Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
565225 | 2lwl RC | 18634 | cing | 1-original | 6 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H PHE 1 1H PHE 1 10.056 -11.943 0.736
2 HA PHE 1 HA PHE 1 8.135 -13.142 -0.049
3 HB2 PHE 1 1HB PHE 1 8.763 -13.476 2.887
4 HB3 PHE 1 2HB PHE 1 7.861 -14.647 1.932
5 HD1 PHE 1 HD1 PHE 1 8.971 -15.836 0.076
6 HD2 PHE 1 HD2 PHE 1 11.124 -13.334 2.758
7 HE1 PHE 1 HE1 PHE 1 11.075 -16.887 -0.637
8 HE2 PHE 1 HE2 PHE 1 13.231 -14.382 2.050
9 HZ PHE 1 HZ PHE 1 13.205 -16.160 0.348
10 H PHE 2 H PHE 2 7.394 -11.254 2.894
11 HA PHE 2 HA PHE 2 4.726 -12.011 3.140
12 HB2 PHE 2 1HB PHE 2 6.072 -9.421 3.897
13 HB3 PHE 2 2HB PHE 2 4.421 -9.822 4.346
14 HD1 PHE 2 HD2 PHE 2 4.349 -12.404 5.332
15 HD2 PHE 2 HD1 PHE 2 7.567 -9.634 5.607
16 HE1 PHE 2 HE2 PHE 2 5.176 -13.567 7.334
17 HE2 PHE 2 HE1 PHE 2 8.401 -10.794 7.610
18 HZ PHE 2 HZ PHE 2 7.202 -12.764 8.476
19 H ASP 3 H ASP 3 5.832 -8.890 1.756
20 HA ASP 3 HA ASP 3 3.244 -8.611 0.521
21 HB2 ASP 3 1HB ASP 3 3.976 -6.425 -0.234
22 HB3 ASP 3 2HB ASP 3 4.282 -6.634 1.483
23 H GLU 4 H GLU 4 5.954 -10.223 -0.315
24 HA GLU 4 HA GLU 4 5.799 -9.978 -3.150
25 HB2 GLU 4 1HB GLU 4 7.676 -11.121 -1.942
26 HB3 GLU 4 2HB GLU 4 6.562 -12.413 -1.513
27 HG2 GLU 4 1HG GLU 4 6.183 -12.698 -4.006
28 HG3 GLU 4 2HG GLU 4 7.593 -11.664 -4.226
29 H LYS 5 H LYS 5 4.251 -11.935 -0.685
30 HA LYS 5 HA LYS 5 2.456 -13.288 -2.426
31 HB2 LYS 5 1HB LYS 5 3.104 -13.971 -0.067
32 HB3 LYS 5 2HB LYS 5 2.047 -12.691 0.503
33 HG2 LYS 5 1HG LYS 5 0.952 -14.862 0.588
34 HG3 LYS 5 2HG LYS 5 0.139 -13.776 -0.540
35 HD2 LYS 5 1HD LYS 5 1.009 -14.899 -2.415
36 HD3 LYS 5 2HD LYS 5 2.217 -15.745 -1.449
37 HE2 LYS 5 1HE LYS 5 0.368 -17.214 -2.137
38 HE3 LYS 5 2HE LYS 5 0.495 -17.066 -0.386
39 HZ1 LYS 5 3HZ LYS 5 -1.313 -15.448 -0.446
40 HZ2 LYS 5 1HZ LYS 5 -1.790 -16.935 -1.092
41 HZ3 LYS 5 2HZ LYS 5 -1.448 -15.643 -2.122
42 H CYS 6 H CYS 6 2.437 -10.231 -0.682
43 HA CYS 6 HA CYS 6 -0.241 -9.524 -1.177
44 HB2 CYS 6 1HB CYS 6 1.300 -8.281 0.384
45 HB3 CYS 6 2HB CYS 6 2.105 -7.612 -1.030
46 HG CYS 6 HG CYS 6 0.557 -5.613 -1.301
47 H ASN 7 H ASN 7 2.691 -9.202 -3.112
48 HA ASN 7 HA ASN 7 1.654 -7.711 -5.241
49 HB2 ASN 7 1HB ASN 7 4.087 -8.463 -4.796
50 HB3 ASN 7 2HB ASN 7 3.635 -9.955 -5.608
51 HD21 ASN 7 1HD2 ASN 7 5.609 -8.034 -6.421
52 HD22 ASN 7 2HD2 ASN 7 5.129 -7.451 -7.978
53 H LYS 8 H LYS 8 1.658 -11.179 -4.598
54 HA LYS 8 HA LYS 8 0.295 -11.999 -6.931
55 HB2 LYS 8 1HB LYS 8 1.465 -13.581 -5.489
56 HB3 LYS 8 2HB LYS 8 0.355 -13.235 -4.172
57 HG2 LYS 8 1HG LYS 8 -0.216 -15.336 -5.185
58 HG3 LYS 8 2HG LYS 8 -1.489 -14.162 -5.515
59 HD2 LYS 8 1HD LYS 8 -0.555 -13.791 -7.752
60 HD3 LYS 8 2HD LYS 8 0.708 -14.978 -7.417
61 HE2 LYS 8 1HE LYS 8 -2.261 -15.512 -7.490
62 HE3 LYS 8 2HE LYS 8 -1.098 -15.955 -8.737
63 HZ1 LYS 8 3HZ LYS 8 -1.082 -16.966 -5.944
64 HZ2 LYS 8 1HZ LYS 8 0.002 -17.407 -7.163
65 HZ3 LYS 8 2HZ LYS 8 -1.630 -17.822 -7.294
66 H LEU 9 H LEU 9 -0.836 -10.876 -3.786
67 HA LEU 9 HA LEU 9 -3.623 -11.201 -4.447
68 HB2 LEU 9 1HB LEU 9 -2.093 -10.111 -2.132
69 HB3 LEU 9 2HB LEU 9 -3.762 -9.618 -2.323
70 HG LEU 9 HG LEU 9 -3.512 -11.505 -0.766
71 HD11 LEU 9 1HD1 LEU 9 -5.244 -12.925 -1.712
72 HD12 LEU 9 2HD1 LEU 9 -4.955 -12.232 -3.308
73 HD13 LEU 9 3HD1 LEU 9 -5.590 -11.222 -2.010
74 HD21 LEU 9 3HD2 LEU 9 -2.920 -13.723 -1.606
75 HD22 LEU 9 1HD2 LEU 9 -1.576 -12.593 -1.767
76 HD23 LEU 9 2HD2 LEU 9 -2.538 -13.027 -3.180
77 H LYS 10 H LYS 10 -1.380 -9.186 -5.577
78 HA LYS 10 HA LYS 10 -1.529 -7.456 -7.025
79 HB2 LYS 10 1HB LYS 10 -4.502 -7.528 -6.484
80 HB3 LYS 10 2HB LYS 10 -3.717 -6.615 -7.764
81 HG2 LYS 10 1HG LYS 10 -3.684 -9.614 -7.499
82 HG3 LYS 10 2HG LYS 10 -4.738 -8.695 -8.572
83 HD2 LYS 10 1HD LYS 10 -1.724 -8.631 -8.671
84 HD3 LYS 10 2HD LYS 10 -2.732 -9.652 -9.694
85 HE2 LYS 10 1HE LYS 10 -3.841 -7.625 -10.565
86 HE3 LYS 10 2HE LYS 10 -2.748 -6.639 -9.598
87 HZ1 LYS 10 3HZ LYS 10 -1.930 -8.508 -11.754
88 HZ2 LYS 10 1HZ LYS 10 -0.886 -7.549 -10.831
89 HZ3 LYS 10 2HZ LYS 10 -1.994 -6.822 -11.881
90 H GLY 11 H GLY 11 -1.156 -7.148 -4.142
91 HA2 GLY 11 1HA GLY 11 -2.244 -4.502 -3.595
92 HA3 GLY 11 2HA GLY 11 -1.190 -5.440 -2.541
93 H THR 12 H THR 12 -1.249 -2.646 -4.048
94 HA THR 12 HA THR 12 1.375 -2.785 -5.315
95 HB THR 12 HB THR 12 0.788 -0.290 -5.776
96 HG1 THR 12 HG1 THR 12 -1.142 -0.648 -4.256
97 HG21 THR 12 1HG2 THR 12 -0.767 -2.525 -7.074
98 HG22 THR 12 2HG2 THR 12 0.888 -2.060 -7.469
99 HG23 THR 12 3HG2 THR 12 -0.441 -0.941 -7.779
100 H CYS 13 H CYS 13 3.189 -1.946 -4.460
101 HA CYS 13 HA CYS 13 3.088 -0.954 -1.753
102 HB2 CYS 13 1HB CYS 13 5.574 -1.023 -3.457
103 HB3 CYS 13 2HB CYS 13 5.428 -1.152 -1.712
104 HG CYS 13 HG CYS 13 5.620 -3.691 -1.697
105 H LYS 14 H LYS 14 2.446 1.051 -1.453
106 HA LYS 14 HA LYS 14 3.722 3.166 -3.044
107 HB2 LYS 14 1HB LYS 14 1.586 4.491 -2.718
108 HB3 LYS 14 2HB LYS 14 1.485 3.142 -3.840
109 HG2 LYS 14 1HG LYS 14 0.354 1.796 -2.228
110 HG3 LYS 14 2HG LYS 14 0.619 2.997 -0.967
111 HD2 LYS 14 1HD LYS 14 -1.675 3.081 -1.782
112 HD3 LYS 14 2HD LYS 14 -0.819 4.575 -2.158
113 HE2 LYS 14 1HE LYS 14 -0.953 2.367 -4.169
114 HE3 LYS 14 2HE LYS 14 -2.328 3.445 -3.952
115 HZ1 LYS 14 3HZ LYS 14 -0.834 4.178 -5.721
116 HZ2 LYS 14 1HZ LYS 14 0.431 4.321 -4.613
117 HZ3 LYS 14 2HZ LYS 14 -0.924 5.320 -4.478
118 H ASN 15 H ASN 15 3.493 5.357 -1.808
119 HA ASN 15 HA ASN 15 4.702 4.903 0.746
120 HB2 ASN 15 1HB ASN 15 5.054 6.847 -1.015
121 HB3 ASN 15 2HB ASN 15 3.805 7.603 -0.047
122 HD21 ASN 15 1HD2 ASN 15 4.696 6.255 2.411
123 HD22 ASN 15 2HD2 ASN 15 6.131 7.083 2.899
124 H ASN 16 H ASN 16 1.838 6.748 -0.248
125 HA ASN 16 HA ASN 16 0.653 6.175 2.396
126 HB2 ASN 16 1HB ASN 16 -0.674 8.213 2.127
127 HB3 ASN 16 2HB ASN 16 1.041 8.577 1.994
128 HD21 ASN 16 1HD2 ASN 16 1.904 9.096 -0.042
129 HD22 ASN 16 2HD2 ASN 16 0.892 9.654 -1.331
130 H CYS 17 H CYS 17 -1.373 5.286 2.494
131 HA CYS 17 HA CYS 17 -2.194 3.789 0.210
132 HB2 CYS 17 1HB CYS 17 -3.764 4.175 2.758
133 HB3 CYS 17 2HB CYS 17 -3.847 2.825 1.636
134 HG CYS 17 HG CYS 17 -1.022 2.227 2.253
135 H GLY 18 H GLY 18 -3.880 4.089 -1.146
136 HA2 GLY 18 1HA GLY 18 -5.049 6.767 -1.141
137 HA3 GLY 18 2HA GLY 18 -4.962 5.676 -2.513
138 H LYS 19 H LYS 19 -7.140 6.148 -2.885
139 HA LYS 19 HA LYS 19 -9.330 5.989 -1.329
140 HB2 LYS 19 1HB LYS 19 -10.605 5.718 -3.276
141 HB3 LYS 19 2HB LYS 19 -9.141 6.511 -3.813
142 HG2 LYS 19 1HG LYS 19 -9.918 3.630 -4.207
143 HG3 LYS 19 2HG LYS 19 -9.764 4.880 -5.435
144 HD2 LYS 19 1HD LYS 19 -7.489 3.772 -3.788
145 HD3 LYS 19 2HD LYS 19 -7.884 3.275 -5.430
146 HE2 LYS 19 1HE LYS 19 -7.420 5.508 -6.245
147 HE3 LYS 19 2HE LYS 19 -7.120 6.068 -4.602
148 HZ1 LYS 19 3HZ LYS 19 -5.287 4.401 -4.490
149 HZ2 LYS 19 1HZ LYS 19 -5.029 5.643 -5.621
150 HZ3 LYS 19 2HZ LYS 19 -5.516 4.110 -6.144
151 H ASN 20 H ASN 20 -9.925 4.583 0.131
152 HA ASN 20 HA ASN 20 -10.544 2.670 1.174
153 HB2 ASN 20 1HB ASN 20 -10.869 1.721 -1.677
154 HB3 ASN 20 2HB ASN 20 -11.417 0.815 -0.270
155 HD21 ASN 20 1HD2 ASN 20 -13.139 1.618 0.956
156 HD22 ASN 20 2HD2 ASN 20 -14.236 2.790 0.311
157 H GLU 21 H GLU 21 -7.657 3.038 0.189
158 HA GLU 21 HA GLU 21 -6.799 0.246 0.100
159 HB2 GLU 21 1HB GLU 21 -5.353 2.859 -0.375
160 HB3 GLU 21 2HB GLU 21 -4.513 1.318 -0.294
161 HG2 GLU 21 1HG GLU 21 -5.779 0.500 -2.186
162 HG3 GLU 21 2HG GLU 21 -6.710 1.993 -2.243
163 H GLU 22 H GLU 22 -5.655 -0.732 1.669
164 HA GLU 22 HA GLU 22 -5.057 0.858 4.071
165 HB2 GLU 22 1HB GLU 22 -5.497 -1.238 5.368
166 HB3 GLU 22 2HB GLU 22 -6.915 -0.522 4.624
167 HG2 GLU 22 1HG GLU 22 -6.740 -2.177 2.800
168 HG3 GLU 22 2HG GLU 22 -5.383 -2.920 3.644
169 H LEU 23 H LEU 23 -3.297 0.117 5.360
170 HA LEU 23 HA LEU 23 -1.066 -0.807 3.764
171 HB2 LEU 23 1HB LEU 23 -1.206 0.997 5.709
172 HB3 LEU 23 2HB LEU 23 -0.939 -0.400 6.711
173 HG LEU 23 HG LEU 23 0.924 0.495 4.519
174 HD11 LEU 23 1HD1 LEU 23 2.360 1.214 6.419
175 HD12 LEU 23 2HD1 LEU 23 0.993 0.948 7.498
176 HD13 LEU 23 3HD1 LEU 23 0.893 2.171 6.233
177 HD21 LEU 23 3HD2 LEU 23 2.481 -1.048 5.583
178 HD22 LEU 23 1HD2 LEU 23 1.030 -1.883 5.031
179 HD23 LEU 23 2HD2 LEU 23 1.232 -1.508 6.739
180 H ILE 24 H ILE 24 -0.608 -2.904 3.570
181 HA ILE 24 HA ILE 24 -1.670 -4.730 5.624
182 HB ILE 24 HB ILE 24 -2.317 -6.266 4.026
183 HG12 ILE 24 1HG1 ILE 24 -1.321 -5.705 1.532
184 HG13 ILE 24 2HG1 ILE 24 0.050 -5.326 2.572
185 HG21 ILE 24 1HG2 ILE 24 -3.557 -4.159 3.763
186 HG22 ILE 24 2HG2 ILE 24 -3.486 -5.108 2.279
187 HG23 ILE 24 3HG2 ILE 24 -2.446 -3.698 2.470
188 HD11 ILE 24 3HD1 ILE 24 0.150 -7.624 1.818
189 HD12 ILE 24 1HD1 ILE 24 -1.449 -7.936 2.493
190 HD13 ILE 24 2HD1 ILE 24 -0.097 -7.561 3.562
191 H ALA 25 H ALA 25 1.157 -3.704 3.953
192 HA ALA 25 HA ALA 25 2.792 -5.420 5.590
193 HB1 ALA 25 3HB ALA 25 2.854 -5.757 2.594
194 HB2 ALA 25 1HB ALA 25 2.260 -6.941 3.757
195 HB3 ALA 25 2HB ALA 25 3.970 -6.500 3.742
196 H LEU 26 H LEU 26 4.930 -4.806 5.660
197 HA LEU 26 HA LEU 26 5.397 -2.079 4.709
198 HB2 LEU 26 1HB LEU 26 6.598 -3.755 6.889
199 HB3 LEU 26 2HB LEU 26 7.331 -2.243 6.377
200 HG LEU 26 HG LEU 26 4.563 -2.569 7.546
201 HD11 LEU 26 1HD1 LEU 26 6.303 -2.892 9.200
202 HD12 LEU 26 2HD1 LEU 26 5.497 -1.344 9.453
203 HD13 LEU 26 3HD1 LEU 26 7.088 -1.397 8.696
204 HD21 LEU 26 3HD2 LEU 26 4.529 -0.119 7.591
205 HD22 LEU 26 1HD2 LEU 26 4.625 -0.742 5.944
206 HD23 LEU 26 2HD2 LEU 26 6.064 -0.086 6.725
207 H CYS 27 H CYS 27 6.605 -1.806 2.988
208 HA CYS 27 HA CYS 27 8.353 -3.967 2.087
209 HB2 CYS 27 1HB CYS 27 7.465 -1.457 0.645
210 HB3 CYS 27 2HB CYS 27 8.293 -2.831 -0.075
211 HG CYS 27 HG CYS 27 6.226 -4.536 -0.080
212 H GLN 28 H GLN 28 10.322 -2.961 0.769
213 HA GLN 28 HA GLN 28 11.866 -1.408 2.660
214 HB2 GLN 28 1HB GLN 28 12.662 -2.422 -0.065
215 HB3 GLN 28 2HB GLN 28 13.741 -1.809 1.173
216 HG2 GLN 28 1HG GLN 28 12.045 -4.275 1.470
217 HG3 GLN 28 2HG GLN 28 13.734 -4.275 0.975
218 HE21 GLN 28 1HE2 GLN 28 14.481 -2.119 2.762
219 HE22 GLN 28 2HE2 GLN 28 14.501 -2.789 4.355
220 H LYS 29 H LYS 29 13.277 0.380 1.642
221 HA LYS 29 HA LYS 29 13.455 2.439 0.672
222 HB2 LYS 29 1HB LYS 29 11.466 1.312 -1.288
223 HB3 LYS 29 2HB LYS 29 12.387 2.787 -1.523
224 HG2 LYS 29 1HG LYS 29 14.411 1.609 -1.744
225 HG3 LYS 29 2HG LYS 29 13.705 0.124 -1.102
226 HD2 LYS 29 1HD LYS 29 12.870 1.429 -3.692
227 HD3 LYS 29 2HD LYS 29 14.025 0.100 -3.574
228 HE2 LYS 29 1HE LYS 29 12.309 -1.310 -2.559
229 HE3 LYS 29 2HE LYS 29 11.150 0.016 -2.644
230 HZ1 LYS 29 3HZ LYS 29 12.456 -1.273 -4.977
231 HZ2 LYS 29 1HZ LYS 29 11.315 -0.026 -5.041
232 HZ3 LYS 29 2HZ LYS 29 10.870 -1.552 -4.465
233 H SER 30 H SER 30 11.115 1.567 2.472
234 HA SER 30 HA SER 30 9.583 2.656 3.717
235 HB2 SER 30 1HB SER 30 10.269 5.043 1.998
236 HB3 SER 30 2HB SER 30 9.193 5.094 3.395
237 HG SER 30 HG SER 30 11.892 4.205 3.463
238 H LEU 31 H LEU 31 9.111 1.580 0.746
239 HA LEU 31 HA LEU 31 6.475 2.611 0.291
240 HB2 LEU 31 1HB LEU 31 8.019 0.274 -0.822
241 HB3 LEU 31 2HB LEU 31 6.341 0.539 -1.219
242 HG LEU 31 HG LEU 31 7.852 1.368 -2.939
243 HD11 LEU 31 1HD1 LEU 31 6.350 3.550 -1.514
244 HD12 LEU 31 2HD1 LEU 31 5.673 2.403 -2.671
245 HD13 LEU 31 3HD1 LEU 31 6.870 3.588 -3.199
246 HD21 LEU 31 3HD2 LEU 31 9.750 2.002 -1.595
247 HD22 LEU 31 1HD2 LEU 31 8.814 3.299 -0.855
248 HD23 LEU 31 2HD2 LEU 31 9.204 3.361 -2.574
249 H LYS 32 H LYS 32 4.506 1.472 0.597
250 HA LYS 32 HA LYS 32 4.647 -0.837 2.424
251 HB2 LYS 32 1HB LYS 32 2.623 1.412 2.569
252 HB3 LYS 32 2HB LYS 32 2.637 -0.023 3.578
253 HG2 LYS 32 1HG LYS 32 3.556 1.538 4.979
254 HG3 LYS 32 2HG LYS 32 5.001 0.817 4.273
255 HD2 LYS 32 1HD LYS 32 5.157 2.656 2.681
256 HD3 LYS 32 2HD LYS 32 3.681 3.366 3.337
257 HE2 LYS 32 1HE LYS 32 6.210 2.904 4.911
258 HE3 LYS 32 2HE LYS 32 5.764 4.436 4.164
259 HZ1 LYS 32 3HZ LYS 32 3.785 4.492 5.552
260 HZ2 LYS 32 1HZ LYS 32 5.180 4.390 6.501
261 HZ3 LYS 32 2HZ LYS 32 4.215 3.024 6.267
262 H CYS 33 H CYS 33 3.297 -2.527 1.883
263 HA CYS 33 HA CYS 33 2.109 -2.376 -0.724
264 HB2 CYS 33 1HB CYS 33 3.025 -4.477 0.890
265 HB3 CYS 33 2HB CYS 33 1.283 -4.715 0.762
266 HG CYS 33 HG CYS 33 3.386 -4.350 -1.921
267 H CYS 34 H CYS 34 0.314 -1.338 -1.018
268 HA CYS 34 HA CYS 34 -1.752 -1.442 1.068
269 HB2 CYS 34 1HB CYS 34 -1.408 0.617 -1.120
270 HB3 CYS 34 2HB CYS 34 -2.540 0.686 0.227
271 HG CYS 34 HG CYS 34 0.860 0.719 0.627
272 H ARG 35 H ARG 35 -3.598 -2.397 0.622
273 HA ARG 35 HA ARG 35 -4.022 -3.416 -2.092
274 HB2 ARG 35 1HB ARG 35 -5.387 -4.109 0.514
275 HB3 ARG 35 2HB ARG 35 -5.712 -4.880 -1.027
276 HG2 ARG 35 1HG ARG 35 -3.496 -5.800 -1.098
277 HG3 ARG 35 2HG ARG 35 -3.045 -4.914 0.361
278 HD2 ARG 35 1HD ARG 35 -3.529 -7.091 1.114
279 HD3 ARG 35 2HD ARG 35 -4.963 -6.139 1.493
280 HE ARG 35 HE ARG 35 -5.127 -7.438 -1.060
281 HH11 ARG 35 1HH1 ARG 35 -5.683 -7.774 2.379
282 HH12 ARG 35 2HH1 ARG 35 -6.838 -9.056 2.200
283 HH21 ARG 35 1HH2 ARG 35 -6.676 -9.111 -1.304
284 HH22 ARG 35 2HH2 ARG 35 -7.416 -9.803 0.104
285 H THR 36 H THR 36 -5.585 -2.672 -3.381
286 HA THR 36 HA THR 36 -7.257 -0.485 -2.524
287 HB THR 36 HB THR 36 -7.417 -1.958 -5.160
288 HG1 THR 36 HG1 THR 36 -5.443 -0.286 -4.149
289 HG21 THR 36 1HG2 THR 36 -8.224 0.193 -5.999
290 HG22 THR 36 2HG2 THR 36 -8.040 0.897 -4.392
291 HG23 THR 36 3HG2 THR 36 -9.233 -0.372 -4.665
292 H ILE 37 H ILE 37 -8.597 -1.304 -0.981
293 HA ILE 37 HA ILE 37 -9.930 -3.797 -1.211
294 HB ILE 37 HB ILE 37 -10.497 -1.499 0.656
295 HG12 ILE 37 1HG1 ILE 37 -8.160 -2.082 0.805
296 HG13 ILE 37 2HG1 ILE 37 -8.983 -2.713 2.218
297 HG21 ILE 37 1HG2 ILE 37 -11.193 -3.461 2.154
298 HG22 ILE 37 2HG2 ILE 37 -11.277 -4.385 0.654
299 HG23 ILE 37 3HG2 ILE 37 -12.288 -2.960 0.868
300 HD11 ILE 37 3HD1 ILE 37 -8.056 -4.253 -0.184
301 HD12 ILE 37 1HD1 ILE 37 -9.049 -4.931 1.103
302 HD13 ILE 37 2HD1 ILE 37 -7.429 -4.343 1.462
303 H GLN 38 H GLN 38 -12.047 -4.261 -1.643
304 HA GLN 38 HA GLN 38 -13.492 -2.359 -3.251
305 HB2 GLN 38 1HB GLN 38 -15.145 -4.258 -3.448
306 HB3 GLN 38 2HB GLN 38 -13.529 -4.599 -4.042
307 HG2 GLN 38 1HG GLN 38 -13.013 -5.851 -2.046
308 HG3 GLN 38 2HG GLN 38 -14.569 -5.425 -1.342
309 HE21 GLN 38 1HE2 GLN 38 -15.203 -7.560 -1.128
310 HE22 GLN 38 2HE2 GLN 38 -15.639 -8.534 -2.486
311 HA PRO 39 HA PRO 39 -15.980 -1.022 0.239
312 HB2 PRO 39 1HB PRO 39 -17.446 0.681 -1.554
313 HB3 PRO 39 2HB PRO 39 -16.218 1.139 -0.375
314 HG2 PRO 39 1HG PRO 39 -15.893 1.321 -3.095
315 HG3 PRO 39 2HG PRO 39 -14.559 1.172 -1.937
316 HD2 PRO 39 1HD PRO 39 -15.831 -0.928 -3.648
317 HD3 PRO 39 2HD PRO 39 -14.119 -0.680 -3.242
318 H SER 40 H SER 40 -18.482 -0.368 0.308
319 HA SER 40 HA SER 40 -20.674 -0.896 0.071
320 HB2 SER 40 1HB SER 40 -20.214 -1.225 -2.385
321 HB3 SER 40 2HB SER 40 -19.936 -2.929 -2.036
322 HG SER 40 HG SER 40 -22.005 -3.215 -2.011
323 H GLY 41 H GLY 41 -18.524 -3.680 -0.089
324 HA2 GLY 41 1HA GLY 41 -20.236 -5.075 1.854
325 HA3 GLY 41 2HA GLY 41 -18.988 -5.824 0.866
326 H SER 42 H SER 42 -18.815 -6.531 3.378
327 HA SER 42 HA SER 42 -17.347 -4.758 5.061
328 HB2 SER 42 1HB SER 42 -17.466 -7.742 5.154
329 HB3 SER 42 2HB SER 42 -16.969 -6.686 6.469
330 HG SER 42 HG SER 42 -19.547 -6.623 5.262
331 H ILE 43 H ILE 43 -15.845 -4.143 3.439
332 HA ILE 43 HA ILE 43 -13.820 -4.118 2.393
333 HB ILE 43 HB ILE 43 -11.935 -4.806 4.059
334 HG12 ILE 43 1HG1 ILE 43 -14.157 -4.431 6.061
335 HG13 ILE 43 2HG1 ILE 43 -13.736 -6.049 5.512
336 HG21 ILE 43 1HG2 ILE 43 -13.854 -2.548 4.618
337 HG22 ILE 43 2HG2 ILE 43 -12.532 -2.527 3.452
338 HG23 ILE 43 3HG2 ILE 43 -12.185 -2.641 5.177
339 HD11 ILE 43 3HD1 ILE 43 -12.635 -5.529 7.601
340 HD12 ILE 43 1HD1 ILE 43 -11.914 -4.084 6.892
341 HD13 ILE 43 2HD1 ILE 43 -11.439 -5.680 6.314
342 H ILE 44 H ILE 44 -12.100 -6.485 4.028
343 HA ILE 44 HA ILE 44 -12.569 -8.477 1.937
344 HB ILE 44 HB ILE 44 -10.220 -8.898 1.703
345 HG12 ILE 44 1HG1 ILE 44 -9.551 -8.236 4.039
346 HG13 ILE 44 2HG1 ILE 44 -8.463 -7.686 2.775
347 HG21 ILE 44 1HG2 ILE 44 -10.810 -5.977 1.411
348 HG22 ILE 44 2HG2 ILE 44 -11.208 -7.241 0.246
349 HG23 ILE 44 3HG2 ILE 44 -9.519 -6.851 0.582
350 HD11 ILE 44 3HD1 ILE 44 -9.556 -5.445 2.908
351 HD12 ILE 44 1HD1 ILE 44 -8.720 -5.944 4.380
352 HD13 ILE 44 2HD1 ILE 44 -10.473 -6.045 4.289
353 H ASP 45 H ASP 45 -13.027 -8.003 4.992
354 HA ASP 45 HA ASP 45 -12.122 -10.670 5.786
355 HB2 ASP 45 1HB ASP 45 -10.470 -9.042 6.646
356 HB3 ASP 45 2HB ASP 45 -11.762 -8.194 7.489
Start of MODEL 2
1 H PHE 1 1H PHE 1 10.336 -11.160 0.037
2 HA PHE 1 HA PHE 1 8.617 -13.447 0.765
3 HB2 PHE 1 1HB PHE 1 10.387 -11.675 2.462
4 HB3 PHE 1 2HB PHE 1 9.206 -12.805 3.111
5 HD1 PHE 1 HD1 PHE 1 9.537 -15.228 2.840
6 HD2 PHE 1 HD2 PHE 1 12.497 -12.412 1.658
7 HE1 PHE 1 HE1 PHE 1 11.220 -17.021 2.800
8 HE2 PHE 1 HE2 PHE 1 14.187 -14.199 1.613
9 HZ PHE 1 HZ PHE 1 13.549 -16.508 2.186
10 H PHE 2 H PHE 2 9.214 -10.056 1.718
11 HA PHE 2 HA PHE 2 6.693 -9.622 2.783
12 HB2 PHE 2 1HB PHE 2 8.730 -7.724 1.648
13 HB3 PHE 2 2HB PHE 2 7.216 -7.155 2.341
14 HD1 PHE 2 HD1 PHE 2 6.709 -7.668 4.734
15 HD2 PHE 2 HD2 PHE 2 10.543 -8.331 3.019
16 HE1 PHE 2 HE1 PHE 2 7.701 -7.727 6.983
17 HE2 PHE 2 HE2 PHE 2 11.542 -8.391 5.262
18 HZ PHE 2 HZ PHE 2 10.119 -8.088 7.249
19 H ASP 3 H ASP 3 7.827 -8.614 -0.471
20 HA ASP 3 HA ASP 3 5.074 -8.008 -1.110
21 HB2 ASP 3 1HB ASP 3 5.880 -7.100 -3.211
22 HB3 ASP 3 2HB ASP 3 6.739 -6.406 -1.845
23 H GLU 4 H GLU 4 6.815 -10.749 -1.101
24 HA GLU 4 HA GLU 4 5.691 -12.009 -3.420
25 HB2 GLU 4 1HB GLU 4 7.653 -12.900 -2.077
26 HB3 GLU 4 2HB GLU 4 6.509 -13.319 -0.812
27 HG2 GLU 4 1HG GLU 4 7.063 -15.253 -2.157
28 HG3 GLU 4 2HG GLU 4 5.361 -14.831 -2.337
29 H LYS 5 H LYS 5 4.867 -11.599 -0.039
30 HA LYS 5 HA LYS 5 2.304 -12.776 -0.097
31 HB2 LYS 5 1HB LYS 5 3.607 -12.174 1.961
32 HB3 LYS 5 2HB LYS 5 3.273 -10.485 1.620
33 HG2 LYS 5 1HG LYS 5 1.757 -11.240 3.304
34 HG3 LYS 5 2HG LYS 5 0.848 -10.979 1.814
35 HD2 LYS 5 1HD LYS 5 0.759 -13.321 1.366
36 HD3 LYS 5 2HD LYS 5 1.905 -13.667 2.662
37 HE2 LYS 5 1HE LYS 5 -0.864 -12.523 3.026
38 HE3 LYS 5 2HE LYS 5 -0.410 -14.205 3.298
39 HZ1 LYS 5 3HZ LYS 5 0.583 -11.837 4.791
40 HZ2 LYS 5 1HZ LYS 5 1.163 -13.412 5.000
41 HZ3 LYS 5 2HZ LYS 5 -0.443 -13.046 5.376
42 H CYS 6 H CYS 6 3.512 -9.505 -0.716
43 HA CYS 6 HA CYS 6 1.076 -8.183 -1.040
44 HB2 CYS 6 1HB CYS 6 3.366 -7.123 -0.942
45 HB3 CYS 6 2HB CYS 6 3.612 -7.643 -2.603
46 HG CYS 6 HG CYS 6 2.068 -5.869 -3.790
47 H ASN 7 H ASN 7 3.036 -9.987 -3.362
48 HA ASN 7 HA ASN 7 1.545 -9.490 -5.673
49 HB2 ASN 7 1HB ASN 7 3.790 -10.619 -5.558
50 HB3 ASN 7 2HB ASN 7 2.971 -12.070 -5.003
51 HD21 ASN 7 1HD2 ASN 7 3.494 -13.322 -6.746
52 HD22 ASN 7 2HD2 ASN 7 2.860 -13.054 -8.332
53 H LYS 8 H LYS 8 1.270 -12.045 -3.254
54 HA LYS 8 HA LYS 8 -0.814 -13.493 -4.424
55 HB2 LYS 8 1HB LYS 8 0.451 -14.382 -2.555
56 HB3 LYS 8 2HB LYS 8 -0.146 -13.107 -1.502
57 HG2 LYS 8 1HG LYS 8 -1.294 -15.200 -1.071
58 HG3 LYS 8 2HG LYS 8 -2.413 -13.991 -1.704
59 HD2 LYS 8 1HD LYS 8 -2.180 -15.003 -3.948
60 HD3 LYS 8 2HD LYS 8 -1.140 -16.248 -3.253
61 HE2 LYS 8 1HE LYS 8 -4.018 -15.719 -2.521
62 HE3 LYS 8 2HE LYS 8 -3.428 -17.054 -3.510
63 HZ1 LYS 8 3HZ LYS 8 -2.168 -17.847 -1.594
64 HZ2 LYS 8 1HZ LYS 8 -3.824 -17.769 -1.253
65 HZ3 LYS 8 2HZ LYS 8 -2.781 -16.584 -0.650
66 H LEU 9 H LEU 9 -0.944 -10.716 -2.207
67 HA LEU 9 HA LEU 9 -3.838 -10.743 -2.231
68 HB2 LEU 9 1HB LEU 9 -1.809 -8.953 -0.927
69 HB3 LEU 9 2HB LEU 9 -3.509 -8.543 -0.946
70 HG LEU 9 HG LEU 9 -3.097 -9.525 1.156
71 HD11 LEU 9 1HD1 LEU 9 -4.496 -11.482 1.177
72 HD12 LEU 9 2HD1 LEU 9 -4.257 -11.716 -0.553
73 HD13 LEU 9 3HD1 LEU 9 -5.142 -10.307 0.032
74 HD21 LEU 9 3HD2 LEU 9 -1.997 -11.653 1.488
75 HD22 LEU 9 1HD2 LEU 9 -0.938 -10.541 0.619
76 HD23 LEU 9 2HD2 LEU 9 -1.769 -11.832 -0.252
77 H LYS 10 H LYS 10 -1.582 -9.746 -4.362
78 HA LYS 10 HA LYS 10 -1.606 -8.472 -6.229
79 HB2 LYS 10 1HB LYS 10 -4.582 -8.349 -5.717
80 HB3 LYS 10 2HB LYS 10 -3.786 -7.919 -7.223
81 HG2 LYS 10 1HG LYS 10 -3.787 -10.651 -5.965
82 HG3 LYS 10 2HG LYS 10 -4.792 -10.140 -7.321
83 HD2 LYS 10 1HD LYS 10 -2.777 -9.716 -8.646
84 HD3 LYS 10 2HD LYS 10 -1.777 -10.226 -7.286
85 HE2 LYS 10 1HE LYS 10 -2.003 -12.023 -8.904
86 HE3 LYS 10 2HE LYS 10 -2.779 -12.451 -7.382
87 HZ1 LYS 10 3HZ LYS 10 -4.213 -11.401 -9.756
88 HZ2 LYS 10 1HZ LYS 10 -4.912 -11.970 -8.327
89 HZ3 LYS 10 2HZ LYS 10 -4.101 -13.038 -9.357
90 H GLY 11 H GLY 11 -0.957 -7.182 -3.860
91 HA2 GLY 11 1HA GLY 11 -2.339 -4.596 -3.961
92 HA3 GLY 11 2HA GLY 11 -1.260 -5.139 -2.684
93 H THR 12 H THR 12 -0.814 -2.684 -3.489
94 HA THR 12 HA THR 12 1.603 -2.910 -5.148
95 HB THR 12 HB THR 12 1.003 -0.409 -5.707
96 HG1 THR 12 HG1 THR 12 -1.511 -1.584 -5.051
97 HG21 THR 12 1HG2 THR 12 1.255 -2.176 -7.369
98 HG22 THR 12 2HG2 THR 12 -0.135 -1.159 -7.752
99 HG23 THR 12 3HG2 THR 12 -0.376 -2.748 -7.025
100 H CYS 13 H CYS 13 3.402 -1.987 -4.309
101 HA CYS 13 HA CYS 13 3.267 -1.001 -1.609
102 HB2 CYS 13 1HB CYS 13 5.788 -0.856 -3.214
103 HB3 CYS 13 2HB CYS 13 5.554 -1.281 -1.525
104 HG CYS 13 HG CYS 13 5.841 -3.781 -1.918
105 H LYS 14 H LYS 14 2.581 0.998 -1.287
106 HA LYS 14 HA LYS 14 3.892 3.153 -2.784
107 HB2 LYS 14 1HB LYS 14 1.814 4.425 -2.896
108 HB3 LYS 14 2HB LYS 14 1.638 2.885 -3.727
109 HG2 LYS 14 1HG LYS 14 0.463 1.973 -1.798
110 HG3 LYS 14 2HG LYS 14 0.652 3.511 -0.954
111 HD2 LYS 14 1HD LYS 14 -1.555 3.427 -1.872
112 HD3 LYS 14 2HD LYS 14 -0.618 4.603 -2.796
113 HE2 LYS 14 1HE LYS 14 -0.262 2.946 -4.552
114 HE3 LYS 14 2HE LYS 14 -1.159 1.749 -3.619
115 HZ1 LYS 14 3HZ LYS 14 -3.126 3.133 -3.788
116 HZ2 LYS 14 1HZ LYS 14 -2.532 2.753 -5.329
117 HZ3 LYS 14 2HZ LYS 14 -2.265 4.290 -4.678
118 H ASN 15 H ASN 15 3.336 5.335 -1.553
119 HA ASN 15 HA ASN 15 4.223 4.823 1.159
120 HB2 ASN 15 1HB ASN 15 4.053 7.335 -0.498
121 HB3 ASN 15 2HB ASN 15 4.592 7.311 1.171
122 HD21 ASN 15 1HD2 ASN 15 6.587 6.373 1.673
123 HD22 ASN 15 2HD2 ASN 15 7.772 6.055 0.450
124 H ASN 16 H ASN 16 1.697 6.784 -0.447
125 HA ASN 16 HA ASN 16 0.235 6.739 2.114
126 HB2 ASN 16 1HB ASN 16 -0.853 8.800 1.480
127 HB3 ASN 16 2HB ASN 16 0.884 9.011 1.311
128 HD21 ASN 16 1HD2 ASN 16 1.780 9.099 -0.784
129 HD22 ASN 16 2HD2 ASN 16 0.806 9.509 -2.155
130 H CYS 17 H CYS 17 -1.699 5.802 2.206
131 HA CYS 17 HA CYS 17 -2.513 4.133 0.048
132 HB2 CYS 17 1HB CYS 17 -4.002 4.760 2.603
133 HB3 CYS 17 2HB CYS 17 -4.270 3.383 1.545
134 HG CYS 17 HG CYS 17 -1.449 2.595 2.038
135 H GLY 18 H GLY 18 -4.110 4.364 -1.400
136 HA2 GLY 18 1HA GLY 18 -5.316 7.000 -1.642
137 HA3 GLY 18 2HA GLY 18 -5.342 5.722 -2.846
138 H LYS 19 H LYS 19 -7.586 6.156 -3.123
139 HA LYS 19 HA LYS 19 -9.492 6.216 -1.130
140 HB2 LYS 19 1HB LYS 19 -11.038 5.307 -3.069
141 HB3 LYS 19 2HB LYS 19 -10.399 6.939 -3.078
142 HG2 LYS 19 1HG LYS 19 -10.133 6.143 -5.263
143 HG3 LYS 19 2HG LYS 19 -8.531 6.055 -4.543
144 HD2 LYS 19 1HD LYS 19 -8.743 3.684 -4.222
145 HD3 LYS 19 2HD LYS 19 -10.429 3.725 -4.738
146 HE2 LYS 19 1HE LYS 19 -8.999 2.895 -6.522
147 HE3 LYS 19 2HE LYS 19 -9.733 4.434 -6.969
148 HZ1 LYS 19 3HZ LYS 19 -6.965 4.071 -5.964
149 HZ2 LYS 19 1HZ LYS 19 -7.664 5.545 -6.409
150 HZ3 LYS 19 2HZ LYS 19 -7.398 4.347 -7.571
151 H ASN 20 H ASN 20 -9.880 4.849 0.374
152 HA ASN 20 HA ASN 20 -10.307 2.960 1.545
153 HB2 ASN 20 1HB ASN 20 -12.194 2.999 -0.197
154 HB3 ASN 20 2HB ASN 20 -11.295 1.733 -1.025
155 HD21 ASN 20 1HD2 ASN 20 -12.928 0.231 -0.718
156 HD22 ASN 20 2HD2 ASN 20 -13.262 -0.472 0.826
157 H GLU 21 H GLU 21 -7.730 3.084 1.030
158 HA GLU 21 HA GLU 21 -6.998 0.318 0.319
159 HB2 GLU 21 1HB GLU 21 -5.603 2.918 -0.211
160 HB3 GLU 21 2HB GLU 21 -4.637 1.470 0.030
161 HG2 GLU 21 1HG GLU 21 -5.932 0.383 -1.773
162 HG3 GLU 21 2HG GLU 21 -6.743 1.918 -2.072
163 H GLU 22 H GLU 22 -5.628 -0.778 1.679
164 HA GLU 22 HA GLU 22 -5.091 0.559 4.257
165 HB2 GLU 22 1HB GLU 22 -5.333 -1.687 5.297
166 HB3 GLU 22 2HB GLU 22 -6.813 -1.083 4.566
167 HG2 GLU 22 1HG GLU 22 -6.480 -2.511 2.644
168 HG3 GLU 22 2HG GLU 22 -4.939 -3.056 3.292
169 H LEU 23 H LEU 23 -3.217 -0.128 5.435
170 HA LEU 23 HA LEU 23 -1.012 -0.854 3.677
171 HB2 LEU 23 1HB LEU 23 -1.314 0.912 5.831
172 HB3 LEU 23 2HB LEU 23 -0.311 -0.384 6.444
173 HG LEU 23 HG LEU 23 1.475 0.152 5.056
174 HD11 LEU 23 1HD1 LEU 23 1.129 1.583 2.995
175 HD12 LEU 23 2HD1 LEU 23 -0.598 1.289 3.205
176 HD13 LEU 23 3HD1 LEU 23 0.506 -0.067 2.936
177 HD21 LEU 23 3HD2 LEU 23 1.801 2.521 5.126
178 HD22 LEU 23 1HD2 LEU 23 0.959 2.019 6.593
179 HD23 LEU 23 2HD2 LEU 23 0.066 2.803 5.289
180 H ILE 24 H ILE 24 -0.570 -2.921 3.465
181 HA ILE 24 HA ILE 24 -1.544 -4.762 5.545
182 HB ILE 24 HB ILE 24 -2.219 -6.261 3.845
183 HG12 ILE 24 1HG1 ILE 24 -1.440 -5.394 1.370
184 HG13 ILE 24 2HG1 ILE 24 -0.019 -5.013 2.329
185 HG21 ILE 24 1HG2 ILE 24 -3.435 -4.074 3.966
186 HG22 ILE 24 2HG2 ILE 24 -3.608 -4.952 2.450
187 HG23 ILE 24 3HG2 ILE 24 -2.515 -3.570 2.546
188 HD11 ILE 24 3HD1 ILE 24 -1.313 -7.717 2.099
189 HD12 ILE 24 1HD1 ILE 24 0.110 -7.334 3.068
190 HD13 ILE 24 2HD1 ILE 24 0.178 -7.202 1.311
191 H ALA 25 H ALA 25 1.275 -3.768 3.817
192 HA ALA 25 HA ALA 25 2.900 -5.572 5.386
193 HB1 ALA 25 3HB ALA 25 2.944 -5.860 2.381
194 HB2 ALA 25 1HB ALA 25 2.271 -7.036 3.510
195 HB3 ALA 25 2HB ALA 25 3.999 -6.686 3.528
196 H LEU 26 H LEU 26 5.226 -5.229 4.963
197 HA LEU 26 HA LEU 26 5.665 -2.432 4.177
198 HB2 LEU 26 1HB LEU 26 5.852 -2.695 6.520
199 HB3 LEU 26 2HB LEU 26 6.894 -4.082 6.374
200 HG LEU 26 HG LEU 26 7.965 -1.951 7.183
201 HD11 LEU 26 1HD1 LEU 26 9.992 -2.173 5.871
202 HD12 LEU 26 2HD1 LEU 26 9.113 -3.089 4.646
203 HD13 LEU 26 3HD1 LEU 26 9.314 -3.751 6.268
204 HD21 LEU 26 3HD2 LEU 26 6.736 -0.400 5.702
205 HD22 LEU 26 1HD2 LEU 26 7.639 -1.044 4.331
206 HD23 LEU 26 2HD2 LEU 26 8.489 -0.194 5.617
207 H CYS 27 H CYS 27 7.197 -1.977 2.822
208 HA CYS 27 HA CYS 27 8.773 -4.199 1.701
209 HB2 CYS 27 1HB CYS 27 7.330 -1.938 0.332
210 HB3 CYS 27 2HB CYS 27 8.593 -2.854 -0.477
211 HG CYS 27 HG CYS 27 6.285 -4.810 0.915
212 H GLN 28 H GLN 28 10.541 -3.095 0.156
213 HA GLN 28 HA GLN 28 12.261 -1.680 1.954
214 HB2 GLN 28 1HB GLN 28 12.681 -2.234 -0.977
215 HB3 GLN 28 2HB GLN 28 13.914 -1.818 0.198
216 HG2 GLN 28 1HG GLN 28 13.609 -3.896 1.350
217 HG3 GLN 28 2HG GLN 28 12.234 -4.307 0.331
218 HE21 GLN 28 1HE2 GLN 28 13.546 -3.296 -2.088
219 HE22 GLN 28 2HE2 GLN 28 14.729 -4.486 -2.505
220 H LYS 29 H LYS 29 13.492 0.280 1.054
221 HA LYS 29 HA LYS 29 13.480 2.503 0.557
222 HB2 LYS 29 1HB LYS 29 11.167 1.797 -1.242
223 HB3 LYS 29 2HB LYS 29 12.062 3.307 -1.281
224 HG2 LYS 29 1HG LYS 29 14.056 2.138 -1.996
225 HG3 LYS 29 2HG LYS 29 13.223 0.588 -1.855
226 HD2 LYS 29 1HD LYS 29 12.501 2.831 -3.744
227 HD3 LYS 29 2HD LYS 29 13.308 1.324 -4.180
228 HE2 LYS 29 1HE LYS 29 10.521 1.578 -3.039
229 HE3 LYS 29 2HE LYS 29 10.922 1.256 -4.724
230 HZ1 LYS 29 3HZ LYS 29 11.942 -0.821 -4.058
231 HZ2 LYS 29 1HZ LYS 29 10.339 -0.765 -3.530
232 HZ3 LYS 29 2HZ LYS 29 11.597 -0.511 -2.435
233 H SER 30 H SER 30 11.468 1.099 2.445
234 HA SER 30 HA SER 30 10.119 1.771 4.138
235 HB2 SER 30 1HB SER 30 10.279 4.565 2.992
236 HB3 SER 30 2HB SER 30 9.737 4.116 4.608
237 HG SER 30 HG SER 30 12.344 3.678 3.560
238 H LEU 31 H LEU 31 9.291 1.370 1.117
239 HA LEU 31 HA LEU 31 6.675 2.500 0.987
240 HB2 LEU 31 1HB LEU 31 8.169 0.394 -0.549
241 HB3 LEU 31 2HB LEU 31 6.454 0.600 -0.797
242 HG LEU 31 HG LEU 31 7.996 1.765 -2.428
243 HD11 LEU 31 1HD1 LEU 31 6.004 3.442 -0.917
244 HD12 LEU 31 2HD1 LEU 31 5.638 2.324 -2.231
245 HD13 LEU 31 3HD1 LEU 31 6.599 3.769 -2.542
246 HD21 LEU 31 3HD2 LEU 31 9.578 2.607 -0.708
247 HD22 LEU 31 1HD2 LEU 31 8.335 3.744 -0.198
248 HD23 LEU 31 2HD2 LEU 31 9.000 3.837 -1.829
249 H LYS 32 H LYS 32 4.663 1.372 1.184
250 HA LYS 32 HA LYS 32 4.811 -1.261 2.485
251 HB2 LYS 32 1HB LYS 32 3.112 1.083 3.316
252 HB3 LYS 32 2HB LYS 32 2.672 -0.567 3.719
253 HG2 LYS 32 1HG LYS 32 5.351 -0.233 4.505
254 HG3 LYS 32 2HG LYS 32 4.468 1.188 5.040
255 HD2 LYS 32 1HD LYS 32 2.796 -0.270 6.108
256 HD3 LYS 32 2HD LYS 32 3.759 -1.670 5.647
257 HE2 LYS 32 1HE LYS 32 4.123 -0.983 7.980
258 HE3 LYS 32 2HE LYS 32 5.591 -0.893 7.020
259 HZ1 LYS 32 3HZ LYS 32 5.222 1.507 6.796
260 HZ2 LYS 32 1HZ LYS 32 5.384 1.040 8.413
261 HZ3 LYS 32 2HZ LYS 32 3.855 1.390 7.784
262 H CYS 33 H CYS 33 2.975 -2.607 2.122
263 HA CYS 33 HA CYS 33 2.003 -2.313 -0.571
264 HB2 CYS 33 1HB CYS 33 1.499 -4.452 1.499
265 HB3 CYS 33 2HB CYS 33 1.090 -4.556 -0.204
266 HG CYS 33 HG CYS 33 3.513 -4.979 -1.161
267 H CYS 34 H CYS 34 0.222 -1.221 -1.034
268 HA CYS 34 HA CYS 34 -1.940 -1.137 0.946
269 HB2 CYS 34 1HB CYS 34 -1.437 0.536 -1.522
270 HB3 CYS 34 2HB CYS 34 -2.875 0.666 -0.517
271 HG CYS 34 HG CYS 34 0.176 1.054 0.918
272 H ARG 35 H ARG 35 -3.719 -2.296 0.647
273 HA ARG 35 HA ARG 35 -4.153 -3.526 -1.982
274 HB2 ARG 35 1HB ARG 35 -5.483 -4.174 0.661
275 HB3 ARG 35 2HB ARG 35 -5.691 -5.058 -0.845
276 HG2 ARG 35 1HG ARG 35 -3.369 -5.720 -0.818
277 HG3 ARG 35 2HG ARG 35 -3.088 -4.763 0.631
278 HD2 ARG 35 1HD ARG 35 -4.493 -7.368 0.325
279 HD3 ARG 35 2HD ARG 35 -3.315 -6.874 1.509
280 HE ARG 35 HE ARG 35 -5.283 -5.402 2.335
281 HH11 ARG 35 1HH1 ARG 35 -5.549 -8.625 0.997
282 HH12 ARG 35 2HH1 ARG 35 -6.892 -9.067 1.998
283 HH21 ARG 35 1HH2 ARG 35 -7.049 -5.990 3.659
284 HH22 ARG 35 2HH2 ARG 35 -7.747 -7.576 3.500
285 H THR 36 H THR 36 -5.633 -2.750 -3.265
286 HA THR 36 HA THR 36 -7.255 -0.515 -2.468
287 HB THR 36 HB THR 36 -7.382 -1.956 -5.113
288 HG1 THR 36 HG1 THR 36 -5.418 -0.134 -4.122
289 HG21 THR 36 1HG2 THR 36 -9.063 -0.228 -4.746
290 HG22 THR 36 2HG2 THR 36 -7.902 0.295 -5.964
291 HG23 THR 36 3HG2 THR 36 -7.805 0.930 -4.320
292 H ILE 37 H ILE 37 -8.756 -1.211 -1.038
293 HA ILE 37 HA ILE 37 -10.159 -3.645 -1.266
294 HB ILE 37 HB ILE 37 -10.816 -1.194 0.357
295 HG12 ILE 37 1HG1 ILE 37 -8.593 -1.872 0.888
296 HG13 ILE 37 2HG1 ILE 37 -9.616 -2.482 2.173
297 HG21 ILE 37 1HG2 ILE 37 -11.950 -2.842 1.851
298 HG22 ILE 37 2HG2 ILE 37 -11.745 -4.044 0.575
299 HG23 ILE 37 3HG2 ILE 37 -12.723 -2.609 0.284
300 HD11 ILE 37 3HD1 ILE 37 -8.029 -4.166 1.628
301 HD12 ILE 37 1HD1 ILE 37 -8.403 -4.040 -0.091
302 HD13 ILE 37 2HD1 ILE 37 -9.595 -4.701 1.022
303 H GLN 38 H GLN 38 -11.808 -4.151 -2.479
304 HA GLN 38 HA GLN 38 -13.239 -2.140 -3.991
305 HB2 GLN 38 1HB GLN 38 -13.537 -5.149 -3.947
306 HB3 GLN 38 2HB GLN 38 -14.295 -4.060 -5.099
307 HG2 GLN 38 1HG GLN 38 -12.113 -3.421 -5.954
308 HG3 GLN 38 2HG GLN 38 -11.334 -4.480 -4.778
309 HE21 GLN 38 1HE2 GLN 38 -13.199 -4.317 -7.700
310 HE22 GLN 38 2HE2 GLN 38 -12.978 -5.968 -8.170
311 HA PRO 39 HA PRO 39 -16.645 -1.907 -1.114
312 HB2 PRO 39 1HB PRO 39 -18.267 -1.157 -3.452
313 HB3 PRO 39 2HB PRO 39 -17.926 -0.237 -1.987
314 HG2 PRO 39 1HG PRO 39 -16.849 0.407 -4.371
315 HG3 PRO 39 2HG PRO 39 -15.994 0.664 -2.842
316 HD2 PRO 39 1HD PRO 39 -15.615 -1.467 -4.894
317 HD3 PRO 39 2HD PRO 39 -14.411 -0.631 -3.892
318 H SER 40 H SER 40 -17.702 -3.638 -0.434
319 HA SER 40 HA SER 40 -19.053 -5.458 -0.343
320 HB2 SER 40 1HB SER 40 -20.556 -4.219 -1.884
321 HB3 SER 40 2HB SER 40 -19.672 -4.911 -3.244
322 HG SER 40 HG SER 40 -20.267 -7.010 -2.271
323 H GLY 41 H GLY 41 -16.312 -5.192 -2.009
324 HA2 GLY 41 1HA GLY 41 -16.138 -7.640 -3.435
325 HA3 GLY 41 2HA GLY 41 -14.781 -6.666 -2.889
326 H SER 42 H SER 42 -15.050 -9.561 -2.886
327 HA SER 42 HA SER 42 -15.549 -10.384 -0.182
328 HB2 SER 42 1HB SER 42 -14.261 -11.892 -2.467
329 HB3 SER 42 2HB SER 42 -14.861 -12.597 -0.966
330 HG SER 42 HG SER 42 -16.784 -11.097 -2.104
331 H ILE 43 H ILE 43 -13.830 -11.781 0.922
332 HA ILE 43 HA ILE 43 -11.740 -12.201 1.731
333 HB ILE 43 HB ILE 43 -10.727 -10.334 -0.426
334 HG12 ILE 43 1HG1 ILE 43 -10.792 -13.361 -0.344
335 HG13 ILE 43 2HG1 ILE 43 -11.881 -12.351 -1.290
336 HG21 ILE 43 1HG2 ILE 43 -9.129 -10.527 1.397
337 HG22 ILE 43 2HG2 ILE 43 -8.539 -11.365 -0.037
338 HG23 ILE 43 3HG2 ILE 43 -9.216 -12.285 1.306
339 HD11 ILE 43 3HD1 ILE 43 -9.976 -11.512 -2.572
340 HD12 ILE 43 1HD1 ILE 43 -10.119 -13.265 -2.675
341 HD13 ILE 43 2HD1 ILE 43 -8.896 -12.542 -1.631
342 H ILE 44 H ILE 44 -13.186 -9.140 1.582
343 HA ILE 44 HA ILE 44 -11.567 -8.210 3.813
344 HB ILE 44 HB ILE 44 -10.328 -7.221 2.092
345 HG12 ILE 44 1HG1 ILE 44 -11.052 -4.734 2.215
346 HG13 ILE 44 2HG1 ILE 44 -12.302 -5.311 3.305
347 HG21 ILE 44 1HG2 ILE 44 -11.258 -6.001 0.212
348 HG22 ILE 44 2HG2 ILE 44 -12.892 -6.301 0.805
349 HG23 ILE 44 3HG2 ILE 44 -11.890 -7.649 0.262
350 HD11 ILE 44 3HD1 ILE 44 -10.170 -4.414 4.320
351 HD12 ILE 44 1HD1 ILE 44 -9.402 -5.896 3.755
352 HD13 ILE 44 2HD1 ILE 44 -10.739 -5.981 4.906
353 H ASP 45 H ASP 45 -14.259 -7.334 1.673
354 HA ASP 45 HA ASP 45 -15.366 -5.526 3.604
355 HB2 ASP 45 1HB ASP 45 -15.608 -5.204 1.146
356 HB3 ASP 45 2HB ASP 45 -16.650 -6.622 1.093
Start of MODEL 3
1 H PHE 1 1H PHE 1 10.702 -11.300 -2.113
2 HA PHE 1 HA PHE 1 8.886 -11.845 -4.378
3 HB2 PHE 1 1HB PHE 1 10.205 -13.718 -2.401
4 HB3 PHE 1 2HB PHE 1 9.058 -14.190 -3.648
5 HD1 PHE 1 HD1 PHE 1 9.740 -13.479 -6.092
6 HD2 PHE 1 HD2 PHE 1 12.449 -13.906 -2.839
7 HE1 PHE 1 HE1 PHE 1 11.594 -13.783 -7.680
8 HE2 PHE 1 HE2 PHE 1 14.307 -14.210 -4.422
9 HZ PHE 1 HZ PHE 1 13.882 -14.146 -6.846
10 H PHE 2 H PHE 2 9.258 -11.333 -0.940
11 HA PHE 2 HA PHE 2 6.905 -12.506 -0.010
12 HB2 PHE 2 1HB PHE 2 8.310 -10.033 1.012
13 HB3 PHE 2 2HB PHE 2 7.057 -10.908 1.882
14 HD1 PHE 2 HD1 PHE 2 7.637 -13.601 1.887
15 HD2 PHE 2 HD2 PHE 2 10.417 -10.384 1.805
16 HE1 PHE 2 HE1 PHE 2 9.340 -15.053 2.903
17 HE2 PHE 2 HE2 PHE 2 12.129 -11.834 2.817
18 HZ PHE 2 HZ PHE 2 11.591 -14.171 3.368
19 H ASP 3 H ASP 3 7.423 -9.048 -0.784
20 HA ASP 3 HA ASP 3 4.574 -8.653 -0.745
21 HB2 ASP 3 1HB ASP 3 5.054 -6.306 -1.230
22 HB3 ASP 3 2HB ASP 3 5.910 -6.896 0.186
23 H GLU 4 H GLU 4 6.648 -9.770 -2.993
24 HA GLU 4 HA GLU 4 5.434 -8.752 -5.353
25 HB2 GLU 4 1HB GLU 4 7.595 -9.928 -5.390
26 HB3 GLU 4 2HB GLU 4 6.808 -11.401 -4.842
27 HG2 GLU 4 1HG GLU 4 5.549 -11.529 -6.898
28 HG3 GLU 4 2HG GLU 4 6.246 -10.002 -7.441
29 H LYS 5 H LYS 5 4.912 -11.538 -3.257
30 HA LYS 5 HA LYS 5 2.540 -12.389 -4.577
31 HB2 LYS 5 1HB LYS 5 3.979 -13.848 -3.131
32 HB3 LYS 5 2HB LYS 5 3.383 -12.963 -1.737
33 HG2 LYS 5 1HG LYS 5 2.203 -15.069 -2.020
34 HG3 LYS 5 2HG LYS 5 1.112 -13.697 -2.220
35 HD2 LYS 5 1HD LYS 5 0.640 -15.344 -3.919
36 HD3 LYS 5 2HD LYS 5 1.349 -13.919 -4.676
37 HE2 LYS 5 1HE LYS 5 2.320 -15.894 -5.649
38 HE3 LYS 5 2HE LYS 5 3.543 -15.068 -4.688
39 HZ1 LYS 5 3HZ LYS 5 3.228 -16.651 -2.929
40 HZ2 LYS 5 1HZ LYS 5 3.533 -17.487 -4.365
41 HZ3 LYS 5 2HZ LYS 5 1.959 -17.400 -3.756
42 H CYS 6 H CYS 6 3.301 -10.071 -2.049
43 HA CYS 6 HA CYS 6 0.665 -9.631 -1.145
44 HB2 CYS 6 1HB CYS 6 2.866 -8.694 -0.155
45 HB3 CYS 6 2HB CYS 6 2.728 -7.436 -1.376
46 HG CYS 6 HG CYS 6 1.860 -6.475 1.107
47 H ASN 7 H ASN 7 2.546 -8.257 -3.804
48 HA ASN 7 HA ASN 7 0.637 -6.456 -4.768
49 HB2 ASN 7 1HB ASN 7 2.997 -6.478 -5.478
50 HB3 ASN 7 2HB ASN 7 2.692 -7.973 -6.340
51 HD21 ASN 7 1HD2 ASN 7 1.693 -7.924 -8.314
52 HD22 ASN 7 2HD2 ASN 7 1.293 -6.455 -9.137
53 H LYS 8 H LYS 8 1.040 -9.907 -5.263
54 HA LYS 8 HA LYS 8 -1.000 -10.191 -7.214
55 HB2 LYS 8 1HB LYS 8 0.713 -11.920 -6.773
56 HB3 LYS 8 2HB LYS 8 -0.012 -12.221 -5.201
57 HG2 LYS 8 1HG LYS 8 -0.674 -13.906 -6.830
58 HG3 LYS 8 2HG LYS 8 -2.062 -12.973 -6.267
59 HD2 LYS 8 1HD LYS 8 -2.006 -11.628 -8.295
60 HD3 LYS 8 2HD LYS 8 -0.571 -12.492 -8.849
61 HE2 LYS 8 1HE LYS 8 -3.256 -13.762 -8.327
62 HE3 LYS 8 2HE LYS 8 -2.666 -13.275 -9.914
63 HZ1 LYS 8 3HZ LYS 8 -1.423 -15.305 -8.140
64 HZ2 LYS 8 1HZ LYS 8 -0.816 -14.820 -9.642
65 HZ3 LYS 8 2HZ LYS 8 -2.300 -15.619 -9.549
66 H LEU 9 H LEU 9 -0.983 -10.294 -3.677
67 HA LEU 9 HA LEU 9 -3.846 -10.643 -3.514
68 HB2 LEU 9 1HB LEU 9 -1.652 -10.221 -1.527
69 HB3 LEU 9 2HB LEU 9 -3.303 -9.903 -1.042
70 HG LEU 9 HG LEU 9 -2.631 -12.133 -0.357
71 HD11 LEU 9 1HD1 LEU 9 -4.597 -12.268 -2.636
72 HD12 LEU 9 2HD1 LEU 9 -4.968 -11.749 -0.992
73 HD13 LEU 9 3HD1 LEU 9 -4.456 -13.408 -1.299
74 HD21 LEU 9 3HD2 LEU 9 -2.189 -12.697 -3.287
75 HD22 LEU 9 1HD2 LEU 9 -2.100 -13.875 -1.976
76 HD23 LEU 9 2HD2 LEU 9 -0.931 -12.558 -2.059
77 H LYS 10 H LYS 10 -2.160 -8.255 -4.660
78 HA LYS 10 HA LYS 10 -2.870 -6.266 -5.461
79 HB2 LYS 10 1HB LYS 10 -5.336 -6.650 -3.759
80 HB3 LYS 10 2HB LYS 10 -5.131 -5.452 -5.032
81 HG2 LYS 10 1HG LYS 10 -5.113 -8.439 -5.407
82 HG3 LYS 10 2HG LYS 10 -6.454 -7.359 -5.793
83 HD2 LYS 10 1HD LYS 10 -5.122 -6.249 -7.472
84 HD3 LYS 10 2HD LYS 10 -3.702 -7.193 -7.025
85 HE2 LYS 10 1HE LYS 10 -4.742 -8.059 -9.055
86 HE3 LYS 10 2HE LYS 10 -4.823 -9.233 -7.742
87 HZ1 LYS 10 3HZ LYS 10 -7.042 -7.433 -8.539
88 HZ2 LYS 10 1HZ LYS 10 -7.111 -8.651 -7.366
89 HZ3 LYS 10 2HZ LYS 10 -6.904 -9.054 -8.996
90 H GLY 11 H GLY 11 -1.353 -6.682 -2.978
91 HA2 GLY 11 1HA GLY 11 -1.844 -4.080 -1.697
92 HA3 GLY 11 2HA GLY 11 -0.807 -5.345 -1.070
93 H THR 12 H THR 12 -1.144 -2.863 -3.414
94 HA THR 12 HA THR 12 1.407 -3.160 -4.642
95 HB THR 12 HB THR 12 0.909 -0.782 -5.460
96 HG1 THR 12 HG1 THR 12 -0.938 -0.983 -3.567
97 HG21 THR 12 1HG2 THR 12 -0.773 -1.582 -7.051
98 HG22 THR 12 2HG2 THR 12 -1.087 -2.979 -6.022
99 HG23 THR 12 3HG2 THR 12 0.487 -2.790 -6.796
100 H CYS 13 H CYS 13 3.284 -1.946 -4.365
101 HA CYS 13 HA CYS 13 3.666 -0.998 -1.667
102 HB2 CYS 13 1HB CYS 13 5.763 -0.751 -3.796
103 HB3 CYS 13 2HB CYS 13 5.948 -1.046 -2.076
104 HG CYS 13 HG CYS 13 4.443 -3.639 -2.696
105 H LYS 14 H LYS 14 2.636 0.861 -1.360
106 HA LYS 14 HA LYS 14 3.802 3.176 -2.716
107 HB2 LYS 14 1HB LYS 14 1.630 4.340 -2.639
108 HB3 LYS 14 2HB LYS 14 1.612 2.942 -3.701
109 HG2 LYS 14 1HG LYS 14 0.457 1.646 -2.006
110 HG3 LYS 14 2HG LYS 14 0.507 3.026 -0.904
111 HD2 LYS 14 1HD LYS 14 -1.666 2.904 -1.957
112 HD3 LYS 14 2HD LYS 14 -0.798 4.336 -2.527
113 HE2 LYS 14 1HE LYS 14 -0.205 3.184 -4.583
114 HE3 LYS 14 2HE LYS 14 -0.969 1.704 -4.005
115 HZ1 LYS 14 3HZ LYS 14 -3.091 2.962 -3.927
116 HZ2 LYS 14 1HZ LYS 14 -2.454 2.787 -5.490
117 HZ3 LYS 14 2HZ LYS 14 -2.305 4.262 -4.680
118 H ASN 15 H ASN 15 3.479 5.176 -1.364
119 HA ASN 15 HA ASN 15 4.419 4.491 1.274
120 HB2 ASN 15 1HB ASN 15 5.377 6.286 -0.229
121 HB3 ASN 15 2HB ASN 15 3.964 7.242 0.143
122 HD21 ASN 15 1HD2 ASN 15 5.211 8.839 1.120
123 HD22 ASN 15 2HD2 ASN 15 5.942 8.614 2.670
124 H ASN 16 H ASN 16 1.749 6.333 -0.122
125 HA ASN 16 HA ASN 16 0.405 6.189 2.506
126 HB2 ASN 16 1HB ASN 16 -0.701 8.259 2.054
127 HB3 ASN 16 2HB ASN 16 1.006 8.508 1.717
128 HD21 ASN 16 1HD2 ASN 16 1.688 8.670 -0.445
129 HD22 ASN 16 2HD2 ASN 16 0.577 9.098 -1.700
130 H CYS 17 H CYS 17 -1.715 5.541 2.578
131 HA CYS 17 HA CYS 17 -2.538 3.854 0.407
132 HB2 CYS 17 1HB CYS 17 -4.079 4.518 2.918
133 HB3 CYS 17 2HB CYS 17 -4.293 3.121 1.874
134 HG CYS 17 HG CYS 17 -1.493 2.354 2.499
135 H GLY 18 H GLY 18 -4.017 4.234 -1.098
136 HA2 GLY 18 1HA GLY 18 -5.234 6.888 -1.211
137 HA3 GLY 18 2HA GLY 18 -5.083 5.752 -2.544
138 H LYS 19 H LYS 19 -7.293 6.106 -3.020
139 HA LYS 19 HA LYS 19 -9.438 5.845 -1.305
140 HB2 LYS 19 1HB LYS 19 -10.813 5.713 -3.188
141 HB3 LYS 19 2HB LYS 19 -9.405 6.586 -3.760
142 HG2 LYS 19 1HG LYS 19 -10.038 3.681 -4.262
143 HG3 LYS 19 2HG LYS 19 -10.162 4.999 -5.420
144 HD2 LYS 19 1HD LYS 19 -7.681 5.347 -5.128
145 HD3 LYS 19 2HD LYS 19 -7.663 3.848 -4.193
146 HE2 LYS 19 1HE LYS 19 -7.028 3.416 -6.493
147 HE3 LYS 19 2HE LYS 19 -8.567 2.640 -6.118
148 HZ1 LYS 19 3HZ LYS 19 -9.708 4.467 -7.217
149 HZ2 LYS 19 1HZ LYS 19 -8.626 3.714 -8.275
150 HZ3 LYS 19 2HZ LYS 19 -8.231 5.205 -7.580
151 H ASN 20 H ASN 20 -10.335 4.249 -0.233
152 HA ASN 20 HA ASN 20 -10.833 2.181 0.567
153 HB2 ASN 20 1HB ASN 20 -10.556 1.523 -2.365
154 HB3 ASN 20 2HB ASN 20 -11.092 0.351 -1.170
155 HD21 ASN 20 1HD2 ASN 20 -13.077 0.084 -2.078
156 HD22 ASN 20 2HD2 ASN 20 -14.310 1.299 -2.020
157 H GLU 21 H GLU 21 -7.945 2.946 0.512
158 HA GLU 21 HA GLU 21 -6.828 0.237 0.248
159 HB2 GLU 21 1HB GLU 21 -5.526 2.928 -0.140
160 HB3 GLU 21 2HB GLU 21 -4.595 1.446 0.031
161 HG2 GLU 21 1HG GLU 21 -5.808 0.517 -1.916
162 HG3 GLU 21 2HG GLU 21 -6.618 2.069 -2.113
163 H GLU 22 H GLU 22 -5.605 -0.645 1.798
164 HA GLU 22 HA GLU 22 -5.350 0.847 4.328
165 HB2 GLU 22 1HB GLU 22 -5.734 -1.256 5.535
166 HB3 GLU 22 2HB GLU 22 -7.114 -0.841 4.525
167 HG2 GLU 22 1HG GLU 22 -6.516 -2.481 2.905
168 HG3 GLU 22 2HG GLU 22 -4.971 -2.775 3.694
169 H LEU 23 H LEU 23 -3.553 0.254 5.661
170 HA LEU 23 HA LEU 23 -1.230 -0.609 4.135
171 HB2 LEU 23 1HB LEU 23 -1.554 1.299 6.048
172 HB3 LEU 23 2HB LEU 23 -0.977 -0.040 7.018
173 HG LEU 23 HG LEU 23 1.096 -0.140 5.804
174 HD11 LEU 23 1HD1 LEU 23 -0.274 1.766 3.934
175 HD12 LEU 23 2HD1 LEU 23 0.448 0.192 3.575
176 HD13 LEU 23 3HD1 LEU 23 1.476 1.568 3.975
177 HD21 LEU 23 3HD2 LEU 23 2.001 2.078 6.222
178 HD22 LEU 23 1HD2 LEU 23 0.938 1.578 7.537
179 HD23 LEU 23 2HD2 LEU 23 0.370 2.735 6.336
180 H ILE 24 H ILE 24 -0.692 -2.694 4.082
181 HA ILE 24 HA ILE 24 -1.768 -4.406 6.226
182 HB ILE 24 HB ILE 24 -2.368 -6.047 4.708
183 HG12 ILE 24 1HG1 ILE 24 -1.401 -5.506 2.177
184 HG13 ILE 24 2HG1 ILE 24 -0.034 -5.116 3.214
185 HG21 ILE 24 1HG2 ILE 24 -3.691 -4.024 4.384
186 HG22 ILE 24 2HG2 ILE 24 -3.560 -4.962 2.899
187 HG23 ILE 24 3HG2 ILE 24 -2.584 -3.510 3.108
188 HD11 ILE 24 3HD1 ILE 24 0.070 -7.416 2.454
189 HD12 ILE 24 1HD1 ILE 24 -1.515 -7.734 3.162
190 HD13 ILE 24 2HD1 ILE 24 -0.146 -7.344 4.202
191 H ALA 25 H ALA 25 1.090 -3.452 4.568
192 HA ALA 25 HA ALA 25 2.733 -5.024 6.305
193 HB1 ALA 25 3HB ALA 25 3.818 -6.418 4.638
194 HB2 ALA 25 1HB ALA 25 2.737 -5.800 3.389
195 HB3 ALA 25 2HB ALA 25 2.093 -6.778 4.708
196 H LEU 26 H LEU 26 5.023 -4.782 5.796
197 HA LEU 26 HA LEU 26 5.524 -2.080 4.786
198 HB2 LEU 26 1HB LEU 26 6.932 -3.877 6.736
199 HB3 LEU 26 2HB LEU 26 7.755 -2.497 6.036
200 HG LEU 26 HG LEU 26 6.978 -1.881 8.204
201 HD11 LEU 26 1HD1 LEU 26 6.761 -0.191 6.433
202 HD12 LEU 26 2HD1 LEU 26 5.592 0.022 7.734
203 HD13 LEU 26 3HD1 LEU 26 5.083 -0.682 6.201
204 HD21 LEU 26 3HD2 LEU 26 4.612 -1.971 8.848
205 HD22 LEU 26 1HD2 LEU 26 5.284 -3.573 8.541
206 HD23 LEU 26 2HD2 LEU 26 4.246 -2.807 7.340
207 H CYS 27 H CYS 27 6.962 -1.723 3.162
208 HA CYS 27 HA CYS 27 8.208 -4.093 1.938
209 HB2 CYS 27 1HB CYS 27 7.275 -1.496 0.696
210 HB3 CYS 27 2HB CYS 27 8.233 -2.692 -0.165
211 HG CYS 27 HG CYS 27 6.294 -4.243 -0.844
212 H GLN 28 H GLN 28 10.207 -3.357 0.585
213 HA GLN 28 HA GLN 28 11.938 -1.797 2.300
214 HB2 GLN 28 1HB GLN 28 12.500 -3.129 -0.344
215 HB3 GLN 28 2HB GLN 28 13.701 -2.347 0.666
216 HG2 GLN 28 1HG GLN 28 13.198 -3.965 2.459
217 HG3 GLN 28 2HG GLN 28 12.089 -4.788 1.365
218 HE21 GLN 28 1HE2 GLN 28 15.415 -4.064 2.070
219 HE22 GLN 28 2HE2 GLN 28 16.102 -5.266 1.035
220 H LYS 29 H LYS 29 13.447 -0.228 1.017
221 HA LYS 29 HA LYS 29 13.687 1.771 0.009
222 HB2 LYS 29 1HB LYS 29 12.656 0.221 -1.894
223 HB3 LYS 29 2HB LYS 29 11.325 1.355 -1.736
224 HG2 LYS 29 1HG LYS 29 13.724 2.829 -1.830
225 HG3 LYS 29 2HG LYS 29 13.758 1.663 -3.148
226 HD2 LYS 29 1HD LYS 29 11.614 3.713 -2.584
227 HD3 LYS 29 2HD LYS 29 12.756 3.714 -3.930
228 HE2 LYS 29 1HE LYS 29 11.762 1.544 -4.669
229 HE3 LYS 29 2HE LYS 29 10.539 1.741 -3.411
230 HZ1 LYS 29 3HZ LYS 29 9.896 3.847 -4.476
231 HZ2 LYS 29 1HZ LYS 29 9.693 2.522 -5.506
232 HZ3 LYS 29 2HZ LYS 29 11.009 3.557 -5.712
233 H SER 30 H SER 30 11.478 1.077 2.063
234 HA SER 30 HA SER 30 10.314 2.344 3.543
235 HB2 SER 30 1HB SER 30 10.744 4.690 1.687
236 HB3 SER 30 2HB SER 30 10.200 4.759 3.362
237 HG SER 30 HG SER 30 12.428 3.378 3.389
238 H LEU 31 H LEU 31 9.322 1.365 0.646
239 HA LEU 31 HA LEU 31 6.748 2.654 0.609
240 HB2 LEU 31 1HB LEU 31 8.054 0.460 -0.981
241 HB3 LEU 31 2HB LEU 31 6.335 0.758 -1.114
242 HG LEU 31 HG LEU 31 7.739 1.819 -2.873
243 HD11 LEU 31 1HD1 LEU 31 6.560 3.945 -2.852
244 HD12 LEU 31 2HD1 LEU 31 6.176 3.728 -1.144
245 HD13 LEU 31 3HD1 LEU 31 5.504 2.630 -2.349
246 HD21 LEU 31 3HD2 LEU 31 8.961 3.852 -2.371
247 HD22 LEU 31 1HD2 LEU 31 9.651 2.469 -1.523
248 HD23 LEU 31 2HD2 LEU 31 8.643 3.624 -0.651
249 H LYS 32 H LYS 32 4.733 1.236 0.622
250 HA LYS 32 HA LYS 32 4.952 -0.974 2.556
251 HB2 LYS 32 1HB LYS 32 2.986 1.315 2.655
252 HB3 LYS 32 2HB LYS 32 2.792 -0.168 3.569
253 HG2 LYS 32 1HG LYS 32 3.684 1.226 5.134
254 HG3 LYS 32 2HG LYS 32 5.138 0.433 4.513
255 HD2 LYS 32 1HD LYS 32 5.543 2.339 3.025
256 HD3 LYS 32 2HD LYS 32 4.101 3.137 3.656
257 HE2 LYS 32 1HE LYS 32 5.097 3.187 5.881
258 HE3 LYS 32 2HE LYS 32 6.529 2.362 5.267
259 HZ1 LYS 32 3HZ LYS 32 6.867 4.749 5.445
260 HZ2 LYS 32 1HZ LYS 32 5.578 5.036 4.387
261 HZ3 LYS 32 2HZ LYS 32 6.970 4.245 3.836
262 H CYS 33 H CYS 33 2.986 -2.361 2.570
263 HA CYS 33 HA CYS 33 1.966 -2.689 -0.129
264 HB2 CYS 33 1HB CYS 33 1.479 -4.343 2.349
265 HB3 CYS 33 2HB CYS 33 1.064 -4.789 0.703
266 HG CYS 33 HG CYS 33 4.259 -4.127 0.776
267 H CYS 34 H CYS 34 0.369 -1.271 -0.563
268 HA CYS 34 HA CYS 34 -1.852 -1.074 1.357
269 HB2 CYS 34 1HB CYS 34 -1.172 0.682 -1.013
270 HB3 CYS 34 2HB CYS 34 -2.570 0.898 0.032
271 HG CYS 34 HG CYS 34 0.719 1.358 0.837
272 H ARG 35 H ARG 35 -3.532 -2.327 0.966
273 HA ARG 35 HA ARG 35 -3.903 -3.457 -1.700
274 HB2 ARG 35 1HB ARG 35 -5.351 -4.085 0.881
275 HB3 ARG 35 2HB ARG 35 -5.527 -4.959 -0.632
276 HG2 ARG 35 1HG ARG 35 -3.237 -5.713 -0.508
277 HG3 ARG 35 2HG ARG 35 -2.976 -4.758 0.952
278 HD2 ARG 35 1HD ARG 35 -3.365 -6.894 1.792
279 HD3 ARG 35 2HD ARG 35 -4.941 -6.115 1.922
280 HE ARG 35 HE ARG 35 -4.790 -7.430 -0.556
281 HH11 ARG 35 1HH1 ARG 35 -4.961 -8.165 2.868
282 HH12 ARG 35 2HH1 ARG 35 -5.755 -9.691 2.629
283 HH21 ARG 35 1HH2 ARG 35 -5.851 -9.440 -0.867
284 HH22 ARG 35 2HH2 ARG 35 -6.260 -10.413 0.514
285 H THR 36 H THR 36 -5.391 -2.739 -3.069
286 HA THR 36 HA THR 36 -7.232 -0.664 -2.263
287 HB THR 36 HB THR 36 -7.242 -2.027 -4.952
288 HG1 THR 36 HG1 THR 36 -5.312 -0.350 -3.813
289 HG21 THR 36 1HG2 THR 36 -8.032 0.122 -5.740
290 HG22 THR 36 2HG2 THR 36 -7.800 0.838 -4.144
291 HG23 THR 36 3HG2 THR 36 -9.041 -0.396 -4.388
292 H ILE 37 H ILE 37 -8.867 -1.282 -1.087
293 HA ILE 37 HA ILE 37 -9.998 -3.889 -1.106
294 HB ILE 37 HB ILE 37 -11.045 -1.350 0.148
295 HG12 ILE 37 1HG1 ILE 37 -8.741 -1.756 0.802
296 HG13 ILE 37 2HG1 ILE 37 -9.798 -2.113 2.152
297 HG21 ILE 37 1HG2 ILE 37 -12.709 -3.120 0.082
298 HG22 ILE 37 2HG2 ILE 37 -12.148 -2.859 1.734
299 HG23 ILE 37 3HG2 ILE 37 -11.564 -4.243 0.812
300 HD11 ILE 37 3HD1 ILE 37 -8.004 -3.751 1.923
301 HD12 ILE 37 1HD1 ILE 37 -8.574 -4.144 0.301
302 HD13 ILE 37 2HD1 ILE 37 -9.586 -4.492 1.701
303 H GLN 38 H GLN 38 -11.171 -4.590 -2.721
304 HA GLN 38 HA GLN 38 -13.013 -2.754 -4.090
305 HB2 GLN 38 1HB GLN 38 -11.902 -5.412 -5.008
306 HB3 GLN 38 2HB GLN 38 -12.941 -4.350 -5.950
307 HG2 GLN 38 1HG GLN 38 -11.221 -2.649 -5.987
308 HG3 GLN 38 2HG GLN 38 -10.187 -3.644 -4.962
309 HE21 GLN 38 1HE2 GLN 38 -9.695 -2.587 -7.627
310 HE22 GLN 38 2HE2 GLN 38 -9.367 -3.958 -8.630
311 HA PRO 39 HA PRO 39 -16.506 -4.779 -2.182
312 HB2 PRO 39 1HB PRO 39 -17.777 -4.071 -4.782
313 HB3 PRO 39 2HB PRO 39 -18.328 -3.745 -3.135
314 HG2 PRO 39 1HG PRO 39 -17.279 -1.804 -4.620
315 HG3 PRO 39 2HG PRO 39 -16.925 -1.914 -2.886
316 HD2 PRO 39 1HD PRO 39 -15.212 -2.637 -5.222
317 HD3 PRO 39 2HD PRO 39 -14.755 -1.927 -3.660
318 H SER 40 H SER 40 -16.635 -6.921 -2.109
319 HA SER 40 HA SER 40 -17.484 -8.527 -4.264
320 HB2 SER 40 1HB SER 40 -15.378 -9.903 -4.435
321 HB3 SER 40 2HB SER 40 -15.251 -8.291 -5.133
322 HG SER 40 HG SER 40 -14.176 -7.622 -3.246
323 H GLY 41 H GLY 41 -17.274 -10.930 -3.627
324 HA2 GLY 41 1HA GLY 41 -18.011 -11.167 -0.832
325 HA3 GLY 41 2HA GLY 41 -18.099 -12.433 -2.049
326 H SER 42 H SER 42 -16.868 -12.100 0.748
327 HA SER 42 HA SER 42 -15.127 -12.956 1.909
328 HB2 SER 42 1HB SER 42 -14.234 -14.103 -0.746
329 HB3 SER 42 2HB SER 42 -13.583 -14.544 0.832
330 HG SER 42 HG SER 42 -16.326 -14.710 0.639
331 H ILE 43 H ILE 43 -12.509 -13.062 1.678
332 HA ILE 43 HA ILE 43 -10.558 -11.908 1.555
333 HB ILE 43 HB ILE 43 -11.961 -10.093 -0.417
334 HG12 ILE 43 1HG1 ILE 43 -11.781 -12.413 -1.217
335 HG13 ILE 43 2HG1 ILE 43 -10.737 -11.338 -2.139
336 HG21 ILE 43 1HG2 ILE 43 -9.718 -9.345 -1.042
337 HG22 ILE 43 2HG2 ILE 43 -9.025 -10.352 0.228
338 HG23 ILE 43 3HG2 ILE 43 -10.065 -8.992 0.650
339 HD11 ILE 43 3HD1 ILE 43 -8.814 -12.106 -0.836
340 HD12 ILE 43 1HD1 ILE 43 -9.626 -13.431 -1.668
341 HD13 ILE 43 2HD1 ILE 43 -9.869 -13.198 0.062
342 H ILE 44 H ILE 44 -13.176 -9.484 1.333
343 HA ILE 44 HA ILE 44 -12.875 -8.634 4.017
344 HB ILE 44 HB ILE 44 -10.789 -7.652 3.183
345 HG12 ILE 44 1HG1 ILE 44 -12.929 -5.579 3.721
346 HG13 ILE 44 2HG1 ILE 44 -12.069 -6.500 4.947
347 HG21 ILE 44 1HG2 ILE 44 -12.516 -6.070 1.282
348 HG22 ILE 44 2HG2 ILE 44 -11.482 -7.422 0.827
349 HG23 ILE 44 3HG2 ILE 44 -10.767 -5.944 1.466
350 HD11 ILE 44 3HD1 ILE 44 -11.141 -4.311 4.828
351 HD12 ILE 44 1HD1 ILE 44 -10.921 -4.447 3.084
352 HD13 ILE 44 2HD1 ILE 44 -9.967 -5.450 4.175
353 H ASP 45 H ASP 45 -14.467 -7.154 4.618
354 HA ASP 45 HA ASP 45 -16.430 -6.519 2.527
355 HB2 ASP 45 1HB ASP 45 -18.105 -6.418 4.365
356 HB3 ASP 45 2HB ASP 45 -17.378 -8.007 4.184
Start of MODEL 4
1 H PHE 1 1H PHE 1 9.788 -10.850 0.248
2 HA PHE 1 HA PHE 1 7.859 -13.087 0.299
3 HB2 PHE 1 1HB PHE 1 9.380 -11.764 2.557
4 HB3 PHE 1 2HB PHE 1 8.065 -12.915 2.772
5 HD1 PHE 1 HD1 PHE 1 8.387 -15.217 1.578
6 HD2 PHE 1 HD2 PHE 1 11.551 -12.533 2.523
7 HE1 PHE 1 HE1 PHE 1 9.992 -17.078 1.477
8 HE2 PHE 1 HE2 PHE 1 13.161 -14.389 2.421
9 HZ PHE 1 HZ PHE 1 12.383 -16.665 1.898
10 H PHE 2 H PHE 2 8.592 -9.727 1.220
11 HA PHE 2 HA PHE 2 6.108 -9.100 2.335
12 HB2 PHE 2 1HB PHE 2 7.967 -7.231 0.858
13 HB3 PHE 2 2HB PHE 2 6.708 -6.758 1.989
14 HD1 PHE 2 HD1 PHE 2 6.934 -7.998 4.361
15 HD2 PHE 2 HD2 PHE 2 10.111 -7.237 1.635
16 HE1 PHE 2 HE1 PHE 2 8.549 -8.128 6.213
17 HE2 PHE 2 HE2 PHE 2 11.731 -7.368 3.480
18 HZ PHE 2 HZ PHE 2 10.951 -7.816 5.772
19 H ASP 3 H ASP 3 7.291 -8.568 -0.989
20 HA ASP 3 HA ASP 3 4.649 -7.689 -1.749
21 HB2 ASP 3 1HB ASP 3 5.571 -7.253 -3.954
22 HB3 ASP 3 2HB ASP 3 6.518 -6.476 -2.694
23 H GLU 4 H GLU 4 6.065 -10.614 -1.414
24 HA GLU 4 HA GLU 4 4.771 -12.033 -3.514
25 HB2 GLU 4 1HB GLU 4 6.526 -13.108 -2.193
26 HB3 GLU 4 2HB GLU 4 5.572 -12.923 -0.728
27 HG2 GLU 4 1HG GLU 4 3.837 -14.381 -1.782
28 HG3 GLU 4 2HG GLU 4 4.980 -14.682 -3.090
29 H LYS 5 H LYS 5 3.957 -11.113 -0.217
30 HA LYS 5 HA LYS 5 1.273 -12.020 -0.286
31 HB2 LYS 5 1HB LYS 5 2.613 -11.416 1.778
32 HB3 LYS 5 2HB LYS 5 2.376 -9.731 1.345
33 HG2 LYS 5 1HG LYS 5 0.781 -10.371 3.029
34 HG3 LYS 5 2HG LYS 5 -0.062 -10.057 1.510
35 HD2 LYS 5 1HD LYS 5 -0.150 -12.458 1.061
36 HD3 LYS 5 2HD LYS 5 0.708 -12.775 2.569
37 HE2 LYS 5 1HE LYS 5 -1.137 -11.788 3.828
38 HE3 LYS 5 2HE LYS 5 -1.990 -11.448 2.324
39 HZ1 LYS 5 3HZ LYS 5 -1.277 -14.143 3.339
40 HZ2 LYS 5 1HZ LYS 5 -2.082 -13.827 1.887
41 HZ3 LYS 5 2HZ LYS 5 -2.817 -13.455 3.362
42 H CYS 6 H CYS 6 2.901 -9.024 -1.194
43 HA CYS 6 HA CYS 6 0.661 -7.418 -1.675
44 HB2 CYS 6 1HB CYS 6 3.084 -6.677 -1.680
45 HB3 CYS 6 2HB CYS 6 3.246 -7.420 -3.260
46 HG CYS 6 HG CYS 6 2.592 -5.319 -4.548
47 H ASN 7 H ASN 7 2.334 -9.753 -3.708
48 HA ASN 7 HA ASN 7 0.962 -9.341 -6.115
49 HB2 ASN 7 1HB ASN 7 3.035 -10.689 -5.851
50 HB3 ASN 7 2HB ASN 7 2.098 -11.931 -5.036
51 HD21 ASN 7 1HD2 ASN 7 2.590 -13.478 -6.563
52 HD22 ASN 7 2HD2 ASN 7 1.904 -13.465 -8.150
53 H LYS 8 H LYS 8 0.352 -11.556 -3.441
54 HA LYS 8 HA LYS 8 -1.847 -12.930 -4.401
55 HB2 LYS 8 1HB LYS 8 -0.742 -13.547 -2.342
56 HB3 LYS 8 2HB LYS 8 -1.226 -12.040 -1.583
57 HG2 LYS 8 1HG LYS 8 -2.607 -13.823 -0.771
58 HG3 LYS 8 2HG LYS 8 -3.581 -12.740 -1.764
59 HD2 LYS 8 1HD LYS 8 -3.453 -14.280 -3.629
60 HD3 LYS 8 2HD LYS 8 -2.379 -15.339 -2.714
61 HE2 LYS 8 1HE LYS 8 -5.230 -14.664 -1.997
62 HE3 LYS 8 2HE LYS 8 -4.682 -16.175 -2.719
63 HZ1 LYS 8 3HZ LYS 8 -3.920 -15.137 -0.041
64 HZ2 LYS 8 1HZ LYS 8 -3.329 -16.561 -0.738
65 HZ3 LYS 8 2HZ LYS 8 -4.966 -16.426 -0.355
66 H LEU 9 H LEU 9 -1.792 -9.807 -2.716
67 HA LEU 9 HA LEU 9 -4.678 -9.587 -2.874
68 HB2 LEU 9 1HB LEU 9 -2.539 -7.814 -1.718
69 HB3 LEU 9 2HB LEU 9 -4.212 -7.306 -1.824
70 HG LEU 9 HG LEU 9 -3.840 -8.060 0.395
71 HD11 LEU 9 1HD1 LEU 9 -5.428 -9.861 0.631
72 HD12 LEU 9 2HD1 LEU 9 -5.253 -10.273 -1.073
73 HD13 LEU 9 3HD1 LEU 9 -5.969 -8.730 -0.610
74 HD21 LEU 9 3HD2 LEU 9 -2.803 -10.652 -0.723
75 HD22 LEU 9 1HD2 LEU 9 -2.958 -10.223 0.980
76 HD23 LEU 9 2HD2 LEU 9 -1.805 -9.364 -0.045
77 H LYS 10 H LYS 10 -2.142 -8.965 -4.907
78 HA LYS 10 HA LYS 10 -1.735 -7.667 -6.712
79 HB2 LYS 10 1HB LYS 10 -4.752 -7.519 -6.744
80 HB3 LYS 10 2HB LYS 10 -3.741 -6.849 -8.013
81 HG2 LYS 10 1HG LYS 10 -4.384 -8.907 -8.855
82 HG3 LYS 10 2HG LYS 10 -2.772 -9.221 -8.212
83 HD2 LYS 10 1HD LYS 10 -3.825 -10.084 -6.137
84 HD3 LYS 10 2HD LYS 10 -5.406 -9.870 -6.891
85 HE2 LYS 10 1HE LYS 10 -4.706 -11.404 -8.699
86 HE3 LYS 10 2HE LYS 10 -3.184 -11.667 -7.848
87 HZ1 LYS 10 3HZ LYS 10 -4.708 -13.432 -7.346
88 HZ2 LYS 10 1HZ LYS 10 -5.896 -12.335 -6.849
89 HZ3 LYS 10 2HZ LYS 10 -4.474 -12.505 -5.951
90 H GLY 11 H GLY 11 -1.264 -6.419 -4.407
91 HA2 GLY 11 1HA GLY 11 -2.551 -3.785 -4.538
92 HA3 GLY 11 2HA GLY 11 -1.568 -4.389 -3.211
93 H THR 12 H THR 12 -0.949 -1.958 -3.904
94 HA THR 12 HA THR 12 1.506 -2.259 -5.484
95 HB THR 12 HB THR 12 1.081 0.309 -5.913
96 HG1 THR 12 HG1 THR 12 -1.569 -0.283 -6.249
97 HG21 THR 12 1HG2 THR 12 -0.006 -0.274 -8.044
98 HG22 THR 12 2HG2 THR 12 -0.337 -1.888 -7.417
99 HG23 THR 12 3HG2 THR 12 1.327 -1.362 -7.662
100 H CYS 13 H CYS 13 3.317 -1.634 -4.499
101 HA CYS 13 HA CYS 13 3.210 -0.710 -1.789
102 HB2 CYS 13 1HB CYS 13 5.717 -0.764 -3.456
103 HB3 CYS 13 2HB CYS 13 5.534 -1.023 -1.729
104 HG CYS 13 HG CYS 13 5.860 -3.271 -3.975
105 H LYS 14 H LYS 14 2.658 1.309 -1.396
106 HA LYS 14 HA LYS 14 4.049 3.442 -2.843
107 HB2 LYS 14 1HB LYS 14 1.997 4.792 -2.863
108 HB3 LYS 14 2HB LYS 14 1.811 3.317 -3.797
109 HG2 LYS 14 1HG LYS 14 0.599 2.296 -1.929
110 HG3 LYS 14 2HG LYS 14 0.773 3.793 -1.012
111 HD2 LYS 14 1HD LYS 14 -1.392 3.850 -1.962
112 HD3 LYS 14 2HD LYS 14 -0.403 4.956 -2.916
113 HE2 LYS 14 1HE LYS 14 -1.745 3.668 -4.422
114 HE3 LYS 14 2HE LYS 14 -0.077 3.111 -4.570
115 HZ1 LYS 14 3HZ LYS 14 -2.259 1.786 -3.043
116 HZ2 LYS 14 1HZ LYS 14 -0.643 1.269 -3.069
117 HZ3 LYS 14 2HZ LYS 14 -1.557 1.237 -4.490
118 H ASN 15 H ASN 15 3.580 5.613 -1.530
119 HA ASN 15 HA ASN 15 4.597 5.004 1.095
120 HB2 ASN 15 1HB ASN 15 4.289 7.478 -0.541
121 HB3 ASN 15 2HB ASN 15 4.523 7.631 1.194
122 HD21 ASN 15 1HD2 ASN 15 6.264 8.429 -0.994
123 HD22 ASN 15 2HD2 ASN 15 7.758 7.592 -0.753
124 H ASN 16 H ASN 16 1.800 6.817 -0.168
125 HA ASN 16 HA ASN 16 0.455 6.280 2.402
126 HB2 ASN 16 1HB ASN 16 -0.872 8.334 2.014
127 HB3 ASN 16 2HB ASN 16 0.848 8.675 2.147
128 HD21 ASN 16 1HD2 ASN 16 2.019 9.139 0.233
129 HD22 ASN 16 2HD2 ASN 16 1.214 9.787 -1.154
130 H CYS 17 H CYS 17 -1.610 5.452 2.325
131 HA CYS 17 HA CYS 17 -2.069 3.794 0.069
132 HB2 CYS 17 1HB CYS 17 -3.937 4.317 2.387
133 HB3 CYS 17 2HB CYS 17 -3.932 2.915 1.328
134 HG CYS 17 HG CYS 17 -1.162 2.365 2.249
135 H GLY 18 H GLY 18 -3.644 3.835 -1.466
136 HA2 GLY 18 1HA GLY 18 -4.683 6.468 -2.097
137 HA3 GLY 18 2HA GLY 18 -4.757 5.037 -3.113
138 H LYS 19 H LYS 19 -6.958 5.646 -3.555
139 HA LYS 19 HA LYS 19 -8.886 5.968 -1.553
140 HB2 LYS 19 1HB LYS 19 -10.549 5.588 -3.360
141 HB3 LYS 19 2HB LYS 19 -9.336 6.790 -3.756
142 HG2 LYS 19 1HG LYS 19 -9.287 5.685 -5.711
143 HG3 LYS 19 2HG LYS 19 -8.191 4.613 -4.837
144 HD2 LYS 19 1HD LYS 19 -10.063 3.136 -4.292
145 HD3 LYS 19 2HD LYS 19 -11.169 4.215 -5.144
146 HE2 LYS 19 1HE LYS 19 -9.897 3.822 -7.219
147 HE3 LYS 19 2HE LYS 19 -8.867 2.690 -6.348
148 HZ1 LYS 19 3HZ LYS 19 -11.786 2.415 -6.810
149 HZ2 LYS 19 1HZ LYS 19 -10.856 1.352 -5.880
150 HZ3 LYS 19 2HZ LYS 19 -10.563 1.503 -7.537
151 H ASN 20 H ASN 20 -9.608 4.615 -0.152
152 HA ASN 20 HA ASN 20 -10.315 2.742 0.898
153 HB2 ASN 20 1HB ASN 20 -11.023 2.065 -1.947
154 HB3 ASN 20 2HB ASN 20 -11.354 0.946 -0.630
155 HD21 ASN 20 1HD2 ASN 20 -11.516 4.416 -0.233
156 HD22 ASN 20 2HD2 ASN 20 -13.232 4.506 -0.056
157 H GLU 21 H GLU 21 -7.689 2.807 0.844
158 HA GLU 21 HA GLU 21 -6.957 0.005 0.329
159 HB2 GLU 21 1HB GLU 21 -5.250 2.476 0.018
160 HB3 GLU 21 2HB GLU 21 -4.579 0.855 0.090
161 HG2 GLU 21 1HG GLU 21 -5.998 0.286 -1.887
162 HG3 GLU 21 2HG GLU 21 -6.412 1.994 -2.000
163 H GLU 22 H GLU 22 -5.523 -0.955 1.820
164 HA GLU 22 HA GLU 22 -5.197 0.502 4.358
165 HB2 GLU 22 1HB GLU 22 -5.755 -1.441 5.619
166 HB3 GLU 22 2HB GLU 22 -7.028 -1.243 4.424
167 HG2 GLU 22 1HG GLU 22 -5.993 -2.970 3.034
168 HG3 GLU 22 2HG GLU 22 -4.716 -3.162 4.233
169 H LEU 23 H LEU 23 -3.429 -0.384 5.706
170 HA LEU 23 HA LEU 23 -1.129 -0.977 4.063
171 HB2 LEU 23 1HB LEU 23 -1.565 0.371 6.474
172 HB3 LEU 23 2HB LEU 23 -0.685 -1.074 6.925
173 HG LEU 23 HG LEU 23 1.226 -0.453 5.693
174 HD11 LEU 23 1HD1 LEU 23 -0.723 1.198 4.154
175 HD12 LEU 23 2HD1 LEU 23 0.488 0.039 3.581
176 HD13 LEU 23 3HD1 LEU 23 0.984 1.635 4.162
177 HD21 LEU 23 3HD2 LEU 23 1.716 1.829 6.382
178 HD22 LEU 23 1HD2 LEU 23 0.885 0.960 7.668
179 HD23 LEU 23 2HD2 LEU 23 0.005 2.127 6.682
180 H ILE 24 H ILE 24 -0.712 -2.981 3.503
181 HA ILE 24 HA ILE 24 -1.723 -5.160 5.176
182 HB ILE 24 HB ILE 24 -2.130 -6.314 3.299
183 HG12 ILE 24 1HG1 ILE 24 0.347 -5.330 1.914
184 HG13 ILE 24 2HG1 ILE 24 0.442 -6.581 3.148
185 HG21 ILE 24 1HG2 ILE 24 -2.981 -4.143 2.648
186 HG22 ILE 24 2HG2 ILE 24 -2.334 -4.991 1.242
187 HG23 ILE 24 3HG2 ILE 24 -1.404 -3.697 1.994
188 HD11 ILE 24 3HD1 ILE 24 -1.134 -7.921 1.844
189 HD12 ILE 24 1HD1 ILE 24 0.382 -7.589 1.006
190 HD13 ILE 24 2HD1 ILE 24 -1.079 -6.695 0.577
191 H ALA 25 H ALA 25 1.236 -3.794 3.865
192 HA ALA 25 HA ALA 25 2.844 -5.442 5.617
193 HB1 ALA 25 3HB ALA 25 2.404 -6.975 3.726
194 HB2 ALA 25 1HB ALA 25 4.114 -6.562 3.882
195 HB3 ALA 25 2HB ALA 25 3.130 -5.799 2.631
196 H LEU 26 H LEU 26 5.064 -4.905 5.579
197 HA LEU 26 HA LEU 26 5.547 -2.161 4.685
198 HB2 LEU 26 1HB LEU 26 6.770 -3.917 6.789
199 HB3 LEU 26 2HB LEU 26 7.598 -2.474 6.234
200 HG LEU 26 HG LEU 26 6.470 -1.935 8.263
201 HD11 LEU 26 1HD1 LEU 26 6.397 -0.239 6.493
202 HD12 LEU 26 2HD1 LEU 26 5.021 -0.133 7.591
203 HD13 LEU 26 3HD1 LEU 26 4.820 -0.851 5.994
204 HD21 LEU 26 3HD2 LEU 26 4.055 -2.204 8.565
205 HD22 LEU 26 1HD2 LEU 26 4.862 -3.753 8.329
206 HD23 LEU 26 2HD2 LEU 26 3.956 -3.022 7.005
207 H CYS 27 H CYS 27 6.670 -1.903 2.884
208 HA CYS 27 HA CYS 27 8.078 -4.222 1.794
209 HB2 CYS 27 1HB CYS 27 7.030 -1.691 0.519
210 HB3 CYS 27 2HB CYS 27 7.933 -2.920 -0.356
211 HG CYS 27 HG CYS 27 5.476 -3.577 -1.135
212 H GLN 28 H GLN 28 9.948 -3.526 0.249
213 HA GLN 28 HA GLN 28 11.943 -2.276 1.868
214 HB2 GLN 28 1HB GLN 28 12.059 -3.114 -1.022
215 HB3 GLN 28 2HB GLN 28 13.438 -2.637 -0.048
216 HG2 GLN 28 1HG GLN 28 11.674 -5.025 0.433
217 HG3 GLN 28 2HG GLN 28 13.305 -5.048 -0.235
218 HE21 GLN 28 1HE2 GLN 28 15.054 -4.600 1.108
219 HE22 GLN 28 2HE2 GLN 28 14.930 -4.688 2.830
220 H LYS 29 H LYS 29 13.412 -0.595 0.744
221 HA LYS 29 HA LYS 29 13.670 1.609 0.204
222 HB2 LYS 29 1HB LYS 29 11.282 1.042 -1.546
223 HB3 LYS 29 2HB LYS 29 12.292 2.473 -1.663
224 HG2 LYS 29 1HG LYS 29 14.155 1.206 -2.393
225 HG3 LYS 29 2HG LYS 29 13.354 -0.316 -1.997
226 HD2 LYS 29 1HD LYS 29 12.447 1.630 -4.121
227 HD3 LYS 29 2HD LYS 29 13.360 0.150 -4.420
228 HE2 LYS 29 1HE LYS 29 11.515 -1.142 -3.392
229 HE3 LYS 29 2HE LYS 29 10.598 0.354 -3.226
230 HZ1 LYS 29 3HZ LYS 29 11.522 -0.826 -5.786
231 HZ2 LYS 29 1HZ LYS 29 10.643 0.609 -5.623
232 HZ3 LYS 29 2HZ LYS 29 9.943 -0.865 -5.192
233 H SER 30 H SER 30 11.745 0.614 2.249
234 HA SER 30 HA SER 30 10.305 1.277 3.809
235 HB2 SER 30 1HB SER 30 10.232 3.675 4.439
236 HB3 SER 30 2HB SER 30 11.863 3.032 4.307
237 HG SER 30 HG SER 30 11.072 4.064 1.945
238 H LEU 31 H LEU 31 9.396 1.091 0.893
239 HA LEU 31 HA LEU 31 7.036 2.690 0.806
240 HB2 LEU 31 1HB LEU 31 8.075 0.331 -0.718
241 HB3 LEU 31 2HB LEU 31 6.398 0.787 -0.883
242 HG LEU 31 HG LEU 31 7.960 1.667 -2.637
243 HD11 LEU 31 1HD1 LEU 31 6.442 3.723 -1.040
244 HD12 LEU 31 2HD1 LEU 31 5.743 2.620 -2.225
245 HD13 LEU 31 3HD1 LEU 31 6.898 3.847 -2.740
246 HD21 LEU 31 3HD2 LEU 31 8.853 3.498 -0.432
247 HD22 LEU 31 1HD2 LEU 31 9.278 3.633 -2.138
248 HD23 LEU 31 2HD2 LEU 31 9.834 2.250 -1.198
249 H LYS 32 H LYS 32 4.858 1.844 0.894
250 HA LYS 32 HA LYS 32 4.573 -0.355 2.839
251 HB2 LYS 32 1HB LYS 32 3.056 2.205 2.458
252 HB3 LYS 32 2HB LYS 32 2.266 0.814 3.172
253 HG2 LYS 32 1HG LYS 32 3.064 2.316 4.881
254 HG3 LYS 32 2HG LYS 32 3.927 0.779 4.964
255 HD2 LYS 32 1HD LYS 32 5.812 1.794 3.760
256 HD3 LYS 32 2HD LYS 32 4.931 3.318 3.658
257 HE2 LYS 32 1HE LYS 32 4.880 3.341 6.164
258 HE3 LYS 32 2HE LYS 32 5.968 1.954 6.135
259 HZ1 LYS 32 3HZ LYS 32 6.497 4.689 5.126
260 HZ2 LYS 32 1HZ LYS 32 7.495 3.370 4.767
261 HZ3 LYS 32 2HZ LYS 32 7.301 3.873 6.368
262 H CYS 33 H CYS 33 3.269 -2.054 2.285
263 HA CYS 33 HA CYS 33 2.272 -2.085 -0.427
264 HB2 CYS 33 1HB CYS 33 3.329 -4.097 0.554
265 HB3 CYS 33 2HB CYS 33 2.024 -4.186 1.733
266 HG CYS 33 HG CYS 33 1.811 -4.691 -1.637
267 H CYS 34 H CYS 34 0.391 -1.237 -0.913
268 HA CYS 34 HA CYS 34 -1.720 -1.213 1.137
269 HB2 CYS 34 1HB CYS 34 -1.380 0.708 -1.176
270 HB3 CYS 34 2HB CYS 34 -2.539 0.834 0.145
271 HG CYS 34 HG CYS 34 0.820 0.899 0.744
272 H ARG 35 H ARG 35 -3.463 -2.386 0.698
273 HA ARG 35 HA ARG 35 -3.868 -3.251 -2.085
274 HB2 ARG 35 1HB ARG 35 -5.074 -5.169 -1.232
275 HB3 ARG 35 2HB ARG 35 -3.501 -5.077 -0.461
276 HG2 ARG 35 1HG ARG 35 -4.695 -3.943 1.481
277 HG3 ARG 35 2HG ARG 35 -6.194 -4.477 0.719
278 HD2 ARG 35 1HD ARG 35 -5.362 -6.799 0.782
279 HD3 ARG 35 2HD ARG 35 -3.909 -6.242 1.591
280 HE ARG 35 HE ARG 35 -6.273 -5.482 3.004
281 HH11 ARG 35 1HH1 ARG 35 -4.092 -8.159 2.410
282 HH12 ARG 35 2HH1 ARG 35 -4.422 -8.933 3.925
283 HH21 ARG 35 1HH2 ARG 35 -6.705 -6.504 5.006
284 HH22 ARG 35 2HH2 ARG 35 -5.916 -8.004 5.391
285 H THR 36 H THR 36 -5.658 -2.726 -3.147
286 HA THR 36 HA THR 36 -7.467 -0.830 -1.970
287 HB THR 36 HB THR 36 -7.843 -2.143 -4.654
288 HG1 THR 36 HG1 THR 36 -5.822 -0.410 -3.802
289 HG21 THR 36 1HG2 THR 36 -9.628 -0.673 -3.840
290 HG22 THR 36 2HG2 THR 36 -8.807 0.035 -5.230
291 HG23 THR 36 3HG2 THR 36 -8.456 0.624 -3.606
292 H ILE 37 H ILE 37 -9.302 -1.268 -0.979
293 HA ILE 37 HA ILE 37 -9.963 -3.967 -0.416
294 HB ILE 37 HB ILE 37 -11.620 -1.531 0.208
295 HG12 ILE 37 1HG1 ILE 37 -9.288 -1.229 0.944
296 HG13 ILE 37 2HG1 ILE 37 -10.361 -1.433 2.318
297 HG21 ILE 37 1HG2 ILE 37 -12.341 -2.927 2.131
298 HG22 ILE 37 2HG2 ILE 37 -11.427 -4.273 1.456
299 HG23 ILE 37 3HG2 ILE 37 -12.799 -3.606 0.569
300 HD11 ILE 37 3HD1 ILE 37 -8.600 -3.561 1.128
301 HD12 ILE 37 1HD1 ILE 37 -9.663 -3.760 2.522
302 HD13 ILE 37 2HD1 ILE 37 -8.286 -2.661 2.614
303 H GLN 38 H GLN 38 -11.035 -5.274 -1.605
304 HA GLN 38 HA GLN 38 -12.715 -4.455 -3.785
305 HB2 GLN 38 1HB GLN 38 -13.107 -6.932 -3.999
306 HB3 GLN 38 2HB GLN 38 -11.417 -6.453 -4.066
307 HG2 GLN 38 1HG GLN 38 -11.164 -7.087 -1.702
308 HG3 GLN 38 2HG GLN 38 -12.843 -7.622 -1.685
309 HE21 GLN 38 1HE2 GLN 38 -12.714 -8.719 -4.374
310 HE22 GLN 38 2HE2 GLN 38 -11.795 -10.177 -4.261
311 HA PRO 39 HA PRO 39 -16.610 -4.129 -1.646
312 HB2 PRO 39 1HB PRO 39 -17.676 -5.586 -4.018
313 HB3 PRO 39 2HB PRO 39 -18.219 -4.067 -3.294
314 HG2 PRO 39 1HG PRO 39 -16.832 -4.078 -5.572
315 HG3 PRO 39 2HG PRO 39 -16.573 -2.823 -4.347
316 HD2 PRO 39 1HD PRO 39 -14.883 -5.182 -5.030
317 HD3 PRO 39 2HD PRO 39 -14.399 -3.561 -4.494
318 H SER 40 H SER 40 -17.078 -5.439 -0.012
319 HA SER 40 HA SER 40 -17.026 -8.347 -0.484
320 HB2 SER 40 1HB SER 40 -16.066 -6.845 1.966
321 HB3 SER 40 2HB SER 40 -16.040 -8.595 1.753
322 HG SER 40 HG SER 40 -14.677 -6.742 0.075
323 H GLY 41 H GLY 41 -18.257 -9.594 1.152
324 HA2 GLY 41 1HA GLY 41 -20.847 -8.489 1.617
325 HA3 GLY 41 2HA GLY 41 -20.257 -10.038 2.211
326 H SER 42 H SER 42 -21.431 -7.187 3.188
327 HA SER 42 HA SER 42 -21.498 -6.017 5.121
328 HB2 SER 42 1HB SER 42 -19.697 -8.146 6.296
329 HB3 SER 42 2HB SER 42 -20.656 -6.969 7.188
330 HG SER 42 HG SER 42 -21.751 -8.917 5.431
331 H ILE 43 H ILE 43 -20.534 -4.145 5.301
332 HA ILE 43 HA ILE 43 -18.964 -2.571 5.775
333 HB ILE 43 HB ILE 43 -16.872 -4.746 5.856
334 HG12 ILE 43 1HG1 ILE 43 -18.517 -3.595 8.129
335 HG13 ILE 43 2HG1 ILE 43 -18.685 -5.220 7.468
336 HG21 ILE 43 1HG2 ILE 43 -15.992 -2.478 5.626
337 HG22 ILE 43 2HG2 ILE 43 -15.619 -3.146 7.214
338 HG23 ILE 43 3HG2 ILE 43 -16.919 -1.969 7.035
339 HD11 ILE 43 3HD1 ILE 43 -16.238 -4.127 8.839
340 HD12 ILE 43 1HD1 ILE 43 -16.435 -5.761 8.207
341 HD13 ILE 43 2HD1 ILE 43 -17.430 -5.212 9.554
342 H ILE 44 H ILE 44 -18.173 -1.198 4.418
343 HA ILE 44 HA ILE 44 -17.454 -0.213 2.535
344 HB ILE 44 HB ILE 44 -15.384 -0.566 3.724
345 HG12 ILE 44 1HG1 ILE 44 -14.962 -1.006 0.768
346 HG13 ILE 44 2HG1 ILE 44 -15.433 0.532 1.482
347 HG21 ILE 44 1HG2 ILE 44 -13.871 -2.377 3.294
348 HG22 ILE 44 2HG2 ILE 44 -14.961 -3.061 2.091
349 HG23 ILE 44 3HG2 ILE 44 -15.428 -3.044 3.793
350 HD11 ILE 44 3HD1 ILE 44 -13.047 0.439 1.007
351 HD12 ILE 44 1HD1 ILE 44 -12.889 -0.962 2.065
352 HD13 ILE 44 2HD1 ILE 44 -13.355 0.599 2.737
353 H ASP 45 H ASP 45 -18.807 -0.505 0.922
354 HA ASP 45 HA ASP 45 -18.393 -2.765 -0.898
355 HB2 ASP 45 1HB ASP 45 -20.627 -0.759 -0.613
356 HB3 ASP 45 2HB ASP 45 -20.487 -1.807 -2.017
Start of MODEL 5
1 H PHE 1 1H PHE 1 9.051 -11.218 1.049
2 HA PHE 1 HA PHE 1 7.497 -13.001 0.574
3 HB2 PHE 1 1HB PHE 1 8.062 -14.399 2.533
4 HB3 PHE 1 2HB PHE 1 7.314 -13.203 3.587
5 HD1 PHE 1 HD1 PHE 1 6.572 -15.481 0.745
6 HD2 PHE 1 HD2 PHE 1 5.052 -13.354 4.104
7 HE1 PHE 1 HE1 PHE 1 4.399 -16.599 0.466
8 HE2 PHE 1 HE2 PHE 1 2.876 -14.471 3.830
9 HZ PHE 1 HZ PHE 1 2.549 -16.096 2.010
10 H PHE 2 H PHE 2 7.714 -10.248 2.627
11 HA PHE 2 HA PHE 2 5.121 -9.585 3.196
12 HB2 PHE 2 1HB PHE 2 7.470 -7.858 2.475
13 HB3 PHE 2 2HB PHE 2 5.905 -7.150 2.855
14 HD1 PHE 2 HD2 PHE 2 4.827 -7.993 5.090
15 HD2 PHE 2 HD1 PHE 2 8.977 -8.188 4.179
16 HE1 PHE 2 HE2 PHE 2 5.344 -8.111 7.491
17 HE2 PHE 2 HE1 PHE 2 9.501 -8.307 6.577
18 HZ PHE 2 HZ PHE 2 7.684 -8.267 8.237
19 H ASP 3 H ASP 3 6.830 -8.661 0.177
20 HA ASP 3 HA ASP 3 4.243 -7.832 -0.857
21 HB2 ASP 3 1HB ASP 3 5.376 -6.738 -2.647
22 HB3 ASP 3 2HB ASP 3 6.140 -6.287 -1.132
23 H GLU 4 H GLU 4 5.894 -10.607 -0.758
24 HA GLU 4 HA GLU 4 5.155 -11.660 -3.320
25 HB2 GLU 4 1HB GLU 4 6.791 -12.588 -1.425
26 HB3 GLU 4 2HB GLU 4 5.328 -13.389 -0.882
27 HG2 GLU 4 1HG GLU 4 6.414 -13.636 -3.673
28 HG3 GLU 4 2HG GLU 4 6.820 -14.741 -2.366
29 H LYS 5 H LYS 5 3.782 -11.453 -0.093
30 HA LYS 5 HA LYS 5 1.254 -12.596 -0.762
31 HB2 LYS 5 1HB LYS 5 2.269 -12.349 1.567
32 HB3 LYS 5 2HB LYS 5 1.825 -10.655 1.476
33 HG2 LYS 5 1HG LYS 5 0.177 -11.897 2.738
34 HG3 LYS 5 2HG LYS 5 -0.532 -11.285 1.242
35 HD2 LYS 5 1HD LYS 5 -0.468 -13.423 0.226
36 HD3 LYS 5 2HD LYS 5 0.588 -14.069 1.483
37 HE2 LYS 5 1HE LYS 5 -1.696 -14.873 1.757
38 HE3 LYS 5 2HE LYS 5 -1.216 -13.859 3.114
39 HZ1 LYS 5 3HZ LYS 5 -2.877 -12.965 0.819
40 HZ2 LYS 5 1HZ LYS 5 -2.460 -12.036 2.170
41 HZ3 LYS 5 2HZ LYS 5 -3.467 -13.378 2.346
42 H CYS 6 H CYS 6 2.654 -9.362 -0.794
43 HA CYS 6 HA CYS 6 0.327 -7.879 -1.341
44 HB2 CYS 6 1HB CYS 6 2.597 -6.939 -0.761
45 HB3 CYS 6 2HB CYS 6 3.116 -7.347 -2.388
46 HG CYS 6 HG CYS 6 1.691 -5.490 -3.697
47 H ASN 7 H ASN 7 2.671 -9.454 -3.453
48 HA ASN 7 HA ASN 7 1.603 -8.793 -5.940
49 HB2 ASN 7 1HB ASN 7 3.809 -9.862 -5.548
50 HB3 ASN 7 2HB ASN 7 2.990 -11.356 -5.131
51 HD21 ASN 7 1HD2 ASN 7 2.062 -9.150 -7.711
52 HD22 ASN 7 2HD2 ASN 7 2.404 -10.245 -9.006
53 H LYS 8 H LYS 8 0.976 -11.534 -3.828
54 HA LYS 8 HA LYS 8 -0.829 -12.928 -5.437
55 HB2 LYS 8 1HB LYS 8 0.249 -13.799 -3.376
56 HB3 LYS 8 2HB LYS 8 -0.806 -12.772 -2.419
57 HG2 LYS 8 1HG LYS 8 -1.630 -15.046 -2.448
58 HG3 LYS 8 2HG LYS 8 -2.755 -13.976 -3.288
59 HD2 LYS 8 1HD LYS 8 -1.883 -14.697 -5.430
60 HD3 LYS 8 2HD LYS 8 -0.679 -15.704 -4.627
61 HE2 LYS 8 1HE LYS 8 -2.457 -17.063 -3.657
62 HE3 LYS 8 2HE LYS 8 -3.667 -16.045 -4.434
63 HZ1 LYS 8 3HZ LYS 8 -1.628 -17.660 -5.860
64 HZ2 LYS 8 1HZ LYS 8 -2.839 -16.726 -6.580
65 HZ3 LYS 8 2HZ LYS 8 -3.253 -18.089 -5.673
66 H LEU 9 H LEU 9 -1.347 -10.277 -3.172
67 HA LEU 9 HA LEU 9 -4.225 -10.358 -3.571
68 HB2 LEU 9 1HB LEU 9 -2.522 -8.449 -1.973
69 HB3 LEU 9 2HB LEU 9 -4.271 -8.521 -1.951
70 HG LEU 9 HG LEU 9 -2.420 -10.711 -1.006
71 HD11 LEU 9 1HD1 LEU 9 -4.142 -8.774 0.532
72 HD12 LEU 9 2HD1 LEU 9 -2.379 -8.792 0.476
73 HD13 LEU 9 3HD1 LEU 9 -3.251 -10.131 1.225
74 HD21 LEU 9 3HD2 LEU 9 -4.449 -11.766 -0.157
75 HD22 LEU 9 1HD2 LEU 9 -4.510 -11.585 -1.908
76 HD23 LEU 9 2HD2 LEU 9 -5.423 -10.487 -0.876
77 H LYS 10 H LYS 10 -1.703 -9.210 -5.270
78 HA LYS 10 HA LYS 10 -1.430 -7.768 -6.983
79 HB2 LYS 10 1HB LYS 10 -4.448 -7.717 -6.893
80 HB3 LYS 10 2HB LYS 10 -3.509 -6.874 -8.114
81 HG2 LYS 10 1HG LYS 10 -4.127 -8.853 -9.153
82 HG3 LYS 10 2HG LYS 10 -2.474 -9.163 -8.624
83 HD2 LYS 10 1HD LYS 10 -3.360 -10.319 -6.634
84 HD3 LYS 10 2HD LYS 10 -4.997 -10.055 -7.235
85 HE2 LYS 10 1HE LYS 10 -4.427 -11.343 -9.261
86 HE3 LYS 10 2HE LYS 10 -2.827 -11.656 -8.587
87 HZ1 LYS 10 3HZ LYS 10 -5.424 -12.535 -7.451
88 HZ2 LYS 10 1HZ LYS 10 -3.925 -12.757 -6.700
89 HZ3 LYS 10 2HZ LYS 10 -4.256 -13.522 -8.173
90 H GLY 11 H GLY 11 -1.146 -6.778 -4.390
91 HA2 GLY 11 1HA GLY 11 -2.276 -4.075 -4.464
92 HA3 GLY 11 2HA GLY 11 -1.392 -4.795 -3.124
93 H THR 12 H THR 12 -0.755 -2.253 -3.944
94 HA THR 12 HA THR 12 1.763 -2.643 -5.440
95 HB THR 12 HB THR 12 0.393 0.019 -5.207
96 HG1 THR 12 HG1 THR 12 -1.166 -1.377 -6.103
97 HG21 THR 12 1HG2 THR 12 1.548 0.429 -7.339
98 HG22 THR 12 2HG2 THR 12 2.211 -1.204 -7.285
99 HG23 THR 12 3HG2 THR 12 2.677 -0.023 -6.061
100 H CYS 13 H CYS 13 3.634 -1.618 -4.642
101 HA CYS 13 HA CYS 13 3.512 -0.869 -1.838
102 HB2 CYS 13 1HB CYS 13 6.007 -0.878 -3.541
103 HB3 CYS 13 2HB CYS 13 5.873 -1.024 -1.797
104 HG CYS 13 HG CYS 13 5.818 -3.579 -1.693
105 H LYS 14 H LYS 14 2.863 1.106 -1.455
106 HA LYS 14 HA LYS 14 4.017 3.310 -3.012
107 HB2 LYS 14 1HB LYS 14 1.809 4.486 -2.790
108 HB3 LYS 14 2HB LYS 14 1.792 3.090 -3.859
109 HG2 LYS 14 1HG LYS 14 0.720 1.750 -2.185
110 HG3 LYS 14 2HG LYS 14 0.883 3.037 -0.991
111 HD2 LYS 14 1HD LYS 14 -1.378 3.006 -1.818
112 HD3 LYS 14 2HD LYS 14 -0.570 4.466 -2.390
113 HE2 LYS 14 1HE LYS 14 -0.203 3.417 -4.562
114 HE3 LYS 14 2HE LYS 14 -0.972 1.938 -3.990
115 HZ1 LYS 14 3HZ LYS 14 -2.510 3.254 -5.279
116 HZ2 LYS 14 1HZ LYS 14 -2.279 4.590 -4.268
117 HZ3 LYS 14 2HZ LYS 14 -3.029 3.191 -3.668
118 H ASN 15 H ASN 15 3.454 5.460 -1.802
119 HA ASN 15 HA ASN 15 4.629 5.265 0.790
120 HB2 ASN 15 1HB ASN 15 5.086 7.162 -0.661
121 HB3 ASN 15 2HB ASN 15 3.400 7.591 -0.634
122 HD21 ASN 15 1HD2 ASN 15 6.328 7.438 1.257
123 HD22 ASN 15 2HD2 ASN 15 5.810 8.538 2.491
124 H ASN 16 H ASN 16 1.684 6.874 -0.212
125 HA ASN 16 HA ASN 16 0.429 6.103 2.342
126 HB2 ASN 16 1HB ASN 16 -1.008 8.126 2.010
127 HB3 ASN 16 2HB ASN 16 0.701 8.492 2.217
128 HD21 ASN 16 1HD2 ASN 16 1.915 9.137 0.423
129 HD22 ASN 16 2HD2 ASN 16 1.152 9.812 -0.978
130 H CYS 17 H CYS 17 -1.671 5.367 2.355
131 HA CYS 17 HA CYS 17 -2.441 3.844 0.075
132 HB2 CYS 17 1HB CYS 17 -4.071 4.413 2.554
133 HB3 CYS 17 2HB CYS 17 -4.249 3.052 1.456
134 HG CYS 17 HG CYS 17 -1.630 2.058 2.140
135 H GLY 18 H GLY 18 -3.956 4.251 -1.443
136 HA2 GLY 18 1HA GLY 18 -5.068 6.942 -1.539
137 HA3 GLY 18 2HA GLY 18 -5.078 5.756 -2.838
138 H LYS 19 H LYS 19 -7.321 6.320 -3.137
139 HA LYS 19 HA LYS 19 -9.296 6.084 -1.197
140 HB2 LYS 19 1HB LYS 19 -10.852 5.669 -3.146
141 HB3 LYS 19 2HB LYS 19 -9.882 7.129 -3.234
142 HG2 LYS 19 1HG LYS 19 -9.690 6.357 -5.372
143 HG3 LYS 19 2HG LYS 19 -8.270 5.619 -4.636
144 HD2 LYS 19 1HD LYS 19 -9.523 3.522 -4.342
145 HD3 LYS 19 2HD LYS 19 -10.933 4.271 -5.099
146 HE2 LYS 19 1HE LYS 19 -9.636 4.615 -7.149
147 HE3 LYS 19 2HE LYS 19 -8.241 3.849 -6.390
148 HZ1 LYS 19 3HZ LYS 19 -10.851 2.547 -6.947
149 HZ2 LYS 19 1HZ LYS 19 -9.529 1.809 -6.193
150 HZ3 LYS 19 2HZ LYS 19 -9.414 2.301 -7.803
151 H ASN 20 H ASN 20 -10.235 4.483 -0.188
152 HA ASN 20 HA ASN 20 -10.719 2.404 0.576
153 HB2 ASN 20 1HB ASN 20 -10.800 1.759 -2.382
154 HB3 ASN 20 2HB ASN 20 -11.472 0.755 -1.104
155 HD21 ASN 20 1HD2 ASN 20 -13.356 1.427 -0.050
156 HD22 ASN 20 2HD2 ASN 20 -14.387 2.640 -0.727
157 H GLU 21 H GLU 21 -8.107 2.742 0.950
158 HA GLU 21 HA GLU 21 -7.069 0.083 0.280
159 HB2 GLU 21 1HB GLU 21 -5.606 2.689 -0.080
160 HB3 GLU 21 2HB GLU 21 -4.749 1.169 0.124
161 HG2 GLU 21 1HG GLU 21 -5.994 0.295 -1.854
162 HG3 GLU 21 2HG GLU 21 -6.631 1.921 -2.097
163 H GLU 22 H GLU 22 -5.608 -0.801 1.749
164 HA GLU 22 HA GLU 22 -5.252 0.675 4.271
165 HB2 GLU 22 1HB GLU 22 -5.668 -1.325 5.558
166 HB3 GLU 22 2HB GLU 22 -7.048 -1.025 4.515
167 HG2 GLU 22 1HG GLU 22 -6.262 -2.735 2.966
168 HG3 GLU 22 2HG GLU 22 -4.859 -3.017 3.993
169 H LEU 23 H LEU 23 -3.480 -0.296 5.612
170 HA LEU 23 HA LEU 23 -1.215 -0.819 3.865
171 HB2 LEU 23 1HB LEU 23 -1.507 0.729 6.112
172 HB3 LEU 23 2HB LEU 23 -0.759 -0.715 6.762
173 HG LEU 23 HG LEU 23 1.210 -0.417 5.483
174 HD11 LEU 23 1HD1 LEU 23 0.436 0.020 3.331
175 HD12 LEU 23 2HD1 LEU 23 1.284 1.499 3.796
176 HD13 LEU 23 3HD1 LEU 23 -0.479 1.440 3.846
177 HD21 LEU 23 3HD2 LEU 23 1.063 1.117 7.357
178 HD22 LEU 23 1HD2 LEU 23 0.226 2.298 6.351
179 HD23 LEU 23 2HD2 LEU 23 1.904 1.880 6.007
180 H ILE 24 H ILE 24 -0.760 -2.812 3.393
181 HA ILE 24 HA ILE 24 -1.811 -4.954 5.086
182 HB ILE 24 HB ILE 24 -2.222 -6.153 3.210
183 HG12 ILE 24 1HG1 ILE 24 -0.023 -5.003 1.550
184 HG13 ILE 24 2HG1 ILE 24 0.418 -6.103 2.851
185 HG21 ILE 24 1HG2 ILE 24 -2.637 -4.737 1.241
186 HG22 ILE 24 2HG2 ILE 24 -1.740 -3.431 2.012
187 HG23 ILE 24 3HG2 ILE 24 -3.241 -4.016 2.733
188 HD11 ILE 24 3HD1 ILE 24 -1.120 -7.757 1.900
189 HD12 ILE 24 1HD1 ILE 24 0.216 -7.325 0.834
190 HD13 ILE 24 2HD1 ILE 24 -1.396 -6.667 0.541
191 H ALA 25 H ALA 25 1.197 -3.716 3.761
192 HA ALA 25 HA ALA 25 2.732 -5.463 5.476
193 HB1 ALA 25 3HB ALA 25 2.238 -6.941 3.560
194 HB2 ALA 25 1HB ALA 25 3.960 -6.594 3.721
195 HB3 ALA 25 2HB ALA 25 3.007 -5.775 2.486
196 H LEU 26 H LEU 26 5.055 -5.133 5.195
197 HA LEU 26 HA LEU 26 5.588 -2.317 4.557
198 HB2 LEU 26 1HB LEU 26 6.779 -4.172 6.605
199 HB3 LEU 26 2HB LEU 26 7.437 -2.582 6.251
200 HG LEU 26 HG LEU 26 4.699 -3.176 7.387
201 HD11 LEU 26 1HD1 LEU 26 6.504 -3.528 8.985
202 HD12 LEU 26 2HD1 LEU 26 5.557 -2.100 9.401
203 HD13 LEU 26 3HD1 LEU 26 7.137 -1.919 8.637
204 HD21 LEU 26 3HD2 LEU 26 6.026 -0.539 6.766
205 HD22 LEU 26 1HD2 LEU 26 4.517 -0.739 7.655
206 HD23 LEU 26 2HD2 LEU 26 4.611 -1.216 5.961
207 H CYS 27 H CYS 27 6.990 -1.936 2.973
208 HA CYS 27 HA CYS 27 8.672 -4.162 2.042
209 HB2 CYS 27 1HB CYS 27 7.288 -1.929 0.594
210 HB3 CYS 27 2HB CYS 27 8.675 -2.727 -0.131
211 HG CYS 27 HG CYS 27 5.971 -4.509 0.935
212 H GLN 28 H GLN 28 10.700 -3.511 0.974
213 HA GLN 28 HA GLN 28 12.196 -1.691 2.569
214 HB2 GLN 28 1HB GLN 28 12.919 -3.042 -0.025
215 HB3 GLN 28 2HB GLN 28 14.040 -2.188 1.018
216 HG2 GLN 28 1HG GLN 28 13.625 -3.783 2.805
217 HG3 GLN 28 2HG GLN 28 12.472 -4.639 1.785
218 HE21 GLN 28 1HE2 GLN 28 13.650 -6.550 1.918
219 HE22 GLN 28 2HE2 GLN 28 15.148 -6.766 1.079
220 H LYS 29 H LYS 29 13.670 -0.076 1.283
221 HA LYS 29 HA LYS 29 13.765 2.009 0.379
222 HB2 LYS 29 1HB LYS 29 11.499 1.012 -1.344
223 HB3 LYS 29 2HB LYS 29 12.315 2.548 -1.577
224 HG2 LYS 29 1HG LYS 29 14.442 1.247 -1.889
225 HG3 LYS 29 2HG LYS 29 13.454 -0.214 -1.908
226 HD2 LYS 29 1HD LYS 29 13.131 2.133 -3.779
227 HD3 LYS 29 2HD LYS 29 13.956 0.628 -4.176
228 HE2 LYS 29 1HE LYS 29 11.098 0.694 -3.250
229 HE3 LYS 29 2HE LYS 29 11.537 0.877 -4.948
230 HZ1 LYS 29 3HZ LYS 29 11.010 -1.411 -4.443
231 HZ2 LYS 29 1HZ LYS 29 12.181 -1.454 -3.223
232 HZ3 LYS 29 2HZ LYS 29 12.648 -1.277 -4.836
233 H SER 30 H SER 30 11.611 0.981 2.382
234 HA SER 30 HA SER 30 10.293 1.969 3.928
235 HB2 SER 30 1HB SER 30 10.734 4.534 2.388
236 HB3 SER 30 2HB SER 30 9.991 4.405 3.983
237 HG SER 30 HG SER 30 12.591 3.420 3.429
238 H LEU 31 H LEU 31 9.526 1.505 0.767
239 HA LEU 31 HA LEU 31 6.936 2.628 0.612
240 HB2 LEU 31 1HB LEU 31 8.366 0.419 -0.839
241 HB3 LEU 31 2HB LEU 31 6.665 0.689 -1.107
242 HG LEU 31 HG LEU 31 8.122 1.736 -2.797
243 HD11 LEU 31 1HD1 LEU 31 5.894 2.618 -2.393
244 HD12 LEU 31 2HD1 LEU 31 7.015 3.909 -2.819
245 HD13 LEU 31 3HD1 LEU 31 6.532 3.680 -1.138
246 HD21 LEU 31 3HD2 LEU 31 9.371 3.752 -2.257
247 HD22 LEU 31 1HD2 LEU 31 10.008 2.345 -1.407
248 HD23 LEU 31 2HD2 LEU 31 9.009 3.515 -0.547
249 H LYS 32 H LYS 32 4.895 1.647 0.908
250 HA LYS 32 HA LYS 32 4.929 -0.825 2.525
251 HB2 LYS 32 1HB LYS 32 2.989 1.483 2.681
252 HB3 LYS 32 2HB LYS 32 2.808 -0.034 3.542
253 HG2 LYS 32 1HG LYS 32 3.699 1.203 5.192
254 HG3 LYS 32 2HG LYS 32 5.202 0.637 4.453
255 HD2 LYS 32 1HD LYS 32 5.395 2.698 3.186
256 HD3 LYS 32 2HD LYS 32 3.852 3.263 3.827
257 HE2 LYS 32 1HE LYS 32 5.658 4.323 5.023
258 HE3 LYS 32 2HE LYS 32 4.811 3.212 6.098
259 HZ1 LYS 32 3HZ LYS 32 7.220 3.049 6.319
260 HZ2 LYS 32 1HZ LYS 32 7.357 2.626 4.686
261 HZ3 LYS 32 2HZ LYS 32 6.562 1.594 5.766
262 H CYS 33 H CYS 33 3.163 -2.285 2.188
263 HA CYS 33 HA CYS 33 2.200 -2.207 -0.546
264 HB2 CYS 33 1HB CYS 33 1.976 -4.276 1.638
265 HB3 CYS 33 2HB CYS 33 1.306 -4.470 0.026
266 HG CYS 33 HG CYS 33 3.591 -4.786 -1.294
267 H CYS 34 H CYS 34 0.324 -1.331 -1.056
268 HA CYS 34 HA CYS 34 -1.788 -1.258 0.996
269 HB2 CYS 34 1HB CYS 34 -1.366 0.607 -1.351
270 HB3 CYS 34 2HB CYS 34 -2.690 0.703 -0.195
271 HG CYS 34 HG CYS 34 0.592 1.022 0.710
272 H ARG 35 H ARG 35 -3.663 -2.247 0.562
273 HA ARG 35 HA ARG 35 -4.041 -3.232 -2.192
274 HB2 ARG 35 1HB ARG 35 -5.259 -5.134 -1.310
275 HB3 ARG 35 2HB ARG 35 -3.666 -5.058 -0.580
276 HG2 ARG 35 1HG ARG 35 -4.816 -3.891 1.381
277 HG3 ARG 35 2HG ARG 35 -6.326 -4.448 0.660
278 HD2 ARG 35 1HD ARG 35 -5.564 -6.754 0.798
279 HD3 ARG 35 2HD ARG 35 -4.010 -6.229 1.413
280 HE ARG 35 HE ARG 35 -5.774 -5.210 3.201
281 HH11 ARG 35 1HH1 ARG 35 -5.270 -8.422 1.911
282 HH12 ARG 35 2HH1 ARG 35 -5.719 -9.222 3.379
283 HH21 ARG 35 1HH2 ARG 35 -6.367 -6.244 5.133
284 HH22 ARG 35 2HH2 ARG 35 -6.351 -7.985 5.215
285 H THR 36 H THR 36 -5.885 -2.786 -3.226
286 HA THR 36 HA THR 36 -7.576 -0.767 -2.061
287 HB THR 36 HB THR 36 -7.891 -2.075 -4.767
288 HG1 THR 36 HG1 THR 36 -5.930 -0.444 -3.804
289 HG21 THR 36 1HG2 THR 36 -9.798 -0.714 -3.977
290 HG22 THR 36 2HG2 THR 36 -8.994 0.016 -5.365
291 HG23 THR 36 3HG2 THR 36 -8.710 0.657 -3.748
292 H ILE 37 H ILE 37 -9.308 -1.119 -0.978
293 HA ILE 37 HA ILE 37 -10.347 -3.714 -0.494
294 HB ILE 37 HB ILE 37 -11.528 -1.034 0.233
295 HG12 ILE 37 1HG1 ILE 37 -9.263 -1.089 1.030
296 HG13 ILE 37 2HG1 ILE 37 -10.323 -1.386 2.398
297 HG21 ILE 37 1HG2 ILE 37 -12.560 -2.268 2.091
298 HG22 ILE 37 2HG2 ILE 37 -11.896 -3.768 1.445
299 HG23 ILE 37 3HG2 ILE 37 -13.092 -2.862 0.518
300 HD11 ILE 37 3HD1 ILE 37 -9.870 -3.794 2.187
301 HD12 ILE 37 1HD1 ILE 37 -8.421 -2.844 2.513
302 HD13 ILE 37 2HD1 ILE 37 -8.738 -3.437 0.884
303 H GLN 38 H GLN 38 -11.972 -4.739 -1.414
304 HA GLN 38 HA GLN 38 -13.601 -3.376 -3.416
305 HB2 GLN 38 1HB GLN 38 -13.390 -6.297 -2.652
306 HB3 GLN 38 2HB GLN 38 -14.419 -5.670 -3.932
307 HG2 GLN 38 1HG GLN 38 -11.415 -5.519 -3.839
308 HG3 GLN 38 2HG GLN 38 -12.375 -6.615 -4.832
309 HE21 GLN 38 1HE2 GLN 38 -13.504 -5.798 -6.597
310 HE22 GLN 38 2HE2 GLN 38 -13.142 -4.254 -7.282
311 HA PRO 39 HA PRO 39 -16.894 -2.608 -0.491
312 HB2 PRO 39 1HB PRO 39 -18.509 -3.043 -2.966
313 HB3 PRO 39 2HB PRO 39 -18.603 -1.738 -1.780
314 HG2 PRO 39 1HG PRO 39 -17.438 -1.333 -4.133
315 HG3 PRO 39 2HG PRO 39 -16.759 -0.631 -2.653
316 HD2 PRO 39 1HD PRO 39 -15.811 -2.957 -4.253
317 HD3 PRO 39 2HD PRO 39 -14.878 -1.763 -3.332
318 H SER 40 H SER 40 -17.924 -3.974 0.799
319 HA SER 40 HA SER 40 -19.072 -5.765 1.602
320 HB2 SER 40 1HB SER 40 -20.498 -5.647 -0.406
321 HB3 SER 40 2HB SER 40 -19.324 -6.625 -1.286
322 HG SER 40 HG SER 40 -19.821 -8.036 0.812
323 H GLY 41 H GLY 41 -16.180 -5.828 0.053
324 HA2 GLY 41 1HA GLY 41 -15.539 -8.600 0.118
325 HA3 GLY 41 2HA GLY 41 -14.391 -7.271 0.035
326 H SER 42 H SER 42 -14.668 -9.837 1.673
327 HA SER 42 HA SER 42 -14.673 -8.726 4.376
328 HB2 SER 42 1HB SER 42 -14.529 -11.612 3.471
329 HB3 SER 42 2HB SER 42 -14.816 -11.039 5.114
330 HG SER 42 HG SER 42 -16.713 -9.929 4.126
331 H ILE 43 H ILE 43 -12.990 -10.348 5.733
332 HA ILE 43 HA ILE 43 -10.856 -11.027 6.165
333 HB ILE 43 HB ILE 43 -10.280 -10.434 3.256
334 HG12 ILE 43 1HG1 ILE 43 -10.807 -13.077 4.645
335 HG13 ILE 43 2HG1 ILE 43 -11.973 -12.219 3.643
336 HG21 ILE 43 1HG2 ILE 43 -8.256 -10.377 4.612
337 HG22 ILE 43 2HG2 ILE 43 -8.276 -11.805 3.578
338 HG23 ILE 43 3HG2 ILE 43 -8.653 -11.955 5.294
339 HD11 ILE 43 3HD1 ILE 43 -10.913 -14.042 2.432
340 HD12 ILE 43 1HD1 ILE 43 -9.330 -13.320 2.714
341 HD13 ILE 43 2HD1 ILE 43 -10.516 -12.484 1.711
342 H ILE 44 H ILE 44 -11.147 -8.109 4.209
343 HA ILE 44 HA ILE 44 -8.709 -6.942 5.118
344 HB ILE 44 HB ILE 44 -9.482 -4.924 3.959
345 HG12 ILE 44 1HG1 ILE 44 -11.724 -5.445 2.583
346 HG13 ILE 44 2HG1 ILE 44 -12.089 -6.365 4.037
347 HG21 ILE 44 1HG2 ILE 44 -9.714 -5.928 1.700
348 HG22 ILE 44 2HG2 ILE 44 -9.911 -7.508 2.467
349 HG23 ILE 44 3HG2 ILE 44 -8.398 -6.619 2.651
350 HD11 ILE 44 3HD1 ILE 44 -13.033 -4.150 4.181
351 HD12 ILE 44 1HD1 ILE 44 -11.448 -3.425 3.895
352 HD13 ILE 44 2HD1 ILE 44 -11.751 -4.335 5.378
353 H ASP 45 H ASP 45 -8.857 -4.574 6.033
354 HA ASP 45 HA ASP 45 -10.942 -4.212 7.997
355 HB2 ASP 45 1HB ASP 45 -9.433 -5.820 9.134
356 HB3 ASP 45 2HB ASP 45 -8.107 -4.676 8.948
Start of MODEL 6
1 H PHE 1 1H PHE 1 8.617 -12.131 2.011
2 HA PHE 1 HA PHE 1 6.452 -14.075 1.479
3 HB2 PHE 1 1HB PHE 1 7.509 -12.937 4.080
4 HB3 PHE 1 2HB PHE 1 6.127 -14.011 3.926
5 HD1 PHE 1 HD2 PHE 1 6.442 -16.360 3.318
6 HD2 PHE 1 HD1 PHE 1 9.748 -13.764 3.977
7 HE1 PHE 1 HE2 PHE 1 7.926 -18.309 3.535
8 HE2 PHE 1 HE1 PHE 1 11.235 -15.708 4.201
9 HZ PHE 1 HZ PHE 1 10.327 -17.982 3.979
10 H PHE 2 H PHE 2 7.267 -10.873 2.831
11 HA PHE 2 HA PHE 2 4.672 -10.045 3.381
12 HB2 PHE 2 1HB PHE 2 7.206 -8.551 2.810
13 HB3 PHE 2 2HB PHE 2 5.693 -7.680 3.031
14 HD1 PHE 2 HD1 PHE 2 4.405 -8.047 5.178
15 HD2 PHE 2 HD2 PHE 2 8.439 -9.289 4.650
16 HE1 PHE 2 HE1 PHE 2 4.683 -8.160 7.618
17 HE2 PHE 2 HE2 PHE 2 8.723 -9.410 7.090
18 HZ PHE 2 HZ PHE 2 6.843 -8.846 8.576
19 H ASP 3 H ASP 3 6.574 -9.274 0.429
20 HA ASP 3 HA ASP 3 4.108 -8.239 -0.701
21 HB2 ASP 3 1HB ASP 3 5.421 -7.378 -2.538
22 HB3 ASP 3 2HB ASP 3 6.093 -6.869 -0.998
23 H GLU 4 H GLU 4 5.293 -11.201 -0.432
24 HA GLU 4 HA GLU 4 4.407 -12.201 -2.990
25 HB2 GLU 4 1HB GLU 4 5.946 -13.504 -1.497
26 HB3 GLU 4 2HB GLU 4 4.632 -13.660 -0.340
27 HG2 GLU 4 1HG GLU 4 4.769 -15.685 -1.573
28 HG3 GLU 4 2HG GLU 4 3.317 -14.834 -2.092
29 H LYS 5 H LYS 5 3.159 -11.630 0.224
30 HA LYS 5 HA LYS 5 0.479 -12.405 -0.222
31 HB2 LYS 5 1HB LYS 5 1.629 -11.908 1.998
32 HB3 LYS 5 2HB LYS 5 1.442 -10.208 1.609
33 HG2 LYS 5 1HG LYS 5 -0.310 -10.837 3.090
34 HG3 LYS 5 2HG LYS 5 -1.015 -10.567 1.495
35 HD2 LYS 5 1HD LYS 5 -1.230 -12.888 1.095
36 HD3 LYS 5 2HD LYS 5 -0.202 -13.293 2.471
37 HE2 LYS 5 1HE LYS 5 -2.542 -13.709 2.987
38 HE3 LYS 5 2HE LYS 5 -1.896 -12.420 3.997
39 HZ1 LYS 5 3HZ LYS 5 -4.098 -11.893 3.159
40 HZ2 LYS 5 1HZ LYS 5 -3.552 -12.033 1.566
41 HZ3 LYS 5 2HZ LYS 5 -2.955 -10.803 2.561
42 H CYS 6 H CYS 6 2.274 -9.394 -0.636
43 HA CYS 6 HA CYS 6 0.167 -7.738 -1.469
44 HB2 CYS 6 1HB CYS 6 2.535 -7.039 -0.866
45 HB3 CYS 6 2HB CYS 6 3.035 -7.623 -2.446
46 HG CYS 6 HG CYS 6 1.420 -5.780 -3.848
47 H ASN 7 H ASN 7 2.347 -9.863 -3.243
48 HA ASN 7 HA ASN 7 1.409 -9.396 -5.848
49 HB2 ASN 7 1HB ASN 7 3.499 -10.556 -5.398
50 HB3 ASN 7 2HB ASN 7 2.641 -11.864 -4.608
51 HD21 ASN 7 1HD2 ASN 7 3.477 -13.392 -5.976
52 HD22 ASN 7 2HD2 ASN 7 2.969 -13.544 -7.625
53 H LYS 8 H LYS 8 0.588 -11.919 -3.516
54 HA LYS 8 HA LYS 8 -1.308 -13.328 -4.947
55 HB2 LYS 8 1HB LYS 8 -0.399 -13.996 -2.749
56 HB3 LYS 8 2HB LYS 8 -1.340 -12.726 -1.983
57 HG2 LYS 8 1HG LYS 8 -2.422 -14.863 -1.688
58 HG3 LYS 8 2HG LYS 8 -3.406 -13.826 -2.721
59 HD2 LYS 8 1HD LYS 8 -2.620 -14.987 -4.694
60 HD3 LYS 8 2HD LYS 8 -1.523 -15.963 -3.716
61 HE2 LYS 8 1HE LYS 8 -3.515 -17.231 -4.288
62 HE3 LYS 8 2HE LYS 8 -3.443 -16.942 -2.552
63 HZ1 LYS 8 3HZ LYS 8 -5.665 -16.585 -3.430
64 HZ2 LYS 8 1HZ LYS 8 -5.086 -15.401 -4.486
65 HZ3 LYS 8 2HZ LYS 8 -5.030 -15.145 -2.818
66 H LEU 9 H LEU 9 -1.798 -10.459 -2.917
67 HA LEU 9 HA LEU 9 -4.628 -10.402 -3.471
68 HB2 LEU 9 1HB LEU 9 -2.860 -8.374 -2.104
69 HB3 LEU 9 2HB LEU 9 -4.611 -8.348 -2.130
70 HG LEU 9 HG LEU 9 -2.945 -10.513 -0.850
71 HD11 LEU 9 1HD1 LEU 9 -2.712 -8.415 0.339
72 HD12 LEU 9 2HD1 LEU 9 -3.704 -9.540 1.265
73 HD13 LEU 9 3HD1 LEU 9 -4.464 -8.221 0.376
74 HD21 LEU 9 3HD2 LEU 9 -5.092 -11.340 -1.604
75 HD22 LEU 9 1HD2 LEU 9 -5.909 -9.983 -0.830
76 HD23 LEU 9 2HD2 LEU 9 -5.088 -11.192 0.153
77 H LYS 10 H LYS 10 -1.878 -9.410 -5.059
78 HA LYS 10 HA LYS 10 -1.403 -8.116 -6.831
79 HB2 LYS 10 1HB LYS 10 -4.385 -8.312 -7.172
80 HB3 LYS 10 2HB LYS 10 -3.379 -7.419 -8.302
81 HG2 LYS 10 1HG LYS 10 -3.004 -10.328 -7.620
82 HG3 LYS 10 2HG LYS 10 -3.875 -9.729 -9.035
83 HD2 LYS 10 1HD LYS 10 -1.866 -8.653 -9.854
84 HD3 LYS 10 2HD LYS 10 -0.983 -9.129 -8.407
85 HE2 LYS 10 1HE LYS 10 -2.216 -11.067 -10.353
86 HE3 LYS 10 2HE LYS 10 -0.531 -10.549 -10.405
87 HZ1 LYS 10 3HZ LYS 10 -0.243 -11.454 -8.169
88 HZ2 LYS 10 1HZ LYS 10 -0.750 -12.646 -9.256
89 HZ3 LYS 10 2HZ LYS 10 -1.848 -11.980 -8.161
90 H GLY 11 H GLY 11 -1.446 -6.918 -4.388
91 HA2 GLY 11 1HA GLY 11 -2.478 -4.216 -4.914
92 HA3 GLY 11 2HA GLY 11 -1.858 -4.801 -3.371
93 H THR 12 H THR 12 -0.794 -2.504 -3.961
94 HA THR 12 HA THR 12 1.820 -3.168 -5.123
95 HB THR 12 HB THR 12 0.646 -1.946 -6.839
96 HG1 THR 12 HG1 THR 12 2.689 -1.293 -6.971
97 HG21 THR 12 1HG2 THR 12 -0.122 0.359 -6.465
98 HG22 THR 12 2HG2 THR 12 0.269 0.189 -4.754
99 HG23 THR 12 3HG2 THR 12 -1.000 -0.803 -5.472
100 H CYS 13 H CYS 13 3.544 -1.857 -4.439
101 HA CYS 13 HA CYS 13 3.232 -1.034 -1.660
102 HB2 CYS 13 1HB CYS 13 5.852 -1.039 -3.146
103 HB3 CYS 13 2HB CYS 13 5.550 -1.261 -1.428
104 HG CYS 13 HG CYS 13 4.778 -3.560 -3.844
105 H LYS 14 H LYS 14 2.643 0.974 -1.344
106 HA LYS 14 HA LYS 14 3.894 3.082 -2.963
107 HB2 LYS 14 1HB LYS 14 1.775 4.356 -2.827
108 HB3 LYS 14 2HB LYS 14 1.616 2.860 -3.738
109 HG2 LYS 14 1HG LYS 14 0.602 1.782 -1.798
110 HG3 LYS 14 2HG LYS 14 0.761 3.282 -0.883
111 HD2 LYS 14 1HD LYS 14 -1.495 3.076 -1.717
112 HD3 LYS 14 2HD LYS 14 -0.678 4.409 -2.539
113 HE2 LYS 14 1HE LYS 14 -0.282 2.993 -4.475
114 HE3 LYS 14 2HE LYS 14 -1.013 1.620 -3.645
115 HZ1 LYS 14 3HZ LYS 14 -2.567 2.633 -5.170
116 HZ2 LYS 14 1HZ LYS 14 -2.398 4.131 -4.405
117 HZ3 LYS 14 2HZ LYS 14 -3.109 2.834 -3.577
118 H ASN 15 H ASN 15 3.690 5.257 -1.822
119 HA ASN 15 HA ASN 15 4.811 4.901 0.785
120 HB2 ASN 15 1HB ASN 15 4.194 7.348 -0.864
121 HB3 ASN 15 2HB ASN 15 4.996 7.405 0.696
122 HD21 ASN 15 1HD2 ASN 15 7.090 6.572 0.887
123 HD22 ASN 15 2HD2 ASN 15 8.092 6.318 -0.499
124 H ASN 16 H ASN 16 1.942 6.574 -0.487
125 HA ASN 16 HA ASN 16 0.731 6.393 2.201
126 HB2 ASN 16 1HB ASN 16 0.208 8.461 0.049
127 HB3 ASN 16 2HB ASN 16 -0.550 8.411 1.636
128 HD21 ASN 16 1HD2 ASN 16 2.454 8.895 -0.079
129 HD22 ASN 16 2HD2 ASN 16 3.241 9.806 1.164
130 H CYS 17 H CYS 17 -1.271 5.453 2.335
131 HA CYS 17 HA CYS 17 -2.112 3.836 0.153
132 HB2 CYS 17 1HB CYS 17 -3.660 4.457 2.675
133 HB3 CYS 17 2HB CYS 17 -3.859 3.061 1.625
134 HG CYS 17 HG CYS 17 -1.044 2.339 2.229
135 H GLY 18 H GLY 18 -3.719 4.090 -1.282
136 HA2 GLY 18 1HA GLY 18 -4.726 6.806 -1.612
137 HA3 GLY 18 2HA GLY 18 -4.816 5.504 -2.788
138 H LYS 19 H LYS 19 -7.029 6.140 -3.123
139 HA LYS 19 HA LYS 19 -8.941 6.190 -1.076
140 HB2 LYS 19 1HB LYS 19 -10.621 6.025 -2.875
141 HB3 LYS 19 2HB LYS 19 -9.398 7.237 -3.204
142 HG2 LYS 19 1HG LYS 19 -9.569 6.262 -5.256
143 HG3 LYS 19 2HG LYS 19 -8.280 5.282 -4.562
144 HD2 LYS 19 1HD LYS 19 -9.896 3.554 -3.961
145 HD3 LYS 19 2HD LYS 19 -11.208 4.549 -4.602
146 HE2 LYS 19 1HE LYS 19 -10.167 4.444 -6.829
147 HE3 LYS 19 2HE LYS 19 -8.902 3.407 -6.174
148 HZ1 LYS 19 3HZ LYS 19 -11.797 2.782 -6.346
149 HZ2 LYS 19 1HZ LYS 19 -10.659 1.809 -5.560
150 HZ3 LYS 19 2HZ LYS 19 -10.548 2.059 -7.227
151 H ASN 20 H ASN 20 -10.077 4.705 -0.064
152 HA ASN 20 HA ASN 20 -10.708 2.682 0.752
153 HB2 ASN 20 1HB ASN 20 -10.919 2.115 -2.209
154 HB3 ASN 20 2HB ASN 20 -11.539 1.044 -0.958
155 HD21 ASN 20 1HD2 ASN 20 -13.331 1.664 0.237
156 HD22 ASN 20 2HD2 ASN 20 -14.375 2.945 -0.274
157 H GLU 21 H GLU 21 -8.088 2.859 1.053
158 HA GLU 21 HA GLU 21 -7.157 0.172 0.344
159 HB2 GLU 21 1HB GLU 21 -5.669 2.766 0.019
160 HB3 GLU 21 2HB GLU 21 -4.808 1.247 0.218
161 HG2 GLU 21 1HG GLU 21 -5.931 0.356 -1.752
162 HG3 GLU 21 2HG GLU 21 -6.795 1.876 -1.952
163 H GLU 22 H GLU 22 -5.441 -0.633 1.705
164 HA GLU 22 HA GLU 22 -5.124 0.721 4.276
165 HB2 GLU 22 1HB GLU 22 -5.729 -1.199 5.568
166 HB3 GLU 22 2HB GLU 22 -7.052 -0.875 4.458
167 HG2 GLU 22 1HG GLU 22 -6.253 -2.656 2.988
168 HG3 GLU 22 2HG GLU 22 -4.927 -2.974 4.104
169 H LEU 23 H LEU 23 -3.364 -0.158 5.543
170 HA LEU 23 HA LEU 23 -1.124 -0.901 3.884
171 HB2 LEU 23 1HB LEU 23 -1.284 0.639 6.044
172 HB3 LEU 23 2HB LEU 23 -1.016 -0.875 6.860
173 HG LEU 23 HG LEU 23 0.856 0.268 4.796
174 HD11 LEU 23 1HD1 LEU 23 0.947 0.402 7.808
175 HD12 LEU 23 2HD1 LEU 23 0.772 1.760 6.696
176 HD13 LEU 23 3HD1 LEU 23 2.275 0.841 6.736
177 HD21 LEU 23 3HD2 LEU 23 0.982 -2.140 5.065
178 HD22 LEU 23 1HD2 LEU 23 1.145 -1.945 6.808
179 HD23 LEU 23 2HD2 LEU 23 2.415 -1.358 5.734
180 H ILE 24 H ILE 24 -0.602 -2.922 3.446
181 HA ILE 24 HA ILE 24 -1.747 -5.066 5.103
182 HB ILE 24 HB ILE 24 -2.171 -6.315 3.246
183 HG12 ILE 24 1HG1 ILE 24 -0.169 -4.996 1.463
184 HG13 ILE 24 2HG1 ILE 24 0.424 -6.101 2.699
185 HG21 ILE 24 1HG2 ILE 24 -1.964 -3.539 2.102
186 HG22 ILE 24 2HG2 ILE 24 -3.367 -4.262 2.890
187 HG23 ILE 24 3HG2 ILE 24 -2.802 -4.887 1.339
188 HD11 ILE 24 3HD1 ILE 24 0.147 -7.315 0.695
189 HD12 ILE 24 1HD1 ILE 24 -1.495 -6.702 0.484
190 HD13 ILE 24 2HD1 ILE 24 -1.129 -7.802 1.811
191 H ALA 25 H ALA 25 1.215 -3.882 3.623
192 HA ALA 25 HA ALA 25 2.822 -5.573 5.335
193 HB1 ALA 25 3HB ALA 25 3.991 -6.732 3.565
194 HB2 ALA 25 1HB ALA 25 3.019 -5.917 2.341
195 HB3 ALA 25 2HB ALA 25 2.265 -7.072 3.439
196 H LEU 26 H LEU 26 5.166 -5.187 4.926
197 HA LEU 26 HA LEU 26 5.540 -2.342 4.298
198 HB2 LEU 26 1HB LEU 26 6.893 -4.195 6.235
199 HB3 LEU 26 2HB LEU 26 7.576 -2.633 5.815
200 HG LEU 26 HG LEU 26 4.890 -3.092 7.126
201 HD11 LEU 26 1HD1 LEU 26 6.776 -3.591 8.599
202 HD12 LEU 26 2HD1 LEU 26 5.921 -2.136 9.109
203 HD13 LEU 26 3HD1 LEU 26 7.462 -2.002 8.261
204 HD21 LEU 26 3HD2 LEU 26 4.842 -1.100 5.747
205 HD22 LEU 26 1HD2 LEU 26 6.355 -0.540 6.460
206 HD23 LEU 26 2HD2 LEU 26 4.901 -0.648 7.449
207 H CYS 27 H CYS 27 7.526 -1.706 3.304
208 HA CYS 27 HA CYS 27 9.127 -3.782 2.035
209 HB2 CYS 27 1HB CYS 27 7.445 -1.767 0.558
210 HB3 CYS 27 2HB CYS 27 8.853 -2.509 -0.187
211 HG CYS 27 HG CYS 27 6.628 -4.635 1.179
212 H GLN 28 H GLN 28 10.882 -2.620 0.613
213 HA GLN 28 HA GLN 28 12.333 -0.879 2.334
214 HB2 GLN 28 1HB GLN 28 12.849 -1.542 -0.557
215 HB3 GLN 28 2HB GLN 28 13.989 -0.789 0.537
216 HG2 GLN 28 1HG GLN 28 12.851 -3.548 0.884
217 HG3 GLN 28 2HG GLN 28 14.416 -3.186 0.166
218 HE21 GLN 28 1HE2 GLN 28 14.962 -1.005 2.027
219 HE22 GLN 28 2HE2 GLN 28 15.349 -1.749 3.540
220 H LYS 29 H LYS 29 13.358 1.150 1.376
221 HA LYS 29 HA LYS 29 13.189 3.302 0.656
222 HB2 LYS 29 1HB LYS 29 11.059 2.199 -1.170
223 HB3 LYS 29 2HB LYS 29 11.797 3.785 -1.319
224 HG2 LYS 29 1HG LYS 29 13.936 2.772 -1.817
225 HG3 LYS 29 2HG LYS 29 13.261 1.163 -1.557
226 HD2 LYS 29 1HD LYS 29 12.399 3.119 -3.691
227 HD3 LYS 29 2HD LYS 29 13.413 1.697 -3.944
228 HE2 LYS 29 1HE LYS 29 11.562 0.266 -3.179
229 HE3 LYS 29 2HE LYS 29 10.553 1.696 -2.973
230 HZ1 LYS 29 3HZ LYS 29 11.718 0.773 -5.544
231 HZ2 LYS 29 1HZ LYS 29 10.731 2.131 -5.335
232 HZ3 LYS 29 2HZ LYS 29 10.107 0.584 -5.069
233 H SER 30 H SER 30 11.168 1.919 2.570
234 HA SER 30 HA SER 30 9.569 2.565 4.026
235 HB2 SER 30 1HB SER 30 10.800 4.795 3.942
236 HB3 SER 30 2HB SER 30 9.585 5.318 2.780
237 HG SER 30 HG SER 30 8.949 4.299 5.354
238 H LEU 31 H LEU 31 9.094 1.715 1.135
239 HA LEU 31 HA LEU 31 6.434 2.699 0.613
240 HB2 LEU 31 1HB LEU 31 8.176 0.573 -0.613
241 HB3 LEU 31 2HB LEU 31 6.495 0.714 -1.049
242 HG LEU 31 HG LEU 31 8.249 1.818 -2.562
243 HD11 LEU 31 1HD1 LEU 31 6.747 3.612 -3.148
244 HD12 LEU 31 2HD1 LEU 31 5.961 3.508 -1.573
245 HD13 LEU 31 3HD1 LEU 31 5.817 2.174 -2.723
246 HD21 LEU 31 3HD2 LEU 31 9.439 2.956 -0.684
247 HD22 LEU 31 1HD2 LEU 31 8.051 4.028 -0.544
248 HD23 LEU 31 2HD2 LEU 31 8.997 4.001 -2.033
249 H LYS 32 H LYS 32 4.508 1.578 0.921
250 HA LYS 32 HA LYS 32 4.700 -0.902 2.509
251 HB2 LYS 32 1HB LYS 32 2.583 1.243 2.796
252 HB3 LYS 32 2HB LYS 32 2.663 -0.257 3.702
253 HG2 LYS 32 1HG LYS 32 3.520 1.214 5.220
254 HG3 LYS 32 2HG LYS 32 4.998 0.659 4.435
255 HD2 LYS 32 1HD LYS 32 5.023 2.625 3.020
256 HD3 LYS 32 2HD LYS 32 3.491 3.168 3.707
257 HE2 LYS 32 1HE LYS 32 4.527 3.409 5.887
258 HE3 LYS 32 2HE LYS 32 6.052 2.790 5.252
259 HZ1 LYS 32 3HZ LYS 32 6.036 5.208 5.396
260 HZ2 LYS 32 1HZ LYS 32 4.707 5.279 4.352
261 HZ3 LYS 32 2HZ LYS 32 6.195 4.694 3.792
262 H CYS 33 H CYS 33 3.332 -2.550 1.935
263 HA CYS 33 HA CYS 33 2.176 -2.424 -0.675
264 HB2 CYS 33 1HB CYS 33 1.948 -4.539 1.472
265 HB3 CYS 33 2HB CYS 33 1.470 -4.731 -0.206
266 HG CYS 33 HG CYS 33 4.206 -4.197 -1.061
267 H CYS 34 H CYS 34 0.329 -1.422 -1.044
268 HA CYS 34 HA CYS 34 -1.722 -1.471 1.062
269 HB2 CYS 34 1HB CYS 34 -1.349 0.565 -1.145
270 HB3 CYS 34 2HB CYS 34 -2.560 0.626 0.132
271 HG CYS 34 HG CYS 34 0.802 0.706 0.756
272 H ARG 35 H ARG 35 -3.602 -2.396 0.621
273 HA ARG 35 HA ARG 35 -4.027 -3.329 -2.136
274 HB2 ARG 35 1HB ARG 35 -5.380 -5.109 -1.252
275 HB3 ARG 35 2HB ARG 35 -3.871 -5.080 -0.359
276 HG2 ARG 35 1HG ARG 35 -5.183 -3.669 1.364
277 HG3 ARG 35 2HG ARG 35 -6.613 -4.299 0.544
278 HD2 ARG 35 1HD ARG 35 -5.633 -6.612 0.915
279 HD3 ARG 35 2HD ARG 35 -4.451 -5.846 1.956
280 HE ARG 35 HE ARG 35 -6.933 -5.013 2.858
281 HH11 ARG 35 1HH1 ARG 35 -5.210 -8.043 2.518
282 HH12 ARG 35 2HH1 ARG 35 -5.964 -8.770 3.895
283 HH21 ARG 35 1HH2 ARG 35 -7.905 -5.947 4.673
284 HH22 ARG 35 2HH2 ARG 35 -7.498 -7.574 5.134
285 H THR 36 H THR 36 -5.787 -2.745 -3.245
286 HA THR 36 HA THR 36 -7.455 -0.665 -2.103
287 HB THR 36 HB THR 36 -7.676 -1.777 -4.897
288 HG1 THR 36 HG1 THR 36 -5.902 0.247 -3.916
289 HG21 THR 36 1HG2 THR 36 -8.524 0.446 -5.416
290 HG22 THR 36 2HG2 THR 36 -8.237 0.969 -3.758
291 HG23 THR 36 3HG2 THR 36 -9.455 -0.258 -4.097
292 H ILE 37 H ILE 37 -9.280 -1.078 -1.164
293 HA ILE 37 HA ILE 37 -10.233 -3.688 -0.792
294 HB ILE 37 HB ILE 37 -11.627 -1.072 -0.239
295 HG12 ILE 37 1HG1 ILE 37 -9.480 -1.048 0.816
296 HG13 ILE 37 2HG1 ILE 37 -10.652 -1.442 2.059
297 HG21 ILE 37 1HG2 ILE 37 -12.040 -3.806 0.957
298 HG22 ILE 37 2HG2 ILE 37 -13.143 -2.982 -0.143
299 HG23 ILE 37 3HG2 ILE 37 -12.849 -2.325 1.467
300 HD11 ILE 37 3HD1 ILE 37 -8.828 -3.366 0.650
301 HD12 ILE 37 1HD1 ILE 37 -10.060 -3.819 1.824
302 HD13 ILE 37 2HD1 ILE 37 -8.700 -2.813 2.320
303 H GLN 38 H GLN 38 -10.793 -4.716 -2.579
304 HA GLN 38 HA GLN 38 -12.902 -3.808 -4.324
305 HB2 GLN 38 1HB GLN 38 -11.442 -6.439 -3.974
306 HB3 GLN 38 2HB GLN 38 -12.708 -6.210 -5.163
307 HG2 GLN 38 1HG GLN 38 -11.396 -4.464 -6.239
308 HG3 GLN 38 2HG GLN 38 -10.129 -4.671 -5.033
309 HE21 GLN 38 1HE2 GLN 38 -10.103 -4.979 -7.957
310 HE22 GLN 38 2HE2 GLN 38 -9.514 -6.577 -8.249
311 HA PRO 39 HA PRO 39 -16.662 -5.522 -2.424
312 HB2 PRO 39 1HB PRO 39 -16.129 -8.025 -4.003
313 HB3 PRO 39 2HB PRO 39 -17.673 -7.237 -3.655
314 HG2 PRO 39 1HG PRO 39 -16.485 -6.847 -5.994
315 HG3 PRO 39 2HG PRO 39 -17.276 -5.501 -5.155
316 HD2 PRO 39 1HD PRO 39 -14.403 -6.040 -5.555
317 HD3 PRO 39 2HD PRO 39 -15.226 -4.499 -5.274
318 H SER 40 H SER 40 -17.209 -6.795 -0.654
319 HA SER 40 HA SER 40 -15.092 -7.251 1.074
320 HB2 SER 40 1HB SER 40 -17.372 -6.664 1.796
321 HB3 SER 40 2HB SER 40 -17.924 -8.274 1.336
322 HG SER 40 HG SER 40 -15.747 -8.254 3.027
323 H GLY 41 H GLY 41 -16.497 -9.457 -1.174
324 HA2 GLY 41 1HA GLY 41 -15.525 -11.824 0.149
325 HA3 GLY 41 2HA GLY 41 -16.163 -11.733 -1.487
326 H SER 42 H SER 42 -13.489 -12.403 0.250
327 HA SER 42 HA SER 42 -11.332 -12.842 -0.280
328 HB2 SER 42 1HB SER 42 -12.037 -11.903 -3.070
329 HB3 SER 42 2HB SER 42 -10.577 -12.777 -2.608
330 HG SER 42 HG SER 42 -12.674 -14.141 -1.704
331 H ILE 43 H ILE 43 -9.264 -11.728 -0.899
332 HA ILE 43 HA ILE 43 -7.810 -10.000 -0.749
333 HB ILE 43 HB ILE 43 -10.170 -8.255 -1.460
334 HG12 ILE 43 1HG1 ILE 43 -9.565 -9.888 -3.203
335 HG13 ILE 43 2HG1 ILE 43 -9.209 -8.240 -3.710
336 HG21 ILE 43 1HG2 ILE 43 -8.453 -6.964 -0.313
337 HG22 ILE 43 2HG2 ILE 43 -8.512 -6.539 -2.023
338 HG23 ILE 43 3HG2 ILE 43 -7.229 -7.586 -1.418
339 HD11 ILE 43 3HD1 ILE 43 -7.227 -10.273 -2.717
340 HD12 ILE 43 1HD1 ILE 43 -6.847 -8.605 -3.141
341 HD13 ILE 43 2HD1 ILE 43 -7.432 -9.718 -4.376
342 H ILE 44 H ILE 44 -10.731 -8.389 0.474
343 HA ILE 44 HA ILE 44 -9.282 -7.793 2.951
344 HB ILE 44 HB ILE 44 -10.150 -5.821 1.954
345 HG12 ILE 44 1HG1 ILE 44 -12.009 -6.672 4.184
346 HG13 ILE 44 2HG1 ILE 44 -10.448 -5.881 4.368
347 HG21 ILE 44 1HG2 ILE 44 -11.695 -6.599 0.377
348 HG22 ILE 44 2HG2 ILE 44 -12.631 -5.593 1.484
349 HG23 ILE 44 3HG2 ILE 44 -12.708 -7.350 1.613
350 HD11 ILE 44 3HD1 ILE 44 -12.287 -4.328 4.705
351 HD12 ILE 44 1HD1 ILE 44 -12.888 -4.677 3.085
352 HD13 ILE 44 2HD1 ILE 44 -11.330 -3.876 3.293
353 H ASP 45 H ASP 45 -10.200 -8.254 4.980
354 HA ASP 45 HA ASP 45 -11.302 -9.467 6.538
355 HB2 ASP 45 1HB ASP 45 -13.386 -8.566 5.606
356 HB3 ASP 45 2HB ASP 45 -13.413 -9.849 4.400
Start of MODEL 7
1 H PHE 1 1H PHE 1 7.327 -13.336 0.952
2 HA PHE 1 HA PHE 1 5.537 -14.875 1.276
3 HB2 PHE 1 1HB PHE 1 6.173 -15.768 3.443
4 HB3 PHE 1 2HB PHE 1 5.915 -14.202 4.200
5 HD1 PHE 1 HD2 PHE 1 4.011 -16.601 2.064
6 HD2 PHE 1 HD1 PHE 1 3.982 -13.952 5.393
7 HE1 PHE 1 HE2 PHE 1 1.671 -17.209 2.520
8 HE2 PHE 1 HE1 PHE 1 1.642 -14.555 5.856
9 HZ PHE 1 HZ PHE 1 0.485 -16.184 4.421
10 H PHE 2 H PHE 2 6.049 -11.860 3.087
11 HA PHE 2 HA PHE 2 3.410 -10.992 3.135
12 HB2 PHE 2 1HB PHE 2 5.960 -9.380 3.072
13 HB3 PHE 2 2HB PHE 2 4.372 -8.690 3.383
14 HD1 PHE 2 HD1 PHE 2 3.026 -9.918 5.305
15 HD2 PHE 2 HD2 PHE 2 7.258 -9.961 4.870
16 HE1 PHE 2 HE1 PHE 2 3.261 -10.438 7.698
17 HE2 PHE 2 HE2 PHE 2 7.503 -10.486 7.260
18 HZ PHE 2 HZ PHE 2 5.501 -10.726 8.678
19 H ASP 3 H ASP 3 5.861 -10.531 0.591
20 HA ASP 3 HA ASP 3 3.851 -9.063 -0.915
21 HB2 ASP 3 1HB ASP 3 5.559 -8.424 -2.471
22 HB3 ASP 3 2HB ASP 3 6.099 -8.092 -0.836
23 H GLU 4 H GLU 4 4.537 -12.208 -0.530
24 HA GLU 4 HA GLU 4 3.904 -13.065 -3.202
25 HB2 GLU 4 1HB GLU 4 3.448 -14.474 -0.551
26 HB3 GLU 4 2HB GLU 4 3.211 -15.204 -2.131
27 HG2 GLU 4 1HG GLU 4 5.789 -14.317 -0.882
28 HG3 GLU 4 2HG GLU 4 5.295 -15.955 -1.300
29 H LYS 5 H LYS 5 2.219 -12.328 -0.228
30 HA LYS 5 HA LYS 5 -0.418 -12.545 -1.149
31 HB2 LYS 5 1HB LYS 5 0.268 -12.306 1.236
32 HB3 LYS 5 2HB LYS 5 0.695 -10.635 0.912
33 HG2 LYS 5 1HG LYS 5 -1.451 -10.702 1.968
34 HG3 LYS 5 2HG LYS 5 -1.661 -10.199 0.289
35 HD2 LYS 5 1HD LYS 5 -2.312 -12.472 -0.318
36 HD3 LYS 5 2HD LYS 5 -2.082 -12.991 1.352
37 HE2 LYS 5 1HE LYS 5 -3.830 -11.415 2.064
38 HE3 LYS 5 2HE LYS 5 -4.077 -10.950 0.381
39 HZ1 LYS 5 3HZ LYS 5 -4.695 -13.246 -0.106
40 HZ2 LYS 5 1HZ LYS 5 -5.713 -12.566 1.061
41 HZ3 LYS 5 2HZ LYS 5 -4.506 -13.656 1.522
42 H CYS 6 H CYS 6 1.881 -9.841 -1.108
43 HA CYS 6 HA CYS 6 0.267 -7.827 -2.121
44 HB2 CYS 6 1HB CYS 6 2.585 -7.510 -1.268
45 HB3 CYS 6 2HB CYS 6 3.205 -8.292 -2.718
46 HG CYS 6 HG CYS 6 2.478 -6.307 -4.463
47 H ASN 7 H ASN 7 2.084 -10.321 -3.830
48 HA ASN 7 HA ASN 7 1.667 -9.387 -6.449
49 HB2 ASN 7 1HB ASN 7 3.378 -11.046 -5.826
50 HB3 ASN 7 2HB ASN 7 2.116 -12.216 -5.485
51 HD21 ASN 7 1HD2 ASN 7 2.958 -13.637 -6.997
52 HD22 ASN 7 2HD2 ASN 7 2.775 -13.385 -8.699
53 H LYS 8 H LYS 8 0.017 -12.000 -4.684
54 HA LYS 8 HA LYS 8 -1.832 -12.521 -6.744
55 HB2 LYS 8 1HB LYS 8 -1.912 -13.214 -3.809
56 HB3 LYS 8 2HB LYS 8 -2.922 -13.921 -5.049
57 HG2 LYS 8 1HG LYS 8 0.066 -14.142 -4.861
58 HG3 LYS 8 2HG LYS 8 -1.107 -15.413 -4.514
59 HD2 LYS 8 1HD LYS 8 -1.854 -15.358 -6.844
60 HD3 LYS 8 2HD LYS 8 -0.684 -14.084 -7.190
61 HE2 LYS 8 1HE LYS 8 1.132 -15.616 -6.557
62 HE3 LYS 8 2HE LYS 8 -0.055 -16.890 -6.285
63 HZ1 LYS 8 3HZ LYS 8 0.393 -15.516 -8.879
64 HZ2 LYS 8 1HZ LYS 8 -0.662 -16.809 -8.597
65 HZ3 LYS 8 2HZ LYS 8 1.009 -17.036 -8.469
66 H LEU 9 H LEU 9 -1.938 -10.472 -3.892
67 HA LEU 9 HA LEU 9 -4.752 -9.933 -4.146
68 HB2 LEU 9 1HB LEU 9 -3.735 -10.104 -1.988
69 HB3 LEU 9 2HB LEU 9 -2.542 -8.895 -2.398
70 HG LEU 9 HG LEU 9 -4.403 -7.218 -2.501
71 HD11 LEU 9 1HD1 LEU 9 -6.494 -7.784 -1.380
72 HD12 LEU 9 2HD1 LEU 9 -5.964 -9.458 -1.218
73 HD13 LEU 9 3HD1 LEU 9 -6.262 -8.779 -2.817
74 HD21 LEU 9 3HD2 LEU 9 -2.839 -7.576 -0.625
75 HD22 LEU 9 1HD2 LEU 9 -4.021 -8.652 0.112
76 HD23 LEU 9 2HD2 LEU 9 -4.410 -6.946 -0.120
77 H LYS 10 H LYS 10 -1.984 -8.796 -5.653
78 HA LYS 10 HA LYS 10 -1.610 -7.164 -7.181
79 HB2 LYS 10 1HB LYS 10 -4.552 -6.569 -6.869
80 HB3 LYS 10 2HB LYS 10 -3.505 -5.868 -8.095
81 HG2 LYS 10 1HG LYS 10 -3.025 -8.233 -8.847
82 HG3 LYS 10 2HG LYS 10 -4.361 -8.728 -7.804
83 HD2 LYS 10 1HD LYS 10 -5.849 -7.196 -9.025
84 HD3 LYS 10 2HD LYS 10 -4.503 -6.771 -10.084
85 HE2 LYS 10 1HE LYS 10 -5.705 -9.519 -9.765
86 HE3 LYS 10 2HE LYS 10 -5.972 -8.430 -11.122
87 HZ1 LYS 10 3HZ LYS 10 -3.363 -9.614 -10.340
88 HZ2 LYS 10 1HZ LYS 10 -3.615 -8.565 -11.642
89 HZ3 LYS 10 2HZ LYS 10 -4.318 -10.102 -11.644
90 H GLY 11 H GLY 11 -1.224 -6.740 -4.386
91 HA2 GLY 11 1HA GLY 11 -1.976 -4.052 -3.731
92 HA3 GLY 11 2HA GLY 11 -0.815 -5.052 -2.866
93 H THR 12 H THR 12 -0.483 -2.287 -3.438
94 HA THR 12 HA THR 12 1.842 -2.443 -5.242
95 HB THR 12 HB THR 12 0.244 0.072 -4.901
96 HG1 THR 12 HG1 THR 12 -0.653 -2.156 -6.029
97 HG21 THR 12 1HG2 THR 12 2.035 -0.931 -7.115
98 HG22 THR 12 2HG2 THR 12 2.480 0.256 -5.887
99 HG23 THR 12 3HG2 THR 12 1.228 0.637 -7.071
100 H CYS 13 H CYS 13 3.673 -1.384 -4.582
101 HA CYS 13 HA CYS 13 3.797 -0.747 -1.760
102 HB2 CYS 13 1HB CYS 13 6.122 -0.431 -3.634
103 HB3 CYS 13 2HB CYS 13 6.116 -0.899 -1.942
104 HG CYS 13 HG CYS 13 5.799 -3.470 -2.247
105 H LYS 14 H LYS 14 2.992 1.175 -1.269
106 HA LYS 14 HA LYS 14 4.032 3.527 -2.687
107 HB2 LYS 14 1HB LYS 14 1.777 4.580 -2.458
108 HB3 LYS 14 2HB LYS 14 1.806 3.209 -3.560
109 HG2 LYS 14 1HG LYS 14 0.890 1.781 -1.792
110 HG3 LYS 14 2HG LYS 14 0.835 3.172 -0.710
111 HD2 LYS 14 1HD LYS 14 -1.360 2.785 -1.630
112 HD3 LYS 14 2HD LYS 14 -0.709 4.288 -2.285
113 HE2 LYS 14 1HE LYS 14 -0.237 1.797 -3.825
114 HE3 LYS 14 2HE LYS 14 -1.875 2.442 -3.810
115 HZ1 LYS 14 3HZ LYS 14 -1.078 4.505 -4.684
116 HZ2 LYS 14 1HZ LYS 14 -0.506 3.260 -5.671
117 HZ3 LYS 14 2HZ LYS 14 0.530 4.008 -4.566
118 H ASN 15 H ASN 15 3.706 5.544 -1.337
119 HA ASN 15 HA ASN 15 4.496 4.941 1.369
120 HB2 ASN 15 1HB ASN 15 4.314 7.475 -0.240
121 HB3 ASN 15 2HB ASN 15 4.625 7.508 1.485
122 HD21 ASN 15 1HD2 ASN 15 6.584 6.716 2.273
123 HD22 ASN 15 2HD2 ASN 15 7.942 6.440 1.236
124 H ASN 16 H ASN 16 1.826 6.569 -0.274
125 HA ASN 16 HA ASN 16 0.322 6.561 2.269
126 HB2 ASN 16 1HB ASN 16 -0.067 8.430 -0.080
127 HB3 ASN 16 2HB ASN 16 -0.861 8.526 1.488
128 HD21 ASN 16 1HD2 ASN 16 2.140 8.919 -0.231
129 HD22 ASN 16 2HD2 ASN 16 2.911 9.933 0.945
130 H CYS 17 H CYS 17 -1.636 5.554 2.264
131 HA CYS 17 HA CYS 17 -2.318 3.889 0.053
132 HB2 CYS 17 1HB CYS 17 -4.063 4.547 2.429
133 HB3 CYS 17 2HB CYS 17 -4.145 3.122 1.406
134 HG CYS 17 HG CYS 17 -1.368 2.493 2.286
135 H GLY 18 H GLY 18 -3.948 4.075 -1.423
136 HA2 GLY 18 1HA GLY 18 -4.995 6.777 -1.810
137 HA3 GLY 18 2HA GLY 18 -5.000 5.475 -2.992
138 H LYS 19 H LYS 19 -7.211 6.024 -3.389
139 HA LYS 19 HA LYS 19 -9.252 6.031 -1.521
140 HB2 LYS 19 1HB LYS 19 -10.737 5.404 -3.471
141 HB3 LYS 19 2HB LYS 19 -9.740 6.832 -3.692
142 HG2 LYS 19 1HG LYS 19 -9.406 5.834 -5.701
143 HG3 LYS 19 2HG LYS 19 -8.098 5.075 -4.798
144 HD2 LYS 19 1HD LYS 19 -9.608 3.147 -4.351
145 HD3 LYS 19 2HD LYS 19 -10.811 3.903 -5.400
146 HE2 LYS 19 1HE LYS 19 -8.034 3.046 -6.208
147 HE3 LYS 19 2HE LYS 19 -9.530 2.200 -6.596
148 HZ1 LYS 19 3HZ LYS 19 -8.809 4.939 -7.493
149 HZ2 LYS 19 1HZ LYS 19 -10.249 4.132 -7.860
150 HZ3 LYS 19 2HZ LYS 19 -8.778 3.546 -8.448
151 H ASN 20 H ASN 20 -10.100 4.569 -0.264
152 HA ASN 20 HA ASN 20 -10.707 2.596 0.679
153 HB2 ASN 20 1HB ASN 20 -10.903 1.806 -2.232
154 HB3 ASN 20 2HB ASN 20 -11.477 0.802 -0.907
155 HD21 ASN 20 1HD2 ASN 20 -13.334 1.368 0.181
156 HD22 ASN 20 2HD2 ASN 20 -14.413 2.592 -0.395
157 H GLU 21 H GLU 21 -7.927 2.988 0.599
158 HA GLU 21 HA GLU 21 -7.030 0.202 0.266
159 HB2 GLU 21 1HB GLU 21 -5.502 2.758 -0.230
160 HB3 GLU 21 2HB GLU 21 -4.715 1.194 -0.075
161 HG2 GLU 21 1HG GLU 21 -6.146 0.394 -1.966
162 HG3 GLU 21 2HG GLU 21 -6.685 2.058 -2.175
163 H GLU 22 H GLU 22 -5.207 -0.418 1.656
164 HA GLU 22 HA GLU 22 -4.792 1.211 4.029
165 HB2 GLU 22 1HB GLU 22 -5.482 -0.397 5.620
166 HB3 GLU 22 2HB GLU 22 -6.796 -0.290 4.459
167 HG2 GLU 22 1HG GLU 22 -5.975 -2.325 3.365
168 HG3 GLU 22 2HG GLU 22 -4.693 -2.437 4.569
169 H LEU 23 H LEU 23 -3.061 0.374 5.388
170 HA LEU 23 HA LEU 23 -0.867 -0.636 3.840
171 HB2 LEU 23 1HB LEU 23 -1.009 1.022 5.928
172 HB3 LEU 23 2HB LEU 23 -0.797 -0.461 6.814
173 HG LEU 23 HG LEU 23 1.131 0.551 4.728
174 HD11 LEU 23 1HD1 LEU 23 2.543 1.138 6.662
175 HD12 LEU 23 2HD1 LEU 23 1.198 0.758 7.736
176 HD13 LEU 23 3HD1 LEU 23 1.062 2.093 6.591
177 HD21 LEU 23 3HD2 LEU 23 2.624 -1.102 5.707
178 HD22 LEU 23 1HD2 LEU 23 1.163 -1.858 5.072
179 HD23 LEU 23 2HD2 LEU 23 1.342 -1.610 6.806
180 H ILE 24 H ILE 24 -0.407 -2.727 3.560
181 HA ILE 24 HA ILE 24 -1.660 -4.691 5.363
182 HB ILE 24 HB ILE 24 -2.171 -6.035 3.613
183 HG12 ILE 24 1HG1 ILE 24 -0.051 -5.052 1.754
184 HG13 ILE 24 2HG1 ILE 24 0.443 -6.065 3.107
185 HG21 ILE 24 1HG2 ILE 24 -2.666 -4.764 1.570
186 HG22 ILE 24 2HG2 ILE 24 -1.719 -3.417 2.198
187 HG23 ILE 24 3HG2 ILE 24 -3.186 -3.931 3.034
188 HD11 ILE 24 3HD1 ILE 24 -1.153 -7.762 2.377
189 HD12 ILE 24 1HD1 ILE 24 0.089 -7.413 1.174
190 HD13 ILE 24 2HD1 ILE 24 -1.541 -6.762 0.977
191 H ALA 25 H ALA 25 1.315 -3.731 3.782
192 HA ALA 25 HA ALA 25 2.890 -5.332 5.604
193 HB1 ALA 25 3HB ALA 25 2.989 -5.903 2.636
194 HB2 ALA 25 1HB ALA 25 2.307 -6.973 3.860
195 HB3 ALA 25 2HB ALA 25 4.033 -6.608 3.870
196 H LEU 26 H LEU 26 5.199 -4.963 5.272
197 HA LEU 26 HA LEU 26 5.631 -2.225 4.330
198 HB2 LEU 26 1HB LEU 26 7.009 -3.967 6.339
199 HB3 LEU 26 2HB LEU 26 7.764 -2.498 5.737
200 HG LEU 26 HG LEU 26 5.146 -2.676 7.240
201 HD11 LEU 26 1HD1 LEU 26 6.348 -1.521 9.018
202 HD12 LEU 26 2HD1 LEU 26 7.831 -1.580 8.064
203 HD13 LEU 26 3HD1 LEU 26 7.096 -3.074 8.645
204 HD21 LEU 26 3HD2 LEU 26 5.029 -0.853 5.666
205 HD22 LEU 26 1HD2 LEU 26 6.631 -0.290 6.143
206 HD23 LEU 26 2HD2 LEU 26 5.289 -0.197 7.280
207 H CYS 27 H CYS 27 7.167 -1.739 2.846
208 HA CYS 27 HA CYS 27 8.355 -4.049 1.452
209 HB2 CYS 27 1HB CYS 27 7.411 -1.412 0.306
210 HB3 CYS 27 2HB CYS 27 8.108 -2.734 -0.617
211 HG CYS 27 HG CYS 27 6.005 -4.493 -0.168
212 H GLN 28 H GLN 28 10.261 -3.308 0.011
213 HA GLN 28 HA GLN 28 12.226 -2.076 1.649
214 HB2 GLN 28 1HB GLN 28 12.290 -2.714 -1.295
215 HB3 GLN 28 2HB GLN 28 13.667 -2.148 -0.378
216 HG2 GLN 28 1HG GLN 28 13.881 -4.496 -0.621
217 HG3 GLN 28 2HG GLN 28 13.467 -4.168 1.059
218 HE21 GLN 28 1HE2 GLN 28 12.698 -6.255 1.362
219 HE22 GLN 28 2HE2 GLN 28 11.196 -6.789 0.692
220 H LYS 29 H LYS 29 13.614 -0.255 0.600
221 HA LYS 29 HA LYS 29 13.773 2.000 0.273
222 HB2 LYS 29 1HB LYS 29 11.307 1.548 -1.397
223 HB3 LYS 29 2HB LYS 29 12.266 3.018 -1.404
224 HG2 LYS 29 1HG LYS 29 14.154 1.827 -2.311
225 HG3 LYS 29 2HG LYS 29 13.281 0.298 -2.198
226 HD2 LYS 29 1HD LYS 29 12.453 2.658 -3.887
227 HD3 LYS 29 2HD LYS 29 13.285 1.223 -4.484
228 HE2 LYS 29 1HE LYS 29 11.393 -0.161 -3.735
229 HE3 LYS 29 2HE LYS 29 10.559 1.293 -3.192
230 HZ1 LYS 29 3HZ LYS 29 11.334 0.665 -5.987
231 HZ2 LYS 29 1HZ LYS 29 10.585 2.096 -5.483
232 HZ3 LYS 29 2HZ LYS 29 9.768 0.622 -5.350
233 H SER 30 H SER 30 11.898 0.727 2.282
234 HA SER 30 HA SER 30 10.403 1.184 3.877
235 HB2 SER 30 1HB SER 30 10.337 3.434 4.843
236 HB3 SER 30 2HB SER 30 11.990 2.918 4.531
237 HG SER 30 HG SER 30 11.440 4.134 2.386
238 H LEU 31 H LEU 31 9.496 1.139 1.061
239 HA LEU 31 HA LEU 31 7.112 2.751 1.061
240 HB2 LEU 31 1HB LEU 31 8.203 0.532 -0.644
241 HB3 LEU 31 2HB LEU 31 6.524 0.992 -0.792
242 HG LEU 31 HG LEU 31 8.221 2.006 -2.424
243 HD11 LEU 31 1HD1 LEU 31 6.345 3.796 -0.886
244 HD12 LEU 31 2HD1 LEU 31 5.920 2.760 -2.250
245 HD13 LEU 31 3HD1 LEU 31 7.002 4.132 -2.489
246 HD21 LEU 31 3HD2 LEU 31 8.716 3.846 -0.100
247 HD22 LEU 31 1HD2 LEU 31 9.346 4.016 -1.739
248 HD23 LEU 31 2HD2 LEU 31 9.875 2.675 -0.724
249 H LYS 32 H LYS 32 4.923 1.626 0.915
250 HA LYS 32 HA LYS 32 4.846 -0.749 2.655
251 HB2 LYS 32 1HB LYS 32 2.833 1.503 2.760
252 HB3 LYS 32 2HB LYS 32 2.885 0.086 3.790
253 HG2 LYS 32 1HG LYS 32 3.768 1.665 5.183
254 HG3 LYS 32 2HG LYS 32 5.236 1.017 4.454
255 HD2 LYS 32 1HD LYS 32 5.314 2.853 2.875
256 HD3 LYS 32 2HD LYS 32 3.788 3.486 3.492
257 HE2 LYS 32 1HE LYS 32 6.317 3.200 5.107
258 HE3 LYS 32 2HE LYS 32 5.781 4.693 4.341
259 HZ1 LYS 32 3HZ LYS 32 4.419 3.209 6.520
260 HZ2 LYS 32 1HZ LYS 32 3.720 4.510 5.690
261 HZ3 LYS 32 2HZ LYS 32 5.121 4.744 6.604
262 H CYS 33 H CYS 33 3.402 -2.317 2.088
263 HA CYS 33 HA CYS 33 2.303 -2.144 -0.570
264 HB2 CYS 33 1HB CYS 33 3.307 -4.247 0.255
265 HB3 CYS 33 2HB CYS 33 2.073 -4.337 1.505
266 HG CYS 33 HG CYS 33 1.842 -5.027 -1.788
267 H CYS 34 H CYS 34 0.430 -1.169 -0.926
268 HA CYS 34 HA CYS 34 -1.607 -1.280 1.190
269 HB2 CYS 34 1HB CYS 34 -1.290 0.724 -1.053
270 HB3 CYS 34 2HB CYS 34 -2.570 0.741 0.156
271 HG CYS 34 HG CYS 34 0.748 1.021 0.948
272 H ARG 35 H ARG 35 -3.574 -2.095 0.775
273 HA ARG 35 HA ARG 35 -3.942 -3.296 -1.890
274 HB2 ARG 35 1HB ARG 35 -5.263 -5.020 -0.848
275 HB3 ARG 35 2HB ARG 35 -3.738 -4.894 0.010
276 HG2 ARG 35 1HG ARG 35 -4.990 -3.407 1.667
277 HG3 ARG 35 2HG ARG 35 -6.460 -3.994 0.892
278 HD2 ARG 35 1HD ARG 35 -5.632 -6.333 1.370
279 HD3 ARG 35 2HD ARG 35 -4.370 -5.601 2.346
280 HE ARG 35 HE ARG 35 -6.732 -4.533 3.275
281 HH11 ARG 35 1HH1 ARG 35 -5.322 -7.729 3.016
282 HH12 ARG 35 2HH1 ARG 35 -6.175 -8.355 4.391
283 HH21 ARG 35 1HH2 ARG 35 -7.846 -5.330 5.059
284 HH22 ARG 35 2HH2 ARG 35 -7.653 -7.001 5.539
285 H THR 36 H THR 36 -5.741 -2.903 -3.029
286 HA THR 36 HA THR 36 -7.539 -0.831 -2.138
287 HB THR 36 HB THR 36 -7.836 -2.452 -4.662
288 HG1 THR 36 HG1 THR 36 -5.956 -0.422 -4.025
289 HG21 THR 36 1HG2 THR 36 -9.660 -0.917 -4.086
290 HG22 THR 36 2HG2 THR 36 -8.800 -0.366 -5.523
291 HG23 THR 36 3HG2 THR 36 -8.510 0.415 -3.969
292 H ILE 37 H ILE 37 -9.185 -1.258 -0.891
293 HA ILE 37 HA ILE 37 -10.004 -3.854 -0.205
294 HB ILE 37 HB ILE 37 -11.309 -1.188 0.312
295 HG12 ILE 37 1HG1 ILE 37 -9.117 -1.116 1.183
296 HG13 ILE 37 2HG1 ILE 37 -10.141 -1.512 2.549
297 HG21 ILE 37 1HG2 ILE 37 -12.868 -3.041 0.676
298 HG22 ILE 37 2HG2 ILE 37 -12.427 -2.245 2.185
299 HG23 ILE 37 3HG2 ILE 37 -11.706 -3.793 1.765
300 HD11 ILE 37 3HD1 ILE 37 -9.527 -3.876 2.300
301 HD12 ILE 37 1HD1 ILE 37 -8.138 -2.835 2.612
302 HD13 ILE 37 2HD1 ILE 37 -8.447 -3.428 0.981
303 H GLN 38 H GLN 38 -10.934 -5.115 -1.680
304 HA GLN 38 HA GLN 38 -13.291 -4.106 -3.111
305 HB2 GLN 38 1HB GLN 38 -11.607 -6.574 -3.571
306 HB3 GLN 38 2HB GLN 38 -13.055 -6.175 -4.484
307 HG2 GLN 38 1HG GLN 38 -11.985 -4.125 -5.278
308 HG3 GLN 38 2HG GLN 38 -10.530 -4.539 -4.373
309 HE21 GLN 38 1HE2 GLN 38 -9.277 -4.594 -6.237
310 HE22 GLN 38 2HE2 GLN 38 -9.395 -5.876 -7.389
311 HA PRO 39 HA PRO 39 -15.803 -6.285 -0.163
312 HB2 PRO 39 1HB PRO 39 -17.893 -6.278 -2.234
313 HB3 PRO 39 2HB PRO 39 -17.892 -5.522 -0.640
314 HG2 PRO 39 1HG PRO 39 -17.711 -4.076 -2.893
315 HG3 PRO 39 2HG PRO 39 -16.875 -3.603 -1.403
316 HD2 PRO 39 1HD PRO 39 -15.781 -4.940 -3.848
317 HD3 PRO 39 2HD PRO 39 -15.066 -3.663 -2.843
318 H SER 40 H SER 40 -15.642 -8.374 0.243
319 HA SER 40 HA SER 40 -16.381 -10.315 -1.834
320 HB2 SER 40 1HB SER 40 -13.994 -10.604 0.015
321 HB3 SER 40 2HB SER 40 -14.486 -11.725 -1.257
322 HG SER 40 HG SER 40 -14.268 -9.350 -2.375
323 H GLY 41 H GLY 41 -15.604 -12.493 0.112
324 HA2 GLY 41 1HA GLY 41 -17.930 -12.732 1.659
325 HA3 GLY 41 2HA GLY 41 -16.417 -13.577 1.976
326 H SER 42 H SER 42 -18.575 -11.716 3.479
327 HA SER 42 HA SER 42 -18.607 -10.142 5.122
328 HB2 SER 42 1HB SER 42 -15.696 -10.901 5.506
329 HB3 SER 42 2HB SER 42 -16.736 -10.102 6.681
330 HG SER 42 HG SER 42 -16.533 -12.758 6.021
331 H ILE 43 H ILE 43 -16.186 -8.508 5.831
332 HA ILE 43 HA ILE 43 -16.244 -6.668 3.629
333 HB ILE 43 HB ILE 43 -14.249 -5.663 5.080
334 HG12 ILE 43 1HG1 ILE 43 -15.904 -7.062 7.184
335 HG13 ILE 43 2HG1 ILE 43 -14.380 -7.722 6.610
336 HG21 ILE 43 1HG2 ILE 43 -16.323 -4.525 4.579
337 HG22 ILE 43 2HG2 ILE 43 -15.940 -4.343 6.291
338 HG23 ILE 43 3HG2 ILE 43 -17.177 -5.492 5.782
339 HD11 ILE 43 3HD1 ILE 43 -13.225 -5.714 7.371
340 HD12 ILE 43 1HD1 ILE 43 -14.110 -6.481 8.689
341 HD13 ILE 43 2HD1 ILE 43 -14.758 -5.034 7.915
342 H ILE 44 H ILE 44 -13.316 -7.780 5.281
343 HA ILE 44 HA ILE 44 -12.139 -8.655 2.774
344 HB ILE 44 HB ILE 44 -10.122 -7.194 3.310
345 HG12 ILE 44 1HG1 ILE 44 -12.221 -5.773 4.954
346 HG13 ILE 44 2HG1 ILE 44 -10.737 -6.503 5.550
347 HG21 ILE 44 1HG2 ILE 44 -12.579 -5.692 2.467
348 HG22 ILE 44 2HG2 ILE 44 -11.766 -6.876 1.441
349 HG23 ILE 44 3HG2 ILE 44 -10.909 -5.425 1.956
350 HD11 ILE 44 3HD1 ILE 44 -9.445 -4.841 4.272
351 HD12 ILE 44 1HD1 ILE 44 -10.507 -4.114 5.475
352 HD13 ILE 44 2HD1 ILE 44 -10.957 -4.081 3.770
353 H ASP 45 H ASP 45 -9.601 -8.931 3.413
354 HA ASP 45 HA ASP 45 -9.456 -11.072 5.240
355 HB2 ASP 45 1HB ASP 45 -7.872 -11.125 3.521
356 HB3 ASP 45 2HB ASP 45 -7.434 -9.435 3.741
Start of MODEL 8
1 H PHE 1 1H PHE 1 11.812 -10.068 -2.580
2 HA PHE 1 HA PHE 1 9.915 -11.805 -4.031
3 HB2 PHE 1 1HB PHE 1 11.385 -12.142 -1.411
4 HB3 PHE 1 2HB PHE 1 10.108 -13.213 -1.975
5 HD1 PHE 1 HD1 PHE 1 10.465 -14.627 -3.957
6 HD2 PHE 1 HD2 PHE 1 13.596 -12.283 -2.282
7 HE1 PHE 1 HE1 PHE 1 12.118 -15.967 -5.187
8 HE2 PHE 1 HE2 PHE 1 15.256 -13.619 -3.513
9 HZ PHE 1 HZ PHE 1 14.519 -15.462 -4.966
10 H PHE 2 H PHE 2 10.337 -9.243 -1.745
11 HA PHE 2 HA PHE 2 8.090 -9.606 -0.126
12 HB2 PHE 2 1HB PHE 2 9.549 -7.110 -0.969
13 HB3 PHE 2 2HB PHE 2 8.185 -7.068 0.139
14 HD1 PHE 2 HD1 PHE 2 8.382 -8.696 2.191
15 HD2 PHE 2 HD2 PHE 2 11.673 -7.282 -0.104
16 HE1 PHE 2 HE1 PHE 2 9.888 -9.143 4.084
17 HE2 PHE 2 HE2 PHE 2 13.187 -7.730 1.783
18 HZ PHE 2 HZ PHE 2 12.295 -8.662 3.879
19 H ASP 3 H ASP 3 8.370 -7.558 -3.060
20 HA ASP 3 HA ASP 3 5.498 -7.221 -2.972
21 HB2 ASP 3 1HB ASP 3 5.710 -5.549 -4.661
22 HB3 ASP 3 2HB ASP 3 6.919 -5.255 -3.420
23 H GLU 4 H GLU 4 7.501 -9.456 -4.251
24 HA GLU 4 HA GLU 4 6.031 -10.152 -6.581
25 HB2 GLU 4 1HB GLU 4 8.203 -11.185 -6.108
26 HB3 GLU 4 2HB GLU 4 7.575 -11.884 -4.624
27 HG2 GLU 4 1HG GLU 4 7.733 -13.548 -6.376
28 HG3 GLU 4 2HG GLU 4 6.053 -13.281 -5.914
29 H LYS 5 H LYS 5 5.852 -11.052 -3.170
30 HA LYS 5 HA LYS 5 3.402 -12.439 -3.339
31 HB2 LYS 5 1HB LYS 5 4.912 -12.658 -1.418
32 HB3 LYS 5 2HB LYS 5 4.638 -10.978 -1.003
33 HG2 LYS 5 1HG LYS 5 3.365 -12.485 0.431
34 HG3 LYS 5 2HG LYS 5 2.310 -11.442 -0.518
35 HD2 LYS 5 1HD LYS 5 1.311 -13.561 -0.625
36 HD3 LYS 5 2HD LYS 5 2.144 -13.383 -2.166
37 HE2 LYS 5 1HE LYS 5 3.283 -14.841 0.213
38 HE3 LYS 5 2HE LYS 5 2.385 -15.628 -1.078
39 HZ1 LYS 5 3HZ LYS 5 4.633 -15.900 -1.603
40 HZ2 LYS 5 1HZ LYS 5 5.026 -14.298 -1.240
41 HZ3 LYS 5 2HZ LYS 5 4.117 -14.654 -2.616
42 H CYS 6 H CYS 6 4.239 -9.042 -2.860
43 HA CYS 6 HA CYS 6 1.725 -8.046 -2.157
44 HB2 CYS 6 1HB CYS 6 3.883 -6.757 -2.125
45 HB3 CYS 6 2HB CYS 6 3.804 -6.669 -3.879
46 HG CYS 6 HG CYS 6 1.801 -4.917 -4.067
47 H ASN 7 H ASN 7 3.207 -8.434 -5.356
48 HA ASN 7 HA ASN 7 1.138 -7.411 -6.919
49 HB2 ASN 7 1HB ASN 7 3.443 -7.970 -7.716
50 HB3 ASN 7 2HB ASN 7 3.010 -9.671 -7.648
51 HD21 ASN 7 1HD2 ASN 7 2.497 -6.656 -9.305
52 HD22 ASN 7 2HD2 ASN 7 1.729 -7.328 -10.698
53 H LYS 8 H LYS 8 1.800 -10.764 -5.983
54 HA LYS 8 HA LYS 8 -0.432 -11.849 -7.331
55 HB2 LYS 8 1HB LYS 8 1.300 -12.965 -5.126
56 HB3 LYS 8 2HB LYS 8 0.183 -13.892 -6.103
57 HG2 LYS 8 1HG LYS 8 2.508 -12.360 -7.223
58 HG3 LYS 8 2HG LYS 8 2.554 -14.075 -6.814
59 HD2 LYS 8 1HD LYS 8 0.926 -14.598 -8.463
60 HD3 LYS 8 2HD LYS 8 0.551 -12.895 -8.726
61 HE2 LYS 8 1HE LYS 8 1.960 -13.931 -10.503
62 HE3 LYS 8 2HE LYS 8 2.669 -12.508 -9.745
63 HZ1 LYS 8 3HZ LYS 8 4.158 -14.508 -10.111
64 HZ2 LYS 8 1HZ LYS 8 3.331 -15.238 -8.831
65 HZ3 LYS 8 2HZ LYS 8 4.197 -13.799 -8.574
66 H LEU 9 H LEU 9 -0.002 -10.460 -4.171
67 HA LEU 9 HA LEU 9 -2.479 -11.532 -3.147
68 HB2 LEU 9 1HB LEU 9 -0.378 -11.112 -1.841
69 HB3 LEU 9 2HB LEU 9 -0.676 -9.400 -2.039
70 HG LEU 9 HG LEU 9 -2.754 -9.611 -0.754
71 HD11 LEU 9 1HD1 LEU 9 -3.198 -11.701 0.463
72 HD12 LEU 9 2HD1 LEU 9 -1.891 -12.487 -0.422
73 HD13 LEU 9 3HD1 LEU 9 -3.324 -11.922 -1.281
74 HD21 LEU 9 3HD2 LEU 9 -1.645 -9.975 1.382
75 HD22 LEU 9 1HD2 LEU 9 -0.620 -9.057 0.275
76 HD23 LEU 9 2HD2 LEU 9 -0.306 -10.768 0.547
77 H LYS 10 H LYS 10 -1.599 -9.075 -5.199
78 HA LYS 10 HA LYS 10 -2.728 -7.416 -6.222
79 HB2 LYS 10 1HB LYS 10 -5.018 -8.641 -4.719
80 HB3 LYS 10 2HB LYS 10 -5.236 -7.142 -5.607
81 HG2 LYS 10 1HG LYS 10 -5.926 -8.863 -7.056
82 HG3 LYS 10 2HG LYS 10 -4.343 -8.344 -7.631
83 HD2 LYS 10 1HD LYS 10 -4.412 -10.732 -7.707
84 HD3 LYS 10 2HD LYS 10 -3.337 -10.257 -6.392
85 HE2 LYS 10 1HE LYS 10 -4.724 -12.077 -5.657
86 HE3 LYS 10 2HE LYS 10 -5.197 -10.613 -4.798
87 HZ1 LYS 10 3HZ LYS 10 -6.600 -11.782 -7.141
88 HZ2 LYS 10 1HZ LYS 10 -7.054 -10.366 -6.336
89 HZ3 LYS 10 2HZ LYS 10 -7.124 -11.851 -5.535
90 H GLY 11 H GLY 11 -1.176 -6.876 -4.015
91 HA2 GLY 11 1HA GLY 11 -2.573 -4.512 -2.925
92 HA3 GLY 11 2HA GLY 11 -1.247 -5.335 -2.110
93 H THR 12 H THR 12 -1.006 -2.659 -2.495
94 HA THR 12 HA THR 12 1.032 -2.553 -4.604
95 HB THR 12 HB THR 12 0.344 -0.032 -4.689
96 HG1 THR 12 HG1 THR 12 -1.650 -1.139 -3.191
97 HG21 THR 12 1HG2 THR 12 -1.187 -0.528 -6.539
98 HG22 THR 12 2HG2 THR 12 -1.301 -2.198 -5.987
99 HG23 THR 12 3HG2 THR 12 0.237 -1.567 -6.574
100 H CYS 13 H CYS 13 2.981 -1.858 -3.954
101 HA CYS 13 HA CYS 13 3.276 -0.949 -1.212
102 HB2 CYS 13 1HB CYS 13 5.502 -1.130 -3.245
103 HB3 CYS 13 2HB CYS 13 5.617 -1.165 -1.496
104 HG CYS 13 HG CYS 13 4.010 -3.660 -3.178
105 H LYS 14 H LYS 14 2.524 1.066 -1.006
106 HA LYS 14 HA LYS 14 3.713 3.097 -2.752
107 HB2 LYS 14 1HB LYS 14 1.575 4.422 -1.903
108 HB3 LYS 14 2HB LYS 14 1.579 3.440 -3.349
109 HG2 LYS 14 1HG LYS 14 -0.331 2.758 -2.386
110 HG3 LYS 14 2HG LYS 14 0.768 1.561 -1.724
111 HD2 LYS 14 1HD LYS 14 -0.010 4.094 -0.292
112 HD3 LYS 14 2HD LYS 14 -0.894 2.582 -0.118
113 HE2 LYS 14 1HE LYS 14 1.015 1.498 0.814
114 HE3 LYS 14 2HE LYS 14 2.038 2.884 0.439
115 HZ1 LYS 14 3HZ LYS 14 -0.255 2.951 2.332
116 HZ2 LYS 14 1HZ LYS 14 0.856 4.195 2.050
117 HZ3 LYS 14 2HZ LYS 14 1.359 2.769 2.797
118 H ASN 15 H ASN 15 3.542 5.337 -1.698
119 HA ASN 15 HA ASN 15 4.764 5.262 0.899
120 HB2 ASN 15 1HB ASN 15 5.111 6.960 -1.043
121 HB3 ASN 15 2HB ASN 15 3.678 7.711 -0.387
122 HD21 ASN 15 1HD2 ASN 15 6.143 6.103 1.529
123 HD22 ASN 15 2HD2 ASN 15 6.687 7.531 2.336
124 H ASN 16 H ASN 16 1.781 6.537 -0.505
125 HA ASN 16 HA ASN 16 0.565 6.570 2.194
126 HB2 ASN 16 1HB ASN 16 -0.587 8.621 1.662
127 HB3 ASN 16 2HB ASN 16 1.125 8.859 1.335
128 HD21 ASN 16 1HD2 ASN 16 1.829 8.860 -0.858
129 HD22 ASN 16 2HD2 ASN 16 0.731 9.281 -2.125
130 H CYS 17 H CYS 17 -1.542 5.860 2.362
131 HA CYS 17 HA CYS 17 -2.304 3.970 0.366
132 HB2 CYS 17 1HB CYS 17 -3.950 4.862 2.731
133 HB3 CYS 17 2HB CYS 17 -4.058 3.337 1.864
134 HG CYS 17 HG CYS 17 -2.545 3.784 4.590
135 H GLY 18 H GLY 18 -3.747 4.099 -1.203
136 HA2 GLY 18 1HA GLY 18 -4.912 6.719 -1.735
137 HA3 GLY 18 2HA GLY 18 -4.795 5.378 -2.863
138 H LYS 19 H LYS 19 -6.974 5.827 -3.398
139 HA LYS 19 HA LYS 19 -9.166 5.916 -1.769
140 HB2 LYS 19 1HB LYS 19 -10.334 4.771 -3.821
141 HB3 LYS 19 2HB LYS 19 -9.672 6.391 -3.952
142 HG2 LYS 19 1HG LYS 19 -8.983 5.338 -5.904
143 HG3 LYS 19 2HG LYS 19 -7.566 5.257 -4.867
144 HD2 LYS 19 1HD LYS 19 -8.314 2.939 -4.223
145 HD3 LYS 19 2HD LYS 19 -9.516 3.057 -5.508
146 HE2 LYS 19 1HE LYS 19 -7.581 1.889 -6.339
147 HE3 LYS 19 2HE LYS 19 -7.689 3.464 -7.124
148 HZ1 LYS 19 3HZ LYS 19 -5.906 2.793 -4.833
149 HZ2 LYS 19 1HZ LYS 19 -6.002 4.295 -5.612
150 HZ3 LYS 19 2HZ LYS 19 -5.426 2.949 -6.450
151 H ASN 20 H ASN 20 -9.985 4.630 -0.318
152 HA ASN 20 HA ASN 20 -10.596 2.790 0.871
153 HB2 ASN 20 1HB ASN 20 -10.907 1.649 -1.913
154 HB3 ASN 20 2HB ASN 20 -11.569 0.928 -0.451
155 HD21 ASN 20 1HD2 ASN 20 -12.895 1.914 -2.856
156 HD22 ASN 20 2HD2 ASN 20 -14.032 3.101 -2.319
157 H GLU 21 H GLU 21 -7.898 2.984 0.910
158 HA GLU 21 HA GLU 21 -6.980 0.223 0.455
159 HB2 GLU 21 1HB GLU 21 -5.604 2.852 0.011
160 HB3 GLU 21 2HB GLU 21 -4.652 1.415 0.348
161 HG2 GLU 21 1HG GLU 21 -5.505 0.315 -1.597
162 HG3 GLU 21 2HG GLU 21 -6.667 1.609 -1.876
163 H GLU 22 H GLU 22 -6.022 -0.838 2.064
164 HA GLU 22 HA GLU 22 -5.390 0.668 4.514
165 HB2 GLU 22 1HB GLU 22 -6.012 -1.339 5.789
166 HB3 GLU 22 2HB GLU 22 -7.368 -0.682 4.894
167 HG2 GLU 22 1HG GLU 22 -7.256 -2.427 3.292
168 HG3 GLU 22 2HG GLU 22 -5.705 -2.987 3.919
169 H LEU 23 H LEU 23 -3.615 -0.092 5.751
170 HA LEU 23 HA LEU 23 -1.452 -1.085 4.137
171 HB2 LEU 23 1HB LEU 23 -1.512 0.650 6.142
172 HB3 LEU 23 2HB LEU 23 -1.246 -0.782 7.097
173 HG LEU 23 HG LEU 23 0.561 0.096 4.851
174 HD11 LEU 23 1HD1 LEU 23 2.063 0.846 6.658
175 HD12 LEU 23 2HD1 LEU 23 0.772 0.551 7.822
176 HD13 LEU 23 3HD1 LEU 23 0.573 1.782 6.577
177 HD21 LEU 23 3HD2 LEU 23 0.629 -2.283 5.421
178 HD22 LEU 23 1HD2 LEU 23 0.948 -1.859 7.099
179 HD23 LEU 23 2HD2 LEU 23 2.128 -1.454 5.849
180 H ILE 24 H ILE 24 -0.745 -3.122 4.013
181 HA ILE 24 HA ILE 24 -1.914 -5.086 5.870
182 HB ILE 24 HB ILE 24 -2.379 -6.587 4.141
183 HG12 ILE 24 1HG1 ILE 24 -1.417 -5.666 1.727
184 HG13 ILE 24 2HG1 ILE 24 -0.093 -5.315 2.832
185 HG21 ILE 24 1HG2 ILE 24 -2.711 -3.927 2.781
186 HG22 ILE 24 2HG2 ILE 24 -3.770 -4.530 4.059
187 HG23 ILE 24 3HG2 ILE 24 -3.665 -5.388 2.522
188 HD11 ILE 24 3HD1 ILE 24 -0.062 -7.649 3.535
189 HD12 ILE 24 1HD1 ILE 24 0.180 -7.487 1.796
190 HD13 ILE 24 2HD1 ILE 24 -1.387 -7.997 2.424
191 H ALA 25 H ALA 25 0.942 -3.956 4.245
192 HA ALA 25 HA ALA 25 2.615 -5.626 5.898
193 HB1 ALA 25 3HB ALA 25 2.110 -7.162 4.049
194 HB2 ALA 25 1HB ALA 25 3.812 -6.701 4.065
195 HB3 ALA 25 2HB ALA 25 2.712 -5.969 2.899
196 H LEU 26 H LEU 26 4.879 -5.110 5.642
197 HA LEU 26 HA LEU 26 5.227 -2.337 4.734
198 HB2 LEU 26 1HB LEU 26 6.517 -3.921 6.935
199 HB3 LEU 26 2HB LEU 26 7.174 -2.392 6.378
200 HG LEU 26 HG LEU 26 4.412 -2.769 7.551
201 HD11 LEU 26 1HD1 LEU 26 6.155 -3.144 9.214
202 HD12 LEU 26 2HD1 LEU 26 5.303 -1.630 9.516
203 HD13 LEU 26 3HD1 LEU 26 6.907 -1.608 8.782
204 HD21 LEU 26 3HD2 LEU 26 4.452 -0.288 7.695
205 HD22 LEU 26 1HD2 LEU 26 4.443 -0.890 6.037
206 HD23 LEU 26 2HD2 LEU 26 5.941 -0.294 6.753
207 H CYS 27 H CYS 27 6.970 -1.813 3.466
208 HA CYS 27 HA CYS 27 8.519 -4.069 2.390
209 HB2 CYS 27 1HB CYS 27 7.080 -1.880 0.883
210 HB3 CYS 27 2HB CYS 27 8.254 -2.949 0.134
211 HG CYS 27 HG CYS 27 5.798 -3.887 -0.652
212 H GLN 28 H GLN 28 10.205 -2.917 0.723
213 HA GLN 28 HA GLN 28 11.776 -1.140 2.415
214 HB2 GLN 28 1HB GLN 28 12.501 -2.398 -0.224
215 HB3 GLN 28 2HB GLN 28 13.594 -1.554 0.855
216 HG2 GLN 28 1HG GLN 28 13.285 -3.272 2.543
217 HG3 GLN 28 2HG GLN 28 12.156 -4.120 1.485
218 HE21 GLN 28 1HE2 GLN 28 14.677 -5.031 2.620
219 HE22 GLN 28 2HE2 GLN 28 15.680 -5.464 1.278
220 H LYS 29 H LYS 29 13.049 0.587 1.162
221 HA LYS 29 HA LYS 29 13.123 2.529 -0.029
222 HB2 LYS 29 1HB LYS 29 11.001 1.275 -1.737
223 HB3 LYS 29 2HB LYS 29 11.974 2.670 -2.159
224 HG2 LYS 29 1HG LYS 29 13.972 1.292 -2.205
225 HG3 LYS 29 2HG LYS 29 13.027 -0.113 -1.714
226 HD2 LYS 29 1HD LYS 29 12.708 1.456 -4.272
227 HD3 LYS 29 2HD LYS 29 13.418 -0.150 -4.113
228 HE2 LYS 29 1HE LYS 29 10.559 0.559 -3.434
229 HE3 LYS 29 2HE LYS 29 11.087 -0.206 -4.933
230 HZ1 LYS 29 3HZ LYS 29 10.260 -1.837 -3.382
231 HZ2 LYS 29 1HZ LYS 29 11.371 -1.342 -2.208
232 HZ3 LYS 29 2HZ LYS 29 11.916 -2.072 -3.629
233 H SER 30 H SER 30 11.470 2.332 2.184
234 HA SER 30 HA SER 30 9.754 3.237 3.342
235 HB2 SER 30 1HB SER 30 9.160 5.606 2.748
236 HB3 SER 30 2HB SER 30 10.882 5.314 2.973
237 HG SER 30 HG SER 30 10.193 4.920 0.398
238 H LEU 31 H LEU 31 9.090 1.455 1.163
239 HA LEU 31 HA LEU 31 6.390 2.404 0.506
240 HB2 LEU 31 1HB LEU 31 8.065 0.202 -0.734
241 HB3 LEU 31 2HB LEU 31 6.388 0.489 -1.123
242 HG LEU 31 HG LEU 31 8.659 2.418 -1.597
243 HD11 LEU 31 1HD1 LEU 31 8.617 0.430 -3.077
244 HD12 LEU 31 2HD1 LEU 31 8.327 1.944 -3.931
245 HD13 LEU 31 3HD1 LEU 31 6.979 0.868 -3.562
246 HD21 LEU 31 3HD2 LEU 31 6.951 3.712 -2.827
247 HD22 LEU 31 1HD2 LEU 31 6.620 3.613 -1.094
248 HD23 LEU 31 2HD2 LEU 31 5.722 2.598 -2.224
249 H LYS 32 H LYS 32 4.616 1.113 1.021
250 HA LYS 32 HA LYS 32 5.087 -1.466 2.234
251 HB2 LYS 32 1HB LYS 32 3.734 -1.000 4.179
252 HB3 LYS 32 2HB LYS 32 5.077 0.115 4.079
253 HG2 LYS 32 1HG LYS 32 2.305 0.833 3.206
254 HG3 LYS 32 2HG LYS 32 2.906 1.071 4.848
255 HD2 LYS 32 1HD LYS 32 4.044 2.298 2.333
256 HD3 LYS 32 2HD LYS 32 3.077 3.129 3.549
257 HE2 LYS 32 1HE LYS 32 5.792 1.888 3.997
258 HE3 LYS 32 2HE LYS 32 5.468 3.606 3.797
259 HZ1 LYS 32 3HZ LYS 32 5.722 2.941 6.128
260 HZ2 LYS 32 1HZ LYS 32 4.371 1.936 5.991
261 HZ3 LYS 32 2HZ LYS 32 4.200 3.608 5.816
262 H CYS 33 H CYS 33 3.175 -2.801 2.314
263 HA CYS 33 HA CYS 33 1.790 -2.462 -0.185
264 HB2 CYS 33 1HB CYS 33 2.716 -4.659 0.644
265 HB3 CYS 33 2HB CYS 33 1.431 -4.658 1.851
266 HG CYS 33 HG CYS 33 1.309 -5.499 -1.361
267 H CYS 34 H CYS 34 -0.063 -1.460 -0.390
268 HA CYS 34 HA CYS 34 -2.077 -1.868 1.707
269 HB2 CYS 34 1HB CYS 34 -1.617 0.605 0.033
270 HB3 CYS 34 2HB CYS 34 -3.050 0.336 1.022
271 HG CYS 34 HG CYS 34 -2.057 1.137 3.250
272 H ARG 35 H ARG 35 -4.043 -2.525 1.042
273 HA ARG 35 HA ARG 35 -4.200 -3.297 -1.790
274 HB2 ARG 35 1HB ARG 35 -5.653 -4.461 0.597
275 HB3 ARG 35 2HB ARG 35 -5.716 -5.075 -1.048
276 HG2 ARG 35 1HG ARG 35 -3.398 -5.692 -0.971
277 HG3 ARG 35 2HG ARG 35 -3.209 -4.929 0.608
278 HD2 ARG 35 1HD ARG 35 -3.435 -7.187 1.135
279 HD3 ARG 35 2HD ARG 35 -5.059 -6.542 1.366
280 HE ARG 35 HE ARG 35 -4.812 -7.486 -1.275
281 HH11 ARG 35 1HH1 ARG 35 -5.057 -8.656 2.011
282 HH12 ARG 35 2HH1 ARG 35 -5.751 -10.177 1.555
283 HH21 ARG 35 1HH2 ARG 35 -5.747 -9.476 -1.884
284 HH22 ARG 35 2HH2 ARG 35 -6.141 -10.648 -0.667
285 H THR 36 H THR 36 -5.843 -2.635 -3.033
286 HA THR 36 HA THR 36 -7.644 -0.625 -2.072
287 HB THR 36 HB THR 36 -7.597 -2.031 -4.754
288 HG1 THR 36 HG1 THR 36 -6.006 -0.106 -3.631
289 HG21 THR 36 1HG2 THR 36 -8.845 -0.076 -5.548
290 HG22 THR 36 2HG2 THR 36 -8.882 0.572 -3.909
291 HG23 THR 36 3HG2 THR 36 -9.736 -0.924 -4.285
292 H ILE 37 H ILE 37 -9.184 -1.251 -0.761
293 HA ILE 37 HA ILE 37 -10.337 -3.879 -0.845
294 HB ILE 37 HB ILE 37 -11.119 -1.501 0.838
295 HG12 ILE 37 1HG1 ILE 37 -8.732 -1.940 1.052
296 HG13 ILE 37 2HG1 ILE 37 -9.559 -2.453 2.510
297 HG21 ILE 37 1HG2 ILE 37 -12.754 -3.318 0.826
298 HG22 ILE 37 2HG2 ILE 37 -11.958 -3.184 2.394
299 HG23 ILE 37 3HG2 ILE 37 -11.489 -4.461 1.274
300 HD11 ILE 37 3HD1 ILE 37 -9.455 -4.763 1.770
301 HD12 ILE 37 1HD1 ILE 37 -7.848 -4.045 1.830
302 HD13 ILE 37 2HD1 ILE 37 -8.667 -4.258 0.280
303 H GLN 38 H GLN 38 -11.856 -4.383 -2.230
304 HA GLN 38 HA GLN 38 -13.742 -2.308 -3.099
305 HB2 GLN 38 1HB GLN 38 -14.138 -3.742 -5.072
306 HB3 GLN 38 2HB GLN 38 -12.460 -3.241 -4.925
307 HG2 GLN 38 1HG GLN 38 -11.912 -5.436 -3.967
308 HG3 GLN 38 2HG GLN 38 -13.591 -5.928 -4.187
309 HE21 GLN 38 1HE2 GLN 38 -11.173 -7.067 -5.318
310 HE22 GLN 38 2HE2 GLN 38 -11.370 -6.999 -7.035
311 HA PRO 39 HA PRO 39 -16.937 -4.383 -0.774
312 HB2 PRO 39 1HB PRO 39 -18.713 -2.998 -2.701
313 HB3 PRO 39 2HB PRO 39 -18.705 -2.935 -0.936
314 HG2 PRO 39 1HG PRO 39 -17.830 -0.874 -2.388
315 HG3 PRO 39 2HG PRO 39 -17.042 -1.328 -0.866
316 HD2 PRO 39 1HD PRO 39 -16.174 -1.848 -3.681
317 HD3 PRO 39 2HD PRO 39 -15.202 -1.401 -2.264
318 H SER 40 H SER 40 -18.032 -6.251 -1.056
319 HA SER 40 HA SER 40 -18.922 -8.106 -2.010
320 HB2 SER 40 1HB SER 40 -18.940 -6.459 -4.538
321 HB3 SER 40 2HB SER 40 -19.711 -8.037 -4.356
322 HG SER 40 HG SER 40 -20.302 -5.802 -2.708
323 H GLY 41 H GLY 41 -15.978 -6.866 -2.639
324 HA2 GLY 41 1HA GLY 41 -14.963 -8.719 -4.550
325 HA3 GLY 41 2HA GLY 41 -14.010 -7.734 -3.452
326 H SER 42 H SER 42 -13.012 -10.123 -3.850
327 HA SER 42 HA SER 42 -14.048 -12.111 -2.072
328 HB2 SER 42 1HB SER 42 -12.764 -12.661 -4.131
329 HB3 SER 42 2HB SER 42 -11.324 -11.973 -3.388
330 HG SER 42 HG SER 42 -12.831 -14.176 -2.406
331 H ILE 43 H ILE 43 -13.113 -12.870 -0.185
332 HA ILE 43 HA ILE 43 -12.048 -12.846 1.811
333 HB ILE 43 HB ILE 43 -10.242 -10.758 0.584
334 HG12 ILE 43 1HG1 ILE 43 -9.844 -13.731 0.995
335 HG13 ILE 43 2HG1 ILE 43 -10.176 -12.953 -0.549
336 HG21 ILE 43 1HG2 ILE 43 -8.706 -11.287 2.423
337 HG22 ILE 43 2HG2 ILE 43 -9.923 -12.354 3.125
338 HG23 ILE 43 3HG2 ILE 43 -10.227 -10.620 3.016
339 HD11 ILE 43 3HD1 ILE 43 -7.824 -13.483 -0.322
340 HD12 ILE 43 1HD1 ILE 43 -7.736 -12.528 1.158
341 HD13 ILE 43 2HD1 ILE 43 -8.066 -11.736 -0.383
342 H ILE 44 H ILE 44 -11.998 -9.428 0.748
343 HA ILE 44 HA ILE 44 -13.371 -8.781 3.271
344 HB ILE 44 HB ILE 44 -11.066 -8.107 3.481
345 HG12 ILE 44 1HG1 ILE 44 -12.792 -5.680 2.939
346 HG13 ILE 44 2HG1 ILE 44 -12.815 -6.624 4.424
347 HG21 ILE 44 1HG2 ILE 44 -10.549 -7.987 1.081
348 HG22 ILE 44 2HG2 ILE 44 -9.974 -6.579 1.969
349 HG23 ILE 44 3HG2 ILE 44 -11.429 -6.461 0.981
350 HD11 ILE 44 3HD1 ILE 44 -10.548 -4.959 3.360
351 HD12 ILE 44 1HD1 ILE 44 -10.424 -6.033 4.755
352 HD13 ILE 44 2HD1 ILE 44 -11.529 -4.660 4.794
353 H ASP 45 H ASP 45 -15.007 -7.332 3.210
354 HA ASP 45 HA ASP 45 -15.834 -6.389 0.545
355 HB2 ASP 45 1HB ASP 45 -17.513 -7.047 2.979
356 HB3 ASP 45 2HB ASP 45 -18.146 -6.367 1.487
Start of MODEL 9
1 H PHE 1 1H PHE 1 11.258 -12.195 -1.037
2 HA PHE 1 HA PHE 1 8.974 -12.616 -1.514
3 HB2 PHE 1 1HB PHE 1 10.170 -14.075 0.104
4 HB3 PHE 1 2HB PHE 1 9.574 -13.066 1.418
5 HD1 PHE 1 HD2 PHE 1 8.419 -15.198 -1.394
6 HD2 PHE 1 HD1 PHE 1 7.535 -13.543 2.423
7 HE1 PHE 1 HE2 PHE 1 6.379 -16.568 -1.277
8 HE2 PHE 1 HE1 PHE 1 5.492 -14.909 2.547
9 HZ PHE 1 HZ PHE 1 4.913 -16.424 0.696
10 H PHE 2 H PHE 2 9.500 -10.029 0.714
11 HA PHE 2 HA PHE 2 7.037 -9.655 1.882
12 HB2 PHE 2 1HB PHE 2 9.046 -7.646 0.885
13 HB3 PHE 2 2HB PHE 2 7.571 -7.154 1.711
14 HD1 PHE 2 HD2 PHE 2 7.141 -8.303 4.012
15 HD2 PHE 2 HD1 PHE 2 10.946 -8.048 2.126
16 HE1 PHE 2 HE2 PHE 2 8.239 -8.634 6.189
17 HE2 PHE 2 HE1 PHE 2 12.051 -8.375 4.300
18 HZ PHE 2 HZ PHE 2 10.694 -8.669 6.335
19 H ASP 3 H ASP 3 8.046 -8.166 -1.225
20 HA ASP 3 HA ASP 3 5.271 -7.520 -1.710
21 HB2 ASP 3 1HB ASP 3 6.029 -6.321 -3.680
22 HB3 ASP 3 2HB ASP 3 6.920 -5.821 -2.251
23 H GLU 4 H GLU 4 7.156 -10.150 -2.236
24 HA GLU 4 HA GLU 4 5.942 -11.093 -4.645
25 HB2 GLU 4 1HB GLU 4 8.003 -12.101 -3.610
26 HB3 GLU 4 2HB GLU 4 6.988 -12.734 -2.323
27 HG2 GLU 4 1HG GLU 4 7.378 -14.490 -3.869
28 HG3 GLU 4 2HG GLU 4 5.699 -13.984 -4.051
29 H LYS 5 H LYS 5 5.239 -11.162 -1.220
30 HA LYS 5 HA LYS 5 2.752 -12.534 -1.463
31 HB2 LYS 5 1HB LYS 5 4.187 -12.302 0.634
32 HB3 LYS 5 2HB LYS 5 3.571 -10.661 0.754
33 HG2 LYS 5 1HG LYS 5 2.336 -12.164 2.203
34 HG3 LYS 5 2HG LYS 5 1.293 -11.523 0.933
35 HD2 LYS 5 1HD LYS 5 1.463 -13.578 -0.313
36 HD3 LYS 5 2HD LYS 5 2.656 -14.212 0.821
37 HE2 LYS 5 1HE LYS 5 -0.182 -13.494 1.536
38 HE3 LYS 5 2HE LYS 5 0.371 -15.124 1.157
39 HZ1 LYS 5 3HZ LYS 5 0.308 -14.811 3.523
40 HZ2 LYS 5 1HZ LYS 5 1.290 -13.437 3.421
41 HZ3 LYS 5 2HZ LYS 5 1.920 -14.955 3.035
42 H CYS 6 H CYS 6 3.821 -9.181 -1.558
43 HA CYS 6 HA CYS 6 1.354 -7.880 -1.498
44 HB2 CYS 6 1HB CYS 6 3.526 -6.692 -1.458
45 HB3 CYS 6 2HB CYS 6 3.821 -7.169 -3.122
46 HG CYS 6 HG CYS 6 1.312 -5.739 -3.858
47 H ASN 7 H ASN 7 3.122 -9.324 -4.191
48 HA ASN 7 HA ASN 7 1.313 -8.716 -6.256
49 HB2 ASN 7 1HB ASN 7 3.622 -9.562 -6.592
50 HB3 ASN 7 2HB ASN 7 3.115 -11.133 -5.996
51 HD21 ASN 7 1HD2 ASN 7 2.979 -8.891 -8.631
52 HD22 ASN 7 2HD2 ASN 7 2.290 -9.978 -9.786
53 H LYS 8 H LYS 8 1.583 -11.456 -4.081
54 HA LYS 8 HA LYS 8 -0.399 -13.104 -5.150
55 HB2 LYS 8 1HB LYS 8 1.357 -13.504 -3.259
56 HB3 LYS 8 2HB LYS 8 0.079 -12.941 -2.199
57 HG2 LYS 8 1HG LYS 8 -0.301 -15.222 -4.113
58 HG3 LYS 8 2HG LYS 8 0.312 -15.441 -2.476
59 HD2 LYS 8 1HD LYS 8 -1.742 -14.427 -1.588
60 HD3 LYS 8 2HD LYS 8 -2.352 -14.240 -3.234
61 HE2 LYS 8 1HE LYS 8 -2.262 -16.671 -3.537
62 HE3 LYS 8 2HE LYS 8 -1.659 -16.849 -1.892
63 HZ1 LYS 8 3HZ LYS 8 -4.296 -15.704 -2.626
64 HZ2 LYS 8 1HZ LYS 8 -3.720 -15.942 -1.055
65 HZ3 LYS 8 2HZ LYS 8 -4.041 -17.270 -2.049
66 H LEU 9 H LEU 9 -0.664 -10.509 -2.734
67 HA LEU 9 HA LEU 9 -3.519 -10.844 -2.475
68 HB2 LEU 9 1HB LEU 9 -1.555 -8.832 -1.422
69 HB3 LEU 9 2HB LEU 9 -3.275 -8.541 -1.297
70 HG LEU 9 HG LEU 9 -2.493 -9.414 0.789
71 HD11 LEU 9 1HD1 LEU 9 -3.969 -11.572 -0.703
72 HD12 LEU 9 2HD1 LEU 9 -4.695 -10.161 0.064
73 HD13 LEU 9 3HD1 LEU 9 -3.890 -11.384 1.047
74 HD21 LEU 9 3HD2 LEU 9 -1.437 -11.787 -0.736
75 HD22 LEU 9 1HD2 LEU 9 -1.410 -11.572 1.014
76 HD23 LEU 9 2HD2 LEU 9 -0.458 -10.504 -0.021
77 H LYS 10 H LYS 10 -1.495 -9.413 -4.708
78 HA LYS 10 HA LYS 10 -1.789 -8.124 -6.530
79 HB2 LYS 10 1HB LYS 10 -4.677 -8.646 -5.900
80 HB3 LYS 10 2HB LYS 10 -4.187 -7.626 -7.249
81 HG2 LYS 10 1HG LYS 10 -2.792 -9.555 -8.058
82 HG3 LYS 10 2HG LYS 10 -3.598 -10.541 -6.836
83 HD2 LYS 10 1HD LYS 10 -5.744 -10.099 -7.831
84 HD3 LYS 10 2HD LYS 10 -5.012 -8.964 -8.967
85 HE2 LYS 10 1HE LYS 10 -4.381 -11.908 -8.828
86 HE3 LYS 10 2HE LYS 10 -5.516 -11.179 -9.963
87 HZ1 LYS 10 3HZ LYS 10 -3.692 -9.857 -10.860
88 HZ2 LYS 10 1HZ LYS 10 -3.369 -11.512 -10.987
89 HZ3 LYS 10 2HZ LYS 10 -2.608 -10.594 -9.790
90 H GLY 11 H GLY 11 -1.290 -6.975 -4.021
91 HA2 GLY 11 1HA GLY 11 -2.674 -4.384 -4.197
92 HA3 GLY 11 2HA GLY 11 -1.702 -4.938 -2.836
93 H THR 12 H THR 12 -1.084 -2.499 -3.607
94 HA THR 12 HA THR 12 1.307 -2.847 -5.285
95 HB THR 12 HB THR 12 -0.316 -1.537 -6.513
96 HG1 THR 12 HG1 THR 12 1.041 0.158 -7.006
97 HG21 THR 12 1HG2 THR 12 -0.232 0.364 -4.180
98 HG22 THR 12 2HG2 THR 12 -1.600 -0.650 -4.637
99 HG23 THR 12 3HG2 THR 12 -1.069 0.649 -5.707
100 H CYS 13 H CYS 13 3.064 -1.464 -4.822
101 HA CYS 13 HA CYS 13 3.290 -0.986 -1.947
102 HB2 CYS 13 1HB CYS 13 5.532 -0.894 -3.964
103 HB3 CYS 13 2HB CYS 13 5.654 -1.064 -2.221
104 HG CYS 13 HG CYS 13 4.051 -3.613 -2.623
105 H LYS 14 H LYS 14 2.483 0.951 -1.515
106 HA LYS 14 HA LYS 14 3.778 3.249 -2.793
107 HB2 LYS 14 1HB LYS 14 1.594 4.496 -2.503
108 HB3 LYS 14 2HB LYS 14 1.613 3.274 -3.767
109 HG2 LYS 14 1HG LYS 14 0.377 1.751 -2.407
110 HG3 LYS 14 2HG LYS 14 0.514 2.813 -1.008
111 HD2 LYS 14 1HD LYS 14 -1.701 2.983 -1.983
112 HD3 LYS 14 2HD LYS 14 -0.834 4.503 -2.171
113 HE2 LYS 14 1HE LYS 14 -0.818 2.470 -4.367
114 HE3 LYS 14 2HE LYS 14 -2.202 3.538 -4.159
115 HZ1 LYS 14 3HZ LYS 14 -0.648 4.452 -5.741
116 HZ2 LYS 14 1HZ LYS 14 0.607 4.398 -4.610
117 HZ3 LYS 14 2HZ LYS 14 -0.702 5.436 -4.369
118 H ASN 15 H ASN 15 3.411 5.270 -1.351
119 HA ASN 15 HA ASN 15 4.175 4.472 1.321
120 HB2 ASN 15 1HB ASN 15 4.154 7.123 -0.114
121 HB3 ASN 15 2HB ASN 15 4.567 6.963 1.584
122 HD21 ASN 15 1HD2 ASN 15 6.467 5.881 2.165
123 HD22 ASN 15 2HD2 ASN 15 7.745 5.625 1.025
124 H ASN 16 H ASN 16 1.805 6.640 -0.185
125 HA ASN 16 HA ASN 16 0.269 6.674 2.315
126 HB2 ASN 16 1HB ASN 16 -0.086 8.415 -0.137
127 HB3 ASN 16 2HB ASN 16 -0.846 8.640 1.433
128 HD21 ASN 16 1HD2 ASN 16 2.079 8.934 -0.405
129 HD22 ASN 16 2HD2 ASN 16 2.937 9.919 0.732
130 H CYS 17 H CYS 17 -1.605 5.577 2.442
131 HA CYS 17 HA CYS 17 -2.437 3.924 0.276
132 HB2 CYS 17 1HB CYS 17 -3.931 4.559 2.827
133 HB3 CYS 17 2HB CYS 17 -4.212 3.189 1.762
134 HG CYS 17 HG CYS 17 -1.454 2.297 2.258
135 H GLY 18 H GLY 18 -3.766 4.381 -1.336
136 HA2 GLY 18 1HA GLY 18 -4.961 7.016 -1.475
137 HA3 GLY 18 2HA GLY 18 -4.910 5.813 -2.756
138 H LYS 19 H LYS 19 -7.131 6.349 -3.164
139 HA LYS 19 HA LYS 19 -9.193 6.173 -1.319
140 HB2 LYS 19 1HB LYS 19 -10.650 5.636 -3.333
141 HB3 LYS 19 2HB LYS 19 -9.728 7.126 -3.403
142 HG2 LYS 19 1HG LYS 19 -9.424 6.300 -5.519
143 HG3 LYS 19 2HG LYS 19 -7.996 5.670 -4.700
144 HD2 LYS 19 1HD LYS 19 -9.142 3.515 -4.382
145 HD3 LYS 19 2HD LYS 19 -10.555 4.157 -5.228
146 HE2 LYS 19 1HE LYS 19 -9.244 4.449 -7.246
147 HE3 LYS 19 2HE LYS 19 -7.792 3.903 -6.409
148 HZ1 LYS 19 3HZ LYS 19 -8.724 2.130 -7.721
149 HZ2 LYS 19 1HZ LYS 19 -10.219 2.276 -6.942
150 HZ3 LYS 19 2HZ LYS 19 -8.864 1.748 -6.083
151 H ASN 20 H ASN 20 -10.070 4.610 -0.213
152 HA ASN 20 HA ASN 20 -10.578 2.563 0.611
153 HB2 ASN 20 1HB ASN 20 -10.782 2.050 -2.351
154 HB3 ASN 20 2HB ASN 20 -11.156 0.805 -1.166
155 HD21 ASN 20 1HD2 ASN 20 -13.286 0.702 -1.834
156 HD22 ASN 20 2HD2 ASN 20 -14.432 1.936 -1.447
157 H GLU 21 H GLU 21 -7.914 2.940 0.877
158 HA GLU 21 HA GLU 21 -6.900 0.245 0.300
159 HB2 GLU 21 1HB GLU 21 -5.472 2.858 -0.102
160 HB3 GLU 21 2HB GLU 21 -4.583 1.362 0.143
161 HG2 GLU 21 1HG GLU 21 -5.812 0.404 -1.799
162 HG3 GLU 21 2HG GLU 21 -6.504 1.999 -2.081
163 H GLU 22 H GLU 22 -5.697 -0.733 1.835
164 HA GLU 22 HA GLU 22 -5.328 0.723 4.376
165 HB2 GLU 22 1HB GLU 22 -5.828 -1.326 5.587
166 HB3 GLU 22 2HB GLU 22 -7.170 -0.926 4.525
167 HG2 GLU 22 1HG GLU 22 -6.508 -2.609 2.955
168 HG3 GLU 22 2HG GLU 22 -5.027 -2.922 3.851
169 H LEU 23 H LEU 23 -3.551 -0.066 5.711
170 HA LEU 23 HA LEU 23 -1.263 -0.834 4.101
171 HB2 LEU 23 1HB LEU 23 -1.534 0.842 6.218
172 HB3 LEU 23 2HB LEU 23 -0.997 -0.611 7.034
173 HG LEU 23 HG LEU 23 1.046 -0.652 5.696
174 HD11 LEU 23 1HD1 LEU 23 -0.287 1.642 4.309
175 HD12 LEU 23 2HD1 LEU 23 0.424 0.180 3.616
176 HD13 LEU 23 3HD1 LEU 23 1.462 1.438 4.288
177 HD21 LEU 23 3HD2 LEU 23 0.497 2.067 6.881
178 HD22 LEU 23 1HD2 LEU 23 2.087 1.372 6.566
179 HD23 LEU 23 2HD2 LEU 23 1.027 0.641 7.772
180 H ILE 24 H ILE 24 -0.656 -2.868 3.848
181 HA ILE 24 HA ILE 24 -1.764 -4.869 5.711
182 HB ILE 24 HB ILE 24 -2.348 -6.265 3.925
183 HG12 ILE 24 1HG1 ILE 24 -1.331 -5.362 1.541
184 HG13 ILE 24 2HG1 ILE 24 0.006 -5.053 2.638
185 HG21 ILE 24 1HG2 ILE 24 -2.496 -3.575 2.605
186 HG22 ILE 24 2HG2 ILE 24 -3.516 -4.040 3.966
187 HG23 ILE 24 3HG2 ILE 24 -3.613 -4.933 2.451
188 HD11 ILE 24 3HD1 ILE 24 -0.011 -7.397 3.319
189 HD12 ILE 24 1HD1 ILE 24 0.226 -7.222 1.580
190 HD13 ILE 24 2HD1 ILE 24 -1.348 -7.705 2.210
191 H ALA 25 H ALA 25 1.053 -3.527 4.414
192 HA ALA 25 HA ALA 25 2.761 -5.234 5.900
193 HB1 ALA 25 3HB ALA 25 2.240 -6.774 4.014
194 HB2 ALA 25 1HB ALA 25 3.951 -6.362 4.138
195 HB3 ALA 25 2HB ALA 25 2.947 -5.596 2.910
196 H LEU 26 H LEU 26 4.988 -4.705 5.619
197 HA LEU 26 HA LEU 26 5.315 -1.952 4.683
198 HB2 LEU 26 1HB LEU 26 5.628 -2.250 7.029
199 HB3 LEU 26 2HB LEU 26 6.757 -3.554 6.789
200 HG LEU 26 HG LEU 26 7.733 -1.366 7.553
201 HD11 LEU 26 1HD1 LEU 26 9.638 -1.382 6.039
202 HD12 LEU 26 2HD1 LEU 26 8.731 -2.379 4.901
203 HD13 LEU 26 3HD1 LEU 26 9.154 -3.014 6.492
204 HD21 LEU 26 3HD2 LEU 26 7.931 0.467 6.036
205 HD22 LEU 26 1HD2 LEU 26 6.223 0.052 6.193
206 HD23 LEU 26 2HD2 LEU 26 7.124 -0.439 4.759
207 H CYS 27 H CYS 27 6.831 -1.487 3.246
208 HA CYS 27 HA CYS 27 7.985 -3.829 1.885
209 HB2 CYS 27 1HB CYS 27 6.735 -1.323 0.780
210 HB3 CYS 27 2HB CYS 27 7.722 -2.386 -0.214
211 HG CYS 27 HG CYS 27 5.693 -4.425 1.119
212 H GLN 28 H GLN 28 9.788 -3.291 0.397
213 HA GLN 28 HA GLN 28 11.882 -1.964 1.761
214 HB2 GLN 28 1HB GLN 28 11.813 -2.762 -1.147
215 HB3 GLN 28 2HB GLN 28 13.241 -2.456 -0.179
216 HG2 GLN 28 1HG GLN 28 13.154 -4.767 -0.320
217 HG3 GLN 28 2HG GLN 28 12.465 -4.422 1.263
218 HE21 GLN 28 1HE2 GLN 28 11.806 -5.487 -1.982
219 HE22 GLN 28 2HE2 GLN 28 10.234 -6.143 -1.670
220 H LYS 29 H LYS 29 13.240 -0.274 0.508
221 HA LYS 29 HA LYS 29 13.454 1.854 -0.301
222 HB2 LYS 29 1HB LYS 29 10.727 1.400 -1.508
223 HB3 LYS 29 2HB LYS 29 11.824 2.707 -1.918
224 HG2 LYS 29 1HG LYS 29 13.331 1.239 -2.978
225 HG3 LYS 29 2HG LYS 29 12.542 -0.182 -2.290
226 HD2 LYS 29 1HD LYS 29 11.237 1.720 -4.233
227 HD3 LYS 29 2HD LYS 29 12.009 0.205 -4.692
228 HE2 LYS 29 1HE LYS 29 10.436 -0.994 -3.190
229 HE3 LYS 29 2HE LYS 29 9.613 0.535 -2.873
230 HZ1 LYS 29 3HZ LYS 29 9.900 -0.743 -5.541
231 HZ2 LYS 29 1HZ LYS 29 9.077 0.698 -5.216
232 HZ3 LYS 29 2HZ LYS 29 8.503 -0.765 -4.589
233 H SER 30 H SER 30 11.680 0.946 2.077
234 HA SER 30 HA SER 30 10.558 1.869 3.808
235 HB2 SER 30 1HB SER 30 12.213 3.750 3.518
236 HB3 SER 30 2HB SER 30 11.023 4.566 2.509
237 HG SER 30 HG SER 30 9.840 5.014 4.225
238 H LEU 31 H LEU 31 9.438 1.282 1.026
239 HA LEU 31 HA LEU 31 7.001 2.793 0.912
240 HB2 LEU 31 1HB LEU 31 8.275 0.573 -0.579
241 HB3 LEU 31 2HB LEU 31 6.564 0.743 -0.746
242 HG LEU 31 HG LEU 31 8.073 1.842 -2.489
243 HD11 LEU 31 1HD1 LEU 31 5.698 2.242 -2.340
244 HD12 LEU 31 2HD1 LEU 31 6.541 3.749 -2.700
245 HD13 LEU 31 3HD1 LEU 31 5.954 3.433 -1.064
246 HD21 LEU 31 3HD2 LEU 31 8.305 3.931 -0.335
247 HD22 LEU 31 1HD2 LEU 31 8.871 4.068 -1.998
248 HD23 LEU 31 2HD2 LEU 31 9.625 2.911 -0.902
249 H LYS 32 H LYS 32 5.049 1.068 0.442
250 HA LYS 32 HA LYS 32 4.851 -0.843 2.626
251 HB2 LYS 32 1HB LYS 32 3.433 1.783 2.563
252 HB3 LYS 32 2HB LYS 32 2.581 0.382 3.191
253 HG2 LYS 32 1HG LYS 32 3.810 0.299 5.075
254 HG3 LYS 32 2HG LYS 32 5.291 0.814 4.256
255 HD2 LYS 32 1HD LYS 32 4.469 3.116 4.203
256 HD3 LYS 32 2HD LYS 32 2.976 2.606 4.995
257 HE2 LYS 32 1HE LYS 32 4.173 1.979 6.976
258 HE3 LYS 32 2HE LYS 32 5.722 2.259 6.183
259 HZ1 LYS 32 3HZ LYS 32 3.690 4.343 6.774
260 HZ2 LYS 32 1HZ LYS 32 5.189 4.601 6.034
261 HZ3 LYS 32 2HZ LYS 32 5.116 4.086 7.642
262 H CYS 33 H CYS 33 3.011 -2.230 2.454
263 HA CYS 33 HA CYS 33 2.081 -2.432 -0.304
264 HB2 CYS 33 1HB CYS 33 3.035 -4.413 0.945
265 HB3 CYS 33 2HB CYS 33 1.600 -4.361 1.964
266 HG CYS 33 HG CYS 33 1.421 -4.742 -1.426
267 H CYS 34 H CYS 34 0.262 -1.464 -0.812
268 HA CYS 34 HA CYS 34 -1.857 -1.311 1.221
269 HB2 CYS 34 1HB CYS 34 -1.390 0.457 -1.191
270 HB3 CYS 34 2HB CYS 34 -2.724 0.616 -0.055
271 HG CYS 34 HG CYS 34 0.529 0.870 0.954
272 H ARG 35 H ARG 35 -3.664 -2.401 0.866
273 HA ARG 35 HA ARG 35 -4.077 -3.581 -1.795
274 HB2 ARG 35 1HB ARG 35 -5.374 -4.290 0.845
275 HB3 ARG 35 2HB ARG 35 -5.668 -5.107 -0.682
276 HG2 ARG 35 1HG ARG 35 -3.411 -5.907 -0.758
277 HG3 ARG 35 2HG ARG 35 -2.986 -4.963 0.666
278 HD2 ARG 35 1HD ARG 35 -4.553 -7.484 0.461
279 HD3 ARG 35 2HD ARG 35 -3.295 -7.046 1.588
280 HE ARG 35 HE ARG 35 -5.510 -5.420 2.090
281 HH11 ARG 35 1HH1 ARG 35 -4.577 -8.780 2.313
282 HH12 ARG 35 2HH1 ARG 35 -5.668 -9.128 3.615
283 HH21 ARG 35 1HH2 ARG 35 -6.960 -5.874 3.817
284 HH22 ARG 35 2HH2 ARG 35 -7.011 -7.490 4.463
285 H THR 36 H THR 36 -5.615 -2.823 -3.062
286 HA THR 36 HA THR 36 -7.338 -0.705 -2.182
287 HB THR 36 HB THR 36 -7.542 -2.170 -4.814
288 HG1 THR 36 HG1 THR 36 -5.551 -0.452 -3.852
289 HG21 THR 36 1HG2 THR 36 -9.326 -0.560 -4.267
290 HG22 THR 36 2HG2 THR 36 -8.349 -0.015 -5.629
291 HG23 THR 36 3HG2 THR 36 -8.112 0.699 -4.034
292 H ILE 37 H ILE 37 -9.048 -1.104 -1.013
293 HA ILE 37 HA ILE 37 -10.148 -3.693 -0.674
294 HB ILE 37 HB ILE 37 -11.251 -1.032 0.221
295 HG12 ILE 37 1HG1 ILE 37 -8.986 -1.258 0.990
296 HG13 ILE 37 2HG1 ILE 37 -10.046 -1.603 2.347
297 HG21 ILE 37 1HG2 ILE 37 -12.347 -2.356 1.975
298 HG22 ILE 37 2HG2 ILE 37 -11.727 -3.834 1.239
299 HG23 ILE 37 3HG2 ILE 37 -12.886 -2.831 0.365
300 HD11 ILE 37 3HD1 ILE 37 -8.298 -3.201 2.391
301 HD12 ILE 37 1HD1 ILE 37 -8.502 -3.560 0.676
302 HD13 ILE 37 2HD1 ILE 37 -9.742 -4.038 1.830
303 H GLN 38 H GLN 38 -11.065 -4.534 -2.393
304 HA GLN 38 HA GLN 38 -13.347 -3.129 -3.608
305 HB2 GLN 38 1HB GLN 38 -11.792 -5.507 -4.662
306 HB3 GLN 38 2HB GLN 38 -13.077 -4.649 -5.503
307 HG2 GLN 38 1HG GLN 38 -11.725 -2.678 -5.685
308 HG3 GLN 38 2HG GLN 38 -10.469 -3.398 -4.680
309 HE21 GLN 38 1HE2 GLN 38 -10.270 -2.344 -7.372
310 HE22 GLN 38 2HE2 GLN 38 -9.712 -3.646 -8.368
311 HA PRO 39 HA PRO 39 -15.998 -5.756 -1.187
312 HB2 PRO 39 1HB PRO 39 -17.673 -5.621 -3.661
313 HB3 PRO 39 2HB PRO 39 -18.133 -5.351 -1.975
314 HG2 PRO 39 1HG PRO 39 -17.785 -3.294 -3.620
315 HG3 PRO 39 2HG PRO 39 -17.241 -3.210 -1.935
316 HD2 PRO 39 1HD PRO 39 -15.644 -3.558 -4.426
317 HD3 PRO 39 2HD PRO 39 -15.223 -2.719 -2.921
318 H SER 40 H SER 40 -15.541 -7.830 -0.934
319 HA SER 40 HA SER 40 -15.622 -9.626 -3.262
320 HB2 SER 40 1HB SER 40 -13.492 -9.681 -1.106
321 HB3 SER 40 2HB SER 40 -13.573 -10.710 -2.535
322 HG SER 40 HG SER 40 -13.361 -7.876 -2.636
323 H GLY 41 H GLY 41 -15.792 -11.935 -2.595
324 HA2 GLY 41 1HA GLY 41 -17.486 -12.317 -0.296
325 HA3 GLY 41 2HA GLY 41 -16.869 -13.576 -1.365
326 H SER 42 H SER 42 -16.783 -12.559 1.715
327 HA SER 42 HA SER 42 -15.417 -12.789 3.504
328 HB2 SER 42 1HB SER 42 -15.126 -15.108 2.603
329 HB3 SER 42 2HB SER 42 -13.715 -14.546 1.712
330 HG SER 42 HG SER 42 -12.847 -15.291 3.536
331 H ILE 43 H ILE 43 -12.727 -12.785 3.858
332 HA ILE 43 HA ILE 43 -10.871 -11.484 3.895
333 HB ILE 43 HB ILE 43 -11.706 -10.409 1.194
334 HG12 ILE 43 1HG1 ILE 43 -9.876 -12.736 1.854
335 HG13 ILE 43 2HG1 ILE 43 -11.504 -12.887 1.200
336 HG21 ILE 43 1HG2 ILE 43 -9.323 -9.890 0.947
337 HG22 ILE 43 2HG2 ILE 43 -9.027 -10.480 2.582
338 HG23 ILE 43 3HG2 ILE 43 -10.030 -9.053 2.328
339 HD11 ILE 43 3HD1 ILE 43 -9.823 -13.172 -0.527
340 HD12 ILE 43 1HD1 ILE 43 -9.167 -11.574 -0.169
341 HD13 ILE 43 2HD1 ILE 43 -10.796 -11.732 -0.827
342 H ILE 44 H ILE 44 -13.141 -9.365 2.128
343 HA ILE 44 HA ILE 44 -13.706 -7.713 4.355
344 HB ILE 44 HB ILE 44 -11.314 -7.088 4.007
345 HG12 ILE 44 1HG1 ILE 44 -13.220 -4.834 3.343
346 HG13 ILE 44 2HG1 ILE 44 -13.023 -5.513 4.953
347 HG21 ILE 44 1HG2 ILE 44 -10.658 -5.817 2.043
348 HG22 ILE 44 2HG2 ILE 44 -12.276 -5.991 1.367
349 HG23 ILE 44 3HG2 ILE 44 -11.251 -7.413 1.576
350 HD11 ILE 44 3HD1 ILE 44 -10.927 -4.080 3.341
351 HD12 ILE 44 1HD1 ILE 44 -10.656 -4.833 4.912
352 HD13 ILE 44 2HD1 ILE 44 -11.769 -3.477 4.764
353 H ASP 45 H ASP 45 -15.073 -5.909 3.772
354 HA ASP 45 HA ASP 45 -16.242 -6.168 1.082
355 HB2 ASP 45 1HB ASP 45 -17.567 -5.239 3.640
356 HB3 ASP 45 2HB ASP 45 -18.333 -5.289 2.059
Start of MODEL 10
1 H PHE 1 1H PHE 1 9.824 -13.032 -2.228
2 HA PHE 1 HA PHE 1 7.575 -13.388 -1.481
3 HB2 PHE 1 1HB PHE 1 9.335 -14.080 0.019
4 HB3 PHE 1 2HB PHE 1 9.520 -12.443 0.634
5 HD1 PHE 1 HD2 PHE 1 6.800 -14.975 0.236
6 HD2 PHE 1 HD1 PHE 1 8.620 -12.014 2.692
7 HE1 PHE 1 HE2 PHE 1 5.170 -15.455 2.017
8 HE2 PHE 1 HE1 PHE 1 6.994 -12.486 4.476
9 HZ PHE 1 HZ PHE 1 5.267 -14.210 4.139
10 H PHE 2 H PHE 2 8.833 -10.234 -0.359
11 HA PHE 2 HA PHE 2 6.588 -9.391 1.021
12 HB2 PHE 2 1HB PHE 2 8.631 -7.764 -0.487
13 HB3 PHE 2 2HB PHE 2 7.402 -7.053 0.551
14 HD1 PHE 2 HD2 PHE 2 7.327 -8.723 2.872
15 HD2 PHE 2 HD1 PHE 2 10.680 -7.561 0.522
16 HE1 PHE 2 HE2 PHE 2 8.795 -9.041 4.819
17 HE2 PHE 2 HE1 PHE 2 12.154 -7.877 2.465
18 HZ PHE 2 HZ PHE 2 11.211 -8.617 4.617
19 H ASP 3 H ASP 3 7.389 -8.482 -2.368
20 HA ASP 3 HA ASP 3 4.669 -7.520 -2.594
21 HB2 ASP 3 1HB ASP 3 5.249 -6.594 -4.729
22 HB3 ASP 3 2HB ASP 3 6.435 -6.117 -3.526
23 H GLU 4 H GLU 4 5.961 -10.453 -2.855
24 HA GLU 4 HA GLU 4 4.354 -11.418 -5.035
25 HB2 GLU 4 1HB GLU 4 6.261 -12.744 -4.176
26 HB3 GLU 4 2HB GLU 4 5.435 -12.918 -2.633
27 HG2 GLU 4 1HG GLU 4 3.603 -14.098 -3.779
28 HG3 GLU 4 2HG GLU 4 4.504 -13.982 -5.290
29 H LYS 5 H LYS 5 4.109 -11.191 -1.532
30 HA LYS 5 HA LYS 5 1.427 -12.012 -1.277
31 HB2 LYS 5 1HB LYS 5 3.175 -11.654 0.562
32 HB3 LYS 5 2HB LYS 5 2.797 -9.944 0.440
33 HG2 LYS 5 1HG LYS 5 1.591 -10.927 2.280
34 HG3 LYS 5 2HG LYS 5 0.459 -10.437 1.018
35 HD2 LYS 5 1HD LYS 5 0.092 -12.651 0.330
36 HD3 LYS 5 2HD LYS 5 1.524 -13.241 1.175
37 HE2 LYS 5 1HE LYS 5 -0.502 -13.892 2.353
38 HE3 LYS 5 2HE LYS 5 0.450 -12.775 3.321
39 HZ1 LYS 5 3HZ LYS 5 -1.936 -12.048 1.712
40 HZ2 LYS 5 1HZ LYS 5 -1.034 -10.992 2.677
41 HZ3 LYS 5 2HZ LYS 5 -1.909 -12.251 3.386
42 H CYS 6 H CYS 6 2.982 -8.948 -2.032
43 HA CYS 6 HA CYS 6 0.724 -7.283 -1.972
44 HB2 CYS 6 1HB CYS 6 3.135 -6.560 -2.149
45 HB3 CYS 6 2HB CYS 6 3.107 -7.064 -3.834
46 HG CYS 6 HG CYS 6 1.205 -5.175 -4.609
47 H ASN 7 H ASN 7 2.064 -9.355 -4.492
48 HA ASN 7 HA ASN 7 0.316 -8.593 -6.581
49 HB2 ASN 7 1HB ASN 7 2.483 -9.857 -6.819
50 HB3 ASN 7 2HB ASN 7 1.651 -11.279 -6.213
51 HD21 ASN 7 1HD2 ASN 7 0.290 -12.405 -7.544
52 HD22 ASN 7 2HD2 ASN 7 0.091 -12.043 -9.224
53 H LYS 8 H LYS 8 0.198 -11.100 -4.123
54 HA LYS 8 HA LYS 8 -2.076 -12.471 -4.916
55 HB2 LYS 8 1HB LYS 8 -0.987 -11.892 -2.162
56 HB3 LYS 8 2HB LYS 8 -2.264 -13.040 -2.492
57 HG2 LYS 8 1HG LYS 8 0.513 -13.203 -3.620
58 HG3 LYS 8 2HG LYS 8 -0.069 -14.107 -2.221
59 HD2 LYS 8 1HD LYS 8 -1.726 -15.222 -3.599
60 HD3 LYS 8 2HD LYS 8 -1.234 -14.270 -4.997
61 HE2 LYS 8 1HE LYS 8 -0.256 -16.475 -5.119
62 HE3 LYS 8 2HE LYS 8 1.005 -15.270 -4.870
63 HZ1 LYS 8 3HZ LYS 8 1.295 -17.257 -3.490
64 HZ2 LYS 8 1HZ LYS 8 -0.181 -16.944 -2.725
65 HZ3 LYS 8 2HZ LYS 8 1.105 -15.861 -2.555
66 H LEU 9 H LEU 9 -1.764 -9.506 -3.016
67 HA LEU 9 HA LEU 9 -4.650 -9.338 -2.691
68 HB2 LEU 9 1HB LEU 9 -2.358 -7.684 -1.672
69 HB3 LEU 9 2HB LEU 9 -4.011 -7.132 -1.535
70 HG LEU 9 HG LEU 9 -3.418 -8.085 0.554
71 HD11 LEU 9 1HD1 LEU 9 -5.021 -9.871 0.809
72 HD12 LEU 9 2HD1 LEU 9 -5.045 -10.134 -0.933
73 HD13 LEU 9 3HD1 LEU 9 -5.666 -8.625 -0.261
74 HD21 LEU 9 3HD2 LEU 9 -1.484 -9.383 -0.234
75 HD22 LEU 9 1HD2 LEU 9 -2.588 -10.590 -0.894
76 HD23 LEU 9 2HD2 LEU 9 -2.531 -10.305 0.846
77 H LYS 10 H LYS 10 -2.475 -8.545 -5.035
78 HA LYS 10 HA LYS 10 -2.517 -7.283 -6.901
79 HB2 LYS 10 1HB LYS 10 -5.416 -7.220 -6.156
80 HB3 LYS 10 2HB LYS 10 -4.833 -6.217 -7.474
81 HG2 LYS 10 1HG LYS 10 -5.623 -8.189 -8.468
82 HG3 LYS 10 2HG LYS 10 -3.865 -8.313 -8.482
83 HD2 LYS 10 1HD LYS 10 -4.762 -10.435 -7.840
84 HD3 LYS 10 2HD LYS 10 -4.012 -9.704 -6.422
85 HE2 LYS 10 1HE LYS 10 -6.166 -9.044 -5.566
86 HE3 LYS 10 2HE LYS 10 -6.963 -9.601 -7.037
87 HZ1 LYS 10 3HZ LYS 10 -6.284 -11.854 -6.515
88 HZ2 LYS 10 1HZ LYS 10 -7.179 -11.198 -5.239
89 HZ3 LYS 10 2HZ LYS 10 -5.498 -11.324 -5.111
90 H GLY 11 H GLY 11 -1.868 -6.124 -4.308
91 HA2 GLY 11 1HA GLY 11 -2.651 -3.321 -4.689
92 HA3 GLY 11 2HA GLY 11 -1.867 -3.988 -3.261
93 H THR 12 H THR 12 -0.506 -1.995 -3.687
94 HA THR 12 HA THR 12 1.863 -2.878 -5.096
95 HB THR 12 HB THR 12 0.657 -1.687 -6.846
96 HG1 THR 12 HG1 THR 12 2.502 -0.944 -7.503
97 HG21 THR 12 1HG2 THR 12 -0.654 -0.168 -5.456
98 HG22 THR 12 2HG2 THR 12 0.248 0.718 -6.685
99 HG23 THR 12 3HG2 THR 12 0.816 0.698 -5.014
100 H CYS 13 H CYS 13 3.731 -1.651 -4.590
101 HA CYS 13 HA CYS 13 3.683 -0.830 -1.826
102 HB2 CYS 13 1HB CYS 13 6.069 -0.704 -3.673
103 HB3 CYS 13 2HB CYS 13 6.059 -0.800 -1.920
104 HG CYS 13 HG CYS 13 4.929 -3.332 -3.924
105 H LYS 14 H LYS 14 2.826 1.073 -1.458
106 HA LYS 14 HA LYS 14 4.001 3.413 -2.789
107 HB2 LYS 14 1HB LYS 14 1.766 4.531 -2.599
108 HB3 LYS 14 2HB LYS 14 1.800 3.197 -3.744
109 HG2 LYS 14 1HG LYS 14 0.720 1.746 -2.146
110 HG3 LYS 14 2HG LYS 14 0.773 3.013 -0.921
111 HD2 LYS 14 1HD LYS 14 -1.444 2.878 -1.895
112 HD3 LYS 14 2HD LYS 14 -0.680 4.412 -2.318
113 HE2 LYS 14 1HE LYS 14 -0.190 3.631 -4.529
114 HE3 LYS 14 2HE LYS 14 -0.697 1.993 -4.119
115 HZ1 LYS 14 3HZ LYS 14 -2.954 2.784 -3.834
116 HZ2 LYS 14 1HZ LYS 14 -2.389 3.176 -5.380
117 HZ3 LYS 14 2HZ LYS 14 -2.476 4.369 -4.193
118 H ASN 15 H ASN 15 3.500 5.444 -1.367
119 HA ASN 15 HA ASN 15 4.354 4.727 1.296
120 HB2 ASN 15 1HB ASN 15 4.070 7.363 -0.137
121 HB3 ASN 15 2HB ASN 15 4.516 7.246 1.555
122 HD21 ASN 15 1HD2 ASN 15 6.511 6.260 2.100
123 HD22 ASN 15 2HD2 ASN 15 7.792 6.167 0.942
124 H ASN 16 H ASN 16 1.766 6.682 -0.148
125 HA ASN 16 HA ASN 16 0.259 6.486 2.370
126 HB2 ASN 16 1HB ASN 16 -0.037 8.387 0.031
127 HB3 ASN 16 2HB ASN 16 -1.080 8.374 1.449
128 HD21 ASN 16 1HD2 ASN 16 2.142 8.999 0.272
129 HD22 ASN 16 2HD2 ASN 16 2.644 9.983 1.606
130 H CYS 17 H CYS 17 -1.625 5.395 2.440
131 HA CYS 17 HA CYS 17 -2.350 3.728 0.246
132 HB2 CYS 17 1HB CYS 17 -3.971 4.316 2.728
133 HB3 CYS 17 2HB CYS 17 -4.114 2.915 1.677
134 HG CYS 17 HG CYS 17 -1.136 2.572 2.431
135 H GLY 18 H GLY 18 -3.892 3.981 -1.261
136 HA2 GLY 18 1HA GLY 18 -5.036 6.640 -1.527
137 HA3 GLY 18 2HA GLY 18 -4.995 5.391 -2.760
138 H LYS 19 H LYS 19 -7.191 5.944 -3.162
139 HA LYS 19 HA LYS 19 -9.304 5.817 -1.398
140 HB2 LYS 19 1HB LYS 19 -10.609 5.040 -3.524
141 HB3 LYS 19 2HB LYS 19 -9.896 6.643 -3.467
142 HG2 LYS 19 1HG LYS 19 -9.375 5.846 -5.594
143 HG3 LYS 19 2HG LYS 19 -7.895 5.607 -4.672
144 HD2 LYS 19 1HD LYS 19 -8.727 3.234 -4.264
145 HD3 LYS 19 2HD LYS 19 -9.918 3.557 -5.526
146 HE2 LYS 19 1HE LYS 19 -7.981 2.431 -6.454
147 HE3 LYS 19 2HE LYS 19 -8.104 4.068 -7.092
148 HZ1 LYS 19 3HZ LYS 19 -5.828 3.447 -6.463
149 HZ2 LYS 19 1HZ LYS 19 -6.316 3.258 -4.854
150 HZ3 LYS 19 2HZ LYS 19 -6.385 4.781 -5.591
151 H ASN 20 H ASN 20 -10.191 4.306 -0.221
152 HA ASN 20 HA ASN 20 -10.830 2.304 0.631
153 HB2 ASN 20 1HB ASN 20 -10.668 1.565 -2.287
154 HB3 ASN 20 2HB ASN 20 -11.182 0.418 -1.056
155 HD21 ASN 20 1HD2 ASN 20 -13.211 0.241 -1.989
156 HD22 ASN 20 2HD2 ASN 20 -14.400 1.491 -1.856
157 H GLU 21 H GLU 21 -7.879 2.955 0.222
158 HA GLU 21 HA GLU 21 -6.847 0.206 0.223
159 HB2 GLU 21 1HB GLU 21 -5.505 2.840 -0.371
160 HB3 GLU 21 2HB GLU 21 -4.625 1.330 -0.192
161 HG2 GLU 21 1HG GLU 21 -5.785 0.379 -2.078
162 HG3 GLU 21 2HG GLU 21 -6.805 1.811 -2.209
163 H GLU 22 H GLU 22 -5.778 -0.598 1.916
164 HA GLU 22 HA GLU 22 -5.039 1.238 4.082
165 HB2 GLU 22 1HB GLU 22 -5.556 -0.759 5.628
166 HB3 GLU 22 2HB GLU 22 -6.889 0.222 5.048
167 HG2 GLU 22 1HG GLU 22 -7.454 -1.449 3.409
168 HG3 GLU 22 2HG GLU 22 -6.046 -2.411 3.855
169 H LEU 23 H LEU 23 -3.385 0.330 5.535
170 HA LEU 23 HA LEU 23 -1.186 -0.574 3.934
171 HB2 LEU 23 1HB LEU 23 -1.415 1.035 6.112
172 HB3 LEU 23 2HB LEU 23 -0.900 -0.455 6.873
173 HG LEU 23 HG LEU 23 1.161 -0.469 5.622
174 HD11 LEU 23 1HD1 LEU 23 0.547 0.243 3.487
175 HD12 LEU 23 2HD1 LEU 23 1.605 1.520 4.099
176 HD13 LEU 23 3HD1 LEU 23 -0.144 1.752 4.092
177 HD21 LEU 23 3HD2 LEU 23 0.557 2.296 6.658
178 HD22 LEU 23 1HD2 LEU 23 2.164 1.625 6.382
179 HD23 LEU 23 2HD2 LEU 23 1.116 0.927 7.616
180 H ILE 24 H ILE 24 -0.559 -2.619 3.651
181 HA ILE 24 HA ILE 24 -1.754 -4.644 5.416
182 HB ILE 24 HB ILE 24 -2.163 -6.027 3.632
183 HG12 ILE 24 1HG1 ILE 24 -0.593 -4.875 1.488
184 HG13 ILE 24 2HG1 ILE 24 0.432 -5.327 2.846
185 HG21 ILE 24 1HG2 ILE 24 -2.882 -4.627 1.676
186 HG22 ILE 24 2HG2 ILE 24 -2.179 -3.242 2.505
187 HG23 ILE 24 3HG2 ILE 24 -3.515 -4.123 3.240
188 HD11 ILE 24 3HD1 ILE 24 -1.498 -7.122 1.403
189 HD12 ILE 24 1HD1 ILE 24 -0.505 -7.580 2.788
190 HD13 ILE 24 2HD1 ILE 24 0.261 -7.139 1.260
191 H ALA 25 H ALA 25 1.233 -3.473 4.029
192 HA ALA 25 HA ALA 25 2.746 -5.274 5.704
193 HB1 ALA 25 3HB ALA 25 2.238 -6.716 3.766
194 HB2 ALA 25 1HB ALA 25 3.963 -6.395 3.939
195 HB3 ALA 25 2HB ALA 25 3.028 -5.544 2.712
196 H LEU 26 H LEU 26 4.968 -4.892 5.682
197 HA LEU 26 HA LEU 26 5.635 -2.126 5.012
198 HB2 LEU 26 1HB LEU 26 6.839 -4.166 6.868
199 HB3 LEU 26 2HB LEU 26 7.573 -2.598 6.567
200 HG LEU 26 HG LEU 26 4.837 -3.047 7.772
201 HD11 LEU 26 1HD1 LEU 26 5.872 -2.273 9.853
202 HD12 LEU 26 2HD1 LEU 26 7.442 -2.241 9.054
203 HD13 LEU 26 3HD1 LEU 26 6.597 -3.773 9.275
204 HD21 LEU 26 3HD2 LEU 26 4.929 -0.952 6.578
205 HD22 LEU 26 1HD2 LEU 26 6.455 -0.536 7.357
206 HD23 LEU 26 2HD2 LEU 26 4.977 -0.641 8.312
207 H CYS 27 H CYS 27 6.669 -1.857 3.153
208 HA CYS 27 HA CYS 27 8.124 -4.104 1.986
209 HB2 CYS 27 1HB CYS 27 7.115 -1.514 0.798
210 HB3 CYS 27 2HB CYS 27 7.991 -2.739 -0.109
211 HG CYS 27 HG CYS 27 5.672 -3.563 -0.943
212 H GLN 28 H GLN 28 10.105 -3.533 0.723
213 HA GLN 28 HA GLN 28 11.903 -2.024 2.382
214 HB2 GLN 28 1HB GLN 28 12.381 -3.409 -0.250
215 HB3 GLN 28 2HB GLN 28 13.629 -2.745 0.788
216 HG2 GLN 28 1HG GLN 28 11.749 -4.976 1.528
217 HG3 GLN 28 2HG GLN 28 13.430 -5.167 1.035
218 HE21 GLN 28 1HE2 GLN 28 15.061 -4.622 2.455
219 HE22 GLN 28 2HE2 GLN 28 14.776 -4.308 4.132
220 H LYS 29 H LYS 29 13.530 -0.577 1.112
221 HA LYS 29 HA LYS 29 13.877 1.475 0.183
222 HB2 LYS 29 1HB LYS 29 11.463 0.775 -1.492
223 HB3 LYS 29 2HB LYS 29 12.501 2.166 -1.768
224 HG2 LYS 29 1HG LYS 29 14.368 0.730 -2.278
225 HG3 LYS 29 2HG LYS 29 13.423 -0.700 -1.859
226 HD2 LYS 29 1HD LYS 29 12.707 1.217 -4.075
227 HD3 LYS 29 2HD LYS 29 13.613 -0.277 -4.312
228 HE2 LYS 29 1HE LYS 29 10.826 -0.084 -3.163
229 HE3 LYS 29 2HE LYS 29 11.220 -0.540 -4.819
230 HZ1 LYS 29 3HZ LYS 29 10.813 -2.479 -3.451
231 HZ2 LYS 29 1HZ LYS 29 12.038 -2.023 -2.382
232 HZ3 LYS 29 2HZ LYS 29 12.422 -2.457 -3.967
233 H SER 30 H SER 30 11.682 0.727 2.235
234 HA SER 30 HA SER 30 10.577 1.867 3.833
235 HB2 SER 30 1HB SER 30 11.228 4.372 2.275
236 HB3 SER 30 2HB SER 30 10.624 4.300 3.931
237 HG SER 30 HG SER 30 12.756 2.718 3.757
238 H LEU 31 H LEU 31 9.564 1.372 0.807
239 HA LEU 31 HA LEU 31 7.065 2.758 0.866
240 HB2 LEU 31 1HB LEU 31 8.187 0.487 -0.761
241 HB3 LEU 31 2HB LEU 31 6.500 0.927 -0.875
242 HG LEU 31 HG LEU 31 7.928 1.883 -2.652
243 HD11 LEU 31 1HD1 LEU 31 6.979 4.141 -2.537
244 HD12 LEU 31 2HD1 LEU 31 6.572 3.873 -0.840
245 HD13 LEU 31 3HD1 LEU 31 5.805 2.903 -2.097
246 HD21 LEU 31 3HD2 LEU 31 9.354 3.792 -2.166
247 HD22 LEU 31 1HD2 LEU 31 9.943 2.327 -1.382
248 HD23 LEU 31 2HD2 LEU 31 9.090 3.548 -0.439
249 H LYS 32 H LYS 32 4.976 1.511 0.852
250 HA LYS 32 HA LYS 32 5.067 -0.881 2.561
251 HB2 LYS 32 1HB LYS 32 3.275 1.520 2.870
252 HB3 LYS 32 2HB LYS 32 2.846 -0.053 3.522
253 HG2 LYS 32 1HG LYS 32 3.771 0.993 5.336
254 HG3 LYS 32 2HG LYS 32 5.145 0.086 4.697
255 HD2 LYS 32 1HD LYS 32 5.863 2.133 3.476
256 HD3 LYS 32 2HD LYS 32 4.567 3.017 4.284
257 HE2 LYS 32 1HE LYS 32 5.549 2.549 6.442
258 HE3 LYS 32 2HE LYS 32 6.800 1.559 5.690
259 HZ1 LYS 32 3HZ LYS 32 6.420 4.482 5.344
260 HZ2 LYS 32 1HZ LYS 32 7.561 3.554 4.506
261 HZ3 LYS 32 2HZ LYS 32 7.671 3.717 6.186
262 H CYS 33 H CYS 33 3.157 -2.249 2.334
263 HA CYS 33 HA CYS 33 2.230 -2.168 -0.433
264 HB2 CYS 33 1HB CYS 33 3.169 -4.279 0.521
265 HB3 CYS 33 2HB CYS 33 1.821 -4.320 1.651
266 HG CYS 33 HG CYS 33 1.559 -4.534 -1.752
267 H CYS 34 H CYS 34 0.405 -1.141 -0.834
268 HA CYS 34 HA CYS 34 -1.709 -1.193 1.213
269 HB2 CYS 34 1HB CYS 34 -1.357 0.739 -1.094
270 HB3 CYS 34 2HB CYS 34 -2.603 0.820 0.147
271 HG CYS 34 HG CYS 34 0.645 0.907 1.126
272 H ARG 35 H ARG 35 -3.610 -2.171 0.727
273 HA ARG 35 HA ARG 35 -3.913 -3.103 -2.051
274 HB2 ARG 35 1HB ARG 35 -4.788 -5.147 -1.353
275 HB3 ARG 35 2HB ARG 35 -3.471 -4.863 -0.233
276 HG2 ARG 35 1HG ARG 35 -5.305 -3.896 1.316
277 HG3 ARG 35 2HG ARG 35 -6.420 -4.761 0.254
278 HD2 ARG 35 1HD ARG 35 -4.846 -6.777 0.647
279 HD3 ARG 35 2HD ARG 35 -4.255 -5.855 2.014
280 HE ARG 35 HE ARG 35 -6.721 -7.279 1.830
281 HH11 ARG 35 1HH1 ARG 35 -5.230 -4.494 3.335
282 HH12 ARG 35 2HH1 ARG 35 -6.188 -4.594 4.778
283 HH21 ARG 35 1HH2 ARG 35 -7.927 -7.466 3.739
284 HH22 ARG 35 2HH2 ARG 35 -7.719 -6.302 5.011
285 H THR 36 H THR 36 -5.874 -2.954 -3.023
286 HA THR 36 HA THR 36 -7.605 -0.903 -1.969
287 HB THR 36 HB THR 36 -8.052 -2.450 -4.520
288 HG1 THR 36 HG1 THR 36 -5.913 -0.930 -3.890
289 HG21 THR 36 1HG2 THR 36 -9.839 -0.941 -3.811
290 HG22 THR 36 2HG2 THR 36 -9.045 -0.326 -5.261
291 HG23 THR 36 3HG2 THR 36 -8.684 0.385 -3.688
292 H ILE 37 H ILE 37 -9.108 -1.422 -0.564
293 HA ILE 37 HA ILE 37 -10.210 -3.962 -0.116
294 HB ILE 37 HB ILE 37 -11.126 -1.198 0.632
295 HG12 ILE 37 1HG1 ILE 37 -8.943 -2.547 1.387
296 HG13 ILE 37 2HG1 ILE 37 -9.813 -1.467 2.479
297 HG21 ILE 37 1HG2 ILE 37 -13.075 -2.658 0.630
298 HG22 ILE 37 2HG2 ILE 37 -12.591 -2.282 2.284
299 HG23 ILE 37 3HG2 ILE 37 -12.199 -3.852 1.588
300 HD11 ILE 37 3HD1 ILE 37 -9.138 -3.714 3.376
301 HD12 ILE 37 1HD1 ILE 37 -10.342 -4.401 2.282
302 HD13 ILE 37 2HD1 ILE 37 -10.844 -3.291 3.560
303 H GLN 38 H GLN 38 -11.402 -5.038 -1.499
304 HA GLN 38 HA GLN 38 -13.333 -3.570 -3.158
305 HB2 GLN 38 1HB GLN 38 -11.935 -6.193 -3.690
306 HB3 GLN 38 2HB GLN 38 -13.190 -5.510 -4.715
307 HG2 GLN 38 1HG GLN 38 -11.790 -3.554 -5.127
308 HG3 GLN 38 2HG GLN 38 -10.529 -4.243 -4.105
309 HE21 GLN 38 1HE2 GLN 38 -12.208 -4.468 -7.131
310 HE22 GLN 38 2HE2 GLN 38 -11.075 -5.510 -7.915
311 HA PRO 39 HA PRO 39 -16.435 -5.652 -0.735
312 HB2 PRO 39 1HB PRO 39 -18.276 -4.845 -2.876
313 HB3 PRO 39 2HB PRO 39 -18.276 -4.400 -1.169
314 HG2 PRO 39 1HG PRO 39 -17.613 -2.640 -3.079
315 HG3 PRO 39 2HG PRO 39 -16.827 -2.634 -1.489
316 HD2 PRO 39 1HD PRO 39 -15.829 -3.732 -4.093
317 HD3 PRO 39 2HD PRO 39 -14.961 -2.806 -2.848
318 H SER 40 H SER 40 -16.600 -7.784 -0.766
319 HA SER 40 HA SER 40 -17.895 -9.101 -2.994
320 HB2 SER 40 1HB SER 40 -15.141 -9.959 -2.062
321 HB3 SER 40 2HB SER 40 -16.143 -10.823 -3.226
322 HG SER 40 HG SER 40 -15.958 -8.300 -4.022
323 H GLY 41 H GLY 41 -17.323 -11.758 -2.112
324 HA2 GLY 41 1HA GLY 41 -19.155 -12.070 -0.004
325 HA3 GLY 41 2HA GLY 41 -18.041 -13.301 -0.573
326 H SER 42 H SER 42 -18.966 -11.777 2.098
327 HA SER 42 HA SER 42 -18.096 -11.378 4.158
328 HB2 SER 42 1HB SER 42 -17.059 -13.695 3.683
329 HB3 SER 42 2HB SER 42 -15.576 -12.813 3.304
330 HG SER 42 HG SER 42 -16.992 -12.739 5.768
331 H ILE 43 H ILE 43 -15.159 -11.136 4.600
332 HA ILE 43 HA ILE 43 -14.827 -8.374 3.856
333 HB ILE 43 HB ILE 43 -12.553 -8.713 4.958
334 HG12 ILE 43 1HG1 ILE 43 -13.747 -11.248 6.039
335 HG13 ILE 43 2HG1 ILE 43 -12.803 -11.289 4.553
336 HG21 ILE 43 1HG2 ILE 43 -15.047 -9.294 6.554
337 HG22 ILE 43 2HG2 ILE 43 -14.431 -7.700 6.124
338 HG23 ILE 43 3HG2 ILE 43 -13.514 -8.732 7.220
339 HD11 ILE 43 3HD1 ILE 43 -11.861 -10.337 7.255
340 HD12 ILE 43 1HD1 ILE 43 -10.900 -10.328 5.777
341 HD13 ILE 43 2HD1 ILE 43 -11.436 -11.857 6.470
342 H ILE 44 H ILE 44 -12.432 -7.857 3.151
343 HA ILE 44 HA ILE 44 -11.988 -9.008 0.569
344 HB ILE 44 HB ILE 44 -11.496 -6.679 0.862
345 HG12 ILE 44 1HG1 ILE 44 -8.824 -8.090 0.712
346 HG13 ILE 44 2HG1 ILE 44 -9.954 -7.972 -0.633
347 HG21 ILE 44 1HG2 ILE 44 -9.578 -6.020 2.396
348 HG22 ILE 44 2HG2 ILE 44 -9.791 -7.605 3.143
349 HG23 ILE 44 3HG2 ILE 44 -11.117 -6.441 3.148
350 HD11 ILE 44 3HD1 ILE 44 -8.027 -6.310 -0.558
351 HD12 ILE 44 1HD1 ILE 44 -8.900 -5.520 0.761
352 HD13 ILE 44 2HD1 ILE 44 -9.642 -5.664 -0.837
353 H ASP 45 H ASP 45 -10.796 -10.758 0.113
354 HA ASP 45 HA ASP 45 -9.257 -11.965 2.285
355 HB2 ASP 45 1HB ASP 45 -9.346 -14.041 1.006
356 HB3 ASP 45 2HB ASP 45 -10.962 -13.381 1.207
Start of MODEL 11
1 H PHE 1 1H PHE 1 10.706 -10.567 -1.248
2 HA PHE 1 HA PHE 1 8.899 -12.753 -0.417
3 HB2 PHE 1 1HB PHE 1 10.959 -12.717 0.901
4 HB3 PHE 1 2HB PHE 1 10.755 -10.995 1.206
5 HD1 PHE 1 HD1 PHE 1 9.355 -14.340 1.887
6 HD2 PHE 1 HD2 PHE 1 9.350 -10.217 2.942
7 HE1 PHE 1 HE1 PHE 1 8.054 -14.862 3.909
8 HE2 PHE 1 HE2 PHE 1 8.049 -10.732 4.964
9 HZ PHE 1 HZ PHE 1 7.400 -13.057 5.449
10 H PHE 2 H PHE 2 9.667 -9.280 -0.067
11 HA PHE 2 HA PHE 2 7.339 -8.670 1.368
12 HB2 PHE 2 1HB PHE 2 9.187 -6.910 -0.238
13 HB3 PHE 2 2HB PHE 2 7.876 -6.287 0.759
14 HD1 PHE 2 HD1 PHE 2 7.955 -6.516 3.194
15 HD2 PHE 2 HD2 PHE 2 11.204 -7.738 0.742
16 HE1 PHE 2 HE1 PHE 2 9.417 -6.575 5.171
17 HE2 PHE 2 HE2 PHE 2 12.672 -7.806 2.714
18 HZ PHE 2 HZ PHE 2 11.780 -7.222 4.932
19 H ASP 3 H ASP 3 8.028 -8.349 -2.123
20 HA ASP 3 HA ASP 3 5.268 -7.537 -2.489
21 HB2 ASP 3 1HB ASP 3 5.770 -7.083 -4.785
22 HB3 ASP 3 2HB ASP 3 6.978 -6.327 -3.760
23 H GLU 4 H GLU 4 6.810 -10.397 -2.229
24 HA GLU 4 HA GLU 4 5.300 -11.974 -4.045
25 HB2 GLU 4 1HB GLU 4 7.260 -12.815 -2.704
26 HB3 GLU 4 2HB GLU 4 6.261 -12.729 -1.265
27 HG2 GLU 4 1HG GLU 4 5.529 -14.419 -3.636
28 HG3 GLU 4 2HG GLU 4 6.556 -15.004 -2.331
29 H LYS 5 H LYS 5 4.870 -10.880 -0.738
30 HA LYS 5 HA LYS 5 2.208 -11.735 -0.399
31 HB2 LYS 5 1HB LYS 5 3.785 -11.008 1.413
32 HB3 LYS 5 2HB LYS 5 3.567 -9.354 0.865
33 HG2 LYS 5 1HG LYS 5 2.187 -9.770 2.794
34 HG3 LYS 5 2HG LYS 5 1.169 -9.518 1.375
35 HD2 LYS 5 1HD LYS 5 0.769 -11.872 1.163
36 HD3 LYS 5 2HD LYS 5 1.954 -12.236 2.419
37 HE2 LYS 5 1HE LYS 5 0.566 -11.103 4.071
38 HE3 LYS 5 2HE LYS 5 -0.604 -10.688 2.821
39 HZ1 LYS 5 3HZ LYS 5 -1.280 -12.621 4.118
40 HZ2 LYS 5 1HZ LYS 5 0.114 -13.451 3.638
41 HZ3 LYS 5 2HZ LYS 5 -1.054 -13.023 2.492
42 H CYS 6 H CYS 6 3.640 -8.702 -1.576
43 HA CYS 6 HA CYS 6 1.290 -7.202 -1.773
44 HB2 CYS 6 1HB CYS 6 3.779 -6.482 -2.084
45 HB3 CYS 6 2HB CYS 6 3.552 -6.952 -3.760
46 HG CYS 6 HG CYS 6 1.580 -5.091 -4.305
47 H ASN 7 H ASN 7 2.903 -9.203 -4.218
48 HA ASN 7 HA ASN 7 1.146 -8.843 -6.359
49 HB2 ASN 7 1HB ASN 7 3.419 -10.019 -6.293
50 HB3 ASN 7 2HB ASN 7 2.562 -11.429 -5.696
51 HD21 ASN 7 1HD2 ASN 7 4.101 -11.101 -8.109
52 HD22 ASN 7 2HD2 ASN 7 3.043 -11.469 -9.426
53 H LYS 8 H LYS 8 1.087 -11.070 -3.665
54 HA LYS 8 HA LYS 8 -0.991 -12.737 -4.598
55 HB2 LYS 8 1HB LYS 8 0.785 -13.198 -2.832
56 HB3 LYS 8 2HB LYS 8 -0.234 -12.298 -1.720
57 HG2 LYS 8 1HG LYS 8 -1.738 -13.963 -1.536
58 HG3 LYS 8 2HG LYS 8 -1.553 -14.466 -3.219
59 HD2 LYS 8 1HD LYS 8 -0.705 -16.171 -1.681
60 HD3 LYS 8 2HD LYS 8 0.582 -15.507 -2.689
61 HE2 LYS 8 1HE LYS 8 1.092 -13.941 -0.765
62 HE3 LYS 8 2HE LYS 8 0.007 -14.932 0.208
63 HZ1 LYS 8 3HZ LYS 8 2.201 -15.712 0.553
64 HZ2 LYS 8 1HZ LYS 8 2.530 -15.777 -1.107
65 HZ3 LYS 8 2HZ LYS 8 1.430 -16.864 -0.411
66 H LEU 9 H LEU 9 -0.999 -9.707 -2.847
67 HA LEU 9 HA LEU 9 -3.880 -9.936 -2.378
68 HB2 LEU 9 1HB LEU 9 -1.801 -7.994 -1.420
69 HB3 LEU 9 2HB LEU 9 -3.506 -7.620 -1.307
70 HG LEU 9 HG LEU 9 -2.824 -8.429 0.812
71 HD11 LEU 9 1HD1 LEU 9 -4.996 -9.242 0.013
72 HD12 LEU 9 2HD1 LEU 9 -4.225 -10.361 1.137
73 HD13 LEU 9 3HD1 LEU 9 -4.211 -10.699 -0.593
74 HD21 LEU 9 3HD2 LEU 9 -1.721 -10.866 -0.563
75 HD22 LEU 9 1HD2 LEU 9 -1.698 -10.528 1.168
76 HD23 LEU 9 2HD2 LEU 9 -0.757 -9.522 0.059
77 H LYS 10 H LYS 10 -1.855 -8.941 -4.768
78 HA LYS 10 HA LYS 10 -2.110 -7.747 -6.674
79 HB2 LYS 10 1HB LYS 10 -5.007 -7.682 -5.812
80 HB3 LYS 10 2HB LYS 10 -4.438 -6.992 -7.322
81 HG2 LYS 10 1HG LYS 10 -5.286 -9.095 -7.884
82 HG3 LYS 10 2HG LYS 10 -3.536 -9.300 -7.867
83 HD2 LYS 10 1HD LYS 10 -3.676 -10.269 -5.624
84 HD3 LYS 10 2HD LYS 10 -5.427 -10.058 -5.641
85 HE2 LYS 10 1HE LYS 10 -3.834 -11.768 -7.543
86 HE3 LYS 10 2HE LYS 10 -4.785 -12.357 -6.183
87 HZ1 LYS 10 3HZ LYS 10 -6.768 -11.441 -7.244
88 HZ2 LYS 10 1HZ LYS 10 -6.005 -12.578 -8.238
89 HZ3 LYS 10 2HZ LYS 10 -5.844 -10.928 -8.562
90 H GLY 11 H GLY 11 -1.461 -6.541 -4.113
91 HA2 GLY 11 1HA GLY 11 -2.573 -3.841 -4.368
92 HA3 GLY 11 2HA GLY 11 -1.673 -4.460 -2.989
93 H THR 12 H THR 12 -0.800 -2.147 -3.641
94 HA THR 12 HA THR 12 1.580 -2.618 -5.319
95 HB THR 12 HB THR 12 0.299 0.087 -5.029
96 HG1 THR 12 HG1 THR 12 -0.432 -2.057 -6.717
97 HG21 THR 12 1HG2 THR 12 1.446 0.515 -7.158
98 HG22 THR 12 2HG2 THR 12 2.070 -1.133 -7.149
99 HG23 THR 12 3HG2 THR 12 2.579 0.008 -5.905
100 H CYS 13 H CYS 13 3.513 -1.656 -4.581
101 HA CYS 13 HA CYS 13 3.524 -0.971 -1.756
102 HB2 CYS 13 1HB CYS 13 5.937 -0.923 -3.574
103 HB3 CYS 13 2HB CYS 13 5.882 -1.133 -1.834
104 HG CYS 13 HG CYS 13 4.159 -3.580 -3.088
105 H LYS 14 H LYS 14 2.731 1.011 -1.437
106 HA LYS 14 HA LYS 14 3.952 3.212 -2.956
107 HB2 LYS 14 1HB LYS 14 1.803 4.438 -2.737
108 HB3 LYS 14 2HB LYS 14 1.670 2.985 -3.718
109 HG2 LYS 14 1HG LYS 14 0.674 1.792 -1.853
110 HG3 LYS 14 2HG LYS 14 0.854 3.217 -0.829
111 HD2 LYS 14 1HD LYS 14 -1.423 3.075 -1.621
112 HD3 LYS 14 2HD LYS 14 -0.629 4.465 -2.361
113 HE2 LYS 14 1HE LYS 14 -0.262 3.169 -4.401
114 HE3 LYS 14 2HE LYS 14 -1.039 1.771 -3.658
115 HZ1 LYS 14 3HZ LYS 14 -2.334 4.382 -4.213
116 HZ2 LYS 14 1HZ LYS 14 -3.087 3.052 -3.484
117 HZ3 LYS 14 2HZ LYS 14 -2.564 2.961 -5.092
118 H ASN 15 H ASN 15 3.548 5.364 -1.704
119 HA ASN 15 HA ASN 15 4.595 4.902 0.954
120 HB2 ASN 15 1HB ASN 15 4.351 7.327 -0.804
121 HB3 ASN 15 2HB ASN 15 4.766 7.473 0.895
122 HD21 ASN 15 1HD2 ASN 15 5.819 6.467 -2.234
123 HD22 ASN 15 2HD2 ASN 15 7.473 6.196 -1.819
124 H ASN 16 H ASN 16 1.962 6.789 -0.530
125 HA ASN 16 HA ASN 16 0.565 6.698 2.063
126 HB2 ASN 16 1HB ASN 16 -0.643 8.739 1.291
127 HB3 ASN 16 2HB ASN 16 1.089 8.980 1.466
128 HD21 ASN 16 1HD2 ASN 16 2.374 9.112 -0.412
129 HD22 ASN 16 2HD2 ASN 16 1.686 9.585 -1.927
130 H CYS 17 H CYS 17 -1.339 5.688 2.170
131 HA CYS 17 HA CYS 17 -2.272 4.197 -0.087
132 HB2 CYS 17 1HB CYS 17 -3.758 4.543 2.512
133 HB3 CYS 17 2HB CYS 17 -3.796 3.174 1.410
134 HG CYS 17 HG CYS 17 -1.460 2.068 2.134
135 H GLY 18 H GLY 18 -4.247 4.380 -1.160
136 HA2 GLY 18 1HA GLY 18 -5.436 7.073 -1.018
137 HA3 GLY 18 2HA GLY 18 -5.388 6.063 -2.454
138 H LYS 19 H LYS 19 -7.633 6.413 -2.654
139 HA LYS 19 HA LYS 19 -9.600 5.927 -0.797
140 HB2 LYS 19 1HB LYS 19 -11.085 5.480 -2.771
141 HB3 LYS 19 2HB LYS 19 -10.168 6.974 -2.857
142 HG2 LYS 19 1HG LYS 19 -9.855 6.224 -4.974
143 HG3 LYS 19 2HG LYS 19 -8.479 5.444 -4.201
144 HD2 LYS 19 1HD LYS 19 -9.946 3.415 -3.891
145 HD3 LYS 19 2HD LYS 19 -11.135 4.214 -4.920
146 HE2 LYS 19 1HE LYS 19 -8.307 3.503 -5.694
147 HE3 LYS 19 2HE LYS 19 -9.761 2.646 -6.194
148 HZ1 LYS 19 3HZ LYS 19 -9.153 5.479 -6.843
149 HZ2 LYS 19 1HZ LYS 19 -10.486 4.592 -7.385
150 HZ3 LYS 19 2HZ LYS 19 -8.929 4.175 -7.893
151 H ASN 20 H ASN 20 -10.396 4.252 0.191
152 HA ASN 20 HA ASN 20 -11.004 2.156 0.770
153 HB2 ASN 20 1HB ASN 20 -10.859 1.726 -2.216
154 HB3 ASN 20 2HB ASN 20 -11.558 0.577 -1.081
155 HD21 ASN 20 1HD2 ASN 20 -13.507 1.066 -0.078
156 HD22 ASN 20 2HD2 ASN 20 -14.548 2.318 -0.661
157 H GLU 21 H GLU 21 -8.101 2.769 0.650
158 HA GLU 21 HA GLU 21 -7.123 0.031 0.203
159 HB2 GLU 21 1HB GLU 21 -5.688 2.680 0.158
160 HB3 GLU 21 2HB GLU 21 -4.826 1.153 0.259
161 HG2 GLU 21 1HG GLU 21 -5.909 0.462 -1.859
162 HG3 GLU 21 2HG GLU 21 -6.632 2.068 -1.965
163 H GLU 22 H GLU 22 -5.765 -0.935 1.675
164 HA GLU 22 HA GLU 22 -5.580 0.328 4.328
165 HB2 GLU 22 1HB GLU 22 -5.852 -1.886 5.353
166 HB3 GLU 22 2HB GLU 22 -7.265 -1.459 4.397
167 HG2 GLU 22 1HG GLU 22 -6.588 -2.911 2.628
168 HG3 GLU 22 2HG GLU 22 -5.035 -3.200 3.394
169 H LEU 23 H LEU 23 -3.716 -0.322 5.564
170 HA LEU 23 HA LEU 23 -1.452 -1.017 3.870
171 HB2 LEU 23 1HB LEU 23 -1.639 0.865 5.751
172 HB3 LEU 23 2HB LEU 23 -1.151 -0.472 6.774
173 HG LEU 23 HG LEU 23 0.916 -0.743 5.540
174 HD11 LEU 23 1HD1 LEU 23 1.480 0.743 3.693
175 HD12 LEU 23 2HD1 LEU 23 -0.121 1.464 3.775
176 HD13 LEU 23 3HD1 LEU 23 0.067 -0.227 3.319
177 HD21 LEU 23 3HD2 LEU 23 1.992 1.335 6.098
178 HD22 LEU 23 1HD2 LEU 23 0.794 0.963 7.334
179 HD23 LEU 23 2HD2 LEU 23 0.445 2.180 6.106
180 H ILE 24 H ILE 24 -0.715 -3.026 3.778
181 HA ILE 24 HA ILE 24 -1.826 -4.925 5.740
182 HB ILE 24 HB ILE 24 -2.337 -6.430 4.059
183 HG12 ILE 24 1HG1 ILE 24 -1.143 -5.516 1.665
184 HG13 ILE 24 2HG1 ILE 24 0.126 -5.497 2.886
185 HG21 ILE 24 1HG2 ILE 24 -3.755 -4.567 3.751
186 HG22 ILE 24 2HG2 ILE 24 -3.272 -5.128 2.150
187 HG23 ILE 24 3HG2 ILE 24 -2.519 -3.695 2.844
188 HD11 ILE 24 3HD1 ILE 24 0.014 -7.611 1.643
189 HD12 ILE 24 1HD1 ILE 24 -1.620 -7.860 2.260
190 HD13 ILE 24 2HD1 ILE 24 -0.252 -7.821 3.374
191 H ALA 25 H ALA 25 1.045 -3.791 4.228
192 HA ALA 25 HA ALA 25 2.680 -5.450 5.897
193 HB1 ALA 25 3HB ALA 25 3.870 -6.631 4.164
194 HB2 ALA 25 1HB ALA 25 2.883 -5.874 2.916
195 HB3 ALA 25 2HB ALA 25 2.153 -7.014 4.046
196 H LEU 26 H LEU 26 4.907 -4.881 5.774
197 HA LEU 26 HA LEU 26 5.262 -2.156 4.743
198 HB2 LEU 26 1HB LEU 26 6.412 -3.587 7.119
199 HB3 LEU 26 2HB LEU 26 7.125 -2.107 6.507
200 HG LEU 26 HG LEU 26 5.745 -1.566 8.387
201 HD11 LEU 26 1HD1 LEU 26 4.227 -0.794 5.904
202 HD12 LEU 26 2HD1 LEU 26 5.695 -0.007 6.481
203 HD13 LEU 26 3HD1 LEU 26 4.227 0.044 7.456
204 HD21 LEU 26 3HD2 LEU 26 4.318 -3.530 8.422
205 HD22 LEU 26 1HD2 LEU 26 3.488 -2.971 6.970
206 HD23 LEU 26 2HD2 LEU 26 3.353 -2.057 8.471
207 H CYS 27 H CYS 27 6.623 -1.918 3.119
208 HA CYS 27 HA CYS 27 8.322 -4.171 2.347
209 HB2 CYS 27 1HB CYS 27 7.264 -1.771 0.846
210 HB3 CYS 27 2HB CYS 27 8.414 -2.894 0.139
211 HG CYS 27 HG CYS 27 6.199 -3.823 -0.994
212 H GLN 28 H GLN 28 10.288 -3.172 0.916
213 HA GLN 28 HA GLN 28 11.841 -1.575 2.786
214 HB2 GLN 28 1HB GLN 28 12.684 -2.849 0.182
215 HB3 GLN 28 2HB GLN 28 13.748 -2.056 1.326
216 HG2 GLN 28 1HG GLN 28 13.146 -3.748 3.015
217 HG3 GLN 28 2HG GLN 28 12.181 -4.578 1.795
218 HE21 GLN 28 1HE2 GLN 28 13.455 -6.426 1.966
219 HE22 GLN 28 2HE2 GLN 28 15.046 -6.509 1.297
220 H LYS 29 H LYS 29 13.368 0.039 1.658
221 HA LYS 29 HA LYS 29 13.682 2.010 0.559
222 HB2 LYS 29 1HB LYS 29 11.569 0.915 -1.285
223 HB3 LYS 29 2HB LYS 29 12.517 2.357 -1.608
224 HG2 LYS 29 1HG LYS 29 14.548 1.048 -1.690
225 HG3 LYS 29 2HG LYS 29 13.657 -0.407 -1.243
226 HD2 LYS 29 1HD LYS 29 13.206 1.211 -3.751
227 HD3 LYS 29 2HD LYS 29 14.123 -0.294 -3.660
228 HE2 LYS 29 1HE LYS 29 12.100 -1.452 -2.865
229 HE3 LYS 29 2HE LYS 29 11.193 0.051 -3.013
230 HZ1 LYS 29 3HZ LYS 29 10.872 -1.390 -4.925
231 HZ2 LYS 29 1HZ LYS 29 12.530 -1.374 -5.248
232 HZ3 LYS 29 2HZ LYS 29 11.630 0.050 -5.380
233 H SER 30 H SER 30 11.380 1.398 2.475
234 HA SER 30 HA SER 30 10.069 2.718 3.774
235 HB2 SER 30 1HB SER 30 11.447 4.672 3.110
236 HB3 SER 30 2HB SER 30 10.412 4.900 1.701
237 HG SER 30 HG SER 30 8.646 4.993 3.354
238 H LEU 31 H LEU 31 9.431 1.686 0.663
239 HA LEU 31 HA LEU 31 6.702 2.489 0.486
240 HB2 LEU 31 1HB LEU 31 8.300 0.298 -0.844
241 HB3 LEU 31 2HB LEU 31 6.596 0.532 -1.139
242 HG LEU 31 HG LEU 31 7.903 1.517 -2.902
243 HD11 LEU 31 1HD1 LEU 31 6.967 3.771 -2.888
244 HD12 LEU 31 2HD1 LEU 31 6.621 3.613 -1.164
245 HD13 LEU 31 3HD1 LEU 31 5.801 2.573 -2.330
246 HD21 LEU 31 3HD2 LEU 31 9.152 3.247 -0.793
247 HD22 LEU 31 1HD2 LEU 31 9.350 3.446 -2.534
248 HD23 LEU 31 2HD2 LEU 31 9.958 1.996 -1.738
249 H LYS 32 H LYS 32 4.852 1.237 0.963
250 HA LYS 32 HA LYS 32 5.266 -1.401 2.062
251 HB2 LYS 32 1HB LYS 32 3.634 -0.889 3.890
252 HB3 LYS 32 2HB LYS 32 5.193 -0.106 3.993
253 HG2 LYS 32 1HG LYS 32 3.007 1.425 2.751
254 HG3 LYS 32 2HG LYS 32 2.972 1.166 4.503
255 HD2 LYS 32 1HD LYS 32 5.295 2.052 4.613
256 HD3 LYS 32 2HD LYS 32 5.186 2.441 2.895
257 HE2 LYS 32 1HE LYS 32 3.353 3.953 3.313
258 HE3 LYS 32 2HE LYS 32 3.322 3.495 5.016
259 HZ1 LYS 32 3HZ LYS 32 5.637 4.782 3.683
260 HZ2 LYS 32 1HZ LYS 32 5.457 4.479 5.334
261 HZ3 LYS 32 2HZ LYS 32 4.469 5.619 4.570
262 H CYS 33 H CYS 33 3.147 -2.599 2.281
263 HA CYS 33 HA CYS 33 2.089 -2.436 -0.403
264 HB2 CYS 33 1HB CYS 33 2.882 -4.579 0.654
265 HB3 CYS 33 2HB CYS 33 1.477 -4.499 1.711
266 HG CYS 33 HG CYS 33 1.289 -4.674 -1.702
267 H CYS 34 H CYS 34 0.332 -1.388 -0.881
268 HA CYS 34 HA CYS 34 -1.867 -1.314 1.077
269 HB2 CYS 34 1HB CYS 34 -1.379 0.641 -1.177
270 HB3 CYS 34 2HB CYS 34 -2.568 0.782 0.115
271 HG CYS 34 HG CYS 34 0.735 0.654 0.908
272 H ARG 35 H ARG 35 -3.736 -2.248 0.464
273 HA ARG 35 HA ARG 35 -3.975 -3.038 -2.368
274 HB2 ARG 35 1HB ARG 35 -5.298 -4.993 -1.577
275 HB3 ARG 35 2HB ARG 35 -3.632 -5.012 -1.026
276 HG2 ARG 35 1HG ARG 35 -4.446 -4.049 1.144
277 HG3 ARG 35 2HG ARG 35 -6.086 -4.335 0.566
278 HD2 ARG 35 1HD ARG 35 -4.090 -6.551 0.537
279 HD3 ARG 35 2HD ARG 35 -4.890 -6.135 2.051
280 HE ARG 35 HE ARG 35 -6.281 -7.006 -0.411
281 HH11 ARG 35 1HH1 ARG 35 -6.146 -6.718 3.087
282 HH12 ARG 35 2HH1 ARG 35 -7.455 -7.828 3.342
283 HH21 ARG 35 1HH2 ARG 35 -8.007 -8.443 -0.060
284 HH22 ARG 35 2HH2 ARG 35 -8.510 -8.814 1.557
285 H THR 36 H THR 36 -5.812 -2.571 -3.426
286 HA THR 36 HA THR 36 -7.646 -0.742 -2.162
287 HB THR 36 HB THR 36 -7.848 -1.904 -4.945
288 HG1 THR 36 HG1 THR 36 -5.831 -0.583 -4.137
289 HG21 THR 36 1HG2 THR 36 -8.917 0.646 -3.720
290 HG22 THR 36 2HG2 THR 36 -9.866 -0.776 -4.152
291 HG23 THR 36 3HG2 THR 36 -9.079 0.175 -5.410
292 H ILE 37 H ILE 37 -9.170 -1.465 -0.928
293 HA ILE 37 HA ILE 37 -10.014 -4.181 -0.896
294 HB ILE 37 HB ILE 37 -11.042 -1.765 0.581
295 HG12 ILE 37 1HG1 ILE 37 -8.706 -2.050 0.997
296 HG13 ILE 37 2HG1 ILE 37 -9.559 -2.683 2.390
297 HG21 ILE 37 1HG2 ILE 37 -12.667 -3.524 0.686
298 HG22 ILE 37 2HG2 ILE 37 -11.831 -3.434 2.236
299 HG23 ILE 37 3HG2 ILE 37 -11.425 -4.704 1.085
300 HD11 ILE 37 3HD1 ILE 37 -7.820 -4.201 1.921
301 HD12 ILE 37 1HD1 ILE 37 -8.209 -4.218 0.201
302 HD13 ILE 37 2HD1 ILE 37 -9.304 -4.967 1.359
303 H GLN 38 H GLN 38 -11.569 -5.096 -1.940
304 HA GLN 38 HA GLN 38 -13.427 -3.683 -3.595
305 HB2 GLN 38 1HB GLN 38 -13.339 -6.606 -2.792
306 HB3 GLN 38 2HB GLN 38 -14.273 -5.935 -4.116
307 HG2 GLN 38 1HG GLN 38 -12.186 -5.256 -5.221
308 HG3 GLN 38 2HG GLN 38 -11.275 -6.000 -3.911
309 HE21 GLN 38 1HE2 GLN 38 -14.224 -7.348 -5.198
310 HE22 GLN 38 2HE2 GLN 38 -13.497 -8.727 -5.946
311 HA PRO 39 HA PRO 39 -17.172 -3.241 -1.139
312 HB2 PRO 39 1HB PRO 39 -18.183 -5.748 -2.434
313 HB3 PRO 39 2HB PRO 39 -19.033 -4.231 -2.117
314 HG2 PRO 39 1HG PRO 39 -18.107 -4.759 -4.548
315 HG3 PRO 39 2HG PRO 39 -17.991 -3.125 -3.871
316 HD2 PRO 39 1HD PRO 39 -15.874 -5.147 -4.301
317 HD3 PRO 39 2HD PRO 39 -15.754 -3.380 -4.278
318 H SER 40 H SER 40 -17.989 -3.949 0.802
319 HA SER 40 HA SER 40 -16.279 -5.675 2.243
320 HB2 SER 40 1HB SER 40 -17.395 -3.664 3.197
321 HB3 SER 40 2HB SER 40 -18.934 -4.520 3.118
322 HG SER 40 HG SER 40 -16.646 -5.202 4.665
323 H GLY 41 H GLY 41 -19.041 -6.348 0.374
324 HA2 GLY 41 1HA GLY 41 -19.837 -8.684 1.868
325 HA3 GLY 41 2HA GLY 41 -20.406 -8.225 0.268
326 H SER 42 H SER 42 -18.684 -10.454 1.944
327 HA SER 42 HA SER 42 -17.396 -12.225 1.398
328 HB2 SER 42 1HB SER 42 -17.986 -11.419 -1.457
329 HB3 SER 42 2HB SER 42 -17.294 -12.959 -0.947
330 HG SER 42 HG SER 42 -19.684 -12.162 0.255
331 H ILE 43 H ILE 43 -15.281 -12.846 0.596
332 HA ILE 43 HA ILE 43 -13.090 -12.561 0.088
333 HB ILE 43 HB ILE 43 -13.903 -9.830 -0.914
334 HG12 ILE 43 1HG1 ILE 43 -13.254 -12.408 -2.362
335 HG13 ILE 43 2HG1 ILE 43 -14.850 -11.684 -2.204
336 HG21 ILE 43 1HG2 ILE 43 -11.703 -9.761 -1.995
337 HG22 ILE 43 2HG2 ILE 43 -11.270 -11.274 -1.199
338 HG23 ILE 43 3HG2 ILE 43 -11.564 -9.825 -0.239
339 HD11 ILE 43 3HD1 ILE 43 -12.510 -10.477 -3.658
340 HD12 ILE 43 1HD1 ILE 43 -14.118 -9.769 -3.514
341 HD13 ILE 43 2HD1 ILE 43 -13.896 -11.277 -4.399
342 H ILE 44 H ILE 44 -14.124 -9.321 1.201
343 HA ILE 44 HA ILE 44 -12.513 -9.701 3.603
344 HB ILE 44 HB ILE 44 -10.908 -8.631 2.207
345 HG12 ILE 44 1HG1 ILE 44 -12.210 -6.576 4.005
346 HG13 ILE 44 2HG1 ILE 44 -11.040 -7.790 4.500
347 HG21 ILE 44 1HG2 ILE 44 -12.483 -7.817 0.487
348 HG22 ILE 44 2HG2 ILE 44 -11.287 -6.608 0.951
349 HG23 ILE 44 3HG2 ILE 44 -12.938 -6.497 1.565
350 HD11 ILE 44 3HD1 ILE 44 -10.579 -5.407 2.731
351 HD12 ILE 44 1HD1 ILE 44 -9.403 -6.707 2.950
352 HD13 ILE 44 2HD1 ILE 44 -9.903 -5.727 4.325
353 H ASP 45 H ASP 45 -13.474 -8.931 5.348
354 HA ASP 45 HA ASP 45 -15.979 -7.498 5.066
355 HB2 ASP 45 1HB ASP 45 -15.875 -9.377 6.634
356 HB3 ASP 45 2HB ASP 45 -14.581 -8.580 7.523
Start of MODEL 12
1 H PHE 1 1H PHE 1 9.884 -10.102 -3.481
2 HA PHE 1 HA PHE 1 10.152 -11.969 -2.017
3 HB2 PHE 1 1HB PHE 1 11.827 -10.058 -0.369
4 HB3 PHE 1 2HB PHE 1 11.370 -11.694 0.097
5 HD1 PHE 1 HD2 PHE 1 12.070 -13.566 -1.597
6 HD2 PHE 1 HD1 PHE 1 13.865 -9.715 -1.373
7 HE1 PHE 1 HE2 PHE 1 14.079 -14.441 -2.711
8 HE2 PHE 1 HE1 PHE 1 15.877 -10.584 -2.491
9 HZ PHE 1 HZ PHE 1 15.987 -12.951 -3.159
10 H PHE 2 H PHE 2 10.286 -8.932 -0.163
11 HA PHE 2 HA PHE 2 7.946 -9.412 1.279
12 HB2 PHE 2 1HB PHE 2 9.230 -6.761 0.597
13 HB3 PHE 2 2HB PHE 2 8.018 -7.005 1.847
14 HD1 PHE 2 HD2 PHE 2 8.572 -8.249 3.886
15 HD2 PHE 2 HD1 PHE 2 11.511 -7.373 0.934
16 HE1 PHE 2 HE2 PHE 2 10.351 -8.763 5.506
17 HE2 PHE 2 HE1 PHE 2 13.294 -7.885 2.550
18 HZ PHE 2 HZ PHE 2 12.713 -8.582 4.839
19 H ASP 3 H ASP 3 8.445 -7.499 -1.684
20 HA ASP 3 HA ASP 3 5.593 -7.053 -1.823
21 HB2 ASP 3 1HB ASP 3 6.026 -5.691 -3.793
22 HB3 ASP 3 2HB ASP 3 7.001 -5.180 -2.423
23 H GLU 4 H GLU 4 7.467 -9.573 -2.599
24 HA GLU 4 HA GLU 4 6.088 -10.373 -4.998
25 HB2 GLU 4 1HB GLU 4 8.306 -11.338 -4.342
26 HB3 GLU 4 2HB GLU 4 7.526 -12.112 -2.972
27 HG2 GLU 4 1HG GLU 4 7.807 -13.717 -4.722
28 HG3 GLU 4 2HG GLU 4 6.091 -13.365 -4.542
29 H LYS 5 H LYS 5 5.793 -10.760 -1.527
30 HA LYS 5 HA LYS 5 3.356 -12.203 -1.557
31 HB2 LYS 5 1HB LYS 5 4.808 -12.016 0.441
32 HB3 LYS 5 2HB LYS 5 4.430 -10.306 0.536
33 HG2 LYS 5 1HG LYS 5 3.132 -11.579 2.145
34 HG3 LYS 5 2HG LYS 5 2.084 -10.829 0.941
35 HD2 LYS 5 1HD LYS 5 1.317 -13.069 1.313
36 HD3 LYS 5 2HD LYS 5 2.056 -12.997 -0.287
37 HE2 LYS 5 1HE LYS 5 4.127 -13.942 0.658
38 HE3 LYS 5 2HE LYS 5 3.337 -14.059 2.229
39 HZ1 LYS 5 3HZ LYS 5 1.686 -15.540 1.200
40 HZ2 LYS 5 1HZ LYS 5 3.253 -16.170 1.119
41 HZ3 LYS 5 2HZ LYS 5 2.548 -15.483 -0.252
42 H CYS 6 H CYS 6 4.198 -8.769 -1.581
43 HA CYS 6 HA CYS 6 1.639 -7.657 -1.446
44 HB2 CYS 6 1HB CYS 6 3.782 -6.366 -1.393
45 HB3 CYS 6 2HB CYS 6 3.982 -6.687 -3.109
46 HG CYS 6 HG CYS 6 1.825 -5.177 -3.933
47 H ASN 7 H ASN 7 3.492 -8.858 -4.194
48 HA ASN 7 HA ASN 7 1.699 -8.333 -6.268
49 HB2 ASN 7 1HB ASN 7 3.998 -9.080 -6.641
50 HB3 ASN 7 2HB ASN 7 3.628 -10.637 -5.923
51 HD21 ASN 7 1HD2 ASN 7 4.139 -11.817 -7.696
52 HD22 ASN 7 2HD2 ASN 7 3.197 -11.805 -9.152
53 H LYS 8 H LYS 8 2.100 -11.263 -4.314
54 HA LYS 8 HA LYS 8 0.038 -12.776 -5.426
55 HB2 LYS 8 1HB LYS 8 1.749 -13.681 -3.901
56 HB3 LYS 8 2HB LYS 8 1.013 -12.815 -2.564
57 HG2 LYS 8 1HG LYS 8 0.359 -15.133 -2.505
58 HG3 LYS 8 2HG LYS 8 -1.044 -14.128 -2.879
59 HD2 LYS 8 1HD LYS 8 -0.748 -14.653 -5.269
60 HD3 LYS 8 2HD LYS 8 0.609 -15.703 -4.853
61 HE2 LYS 8 1HE LYS 8 -0.885 -17.094 -3.512
62 HE3 LYS 8 2HE LYS 8 -2.236 -16.041 -3.918
63 HZ1 LYS 8 3HZ LYS 8 -0.659 -17.670 -5.834
64 HZ2 LYS 8 1HZ LYS 8 -1.918 -16.619 -6.255
65 HZ3 LYS 8 2HZ LYS 8 -2.235 -17.988 -5.317
66 H LEU 9 H LEU 9 -0.035 -10.513 -2.702
67 HA LEU 9 HA LEU 9 -2.833 -10.984 -2.217
68 HB2 LEU 9 1HB LEU 9 -0.934 -8.934 -1.087
69 HB3 LEU 9 2HB LEU 9 -2.579 -9.186 -0.534
70 HG LEU 9 HG LEU 9 -0.387 -11.260 -0.412
71 HD11 LEU 9 1HD1 LEU 9 0.042 -9.380 1.092
72 HD12 LEU 9 2HD1 LEU 9 -0.371 -10.848 1.981
73 HD13 LEU 9 3HD1 LEU 9 -1.571 -9.570 1.784
74 HD21 LEU 9 3HD2 LEU 9 -2.583 -12.266 -0.592
75 HD22 LEU 9 1HD2 LEU 9 -3.189 -11.236 0.706
76 HD23 LEU 9 2HD2 LEU 9 -1.965 -12.459 1.047
77 H LYS 10 H LYS 10 -1.201 -9.294 -4.508
78 HA LYS 10 HA LYS 10 -1.946 -8.041 -6.238
79 HB2 LYS 10 1HB LYS 10 -4.656 -8.414 -4.974
80 HB3 LYS 10 2HB LYS 10 -4.361 -7.770 -6.585
81 HG2 LYS 10 1HG LYS 10 -3.231 -9.925 -7.149
82 HG3 LYS 10 2HG LYS 10 -3.789 -10.548 -5.593
83 HD2 LYS 10 1HD LYS 10 -6.097 -10.089 -6.247
84 HD3 LYS 10 2HD LYS 10 -5.523 -9.471 -7.794
85 HE2 LYS 10 1HE LYS 10 -4.592 -11.669 -8.328
86 HE3 LYS 10 2HE LYS 10 -5.162 -12.286 -6.778
87 HZ1 LYS 10 3HZ LYS 10 -7.436 -11.791 -7.491
88 HZ2 LYS 10 1HZ LYS 10 -6.679 -12.893 -8.529
89 HZ3 LYS 10 2HZ LYS 10 -6.857 -11.277 -8.994
90 H GLY 11 H GLY 11 -0.887 -6.753 -4.008
91 HA2 GLY 11 1HA GLY 11 -2.427 -4.225 -4.046
92 HA3 GLY 11 2HA GLY 11 -1.423 -4.733 -2.691
93 H THR 12 H THR 12 -0.988 -2.270 -3.750
94 HA THR 12 HA THR 12 1.532 -2.650 -5.235
95 HB THR 12 HB THR 12 -0.029 -0.073 -5.141
96 HG1 THR 12 HG1 THR 12 -0.663 -2.369 -6.457
97 HG21 THR 12 1HG2 THR 12 1.232 0.417 -7.193
98 HG22 THR 12 2HG2 THR 12 2.045 -1.141 -7.060
99 HG23 THR 12 3HG2 THR 12 2.307 0.099 -5.833
100 H CYS 13 H CYS 13 3.348 -1.458 -4.513
101 HA CYS 13 HA CYS 13 3.229 -0.812 -1.681
102 HB2 CYS 13 1HB CYS 13 5.721 -0.676 -3.371
103 HB3 CYS 13 2HB CYS 13 5.572 -0.971 -1.646
104 HG CYS 13 HG CYS 13 5.335 -3.537 -1.719
105 H LYS 14 H LYS 14 2.527 1.165 -1.245
106 HA LYS 14 HA LYS 14 3.617 3.407 -2.823
107 HB2 LYS 14 1HB LYS 14 0.977 3.351 -1.347
108 HB3 LYS 14 2HB LYS 14 1.600 4.670 -2.329
109 HG2 LYS 14 1HG LYS 14 1.462 3.208 -4.292
110 HG3 LYS 14 2HG LYS 14 0.785 1.959 -3.249
111 HD2 LYS 14 1HD LYS 14 -0.972 3.680 -2.597
112 HD3 LYS 14 2HD LYS 14 -0.407 4.599 -3.993
113 HE2 LYS 14 1HE LYS 14 -0.896 2.720 -5.450
114 HE3 LYS 14 2HE LYS 14 -1.399 1.770 -4.050
115 HZ1 LYS 14 3HZ LYS 14 -3.243 2.793 -5.355
116 HZ2 LYS 14 1HZ LYS 14 -2.703 4.310 -4.841
117 HZ3 LYS 14 2HZ LYS 14 -3.254 3.175 -3.705
118 H ASN 15 H ASN 15 3.499 5.481 -1.541
119 HA ASN 15 HA ASN 15 4.600 5.107 1.102
120 HB2 ASN 15 1HB ASN 15 4.431 7.264 -0.870
121 HB3 ASN 15 2HB ASN 15 4.173 7.809 0.781
122 HD21 ASN 15 1HD2 ASN 15 6.125 8.980 0.674
123 HD22 ASN 15 2HD2 ASN 15 7.654 8.185 0.812
124 H ASN 16 H ASN 16 1.578 5.727 -0.398
125 HA ASN 16 HA ASN 16 0.299 6.033 2.216
126 HB2 ASN 16 1HB ASN 16 -0.923 8.018 1.608
127 HB3 ASN 16 2HB ASN 16 0.789 8.340 1.353
128 HD21 ASN 16 1HD2 ASN 16 1.590 8.106 -0.849
129 HD22 ASN 16 2HD2 ASN 16 0.548 8.531 -2.162
130 H CYS 17 H CYS 17 -1.869 5.419 2.242
131 HA CYS 17 HA CYS 17 -2.636 3.672 0.060
132 HB2 CYS 17 1HB CYS 17 -4.068 4.218 2.667
133 HB3 CYS 17 2HB CYS 17 -4.367 2.885 1.564
134 HG CYS 17 HG CYS 17 -1.388 2.309 2.048
135 H GLY 18 H GLY 18 -4.147 4.076 -1.397
136 HA2 GLY 18 1HA GLY 18 -5.287 6.745 -1.492
137 HA3 GLY 18 2HA GLY 18 -5.321 5.538 -2.768
138 H LYS 19 H LYS 19 -7.524 6.082 -3.066
139 HA LYS 19 HA LYS 19 -9.526 6.077 -1.184
140 HB2 LYS 19 1HB LYS 19 -11.076 5.930 -2.955
141 HB3 LYS 19 2HB LYS 19 -9.683 6.771 -3.606
142 HG2 LYS 19 1HG LYS 19 -10.407 3.886 -4.084
143 HG3 LYS 19 2HG LYS 19 -10.598 5.215 -5.222
144 HD2 LYS 19 1HD LYS 19 -8.102 5.532 -5.104
145 HD3 LYS 19 2HD LYS 19 -8.031 4.029 -4.180
146 HE2 LYS 19 1HE LYS 19 -7.570 3.595 -6.517
147 HE3 LYS 19 2HE LYS 19 -9.095 2.845 -6.046
148 HZ1 LYS 19 3HZ LYS 19 -9.294 3.932 -8.180
149 HZ2 LYS 19 1HZ LYS 19 -8.795 5.406 -7.519
150 HZ3 LYS 19 2HZ LYS 19 -10.265 4.720 -7.045
151 H ASN 20 H ASN 20 -10.262 4.640 0.141
152 HA ASN 20 HA ASN 20 -10.873 2.706 1.130
153 HB2 ASN 20 1HB ASN 20 -11.344 1.940 -1.751
154 HB3 ASN 20 2HB ASN 20 -11.807 0.918 -0.395
155 HD21 ASN 20 1HD2 ASN 20 -13.976 1.032 -0.874
156 HD22 ASN 20 2HD2 ASN 20 -14.914 2.466 -0.647
157 H GLU 21 H GLU 21 -8.045 3.061 0.511
158 HA GLU 21 HA GLU 21 -7.238 0.237 0.328
159 HB2 GLU 21 1HB GLU 21 -5.580 2.747 -0.012
160 HB3 GLU 21 2HB GLU 21 -4.940 1.113 -0.077
161 HG2 GLU 21 1HG GLU 21 -6.567 0.724 -1.985
162 HG3 GLU 21 2HG GLU 21 -6.802 2.467 -2.000
163 H GLU 22 H GLU 22 -5.657 -0.555 1.823
164 HA GLU 22 HA GLU 22 -5.256 1.072 4.230
165 HB2 GLU 22 1HB GLU 22 -5.795 -0.774 5.697
166 HB3 GLU 22 2HB GLU 22 -7.167 -0.446 4.653
167 HG2 GLU 22 1HG GLU 22 -6.631 -2.354 3.281
168 HG3 GLU 22 2HG GLU 22 -5.160 -2.642 4.210
169 H LEU 23 H LEU 23 -3.487 0.304 5.582
170 HA LEU 23 HA LEU 23 -1.284 -0.658 3.964
171 HB2 LEU 23 1HB LEU 23 -1.474 1.161 6.002
172 HB3 LEU 23 2HB LEU 23 -0.859 -0.246 6.846
173 HG LEU 23 HG LEU 23 1.133 -0.295 5.511
174 HD11 LEU 23 1HD1 LEU 23 -0.365 1.654 3.791
175 HD12 LEU 23 2HD1 LEU 23 0.391 0.120 3.338
176 HD13 LEU 23 3HD1 LEU 23 1.390 1.519 3.731
177 HD21 LEU 23 3HD2 LEU 23 0.461 2.562 6.215
178 HD22 LEU 23 1HD2 LEU 23 2.079 1.916 5.941
179 HD23 LEU 23 2HD2 LEU 23 1.124 1.351 7.312
180 H ILE 24 H ILE 24 -0.767 -2.739 3.833
181 HA ILE 24 HA ILE 24 -1.903 -4.528 5.880
182 HB ILE 24 HB ILE 24 -2.353 -6.159 4.232
183 HG12 ILE 24 1HG1 ILE 24 -1.569 -5.318 1.755
184 HG13 ILE 24 2HG1 ILE 24 -0.220 -4.793 2.750
185 HG21 ILE 24 1HG2 ILE 24 -2.852 -3.486 2.944
186 HG22 ILE 24 2HG2 ILE 24 -3.865 -4.236 4.181
187 HG23 ILE 24 3HG2 ILE 24 -3.709 -4.988 2.594
188 HD11 ILE 24 3HD1 ILE 24 -1.294 -7.593 2.576
189 HD12 ILE 24 1HD1 ILE 24 0.062 -7.067 3.573
190 HD13 ILE 24 2HD1 ILE 24 0.180 -6.992 1.815
191 H ALA 25 H ALA 25 1.004 -3.520 4.354
192 HA ALA 25 HA ALA 25 2.610 -5.185 6.031
193 HB1 ALA 25 3HB ALA 25 2.609 -5.844 3.083
194 HB2 ALA 25 1HB ALA 25 1.993 -6.879 4.371
195 HB3 ALA 25 2HB ALA 25 3.712 -6.500 4.292
196 H LEU 26 H LEU 26 4.865 -4.816 5.746
197 HA LEU 26 HA LEU 26 5.377 -2.193 4.554
198 HB2 LEU 26 1HB LEU 26 5.740 -2.183 6.879
199 HB3 LEU 26 2HB LEU 26 6.649 -3.676 6.833
200 HG LEU 26 HG LEU 26 8.440 -2.439 5.578
201 HD11 LEU 26 1HD1 LEU 26 8.310 0.091 5.871
202 HD12 LEU 26 2HD1 LEU 26 6.575 -0.147 6.121
203 HD13 LEU 26 3HD1 LEU 26 7.326 -0.631 4.600
204 HD21 LEU 26 3HD2 LEU 26 8.636 -2.818 7.968
205 HD22 LEU 26 1HD2 LEU 26 7.693 -1.364 8.294
206 HD23 LEU 26 2HD2 LEU 26 9.282 -1.234 7.542
207 H CYS 27 H CYS 27 6.981 -1.884 3.174
208 HA CYS 27 HA CYS 27 8.257 -4.304 2.071
209 HB2 CYS 27 1HB CYS 27 7.197 -1.834 0.685
210 HB3 CYS 27 2HB CYS 27 8.160 -3.057 -0.128
211 HG CYS 27 HG CYS 27 5.816 -4.726 1.286
212 H GLN 28 H GLN 28 10.214 -3.617 0.623
213 HA GLN 28 HA GLN 28 12.042 -2.170 2.283
214 HB2 GLN 28 1HB GLN 28 12.440 -3.112 -0.559
215 HB3 GLN 28 2HB GLN 28 13.697 -2.611 0.558
216 HG2 GLN 28 1HG GLN 28 13.088 -4.501 2.029
217 HG3 GLN 28 2HG GLN 28 11.931 -5.032 0.809
218 HE21 GLN 28 1HE2 GLN 28 12.695 -5.832 -1.152
219 HE22 GLN 28 2HE2 GLN 28 14.319 -6.389 -1.341
220 H LYS 29 H LYS 29 13.501 -0.499 1.100
221 HA LYS 29 HA LYS 29 13.707 1.650 0.381
222 HB2 LYS 29 1HB LYS 29 11.352 0.897 -1.349
223 HB3 LYS 29 2HB LYS 29 12.253 2.397 -1.508
224 HG2 LYS 29 1HG LYS 29 14.277 1.099 -2.032
225 HG3 LYS 29 2HG LYS 29 13.330 -0.387 -1.919
226 HD2 LYS 29 1HD LYS 29 12.703 1.871 -3.817
227 HD3 LYS 29 2HD LYS 29 13.672 0.463 -4.252
228 HE2 LYS 29 1HE LYS 29 10.849 0.295 -3.197
229 HE3 LYS 29 2HE LYS 29 11.252 0.346 -4.914
230 HZ1 LYS 29 3HZ LYS 29 12.076 -1.744 -2.972
231 HZ2 LYS 29 1HZ LYS 29 12.593 -1.675 -4.580
232 HZ3 LYS 29 2HZ LYS 29 10.960 -1.915 -4.225
233 H SER 30 H SER 30 11.536 0.649 2.379
234 HA SER 30 HA SER 30 10.321 1.638 4.008
235 HB2 SER 30 1HB SER 30 11.872 3.590 3.764
236 HB3 SER 30 2HB SER 30 10.745 4.281 2.597
237 HG SER 30 HG SER 30 9.147 4.227 4.266
238 H LEU 31 H LEU 31 9.441 1.178 0.943
239 HA LEU 31 HA LEU 31 6.905 2.470 0.848
240 HB2 LEU 31 1HB LEU 31 8.197 0.213 -0.663
241 HB3 LEU 31 2HB LEU 31 6.499 0.566 -0.880
242 HG LEU 31 HG LEU 31 8.002 1.561 -2.590
243 HD11 LEU 31 1HD1 LEU 31 6.420 3.514 -0.931
244 HD12 LEU 31 2HD1 LEU 31 5.779 2.460 -2.192
245 HD13 LEU 31 3HD1 LEU 31 6.910 3.745 -2.611
246 HD21 LEU 31 3HD2 LEU 31 8.880 3.356 -0.348
247 HD22 LEU 31 1HD2 LEU 31 9.282 3.549 -2.053
248 HD23 LEU 31 2HD2 LEU 31 9.881 2.153 -1.160
249 H LYS 32 H LYS 32 4.816 1.280 0.857
250 HA LYS 32 HA LYS 32 4.838 -1.143 2.520
251 HB2 LYS 32 1HB LYS 32 3.136 1.299 2.994
252 HB3 LYS 32 2HB LYS 32 2.820 -0.264 3.728
253 HG2 LYS 32 1HG LYS 32 4.018 0.551 5.425
254 HG3 LYS 32 2HG LYS 32 5.407 0.128 4.423
255 HD2 LYS 32 1HD LYS 32 5.431 2.393 3.489
256 HD3 LYS 32 2HD LYS 32 4.051 2.821 4.501
257 HE2 LYS 32 1HE LYS 32 5.391 2.354 6.502
258 HE3 LYS 32 2HE LYS 32 6.769 1.958 5.478
259 HZ1 LYS 32 3HZ LYS 32 6.658 4.245 4.601
260 HZ2 LYS 32 1HZ LYS 32 6.983 4.190 6.260
261 HZ3 LYS 32 2HZ LYS 32 5.438 4.596 5.718
262 H CYS 33 H CYS 33 2.885 -2.416 2.347
263 HA CYS 33 HA CYS 33 1.903 -2.357 -0.376
264 HB2 CYS 33 1HB CYS 33 2.603 -4.482 0.731
265 HB3 CYS 33 2HB CYS 33 1.256 -4.295 1.850
266 HG CYS 33 HG CYS 33 0.993 -4.766 -1.528
267 H CYS 34 H CYS 34 0.199 -1.198 -0.895
268 HA CYS 34 HA CYS 34 -1.970 -0.886 1.069
269 HB2 CYS 34 1HB CYS 34 -1.435 0.745 -1.425
270 HB3 CYS 34 2HB CYS 34 -2.652 1.078 -0.197
271 HG CYS 34 HG CYS 34 0.468 0.900 1.001
272 H ARG 35 H ARG 35 -3.721 -2.088 0.730
273 HA ARG 35 HA ARG 35 -4.188 -3.143 -1.980
274 HB2 ARG 35 1HB ARG 35 -5.328 -4.158 0.633
275 HB3 ARG 35 2HB ARG 35 -5.495 -4.914 -0.943
276 HG2 ARG 35 1HG ARG 35 -3.100 -5.353 -1.000
277 HG3 ARG 35 2HG ARG 35 -2.915 -4.568 0.569
278 HD2 ARG 35 1HD ARG 35 -3.003 -6.838 1.114
279 HD3 ARG 35 2HD ARG 35 -4.649 -6.276 1.393
280 HE ARG 35 HE ARG 35 -4.193 -7.348 -1.252
281 HH11 ARG 35 1HH1 ARG 35 -5.106 -8.095 2.044
282 HH12 ARG 35 2HH1 ARG 35 -6.023 -9.503 1.605
283 HH21 ARG 35 1HH2 ARG 35 -5.385 -9.206 -1.827
284 HH22 ARG 35 2HH2 ARG 35 -6.184 -10.131 -0.595
285 H THR 36 H THR 36 -5.944 -2.515 -3.074
286 HA THR 36 HA THR 36 -7.763 -0.612 -1.878
287 HB THR 36 HB THR 36 -8.262 -1.765 -4.585
288 HG1 THR 36 HG1 THR 36 -6.057 -0.077 -3.898
289 HG21 THR 36 1HG2 THR 36 -9.691 0.025 -3.659
290 HG22 THR 36 2HG2 THR 36 -8.843 0.540 -5.117
291 HG23 THR 36 3HG2 THR 36 -8.278 1.074 -3.534
292 H ILE 37 H ILE 37 -9.385 -1.272 -0.688
293 HA ILE 37 HA ILE 37 -10.214 -3.873 -0.359
294 HB ILE 37 HB ILE 37 -11.593 -1.281 0.229
295 HG12 ILE 37 1HG1 ILE 37 -9.343 -2.251 1.287
296 HG13 ILE 37 2HG1 ILE 37 -10.517 -1.369 2.251
297 HG21 ILE 37 1HG2 ILE 37 -13.074 -2.542 1.729
298 HG22 ILE 37 2HG2 ILE 37 -12.399 -4.051 1.112
299 HG23 ILE 37 3HG2 ILE 37 -13.312 -2.988 0.040
300 HD11 ILE 37 3HD1 ILE 37 -11.444 -3.502 3.021
301 HD12 ILE 37 1HD1 ILE 37 -9.730 -3.342 3.405
302 HD13 ILE 37 2HD1 ILE 37 -10.240 -4.353 2.054
303 H GLN 38 H GLN 38 -11.298 -5.223 -1.549
304 HA GLN 38 HA GLN 38 -12.616 -4.366 -3.963
305 HB2 GLN 38 1HB GLN 38 -12.280 -7.109 -2.729
306 HB3 GLN 38 2HB GLN 38 -12.944 -6.799 -4.326
307 HG2 GLN 38 1HG GLN 38 -10.846 -5.927 -5.092
308 HG3 GLN 38 2HG GLN 38 -10.165 -6.033 -3.470
309 HE21 GLN 38 1HE2 GLN 38 -12.233 -8.514 -4.808
310 HE22 GLN 38 2HE2 GLN 38 -11.002 -9.717 -4.979
311 HA PRO 39 HA PRO 39 -16.653 -4.270 -2.078
312 HB2 PRO 39 1HB PRO 39 -18.087 -3.707 -4.232
313 HB3 PRO 39 2HB PRO 39 -16.941 -2.520 -3.585
314 HG2 PRO 39 1HG PRO 39 -16.532 -4.513 -5.771
315 HG3 PRO 39 2HG PRO 39 -16.252 -2.762 -5.839
316 HD2 PRO 39 1HD PRO 39 -14.247 -4.495 -5.381
317 HD3 PRO 39 2HD PRO 39 -14.311 -2.922 -4.553
318 H SER 40 H SER 40 -18.860 -5.252 -2.622
319 HA SER 40 HA SER 40 -20.235 -6.972 -3.123
320 HB2 SER 40 1HB SER 40 -18.027 -8.060 -4.871
321 HB3 SER 40 2HB SER 40 -19.724 -8.541 -4.901
322 HG SER 40 HG SER 40 -20.246 -6.416 -5.560
323 H GLY 41 H GLY 41 -16.969 -8.342 -2.908
324 HA2 GLY 41 1HA GLY 41 -18.071 -10.349 -1.045
325 HA3 GLY 41 2HA GLY 41 -16.705 -10.633 -2.110
326 H SER 42 H SER 42 -17.552 -10.109 0.987
327 HA SER 42 HA SER 42 -16.561 -9.318 2.874
328 HB2 SER 42 1HB SER 42 -14.258 -10.202 3.195
329 HB3 SER 42 2HB SER 42 -15.403 -11.403 2.610
330 HG SER 42 HG SER 42 -13.435 -11.524 1.469
331 H ILE 43 H ILE 43 -13.461 -8.931 2.004
332 HA ILE 43 HA ILE 43 -13.688 -6.137 1.199
333 HB ILE 43 HB ILE 43 -11.619 -5.780 2.801
334 HG12 ILE 43 1HG1 ILE 43 -13.224 -7.831 4.343
335 HG13 ILE 43 2HG1 ILE 43 -11.686 -8.182 3.573
336 HG21 ILE 43 1HG2 ILE 43 -13.148 -4.877 4.499
337 HG22 ILE 43 2HG2 ILE 43 -14.482 -5.765 3.762
338 HG23 ILE 43 3HG2 ILE 43 -13.675 -4.480 2.863
339 HD11 ILE 43 3HD1 ILE 43 -11.427 -7.770 5.953
340 HD12 ILE 43 1HD1 ILE 43 -12.142 -6.169 5.762
341 HD13 ILE 43 2HD1 ILE 43 -10.594 -6.540 5.003
342 H ILE 44 H ILE 44 -10.781 -7.690 2.344
343 HA ILE 44 HA ILE 44 -9.914 -8.159 -0.412
344 HB ILE 44 HB ILE 44 -7.602 -7.515 0.379
345 HG12 ILE 44 1HG1 ILE 44 -9.229 -6.537 2.726
346 HG13 ILE 44 2HG1 ILE 44 -7.785 -7.544 2.750
347 HG21 ILE 44 1HG2 ILE 44 -9.758 -5.426 0.339
348 HG22 ILE 44 2HG2 ILE 44 -8.919 -6.088 -1.066
349 HG23 ILE 44 3HG2 ILE 44 -8.039 -5.102 0.106
350 HD11 ILE 44 3HD1 ILE 44 -6.466 -5.614 1.972
351 HD12 ILE 44 1HD1 ILE 44 -7.262 -5.320 3.518
352 HD13 ILE 44 2HD1 ILE 44 -7.922 -4.615 2.038
353 H ASP 45 H ASP 45 -11.109 -9.882 1.556
354 HA ASP 45 HA ASP 45 -8.929 -11.815 1.924
355 HB2 ASP 45 1HB ASP 45 -9.730 -10.860 4.093
356 HB3 ASP 45 2HB ASP 45 -11.340 -11.470 3.725
Start of MODEL 13
1 H PHE 1 1H PHE 1 11.068 -10.394 -1.070
2 HA PHE 1 HA PHE 1 9.055 -12.134 -2.354
3 HB2 PHE 1 1HB PHE 1 10.379 -12.254 0.358
4 HB3 PHE 1 2HB PHE 1 9.007 -13.245 -0.120
5 HD1 PHE 1 HD1 PHE 1 9.268 -15.050 -1.708
6 HD2 PHE 1 HD2 PHE 1 12.589 -12.669 -0.521
7 HE1 PHE 1 HE1 PHE 1 10.805 -16.727 -2.652
8 HE2 PHE 1 HE2 PHE 1 14.126 -14.338 -1.464
9 HZ PHE 1 HZ PHE 1 13.237 -16.368 -2.530
10 H PHE 2 H PHE 2 9.685 -9.332 -0.428
11 HA PHE 2 HA PHE 2 7.386 -9.169 1.118
12 HB2 PHE 2 1HB PHE 2 9.035 -6.996 -0.167
13 HB3 PHE 2 2HB PHE 2 7.689 -6.652 0.912
14 HD1 PHE 2 HD1 PHE 2 7.784 -7.808 3.240
15 HD2 PHE 2 HD2 PHE 2 11.157 -7.243 0.708
16 HE1 PHE 2 HE1 PHE 2 9.273 -8.024 5.183
17 HE2 PHE 2 HE2 PHE 2 12.654 -7.465 2.649
18 HZ PHE 2 HZ PHE 2 11.710 -7.857 4.890
19 H ASP 3 H ASP 3 7.884 -8.029 -2.232
20 HA ASP 3 HA ASP 3 5.048 -7.420 -2.318
21 HB2 ASP 3 1HB ASP 3 5.424 -6.307 -4.417
22 HB3 ASP 3 2HB ASP 3 6.562 -5.722 -3.211
23 H GLU 4 H GLU 4 6.847 -10.088 -2.867
24 HA GLU 4 HA GLU 4 5.257 -11.197 -4.985
25 HB2 GLU 4 1HB GLU 4 6.780 -12.569 -2.752
26 HB3 GLU 4 2HB GLU 4 5.978 -13.414 -4.065
27 HG2 GLU 4 1HG GLU 4 8.344 -11.579 -4.239
28 HG3 GLU 4 2HG GLU 4 8.289 -13.305 -4.570
29 H LYS 5 H LYS 5 5.167 -11.083 -1.480
30 HA LYS 5 HA LYS 5 2.667 -12.307 -1.085
31 HB2 LYS 5 1HB LYS 5 4.383 -11.707 0.673
32 HB3 LYS 5 2HB LYS 5 3.862 -10.039 0.512
33 HG2 LYS 5 1HG LYS 5 2.786 -10.956 2.417
34 HG3 LYS 5 2HG LYS 5 1.567 -10.768 1.153
35 HD2 LYS 5 1HD LYS 5 1.709 -13.125 0.619
36 HD3 LYS 5 2HD LYS 5 3.016 -13.337 1.785
37 HE2 LYS 5 1HE LYS 5 1.461 -12.627 3.580
38 HE3 LYS 5 2HE LYS 5 0.166 -12.562 2.386
39 HZ1 LYS 5 3HZ LYS 5 0.526 -14.932 1.959
40 HZ2 LYS 5 1HZ LYS 5 0.109 -14.643 3.573
41 HZ3 LYS 5 2HZ LYS 5 1.713 -14.972 3.157
42 H CYS 6 H CYS 6 3.643 -8.960 -1.679
43 HA CYS 6 HA CYS 6 1.175 -7.697 -1.471
44 HB2 CYS 6 1HB CYS 6 3.428 -6.594 -1.717
45 HB3 CYS 6 2HB CYS 6 3.395 -7.024 -3.421
46 HG CYS 6 HG CYS 6 1.562 -5.273 -4.213
47 H ASN 7 H ASN 7 2.714 -9.234 -4.259
48 HA ASN 7 HA ASN 7 0.803 -8.674 -6.211
49 HB2 ASN 7 1HB ASN 7 3.042 -9.664 -6.637
50 HB3 ASN 7 2HB ASN 7 2.480 -11.177 -5.948
51 HD21 ASN 7 1HD2 ASN 7 2.740 -12.363 -7.789
52 HD22 ASN 7 2HD2 ASN 7 1.753 -12.149 -9.194
53 H LYS 8 H LYS 8 1.070 -11.366 -3.964
54 HA LYS 8 HA LYS 8 -1.101 -12.852 -4.960
55 HB2 LYS 8 1HB LYS 8 0.721 -13.706 -3.450
56 HB3 LYS 8 2HB LYS 8 -0.081 -12.883 -2.119
57 HG2 LYS 8 1HG LYS 8 -0.639 -15.257 -2.183
58 HG3 LYS 8 2HG LYS 8 -2.065 -14.250 -2.441
59 HD2 LYS 8 1HD LYS 8 -1.910 -14.626 -4.840
60 HD3 LYS 8 2HD LYS 8 -0.454 -15.590 -4.608
61 HE2 LYS 8 1HE LYS 8 -1.729 -17.221 -3.324
62 HE3 LYS 8 2HE LYS 8 -3.183 -16.246 -3.507
63 HZ1 LYS 8 3HZ LYS 8 -3.046 -16.569 -5.903
64 HZ2 LYS 8 1HZ LYS 8 -3.147 -18.050 -5.097
65 HZ3 LYS 8 2HZ LYS 8 -1.665 -17.524 -5.713
66 H LEU 9 H LEU 9 -0.935 -10.245 -2.598
67 HA LEU 9 HA LEU 9 -3.764 -10.533 -1.980
68 HB2 LEU 9 1HB LEU 9 -1.608 -8.704 -0.970
69 HB3 LEU 9 2HB LEU 9 -3.295 -8.380 -0.637
70 HG LEU 9 HG LEU 9 -2.448 -9.473 1.272
71 HD11 LEU 9 1HD1 LEU 9 -3.843 -11.587 -0.350
72 HD12 LEU 9 2HD1 LEU 9 -4.639 -10.270 0.511
73 HD13 LEU 9 3HD1 LEU 9 -3.744 -11.497 1.408
74 HD21 LEU 9 3HD2 LEU 9 -1.347 -11.624 -0.521
75 HD22 LEU 9 1HD2 LEU 9 -1.231 -11.560 1.238
76 HD23 LEU 9 2HD2 LEU 9 -0.399 -10.352 0.252
77 H LYS 10 H LYS 10 -2.037 -9.213 -4.430
78 HA LYS 10 HA LYS 10 -2.611 -7.948 -6.217
79 HB2 LYS 10 1HB LYS 10 -5.349 -7.991 -4.944
80 HB3 LYS 10 2HB LYS 10 -5.013 -7.229 -6.487
81 HG2 LYS 10 1HG LYS 10 -5.865 -9.296 -7.081
82 HG3 LYS 10 2HG LYS 10 -4.121 -9.533 -7.198
83 HD2 LYS 10 1HD LYS 10 -4.128 -10.549 -4.961
84 HD3 LYS 10 2HD LYS 10 -5.878 -10.337 -4.883
85 HE2 LYS 10 1HE LYS 10 -6.147 -11.788 -6.822
86 HE3 LYS 10 2HE LYS 10 -4.398 -11.986 -6.927
87 HZ1 LYS 10 3HZ LYS 10 -5.319 -13.869 -5.817
88 HZ2 LYS 10 1HZ LYS 10 -6.163 -12.894 -4.721
89 HZ3 LYS 10 2HZ LYS 10 -4.475 -12.957 -4.668
90 H GLY 11 H GLY 11 -1.527 -6.777 -3.826
91 HA2 GLY 11 1HA GLY 11 -2.705 -4.077 -3.918
92 HA3 GLY 11 2HA GLY 11 -1.677 -4.690 -2.629
93 H THR 12 H THR 12 -0.648 -2.522 -3.167
94 HA THR 12 HA THR 12 1.656 -3.098 -4.855
95 HB THR 12 HB THR 12 0.156 -0.496 -5.196
96 HG1 THR 12 HG1 THR 12 -0.199 -2.980 -6.392
97 HG21 THR 12 1HG2 THR 12 1.581 -0.240 -7.169
98 HG22 THR 12 2HG2 THR 12 2.365 -1.776 -6.808
99 HG23 THR 12 3HG2 THR 12 2.551 -0.411 -5.708
100 H CYS 13 H CYS 13 3.495 -1.829 -4.300
101 HA CYS 13 HA CYS 13 3.384 -0.856 -1.558
102 HB2 CYS 13 1HB CYS 13 5.864 -1.062 -3.268
103 HB3 CYS 13 2HB CYS 13 5.742 -1.057 -1.516
104 HG CYS 13 HG CYS 13 5.244 -3.611 -3.675
105 H LYS 14 H LYS 14 2.882 1.198 -1.282
106 HA LYS 14 HA LYS 14 3.981 3.180 -3.147
107 HB2 LYS 14 1HB LYS 14 1.819 4.429 -2.955
108 HB3 LYS 14 2HB LYS 14 1.696 2.898 -3.812
109 HG2 LYS 14 1HG LYS 14 0.757 1.838 -1.853
110 HG3 LYS 14 2HG LYS 14 0.964 3.320 -0.921
111 HD2 LYS 14 1HD LYS 14 -1.339 3.097 -1.626
112 HD3 LYS 14 2HD LYS 14 -0.592 4.468 -2.442
113 HE2 LYS 14 1HE LYS 14 -0.320 3.156 -4.458
114 HE3 LYS 14 2HE LYS 14 -0.949 1.725 -3.643
115 HZ1 LYS 14 3HZ LYS 14 -3.058 2.923 -3.323
116 HZ2 LYS 14 1HZ LYS 14 -2.671 2.719 -4.961
117 HZ3 LYS 14 2HZ LYS 14 -2.445 4.221 -4.225
118 H ASN 15 H ASN 15 3.527 5.478 -2.178
119 HA ASN 15 HA ASN 15 4.944 5.629 0.279
120 HB2 ASN 15 1HB ASN 15 5.023 7.336 -1.544
121 HB3 ASN 15 2HB ASN 15 3.402 7.793 -1.091
122 HD21 ASN 15 1HD2 ASN 15 6.733 7.806 -0.122
123 HD22 ASN 15 2HD2 ASN 15 6.565 8.977 1.139
124 H ASN 16 H ASN 16 1.786 6.936 -0.564
125 HA ASN 16 HA ASN 16 0.800 6.188 2.116
126 HB2 ASN 16 1HB ASN 16 -0.617 8.199 2.074
127 HB3 ASN 16 2HB ASN 16 1.088 8.618 1.954
128 HD21 ASN 16 1HD2 ASN 16 1.917 9.254 -0.079
129 HD22 ASN 16 2HD2 ASN 16 0.878 9.934 -1.282
130 H CYS 17 H CYS 17 -1.297 5.400 2.256
131 HA CYS 17 HA CYS 17 -2.182 3.955 -0.035
132 HB2 CYS 17 1HB CYS 17 -3.822 4.327 2.458
133 HB3 CYS 17 2HB CYS 17 -3.740 2.934 1.391
134 HG CYS 17 HG CYS 17 -1.261 2.076 2.222
135 H GLY 18 H GLY 18 -4.026 4.190 -1.253
136 HA2 GLY 18 1HA GLY 18 -5.043 6.934 -1.360
137 HA3 GLY 18 2HA GLY 18 -5.183 5.721 -2.625
138 H LYS 19 H LYS 19 -7.407 6.319 -2.765
139 HA LYS 19 HA LYS 19 -9.230 6.268 -0.672
140 HB2 LYS 19 1HB LYS 19 -10.938 5.875 -2.523
141 HB3 LYS 19 2HB LYS 19 -9.936 7.310 -2.643
142 HG2 LYS 19 1HG LYS 19 -9.809 6.594 -4.789
143 HG3 LYS 19 2HG LYS 19 -8.440 5.708 -4.122
144 HD2 LYS 19 1HD LYS 19 -9.844 3.722 -3.860
145 HD3 LYS 19 2HD LYS 19 -11.227 4.614 -4.504
146 HE2 LYS 19 1HE LYS 19 -9.907 4.981 -6.594
147 HE3 LYS 19 2HE LYS 19 -8.679 3.898 -5.944
148 HZ1 LYS 19 3HZ LYS 19 -10.420 2.167 -5.804
149 HZ2 LYS 19 1HZ LYS 19 -10.108 2.673 -7.386
150 HZ3 LYS 19 2HZ LYS 19 -11.492 3.213 -6.585
151 H ASN 20 H ASN 20 -10.277 4.798 0.398
152 HA ASN 20 HA ASN 20 -10.560 2.803 1.417
153 HB2 ASN 20 1HB ASN 20 -11.892 1.173 0.015
154 HB3 ASN 20 2HB ASN 20 -12.545 2.796 0.166
155 HD21 ASN 20 1HD2 ASN 20 -11.058 0.491 -1.967
156 HD22 ASN 20 2HD2 ASN 20 -11.459 1.300 -3.440
157 H GLU 21 H GLU 21 -8.050 2.768 1.247
158 HA GLU 21 HA GLU 21 -7.406 0.049 0.318
159 HB2 GLU 21 1HB GLU 21 -5.592 2.453 0.601
160 HB3 GLU 21 2HB GLU 21 -4.996 0.825 0.335
161 HG2 GLU 21 1HG GLU 21 -6.570 0.897 -1.741
162 HG3 GLU 21 2HG GLU 21 -6.469 2.638 -1.517
163 H GLU 22 H GLU 22 -6.073 -1.223 1.735
164 HA GLU 22 HA GLU 22 -5.960 -0.205 4.500
165 HB2 GLU 22 1HB GLU 22 -6.433 -2.394 5.358
166 HB3 GLU 22 2HB GLU 22 -7.676 -2.010 4.178
167 HG2 GLU 22 1HG GLU 22 -6.621 -3.433 2.539
168 HG3 GLU 22 2HG GLU 22 -5.270 -3.731 3.629
169 H LEU 23 H LEU 23 -4.166 -0.963 5.775
170 HA LEU 23 HA LEU 23 -1.833 -1.569 4.138
171 HB2 LEU 23 1HB LEU 23 -2.143 0.052 6.303
172 HB3 LEU 23 2HB LEU 23 -1.429 -1.364 7.029
173 HG LEU 23 HG LEU 23 0.248 0.329 6.390
174 HD11 LEU 23 1HD1 LEU 23 1.789 -1.120 5.258
175 HD12 LEU 23 2HD1 LEU 23 0.465 -2.157 4.730
176 HD13 LEU 23 3HD1 LEU 23 0.864 -2.043 6.444
177 HD21 LEU 23 3HD2 LEU 23 -1.057 1.165 4.443
178 HD22 LEU 23 1HD2 LEU 23 -0.533 -0.266 3.559
179 HD23 LEU 23 2HD2 LEU 23 0.656 0.902 4.130
180 H ILE 24 H ILE 24 -0.638 -3.319 4.326
181 HA ILE 24 HA ILE 24 -1.842 -5.558 5.811
182 HB ILE 24 HB ILE 24 -2.204 -6.870 3.957
183 HG12 ILE 24 1HG1 ILE 24 -0.877 -5.748 1.746
184 HG13 ILE 24 2HG1 ILE 24 0.297 -5.739 3.058
185 HG21 ILE 24 1HG2 ILE 24 -2.400 -4.054 2.932
186 HG22 ILE 24 2HG2 ILE 24 -3.676 -5.029 3.665
187 HG23 ILE 24 3HG2 ILE 24 -3.037 -5.454 2.075
188 HD11 ILE 24 3HD1 ILE 24 0.455 -7.767 1.741
189 HD12 ILE 24 1HD1 ILE 24 -1.236 -8.131 2.085
190 HD13 ILE 24 2HD1 ILE 24 -0.052 -8.120 3.393
191 H ALA 25 H ALA 25 0.989 -4.136 4.327
192 HA ALA 25 HA ALA 25 2.732 -5.634 6.052
193 HB1 ALA 25 3HB ALA 25 2.956 -6.106 3.078
194 HB2 ALA 25 1HB ALA 25 2.348 -7.277 4.248
195 HB3 ALA 25 2HB ALA 25 4.025 -6.741 4.326
196 H LEU 26 H LEU 26 4.896 -4.915 5.952
197 HA LEU 26 HA LEU 26 5.094 -2.198 4.862
198 HB2 LEU 26 1HB LEU 26 6.398 -3.527 7.219
199 HB3 LEU 26 2HB LEU 26 6.883 -1.944 6.631
200 HG LEU 26 HG LEU 26 4.166 -2.684 7.734
201 HD11 LEU 26 1HD1 LEU 26 6.379 -0.987 8.872
202 HD12 LEU 26 2HD1 LEU 26 5.873 -2.574 9.453
203 HD13 LEU 26 3HD1 LEU 26 4.777 -1.198 9.579
204 HD21 LEU 26 3HD2 LEU 26 5.232 -0.072 6.674
205 HD22 LEU 26 1HD2 LEU 26 3.775 -0.218 7.654
206 HD23 LEU 26 2HD2 LEU 26 3.851 -0.989 6.074
207 H CYS 27 H CYS 27 6.732 -1.674 3.518
208 HA CYS 27 HA CYS 27 8.463 -3.897 2.662
209 HB2 CYS 27 1HB CYS 27 7.247 -1.628 1.071
210 HB3 CYS 27 2HB CYS 27 8.383 -2.793 0.409
211 HG CYS 27 HG CYS 27 6.043 -3.695 -0.577
212 H GLN 28 H GLN 28 10.375 -2.935 1.305
213 HA GLN 28 HA GLN 28 11.732 -0.966 2.963
214 HB2 GLN 28 1HB GLN 28 12.764 -2.569 0.621
215 HB3 GLN 28 2HB GLN 28 13.729 -1.521 1.643
216 HG2 GLN 28 1HG GLN 28 13.244 -2.944 3.568
217 HG3 GLN 28 2HG GLN 28 12.287 -4.006 2.539
218 HE21 GLN 28 1HE2 GLN 28 13.620 -5.749 3.041
219 HE22 GLN 28 2HE2 GLN 28 15.198 -5.918 2.359
220 H LYS 29 H LYS 29 13.190 0.570 1.608
221 HA LYS 29 HA LYS 29 13.425 2.306 0.140
222 HB2 LYS 29 1HB LYS 29 11.301 0.870 -1.434
223 HB3 LYS 29 2HB LYS 29 12.246 2.229 -2.022
224 HG2 LYS 29 1HG LYS 29 14.261 0.943 -1.957
225 HG3 LYS 29 2HG LYS 29 13.438 -0.393 -1.150
226 HD2 LYS 29 1HD LYS 29 12.820 0.611 -3.928
227 HD3 LYS 29 2HD LYS 29 13.795 -0.810 -3.554
228 HE2 LYS 29 1HE LYS 29 11.845 -1.799 -2.400
229 HE3 LYS 29 2HE LYS 29 10.883 -0.401 -2.877
230 HZ1 LYS 29 3HZ LYS 29 12.156 -2.371 -4.694
231 HZ2 LYS 29 1HZ LYS 29 11.352 -0.975 -5.204
232 HZ3 LYS 29 2HZ LYS 29 10.504 -2.190 -4.399
233 H SER 30 H SER 30 11.404 2.178 2.286
234 HA SER 30 HA SER 30 9.946 3.598 3.287
235 HB2 SER 30 1HB SER 30 11.304 5.430 2.371
236 HB3 SER 30 2HB SER 30 10.397 5.359 0.861
237 HG SER 30 HG SER 30 8.498 5.798 2.217
238 H LEU 31 H LEU 31 9.231 1.557 1.202
239 HA LEU 31 HA LEU 31 6.565 2.552 0.468
240 HB2 LEU 31 1HB LEU 31 8.173 0.219 -0.589
241 HB3 LEU 31 2HB LEU 31 6.529 0.569 -1.059
242 HG LEU 31 HG LEU 31 8.892 2.386 -1.531
243 HD11 LEU 31 1HD1 LEU 31 8.973 0.352 -2.888
244 HD12 LEU 31 2HD1 LEU 31 8.636 1.774 -3.872
245 HD13 LEU 31 3HD1 LEU 31 7.333 0.663 -3.453
246 HD21 LEU 31 3HD2 LEU 31 6.014 2.581 -2.402
247 HD22 LEU 31 1HD2 LEU 31 7.318 3.636 -2.949
248 HD23 LEU 31 2HD2 LEU 31 6.835 3.638 -1.253
249 H LYS 32 H LYS 32 4.719 1.261 0.957
250 HA LYS 32 HA LYS 32 5.220 -1.257 2.322
251 HB2 LYS 32 1HB LYS 32 3.860 -0.814 4.179
252 HB3 LYS 32 2HB LYS 32 4.890 0.593 4.005
253 HG2 LYS 32 1HG LYS 32 2.086 0.492 2.970
254 HG3 LYS 32 2HG LYS 32 2.494 1.002 4.614
255 HD2 LYS 32 1HD LYS 32 3.973 2.747 3.616
256 HD3 LYS 32 2HD LYS 32 3.377 2.282 2.022
257 HE2 LYS 32 1HE LYS 32 2.109 4.171 2.708
258 HE3 LYS 32 2HE LYS 32 1.058 2.765 2.858
259 HZ1 LYS 32 3HZ LYS 32 2.501 4.122 5.072
260 HZ2 LYS 32 1HZ LYS 32 1.560 2.728 5.247
261 HZ3 LYS 32 2HZ LYS 32 0.838 4.181 4.780
262 H CYS 33 H CYS 33 3.330 -2.667 2.380
263 HA CYS 33 HA CYS 33 2.160 -2.613 -0.235
264 HB2 CYS 33 1HB CYS 33 2.984 -4.703 0.831
265 HB3 CYS 33 2HB CYS 33 1.689 -4.573 2.017
266 HG CYS 33 HG CYS 33 1.116 -4.853 -1.340
267 H CYS 34 H CYS 34 0.537 -1.328 -0.608
268 HA CYS 34 HA CYS 34 -1.707 -1.269 1.295
269 HB2 CYS 34 1HB CYS 34 -1.178 0.680 -0.955
270 HB3 CYS 34 2HB CYS 34 -2.309 0.864 0.382
271 HG CYS 34 HG CYS 34 1.065 0.694 0.887
272 H ARG 35 H ARG 35 -3.545 -2.245 0.646
273 HA ARG 35 HA ARG 35 -3.790 -2.834 -2.222
274 HB2 ARG 35 1HB ARG 35 -4.810 -4.995 -1.653
275 HB3 ARG 35 2HB ARG 35 -3.177 -4.868 -1.048
276 HG2 ARG 35 1HG ARG 35 -4.133 -4.314 1.175
277 HG3 ARG 35 2HG ARG 35 -5.726 -4.668 0.512
278 HD2 ARG 35 1HD ARG 35 -3.445 -6.609 0.382
279 HD3 ARG 35 2HD ARG 35 -4.571 -6.583 1.738
280 HE ARG 35 HE ARG 35 -5.299 -7.154 -1.074
281 HH11 ARG 35 1HH1 ARG 35 -5.857 -7.516 2.367
282 HH12 ARG 35 2HH1 ARG 35 -7.096 -8.716 2.166
283 HH21 ARG 35 1HH2 ARG 35 -6.900 -8.761 -1.327
284 HH22 ARG 35 2HH2 ARG 35 -7.675 -9.436 0.079
285 H THR 36 H THR 36 -5.550 -2.193 -3.156
286 HA THR 36 HA THR 36 -7.444 -0.617 -1.759
287 HB THR 36 HB THR 36 -7.804 -1.597 -4.575
288 HG1 THR 36 HG1 THR 36 -5.757 0.023 -3.528
289 HG21 THR 36 1HG2 THR 36 -8.716 0.646 -4.917
290 HG22 THR 36 2HG2 THR 36 -8.338 1.067 -3.247
291 HG23 THR 36 3HG2 THR 36 -9.549 -0.167 -3.593
292 H ILE 37 H ILE 37 -9.381 -1.087 -1.017
293 HA ILE 37 HA ILE 37 -10.385 -3.648 -0.664
294 HB ILE 37 HB ILE 37 -11.878 -1.036 -0.783
295 HG12 ILE 37 1HG1 ILE 37 -9.829 -1.362 0.742
296 HG13 ILE 37 2HG1 ILE 37 -11.302 -0.760 1.471
297 HG21 ILE 37 1HG2 ILE 37 -13.532 -2.140 0.649
298 HG22 ILE 37 2HG2 ILE 37 -12.637 -3.653 0.520
299 HG23 ILE 37 3HG2 ILE 37 -13.395 -2.953 -0.910
300 HD11 ILE 37 3HD1 ILE 37 -10.432 -3.625 1.521
301 HD12 ILE 37 1HD1 ILE 37 -11.758 -2.905 2.429
302 HD13 ILE 37 2HD1 ILE 37 -10.087 -2.464 2.801
303 H GLN 38 H GLN 38 -11.329 -5.036 -1.987
304 HA GLN 38 HA GLN 38 -11.345 -4.637 -4.742
305 HB2 GLN 38 1HB GLN 38 -12.661 -6.762 -3.054
306 HB3 GLN 38 2HB GLN 38 -12.601 -6.817 -4.810
307 HG2 GLN 38 1HG GLN 38 -10.235 -6.808 -2.947
308 HG3 GLN 38 2HG GLN 38 -10.855 -8.190 -3.850
309 HE21 GLN 38 1HE2 GLN 38 -10.578 -8.254 -6.090
310 HE22 GLN 38 2HE2 GLN 38 -9.399 -7.272 -6.889
311 HA PRO 39 HA PRO 39 -15.096 -2.732 -5.918
312 HB2 PRO 39 1HB PRO 39 -15.533 -4.925 -7.865
313 HB3 PRO 39 2HB PRO 39 -15.396 -3.185 -8.138
314 HG2 PRO 39 1HG PRO 39 -13.404 -4.821 -8.795
315 HG3 PRO 39 2HG PRO 39 -13.079 -3.225 -8.093
316 HD2 PRO 39 1HD PRO 39 -12.994 -5.920 -6.796
317 HD3 PRO 39 2HD PRO 39 -11.900 -4.536 -6.598
318 H SER 40 H SER 40 -17.440 -3.539 -6.836
319 HA SER 40 HA SER 40 -18.935 -4.077 -4.648
320 HB2 SER 40 1HB SER 40 -19.635 -4.830 -7.482
321 HB3 SER 40 2HB SER 40 -20.785 -4.612 -6.164
322 HG SER 40 HG SER 40 -20.057 -2.431 -6.017
323 H GLY 41 H GLY 41 -17.639 -6.511 -6.838
324 HA2 GLY 41 1HA GLY 41 -19.111 -8.685 -5.758
325 HA3 GLY 41 2HA GLY 41 -17.669 -8.810 -6.747
326 H SER 42 H SER 42 -18.947 -9.497 -3.828
327 HA SER 42 HA SER 42 -18.194 -10.160 -1.817
328 HB2 SER 42 1HB SER 42 -15.622 -10.629 -3.329
329 HB3 SER 42 2HB SER 42 -16.041 -11.325 -1.764
330 HG SER 42 HG SER 42 -18.046 -11.838 -3.408
331 H ILE 43 H ILE 43 -15.886 -9.994 -0.436
332 HA ILE 43 HA ILE 43 -15.530 -7.129 -0.053
333 HB ILE 43 HB ILE 43 -14.127 -7.993 1.944
334 HG12 ILE 43 1HG1 ILE 43 -15.804 -10.458 1.549
335 HG13 ILE 43 2HG1 ILE 43 -14.175 -10.363 0.891
336 HG21 ILE 43 1HG2 ILE 43 -17.108 -8.453 1.841
337 HG22 ILE 43 2HG2 ILE 43 -16.304 -6.917 2.164
338 HG23 ILE 43 3HG2 ILE 43 -16.148 -8.252 3.306
339 HD11 ILE 43 3HD1 ILE 43 -13.304 -9.987 3.148
340 HD12 ILE 43 1HD1 ILE 43 -14.204 -11.499 3.036
341 HD13 ILE 43 2HD1 ILE 43 -14.944 -10.087 3.790
342 H ILE 44 H ILE 44 -13.014 -6.975 1.003
343 HA ILE 44 HA ILE 44 -11.344 -7.329 -1.326
344 HB ILE 44 HB ILE 44 -11.183 -5.284 0.048
345 HG12 ILE 44 1HG1 ILE 44 -8.690 -6.990 -0.086
346 HG13 ILE 44 2HG1 ILE 44 -9.272 -5.868 -1.309
347 HG21 ILE 44 1HG2 ILE 44 -10.033 -7.101 2.155
348 HG22 ILE 44 2HG2 ILE 44 -11.599 -6.292 2.223
349 HG23 ILE 44 3HG2 ILE 44 -10.113 -5.341 2.232
350 HD11 ILE 44 3HD1 ILE 44 -8.146 -5.201 1.395
351 HD12 ILE 44 1HD1 ILE 44 -8.911 -4.015 0.334
352 HD13 ILE 44 2HD1 ILE 44 -7.452 -4.852 -0.186
353 H ASP 45 H ASP 45 -11.796 -8.780 1.793
354 HA ASP 45 HA ASP 45 -10.881 -10.513 2.917
355 HB2 ASP 45 1HB ASP 45 -11.589 -11.772 0.893
356 HB3 ASP 45 2HB ASP 45 -10.002 -11.484 0.186
Start of MODEL 14
1 H PHE 1 1H PHE 1 9.455 -11.053 -1.623
2 HA PHE 1 HA PHE 1 8.521 -12.986 -0.542
3 HB2 PHE 1 1HB PHE 1 10.218 -12.049 1.778
4 HB3 PHE 1 2HB PHE 1 8.950 -13.263 1.898
5 HD1 PHE 1 HD2 PHE 1 9.227 -15.453 0.871
6 HD2 PHE 1 HD1 PHE 1 12.340 -12.558 0.766
7 HE1 PHE 1 HE2 PHE 1 10.828 -17.205 0.231
8 HE2 PHE 1 HE1 PHE 1 13.946 -14.305 0.121
9 HZ PHE 1 HZ PHE 1 13.193 -16.632 -0.146
10 H PHE 2 H PHE 2 9.189 -9.775 0.804
11 HA PHE 2 HA PHE 2 6.746 -9.470 2.163
12 HB2 PHE 2 1HB PHE 2 8.646 -7.427 1.010
13 HB3 PHE 2 2HB PHE 2 7.228 -6.994 1.956
14 HD1 PHE 2 HD2 PHE 2 7.046 -8.149 4.291
15 HD2 PHE 2 HD1 PHE 2 10.658 -7.730 2.082
16 HE1 PHE 2 HE2 PHE 2 8.341 -8.418 6.364
17 HE2 PHE 2 HE1 PHE 2 11.958 -7.997 4.153
18 HZ PHE 2 HZ PHE 2 10.801 -8.341 6.297
19 H ASP 3 H ASP 3 7.716 -8.232 -1.062
20 HA ASP 3 HA ASP 3 4.965 -7.510 -1.542
21 HB2 ASP 3 1HB ASP 3 5.683 -6.549 -3.629
22 HB3 ASP 3 2HB ASP 3 6.709 -5.990 -2.319
23 H GLU 4 H GLU 4 6.672 -10.291 -1.850
24 HA GLU 4 HA GLU 4 5.351 -11.396 -4.116
25 HB2 GLU 4 1HB GLU 4 7.345 -12.442 -2.987
26 HB3 GLU 4 2HB GLU 4 6.298 -12.862 -1.638
27 HG2 GLU 4 1HG GLU 4 4.928 -14.227 -3.141
28 HG3 GLU 4 2HG GLU 4 6.004 -13.821 -4.477
29 H LYS 5 H LYS 5 4.723 -11.210 -0.666
30 HA LYS 5 HA LYS 5 2.128 -12.326 -0.711
31 HB2 LYS 5 1HB LYS 5 3.570 -11.927 1.329
32 HB3 LYS 5 2HB LYS 5 3.182 -10.222 1.183
33 HG2 LYS 5 1HG LYS 5 1.782 -11.237 2.853
34 HG3 LYS 5 2HG LYS 5 0.800 -10.752 1.471
35 HD2 LYS 5 1HD LYS 5 0.123 -12.948 2.256
36 HD3 LYS 5 2HD LYS 5 0.842 -13.072 0.650
37 HE2 LYS 5 1HE LYS 5 2.957 -13.789 1.658
38 HE3 LYS 5 2HE LYS 5 2.233 -13.667 3.261
39 HZ1 LYS 5 3HZ LYS 5 0.677 -15.392 2.671
40 HZ2 LYS 5 1HZ LYS 5 2.254 -15.944 2.418
41 HZ3 LYS 5 2HZ LYS 5 1.302 -15.478 1.104
42 H CYS 6 H CYS 6 3.402 -9.062 -1.174
43 HA CYS 6 HA CYS 6 1.010 -7.627 -1.203
44 HB2 CYS 6 1HB CYS 6 3.329 -6.647 -1.217
45 HB3 CYS 6 2HB CYS 6 3.453 -7.087 -2.913
46 HG CYS 6 HG CYS 6 1.489 -5.354 -3.792
47 H ASN 7 H ASN 7 2.712 -9.289 -3.827
48 HA ASN 7 HA ASN 7 0.934 -8.585 -5.888
49 HB2 ASN 7 1HB ASN 7 3.174 -9.446 -6.333
50 HB3 ASN 7 2HB ASN 7 2.703 -10.993 -5.657
51 HD21 ASN 7 1HD2 ASN 7 2.311 -8.803 -8.324
52 HD22 ASN 7 2HD2 ASN 7 1.634 -9.952 -9.428
53 H LYS 8 H LYS 8 0.952 -11.219 -3.575
54 HA LYS 8 HA LYS 8 -1.154 -12.703 -4.765
55 HB2 LYS 8 1HB LYS 8 0.464 -13.645 -3.134
56 HB3 LYS 8 2HB LYS 8 -0.264 -12.665 -1.874
57 HG2 LYS 8 1HG LYS 8 -1.058 -14.945 -1.748
58 HG3 LYS 8 2HG LYS 8 -2.378 -13.852 -2.160
59 HD2 LYS 8 1HD LYS 8 -2.684 -15.692 -3.573
60 HD3 LYS 8 2HD LYS 8 -1.905 -14.489 -4.595
61 HE2 LYS 8 1HE LYS 8 -0.426 -16.701 -3.180
62 HE3 LYS 8 2HE LYS 8 -1.031 -16.832 -4.827
63 HZ1 LYS 8 3HZ LYS 8 0.356 -14.826 -5.336
64 HZ2 LYS 8 1HZ LYS 8 1.228 -16.225 -4.957
65 HZ3 LYS 8 2HZ LYS 8 1.062 -15.001 -3.810
66 H LEU 9 H LEU 9 -1.043 -10.067 -2.449
67 HA LEU 9 HA LEU 9 -3.906 -10.137 -2.016
68 HB2 LEU 9 1HB LEU 9 -1.686 -8.375 -1.055
69 HB3 LEU 9 2HB LEU 9 -3.344 -7.835 -0.911
70 HG LEU 9 HG LEU 9 -2.660 -8.777 1.180
71 HD11 LEU 9 1HD1 LEU 9 -4.333 -10.484 1.506
72 HD12 LEU 9 2HD1 LEU 9 -4.444 -10.744 -0.233
73 HD13 LEU 9 3HD1 LEU 9 -4.958 -9.207 0.462
74 HD21 LEU 9 3HD2 LEU 9 -2.002 -11.311 -0.307
75 HD22 LEU 9 1HD2 LEU 9 -1.898 -11.059 1.436
76 HD23 LEU 9 2HD2 LEU 9 -0.826 -10.171 0.350
77 H LYS 10 H LYS 10 -1.923 -9.080 -4.429
78 HA LYS 10 HA LYS 10 -2.283 -7.935 -6.348
79 HB2 LYS 10 1HB LYS 10 -5.145 -7.774 -5.383
80 HB3 LYS 10 2HB LYS 10 -4.598 -7.368 -7.001
81 HG2 LYS 10 1HG LYS 10 -4.387 -10.093 -5.734
82 HG3 LYS 10 2HG LYS 10 -5.641 -9.590 -6.868
83 HD2 LYS 10 1HD LYS 10 -2.683 -9.628 -7.461
84 HD3 LYS 10 2HD LYS 10 -3.826 -10.885 -7.937
85 HE2 LYS 10 1HE LYS 10 -5.082 -9.212 -9.239
86 HE3 LYS 10 2HE LYS 10 -3.887 -7.995 -8.796
87 HZ1 LYS 10 3HZ LYS 10 -3.426 -8.866 -10.979
88 HZ2 LYS 10 1HZ LYS 10 -3.375 -10.450 -10.387
89 HZ3 LYS 10 2HZ LYS 10 -2.195 -9.334 -9.918
90 H GLY 11 H GLY 11 -1.363 -6.593 -4.028
91 HA2 GLY 11 1HA GLY 11 -2.508 -3.898 -4.437
92 HA3 GLY 11 2HA GLY 11 -1.742 -4.430 -2.946
93 H THR 12 H THR 12 -0.769 -2.168 -3.803
94 HA THR 12 HA THR 12 1.778 -2.896 -5.110
95 HB THR 12 HB THR 12 0.539 -0.161 -5.338
96 HG1 THR 12 HG1 THR 12 -0.941 -1.581 -6.303
97 HG21 THR 12 1HG2 THR 12 2.569 -1.635 -7.020
98 HG22 THR 12 2HG2 THR 12 2.921 -0.357 -5.857
99 HG23 THR 12 3HG2 THR 12 1.988 0.006 -7.308
100 H CYS 13 H CYS 13 3.642 -1.818 -4.319
101 HA CYS 13 HA CYS 13 3.418 -0.925 -1.575
102 HB2 CYS 13 1HB CYS 13 5.986 -0.849 -3.135
103 HB3 CYS 13 2HB CYS 13 5.731 -1.169 -1.425
104 HG CYS 13 HG CYS 13 5.820 -3.298 -3.983
105 H LYS 14 H LYS 14 2.610 1.063 -1.388
106 HA LYS 14 HA LYS 14 3.911 3.204 -2.925
107 HB2 LYS 14 1HB LYS 14 1.753 4.429 -2.886
108 HB3 LYS 14 2HB LYS 14 1.674 2.932 -3.803
109 HG2 LYS 14 1HG LYS 14 0.609 1.831 -1.885
110 HG3 LYS 14 2HG LYS 14 0.657 3.358 -1.002
111 HD2 LYS 14 1HD LYS 14 -1.537 3.082 -1.931
112 HD3 LYS 14 2HD LYS 14 -0.716 4.377 -2.804
113 HE2 LYS 14 1HE LYS 14 -0.215 2.856 -4.631
114 HE3 LYS 14 2HE LYS 14 -0.942 1.517 -3.744
115 HZ1 LYS 14 3HZ LYS 14 -3.067 2.785 -3.796
116 HZ2 LYS 14 1HZ LYS 14 -2.509 2.305 -5.325
117 HZ3 LYS 14 2HZ LYS 14 -2.322 3.908 -4.827
118 H ASN 15 H ASN 15 3.640 5.382 -1.789
119 HA ASN 15 HA ASN 15 4.669 5.039 0.841
120 HB2 ASN 15 1HB ASN 15 4.084 7.426 -0.874
121 HB3 ASN 15 2HB ASN 15 4.573 7.615 0.804
122 HD21 ASN 15 1HD2 ASN 15 6.661 6.990 1.420
123 HD22 ASN 15 2HD2 ASN 15 7.919 6.770 0.252
124 H ASN 16 H ASN 16 1.694 6.499 -0.456
125 HA ASN 16 HA ASN 16 0.506 6.128 2.217
126 HB2 ASN 16 1HB ASN 16 -0.695 8.184 2.029
127 HB3 ASN 16 2HB ASN 16 0.978 8.551 1.626
128 HD21 ASN 16 1HD2 ASN 16 1.527 8.853 -0.587
129 HD22 ASN 16 2HD2 ASN 16 0.329 9.367 -1.724
130 H CYS 17 H CYS 17 -1.576 5.327 2.259
131 HA CYS 17 HA CYS 17 -2.356 3.774 0.010
132 HB2 CYS 17 1HB CYS 17 -4.033 4.418 2.440
133 HB3 CYS 17 2HB CYS 17 -4.188 3.031 1.374
134 HG CYS 17 HG CYS 17 -1.422 2.269 2.176
135 H GLY 18 H GLY 18 -4.014 4.061 -1.426
136 HA2 GLY 18 1HA GLY 18 -4.964 6.789 -1.746
137 HA3 GLY 18 2HA GLY 18 -5.144 5.473 -2.898
138 H LYS 19 H LYS 19 -7.351 6.168 -3.120
139 HA LYS 19 HA LYS 19 -9.176 6.299 -1.022
140 HB2 LYS 19 1HB LYS 19 -10.919 5.900 -2.812
141 HB3 LYS 19 2HB LYS 19 -9.833 7.251 -3.080
142 HG2 LYS 19 1HG LYS 19 -9.865 6.340 -5.166
143 HG3 LYS 19 2HG LYS 19 -8.492 5.473 -4.484
144 HD2 LYS 19 1HD LYS 19 -9.910 3.559 -3.999
145 HD3 LYS 19 2HD LYS 19 -11.324 4.432 -4.589
146 HE2 LYS 19 1HE LYS 19 -10.522 2.880 -6.275
147 HE3 LYS 19 2HE LYS 19 -10.315 4.542 -6.821
148 HZ1 LYS 19 3HZ LYS 19 -8.180 2.830 -5.671
149 HZ2 LYS 19 1HZ LYS 19 -7.983 4.413 -6.224
150 HZ3 LYS 19 2HZ LYS 19 -8.377 3.180 -7.310
151 H ASN 20 H ASN 20 -9.934 4.869 0.293
152 HA ASN 20 HA ASN 20 -10.575 2.935 1.272
153 HB2 ASN 20 1HB ASN 20 -12.245 3.155 -0.622
154 HB3 ASN 20 2HB ASN 20 -11.273 1.988 -1.510
155 HD21 ASN 20 1HD2 ASN 20 -13.071 0.597 -1.558
156 HD22 ASN 20 2HD2 ASN 20 -13.522 -0.333 -0.172
157 H GLU 21 H GLU 21 -7.869 3.061 0.829
158 HA GLU 21 HA GLU 21 -7.236 0.233 0.314
159 HB2 GLU 21 1HB GLU 21 -5.566 2.700 -0.144
160 HB3 GLU 21 2HB GLU 21 -4.854 1.098 -0.050
161 HG2 GLU 21 1HG GLU 21 -6.405 0.427 -1.907
162 HG3 GLU 21 2HG GLU 21 -6.817 2.129 -2.073
163 H GLU 22 H GLU 22 -6.146 -0.883 1.826
164 HA GLU 22 HA GLU 22 -5.593 0.520 4.350
165 HB2 GLU 22 1HB GLU 22 -6.004 -1.547 5.499
166 HB3 GLU 22 2HB GLU 22 -7.342 -1.275 4.395
167 HG2 GLU 22 1HG GLU 22 -6.514 -2.905 2.871
168 HG3 GLU 22 2HG GLU 22 -5.004 -3.054 3.769
169 H LEU 23 H LEU 23 -3.712 -0.148 5.558
170 HA LEU 23 HA LEU 23 -1.448 -0.724 3.849
171 HB2 LEU 23 1HB LEU 23 -1.717 0.850 6.027
172 HB3 LEU 23 2HB LEU 23 -1.139 -0.615 6.795
173 HG LEU 23 HG LEU 23 0.933 -0.543 5.576
174 HD11 LEU 23 1HD1 LEU 23 0.332 0.083 3.410
175 HD12 LEU 23 2HD1 LEU 23 1.288 1.443 4.004
176 HD13 LEU 23 3HD1 LEU 23 -0.471 1.556 3.958
177 HD21 LEU 23 3HD2 LEU 23 0.791 0.916 7.527
178 HD22 LEU 23 1HD2 LEU 23 0.195 2.229 6.511
179 HD23 LEU 23 2HD2 LEU 23 1.831 1.611 6.284
180 H ILE 24 H ILE 24 -0.776 -2.679 3.448
181 HA ILE 24 HA ILE 24 -1.918 -4.872 5.029
182 HB ILE 24 HB ILE 24 -2.185 -6.107 3.129
183 HG12 ILE 24 1HG1 ILE 24 -0.227 -4.627 1.434
184 HG13 ILE 24 2HG1 ILE 24 0.421 -5.702 2.671
185 HG21 ILE 24 1HG2 ILE 24 -2.806 -4.622 1.244
186 HG22 ILE 24 2HG2 ILE 24 -2.087 -3.271 2.121
187 HG23 ILE 24 3HG2 ILE 24 -3.479 -4.119 2.795
188 HD11 ILE 24 3HD1 ILE 24 0.251 -6.853 0.582
189 HD12 ILE 24 1HD1 ILE 24 -1.463 -6.451 0.465
190 HD13 ILE 24 2HD1 ILE 24 -0.895 -7.528 1.740
191 H ALA 25 H ALA 25 1.097 -3.579 3.799
192 HA ALA 25 HA ALA 25 2.643 -5.298 5.504
193 HB1 ALA 25 3HB ALA 25 3.872 -6.465 3.756
194 HB2 ALA 25 1HB ALA 25 2.863 -5.712 2.521
195 HB3 ALA 25 2HB ALA 25 2.153 -6.852 3.663
196 H LEU 26 H LEU 26 5.031 -5.031 4.946
197 HA LEU 26 HA LEU 26 5.508 -2.244 4.155
198 HB2 LEU 26 1HB LEU 26 5.620 -2.379 6.523
199 HB3 LEU 26 2HB LEU 26 6.622 -3.809 6.471
200 HG LEU 26 HG LEU 26 8.422 -2.370 5.441
201 HD11 LEU 26 1HD1 LEU 26 6.409 -0.234 6.108
202 HD12 LEU 26 2HD1 LEU 26 7.219 -0.546 4.568
203 HD13 LEU 26 3HD1 LEU 26 8.137 0.096 5.930
204 HD21 LEU 26 3HD2 LEU 26 9.064 -1.344 7.568
205 HD22 LEU 26 1HD2 LEU 26 8.461 -2.986 7.797
206 HD23 LEU 26 2HD2 LEU 26 7.432 -1.607 8.185
207 H CYS 27 H CYS 27 7.382 -1.824 3.076
208 HA CYS 27 HA CYS 27 8.829 -4.171 2.052
209 HB2 CYS 27 1HB CYS 27 7.261 -2.120 0.577
210 HB3 CYS 27 2HB CYS 27 8.746 -2.686 -0.173
211 HG CYS 27 HG CYS 27 5.791 -4.123 -0.071
212 H GLN 28 H GLN 28 10.636 -3.192 0.452
213 HA GLN 28 HA GLN 28 12.436 -1.767 2.134
214 HB2 GLN 28 1HB GLN 28 12.674 -2.308 -0.823
215 HB3 GLN 28 2HB GLN 28 13.978 -1.856 0.258
216 HG2 GLN 28 1HG GLN 28 13.790 -3.937 1.443
217 HG3 GLN 28 2HG GLN 28 12.377 -4.391 0.494
218 HE21 GLN 28 1HE2 GLN 28 15.828 -4.063 0.525
219 HE22 GLN 28 2HE2 GLN 28 16.123 -4.905 -0.956
220 H LYS 29 H LYS 29 13.652 0.180 1.165
221 HA LYS 29 HA LYS 29 13.639 2.416 0.711
222 HB2 LYS 29 1HB LYS 29 11.328 1.685 -1.080
223 HB3 LYS 29 2HB LYS 29 12.187 3.216 -1.115
224 HG2 LYS 29 1HG LYS 29 14.236 2.034 -1.770
225 HG3 LYS 29 2HG LYS 29 13.344 0.511 -1.758
226 HD2 LYS 29 1HD LYS 29 12.780 2.893 -3.529
227 HD3 LYS 29 2HD LYS 29 13.543 1.384 -4.030
228 HE2 LYS 29 1HE LYS 29 11.506 0.159 -3.515
229 HE3 LYS 29 2HE LYS 29 10.744 1.636 -2.932
230 HZ1 LYS 29 3HZ LYS 29 11.629 1.124 -5.718
231 HZ2 LYS 29 1HZ LYS 29 10.933 2.561 -5.163
232 HZ3 LYS 29 2HZ LYS 29 10.034 1.133 -5.167
233 H SER 30 H SER 30 11.714 1.085 2.661
234 HA SER 30 HA SER 30 10.132 1.549 4.169
235 HB2 SER 30 1HB SER 30 9.861 3.801 4.996
236 HB3 SER 30 2HB SER 30 11.563 3.520 4.650
237 HG SER 30 HG SER 30 10.795 4.512 2.467
238 H LEU 31 H LEU 31 9.426 1.292 1.249
239 HA LEU 31 HA LEU 31 6.918 2.672 1.017
240 HB2 LEU 31 1HB LEU 31 8.346 0.526 -0.508
241 HB3 LEU 31 2HB LEU 31 6.643 0.774 -0.790
242 HG LEU 31 HG LEU 31 8.313 1.927 -2.348
243 HD11 LEU 31 1HD1 LEU 31 6.204 3.617 -1.013
244 HD12 LEU 31 2HD1 LEU 31 5.904 2.416 -2.271
245 HD13 LEU 31 3HD1 LEU 31 6.865 3.849 -2.632
246 HD21 LEU 31 3HD2 LEU 31 8.475 3.839 -0.034
247 HD22 LEU 31 1HD2 LEU 31 9.122 4.103 -1.653
248 HD23 LEU 31 2HD2 LEU 31 9.793 2.833 -0.631
249 H LYS 32 H LYS 32 4.824 1.676 1.138
250 HA LYS 32 HA LYS 32 4.797 -0.876 2.600
251 HB2 LYS 32 1HB LYS 32 3.231 1.614 3.187
252 HB3 LYS 32 2HB LYS 32 2.645 0.034 3.683
253 HG2 LYS 32 1HG LYS 32 3.760 0.526 5.571
254 HG3 LYS 32 2HG LYS 32 5.123 -0.099 4.653
255 HD2 LYS 32 1HD LYS 32 5.920 1.907 5.546
256 HD3 LYS 32 2HD LYS 32 5.502 2.306 3.882
257 HE2 LYS 32 1HE LYS 32 3.615 2.764 6.181
258 HE3 LYS 32 2HE LYS 32 4.804 3.963 5.684
259 HZ1 LYS 32 3HZ LYS 32 2.714 4.448 4.662
260 HZ2 LYS 32 1HZ LYS 32 2.586 2.886 4.034
261 HZ3 LYS 32 2HZ LYS 32 3.782 3.932 3.458
262 H CYS 33 H CYS 33 3.090 -2.266 2.180
263 HA CYS 33 HA CYS 33 2.121 -1.989 -0.529
264 HB2 CYS 33 1HB CYS 33 1.924 -4.242 1.470
265 HB3 CYS 33 2HB CYS 33 1.385 -4.330 -0.199
266 HG CYS 33 HG CYS 33 3.854 -4.199 -1.344
267 H CYS 34 H CYS 34 0.125 -1.430 -1.079
268 HA CYS 34 HA CYS 34 -1.923 -1.369 1.039
269 HB2 CYS 34 1HB CYS 34 -1.630 0.567 -1.270
270 HB3 CYS 34 2HB CYS 34 -2.835 0.644 0.012
271 HG CYS 34 HG CYS 34 0.498 0.824 0.717
272 H ARG 35 H ARG 35 -3.845 -2.289 0.578
273 HA ARG 35 HA ARG 35 -4.246 -3.201 -2.199
274 HB2 ARG 35 1HB ARG 35 -5.367 -5.177 -1.392
275 HB3 ARG 35 2HB ARG 35 -3.796 -5.069 -0.621
276 HG2 ARG 35 1HG ARG 35 -5.082 -3.961 1.326
277 HG3 ARG 35 2HG ARG 35 -6.511 -4.661 0.563
278 HD2 ARG 35 1HD ARG 35 -5.426 -6.886 0.672
279 HD3 ARG 35 2HD ARG 35 -4.062 -6.157 1.500
280 HE ARG 35 HE ARG 35 -6.569 -5.659 2.810
281 HH11 ARG 35 1HH1 ARG 35 -3.925 -7.942 2.469
282 HH12 ARG 35 2HH1 ARG 35 -4.193 -8.666 4.019
283 HH21 ARG 35 1HH2 ARG 35 -6.909 -6.617 4.835
284 HH22 ARG 35 2HH2 ARG 35 -5.889 -7.925 5.355
285 H THR 36 H THR 36 -6.138 -2.738 -3.160
286 HA THR 36 HA THR 36 -7.807 -0.793 -1.825
287 HB THR 36 HB THR 36 -8.284 -1.881 -4.592
288 HG1 THR 36 HG1 THR 36 -6.148 -0.382 -3.657
289 HG21 THR 36 1HG2 THR 36 -9.995 -0.410 -3.649
290 HG22 THR 36 2HG2 THR 36 -9.152 0.386 -4.978
291 HG23 THR 36 3HG2 THR 36 -8.771 0.812 -3.310
292 H ILE 37 H ILE 37 -9.543 -1.281 -0.724
293 HA ILE 37 HA ILE 37 -10.510 -3.890 -0.470
294 HB ILE 37 HB ILE 37 -11.639 -1.239 0.382
295 HG12 ILE 37 1HG1 ILE 37 -9.449 -2.570 1.205
296 HG13 ILE 37 2HG1 ILE 37 -10.401 -1.536 2.265
297 HG21 ILE 37 1HG2 ILE 37 -12.626 -4.005 1.083
298 HG22 ILE 37 2HG2 ILE 37 -13.503 -2.785 0.161
299 HG23 ILE 37 3HG2 ILE 37 -13.140 -2.512 1.865
300 HD11 ILE 37 3HD1 ILE 37 -9.735 -3.807 3.132
301 HD12 ILE 37 1HD1 ILE 37 -10.881 -4.473 1.971
302 HD13 ILE 37 2HD1 ILE 37 -11.448 -3.400 3.251
303 H GLN 38 H GLN 38 -11.401 -4.932 -2.018
304 HA GLN 38 HA GLN 38 -13.493 -3.655 -3.649
305 HB2 GLN 38 1HB GLN 38 -13.011 -5.366 -5.349
306 HB3 GLN 38 2HB GLN 38 -11.576 -4.423 -4.974
307 HG2 GLN 38 1HG GLN 38 -10.759 -6.229 -3.547
308 HG3 GLN 38 2HG GLN 38 -12.199 -7.174 -3.918
309 HE21 GLN 38 1HE2 GLN 38 -12.210 -6.260 -6.715
310 HE22 GLN 38 2HE2 GLN 38 -10.948 -7.144 -7.497
311 HA PRO 39 HA PRO 39 -16.344 -6.434 -1.692
312 HB2 PRO 39 1HB PRO 39 -18.271 -6.579 -3.567
313 HB3 PRO 39 2HB PRO 39 -18.026 -5.133 -2.575
314 HG2 PRO 39 1HG PRO 39 -16.986 -5.739 -5.305
315 HG3 PRO 39 2HG PRO 39 -17.842 -4.280 -4.769
316 HD2 PRO 39 1HD PRO 39 -15.183 -4.305 -4.982
317 HD3 PRO 39 2HD PRO 39 -15.962 -3.498 -3.602
318 H SER 40 H SER 40 -15.840 -8.519 -1.467
319 HA SER 40 HA SER 40 -16.300 -10.502 -3.372
320 HB2 SER 40 1HB SER 40 -14.274 -9.305 -4.419
321 HB3 SER 40 2HB SER 40 -13.341 -9.961 -3.074
322 HG SER 40 HG SER 40 -14.497 -11.256 -5.257
323 H GLY 41 H GLY 41 -15.491 -12.618 -2.628
324 HA2 GLY 41 1HA GLY 41 -15.514 -12.711 0.266
325 HA3 GLY 41 2HA GLY 41 -15.589 -14.087 -0.823
326 H SER 42 H SER 42 -13.799 -12.840 1.519
327 HA SER 42 HA SER 42 -11.706 -13.238 2.295
328 HB2 SER 42 1HB SER 42 -11.414 -15.098 -0.080
329 HB3 SER 42 2HB SER 42 -10.456 -15.119 1.401
330 HG SER 42 HG SER 42 -12.964 -15.266 2.156
331 H ILE 43 H ILE 43 -9.388 -13.877 0.603
332 HA ILE 43 HA ILE 43 -7.770 -12.924 -0.657
333 HB ILE 43 HB ILE 43 -9.819 -10.869 -1.521
334 HG12 ILE 43 1HG1 ILE 43 -8.842 -13.366 -2.933
335 HG13 ILE 43 2HG1 ILE 43 -10.423 -13.175 -2.184
336 HG21 ILE 43 1HG2 ILE 43 -8.254 -10.397 -3.345
337 HG22 ILE 43 2HG2 ILE 43 -7.109 -11.552 -2.664
338 HG23 ILE 43 3HG2 ILE 43 -7.518 -10.087 -1.772
339 HD11 ILE 43 3HD1 ILE 43 -10.516 -12.909 -4.605
340 HD12 ILE 43 1HD1 ILE 43 -9.382 -11.563 -4.501
341 HD13 ILE 43 2HD1 ILE 43 -10.982 -11.427 -3.772
342 H ILE 44 H ILE 44 -9.612 -10.002 0.226
343 HA ILE 44 HA ILE 44 -7.152 -8.931 1.373
344 HB ILE 44 HB ILE 44 -8.308 -6.774 1.428
345 HG12 ILE 44 1HG1 ILE 44 -10.642 -8.297 0.255
346 HG13 ILE 44 2HG1 ILE 44 -10.588 -7.526 1.837
347 HG21 ILE 44 1HG2 ILE 44 -8.536 -6.432 -0.994
348 HG22 ILE 44 2HG2 ILE 44 -8.518 -8.185 -1.226
349 HG23 ILE 44 3HG2 ILE 44 -7.095 -7.367 -0.580
350 HD11 ILE 44 3HD1 ILE 44 -10.172 -5.353 0.587
351 HD12 ILE 44 1HD1 ILE 44 -11.789 -6.058 0.469
352 HD13 ILE 44 2HD1 ILE 44 -10.650 -6.239 -0.865
353 H ASP 45 H ASP 45 -8.867 -10.985 2.700
354 HA ASP 45 HA ASP 45 -9.488 -9.495 5.159
355 HB2 ASP 45 1HB ASP 45 -10.574 -12.101 4.096
356 HB3 ASP 45 2HB ASP 45 -10.777 -11.613 5.774
Start of MODEL 15
1 H PHE 1 1H PHE 1 9.168 -11.676 1.041
2 HA PHE 1 HA PHE 1 7.536 -14.111 1.371
3 HB2 PHE 1 1HB PHE 1 9.045 -12.475 3.420
4 HB3 PHE 1 2HB PHE 1 7.983 -13.828 3.783
5 HD1 PHE 1 HD2 PHE 1 8.607 -16.069 2.536
6 HD2 PHE 1 HD1 PHE 1 11.300 -12.857 3.272
7 HE1 PHE 1 HE2 PHE 1 10.507 -17.617 2.320
8 HE2 PHE 1 HE1 PHE 1 13.205 -14.398 3.056
9 HZ PHE 1 HZ PHE 1 12.810 -16.781 2.580
10 H PHE 2 H PHE 2 7.848 -11.013 3.088
11 HA PHE 2 HA PHE 2 5.123 -10.856 3.694
12 HB2 PHE 2 1HB PHE 2 7.104 -8.581 3.527
13 HB3 PHE 2 2HB PHE 2 5.566 -8.550 4.379
14 HD1 PHE 2 HD2 PHE 2 5.250 -10.278 6.261
15 HD2 PHE 2 HD1 PHE 2 9.034 -9.223 4.628
16 HE1 PHE 2 HE2 PHE 2 6.360 -11.137 8.280
17 HE2 PHE 2 HE1 PHE 2 10.150 -10.081 6.644
18 HZ PHE 2 HZ PHE 2 8.812 -11.039 8.475
19 H ASP 3 H ASP 3 6.986 -9.195 1.142
20 HA ASP 3 HA ASP 3 4.469 -8.258 0.046
21 HB2 ASP 3 1HB ASP 3 5.767 -6.934 -1.519
22 HB3 ASP 3 2HB ASP 3 6.268 -6.627 0.136
23 H GLU 4 H GLU 4 5.993 -11.075 -0.116
24 HA GLU 4 HA GLU 4 5.368 -11.642 -2.883
25 HB2 GLU 4 1HB GLU 4 7.036 -13.010 -1.623
26 HB3 GLU 4 2HB GLU 4 5.745 -13.568 -0.568
27 HG2 GLU 4 1HG GLU 4 6.257 -15.239 -2.234
28 HG3 GLU 4 2HG GLU 4 4.631 -14.605 -2.485
29 H LYS 5 H LYS 5 3.939 -12.004 0.308
30 HA LYS 5 HA LYS 5 1.390 -12.877 -0.443
31 HB2 LYS 5 1HB LYS 5 2.201 -12.750 1.889
32 HB3 LYS 5 2HB LYS 5 2.182 -10.999 1.789
33 HG2 LYS 5 1HG LYS 5 0.251 -11.771 2.996
34 HG3 LYS 5 2HG LYS 5 -0.255 -11.065 1.460
35 HD2 LYS 5 1HD LYS 5 -0.629 -13.206 0.502
36 HD3 LYS 5 2HD LYS 5 0.170 -14.019 1.850
37 HE2 LYS 5 1HE LYS 5 -2.276 -14.209 1.979
38 HE3 LYS 5 2HE LYS 5 -1.611 -13.325 3.352
39 HZ1 LYS 5 3HZ LYS 5 -2.245 -11.255 2.272
40 HZ2 LYS 5 1HZ LYS 5 -3.591 -12.254 2.492
41 HZ3 LYS 5 2HZ LYS 5 -2.888 -12.109 0.963
42 H CYS 6 H CYS 6 2.845 -9.654 -0.255
43 HA CYS 6 HA CYS 6 0.603 -8.139 -0.995
44 HB2 CYS 6 1HB CYS 6 2.754 -7.217 -0.105
45 HB3 CYS 6 2HB CYS 6 3.503 -7.578 -1.654
46 HG CYS 6 HG CYS 6 1.794 -5.807 -3.074
47 H ASN 7 H ASN 7 3.132 -9.660 -2.937
48 HA ASN 7 HA ASN 7 2.352 -8.831 -5.477
49 HB2 ASN 7 1HB ASN 7 4.468 -9.968 -5.041
50 HB3 ASN 7 2HB ASN 7 3.616 -11.440 -4.608
51 HD21 ASN 7 1HD2 ASN 7 4.621 -12.659 -6.155
52 HD22 ASN 7 2HD2 ASN 7 4.290 -12.481 -7.848
53 H LYS 8 H LYS 8 1.551 -11.860 -3.806
54 HA LYS 8 HA LYS 8 -0.208 -12.864 -5.740
55 HB2 LYS 8 1HB LYS 8 0.861 -14.010 -3.673
56 HB3 LYS 8 2HB LYS 8 -0.540 -13.407 -2.808
57 HG2 LYS 8 1HG LYS 8 -0.739 -15.138 -5.257
58 HG3 LYS 8 2HG LYS 8 -0.692 -15.778 -3.616
59 HD2 LYS 8 1HD LYS 8 -2.725 -14.598 -3.058
60 HD3 LYS 8 2HD LYS 8 -2.740 -13.815 -4.637
61 HE2 LYS 8 1HE LYS 8 -3.000 -16.000 -5.711
62 HE3 LYS 8 2HE LYS 8 -2.993 -16.777 -4.129
63 HZ1 LYS 8 3HZ LYS 8 -4.995 -14.785 -5.043
64 HZ2 LYS 8 1HZ LYS 8 -5.002 -15.599 -3.562
65 HZ3 LYS 8 2HZ LYS 8 -5.236 -16.457 -4.998
66 H LEU 9 H LEU 9 -0.858 -10.933 -2.829
67 HA LEU 9 HA LEU 9 -3.677 -10.908 -3.167
68 HB2 LEU 9 1HB LEU 9 -2.532 -10.709 -1.033
69 HB3 LEU 9 2HB LEU 9 -1.793 -9.213 -1.547
70 HG LEU 9 HG LEU 9 -3.971 -8.112 -1.532
71 HD11 LEU 9 1HD1 LEU 9 -5.381 -10.034 -2.095
72 HD12 LEU 9 2HD1 LEU 9 -5.922 -9.258 -0.606
73 HD13 LEU 9 3HD1 LEU 9 -5.009 -10.764 -0.533
74 HD21 LEU 9 3HD2 LEU 9 -2.533 -8.179 0.436
75 HD22 LEU 9 1HD2 LEU 9 -3.336 -9.649 0.971
76 HD23 LEU 9 2HD2 LEU 9 -4.238 -8.136 0.885
77 H LYS 10 H LYS 10 -1.226 -9.330 -4.786
78 HA LYS 10 HA LYS 10 -1.184 -7.782 -6.426
79 HB2 LYS 10 1HB LYS 10 -4.192 -7.874 -6.186
80 HB3 LYS 10 2HB LYS 10 -3.306 -7.055 -7.467
81 HG2 LYS 10 1HG LYS 10 -2.242 -9.301 -7.968
82 HG3 LYS 10 2HG LYS 10 -3.471 -9.999 -6.912
83 HD2 LYS 10 1HD LYS 10 -5.224 -9.063 -8.318
84 HD3 LYS 10 2HD LYS 10 -4.003 -8.312 -9.346
85 HE2 LYS 10 1HE LYS 10 -4.363 -11.276 -8.907
86 HE3 LYS 10 2HE LYS 10 -4.868 -10.380 -10.338
87 HZ1 LYS 10 3HZ LYS 10 -2.533 -9.803 -10.723
88 HZ2 LYS 10 1HZ LYS 10 -2.777 -11.476 -10.729
89 HZ3 LYS 10 2HZ LYS 10 -2.077 -10.734 -9.385
90 H GLY 11 H GLY 11 -0.910 -7.026 -3.723
91 HA2 GLY 11 1HA GLY 11 -2.203 -4.432 -3.468
92 HA3 GLY 11 2HA GLY 11 -1.076 -5.157 -2.328
93 H THR 12 H THR 12 -1.145 -2.458 -3.542
94 HA THR 12 HA THR 12 1.303 -2.501 -5.152
95 HB THR 12 HB THR 12 0.676 0.016 -5.381
96 HG1 THR 12 HG1 THR 12 -1.131 -0.548 -3.710
97 HG21 THR 12 1HG2 THR 12 -1.004 -2.136 -6.669
98 HG22 THR 12 2HG2 THR 12 0.604 -1.631 -7.193
99 HG23 THR 12 3HG2 THR 12 -0.752 -0.504 -7.291
100 H CYS 13 H CYS 13 3.187 -1.781 -4.391
101 HA CYS 13 HA CYS 13 3.314 -0.846 -1.651
102 HB2 CYS 13 1HB CYS 13 5.728 -0.900 -3.421
103 HB3 CYS 13 2HB CYS 13 5.573 -1.309 -1.719
104 HG CYS 13 HG CYS 13 5.817 -3.805 -2.243
105 H LYS 14 H LYS 14 2.798 1.187 -1.319
106 HA LYS 14 HA LYS 14 3.918 3.242 -3.090
107 HB2 LYS 14 1HB LYS 14 1.747 4.492 -2.845
108 HB3 LYS 14 2HB LYS 14 1.654 3.035 -3.825
109 HG2 LYS 14 1HG LYS 14 0.686 1.816 -1.968
110 HG3 LYS 14 2HG LYS 14 0.836 3.238 -0.935
111 HD2 LYS 14 1HD LYS 14 -1.437 3.031 -1.732
112 HD3 LYS 14 2HD LYS 14 -0.680 4.460 -2.434
113 HE2 LYS 14 1HE LYS 14 -0.306 3.273 -4.512
114 HE3 LYS 14 2HE LYS 14 -0.956 1.791 -3.812
115 HZ1 LYS 14 3HZ LYS 14 -2.460 4.309 -4.238
116 HZ2 LYS 14 1HZ LYS 14 -3.089 2.896 -3.546
117 HZ3 LYS 14 2HZ LYS 14 -2.600 2.909 -5.170
118 H ASN 15 H ASN 15 3.457 5.505 -1.947
119 HA ASN 15 HA ASN 15 4.806 5.297 0.566
120 HB2 ASN 15 1HB ASN 15 4.933 7.191 -1.223
121 HB3 ASN 15 2HB ASN 15 3.536 7.812 -0.369
122 HD21 ASN 15 1HD2 ASN 15 6.168 8.971 -0.607
123 HD22 ASN 15 2HD2 ASN 15 6.768 9.156 1.003
124 H ASN 16 H ASN 16 1.745 6.787 -0.371
125 HA ASN 16 HA ASN 16 0.675 6.133 2.296
126 HB2 ASN 16 1HB ASN 16 -0.843 8.131 1.956
127 HB3 ASN 16 2HB ASN 16 0.852 8.496 2.224
128 HD21 ASN 16 1HD2 ASN 16 -0.405 7.356 -0.869
129 HD22 ASN 16 2HD2 ASN 16 -0.152 8.847 -1.711
130 H CYS 17 H CYS 17 -1.585 5.615 2.415
131 HA CYS 17 HA CYS 17 -2.358 3.891 0.264
132 HB2 CYS 17 1HB CYS 17 -4.009 4.669 2.670
133 HB3 CYS 17 2HB CYS 17 -4.183 3.230 1.677
134 HG CYS 17 HG CYS 17 -1.495 2.378 2.465
135 H GLY 18 H GLY 18 -3.933 4.108 -1.218
136 HA2 GLY 18 1HA GLY 18 -4.994 6.804 -1.636
137 HA3 GLY 18 2HA GLY 18 -4.980 5.494 -2.807
138 H LYS 19 H LYS 19 -7.208 6.017 -3.228
139 HA LYS 19 HA LYS 19 -9.192 6.035 -1.249
140 HB2 LYS 19 1HB LYS 19 -10.769 6.154 -2.962
141 HB3 LYS 19 2HB LYS 19 -9.343 6.891 -3.660
142 HG2 LYS 19 1HG LYS 19 -10.343 4.098 -4.191
143 HG3 LYS 19 2HG LYS 19 -10.495 5.484 -5.267
144 HD2 LYS 19 1HD LYS 19 -7.960 5.585 -5.272
145 HD3 LYS 19 2HD LYS 19 -7.991 4.010 -4.468
146 HE2 LYS 19 1HE LYS 19 -9.220 4.650 -7.147
147 HE3 LYS 19 2HE LYS 19 -7.710 3.782 -6.887
148 HZ1 LYS 19 3HZ LYS 19 -8.983 2.084 -5.684
149 HZ2 LYS 19 1HZ LYS 19 -9.479 2.234 -7.292
150 HZ3 LYS 19 2HZ LYS 19 -10.415 2.896 -6.050
151 H ASN 20 H ASN 20 -10.227 4.526 -0.181
152 HA ASN 20 HA ASN 20 -10.783 2.499 0.676
153 HB2 ASN 20 1HB ASN 20 -10.993 1.896 -2.275
154 HB3 ASN 20 2HB ASN 20 -11.474 0.750 -1.029
155 HD21 ASN 20 1HD2 ASN 20 -13.081 1.993 -3.081
156 HD22 ASN 20 2HD2 ASN 20 -14.336 2.856 -2.263
157 H GLU 21 H GLU 21 -8.119 2.850 0.876
158 HA GLU 21 HA GLU 21 -7.119 0.154 0.277
159 HB2 GLU 21 1HB GLU 21 -5.718 2.794 -0.053
160 HB3 GLU 21 2HB GLU 21 -4.797 1.318 0.203
161 HG2 GLU 21 1HG GLU 21 -5.880 0.333 -1.772
162 HG3 GLU 21 2HG GLU 21 -6.741 1.846 -2.038
163 H GLU 22 H GLU 22 -5.544 -0.680 1.713
164 HA GLU 22 HA GLU 22 -5.335 0.662 4.322
165 HB2 GLU 22 1HB GLU 22 -5.888 -1.340 5.521
166 HB3 GLU 22 2HB GLU 22 -7.177 -1.058 4.362
167 HG2 GLU 22 1HG GLU 22 -6.269 -2.744 2.888
168 HG3 GLU 22 2HG GLU 22 -4.899 -2.983 3.969
169 H LEU 23 H LEU 23 -3.541 -0.259 5.646
170 HA LEU 23 HA LEU 23 -1.304 -0.978 3.964
171 HB2 LEU 23 1HB LEU 23 -1.560 0.373 6.370
172 HB3 LEU 23 2HB LEU 23 -0.825 -1.137 6.822
173 HG LEU 23 HG LEU 23 1.000 0.242 6.449
174 HD11 LEU 23 1HD1 LEU 23 1.121 -1.856 5.177
175 HD12 LEU 23 2HD1 LEU 23 2.107 -0.552 4.517
176 HD13 LEU 23 3HD1 LEU 23 0.575 -0.972 3.756
177 HD21 LEU 23 3HD2 LEU 23 -0.332 1.286 3.970
178 HD22 LEU 23 1HD2 LEU 23 1.160 1.871 4.703
179 HD23 LEU 23 2HD2 LEU 23 -0.375 2.081 5.542
180 H ILE 24 H ILE 24 -0.336 -2.917 3.867
181 HA ILE 24 HA ILE 24 -1.767 -5.142 5.175
182 HB ILE 24 HB ILE 24 -2.067 -6.302 3.207
183 HG12 ILE 24 1HG1 ILE 24 -0.148 -4.691 1.587
184 HG13 ILE 24 2HG1 ILE 24 0.510 -5.878 2.711
185 HG21 ILE 24 1HG2 ILE 24 -2.016 -3.422 2.334
186 HG22 ILE 24 2HG2 ILE 24 -3.379 -4.292 3.042
187 HG23 ILE 24 3HG2 ILE 24 -2.779 -4.739 1.445
188 HD11 ILE 24 3HD1 ILE 24 0.296 -6.865 0.562
189 HD12 ILE 24 1HD1 ILE 24 -1.401 -6.389 0.466
190 HD13 ILE 24 2HD1 ILE 24 -0.888 -7.586 1.655
191 H ALA 25 H ALA 25 1.242 -3.856 3.971
192 HA ALA 25 HA ALA 25 2.851 -5.595 5.547
193 HB1 ALA 25 3HB ALA 25 2.813 -6.104 2.566
194 HB2 ALA 25 1HB ALA 25 2.259 -7.216 3.818
195 HB3 ALA 25 2HB ALA 25 3.969 -6.794 3.708
196 H LEU 26 H LEU 26 5.229 -5.358 4.793
197 HA LEU 26 HA LEU 26 5.607 -2.548 4.016
198 HB2 LEU 26 1HB LEU 26 6.931 -4.203 6.133
199 HB3 LEU 26 2HB LEU 26 7.741 -2.798 5.461
200 HG LEU 26 HG LEU 26 6.750 -2.061 7.457
201 HD11 LEU 26 1HD1 LEU 26 4.783 -1.299 5.315
202 HD12 LEU 26 2HD1 LEU 26 6.393 -0.602 5.493
203 HD13 LEU 26 3HD1 LEU 26 5.192 -0.388 6.767
204 HD21 LEU 26 3HD2 LEU 26 4.201 -3.410 6.586
205 HD22 LEU 26 1HD2 LEU 26 4.391 -2.411 8.027
206 HD23 LEU 26 2HD2 LEU 26 5.275 -3.930 7.884
207 H CYS 27 H CYS 27 7.209 -2.033 2.638
208 HA CYS 27 HA CYS 27 8.791 -4.243 1.504
209 HB2 CYS 27 1HB CYS 27 7.465 -1.886 0.182
210 HB3 CYS 27 2HB CYS 27 8.799 -2.730 -0.589
211 HG CYS 27 HG CYS 27 5.869 -4.230 0.344
212 H GLN 28 H GLN 28 10.788 -3.351 0.327
213 HA GLN 28 HA GLN 28 12.295 -1.747 2.153
214 HB2 GLN 28 1HB GLN 28 13.041 -2.513 -0.670
215 HB3 GLN 28 2HB GLN 28 14.129 -1.983 0.600
216 HG2 GLN 28 1HG GLN 28 13.517 -4.015 1.893
217 HG3 GLN 28 2HG GLN 28 12.588 -4.562 0.498
218 HE21 GLN 28 1HE2 GLN 28 13.680 -5.185 -1.375
219 HE22 GLN 28 2HE2 GLN 28 15.369 -5.554 -1.372
220 H LYS 29 H LYS 29 13.613 0.148 1.157
221 HA LYS 29 HA LYS 29 13.630 2.298 0.387
222 HB2 LYS 29 1HB LYS 29 11.346 1.458 -1.389
223 HB3 LYS 29 2HB LYS 29 12.346 2.886 -1.591
224 HG2 LYS 29 1HG LYS 29 14.251 1.531 -2.137
225 HG3 LYS 29 2HG LYS 29 13.356 0.057 -1.764
226 HD2 LYS 29 1HD LYS 29 12.720 2.011 -3.979
227 HD3 LYS 29 2HD LYS 29 13.478 0.432 -4.179
228 HE2 LYS 29 1HE LYS 29 10.692 0.950 -3.127
229 HE3 LYS 29 2HE LYS 29 11.101 0.343 -4.731
230 HZ1 LYS 29 3HZ LYS 29 11.601 -1.038 -2.150
231 HZ2 LYS 29 1HZ LYS 29 12.096 -1.612 -3.662
232 HZ3 LYS 29 2HZ LYS 29 10.452 -1.462 -3.310
233 H SER 30 H SER 30 11.665 1.113 2.377
234 HA SER 30 HA SER 30 10.023 1.673 3.779
235 HB2 SER 30 1HB SER 30 9.723 4.052 4.364
236 HB3 SER 30 2HB SER 30 11.416 3.576 4.324
237 HG SER 30 HG SER 30 10.862 4.435 1.917
238 H LEU 31 H LEU 31 9.260 1.044 1.052
239 HA LEU 31 HA LEU 31 6.867 2.579 0.606
240 HB2 LEU 31 1HB LEU 31 8.129 0.180 -0.669
241 HB3 LEU 31 2HB LEU 31 6.450 0.545 -0.988
242 HG LEU 31 HG LEU 31 8.172 1.384 -2.650
243 HD11 LEU 31 1HD1 LEU 31 6.960 3.465 -3.037
244 HD12 LEU 31 2HD1 LEU 31 6.281 3.374 -1.410
245 HD13 LEU 31 3HD1 LEU 31 5.858 2.155 -2.616
246 HD21 LEU 31 3HD2 LEU 31 9.738 2.262 -0.931
247 HD22 LEU 31 1HD2 LEU 31 8.579 3.549 -0.617
248 HD23 LEU 31 2HD2 LEU 31 9.331 3.408 -2.207
249 H LYS 32 H LYS 32 4.807 2.023 1.072
250 HA LYS 32 HA LYS 32 4.423 -0.181 2.980
251 HB2 LYS 32 1HB LYS 32 3.073 2.447 2.499
252 HB3 LYS 32 2HB LYS 32 2.136 1.140 3.194
253 HG2 LYS 32 1HG LYS 32 3.054 2.695 4.869
254 HG3 LYS 32 2HG LYS 32 3.592 1.032 5.109
255 HD2 LYS 32 1HD LYS 32 5.756 1.539 4.243
256 HD3 LYS 32 2HD LYS 32 5.217 3.100 3.624
257 HE2 LYS 32 1HE LYS 32 6.505 3.482 5.608
258 HE3 LYS 32 2HE LYS 32 4.818 3.824 5.970
259 HZ1 LYS 32 3HZ LYS 32 6.333 1.388 6.720
260 HZ2 LYS 32 1HZ LYS 32 4.670 1.585 6.963
261 HZ3 LYS 32 2HZ LYS 32 5.766 2.591 7.760
262 H CYS 33 H CYS 33 3.280 -1.947 2.341
263 HA CYS 33 HA CYS 33 2.195 -2.060 -0.306
264 HB2 CYS 33 1HB CYS 33 2.088 -4.011 1.996
265 HB3 CYS 33 2HB CYS 33 1.487 -4.347 0.381
266 HG CYS 33 HG CYS 33 3.771 -4.785 -0.799
267 H CYS 34 H CYS 34 0.366 -1.016 -0.732
268 HA CYS 34 HA CYS 34 -1.815 -1.167 1.239
269 HB2 CYS 34 1HB CYS 34 -1.433 0.872 -0.963
270 HB3 CYS 34 2HB CYS 34 -2.667 0.900 0.293
271 HG CYS 34 HG CYS 34 0.696 1.216 0.867
272 H ARG 35 H ARG 35 -3.547 -2.319 0.687
273 HA ARG 35 HA ARG 35 -3.804 -3.153 -2.117
274 HB2 ARG 35 1HB ARG 35 -5.066 -5.046 -1.358
275 HB3 ARG 35 2HB ARG 35 -3.620 -4.940 -0.371
276 HG2 ARG 35 1HG ARG 35 -5.087 -3.714 1.328
277 HG3 ARG 35 2HG ARG 35 -6.452 -4.307 0.380
278 HD2 ARG 35 1HD ARG 35 -5.412 -6.627 0.665
279 HD3 ARG 35 2HD ARG 35 -4.385 -5.892 1.879
280 HE ARG 35 HE ARG 35 -6.725 -5.156 2.819
281 HH11 ARG 35 1HH1 ARG 35 -5.860 -8.283 1.467
282 HH12 ARG 35 2HH1 ARG 35 -6.962 -9.156 2.478
283 HH21 ARG 35 1HH2 ARG 35 -8.125 -6.299 4.154
284 HH22 ARG 35 2HH2 ARG 35 -8.241 -8.032 4.026
285 H THR 36 H THR 36 -5.572 -2.682 -3.291
286 HA THR 36 HA THR 36 -7.361 -0.668 -2.227
287 HB THR 36 HB THR 36 -7.546 -1.825 -4.995
288 HG1 THR 36 HG1 THR 36 -5.650 0.094 -4.027
289 HG21 THR 36 1HG2 THR 36 -8.310 0.397 -5.572
290 HG22 THR 36 2HG2 THR 36 -7.946 0.988 -3.951
291 HG23 THR 36 3HG2 THR 36 -9.242 -0.187 -4.194
292 H ILE 37 H ILE 37 -9.198 -1.142 -1.316
293 HA ILE 37 HA ILE 37 -10.155 -3.799 -1.130
294 HB ILE 37 HB ILE 37 -11.451 -1.212 -0.290
295 HG12 ILE 37 1HG1 ILE 37 -9.290 -1.359 0.722
296 HG13 ILE 37 2HG1 ILE 37 -10.465 -1.811 1.942
297 HG21 ILE 37 1HG2 ILE 37 -11.964 -4.041 0.575
298 HG22 ILE 37 2HG2 ILE 37 -13.059 -3.002 -0.333
299 HG23 ILE 37 3HG2 ILE 37 -12.653 -2.612 1.339
300 HD11 ILE 37 3HD1 ILE 37 -8.697 -3.662 0.374
301 HD12 ILE 37 1HD1 ILE 37 -9.956 -4.187 1.490
302 HD13 ILE 37 2HD1 ILE 37 -8.578 -3.268 2.088
303 H GLN 38 H GLN 38 -11.542 -4.851 -2.339
304 HA GLN 38 HA GLN 38 -12.923 -3.491 -4.503
305 HB2 GLN 38 1HB GLN 38 -13.439 -5.791 -5.278
306 HB3 GLN 38 2HB GLN 38 -11.716 -5.511 -5.073
307 HG2 GLN 38 1HG GLN 38 -11.708 -6.723 -3.001
308 HG3 GLN 38 2HG GLN 38 -13.463 -6.886 -3.045
309 HE21 GLN 38 1HE2 GLN 38 -14.396 -8.344 -4.461
310 HE22 GLN 38 2HE2 GLN 38 -13.485 -9.594 -5.232
311 HA PRO 39 HA PRO 39 -16.883 -3.601 -2.458
312 HB2 PRO 39 1HB PRO 39 -18.156 -3.850 -5.079
313 HB3 PRO 39 2HB PRO 39 -18.205 -2.503 -3.940
314 HG2 PRO 39 1HG PRO 39 -16.881 -2.364 -6.291
315 HG3 PRO 39 2HG PRO 39 -16.341 -1.502 -4.838
316 HD2 PRO 39 1HD PRO 39 -15.318 -4.060 -6.016
317 HD3 PRO 39 2HD PRO 39 -14.418 -2.700 -5.311
318 H SER 40 H SER 40 -17.839 -5.271 -1.527
319 HA SER 40 HA SER 40 -18.984 -7.443 -2.971
320 HB2 SER 40 1HB SER 40 -16.566 -8.118 -2.923
321 HB3 SER 40 2HB SER 40 -16.634 -8.085 -1.164
322 HG SER 40 HG SER 40 -17.123 -10.128 -2.615
323 H GLY 41 H GLY 41 -19.331 -9.260 -0.890
324 HA2 GLY 41 1HA GLY 41 -21.143 -7.914 0.836
325 HA3 GLY 41 2HA GLY 41 -20.563 -9.563 1.044
326 H SER 42 H SER 42 -20.699 -6.672 2.518
327 HA SER 42 HA SER 42 -19.348 -5.315 3.742
328 HB2 SER 42 1HB SER 42 -18.170 -6.757 5.592
329 HB3 SER 42 2HB SER 42 -19.907 -6.488 5.557
330 HG SER 42 HG SER 42 -18.689 -8.725 4.320
331 H ILE 43 H ILE 43 -18.028 -4.698 2.159
332 HA ILE 43 HA ILE 43 -16.140 -4.554 0.852
333 HB ILE 43 HB ILE 43 -14.118 -4.114 2.504
334 HG12 ILE 43 1HG1 ILE 43 -16.516 -3.673 4.289
335 HG13 ILE 43 2HG1 ILE 43 -15.436 -5.051 4.466
336 HG21 ILE 43 1HG2 ILE 43 -15.174 -2.467 1.080
337 HG22 ILE 43 2HG2 ILE 43 -14.935 -1.804 2.696
338 HG23 ILE 43 3HG2 ILE 43 -16.537 -2.344 2.193
339 HD11 ILE 43 3HD1 ILE 43 -13.580 -3.520 4.909
340 HD12 ILE 43 1HD1 ILE 43 -14.905 -3.282 6.048
341 HD13 ILE 43 2HD1 ILE 43 -14.670 -2.147 4.719
342 H ILE 44 H ILE 44 -14.138 -6.008 3.343
343 HA ILE 44 HA ILE 44 -13.651 -8.266 1.545
344 HB ILE 44 HB ILE 44 -11.266 -8.147 1.958
345 HG12 ILE 44 1HG1 ILE 44 -11.361 -6.917 4.132
346 HG13 ILE 44 2HG1 ILE 44 -10.146 -6.321 3.015
347 HG21 ILE 44 1HG2 ILE 44 -12.561 -5.783 0.687
348 HG22 ILE 44 2HG2 ILE 44 -11.901 -7.229 -0.075
349 HG23 ILE 44 3HG2 ILE 44 -10.818 -6.031 0.632
350 HD11 ILE 44 3HD1 ILE 44 -11.610 -4.437 2.450
351 HD12 ILE 44 1HD1 ILE 44 -11.246 -4.506 4.173
352 HD13 ILE 44 2HD1 ILE 44 -12.811 -5.050 3.584
353 H ASP 45 H ASP 45 -15.040 -7.838 4.224
354 HA ASP 45 HA ASP 45 -13.796 -10.166 5.462
355 HB2 ASP 45 1HB ASP 45 -13.941 -9.188 7.725
356 HB3 ASP 45 2HB ASP 45 -12.814 -8.320 6.697
Start of MODEL 16
1 H PHE 1 1H PHE 1 10.224 -9.177 -2.627
2 HA PHE 1 HA PHE 1 10.638 -11.278 -1.535
3 HB2 PHE 1 1HB PHE 1 11.327 -9.572 0.869
4 HB3 PHE 1 2HB PHE 1 11.237 -11.328 0.837
5 HD1 PHE 1 HD2 PHE 1 13.190 -8.395 -0.142
6 HD2 PHE 1 HD1 PHE 1 12.991 -12.646 -0.175
7 HE1 PHE 1 HE2 PHE 1 15.572 -8.499 -0.748
8 HE2 PHE 1 HE1 PHE 1 15.374 -12.757 -0.777
9 HZ PHE 1 HZ PHE 1 16.667 -10.680 -1.065
10 H PHE 2 H PHE 2 9.584 -9.067 1.016
11 HA PHE 2 HA PHE 2 7.112 -10.384 1.328
12 HB2 PHE 2 1HB PHE 2 7.989 -7.655 2.278
13 HB3 PHE 2 2HB PHE 2 6.520 -8.467 2.800
14 HD1 PHE 2 HD1 PHE 2 10.165 -8.400 3.036
15 HD2 PHE 2 HD2 PHE 2 6.607 -10.359 4.300
16 HE1 PHE 2 HE1 PHE 2 11.423 -9.515 4.830
17 HE2 PHE 2 HE2 PHE 2 7.859 -11.478 6.100
18 HZ PHE 2 HZ PHE 2 10.270 -11.056 6.366
19 H ASP 3 H ASP 3 8.150 -7.839 -0.764
20 HA ASP 3 HA ASP 3 5.422 -7.139 -1.418
21 HB2 ASP 3 1HB ASP 3 6.417 -5.554 -3.030
22 HB3 ASP 3 2HB ASP 3 6.910 -5.284 -1.368
23 H GLU 4 H GLU 4 7.487 -9.544 -2.297
24 HA GLU 4 HA GLU 4 6.359 -9.935 -4.929
25 HB2 GLU 4 1HB GLU 4 7.717 -11.912 -3.073
26 HB3 GLU 4 2HB GLU 4 7.275 -12.233 -4.743
27 HG2 GLU 4 1HG GLU 4 9.308 -10.247 -3.761
28 HG3 GLU 4 2HG GLU 4 9.621 -11.758 -4.613
29 H LYS 5 H LYS 5 5.824 -10.889 -1.616
30 HA LYS 5 HA LYS 5 3.412 -12.316 -1.988
31 HB2 LYS 5 1HB LYS 5 4.801 -12.241 0.105
32 HB3 LYS 5 2HB LYS 5 4.213 -10.612 0.376
33 HG2 LYS 5 1HG LYS 5 2.997 -12.168 1.748
34 HG3 LYS 5 2HG LYS 5 1.921 -11.483 0.530
35 HD2 LYS 5 1HD LYS 5 1.809 -13.463 -0.670
36 HD3 LYS 5 2HD LYS 5 3.324 -14.071 0.000
37 HE2 LYS 5 1HE LYS 5 1.402 -15.282 0.902
38 HE3 LYS 5 2HE LYS 5 2.255 -14.400 2.162
39 HZ1 LYS 5 3HZ LYS 5 -0.279 -13.591 0.850
40 HZ2 LYS 5 1HZ LYS 5 0.563 -12.647 1.973
41 HZ3 LYS 5 2HZ LYS 5 -0.093 -14.130 2.439
42 H CYS 6 H CYS 6 4.197 -8.886 -1.730
43 HA CYS 6 HA CYS 6 1.648 -7.790 -1.531
44 HB2 CYS 6 1HB CYS 6 3.578 -6.367 -1.335
45 HB3 CYS 6 2HB CYS 6 4.140 -6.797 -2.941
46 HG CYS 6 HG CYS 6 1.774 -5.535 -4.110
47 H ASN 7 H ASN 7 3.477 -8.740 -4.413
48 HA ASN 7 HA ASN 7 1.597 -8.044 -6.365
49 HB2 ASN 7 1HB ASN 7 3.971 -8.773 -6.761
50 HB3 ASN 7 2HB ASN 7 3.465 -10.420 -6.442
51 HD21 ASN 7 1HD2 ASN 7 2.276 -11.522 -7.957
52 HD22 ASN 7 2HD2 ASN 7 2.039 -10.943 -9.568
53 H LYS 8 H LYS 8 2.021 -10.957 -4.467
54 HA LYS 8 HA LYS 8 0.088 -12.572 -5.685
55 HB2 LYS 8 1HB LYS 8 1.893 -13.181 -3.949
56 HB3 LYS 8 2HB LYS 8 0.714 -12.684 -2.744
57 HG2 LYS 8 1HG LYS 8 0.532 -15.026 -2.943
58 HG3 LYS 8 2HG LYS 8 -0.873 -14.345 -3.766
59 HD2 LYS 8 1HD LYS 8 0.241 -14.628 -5.919
60 HD3 LYS 8 2HD LYS 8 1.667 -15.273 -5.108
61 HE2 LYS 8 1HE LYS 8 0.380 -17.098 -5.986
62 HE3 LYS 8 2HE LYS 8 0.270 -17.119 -4.228
63 HZ1 LYS 8 3HZ LYS 8 -1.871 -17.509 -5.318
64 HZ2 LYS 8 1HZ LYS 8 -1.788 -15.984 -6.041
65 HZ3 LYS 8 2HZ LYS 8 -1.900 -16.119 -4.359
66 H LEU 9 H LEU 9 -0.217 -10.191 -3.082
67 HA LEU 9 HA LEU 9 -3.031 -10.804 -2.712
68 HB2 LEU 9 1HB LEU 9 -1.128 -8.894 -1.406
69 HB3 LEU 9 2HB LEU 9 -2.853 -8.700 -1.188
70 HG LEU 9 HG LEU 9 -1.976 -9.874 0.701
71 HD11 LEU 9 1HD1 LEU 9 -3.285 -11.904 0.667
72 HD12 LEU 9 2HD1 LEU 9 -3.376 -11.848 -1.091
73 HD13 LEU 9 3HD1 LEU 9 -4.165 -10.600 -0.127
74 HD21 LEU 9 3HD2 LEU 9 -0.883 -11.925 -1.211
75 HD22 LEU 9 1HD2 LEU 9 -0.763 -11.946 0.548
76 HD23 LEU 9 2HD2 LEU 9 0.075 -10.698 -0.378
77 H LYS 10 H LYS 10 -1.301 -9.019 -4.881
78 HA LYS 10 HA LYS 10 -1.855 -7.526 -6.495
79 HB2 LYS 10 1HB LYS 10 -4.669 -7.874 -5.455
80 HB3 LYS 10 2HB LYS 10 -4.244 -6.954 -6.890
81 HG2 LYS 10 1HG LYS 10 -3.188 -9.113 -7.748
82 HG3 LYS 10 2HG LYS 10 -4.069 -9.912 -6.443
83 HD2 LYS 10 1HD LYS 10 -5.294 -8.195 -8.595
84 HD3 LYS 10 2HD LYS 10 -5.312 -9.958 -8.566
85 HE2 LYS 10 1HE LYS 10 -6.544 -8.171 -6.469
86 HE3 LYS 10 2HE LYS 10 -7.428 -8.962 -7.773
87 HZ1 LYS 10 3HZ LYS 10 -7.546 -10.168 -5.658
88 HZ2 LYS 10 1HZ LYS 10 -5.870 -10.386 -5.687
89 HZ3 LYS 10 2HZ LYS 10 -6.836 -11.093 -6.882
90 H GLY 11 H GLY 11 -1.055 -6.776 -3.823
91 HA2 GLY 11 1HA GLY 11 -2.430 -4.248 -3.348
92 HA3 GLY 11 2HA GLY 11 -1.144 -4.937 -2.363
93 H THR 12 H THR 12 -0.930 -2.328 -2.901
94 HA THR 12 HA THR 12 1.261 -2.278 -4.857
95 HB THR 12 HB THR 12 0.464 0.238 -5.083
96 HG1 THR 12 HG1 THR 12 -2.000 -1.137 -4.671
97 HG21 THR 12 1HG2 THR 12 -0.811 -0.414 -7.092
98 HG22 THR 12 2HG2 THR 12 -0.817 -2.083 -6.525
99 HG23 THR 12 3HG2 THR 12 0.705 -1.303 -6.946
100 H CYS 13 H CYS 13 3.115 -1.482 -4.096
101 HA CYS 13 HA CYS 13 3.175 -0.354 -1.429
102 HB2 CYS 13 1HB CYS 13 5.732 -0.215 -2.129
103 HB3 CYS 13 2HB CYS 13 5.006 -1.723 -1.602
104 HG CYS 13 HG CYS 13 6.379 -0.929 -4.509
105 H LYS 14 H LYS 14 2.391 1.684 -1.453
106 HA LYS 14 HA LYS 14 4.042 3.588 -2.965
107 HB2 LYS 14 1HB LYS 14 1.670 4.912 -2.174
108 HB3 LYS 14 2HB LYS 14 2.238 4.595 -3.798
109 HG2 LYS 14 1HG LYS 14 1.054 2.401 -3.707
110 HG3 LYS 14 2HG LYS 14 0.396 2.887 -2.139
111 HD2 LYS 14 1HD LYS 14 -0.265 5.059 -3.506
112 HD3 LYS 14 2HD LYS 14 -0.201 3.933 -4.860
113 HE2 LYS 14 1HE LYS 14 -1.804 3.457 -2.360
114 HE3 LYS 14 2HE LYS 14 -2.457 4.223 -3.805
115 HZ1 LYS 14 3HZ LYS 14 -2.987 1.876 -3.729
116 HZ2 LYS 14 1HZ LYS 14 -1.344 1.474 -3.657
117 HZ3 LYS 14 2HZ LYS 14 -1.970 2.207 -5.043
118 H ASN 15 H ASN 15 3.903 5.830 -1.843
119 HA ASN 15 HA ASN 15 4.781 5.493 0.864
120 HB2 ASN 15 1HB ASN 15 5.203 7.373 -1.089
121 HB3 ASN 15 2HB ASN 15 4.122 8.198 0.018
122 HD21 ASN 15 1HD2 ASN 15 7.244 6.732 -0.343
123 HD22 ASN 15 2HD2 ASN 15 7.935 7.376 1.105
124 H ASN 16 H ASN 16 1.946 6.566 -0.807
125 HA ASN 16 HA ASN 16 0.522 6.846 1.767
126 HB2 ASN 16 1HB ASN 16 -0.977 8.439 0.654
127 HB3 ASN 16 2HB ASN 16 0.693 8.986 0.560
128 HD21 ASN 16 1HD2 ASN 16 1.789 8.832 -1.426
129 HD22 ASN 16 2HD2 ASN 16 0.921 8.743 -2.921
130 H CYS 17 H CYS 17 -1.547 5.946 1.924
131 HA CYS 17 HA CYS 17 -2.076 3.752 0.108
132 HB2 CYS 17 1HB CYS 17 -3.774 4.663 2.437
133 HB3 CYS 17 2HB CYS 17 -3.767 3.082 1.670
134 HG CYS 17 HG CYS 17 -1.362 2.258 2.659
135 H GLY 18 H GLY 18 -3.847 3.568 -1.242
136 HA2 GLY 18 1HA GLY 18 -4.928 6.143 -2.105
137 HA3 GLY 18 2HA GLY 18 -4.998 4.629 -2.993
138 H LYS 19 H LYS 19 -7.206 5.165 -3.396
139 HA LYS 19 HA LYS 19 -9.145 5.617 -1.447
140 HB2 LYS 19 1HB LYS 19 -10.765 5.281 -3.132
141 HB3 LYS 19 2HB LYS 19 -9.361 5.924 -3.964
142 HG2 LYS 19 1HG LYS 19 -10.092 3.000 -3.865
143 HG3 LYS 19 2HG LYS 19 -10.515 4.095 -5.178
144 HD2 LYS 19 1HD LYS 19 -7.661 3.757 -4.328
145 HD3 LYS 19 2HD LYS 19 -8.420 2.593 -5.411
146 HE2 LYS 19 1HE LYS 19 -8.352 5.561 -5.923
147 HE3 LYS 19 2HE LYS 19 -7.151 4.432 -6.549
148 HZ1 LYS 19 3HZ LYS 19 -8.854 4.866 -8.184
149 HZ2 LYS 19 1HZ LYS 19 -10.065 4.368 -7.116
150 HZ3 LYS 19 2HZ LYS 19 -8.934 3.251 -7.692
151 H ASN 20 H ASN 20 -10.017 4.387 0.050
152 HA ASN 20 HA ASN 20 -10.783 2.606 1.233
153 HB2 ASN 20 1HB ASN 20 -11.008 1.383 -1.522
154 HB3 ASN 20 2HB ASN 20 -11.707 0.692 -0.064
155 HD21 ASN 20 1HD2 ASN 20 -13.016 1.568 -2.484
156 HD22 ASN 20 2HD2 ASN 20 -14.157 2.777 -2.011
157 H GLU 21 H GLU 21 -7.890 2.815 0.716
158 HA GLU 21 HA GLU 21 -7.119 -0.004 0.583
159 HB2 GLU 21 1HB GLU 21 -5.615 2.562 0.174
160 HB3 GLU 21 2HB GLU 21 -4.765 1.049 0.446
161 HG2 GLU 21 1HG GLU 21 -5.945 0.082 -1.496
162 HG3 GLU 21 2HG GLU 21 -6.691 1.652 -1.787
163 H GLU 22 H GLU 22 -6.147 -1.066 2.161
164 HA GLU 22 HA GLU 22 -5.628 0.374 4.683
165 HB2 GLU 22 1HB GLU 22 -6.108 -1.649 5.885
166 HB3 GLU 22 2HB GLU 22 -7.430 -1.387 4.758
167 HG2 GLU 22 1HG GLU 22 -6.567 -3.061 3.271
168 HG3 GLU 22 2HG GLU 22 -5.119 -3.246 4.259
169 H LEU 23 H LEU 23 -3.840 -0.620 5.992
170 HA LEU 23 HA LEU 23 -1.549 -1.047 4.268
171 HB2 LEU 23 1HB LEU 23 -1.886 0.279 6.633
172 HB3 LEU 23 2HB LEU 23 -1.188 -1.232 7.180
173 HG LEU 23 HG LEU 23 0.804 -0.881 5.897
174 HD11 LEU 23 1HD1 LEU 23 0.165 -0.052 3.858
175 HD12 LEU 23 2HD1 LEU 23 0.901 1.367 4.610
176 HD13 LEU 23 3HD1 LEU 23 -0.851 1.206 4.566
177 HD21 LEU 23 3HD2 LEU 23 -0.054 1.690 7.218
178 HD22 LEU 23 1HD2 LEU 23 1.602 1.259 6.793
179 HD23 LEU 23 2HD2 LEU 23 0.729 0.317 8.004
180 H ILE 24 H ILE 24 -0.880 -3.006 3.705
181 HA ILE 24 HA ILE 24 -1.972 -5.269 5.224
182 HB ILE 24 HB ILE 24 -2.386 -6.373 3.266
183 HG12 ILE 24 1HG1 ILE 24 -0.728 -5.132 1.282
184 HG13 ILE 24 2HG1 ILE 24 0.276 -5.604 2.649
185 HG21 ILE 24 1HG2 ILE 24 -3.042 -4.805 1.488
186 HG22 ILE 24 2HG2 ILE 24 -2.176 -3.520 2.327
187 HG23 ILE 24 3HG2 ILE 24 -3.576 -4.281 3.083
188 HD11 ILE 24 3HD1 ILE 24 -1.597 -7.409 1.143
189 HD12 ILE 24 1HD1 ILE 24 -0.553 -7.878 2.483
190 HD13 ILE 24 2HD1 ILE 24 0.156 -7.350 0.956
191 H ALA 25 H ALA 25 0.955 -3.797 4.051
192 HA ALA 25 HA ALA 25 2.609 -5.508 5.618
193 HB1 ALA 25 3HB ALA 25 2.748 -5.918 2.631
194 HB2 ALA 25 1HB ALA 25 2.131 -7.084 3.801
195 HB3 ALA 25 2HB ALA 25 3.833 -6.621 3.829
196 H LEU 26 H LEU 26 4.910 -5.100 5.235
197 HA LEU 26 HA LEU 26 5.361 -2.354 4.303
198 HB2 LEU 26 1HB LEU 26 6.642 -4.048 6.417
199 HB3 LEU 26 2HB LEU 26 7.524 -2.702 5.718
200 HG LEU 26 HG LEU 26 6.560 -1.988 7.788
201 HD11 LEU 26 1HD1 LEU 26 6.549 -0.364 5.959
202 HD12 LEU 26 2HD1 LEU 26 5.220 -0.102 7.087
203 HD13 LEU 26 3HD1 LEU 26 4.914 -0.868 5.529
204 HD21 LEU 26 3HD2 LEU 26 3.920 -2.950 6.700
205 HD22 LEU 26 1HD2 LEU 26 4.125 -2.012 8.179
206 HD23 LEU 26 2HD2 LEU 26 4.816 -3.629 8.059
207 H CYS 27 H CYS 27 6.562 -2.084 2.543
208 HA CYS 27 HA CYS 27 7.866 -4.446 1.397
209 HB2 CYS 27 1HB CYS 27 7.078 -1.825 0.110
210 HB3 CYS 27 2HB CYS 27 7.783 -3.199 -0.731
211 HG CYS 27 HG CYS 27 5.402 -3.868 -1.480
212 H GLN 28 H GLN 28 9.786 -3.606 -0.172
213 HA GLN 28 HA GLN 28 11.829 -2.777 1.609
214 HB2 GLN 28 1HB GLN 28 11.908 -2.959 -1.395
215 HB3 GLN 28 2HB GLN 28 13.303 -2.805 -0.348
216 HG2 GLN 28 1HG GLN 28 12.915 -4.954 0.613
217 HG3 GLN 28 2HG GLN 28 11.373 -5.103 -0.225
218 HE21 GLN 28 1HE2 GLN 28 11.336 -5.647 -2.377
219 HE22 GLN 28 2HE2 GLN 28 12.734 -6.217 -3.226
220 H LYS 29 H LYS 29 13.369 -0.982 0.917
221 HA LYS 29 HA LYS 29 13.753 1.255 1.029
222 HB2 LYS 29 1HB LYS 29 11.433 1.435 -0.883
223 HB3 LYS 29 2HB LYS 29 12.579 2.718 -0.555
224 HG2 LYS 29 1HG LYS 29 13.544 1.943 -2.440
225 HG3 LYS 29 2HG LYS 29 14.272 0.792 -1.328
226 HD2 LYS 29 1HD LYS 29 13.390 -0.356 -3.282
227 HD3 LYS 29 2HD LYS 29 12.498 -0.821 -1.831
228 HE2 LYS 29 1HE LYS 29 10.720 0.732 -2.414
229 HE3 LYS 29 2HE LYS 29 11.611 1.246 -3.841
230 HZ1 LYS 29 3HZ LYS 29 9.890 -0.355 -4.385
231 HZ2 LYS 29 1HZ LYS 29 10.582 -1.494 -3.345
232 HZ3 LYS 29 2HZ LYS 29 11.418 -0.990 -4.724
233 H SER 30 H SER 30 11.512 -0.118 2.601
234 HA SER 30 HA SER 30 10.158 0.370 4.342
235 HB2 SER 30 1HB SER 30 11.915 2.092 4.867
236 HB3 SER 30 2HB SER 30 10.946 3.269 3.985
237 HG SER 30 HG SER 30 9.253 2.893 5.467
238 H LEU 31 H LEU 31 9.255 0.435 1.539
239 HA LEU 31 HA LEU 31 7.168 2.369 1.356
240 HB2 LEU 31 1HB LEU 31 8.014 -0.042 -0.167
241 HB3 LEU 31 2HB LEU 31 6.381 0.542 -0.394
242 HG LEU 31 HG LEU 31 8.250 1.325 -1.998
243 HD11 LEU 31 1HD1 LEU 31 6.371 3.298 -0.703
244 HD12 LEU 31 2HD1 LEU 31 5.961 2.170 -1.999
245 HD13 LEU 31 3HD1 LEU 31 7.116 3.473 -2.293
246 HD21 LEU 31 3HD2 LEU 31 8.654 3.343 0.193
247 HD22 LEU 31 1HD2 LEU 31 9.467 3.275 -1.369
248 HD23 LEU 31 2HD2 LEU 31 9.779 2.033 -0.155
249 H LYS 32 H LYS 32 4.885 1.846 1.241
250 HA LYS 32 HA LYS 32 4.155 -0.218 3.206
251 HB2 LYS 32 1HB LYS 32 3.218 2.552 2.719
252 HB3 LYS 32 2HB LYS 32 2.001 1.379 3.194
253 HG2 LYS 32 1HG LYS 32 3.084 0.927 5.242
254 HG3 LYS 32 2HG LYS 32 4.543 1.795 4.742
255 HD2 LYS 32 1HD LYS 32 1.837 3.073 5.141
256 HD3 LYS 32 2HD LYS 32 3.119 3.054 6.350
257 HE2 LYS 32 1HE LYS 32 4.583 4.268 4.801
258 HE3 LYS 32 2HE LYS 32 3.287 4.300 3.607
259 HZ1 LYS 32 3HZ LYS 32 3.228 5.578 6.283
260 HZ2 LYS 32 1HZ LYS 32 1.943 5.568 5.184
261 HZ3 LYS 32 2HZ LYS 32 3.378 6.370 4.800
262 H CYS 33 H CYS 33 3.082 -1.908 2.450
263 HA CYS 33 HA CYS 33 2.009 -1.867 -0.232
264 HB2 CYS 33 1HB CYS 33 3.199 -3.859 0.668
265 HB3 CYS 33 2HB CYS 33 1.902 -4.063 1.845
266 HG CYS 33 HG CYS 33 1.639 -4.383 -1.549
267 H CYS 34 H CYS 34 0.070 -1.126 -0.645
268 HA CYS 34 HA CYS 34 -1.996 -1.340 1.442
269 HB2 CYS 34 1HB CYS 34 -1.891 0.740 -0.740
270 HB3 CYS 34 2HB CYS 34 -2.874 0.750 0.719
271 HG CYS 34 HG CYS 34 0.540 1.029 0.729
272 H ARG 35 H ARG 35 -3.980 -2.156 0.858
273 HA ARG 35 HA ARG 35 -4.215 -3.051 -1.940
274 HB2 ARG 35 1HB ARG 35 -5.379 -5.026 -1.208
275 HB3 ARG 35 2HB ARG 35 -3.866 -4.911 -0.327
276 HG2 ARG 35 1HG ARG 35 -5.205 -3.880 1.560
277 HG3 ARG 35 2HG ARG 35 -6.647 -4.381 0.678
278 HD2 ARG 35 1HD ARG 35 -5.565 -6.720 0.665
279 HD3 ARG 35 2HD ARG 35 -4.502 -6.084 1.907
280 HE ARG 35 HE ARG 35 -6.611 -5.563 3.170
281 HH11 ARG 35 1HH1 ARG 35 -6.465 -8.189 0.847
282 HH12 ARG 35 2HH1 ARG 35 -7.736 -9.095 1.620
283 HH21 ARG 35 1HH2 ARG 35 -8.250 -6.749 4.172
284 HH22 ARG 35 2HH2 ARG 35 -8.763 -8.271 3.500
285 H THR 36 H THR 36 -6.022 -2.605 -3.031
286 HA THR 36 HA THR 36 -7.771 -0.597 -1.921
287 HB THR 36 HB THR 36 -7.940 -1.860 -4.658
288 HG1 THR 36 HG1 THR 36 -6.237 0.185 -3.656
289 HG21 THR 36 1HG2 THR 36 -9.864 -0.502 -3.988
290 HG22 THR 36 2HG2 THR 36 -8.954 0.277 -5.281
291 HG23 THR 36 3HG2 THR 36 -8.787 0.846 -3.620
292 H ILE 37 H ILE 37 -9.134 -1.515 -0.465
293 HA ILE 37 HA ILE 37 -10.443 -3.999 -0.860
294 HB ILE 37 HB ILE 37 -10.917 -1.751 1.075
295 HG12 ILE 37 1HG1 ILE 37 -8.728 -3.165 0.896
296 HG13 ILE 37 2HG1 ILE 37 -9.440 -2.853 2.468
297 HG21 ILE 37 1HG2 ILE 37 -12.184 -3.381 2.407
298 HG22 ILE 37 2HG2 ILE 37 -12.035 -4.556 1.103
299 HG23 ILE 37 3HG2 ILE 37 -12.956 -3.075 0.851
300 HD11 ILE 37 3HD1 ILE 37 -10.469 -5.082 2.416
301 HD12 ILE 37 1HD1 ILE 37 -8.713 -5.161 2.268
302 HD13 ILE 37 2HD1 ILE 37 -9.731 -5.367 0.841
303 H GLN 38 H GLN 38 -12.153 -4.416 -2.051
304 HA GLN 38 HA GLN 38 -13.890 -2.245 -2.942
305 HB2 GLN 38 1HB GLN 38 -13.759 -5.145 -3.801
306 HB3 GLN 38 2HB GLN 38 -14.814 -3.928 -4.505
307 HG2 GLN 38 1HG GLN 38 -12.781 -2.649 -5.164
308 HG3 GLN 38 2HG GLN 38 -11.810 -4.012 -4.607
309 HE21 GLN 38 1HE2 GLN 38 -10.977 -4.415 -6.654
310 HE22 GLN 38 2HE2 GLN 38 -11.934 -5.099 -7.921
311 HA PRO 39 HA PRO 39 -17.118 -3.232 -0.070
312 HB2 PRO 39 1HB PRO 39 -19.022 -2.736 -2.277
313 HB3 PRO 39 2HB PRO 39 -18.881 -1.932 -0.709
314 HG2 PRO 39 1HG PRO 39 -18.127 -0.713 -2.965
315 HG3 PRO 39 2HG PRO 39 -17.238 -0.486 -1.449
316 HD2 PRO 39 1HD PRO 39 -16.553 -2.181 -3.815
317 HD3 PRO 39 2HD PRO 39 -15.494 -1.190 -2.790
318 H SER 40 H SER 40 -18.306 -4.979 0.506
319 HA SER 40 HA SER 40 -19.240 -7.046 0.470
320 HB2 SER 40 1HB SER 40 -20.617 -6.188 -1.426
321 HB3 SER 40 2HB SER 40 -19.370 -6.741 -2.541
322 HG SER 40 HG SER 40 -21.254 -8.194 -1.102
323 H GLY 41 H GLY 41 -18.775 -9.323 -0.314
324 HA2 GLY 41 1HA GLY 41 -15.871 -9.547 -0.398
325 HA3 GLY 41 2HA GLY 41 -17.003 -10.838 -0.027
326 H SER 42 H SER 42 -14.874 -9.710 -2.224
327 HA SER 42 HA SER 42 -14.998 -11.731 -4.031
328 HB2 SER 42 1HB SER 42 -17.242 -10.943 -4.705
329 HB3 SER 42 2HB SER 42 -16.571 -9.364 -5.098
330 HG SER 42 HG SER 42 -16.438 -10.302 -7.005
331 H ILE 43 H ILE 43 -13.379 -11.550 -5.523
332 HA ILE 43 HA ILE 43 -11.492 -10.786 -6.539
333 HB ILE 43 HB ILE 43 -12.456 -8.004 -5.851
334 HG12 ILE 43 1HG1 ILE 43 -12.799 -9.600 -8.402
335 HG13 ILE 43 2HG1 ILE 43 -14.072 -9.284 -7.227
336 HG21 ILE 43 1HG2 ILE 43 -10.084 -8.060 -6.365
337 HG22 ILE 43 2HG2 ILE 43 -10.974 -7.298 -7.683
338 HG23 ILE 43 3HG2 ILE 43 -10.405 -8.960 -7.847
339 HD11 ILE 43 3HD1 ILE 43 -14.284 -7.794 -9.106
340 HD12 ILE 43 1HD1 ILE 43 -12.624 -7.241 -8.894
341 HD13 ILE 43 2HD1 ILE 43 -13.838 -6.876 -7.670
342 H ILE 44 H ILE 44 -12.127 -8.708 -3.726
343 HA ILE 44 HA ILE 44 -9.609 -9.595 -2.529
344 HB ILE 44 HB ILE 44 -8.946 -7.541 -3.566
345 HG12 ILE 44 1HG1 ILE 44 -9.554 -7.052 -0.640
346 HG13 ILE 44 2HG1 ILE 44 -8.132 -7.867 -1.280
347 HG21 ILE 44 1HG2 ILE 44 -11.142 -6.607 -4.020
348 HG22 ILE 44 2HG2 ILE 44 -10.123 -5.418 -3.207
349 HG23 ILE 44 3HG2 ILE 44 -11.373 -6.272 -2.304
350 HD11 ILE 44 3HD1 ILE 44 -8.845 -4.993 -1.801
351 HD12 ILE 44 1HD1 ILE 44 -7.370 -5.823 -2.296
352 HD13 ILE 44 2HD1 ILE 44 -7.700 -5.549 -0.584
353 H ASP 45 H ASP 45 -9.747 -9.879 -0.366
354 HA ASP 45 HA ASP 45 -11.760 -8.511 1.191
355 HB2 ASP 45 1HB ASP 45 -12.810 -10.462 2.101
356 HB3 ASP 45 2HB ASP 45 -12.876 -10.621 0.351
Start of MODEL 17
1 H PHE 1 1H PHE 1 11.001 -9.997 -0.887
2 HA PHE 1 HA PHE 1 9.326 -12.424 -0.754
3 HB2 PHE 1 1HB PHE 1 11.219 -12.469 0.830
4 HB3 PHE 1 2HB PHE 1 10.732 -10.896 1.452
5 HD1 PHE 1 HD1 PHE 1 9.783 -14.448 1.216
6 HD2 PHE 1 HD2 PHE 1 8.989 -10.690 3.050
7 HE1 PHE 1 HE1 PHE 1 8.328 -15.558 2.858
8 HE2 PHE 1 HE2 PHE 1 7.531 -11.797 4.694
9 HZ PHE 1 HZ PHE 1 7.200 -14.233 4.598
10 H PHE 2 H PHE 2 9.685 -9.104 0.533
11 HA PHE 2 HA PHE 2 7.163 -8.842 1.603
12 HB2 PHE 2 1HB PHE 2 8.932 -6.733 0.370
13 HB3 PHE 2 2HB PHE 2 7.462 -6.364 1.261
14 HD1 PHE 2 HD1 PHE 2 7.451 -7.918 3.586
15 HD2 PHE 2 HD2 PHE 2 10.814 -6.266 1.571
16 HE1 PHE 2 HE1 PHE 2 8.715 -7.928 5.695
17 HE2 PHE 2 HE2 PHE 2 12.086 -6.280 3.676
18 HZ PHE 2 HZ PHE 2 11.037 -7.112 5.740
19 H ASP 3 H ASP 3 8.124 -7.619 -1.639
20 HA ASP 3 HA ASP 3 5.307 -7.273 -2.178
21 HB2 ASP 3 1HB ASP 3 5.892 -6.058 -4.140
22 HB3 ASP 3 2HB ASP 3 6.835 -5.458 -2.785
23 H GLU 4 H GLU 4 7.359 -9.780 -2.480
24 HA GLU 4 HA GLU 4 6.338 -10.905 -4.902
25 HB2 GLU 4 1HB GLU 4 8.359 -11.827 -3.847
26 HB3 GLU 4 2HB GLU 4 7.441 -12.242 -2.407
27 HG2 GLU 4 1HG GLU 4 7.847 -14.211 -3.742
28 HG3 GLU 4 2HG GLU 4 6.124 -13.841 -3.715
29 H LYS 5 H LYS 5 5.517 -11.101 -1.474
30 HA LYS 5 HA LYS 5 3.087 -12.494 -1.822
31 HB2 LYS 5 1HB LYS 5 4.199 -12.406 0.345
32 HB3 LYS 5 2HB LYS 5 4.003 -10.662 0.397
33 HG2 LYS 5 1HG LYS 5 2.383 -11.805 1.823
34 HG3 LYS 5 2HG LYS 5 1.595 -10.903 0.528
35 HD2 LYS 5 1HD LYS 5 0.491 -13.011 0.697
36 HD3 LYS 5 2HD LYS 5 1.474 -13.046 -0.767
37 HE2 LYS 5 1HE LYS 5 1.718 -15.142 0.376
38 HE3 LYS 5 2HE LYS 5 3.232 -14.248 0.501
39 HZ1 LYS 5 3HZ LYS 5 2.601 -15.274 2.602
40 HZ2 LYS 5 1HZ LYS 5 1.155 -14.399 2.615
41 HZ3 LYS 5 2HZ LYS 5 2.633 -13.589 2.735
42 H CYS 6 H CYS 6 3.976 -9.077 -1.883
43 HA CYS 6 HA CYS 6 1.433 -7.928 -1.752
44 HB2 CYS 6 1HB CYS 6 3.634 -6.700 -1.693
45 HB3 CYS 6 2HB CYS 6 3.780 -6.967 -3.422
46 HG CYS 6 HG CYS 6 1.563 -5.413 -4.089
47 H ASN 7 H ASN 7 3.313 -9.004 -4.564
48 HA ASN 7 HA ASN 7 1.493 -8.300 -6.570
49 HB2 ASN 7 1HB ASN 7 3.924 -9.060 -6.826
50 HB3 ASN 7 2HB ASN 7 3.315 -10.703 -6.677
51 HD21 ASN 7 1HD2 ASN 7 2.007 -11.558 -8.317
52 HD22 ASN 7 2HD2 ASN 7 1.948 -10.853 -9.893
53 H LYS 8 H LYS 8 1.962 -11.406 -4.902
54 HA LYS 8 HA LYS 8 -0.029 -12.846 -6.236
55 HB2 LYS 8 1HB LYS 8 0.988 -13.218 -3.416
56 HB3 LYS 8 2HB LYS 8 0.187 -14.419 -4.400
57 HG2 LYS 8 1HG LYS 8 2.844 -13.188 -5.051
58 HG3 LYS 8 2HG LYS 8 2.621 -14.741 -4.245
59 HD2 LYS 8 1HD LYS 8 1.430 -15.589 -6.201
60 HD3 LYS 8 2HD LYS 8 1.634 -14.031 -7.002
61 HE2 LYS 8 1HE LYS 8 3.287 -15.660 -7.774
62 HE3 LYS 8 2HE LYS 8 4.048 -14.297 -6.958
63 HZ1 LYS 8 3HZ LYS 8 3.515 -16.944 -5.730
64 HZ2 LYS 8 1HZ LYS 8 4.291 -15.640 -4.981
65 HZ3 LYS 8 2HZ LYS 8 5.016 -16.412 -6.298
66 H LEU 9 H LEU 9 -0.068 -10.967 -3.254
67 HA LEU 9 HA LEU 9 -2.732 -11.731 -2.538
68 HB2 LEU 9 1HB LEU 9 -0.836 -11.322 -0.998
69 HB3 LEU 9 2HB LEU 9 -0.892 -9.629 -1.433
70 HG LEU 9 HG LEU 9 -3.191 -9.526 -0.484
71 HD11 LEU 9 1HD1 LEU 9 -3.864 -11.335 1.038
72 HD12 LEU 9 2HD1 LEU 9 -2.490 -12.296 0.493
73 HD13 LEU 9 3HD1 LEU 9 -3.783 -11.887 -0.634
74 HD21 LEU 9 3HD2 LEU 9 -2.373 -9.306 1.721
75 HD22 LEU 9 1HD2 LEU 9 -1.032 -8.928 0.632
76 HD23 LEU 9 2HD2 LEU 9 -1.104 -10.501 1.434
77 H LYS 10 H LYS 10 -1.565 -9.580 -4.764
78 HA LYS 10 HA LYS 10 -2.715 -8.215 -6.182
79 HB2 LYS 10 1HB LYS 10 -5.092 -8.749 -4.389
80 HB3 LYS 10 2HB LYS 10 -5.154 -7.955 -5.954
81 HG2 LYS 10 1HG LYS 10 -4.179 -10.773 -5.552
82 HG3 LYS 10 2HG LYS 10 -5.847 -10.356 -5.946
83 HD2 LYS 10 1HD LYS 10 -3.457 -9.588 -7.614
84 HD3 LYS 10 2HD LYS 10 -4.474 -10.998 -7.919
85 HE2 LYS 10 1HE LYS 10 -5.352 -8.112 -7.929
86 HE3 LYS 10 2HE LYS 10 -5.151 -9.150 -9.339
87 HZ1 LYS 10 3HZ LYS 10 -6.902 -10.594 -8.431
88 HZ2 LYS 10 1HZ LYS 10 -7.459 -9.029 -8.744
89 HZ3 LYS 10 2HZ LYS 10 -7.135 -9.509 -7.157
90 H GLY 11 H GLY 11 -1.158 -7.142 -4.178
91 HA2 GLY 11 1HA GLY 11 -2.626 -4.627 -3.654
92 HA3 GLY 11 2HA GLY 11 -1.466 -5.292 -2.510
93 H THR 12 H THR 12 -1.080 -2.740 -3.371
94 HA THR 12 HA THR 12 1.307 -3.071 -5.052
95 HB THR 12 HB THR 12 0.767 -0.591 -5.705
96 HG1 THR 12 HG1 THR 12 -1.885 -1.226 -5.792
97 HG21 THR 12 1HG2 THR 12 0.911 -2.434 -7.296
98 HG22 THR 12 2HG2 THR 12 -0.449 -1.381 -7.687
99 HG23 THR 12 3HG2 THR 12 -0.733 -2.928 -6.889
100 H CYS 13 H CYS 13 3.144 -2.107 -4.304
101 HA CYS 13 HA CYS 13 3.042 -1.069 -1.607
102 HB2 CYS 13 1HB CYS 13 5.540 -1.147 -3.291
103 HB3 CYS 13 2HB CYS 13 5.376 -1.263 -1.547
104 HG CYS 13 HG CYS 13 3.751 -3.780 -2.840
105 H LYS 14 H LYS 14 2.521 0.952 -1.284
106 HA LYS 14 HA LYS 14 3.824 3.003 -2.912
107 HB2 LYS 14 1HB LYS 14 1.749 4.360 -2.865
108 HB3 LYS 14 2HB LYS 14 1.583 2.879 -3.796
109 HG2 LYS 14 1HG LYS 14 0.417 1.830 -1.927
110 HG3 LYS 14 2HG LYS 14 0.589 3.313 -0.987
111 HD2 LYS 14 1HD LYS 14 -1.612 3.289 -1.912
112 HD3 LYS 14 2HD LYS 14 -0.675 4.505 -2.780
113 HE2 LYS 14 1HE LYS 14 -1.956 3.274 -4.381
114 HE3 LYS 14 2HE LYS 14 -0.266 2.811 -4.565
115 HZ1 LYS 14 3HZ LYS 14 -1.611 0.857 -4.644
116 HZ2 LYS 14 1HZ LYS 14 -2.404 1.261 -3.199
117 HZ3 LYS 14 2HZ LYS 14 -0.762 0.837 -3.184
118 H ASN 15 H ASN 15 3.387 5.241 -1.706
119 HA ASN 15 HA ASN 15 4.493 4.786 0.911
120 HB2 ASN 15 1HB ASN 15 4.075 7.189 -0.816
121 HB3 ASN 15 2HB ASN 15 4.459 7.390 0.886
122 HD21 ASN 15 1HD2 ASN 15 5.997 8.143 -1.444
123 HD22 ASN 15 2HD2 ASN 15 7.514 7.324 -1.311
124 H ASN 16 H ASN 16 1.683 6.580 -0.368
125 HA ASN 16 HA ASN 16 0.442 6.312 2.295
126 HB2 ASN 16 1HB ASN 16 -0.747 8.360 1.914
127 HB3 ASN 16 2HB ASN 16 0.944 8.668 1.537
128 HD21 ASN 16 1HD2 ASN 16 1.561 8.913 -0.640
129 HD22 ASN 16 2HD2 ASN 16 0.400 9.300 -1.862
130 H CYS 17 H CYS 17 -1.673 5.591 2.411
131 HA CYS 17 HA CYS 17 -2.473 3.893 0.248
132 HB2 CYS 17 1HB CYS 17 -3.949 4.541 2.805
133 HB3 CYS 17 2HB CYS 17 -4.267 3.190 1.735
134 HG CYS 17 HG CYS 17 -1.296 2.575 2.284
135 H GLY 18 H GLY 18 -3.981 4.203 -1.251
136 HA2 GLY 18 1HA GLY 18 -5.173 6.853 -1.462
137 HA3 GLY 18 2HA GLY 18 -5.113 5.627 -2.720
138 H LYS 19 H LYS 19 -7.309 6.038 -3.140
139 HA LYS 19 HA LYS 19 -9.486 6.126 -1.550
140 HB2 LYS 19 1HB LYS 19 -10.756 5.053 -3.414
141 HB3 LYS 19 2HB LYS 19 -9.695 6.353 -3.935
142 HG2 LYS 19 1HG LYS 19 -8.184 4.893 -4.932
143 HG3 LYS 19 2HG LYS 19 -8.773 3.506 -4.022
144 HD2 LYS 19 1HD LYS 19 -10.287 4.949 -6.198
145 HD3 LYS 19 2HD LYS 19 -9.435 3.412 -6.380
146 HE2 LYS 19 1HE LYS 19 -10.910 2.423 -4.669
147 HE3 LYS 19 2HE LYS 19 -11.788 3.947 -4.567
148 HZ1 LYS 19 3HZ LYS 19 -12.438 3.709 -6.862
149 HZ2 LYS 19 1HZ LYS 19 -12.900 2.337 -5.990
150 HZ3 LYS 19 2HZ LYS 19 -11.552 2.276 -7.007
151 H ASN 20 H ASN 20 -9.945 4.952 0.160
152 HA ASN 20 HA ASN 20 -10.233 3.185 1.573
153 HB2 ASN 20 1HB ASN 20 -12.225 3.162 0.033
154 HB3 ASN 20 2HB ASN 20 -11.417 1.908 -0.897
155 HD21 ASN 20 1HD2 ASN 20 -11.233 2.121 2.597
156 HD22 ASN 20 2HD2 ASN 20 -12.165 0.703 2.914
157 H GLU 21 H GLU 21 -7.694 3.093 1.055
158 HA GLU 21 HA GLU 21 -7.121 0.299 0.337
159 HB2 GLU 21 1HB GLU 21 -5.415 2.778 0.311
160 HB3 GLU 21 2HB GLU 21 -4.685 1.181 0.312
161 HG2 GLU 21 1HG GLU 21 -6.155 0.729 -1.725
162 HG3 GLU 21 2HG GLU 21 -6.402 2.468 -1.780
163 H GLU 22 H GLU 22 -6.028 -1.033 1.720
164 HA GLU 22 HA GLU 22 -5.752 -0.047 4.479
165 HB2 GLU 22 1HB GLU 22 -6.039 -2.353 5.208
166 HB3 GLU 22 2HB GLU 22 -7.386 -1.874 4.190
167 HG2 GLU 22 1HG GLU 22 -6.469 -3.112 2.331
168 HG3 GLU 22 2HG GLU 22 -5.026 -3.492 3.260
169 H LEU 23 H LEU 23 -3.876 -0.529 5.656
170 HA LEU 23 HA LEU 23 -1.552 -1.102 3.989
171 HB2 LEU 23 1HB LEU 23 -1.877 0.804 5.843
172 HB3 LEU 23 2HB LEU 23 -1.267 -0.477 6.872
173 HG LEU 23 HG LEU 23 0.807 -0.583 5.639
174 HD11 LEU 23 1HD1 LEU 23 -0.027 -0.285 3.403
175 HD12 LEU 23 2HD1 LEU 23 1.214 0.912 3.735
176 HD13 LEU 23 3HD1 LEU 23 -0.484 1.380 3.760
177 HD21 LEU 23 3HD2 LEU 23 1.694 1.614 6.057
178 HD22 LEU 23 1HD2 LEU 23 0.567 1.189 7.342
179 HD23 LEU 23 2HD2 LEU 23 0.073 2.306 6.071
180 H ILE 24 H ILE 24 -0.734 -3.060 3.919
181 HA ILE 24 HA ILE 24 -1.718 -4.980 5.929
182 HB ILE 24 HB ILE 24 -2.086 -6.576 4.240
183 HG12 ILE 24 1HG1 ILE 24 -1.327 -5.633 1.788
184 HG13 ILE 24 2HG1 ILE 24 -0.008 -5.075 2.807
185 HG21 ILE 24 1HG2 ILE 24 -3.678 -4.710 4.218
186 HG22 ILE 24 2HG2 ILE 24 -3.485 -5.439 2.628
187 HG23 ILE 24 3HG2 ILE 24 -2.695 -3.909 2.991
188 HD11 ILE 24 3HD1 ILE 24 -0.958 -7.910 2.538
189 HD12 ILE 24 1HD1 ILE 24 0.352 -7.362 3.583
190 HD13 ILE 24 2HD1 ILE 24 0.505 -7.224 1.831
191 H ALA 25 H ALA 25 1.064 -3.760 4.309
192 HA ALA 25 HA ALA 25 2.801 -5.315 5.988
193 HB1 ALA 25 3HB ALA 25 2.403 -6.920 4.171
194 HB2 ALA 25 1HB ALA 25 4.078 -6.369 4.201
195 HB3 ALA 25 2HB ALA 25 2.959 -5.723 3.001
196 H LEU 26 H LEU 26 5.034 -4.699 5.724
197 HA LEU 26 HA LEU 26 5.268 -1.958 4.694
198 HB2 LEU 26 1HB LEU 26 6.492 -3.274 7.108
199 HB3 LEU 26 2HB LEU 26 7.003 -1.706 6.513
200 HG LEU 26 HG LEU 26 4.208 -2.356 7.464
201 HD11 LEU 26 1HD1 LEU 26 4.770 -1.055 9.446
202 HD12 LEU 26 2HD1 LEU 26 6.422 -0.864 8.862
203 HD13 LEU 26 3HD1 LEU 26 5.819 -2.464 9.294
204 HD21 LEU 26 3HD2 LEU 26 5.526 0.240 6.675
205 HD22 LEU 26 1HD2 LEU 26 3.974 0.124 7.502
206 HD23 LEU 26 2HD2 LEU 26 4.159 -0.543 5.882
207 H CYS 27 H CYS 27 6.694 -1.694 3.123
208 HA CYS 27 HA CYS 27 8.357 -3.993 2.388
209 HB2 CYS 27 1HB CYS 27 7.227 -1.698 0.781
210 HB3 CYS 27 2HB CYS 27 8.307 -2.908 0.108
211 HG CYS 27 HG CYS 27 5.931 -3.765 -0.811
212 H GLN 28 H GLN 28 10.284 -3.179 0.901
213 HA GLN 28 HA GLN 28 11.906 -1.485 2.590
214 HB2 GLN 28 1HB GLN 28 12.607 -2.815 -0.021
215 HB3 GLN 28 2HB GLN 28 13.735 -2.049 1.080
216 HG2 GLN 28 1HG GLN 28 12.093 -4.505 1.647
217 HG3 GLN 28 2HG GLN 28 13.822 -4.456 1.302
218 HE21 GLN 28 1HE2 GLN 28 15.226 -3.623 2.856
219 HE22 GLN 28 2HE2 GLN 28 14.762 -3.463 4.514
220 H LYS 29 H LYS 29 13.377 0.114 1.368
221 HA LYS 29 HA LYS 29 13.598 2.109 0.291
222 HB2 LYS 29 1HB LYS 29 11.395 1.056 -1.475
223 HB3 LYS 29 2HB LYS 29 12.376 2.470 -1.820
224 HG2 LYS 29 1HG LYS 29 14.348 1.106 -2.032
225 HG3 LYS 29 2HG LYS 29 13.450 -0.328 -1.527
226 HD2 LYS 29 1HD LYS 29 12.953 1.292 -4.027
227 HD3 LYS 29 2HD LYS 29 13.745 -0.282 -3.954
228 HE2 LYS 29 1HE LYS 29 10.876 0.340 -3.240
229 HE3 LYS 29 2HE LYS 29 11.444 -0.559 -4.645
230 HZ1 LYS 29 3HZ LYS 29 12.335 -2.243 -3.129
231 HZ2 LYS 29 1HZ LYS 29 10.663 -2.060 -2.953
232 HZ3 LYS 29 2HZ LYS 29 11.709 -1.392 -1.810
233 H SER 30 H SER 30 11.419 1.403 2.305
234 HA SER 30 HA SER 30 10.091 2.623 3.676
235 HB2 SER 30 1HB SER 30 10.407 4.889 1.700
236 HB3 SER 30 2HB SER 30 9.703 5.009 3.312
237 HG SER 30 HG SER 30 12.168 3.846 3.354
238 H LEU 31 H LEU 31 9.346 1.676 0.572
239 HA LEU 31 HA LEU 31 6.642 2.541 0.445
240 HB2 LEU 31 1HB LEU 31 8.149 0.273 -0.862
241 HB3 LEU 31 2HB LEU 31 6.435 0.498 -1.095
242 HG LEU 31 HG LEU 31 7.755 1.406 -2.937
243 HD11 LEU 31 1HD1 LEU 31 6.325 3.519 -1.336
244 HD12 LEU 31 2HD1 LEU 31 5.574 2.345 -2.418
245 HD13 LEU 31 3HD1 LEU 31 6.658 3.574 -3.069
246 HD21 LEU 31 3HD2 LEU 31 9.755 2.088 -1.766
247 HD22 LEU 31 1HD2 LEU 31 8.848 3.335 -0.912
248 HD23 LEU 31 2HD2 LEU 31 9.067 3.443 -2.659
249 H LYS 32 H LYS 32 4.749 1.291 0.906
250 HA LYS 32 HA LYS 32 5.143 -1.247 2.237
251 HB2 LYS 32 1HB LYS 32 3.550 -0.626 4.014
252 HB3 LYS 32 2HB LYS 32 5.025 0.313 4.020
253 HG2 LYS 32 1HG LYS 32 2.621 1.407 2.686
254 HG3 LYS 32 2HG LYS 32 2.765 1.446 4.454
255 HD2 LYS 32 1HD LYS 32 4.865 2.531 2.570
256 HD3 LYS 32 2HD LYS 32 3.567 3.516 3.242
257 HE2 LYS 32 1HE LYS 32 4.355 3.001 5.504
258 HE3 LYS 32 2HE LYS 32 5.652 2.017 4.829
259 HZ1 LYS 32 3HZ LYS 32 6.587 3.962 3.796
260 HZ2 LYS 32 1HZ LYS 32 6.388 4.253 5.452
261 HZ3 LYS 32 2HZ LYS 32 5.305 4.926 4.340
262 H CYS 33 H CYS 33 3.095 -2.493 2.415
263 HA CYS 33 HA CYS 33 2.014 -2.429 -0.262
264 HB2 CYS 33 1HB CYS 33 2.822 -4.531 0.840
265 HB3 CYS 33 2HB CYS 33 1.452 -4.413 1.940
266 HG CYS 33 HG CYS 33 1.241 -4.831 -1.447
267 H CYS 34 H CYS 34 0.346 -1.191 -0.673
268 HA CYS 34 HA CYS 34 -1.869 -1.098 1.254
269 HB2 CYS 34 1HB CYS 34 -1.353 0.698 -1.130
270 HB3 CYS 34 2HB CYS 34 -2.623 0.897 0.072
271 HG CYS 34 HG CYS 34 0.478 0.829 1.344
272 H ARG 35 H ARG 35 -3.684 -2.155 0.763
273 HA ARG 35 HA ARG 35 -3.964 -3.198 -1.975
274 HB2 ARG 35 1HB ARG 35 -5.265 -4.203 0.562
275 HB3 ARG 35 2HB ARG 35 -5.383 -4.945 -1.025
276 HG2 ARG 35 1HG ARG 35 -3.025 -5.469 -0.998
277 HG3 ARG 35 2HG ARG 35 -2.834 -4.639 0.548
278 HD2 ARG 35 1HD ARG 35 -2.988 -6.900 1.135
279 HD3 ARG 35 2HD ARG 35 -4.600 -6.253 1.423
280 HE ARG 35 HE ARG 35 -4.050 -7.601 -1.117
281 HH11 ARG 35 1HH1 ARG 35 -5.741 -7.437 1.940
282 HH12 ARG 35 2HH1 ARG 35 -6.798 -8.761 1.576
283 HH21 ARG 35 1HH2 ARG 35 -5.440 -9.340 -1.615
284 HH22 ARG 35 2HH2 ARG 35 -6.630 -9.845 -0.455
285 H THR 36 H THR 36 -5.506 -2.360 -3.190
286 HA THR 36 HA THR 36 -7.352 -0.452 -2.090
287 HB THR 36 HB THR 36 -7.399 -1.481 -4.918
288 HG1 THR 36 HG1 THR 36 -5.408 -0.083 -3.603
289 HG21 THR 36 1HG2 THR 36 -9.216 0.017 -4.253
290 HG22 THR 36 2HG2 THR 36 -8.142 0.824 -5.397
291 HG23 THR 36 3HG2 THR 36 -8.043 1.201 -3.678
292 H ILE 37 H ILE 37 -9.105 -1.014 -1.118
293 HA ILE 37 HA ILE 37 -10.174 -3.628 -1.145
294 HB ILE 37 HB ILE 37 -11.557 -1.104 -0.239
295 HG12 ILE 37 1HG1 ILE 37 -9.323 -1.214 0.747
296 HG13 ILE 37 2HG1 ILE 37 -10.543 -1.534 1.968
297 HG21 ILE 37 1HG2 ILE 37 -11.849 -3.972 0.634
298 HG22 ILE 37 2HG2 ILE 37 -12.980 -3.076 -0.377
299 HG23 ILE 37 3HG2 ILE 37 -12.723 -2.593 1.299
300 HD11 ILE 37 3HD1 ILE 37 -10.028 -3.822 2.017
301 HD12 ILE 37 1HD1 ILE 37 -8.488 -2.974 2.028
302 HD13 ILE 37 2HD1 ILE 37 -9.074 -3.720 0.538
303 H GLN 38 H GLN 38 -11.686 -4.532 -2.370
304 HA GLN 38 HA GLN 38 -12.704 -3.136 -4.662
305 HB2 GLN 38 1HB GLN 38 -13.657 -5.231 -5.326
306 HB3 GLN 38 2HB GLN 38 -12.065 -5.566 -4.670
307 HG2 GLN 38 1HG GLN 38 -14.641 -5.905 -3.152
308 HG3 GLN 38 2HG GLN 38 -13.806 -7.197 -4.010
309 HE21 GLN 38 1HE2 GLN 38 -14.465 -6.901 -1.179
310 HE22 GLN 38 2HE2 GLN 38 -12.960 -7.062 -0.336
311 HA PRO 39 HA PRO 39 -16.572 -1.524 -3.224
312 HB2 PRO 39 1HB PRO 39 -17.740 -3.043 -5.514
313 HB3 PRO 39 2HB PRO 39 -17.971 -1.354 -5.054
314 HG2 PRO 39 1HG PRO 39 -16.385 -1.996 -7.088
315 HG3 PRO 39 2HG PRO 39 -15.950 -0.688 -5.974
316 HD2 PRO 39 1HD PRO 39 -14.840 -3.442 -6.188
317 HD3 PRO 39 2HD PRO 39 -14.038 -1.931 -5.714
318 H SER 40 H SER 40 -17.841 -2.227 -1.655
319 HA SER 40 HA SER 40 -19.022 -3.520 -0.253
320 HB2 SER 40 1HB SER 40 -19.072 -5.557 -2.484
321 HB3 SER 40 2HB SER 40 -20.071 -5.567 -1.035
322 HG SER 40 HG SER 40 -20.113 -3.236 -2.540
323 H GLY 41 H GLY 41 -18.256 -4.464 1.464
324 HA2 GLY 41 1HA GLY 41 -15.564 -5.246 1.591
325 HA3 GLY 41 2HA GLY 41 -16.738 -5.400 2.885
326 H SER 42 H SER 42 -14.662 -7.039 1.005
327 HA SER 42 HA SER 42 -15.842 -9.582 1.795
328 HB2 SER 42 1HB SER 42 -14.699 -9.154 -0.976
329 HB3 SER 42 2HB SER 42 -15.477 -10.609 -0.355
330 HG SER 42 HG SER 42 -17.372 -9.156 -0.049
331 H ILE 43 H ILE 43 -14.330 -10.925 2.621
332 HA ILE 43 HA ILE 43 -12.329 -11.872 3.152
333 HB ILE 43 HB ILE 43 -11.113 -10.091 1.036
334 HG12 ILE 43 1HG1 ILE 43 -11.988 -12.984 0.869
335 HG13 ILE 43 2HG1 ILE 43 -12.839 -11.622 0.144
336 HG21 ILE 43 1HG2 ILE 43 -9.456 -10.878 2.619
337 HG22 ILE 43 2HG2 ILE 43 -9.258 -11.702 1.072
338 HG23 ILE 43 3HG2 ILE 43 -10.024 -12.537 2.423
339 HD11 ILE 43 3HD1 ILE 43 -10.058 -12.538 -0.553
340 HD12 ILE 43 1HD1 ILE 43 -10.911 -11.178 -1.280
341 HD13 ILE 43 2HD1 ILE 43 -11.517 -12.818 -1.502
342 H ILE 44 H ILE 44 -12.003 -8.397 2.556
343 HA ILE 44 HA ILE 44 -9.891 -7.939 4.356
344 HB ILE 44 HB ILE 44 -10.322 -5.603 4.074
345 HG12 ILE 44 1HG1 ILE 44 -12.895 -6.061 2.623
346 HG13 ILE 44 2HG1 ILE 44 -12.921 -6.108 4.383
347 HG21 ILE 44 1HG2 ILE 44 -9.364 -6.573 2.129
348 HG22 ILE 44 2HG2 ILE 44 -10.633 -5.489 1.555
349 HG23 ILE 44 3HG2 ILE 44 -10.914 -7.228 1.608
350 HD11 ILE 44 3HD1 ILE 44 -12.030 -3.862 4.478
351 HD12 ILE 44 1HD1 ILE 44 -13.497 -3.907 3.504
352 HD13 ILE 44 2HD1 ILE 44 -11.921 -3.811 2.720
353 H ASP 45 H ASP 45 -10.036 -6.518 6.292
354 HA ASP 45 HA ASP 45 -12.234 -7.405 7.994
355 HB2 ASP 45 1HB ASP 45 -10.875 -6.971 9.872
356 HB3 ASP 45 2HB ASP 45 -9.796 -7.695 8.694
Start of MODEL 18
1 H PHE 1 1H PHE 1 8.072 -14.213 1.299
2 HA PHE 1 HA PHE 1 5.755 -14.434 0.734
3 HB2 PHE 1 1HB PHE 1 6.333 -14.250 3.694
4 HB3 PHE 1 2HB PHE 1 4.923 -15.042 3.004
5 HD1 PHE 1 HD2 PHE 1 5.692 -16.708 0.957
6 HD2 PHE 1 HD1 PHE 1 7.961 -15.680 4.406
7 HE1 PHE 1 HE2 PHE 1 6.969 -18.798 0.733
8 HE2 PHE 1 HE1 PHE 1 9.246 -17.766 4.187
9 HZ PHE 1 HZ PHE 1 8.747 -19.328 2.350
10 H PHE 2 H PHE 2 6.373 -11.675 2.896
11 HA PHE 2 HA PHE 2 3.759 -10.903 3.363
12 HB2 PHE 2 1HB PHE 2 6.331 -9.382 3.272
13 HB3 PHE 2 2HB PHE 2 4.812 -8.517 3.485
14 HD1 PHE 2 HD2 PHE 2 3.239 -9.531 5.346
15 HD2 PHE 2 HD1 PHE 2 7.453 -10.084 5.156
16 HE1 PHE 2 HE2 PHE 2 3.277 -10.031 7.754
17 HE2 PHE 2 HE1 PHE 2 7.498 -10.585 7.563
18 HZ PHE 2 HZ PHE 2 5.409 -10.557 8.865
19 H ASP 3 H ASP 3 5.862 -9.511 0.794
20 HA ASP 3 HA ASP 3 3.461 -8.372 -0.364
21 HB2 ASP 3 1HB ASP 3 4.926 -7.193 -1.921
22 HB3 ASP 3 2HB ASP 3 5.360 -6.889 -0.246
23 H GLU 4 H GLU 4 5.090 -11.201 -0.622
24 HA GLU 4 HA GLU 4 4.479 -11.863 -3.325
25 HB2 GLU 4 1HB GLU 4 5.974 -13.234 -1.886
26 HB3 GLU 4 2HB GLU 4 4.598 -13.647 -0.875
27 HG2 GLU 4 1HG GLU 4 3.547 -14.735 -2.836
28 HG3 GLU 4 2HG GLU 4 5.019 -14.412 -3.753
29 H LYS 5 H LYS 5 2.851 -12.134 -0.229
30 HA LYS 5 HA LYS 5 0.316 -12.962 -1.113
31 HB2 LYS 5 1HB LYS 5 1.225 -12.862 1.262
32 HB3 LYS 5 2HB LYS 5 0.915 -11.136 1.215
33 HG2 LYS 5 1HG LYS 5 -0.887 -12.155 2.359
34 HG3 LYS 5 2HG LYS 5 -1.487 -11.661 0.775
35 HD2 LYS 5 1HD LYS 5 -1.503 -13.867 -0.026
36 HD3 LYS 5 2HD LYS 5 -0.464 -14.440 1.281
37 HE2 LYS 5 1HE LYS 5 -2.776 -15.157 1.609
38 HE3 LYS 5 2HE LYS 5 -2.257 -14.061 2.888
39 HZ1 LYS 5 3HZ LYS 5 -3.413 -12.261 1.739
40 HZ2 LYS 5 1HZ LYS 5 -4.469 -13.516 2.145
41 HZ3 LYS 5 2HZ LYS 5 -3.939 -13.345 0.551
42 H CYS 6 H CYS 6 1.852 -9.790 -0.801
43 HA CYS 6 HA CYS 6 -0.371 -8.173 -1.325
44 HB2 CYS 6 1HB CYS 6 1.834 -7.329 -0.516
45 HB3 CYS 6 2HB CYS 6 2.511 -7.639 -2.107
46 HG CYS 6 HG CYS 6 1.341 -5.624 -3.406
47 H ASN 7 H ASN 7 1.934 -9.712 -3.516
48 HA ASN 7 HA ASN 7 1.013 -8.617 -5.930
49 HB2 ASN 7 1HB ASN 7 3.123 -9.914 -5.642
50 HB3 ASN 7 2HB ASN 7 2.168 -11.378 -5.492
51 HD21 ASN 7 1HD2 ASN 7 3.115 -12.308 -7.293
52 HD22 ASN 7 2HD2 ASN 7 2.758 -11.784 -8.901
53 H LYS 8 H LYS 8 0.083 -11.517 -4.171
54 HA LYS 8 HA LYS 8 -1.802 -12.496 -5.992
55 HB2 LYS 8 1HB LYS 8 -0.942 -13.803 -4.090
56 HB3 LYS 8 2HB LYS 8 -1.816 -12.757 -2.980
57 HG2 LYS 8 1HG LYS 8 -2.970 -14.884 -3.354
58 HG3 LYS 8 2HG LYS 8 -3.934 -13.506 -3.888
59 HD2 LYS 8 1HD LYS 8 -3.196 -13.916 -6.200
60 HD3 LYS 8 2HD LYS 8 -2.284 -15.320 -5.647
61 HE2 LYS 8 1HE LYS 8 -4.306 -16.422 -4.953
62 HE3 LYS 8 2HE LYS 8 -5.260 -14.983 -5.312
63 HZ1 LYS 8 3HZ LYS 8 -3.796 -16.651 -7.283
64 HZ2 LYS 8 1HZ LYS 8 -4.638 -15.229 -7.651
65 HZ3 LYS 8 2HZ LYS 8 -5.469 -16.583 -7.077
66 H LEU 9 H LEU 9 -2.187 -10.226 -3.292
67 HA LEU 9 HA LEU 9 -5.002 -9.878 -3.794
68 HB2 LEU 9 1HB LEU 9 -3.037 -8.565 -1.945
69 HB3 LEU 9 2HB LEU 9 -4.630 -7.878 -2.180
70 HG LEU 9 HG LEU 9 -4.615 -9.207 -0.169
71 HD11 LEU 9 1HD1 LEU 9 -6.661 -9.206 -1.516
72 HD12 LEU 9 2HD1 LEU 9 -6.460 -10.709 -0.616
73 HD13 LEU 9 3HD1 LEU 9 -6.109 -10.663 -2.343
74 HD21 LEU 9 3HD2 LEU 9 -2.750 -10.688 -0.749
75 HD22 LEU 9 1HD2 LEU 9 -3.792 -11.538 -1.892
76 HD23 LEU 9 2HD2 LEU 9 -4.155 -11.586 -0.167
77 H LYS 10 H LYS 10 -2.306 -8.827 -5.347
78 HA LYS 10 HA LYS 10 -1.927 -7.356 -7.016
79 HB2 LYS 10 1HB LYS 10 -4.917 -6.957 -6.873
80 HB3 LYS 10 2HB LYS 10 -3.890 -6.276 -8.125
81 HG2 LYS 10 1HG LYS 10 -4.229 -9.214 -7.564
82 HG3 LYS 10 2HG LYS 10 -5.034 -8.317 -8.854
83 HD2 LYS 10 1HD LYS 10 -2.873 -7.784 -9.850
84 HD3 LYS 10 2HD LYS 10 -2.047 -8.631 -8.543
85 HE2 LYS 10 1HE LYS 10 -3.969 -9.891 -10.491
86 HE3 LYS 10 2HE LYS 10 -2.213 -9.984 -10.594
87 HZ1 LYS 10 3HZ LYS 10 -3.140 -11.963 -9.580
88 HZ2 LYS 10 1HZ LYS 10 -3.876 -11.038 -8.370
89 HZ3 LYS 10 2HZ LYS 10 -2.189 -11.123 -8.463
90 H GLY 11 H GLY 11 -1.551 -6.561 -4.363
91 HA2 GLY 11 1HA GLY 11 -2.426 -3.788 -4.200
92 HA3 GLY 11 2HA GLY 11 -1.489 -4.661 -2.995
93 H THR 12 H THR 12 -0.966 -2.025 -4.046
94 HA THR 12 HA THR 12 1.470 -2.480 -5.643
95 HB THR 12 HB THR 12 0.116 0.180 -5.263
96 HG1 THR 12 HG1 THR 12 -1.461 -1.194 -6.135
97 HG21 THR 12 1HG2 THR 12 1.830 -0.930 -7.487
98 HG22 THR 12 2HG2 THR 12 2.382 0.161 -6.218
99 HG23 THR 12 3HG2 THR 12 1.185 0.708 -7.391
100 H CYS 13 H CYS 13 3.406 -1.470 -5.025
101 HA CYS 13 HA CYS 13 3.675 -0.843 -2.227
102 HB2 CYS 13 1HB CYS 13 6.087 -0.224 -3.132
103 HB3 CYS 13 2HB CYS 13 5.599 -1.892 -2.894
104 HG CYS 13 HG CYS 13 6.548 -0.355 -5.649
105 H LYS 14 H LYS 14 2.858 1.001 -1.613
106 HA LYS 14 HA LYS 14 3.885 3.428 -2.873
107 HB2 LYS 14 1HB LYS 14 1.645 4.502 -2.552
108 HB3 LYS 14 2HB LYS 14 1.676 3.255 -3.790
109 HG2 LYS 14 1HG LYS 14 0.623 1.685 -2.307
110 HG3 LYS 14 2HG LYS 14 0.706 2.838 -0.973
111 HD2 LYS 14 1HD LYS 14 -1.523 2.842 -1.872
112 HD3 LYS 14 2HD LYS 14 -0.736 4.372 -2.272
113 HE2 LYS 14 1HE LYS 14 -0.307 3.592 -4.527
114 HE3 LYS 14 2HE LYS 14 -0.968 2.006 -4.134
115 HZ1 LYS 14 3HZ LYS 14 -2.461 4.570 -4.207
116 HZ2 LYS 14 1HZ LYS 14 -3.115 3.094 -3.691
117 HZ3 LYS 14 2HZ LYS 14 -2.607 3.288 -5.297
118 H ASN 15 H ASN 15 3.734 5.290 -1.418
119 HA ASN 15 HA ASN 15 4.452 4.464 1.262
120 HB2 ASN 15 1HB ASN 15 5.709 6.191 -0.023
121 HB3 ASN 15 2HB ASN 15 4.313 7.236 0.080
122 HD21 ASN 15 1HD2 ASN 15 6.955 5.820 1.809
123 HD22 ASN 15 2HD2 ASN 15 6.804 6.782 3.238
124 H ASN 16 H ASN 16 2.066 6.486 -0.317
125 HA ASN 16 HA ASN 16 0.479 6.544 2.170
126 HB2 ASN 16 1HB ASN 16 0.288 8.360 -0.246
127 HB3 ASN 16 2HB ASN 16 -0.634 8.521 1.245
128 HD21 ASN 16 1HD2 ASN 16 2.482 8.834 -0.249
129 HD22 ASN 16 2HD2 ASN 16 3.202 9.808 0.989
130 H CYS 17 H CYS 17 -1.380 5.442 2.226
131 HA CYS 17 HA CYS 17 -2.147 3.812 0.017
132 HB2 CYS 17 1HB CYS 17 -3.852 4.364 2.443
133 HB3 CYS 17 2HB CYS 17 -3.814 2.920 1.446
134 HG CYS 17 HG CYS 17 -1.133 2.300 2.297
135 H GLY 18 H GLY 18 -3.804 4.035 -1.408
136 HA2 GLY 18 1HA GLY 18 -4.827 6.764 -1.669
137 HA3 GLY 18 2HA GLY 18 -4.792 5.538 -2.926
138 H LYS 19 H LYS 19 -6.958 6.114 -3.365
139 HA LYS 19 HA LYS 19 -9.121 6.166 -1.719
140 HB2 LYS 19 1HB LYS 19 -10.408 5.300 -3.757
141 HB3 LYS 19 2HB LYS 19 -9.473 6.774 -3.948
142 HG2 LYS 19 1HG LYS 19 -8.826 5.719 -5.843
143 HG3 LYS 19 2HG LYS 19 -7.627 5.028 -4.749
144 HD2 LYS 19 1HD LYS 19 -9.298 3.134 -4.388
145 HD3 LYS 19 2HD LYS 19 -10.157 3.776 -5.789
146 HE2 LYS 19 1HE LYS 19 -8.708 2.023 -6.536
147 HE3 LYS 19 2HE LYS 19 -8.049 3.560 -7.094
148 HZ1 LYS 19 3HZ LYS 19 -7.110 2.017 -4.736
149 HZ2 LYS 19 1HZ LYS 19 -6.487 3.509 -5.236
150 HZ3 LYS 19 2HZ LYS 19 -6.311 2.146 -6.220
151 H ASN 20 H ASN 20 -9.788 4.837 -0.236
152 HA ASN 20 HA ASN 20 -10.504 2.984 0.858
153 HB2 ASN 20 1HB ASN 20 -12.029 3.056 -1.164
154 HB3 ASN 20 2HB ASN 20 -11.000 1.826 -1.886
155 HD21 ASN 20 1HD2 ASN 20 -12.698 0.366 -1.962
156 HD22 ASN 20 2HD2 ASN 20 -13.279 -0.438 -0.548
157 H GLU 21 H GLU 21 -7.857 2.976 0.879
158 HA GLU 21 HA GLU 21 -7.163 0.167 0.344
159 HB2 GLU 21 1HB GLU 21 -5.417 2.614 0.043
160 HB3 GLU 21 2HB GLU 21 -4.788 0.975 0.045
161 HG2 GLU 21 1HG GLU 21 -6.378 0.534 -1.886
162 HG3 GLU 21 2HG GLU 21 -6.600 2.278 -1.962
163 H GLU 22 H GLU 22 -5.457 -0.691 1.728
164 HA GLU 22 HA GLU 22 -5.124 0.722 4.281
165 HB2 GLU 22 1HB GLU 22 -5.578 -1.236 5.571
166 HB3 GLU 22 2HB GLU 22 -6.923 -1.046 4.455
167 HG2 GLU 22 1HG GLU 22 -6.094 -2.790 3.049
168 HG3 GLU 22 2HG GLU 22 -4.593 -2.880 3.966
169 H LEU 23 H LEU 23 -3.250 0.042 5.476
170 HA LEU 23 HA LEU 23 -1.032 -0.743 3.806
171 HB2 LEU 23 1HB LEU 23 -1.177 0.878 5.920
172 HB3 LEU 23 2HB LEU 23 -0.835 -0.603 6.768
173 HG LEU 23 HG LEU 23 0.923 0.597 4.632
174 HD11 LEU 23 1HD1 LEU 23 1.174 0.594 7.637
175 HD12 LEU 23 2HD1 LEU 23 0.895 1.999 6.609
176 HD13 LEU 23 3HD1 LEU 23 2.422 1.126 6.513
177 HD21 LEU 23 3HD2 LEU 23 1.357 -1.688 6.536
178 HD22 LEU 23 1HD2 LEU 23 2.547 -1.041 5.407
179 HD23 LEU 23 2HD2 LEU 23 1.087 -1.824 4.800
180 H ILE 24 H ILE 24 -0.654 -2.792 3.370
181 HA ILE 24 HA ILE 24 -1.751 -4.868 5.127
182 HB ILE 24 HB ILE 24 -2.254 -6.084 3.308
183 HG12 ILE 24 1HG1 ILE 24 0.164 -5.199 1.760
184 HG13 ILE 24 2HG1 ILE 24 0.302 -6.412 3.028
185 HG21 ILE 24 1HG2 ILE 24 -1.549 -3.505 1.924
186 HG22 ILE 24 2HG2 ILE 24 -3.104 -3.932 2.639
187 HG23 ILE 24 3HG2 ILE 24 -2.514 -4.804 1.224
188 HD11 ILE 24 3HD1 ILE 24 -1.352 -6.573 0.541
189 HD12 ILE 24 1HD1 ILE 24 -1.397 -7.745 1.859
190 HD13 ILE 24 2HD1 ILE 24 0.094 -7.505 0.945
191 H ALA 25 H ALA 25 1.225 -3.781 3.612
192 HA ALA 25 HA ALA 25 2.817 -5.395 5.413
193 HB1 ALA 25 3HB ALA 25 2.268 -6.948 3.537
194 HB2 ALA 25 1HB ALA 25 3.994 -6.621 3.702
195 HB3 ALA 25 2HB ALA 25 3.065 -5.828 2.434
196 H LEU 26 H LEU 26 5.150 -4.990 5.046
197 HA LEU 26 HA LEU 26 5.486 -2.163 4.351
198 HB2 LEU 26 1HB LEU 26 6.904 -4.000 6.250
199 HB3 LEU 26 2HB LEU 26 7.566 -2.433 5.809
200 HG LEU 26 HG LEU 26 4.906 -2.898 7.169
201 HD11 LEU 26 1HD1 LEU 26 5.987 -1.932 9.131
202 HD12 LEU 26 2HD1 LEU 26 7.515 -1.853 8.254
203 HD13 LEU 26 3HD1 LEU 26 6.788 -3.417 8.621
204 HD21 LEU 26 3HD2 LEU 26 4.852 -0.897 5.801
205 HD22 LEU 26 1HD2 LEU 26 6.380 -0.354 6.494
206 HD23 LEU 26 2HD2 LEU 26 4.940 -0.454 7.504
207 H CYS 27 H CYS 27 7.077 -1.503 2.985
208 HA CYS 27 HA CYS 27 8.460 -3.637 1.501
209 HB2 CYS 27 1HB CYS 27 7.473 -0.939 0.555
210 HB3 CYS 27 2HB CYS 27 8.414 -2.050 -0.430
211 HG CYS 27 HG CYS 27 6.502 -3.749 -1.010
212 H GLN 28 H GLN 28 10.477 -2.813 0.378
213 HA GLN 28 HA GLN 28 12.223 -1.599 2.275
214 HB2 GLN 28 1HB GLN 28 12.670 -2.199 -0.645
215 HB3 GLN 28 2HB GLN 28 13.920 -1.760 0.506
216 HG2 GLN 28 1HG GLN 28 12.191 -4.216 0.703
217 HG3 GLN 28 2HG GLN 28 13.829 -4.179 0.053
218 HE21 GLN 28 1HE2 GLN 28 11.876 -3.929 2.926
219 HE22 GLN 28 2HE2 GLN 28 13.170 -4.091 4.060
220 H LYS 29 H LYS 29 13.713 0.206 1.407
221 HA LYS 29 HA LYS 29 13.901 2.445 1.241
222 HB2 LYS 29 1HB LYS 29 13.468 3.404 -0.834
223 HB3 LYS 29 2HB LYS 29 13.858 1.720 -1.127
224 HG2 LYS 29 1HG LYS 29 11.089 1.960 -0.765
225 HG3 LYS 29 2HG LYS 29 11.587 3.170 -1.948
226 HD2 LYS 29 1HD LYS 29 12.726 1.402 -3.234
227 HD3 LYS 29 2HD LYS 29 12.168 0.206 -2.062
228 HE2 LYS 29 1HE LYS 29 9.853 0.727 -2.610
229 HE3 LYS 29 2HE LYS 29 10.390 1.962 -3.750
230 HZ1 LYS 29 3HZ LYS 29 10.846 -0.963 -3.960
231 HZ2 LYS 29 1HZ LYS 29 11.518 0.184 -5.006
232 HZ3 LYS 29 2HZ LYS 29 9.842 -0.020 -4.937
233 H SER 30 H SER 30 11.710 1.424 2.703
234 HA SER 30 HA SER 30 10.241 2.280 4.200
235 HB2 SER 30 1HB SER 30 11.713 4.283 4.181
236 HB3 SER 30 2HB SER 30 10.727 4.961 2.889
237 HG SER 30 HG SER 30 8.918 4.711 4.399
238 H LEU 31 H LEU 31 9.517 1.544 1.281
239 HA LEU 31 HA LEU 31 6.984 2.879 0.984
240 HB2 LEU 31 1HB LEU 31 8.471 0.754 -0.444
241 HB3 LEU 31 2HB LEU 31 6.767 0.856 -0.697
242 HG LEU 31 HG LEU 31 8.410 2.060 -2.309
243 HD11 LEU 31 1HD1 LEU 31 5.947 2.129 -2.343
244 HD12 LEU 31 2HD1 LEU 31 6.688 3.654 -2.839
245 HD13 LEU 31 3HD1 LEU 31 5.998 3.495 -1.220
246 HD21 LEU 31 3HD2 LEU 31 8.101 4.171 -0.185
247 HD22 LEU 31 1HD2 LEU 31 8.872 4.361 -1.757
248 HD23 LEU 31 2HD2 LEU 31 9.597 3.311 -0.540
249 H LYS 32 H LYS 32 5.136 1.206 0.464
250 HA LYS 32 HA LYS 32 4.953 -0.884 2.481
251 HB2 LYS 32 1HB LYS 32 2.991 1.427 2.429
252 HB3 LYS 32 2HB LYS 32 2.826 -0.024 3.401
253 HG2 LYS 32 1HG LYS 32 3.665 1.370 4.974
254 HG3 LYS 32 2HG LYS 32 5.185 0.771 4.314
255 HD2 LYS 32 1HD LYS 32 5.316 2.738 2.853
256 HD3 LYS 32 2HD LYS 32 3.806 3.339 3.534
257 HE2 LYS 32 1HE LYS 32 6.369 2.866 5.051
258 HE3 LYS 32 2HE LYS 32 5.749 4.434 4.539
259 HZ1 LYS 32 3HZ LYS 32 3.756 3.966 5.926
260 HZ2 LYS 32 1HZ LYS 32 5.191 4.115 6.811
261 HZ3 LYS 32 2HZ LYS 32 4.535 2.590 6.518
262 H CYS 33 H CYS 33 3.231 -2.350 2.085
263 HA CYS 33 HA CYS 33 2.240 -2.305 -0.645
264 HB2 CYS 33 1HB CYS 33 2.013 -4.335 1.582
265 HB3 CYS 33 2HB CYS 33 1.323 -4.548 -0.018
266 HG CYS 33 HG CYS 33 4.538 -3.803 -0.199
267 H CYS 34 H CYS 34 0.369 -1.345 -1.087
268 HA CYS 34 HA CYS 34 -1.679 -1.293 1.028
269 HB2 CYS 34 1HB CYS 34 -1.249 0.710 -1.200
270 HB3 CYS 34 2HB CYS 34 -2.517 0.784 0.021
271 HG CYS 34 HG CYS 34 0.830 0.956 0.721
272 H ARG 35 H ARG 35 -3.571 -2.215 0.586
273 HA ARG 35 HA ARG 35 -4.005 -3.136 -2.183
274 HB2 ARG 35 1HB ARG 35 -5.178 -5.050 -1.316
275 HB3 ARG 35 2HB ARG 35 -3.628 -4.943 -0.498
276 HG2 ARG 35 1HG ARG 35 -4.891 -3.745 1.369
277 HG3 ARG 35 2HG ARG 35 -6.357 -4.319 0.578
278 HD2 ARG 35 1HD ARG 35 -5.473 -6.642 0.768
279 HD3 ARG 35 2HD ARG 35 -4.109 -6.005 1.673
280 HE ARG 35 HE ARG 35 -6.485 -5.137 2.890
281 HH11 ARG 35 1HH1 ARG 35 -4.652 -8.089 2.415
282 HH12 ARG 35 2HH1 ARG 35 -5.213 -8.815 3.883
283 HH21 ARG 35 1HH2 ARG 35 -7.210 -6.079 4.809
284 HH22 ARG 35 2HH2 ARG 35 -6.678 -7.679 5.246
285 H THR 36 H THR 36 -5.870 -2.650 -3.181
286 HA THR 36 HA THR 36 -7.653 -0.769 -1.932
287 HB THR 36 HB THR 36 -7.862 -2.098 -4.643
288 HG1 THR 36 HG1 THR 36 -6.101 -0.341 -3.795
289 HG21 THR 36 1HG2 THR 36 -9.350 -0.219 -5.194
290 HG22 THR 36 2HG2 THR 36 -9.237 0.354 -3.531
291 HG23 THR 36 3HG2 THR 36 -10.003 -1.196 -3.879
292 H ILE 37 H ILE 37 -9.390 -1.204 -0.843
293 HA ILE 37 HA ILE 37 -10.149 -3.856 -0.196
294 HB ILE 37 HB ILE 37 -11.595 -1.258 0.311
295 HG12 ILE 37 1HG1 ILE 37 -9.331 -1.141 1.136
296 HG13 ILE 37 2HG1 ILE 37 -10.407 -1.362 2.504
297 HG21 ILE 37 1HG2 ILE 37 -13.041 -3.161 0.662
298 HG22 ILE 37 2HG2 ILE 37 -12.585 -2.466 2.217
299 HG23 ILE 37 3HG2 ILE 37 -11.814 -3.947 1.650
300 HD11 ILE 37 3HD1 ILE 37 -8.761 -3.509 1.189
301 HD12 ILE 37 1HD1 ILE 37 -9.830 -3.733 2.572
302 HD13 ILE 37 2HD1 ILE 37 -8.399 -2.713 2.722
303 H GLN 38 H GLN 38 -10.908 -5.032 -1.851
304 HA GLN 38 HA GLN 38 -13.189 -4.013 -3.378
305 HB2 GLN 38 1HB GLN 38 -12.815 -6.007 -4.828
306 HB3 GLN 38 2HB GLN 38 -11.437 -4.919 -4.764
307 HG2 GLN 38 1HG GLN 38 -10.358 -6.412 -3.140
308 HG3 GLN 38 2HG GLN 38 -11.729 -7.514 -3.268
309 HE21 GLN 38 1HE2 GLN 38 -8.925 -7.979 -3.863
310 HE22 GLN 38 2HE2 GLN 38 -8.856 -8.468 -5.521
311 HA PRO 39 HA PRO 39 -16.055 -6.140 -0.764
312 HB2 PRO 39 1HB PRO 39 -17.576 -6.499 -3.299
313 HB3 PRO 39 2HB PRO 39 -18.106 -5.818 -1.757
314 HG2 PRO 39 1HG PRO 39 -17.593 -4.230 -3.829
315 HG3 PRO 39 2HG PRO 39 -17.132 -3.752 -2.184
316 HD2 PRO 39 1HD PRO 39 -15.430 -4.795 -4.407
317 HD3 PRO 39 2HD PRO 39 -15.065 -3.560 -3.184
318 H SER 40 H SER 40 -15.650 -8.136 -0.095
319 HA SER 40 HA SER 40 -16.028 -10.432 -1.777
320 HB2 SER 40 1HB SER 40 -13.262 -9.754 -0.738
321 HB3 SER 40 2HB SER 40 -13.717 -11.299 -1.448
322 HG SER 40 HG SER 40 -14.426 -9.247 -3.063
323 H GLY 41 H GLY 41 -15.591 -12.465 -0.496
324 HA2 GLY 41 1HA GLY 41 -16.591 -12.100 2.203
325 HA3 GLY 41 2HA GLY 41 -16.362 -13.632 1.370
326 H SER 42 H SER 42 -15.483 -12.274 4.024
327 HA SER 42 HA SER 42 -13.809 -12.547 5.515
328 HB2 SER 42 1HB SER 42 -13.664 -14.860 4.494
329 HB3 SER 42 2HB SER 42 -12.373 -14.244 3.462
330 HG SER 42 HG SER 42 -12.400 -14.665 6.243
331 H ILE 43 H ILE 43 -11.219 -12.328 5.592
332 HA ILE 43 HA ILE 43 -9.437 -10.938 5.365
333 HB ILE 43 HB ILE 43 -10.631 -10.184 2.691
334 HG12 ILE 43 1HG1 ILE 43 -10.032 -12.550 2.800
335 HG13 ILE 43 2HG1 ILE 43 -8.902 -11.688 1.762
336 HG21 ILE 43 1HG2 ILE 43 -9.137 -8.449 3.512
337 HG22 ILE 43 2HG2 ILE 43 -8.407 -9.306 2.153
338 HG23 ILE 43 3HG2 ILE 43 -7.877 -9.649 3.799
339 HD11 ILE 43 3HD1 ILE 43 -7.289 -11.635 3.622
340 HD12 ILE 43 1HD1 ILE 43 -7.721 -13.273 3.129
341 HD13 ILE 43 2HD1 ILE 43 -8.417 -12.581 4.593
342 H ILE 44 H ILE 44 -12.260 -9.250 3.978
343 HA ILE 44 HA ILE 44 -12.294 -7.428 6.210
344 HB ILE 44 HB ILE 44 -10.632 -6.351 4.758
345 HG12 ILE 44 1HG1 ILE 44 -13.258 -4.849 4.714
346 HG13 ILE 44 2HG1 ILE 44 -12.249 -5.033 6.144
347 HG21 ILE 44 1HG2 ILE 44 -12.816 -6.190 2.680
348 HG22 ILE 44 2HG2 ILE 44 -11.430 -7.278 2.614
349 HG23 ILE 44 3HG2 ILE 44 -11.181 -5.532 2.543
350 HD11 ILE 44 3HD1 ILE 44 -11.546 -3.595 3.606
351 HD12 ILE 44 1HD1 ILE 44 -10.429 -3.873 4.940
352 HD13 ILE 44 2HD1 ILE 44 -11.868 -2.886 5.185
353 H ASP 45 H ASP 45 -14.254 -6.181 6.283
354 HA ASP 45 HA ASP 45 -16.397 -7.493 4.763
355 HB2 ASP 45 1HB ASP 45 -16.608 -5.933 7.350
356 HB3 ASP 45 2HB ASP 45 -17.891 -6.856 6.577
Start of MODEL 19
1 H PHE 1 1H PHE 1 9.006 -11.412 -0.360
2 HA PHE 1 HA PHE 1 6.923 -13.403 0.270
3 HB2 PHE 1 1HB PHE 1 8.922 -13.671 1.666
4 HB3 PHE 1 2HB PHE 1 8.888 -11.959 2.064
5 HD1 PHE 1 HD1 PHE 1 7.200 -15.185 2.557
6 HD2 PHE 1 HD2 PHE 1 7.432 -11.109 3.748
7 HE1 PHE 1 HE1 PHE 1 5.795 -15.680 4.511
8 HE2 PHE 1 HE2 PHE 1 6.021 -11.597 5.702
9 HZ PHE 1 HZ PHE 1 5.202 -13.886 6.085
10 H PHE 2 H PHE 2 8.047 -10.142 1.230
11 HA PHE 2 HA PHE 2 5.598 -9.366 2.315
12 HB2 PHE 2 1HB PHE 2 7.828 -7.666 1.201
13 HB3 PHE 2 2HB PHE 2 6.470 -7.032 2.124
14 HD1 PHE 2 HD2 PHE 2 6.093 -8.686 4.342
15 HD2 PHE 2 HD1 PHE 2 9.759 -7.709 2.422
16 HE1 PHE 2 HE2 PHE 2 7.303 -9.143 6.433
17 HE2 PHE 2 HE1 PHE 2 10.978 -8.167 4.509
18 HZ PHE 2 HZ PHE 2 9.748 -8.885 6.518
19 H ASP 3 H ASP 3 6.950 -8.493 -0.885
20 HA ASP 3 HA ASP 3 4.311 -7.501 -1.568
21 HB2 ASP 3 1HB ASP 3 5.271 -6.533 -3.552
22 HB3 ASP 3 2HB ASP 3 6.206 -6.065 -2.141
23 H GLU 4 H GLU 4 5.811 -10.406 -1.705
24 HA GLU 4 HA GLU 4 4.621 -11.345 -4.139
25 HB2 GLU 4 1HB GLU 4 6.427 -12.594 -2.910
26 HB3 GLU 4 2HB GLU 4 5.253 -12.952 -1.649
27 HG2 GLU 4 1HG GLU 4 3.859 -14.108 -3.326
28 HG3 GLU 4 2HG GLU 4 5.120 -13.825 -4.524
29 H LYS 5 H LYS 5 3.748 -11.150 -0.758
30 HA LYS 5 HA LYS 5 1.079 -12.002 -0.923
31 HB2 LYS 5 1HB LYS 5 2.386 -11.630 1.169
32 HB3 LYS 5 2HB LYS 5 2.292 -9.903 0.878
33 HG2 LYS 5 1HG LYS 5 0.653 -10.384 2.481
34 HG3 LYS 5 2HG LYS 5 -0.215 -10.149 0.963
35 HD2 LYS 5 1HD LYS 5 -0.496 -12.500 0.677
36 HD3 LYS 5 2HD LYS 5 0.600 -12.852 2.014
37 HE2 LYS 5 1HE LYS 5 -2.094 -11.509 2.202
38 HE3 LYS 5 2HE LYS 5 -1.707 -13.149 2.713
39 HZ1 LYS 5 3HZ LYS 5 -0.594 -10.652 3.879
40 HZ2 LYS 5 1HZ LYS 5 -0.173 -12.220 4.353
41 HZ3 LYS 5 2HZ LYS 5 -1.748 -11.656 4.594
42 H CYS 6 H CYS 6 2.616 -8.829 -1.296
43 HA CYS 6 HA CYS 6 0.341 -7.253 -1.586
44 HB2 CYS 6 1HB CYS 6 2.742 -6.482 -1.344
45 HB3 CYS 6 2HB CYS 6 2.963 -6.853 -3.047
46 HG CYS 6 HG CYS 6 1.283 -4.914 -4.002
47 H ASN 7 H ASN 7 2.255 -8.918 -4.073
48 HA ASN 7 HA ASN 7 0.780 -8.147 -6.320
49 HB2 ASN 7 1HB ASN 7 2.990 -9.310 -6.335
50 HB3 ASN 7 2HB ASN 7 2.170 -10.793 -5.879
51 HD21 ASN 7 1HD2 ASN 7 2.811 -11.844 -7.746
52 HD22 ASN 7 2HD2 ASN 7 2.131 -11.483 -9.292
53 H LYS 8 H LYS 8 0.412 -10.870 -4.132
54 HA LYS 8 HA LYS 8 -1.647 -12.228 -5.430
55 HB2 LYS 8 1HB LYS 8 -0.377 -13.149 -3.532
56 HB3 LYS 8 2HB LYS 8 -1.155 -11.999 -2.455
57 HG2 LYS 8 1HG LYS 8 -2.204 -14.141 -2.221
58 HG3 LYS 8 2HG LYS 8 -3.335 -13.027 -2.992
59 HD2 LYS 8 1HD LYS 8 -2.746 -13.973 -5.183
60 HD3 LYS 8 2HD LYS 8 -1.650 -15.105 -4.389
61 HE2 LYS 8 1HE LYS 8 -4.635 -14.932 -3.997
62 HE3 LYS 8 2HE LYS 8 -3.773 -16.173 -4.905
63 HZ1 LYS 8 3HZ LYS 8 -4.335 -16.979 -2.725
64 HZ2 LYS 8 1HZ LYS 8 -3.558 -15.669 -1.987
65 HZ3 LYS 8 2HZ LYS 8 -2.656 -16.815 -2.839
66 H LEU 9 H LEU 9 -1.804 -9.589 -3.066
67 HA LEU 9 HA LEU 9 -4.696 -9.529 -3.163
68 HB2 LEU 9 1HB LEU 9 -2.642 -7.869 -1.732
69 HB3 LEU 9 2HB LEU 9 -4.325 -7.393 -1.772
70 HG LEU 9 HG LEU 9 -3.926 -8.493 0.303
71 HD11 LEU 9 1HD1 LEU 9 -5.498 -10.326 0.230
72 HD12 LEU 9 2HD1 LEU 9 -5.326 -10.436 -1.522
73 HD13 LEU 9 3HD1 LEU 9 -6.054 -9.003 -0.795
74 HD21 LEU 9 3HD2 LEU 9 -3.040 -10.737 0.496
75 HD22 LEU 9 1HD2 LEU 9 -1.886 -9.689 -0.332
76 HD23 LEU 9 2HD2 LEU 9 -2.858 -10.837 -1.255
77 H LYS 10 H LYS 10 -2.316 -8.464 -5.153
78 HA LYS 10 HA LYS 10 -2.242 -7.105 -6.954
79 HB2 LYS 10 1HB LYS 10 -5.201 -7.057 -6.439
80 HB3 LYS 10 2HB LYS 10 -4.491 -6.088 -7.719
81 HG2 LYS 10 1HG LYS 10 -4.254 -9.080 -7.465
82 HG3 LYS 10 2HG LYS 10 -5.374 -8.229 -8.531
83 HD2 LYS 10 1HD LYS 10 -2.362 -8.044 -8.641
84 HD3 LYS 10 2HD LYS 10 -3.369 -9.003 -9.725
85 HE2 LYS 10 1HE LYS 10 -4.418 -7.028 -10.593
86 HE3 LYS 10 2HE LYS 10 -3.606 -6.016 -9.401
87 HZ1 LYS 10 3HZ LYS 10 -2.514 -5.852 -11.517
88 HZ2 LYS 10 1HZ LYS 10 -2.298 -7.528 -11.590
89 HZ3 LYS 10 2HZ LYS 10 -1.486 -6.619 -10.416
90 H GLY 11 H GLY 11 -1.652 -6.109 -4.378
91 HA2 GLY 11 1HA GLY 11 -2.586 -3.325 -4.487
92 HA3 GLY 11 2HA GLY 11 -1.773 -4.084 -3.124
93 H THR 12 H THR 12 -0.805 -1.724 -3.774
94 HA THR 12 HA THR 12 1.647 -2.318 -5.312
95 HB THR 12 HB THR 12 0.526 0.456 -5.049
96 HG1 THR 12 HG1 THR 12 -0.247 -1.580 -6.879
97 HG21 THR 12 1HG2 THR 12 1.751 0.825 -7.134
98 HG22 THR 12 2HG2 THR 12 2.235 -0.871 -7.157
99 HG23 THR 12 3HG2 THR 12 2.817 0.196 -5.878
100 H CYS 13 H CYS 13 3.594 -1.479 -4.465
101 HA CYS 13 HA CYS 13 3.501 -0.724 -1.656
102 HB2 CYS 13 1HB CYS 13 6.026 -0.847 -3.301
103 HB3 CYS 13 2HB CYS 13 5.818 -1.095 -1.576
104 HG CYS 13 HG CYS 13 6.008 -3.633 -1.828
105 H LYS 14 H LYS 14 2.848 1.325 -1.416
106 HA LYS 14 HA LYS 14 4.279 3.398 -2.943
107 HB2 LYS 14 1HB LYS 14 1.776 4.400 -1.982
108 HB3 LYS 14 2HB LYS 14 2.351 4.303 -3.636
109 HG2 LYS 14 1HG LYS 14 1.517 1.968 -3.714
110 HG3 LYS 14 2HG LYS 14 0.853 2.209 -2.096
111 HD2 LYS 14 1HD LYS 14 -0.286 4.287 -3.158
112 HD3 LYS 14 2HD LYS 14 0.022 3.449 -4.685
113 HE2 LYS 14 1HE LYS 14 -1.135 1.464 -3.781
114 HE3 LYS 14 2HE LYS 14 -1.491 2.381 -2.319
115 HZ1 LYS 14 3HZ LYS 14 -2.710 3.976 -3.729
116 HZ2 LYS 14 1HZ LYS 14 -3.390 2.424 -3.740
117 HZ3 LYS 14 2HZ LYS 14 -2.468 2.961 -5.057
118 H ASN 15 H ASN 15 3.995 5.582 -1.798
119 HA ASN 15 HA ASN 15 4.923 5.384 0.895
120 HB2 ASN 15 1HB ASN 15 5.323 7.224 -0.922
121 HB3 ASN 15 2HB ASN 15 3.836 7.880 -0.291
122 HD21 ASN 15 1HD2 ASN 15 6.490 9.017 -0.230
123 HD22 ASN 15 2HD2 ASN 15 6.870 9.279 1.438
124 H ASN 16 H ASN 16 2.003 6.404 -0.728
125 HA ASN 16 HA ASN 16 0.573 6.493 1.860
126 HB2 ASN 16 1HB ASN 16 0.017 8.088 -0.650
127 HB3 ASN 16 2HB ASN 16 -0.886 8.192 0.858
128 HD21 ASN 16 1HD2 ASN 16 2.177 8.813 -0.689
129 HD22 ASN 16 2HD2 ASN 16 2.724 10.010 0.441
130 H CYS 17 H CYS 17 -1.510 5.647 1.953
131 HA CYS 17 HA CYS 17 -2.167 3.664 -0.038
132 HB2 CYS 17 1HB CYS 17 -3.805 4.531 2.353
133 HB3 CYS 17 2HB CYS 17 -3.959 3.033 1.447
134 HG CYS 17 HG CYS 17 -1.225 2.309 2.223
135 H GLY 18 H GLY 18 -3.948 3.694 -1.391
136 HA2 GLY 18 1HA GLY 18 -4.837 6.374 -2.123
137 HA3 GLY 18 2HA GLY 18 -5.091 4.897 -3.044
138 H LYS 19 H LYS 19 -7.283 5.666 -3.304
139 HA LYS 19 HA LYS 19 -9.017 5.982 -1.101
140 HB2 LYS 19 1HB LYS 19 -10.843 5.718 -2.802
141 HB3 LYS 19 2HB LYS 19 -9.667 6.968 -3.164
142 HG2 LYS 19 1HG LYS 19 -9.875 6.013 -5.218
143 HG3 LYS 19 2HG LYS 19 -8.553 5.040 -4.575
144 HD2 LYS 19 1HD LYS 19 -10.171 3.305 -3.916
145 HD3 LYS 19 2HD LYS 19 -11.476 4.280 -4.598
146 HE2 LYS 19 1HE LYS 19 -9.136 3.117 -6.103
147 HE3 LYS 19 2HE LYS 19 -10.796 2.533 -6.149
148 HZ1 LYS 19 3HZ LYS 19 -11.444 4.709 -7.074
149 HZ2 LYS 19 1HZ LYS 19 -10.366 3.871 -8.070
150 HZ3 LYS 19 2HZ LYS 19 -9.815 5.158 -7.128
151 H ASN 20 H ASN 20 -10.028 4.582 0.144
152 HA ASN 20 HA ASN 20 -10.713 2.638 1.089
153 HB2 ASN 20 1HB ASN 20 -12.274 2.823 -0.865
154 HB3 ASN 20 2HB ASN 20 -11.196 1.768 -1.769
155 HD21 ASN 20 1HD2 ASN 20 -11.813 1.340 1.649
156 HD22 ASN 20 2HD2 ASN 20 -12.725 -0.120 1.489
157 H GLU 21 H GLU 21 -8.167 2.609 1.300
158 HA GLU 21 HA GLU 21 -7.309 -0.079 0.499
159 HB2 GLU 21 1HB GLU 21 -5.829 2.505 0.132
160 HB3 GLU 21 2HB GLU 21 -4.946 0.998 0.333
161 HG2 GLU 21 1HG GLU 21 -6.169 0.077 -1.601
162 HG3 GLU 21 2HG GLU 21 -6.947 1.642 -1.822
163 H GLU 22 H GLU 22 -5.936 -1.133 1.911
164 HA GLU 22 HA GLU 22 -5.480 0.207 4.499
165 HB2 GLU 22 1HB GLU 22 -5.771 -1.909 5.630
166 HB3 GLU 22 2HB GLU 22 -7.190 -1.596 4.643
167 HG2 GLU 22 1HG GLU 22 -6.465 -3.173 2.994
168 HG3 GLU 22 2HG GLU 22 -4.917 -3.378 3.808
169 H LEU 23 H LEU 23 -3.602 -0.645 5.696
170 HA LEU 23 HA LEU 23 -1.351 -1.021 3.905
171 HB2 LEU 23 1HB LEU 23 -1.637 0.372 6.214
172 HB3 LEU 23 2HB LEU 23 -0.958 -1.124 6.821
173 HG LEU 23 HG LEU 23 1.043 -0.846 5.507
174 HD11 LEU 23 1HD1 LEU 23 1.163 1.406 4.208
175 HD12 LEU 23 2HD1 LEU 23 -0.592 1.254 4.164
176 HD13 LEU 23 3HD1 LEU 23 0.423 -0.012 3.464
177 HD21 LEU 23 3HD2 LEU 23 0.845 0.403 7.638
178 HD22 LEU 23 1HD2 LEU 23 0.294 1.807 6.727
179 HD23 LEU 23 2HD2 LEU 23 1.921 1.175 6.474
180 H ILE 24 H ILE 24 -0.859 -2.982 3.287
181 HA ILE 24 HA ILE 24 -1.857 -5.245 4.850
182 HB ILE 24 HB ILE 24 -2.176 -6.392 2.897
183 HG12 ILE 24 1HG1 ILE 24 -0.383 -4.935 1.087
184 HG13 ILE 24 2HG1 ILE 24 0.460 -5.758 2.396
185 HG21 ILE 24 1HG2 ILE 24 -3.462 -4.376 2.684
186 HG22 ILE 24 2HG2 ILE 24 -2.840 -4.836 1.100
187 HG23 ILE 24 3HG2 ILE 24 -2.082 -3.523 1.995
188 HD11 ILE 24 3HD1 ILE 24 -1.419 -7.006 0.419
189 HD12 ILE 24 1HD1 ILE 24 -0.662 -7.836 1.777
190 HD13 ILE 24 2HD1 ILE 24 0.336 -7.183 0.479
191 H ALA 25 H ALA 25 1.083 -3.778 3.738
192 HA ALA 25 HA ALA 25 2.693 -5.503 5.353
193 HB1 ALA 25 3HB ALA 25 3.004 -5.779 2.361
194 HB2 ALA 25 1HB ALA 25 2.303 -6.997 3.425
195 HB3 ALA 25 2HB ALA 25 4.002 -6.549 3.595
196 H LEU 26 H LEU 26 4.966 -4.980 5.201
197 HA LEU 26 HA LEU 26 5.401 -2.242 4.230
198 HB2 LEU 26 1HB LEU 26 5.314 -2.269 6.594
199 HB3 LEU 26 2HB LEU 26 6.388 -3.634 6.713
200 HG LEU 26 HG LEU 26 7.336 -1.433 7.434
201 HD11 LEU 26 1HD1 LEU 26 8.833 -3.230 6.820
202 HD12 LEU 26 2HD1 LEU 26 9.490 -1.670 6.323
203 HD13 LEU 26 3HD1 LEU 26 8.756 -2.740 5.127
204 HD21 LEU 26 3HD2 LEU 26 7.984 0.202 5.771
205 HD22 LEU 26 1HD2 LEU 26 6.237 -0.032 5.773
206 HD23 LEU 26 2HD2 LEU 26 7.223 -0.759 4.505
207 H CYS 27 H CYS 27 7.101 -1.871 3.031
208 HA CYS 27 HA CYS 27 8.630 -4.230 2.144
209 HB2 CYS 27 1HB CYS 27 7.399 -1.946 0.645
210 HB3 CYS 27 2HB CYS 27 8.773 -2.794 -0.044
211 HG CYS 27 HG CYS 27 5.673 -4.055 0.646
212 H GLN 28 H GLN 28 10.574 -3.264 0.666
213 HA GLN 28 HA GLN 28 12.263 -1.886 2.549
214 HB2 GLN 28 1HB GLN 28 12.929 -2.630 -0.294
215 HB3 GLN 28 2HB GLN 28 14.054 -2.278 1.004
216 HG2 GLN 28 1HG GLN 28 12.272 -4.680 0.740
217 HG3 GLN 28 2HG GLN 28 14.030 -4.632 0.644
218 HE21 GLN 28 1HE2 GLN 28 12.294 -6.175 2.388
219 HE22 GLN 28 2HE2 GLN 28 12.756 -5.768 4.006
220 H LYS 29 H LYS 29 13.675 -0.073 1.630
221 HA LYS 29 HA LYS 29 13.868 2.068 0.886
222 HB2 LYS 29 1HB LYS 29 11.655 1.342 -1.025
223 HB3 LYS 29 2HB LYS 29 12.715 2.736 -1.159
224 HG2 LYS 29 1HG LYS 29 14.616 1.274 -1.525
225 HG3 LYS 29 2HG LYS 29 13.586 -0.141 -1.315
226 HD2 LYS 29 1HD LYS 29 13.359 1.936 -3.494
227 HD3 LYS 29 2HD LYS 29 13.960 0.288 -3.678
228 HE2 LYS 29 1HE LYS 29 11.151 1.077 -2.888
229 HE3 LYS 29 2HE LYS 29 11.656 0.487 -4.469
230 HZ1 LYS 29 3HZ LYS 29 10.680 -1.297 -3.235
231 HZ2 LYS 29 1HZ LYS 29 11.707 -1.030 -1.918
232 HZ3 LYS 29 2HZ LYS 29 12.335 -1.599 -3.377
233 H SER 30 H SER 30 11.610 0.967 2.696
234 HA SER 30 HA SER 30 10.128 1.834 4.160
235 HB2 SER 30 1HB SER 30 10.746 4.515 2.900
236 HB3 SER 30 2HB SER 30 9.917 4.252 4.435
237 HG SER 30 HG SER 30 12.003 2.961 4.869
238 H LEU 31 H LEU 31 9.504 1.197 1.172
239 HA LEU 31 HA LEU 31 7.023 2.582 0.777
240 HB2 LEU 31 1HB LEU 31 8.439 0.321 -0.590
241 HB3 LEU 31 2HB LEU 31 6.767 0.650 -0.958
242 HG LEU 31 HG LEU 31 8.424 1.653 -2.527
243 HD11 LEU 31 1HD1 LEU 31 7.296 3.812 -2.687
244 HD12 LEU 31 2HD1 LEU 31 6.643 3.591 -1.062
245 HD13 LEU 31 3HD1 LEU 31 6.153 2.509 -2.368
246 HD21 LEU 31 3HD2 LEU 31 9.008 3.545 -0.273
247 HD22 LEU 31 1HD2 LEU 31 9.637 3.632 -1.918
248 HD23 LEU 31 2HD2 LEU 31 10.107 2.302 -0.861
249 H LYS 32 H LYS 32 4.933 1.634 0.809
250 HA LYS 32 HA LYS 32 4.680 -0.698 2.596
251 HB2 LYS 32 1HB LYS 32 3.315 1.961 2.653
252 HB3 LYS 32 2HB LYS 32 2.468 0.538 3.235
253 HG2 LYS 32 1HG LYS 32 3.789 0.312 5.063
254 HG3 LYS 32 2HG LYS 32 5.197 1.054 4.279
255 HD2 LYS 32 1HD LYS 32 4.066 3.242 4.399
256 HD3 LYS 32 2HD LYS 32 2.716 2.483 5.238
257 HE2 LYS 32 1HE LYS 32 4.238 1.813 7.045
258 HE3 LYS 32 2HE LYS 32 5.567 2.614 6.209
259 HZ1 LYS 32 3HZ LYS 32 4.330 4.710 6.402
260 HZ2 LYS 32 1HZ LYS 32 4.693 4.041 7.912
261 HZ3 LYS 32 2HZ LYS 32 3.129 3.917 7.288
262 H CYS 33 H CYS 33 3.116 -2.189 2.093
263 HA CYS 33 HA CYS 33 2.072 -2.034 -0.600
264 HB2 CYS 33 1HB CYS 33 1.974 -4.194 1.504
265 HB3 CYS 33 2HB CYS 33 1.292 -4.355 -0.108
266 HG CYS 33 HG CYS 33 3.698 -4.191 -1.446
267 H CYS 34 H CYS 34 0.180 -1.184 -1.032
268 HA CYS 34 HA CYS 34 -1.908 -1.241 1.047
269 HB2 CYS 34 1HB CYS 34 -1.652 0.777 -1.185
270 HB3 CYS 34 2HB CYS 34 -2.723 0.855 0.210
271 HG CYS 34 HG CYS 34 0.678 0.924 0.543
272 H ARG 35 H ARG 35 -3.719 -2.324 0.544
273 HA ARG 35 HA ARG 35 -4.096 -3.099 -2.279
274 HB2 ARG 35 1HB ARG 35 -5.137 -5.114 -1.568
275 HB3 ARG 35 2HB ARG 35 -3.687 -4.949 -0.594
276 HG2 ARG 35 1HG ARG 35 -5.202 -3.897 1.171
277 HG3 ARG 35 2HG ARG 35 -6.541 -4.531 0.217
278 HD2 ARG 35 1HD ARG 35 -5.485 -6.802 0.423
279 HD3 ARG 35 2HD ARG 35 -4.331 -6.092 1.539
280 HE ARG 35 HE ARG 35 -6.730 -5.376 2.577
281 HH11 ARG 35 1HH1 ARG 35 -5.309 -8.441 1.674
282 HH12 ARG 35 2HH1 ARG 35 -6.172 -9.336 2.880
283 HH21 ARG 35 1HH2 ARG 35 -7.836 -6.525 4.166
284 HH22 ARG 35 2HH2 ARG 35 -7.619 -8.249 4.296
285 H THR 36 H THR 36 -6.028 -2.763 -3.252
286 HA THR 36 HA THR 36 -7.790 -0.846 -2.015
287 HB THR 36 HB THR 36 -8.223 -2.182 -4.683
288 HG1 THR 36 HG1 THR 36 -6.417 -0.093 -3.964
289 HG21 THR 36 1HG2 THR 36 -9.276 -0.051 -5.251
290 HG22 THR 36 2HG2 THR 36 -8.877 0.590 -3.658
291 HG23 THR 36 3HG2 THR 36 -10.023 -0.741 -3.812
292 H ILE 37 H ILE 37 -9.434 -1.378 -0.798
293 HA ILE 37 HA ILE 37 -10.135 -4.020 -0.182
294 HB ILE 37 HB ILE 37 -11.691 -1.479 0.285
295 HG12 ILE 37 1HG1 ILE 37 -9.479 -1.266 1.210
296 HG13 ILE 37 2HG1 ILE 37 -10.609 -1.540 2.526
297 HG21 ILE 37 1HG2 ILE 37 -11.896 -4.169 1.608
298 HG22 ILE 37 2HG2 ILE 37 -13.112 -3.382 0.608
299 HG23 ILE 37 3HG2 ILE 37 -12.690 -2.704 2.180
300 HD11 ILE 37 3HD1 ILE 37 -8.563 -2.784 2.858
301 HD12 ILE 37 1HD1 ILE 37 -8.788 -3.599 1.312
302 HD13 ILE 37 2HD1 ILE 37 -9.925 -3.875 2.630
303 H GLN 38 H GLN 38 -11.634 -5.389 -0.949
304 HA GLN 38 HA GLN 38 -13.431 -4.518 -3.063
305 HB2 GLN 38 1HB GLN 38 -14.101 -6.920 -3.162
306 HB3 GLN 38 2HB GLN 38 -12.390 -6.662 -3.443
307 HG2 GLN 38 1HG GLN 38 -13.426 -7.403 -0.732
308 HG3 GLN 38 2HG GLN 38 -13.105 -8.622 -1.963
309 HE21 GLN 38 1HE2 GLN 38 -10.833 -7.196 -3.078
310 HE22 GLN 38 2HE2 GLN 38 -9.541 -7.392 -1.948
311 HA PRO 39 HA PRO 39 -16.563 -3.515 -0.103
312 HB2 PRO 39 1HB PRO 39 -18.470 -4.095 -2.292
313 HB3 PRO 39 2HB PRO 39 -18.242 -2.610 -1.365
314 HG2 PRO 39 1HG PRO 39 -17.434 -2.802 -3.908
315 HG3 PRO 39 2HG PRO 39 -16.512 -1.879 -2.708
316 HD2 PRO 39 1HD PRO 39 -15.970 -4.588 -3.843
317 HD3 PRO 39 2HD PRO 39 -14.835 -3.290 -3.421
318 H SER 40 H SER 40 -17.060 -4.935 1.420
319 HA SER 40 HA SER 40 -19.051 -6.860 1.222
320 HB2 SER 40 1HB SER 40 -17.178 -7.980 -0.163
321 HB3 SER 40 2HB SER 40 -16.340 -8.187 1.374
322 HG SER 40 HG SER 40 -18.904 -9.192 0.668
323 H GLY 41 H GLY 41 -19.122 -8.227 3.247
324 HA2 GLY 41 1HA GLY 41 -18.207 -6.605 5.482
325 HA3 GLY 41 2HA GLY 41 -19.339 -7.946 5.560
326 H SER 42 H SER 42 -16.780 -7.217 7.035
327 HA SER 42 HA SER 42 -14.993 -8.274 7.957
328 HB2 SER 42 1HB SER 42 -16.286 -10.789 6.867
329 HB3 SER 42 2HB SER 42 -15.079 -10.708 8.151
330 HG SER 42 HG SER 42 -17.604 -10.713 8.521
331 H ILE 43 H ILE 43 -13.775 -10.756 6.858
332 HA ILE 43 HA ILE 43 -12.367 -11.523 5.250
333 HB ILE 43 HB ILE 43 -13.455 -9.305 3.507
334 HG12 ILE 43 1HG1 ILE 43 -14.113 -12.261 3.568
335 HG13 ILE 43 2HG1 ILE 43 -15.142 -10.983 4.207
336 HG21 ILE 43 1HG2 ILE 43 -11.787 -11.713 2.780
337 HG22 ILE 43 2HG2 ILE 43 -11.245 -10.035 2.779
338 HG23 ILE 43 3HG2 ILE 43 -12.487 -10.561 1.643
339 HD11 ILE 43 3HD1 ILE 43 -15.376 -10.050 1.969
340 HD12 ILE 43 1HD1 ILE 43 -15.904 -11.731 2.028
341 HD13 ILE 43 2HD1 ILE 43 -14.337 -11.323 1.329
342 H ILE 44 H ILE 44 -12.434 -7.967 5.146
343 HA ILE 44 HA ILE 44 -9.525 -7.889 5.014
344 HB ILE 44 HB ILE 44 -9.773 -5.480 4.760
345 HG12 ILE 44 1HG1 ILE 44 -12.750 -5.946 5.085
346 HG13 ILE 44 2HG1 ILE 44 -11.710 -5.235 6.313
347 HG21 ILE 44 1HG2 ILE 44 -11.002 -5.457 2.643
348 HG22 ILE 44 2HG2 ILE 44 -11.738 -7.004 3.050
349 HG23 ILE 44 3HG2 ILE 44 -9.998 -6.897 2.782
350 HD11 ILE 44 3HD1 ILE 44 -12.920 -3.510 5.166
351 HD12 ILE 44 1HD1 ILE 44 -12.339 -4.089 3.608
352 HD13 ILE 44 2HD1 ILE 44 -11.208 -3.385 4.760
353 H ASP 45 H ASP 45 -8.436 -6.231 6.500
354 HA ASP 45 HA ASP 45 -9.601 -6.434 9.194
355 HB2 ASP 45 1HB ASP 45 -6.720 -6.785 8.361
356 HB3 ASP 45 2HB ASP 45 -7.206 -6.505 10.029
Start of MODEL 20
1 H PHE 1 1H PHE 1 10.809 -10.333 1.205
2 HA PHE 1 HA PHE 1 9.118 -12.018 -0.537
3 HB2 PHE 1 1HB PHE 1 10.563 -13.286 1.017
4 HB3 PHE 1 2HB PHE 1 9.897 -12.375 2.366
5 HD1 PHE 1 HD2 PHE 1 8.973 -14.697 -0.369
6 HD2 PHE 1 HD1 PHE 1 7.948 -13.084 3.434
7 HE1 PHE 1 HE2 PHE 1 7.157 -16.345 -0.161
8 HE2 PHE 1 HE1 PHE 1 6.132 -14.728 3.646
9 HZ PHE 1 HZ PHE 1 5.734 -16.361 1.848
10 H PHE 2 H PHE 2 9.286 -9.447 1.817
11 HA PHE 2 HA PHE 2 6.748 -9.504 2.916
12 HB2 PHE 2 1HB PHE 2 8.490 -7.169 2.150
13 HB3 PHE 2 2HB PHE 2 6.957 -6.965 2.984
14 HD1 PHE 2 HD2 PHE 2 6.720 -8.498 5.150
15 HD2 PHE 2 HD1 PHE 2 10.393 -7.232 3.416
16 HE1 PHE 2 HE2 PHE 2 7.848 -8.819 7.312
17 HE2 PHE 2 HE1 PHE 2 11.527 -7.549 5.576
18 HZ PHE 2 HZ PHE 2 10.254 -8.344 7.527
19 H ASP 3 H ASP 3 7.708 -7.621 0.029
20 HA ASP 3 HA ASP 3 4.902 -7.271 -0.564
21 HB2 ASP 3 1HB ASP 3 5.595 -5.742 -2.310
22 HB3 ASP 3 2HB ASP 3 6.349 -5.330 -0.779
23 H GLU 4 H GLU 4 7.075 -9.609 -1.196
24 HA GLU 4 HA GLU 4 6.195 -10.376 -3.798
25 HB2 GLU 4 1HB GLU 4 8.223 -11.332 -2.634
26 HB3 GLU 4 2HB GLU 4 7.127 -12.202 -1.568
27 HG2 GLU 4 1HG GLU 4 6.161 -13.323 -3.550
28 HG3 GLU 4 2HG GLU 4 7.374 -12.525 -4.549
29 H LYS 5 H LYS 5 5.206 -11.044 -0.482
30 HA LYS 5 HA LYS 5 2.863 -12.492 -1.126
31 HB2 LYS 5 1HB LYS 5 3.815 -12.595 1.110
32 HB3 LYS 5 2HB LYS 5 3.573 -10.869 1.321
33 HG2 LYS 5 1HG LYS 5 1.890 -12.121 2.531
34 HG3 LYS 5 2HG LYS 5 1.149 -11.194 1.225
35 HD2 LYS 5 1HD LYS 5 0.127 -13.315 1.145
36 HD3 LYS 5 2HD LYS 5 1.305 -13.312 -0.166
37 HE2 LYS 5 1HE LYS 5 1.438 -15.416 0.976
38 HE3 LYS 5 2HE LYS 5 2.895 -14.491 1.335
39 HZ1 LYS 5 3HZ LYS 5 0.530 -14.770 3.109
40 HZ2 LYS 5 1HZ LYS 5 1.910 -13.857 3.458
41 HZ3 LYS 5 2HZ LYS 5 2.020 -15.536 3.316
42 H CYS 6 H CYS 6 3.600 -9.060 -0.734
43 HA CYS 6 HA CYS 6 0.999 -8.041 -0.893
44 HB2 CYS 6 1HB CYS 6 3.047 -6.698 -0.380
45 HB3 CYS 6 2HB CYS 6 3.503 -6.815 -2.075
46 HG CYS 6 HG CYS 6 1.494 -5.256 -3.055
47 H ASN 7 H ASN 7 3.322 -8.792 -3.473
48 HA ASN 7 HA ASN 7 1.678 -8.101 -5.650
49 HB2 ASN 7 1HB ASN 7 4.146 -8.532 -5.750
50 HB3 ASN 7 2HB ASN 7 3.806 -10.248 -5.591
51 HD21 ASN 7 1HD2 ASN 7 3.638 -7.474 -7.666
52 HD22 ASN 7 2HD2 ASN 7 3.287 -8.332 -9.123
53 H LYS 8 H LYS 8 2.225 -11.157 -3.983
54 HA LYS 8 HA LYS 8 0.512 -12.811 -5.418
55 HB2 LYS 8 1HB LYS 8 2.041 -13.661 -3.728
56 HB3 LYS 8 2HB LYS 8 1.166 -12.812 -2.465
57 HG2 LYS 8 1HG LYS 8 0.601 -15.134 -2.380
58 HG3 LYS 8 2HG LYS 8 -0.807 -14.228 -2.935
59 HD2 LYS 8 1HD LYS 8 -0.298 -14.849 -5.244
60 HD3 LYS 8 2HD LYS 8 1.118 -15.744 -4.693
61 HE2 LYS 8 1HE LYS 8 -0.356 -17.198 -3.357
62 HE3 LYS 8 2HE LYS 8 -1.754 -16.328 -3.984
63 HZ1 LYS 8 3HZ LYS 8 0.176 -17.948 -5.557
64 HZ2 LYS 8 1HZ LYS 8 -1.066 -17.019 -6.230
65 HZ3 LYS 8 2HZ LYS 8 -1.439 -18.331 -5.232
66 H LEU 9 H LEU 9 -0.208 -10.497 -2.861
67 HA LEU 9 HA LEU 9 -3.019 -11.243 -2.850
68 HB2 LEU 9 1HB LEU 9 -1.478 -9.195 -1.264
69 HB3 LEU 9 2HB LEU 9 -3.187 -9.524 -1.064
70 HG LEU 9 HG LEU 9 -0.957 -11.500 -0.563
71 HD11 LEU 9 1HD1 LEU 9 -1.563 -11.255 1.786
72 HD12 LEU 9 2HD1 LEU 9 -2.741 -10.014 1.358
73 HD13 LEU 9 3HD1 LEU 9 -1.020 -9.723 1.101
74 HD21 LEU 9 3HD2 LEU 9 -3.937 -11.724 -0.152
75 HD22 LEU 9 1HD2 LEU 9 -2.740 -12.890 0.414
76 HD23 LEU 9 2HD2 LEU 9 -2.965 -12.626 -1.315
77 H LYS 10 H LYS 10 -1.177 -9.413 -4.800
78 HA LYS 10 HA LYS 10 -1.683 -8.014 -6.501
79 HB2 LYS 10 1HB LYS 10 -4.488 -8.606 -5.584
80 HB3 LYS 10 2HB LYS 10 -4.171 -7.463 -6.879
81 HG2 LYS 10 1HG LYS 10 -4.697 -9.537 -7.888
82 HG3 LYS 10 2HG LYS 10 -2.960 -9.298 -8.078
83 HD2 LYS 10 1HD LYS 10 -2.490 -10.834 -6.300
84 HD3 LYS 10 2HD LYS 10 -4.204 -10.964 -5.898
85 HE2 LYS 10 1HE LYS 10 -3.417 -12.908 -7.163
86 HE3 LYS 10 2HE LYS 10 -4.650 -12.011 -8.042
87 HZ1 LYS 10 3HZ LYS 10 -1.722 -11.922 -8.525
88 HZ2 LYS 10 1HZ LYS 10 -2.854 -10.946 -9.316
89 HZ3 LYS 10 2HZ LYS 10 -2.890 -12.621 -9.525
90 H GLY 11 H GLY 11 -0.922 -6.992 -3.967
91 HA2 GLY 11 1HA GLY 11 -2.380 -4.428 -3.902
92 HA3 GLY 11 2HA GLY 11 -1.392 -5.061 -2.592
93 H THR 12 H THR 12 -1.250 -2.466 -3.981
94 HA THR 12 HA THR 12 1.398 -2.697 -5.221
95 HB THR 12 HB THR 12 0.894 -0.251 -5.880
96 HG1 THR 12 HG1 THR 12 -1.703 -0.537 -6.143
97 HG21 THR 12 1HG2 THR 12 -0.679 -2.519 -7.099
98 HG22 THR 12 2HG2 THR 12 1.001 -2.120 -7.453
99 HG23 THR 12 3HG2 THR 12 -0.284 -0.993 -7.891
100 H CYS 13 H CYS 13 3.141 -1.804 -4.334
101 HA CYS 13 HA CYS 13 2.942 -0.777 -1.654
102 HB2 CYS 13 1HB CYS 13 5.412 -0.953 -3.389
103 HB3 CYS 13 2HB CYS 13 5.346 -0.818 -1.637
104 HG CYS 13 HG CYS 13 6.144 -3.417 -2.456
105 H LYS 14 H LYS 14 2.757 1.265 -1.104
106 HA LYS 14 HA LYS 14 3.865 3.348 -2.802
107 HB2 LYS 14 1HB LYS 14 1.748 4.644 -2.737
108 HB3 LYS 14 2HB LYS 14 1.628 3.166 -3.676
109 HG2 LYS 14 1HG LYS 14 0.532 2.072 -1.757
110 HG3 LYS 14 2HG LYS 14 0.593 3.604 -0.882
111 HD2 LYS 14 1HD LYS 14 -1.576 3.455 -1.816
112 HD3 LYS 14 2HD LYS 14 -0.686 4.617 -2.801
113 HE2 LYS 14 1HE LYS 14 -1.884 3.219 -4.299
114 HE3 LYS 14 2HE LYS 14 -0.196 2.723 -4.388
115 HZ1 LYS 14 3HZ LYS 14 -1.605 0.797 -4.285
116 HZ2 LYS 14 1HZ LYS 14 -2.362 1.364 -2.875
117 HZ3 LYS 14 2HZ LYS 14 -0.729 0.904 -2.844
118 H ASN 15 H ASN 15 3.537 5.550 -1.634
119 HA ASN 15 HA ASN 15 4.553 5.153 1.029
120 HB2 ASN 15 1HB ASN 15 4.172 7.554 -0.737
121 HB3 ASN 15 2HB ASN 15 4.663 7.720 0.941
122 HD21 ASN 15 1HD2 ASN 15 6.699 7.005 1.566
123 HD22 ASN 15 2HD2 ASN 15 7.945 6.655 0.419
124 H ASN 16 H ASN 16 1.726 6.694 -0.450
125 HA ASN 16 HA ASN 16 0.412 6.549 2.179
126 HB2 ASN 16 1HB ASN 16 -0.959 8.567 1.371
127 HB3 ASN 16 2HB ASN 16 0.684 8.863 1.909
128 HD21 ASN 16 1HD2 ASN 16 -0.263 7.536 -1.236
129 HD22 ASN 16 2HD2 ASN 16 0.314 8.882 -2.159
130 H CYS 17 H CYS 17 -1.637 5.732 2.231
131 HA CYS 17 HA CYS 17 -2.237 3.949 0.093
132 HB2 CYS 17 1HB CYS 17 -3.978 4.620 2.471
133 HB3 CYS 17 2HB CYS 17 -4.031 3.163 1.491
134 HG CYS 17 HG CYS 17 -1.292 2.526 2.299
135 H GLY 18 H GLY 18 -3.872 3.953 -1.367
136 HA2 GLY 18 1HA GLY 18 -4.974 6.574 -1.997
137 HA3 GLY 18 2HA GLY 18 -5.003 5.150 -3.026
138 H LYS 19 H LYS 19 -7.215 5.680 -3.438
139 HA LYS 19 HA LYS 19 -9.204 5.974 -1.537
140 HB2 LYS 19 1HB LYS 19 -10.796 5.609 -3.268
141 HB3 LYS 19 2HB LYS 19 -9.426 6.417 -4.005
142 HG2 LYS 19 1HG LYS 19 -9.921 3.449 -4.150
143 HG3 LYS 19 2HG LYS 19 -10.424 4.605 -5.381
144 HD2 LYS 19 1HD LYS 19 -7.565 4.242 -4.497
145 HD3 LYS 19 2HD LYS 19 -8.281 3.385 -5.860
146 HE2 LYS 19 1HE LYS 19 -8.068 6.383 -5.581
147 HE3 LYS 19 2HE LYS 19 -7.023 5.370 -6.574
148 HZ1 LYS 19 3HZ LYS 19 -8.731 6.385 -7.912
149 HZ2 LYS 19 1HZ LYS 19 -9.949 5.740 -6.930
150 HZ3 LYS 19 2HZ LYS 19 -8.980 4.713 -7.861
151 H ASN 20 H ASN 20 -10.011 4.690 -0.075
152 HA ASN 20 HA ASN 20 -10.671 2.849 1.082
153 HB2 ASN 20 1HB ASN 20 -11.205 1.926 -1.744
154 HB3 ASN 20 2HB ASN 20 -11.724 1.030 -0.321
155 HD21 ASN 20 1HD2 ASN 20 -13.399 1.802 0.909
156 HD22 ASN 20 2HD2 ASN 20 -14.428 3.090 0.391
157 H GLU 21 H GLU 21 -7.933 2.923 0.935
158 HA GLU 21 HA GLU 21 -7.222 0.132 0.343
159 HB2 GLU 21 1HB GLU 21 -5.538 2.627 0.398
160 HB3 GLU 21 2HB GLU 21 -4.825 1.021 0.408
161 HG2 GLU 21 1HG GLU 21 -6.343 0.683 -1.697
162 HG3 GLU 21 2HG GLU 21 -6.297 2.441 -1.754
163 H GLU 22 H GLU 22 -5.692 -0.913 1.717
164 HA GLU 22 HA GLU 22 -5.704 0.043 4.505
165 HB2 GLU 22 1HB GLU 22 -5.949 -2.250 5.262
166 HB3 GLU 22 2HB GLU 22 -7.270 -1.866 4.166
167 HG2 GLU 22 1HG GLU 22 -6.252 -3.096 2.392
168 HG3 GLU 22 2HG GLU 22 -4.773 -3.310 3.322
169 H LEU 23 H LEU 23 -3.886 -0.839 5.794
170 HA LEU 23 HA LEU 23 -1.476 -1.087 4.151
171 HB2 LEU 23 1HB LEU 23 -1.941 0.401 6.371
172 HB3 LEU 23 2HB LEU 23 -1.267 -1.045 7.098
173 HG LEU 23 HG LEU 23 0.791 -0.794 5.850
174 HD11 LEU 23 1HD1 LEU 23 0.934 1.425 4.499
175 HD12 LEU 23 2HD1 LEU 23 -0.814 1.230 4.370
176 HD13 LEU 23 3HD1 LEU 23 0.266 -0.031 3.764
177 HD21 LEU 23 3HD2 LEU 23 0.600 0.491 7.918
178 HD22 LEU 23 1HD2 LEU 23 -0.089 1.843 7.020
179 HD23 LEU 23 2HD2 LEU 23 1.576 1.344 6.721
180 H ILE 24 H ILE 24 -0.627 -3.028 3.781
181 HA ILE 24 HA ILE 24 -1.651 -5.258 5.415
182 HB ILE 24 HB ILE 24 -1.814 -6.619 3.535
183 HG12 ILE 24 1HG1 ILE 24 -0.623 -4.960 1.475
184 HG13 ILE 24 2HG1 ILE 24 0.547 -5.367 2.727
185 HG21 ILE 24 1HG2 ILE 24 -3.099 -5.368 1.943
186 HG22 ILE 24 2HG2 ILE 24 -2.350 -3.861 2.465
187 HG23 ILE 24 3HG2 ILE 24 -3.421 -4.741 3.558
188 HD11 ILE 24 3HD1 ILE 24 0.635 -7.002 0.977
189 HD12 ILE 24 1HD1 ILE 24 -1.098 -7.295 1.119
190 HD13 ILE 24 2HD1 ILE 24 -0.021 -7.735 2.441
191 H ALA 25 H ALA 25 1.222 -3.699 4.291
192 HA ALA 25 HA ALA 25 2.919 -5.322 5.876
193 HB1 ALA 25 3HB ALA 25 2.449 -6.965 4.089
194 HB2 ALA 25 1HB ALA 25 4.152 -6.519 4.182
195 HB3 ALA 25 2HB ALA 25 3.133 -5.843 2.912
196 H LEU 26 H LEU 26 5.193 -4.919 5.458
197 HA LEU 26 HA LEU 26 5.633 -2.166 4.571
198 HB2 LEU 26 1HB LEU 26 7.087 -4.027 6.425
199 HB3 LEU 26 2HB LEU 26 7.813 -2.530 5.861
200 HG LEU 26 HG LEU 26 5.270 -2.757 7.476
201 HD11 LEU 26 1HD1 LEU 26 7.251 -3.337 8.764
202 HD12 LEU 26 2HD1 LEU 26 6.594 -1.784 9.279
203 HD13 LEU 26 3HD1 LEU 26 8.031 -1.840 8.257
204 HD21 LEU 26 3HD2 LEU 26 5.206 -0.821 6.025
205 HD22 LEU 26 1HD2 LEU 26 6.826 -0.350 6.539
206 HD23 LEU 26 2HD2 LEU 26 5.490 -0.311 7.689
207 H CYS 27 H CYS 27 6.747 -1.816 2.759
208 HA CYS 27 HA CYS 27 7.930 -4.127 1.402
209 HB2 CYS 27 1HB CYS 27 6.248 -2.682 0.213
210 HB3 CYS 27 2HB CYS 27 7.378 -1.348 0.343
211 HG CYS 27 HG CYS 27 8.332 -4.218 -1.228
212 H GLN 28 H GLN 28 10.013 -3.860 0.337
213 HA GLN 28 HA GLN 28 11.979 -2.495 1.849
214 HB2 GLN 28 1HB GLN 28 12.257 -3.348 -1.026
215 HB3 GLN 28 2HB GLN 28 13.537 -3.139 0.152
216 HG2 GLN 28 1HG GLN 28 12.728 -5.051 1.408
217 HG3 GLN 28 2HG GLN 28 11.401 -5.254 0.266
218 HE21 GLN 28 1HE2 GLN 28 11.841 -5.995 -1.813
219 HE22 GLN 28 2HE2 GLN 28 13.316 -6.814 -2.196
220 H LYS 29 H LYS 29 13.421 -0.817 0.797
221 HA LYS 29 HA LYS 29 13.690 1.329 0.070
222 HB2 LYS 29 1HB LYS 29 11.195 0.899 -1.573
223 HB3 LYS 29 2HB LYS 29 12.396 2.158 -1.806
224 HG2 LYS 29 1HG LYS 29 14.018 0.571 -2.542
225 HG3 LYS 29 2HG LYS 29 12.976 -0.780 -2.087
226 HD2 LYS 29 1HD LYS 29 12.340 1.270 -4.209
227 HD3 LYS 29 2HD LYS 29 12.968 -0.348 -4.519
228 HE2 LYS 29 1HE LYS 29 10.331 0.317 -3.197
229 HE3 LYS 29 2HE LYS 29 10.548 -0.254 -4.850
230 HZ1 LYS 29 3HZ LYS 29 11.099 -1.751 -2.351
231 HZ2 LYS 29 1HZ LYS 29 11.558 -2.297 -3.887
232 HZ3 LYS 29 2HZ LYS 29 9.922 -2.092 -3.514
233 H SER 30 H SER 30 11.482 0.270 2.048
234 HA SER 30 HA SER 30 10.368 1.207 3.771
235 HB2 SER 30 1HB SER 30 11.160 3.881 2.605
236 HB3 SER 30 2HB SER 30 10.550 3.587 4.235
237 HG SER 30 HG SER 30 12.553 1.948 3.963
238 H LEU 31 H LEU 31 9.241 0.943 0.857
239 HA LEU 31 HA LEU 31 6.974 2.685 0.903
240 HB2 LEU 31 1HB LEU 31 7.699 0.238 -0.697
241 HB3 LEU 31 2HB LEU 31 6.106 0.951 -0.803
242 HG LEU 31 HG LEU 31 7.770 1.598 -2.595
243 HD11 LEU 31 1HD1 LEU 31 6.459 3.788 -0.991
244 HD12 LEU 31 2HD1 LEU 31 5.692 2.804 -2.237
245 HD13 LEU 31 3HD1 LEU 31 6.989 3.918 -2.668
246 HD21 LEU 31 3HD2 LEU 31 9.696 1.968 -1.113
247 HD22 LEU 31 1HD2 LEU 31 8.874 3.368 -0.432
248 HD23 LEU 31 2HD2 LEU 31 9.340 3.359 -2.133
249 H LYS 32 H LYS 32 4.726 1.870 1.018
250 HA LYS 32 HA LYS 32 4.457 -0.290 3.009
251 HB2 LYS 32 1HB LYS 32 3.275 2.393 2.827
252 HB3 LYS 32 2HB LYS 32 2.116 1.117 3.146
253 HG2 LYS 32 1HG LYS 32 2.865 2.087 5.211
254 HG3 LYS 32 2HG LYS 32 3.422 0.416 5.100
255 HD2 LYS 32 1HD LYS 32 5.217 1.766 5.959
256 HD3 LYS 32 2HD LYS 32 5.630 1.303 4.307
257 HE2 LYS 32 1HE LYS 32 4.938 3.473 3.490
258 HE3 LYS 32 2HE LYS 32 4.395 3.936 5.102
259 HZ1 LYS 32 3HZ LYS 32 6.700 3.733 5.863
260 HZ2 LYS 32 1HZ LYS 32 6.534 4.892 4.641
261 HZ3 LYS 32 2HZ LYS 32 7.195 3.375 4.283
262 H CYS 33 H CYS 33 3.167 -1.989 2.494
263 HA CYS 33 HA CYS 33 2.143 -2.140 -0.183
264 HB2 CYS 33 1HB CYS 33 1.897 -4.062 2.134
265 HB3 CYS 33 2HB CYS 33 1.479 -4.412 0.463
266 HG CYS 33 HG CYS 33 4.146 -4.029 -0.451
267 H CYS 34 H CYS 34 0.287 -1.257 -0.734
268 HA CYS 34 HA CYS 34 -1.890 -1.218 1.249
269 HB2 CYS 34 1HB CYS 34 -1.458 0.767 -0.990
270 HB3 CYS 34 2HB CYS 34 -2.642 0.870 0.308
271 HG CYS 34 HG CYS 34 0.734 0.966 0.860
272 H ARG 35 H ARG 35 -3.766 -2.130 0.660
273 HA ARG 35 HA ARG 35 -4.024 -3.032 -2.138
274 HB2 ARG 35 1HB ARG 35 -5.217 -4.251 0.359
275 HB3 ARG 35 2HB ARG 35 -5.447 -4.847 -1.277
276 HG2 ARG 35 1HG ARG 35 -3.101 -5.385 -1.450
277 HG3 ARG 35 2HG ARG 35 -2.802 -4.703 0.151
278 HD2 ARG 35 1HD ARG 35 -2.969 -7.011 0.539
279 HD3 ARG 35 2HD ARG 35 -4.553 -6.373 0.978
280 HE ARG 35 HE ARG 35 -4.364 -7.268 -1.753
281 HH11 ARG 35 1HH1 ARG 35 -5.105 -8.185 1.543
282 HH12 ARG 35 2HH1 ARG 35 -6.083 -9.539 1.075
283 HH21 ARG 35 1HH2 ARG 35 -5.637 -9.039 -2.370
284 HH22 ARG 35 2HH2 ARG 35 -6.390 -10.024 -1.156
285 H THR 36 H THR 36 -5.730 -2.367 -3.275
286 HA THR 36 HA THR 36 -7.586 -0.505 -2.126
287 HB THR 36 HB THR 36 -7.642 -1.717 -4.895
288 HG1 THR 36 HG1 THR 36 -5.839 -0.048 -3.752
289 HG21 THR 36 1HG2 THR 36 -8.821 0.359 -5.482
290 HG22 THR 36 2HG2 THR 36 -8.754 0.871 -3.797
291 HG23 THR 36 3HG2 THR 36 -9.696 -0.549 -4.248
292 H ILE 37 H ILE 37 -9.202 -1.155 -0.928
293 HA ILE 37 HA ILE 37 -10.274 -3.784 -0.952
294 HB ILE 37 HB ILE 37 -11.443 -1.268 0.236
295 HG12 ILE 37 1HG1 ILE 37 -9.166 -1.612 1.024
296 HG13 ILE 37 2HG1 ILE 37 -10.306 -1.971 2.309
297 HG21 ILE 37 1HG2 ILE 37 -12.591 -2.789 1.764
298 HG22 ILE 37 2HG2 ILE 37 -11.906 -4.168 0.905
299 HG23 ILE 37 3HG2 ILE 37 -13.040 -3.094 0.086
300 HD11 ILE 37 3HD1 ILE 37 -8.955 -4.020 0.578
301 HD12 ILE 37 1HD1 ILE 37 -10.015 -4.335 1.947
302 HD13 ILE 37 2HD1 ILE 37 -8.452 -3.565 2.207
303 H GLN 38 H GLN 38 -11.733 -4.610 -2.267
304 HA GLN 38 HA GLN 38 -13.323 -2.799 -3.944
305 HB2 GLN 38 1HB GLN 38 -12.759 -5.747 -4.304
306 HB3 GLN 38 2HB GLN 38 -13.624 -4.715 -5.433
307 HG2 GLN 38 1HG GLN 38 -11.581 -3.387 -5.751
308 HG3 GLN 38 2HG GLN 38 -10.725 -4.484 -4.668
309 HE21 GLN 38 1HE2 GLN 38 -10.275 -6.575 -5.343
310 HE22 GLN 38 2HE2 GLN 38 -10.339 -7.033 -7.011
311 HA PRO 39 HA PRO 39 -16.931 -3.981 -1.546
312 HB2 PRO 39 1HB PRO 39 -18.383 -3.018 -3.935
313 HB3 PRO 39 2HB PRO 39 -18.506 -2.481 -2.257
314 HG2 PRO 39 1HG PRO 39 -17.329 -0.968 -4.125
315 HG3 PRO 39 2HG PRO 39 -16.737 -1.015 -2.455
316 HD2 PRO 39 1HD PRO 39 -15.645 -2.358 -4.893
317 HD3 PRO 39 2HD PRO 39 -14.783 -1.590 -3.545
318 H SER 40 H SER 40 -17.774 -5.964 -1.460
319 HA SER 40 HA SER 40 -18.753 -7.937 -2.069
320 HB2 SER 40 1HB SER 40 -20.033 -6.566 -3.738
321 HB3 SER 40 2HB SER 40 -18.745 -6.887 -4.900
322 HG SER 40 HG SER 40 -20.326 -8.865 -3.606
323 H GLY 41 H GLY 41 -15.835 -6.865 -2.801
324 HA2 GLY 41 1HA GLY 41 -14.761 -8.902 -4.477
325 HA3 GLY 41 2HA GLY 41 -13.842 -7.805 -3.460
326 H SER 42 H SER 42 -12.752 -10.139 -3.523
327 HA SER 42 HA SER 42 -13.904 -12.086 -1.770
328 HB2 SER 42 1HB SER 42 -11.085 -11.918 -2.856
329 HB3 SER 42 2HB SER 42 -11.866 -13.347 -2.181
330 HG SER 42 HG SER 42 -13.509 -12.636 -3.996
331 H ILE 43 H ILE 43 -13.182 -12.730 0.254
332 HA ILE 43 HA ILE 43 -12.186 -12.671 2.292
333 HB ILE 43 HB ILE 43 -10.372 -10.564 1.104
334 HG12 ILE 43 1HG1 ILE 43 -10.121 -12.775 0.071
335 HG13 ILE 43 2HG1 ILE 43 -8.712 -12.382 1.046
336 HG21 ILE 43 1HG2 ILE 43 -10.143 -12.031 3.732
337 HG22 ILE 43 2HG2 ILE 43 -10.531 -10.323 3.526
338 HG23 ILE 43 3HG2 ILE 43 -8.944 -10.928 3.054
339 HD11 ILE 43 3HD1 ILE 43 -9.594 -13.803 2.849
340 HD12 ILE 43 1HD1 ILE 43 -9.318 -14.690 1.352
341 HD13 ILE 43 2HD1 ILE 43 -10.955 -14.232 1.814
342 H ILE 44 H ILE 44 -12.139 -9.287 1.168
343 HA ILE 44 HA ILE 44 -13.713 -8.611 3.551
344 HB ILE 44 HB ILE 44 -11.659 -7.391 3.513
345 HG12 ILE 44 1HG1 ILE 44 -13.769 -5.458 2.545
346 HG13 ILE 44 2HG1 ILE 44 -13.796 -6.193 4.143
347 HG21 ILE 44 1HG2 ILE 44 -11.134 -7.630 1.141
348 HG22 ILE 44 2HG2 ILE 44 -10.952 -5.961 1.680
349 HG23 ILE 44 3HG2 ILE 44 -12.369 -6.432 0.747
350 HD11 ILE 44 3HD1 ILE 44 -12.863 -3.986 4.283
351 HD12 ILE 44 1HD1 ILE 44 -11.672 -4.364 3.039
352 HD13 ILE 44 2HD1 ILE 44 -11.597 -5.170 4.607
353 H ASP 45 H ASP 45 -15.754 -8.884 3.014
354 HA ASP 45 HA ASP 45 -16.777 -8.538 0.378
355 HB2 ASP 45 1HB ASP 45 -18.230 -8.950 3.000
356 HB3 ASP 45 2HB ASP 45 -18.968 -9.052 1.408