1.773
286 HE3 LYS 47 1HE LYS 47 -0.608 10.125 0.822
287 HZ1 LYS 47 3HZ LYS 47 -1.199 11.968 2.077
288 HZ2 LYS 47 1HZ LYS 47 0.477 12.140 1.927
289 HZ3 LYS 47 2HZ LYS 47 -0.189 11.558 3.368
290 H PHE 48 H PHE 48 -4.294 6.919 1.559
291 HA PHE 48 HA PHE 48 -3.969 4.660 3.218
292 HB2 PHE 48 2HB PHE 48 -5.262 6.704 3.835
293 HB3 PHE 48 1HB PHE 48 -6.510 6.211 2.696
294 HD1 PHE 48 2HD PHE 48 -7.920 4.277 3.156
295 HD2 PHE 48 1HD PHE 48 -4.995 5.604 5.948
296 HE1 PHE 48 2HE PHE 48 -8.988 2.923 4.912
297 HE2 PHE 48 1HE PHE 48 -6.057 4.252 7.709
298 HZ PHE 48 HZ PHE 48 -8.057 2.910 7.192
299 H LEU 49 H LEU 49 -6.027 5.264 0.399
300 HA LEU 49 HA LEU 49 -7.237 2.677 0.487
301 HB2 LEU 49 2HB LEU 49 -8.038 3.224 -1.803
302 HB3 LEU 49 1HB LEU 49 -8.451 4.424 -0.594
303 HG LEU 49 HG LEU 49 -6.270 5.608 -1.475
304 HD11 LEU 49 1HD1 LEU 49 -5.415 4.950 -3.431
305 HD12 LEU 49 2HD1 LEU 49 -7.005 4.651 -4.131
306 HD13 LEU 49 3HD1 LEU 49 -6.239 3.422 -3.125
307 HD21 LEU 49 3HD2 LEU 49 -7.853 6.513 -3.401
308 HD22 LEU 49 1HD2 LEU 49 -8.140 6.885 -1.700
309 HD23 LEU 49 2HD2 LEU 49 -9.057 5.601 -2.489
310 H ARG 50 H ARG 50 -4.465 4.088 -1.123
311 HA ARG 50 HA ARG 50 -3.917 1.914 -2.856
312 HB2 ARG 50 2HB ARG 50 -2.465 4.328 -1.915
313 HB3 ARG 50 1HB ARG 50 -1.487 3.015 -2.557
314 HG2 ARG 50 2HG ARG 50 -3.147 3.097 -4.547
315 HG3 ARG 50 1HG ARG 50 -3.518 4.709 -3.936
316 HD2 ARG 50 2HD ARG 50 -0.945 5.026 -3.938
317 HD3 ARG 50 1HD ARG 50 -0.943 3.644 -5.033
318 HE ARG 50 HE ARG 50 -2.757 5.285 -6.160
319 HH11 ARG 50 1HH1 ARG 50 0.509 5.801 -5.040
320 HH12 ARG 50 2HH1 ARG 50 0.839 7.048 -6.196
321 HH21 ARG 50 1HH2 ARG 50 -2.323 6.923 -7.680
322 HH22 ARG 50 2HH2 ARG 50 -0.767 7.685 -7.694
323 H GLU 51 H GLU 51 -3.033 2.682 0.450
324 HA GLU 51 HA GLU 51 -1.076 0.638 0.742
325 HB2 GLU 51 2HB GLU 51 -1.477 2.751 2.187
326 HB3 GLU 51 1HB GLU 51 -2.670 1.767 3.023
327 HG2 GLU 51 2HG GLU 51 -0.914 0.114 3.523
328 HG3 GLU 51 1HG GLU 51 0.267 1.174 2.756
329 H SER 52 H SER 52 -4.546 0.752 1.064
330 HA SER 52 HA SER 52 -4.605 -1.932 2.227
331 HB2 SER 52 2HB SER 52 -6.997 -0.200 1.598
332 HB3 SER 52 1HB SER 52 -6.892 -1.542 2.738
333 HG SER 52 HG SER 52 -5.930 1.084 2.977
334 H ALA 53 H ALA 53 -3.663 -1.662 -0.446
335 HA ALA 53 HA ALA 53 -5.851 -2.942 -1.952
336 HB1 ALA 53 3HB ALA 53 -3.473 -1.675 -3.261
337 HB2 ALA 53 1HB ALA 53 -4.864 -0.708 -2.773
338 HB3 ALA 53 2HB ALA 53 -5.067 -2.016 -3.939
339 H CYS 54 H CYS 54 -5.588 -5.004 -2.498
340 HA CYS 54 HA CYS 54 -3.288 -6.465 -1.706
341 HB2 CYS 54 2HB CYS 54 -4.403 -8.357 -2.961
342 HB3 CYS 54 1HB CYS 54 -5.369 -7.619 -1.689
343 H GLY 55 H GLY 55 -1.737 -5.065 -2.913
344 HA2 GLY 55 2HA GLY 55 -0.041 -5.710 -4.547
345 HA3 GLY 55 1HA GLY 55 -1.350 -6.147 -5.634
346 H PHE 56 H PHE 56 0.398 -4.612 -6.784
347 HA PHE 56 HA PHE 56 -1.029 -2.216 -7.359
348 HB2 PHE 56 2HB PHE 56 0.787 -0.632 -6.735
349 HB3 PHE 56 1HB PHE 56 0.028 -1.397 -5.344
350 HD1 PHE 56 1HD PHE 56 3.015 -1.479 -7.526
351 HD2 PHE 56 2HD PHE 56 1.288 -2.657 -3.817
352 HE1 PHE 56 1HE PHE 56 5.223 -2.220 -6.736
353 HE2 PHE 56 2HE PHE 56 3.494 -3.399 -3.022
354 HZ PHE 56 HZ PHE 56 5.466 -3.180 -4.481
355 H ASP 57 H ASP 57 -0.622 -1.595 -9.397
356 HA ASP 57 HA ASP 57 1.886 -2.461 -10.657
357 HB2 ASP 57 2HB ASP 57 -0.578 -3.661 -11.154
358 HB3 ASP 57 1HB ASP 57 -0.362 -2.551 -12.505
359 H GLY 58 H GLY 58 0.600 0.140 -9.662
360 HA2 GLY 58 2HA GLY 58 0.493 2.336 -10.320
361 HA3 GLY 58 1HA GLY 58 1.751 1.895 -11.464
362 H GLN 59 H GLN 59 -1.391 0.399 -11.603
363 HA GLN 59 HA GLN 59 -2.452 2.232 -13.547
364 HB2 GLN 59 2HB GLN 59 -0.966 -0.150 -14.391
365 HB3 GLN 59 1HB GLN 59 -2.576 -0.045 -15.087
366 HG2 GLN 59 2HG GLN 59 -0.495 2.124 -15.220
367 HG3 GLN 59 1HG GLN 59 -0.840 0.967 -16.502
368 HE21 GLN 59 1HE2 GLN 59 -1.928 3.781 -14.808
369 HE22 GLN 59 2HE2 GLN 59 -3.216 4.190 -15.884
370 H THR 60 H THR 60 -2.629 -1.048 -12.208
371 HA THR 60 HA THR 60 -5.495 -1.153 -12.581
372 HB THR 60 HB THR 60 -4.165 -3.184 -12.874
373 HG1 THR 60 1HG THR 60 -5.765 -4.289 -12.110
374 HG21 THR 60 3HG2 THR 60 -3.043 -4.310 -11.137
375 HG22 THR 60 1HG2 THR 60 -3.638 -3.180 -9.920
376 HG23 THR 60 2HG2 THR 60 -2.454 -2.648 -11.113
377 HA PRO 61 HA PRO 61 -5.989 0.631 -8.467
378 HB2 PRO 61 2HB PRO 61 -8.446 1.601 -8.803
379 HB3 PRO 61 1HB PRO 61 -7.063 2.340 -9.618
380 HG2 PRO 61 2HG PRO 61 -9.143 0.495 -10.709
381 HG3 PRO 61 1HG PRO 61 -8.384 1.904 -11.469
382 HD2 PRO 61 2HD PRO 61 -7.657 -0.753 -11.895
383 HD3 PRO 61 1HD PRO 61 -6.655 0.663 -12.269
384 H LYS 62 H LYS 62 -6.302 -0.780 -6.851
385 HA LYS 62 HA LYS 62 -8.862 -2.203 -6.718
386 HB2 LYS 62 2HB LYS 62 -7.774 -4.261 -6.002
387 HB3 LYS 62 1HB LYS 62 -7.195 -3.791 -7.595
388 HG2 LYS 62 2HG LYS 62 -5.245 -2.691 -6.331
389 HG3 LYS 62 1HG LYS 62 -5.769 -3.680 -4.967
390 HD2 LYS 62 2HD LYS 62 -4.388 -5.217 -5.860
391 HD3 LYS 62 1HD LYS 62 -5.738 -5.523 -6.954
392 HE2 LYS 62 2HE LYS 62 -4.773 -4.310 -8.685
393 HE3 LYS 62 1HE LYS 62 -3.709 -3.420 -7.597
394 HZ1 LYS 62 3HZ LYS 62 -2.204 -5.095 -7.548
395 HZ2 LYS 62 1HZ LYS 62 -2.850 -5.406 -9.081
396 HZ3 LYS 62 2HZ LYS 62 -3.358 -6.315 -7.749
397 H VAL 63 H VAL 63 -9.358 -2.997 -4.526
398 HA VAL 63 HA VAL 63 -7.867 -1.710 -2.370
399 HB VAL 63 HB VAL 63 -10.852 -1.339 -2.619
400 HG11 VAL 63 1HG1 VAL 63 -10.183 -1.291 -0.343
401 HG12 VAL 63 2HG1 VAL 63 -10.402 0.387 -0.841
402 HG13 VAL 63 3HG1 VAL 63 -8.778 -0.288 -0.708
403 HG21 VAL 63 3HG2 VAL 63 -8.579 0.371 -3.524
404 HG22 VAL 63 1HG2 VAL 63 -10.047 1.134 -2.916
405 HG23 VAL 63 2HG2 VAL 63 -10.127 0.051 -4.306
406 H CYS 64 H CYS 64 -8.498 -2.478 -0.230
407 HA CYS 64 HA CYS 64 -9.453 -5.253 -0.356
408 HB2 CYS 64 2HB CYS 64 -7.139 -4.552 0.617
409 HB3 CYS 64 1HB CYS 64 -8.070 -4.048 2.022
410 H CYS 65 H CYS 65 -11.376 -5.750 0.446
411 HA CYS 65 HA CYS 65 -12.602 -3.921 2.403
412 HB2 CYS 65 2HB CYS 65 -13.604 -4.945 -0.143
413 HB3 CYS 65 1HB CYS 65 -14.718 -5.226 1.189
414 HA PRO 66 HA PRO 66 -12.547 -7.767 4.755
415 HB2 PRO 66 2HB PRO 66 -13.225 -6.702 7.134
416 HB3 PRO 66 1HB PRO 66 -11.604 -6.517 6.452
417 HG2 PRO 66 2HG PRO 66 -13.889 -4.582 6.454
418 HG3 PRO 66 1HG PRO 66 -12.170 -4.284 6.769
419 HD2 PRO 66 2HD PRO 66 -13.367 -3.772 4.372
420 HD3 PRO 66 1HD PRO 66 -11.651 -4.191 4.534
Start of MODEL 16
1 H GLN 11 H GLN 11 -12.552 -11.662 -4.571
2 HA GLN 11 HA GLN 11 -10.471 -12.607 -4.562
3 HB2 GLN 11 2HB GLN 11 -9.769 -10.290 -5.915
4 HB3 GLN 11 1HB GLN 11 -8.881 -10.160 -4.404
5 HG2 GLN 11 2HG GLN 11 -7.372 -11.603 -5.121
6 HG3 GLN 11 1HG GLN 11 -8.620 -12.816 -5.408
7 HE21 GLN 11 1HE2 GLN 11 -7.371 -13.510 -7.213
8 HE22 GLN 11 2HE2 GLN 11 -7.439 -12.651 -8.710
9 H ALA 12 H ALA 12 -9.423 -13.078 -2.647
10 HA ALA 12 HA ALA 12 -10.320 -11.522 -0.335
11 HB1 ALA 12 3HB ALA 12 -10.326 -13.436 0.861
12 HB2 ALA 12 1HB ALA 12 -8.861 -14.049 0.093
13 HB3 ALA 12 2HB ALA 12 -10.412 -14.180 -0.737
14 H CYS 13 H CYS 13 -8.984 -10.082 0.517
15 HA CYS 13 HA CYS 13 -6.088 -10.615 0.405
16 HB2 CYS 13 2HB CYS 13 -5.921 -8.766 -0.850
17 HB3 CYS 13 1HB CYS 13 -7.602 -8.346 -0.574
18 H THR 14 H THR 14 -4.835 -9.602 2.135
19 HA THR 14 HA THR 14 -6.298 -9.745 4.658
20 HB THR 14 HB THR 14 -4.322 -11.127 4.511
21 HG1 THR 14 1HG THR 14 -4.529 -10.357 6.540
22 HG21 THR 14 3HG2 THR 14 -2.179 -9.339 4.578
23 HG22 THR 14 1HG2 THR 14 -3.164 -8.863 3.196
24 HG23 THR 14 2HG2 THR 14 -2.565 -10.517 3.322
25 H LEU 15 H LEU 15 -7.023 -7.934 5.529
26 HA LEU 15 HA LEU 15 -6.330 -5.349 4.687
27 HB2 LEU 15 2HB LEU 15 -7.422 -4.697 6.940
28 HB3 LEU 15 1HB LEU 15 -8.404 -5.467 5.710
29 HG LEU 15 HG LEU 15 -7.161 -7.334 7.612
30 HD11 LEU 15 1HD1 LEU 15 -8.151 -6.695 9.541
31 HD12 LEU 15 2HD1 LEU 15 -9.518 -5.941 8.721
32 HD13 LEU 15 3HD1 LEU 15 -7.974 -5.094 8.825
33 HD21 LEU 15 3HD2 LEU 15 -8.704 -8.473 6.442
34 HD22 LEU 15 1HD2 LEU 15 -9.620 -7.021 6.037
35 HD23 LEU 15 2HD2 LEU 15 -9.835 -7.791 7.609
36 HA PRO 16 HA PRO 16 -2.674 -4.054 6.757
37 HB2 PRO 16 2HB PRO 16 -3.647 -1.948 8.343
38 HB3 PRO 16 1HB PRO 16 -3.029 -1.817 6.695
39 HG2 PRO 16 2HG PRO 16 -5.842 -1.991 7.659
40 HG3 PRO 16 1HG PRO 16 -5.175 -1.086 6.289
41 HD2 PRO 16 2HD PRO 16 -6.556 -3.343 5.912
42 HD3 PRO 16 1HD PRO 16 -5.141 -2.958 4.911
43 H ASN 17 H ASN 17 -5.539 -4.633 8.672
44 HA ASN 17 HA ASN 17 -4.090 -4.851 11.161
45 HB2 ASN 17 2HB ASN 17 -6.775 -4.469 10.440
46 HB3 ASN 17 1HB ASN 17 -6.724 -6.048 11.219
47 HD21 ASN 17 1HD2 ASN 17 -6.130 -2.637 11.610
48 HD22 ASN 17 2HD2 ASN 17 -6.099 -2.640 13.338
49 H ASN 18 H ASN 18 -4.858 -6.904 8.530
50 HA ASN 18 HA ASN 18 -4.338 -9.070 8.085
51 HB2 ASN 18 2HB ASN 18 -3.030 -9.205 10.804
52 HB3 ASN 18 1HB ASN 18 -2.704 -10.219 9.401
53 HD21 ASN 18 1HD2 ASN 18 -1.815 -9.127 7.494
54 HD22 ASN 18 2HD2 ASN 18 -0.723 -7.809 7.736
55 H ASP 19 H ASP 19 -6.628 -9.443 8.227
56 HA ASP 19 HA ASP 19 -7.255 -11.456 10.214
57 HB2 ASP 19 2HB ASP 19 -7.968 -8.954 10.908
58 HB3 ASP 19 1HB ASP 19 -9.375 -9.398 9.948
59 H LYS 20 H LYS 20 -6.937 -11.127 7.244
60 HA LYS 20 HA LYS 20 -7.849 -11.991 5.351
61 HB2 LYS 20 2HB LYS 20 -9.930 -13.286 7.106
62 HB3 LYS 20 1HB LYS 20 -9.358 -13.827 5.534
63 HG2 LYS 20 2HG LYS 20 -7.742 -13.781 8.075
64 HG3 LYS 20 1HG LYS 20 -8.471 -15.205 7.333
65 HD2 LYS 20 2HD LYS 20 -6.802 -15.413 5.857
66 HD3 LYS 20 1HD LYS 20 -6.820 -13.691 5.474
67 HE2 LYS 20 2HE LYS 20 -5.289 -13.173 7.122
68 HE3 LYS 20 1HE LYS 20 -5.679 -14.603 8.077
69 HZ1 LYS 20 3HZ LYS 20 -3.838 -14.307 5.840
70 HZ2 LYS 20 1HZ LYS 20 -4.706 -15.757 5.912
71 HZ3 LYS 20 2HZ LYS 20 -3.727 -15.292 7.210
72 H GLY 21 H GLY 21 -9.135 -11.130 3.826
73 HA2 GLY 21 2HA GLY 21 -11.798 -10.204 4.426
74 HA3 GLY 21 1HA GLY 21 -10.651 -8.902 4.156
75 H THR 22 H THR 22 -12.036 -8.329 2.366
76 HA THR 22 HA THR 22 -11.418 -9.903 -0.048
77 HB THR 22 HB THR 22 -13.972 -8.350 0.247
78 HG1 THR 22 1HG THR 22 -13.489 -11.022 1.061
79 HG21 THR 22 3HG2 THR 22 -13.834 -8.979 -1.948
80 HG22 THR 22 1HG2 THR 22 -14.693 -10.355 -1.258
81 HG23 THR 22 2HG2 THR 22 -12.964 -10.469 -1.584
82 H CYS 23 H CYS 23 -10.606 -8.731 -1.731
83 HA CYS 23 HA CYS 23 -10.696 -5.801 -1.454
84 HB2 CYS 23 2HB CYS 23 -8.508 -5.651 -2.455
85 HB3 CYS 23 1HB CYS 23 -8.435 -6.753 -1.086
86 H LYS 24 H LYS 24 -11.484 -4.657 -3.068
87 HA LYS 24 HA LYS 24 -11.587 -5.752 -5.767
88 HB2 LYS 24 2HB LYS 24 -13.995 -5.112 -5.973
89 HB3 LYS 24 1HB LYS 24 -13.709 -6.466 -4.887
90 HG2 LYS 24 2HG LYS 24 -13.710 -4.676 -3.028
91 HG3 LYS 24 1HG LYS 24 -14.501 -3.660 -4.234
92 HD2 LYS 24 2HD LYS 24 -16.284 -4.644 -3.103
93 HD3 LYS 24 1HD LYS 24 -16.106 -5.652 -4.540
94 HE2 LYS 24 2HE LYS 24 -16.397 -7.100 -2.664
95 HE3 LYS 24 1HE LYS 24 -14.715 -7.215 -3.179
96 HZ1 LYS 24 3HZ LYS 24 -14.265 -6.854 -1.037
97 HZ2 LYS 24 1HZ LYS 24 -15.812 -6.263 -0.694
98 HZ3 LYS 24 2HZ LYS 24 -14.639 -5.234 -1.347
99 H SER 25 H SER 25 -12.471 -4.018 -7.310
100 HA SER 25 HA SER 25 -10.875 -1.780 -7.257
101 HB2 SER 25 2HB SER 25 -12.284 -2.714 -9.190
102 HB3 SER 25 1HB SER 25 -13.607 -1.750 -8.534
103 HG SER 25 HG SER 25 -11.102 -0.832 -9.491
104 H LEU 26 H LEU 26 -11.891 0.557 -7.382
105 HA LEU 26 HA LEU 26 -13.032 1.032 -4.749
106 HB2 LEU 26 2HB LEU 26 -12.539 3.404 -5.218
107 HB3 LEU 26 1HB LEU 26 -11.130 2.369 -5.347
108 HG LEU 26 HG LEU 26 -12.116 2.457 -7.941
109 HD11 LEU 26 1HD1 LEU 26 -12.943 4.482 -8.452
110 HD12 LEU 26 2HD1 LEU 26 -11.915 5.314 -7.284
111 HD13 LEU 26 3HD1 LEU 26 -13.395 4.520 -6.748
112 HD21 LEU 26 3HD2 LEU 26 -10.137 3.961 -8.315
113 HD22 LEU 26 1HD2 LEU 26 -9.791 2.462 -7.454
114 HD23 LEU 26 2HD2 LEU 26 -9.913 3.981 -6.567
115 H LEU 27 H LEU 27 -14.713 -0.119 -6.846
116 HA LEU 27 HA LEU 27 -16.871 1.838 -6.710
117 HB2 LEU 27 2HB LEU 27 -16.352 0.421 -9.306
118 HB3 LEU 27 1HB LEU 27 -17.389 1.801 -9.000
119 HG LEU 27 HG LEU 27 -15.008 2.881 -8.348
120 HD11 LEU 27 1HD1 LEU 27 -13.312 2.166 -9.912
121 HD12 LEU 27 2HD1 LEU 27 -14.394 0.935 -10.567
122 HD13 LEU 27 3HD1 LEU 27 -13.806 0.802 -8.909
123 HD21 LEU 27 3HD2 LEU 27 -16.777 3.633 -9.995
124 HD22 LEU 27 1HD2 LEU 27 -15.915 2.687 -11.207
125 HD23 LEU 27 2HD2 LEU 27 -15.110 4.034 -10.404
126 H GLN 28 H GLN 28 -16.293 -0.672 -5.361
127 HA GLN 28 HA GLN 28 -18.706 -2.137 -6.170
128 HB2 GLN 28 2HB GLN 28 -16.028 -3.350 -5.478
129 HB3 GLN 28 1HB GLN 28 -17.522 -4.270 -5.596
130 HG2 GLN 28 2HG GLN 28 -16.975 -2.626 -7.943
131 HG3 GLN 28 1HG GLN 28 -15.742 -3.846 -7.624
132 HE21 GLN 28 1HE2 GLN 28 -16.185 -5.250 -9.230
133 HE22 GLN 28 2HE2 GLN 28 -17.679 -6.099 -9.400
134 H CYS 29 H CYS 29 -16.220 -1.939 -3.613
135 HA CYS 29 HA CYS 29 -17.861 -2.962 -1.565
136 HB2 CYS 29 2HB CYS 29 -15.305 -2.675 -1.586
137 HB3 CYS 29 1HB CYS 29 -15.613 -1.016 -1.088
138 H ASP 30 H ASP 30 -19.256 -2.038 -0.161
139 HA ASP 30 HA ASP 30 -20.532 0.367 -0.841
140 HB2 ASP 30 2HB ASP 30 -21.055 -1.745 0.870
141 HB3 ASP 30 1HB ASP 30 -20.834 -0.387 1.968
142 H VAL 31 H VAL 31 -17.878 -0.339 1.319
143 HA VAL 31 HA VAL 31 -17.902 2.138 2.711
144 HB VAL 31 HB VAL 31 -15.540 0.307 2.287
145 HG11 VAL 31 1HG1 VAL 31 -14.531 1.341 4.114
146 HG12 VAL 31 2HG1 VAL 31 -16.044 2.064 4.661
147 HG13 VAL 31 3HG1 VAL 31 -15.243 2.683 3.218
148 HG21 VAL 31 3HG2 VAL 31 -16.219 -1.031 4.027
149 HG22 VAL 31 1HG2 VAL 31 -17.770 -0.643 3.283
150 HG23 VAL 31 2HG2 VAL 31 -17.245 0.217 4.731
151 H ALA 32 H ALA 32 -16.220 0.955 -0.154
152 HA ALA 32 HA ALA 32 -14.555 3.207 -0.519
153 HB1 ALA 32 3HB ALA 32 -15.412 0.914 -2.198
154 HB2 ALA 32 1HB ALA 32 -13.791 1.453 -1.758
155 HB3 ALA 32 2HB ALA 32 -14.697 2.308 -3.007
156 H SER 33 H SER 33 -17.814 2.448 -1.588
157 HA SER 33 HA SER 33 -18.092 4.619 -3.383
158 HB2 SER 33 2HB SER 33 -20.419 4.066 -3.452
159 HB3 SER 33 1HB SER 33 -19.533 2.547 -3.314
160 HG SER 33 HG SER 33 -19.936 2.750 -0.989
161 H LYS 34 H LYS 34 -18.719 4.252 0.062
162 HA LYS 34 HA LYS 34 -20.099 6.718 0.361
163 HB2 LYS 34 2HB LYS 34 -19.909 6.369 2.730
164 HB3 LYS 34 1HB LYS 34 -20.255 4.823 1.969
165 HG2 LYS 34 2HG LYS 34 -18.222 3.954 2.480
166 HG3 LYS 34 1HG LYS 34 -17.414 5.518 2.457
167 HD2 LYS 34 2HD LYS 34 -18.336 6.101 4.587
168 HD3 LYS 34 1HD LYS 34 -19.373 4.674 4.580
169 HE2 LYS 34 2HE LYS 34 -17.761 3.412 5.453
170 HE3 LYS 34 1HE LYS 34 -16.614 3.929 4.219
171 HZ1 LYS 34 3HZ LYS 34 -15.785 5.567 5.541
172 HZ2 LYS 34 1HZ LYS 34 -16.233 4.462 6.743
173 HZ3 LYS 34 2HZ LYS 34 -17.227 5.787 6.398
174 H ILE 35 H ILE 35 -16.720 5.794 0.473
175 HA ILE 35 HA ILE 35 -15.771 8.222 1.617
176 HB ILE 35 HB ILE 35 -14.257 6.252 -0.101
177 HG12 ILE 35 2HG1 ILE 35 -14.090 6.339 2.884
178 HG13 ILE 35 1HG1 ILE 35 -15.454 5.519 2.134
179 HG21 ILE 35 1HG2 ILE 35 -13.479 8.760 0.763
180 HG22 ILE 35 2HG2 ILE 35 -12.411 7.458 0.241
181 HG23 ILE 35 3HG2 ILE 35 -12.774 7.670 1.953
182 HD11 ILE 35 3HD1 ILE 35 -12.740 4.840 1.164
183 HD12 ILE 35 1HD1 ILE 35 -14.172 3.825 1.337
184 HD13 ILE 35 2HD1 ILE 35 -13.221 4.260 2.757
185 H ILE 36 H ILE 36 -16.336 7.110 -1.666
186 HA ILE 36 HA ILE 36 -15.065 9.338 -2.927
187 HB ILE 36 HB ILE 36 -17.087 7.400 -4.060
188 HG12 ILE 36 2HG1 ILE 36 -14.927 6.434 -3.137
189 HG13 ILE 36 1HG1 ILE 36 -15.255 6.092 -4.831
190 HG21 ILE 36 1HG2 ILE 36 -15.629 9.682 -5.200
191 HG22 ILE 36 2HG2 ILE 36 -17.129 8.915 -5.720
192 HG23 ILE 36 3HG2 ILE 36 -15.578 8.202 -6.158
193 HD11 ILE 36 3HD1 ILE 36 -13.323 6.991 -5.417
194 HD12 ILE 36 1HD1 ILE 36 -12.948 7.212 -3.709
195 HD13 ILE 36 2HD1 ILE 36 -13.737 8.505 -4.614
196 H SER 37 H SER 37 -18.266 8.662 -1.725
197 HA SER 37 HA SER 37 -19.423 10.975 -3.048
198 HB2 SER 37 2HB SER 37 -20.867 9.071 -2.894
199 HB3 SER 37 1HB SER 37 -20.565 8.904 -1.165
200 HG SER 37 HG SER 37 -22.495 9.935 -1.335
201 H LYS 38 H LYS 38 -18.218 10.038 0.093
202 HA LYS 38 HA LYS 38 -19.329 12.218 1.542
203 HB2 LYS 38 2HB LYS 38 -17.293 10.118 2.065
204 HB3 LYS 38 1HB LYS 38 -17.253 11.550 3.082
205 HG2 LYS 38 2HG LYS 38 -19.927 10.428 2.760
206 HG3 LYS 38 1HG LYS 38 -18.777 9.324 3.517
207 HD2 LYS 38 2HD LYS 38 -19.733 10.518 5.300
208 HD3 LYS 38 1HD LYS 38 -18.162 11.275 5.041
209 HE2 LYS 38 2HE LYS 38 -19.161 13.237 4.768
210 HE3 LYS 38 1HE LYS 38 -20.026 12.597 3.370
211 HZ1 LYS 38 3HZ LYS 38 -21.905 12.313 4.551
212 HZ2 LYS 38 1HZ LYS 38 -21.239 13.508 5.547
213 HZ3 LYS 38 2HZ LYS 38 -21.099 11.878 5.973
214 H LYS 39 H LYS 39 -15.921 11.580 0.783
215 HA LYS 39 HA LYS 39 -15.391 14.066 -0.400
216 HB2 LYS 39 2HB LYS 39 -13.934 14.915 1.580
217 HB3 LYS 39 1HB LYS 39 -15.659 15.236 1.576
218 HG2 LYS 39 2HG LYS 39 -15.904 13.152 3.003
219 HG3 LYS 39 1HG LYS 39 -14.151 13.214 3.195
220 HD2 LYS 39 2HD LYS 39 -14.935 15.801 3.737
221 HD3 LYS 39 1HD LYS 39 -16.230 14.833 4.444
222 HE2 LYS 39 2HE LYS 39 -14.293 13.435 5.451
223 HE3 LYS 39 1HE LYS 39 -13.309 14.855 5.097
224 HZ1 LYS 39 3HZ LYS 39 -15.147 16.109 6.350
225 HZ2 LYS 39 1HZ LYS 39 -14.021 15.222 7.249
226 HZ3 LYS 39 2HZ LYS 39 -15.567 14.594 6.972
227 HA PRO 40 HA PRO 40 -12.043 10.940 -0.689
228 HB2 PRO 40 2HB PRO 40 -11.990 10.693 -3.358
229 HB3 PRO 40 1HB PRO 40 -13.207 9.861 -2.379
230 HG2 PRO 40 2HG PRO 40 -13.458 12.378 -3.976
231 HG3 PRO 40 1HG PRO 40 -14.601 11.033 -3.820
232 HD2 PRO 40 2HD PRO 40 -14.786 13.403 -2.426
233 HD3 PRO 40 1HD PRO 40 -15.496 11.867 -1.891
234 H ARG 41 H ARG 41 -10.754 12.772 0.106
235 HA ARG 41 HA ARG 41 -8.761 13.537 -1.738
236 HB2 ARG 41 2HB ARG 41 -10.667 15.085 -2.382
237 HB3 ARG 41 1HB ARG 41 -10.464 15.848 -0.811
238 HG2 ARG 41 2HG ARG 41 -8.169 16.438 -1.385
239 HG3 ARG 41 1HG ARG 41 -8.359 15.658 -2.957
240 HD2 ARG 41 2HD ARG 41 -10.340 17.732 -2.191
241 HD3 ARG 41 1HD ARG 41 -8.714 18.270 -2.612
242 HE ARG 41 HE ARG 41 -9.778 16.456 -4.541
243 HH11 ARG 41 1HH1 ARG 41 -9.836 19.784 -3.494
244 HH12 ARG 41 2HH1 ARG 41 -10.265 20.399 -5.055
245 HH21 ARG 41 1HH2 ARG 41 -10.343 17.261 -6.593
246 HH22 ARG 41 2HH2 ARG 41 -10.553 18.966 -6.815
247 H THR 42 H THR 42 -7.924 12.391 0.242
248 HA THR 42 HA THR 42 -6.870 14.385 2.068
249 HB THR 42 HB THR 42 -7.834 11.911 3.396
250 HG1 THR 42 1HG THR 42 -9.601 14.046 2.808
251 HG21 THR 42 3HG2 THR 42 -6.634 13.801 4.553
252 HG22 THR 42 1HG2 THR 42 -8.161 13.285 5.273
253 HG23 THR 42 2HG2 THR 42 -8.095 14.758 4.303
254 H ALA 43 H ALA 43 -4.807 13.969 2.623
255 HA ALA 43 HA ALA 43 -3.284 12.102 1.251
256 HB1 ALA 43 3HB ALA 43 -2.825 14.123 3.195
257 HB2 ALA 43 1HB ALA 43 -1.671 13.372 2.094
258 HB3 ALA 43 2HB ALA 43 -1.954 12.673 3.690
259 H GLN 44 H GLN 44 -4.966 11.827 4.297
260 HA GLN 44 HA GLN 44 -3.699 9.395 5.106
261 HB2 GLN 44 2HB GLN 44 -4.975 11.151 6.543
262 HB3 GLN 44 1HB GLN 44 -6.409 10.252 6.065
263 HG2 GLN 44 2HG GLN 44 -4.341 8.477 7.001
264 HG3 GLN 44 1HG GLN 44 -4.710 9.715 8.201
265 HE21 GLN 44 1HE2 GLN 44 -6.484 9.500 9.402
266 HE22 GLN 44 2HE2 GLN 44 -7.706 8.300 9.170
267 H ASP 45 H ASP 45 -6.566 10.233 3.277
268 HA ASP 45 HA ASP 45 -7.701 7.627 3.269
269 HB2 ASP 45 2HB ASP 45 -8.325 10.221 2.149
270 HB3 ASP 45 1HB ASP 45 -8.588 8.950 0.957
271 H GLU 46 H GLU 46 -5.444 9.318 1.169
272 HA GLU 46 HA GLU 46 -5.484 7.364 -0.901
273 HB2 GLU 46 2HB GLU 46 -3.403 8.491 -1.681
274 HB3 GLU 46 1HB GLU 46 -4.749 9.593 -1.427
275 HG2 GLU 46 2HG GLU 46 -3.817 10.330 0.661
276 HG3 GLU 46 1HG GLU 46 -2.527 9.134 0.548
277 H LYS 47 H LYS 47 -3.438 7.907 1.920
278 HA LYS 47 HA LYS 47 -1.584 5.844 1.315
279 HB2 LYS 47 2HB LYS 47 -0.839 6.086 3.631
280 HB3 LYS 47 1HB LYS 47 -1.042 7.659 2.872
281 HG2 LYS 47 2HG LYS 47 -3.161 7.961 3.998
282 HG3 LYS 47 1HG LYS 47 -3.036 6.353 4.711
283 HD2 LYS 47 2HD LYS 47 -2.384 8.065 6.319
284 HD3 LYS 47 1HD LYS 47 -1.008 7.043 5.901
285 HE2 LYS 47 2HE LYS 47 -1.353 9.436 4.227
286 HE3 LYS 47 1HE LYS 47 -0.959 9.753 5.915
287 HZ1 LYS 47 3HZ LYS 47 0.794 7.835 5.347
288 HZ2 LYS 47 1HZ LYS 47 1.129 9.483 5.169
289 HZ3 LYS 47 2HZ LYS 47 0.667 8.564 3.826
290 H PHE 48 H PHE 48 -4.592 5.979 3.127
291 HA PHE 48 HA PHE 48 -4.410 3.381 4.234
292 HB2 PHE 48 2HB PHE 48 -5.962 5.351 4.899
293 HB3 PHE 48 1HB PHE 48 -7.024 4.734 3.636
294 HD1 PHE 48 2HD PHE 48 -4.935 3.041 6.220
295 HD2 PHE 48 1HD PHE 48 -8.819 3.682 4.603
296 HE1 PHE 48 2HE PHE 48 -5.861 1.403 7.806
297 HE2 PHE 48 1HE PHE 48 -9.752 2.045 6.185
298 HZ PHE 48 HZ PHE 48 -8.273 0.902 7.788
299 H LEU 49 H LEU 49 -5.933 4.639 1.298
300 HA LEU 49 HA LEU 49 -7.001 2.102 0.536
301 HB2 LEU 49 2HB LEU 49 -7.423 3.166 -1.650
302 HB3 LEU 49 1HB LEU 49 -8.050 4.096 -0.304
303 HG LEU 49 HG LEU 49 -5.813 5.421 -0.512
304 HD11 LEU 49 1HD1 LEU 49 -5.664 3.626 -2.764
305 HD12 LEU 49 2HD1 LEU 49 -4.455 4.742 -2.133
306 HD13 LEU 49 3HD1 LEU 49 -5.655 5.309 -3.292
307 HD21 LEU 49 3HD2 LEU 49 -8.145 5.627 -2.401
308 HD22 LEU 49 1HD2 LEU 49 -6.890 6.860 -2.273
309 HD23 LEU 49 2HD2 LEU 49 -7.903 6.482 -0.879
310 H ARG 50 H ARG 50 -4.086 3.917 -0.216
311 HA ARG 50 HA ARG 50 -3.107 2.144 -2.202
312 HB2 ARG 50 2HB ARG 50 -1.928 4.334 -0.544
313 HB3 ARG 50 1HB ARG 50 -0.846 3.253 -1.410
314 HG2 ARG 50 2HG ARG 50 -2.725 3.953 -3.310
315 HG3 ARG 50 1HG ARG 50 -2.470 5.442 -2.396
316 HD2 ARG 50 2HD ARG 50 -0.135 5.407 -2.830
317 HD3 ARG 50 1HD ARG 50 -0.212 3.769 -3.473
318 HE ARG 50 HE ARG 50 -0.786 4.648 -5.495
319 HH11 ARG 50 1HH1 ARG 50 -1.444 7.034 -3.035
320 HH12 ARG 50 2HH1 ARG 50 -1.868 8.271 -4.171
321 HH21 ARG 50 1HH2 ARG 50 -1.343 6.274 -6.991
322 HH22 ARG 50 2HH2 ARG 50 -1.811 7.838 -6.416
323 H GLU 51 H GLU 51 -2.736 2.340 1.294
324 HA GLU 51 HA GLU 51 -0.767 0.279 1.464
325 HB2 GLU 51 2HB GLU 51 -2.478 1.749 3.432
326 HB3 GLU 51 1HB GLU 51 -1.622 0.302 3.945
327 HG2 GLU 51 2HG GLU 51 0.459 1.444 2.955
328 HG3 GLU 51 1HG GLU 51 -0.509 2.916 3.013
329 H SER 52 H SER 52 -4.265 0.380 1.564
330 HA SER 52 HA SER 52 -4.382 -2.472 2.207
331 HB2 SER 52 2HB SER 52 -6.794 -0.730 1.786
332 HB3 SER 52 1HB SER 52 -6.623 -2.162 2.801
333 HG SER 52 HG SER 52 -6.578 0.153 3.727
334 H ALA 53 H ALA 53 -3.324 -1.760 -0.320
335 HA ALA 53 HA ALA 53 -5.482 -2.544 -2.164
336 HB1 ALA 53 3HB ALA 53 -4.125 -1.640 -3.954
337 HB2 ALA 53 1HB ALA 53 -2.811 -1.304 -2.824
338 HB3 ALA 53 2HB ALA 53 -4.336 -0.428 -2.691
339 H CYS 54 H CYS 54 -5.517 -4.607 -2.751
340 HA CYS 54 HA CYS 54 -3.266 -6.333 -2.263
341 HB2 CYS 54 2HB CYS 54 -4.735 -8.131 -3.025
342 HB3 CYS 54 1HB CYS 54 -5.565 -7.107 -1.860
343 H GLY 55 H GLY 55 -2.096 -4.747 -3.874
344 HA2 GLY 55 2HA GLY 55 -0.788 -5.743 -5.814
345 HA3 GLY 55 1HA GLY 55 -2.354 -5.834 -6.606
346 H PHE 56 H PHE 56 0.175 -4.336 -7.223
347 HA PHE 56 HA PHE 56 -0.945 -1.612 -7.263
348 HB2 PHE 56 2HB PHE 56 1.807 -2.657 -6.929
349 HB3 PHE 56 1HB PHE 56 1.643 -1.213 -7.922
350 HD1 PHE 56 1HD PHE 56 -0.286 0.428 -6.718
351 HD2 PHE 56 2HD PHE 56 2.503 -2.159 -4.809
352 HE1 PHE 56 1HE PHE 56 -0.398 1.813 -4.688
353 HE2 PHE 56 2HE PHE 56 2.394 -0.780 -2.774
354 HZ PHE 56 HZ PHE 56 0.943 1.208 -2.712
355 H ASP 57 H ASP 57 -1.972 -1.332 -9.140
356 HA ASP 57 HA ASP 57 -0.540 -2.065 -11.608
357 HB2 ASP 57 2HB ASP 57 -3.397 -2.492 -10.842
358 HB3 ASP 57 1HB ASP 57 -3.016 -2.163 -12.530
359 H GLY 58 H GLY 58 -0.396 -0.532 -13.169
360 HA2 GLY 58 2HA GLY 58 -1.330 2.140 -12.449
361 HA3 GLY 58 1HA GLY 58 -0.157 1.751 -13.697
362 H GLN 59 H GLN 59 -3.450 0.530 -13.166
363 HA GLN 59 HA GLN 59 -4.490 2.002 -15.412
364 HB2 GLN 59 2HB GLN 59 -4.127 -0.993 -15.578
365 HB3 GLN 59 1HB GLN 59 -5.180 -0.075 -16.646
366 HG2 GLN 59 2HG GLN 59 -3.208 1.240 -17.374
367 HG3 GLN 59 1HG GLN 59 -2.193 0.183 -16.394
368 HE21 GLN 59 1HE2 GLN 59 -2.498 -2.194 -16.868
369 HE22 GLN 59 2HE2 GLN 59 -2.616 -2.641 -18.533
370 H THR 60 H THR 60 -4.990 -0.739 -13.212
371 HA THR 60 HA THR 60 -7.735 0.233 -12.772
372 HB THR 60 HB THR 60 -6.980 -2.675 -12.605
373 HG1 THR 60 1HG THR 60 -6.767 -2.575 -14.689
374 HG21 THR 60 3HG2 THR 60 -9.162 -3.133 -12.375
375 HG22 THR 60 1HG2 THR 60 -9.661 -1.827 -13.450
376 HG23 THR 60 2HG2 THR 60 -9.235 -1.477 -11.774
377 HA PRO 61 HA PRO 61 -5.782 0.391 -8.660
378 HB2 PRO 61 2HB PRO 61 -7.706 1.969 -7.551
379 HB3 PRO 61 1HB PRO 61 -6.364 2.605 -8.508
380 HG2 PRO 61 2HG PRO 61 -9.190 2.063 -9.332
381 HG3 PRO 61 1HG PRO 61 -8.158 3.453 -9.719
382 HD2 PRO 61 2HD PRO 61 -8.579 1.437 -11.466
383 HD3 PRO 61 1HD PRO 61 -7.039 2.317 -11.387
384 H LYS 62 H LYS 62 -6.257 -0.626 -6.718
385 HA LYS 62 HA LYS 62 -8.882 -1.918 -6.480
386 HB2 LYS 62 2HB LYS 62 -6.194 -3.274 -6.258
387 HB3 LYS 62 1HB LYS 62 -7.687 -3.988 -5.667
388 HG2 LYS 62 2HG LYS 62 -7.809 -3.068 -8.444
389 HG3 LYS 62 1HG LYS 62 -6.649 -4.365 -8.148
390 HD2 LYS 62 2HD LYS 62 -9.002 -5.034 -6.739
391 HD3 LYS 62 1HD LYS 62 -9.503 -4.501 -8.345
392 HE2 LYS 62 2HE LYS 62 -9.130 -6.751 -8.689
393 HE3 LYS 62 1HE LYS 62 -7.582 -6.052 -9.163
394 HZ1 LYS 62 3HZ LYS 62 -8.260 -7.512 -6.687
395 HZ2 LYS 62 1HZ LYS 62 -6.910 -6.493 -6.758
396 HZ3 LYS 62 2HZ LYS 62 -7.020 -7.825 -7.795
397 H VAL 63 H VAL 63 -9.442 -2.567 -4.327
398 HA VAL 63 HA VAL 63 -7.789 -1.441 -2.184
399 HB VAL 63 HB VAL 63 -10.766 -0.964 -2.341
400 HG11 VAL 63 1HG1 VAL 63 -8.636 -0.377 -0.365
401 HG12 VAL 63 2HG1 VAL 63 -10.335 -0.781 -0.116
402 HG13 VAL 63 3HG1 VAL 63 -9.880 0.850 -0.605
403 HG21 VAL 63 3HG2 VAL 63 -9.740 1.500 -2.549
404 HG22 VAL 63 1HG2 VAL 63 -10.157 0.511 -3.950
405 HG23 VAL 63 2HG2 VAL 63 -8.486 0.596 -3.396
406 H CYS 64 H CYS 64 -8.230 -2.317 -0.088
407 HA CYS 64 HA CYS 64 -9.437 -4.989 -0.232
408 HB2 CYS 64 2HB CYS 64 -6.972 -4.527 0.513
409 HB3 CYS 64 1HB CYS 64 -7.714 -4.078 2.045
410 H CYS 65 H CYS 65 -11.300 -5.358 0.746
411 HA CYS 65 HA CYS 65 -12.184 -3.501 2.851
412 HB2 CYS 65 2HB CYS 65 -13.511 -4.559 0.463
413 HB3 CYS 65 1HB CYS 65 -14.472 -4.735 1.927
414 HA PRO 66 HA PRO 66 -11.681 -7.139 5.476
415 HB2 PRO 66 2HB PRO 66 -13.419 -5.445 7.207
416 HB3 PRO 66 1HB PRO 66 -11.918 -6.290 7.603
417 HG2 PRO 66 2HG PRO 66 -11.942 -3.649 7.237
418 HG3 PRO 66 1HG PRO 66 -10.587 -4.641 6.669
419 HD2 PRO 66 2HD PRO 66 -12.794 -3.380 5.114
420 HD3 PRO 66 1HD PRO 66 -11.105 -3.663 4.654
Start of MODEL 17
1 H GLN 11 H GLN 11 -11.808 -10.980 -4.863
2 HA GLN 11 HA GLN 11 -10.204 -12.857 -4.972
3 HB2 GLN 11 2HB GLN 11 -8.777 -10.964 -6.430
4 HB3 GLN 11 1HB GLN 11 -7.946 -11.015 -4.882
5 HG2 GLN 11 2HG GLN 11 -8.322 -13.671 -5.464
6 HG3 GLN 11 1HG GLN 11 -8.001 -12.957 -7.044
7 HE21 GLN 11 1HE2 GLN 11 -6.008 -13.941 -7.241
8 HE22 GLN 11 2HE2 GLN 11 -4.637 -13.469 -6.302
9 H ALA 12 H ALA 12 -9.373 -13.433 -2.973
10 HA ALA 12 HA ALA 12 -10.147 -11.742 -0.782
11 HB1 ALA 12 3HB ALA 12 -8.547 -14.155 -0.221
12 HB2 ALA 12 1HB ALA 12 -10.065 -14.415 -1.080
13 HB3 ALA 12 2HB ALA 12 -10.067 -13.607 0.488
14 H CYS 13 H CYS 13 -8.920 -10.282 0.199
15 HA CYS 13 HA CYS 13 -5.993 -10.537 -0.010
16 HB2 CYS 13 2HB CYS 13 -5.782 -8.163 -0.169
17 HB3 CYS 13 1HB CYS 13 -6.991 -8.652 -1.349
18 H THR 14 H THR 14 -4.829 -9.295 1.740
19 HA THR 14 HA THR 14 -6.217 -9.743 4.294
20 HB THR 14 HB THR 14 -4.291 -11.152 4.115
21 HG1 THR 14 1HG THR 14 -3.583 -10.651 6.023
22 HG21 THR 14 3HG2 THR 14 -2.039 -10.324 3.756
23 HG22 THR 14 1HG2 THR 14 -2.667 -8.697 3.495
24 HG23 THR 14 2HG2 THR 14 -3.067 -9.988 2.363
25 H LEU 15 H LEU 15 -6.897 -7.964 5.264
26 HA LEU 15 HA LEU 15 -6.182 -5.354 4.524
27 HB2 LEU 15 2HB LEU 15 -7.245 -4.768 6.788
28 HB3 LEU 15 1HB LEU 15 -8.248 -5.535 5.572
29 HG LEU 15 HG LEU 15 -6.939 -7.406 7.426
30 HD11 LEU 15 1HD1 LEU 15 -8.542 -6.944 9.243
31 HD12 LEU 15 2HD1 LEU 15 -9.028 -5.468 8.408
32 HD13 LEU 15 3HD1 LEU 15 -7.378 -5.638 9.007
33 HD21 LEU 15 3HD2 LEU 15 -9.864 -7.307 7.068
34 HD22 LEU 15 1HD2 LEU 15 -8.752 -8.673 6.979
35 HD23 LEU 15 2HD2 LEU 15 -8.915 -7.578 5.606
36 HA PRO 16 HA PRO 16 -2.495 -4.162 6.603
37 HB2 PRO 16 2HB PRO 16 -4.091 -2.241 8.236
38 HB3 PRO 16 1HB PRO 16 -2.634 -1.961 7.275
39 HG2 PRO 16 2HG PRO 16 -5.014 -1.181 6.378
40 HG3 PRO 16 1HG PRO 16 -3.810 -1.873 5.276
41 HD2 PRO 16 2HD PRO 16 -6.279 -3.106 6.406
42 HD3 PRO 16 1HD PRO 16 -5.530 -3.332 4.812
43 H ASN 17 H ASN 17 -5.317 -4.834 8.562
44 HA ASN 17 HA ASN 17 -3.777 -5.229 10.978
45 HB2 ASN 17 2HB ASN 17 -6.368 -4.535 10.551
46 HB3 ASN 17 1HB ASN 17 -6.543 -6.259 10.868
47 HD21 ASN 17 1HD2 ASN 17 -7.749 -5.396 12.729
48 HD22 ASN 17 2HD2 ASN 17 -6.869 -5.025 14.168
49 H ASN 18 H ASN 18 -4.663 -7.092 8.262
50 HA ASN 18 HA ASN 18 -4.260 -9.256 7.694
51 HB2 ASN 18 2HB ASN 18 -2.199 -8.684 9.331
52 HB3 ASN 18 1HB ASN 18 -2.965 -9.963 10.268
53 HD21 ASN 18 1HD2 ASN 18 -3.403 -11.991 9.115
54 HD22 ASN 18 2HD2 ASN 18 -2.275 -12.512 7.915
55 H ASP 19 H ASP 19 -6.497 -9.698 7.819
56 HA ASP 19 HA ASP 19 -7.147 -11.697 9.806
57 HB2 ASP 19 2HB ASP 19 -7.834 -9.225 10.543
58 HB3 ASP 19 1HB ASP 19 -9.225 -9.585 9.525
59 H LYS 20 H LYS 20 -6.821 -11.376 6.836
60 HA LYS 20 HA LYS 20 -7.737 -12.242 4.944
61 HB2 LYS 20 2HB LYS 20 -9.834 -13.501 6.712
62 HB3 LYS 20 1HB LYS 20 -9.284 -14.052 5.135
63 HG2 LYS 20 2HG LYS 20 -7.582 -15.196 6.007
64 HG3 LYS 20 1HG LYS 20 -7.133 -13.877 7.088
65 HD2 LYS 20 2HD LYS 20 -9.609 -15.385 7.724
66 HD3 LYS 20 1HD LYS 20 -8.067 -16.205 7.984
67 HE2 LYS 20 2HE LYS 20 -7.688 -13.668 9.049
68 HE3 LYS 20 1HE LYS 20 -9.333 -14.096 9.520
69 HZ1 LYS 20 3HZ LYS 20 -7.309 -16.156 9.876
70 HZ2 LYS 20 1HZ LYS 20 -8.616 -15.738 10.867
71 HZ3 LYS 20 2HZ LYS 20 -7.196 -14.818 10.904
72 H GLY 21 H GLY 21 -9.030 -11.397 3.405
73 HA2 GLY 21 2HA GLY 21 -11.666 -10.405 4.023
74 HA3 GLY 21 1HA GLY 21 -10.494 -9.136 3.707
75 H THR 22 H THR 22 -11.763 -8.506 1.918
76 HA THR 22 HA THR 22 -11.311 -10.165 -0.465
77 HB THR 22 HB THR 22 -13.785 -8.483 -0.103
78 HG1 THR 22 1HG THR 22 -14.847 -10.290 0.610
79 HG21 THR 22 3HG2 THR 22 -13.792 -10.949 -1.710
80 HG22 THR 22 1HG2 THR 22 -12.864 -9.596 -2.354
81 HG23 THR 22 2HG2 THR 22 -14.579 -9.398 -1.996
82 H CYS 23 H CYS 23 -10.892 -9.013 -2.396
83 HA CYS 23 HA CYS 23 -10.343 -6.145 -1.975
84 HB2 CYS 23 2HB CYS 23 -8.270 -7.408 -2.219
85 HB3 CYS 23 1HB CYS 23 -8.849 -8.110 -3.725
86 H LYS 24 H LYS 24 -11.479 -4.810 -3.155
87 HA LYS 24 HA LYS 24 -12.484 -5.683 -5.780
88 HB2 LYS 24 2HB LYS 24 -13.955 -4.554 -3.459
89 HB3 LYS 24 1HB LYS 24 -14.411 -3.957 -5.050
90 HG2 LYS 24 2HG LYS 24 -15.033 -6.111 -5.784
91 HG3 LYS 24 1HG LYS 24 -14.284 -6.881 -4.384
92 HD2 LYS 24 2HD LYS 24 -16.271 -4.888 -3.642
93 HD3 LYS 24 1HD LYS 24 -16.945 -6.182 -4.636
94 HE2 LYS 24 2HE LYS 24 -15.281 -7.451 -2.776
95 HE3 LYS 24 1HE LYS 24 -16.155 -6.220 -1.866
96 HZ1 LYS 24 3HZ LYS 24 -17.554 -8.068 -3.699
97 HZ2 LYS 24 1HZ LYS 24 -18.199 -7.151 -2.432
98 HZ3 LYS 24 2HZ LYS 24 -17.228 -8.495 -2.096
99 H SER 25 H SER 25 -13.113 -3.810 -7.172
100 HA SER 25 HA SER 25 -10.989 -1.916 -7.266
101 HB2 SER 25 2HB SER 25 -12.800 -0.909 -9.020
102 HB3 SER 25 1HB SER 25 -11.699 -2.232 -9.409
103 HG SER 25 HG SER 25 -14.434 -2.318 -8.762
104 H LEU 26 H LEU 26 -11.991 0.496 -7.892
105 HA LEU 26 HA LEU 26 -12.923 1.441 -5.327
106 HB2 LEU 26 2HB LEU 26 -12.444 3.626 -6.112
107 HB3 LEU 26 1HB LEU 26 -11.151 2.587 -6.682
108 HG LEU 26 HG LEU 26 -12.842 2.513 -8.815
109 HD11 LEU 26 1HD1 LEU 26 -13.984 4.475 -7.314
110 HD12 LEU 26 2HD1 LEU 26 -14.112 4.337 -9.067
111 HD13 LEU 26 3HD1 LEU 26 -12.901 5.402 -8.352
112 HD21 LEU 26 3HD2 LEU 26 -10.725 2.936 -9.461
113 HD22 LEU 26 1HD2 LEU 26 -10.404 3.994 -8.088
114 HD23 LEU 26 2HD2 LEU 26 -11.283 4.610 -9.489
115 H LEU 27 H LEU 27 -14.563 0.082 -7.753
116 HA LEU 27 HA LEU 27 -16.955 1.678 -7.193
117 HB2 LEU 27 2HB LEU 27 -17.609 1.226 -9.637
118 HB3 LEU 27 1HB LEU 27 -16.466 2.513 -9.304
119 HG LEU 27 HG LEU 27 -14.886 0.238 -9.718
120 HD11 LEU 27 1HD1 LEU 27 -15.680 -0.966 -11.456
121 HD12 LEU 27 2HD1 LEU 27 -16.560 0.399 -12.144
122 HD13 LEU 27 3HD1 LEU 27 -17.234 -0.485 -10.775
123 HD21 LEU 27 3HD2 LEU 27 -14.288 1.441 -11.834
124 HD22 LEU 27 1HD2 LEU 27 -14.203 2.423 -10.371
125 HD23 LEU 27 2HD2 LEU 27 -15.573 2.591 -11.466
126 H GLN 28 H GLN 28 -15.828 -0.980 -6.345
127 HA GLN 28 HA GLN 28 -18.053 -2.682 -7.252
128 HB2 GLN 28 2HB GLN 28 -15.198 -3.212 -6.835
129 HB3 GLN 28 1HB GLN 28 -16.253 -4.397 -6.078
130 HG2 GLN 28 2HG GLN 28 -16.959 -3.699 -8.836
131 HG3 GLN 28 1HG GLN 28 -15.402 -4.501 -8.641
132 HE21 GLN 28 1HE2 GLN 28 -15.372 -6.636 -8.416
133 HE22 GLN 28 2HE2 GLN 28 -16.756 -7.636 -8.155
134 H CYS 29 H CYS 29 -16.125 -1.641 -4.485
135 HA CYS 29 HA CYS 29 -17.835 -3.045 -2.611
136 HB2 CYS 29 2HB CYS 29 -15.223 -2.339 -2.495
137 HB3 CYS 29 1HB CYS 29 -15.943 -1.004 -1.604
138 H ASP 30 H ASP 30 -19.708 -2.252 -1.942
139 HA ASP 30 HA ASP 30 -20.652 0.315 -2.551
140 HB2 ASP 30 2HB ASP 30 -21.787 -1.993 -1.620
141 HB3 ASP 30 1HB ASP 30 -21.883 -0.955 -0.201
142 H VAL 31 H VAL 31 -19.149 -0.980 0.356
143 HA VAL 31 HA VAL 31 -19.581 1.250 2.017
144 HB VAL 31 HB VAL 31 -17.553 0.389 3.284
145 HG11 VAL 31 1HG1 VAL 31 -18.763 -1.417 4.244
146 HG12 VAL 31 2HG1 VAL 31 -19.675 -1.681 2.758
147 HG13 VAL 31 3HG1 VAL 31 -19.951 -0.226 3.717
148 HG21 VAL 31 3HG2 VAL 31 -16.599 -1.705 2.685
149 HG22 VAL 31 1HG2 VAL 31 -16.534 -0.682 1.249
150 HG23 VAL 31 2HG2 VAL 31 -17.766 -1.937 1.382
151 H ALA 32 H ALA 32 -17.010 0.468 -0.259
152 HA ALA 32 HA ALA 32 -15.266 2.568 0.427
153 HB1 ALA 32 3HB ALA 32 -14.619 0.628 -0.955
154 HB2 ALA 32 1HB ALA 32 -14.198 2.166 -1.708
155 HB3 ALA 32 2HB ALA 32 -15.605 1.264 -2.273
156 H SER 33 H SER 33 -18.021 2.390 -1.744
157 HA SER 33 HA SER 33 -17.647 4.899 -2.988
158 HB2 SER 33 2HB SER 33 -19.213 2.871 -3.602
159 HB3 SER 33 1HB SER 33 -20.384 3.752 -2.620
160 HG SER 33 HG SER 33 -20.032 4.180 -5.072
161 H LYS 34 H LYS 34 -19.412 3.894 -0.103
162 HA LYS 34 HA LYS 34 -20.702 6.362 0.351
163 HB2 LYS 34 2HB LYS 34 -21.310 5.527 2.478
164 HB3 LYS 34 1HB LYS 34 -21.289 4.138 1.405
165 HG2 LYS 34 2HG LYS 34 -19.811 3.093 2.680
166 HG3 LYS 34 1HG LYS 34 -18.719 4.477 2.655
167 HD2 LYS 34 2HD LYS 34 -19.655 5.409 4.572
168 HD3 LYS 34 1HD LYS 34 -21.148 4.480 4.409
169 HE2 LYS 34 2HE LYS 34 -20.317 2.742 5.548
170 HE3 LYS 34 1HE LYS 34 -18.774 2.810 4.698
171 HZ1 LYS 34 3HZ LYS 34 -18.544 4.952 6.226
172 HZ2 LYS 34 1HZ LYS 34 -18.062 3.413 6.740
173 HZ3 LYS 34 2HZ LYS 34 -19.560 4.035 7.219
174 H ILE 35 H ILE 35 -17.509 5.178 1.146
175 HA ILE 35 HA ILE 35 -16.865 7.221 3.022
176 HB ILE 35 HB ILE 35 -15.019 5.517 1.344
177 HG12 ILE 35 2HG1 ILE 35 -16.543 4.258 2.854
178 HG13 ILE 35 1HG1 ILE 35 -14.849 4.088 3.294
179 HG21 ILE 35 1HG2 ILE 35 -14.445 7.765 2.962
180 HG22 ILE 35 2HG2 ILE 35 -13.313 6.664 2.180
181 HG23 ILE 35 3HG2 ILE 35 -13.869 6.337 3.820
182 HD11 ILE 35 3HD1 ILE 35 -17.034 4.991 4.874
183 HD12 ILE 35 1HD1 ILE 35 -15.854 6.292 4.729
184 HD13 ILE 35 2HD1 ILE 35 -15.358 4.718 5.348
185 H ILE 36 H ILE 36 -16.371 6.843 -0.451
186 HA ILE 36 HA ILE 36 -14.799 9.136 -0.863
187 HB ILE 36 HB ILE 36 -16.723 7.830 -2.793
188 HG12 ILE 36 2HG1 ILE 36 -14.978 6.322 -1.810
189 HG13 ILE 36 1HG1 ILE 36 -14.853 6.518 -3.555
190 HG21 ILE 36 1HG2 ILE 36 -15.425 8.867 -4.547
191 HG22 ILE 36 2HG2 ILE 36 -14.341 9.591 -3.359
192 HG23 ILE 36 3HG2 ILE 36 -16.026 10.106 -3.446
193 HD11 ILE 36 3HD1 ILE 36 -13.241 8.511 -2.401
194 HD12 ILE 36 1HD1 ILE 36 -12.733 7.077 -3.294
195 HD13 ILE 36 2HD1 ILE 36 -12.901 7.010 -1.540
196 H SER 37 H SER 37 -18.261 8.674 -0.603
197 HA SER 37 HA SER 37 -18.863 11.376 -1.443
198 HB2 SER 37 2HB SER 37 -21.219 10.682 -0.663
199 HB3 SER 37 1HB SER 37 -20.536 9.829 -2.048
200 HG SER 37 HG SER 37 -20.729 8.940 0.633
201 H LYS 38 H LYS 38 -18.291 9.656 1.513
202 HA LYS 38 HA LYS 38 -19.579 11.350 3.332
203 HB2 LYS 38 2HB LYS 38 -17.483 9.288 3.451
204 HB3 LYS 38 1HB LYS 38 -17.428 10.470 4.751
205 HG2 LYS 38 2HG LYS 38 -20.065 9.284 4.130
206 HG3 LYS 38 1HG LYS 38 -18.865 8.233 4.884
207 HD2 LYS 38 2HD LYS 38 -19.275 10.945 6.034
208 HD3 LYS 38 1HD LYS 38 -20.516 9.724 6.324
209 HE2 LYS 38 2HE LYS 38 -17.599 9.210 6.836
210 HE3 LYS 38 1HE LYS 38 -18.657 9.923 8.053
211 HZ1 LYS 38 3HZ LYS 38 -20.054 7.970 7.954
212 HZ2 LYS 38 1HZ LYS 38 -18.460 7.515 8.296
213 HZ3 LYS 38 2HZ LYS 38 -19.088 7.292 6.741
214 H LYS 39 H LYS 39 -16.059 11.195 2.977
215 HA LYS 39 HA LYS 39 -15.827 14.038 2.595
216 HB2 LYS 39 2HB LYS 39 -15.881 13.038 5.243
217 HB3 LYS 39 1HB LYS 39 -14.213 13.476 4.901
218 HG2 LYS 39 2HG LYS 39 -15.212 15.690 4.033
219 HG3 LYS 39 1HG LYS 39 -16.647 15.210 4.941
220 HD2 LYS 39 2HD LYS 39 -13.882 15.361 6.131
221 HD3 LYS 39 1HD LYS 39 -15.048 16.684 6.191
222 HE2 LYS 39 2HE LYS 39 -15.564 13.915 7.264
223 HE3 LYS 39 1HE LYS 39 -14.996 15.267 8.244
224 HZ1 LYS 39 3HZ LYS 39 -17.551 15.186 6.728
225 HZ2 LYS 39 1HZ LYS 39 -17.006 16.478 7.677
226 HZ3 LYS 39 2HZ LYS 39 -17.390 15.000 8.402
227 HA PRO 40 HA PRO 40 -12.505 11.674 0.489
228 HB2 PRO 40 2HB PRO 40 -12.342 14.298 -0.898
229 HB3 PRO 40 1HB PRO 40 -12.408 12.668 -1.577
230 HG2 PRO 40 2HG PRO 40 -14.537 14.256 -1.683
231 HG3 PRO 40 1HG PRO 40 -14.715 12.524 -1.347
232 HD2 PRO 40 2HD PRO 40 -14.823 14.842 0.543
233 HD3 PRO 40 1HD PRO 40 -15.827 13.376 0.498
234 H ARG 41 H ARG 41 -10.365 13.203 -0.478
235 HA ARG 41 HA ARG 41 -9.251 15.078 1.182
236 HB2 ARG 41 2HB ARG 41 -9.414 12.757 2.619
237 HB3 ARG 41 1HB ARG 41 -7.819 12.599 1.899
238 HG2 ARG 41 2HG ARG 41 -7.152 13.749 3.697
239 HG3 ARG 41 1HG ARG 41 -7.716 15.151 2.786
240 HD2 ARG 41 2HD ARG 41 -9.980 14.093 4.064
241 HD3 ARG 41 1HD ARG 41 -8.689 14.071 5.265
242 HE ARG 41 HE ARG 41 -8.907 16.557 3.837
243 HH11 ARG 41 1HH1 ARG 41 -10.048 14.716 6.572
244 HH12 ARG 41 2HH1 ARG 41 -10.527 16.116 7.473
245 HH21 ARG 41 1HH2 ARG 41 -9.536 18.400 5.019
246 HH22 ARG 41 2HH2 ARG 41 -10.237 18.206 6.592
247 H THR 42 H THR 42 -6.999 15.378 0.722
248 HA THR 42 HA THR 42 -6.402 14.796 -2.004
249 HB THR 42 HB THR 42 -4.497 16.093 -0.069
250 HG1 THR 42 1HG THR 42 -6.772 17.244 -1.301
251 HG21 THR 42 3HG2 THR 42 -3.727 15.727 -2.379
252 HG22 THR 42 1HG2 THR 42 -3.851 17.434 -1.954
253 HG23 THR 42 2HG2 THR 42 -5.092 16.682 -2.956
254 H ALA 43 H ALA 43 -3.394 14.804 -0.656
255 HA ALA 43 HA ALA 43 -2.705 12.256 -1.479
256 HB1 ALA 43 3HB ALA 43 -1.425 14.194 0.409
257 HB2 ALA 43 1HB ALA 43 -0.928 13.725 -1.217
258 HB3 ALA 43 2HB ALA 43 -0.717 12.603 0.126
259 H GLN 44 H GLN 44 -3.960 13.333 1.613
260 HA GLN 44 HA GLN 44 -3.312 11.098 3.159
261 HB2 GLN 44 2HB GLN 44 -4.833 13.459 3.480
262 HB3 GLN 44 1HB GLN 44 -5.884 12.122 3.925
263 HG2 GLN 44 2HG GLN 44 -4.924 12.500 5.935
264 HG3 GLN 44 1HG GLN 44 -3.738 11.371 5.278
265 HE21 GLN 44 1HE2 GLN 44 -2.701 12.723 7.168
266 HE22 GLN 44 2HE2 GLN 44 -1.738 14.053 6.636
267 H ASP 45 H ASP 45 -6.144 11.742 1.146
268 HA ASP 45 HA ASP 45 -7.445 9.286 1.775
269 HB2 ASP 45 2HB ASP 45 -8.705 11.208 0.916
270 HB3 ASP 45 1HB ASP 45 -7.809 11.132 -0.596
271 H GLU 46 H GLU 46 -5.196 10.353 -0.688
272 HA GLU 46 HA GLU 46 -5.374 8.073 -2.350
273 HB2 GLU 46 2HB GLU 46 -3.336 10.248 -2.004
274 HB3 GLU 46 1HB GLU 46 -3.013 8.885 -3.064
275 HG2 GLU 46 2HG GLU 46 -5.373 10.739 -3.298
276 HG3 GLU 46 1HG GLU 46 -3.897 10.842 -4.256
277 H LYS 47 H LYS 47 -3.279 8.878 0.386
278 HA LYS 47 HA LYS 47 -1.617 6.595 0.137
279 HB2 LYS 47 2HB LYS 47 -0.977 7.069 2.494
280 HB3 LYS 47 1HB LYS 47 -0.854 8.472 1.442
281 HG2 LYS 47 2HG LYS 47 -2.843 9.415 2.333
282 HG3 LYS 47 1HG LYS 47 -3.220 7.935 3.215
283 HD2 LYS 47 2HD LYS 47 -0.652 9.379 3.731
284 HD3 LYS 47 1HD LYS 47 -2.151 9.948 4.470
285 HE2 LYS 47 2HE LYS 47 -2.310 7.313 5.021
286 HE3 LYS 47 1HE LYS 47 -0.559 7.527 5.018
287 HZ1 LYS 47 3HZ LYS 47 -2.400 9.248 6.581
288 HZ2 LYS 47 1HZ LYS 47 -0.714 9.159 6.706
289 HZ3 LYS 47 2HZ LYS 47 -1.672 7.859 7.214
290 H PHE 48 H PHE 48 -4.631 7.231 1.819
291 HA PHE 48 HA PHE 48 -4.767 4.920 3.375
292 HB2 PHE 48 2HB PHE 48 -6.503 7.077 2.679
293 HB3 PHE 48 1HB PHE 48 -7.395 5.571 2.504
294 HD1 PHE 48 1HD PHE 48 -5.631 7.769 4.842
295 HD2 PHE 48 2HD PHE 48 -7.919 4.208 4.409
296 HE1 PHE 48 1HE PHE 48 -5.970 7.695 7.279
297 HE2 PHE 48 2HE PHE 48 -8.262 4.127 6.844
298 HZ PHE 48 HZ PHE 48 -7.287 5.873 8.282
299 H LEU 49 H LEU 49 -5.713 5.493 0.023
300 HA LEU 49 HA LEU 49 -6.966 2.984 -0.375
301 HB2 LEU 49 2HB LEU 49 -5.585 4.283 -2.661
302 HB3 LEU 49 1HB LEU 49 -7.175 3.553 -2.585
303 HG LEU 49 HG LEU 49 -6.375 6.294 -1.631
304 HD11 LEU 49 1HD1 LEU 49 -8.379 5.403 -3.695
305 HD12 LEU 49 2HD1 LEU 49 -6.763 6.015 -4.045
306 HD13 LEU 49 3HD1 LEU 49 -7.957 7.065 -3.284
307 HD21 LEU 49 3HD2 LEU 49 -9.133 5.115 -1.439
308 HD22 LEU 49 1HD2 LEU 49 -8.531 6.614 -0.736
309 HD23 LEU 49 2HD2 LEU 49 -7.992 5.062 -0.097
310 H ARG 50 H ARG 50 -3.683 4.139 -0.934
311 HA ARG 50 HA ARG 50 -2.676 1.775 -2.090
312 HB2 ARG 50 2HB ARG 50 -1.508 3.914 -2.270
313 HB3 ARG 50 1HB ARG 50 -1.231 3.925 -0.534
314 HG2 ARG 50 2HG ARG 50 -0.156 1.521 -1.290
315 HG3 ARG 50 1HG ARG 50 0.227 2.564 -2.658
316 HD2 ARG 50 2HD ARG 50 0.714 3.959 -0.197
317 HD3 ARG 50 1HD ARG 50 1.549 2.407 -0.182
318 HE ARG 50 HE ARG 50 2.002 3.671 -2.649
319 HH11 ARG 50 1HH1 ARG 50 2.841 3.994 0.723
320 HH12 ARG 50 2HH1 ARG 50 4.354 4.770 0.401
321 HH21 ARG 50 1HH2 ARG 50 3.994 4.691 -3.073
322 HH22 ARG 50 2HH2 ARG 50 5.009 5.166 -1.754
323 H GLU 51 H GLU 51 -2.889 2.870 1.248
324 HA GLU 51 HA GLU 51 -1.397 0.702 2.340
325 HB2 GLU 51 2HB GLU 51 -2.175 3.094 3.315
326 HB3 GLU 51 1HB GLU 51 -3.402 2.067 4.042
327 HG2 GLU 51 2HG GLU 51 -1.820 0.826 5.239
328 HG3 GLU 51 1HG GLU 51 -0.484 1.420 4.253
329 H SER 52 H SER 52 -4.762 1.234 1.566
330 HA SER 52 HA SER 52 -5.445 -1.374 2.741
331 HB2 SER 52 2HB SER 52 -7.472 0.614 1.748
332 HB3 SER 52 1HB SER 52 -7.665 -0.655 2.959
333 HG SER 52 HG SER 52 -7.233 0.837 4.361
334 H ALA 53 H ALA 53 -4.012 -1.411 0.376
335 HA ALA 53 HA ALA 53 -6.057 -2.227 -1.589
336 HB1 ALA 53 3HB ALA 53 -4.044 -0.344 -1.922
337 HB2 ALA 53 1HB ALA 53 -4.996 -1.105 -3.195
338 HB3 ALA 53 2HB ALA 53 -3.434 -1.784 -2.737
339 H CYS 54 H CYS 54 -5.618 -4.111 -2.841
340 HA CYS 54 HA CYS 54 -4.028 -6.068 -1.375
341 HB2 CYS 54 2HB CYS 54 -5.184 -7.753 -2.682
342 HB3 CYS 54 1HB CYS 54 -6.354 -6.627 -2.009
343 H GLY 55 H GLY 55 -2.838 -3.955 -3.158
344 HA2 GLY 55 2HA GLY 55 -1.167 -3.778 -4.730
345 HA3 GLY 55 1HA GLY 55 -0.690 -5.367 -4.162
346 H PHE 56 H PHE 56 -0.157 -6.364 -5.994
347 HA PHE 56 HA PHE 56 -0.440 -7.563 -7.908
348 HB2 PHE 56 2HB PHE 56 -3.154 -7.265 -6.901
349 HB3 PHE 56 1HB PHE 56 -3.113 -7.342 -8.659
350 HD1 PHE 56 2HD PHE 56 -2.292 -9.333 -9.797
351 HD2 PHE 56 1HD PHE 56 -2.552 -9.152 -5.553
352 HE1 PHE 56 2HE PHE 56 -2.068 -11.781 -9.683
353 HE2 PHE 56 1HE PHE 56 -2.327 -11.600 -5.431
354 HZ PHE 56 HZ PHE 56 -2.085 -12.917 -7.498
355 H ASP 57 H ASP 57 -2.816 -4.907 -8.178
356 HA ASP 57 HA ASP 57 -1.621 -4.217 -10.766
357 HB2 ASP 57 2HB ASP 57 -4.326 -4.003 -9.603
358 HB3 ASP 57 1HB ASP 57 -3.828 -2.640 -10.599
359 H GLY 58 H GLY 58 -0.880 -2.165 -11.237
360 HA2 GLY 58 2HA GLY 58 -0.375 -0.474 -8.877
361 HA3 GLY 58 1HA GLY 58 0.617 -0.510 -10.325
362 H GLN 59 H GLN 59 -1.490 -0.363 -12.229
363 HA GLN 59 HA GLN 59 -2.012 2.480 -12.082
364 HB2 GLN 59 2HB GLN 59 -2.036 0.401 -14.176
365 HB3 GLN 59 1HB GLN 59 -3.235 1.672 -14.373
366 HG2 GLN 59 2HG GLN 59 -1.589 3.348 -14.493
367 HG3 GLN 59 1HG GLN 59 -0.331 2.263 -13.903
368 HE21 GLN 59 1HE2 GLN 59 -1.652 3.677 -16.593
369 HE22 GLN 59 2HE2 GLN 59 -0.984 2.644 -17.805
370 H THR 60 H THR 60 -4.046 -0.376 -12.757
371 HA THR 60 HA THR 60 -6.499 0.938 -12.451
372 HB THR 60 HB THR 60 -5.868 -1.984 -11.996
373 HG1 THR 60 1HG THR 60 -5.279 -1.231 -14.072
374 HG21 THR 60 3HG2 THR 60 -8.441 -0.516 -12.324
375 HG22 THR 60 1HG2 THR 60 -8.025 -1.828 -11.221
376 HG23 THR 60 2HG2 THR 60 -8.275 -2.162 -12.934
377 HA PRO 61 HA PRO 61 -6.239 1.697 -8.012
378 HB2 PRO 61 2HB PRO 61 -9.111 2.324 -8.461
379 HB3 PRO 61 1HB PRO 61 -7.860 3.281 -7.659
380 HG2 PRO 61 2HG PRO 61 -8.722 3.928 -10.096
381 HG3 PRO 61 1HG PRO 61 -7.011 4.090 -9.657
382 HD2 PRO 61 2HD PRO 61 -8.357 1.998 -11.313
383 HD3 PRO 61 1HD PRO 61 -6.757 2.741 -11.513
384 H LYS 62 H LYS 62 -6.515 0.282 -6.411
385 HA LYS 62 HA LYS 62 -8.838 -1.506 -6.449
386 HB2 LYS 62 2HB LYS 62 -5.999 -2.430 -5.956
387 HB3 LYS 62 1HB LYS 62 -7.443 -3.432 -5.871
388 HG2 LYS 62 2HG LYS 62 -7.384 -2.164 -8.415
389 HG3 LYS 62 1HG LYS 62 -5.803 -2.883 -8.109
390 HD2 LYS 62 2HD LYS 62 -7.431 -4.877 -7.272
391 HD3 LYS 62 1HD LYS 62 -8.417 -4.166 -8.552
392 HE2 LYS 62 2HE LYS 62 -6.271 -4.279 -9.970
393 HE3 LYS 62 1HE LYS 62 -5.687 -5.394 -8.737
394 HZ1 LYS 62 3HZ LYS 62 -7.731 -5.775 -10.765
395 HZ2 LYS 62 1HZ LYS 62 -8.073 -6.441 -9.246
396 HZ3 LYS 62 2HZ LYS 62 -6.671 -6.895 -10.072
397 H VAL 63 H VAL 63 -9.562 -2.163 -4.418
398 HA VAL 63 HA VAL 63 -8.137 -1.070 -2.095
399 HB VAL 63 HB VAL 63 -11.117 -0.790 -2.520
400 HG11 VAL 63 1HG1 VAL 63 -9.310 0.215 -0.323
401 HG12 VAL 63 2HG1 VAL 63 -10.526 -1.052 -0.180
402 HG13 VAL 63 3HG1 VAL 63 -11.020 0.610 -0.499
403 HG21 VAL 63 3HG2 VAL 63 -10.776 1.529 -2.895
404 HG22 VAL 63 1HG2 VAL 63 -9.670 0.671 -3.969
405 HG23 VAL 63 2HG2 VAL 63 -9.063 1.410 -2.487
406 H CYS 64 H CYS 64 -8.586 -2.098 -0.100
407 HA CYS 64 HA CYS 64 -9.511 -4.859 -0.429
408 HB2 CYS 64 2HB CYS 64 -7.526 -3.511 1.308
409 HB3 CYS 64 1HB CYS 64 -8.417 -4.842 2.037
410 H CYS 65 H CYS 65 -11.401 -5.469 0.358
411 HA CYS 65 HA CYS 65 -12.649 -3.848 2.475
412 HB2 CYS 65 2HB CYS 65 -13.803 -5.225 0.073
413 HB3 CYS 65 1HB CYS 65 -14.806 -4.959 1.494
414 HA PRO 66 HA PRO 66 -11.889 -7.561 4.927
415 HB2 PRO 66 2HB PRO 66 -13.953 -6.203 6.602
416 HB3 PRO 66 1HB PRO 66 -12.395 -6.891 7.074
417 HG2 PRO 66 2HG PRO 66 -12.710 -4.254 6.854
418 HG3 PRO 66 1HG PRO 66 -11.206 -5.042 6.343
419 HD2 PRO 66 2HD PRO 66 -13.426 -3.944 4.689
420 HD3 PRO 66 1HD PRO 66 -11.686 -4.004 4.350
Start of MODEL 18
1 H GLN 11 H GLN 11 -10.645 -10.217 -5.507
2 HA GLN 11 HA GLN 11 -9.488 -12.914 -5.470
3 HB2 GLN 11 2HB GLN 11 -8.427 -10.419 -6.510
4 HB3 GLN 11 1HB GLN 11 -7.452 -11.018 -5.176
5 HG2 GLN 11 2HG GLN 11 -7.823 -13.281 -6.640
6 HG3 GLN 11 1HG GLN 11 -7.760 -12.044 -7.896
7 HE21 GLN 11 1HE2 GLN 11 -5.891 -14.231 -6.892
8 HE22 GLN 11 2HE2 GLN 11 -4.371 -13.428 -6.729
9 H ALA 12 H ALA 12 -9.070 -13.581 -3.456
10 HA ALA 12 HA ALA 12 -9.893 -11.984 -1.226
11 HB1 ALA 12 3HB ALA 12 -10.326 -14.318 -1.108
12 HB2 ALA 12 1HB ALA 12 -9.103 -13.958 0.110
13 HB3 ALA 12 2HB ALA 12 -8.635 -14.712 -1.414
14 H CYS 13 H CYS 13 -8.699 -10.547 -0.173
15 HA CYS 13 HA CYS 13 -5.766 -10.855 -0.228
16 HB2 CYS 13 2HB CYS 13 -5.551 -8.442 -0.179
17 HB3 CYS 13 1HB CYS 13 -6.565 -8.909 -1.539
18 H THR 14 H THR 14 -4.670 -9.714 1.622
19 HA THR 14 HA THR 14 -6.141 -10.312 4.093
20 HB THR 14 HB THR 14 -4.117 -11.589 3.896
21 HG1 THR 14 1HG THR 14 -3.568 -9.426 5.638
22 HG21 THR 14 3HG2 THR 14 -3.007 -9.139 2.819
23 HG22 THR 14 1HG2 THR 14 -2.458 -10.806 2.652
24 HG23 THR 14 2HG2 THR 14 -1.989 -9.861 4.064
25 H LEU 15 H LEU 15 -6.965 -8.631 5.120
26 HA LEU 15 HA LEU 15 -6.417 -5.950 4.548
27 HB2 LEU 15 2HB LEU 15 -7.505 -5.591 6.874
28 HB3 LEU 15 1HB LEU 15 -8.463 -6.266 5.570
29 HG LEU 15 HG LEU 15 -7.113 -8.267 7.252
30 HD11 LEU 15 1HD1 LEU 15 -7.601 -6.861 9.067
31 HD12 LEU 15 2HD1 LEU 15 -8.941 -8.005 9.002
32 HD13 LEU 15 3HD1 LEU 15 -9.147 -6.369 8.380
33 HD21 LEU 15 3HD2 LEU 15 -8.943 -8.462 5.381
34 HD22 LEU 15 1HD2 LEU 15 -10.040 -8.124 6.720
35 HD23 LEU 15 2HD2 LEU 15 -8.971 -9.525 6.786
36 HA PRO 16 HA PRO 16 -2.817 -4.649 6.709
37 HB2 PRO 16 2HB PRO 16 -3.869 -2.732 8.465
38 HB3 PRO 16 1HB PRO 16 -3.303 -2.438 6.818
39 HG2 PRO 16 2HG PRO 16 -6.078 -2.858 7.824
40 HG3 PRO 16 1HG PRO 16 -5.498 -1.794 6.529
41 HD2 PRO 16 2HD PRO 16 -6.752 -4.086 5.971
42 HD3 PRO 16 1HD PRO 16 -5.383 -3.529 4.986
43 H ASN 17 H ASN 17 -5.626 -5.563 8.571
44 HA ASN 17 HA ASN 17 -4.100 -5.936 11.008
45 HB2 ASN 17 2HB ASN 17 -6.835 -5.549 10.379
46 HB3 ASN 17 1HB ASN 17 -6.704 -7.128 11.147
47 HD21 ASN 17 1HD2 ASN 17 -6.181 -3.702 11.522
48 HD22 ASN 17 2HD2 ASN 17 -6.065 -3.709 13.245
49 H ASN 18 H ASN 18 -4.692 -7.712 8.215
50 HA ASN 18 HA ASN 18 -4.251 -9.850 7.598
51 HB2 ASN 18 2HB ASN 18 -2.709 -9.581 10.135
52 HB3 ASN 18 1HB ASN 18 -2.924 -11.198 9.473
53 HD21 ASN 18 1HD2 ASN 18 -1.692 -7.983 8.804
54 HD22 ASN 18 2HD2 ASN 18 -0.564 -8.465 7.587
55 H ASP 19 H ASP 19 -6.499 -10.312 7.630
56 HA ASP 19 HA ASP 19 -7.164 -12.448 9.463
57 HB2 ASP 19 2HB ASP 19 -8.306 -9.755 9.720
58 HB3 ASP 19 1HB ASP 19 -9.515 -11.032 9.615
59 H LYS 20 H LYS 20 -6.750 -11.958 6.548
60 HA LYS 20 HA LYS 20 -7.595 -12.709 4.575
61 HB2 LYS 20 2HB LYS 20 -9.685 -14.069 6.284
62 HB3 LYS 20 1HB LYS 20 -9.275 -14.467 4.621
63 HG2 LYS 20 2HG LYS 20 -7.643 -15.814 5.274
64 HG3 LYS 20 1HG LYS 20 -6.930 -14.556 6.284
65 HD2 LYS 20 2HD LYS 20 -9.378 -15.729 7.385
66 HD3 LYS 20 1HD LYS 20 -8.048 -16.877 7.204
67 HE2 LYS 20 2HE LYS 20 -7.286 -14.282 8.344
68 HE3 LYS 20 1HE LYS 20 -8.400 -15.218 9.336
69 HZ1 LYS 20 3HZ LYS 20 -6.498 -16.143 10.060
70 HZ2 LYS 20 1HZ LYS 20 -5.624 -15.745 8.667
71 HZ3 LYS 20 2HZ LYS 20 -6.642 -17.096 8.670
72 H GLY 21 H GLY 21 -8.995 -11.998 3.004
73 HA2 GLY 21 2HA GLY 21 -11.593 -10.982 3.545
74 HA3 GLY 21 1HA GLY 21 -10.436 -9.667 3.426
75 H THR 22 H THR 22 -11.886 -9.072 1.617
76 HA THR 22 HA THR 22 -11.126 -10.498 -0.848
77 HB THR 22 HB THR 22 -13.648 -8.883 -0.430
78 HG1 THR 22 1HG THR 22 -14.690 -10.823 -0.149
79 HG21 THR 22 3HG2 THR 22 -12.458 -10.118 -2.744
80 HG22 THR 22 1HG2 THR 22 -13.861 -9.057 -2.624
81 HG23 THR 22 2HG2 THR 22 -14.048 -10.796 -2.396
82 H CYS 23 H CYS 23 -10.564 -9.261 -2.654
83 HA CYS 23 HA CYS 23 -10.070 -6.411 -2.086
84 HB2 CYS 23 2HB CYS 23 -8.144 -8.272 -2.481
85 HB3 CYS 23 1HB CYS 23 -8.402 -7.734 -4.135
86 H LYS 24 H LYS 24 -11.135 -5.047 -3.324
87 HA LYS 24 HA LYS 24 -11.630 -5.678 -6.128
88 HB2 LYS 24 2HB LYS 24 -14.014 -4.908 -5.889
89 HB3 LYS 24 1HB LYS 24 -13.662 -6.465 -5.151
90 HG2 LYS 24 2HG LYS 24 -13.719 -5.567 -2.977
91 HG3 LYS 24 1HG LYS 24 -13.658 -3.909 -3.579
92 HD2 LYS 24 2HD LYS 24 -15.886 -3.947 -3.300
93 HD3 LYS 24 1HD LYS 24 -15.899 -4.863 -4.809
94 HE2 LYS 24 2HE LYS 24 -15.483 -6.882 -3.135
95 HE3 LYS 24 1HE LYS 24 -16.288 -5.785 -2.013
96 HZ1 LYS 24 3HZ LYS 24 -17.877 -7.237 -3.088
97 HZ2 LYS 24 1HZ LYS 24 -17.373 -6.714 -4.618
98 HZ3 LYS 24 2HZ LYS 24 -18.144 -5.636 -3.566
99 H SER 25 H SER 25 -12.608 -3.712 -7.259
100 HA SER 25 HA SER 25 -10.921 -1.506 -6.889
101 HB2 SER 25 2HB SER 25 -11.949 -1.961 -9.047
102 HB3 SER 25 1HB SER 25 -13.555 -1.690 -8.371
103 HG SER 25 HG SER 25 -11.477 0.229 -8.618
104 H LEU 26 H LEU 26 -12.022 0.813 -6.784
105 HA LEU 26 HA LEU 26 -13.343 0.896 -4.178
106 HB2 LEU 26 2HB LEU 26 -12.658 3.179 -4.044
107 HB3 LEU 26 1HB LEU 26 -11.285 2.231 -4.581
108 HG LEU 26 HG LEU 26 -12.596 3.132 -6.917
109 HD11 LEU 26 1HD1 LEU 26 -13.539 4.801 -5.146
110 HD12 LEU 26 2HD1 LEU 26 -12.945 5.392 -6.699
111 HD13 LEU 26 3HD1 LEU 26 -11.931 5.519 -5.260
112 HD21 LEU 26 3HD2 LEU 26 -10.079 4.196 -5.648
113 HD22 LEU 26 1HD2 LEU 26 -10.504 4.208 -7.360
114 HD23 LEU 26 2HD2 LEU 26 -10.176 2.679 -6.544
115 H LEU 27 H LEU 27 -14.887 0.087 -6.439
116 HA LEU 27 HA LEU 27 -16.860 2.265 -6.466
117 HB2 LEU 27 2HB LEU 27 -16.200 0.506 -8.827
118 HB3 LEU 27 1HB LEU 27 -17.404 1.778 -8.786
119 HG LEU 27 HG LEU 27 -14.638 2.597 -8.131
120 HD11 LEU 27 1HD1 LEU 27 -15.402 1.357 -10.713
121 HD12 LEU 27 2HD1 LEU 27 -13.840 1.408 -9.895
122 HD13 LEU 27 3HD1 LEU 27 -14.426 2.824 -10.767
123 HD21 LEU 27 3HD2 LEU 27 -16.270 3.949 -10.180
124 HD22 LEU 27 1HD2 LEU 27 -15.355 4.619 -8.830
125 HD23 LEU 27 2HD2 LEU 27 -16.949 3.914 -8.553
126 H GLN 28 H GLN 28 -16.727 -0.016 -4.750
127 HA GLN 28 HA GLN 28 -19.364 -1.075 -5.219
128 HB2 GLN 28 2HB GLN 28 -16.956 -2.900 -5.253
129 HB3 GLN 28 1HB GLN 28 -18.610 -3.460 -5.046
130 HG2 GLN 28 2HG GLN 28 -19.067 -2.244 -7.268
131 HG3 GLN 28 1HG GLN 28 -17.314 -2.268 -7.462
132 HE21 GLN 28 1HE2 GLN 28 -19.794 -3.711 -8.653
133 HE22 GLN 28 2HE2 GLN 28 -19.269 -5.354 -8.743
134 H CYS 29 H CYS 29 -16.382 -1.263 -3.326
135 HA CYS 29 HA CYS 29 -17.343 -2.420 -1.008
136 HB2 CYS 29 2HB CYS 29 -15.135 -0.508 -1.625
137 HB3 CYS 29 1HB CYS 29 -15.536 -0.810 0.059
138 H ASP 30 H ASP 30 -18.505 -1.747 0.722
139 HA ASP 30 HA ASP 30 -20.230 0.443 0.493
140 HB2 ASP 30 2HB ASP 30 -19.498 -1.442 2.685
141 HB3 ASP 30 1HB ASP 30 -20.388 0.017 3.113
142 H VAL 31 H VAL 31 -17.211 0.067 2.284
143 HA VAL 31 HA VAL 31 -17.283 2.630 3.503
144 HB VAL 31 HB VAL 31 -14.770 1.081 2.895
145 HG11 VAL 31 1HG1 VAL 31 -15.438 2.810 5.267
146 HG12 VAL 31 2HG1 VAL 31 -14.649 3.419 3.813
147 HG13 VAL 31 3HG1 VAL 31 -13.859 2.182 4.792
148 HG21 VAL 31 3HG2 VAL 31 -15.350 0.308 5.402
149 HG22 VAL 31 1HG2 VAL 31 -15.802 -0.621 3.973
150 HG23 VAL 31 2HG2 VAL 31 -16.981 0.438 4.746
151 H ALA 32 H ALA 32 -15.910 1.382 0.515
152 HA ALA 32 HA ALA 32 -14.478 3.706 -0.210
153 HB1 ALA 32 3HB ALA 32 -13.940 1.642 -1.281
154 HB2 ALA 32 1HB ALA 32 -14.565 2.735 -2.517
155 HB3 ALA 32 2HB ALA 32 -15.591 1.454 -1.872
156 H SER 33 H SER 33 -17.794 2.665 -0.731
157 HA SER 33 HA SER 33 -18.511 4.666 -2.587
158 HB2 SER 33 2HB SER 33 -19.739 2.443 -1.663
159 HB3 SER 33 1HB SER 33 -20.615 3.676 -0.757
160 HG SER 33 HG SER 33 -21.241 4.620 -2.665
161 H LYS 34 H LYS 34 -18.678 4.525 0.937
162 HA LYS 34 HA LYS 34 -20.084 6.945 1.288
163 HB2 LYS 34 2HB LYS 34 -19.468 6.809 3.605
164 HB3 LYS 34 1HB LYS 34 -19.822 5.186 3.035
165 HG2 LYS 34 2HG LYS 34 -17.714 4.469 3.341
166 HG3 LYS 34 1HG LYS 34 -16.998 6.013 2.887
167 HD2 LYS 34 2HD LYS 34 -17.377 6.932 5.025
168 HD3 LYS 34 1HD LYS 34 -18.476 5.626 5.473
169 HE2 LYS 34 2HE LYS 34 -16.794 4.205 5.995
170 HE3 LYS 34 1HE LYS 34 -15.735 4.826 4.728
171 HZ1 LYS 34 3HZ LYS 34 -14.902 5.330 6.951
172 HZ2 LYS 34 1HZ LYS 34 -16.313 6.197 7.300
173 HZ3 LYS 34 2HZ LYS 34 -15.259 6.746 6.096
174 H ILE 35 H ILE 35 -16.692 6.222 0.828
175 HA ILE 35 HA ILE 35 -15.709 8.775 1.616
176 HB ILE 35 HB ILE 35 -14.409 6.795 -0.258
177 HG12 ILE 35 2HG1 ILE 35 -13.664 7.022 2.621
178 HG13 ILE 35 1HG1 ILE 35 -15.139 6.147 2.218
179 HG21 ILE 35 1HG2 ILE 35 -13.653 9.366 0.273
180 HG22 ILE 35 2HG2 ILE 35 -12.571 8.075 -0.247
181 HG23 ILE 35 3HG2 ILE 35 -12.730 8.455 1.468
182 HD11 ILE 35 3HD1 ILE 35 -13.848 4.368 1.932
183 HD12 ILE 35 1HD1 ILE 35 -12.376 5.340 1.969
184 HD13 ILE 35 2HD1 ILE 35 -13.263 5.140 0.457
185 H ILE 36 H ILE 36 -16.752 7.389 -1.447
186 HA ILE 36 HA ILE 36 -15.880 9.508 -3.101
187 HB ILE 36 HB ILE 36 -18.139 7.554 -3.558
188 HG12 ILE 36 2HG1 ILE 36 -15.862 6.567 -3.174
189 HG13 ILE 36 1HG1 ILE 36 -16.549 6.210 -4.754
190 HG21 ILE 36 1HG2 ILE 36 -18.388 9.452 -5.019
191 HG22 ILE 36 2HG2 ILE 36 -17.794 8.080 -5.954
192 HG23 ILE 36 3HG2 ILE 36 -16.686 9.368 -5.480
193 HD11 ILE 36 3HD1 ILE 36 -14.812 7.120 -5.777
194 HD12 ILE 36 1HD1 ILE 36 -14.039 7.267 -4.200
195 HD13 ILE 36 2HD1 ILE 36 -14.974 8.612 -4.851
196 H SER 37 H SER 37 -18.811 8.956 -1.256
197 HA SER 37 HA SER 37 -20.211 11.193 -2.398
198 HB2 SER 37 2HB SER 37 -20.769 9.149 -0.313
199 HB3 SER 37 1HB SER 37 -21.642 10.676 -0.187
200 HG SER 37 HG SER 37 -22.791 9.200 -1.467
201 H LYS 38 H LYS 38 -17.959 10.722 0.165
202 HA LYS 38 HA LYS 38 -18.692 13.181 1.524
203 HB2 LYS 38 2HB LYS 38 -16.869 10.904 2.073
204 HB3 LYS 38 1HB LYS 38 -16.425 12.461 2.759
205 HG2 LYS 38 2HG LYS 38 -19.058 12.316 3.421
206 HG3 LYS 38 1HG LYS 38 -18.578 10.618 3.495
207 HD2 LYS 38 2HD LYS 38 -16.851 12.685 4.785
208 HD3 LYS 38 1HD LYS 38 -18.331 12.168 5.595
209 HE2 LYS 38 2HE LYS 38 -17.527 9.800 5.314
210 HE3 LYS 38 1HE LYS 38 -15.985 10.466 4.777
211 HZ1 LYS 38 3HZ LYS 38 -16.490 9.874 7.299
212 HZ2 LYS 38 1HZ LYS 38 -17.036 11.475 7.300
213 HZ3 LYS 38 2HZ LYS 38 -15.444 11.125 6.853
214 H LYS 39 H LYS 39 -15.717 11.894 0.060
215 HA LYS 39 HA LYS 39 -15.134 14.084 -1.540
216 HB2 LYS 39 2HB LYS 39 -13.204 15.025 -0.118
217 HB3 LYS 39 1HB LYS 39 -14.841 15.532 0.263
218 HG2 LYS 39 2HG LYS 39 -14.500 14.908 2.357
219 HG3 LYS 39 1HG LYS 39 -14.370 13.238 1.804
220 HD2 LYS 39 2HD LYS 39 -12.116 13.219 1.977
221 HD3 LYS 39 1HD LYS 39 -11.958 14.897 1.449
222 HE2 LYS 39 2HE LYS 39 -12.276 15.734 3.576
223 HE3 LYS 39 1HE LYS 39 -13.145 14.301 4.123
224 HZ1 LYS 39 3HZ LYS 39 -10.619 14.813 4.757
225 HZ2 LYS 39 1HZ LYS 39 -10.372 13.893 3.358
226 HZ3 LYS 39 2HZ LYS 39 -11.245 13.246 4.654
227 HA PRO 40 HA PRO 40 -12.314 10.518 -2.009
228 HB2 PRO 40 2HB PRO 40 -12.817 9.991 -4.588
229 HB3 PRO 40 1HB PRO 40 -13.916 9.464 -3.308
230 HG2 PRO 40 2HG PRO 40 -14.150 11.788 -5.169
231 HG3 PRO 40 1HG PRO 40 -15.408 10.680 -4.596
232 HD2 PRO 40 2HD PRO 40 -14.934 13.207 -3.569
233 HD3 PRO 40 1HD PRO 40 -15.778 11.904 -2.709
234 H ARG 41 H ARG 41 -10.984 12.683 -1.720
235 HA ARG 41 HA ARG 41 -8.976 12.687 -3.676
236 HB2 ARG 41 2HB ARG 41 -11.171 14.233 -4.445
237 HB3 ARG 41 1HB ARG 41 -9.996 15.399 -3.854
238 HG2 ARG 41 2HG ARG 41 -8.578 15.047 -5.569
239 HG3 ARG 41 1HG ARG 41 -8.947 13.323 -5.662
240 HD2 ARG 41 2HD ARG 41 -10.579 13.629 -7.180
241 HD3 ARG 41 1HD ARG 41 -11.164 15.098 -6.402
242 HE ARG 41 HE ARG 41 -9.848 16.335 -7.815
243 HH11 ARG 41 1HH1 ARG 41 -8.862 12.991 -7.974
244 HH12 ARG 41 2HH1 ARG 41 -7.802 13.236 -9.320
245 HH21 ARG 41 1HH2 ARG 41 -8.455 16.660 -9.587
246 HH22 ARG 41 2HH2 ARG 41 -7.571 15.320 -10.237
247 H THR 42 H THR 42 -7.836 12.455 -1.698
248 HA THR 42 HA THR 42 -6.886 14.939 -0.639
249 HB THR 42 HB THR 42 -8.066 13.114 1.431
250 HG1 THR 42 1HG THR 42 -9.424 15.276 0.200
251 HG21 THR 42 3HG2 THR 42 -7.528 14.691 2.890
252 HG22 THR 42 1HG2 THR 42 -8.214 15.965 1.882
253 HG23 THR 42 2HG2 THR 42 -6.561 15.418 1.608
254 H ALA 43 H ALA 43 -4.972 14.709 0.583
255 HA ALA 43 HA ALA 43 -3.292 12.616 -0.170
256 HB1 ALA 43 3HB ALA 43 -1.666 13.767 0.889
257 HB2 ALA 43 1HB ALA 43 -2.620 13.975 2.357
258 HB3 ALA 43 2HB ALA 43 -2.898 15.026 0.969
259 H GLN 44 H GLN 44 -5.369 12.983 2.624
260 HA GLN 44 HA GLN 44 -4.275 10.808 4.107
261 HB2 GLN 44 2HB GLN 44 -5.941 12.838 4.737
262 HB3 GLN 44 1HB GLN 44 -7.112 11.542 4.533
263 HG2 GLN 44 2HG GLN 44 -6.690 11.026 6.650
264 HG3 GLN 44 1HG GLN 44 -5.161 10.369 6.067
265 HE21 GLN 44 1HE2 GLN 44 -5.121 11.100 8.575
266 HE22 GLN 44 2HE2 GLN 44 -4.305 12.605 8.811
267 H ASP 45 H ASP 45 -6.732 11.122 1.646
268 HA ASP 45 HA ASP 45 -7.928 8.572 2.035
269 HB2 ASP 45 2HB ASP 45 -8.507 10.803 0.513
270 HB3 ASP 45 1HB ASP 45 -8.050 9.611 -0.699
271 H GLU 46 H GLU 46 -5.249 9.755 0.097
272 HA GLU 46 HA GLU 46 -4.908 7.430 -1.476
273 HB2 GLU 46 2HB GLU 46 -3.907 9.860 -1.703
274 HB3 GLU 46 1HB GLU 46 -2.586 9.168 -0.772
275 HG2 GLU 46 2HG GLU 46 -3.524 7.657 -3.139
276 HG3 GLU 46 1HG GLU 46 -2.633 9.153 -3.423
277 H LYS 47 H LYS 47 -3.517 8.474 1.592
278 HA LYS 47 HA LYS 47 -1.719 6.295 1.834
279 HB2 LYS 47 2HB LYS 47 -1.577 6.964 4.223
280 HB3 LYS 47 1HB LYS 47 -1.339 8.308 3.115
281 HG2 LYS 47 2HG LYS 47 -3.564 9.107 3.518
282 HG3 LYS 47 1HG LYS 47 -3.942 7.685 4.493
283 HD2 LYS 47 2HD LYS 47 -1.595 9.318 5.294
284 HD3 LYS 47 1HD LYS 47 -3.199 9.999 5.578
285 HE2 LYS 47 2HE LYS 47 -3.389 7.360 6.441
286 HE3 LYS 47 1HE LYS 47 -1.803 7.897 6.995
287 HZ1 LYS 47 3HZ LYS 47 -3.237 8.486 8.704
288 HZ2 LYS 47 1HZ LYS 47 -4.456 9.012 7.656
289 HZ3 LYS 47 2HZ LYS 47 -3.052 9.933 7.851
290 H PHE 48 H PHE 48 -5.042 6.825 2.838
291 HA PHE 48 HA PHE 48 -5.232 4.469 4.408
292 HB2 PHE 48 2HB PHE 48 -6.778 6.365 4.694
293 HB3 PHE 48 1HB PHE 48 -7.432 6.068 3.086
294 HD1 PHE 48 1HD PHE 48 -6.781 4.159 6.230
295 HD2 PHE 48 2HD PHE 48 -9.419 4.938 2.982
296 HE1 PHE 48 1HE PHE 48 -8.420 2.596 7.192
297 HE2 PHE 48 2HE PHE 48 -11.065 3.379 3.939
298 HZ PHE 48 HZ PHE 48 -10.566 2.207 6.047
299 H LEU 49 H LEU 49 -6.020 5.227 1.046
300 HA LEU 49 HA LEU 49 -7.098 2.638 0.515
301 HB2 LEU 49 2HB LEU 49 -6.994 3.293 -1.854
302 HB3 LEU 49 1HB LEU 49 -7.790 4.493 -0.856
303 HG LEU 49 HG LEU 49 -5.459 5.650 -0.823
304 HD11 LEU 49 1HD1 LEU 49 -4.873 4.838 -3.495
305 HD12 LEU 49 2HD1 LEU 49 -4.885 3.418 -2.450
306 HD13 LEU 49 3HD1 LEU 49 -3.840 4.786 -2.066
307 HD21 LEU 49 3HD2 LEU 49 -7.316 6.721 -1.822
308 HD22 LEU 49 1HD2 LEU 49 -7.343 5.578 -3.166
309 HD23 LEU 49 2HD2 LEU 49 -6.028 6.744 -3.026
310 H ARG 50 H ARG 50 -3.938 4.154 0.086
311 HA ARG 50 HA ARG 50 -2.781 1.962 -1.304
312 HB2 ARG 50 2HB ARG 50 -0.694 3.057 -1.045
313 HB3 ARG 50 1HB ARG 50 -1.888 4.328 -1.254
314 HG2 ARG 50 2HG ARG 50 -0.601 5.157 0.454
315 HG3 ARG 50 1HG ARG 50 -1.911 4.375 1.337
316 HD2 ARG 50 2HD ARG 50 -0.507 2.954 2.324
317 HD3 ARG 50 1HD ARG 50 0.239 2.524 0.785
318 HE ARG 50 HE ARG 50 1.214 4.415 2.722
319 HH11 ARG 50 1HH1 ARG 50 1.302 3.430 -0.626
320 HH12 ARG 50 2HH1 ARG 50 2.845 4.154 -0.928
321 HH21 ARG 50 1HH2 ARG 50 3.244 5.369 2.325
322 HH22 ARG 50 2HH2 ARG 50 3.948 5.256 0.747
323 H GLU 51 H GLU 51 -3.167 2.772 2.084
324 HA GLU 51 HA GLU 51 -1.401 0.751 3.061
325 HB2 GLU 51 2HB GLU 51 -1.958 2.740 4.388
326 HB3 GLU 51 1HB GLU 51 -3.638 2.226 4.461
327 HG2 GLU 51 2HG GLU 51 -2.782 1.583 6.511
328 HG3 GLU 51 1HG GLU 51 -2.734 0.098 5.562
329 H SER 52 H SER 52 -4.844 0.945 2.395
330 HA SER 52 HA SER 52 -5.174 -1.840 3.263
331 HB2 SER 52 2HB SER 52 -7.434 -0.028 2.456
332 HB3 SER 52 1HB SER 52 -7.467 -1.423 3.532
333 HG SER 52 HG SER 52 -6.463 1.169 4.026
334 H ALA 53 H ALA 53 -3.774 -1.379 0.882
335 HA ALA 53 HA ALA 53 -5.699 -2.353 -1.131
336 HB1 ALA 53 3HB ALA 53 -3.381 -0.481 -1.398
337 HB2 ALA 53 1HB ALA 53 -5.026 -0.323 -2.013
338 HB3 ALA 53 2HB ALA 53 -3.904 -1.452 -2.775
339 H CYS 54 H CYS 54 -5.139 -4.133 -2.342
340 HA CYS 54 HA CYS 54 -2.919 -5.711 -1.286
341 HB2 CYS 54 2HB CYS 54 -3.967 -7.599 -2.463
342 HB3 CYS 54 1HB CYS 54 -5.108 -6.792 -1.395
343 H GLY 55 H GLY 55 -2.434 -3.445 -3.089
344 HA2 GLY 55 2HA GLY 55 -1.112 -2.940 -4.898
345 HA3 GLY 55 1HA GLY 55 -0.452 -4.555 -4.707
346 H PHE 56 H PHE 56 -0.304 -5.153 -6.799
347 HA PHE 56 HA PHE 56 -0.951 -5.960 -8.823
348 HB2 PHE 56 2HB PHE 56 -3.491 -6.181 -7.249
349 HB3 PHE 56 1HB PHE 56 -3.513 -6.506 -8.978
350 HD1 PHE 56 1HD PHE 56 -1.605 -7.431 -5.913
351 HD2 PHE 56 2HD PHE 56 -3.106 -8.648 -9.705
352 HE1 PHE 56 1HE PHE 56 -0.810 -9.720 -5.488
353 HE2 PHE 56 2HE PHE 56 -2.316 -10.940 -9.285
354 HZ PHE 56 HZ PHE 56 -1.166 -11.478 -7.175
355 H ASP 57 H ASP 57 -2.400 -5.482 -10.749
356 HA ASP 57 HA ASP 57 -3.218 -4.014 -12.278
357 HB2 ASP 57 2HB ASP 57 -4.332 -3.039 -9.727
358 HB3 ASP 57 1HB ASP 57 -4.279 -1.844 -11.019
359 H GLY 58 H GLY 58 -2.344 -1.650 -9.773
360 HA2 GLY 58 2HA GLY 58 -0.418 -0.300 -9.697
361 HA3 GLY 58 1HA GLY 58 0.015 -0.867 -11.303
362 H GLN 59 H GLN 59 -2.164 -0.295 -12.800
363 HA GLN 59 HA GLN 59 -2.018 2.594 -12.937
364 HB2 GLN 59 2HB GLN 59 -2.333 0.507 -14.806
365 HB3 GLN 59 1HB GLN 59 -3.818 1.446 -14.869
366 HG2 GLN 59 2HG GLN 59 -2.149 2.212 -16.488
367 HG3 GLN 59 1HG GLN 59 -2.576 3.461 -15.319
368 HE21 GLN 59 1HE2 GLN 59 -0.959 4.520 -14.431
369 HE22 GLN 59 2HE2 GLN 59 0.678 3.976 -14.323
370 H THR 60 H THR 60 -4.382 0.110 -12.199
371 HA THR 60 HA THR 60 -6.442 2.158 -11.800
372 HB THR 60 HB THR 60 -7.105 -0.704 -11.417
373 HG1 THR 60 1HG THR 60 -6.407 0.379 -13.941
374 HG21 THR 60 3HG2 THR 60 -8.396 1.663 -12.702
375 HG22 THR 60 1HG2 THR 60 -8.983 0.645 -11.388
376 HG23 THR 60 2HG2 THR 60 -8.959 0.025 -13.038
377 HA PRO 61 HA PRO 61 -5.878 1.906 -7.411
378 HB2 PRO 61 2HB PRO 61 -8.210 2.990 -6.588
379 HB3 PRO 61 1HB PRO 61 -6.937 3.954 -7.346
380 HG2 PRO 61 2HG PRO 61 -9.437 2.834 -8.554
381 HG3 PRO 61 1HG PRO 61 -8.716 4.442 -8.763
382 HD2 PRO 61 2HD PRO 61 -8.424 2.436 -10.579
383 HD3 PRO 61 1HD PRO 61 -7.202 3.696 -10.324
384 H LYS 62 H LYS 62 -6.260 0.455 -5.820
385 HA LYS 62 HA LYS 62 -8.705 -1.157 -5.924
386 HB2 LYS 62 2HB LYS 62 -5.883 -2.157 -6.055
387 HB3 LYS 62 1HB LYS 62 -7.121 -3.138 -5.284
388 HG2 LYS 62 2HG LYS 62 -8.357 -2.507 -7.605
389 HG3 LYS 62 1HG LYS 62 -6.671 -2.549 -8.124
390 HD2 LYS 62 2HD LYS 62 -6.512 -4.782 -7.850
391 HD3 LYS 62 1HD LYS 62 -7.498 -4.773 -6.386
392 HE2 LYS 62 2HE LYS 62 -9.476 -4.945 -7.555
393 HE3 LYS 62 1HE LYS 62 -8.792 -4.241 -9.020
394 HZ1 LYS 62 3HZ LYS 62 -7.472 -6.308 -9.269
395 HZ2 LYS 62 1HZ LYS 62 -9.142 -6.556 -9.384
396 HZ3 LYS 62 2HZ LYS 62 -8.320 -6.975 -7.966
397 H VAL 63 H VAL 63 -9.235 -2.209 -3.927
398 HA VAL 63 HA VAL 63 -7.725 -1.377 -1.568
399 HB VAL 63 HB VAL 63 -10.697 -0.894 -1.772
400 HG11 VAL 63 1HG1 VAL 63 -10.251 0.437 0.313
401 HG12 VAL 63 2HG1 VAL 63 -8.640 -0.279 0.338
402 HG13 VAL 63 3HG1 VAL 63 -10.065 -1.309 0.481
403 HG21 VAL 63 3HG2 VAL 63 -8.380 0.993 -2.110
404 HG22 VAL 63 1HG2 VAL 63 -10.003 1.541 -1.691
405 HG23 VAL 63 2HG2 VAL 63 -9.723 0.700 -3.216
406 H CYS 64 H CYS 64 -8.362 -2.526 0.382
407 HA CYS 64 HA CYS 64 -9.353 -5.211 -0.257
408 HB2 CYS 64 2HB CYS 64 -7.481 -4.109 1.782
409 HB3 CYS 64 1HB CYS 64 -8.402 -5.547 2.206
410 H CYS 65 H CYS 65 -11.203 -5.973 0.539
411 HA CYS 65 HA CYS 65 -12.529 -4.491 2.705
412 HB2 CYS 65 2HB CYS 65 -13.521 -5.170 -0.002
413 HB3 CYS 65 1HB CYS 65 -14.654 -5.423 1.321
414 HA PRO 66 HA PRO 66 -12.271 -8.570 4.604
415 HB2 PRO 66 2HB PRO 66 -14.389 -7.303 6.284
416 HB3 PRO 66 1HB PRO 66 -12.943 -8.195 6.777
417 HG2 PRO 66 2HG PRO 66 -13.019 -5.543 6.953
418 HG3 PRO 66 1HG PRO 66 -11.543 -6.377 6.433
419 HD2 PRO 66 2HD PRO 66 -13.528 -4.850 4.817
420 HD3 PRO 66 1HD PRO 66 -11.773 -4.998 4.606
Start of MODEL 19
1 H GLN 11 H GLN 11 -12.228 -11.421 -4.577
2 HA GLN 11 HA GLN 11 -10.591 -13.258 -4.607
3 HB2 GLN 11 2HB GLN 11 -9.116 -12.064 -6.250
4 HB3 GLN 11 1HB GLN 11 -8.677 -10.944 -4.968
5 HG2 GLN 11 2HG GLN 11 -6.934 -12.398 -4.843
6 HG3 GLN 11 1HG GLN 11 -8.042 -13.151 -3.698
7 HE21 GLN 11 1HE2 GLN 11 -7.709 -13.139 -7.234
8 HE22 GLN 11 2HE2 GLN 11 -7.726 -14.857 -7.412
9 H ALA 12 H ALA 12 -9.627 -13.738 -2.597
10 HA ALA 12 HA ALA 12 -10.435 -11.932 -0.468
11 HB1 ALA 12 3HB ALA 12 -9.401 -14.021 0.858
12 HB2 ALA 12 1HB ALA 12 -9.778 -14.805 -0.677
13 HB3 ALA 12 2HB ALA 12 -11.051 -13.994 0.234
14 H CYS 13 H CYS 13 -9.082 -10.482 0.354
15 HA CYS 13 HA CYS 13 -6.189 -11.021 0.208
16 HB2 CYS 13 2HB CYS 13 -5.796 -8.675 0.027
17 HB3 CYS 13 1HB CYS 13 -7.072 -9.063 -1.122
18 H THR 14 H THR 14 -4.913 -9.867 1.930
19 HA THR 14 HA THR 14 -6.317 -10.094 4.510
20 HB THR 14 HB THR 14 -4.586 -11.777 4.285
21 HG1 THR 14 1HG THR 14 -3.668 -9.679 5.955
22 HG21 THR 14 3HG2 THR 14 -2.569 -9.578 3.940
23 HG22 THR 14 1HG2 THR 14 -3.190 -10.560 2.613
24 HG23 THR 14 2HG2 THR 14 -2.290 -11.319 3.924
25 H LEU 15 H LEU 15 -6.721 -8.196 5.410
26 HA LEU 15 HA LEU 15 -5.491 -5.780 4.568
27 HB2 LEU 15 2HB LEU 15 -6.698 -4.841 6.615
28 HB3 LEU 15 1HB LEU 15 -7.679 -5.543 5.343
29 HG LEU 15 HG LEU 15 -6.939 -7.447 7.449
30 HD11 LEU 15 1HD1 LEU 15 -8.409 -6.577 9.139
31 HD12 LEU 15 2HD1 LEU 15 -8.820 -5.193 8.127
32 HD13 LEU 15 3HD1 LEU 15 -7.186 -5.362 8.767
33 HD21 LEU 15 3HD2 LEU 15 -9.621 -7.478 7.280
34 HD22 LEU 15 1HD2 LEU 15 -8.564 -8.344 6.166
35 HD23 LEU 15 2HD2 LEU 15 -9.225 -6.773 5.713
36 HA PRO 16 HA PRO 16 -1.894 -5.148 7.014
37 HB2 PRO 16 2HB PRO 16 -3.308 -2.870 8.332
38 HB3 PRO 16 1HB PRO 16 -1.704 -2.920 7.590
39 HG2 PRO 16 2HG PRO 16 -3.754 -1.793 6.318
40 HG3 PRO 16 1HG PRO 16 -2.548 -2.750 5.437
41 HD2 PRO 16 2HD PRO 16 -5.343 -3.447 6.181
42 HD3 PRO 16 1HD PRO 16 -4.391 -3.942 4.768
43 H ASN 17 H ASN 17 -5.002 -5.167 8.633
44 HA ASN 17 HA ASN 17 -3.876 -5.636 11.249
45 HB2 ASN 17 2HB ASN 17 -6.190 -4.537 10.523
46 HB3 ASN 17 1HB ASN 17 -6.745 -6.201 10.669
47 HD21 ASN 17 1HD2 ASN 17 -8.001 -4.779 12.326
48 HD22 ASN 17 2HD2 ASN 17 -7.367 -4.818 13.932
49 H ASN 18 H ASN 18 -4.709 -7.546 8.541
50 HA ASN 18 HA ASN 18 -4.644 -9.777 8.138
51 HB2 ASN 18 2HB ASN 18 -3.286 -9.802 10.839
52 HB3 ASN 18 1HB ASN 18 -3.448 -11.225 9.814
53 HD21 ASN 18 1HD2 ASN 18 -2.238 -7.903 9.802
54 HD22 ASN 18 2HD2 ASN 18 -0.902 -8.208 8.749
55 H ASP 19 H ASP 19 -6.947 -9.800 8.187
56 HA ASP 19 HA ASP 19 -7.981 -11.581 10.227
57 HB2 ASP 19 2HB ASP 19 -8.357 -8.911 10.643
58 HB3 ASP 19 1HB ASP 19 -9.808 -9.322 9.733
59 H LYS 20 H LYS 20 -7.441 -11.488 7.271
60 HA LYS 20 HA LYS 20 -8.357 -12.332 5.372
61 HB2 LYS 20 2HB LYS 20 -10.700 -13.195 7.059
62 HB3 LYS 20 1HB LYS 20 -10.143 -13.906 5.551
63 HG2 LYS 20 2HG LYS 20 -8.385 -14.995 6.552
64 HG3 LYS 20 1HG LYS 20 -8.315 -13.866 7.905
65 HD2 LYS 20 2HD LYS 20 -10.628 -14.798 8.534
66 HD3 LYS 20 1HD LYS 20 -10.238 -16.120 7.433
67 HE2 LYS 20 2HE LYS 20 -8.226 -15.353 9.484
68 HE3 LYS 20 1HE LYS 20 -9.658 -16.235 10.013
69 HZ1 LYS 20 3HZ LYS 20 -8.288 -17.960 9.509
70 HZ2 LYS 20 1HZ LYS 20 -7.460 -17.118 8.296
71 HZ3 LYS 20 2HZ LYS 20 -8.999 -17.748 7.989
72 H GLY 21 H GLY 21 -9.400 -11.398 3.717
73 HA2 GLY 21 2HA GLY 21 -11.934 -10.076 4.048
74 HA3 GLY 21 1HA GLY 21 -10.599 -8.953 3.833
75 H THR 22 H THR 22 -12.185 -8.526 1.954
76 HA THR 22 HA THR 22 -11.373 -10.175 -0.352
77 HB THR 22 HB THR 22 -13.883 -8.505 -0.198
78 HG1 THR 22 1HG THR 22 -13.499 -11.227 0.480
79 HG21 THR 22 3HG2 THR 22 -13.217 -9.117 -2.449
80 HG22 THR 22 1HG2 THR 22 -14.680 -9.977 -1.967
81 HG23 THR 22 2HG2 THR 22 -13.127 -10.813 -1.974
82 H CYS 23 H CYS 23 -10.762 -9.101 -2.259
83 HA CYS 23 HA CYS 23 -10.341 -6.205 -1.938
84 HB2 CYS 23 2HB CYS 23 -8.242 -6.333 -2.974
85 HB3 CYS 23 1HB CYS 23 -8.275 -7.719 -1.897
86 H LYS 24 H LYS 24 -11.245 -4.929 -3.385
87 HA LYS 24 HA LYS 24 -11.745 -5.885 -6.093
88 HB2 LYS 24 2HB LYS 24 -14.093 -4.978 -5.985
89 HB3 LYS 24 1HB LYS 24 -13.820 -6.450 -5.063
90 HG2 LYS 24 2HG LYS 24 -13.533 -5.007 -3.032
91 HG3 LYS 24 1HG LYS 24 -14.081 -3.646 -4.014
92 HD2 LYS 24 2HD LYS 24 -16.115 -4.250 -3.240
93 HD3 LYS 24 1HD LYS 24 -16.028 -5.439 -4.541
94 HE2 LYS 24 2HE LYS 24 -14.921 -6.076 -1.837
95 HE3 LYS 24 1HE LYS 24 -16.653 -6.207 -2.139
96 HZ1 LYS 24 3HZ LYS 24 -15.648 -8.321 -2.522
97 HZ2 LYS 24 1HZ LYS 24 -14.481 -7.657 -3.552
98 HZ3 LYS 24 2HZ LYS 24 -16.106 -7.694 -4.023
99 H SER 25 H SER 25 -12.621 -4.037 -7.477
100 HA SER 25 HA SER 25 -10.836 -1.909 -7.451
101 HB2 SER 25 2HB SER 25 -13.586 -1.706 -8.672
102 HB3 SER 25 1HB SER 25 -12.076 -0.994 -9.244
103 HG SER 25 HG SER 25 -11.382 -3.275 -9.499
104 H LEU 26 H LEU 26 -11.968 0.476 -7.655
105 HA LEU 26 HA LEU 26 -12.944 0.978 -4.942
106 HB2 LEU 26 2HB LEU 26 -12.321 3.303 -5.338
107 HB3 LEU 26 1HB LEU 26 -10.972 2.221 -5.632
108 HG LEU 26 HG LEU 26 -11.949 2.417 -8.139
109 HD11 LEU 26 1HD1 LEU 26 -13.452 4.043 -8.315
110 HD12 LEU 26 2HD1 LEU 26 -12.150 5.180 -7.969
111 HD13 LEU 26 3HD1 LEU 26 -13.167 4.581 -6.659
112 HD21 LEU 26 3HD2 LEU 26 -10.123 3.871 -8.600
113 HD22 LEU 26 1HD2 LEU 26 -9.628 2.817 -7.276
114 HD23 LEU 26 2HD2 LEU 26 -10.110 4.480 -6.944
115 H LEU 27 H LEU 27 -14.695 -0.095 -6.993
116 HA LEU 27 HA LEU 27 -16.788 1.923 -6.815
117 HB2 LEU 27 2HB LEU 27 -16.109 0.573 -9.427
118 HB3 LEU 27 1HB LEU 27 -17.405 1.721 -9.153
119 HG LEU 27 HG LEU 27 -14.502 2.437 -8.793
120 HD11 LEU 27 1HD1 LEU 27 -15.320 1.645 -11.158
121 HD12 LEU 27 2HD1 LEU 27 -14.309 3.081 -10.981
122 HD13 LEU 27 3HD1 LEU 27 -16.050 3.250 -11.202
123 HD21 LEU 27 3HD2 LEU 27 -16.968 4.122 -9.207
124 HD22 LEU 27 1HD2 LEU 27 -15.324 4.716 -8.976
125 HD23 LEU 27 2HD2 LEU 27 -16.147 3.868 -7.667
126 H GLN 28 H GLN 28 -16.205 -0.682 -5.575
127 HA GLN 28 HA GLN 28 -18.640 -2.103 -6.430
128 HB2 GLN 28 2HB GLN 28 -16.105 -3.369 -5.377
129 HB3 GLN 28 1HB GLN 28 -17.566 -4.220 -5.857
130 HG2 GLN 28 2HG GLN 28 -16.650 -2.542 -7.996
131 HG3 GLN 28 1HG GLN 28 -15.350 -3.593 -7.440
132 HE21 GLN 28 1HE2 GLN 28 -18.850 -4.091 -7.640
133 HE22 GLN 28 2HE2 GLN 28 -18.769 -5.482 -8.661
134 H CYS 29 H CYS 29 -16.356 -1.699 -3.724
135 HA CYS 29 HA CYS 29 -18.109 -2.687 -1.744
136 HB2 CYS 29 2HB CYS 29 -15.465 -1.957 -1.810
137 HB3 CYS 29 1HB CYS 29 -16.172 -0.670 -0.840
138 H ASP 30 H ASP 30 -19.913 -1.817 -0.995
139 HA ASP 30 HA ASP 30 -20.870 0.709 -1.714
140 HB2 ASP 30 2HB ASP 30 -21.681 -1.376 0.249
141 HB3 ASP 30 1HB ASP 30 -22.378 0.231 0.432
142 H VAL 31 H VAL 31 -19.140 -0.375 1.151
143 HA VAL 31 HA VAL 31 -19.445 1.966 2.682
144 HB VAL 31 HB VAL 31 -17.467 1.193 3.948
145 HG11 VAL 31 1HG1 VAL 31 -18.514 -0.648 4.924
146 HG12 VAL 31 2HG1 VAL 31 -19.201 -1.187 3.392
147 HG13 VAL 31 3HG1 VAL 31 -19.842 0.250 4.190
148 HG21 VAL 31 3HG2 VAL 31 -15.969 0.250 2.482
149 HG22 VAL 31 1HG2 VAL 31 -17.218 -0.630 1.600
150 HG23 VAL 31 2HG2 VAL 31 -16.695 -1.193 3.188
151 H ALA 32 H ALA 32 -16.924 0.958 0.419
152 HA ALA 32 HA ALA 32 -15.205 3.139 0.777
153 HB1 ALA 32 3HB ALA 32 -14.522 1.116 -0.393
154 HB2 ALA 32 1HB ALA 32 -14.268 2.539 -1.405
155 HB3 ALA 32 2HB ALA 32 -15.646 1.480 -1.703
156 H SER 33 H SER 33 -18.040 2.720 -1.253
157 HA SER 33 HA SER 33 -17.733 5.064 -2.791
158 HB2 SER 33 2HB SER 33 -19.930 3.138 -2.253
159 HB3 SER 33 1HB SER 33 -20.388 4.716 -2.890
160 HG SER 33 HG SER 33 -19.992 3.392 -4.624
161 H LYS 34 H LYS 34 -19.344 4.437 0.286
162 HA LYS 34 HA LYS 34 -20.589 6.979 0.472
163 HB2 LYS 34 2HB LYS 34 -21.136 6.407 2.720
164 HB3 LYS 34 1HB LYS 34 -21.270 4.940 1.762
165 HG2 LYS 34 2HG LYS 34 -19.708 3.889 2.949
166 HG3 LYS 34 1HG LYS 34 -18.634 5.285 2.952
167 HD2 LYS 34 2HD LYS 34 -19.516 6.131 4.897
168 HD3 LYS 34 1HD LYS 34 -21.085 5.364 4.643
169 HE2 LYS 34 2HE LYS 34 -18.840 3.502 4.989
170 HE3 LYS 34 1HE LYS 34 -19.200 4.496 6.400
171 HZ1 LYS 34 3HZ LYS 34 -21.646 3.713 5.708
172 HZ2 LYS 34 1HZ LYS 34 -20.671 2.864 6.800
173 HZ3 LYS 34 2HZ LYS 34 -20.759 2.372 5.185
174 H ILE 35 H ILE 35 -17.423 5.782 1.351
175 HA ILE 35 HA ILE 35 -16.685 7.978 2.999
176 HB ILE 35 HB ILE 35 -14.912 6.072 1.465
177 HG12 ILE 35 2HG1 ILE 35 -16.448 4.993 3.097
178 HG13 ILE 35 1HG1 ILE 35 -14.752 4.823 3.537
179 HG21 ILE 35 1HG2 ILE 35 -13.739 8.118 2.097
180 HG22 ILE 35 2HG2 ILE 35 -13.157 6.736 3.026
181 HG23 ILE 35 3HG2 ILE 35 -14.252 7.902 3.770
182 HD11 ILE 35 3HD1 ILE 35 -15.489 7.118 4.840
183 HD12 ILE 35 1HD1 ILE 35 -15.388 5.508 5.553
184 HD13 ILE 35 2HD1 ILE 35 -16.934 6.113 4.955
185 H ILE 36 H ILE 36 -16.417 7.303 -0.441
186 HA ILE 36 HA ILE 36 -14.776 9.555 -1.050
187 HB ILE 36 HB ILE 36 -16.589 8.000 -2.899
188 HG12 ILE 36 2HG1 ILE 36 -14.846 6.664 -1.632
189 HG13 ILE 36 1HG1 ILE 36 -14.742 6.579 -3.386
190 HG21 ILE 36 1HG2 ILE 36 -14.569 8.838 -4.453
191 HG22 ILE 36 2HG2 ILE 36 -14.631 10.171 -3.301
192 HG23 ILE 36 3HG2 ILE 36 -16.065 9.747 -4.235
193 HD11 ILE 36 3HD1 ILE 36 -12.674 7.100 -1.682
194 HD12 ILE 36 1HD1 ILE 36 -13.129 8.713 -2.232
195 HD13 ILE 36 2HD1 ILE 36 -12.700 7.470 -3.407
196 H SER 37 H SER 37 -18.215 9.011 -0.782
197 HA SER 37 HA SER 37 -18.850 11.610 -1.927
198 HB2 SER 37 2HB SER 37 -20.197 9.282 -2.041
199 HB3 SER 37 1HB SER 37 -20.969 9.991 -0.624
200 HG SER 37 HG SER 37 -21.532 10.507 -3.103
201 H LYS 38 H LYS 38 -18.281 10.198 1.149
202 HA LYS 38 HA LYS 38 -19.861 11.695 2.852
203 HB2 LYS 38 2HB LYS 38 -17.268 10.295 3.074
204 HB3 LYS 38 1HB LYS 38 -17.594 11.504 4.310
205 HG2 LYS 38 2HG LYS 38 -19.932 9.933 4.000
206 HG3 LYS 38 1HG LYS 38 -18.552 8.840 4.131
207 HD2 LYS 38 2HD LYS 38 -19.365 9.257 6.340
208 HD3 LYS 38 1HD LYS 38 -17.838 10.123 6.159
209 HE2 LYS 38 2HE LYS 38 -19.247 11.662 7.212
210 HE3 LYS 38 1HE LYS 38 -19.272 12.140 5.515
211 HZ1 LYS 38 3HZ LYS 38 -21.346 10.535 6.908
212 HZ2 LYS 38 1HZ LYS 38 -21.366 10.933 5.262
213 HZ3 LYS 38 2HZ LYS 38 -21.490 12.151 6.428
214 H LYS 39 H LYS 39 -16.457 12.430 2.153
215 HA LYS 39 HA LYS 39 -16.804 15.102 1.454
216 HB2 LYS 39 2HB LYS 39 -17.231 14.711 4.203
217 HB3 LYS 39 1HB LYS 39 -15.627 15.420 4.073
218 HG2 LYS 39 2HG LYS 39 -17.035 16.995 2.370
219 HG3 LYS 39 1HG LYS 39 -18.260 16.603 3.580
220 HD2 LYS 39 2HD LYS 39 -17.303 18.484 4.503
221 HD3 LYS 39 1HD LYS 39 -16.356 17.208 5.270
222 HE2 LYS 39 2HE LYS 39 -14.632 18.496 4.568
223 HE3 LYS 39 1HE LYS 39 -14.872 17.580 3.081
224 HZ1 LYS 39 3HZ LYS 39 -14.787 20.217 3.139
225 HZ2 LYS 39 1HZ LYS 39 -16.447 20.010 3.387
226 HZ3 LYS 39 2HZ LYS 39 -15.711 19.364 2.008
227 HA PRO 40 HA PRO 40 -12.130 14.301 2.941
228 HB2 PRO 40 2HB PRO 40 -12.453 11.334 3.052
229 HB3 PRO 40 1HB PRO 40 -11.393 12.385 3.996
230 HG2 PRO 40 2HG PRO 40 -13.611 11.393 5.073
231 HG3 PRO 40 1HG PRO 40 -13.100 13.056 5.416
232 HD2 PRO 40 2HD PRO 40 -15.290 12.071 3.653
233 HD3 PRO 40 1HD PRO 40 -15.206 13.548 4.632
234 H ARG 41 H ARG 41 -10.864 14.430 1.200
235 HA ARG 41 HA ARG 41 -10.685 12.423 -0.793
236 HB2 ARG 41 2HB ARG 41 -12.895 13.612 -1.325
237 HB3 ARG 41 1HB ARG 41 -11.906 14.987 -1.795
238 HG2 ARG 41 2HG ARG 41 -10.702 13.378 -3.357
239 HG3 ARG 41 1HG ARG 41 -12.039 12.268 -3.049
240 HD2 ARG 41 2HD ARG 41 -12.134 14.993 -4.319
241 HD3 ARG 41 1HD ARG 41 -12.587 13.445 -5.029
242 HE ARG 41 HE ARG 41 -14.278 13.671 -2.934
243 HH11 ARG 41 1HH1 ARG 41 -13.461 15.808 -5.571
244 HH12 ARG 41 2HH1 ARG 41 -15.022 16.557 -5.612
245 HH21 ARG 41 1HH2 ARG 41 -16.332 14.654 -2.990
246 HH22 ARG 41 2HH2 ARG 41 -16.653 15.902 -4.148
247 H THR 42 H THR 42 -8.489 12.679 -0.285
248 HA THR 42 HA THR 42 -7.178 14.778 -1.785
249 HB THR 42 HB THR 42 -6.094 14.524 0.955
250 HG1 THR 42 1HG THR 42 -8.026 14.869 1.754
251 HG21 THR 42 3HG2 THR 42 -6.189 16.522 -1.176
252 HG22 THR 42 1HG2 THR 42 -4.957 16.215 0.048
253 HG23 THR 42 2HG2 THR 42 -6.384 17.171 0.452
254 H ALA 43 H ALA 43 -4.609 14.477 -0.995
255 HA ALA 43 HA ALA 43 -3.805 12.110 -2.244
256 HB1 ALA 43 3HB ALA 43 -1.898 13.307 -0.340
257 HB2 ALA 43 1HB ALA 43 -2.550 14.393 -1.566
258 HB3 ALA 43 2HB ALA 43 -1.708 12.922 -2.050
259 H GLN 44 H GLN 44 -4.399 12.845 1.130
260 HA GLN 44 HA GLN 44 -3.114 10.660 2.309
261 HB2 GLN 44 2HB GLN 44 -4.425 12.781 3.287
262 HB3 GLN 44 1HB GLN 44 -5.687 11.572 3.478
263 HG2 GLN 44 2HG GLN 44 -3.935 10.162 4.662
264 HG3 GLN 44 1HG GLN 44 -2.959 11.630 4.715
265 HE21 GLN 44 1HE2 GLN 44 -6.377 10.826 5.257
266 HE22 GLN 44 2HE2 GLN 44 -6.498 11.623 6.786
267 H ASP 45 H ASP 45 -6.197 10.923 0.689
268 HA ASP 45 HA ASP 45 -7.258 8.444 1.588
269 HB2 ASP 45 2HB ASP 45 -7.941 10.366 -0.606
270 HB3 ASP 45 1HB ASP 45 -8.696 8.776 -0.580
271 H GLU 46 H GLU 46 -5.289 9.416 -1.152
272 HA GLU 46 HA GLU 46 -5.501 6.978 -2.583
273 HB2 GLU 46 2HB GLU 46 -3.715 9.362 -2.702
274 HB3 GLU 46 1HB GLU 46 -3.211 7.903 -3.542
275 HG2 GLU 46 2HG GLU 46 -5.506 7.938 -4.639
276 HG3 GLU 46 1HG GLU 46 -5.647 9.583 -4.019
277 H LYS 47 H LYS 47 -3.232 8.159 -0.157
278 HA LYS 47 HA LYS 47 -1.420 5.987 -0.392
279 HB2 LYS 47 2HB LYS 47 -0.556 6.742 1.801
280 HB3 LYS 47 1HB LYS 47 -0.705 8.057 0.643
281 HG2 LYS 47 2HG LYS 47 -2.630 8.907 1.715
282 HG3 LYS 47 1HG LYS 47 -2.798 7.461 2.714
283 HD2 LYS 47 2HD LYS 47 -1.872 9.246 4.049
284 HD3 LYS 47 1HD LYS 47 -0.637 8.012 3.795
285 HE2 LYS 47 2HE LYS 47 -0.290 9.725 1.657
286 HE3 LYS 47 1HE LYS 47 -0.679 10.808 2.992
287 HZ1 LYS 47 3HZ LYS 47 1.630 9.042 2.642
288 HZ2 LYS 47 1HZ LYS 47 1.074 9.316 4.216
289 HZ3 LYS 47 2HZ LYS 47 1.560 10.618 3.253
290 H PHE 48 H PHE 48 -4.285 6.580 1.553
291 HA PHE 48 HA PHE 48 -4.034 4.350 3.258
292 HB2 PHE 48 2HB PHE 48 -5.699 6.476 3.191
293 HB3 PHE 48 1HB PHE 48 -6.765 5.236 2.539
294 HD1 PHE 48 2HD PHE 48 -6.764 2.977 3.915
295 HD2 PHE 48 1HD PHE 48 -5.644 6.780 5.462
296 HE1 PHE 48 2HE PHE 48 -7.236 2.184 6.196
297 HE2 PHE 48 1HE PHE 48 -6.112 5.993 7.745
298 HZ PHE 48 HZ PHE 48 -6.910 3.693 8.115
299 H LEU 49 H LEU 49 -5.726 4.789 0.177
300 HA LEU 49 HA LEU 49 -6.754 2.127 0.133
301 HB2 LEU 49 2HB LEU 49 -7.292 2.598 -2.232
302 HB3 LEU 49 1HB LEU 49 -7.889 3.823 -1.131
303 HG LEU 49 HG LEU 49 -5.709 5.098 -1.760
304 HD11 LEU 49 1HD1 LEU 49 -4.381 3.951 -3.142
305 HD12 LEU 49 2HD1 LEU 49 -5.544 4.373 -4.398
306 HD13 LEU 49 3HD1 LEU 49 -5.661 2.818 -3.575
307 HD21 LEU 49 3HD2 LEU 49 -7.728 6.093 -2.339
308 HD22 LEU 49 1HD2 LEU 49 -8.181 4.775 -3.419
309 HD23 LEU 49 2HD2 LEU 49 -6.912 5.906 -3.892
310 H ARG 50 H ARG 50 -3.842 3.685 -0.995
311 HA ARG 50 HA ARG 50 -2.917 1.587 -2.660
312 HB2 ARG 50 2HB ARG 50 -2.114 4.044 -2.507
313 HB3 ARG 50 1HB ARG 50 -1.102 3.477 -1.186
314 HG2 ARG 50 2HG ARG 50 0.355 2.504 -2.567
315 HG3 ARG 50 1HG ARG 50 -0.917 1.826 -3.584
316 HD2 ARG 50 2HD ARG 50 0.367 3.367 -4.898
317 HD3 ARG 50 1HD ARG 50 -1.222 4.073 -4.601
318 HE ARG 50 HE ARG 50 0.511 4.974 -2.607
319 HH11 ARG 50 1HH1 ARG 50 0.081 5.283 -6.057
320 HH12 ARG 50 2HH1 ARG 50 0.791 6.861 -6.130
321 HH21 ARG 50 1HH2 ARG 50 1.445 7.049 -2.701
322 HH22 ARG 50 2HH2 ARG 50 1.566 7.864 -4.226
323 H GLU 51 H GLU 51 -2.645 2.272 0.770
324 HA GLU 51 HA GLU 51 -0.678 0.284 1.320
325 HB2 GLU 51 2HB GLU 51 -1.722 2.375 2.726
326 HB3 GLU 51 1HB GLU 51 -2.525 1.015 3.498
327 HG2 GLU 51 2HG GLU 51 -0.713 0.818 4.756
328 HG3 GLU 51 1HG GLU 51 0.104 0.198 3.322
329 H SER 52 H SER 52 -4.172 0.342 1.196
330 HA SER 52 HA SER 52 -4.225 -2.518 1.903
331 HB2 SER 52 2HB SER 52 -6.517 -0.543 2.028
332 HB3 SER 52 1HB SER 52 -6.532 -2.213 2.595
333 HG SER 52 HG SER 52 -5.984 -1.295 4.415
334 H ALA 53 H ALA 53 -3.455 -1.927 -0.641
335 HA ALA 53 HA ALA 53 -5.859 -2.346 -2.283
336 HB1 ALA 53 3HB ALA 53 -3.294 -0.963 -2.756
337 HB2 ALA 53 1HB ALA 53 -4.916 -0.581 -3.333
338 HB3 ALA 53 2HB ALA 53 -3.977 -1.848 -4.122
339 H CYS 54 H CYS 54 -5.942 -4.013 -3.778
340 HA CYS 54 HA CYS 54 -4.609 -6.409 -3.046
341 HB2 CYS 54 2HB CYS 54 -6.922 -5.892 -4.330
342 HB3 CYS 54 1HB CYS 54 -5.898 -6.256 -5.713
343 H GLY 55 H GLY 55 -2.394 -5.403 -3.281
344 HA2 GLY 55 2HA GLY 55 -0.530 -6.302 -4.632
345 HA3 GLY 55 1HA GLY 55 -1.438 -5.804 -6.052
346 H PHE 56 H PHE 56 0.677 -4.754 -6.516
347 HA PHE 56 HA PHE 56 0.929 -2.170 -5.126
348 HB2 PHE 56 2HB PHE 56 2.950 -3.872 -6.573
349 HB3 PHE 56 1HB PHE 56 3.250 -2.174 -6.218
350 HD1 PHE 56 1HD PHE 56 2.519 -1.624 -3.622
351 HD2 PHE 56 2HD PHE 56 3.974 -5.323 -5.141
352 HE1 PHE 56 1HE PHE 56 3.307 -2.232 -1.372
353 HE2 PHE 56 2HE PHE 56 4.763 -5.940 -2.893
354 HZ PHE 56 HZ PHE 56 4.430 -4.394 -1.006
355 H ASP 57 H ASP 57 0.201 -3.686 -8.125
356 HA ASP 57 HA ASP 57 0.919 -1.829 -10.024
357 HB2 ASP 57 2HB ASP 57 -1.682 -3.374 -9.936
358 HB3 ASP 57 1HB ASP 57 -0.944 -2.666 -11.370
359 H GLY 58 H GLY 58 0.401 0.215 -10.451
360 HA2 GLY 58 2HA GLY 58 -1.665 1.496 -8.838
361 HA3 GLY 58 1HA GLY 58 -0.458 2.310 -9.823
362 H GLN 59 H GLN 59 -0.984 0.769 -12.213
363 HA GLN 59 HA GLN 59 -2.926 2.375 -13.411
364 HB2 GLN 59 2HB GLN 59 -1.337 0.026 -14.174
365 HB3 GLN 59 1HB GLN 59 -2.868 0.161 -15.028
366 HG2 GLN 59 2HG GLN 59 -2.166 1.886 -16.254
367 HG3 GLN 59 1HG GLN 59 -1.381 2.667 -14.884
368 HE21 GLN 59 1HE2 GLN 59 -0.803 1.467 -17.820
369 HE22 GLN 59 2HE2 GLN 59 0.840 0.963 -17.642
370 H THR 60 H THR 60 -3.189 -0.696 -11.770
371 HA THR 60 HA THR 60 -6.016 -0.913 -12.511
372 HB THR 60 HB THR 60 -4.683 -2.960 -10.808
373 HG1 THR 60 1HG THR 60 -4.205 -2.702 -13.592
374 HG21 THR 60 3HG2 THR 60 -6.567 -4.000 -11.327
375 HG22 THR 60 1HG2 THR 60 -5.917 -4.175 -12.957
376 HG23 THR 60 2HG2 THR 60 -6.967 -2.813 -12.570
377 HA PRO 61 HA PRO 61 -6.557 1.092 -8.445
378 HB2 PRO 61 2HB PRO 61 -9.190 1.694 -8.862
379 HB3 PRO 61 1HB PRO 61 -7.855 2.709 -9.419
380 HG2 PRO 61 2HG PRO 61 -9.475 0.704 -10.938
381 HG3 PRO 61 1HG PRO 61 -8.924 2.311 -11.442
382 HD2 PRO 61 2HD PRO 61 -7.684 0.058 -12.243
383 HD3 PRO 61 1HD PRO 61 -6.794 1.565 -11.939
384 H LYS 62 H LYS 62 -6.543 -0.517 -6.968
385 HA LYS 62 HA LYS 62 -9.028 -2.043 -6.640
386 HB2 LYS 62 2HB LYS 62 -6.240 -3.204 -6.458
387 HB3 LYS 62 1HB LYS 62 -7.724 -4.056 -6.054
388 HG2 LYS 62 2HG LYS 62 -7.205 -2.910 -8.781
389 HG3 LYS 62 1HG LYS 62 -6.727 -4.544 -8.318
390 HD2 LYS 62 2HD LYS 62 -9.143 -4.915 -7.650
391 HD3 LYS 62 1HD LYS 62 -9.504 -3.391 -8.461
392 HE2 LYS 62 2HE LYS 62 -8.915 -4.233 -10.560
393 HE3 LYS 62 1HE LYS 62 -8.016 -5.582 -9.866
394 HZ1 LYS 62 3HZ LYS 62 -9.872 -6.806 -9.616
395 HZ2 LYS 62 1HZ LYS 62 -10.470 -5.811 -10.848
396 HZ3 LYS 62 2HZ LYS 62 -10.850 -5.480 -9.234
397 H VAL 63 H VAL 63 -9.564 -2.574 -4.514
398 HA VAL 63 HA VAL 63 -7.810 -1.543 -2.399
399 HB VAL 63 HB VAL 63 -10.771 -0.965 -2.465
400 HG11 VAL 63 1HG1 VAL 63 -9.836 0.776 -0.719
401 HG12 VAL 63 2HG1 VAL 63 -8.555 -0.425 -0.558
402 HG13 VAL 63 3HG1 VAL 63 -10.230 -0.876 -0.245
403 HG21 VAL 63 3HG2 VAL 63 -9.638 1.464 -2.660
404 HG22 VAL 63 1HG2 VAL 63 -10.177 0.529 -4.054
405 HG23 VAL 63 2HG2 VAL 63 -8.477 0.513 -3.586
406 H CYS 64 H CYS 64 -8.281 -2.393 -0.280
407 HA CYS 64 HA CYS 64 -9.465 -5.071 -0.434
408 HB2 CYS 64 2HB CYS 64 -7.304 -3.836 1.190
409 HB3 CYS 64 1HB CYS 64 -8.267 -5.088 1.965
410 H CYS 65 H CYS 65 -11.360 -5.469 0.459
411 HA CYS 65 HA CYS 65 -12.377 -3.621 2.516
412 HB2 CYS 65 2HB CYS 65 -13.568 -4.650 0.058
413 HB3 CYS 65 1HB CYS 65 -14.589 -4.928 1.464
414 HA PRO 66 HA PRO 66 -12.105 -7.379 4.991
415 HB2 PRO 66 2HB PRO 66 -12.980 -6.250 7.310
416 HB3 PRO 66 1HB PRO 66 -11.323 -6.087 6.718
417 HG2 PRO 66 2HG PRO 66 -13.610 -4.168 6.495
418 HG3 PRO 66 1HG PRO 66 -11.912 -3.845 6.898
419 HD2 PRO 66 2HD PRO 66 -12.909 -3.400 4.431
420 HD3 PRO 66 1HD PRO 66 -11.238 -3.940 4.690
Start of MODEL 20
1 H GLN 11 H GLN 11 -11.977 -12.407 -4.911
2 HA GLN 11 HA GLN 11 -10.152 -13.749 -4.543
3 HB2 GLN 11 2HB GLN 11 -8.891 -12.215 -6.336
4 HB3 GLN 11 1HB GLN 11 -8.208 -11.518 -4.875
5 HG2 GLN 11 2HG GLN 11 -7.776 -14.041 -4.273
6 HG3 GLN 11 1HG GLN 11 -7.867 -14.234 -6.025
7 HE21 GLN 11 1HE2 GLN 11 -5.604 -14.928 -5.622
8 HE22 GLN 11 2HE2 GLN 11 -4.375 -13.715 -5.645
9 H ALA 12 H ALA 12 -9.291 -13.994 -2.492
10 HA ALA 12 HA ALA 12 -10.145 -12.031 -0.552
11 HB1 ALA 12 3HB ALA 12 -8.713 -14.642 -0.088
12 HB2 ALA 12 1HB ALA 12 -10.464 -14.459 -0.192
13 HB3 ALA 12 2HB ALA 12 -9.573 -13.675 1.110
14 H CYS 13 H CYS 13 -8.916 -10.472 0.265
15 HA CYS 13 HA CYS 13 -5.988 -10.739 0.036
16 HB2 CYS 13 2HB CYS 13 -5.834 -8.338 -0.199
17 HB3 CYS 13 1HB CYS 13 -6.965 -8.956 -1.396
18 H THR 14 H THR 14 -4.786 -9.385 1.673
19 HA THR 14 HA THR 14 -6.028 -9.800 4.298
20 HB THR 14 HB THR 14 -3.917 -10.952 3.981
21 HG1 THR 14 1HG THR 14 -3.484 -8.694 5.635
22 HG21 THR 14 3HG2 THR 14 -3.119 -8.589 2.627
23 HG22 THR 14 1HG2 THR 14 -2.257 -10.120 2.793
24 HG23 THR 14 2HG2 THR 14 -2.037 -8.849 3.997
25 H LEU 15 H LEU 15 -6.885 -8.085 5.243
26 HA LEU 15 HA LEU 15 -6.517 -5.433 4.382
27 HB2 LEU 15 2HB LEU 15 -7.601 -4.886 6.635
28 HB3 LEU 15 1HB LEU 15 -8.523 -5.845 5.495
29 HG LEU 15 HG LEU 15 -6.931 -7.431 7.389
30 HD11 LEU 15 1HD1 LEU 15 -9.362 -6.030 8.457
31 HD12 LEU 15 2HD1 LEU 15 -7.732 -5.412 8.720
32 HD13 LEU 15 3HD1 LEU 15 -8.178 -7.006 9.327
33 HD21 LEU 15 3HD2 LEU 15 -9.506 -8.256 7.566
34 HD22 LEU 15 1HD2 LEU 15 -8.361 -8.820 6.349
35 HD23 LEU 15 2HD2 LEU 15 -9.497 -7.528 5.960
36 HA PRO 16 HA PRO 16 -2.950 -3.736 6.314
37 HB2 PRO 16 2HB PRO 16 -4.728 -1.967 7.932
38 HB3 PRO 16 1HB PRO 16 -3.336 -1.547 6.926
39 HG2 PRO 16 2HG PRO 16 -5.810 -1.087 6.066
40 HG3 PRO 16 1HG PRO 16 -4.555 -1.671 4.955
41 HD2 PRO 16 2HD PRO 16 -6.835 -3.146 6.188
42 HD3 PRO 16 1HD PRO 16 -6.100 -3.338 4.584
43 H ASN 17 H ASN 17 -5.616 -4.685 8.374
44 HA ASN 17 HA ASN 17 -4.002 -4.787 10.765
45 HB2 ASN 17 2HB ASN 17 -6.687 -4.528 10.334
46 HB3 ASN 17 1HB ASN 17 -6.569 -6.232 10.764
47 HD21 ASN 17 1HD2 ASN 17 -7.647 -3.795 12.152
48 HD22 ASN 17 2HD2 ASN 17 -6.913 -3.832 13.716
49 H ASN 18 H ASN 18 -4.670 -6.859 8.131
50 HA ASN 18 HA ASN 18 -3.952 -8.952 7.614
51 HB2 ASN 18 2HB ASN 18 -1.992 -8.021 9.261
52 HB3 ASN 18 1HB ASN 18 -2.515 -9.451 10.144
53 HD21 ASN 18 1HD2 ASN 18 -1.286 -8.286 7.073
54 HD22 ASN 18 2HD2 ASN 18 -0.605 -9.790 6.563
55 H ASP 19 H ASP 19 -6.127 -9.653 7.828
56 HA ASP 19 HA ASP 19 -6.437 -11.764 9.751
57 HB2 ASP 19 2HB ASP 19 -7.819 -9.174 10.105
58 HB3 ASP 19 1HB ASP 19 -8.838 -10.603 10.252
59 H LYS 20 H LYS 20 -6.357 -11.380 6.850
60 HA LYS 20 HA LYS 20 -7.351 -12.226 4.990
61 HB2 LYS 20 2HB LYS 20 -9.190 -13.572 6.978
62 HB3 LYS 20 1HB LYS 20 -9.053 -13.983 5.275
63 HG2 LYS 20 2HG LYS 20 -7.598 -15.525 5.968
64 HG3 LYS 20 1HG LYS 20 -6.464 -14.178 6.094
65 HD2 LYS 20 2HD LYS 20 -7.739 -13.999 8.479
66 HD3 LYS 20 1HD LYS 20 -7.796 -15.741 8.204
67 HE2 LYS 20 2HE LYS 20 -5.204 -14.484 7.638
68 HE3 LYS 20 1HE LYS 20 -5.705 -14.415 9.326
69 HZ1 LYS 20 3HZ LYS 20 -5.492 -16.629 9.573
70 HZ2 LYS 20 1HZ LYS 20 -4.428 -16.485 8.264
71 HZ3 LYS 20 2HZ LYS 20 -6.025 -16.985 8.007
72 H GLY 21 H GLY 21 -8.912 -11.624 3.524
73 HA2 GLY 21 2HA GLY 21 -11.440 -10.542 4.337
74 HA3 GLY 21 1HA GLY 21 -10.304 -9.292 3.854
75 H THR 22 H THR 22 -11.535 -8.679 2.076
76 HA THR 22 HA THR 22 -11.391 -10.557 -0.176
77 HB THR 22 HB THR 22 -13.715 -8.677 0.200
78 HG1 THR 22 1HG THR 22 -13.645 -10.200 1.928
79 HG21 THR 22 3HG2 THR 22 -14.854 -10.355 -1.255
80 HG22 THR 22 1HG2 THR 22 -13.277 -11.101 -1.519
81 HG23 THR 22 2HG2 THR 22 -13.564 -9.440 -2.038
82 H CYS 23 H CYS 23 -11.021 -9.646 -2.202
83 HA CYS 23 HA CYS 23 -10.268 -6.797 -2.162
84 HB2 CYS 23 2HB CYS 23 -8.218 -7.838 -2.425
85 HB3 CYS 23 1HB CYS 23 -8.901 -9.200 -3.302
86 H LYS 24 H LYS 24 -11.432 -5.553 -3.441
87 HA LYS 24 HA LYS 24 -12.374 -6.554 -6.013
88 HB2 LYS 24 2HB LYS 24 -14.650 -5.535 -5.543
89 HB3 LYS 24 1HB LYS 24 -14.289 -7.035 -4.701
90 HG2 LYS 24 2HG LYS 24 -13.783 -5.811 -2.673
91 HG3 LYS 24 1HG LYS 24 -14.053 -4.279 -3.510
92 HD2 LYS 24 2HD LYS 24 -16.060 -4.651 -2.383
93 HD3 LYS 24 1HD LYS 24 -16.396 -5.213 -4.020
94 HE2 LYS 24 2HE LYS 24 -17.274 -6.822 -2.480
95 HE3 LYS 24 1HE LYS 24 -15.861 -7.524 -3.266
96 HZ1 LYS 24 3HZ LYS 24 -14.593 -7.320 -1.357
97 HZ2 LYS 24 1HZ LYS 24 -16.105 -7.766 -0.743
98 HZ3 LYS 24 2HZ LYS 24 -15.606 -6.152 -0.668
99 H SER 25 H SER 25 -13.305 -4.749 -7.351
100 HA SER 25 HA SER 25 -11.499 -2.600 -7.462
101 HB2 SER 25 2HB SER 25 -13.185 -1.634 -9.107
102 HB3 SER 25 1HB SER 25 -12.581 -3.248 -9.485
103 HG SER 25 HG SER 25 -15.036 -2.632 -9.405
104 H LEU 26 H LEU 26 -12.615 -0.254 -7.747
105 HA LEU 26 HA LEU 26 -13.664 0.345 -5.087
106 HB2 LEU 26 2HB LEU 26 -12.996 2.597 -5.462
107 HB3 LEU 26 1HB LEU 26 -11.680 1.561 -5.979
108 HG LEU 26 HG LEU 26 -13.547 2.297 -8.128
109 HD11 LEU 26 1HD1 LEU 26 -12.145 4.360 -6.503
110 HD12 LEU 26 2HD1 LEU 26 -13.709 4.430 -7.313
111 HD13 LEU 26 3HD1 LEU 26 -12.224 4.558 -8.254
112 HD21 LEU 26 3HD2 LEU 26 -11.736 1.966 -9.398
113 HD22 LEU 26 1HD2 LEU 26 -11.030 1.251 -7.949
114 HD23 LEU 26 2HD2 LEU 26 -10.703 2.937 -8.350
115 H LEU 27 H LEU 27 -15.415 -0.872 -7.030
116 HA LEU 27 HA LEU 27 -17.485 1.191 -7.070
117 HB2 LEU 27 2HB LEU 27 -17.051 -0.579 -9.461
118 HB3 LEU 27 1HB LEU 27 -18.092 0.826 -9.326
119 HG LEU 27 HG LEU 27 -15.093 1.027 -9.140
120 HD11 LEU 27 1HD1 LEU 27 -16.440 1.811 -11.641
121 HD12 LEU 27 2HD1 LEU 27 -16.281 0.078 -11.355
122 HD13 LEU 27 3HD1 LEU 27 -14.846 1.102 -11.379
123 HD21 LEU 27 3HD2 LEU 27 -16.791 3.205 -10.180
124 HD22 LEU 27 1HD2 LEU 27 -15.383 3.267 -9.118
125 HD23 LEU 27 2HD2 LEU 27 -16.965 2.836 -8.464
126 H GLN 28 H GLN 28 -16.940 -1.212 -5.463
127 HA GLN 28 HA GLN 28 -19.467 -2.617 -5.994
128 HB2 GLN 28 2HB GLN 28 -16.763 -3.783 -5.412
129 HB3 GLN 28 1HB GLN 28 -18.222 -4.651 -4.950
130 HG2 GLN 28 2HG GLN 28 -18.950 -4.380 -7.375
131 HG3 GLN 28 1HG GLN 28 -17.281 -3.907 -7.698
132 HE21 GLN 28 1HE2 GLN 28 -18.502 -6.126 -8.857
133 HE22 GLN 28 2HE2 GLN 28 -17.720 -7.554 -8.276
134 H CYS 29 H CYS 29 -16.912 -2.169 -3.550
135 HA CYS 29 HA CYS 29 -18.511 -2.808 -1.330
136 HB2 CYS 29 2HB CYS 29 -15.849 -2.177 -1.745
137 HB3 CYS 29 1HB CYS 29 -16.433 -0.827 -0.777
138 H ASP 30 H ASP 30 -20.300 -1.783 -0.730
139 HA ASP 30 HA ASP 30 -21.106 0.745 -1.564
140 HB2 ASP 30 2HB ASP 30 -21.982 -1.171 0.523
141 HB3 ASP 30 1HB ASP 30 -22.518 0.494 0.720
142 H VAL 31 H VAL 31 -19.291 -0.233 1.281
143 HA VAL 31 HA VAL 31 -19.390 2.278 2.597
144 HB VAL 31 HB VAL 31 -18.838 0.199 3.787
145 HG11 VAL 31 1HG1 VAL 31 -16.221 0.320 2.291
146 HG12 VAL 31 2HG1 VAL 31 -17.504 -0.862 2.028
147 HG13 VAL 31 3HG1 VAL 31 -16.641 -0.825 3.566
148 HG21 VAL 31 3HG2 VAL 31 -18.083 1.772 5.193
149 HG22 VAL 31 1HG2 VAL 31 -17.249 2.653 3.914
150 HG23 VAL 31 2HG2 VAL 31 -16.480 1.259 4.673
151 H ALA 32 H ALA 32 -17.121 0.801 0.341
152 HA ALA 32 HA ALA 32 -15.139 2.808 0.485
153 HB1 ALA 32 3HB ALA 32 -14.780 0.538 -0.450
154 HB2 ALA 32 1HB ALA 32 -14.223 1.830 -1.514
155 HB3 ALA 32 2HB ALA 32 -15.743 1.002 -1.853
156 H SER 33 H SER 33 -18.029 2.433 -1.480
157 HA SER 33 HA SER 33 -17.492 4.561 -3.267
158 HB2 SER 33 2HB SER 33 -19.509 2.612 -2.939
159 HB3 SER 33 1HB SER 33 -20.320 4.178 -2.915
160 HG SER 33 HG SER 33 -18.492 3.302 -4.903
161 H LYS 34 H LYS 34 -19.144 4.390 -0.163
162 HA LYS 34 HA LYS 34 -20.195 7.027 -0.258
163 HB2 LYS 34 2HB LYS 34 -20.776 6.725 2.046
164 HB3 LYS 34 1HB LYS 34 -21.063 5.205 1.214
165 HG2 LYS 34 2HG LYS 34 -19.347 4.135 2.283
166 HG3 LYS 34 1HG LYS 34 -18.457 5.624 2.591
167 HD2 LYS 34 2HD LYS 34 -20.445 6.228 4.121
168 HD3 LYS 34 1HD LYS 34 -20.830 4.508 4.037
169 HE2 LYS 34 2HE LYS 34 -19.397 4.206 5.712
170 HE3 LYS 34 1HE LYS 34 -18.106 4.580 4.571
171 HZ1 LYS 34 3HZ LYS 34 -17.800 6.615 5.447
172 HZ2 LYS 34 1HZ LYS 34 -18.513 5.930 6.822
173 HZ3 LYS 34 2HZ LYS 34 -19.443 6.866 5.763
174 H ILE 35 H ILE 35 -17.157 5.662 0.824
175 HA ILE 35 HA ILE 35 -16.257 7.969 2.228
176 HB ILE 35 HB ILE 35 -14.596 5.767 0.995
177 HG12 ILE 35 2HG1 ILE 35 -15.232 5.884 3.905
178 HG13 ILE 35 1HG1 ILE 35 -16.488 5.311 2.813
179 HG21 ILE 35 1HG2 ILE 35 -12.958 7.223 1.531
180 HG22 ILE 35 2HG2 ILE 35 -13.216 6.588 3.157
181 HG23 ILE 35 3HG2 ILE 35 -13.971 8.106 2.674
182 HD11 ILE 35 3HD1 ILE 35 -14.259 3.918 2.004
183 HD12 ILE 35 1HD1 ILE 35 -15.555 3.311 3.035
184 HD13 ILE 35 2HD1 ILE 35 -14.094 3.985 3.759
185 H ILE 36 H ILE 36 -15.993 6.860 -1.096
186 HA ILE 36 HA ILE 36 -14.120 8.868 -1.897
187 HB ILE 36 HB ILE 36 -15.960 7.188 -3.606
188 HG12 ILE 36 2HG1 ILE 36 -14.311 5.971 -2.094
189 HG13 ILE 36 1HG1 ILE 36 -14.194 5.618 -3.814
190 HG21 ILE 36 1HG2 ILE 36 -14.398 7.694 -5.424
191 HG22 ILE 36 2HG2 ILE 36 -13.489 8.752 -4.345
192 HG23 ILE 36 3HG2 ILE 36 -15.148 9.158 -4.785
193 HD11 ILE 36 3HD1 ILE 36 -11.993 5.841 -2.916
194 HD12 ILE 36 1HD1 ILE 36 -12.392 7.402 -2.198
195 HD13 ILE 36 2HD1 ILE 36 -12.314 7.232 -3.952
196 H SER 37 H SER 37 -17.610 8.591 -1.811
197 HA SER 37 HA SER 37 -17.913 11.148 -3.196
198 HB2 SER 37 2HB SER 37 -20.268 9.625 -2.183
199 HB3 SER 37 1HB SER 37 -20.080 10.543 -3.676
200 HG SER 37 HG SER 37 -19.422 7.901 -3.108
201 H LYS 38 H LYS 38 -17.335 10.198 -0.116
202 HA LYS 38 HA LYS 38 -19.234 11.499 1.451
203 HB2 LYS 38 2HB LYS 38 -16.646 10.303 1.829
204 HB3 LYS 38 1HB LYS 38 -16.750 11.796 2.750
205 HG2 LYS 38 2HG LYS 38 -18.827 9.627 2.884
206 HG3 LYS 38 1HG LYS 38 -17.438 9.717 3.968
207 HD2 LYS 38 2HD LYS 38 -19.038 12.183 3.691
208 HD3 LYS 38 1HD LYS 38 -19.823 10.834 4.514
209 HE2 LYS 38 2HE LYS 38 -18.598 12.388 6.032
210 HE3 LYS 38 1HE LYS 38 -18.070 10.710 6.132
211 HZ1 LYS 38 3HZ LYS 38 -16.170 12.151 6.094
212 HZ2 LYS 38 1HZ LYS 38 -16.700 12.905 4.676
213 HZ3 LYS 38 2HZ LYS 38 -16.218 11.284 4.641
214 H LYS 39 H LYS 39 -15.949 12.780 1.207
215 HA LYS 39 HA LYS 39 -16.558 15.235 0.026
216 HB2 LYS 39 2HB LYS 39 -17.570 15.085 2.628
217 HB3 LYS 39 1HB LYS 39 -16.096 16.034 2.776
218 HG2 LYS 39 2HG LYS 39 -16.981 17.802 1.729
219 HG3 LYS 39 1HG LYS 39 -17.794 16.806 0.521
220 HD2 LYS 39 2HD LYS 39 -19.206 16.212 2.781
221 HD3 LYS 39 1HD LYS 39 -18.800 17.909 3.043
222 HE2 LYS 39 2HE LYS 39 -19.892 18.586 1.077
223 HE3 LYS 39 1HE LYS 39 -19.954 16.940 0.447
224 HZ1 LYS 39 3HZ LYS 39 -22.106 17.740 1.292
225 HZ2 LYS 39 1HZ LYS 39 -21.439 17.878 2.841
226 HZ3 LYS 39 2HZ LYS 39 -21.565 16.360 2.108
227 HA PRO 40 HA PRO 40 -12.292 15.699 2.379
228 HB2 PRO 40 2HB PRO 40 -11.530 13.351 3.648
229 HB3 PRO 40 1HB PRO 40 -12.190 14.777 4.454
230 HG2 PRO 40 2HG PRO 40 -13.567 12.262 3.622
231 HG3 PRO 40 1HG PRO 40 -13.788 13.230 5.089
232 HD2 PRO 40 2HD PRO 40 -15.540 13.350 3.072
233 HD3 PRO 40 1HD PRO 40 -15.112 14.799 4.004
234 H ARG 41 H ARG 41 -10.492 15.382 1.193
235 HA ARG 41 HA ARG 41 -9.825 12.873 -0.006
236 HB2 ARG 41 2HB ARG 41 -11.617 14.458 -1.447
237 HB3 ARG 41 1HB ARG 41 -10.058 14.761 -2.201
238 HG2 ARG 41 2HG ARG 41 -9.870 12.150 -2.149
239 HG3 ARG 41 1HG ARG 41 -11.628 12.239 -2.036
240 HD2 ARG 41 2HD ARG 41 -11.158 14.003 -4.035
241 HD3 ARG 41 1HD ARG 41 -9.837 12.862 -4.286
242 HE ARG 41 HE ARG 41 -12.374 11.580 -3.937
243 HH11 ARG 41 1HH1 ARG 41 -10.278 13.137 -6.251
244 HH12 ARG 41 2HH1 ARG 41 -10.965 12.320 -7.613
245 HH21 ARG 41 1HH2 ARG 41 -13.282 10.504 -5.728
246 HH22 ARG 41 2HH2 ARG 41 -12.672 10.826 -7.318
247 H THR 42 H THR 42 -7.853 13.220 1.024
248 HA THR 42 HA THR 42 -6.147 15.233 -0.270
249 HB THR 42 HB THR 42 -5.016 15.107 2.184
250 HG1 THR 42 1HG THR 42 -6.499 14.899 3.734
251 HG21 THR 42 3HG2 THR 42 -6.203 17.066 0.737
252 HG22 THR 42 1HG2 THR 42 -5.510 17.276 2.345
253 HG23 THR 42 2HG2 THR 42 -7.244 16.999 2.160
254 H ALA 43 H ALA 43 -3.747 14.703 0.726
255 HA ALA 43 HA ALA 43 -2.873 12.440 -0.620
256 HB1 ALA 43 3HB ALA 43 -1.637 14.540 0.521
257 HB2 ALA 43 1HB ALA 43 -0.797 13.084 -0.015
258 HB3 ALA 43 2HB ALA 43 -1.234 13.276 1.682
259 H GLN 44 H GLN 44 -3.953 12.799 2.693
260 HA GLN 44 HA GLN 44 -2.959 10.413 3.761
261 HB2 GLN 44 2HB GLN 44 -5.405 12.043 4.432
262 HB3 GLN 44 1HB GLN 44 -4.938 10.621 5.352
263 HG2 GLN 44 2HG GLN 44 -2.617 12.092 5.257
264 HG3 GLN 44 1HG GLN 44 -3.872 13.321 5.414
265 HE21 GLN 44 1HE2 GLN 44 -3.077 13.802 7.497
266 HE22 GLN 44 2HE2 GLN 44 -3.441 12.789 8.848
267 H ASP 45 H ASP 45 -5.696 11.035 1.694
268 HA ASP 45 HA ASP 45 -6.991 8.539 2.126
269 HB2 ASP 45 2HB ASP 45 -7.302 10.824 0.280
270 HB3 ASP 45 1HB ASP 45 -7.863 9.274 -0.338
271 H GLU 46 H GLU 46 -4.548 9.690 -0.108
272 HA GLU 46 HA GLU 46 -4.580 7.437 -1.822
273 HB2 GLU 46 2HB GLU 46 -2.377 9.431 -1.278
274 HB3 GLU 46 1HB GLU 46 -2.384 8.273 -2.602
275 HG2 GLU 46 2HG GLU 46 -4.358 9.330 -3.541
276 HG3 GLU 46 1HG GLU 46 -4.410 10.463 -2.192
277 H LYS 47 H LYS 47 -2.610 8.282 0.994
278 HA LYS 47 HA LYS 47 -0.975 5.964 0.850
279 HB2 LYS 47 2HB LYS 47 -0.488 6.535 3.299
280 HB3 LYS 47 1HB LYS 47 -0.041 7.723 2.084
281 HG2 LYS 47 2HG LYS 47 -1.384 9.264 2.952
282 HG3 LYS 47 1HG LYS 47 -2.728 8.131 3.082
283 HD2 LYS 47 2HD LYS 47 -1.048 7.256 5.055
284 HD3 LYS 47 1HD LYS 47 -0.799 9.003 5.102
285 HE2 LYS 47 2HE LYS 47 -3.109 9.407 5.474
286 HE3 LYS 47 1HE LYS 47 -3.527 7.734 5.111
287 HZ1 LYS 47 3HZ LYS 47 -1.959 7.262 7.117
288 HZ2 LYS 47 1HZ LYS 47 -3.564 7.731 7.386
289 HZ3 LYS 47 2HZ LYS 47 -2.314 8.863 7.535
290 H PHE 48 H PHE 48 -3.992 6.721 2.488
291 HA PHE 48 HA PHE 48 -4.115 4.361 4.053
292 HB2 PHE 48 2HB PHE 48 -5.463 6.470 4.413
293 HB3 PHE 48 1HB PHE 48 -6.465 5.975 3.053
294 HD1 PHE 48 2HD PHE 48 -7.668 3.745 3.208
295 HD2 PHE 48 1HD PHE 48 -5.870 5.657 6.559
296 HE1 PHE 48 2HE PHE 48 -9.052 2.386 4.721
297 HE2 PHE 48 1HE PHE 48 -7.252 4.301 8.078
298 HZ PHE 48 HZ PHE 48 -8.845 2.663 7.159
299 H LEU 49 H LEU 49 -5.151 5.175 0.801
300 HA LEU 49 HA LEU 49 -6.628 2.775 0.366
301 HB2 LEU 49 2HB LEU 49 -7.320 4.369 -1.110
302 HB3 LEU 49 1HB LEU 49 -5.731 5.091 -1.247
303 HG LEU 49 HG LEU 49 -5.040 3.237 -2.730
304 HD11 LEU 49 1HD1 LEU 49 -7.411 2.158 -3.629
305 HD12 LEU 49 2HD1 LEU 49 -7.604 2.167 -1.876
306 HD13 LEU 49 3HD1 LEU 49 -6.222 1.351 -2.606
307 HD21 LEU 49 3HD2 LEU 49 -7.513 4.275 -3.984
308 HD22 LEU 49 1HD2 LEU 49 -5.855 4.263 -4.584
309 HD23 LEU 49 2HD2 LEU 49 -6.351 5.459 -3.386
310 H ARG 50 H ARG 50 -3.302 3.771 -0.060
311 HA ARG 50 HA ARG 50 -2.461 1.607 -1.678
312 HB2 ARG 50 2HB ARG 50 -1.241 3.806 -1.252
313 HB3 ARG 50 1HB ARG 50 -0.722 3.106 0.275
314 HG2 ARG 50 2HG ARG 50 0.375 1.285 -0.935
315 HG3 ARG 50 1HG ARG 50 -0.136 2.002 -2.465
316 HD2 ARG 50 2HD ARG 50 1.238 3.893 -2.153
317 HD3 ARG 50 1HD ARG 50 1.505 3.514 -0.452
318 HE ARG 50 HE ARG 50 3.176 2.069 -1.065
319 HH11 ARG 50 1HH1 ARG 50 1.308 2.916 -3.890
320 HH12 ARG 50 2HH1 ARG 50 2.412 2.171 -4.996
321 HH21 ARG 50 1HH2 ARG 50 4.629 1.088 -2.521
322 HH22 ARG 50 2HH2 ARG 50 4.295 1.133 -4.220
323 H GLU 51 H GLU 51 -2.747 2.063 1.788
324 HA GLU 51 HA GLU 51 -1.349 -0.315 2.512
325 HB2 GLU 51 2HB GLU 51 -2.124 1.865 3.894
326 HB3 GLU 51 1HB GLU 51 -3.416 0.760 4.345
327 HG2 GLU 51 2HG GLU 51 -2.070 -0.513 5.613
328 HG3 GLU 51 1HG GLU 51 -0.697 -0.340 4.521
329 H SER 52 H SER 52 -4.694 0.483 1.827
330 HA SER 52 HA SER 52 -5.465 -2.303 2.358
331 HB2 SER 52 2HB SER 52 -7.537 -0.269 1.725
332 HB3 SER 52 1HB SER 52 -7.568 -1.582 2.901
333 HG SER 52 HG SER 52 -6.104 -0.307 4.176
334 H ALA 53 H ALA 53 -3.972 -1.695 0.037
335 HA ALA 53 HA ALA 53 -5.990 -2.070 -2.081
336 HB1 ALA 53 3HB ALA 53 -4.968 -0.211 -2.872
337 HB2 ALA 53 1HB ALA 53 -3.816 -1.394 -3.494
338 HB3 ALA 53 2HB ALA 53 -3.469 -0.528 -1.997
339 H CYS 54 H CYS 54 -6.165 -4.202 -2.380
340 HA CYS 54 HA CYS 54 -4.262 -6.156 -1.872
341 HB2 CYS 54 2HB CYS 54 -5.618 -7.534 -3.556
342 HB3 CYS 54 1HB CYS 54 -6.476 -6.898 -2.158
343 H GLY 55 H GLY 55 -2.237 -5.541 -2.662
344 HA2 GLY 55 2HA GLY 55 -0.595 -6.073 -4.268
345 HA3 GLY 55 1HA GLY 55 -1.851 -6.159 -5.492
346 H PHE 56 H PHE 56 0.132 -4.910 -6.457
347 HA PHE 56 HA PHE 56 -0.573 -2.068 -6.304
348 HB2 PHE 56 2HB PHE 56 2.243 -3.168 -6.253
349 HB3 PHE 56 1HB PHE 56 1.835 -1.468 -6.459
350 HD1 PHE 56 1HD PHE 56 0.134 -0.590 -4.567
351 HD2 PHE 56 2HD PHE 56 2.868 -3.825 -4.154
352 HE1 PHE 56 1HE PHE 56 0.102 -0.300 -2.123
353 HE2 PHE 56 2HE PHE 56 2.841 -3.541 -1.710
354 HZ PHE 56 HZ PHE 56 1.456 -1.777 -0.691
355 H ASP 57 H ASP 57 -1.336 -1.606 -8.259
356 HA ASP 57 HA ASP 57 0.015 -2.768 -10.604
357 HB2 ASP 57 2HB ASP 57 -2.794 -2.409 -9.920
358 HB3 ASP 57 1HB ASP 57 -2.403 -1.718 -11.493
359 H GLY 58 H GLY 58 -2.075 0.075 -10.110
360 HA2 GLY 58 2HA GLY 58 -0.856 2.283 -10.112
361 HA3 GLY 58 1HA GLY 58 -0.041 1.668 -11.543
362 H GLN 59 H GLN 59 -2.072 0.544 -12.968
363 HA GLN 59 HA GLN 59 -3.583 2.916 -13.754
364 HB2 GLN 59 2HB GLN 59 -2.202 1.136 -15.256
365 HB3 GLN 59 1HB GLN 59 -3.814 0.437 -15.348
366 HG2 GLN 59 2HG GLN 59 -3.532 1.876 -17.215
367 HG3 GLN 59 1HG GLN 59 -4.658 2.653 -16.103
368 HE21 GLN 59 1HE2 GLN 59 -1.626 2.844 -17.686
369 HE22 GLN 59 2HE2 GLN 59 -1.161 4.399 -17.096
370 H THR 60 H THR 60 -4.066 -0.421 -12.733
371 HA THR 60 HA THR 60 -6.966 -0.072 -12.798
372 HB THR 60 HB THR 60 -5.508 -2.563 -11.946
373 HG1 THR 60 1HG THR 60 -6.238 -1.897 -14.600
374 HG21 THR 60 3HG2 THR 60 -7.450 -3.706 -12.863
375 HG22 THR 60 1HG2 THR 60 -8.170 -2.152 -13.285
376 HG23 THR 60 2HG2 THR 60 -7.910 -2.573 -11.591
377 HA PRO 61 HA PRO 61 -6.439 1.049 -8.419
378 HB2 PRO 61 2HB PRO 61 -8.969 2.008 -8.112
379 HB3 PRO 61 1HB PRO 61 -7.652 2.959 -8.805
380 HG2 PRO 61 2HG PRO 61 -9.836 1.456 -10.192
381 HG3 PRO 61 1HG PRO 61 -9.187 3.068 -10.547
382 HD2 PRO 61 2HD PRO 61 -8.480 0.882 -11.968
383 HD3 PRO 61 1HD PRO 61 -7.354 2.221 -11.666
384 H LYS 62 H LYS 62 -6.812 -0.198 -6.683
385 HA LYS 62 HA LYS 62 -9.158 -1.955 -6.660
386 HB2 LYS 62 2HB LYS 62 -7.739 -3.824 -5.829
387 HB3 LYS 62 1HB LYS 62 -7.396 -3.367 -7.491
388 HG2 LYS 62 2HG LYS 62 -5.779 -2.161 -5.301
389 HG3 LYS 62 1HG LYS 62 -5.459 -3.825 -5.796
390 HD2 LYS 62 2HD LYS 62 -5.239 -3.010 -8.143
391 HD3 LYS 62 1HD LYS 62 -5.386 -1.360 -7.534
392 HE2 LYS 62 2HE LYS 62 -3.366 -3.050 -6.208
393 HE3 LYS 62 1HE LYS 62 -3.034 -2.631 -7.888
394 HZ1 LYS 62 3HZ LYS 62 -3.891 -0.474 -6.119
395 HZ2 LYS 62 1HZ LYS 62 -2.774 -0.451 -7.390
396 HZ3 LYS 62 2HZ LYS 62 -2.330 -1.082 -5.885
397 H VAL 63 H VAL 63 -9.706 -2.768 -4.539
398 HA VAL 63 HA VAL 63 -8.436 -1.417 -2.278
399 HB VAL 63 HB VAL 63 -11.427 -1.340 -2.673
400 HG11 VAL 63 1HG1 VAL 63 -10.731 -1.337 -0.348
401 HG12 VAL 63 2HG1 VAL 63 -11.354 0.250 -0.800
402 HG13 VAL 63 3HG1 VAL 63 -9.615 -0.007 -0.664
403 HG21 VAL 63 3HG2 VAL 63 -10.347 0.073 -4.341
404 HG22 VAL 63 1HG2 VAL 63 -9.412 0.869 -3.075
405 HG23 VAL 63 2HG2 VAL 63 -11.164 1.052 -3.123
406 H CYS 64 H CYS 64 -8.863 -2.396 -0.243
407 HA CYS 64 HA CYS 64 -9.710 -5.195 -0.485
408 HB2 CYS 64 2HB CYS 64 -7.737 -3.765 1.211
409 HB3 CYS 64 1HB CYS 64 -8.571 -5.132 1.942
410 H CYS 65 H CYS 65 -11.572 -5.824 0.364
411 HA CYS 65 HA CYS 65 -12.740 -4.227 2.543
412 HB2 CYS 65 2HB CYS 65 -13.936 -5.109 -0.032
413 HB3 CYS 65 1HB CYS 65 -14.965 -5.181 1.393
414 HA PRO 66 HA PRO 66 -12.515 -8.281 4.486
415 HB2 PRO 66 2HB PRO 66 -13.694 -7.523 6.835
416 HB3 PRO 66 1HB PRO 66 -11.989 -7.249 6.462
417 HG2 PRO 66 2HG PRO 66 -14.300 -5.359 6.260
418 HG3 PRO 66 1HG PRO 66 -12.662 -5.065 6.876
419 HD2 PRO 66 2HD PRO 66 -13.417 -4.289 4.411
420 HD3 PRO 66 1HD PRO 66 -11.767 -4.850 4.753