Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
23098 | 2jte RC | 15407 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 GLY 1 1HT GLY 1 -14.561 -10.180 2.874
2 H2 GLY 1 2HT GLY 1 -13.986 -11.227 4.054
3 H3 GLY 1 3HT GLY 1 -12.922 -10.153 3.296
4 HA2 GLY 1 1HA GLY 1 -15.180 -9.421 5.059
5 HA3 GLY 1 2HA GLY 1 -13.479 -9.400 5.516
6 H ALA 2 H ALA 2 -12.300 -8.282 3.319
7 HA ALA 2 HA ALA 2 -13.197 -5.544 3.561
8 HB1 ALA 2 1HB ALA 2 -11.102 -5.036 2.335
9 HB2 ALA 2 2HB ALA 2 -10.798 -6.771 2.190
10 HB3 ALA 2 3HB ALA 2 -10.813 -6.009 3.775
11 H MET 3 H MET 3 -13.480 -4.229 1.613
12 HA MET 3 HA MET 3 -14.277 -5.740 -0.738
13 HB2 MET 3 2HB MET 3 -16.309 -5.547 0.553
14 HB3 MET 3 1HB MET 3 -16.037 -3.844 0.835
15 HG2 MET 3 2HG MET 3 -16.397 -3.402 -1.546
16 HG3 MET 3 1HG MET 3 -16.669 -5.125 -1.822
17 HE1 MET 3 3HE MET 3 -18.740 -2.732 -2.610
18 HE2 MET 3 1HE MET 3 -20.258 -3.519 -2.187
19 HE3 MET 3 2HE MET 3 -18.991 -4.436 -3.003
20 H GLY 4 H GLY 4 -12.727 -4.915 -1.997
21 HA2 GLY 4 2HA GLY 4 -11.758 -2.286 -1.950
22 HA3 GLY 4 1HA GLY 4 -11.561 -3.433 -3.269
23 H ALA 5 H ALA 5 -13.324 -0.801 -2.046
24 HA ALA 5 HA ALA 5 -15.092 -0.723 -4.394
25 HB1 ALA 5 1HB ALA 5 -16.362 0.940 -3.101
26 HB2 ALA 5 2HB ALA 5 -15.179 0.823 -1.797
27 HB3 ALA 5 3HB ALA 5 -16.182 -0.569 -2.205
28 H LYS 6 H LYS 6 -12.224 -0.111 -4.255
29 HA LYS 6 HA LYS 6 -10.741 1.224 -5.164
30 HB2 LYS 6 2HB LYS 6 -12.944 3.247 -5.667
31 HB3 LYS 6 1HB LYS 6 -11.291 3.385 -6.255
32 HG2 LYS 6 2HG LYS 6 -11.568 1.462 -7.669
33 HG3 LYS 6 1HG LYS 6 -13.151 1.130 -6.968
34 HD2 LYS 6 2HD LYS 6 -12.407 3.547 -8.621
35 HD3 LYS 6 1HD LYS 6 -13.358 2.171 -9.171
36 HE2 LYS 6 2HE LYS 6 -14.113 4.216 -7.081
37 HE3 LYS 6 1HE LYS 6 -14.861 3.961 -8.647
38 HZ1 LYS 6 3HZ LYS 6 -15.511 1.668 -7.772
39 HZ2 LYS 6 1HZ LYS 6 -16.271 2.979 -7.053
40 HZ3 LYS 6 2HZ LYS 6 -15.052 2.234 -6.240
41 H GLU 7 H GLU 7 -10.036 1.061 -3.145
42 HA GLU 7 HA GLU 7 -10.386 3.345 -1.383
43 HB2 GLU 7 2HB GLU 7 -9.121 0.620 -0.923
44 HB3 GLU 7 1HB GLU 7 -9.245 1.883 0.294
45 HG2 GLU 7 2HG GLU 7 -11.704 1.757 0.148
46 HG3 GLU 7 1HG GLU 7 -11.554 0.472 -1.046
47 H TYR 8 H TYR 8 -8.483 4.404 -0.544
48 HA TYR 8 HA TYR 8 -6.017 3.996 -2.074
49 HD1 TYR 8 2HD TYR 8 -5.699 5.312 -4.731
50 HD2 TYR 8 1HD TYR 8 -9.396 6.376 -2.939
51 HE1 TYR 8 2HE TYR 8 -6.832 5.062 -6.916
52 HE2 TYR 8 1HE TYR 8 -10.528 6.133 -5.103
53 HH TYR 8 HH TYR 8 -9.056 4.617 -7.752
54 HB2 TYR 8 2HB TYR 8 -7.244 6.761 -1.755
55 HB3 TYR 8 1HB TYR 8 -5.752 6.356 -2.546
56 H CYS 9 H CYS 9 -4.183 4.822 -0.992
57 HA CYS 9 HA CYS 9 -4.639 5.671 1.761
58 HG CYS 9 HG CYS 9 -3.235 2.997 -0.725
59 HB2 CYS 9 2HB CYS 9 -2.838 4.009 2.455
60 HB3 CYS 9 1HB CYS 9 -4.420 3.338 2.089
61 H ARG 10 H ARG 10 -2.737 6.596 2.764
62 HA ARG 10 HA ARG 10 -0.718 7.487 0.827
63 HE ARG 10 HE ARG 10 1.740 11.296 3.258
64 HB2 ARG 10 2HB ARG 10 -2.045 9.441 1.495
65 HB3 ARG 10 1HB ARG 10 -1.835 9.026 3.192
66 HG2 ARG 10 2HG ARG 10 0.605 9.340 2.947
67 HG3 ARG 10 1HG ARG 10 0.348 9.837 1.283
68 HD2 ARG 10 2HD ARG 10 -0.847 11.786 1.994
69 HD3 ARG 10 1HD ARG 10 -0.844 11.231 3.671
70 HH11 ARG 10 1HH1 ARG 10 -0.600 13.724 2.202
71 HH12 ARG 10 2HH1 ARG 10 0.482 15.012 2.352
72 HH21 ARG 10 1HH2 ARG 10 3.193 13.024 3.447
73 HH22 ARG 10 2HH2 ARG 10 2.702 14.633 3.097
74 H THR 11 H THR 11 1.338 7.236 1.429
75 HA THR 11 HA THR 11 1.909 5.584 3.656
76 HB THR 11 HB THR 11 4.246 5.901 2.774
77 HG1 THR 11 1HG THR 11 4.481 7.047 0.938
78 HG21 THR 11 3HG2 THR 11 2.792 4.070 2.064
79 HG22 THR 11 1HG2 THR 11 3.785 4.642 0.725
80 HG23 THR 11 2HG2 THR 11 2.085 5.106 0.823
81 H LEU 12 H LEU 12 2.721 6.179 5.583
82 HA LEU 12 HA LEU 12 3.053 9.047 6.162
83 HG LEU 12 HG LEU 12 0.657 7.191 7.053
84 HB2 LEU 12 2HB LEU 12 2.868 6.656 7.996
85 HB3 LEU 12 1HB LEU 12 3.041 8.312 8.525
86 HD11 LEU 12 1HD1 LEU 12 -0.482 7.476 9.214
87 HD12 LEU 12 2HD1 LEU 12 1.046 7.955 9.945
88 HD13 LEU 12 3HD1 LEU 12 0.844 6.320 9.317
89 HD21 LEU 12 3HD2 LEU 12 1.127 9.898 8.305
90 HD22 LEU 12 1HD2 LEU 12 -0.387 9.333 7.605
91 HD23 LEU 12 2HD2 LEU 12 1.020 9.563 6.572
92 H PHE 13 H PHE 13 4.770 6.183 5.630
93 HA PHE 13 HA PHE 13 7.288 7.456 6.308
94 HD1 PHE 13 1HD PHE 13 8.541 7.158 8.960
95 HD2 PHE 13 2HD PHE 13 4.821 5.088 8.826
96 HE1 PHE 13 1HE PHE 13 8.013 7.965 11.220
97 HE2 PHE 13 2HE PHE 13 4.285 5.899 11.085
98 HZ PHE 13 HZ PHE 13 5.883 7.341 12.286
99 HB2 PHE 13 2HB PHE 13 6.479 4.661 7.208
100 HB3 PHE 13 1HB PHE 13 8.102 5.317 7.330
101 HA PRO 14 HA PRO 14 8.183 5.406 2.457
102 HB2 PRO 14 2HB PRO 14 10.871 5.521 2.460
103 HB3 PRO 14 1HB PRO 14 9.900 6.986 2.259
104 HG2 PRO 14 2HG PRO 14 11.247 5.937 4.717
105 HG3 PRO 14 1HG PRO 14 11.196 7.597 4.099
106 HD2 PRO 14 2HD PRO 14 9.571 6.690 6.094
107 HD3 PRO 14 1HD PRO 14 9.104 7.985 4.973
108 H TYR 15 H TYR 15 9.096 3.391 1.726
109 HA TYR 15 HA TYR 15 10.334 1.659 3.659
110 HD1 TYR 15 2HD TYR 15 9.652 -0.380 5.267
111 HD2 TYR 15 1HD TYR 15 7.688 -1.173 1.586
112 HE1 TYR 15 2HE TYR 15 10.117 -2.780 5.543
113 HE2 TYR 15 1HE TYR 15 8.144 -3.572 1.857
114 HH TYR 15 HH TYR 15 9.784 -4.972 3.012
115 HB2 TYR 15 2HB TYR 15 7.984 1.247 4.166
116 HB3 TYR 15 1HB TYR 15 7.629 0.992 2.466
117 H THR 16 H THR 16 11.696 0.352 2.705
118 HA THR 16 HA THR 16 11.811 0.416 -0.182
119 HB THR 16 HB THR 16 13.816 -0.543 1.864
120 HG1 THR 16 1HG THR 16 13.269 1.748 1.751
121 HG21 THR 16 3HG2 THR 16 14.079 -0.066 -1.113
122 HG22 THR 16 1HG2 THR 16 14.090 -1.642 -0.319
123 HG23 THR 16 2HG2 THR 16 15.396 -0.496 -0.021
124 H GLY 17 H GLY 17 11.072 -1.275 -1.317
125 HA2 GLY 17 2HA GLY 17 10.309 -3.674 0.029
126 HA3 GLY 17 1HA GLY 17 10.105 -3.311 -1.685
127 H THR 18 H THR 18 11.465 -5.383 0.206
128 HA THR 18 HA THR 18 14.121 -5.462 -1.000
129 HB THR 18 HB THR 18 14.364 -7.491 0.536
130 HG1 THR 18 1HG THR 18 11.822 -6.515 1.479
131 HG21 THR 18 3HG2 THR 18 13.643 -4.841 1.802
132 HG22 THR 18 1HG2 THR 18 15.230 -5.283 1.176
133 HG23 THR 18 2HG2 THR 18 14.573 -6.120 2.584
134 H ASN 19 H ASN 19 11.119 -7.122 -0.867
135 HA ASN 19 HA ASN 19 11.902 -9.069 -2.854
136 HB2 ASN 19 2HB ASN 19 9.294 -8.554 -1.426
137 HB3 ASN 19 1HB ASN 19 9.498 -9.798 -2.635
138 HD21 ASN 19 1HD2 ASN 19 9.893 -8.916 0.681
139 HD22 ASN 19 2HD2 ASN 19 10.586 -10.398 1.195
140 H GLU 20 H GLU 20 10.421 -9.262 -4.788
141 HA GLU 20 HA GLU 20 10.145 -6.696 -6.053
142 HB2 GLU 20 2HB GLU 20 11.033 -8.659 -7.226
143 HB3 GLU 20 1HB GLU 20 9.520 -9.498 -6.941
144 HG2 GLU 20 2HG GLU 20 8.360 -7.845 -8.303
145 HG3 GLU 20 1HG GLU 20 9.916 -7.084 -8.656
146 H ASP 21 H ASP 21 8.168 -9.244 -4.727
147 HA ASP 21 HA ASP 21 5.625 -8.115 -5.446
148 HB2 ASP 21 2HB ASP 21 6.431 -10.255 -3.474
149 HB3 ASP 21 1HB ASP 21 4.763 -9.756 -3.702
150 H GLU 22 H GLU 22 7.857 -6.934 -3.548
151 HA GLU 22 HA GLU 22 6.064 -6.010 -1.430
152 HB2 GLU 22 2HB GLU 22 7.997 -7.381 -0.801
153 HB3 GLU 22 1HB GLU 22 9.086 -6.206 -1.533
154 HG2 GLU 22 2HG GLU 22 8.421 -4.618 0.165
155 HG3 GLU 22 1HG GLU 22 7.292 -5.800 0.844
156 H LEU 23 H LEU 23 5.705 -3.863 -1.427
157 HA LEU 23 HA LEU 23 6.491 -2.464 -3.846
158 HG LEU 23 HG LEU 23 4.219 -1.588 -4.743
159 HB2 LEU 23 2HB LEU 23 4.153 -2.686 -2.589
160 HB3 LEU 23 1HB LEU 23 4.722 -1.246 -1.784
161 HD11 LEU 23 1HD1 LEU 23 2.196 -1.442 -3.455
162 HD12 LEU 23 2HD1 LEU 23 2.431 0.032 -4.391
163 HD13 LEU 23 3HD1 LEU 23 2.775 0.021 -2.659
164 HD21 LEU 23 3HD2 LEU 23 4.695 0.777 -4.998
165 HD22 LEU 23 1HD2 LEU 23 6.102 -0.048 -4.338
166 HD23 LEU 23 2HD2 LEU 23 5.069 0.920 -3.281
167 H THR 24 H THR 24 8.104 -1.019 -3.909
168 HA THR 24 HA THR 24 9.243 0.101 -1.472
169 HB THR 24 HB THR 24 10.000 0.412 -4.400
170 HG1 THR 24 1HG THR 24 10.971 -1.421 -4.139
171 HG21 THR 24 3HG2 THR 24 10.798 2.317 -3.073
172 HG22 THR 24 1HG2 THR 24 12.148 1.297 -3.562
173 HG23 THR 24 2HG2 THR 24 11.533 1.223 -1.910
174 H PHE 25 H PHE 25 8.458 2.004 -0.725
175 HA PHE 25 HA PHE 25 7.483 3.929 -2.652
176 HD1 PHE 25 1HD PHE 25 6.306 4.272 1.317
177 HD2 PHE 25 2HD PHE 25 4.926 1.007 -1.024
178 HE1 PHE 25 1HE PHE 25 5.766 3.030 3.370
179 HE2 PHE 25 2HE PHE 25 4.394 -0.239 1.012
180 HZ PHE 25 HZ PHE 25 4.808 0.767 3.218
181 HB2 PHE 25 2HB PHE 25 5.535 4.476 -1.133
182 HB3 PHE 25 1HB PHE 25 5.425 2.998 -2.068
183 H ARG 26 H ARG 26 7.245 6.046 -1.927
184 HA ARG 26 HA ARG 26 9.134 6.844 0.165
185 HE ARG 26 HE ARG 26 11.595 7.896 -4.155
186 HB2 ARG 26 2HB ARG 26 7.715 8.423 -2.001
187 HB3 ARG 26 1HB ARG 26 8.932 9.072 -0.915
188 HG2 ARG 26 2HG ARG 26 10.630 7.701 -1.890
189 HG3 ARG 26 1HG ARG 26 9.444 6.828 -2.853
190 HD2 ARG 26 2HD ARG 26 8.887 8.943 -4.000
191 HD3 ARG 26 1HD ARG 26 10.169 9.745 -3.095
192 HH11 ARG 26 1HH1 ARG 26 9.009 9.711 -5.722
193 HH12 ARG 26 2HH1 ARG 26 9.580 9.503 -7.304
194 HH21 ARG 26 1HH2 ARG 26 12.437 7.615 -6.323
195 HH22 ARG 26 2HH2 ARG 26 11.620 8.303 -7.659
196 H GLU 27 H GLU 27 8.165 9.108 1.182
197 HA GLU 27 HA GLU 27 5.597 8.397 2.346
198 HB2 GLU 27 2HB GLU 27 7.549 9.083 3.764
199 HB3 GLU 27 1HB GLU 27 7.530 10.650 2.991
200 HG2 GLU 27 2HG GLU 27 5.204 9.595 4.591
201 HG3 GLU 27 1HG GLU 27 6.531 10.474 5.323
202 H GLY 28 H GLY 28 3.776 9.557 2.000
203 HA2 GLY 28 2HA GLY 28 2.520 11.451 1.321
204 HA3 GLY 28 1HA GLY 28 3.938 12.038 0.457
205 H GLU 29 H GLU 29 3.225 8.762 0.029
206 HA GLU 29 HA GLU 29 2.501 9.335 -2.728
207 HB2 GLU 29 2HB GLU 29 3.338 6.778 -1.371
208 HB3 GLU 29 1HB GLU 29 3.011 6.959 -3.086
209 HG2 GLU 29 2HG GLU 29 5.174 8.403 -1.575
210 HG3 GLU 29 1HG GLU 29 5.401 6.947 -2.534
211 H ILE 30 H ILE 30 0.472 9.116 -3.375
212 HA ILE 30 HA ILE 30 -1.453 7.773 -1.670
213 HB ILE 30 HB ILE 30 -1.864 9.124 -4.373
214 HG12 ILE 30 2HG1 ILE 30 -1.160 10.744 -2.655
215 HG13 ILE 30 1HG1 ILE 30 -2.838 11.000 -3.130
216 HG21 ILE 30 1HG2 ILE 30 -3.584 7.466 -3.939
217 HG22 ILE 30 2HG2 ILE 30 -4.257 9.093 -3.840
218 HG23 ILE 30 3HG2 ILE 30 -3.912 8.193 -2.366
219 HD11 ILE 30 3HD1 ILE 30 -2.541 11.274 -0.739
220 HD12 ILE 30 1HD1 ILE 30 -1.873 9.644 -0.619
221 HD13 ILE 30 2HD1 ILE 30 -3.560 9.876 -1.080
222 H ILE 31 H ILE 31 -1.774 5.741 -1.880
223 HA ILE 31 HA ILE 31 -0.802 4.338 -4.281
224 HB ILE 31 HB ILE 31 -1.211 3.294 -1.453
225 HG12 ILE 31 2HG1 ILE 31 1.332 3.865 -2.987
226 HG13 ILE 31 1HG1 ILE 31 0.726 4.770 -1.609
227 HG21 ILE 31 1HG2 ILE 31 -0.111 1.234 -2.214
228 HG22 ILE 31 2HG2 ILE 31 -0.086 1.863 -3.860
229 HG23 ILE 31 3HG2 ILE 31 -1.627 1.529 -3.067
230 HD11 ILE 31 3HD1 ILE 31 1.639 1.899 -1.575
231 HD12 ILE 31 1HD1 ILE 31 1.034 2.804 -0.188
232 HD13 ILE 31 2HD1 ILE 31 2.544 3.285 -0.969
233 H HIS 32 H HIS 32 -2.147 2.855 -5.282
234 HA HIS 32 HA HIS 32 -4.989 3.220 -4.785
235 HD1 HIS 32 1HD HIS 32 -2.669 2.601 -8.967
236 HD2 HIS 32 2HD HIS 32 -4.815 5.235 -6.567
237 HE1 HIS 32 1HE HIS 32 -2.378 4.882 -9.976
238 HB2 HIS 32 2HB HIS 32 -3.616 1.501 -6.883
239 HB3 HIS 32 1HB HIS 32 -5.287 2.043 -6.886
240 H LEU 33 H LEU 33 -5.790 1.932 -3.248
241 HA LEU 33 HA LEU 33 -4.367 -0.384 -2.386
242 HG LEU 33 HG LEU 33 -5.178 -1.132 -0.001
243 HB2 LEU 33 2HB LEU 33 -5.620 1.204 -0.888
244 HB3 LEU 33 1HB LEU 33 -7.106 0.602 -1.572
245 HD11 LEU 33 1HD1 LEU 33 -7.648 0.323 0.927
246 HD12 LEU 33 2HD1 LEU 33 -5.988 0.713 1.375
247 HD13 LEU 33 3HD1 LEU 33 -6.702 -0.820 1.880
248 HD21 LEU 33 3HD2 LEU 33 -8.124 -1.523 -0.549
249 HD22 LEU 33 1HD2 LEU 33 -7.000 -2.678 0.166
250 HD23 LEU 33 2HD2 LEU 33 -6.850 -2.251 -1.530
251 H ILE 34 H ILE 34 -4.598 -2.350 -3.056
252 HA ILE 34 HA ILE 34 -6.650 -2.934 -5.051
253 HB ILE 34 HB ILE 34 -4.140 -4.468 -4.303
254 HG12 ILE 34 2HG1 ILE 34 -3.536 -2.354 -5.332
255 HG13 ILE 34 1HG1 ILE 34 -3.220 -3.663 -6.461
256 HG21 ILE 34 1HG2 ILE 34 -6.033 -4.890 -6.604
257 HG22 ILE 34 2HG2 ILE 34 -5.779 -5.979 -5.234
258 HG23 ILE 34 3HG2 ILE 34 -4.482 -5.699 -6.406
259 HD11 ILE 34 3HD1 ILE 34 -5.549 -1.753 -6.523
260 HD12 ILE 34 1HD1 ILE 34 -5.318 -3.106 -7.634
261 HD13 ILE 34 2HD1 ILE 34 -4.164 -1.775 -7.612
262 H SER 35 H SER 35 -5.146 -4.348 -2.133
263 HA SER 35 HA SER 35 -7.683 -5.504 -1.400
264 HG SER 35 HG SER 35 -7.427 -6.527 -3.417
265 HB2 SER 35 2HB SER 35 -5.264 -7.242 -1.950
266 HB3 SER 35 1HB SER 35 -6.771 -7.811 -1.241
267 H LYS 36 H LYS 36 -7.881 -5.551 0.785
268 HA LYS 36 HA LYS 36 -5.538 -4.915 2.392
269 HB2 LYS 36 2HB LYS 36 -8.494 -4.979 3.035
270 HB3 LYS 36 1HB LYS 36 -7.272 -4.798 4.289
271 HG2 LYS 36 2HG LYS 36 -6.459 -2.783 3.270
272 HG3 LYS 36 1HG LYS 36 -7.575 -2.937 1.935
273 HD2 LYS 36 2HD LYS 36 -8.313 -2.493 4.821
274 HD3 LYS 36 1HD LYS 36 -8.288 -1.262 3.562
275 HE2 LYS 36 2HE LYS 36 -9.966 -2.676 2.323
276 HE3 LYS 36 1HE LYS 36 -10.101 -3.645 3.790
277 HZ1 LYS 36 3HZ LYS 36 -10.801 -0.817 3.384
278 HZ2 LYS 36 1HZ LYS 36 -10.650 -1.482 4.949
279 HZ3 LYS 36 2HZ LYS 36 -11.790 -2.087 3.863
280 H GLU 37 H GLU 37 -7.623 -7.498 1.595
281 HA GLU 37 HA GLU 37 -6.384 -9.205 3.596
282 HB2 GLU 37 2HB GLU 37 -8.588 -9.749 1.601
283 HB3 GLU 37 1HB GLU 37 -7.951 -10.932 2.734
284 HG2 GLU 37 2HG GLU 37 -8.713 -9.559 4.594
285 HG3 GLU 37 1HG GLU 37 -9.331 -8.368 3.450
286 H THR 38 H THR 38 -4.379 -9.651 2.921
287 HA THR 38 HA THR 38 -3.996 -10.543 0.155
288 HB THR 38 HB THR 38 -1.558 -10.380 0.835
289 HG1 THR 38 1HG THR 38 -2.159 -8.684 2.936
290 HG21 THR 38 3HG2 THR 38 -3.238 -7.875 1.073
291 HG22 THR 38 1HG2 THR 38 -2.676 -8.593 -0.437
292 HG23 THR 38 2HG2 THR 38 -1.514 -7.920 0.711
293 H GLY 39 H GLY 39 -5.054 -11.807 2.804
294 HA2 GLY 39 2HA GLY 39 -5.230 -14.145 3.187
295 HA3 GLY 39 1HA GLY 39 -3.604 -14.343 2.527
296 H GLU 40 H GLU 40 -2.862 -11.850 3.981
297 HA GLU 40 HA GLU 40 -2.531 -13.035 6.616
298 HB2 GLU 40 2HB GLU 40 -0.449 -13.066 5.342
299 HB3 GLU 40 1HB GLU 40 -0.598 -11.343 5.033
300 HG2 GLU 40 2HG GLU 40 1.014 -11.747 6.767
301 HG3 GLU 40 1HG GLU 40 -0.389 -10.910 7.434
302 H ALA 41 H ALA 41 -2.626 -11.648 8.323
303 HA ALA 41 HA ALA 41 -4.083 -9.179 7.838
304 HB1 ALA 41 1HB ALA 41 -4.971 -10.713 9.529
305 HB2 ALA 41 2HB ALA 41 -4.447 -9.201 10.274
306 HB3 ALA 41 3HB ALA 41 -3.443 -10.642 10.404
307 H GLY 42 H GLY 42 -2.829 -7.500 7.451
308 HA2 GLY 42 2HA GLY 42 -1.360 -5.948 8.835
309 HA3 GLY 42 1HA GLY 42 -0.249 -7.313 8.876
310 H TRP 43 H TRP 43 -1.164 -7.969 6.096
311 HA TRP 43 HA TRP 43 0.590 -6.020 4.799
312 HD1 TRP 43 HD TRP 43 1.044 -9.672 6.417
313 HE1 TRP 43 1HE TRP 43 3.486 -9.994 7.121
314 HE3 TRP 43 3HE TRP 43 3.275 -6.875 2.773
315 HZ2 TRP 43 2HZ TRP 43 6.050 -9.154 6.236
316 HZ3 TRP 43 3HZ TRP 43 5.728 -6.681 2.769
317 HH2 TRP 43 HH TRP 43 7.087 -7.794 4.462
318 HB2 TRP 43 2HB TRP 43 -0.018 -8.884 4.037
319 HB3 TRP 43 1HB TRP 43 0.951 -7.781 3.069
320 H TRP 44 H TRP 44 -0.247 -4.749 3.369
321 HA TRP 44 HA TRP 44 -2.888 -5.350 2.236
322 HD1 TRP 44 HD TRP 44 -3.562 -5.076 4.435
323 HE1 TRP 44 1HE TRP 44 -5.238 -3.933 6.008
324 HE3 TRP 44 3HE TRP 44 -3.177 -0.293 2.696
325 HZ2 TRP 44 2HZ TRP 44 -6.247 -1.351 6.474
326 HZ3 TRP 44 3HZ TRP 44 -4.540 1.460 3.765
327 HH2 TRP 44 HH TRP 44 -6.047 0.926 5.610
328 HB2 TRP 44 2HB TRP 44 -1.445 -2.765 2.787
329 HB3 TRP 44 1HB TRP 44 -2.751 -2.848 1.619
330 H LYS 45 H LYS 45 -3.146 -5.054 0.023
331 HA LYS 45 HA LYS 45 -0.611 -4.937 -1.428
332 HB2 LYS 45 2HB LYS 45 -1.891 -7.061 -1.817
333 HB3 LYS 45 1HB LYS 45 -3.253 -6.099 -2.360
334 HG2 LYS 45 2HG LYS 45 -2.013 -5.257 -4.238
335 HG3 LYS 45 1HG LYS 45 -0.552 -6.056 -3.674
336 HD2 LYS 45 2HD LYS 45 -1.585 -8.225 -4.046
337 HD3 LYS 45 1HD LYS 45 -3.083 -7.441 -4.566
338 HE2 LYS 45 2HE LYS 45 -1.918 -6.375 -6.411
339 HE3 LYS 45 1HE LYS 45 -0.393 -7.078 -5.888
340 HZ1 LYS 45 3HZ LYS 45 -1.152 -9.224 -6.475
341 HZ2 LYS 45 1HZ LYS 45 -1.489 -8.202 -7.769
342 HZ3 LYS 45 2HZ LYS 45 -2.731 -8.692 -6.739
343 H GLY 46 H GLY 46 -0.306 -3.316 -2.700
344 HA2 GLY 46 2HA GLY 46 -2.568 -1.675 -3.492
345 HA3 GLY 46 1HA GLY 46 -1.245 -0.918 -2.613
346 H GLU 47 H GLU 47 -2.001 -0.205 -5.143
347 HA GLU 47 HA GLU 47 0.323 -1.084 -6.664
348 HB2 GLU 47 2HB GLU 47 -1.843 -1.801 -7.646
349 HB3 GLU 47 1HB GLU 47 -2.364 -0.139 -7.675
350 HG2 GLU 47 2HG GLU 47 0.090 -0.964 -9.177
351 HG3 GLU 47 1HG GLU 47 -1.508 -1.245 -9.852
352 H LEU 48 H LEU 48 1.741 0.354 -6.950
353 HA LEU 48 HA LEU 48 1.037 3.162 -7.201
354 HG LEU 48 HG LEU 48 3.825 4.298 -6.497
355 HB2 LEU 48 2HB LEU 48 1.696 2.873 -4.851
356 HB3 LEU 48 1HB LEU 48 3.180 2.098 -5.360
357 HD11 LEU 48 1HD1 LEU 48 2.692 6.288 -5.761
358 HD12 LEU 48 2HD1 LEU 48 1.457 5.314 -4.963
359 HD13 LEU 48 3HD1 LEU 48 1.638 5.250 -6.719
360 HD21 LEU 48 3HD2 LEU 48 4.492 5.363 -4.412
361 HD22 LEU 48 1HD2 LEU 48 4.747 3.620 -4.336
362 HD23 LEU 48 2HD2 LEU 48 3.368 4.342 -3.512
363 H ASN 49 H ASN 49 2.097 3.957 -8.861
364 HA ASN 49 HA ASN 49 3.740 4.459 -10.341
365 HB2 ASN 49 2HB ASN 49 5.109 3.835 -8.095
366 HB3 ASN 49 1HB ASN 49 5.707 2.577 -9.161
367 HD21 ASN 49 1HD2 ASN 49 5.439 5.931 -8.594
368 HD22 ASN 49 2HD2 ASN 49 6.723 6.439 -9.609
369 H GLY 50 H GLY 50 2.001 1.873 -10.379
370 HA2 GLY 50 2HA GLY 50 1.633 0.540 -12.269
371 HA3 GLY 50 1HA GLY 50 3.322 0.747 -12.716
372 H LYS 51 H LYS 51 3.227 0.134 -9.465
373 HA LYS 51 HA LYS 51 3.606 -2.722 -9.954
374 HB2 LYS 51 2HB LYS 51 4.997 -1.050 -7.861
375 HB3 LYS 51 1HB LYS 51 5.146 -2.785 -8.038
376 HG2 LYS 51 2HG LYS 51 7.051 -2.020 -8.993
377 HG3 LYS 51 1HG LYS 51 6.017 -2.252 -10.389
378 HD2 LYS 51 2HD LYS 51 5.422 0.152 -10.357
379 HD3 LYS 51 1HD LYS 51 6.532 0.390 -9.008
380 HE2 LYS 51 2HE LYS 51 8.398 -0.307 -10.427
381 HE3 LYS 51 1HE LYS 51 7.283 -0.572 -11.765
382 HZ1 LYS 51 3HZ LYS 51 8.306 1.558 -12.022
383 HZ2 LYS 51 1HZ LYS 51 7.874 2.037 -10.459
384 HZ3 LYS 51 2HZ LYS 51 6.696 1.795 -11.641
385 H GLU 52 H GLU 52 2.390 -3.977 -8.974
386 HA GLU 52 HA GLU 52 0.989 -3.004 -6.606
387 HB2 GLU 52 2HB GLU 52 -0.846 -4.632 -7.075
388 HB3 GLU 52 1HB GLU 52 -0.737 -3.372 -8.276
389 HG2 GLU 52 2HG GLU 52 0.370 -4.920 -9.792
390 HG3 GLU 52 1HG GLU 52 0.274 -6.188 -8.569
391 H GLY 53 H GLY 53 1.672 -3.776 -4.880
392 HA2 GLY 53 2HA GLY 53 2.438 -6.572 -4.718
393 HA3 GLY 53 1HA GLY 53 3.670 -5.371 -4.332
394 H VAL 54 H VAL 54 3.574 -6.461 -2.246
395 HA VAL 54 HA VAL 54 1.280 -5.539 -0.679
396 HB VAL 54 HB VAL 54 1.690 -7.391 0.890
397 HG11 VAL 54 1HG1 VAL 54 0.929 -9.247 -0.514
398 HG12 VAL 54 2HG1 VAL 54 1.370 -8.327 -1.954
399 HG13 VAL 54 3HG1 VAL 54 0.086 -7.744 -0.896
400 HG21 VAL 54 3HG2 VAL 54 3.787 -8.305 -1.086
401 HG22 VAL 54 1HG2 VAL 54 3.227 -9.228 0.310
402 HG23 VAL 54 2HG2 VAL 54 4.091 -7.707 0.544
403 H PHE 55 H PHE 55 1.653 -4.790 1.376
404 HA PHE 55 HA PHE 55 4.340 -4.295 2.260
405 HD1 PHE 55 1HD PHE 55 1.788 -2.393 -0.507
406 HD2 PHE 55 2HD PHE 55 2.179 -0.809 3.427
407 HE1 PHE 55 1HE PHE 55 -0.334 -1.187 -0.780
408 HE2 PHE 55 2HE PHE 55 0.056 0.400 3.156
409 HZ PHE 55 HZ PHE 55 -1.206 0.211 1.051
410 HB2 PHE 55 2HB PHE 55 4.084 -1.847 2.300
411 HB3 PHE 55 1HB PHE 55 3.909 -2.483 0.663
412 HA PRO 56 HA PRO 56 2.080 -4.562 6.139
413 HB2 PRO 56 2HB PRO 56 4.064 -2.701 7.309
414 HB3 PRO 56 1HB PRO 56 3.697 -4.367 7.758
415 HG2 PRO 56 2HG PRO 56 5.988 -3.760 6.515
416 HG3 PRO 56 1HG PRO 56 5.118 -5.259 6.162
417 HD2 PRO 56 2HD PRO 56 5.175 -2.700 4.601
418 HD3 PRO 56 1HD PRO 56 5.286 -4.383 4.030
419 H ASP 57 H ASP 57 0.350 -3.446 6.814
420 HA ASP 57 HA ASP 57 -0.272 -0.928 5.659
421 HB2 ASP 57 2HB ASP 57 -2.415 -1.085 6.674
422 HB3 ASP 57 1HB ASP 57 -1.952 -2.719 6.234
423 H ASN 58 H ASN 58 1.496 -1.597 8.346
424 HA ASN 58 HA ASN 58 0.767 0.516 10.114
425 HB2 ASN 58 2HB ASN 58 3.362 -1.024 9.883
426 HB3 ASN 58 1HB ASN 58 3.013 0.127 11.165
427 HD21 ASN 58 1HD2 ASN 58 3.581 -2.743 11.282
428 HD22 ASN 58 2HD2 ASN 58 2.232 -3.447 12.083
429 H PHE 59 H PHE 59 2.471 0.519 7.176
430 HA PHE 59 HA PHE 59 3.985 2.932 7.801
431 HD1 PHE 59 2HD PHE 59 4.487 -0.704 6.780
432 HD2 PHE 59 1HD PHE 59 6.907 2.768 6.411
433 HE1 PHE 59 2HE PHE 59 6.413 -1.954 7.668
434 HE2 PHE 59 1HE PHE 59 8.832 1.529 7.291
435 HZ PHE 59 HZ PHE 59 8.590 -0.838 7.921
436 HB2 PHE 59 2HB PHE 59 3.862 1.220 5.322
437 HB3 PHE 59 1HB PHE 59 4.779 2.715 5.419
438 H ALA 60 H ALA 60 0.839 2.377 6.934
439 HA ALA 60 HA ALA 60 0.758 4.865 5.405
440 HB1 ALA 60 1HB ALA 60 0.751 3.021 3.793
441 HB2 ALA 60 2HB ALA 60 -0.768 3.917 3.783
442 HB3 ALA 60 3HB ALA 60 -0.677 2.348 4.580
443 H VAL 61 H VAL 61 -1.349 5.770 5.222
444 HA VAL 61 HA VAL 61 -3.269 4.953 7.267
445 HB VAL 61 HB VAL 61 -2.070 7.070 7.955
446 HG11 VAL 61 1HG1 VAL 61 -1.557 8.010 5.798
447 HG12 VAL 61 2HG1 VAL 61 -2.486 9.170 6.749
448 HG13 VAL 61 3HG1 VAL 61 -3.269 8.257 5.461
449 HG21 VAL 61 3HG2 VAL 61 -4.988 7.435 7.286
450 HG22 VAL 61 1HG2 VAL 61 -4.081 8.419 8.436
451 HG23 VAL 61 2HG2 VAL 61 -4.332 6.703 8.750
452 H GLN 62 H GLN 62 -5.438 5.105 6.495
453 HA GLN 62 HA GLN 62 -5.427 5.023 3.624
454 HB2 GLN 62 2HB GLN 62 -6.533 3.279 5.126
455 HB3 GLN 62 1HB GLN 62 -7.822 4.460 5.343
456 HG2 GLN 62 2HG GLN 62 -8.249 4.500 2.992
457 HG3 GLN 62 1HG GLN 62 -6.871 3.452 2.687
458 HE21 GLN 62 1HE2 GLN 62 -9.576 3.102 1.969
459 HE22 GLN 62 2HE2 GLN 62 -10.058 1.599 2.664
460 H ILE 63 H ILE 63 -6.727 6.227 2.277
461 HA ILE 63 HA ILE 63 -7.450 8.876 3.343
462 HB ILE 63 HB ILE 63 -7.003 8.000 0.475
463 HG12 ILE 63 2HG1 ILE 63 -4.952 7.801 1.734
464 HG13 ILE 63 1HG1 ILE 63 -4.842 9.123 0.582
465 HG21 ILE 63 1HG2 ILE 63 -7.261 10.761 1.658
466 HG22 ILE 63 2HG2 ILE 63 -8.428 9.951 0.610
467 HG23 ILE 63 3HG2 ILE 63 -6.847 10.408 -0.019
468 HD11 ILE 63 3HD1 ILE 63 -5.267 10.723 2.424
469 HD12 ILE 63 1HD1 ILE 63 -3.813 9.761 2.698
470 HD13 ILE 63 2HD1 ILE 63 -5.297 9.369 3.557
471 H SER 64 H SER 64 -8.541 6.241 1.255
472 HA SER 64 HA SER 64 -11.279 7.079 1.635
473 HG SER 64 HG SER 64 -12.174 6.260 -1.575
474 HB2 SER 64 2HB SER 64 -10.275 7.884 -0.630
475 HB3 SER 64 1HB SER 64 -10.150 6.175 -1.029
Start of MODEL 2
1 H1 GLY 1 1HT GLY 1 -11.507 -2.335 -4.862
2 H2 GLY 1 2HT GLY 1 -10.007 -3.023 -5.096
3 H3 GLY 1 3HT GLY 1 -10.168 -1.329 -5.117
4 HA2 GLY 1 1HA GLY 1 -9.207 -2.080 -3.036
5 HA3 GLY 1 2HA GLY 1 -10.816 -1.403 -2.777
6 H ALA 2 H ALA 2 -10.737 -2.749 -0.808
7 HA ALA 2 HA ALA 2 -11.543 -5.500 -1.489
8 HB1 ALA 2 1HB ALA 2 -10.034 -4.611 0.964
9 HB2 ALA 2 2HB ALA 2 -9.371 -5.531 -0.387
10 HB3 ALA 2 3HB ALA 2 -10.608 -6.246 0.648
11 H MET 3 H MET 3 -11.904 -2.726 0.650
12 HA MET 3 HA MET 3 -14.470 -3.865 1.504
13 HB2 MET 3 2HB MET 3 -12.713 -1.863 2.954
14 HB3 MET 3 1HB MET 3 -14.294 -2.415 3.493
15 HG2 MET 3 2HG MET 3 -11.866 -4.157 3.149
16 HG3 MET 3 1HG MET 3 -12.476 -3.533 4.683
17 HE1 MET 3 3HE MET 3 -12.485 -6.103 5.606
18 HE2 MET 3 1HE MET 3 -11.879 -6.617 4.028
19 HE3 MET 3 2HE MET 3 -13.284 -7.411 4.739
20 H GLY 4 H GLY 4 -13.252 -1.896 -0.609
21 HA2 GLY 4 2HA GLY 4 -15.654 -0.342 -0.863
22 HA3 GLY 4 1HA GLY 4 -14.202 0.604 -0.535
23 H ALA 5 H ALA 5 -15.559 0.955 -2.857
24 HA ALA 5 HA ALA 5 -14.404 -0.579 -4.981
25 HB1 ALA 5 1HB ALA 5 -16.610 0.434 -5.206
26 HB2 ALA 5 2HB ALA 5 -15.514 1.028 -6.454
27 HB3 ALA 5 3HB ALA 5 -15.899 2.039 -5.062
28 H LYS 6 H LYS 6 -13.584 2.291 -3.263
29 HA LYS 6 HA LYS 6 -11.156 2.452 -4.795
30 HB2 LYS 6 2HB LYS 6 -11.340 4.931 -5.050
31 HB3 LYS 6 1HB LYS 6 -12.513 4.035 -5.994
32 HG2 LYS 6 2HG LYS 6 -14.214 4.516 -4.264
33 HG3 LYS 6 1HG LYS 6 -13.018 5.493 -3.413
34 HD2 LYS 6 2HD LYS 6 -12.801 6.914 -5.410
35 HD3 LYS 6 1HD LYS 6 -14.055 5.953 -6.202
36 HE2 LYS 6 2HE LYS 6 -15.575 6.533 -4.323
37 HE3 LYS 6 1HE LYS 6 -14.336 7.624 -3.719
38 HZ1 LYS 6 3HZ LYS 6 -16.004 8.763 -5.038
39 HZ2 LYS 6 1HZ LYS 6 -15.657 7.804 -6.365
40 HZ3 LYS 6 2HZ LYS 6 -14.495 8.888 -5.786
41 H GLU 7 H GLU 7 -10.006 1.797 -3.135
42 HA GLU 7 HA GLU 7 -10.120 3.433 -0.727
43 HB2 GLU 7 2HB GLU 7 -9.103 0.599 -1.072
44 HB3 GLU 7 1HB GLU 7 -9.013 1.520 0.426
45 HG2 GLU 7 2HG GLU 7 -11.504 1.670 0.397
46 HG3 GLU 7 1HG GLU 7 -11.504 0.596 -0.997
47 H TYR 8 H TYR 8 -8.383 4.523 -0.138
48 HA TYR 8 HA TYR 8 -5.899 4.105 -1.686
49 HD1 TYR 8 2HD TYR 8 -5.920 5.298 -4.244
50 HD2 TYR 8 1HD TYR 8 -9.026 7.167 -2.030
51 HE1 TYR 8 2HE TYR 8 -7.295 5.421 -6.277
52 HE2 TYR 8 1HE TYR 8 -10.407 7.291 -4.047
53 HH TYR 8 HH TYR 8 -9.997 7.363 -6.477
54 HB2 TYR 8 2HB TYR 8 -6.902 6.887 -1.034
55 HB3 TYR 8 1HB TYR 8 -5.534 6.429 -2.007
56 H CYS 9 H CYS 9 -4.108 4.240 -0.492
57 HA CYS 9 HA CYS 9 -4.417 5.276 2.207
58 HG CYS 9 HG CYS 9 -1.561 1.774 1.359
59 HB2 CYS 9 2HB CYS 9 -2.617 3.578 2.825
60 HB3 CYS 9 1HB CYS 9 -4.227 2.950 2.520
61 H ARG 10 H ARG 10 -2.967 6.673 2.891
62 HA ARG 10 HA ARG 10 -1.042 7.593 0.890
63 HE ARG 10 HE ARG 10 -0.756 12.567 0.749
64 HB2 ARG 10 2HB ARG 10 -2.771 9.166 1.887
65 HB3 ARG 10 1HB ARG 10 -1.910 9.004 3.409
66 HG2 ARG 10 2HG ARG 10 0.107 9.902 2.361
67 HG3 ARG 10 1HG ARG 10 -0.762 10.100 0.843
68 HD2 ARG 10 2HD ARG 10 -2.415 11.516 2.169
69 HD3 ARG 10 1HD ARG 10 -1.202 11.503 3.451
70 HH11 ARG 10 1HH1 ARG 10 -0.033 12.679 4.205
71 HH12 ARG 10 2HH1 ARG 10 0.797 14.156 4.136
72 HH21 ARG 10 1HH2 ARG 10 0.363 14.578 0.634
73 HH22 ARG 10 2HH2 ARG 10 1.046 15.277 2.011
74 H THR 11 H THR 11 1.014 7.345 1.247
75 HA THR 11 HA THR 11 2.083 5.700 3.247
76 HB THR 11 HB THR 11 4.239 6.550 2.314
77 HG1 THR 11 1HG THR 11 2.811 8.601 1.930
78 HG21 THR 11 3HG2 THR 11 3.840 5.798 0.005
79 HG22 THR 11 1HG2 THR 11 2.102 5.979 0.243
80 HG23 THR 11 2HG2 THR 11 2.996 4.752 1.148
81 H LEU 12 H LEU 12 2.674 6.207 5.310
82 HA LEU 12 HA LEU 12 2.737 9.036 6.068
83 HG LEU 12 HG LEU 12 0.585 6.927 6.796
84 HB2 LEU 12 2HB LEU 12 2.838 6.525 7.739
85 HB3 LEU 12 1HB LEU 12 2.835 8.147 8.386
86 HD11 LEU 12 1HD1 LEU 12 0.899 7.378 9.772
87 HD12 LEU 12 2HD1 LEU 12 0.871 5.813 8.959
88 HD13 LEU 12 3HD1 LEU 12 -0.572 6.825 8.973
89 HD21 LEU 12 3HD2 LEU 12 0.804 9.504 8.356
90 HD22 LEU 12 1HD2 LEU 12 -0.674 8.872 7.628
91 HD23 LEU 12 2HD2 LEU 12 0.678 9.339 6.603
92 H PHE 13 H PHE 13 4.720 6.392 5.334
93 HA PHE 13 HA PHE 13 7.179 7.770 5.946
94 HD1 PHE 13 2HD PHE 13 8.283 7.815 8.610
95 HD2 PHE 13 1HD PHE 13 4.874 5.268 8.617
96 HE1 PHE 13 2HE PHE 13 7.605 8.722 10.793
97 HE2 PHE 13 1HE PHE 13 4.195 6.171 10.792
98 HZ PHE 13 HZ PHE 13 5.557 7.899 11.885
99 HB2 PHE 13 2HB PHE 13 6.530 4.989 7.010
100 HB3 PHE 13 1HB PHE 13 8.092 5.778 7.130
101 HA PRO 14 HA PRO 14 7.915 5.320 2.305
102 HB2 PRO 14 2HB PRO 14 10.576 5.267 2.138
103 HB3 PRO 14 1HB PRO 14 9.703 6.793 2.004
104 HG2 PRO 14 2HG PRO 14 11.191 5.682 4.345
105 HG3 PRO 14 1HG PRO 14 11.129 7.345 3.747
106 HD2 PRO 14 2HD PRO 14 9.626 6.344 5.845
107 HD3 PRO 14 1HD PRO 14 9.234 7.812 4.932
108 H TYR 15 H TYR 15 8.897 3.254 1.589
109 HA TYR 15 HA TYR 15 9.853 1.458 3.653
110 HD1 TYR 15 1HD TYR 15 8.698 -0.423 5.297
111 HD2 TYR 15 2HD TYR 15 7.358 -1.292 1.358
112 HE1 TYR 15 1HE TYR 15 8.801 -2.826 5.794
113 HE2 TYR 15 2HE TYR 15 7.472 -3.698 1.841
114 HH TYR 15 HH TYR 15 8.457 -5.283 3.371
115 HB2 TYR 15 2HB TYR 15 7.414 1.255 3.846
116 HB3 TYR 15 1HB TYR 15 7.293 0.928 2.128
117 H THR 16 H THR 16 11.321 0.132 2.814
118 HA THR 16 HA THR 16 11.635 0.160 -0.063
119 HB THR 16 HB THR 16 13.550 -0.815 2.072
120 HG1 THR 16 1HG THR 16 12.803 1.563 1.769
121 HG21 THR 16 3HG2 THR 16 15.224 -0.586 0.290
122 HG22 THR 16 1HG2 THR 16 13.962 -0.091 -0.837
123 HG23 THR 16 2HG2 THR 16 13.962 -1.729 -0.183
124 H GLY 17 H GLY 17 10.824 -1.533 -1.139
125 HA2 GLY 17 2HA GLY 17 10.223 -3.985 0.193
126 HA3 GLY 17 1HA GLY 17 10.015 -3.621 -1.526
127 H THR 18 H THR 18 11.525 -5.653 0.332
128 HA THR 18 HA THR 18 14.062 -5.465 -1.097
129 HB THR 18 HB THR 18 14.219 -5.521 1.404
130 HG1 THR 18 1HG THR 18 15.395 -7.457 -0.221
131 HG21 THR 18 3HG2 THR 18 12.272 -6.932 1.881
132 HG22 THR 18 1HG2 THR 18 13.727 -7.603 2.624
133 HG23 THR 18 2HG2 THR 18 13.083 -8.312 1.144
134 H ASN 19 H ASN 19 11.223 -6.581 -1.545
135 HA ASN 19 HA ASN 19 12.073 -8.988 -2.966
136 HB2 ASN 19 2HB ASN 19 9.387 -8.473 -1.640
137 HB3 ASN 19 1HB ASN 19 9.755 -9.858 -2.652
138 HD21 ASN 19 1HD2 ASN 19 10.239 -8.347 0.460
139 HD22 ASN 19 2HD2 ASN 19 10.856 -9.746 1.240
140 H GLU 20 H GLU 20 10.947 -9.211 -4.988
141 HA GLU 20 HA GLU 20 10.713 -6.763 -6.346
142 HB2 GLU 20 2HB GLU 20 9.939 -8.149 -8.284
143 HB3 GLU 20 1HB GLU 20 11.462 -8.660 -7.574
144 HG2 GLU 20 2HG GLU 20 10.357 -10.474 -6.421
145 HG3 GLU 20 1HG GLU 20 8.793 -9.908 -6.994
146 H ASP 21 H ASP 21 8.229 -8.965 -5.144
147 HA ASP 21 HA ASP 21 6.190 -7.152 -6.144
148 HB2 ASP 21 2HB ASP 21 4.585 -8.966 -5.565
149 HB3 ASP 21 1HB ASP 21 5.806 -9.451 -6.731
150 H GLU 22 H GLU 22 7.981 -6.957 -3.689
151 HA GLU 22 HA GLU 22 5.886 -6.346 -1.759
152 HB2 GLU 22 2HB GLU 22 7.802 -7.576 -0.893
153 HB3 GLU 22 1HB GLU 22 8.914 -6.389 -1.562
154 HG2 GLU 22 2HG GLU 22 8.106 -4.747 0.023
155 HG3 GLU 22 1HG GLU 22 6.926 -5.908 0.644
156 H LEU 23 H LEU 23 5.374 -4.227 -1.412
157 HA LEU 23 HA LEU 23 5.972 -2.584 -3.686
158 HG LEU 23 HG LEU 23 3.515 -1.827 -4.293
159 HB2 LEU 23 2HB LEU 23 3.778 -2.883 -2.152
160 HB3 LEU 23 1HB LEU 23 4.443 -1.428 -1.442
161 HD11 LEU 23 1HD1 LEU 23 2.558 -0.025 -2.094
162 HD12 LEU 23 2HD1 LEU 23 1.751 -1.465 -2.713
163 HD13 LEU 23 3HD1 LEU 23 1.948 -0.051 -3.747
164 HD21 LEU 23 3HD2 LEU 23 4.775 0.661 -3.126
165 HD22 LEU 23 1HD2 LEU 23 4.124 0.469 -4.752
166 HD23 LEU 23 2HD2 LEU 23 5.562 -0.428 -4.268
167 H THR 24 H THR 24 7.607 -1.262 -3.828
168 HA THR 24 HA THR 24 8.856 -0.141 -1.442
169 HB THR 24 HB THR 24 9.613 0.057 -4.375
170 HG1 THR 24 1HG THR 24 9.749 -2.035 -3.538
171 HG21 THR 24 3HG2 THR 24 11.193 0.761 -1.885
172 HG22 THR 24 1HG2 THR 24 10.519 1.910 -3.037
173 HG23 THR 24 2HG2 THR 24 11.812 0.818 -3.535
174 H PHE 25 H PHE 25 8.155 1.803 -0.795
175 HA PHE 25 HA PHE 25 7.207 3.638 -2.806
176 HD1 PHE 25 1HD PHE 25 5.917 4.479 1.113
177 HD2 PHE 25 2HD PHE 25 4.763 0.873 -0.814
178 HE1 PHE 25 1HE PHE 25 5.301 3.516 3.287
179 HE2 PHE 25 2HE PHE 25 4.152 -0.095 1.339
180 HZ PHE 25 HZ PHE 25 4.413 1.221 3.405
181 HB2 PHE 25 2HB PHE 25 5.294 4.337 -1.346
182 HB3 PHE 25 1HB PHE 25 5.162 2.755 -2.083
183 H ARG 26 H ARG 26 6.930 5.822 -2.067
184 HA ARG 26 HA ARG 26 9.179 6.592 -0.356
185 HE ARG 26 HE ARG 26 10.790 7.641 -5.445
186 HB2 ARG 26 2HB ARG 26 7.517 8.195 -2.300
187 HB3 ARG 26 1HB ARG 26 9.004 8.716 -1.524
188 HG2 ARG 26 2HG ARG 26 10.293 7.182 -2.790
189 HG3 ARG 26 1HG ARG 26 8.843 6.369 -3.385
190 HD2 ARG 26 2HD ARG 26 8.175 8.504 -4.468
191 HD3 ARG 26 1HD ARG 26 9.745 9.166 -4.007
192 HH11 ARG 26 1HH1 ARG 26 7.271 7.355 -5.625
193 HH12 ARG 26 2HH1 ARG 26 7.216 6.911 -7.257
194 HH21 ARG 26 1HH2 ARG 26 10.754 6.939 -7.684
195 HH22 ARG 26 2HH2 ARG 26 9.271 6.681 -8.483
196 H GLU 27 H GLU 27 8.641 8.750 0.785
197 HA GLU 27 HA GLU 27 6.145 8.417 2.218
198 HB2 GLU 27 2HB GLU 27 8.352 8.765 3.362
199 HB3 GLU 27 1HB GLU 27 8.389 10.369 2.659
200 HG2 GLU 27 2HG GLU 27 6.332 10.936 3.861
201 HG3 GLU 27 1HG GLU 27 6.347 9.338 4.606
202 H GLY 28 H GLY 28 4.483 9.351 1.235
203 HA2 GLY 28 2HA GLY 28 3.436 11.609 1.104
204 HA3 GLY 28 1HA GLY 28 4.853 12.088 0.184
205 H GLU 29 H GLU 29 3.339 8.954 -0.311
206 HA GLU 29 HA GLU 29 2.282 9.996 -2.819
207 HB2 GLU 29 2HB GLU 29 3.549 7.295 -2.340
208 HB3 GLU 29 1HB GLU 29 2.686 7.739 -3.800
209 HG2 GLU 29 2HG GLU 29 4.350 9.602 -4.089
210 HG3 GLU 29 1HG GLU 29 5.270 8.881 -2.772
211 H ILE 30 H ILE 30 0.494 8.829 -3.688
212 HA ILE 30 HA ILE 30 -1.303 7.816 -1.610
213 HB ILE 30 HB ILE 30 -1.883 8.843 -4.407
214 HG12 ILE 30 2HG1 ILE 30 -1.301 10.610 -2.781
215 HG13 ILE 30 1HG1 ILE 30 -2.975 10.720 -3.324
216 HG21 ILE 30 1HG2 ILE 30 -4.266 8.641 -3.848
217 HG22 ILE 30 2HG2 ILE 30 -3.835 7.889 -2.313
218 HG23 ILE 30 3HG2 ILE 30 -3.453 7.072 -3.827
219 HD11 ILE 30 3HD1 ILE 30 -2.768 11.169 -0.936
220 HD12 ILE 30 1HD1 ILE 30 -2.040 9.581 -0.695
221 HD13 ILE 30 2HD1 ILE 30 -3.713 9.712 -1.229
222 H ILE 31 H ILE 31 -1.494 5.711 -1.520
223 HA ILE 31 HA ILE 31 -0.687 4.091 -3.814
224 HB ILE 31 HB ILE 31 -1.384 3.243 -0.977
225 HG12 ILE 31 2HG1 ILE 31 1.325 3.453 -2.280
226 HG13 ILE 31 1HG1 ILE 31 0.704 4.599 -1.093
227 HG21 ILE 31 1HG2 ILE 31 -1.773 1.465 -2.595
228 HG22 ILE 31 2HG2 ILE 31 -0.375 1.086 -1.589
229 HG23 ILE 31 3HG2 ILE 31 -0.142 1.666 -3.238
230 HD11 ILE 31 3HD1 ILE 31 0.642 2.801 0.574
231 HD12 ILE 31 1HD1 ILE 31 2.264 3.026 -0.084
232 HD13 ILE 31 2HD1 ILE 31 1.271 1.674 -0.628
233 H HIS 32 H HIS 32 -2.198 2.989 -4.960
234 HA HIS 32 HA HIS 32 -4.964 3.390 -4.165
235 HD1 HIS 32 1HD HIS 32 -6.332 4.154 -7.792
236 HD2 HIS 32 2HD HIS 32 -6.519 0.576 -5.702
237 HE1 HIS 32 1HE HIS 32 -8.642 3.243 -8.167
238 HB2 HIS 32 2HB HIS 32 -4.196 3.668 -6.586
239 HB3 HIS 32 1HB HIS 32 -3.881 1.938 -6.605
240 H LEU 33 H LEU 33 -5.681 2.015 -2.753
241 HA LEU 33 HA LEU 33 -4.301 -0.381 -2.140
242 HG LEU 33 HG LEU 33 -5.164 -1.374 0.152
243 HB2 LEU 33 2HB LEU 33 -5.426 1.083 -0.476
244 HB3 LEU 33 1HB LEU 33 -6.968 0.671 -1.176
245 HD11 LEU 33 1HD1 LEU 33 -5.735 0.420 1.712
246 HD12 LEU 33 2HD1 LEU 33 -6.550 -1.085 2.119
247 HD13 LEU 33 3HD1 LEU 33 -7.443 0.212 1.325
248 HD21 LEU 33 3HD2 LEU 33 -6.987 -2.170 -1.379
249 HD22 LEU 33 1HD2 LEU 33 -8.156 -1.405 -0.314
250 HD23 LEU 33 2HD2 LEU 33 -7.136 -2.738 0.268
251 H ILE 34 H ILE 34 -4.514 -2.165 -3.143
252 HA ILE 34 HA ILE 34 -6.747 -2.546 -4.965
253 HB ILE 34 HB ILE 34 -4.208 -4.161 -4.624
254 HG12 ILE 34 2HG1 ILE 34 -3.716 -1.917 -5.469
255 HG13 ILE 34 1HG1 ILE 34 -3.462 -3.119 -6.727
256 HG21 ILE 34 1HG2 ILE 34 -6.308 -4.293 -6.780
257 HG22 ILE 34 2HG2 ILE 34 -6.012 -5.501 -5.531
258 HG23 ILE 34 3HG2 ILE 34 -4.788 -5.190 -6.765
259 HD11 ILE 34 3HD1 ILE 34 -5.848 -1.298 -6.465
260 HD12 ILE 34 1HD1 ILE 34 -5.610 -2.506 -7.726
261 HD13 ILE 34 2HD1 ILE 34 -4.522 -1.123 -7.612
262 H SER 35 H SER 35 -5.160 -4.046 -2.159
263 HA SER 35 HA SER 35 -7.654 -5.318 -1.547
264 HG SER 35 HG SER 35 -7.611 -8.232 -1.868
265 HB2 SER 35 2HB SER 35 -6.589 -6.927 -3.104
266 HB3 SER 35 1HB SER 35 -5.207 -7.023 -2.020
267 H LYS 36 H LYS 36 -7.838 -5.874 0.552
268 HA LYS 36 HA LYS 36 -5.672 -5.156 2.390
269 HB2 LYS 36 2HB LYS 36 -8.672 -5.340 2.692
270 HB3 LYS 36 1HB LYS 36 -7.618 -5.376 4.095
271 HG2 LYS 36 2HG LYS 36 -6.827 -3.183 3.658
272 HG3 LYS 36 1HG LYS 36 -7.622 -3.108 2.096
273 HD2 LYS 36 2HD LYS 36 -9.796 -3.124 3.162
274 HD3 LYS 36 1HD LYS 36 -9.050 -3.391 4.738
275 HE2 LYS 36 2HE LYS 36 -7.988 -1.223 4.659
276 HE3 LYS 36 1HE LYS 36 -8.533 -0.991 3.003
277 HZ1 LYS 36 3HZ LYS 36 -10.452 -1.262 5.270
278 HZ2 LYS 36 1HZ LYS 36 -10.729 -0.713 3.692
279 HZ3 LYS 36 2HZ LYS 36 -9.815 0.199 4.778
280 H GLU 37 H GLU 37 -6.875 -7.759 0.786
281 HA GLU 37 HA GLU 37 -6.436 -9.577 3.019
282 HB2 GLU 37 2HB GLU 37 -8.284 -9.795 0.673
283 HB3 GLU 37 1HB GLU 37 -7.838 -11.181 1.658
284 HG2 GLU 37 2HG GLU 37 -9.172 -8.683 2.653
285 HG3 GLU 37 1HG GLU 37 -9.975 -10.225 2.305
286 H THR 38 H THR 38 -4.452 -10.168 2.819
287 HA THR 38 HA THR 38 -3.498 -11.237 0.236
288 HB THR 38 HB THR 38 -1.233 -10.823 1.288
289 HG1 THR 38 1HG THR 38 -2.221 -8.882 2.963
290 HG21 THR 38 3HG2 THR 38 -2.155 -9.302 -0.428
291 HG22 THR 38 1HG2 THR 38 -1.240 -8.405 0.785
292 HG23 THR 38 2HG2 THR 38 -3.005 -8.404 0.829
293 H GLY 39 H GLY 39 -4.896 -12.188 2.891
294 HA2 GLY 39 2HA GLY 39 -5.059 -14.437 3.588
295 HA3 GLY 39 1HA GLY 39 -3.399 -14.693 3.055
296 H GLU 40 H GLU 40 -2.759 -12.048 4.366
297 HA GLU 40 HA GLU 40 -2.633 -13.014 7.126
298 HB2 GLU 40 2HB GLU 40 -0.467 -11.647 5.539
299 HB3 GLU 40 1HB GLU 40 -0.371 -12.050 7.250
300 HG2 GLU 40 2HG GLU 40 -0.515 -14.420 6.699
301 HG3 GLU 40 1HG GLU 40 -0.636 -14.018 4.987
302 H ALA 41 H ALA 41 -2.884 -11.486 8.660
303 HA ALA 41 HA ALA 41 -4.101 -9.019 7.865
304 HB1 ALA 41 1HB ALA 41 -4.441 -8.675 10.266
305 HB2 ALA 41 2HB ALA 41 -3.447 -10.095 10.610
306 HB3 ALA 41 3HB ALA 41 -4.984 -10.277 9.768
307 H GLY 42 H GLY 42 -3.100 -7.151 7.650
308 HA2 GLY 42 2HA GLY 42 -1.552 -5.531 8.587
309 HA3 GLY 42 1HA GLY 42 -0.434 -6.866 8.876
310 H TRP 43 H TRP 43 -1.340 -7.938 6.190
311 HA TRP 43 HA TRP 43 0.501 -6.269 4.673
312 HD1 TRP 43 HD TRP 43 0.879 -10.138 6.310
313 HE1 TRP 43 1HE TRP 43 3.353 -10.289 6.970
314 HE3 TRP 43 3HE TRP 43 2.780 -6.822 2.950
315 HZ2 TRP 43 2HZ TRP 43 5.809 -9.109 6.175
316 HZ3 TRP 43 3HZ TRP 43 5.194 -6.375 2.961
317 HH2 TRP 43 HH TRP 43 6.669 -7.485 4.529
318 HB2 TRP 43 2HB TRP 43 -0.368 -9.122 4.246
319 HB3 TRP 43 1HB TRP 43 0.589 -8.213 3.088
320 H TRP 44 H TRP 44 -0.341 -4.908 3.396
321 HA TRP 44 HA TRP 44 -2.925 -5.497 2.160
322 HD1 TRP 44 HD TRP 44 -3.709 -5.395 4.279
323 HE1 TRP 44 1HE TRP 44 -5.366 -4.388 5.951
324 HE3 TRP 44 3HE TRP 44 -3.216 -0.476 3.006
325 HZ2 TRP 44 2HZ TRP 44 -6.339 -1.835 6.634
326 HZ3 TRP 44 3HZ TRP 44 -4.554 1.190 4.222
327 HH2 TRP 44 HH TRP 44 -6.085 0.518 5.996
328 HB2 TRP 44 2HB TRP 44 -1.563 -2.902 2.829
329 HB3 TRP 44 1HB TRP 44 -2.875 -2.993 1.661
330 H LYS 45 H LYS 45 -3.170 -4.906 -0.003
331 HA LYS 45 HA LYS 45 -0.667 -4.957 -1.535
332 HB2 LYS 45 2HB LYS 45 -1.905 -6.984 -1.974
333 HB3 LYS 45 1HB LYS 45 -3.411 -6.089 -2.119
334 HG2 LYS 45 2HG LYS 45 -2.388 -4.965 -4.159
335 HG3 LYS 45 1HG LYS 45 -1.115 -6.174 -4.054
336 HD2 LYS 45 2HD LYS 45 -3.998 -7.003 -4.112
337 HD3 LYS 45 1HD LYS 45 -3.142 -6.620 -5.598
338 HE2 LYS 45 2HE LYS 45 -2.176 -8.652 -3.594
339 HE3 LYS 45 1HE LYS 45 -3.201 -9.048 -4.977
340 HZ1 LYS 45 3HZ LYS 45 -1.491 -8.050 -6.408
341 HZ2 LYS 45 1HZ LYS 45 -0.953 -9.424 -5.592
342 HZ3 LYS 45 2HZ LYS 45 -0.474 -7.892 -5.070
343 H GLY 46 H GLY 46 -0.373 -3.262 -2.795
344 HA2 GLY 46 2HA GLY 46 -2.651 -1.638 -3.565
345 HA3 GLY 46 1HA GLY 46 -1.362 -0.863 -2.647
346 H GLU 47 H GLU 47 -2.101 -0.167 -5.233
347 HA GLU 47 HA GLU 47 0.305 -1.011 -6.660
348 HB2 GLU 47 2HB GLU 47 -1.854 -1.644 -7.772
349 HB3 GLU 47 1HB GLU 47 -2.277 0.052 -7.840
350 HG2 GLU 47 2HG GLU 47 0.214 -0.973 -9.163
351 HG3 GLU 47 1HG GLU 47 -1.349 -1.111 -9.954
352 H LEU 48 H LEU 48 1.773 0.388 -6.885
353 HA LEU 48 HA LEU 48 1.137 3.177 -7.047
354 HG LEU 48 HG LEU 48 3.710 4.281 -5.925
355 HB2 LEU 48 2HB LEU 48 1.447 2.789 -4.638
356 HB3 LEU 48 1HB LEU 48 3.022 2.092 -4.952
357 HD11 LEU 48 1HD1 LEU 48 1.141 5.234 -4.728
358 HD12 LEU 48 2HD1 LEU 48 1.579 5.201 -6.440
359 HD13 LEU 48 3HD1 LEU 48 2.449 6.252 -5.324
360 HD21 LEU 48 3HD2 LEU 48 2.883 4.299 -3.031
361 HD22 LEU 48 1HD2 LEU 48 4.068 5.358 -3.787
362 HD23 LEU 48 2HD2 LEU 48 4.369 3.625 -3.705
363 H ASN 49 H ASN 49 2.380 4.070 -8.498
364 HA ASN 49 HA ASN 49 3.931 4.517 -9.998
365 HB2 ASN 49 2HB ASN 49 5.777 2.996 -8.140
366 HB3 ASN 49 1HB ASN 49 6.339 3.840 -9.578
367 HD21 ASN 49 1HD2 ASN 49 5.399 4.146 -6.319
368 HD22 ASN 49 2HD2 ASN 49 5.535 5.854 -6.161
369 H GLY 50 H GLY 50 2.382 1.882 -10.057
370 HA2 GLY 50 2HA GLY 50 2.108 1.083 -12.329
371 HA3 GLY 50 1HA GLY 50 3.855 0.971 -12.425
372 H LYS 51 H LYS 51 3.611 -0.051 -9.498
373 HA LYS 51 HA LYS 51 3.114 -2.801 -10.380
374 HB2 LYS 51 2HB LYS 51 5.122 -1.911 -8.328
375 HB3 LYS 51 1HB LYS 51 4.851 -3.568 -8.842
376 HG2 LYS 51 2HG LYS 51 6.766 -3.041 -10.027
377 HG3 LYS 51 1HG LYS 51 5.529 -2.609 -11.202
378 HD2 LYS 51 2HD LYS 51 7.114 -0.794 -11.168
379 HD3 LYS 51 1HD LYS 51 5.666 -0.258 -10.345
380 HE2 LYS 51 2HE LYS 51 7.708 0.413 -9.141
381 HE3 LYS 51 1HE LYS 51 6.672 -0.615 -8.160
382 HZ1 LYS 51 3HZ LYS 51 8.990 -1.297 -7.943
383 HZ2 LYS 51 1HZ LYS 51 9.139 -1.483 -9.607
384 HZ3 LYS 51 2HZ LYS 51 8.143 -2.500 -8.735
385 H GLU 52 H GLU 52 2.056 -4.157 -8.998
386 HA GLU 52 HA GLU 52 0.946 -2.871 -6.649
387 HB2 GLU 52 2HB GLU 52 -0.808 -4.617 -6.652
388 HB3 GLU 52 1HB GLU 52 -0.807 -3.684 -8.135
389 HG2 GLU 52 2HG GLU 52 0.208 -5.500 -9.334
390 HG3 GLU 52 1HG GLU 52 0.430 -6.410 -7.840
391 H GLY 53 H GLY 53 1.764 -3.340 -4.858
392 HA2 GLY 53 2HA GLY 53 3.144 -5.917 -4.608
393 HA3 GLY 53 1HA GLY 53 3.857 -4.424 -4.015
394 H VAL 54 H VAL 54 3.757 -6.096 -2.199
395 HA VAL 54 HA VAL 54 1.340 -5.503 -0.664
396 HB VAL 54 HB VAL 54 1.885 -7.481 0.744
397 HG11 VAL 54 1HG1 VAL 54 0.318 -7.759 -1.086
398 HG12 VAL 54 2HG1 VAL 54 1.278 -9.224 -0.868
399 HG13 VAL 54 3HG1 VAL 54 1.649 -8.115 -2.188
400 HG21 VAL 54 3HG2 VAL 54 3.562 -9.115 -0.005
401 HG22 VAL 54 1HG2 VAL 54 4.309 -7.564 0.382
402 HG23 VAL 54 2HG2 VAL 54 4.049 -8.024 -1.302
403 H PHE 55 H PHE 55 1.613 -4.825 1.439
404 HA PHE 55 HA PHE 55 4.260 -4.160 2.335
405 HD1 PHE 55 1HD PHE 55 1.582 -2.487 -0.401
406 HD2 PHE 55 2HD PHE 55 1.896 -0.793 3.491
407 HE1 PHE 55 1HE PHE 55 -0.622 -1.442 -0.682
408 HE2 PHE 55 2HE PHE 55 -0.312 0.252 3.216
409 HZ PHE 55 HZ PHE 55 -1.574 -0.076 1.125
410 HB2 PHE 55 2HB PHE 55 3.845 -1.741 2.391
411 HB3 PHE 55 1HB PHE 55 3.714 -2.388 0.748
412 HA PRO 56 HA PRO 56 2.034 -4.432 6.220
413 HB2 PRO 56 2HB PRO 56 3.969 -2.541 7.388
414 HB3 PRO 56 1HB PRO 56 3.692 -4.238 7.783
415 HG2 PRO 56 2HG PRO 56 5.928 -3.459 6.508
416 HG3 PRO 56 1HG PRO 56 5.134 -5.002 6.146
417 HD2 PRO 56 2HD PRO 56 4.973 -2.403 4.657
418 HD3 PRO 56 1HD PRO 56 5.217 -4.055 4.040
419 H ASP 57 H ASP 57 0.344 -3.395 6.857
420 HA ASP 57 HA ASP 57 -0.540 -0.995 5.718
421 HB2 ASP 57 2HB ASP 57 -2.527 -1.239 7.012
422 HB3 ASP 57 1HB ASP 57 -2.002 -2.842 6.529
423 H ASN 58 H ASN 58 1.355 -1.441 8.557
424 HA ASN 58 HA ASN 58 0.410 0.887 9.932
425 HB2 ASN 58 2HB ASN 58 2.198 0.545 11.549
426 HB3 ASN 58 1HB ASN 58 1.399 -0.980 11.196
427 HD21 ASN 58 1HD2 ASN 58 4.064 -0.365 12.266
428 HD22 ASN 58 2HD2 ASN 58 5.178 -1.184 11.233
429 H PHE 59 H PHE 59 2.131 0.756 7.195
430 HA PHE 59 HA PHE 59 3.665 3.161 7.856
431 HD1 PHE 59 1HD PHE 59 6.335 3.075 7.615
432 HD2 PHE 59 2HD PHE 59 4.707 -0.666 6.438
433 HE1 PHE 59 1HE PHE 59 8.118 1.927 8.836
434 HE2 PHE 59 2HE PHE 59 6.490 -1.827 7.676
435 HZ PHE 59 HZ PHE 59 8.197 -0.531 8.877
436 HB2 PHE 59 2HB PHE 59 3.880 1.293 5.500
437 HB3 PHE 59 1HB PHE 59 4.771 2.806 5.627
438 H ALA 60 H ALA 60 0.640 2.483 6.768
439 HA ALA 60 HA ALA 60 0.582 4.956 5.242
440 HB1 ALA 60 1HB ALA 60 -0.685 3.988 3.433
441 HB2 ALA 60 2HB ALA 60 -0.636 2.403 4.204
442 HB3 ALA 60 3HB ALA 60 0.852 3.135 3.603
443 H VAL 61 H VAL 61 -1.372 6.014 5.268
444 HA VAL 61 HA VAL 61 -3.325 4.944 7.178
445 HB VAL 61 HB VAL 61 -2.291 7.102 7.881
446 HG11 VAL 61 1HG1 VAL 61 -1.808 8.099 5.738
447 HG12 VAL 61 2HG1 VAL 61 -2.801 9.196 6.704
448 HG13 VAL 61 3HG1 VAL 61 -3.530 8.266 5.397
449 HG21 VAL 61 3HG2 VAL 61 -4.537 6.607 8.638
450 HG22 VAL 61 1HG2 VAL 61 -5.204 7.327 7.172
451 HG23 VAL 61 2HG2 VAL 61 -4.362 8.340 8.345
452 H GLN 62 H GLN 62 -5.361 4.588 6.470
453 HA GLN 62 HA GLN 62 -5.774 4.889 3.663
454 HB2 GLN 62 2HB GLN 62 -6.591 2.845 4.650
455 HB3 GLN 62 1HB GLN 62 -7.567 3.755 5.802
456 HG2 GLN 62 2HG GLN 62 -8.993 4.557 4.075
457 HG3 GLN 62 1HG GLN 62 -7.952 3.882 2.831
458 HE21 GLN 62 1HE2 GLN 62 -9.758 2.871 2.056
459 HE22 GLN 62 2HE2 GLN 62 -10.357 1.387 2.686
460 H ILE 63 H ILE 63 -6.770 6.360 2.672
461 HA ILE 63 HA ILE 63 -7.799 8.670 4.131
462 HB ILE 63 HB ILE 63 -7.377 8.268 1.157
463 HG12 ILE 63 2HG1 ILE 63 -5.240 8.045 2.318
464 HG13 ILE 63 1HG1 ILE 63 -5.283 9.539 1.397
465 HG21 ILE 63 1HG2 ILE 63 -8.932 10.040 1.632
466 HG22 ILE 63 2HG2 ILE 63 -7.412 10.725 1.045
467 HG23 ILE 63 3HG2 ILE 63 -7.796 10.778 2.765
468 HD11 ILE 63 3HD1 ILE 63 -4.225 9.884 3.553
469 HD12 ILE 63 1HD1 ILE 63 -5.660 9.275 4.379
470 HD13 ILE 63 2HD1 ILE 63 -5.743 10.779 3.466
471 H SER 64 H SER 64 -8.713 6.521 1.449
472 HA SER 64 HA SER 64 -11.513 7.009 2.037
473 HG SER 64 HG SER 64 -10.461 8.694 0.725
474 HB2 SER 64 2HB SER 64 -10.226 6.404 -0.628
475 HB3 SER 64 1HB SER 64 -11.926 6.765 -0.336
Start of MODEL 3
1 H1 GLY 1 1HT GLY 1 -10.699 -1.892 -3.179
2 H2 GLY 1 2HT GLY 1 -10.723 -1.815 -1.441
3 H3 GLY 1 3HT GLY 1 -12.022 -1.287 -2.330
4 HA2 GLY 1 1HA GLY 1 -12.629 -3.421 -3.016
5 HA3 GLY 1 2HA GLY 1 -11.128 -4.074 -2.350
6 H ALA 2 H ALA 2 -12.390 -5.414 -1.028
7 HA ALA 2 HA ALA 2 -13.353 -6.086 0.874
8 HB1 ALA 2 1HB ALA 2 -12.237 -5.360 2.867
9 HB2 ALA 2 2HB ALA 2 -11.675 -3.897 2.059
10 HB3 ALA 2 3HB ALA 2 -11.080 -5.474 1.542
11 H MET 3 H MET 3 -13.240 -2.671 1.741
12 HA MET 3 HA MET 3 -15.811 -2.977 3.032
13 HB2 MET 3 2HB MET 3 -13.819 -0.716 3.098
14 HB3 MET 3 1HB MET 3 -15.321 -0.752 4.018
15 HG2 MET 3 2HG MET 3 -14.547 -2.604 5.310
16 HG3 MET 3 1HG MET 3 -13.135 -2.800 4.274
17 HE1 MET 3 3HE MET 3 -14.670 0.596 5.627
18 HE2 MET 3 1HE MET 3 -13.756 0.794 7.122
19 HE3 MET 3 2HE MET 3 -14.914 -0.530 6.960
20 H GLY 4 H GLY 4 -14.807 -2.107 0.100
21 HA2 GLY 4 2HA GLY 4 -17.297 -1.396 -0.860
22 HA3 GLY 4 1HA GLY 4 -16.557 0.122 -0.400
23 H ALA 5 H ALA 5 -15.545 1.169 -1.986
24 HA ALA 5 HA ALA 5 -15.107 -0.211 -4.496
25 HB1 ALA 5 1HB ALA 5 -16.573 1.753 -4.467
26 HB2 ALA 5 2HB ALA 5 -15.134 2.064 -5.428
27 HB3 ALA 5 3HB ALA 5 -15.265 2.728 -3.800
28 H LYS 6 H LYS 6 -13.369 1.880 -5.378
29 HA LYS 6 HA LYS 6 -10.819 0.814 -4.733
30 HB2 LYS 6 2HB LYS 6 -11.490 3.467 -6.018
31 HB3 LYS 6 1HB LYS 6 -9.896 2.732 -5.975
32 HG2 LYS 6 2HG LYS 6 -12.321 1.610 -7.375
33 HG3 LYS 6 1HG LYS 6 -10.953 2.424 -8.130
34 HD2 LYS 6 2HD LYS 6 -9.452 0.653 -7.314
35 HD3 LYS 6 1HD LYS 6 -10.834 -0.170 -6.590
36 HE2 LYS 6 2HE LYS 6 -10.274 -1.198 -8.712
37 HE3 LYS 6 1HE LYS 6 -11.845 -0.413 -8.810
38 HZ1 LYS 6 3HZ LYS 6 -9.307 0.754 -9.789
39 HZ2 LYS 6 1HZ LYS 6 -10.852 1.423 -9.982
40 HZ3 LYS 6 2HZ LYS 6 -10.438 -0.020 -10.753
41 H GLU 7 H GLU 7 -9.521 1.196 -3.136
42 HA GLU 7 HA GLU 7 -10.242 3.332 -1.290
43 HB2 GLU 7 2HB GLU 7 -8.821 0.700 -0.850
44 HB3 GLU 7 1HB GLU 7 -9.103 1.894 0.413
45 HG2 GLU 7 2HG GLU 7 -11.464 1.629 0.196
46 HG3 GLU 7 1HG GLU 7 -11.269 0.584 -1.203
47 H TYR 8 H TYR 8 -8.589 4.660 -0.457
48 HA TYR 8 HA TYR 8 -6.059 4.535 -1.943
49 HD1 TYR 8 1HD TYR 8 -9.709 6.353 -2.015
50 HD2 TYR 8 2HD TYR 8 -6.285 6.558 -4.527
51 HE1 TYR 8 1HE TYR 8 -11.167 6.317 -3.983
52 HE2 TYR 8 2HE TYR 8 -7.751 6.531 -6.513
53 HH TYR 8 HH TYR 8 -11.194 6.873 -6.205
54 HB2 TYR 8 2HB TYR 8 -7.435 7.107 -1.143
55 HB3 TYR 8 1HB TYR 8 -6.052 6.903 -2.183
56 H CYS 9 H CYS 9 -4.331 4.792 -0.708
57 HA CYS 9 HA CYS 9 -4.716 5.627 2.093
58 HG CYS 9 HG CYS 9 -5.778 2.808 2.424
59 HB2 CYS 9 2HB CYS 9 -2.675 3.610 1.158
60 HB3 CYS 9 1HB CYS 9 -3.173 3.971 2.803
61 H ARG 10 H ARG 10 -2.638 6.500 2.988
62 HA ARG 10 HA ARG 10 -0.809 7.477 0.900
63 HE ARG 10 HE ARG 10 -1.344 11.302 4.422
64 HB2 ARG 10 2HB ARG 10 -2.333 9.290 1.688
65 HB3 ARG 10 1HB ARG 10 -1.685 9.092 3.318
66 HG2 ARG 10 2HG ARG 10 0.576 9.590 2.328
67 HG3 ARG 10 1HG ARG 10 -0.261 10.029 0.839
68 HD2 ARG 10 2HD ARG 10 0.138 12.045 2.059
69 HD3 ARG 10 1HD ARG 10 -1.582 11.681 2.190
70 HH11 ARG 10 1HH1 ARG 10 1.838 11.638 2.955
71 HH12 ARG 10 2HH1 ARG 10 2.747 11.697 4.363
72 HH21 ARG 10 1HH2 ARG 10 -0.175 11.465 6.474
73 HH22 ARG 10 2HH2 ARG 10 1.515 11.624 6.481
74 H THR 11 H THR 11 1.304 7.178 1.412
75 HA THR 11 HA THR 11 1.906 5.573 3.656
76 HB THR 11 HB THR 11 4.269 5.910 2.789
77 HG1 THR 11 1HG THR 11 4.514 6.995 1.007
78 HG21 THR 11 3HG2 THR 11 2.156 4.889 0.905
79 HG22 THR 11 1HG2 THR 11 2.843 3.971 2.246
80 HG23 THR 11 2HG2 THR 11 3.860 4.439 0.888
81 H LEU 12 H LEU 12 2.898 6.054 5.503
82 HA LEU 12 HA LEU 12 3.124 8.892 6.224
83 HG LEU 12 HG LEU 12 0.984 6.574 7.003
84 HB2 LEU 12 2HB LEU 12 3.240 6.430 7.955
85 HB3 LEU 12 1HB LEU 12 3.121 8.087 8.501
86 HD11 LEU 12 1HD1 LEU 12 1.197 7.402 9.888
87 HD12 LEU 12 2HD1 LEU 12 1.273 5.755 9.258
88 HD13 LEU 12 3HD1 LEU 12 -0.221 6.680 9.135
89 HD21 LEU 12 3HD2 LEU 12 0.963 9.318 8.234
90 HD22 LEU 12 1HD2 LEU 12 -0.419 8.490 7.522
91 HD23 LEU 12 2HD2 LEU 12 0.944 8.955 6.506
92 H PHE 13 H PHE 13 4.971 6.110 5.458
93 HA PHE 13 HA PHE 13 7.431 7.447 6.221
94 HD1 PHE 13 1HD PHE 13 8.554 7.197 8.882
95 HD2 PHE 13 2HD PHE 13 5.063 4.795 8.552
96 HE1 PHE 13 1HE PHE 13 7.861 7.885 11.142
97 HE2 PHE 13 2HE PHE 13 4.370 5.487 10.800
98 HZ PHE 13 HZ PHE 13 5.767 7.026 12.096
99 HB2 PHE 13 2HB PHE 13 6.780 4.582 6.985
100 HB3 PHE 13 1HB PHE 13 8.340 5.357 7.197
101 HA PRO 14 HA PRO 14 8.545 5.517 2.332
102 HB2 PRO 14 2HB PRO 14 11.356 5.566 3.156
103 HB3 PRO 14 1HB PRO 14 10.559 6.487 1.874
104 HG2 PRO 14 2HG PRO 14 11.482 7.624 4.165
105 HG3 PRO 14 1HG PRO 14 10.109 8.257 3.242
106 HD2 PRO 14 2HD PRO 14 10.121 6.638 5.755
107 HD3 PRO 14 1HD PRO 14 9.066 7.983 5.250
108 H TYR 15 H TYR 15 9.040 3.481 1.682
109 HA TYR 15 HA TYR 15 10.035 1.546 3.635
110 HD1 TYR 15 1HD TYR 15 8.536 -0.174 5.267
111 HD2 TYR 15 2HD TYR 15 7.557 -0.983 1.210
112 HE1 TYR 15 1HE TYR 15 8.470 -2.579 5.768
113 HE2 TYR 15 2HE TYR 15 7.499 -3.387 1.696
114 HH TYR 15 HH TYR 15 8.400 -4.992 3.382
115 HB2 TYR 15 2HB TYR 15 7.534 1.566 3.727
116 HB3 TYR 15 1HB TYR 15 7.490 1.242 2.006
117 H THR 16 H THR 16 11.354 0.069 2.605
118 HA THR 16 HA THR 16 11.501 0.362 -0.309
119 HB THR 16 HB THR 16 13.704 -0.582 1.532
120 HG1 THR 16 1HG THR 16 12.717 1.886 1.080
121 HG21 THR 16 3HG2 THR 16 13.911 -1.270 -0.826
122 HG22 THR 16 1HG2 THR 16 15.132 -0.067 -0.416
123 HG23 THR 16 2HG2 THR 16 13.706 0.407 -1.334
124 H GLY 17 H GLY 17 11.058 -1.372 -1.504
125 HA2 GLY 17 2HA GLY 17 10.489 -3.850 -0.179
126 HA3 GLY 17 1HA GLY 17 10.285 -3.495 -1.899
127 H THR 18 H THR 18 11.795 -5.489 -0.018
128 HA THR 18 HA THR 18 14.474 -5.171 -1.147
129 HB THR 18 HB THR 18 15.060 -6.991 0.523
130 HG1 THR 18 1HG THR 18 12.301 -6.570 1.175
131 HG21 THR 18 3HG2 THR 18 13.751 -4.498 1.592
132 HG22 THR 18 1HG2 THR 18 15.414 -4.613 1.024
133 HG23 THR 18 2HG2 THR 18 14.916 -5.494 2.473
134 H ASN 19 H ASN 19 11.690 -6.583 -1.765
135 HA ASN 19 HA ASN 19 12.825 -8.441 -3.641
136 HB2 ASN 19 2HB ASN 19 11.152 -10.175 -3.028
137 HB3 ASN 19 1HB ASN 19 12.304 -9.899 -1.731
138 HD21 ASN 19 1HD2 ASN 19 9.029 -9.921 -2.684
139 HD22 ASN 19 2HD2 ASN 19 8.363 -9.429 -1.159
140 H GLU 20 H GLU 20 11.237 -8.888 -5.352
141 HA GLU 20 HA GLU 20 10.224 -6.416 -6.167
142 HB2 GLU 20 2HB GLU 20 9.405 -7.580 -8.186
143 HB3 GLU 20 1HB GLU 20 11.098 -7.852 -7.821
144 HG2 GLU 20 2HG GLU 20 10.505 -10.053 -6.879
145 HG3 GLU 20 1HG GLU 20 8.823 -9.757 -7.324
146 H ASP 21 H ASP 21 8.503 -9.027 -4.670
147 HA ASP 21 HA ASP 21 5.929 -7.864 -5.333
148 HB2 ASP 21 2HB ASP 21 6.617 -10.155 -3.479
149 HB3 ASP 21 1HB ASP 21 4.979 -9.567 -3.726
150 H GLU 22 H GLU 22 8.262 -7.103 -3.199
151 HA GLU 22 HA GLU 22 6.403 -5.946 -1.277
152 HB2 GLU 22 2HB GLU 22 8.297 -7.361 -0.446
153 HB3 GLU 22 1HB GLU 22 9.415 -6.250 -1.205
154 HG2 GLU 22 2HG GLU 22 8.680 -4.474 0.288
155 HG3 GLU 22 1HG GLU 22 7.503 -5.567 0.997
156 H LEU 23 H LEU 23 5.900 -3.938 -1.751
157 HA LEU 23 HA LEU 23 7.290 -2.623 -3.906
158 HG LEU 23 HG LEU 23 5.010 -2.139 -5.544
159 HB2 LEU 23 2HB LEU 23 4.702 -2.319 -2.544
160 HB3 LEU 23 1HB LEU 23 5.330 -0.895 -3.383
161 HD11 LEU 23 1HD1 LEU 23 5.974 -4.142 -5.002
162 HD12 LEU 23 2HD1 LEU 23 4.311 -4.388 -5.561
163 HD13 LEU 23 3HD1 LEU 23 4.717 -4.469 -3.829
164 HD21 LEU 23 3HD2 LEU 23 2.712 -2.589 -5.396
165 HD22 LEU 23 1HD2 LEU 23 3.056 -1.166 -4.415
166 HD23 LEU 23 2HD2 LEU 23 2.787 -2.731 -3.639
167 H THR 24 H THR 24 8.214 -0.685 -3.907
168 HA THR 24 HA THR 24 9.200 0.315 -1.374
169 HB THR 24 HB THR 24 9.971 0.916 -4.244
170 HG1 THR 24 1HG THR 24 11.181 -0.761 -4.076
171 HG21 THR 24 3HG2 THR 24 11.339 1.748 -1.657
172 HG22 THR 24 1HG2 THR 24 10.509 2.811 -2.786
173 HG23 THR 24 2HG2 THR 24 11.992 1.988 -3.273
174 H PHE 25 H PHE 25 8.572 2.244 -0.590
175 HA PHE 25 HA PHE 25 6.810 3.977 -2.200
176 HD1 PHE 25 1HD PHE 25 6.090 0.780 0.166
177 HD2 PHE 25 2HD PHE 25 3.737 3.766 -1.717
178 HE1 PHE 25 1HE PHE 25 4.487 -0.933 -0.537
179 HE2 PHE 25 2HE PHE 25 2.124 2.052 -2.438
180 HZ PHE 25 HZ PHE 25 2.496 -0.302 -1.843
181 HB2 PHE 25 2HB PHE 25 6.374 3.147 0.677
182 HB3 PHE 25 1HB PHE 25 5.470 4.374 -0.190
183 H ARG 26 H ARG 26 6.899 6.135 -1.617
184 HA ARG 26 HA ARG 26 9.084 6.984 0.153
185 HE ARG 26 HE ARG 26 7.386 9.455 -3.564
186 HB2 ARG 26 2HB ARG 26 7.380 8.545 -1.811
187 HB3 ARG 26 1HB ARG 26 8.615 9.257 -0.793
188 HG2 ARG 26 2HG ARG 26 10.302 7.910 -1.942
189 HG3 ARG 26 1HG ARG 26 9.036 7.247 -2.982
190 HD2 ARG 26 2HD ARG 26 9.735 10.169 -2.733
191 HD3 ARG 26 1HD ARG 26 10.267 9.107 -4.028
192 HH11 ARG 26 1HH1 ARG 26 10.157 10.135 -5.681
193 HH12 ARG 26 2HH1 ARG 26 9.193 10.555 -7.010
194 HH21 ARG 26 1HH2 ARG 26 6.112 9.997 -5.340
195 HH22 ARG 26 2HH2 ARG 26 6.804 10.511 -6.819
196 H GLU 27 H GLU 27 8.221 9.243 1.167
197 HA GLU 27 HA GLU 27 5.842 8.524 2.709
198 HB2 GLU 27 2HB GLU 27 7.988 9.323 3.818
199 HB3 GLU 27 1HB GLU 27 7.756 10.867 3.035
200 HG2 GLU 27 2HG GLU 27 5.747 9.728 4.963
201 HG3 GLU 27 1HG GLU 27 7.134 10.660 5.497
202 H GLY 28 H GLY 28 3.904 9.343 2.114
203 HA2 GLY 28 2HA GLY 28 2.487 11.150 1.486
204 HA3 GLY 28 1HA GLY 28 3.860 11.919 0.706
205 H GLU 29 H GLU 29 3.282 8.557 0.100
206 HA GLU 29 HA GLU 29 2.585 9.221 -2.658
207 HB2 GLU 29 2HB GLU 29 3.229 6.547 -1.398
208 HB3 GLU 29 1HB GLU 29 3.045 6.867 -3.111
209 HG2 GLU 29 2HG GLU 29 5.218 7.961 -1.340
210 HG3 GLU 29 1HG GLU 29 5.369 6.606 -2.453
211 H ILE 30 H ILE 30 0.585 8.746 -3.452
212 HA ILE 30 HA ILE 30 -1.382 7.729 -1.582
213 HB ILE 30 HB ILE 30 -1.694 8.858 -4.386
214 HG12 ILE 30 2HG1 ILE 30 -1.062 10.514 -2.693
215 HG13 ILE 30 1HG1 ILE 30 -2.698 10.806 -3.279
216 HG21 ILE 30 1HG2 ILE 30 -3.855 8.024 -2.448
217 HG22 ILE 30 2HG2 ILE 30 -3.451 7.213 -3.957
218 HG23 ILE 30 3HG2 ILE 30 -4.123 8.845 -3.987
219 HD11 ILE 30 3HD1 ILE 30 -1.919 9.517 -0.664
220 HD12 ILE 30 1HD1 ILE 30 -3.573 9.763 -1.229
221 HD13 ILE 30 2HD1 ILE 30 -2.539 11.152 -0.885
222 H ILE 31 H ILE 31 -2.064 5.768 -1.618
223 HA ILE 31 HA ILE 31 -0.854 3.954 -3.580
224 HB ILE 31 HB ILE 31 -2.188 3.276 -0.949
225 HG12 ILE 31 2HG1 ILE 31 0.775 3.539 -1.541
226 HG13 ILE 31 1HG1 ILE 31 -0.178 4.676 -0.592
227 HG21 ILE 31 1HG2 ILE 31 -2.142 1.426 -2.534
228 HG22 ILE 31 2HG2 ILE 31 -1.030 1.113 -1.201
229 HG23 ILE 31 3HG2 ILE 31 -0.407 1.642 -2.763
230 HD11 ILE 31 3HD1 ILE 31 -0.595 2.963 1.074
231 HD12 ILE 31 1HD1 ILE 31 1.137 3.155 0.815
232 HD13 ILE 31 2HD1 ILE 31 0.288 1.785 0.106
233 H HIS 32 H HIS 32 -2.139 2.882 -4.987
234 HA HIS 32 HA HIS 32 -5.018 3.167 -4.730
235 HD1 HIS 32 1HD HIS 32 -2.632 2.952 -8.878
236 HD2 HIS 32 2HD HIS 32 -5.076 5.192 -6.357
237 HE1 HIS 32 1HE HIS 32 -2.637 5.297 -9.797
238 HB2 HIS 32 2HB HIS 32 -3.357 1.688 -6.814
239 HB3 HIS 32 1HB HIS 32 -5.092 1.946 -6.893
240 H LEU 33 H LEU 33 -5.736 1.868 -3.169
241 HA LEU 33 HA LEU 33 -4.326 -0.499 -2.459
242 HG LEU 33 HG LEU 33 -5.194 -1.474 -0.166
243 HB2 LEU 33 2HB LEU 33 -5.500 0.981 -0.835
244 HB3 LEU 33 1HB LEU 33 -7.020 0.515 -1.549
245 HD11 LEU 33 1HD1 LEU 33 -5.785 0.336 1.366
246 HD12 LEU 33 2HD1 LEU 33 -6.581 -1.171 1.801
247 HD13 LEU 33 3HD1 LEU 33 -7.489 0.103 0.982
248 HD21 LEU 33 3HD2 LEU 33 -6.974 -2.367 -1.657
249 HD22 LEU 33 1HD2 LEU 33 -8.173 -1.521 -0.684
250 HD23 LEU 33 2HD2 LEU 33 -7.196 -2.815 0.029
251 H ILE 34 H ILE 34 -4.594 -2.409 -3.190
252 HA ILE 34 HA ILE 34 -6.667 -2.873 -5.193
253 HB ILE 34 HB ILE 34 -4.107 -4.394 -4.615
254 HG12 ILE 34 2HG1 ILE 34 -3.639 -2.188 -5.559
255 HG13 ILE 34 1HG1 ILE 34 -3.274 -3.446 -6.732
256 HG21 ILE 34 1HG2 ILE 34 -6.055 -4.749 -6.884
257 HG22 ILE 34 2HG2 ILE 34 -5.766 -5.882 -5.558
258 HG23 ILE 34 3HG2 ILE 34 -4.487 -5.542 -6.733
259 HD11 ILE 34 3HD1 ILE 34 -5.394 -2.960 -7.880
260 HD12 ILE 34 1HD1 ILE 34 -4.336 -1.549 -7.797
261 HD13 ILE 34 2HD1 ILE 34 -5.716 -1.676 -6.710
262 H SER 35 H SER 35 -5.246 -4.285 -2.246
263 HA SER 35 HA SER 35 -7.763 -5.591 -1.686
264 HG SER 35 HG SER 35 -7.298 -6.680 -3.661
265 HB2 SER 35 2HB SER 35 -5.226 -7.244 -1.939
266 HB3 SER 35 1HB SER 35 -6.812 -7.832 -1.454
267 H LYS 36 H LYS 36 -8.125 -5.507 0.469
268 HA LYS 36 HA LYS 36 -5.961 -4.806 2.280
269 HB2 LYS 36 2HB LYS 36 -8.957 -4.952 2.552
270 HB3 LYS 36 1HB LYS 36 -7.959 -5.004 3.994
271 HG2 LYS 36 2HG LYS 36 -7.046 -2.842 3.504
272 HG3 LYS 36 1HG LYS 36 -7.880 -2.782 1.956
273 HD2 LYS 36 2HD LYS 36 -10.019 -2.704 3.055
274 HD3 LYS 36 1HD LYS 36 -9.265 -2.961 4.630
275 HE2 LYS 36 2HE LYS 36 -8.191 -0.823 4.540
276 HE3 LYS 36 1HE LYS 36 -8.653 -0.600 2.857
277 HZ1 LYS 36 3HZ LYS 36 -10.657 -0.813 5.048
278 HZ2 LYS 36 1HZ LYS 36 -10.868 -0.352 3.433
279 HZ3 LYS 36 2HZ LYS 36 -10.034 0.651 4.505
280 H GLU 37 H GLU 37 -8.211 -7.379 1.607
281 HA GLU 37 HA GLU 37 -6.982 -9.083 3.582
282 HB2 GLU 37 2HB GLU 37 -9.396 -9.239 3.338
283 HB3 GLU 37 1HB GLU 37 -9.230 -9.558 1.617
284 HG2 GLU 37 2HG GLU 37 -9.732 -11.590 2.823
285 HG3 GLU 37 1HG GLU 37 -8.130 -11.668 2.101
286 H THR 38 H THR 38 -5.042 -9.752 3.025
287 HA THR 38 HA THR 38 -4.614 -10.738 0.302
288 HB THR 38 HB THR 38 -2.182 -10.469 0.933
289 HG1 THR 38 1HG THR 38 -2.589 -8.650 2.897
290 HG21 THR 38 3HG2 THR 38 -3.350 -8.767 -0.428
291 HG22 THR 38 1HG2 THR 38 -2.166 -8.022 0.647
292 HG23 THR 38 2HG2 THR 38 -3.881 -7.965 1.052
293 H GLY 39 H GLY 39 -5.443 -11.773 3.257
294 HA2 GLY 39 2HA GLY 39 -5.505 -14.022 3.899
295 HA3 GLY 39 1HA GLY 39 -4.034 -14.320 2.971
296 H GLU 40 H GLU 40 -2.570 -12.119 3.864
297 HA GLU 40 HA GLU 40 -1.965 -13.020 6.560
298 HB2 GLU 40 2HB GLU 40 -0.288 -11.619 4.480
299 HB3 GLU 40 1HB GLU 40 0.202 -11.703 6.163
300 HG2 GLU 40 2HG GLU 40 1.362 -13.406 4.943
301 HG3 GLU 40 1HG GLU 40 0.199 -14.172 6.009
302 H ALA 41 H ALA 41 -2.690 -11.867 8.132
303 HA ALA 41 HA ALA 41 -3.938 -9.373 7.831
304 HB1 ALA 41 1HB ALA 41 -2.994 -10.709 10.361
305 HB2 ALA 41 2HB ALA 41 -4.552 -10.982 9.580
306 HB3 ALA 41 3HB ALA 41 -4.165 -9.398 10.251
307 H GLY 42 H GLY 42 -3.129 -7.411 7.761
308 HA2 GLY 42 2HA GLY 42 -1.752 -5.704 8.809
309 HA3 GLY 42 1HA GLY 42 -0.505 -6.926 9.007
310 H TRP 43 H TRP 43 -1.383 -7.846 6.205
311 HA TRP 43 HA TRP 43 0.350 -5.952 4.810
312 HD1 TRP 43 HD TRP 43 0.887 -9.560 6.593
313 HE1 TRP 43 1HE TRP 43 3.343 -9.668 7.320
314 HE3 TRP 43 3HE TRP 43 2.946 -6.692 2.903
315 HZ2 TRP 43 2HZ TRP 43 5.844 -8.660 6.450
316 HZ3 TRP 43 3HZ TRP 43 5.374 -6.312 2.918
317 HH2 TRP 43 HH TRP 43 6.791 -7.268 4.646
318 HB2 TRP 43 2HB TRP 43 -0.237 -8.861 4.244
319 HB3 TRP 43 1HB TRP 43 0.702 -7.817 3.184
320 H TRP 44 H TRP 44 -0.507 -4.737 3.358
321 HA TRP 44 HA TRP 44 -3.076 -5.504 2.171
322 HD1 TRP 44 HD TRP 44 -4.003 -5.324 4.188
323 HE1 TRP 44 1HE TRP 44 -5.615 -4.294 5.877
324 HE3 TRP 44 3HE TRP 44 -3.428 -0.399 2.952
325 HZ2 TRP 44 2HZ TRP 44 -6.532 -1.734 6.610
326 HZ3 TRP 44 3HZ TRP 44 -4.717 1.282 4.207
327 HH2 TRP 44 HH TRP 44 -6.239 0.622 5.996
328 HB2 TRP 44 2HB TRP 44 -1.859 -2.788 2.678
329 HB3 TRP 44 1HB TRP 44 -3.185 -3.027 1.555
330 H LYS 45 H LYS 45 -3.312 -5.133 -0.032
331 HA LYS 45 HA LYS 45 -0.762 -5.080 -1.469
332 HB2 LYS 45 2HB LYS 45 -2.109 -7.122 -1.870
333 HB3 LYS 45 1HB LYS 45 -3.463 -6.120 -2.378
334 HG2 LYS 45 2HG LYS 45 -2.084 -5.250 -4.231
335 HG3 LYS 45 1HG LYS 45 -0.793 -6.348 -3.748
336 HD2 LYS 45 2HD LYS 45 -2.230 -8.254 -4.200
337 HD3 LYS 45 1HD LYS 45 -3.560 -7.163 -4.619
338 HE2 LYS 45 2HE LYS 45 -2.171 -6.222 -6.429
339 HE3 LYS 45 1HE LYS 45 -0.909 -7.385 -6.043
340 HZ1 LYS 45 3HZ LYS 45 -2.281 -7.987 -7.920
341 HZ2 LYS 45 1HZ LYS 45 -3.654 -8.091 -6.961
342 HZ3 LYS 45 2HZ LYS 45 -2.382 -9.172 -6.717
343 H GLY 46 H GLY 46 -0.383 -3.443 -2.736
344 HA2 GLY 46 2HA GLY 46 -2.587 -1.703 -3.530
345 HA3 GLY 46 1HA GLY 46 -1.223 -1.006 -2.660
346 H GLU 47 H GLU 47 -1.879 -0.141 -5.121
347 HA GLU 47 HA GLU 47 0.331 -1.170 -6.729
348 HB2 GLU 47 2HB GLU 47 -1.867 -1.635 -7.739
349 HB3 GLU 47 1HB GLU 47 -2.299 0.052 -7.626
350 HG2 GLU 47 2HG GLU 47 0.020 -0.884 -9.299
351 HG3 GLU 47 1HG GLU 47 -1.630 -0.887 -9.908
352 H LEU 48 H LEU 48 1.857 0.184 -7.200
353 HA LEU 48 HA LEU 48 1.402 3.048 -7.180
354 HG LEU 48 HG LEU 48 4.166 3.986 -6.655
355 HB2 LEU 48 2HB LEU 48 2.220 2.512 -4.899
356 HB3 LEU 48 1HB LEU 48 3.635 1.749 -5.605
357 HD11 LEU 48 1HD1 LEU 48 2.048 5.057 -6.505
358 HD12 LEU 48 2HD1 LEU 48 3.227 5.973 -5.564
359 HD13 LEU 48 3HD1 LEU 48 2.057 4.936 -4.747
360 HD21 LEU 48 3HD2 LEU 48 5.409 3.166 -4.748
361 HD22 LEU 48 1HD2 LEU 48 4.174 3.795 -3.655
362 HD23 LEU 48 2HD2 LEU 48 5.156 4.906 -4.607
363 H ASN 49 H ASN 49 2.271 3.818 -8.948
364 HA ASN 49 HA ASN 49 3.647 4.261 -10.697
365 HB2 ASN 49 2HB ASN 49 5.689 2.565 -9.236
366 HB3 ASN 49 1HB ASN 49 6.018 3.642 -10.584
367 HD21 ASN 49 1HD2 ASN 49 7.125 3.600 -7.940
368 HD22 ASN 49 2HD2 ASN 49 6.810 5.140 -7.224
369 H GLY 50 H GLY 50 2.006 1.667 -10.531
370 HA2 GLY 50 2HA GLY 50 1.513 0.311 -12.371
371 HA3 GLY 50 1HA GLY 50 3.147 0.549 -12.972
372 H LYS 51 H LYS 51 3.313 -0.097 -9.718
373 HA LYS 51 HA LYS 51 3.633 -2.959 -10.260
374 HB2 LYS 51 2HB LYS 51 5.118 -1.311 -8.191
375 HB3 LYS 51 1HB LYS 51 5.243 -3.048 -8.369
376 HG2 LYS 51 2HG LYS 51 7.158 -2.227 -9.366
377 HG3 LYS 51 1HG LYS 51 6.098 -2.575 -10.725
378 HD2 LYS 51 2HD LYS 51 5.449 -0.208 -10.832
379 HD3 LYS 51 1HD LYS 51 6.524 0.147 -9.483
380 HE2 LYS 51 2HE LYS 51 8.439 -0.590 -10.842
381 HE3 LYS 51 1HE LYS 51 7.345 -0.918 -12.186
382 HZ1 LYS 51 3HZ LYS 51 6.746 1.472 -12.175
383 HZ2 LYS 51 1HZ LYS 51 8.382 1.215 -12.470
384 HZ3 LYS 51 2HZ LYS 51 7.884 1.741 -10.963
385 H GLU 52 H GLU 52 2.646 -4.345 -8.935
386 HA GLU 52 HA GLU 52 1.227 -3.160 -6.716
387 HB2 GLU 52 2HB GLU 52 -0.710 -4.715 -7.165
388 HB3 GLU 52 1HB GLU 52 -0.531 -3.443 -8.353
389 HG2 GLU 52 2HG GLU 52 0.597 -5.067 -9.845
390 HG3 GLU 52 1HG GLU 52 0.306 -6.321 -8.645
391 H GLY 53 H GLY 53 1.385 -4.113 -4.893
392 HA2 GLY 53 2HA GLY 53 2.204 -6.852 -4.652
393 HA3 GLY 53 1HA GLY 53 3.444 -5.731 -4.321
394 H VAL 54 H VAL 54 3.542 -6.368 -2.212
395 HA VAL 54 HA VAL 54 1.204 -5.592 -0.620
396 HB VAL 54 HB VAL 54 1.835 -7.301 1.069
397 HG11 VAL 54 1HG1 VAL 54 1.283 -8.380 -1.687
398 HG12 VAL 54 2HG1 VAL 54 0.085 -7.789 -0.540
399 HG13 VAL 54 3HG1 VAL 54 1.007 -9.249 -0.179
400 HG21 VAL 54 3HG2 VAL 54 4.202 -7.568 0.525
401 HG22 VAL 54 1HG2 VAL 54 3.777 -8.250 -1.045
402 HG23 VAL 54 2HG2 VAL 54 3.372 -9.122 0.432
403 H PHE 55 H PHE 55 1.502 -4.720 1.374
404 HA PHE 55 HA PHE 55 4.143 -3.975 2.258
405 HD1 PHE 55 1HD PHE 55 1.276 -2.364 -0.406
406 HD2 PHE 55 2HD PHE 55 1.748 -0.675 3.478
407 HE1 PHE 55 1HE PHE 55 -0.967 -1.372 -0.560
408 HE2 PHE 55 2HE PHE 55 -0.494 0.310 3.325
409 HZ PHE 55 HZ PHE 55 -1.855 -0.036 1.305
410 HB2 PHE 55 2HB PHE 55 3.665 -1.564 2.267
411 HB3 PHE 55 1HB PHE 55 3.473 -2.219 0.643
412 HA PRO 56 HA PRO 56 1.770 -4.392 6.063
413 HB2 PRO 56 2HB PRO 56 3.703 -2.718 7.485
414 HB3 PRO 56 1HB PRO 56 3.431 -4.453 7.636
415 HG2 PRO 56 2HG PRO 56 5.687 -3.422 6.533
416 HG3 PRO 56 1HG PRO 56 5.001 -4.980 6.045
417 HD2 PRO 56 2HD PRO 56 4.773 -2.307 4.711
418 HD3 PRO 56 1HD PRO 56 5.068 -3.909 3.996
419 H ASP 57 H ASP 57 0.069 -3.246 6.746
420 HA ASP 57 HA ASP 57 -0.481 -0.769 5.541
421 HB2 ASP 57 2HB ASP 57 -2.620 -0.799 6.515
422 HB3 ASP 57 1HB ASP 57 -2.205 -2.478 6.240
423 H ASN 58 H ASN 58 1.097 -1.340 8.515
424 HA ASN 58 HA ASN 58 0.266 1.102 9.738
425 HB2 ASN 58 2HB ASN 58 2.552 -0.723 10.493
426 HB3 ASN 58 1HB ASN 58 2.178 0.753 11.367
427 HD21 ASN 58 1HD2 ASN 58 1.267 -2.509 10.777
428 HD22 ASN 58 2HD2 ASN 58 0.030 -2.613 11.962
429 H PHE 59 H PHE 59 2.378 0.566 7.233
430 HA PHE 59 HA PHE 59 4.009 2.906 7.796
431 HD1 PHE 59 2HD PHE 59 4.399 -0.825 7.084
432 HD2 PHE 59 1HD PHE 59 6.952 2.545 6.719
433 HE1 PHE 59 2HE PHE 59 6.172 -2.043 8.281
434 HE2 PHE 59 1HE PHE 59 8.723 1.350 7.911
435 HZ PHE 59 HZ PHE 59 8.338 -0.955 8.695
436 HB2 PHE 59 2HB PHE 59 3.958 0.980 5.472
437 HB3 PHE 59 1HB PHE 59 4.955 2.430 5.476
438 H ALA 60 H ALA 60 0.968 2.474 6.819
439 HA ALA 60 HA ALA 60 0.937 4.972 5.339
440 HB1 ALA 60 1HB ALA 60 -0.454 2.439 4.453
441 HB2 ALA 60 2HB ALA 60 0.924 3.186 3.649
442 HB3 ALA 60 3HB ALA 60 -0.628 4.025 3.701
443 H VAL 61 H VAL 61 -1.435 5.605 5.100
444 HA VAL 61 HA VAL 61 -3.091 4.594 7.270
445 HB VAL 61 HB VAL 61 -1.935 6.712 8.010
446 HG11 VAL 61 1HG1 VAL 61 -1.744 7.860 5.910
447 HG12 VAL 61 2HG1 VAL 61 -2.631 8.855 7.070
448 HG13 VAL 61 3HG1 VAL 61 -3.498 7.998 5.798
449 HG21 VAL 61 3HG2 VAL 61 -3.951 7.873 8.827
450 HG22 VAL 61 1HG2 VAL 61 -4.054 6.121 9.026
451 HG23 VAL 61 2HG2 VAL 61 -4.926 6.911 7.713
452 H GLN 62 H GLN 62 -5.301 4.723 6.744
453 HA GLN 62 HA GLN 62 -5.872 4.766 3.946
454 HB2 GLN 62 2HB GLN 62 -7.019 3.259 5.551
455 HB3 GLN 62 1HB GLN 62 -7.738 4.656 6.329
456 HG2 GLN 62 2HG GLN 62 -9.399 3.659 4.899
457 HG3 GLN 62 1HG GLN 62 -8.891 5.179 4.210
458 HE21 GLN 62 1HE2 GLN 62 -9.804 4.356 2.239
459 HE22 GLN 62 2HE2 GLN 62 -8.820 3.298 1.280
460 H ILE 63 H ILE 63 -7.186 6.293 2.908
461 HA ILE 63 HA ILE 63 -7.123 8.939 4.177
462 HB ILE 63 HB ILE 63 -7.583 8.175 1.272
463 HG12 ILE 63 2HG1 ILE 63 -5.254 7.905 1.982
464 HG13 ILE 63 1HG1 ILE 63 -5.411 9.248 0.858
465 HG21 ILE 63 1HG2 ILE 63 -8.852 10.167 1.785
466 HG22 ILE 63 2HG2 ILE 63 -7.443 10.589 0.797
467 HG23 ILE 63 3HG2 ILE 63 -7.431 10.909 2.528
468 HD11 ILE 63 3HD1 ILE 63 -3.901 9.864 2.644
469 HD12 ILE 63 1HD1 ILE 63 -5.114 9.434 3.848
470 HD13 ILE 63 2HD1 ILE 63 -5.384 10.801 2.777
471 H SER 64 H SER 64 -9.311 6.996 2.214
472 HA SER 64 HA SER 64 -11.511 8.011 3.808
473 HG SER 64 HG SER 64 -11.268 6.475 0.663
474 HB2 SER 64 2HB SER 64 -12.844 7.784 1.663
475 HB3 SER 64 1HB SER 64 -11.644 9.080 1.647
Start of MODEL 4
1 H1 GLY 1 1HT GLY 1 -16.317 -7.974 -1.252
2 H2 GLY 1 2HT GLY 1 -14.643 -7.952 -1.368
3 H3 GLY 1 3HT GLY 1 -15.507 -6.514 -1.501
4 HA2 GLY 1 1HA GLY 1 -16.243 -6.728 0.799
5 HA3 GLY 1 2HA GLY 1 -15.262 -8.184 0.916
6 H ALA 2 H ALA 2 -13.083 -8.019 1.195
7 HA ALA 2 HA ALA 2 -12.129 -5.418 2.012
8 HB1 ALA 2 1HB ALA 2 -11.650 -7.373 3.406
9 HB2 ALA 2 2HB ALA 2 -10.162 -6.603 2.845
10 HB3 ALA 2 3HB ALA 2 -10.736 -8.089 2.079
11 H MET 3 H MET 3 -12.170 -7.096 -0.861
12 HA MET 3 HA MET 3 -9.693 -6.169 -1.911
13 HB2 MET 3 2HB MET 3 -10.981 -8.034 -2.982
14 HB3 MET 3 1HB MET 3 -12.221 -6.868 -3.433
15 HG2 MET 3 2HG MET 3 -10.660 -5.695 -4.856
16 HG3 MET 3 1HG MET 3 -9.352 -6.755 -4.343
17 HE1 MET 3 3HE MET 3 -9.967 -6.140 -7.372
18 HE2 MET 3 1HE MET 3 -9.823 -7.751 -8.076
19 HE3 MET 3 2HE MET 3 -8.689 -7.231 -6.830
20 H GLY 4 H GLY 4 -9.279 -4.347 -3.125
21 HA2 GLY 4 2HA GLY 4 -10.700 -2.097 -2.142
22 HA3 GLY 4 1HA GLY 4 -9.279 -2.078 -3.173
23 H ALA 5 H ALA 5 -12.123 -0.880 -3.013
24 HA ALA 5 HA ALA 5 -12.934 -1.254 -5.786
25 HB1 ALA 5 1HB ALA 5 -14.710 -1.049 -4.090
26 HB2 ALA 5 2HB ALA 5 -14.757 0.333 -5.184
27 HB3 ALA 5 3HB ALA 5 -14.055 0.505 -3.576
28 H LYS 6 H LYS 6 -12.491 1.542 -3.757
29 HA LYS 6 HA LYS 6 -10.263 2.451 -5.316
30 HB2 LYS 6 2HB LYS 6 -12.688 4.233 -4.848
31 HB3 LYS 6 1HB LYS 6 -11.110 4.830 -5.327
32 HG2 LYS 6 2HG LYS 6 -11.317 3.373 -7.377
33 HG3 LYS 6 1HG LYS 6 -12.990 3.098 -6.912
34 HD2 LYS 6 2HD LYS 6 -12.894 4.884 -8.550
35 HD3 LYS 6 1HD LYS 6 -13.371 5.548 -6.988
36 HE2 LYS 6 2HE LYS 6 -11.175 6.409 -6.608
37 HE3 LYS 6 1HE LYS 6 -10.541 5.589 -8.036
38 HZ1 LYS 6 3HZ LYS 6 -10.914 7.947 -8.383
39 HZ2 LYS 6 1HZ LYS 6 -12.540 7.788 -8.016
40 HZ3 LYS 6 2HZ LYS 6 -11.902 7.055 -9.398
41 H GLU 7 H GLU 7 -9.264 1.686 -3.531
42 HA GLU 7 HA GLU 7 -9.728 3.029 -0.953
43 HB2 GLU 7 2HB GLU 7 -8.071 0.654 -1.743
44 HB3 GLU 7 1HB GLU 7 -8.306 1.202 -0.078
45 HG2 GLU 7 2HG GLU 7 -10.405 0.090 -1.934
46 HG3 GLU 7 1HG GLU 7 -9.553 -0.836 -0.706
47 H TYR 8 H TYR 8 -8.349 4.779 -0.672
48 HA TYR 8 HA TYR 8 -5.659 4.446 -1.810
49 HD1 TYR 8 2HD TYR 8 -4.987 5.900 -4.247
50 HD2 TYR 8 1HD TYR 8 -8.954 6.605 -2.938
51 HE1 TYR 8 2HE TYR 8 -5.772 5.692 -6.557
52 HE2 TYR 8 1HE TYR 8 -9.759 6.405 -5.233
53 HH TYR 8 HH TYR 8 -7.864 5.135 -7.731
54 HB2 TYR 8 2HB TYR 8 -7.073 7.087 -1.470
55 HB3 TYR 8 1HB TYR 8 -5.454 6.842 -2.047
56 H CYS 9 H CYS 9 -4.004 4.669 -0.622
57 HA CYS 9 HA CYS 9 -4.344 5.662 2.126
58 HG CYS 9 HG CYS 9 -5.649 3.101 1.468
59 HB2 CYS 9 2HB CYS 9 -2.518 3.398 1.254
60 HB3 CYS 9 1HB CYS 9 -2.818 3.962 2.892
61 H ARG 10 H ARG 10 -2.714 6.967 2.890
62 HA ARG 10 HA ARG 10 -0.676 7.809 0.937
63 HE ARG 10 HE ARG 10 2.032 11.243 3.672
64 HB2 ARG 10 2HB ARG 10 -1.861 9.718 1.857
65 HB3 ARG 10 1HB ARG 10 -1.634 9.121 3.500
66 HG2 ARG 10 2HG ARG 10 0.806 9.389 3.242
67 HG3 ARG 10 1HG ARG 10 0.549 10.066 1.645
68 HD2 ARG 10 2HD ARG 10 -0.536 11.982 2.568
69 HD3 ARG 10 1HD ARG 10 -0.601 11.240 4.168
70 HH11 ARG 10 1HH1 ARG 10 -0.259 13.900 3.220
71 HH12 ARG 10 2HH1 ARG 10 0.804 15.081 3.826
72 HH21 ARG 10 1HH2 ARG 10 3.462 12.821 4.396
73 HH22 ARG 10 2HH2 ARG 10 3.012 14.476 4.509
74 H THR 11 H THR 11 1.379 7.297 1.227
75 HA THR 11 HA THR 11 2.152 5.524 3.276
76 HB THR 11 HB THR 11 4.407 5.847 2.236
77 HG1 THR 11 1HG THR 11 4.630 7.270 0.629
78 HG21 THR 11 3HG2 THR 11 3.774 4.933 0.056
79 HG22 THR 11 1HG2 THR 11 2.111 5.446 0.326
80 HG23 THR 11 2HG2 THR 11 2.825 4.200 1.350
81 H LEU 12 H LEU 12 2.992 5.992 5.241
82 HA LEU 12 HA LEU 12 3.360 8.833 5.902
83 HG LEU 12 HG LEU 12 0.928 7.106 6.663
84 HB2 LEU 12 2HB LEU 12 3.047 6.431 7.677
85 HB3 LEU 12 1HB LEU 12 3.291 8.065 8.247
86 HD11 LEU 12 1HD1 LEU 12 1.270 7.752 9.592
87 HD12 LEU 12 2HD1 LEU 12 0.914 6.167 8.897
88 HD13 LEU 12 3HD1 LEU 12 -0.280 7.465 8.814
89 HD21 LEU 12 3HD2 LEU 12 1.384 9.458 6.238
90 HD22 LEU 12 1HD2 LEU 12 1.505 9.770 7.972
91 HD23 LEU 12 2HD2 LEU 12 -0.040 9.301 7.265
92 H PHE 13 H PHE 13 5.129 5.989 5.386
93 HA PHE 13 HA PHE 13 7.555 7.307 6.345
94 HD1 PHE 13 1HD PHE 13 8.258 7.084 9.088
95 HD2 PHE 13 2HD PHE 13 5.030 4.412 8.351
96 HE1 PHE 13 1HE PHE 13 7.283 7.657 11.272
97 HE2 PHE 13 2HE PHE 13 4.051 4.981 10.532
98 HZ PHE 13 HZ PHE 13 5.178 6.607 11.996
99 HB2 PHE 13 2HB PHE 13 6.890 4.401 6.942
100 HB3 PHE 13 1HB PHE 13 8.374 5.230 7.369
101 HA PRO 14 HA PRO 14 8.931 5.569 2.429
102 HB2 PRO 14 2HB PRO 14 11.676 5.715 3.474
103 HB3 PRO 14 1HB PRO 14 10.965 6.593 2.117
104 HG2 PRO 14 2HG PRO 14 11.626 7.811 4.429
105 HG3 PRO 14 1HG PRO 14 10.239 8.328 3.452
106 HD2 PRO 14 2HD PRO 14 10.300 6.659 5.939
107 HD3 PRO 14 1HD PRO 14 9.179 7.958 5.460
108 H TYR 15 H TYR 15 9.444 3.534 1.769
109 HA TYR 15 HA TYR 15 10.594 1.682 3.685
110 HD1 TYR 15 2HD TYR 15 9.656 -0.196 5.289
111 HD2 TYR 15 1HD TYR 15 7.721 -0.871 1.569
112 HE1 TYR 15 2HE TYR 15 9.802 -2.611 5.658
113 HE2 TYR 15 1HE TYR 15 7.866 -3.296 1.928
114 HH TYR 15 HH TYR 15 9.167 -4.846 3.165
115 HB2 TYR 15 2HB TYR 15 8.199 1.558 4.090
116 HB3 TYR 15 1HB TYR 15 7.898 1.301 2.379
117 H THR 16 H THR 16 11.685 0.036 2.732
118 HA THR 16 HA THR 16 11.917 0.216 -0.160
119 HB THR 16 HB THR 16 13.852 -0.964 1.843
120 HG1 THR 16 1HG THR 16 14.810 0.994 1.891
121 HG21 THR 16 3HG2 THR 16 14.092 -1.791 -0.476
122 HG22 THR 16 1HG2 THR 16 15.460 -0.774 -0.021
123 HG23 THR 16 2HG2 THR 16 14.186 -0.128 -1.053
124 H GLY 17 H GLY 17 10.903 -1.373 -1.246
125 HA2 GLY 17 2HA GLY 17 9.921 -3.698 -0.021
126 HA3 GLY 17 1HA GLY 17 10.028 -3.378 -1.757
127 H THR 18 H THR 18 11.120 -5.422 0.615
128 HA THR 18 HA THR 18 13.838 -5.528 -0.104
129 HB THR 18 HB THR 18 12.187 -7.396 1.560
130 HG1 THR 18 1HG THR 18 12.165 -4.784 1.833
131 HG21 THR 18 3HG2 THR 18 14.509 -7.836 1.128
132 HG22 THR 18 1HG2 THR 18 14.215 -7.434 2.843
133 HG23 THR 18 2HG2 THR 18 14.876 -6.199 1.737
134 H ASN 19 H ASN 19 10.828 -6.756 -0.962
135 HA ASN 19 HA ASN 19 11.957 -8.866 -2.649
136 HB2 ASN 19 2HB ASN 19 9.168 -8.509 -1.513
137 HB3 ASN 19 1HB ASN 19 9.636 -9.775 -2.621
138 HD21 ASN 19 1HD2 ASN 19 8.495 -9.983 0.048
139 HD22 ASN 19 2HD2 ASN 19 9.605 -10.895 0.974
140 H GLU 20 H GLU 20 10.947 -8.855 -4.842
141 HA GLU 20 HA GLU 20 10.639 -6.172 -5.782
142 HB2 GLU 20 2HB GLU 20 10.201 -8.779 -7.207
143 HB3 GLU 20 1HB GLU 20 10.318 -7.206 -7.983
144 HG2 GLU 20 2HG GLU 20 12.627 -7.020 -7.194
145 HG3 GLU 20 1HG GLU 20 12.484 -8.615 -6.447
146 H ASP 21 H ASP 21 8.549 -8.790 -4.975
147 HA ASP 21 HA ASP 21 6.160 -7.524 -6.020
148 HB2 ASP 21 2HB ASP 21 4.970 -9.480 -5.058
149 HB3 ASP 21 1HB ASP 21 6.309 -9.959 -6.094
150 H GLU 22 H GLU 22 7.983 -6.657 -3.671
151 HA GLU 22 HA GLU 22 5.832 -5.955 -1.822
152 HB2 GLU 22 2HB GLU 22 7.693 -7.320 -0.885
153 HB3 GLU 22 1HB GLU 22 8.838 -6.086 -1.389
154 HG2 GLU 22 2HG GLU 22 7.804 -4.527 0.174
155 HG3 GLU 22 1HG GLU 22 6.647 -5.773 0.650
156 H LEU 23 H LEU 23 5.514 -3.754 -1.601
157 HA LEU 23 HA LEU 23 6.579 -2.243 -3.793
158 HG LEU 23 HG LEU 23 3.967 -2.481 -4.461
159 HB2 LEU 23 2HB LEU 23 4.301 -1.949 -1.986
160 HB3 LEU 23 1HB LEU 23 5.050 -0.445 -2.460
161 HD11 LEU 23 1HD1 LEU 23 2.198 -1.528 -3.090
162 HD12 LEU 23 2HD1 LEU 23 2.159 -0.909 -4.739
163 HD13 LEU 23 3HD1 LEU 23 2.804 0.090 -3.435
164 HD21 LEU 23 3HD2 LEU 23 5.781 -1.068 -5.330
165 HD22 LEU 23 1HD2 LEU 23 4.927 0.366 -4.753
166 HD23 LEU 23 2HD2 LEU 23 4.219 -0.631 -6.019
167 H THR 24 H THR 24 7.978 -0.734 -3.834
168 HA THR 24 HA THR 24 9.228 0.172 -1.359
169 HB THR 24 HB THR 24 10.004 0.516 -4.278
170 HG1 THR 24 1HG THR 24 11.376 -1.145 -3.932
171 HG21 THR 24 3HG2 THR 24 12.160 1.336 -3.433
172 HG22 THR 24 1HG2 THR 24 11.559 1.223 -1.778
173 HG23 THR 24 2HG2 THR 24 10.836 2.371 -2.898
174 H PHE 25 H PHE 25 8.555 2.077 -0.582
175 HA PHE 25 HA PHE 25 7.492 3.994 -2.454
176 HD1 PHE 25 1HD PHE 25 6.022 4.417 1.570
177 HD2 PHE 25 2HD PHE 25 5.483 0.909 -0.760
178 HE1 PHE 25 1HE PHE 25 5.549 3.137 3.611
179 HE2 PHE 25 2HE PHE 25 5.022 -0.376 1.261
180 HZ PHE 25 HZ PHE 25 5.040 0.731 3.461
181 HB2 PHE 25 2HB PHE 25 5.628 4.520 -0.840
182 HB3 PHE 25 1HB PHE 25 5.474 3.057 -1.793
183 H ARG 26 H ARG 26 7.332 6.078 -1.773
184 HA ARG 26 HA ARG 26 9.220 6.750 0.351
185 HE ARG 26 HE ARG 26 12.551 6.894 -3.043
186 HB2 ARG 26 2HB ARG 26 8.401 8.240 -2.151
187 HB3 ARG 26 1HB ARG 26 9.428 8.934 -0.904
188 HG2 ARG 26 2HG ARG 26 11.083 7.214 -1.258
189 HG3 ARG 26 1HG ARG 26 10.054 6.430 -2.449
190 HD2 ARG 26 2HD ARG 26 10.258 8.329 -3.920
191 HD3 ARG 26 1HD ARG 26 11.195 9.214 -2.710
192 HH11 ARG 26 1HH1 ARG 26 11.520 9.383 -5.355
193 HH12 ARG 26 2HH1 ARG 26 12.874 9.192 -6.366
194 HH21 ARG 26 1HH2 ARG 26 14.406 6.626 -4.448
195 HH22 ARG 26 2HH2 ARG 26 14.560 7.565 -5.851
196 H GLU 27 H GLU 27 8.576 9.020 1.293
197 HA GLU 27 HA GLU 27 5.971 8.554 2.431
198 HB2 GLU 27 2HB GLU 27 8.091 9.262 3.667
199 HB3 GLU 27 1HB GLU 27 7.884 10.841 2.945
200 HG2 GLU 27 2HG GLU 27 5.894 9.522 4.791
201 HG3 GLU 27 1HG GLU 27 7.132 10.650 5.308
202 H GLY 28 H GLY 28 4.142 9.562 1.876
203 HA2 GLY 28 2HA GLY 28 2.876 11.452 1.265
204 HA3 GLY 28 1HA GLY 28 4.286 12.111 0.454
205 H GLU 29 H GLU 29 3.440 8.787 -0.092
206 HA GLU 29 HA GLU 29 2.526 9.555 -2.755
207 HB2 GLU 29 2HB GLU 29 3.716 6.903 -1.878
208 HB3 GLU 29 1HB GLU 29 3.173 7.295 -3.499
209 HG2 GLU 29 2HG GLU 29 4.903 9.153 -3.467
210 HG3 GLU 29 1HG GLU 29 5.534 8.392 -2.012
211 H ILE 30 H ILE 30 0.594 8.853 -3.466
212 HA ILE 30 HA ILE 30 -1.129 7.572 -1.505
213 HB ILE 30 HB ILE 30 -1.779 8.941 -4.137
214 HG12 ILE 30 2HG1 ILE 30 -1.140 10.490 -2.328
215 HG13 ILE 30 1HG1 ILE 30 -2.833 10.669 -2.762
216 HG21 ILE 30 1HG2 ILE 30 -3.668 7.758 -2.131
217 HG22 ILE 30 2HG2 ILE 30 -3.338 7.129 -3.745
218 HG23 ILE 30 3HG2 ILE 30 -4.139 8.694 -3.554
219 HD11 ILE 30 3HD1 ILE 30 -1.744 9.242 -0.347
220 HD12 ILE 30 1HD1 ILE 30 -3.449 9.327 -0.794
221 HD13 ILE 30 2HD1 ILE 30 -2.575 10.796 -0.380
222 H ILE 31 H ILE 31 -1.705 5.551 -1.665
223 HA ILE 31 HA ILE 31 -0.858 4.005 -4.042
224 HB ILE 31 HB ILE 31 -1.301 3.031 -1.200
225 HG12 ILE 31 2HG1 ILE 31 1.288 3.448 -2.711
226 HG13 ILE 31 1HG1 ILE 31 0.729 4.378 -1.328
227 HG21 ILE 31 1HG2 ILE 31 -1.816 1.297 -2.809
228 HG22 ILE 31 2HG2 ILE 31 -0.321 0.903 -1.961
229 HG23 ILE 31 3HG2 ILE 31 -0.260 1.533 -3.606
230 HD11 ILE 31 3HD1 ILE 31 2.441 2.772 -0.681
231 HD12 ILE 31 1HD1 ILE 31 1.455 1.452 -1.308
232 HD13 ILE 31 2HD1 ILE 31 0.900 2.383 0.082
233 H HIS 32 H HIS 32 -2.433 2.870 -5.115
234 HA HIS 32 HA HIS 32 -5.115 3.042 -4.030
235 HD1 HIS 32 1HD HIS 32 -5.947 0.557 -7.804
236 HD2 HIS 32 2HD HIS 32 -7.525 3.228 -5.047
237 HE1 HIS 32 1HE HIS 32 -8.446 0.162 -7.780
238 HB2 HIS 32 2HB HIS 32 -4.788 3.566 -6.451
239 HB3 HIS 32 1HB HIS 32 -4.173 1.933 -6.694
240 H LEU 33 H LEU 33 -5.491 1.602 -2.622
241 HA LEU 33 HA LEU 33 -4.047 -0.818 -2.365
242 HG LEU 33 HG LEU 33 -4.736 -1.981 0.066
243 HB2 LEU 33 2HB LEU 33 -4.790 0.467 -0.464
244 HB3 LEU 33 1HB LEU 33 -6.451 0.328 -0.917
245 HD11 LEU 33 1HD1 LEU 33 -5.926 -1.650 2.142
246 HD12 LEU 33 2HD1 LEU 33 -6.787 -0.276 1.451
247 HD13 LEU 33 3HD1 LEU 33 -5.045 -0.191 1.704
248 HD21 LEU 33 3HD2 LEU 33 -6.757 -3.187 0.290
249 HD22 LEU 33 1HD2 LEU 33 -6.762 -2.546 -1.341
250 HD23 LEU 33 2HD2 LEU 33 -7.749 -1.769 -0.095
251 H ILE 34 H ILE 34 -4.519 -2.732 -3.065
252 HA ILE 34 HA ILE 34 -6.827 -3.048 -4.825
253 HB ILE 34 HB ILE 34 -4.235 -4.612 -4.638
254 HG12 ILE 34 2HG1 ILE 34 -3.895 -2.385 -5.598
255 HG13 ILE 34 1HG1 ILE 34 -3.691 -3.623 -6.827
256 HG21 ILE 34 1HG2 ILE 34 -4.910 -5.740 -6.691
257 HG22 ILE 34 2HG2 ILE 34 -6.480 -4.938 -6.615
258 HG23 ILE 34 3HG2 ILE 34 -6.015 -6.085 -5.356
259 HD11 ILE 34 3HD1 ILE 34 -4.881 -1.717 -7.717
260 HD12 ILE 34 1HD1 ILE 34 -6.103 -1.852 -6.454
261 HD13 ILE 34 2HD1 ILE 34 -5.950 -3.117 -7.669
262 H SER 35 H SER 35 -5.169 -4.534 -2.050
263 HA SER 35 HA SER 35 -7.620 -5.986 -1.463
264 HG SER 35 HG SER 35 -6.997 -6.896 -3.486
265 HB2 SER 35 2HB SER 35 -4.970 -7.421 -1.775
266 HB3 SER 35 1HB SER 35 -6.480 -8.148 -1.243
267 H LYS 36 H LYS 36 -8.058 -5.642 0.641
268 HA LYS 36 HA LYS 36 -5.968 -4.918 2.471
269 HB2 LYS 36 2HB LYS 36 -8.950 -5.005 2.632
270 HB3 LYS 36 1HB LYS 36 -8.043 -5.016 4.144
271 HG2 LYS 36 2HG LYS 36 -7.021 -2.970 3.625
272 HG3 LYS 36 1HG LYS 36 -7.629 -2.919 1.998
273 HD2 LYS 36 2HD LYS 36 -9.226 -2.675 4.543
274 HD3 LYS 36 1HD LYS 36 -8.843 -1.377 3.413
275 HE2 LYS 36 2HE LYS 36 -10.069 -2.763 1.663
276 HE3 LYS 36 1HE LYS 36 -10.650 -3.732 3.018
277 HZ1 LYS 36 3HZ LYS 36 -12.294 -2.068 2.519
278 HZ2 LYS 36 1HZ LYS 36 -11.142 -0.847 2.528
279 HZ3 LYS 36 2HZ LYS 36 -11.556 -1.595 3.965
280 H GLU 37 H GLU 37 -6.980 -7.790 1.356
281 HA GLU 37 HA GLU 37 -5.643 -9.034 3.586
282 HB2 GLU 37 2HB GLU 37 -7.151 -11.033 3.360
283 HB3 GLU 37 1HB GLU 37 -7.905 -9.612 4.062
284 HG2 GLU 37 2HG GLU 37 -9.042 -9.139 2.026
285 HG3 GLU 37 1HG GLU 37 -8.155 -10.403 1.180
286 H THR 38 H THR 38 -3.998 -10.115 2.964
287 HA THR 38 HA THR 38 -3.781 -10.964 0.162
288 HB THR 38 HB THR 38 -1.298 -10.963 0.832
289 HG1 THR 38 1HG THR 38 -1.771 -9.064 2.772
290 HG21 THR 38 3HG2 THR 38 -1.118 -8.518 0.516
291 HG22 THR 38 1HG2 THR 38 -2.842 -8.357 0.846
292 HG23 THR 38 2HG2 THR 38 -2.303 -9.221 -0.591
293 H GLY 39 H GLY 39 -4.986 -12.281 2.617
294 HA2 GLY 39 2HA GLY 39 -5.045 -14.581 3.229
295 HA3 GLY 39 1HA GLY 39 -3.372 -14.736 2.669
296 H GLU 40 H GLU 40 -3.073 -11.995 3.971
297 HA GLU 40 HA GLU 40 -2.934 -12.787 6.759
298 HB2 GLU 40 2HB GLU 40 -0.662 -12.927 5.732
299 HB3 GLU 40 1HB GLU 40 -0.817 -11.255 5.216
300 HG2 GLU 40 2HG GLU 40 0.566 -11.476 7.211
301 HG3 GLU 40 1HG GLU 40 -0.890 -10.532 7.529
302 H ALA 41 H ALA 41 -3.238 -11.087 8.156
303 HA ALA 41 HA ALA 41 -4.340 -8.642 6.974
304 HB1 ALA 41 1HB ALA 41 -5.488 -8.329 9.138
305 HB2 ALA 41 2HB ALA 41 -4.783 -9.832 9.725
306 HB3 ALA 41 3HB ALA 41 -5.940 -9.863 8.394
307 H GLY 42 H GLY 42 -2.741 -7.248 6.863
308 HA2 GLY 42 2HA GLY 42 -1.468 -5.847 8.679
309 HA3 GLY 42 1HA GLY 42 -0.553 -7.356 8.786
310 H TRP 43 H TRP 43 -0.996 -7.966 6.012
311 HA TRP 43 HA TRP 43 0.677 -5.924 4.791
312 HD1 TRP 43 HD TRP 43 1.756 -9.309 6.629
313 HE1 TRP 43 1HE TRP 43 4.211 -8.968 7.349
314 HE3 TRP 43 3HE TRP 43 3.324 -6.307 2.798
315 HZ2 TRP 43 2HZ TRP 43 6.501 -7.619 6.407
316 HZ3 TRP 43 3HZ TRP 43 5.657 -5.538 2.777
317 HH2 TRP 43 HH TRP 43 7.213 -6.179 4.546
318 HB2 TRP 43 2HB TRP 43 0.526 -8.897 4.267
319 HB3 TRP 43 1HB TRP 43 1.292 -7.773 3.148
320 H TRP 44 H TRP 44 -0.237 -4.803 3.330
321 HA TRP 44 HA TRP 44 -2.773 -5.730 2.199
322 HD1 TRP 44 HD TRP 44 -3.933 -5.638 4.040
323 HE1 TRP 44 1HE TRP 44 -5.576 -4.634 5.761
324 HE3 TRP 44 3HE TRP 44 -3.024 -0.685 3.253
325 HZ2 TRP 44 2HZ TRP 44 -6.362 -2.107 6.661
326 HZ3 TRP 44 3HZ TRP 44 -4.257 0.962 4.561
327 HH2 TRP 44 HH TRP 44 -5.914 0.258 6.240
328 HB2 TRP 44 2HB TRP 44 -1.663 -2.999 2.764
329 HB3 TRP 44 1HB TRP 44 -2.965 -3.238 1.615
330 H LYS 45 H LYS 45 -3.068 -5.516 0.029
331 HA LYS 45 HA LYS 45 -0.582 -5.156 -1.471
332 HB2 LYS 45 2HB LYS 45 -1.618 -7.383 -1.781
333 HB3 LYS 45 1HB LYS 45 -3.114 -6.610 -2.291
334 HG2 LYS 45 2HG LYS 45 -2.002 -5.673 -4.231
335 HG3 LYS 45 1HG LYS 45 -0.475 -6.379 -3.715
336 HD2 LYS 45 2HD LYS 45 -1.405 -8.615 -3.995
337 HD3 LYS 45 1HD LYS 45 -2.962 -7.916 -4.466
338 HE2 LYS 45 2HE LYS 45 -1.901 -6.812 -6.356
339 HE3 LYS 45 1HE LYS 45 -0.345 -7.492 -5.895
340 HZ1 LYS 45 3HZ LYS 45 -1.497 -8.576 -7.705
341 HZ2 LYS 45 1HZ LYS 45 -2.721 -9.086 -6.680
342 HZ3 LYS 45 2HZ LYS 45 -1.138 -9.669 -6.443
343 H GLY 46 H GLY 46 -0.451 -3.532 -2.831
344 HA2 GLY 46 2HA GLY 46 -2.862 -2.194 -3.709
345 HA3 GLY 46 1HA GLY 46 -1.736 -1.245 -2.747
346 H GLU 47 H GLU 47 -2.357 -0.532 -5.267
347 HA GLU 47 HA GLU 47 0.038 -1.244 -6.753
348 HB2 GLU 47 2HB GLU 47 -2.087 -1.841 -7.868
349 HB3 GLU 47 1HB GLU 47 -2.631 -0.188 -7.714
350 HG2 GLU 47 2HG GLU 47 -0.144 -0.809 -9.247
351 HG3 GLU 47 1HG GLU 47 -1.726 -1.059 -9.979
352 H LEU 48 H LEU 48 1.482 0.169 -6.865
353 HA LEU 48 HA LEU 48 0.836 3.002 -6.705
354 HG LEU 48 HG LEU 48 3.790 3.774 -5.977
355 HB2 LEU 48 2HB LEU 48 1.580 2.372 -4.482
356 HB3 LEU 48 1HB LEU 48 2.984 1.569 -5.148
357 HD11 LEU 48 1HD1 LEU 48 1.558 4.897 -4.298
358 HD12 LEU 48 2HD1 LEU 48 1.684 4.959 -6.052
359 HD13 LEU 48 3HD1 LEU 48 2.857 5.815 -5.060
360 HD21 LEU 48 3HD2 LEU 48 4.555 4.567 -3.798
361 HD22 LEU 48 1HD2 LEU 48 4.667 2.813 -3.935
362 HD23 LEU 48 2HD2 LEU 48 3.359 3.543 -3.004
363 H ASN 49 H ASN 49 1.555 3.848 -8.469
364 HA ASN 49 HA ASN 49 2.885 4.514 -10.158
365 HB2 ASN 49 2HB ASN 49 5.084 3.138 -8.578
366 HB3 ASN 49 1HB ASN 49 5.346 4.195 -9.959
367 HD21 ASN 49 1HD2 ASN 49 6.218 4.451 -7.167
368 HD22 ASN 49 2HD2 ASN 49 5.650 5.959 -6.594
369 H GLY 50 H GLY 50 1.557 1.809 -10.107
370 HA2 GLY 50 2HA GLY 50 1.295 0.637 -12.138
371 HA3 GLY 50 1HA GLY 50 3.015 0.810 -12.437
372 H LYS 51 H LYS 51 3.336 0.071 -9.379
373 HA LYS 51 HA LYS 51 3.321 -2.756 -10.030
374 HB2 LYS 51 2HB LYS 51 5.039 -1.148 -8.172
375 HB3 LYS 51 1HB LYS 51 4.849 -2.878 -7.943
376 HG2 LYS 51 2HG LYS 51 6.849 -2.545 -9.136
377 HG3 LYS 51 1HG LYS 51 5.686 -3.203 -10.264
378 HD2 LYS 51 2HD LYS 51 5.278 -0.935 -11.158
379 HD3 LYS 51 1HD LYS 51 6.486 -0.295 -10.043
380 HE2 LYS 51 2HE LYS 51 7.466 -0.611 -12.249
381 HE3 LYS 51 1HE LYS 51 8.195 -1.721 -11.093
382 HZ1 LYS 51 3HZ LYS 51 6.770 -3.483 -11.941
383 HZ2 LYS 51 1HZ LYS 51 7.694 -2.830 -13.176
384 HZ3 LYS 51 2HZ LYS 51 6.065 -2.432 -13.036
385 H GLU 52 H GLU 52 2.062 -4.051 -9.088
386 HA GLU 52 HA GLU 52 0.696 -3.132 -6.696
387 HB2 GLU 52 2HB GLU 52 -0.944 -4.978 -7.136
388 HB3 GLU 52 1HB GLU 52 -0.973 -3.685 -8.322
389 HG2 GLU 52 2HG GLU 52 0.151 -5.041 -9.933
390 HG3 GLU 52 1HG GLU 52 0.494 -6.283 -8.734
391 H GLY 53 H GLY 53 1.737 -3.611 -5.082
392 HA2 GLY 53 2HA GLY 53 2.723 -6.355 -4.752
393 HA3 GLY 53 1HA GLY 53 3.765 -4.983 -4.376
394 H VAL 54 H VAL 54 3.798 -5.983 -2.239
395 HA VAL 54 HA VAL 54 1.377 -5.293 -0.742
396 HB VAL 54 HB VAL 54 2.089 -6.953 0.980
397 HG11 VAL 54 1HG1 VAL 54 1.440 -8.952 -0.277
398 HG12 VAL 54 2HG1 VAL 54 1.710 -8.077 -1.786
399 HG13 VAL 54 3HG1 VAL 54 0.433 -7.564 -0.690
400 HG21 VAL 54 3HG2 VAL 54 4.484 -7.026 0.482
401 HG22 VAL 54 1HG2 VAL 54 4.145 -7.759 -1.086
402 HG23 VAL 54 2HG2 VAL 54 3.781 -8.643 0.396
403 H PHE 55 H PHE 55 1.582 -4.400 1.274
404 HA PHE 55 HA PHE 55 4.154 -3.350 2.070
405 HD1 PHE 55 2HD PHE 55 1.144 -2.133 -0.607
406 HD2 PHE 55 1HD PHE 55 1.307 -0.397 3.275
407 HE1 PHE 55 2HE PHE 55 -1.198 -1.421 -0.824
408 HE2 PHE 55 1HE PHE 55 -1.030 0.322 3.055
409 HZ PHE 55 HZ PHE 55 -2.288 -0.189 1.003
410 HB2 PHE 55 2HB PHE 55 3.326 -1.023 2.122
411 HB3 PHE 55 1HB PHE 55 3.279 -1.698 0.491
412 HA PRO 56 HA PRO 56 2.384 -3.988 6.138
413 HB2 PRO 56 2HB PRO 56 3.576 -1.460 7.048
414 HB3 PRO 56 1HB PRO 56 3.873 -3.080 7.634
415 HG2 PRO 56 2HG PRO 56 5.725 -1.793 6.167
416 HG3 PRO 56 1HG PRO 56 5.480 -3.542 6.017
417 HD2 PRO 56 2HD PRO 56 4.566 -1.336 4.212
418 HD3 PRO 56 1HD PRO 56 5.195 -2.948 3.807
419 H ASP 57 H ASP 57 0.501 -3.507 6.964
420 HA ASP 57 HA ASP 57 -1.223 -1.629 5.811
421 HB2 ASP 57 2HB ASP 57 -2.877 -2.445 7.323
422 HB3 ASP 57 1HB ASP 57 -1.857 -3.801 6.889
423 H ASN 58 H ASN 58 1.056 -1.165 8.302
424 HA ASN 58 HA ASN 58 -0.403 1.129 9.379
425 HB2 ASN 58 2HB ASN 58 1.134 1.089 11.254
426 HB3 ASN 58 1HB ASN 58 0.491 -0.531 10.967
427 HD21 ASN 58 1HD2 ASN 58 2.973 0.521 12.275
428 HD22 ASN 58 2HD2 ASN 58 4.232 -0.383 11.531
429 H PHE 59 H PHE 59 2.041 0.460 7.132
430 HA PHE 59 HA PHE 59 3.544 2.879 7.631
431 HD1 PHE 59 1HD PHE 59 4.394 0.064 8.350
432 HD2 PHE 59 2HD PHE 59 6.746 2.380 5.671
433 HE1 PHE 59 1HE PHE 59 6.401 -0.438 9.681
434 HE2 PHE 59 2HE PHE 59 8.757 1.883 6.999
435 HZ PHE 59 HZ PHE 59 8.585 0.471 9.007
436 HB2 PHE 59 2HB PHE 59 3.824 0.624 5.717
437 HB3 PHE 59 1HB PHE 59 4.519 2.169 5.249
438 H ALA 60 H ALA 60 0.693 2.266 6.211
439 HA ALA 60 HA ALA 60 0.774 4.826 4.853
440 HB1 ALA 60 1HB ALA 60 -0.458 2.311 3.712
441 HB2 ALA 60 2HB ALA 60 0.994 3.107 3.108
442 HB3 ALA 60 3HB ALA 60 -0.565 3.923 3.002
443 H VAL 61 H VAL 61 -1.059 5.970 5.171
444 HA VAL 61 HA VAL 61 -3.009 4.753 6.979
445 HB VAL 61 HB VAL 61 -1.914 6.750 7.890
446 HG11 VAL 61 1HG1 VAL 61 -3.077 8.247 5.550
447 HG12 VAL 61 2HG1 VAL 61 -1.368 7.939 5.854
448 HG13 VAL 61 3HG1 VAL 61 -2.283 8.985 6.941
449 HG21 VAL 61 3HG2 VAL 61 -4.809 7.249 7.220
450 HG22 VAL 61 1HG2 VAL 61 -3.908 8.049 8.506
451 HG23 VAL 61 2HG2 VAL 61 -4.196 6.311 8.581
452 H GLN 62 H GLN 62 -4.969 4.321 6.245
453 HA GLN 62 HA GLN 62 -5.596 5.062 3.567
454 HB2 GLN 62 2HB GLN 62 -6.232 2.848 4.250
455 HB3 GLN 62 1HB GLN 62 -7.191 3.488 5.582
456 HG2 GLN 62 2HG GLN 62 -8.784 4.417 4.116
457 HG3 GLN 62 1HG GLN 62 -7.758 4.145 2.715
458 HE21 GLN 62 1HE2 GLN 62 -9.404 3.106 1.744
459 HE22 GLN 62 2HE2 GLN 62 -9.857 1.476 2.101
460 H ILE 63 H ILE 63 -6.351 6.868 3.024
461 HA ILE 63 HA ILE 63 -7.779 8.483 4.939
462 HB ILE 63 HB ILE 63 -7.772 10.260 3.156
463 HG12 ILE 63 2HG1 ILE 63 -6.044 8.299 1.595
464 HG13 ILE 63 1HG1 ILE 63 -7.684 8.757 1.164
465 HG21 ILE 63 1HG2 ILE 63 -6.027 10.199 4.830
466 HG22 ILE 63 2HG2 ILE 63 -5.375 10.745 3.288
467 HG23 ILE 63 3HG2 ILE 63 -5.080 9.095 3.834
468 HD11 ILE 63 3HD1 ILE 63 -5.299 10.596 1.251
469 HD12 ILE 63 1HD1 ILE 63 -6.939 11.059 0.804
470 HD13 ILE 63 2HD1 ILE 63 -6.045 9.922 -0.200
471 H SER 64 H SER 64 -8.371 7.017 1.734
472 HA SER 64 HA SER 64 -11.004 6.374 2.352
473 HG SER 64 HG SER 64 -11.076 8.786 2.742
474 HB2 SER 64 2HB SER 64 -10.345 8.476 0.275
475 HB3 SER 64 1HB SER 64 -11.874 7.609 0.403
Start of MODEL 5
1 H1 GLY 1 1HT GLY 1 -12.404 -9.800 1.377
2 H2 GLY 1 2HT GLY 1 -13.379 -10.743 0.350
3 H3 GLY 1 3HT GLY 1 -14.022 -9.374 1.131
4 HA2 GLY 1 1HA GLY 1 -11.823 -9.276 -0.812
5 HA3 GLY 1 2HA GLY 1 -13.514 -8.972 -1.208
6 H ALA 2 H ALA 2 -11.486 -7.069 -1.550
7 HA ALA 2 HA ALA 2 -11.892 -5.183 0.621
8 HB1 ALA 2 1HB ALA 2 -10.335 -3.725 -0.655
9 HB2 ALA 2 2HB ALA 2 -10.232 -4.963 -1.912
10 HB3 ALA 2 3HB ALA 2 -9.634 -5.296 -0.283
11 H MET 3 H MET 3 -13.748 -4.242 0.571
12 HA MET 3 HA MET 3 -15.075 -3.795 -1.983
13 HB2 MET 3 2HB MET 3 -16.190 -3.572 0.812
14 HB3 MET 3 1HB MET 3 -17.113 -3.468 -0.681
15 HG2 MET 3 2HG MET 3 -15.662 -5.868 0.390
16 HG3 MET 3 1HG MET 3 -17.406 -5.638 0.286
17 HE1 MET 3 3HE MET 3 -17.739 -4.357 -2.660
18 HE2 MET 3 1HE MET 3 -18.765 -5.639 -2.007
19 HE3 MET 3 2HE MET 3 -18.017 -5.826 -3.590
20 H GLY 4 H GLY 4 -15.178 -1.897 -2.828
21 HA2 GLY 4 2HA GLY 4 -15.558 0.542 -2.084
22 HA3 GLY 4 1HA GLY 4 -13.931 0.319 -1.424
23 H ALA 5 H ALA 5 -13.200 -1.574 -3.432
24 HA ALA 5 HA ALA 5 -12.231 -1.831 -5.422
25 HB1 ALA 5 1HB ALA 5 -13.172 -0.834 -7.431
26 HB2 ALA 5 2HB ALA 5 -14.058 0.342 -6.453
27 HB3 ALA 5 3HB ALA 5 -14.468 -1.371 -6.357
28 H LYS 6 H LYS 6 -12.735 1.589 -5.125
29 HA LYS 6 HA LYS 6 -9.869 1.935 -5.586
30 HB2 LYS 6 2HB LYS 6 -12.114 3.842 -6.223
31 HB3 LYS 6 1HB LYS 6 -10.418 4.299 -6.255
32 HG2 LYS 6 2HG LYS 6 -11.685 2.168 -7.973
33 HG3 LYS 6 1HG LYS 6 -11.293 3.825 -8.453
34 HD2 LYS 6 2HD LYS 6 -8.932 3.421 -8.102
35 HD3 LYS 6 1HD LYS 6 -9.270 1.801 -7.496
36 HE2 LYS 6 2HE LYS 6 -8.495 1.691 -9.791
37 HE3 LYS 6 1HE LYS 6 -10.172 1.170 -9.671
38 HZ1 LYS 6 3HZ LYS 6 -10.828 3.392 -10.475
39 HZ2 LYS 6 1HZ LYS 6 -9.871 2.566 -11.571
40 HZ3 LYS 6 2HZ LYS 6 -9.213 3.803 -10.673
41 H GLU 7 H GLU 7 -9.135 1.846 -3.708
42 HA GLU 7 HA GLU 7 -10.067 3.789 -1.721
43 HB2 GLU 7 2HB GLU 7 -8.850 1.050 -1.202
44 HB3 GLU 7 1HB GLU 7 -9.258 2.221 0.039
45 HG2 GLU 7 2HG GLU 7 -11.646 2.022 -0.667
46 HG3 GLU 7 1HG GLU 7 -11.162 0.743 -1.774
47 H TYR 8 H TYR 8 -8.412 4.948 -0.705
48 HA TYR 8 HA TYR 8 -5.814 4.635 -2.078
49 HD1 TYR 8 1HD TYR 8 -9.247 6.728 -2.507
50 HD2 TYR 8 2HD TYR 8 -5.550 6.628 -4.606
51 HE1 TYR 8 1HE TYR 8 -10.468 6.749 -4.634
52 HE2 TYR 8 2HE TYR 8 -6.771 6.646 -6.746
53 HH TYR 8 HH TYR 8 -10.152 7.278 -6.922
54 HB2 TYR 8 2HB TYR 8 -6.973 7.340 -1.378
55 HB3 TYR 8 1HB TYR 8 -5.544 6.984 -2.286
56 H CYS 9 H CYS 9 -4.064 4.860 -0.889
57 HA CYS 9 HA CYS 9 -4.411 5.608 1.934
58 HG CYS 9 HG CYS 9 -5.787 3.181 1.113
59 HB2 CYS 9 2HB CYS 9 -2.664 3.380 0.875
60 HB3 CYS 9 1HB CYS 9 -2.898 3.824 2.564
61 H ARG 10 H ARG 10 -2.860 6.940 2.723
62 HA ARG 10 HA ARG 10 -0.729 7.664 0.846
63 HE ARG 10 HE ARG 10 1.896 11.324 3.442
64 HB2 ARG 10 2HB ARG 10 -1.995 9.637 1.589
65 HB3 ARG 10 1HB ARG 10 -1.731 9.192 3.276
66 HG2 ARG 10 2HG ARG 10 0.705 9.412 2.932
67 HG3 ARG 10 1HG ARG 10 0.406 9.936 1.289
68 HD2 ARG 10 2HD ARG 10 -0.642 11.941 2.072
69 HD3 ARG 10 1HD ARG 10 -0.591 11.363 3.744
70 HH11 ARG 10 1HH1 ARG 10 -0.075 13.663 1.624
71 HH12 ARG 10 2HH1 ARG 10 1.185 14.775 1.455
72 HH21 ARG 10 1HH2 ARG 10 3.609 12.848 3.192
73 HH22 ARG 10 2HH2 ARG 10 3.317 14.330 2.380
74 H THR 11 H THR 11 1.330 7.326 1.366
75 HA THR 11 HA THR 11 1.928 5.618 3.528
76 HB THR 11 HB THR 11 4.267 5.928 2.716
77 HG1 THR 11 1HG THR 11 4.611 7.211 0.967
78 HG21 THR 11 3HG2 THR 11 2.201 5.441 0.578
79 HG22 THR 11 1HG2 THR 11 2.795 4.245 1.729
80 HG23 THR 11 2HG2 THR 11 3.888 4.926 0.526
81 H LEU 12 H LEU 12 2.691 6.137 5.504
82 HA LEU 12 HA LEU 12 2.945 8.991 6.151
83 HG LEU 12 HG LEU 12 0.534 7.142 6.900
84 HB2 LEU 12 2HB LEU 12 2.696 6.564 7.925
85 HB3 LEU 12 1HB LEU 12 2.859 8.207 8.504
86 HD11 LEU 12 1HD1 LEU 12 0.797 7.844 9.817
87 HD12 LEU 12 2HD1 LEU 12 0.600 6.221 9.145
88 HD13 LEU 12 3HD1 LEU 12 -0.702 7.406 9.002
89 HD21 LEU 12 3HD2 LEU 12 0.978 9.815 8.226
90 HD22 LEU 12 1HD2 LEU 12 -0.520 9.285 7.464
91 HD23 LEU 12 2HD2 LEU 12 0.928 9.519 6.487
92 H PHE 13 H PHE 13 4.709 6.154 5.617
93 HA PHE 13 HA PHE 13 7.182 7.476 6.333
94 HD1 PHE 13 1HD PHE 13 8.317 7.495 8.750
95 HD2 PHE 13 2HD PHE 13 4.835 5.081 9.000
96 HE1 PHE 13 1HE PHE 13 7.749 8.553 10.888
97 HE2 PHE 13 2HE PHE 13 4.259 6.131 11.142
98 HZ PHE 13 HZ PHE 13 5.728 7.880 12.082
99 HB2 PHE 13 2HB PHE 13 6.367 4.723 7.312
100 HB3 PHE 13 1HB PHE 13 8.009 5.359 7.418
101 HA PRO 14 HA PRO 14 8.148 5.375 2.548
102 HB2 PRO 14 2HB PRO 14 10.825 5.596 2.509
103 HB3 PRO 14 1HB PRO 14 9.786 7.010 2.313
104 HG2 PRO 14 2HG PRO 14 11.272 6.079 4.722
105 HG3 PRO 14 1HG PRO 14 11.041 7.731 4.120
106 HD2 PRO 14 2HD PRO 14 9.583 6.567 6.165
107 HD3 PRO 14 1HD PRO 14 9.034 7.945 5.193
108 H TYR 15 H TYR 15 9.033 3.378 1.814
109 HA TYR 15 HA TYR 15 10.297 1.638 3.732
110 HD1 TYR 15 1HD TYR 15 9.553 -0.425 5.358
111 HD2 TYR 15 2HD TYR 15 7.431 -1.037 1.725
112 HE1 TYR 15 1HE TYR 15 9.797 -2.855 5.628
113 HE2 TYR 15 2HE TYR 15 7.672 -3.463 1.984
114 HH TYR 15 HH TYR 15 9.200 -5.015 3.123
115 HB2 TYR 15 2HB TYR 15 7.961 1.318 4.309
116 HB3 TYR 15 1HB TYR 15 7.539 1.100 2.620
117 H THR 16 H THR 16 11.577 0.197 2.720
118 HA THR 16 HA THR 16 11.511 0.198 -0.187
119 HB THR 16 HB THR 16 13.711 -0.717 1.690
120 HG1 THR 16 1HG THR 16 12.872 1.742 1.092
121 HG21 THR 16 3HG2 THR 16 15.135 -0.522 -0.305
122 HG22 THR 16 1HG2 THR 16 13.739 -0.032 -1.266
123 HG23 THR 16 2HG2 THR 16 13.817 -1.660 -0.590
124 H GLY 17 H GLY 17 10.880 -1.639 -1.189
125 HA2 GLY 17 2HA GLY 17 10.188 -3.917 0.420
126 HA3 GLY 17 1HA GLY 17 9.933 -3.715 -1.315
127 H THR 18 H THR 18 11.283 -5.805 0.468
128 HA THR 18 HA THR 18 13.988 -5.689 -0.602
129 HB THR 18 HB THR 18 13.616 -6.366 1.784
130 HG1 THR 18 1HG THR 18 14.941 -8.235 1.710
131 HG21 THR 18 3HG2 THR 18 12.300 -8.796 0.563
132 HG22 THR 18 1HG2 THR 18 11.512 -7.572 1.552
133 HG23 THR 18 2HG2 THR 18 12.726 -8.635 2.265
134 H ASN 19 H ASN 19 11.002 -6.836 -1.344
135 HA ASN 19 HA ASN 19 12.027 -8.839 -3.223
136 HB2 ASN 19 2HB ASN 19 9.307 -8.613 -1.926
137 HB3 ASN 19 1HB ASN 19 9.711 -9.757 -3.181
138 HD21 ASN 19 1HD2 ASN 19 8.729 -10.285 -0.534
139 HD22 ASN 19 2HD2 ASN 19 9.915 -11.251 0.247
140 H GLU 20 H GLU 20 10.958 -8.795 -5.286
141 HA GLU 20 HA GLU 20 10.477 -6.215 -6.330
142 HB2 GLU 20 2HB GLU 20 9.761 -7.422 -8.366
143 HB3 GLU 20 1HB GLU 20 11.289 -8.016 -7.728
144 HG2 GLU 20 2HG GLU 20 10.259 -9.960 -6.834
145 HG3 GLU 20 1HG GLU 20 8.650 -9.321 -7.151
146 H ASP 21 H ASP 21 8.438 -8.675 -5.051
147 HA ASP 21 HA ASP 21 5.967 -7.377 -5.801
148 HB2 ASP 21 2HB ASP 21 4.950 -9.419 -4.814
149 HB3 ASP 21 1HB ASP 21 6.079 -9.754 -6.114
150 H GLU 22 H GLU 22 8.072 -6.629 -3.636
151 HA GLU 22 HA GLU 22 6.098 -6.067 -1.551
152 HB2 GLU 22 2HB GLU 22 8.075 -7.499 -0.868
153 HB3 GLU 22 1HB GLU 22 9.129 -6.151 -1.278
154 HG2 GLU 22 2HG GLU 22 8.081 -4.820 0.457
155 HG3 GLU 22 1HG GLU 22 6.991 -6.155 0.838
156 H LEU 23 H LEU 23 5.528 -4.021 -1.589
157 HA LEU 23 HA LEU 23 6.449 -2.456 -3.786
158 HG LEU 23 HG LEU 23 4.238 -1.587 -4.750
159 HB2 LEU 23 2HB LEU 23 4.088 -2.763 -2.623
160 HB3 LEU 23 1HB LEU 23 4.594 -1.329 -1.757
161 HD11 LEU 23 1HD1 LEU 23 2.147 -1.556 -3.560
162 HD12 LEU 23 2HD1 LEU 23 2.379 -0.043 -4.434
163 HD13 LEU 23 3HD1 LEU 23 2.633 -0.102 -2.688
164 HD21 LEU 23 3HD2 LEU 23 4.912 0.884 -3.150
165 HD22 LEU 23 1HD2 LEU 23 4.668 0.795 -4.892
166 HD23 LEU 23 2HD2 LEU 23 6.053 -0.005 -4.157
167 H THR 24 H THR 24 8.090 -1.118 -3.794
168 HA THR 24 HA THR 24 9.133 0.063 -1.356
169 HB THR 24 HB THR 24 10.032 0.176 -4.248
170 HG1 THR 24 1HG THR 24 11.200 -1.508 -3.772
171 HG21 THR 24 3HG2 THR 24 11.400 1.274 -1.770
172 HG22 THR 24 1HG2 THR 24 10.759 2.195 -3.121
173 HG23 THR 24 2HG2 THR 24 12.155 1.139 -3.355
174 H PHE 25 H PHE 25 8.408 1.981 -0.704
175 HA PHE 25 HA PHE 25 7.558 3.914 -2.689
176 HD1 PHE 25 2HD PHE 25 6.360 4.378 1.274
177 HD2 PHE 25 1HD PHE 25 4.882 1.142 -1.046
178 HE1 PHE 25 2HE PHE 25 5.769 3.174 3.331
179 HE2 PHE 25 1HE PHE 25 4.294 -0.056 0.971
180 HZ PHE 25 HZ PHE 25 4.730 0.941 3.185
181 HB2 PHE 25 2HB PHE 25 5.634 4.578 -1.192
182 HB3 PHE 25 1HB PHE 25 5.460 3.092 -2.106
183 H ARG 26 H ARG 26 7.338 6.071 -1.919
184 HA ARG 26 HA ARG 26 9.212 6.668 0.242
185 HE ARG 26 HE ARG 26 11.363 8.942 -0.241
186 HB2 ARG 26 2HB ARG 26 8.231 8.357 -2.067
187 HB3 ARG 26 1HB ARG 26 9.257 8.974 -0.793
188 HG2 ARG 26 2HG ARG 26 9.935 6.896 -2.863
189 HG3 ARG 26 1HG ARG 26 10.608 8.518 -2.706
190 HD2 ARG 26 2HD ARG 26 10.983 6.197 -0.813
191 HD3 ARG 26 1HD ARG 26 12.196 6.885 -1.880
192 HH11 ARG 26 1HH1 ARG 26 12.928 5.800 0.163
193 HH12 ARG 26 2HH1 ARG 26 13.752 6.212 1.593
194 HH21 ARG 26 1HH2 ARG 26 12.479 9.526 1.782
195 HH22 ARG 26 2HH2 ARG 26 13.486 8.399 2.537
196 H GLU 27 H GLU 27 8.493 8.934 1.280
197 HA GLU 27 HA GLU 27 5.829 8.406 2.299
198 HB2 GLU 27 2HB GLU 27 7.763 8.825 3.822
199 HB3 GLU 27 1HB GLU 27 7.901 10.443 3.176
200 HG2 GLU 27 2HG GLU 27 5.433 9.449 4.587
201 HG3 GLU 27 1HG GLU 27 6.784 10.178 5.438
202 H GLY 28 H GLY 28 4.124 9.453 1.640
203 HA2 GLY 28 2HA GLY 28 3.068 11.577 1.086
204 HA3 GLY 28 1HA GLY 28 4.504 11.966 0.142
205 H GLU 29 H GLU 29 3.697 8.747 -0.142
206 HA GLU 29 HA GLU 29 2.744 9.227 -2.845
207 HB2 GLU 29 2HB GLU 29 3.764 6.737 -1.480
208 HB3 GLU 29 1HB GLU 29 3.139 6.760 -3.116
209 HG2 GLU 29 2HG GLU 29 5.531 8.301 -2.129
210 HG3 GLU 29 1HG GLU 29 5.583 6.808 -3.062
211 H ILE 30 H ILE 30 0.796 8.676 -3.543
212 HA ILE 30 HA ILE 30 -1.136 7.689 -1.587
213 HB ILE 30 HB ILE 30 -1.617 8.891 -4.338
214 HG12 ILE 30 2HG1 ILE 30 -0.663 10.603 -2.884
215 HG13 ILE 30 1HG1 ILE 30 -2.372 10.923 -3.147
216 HG21 ILE 30 1HG2 ILE 30 -3.552 8.296 -2.102
217 HG22 ILE 30 2HG2 ILE 30 -3.418 7.427 -3.630
218 HG23 ILE 30 3HG2 ILE 30 -3.958 9.106 -3.617
219 HD11 ILE 30 3HD1 ILE 30 -1.721 11.351 -0.849
220 HD12 ILE 30 1HD1 ILE 30 -1.165 9.688 -0.682
221 HD13 ILE 30 2HD1 ILE 30 -2.878 10.023 -0.938
222 H ILE 31 H ILE 31 -1.634 5.660 -1.694
223 HA ILE 31 HA ILE 31 -0.767 4.097 -4.031
224 HB ILE 31 HB ILE 31 -1.298 3.176 -1.181
225 HG12 ILE 31 2HG1 ILE 31 1.321 3.517 -2.658
226 HG13 ILE 31 1HG1 ILE 31 0.737 4.543 -1.355
227 HG21 ILE 31 1HG2 ILE 31 -0.305 1.030 -1.869
228 HG22 ILE 31 2HG2 ILE 31 -0.189 1.624 -3.525
229 HG23 ILE 31 3HG2 ILE 31 -1.771 1.397 -2.784
230 HD11 ILE 31 3HD1 ILE 31 2.423 2.970 -0.575
231 HD12 ILE 31 1HD1 ILE 31 1.432 1.620 -1.122
232 HD13 ILE 31 2HD1 ILE 31 0.867 2.654 0.190
233 H HIS 32 H HIS 32 -2.175 2.770 -5.042
234 HA HIS 32 HA HIS 32 -5.002 3.131 -4.490
235 HD1 HIS 32 1HD HIS 32 -2.670 2.909 -8.641
236 HD2 HIS 32 2HD HIS 32 -5.234 5.130 -6.218
237 HE1 HIS 32 1HE HIS 32 -2.588 5.275 -9.501
238 HB2 HIS 32 2HB HIS 32 -3.593 1.582 -6.701
239 HB3 HIS 32 1HB HIS 32 -5.303 1.978 -6.649
240 H LEU 33 H LEU 33 -5.871 1.731 -3.121
241 HA LEU 33 HA LEU 33 -4.405 -0.558 -2.218
242 HG LEU 33 HG LEU 33 -5.224 -1.210 0.141
243 HB2 LEU 33 2HB LEU 33 -5.933 1.016 -0.870
244 HB3 LEU 33 1HB LEU 33 -7.248 0.160 -1.637
245 HD11 LEU 33 1HD1 LEU 33 -6.373 0.540 1.374
246 HD12 LEU 33 2HD1 LEU 33 -6.916 -1.055 1.886
247 HD13 LEU 33 3HD1 LEU 33 -7.928 -0.078 0.819
248 HD21 LEU 33 3HD2 LEU 33 -8.028 -2.019 -0.642
249 HD22 LEU 33 1HD2 LEU 33 -6.865 -2.962 0.287
250 HD23 LEU 33 2HD2 LEU 33 -6.570 -2.634 -1.421
251 H ILE 34 H ILE 34 -4.563 -2.546 -2.921
252 HA ILE 34 HA ILE 34 -6.528 -3.113 -5.004
253 HB ILE 34 HB ILE 34 -3.849 -4.404 -4.405
254 HG12 ILE 34 2HG1 ILE 34 -3.604 -2.220 -5.420
255 HG13 ILE 34 1HG1 ILE 34 -3.166 -3.468 -6.578
256 HG21 ILE 34 1HG2 ILE 34 -5.776 -5.056 -6.627
257 HG22 ILE 34 2HG2 ILE 34 -5.302 -6.126 -5.292
258 HG23 ILE 34 3HG2 ILE 34 -4.113 -5.615 -6.498
259 HD11 ILE 34 3HD1 ILE 34 -5.363 -3.194 -7.654
260 HD12 ILE 34 1HD1 ILE 34 -4.417 -1.705 -7.642
261 HD13 ILE 34 2HD1 ILE 34 -5.745 -1.909 -6.505
262 H SER 35 H SER 35 -4.936 -4.666 -2.198
263 HA SER 35 HA SER 35 -7.454 -6.024 -1.632
264 HG SER 35 HG SER 35 -6.956 -8.251 -3.448
265 HB2 SER 35 2HB SER 35 -4.832 -7.553 -1.831
266 HB3 SER 35 1HB SER 35 -6.401 -8.214 -1.409
267 H LYS 36 H LYS 36 -7.882 -6.014 0.511
268 HA LYS 36 HA LYS 36 -5.859 -5.056 2.396
269 HB2 LYS 36 2HB LYS 36 -8.811 -5.596 2.639
270 HB3 LYS 36 1HB LYS 36 -7.822 -5.224 4.048
271 HG2 LYS 36 2HG LYS 36 -7.264 -3.076 3.094
272 HG3 LYS 36 1HG LYS 36 -8.175 -3.451 1.641
273 HD2 LYS 36 2HD LYS 36 -10.222 -3.637 3.019
274 HD3 LYS 36 1HD LYS 36 -9.273 -3.170 4.433
275 HE2 LYS 36 2HE LYS 36 -8.743 -1.043 3.433
276 HE3 LYS 36 1HE LYS 36 -9.544 -1.507 1.937
277 HZ1 LYS 36 3HZ LYS 36 -11.623 -1.668 3.262
278 HZ2 LYS 36 1HZ LYS 36 -10.980 -0.129 3.089
279 HZ3 LYS 36 2HZ LYS 36 -10.814 -0.948 4.558
280 H GLU 37 H GLU 37 -7.115 -7.930 1.300
281 HA GLU 37 HA GLU 37 -6.126 -9.357 3.632
282 HB2 GLU 37 2HB GLU 37 -7.647 -11.223 2.814
283 HB3 GLU 37 1HB GLU 37 -8.455 -9.803 3.459
284 HG2 GLU 37 2HG GLU 37 -8.787 -8.987 1.177
285 HG3 GLU 37 1HG GLU 37 -8.066 -10.470 0.550
286 H THR 38 H THR 38 -4.295 -10.335 3.309
287 HA THR 38 HA THR 38 -3.654 -11.421 0.649
288 HB THR 38 HB THR 38 -1.248 -11.136 1.527
289 HG1 THR 38 1HG THR 38 -2.033 -9.042 3.129
290 HG21 THR 38 3HG2 THR 38 -2.189 -9.654 -0.211
291 HG22 THR 38 1HG2 THR 38 -1.150 -8.750 0.892
292 HG23 THR 38 2HG2 THR 38 -2.903 -8.642 1.046
293 H GLY 39 H GLY 39 -5.047 -12.378 3.101
294 HA2 GLY 39 2HA GLY 39 -5.103 -14.642 3.879
295 HA3 GLY 39 1HA GLY 39 -3.333 -14.657 3.820
296 H GLU 40 H GLU 40 -2.661 -12.356 4.875
297 HA GLU 40 HA GLU 40 -3.496 -12.569 7.662
298 HB2 GLU 40 2HB GLU 40 -1.034 -11.457 6.333
299 HB3 GLU 40 1HB GLU 40 -1.454 -10.998 7.968
300 HG2 GLU 40 2HG GLU 40 0.209 -12.772 7.943
301 HG3 GLU 40 1HG GLU 40 -1.293 -13.307 8.675
302 H ALA 41 H ALA 41 -3.736 -10.564 8.853
303 HA ALA 41 HA ALA 41 -4.806 -8.413 7.187
304 HB1 ALA 41 1HB ALA 41 -5.331 -9.042 10.106
305 HB2 ALA 41 2HB ALA 41 -6.441 -9.353 8.773
306 HB3 ALA 41 3HB ALA 41 -6.035 -7.695 9.213
307 H GLY 42 H GLY 42 -2.840 -7.527 6.744
308 HA2 GLY 42 2HA GLY 42 -1.777 -5.627 8.467
309 HA3 GLY 42 1HA GLY 42 -0.793 -7.083 8.631
310 H TRP 43 H TRP 43 -0.720 -8.117 6.180
311 HA TRP 43 HA TRP 43 0.739 -6.139 4.697
312 HD1 TRP 43 HD TRP 43 1.464 -9.901 6.301
313 HE1 TRP 43 1HE TRP 43 3.961 -9.911 6.916
314 HE3 TRP 43 3HE TRP 43 3.212 -6.629 2.779
315 HZ2 TRP 43 2HZ TRP 43 6.350 -8.707 6.044
316 HZ3 TRP 43 3HZ TRP 43 5.616 -6.118 2.736
317 HH2 TRP 43 HH TRP 43 7.153 -7.134 4.335
318 HB2 TRP 43 2HB TRP 43 0.163 -9.059 4.149
319 HB3 TRP 43 1HB TRP 43 1.023 -8.024 3.020
320 H TRP 44 H TRP 44 -0.153 -4.876 3.326
321 HA TRP 44 HA TRP 44 -2.754 -5.568 2.185
322 HD1 TRP 44 HD TRP 44 -3.691 -5.449 4.143
323 HE1 TRP 44 1HE TRP 44 -5.606 -4.499 5.526
324 HE3 TRP 44 3HE TRP 44 -3.299 -0.540 2.782
325 HZ2 TRP 44 2HZ TRP 44 -6.817 -1.980 5.997
326 HZ3 TRP 44 3HZ TRP 44 -4.879 1.075 3.751
327 HH2 TRP 44 HH TRP 44 -6.605 0.362 5.327
328 HB2 TRP 44 2HB TRP 44 -1.469 -2.973 2.939
329 HB3 TRP 44 1HB TRP 44 -2.607 -3.001 1.602
330 H LYS 45 H LYS 45 -3.021 -5.403 0.056
331 HA LYS 45 HA LYS 45 -0.543 -5.303 -1.504
332 HB2 LYS 45 2HB LYS 45 -1.922 -7.391 -1.644
333 HB3 LYS 45 1HB LYS 45 -3.270 -6.407 -2.190
334 HG2 LYS 45 2HG LYS 45 -2.006 -5.806 -4.201
335 HG3 LYS 45 1HG LYS 45 -0.678 -6.832 -3.659
336 HD2 LYS 45 2HD LYS 45 -2.121 -8.787 -3.725
337 HD3 LYS 45 1HD LYS 45 -3.494 -7.780 -4.190
338 HE2 LYS 45 2HE LYS 45 -2.624 -8.855 -6.154
339 HE3 LYS 45 1HE LYS 45 -2.265 -7.134 -6.239
340 HZ1 LYS 45 3HZ LYS 45 -0.394 -9.359 -5.669
341 HZ2 LYS 45 1HZ LYS 45 0.018 -7.742 -5.362
342 HZ3 LYS 45 2HZ LYS 45 -0.368 -8.199 -6.914
343 H GLY 46 H GLY 46 -0.303 -3.672 -2.859
344 HA2 GLY 46 2HA GLY 46 -2.612 -2.070 -3.588
345 HA3 GLY 46 1HA GLY 46 -1.323 -1.275 -2.698
346 H GLU 47 H GLU 47 -1.979 -0.354 -5.069
347 HA GLU 47 HA GLU 47 0.276 -1.116 -6.747
348 HB2 GLU 47 2HB GLU 47 -1.848 -1.837 -7.758
349 HB3 GLU 47 1HB GLU 47 -2.501 -0.229 -7.575
350 HG2 GLU 47 2HG GLU 47 -0.086 -0.720 -9.282
351 HG3 GLU 47 1HG GLU 47 -1.708 -1.017 -9.897
352 H LEU 48 H LEU 48 1.581 0.456 -7.162
353 HA LEU 48 HA LEU 48 0.744 3.213 -6.757
354 HG LEU 48 HG LEU 48 3.701 4.205 -6.235
355 HB2 LEU 48 2HB LEU 48 1.745 2.533 -4.662
356 HB3 LEU 48 1HB LEU 48 3.138 1.896 -5.509
357 HD11 LEU 48 1HD1 LEU 48 2.660 6.084 -5.108
358 HD12 LEU 48 2HD1 LEU 48 1.483 4.993 -4.372
359 HD13 LEU 48 3HD1 LEU 48 1.519 5.205 -6.124
360 HD21 LEU 48 3HD2 LEU 48 4.524 4.947 -4.063
361 HD22 LEU 48 1HD2 LEU 48 4.781 3.221 -4.310
362 HD23 LEU 48 2HD2 LEU 48 3.471 3.779 -3.267
363 H ASN 49 H ASN 49 1.096 4.084 -8.647
364 HA ASN 49 HA ASN 49 2.175 4.997 -10.425
365 HB2 ASN 49 2HB ASN 49 4.669 4.002 -9.041
366 HB3 ASN 49 1HB ASN 49 4.659 5.110 -10.405
367 HD21 ASN 49 1HD2 ASN 49 5.695 5.406 -7.709
368 HD22 ASN 49 2HD2 ASN 49 4.932 6.784 -7.016
369 H GLY 50 H GLY 50 1.377 2.103 -10.339
370 HA2 GLY 50 2HA GLY 50 1.230 0.887 -12.377
371 HA3 GLY 50 1HA GLY 50 2.885 1.356 -12.741
372 H LYS 51 H LYS 51 3.257 0.689 -9.662
373 HA LYS 51 HA LYS 51 3.893 -2.113 -10.273
374 HB2 LYS 51 2HB LYS 51 5.012 -0.383 -8.057
375 HB3 LYS 51 1HB LYS 51 5.476 -2.036 -8.399
376 HG2 LYS 51 2HG LYS 51 7.192 -0.742 -9.223
377 HG3 LYS 51 1HG LYS 51 6.273 -1.181 -10.653
378 HD2 LYS 51 2HD LYS 51 5.115 0.987 -10.593
379 HD3 LYS 51 1HD LYS 51 6.047 1.446 -9.173
380 HE2 LYS 51 2HE LYS 51 8.080 1.384 -10.452
381 HE3 LYS 51 1HE LYS 51 7.213 0.808 -11.879
382 HZ1 LYS 51 3HZ LYS 51 6.817 3.414 -10.523
383 HZ2 LYS 51 1HZ LYS 51 5.947 2.880 -11.861
384 HZ3 LYS 51 2HZ LYS 51 7.584 3.197 -12.000
385 H GLU 52 H GLU 52 3.103 -3.683 -9.051
386 HA GLU 52 HA GLU 52 1.510 -2.835 -6.785
387 HB2 GLU 52 2HB GLU 52 -0.092 -4.717 -7.248
388 HB3 GLU 52 1HB GLU 52 -0.256 -3.417 -8.377
389 HG2 GLU 52 2HG GLU 52 -0.339 -5.190 -9.804
390 HG3 GLU 52 1HG GLU 52 1.408 -4.995 -9.772
391 H GLY 53 H GLY 53 1.416 -4.161 -5.033
392 HA2 GLY 53 2HA GLY 53 2.680 -6.644 -4.851
393 HA3 GLY 53 1HA GLY 53 3.829 -5.383 -4.405
394 H VAL 54 H VAL 54 3.766 -6.369 -2.299
395 HA VAL 54 HA VAL 54 1.382 -5.528 -0.814
396 HB VAL 54 HB VAL 54 1.937 -7.207 0.912
397 HG11 VAL 54 1HG1 VAL 54 0.309 -7.783 -0.774
398 HG12 VAL 54 2HG1 VAL 54 1.243 -9.208 -0.322
399 HG13 VAL 54 3HG1 VAL 54 1.582 -8.371 -1.839
400 HG21 VAL 54 3HG2 VAL 54 4.333 -7.426 0.550
401 HG22 VAL 54 1HG2 VAL 54 4.051 -8.140 -1.036
402 HG23 VAL 54 2HG2 VAL 54 3.566 -9.008 0.419
403 H PHE 55 H PHE 55 1.660 -4.653 1.205
404 HA PHE 55 HA PHE 55 4.306 -3.894 2.029
405 HD1 PHE 55 2HD PHE 55 1.401 -2.258 -0.591
406 HD2 PHE 55 1HD PHE 55 1.872 -0.671 3.333
407 HE1 PHE 55 2HE PHE 55 -0.845 -1.264 -0.720
408 HE2 PHE 55 1HE PHE 55 -0.368 0.326 3.201
409 HZ PHE 55 HZ PHE 55 -1.729 0.033 1.175
410 HB2 PHE 55 2HB PHE 55 3.783 -1.516 2.100
411 HB3 PHE 55 1HB PHE 55 3.595 -2.145 0.453
412 HA PRO 56 HA PRO 56 2.105 -4.414 5.863
413 HB2 PRO 56 2HB PRO 56 3.973 -2.678 7.278
414 HB3 PRO 56 1HB PRO 56 3.809 -4.430 7.372
415 HG2 PRO 56 2HG PRO 56 5.967 -3.235 6.233
416 HG3 PRO 56 1HG PRO 56 5.346 -4.805 5.697
417 HD2 PRO 56 2HD PRO 56 4.905 -2.093 4.506
418 HD3 PRO 56 1HD PRO 56 5.289 -3.630 3.702
419 H ASP 57 H ASP 57 0.369 -3.486 6.565
420 HA ASP 57 HA ASP 57 -0.694 -1.052 5.885
421 HB2 ASP 57 2HB ASP 57 -2.200 -2.674 6.602
422 HB3 ASP 57 1HB ASP 57 -1.337 -3.013 8.079
423 H ASN 58 H ASN 58 1.438 -1.665 8.562
424 HA ASN 58 HA ASN 58 0.769 0.654 10.068
425 HB2 ASN 58 2HB ASN 58 2.695 0.247 11.446
426 HB3 ASN 58 1HB ASN 58 1.936 -1.292 11.083
427 HD21 ASN 58 1HD2 ASN 58 3.079 -2.814 9.896
428 HD22 ASN 58 2HD2 ASN 58 4.755 -2.624 9.537
429 H PHE 59 H PHE 59 2.433 0.496 7.148
430 HA PHE 59 HA PHE 59 4.001 2.890 7.745
431 HD1 PHE 59 1HD PHE 59 6.834 2.869 6.763
432 HD2 PHE 59 2HD PHE 59 4.752 -0.825 6.670
433 HE1 PHE 59 1HE PHE 59 8.747 1.778 7.842
434 HE2 PHE 59 2HE PHE 59 6.671 -1.934 7.758
435 HZ PHE 59 HZ PHE 59 8.664 -0.627 8.344
436 HB2 PHE 59 2HB PHE 59 4.014 1.051 5.359
437 HB3 PHE 59 1HB PHE 59 4.882 2.579 5.381
438 H ALA 60 H ALA 60 0.916 2.258 6.611
439 HA ALA 60 HA ALA 60 0.852 4.851 5.280
440 HB1 ALA 60 1HB ALA 60 -0.310 2.339 4.084
441 HB2 ALA 60 2HB ALA 60 1.125 3.178 3.499
442 HB3 ALA 60 3HB ALA 60 -0.451 3.966 3.420
443 H VAL 61 H VAL 61 -1.320 5.683 5.070
444 HA VAL 61 HA VAL 61 -3.245 4.373 6.838
445 HB VAL 61 HB VAL 61 -2.250 6.324 8.027
446 HG11 VAL 61 1HG1 VAL 61 -3.412 7.985 5.800
447 HG12 VAL 61 2HG1 VAL 61 -1.705 7.754 6.164
448 HG13 VAL 61 3HG1 VAL 61 -2.742 8.611 7.305
449 HG21 VAL 61 3HG2 VAL 61 -4.520 5.677 8.592
450 HG22 VAL 61 1HG2 VAL 61 -5.154 6.677 7.284
451 HG23 VAL 61 2HG2 VAL 61 -4.362 7.431 8.666
452 H GLN 62 H GLN 62 -5.243 4.197 6.024
453 HA GLN 62 HA GLN 62 -5.603 4.928 3.315
454 HB2 GLN 62 2HB GLN 62 -6.556 2.851 3.998
455 HB3 GLN 62 1HB GLN 62 -7.429 3.617 5.317
456 HG2 GLN 62 2HG GLN 62 -8.888 4.720 3.815
457 HG3 GLN 62 1HG GLN 62 -7.905 4.262 2.435
458 HE21 GLN 62 1HE2 GLN 62 -9.742 3.443 1.533
459 HE22 GLN 62 2HE2 GLN 62 -10.374 1.893 1.947
460 H ILE 63 H ILE 63 -6.216 6.754 2.612
461 HA ILE 63 HA ILE 63 -7.317 8.705 4.458
462 HB ILE 63 HB ILE 63 -6.918 10.346 2.642
463 HG12 ILE 63 2HG1 ILE 63 -5.598 8.014 1.212
464 HG13 ILE 63 1HG1 ILE 63 -7.092 8.799 0.721
465 HG21 ILE 63 1HG2 ILE 63 -4.450 10.339 2.838
466 HG22 ILE 63 2HG2 ILE 63 -4.520 8.690 3.457
467 HG23 ILE 63 3HG2 ILE 63 -5.243 10.007 4.378
468 HD11 ILE 63 3HD1 ILE 63 -4.366 10.071 0.805
469 HD12 ILE 63 1HD1 ILE 63 -5.858 10.867 0.309
470 HD13 ILE 63 2HD1 ILE 63 -5.223 9.524 -0.639
471 H SER 64 H SER 64 -8.249 6.710 1.842
472 HA SER 64 HA SER 64 -10.942 7.647 2.096
473 HG SER 64 HG SER 64 -11.444 8.301 -1.382
474 HB2 SER 64 2HB SER 64 -9.859 9.030 0.257
475 HB3 SER 64 1HB SER 64 -9.593 7.527 -0.620
Start of MODEL 6
1 H1 GLY 1 1HT GLY 1 -11.526 -10.199 4.717
2 H2 GLY 1 2HT GLY 1 -12.675 -11.176 5.504
3 H3 GLY 1 3HT GLY 1 -12.135 -9.756 6.239
4 HA2 GLY 1 1HA GLY 1 -13.654 -9.948 3.711
5 HA3 GLY 1 2HA GLY 1 -14.325 -9.488 5.268
6 H ALA 2 H ALA 2 -11.484 -8.584 3.262
7 HA ALA 2 HA ALA 2 -12.433 -5.842 3.348
8 HB1 ALA 2 1HB ALA 2 -10.900 -6.082 5.244
9 HB2 ALA 2 2HB ALA 2 -10.284 -4.988 4.021
10 HB3 ALA 2 3HB ALA 2 -9.632 -6.633 4.147
11 H MET 3 H MET 3 -11.687 -4.580 1.588
12 HA MET 3 HA MET 3 -10.203 -6.029 -0.477
13 HB2 MET 3 2HB MET 3 -11.844 -5.476 -2.176
14 HB3 MET 3 1HB MET 3 -12.637 -6.381 -0.899
15 HG2 MET 3 2HG MET 3 -13.565 -4.284 0.002
16 HG3 MET 3 1HG MET 3 -12.755 -3.389 -1.275
17 HE1 MET 3 3HE MET 3 -13.315 -3.716 -3.882
18 HE2 MET 3 1HE MET 3 -14.651 -4.703 -4.477
19 HE3 MET 3 2HE MET 3 -13.229 -5.474 -3.786
20 H GLY 4 H GLY 4 -10.420 -4.174 -2.485
21 HA2 GLY 4 2HA GLY 4 -9.864 -1.545 -1.377
22 HA3 GLY 4 1HA GLY 4 -8.658 -2.306 -2.424
23 H ALA 5 H ALA 5 -11.933 -1.149 -2.237
24 HA ALA 5 HA ALA 5 -12.484 -1.684 -5.024
25 HB1 ALA 5 1HB ALA 5 -14.270 -1.817 -3.348
26 HB2 ALA 5 2HB ALA 5 -14.636 -0.617 -4.592
27 HB3 ALA 5 3HB ALA 5 -14.058 -0.101 -3.008
28 H LYS 6 H LYS 6 -12.434 1.218 -3.100
29 HA LYS 6 HA LYS 6 -11.073 2.657 -5.241
30 HB2 LYS 6 2HB LYS 6 -12.668 4.531 -5.103
31 HB3 LYS 6 1HB LYS 6 -13.442 3.058 -5.665
32 HG2 LYS 6 2HG LYS 6 -14.376 2.702 -3.418
33 HG3 LYS 6 1HG LYS 6 -13.595 4.185 -2.875
34 HD2 LYS 6 2HD LYS 6 -15.939 4.597 -3.379
35 HD3 LYS 6 1HD LYS 6 -14.904 5.464 -4.513
36 HE2 LYS 6 2HE LYS 6 -15.258 3.742 -6.193
37 HE3 LYS 6 1HE LYS 6 -16.232 2.807 -5.060
38 HZ1 LYS 6 3HZ LYS 6 -17.830 4.601 -5.033
39 HZ2 LYS 6 1HZ LYS 6 -17.576 4.051 -6.609
40 HZ3 LYS 6 2HZ LYS 6 -16.877 5.500 -6.107
41 H GLU 7 H GLU 7 -10.522 1.562 -2.658
42 HA GLU 7 HA GLU 7 -10.283 3.848 -0.905
43 HB2 GLU 7 2HB GLU 7 -9.396 0.966 -0.425
44 HB3 GLU 7 1HB GLU 7 -9.341 2.244 0.776
45 HG2 GLU 7 2HG GLU 7 -11.196 0.927 1.306
46 HG3 GLU 7 1HG GLU 7 -11.824 2.410 0.614
47 H TYR 8 H TYR 8 -8.439 4.890 -0.510
48 HA TYR 8 HA TYR 8 -6.015 3.944 -1.886
49 HD1 TYR 8 1HD TYR 8 -8.967 6.547 -2.612
50 HD2 TYR 8 2HD TYR 8 -5.287 5.633 -4.510
51 HE1 TYR 8 1HE TYR 8 -10.077 6.639 -4.775
52 HE2 TYR 8 2HE TYR 8 -6.391 5.717 -6.700
53 HH TYR 8 HH TYR 8 -9.594 6.950 -7.020
54 HB2 TYR 8 2HB TYR 8 -6.771 6.849 -1.460
55 HB3 TYR 8 1HB TYR 8 -5.328 6.246 -2.226
56 H CYS 9 H CYS 9 -4.076 4.649 -0.876
57 HA CYS 9 HA CYS 9 -4.407 5.344 1.915
58 HG CYS 9 HG CYS 9 -2.913 3.007 -0.795
59 HB2 CYS 9 2HB CYS 9 -2.655 3.574 2.441
60 HB3 CYS 9 1HB CYS 9 -4.269 2.998 2.050
61 H ARG 10 H ARG 10 -2.941 6.717 2.638
62 HA ARG 10 HA ARG 10 -0.854 7.460 0.749
63 HE ARG 10 HE ARG 10 1.435 11.324 3.330
64 HB2 ARG 10 2HB ARG 10 -2.196 9.394 1.362
65 HB3 ARG 10 1HB ARG 10 -1.982 9.048 3.077
66 HG2 ARG 10 2HG ARG 10 0.422 9.410 2.860
67 HG3 ARG 10 1HG ARG 10 0.220 9.755 1.154
68 HD2 ARG 10 2HD ARG 10 -0.905 11.782 1.626
69 HD3 ARG 10 1HD ARG 10 -1.073 11.365 3.341
70 HH11 ARG 10 1HH1 ARG 10 -0.374 13.575 1.276
71 HH12 ARG 10 2HH1 ARG 10 0.870 14.709 1.174
72 HH21 ARG 10 1HH2 ARG 10 3.155 12.832 3.203
73 HH22 ARG 10 2HH2 ARG 10 2.947 14.301 2.354
74 H THR 11 H THR 11 1.145 7.291 1.212
75 HA THR 11 HA THR 11 2.213 5.535 3.072
76 HB THR 11 HB THR 11 4.310 6.629 2.313
77 HG1 THR 11 1HG THR 11 2.763 8.623 2.143
78 HG21 THR 11 3HG2 THR 11 2.239 6.132 0.151
79 HG22 THR 11 1HG2 THR 11 3.205 4.883 0.936
80 HG23 THR 11 2HG2 THR 11 3.987 6.106 -0.070
81 H LEU 12 H LEU 12 2.862 5.873 5.182
82 HA LEU 12 HA LEU 12 2.896 8.639 6.196
83 HG LEU 12 HG LEU 12 0.598 6.609 6.603
84 HB2 LEU 12 2HB LEU 12 2.760 6.008 7.663
85 HB3 LEU 12 1HB LEU 12 2.790 7.581 8.430
86 HD11 LEU 12 1HD1 LEU 12 -0.715 6.361 8.665
87 HD12 LEU 12 2HD1 LEU 12 0.686 6.838 9.605
88 HD13 LEU 12 3HD1 LEU 12 0.713 5.330 8.692
89 HD21 LEU 12 3HD2 LEU 12 0.825 9.023 6.606
90 HD22 LEU 12 1HD2 LEU 12 0.833 9.046 8.371
91 HD23 LEU 12 2HD2 LEU 12 -0.617 8.551 7.500
92 H PHE 13 H PHE 13 4.825 5.965 5.387
93 HA PHE 13 HA PHE 13 7.237 7.256 6.342
94 HD1 PHE 13 1HD PHE 13 8.522 6.849 8.860
95 HD2 PHE 13 2HD PHE 13 4.875 4.667 8.748
96 HE1 PHE 13 1HE PHE 13 8.064 7.500 11.189
97 HE2 PHE 13 2HE PHE 13 4.411 5.324 11.074
98 HZ PHE 13 HZ PHE 13 6.004 6.740 12.293
99 HB2 PHE 13 2HB PHE 13 6.445 4.407 7.051
100 HB3 PHE 13 1HB PHE 13 8.078 5.022 7.184
101 HA PRO 14 HA PRO 14 8.423 5.388 2.441
102 HB2 PRO 14 2HB PRO 14 11.122 5.329 2.734
103 HB3 PRO 14 1HB PRO 14 10.253 6.833 2.403
104 HG2 PRO 14 2HG PRO 14 11.292 5.778 4.999
105 HG3 PRO 14 1HG PRO 14 11.343 7.429 4.364
106 HD2 PRO 14 2HD PRO 14 9.511 6.610 6.201
107 HD3 PRO 14 1HD PRO 14 9.179 7.875 5.004
108 H TYR 15 H TYR 15 9.005 3.340 1.741
109 HA TYR 15 HA TYR 15 9.879 1.425 3.758
110 HD1 TYR 15 1HD TYR 15 8.780 -0.459 5.129
111 HD2 TYR 15 2HD TYR 15 7.174 -1.039 1.245
112 HE1 TYR 15 1HE TYR 15 8.717 -2.878 5.527
113 HE2 TYR 15 2HE TYR 15 7.117 -3.453 1.618
114 HH TYR 15 HH TYR 15 8.111 -5.144 3.040
115 HB2 TYR 15 2HB TYR 15 7.443 1.358 3.769
116 HB3 TYR 15 1HB TYR 15 7.426 1.119 2.031
117 H THR 16 H THR 16 11.292 0.014 2.956
118 HA THR 16 HA THR 16 11.750 0.062 0.073
119 HB THR 16 HB THR 16 13.621 -0.894 2.244
120 HG1 THR 16 1HG THR 16 14.155 1.098 2.588
121 HG21 THR 16 3HG2 THR 16 14.132 -1.661 -0.036
122 HG22 THR 16 1HG2 THR 16 15.338 -0.499 0.515
123 HG23 THR 16 2HG2 THR 16 14.081 0.004 -0.614
124 H GLY 17 H GLY 17 11.348 -1.768 -1.027
125 HA2 GLY 17 2HA GLY 17 10.556 -4.130 0.438
126 HA3 GLY 17 1HA GLY 17 10.430 -3.874 -1.303
127 H THR 18 H THR 18 11.649 -6.036 0.462
128 HA THR 18 HA THR 18 14.438 -5.852 -0.354
129 HB THR 18 HB THR 18 13.986 -6.625 1.976
130 HG1 THR 18 1HG THR 18 15.814 -7.555 1.426
131 HG21 THR 18 3HG2 THR 18 11.832 -7.724 1.635
132 HG22 THR 18 1HG2 THR 18 12.987 -8.841 2.364
133 HG23 THR 18 2HG2 THR 18 12.606 -8.962 0.646
134 H ASN 19 H ASN 19 11.494 -7.014 -1.280
135 HA ASN 19 HA ASN 19 12.761 -8.623 -3.293
136 HB2 ASN 19 2HB ASN 19 10.928 -10.194 -3.297
137 HB3 ASN 19 1HB ASN 19 11.644 -10.148 -1.701
138 HD21 ASN 19 1HD2 ASN 19 10.359 -9.515 0.022
139 HD22 ASN 19 2HD2 ASN 19 8.670 -9.240 -0.143
140 H GLU 20 H GLU 20 11.063 -8.892 -5.159
141 HA GLU 20 HA GLU 20 10.643 -6.183 -5.968
142 HB2 GLU 20 2HB GLU 20 10.314 -8.806 -7.381
143 HB3 GLU 20 1HB GLU 20 9.960 -7.256 -8.137
144 HG2 GLU 20 2HG GLU 20 12.610 -7.934 -6.900
145 HG3 GLU 20 1HG GLU 20 12.233 -8.153 -8.611
146 H ASP 21 H ASP 21 8.595 -8.730 -4.867
147 HA ASP 21 HA ASP 21 6.196 -7.423 -5.823
148 HB2 ASP 21 2HB ASP 21 6.248 -9.857 -5.761
149 HB3 ASP 21 1HB ASP 21 6.567 -9.841 -4.033
150 H GLU 22 H GLU 22 8.224 -7.135 -3.248
151 HA GLU 22 HA GLU 22 6.265 -6.051 -1.416
152 HB2 GLU 22 2HB GLU 22 8.299 -7.392 -0.729
153 HB3 GLU 22 1HB GLU 22 9.283 -6.050 -1.263
154 HG2 GLU 22 2HG GLU 22 8.476 -4.656 0.448
155 HG3 GLU 22 1HG GLU 22 7.194 -5.799 0.863
156 H LEU 23 H LEU 23 5.527 -4.116 -1.870
157 HA LEU 23 HA LEU 23 6.718 -2.604 -3.963
158 HG LEU 23 HG LEU 23 3.365 -1.082 -4.527
159 HB2 LEU 23 2HB LEU 23 4.229 -2.994 -3.600
160 HB3 LEU 23 1HB LEU 23 4.318 -1.848 -2.293
161 HD11 LEU 23 1HD1 LEU 23 3.940 0.535 -2.806
162 HD12 LEU 23 2HD1 LEU 23 4.432 1.166 -4.381
163 HD13 LEU 23 3HD1 LEU 23 5.635 0.484 -3.289
164 HD21 LEU 23 3HD2 LEU 23 5.045 -2.071 -5.963
165 HD22 LEU 23 1HD2 LEU 23 6.271 -1.008 -5.276
166 HD23 LEU 23 2HD2 LEU 23 4.939 -0.329 -6.216
167 H THR 24 H THR 24 7.762 -0.750 -3.928
168 HA THR 24 HA THR 24 8.782 0.126 -1.325
169 HB THR 24 HB THR 24 9.922 0.358 -4.119
170 HG1 THR 24 1HG THR 24 9.831 -1.684 -2.867
171 HG21 THR 24 3HG2 THR 24 11.989 1.155 -2.998
172 HG22 THR 24 1HG2 THR 24 11.127 1.166 -1.459
173 HG23 THR 24 2HG2 THR 24 10.640 2.266 -2.744
174 H PHE 25 H PHE 25 8.099 2.042 -0.602
175 HA PHE 25 HA PHE 25 7.322 4.058 -2.519
176 HD1 PHE 25 2HD PHE 25 5.628 4.503 1.365
177 HD2 PHE 25 1HD PHE 25 4.997 1.042 -1.007
178 HE1 PHE 25 2HE PHE 25 4.999 3.256 3.366
179 HE2 PHE 25 1HE PHE 25 4.359 -0.222 0.986
180 HZ PHE 25 HZ PHE 25 4.357 0.873 3.184
181 HB2 PHE 25 2HB PHE 25 5.330 4.634 -1.069
182 HB3 PHE 25 1HB PHE 25 5.212 3.170 -2.032
183 H ARG 26 H ARG 26 7.042 6.187 -1.611
184 HA ARG 26 HA ARG 26 9.040 6.750 0.498
185 HE ARG 26 HE ARG 26 11.820 7.831 -3.967
186 HB2 ARG 26 2HB ARG 26 7.942 8.507 -1.693
187 HB3 ARG 26 1HB ARG 26 9.268 8.893 -0.608
188 HG2 ARG 26 2HG ARG 26 10.690 7.325 -1.631
189 HG3 ARG 26 1HG ARG 26 9.347 6.593 -2.519
190 HD2 ARG 26 2HD ARG 26 9.025 8.673 -3.730
191 HD3 ARG 26 1HD ARG 26 10.386 9.393 -2.879
192 HH11 ARG 26 1HH1 ARG 26 8.494 7.851 -5.272
193 HH12 ARG 26 2HH1 ARG 26 8.969 7.447 -6.840
194 HH21 ARG 26 1HH2 ARG 26 12.452 7.231 -6.161
195 HH22 ARG 26 2HH2 ARG 26 11.262 7.117 -7.378
196 H GLU 27 H GLU 27 8.409 8.930 1.637
197 HA GLU 27 HA GLU 27 5.646 8.695 2.471
198 HB2 GLU 27 2HB GLU 27 7.568 9.068 4.094
199 HB3 GLU 27 1HB GLU 27 7.745 10.673 3.420
200 HG2 GLU 27 2HG GLU 27 5.277 9.653 4.849
201 HG3 GLU 27 1HG GLU 27 6.537 10.630 5.585
202 H GLY 28 H GLY 28 4.224 9.627 1.321
203 HA2 GLY 28 2HA GLY 28 3.268 11.874 0.860
204 HA3 GLY 28 1HA GLY 28 4.811 12.241 0.096
205 H GLU 29 H GLU 29 3.436 9.066 -0.300
206 HA GLU 29 HA GLU 29 2.671 9.853 -3.003
207 HB2 GLU 29 2HB GLU 29 3.924 7.214 -2.172
208 HB3 GLU 29 1HB GLU 29 3.466 7.670 -3.809
209 HG2 GLU 29 2HG GLU 29 5.108 9.532 -3.702
210 HG3 GLU 29 1HG GLU 29 5.611 8.956 -2.122
211 H ILE 30 H ILE 30 0.868 8.799 -3.888
212 HA ILE 30 HA ILE 30 -0.971 7.799 -1.839
213 HB ILE 30 HB ILE 30 -1.551 8.865 -4.625
214 HG12 ILE 30 2HG1 ILE 30 -0.854 10.642 -3.069
215 HG13 ILE 30 1HG1 ILE 30 -2.547 10.808 -3.503
216 HG21 ILE 30 1HG2 ILE 30 -3.192 7.185 -3.998
217 HG22 ILE 30 2HG2 ILE 30 -3.929 8.785 -3.996
218 HG23 ILE 30 3HG2 ILE 30 -3.494 8.018 -2.473
219 HD11 ILE 30 3HD1 ILE 30 -1.472 9.689 -0.917
220 HD12 ILE 30 1HD1 ILE 30 -3.178 9.812 -1.353
221 HD13 ILE 30 2HD1 ILE 30 -2.210 11.273 -1.155
222 H ILE 31 H ILE 31 -1.348 5.717 -1.793
223 HA ILE 31 HA ILE 31 -0.580 4.119 -4.123
224 HB ILE 31 HB ILE 31 -1.039 3.239 -1.248
225 HG12 ILE 31 2HG1 ILE 31 1.571 3.614 -2.739
226 HG13 ILE 31 1HG1 ILE 31 0.950 4.689 -1.490
227 HG21 ILE 31 1HG2 ILE 31 0.110 1.729 -3.603
228 HG22 ILE 31 2HG2 ILE 31 -1.463 1.449 -2.858
229 HG23 ILE 31 3HG2 ILE 31 0.012 1.126 -1.947
230 HD11 ILE 31 3HD1 ILE 31 1.105 2.887 0.141
231 HD12 ILE 31 1HD1 ILE 31 2.665 3.196 -0.625
232 HD13 ILE 31 2HD1 ILE 31 1.704 1.799 -1.113
233 H HIS 32 H HIS 32 -2.080 2.851 -5.084
234 HA HIS 32 HA HIS 32 -4.868 3.303 -4.395
235 HD1 HIS 32 1HD HIS 32 -6.429 3.835 -7.641
236 HD2 HIS 32 2HD HIS 32 -5.819 -0.069 -6.341
237 HE1 HIS 32 1HE HIS 32 -8.510 2.578 -8.215
238 HB2 HIS 32 2HB HIS 32 -4.093 3.451 -6.766
239 HB3 HIS 32 1HB HIS 32 -3.566 1.778 -6.690
240 H LEU 33 H LEU 33 -5.718 1.959 -2.973
241 HA LEU 33 HA LEU 33 -4.287 -0.362 -2.128
242 HG LEU 33 HG LEU 33 -4.910 -0.759 0.385
243 HB2 LEU 33 2HB LEU 33 -5.554 1.366 -0.730
244 HB3 LEU 33 1HB LEU 33 -7.015 0.612 -1.300
245 HD11 LEU 33 1HD1 LEU 33 -6.518 -0.479 2.194
246 HD12 LEU 33 2HD1 LEU 33 -7.568 0.443 1.116
247 HD13 LEU 33 3HD1 LEU 33 -5.982 1.077 1.557
248 HD21 LEU 33 3HD2 LEU 33 -7.748 -1.577 -0.198
249 HD22 LEU 33 1HD2 LEU 33 -6.531 -2.478 0.701
250 HD23 LEU 33 2HD2 LEU 33 -6.343 -2.237 -1.037
251 H ILE 34 H ILE 34 -4.566 -2.312 -2.945
252 HA ILE 34 HA ILE 34 -6.815 -2.784 -4.737
253 HB ILE 34 HB ILE 34 -4.202 -4.290 -4.393
254 HG12 ILE 34 2HG1 ILE 34 -5.257 -2.550 -6.640
255 HG13 ILE 34 1HG1 ILE 34 -3.893 -2.206 -5.579
256 HG21 ILE 34 1HG2 ILE 34 -6.472 -4.881 -6.279
257 HG22 ILE 34 2HG2 ILE 34 -5.904 -5.903 -4.950
258 HG23 ILE 34 3HG2 ILE 34 -4.865 -5.605 -6.351
259 HD11 ILE 34 3HD1 ILE 34 -3.265 -2.925 -7.840
260 HD12 ILE 34 1HD1 ILE 34 -4.009 -4.484 -7.526
261 HD13 ILE 34 2HD1 ILE 34 -2.613 -3.967 -6.568
262 H SER 35 H SER 35 -5.258 -4.089 -1.837
263 HA SER 35 HA SER 35 -7.755 -5.208 -1.018
264 HG SER 35 HG SER 35 -6.557 -8.442 -0.363
265 HB2 SER 35 2HB SER 35 -6.893 -6.993 -2.535
266 HB3 SER 35 1HB SER 35 -5.457 -7.114 -1.525
267 H LYS 36 H LYS 36 -7.845 -5.363 1.140
268 HA LYS 36 HA LYS 36 -5.537 -4.505 2.686
269 HB2 LYS 36 2HB LYS 36 -8.420 -4.972 3.406
270 HB3 LYS 36 1HB LYS 36 -7.205 -4.474 4.575
271 HG2 LYS 36 2HG LYS 36 -6.917 -2.389 3.529
272 HG3 LYS 36 1HG LYS 36 -7.793 -2.882 2.094
273 HD2 LYS 36 2HD LYS 36 -9.848 -3.073 3.485
274 HD3 LYS 36 1HD LYS 36 -8.928 -2.429 4.847
275 HE2 LYS 36 2HE LYS 36 -8.529 -0.377 3.679
276 HE3 LYS 36 1HE LYS 36 -9.234 -1.027 2.203
277 HZ1 LYS 36 3HZ LYS 36 -10.706 0.466 3.429
278 HZ2 LYS 36 1HZ LYS 36 -10.723 -0.611 4.729
279 HZ3 LYS 36 2HZ LYS 36 -11.370 -1.090 3.256
280 H GLU 37 H GLU 37 -6.890 -7.393 1.683
281 HA GLU 37 HA GLU 37 -5.414 -8.730 3.794
282 HB2 GLU 37 2HB GLU 37 -6.991 -10.621 3.707
283 HB3 GLU 37 1HB GLU 37 -7.741 -9.143 4.277
284 HG2 GLU 37 2HG GLU 37 -8.811 -8.835 2.128
285 HG3 GLU 37 1HG GLU 37 -7.998 -10.270 1.497
286 H THR 38 H THR 38 -3.944 -10.080 3.177
287 HA THR 38 HA THR 38 -3.871 -10.866 0.351
288 HB THR 38 HB THR 38 -1.340 -10.756 0.691
289 HG1 THR 38 1HG THR 38 -1.844 -8.893 2.724
290 HG21 THR 38 3HG2 THR 38 -2.550 -9.070 -0.616
291 HG22 THR 38 1HG2 THR 38 -1.250 -8.323 0.316
292 HG23 THR 38 2HG2 THR 38 -2.920 -8.183 0.865
293 H GLY 39 H GLY 39 -4.884 -12.223 2.802
294 HA2 GLY 39 2HA GLY 39 -4.825 -14.562 3.210
295 HA3 GLY 39 1HA GLY 39 -3.104 -14.561 2.803
296 H GLU 40 H GLU 40 -2.366 -12.321 4.117
297 HA GLU 40 HA GLU 40 -2.561 -13.055 6.937
298 HB2 GLU 40 2HB GLU 40 -0.283 -13.025 6.054
299 HB3 GLU 40 1HB GLU 40 -0.537 -11.433 5.365
300 HG2 GLU 40 2HG GLU 40 0.838 -11.273 7.336
301 HG3 GLU 40 1HG GLU 40 -0.709 -10.492 7.622
302 H ALA 41 H ALA 41 -3.287 -11.529 8.368
303 HA ALA 41 HA ALA 41 -4.660 -9.235 7.208
304 HB1 ALA 41 1HB ALA 41 -5.959 -10.680 8.711
305 HB2 ALA 41 2HB ALA 41 -5.784 -9.065 9.396
306 HB3 ALA 41 3HB ALA 41 -4.795 -10.390 10.003
307 H GLY 42 H GLY 42 -3.280 -7.632 6.937
308 HA2 GLY 42 2HA GLY 42 -2.378 -5.845 8.615
309 HA3 GLY 42 1HA GLY 42 -1.217 -7.131 8.947
310 H TRP 43 H TRP 43 -1.391 -8.049 6.174
311 HA TRP 43 HA TRP 43 0.346 -6.031 5.025
312 HD1 TRP 43 HD TRP 43 1.152 -8.964 7.107
313 HE1 TRP 43 1HE TRP 43 3.644 -8.885 7.751
314 HE3 TRP 43 3HE TRP 43 3.074 -7.184 2.718
315 HZ2 TRP 43 2HZ TRP 43 6.098 -8.188 6.553
316 HZ3 TRP 43 3HZ TRP 43 5.496 -6.835 2.549
317 HH2 TRP 43 HH TRP 43 6.979 -7.329 4.425
318 HB2 TRP 43 2HB TRP 43 0.036 -8.980 4.507
319 HB3 TRP 43 1HB TRP 43 0.868 -7.930 3.367
320 H TRP 44 H TRP 44 -0.245 -4.887 3.408
321 HA TRP 44 HA TRP 44 -2.873 -5.369 2.216
322 HD1 TRP 44 HD TRP 44 -3.478 -5.040 4.439
323 HE1 TRP 44 1HE TRP 44 -5.123 -3.837 5.954
324 HE3 TRP 44 3HE TRP 44 -2.933 -0.305 2.605
325 HZ2 TRP 44 2HZ TRP 44 -6.086 -1.215 6.355
326 HZ3 TRP 44 3HZ TRP 44 -4.258 1.504 3.630
327 HH2 TRP 44 HH TRP 44 -5.805 1.045 5.464
328 HB2 TRP 44 2HB TRP 44 -1.276 -2.877 2.757
329 HB3 TRP 44 1HB TRP 44 -2.575 -2.895 1.579
330 H LYS 45 H LYS 45 -3.080 -4.952 0.062
331 HA LYS 45 HA LYS 45 -0.601 -5.125 -1.504
332 HB2 LYS 45 2HB LYS 45 -2.020 -7.158 -1.643
333 HB3 LYS 45 1HB LYS 45 -3.401 -6.170 -2.045
334 HG2 LYS 45 2HG LYS 45 -2.302 -5.573 -4.183
335 HG3 LYS 45 1HG LYS 45 -0.976 -6.665 -3.766
336 HD2 LYS 45 2HD LYS 45 -2.466 -8.561 -3.710
337 HD3 LYS 45 1HD LYS 45 -3.871 -7.519 -3.910
338 HE2 LYS 45 2HE LYS 45 -3.423 -8.563 -6.009
339 HE3 LYS 45 1HE LYS 45 -2.979 -6.868 -6.145
340 HZ1 LYS 45 3HZ LYS 45 -0.589 -7.702 -5.681
341 HZ2 LYS 45 1HZ LYS 45 -1.322 -8.038 -7.169
342 HZ3 LYS 45 2HZ LYS 45 -1.220 -9.226 -5.993
343 H GLY 46 H GLY 46 -0.333 -3.434 -2.837
344 HA2 GLY 46 2HA GLY 46 -2.618 -1.817 -3.599
345 HA3 GLY 46 1HA GLY 46 -1.374 -1.035 -2.633
346 H GLU 47 H GLU 47 -2.050 -0.208 -5.134
347 HA GLU 47 HA GLU 47 0.305 -0.979 -6.662
348 HB2 GLU 47 2HB GLU 47 -1.666 -1.792 -7.758
349 HB3 GLU 47 1HB GLU 47 -2.445 -0.226 -7.665
350 HG2 GLU 47 2HG GLU 47 0.108 -0.473 -9.181
351 HG3 GLU 47 1HG GLU 47 -1.359 -1.135 -9.892
352 H LEU 48 H LEU 48 1.635 0.459 -7.207
353 HA LEU 48 HA LEU 48 0.948 3.277 -7.243
354 HG LEU 48 HG LEU 48 3.951 4.208 -6.762
355 HB2 LEU 48 2HB LEU 48 1.890 2.866 -5.009
356 HB3 LEU 48 1HB LEU 48 3.264 2.064 -5.737
357 HD11 LEU 48 1HD1 LEU 48 2.945 6.294 -5.989
358 HD12 LEU 48 2HD1 LEU 48 1.693 5.378 -5.154
359 HD13 LEU 48 3HD1 LEU 48 1.811 5.309 -6.914
360 HD21 LEU 48 3HD2 LEU 48 3.594 4.281 -3.769
361 HD22 LEU 48 1HD2 LEU 48 4.733 5.258 -4.695
362 HD23 LEU 48 2HD2 LEU 48 4.914 3.507 -4.645
363 H ASN 49 H ASN 49 1.703 4.098 -9.054
364 HA ASN 49 HA ASN 49 2.899 4.535 -10.903
365 HB2 ASN 49 2HB ASN 49 5.063 2.766 -9.722
366 HB3 ASN 49 1HB ASN 49 5.259 3.857 -11.087
367 HD21 ASN 49 1HD2 ASN 49 6.662 3.780 -8.570
368 HD22 ASN 49 2HD2 ASN 49 6.407 5.313 -7.815
369 H GLY 50 H GLY 50 1.266 1.966 -10.468
370 HA2 GLY 50 2HA GLY 50 0.493 0.571 -12.175
371 HA3 GLY 50 1HA GLY 50 2.021 0.790 -13.023
372 H LYS 51 H LYS 51 2.794 0.291 -9.856
373 HA LYS 51 HA LYS 51 3.203 -2.548 -10.365
374 HB2 LYS 51 2HB LYS 51 4.733 -0.594 -8.658
375 HB3 LYS 51 1HB LYS 51 4.879 -2.324 -8.436
376 HG2 LYS 51 2HG LYS 51 6.713 -1.575 -9.711
377 HG3 LYS 51 1HG LYS 51 5.670 -2.506 -10.765
378 HD2 LYS 51 2HD LYS 51 4.766 -0.472 -11.742
379 HD3 LYS 51 1HD LYS 51 5.726 0.510 -10.632
380 HE2 LYS 51 2HE LYS 51 6.735 0.373 -12.867
381 HE3 LYS 51 1HE LYS 51 7.773 -0.308 -11.623
382 HZ1 LYS 51 3HZ LYS 51 6.067 -1.882 -13.496
383 HZ2 LYS 51 1HZ LYS 51 7.053 -2.526 -12.288
384 HZ3 LYS 51 2HZ LYS 51 7.735 -1.712 -13.575
385 H GLU 52 H GLU 52 2.330 -3.939 -9.089
386 HA GLU 52 HA GLU 52 0.882 -2.944 -6.753
387 HB2 GLU 52 2HB GLU 52 -0.559 -4.986 -6.986
388 HB3 GLU 52 1HB GLU 52 -0.866 -3.787 -8.208
389 HG2 GLU 52 2HG GLU 52 0.523 -5.129 -9.770
390 HG3 GLU 52 1HG GLU 52 0.763 -6.318 -8.494
391 H GLY 53 H GLY 53 1.575 -3.584 -4.928
392 HA2 GLY 53 2HA GLY 53 2.896 -6.163 -4.756
393 HA3 GLY 53 1HA GLY 53 3.812 -4.758 -4.267
394 H VAL 54 H VAL 54 3.755 -6.156 -2.346
395 HA VAL 54 HA VAL 54 1.379 -5.536 -0.734
396 HB VAL 54 HB VAL 54 1.914 -7.479 0.695
397 HG11 VAL 54 1HG1 VAL 54 1.637 -8.195 -2.220
398 HG12 VAL 54 2HG1 VAL 54 0.326 -7.760 -1.127
399 HG13 VAL 54 3HG1 VAL 54 1.241 -9.245 -0.859
400 HG21 VAL 54 3HG2 VAL 54 4.048 -8.076 -1.356
401 HG22 VAL 54 1HG2 VAL 54 3.548 -9.147 -0.049
402 HG23 VAL 54 2HG2 VAL 54 4.319 -7.606 0.323
403 H PHE 55 H PHE 55 1.683 -4.943 1.409
404 HA PHE 55 HA PHE 55 4.299 -4.340 2.405
405 HD1 PHE 55 2HD PHE 55 1.797 -2.488 -0.442
406 HD2 PHE 55 1HD PHE 55 2.099 -0.861 3.479
407 HE1 PHE 55 2HE PHE 55 -0.321 -1.294 -0.778
408 HE2 PHE 55 1HE PHE 55 -0.019 0.340 3.146
409 HZ PHE 55 HZ PHE 55 -1.234 0.125 1.012
410 HB2 PHE 55 2HB PHE 55 4.061 -1.904 2.373
411 HB3 PHE 55 1HB PHE 55 3.853 -2.593 0.756
412 HA PRO 56 HA PRO 56 1.828 -4.643 6.166
413 HB2 PRO 56 2HB PRO 56 3.733 -2.880 7.551
414 HB3 PRO 56 1HB PRO 56 3.396 -4.585 7.839
415 HG2 PRO 56 2HG PRO 56 5.722 -3.769 6.753
416 HG3 PRO 56 1HG PRO 56 4.952 -5.300 6.298
417 HD2 PRO 56 2HD PRO 56 4.943 -2.678 4.849
418 HD3 PRO 56 1HD PRO 56 5.161 -4.323 4.214
419 H ASP 57 H ASP 57 0.193 -3.502 7.042
420 HA ASP 57 HA ASP 57 -0.583 -1.091 5.808
421 HB2 ASP 57 2HB ASP 57 -2.628 -1.307 6.866
422 HB3 ASP 57 1HB ASP 57 -2.047 -2.961 6.894
423 H ASN 58 H ASN 58 1.391 -1.539 8.541
424 HA ASN 58 HA ASN 58 0.623 0.836 9.957
425 HB2 ASN 58 2HB ASN 58 2.481 0.437 11.449
426 HB3 ASN 58 1HB ASN 58 1.740 -1.111 11.086
427 HD21 ASN 58 1HD2 ASN 58 4.560 0.850 10.819
428 HD22 ASN 58 2HD2 ASN 58 5.611 -0.361 10.180
429 H PHE 59 H PHE 59 2.092 0.531 7.086
430 HA PHE 59 HA PHE 59 3.812 2.869 7.424
431 HD1 PHE 59 1HD PHE 59 4.307 -0.877 6.868
432 HD2 PHE 59 2HD PHE 59 6.607 2.594 6.071
433 HE1 PHE 59 1HE PHE 59 6.263 -1.939 7.908
434 HE2 PHE 59 2HE PHE 59 8.560 1.556 7.102
435 HZ PHE 59 HZ PHE 59 8.397 -0.718 8.031
436 HB2 PHE 59 2HB PHE 59 3.601 0.816 5.245
437 HB3 PHE 59 1HB PHE 59 4.511 2.309 5.060
438 H ALA 60 H ALA 60 0.624 2.304 6.653
439 HA ALA 60 HA ALA 60 0.555 4.733 5.060
440 HB1 ALA 60 1HB ALA 60 0.655 2.868 3.452
441 HB2 ALA 60 2HB ALA 60 -0.843 3.787 3.357
442 HB3 ALA 60 3HB ALA 60 -0.828 2.211 4.154
443 H VAL 61 H VAL 61 -1.472 5.728 4.980
444 HA VAL 61 HA VAL 61 -3.406 4.810 6.993
445 HB VAL 61 HB VAL 61 -2.242 6.930 7.660
446 HG11 VAL 61 1HG1 VAL 61 -1.780 7.897 5.504
447 HG12 VAL 61 2HG1 VAL 61 -2.700 9.032 6.495
448 HG13 VAL 61 3HG1 VAL 61 -3.504 8.130 5.208
449 HG21 VAL 61 3HG2 VAL 61 -4.249 8.245 8.181
450 HG22 VAL 61 1HG2 VAL 61 -4.476 6.524 8.494
451 HG23 VAL 61 2HG2 VAL 61 -5.170 7.255 7.048
452 H GLN 62 H GLN 62 -5.507 4.651 6.301
453 HA GLN 62 HA GLN 62 -5.930 4.802 3.467
454 HB2 GLN 62 2HB GLN 62 -6.894 3.007 4.877
455 HB3 GLN 62 1HB GLN 62 -7.886 4.220 5.678
456 HG2 GLN 62 2HG GLN 62 -8.958 4.736 3.536
457 HG3 GLN 62 1HG GLN 62 -8.000 3.477 2.763
458 HE21 GLN 62 1HE2 GLN 62 -9.331 3.224 5.963
459 HE22 GLN 62 2HE2 GLN 62 -10.484 2.009 5.569
460 H ILE 63 H ILE 63 -6.518 6.570 2.460
461 HA ILE 63 HA ILE 63 -7.427 8.834 4.030
462 HB ILE 63 HB ILE 63 -7.240 10.136 1.967
463 HG12 ILE 63 2HG1 ILE 63 -6.063 7.610 0.773
464 HG13 ILE 63 1HG1 ILE 63 -7.603 8.338 0.328
465 HG21 ILE 63 1HG2 ILE 63 -5.385 10.072 3.540
466 HG22 ILE 63 2HG2 ILE 63 -4.733 10.091 1.898
467 HG23 ILE 63 3HG2 ILE 63 -4.779 8.585 2.809
468 HD11 ILE 63 3HD1 ILE 63 -4.894 9.590 -0.036
469 HD12 ILE 63 1HD1 ILE 63 -6.431 10.303 -0.515
470 HD13 ILE 63 2HD1 ILE 63 -5.855 8.833 -1.307
471 H SER 64 H SER 64 -8.759 6.442 2.326
472 HA SER 64 HA SER 64 -11.092 7.747 1.340
473 HG SER 64 HG SER 64 -10.310 6.356 -0.527
474 HB2 SER 64 2HB SER 64 -10.545 4.818 1.813
475 HB3 SER 64 1HB SER 64 -11.814 5.503 0.788
Start of MODEL 7
1 H1 GLY 1 1HT GLY 1 -10.658 -7.211 -6.268
2 H2 GLY 1 2HT GLY 1 -10.291 -8.798 -5.834
3 H3 GLY 1 3HT GLY 1 -9.260 -7.958 -6.891
4 HA2 GLY 1 1HA GLY 1 -8.293 -8.059 -4.738
5 HA3 GLY 1 2HA GLY 1 -8.778 -6.407 -5.077
6 H ALA 2 H ALA 2 -8.839 -6.032 -2.835
7 HA ALA 2 HA ALA 2 -11.293 -6.986 -1.591
8 HB1 ALA 2 1HB ALA 2 -8.640 -6.934 -0.141
9 HB2 ALA 2 2HB ALA 2 -9.477 -8.406 -0.651
10 HB3 ALA 2 3HB ALA 2 -10.195 -7.340 0.560
11 H MET 3 H MET 3 -12.117 -5.024 -2.065
12 HA MET 3 HA MET 3 -12.667 -2.898 -1.881
13 HB2 MET 3 2HB MET 3 -11.287 -3.096 0.808
14 HB3 MET 3 1HB MET 3 -12.271 -1.729 0.304
15 HG2 MET 3 2HG MET 3 -14.220 -3.175 0.121
16 HG3 MET 3 1HG MET 3 -13.236 -4.564 0.566
17 HE1 MET 3 3HE MET 3 -15.976 -3.787 1.984
18 HE2 MET 3 1HE MET 3 -15.572 -4.029 3.683
19 HE3 MET 3 2HE MET 3 -15.014 -5.183 2.475
20 H GLY 4 H GLY 4 -11.415 -2.370 -3.659
21 HA2 GLY 4 2HA GLY 4 -9.357 -0.452 -2.993
22 HA3 GLY 4 1HA GLY 4 -8.873 -1.823 -3.978
23 H ALA 5 H ALA 5 -11.490 0.522 -3.843
24 HA ALA 5 HA ALA 5 -11.058 0.997 -6.721
25 HB1 ALA 5 1HB ALA 5 -13.469 1.212 -7.070
26 HB2 ALA 5 2HB ALA 5 -13.752 0.822 -5.371
27 HB3 ALA 5 3HB ALA 5 -13.055 -0.387 -6.451
28 H LYS 6 H LYS 6 -12.369 2.212 -3.740
29 HA LYS 6 HA LYS 6 -11.757 4.951 -4.641
30 HB2 LYS 6 2HB LYS 6 -13.623 5.708 -3.098
31 HB3 LYS 6 1HB LYS 6 -14.175 4.797 -4.496
32 HG2 LYS 6 2HG LYS 6 -14.396 2.798 -3.149
33 HG3 LYS 6 1HG LYS 6 -13.758 3.654 -1.752
34 HD2 LYS 6 2HD LYS 6 -15.697 5.129 -1.764
35 HD3 LYS 6 1HD LYS 6 -16.317 4.313 -3.202
36 HE2 LYS 6 2HE LYS 6 -17.412 3.485 -1.164
37 HE3 LYS 6 1HE LYS 6 -16.491 2.219 -1.967
38 HZ1 LYS 6 3HZ LYS 6 -15.575 3.773 0.394
39 HZ2 LYS 6 1HZ LYS 6 -14.703 2.542 -0.355
40 HZ3 LYS 6 2HZ LYS 6 -16.146 2.200 0.445
41 H GLU 7 H GLU 7 -10.612 2.707 -3.152
42 HA GLU 7 HA GLU 7 -10.064 3.823 -0.526
43 HB2 GLU 7 2HB GLU 7 -9.478 1.144 -1.775
44 HB3 GLU 7 1HB GLU 7 -8.880 1.623 -0.201
45 HG2 GLU 7 2HG GLU 7 -10.834 0.165 -0.034
46 HG3 GLU 7 1HG GLU 7 -11.141 1.747 0.658
47 H TYR 8 H TYR 8 -8.416 5.070 -0.370
48 HA TYR 8 HA TYR 8 -5.975 4.500 -1.924
49 HD1 TYR 8 1HD TYR 8 -6.038 5.438 -4.533
50 HD2 TYR 8 2HD TYR 8 -9.073 7.611 -2.496
51 HE1 TYR 8 1HE TYR 8 -7.441 5.370 -6.550
52 HE2 TYR 8 2HE TYR 8 -10.480 7.549 -4.506
53 HH TYR 8 HH TYR 8 -10.223 7.286 -6.926
54 HB2 TYR 8 2HB TYR 8 -6.942 7.344 -1.459
55 HB3 TYR 8 1HB TYR 8 -5.586 6.816 -2.417
56 H CYS 9 H CYS 9 -4.078 4.989 -0.829
57 HA CYS 9 HA CYS 9 -4.459 5.768 1.980
58 HG CYS 9 HG CYS 9 -5.810 3.418 1.656
59 HB2 CYS 9 2HB CYS 9 -2.619 3.595 0.962
60 HB3 CYS 9 1HB CYS 9 -2.851 4.075 2.639
61 H ARG 10 H ARG 10 -2.878 7.051 2.846
62 HA ARG 10 HA ARG 10 -0.804 7.990 0.988
63 HE ARG 10 HE ARG 10 -1.539 11.397 4.815
64 HB2 ARG 10 2HB ARG 10 -2.319 9.752 1.978
65 HB3 ARG 10 1HB ARG 10 -1.726 9.299 3.573
66 HG2 ARG 10 2HG ARG 10 0.577 9.855 2.806
67 HG3 ARG 10 1HG ARG 10 -0.113 10.455 1.305
68 HD2 ARG 10 2HD ARG 10 0.300 12.316 2.767
69 HD3 ARG 10 1HD ARG 10 -1.439 12.088 2.628
70 HH11 ARG 10 1HH1 ARG 10 1.845 12.004 3.915
71 HH12 ARG 10 2HH1 ARG 10 2.414 12.080 5.512
72 HH21 ARG 10 1HH2 ARG 10 -0.731 11.598 7.035
73 HH22 ARG 10 2HH2 ARG 10 0.929 11.824 7.330
74 H THR 11 H THR 11 1.261 7.555 1.490
75 HA THR 11 HA THR 11 1.727 5.723 3.594
76 HB THR 11 HB THR 11 4.068 5.772 2.742
77 HG1 THR 11 1HG THR 11 4.594 7.114 1.171
78 HG21 THR 11 3HG2 THR 11 3.507 4.816 0.563
79 HG22 THR 11 1HG2 THR 11 1.895 5.519 0.662
80 HG23 THR 11 2HG2 THR 11 2.383 4.267 1.804
81 H LEU 12 H LEU 12 2.696 5.990 5.479
82 HA LEU 12 HA LEU 12 3.037 8.723 6.471
83 HG LEU 12 HG LEU 12 0.705 6.689 7.050
84 HB2 LEU 12 2HB LEU 12 2.949 6.073 7.905
85 HB3 LEU 12 1HB LEU 12 3.067 7.639 8.675
86 HD11 LEU 12 1HD1 LEU 12 1.081 6.914 10.036
87 HD12 LEU 12 2HD1 LEU 12 0.959 5.416 9.113
88 HD13 LEU 12 3HD1 LEU 12 -0.425 6.505 9.215
89 HD21 LEU 12 3HD2 LEU 12 -0.408 8.651 8.024
90 HD22 LEU 12 1HD2 LEU 12 0.971 9.114 7.026
91 HD23 LEU 12 2HD2 LEU 12 1.110 9.129 8.781
92 H PHE 13 H PHE 13 4.813 6.012 5.431
93 HA PHE 13 HA PHE 13 7.312 7.135 6.451
94 HD1 PHE 13 1HD PHE 13 4.696 4.631 8.338
95 HD2 PHE 13 2HD PHE 13 8.663 6.008 9.003
96 HE1 PHE 13 1HE PHE 13 4.183 4.927 10.717
97 HE2 PHE 13 2HE PHE 13 8.157 6.315 11.391
98 HZ PHE 13 HZ PHE 13 5.914 5.772 12.254
99 HB2 PHE 13 2HB PHE 13 6.394 4.283 6.729
100 HB3 PHE 13 1HB PHE 13 8.065 4.779 6.968
101 HA PRO 14 HA PRO 14 8.570 5.576 2.429
102 HB2 PRO 14 2HB PRO 14 11.267 5.779 2.720
103 HB3 PRO 14 1HB PRO 14 10.254 7.197 2.442
104 HG2 PRO 14 2HG PRO 14 11.512 6.233 4.959
105 HG3 PRO 14 1HG PRO 14 11.194 7.890 4.420
106 HD2 PRO 14 2HD PRO 14 9.657 6.455 6.256
107 HD3 PRO 14 1HD PRO 14 9.136 7.903 5.378
108 H TYR 15 H TYR 15 8.976 3.506 1.759
109 HA TYR 15 HA TYR 15 10.165 1.599 3.655
110 HD1 TYR 15 2HD TYR 15 8.756 -0.173 5.369
111 HD2 TYR 15 1HD TYR 15 7.607 -0.967 1.363
112 HE1 TYR 15 2HE TYR 15 8.703 -2.567 5.873
113 HE2 TYR 15 1HE TYR 15 7.543 -3.363 1.846
114 HH TYR 15 HH TYR 15 8.455 -4.963 3.464
115 HB2 TYR 15 2HB TYR 15 7.708 1.565 3.901
116 HB3 TYR 15 1HB TYR 15 7.550 1.257 2.185
117 H THR 16 H THR 16 11.374 0.027 2.619
118 HA THR 16 HA THR 16 11.576 0.426 -0.260
119 HB THR 16 HB THR 16 13.673 -0.708 1.597
120 HG1 THR 16 1HG THR 16 13.096 1.535 1.970
121 HG21 THR 16 3HG2 THR 16 15.191 -0.249 -0.290
122 HG22 THR 16 1HG2 THR 16 13.831 0.345 -1.241
123 HG23 THR 16 2HG2 THR 16 13.906 -1.354 -0.782
124 H GLY 17 H GLY 17 10.856 -1.129 -1.509
125 HA2 GLY 17 2HA GLY 17 10.248 -3.696 -0.451
126 HA3 GLY 17 1HA GLY 17 9.950 -3.117 -2.096
127 H THR 18 H THR 18 11.803 -5.020 -0.127
128 HA THR 18 HA THR 18 14.214 -5.031 -1.664
129 HB THR 18 HB THR 18 13.979 -7.186 0.181
130 HG1 THR 18 1HG THR 18 12.214 -5.978 1.133
131 HG21 THR 18 3HG2 THR 18 15.985 -5.908 -0.412
132 HG22 THR 18 1HG2 THR 18 15.716 -5.931 1.347
133 HG23 THR 18 2HG2 THR 18 15.254 -4.507 0.395
134 H ASN 19 H ASN 19 11.303 -6.741 -1.085
135 HA ASN 19 HA ASN 19 12.013 -8.958 -2.816
136 HB2 ASN 19 2HB ASN 19 9.485 -8.306 -1.312
137 HB3 ASN 19 1HB ASN 19 9.687 -9.727 -2.310
138 HD21 ASN 19 1HD2 ASN 19 9.044 -9.544 0.468
139 HD22 ASN 19 2HD2 ASN 19 10.275 -10.394 1.327
140 H GLU 20 H GLU 20 10.787 -9.424 -4.717
141 HA GLU 20 HA GLU 20 10.307 -7.225 -6.403
142 HB2 GLU 20 2HB GLU 20 9.357 -10.049 -6.648
143 HB3 GLU 20 1HB GLU 20 9.266 -8.860 -7.937
144 HG2 GLU 20 2HG GLU 20 11.702 -8.707 -7.947
145 HG3 GLU 20 1HG GLU 20 11.776 -9.910 -6.655
146 H ASP 21 H ASP 21 8.116 -9.185 -4.480
147 HA ASP 21 HA ASP 21 5.774 -7.796 -5.505
148 HB2 ASP 21 2HB ASP 21 4.460 -9.401 -4.242
149 HB3 ASP 21 1HB ASP 21 5.700 -10.261 -5.141
150 H GLU 22 H GLU 22 7.991 -6.813 -3.562
151 HA GLU 22 HA GLU 22 6.187 -5.739 -1.515
152 HB2 GLU 22 2HB GLU 22 8.082 -7.121 -0.716
153 HB3 GLU 22 1HB GLU 22 9.204 -6.036 -1.519
154 HG2 GLU 22 2HG GLU 22 8.435 -4.247 0.011
155 HG3 GLU 22 1HG GLU 22 7.394 -5.427 0.787
156 H LEU 23 H LEU 23 5.800 -3.613 -1.669
157 HA LEU 23 HA LEU 23 6.891 -2.218 -3.947
158 HG LEU 23 HG LEU 23 4.329 -2.544 -4.689
159 HB2 LEU 23 2HB LEU 23 4.534 -1.958 -2.274
160 HB3 LEU 23 1HB LEU 23 5.238 -0.413 -2.718
161 HD11 LEU 23 1HD1 LEU 23 2.511 -1.003 -5.143
162 HD12 LEU 23 2HD1 LEU 23 3.078 0.063 -3.859
163 HD13 LEU 23 3HD1 LEU 23 2.475 -1.543 -3.467
164 HD21 LEU 23 3HD2 LEU 23 4.612 -0.731 -6.321
165 HD22 LEU 23 1HD2 LEU 23 6.150 -1.164 -5.567
166 HD23 LEU 23 2HD2 LEU 23 5.295 0.290 -5.059
167 H THR 24 H THR 24 8.143 -0.488 -4.008
168 HA THR 24 HA THR 24 9.354 0.454 -1.520
169 HB THR 24 HB THR 24 10.066 0.994 -4.419
170 HG1 THR 24 1HG THR 24 11.825 -0.499 -3.894
171 HG21 THR 24 3HG2 THR 24 11.651 1.486 -1.872
172 HG22 THR 24 1HG2 THR 24 10.907 2.722 -2.885
173 HG23 THR 24 2HG2 THR 24 12.232 1.745 -3.512
174 H PHE 25 H PHE 25 8.489 2.257 -0.709
175 HA PHE 25 HA PHE 25 7.551 4.253 -2.558
176 HD1 PHE 25 2HD PHE 25 5.982 4.543 1.371
177 HD2 PHE 25 1HD PHE 25 5.170 1.194 -1.104
178 HE1 PHE 25 2HE PHE 25 5.342 3.240 3.353
179 HE2 PHE 25 1HE PHE 25 4.527 -0.117 0.867
180 HZ PHE 25 HZ PHE 25 4.610 0.903 3.101
181 HB2 PHE 25 2HB PHE 25 5.565 4.748 -1.076
182 HB3 PHE 25 1HB PHE 25 5.473 3.309 -2.070
183 H ARG 26 H ARG 26 7.242 6.317 -1.672
184 HA ARG 26 HA ARG 26 9.229 6.938 0.380
185 HE ARG 26 HE ARG 26 10.584 10.681 -1.379
186 HB2 ARG 26 2HB ARG 26 7.921 8.499 -1.826
187 HB3 ARG 26 1HB ARG 26 8.810 9.302 -0.551
188 HG2 ARG 26 2HG ARG 26 10.830 8.148 -1.201
189 HG3 ARG 26 1HG ARG 26 9.936 7.235 -2.422
190 HD2 ARG 26 2HD ARG 26 11.196 9.170 -3.301
191 HD3 ARG 26 1HD ARG 26 9.468 9.226 -3.667
192 HH11 ARG 26 1HH1 ARG 26 9.061 10.804 -4.577
193 HH12 ARG 26 2HH1 ARG 26 8.577 12.433 -4.423
194 HH21 ARG 26 1HH2 ARG 26 9.881 12.938 -1.216
195 HH22 ARG 26 2HH2 ARG 26 9.011 13.635 -2.516
196 H GLU 27 H GLU 27 8.427 9.121 1.510
197 HA GLU 27 HA GLU 27 5.899 8.458 2.778
198 HB2 GLU 27 2HB GLU 27 7.822 9.259 4.136
199 HB3 GLU 27 1HB GLU 27 7.789 10.778 3.254
200 HG2 GLU 27 2HG GLU 27 5.447 11.104 4.070
201 HG3 GLU 27 1HG GLU 27 5.681 9.695 5.099
202 H GLY 28 H GLY 28 3.997 9.505 2.331
203 HA2 GLY 28 2HA GLY 28 2.705 11.378 1.694
204 HA3 GLY 28 1HA GLY 28 4.124 12.058 0.907
205 H GLU 29 H GLU 29 3.528 8.768 0.307
206 HA GLU 29 HA GLU 29 2.819 9.393 -2.441
207 HB2 GLU 29 2HB GLU 29 3.645 6.833 -1.069
208 HB3 GLU 29 1HB GLU 29 3.129 6.908 -2.742
209 HG2 GLU 29 2HG GLU 29 5.514 8.316 -1.578
210 HG3 GLU 29 1HG GLU 29 5.550 6.834 -2.532
211 H ILE 30 H ILE 30 0.943 8.759 -3.325
212 HA ILE 30 HA ILE 30 -1.108 7.764 -1.513
213 HB ILE 30 HB ILE 30 -1.386 8.945 -4.301
214 HG12 ILE 30 2HG1 ILE 30 -0.649 10.659 -2.708
215 HG13 ILE 30 1HG1 ILE 30 -2.312 10.952 -3.194
216 HG21 ILE 30 1HG2 ILE 30 -3.803 9.028 -3.812
217 HG22 ILE 30 2HG2 ILE 30 -3.513 8.240 -2.266
218 HG23 ILE 30 3HG2 ILE 30 -3.185 7.378 -3.765
219 HD11 ILE 30 3HD1 ILE 30 -3.071 9.975 -1.070
220 HD12 ILE 30 1HD1 ILE 30 -2.019 11.371 -0.833
221 HD13 ILE 30 2HD1 ILE 30 -1.388 9.742 -0.596
222 H ILE 31 H ILE 31 -1.631 5.740 -1.689
223 HA ILE 31 HA ILE 31 -0.759 4.271 -4.071
224 HB ILE 31 HB ILE 31 -0.979 3.284 -1.201
225 HG12 ILE 31 2HG1 ILE 31 1.422 3.636 -3.011
226 HG13 ILE 31 1HG1 ILE 31 1.036 4.603 -1.592
227 HG21 ILE 31 1HG2 ILE 31 -0.124 1.126 -2.007
228 HG22 ILE 31 2HG2 ILE 31 -0.216 1.718 -3.668
229 HG23 ILE 31 3HG2 ILE 31 -1.689 1.520 -2.723
230 HD11 ILE 31 3HD1 ILE 31 1.359 2.628 -0.176
231 HD12 ILE 31 1HD1 ILE 31 2.801 3.003 -1.120
232 HD13 ILE 31 2HD1 ILE 31 1.748 1.675 -1.607
233 H HIS 32 H HIS 32 -2.199 2.914 -5.001
234 HA HIS 32 HA HIS 32 -4.987 3.281 -4.268
235 HD1 HIS 32 1HD HIS 32 -6.530 3.646 -7.701
236 HD2 HIS 32 2HD HIS 32 -2.627 4.728 -6.789
237 HE1 HIS 32 1HE HIS 32 -6.116 5.830 -8.885
238 HB2 HIS 32 2HB HIS 32 -3.633 1.906 -6.605
239 HB3 HIS 32 1HB HIS 32 -5.370 1.902 -6.364
240 H LEU 33 H LEU 33 -5.794 1.925 -2.846
241 HA LEU 33 HA LEU 33 -4.448 -0.409 -1.959
242 HG LEU 33 HG LEU 33 -5.345 -0.708 0.509
243 HB2 LEU 33 2HB LEU 33 -6.220 1.171 -0.808
244 HB3 LEU 33 1HB LEU 33 -7.388 0.122 -1.569
245 HD11 LEU 33 1HD1 LEU 33 -7.260 -0.954 1.983
246 HD12 LEU 33 2HD1 LEU 33 -8.322 -0.350 0.715
247 HD13 LEU 33 3HD1 LEU 33 -7.088 0.706 1.411
248 HD21 LEU 33 3HD2 LEU 33 -6.539 -2.826 0.610
249 HD22 LEU 33 1HD2 LEU 33 -5.894 -2.565 -1.006
250 HD23 LEU 33 2HD2 LEU 33 -7.610 -2.309 -0.693
251 H ILE 34 H ILE 34 -4.662 -2.469 -2.696
252 HA ILE 34 HA ILE 34 -6.593 -2.934 -4.866
253 HB ILE 34 HB ILE 34 -3.934 -4.319 -4.357
254 HG12 ILE 34 2HG1 ILE 34 -3.645 -2.070 -5.298
255 HG13 ILE 34 1HG1 ILE 34 -3.191 -3.302 -6.467
256 HG21 ILE 34 1HG2 ILE 34 -5.529 -5.901 -5.273
257 HG22 ILE 34 2HG2 ILE 34 -4.307 -5.505 -6.481
258 HG23 ILE 34 3HG2 ILE 34 -5.915 -4.789 -6.587
259 HD11 ILE 34 3HD1 ILE 34 -5.751 -1.712 -6.430
260 HD12 ILE 34 1HD1 ILE 34 -5.351 -2.976 -7.594
261 HD13 ILE 34 2HD1 ILE 34 -4.393 -1.499 -7.528
262 H SER 35 H SER 35 -4.951 -4.485 -2.101
263 HA SER 35 HA SER 35 -7.407 -5.924 -1.552
264 HG SER 35 HG SER 35 -6.585 -6.566 -3.726
265 HB2 SER 35 2HB SER 35 -4.814 -7.407 -2.043
266 HB3 SER 35 1HB SER 35 -6.345 -8.118 -1.524
267 H LYS 36 H LYS 36 -7.727 -5.514 0.561
268 HA LYS 36 HA LYS 36 -5.639 -5.070 2.450
269 HB2 LYS 36 2HB LYS 36 -8.501 -5.891 2.885
270 HB3 LYS 36 1HB LYS 36 -7.406 -5.331 4.139
271 HG2 LYS 36 2HG LYS 36 -7.275 -3.200 3.061
272 HG3 LYS 36 1HG LYS 36 -8.359 -3.678 1.802
273 HD2 LYS 36 2HD LYS 36 -8.997 -3.471 4.754
274 HD3 LYS 36 1HD LYS 36 -9.587 -2.413 3.478
275 HE2 LYS 36 2HE LYS 36 -11.426 -3.798 3.884
276 HE3 LYS 36 1HE LYS 36 -10.661 -4.562 2.503
277 HZ1 LYS 36 3HZ LYS 36 -9.668 -6.252 4.125
278 HZ2 LYS 36 1HZ LYS 36 -11.345 -6.185 4.137
279 HZ3 LYS 36 2HZ LYS 36 -10.477 -5.449 5.344
280 H GLU 37 H GLU 37 -7.263 -7.840 1.206
281 HA GLU 37 HA GLU 37 -6.198 -9.534 3.334
282 HB2 GLU 37 2HB GLU 37 -7.959 -10.460 1.098
283 HB3 GLU 37 1HB GLU 37 -7.708 -11.195 2.669
284 HG2 GLU 37 2HG GLU 37 -9.190 -8.718 2.024
285 HG3 GLU 37 1HG GLU 37 -9.865 -10.290 2.500
286 H THR 38 H THR 38 -4.272 -10.108 2.848
287 HA THR 38 HA THR 38 -3.628 -10.952 0.094
288 HB THR 38 HB THR 38 -1.265 -10.807 0.853
289 HG1 THR 38 1HG THR 38 -1.050 -10.903 2.943
290 HG21 THR 38 3HG2 THR 38 -2.893 -8.307 1.367
291 HG22 THR 38 1HG2 THR 38 -2.321 -8.856 -0.209
292 HG23 THR 38 2HG2 THR 38 -1.164 -8.351 1.024
293 H GLY 39 H GLY 39 -4.781 -12.099 2.846
294 HA2 GLY 39 2HA GLY 39 -4.894 -14.467 3.362
295 HA3 GLY 39 1HA GLY 39 -3.235 -14.611 2.780
296 H GLU 40 H GLU 40 -2.969 -11.843 4.171
297 HA GLU 40 HA GLU 40 -2.583 -12.813 6.915
298 HB2 GLU 40 2HB GLU 40 -0.852 -10.828 5.416
299 HB3 GLU 40 1HB GLU 40 -0.627 -11.345 7.072
300 HG2 GLU 40 2HG GLU 40 1.044 -12.429 5.810
301 HG3 GLU 40 1HG GLU 40 -0.165 -13.657 6.150
302 H ALA 41 H ALA 41 -3.218 -11.326 8.503
303 HA ALA 41 HA ALA 41 -4.679 -9.032 7.482
304 HB1 ALA 41 1HB ALA 41 -5.814 -10.502 9.114
305 HB2 ALA 41 2HB ALA 41 -5.648 -8.853 9.710
306 HB3 ALA 41 3HB ALA 41 -4.567 -10.114 10.300
307 H GLY 42 H GLY 42 -2.995 -7.720 6.910
308 HA2 GLY 42 2HA GLY 42 -2.073 -5.795 8.554
309 HA3 GLY 42 1HA GLY 42 -0.897 -7.088 8.797
310 H TRP 43 H TRP 43 -1.187 -8.050 6.072
311 HA TRP 43 HA TRP 43 0.475 -6.066 4.806
312 HD1 TRP 43 HD TRP 43 0.998 -9.850 6.249
313 HE1 TRP 43 1HE TRP 43 3.494 -10.066 6.810
314 HE3 TRP 43 3HE TRP 43 2.903 -6.668 2.740
315 HZ2 TRP 43 2HZ TRP 43 5.959 -9.008 5.893
316 HZ3 TRP 43 3HZ TRP 43 5.333 -6.328 2.646
317 HH2 TRP 43 HH TRP 43 6.828 -7.470 4.184
318 HB2 TRP 43 2HB TRP 43 -0.249 -8.901 4.064
319 HB3 TRP 43 1HB TRP 43 0.669 -7.839 3.009
320 H TRP 44 H TRP 44 -0.317 -4.684 3.481
321 HA TRP 44 HA TRP 44 -2.906 -5.223 2.264
322 HD1 TRP 44 HD TRP 44 -3.724 -5.155 4.433
323 HE1 TRP 44 1HE TRP 44 -5.722 -4.235 5.751
324 HE3 TRP 44 3HE TRP 44 -3.594 -0.321 2.800
325 HZ2 TRP 44 2HZ TRP 44 -7.076 -1.781 6.044
326 HZ3 TRP 44 3HZ TRP 44 -5.270 1.245 3.645
327 HH2 TRP 44 HH TRP 44 -6.999 0.510 5.235
328 HB2 TRP 44 2HB TRP 44 -1.584 -2.712 3.200
329 HB3 TRP 44 1HB TRP 44 -2.687 -2.634 1.835
330 H LYS 45 H LYS 45 -3.019 -5.299 0.169
331 HA LYS 45 HA LYS 45 -0.525 -4.926 -1.292
332 HB2 LYS 45 2HB LYS 45 -1.818 -7.114 -1.508
333 HB3 LYS 45 1HB LYS 45 -3.104 -6.187 -2.253
334 HG2 LYS 45 2HG LYS 45 -1.710 -5.577 -4.088
335 HG3 LYS 45 1HG LYS 45 -0.303 -6.300 -3.319
336 HD2 LYS 45 2HD LYS 45 -1.450 -8.507 -3.444
337 HD3 LYS 45 1HD LYS 45 -2.741 -7.734 -4.369
338 HE2 LYS 45 2HE LYS 45 -1.119 -7.018 -6.044
339 HE3 LYS 45 1HE LYS 45 0.172 -7.780 -5.126
340 HZ1 LYS 45 3HZ LYS 45 -0.841 -9.917 -5.532
341 HZ2 LYS 45 1HZ LYS 45 -0.564 -9.104 -6.979
342 HZ3 LYS 45 2HZ LYS 45 -2.119 -9.179 -6.374
343 H GLY 46 H GLY 46 -0.317 -3.305 -2.633
344 HA2 GLY 46 2HA GLY 46 -2.669 -1.805 -3.465
345 HA3 GLY 46 1HA GLY 46 -1.414 -0.957 -2.575
346 H GLU 47 H GLU 47 -2.060 -0.166 -5.070
347 HA GLU 47 HA GLU 47 0.128 -1.186 -6.740
348 HB2 GLU 47 2HB GLU 47 -2.144 -1.429 -7.695
349 HB3 GLU 47 1HB GLU 47 -2.359 0.304 -7.555
350 HG2 GLU 47 2HG GLU 47 -0.472 0.644 -9.100
351 HG3 GLU 47 1HG GLU 47 -0.348 -1.102 -9.290
352 H LEU 48 H LEU 48 1.714 0.111 -7.213
353 HA LEU 48 HA LEU 48 1.331 2.978 -7.295
354 HG LEU 48 HG LEU 48 4.309 3.757 -6.621
355 HB2 LEU 48 2HB LEU 48 2.065 2.564 -4.988
356 HB3 LEU 48 1HB LEU 48 3.451 1.672 -5.578
357 HD11 LEU 48 1HD1 LEU 48 2.006 5.062 -5.188
358 HD12 LEU 48 2HD1 LEU 48 2.230 4.945 -6.935
359 HD13 LEU 48 3HD1 LEU 48 3.350 5.901 -5.965
360 HD21 LEU 48 3HD2 LEU 48 3.757 3.927 -3.664
361 HD22 LEU 48 1HD2 LEU 48 5.001 4.825 -4.534
362 HD23 LEU 48 2HD2 LEU 48 5.094 3.067 -4.429
363 H ASN 49 H ASN 49 2.070 3.532 -9.205
364 HA ASN 49 HA ASN 49 3.346 3.830 -11.010
365 HB2 ASN 49 2HB ASN 49 5.537 2.801 -9.192
366 HB3 ASN 49 1HB ASN 49 5.844 3.395 -10.820
367 HD21 ASN 49 1HD2 ASN 49 6.816 4.441 -8.294
368 HD22 ASN 49 2HD2 ASN 49 6.248 6.061 -8.176
369 H GLY 50 H GLY 50 1.866 1.473 -10.799
370 HA2 GLY 50 2HA GLY 50 1.514 -0.047 -12.546
371 HA3 GLY 50 1HA GLY 50 3.230 -0.002 -12.908
372 H LYS 51 H LYS 51 3.372 -0.390 -9.715
373 HA LYS 51 HA LYS 51 3.297 -3.294 -10.014
374 HB2 LYS 51 2HB LYS 51 4.914 -1.506 -8.251
375 HB3 LYS 51 1HB LYS 51 4.664 -3.188 -7.832
376 HG2 LYS 51 2HG LYS 51 6.748 -3.019 -8.851
377 HG3 LYS 51 1HG LYS 51 5.687 -3.782 -10.011
378 HD2 LYS 51 2HD LYS 51 5.447 -1.741 -11.258
379 HD3 LYS 51 1HD LYS 51 6.368 -0.848 -10.043
380 HE2 LYS 51 2HE LYS 51 7.705 -1.426 -12.030
381 HE3 LYS 51 1HE LYS 51 8.343 -2.115 -10.542
382 HZ1 LYS 51 3HZ LYS 51 7.348 -4.234 -11.142
383 HZ2 LYS 51 1HZ LYS 51 8.382 -3.694 -12.336
384 HZ3 LYS 51 2HZ LYS 51 6.715 -3.580 -12.556
385 H GLU 52 H GLU 52 1.900 -4.370 -8.943
386 HA GLU 52 HA GLU 52 0.992 -3.137 -6.543
387 HB2 GLU 52 2HB GLU 52 -1.159 -4.597 -6.683
388 HB3 GLU 52 1HB GLU 52 -1.040 -3.116 -7.596
389 HG2 GLU 52 2HG GLU 52 -2.101 -4.643 -8.938
390 HG3 GLU 52 1HG GLU 52 -0.478 -4.527 -9.600
391 H GLY 53 H GLY 53 1.660 -3.731 -4.936
392 HA2 GLY 53 2HA GLY 53 2.444 -6.535 -4.543
393 HA3 GLY 53 1HA GLY 53 3.623 -5.255 -4.276
394 H VAL 54 H VAL 54 3.568 -6.333 -2.125
395 HA VAL 54 HA VAL 54 1.290 -5.335 -0.575
396 HB VAL 54 HB VAL 54 1.694 -7.168 1.033
397 HG11 VAL 54 1HG1 VAL 54 0.806 -8.978 -0.345
398 HG12 VAL 54 2HG1 VAL 54 1.248 -8.075 -1.797
399 HG13 VAL 54 3HG1 VAL 54 0.031 -7.433 -0.696
400 HG21 VAL 54 3HG2 VAL 54 3.132 -9.063 0.389
401 HG22 VAL 54 1HG2 VAL 54 4.058 -7.576 0.600
402 HG23 VAL 54 2HG2 VAL 54 3.677 -8.155 -1.021
403 H PHE 55 H PHE 55 1.617 -4.558 1.424
404 HA PHE 55 HA PHE 55 4.274 -4.122 2.425
405 HD1 PHE 55 1HD PHE 55 1.962 -0.753 3.580
406 HD2 PHE 55 2HD PHE 55 1.920 -2.091 -0.464
407 HE1 PHE 55 1HE PHE 55 -0.163 0.437 3.207
408 HE2 PHE 55 2HE PHE 55 -0.202 -0.907 -0.833
409 HZ PHE 55 HZ PHE 55 -1.244 0.359 1.004
410 HB2 PHE 55 2HB PHE 55 4.009 -1.654 2.480
411 HB3 PHE 55 1HB PHE 55 3.888 -2.297 0.838
412 HA PRO 56 HA PRO 56 1.774 -4.505 6.134
413 HB2 PRO 56 2HB PRO 56 3.721 -2.776 7.540
414 HB3 PRO 56 1HB PRO 56 3.293 -4.452 7.865
415 HG2 PRO 56 2HG PRO 56 5.669 -3.815 6.800
416 HG3 PRO 56 1HG PRO 56 4.804 -5.289 6.329
417 HD2 PRO 56 2HD PRO 56 4.995 -2.667 4.885
418 HD3 PRO 56 1HD PRO 56 5.111 -4.323 4.245
419 H ASP 57 H ASP 57 0.051 -3.366 6.727
420 HA ASP 57 HA ASP 57 -0.584 -0.939 5.494
421 HB2 ASP 57 2HB ASP 57 -2.684 -1.051 6.479
422 HB3 ASP 57 1HB ASP 57 -2.177 -2.730 6.448
423 H ASN 58 H ASN 58 1.037 -1.422 8.474
424 HA ASN 58 HA ASN 58 0.262 1.005 9.749
425 HB2 ASN 58 2HB ASN 58 2.062 0.578 11.343
426 HB3 ASN 58 1HB ASN 58 1.129 -0.879 11.036
427 HD21 ASN 58 1HD2 ASN 58 4.206 0.637 10.830
428 HD22 ASN 58 2HD2 ASN 58 5.085 -0.719 10.262
429 H PHE 59 H PHE 59 2.215 0.534 7.094
430 HA PHE 59 HA PHE 59 3.876 2.863 7.616
431 HD1 PHE 59 2HD PHE 59 4.245 -0.878 6.947
432 HD2 PHE 59 1HD PHE 59 6.846 2.437 6.482
433 HE1 PHE 59 2HE PHE 59 6.035 -2.117 8.110
434 HE2 PHE 59 1HE PHE 59 8.630 1.222 7.636
435 HZ PHE 59 HZ PHE 59 8.229 -1.063 8.452
436 HB2 PHE 59 2HB PHE 59 3.792 0.919 5.309
437 HB3 PHE 59 1HB PHE 59 4.792 2.365 5.304
438 H ALA 60 H ALA 60 0.760 2.452 6.685
439 HA ALA 60 HA ALA 60 0.752 4.952 5.217
440 HB1 ALA 60 1HB ALA 60 0.855 3.200 3.479
441 HB2 ALA 60 2HB ALA 60 -0.671 4.080 3.453
442 HB3 ALA 60 3HB ALA 60 -0.605 2.469 4.158
443 H VAL 61 H VAL 61 -1.473 5.776 5.000
444 HA VAL 61 HA VAL 61 -3.316 4.612 6.932
445 HB VAL 61 HB VAL 61 -2.240 6.585 7.981
446 HG11 VAL 61 1HG1 VAL 61 -1.689 7.883 6.023
447 HG12 VAL 61 2HG1 VAL 61 -2.638 8.849 7.154
448 HG13 VAL 61 3HG1 VAL 61 -3.399 8.182 5.709
449 HG21 VAL 61 3HG2 VAL 61 -4.279 7.799 8.629
450 HG22 VAL 61 1HG2 VAL 61 -4.519 6.052 8.622
451 HG23 VAL 61 2HG2 VAL 61 -5.145 7.031 7.297
452 H GLN 62 H GLN 62 -5.365 4.470 6.244
453 HA GLN 62 HA GLN 62 -5.932 4.860 3.485
454 HB2 GLN 62 2HB GLN 62 -6.892 3.036 4.908
455 HB3 GLN 62 1HB GLN 62 -7.815 4.247 5.779
456 HG2 GLN 62 2HG GLN 62 -8.935 4.850 3.650
457 HG3 GLN 62 1HG GLN 62 -8.076 3.522 2.874
458 HE21 GLN 62 1HE2 GLN 62 -10.915 3.937 3.188
459 HE22 GLN 62 2HE2 GLN 62 -11.510 2.550 4.039
460 H ILE 63 H ILE 63 -6.495 6.760 2.628
461 HA ILE 63 HA ILE 63 -7.438 8.860 4.437
462 HB ILE 63 HB ILE 63 -7.001 10.438 2.605
463 HG12 ILE 63 2HG1 ILE 63 -5.863 8.045 1.119
464 HG13 ILE 63 1HG1 ILE 63 -7.339 8.904 0.694
465 HG21 ILE 63 1HG2 ILE 63 -4.526 10.273 2.677
466 HG22 ILE 63 2HG2 ILE 63 -4.686 8.644 3.339
467 HG23 ILE 63 3HG2 ILE 63 -5.280 10.030 4.255
468 HD11 ILE 63 3HD1 ILE 63 -5.481 9.543 -0.743
469 HD12 ILE 63 1HD1 ILE 63 -4.556 10.050 0.668
470 HD13 ILE 63 2HD1 ILE 63 -6.029 10.913 0.225
471 H SER 64 H SER 64 -8.469 6.831 1.884
472 HA SER 64 HA SER 64 -11.133 7.799 2.139
473 HG SER 64 HG SER 64 -9.867 9.481 1.127
474 HB2 SER 64 2HB SER 64 -9.652 7.411 -0.475
475 HB3 SER 64 1HB SER 64 -11.364 7.814 -0.290
Start of MODEL 8
1 H1 GLY 1 1HT GLY 1 -11.795 -9.606 3.188
2 H2 GLY 1 2HT GLY 1 -12.637 -8.143 3.239
3 H3 GLY 1 3HT GLY 1 -11.077 -8.201 3.818
4 HA2 GLY 1 1HA GLY 1 -10.294 -8.706 1.550
5 HA3 GLY 1 2HA GLY 1 -11.955 -8.472 1.020
6 H ALA 2 H ALA 2 -11.628 -6.689 -0.200
7 HA ALA 2 HA ALA 2 -11.121 -4.204 1.223
8 HB1 ALA 2 1HB ALA 2 -9.972 -5.011 -1.472
9 HB2 ALA 2 2HB ALA 2 -9.051 -4.680 0.001
10 HB3 ALA 2 3HB ALA 2 -9.919 -3.379 -0.805
11 H MET 3 H MET 3 -12.332 -2.481 0.190
12 HA MET 3 HA MET 3 -14.675 -3.713 -1.054
13 HB2 MET 3 2HB MET 3 -15.172 -2.673 1.086
14 HB3 MET 3 1HB MET 3 -14.526 -1.143 0.515
15 HG2 MET 3 2HG MET 3 -16.321 -0.915 -1.081
16 HG3 MET 3 1HG MET 3 -16.917 -2.523 -0.695
17 HE1 MET 3 3HE MET 3 -17.016 0.972 2.336
18 HE2 MET 3 1HE MET 3 -16.271 1.090 0.743
19 HE3 MET 3 2HE MET 3 -15.563 0.047 1.983
20 H GLY 4 H GLY 4 -14.177 -3.709 -3.120
21 HA2 GLY 4 2HA GLY 4 -14.631 -2.833 -5.204
22 HA3 GLY 4 1HA GLY 4 -14.787 -1.260 -4.447
23 H ALA 5 H ALA 5 -11.912 -2.259 -3.354
24 HA ALA 5 HA ALA 5 -9.748 -1.665 -3.759
25 HB1 ALA 5 1HB ALA 5 -9.929 -3.372 -5.545
26 HB2 ALA 5 2HB ALA 5 -8.841 -2.064 -6.016
27 HB3 ALA 5 3HB ALA 5 -10.478 -2.126 -6.669
28 H LYS 6 H LYS 6 -11.875 0.306 -3.771
29 HA LYS 6 HA LYS 6 -10.718 2.493 -5.384
30 HB2 LYS 6 2HB LYS 6 -13.471 2.212 -4.148
31 HB3 LYS 6 1HB LYS 6 -12.915 3.603 -5.067
32 HG2 LYS 6 2HG LYS 6 -12.701 2.292 -7.042
33 HG3 LYS 6 1HG LYS 6 -13.069 0.814 -6.154
34 HD2 LYS 6 2HD LYS 6 -15.307 1.709 -5.669
35 HD3 LYS 6 1HD LYS 6 -14.924 3.138 -6.630
36 HE2 LYS 6 2HE LYS 6 -16.204 1.523 -7.931
37 HE3 LYS 6 1HE LYS 6 -14.594 1.751 -8.609
38 HZ1 LYS 6 3HZ LYS 6 -15.166 -0.583 -8.589
39 HZ2 LYS 6 1HZ LYS 6 -15.521 -0.534 -6.954
40 HZ3 LYS 6 2HZ LYS 6 -13.926 -0.358 -7.480
41 H GLU 7 H GLU 7 -9.811 1.376 -2.919
42 HA GLU 7 HA GLU 7 -10.301 3.505 -0.994
43 HB2 GLU 7 2HB GLU 7 -8.982 0.789 -0.599
44 HB3 GLU 7 1HB GLU 7 -9.502 1.903 0.666
45 HG2 GLU 7 2HG GLU 7 -11.845 1.602 -0.048
46 HG3 GLU 7 1HG GLU 7 -11.317 0.461 -1.269
47 H TYR 8 H TYR 8 -8.513 4.749 -0.374
48 HA TYR 8 HA TYR 8 -6.012 4.142 -1.807
49 HD1 TYR 8 2HD TYR 8 -5.720 5.111 -4.480
50 HD2 TYR 8 1HD TYR 8 -9.307 6.635 -2.791
51 HE1 TYR 8 2HE TYR 8 -6.909 4.658 -6.589
52 HE2 TYR 8 1HE TYR 8 -10.500 6.184 -4.892
53 HH TYR 8 HH TYR 8 -9.060 4.311 -7.386
54 HB2 TYR 8 2HB TYR 8 -7.170 6.946 -1.644
55 HB3 TYR 8 1HB TYR 8 -5.689 6.453 -2.428
56 H CYS 9 H CYS 9 -4.189 4.604 -0.717
57 HA CYS 9 HA CYS 9 -4.592 5.728 1.943
58 HG CYS 9 HG CYS 9 -2.425 1.633 1.423
59 HB2 CYS 9 2HB CYS 9 -2.855 4.104 2.732
60 HB3 CYS 9 1HB CYS 9 -4.378 3.380 2.245
61 H ARG 10 H ARG 10 -2.954 6.934 2.795
62 HA ARG 10 HA ARG 10 -0.878 7.761 0.889
63 HE ARG 10 HE ARG 10 -2.070 11.697 4.179
64 HB2 ARG 10 2HB ARG 10 -2.378 9.604 1.677
65 HB3 ARG 10 1HB ARG 10 -1.893 9.240 3.330
66 HG2 ARG 10 2HG ARG 10 0.435 9.778 2.756
67 HG3 ARG 10 1HG ARG 10 -0.080 10.200 1.126
68 HD2 ARG 10 2HD ARG 10 0.198 12.186 2.511
69 HD3 ARG 10 1HD ARG 10 -1.484 11.980 2.030
70 HH11 ARG 10 1HH1 ARG 10 1.487 11.338 4.054
71 HH12 ARG 10 2HH1 ARG 10 1.699 11.563 5.708
72 HH21 ARG 10 1HH2 ARG 10 -1.709 11.990 6.519
73 HH22 ARG 10 2HH2 ARG 10 -0.116 11.946 7.120
74 H THR 11 H THR 11 1.187 7.495 1.486
75 HA THR 11 HA THR 11 1.627 5.745 3.668
76 HB THR 11 HB THR 11 3.969 5.759 2.807
77 HG1 THR 11 1HG THR 11 4.417 6.963 1.054
78 HG21 THR 11 3HG2 THR 11 1.761 5.374 0.790
79 HG22 THR 11 1HG2 THR 11 2.272 4.194 1.995
80 HG23 THR 11 2HG2 THR 11 3.374 4.669 0.702
81 H LEU 12 H LEU 12 2.605 6.100 5.508
82 HA LEU 12 HA LEU 12 3.063 8.875 6.354
83 HG LEU 12 HG LEU 12 0.594 7.027 6.993
84 HB2 LEU 12 2HB LEU 12 2.775 6.332 7.952
85 HB3 LEU 12 1HB LEU 12 2.967 7.934 8.625
86 HD11 LEU 12 1HD1 LEU 12 0.699 5.881 9.137
87 HD12 LEU 12 2HD1 LEU 12 -0.606 7.067 9.133
88 HD13 LEU 12 3HD1 LEU 12 0.904 7.421 9.967
89 HD21 LEU 12 3HD2 LEU 12 1.116 9.551 8.562
90 HD22 LEU 12 1HD2 LEU 12 -0.418 9.114 7.807
91 HD23 LEU 12 2HD2 LEU 12 0.998 9.418 6.807
92 H PHE 13 H PHE 13 4.658 5.972 5.537
93 HA PHE 13 HA PHE 13 7.232 7.051 6.343
94 HD1 PHE 13 2HD PHE 13 8.468 6.486 8.959
95 HD2 PHE 13 1HD PHE 13 4.604 4.742 8.677
96 HE1 PHE 13 2HE PHE 13 7.976 7.212 11.253
97 HE2 PHE 13 1HE PHE 13 4.100 5.463 10.966
98 HZ PHE 13 HZ PHE 13 5.784 6.701 12.262
99 HB2 PHE 13 2HB PHE 13 6.262 4.261 7.044
100 HB3 PHE 13 1HB PHE 13 7.918 4.814 7.221
101 HA PRO 14 HA PRO 14 8.032 4.991 2.433
102 HB2 PRO 14 2HB PRO 14 10.711 4.949 2.397
103 HB3 PRO 14 1HB PRO 14 9.820 6.473 2.281
104 HG2 PRO 14 2HG PRO 14 11.205 5.269 4.633
105 HG3 PRO 14 1HG PRO 14 11.145 6.963 4.108
106 HD2 PRO 14 2HD PRO 14 9.566 5.873 6.106
107 HD3 PRO 14 1HD PRO 14 9.175 7.340 5.195
108 H TYR 15 H TYR 15 8.605 2.943 1.630
109 HA TYR 15 HA TYR 15 9.722 0.995 3.503
110 HD1 TYR 15 1HD TYR 15 8.345 -0.832 5.125
111 HD2 TYR 15 2HD TYR 15 7.566 -1.744 1.038
112 HE1 TYR 15 1HE TYR 15 8.581 -3.221 5.617
113 HE2 TYR 15 2HE TYR 15 7.806 -4.132 1.522
114 HH TYR 15 HH TYR 15 8.824 -5.571 3.142
115 HB2 TYR 15 2HB TYR 15 7.222 0.803 3.596
116 HB3 TYR 15 1HB TYR 15 7.213 0.495 1.869
117 H THR 16 H THR 16 11.255 -0.109 2.519
118 HA THR 16 HA THR 16 11.336 -0.000 -0.417
119 HB THR 16 HB THR 16 13.684 -0.342 1.466
120 HG1 THR 16 1HG THR 16 12.510 1.728 1.527
121 HG21 THR 16 3HG2 THR 16 13.531 0.348 -1.482
122 HG22 THR 16 1HG2 THR 16 14.014 -1.213 -0.819
123 HG23 THR 16 2HG2 THR 16 15.012 0.212 -0.537
124 H GLY 17 H GLY 17 10.671 -1.934 -1.204
125 HA2 GLY 17 2HA GLY 17 10.738 -4.293 0.286
126 HA3 GLY 17 1HA GLY 17 10.428 -4.119 -1.438
127 H THR 18 H THR 18 12.036 -6.028 0.130
128 HA THR 18 HA THR 18 14.703 -5.504 -0.899
129 HB THR 18 HB THR 18 15.240 -7.707 0.274
130 HG1 THR 18 1HG THR 18 12.470 -7.570 0.841
131 HG21 THR 18 3HG2 THR 18 14.114 -5.489 1.984
132 HG22 THR 18 1HG2 THR 18 15.737 -5.536 1.295
133 HG23 THR 18 2HG2 THR 18 15.265 -6.716 2.515
134 H ASN 19 H ASN 19 11.832 -7.108 -1.466
135 HA ASN 19 HA ASN 19 12.868 -8.394 -3.896
136 HB2 ASN 19 2HB ASN 19 10.431 -9.080 -2.226
137 HB3 ASN 19 1HB ASN 19 10.890 -9.886 -3.710
138 HD21 ASN 19 1HD2 ASN 19 11.361 -9.586 -0.358
139 HD22 ASN 19 2HD2 ASN 19 12.462 -10.891 -0.157
140 H GLU 20 H GLU 20 11.306 -8.101 -5.695
141 HA GLU 20 HA GLU 20 9.900 -5.587 -5.360
142 HB2 GLU 20 2HB GLU 20 9.633 -5.582 -7.807
143 HB3 GLU 20 1HB GLU 20 11.310 -5.813 -7.349
144 HG2 GLU 20 2HG GLU 20 10.951 -8.258 -7.704
145 HG3 GLU 20 1HG GLU 20 9.387 -7.843 -8.407
146 H ASP 21 H ASP 21 9.231 -8.394 -4.526
147 HA ASP 21 HA ASP 21 6.460 -8.770 -5.280
148 HB2 ASP 21 2HB ASP 21 7.800 -10.695 -4.519
149 HB3 ASP 21 1HB ASP 21 8.162 -9.873 -3.013
150 H GLU 22 H GLU 22 8.397 -7.227 -2.904
151 HA GLU 22 HA GLU 22 6.279 -6.170 -1.275
152 HB2 GLU 22 2HB GLU 22 9.242 -5.777 -1.513
153 HB3 GLU 22 1HB GLU 22 8.270 -4.796 -0.429
154 HG2 GLU 22 2HG GLU 22 7.741 -6.615 0.866
155 HG3 GLU 22 1HG GLU 22 8.396 -7.793 -0.302
156 H LEU 23 H LEU 23 5.754 -3.952 -1.356
157 HA LEU 23 HA LEU 23 6.522 -2.773 -3.910
158 HG LEU 23 HG LEU 23 3.176 -1.271 -4.502
159 HB2 LEU 23 2HB LEU 23 4.072 -3.167 -3.594
160 HB3 LEU 23 1HB LEU 23 4.097 -2.071 -2.241
161 HD11 LEU 23 1HD1 LEU 23 3.534 0.252 -2.645
162 HD12 LEU 23 2HD1 LEU 23 4.047 1.034 -4.141
163 HD13 LEU 23 3HD1 LEU 23 5.247 0.369 -3.038
164 HD21 LEU 23 3HD2 LEU 23 4.970 -2.020 -5.928
165 HD22 LEU 23 1HD2 LEU 23 6.117 -0.976 -5.083
166 HD23 LEU 23 2HD2 LEU 23 4.810 -0.268 -6.025
167 H THR 24 H THR 24 7.640 -1.077 -4.021
168 HA THR 24 HA THR 24 8.645 0.051 -1.533
169 HB THR 24 HB THR 24 9.725 0.168 -4.363
170 HG1 THR 24 1HG THR 24 11.258 -1.268 -3.596
171 HG21 THR 24 3HG2 THR 24 10.371 2.211 -3.217
172 HG22 THR 24 1HG2 THR 24 11.773 1.155 -3.331
173 HG23 THR 24 2HG2 THR 24 10.895 1.313 -1.801
174 H PHE 25 H PHE 25 7.946 1.886 -0.859
175 HA PHE 25 HA PHE 25 7.136 3.929 -2.743
176 HD1 PHE 25 2HD PHE 25 5.933 4.426 1.221
177 HD2 PHE 25 1HD PHE 25 4.592 1.070 -0.992
178 HE1 PHE 25 2HE PHE 25 5.387 3.266 3.316
179 HE2 PHE 25 1HE PHE 25 4.046 -0.086 1.079
180 HZ PHE 25 HZ PHE 25 4.436 1.004 3.244
181 HB2 PHE 25 2HB PHE 25 5.236 4.546 -1.222
182 HB3 PHE 25 1HB PHE 25 5.036 3.044 -2.106
183 H ARG 26 H ARG 26 7.155 6.051 -1.875
184 HA ARG 26 HA ARG 26 9.060 6.362 0.329
185 HE ARG 26 HE ARG 26 11.099 7.711 -4.543
186 HB2 ARG 26 2HB ARG 26 8.032 8.421 -1.644
187 HB3 ARG 26 1HB ARG 26 9.283 8.695 -0.446
188 HG2 ARG 26 2HG ARG 26 10.670 6.979 -1.582
189 HG3 ARG 26 1HG ARG 26 9.431 6.874 -2.835
190 HD2 ARG 26 2HD ARG 26 9.724 9.293 -3.267
191 HD3 ARG 26 1HD ARG 26 11.019 9.320 -2.081
192 HH11 ARG 26 1HH1 ARG 26 12.776 9.718 -2.127
193 HH12 ARG 26 2HH1 ARG 26 14.244 9.736 -3.001
194 HH21 ARG 26 1HH2 ARG 26 13.154 7.766 -5.699
195 HH22 ARG 26 2HH2 ARG 26 14.466 8.604 -4.994
196 H GLU 27 H GLU 27 8.457 8.626 1.545
197 HA GLU 27 HA GLU 27 5.920 8.136 2.831
198 HB2 GLU 27 2HB GLU 27 7.815 8.797 4.197
199 HB3 GLU 27 1HB GLU 27 8.046 10.254 3.243
200 HG2 GLU 27 2HG GLU 27 5.761 10.973 3.985
201 HG3 GLU 27 1HG GLU 27 5.779 9.619 5.112
202 H GLY 28 H GLY 28 4.042 9.231 2.471
203 HA2 GLY 28 2HA GLY 28 2.710 11.075 1.982
204 HA3 GLY 28 1HA GLY 28 4.124 11.888 1.326
205 H GLU 29 H GLU 29 3.287 8.681 0.328
206 HA GLU 29 HA GLU 29 2.634 9.771 -2.313
207 HB2 GLU 29 2HB GLU 29 3.511 6.974 -1.542
208 HB3 GLU 29 1HB GLU 29 3.271 7.568 -3.175
209 HG2 GLU 29 2HG GLU 29 5.362 8.562 -1.248
210 HG3 GLU 29 1HG GLU 29 5.645 7.423 -2.552
211 H ILE 30 H ILE 30 0.814 8.858 -3.403
212 HA ILE 30 HA ILE 30 -1.217 7.751 -1.591
213 HB ILE 30 HB ILE 30 -1.561 8.962 -4.359
214 HG12 ILE 30 2HG1 ILE 30 -0.871 10.657 -2.700
215 HG13 ILE 30 1HG1 ILE 30 -2.520 10.935 -3.246
216 HG21 ILE 30 1HG2 ILE 30 -3.649 8.131 -2.330
217 HG22 ILE 30 2HG2 ILE 30 -3.311 7.339 -3.863
218 HG23 ILE 30 3HG2 ILE 30 -3.980 8.967 -3.847
219 HD11 ILE 30 3HD1 ILE 30 -2.304 11.321 -0.866
220 HD12 ILE 30 1HD1 ILE 30 -1.677 9.691 -0.631
221 HD13 ILE 30 2HD1 ILE 30 -3.343 9.926 -1.158
222 H ILE 31 H ILE 31 -1.754 5.687 -1.816
223 HA ILE 31 HA ILE 31 -0.721 4.254 -4.168
224 HB ILE 31 HB ILE 31 -1.241 3.217 -1.356
225 HG12 ILE 31 2HG1 ILE 31 1.346 3.615 -2.866
226 HG13 ILE 31 1HG1 ILE 31 0.782 4.585 -1.508
227 HG21 ILE 31 1HG2 ILE 31 -0.254 1.097 -2.106
228 HG22 ILE 31 2HG2 ILE 31 -0.164 1.724 -3.752
229 HG23 ILE 31 3HG2 ILE 31 -1.735 1.477 -2.989
230 HD11 ILE 31 3HD1 ILE 31 2.489 2.996 -0.826
231 HD12 ILE 31 1HD1 ILE 31 1.495 1.664 -1.414
232 HD13 ILE 31 2HD1 ILE 31 0.945 2.640 -0.050
233 H HIS 32 H HIS 32 -2.085 2.851 -5.255
234 HA HIS 32 HA HIS 32 -4.935 3.201 -4.761
235 HD1 HIS 32 1HD HIS 32 -2.686 2.784 -8.997
236 HD2 HIS 32 2HD HIS 32 -4.943 5.279 -6.536
237 HE1 HIS 32 1HE HIS 32 -2.541 5.087 -9.993
238 HB2 HIS 32 2HB HIS 32 -3.533 1.600 -6.943
239 HB3 HIS 32 1HB HIS 32 -5.230 2.044 -6.904
240 H LEU 33 H LEU 33 -5.647 1.892 -3.172
241 HA LEU 33 HA LEU 33 -4.210 -0.439 -2.424
242 HG LEU 33 HG LEU 33 -4.992 -1.246 -0.025
243 HB2 LEU 33 2HB LEU 33 -5.380 1.119 -0.861
244 HB3 LEU 33 1HB LEU 33 -6.901 0.575 -1.507
245 HD11 LEU 33 1HD1 LEU 33 -5.675 0.638 1.374
246 HD12 LEU 33 2HD1 LEU 33 -6.424 -0.857 1.917
247 HD13 LEU 33 3HD1 LEU 33 -7.365 0.316 0.993
248 HD21 LEU 33 3HD2 LEU 33 -6.866 -2.715 0.188
249 HD22 LEU 33 1HD2 LEU 33 -6.758 -2.268 -1.499
250 HD23 LEU 33 2HD2 LEU 33 -7.980 -1.510 -0.467
251 H ILE 34 H ILE 34 -4.519 -2.441 -3.007
252 HA ILE 34 HA ILE 34 -6.671 -3.008 -4.915
253 HB ILE 34 HB ILE 34 -4.082 -4.504 -4.409
254 HG12 ILE 34 2HG1 ILE 34 -3.644 -2.348 -5.471
255 HG13 ILE 34 1HG1 ILE 34 -3.359 -3.657 -6.610
256 HG21 ILE 34 1HG2 ILE 34 -5.808 -6.015 -5.188
257 HG22 ILE 34 2HG2 ILE 34 -4.597 -5.757 -6.447
258 HG23 ILE 34 3HG2 ILE 34 -6.158 -4.945 -6.549
259 HD11 ILE 34 3HD1 ILE 34 -5.521 -3.191 -7.666
260 HD12 ILE 34 1HD1 ILE 34 -4.455 -1.785 -7.677
261 HD13 ILE 34 2HD1 ILE 34 -5.783 -1.869 -6.524
262 H SER 35 H SER 35 -4.940 -4.433 -2.133
263 HA SER 35 HA SER 35 -7.392 -5.842 -1.425
264 HG SER 35 HG SER 35 -6.926 -6.980 -3.431
265 HB2 SER 35 2HB SER 35 -4.726 -7.258 -1.712
266 HB3 SER 35 1HB SER 35 -6.258 -7.982 -1.245
267 H LYS 36 H LYS 36 -7.701 -5.723 0.737
268 HA LYS 36 HA LYS 36 -5.427 -5.029 2.449
269 HB2 LYS 36 2HB LYS 36 -8.385 -4.733 2.784
270 HB3 LYS 36 1HB LYS 36 -7.379 -4.869 4.223
271 HG2 LYS 36 2HG LYS 36 -6.077 -2.960 3.507
272 HG3 LYS 36 1HG LYS 36 -7.044 -2.809 2.056
273 HD2 LYS 36 2HD LYS 36 -8.175 -2.619 4.835
274 HD3 LYS 36 1HD LYS 36 -7.619 -1.226 3.907
275 HE2 LYS 36 2HE LYS 36 -9.232 -1.913 2.118
276 HE3 LYS 36 1HE LYS 36 -9.870 -3.109 3.245
277 HZ1 LYS 36 3HZ LYS 36 -10.605 -1.386 4.702
278 HZ2 LYS 36 1HZ LYS 36 -11.056 -0.938 3.137
279 HZ3 LYS 36 2HZ LYS 36 -9.731 -0.212 3.843
280 H GLU 37 H GLU 37 -7.462 -7.600 1.632
281 HA GLU 37 HA GLU 37 -6.424 -9.111 3.902
282 HB2 GLU 37 2HB GLU 37 -8.940 -8.900 3.651
283 HB3 GLU 37 1HB GLU 37 -8.766 -9.748 2.127
284 HG2 GLU 37 2HG GLU 37 -8.148 -11.755 3.194
285 HG3 GLU 37 1HG GLU 37 -7.954 -10.946 4.753
286 H THR 38 H THR 38 -4.452 -9.439 2.941
287 HA THR 38 HA THR 38 -4.258 -10.488 0.288
288 HB THR 38 HB THR 38 -1.781 -10.436 1.031
289 HG1 THR 38 1HG THR 38 -2.196 -8.562 2.923
290 HG21 THR 38 3HG2 THR 38 -3.431 -7.893 0.980
291 HG22 THR 38 1HG2 THR 38 -2.817 -8.742 -0.437
292 HG23 THR 38 2HG2 THR 38 -1.692 -7.992 0.697
293 H GLY 39 H GLY 39 -4.510 -11.532 3.366
294 HA2 GLY 39 2HA GLY 39 -4.840 -14.114 3.381
295 HA3 GLY 39 1HA GLY 39 -3.098 -14.066 3.043
296 H GLU 40 H GLU 40 -2.356 -11.888 4.407
297 HA GLU 40 HA GLU 40 -2.994 -12.546 7.189
298 HB2 GLU 40 2HB GLU 40 -0.682 -13.152 6.489
299 HB3 GLU 40 1HB GLU 40 -0.411 -11.472 6.047
300 HG2 GLU 40 2HG GLU 40 -0.866 -10.843 8.403
301 HG3 GLU 40 1HG GLU 40 -0.949 -12.557 8.798
302 H ALA 41 H ALA 41 -4.290 -10.957 7.859
303 HA ALA 41 HA ALA 41 -4.375 -8.357 6.768
304 HB1 ALA 41 1HB ALA 41 -5.755 -7.783 8.718
305 HB2 ALA 41 2HB ALA 41 -5.299 -9.304 9.487
306 HB3 ALA 41 3HB ALA 41 -6.265 -9.317 8.013
307 H GLY 42 H GLY 42 -2.808 -7.037 6.839
308 HA2 GLY 42 2HA GLY 42 -1.563 -5.721 8.747
309 HA3 GLY 42 1HA GLY 42 -0.692 -7.261 8.791
310 H TRP 43 H TRP 43 -1.070 -7.887 6.085
311 HA TRP 43 HA TRP 43 0.731 -5.984 4.822
312 HD1 TRP 43 HD TRP 43 1.187 -9.783 6.316
313 HE1 TRP 43 1HE TRP 43 3.678 -10.065 6.889
314 HE3 TRP 43 3HE TRP 43 3.191 -6.695 2.772
315 HZ2 TRP 43 2HZ TRP 43 6.170 -9.085 5.968
316 HZ3 TRP 43 3HZ TRP 43 5.631 -6.425 2.682
317 HH2 TRP 43 HH TRP 43 7.089 -7.595 4.247
318 HB2 TRP 43 2HB TRP 43 -0.029 -8.831 4.125
319 HB3 TRP 43 1HB TRP 43 0.906 -7.797 3.059
320 H TRP 44 H TRP 44 -0.078 -4.643 3.424
321 HA TRP 44 HA TRP 44 -2.734 -5.143 2.309
322 HD1 TRP 44 HD TRP 44 -3.262 -4.814 4.657
323 HE1 TRP 44 1HE TRP 44 -4.888 -3.593 6.236
324 HE3 TRP 44 3HE TRP 44 -2.978 -0.116 2.661
325 HZ2 TRP 44 2HZ TRP 44 -5.905 -0.997 6.599
326 HZ3 TRP 44 3HZ TRP 44 -4.315 1.678 3.686
327 HH2 TRP 44 HH TRP 44 -5.750 1.238 5.610
328 HB2 TRP 44 2HB TRP 44 -1.188 -2.608 2.847
329 HB3 TRP 44 1HB TRP 44 -2.525 -2.651 1.713
330 H LYS 45 H LYS 45 -2.948 -4.946 0.114
331 HA LYS 45 HA LYS 45 -0.420 -4.908 -1.369
332 HB2 LYS 45 2HB LYS 45 -1.749 -7.013 -1.507
333 HB3 LYS 45 1HB LYS 45 -3.102 -6.075 -2.114
334 HG2 LYS 45 2HG LYS 45 -1.829 -5.495 -4.100
335 HG3 LYS 45 1HG LYS 45 -0.453 -6.423 -3.495
336 HD2 LYS 45 2HD LYS 45 -1.856 -8.431 -3.454
337 HD3 LYS 45 1HD LYS 45 -3.195 -7.495 -4.115
338 HE2 LYS 45 2HE LYS 45 -1.864 -7.019 -6.116
339 HE3 LYS 45 1HE LYS 45 -0.535 -7.962 -5.446
340 HZ1 LYS 45 3HZ LYS 45 -1.970 -9.927 -5.498
341 HZ2 LYS 45 1HZ LYS 45 -1.833 -9.239 -7.034
342 HZ3 LYS 45 2HZ LYS 45 -3.223 -9.001 -6.139
343 H GLY 46 H GLY 46 -0.177 -3.296 -2.728
344 HA2 GLY 46 2HA GLY 46 -2.503 -1.812 -3.607
345 HA3 GLY 46 1HA GLY 46 -1.284 -0.940 -2.688
346 H GLU 47 H GLU 47 -1.996 -0.329 -5.240
347 HA GLU 47 HA GLU 47 0.343 -1.154 -6.758
348 HB2 GLU 47 2HB GLU 47 -1.767 -1.852 -7.769
349 HB3 GLU 47 1HB GLU 47 -2.382 -0.221 -7.670
350 HG2 GLU 47 2HG GLU 47 0.058 -0.803 -9.291
351 HG3 GLU 47 1HG GLU 47 -1.544 -1.160 -9.932
352 H LEU 48 H LEU 48 1.737 0.263 -7.280
353 HA LEU 48 HA LEU 48 1.118 3.096 -7.237
354 HG LEU 48 HG LEU 48 3.900 4.164 -6.514
355 HB2 LEU 48 2HB LEU 48 1.966 2.439 -4.971
356 HB3 LEU 48 1HB LEU 48 3.425 1.877 -5.767
357 HD11 LEU 48 1HD1 LEU 48 2.644 6.023 -5.539
358 HD12 LEU 48 2HD1 LEU 48 1.480 4.877 -4.878
359 HD13 LEU 48 3HD1 LEU 48 1.666 5.044 -6.626
360 HD21 LEU 48 3HD2 LEU 48 4.484 5.065 -4.310
361 HD22 LEU 48 1HD2 LEU 48 4.885 3.355 -4.462
362 HD23 LEU 48 2HD2 LEU 48 3.455 3.851 -3.557
363 H ASN 49 H ASN 49 1.976 3.961 -8.976
364 HA ASN 49 HA ASN 49 3.185 4.404 -10.813
365 HB2 ASN 49 2HB ASN 49 5.355 2.766 -9.471
366 HB3 ASN 49 1HB ASN 49 5.586 3.676 -10.958
367 HD21 ASN 49 1HD2 ASN 49 5.422 3.785 -7.561
368 HD22 ASN 49 2HD2 ASN 49 5.699 5.474 -7.353
369 H GLY 50 H GLY 50 1.558 1.870 -10.469
370 HA2 GLY 50 2HA GLY 50 0.843 0.610 -12.297
371 HA3 GLY 50 1HA GLY 50 2.479 0.641 -12.946
372 H LYS 51 H LYS 51 3.197 0.064 -9.887
373 HA LYS 51 HA LYS 51 3.189 -2.807 -10.391
374 HB2 LYS 51 2HB LYS 51 4.985 -1.146 -8.618
375 HB3 LYS 51 1HB LYS 51 4.993 -2.896 -8.645
376 HG2 LYS 51 2HG LYS 51 6.826 -2.162 -9.921
377 HG3 LYS 51 1HG LYS 51 5.634 -2.763 -11.062
378 HD2 LYS 51 2HD LYS 51 4.921 -0.505 -11.573
379 HD3 LYS 51 1HD LYS 51 6.027 0.146 -10.370
380 HE2 LYS 51 2HE LYS 51 7.922 -0.694 -11.645
381 HE3 LYS 51 1HE LYS 51 6.821 -1.401 -12.830
382 HZ1 LYS 51 3HZ LYS 51 7.723 0.738 -13.537
383 HZ2 LYS 51 1HZ LYS 51 7.018 1.491 -12.211
384 HZ3 LYS 51 2HZ LYS 51 6.054 0.772 -13.406
385 H GLU 52 H GLU 52 2.299 -4.131 -9.069
386 HA GLU 52 HA GLU 52 1.055 -3.033 -6.676
387 HB2 GLU 52 2HB GLU 52 -0.641 -4.871 -6.882
388 HB3 GLU 52 1HB GLU 52 -0.703 -3.696 -8.181
389 HG2 GLU 52 2HG GLU 52 0.431 -5.230 -9.665
390 HG3 GLU 52 1HG GLU 52 0.617 -6.396 -8.357
391 H GLY 53 H GLY 53 1.798 -3.715 -4.878
392 HA2 GLY 53 2HA GLY 53 2.878 -6.403 -4.690
393 HA3 GLY 53 1HA GLY 53 3.961 -5.076 -4.289
394 H VAL 54 H VAL 54 3.911 -6.245 -2.205
395 HA VAL 54 HA VAL 54 1.549 -5.434 -0.681
396 HB VAL 54 HB VAL 54 2.051 -7.285 0.931
397 HG11 VAL 54 1HG1 VAL 54 1.156 -9.093 -0.461
398 HG12 VAL 54 2HG1 VAL 54 1.509 -8.142 -1.905
399 HG13 VAL 54 3HG1 VAL 54 0.317 -7.565 -0.738
400 HG21 VAL 54 3HG2 VAL 54 3.506 -9.133 0.204
401 HG22 VAL 54 1HG2 VAL 54 4.412 -7.629 0.404
402 HG23 VAL 54 2HG2 VAL 54 3.981 -8.193 -1.210
403 H PHE 55 H PHE 55 1.825 -4.716 1.395
404 HA PHE 55 HA PHE 55 4.458 -4.127 2.375
405 HD1 PHE 55 2HD PHE 55 2.036 -2.286 -0.558
406 HD2 PHE 55 1HD PHE 55 2.076 -0.767 3.420
407 HE1 PHE 55 2HE PHE 55 -0.104 -1.157 -0.968
408 HE2 PHE 55 1HE PHE 55 -0.064 0.371 3.010
409 HZ PHE 55 HZ PHE 55 -1.158 0.176 0.813
410 HB2 PHE 55 2HB PHE 55 4.119 -1.689 2.381
411 HB3 PHE 55 1HB PHE 55 4.042 -2.359 0.748
412 HA PRO 56 HA PRO 56 2.026 -4.457 6.139
413 HB2 PRO 56 2HB PRO 56 3.983 -2.595 7.362
414 HB3 PRO 56 1HB PRO 56 3.560 -4.244 7.846
415 HG2 PRO 56 2HG PRO 56 5.901 -3.792 6.676
416 HG3 PRO 56 1HG PRO 56 4.939 -5.211 6.230
417 HD2 PRO 56 2HD PRO 56 5.170 -2.586 4.796
418 HD3 PRO 56 1HD PRO 56 5.299 -4.244 4.156
419 H ASP 57 H ASP 57 0.353 -3.379 6.949
420 HA ASP 57 HA ASP 57 -0.562 -0.972 5.796
421 HB2 ASP 57 2HB ASP 57 -2.504 -1.156 7.152
422 HB3 ASP 57 1HB ASP 57 -2.014 -2.792 6.752
423 H ASN 58 H ASN 58 1.573 -1.372 8.293
424 HA ASN 58 HA ASN 58 0.800 0.721 10.074
425 HB2 ASN 58 2HB ASN 58 3.511 -0.567 9.787
426 HB3 ASN 58 1HB ASN 58 2.922 0.345 11.171
427 HD21 ASN 58 1HD2 ASN 58 1.397 -0.607 12.522
428 HD22 ASN 58 2HD2 ASN 58 1.101 -2.299 12.514
429 H PHE 59 H PHE 59 2.215 0.802 7.043
430 HA PHE 59 HA PHE 59 3.615 3.275 7.700
431 HD1 PHE 59 1HD PHE 59 5.787 2.776 8.279
432 HD2 PHE 59 2HD PHE 59 4.992 -0.469 5.652
433 HE1 PHE 59 1HE PHE 59 7.298 1.369 9.574
434 HE2 PHE 59 2HE PHE 59 6.522 -1.884 6.953
435 HZ PHE 59 HZ PHE 59 7.669 -0.965 8.917
436 HB2 PHE 59 2HB PHE 59 3.947 1.525 5.275
437 HB3 PHE 59 1HB PHE 59 4.914 2.939 5.681
438 H ALA 60 H ALA 60 0.648 2.565 6.830
439 HA ALA 60 HA ALA 60 0.453 4.901 5.116
440 HB1 ALA 60 1HB ALA 60 -0.953 3.778 3.495
441 HB2 ALA 60 2HB ALA 60 -0.796 2.258 4.376
442 HB3 ALA 60 3HB ALA 60 0.611 2.971 3.592
443 H VAL 61 H VAL 61 -1.581 5.849 5.086
444 HA VAL 61 HA VAL 61 -3.522 4.826 7.025
445 HB VAL 61 HB VAL 61 -2.466 6.845 7.981
446 HG11 VAL 61 1HG1 VAL 61 -2.666 9.049 6.917
447 HG12 VAL 61 2HG1 VAL 61 -3.338 8.279 5.477
448 HG13 VAL 61 3HG1 VAL 61 -1.682 7.935 5.966
449 HG21 VAL 61 3HG2 VAL 61 -5.262 7.409 7.005
450 HG22 VAL 61 1HG2 VAL 61 -4.461 8.246 8.333
451 HG23 VAL 61 2HG2 VAL 61 -4.824 6.527 8.470
452 H GLN 62 H GLN 62 -5.592 4.637 6.242
453 HA GLN 62 HA GLN 62 -5.883 4.965 3.405
454 HB2 GLN 62 2HB GLN 62 -6.929 3.123 5.004
455 HB3 GLN 62 1HB GLN 62 -8.207 4.315 5.180
456 HG2 GLN 62 2HG GLN 62 -8.507 4.325 2.732
457 HG3 GLN 62 1HG GLN 62 -7.277 3.072 2.594
458 HE21 GLN 62 1HE2 GLN 62 -10.554 3.770 3.273
459 HE22 GLN 62 2HE2 GLN 62 -11.072 2.157 3.574
460 H ILE 63 H ILE 63 -6.764 6.593 2.397
461 HA ILE 63 HA ILE 63 -7.618 8.943 3.915
462 HB ILE 63 HB ILE 63 -7.270 8.613 0.921
463 HG12 ILE 63 2HG1 ILE 63 -5.160 8.111 1.990
464 HG13 ILE 63 1HG1 ILE 63 -5.060 9.671 1.183
465 HG21 ILE 63 1HG2 ILE 63 -7.080 11.054 0.877
466 HG22 ILE 63 2HG2 ILE 63 -7.339 11.106 2.617
467 HG23 ILE 63 3HG2 ILE 63 -8.628 10.540 1.554
468 HD11 ILE 63 3HD1 ILE 63 -5.409 9.212 4.144
469 HD12 ILE 63 1HD1 ILE 63 -5.373 10.787 3.352
470 HD13 ILE 63 2HD1 ILE 63 -3.941 9.758 3.333
471 H SER 64 H SER 64 -8.652 6.860 1.285
472 HA SER 64 HA SER 64 -11.422 7.614 1.743
473 HG SER 64 HG SER 64 -10.517 9.208 0.294
474 HB2 SER 64 2HB SER 64 -10.090 6.696 -0.819
475 HB3 SER 64 1HB SER 64 -11.751 7.263 -0.632
Start of MODEL 9
1 H1 GLY 1 1HT GLY 1 -12.883 -10.020 0.762
2 H2 GLY 1 2HT GLY 1 -13.661 -10.894 1.997
3 H3 GLY 1 3HT GLY 1 -12.365 -9.895 2.369
4 HA2 GLY 1 1HA GLY 1 -14.981 -9.003 1.323
5 HA3 GLY 1 2HA GLY 1 -14.452 -8.908 2.995
6 H ALA 2 H ALA 2 -11.851 -8.020 2.744
7 HA ALA 2 HA ALA 2 -12.446 -5.310 1.968
8 HB1 ALA 2 1HB ALA 2 -10.078 -6.406 3.471
9 HB2 ALA 2 2HB ALA 2 -11.523 -5.687 4.189
10 HB3 ALA 2 3HB ALA 2 -10.440 -4.698 3.208
11 H MET 3 H MET 3 -12.429 -5.644 -0.216
12 HA MET 3 HA MET 3 -9.846 -5.222 -1.472
13 HB2 MET 3 2HB MET 3 -10.193 -7.653 -1.715
14 HB3 MET 3 1HB MET 3 -11.802 -7.357 -2.355
15 HG2 MET 3 2HG MET 3 -10.785 -6.176 -4.278
16 HG3 MET 3 1HG MET 3 -9.195 -6.591 -3.656
17 HE1 MET 3 3HE MET 3 -12.557 -7.926 -5.153
18 HE2 MET 3 1HE MET 3 -12.472 -8.858 -3.660
19 HE3 MET 3 2HE MET 3 -12.277 -9.668 -5.209
20 H GLY 4 H GLY 4 -10.099 -3.677 -3.078
21 HA2 GLY 4 2HA GLY 4 -12.634 -3.299 -4.337
22 HA3 GLY 4 1HA GLY 4 -12.223 -2.029 -3.188
23 H ALA 5 H ALA 5 -12.310 -0.763 -5.189
24 HA ALA 5 HA ALA 5 -9.638 -0.740 -6.393
25 HB1 ALA 5 1HB ALA 5 -11.322 -1.491 -8.015
26 HB2 ALA 5 2HB ALA 5 -10.591 0.042 -8.479
27 HB3 ALA 5 3HB ALA 5 -12.210 0.015 -7.772
28 H LYS 6 H LYS 6 -12.369 1.059 -5.236
29 HA LYS 6 HA LYS 6 -10.795 3.484 -5.397
30 HB2 LYS 6 2HB LYS 6 -13.086 3.659 -6.284
31 HB3 LYS 6 1HB LYS 6 -13.726 3.169 -4.723
32 HG2 LYS 6 2HG LYS 6 -12.848 5.179 -3.682
33 HG3 LYS 6 1HG LYS 6 -12.116 5.675 -5.204
34 HD2 LYS 6 2HD LYS 6 -15.070 5.263 -4.794
35 HD3 LYS 6 1HD LYS 6 -14.270 6.826 -4.650
36 HE2 LYS 6 2HE LYS 6 -14.351 5.095 -7.131
37 HE3 LYS 6 1HE LYS 6 -15.334 6.523 -6.839
38 HZ1 LYS 6 3HZ LYS 6 -13.282 7.823 -6.713
39 HZ2 LYS 6 1HZ LYS 6 -13.469 7.073 -8.216
40 HZ3 LYS 6 2HZ LYS 6 -12.385 6.455 -7.090
41 H GLU 7 H GLU 7 -9.420 2.584 -3.834
42 HA GLU 7 HA GLU 7 -10.071 3.731 -1.272
43 HB2 GLU 7 2HB GLU 7 -8.858 0.953 -1.556
44 HB3 GLU 7 1HB GLU 7 -8.913 1.858 -0.053
45 HG2 GLU 7 2HG GLU 7 -11.494 1.799 -0.485
46 HG3 GLU 7 1HG GLU 7 -11.081 0.431 -1.520
47 H TYR 8 H TYR 8 -8.564 5.268 -1.185
48 HA TYR 8 HA TYR 8 -5.940 4.559 -2.304
49 HD1 TYR 8 1HD TYR 8 -9.148 6.589 -3.267
50 HD2 TYR 8 2HD TYR 8 -5.218 6.462 -4.890
51 HE1 TYR 8 1HE TYR 8 -10.092 6.470 -5.530
52 HE2 TYR 8 2HE TYR 8 -6.157 6.347 -7.160
53 HH TYR 8 HH TYR 8 -8.237 5.680 -8.277
54 HB2 TYR 8 2HB TYR 8 -7.051 7.358 -1.935
55 HB3 TYR 8 1HB TYR 8 -5.504 6.933 -2.604
56 H CYS 9 H CYS 9 -4.226 4.652 -1.062
57 HA CYS 9 HA CYS 9 -4.641 5.683 1.624
58 HG CYS 9 HG CYS 9 -1.507 2.895 0.491
59 HB2 CYS 9 2HB CYS 9 -3.025 3.904 2.389
60 HB3 CYS 9 1HB CYS 9 -4.578 3.303 1.829
61 H ARG 10 H ARG 10 -2.935 6.648 2.612
62 HA ARG 10 HA ARG 10 -1.007 7.758 0.733
63 HE ARG 10 HE ARG 10 0.610 12.048 3.548
64 HB2 ARG 10 2HB ARG 10 -2.554 9.388 1.687
65 HB3 ARG 10 1HB ARG 10 -2.135 8.858 3.307
66 HG2 ARG 10 2HG ARG 10 0.096 9.694 3.055
67 HG3 ARG 10 1HG ARG 10 -0.212 10.103 1.367
68 HD2 ARG 10 2HD ARG 10 -1.877 11.723 2.039
69 HD3 ARG 10 1HD ARG 10 -1.657 11.281 3.733
70 HH11 ARG 10 1HH1 ARG 10 -1.729 13.320 1.159
71 HH12 ARG 10 2HH1 ARG 10 -0.777 14.657 0.751
72 HH21 ARG 10 1HH2 ARG 10 1.863 13.915 3.008
73 HH22 ARG 10 2HH2 ARG 10 1.302 15.048 1.875
74 H THR 11 H THR 11 1.056 7.521 1.140
75 HA THR 11 HA THR 11 2.072 5.555 2.879
76 HB THR 11 HB THR 11 4.230 6.543 2.129
77 HG1 THR 11 1HG THR 11 2.850 8.637 2.032
78 HG21 THR 11 3HG2 THR 11 3.897 6.082 -0.248
79 HG22 THR 11 1HG2 THR 11 2.149 6.252 -0.054
80 HG23 THR 11 2HG2 THR 11 2.999 4.914 0.717
81 H LEU 12 H LEU 12 2.982 5.813 4.972
82 HA LEU 12 HA LEU 12 2.963 8.561 6.034
83 HG LEU 12 HG LEU 12 0.819 6.395 6.608
84 HB2 LEU 12 2HB LEU 12 3.086 5.908 7.450
85 HB3 LEU 12 1HB LEU 12 3.107 7.471 8.232
86 HD11 LEU 12 1HD1 LEU 12 -0.281 6.133 8.793
87 HD12 LEU 12 2HD1 LEU 12 1.213 6.613 9.594
88 HD13 LEU 12 3HD1 LEU 12 1.153 5.119 8.657
89 HD21 LEU 12 3HD2 LEU 12 -0.405 8.281 7.639
90 HD22 LEU 12 1HD2 LEU 12 0.908 8.819 6.589
91 HD23 LEU 12 2HD2 LEU 12 1.115 8.847 8.337
92 H PHE 13 H PHE 13 5.042 5.975 5.066
93 HA PHE 13 HA PHE 13 7.407 7.451 5.883
94 HD1 PHE 13 1HD PHE 13 8.182 7.441 8.726
95 HD2 PHE 13 2HD PHE 13 5.172 4.495 8.155
96 HE1 PHE 13 1HE PHE 13 7.169 8.048 10.890
97 HE2 PHE 13 2HE PHE 13 4.162 5.095 10.305
98 HZ PHE 13 HZ PHE 13 5.154 6.872 11.671
99 HB2 PHE 13 2HB PHE 13 7.030 4.555 6.736
100 HB3 PHE 13 1HB PHE 13 8.419 5.566 7.066
101 HA PRO 14 HA PRO 14 8.596 5.349 2.159
102 HB2 PRO 14 2HB PRO 14 11.275 5.559 2.288
103 HB3 PRO 14 1HB PRO 14 10.254 6.934 1.857
104 HG2 PRO 14 2HG PRO 14 11.601 6.321 4.444
105 HG3 PRO 14 1HG PRO 14 11.298 7.892 3.683
106 HD2 PRO 14 2HD PRO 14 9.807 6.835 5.753
107 HD3 PRO 14 1HD PRO 14 9.219 8.064 4.617
108 H TYR 15 H TYR 15 8.319 3.281 2.161
109 HA TYR 15 HA TYR 15 9.994 1.574 3.864
110 HD1 TYR 15 2HD TYR 15 9.223 -0.322 5.586
111 HD2 TYR 15 1HD TYR 15 7.263 -1.220 1.925
112 HE1 TYR 15 2HE TYR 15 9.655 -2.710 5.949
113 HE2 TYR 15 1HE TYR 15 7.692 -3.614 2.277
114 HH TYR 15 HH TYR 15 9.339 -4.979 3.505
115 HB2 TYR 15 2HB TYR 15 7.622 1.308 4.423
116 HB3 TYR 15 1HB TYR 15 7.240 0.990 2.734
117 H THR 16 H THR 16 11.282 0.128 2.907
118 HA THR 16 HA THR 16 11.131 0.024 -0.008
119 HB THR 16 HB THR 16 13.556 -0.413 1.748
120 HG1 THR 16 1HG THR 16 12.427 1.732 1.566
121 HG21 THR 16 3HG2 THR 16 13.641 -1.473 -0.492
122 HG22 THR 16 1HG2 THR 16 14.789 -0.139 -0.362
123 HG23 THR 16 2HG2 THR 16 13.269 0.082 -1.230
124 H GLY 17 H GLY 17 10.782 -1.880 -0.889
125 HA2 GLY 17 2HA GLY 17 10.347 -4.158 0.788
126 HA3 GLY 17 1HA GLY 17 10.213 -4.102 -0.972
127 H THR 18 H THR 18 11.530 -6.098 0.705
128 HA THR 18 HA THR 18 14.328 -5.631 -0.012
129 HB THR 18 HB THR 18 13.816 -6.306 2.350
130 HG1 THR 18 1HG THR 18 15.827 -6.844 1.444
131 HG21 THR 18 3HG2 THR 18 12.921 -8.902 1.091
132 HG22 THR 18 1HG2 THR 18 11.896 -7.760 1.957
133 HG23 THR 18 2HG2 THR 18 13.155 -8.647 2.819
134 H ASN 19 H ASN 19 11.760 -6.589 -1.441
135 HA ASN 19 HA ASN 19 13.038 -8.199 -3.390
136 HB2 ASN 19 2HB ASN 19 11.348 -9.984 -3.341
137 HB3 ASN 19 1HB ASN 19 12.272 -9.983 -1.842
138 HD21 ASN 19 1HD2 ASN 19 11.191 -9.511 0.064
139 HD22 ASN 19 2HD2 ASN 19 9.480 -9.388 0.148
140 H GLU 20 H GLU 20 11.140 -8.626 -5.131
141 HA GLU 20 HA GLU 20 10.246 -5.953 -5.684
142 HB2 GLU 20 2HB GLU 20 10.026 -8.469 -7.309
143 HB3 GLU 20 1HB GLU 20 9.512 -6.882 -7.857
144 HG2 GLU 20 2HG GLU 20 12.301 -7.654 -7.073
145 HG3 GLU 20 1HG GLU 20 11.698 -7.496 -8.720
146 H ASP 21 H ASP 21 8.630 -8.910 -4.685
147 HA ASP 21 HA ASP 21 6.004 -7.998 -5.436
148 HB2 ASP 21 2HB ASP 21 6.584 -10.437 -5.111
149 HB3 ASP 21 1HB ASP 21 6.684 -10.134 -3.382
150 H GLU 22 H GLU 22 8.081 -7.524 -2.851
151 HA GLU 22 HA GLU 22 6.084 -6.337 -1.120
152 HB2 GLU 22 2HB GLU 22 8.136 -7.680 -0.383
153 HB3 GLU 22 1HB GLU 22 9.094 -6.310 -0.897
154 HG2 GLU 22 2HG GLU 22 8.133 -4.923 0.755
155 HG3 GLU 22 1HG GLU 22 6.949 -6.165 1.190
156 H LEU 23 H LEU 23 5.431 -4.341 -1.621
157 HA LEU 23 HA LEU 23 6.751 -2.991 -3.782
158 HG LEU 23 HG LEU 23 3.436 -1.370 -4.614
159 HB2 LEU 23 2HB LEU 23 4.241 -3.338 -3.582
160 HB3 LEU 23 1HB LEU 23 4.239 -2.133 -2.328
161 HD11 LEU 23 1HD1 LEU 23 4.574 0.777 -4.579
162 HD12 LEU 23 2HD1 LEU 23 5.757 0.130 -3.445
163 HD13 LEU 23 3HD1 LEU 23 4.061 0.270 -2.973
164 HD21 LEU 23 3HD2 LEU 23 5.062 -2.578 -5.956
165 HD22 LEU 23 1HD2 LEU 23 6.352 -1.569 -5.307
166 HD23 LEU 23 2HD2 LEU 23 5.091 -0.850 -6.308
167 H THR 24 H THR 24 7.801 -1.160 -3.787
168 HA THR 24 HA THR 24 8.659 -0.047 -1.213
169 HB THR 24 HB THR 24 9.847 0.122 -3.983
170 HG1 THR 24 1HG THR 24 10.008 -1.854 -2.834
171 HG21 THR 24 3HG2 THR 24 10.868 1.313 -1.380
172 HG22 THR 24 1HG2 THR 24 10.373 2.187 -2.821
173 HG23 THR 24 2HG2 THR 24 11.827 1.191 -2.857
174 H PHE 25 H PHE 25 7.897 1.862 -0.596
175 HA PHE 25 HA PHE 25 7.076 3.803 -2.593
176 HD1 PHE 25 1HD PHE 25 5.351 4.457 1.298
177 HD2 PHE 25 2HD PHE 25 5.005 0.774 -0.795
178 HE1 PHE 25 1HE PHE 25 4.847 3.305 3.406
179 HE2 PHE 25 2HE PHE 25 4.510 -0.375 1.296
180 HZ PHE 25 HZ PHE 25 4.424 0.880 3.406
181 HB2 PHE 25 2HB PHE 25 5.097 4.387 -1.132
182 HB3 PHE 25 1HB PHE 25 4.981 2.855 -1.980
183 H ARG 26 H ARG 26 6.972 6.002 -1.752
184 HA ARG 26 HA ARG 26 8.976 6.386 0.352
185 HE ARG 26 HE ARG 26 8.154 7.529 -3.780
186 HB2 ARG 26 2HB ARG 26 8.152 7.982 -2.030
187 HB3 ARG 26 1HB ARG 26 9.233 8.607 -0.803
188 HG2 ARG 26 2HG ARG 26 10.944 7.227 -1.422
189 HG3 ARG 26 1HG ARG 26 9.854 6.009 -2.092
190 HD2 ARG 26 2HD ARG 26 10.312 8.737 -3.254
191 HD3 ARG 26 1HD ARG 26 11.097 7.248 -3.797
192 HH11 ARG 26 1HH1 ARG 26 11.089 6.607 -5.517
193 HH12 ARG 26 2HH1 ARG 26 10.262 6.158 -6.933
194 HH21 ARG 26 1HH2 ARG 26 7.046 6.967 -5.643
195 HH22 ARG 26 2HH2 ARG 26 7.864 6.319 -7.007
196 H GLU 27 H GLU 27 8.552 9.038 0.826
197 HA GLU 27 HA GLU 27 6.060 8.955 2.336
198 HB2 GLU 27 2HB GLU 27 8.135 9.680 3.451
199 HB3 GLU 27 1HB GLU 27 8.297 11.002 2.315
200 HG2 GLU 27 2HG GLU 27 6.083 11.860 3.169
201 HG3 GLU 27 1HG GLU 27 6.197 10.641 4.438
202 H GLY 28 H GLY 28 4.357 10.325 2.004
203 HA2 GLY 28 2HA GLY 28 3.086 12.017 1.105
204 HA3 GLY 28 1HA GLY 28 4.509 12.590 0.251
205 H GLU 29 H GLU 29 3.348 9.284 -0.053
206 HA GLU 29 HA GLU 29 2.528 10.022 -2.738
207 HB2 GLU 29 2HB GLU 29 3.810 7.447 -1.859
208 HB3 GLU 29 1HB GLU 29 3.167 7.745 -3.470
209 HG2 GLU 29 2HG GLU 29 4.698 9.717 -3.587
210 HG3 GLU 29 1HG GLU 29 5.456 9.122 -2.116
211 H ILE 30 H ILE 30 0.981 8.676 -3.751
212 HA ILE 30 HA ILE 30 -1.117 7.899 -1.854
213 HB ILE 30 HB ILE 30 -1.423 8.868 -4.712
214 HG12 ILE 30 2HG1 ILE 30 -0.560 10.696 -3.336
215 HG13 ILE 30 1HG1 ILE 30 -2.232 11.003 -3.774
216 HG21 ILE 30 1HG2 ILE 30 -3.252 7.442 -3.970
217 HG22 ILE 30 2HG2 ILE 30 -3.803 9.109 -4.143
218 HG23 ILE 30 3HG2 ILE 30 -3.478 8.451 -2.541
219 HD11 ILE 30 3HD1 ILE 30 -1.250 9.995 -1.104
220 HD12 ILE 30 1HD1 ILE 30 -2.933 10.304 -1.536
221 HD13 ILE 30 2HD1 ILE 30 -1.778 11.637 -1.467
222 H ILE 31 H ILE 31 -1.693 5.838 -1.956
223 HA ILE 31 HA ILE 31 -0.693 4.226 -4.195
224 HB ILE 31 HB ILE 31 -1.127 3.416 -1.296
225 HG12 ILE 31 2HG1 ILE 31 1.454 3.736 -2.842
226 HG13 ILE 31 1HG1 ILE 31 0.870 4.819 -1.583
227 HG21 ILE 31 1HG2 ILE 31 -0.038 1.793 -3.596
228 HG22 ILE 31 2HG2 ILE 31 -1.591 1.560 -2.795
229 HG23 ILE 31 3HG2 ILE 31 -0.091 1.278 -1.910
230 HD11 ILE 31 3HD1 ILE 31 1.060 3.031 0.057
231 HD12 ILE 31 1HD1 ILE 31 2.600 3.307 -0.755
232 HD13 ILE 31 2HD1 ILE 31 1.603 1.919 -1.199
233 H HIS 32 H HIS 32 -2.120 2.800 -5.075
234 HA HIS 32 HA HIS 32 -4.939 3.153 -4.429
235 HD1 HIS 32 1HD HIS 32 -6.151 3.185 -8.182
236 HD2 HIS 32 2HD HIS 32 -2.386 4.335 -6.864
237 HE1 HIS 32 1HE HIS 32 -5.520 5.199 -9.543
238 HB2 HIS 32 2HB HIS 32 -3.556 1.503 -6.574
239 HB3 HIS 32 1HB HIS 32 -5.292 1.676 -6.409
240 H LEU 33 H LEU 33 -5.749 1.854 -2.913
241 HA LEU 33 HA LEU 33 -4.250 -0.434 -2.062
242 HG LEU 33 HG LEU 33 -4.985 -1.164 0.358
243 HB2 LEU 33 2HB LEU 33 -5.380 1.193 -0.516
244 HB3 LEU 33 1HB LEU 33 -6.920 0.643 -1.115
245 HD11 LEU 33 1HD1 LEU 33 -6.391 -0.764 2.313
246 HD12 LEU 33 2HD1 LEU 33 -7.314 0.432 1.403
247 HD13 LEU 33 3HD1 LEU 33 -5.612 0.721 1.766
248 HD21 LEU 33 3HD2 LEU 33 -6.948 -2.545 0.738
249 HD22 LEU 33 1HD2 LEU 33 -6.727 -2.294 -0.992
250 HD23 LEU 33 2HD2 LEU 33 -7.966 -1.387 -0.119
251 H ILE 34 H ILE 34 -4.486 -2.302 -2.900
252 HA ILE 34 HA ILE 34 -6.665 -2.825 -4.742
253 HB ILE 34 HB ILE 34 -4.187 -4.458 -4.086
254 HG12 ILE 34 2HG1 ILE 34 -4.775 -2.667 -6.458
255 HG13 ILE 34 1HG1 ILE 34 -3.629 -2.337 -5.164
256 HG21 ILE 34 1HG2 ILE 34 -5.925 -5.926 -4.938
257 HG22 ILE 34 2HG2 ILE 34 -4.666 -5.670 -6.163
258 HG23 ILE 34 3HG2 ILE 34 -6.204 -4.826 -6.301
259 HD11 ILE 34 3HD1 ILE 34 -3.435 -4.697 -6.987
260 HD12 ILE 34 1HD1 ILE 34 -2.223 -4.122 -5.856
261 HD13 ILE 34 2HD1 ILE 34 -2.622 -3.174 -7.299
262 H SER 35 H SER 35 -5.210 -4.238 -1.813
263 HA SER 35 HA SER 35 -7.773 -5.339 -1.034
264 HG SER 35 HG SER 35 -7.343 -6.316 -3.173
265 HB2 SER 35 2HB SER 35 -5.412 -7.164 -1.553
266 HB3 SER 35 1HB SER 35 -6.968 -7.648 -0.889
267 H LYS 36 H LYS 36 -7.888 -5.470 1.195
268 HA LYS 36 HA LYS 36 -5.463 -4.974 2.729
269 HB2 LYS 36 2HB LYS 36 -8.354 -5.271 3.551
270 HB3 LYS 36 1HB LYS 36 -7.042 -5.055 4.696
271 HG2 LYS 36 2HG LYS 36 -6.539 -2.902 3.739
272 HG3 LYS 36 1HG LYS 36 -7.829 -3.051 2.567
273 HD2 LYS 36 2HD LYS 36 -9.441 -3.241 4.444
274 HD3 LYS 36 1HD LYS 36 -8.096 -3.000 5.563
275 HE2 LYS 36 2HE LYS 36 -9.102 -0.865 5.290
276 HE3 LYS 36 1HE LYS 36 -7.608 -0.904 4.352
277 HZ1 LYS 36 3HZ LYS 36 -10.349 -1.162 3.248
278 HZ2 LYS 36 1HZ LYS 36 -8.958 -1.236 2.297
279 HZ3 LYS 36 2HZ LYS 36 -9.337 0.149 3.130
280 H GLU 37 H GLU 37 -7.343 -7.520 1.581
281 HA GLU 37 HA GLU 37 -6.180 -9.331 3.519
282 HB2 GLU 37 2HB GLU 37 -8.561 -9.696 1.707
283 HB3 GLU 37 1HB GLU 37 -7.870 -10.986 2.686
284 HG2 GLU 37 2HG GLU 37 -8.314 -9.731 4.696
285 HG3 GLU 37 1HG GLU 37 -8.938 -8.400 3.733
286 H THR 38 H THR 38 -4.285 -9.876 2.795
287 HA THR 38 HA THR 38 -3.978 -10.648 -0.014
288 HB THR 38 HB THR 38 -1.534 -10.502 0.562
289 HG1 THR 38 1HG THR 38 -2.089 -8.904 2.774
290 HG21 THR 38 3HG2 THR 38 -3.202 -8.014 0.982
291 HG22 THR 38 1HG2 THR 38 -2.700 -8.670 -0.576
292 HG23 THR 38 2HG2 THR 38 -1.492 -8.036 0.548
293 H GLY 39 H GLY 39 -4.796 -11.976 2.780
294 HA2 GLY 39 2HA GLY 39 -4.911 -14.378 3.030
295 HA3 GLY 39 1HA GLY 39 -3.326 -14.481 2.262
296 H GLU 40 H GLU 40 -2.756 -11.954 3.881
297 HA GLU 40 HA GLU 40 -2.260 -13.191 6.483
298 HB2 GLU 40 2HB GLU 40 -0.340 -11.475 4.895
299 HB3 GLU 40 1HB GLU 40 -0.081 -12.056 6.531
300 HG2 GLU 40 2HG GLU 40 0.022 -14.325 5.767
301 HG3 GLU 40 1HG GLU 40 -0.407 -13.830 4.131
302 H ALA 41 H ALA 41 -3.316 -12.003 7.908
303 HA ALA 41 HA ALA 41 -4.334 -9.408 7.392
304 HB1 ALA 41 1HB ALA 41 -5.005 -9.422 9.754
305 HB2 ALA 41 2HB ALA 41 -4.011 -10.853 10.032
306 HB3 ALA 41 3HB ALA 41 -5.418 -10.947 8.972
307 H GLY 42 H GLY 42 -3.227 -7.582 7.388
308 HA2 GLY 42 2HA GLY 42 -1.844 -6.094 8.823
309 HA3 GLY 42 1HA GLY 42 -0.752 -7.463 8.978
310 H TRP 43 H TRP 43 -1.377 -8.190 6.144
311 HA TRP 43 HA TRP 43 0.454 -6.265 4.952
312 HD1 TRP 43 HD TRP 43 0.830 -9.993 6.588
313 HE1 TRP 43 1HE TRP 43 3.231 -10.176 7.471
314 HE3 TRP 43 3HE TRP 43 3.155 -6.957 3.197
315 HZ2 TRP 43 2HZ TRP 43 5.793 -9.156 6.815
316 HZ3 TRP 43 3HZ TRP 43 5.582 -6.613 3.392
317 HH2 TRP 43 HH TRP 43 6.872 -7.690 5.164
318 HB2 TRP 43 2HB TRP 43 -0.144 -9.137 4.216
319 HB3 TRP 43 1HB TRP 43 0.879 -8.067 3.267
320 H TRP 44 H TRP 44 -0.318 -4.961 3.528
321 HA TRP 44 HA TRP 44 -2.945 -5.504 2.353
322 HD1 TRP 44 HD TRP 44 -3.528 -5.316 4.655
323 HE1 TRP 44 1HE TRP 44 -5.083 -4.199 6.364
324 HE3 TRP 44 3HE TRP 44 -3.147 -0.482 3.059
325 HZ2 TRP 44 2HZ TRP 44 -6.018 -1.614 6.968
326 HZ3 TRP 44 3HZ TRP 44 -4.406 1.254 4.263
327 HH2 TRP 44 HH TRP 44 -5.813 0.688 6.166
328 HB2 TRP 44 2HB TRP 44 -1.474 -2.942 2.949
329 HB3 TRP 44 1HB TRP 44 -2.850 -3.005 1.863
330 H LYS 45 H LYS 45 -3.169 -4.938 0.157
331 HA LYS 45 HA LYS 45 -0.626 -5.014 -1.294
332 HB2 LYS 45 2HB LYS 45 -2.123 -6.970 -1.660
333 HB3 LYS 45 1HB LYS 45 -3.360 -5.874 -2.261
334 HG2 LYS 45 2HG LYS 45 -1.922 -5.197 -4.073
335 HG3 LYS 45 1HG LYS 45 -0.631 -6.221 -3.456
336 HD2 LYS 45 2HD LYS 45 -2.140 -8.169 -3.759
337 HD3 LYS 45 1HD LYS 45 -3.294 -7.090 -4.543
338 HE2 LYS 45 2HE LYS 45 -1.690 -6.491 -6.226
339 HE3 LYS 45 1HE LYS 45 -0.440 -7.440 -5.429
340 HZ1 LYS 45 3HZ LYS 45 -2.891 -8.498 -6.726
341 HZ2 LYS 45 1HZ LYS 45 -1.714 -9.435 -5.930
342 HZ3 LYS 45 2HZ LYS 45 -1.308 -8.538 -7.305
343 H GLY 46 H GLY 46 -0.175 -3.371 -2.558
344 HA2 GLY 46 2HA GLY 46 -2.313 -1.511 -3.248
345 HA3 GLY 46 1HA GLY 46 -0.883 -0.901 -2.420
346 H GLU 47 H GLU 47 -1.647 0.022 -4.812
347 HA GLU 47 HA GLU 47 0.442 -1.000 -6.618
348 HB2 GLU 47 2HB GLU 47 -1.940 -1.396 -7.318
349 HB3 GLU 47 1HB GLU 47 -2.146 0.341 -7.352
350 HG2 GLU 47 2HG GLU 47 -0.213 0.377 -9.000
351 HG3 GLU 47 1HG GLU 47 -0.453 -1.362 -9.118
352 H LEU 48 H LEU 48 1.968 0.488 -6.937
353 HA LEU 48 HA LEU 48 1.250 3.340 -6.774
354 HG LEU 48 HG LEU 48 4.213 4.348 -6.777
355 HB2 LEU 48 2HB LEU 48 2.606 2.704 -4.811
356 HB3 LEU 48 1HB LEU 48 3.831 2.067 -5.890
357 HD11 LEU 48 1HD1 LEU 48 2.339 5.206 -4.579
358 HD12 LEU 48 2HD1 LEU 48 2.061 5.348 -6.318
359 HD13 LEU 48 3HD1 LEU 48 3.348 6.276 -5.553
360 HD21 LEU 48 3HD2 LEU 48 5.637 3.455 -5.018
361 HD22 LEU 48 1HD2 LEU 48 4.520 4.062 -3.795
362 HD23 LEU 48 2HD2 LEU 48 5.407 5.193 -4.819
363 H ASN 49 H ASN 49 1.406 4.191 -8.699
364 HA ASN 49 HA ASN 49 2.125 4.851 -10.723
365 HB2 ASN 49 2HB ASN 49 4.773 3.593 -9.916
366 HB3 ASN 49 1HB ASN 49 4.539 4.525 -11.380
367 HD21 ASN 49 1HD2 ASN 49 2.793 6.526 -9.981
368 HD22 ASN 49 2HD2 ASN 49 3.880 7.438 -9.015
369 H GLY 50 H GLY 50 0.995 2.202 -10.162
370 HA2 GLY 50 2HA GLY 50 0.093 0.808 -11.842
371 HA3 GLY 50 1HA GLY 50 1.534 1.081 -12.806
372 H LYS 51 H LYS 51 2.863 0.461 -9.873
373 HA LYS 51 HA LYS 51 3.106 -2.350 -10.601
374 HB2 LYS 51 2HB LYS 51 4.861 -0.613 -8.850
375 HB3 LYS 51 1HB LYS 51 5.083 -2.337 -9.047
376 HG2 LYS 51 2HG LYS 51 6.670 -1.365 -10.430
377 HG3 LYS 51 1HG LYS 51 5.399 -1.873 -11.523
378 HD2 LYS 51 2HD LYS 51 4.538 0.402 -11.671
379 HD3 LYS 51 1HD LYS 51 5.715 0.952 -10.479
380 HE2 LYS 51 2HE LYS 51 6.434 1.568 -12.719
381 HE3 LYS 51 1HE LYS 51 7.541 0.391 -12.028
382 HZ1 LYS 51 3HZ LYS 51 6.456 -1.338 -13.386
383 HZ2 LYS 51 1HZ LYS 51 7.031 -0.097 -14.356
384 HZ3 LYS 51 2HZ LYS 51 5.401 -0.203 -14.013
385 H GLU 52 H GLU 52 2.481 -3.902 -9.277
386 HA GLU 52 HA GLU 52 1.177 -3.001 -6.834
387 HB2 GLU 52 2HB GLU 52 -0.243 -5.112 -7.022
388 HB3 GLU 52 1HB GLU 52 -0.673 -3.835 -8.107
389 HG2 GLU 52 2HG GLU 52 -0.775 -5.630 -9.519
390 HG3 GLU 52 1HG GLU 52 0.915 -5.214 -9.749
391 H GLY 53 H GLY 53 1.280 -4.146 -4.956
392 HA2 GLY 53 2HA GLY 53 2.685 -6.553 -4.693
393 HA3 GLY 53 1HA GLY 53 3.749 -5.199 -4.331
394 H VAL 54 H VAL 54 3.652 -6.363 -2.230
395 HA VAL 54 HA VAL 54 1.287 -5.499 -0.709
396 HB VAL 54 HB VAL 54 1.682 -7.329 0.886
397 HG11 VAL 54 1HG1 VAL 54 0.129 -7.714 -0.925
398 HG12 VAL 54 2HG1 VAL 54 0.989 -9.205 -0.536
399 HG13 VAL 54 3HG1 VAL 54 1.439 -8.269 -1.962
400 HG21 VAL 54 3HG2 VAL 54 3.844 -8.220 -1.028
401 HG22 VAL 54 1HG2 VAL 54 3.264 -9.141 0.360
402 HG23 VAL 54 2HG2 VAL 54 4.092 -7.603 0.607
403 H PHE 55 H PHE 55 1.607 -4.903 1.472
404 HA PHE 55 HA PHE 55 4.248 -4.280 2.401
405 HD1 PHE 55 2HD PHE 55 1.564 -2.460 -0.280
406 HD2 PHE 55 1HD PHE 55 2.037 -0.848 3.632
407 HE1 PHE 55 2HE PHE 55 -0.609 -1.330 -0.477
408 HE2 PHE 55 1HE PHE 55 -0.131 0.281 3.434
409 HZ PHE 55 HZ PHE 55 -1.460 0.043 1.375
410 HB2 PHE 55 2HB PHE 55 3.900 -1.863 2.513
411 HB3 PHE 55 1HB PHE 55 3.765 -2.427 0.844
412 HA PRO 56 HA PRO 56 1.856 -4.559 6.216
413 HB2 PRO 56 2HB PRO 56 3.755 -2.790 7.571
414 HB3 PRO 56 1HB PRO 56 3.491 -4.518 7.818
415 HG2 PRO 56 2HG PRO 56 5.752 -3.563 6.689
416 HG3 PRO 56 1HG PRO 56 5.044 -5.121 6.224
417 HD2 PRO 56 2HD PRO 56 4.849 -2.466 4.845
418 HD3 PRO 56 1HD PRO 56 5.161 -4.079 4.162
419 H ASP 57 H ASP 57 0.203 -3.440 7.081
420 HA ASP 57 HA ASP 57 -0.633 -1.040 5.892
421 HB2 ASP 57 2HB ASP 57 -2.594 -1.135 7.228
422 HB3 ASP 57 1HB ASP 57 -2.153 -2.790 6.855
423 H ASN 58 H ASN 58 1.319 -1.472 8.660
424 HA ASN 58 HA ASN 58 0.589 0.956 9.978
425 HB2 ASN 58 2HB ASN 58 2.446 0.551 11.470
426 HB3 ASN 58 1HB ASN 58 1.566 -0.944 11.190
427 HD21 ASN 58 1HD2 ASN 58 4.581 0.698 10.878
428 HD22 ASN 58 2HD2 ASN 58 5.461 -0.645 10.265
429 H PHE 59 H PHE 59 2.256 0.539 7.155
430 HA PHE 59 HA PHE 59 3.896 2.903 7.650
431 HD1 PHE 59 1HD PHE 59 6.509 2.774 7.406
432 HD2 PHE 59 2HD PHE 59 4.833 -1.036 6.576
433 HE1 PHE 59 1HE PHE 59 8.260 1.729 8.751
434 HE2 PHE 59 2HE PHE 59 6.593 -2.101 7.937
435 HZ PHE 59 HZ PHE 59 8.308 -0.709 9.025
436 HB2 PHE 59 2HB PHE 59 4.038 0.843 5.462
437 HB3 PHE 59 1HB PHE 59 4.976 2.338 5.442
438 H ALA 60 H ALA 60 0.866 2.425 6.746
439 HA ALA 60 HA ALA 60 0.837 4.804 5.105
440 HB1 ALA 60 1HB ALA 60 -0.564 3.794 3.384
441 HB2 ALA 60 2HB ALA 60 -0.449 2.230 4.190
442 HB3 ALA 60 3HB ALA 60 0.989 2.959 3.474
443 H VAL 61 H VAL 61 -1.397 5.586 4.871
444 HA VAL 61 HA VAL 61 -3.267 4.468 6.822
445 HB VAL 61 HB VAL 61 -2.092 6.483 7.800
446 HG11 VAL 61 1HG1 VAL 61 -2.633 8.730 6.993
447 HG12 VAL 61 2HG1 VAL 61 -3.459 8.019 5.607
448 HG13 VAL 61 3HG1 VAL 61 -1.722 7.790 5.803
449 HG21 VAL 61 3HG2 VAL 61 -4.125 7.636 8.555
450 HG22 VAL 61 1HG2 VAL 61 -4.280 5.877 8.604
451 HG23 VAL 61 2HG2 VAL 61 -5.035 6.791 7.299
452 H GLN 62 H GLN 62 -5.451 4.580 6.068
453 HA GLN 62 HA GLN 62 -5.500 5.099 3.240
454 HB2 GLN 62 2HB GLN 62 -6.553 3.030 4.130
455 HB3 GLN 62 1HB GLN 62 -7.747 4.031 4.948
456 HG2 GLN 62 2HG GLN 62 -8.556 4.871 2.828
457 HG3 GLN 62 1HG GLN 62 -7.302 3.980 1.971
458 HE21 GLN 62 1HE2 GLN 62 -10.208 3.797 1.630
459 HE22 GLN 62 2HE2 GLN 62 -10.559 2.153 1.974
460 H ILE 63 H ILE 63 -6.498 6.684 2.245
461 HA ILE 63 HA ILE 63 -7.251 8.997 3.797
462 HB ILE 63 HB ILE 63 -7.478 8.569 0.795
463 HG12 ILE 63 2HG1 ILE 63 -5.096 9.677 2.311
464 HG13 ILE 63 1HG1 ILE 63 -5.185 8.086 1.556
465 HG21 ILE 63 1HG2 ILE 63 -7.219 11.082 2.447
466 HG22 ILE 63 2HG2 ILE 63 -8.675 10.504 1.636
467 HG23 ILE 63 3HG2 ILE 63 -7.282 11.017 0.684
468 HD11 ILE 63 3HD1 ILE 63 -5.361 10.718 0.117
469 HD12 ILE 63 1HD1 ILE 63 -5.423 9.119 -0.628
470 HD13 ILE 63 2HD1 ILE 63 -3.951 9.659 0.177
471 H SER 64 H SER 64 -8.762 7.286 1.058
472 HA SER 64 HA SER 64 -11.128 6.678 2.358
473 HG SER 64 HG SER 64 -11.105 8.930 2.787
474 HB2 SER 64 2HB SER 64 -11.018 8.786 0.179
475 HB3 SER 64 1HB SER 64 -12.474 7.948 0.709
Start of MODEL 10
1 H1 GLY 1 1HT GLY 1 -9.317 -8.497 -0.309
2 H2 GLY 1 2HT GLY 1 -9.266 -8.619 -1.997
3 H3 GLY 1 3HT GLY 1 -9.584 -9.995 -1.050
4 HA2 GLY 1 1HA GLY 1 -11.630 -9.085 -2.015
5 HA3 GLY 1 2HA GLY 1 -11.612 -9.009 -0.258
6 H ALA 2 H ALA 2 -11.793 -7.126 0.722
7 HA ALA 2 HA ALA 2 -12.348 -4.944 1.059
8 HB1 ALA 2 1HB ALA 2 -10.692 -3.340 0.203
9 HB2 ALA 2 2HB ALA 2 -10.105 -4.549 -0.933
10 HB3 ALA 2 3HB ALA 2 -9.904 -4.802 0.799
11 H MET 3 H MET 3 -12.373 -2.661 -0.610
12 HA MET 3 HA MET 3 -14.162 -3.614 -2.673
13 HB2 MET 3 2HB MET 3 -15.115 -1.286 -2.846
14 HB3 MET 3 1HB MET 3 -15.434 -2.091 -1.326
15 HG2 MET 3 2HG MET 3 -13.638 -0.795 -0.296
16 HG3 MET 3 1HG MET 3 -13.380 0.022 -1.841
17 HE1 MET 3 3HE MET 3 -15.076 2.702 0.501
18 HE2 MET 3 1HE MET 3 -13.613 2.226 -0.360
19 HE3 MET 3 2HE MET 3 -14.099 1.357 1.096
20 H GLY 4 H GLY 4 -11.224 -2.534 -2.145
21 HA2 GLY 4 2HA GLY 4 -9.562 -3.068 -3.670
22 HA3 GLY 4 1HA GLY 4 -10.755 -3.063 -4.939
23 H ALA 5 H ALA 5 -10.240 -1.774 -6.384
24 HA ALA 5 HA ALA 5 -8.056 -0.176 -6.466
25 HB1 ALA 5 1HB ALA 5 -8.729 0.487 -8.646
26 HB2 ALA 5 2HB ALA 5 -10.406 0.078 -8.293
27 HB3 ALA 5 3HB ALA 5 -9.192 -1.195 -8.379
28 H LYS 6 H LYS 6 -11.192 0.940 -5.514
29 HA LYS 6 HA LYS 6 -10.084 3.610 -5.715
30 HB2 LYS 6 2HB LYS 6 -12.979 2.867 -5.507
31 HB3 LYS 6 1HB LYS 6 -12.390 4.523 -5.374
32 HG2 LYS 6 2HG LYS 6 -11.276 4.154 -7.632
33 HG3 LYS 6 1HG LYS 6 -12.244 2.686 -7.751
34 HD2 LYS 6 2HD LYS 6 -13.374 4.465 -8.914
35 HD3 LYS 6 1HD LYS 6 -14.283 4.068 -7.460
36 HE2 LYS 6 2HE LYS 6 -14.139 6.484 -7.786
37 HE3 LYS 6 1HE LYS 6 -13.323 6.015 -6.306
38 HZ1 LYS 6 3HZ LYS 6 -11.173 6.222 -7.512
39 HZ2 LYS 6 1HZ LYS 6 -12.061 7.645 -7.547
40 HZ3 LYS 6 2HZ LYS 6 -12.002 6.660 -8.903
41 H GLU 7 H GLU 7 -9.625 1.694 -3.570
42 HA GLU 7 HA GLU 7 -10.181 3.554 -1.377
43 HB2 GLU 7 2HB GLU 7 -8.965 0.772 -1.363
44 HB3 GLU 7 1HB GLU 7 -9.146 1.778 0.071
45 HG2 GLU 7 2HG GLU 7 -11.570 1.770 -0.283
46 HG3 GLU 7 1HG GLU 7 -11.343 0.695 -1.660
47 H TYR 8 H TYR 8 -8.610 4.956 -0.789
48 HA TYR 8 HA TYR 8 -5.980 4.391 -1.965
49 HD1 TYR 8 2HD TYR 8 -5.604 5.587 -4.581
50 HD2 TYR 8 1HD TYR 8 -9.195 6.973 -2.822
51 HE1 TYR 8 2HE TYR 8 -6.767 5.359 -6.762
52 HE2 TYR 8 1HE TYR 8 -10.358 6.747 -4.961
53 HH TYR 8 HH TYR 8 -8.950 5.142 -7.652
54 HB2 TYR 8 2HB TYR 8 -7.114 7.178 -1.616
55 HB3 TYR 8 1HB TYR 8 -5.614 6.726 -2.388
56 H CYS 9 H CYS 9 -4.289 4.528 -0.736
57 HA CYS 9 HA CYS 9 -4.654 5.588 1.947
58 HG CYS 9 HG CYS 9 -4.220 1.884 0.108
59 HB2 CYS 9 2HB CYS 9 -2.965 3.753 2.615
60 HB3 CYS 9 1HB CYS 9 -4.627 3.266 2.306
61 H ARG 10 H ARG 10 -2.812 6.519 2.909
62 HA ARG 10 HA ARG 10 -0.824 7.392 0.919
63 HE ARG 10 HE ARG 10 0.464 12.203 1.179
64 HB2 ARG 10 2HB ARG 10 -2.460 9.147 1.635
65 HB3 ARG 10 1HB ARG 10 -1.881 8.948 3.282
66 HG2 ARG 10 2HG ARG 10 0.366 9.639 2.545
67 HG3 ARG 10 1HG ARG 10 -0.274 9.922 0.925
68 HD2 ARG 10 2HD ARG 10 -1.906 11.515 1.925
69 HD3 ARG 10 1HD ARG 10 -1.086 11.288 3.471
70 HH11 ARG 10 1HH1 ARG 10 -0.972 12.948 4.345
71 HH12 ARG 10 2HH1 ARG 10 -0.175 14.438 4.492
72 HH21 ARG 10 1HH2 ARG 10 1.547 14.300 1.438
73 HH22 ARG 10 2HH2 ARG 10 1.274 15.173 2.873
74 H THR 11 H THR 11 1.262 7.121 1.516
75 HA THR 11 HA THR 11 1.843 5.615 3.840
76 HB THR 11 HB THR 11 4.232 6.104 3.000
77 HG1 THR 11 1HG THR 11 4.308 6.830 0.923
78 HG21 THR 11 3HG2 THR 11 3.013 3.978 2.681
79 HG22 THR 11 1HG2 THR 11 3.984 4.402 1.266
80 HG23 THR 11 2HG2 THR 11 2.241 4.678 1.256
81 H LEU 12 H LEU 12 2.701 6.236 5.702
82 HA LEU 12 HA LEU 12 3.097 9.113 6.181
83 HG LEU 12 HG LEU 12 0.598 7.347 6.968
84 HB2 LEU 12 2HB LEU 12 2.717 6.821 8.109
85 HB3 LEU 12 1HB LEU 12 2.886 8.505 8.557
86 HD11 LEU 12 1HD1 LEU 12 -0.710 7.777 9.001
87 HD12 LEU 12 2HD1 LEU 12 0.780 8.206 9.850
88 HD13 LEU 12 3HD1 LEU 12 0.551 6.568 9.230
89 HD21 LEU 12 3HD2 LEU 12 -0.455 9.539 7.345
90 HD22 LEU 12 1HD2 LEU 12 1.024 9.676 6.391
91 HD23 LEU 12 2HD2 LEU 12 1.030 10.110 8.101
92 H PHE 13 H PHE 13 4.625 6.117 5.802
93 HA PHE 13 HA PHE 13 7.208 7.228 6.553
94 HD1 PHE 13 1HD PHE 13 4.467 5.385 8.869
95 HD2 PHE 13 2HD PHE 13 8.581 6.406 9.209
96 HE1 PHE 13 1HE PHE 13 4.068 6.215 11.143
97 HE2 PHE 13 2HE PHE 13 8.190 7.234 11.488
98 HZ PHE 13 HZ PHE 13 5.930 7.142 12.460
99 HB2 PHE 13 2HB PHE 13 6.100 4.518 7.336
100 HB3 PHE 13 1HB PHE 13 7.804 4.935 7.449
101 HA PRO 14 HA PRO 14 8.141 5.280 2.634
102 HB2 PRO 14 2HB PRO 14 10.832 5.127 2.798
103 HB3 PRO 14 1HB PRO 14 10.002 6.665 2.553
104 HG2 PRO 14 2HG PRO 14 11.140 5.506 5.061
105 HG3 PRO 14 1HG PRO 14 11.203 7.177 4.473
106 HD2 PRO 14 2HD PRO 14 9.445 6.299 6.378
107 HD3 PRO 14 1HD PRO 14 9.113 7.667 5.299
108 H TYR 15 H TYR 15 9.041 3.270 1.803
109 HA TYR 15 HA TYR 15 9.763 1.241 3.743
110 HD1 TYR 15 2HD TYR 15 8.434 -0.405 5.201
111 HD2 TYR 15 1HD TYR 15 7.341 -1.270 1.194
112 HE1 TYR 15 2HE TYR 15 8.483 -2.789 5.717
113 HE2 TYR 15 1HE TYR 15 7.384 -3.672 1.699
114 HH TYR 15 HH TYR 15 8.460 -5.179 3.376
115 HB2 TYR 15 2HB TYR 15 7.268 1.274 3.654
116 HB3 TYR 15 1HB TYR 15 7.361 0.949 1.930
117 H THR 16 H THR 16 11.366 0.086 2.834
118 HA THR 16 HA THR 16 11.655 0.181 -0.070
119 HB THR 16 HB THR 16 13.689 -0.619 2.045
120 HG1 THR 16 1HG THR 16 12.879 1.664 1.908
121 HG21 THR 16 3HG2 THR 16 14.009 0.047 -0.896
122 HG22 THR 16 1HG2 THR 16 14.123 -1.566 -0.196
123 HG23 THR 16 2HG2 THR 16 15.320 -0.336 0.218
124 H GLY 17 H GLY 17 11.179 -1.602 -1.196
125 HA2 GLY 17 2HA GLY 17 10.488 -4.020 0.216
126 HA3 GLY 17 1HA GLY 17 10.326 -3.737 -1.515
127 H THR 18 H THR 18 11.660 -5.833 0.346
128 HA THR 18 HA THR 18 14.349 -5.758 -0.782
129 HB THR 18 HB THR 18 14.804 -7.680 0.745
130 HG1 THR 18 1HG THR 18 12.008 -7.423 1.302
131 HG21 THR 18 3HG2 THR 18 15.194 -5.411 1.554
132 HG22 THR 18 1HG2 THR 18 14.646 -6.452 2.868
133 HG23 THR 18 2HG2 THR 18 13.525 -5.318 2.116
134 H ASN 19 H ASN 19 11.323 -6.993 -1.219
135 HA ASN 19 HA ASN 19 12.202 -9.096 -3.085
136 HB2 ASN 19 2HB ASN 19 9.517 -8.650 -1.730
137 HB3 ASN 19 1HB ASN 19 9.839 -9.900 -2.907
138 HD21 ASN 19 1HD2 ASN 19 10.322 -8.840 0.375
139 HD22 ASN 19 2HD2 ASN 19 10.876 -10.358 0.969
140 H GLU 20 H GLU 20 10.675 -9.150 -5.046
141 HA GLU 20 HA GLU 20 10.286 -6.429 -5.961
142 HB2 GLU 20 2HB GLU 20 10.198 -9.113 -7.314
143 HB3 GLU 20 1HB GLU 20 9.534 -7.695 -8.104
144 HG2 GLU 20 2HG GLU 20 11.792 -8.177 -8.863
145 HG3 GLU 20 1HG GLU 20 11.696 -6.616 -8.059
146 H ASP 21 H ASP 21 8.510 -9.129 -4.932
147 HA ASP 21 HA ASP 21 5.886 -8.184 -5.621
148 HB2 ASP 21 2HB ASP 21 6.289 -10.552 -5.262
149 HB3 ASP 21 1HB ASP 21 6.827 -10.243 -3.618
150 H GLU 22 H GLU 22 8.051 -7.749 -3.018
151 HA GLU 22 HA GLU 22 6.214 -6.352 -1.271
152 HB2 GLU 22 2HB GLU 22 8.149 -7.729 -0.461
153 HB3 GLU 22 1HB GLU 22 9.232 -6.630 -1.289
154 HG2 GLU 22 2HG GLU 22 8.537 -4.843 0.219
155 HG3 GLU 22 1HG GLU 22 7.475 -5.982 1.055
156 H LEU 23 H LEU 23 5.734 -4.248 -1.695
157 HA LEU 23 HA LEU 23 7.102 -3.067 -3.982
158 HG LEU 23 HG LEU 23 3.786 -1.647 -4.978
159 HB2 LEU 23 2HB LEU 23 4.488 -3.367 -3.472
160 HB3 LEU 23 1HB LEU 23 4.722 -1.833 -2.694
161 HD11 LEU 23 1HD1 LEU 23 5.216 0.113 -5.812
162 HD12 LEU 23 2HD1 LEU 23 6.466 -0.365 -4.659
163 HD13 LEU 23 3HD1 LEU 23 4.918 0.250 -4.081
164 HD21 LEU 23 3HD2 LEU 23 4.926 -3.516 -6.029
165 HD22 LEU 23 1HD2 LEU 23 6.470 -2.672 -5.893
166 HD23 LEU 23 2HD2 LEU 23 5.198 -2.023 -6.923
167 H THR 24 H THR 24 8.054 -1.071 -3.958
168 HA THR 24 HA THR 24 8.925 -0.122 -1.350
169 HB THR 24 HB THR 24 9.888 0.508 -4.148
170 HG1 THR 24 1HG THR 24 10.400 -1.566 -3.406
171 HG21 THR 24 3HG2 THR 24 11.801 1.642 -3.034
172 HG22 THR 24 1HG2 THR 24 11.014 1.412 -1.474
173 HG23 THR 24 2HG2 THR 24 10.272 2.443 -2.693
174 H PHE 25 H PHE 25 8.230 1.729 -0.509
175 HA PHE 25 HA PHE 25 6.702 3.568 -2.192
176 HD1 PHE 25 2HD PHE 25 3.848 3.497 -2.250
177 HD2 PHE 25 1HD PHE 25 5.429 0.349 0.092
178 HE1 PHE 25 2HE PHE 25 2.259 1.936 -3.297
179 HE2 PHE 25 1HE PHE 25 3.844 -1.215 -0.947
180 HZ PHE 25 HZ PHE 25 2.259 -0.426 -2.637
181 HB2 PHE 25 2HB PHE 25 5.960 2.623 0.584
182 HB3 PHE 25 1HB PHE 25 5.189 3.946 -0.280
183 H ARG 26 H ARG 26 6.958 5.670 -1.680
184 HA ARG 26 HA ARG 26 8.844 6.293 0.457
185 HE ARG 26 HE ARG 26 12.174 6.007 -2.459
186 HB2 ARG 26 2HB ARG 26 8.012 7.903 -1.965
187 HB3 ARG 26 1HB ARG 26 9.016 8.548 -0.678
188 HG2 ARG 26 2HG ARG 26 9.717 6.192 -2.426
189 HG3 ARG 26 1HG ARG 26 10.357 7.828 -2.590
190 HD2 ARG 26 2HD ARG 26 11.391 7.681 -0.401
191 HD3 ARG 26 1HD ARG 26 10.676 6.098 -0.126
192 HH11 ARG 26 1HH1 ARG 26 12.703 6.365 1.017
193 HH12 ARG 26 2HH1 ARG 26 14.233 5.613 1.001
194 HH21 ARG 26 1HH2 ARG 26 14.256 4.995 -2.485
195 HH22 ARG 26 2HH2 ARG 26 15.147 4.812 -1.043
196 H GLU 27 H GLU 27 8.297 8.537 1.408
197 HA GLU 27 HA GLU 27 5.790 8.130 2.733
198 HB2 GLU 27 2HB GLU 27 7.865 8.815 3.832
199 HB3 GLU 27 1HB GLU 27 7.827 10.326 2.936
200 HG2 GLU 27 2HG GLU 27 5.688 10.850 4.041
201 HG3 GLU 27 1HG GLU 27 5.878 9.388 5.012
202 H GLY 28 H GLY 28 3.907 9.219 2.379
203 HA2 GLY 28 2HA GLY 28 2.573 11.030 1.826
204 HA3 GLY 28 1HA GLY 28 3.953 11.790 1.057
205 H GLU 29 H GLU 29 3.358 8.545 0.178
206 HA GLU 29 HA GLU 29 2.598 9.435 -2.500
207 HB2 GLU 29 2HB GLU 29 3.355 6.689 -1.470
208 HB3 GLU 29 1HB GLU 29 3.033 7.095 -3.144
209 HG2 GLU 29 2HG GLU 29 5.286 8.223 -1.497
210 HG3 GLU 29 1HG GLU 29 5.427 6.875 -2.616
211 H ILE 30 H ILE 30 0.712 8.693 -3.494
212 HA ILE 30 HA ILE 30 -1.316 7.680 -1.662
213 HB ILE 30 HB ILE 30 -1.575 8.984 -4.392
214 HG12 ILE 30 2HG1 ILE 30 -1.003 10.529 -2.560
215 HG13 ILE 30 1HG1 ILE 30 -2.617 10.851 -3.194
216 HG21 ILE 30 1HG2 ILE 30 -3.324 7.313 -4.141
217 HG22 ILE 30 2HG2 ILE 30 -4.013 8.934 -4.050
218 HG23 ILE 30 3HG2 ILE 30 -3.775 7.994 -2.577
219 HD11 ILE 30 3HD1 ILE 30 -3.574 9.682 -1.261
220 HD12 ILE 30 1HD1 ILE 30 -2.555 11.034 -0.772
221 HD13 ILE 30 2HD1 ILE 30 -1.951 9.388 -0.641
222 H ILE 31 H ILE 31 -1.773 5.671 -1.732
223 HA ILE 31 HA ILE 31 -0.700 4.009 -3.891
224 HB ILE 31 HB ILE 31 -1.802 3.197 -1.191
225 HG12 ILE 31 2HG1 ILE 31 1.098 3.521 -1.990
226 HG13 ILE 31 1HG1 ILE 31 0.204 4.653 -0.977
227 HG21 ILE 31 1HG2 ILE 31 -1.832 1.410 -2.846
228 HG22 ILE 31 2HG2 ILE 31 -0.614 1.085 -1.610
229 HG23 ILE 31 3HG2 ILE 31 -0.127 1.684 -3.197
230 HD11 ILE 31 3HD1 ILE 31 1.653 3.089 0.281
231 HD12 ILE 31 1HD1 ILE 31 0.675 1.760 -0.314
232 HD13 ILE 31 2HD1 ILE 31 -0.049 2.977 0.743
233 H HIS 32 H HIS 32 -2.062 2.915 -5.202
234 HA HIS 32 HA HIS 32 -4.936 3.237 -4.818
235 HD1 HIS 32 1HD HIS 32 -2.565 2.983 -9.004
236 HD2 HIS 32 2HD HIS 32 -4.677 5.427 -6.385
237 HE1 HIS 32 1HE HIS 32 -2.251 5.311 -9.821
238 HB2 HIS 32 2HB HIS 32 -3.477 1.731 -7.018
239 HB3 HIS 32 1HB HIS 32 -5.152 2.248 -7.026
240 H LEU 33 H LEU 33 -5.750 1.812 -3.415
241 HA LEU 33 HA LEU 33 -4.283 -0.484 -2.660
242 HG LEU 33 HG LEU 33 -5.270 -1.509 -0.473
243 HB2 LEU 33 2HB LEU 33 -5.627 0.968 -1.159
244 HB3 LEU 33 1HB LEU 33 -7.067 0.402 -1.956
245 HD11 LEU 33 1HD1 LEU 33 -6.663 -1.091 1.490
246 HD12 LEU 33 2HD1 LEU 33 -7.541 0.159 0.613
247 HD13 LEU 33 3HD1 LEU 33 -5.836 0.385 1.001
248 HD21 LEU 33 3HD2 LEU 33 -7.232 -2.834 -0.318
249 HD22 LEU 33 1HD2 LEU 33 -7.108 -2.320 -1.983
250 HD23 LEU 33 2HD2 LEU 33 -8.270 -1.528 -0.905
251 H ILE 34 H ILE 34 -4.648 -2.571 -3.065
252 HA ILE 34 HA ILE 34 -6.538 -3.210 -5.227
253 HB ILE 34 HB ILE 34 -4.078 -4.746 -4.336
254 HG12 ILE 34 2HG1 ILE 34 -3.413 -2.642 -5.390
255 HG13 ILE 34 1HG1 ILE 34 -3.028 -3.999 -6.440
256 HG21 ILE 34 1HG2 ILE 34 -4.367 -6.038 -6.399
257 HG22 ILE 34 2HG2 ILE 34 -5.870 -5.172 -6.725
258 HG23 ILE 34 3HG2 ILE 34 -5.744 -6.214 -5.308
259 HD11 ILE 34 3HD1 ILE 34 -3.899 -2.143 -7.712
260 HD12 ILE 34 1HD1 ILE 34 -5.368 -2.127 -6.731
261 HD13 ILE 34 2HD1 ILE 34 -5.017 -3.506 -7.774
262 H SER 35 H SER 35 -5.217 -4.358 -2.111
263 HA SER 35 HA SER 35 -7.751 -5.525 -1.440
264 HG SER 35 HG SER 35 -6.461 -8.772 -0.691
265 HB2 SER 35 2HB SER 35 -6.666 -7.324 -2.812
266 HB3 SER 35 1HB SER 35 -5.311 -7.311 -1.691
267 H LYS 36 H LYS 36 -7.971 -5.762 0.814
268 HA LYS 36 HA LYS 36 -5.725 -4.872 2.428
269 HB2 LYS 36 2HB LYS 36 -8.720 -4.901 2.864
270 HB3 LYS 36 1HB LYS 36 -7.578 -4.552 4.161
271 HG2 LYS 36 2HG LYS 36 -6.767 -2.644 3.080
272 HG3 LYS 36 1HG LYS 36 -7.564 -2.999 1.577
273 HD2 LYS 36 2HD LYS 36 -8.665 -1.199 2.693
274 HD3 LYS 36 1HD LYS 36 -9.736 -2.610 2.707
275 HE2 LYS 36 2HE LYS 36 -9.377 -2.972 4.953
276 HE3 LYS 36 1HE LYS 36 -7.903 -1.998 4.951
277 HZ1 LYS 36 3HZ LYS 36 -9.287 -0.027 4.584
278 HZ2 LYS 36 1HZ LYS 36 -9.767 -0.770 6.017
279 HZ3 LYS 36 2HZ LYS 36 -10.693 -0.938 4.618
280 H GLU 37 H GLU 37 -7.012 -7.586 1.299
281 HA GLU 37 HA GLU 37 -6.266 -9.138 3.661
282 HB2 GLU 37 2HB GLU 37 -8.113 -10.071 1.452
283 HB3 GLU 37 1HB GLU 37 -7.796 -10.876 2.975
284 HG2 GLU 37 2HG GLU 37 -9.806 -9.989 3.467
285 HG3 GLU 37 1HG GLU 37 -8.811 -8.610 3.926
286 H THR 38 H THR 38 -4.346 -10.036 3.318
287 HA THR 38 HA THR 38 -3.672 -10.988 0.601
288 HB THR 38 HB THR 38 -1.284 -10.592 1.357
289 HG1 THR 38 1HG THR 38 -2.166 -8.695 3.189
290 HG21 THR 38 3HG2 THR 38 -3.096 -8.169 1.143
291 HG22 THR 38 1HG2 THR 38 -2.398 -9.050 -0.215
292 HG23 THR 38 2HG2 THR 38 -1.351 -8.160 0.890
293 H GLY 39 H GLY 39 -4.642 -11.960 3.480
294 HA2 GLY 39 2HA GLY 39 -4.581 -14.229 4.206
295 HA3 GLY 39 1HA GLY 39 -2.960 -14.371 3.519
296 H GLU 40 H GLU 40 -2.439 -11.623 4.561
297 HA GLU 40 HA GLU 40 -1.831 -12.361 7.325
298 HB2 GLU 40 2HB GLU 40 -0.364 -10.550 5.413
299 HB3 GLU 40 1HB GLU 40 0.084 -10.815 7.089
300 HG2 GLU 40 2HG GLU 40 0.458 -13.197 6.569
301 HG3 GLU 40 1HG GLU 40 0.071 -12.863 4.883
302 H ALA 41 H ALA 41 -2.463 -10.951 8.873
303 HA ALA 41 HA ALA 41 -4.195 -8.773 8.057
304 HB1 ALA 41 1HB ALA 41 -3.521 -9.815 10.810
305 HB2 ALA 41 2HB ALA 41 -4.966 -10.217 9.872
306 HB3 ALA 41 3HB ALA 41 -4.717 -8.572 10.455
307 H GLY 42 H GLY 42 -3.045 -7.125 7.391
308 HA2 GLY 42 2HA GLY 42 -1.932 -5.152 8.558
309 HA3 GLY 42 1HA GLY 42 -0.713 -6.349 8.981
310 H TRP 43 H TRP 43 -1.446 -7.565 6.230
311 HA TRP 43 HA TRP 43 0.298 -5.745 4.785
312 HD1 TRP 43 HD TRP 43 1.228 -8.565 7.045
313 HE1 TRP 43 1HE TRP 43 3.749 -8.430 7.547
314 HE3 TRP 43 3HE TRP 43 2.881 -7.011 2.469
315 HZ2 TRP 43 2HZ TRP 43 6.126 -7.754 6.177
316 HZ3 TRP 43 3HZ TRP 43 5.289 -6.647 2.146
317 HH2 TRP 43 HH TRP 43 6.874 -7.014 3.957
318 HB2 TRP 43 2HB TRP 43 -0.049 -8.725 4.545
319 HB3 TRP 43 1HB TRP 43 0.717 -7.772 3.283
320 H TRP 44 H TRP 44 -0.404 -4.734 3.168
321 HA TRP 44 HA TRP 44 -2.989 -5.483 2.003
322 HD1 TRP 44 HD TRP 44 -3.807 -5.173 4.117
323 HE1 TRP 44 1HE TRP 44 -5.433 -4.001 5.716
324 HE3 TRP 44 3HE TRP 44 -3.313 -0.388 2.416
325 HZ2 TRP 44 2HZ TRP 44 -6.353 -1.425 6.208
326 HZ3 TRP 44 3HZ TRP 44 -4.617 1.375 3.519
327 HH2 TRP 44 HH TRP 44 -6.122 0.839 5.375
328 HB2 TRP 44 2HB TRP 44 -1.689 -2.798 2.408
329 HB3 TRP 44 1HB TRP 44 -3.016 -3.045 1.289
330 H LYS 45 H LYS 45 -3.176 -4.821 -0.236
331 HA LYS 45 HA LYS 45 -0.598 -4.934 -1.621
332 HB2 LYS 45 2HB LYS 45 -1.965 -7.007 -1.940
333 HB3 LYS 45 1HB LYS 45 -3.270 -6.015 -2.567
334 HG2 LYS 45 2HG LYS 45 -1.932 -5.375 -4.475
335 HG3 LYS 45 1HG LYS 45 -0.538 -6.223 -3.808
336 HD2 LYS 45 2HD LYS 45 -1.767 -8.341 -3.960
337 HD3 LYS 45 1HD LYS 45 -3.143 -7.484 -4.654
338 HE2 LYS 45 2HE LYS 45 -1.883 -6.875 -6.589
339 HE3 LYS 45 1HE LYS 45 -0.389 -7.474 -5.884
340 HZ1 LYS 45 3HZ LYS 45 -1.210 -9.086 -7.435
341 HZ2 LYS 45 1HZ LYS 45 -2.740 -9.112 -6.688
342 HZ3 LYS 45 2HZ LYS 45 -1.411 -9.694 -5.874
343 H GLY 46 H GLY 46 -0.237 -3.284 -2.938
344 HA2 GLY 46 2HA GLY 46 -2.467 -1.591 -3.728
345 HA3 GLY 46 1HA GLY 46 -1.184 -0.871 -2.763
346 H GLU 47 H GLU 47 -1.899 -0.086 -5.322
347 HA GLU 47 HA GLU 47 0.426 -0.894 -6.896
348 HB2 GLU 47 2HB GLU 47 -1.737 -1.480 -7.914
349 HB3 GLU 47 1HB GLU 47 -2.270 0.174 -7.774
350 HG2 GLU 47 2HG GLU 47 0.113 -0.570 -9.448
351 HG3 GLU 47 1HG GLU 47 -1.523 -0.713 -10.069
352 H LEU 48 H LEU 48 1.873 0.522 -7.338
353 HA LEU 48 HA LEU 48 1.231 3.337 -7.403
354 HG LEU 48 HG LEU 48 4.026 4.457 -6.823
355 HB2 LEU 48 2HB LEU 48 2.064 2.939 -5.110
356 HB3 LEU 48 1HB LEU 48 3.536 2.243 -5.769
357 HD11 LEU 48 1HD1 LEU 48 1.687 5.367 -5.162
358 HD12 LEU 48 2HD1 LEU 48 1.791 5.363 -6.926
359 HD13 LEU 48 3HD1 LEU 48 2.837 6.420 -5.980
360 HD21 LEU 48 3HD2 LEU 48 3.653 4.567 -3.852
361 HD22 LEU 48 1HD2 LEU 48 4.786 5.518 -4.796
362 HD23 LEU 48 2HD2 LEU 48 5.012 3.767 -4.651
363 H ASN 49 H ASN 49 2.176 4.255 -9.078
364 HA ASN 49 HA ASN 49 3.522 4.738 -10.825
365 HB2 ASN 49 2HB ASN 49 5.491 2.774 -9.612
366 HB3 ASN 49 1HB ASN 49 5.840 3.854 -10.951
367 HD21 ASN 49 1HD2 ASN 49 7.193 3.686 -8.488
368 HD22 ASN 49 2HD2 ASN 49 7.051 5.206 -7.679
369 H GLY 50 H GLY 50 1.739 2.207 -10.611
370 HA2 GLY 50 2HA GLY 50 0.928 1.060 -12.453
371 HA3 GLY 50 1HA GLY 50 2.480 1.254 -13.255
372 H LYS 51 H LYS 51 2.893 0.357 -10.031
373 HA LYS 51 HA LYS 51 2.967 -2.469 -10.769
374 HB2 LYS 51 2HB LYS 51 5.023 -0.976 -9.139
375 HB3 LYS 51 1HB LYS 51 4.876 -2.725 -9.137
376 HG2 LYS 51 2HG LYS 51 6.590 -2.309 -10.615
377 HG3 LYS 51 1HG LYS 51 5.196 -2.574 -11.649
378 HD2 LYS 51 2HD LYS 51 4.893 -0.114 -11.826
379 HD3 LYS 51 1HD LYS 51 6.389 0.100 -10.913
380 HE2 LYS 51 2HE LYS 51 6.838 0.298 -13.283
381 HE3 LYS 51 1HE LYS 51 7.598 -1.157 -12.638
382 HZ1 LYS 51 3HZ LYS 51 5.078 -1.044 -14.232
383 HZ2 LYS 51 1HZ LYS 51 5.718 -2.460 -13.535
384 HZ3 LYS 51 2HZ LYS 51 6.570 -1.635 -14.702
385 H GLU 52 H GLU 52 1.890 -3.725 -9.571
386 HA GLU 52 HA GLU 52 0.929 -2.737 -7.014
387 HB2 GLU 52 2HB GLU 52 -0.786 -4.539 -7.136
388 HB3 GLU 52 1HB GLU 52 -0.908 -3.392 -8.450
389 HG2 GLU 52 2HG GLU 52 0.414 -6.089 -8.711
390 HG3 GLU 52 1HG GLU 52 -1.290 -5.803 -9.042
391 H GLY 53 H GLY 53 1.601 -3.479 -5.212
392 HA2 GLY 53 2HA GLY 53 2.764 -6.129 -5.062
393 HA3 GLY 53 1HA GLY 53 3.802 -4.782 -4.631
394 H VAL 54 H VAL 54 3.699 -6.079 -2.557
395 HA VAL 54 HA VAL 54 1.324 -5.252 -1.044
396 HB VAL 54 HB VAL 54 1.731 -7.145 0.484
397 HG11 VAL 54 1HG1 VAL 54 1.002 -8.935 -1.017
398 HG12 VAL 54 2HG1 VAL 54 1.459 -7.949 -2.404
399 HG13 VAL 54 3HG1 VAL 54 0.151 -7.422 -1.342
400 HG21 VAL 54 3HG2 VAL 54 3.852 -7.925 -1.511
401 HG22 VAL 54 1HG2 VAL 54 3.277 -8.925 -0.178
402 HG23 VAL 54 2HG2 VAL 54 4.122 -7.415 0.158
403 H PHE 55 H PHE 55 1.637 -4.810 1.205
404 HA PHE 55 HA PHE 55 4.252 -4.117 2.161
405 HD1 PHE 55 2HD PHE 55 1.469 -2.474 -0.443
406 HD2 PHE 55 1HD PHE 55 2.061 -0.590 3.332
407 HE1 PHE 55 2HE PHE 55 -0.725 -1.393 -0.638
408 HE2 PHE 55 1HE PHE 55 -0.137 0.494 3.135
409 HZ PHE 55 HZ PHE 55 -1.531 0.092 1.145
410 HB2 PHE 55 2HB PHE 55 3.894 -1.706 2.260
411 HB3 PHE 55 1HB PHE 55 3.738 -2.296 0.606
412 HA PRO 56 HA PRO 56 1.751 -4.325 5.925
413 HB2 PRO 56 2HB PRO 56 3.678 -2.648 7.337
414 HB3 PRO 56 1HB PRO 56 3.371 -4.371 7.548
415 HG2 PRO 56 2HG PRO 56 5.678 -3.430 6.479
416 HG3 PRO 56 1HG PRO 56 4.971 -4.988 6.020
417 HD2 PRO 56 2HD PRO 56 4.833 -2.354 4.603
418 HD3 PRO 56 1HD PRO 56 5.130 -3.981 3.945
419 H ASP 57 H ASP 57 0.062 -3.111 6.438
420 HA ASP 57 HA ASP 57 -0.314 -0.556 5.261
421 HB2 ASP 57 2HB ASP 57 -2.516 -0.566 6.101
422 HB3 ASP 57 1HB ASP 57 -2.138 -2.254 5.795
423 H ASN 58 H ASN 58 1.017 -1.458 8.234
424 HA ASN 58 HA ASN 58 0.358 0.848 9.701
425 HB2 ASN 58 2HB ASN 58 2.253 0.223 11.243
426 HB3 ASN 58 1HB ASN 58 1.043 -1.024 11.000
427 HD21 ASN 58 1HD2 ASN 58 2.477 -2.608 11.675
428 HD22 ASN 58 2HD2 ASN 58 3.779 -3.160 10.692
429 H PHE 59 H PHE 59 2.510 0.541 7.125
430 HA PHE 59 HA PHE 59 4.044 2.886 7.894
431 HD1 PHE 59 1HD PHE 59 4.617 -0.754 6.736
432 HD2 PHE 59 2HD PHE 59 6.970 2.776 6.826
433 HE1 PHE 59 1HE PHE 59 6.448 -2.000 7.795
434 HE2 PHE 59 2HE PHE 59 8.801 1.541 7.880
435 HZ PHE 59 HZ PHE 59 8.543 -0.858 8.369
436 HB2 PHE 59 2HB PHE 59 4.044 1.197 5.391
437 HB3 PHE 59 1HB PHE 59 4.976 2.682 5.520
438 H ALA 60 H ALA 60 0.983 2.473 6.856
439 HA ALA 60 HA ALA 60 0.926 5.062 5.533
440 HB1 ALA 60 1HB ALA 60 -0.563 4.179 3.806
441 HB2 ALA 60 2HB ALA 60 -0.404 2.559 4.478
442 HB3 ALA 60 3HB ALA 60 0.995 3.353 3.759
443 H VAL 61 H VAL 61 -1.458 5.631 5.216
444 HA VAL 61 HA VAL 61 -3.214 4.432 7.187
445 HB VAL 61 HB VAL 61 -2.300 6.513 8.220
446 HG11 VAL 61 1HG1 VAL 61 -3.521 7.963 5.876
447 HG12 VAL 61 2HG1 VAL 61 -1.802 7.811 6.237
448 HG13 VAL 61 3HG1 VAL 61 -2.851 8.727 7.319
449 HG21 VAL 61 3HG2 VAL 61 -4.444 7.598 8.773
450 HG22 VAL 61 1HG2 VAL 61 -4.546 5.839 8.827
451 HG23 VAL 61 2HG2 VAL 61 -5.210 6.717 7.451
452 H GLN 62 H GLN 62 -5.276 4.161 6.340
453 HA GLN 62 HA GLN 62 -5.495 4.794 3.547
454 HB2 GLN 62 2HB GLN 62 -6.319 2.629 4.508
455 HB3 GLN 62 1HB GLN 62 -7.608 3.531 5.303
456 HG2 GLN 62 2HG GLN 62 -8.439 4.267 3.131
457 HG3 GLN 62 1HG GLN 62 -7.126 3.415 2.329
458 HE21 GLN 62 1HE2 GLN 62 -9.968 3.080 1.952
459 HE22 GLN 62 2HE2 GLN 62 -10.268 1.429 2.286
460 H ILE 63 H ILE 63 -6.567 6.423 2.690
461 HA ILE 63 HA ILE 63 -7.504 8.484 4.458
462 HB ILE 63 HB ILE 63 -7.678 8.325 1.425
463 HG12 ILE 63 2HG1 ILE 63 -5.337 8.086 2.093
464 HG13 ILE 63 1HG1 ILE 63 -5.600 9.644 1.330
465 HG21 ILE 63 1HG2 ILE 63 -7.750 10.709 3.262
466 HG22 ILE 63 2HG2 ILE 63 -9.124 10.009 2.411
467 HG23 ILE 63 3HG2 ILE 63 -7.813 10.762 1.499
468 HD11 ILE 63 3HD1 ILE 63 -5.636 10.697 3.563
469 HD12 ILE 63 1HD1 ILE 63 -4.116 9.862 3.232
470 HD13 ILE 63 2HD1 ILE 63 -5.317 9.119 4.283
471 H SER 64 H SER 64 -8.964 6.947 1.586
472 HA SER 64 HA SER 64 -11.240 6.106 3.017
473 HG SER 64 HG SER 64 -11.371 8.457 3.376
474 HB2 SER 64 2HB SER 64 -11.404 8.014 0.666
475 HB3 SER 64 1HB SER 64 -12.732 7.258 1.535
Start of MODEL 11
1 H1 GLY 1 1HT GLY 1 -14.243 -12.138 1.548
2 H2 GLY 1 2HT GLY 1 -14.802 -10.541 1.377
3 H3 GLY 1 3HT GLY 1 -14.056 -11.012 2.819
4 HA2 GLY 1 1HA GLY 1 -11.984 -11.286 1.701
5 HA3 GLY 1 2HA GLY 1 -12.769 -10.842 0.188
6 H ALA 2 H ALA 2 -10.778 -9.300 0.703
7 HA ALA 2 HA ALA 2 -12.084 -6.864 1.579
8 HB1 ALA 2 1HB ALA 2 -9.306 -7.615 2.503
9 HB2 ALA 2 2HB ALA 2 -10.758 -7.666 3.502
10 HB3 ALA 2 3HB ALA 2 -10.176 -6.124 2.879
11 H MET 3 H MET 3 -12.271 -6.532 -0.646
12 HA MET 3 HA MET 3 -9.788 -5.969 -2.084
13 HB2 MET 3 2HB MET 3 -12.618 -6.295 -3.099
14 HB3 MET 3 1HB MET 3 -11.238 -5.877 -4.099
15 HG2 MET 3 2HG MET 3 -11.592 -8.430 -2.551
16 HG3 MET 3 1HG MET 3 -11.793 -8.231 -4.292
17 HE1 MET 3 3HE MET 3 -8.509 -10.344 -4.028
18 HE2 MET 3 1HE MET 3 -10.128 -10.248 -4.725
19 HE3 MET 3 2HE MET 3 -9.926 -10.455 -2.985
20 H GLY 4 H GLY 4 -9.578 -3.984 -3.221
21 HA2 GLY 4 2HA GLY 4 -11.356 -1.898 -2.201
22 HA3 GLY 4 1HA GLY 4 -9.610 -1.720 -2.161
23 H ALA 5 H ALA 5 -11.716 -0.202 -3.466
24 HA ALA 5 HA ALA 5 -10.487 -0.120 -6.117
25 HB1 ALA 5 1HB ALA 5 -13.417 0.351 -5.527
26 HB2 ALA 5 2HB ALA 5 -12.751 -1.079 -6.310
27 HB3 ALA 5 3HB ALA 5 -12.638 0.490 -7.107
28 H LYS 6 H LYS 6 -12.557 1.617 -3.900
29 HA LYS 6 HA LYS 6 -11.315 4.167 -4.668
30 HB2 LYS 6 2HB LYS 6 -13.016 5.241 -3.225
31 HB3 LYS 6 1HB LYS 6 -13.741 4.238 -4.459
32 HG2 LYS 6 2HG LYS 6 -14.660 2.812 -2.963
33 HG3 LYS 6 1HG LYS 6 -13.261 2.871 -1.893
34 HD2 LYS 6 2HD LYS 6 -15.263 5.121 -2.142
35 HD3 LYS 6 1HD LYS 6 -15.390 3.840 -0.936
36 HE2 LYS 6 2HE LYS 6 -13.004 5.682 -1.232
37 HE3 LYS 6 1HE LYS 6 -14.300 5.916 -0.075
38 HZ1 LYS 6 3HZ LYS 6 -13.683 4.031 1.105
39 HZ2 LYS 6 1HZ LYS 6 -12.215 4.753 0.764
40 HZ3 LYS 6 2HZ LYS 6 -12.723 3.376 -0.084
41 H GLU 7 H GLU 7 -10.141 2.026 -3.059
42 HA GLU 7 HA GLU 7 -9.842 3.267 -0.435
43 HB2 GLU 7 2HB GLU 7 -8.633 0.705 -1.467
44 HB3 GLU 7 1HB GLU 7 -8.722 1.217 0.220
45 HG2 GLU 7 2HG GLU 7 -10.991 0.390 -1.583
46 HG3 GLU 7 1HG GLU 7 -10.296 -0.556 -0.277
47 H TYR 8 H TYR 8 -8.387 4.911 -0.474
48 HA TYR 8 HA TYR 8 -5.823 4.388 -1.829
49 HD1 TYR 8 1HD TYR 8 -5.905 5.364 -4.444
50 HD2 TYR 8 2HD TYR 8 -9.097 7.285 -2.396
51 HE1 TYR 8 1HE TYR 8 -7.277 5.242 -6.474
52 HE2 TYR 8 2HE TYR 8 -10.481 7.167 -4.424
53 HH TYR 8 HH TYR 8 -10.156 6.975 -6.861
54 HB2 TYR 8 2HB TYR 8 -6.938 7.168 -1.373
55 HB3 TYR 8 1HB TYR 8 -5.562 6.695 -2.322
56 H CYS 9 H CYS 9 -4.036 4.744 -0.653
57 HA CYS 9 HA CYS 9 -4.423 5.843 2.025
58 HG CYS 9 HG CYS 9 -2.487 1.660 1.420
59 HB2 CYS 9 2HB CYS 9 -2.661 4.186 2.774
60 HB3 CYS 9 1HB CYS 9 -4.226 3.502 2.360
61 H ARG 10 H ARG 10 -2.832 7.154 2.815
62 HA ARG 10 HA ARG 10 -0.819 7.981 0.842
63 HE ARG 10 HE ARG 10 0.634 11.216 4.132
64 HB2 ARG 10 2HB ARG 10 -2.404 9.719 1.946
65 HB3 ARG 10 1HB ARG 10 -1.487 9.425 3.415
66 HG2 ARG 10 2HG ARG 10 0.589 10.048 2.154
67 HG3 ARG 10 1HG ARG 10 -0.441 10.537 0.814
68 HD2 ARG 10 2HD ARG 10 0.018 12.509 2.011
69 HD3 ARG 10 1HD ARG 10 -1.618 12.049 2.483
70 HH11 ARG 10 1HH1 ARG 10 -2.228 13.263 3.822
71 HH12 ARG 10 2HH1 ARG 10 -2.238 13.728 5.457
72 HH21 ARG 10 1HH2 ARG 10 0.624 11.848 6.333
73 HH22 ARG 10 2HH2 ARG 10 -0.601 12.870 6.941
74 H THR 11 H THR 11 1.282 7.705 1.336
75 HA THR 11 HA THR 11 1.832 5.892 3.448
76 HB THR 11 HB THR 11 4.141 5.939 2.523
77 HG1 THR 11 1HG THR 11 4.593 7.257 0.877
78 HG21 THR 11 3HG2 THR 11 3.530 5.017 0.343
79 HG22 THR 11 1HG2 THR 11 1.927 5.729 0.487
80 HG23 THR 11 2HG2 THR 11 2.425 4.452 1.597
81 H LEU 12 H LEU 12 2.652 6.258 5.370
82 HA LEU 12 HA LEU 12 3.122 9.036 6.209
83 HG LEU 12 HG LEU 12 0.557 7.335 6.754
84 HB2 LEU 12 2HB LEU 12 2.649 6.519 7.791
85 HB3 LEU 12 1HB LEU 12 2.906 8.101 8.486
86 HD11 LEU 12 1HD1 LEU 12 0.846 7.649 9.729
87 HD12 LEU 12 2HD1 LEU 12 0.455 6.165 8.855
88 HD13 LEU 12 3HD1 LEU 12 -0.687 7.514 8.884
89 HD21 LEU 12 3HD2 LEU 12 1.150 9.825 8.359
90 HD22 LEU 12 1HD2 LEU 12 -0.376 9.464 7.552
91 HD23 LEU 12 2HD2 LEU 12 1.080 9.698 6.600
92 H PHE 13 H PHE 13 4.684 6.090 5.544
93 HA PHE 13 HA PHE 13 7.209 7.122 6.559
94 HD1 PHE 13 1HD PHE 13 4.268 4.986 8.496
95 HD2 PHE 13 2HD PHE 13 8.245 6.216 9.365
96 HE1 PHE 13 1HE PHE 13 3.580 5.585 10.777
97 HE2 PHE 13 2HE PHE 13 7.556 6.820 11.647
98 HZ PHE 13 HZ PHE 13 5.222 6.507 12.354
99 HB2 PHE 13 2HB PHE 13 6.114 4.341 7.087
100 HB3 PHE 13 1HB PHE 13 7.766 4.841 7.419
101 HA PRO 14 HA PRO 14 8.284 5.357 2.580
102 HB2 PRO 14 2HB PRO 14 10.998 5.393 2.839
103 HB3 PRO 14 1HB PRO 14 10.065 6.853 2.496
104 HG2 PRO 14 2HG PRO 14 11.209 5.902 5.082
105 HG3 PRO 14 1HG PRO 14 11.122 7.547 4.435
106 HD2 PRO 14 2HD PRO 14 9.397 6.565 6.322
107 HD3 PRO 14 1HD PRO 14 8.975 7.852 5.181
108 H TYR 15 H TYR 15 8.729 3.289 1.892
109 HA TYR 15 HA TYR 15 9.851 1.420 3.813
110 HD1 TYR 15 2HD TYR 15 8.716 -0.502 5.410
111 HD2 TYR 15 1HD TYR 15 7.294 -1.142 1.459
112 HE1 TYR 15 2HE TYR 15 8.921 -2.927 5.735
113 HE2 TYR 15 1HE TYR 15 7.495 -3.565 1.775
114 HH TYR 15 HH TYR 15 8.821 -5.086 3.187
115 HB2 TYR 15 2HB TYR 15 7.434 1.255 4.113
116 HB3 TYR 15 1HB TYR 15 7.220 1.022 2.383
117 H THR 16 H THR 16 11.245 0.126 2.912
118 HA THR 16 HA THR 16 11.459 0.178 0.016
119 HB THR 16 HB THR 16 13.499 -0.725 2.064
120 HG1 THR 16 1HG THR 16 12.826 1.513 2.174
121 HG21 THR 16 3HG2 THR 16 15.085 -0.417 0.204
122 HG22 THR 16 1HG2 THR 16 13.761 0.065 -0.853
123 HG23 THR 16 2HG2 THR 16 13.840 -1.586 -0.238
124 H GLY 17 H GLY 17 10.661 -1.541 -1.033
125 HA2 GLY 17 2HA GLY 17 9.912 -3.915 0.305
126 HA3 GLY 17 1HA GLY 17 9.915 -3.649 -1.440
127 H THR 18 H THR 18 11.078 -5.615 0.751
128 HA THR 18 HA THR 18 13.851 -5.693 -0.042
129 HB THR 18 HB THR 18 13.898 -7.745 1.446
130 HG1 THR 18 1HG THR 18 11.165 -6.998 1.985
131 HG21 THR 18 3HG2 THR 18 14.413 -5.504 2.319
132 HG22 THR 18 1HG2 THR 18 13.606 -6.493 3.538
133 HG23 THR 18 2HG2 THR 18 12.704 -5.258 2.664
134 H ASN 19 H ASN 19 10.924 -6.894 -0.911
135 HA ASN 19 HA ASN 19 12.003 -8.848 -2.824
136 HB2 ASN 19 2HB ASN 19 9.295 -8.564 -1.512
137 HB3 ASN 19 1HB ASN 19 9.610 -9.679 -2.814
138 HD21 ASN 19 1HD2 ASN 19 9.929 -9.021 0.589
139 HD22 ASN 19 2HD2 ASN 19 10.561 -10.545 1.027
140 H GLU 20 H GLU 20 10.796 -8.660 -4.963
141 HA GLU 20 HA GLU 20 10.160 -5.866 -5.434
142 HB2 GLU 20 2HB GLU 20 10.256 -8.170 -7.374
143 HB3 GLU 20 1HB GLU 20 9.955 -6.499 -7.820
144 HG2 GLU 20 2HG GLU 20 12.173 -5.897 -6.912
145 HG3 GLU 20 1HG GLU 20 12.470 -7.608 -6.609
146 H ASP 21 H ASP 21 8.599 -8.792 -4.857
147 HA ASP 21 HA ASP 21 5.983 -7.960 -5.764
148 HB2 ASP 21 2HB ASP 21 6.866 -10.250 -3.982
149 HB3 ASP 21 1HB ASP 21 5.191 -9.971 -4.440
150 H GLU 22 H GLU 22 7.931 -7.034 -3.432
151 HA GLU 22 HA GLU 22 5.862 -6.254 -1.529
152 HB2 GLU 22 2HB GLU 22 7.816 -7.610 -0.773
153 HB3 GLU 22 1HB GLU 22 8.892 -6.331 -1.319
154 HG2 GLU 22 2HG GLU 22 8.009 -4.889 0.387
155 HG3 GLU 22 1HG GLU 22 6.847 -6.135 0.875
156 H LEU 23 H LEU 23 5.452 -4.060 -1.557
157 HA LEU 23 HA LEU 23 6.581 -2.817 -3.906
158 HG LEU 23 HG LEU 23 3.327 -1.167 -4.518
159 HB2 LEU 23 2HB LEU 23 4.082 -3.065 -3.457
160 HB3 LEU 23 1HB LEU 23 4.267 -1.809 -2.265
161 HD11 LEU 23 1HD1 LEU 23 5.743 0.288 -3.459
162 HD12 LEU 23 2HD1 LEU 23 4.046 0.582 -3.036
163 HD13 LEU 23 3HD1 LEU 23 4.642 0.955 -4.651
164 HD21 LEU 23 3HD2 LEU 23 4.853 -2.429 -5.915
165 HD22 LEU 23 1HD2 LEU 23 6.201 -1.426 -5.380
166 HD23 LEU 23 2HD2 LEU 23 4.894 -0.715 -6.326
167 H THR 24 H THR 24 7.731 -1.010 -3.979
168 HA THR 24 HA THR 24 8.781 -0.029 -1.424
169 HB THR 24 HB THR 24 9.832 0.241 -4.242
170 HG1 THR 24 1HG THR 24 9.946 -1.826 -3.483
171 HG21 THR 24 3HG2 THR 24 11.029 1.062 -1.584
172 HG22 THR 24 1HG2 THR 24 10.593 2.117 -2.914
173 HG23 THR 24 2HG2 THR 24 11.949 0.998 -3.085
174 H PHE 25 H PHE 25 8.058 1.844 -0.722
175 HA PHE 25 HA PHE 25 7.335 3.887 -2.635
176 HD1 PHE 25 2HD PHE 25 5.774 4.387 1.255
177 HD2 PHE 25 1HD PHE 25 4.863 0.956 -1.070
178 HE1 PHE 25 2HE PHE 25 5.128 3.185 3.292
179 HE2 PHE 25 1HE PHE 25 4.217 -0.252 0.950
180 HZ PHE 25 HZ PHE 25 4.346 0.851 3.141
181 HB2 PHE 25 2HB PHE 25 5.361 4.502 -1.194
182 HB3 PHE 25 1HB PHE 25 5.207 3.020 -2.122
183 H ARG 26 H ARG 26 7.510 5.983 -1.901
184 HA ARG 26 HA ARG 26 9.135 6.290 0.512
185 HE ARG 26 HE ARG 26 7.363 10.147 -3.677
186 HB2 ARG 26 2HB ARG 26 9.668 8.524 -0.374
187 HB3 ARG 26 1HB ARG 26 10.009 7.290 -1.574
188 HG2 ARG 26 2HG ARG 26 7.854 7.795 -2.654
189 HG3 ARG 26 1HG ARG 26 7.617 9.095 -1.489
190 HD2 ARG 26 2HD ARG 26 9.607 10.209 -2.284
191 HD3 ARG 26 1HD ARG 26 9.929 8.864 -3.378
192 HH11 ARG 26 1HH1 ARG 26 10.720 9.918 -4.822
193 HH12 ARG 26 2HH1 ARG 26 10.382 10.628 -6.332
194 HH21 ARG 26 1HH2 ARG 26 6.926 11.131 -5.725
195 HH22 ARG 26 2HH2 ARG 26 8.169 11.359 -6.861
196 H GLU 27 H GLU 27 8.510 8.660 1.517
197 HA GLU 27 HA GLU 27 5.836 8.312 2.508
198 HB2 GLU 27 2HB GLU 27 7.809 8.960 3.902
199 HB3 GLU 27 1HB GLU 27 7.875 10.479 3.025
200 HG2 GLU 27 2HG GLU 27 5.606 10.990 3.853
201 HG3 GLU 27 1HG GLU 27 5.666 9.521 4.824
202 H GLY 28 H GLY 28 4.093 9.606 2.015
203 HA2 GLY 28 2HA GLY 28 3.061 11.621 1.317
204 HA3 GLY 28 1HA GLY 28 4.524 12.041 0.443
205 H GLU 29 H GLU 29 3.579 8.835 -0.064
206 HA GLU 29 HA GLU 29 2.709 9.558 -2.761
207 HB2 GLU 29 2HB GLU 29 3.515 6.881 -1.620
208 HB3 GLU 29 1HB GLU 29 3.039 7.165 -3.284
209 HG2 GLU 29 2HG GLU 29 5.459 8.281 -1.892
210 HG3 GLU 29 1HG GLU 29 5.433 7.003 -3.103
211 H ILE 30 H ILE 30 0.886 8.464 -3.706
212 HA ILE 30 HA ILE 30 -1.169 7.764 -1.730
213 HB ILE 30 HB ILE 30 -1.548 8.745 -4.579
214 HG12 ILE 30 2HG1 ILE 30 -0.645 10.550 -3.174
215 HG13 ILE 30 1HG1 ILE 30 -2.322 10.852 -3.629
216 HG21 ILE 30 1HG2 ILE 30 -3.912 8.997 -3.961
217 HG22 ILE 30 2HG2 ILE 30 -3.565 8.306 -2.378
218 HG23 ILE 30 3HG2 ILE 30 -3.369 7.326 -3.828
219 HD11 ILE 30 3HD1 ILE 30 -1.864 11.484 -1.319
220 HD12 ILE 30 1HD1 ILE 30 -1.373 9.827 -0.962
221 HD13 ILE 30 2HD1 ILE 30 -3.044 10.177 -1.411
222 H ILE 31 H ILE 31 -1.577 5.706 -1.698
223 HA ILE 31 HA ILE 31 -0.778 4.084 -4.010
224 HB ILE 31 HB ILE 31 -1.245 3.204 -1.142
225 HG12 ILE 31 2HG1 ILE 31 1.314 3.435 -2.745
226 HG13 ILE 31 1HG1 ILE 31 0.829 4.484 -1.420
227 HG21 ILE 31 1HG2 ILE 31 -1.863 1.433 -2.711
228 HG22 ILE 31 2HG2 ILE 31 -0.380 1.010 -1.853
229 HG23 ILE 31 3HG2 ILE 31 -0.302 1.584 -3.518
230 HD11 ILE 31 3HD1 ILE 31 2.493 2.863 -0.706
231 HD12 ILE 31 1HD1 ILE 31 1.442 1.541 -1.213
232 HD13 ILE 31 2HD1 ILE 31 0.958 2.589 0.119
233 H HIS 32 H HIS 32 -2.223 3.011 -5.121
234 HA HIS 32 HA HIS 32 -5.015 3.346 -4.412
235 HD1 HIS 32 1HD HIS 32 -6.002 4.541 -8.199
236 HD2 HIS 32 2HD HIS 32 -2.389 5.027 -6.188
237 HE1 HIS 32 1HE HIS 32 -5.160 6.827 -8.794
238 HB2 HIS 32 2HB HIS 32 -3.700 2.249 -6.935
239 HB3 HIS 32 1HB HIS 32 -5.425 2.526 -6.724
240 H LEU 33 H LEU 33 -5.627 1.873 -3.022
241 HA LEU 33 HA LEU 33 -4.200 -0.532 -2.624
242 HG LEU 33 HG LEU 33 -5.070 -1.721 -0.319
243 HB2 LEU 33 2HB LEU 33 -5.167 0.772 -0.819
244 HB3 LEU 33 1HB LEU 33 -6.764 0.536 -1.449
245 HD11 LEU 33 1HD1 LEU 33 -5.438 0.031 1.341
246 HD12 LEU 33 2HD1 LEU 33 -6.376 -1.412 1.709
247 HD13 LEU 33 3HD1 LEU 33 -7.167 -0.006 0.999
248 HD21 LEU 33 3HD2 LEU 33 -7.176 -2.870 -0.068
249 HD22 LEU 33 1HD2 LEU 33 -6.991 -2.389 -1.751
250 HD23 LEU 33 2HD2 LEU 33 -8.065 -1.474 -0.681
251 H ILE 34 H ILE 34 -4.616 -2.503 -3.195
252 HA ILE 34 HA ILE 34 -6.721 -2.971 -5.179
253 HB ILE 34 HB ILE 34 -4.209 -4.557 -4.526
254 HG12 ILE 34 2HG1 ILE 34 -3.661 -2.426 -5.600
255 HG13 ILE 34 1HG1 ILE 34 -3.337 -3.769 -6.686
256 HG21 ILE 34 1HG2 ILE 34 -5.918 -6.040 -5.374
257 HG22 ILE 34 2HG2 ILE 34 -4.646 -5.816 -6.583
258 HG23 ILE 34 3HG2 ILE 34 -6.186 -4.974 -6.758
259 HD11 ILE 34 3HD1 ILE 34 -5.420 -3.287 -7.867
260 HD12 ILE 34 1HD1 ILE 34 -4.330 -1.898 -7.864
261 HD13 ILE 34 2HD1 ILE 34 -5.718 -1.933 -6.779
262 H SER 35 H SER 35 -5.123 -4.434 -2.360
263 HA SER 35 HA SER 35 -7.641 -5.643 -1.536
264 HG SER 35 HG SER 35 -7.485 -7.322 -3.384
265 HB2 SER 35 2HB SER 35 -5.083 -7.227 -1.874
266 HB3 SER 35 1HB SER 35 -6.630 -7.850 -1.311
267 H LYS 36 H LYS 36 -7.762 -5.725 0.689
268 HA LYS 36 HA LYS 36 -5.423 -4.823 2.201
269 HB2 LYS 36 2HB LYS 36 -8.251 -5.391 3.105
270 HB3 LYS 36 1HB LYS 36 -6.947 -4.995 4.205
271 HG2 LYS 36 2HG LYS 36 -6.697 -2.844 3.037
272 HG3 LYS 36 1HG LYS 36 -8.155 -3.138 2.109
273 HD2 LYS 36 2HD LYS 36 -7.842 -2.841 5.093
274 HD3 LYS 36 1HD LYS 36 -8.734 -1.797 3.996
275 HE2 LYS 36 2HE LYS 36 -10.360 -3.612 3.612
276 HE3 LYS 36 1HE LYS 36 -9.444 -4.649 4.697
277 HZ1 LYS 36 3HZ LYS 36 -10.776 -2.112 5.485
278 HZ2 LYS 36 1HZ LYS 36 -9.879 -3.111 6.504
279 HZ3 LYS 36 2HZ LYS 36 -11.321 -3.652 5.845
280 H GLU 37 H GLU 37 -7.112 -7.630 1.337
281 HA GLU 37 HA GLU 37 -5.794 -9.166 3.435
282 HB2 GLU 37 2HB GLU 37 -8.244 -9.487 3.156
283 HB3 GLU 37 1HB GLU 37 -7.950 -10.031 1.509
284 HG2 GLU 37 2HG GLU 37 -6.596 -11.890 2.388
285 HG3 GLU 37 1HG GLU 37 -6.973 -11.365 4.024
286 H THR 38 H THR 38 -3.864 -9.803 2.849
287 HA THR 38 HA THR 38 -3.360 -10.684 0.110
288 HB THR 38 HB THR 38 -0.981 -10.628 1.041
289 HG1 THR 38 1HG THR 38 -1.800 -8.854 3.017
290 HG21 THR 38 3HG2 THR 38 -0.848 -8.172 0.856
291 HG22 THR 38 1HG2 THR 38 -2.604 -8.075 1.003
292 HG23 THR 38 2HG2 THR 38 -1.877 -8.867 -0.399
293 H GLY 39 H GLY 39 -4.502 -11.862 2.848
294 HA2 GLY 39 2HA GLY 39 -4.728 -14.261 3.154
295 HA3 GLY 39 1HA GLY 39 -3.005 -14.394 2.776
296 H GLU 40 H GLU 40 -2.001 -12.271 4.154
297 HA GLU 40 HA GLU 40 -2.355 -13.135 6.918
298 HB2 GLU 40 2HB GLU 40 -0.178 -11.498 5.606
299 HB3 GLU 40 1HB GLU 40 -0.260 -11.845 7.326
300 HG2 GLU 40 2HG GLU 40 0.084 -13.841 5.109
301 HG3 GLU 40 1HG GLU 40 1.318 -13.300 6.240
302 H ALA 41 H ALA 41 -3.192 -11.811 8.389
303 HA ALA 41 HA ALA 41 -4.335 -9.321 7.555
304 HB1 ALA 41 1HB ALA 41 -5.506 -10.787 9.149
305 HB2 ALA 41 2HB ALA 41 -5.196 -9.193 9.843
306 HB3 ALA 41 3HB ALA 41 -4.191 -10.564 10.304
307 H GLY 42 H GLY 42 -2.918 -7.763 7.170
308 HA2 GLY 42 2HA GLY 42 -1.831 -6.041 8.822
309 HA3 GLY 42 1HA GLY 42 -0.653 -7.344 8.970
310 H TRP 43 H TRP 43 -1.106 -8.135 6.180
311 HA TRP 43 HA TRP 43 0.568 -6.096 4.943
312 HD1 TRP 43 HD TRP 43 1.085 -9.766 6.520
313 HE1 TRP 43 1HE TRP 43 3.537 -10.004 7.212
314 HE3 TRP 43 3HE TRP 43 3.212 -6.841 2.910
315 HZ2 TRP 43 2HZ TRP 43 6.064 -9.061 6.336
316 HZ3 TRP 43 3HZ TRP 43 5.655 -6.559 2.907
317 HH2 TRP 43 HH TRP 43 7.050 -7.646 4.586
318 HB2 TRP 43 2HB TRP 43 -0.003 -8.959 4.167
319 HB3 TRP 43 1HB TRP 43 0.946 -7.852 3.190
320 H TRP 44 H TRP 44 -0.193 -4.856 3.439
321 HA TRP 44 HA TRP 44 -2.842 -5.374 2.291
322 HD1 TRP 44 HD TRP 44 -3.568 -5.040 4.490
323 HE1 TRP 44 1HE TRP 44 -5.338 -3.805 5.895
324 HE3 TRP 44 3HE TRP 44 -3.003 -0.343 2.568
325 HZ2 TRP 44 2HZ TRP 44 -6.350 -1.193 6.148
326 HZ3 TRP 44 3HZ TRP 44 -4.422 1.466 3.450
327 HH2 TRP 44 HH TRP 44 -6.073 1.021 5.204
328 HB2 TRP 44 2HB TRP 44 -1.298 -2.874 2.908
329 HB3 TRP 44 1HB TRP 44 -2.514 -2.865 1.646
330 H LYS 45 H LYS 45 -3.057 -4.751 0.030
331 HA LYS 45 HA LYS 45 -0.527 -4.884 -1.436
332 HB2 LYS 45 2HB LYS 45 -1.726 -7.081 -1.399
333 HB3 LYS 45 1HB LYS 45 -3.131 -6.290 -2.057
334 HG2 LYS 45 2HG LYS 45 -2.169 -6.075 -4.184
335 HG3 LYS 45 1HG LYS 45 -0.531 -6.351 -3.563
336 HD2 LYS 45 2HD LYS 45 -1.086 -8.640 -3.004
337 HD3 LYS 45 1HD LYS 45 -2.754 -8.393 -3.485
338 HE2 LYS 45 2HE LYS 45 -0.427 -8.137 -5.391
339 HE3 LYS 45 1HE LYS 45 -1.267 -9.657 -5.108
340 HZ1 LYS 45 3HZ LYS 45 -2.370 -7.202 -6.435
341 HZ2 LYS 45 1HZ LYS 45 -3.347 -8.470 -5.847
342 HZ3 LYS 45 2HZ LYS 45 -2.169 -8.729 -6.999
343 H GLY 46 H GLY 46 -0.378 -3.317 -2.904
344 HA2 GLY 46 2HA GLY 46 -2.762 -1.957 -3.831
345 HA3 GLY 46 1HA GLY 46 -1.650 -1.016 -2.848
346 H GLU 47 H GLU 47 -2.271 -0.373 -5.447
347 HA GLU 47 HA GLU 47 0.132 -1.112 -6.915
348 HB2 GLU 47 2HB GLU 47 -2.076 -1.722 -7.927
349 HB3 GLU 47 1HB GLU 47 -2.511 -0.033 -7.927
350 HG2 GLU 47 2HG GLU 47 -0.066 -0.919 -9.399
351 HG3 GLU 47 1HG GLU 47 -1.654 -1.188 -10.103
352 H LEU 48 H LEU 48 1.565 0.333 -7.249
353 HA LEU 48 HA LEU 48 0.905 3.166 -7.017
354 HG LEU 48 HG LEU 48 3.924 4.042 -6.532
355 HB2 LEU 48 2HB LEU 48 1.896 2.514 -4.883
356 HB3 LEU 48 1HB LEU 48 3.250 1.793 -5.730
357 HD11 LEU 48 1HD1 LEU 48 1.804 5.146 -6.506
358 HD12 LEU 48 2HD1 LEU 48 2.957 6.030 -5.497
359 HD13 LEU 48 3HD1 LEU 48 1.714 5.027 -4.749
360 HD21 LEU 48 3HD2 LEU 48 4.949 3.128 -4.532
361 HD22 LEU 48 1HD2 LEU 48 3.646 3.794 -3.549
362 HD23 LEU 48 2HD2 LEU 48 4.754 4.876 -4.391
363 H ASN 49 H ASN 49 1.214 3.852 -8.941
364 HA ASN 49 HA ASN 49 2.188 4.593 -10.826
365 HB2 ASN 49 2HB ASN 49 4.770 3.783 -9.485
366 HB3 ASN 49 1HB ASN 49 4.657 4.735 -10.954
367 HD21 ASN 49 1HD2 ASN 49 2.283 6.269 -9.846
368 HD22 ASN 49 2HD2 ASN 49 3.007 7.342 -8.711
369 H GLY 50 H GLY 50 1.515 1.622 -10.478
370 HA2 GLY 50 2HA GLY 50 1.310 0.539 -12.694
371 HA3 GLY 50 1HA GLY 50 3.035 0.775 -12.863
372 H LYS 51 H LYS 51 3.356 0.031 -9.908
373 HA LYS 51 HA LYS 51 3.114 -2.841 -10.407
374 HB2 LYS 51 2HB LYS 51 5.117 -1.310 -8.769
375 HB3 LYS 51 1HB LYS 51 4.796 -2.997 -8.433
376 HG2 LYS 51 2HG LYS 51 6.726 -2.927 -9.776
377 HG3 LYS 51 1HG LYS 51 5.425 -3.483 -10.816
378 HD2 LYS 51 2HD LYS 51 5.230 -1.240 -11.759
379 HD3 LYS 51 1HD LYS 51 6.526 -0.675 -10.705
380 HE2 LYS 51 2HE LYS 51 6.733 -2.772 -12.870
381 HE3 LYS 51 1HE LYS 51 7.433 -1.158 -12.895
382 HZ1 LYS 51 3HZ LYS 51 8.851 -1.806 -11.012
383 HZ2 LYS 51 1HZ LYS 51 9.090 -2.803 -12.340
384 HZ3 LYS 51 2HZ LYS 51 8.204 -3.364 -11.040
385 H GLU 52 H GLU 52 2.234 -4.175 -8.928
386 HA GLU 52 HA GLU 52 1.034 -2.890 -6.625
387 HB2 GLU 52 2HB GLU 52 -0.847 -4.502 -6.766
388 HB3 GLU 52 1HB GLU 52 -0.808 -3.434 -8.146
389 HG2 GLU 52 2HG GLU 52 0.153 -5.214 -9.503
390 HG3 GLU 52 1HG GLU 52 0.178 -6.278 -8.098
391 H GLY 53 H GLY 53 1.885 -3.532 -4.886
392 HA2 GLY 53 2HA GLY 53 2.833 -6.297 -4.727
393 HA3 GLY 53 1HA GLY 53 3.891 -4.985 -4.233
394 H VAL 54 H VAL 54 3.830 -6.205 -2.252
395 HA VAL 54 HA VAL 54 1.436 -5.571 -0.681
396 HB VAL 54 HB VAL 54 2.013 -7.431 0.829
397 HG11 VAL 54 1HG1 VAL 54 0.481 -7.874 -0.997
398 HG12 VAL 54 2HG1 VAL 54 1.465 -9.298 -0.667
399 HG13 VAL 54 3HG1 VAL 54 1.832 -8.272 -2.055
400 HG21 VAL 54 3HG2 VAL 54 4.440 -7.483 0.514
401 HG22 VAL 54 1HG2 VAL 54 4.227 -8.054 -1.140
402 HG23 VAL 54 2HG2 VAL 54 3.748 -9.075 0.218
403 H PHE 55 H PHE 55 1.732 -4.920 1.462
404 HA PHE 55 HA PHE 55 4.327 -4.201 2.431
405 HD1 PHE 55 1HD PHE 55 1.839 -2.520 -0.489
406 HD2 PHE 55 2HD PHE 55 1.944 -0.763 3.393
407 HE1 PHE 55 1HE PHE 55 -0.315 -1.427 -0.928
408 HE2 PHE 55 2HE PHE 55 -0.214 0.330 2.958
409 HZ PHE 55 HZ PHE 55 -1.348 -0.000 0.793
410 HB2 PHE 55 2HB PHE 55 3.940 -1.764 2.437
411 HB3 PHE 55 1HB PHE 55 3.913 -2.429 0.803
412 HA PRO 56 HA PRO 56 1.816 -4.495 6.173
413 HB2 PRO 56 2HB PRO 56 3.798 -2.762 7.514
414 HB3 PRO 56 1HB PRO 56 3.374 -4.440 7.866
415 HG2 PRO 56 2HG PRO 56 5.741 -3.798 6.764
416 HG3 PRO 56 1HG PRO 56 4.881 -5.288 6.332
417 HD2 PRO 56 2HD PRO 56 5.035 -2.690 4.840
418 HD3 PRO 56 1HD PRO 56 5.159 -4.360 4.234
419 H ASP 57 H ASP 57 0.149 -3.257 6.902
420 HA ASP 57 HA ASP 57 -0.316 -0.724 5.685
421 HB2 ASP 57 2HB ASP 57 -2.469 -0.691 6.778
422 HB3 ASP 57 1HB ASP 57 -2.152 -2.308 6.186
423 H ASN 58 H ASN 58 1.621 -1.245 8.161
424 HA ASN 58 HA ASN 58 0.895 0.819 10.024
425 HB2 ASN 58 2HB ASN 58 3.593 -0.481 9.631
426 HB3 ASN 58 1HB ASN 58 3.041 0.393 11.052
427 HD21 ASN 58 1HD2 ASN 58 1.590 -0.618 12.458
428 HD22 ASN 58 2HD2 ASN 58 1.331 -2.313 12.392
429 H PHE 59 H PHE 59 2.570 0.703 7.037
430 HA PHE 59 HA PHE 59 4.097 3.105 7.613
431 HD1 PHE 59 2HD PHE 59 4.454 -0.640 6.810
432 HD2 PHE 59 1HD PHE 59 7.128 2.669 6.642
433 HE1 PHE 59 2HE PHE 59 6.153 -1.949 8.015
434 HE2 PHE 59 1HE PHE 59 8.821 1.368 7.846
435 HZ PHE 59 HZ PHE 59 8.339 -0.942 8.537
436 HB2 PHE 59 2HB PHE 59 4.121 1.264 5.221
437 HB3 PHE 59 1HB PHE 59 5.125 2.703 5.365
438 H ALA 60 H ALA 60 1.025 2.666 6.741
439 HA ALA 60 HA ALA 60 0.925 5.179 5.302
440 HB1 ALA 60 1HB ALA 60 1.088 3.484 3.525
441 HB2 ALA 60 2HB ALA 60 -0.486 4.278 3.522
442 HB3 ALA 60 3HB ALA 60 -0.319 2.657 4.195
443 H VAL 61 H VAL 61 -1.414 5.835 5.012
444 HA VAL 61 HA VAL 61 -3.208 4.549 6.891
445 HB VAL 61 HB VAL 61 -2.251 6.484 8.105
446 HG11 VAL 61 1HG1 VAL 61 -1.702 7.954 6.264
447 HG12 VAL 61 2HG1 VAL 61 -2.745 8.794 7.412
448 HG13 VAL 61 3HG1 VAL 61 -3.412 8.180 5.901
449 HG21 VAL 61 3HG2 VAL 61 -4.366 7.579 8.756
450 HG22 VAL 61 1HG2 VAL 61 -4.515 5.824 8.646
451 HG23 VAL 61 2HG2 VAL 61 -5.149 6.845 7.357
452 H GLN 62 H GLN 62 -5.176 4.307 6.093
453 HA GLN 62 HA GLN 62 -5.688 5.016 3.406
454 HB2 GLN 62 2HB GLN 62 -6.607 2.970 4.161
455 HB3 GLN 62 1HB GLN 62 -7.379 3.738 5.540
456 HG2 GLN 62 2HG GLN 62 -8.978 4.798 4.153
457 HG3 GLN 62 1HG GLN 62 -8.101 4.352 2.699
458 HE21 GLN 62 1HE2 GLN 62 -10.031 3.503 1.993
459 HE22 GLN 62 2HE2 GLN 62 -10.550 1.918 2.418
460 H ILE 63 H ILE 63 -6.353 6.797 2.662
461 HA ILE 63 HA ILE 63 -6.949 9.081 4.254
462 HB ILE 63 HB ILE 63 -7.433 8.706 1.286
463 HG12 ILE 63 2HG1 ILE 63 -4.904 9.679 2.643
464 HG13 ILE 63 1HG1 ILE 63 -5.116 8.079 1.937
465 HG21 ILE 63 1HG2 ILE 63 -7.089 11.143 1.175
466 HG22 ILE 63 2HG2 ILE 63 -6.914 11.192 2.928
467 HG23 ILE 63 3HG2 ILE 63 -8.454 10.722 2.210
468 HD11 ILE 63 3HD1 ILE 63 -5.240 10.690 0.447
469 HD12 ILE 63 1HD1 ILE 63 -5.421 9.086 -0.258
470 HD13 ILE 63 2HD1 ILE 63 -3.884 9.560 0.455
471 H SER 64 H SER 64 -8.861 7.078 2.018
472 HA SER 64 HA SER 64 -11.256 7.863 3.415
473 HG SER 64 HG SER 64 -10.322 9.600 2.030
474 HB2 SER 64 2HB SER 64 -10.856 7.677 0.423
475 HB3 SER 64 1HB SER 64 -12.381 8.002 1.255
Start of MODEL 12
1 H1 GLY 1 1HT GLY 1 -13.285 -8.175 3.442
2 H2 GLY 1 2HT GLY 1 -14.006 -6.824 2.685
3 H3 GLY 1 3HT GLY 1 -12.616 -6.639 3.599
4 HA2 GLY 1 1HA GLY 1 -11.315 -7.811 2.047
5 HA3 GLY 1 2HA GLY 1 -12.758 -8.161 1.102
6 H ALA 2 H ALA 2 -10.914 -6.989 -0.281
7 HA ALA 2 HA ALA 2 -12.026 -4.439 -0.930
8 HB1 ALA 2 1HB ALA 2 -9.125 -4.715 -0.100
9 HB2 ALA 2 2HB ALA 2 -10.350 -3.763 0.730
10 HB3 ALA 2 3HB ALA 2 -9.821 -3.301 -0.889
11 H MET 3 H MET 3 -12.031 -4.391 -3.093
12 HA MET 3 HA MET 3 -10.276 -6.304 -4.465
13 HB2 MET 3 2HB MET 3 -13.053 -5.411 -5.247
14 HB3 MET 3 1HB MET 3 -12.012 -6.416 -6.242
15 HG2 MET 3 2HG MET 3 -13.112 -7.127 -3.531
16 HG3 MET 3 1HG MET 3 -13.655 -7.763 -5.079
17 HE1 MET 3 3HE MET 3 -13.406 -10.228 -4.228
18 HE2 MET 3 1HE MET 3 -12.877 -9.650 -2.647
19 HE3 MET 3 2HE MET 3 -11.946 -10.889 -3.494
20 H GLY 4 H GLY 4 -9.942 -3.459 -3.752
21 HA2 GLY 4 2HA GLY 4 -8.863 -1.674 -4.678
22 HA3 GLY 4 1HA GLY 4 -8.637 -2.659 -6.123
23 H ALA 5 H ALA 5 -11.460 -1.379 -4.450
24 HA ALA 5 HA ALA 5 -12.582 -0.640 -7.000
25 HB1 ALA 5 1HB ALA 5 -14.580 -0.001 -5.712
26 HB2 ALA 5 2HB ALA 5 -13.704 -0.327 -4.213
27 HB3 ALA 5 3HB ALA 5 -14.056 -1.641 -5.327
28 H LYS 6 H LYS 6 -12.595 1.221 -4.056
29 HA LYS 6 HA LYS 6 -10.908 3.233 -5.210
30 HB2 LYS 6 2HB LYS 6 -13.785 3.831 -4.522
31 HB3 LYS 6 1HB LYS 6 -12.554 5.079 -4.527
32 HG2 LYS 6 2HG LYS 6 -12.129 4.660 -6.893
33 HG3 LYS 6 1HG LYS 6 -13.356 3.396 -6.896
34 HD2 LYS 6 2HD LYS 6 -13.892 6.271 -6.182
35 HD3 LYS 6 1HD LYS 6 -14.110 5.603 -7.799
36 HE2 LYS 6 2HE LYS 6 -15.534 4.667 -5.302
37 HE3 LYS 6 1HE LYS 6 -16.216 5.726 -6.522
38 HZ1 LYS 6 3HZ LYS 6 -15.379 2.895 -6.920
39 HZ2 LYS 6 1HZ LYS 6 -15.892 3.936 -8.149
40 HZ3 LYS 6 2HZ LYS 6 -16.953 3.496 -6.916
41 H GLU 7 H GLU 7 -9.625 2.355 -3.524
42 HA GLU 7 HA GLU 7 -10.109 3.830 -1.076
43 HB2 GLU 7 2HB GLU 7 -9.252 0.913 -1.191
44 HB3 GLU 7 1HB GLU 7 -9.135 1.906 0.253
45 HG2 GLU 7 2HG GLU 7 -11.599 2.221 0.176
46 HG3 GLU 7 1HG GLU 7 -11.663 1.115 -1.192
47 H TYR 8 H TYR 8 -8.453 5.078 -0.670
48 HA TYR 8 HA TYR 8 -5.874 4.359 -1.908
49 HD1 TYR 8 1HD TYR 8 -5.154 5.831 -4.438
50 HD2 TYR 8 2HD TYR 8 -8.977 6.867 -2.925
51 HE1 TYR 8 1HE TYR 8 -6.065 5.762 -6.713
52 HE2 TYR 8 2HE TYR 8 -9.911 6.789 -5.201
53 HH TYR 8 HH TYR 8 -9.076 7.034 -7.501
54 HB2 TYR 8 2HB TYR 8 -6.971 7.157 -1.561
55 HB3 TYR 8 1HB TYR 8 -5.406 6.734 -2.201
56 H CYS 9 H CYS 9 -4.080 4.733 -0.726
57 HA CYS 9 HA CYS 9 -4.470 5.807 1.951
58 HG CYS 9 HG CYS 9 -2.838 1.474 1.468
59 HB2 CYS 9 2HB CYS 9 -2.853 4.004 2.746
60 HB3 CYS 9 1HB CYS 9 -4.480 3.477 2.339
61 H ARG 10 H ARG 10 -2.646 6.765 2.876
62 HA ARG 10 HA ARG 10 -0.583 7.531 0.923
63 HE ARG 10 HE ARG 10 2.035 11.071 3.610
64 HB2 ARG 10 2HB ARG 10 -1.790 9.497 1.677
65 HB3 ARG 10 1HB ARG 10 -1.603 9.009 3.362
66 HG2 ARG 10 2HG ARG 10 0.861 9.223 3.083
67 HG3 ARG 10 1HG ARG 10 0.574 9.877 1.479
68 HD2 ARG 10 2HD ARG 10 -0.509 11.795 2.380
69 HD3 ARG 10 1HD ARG 10 -0.544 11.081 3.998
70 HH11 ARG 10 1HH1 ARG 10 -0.213 13.719 2.837
71 HH12 ARG 10 2HH1 ARG 10 0.973 14.921 3.030
72 HH21 ARG 10 1HH2 ARG 10 3.593 12.662 3.887
73 HH22 ARG 10 2HH2 ARG 10 3.242 14.313 3.632
74 H THR 11 H THR 11 1.483 7.010 1.387
75 HA THR 11 HA THR 11 2.075 5.468 3.671
76 HB THR 11 HB THR 11 4.446 5.997 2.630
77 HG1 THR 11 1HG THR 11 4.330 6.856 0.711
78 HG21 THR 11 3HG2 THR 11 2.292 4.312 1.437
79 HG22 THR 11 1HG2 THR 11 3.407 3.814 2.709
80 HG23 THR 11 2HG2 THR 11 4.011 4.133 1.064
81 H LEU 12 H LEU 12 2.728 6.129 5.527
82 HA LEU 12 HA LEU 12 3.383 8.947 6.009
83 HG LEU 12 HG LEU 12 0.789 7.321 6.784
84 HB2 LEU 12 2HB LEU 12 2.875 6.659 7.909
85 HB3 LEU 12 1HB LEU 12 3.143 8.321 8.375
86 HD11 LEU 12 1HD1 LEU 12 1.053 8.143 9.667
87 HD12 LEU 12 2HD1 LEU 12 0.726 6.517 9.056
88 HD13 LEU 12 3HD1 LEU 12 -0.464 7.800 8.838
89 HD21 LEU 12 3HD2 LEU 12 1.394 10.040 7.956
90 HD22 LEU 12 1HD2 LEU 12 -0.126 9.568 7.201
91 HD23 LEU 12 2HD2 LEU 12 1.346 9.635 6.238
92 H PHE 13 H PHE 13 4.790 6.011 5.425
93 HA PHE 13 HA PHE 13 7.386 6.952 6.317
94 HD1 PHE 13 1HD PHE 13 8.772 6.032 8.761
95 HD2 PHE 13 2HD PHE 13 4.704 4.806 8.599
96 HE1 PHE 13 1HE PHE 13 8.503 6.622 11.128
97 HE2 PHE 13 2HE PHE 13 4.428 5.401 10.969
98 HZ PHE 13 HZ PHE 13 6.339 6.310 12.231
99 HB2 PHE 13 2HB PHE 13 6.209 4.229 6.892
100 HB3 PHE 13 1HB PHE 13 7.929 4.566 6.982
101 HA PRO 14 HA PRO 14 8.288 5.246 2.252
102 HB2 PRO 14 2HB PRO 14 11.081 5.288 3.116
103 HB3 PRO 14 1HB PRO 14 10.341 6.191 1.795
104 HG2 PRO 14 2HG PRO 14 11.201 7.384 4.050
105 HG3 PRO 14 1HG PRO 14 9.778 7.961 3.163
106 HD2 PRO 14 2HD PRO 14 9.921 6.330 5.662
107 HD3 PRO 14 1HD PRO 14 8.823 7.658 5.205
108 H TYR 15 H TYR 15 8.420 3.142 1.723
109 HA TYR 15 HA TYR 15 9.691 1.294 3.614
110 HD1 TYR 15 1HD TYR 15 8.692 -0.627 5.155
111 HD2 TYR 15 2HD TYR 15 7.162 -1.401 1.249
112 HE1 TYR 15 1HE TYR 15 8.997 -3.035 5.508
113 HE2 TYR 15 2HE TYR 15 7.472 -3.818 1.612
114 HH TYR 15 HH TYR 15 8.800 -5.284 2.964
115 HB2 TYR 15 2HB TYR 15 7.253 1.073 3.857
116 HB3 TYR 15 1HB TYR 15 7.091 0.819 2.123
117 H THR 16 H THR 16 11.290 0.257 2.667
118 HA THR 16 HA THR 16 11.254 -0.050 -0.234
119 HB THR 16 HB THR 16 13.520 -0.543 1.730
120 HG1 THR 16 1HG THR 16 12.935 1.635 1.724
121 HG21 THR 16 3HG2 THR 16 13.730 -1.711 -0.434
122 HG22 THR 16 1HG2 THR 16 14.938 -0.437 -0.280
123 HG23 THR 16 2HG2 THR 16 13.504 -0.181 -1.280
124 H GLY 17 H GLY 17 10.556 -1.988 -0.965
125 HA2 GLY 17 2HA GLY 17 10.067 -4.145 0.764
126 HA3 GLY 17 1HA GLY 17 9.996 -4.158 -0.996
127 H THR 18 H THR 18 11.108 -6.032 1.026
128 HA THR 18 HA THR 18 13.945 -6.040 0.404
129 HB THR 18 HB THR 18 13.840 -8.257 1.750
130 HG1 THR 18 1HG THR 18 11.165 -7.748 1.650
131 HG21 THR 18 3HG2 THR 18 14.705 -6.174 2.696
132 HG22 THR 18 1HG2 THR 18 13.776 -7.065 3.902
133 HG23 THR 18 2HG2 THR 18 13.066 -5.664 3.099
134 H ASN 19 H ASN 19 11.018 -7.631 -0.351
135 HA ASN 19 HA ASN 19 12.241 -9.211 -2.475
136 HB2 ASN 19 2HB ASN 19 9.473 -9.161 -1.244
137 HB3 ASN 19 1HB ASN 19 9.931 -10.185 -2.583
138 HD21 ASN 19 1HD2 ASN 19 10.165 -9.602 0.778
139 HD22 ASN 19 2HD2 ASN 19 10.846 -11.119 1.257
140 H GLU 20 H GLU 20 11.121 -8.899 -4.615
141 HA GLU 20 HA GLU 20 10.256 -6.138 -4.764
142 HB2 GLU 20 2HB GLU 20 10.534 -6.305 -7.214
143 HB3 GLU 20 1HB GLU 20 12.005 -6.644 -6.330
144 HG2 GLU 20 2HG GLU 20 11.678 -9.030 -6.712
145 HG3 GLU 20 1HG GLU 20 10.192 -8.677 -7.604
146 H ASP 21 H ASP 21 8.856 -8.867 -4.176
147 HA ASP 21 HA ASP 21 6.381 -8.450 -5.617
148 HB2 ASP 21 2HB ASP 21 7.117 -10.701 -4.653
149 HB3 ASP 21 1HB ASP 21 6.784 -10.034 -3.057
150 H GLU 22 H GLU 22 8.017 -7.333 -2.909
151 HA GLU 22 HA GLU 22 5.870 -5.925 -1.600
152 HB2 GLU 22 2HB GLU 22 8.865 -6.005 -1.399
153 HB3 GLU 22 1HB GLU 22 7.937 -4.772 -0.574
154 HG2 GLU 22 2HG GLU 22 7.023 -6.224 0.852
155 HG3 GLU 22 1HG GLU 22 7.330 -7.665 -0.149
156 H LEU 23 H LEU 23 5.949 -3.528 -1.608
157 HA LEU 23 HA LEU 23 7.099 -2.601 -4.128
158 HG LEU 23 HG LEU 23 3.889 -1.176 -5.269
159 HB2 LEU 23 2HB LEU 23 4.478 -2.881 -3.762
160 HB3 LEU 23 1HB LEU 23 4.666 -1.334 -2.981
161 HD11 LEU 23 1HD1 LEU 23 5.455 0.540 -6.106
162 HD12 LEU 23 2HD1 LEU 23 6.621 0.035 -4.880
163 HD13 LEU 23 3HD1 LEU 23 5.079 0.738 -4.396
164 HD21 LEU 23 3HD2 LEU 23 4.979 -3.083 -6.242
165 HD22 LEU 23 1HD2 LEU 23 6.560 -2.316 -6.059
166 HD23 LEU 23 2HD2 LEU 23 5.369 -1.627 -7.157
167 H THR 24 H THR 24 8.178 -0.774 -4.043
168 HA THR 24 HA THR 24 8.820 0.203 -1.395
169 HB THR 24 HB THR 24 10.151 0.657 -4.078
170 HG1 THR 24 1HG THR 24 11.588 -0.811 -3.410
171 HG21 THR 24 3HG2 THR 24 12.000 1.712 -2.795
172 HG22 THR 24 1HG2 THR 24 11.023 1.628 -1.331
173 HG23 THR 24 2HG2 THR 24 10.511 2.643 -2.675
174 H PHE 25 H PHE 25 7.997 1.942 -0.616
175 HA PHE 25 HA PHE 25 6.756 3.938 -2.399
176 HD1 PHE 25 2HD PHE 25 4.022 3.654 -2.815
177 HD2 PHE 25 1HD PHE 25 5.173 0.871 0.166
178 HE1 PHE 25 2HE PHE 25 2.493 1.973 -3.794
179 HE2 PHE 25 1HE PHE 25 3.652 -0.803 -0.803
180 HZ PHE 25 HZ PHE 25 2.313 -0.247 -2.780
181 HB2 PHE 25 2HB PHE 25 5.808 3.106 0.349
182 HB3 PHE 25 1HB PHE 25 5.098 4.351 -0.671
183 H ARG 26 H ARG 26 6.693 6.112 -1.475
184 HA ARG 26 HA ARG 26 8.863 6.641 0.394
185 HE ARG 26 HE ARG 26 7.587 10.191 -2.689
186 HB2 ARG 26 2HB ARG 26 9.407 7.387 -1.832
187 HB3 ARG 26 1HB ARG 26 7.808 8.092 -2.031
188 HG2 ARG 26 2HG ARG 26 8.333 9.714 -0.346
189 HG3 ARG 26 1HG ARG 26 9.967 9.047 -0.185
190 HD2 ARG 26 2HD ARG 26 9.901 11.040 -1.650
191 HD3 ARG 26 1HD ARG 26 10.425 9.591 -2.512
192 HH11 ARG 26 1HH1 ARG 26 10.749 10.729 -4.156
193 HH12 ARG 26 2HH1 ARG 26 10.126 10.894 -5.736
194 HH21 ARG 26 1HH2 ARG 26 6.741 10.409 -4.770
195 HH22 ARG 26 2HH2 ARG 26 7.777 10.740 -6.093
196 H GLU 27 H GLU 27 8.392 8.679 1.595
197 HA GLU 27 HA GLU 27 5.882 8.785 2.849
198 HB2 GLU 27 2HB GLU 27 7.660 9.603 4.067
199 HB3 GLU 27 1HB GLU 27 8.329 10.511 2.743
200 HG2 GLU 27 2HG GLU 27 7.534 12.083 4.317
201 HG3 GLU 27 1HG GLU 27 6.383 12.081 2.992
202 H GLY 28 H GLY 28 4.040 9.631 2.143
203 HA2 GLY 28 2HA GLY 28 2.701 11.406 1.359
204 HA3 GLY 28 1HA GLY 28 4.100 12.065 0.536
205 H GLU 29 H GLU 29 3.639 8.730 -0.048
206 HA GLU 29 HA GLU 29 2.741 9.436 -2.723
207 HB2 GLU 29 2HB GLU 29 3.616 6.743 -1.661
208 HB3 GLU 29 1HB GLU 29 3.295 7.130 -3.340
209 HG2 GLU 29 2HG GLU 29 5.563 8.096 -1.617
210 HG3 GLU 29 1HG GLU 29 5.649 7.049 -3.027
211 H ILE 30 H ILE 30 0.874 8.628 -3.606
212 HA ILE 30 HA ILE 30 -1.050 7.641 -1.660
213 HB ILE 30 HB ILE 30 -1.477 8.888 -4.395
214 HG12 ILE 30 2HG1 ILE 30 -0.852 10.499 -2.656
215 HG13 ILE 30 1HG1 ILE 30 -2.517 10.733 -3.168
216 HG21 ILE 30 1HG2 ILE 30 -3.170 7.176 -3.993
217 HG22 ILE 30 2HG2 ILE 30 -3.880 8.788 -3.935
218 HG23 ILE 30 3HG2 ILE 30 -3.556 7.915 -2.438
219 HD11 ILE 30 3HD1 ILE 30 -1.593 9.393 -0.627
220 HD12 ILE 30 1HD1 ILE 30 -3.275 9.561 -1.139
221 HD13 ILE 30 2HD1 ILE 30 -2.316 10.994 -0.778
222 H ILE 31 H ILE 31 -1.634 5.684 -1.713
223 HA ILE 31 HA ILE 31 -0.739 3.946 -3.903
224 HB ILE 31 HB ILE 31 -1.616 3.214 -1.107
225 HG12 ILE 31 2HG1 ILE 31 1.216 3.461 -2.135
226 HG13 ILE 31 1HG1 ILE 31 0.436 4.605 -1.046
227 HG21 ILE 31 1HG2 ILE 31 -0.513 1.081 -1.589
228 HG22 ILE 31 2HG2 ILE 31 -0.151 1.643 -3.221
229 HG23 ILE 31 3HG2 ILE 31 -1.824 1.417 -2.719
230 HD11 ILE 31 3HD1 ILE 31 1.938 2.987 0.065
231 HD12 ILE 31 1HD1 ILE 31 0.863 1.695 -0.437
232 HD13 ILE 31 2HD1 ILE 31 0.281 2.939 0.680
233 H HIS 32 H HIS 32 -2.362 2.939 -5.066
234 HA HIS 32 HA HIS 32 -5.060 3.273 -4.074
235 HD1 HIS 32 1HD HIS 32 -6.143 1.063 -8.122
236 HD2 HIS 32 2HD HIS 32 -7.344 3.173 -4.742
237 HE1 HIS 32 1HE HIS 32 -8.627 0.773 -7.950
238 HB2 HIS 32 2HB HIS 32 -4.616 3.587 -6.548
239 HB3 HIS 32 1HB HIS 32 -4.155 1.887 -6.633
240 H LEU 33 H LEU 33 -5.874 1.830 -2.824
241 HA LEU 33 HA LEU 33 -4.340 -0.438 -2.077
242 HG LEU 33 HG LEU 33 -5.094 -1.244 0.282
243 HB2 LEU 33 2HB LEU 33 -5.631 1.092 -0.555
244 HB3 LEU 33 1HB LEU 33 -7.101 0.440 -1.225
245 HD11 LEU 33 1HD1 LEU 33 -5.905 0.581 1.682
246 HD12 LEU 33 2HD1 LEU 33 -6.586 -0.964 2.190
247 HD13 LEU 33 3HD1 LEU 33 -7.568 0.172 1.260
248 HD21 LEU 33 3HD2 LEU 33 -6.876 -2.802 0.490
249 HD22 LEU 33 1HD2 LEU 33 -6.754 -2.381 -1.206
250 HD23 LEU 33 2HD2 LEU 33 -8.045 -1.679 -0.220
251 H ILE 34 H ILE 34 -4.452 -2.309 -2.982
252 HA ILE 34 HA ILE 34 -6.529 -2.873 -4.929
253 HB ILE 34 HB ILE 34 -3.910 -4.262 -4.324
254 HG12 ILE 34 2HG1 ILE 34 -3.566 -2.071 -5.337
255 HG13 ILE 34 1HG1 ILE 34 -3.152 -3.340 -6.484
256 HG21 ILE 34 1HG2 ILE 34 -5.857 -4.815 -6.548
257 HG22 ILE 34 2HG2 ILE 34 -5.480 -5.877 -5.190
258 HG23 ILE 34 3HG2 ILE 34 -4.241 -5.504 -6.396
259 HD11 ILE 34 3HD1 ILE 34 -4.321 -1.535 -7.590
260 HD12 ILE 34 1HD1 ILE 34 -5.679 -1.685 -6.476
261 HD13 ILE 34 2HD1 ILE 34 -5.320 -2.987 -7.606
262 H SER 35 H SER 35 -5.138 -4.202 -1.943
263 HA SER 35 HA SER 35 -7.622 -5.496 -1.405
264 HG SER 35 HG SER 35 -6.532 -8.904 -1.345
265 HB2 SER 35 2HB SER 35 -6.574 -7.123 -2.961
266 HB3 SER 35 1HB SER 35 -5.205 -7.257 -1.862
267 H LYS 36 H LYS 36 -7.873 -5.978 0.714
268 HA LYS 36 HA LYS 36 -5.688 -5.336 2.555
269 HB2 LYS 36 2HB LYS 36 -8.691 -5.564 2.906
270 HB3 LYS 36 1HB LYS 36 -7.588 -5.449 4.270
271 HG2 LYS 36 2HG LYS 36 -6.887 -3.275 3.621
272 HG3 LYS 36 1HG LYS 36 -7.736 -3.361 2.097
273 HD2 LYS 36 2HD LYS 36 -9.874 -3.439 3.315
274 HD3 LYS 36 1HD LYS 36 -8.986 -3.314 4.839
275 HE2 LYS 36 2HE LYS 36 -8.100 -1.169 4.203
276 HE3 LYS 36 1HE LYS 36 -8.815 -1.308 2.604
277 HZ1 LYS 36 3HZ LYS 36 -10.958 -1.111 3.511
278 HZ2 LYS 36 1HZ LYS 36 -10.009 0.136 4.082
279 HZ3 LYS 36 2HZ LYS 36 -10.390 -1.148 5.121
280 H GLU 37 H GLU 37 -6.701 -7.835 0.889
281 HA GLU 37 HA GLU 37 -6.337 -9.781 3.047
282 HB2 GLU 37 2HB GLU 37 -8.633 -9.711 1.991
283 HB3 GLU 37 1HB GLU 37 -7.862 -10.131 0.471
284 HG2 GLU 37 2HG GLU 37 -8.796 -12.105 1.410
285 HG3 GLU 37 1HG GLU 37 -7.042 -12.213 1.516
286 H THR 38 H THR 38 -4.176 -10.149 2.773
287 HA THR 38 HA THR 38 -3.336 -11.058 0.097
288 HB THR 38 HB THR 38 -1.007 -10.603 0.895
289 HG1 THR 38 1HG THR 38 -1.838 -8.966 2.975
290 HG21 THR 38 3HG2 THR 38 -2.874 -8.229 1.066
291 HG22 THR 38 1HG2 THR 38 -2.198 -8.890 -0.422
292 HG23 THR 38 2HG2 THR 38 -1.137 -8.142 0.773
293 H GLY 39 H GLY 39 -4.616 -12.231 2.680
294 HA2 GLY 39 2HA GLY 39 -4.577 -14.493 3.351
295 HA3 GLY 39 1HA GLY 39 -2.865 -14.568 2.914
296 H GLU 40 H GLU 40 -2.729 -11.784 4.112
297 HA GLU 40 HA GLU 40 -2.509 -12.583 6.922
298 HB2 GLU 40 2HB GLU 40 -0.754 -10.741 5.317
299 HB3 GLU 40 1HB GLU 40 -0.639 -10.971 7.045
300 HG2 GLU 40 2HG GLU 40 -0.104 -13.348 6.649
301 HG3 GLU 40 1HG GLU 40 -0.130 -13.024 4.913
302 H ALA 41 H ALA 41 -3.001 -11.003 8.423
303 HA ALA 41 HA ALA 41 -4.458 -8.682 7.406
304 HB1 ALA 41 1HB ALA 41 -5.726 -10.080 8.979
305 HB2 ALA 41 2HB ALA 41 -5.369 -8.512 9.709
306 HB3 ALA 41 3HB ALA 41 -4.430 -9.933 10.166
307 H GLY 42 H GLY 42 -2.962 -7.200 7.049
308 HA2 GLY 42 2HA GLY 42 -1.737 -5.536 8.692
309 HA3 GLY 42 1HA GLY 42 -0.674 -6.936 8.829
310 H TRP 43 H TRP 43 -0.888 -7.887 6.281
311 HA TRP 43 HA TRP 43 0.623 -5.877 4.824
312 HD1 TRP 43 HD TRP 43 1.600 -9.013 6.911
313 HE1 TRP 43 1HE TRP 43 4.118 -8.834 7.455
314 HE3 TRP 43 3HE TRP 43 3.214 -6.752 2.624
315 HZ2 TRP 43 2HZ TRP 43 6.455 -7.874 6.236
316 HZ3 TRP 43 3HZ TRP 43 5.598 -6.239 2.393
317 HH2 TRP 43 HH TRP 43 7.186 -6.788 4.159
318 HB2 TRP 43 2HB TRP 43 0.329 -8.857 4.472
319 HB3 TRP 43 1HB TRP 43 1.096 -7.836 3.261
320 H TRP 44 H TRP 44 -0.318 -4.738 3.384
321 HA TRP 44 HA TRP 44 -2.795 -5.701 2.154
322 HD1 TRP 44 HD TRP 44 -3.694 -5.622 4.216
323 HE1 TRP 44 1HE TRP 44 -5.317 -4.733 5.975
324 HE3 TRP 44 3HE TRP 44 -3.501 -0.649 3.052
325 HZ2 TRP 44 2HZ TRP 44 -6.386 -2.256 6.784
326 HZ3 TRP 44 3HZ TRP 44 -4.872 0.914 4.373
327 HH2 TRP 44 HH TRP 44 -6.287 0.114 6.190
328 HB2 TRP 44 2HB TRP 44 -1.780 -2.905 2.682
329 HB3 TRP 44 1HB TRP 44 -3.117 -3.240 1.593
330 H LYS 45 H LYS 45 -3.064 -5.106 -0.072
331 HA LYS 45 HA LYS 45 -0.487 -5.013 -1.476
332 HB2 LYS 45 2HB LYS 45 -1.932 -7.048 -1.896
333 HB3 LYS 45 1HB LYS 45 -3.170 -5.978 -2.535
334 HG2 LYS 45 2HG LYS 45 -1.587 -5.241 -4.283
335 HG3 LYS 45 1HG LYS 45 -0.411 -6.401 -3.671
336 HD2 LYS 45 2HD LYS 45 -2.020 -8.221 -4.131
337 HD3 LYS 45 1HD LYS 45 -3.134 -7.035 -4.815
338 HE2 LYS 45 2HE LYS 45 -1.381 -6.405 -6.451
339 HE3 LYS 45 1HE LYS 45 -0.365 -7.695 -5.815
340 HZ1 LYS 45 3HZ LYS 45 -2.161 -9.277 -6.491
341 HZ2 LYS 45 1HZ LYS 45 -1.468 -8.419 -7.775
342 HZ3 LYS 45 2HZ LYS 45 -2.967 -7.970 -7.207
343 H GLY 46 H GLY 46 -0.120 -3.294 -2.706
344 HA2 GLY 46 2HA GLY 46 -2.354 -1.530 -3.357
345 HA3 GLY 46 1HA GLY 46 -0.971 -0.870 -2.493
346 H GLU 47 H GLU 47 -1.803 0.031 -4.969
347 HA GLU 47 HA GLU 47 0.404 -0.885 -6.647
348 HB2 GLU 47 2HB GLU 47 -1.800 -1.698 -7.420
349 HB3 GLU 47 1HB GLU 47 -2.366 -0.048 -7.504
350 HG2 GLU 47 2HG GLU 47 0.019 -0.763 -9.112
351 HG3 GLU 47 1HG GLU 47 -1.549 -1.384 -9.628
352 H LEU 48 H LEU 48 1.674 0.575 -7.483
353 HA LEU 48 HA LEU 48 0.965 3.404 -7.461
354 HG LEU 48 HG LEU 48 3.965 4.372 -7.530
355 HB2 LEU 48 2HB LEU 48 2.246 3.072 -5.428
356 HB3 LEU 48 1HB LEU 48 3.504 2.220 -6.309
357 HD11 LEU 48 1HD1 LEU 48 1.842 5.475 -7.201
358 HD12 LEU 48 2HD1 LEU 48 3.154 6.454 -6.547
359 HD13 LEU 48 3HD1 LEU 48 2.117 5.532 -5.460
360 HD21 LEU 48 3HD2 LEU 48 4.258 4.498 -4.532
361 HD22 LEU 48 1HD2 LEU 48 5.221 5.383 -5.706
362 HD23 LEU 48 2HD2 LEU 48 5.340 3.624 -5.613
363 H ASN 49 H ASN 49 1.248 4.102 -9.445
364 HA ASN 49 HA ASN 49 2.165 4.630 -11.467
365 HB2 ASN 49 2HB ASN 49 4.609 3.135 -10.497
366 HB3 ASN 49 1HB ASN 49 4.540 4.105 -11.955
367 HD21 ASN 49 1HD2 ASN 49 2.917 6.226 -10.670
368 HD22 ASN 49 2HD2 ASN 49 4.008 7.031 -9.627
369 H GLY 50 H GLY 50 0.976 1.822 -10.759
370 HA2 GLY 50 2HA GLY 50 0.146 0.416 -12.467
371 HA3 GLY 50 1HA GLY 50 1.626 0.691 -13.382
372 H LYS 51 H LYS 51 2.761 0.403 -10.402
373 HA LYS 51 HA LYS 51 3.182 -2.461 -10.745
374 HB2 LYS 51 2HB LYS 51 4.834 -0.408 -9.258
375 HB3 LYS 51 1HB LYS 51 5.137 -2.133 -9.205
376 HG2 LYS 51 2HG LYS 51 6.672 -1.272 -10.719
377 HG3 LYS 51 1HG LYS 51 5.442 -2.046 -11.696
378 HD2 LYS 51 2HD LYS 51 4.379 0.127 -12.123
379 HD3 LYS 51 1HD LYS 51 5.632 0.925 -11.174
380 HE2 LYS 51 2HE LYS 51 6.060 1.099 -13.575
381 HE3 LYS 51 1HE LYS 51 7.319 0.191 -12.745
382 HZ1 LYS 51 3HZ LYS 51 6.573 -0.768 -14.877
383 HZ2 LYS 51 1HZ LYS 51 5.069 -1.108 -14.216
384 HZ3 LYS 51 2HZ LYS 51 6.480 -1.842 -13.616
385 H GLU 52 H GLU 52 2.578 -3.791 -9.246
386 HA GLU 52 HA GLU 52 1.384 -2.621 -6.849
387 HB2 GLU 52 2HB GLU 52 -0.377 -4.386 -6.928
388 HB3 GLU 52 1HB GLU 52 -0.493 -3.197 -8.206
389 HG2 GLU 52 2HG GLU 52 0.737 -4.859 -9.657
390 HG3 GLU 52 1HG GLU 52 0.439 -6.038 -8.380
391 H GLY 53 H GLY 53 1.735 -3.501 -4.993
392 HA2 GLY 53 2HA GLY 53 2.935 -6.106 -4.836
393 HA3 GLY 53 1HA GLY 53 3.983 -4.772 -4.373
394 H VAL 54 H VAL 54 3.927 -5.904 -2.349
395 HA VAL 54 HA VAL 54 1.510 -5.261 -0.810
396 HB VAL 54 HB VAL 54 2.123 -7.088 0.778
397 HG11 VAL 54 1HG1 VAL 54 1.366 -8.944 -0.647
398 HG12 VAL 54 2HG1 VAL 54 1.637 -7.935 -2.070
399 HG13 VAL 54 3HG1 VAL 54 0.418 -7.477 -0.885
400 HG21 VAL 54 3HG2 VAL 54 4.511 -7.263 0.257
401 HG22 VAL 54 1HG2 VAL 54 4.118 -7.857 -1.357
402 HG23 VAL 54 2HG2 VAL 54 3.705 -8.823 0.064
403 H PHE 55 H PHE 55 1.744 -4.638 1.336
404 HA PHE 55 HA PHE 55 4.322 -3.831 2.318
405 HD1 PHE 55 1HD PHE 55 1.475 -2.288 -0.347
406 HD2 PHE 55 2HD PHE 55 1.857 -0.559 3.522
407 HE1 PHE 55 1HE PHE 55 -0.794 -1.366 -0.532
408 HE2 PHE 55 2HE PHE 55 -0.416 0.357 3.337
409 HZ PHE 55 HZ PHE 55 -1.741 -0.045 1.305
410 HB2 PHE 55 2HB PHE 55 3.812 -1.433 2.375
411 HB3 PHE 55 1HB PHE 55 3.665 -2.060 0.731
412 HA PRO 56 HA PRO 56 1.765 -4.349 6.008
413 HB2 PRO 56 2HB PRO 56 3.624 -2.719 7.556
414 HB3 PRO 56 1HB PRO 56 3.345 -4.457 7.653
415 HG2 PRO 56 2HG PRO 56 5.655 -3.387 6.697
416 HG3 PRO 56 1HG PRO 56 5.014 -4.949 6.158
417 HD2 PRO 56 2HD PRO 56 4.861 -2.273 4.827
418 HD3 PRO 56 1HD PRO 56 5.166 -3.878 4.121
419 H ASP 57 H ASP 57 0.099 -3.171 6.817
420 HA ASP 57 HA ASP 57 -0.411 -0.579 5.767
421 HB2 ASP 57 2HB ASP 57 -2.534 -0.634 6.770
422 HB3 ASP 57 1HB ASP 57 -2.168 -2.339 6.581
423 H ASN 58 H ASN 58 1.278 -1.573 8.548
424 HA ASN 58 HA ASN 58 1.126 0.426 10.349
425 HB2 ASN 58 2HB ASN 58 2.437 -1.722 10.320
426 HB3 ASN 58 1HB ASN 58 3.645 -0.867 9.370
427 HD21 ASN 58 1HD2 ASN 58 2.108 -1.202 12.370
428 HD22 ASN 58 2HD2 ASN 58 3.231 -0.284 13.287
429 H PHE 59 H PHE 59 2.582 0.479 7.166
430 HA PHE 59 HA PHE 59 4.041 2.937 7.705
431 HD1 PHE 59 1HD PHE 59 4.490 -0.675 7.150
432 HD2 PHE 59 2HD PHE 59 7.116 2.544 6.253
433 HE1 PHE 59 1HE PHE 59 6.348 -1.894 8.207
434 HE2 PHE 59 2HE PHE 59 8.968 1.338 7.309
435 HZ PHE 59 HZ PHE 59 8.590 -0.882 8.287
436 HB2 PHE 59 2HB PHE 59 4.024 1.085 5.319
437 HB3 PHE 59 1HB PHE 59 4.953 2.576 5.388
438 H ALA 60 H ALA 60 0.890 2.331 6.846
439 HA ALA 60 HA ALA 60 0.756 4.784 5.282
440 HB1 ALA 60 1HB ALA 60 0.992 2.978 3.635
441 HB2 ALA 60 2HB ALA 60 -0.561 3.806 3.515
442 HB3 ALA 60 3HB ALA 60 -0.467 2.222 4.283
443 H VAL 61 H VAL 61 -1.188 5.806 5.289
444 HA VAL 61 HA VAL 61 -3.212 4.728 7.121
445 HB VAL 61 HB VAL 61 -2.056 6.719 8.053
446 HG11 VAL 61 1HG1 VAL 61 -2.357 8.944 7.069
447 HG12 VAL 61 2HG1 VAL 61 -3.119 8.205 5.662
448 HG13 VAL 61 3HG1 VAL 61 -1.425 7.869 6.025
449 HG21 VAL 61 3HG2 VAL 61 -4.909 7.268 7.282
450 HG22 VAL 61 1HG2 VAL 61 -4.036 8.061 8.589
451 HG23 VAL 61 2HG2 VAL 61 -4.376 6.330 8.675
452 H GLN 62 H GLN 62 -5.284 4.627 6.334
453 HA GLN 62 HA GLN 62 -5.537 5.017 3.504
454 HB2 GLN 62 2HB GLN 62 -6.545 3.056 4.749
455 HB3 GLN 62 1HB GLN 62 -7.718 4.183 5.413
456 HG2 GLN 62 2HG GLN 62 -8.552 4.696 3.216
457 HG3 GLN 62 1HG GLN 62 -7.310 3.698 2.474
458 HE21 GLN 62 1HE2 GLN 62 -10.167 3.513 2.210
459 HE22 GLN 62 2HE2 GLN 62 -10.560 1.903 2.664
460 H ILE 63 H ILE 63 -6.444 6.630 2.480
461 HA ILE 63 HA ILE 63 -7.145 9.005 3.970
462 HB ILE 63 HB ILE 63 -7.105 8.490 0.982
463 HG12 ILE 63 2HG1 ILE 63 -4.890 8.144 1.917
464 HG13 ILE 63 1HG1 ILE 63 -4.915 9.623 0.967
465 HG21 ILE 63 1HG2 ILE 63 -8.475 10.397 1.525
466 HG22 ILE 63 2HG2 ILE 63 -6.986 10.930 0.745
467 HG23 ILE 63 3HG2 ILE 63 -7.177 11.096 2.491
468 HD11 ILE 63 3HD1 ILE 63 -5.083 10.925 3.056
469 HD12 ILE 63 1HD1 ILE 63 -3.622 9.938 2.997
470 HD13 ILE 63 2HD1 ILE 63 -4.993 9.425 3.977
471 H SER 64 H SER 64 -8.661 7.086 1.364
472 HA SER 64 HA SER 64 -11.188 7.192 2.643
473 HG SER 64 HG SER 64 -10.744 9.472 2.149
474 HB2 SER 64 2HB SER 64 -10.645 8.153 -0.178
475 HB3 SER 64 1HB SER 64 -12.225 7.949 0.572
Start of MODEL 13
1 H1 GLY 1 1HT GLY 1 -11.612 -7.775 3.929
2 H2 GLY 1 2HT GLY 1 -10.038 -8.226 3.643
3 H3 GLY 1 3HT GLY 1 -11.261 -9.383 3.603
4 HA2 GLY 1 1HA GLY 1 -10.573 -8.792 1.355
5 HA3 GLY 1 2HA GLY 1 -12.244 -8.322 1.672
6 H ALA 2 H ALA 2 -12.770 -6.329 1.081
7 HA ALA 2 HA ALA 2 -11.420 -4.036 1.828
8 HB1 ALA 2 1HB ALA 2 -9.856 -4.493 0.041
9 HB2 ALA 2 2HB ALA 2 -10.890 -3.158 -0.476
10 HB3 ALA 2 3HB ALA 2 -11.163 -4.788 -1.114
11 H MET 3 H MET 3 -12.726 -2.117 0.948
12 HA MET 3 HA MET 3 -15.428 -3.099 0.371
13 HB2 MET 3 2HB MET 3 -16.417 -1.683 2.120
14 HB3 MET 3 1HB MET 3 -15.357 -2.915 2.777
15 HG2 MET 3 2HG MET 3 -13.586 -1.165 2.982
16 HG3 MET 3 1HG MET 3 -14.790 0.021 2.491
17 HE1 MET 3 3HE MET 3 -14.316 0.605 6.380
18 HE2 MET 3 1HE MET 3 -14.263 1.378 4.796
19 HE3 MET 3 2HE MET 3 -13.093 0.123 5.207
20 H GLY 4 H GLY 4 -13.195 -1.427 -0.881
21 HA2 GLY 4 2HA GLY 4 -15.121 0.248 -2.208
22 HA3 GLY 4 1HA GLY 4 -13.761 1.065 -1.442
23 H ALA 5 H ALA 5 -14.636 0.531 -4.282
24 HA ALA 5 HA ALA 5 -12.444 -0.926 -5.400
25 HB1 ALA 5 1HB ALA 5 -14.576 -0.727 -6.613
26 HB2 ALA 5 2HB ALA 5 -13.258 -0.028 -7.555
27 HB3 ALA 5 3HB ALA 5 -14.373 1.022 -6.681
28 H LYS 6 H LYS 6 -13.242 2.318 -4.580
29 HA LYS 6 HA LYS 6 -10.579 3.165 -5.409
30 HB2 LYS 6 2HB LYS 6 -13.037 4.879 -4.979
31 HB3 LYS 6 1HB LYS 6 -11.443 5.469 -5.419
32 HG2 LYS 6 2HG LYS 6 -11.568 4.278 -7.545
33 HG3 LYS 6 1HG LYS 6 -13.143 3.627 -7.094
34 HD2 LYS 6 2HD LYS 6 -13.435 5.515 -8.594
35 HD3 LYS 6 1HD LYS 6 -14.033 5.935 -6.990
36 HE2 LYS 6 2HE LYS 6 -11.948 7.139 -6.535
37 HE3 LYS 6 1HE LYS 6 -11.345 6.703 -8.131
38 HZ1 LYS 6 3HZ LYS 6 -13.693 8.415 -7.547
39 HZ2 LYS 6 1HZ LYS 6 -13.202 7.931 -9.086
40 HZ3 LYS 6 2HZ LYS 6 -12.210 8.911 -8.170
41 H GLU 7 H GLU 7 -9.885 2.123 -3.416
42 HA GLU 7 HA GLU 7 -10.220 3.937 -1.157
43 HB2 GLU 7 2HB GLU 7 -9.201 1.052 -1.188
44 HB3 GLU 7 1HB GLU 7 -9.181 2.079 0.237
45 HG2 GLU 7 2HG GLU 7 -11.700 2.218 0.031
46 HG3 GLU 7 1HG GLU 7 -11.585 1.001 -1.231
47 H TYR 8 H TYR 8 -8.526 5.269 -0.738
48 HA TYR 8 HA TYR 8 -6.004 4.625 -2.117
49 HD1 TYR 8 1HD TYR 8 -9.157 7.188 -2.183
50 HD2 TYR 8 2HD TYR 8 -5.639 6.944 -4.537
51 HE1 TYR 8 1HE TYR 8 -10.456 7.825 -4.165
52 HE2 TYR 8 2HE TYR 8 -6.926 7.570 -6.538
53 HH TYR 8 HH TYR 8 -9.158 7.620 -7.320
54 HB2 TYR 8 2HB TYR 8 -6.812 7.380 -1.196
55 HB3 TYR 8 1HB TYR 8 -5.474 6.930 -2.198
56 H CYS 9 H CYS 9 -4.216 4.649 -0.912
57 HA CYS 9 HA CYS 9 -4.540 5.391 1.881
58 HG CYS 9 HG CYS 9 -3.215 2.969 -0.895
59 HB2 CYS 9 2HB CYS 9 -2.889 3.530 2.394
60 HB3 CYS 9 1HB CYS 9 -4.500 3.028 1.895
61 H ARG 10 H ARG 10 -3.030 6.650 2.721
62 HA ARG 10 HA ARG 10 -0.957 7.644 0.887
63 HE ARG 10 HE ARG 10 -1.870 11.937 1.389
64 HB2 ARG 10 2HB ARG 10 -2.483 9.338 1.818
65 HB3 ARG 10 1HB ARG 10 -2.044 8.837 3.445
66 HG2 ARG 10 2HG ARG 10 0.299 9.507 2.967
67 HG3 ARG 10 1HG ARG 10 -0.237 10.133 1.410
68 HD2 ARG 10 2HD ARG 10 -1.290 11.011 4.081
69 HD3 ARG 10 1HD ARG 10 -0.058 11.882 3.169
70 HH11 ARG 10 1HH1 ARG 10 -2.390 12.236 4.883
71 HH12 ARG 10 2HH1 ARG 10 -3.829 13.120 4.762
72 HH21 ARG 10 1HH2 ARG 10 -3.819 13.263 1.201
73 HH22 ARG 10 2HH2 ARG 10 -4.638 13.771 2.599
74 H THR 11 H THR 11 1.146 7.400 1.371
75 HA THR 11 HA THR 11 1.759 5.607 3.508
76 HB THR 11 HB THR 11 4.054 5.646 2.579
77 HG1 THR 11 1HG THR 11 4.528 6.935 0.877
78 HG21 THR 11 3HG2 THR 11 2.372 4.142 1.645
79 HG22 THR 11 1HG2 THR 11 3.482 4.705 0.396
80 HG23 THR 11 2HG2 THR 11 1.868 5.402 0.519
81 H LEU 12 H LEU 12 2.577 6.059 5.408
82 HA LEU 12 HA LEU 12 2.995 8.868 6.146
83 HG LEU 12 HG LEU 12 0.606 6.742 6.812
84 HB2 LEU 12 2HB LEU 12 2.772 6.411 7.881
85 HB3 LEU 12 1HB LEU 12 2.776 8.071 8.429
86 HD11 LEU 12 1HD1 LEU 12 -0.720 7.026 8.860
87 HD12 LEU 12 2HD1 LEU 12 0.714 7.630 9.689
88 HD13 LEU 12 3HD1 LEU 12 0.672 5.970 9.098
89 HD21 LEU 12 3HD2 LEU 12 0.767 9.536 7.947
90 HD22 LEU 12 1HD2 LEU 12 -0.650 8.817 7.188
91 HD23 LEU 12 2HD2 LEU 12 0.801 9.106 6.235
92 H PHE 13 H PHE 13 4.650 5.997 5.449
93 HA PHE 13 HA PHE 13 7.199 7.097 6.357
94 HD1 PHE 13 1HD PHE 13 8.258 6.284 9.148
95 HD2 PHE 13 2HD PHE 13 4.387 4.743 8.330
96 HE1 PHE 13 1HE PHE 13 7.558 6.838 11.434
97 HE2 PHE 13 2HE PHE 13 3.678 5.298 10.610
98 HZ PHE 13 HZ PHE 13 5.270 6.345 12.169
99 HB2 PHE 13 2HB PHE 13 6.222 4.271 6.899
100 HB3 PHE 13 1HB PHE 13 7.850 4.846 7.218
101 HA PRO 14 HA PRO 14 8.170 5.208 2.412
102 HB2 PRO 14 2HB PRO 14 10.870 5.238 2.524
103 HB3 PRO 14 1HB PRO 14 9.933 6.714 2.285
104 HG2 PRO 14 2HG PRO 14 11.288 5.709 4.738
105 HG3 PRO 14 1HG PRO 14 11.068 7.373 4.177
106 HD2 PRO 14 2HD PRO 14 9.546 6.102 6.134
107 HD3 PRO 14 1HD PRO 14 9.077 7.575 5.261
108 H TYR 15 H TYR 15 8.624 3.121 1.698
109 HA TYR 15 HA TYR 15 9.622 1.282 3.746
110 HD1 TYR 15 2HD TYR 15 8.626 -0.514 5.150
111 HD2 TYR 15 1HD TYR 15 7.289 -1.507 1.241
112 HE1 TYR 15 2HE TYR 15 8.887 -2.878 5.680
113 HE2 TYR 15 1HE TYR 15 7.551 -3.905 1.762
114 HH TYR 15 HH TYR 15 8.766 -5.328 3.307
115 HB2 TYR 15 2HB TYR 15 7.178 1.066 3.639
116 HB3 TYR 15 1HB TYR 15 7.284 0.730 1.917
117 H THR 16 H THR 16 11.120 -0.029 3.112
118 HA THR 16 HA THR 16 11.849 -0.041 0.307
119 HB THR 16 HB THR 16 13.398 -0.908 2.763
120 HG1 THR 16 1HG THR 16 13.051 1.326 2.765
121 HG21 THR 16 3HG2 THR 16 14.156 -2.006 0.707
122 HG22 THR 16 1HG2 THR 16 15.346 -0.818 1.243
123 HG23 THR 16 2HG2 THR 16 14.258 -0.441 -0.098
124 H GLY 17 H GLY 17 10.998 -1.771 -0.787
125 HA2 GLY 17 2HA GLY 17 10.266 -4.166 0.592
126 HA3 GLY 17 1HA GLY 17 10.189 -3.863 -1.148
127 H THR 18 H THR 18 11.276 -6.194 0.353
128 HA THR 18 HA THR 18 14.117 -5.925 -0.173
129 HB THR 18 HB THR 18 14.116 -8.308 0.873
130 HG1 THR 18 1HG THR 18 11.479 -7.936 0.855
131 HG21 THR 18 3HG2 THR 18 13.341 -5.923 2.544
132 HG22 THR 18 1HG2 THR 18 14.977 -6.340 2.037
133 HG23 THR 18 2HG2 THR 18 14.109 -7.390 3.158
134 H ASN 19 H ASN 19 11.247 -7.558 -1.092
135 HA ASN 19 HA ASN 19 12.612 -8.847 -3.322
136 HB2 ASN 19 2HB ASN 19 9.826 -9.248 -2.227
137 HB3 ASN 19 1HB ASN 19 10.565 -10.162 -3.524
138 HD21 ASN 19 1HD2 ASN 19 10.185 -9.752 -0.211
139 HD22 ASN 19 2HD2 ASN 19 11.139 -11.098 0.327
140 H GLU 20 H GLU 20 10.875 -8.943 -5.200
141 HA GLU 20 HA GLU 20 10.045 -6.200 -5.694
142 HB2 GLU 20 2HB GLU 20 9.701 -6.952 -8.017
143 HB3 GLU 20 1HB GLU 20 11.332 -7.277 -7.450
144 HG2 GLU 20 2HG GLU 20 10.726 -9.626 -7.098
145 HG3 GLU 20 1HG GLU 20 9.096 -9.274 -7.666
146 H ASP 21 H ASP 21 8.786 -8.519 -4.054
147 HA ASP 21 HA ASP 21 6.108 -8.561 -5.194
148 HB2 ASP 21 2HB ASP 21 7.009 -10.676 -4.314
149 HB3 ASP 21 1HB ASP 21 7.234 -9.925 -2.736
150 H GLU 22 H GLU 22 7.992 -7.346 -2.550
151 HA GLU 22 HA GLU 22 5.819 -5.974 -1.341
152 HB2 GLU 22 2HB GLU 22 8.786 -5.541 -1.140
153 HB3 GLU 22 1HB GLU 22 7.595 -4.668 -0.193
154 HG2 GLU 22 2HG GLU 22 8.303 -6.240 1.276
155 HG3 GLU 22 1HG GLU 22 6.932 -7.082 0.539
156 H LEU 23 H LEU 23 5.611 -3.717 -1.351
157 HA LEU 23 HA LEU 23 6.358 -2.562 -3.944
158 HG LEU 23 HG LEU 23 4.273 -1.428 -5.043
159 HB2 LEU 23 2HB LEU 23 3.927 -2.752 -3.021
160 HB3 LEU 23 1HB LEU 23 4.363 -1.389 -2.015
161 HD11 LEU 23 1HD1 LEU 23 2.476 -0.112 -3.035
162 HD12 LEU 23 2HD1 LEU 23 2.083 -1.501 -4.051
163 HD13 LEU 23 3HD1 LEU 23 2.372 0.076 -4.787
164 HD21 LEU 23 3HD2 LEU 23 5.997 0.121 -4.163
165 HD22 LEU 23 1HD2 LEU 23 4.757 0.929 -3.214
166 HD23 LEU 23 2HD2 LEU 23 4.684 0.959 -4.980
167 H THR 24 H THR 24 8.127 -1.343 -3.826
168 HA THR 24 HA THR 24 8.992 -0.184 -1.326
169 HB THR 24 HB THR 24 10.139 0.034 -4.126
170 HG1 THR 24 1HG THR 24 10.430 -1.992 -3.680
171 HG21 THR 24 3HG2 THR 24 11.374 0.654 -1.433
172 HG22 THR 24 1HG2 THR 24 10.944 1.827 -2.671
173 HG23 THR 24 2HG2 THR 24 12.241 0.670 -2.970
174 H PHE 25 H PHE 25 8.327 1.770 -0.700
175 HA PHE 25 HA PHE 25 7.634 3.697 -2.746
176 HD1 PHE 25 1HD PHE 25 6.173 4.359 1.079
177 HD2 PHE 25 2HD PHE 25 4.757 1.016 -1.128
178 HE1 PHE 25 1HE PHE 25 5.361 3.327 3.156
179 HE2 PHE 25 2HE PHE 25 3.957 -0.015 0.933
180 HZ PHE 25 HZ PHE 25 4.250 1.132 3.082
181 HB2 PHE 25 2HB PHE 25 5.614 4.416 -1.442
182 HB3 PHE 25 1HB PHE 25 5.487 2.879 -2.274
183 H ARG 26 H ARG 26 7.370 5.861 -2.027
184 HA ARG 26 HA ARG 26 9.311 6.606 -0.020
185 HE ARG 26 HE ARG 26 7.474 9.875 -2.874
186 HB2 ARG 26 2HB ARG 26 9.453 7.447 -2.328
187 HB3 ARG 26 1HB ARG 26 7.807 8.041 -2.209
188 HG2 ARG 26 2HG ARG 26 8.495 9.630 -0.574
189 HG3 ARG 26 1HG ARG 26 10.165 9.028 -0.665
190 HD2 ARG 26 2HD ARG 26 9.804 11.075 -2.058
191 HD3 ARG 26 1HD ARG 26 10.308 9.674 -3.004
192 HH11 ARG 26 1HH1 ARG 26 10.219 11.398 -4.509
193 HH12 ARG 26 2HH1 ARG 26 9.334 11.771 -5.904
194 HH21 ARG 26 1HH2 ARG 26 6.305 10.338 -4.712
195 HH22 ARG 26 2HH2 ARG 26 7.024 11.161 -6.041
196 H GLU 27 H GLU 27 8.521 8.583 1.287
197 HA GLU 27 HA GLU 27 5.950 8.035 2.484
198 HB2 GLU 27 2HB GLU 27 7.979 8.653 3.771
199 HB3 GLU 27 1HB GLU 27 7.965 10.221 2.988
200 HG2 GLU 27 2HG GLU 27 5.771 10.673 4.016
201 HG3 GLU 27 1HG GLU 27 5.885 9.127 4.858
202 H GLY 28 H GLY 28 4.111 9.255 2.175
203 HA2 GLY 28 2HA GLY 28 2.880 11.176 1.617
204 HA3 GLY 28 1HA GLY 28 4.309 11.839 0.836
205 H GLU 29 H GLU 29 3.284 8.605 0.190
206 HA GLU 29 HA GLU 29 2.638 9.409 -2.556
207 HB2 GLU 29 2HB GLU 29 3.247 6.681 -1.412
208 HB3 GLU 29 1HB GLU 29 2.985 7.051 -3.107
209 HG2 GLU 29 2HG GLU 29 5.246 8.077 -1.416
210 HG3 GLU 29 1HG GLU 29 5.337 6.738 -2.556
211 H ILE 30 H ILE 30 0.722 8.688 -3.483
212 HA ILE 30 HA ILE 30 -1.286 7.707 -1.606
213 HB ILE 30 HB ILE 30 -1.646 9.075 -4.300
214 HG12 ILE 30 2HG1 ILE 30 -0.919 10.658 -2.554
215 HG13 ILE 30 1HG1 ILE 30 -2.582 10.946 -3.048
216 HG21 ILE 30 1HG2 ILE 30 -3.722 8.182 -2.302
217 HG22 ILE 30 2HG2 ILE 30 -3.409 7.453 -3.876
218 HG23 ILE 30 3HG2 ILE 30 -4.046 9.096 -3.776
219 HD11 ILE 30 3HD1 ILE 30 -2.337 11.185 -0.645
220 HD12 ILE 30 1HD1 ILE 30 -1.698 9.544 -0.529
221 HD13 ILE 30 2HD1 ILE 30 -3.369 9.808 -1.024
222 H ILE 31 H ILE 31 -1.562 5.666 -1.742
223 HA ILE 31 HA ILE 31 -0.832 4.240 -4.199
224 HB ILE 31 HB ILE 31 -1.199 3.194 -1.366
225 HG12 ILE 31 2HG1 ILE 31 1.300 3.560 -3.032
226 HG13 ILE 31 1HG1 ILE 31 0.847 4.499 -1.617
227 HG21 ILE 31 1HG2 ILE 31 -1.850 1.489 -2.969
228 HG22 ILE 31 2HG2 ILE 31 -0.327 1.049 -2.191
229 HG23 ILE 31 3HG2 ILE 31 -0.325 1.687 -3.833
230 HD11 ILE 31 3HD1 ILE 31 1.512 1.561 -1.654
231 HD12 ILE 31 1HD1 ILE 31 1.054 2.493 -0.229
232 HD13 ILE 31 2HD1 ILE 31 2.555 2.861 -1.077
233 H HIS 32 H HIS 32 -2.313 3.019 -5.243
234 HA HIS 32 HA HIS 32 -5.098 3.461 -4.521
235 HD1 HIS 32 1HD HIS 32 -2.932 3.274 -8.738
236 HD2 HIS 32 2HD HIS 32 -5.431 5.539 -6.293
237 HE1 HIS 32 1HE HIS 32 -2.741 5.636 -9.530
238 HB2 HIS 32 2HB HIS 32 -3.961 1.923 -6.884
239 HB3 HIS 32 1HB HIS 32 -5.623 2.448 -6.684
240 H LEU 33 H LEU 33 -5.808 2.129 -3.045
241 HA LEU 33 HA LEU 33 -4.470 -0.263 -2.382
242 HG LEU 33 HG LEU 33 -5.298 -1.095 -0.034
243 HB2 LEU 33 2HB LEU 33 -5.611 1.301 -0.809
244 HB3 LEU 33 1HB LEU 33 -7.140 0.815 -1.483
245 HD11 LEU 33 1HD1 LEU 33 -6.735 -0.702 1.907
246 HD12 LEU 33 2HD1 LEU 33 -7.624 0.522 1.003
247 HD13 LEU 33 3HD1 LEU 33 -5.928 0.782 1.406
248 HD21 LEU 33 3HD2 LEU 33 -7.142 -2.539 0.067
249 HD22 LEU 33 1HD2 LEU 33 -7.141 -1.949 -1.574
250 HD23 LEU 33 2HD2 LEU 33 -8.298 -1.287 -0.405
251 H ILE 34 H ILE 34 -4.732 -2.158 -3.217
252 HA ILE 34 HA ILE 34 -6.957 -2.645 -5.033
253 HB ILE 34 HB ILE 34 -4.305 -4.078 -4.666
254 HG12 ILE 34 2HG1 ILE 34 -5.388 -2.409 -6.953
255 HG13 ILE 34 1HG1 ILE 34 -4.072 -1.978 -5.865
256 HG21 ILE 34 1HG2 ILE 34 -6.523 -4.766 -6.588
257 HG22 ILE 34 2HG2 ILE 34 -5.954 -5.755 -5.234
258 HG23 ILE 34 3HG2 ILE 34 -4.890 -5.428 -6.611
259 HD11 ILE 34 3HD1 ILE 34 -2.699 -3.723 -6.767
260 HD12 ILE 34 1HD1 ILE 34 -3.303 -2.717 -8.081
261 HD13 ILE 34 2HD1 ILE 34 -4.026 -4.294 -7.775
262 H SER 35 H SER 35 -5.267 -4.052 -2.233
263 HA SER 35 HA SER 35 -7.747 -5.320 -1.441
264 HG SER 35 HG SER 35 -7.385 -6.431 -3.434
265 HB2 SER 35 2HB SER 35 -5.204 -6.912 -1.877
266 HB3 SER 35 1HB SER 35 -6.694 -7.527 -1.170
267 H LYS 36 H LYS 36 -7.948 -5.378 0.755
268 HA LYS 36 HA LYS 36 -5.634 -4.654 2.376
269 HB2 LYS 36 2HB LYS 36 -8.611 -4.683 2.836
270 HB3 LYS 36 1HB LYS 36 -7.497 -4.549 4.209
271 HG2 LYS 36 2HG LYS 36 -6.579 -2.516 3.215
272 HG3 LYS 36 1HG LYS 36 -7.665 -2.665 1.861
273 HD2 LYS 36 2HD LYS 36 -8.509 -2.261 4.721
274 HD3 LYS 36 1HD LYS 36 -8.413 -0.997 3.496
275 HE2 LYS 36 2HE LYS 36 -10.024 -2.393 2.135
276 HE3 LYS 36 1HE LYS 36 -10.256 -3.360 3.594
277 HZ1 LYS 36 3HZ LYS 36 -10.822 -1.171 4.707
278 HZ2 LYS 36 1HZ LYS 36 -11.936 -1.767 3.570
279 HZ3 LYS 36 2HZ LYS 36 -10.894 -0.534 3.125
280 H GLU 37 H GLU 37 -6.708 -7.194 1.014
281 HA GLU 37 HA GLU 37 -6.368 -9.051 3.227
282 HB2 GLU 37 2HB GLU 37 -8.640 -9.068 2.375
283 HB3 GLU 37 1HB GLU 37 -8.055 -9.202 0.726
284 HG2 GLU 37 2HG GLU 37 -8.936 -11.309 1.615
285 HG3 GLU 37 1HG GLU 37 -7.238 -11.406 1.149
286 H THR 38 H THR 38 -4.453 -10.014 3.019
287 HA THR 38 HA THR 38 -3.520 -10.792 0.347
288 HB THR 38 HB THR 38 -1.185 -10.424 1.187
289 HG1 THR 38 1HG THR 38 -2.049 -8.626 3.111
290 HG21 THR 38 3HG2 THR 38 -1.187 -7.982 0.886
291 HG22 THR 38 1HG2 THR 38 -2.938 -7.959 1.103
292 HG23 THR 38 2HG2 THR 38 -2.241 -8.777 -0.292
293 H GLY 39 H GLY 39 -4.624 -11.824 3.200
294 HA2 GLY 39 2HA GLY 39 -4.580 -14.089 3.894
295 HA3 GLY 39 1HA GLY 39 -2.973 -14.249 3.189
296 H GLU 40 H GLU 40 -1.824 -11.953 4.218
297 HA GLU 40 HA GLU 40 -1.459 -12.767 6.998
298 HB2 GLU 40 2HB GLU 40 0.224 -11.035 5.189
299 HB3 GLU 40 1HB GLU 40 0.579 -11.334 6.879
300 HG2 GLU 40 2HG GLU 40 0.478 -13.407 4.708
301 HG3 GLU 40 1HG GLU 40 1.931 -12.698 5.411
302 H ALA 41 H ALA 41 -2.556 -11.652 8.430
303 HA ALA 41 HA ALA 41 -3.717 -9.112 7.931
304 HB1 ALA 41 1HB ALA 41 -4.225 -9.139 10.341
305 HB2 ALA 41 2HB ALA 41 -3.218 -10.574 10.524
306 HB3 ALA 41 3HB ALA 41 -4.689 -10.644 9.550
307 H GLY 42 H GLY 42 -2.624 -7.298 7.810
308 HA2 GLY 42 2HA GLY 42 -1.148 -5.793 9.126
309 HA3 GLY 42 1HA GLY 42 -0.026 -7.155 9.173
310 H TRP 43 H TRP 43 -1.094 -7.780 6.374
311 HA TRP 43 HA TRP 43 0.619 -5.843 4.996
312 HD1 TRP 43 HD TRP 43 1.433 -9.279 6.786
313 HE1 TRP 43 1HE TRP 43 3.974 -9.372 7.261
314 HE3 TRP 43 3HE TRP 43 3.133 -6.726 2.696
315 HZ2 TRP 43 2HZ TRP 43 6.356 -8.473 6.063
316 HZ3 TRP 43 3HZ TRP 43 5.552 -6.389 2.437
317 HH2 TRP 43 HH TRP 43 7.127 -7.248 4.084
318 HB2 TRP 43 2HB TRP 43 0.114 -8.763 4.405
319 HB3 TRP 43 1HB TRP 43 0.930 -7.681 3.289
320 H TRP 44 H TRP 44 -0.250 -4.649 3.491
321 HA TRP 44 HA TRP 44 -2.874 -5.350 2.368
322 HD1 TRP 44 HD TRP 44 -3.787 -5.011 4.412
323 HE1 TRP 44 1HE TRP 44 -5.446 -3.792 5.954
324 HE3 TRP 44 3HE TRP 44 -3.115 -0.224 2.731
325 HZ2 TRP 44 2HZ TRP 44 -6.348 -1.167 6.408
326 HZ3 TRP 44 3HZ TRP 44 -4.422 1.578 3.775
327 HH2 TRP 44 HH TRP 44 -6.009 1.110 5.569
328 HB2 TRP 44 2HB TRP 44 -1.525 -2.690 2.807
329 HB3 TRP 44 1HB TRP 44 -2.803 -2.873 1.620
330 H LYS 45 H LYS 45 -3.098 -4.444 0.075
331 HA LYS 45 HA LYS 45 -0.598 -4.730 -1.410
332 HB2 LYS 45 2HB LYS 45 -1.785 -6.917 -1.222
333 HB3 LYS 45 1HB LYS 45 -3.198 -6.186 -1.936
334 HG2 LYS 45 2HG LYS 45 -2.167 -6.083 -4.069
335 HG3 LYS 45 1HG LYS 45 -0.567 -6.424 -3.385
336 HD2 LYS 45 2HD LYS 45 -1.356 -8.621 -2.632
337 HD3 LYS 45 1HD LYS 45 -2.936 -8.292 -3.325
338 HE2 LYS 45 2HE LYS 45 -0.412 -8.351 -4.960
339 HE3 LYS 45 1HE LYS 45 -1.376 -9.789 -4.640
340 HZ1 LYS 45 3HZ LYS 45 -2.082 -7.453 -6.348
341 HZ2 LYS 45 1HZ LYS 45 -3.285 -8.472 -5.657
342 HZ3 LYS 45 2HZ LYS 45 -2.084 -9.090 -6.613
343 H GLY 46 H GLY 46 -0.496 -3.197 -2.969
344 HA2 GLY 46 2HA GLY 46 -2.928 -1.963 -3.953
345 HA3 GLY 46 1HA GLY 46 -1.886 -0.936 -2.982
346 H GLU 47 H GLU 47 -2.337 -0.079 -5.373
347 HA GLU 47 HA GLU 47 -0.126 -0.899 -7.130
348 HB2 GLU 47 2HB GLU 47 -2.467 -0.970 -8.003
349 HB3 GLU 47 1HB GLU 47 -2.577 0.755 -7.712
350 HG2 GLU 47 2HG GLU 47 -0.415 0.805 -9.205
351 HG3 GLU 47 1HG GLU 47 -1.081 -0.732 -9.771
352 H LEU 48 H LEU 48 1.447 0.534 -7.465
353 HA LEU 48 HA LEU 48 0.996 3.378 -7.315
354 HG LEU 48 HG LEU 48 3.859 4.226 -6.482
355 HB2 LEU 48 2HB LEU 48 1.638 2.818 -5.001
356 HB3 LEU 48 1HB LEU 48 3.080 2.027 -5.598
357 HD11 LEU 48 1HD1 LEU 48 2.831 6.269 -5.629
358 HD12 LEU 48 2HD1 LEU 48 1.522 5.312 -4.933
359 HD13 LEU 48 3HD1 LEU 48 1.743 5.369 -6.682
360 HD21 LEU 48 3HD2 LEU 48 3.333 4.068 -3.518
361 HD22 LEU 48 1HD2 LEU 48 4.511 5.124 -4.298
362 HD23 LEU 48 2HD2 LEU 48 4.701 3.376 -4.386
363 H ASN 49 H ASN 49 2.051 4.273 -8.952
364 HA ASN 49 HA ASN 49 3.499 4.704 -10.624
365 HB2 ASN 49 2HB ASN 49 5.382 2.976 -8.998
366 HB3 ASN 49 1HB ASN 49 5.866 3.833 -10.454
367 HD21 ASN 49 1HD2 ASN 49 6.882 4.151 -7.751
368 HD22 ASN 49 2HD2 ASN 49 6.592 5.799 -7.349
369 H GLY 50 H GLY 50 1.772 2.270 -10.609
370 HA2 GLY 50 2HA GLY 50 1.191 1.018 -12.515
371 HA3 GLY 50 1HA GLY 50 2.834 1.202 -13.107
372 H LYS 51 H LYS 51 3.011 0.307 -9.905
373 HA LYS 51 HA LYS 51 3.174 -2.544 -10.633
374 HB2 LYS 51 2HB LYS 51 4.728 -1.107 -8.464
375 HB3 LYS 51 1HB LYS 51 4.826 -2.816 -8.824
376 HG2 LYS 51 2HG LYS 51 6.777 -1.913 -9.705
377 HG3 LYS 51 1HG LYS 51 5.727 -2.064 -11.112
378 HD2 LYS 51 2HD LYS 51 5.158 0.290 -10.967
379 HD3 LYS 51 1HD LYS 51 6.125 0.453 -9.503
380 HE2 LYS 51 2HE LYS 51 8.123 -0.140 -10.747
381 HE3 LYS 51 1HE LYS 51 7.167 -0.340 -12.209
382 HZ1 LYS 51 3HZ LYS 51 7.622 2.193 -10.716
383 HZ2 LYS 51 1HZ LYS 51 6.564 2.031 -12.039
384 HZ3 LYS 51 2HZ LYS 51 8.217 1.773 -12.220
385 H GLU 52 H GLU 52 2.374 -3.989 -9.078
386 HA GLU 52 HA GLU 52 1.096 -2.738 -6.795
387 HB2 GLU 52 2HB GLU 52 -0.557 -4.607 -6.817
388 HB3 GLU 52 1HB GLU 52 -0.786 -3.505 -8.150
389 HG2 GLU 52 2HG GLU 52 0.314 -5.108 -9.635
390 HG3 GLU 52 1HG GLU 52 0.618 -6.172 -8.259
391 H GLY 53 H GLY 53 1.380 -3.744 -4.865
392 HA2 GLY 53 2HA GLY 53 2.724 -6.275 -4.731
393 HA3 GLY 53 1HA GLY 53 3.737 -4.899 -4.301
394 H VAL 54 H VAL 54 3.735 -6.158 -2.276
395 HA VAL 54 HA VAL 54 1.380 -5.478 -0.668
396 HB VAL 54 HB VAL 54 2.006 -7.325 0.865
397 HG11 VAL 54 1HG1 VAL 54 1.640 -8.188 -1.992
398 HG12 VAL 54 2HG1 VAL 54 0.363 -7.749 -0.857
399 HG13 VAL 54 3HG1 VAL 54 1.341 -9.189 -0.572
400 HG21 VAL 54 3HG2 VAL 54 4.409 -7.431 0.410
401 HG22 VAL 54 1HG2 VAL 54 4.083 -8.012 -1.221
402 HG23 VAL 54 2HG2 VAL 54 3.659 -9.008 0.170
403 H PHE 55 H PHE 55 1.721 -4.797 1.446
404 HA PHE 55 HA PHE 55 4.354 -4.076 2.316
405 HD1 PHE 55 1HD PHE 55 1.864 -2.345 -0.575
406 HD2 PHE 55 2HD PHE 55 1.807 -0.804 3.398
407 HE1 PHE 55 1HE PHE 55 -0.327 -1.324 -1.006
408 HE2 PHE 55 2HE PHE 55 -0.390 0.214 2.968
409 HZ PHE 55 HZ PHE 55 -1.458 -0.045 0.764
410 HB2 PHE 55 2HB PHE 55 3.882 -1.635 2.398
411 HB3 PHE 55 1HB PHE 55 3.882 -2.280 0.756
412 HA PRO 56 HA PRO 56 2.116 -4.516 6.155
413 HB2 PRO 56 2HB PRO 56 3.989 -2.610 7.412
414 HB3 PRO 56 1HB PRO 56 3.718 -4.307 7.788
415 HG2 PRO 56 2HG PRO 56 5.974 -3.498 6.578
416 HG3 PRO 56 1HG PRO 56 5.224 -5.058 6.209
417 HD2 PRO 56 2HD PRO 56 5.117 -2.498 4.660
418 HD3 PRO 56 1HD PRO 56 5.313 -4.169 4.082
419 H ASP 57 H ASP 57 0.359 -3.530 6.725
420 HA ASP 57 HA ASP 57 -0.434 -1.183 5.425
421 HB2 ASP 57 2HB ASP 57 -2.567 -1.383 6.471
422 HB3 ASP 57 1HB ASP 57 -1.998 -2.988 6.060
423 H ASN 58 H ASN 58 1.167 -1.456 8.400
424 HA ASN 58 HA ASN 58 0.057 0.893 9.598
425 HB2 ASN 58 2HB ASN 58 1.740 0.673 11.309
426 HB3 ASN 58 1HB ASN 58 1.172 -0.938 10.895
427 HD21 ASN 58 1HD2 ASN 58 3.831 1.228 10.915
428 HD22 ASN 58 2HD2 ASN 58 5.027 0.095 10.389
429 H PHE 59 H PHE 59 2.284 0.430 7.088
430 HA PHE 59 HA PHE 59 3.745 2.879 7.504
431 HD1 PHE 59 2HD PHE 59 4.285 -0.699 7.022
432 HD2 PHE 59 1HD PHE 59 6.710 2.618 5.990
433 HE1 PHE 59 2HE PHE 59 6.215 -1.776 8.104
434 HE2 PHE 59 1HE PHE 59 8.639 1.561 7.079
435 HZ PHE 59 HZ PHE 59 8.386 -0.647 8.140
436 HB2 PHE 59 2HB PHE 59 3.673 0.918 5.220
437 HB3 PHE 59 1HB PHE 59 4.553 2.435 5.112
438 H ALA 60 H ALA 60 0.710 2.112 6.287
439 HA ALA 60 HA ALA 60 0.573 4.705 4.961
440 HB1 ALA 60 1HB ALA 60 -0.847 3.753 3.220
441 HB2 ALA 60 2HB ALA 60 -0.675 2.151 3.934
442 HB3 ALA 60 3HB ALA 60 0.729 2.957 3.229
443 H VAL 61 H VAL 61 -1.709 5.411 4.778
444 HA VAL 61 HA VAL 61 -3.465 4.154 6.734
445 HB VAL 61 HB VAL 61 -2.273 6.077 7.816
446 HG11 VAL 61 1HG1 VAL 61 -2.887 8.386 7.237
447 HG12 VAL 61 2HG1 VAL 61 -3.748 7.776 5.823
448 HG13 VAL 61 3HG1 VAL 61 -2.003 7.564 5.945
449 HG21 VAL 61 3HG2 VAL 61 -4.414 5.382 8.681
450 HG22 VAL 61 1HG2 VAL 61 -5.247 6.399 7.505
451 HG23 VAL 61 2HG2 VAL 61 -4.273 7.137 8.776
452 H GLN 62 H GLN 62 -5.626 4.244 6.166
453 HA GLN 62 HA GLN 62 -6.259 4.878 3.470
454 HB2 GLN 62 2HB GLN 62 -7.437 3.091 4.606
455 HB3 GLN 62 1HB GLN 62 -7.962 4.181 5.872
456 HG2 GLN 62 2HG GLN 62 -9.806 3.684 4.379
457 HG3 GLN 62 1HG GLN 62 -9.362 5.366 4.283
458 HE21 GLN 62 1HE2 GLN 62 -10.539 5.382 2.386
459 HE22 GLN 62 2HE2 GLN 62 -9.863 4.830 0.893
460 H ILE 63 H ILE 63 -7.430 6.561 2.768
461 HA ILE 63 HA ILE 63 -7.064 8.934 4.455
462 HB ILE 63 HB ILE 63 -7.410 10.334 2.457
463 HG12 ILE 63 2HG1 ILE 63 -7.433 7.743 0.883
464 HG13 ILE 63 1HG1 ILE 63 -8.857 8.728 1.188
465 HG21 ILE 63 1HG2 ILE 63 -5.283 8.220 2.174
466 HG22 ILE 63 2HG2 ILE 63 -5.168 9.720 3.097
467 HG23 ILE 63 3HG2 ILE 63 -5.287 9.774 1.339
468 HD11 ILE 63 3HD1 ILE 63 -7.991 9.123 -1.040
469 HD12 ILE 63 1HD1 ILE 63 -6.420 9.571 -0.373
470 HD13 ILE 63 2HD1 ILE 63 -7.840 10.569 -0.054
471 H SER 64 H SER 64 -9.583 7.378 2.612
472 HA SER 64 HA SER 64 -11.512 9.014 4.046
473 HG SER 64 HG SER 64 -12.179 10.125 1.160
474 HB2 SER 64 2HB SER 64 -11.799 7.547 1.414
475 HB3 SER 64 1HB SER 64 -13.030 8.558 2.178
Start of MODEL 14
1 H1 GLY 1 1HT GLY 1 -13.698 -7.958 2.301
2 H2 GLY 1 2HT GLY 1 -13.793 -7.988 4.007
3 H3 GLY 1 3HT GLY 1 -12.283 -8.076 3.210
4 HA2 GLY 1 1HA GLY 1 -14.041 -5.734 3.093
5 HA3 GLY 1 2HA GLY 1 -12.592 -5.908 4.084
6 H ALA 2 H ALA 2 -13.024 -4.000 2.025
7 HA ALA 2 HA ALA 2 -12.020 -3.024 0.271
8 HB1 ALA 2 1HB ALA 2 -9.672 -4.731 1.086
9 HB2 ALA 2 2HB ALA 2 -10.097 -3.160 1.765
10 HB3 ALA 2 3HB ALA 2 -9.607 -3.288 0.075
11 H MET 3 H MET 3 -13.626 -4.408 -0.902
12 HA MET 3 HA MET 3 -12.220 -5.663 -3.098
13 HB2 MET 3 2HB MET 3 -12.854 -7.481 -1.461
14 HB3 MET 3 1HB MET 3 -14.532 -7.037 -1.735
15 HG2 MET 3 2HG MET 3 -13.897 -8.982 -3.062
16 HG3 MET 3 1HG MET 3 -14.348 -7.614 -4.076
17 HE1 MET 3 3HE MET 3 -9.952 -8.890 -3.342
18 HE2 MET 3 1HE MET 3 -11.333 -9.697 -2.604
19 HE3 MET 3 2HE MET 3 -10.915 -8.052 -2.128
20 H GLY 4 H GLY 4 -12.862 -4.337 -4.640
21 HA2 GLY 4 2HA GLY 4 -14.396 -3.600 -6.262
22 HA3 GLY 4 1HA GLY 4 -15.708 -4.128 -5.219
23 H ALA 5 H ALA 5 -13.029 -1.693 -5.136
24 HA ALA 5 HA ALA 5 -14.751 0.466 -4.812
25 HB1 ALA 5 1HB ALA 5 -14.069 1.054 -2.508
26 HB2 ALA 5 2HB ALA 5 -13.269 -0.511 -2.357
27 HB3 ALA 5 3HB ALA 5 -15.020 -0.431 -2.546
28 H LYS 6 H LYS 6 -13.311 2.306 -4.169
29 HA LYS 6 HA LYS 6 -10.581 1.851 -5.104
30 HB2 LYS 6 2HB LYS 6 -10.549 4.204 -5.975
31 HB3 LYS 6 1HB LYS 6 -11.673 3.159 -6.819
32 HG2 LYS 6 2HG LYS 6 -13.546 4.182 -5.721
33 HG3 LYS 6 1HG LYS 6 -12.477 5.102 -4.658
34 HD2 LYS 6 2HD LYS 6 -11.566 6.267 -6.633
35 HD3 LYS 6 1HD LYS 6 -12.693 5.369 -7.651
36 HE2 LYS 6 2HE LYS 6 -14.576 6.397 -6.545
37 HE3 LYS 6 1HE LYS 6 -13.504 7.210 -5.410
38 HZ1 LYS 6 3HZ LYS 6 -14.290 8.615 -7.249
39 HZ2 LYS 6 1HZ LYS 6 -13.467 7.645 -8.339
40 HZ3 LYS 6 2HZ LYS 6 -12.618 8.535 -7.164
41 H GLU 7 H GLU 7 -9.595 1.622 -3.184
42 HA GLU 7 HA GLU 7 -10.074 3.722 -1.231
43 HB2 GLU 7 2HB GLU 7 -8.769 1.024 -0.867
44 HB3 GLU 7 1HB GLU 7 -9.050 2.201 0.416
45 HG2 GLU 7 2HG GLU 7 -11.511 1.957 -0.186
46 HG3 GLU 7 1HG GLU 7 -11.020 0.553 -1.129
47 H TYR 8 H TYR 8 -8.397 4.870 -0.406
48 HA TYR 8 HA TYR 8 -5.851 4.562 -1.842
49 HD1 TYR 8 1HD TYR 8 -5.392 6.014 -4.322
50 HD2 TYR 8 2HD TYR 8 -9.200 6.941 -2.670
51 HE1 TYR 8 1HE TYR 8 -6.392 5.882 -6.558
52 HE2 TYR 8 2HE TYR 8 -10.208 6.811 -4.893
53 HH TYR 8 HH TYR 8 -8.590 5.490 -7.576
54 HB2 TYR 8 2HB TYR 8 -7.178 7.242 -1.343
55 HB3 TYR 8 1HB TYR 8 -5.611 6.982 -2.065
56 H CYS 9 H CYS 9 -4.092 4.861 -0.695
57 HA CYS 9 HA CYS 9 -4.429 5.701 2.103
58 HG CYS 9 HG CYS 9 -5.691 3.228 1.470
59 HB2 CYS 9 2HB CYS 9 -2.590 3.523 1.079
60 HB3 CYS 9 1HB CYS 9 -2.787 4.028 2.752
61 H ARG 10 H ARG 10 -2.634 6.740 3.030
62 HA ARG 10 HA ARG 10 -0.645 7.697 1.093
63 HE ARG 10 HE ARG 10 -2.245 11.825 2.165
64 HB2 ARG 10 2HB ARG 10 -2.077 9.561 1.868
65 HB3 ARG 10 1HB ARG 10 -1.719 9.145 3.541
66 HG2 ARG 10 2HG ARG 10 0.667 9.623 3.126
67 HG3 ARG 10 1HG ARG 10 0.265 10.107 1.483
68 HD2 ARG 10 2HD ARG 10 -0.768 11.411 3.997
69 HD3 ARG 10 1HD ARG 10 0.559 12.014 3.013
70 HH11 ARG 10 1HH1 ARG 10 0.920 13.439 2.022
71 HH12 ARG 10 2HH1 ARG 10 0.426 14.642 0.939
72 HH21 ARG 10 1HH2 ARG 10 -2.954 13.594 0.701
73 HH22 ARG 10 2HH2 ARG 10 -1.803 14.752 0.232
74 H THR 11 H THR 11 1.417 7.274 1.609
75 HA THR 11 HA THR 11 1.992 5.567 3.786
76 HB THR 11 HB THR 11 4.379 6.085 2.984
77 HG1 THR 11 1HG THR 11 4.477 7.061 1.001
78 HG21 THR 11 3HG2 THR 11 2.365 4.950 1.058
79 HG22 THR 11 1HG2 THR 11 3.101 4.056 2.393
80 HG23 THR 11 2HG2 THR 11 4.102 4.626 1.058
81 H LEU 12 H LEU 12 2.635 6.081 5.762
82 HA LEU 12 HA LEU 12 3.011 8.885 6.474
83 HG LEU 12 HG LEU 12 0.700 6.877 7.282
84 HB2 LEU 12 2HB LEU 12 2.942 6.389 8.177
85 HB3 LEU 12 1HB LEU 12 3.053 8.023 8.790
86 HD11 LEU 12 1HD1 LEU 12 -0.446 7.011 9.442
87 HD12 LEU 12 2HD1 LEU 12 1.058 7.520 10.207
88 HD13 LEU 12 3HD1 LEU 12 0.929 5.911 9.499
89 HD21 LEU 12 3HD2 LEU 12 0.923 9.261 6.886
90 HD22 LEU 12 1HD2 LEU 12 1.103 9.555 8.618
91 HD23 LEU 12 2HD2 LEU 12 -0.424 8.955 7.979
92 H PHE 13 H PHE 13 4.753 6.101 5.705
93 HA PHE 13 HA PHE 13 7.317 7.354 6.352
94 HD1 PHE 13 1HD PHE 13 8.512 6.702 9.100
95 HD2 PHE 13 2HD PHE 13 4.829 4.670 8.495
96 HE1 PHE 13 1HE PHE 13 7.894 7.119 11.442
97 HE2 PHE 13 2HE PHE 13 4.199 5.089 10.831
98 HZ PHE 13 HZ PHE 13 5.733 6.315 12.309
99 HB2 PHE 13 2HB PHE 13 6.566 4.474 6.934
100 HB3 PHE 13 1HB PHE 13 8.158 5.175 7.177
101 HA PRO 14 HA PRO 14 7.982 5.538 2.335
102 HB2 PRO 14 2HB PRO 14 10.689 5.373 2.275
103 HB3 PRO 14 1HB PRO 14 9.843 6.916 2.123
104 HG2 PRO 14 2HG PRO 14 11.264 5.758 4.468
105 HG3 PRO 14 1HG PRO 14 11.143 7.443 3.949
106 HD2 PRO 14 2HD PRO 14 9.654 6.282 5.980
107 HD3 PRO 14 1HD PRO 14 9.214 7.771 5.134
108 H TYR 15 H TYR 15 8.084 3.442 1.610
109 HA TYR 15 HA TYR 15 9.228 1.497 3.480
110 HD1 TYR 15 2HD TYR 15 8.160 -0.203 5.024
111 HD2 TYR 15 1HD TYR 15 6.853 -1.287 1.109
112 HE1 TYR 15 2HE TYR 15 8.477 -2.562 5.571
113 HE2 TYR 15 1HE TYR 15 7.176 -3.651 1.660
114 HH TYR 15 HH TYR 15 8.475 -5.042 3.270
115 HB2 TYR 15 2HB TYR 15 6.741 1.368 3.531
116 HB3 TYR 15 1HB TYR 15 6.753 1.006 1.806
117 H THR 16 H THR 16 10.881 0.563 2.615
118 HA THR 16 HA THR 16 10.870 0.128 -0.276
119 HB THR 16 HB THR 16 13.237 0.113 1.616
120 HG1 THR 16 1HG THR 16 11.756 2.115 0.743
121 HG21 THR 16 3HG2 THR 16 13.537 -1.117 -0.512
122 HG22 THR 16 1HG2 THR 16 14.532 0.336 -0.464
123 HG23 THR 16 2HG2 THR 16 13.042 0.321 -1.404
124 H GLY 17 H GLY 17 10.701 -1.922 -0.942
125 HA2 GLY 17 2HA GLY 17 10.536 -4.001 1.032
126 HA3 GLY 17 1HA GLY 17 10.201 -4.120 -0.690
127 H THR 18 H THR 18 11.766 -5.905 0.941
128 HA THR 18 HA THR 18 14.395 -5.449 -0.208
129 HB THR 18 HB THR 18 14.439 -5.926 2.190
130 HG1 THR 18 1HG THR 18 15.324 -8.390 1.305
131 HG21 THR 18 3HG2 THR 18 12.356 -7.166 2.432
132 HG22 THR 18 1HG2 THR 18 13.697 -8.083 3.116
133 HG23 THR 18 2HG2 THR 18 13.043 -8.522 1.538
134 H ASN 19 H ASN 19 11.527 -7.207 -0.468
135 HA ASN 19 HA ASN 19 12.651 -9.035 -2.467
136 HB2 ASN 19 2HB ASN 19 9.900 -8.956 -1.183
137 HB3 ASN 19 1HB ASN 19 10.463 -10.173 -2.315
138 HD21 ASN 19 1HD2 ASN 19 10.633 -8.968 0.916
139 HD22 ASN 19 2HD2 ASN 19 11.414 -10.350 1.608
140 H GLU 20 H GLU 20 11.251 -9.220 -4.465
141 HA GLU 20 HA GLU 20 10.541 -6.591 -5.430
142 HB2 GLU 20 2HB GLU 20 10.213 -7.671 -7.576
143 HB3 GLU 20 1HB GLU 20 11.700 -8.272 -6.855
144 HG2 GLU 20 2HG GLU 20 10.474 -10.277 -6.098
145 HG3 GLU 20 1HG GLU 20 9.047 -9.680 -6.934
146 H ASP 21 H ASP 21 9.039 -8.931 -3.726
147 HA ASP 21 HA ASP 21 6.378 -8.874 -4.844
148 HB2 ASP 21 2HB ASP 21 7.216 -10.886 -3.758
149 HB3 ASP 21 1HB ASP 21 7.503 -9.994 -2.273
150 H GLU 22 H GLU 22 8.209 -7.375 -2.395
151 HA GLU 22 HA GLU 22 6.107 -5.852 -1.183
152 HB2 GLU 22 2HB GLU 22 9.095 -5.815 -1.162
153 HB3 GLU 22 1HB GLU 22 8.147 -4.602 -0.320
154 HG2 GLU 22 2HG GLU 22 7.299 -6.138 1.146
155 HG3 GLU 22 1HG GLU 22 7.819 -7.539 0.180
156 H LEU 23 H LEU 23 5.871 -3.597 -1.532
157 HA LEU 23 HA LEU 23 6.955 -2.731 -4.121
158 HG LEU 23 HG LEU 23 3.626 -1.371 -5.177
159 HB2 LEU 23 2HB LEU 23 4.354 -3.067 -3.631
160 HB3 LEU 23 1HB LEU 23 4.520 -1.498 -2.894
161 HD11 LEU 23 1HD1 LEU 23 5.135 0.309 -6.106
162 HD12 LEU 23 2HD1 LEU 23 6.324 -0.117 -4.872
163 HD13 LEU 23 3HD1 LEU 23 4.766 0.559 -4.400
164 HD21 LEU 23 3HD2 LEU 23 6.289 -2.477 -6.047
165 HD22 LEU 23 1HD2 LEU 23 5.023 -1.858 -7.101
166 HD23 LEU 23 2HD2 LEU 23 4.733 -3.304 -6.138
167 H THR 24 H THR 24 7.921 -0.736 -4.200
168 HA THR 24 HA THR 24 8.639 0.334 -1.593
169 HB THR 24 HB THR 24 9.920 0.708 -4.309
170 HG1 THR 24 1HG THR 24 11.219 -0.848 -3.721
171 HG21 THR 24 3HG2 THR 24 11.779 1.797 -3.083
172 HG22 THR 24 1HG2 THR 24 10.844 1.705 -1.591
173 HG23 THR 24 2HG2 THR 24 10.281 2.713 -2.920
174 H PHE 25 H PHE 25 7.798 2.073 -0.880
175 HA PHE 25 HA PHE 25 6.539 4.028 -2.693
176 HD1 PHE 25 1HD PHE 25 3.604 3.856 -2.887
177 HD2 PHE 25 2HD PHE 25 5.131 0.941 -0.197
178 HE1 PHE 25 1HE PHE 25 2.017 2.201 -3.779
179 HE2 PHE 25 2HE PHE 25 3.552 -0.716 -1.091
180 HZ PHE 25 HZ PHE 25 1.994 -0.087 -2.886
181 HB2 PHE 25 2HB PHE 25 5.647 3.243 0.093
182 HB3 PHE 25 1HB PHE 25 4.923 4.486 -0.911
183 H ARG 26 H ARG 26 6.858 6.171 -2.101
184 HA ARG 26 HA ARG 26 9.027 6.667 -0.201
185 HE ARG 26 HE ARG 26 8.517 10.968 -1.684
186 HB2 ARG 26 2HB ARG 26 8.952 8.988 -1.067
187 HB3 ARG 26 1HB ARG 26 9.149 7.822 -2.376
188 HG2 ARG 26 2HG ARG 26 6.783 7.986 -2.891
189 HG3 ARG 26 1HG ARG 26 6.570 9.098 -1.543
190 HD2 ARG 26 2HD ARG 26 8.347 9.635 -3.916
191 HD3 ARG 26 1HD ARG 26 6.664 10.146 -3.764
192 HH11 ARG 26 1HH1 ARG 26 6.648 11.861 -4.581
193 HH12 ARG 26 2HH1 ARG 26 6.744 13.526 -4.297
194 HH21 ARG 26 1HH2 ARG 26 8.613 13.302 -1.298
195 HH22 ARG 26 2HH2 ARG 26 7.888 14.357 -2.426
196 H GLU 27 H GLU 27 8.623 8.732 1.213
197 HA GLU 27 HA GLU 27 6.324 8.265 2.831
198 HB2 GLU 27 2HB GLU 27 8.507 8.985 3.689
199 HB3 GLU 27 1HB GLU 27 8.342 10.496 2.817
200 HG2 GLU 27 2HG GLU 27 6.357 11.027 4.172
201 HG3 GLU 27 1HG GLU 27 6.626 9.547 5.097
202 H GLY 28 H GLY 28 4.366 9.237 2.645
203 HA2 GLY 28 2HA GLY 28 2.839 10.903 2.282
204 HA3 GLY 28 1HA GLY 28 4.140 11.931 1.701
205 H GLU 29 H GLU 29 3.235 8.733 0.491
206 HA GLU 29 HA GLU 29 2.497 10.053 -2.010
207 HB2 GLU 29 2HB GLU 29 4.655 8.880 -2.201
208 HB3 GLU 29 1HB GLU 29 3.900 7.398 -1.642
209 HG2 GLU 29 2HG GLU 29 2.735 7.105 -3.652
210 HG3 GLU 29 1HG GLU 29 2.993 8.777 -4.144
211 H ILE 30 H ILE 30 0.933 8.875 -3.297
212 HA ILE 30 HA ILE 30 -1.147 7.862 -1.517
213 HB ILE 30 HB ILE 30 -1.379 8.896 -4.359
214 HG12 ILE 30 2HG1 ILE 30 -0.700 10.686 -2.836
215 HG13 ILE 30 1HG1 ILE 30 -2.360 10.934 -3.367
216 HG21 ILE 30 1HG2 ILE 30 -3.798 8.990 -3.928
217 HG22 ILE 30 2HG2 ILE 30 -3.539 8.247 -2.349
218 HG23 ILE 30 3HG2 ILE 30 -3.173 7.344 -3.816
219 HD11 ILE 30 3HD1 ILE 30 -3.141 10.049 -1.201
220 HD12 ILE 30 1HD1 ILE 30 -2.107 11.466 -1.016
221 HD13 ILE 30 2HD1 ILE 30 -1.462 9.859 -0.691
222 H ILE 31 H ILE 31 -1.809 5.884 -1.618
223 HA ILE 31 HA ILE 31 -0.734 4.062 -3.687
224 HB ILE 31 HB ILE 31 -1.777 3.395 -0.929
225 HG12 ILE 31 2HG1 ILE 31 1.111 3.611 -1.810
226 HG13 ILE 31 1HG1 ILE 31 0.281 4.748 -0.751
227 HG21 ILE 31 1HG2 ILE 31 -0.230 1.737 -2.916
228 HG22 ILE 31 2HG2 ILE 31 -1.935 1.560 -2.501
229 HG23 ILE 31 3HG2 ILE 31 -0.694 1.222 -1.294
230 HD11 ILE 31 3HD1 ILE 31 0.731 1.836 -0.148
231 HD12 ILE 31 1HD1 ILE 31 0.000 3.022 0.928
232 HD13 ILE 31 2HD1 ILE 31 1.708 3.154 0.481
233 H HIS 32 H HIS 32 -2.283 3.032 -4.941
234 HA HIS 32 HA HIS 32 -5.056 3.326 -4.127
235 HD1 HIS 32 1HD HIS 32 -5.646 0.622 -7.884
236 HD2 HIS 32 2HD HIS 32 -7.386 3.394 -5.311
237 HE1 HIS 32 1HE HIS 32 -8.125 0.216 -7.979
238 HB2 HIS 32 2HB HIS 32 -4.521 3.655 -6.554
239 HB3 HIS 32 1HB HIS 32 -3.917 2.001 -6.628
240 H LEU 33 H LEU 33 -5.767 1.951 -2.750
241 HA LEU 33 HA LEU 33 -4.351 -0.445 -2.115
242 HG LEU 33 HG LEU 33 -5.165 -1.322 0.320
243 HB2 LEU 33 2HB LEU 33 -5.408 1.074 -0.445
244 HB3 LEU 33 1HB LEU 33 -6.966 0.673 -1.102
245 HD11 LEU 33 1HD1 LEU 33 -6.654 -1.013 2.229
246 HD12 LEU 33 2HD1 LEU 33 -7.511 0.257 1.357
247 HD13 LEU 33 3HD1 LEU 33 -5.823 0.485 1.814
248 HD21 LEU 33 3HD2 LEU 33 -7.193 -2.653 0.543
249 HD22 LEU 33 1HD2 LEU 33 -6.856 -2.345 -1.158
250 HD23 LEU 33 2HD2 LEU 33 -8.117 -1.431 -0.331
251 H ILE 34 H ILE 34 -4.686 -2.307 -2.964
252 HA ILE 34 HA ILE 34 -6.952 -2.717 -4.772
253 HB ILE 34 HB ILE 34 -4.500 -4.455 -4.362
254 HG12 ILE 34 2HG1 ILE 34 -3.801 -2.277 -5.207
255 HG13 ILE 34 1HG1 ILE 34 -3.641 -3.492 -6.468
256 HG21 ILE 34 1HG2 ILE 34 -5.093 -5.458 -6.526
257 HG22 ILE 34 2HG2 ILE 34 -6.552 -4.469 -6.577
258 HG23 ILE 34 3HG2 ILE 34 -6.361 -5.691 -5.319
259 HD11 ILE 34 3HD1 ILE 34 -5.718 -2.683 -7.487
260 HD12 ILE 34 1HD1 ILE 34 -4.504 -1.411 -7.349
261 HD13 ILE 34 2HD1 ILE 34 -5.853 -1.465 -6.218
262 H SER 35 H SER 35 -5.329 -4.164 -1.958
263 HA SER 35 HA SER 35 -7.789 -5.426 -1.162
264 HG SER 35 HG SER 35 -7.560 -6.346 -3.232
265 HB2 SER 35 2HB SER 35 -5.375 -7.092 -1.901
266 HB3 SER 35 1HB SER 35 -6.811 -7.717 -1.101
267 H LYS 36 H LYS 36 -7.876 -5.487 1.034
268 HA LYS 36 HA LYS 36 -5.498 -5.017 2.609
269 HB2 LYS 36 2HB LYS 36 -8.395 -5.459 3.371
270 HB3 LYS 36 1HB LYS 36 -7.110 -5.290 4.553
271 HG2 LYS 36 2HG LYS 36 -6.650 -3.046 3.692
272 HG3 LYS 36 1HG LYS 36 -8.004 -3.154 2.591
273 HD2 LYS 36 2HD LYS 36 -9.498 -3.532 4.516
274 HD3 LYS 36 1HD LYS 36 -8.116 -3.372 5.596
275 HE2 LYS 36 2HE LYS 36 -9.067 -1.240 5.649
276 HE3 LYS 36 1HE LYS 36 -7.759 -1.129 4.470
277 HZ1 LYS 36 3HZ LYS 36 -9.767 -0.026 3.727
278 HZ2 LYS 36 1HZ LYS 36 -10.633 -1.446 3.789
279 HZ3 LYS 36 2HZ LYS 36 -9.418 -1.231 2.648
280 H GLU 37 H GLU 37 -7.541 -7.590 1.567
281 HA GLU 37 HA GLU 37 -6.196 -9.476 3.303
282 HB2 GLU 37 2HB GLU 37 -8.608 -9.703 1.515
283 HB3 GLU 37 1HB GLU 37 -7.769 -11.132 2.076
284 HG2 GLU 37 2HG GLU 37 -9.606 -10.821 3.495
285 HG3 GLU 37 1HG GLU 37 -8.197 -10.354 4.414
286 H THR 38 H THR 38 -4.238 -9.852 2.554
287 HA THR 38 HA THR 38 -3.917 -10.514 -0.298
288 HB THR 38 HB THR 38 -1.462 -10.212 0.227
289 HG1 THR 38 1HG THR 38 -2.023 -8.718 2.499
290 HG21 THR 38 3HG2 THR 38 -2.789 -8.417 -0.816
291 HG22 THR 38 1HG2 THR 38 -1.572 -7.756 0.279
292 HG23 THR 38 2HG2 THR 38 -3.257 -7.843 0.788
293 H GLY 39 H GLY 39 -4.522 -11.932 2.497
294 HA2 GLY 39 2HA GLY 39 -4.381 -14.439 2.463
295 HA3 GLY 39 1HA GLY 39 -2.651 -14.182 2.201
296 H GLU 40 H GLU 40 -2.243 -12.013 3.720
297 HA GLU 40 HA GLU 40 -2.800 -12.911 6.459
298 HB2 GLU 40 2HB GLU 40 -0.473 -11.350 5.357
299 HB3 GLU 40 1HB GLU 40 -0.802 -11.540 7.067
300 HG2 GLU 40 2HG GLU 40 -0.527 -13.966 6.812
301 HG3 GLU 40 1HG GLU 40 -0.116 -13.713 5.113
302 H ALA 41 H ALA 41 -2.900 -11.175 7.993
303 HA ALA 41 HA ALA 41 -4.076 -8.734 6.930
304 HB1 ALA 41 1HB ALA 41 -4.732 -8.352 9.275
305 HB2 ALA 41 2HB ALA 41 -3.937 -9.856 9.735
306 HB3 ALA 41 3HB ALA 41 -5.353 -9.891 8.681
307 H GLY 42 H GLY 42 -3.141 -6.717 7.624
308 HA2 GLY 42 2HA GLY 42 -1.424 -5.471 8.657
309 HA3 GLY 42 1HA GLY 42 -0.469 -6.946 8.795
310 H TRP 43 H TRP 43 -1.230 -7.663 6.017
311 HA TRP 43 HA TRP 43 0.642 -5.892 4.633
312 HD1 TRP 43 HD TRP 43 1.196 -9.573 6.503
313 HE1 TRP 43 1HE TRP 43 3.640 -9.589 7.284
314 HE3 TRP 43 3HE TRP 43 3.194 -6.528 2.923
315 HZ2 TRP 43 2HZ TRP 43 6.110 -8.442 6.484
316 HZ3 TRP 43 3HZ TRP 43 5.596 -6.031 2.994
317 HH2 TRP 43 HH TRP 43 7.028 -6.972 4.737
318 HB2 TRP 43 2HB TRP 43 0.056 -8.830 4.212
319 HB3 TRP 43 1HB TRP 43 1.008 -7.856 3.105
320 H TRP 44 H TRP 44 -0.298 -4.653 3.245
321 HA TRP 44 HA TRP 44 -2.849 -5.488 2.065
322 HD1 TRP 44 HD TRP 44 -3.522 -5.372 4.292
323 HE1 TRP 44 1HE TRP 44 -5.009 -4.395 6.132
324 HE3 TRP 44 3HE TRP 44 -3.349 -0.454 2.939
325 HZ2 TRP 44 2HZ TRP 44 -5.977 -1.875 6.918
326 HZ3 TRP 44 3HZ TRP 44 -4.585 1.180 4.284
327 HH2 TRP 44 HH TRP 44 -5.884 0.474 6.234
328 HB2 TRP 44 2HB TRP 44 -1.687 -2.745 2.552
329 HB3 TRP 44 1HB TRP 44 -3.107 -3.037 1.565
330 H LYS 45 H LYS 45 -3.155 -4.944 -0.136
331 HA LYS 45 HA LYS 45 -0.641 -4.850 -1.650
332 HB2 LYS 45 2HB LYS 45 -2.044 -6.812 -2.212
333 HB3 LYS 45 1HB LYS 45 -3.397 -5.743 -2.544
334 HG2 LYS 45 2HG LYS 45 -2.136 -4.691 -4.371
335 HG3 LYS 45 1HG LYS 45 -0.803 -5.796 -4.078
336 HD2 LYS 45 2HD LYS 45 -3.587 -6.650 -4.851
337 HD3 LYS 45 1HD LYS 45 -2.270 -6.418 -5.993
338 HE2 LYS 45 2HE LYS 45 -0.973 -8.113 -4.669
339 HE3 LYS 45 1HE LYS 45 -2.459 -8.435 -3.774
340 HZ1 LYS 45 3HZ LYS 45 -2.102 -9.962 -5.664
341 HZ2 LYS 45 1HZ LYS 45 -2.180 -8.643 -6.711
342 HZ3 LYS 45 2HZ LYS 45 -3.540 -9.091 -5.809
343 H GLY 46 H GLY 46 -0.205 -3.144 -2.817
344 HA2 GLY 46 2HA GLY 46 -2.372 -1.313 -3.495
345 HA3 GLY 46 1HA GLY 46 -0.924 -0.699 -2.702
346 H GLU 47 H GLU 47 -2.025 -0.176 -5.369
347 HA GLU 47 HA GLU 47 0.184 -1.222 -6.981
348 HB2 GLU 47 2HB GLU 47 -2.098 -1.626 -7.872
349 HB3 GLU 47 1HB GLU 47 -2.357 0.114 -7.923
350 HG2 GLU 47 2HG GLU 47 -0.423 0.301 -9.477
351 HG3 GLU 47 1HG GLU 47 -0.335 -1.456 -9.508
352 H LEU 48 H LEU 48 1.648 0.068 -7.792
353 HA LEU 48 HA LEU 48 1.248 2.948 -7.897
354 HG LEU 48 HG LEU 48 4.000 3.915 -7.700
355 HB2 LEU 48 2HB LEU 48 2.373 2.340 -5.732
356 HB3 LEU 48 1HB LEU 48 3.673 1.639 -6.669
357 HD11 LEU 48 1HD1 LEU 48 2.182 4.721 -5.450
358 HD12 LEU 48 2HD1 LEU 48 1.895 4.933 -7.179
359 HD13 LEU 48 3HD1 LEU 48 3.191 5.821 -6.378
360 HD21 LEU 48 3HD2 LEU 48 4.460 3.579 -4.739
361 HD22 LEU 48 1HD2 LEU 48 5.259 4.767 -5.772
362 HD23 LEU 48 2HD2 LEU 48 5.524 3.046 -6.041
363 H ASN 49 H ASN 49 1.957 3.593 -9.853
364 HA ASN 49 HA ASN 49 2.978 3.706 -11.878
365 HB2 ASN 49 2HB ASN 49 5.151 1.946 -10.714
366 HB3 ASN 49 1HB ASN 49 5.269 2.922 -12.167
367 HD21 ASN 49 1HD2 ASN 49 5.643 2.784 -8.854
368 HD22 ASN 49 2HD2 ASN 49 6.083 4.432 -8.580
369 H GLY 50 H GLY 50 1.231 1.389 -11.155
370 HA2 GLY 50 2HA GLY 50 0.274 -0.148 -12.644
371 HA3 GLY 50 1HA GLY 50 1.756 -0.111 -13.592
372 H LYS 51 H LYS 51 2.820 -0.425 -10.539
373 HA LYS 51 HA LYS 51 2.901 -3.325 -10.792
374 HB2 LYS 51 2HB LYS 51 4.664 -1.445 -9.216
375 HB3 LYS 51 1HB LYS 51 4.742 -3.190 -9.094
376 HG2 LYS 51 2HG LYS 51 6.511 -2.551 -10.444
377 HG3 LYS 51 1HG LYS 51 5.319 -3.210 -11.545
378 HD2 LYS 51 2HD LYS 51 4.581 -0.943 -12.142
379 HD3 LYS 51 1HD LYS 51 5.760 -0.265 -11.023
380 HE2 LYS 51 2HE LYS 51 6.559 -0.172 -13.332
381 HE3 LYS 51 1HE LYS 51 7.578 -1.203 -12.333
382 HZ1 LYS 51 3HZ LYS 51 6.489 -3.134 -13.265
383 HZ2 LYS 51 1HZ LYS 51 7.114 -2.181 -14.497
384 HZ3 LYS 51 2HZ LYS 51 5.456 -2.175 -14.177
385 H GLU 52 H GLU 52 2.046 -4.545 -9.272
386 HA GLU 52 HA GLU 52 0.910 -3.149 -6.971
387 HB2 GLU 52 2HB GLU 52 -0.802 -4.974 -6.835
388 HB3 GLU 52 1HB GLU 52 -0.957 -3.964 -8.256
389 HG2 GLU 52 2HG GLU 52 -0.018 -5.673 -9.647
390 HG3 GLU 52 1HG GLU 52 0.393 -6.651 -8.240
391 H GLY 53 H GLY 53 1.732 -3.614 -5.138
392 HA2 GLY 53 2HA GLY 53 2.915 -6.266 -4.772
393 HA3 GLY 53 1HA GLY 53 3.881 -4.845 -4.410
394 H VAL 54 H VAL 54 3.843 -6.050 -2.294
395 HA VAL 54 HA VAL 54 1.440 -5.261 -0.828
396 HB VAL 54 HB VAL 54 1.928 -7.031 0.818
397 HG11 VAL 54 1HG1 VAL 54 1.698 -8.055 -2.004
398 HG12 VAL 54 2HG1 VAL 54 0.371 -7.490 -0.991
399 HG13 VAL 54 3HG1 VAL 54 1.261 -8.946 -0.544
400 HG21 VAL 54 3HG2 VAL 54 4.101 -7.882 -1.107
401 HG22 VAL 54 1HG2 VAL 54 3.573 -8.796 0.307
402 HG23 VAL 54 2HG2 VAL 54 4.349 -7.224 0.511
403 H PHE 55 H PHE 55 1.654 -4.485 1.235
404 HA PHE 55 HA PHE 55 4.258 -3.691 2.175
405 HD1 PHE 55 1HD PHE 55 1.317 -2.168 -0.448
406 HD2 PHE 55 2HD PHE 55 1.825 -0.423 3.406
407 HE1 PHE 55 1HE PHE 55 -0.951 -1.229 -0.574
408 HE2 PHE 55 2HE PHE 55 -0.443 0.513 3.282
409 HZ PHE 55 HZ PHE 55 -1.833 0.111 1.291
410 HB2 PHE 55 2HB PHE 55 3.740 -1.305 2.197
411 HB3 PHE 55 1HB PHE 55 3.539 -1.947 0.566
412 HA PRO 56 HA PRO 56 1.842 -4.231 5.923
413 HB2 PRO 56 2HB PRO 56 3.685 -2.567 7.433
414 HB3 PRO 56 1HB PRO 56 3.475 -4.311 7.501
415 HG2 PRO 56 2HG PRO 56 5.704 -3.132 6.486
416 HG3 PRO 56 1HG PRO 56 5.106 -4.709 5.938
417 HD2 PRO 56 2HD PRO 56 4.777 -2.011 4.677
418 HD3 PRO 56 1HD PRO 56 5.151 -3.578 3.924
419 H ASP 57 H ASP 57 0.151 -3.145 6.761
420 HA ASP 57 HA ASP 57 -0.450 -0.514 5.897
421 HB2 ASP 57 2HB ASP 57 -2.493 -0.627 7.139
422 HB3 ASP 57 1HB ASP 57 -2.193 -2.232 6.500
423 H ASN 58 H ASN 58 1.386 -1.586 8.453
424 HA ASN 58 HA ASN 58 1.065 0.470 10.360
425 HB2 ASN 58 2HB ASN 58 3.589 -1.105 9.769
426 HB3 ASN 58 1HB ASN 58 3.325 -0.108 11.189
427 HD21 ASN 58 1HD2 ASN 58 2.841 -3.185 9.728
428 HD22 ASN 58 2HD2 ASN 58 1.999 -3.898 11.045
429 H PHE 59 H PHE 59 2.521 0.527 7.260
430 HA PHE 59 HA PHE 59 4.099 2.892 7.919
431 HD1 PHE 59 1HD PHE 59 4.645 -0.700 7.210
432 HD2 PHE 59 2HD PHE 59 7.150 2.664 6.524
433 HE1 PHE 59 1HE PHE 59 6.532 -1.893 8.244
434 HE2 PHE 59 2HE PHE 59 9.034 1.487 7.562
435 HZ PHE 59 HZ PHE 59 8.731 -0.797 8.424
436 HB2 PHE 59 2HB PHE 59 4.115 1.103 5.490
437 HB3 PHE 59 1HB PHE 59 5.011 2.609 5.570
438 H ALA 60 H ALA 60 0.971 2.420 7.051
439 HA ALA 60 HA ALA 60 0.907 4.927 5.578
440 HB1 ALA 60 1HB ALA 60 1.060 3.193 3.848
441 HB2 ALA 60 2HB ALA 60 -0.498 4.020 3.811
442 HB3 ALA 60 3HB ALA 60 -0.372 2.410 4.519
443 H VAL 61 H VAL 61 -1.339 5.686 5.290
444 HA VAL 61 HA VAL 61 -3.236 4.540 7.193
445 HB VAL 61 HB VAL 61 -2.224 6.576 8.230
446 HG11 VAL 61 1HG1 VAL 61 -3.357 8.057 5.869
447 HG12 VAL 61 2HG1 VAL 61 -1.650 7.835 6.252
448 HG13 VAL 61 3HG1 VAL 61 -2.673 8.803 7.314
449 HG21 VAL 61 3HG2 VAL 61 -4.327 7.751 8.764
450 HG22 VAL 61 1HG2 VAL 61 -4.499 5.996 8.813
451 HG23 VAL 61 2HG2 VAL 61 -5.110 6.903 7.430
452 H GLN 62 H GLN 62 -5.348 4.496 6.412
453 HA GLN 62 HA GLN 62 -5.541 4.973 3.590
454 HB2 GLN 62 2HB GLN 62 -6.497 2.936 4.713
455 HB3 GLN 62 1HB GLN 62 -7.684 3.991 5.469
456 HG2 GLN 62 2HG GLN 62 -8.482 4.669 3.275
457 HG3 GLN 62 1HG GLN 62 -7.295 3.615 2.517
458 HE21 GLN 62 1HE2 GLN 62 -10.092 3.616 2.264
459 HE22 GLN 62 2HE2 GLN 62 -10.648 2.038 2.713
460 H ILE 63 H ILE 63 -6.474 6.661 2.694
461 HA ILE 63 HA ILE 63 -7.602 8.671 4.498
462 HB ILE 63 HB ILE 63 -7.145 10.318 2.678
463 HG12 ILE 63 2HG1 ILE 63 -5.755 7.975 1.332
464 HG13 ILE 63 1HG1 ILE 63 -7.221 8.754 0.761
465 HG21 ILE 63 1HG2 ILE 63 -4.707 10.358 2.971
466 HG22 ILE 63 2HG2 ILE 63 -4.769 8.711 3.601
467 HG23 ILE 63 3HG2 ILE 63 -5.555 10.021 4.482
468 HD11 ILE 63 3HD1 ILE 63 -5.978 10.805 0.356
469 HD12 ILE 63 1HD1 ILE 63 -5.275 9.444 -0.512
470 HD13 ILE 63 2HD1 ILE 63 -4.508 10.042 0.962
471 H SER 64 H SER 64 -8.304 6.717 1.693
472 HA SER 64 HA SER 64 -11.034 7.667 1.778
473 HG SER 64 HG SER 64 -9.678 9.180 -1.167
474 HB2 SER 64 2HB SER 64 -9.355 6.989 -0.641
475 HB3 SER 64 1HB SER 64 -11.076 7.380 -0.673
Start of MODEL 15
1 H1 GLY 1 1HT GLY 1 -13.555 -0.213 2.688
2 H2 GLY 1 2HT GLY 1 -15.125 -0.229 2.047
3 H3 GLY 1 3HT GLY 1 -13.811 0.283 1.108
4 HA2 GLY 1 1HA GLY 1 -14.098 -2.432 2.218
5 HA3 GLY 1 2HA GLY 1 -14.497 -1.983 0.561
6 H ALA 2 H ALA 2 -12.877 -3.572 -0.004
7 HA ALA 2 HA ALA 2 -10.129 -2.722 0.405
8 HB1 ALA 2 1HB ALA 2 -9.545 -4.782 -0.787
9 HB2 ALA 2 2HB ALA 2 -11.256 -5.096 -1.088
10 HB3 ALA 2 3HB ALA 2 -10.632 -5.106 0.562
11 H MET 3 H MET 3 -12.646 -2.798 -1.974
12 HA MET 3 HA MET 3 -11.514 -0.645 -3.394
13 HB2 MET 3 2HB MET 3 -10.208 -2.489 -4.463
14 HB3 MET 3 1HB MET 3 -11.720 -3.280 -4.896
15 HG2 MET 3 2HG MET 3 -12.322 -1.360 -6.289
16 HG3 MET 3 1HG MET 3 -10.800 -0.582 -5.875
17 HE1 MET 3 3HE MET 3 -8.426 -1.523 -6.588
18 HE2 MET 3 1HE MET 3 -8.188 -2.957 -7.593
19 HE3 MET 3 2HE MET 3 -8.795 -3.132 -5.953
20 H GLY 4 H GLY 4 -13.472 0.285 -2.832
21 HA2 GLY 4 2HA GLY 4 -15.739 -0.856 -4.328
22 HA3 GLY 4 1HA GLY 4 -15.929 -0.239 -2.692
23 H ALA 5 H ALA 5 -14.234 2.032 -2.993
24 HA ALA 5 HA ALA 5 -15.686 3.588 -5.024
25 HB1 ALA 5 1HB ALA 5 -15.895 5.405 -3.375
26 HB2 ALA 5 2HB ALA 5 -15.202 4.359 -2.138
27 HB3 ALA 5 3HB ALA 5 -16.762 3.960 -2.857
28 H LYS 6 H LYS 6 -13.081 2.332 -4.846
29 HA LYS 6 HA LYS 6 -10.905 2.658 -5.182
30 HB2 LYS 6 2HB LYS 6 -11.801 5.451 -5.922
31 HB3 LYS 6 1HB LYS 6 -10.104 5.018 -5.888
32 HG2 LYS 6 2HG LYS 6 -10.880 4.898 -8.146
33 HG3 LYS 6 1HG LYS 6 -10.562 3.265 -7.582
34 HD2 LYS 6 2HD LYS 6 -12.967 2.952 -7.187
35 HD3 LYS 6 1HD LYS 6 -13.268 4.584 -7.785
36 HE2 LYS 6 2HE LYS 6 -12.301 3.962 -9.952
37 HE3 LYS 6 1HE LYS 6 -12.022 2.330 -9.352
38 HZ1 LYS 6 3HZ LYS 6 -14.026 2.485 -10.676
39 HZ2 LYS 6 1HZ LYS 6 -14.663 3.634 -9.641
40 HZ3 LYS 6 2HZ LYS 6 -14.417 2.059 -9.096
41 H GLU 7 H GLU 7 -9.976 2.233 -3.414
42 HA GLU 7 HA GLU 7 -10.231 4.036 -1.155
43 HB2 GLU 7 2HB GLU 7 -8.685 1.485 -1.076
44 HB3 GLU 7 1HB GLU 7 -9.644 2.228 0.175
45 HG2 GLU 7 2HG GLU 7 -10.732 0.771 -2.219
46 HG3 GLU 7 1HG GLU 7 -10.573 0.086 -0.613
47 H TYR 8 H TYR 8 -8.405 5.107 -0.384
48 HA TYR 8 HA TYR 8 -5.921 4.659 -1.891
49 HD1 TYR 8 2HD TYR 8 -5.579 5.838 -4.307
50 HD2 TYR 8 1HD TYR 8 -8.932 7.777 -2.555
51 HE1 TYR 8 2HE TYR 8 -6.636 6.018 -6.525
52 HE2 TYR 8 1HE TYR 8 -9.990 7.960 -4.754
53 HH TYR 8 HH TYR 8 -9.227 8.034 -7.130
54 HB2 TYR 8 2HB TYR 8 -7.038 7.400 -1.246
55 HB3 TYR 8 1HB TYR 8 -5.502 7.064 -2.006
56 H CYS 9 H CYS 9 -4.141 4.730 -0.665
57 HA CYS 9 HA CYS 9 -4.476 5.685 2.086
58 HG CYS 9 HG CYS 9 -1.472 3.408 0.379
59 HB2 CYS 9 2HB CYS 9 -2.817 3.929 2.752
60 HB3 CYS 9 1HB CYS 9 -4.357 3.289 2.201
61 H ARG 10 H ARG 10 -2.860 6.952 2.892
62 HA ARG 10 HA ARG 10 -0.776 7.617 0.942
63 HE ARG 10 HE ARG 10 0.916 12.055 0.661
64 HB2 ARG 10 2HB ARG 10 -2.370 9.487 1.667
65 HB3 ARG 10 1HB ARG 10 -1.615 9.369 3.251
66 HG2 ARG 10 2HG ARG 10 0.534 9.952 2.332
67 HG3 ARG 10 1HG ARG 10 -0.126 9.952 0.699
68 HD2 ARG 10 2HD ARG 10 -1.684 11.779 1.451
69 HD3 ARG 10 1HD ARG 10 -0.756 11.831 2.952
70 HH11 ARG 10 1HH1 ARG 10 -1.294 13.957 2.681
71 HH12 ARG 10 2HH1 ARG 10 -0.503 15.431 2.401
72 HH21 ARG 10 1HH2 ARG 10 1.992 14.130 0.233
73 HH22 ARG 10 2HH2 ARG 10 1.354 15.531 0.955
74 H THR 11 H THR 11 1.253 7.421 1.510
75 HA THR 11 HA THR 11 1.769 5.792 3.766
76 HB THR 11 HB THR 11 4.081 5.789 2.829
77 HG1 THR 11 1HG THR 11 4.455 6.943 0.981
78 HG21 THR 11 3HG2 THR 11 1.830 5.344 0.869
79 HG22 THR 11 1HG2 THR 11 2.364 4.196 2.095
80 HG23 THR 11 2HG2 THR 11 3.444 4.635 0.773
81 H LEU 12 H LEU 12 2.699 6.307 5.626
82 HA LEU 12 HA LEU 12 3.173 9.153 6.156
83 HG LEU 12 HG LEU 12 0.686 7.308 6.954
84 HB2 LEU 12 2HB LEU 12 2.814 6.842 8.062
85 HB3 LEU 12 1HB LEU 12 2.959 8.530 8.512
86 HD11 LEU 12 1HD1 LEU 12 0.650 6.663 9.277
87 HD12 LEU 12 2HD1 LEU 12 -0.635 7.830 8.951
88 HD13 LEU 12 3HD1 LEU 12 0.839 8.345 9.772
89 HD21 LEU 12 3HD2 LEU 12 1.123 10.139 7.905
90 HD22 LEU 12 1HD2 LEU 12 -0.380 9.511 7.229
91 HD23 LEU 12 2HD2 LEU 12 1.069 9.579 6.232
92 H PHE 13 H PHE 13 4.764 6.383 5.393
93 HA PHE 13 HA PHE 13 7.370 7.366 6.235
94 HD1 PHE 13 1HD PHE 13 8.332 6.519 9.088
95 HD2 PHE 13 2HD PHE 13 4.550 4.840 8.133
96 HE1 PHE 13 1HE PHE 13 7.568 6.942 11.382
97 HE2 PHE 13 2HE PHE 13 3.772 5.258 10.426
98 HZ PHE 13 HZ PHE 13 5.277 6.314 12.051
99 HB2 PHE 13 2HB PHE 13 6.423 4.517 6.711
100 HB3 PHE 13 1HB PHE 13 8.013 5.156 7.085
101 HA PRO 14 HA PRO 14 8.011 5.387 2.283
102 HB2 PRO 14 2HB PRO 14 10.696 5.401 2.168
103 HB3 PRO 14 1HB PRO 14 9.778 6.904 2.040
104 HG2 PRO 14 2HG PRO 14 11.280 5.800 4.360
105 HG3 PRO 14 1HG PRO 14 11.108 7.481 3.831
106 HD2 PRO 14 2HD PRO 14 9.658 6.260 5.882
107 HD3 PRO 14 1HD PRO 14 9.199 7.760 5.060
108 H TYR 15 H TYR 15 8.758 3.313 1.529
109 HA TYR 15 HA TYR 15 9.986 1.559 3.452
110 HD1 TYR 15 2HD TYR 15 9.014 -0.173 5.347
111 HD2 TYR 15 1HD TYR 15 7.407 -1.279 1.572
112 HE1 TYR 15 2HE TYR 15 9.370 -2.537 5.895
113 HE2 TYR 15 1HE TYR 15 7.762 -3.642 2.111
114 HH TYR 15 HH TYR 15 9.181 -4.916 3.505
115 HB2 TYR 15 2HB TYR 15 7.574 1.370 3.965
116 HB3 TYR 15 1HB TYR 15 7.256 0.951 2.290
117 H THR 16 H THR 16 11.314 0.269 2.451
118 HA THR 16 HA THR 16 11.079 0.050 -0.449
119 HB THR 16 HB THR 16 13.594 -0.092 1.230
120 HG1 THR 16 1HG THR 16 12.769 1.913 1.403
121 HG21 THR 16 3HG2 THR 16 14.735 0.279 -0.921
122 HG22 THR 16 1HG2 THR 16 13.178 0.309 -1.749
123 HG23 THR 16 2HG2 THR 16 13.742 -1.177 -0.988
124 H GLY 17 H GLY 17 10.729 -1.944 -1.204
125 HA2 GLY 17 2HA GLY 17 10.991 -4.259 0.534
126 HA3 GLY 17 1HA GLY 17 10.356 -4.204 -1.105
127 H THR 18 H THR 18 12.448 -6.011 -0.008
128 HA THR 18 HA THR 18 14.747 -5.019 -1.501
129 HB THR 18 HB THR 18 15.089 -6.014 0.819
130 HG1 THR 18 1HG THR 18 16.663 -6.031 -0.999
131 HG21 THR 18 3HG2 THR 18 14.442 -8.617 -0.585
132 HG22 THR 18 1HG2 THR 18 13.452 -7.837 0.649
133 HG23 THR 18 2HG2 THR 18 15.053 -8.459 1.063
134 H ASN 19 H ASN 19 12.021 -6.399 -2.167
135 HA ASN 19 HA ASN 19 12.978 -7.826 -4.483
136 HB2 ASN 19 2HB ASN 19 11.441 -9.684 -4.101
137 HB3 ASN 19 1HB ASN 19 12.572 -9.580 -2.761
138 HD21 ASN 19 1HD2 ASN 19 11.780 -9.038 -0.723
139 HD22 ASN 19 2HD2 ASN 19 10.100 -9.000 -0.369
140 H GLU 20 H GLU 20 10.997 -8.140 -5.964
141 HA GLU 20 HA GLU 20 9.693 -5.554 -6.011
142 HB2 GLU 20 2HB GLU 20 9.735 -7.757 -8.067
143 HB3 GLU 20 1HB GLU 20 9.069 -6.148 -8.308
144 HG2 GLU 20 2HG GLU 20 11.281 -5.177 -7.963
145 HG3 GLU 20 1HG GLU 20 11.946 -6.789 -7.709
146 H ASP 21 H ASP 21 8.880 -8.552 -4.840
147 HA ASP 21 HA ASP 21 6.055 -8.415 -5.494
148 HB2 ASP 21 2HB ASP 21 7.120 -10.618 -5.282
149 HB3 ASP 21 1HB ASP 21 7.581 -10.266 -3.627
150 H GLU 22 H GLU 22 8.198 -7.403 -3.069
151 HA GLU 22 HA GLU 22 6.074 -6.562 -1.281
152 HB2 GLU 22 2HB GLU 22 8.264 -7.642 -0.511
153 HB3 GLU 22 1HB GLU 22 9.077 -6.199 -1.080
154 HG2 GLU 22 2HG GLU 22 7.942 -4.861 0.520
155 HG3 GLU 22 1HG GLU 22 6.945 -6.228 1.030
156 H LEU 23 H LEU 23 5.496 -4.388 -1.265
157 HA LEU 23 HA LEU 23 6.399 -3.070 -3.665
158 HG LEU 23 HG LEU 23 3.040 -1.534 -4.117
159 HB2 LEU 23 2HB LEU 23 3.973 -3.453 -3.237
160 HB3 LEU 23 1HB LEU 23 4.059 -2.318 -1.916
161 HD11 LEU 23 1HD1 LEU 23 4.027 0.724 -3.970
162 HD12 LEU 23 2HD1 LEU 23 5.287 0.080 -2.915
163 HD13 LEU 23 3HD1 LEU 23 3.601 0.059 -2.395
164 HD21 LEU 23 3HD2 LEU 23 4.558 -0.729 -5.837
165 HD22 LEU 23 1HD2 LEU 23 4.691 -2.472 -5.620
166 HD23 LEU 23 2HD2 LEU 23 5.930 -1.399 -4.960
167 H THR 24 H THR 24 7.491 -1.375 -3.831
168 HA THR 24 HA THR 24 8.660 -0.125 -1.463
169 HB THR 24 HB THR 24 9.441 -0.088 -4.382
170 HG1 THR 24 1HG THR 24 9.763 -2.031 -3.484
171 HG21 THR 24 3HG2 THR 24 10.917 1.073 -1.985
172 HG22 THR 24 1HG2 THR 24 10.206 1.968 -3.315
173 HG23 THR 24 2HG2 THR 24 11.588 0.922 -3.606
174 H PHE 25 H PHE 25 7.933 1.804 -0.853
175 HA PHE 25 HA PHE 25 6.958 3.643 -2.878
176 HD1 PHE 25 2HD PHE 25 6.155 4.448 1.068
177 HD2 PHE 25 1HD PHE 25 4.320 1.046 -0.678
178 HE1 PHE 25 2HE PHE 25 5.699 3.546 3.309
179 HE2 PHE 25 1HE PHE 25 3.855 0.150 1.540
180 HZ PHE 25 HZ PHE 25 4.543 1.390 3.548
181 HB2 PHE 25 2HB PHE 25 5.123 4.374 -1.348
182 HB3 PHE 25 1HB PHE 25 4.922 2.778 -2.042
183 H ARG 26 H ARG 26 6.879 5.839 -2.224
184 HA ARG 26 HA ARG 26 9.011 6.558 -0.368
185 HE ARG 26 HE ARG 26 5.537 9.463 -4.421
186 HB2 ARG 26 2HB ARG 26 8.804 8.812 -1.344
187 HB3 ARG 26 1HB ARG 26 9.022 7.620 -2.611
188 HG2 ARG 26 2HG ARG 26 6.664 7.707 -3.146
189 HG3 ARG 26 1HG ARG 26 6.380 8.783 -1.777
190 HD2 ARG 26 2HD ARG 26 7.771 10.496 -2.820
191 HD3 ARG 26 1HD ARG 26 8.092 9.411 -4.175
192 HH11 ARG 26 1HH1 ARG 26 7.424 12.283 -3.386
193 HH12 ARG 26 2HH1 ARG 26 6.355 13.408 -4.061
194 HH21 ARG 26 1HH2 ARG 26 4.125 10.897 -5.271
195 HH22 ARG 26 2HH2 ARG 26 4.335 12.597 -5.220
196 H GLU 27 H GLU 27 8.432 8.608 0.990
197 HA GLU 27 HA GLU 27 6.076 8.048 2.503
198 HB2 GLU 27 2HB GLU 27 8.316 8.796 3.379
199 HB3 GLU 27 1HB GLU 27 7.991 10.366 2.669
200 HG2 GLU 27 2HG GLU 27 5.929 10.469 4.065
201 HG3 GLU 27 1HG GLU 27 6.483 9.002 4.866
202 H GLY 28 H GLY 28 4.224 9.372 2.588
203 HA2 GLY 28 2HA GLY 28 2.852 11.171 2.185
204 HA3 GLY 28 1HA GLY 28 4.172 11.952 1.332
205 H GLU 29 H GLU 29 3.377 8.770 0.358
206 HA GLU 29 HA GLU 29 2.448 9.908 -2.159
207 HB2 GLU 29 2HB GLU 29 4.419 8.399 -2.199
208 HB3 GLU 29 1HB GLU 29 3.387 7.126 -1.547
209 HG2 GLU 29 2HG GLU 29 3.727 6.917 -3.959
210 HG3 GLU 29 1HG GLU 29 2.032 7.127 -3.518
211 H ILE 30 H ILE 30 0.691 9.109 -3.170
212 HA ILE 30 HA ILE 30 -1.386 7.984 -1.431
213 HB ILE 30 HB ILE 30 -1.588 9.302 -4.162
214 HG12 ILE 30 2HG1 ILE 30 -1.012 10.848 -2.288
215 HG13 ILE 30 1HG1 ILE 30 -2.563 11.209 -3.058
216 HG21 ILE 30 1HG2 ILE 30 -3.339 7.644 -3.876
217 HG22 ILE 30 2HG2 ILE 30 -4.030 9.265 -3.811
218 HG23 ILE 30 3HG2 ILE 30 -3.783 8.354 -2.324
219 HD11 ILE 30 3HD1 ILE 30 -2.143 9.794 -0.433
220 HD12 ILE 30 1HD1 ILE 30 -3.707 10.125 -1.178
221 HD13 ILE 30 2HD1 ILE 30 -2.687 11.459 -0.648
222 H ILE 31 H ILE 31 -1.736 5.919 -1.670
223 HA ILE 31 HA ILE 31 -0.972 4.616 -4.193
224 HB ILE 31 HB ILE 31 -1.126 3.424 -1.400
225 HG12 ILE 31 2HG1 ILE 31 1.266 4.014 -3.153
226 HG13 ILE 31 1HG1 ILE 31 0.818 4.884 -1.693
227 HG21 ILE 31 1HG2 ILE 31 -1.743 1.778 -3.084
228 HG22 ILE 31 2HG2 ILE 31 -0.168 1.388 -2.392
229 HG23 ILE 31 3HG2 ILE 31 -0.272 2.130 -3.992
230 HD11 ILE 31 3HD1 ILE 31 1.663 1.998 -1.849
231 HD12 ILE 31 1HD1 ILE 31 1.208 2.860 -0.378
232 HD13 ILE 31 2HD1 ILE 31 2.643 3.348 -1.275
233 H HIS 32 H HIS 32 -2.491 3.333 -5.181
234 HA HIS 32 HA HIS 32 -5.207 3.584 -4.196
235 HD1 HIS 32 1HD HIS 32 -5.658 1.149 -8.181
236 HD2 HIS 32 2HD HIS 32 -7.643 3.452 -5.350
237 HE1 HIS 32 1HE HIS 32 -8.115 0.583 -8.403
238 HB2 HIS 32 2HB HIS 32 -4.790 4.049 -6.592
239 HB3 HIS 32 1HB HIS 32 -4.078 2.453 -6.782
240 H LEU 33 H LEU 33 -6.107 2.024 -3.101
241 HA LEU 33 HA LEU 33 -4.531 -0.259 -2.358
242 HG LEU 33 HG LEU 33 -5.156 -0.880 0.085
243 HB2 LEU 33 2HB LEU 33 -6.068 1.303 -0.920
244 HB3 LEU 33 1HB LEU 33 -7.345 0.331 -1.618
245 HD11 LEU 33 1HD1 LEU 33 -7.883 0.109 0.893
246 HD12 LEU 33 2HD1 LEU 33 -6.337 0.822 1.358
247 HD13 LEU 33 3HD1 LEU 33 -6.765 -0.796 1.912
248 HD21 LEU 33 3HD2 LEU 33 -7.933 -1.823 -0.607
249 HD22 LEU 33 1HD2 LEU 33 -6.740 -2.684 0.363
250 HD23 LEU 33 2HD2 LEU 33 -6.449 -2.411 -1.355
251 H ILE 34 H ILE 34 -4.826 -2.274 -3.075
252 HA ILE 34 HA ILE 34 -7.009 -2.722 -4.967
253 HB ILE 34 HB ILE 34 -4.356 -4.178 -4.757
254 HG12 ILE 34 2HG1 ILE 34 -5.488 -2.309 -6.864
255 HG13 ILE 34 1HG1 ILE 34 -4.095 -2.042 -5.830
256 HG21 ILE 34 1HG2 ILE 34 -6.090 -5.781 -5.361
257 HG22 ILE 34 2HG2 ILE 34 -5.039 -5.460 -6.742
258 HG23 ILE 34 3HG2 ILE 34 -6.640 -4.725 -6.664
259 HD11 ILE 34 3HD1 ILE 34 -2.841 -3.727 -6.964
260 HD12 ILE 34 1HD1 ILE 34 -3.511 -2.610 -8.157
261 HD13 ILE 34 2HD1 ILE 34 -4.247 -4.194 -7.917
262 H SER 35 H SER 35 -5.286 -4.159 -2.219
263 HA SER 35 HA SER 35 -7.699 -5.602 -1.560
264 HG SER 35 HG SER 35 -7.304 -6.493 -3.556
265 HB2 SER 35 2HB SER 35 -5.105 -7.049 -2.120
266 HB3 SER 35 1HB SER 35 -6.535 -7.793 -1.418
267 H LYS 36 H LYS 36 -7.991 -5.613 0.547
268 HA LYS 36 HA LYS 36 -5.820 -4.893 2.348
269 HB2 LYS 36 2HB LYS 36 -8.794 -5.274 2.784
270 HB3 LYS 36 1HB LYS 36 -7.673 -5.056 4.117
271 HG2 LYS 36 2HG LYS 36 -7.058 -2.863 3.259
272 HG3 LYS 36 1HG LYS 36 -8.150 -3.045 1.899
273 HD2 LYS 36 2HD LYS 36 -10.054 -3.162 3.433
274 HD3 LYS 36 1HD LYS 36 -8.955 -3.043 4.810
275 HE2 LYS 36 2HE LYS 36 -8.213 -0.832 3.994
276 HE3 LYS 36 1HE LYS 36 -9.353 -0.964 2.660
277 HZ1 LYS 36 3HZ LYS 36 -10.116 -0.906 5.538
278 HZ2 LYS 36 1HZ LYS 36 -11.178 -0.902 4.231
279 HZ3 LYS 36 2HZ LYS 36 -10.163 0.412 4.514
280 H GLU 37 H GLU 37 -7.580 -7.601 1.222
281 HA GLU 37 HA GLU 37 -6.478 -9.301 3.286
282 HB2 GLU 37 2HB GLU 37 -8.451 -9.927 1.081
283 HB3 GLU 37 1HB GLU 37 -7.782 -11.125 2.165
284 HG2 GLU 37 2HG GLU 37 -9.920 -10.650 2.986
285 HG3 GLU 37 1HG GLU 37 -8.799 -9.804 4.042
286 H THR 38 H THR 38 -4.470 -9.870 2.857
287 HA THR 38 HA THR 38 -3.778 -10.621 0.106
288 HB THR 38 HB THR 38 -1.399 -10.361 0.948
289 HG1 THR 38 1HG THR 38 -2.197 -8.668 2.974
290 HG21 THR 38 3HG2 THR 38 -3.200 -7.926 1.015
291 HG22 THR 38 1HG2 THR 38 -2.471 -8.627 -0.429
292 HG23 THR 38 2HG2 THR 38 -1.451 -7.888 0.808
293 H GLY 39 H GLY 39 -4.647 -11.842 2.972
294 HA2 GLY 39 2HA GLY 39 -4.783 -14.253 3.280
295 HA3 GLY 39 1HA GLY 39 -3.175 -14.370 2.563
296 H GLU 40 H GLU 40 -2.612 -11.810 4.088
297 HA GLU 40 HA GLU 40 -2.187 -12.951 6.759
298 HB2 GLU 40 2HB GLU 40 -0.265 -11.296 5.127
299 HB3 GLU 40 1HB GLU 40 -0.033 -11.750 6.808
300 HG2 GLU 40 2HG GLU 40 0.076 -14.085 6.180
301 HG3 GLU 40 1HG GLU 40 -0.229 -13.659 4.496
302 H ALA 41 H ALA 41 -2.892 -11.636 8.311
303 HA ALA 41 HA ALA 41 -4.064 -9.120 7.599
304 HB1 ALA 41 1HB ALA 41 -5.145 -10.565 9.249
305 HB2 ALA 41 2HB ALA 41 -4.720 -9.008 9.964
306 HB3 ALA 41 3HB ALA 41 -3.731 -10.431 10.291
307 H GLY 42 H GLY 42 -2.928 -7.360 7.413
308 HA2 GLY 42 2HA GLY 42 -1.585 -5.756 8.783
309 HA3 GLY 42 1HA GLY 42 -0.449 -7.092 8.986
310 H TRP 43 H TRP 43 -1.321 -7.811 6.114
311 HA TRP 43 HA TRP 43 0.532 -5.951 4.841
312 HD1 TRP 43 HD TRP 43 1.014 -9.775 6.398
313 HE1 TRP 43 1HE TRP 43 3.454 -9.899 7.199
314 HE3 TRP 43 3HE TRP 43 3.121 -6.486 3.102
315 HZ2 TRP 43 2HZ TRP 43 5.952 -8.745 6.516
316 HZ3 TRP 43 3HZ TRP 43 5.535 -6.056 3.242
317 HH2 TRP 43 HH TRP 43 6.918 -7.164 4.914
318 HB2 TRP 43 2HB TRP 43 -0.094 -8.833 4.167
319 HB3 TRP 43 1HB TRP 43 0.880 -7.777 3.156
320 H TRP 44 H TRP 44 -0.271 -4.669 3.418
321 HA TRP 44 HA TRP 44 -2.909 -5.231 2.255
322 HD1 TRP 44 HD TRP 44 -3.703 -4.997 4.382
323 HE1 TRP 44 1HE TRP 44 -5.522 -3.882 5.799
324 HE3 TRP 44 3HE TRP 44 -3.250 -0.210 2.663
325 HZ2 TRP 44 2HZ TRP 44 -6.625 -1.312 6.155
326 HZ3 TRP 44 3HZ TRP 44 -4.732 1.519 3.597
327 HH2 TRP 44 HH TRP 44 -6.392 0.964 5.306
328 HB2 TRP 44 2HB TRP 44 -1.472 -2.697 2.949
329 HB3 TRP 44 1HB TRP 44 -2.661 -2.699 1.658
330 H LYS 45 H LYS 45 -3.201 -4.767 0.073
331 HA LYS 45 HA LYS 45 -0.720 -4.545 -1.440
332 HB2 LYS 45 2HB LYS 45 -1.708 -6.720 -1.918
333 HB3 LYS 45 1HB LYS 45 -3.268 -5.974 -2.227
334 HG2 LYS 45 2HG LYS 45 -2.433 -4.845 -4.184
335 HG3 LYS 45 1HG LYS 45 -0.800 -5.402 -3.856
336 HD2 LYS 45 2HD LYS 45 -3.122 -7.219 -4.459
337 HD3 LYS 45 1HD LYS 45 -1.985 -6.631 -5.672
338 HE2 LYS 45 2HE LYS 45 -0.143 -7.637 -4.313
339 HE3 LYS 45 1HE LYS 45 -1.382 -8.368 -3.290
340 HZ1 LYS 45 3HZ LYS 45 -0.632 -9.900 -4.997
341 HZ2 LYS 45 1HZ LYS 45 -1.060 -8.792 -6.198
342 HZ3 LYS 45 2HZ LYS 45 -2.246 -9.513 -5.236
343 H GLY 46 H GLY 46 -0.537 -2.899 -2.686
344 HA2 GLY 46 2HA GLY 46 -2.869 -1.491 -3.664
345 HA3 GLY 46 1HA GLY 46 -1.654 -0.581 -2.747
346 H GLU 47 H GLU 47 -2.076 0.137 -5.304
347 HA GLU 47 HA GLU 47 0.215 -1.064 -6.654
348 HB2 GLU 47 2HB GLU 47 -1.954 -1.516 -7.728
349 HB3 GLU 47 1HB GLU 47 -2.203 0.207 -7.937
350 HG2 GLU 47 2HG GLU 47 0.195 -1.142 -9.098
351 HG3 GLU 47 1HG GLU 47 -1.352 -1.270 -9.917
352 H LEU 48 H LEU 48 1.795 0.122 -7.143
353 HA LEU 48 HA LEU 48 1.601 2.918 -7.666
354 HG LEU 48 HG LEU 48 4.311 3.836 -6.549
355 HB2 LEU 48 2HB LEU 48 1.797 2.884 -5.188
356 HB3 LEU 48 1HB LEU 48 3.261 1.932 -5.343
357 HD11 LEU 48 1HD1 LEU 48 1.825 5.312 -5.721
358 HD12 LEU 48 2HD1 LEU 48 2.348 4.962 -7.372
359 HD13 LEU 48 3HD1 LEU 48 3.290 6.054 -6.361
360 HD21 LEU 48 3HD2 LEU 48 3.304 4.440 -3.774
361 HD22 LEU 48 1HD2 LEU 48 4.700 5.177 -4.558
362 HD23 LEU 48 2HD2 LEU 48 4.711 3.456 -4.183
363 H ASN 49 H ASN 49 3.206 3.467 -9.033
364 HA ASN 49 HA ASN 49 5.039 3.411 -10.376
365 HB2 ASN 49 2HB ASN 49 6.111 1.110 -8.694
366 HB3 ASN 49 1HB ASN 49 7.013 2.014 -9.897
367 HD21 ASN 49 1HD2 ASN 49 5.836 1.904 -6.710
368 HD22 ASN 49 2HD2 ASN 49 6.573 3.352 -6.127
369 H GLY 50 H GLY 50 2.653 1.422 -10.397
370 HA2 GLY 50 2HA GLY 50 1.849 0.353 -12.258
371 HA3 GLY 50 1HA GLY 50 3.499 0.192 -12.870
372 H LYS 51 H LYS 51 3.068 -0.515 -9.555
373 HA LYS 51 HA LYS 51 3.224 -3.382 -10.170
374 HB2 LYS 51 2HB LYS 51 4.613 -2.052 -7.880
375 HB3 LYS 51 1HB LYS 51 4.841 -3.675 -8.499
376 HG2 LYS 51 2HG LYS 51 5.644 -1.116 -9.801
377 HG3 LYS 51 1HG LYS 51 6.667 -2.312 -8.969
378 HD2 LYS 51 2HD LYS 51 5.016 -2.918 -11.384
379 HD3 LYS 51 1HD LYS 51 6.677 -2.363 -11.503
380 HE2 LYS 51 2HE LYS 51 7.245 -4.371 -9.963
381 HE3 LYS 51 1HE LYS 51 5.591 -4.895 -10.233
382 HZ1 LYS 51 3HZ LYS 51 7.095 -6.003 -11.723
383 HZ2 LYS 51 1HZ LYS 51 7.651 -4.532 -12.310
384 HZ3 LYS 51 2HZ LYS 51 6.065 -4.998 -12.616
385 H GLU 52 H GLU 52 2.536 -4.593 -8.569
386 HA GLU 52 HA GLU 52 1.101 -3.358 -6.429
387 HB2 GLU 52 2HB GLU 52 -0.835 -5.013 -6.690
388 HB3 GLU 52 1HB GLU 52 -0.785 -3.705 -7.847
389 HG2 GLU 52 2HG GLU 52 -1.467 -5.667 -8.994
390 HG3 GLU 52 1HG GLU 52 0.178 -5.325 -9.504
391 H GLY 53 H GLY 53 1.466 -4.226 -4.568
392 HA2 GLY 53 2HA GLY 53 2.431 -6.926 -4.390
393 HA3 GLY 53 1HA GLY 53 3.645 -5.686 -4.089
394 H VAL 54 H VAL 54 3.725 -6.565 -1.962
395 HA VAL 54 HA VAL 54 1.399 -5.732 -0.391
396 HB VAL 54 HB VAL 54 2.047 -7.393 1.315
397 HG11 VAL 54 1HG1 VAL 54 0.369 -7.946 -0.359
398 HG12 VAL 54 2HG1 VAL 54 1.299 -9.364 0.119
399 HG13 VAL 54 3HG1 VAL 54 1.629 -8.576 -1.426
400 HG21 VAL 54 3HG2 VAL 54 4.431 -7.577 0.823
401 HG22 VAL 54 1HG2 VAL 54 4.068 -8.323 -0.734
402 HG23 VAL 54 2HG2 VAL 54 3.662 -9.165 0.764
403 H PHE 55 H PHE 55 1.689 -4.716 1.496
404 HA PHE 55 HA PHE 55 4.330 -4.026 2.369
405 HD1 PHE 55 1HD PHE 55 1.855 -0.723 3.338
406 HD2 PHE 55 2HD PHE 55 1.834 -2.329 -0.607
407 HE1 PHE 55 1HE PHE 55 -0.320 0.347 2.916
408 HE2 PHE 55 2HE PHE 55 -0.338 -1.263 -1.028
409 HZ PHE 55 HZ PHE 55 -1.419 0.073 0.728
410 HB2 PHE 55 2HB PHE 55 3.904 -1.613 2.318
411 HB3 PHE 55 1HB PHE 55 3.866 -2.307 0.697
412 HA PRO 56 HA PRO 56 2.143 -4.235 6.212
413 HB2 PRO 56 2HB PRO 56 3.864 -2.200 7.431
414 HB3 PRO 56 1HB PRO 56 3.802 -3.930 7.757
415 HG2 PRO 56 2HG PRO 56 5.905 -2.779 6.510
416 HG3 PRO 56 1HG PRO 56 5.368 -4.428 6.145
417 HD2 PRO 56 2HD PRO 56 4.825 -1.888 4.649
418 HD3 PRO 56 1HD PRO 56 5.291 -3.485 4.024
419 H ASP 57 H ASP 57 0.326 -3.380 6.838
420 HA ASP 57 HA ASP 57 -0.744 -1.005 5.744
421 HB2 ASP 57 2HB ASP 57 -2.760 -1.506 6.905
422 HB3 ASP 57 1HB ASP 57 -2.051 -3.055 6.478
423 H ASN 58 H ASN 58 1.103 -1.492 8.560
424 HA ASN 58 HA ASN 58 0.083 0.724 10.087
425 HB2 ASN 58 2HB ASN 58 2.504 -1.035 10.419
426 HB3 ASN 58 1HB ASN 58 2.263 0.377 11.422
427 HD21 ASN 58 1HD2 ASN 58 -0.461 -1.638 10.386
428 HD22 ASN 58 2HD2 ASN 58 -0.741 -2.296 11.938
429 H PHE 59 H PHE 59 1.942 0.700 7.342
430 HA PHE 59 HA PHE 59 3.509 3.038 8.155
431 HD1 PHE 59 1HD PHE 59 3.969 -0.299 8.100
432 HD2 PHE 59 2HD PHE 59 6.850 2.517 6.751
433 HE1 PHE 59 1HE PHE 59 5.697 -1.429 9.442
434 HE2 PHE 59 2HE PHE 59 8.576 1.401 8.097
435 HZ PHE 59 HZ PHE 59 8.005 -0.570 9.442
436 HB2 PHE 59 2HB PHE 59 3.811 1.142 5.830
437 HB3 PHE 59 1HB PHE 59 4.704 2.655 5.927
438 H ALA 60 H ALA 60 0.566 2.541 6.894
439 HA ALA 60 HA ALA 60 0.615 5.055 5.432
440 HB1 ALA 60 1HB ALA 60 -0.691 4.121 3.587
441 HB2 ALA 60 2HB ALA 60 -0.597 2.519 4.317
442 HB3 ALA 60 3HB ALA 60 0.867 3.303 3.721
443 H VAL 61 H VAL 61 -1.485 6.015 5.269
444 HA VAL 61 HA VAL 61 -3.439 4.868 7.133
445 HB VAL 61 HB VAL 61 -2.340 6.900 8.080
446 HG11 VAL 61 1HG1 VAL 61 -3.530 8.367 5.744
447 HG12 VAL 61 2HG1 VAL 61 -1.816 8.112 6.071
448 HG13 VAL 61 3HG1 VAL 61 -2.778 9.123 7.150
449 HG21 VAL 61 3HG2 VAL 61 -4.391 8.154 8.669
450 HG22 VAL 61 1HG2 VAL 61 -4.591 6.405 8.801
451 HG23 VAL 61 2HG2 VAL 61 -5.255 7.266 7.414
452 H GLN 62 H GLN 62 -5.582 4.880 6.437
453 HA GLN 62 HA GLN 62 -5.820 5.154 3.611
454 HB2 GLN 62 2HB GLN 62 -6.764 3.176 4.606
455 HB3 GLN 62 1HB GLN 62 -7.764 4.141 5.685
456 HG2 GLN 62 2HG GLN 62 -9.146 4.847 3.941
457 HG3 GLN 62 1HG GLN 62 -8.005 4.324 2.716
458 HE21 GLN 62 1HE2 GLN 62 -9.628 3.242 1.743
459 HE22 GLN 62 2HE2 GLN 62 -10.212 1.707 2.272
460 H ILE 63 H ILE 63 -6.578 6.703 2.535
461 HA ILE 63 HA ILE 63 -7.474 9.170 3.853
462 HB ILE 63 HB ILE 63 -6.759 8.663 0.953
463 HG12 ILE 63 2HG1 ILE 63 -4.874 8.089 2.333
464 HG13 ILE 63 1HG1 ILE 63 -4.549 9.564 1.436
465 HG21 ILE 63 1HG2 ILE 63 -6.377 11.080 0.837
466 HG22 ILE 63 2HG2 ILE 63 -6.910 11.236 2.509
467 HG23 ILE 63 3HG2 ILE 63 -8.042 10.688 1.271
468 HD11 ILE 63 3HD1 ILE 63 -3.700 9.751 3.717
469 HD12 ILE 63 1HD1 ILE 63 -5.302 9.388 4.359
470 HD13 ILE 63 2HD1 ILE 63 -5.027 10.884 3.469
471 H SER 64 H SER 64 -8.478 6.660 1.668
472 HA SER 64 HA SER 64 -11.169 7.716 1.580
473 HG SER 64 HG SER 64 -11.475 6.405 -1.621
474 HB2 SER 64 2HB SER 64 -9.979 8.382 -0.542
475 HB3 SER 64 1HB SER 64 -9.588 6.686 -0.810
Start of MODEL 16
1 H1 GLY 1 1HT GLY 1 -11.683 -10.013 4.580
2 H2 GLY 1 2HT GLY 1 -12.392 -8.491 4.707
3 H3 GLY 1 3HT GLY 1 -10.733 -8.658 4.936
4 HA2 GLY 1 1HA GLY 1 -10.442 -9.264 2.636
5 HA3 GLY 1 2HA GLY 1 -12.185 -9.140 2.415
6 H ALA 2 H ALA 2 -11.564 -7.519 0.764
7 HA ALA 2 HA ALA 2 -10.851 -4.966 1.987
8 HB1 ALA 2 1HB ALA 2 -9.495 -5.607 0.026
9 HB2 ALA 2 2HB ALA 2 -10.438 -4.153 -0.282
10 HB3 ALA 2 3HB ALA 2 -10.963 -5.698 -0.951
11 H MET 3 H MET 3 -12.574 -3.985 2.722
12 HA MET 3 HA MET 3 -15.204 -4.538 1.792
13 HB2 MET 3 2HB MET 3 -15.952 -2.967 3.502
14 HB3 MET 3 1HB MET 3 -14.745 -4.056 4.165
15 HG2 MET 3 2HG MET 3 -14.230 -1.223 3.264
16 HG3 MET 3 1HG MET 3 -14.485 -1.727 4.932
17 HE1 MET 3 3HE MET 3 -11.986 -0.032 3.797
18 HE2 MET 3 1HE MET 3 -10.657 -0.769 4.694
19 HE3 MET 3 2HE MET 3 -12.185 -0.431 5.504
20 H GLY 4 H GLY 4 -12.911 -2.623 0.667
21 HA2 GLY 4 2HA GLY 4 -14.804 -1.125 -0.943
22 HA3 GLY 4 1HA GLY 4 -13.556 -0.225 -0.077
23 H ALA 5 H ALA 5 -13.980 -0.585 -2.951
24 HA ALA 5 HA ALA 5 -11.426 -1.886 -3.585
25 HB1 ALA 5 1HB ALA 5 -13.837 -1.500 -5.360
26 HB2 ALA 5 2HB ALA 5 -13.349 -3.012 -4.597
27 HB3 ALA 5 3HB ALA 5 -12.324 -2.277 -5.831
28 H LYS 6 H LYS 6 -12.410 0.993 -2.860
29 HA LYS 6 HA LYS 6 -10.826 2.306 -4.929
30 HB2 LYS 6 2HB LYS 6 -12.456 4.161 -5.007
31 HB3 LYS 6 1HB LYS 6 -13.123 2.661 -5.626
32 HG2 LYS 6 2HG LYS 6 -14.316 2.320 -3.513
33 HG3 LYS 6 1HG LYS 6 -13.638 3.826 -2.891
34 HD2 LYS 6 2HD LYS 6 -15.436 3.566 -5.303
35 HD3 LYS 6 1HD LYS 6 -15.937 4.119 -3.706
36 HE2 LYS 6 2HE LYS 6 -14.411 6.022 -3.880
37 HE3 LYS 6 1HE LYS 6 -13.884 5.467 -5.467
38 HZ1 LYS 6 3HZ LYS 6 -15.487 7.183 -5.709
39 HZ2 LYS 6 1HZ LYS 6 -16.615 6.376 -4.747
40 HZ3 LYS 6 2HZ LYS 6 -16.158 5.752 -6.249
41 H GLU 7 H GLU 7 -10.095 1.481 -2.412
42 HA GLU 7 HA GLU 7 -10.251 3.821 -0.691
43 HB2 GLU 7 2HB GLU 7 -8.883 1.209 -0.043
44 HB3 GLU 7 1HB GLU 7 -9.454 2.410 1.095
45 HG2 GLU 7 2HG GLU 7 -11.026 0.393 -0.462
46 HG3 GLU 7 1HG GLU 7 -10.976 0.658 1.278
47 H TYR 8 H TYR 8 -8.561 5.160 -0.489
48 HA TYR 8 HA TYR 8 -6.047 4.251 -1.678
49 HD1 TYR 8 2HD TYR 8 -9.125 6.602 -2.590
50 HD2 TYR 8 1HD TYR 8 -5.295 5.921 -4.303
51 HE1 TYR 8 2HE TYR 8 -10.148 6.494 -4.816
52 HE2 TYR 8 1HE TYR 8 -6.312 5.808 -6.536
53 HH TYR 8 HH TYR 8 -9.487 6.807 -7.107
54 HB2 TYR 8 2HB TYR 8 -6.939 7.130 -1.342
55 HB3 TYR 8 1HB TYR 8 -5.459 6.568 -2.054
56 H CYS 9 H CYS 9 -4.180 4.847 -0.641
57 HA CYS 9 HA CYS 9 -4.496 5.712 2.107
58 HG CYS 9 HG CYS 9 -3.216 3.094 -0.502
59 HB2 CYS 9 2HB CYS 9 -2.742 3.971 2.701
60 HB3 CYS 9 1HB CYS 9 -4.349 3.355 2.339
61 H ARG 10 H ARG 10 -2.925 7.040 2.787
62 HA ARG 10 HA ARG 10 -0.938 7.729 0.769
63 HE ARG 10 HE ARG 10 1.728 11.561 2.774
64 HB2 ARG 10 2HB ARG 10 -2.211 9.682 1.515
65 HB3 ARG 10 1HB ARG 10 -1.826 9.323 3.200
66 HG2 ARG 10 2HG ARG 10 0.561 9.644 2.704
67 HG3 ARG 10 1HG ARG 10 0.149 10.050 1.047
68 HD2 ARG 10 2HD ARG 10 -0.952 12.045 1.747
69 HD3 ARG 10 1HD ARG 10 -0.827 11.569 3.445
70 HH11 ARG 10 1HH1 ARG 10 -0.695 14.082 2.204
71 HH12 ARG 10 2HH1 ARG 10 0.470 15.321 2.077
72 HH21 ARG 10 1HH2 ARG 10 3.235 13.209 2.710
73 HH22 ARG 10 2HH2 ARG 10 2.758 14.836 2.402
74 H THR 11 H THR 11 1.130 7.546 1.158
75 HA THR 11 HA THR 11 2.182 5.700 2.965
76 HB THR 11 HB THR 11 4.292 6.701 2.134
77 HG1 THR 11 1HG THR 11 2.951 8.795 2.086
78 HG21 THR 11 3HG2 THR 11 3.061 5.027 0.766
79 HG22 THR 11 1HG2 THR 11 3.872 6.222 -0.247
80 HG23 THR 11 2HG2 THR 11 2.134 6.334 0.028
81 H LEU 12 H LEU 12 3.144 6.038 5.024
82 HA LEU 12 HA LEU 12 3.215 8.832 5.978
83 HG LEU 12 HG LEU 12 0.937 6.743 6.663
84 HB2 LEU 12 2HB LEU 12 3.169 6.261 7.557
85 HB3 LEU 12 1HB LEU 12 3.240 7.864 8.243
86 HD11 LEU 12 1HD1 LEU 12 -0.220 6.722 8.840
87 HD12 LEU 12 2HD1 LEU 12 1.260 7.257 9.627
88 HD13 LEU 12 3HD1 LEU 12 1.196 5.674 8.852
89 HD21 LEU 12 3HD2 LEU 12 -0.249 8.756 7.467
90 HD22 LEU 12 1HD2 LEU 12 1.104 9.146 6.408
91 HD23 LEU 12 2HD2 LEU 12 1.259 9.349 8.154
92 H PHE 13 H PHE 13 5.099 6.169 5.038
93 HA PHE 13 HA PHE 13 7.534 7.353 6.070
94 HD1 PHE 13 2HD PHE 13 8.318 7.217 8.717
95 HD2 PHE 13 1HD PHE 13 5.015 4.586 8.284
96 HE1 PHE 13 2HE PHE 13 7.462 7.938 10.908
97 HE2 PHE 13 1HE PHE 13 4.149 5.299 10.474
98 HZ PHE 13 HZ PHE 13 5.375 6.978 11.790
99 HB2 PHE 13 2HB PHE 13 6.749 4.499 6.753
100 HB3 PHE 13 1HB PHE 13 8.303 5.238 7.097
101 HA PRO 14 HA PRO 14 8.842 5.475 2.233
102 HB2 PRO 14 2HB PRO 14 11.544 5.569 2.605
103 HB3 PRO 14 1HB PRO 14 10.593 6.987 2.155
104 HG2 PRO 14 2HG PRO 14 11.654 6.172 4.814
105 HG3 PRO 14 1HG PRO 14 11.541 7.793 4.107
106 HD2 PRO 14 2HD PRO 14 9.791 6.821 5.973
107 HD3 PRO 14 1HD PRO 14 9.360 8.054 4.772
108 H TYR 15 H TYR 15 8.821 3.405 1.818
109 HA TYR 15 HA TYR 15 10.107 1.476 3.628
110 HD1 TYR 15 2HD TYR 15 8.441 -0.267 5.514
111 HD2 TYR 15 1HD TYR 15 7.395 -0.862 1.438
112 HE1 TYR 15 2HE TYR 15 8.236 -2.677 5.924
113 HE2 TYR 15 1HE TYR 15 7.176 -3.276 1.837
114 HH TYR 15 HH TYR 15 7.970 -4.976 3.413
115 HB2 TYR 15 2HB TYR 15 7.705 1.582 4.125
116 HB3 TYR 15 1HB TYR 15 7.326 1.362 2.429
117 H THR 16 H THR 16 11.228 -0.072 2.511
118 HA THR 16 HA THR 16 10.942 -0.021 -0.400
119 HB THR 16 HB THR 16 13.462 -0.557 1.196
120 HG1 THR 16 1HG THR 16 12.562 1.645 1.085
121 HG21 THR 16 3HG2 THR 16 13.422 -1.735 -0.972
122 HG22 THR 16 1HG2 THR 16 14.593 -0.416 -0.999
123 HG23 THR 16 2HG2 THR 16 13.026 -0.224 -1.787
124 H GLY 17 H GLY 17 10.549 -1.859 -1.387
125 HA2 GLY 17 2HA GLY 17 10.355 -4.249 0.260
126 HA3 GLY 17 1HA GLY 17 9.601 -3.983 -1.313
127 H THR 18 H THR 18 11.590 -6.003 -0.104
128 HA THR 18 HA THR 18 13.805 -5.586 -1.978
129 HB THR 18 HB THR 18 14.799 -7.632 -0.885
130 HG1 THR 18 1HG THR 18 13.166 -7.555 1.301
131 HG21 THR 18 3HG2 THR 18 14.000 -5.416 1.012
132 HG22 THR 18 1HG2 THR 18 15.404 -5.413 -0.053
133 HG23 THR 18 2HG2 THR 18 15.312 -6.562 1.283
134 H ASN 19 H ASN 19 11.153 -7.530 -1.203
135 HA ASN 19 HA ASN 19 11.414 -9.438 -3.320
136 HB2 ASN 19 2HB ASN 19 10.381 -10.174 -1.357
137 HB3 ASN 19 1HB ASN 19 9.370 -8.737 -1.243
138 HD21 ASN 19 1HD2 ASN 19 7.559 -9.835 -1.011
139 HD22 ASN 19 2HD2 ASN 19 6.813 -10.813 -2.234
140 H GLU 20 H GLU 20 10.202 -9.471 -5.142
141 HA GLU 20 HA GLU 20 9.667 -7.035 -6.430
142 HB2 GLU 20 2HB GLU 20 10.257 -9.092 -7.621
143 HB3 GLU 20 1HB GLU 20 8.733 -9.814 -7.133
144 HG2 GLU 20 2HG GLU 20 7.550 -8.041 -8.336
145 HG3 GLU 20 1HG GLU 20 9.107 -7.431 -8.891
146 H ASP 21 H ASP 21 7.646 -9.315 -4.728
147 HA ASP 21 HA ASP 21 5.215 -7.924 -5.499
148 HB2 ASP 21 2HB ASP 21 5.283 -10.434 -5.309
149 HB3 ASP 21 1HB ASP 21 5.512 -10.254 -3.577
150 H GLU 22 H GLU 22 7.529 -7.125 -3.483
151 HA GLU 22 HA GLU 22 5.743 -6.155 -1.374
152 HB2 GLU 22 2HB GLU 22 7.726 -7.517 -0.677
153 HB3 GLU 22 1HB GLU 22 8.774 -6.341 -1.449
154 HG2 GLU 22 2HG GLU 22 8.044 -4.652 0.150
155 HG3 GLU 22 1HG GLU 22 6.973 -5.832 0.903
156 H LEU 23 H LEU 23 5.558 -3.916 -1.148
157 HA LEU 23 HA LEU 23 6.201 -2.515 -3.633
158 HG LEU 23 HG LEU 23 3.827 -1.787 -4.412
159 HB2 LEU 23 2HB LEU 23 3.926 -2.681 -2.153
160 HB3 LEU 23 1HB LEU 23 4.592 -1.187 -1.550
161 HD11 LEU 23 1HD1 LEU 23 1.930 -1.465 -2.981
162 HD12 LEU 23 2HD1 LEU 23 2.119 -0.085 -4.062
163 HD13 LEU 23 3HD1 LEU 23 2.606 0.045 -2.373
164 HD21 LEU 23 3HD2 LEU 23 4.864 0.807 -3.259
165 HD22 LEU 23 1HD2 LEU 23 4.323 0.538 -4.915
166 HD23 LEU 23 2HD2 LEU 23 5.775 -0.270 -4.319
167 H THR 24 H THR 24 7.616 -0.835 -3.767
168 HA THR 24 HA THR 24 8.805 0.192 -1.300
169 HB THR 24 HB THR 24 9.674 0.395 -4.196
170 HG1 THR 24 1HG THR 24 10.733 -1.342 -3.830
171 HG21 THR 24 3HG2 THR 24 11.783 1.335 -3.320
172 HG22 THR 24 1HG2 THR 24 11.110 1.355 -1.689
173 HG23 THR 24 2HG2 THR 24 10.397 2.354 -2.940
174 H PHE 25 H PHE 25 8.075 2.101 -0.612
175 HA PHE 25 HA PHE 25 7.120 4.046 -2.536
176 HD1 PHE 25 2HD PHE 25 5.451 4.616 1.411
177 HD2 PHE 25 1HD PHE 25 5.057 0.997 -0.778
178 HE1 PHE 25 2HE PHE 25 4.895 3.424 3.487
179 HE2 PHE 25 1HE PHE 25 4.500 -0.197 1.282
180 HZ PHE 25 HZ PHE 25 4.416 1.008 3.423
181 HB2 PHE 25 2HB PHE 25 5.185 4.608 -1.012
182 HB3 PHE 25 1HB PHE 25 5.062 3.105 -1.901
183 H ARG 26 H ARG 26 7.086 6.230 -1.837
184 HA ARG 26 HA ARG 26 8.982 6.798 0.349
185 HE ARG 26 HE ARG 26 8.312 8.161 -4.041
186 HB2 ARG 26 2HB ARG 26 7.942 8.504 -1.903
187 HB3 ARG 26 1HB ARG 26 9.091 9.012 -0.681
188 HG2 ARG 26 2HG ARG 26 10.737 7.545 -1.524
189 HG3 ARG 26 1HG ARG 26 9.559 6.780 -2.601
190 HD2 ARG 26 2HD ARG 26 10.314 9.678 -2.690
191 HD3 ARG 26 1HD ARG 26 10.997 8.431 -3.732
192 HH11 ARG 26 1HH1 ARG 26 10.428 10.967 -4.336
193 HH12 ARG 26 2HH1 ARG 26 9.562 11.693 -5.600
194 HH21 ARG 26 1HH2 ARG 26 7.089 9.108 -5.758
195 HH22 ARG 26 2HH2 ARG 26 7.600 10.584 -6.463
196 H GLU 27 H GLU 27 8.330 9.178 1.129
197 HA GLU 27 HA GLU 27 5.564 8.918 2.034
198 HB2 GLU 27 2HB GLU 27 7.525 9.465 3.635
199 HB3 GLU 27 1HB GLU 27 7.515 11.058 2.907
200 HG2 GLU 27 2HG GLU 27 5.195 9.807 4.397
201 HG3 GLU 27 1HG GLU 27 6.327 10.961 5.072
202 H GLY 28 H GLY 28 4.092 9.912 1.045
203 HA2 GLY 28 2HA GLY 28 3.235 12.191 0.461
204 HA3 GLY 28 1HA GLY 28 4.721 12.392 -0.455
205 H GLU 29 H GLU 29 3.561 9.248 -0.693
206 HA GLU 29 HA GLU 29 2.425 9.922 -3.294
207 HB2 GLU 29 2HB GLU 29 3.810 7.375 -2.416
208 HB3 GLU 29 1HB GLU 29 3.152 7.690 -4.019
209 HG2 GLU 29 2HG GLU 29 4.727 9.540 -4.310
210 HG3 GLU 29 1HG GLU 29 5.391 9.228 -2.712
211 H ILE 30 H ILE 30 0.653 8.584 -4.040
212 HA ILE 30 HA ILE 30 -1.043 7.757 -1.789
213 HB ILE 30 HB ILE 30 -1.869 8.714 -4.549
214 HG12 ILE 30 2HG1 ILE 30 -0.970 10.563 -3.219
215 HG13 ILE 30 1HG1 ILE 30 -2.707 10.731 -3.407
216 HG21 ILE 30 1HG2 ILE 30 -4.158 8.747 -3.665
217 HG22 ILE 30 2HG2 ILE 30 -3.573 8.065 -2.148
218 HG23 ILE 30 3HG2 ILE 30 -3.466 7.122 -3.635
219 HD11 ILE 30 3HD1 ILE 30 -1.286 9.714 -0.950
220 HD12 ILE 30 1HD1 ILE 30 -3.032 9.889 -1.132
221 HD13 ILE 30 2HD1 ILE 30 -1.990 11.313 -1.165
222 H ILE 31 H ILE 31 -1.556 5.699 -1.656
223 HA ILE 31 HA ILE 31 -0.877 3.961 -3.929
224 HB ILE 31 HB ILE 31 -1.186 3.212 -1.000
225 HG12 ILE 31 2HG1 ILE 31 1.360 3.535 -2.606
226 HG13 ILE 31 1HG1 ILE 31 0.801 4.649 -1.367
227 HG21 ILE 31 1HG2 ILE 31 -0.163 1.077 -1.666
228 HG22 ILE 31 2HG2 ILE 31 -0.143 1.617 -3.342
229 HG23 ILE 31 3HG2 ILE 31 -1.681 1.374 -2.512
230 HD11 ILE 31 3HD1 ILE 31 1.567 1.771 -0.932
231 HD12 ILE 31 1HD1 ILE 31 1.027 2.895 0.314
232 HD13 ILE 31 2HD1 ILE 31 2.552 3.178 -0.530
233 H HIS 32 H HIS 32 -2.533 2.907 -4.860
234 HA HIS 32 HA HIS 32 -5.166 3.210 -3.674
235 HD1 HIS 32 1HD HIS 32 -6.296 0.992 -7.668
236 HD2 HIS 32 2HD HIS 32 -7.557 3.220 -4.394
237 HE1 HIS 32 1HE HIS 32 -8.769 0.676 -7.520
238 HB2 HIS 32 2HB HIS 32 -4.872 3.654 -6.109
239 HB3 HIS 32 1HB HIS 32 -4.353 1.988 -6.334
240 H LEU 33 H LEU 33 -6.148 1.628 -2.605
241 HA LEU 33 HA LEU 33 -4.669 -0.697 -1.918
242 HG LEU 33 HG LEU 33 -5.641 -1.704 0.306
243 HB2 LEU 33 2HB LEU 33 -6.177 0.671 -0.409
244 HB3 LEU 33 1HB LEU 33 -7.534 0.034 -1.297
245 HD11 LEU 33 1HD1 LEU 33 -6.734 -0.028 1.723
246 HD12 LEU 33 2HD1 LEU 33 -7.310 -1.650 2.066
247 HD13 LEU 33 3HD1 LEU 33 -8.306 -0.546 1.115
248 HD21 LEU 33 3HD2 LEU 33 -6.996 -2.853 -1.421
249 HD22 LEU 33 1HD2 LEU 33 -8.461 -2.206 -0.686
250 HD23 LEU 33 2HD2 LEU 33 -7.439 -3.344 0.206
251 H ILE 34 H ILE 34 -4.666 -2.501 -2.971
252 HA ILE 34 HA ILE 34 -6.696 -3.010 -5.008
253 HB ILE 34 HB ILE 34 -3.945 -4.218 -4.588
254 HG12 ILE 34 2HG1 ILE 34 -3.803 -1.937 -5.424
255 HG13 ILE 34 1HG1 ILE 34 -3.343 -3.061 -6.694
256 HG21 ILE 34 1HG2 ILE 34 -5.399 -5.899 -5.563
257 HG22 ILE 34 2HG2 ILE 34 -4.217 -5.337 -6.748
258 HG23 ILE 34 3HG2 ILE 34 -5.884 -4.766 -6.828
259 HD11 ILE 34 3HD1 ILE 34 -5.581 -2.785 -7.692
260 HD12 ILE 34 1HD1 ILE 34 -4.689 -1.266 -7.580
261 HD13 ILE 34 2HD1 ILE 34 -5.972 -1.614 -6.429
262 H SER 35 H SER 35 -5.095 -4.461 -2.189
263 HA SER 35 HA SER 35 -7.423 -6.142 -1.785
264 HG SER 35 HG SER 35 -6.717 -6.954 -3.829
265 HB2 SER 35 2HB SER 35 -4.665 -7.358 -2.063
266 HB3 SER 35 1HB SER 35 -6.142 -8.211 -1.655
267 H LYS 36 H LYS 36 -7.782 -6.538 0.344
268 HA LYS 36 HA LYS 36 -5.768 -5.682 2.306
269 HB2 LYS 36 2HB LYS 36 -8.739 -5.798 2.330
270 HB3 LYS 36 1HB LYS 36 -7.912 -6.119 3.841
271 HG2 LYS 36 2HG LYS 36 -6.862 -3.965 3.782
272 HG3 LYS 36 1HG LYS 36 -7.512 -3.635 2.184
273 HD2 LYS 36 2HD LYS 36 -8.756 -2.491 3.974
274 HD3 LYS 36 1HD LYS 36 -9.776 -3.586 3.066
275 HE2 LYS 36 2HE LYS 36 -10.286 -3.765 5.428
276 HE3 LYS 36 1HE LYS 36 -9.544 -5.263 4.889
277 HZ1 LYS 36 3HZ LYS 36 -8.707 -4.516 7.019
278 HZ2 LYS 36 1HZ LYS 36 -8.174 -3.074 6.341
279 HZ3 LYS 36 2HZ LYS 36 -7.471 -4.564 5.897
280 H GLU 37 H GLU 37 -7.148 -8.411 0.905
281 HA GLU 37 HA GLU 37 -6.327 -10.030 3.176
282 HB2 GLU 37 2HB GLU 37 -8.699 -10.240 2.638
283 HB3 GLU 37 1HB GLU 37 -8.309 -10.665 0.975
284 HG2 GLU 37 2HG GLU 37 -8.952 -12.576 2.409
285 HG3 GLU 37 1HG GLU 37 -7.357 -12.730 1.669
286 H THR 38 H THR 38 -4.270 -10.357 2.806
287 HA THR 38 HA THR 38 -3.367 -11.179 0.163
288 HB THR 38 HB THR 38 -1.121 -10.704 1.282
289 HG1 THR 38 1HG THR 38 -2.183 -8.978 3.068
290 HG21 THR 38 3HG2 THR 38 -2.179 -9.144 -0.325
291 HG22 THR 38 1HG2 THR 38 -1.364 -8.268 0.974
292 HG23 THR 38 2HG2 THR 38 -3.119 -8.442 0.993
293 H GLY 39 H GLY 39 -4.467 -12.571 2.865
294 HA2 GLY 39 2HA GLY 39 -4.227 -14.934 3.231
295 HA3 GLY 39 1HA GLY 39 -2.536 -14.786 2.747
296 H GLU 40 H GLU 40 -2.378 -12.222 4.160
297 HA GLU 40 HA GLU 40 -2.141 -13.261 6.881
298 HB2 GLU 40 2HB GLU 40 -0.367 -11.270 5.449
299 HB3 GLU 40 1HB GLU 40 -0.177 -11.781 7.120
300 HG2 GLU 40 2HG GLU 40 0.208 -14.083 6.351
301 HG3 GLU 40 1HG GLU 40 0.064 -13.537 4.685
302 H ALA 41 H ALA 41 -1.926 -11.290 8.415
303 HA ALA 41 HA ALA 41 -4.125 -9.445 7.796
304 HB1 ALA 41 1HB ALA 41 -4.442 -10.835 9.774
305 HB2 ALA 41 2HB ALA 41 -4.284 -9.137 10.221
306 HB3 ALA 41 3HB ALA 41 -2.926 -10.243 10.449
307 H GLY 42 H GLY 42 -3.764 -7.250 7.924
308 HA2 GLY 42 2HA GLY 42 -2.587 -5.295 8.452
309 HA3 GLY 42 1HA GLY 42 -1.227 -6.280 8.972
310 H TRP 43 H TRP 43 -1.243 -7.834 6.495
311 HA TRP 43 HA TRP 43 0.314 -6.015 4.914
312 HD1 TRP 43 HD TRP 43 0.893 -9.362 7.040
313 HE1 TRP 43 1HE TRP 43 3.362 -9.288 7.773
314 HE3 TRP 43 3HE TRP 43 2.852 -6.916 3.018
315 HZ2 TRP 43 2HZ TRP 43 5.817 -8.328 6.766
316 HZ3 TRP 43 3HZ TRP 43 5.266 -6.455 2.975
317 HH2 TRP 43 HH TRP 43 6.711 -7.145 4.808
318 HB2 TRP 43 2HB TRP 43 -0.261 -8.965 4.639
319 HB3 TRP 43 1HB TRP 43 0.661 -8.060 3.448
320 H TRP 44 H TRP 44 -0.534 -4.780 3.524
321 HA TRP 44 HA TRP 44 -3.012 -5.566 2.178
322 HD1 TRP 44 HD TRP 44 -3.704 -5.346 4.454
323 HE1 TRP 44 1HE TRP 44 -5.369 -4.331 6.087
324 HE3 TRP 44 3HE TRP 44 -3.655 -0.532 2.719
325 HZ2 TRP 44 2HZ TRP 44 -6.553 -1.797 6.566
326 HZ3 TRP 44 3HZ TRP 44 -5.089 1.122 3.821
327 HH2 TRP 44 HH TRP 44 -6.509 0.500 5.710
328 HB2 TRP 44 2HB TRP 44 -1.788 -2.861 2.733
329 HB3 TRP 44 1HB TRP 44 -3.115 -3.100 1.610
330 H LYS 45 H LYS 45 -3.127 -5.140 -0.022
331 HA LYS 45 HA LYS 45 -0.526 -4.852 -1.327
332 HB2 LYS 45 2HB LYS 45 -1.327 -7.103 -1.788
333 HB3 LYS 45 1HB LYS 45 -2.927 -6.495 -2.148
334 HG2 LYS 45 2HG LYS 45 -2.138 -5.467 -4.192
335 HG3 LYS 45 1HG LYS 45 -0.482 -5.926 -3.815
336 HD2 LYS 45 2HD LYS 45 -2.631 -8.008 -4.043
337 HD3 LYS 45 1HD LYS 45 -1.847 -7.369 -5.486
338 HE2 LYS 45 2HE LYS 45 -0.362 -8.603 -3.160
339 HE3 LYS 45 1HE LYS 45 -0.831 -9.482 -4.613
340 HZ1 LYS 45 3HZ LYS 45 1.013 -7.138 -4.537
341 HZ2 LYS 45 1HZ LYS 45 0.439 -7.911 -5.923
342 HZ3 LYS 45 2HZ LYS 45 1.439 -8.737 -4.865
343 H GLY 46 H GLY 46 -0.354 -3.240 -2.646
344 HA2 GLY 46 2HA GLY 46 -2.735 -1.954 -3.691
345 HA3 GLY 46 1HA GLY 46 -1.632 -0.992 -2.708
346 H GLU 47 H GLU 47 -1.890 -0.072 -5.119
347 HA GLU 47 HA GLU 47 0.578 -0.980 -6.410
348 HB2 GLU 47 2HB GLU 47 -1.402 -1.551 -7.806
349 HB3 GLU 47 1HB GLU 47 -1.849 0.149 -7.832
350 HG2 GLU 47 2HG GLU 47 0.286 0.670 -8.958
351 HG3 GLU 47 1HG GLU 47 0.668 -1.048 -8.972
352 H LEU 48 H LEU 48 2.060 0.493 -6.759
353 HA LEU 48 HA LEU 48 1.350 3.264 -6.965
354 HG LEU 48 HG LEU 48 3.980 4.434 -5.931
355 HB2 LEU 48 2HB LEU 48 1.693 3.025 -4.567
356 HB3 LEU 48 1HB LEU 48 3.266 2.299 -4.835
357 HD11 LEU 48 1HD1 LEU 48 2.722 6.450 -5.545
358 HD12 LEU 48 2HD1 LEU 48 1.430 5.525 -4.781
359 HD13 LEU 48 3HD1 LEU 48 1.783 5.300 -6.492
360 HD21 LEU 48 3HD2 LEU 48 3.115 4.578 -3.054
361 HD22 LEU 48 1HD2 LEU 48 4.280 5.650 -3.836
362 HD23 LEU 48 2HD2 LEU 48 4.634 3.932 -3.692
363 H ASN 49 H ASN 49 2.692 4.335 -8.226
364 HA ASN 49 HA ASN 49 4.344 4.880 -9.640
365 HB2 ASN 49 2HB ASN 49 6.015 2.812 -8.183
366 HB3 ASN 49 1HB ASN 49 6.638 3.996 -9.317
367 HD21 ASN 49 1HD2 ASN 49 4.854 6.160 -8.176
368 HD22 ASN 49 2HD2 ASN 49 5.581 6.553 -6.659
369 H GLY 50 H GLY 50 2.631 2.336 -9.835
370 HA2 GLY 50 2HA GLY 50 2.101 1.358 -11.945
371 HA3 GLY 50 1HA GLY 50 3.798 1.486 -12.386
372 H LYS 51 H LYS 51 3.829 0.425 -9.279
373 HA LYS 51 HA LYS 51 3.855 -2.367 -10.187
374 HB2 LYS 51 2HB LYS 51 5.587 -1.134 -8.032
375 HB3 LYS 51 1HB LYS 51 5.543 -2.829 -8.439
376 HG2 LYS 51 2HG LYS 51 7.470 -2.077 -9.470
377 HG3 LYS 51 1HG LYS 51 6.300 -2.100 -10.781
378 HD2 LYS 51 2HD LYS 51 7.531 -0.021 -10.955
379 HD3 LYS 51 1HD LYS 51 5.910 0.326 -10.397
380 HE2 LYS 51 2HE LYS 51 7.603 1.610 -9.167
381 HE3 LYS 51 1HE LYS 51 6.665 0.569 -8.109
382 HZ1 LYS 51 3HZ LYS 51 9.397 -0.028 -9.133
383 HZ2 LYS 51 1HZ LYS 51 8.540 -0.981 -8.033
384 HZ3 LYS 51 2HZ LYS 51 9.027 0.559 -7.605
385 H GLU 52 H GLU 52 2.815 -3.817 -8.993
386 HA GLU 52 HA GLU 52 1.286 -2.794 -6.738
387 HB2 GLU 52 2HB GLU 52 0.036 -4.894 -6.822
388 HB3 GLU 52 1HB GLU 52 0.010 -4.114 -8.393
389 HG2 GLU 52 2HG GLU 52 1.522 -5.676 -9.298
390 HG3 GLU 52 1HG GLU 52 1.974 -6.275 -7.703
391 H GLY 53 H GLY 53 1.529 -3.630 -4.714
392 HA2 GLY 53 2HA GLY 53 3.345 -5.810 -4.291
393 HA3 GLY 53 1HA GLY 53 3.969 -4.244 -3.784
394 H VAL 54 H VAL 54 3.812 -5.903 -1.883
395 HA VAL 54 HA VAL 54 1.349 -5.268 -0.456
396 HB VAL 54 HB VAL 54 1.826 -7.186 1.014
397 HG11 VAL 54 1HG1 VAL 54 1.739 -7.894 -1.903
398 HG12 VAL 54 2HG1 VAL 54 0.370 -7.583 -0.828
399 HG13 VAL 54 3HG1 VAL 54 1.391 -8.997 -0.574
400 HG21 VAL 54 3HG2 VAL 54 4.121 -7.773 -0.859
401 HG22 VAL 54 1HG2 VAL 54 3.551 -8.836 0.428
402 HG23 VAL 54 2HG2 VAL 54 4.260 -7.268 0.826
403 H PHE 55 H PHE 55 1.558 -4.686 1.685
404 HA PHE 55 HA PHE 55 4.115 -4.008 2.756
405 HD1 PHE 55 1HD PHE 55 1.702 -2.265 -0.203
406 HD2 PHE 55 2HD PHE 55 1.677 -0.629 3.731
407 HE1 PHE 55 1HE PHE 55 -0.458 -1.191 -0.667
408 HE2 PHE 55 2HE PHE 55 -0.488 0.442 3.272
409 HZ PHE 55 HZ PHE 55 -1.557 0.165 1.071
410 HB2 PHE 55 2HB PHE 55 3.727 -1.573 2.777
411 HB3 PHE 55 1HB PHE 55 3.713 -2.226 1.134
412 HA PRO 56 HA PRO 56 1.423 -4.348 6.359
413 HB2 PRO 56 2HB PRO 56 3.427 -2.695 7.784
414 HB3 PRO 56 1HB PRO 56 2.906 -4.345 8.131
415 HG2 PRO 56 2HG PRO 56 5.339 -3.877 7.124
416 HG3 PRO 56 1HG PRO 56 4.387 -5.282 6.620
417 HD2 PRO 56 2HD PRO 56 4.761 -2.662 5.210
418 HD3 PRO 56 1HD PRO 56 4.839 -4.323 4.569
419 H ASP 57 H ASP 57 -0.237 -3.110 6.829
420 HA ASP 57 HA ASP 57 -0.728 -0.665 5.592
421 HB2 ASP 57 2HB ASP 57 -2.826 -0.631 6.666
422 HB3 ASP 57 1HB ASP 57 -2.435 -2.326 6.447
423 H ASN 58 H ASN 58 0.858 -1.225 8.591
424 HA ASN 58 HA ASN 58 0.142 1.220 9.860
425 HB2 ASN 58 2HB ASN 58 1.798 0.738 11.537
426 HB3 ASN 58 1HB ASN 58 1.031 -0.777 11.094
427 HD21 ASN 58 1HD2 ASN 58 3.949 1.024 11.162
428 HD22 ASN 58 2HD2 ASN 58 4.997 -0.222 10.596
429 H PHE 59 H PHE 59 2.222 0.633 7.259
430 HA PHE 59 HA PHE 59 3.833 2.984 7.839
431 HD1 PHE 59 2HD PHE 59 6.617 2.567 7.567
432 HD2 PHE 59 1HD PHE 59 4.367 -0.951 6.800
433 HE1 PHE 59 2HE PHE 59 8.176 1.273 8.950
434 HE2 PHE 59 1HE PHE 59 5.929 -2.248 8.196
435 HZ PHE 59 HZ PHE 59 7.829 -1.137 9.266
436 HB2 PHE 59 2HB PHE 59 3.955 1.015 5.554
437 HB3 PHE 59 1HB PHE 59 5.004 2.421 5.688
438 H ALA 60 H ALA 60 0.844 2.594 6.769
439 HA ALA 60 HA ALA 60 0.940 5.006 5.156
440 HB1 ALA 60 1HB ALA 60 0.890 3.126 3.560
441 HB2 ALA 60 2HB ALA 60 -0.612 4.047 3.522
442 HB3 ALA 60 3HB ALA 60 -0.557 2.496 4.351
443 H VAL 61 H VAL 61 -1.321 5.841 4.917
444 HA VAL 61 HA VAL 61 -3.059 4.938 7.075
445 HB VAL 61 HB VAL 61 -2.003 7.065 7.795
446 HG11 VAL 61 1HG1 VAL 61 -3.279 8.314 5.371
447 HG12 VAL 61 2HG1 VAL 61 -1.552 8.108 5.654
448 HG13 VAL 61 3HG1 VAL 61 -2.491 9.191 6.682
449 HG21 VAL 61 3HG2 VAL 61 -4.241 6.577 8.579
450 HG22 VAL 61 1HG2 VAL 61 -4.933 7.349 7.153
451 HG23 VAL 61 2HG2 VAL 61 -4.049 8.312 8.340
452 H GLN 62 H GLN 62 -4.952 4.331 6.362
453 HA GLN 62 HA GLN 62 -5.663 4.713 3.621
454 HB2 GLN 62 2HB GLN 62 -6.209 2.676 5.016
455 HB3 GLN 62 1HB GLN 62 -7.354 3.662 5.903
456 HG2 GLN 62 2HG GLN 62 -8.616 4.036 3.825
457 HG3 GLN 62 1HG GLN 62 -7.472 3.015 2.958
458 HE21 GLN 62 1HE2 GLN 62 -8.647 2.411 6.198
459 HE22 GLN 62 2HE2 GLN 62 -9.521 0.970 5.796
460 H ILE 63 H ILE 63 -6.730 6.421 2.845
461 HA ILE 63 HA ILE 63 -7.441 8.425 4.794
462 HB ILE 63 HB ILE 63 -7.763 9.925 2.879
463 HG12 ILE 63 2HG1 ILE 63 -6.594 7.620 1.301
464 HG13 ILE 63 1HG1 ILE 63 -8.191 8.333 1.102
465 HG21 ILE 63 1HG2 ILE 63 -5.290 10.156 2.465
466 HG22 ILE 63 2HG2 ILE 63 -5.074 8.574 3.224
467 HG23 ILE 63 3HG2 ILE 63 -5.699 9.925 4.167
468 HD11 ILE 63 3HD1 ILE 63 -5.562 9.697 0.548
469 HD12 ILE 63 1HD1 ILE 63 -7.158 10.417 0.357
470 HD13 ILE 63 2HD1 ILE 63 -6.677 9.060 -0.662
471 H SER 64 H SER 64 -8.992 6.116 3.239
472 HA SER 64 HA SER 64 -11.526 7.063 2.664
473 HG SER 64 HG SER 64 -11.120 3.920 1.559
474 HB2 SER 64 2HB SER 64 -10.780 4.409 3.903
475 HB3 SER 64 1HB SER 64 -12.274 4.769 3.040
Start of MODEL 17
1 H1 GLY 1 1HT GLY 1 -10.016 -2.818 -4.630
2 H2 GLY 1 2HT GLY 1 -9.399 -1.274 -4.339
3 H3 GLY 1 3HT GLY 1 -11.061 -1.577 -4.179
4 HA2 GLY 1 1HA GLY 1 -8.911 -2.682 -2.499
5 HA3 GLY 1 2HA GLY 1 -10.044 -1.416 -2.034
6 H ALA 2 H ALA 2 -11.196 -2.336 -0.498
7 HA ALA 2 HA ALA 2 -12.369 -4.989 -1.005
8 HB1 ALA 2 1HB ALA 2 -10.751 -4.998 0.846
9 HB2 ALA 2 2HB ALA 2 -12.393 -5.288 1.421
10 HB3 ALA 2 3HB ALA 2 -11.658 -3.701 1.624
11 H MET 3 H MET 3 -12.839 -1.702 0.088
12 HA MET 3 HA MET 3 -15.706 -2.198 0.509
13 HB2 MET 3 2HB MET 3 -13.997 0.190 1.216
14 HB3 MET 3 1HB MET 3 -15.714 0.057 1.548
15 HG2 MET 3 2HG MET 3 -13.583 -1.743 2.672
16 HG3 MET 3 1HG MET 3 -14.293 -0.373 3.515
17 HE1 MET 3 3HE MET 3 -16.858 -0.271 4.271
18 HE2 MET 3 1HE MET 3 -18.014 -1.572 3.986
19 HE3 MET 3 2HE MET 3 -17.396 -0.633 2.631
20 H GLY 4 H GLY 4 -13.859 -1.590 -1.945
21 HA2 GLY 4 2HA GLY 4 -15.516 -0.859 -3.850
22 HA3 GLY 4 1HA GLY 4 -15.238 0.701 -3.075
23 H ALA 5 H ALA 5 -14.394 1.135 -5.295
24 HA ALA 5 HA ALA 5 -11.622 0.204 -5.632
25 HB1 ALA 5 1HB ALA 5 -11.886 0.821 -7.992
26 HB2 ALA 5 2HB ALA 5 -13.528 1.373 -7.668
27 HB3 ALA 5 3HB ALA 5 -13.122 -0.338 -7.496
28 H LYS 6 H LYS 6 -12.834 2.457 -4.005
29 HA LYS 6 HA LYS 6 -11.196 4.628 -5.112
30 HB2 LYS 6 2HB LYS 6 -12.745 6.212 -3.994
31 HB3 LYS 6 1HB LYS 6 -13.470 5.334 -5.321
32 HG2 LYS 6 2HG LYS 6 -14.604 3.863 -3.724
33 HG3 LYS 6 1HG LYS 6 -13.831 4.721 -2.389
34 HD2 LYS 6 2HD LYS 6 -14.965 6.774 -3.018
35 HD3 LYS 6 1HD LYS 6 -15.689 5.981 -4.414
36 HE2 LYS 6 2HE LYS 6 -16.885 4.463 -2.945
37 HE3 LYS 6 1HE LYS 6 -16.141 5.223 -1.534
38 HZ1 LYS 6 3HZ LYS 6 -17.962 6.569 -3.467
39 HZ2 LYS 6 1HZ LYS 6 -17.261 7.278 -2.112
40 HZ3 LYS 6 2HZ LYS 6 -18.383 6.036 -1.939
41 H GLU 7 H GLU 7 -10.545 2.512 -3.268
42 HA GLU 7 HA GLU 7 -10.187 3.987 -0.779
43 HB2 GLU 7 2HB GLU 7 -9.619 1.090 -1.406
44 HB3 GLU 7 1HB GLU 7 -9.315 1.854 0.144
45 HG2 GLU 7 2HG GLU 7 -11.751 2.374 0.267
46 HG3 GLU 7 1HG GLU 7 -11.969 1.381 -1.176
47 H TYR 8 H TYR 8 -8.402 4.954 -0.349
48 HA TYR 8 HA TYR 8 -5.963 4.007 -1.520
49 HD1 TYR 8 2HD TYR 8 -5.896 8.256 -0.760
50 HD2 TYR 8 1HD TYR 8 -8.697 6.450 -3.398
51 HE1 TYR 8 2HE TYR 8 -7.336 10.236 -0.580
52 HE2 TYR 8 1HE TYR 8 -10.146 8.415 -3.239
53 HH TYR 8 HH TYR 8 -10.541 10.281 -1.676
54 HB2 TYR 8 2HB TYR 8 -5.285 6.362 -2.129
55 HB3 TYR 8 1HB TYR 8 -6.432 5.579 -3.208
56 H CYS 9 H CYS 9 -4.104 4.763 -0.580
57 HA CYS 9 HA CYS 9 -4.484 5.762 2.138
58 HG CYS 9 HG CYS 9 -3.074 3.131 -0.399
59 HB2 CYS 9 2HB CYS 9 -2.762 4.046 2.822
60 HB3 CYS 9 1HB CYS 9 -4.337 3.395 2.374
61 H ARG 10 H ARG 10 -2.631 6.782 3.012
62 HA ARG 10 HA ARG 10 -0.683 7.575 0.963
63 HE ARG 10 HE ARG 10 -0.753 11.249 4.544
64 HB2 ARG 10 2HB ARG 10 -2.175 9.400 1.971
65 HB3 ARG 10 1HB ARG 10 -1.310 9.126 3.478
66 HG2 ARG 10 2HG ARG 10 0.815 9.587 2.265
67 HG3 ARG 10 1HG ARG 10 -0.147 10.053 0.864
68 HD2 ARG 10 2HD ARG 10 0.419 12.034 2.004
69 HD3 ARG 10 1HD ARG 10 -1.283 11.725 2.357
70 HH11 ARG 10 1HH1 ARG 10 2.144 12.093 2.717
71 HH12 ARG 10 2HH1 ARG 10 3.209 12.039 4.039
72 HH21 ARG 10 1HH2 ARG 10 0.622 11.372 6.404
73 HH22 ARG 10 2HH2 ARG 10 2.284 11.712 6.231
74 H THR 11 H THR 11 1.402 7.205 1.422
75 HA THR 11 HA THR 11 1.956 5.455 3.580
76 HB THR 11 HB THR 11 4.241 5.529 2.512
77 HG1 THR 11 1HG THR 11 4.508 6.803 0.842
78 HG21 THR 11 3HG2 THR 11 1.839 4.904 0.795
79 HG22 THR 11 1HG2 THR 11 2.552 3.827 1.995
80 HG23 THR 11 2HG2 THR 11 3.467 4.273 0.554
81 H LEU 12 H LEU 12 2.959 5.882 5.429
82 HA LEU 12 HA LEU 12 3.498 8.668 6.121
83 HG LEU 12 HG LEU 12 1.134 6.703 6.929
84 HB2 LEU 12 2HB LEU 12 3.387 6.194 7.842
85 HB3 LEU 12 1HB LEU 12 3.505 7.841 8.417
86 HD11 LEU 12 1HD1 LEU 12 1.379 5.680 9.120
87 HD12 LEU 12 2HD1 LEU 12 0.003 6.784 9.094
88 HD13 LEU 12 3HD1 LEU 12 1.513 7.274 9.862
89 HD21 LEU 12 3HD2 LEU 12 1.542 9.334 8.346
90 HD22 LEU 12 1HD2 LEU 12 0.020 8.762 7.665
91 HD23 LEU 12 2HD2 LEU 12 1.385 9.102 6.605
92 H PHE 13 H PHE 13 5.170 5.924 5.126
93 HA PHE 13 HA PHE 13 7.682 6.883 6.310
94 HD1 PHE 13 1HD PHE 13 4.903 4.364 7.670
95 HD2 PHE 13 2HD PHE 13 8.917 5.273 8.733
96 HE1 PHE 13 1HE PHE 13 4.263 4.387 10.039
97 HE2 PHE 13 2HE PHE 13 8.285 5.304 11.108
98 HZ PHE 13 HZ PHE 13 5.955 4.861 11.764
99 HB2 PHE 13 2HB PHE 13 6.765 4.005 6.128
100 HB3 PHE 13 1HB PHE 13 8.394 4.506 6.541
101 HA PRO 14 HA PRO 14 9.100 5.850 2.162
102 HB2 PRO 14 2HB PRO 14 11.749 6.299 2.552
103 HB3 PRO 14 1HB PRO 14 10.590 7.619 2.367
104 HG2 PRO 14 2HG PRO 14 11.962 6.641 4.802
105 HG3 PRO 14 1HG PRO 14 11.359 8.259 4.429
106 HD2 PRO 14 2HD PRO 14 10.101 6.319 6.057
107 HD3 PRO 14 1HD PRO 14 9.404 7.842 5.467
108 H TYR 15 H TYR 15 9.339 3.704 1.527
109 HA TYR 15 HA TYR 15 11.113 2.025 3.064
110 HD1 TYR 15 1HD TYR 15 10.867 0.084 4.956
111 HD2 TYR 15 2HD TYR 15 7.789 -0.672 2.118
112 HE1 TYR 15 1HE TYR 15 11.164 -2.330 5.274
113 HE2 TYR 15 2HE TYR 15 8.081 -3.083 2.428
114 HH TYR 15 HH TYR 15 9.734 -4.605 3.158
115 HB2 TYR 15 2HB TYR 15 9.050 1.821 4.300
116 HB3 TYR 15 1HB TYR 15 8.158 1.513 2.827
117 H THR 16 H THR 16 12.217 0.892 1.716
118 HA THR 16 HA THR 16 11.250 0.462 -0.958
119 HB THR 16 HB THR 16 13.947 -0.094 0.312
120 HG1 THR 16 1HG THR 16 12.827 2.165 -0.471
121 HG21 THR 16 3HG2 THR 16 13.120 -0.122 -2.605
122 HG22 THR 16 1HG2 THR 16 13.526 -1.540 -1.640
123 HG23 THR 16 2HG2 THR 16 14.763 -0.340 -2.002
124 H GLY 17 H GLY 17 10.650 -1.443 -1.681
125 HA2 GLY 17 2HA GLY 17 9.993 -3.522 0.088
126 HA3 GLY 17 1HA GLY 17 10.006 -3.635 -1.675
127 H THR 18 H THR 18 11.238 -5.084 0.922
128 HA THR 18 HA THR 18 13.979 -5.270 0.365
129 HB THR 18 HB THR 18 12.495 -7.437 1.762
130 HG1 THR 18 1HG THR 18 11.214 -5.672 2.452
131 HG21 THR 18 3HG2 THR 18 14.635 -5.529 2.467
132 HG22 THR 18 1HG2 THR 18 14.932 -7.124 1.759
133 HG23 THR 18 2HG2 THR 18 14.217 -6.992 3.391
134 H ASN 19 H ASN 19 11.049 -6.837 -0.316
135 HA ASN 19 HA ASN 19 12.218 -8.815 -2.109
136 HB2 ASN 19 2HB ASN 19 9.541 -8.429 -0.792
137 HB3 ASN 19 1HB ASN 19 9.778 -9.632 -2.033
138 HD21 ASN 19 1HD2 ASN 19 8.974 -9.967 0.727
139 HD22 ASN 19 2HD2 ASN 19 10.146 -10.966 1.486
140 H GLU 20 H GLU 20 11.453 -8.728 -4.334
141 HA GLU 20 HA GLU 20 10.643 -6.063 -5.014
142 HB2 GLU 20 2HB GLU 20 11.035 -6.656 -7.367
143 HB3 GLU 20 1HB GLU 20 12.405 -7.088 -6.375
144 HG2 GLU 20 2HG GLU 20 12.259 -8.890 -7.778
145 HG3 GLU 20 1HG GLU 20 11.309 -9.461 -6.413
146 H ASP 21 H ASP 21 9.164 -8.970 -4.405
147 HA ASP 21 HA ASP 21 6.641 -8.517 -5.711
148 HB2 ASP 21 2HB ASP 21 7.286 -10.152 -3.226
149 HB3 ASP 21 1HB ASP 21 5.723 -10.129 -4.012
150 H GLU 22 H GLU 22 8.244 -7.235 -3.066
151 HA GLU 22 HA GLU 22 5.910 -6.322 -1.614
152 HB2 GLU 22 2HB GLU 22 7.842 -7.308 -0.454
153 HB3 GLU 22 1HB GLU 22 8.890 -6.087 -1.135
154 HG2 GLU 22 2HG GLU 22 7.850 -4.404 0.217
155 HG3 GLU 22 1HG GLU 22 6.641 -5.562 0.785
156 H LEU 23 H LEU 23 5.500 -4.092 -1.394
157 HA LEU 23 HA LEU 23 6.092 -2.716 -3.874
158 HG LEU 23 HG LEU 23 4.035 -1.301 -4.635
159 HB2 LEU 23 2HB LEU 23 3.784 -3.057 -2.839
160 HB3 LEU 23 1HB LEU 23 4.229 -1.863 -1.656
161 HD11 LEU 23 1HD1 LEU 23 2.071 -0.765 -2.423
162 HD12 LEU 23 2HD1 LEU 23 1.880 -1.945 -3.724
163 HD13 LEU 23 3HD1 LEU 23 1.921 -0.221 -4.094
164 HD21 LEU 23 3HD2 LEU 23 4.147 0.557 -2.257
165 HD22 LEU 23 1HD2 LEU 23 3.979 1.044 -3.941
166 HD23 LEU 23 2HD2 LEU 23 5.468 0.276 -3.390
167 H THR 24 H THR 24 7.577 -1.196 -4.061
168 HA THR 24 HA THR 24 8.879 -0.014 -1.762
169 HB THR 24 HB THR 24 9.292 0.229 -4.738
170 HG1 THR 24 1HG THR 24 9.831 -1.728 -4.019
171 HG21 THR 24 3HG2 THR 24 11.475 1.303 -4.176
172 HG22 THR 24 1HG2 THR 24 10.990 1.403 -2.485
173 HG23 THR 24 2HG2 THR 24 10.092 2.280 -3.698
174 H PHE 25 H PHE 25 8.214 1.853 -0.896
175 HA PHE 25 HA PHE 25 6.910 3.796 -2.613
176 HD1 PHE 25 1HD PHE 25 5.994 4.336 1.559
177 HD2 PHE 25 2HD PHE 25 5.413 0.645 -0.459
178 HE1 PHE 25 1HE PHE 25 5.959 3.162 3.718
179 HE2 PHE 25 2HE PHE 25 5.386 -0.531 1.687
180 HZ PHE 25 HZ PHE 25 5.650 0.723 3.784
181 HB2 PHE 25 2HB PHE 25 5.276 4.276 -0.763
182 HB3 PHE 25 1HB PHE 25 5.047 2.748 -1.602
183 H ARG 26 H ARG 26 6.806 5.923 -1.669
184 HA ARG 26 HA ARG 26 9.085 6.483 0.106
185 HE ARG 26 HE ARG 26 11.571 7.313 -4.216
186 HB2 ARG 26 2HB ARG 26 7.783 8.203 -2.013
187 HB3 ARG 26 1HB ARG 26 9.078 8.734 -0.961
188 HG2 ARG 26 2HG ARG 26 10.569 7.084 -1.948
189 HG3 ARG 26 1HG ARG 26 9.258 6.519 -2.989
190 HD2 ARG 26 2HD ARG 26 9.083 8.763 -3.946
191 HD3 ARG 26 1HD ARG 26 10.440 9.282 -2.946
192 HH11 ARG 26 1HH1 ARG 26 9.359 9.772 -5.490
193 HH12 ARG 26 2HH1 ARG 26 10.035 9.791 -7.055
194 HH21 ARG 26 1HH2 ARG 26 12.523 7.341 -6.414
195 HH22 ARG 26 2HH2 ARG 26 11.860 8.405 -7.576
196 H GLU 27 H GLU 27 8.601 8.704 1.280
197 HA GLU 27 HA GLU 27 6.108 8.352 2.668
198 HB2 GLU 27 2HB GLU 27 8.266 9.001 3.773
199 HB3 GLU 27 1HB GLU 27 8.216 10.521 2.913
200 HG2 GLU 27 2HG GLU 27 6.095 9.675 4.889
201 HG3 GLU 27 1HG GLU 27 7.543 10.551 5.350
202 H GLY 28 H GLY 28 4.235 9.286 2.097
203 HA2 GLY 28 2HA GLY 28 2.958 11.204 1.583
204 HA3 GLY 28 1HA GLY 28 4.330 11.863 0.705
205 H GLU 29 H GLU 29 3.627 8.591 0.037
206 HA GLU 29 HA GLU 29 2.708 9.404 -2.601
207 HB2 GLU 29 2HB GLU 29 3.652 6.736 -1.545
208 HB3 GLU 29 1HB GLU 29 3.154 7.034 -3.202
209 HG2 GLU 29 2HG GLU 29 5.482 8.349 -1.811
210 HG3 GLU 29 1HG GLU 29 5.596 6.999 -2.933
211 H ILE 30 H ILE 30 0.784 8.721 -3.460
212 HA ILE 30 HA ILE 30 -1.174 7.656 -1.567
213 HB ILE 30 HB ILE 30 -1.554 9.038 -4.248
214 HG12 ILE 30 2HG1 ILE 30 -0.925 10.533 -2.391
215 HG13 ILE 30 1HG1 ILE 30 -2.558 10.850 -2.979
216 HG21 ILE 30 1HG2 ILE 30 -3.973 8.965 -3.813
217 HG22 ILE 30 2HG2 ILE 30 -3.679 7.991 -2.376
218 HG23 ILE 30 3HG2 ILE 30 -3.281 7.346 -3.969
219 HD11 ILE 30 3HD1 ILE 30 -1.821 9.338 -0.476
220 HD12 ILE 30 1HD1 ILE 30 -3.460 9.643 -1.049
221 HD13 ILE 30 2HD1 ILE 30 -2.433 10.987 -0.558
222 H ILE 31 H ILE 31 -1.420 5.617 -1.634
223 HA ILE 31 HA ILE 31 -0.957 4.143 -4.138
224 HB ILE 31 HB ILE 31 -0.975 3.105 -1.283
225 HG12 ILE 31 2HG1 ILE 31 1.343 3.612 -3.160
226 HG13 ILE 31 1HG1 ILE 31 0.989 4.488 -1.680
227 HG21 ILE 31 1HG2 ILE 31 -1.704 1.411 -2.868
228 HG22 ILE 31 2HG2 ILE 31 -0.104 1.014 -2.244
229 HG23 ILE 31 3HG2 ILE 31 -0.275 1.697 -3.859
230 HD11 ILE 31 3HD1 ILE 31 2.805 2.908 -1.356
231 HD12 ILE 31 1HD1 ILE 31 1.762 1.584 -1.873
232 HD13 ILE 31 2HD1 ILE 31 1.406 2.457 -0.382
233 H HIS 32 H HIS 32 -2.657 3.075 -5.017
234 HA HIS 32 HA HIS 32 -5.197 3.294 -3.644
235 HD1 HIS 32 1HD HIS 32 -7.522 3.528 -7.198
236 HD2 HIS 32 2HD HIS 32 -4.692 5.669 -5.034
237 HE1 HIS 32 1HE HIS 32 -8.256 5.926 -7.273
238 HB2 HIS 32 2HB HIS 32 -4.401 2.713 -6.459
239 HB3 HIS 32 1HB HIS 32 -5.919 2.032 -5.890
240 H LEU 33 H LEU 33 -6.185 1.765 -2.713
241 HA LEU 33 HA LEU 33 -4.706 -0.544 -1.930
242 HG LEU 33 HG LEU 33 -5.532 -1.034 0.541
243 HB2 LEU 33 2HB LEU 33 -6.291 1.004 -0.593
244 HB3 LEU 33 1HB LEU 33 -7.586 0.124 -1.354
245 HD11 LEU 33 1HD1 LEU 33 -7.408 -1.175 2.096
246 HD12 LEU 33 2HD1 LEU 33 -8.443 -0.364 0.923
247 HD13 LEU 33 3HD1 LEU 33 -7.071 0.490 1.630
248 HD21 LEU 33 3HD2 LEU 33 -6.781 -3.042 0.522
249 HD22 LEU 33 1HD2 LEU 33 -6.454 -2.638 -1.150
250 HD23 LEU 33 2HD2 LEU 33 -8.062 -2.337 -0.469
251 H ILE 34 H ILE 34 -4.804 -2.480 -2.909
252 HA ILE 34 HA ILE 34 -6.955 -3.013 -4.809
253 HB ILE 34 HB ILE 34 -4.257 -4.348 -4.435
254 HG12 ILE 34 2HG1 ILE 34 -5.332 -2.664 -6.718
255 HG13 ILE 34 1HG1 ILE 34 -4.090 -2.185 -5.563
256 HG21 ILE 34 1HG2 ILE 34 -5.844 -6.049 -5.102
257 HG22 ILE 34 2HG2 ILE 34 -4.765 -5.660 -6.451
258 HG23 ILE 34 3HG2 ILE 34 -6.415 -5.032 -6.431
259 HD11 ILE 34 3HD1 ILE 34 -2.567 -3.759 -6.448
260 HD12 ILE 34 1HD1 ILE 34 -3.254 -2.843 -7.785
261 HD13 ILE 34 2HD1 ILE 34 -3.809 -4.491 -7.460
262 H SER 35 H SER 35 -5.117 -4.589 -2.176
263 HA SER 35 HA SER 35 -7.550 -6.013 -1.410
264 HG SER 35 HG SER 35 -7.209 -7.567 -3.393
265 HB2 SER 35 2HB SER 35 -4.896 -7.422 -1.743
266 HB3 SER 35 1HB SER 35 -6.442 -8.139 -1.312
267 H LYS 36 H LYS 36 -7.799 -5.855 0.744
268 HA LYS 36 HA LYS 36 -5.646 -5.046 2.503
269 HB2 LYS 36 2HB LYS 36 -8.556 -5.736 2.938
270 HB3 LYS 36 1HB LYS 36 -7.457 -5.258 4.223
271 HG2 LYS 36 2HG LYS 36 -7.204 -3.089 3.284
272 HG3 LYS 36 1HG LYS 36 -8.094 -3.549 1.836
273 HD2 LYS 36 2HD LYS 36 -9.441 -2.233 3.380
274 HD3 LYS 36 1HD LYS 36 -10.111 -3.840 3.115
275 HE2 LYS 36 2HE LYS 36 -9.171 -4.586 5.230
276 HE3 LYS 36 1HE LYS 36 -8.435 -2.999 5.466
277 HZ1 LYS 36 3HZ LYS 36 -11.339 -3.566 5.272
278 HZ2 LYS 36 1HZ LYS 36 -10.655 -2.048 5.523
279 HZ3 LYS 36 2HZ LYS 36 -10.517 -3.250 6.706
280 H GLU 37 H GLU 37 -7.529 -7.812 1.619
281 HA GLU 37 HA GLU 37 -6.214 -9.460 3.613
282 HB2 GLU 37 2HB GLU 37 -8.504 -10.067 1.737
283 HB3 GLU 37 1HB GLU 37 -7.811 -11.228 2.845
284 HG2 GLU 37 2HG GLU 37 -9.753 -10.501 3.889
285 HG3 GLU 37 1HG GLU 37 -8.479 -9.610 4.695
286 H THR 38 H THR 38 -4.323 -10.109 2.940
287 HA THR 38 HA THR 38 -3.997 -11.009 0.146
288 HB THR 38 HB THR 38 -1.560 -10.485 0.588
289 HG1 THR 38 1HG THR 38 -2.186 -8.719 2.600
290 HG21 THR 38 3HG2 THR 38 -3.018 -8.939 -0.686
291 HG22 THR 38 1HG2 THR 38 -1.851 -8.049 0.295
292 HG23 THR 38 2HG2 THR 38 -3.528 -8.190 0.824
293 H GLY 39 H GLY 39 -4.585 -12.240 3.028
294 HA2 GLY 39 2HA GLY 39 -4.203 -14.666 3.297
295 HA3 GLY 39 1HA GLY 39 -2.511 -14.336 2.908
296 H GLU 40 H GLU 40 -2.755 -11.763 4.319
297 HA GLU 40 HA GLU 40 -3.100 -12.523 7.107
298 HB2 GLU 40 2HB GLU 40 -0.661 -11.174 5.944
299 HB3 GLU 40 1HB GLU 40 -1.052 -11.160 7.651
300 HG2 GLU 40 2HG GLU 40 -0.883 -13.637 7.632
301 HG3 GLU 40 1HG GLU 40 -0.338 -13.532 5.956
302 H ALA 41 H ALA 41 -3.992 -10.868 8.251
303 HA ALA 41 HA ALA 41 -4.707 -8.479 6.787
304 HB1 ALA 41 1HB ALA 41 -5.321 -9.273 9.645
305 HB2 ALA 41 2HB ALA 41 -6.394 -9.497 8.263
306 HB3 ALA 41 3HB ALA 41 -5.985 -7.870 8.810
307 H GLY 42 H GLY 42 -2.840 -7.481 6.469
308 HA2 GLY 42 2HA GLY 42 -1.774 -5.699 8.271
309 HA3 GLY 42 1HA GLY 42 -0.809 -7.168 8.455
310 H TRP 43 H TRP 43 -1.161 -7.965 5.709
311 HA TRP 43 HA TRP 43 0.606 -6.017 4.484
312 HD1 TRP 43 HD TRP 43 1.179 -10.050 5.784
313 HE1 TRP 43 1HE TRP 43 3.589 -10.103 6.631
314 HE3 TRP 43 3HE TRP 43 3.102 -6.249 2.957
315 HZ2 TRP 43 2HZ TRP 43 6.021 -8.705 6.166
316 HZ3 TRP 43 3HZ TRP 43 5.478 -5.671 3.220
317 HH2 TRP 43 HH TRP 43 6.904 -6.874 4.792
318 HB2 TRP 43 2HB TRP 43 -0.007 -8.894 3.770
319 HB3 TRP 43 1HB TRP 43 0.950 -7.826 2.757
320 H TRP 44 H TRP 44 -0.228 -4.700 3.115
321 HA TRP 44 HA TRP 44 -2.830 -5.331 1.959
322 HD1 TRP 44 HD TRP 44 -3.489 -5.173 4.197
323 HE1 TRP 44 1HE TRP 44 -5.333 -4.198 5.673
324 HE3 TRP 44 3HE TRP 44 -3.457 -0.385 2.432
325 HZ2 TRP 44 2HZ TRP 44 -6.606 -1.707 6.048
326 HZ3 TRP 44 3HZ TRP 44 -5.022 1.238 3.408
327 HH2 TRP 44 HH TRP 44 -6.570 0.578 5.183
328 HB2 TRP 44 2HB TRP 44 -1.478 -2.759 2.677
329 HB3 TRP 44 1HB TRP 44 -2.715 -2.795 1.432
330 H LYS 45 H LYS 45 -3.061 -5.248 -0.127
331 HA LYS 45 HA LYS 45 -0.635 -4.936 -1.724
332 HB2 LYS 45 2HB LYS 45 -1.778 -7.070 -2.046
333 HB3 LYS 45 1HB LYS 45 -3.298 -6.238 -2.329
334 HG2 LYS 45 2HG LYS 45 -2.275 -5.205 -4.365
335 HG3 LYS 45 1HG LYS 45 -0.874 -6.236 -4.109
336 HD2 LYS 45 2HD LYS 45 -3.679 -7.299 -4.402
337 HD3 LYS 45 1HD LYS 45 -2.583 -7.085 -5.759
338 HE2 LYS 45 2HE LYS 45 -2.000 -8.779 -3.338
339 HE3 LYS 45 1HE LYS 45 -2.643 -9.409 -4.849
340 HZ1 LYS 45 3HZ LYS 45 -0.603 -8.379 -5.921
341 HZ2 LYS 45 1HZ LYS 45 -0.310 -9.724 -4.949
342 HZ3 LYS 45 2HZ LYS 45 0.027 -8.213 -4.367
343 H GLY 46 H GLY 46 -0.497 -3.241 -2.966
344 HA2 GLY 46 2HA GLY 46 -2.887 -1.830 -3.801
345 HA3 GLY 46 1HA GLY 46 -1.688 -0.923 -2.883
346 H GLU 47 H GLU 47 -2.074 0.039 -5.265
347 HA GLU 47 HA GLU 47 0.251 -0.949 -6.730
348 HB2 GLU 47 2HB GLU 47 -1.831 -1.563 -7.884
349 HB3 GLU 47 1HB GLU 47 -2.313 0.117 -7.951
350 HG2 GLU 47 2HG GLU 47 0.269 -0.690 -9.209
351 HG3 GLU 47 1HG GLU 47 -1.227 -1.133 -10.015
352 H LEU 48 H LEU 48 1.736 0.439 -7.146
353 HA LEU 48 HA LEU 48 1.139 3.287 -7.090
354 HG LEU 48 HG LEU 48 4.004 4.275 -6.348
355 HB2 LEU 48 2HB LEU 48 1.978 2.617 -4.840
356 HB3 LEU 48 1HB LEU 48 3.426 2.009 -5.613
357 HD11 LEU 48 1HD1 LEU 48 2.814 6.205 -5.443
358 HD12 LEU 48 2HD1 LEU 48 1.585 5.134 -4.771
359 HD13 LEU 48 3HD1 LEU 48 1.797 5.250 -6.516
360 HD21 LEU 48 3HD2 LEU 48 4.881 3.416 -4.240
361 HD22 LEU 48 1HD2 LEU 48 3.479 4.054 -3.390
362 HD23 LEU 48 2HD2 LEU 48 4.621 5.158 -4.158
363 H ASN 49 H ASN 49 1.816 4.071 -8.907
364 HA ASN 49 HA ASN 49 2.958 4.574 -10.771
365 HB2 ASN 49 2HB ASN 49 5.326 3.283 -9.385
366 HB3 ASN 49 1HB ASN 49 5.431 4.145 -10.911
367 HD21 ASN 49 1HD2 ASN 49 5.350 4.390 -7.518
368 HD22 ASN 49 2HD2 ASN 49 5.443 6.106 -7.425
369 H GLY 50 H GLY 50 1.636 1.901 -10.448
370 HA2 GLY 50 2HA GLY 50 1.116 0.641 -12.385
371 HA3 GLY 50 1HA GLY 50 2.780 0.812 -12.916
372 H LYS 51 H LYS 51 3.266 0.215 -9.838
373 HA LYS 51 HA LYS 51 3.437 -2.678 -10.315
374 HB2 LYS 51 2HB LYS 51 4.994 -0.893 -8.448
375 HB3 LYS 51 1HB LYS 51 5.018 -2.636 -8.332
376 HG2 LYS 51 2HG LYS 51 6.966 -1.955 -9.445
377 HG3 LYS 51 1HG LYS 51 5.932 -2.714 -10.635
378 HD2 LYS 51 2HD LYS 51 5.261 -0.554 -11.517
379 HD3 LYS 51 1HD LYS 51 6.176 0.276 -10.252
380 HE2 LYS 51 2HE LYS 51 7.371 0.256 -12.391
381 HE3 LYS 51 1HE LYS 51 8.250 -0.612 -11.138
382 HZ1 LYS 51 3HZ LYS 51 8.302 -1.810 -13.207
383 HZ2 LYS 51 1HZ LYS 51 6.615 -1.859 -13.297
384 HZ3 LYS 51 2HZ LYS 51 7.419 -2.691 -12.079
385 H GLU 52 H GLU 52 2.421 -4.055 -9.049
386 HA GLU 52 HA GLU 52 1.231 -2.937 -6.666
387 HB2 GLU 52 2HB GLU 52 -0.519 -4.727 -6.736
388 HB3 GLU 52 1HB GLU 52 -0.753 -3.553 -7.980
389 HG2 GLU 52 2HG GLU 52 -1.205 -5.543 -9.049
390 HG3 GLU 52 1HG GLU 52 0.496 -5.343 -9.448
391 H GLY 53 H GLY 53 1.353 -4.009 -4.814
392 HA2 GLY 53 2HA GLY 53 2.628 -6.520 -4.617
393 HA3 GLY 53 1HA GLY 53 3.736 -5.194 -4.254
394 H VAL 54 H VAL 54 3.736 -6.201 -2.147
395 HA VAL 54 HA VAL 54 1.347 -5.426 -0.648
396 HB VAL 54 HB VAL 54 1.999 -7.102 1.071
397 HG11 VAL 54 1HG1 VAL 54 1.259 -9.086 -0.180
398 HG12 VAL 54 2HG1 VAL 54 1.533 -8.213 -1.690
399 HG13 VAL 54 3HG1 VAL 54 0.299 -7.659 -0.565
400 HG21 VAL 54 3HG2 VAL 54 4.374 -7.273 0.562
401 HG22 VAL 54 1HG2 VAL 54 4.006 -8.013 -0.998
402 HG23 VAL 54 2HG2 VAL 54 3.617 -8.867 0.499
403 H PHE 55 H PHE 55 1.563 -4.451 1.251
404 HA PHE 55 HA PHE 55 4.158 -3.634 2.207
405 HD1 PHE 55 2HD PHE 55 1.480 -2.111 -0.700
406 HD2 PHE 55 1HD PHE 55 1.516 -0.473 3.225
407 HE1 PHE 55 2HE PHE 55 -0.761 -1.187 -1.068
408 HE2 PHE 55 1HE PHE 55 -0.728 0.461 2.856
409 HZ PHE 55 HZ PHE 55 -1.870 0.101 0.709
410 HB2 PHE 55 2HB PHE 55 3.570 -1.226 2.138
411 HB3 PHE 55 1HB PHE 55 3.513 -1.962 0.528
412 HA PRO 56 HA PRO 56 1.866 -4.212 5.974
413 HB2 PRO 56 2HB PRO 56 3.478 -2.249 7.403
414 HB3 PRO 56 1HB PRO 56 3.452 -3.998 7.574
415 HG2 PRO 56 2HG PRO 56 5.572 -2.684 6.489
416 HG3 PRO 56 1HG PRO 56 5.115 -4.332 6.020
417 HD2 PRO 56 2HD PRO 56 4.576 -1.737 4.624
418 HD3 PRO 56 1HD PRO 56 5.061 -3.307 3.944
419 H ASP 57 H ASP 57 0.089 -3.406 6.881
420 HA ASP 57 HA ASP 57 -1.035 -0.999 5.883
421 HB2 ASP 57 2HB ASP 57 -3.053 -1.600 6.946
422 HB3 ASP 57 1HB ASP 57 -2.300 -3.125 6.528
423 H ASN 58 H ASN 58 1.053 -1.430 8.424
424 HA ASN 58 HA ASN 58 0.024 0.867 9.875
425 HB2 ASN 58 2HB ASN 58 1.716 0.358 11.598
426 HB3 ASN 58 1HB ASN 58 0.660 -1.008 11.274
427 HD21 ASN 58 1HD2 ASN 58 3.255 -0.896 12.505
428 HD22 ASN 58 2HD2 ASN 58 4.289 -1.917 11.587
429 H PHE 59 H PHE 59 1.899 0.430 7.281
430 HA PHE 59 HA PHE 59 3.711 2.642 7.914
431 HD1 PHE 59 1HD PHE 59 4.106 -0.440 8.243
432 HD2 PHE 59 2HD PHE 59 6.833 1.792 5.872
433 HE1 PHE 59 1HE PHE 59 5.979 -1.507 9.403
434 HE2 PHE 59 2HE PHE 59 8.718 0.737 7.035
435 HZ PHE 59 HZ PHE 59 8.290 -0.924 8.810
436 HB2 PHE 59 2HB PHE 59 3.678 0.613 5.695
437 HB3 PHE 59 1HB PHE 59 4.600 2.099 5.538
438 H ALA 60 H ALA 60 0.724 2.114 6.555
439 HA ALA 60 HA ALA 60 0.790 4.716 5.249
440 HB1 ALA 60 1HB ALA 60 -0.396 2.228 4.012
441 HB2 ALA 60 2HB ALA 60 1.080 3.030 3.480
442 HB3 ALA 60 3HB ALA 60 -0.467 3.860 3.342
443 H VAL 61 H VAL 61 -1.140 5.788 5.360
444 HA VAL 61 HA VAL 61 -3.119 4.532 7.109
445 HB VAL 61 HB VAL 61 -2.075 6.496 8.159
446 HG11 VAL 61 1HG1 VAL 61 -3.081 8.082 5.809
447 HG12 VAL 61 2HG1 VAL 61 -1.400 7.743 6.206
448 HG13 VAL 61 3HG1 VAL 61 -2.373 8.757 7.276
449 HG21 VAL 61 3HG2 VAL 61 -4.403 6.064 8.714
450 HG22 VAL 61 1HG2 VAL 61 -4.928 7.035 7.338
451 HG23 VAL 61 2HG2 VAL 61 -4.097 7.800 8.690
452 H GLN 62 H GLN 62 -5.026 4.114 6.293
453 HA GLN 62 HA GLN 62 -5.607 4.740 3.604
454 HB2 GLN 62 2HB GLN 62 -6.455 2.682 4.491
455 HB3 GLN 62 1HB GLN 62 -7.309 3.525 5.779
456 HG2 GLN 62 2HG GLN 62 -8.857 4.464 4.241
457 HG3 GLN 62 1HG GLN 62 -7.915 3.910 2.867
458 HE21 GLN 62 1HE2 GLN 62 -9.719 2.981 2.096
459 HE22 GLN 62 2HE2 GLN 62 -10.323 1.458 2.601
460 H ILE 63 H ILE 63 -6.466 6.441 2.775
461 HA ILE 63 HA ILE 63 -7.300 8.630 4.490
462 HB ILE 63 HB ILE 63 -7.172 8.536 1.461
463 HG12 ILE 63 2HG1 ILE 63 -4.967 7.989 2.345
464 HG13 ILE 63 1HG1 ILE 63 -4.954 9.582 1.616
465 HG21 ILE 63 1HG2 ILE 63 -7.001 10.981 1.620
466 HG22 ILE 63 2HG2 ILE 63 -7.158 10.870 3.370
467 HG23 ILE 63 3HG2 ILE 63 -8.497 10.375 2.336
468 HD11 ILE 63 3HD1 ILE 63 -3.666 9.584 3.673
469 HD12 ILE 63 1HD1 ILE 63 -5.058 8.978 4.572
470 HD13 ILE 63 2HD1 ILE 63 -5.104 10.589 3.861
471 H SER 64 H SER 64 -8.565 6.582 1.876
472 HA SER 64 HA SER 64 -11.239 7.180 2.743
473 HG SER 64 HG SER 64 -10.540 9.061 1.720
474 HB2 SER 64 2HB SER 64 -10.210 7.087 -0.104
475 HB3 SER 64 1HB SER 64 -11.893 7.306 0.390
Start of MODEL 18
1 H1 GLY 1 1HT GLY 1 -11.141 -11.443 0.040
2 H2 GLY 1 2HT GLY 1 -11.502 -11.498 -1.624
3 H3 GLY 1 3HT GLY 1 -12.660 -10.925 -0.509
4 HA2 GLY 1 1HA GLY 1 -10.065 -9.663 -1.009
5 HA3 GLY 1 2HA GLY 1 -11.582 -9.147 -1.732
6 H ALA 2 H ALA 2 -10.425 -7.287 -0.403
7 HA ALA 2 HA ALA 2 -12.179 -6.774 1.762
8 HB1 ALA 2 1HB ALA 2 -9.213 -6.935 2.352
9 HB2 ALA 2 2HB ALA 2 -10.458 -7.997 3.008
10 HB3 ALA 2 3HB ALA 2 -10.438 -6.292 3.451
11 H MET 3 H MET 3 -12.858 -5.117 0.576
12 HA MET 3 HA MET 3 -11.403 -2.693 0.629
13 HB2 MET 3 2HB MET 3 -11.261 -2.283 -1.773
14 HB3 MET 3 1HB MET 3 -10.388 -3.760 -1.412
15 HG2 MET 3 2HG MET 3 -13.159 -3.602 -2.609
16 HG3 MET 3 1HG MET 3 -11.675 -3.867 -3.513
17 HE1 MET 3 3HE MET 3 -12.709 -6.026 -4.656
18 HE2 MET 3 1HE MET 3 -14.223 -5.765 -3.788
19 HE3 MET 3 2HE MET 3 -13.455 -7.354 -3.764
20 H GLY 4 H GLY 4 -12.861 -0.993 0.496
21 HA2 GLY 4 2HA GLY 4 -15.643 -1.622 0.593
22 HA3 GLY 4 1HA GLY 4 -14.918 -0.013 0.611
23 H ALA 5 H ALA 5 -13.989 0.719 -1.489
24 HA ALA 5 HA ALA 5 -15.144 -0.439 -3.869
25 HB1 ALA 5 1HB ALA 5 -16.998 0.959 -3.037
26 HB2 ALA 5 2HB ALA 5 -16.351 1.549 -4.566
27 HB3 ALA 5 3HB ALA 5 -15.931 2.364 -3.059
28 H LYS 6 H LYS 6 -14.028 2.755 -3.014
29 HA LYS 6 HA LYS 6 -11.763 2.374 -4.835
30 HB2 LYS 6 2HB LYS 6 -13.463 4.817 -4.411
31 HB3 LYS 6 1HB LYS 6 -11.794 4.970 -4.937
32 HG2 LYS 6 2HG LYS 6 -13.213 5.074 -6.849
33 HG3 LYS 6 1HG LYS 6 -12.320 3.561 -6.885
34 HD2 LYS 6 2HD LYS 6 -14.320 2.404 -6.001
35 HD3 LYS 6 1HD LYS 6 -15.200 3.933 -6.074
36 HE2 LYS 6 2HE LYS 6 -15.682 2.563 -8.038
37 HE3 LYS 6 1HE LYS 6 -14.829 4.034 -8.488
38 HZ1 LYS 6 3HZ LYS 6 -13.561 1.376 -8.149
39 HZ2 LYS 6 1HZ LYS 6 -12.781 2.766 -8.686
40 HZ3 LYS 6 2HZ LYS 6 -13.989 2.026 -9.618
41 H GLU 7 H GLU 7 -10.292 1.763 -3.539
42 HA GLU 7 HA GLU 7 -10.049 3.086 -0.954
43 HB2 GLU 7 2HB GLU 7 -8.769 0.538 -1.867
44 HB3 GLU 7 1HB GLU 7 -8.984 1.106 -0.217
45 HG2 GLU 7 2HG GLU 7 -11.140 0.157 -2.096
46 HG3 GLU 7 1HG GLU 7 -10.445 -0.737 -0.749
47 H TYR 8 H TYR 8 -8.346 4.397 -0.660
48 HA TYR 8 HA TYR 8 -5.865 3.659 -1.793
49 HD1 TYR 8 1HD TYR 8 -6.381 7.944 -1.343
50 HD2 TYR 8 2HD TYR 8 -8.465 5.636 -4.241
51 HE1 TYR 8 1HE TYR 8 -8.025 9.749 -1.593
52 HE2 TYR 8 2HE TYR 8 -10.118 7.419 -4.495
53 HH TYR 8 HH TYR 8 -9.601 10.531 -3.162
54 HB2 TYR 8 2HB TYR 8 -5.354 6.087 -2.453
55 HB3 TYR 8 1HB TYR 8 -6.197 5.068 -3.621
56 H CYS 9 H CYS 9 -4.078 4.505 -0.872
57 HA CYS 9 HA CYS 9 -4.619 5.501 1.820
58 HG CYS 9 HG CYS 9 -2.757 3.142 -0.643
59 HB2 CYS 9 2HB CYS 9 -2.847 3.871 2.575
60 HB3 CYS 9 1HB CYS 9 -4.378 3.161 2.066
61 H ARG 10 H ARG 10 -3.019 6.675 2.762
62 HA ARG 10 HA ARG 10 -0.996 7.763 0.945
63 HE ARG 10 HE ARG 10 0.969 11.854 3.482
64 HB2 ARG 10 2HB ARG 10 -2.505 9.422 1.944
65 HB3 ARG 10 1HB ARG 10 -2.109 8.823 3.550
66 HG2 ARG 10 2HG ARG 10 0.207 9.567 3.254
67 HG3 ARG 10 1HG ARG 10 -0.201 10.187 1.654
68 HD2 ARG 10 2HD ARG 10 -1.795 11.728 2.641
69 HD3 ARG 10 1HD ARG 10 -1.463 11.077 4.241
70 HH11 ARG 10 1HH1 ARG 10 -2.102 13.600 3.279
71 HH12 ARG 10 2HH1 ARG 10 -1.406 15.133 3.538
72 HH21 ARG 10 1HH2 ARG 10 1.913 13.926 3.804
73 HH22 ARG 10 2HH2 ARG 10 0.952 15.328 3.840
74 H THR 11 H THR 11 1.067 7.468 1.400
75 HA THR 11 HA THR 11 1.968 5.531 3.251
76 HB THR 11 HB THR 11 4.183 6.398 2.525
77 HG1 THR 11 1HG THR 11 2.755 8.510 2.246
78 HG21 THR 11 3HG2 THR 11 2.146 6.121 0.298
79 HG22 THR 11 1HG2 THR 11 2.948 4.777 1.110
80 HG23 THR 11 2HG2 THR 11 3.890 5.909 0.138
81 H LEU 12 H LEU 12 2.782 5.845 5.329
82 HA LEU 12 HA LEU 12 2.841 8.621 6.317
83 HG LEU 12 HG LEU 12 0.528 6.637 6.862
84 HB2 LEU 12 2HB LEU 12 2.690 6.015 7.815
85 HB3 LEU 12 1HB LEU 12 2.811 7.588 8.569
86 HD11 LEU 12 1HD1 LEU 12 -0.711 6.627 9.020
87 HD12 LEU 12 2HD1 LEU 12 0.799 7.002 9.851
88 HD13 LEU 12 3HD1 LEU 12 0.620 5.470 8.997
89 HD21 LEU 12 3HD2 LEU 12 -0.602 8.678 7.699
90 HD22 LEU 12 1HD2 LEU 12 0.811 9.045 6.707
91 HD23 LEU 12 2HD2 LEU 12 0.907 9.171 8.462
92 H PHE 13 H PHE 13 4.779 5.939 5.504
93 HA PHE 13 HA PHE 13 7.174 7.289 6.461
94 HD1 PHE 13 2HD PHE 13 8.158 7.074 9.098
95 HD2 PHE 13 1HD PHE 13 4.780 4.522 8.730
96 HE1 PHE 13 2HE PHE 13 7.397 7.765 11.335
97 HE2 PHE 13 1HE PHE 13 4.010 5.202 10.960
98 HZ PHE 13 HZ PHE 13 5.318 6.827 12.269
99 HB2 PHE 13 2HB PHE 13 6.495 4.408 7.166
100 HB3 PHE 13 1HB PHE 13 8.055 5.166 7.439
101 HA PRO 14 HA PRO 14 8.507 5.493 2.593
102 HB2 PRO 14 2HB PRO 14 11.197 5.662 2.880
103 HB3 PRO 14 1HB PRO 14 10.188 7.073 2.549
104 HG2 PRO 14 2HG PRO 14 11.379 6.156 5.126
105 HG3 PRO 14 1HG PRO 14 11.192 7.803 4.503
106 HD2 PRO 14 2HD PRO 14 9.532 6.657 6.373
107 HD3 PRO 14 1HD PRO 14 9.050 7.978 5.288
108 H TYR 15 H TYR 15 9.018 3.493 1.872
109 HA TYR 15 HA TYR 15 10.368 1.580 3.600
110 HD1 TYR 15 2HD TYR 15 9.220 -0.260 5.495
111 HD2 TYR 15 1HD TYR 15 7.616 -1.032 1.632
112 HE1 TYR 15 2HE TYR 15 9.316 -2.673 5.942
113 HE2 TYR 15 1HE TYR 15 7.702 -3.444 2.070
114 HH TYR 15 HH TYR 15 8.858 -5.014 3.495
115 HB2 TYR 15 2HB TYR 15 7.966 1.472 4.198
116 HB3 TYR 15 1HB TYR 15 7.571 1.181 2.516
117 H THR 16 H THR 16 11.425 0.059 2.387
118 HA THR 16 HA THR 16 11.194 0.330 -0.519
119 HB THR 16 HB THR 16 13.595 -0.477 1.136
120 HG1 THR 16 1HG THR 16 12.543 1.871 0.634
121 HG21 THR 16 3HG2 THR 16 13.348 0.128 -1.832
122 HG22 THR 16 1HG2 THR 16 13.573 -1.478 -1.134
123 HG23 THR 16 2HG2 THR 16 14.840 -0.263 -0.975
124 H GLY 17 H GLY 17 10.698 -1.428 -1.652
125 HA2 GLY 17 2HA GLY 17 10.264 -3.891 -0.251
126 HA3 GLY 17 1HA GLY 17 9.822 -3.521 -1.923
127 H THR 18 H THR 18 11.781 -5.459 -0.121
128 HA THR 18 HA THR 18 14.188 -5.212 -1.538
129 HB THR 18 HB THR 18 13.000 -7.169 0.421
130 HG1 THR 18 1HG THR 18 13.740 -4.625 0.655
131 HG21 THR 18 3HG2 THR 18 15.795 -6.507 -0.358
132 HG22 THR 18 1HG2 THR 18 14.877 -7.963 -0.785
133 HG23 THR 18 2HG2 THR 18 15.300 -7.655 0.927
134 H ASN 19 H ASN 19 11.187 -6.856 -1.450
135 HA ASN 19 HA ASN 19 11.879 -8.861 -3.455
136 HB2 ASN 19 2HB ASN 19 9.330 -8.295 -1.931
137 HB3 ASN 19 1HB ASN 19 9.579 -9.641 -3.028
138 HD21 ASN 19 1HD2 ASN 19 10.392 -8.282 0.122
139 HD22 ASN 19 2HD2 ASN 19 10.990 -9.752 0.771
140 H GLU 20 H GLU 20 10.262 -9.024 -5.307
141 HA GLU 20 HA GLU 20 9.882 -6.381 -6.386
142 HB2 GLU 20 2HB GLU 20 9.187 -7.532 -8.476
143 HB3 GLU 20 1HB GLU 20 10.758 -8.065 -7.921
144 HG2 GLU 20 2HG GLU 20 8.220 -9.597 -7.416
145 HG3 GLU 20 1HG GLU 20 9.208 -9.822 -8.855
146 H ASP 21 H ASP 21 8.021 -8.848 -4.914
147 HA ASP 21 HA ASP 21 5.517 -7.522 -5.599
148 HB2 ASP 21 2HB ASP 21 6.034 -10.075 -4.060
149 HB3 ASP 21 1HB ASP 21 4.433 -9.373 -4.279
150 H GLU 22 H GLU 22 7.762 -6.732 -3.663
151 HA GLU 22 HA GLU 22 5.999 -5.950 -1.467
152 HB2 GLU 22 2HB GLU 22 7.989 -7.293 -0.861
153 HB3 GLU 22 1HB GLU 22 9.022 -6.102 -1.640
154 HG2 GLU 22 2HG GLU 22 8.318 -4.459 0.052
155 HG3 GLU 22 1HG GLU 22 7.317 -5.704 0.798
156 H LEU 23 H LEU 23 5.709 -3.748 -1.265
157 HA LEU 23 HA LEU 23 6.357 -2.328 -3.727
158 HG LEU 23 HG LEU 23 4.012 -1.564 -4.547
159 HB2 LEU 23 2HB LEU 23 4.067 -2.583 -2.337
160 HB3 LEU 23 1HB LEU 23 4.665 -1.105 -1.630
161 HD11 LEU 23 1HD1 LEU 23 2.064 -1.390 -3.156
162 HD12 LEU 23 2HD1 LEU 23 2.241 0.055 -4.151
163 HD13 LEU 23 3HD1 LEU 23 2.675 0.103 -2.443
164 HD21 LEU 23 3HD2 LEU 23 4.451 0.787 -4.902
165 HD22 LEU 23 1HD2 LEU 23 5.899 0.004 -4.284
166 HD23 LEU 23 2HD2 LEU 23 4.905 0.994 -3.210
167 H THR 24 H THR 24 7.843 -0.727 -3.856
168 HA THR 24 HA THR 24 9.013 0.353 -1.426
169 HB THR 24 HB THR 24 9.697 0.696 -4.367
170 HG1 THR 24 1HG THR 24 11.196 -0.816 -4.017
171 HG21 THR 24 3HG2 THR 24 10.359 2.701 -3.122
172 HG22 THR 24 1HG2 THR 24 11.782 1.776 -3.588
173 HG23 THR 24 2HG2 THR 24 11.198 1.718 -1.925
174 H PHE 25 H PHE 25 8.197 2.174 -0.630
175 HA PHE 25 HA PHE 25 7.052 4.078 -2.456
176 HD1 PHE 25 2HD PHE 25 5.333 0.875 -0.700
177 HD2 PHE 25 1HD PHE 25 5.437 4.484 1.532
178 HE1 PHE 25 2HE PHE 25 4.977 -0.394 1.350
179 HE2 PHE 25 1HE PHE 25 5.068 3.224 3.598
180 HZ PHE 25 HZ PHE 25 4.835 0.771 3.513
181 HB2 PHE 25 2HB PHE 25 5.148 4.502 -0.864
182 HB3 PHE 25 1HB PHE 25 5.077 3.013 -1.786
183 H ARG 26 H ARG 26 7.083 6.154 -1.890
184 HA ARG 26 HA ARG 26 9.035 6.879 0.110
185 HE ARG 26 HE ARG 26 7.463 10.494 -2.928
186 HB2 ARG 26 2HB ARG 26 9.389 7.647 -2.135
187 HB3 ARG 26 1HB ARG 26 7.736 8.245 -2.237
188 HG2 ARG 26 2HG ARG 26 8.245 9.929 -0.619
189 HG3 ARG 26 1HG ARG 26 9.903 9.314 -0.485
190 HD2 ARG 26 2HD ARG 26 9.843 11.261 -1.973
191 HD3 ARG 26 1HD ARG 26 10.261 9.784 -2.829
192 HH11 ARG 26 1HH1 ARG 26 10.621 10.684 -4.533
193 HH12 ARG 26 2HH1 ARG 26 9.984 11.110 -6.041
194 HH21 ARG 26 1HH2 ARG 26 6.599 11.043 -4.909
195 HH22 ARG 26 2HH2 ARG 26 7.575 11.318 -6.289
196 H GLU 27 H GLU 27 8.473 8.766 1.400
197 HA GLU 27 HA GLU 27 5.851 8.655 2.563
198 HB2 GLU 27 2HB GLU 27 7.885 9.184 3.858
199 HB3 GLU 27 1HB GLU 27 8.083 10.650 2.910
200 HG2 GLU 27 2HG GLU 27 5.722 11.244 3.768
201 HG3 GLU 27 1HG GLU 27 6.049 10.022 4.999
202 H GLY 28 H GLY 28 4.184 9.684 1.725
203 HA2 GLY 28 2HA GLY 28 3.163 11.847 1.246
204 HA3 GLY 28 1HA GLY 28 4.617 12.250 0.336
205 H GLU 29 H GLU 29 3.680 9.037 -0.074
206 HA GLU 29 HA GLU 29 2.724 9.733 -2.729
207 HB2 GLU 29 2HB GLU 29 3.700 7.076 -1.678
208 HB3 GLU 29 1HB GLU 29 3.251 7.422 -3.339
209 HG2 GLU 29 2HG GLU 29 5.575 8.556 -1.808
210 HG3 GLU 29 1HG GLU 29 5.639 7.410 -3.146
211 H ILE 30 H ILE 30 0.913 8.661 -3.606
212 HA ILE 30 HA ILE 30 -0.979 7.705 -1.591
213 HB ILE 30 HB ILE 30 -1.559 8.913 -4.318
214 HG12 ILE 30 2HG1 ILE 30 -0.803 10.632 -2.726
215 HG13 ILE 30 1HG1 ILE 30 -2.514 10.804 -3.098
216 HG21 ILE 30 1HG2 ILE 30 -3.466 8.025 -2.149
217 HG22 ILE 30 2HG2 ILE 30 -3.235 7.254 -3.718
218 HG23 ILE 30 3HG2 ILE 30 -3.927 8.871 -3.626
219 HD11 ILE 30 3HD1 ILE 30 -3.075 9.757 -0.949
220 HD12 ILE 30 1HD1 ILE 30 -2.080 11.199 -0.742
221 HD13 ILE 30 2HD1 ILE 30 -1.356 9.600 -0.588
222 H ILE 31 H ILE 31 -1.108 5.661 -1.621
223 HA ILE 31 HA ILE 31 -0.438 4.123 -4.024
224 HB ILE 31 HB ILE 31 -0.899 3.172 -1.172
225 HG12 ILE 31 2HG1 ILE 31 1.710 3.494 -2.665
226 HG13 ILE 31 1HG1 ILE 31 1.137 4.577 -1.398
227 HG21 ILE 31 1HG2 ILE 31 -1.377 1.435 -2.811
228 HG22 ILE 31 2HG2 ILE 31 0.103 1.054 -1.928
229 HG23 ILE 31 3HG2 ILE 31 0.195 1.691 -3.569
230 HD11 ILE 31 3HD1 ILE 31 2.805 3.016 -0.562
231 HD12 ILE 31 1HD1 ILE 31 1.809 1.658 -1.080
232 HD13 ILE 31 2HD1 ILE 31 1.241 2.728 0.202
233 H HIS 32 H HIS 32 -2.017 2.973 -5.073
234 HA HIS 32 HA HIS 32 -4.742 3.382 -4.161
235 HD1 HIS 32 1HD HIS 32 -2.694 3.892 -8.157
236 HD2 HIS 32 2HD HIS 32 -6.016 5.164 -5.996
237 HE1 HIS 32 1HE HIS 32 -3.150 6.245 -8.897
238 HB2 HIS 32 2HB HIS 32 -3.637 2.088 -6.682
239 HB3 HIS 32 1HB HIS 32 -5.349 2.280 -6.331
240 H LEU 33 H LEU 33 -5.701 1.938 -2.965
241 HA LEU 33 HA LEU 33 -4.222 -0.389 -2.218
242 HG LEU 33 HG LEU 33 -5.066 -1.303 0.144
243 HB2 LEU 33 2HB LEU 33 -5.354 1.107 -0.590
244 HB3 LEU 33 1HB LEU 33 -6.895 0.668 -1.263
245 HD11 LEU 33 1HD1 LEU 33 -6.533 -0.991 2.072
246 HD12 LEU 33 2HD1 LEU 33 -7.393 0.284 1.213
247 HD13 LEU 33 3HD1 LEU 33 -5.696 0.498 1.647
248 HD21 LEU 33 3HD2 LEU 33 -6.784 -2.306 -1.327
249 HD22 LEU 33 1HD2 LEU 33 -8.032 -1.418 -0.455
250 HD23 LEU 33 2HD2 LEU 33 -7.078 -2.656 0.371
251 H ILE 34 H ILE 34 -4.484 -2.282 -2.993
252 HA ILE 34 HA ILE 34 -6.594 -2.753 -4.934
253 HB ILE 34 HB ILE 34 -4.098 -4.341 -4.267
254 HG12 ILE 34 2HG1 ILE 34 -3.532 -2.236 -5.348
255 HG13 ILE 34 1HG1 ILE 34 -3.263 -3.567 -6.464
256 HG21 ILE 34 1HG2 ILE 34 -4.547 -5.637 -6.296
257 HG22 ILE 34 2HG2 ILE 34 -6.075 -4.779 -6.494
258 HG23 ILE 34 3HG2 ILE 34 -5.828 -5.823 -5.095
259 HD11 ILE 34 3HD1 ILE 34 -5.400 -3.031 -7.567
260 HD12 ILE 34 1HD1 ILE 34 -4.257 -1.687 -7.611
261 HD13 ILE 34 2HD1 ILE 34 -5.598 -1.660 -6.472
262 H SER 35 H SER 35 -5.129 -4.251 -2.051
263 HA SER 35 HA SER 35 -7.688 -5.349 -1.281
264 HG SER 35 HG SER 35 -7.373 -6.216 -3.403
265 HB2 SER 35 2HB SER 35 -5.366 -7.148 -2.004
266 HB3 SER 35 1HB SER 35 -6.849 -7.689 -1.223
267 H LYS 36 H LYS 36 -7.794 -5.310 0.939
268 HA LYS 36 HA LYS 36 -5.360 -5.000 2.489
269 HB2 LYS 36 2HB LYS 36 -8.256 -5.278 3.338
270 HB3 LYS 36 1HB LYS 36 -6.935 -5.065 4.470
271 HG2 LYS 36 2HG LYS 36 -6.444 -2.890 3.486
272 HG3 LYS 36 1HG LYS 36 -7.769 -3.054 2.357
273 HD2 LYS 36 2HD LYS 36 -7.966 -2.948 5.371
274 HD3 LYS 36 1HD LYS 36 -8.409 -1.667 4.246
275 HE2 LYS 36 2HE LYS 36 -10.157 -3.150 3.308
276 HE3 LYS 36 1HE LYS 36 -9.726 -4.368 4.503
277 HZ1 LYS 36 3HZ LYS 36 -10.797 -1.662 5.081
278 HZ2 LYS 36 1HZ LYS 36 -10.318 -2.781 6.255
279 HZ3 LYS 36 2HZ LYS 36 -11.619 -3.117 5.247
280 H GLU 37 H GLU 37 -7.237 -7.488 1.285
281 HA GLU 37 HA GLU 37 -6.378 -9.425 3.282
282 HB2 GLU 37 2HB GLU 37 -8.751 -9.422 2.637
283 HB3 GLU 37 1HB GLU 37 -8.300 -9.667 0.960
284 HG2 GLU 37 2HG GLU 37 -7.335 -11.849 1.569
285 HG3 GLU 37 1HG GLU 37 -7.878 -11.597 3.228
286 H THR 38 H THR 38 -4.247 -9.768 2.792
287 HA THR 38 HA THR 38 -3.576 -10.647 0.081
288 HB THR 38 HB THR 38 -1.225 -10.475 1.048
289 HG1 THR 38 1HG THR 38 -2.067 -8.739 3.006
290 HG21 THR 38 3HG2 THR 38 -2.196 -8.739 -0.394
291 HG22 THR 38 1HG2 THR 38 -1.184 -8.023 0.863
292 HG23 THR 38 2HG2 THR 38 -2.941 -7.984 1.017
293 H GLY 39 H GLY 39 -4.605 -11.822 2.889
294 HA2 GLY 39 2HA GLY 39 -4.758 -14.313 2.975
295 HA3 GLY 39 1HA GLY 39 -3.005 -14.289 2.777
296 H GLU 40 H GLU 40 -2.379 -12.116 4.371
297 HA GLU 40 HA GLU 40 -3.200 -13.046 7.019
298 HB2 GLU 40 2HB GLU 40 -0.471 -12.038 6.190
299 HB3 GLU 40 1HB GLU 40 -0.943 -12.454 7.827
300 HG2 GLU 40 2HG GLU 40 -1.315 -14.782 7.104
301 HG3 GLU 40 1HG GLU 40 -0.769 -14.341 5.487
302 H ALA 41 H ALA 41 -3.985 -11.541 8.301
303 HA ALA 41 HA ALA 41 -4.543 -8.930 7.346
304 HB1 ALA 41 1HB ALA 41 -5.546 -8.551 9.548
305 HB2 ALA 41 2HB ALA 41 -4.786 -10.023 10.152
306 HB3 ALA 41 3HB ALA 41 -6.025 -10.123 8.903
307 H GLY 42 H GLY 42 -3.308 -7.192 7.375
308 HA2 GLY 42 2HA GLY 42 -1.918 -5.773 8.927
309 HA3 GLY 42 1HA GLY 42 -0.912 -7.210 9.083
310 H TRP 43 H TRP 43 -1.455 -7.909 6.261
311 HA TRP 43 HA TRP 43 0.423 -6.018 5.068
312 HD1 TRP 43 HD TRP 43 1.089 -9.513 6.880
313 HE1 TRP 43 1HE TRP 43 3.579 -9.502 7.546
314 HE3 TRP 43 3HE TRP 43 2.940 -6.745 3.012
315 HZ2 TRP 43 2HZ TRP 43 6.012 -8.460 6.537
316 HZ3 TRP 43 3HZ TRP 43 5.347 -6.286 2.927
317 HH2 TRP 43 HH TRP 43 6.848 -7.124 4.647
318 HB2 TRP 43 2HB TRP 43 -0.112 -8.931 4.497
319 HB3 TRP 43 1HB TRP 43 0.784 -7.906 3.390
320 H TRP 44 H TRP 44 -0.288 -4.759 3.561
321 HA TRP 44 HA TRP 44 -2.878 -5.344 2.318
322 HD1 TRP 44 HD TRP 44 -3.479 -5.109 4.616
323 HE1 TRP 44 1HE TRP 44 -5.102 -3.995 6.243
324 HE3 TRP 44 3HE TRP 44 -3.193 -0.322 2.871
325 HZ2 TRP 44 2HZ TRP 44 -6.137 -1.404 6.738
326 HZ3 TRP 44 3HZ TRP 44 -4.535 1.413 3.976
327 HH2 TRP 44 HH TRP 44 -5.980 0.872 5.862
328 HB2 TRP 44 2HB TRP 44 -1.447 -2.756 2.890
329 HB3 TRP 44 1HB TRP 44 -2.794 -2.860 1.770
330 H LYS 45 H LYS 45 -3.067 -4.916 0.099
331 HA LYS 45 HA LYS 45 -0.499 -4.901 -1.337
332 HB2 LYS 45 2HB LYS 45 -1.933 -6.998 -1.514
333 HB3 LYS 45 1HB LYS 45 -3.162 -6.004 -2.254
334 HG2 LYS 45 2HG LYS 45 -1.661 -5.505 -4.126
335 HG3 LYS 45 1HG LYS 45 -0.408 -6.504 -3.387
336 HD2 LYS 45 2HD LYS 45 -1.916 -8.445 -3.491
337 HD3 LYS 45 1HD LYS 45 -3.138 -7.444 -4.268
338 HE2 LYS 45 2HE LYS 45 -2.001 -8.748 -5.931
339 HE3 LYS 45 1HE LYS 45 -1.571 -7.056 -6.146
340 HZ1 LYS 45 3HZ LYS 45 0.293 -8.642 -6.353
341 HZ2 LYS 45 1HZ LYS 45 0.120 -9.069 -4.751
342 HZ3 LYS 45 2HZ LYS 45 0.606 -7.498 -5.201
343 H GLY 46 H GLY 46 -0.219 -3.241 -2.673
344 HA2 GLY 46 2HA GLY 46 -2.526 -1.676 -3.526
345 HA3 GLY 46 1HA GLY 46 -1.234 -0.863 -2.652
346 H GLU 47 H GLU 47 -1.947 -0.177 -5.236
347 HA GLU 47 HA GLU 47 0.376 -1.151 -6.745
348 HB2 GLU 47 2HB GLU 47 -1.997 -1.764 -7.567
349 HB3 GLU 47 1HB GLU 47 -2.178 -0.067 -7.950
350 HG2 GLU 47 2HG GLU 47 0.009 -1.792 -9.109
351 HG3 GLU 47 1HG GLU 47 -1.571 -1.614 -9.855
352 H LEU 48 H LEU 48 1.812 0.288 -7.155
353 HA LEU 48 HA LEU 48 1.131 3.059 -7.558
354 HG LEU 48 HG LEU 48 3.912 4.208 -6.613
355 HB2 LEU 48 2HB LEU 48 1.562 2.998 -5.154
356 HB3 LEU 48 1HB LEU 48 3.085 2.178 -5.425
357 HD11 LEU 48 1HD1 LEU 48 1.366 5.457 -5.611
358 HD12 LEU 48 2HD1 LEU 48 1.812 5.180 -7.296
359 HD13 LEU 48 3HD1 LEU 48 2.729 6.323 -6.319
360 HD21 LEU 48 3HD2 LEU 48 4.456 3.802 -4.262
361 HD22 LEU 48 1HD2 LEU 48 3.000 4.668 -3.775
362 HD23 LEU 48 2HD2 LEU 48 4.298 5.526 -4.600
363 H ASN 49 H ASN 49 2.045 3.513 -9.397
364 HA ASN 49 HA ASN 49 3.573 3.956 -10.957
365 HB2 ASN 49 2HB ASN 49 5.575 2.964 -8.916
366 HB3 ASN 49 1HB ASN 49 6.036 3.639 -10.478
367 HD21 ASN 49 1HD2 ASN 49 6.626 4.622 -7.783
368 HD22 ASN 49 2HD2 ASN 49 6.003 6.215 -7.702
369 H GLY 50 H GLY 50 2.276 1.250 -10.610
370 HA2 GLY 50 2HA GLY 50 2.084 -0.033 -12.608
371 HA3 GLY 50 1HA GLY 50 3.823 0.101 -12.808
372 H LYS 51 H LYS 51 3.247 -0.449 -9.617
373 HA LYS 51 HA LYS 51 3.423 -3.340 -10.026
374 HB2 LYS 51 2HB LYS 51 5.148 -1.782 -8.086
375 HB3 LYS 51 1HB LYS 51 5.078 -3.529 -8.202
376 HG2 LYS 51 2HG LYS 51 7.015 -2.979 -9.307
377 HG3 LYS 51 1HG LYS 51 5.868 -3.217 -10.614
378 HD2 LYS 51 2HD LYS 51 5.458 -0.741 -10.629
379 HD3 LYS 51 1HD LYS 51 6.781 -0.567 -9.483
380 HE2 LYS 51 2HE LYS 51 8.333 -1.489 -11.102
381 HE3 LYS 51 1HE LYS 51 7.011 -1.777 -12.235
382 HZ1 LYS 51 3HZ LYS 51 7.996 0.857 -11.286
383 HZ2 LYS 51 1HZ LYS 51 6.611 0.659 -12.224
384 HZ3 LYS 51 2HZ LYS 51 8.132 0.257 -12.826
385 H GLU 52 H GLU 52 2.245 -4.494 -8.752
386 HA GLU 52 HA GLU 52 0.934 -3.086 -6.569
387 HB2 GLU 52 2HB GLU 52 -0.872 -4.769 -6.702
388 HB3 GLU 52 1HB GLU 52 -0.784 -3.725 -8.109
389 HG2 GLU 52 2HG GLU 52 0.411 -5.563 -9.310
390 HG3 GLU 52 1HG GLU 52 0.124 -6.595 -7.909
391 H GLY 53 H GLY 53 2.045 -3.393 -4.964
392 HA2 GLY 53 2HA GLY 53 3.065 -6.102 -4.437
393 HA3 GLY 53 1HA GLY 53 3.940 -4.638 -4.002
394 H VAL 54 H VAL 54 3.805 -6.043 -1.997
395 HA VAL 54 HA VAL 54 1.409 -5.254 -0.531
396 HB VAL 54 HB VAL 54 1.878 -7.098 1.039
397 HG11 VAL 54 1HG1 VAL 54 1.676 -7.985 -1.824
398 HG12 VAL 54 2HG1 VAL 54 0.343 -7.503 -0.776
399 HG13 VAL 54 3HG1 VAL 54 1.257 -8.969 -0.420
400 HG21 VAL 54 3HG2 VAL 54 3.530 -8.837 0.492
401 HG22 VAL 54 1HG2 VAL 54 4.302 -7.269 0.747
402 HG23 VAL 54 2HG2 VAL 54 4.069 -7.882 -0.892
403 H PHE 55 H PHE 55 1.672 -4.610 1.572
404 HA PHE 55 HA PHE 55 4.278 -3.833 2.467
405 HD1 PHE 55 2HD PHE 55 1.606 -0.833 3.741
406 HD2 PHE 55 1HD PHE 55 1.667 -2.009 -0.353
407 HE1 PHE 55 2HE PHE 55 -0.633 0.118 3.442
408 HE2 PHE 55 1HE PHE 55 -0.573 -1.047 -0.662
409 HZ PHE 55 HZ PHE 55 -1.726 0.019 1.229
410 HB2 PHE 55 2HB PHE 55 3.714 -1.438 2.592
411 HB3 PHE 55 1HB PHE 55 3.670 -2.042 0.934
412 HA PRO 56 HA PRO 56 1.984 -4.393 6.231
413 HB2 PRO 56 2HB PRO 56 3.739 -2.657 7.741
414 HB3 PRO 56 1HB PRO 56 3.681 -4.418 7.727
415 HG2 PRO 56 2HG PRO 56 5.780 -3.001 6.710
416 HG3 PRO 56 1HG PRO 56 5.297 -4.612 6.142
417 HD2 PRO 56 2HD PRO 56 4.713 -1.934 4.951
418 HD3 PRO 56 1HD PRO 56 5.202 -3.450 4.157
419 H ASP 57 H ASP 57 0.269 -3.495 7.030
420 HA ASP 57 HA ASP 57 -0.999 -1.172 6.364
421 HB2 ASP 57 2HB ASP 57 -2.250 -2.802 7.442
422 HB3 ASP 57 1HB ASP 57 -1.157 -2.896 8.812
423 H ASN 58 H ASN 58 1.298 -1.533 8.954
424 HA ASN 58 HA ASN 58 0.796 0.846 10.378
425 HB2 ASN 58 2HB ASN 58 3.311 -0.804 10.220
426 HB3 ASN 58 1HB ASN 58 3.045 0.511 11.362
427 HD21 ASN 58 1HD2 ASN 58 1.663 0.194 13.083
428 HD22 ASN 58 2HD2 ASN 58 1.061 -1.379 13.496
429 H PHE 59 H PHE 59 2.341 0.460 7.365
430 HA PHE 59 HA PHE 59 3.882 2.900 7.751
431 HD1 PHE 59 2HD PHE 59 4.501 -0.680 7.617
432 HD2 PHE 59 1HD PHE 59 6.934 2.577 6.377
433 HE1 PHE 59 2HE PHE 59 6.394 -1.624 8.871
434 HE2 PHE 59 1HE PHE 59 8.832 1.647 7.634
435 HZ PHE 59 HZ PHE 59 8.564 -0.459 8.883
436 HB2 PHE 59 2HB PHE 59 3.957 0.796 5.599
437 HB3 PHE 59 1HB PHE 59 4.814 2.328 5.457
438 H ALA 60 H ALA 60 0.793 2.301 6.950
439 HA ALA 60 HA ALA 60 0.678 4.668 5.275
440 HB1 ALA 60 1HB ALA 60 -0.768 3.614 3.629
441 HB2 ALA 60 2HB ALA 60 -0.640 2.077 4.477
442 HB3 ALA 60 3HB ALA 60 0.785 2.778 3.706
443 H VAL 61 H VAL 61 -1.617 5.317 4.921
444 HA VAL 61 HA VAL 61 -3.466 4.446 7.000
445 HB VAL 61 HB VAL 61 -2.307 6.502 7.815
446 HG11 VAL 61 1HG1 VAL 61 -1.761 7.601 5.752
447 HG12 VAL 61 2HG1 VAL 61 -2.714 8.686 6.771
448 HG13 VAL 61 3HG1 VAL 61 -3.469 7.866 5.405
449 HG21 VAL 61 3HG2 VAL 61 -4.299 7.833 8.350
450 HG22 VAL 61 1HG2 VAL 61 -4.547 6.102 8.573
451 HG23 VAL 61 2HG2 VAL 61 -5.207 6.913 7.150
452 H GLN 62 H GLN 62 -5.546 4.241 6.174
453 HA GLN 62 HA GLN 62 -5.706 4.607 3.316
454 HB2 GLN 62 2HB GLN 62 -6.547 2.522 4.466
455 HB3 GLN 62 1HB GLN 62 -7.868 3.493 5.108
456 HG2 GLN 62 2HG GLN 62 -8.545 4.057 2.825
457 HG3 GLN 62 1HG GLN 62 -7.249 3.050 2.199
458 HE21 GLN 62 1HE2 GLN 62 -10.016 2.864 1.713
459 HE22 GLN 62 2HE2 GLN 62 -10.533 1.299 2.196
460 H ILE 63 H ILE 63 -6.695 6.185 2.316
461 HA ILE 63 HA ILE 63 -7.811 8.368 3.910
462 HB ILE 63 HB ILE 63 -7.348 8.274 0.917
463 HG12 ILE 63 2HG1 ILE 63 -5.249 7.780 2.021
464 HG13 ILE 63 1HG1 ILE 63 -5.193 9.373 1.295
465 HG21 ILE 63 1HG2 ILE 63 -7.563 10.594 2.831
466 HG22 ILE 63 2HG2 ILE 63 -8.807 10.061 1.708
467 HG23 ILE 63 3HG2 ILE 63 -7.288 10.717 1.091
468 HD11 ILE 63 3HD1 ILE 63 -5.607 10.389 3.519
469 HD12 ILE 63 1HD1 ILE 63 -4.134 9.417 3.497
470 HD13 ILE 63 2HD1 ILE 63 -5.598 8.777 4.234
471 H SER 64 H SER 64 -8.592 6.416 1.082
472 HA SER 64 HA SER 64 -11.407 7.036 1.471
473 HG SER 64 HG SER 64 -11.947 5.855 -1.523
474 HB2 SER 64 2HB SER 64 -10.353 7.926 -0.648
475 HB3 SER 64 1HB SER 64 -9.958 6.270 -1.084
Start of MODEL 19
1 H1 GLY 1 1HT GLY 1 -12.346 -12.304 -1.687
2 H2 GLY 1 2HT GLY 1 -11.104 -13.066 -2.549
3 H3 GLY 1 3HT GLY 1 -11.908 -11.715 -3.211
4 HA2 GLY 1 1HA GLY 1 -10.179 -11.729 -0.828
5 HA3 GLY 1 2HA GLY 1 -9.787 -11.089 -2.422
6 H ALA 2 H ALA 2 -9.498 -9.259 -0.654
7 HA ALA 2 HA ALA 2 -12.041 -7.972 -0.094
8 HB1 ALA 2 1HB ALA 2 -10.774 -6.371 1.277
9 HB2 ALA 2 2HB ALA 2 -9.272 -7.142 0.786
10 HB3 ALA 2 3HB ALA 2 -10.447 -8.037 1.753
11 H MET 3 H MET 3 -12.477 -7.618 -2.227
12 HA MET 3 HA MET 3 -11.211 -5.198 -3.303
13 HB2 MET 3 2HB MET 3 -10.987 -7.023 -4.907
14 HB3 MET 3 1HB MET 3 -12.683 -7.434 -4.731
15 HG2 MET 3 2HG MET 3 -12.245 -6.290 -6.849
16 HG3 MET 3 1HG MET 3 -13.341 -5.373 -5.827
17 HE1 MET 3 3HE MET 3 -9.694 -5.672 -7.234
18 HE2 MET 3 1HE MET 3 -9.396 -5.638 -5.498
19 HE3 MET 3 2HE MET 3 -8.896 -4.280 -6.505
20 H GLY 4 H GLY 4 -12.371 -3.705 -2.325
21 HA2 GLY 4 2HA GLY 4 -15.282 -4.008 -2.296
22 HA3 GLY 4 1HA GLY 4 -14.357 -2.915 -1.273
23 H ALA 5 H ALA 5 -12.850 -1.435 -2.850
24 HA ALA 5 HA ALA 5 -14.331 -0.460 -5.063
25 HB1 ALA 5 1HB ALA 5 -15.577 0.532 -3.217
26 HB2 ALA 5 2HB ALA 5 -14.615 1.779 -4.010
27 HB3 ALA 5 3HB ALA 5 -14.084 1.094 -2.477
28 H LYS 6 H LYS 6 -13.153 1.839 -5.311
29 HA LYS 6 HA LYS 6 -10.302 1.217 -5.480
30 HB2 LYS 6 2HB LYS 6 -11.764 3.628 -6.612
31 HB3 LYS 6 1HB LYS 6 -10.144 3.085 -7.027
32 HG2 LYS 6 2HG LYS 6 -11.058 1.071 -8.021
33 HG3 LYS 6 1HG LYS 6 -12.691 1.576 -7.601
34 HD2 LYS 6 2HD LYS 6 -12.302 3.618 -9.022
35 HD3 LYS 6 1HD LYS 6 -10.787 2.878 -9.546
36 HE2 LYS 6 2HE LYS 6 -13.559 1.741 -9.902
37 HE3 LYS 6 1HE LYS 6 -12.536 2.425 -11.165
38 HZ1 LYS 6 3HZ LYS 6 -11.904 -0.030 -9.590
39 HZ2 LYS 6 1HZ LYS 6 -10.973 0.623 -10.826
40 HZ3 LYS 6 2HZ LYS 6 -12.490 -0.006 -11.156
41 H GLU 7 H GLU 7 -9.640 1.484 -3.451
42 HA GLU 7 HA GLU 7 -10.351 3.911 -1.992
43 HB2 GLU 7 2HB GLU 7 -9.188 1.282 -1.045
44 HB3 GLU 7 1HB GLU 7 -9.617 2.640 -0.009
45 HG2 GLU 7 2HG GLU 7 -11.950 2.395 -0.596
46 HG3 GLU 7 1HG GLU 7 -11.555 1.127 -1.751
47 H TYR 8 H TYR 8 -8.695 5.170 -1.029
48 HA TYR 8 HA TYR 8 -6.035 4.601 -2.105
49 HD1 TYR 8 2HD TYR 8 -9.251 6.759 -3.295
50 HD2 TYR 8 1HD TYR 8 -5.263 6.158 -4.649
51 HE1 TYR 8 2HE TYR 8 -10.076 6.509 -5.594
52 HE2 TYR 8 1HE TYR 8 -6.080 5.903 -6.949
53 HH TYR 8 HH TYR 8 -9.260 6.715 -7.844
54 HB2 TYR 8 2HB TYR 8 -7.272 7.353 -1.859
55 HB3 TYR 8 1HB TYR 8 -5.669 6.973 -2.434
56 H CYS 9 H CYS 9 -4.386 4.939 -0.824
57 HA CYS 9 HA CYS 9 -4.867 5.973 1.858
58 HG CYS 9 HG CYS 9 -3.752 3.032 -0.529
59 HB2 CYS 9 2HB CYS 9 -3.249 4.141 2.636
60 HB3 CYS 9 1HB CYS 9 -4.869 3.616 2.195
61 H ARG 10 H ARG 10 -2.738 6.652 2.865
62 HA ARG 10 HA ARG 10 -0.876 7.481 0.727
63 HE ARG 10 HE ARG 10 1.170 10.004 3.791
64 HB2 ARG 10 2HB ARG 10 -2.243 9.351 1.817
65 HB3 ARG 10 1HB ARG 10 -1.309 9.035 3.279
66 HG2 ARG 10 2HG ARG 10 0.739 9.329 1.707
67 HG3 ARG 10 1HG ARG 10 -0.402 10.144 0.649
68 HD2 ARG 10 2HD ARG 10 0.486 11.885 1.894
69 HD3 ARG 10 1HD ARG 10 -1.004 11.502 2.765
70 HH11 ARG 10 1HH1 ARG 10 -0.257 13.241 3.877
71 HH12 ARG 10 2HH1 ARG 10 0.491 13.699 5.326
72 HH21 ARG 10 1HH2 ARG 10 2.278 10.660 5.798
73 HH22 ARG 10 2HH2 ARG 10 1.989 12.200 6.429
74 H THR 11 H THR 11 1.265 7.324 1.214
75 HA THR 11 HA THR 11 2.059 5.459 3.179
76 HB THR 11 HB THR 11 4.332 6.062 2.404
77 HG1 THR 11 1HG THR 11 4.570 7.580 0.864
78 HG21 THR 11 3HG2 THR 11 2.220 5.669 0.322
79 HG22 THR 11 1HG2 THR 11 3.239 4.440 1.063
80 HG23 THR 11 2HG2 THR 11 3.927 5.642 -0.064
81 H LEU 12 H LEU 12 2.965 5.848 5.181
82 HA LEU 12 HA LEU 12 3.095 8.649 6.058
83 HG LEU 12 HG LEU 12 0.827 6.691 6.796
84 HB2 LEU 12 2HB LEU 12 3.075 6.077 7.623
85 HB3 LEU 12 1HB LEU 12 3.230 7.669 8.329
86 HD11 LEU 12 1HD1 LEU 12 -0.231 6.608 9.008
87 HD12 LEU 12 2HD1 LEU 12 1.314 7.021 9.753
88 HD13 LEU 12 3HD1 LEU 12 1.132 5.497 8.888
89 HD21 LEU 12 3HD2 LEU 12 1.111 9.115 6.675
90 HD22 LEU 12 1HD2 LEU 12 1.299 9.188 8.429
91 HD23 LEU 12 2HD2 LEU 12 -0.239 8.696 7.730
92 H PHE 13 H PHE 13 4.970 5.961 5.174
93 HA PHE 13 HA PHE 13 7.423 7.269 6.077
94 HD1 PHE 13 2HD PHE 13 8.711 6.432 8.738
95 HD2 PHE 13 1HD PHE 13 4.909 4.665 8.045
96 HE1 PHE 13 2HE PHE 13 8.078 6.896 11.064
97 HE2 PHE 13 1HE PHE 13 4.265 5.121 10.374
98 HZ PHE 13 HZ PHE 13 5.855 6.241 11.884
99 HB2 PHE 13 2HB PHE 13 6.711 4.361 6.499
100 HB3 PHE 13 1HB PHE 13 8.307 5.037 6.781
101 HA PRO 14 HA PRO 14 8.600 5.621 2.095
102 HB2 PRO 14 2HB PRO 14 11.380 5.527 2.727
103 HB3 PRO 14 1HB PRO 14 10.550 6.763 1.788
104 HG2 PRO 14 2HG PRO 14 11.698 7.089 4.316
105 HG3 PRO 14 1HG PRO 14 10.593 8.213 3.506
106 HD2 PRO 14 2HD PRO 14 10.072 6.299 5.698
107 HD3 PRO 14 1HD PRO 14 9.218 7.793 5.255
108 H TYR 15 H TYR 15 8.416 3.582 1.679
109 HA TYR 15 HA TYR 15 9.571 1.650 3.549
110 HD1 TYR 15 2HD TYR 15 8.408 -0.003 5.056
111 HD2 TYR 15 1HD TYR 15 6.987 -0.965 1.169
112 HE1 TYR 15 2HE TYR 15 8.498 -2.368 5.625
113 HE2 TYR 15 1HE TYR 15 7.069 -3.354 1.730
114 HH TYR 15 HH TYR 15 8.233 -4.861 3.341
115 HB2 TYR 15 2HB TYR 15 7.115 1.637 3.570
116 HB3 TYR 15 1HB TYR 15 7.101 1.292 1.833
117 H THR 16 H THR 16 11.205 0.639 2.769
118 HA THR 16 HA THR 16 11.585 0.645 -0.113
119 HB THR 16 HB THR 16 13.604 0.086 2.071
120 HG1 THR 16 1HG THR 16 13.360 2.186 2.292
121 HG21 THR 16 3HG2 THR 16 15.253 0.463 0.268
122 HG22 THR 16 1HG2 THR 16 13.938 0.664 -0.887
123 HG23 THR 16 2HG2 THR 16 14.198 -0.900 -0.111
124 H GLY 17 H GLY 17 10.862 -1.092 -1.079
125 HA2 GLY 17 2HA GLY 17 10.688 -3.648 0.186
126 HA3 GLY 17 1HA GLY 17 10.398 -3.278 -1.509
127 H THR 18 H THR 18 12.113 -5.236 0.123
128 HA THR 18 HA THR 18 14.540 -4.822 -1.507
129 HB THR 18 HB THR 18 15.072 -4.750 0.906
130 HG1 THR 18 1HG THR 18 16.077 -6.671 -0.750
131 HG21 THR 18 3HG2 THR 18 13.864 -7.506 1.035
132 HG22 THR 18 1HG2 THR 18 13.220 -6.050 1.793
133 HG23 THR 18 2HG2 THR 18 14.752 -6.731 2.346
134 H ASN 19 H ASN 19 11.802 -6.188 -1.579
135 HA ASN 19 HA ASN 19 12.618 -8.691 -2.859
136 HB2 ASN 19 2HB ASN 19 11.601 -9.223 -0.733
137 HB3 ASN 19 1HB ASN 19 10.280 -8.099 -1.025
138 HD21 ASN 19 1HD2 ASN 19 8.741 -9.600 -0.752
139 HD22 ASN 19 2HD2 ASN 19 8.434 -10.847 -1.899
140 H GLU 20 H GLU 20 11.061 -9.261 -4.591
141 HA GLU 20 HA GLU 20 10.484 -6.886 -6.124
142 HB2 GLU 20 2HB GLU 20 10.099 -9.780 -6.859
143 HB3 GLU 20 1HB GLU 20 10.015 -8.409 -7.953
144 HG2 GLU 20 2HG GLU 20 12.323 -7.926 -7.645
145 HG3 GLU 20 1HG GLU 20 12.454 -9.130 -6.364
146 H ASP 21 H ASP 21 8.576 -9.189 -4.332
147 HA ASP 21 HA ASP 21 6.168 -7.995 -5.469
148 HB2 ASP 21 2HB ASP 21 4.849 -9.693 -4.251
149 HB3 ASP 21 1HB ASP 21 6.081 -10.439 -5.253
150 H GLU 22 H GLU 22 8.237 -7.321 -3.128
151 HA GLU 22 HA GLU 22 6.308 -6.119 -1.311
152 HB2 GLU 22 2HB GLU 22 8.309 -7.305 -0.413
153 HB3 GLU 22 1HB GLU 22 9.340 -6.201 -1.307
154 HG2 GLU 22 2HG GLU 22 8.568 -4.355 0.065
155 HG3 GLU 22 1HG GLU 22 7.474 -5.442 0.917
156 H LEU 23 H LEU 23 5.654 -4.121 -1.794
157 HA LEU 23 HA LEU 23 6.841 -2.866 -4.125
158 HG LEU 23 HG LEU 23 3.416 -1.510 -4.893
159 HB2 LEU 23 2HB LEU 23 4.283 -3.247 -3.493
160 HB3 LEU 23 1HB LEU 23 4.485 -1.736 -2.653
161 HD11 LEU 23 1HD1 LEU 23 4.726 0.340 -5.745
162 HD12 LEU 23 2HD1 LEU 23 6.071 -0.123 -4.702
163 HD13 LEU 23 3HD1 LEU 23 4.548 0.418 -3.992
164 HD21 LEU 23 3HD2 LEU 23 4.738 -1.753 -6.897
165 HD22 LEU 23 1HD2 LEU 23 4.571 -3.289 -6.049
166 HD23 LEU 23 2HD2 LEU 23 6.085 -2.382 -5.955
167 H THR 24 H THR 24 7.689 -0.777 -4.182
168 HA THR 24 HA THR 24 8.698 0.166 -1.613
169 HB THR 24 HB THR 24 9.655 0.738 -4.420
170 HG1 THR 24 1HG THR 24 9.844 -1.378 -3.469
171 HG21 THR 24 3HG2 THR 24 10.210 2.591 -2.911
172 HG22 THR 24 1HG2 THR 24 11.667 1.668 -3.271
173 HG23 THR 24 2HG2 THR 24 10.845 1.463 -1.722
174 H PHE 25 H PHE 25 8.184 2.038 -0.798
175 HA PHE 25 HA PHE 25 6.492 3.902 -2.330
176 HD1 PHE 25 1HD PHE 25 3.636 3.533 -2.040
177 HD2 PHE 25 2HD PHE 25 5.775 0.697 0.266
178 HE1 PHE 25 1HE PHE 25 2.084 1.779 -2.771
179 HE2 PHE 25 2HE PHE 25 4.238 -1.059 -0.460
180 HZ PHE 25 HZ PHE 25 2.380 -0.525 -1.979
181 HB2 PHE 25 2HB PHE 25 6.164 3.026 0.547
182 HB3 PHE 25 1HB PHE 25 5.191 4.227 -0.283
183 H ARG 26 H ARG 26 6.744 6.098 -1.661
184 HA ARG 26 HA ARG 26 9.116 6.602 0.011
185 HE ARG 26 HE ARG 26 10.388 6.409 -4.901
186 HB2 ARG 26 2HB ARG 26 7.828 8.522 -1.980
187 HB3 ARG 26 1HB ARG 26 9.272 8.825 -1.049
188 HG2 ARG 26 2HG ARG 26 9.910 8.411 -3.303
189 HG3 ARG 26 1HG ARG 26 10.404 7.001 -2.364
190 HD2 ARG 26 2HD ARG 26 8.511 5.771 -3.124
191 HD3 ARG 26 1HD ARG 26 7.825 7.198 -3.880
192 HH11 ARG 26 1HH1 ARG 26 6.859 6.089 -5.109
193 HH12 ARG 26 2HH1 ARG 26 6.865 5.519 -6.717
194 HH21 ARG 26 1HH2 ARG 26 10.389 5.686 -7.139
195 HH22 ARG 26 2HH2 ARG 26 8.915 5.323 -7.909
196 H GLU 27 H GLU 27 8.772 8.943 1.076
197 HA GLU 27 HA GLU 27 6.452 8.570 2.731
198 HB2 GLU 27 2HB GLU 27 8.559 9.109 3.754
199 HB3 GLU 27 1HB GLU 27 8.717 10.539 2.754
200 HG2 GLU 27 2HG GLU 27 6.803 11.540 3.906
201 HG3 GLU 27 1HG GLU 27 6.684 10.104 4.926
202 H GLY 28 H GLY 28 4.515 9.366 2.129
203 HA2 GLY 28 2HA GLY 28 3.109 11.265 2.094
204 HA3 GLY 28 1HA GLY 28 4.425 12.197 1.413
205 H GLU 29 H GLU 29 3.226 9.056 0.175
206 HA GLU 29 HA GLU 29 2.027 10.535 -1.989
207 HB2 GLU 29 2HB GLU 29 2.940 8.877 -3.638
208 HB3 GLU 29 1HB GLU 29 4.104 9.980 -2.909
209 HG2 GLU 29 2HG GLU 29 4.747 8.110 -1.379
210 HG3 GLU 29 1HG GLU 29 3.740 7.049 -2.371
211 H ILE 30 H ILE 30 0.552 9.270 -3.333
212 HA ILE 30 HA ILE 30 -1.216 7.897 -1.496
213 HB ILE 30 HB ILE 30 -1.670 8.965 -4.297
214 HG12 ILE 30 2HG1 ILE 30 -1.265 10.697 -2.583
215 HG13 ILE 30 1HG1 ILE 30 -2.906 10.774 -3.222
216 HG21 ILE 30 1HG2 ILE 30 -4.071 8.635 -3.887
217 HG22 ILE 30 2HG2 ILE 30 -3.687 7.856 -2.352
218 HG23 ILE 30 3HG2 ILE 30 -3.183 7.108 -3.867
219 HD11 ILE 30 3HD1 ILE 30 -2.070 9.601 -0.572
220 HD12 ILE 30 1HD1 ILE 30 -3.717 9.652 -1.197
221 HD13 ILE 30 2HD1 ILE 30 -2.872 11.150 -0.826
222 H ILE 31 H ILE 31 -1.910 5.886 -1.689
223 HA ILE 31 HA ILE 31 -0.638 4.110 -3.682
224 HB ILE 31 HB ILE 31 -1.787 3.361 -0.992
225 HG12 ILE 31 2HG1 ILE 31 1.149 3.739 -1.623
226 HG13 ILE 31 1HG1 ILE 31 0.169 4.874 -0.694
227 HG21 ILE 31 1HG2 ILE 31 -0.013 1.851 -2.906
228 HG22 ILE 31 2HG2 ILE 31 -1.710 1.529 -2.553
229 HG23 ILE 31 3HG2 ILE 31 -0.488 1.284 -1.304
230 HD11 ILE 31 3HD1 ILE 31 0.749 2.015 0.062
231 HD12 ILE 31 1HD1 ILE 31 -0.231 3.148 0.990
232 HD13 ILE 31 2HD1 ILE 31 1.492 3.448 0.776
233 H HIS 32 H HIS 32 -2.081 2.922 -4.899
234 HA HIS 32 HA HIS 32 -4.907 3.316 -4.399
235 HD1 HIS 32 1HD HIS 32 -4.957 0.751 -8.361
236 HD2 HIS 32 2HD HIS 32 -7.053 3.140 -5.676
237 HE1 HIS 32 1HE HIS 32 -7.389 0.420 -8.877
238 HB2 HIS 32 2HB HIS 32 -4.018 3.519 -6.711
239 HB3 HIS 32 1HB HIS 32 -3.456 1.854 -6.631
240 H LEU 33 H LEU 33 -5.947 1.917 -3.159
241 HA LEU 33 HA LEU 33 -4.586 -0.400 -2.161
242 HG LEU 33 HG LEU 33 -5.532 -0.995 0.206
243 HB2 LEU 33 2HB LEU 33 -6.004 1.249 -0.839
244 HB3 LEU 33 1HB LEU 33 -7.397 0.548 -1.616
245 HD11 LEU 33 1HD1 LEU 33 -7.267 -0.722 1.897
246 HD12 LEU 33 2HD1 LEU 33 -8.174 0.321 0.802
247 HD13 LEU 33 3HD1 LEU 33 -6.597 0.832 1.405
248 HD21 LEU 33 3HD2 LEU 33 -8.347 -1.610 -0.715
249 HD22 LEU 33 1HD2 LEU 33 -7.330 -2.610 0.324
250 HD23 LEU 33 2HD2 LEU 33 -6.889 -2.362 -1.366
251 H ILE 34 H ILE 34 -4.744 -2.348 -2.950
252 HA ILE 34 HA ILE 34 -6.800 -2.931 -4.956
253 HB ILE 34 HB ILE 34 -4.172 -4.344 -4.404
254 HG12 ILE 34 2HG1 ILE 34 -3.793 -2.147 -5.355
255 HG13 ILE 34 1HG1 ILE 34 -3.430 -3.378 -6.556
256 HG21 ILE 34 1HG2 ILE 34 -5.808 -5.900 -5.308
257 HG22 ILE 34 2HG2 ILE 34 -4.561 -5.553 -6.511
258 HG23 ILE 34 3HG2 ILE 34 -6.146 -4.798 -6.645
259 HD11 ILE 34 3HD1 ILE 34 -5.615 -2.955 -7.608
260 HD12 ILE 34 1HD1 ILE 34 -4.591 -1.520 -7.569
261 HD13 ILE 34 2HD1 ILE 34 -5.915 -1.680 -6.424
262 H SER 35 H SER 35 -5.296 -4.189 -2.003
263 HA SER 35 HA SER 35 -7.721 -5.679 -1.477
264 HG SER 35 HG SER 35 -7.125 -6.691 -3.416
265 HB2 SER 35 2HB SER 35 -5.052 -7.064 -1.749
266 HB3 SER 35 1HB SER 35 -6.510 -7.793 -1.094
267 H LYS 36 H LYS 36 -8.154 -5.676 0.626
268 HA LYS 36 HA LYS 36 -6.121 -4.859 2.557
269 HB2 LYS 36 2HB LYS 36 -9.066 -5.451 2.897
270 HB3 LYS 36 1HB LYS 36 -7.995 -4.925 4.191
271 HG2 LYS 36 2HG LYS 36 -7.631 -2.846 3.117
272 HG3 LYS 36 1HG LYS 36 -8.539 -3.348 1.701
273 HD2 LYS 36 2HD LYS 36 -10.531 -3.624 3.229
274 HD3 LYS 36 1HD LYS 36 -9.560 -2.832 4.479
275 HE2 LYS 36 2HE LYS 36 -9.244 -0.912 3.007
276 HE3 LYS 36 1HE LYS 36 -10.214 -1.740 1.782
277 HZ1 LYS 36 3HZ LYS 36 -11.536 -0.145 2.915
278 HZ2 LYS 36 1HZ LYS 36 -11.165 -0.801 4.434
279 HZ3 LYS 36 2HZ LYS 36 -12.076 -1.685 3.336
280 H GLU 37 H GLU 37 -7.262 -7.648 1.198
281 HA GLU 37 HA GLU 37 -6.390 -9.204 3.503
282 HB2 GLU 37 2HB GLU 37 -8.791 -9.536 2.979
283 HB3 GLU 37 1HB GLU 37 -8.343 -10.051 1.357
284 HG2 GLU 37 2HG GLU 37 -8.787 -11.971 2.762
285 HG3 GLU 37 1HG GLU 37 -7.089 -11.921 2.291
286 H THR 38 H THR 38 -4.518 -10.068 3.153
287 HA THR 38 HA THR 38 -3.791 -10.808 0.420
288 HB THR 38 HB THR 38 -1.444 -10.723 1.477
289 HG1 THR 38 1HG THR 38 -2.409 -8.847 3.289
290 HG21 THR 38 3HG2 THR 38 -1.293 -8.279 1.130
291 HG22 THR 38 1HG2 THR 38 -3.051 -8.166 1.177
292 HG23 THR 38 2HG2 THR 38 -2.257 -9.035 -0.137
293 H GLY 39 H GLY 39 -5.007 -12.002 3.161
294 HA2 GLY 39 2HA GLY 39 -5.288 -14.313 3.564
295 HA3 GLY 39 1HA GLY 39 -3.707 -14.607 2.840
296 H GLU 40 H GLU 40 -3.430 -11.894 4.604
297 HA GLU 40 HA GLU 40 -2.972 -13.122 7.173
298 HB2 GLU 40 2HB GLU 40 -0.865 -13.398 5.868
299 HB3 GLU 40 1HB GLU 40 -0.802 -11.655 5.675
300 HG2 GLU 40 2HG GLU 40 -0.635 -11.387 8.101
301 HG3 GLU 40 1HG GLU 40 -0.687 -13.140 8.291
302 H ALA 41 H ALA 41 -3.524 -11.690 8.691
303 HA ALA 41 HA ALA 41 -4.370 -9.062 7.953
304 HB1 ALA 41 1HB ALA 41 -4.090 -10.345 10.679
305 HB2 ALA 41 2HB ALA 41 -5.552 -10.318 9.694
306 HB3 ALA 41 3HB ALA 41 -4.899 -8.813 10.349
307 H GLY 42 H GLY 42 -2.862 -7.605 7.472
308 HA2 GLY 42 2HA GLY 42 -1.228 -6.239 8.993
309 HA3 GLY 42 1HA GLY 42 -0.273 -7.706 8.794
310 H TRP 43 H TRP 43 -1.295 -8.158 6.108
311 HA TRP 43 HA TRP 43 0.375 -6.155 4.785
312 HD1 TRP 43 HD TRP 43 0.875 -10.081 5.990
313 HE1 TRP 43 1HE TRP 43 3.358 -10.407 6.518
314 HE3 TRP 43 3HE TRP 43 2.825 -6.675 2.732
315 HZ2 TRP 43 2HZ TRP 43 5.833 -9.337 5.669
316 HZ3 TRP 43 3HZ TRP 43 5.262 -6.385 2.644
317 HH2 TRP 43 HH TRP 43 6.735 -7.677 4.070
318 HB2 TRP 43 2HB TRP 43 -0.349 -8.954 3.915
319 HB3 TRP 43 1HB TRP 43 0.562 -7.812 2.946
320 H TRP 44 H TRP 44 -0.483 -4.855 3.398
321 HA TRP 44 HA TRP 44 -3.104 -5.468 2.261
322 HD1 TRP 44 HD TRP 44 -4.078 -5.348 4.248
323 HE1 TRP 44 1HE TRP 44 -6.006 -4.388 5.644
324 HE3 TRP 44 3HE TRP 44 -3.688 -0.437 2.898
325 HZ2 TRP 44 2HZ TRP 44 -7.207 -1.891 6.117
326 HZ3 TRP 44 3HZ TRP 44 -5.277 1.174 3.865
327 HH2 TRP 44 HH TRP 44 -7.006 0.453 5.436
328 HB2 TRP 44 2HB TRP 44 -1.832 -2.871 3.081
329 HB3 TRP 44 1HB TRP 44 -2.956 -2.885 1.733
330 H LYS 45 H LYS 45 -3.315 -5.019 0.043
331 HA LYS 45 HA LYS 45 -0.704 -4.947 -1.259
332 HB2 LYS 45 2HB LYS 45 -1.905 -7.059 -1.689
333 HB3 LYS 45 1HB LYS 45 -3.279 -6.148 -2.308
334 HG2 LYS 45 2HG LYS 45 -2.054 -5.386 -4.180
335 HG3 LYS 45 1HG LYS 45 -0.539 -5.984 -3.515
336 HD2 LYS 45 2HD LYS 45 -1.341 -8.280 -3.751
337 HD3 LYS 45 1HD LYS 45 -2.875 -7.673 -4.390
338 HE2 LYS 45 2HE LYS 45 -1.768 -6.685 -6.269
339 HE3 LYS 45 1HE LYS 45 -0.192 -7.101 -5.614
340 HZ1 LYS 45 3HZ LYS 45 -0.539 -9.350 -6.074
341 HZ2 LYS 45 1HZ LYS 45 -1.074 -8.506 -7.418
342 HZ3 LYS 45 2HZ LYS 45 -2.208 -9.162 -6.348
343 H GLY 46 H GLY 46 -0.276 -3.369 -2.566
344 HA2 GLY 46 2HA GLY 46 -2.449 -1.559 -3.278
345 HA3 GLY 46 1HA GLY 46 -0.986 -0.946 -2.519
346 H GLU 47 H GLU 47 -1.957 -0.181 -4.966
347 HA GLU 47 HA GLU 47 0.070 -1.238 -6.790
348 HB2 GLU 47 2HB GLU 47 -2.268 -1.683 -7.426
349 HB3 GLU 47 1HB GLU 47 -2.604 0.034 -7.361
350 HG2 GLU 47 2HG GLU 47 -1.044 0.382 -9.230
351 HG3 GLU 47 1HG GLU 47 -0.736 -1.349 -9.252
352 H LEU 48 H LEU 48 1.524 0.163 -7.446
353 HA LEU 48 HA LEU 48 1.093 2.961 -7.653
354 HG LEU 48 HG LEU 48 3.814 4.047 -6.592
355 HB2 LEU 48 2HB LEU 48 1.467 2.746 -5.207
356 HB3 LEU 48 1HB LEU 48 2.997 1.959 -5.523
357 HD11 LEU 48 1HD1 LEU 48 2.574 6.124 -6.214
358 HD12 LEU 48 2HD1 LEU 48 1.216 5.185 -5.592
359 HD13 LEU 48 3HD1 LEU 48 1.714 5.011 -7.274
360 HD21 LEU 48 3HD2 LEU 48 4.103 5.290 -4.532
361 HD22 LEU 48 1HD2 LEU 48 4.302 3.558 -4.262
362 HD23 LEU 48 2HD2 LEU 48 2.801 4.361 -3.787
363 H ASN 49 H ASN 49 2.763 3.907 -8.848
364 HA ASN 49 HA ASN 49 4.585 4.143 -10.177
365 HB2 ASN 49 2HB ASN 49 5.638 1.570 -8.937
366 HB3 ASN 49 1HB ASN 49 6.568 2.675 -9.936
367 HD21 ASN 49 1HD2 ASN 49 6.990 1.749 -7.194
368 HD22 ASN 49 2HD2 ASN 49 7.069 3.142 -6.193
369 H GLY 50 H GLY 50 2.383 1.893 -10.419
370 HA2 GLY 50 2HA GLY 50 1.513 1.257 -12.552
371 HA3 GLY 50 1HA GLY 50 3.172 1.110 -13.128
372 H LYS 51 H LYS 51 3.083 -0.054 -10.034
373 HA LYS 51 HA LYS 51 2.809 -2.820 -11.001
374 HB2 LYS 51 2HB LYS 51 4.713 -1.849 -8.888
375 HB3 LYS 51 1HB LYS 51 4.670 -3.455 -9.580
376 HG2 LYS 51 2HG LYS 51 5.529 -0.887 -10.880
377 HG3 LYS 51 1HG LYS 51 6.542 -2.256 -10.404
378 HD2 LYS 51 2HD LYS 51 4.331 -2.671 -12.349
379 HD3 LYS 51 1HD LYS 51 5.773 -1.848 -12.892
380 HE2 LYS 51 2HE LYS 51 5.951 -4.240 -13.404
381 HE3 LYS 51 1HE LYS 51 7.102 -3.853 -12.143
382 HZ1 LYS 51 3HZ LYS 51 5.817 -5.961 -11.850
383 HZ2 LYS 51 1HZ LYS 51 4.434 -5.077 -11.630
384 HZ3 LYS 51 2HZ LYS 51 5.684 -4.967 -10.505
385 H GLU 52 H GLU 52 2.574 -4.261 -9.139
386 HA GLU 52 HA GLU 52 1.096 -3.037 -6.945
387 HB2 GLU 52 2HB GLU 52 -0.483 -4.979 -7.021
388 HB3 GLU 52 1HB GLU 52 -0.613 -3.889 -8.391
389 HG2 GLU 52 2HG GLU 52 0.677 -5.439 -9.762
390 HG3 GLU 52 1HG GLU 52 0.836 -6.524 -8.382
391 H GLY 53 H GLY 53 1.383 -3.986 -4.978
392 HA2 GLY 53 2HA GLY 53 2.745 -6.479 -4.717
393 HA3 GLY 53 1HA GLY 53 3.774 -5.098 -4.345
394 H VAL 54 H VAL 54 3.684 -6.317 -2.239
395 HA VAL 54 HA VAL 54 1.293 -5.491 -0.763
396 HB VAL 54 HB VAL 54 1.772 -7.341 0.844
397 HG11 VAL 54 1HG1 VAL 54 1.004 -9.178 -0.591
398 HG12 VAL 54 2HG1 VAL 54 1.387 -8.212 -2.016
399 HG13 VAL 54 3HG1 VAL 54 0.126 -7.682 -0.900
400 HG21 VAL 54 3HG2 VAL 54 3.311 -9.142 0.193
401 HG22 VAL 54 1HG2 VAL 54 4.167 -7.618 0.419
402 HG23 VAL 54 2HG2 VAL 54 3.824 -8.204 -1.208
403 H PHE 55 H PHE 55 1.539 -4.784 1.351
404 HA PHE 55 HA PHE 55 4.165 -4.178 2.360
405 HD1 PHE 55 1HD PHE 55 1.442 -2.438 -0.289
406 HD2 PHE 55 2HD PHE 55 1.900 -0.737 3.588
407 HE1 PHE 55 1HE PHE 55 -0.753 -1.355 -0.502
408 HE2 PHE 55 2HE PHE 55 -0.291 0.345 3.376
409 HZ PHE 55 HZ PHE 55 -1.624 0.041 1.330
410 HB2 PHE 55 2HB PHE 55 3.776 -1.754 2.495
411 HB3 PHE 55 1HB PHE 55 3.663 -2.315 0.831
412 HA PRO 56 HA PRO 56 1.703 -4.641 6.094
413 HB2 PRO 56 2HB PRO 56 3.624 -2.882 7.483
414 HB3 PRO 56 1HB PRO 56 3.262 -4.585 7.780
415 HG2 PRO 56 2HG PRO 56 5.600 -3.829 6.692
416 HG3 PRO 56 1HG PRO 56 4.785 -5.326 6.213
417 HD2 PRO 56 2HD PRO 56 4.825 -2.670 4.819
418 HD3 PRO 56 1HD PRO 56 5.027 -4.307 4.148
419 H ASP 57 H ASP 57 -0.016 -3.517 6.768
420 HA ASP 57 HA ASP 57 -0.627 -0.980 5.662
421 HB2 ASP 57 2HB ASP 57 -2.736 -1.076 6.877
422 HB3 ASP 57 1HB ASP 57 -2.372 -2.649 6.185
423 H ASN 58 H ASN 58 1.135 -1.713 8.332
424 HA ASN 58 HA ASN 58 0.654 0.335 10.188
425 HB2 ASN 58 2HB ASN 58 3.286 -0.990 9.504
426 HB3 ASN 58 1HB ASN 58 2.903 -0.143 10.998
427 HD21 ASN 58 1HD2 ASN 58 1.764 -1.206 12.565
428 HD22 ASN 58 2HD2 ASN 58 1.345 -2.879 12.463
429 H PHE 59 H PHE 59 2.417 0.313 7.147
430 HA PHE 59 HA PHE 59 3.848 2.772 7.777
431 HD1 PHE 59 2HD PHE 59 4.402 -0.982 6.776
432 HD2 PHE 59 1HD PHE 59 6.799 2.509 7.017
433 HE1 PHE 59 2HE PHE 59 6.120 -2.247 7.987
434 HE2 PHE 59 1HE PHE 59 8.514 1.274 8.211
435 HZ PHE 59 HZ PHE 59 8.188 -1.125 8.716
436 HB2 PHE 59 2HB PHE 59 3.970 0.964 5.367
437 HB3 PHE 59 1HB PHE 59 4.923 2.429 5.550
438 H ALA 60 H ALA 60 0.821 2.317 6.824
439 HA ALA 60 HA ALA 60 0.820 4.745 5.213
440 HB1 ALA 60 1HB ALA 60 -0.679 2.227 4.492
441 HB2 ALA 60 2HB ALA 60 0.731 2.855 3.642
442 HB3 ALA 60 3HB ALA 60 -0.779 3.771 3.644
443 H VAL 61 H VAL 61 -1.456 5.533 4.987
444 HA VAL 61 HA VAL 61 -3.238 4.665 7.108
445 HB VAL 61 HB VAL 61 -1.977 6.685 7.933
446 HG11 VAL 61 1HG1 VAL 61 -3.317 8.135 5.670
447 HG12 VAL 61 2HG1 VAL 61 -1.587 7.851 5.862
448 HG13 VAL 61 3HG1 VAL 61 -2.441 8.902 6.993
449 HG21 VAL 61 3HG2 VAL 61 -3.938 7.953 8.691
450 HG22 VAL 61 1HG2 VAL 61 -4.190 6.214 8.810
451 HG23 VAL 61 2HG2 VAL 61 -4.930 7.120 7.492
452 H GLN 62 H GLN 62 -5.360 4.689 6.452
453 HA GLN 62 HA GLN 62 -5.693 5.019 3.624
454 HB2 GLN 62 2HB GLN 62 -6.667 3.047 4.575
455 HB3 GLN 62 1HB GLN 62 -7.583 3.995 5.735
456 HG2 GLN 62 2HG GLN 62 -8.983 4.878 4.030
457 HG3 GLN 62 1HG GLN 62 -7.958 4.212 2.766
458 HE21 GLN 62 1HE2 GLN 62 -9.730 3.244 1.916
459 HE22 GLN 62 2HE2 GLN 62 -10.421 1.800 2.521
460 H ILE 63 H ILE 63 -6.607 6.594 2.573
461 HA ILE 63 HA ILE 63 -7.429 8.968 4.042
462 HB ILE 63 HB ILE 63 -7.361 8.531 1.039
463 HG12 ILE 63 2HG1 ILE 63 -5.149 8.056 1.876
464 HG13 ILE 63 1HG1 ILE 63 -5.139 9.584 1.013
465 HG21 ILE 63 1HG2 ILE 63 -8.645 10.466 1.733
466 HG22 ILE 63 2HG2 ILE 63 -7.172 10.970 0.905
467 HG23 ILE 63 3HG2 ILE 63 -7.272 11.069 2.664
468 HD11 ILE 63 3HD1 ILE 63 -5.177 9.261 4.017
469 HD12 ILE 63 1HD1 ILE 63 -5.155 10.791 3.146
470 HD13 ILE 63 2HD1 ILE 63 -3.771 9.702 3.052
471 H SER 64 H SER 64 -8.648 7.078 1.268
472 HA SER 64 HA SER 64 -11.193 6.720 2.368
473 HG SER 64 HG SER 64 -10.852 9.194 2.306
474 HB2 SER 64 2HB SER 64 -10.719 8.434 -0.088
475 HB3 SER 64 1HB SER 64 -12.268 7.757 0.412
Start of MODEL 20
1 H1 GLY 1 1HT GLY 1 -10.911 -13.067 5.129
2 H2 GLY 1 2HT GLY 1 -11.213 -11.795 6.224
3 H3 GLY 1 3HT GLY 1 -9.801 -11.796 5.273
4 HA2 GLY 1 1HA GLY 1 -11.025 -11.497 3.305
5 HA3 GLY 1 2HA GLY 1 -12.530 -11.567 4.228
6 H ALA 2 H ALA 2 -11.559 -9.419 2.575
7 HA ALA 2 HA ALA 2 -12.112 -7.281 4.311
8 HB1 ALA 2 1HB ALA 2 -10.021 -6.043 4.036
9 HB2 ALA 2 2HB ALA 2 -9.305 -7.414 3.189
10 HB3 ALA 2 3HB ALA 2 -9.733 -7.556 4.896
11 H MET 3 H MET 3 -11.445 -5.168 2.861
12 HA MET 3 HA MET 3 -12.702 -5.782 0.299
13 HB2 MET 3 2HB MET 3 -12.555 -3.163 1.787
14 HB3 MET 3 1HB MET 3 -13.331 -3.391 0.229
15 HG2 MET 3 2HG MET 3 -14.131 -4.684 2.819
16 HG3 MET 3 1HG MET 3 -14.953 -3.343 2.024
17 HE1 MET 3 3HE MET 3 -16.366 -5.993 3.049
18 HE2 MET 3 1HE MET 3 -17.464 -6.326 1.706
19 HE3 MET 3 2HE MET 3 -17.227 -4.670 2.263
20 H GLY 4 H GLY 4 -12.194 -3.901 -1.292
21 HA2 GLY 4 2HA GLY 4 -9.625 -2.752 -1.372
22 HA3 GLY 4 1HA GLY 4 -9.715 -4.180 -2.416
23 H ALA 5 H ALA 5 -11.948 -1.670 -1.502
24 HA ALA 5 HA ALA 5 -13.180 -1.820 -4.144
25 HB1 ALA 5 1HB ALA 5 -15.006 -0.557 -3.135
26 HB2 ALA 5 2HB ALA 5 -14.066 -0.365 -1.657
27 HB3 ALA 5 3HB ALA 5 -14.592 -1.970 -2.164
28 H LYS 6 H LYS 6 -10.840 -0.721 -4.548
29 HA LYS 6 HA LYS 6 -9.661 1.052 -5.352
30 HB2 LYS 6 2HB LYS 6 -12.410 2.203 -5.939
31 HB3 LYS 6 1HB LYS 6 -10.904 2.688 -6.706
32 HG2 LYS 6 2HG LYS 6 -10.680 0.484 -7.711
33 HG3 LYS 6 1HG LYS 6 -12.153 -0.050 -6.903
34 HD2 LYS 6 2HD LYS 6 -13.378 1.751 -8.115
35 HD3 LYS 6 1HD LYS 6 -11.898 2.084 -9.014
36 HE2 LYS 6 2HE LYS 6 -13.363 0.634 -10.310
37 HE3 LYS 6 1HE LYS 6 -11.894 -0.225 -9.848
38 HZ1 LYS 6 3HZ LYS 6 -14.529 -0.462 -8.488
39 HZ2 LYS 6 1HZ LYS 6 -13.143 -1.321 -8.086
40 HZ3 LYS 6 2HZ LYS 6 -13.893 -1.584 -9.564
41 H GLU 7 H GLU 7 -9.409 1.133 -2.998
42 HA GLU 7 HA GLU 7 -10.390 3.550 -1.704
43 HB2 GLU 7 2HB GLU 7 -9.074 1.032 -0.620
44 HB3 GLU 7 1HB GLU 7 -9.674 2.368 0.359
45 HG2 GLU 7 2HG GLU 7 -11.944 1.920 -0.311
46 HG3 GLU 7 1HG GLU 7 -11.409 0.716 -1.473
47 H TYR 8 H TYR 8 -8.710 4.914 -0.695
48 HA TYR 8 HA TYR 8 -6.079 4.321 -1.848
49 HD1 TYR 8 2HD TYR 8 -5.472 5.609 -4.521
50 HD2 TYR 8 1HD TYR 8 -9.297 6.623 -2.991
51 HE1 TYR 8 2HE TYR 8 -6.443 5.331 -6.770
52 HE2 TYR 8 1HE TYR 8 -10.274 6.362 -5.232
53 HH TYR 8 HH TYR 8 -8.620 4.884 -7.810
54 HB2 TYR 8 2HB TYR 8 -7.219 7.120 -1.687
55 HB3 TYR 8 1HB TYR 8 -5.683 6.636 -2.344
56 H CYS 9 H CYS 9 -4.332 4.872 -0.731
57 HA CYS 9 HA CYS 9 -4.767 5.782 2.000
58 HG CYS 9 HG CYS 9 -3.317 3.177 -0.571
59 HB2 CYS 9 2HB CYS 9 -2.921 4.151 2.639
60 HB3 CYS 9 1HB CYS 9 -4.471 3.438 2.222
61 H ARG 10 H ARG 10 -2.962 6.807 2.959
62 HA ARG 10 HA ARG 10 -1.155 8.040 0.994
63 HE ARG 10 HE ARG 10 -0.146 12.894 2.295
64 HB2 ARG 10 2HB ARG 10 -2.936 9.503 1.977
65 HB3 ARG 10 1HB ARG 10 -2.263 9.189 3.565
66 HG2 ARG 10 2HG ARG 10 -0.229 10.360 2.957
67 HG3 ARG 10 1HG ARG 10 -0.826 10.596 1.311
68 HD2 ARG 10 2HD ARG 10 -2.778 11.818 2.253
69 HD3 ARG 10 1HD ARG 10 -2.057 11.680 3.849
70 HH11 ARG 10 1HH1 ARG 10 -3.505 13.630 3.135
71 HH12 ARG 10 2HH1 ARG 10 -3.314 15.323 3.054
72 HH21 ARG 10 1HH2 ARG 10 0.121 15.197 2.177
73 HH22 ARG 10 2HH2 ARG 10 -1.184 16.238 2.536
74 H THR 11 H THR 11 0.965 7.884 1.480
75 HA THR 11 HA THR 11 1.888 5.970 3.300
76 HB THR 11 HB THR 11 4.125 6.972 2.750
77 HG1 THR 11 1HG THR 11 2.718 9.060 2.276
78 HG21 THR 11 3HG2 THR 11 4.035 6.284 0.409
79 HG22 THR 11 1HG2 THR 11 2.275 6.428 0.415
80 HG23 THR 11 2HG2 THR 11 3.063 5.193 1.394
81 H LEU 12 H LEU 12 2.979 6.158 5.279
82 HA LEU 12 HA LEU 12 2.909 8.835 6.502
83 HG LEU 12 HG LEU 12 0.646 6.678 7.002
84 HB2 LEU 12 2HB LEU 12 2.897 6.123 7.835
85 HB3 LEU 12 1HB LEU 12 2.958 7.651 8.678
86 HD11 LEU 12 1HD1 LEU 12 1.011 6.838 9.994
87 HD12 LEU 12 2HD1 LEU 12 0.929 5.362 9.037
88 HD13 LEU 12 3HD1 LEU 12 -0.486 6.405 9.175
89 HD21 LEU 12 3HD2 LEU 12 0.956 9.084 8.794
90 HD22 LEU 12 1HD2 LEU 12 -0.545 8.570 8.024
91 HD23 LEU 12 2HD2 LEU 12 0.814 9.099 7.036
92 H PHE 13 H PHE 13 4.836 6.226 5.413
93 HA PHE 13 HA PHE 13 7.268 7.499 6.335
94 HD1 PHE 13 2HD PHE 13 8.568 6.986 8.942
95 HD2 PHE 13 1HD PHE 13 4.912 4.855 8.570
96 HE1 PHE 13 2HE PHE 13 7.993 7.569 11.259
97 HE2 PHE 13 1HE PHE 13 4.333 5.425 10.866
98 HZ PHE 13 HZ PHE 13 5.859 6.783 12.223
99 HB2 PHE 13 2HB PHE 13 6.581 4.618 6.955
100 HB3 PHE 13 1HB PHE 13 8.179 5.314 7.140
101 HA PRO 14 HA PRO 14 8.495 5.576 2.417
102 HB2 PRO 14 2HB PRO 14 11.248 5.571 3.468
103 HB3 PRO 14 1HB PRO 14 10.613 6.429 2.064
104 HG2 PRO 14 2HG PRO 14 11.346 7.733 4.294
105 HG3 PRO 14 1HG PRO 14 9.963 8.264 3.318
106 HD2 PRO 14 2HD PRO 14 9.983 6.698 5.873
107 HD3 PRO 14 1HD PRO 14 8.937 8.045 5.373
108 H TYR 15 H TYR 15 8.908 3.454 1.846
109 HA TYR 15 HA TYR 15 9.894 1.655 3.906
110 HD1 TYR 15 1HD TYR 15 8.812 -0.114 5.466
111 HD2 TYR 15 2HD TYR 15 7.416 -1.087 1.570
112 HE1 TYR 15 1HE TYR 15 8.984 -2.498 6.009
113 HE2 TYR 15 2HE TYR 15 7.590 -3.478 2.097
114 HH TYR 15 HH TYR 15 8.689 -4.965 3.632
115 HB2 TYR 15 2HB TYR 15 7.443 1.508 3.978
116 HB3 TYR 15 1HB TYR 15 7.414 1.146 2.256
117 H THR 16 H THR 16 11.346 0.322 3.149
118 HA THR 16 HA THR 16 11.983 0.471 0.325
119 HB THR 16 HB THR 16 13.555 -0.827 2.554
120 HG1 THR 16 1HG THR 16 12.887 1.510 2.681
121 HG21 THR 16 3HG2 THR 16 15.466 -0.383 1.060
122 HG22 THR 16 1HG2 THR 16 14.377 0.343 -0.123
123 HG23 THR 16 2HG2 THR 16 14.262 -1.377 0.242
124 H GLY 17 H GLY 17 11.099 -1.117 -0.968
125 HA2 GLY 17 2HA GLY 17 10.512 -3.683 0.189
126 HA3 GLY 17 1HA GLY 17 10.110 -3.194 -1.451
127 H THR 18 H THR 18 11.910 -5.212 0.188
128 HA THR 18 HA THR 18 14.299 -4.938 -1.508
129 HB THR 18 HB THR 18 15.391 -6.418 0.210
130 HG1 THR 18 1HG THR 18 12.997 -5.859 1.679
131 HG21 THR 18 3HG2 THR 18 15.663 -3.985 0.277
132 HG22 THR 18 1HG2 THR 18 15.590 -4.649 1.913
133 HG23 THR 18 2HG2 THR 18 14.177 -3.849 1.218
134 H ASN 19 H ASN 19 11.511 -6.552 -1.108
135 HA ASN 19 HA ASN 19 12.473 -8.978 -2.460
136 HB2 ASN 19 2HB ASN 19 9.856 -8.480 -0.994
137 HB3 ASN 19 1HB ASN 19 10.317 -9.990 -1.765
138 HD21 ASN 19 1HD2 ASN 19 10.937 -7.831 0.927
139 HD22 ASN 19 2HD2 ASN 19 11.787 -8.979 1.883
140 H GLU 20 H GLU 20 11.293 -9.602 -4.367
141 HA GLU 20 HA GLU 20 10.678 -7.351 -5.980
142 HB2 GLU 20 2HB GLU 20 10.306 -10.280 -6.547
143 HB3 GLU 20 1HB GLU 20 10.207 -8.994 -7.739
144 HG2 GLU 20 2HG GLU 20 12.532 -8.404 -7.307
145 HG3 GLU 20 1HG GLU 20 12.635 -9.690 -6.114
146 H ASP 21 H ASP 21 8.753 -9.410 -4.071
147 HA ASP 21 HA ASP 21 6.282 -8.624 -5.414
148 HB2 ASP 21 2HB ASP 21 6.581 -10.981 -4.797
149 HB3 ASP 21 1HB ASP 21 6.810 -10.528 -3.118
150 H GLU 22 H GLU 22 8.288 -7.311 -3.271
151 HA GLU 22 HA GLU 22 6.288 -6.207 -1.440
152 HB2 GLU 22 2HB GLU 22 8.230 -7.403 -0.486
153 HB3 GLU 22 1HB GLU 22 9.301 -6.310 -1.332
154 HG2 GLU 22 2HG GLU 22 8.474 -4.473 0.033
155 HG3 GLU 22 1HG GLU 22 7.414 -5.607 0.887
156 H LEU 23 H LEU 23 5.759 -4.142 -1.728
157 HA LEU 23 HA LEU 23 6.974 -2.635 -3.885
158 HG LEU 23 HG LEU 23 4.670 -1.819 -5.291
159 HB2 LEU 23 2HB LEU 23 4.478 -2.501 -2.351
160 HB3 LEU 23 1HB LEU 23 5.056 -0.960 -2.991
161 HD11 LEU 23 1HD1 LEU 23 5.742 -3.822 -5.159
162 HD12 LEU 23 2HD1 LEU 23 4.068 -4.074 -5.676
163 HD13 LEU 23 3HD1 LEU 23 4.573 -4.417 -3.999
164 HD21 LEU 23 3HD2 LEU 23 2.533 -2.859 -3.471
165 HD22 LEU 23 1HD2 LEU 23 2.388 -2.435 -5.175
166 HD23 LEU 23 2HD2 LEU 23 2.684 -1.176 -3.975
167 H THR 24 H THR 24 8.165 -0.922 -3.822
168 HA THR 24 HA THR 24 9.142 0.089 -1.280
169 HB THR 24 HB THR 24 10.036 0.646 -4.127
170 HG1 THR 24 1HG THR 24 10.931 -1.229 -3.994
171 HG21 THR 24 3HG2 THR 24 10.718 2.391 -2.534
172 HG22 THR 24 1HG2 THR 24 12.112 1.452 -3.067
173 HG23 THR 24 2HG2 THR 24 11.406 1.168 -1.474
174 H PHE 25 H PHE 25 8.289 1.949 -0.516
175 HA PHE 25 HA PHE 25 7.412 3.912 -2.430
176 HD1 PHE 25 1HD PHE 25 5.290 0.902 -0.748
177 HD2 PHE 25 2HD PHE 25 5.491 4.553 1.414
178 HE1 PHE 25 1HE PHE 25 4.600 -0.268 1.267
179 HE2 PHE 25 2HE PHE 25 4.796 3.382 3.463
180 HZ PHE 25 HZ PHE 25 4.343 0.949 3.387
181 HB2 PHE 25 2HB PHE 25 5.437 4.519 -0.985
182 HB3 PHE 25 1HB PHE 25 5.303 3.025 -1.887
183 H ARG 26 H ARG 26 7.129 6.018 -1.549
184 HA ARG 26 HA ARG 26 9.083 6.529 0.570
185 HE ARG 26 HE ARG 26 10.189 7.247 -3.507
186 HB2 ARG 26 2HB ARG 26 9.598 8.625 -0.646
187 HB3 ARG 26 1HB ARG 26 9.954 7.198 -1.602
188 HG2 ARG 26 2HG ARG 26 7.786 7.513 -2.765
189 HG3 ARG 26 1HG ARG 26 7.585 9.025 -1.876
190 HD2 ARG 26 2HD ARG 26 8.491 9.443 -4.082
191 HD3 ARG 26 1HD ARG 26 9.676 9.846 -2.840
192 HH11 ARG 26 1HH1 ARG 26 10.140 10.305 -5.320
193 HH12 ARG 26 2HH1 ARG 26 11.355 9.808 -6.399
194 HH21 ARG 26 1HH2 ARG 26 11.810 6.608 -4.981
195 HH22 ARG 26 2HH2 ARG 26 12.338 7.653 -6.218
196 H GLU 27 H GLU 27 8.624 8.907 1.412
197 HA GLU 27 HA GLU 27 5.887 8.852 2.328
198 HB2 GLU 27 2HB GLU 27 7.810 9.528 3.815
199 HB3 GLU 27 1HB GLU 27 8.009 10.963 2.814
200 HG2 GLU 27 2HG GLU 27 5.630 11.552 3.386
201 HG3 GLU 27 1HG GLU 27 5.672 10.253 4.568
202 H GLY 28 H GLY 28 4.305 10.302 1.746
203 HA2 GLY 28 2HA GLY 28 3.540 12.319 0.720
204 HA3 GLY 28 1HA GLY 28 5.016 12.356 -0.227
205 H GLU 29 H GLU 29 3.626 9.279 -0.078
206 HA GLU 29 HA GLU 29 2.660 9.682 -2.810
207 HB2 GLU 29 2HB GLU 29 3.739 7.223 -1.460
208 HB3 GLU 29 1HB GLU 29 2.919 7.184 -3.011
209 HG2 GLU 29 2HG GLU 29 5.418 8.741 -2.406
210 HG3 GLU 29 1HG GLU 29 5.359 7.176 -3.223
211 H ILE 30 H ILE 30 0.766 8.895 -3.482
212 HA ILE 30 HA ILE 30 -1.154 8.013 -1.454
213 HB ILE 30 HB ILE 30 -1.587 9.002 -4.305
214 HG12 ILE 30 2HG1 ILE 30 -0.889 10.831 -2.815
215 HG13 ILE 30 1HG1 ILE 30 -2.561 11.028 -3.319
216 HG21 ILE 30 1HG2 ILE 30 -3.311 7.415 -3.675
217 HG22 ILE 30 2HG2 ILE 30 -3.988 9.040 -3.762
218 HG23 ILE 30 3HG2 ILE 30 -3.632 8.317 -2.195
219 HD11 ILE 30 3HD1 ILE 30 -3.305 10.183 -1.145
220 HD12 ILE 30 1HD1 ILE 30 -2.265 11.599 -0.972
221 HD13 ILE 30 2HD1 ILE 30 -1.623 9.988 -0.648
222 H ILE 31 H ILE 31 -1.783 5.931 -1.551
223 HA ILE 31 HA ILE 31 -0.757 4.338 -3.800
224 HB ILE 31 HB ILE 31 -1.172 3.427 -0.926
225 HG12 ILE 31 2HG1 ILE 31 1.422 3.907 -2.417
226 HG13 ILE 31 1HG1 ILE 31 0.768 4.951 -1.160
227 HG21 ILE 31 1HG2 ILE 31 -0.036 1.355 -1.630
228 HG22 ILE 31 2HG2 ILE 31 0.023 1.957 -3.286
229 HG23 ILE 31 3HG2 ILE 31 -1.533 1.622 -2.532
230 HD11 ILE 31 3HD1 ILE 31 1.002 3.130 0.455
231 HD12 ILE 31 1HD1 ILE 31 2.545 3.523 -0.305
232 HD13 ILE 31 2HD1 ILE 31 1.648 2.090 -0.813
233 H HIS 32 H HIS 32 -2.169 3.061 -4.795
234 HA HIS 32 HA HIS 32 -4.969 3.368 -4.108
235 HD1 HIS 32 1HD HIS 32 -4.971 1.377 -8.478
236 HD2 HIS 32 2HD HIS 32 -7.189 2.567 -5.167
237 HE1 HIS 32 1HE HIS 32 -7.323 0.583 -8.876
238 HB2 HIS 32 2HB HIS 32 -4.312 3.767 -6.427
239 HB3 HIS 32 1HB HIS 32 -3.529 2.202 -6.515
240 H LEU 33 H LEU 33 -5.923 1.871 -2.935
241 HA LEU 33 HA LEU 33 -4.488 -0.503 -2.192
242 HG LEU 33 HG LEU 33 -5.263 -1.223 0.207
243 HB2 LEU 33 2HB LEU 33 -5.776 1.080 -0.663
244 HB3 LEU 33 1HB LEU 33 -7.231 0.445 -1.377
245 HD11 LEU 33 1HD1 LEU 33 -7.859 0.063 1.037
246 HD12 LEU 33 2HD1 LEU 33 -6.248 0.546 1.567
247 HD13 LEU 33 3HD1 LEU 33 -6.886 -1.034 2.015
248 HD21 LEU 33 3HD2 LEU 33 -8.135 -1.743 -0.507
249 HD22 LEU 33 1HD2 LEU 33 -7.029 -2.847 0.307
250 HD23 LEU 33 2HD2 LEU 33 -6.771 -2.436 -1.392
251 H ILE 34 H ILE 34 -4.782 -2.394 -3.116
252 HA ILE 34 HA ILE 34 -6.911 -2.691 -5.094
253 HB ILE 34 HB ILE 34 -4.337 -4.238 -4.668
254 HG12 ILE 34 2HG1 ILE 34 -3.978 -2.022 -5.628
255 HG13 ILE 34 1HG1 ILE 34 -3.634 -3.275 -6.815
256 HG21 ILE 34 1HG2 ILE 34 -6.413 -4.653 -6.808
257 HG22 ILE 34 2HG2 ILE 34 -5.984 -5.786 -5.521
258 HG23 ILE 34 3HG2 ILE 34 -4.810 -5.383 -6.783
259 HD11 ILE 34 3HD1 ILE 34 -5.832 -2.852 -7.849
260 HD12 ILE 34 1HD1 ILE 34 -4.800 -1.422 -7.843
261 HD13 ILE 34 2HD1 ILE 34 -6.114 -1.565 -6.680
262 H SER 35 H SER 35 -5.383 -4.411 -2.375
263 HA SER 35 HA SER 35 -7.933 -5.598 -1.685
264 HG SER 35 HG SER 35 -7.753 -6.645 -3.746
265 HB2 SER 35 2HB SER 35 -5.512 -7.337 -2.263
266 HB3 SER 35 1HB SER 35 -7.092 -7.883 -1.711
267 H LYS 36 H LYS 36 -8.038 -5.342 0.510
268 HA LYS 36 HA LYS 36 -5.683 -4.899 2.086
269 HB2 LYS 36 2HB LYS 36 -8.545 -5.436 2.837
270 HB3 LYS 36 1HB LYS 36 -7.291 -5.135 4.030
271 HG2 LYS 36 2HG LYS 36 -6.999 -2.915 3.192
272 HG3 LYS 36 1HG LYS 36 -8.142 -3.179 1.889
273 HD2 LYS 36 2HD LYS 36 -9.882 -3.638 3.603
274 HD3 LYS 36 1HD LYS 36 -8.711 -3.182 4.845
275 HE2 LYS 36 2HE LYS 36 -8.479 -0.987 3.739
276 HE3 LYS 36 1HE LYS 36 -9.731 -1.483 2.600
277 HZ1 LYS 36 3HZ LYS 36 -10.142 -1.249 5.540
278 HZ2 LYS 36 1HZ LYS 36 -11.321 -1.565 4.377
279 HZ3 LYS 36 2HZ LYS 36 -10.541 -0.070 4.423
280 H GLU 37 H GLU 37 -7.501 -7.660 1.110
281 HA GLU 37 HA GLU 37 -6.426 -9.276 3.239
282 HB2 GLU 37 2HB GLU 37 -8.803 -9.543 2.578
283 HB3 GLU 37 1HB GLU 37 -8.278 -10.051 0.980
284 HG2 GLU 37 2HG GLU 37 -8.875 -11.943 2.434
285 HG3 GLU 37 1HG GLU 37 -7.194 -11.997 1.904
286 H THR 38 H THR 38 -4.599 -10.251 3.015
287 HA THR 38 HA THR 38 -3.690 -11.018 0.335
288 HB THR 38 HB THR 38 -1.365 -10.798 1.334
289 HG1 THR 38 1HG THR 38 -2.289 -8.962 3.200
290 HG21 THR 38 3HG2 THR 38 -1.289 -8.350 1.033
291 HG22 THR 38 1HG2 THR 38 -3.049 -8.293 1.121
292 HG23 THR 38 2HG2 THR 38 -2.258 -9.127 -0.218
293 H GLY 39 H GLY 39 -4.882 -12.124 3.139
294 HA2 GLY 39 2HA GLY 39 -5.050 -14.468 3.554
295 HA3 GLY 39 1HA GLY 39 -3.421 -14.673 2.914
296 H GLU 40 H GLU 40 -3.112 -11.984 4.570
297 HA GLU 40 HA GLU 40 -2.902 -13.103 7.233
298 HB2 GLU 40 2HB GLU 40 -0.703 -13.506 6.038
299 HB3 GLU 40 1HB GLU 40 -0.577 -11.778 5.832
300 HG2 GLU 40 2HG GLU 40 0.760 -12.603 7.721
301 HG3 GLU 40 1HG GLU 40 -0.460 -11.420 8.199
302 H ALA 41 H ALA 41 -3.482 -11.586 8.655
303 HA ALA 41 HA ALA 41 -4.291 -9.008 7.773
304 HB1 ALA 41 1HB ALA 41 -5.426 -10.149 9.620
305 HB2 ALA 41 2HB ALA 41 -4.780 -8.598 10.155
306 HB3 ALA 41 3HB ALA 41 -3.946 -10.094 10.577
307 H GLY 42 H GLY 42 -3.090 -7.206 7.639
308 HA2 GLY 42 2HA GLY 42 -1.431 -5.843 8.895
309 HA3 GLY 42 1HA GLY 42 -0.408 -7.276 8.850
310 H TRP 43 H TRP 43 -1.074 -8.075 6.197
311 HA TRP 43 HA TRP 43 0.490 -6.070 4.776
312 HD1 TRP 43 HD TRP 43 1.290 -9.573 6.505
313 HE1 TRP 43 1HE TRP 43 3.808 -9.623 7.002
314 HE3 TRP 43 3HE TRP 43 2.957 -6.805 2.547
315 HZ2 TRP 43 2HZ TRP 43 6.195 -8.616 5.868
316 HZ3 TRP 43 3HZ TRP 43 5.371 -6.394 2.324
317 HH2 TRP 43 HH TRP 43 6.958 -7.285 3.952
318 HB2 TRP 43 2HB TRP 43 -0.031 -8.986 4.211
319 HB3 TRP 43 1HB TRP 43 0.778 -7.914 3.079
320 H TRP 44 H TRP 44 -0.365 -4.891 3.299
321 HA TRP 44 HA TRP 44 -2.991 -5.597 2.223
322 HD1 TRP 44 HD TRP 44 -3.827 -5.368 4.245
323 HE1 TRP 44 1HE TRP 44 -5.560 -4.290 5.789
324 HE3 TRP 44 3HE TRP 44 -3.344 -0.513 2.724
325 HZ2 TRP 44 2HZ TRP 44 -6.587 -1.717 6.312
326 HZ3 TRP 44 3HZ TRP 44 -4.747 1.194 3.801
327 HH2 TRP 44 HH TRP 44 -6.341 0.593 5.551
328 HB2 TRP 44 2HB TRP 44 -1.652 -2.950 2.724
329 HB3 TRP 44 1HB TRP 44 -2.932 -3.103 1.529
330 H LYS 45 H LYS 45 -3.303 -5.244 -0.005
331 HA LYS 45 HA LYS 45 -0.810 -5.342 -1.548
332 HB2 LYS 45 2HB LYS 45 -2.309 -7.397 -1.434
333 HB3 LYS 45 1HB LYS 45 -3.554 -6.444 -2.202
334 HG2 LYS 45 2HG LYS 45 -2.265 -6.324 -4.240
335 HG3 LYS 45 1HG LYS 45 -0.896 -7.133 -3.457
336 HD2 LYS 45 2HD LYS 45 -2.377 -9.072 -2.981
337 HD3 LYS 45 1HD LYS 45 -3.651 -8.288 -3.901
338 HE2 LYS 45 2HE LYS 45 -0.966 -9.113 -5.006
339 HE3 LYS 45 1HE LYS 45 -2.445 -10.046 -5.162
340 HZ1 LYS 45 3HZ LYS 45 -1.731 -7.495 -6.485
341 HZ2 LYS 45 1HZ LYS 45 -3.359 -7.982 -6.308
342 HZ3 LYS 45 2HZ LYS 45 -2.253 -8.936 -7.099
343 H GLY 46 H GLY 46 -0.609 -3.729 -2.995
344 HA2 GLY 46 2HA GLY 46 -2.927 -2.155 -3.721
345 HA3 GLY 46 1HA GLY 46 -1.706 -1.331 -2.771
346 H GLU 47 H GLU 47 -2.168 -0.235 -4.990
347 HA GLU 47 HA GLU 47 -0.198 -1.146 -6.961
348 HB2 GLU 47 2HB GLU 47 -2.480 -1.230 -7.759
349 HB3 GLU 47 1HB GLU 47 -2.763 0.410 -7.227
350 HG2 GLU 47 2HG GLU 47 -1.083 1.172 -8.901
351 HG3 GLU 47 1HG GLU 47 -0.977 -0.492 -9.456
352 H LEU 48 H LEU 48 1.427 0.203 -7.317
353 HA LEU 48 HA LEU 48 1.182 3.049 -6.999
354 HG LEU 48 HG LEU 48 3.970 3.788 -6.088
355 HB2 LEU 48 2HB LEU 48 1.791 2.219 -4.721
356 HB3 LEU 48 1HB LEU 48 3.235 1.509 -5.402
357 HD11 LEU 48 1HD1 LEU 48 2.903 5.714 -5.025
358 HD12 LEU 48 2HD1 LEU 48 1.611 4.669 -4.437
359 HD13 LEU 48 3HD1 LEU 48 1.840 4.906 -6.169
360 HD21 LEU 48 3HD2 LEU 48 4.822 2.745 -4.080
361 HD22 LEU 48 1HD2 LEU 48 3.447 3.354 -3.160
362 HD23 LEU 48 2HD2 LEU 48 4.622 4.481 -3.842
363 H ASN 49 H ASN 49 2.485 4.041 -8.440
364 HA ASN 49 HA ASN 49 3.929 4.440 -10.121
365 HB2 ASN 49 2HB ASN 49 5.520 2.167 -8.899
366 HB3 ASN 49 1HB ASN 49 6.086 3.114 -10.266
367 HD21 ASN 49 1HD2 ASN 49 5.658 2.971 -6.887
368 HD22 ASN 49 2HD2 ASN 49 6.352 4.504 -6.506
369 H GLY 50 H GLY 50 1.774 2.327 -10.291
370 HA2 GLY 50 2HA GLY 50 0.918 1.269 -12.170
371 HA3 GLY 50 1HA GLY 50 2.482 1.436 -12.959
372 H LYS 51 H LYS 51 2.902 0.216 -9.877
373 HA LYS 51 HA LYS 51 2.888 -2.543 -10.864
374 HB2 LYS 51 2HB LYS 51 4.678 -1.260 -8.776
375 HB3 LYS 51 1HB LYS 51 4.559 -2.986 -9.011
376 HG2 LYS 51 2HG LYS 51 6.547 -2.291 -10.054
377 HG3 LYS 51 1HG LYS 51 5.404 -2.612 -11.353
378 HD2 LYS 51 2HD LYS 51 4.991 -0.221 -11.584
379 HD3 LYS 51 1HD LYS 51 6.074 0.107 -10.231
380 HE2 LYS 51 2HE LYS 51 6.867 -1.208 -12.824
381 HE3 LYS 51 1HE LYS 51 7.160 0.479 -12.404
382 HZ1 LYS 51 3HZ LYS 51 9.085 -0.917 -12.043
383 HZ2 LYS 51 1HZ LYS 51 8.266 -1.870 -10.947
384 HZ3 LYS 51 2HZ LYS 51 8.594 -0.237 -10.599
385 H GLU 52 H GLU 52 2.222 -4.123 -9.261
386 HA GLU 52 HA GLU 52 1.142 -2.949 -6.902
387 HB2 GLU 52 2HB GLU 52 -0.964 -4.351 -7.048
388 HB3 GLU 52 1HB GLU 52 -0.909 -3.017 -8.164
389 HG2 GLU 52 2HG GLU 52 -1.840 -4.786 -9.364
390 HG3 GLU 52 1HG GLU 52 -0.162 -4.739 -9.896
391 H GLY 53 H GLY 53 1.153 -4.096 -5.124
392 HA2 GLY 53 2HA GLY 53 2.190 -6.804 -5.064
393 HA3 GLY 53 1HA GLY 53 3.324 -5.611 -4.667
394 H VAL 54 H VAL 54 3.452 -6.482 -2.566
395 HA VAL 54 HA VAL 54 1.146 -5.708 -0.941
396 HB VAL 54 HB VAL 54 1.807 -7.424 0.724
397 HG11 VAL 54 1HG1 VAL 54 0.984 -9.368 -0.513
398 HG12 VAL 54 2HG1 VAL 54 1.235 -8.498 -2.026
399 HG13 VAL 54 3HG1 VAL 54 0.046 -7.916 -0.861
400 HG21 VAL 54 3HG2 VAL 54 3.723 -8.357 -1.416
401 HG22 VAL 54 1HG2 VAL 54 3.347 -9.222 0.074
402 HG23 VAL 54 2HG2 VAL 54 4.168 -7.661 0.142
403 H PHE 55 H PHE 55 1.511 -4.943 1.125
404 HA PHE 55 HA PHE 55 4.143 -4.200 1.960
405 HD1 PHE 55 1HD PHE 55 1.351 -2.598 -0.733
406 HD2 PHE 55 2HD PHE 55 1.897 -0.731 3.056
407 HE1 PHE 55 1HE PHE 55 -0.834 -1.503 -0.959
408 HE2 PHE 55 2HE PHE 55 -0.294 0.362 2.837
409 HZ PHE 55 HZ PHE 55 -1.663 -0.022 0.824
410 HB2 PHE 55 2HB PHE 55 3.740 -1.796 1.956
411 HB3 PHE 55 1HB PHE 55 3.570 -2.460 0.317
412 HA PRO 56 HA PRO 56 1.789 -4.463 5.796
413 HB2 PRO 56 2HB PRO 56 3.803 -2.818 7.145
414 HB3 PRO 56 1HB PRO 56 3.455 -4.531 7.372
415 HG2 PRO 56 2HG PRO 56 5.750 -3.665 6.219
416 HG3 PRO 56 1HG PRO 56 4.969 -5.191 5.772
417 HD2 PRO 56 2HD PRO 56 4.887 -2.543 4.368
418 HD3 PRO 56 1HD PRO 56 5.084 -4.180 3.697
419 H ASP 57 H ASP 57 0.184 -3.212 6.649
420 HA ASP 57 HA ASP 57 -0.255 -0.603 5.555
421 HB2 ASP 57 2HB ASP 57 -2.364 -0.576 6.639
422 HB3 ASP 57 1HB ASP 57 -2.078 -2.261 6.233
423 H ASN 58 H ASN 58 1.613 -1.525 8.067
424 HA ASN 58 HA ASN 58 1.177 0.377 10.100
425 HB2 ASN 58 2HB ASN 58 3.801 -0.908 9.315
426 HB3 ASN 58 1HB ASN 58 3.451 -0.128 10.851
427 HD21 ASN 58 1HD2 ASN 58 2.195 -1.208 12.357
428 HD22 ASN 58 2HD2 ASN 58 1.817 -2.878 12.226
429 H PHE 59 H PHE 59 2.581 0.754 6.979
430 HA PHE 59 HA PHE 59 3.991 3.173 7.836
431 HD1 PHE 59 2HD PHE 59 6.878 2.812 7.716
432 HD2 PHE 59 1HD PHE 59 4.745 -0.608 6.339
433 HE1 PHE 59 2HE PHE 59 8.394 1.360 8.977
434 HE2 PHE 59 1HE PHE 59 6.265 -2.062 7.605
435 HZ PHE 59 HZ PHE 59 8.086 -1.079 8.921
436 HB2 PHE 59 2HB PHE 59 4.364 1.521 5.346
437 HB3 PHE 59 1HB PHE 59 5.317 2.935 5.790
438 H ALA 60 H ALA 60 1.018 2.618 6.809
439 HA ALA 60 HA ALA 60 0.881 5.101 5.321
440 HB1 ALA 60 1HB ALA 60 -0.229 2.510 4.220
441 HB2 ALA 60 2HB ALA 60 1.148 3.401 3.566
442 HB3 ALA 60 3HB ALA 60 -0.462 4.117 3.525
443 H VAL 61 H VAL 61 -1.411 5.795 5.113
444 HA VAL 61 HA VAL 61 -3.179 4.428 6.991
445 HB VAL 61 HB VAL 61 -2.263 6.453 8.122
446 HG11 VAL 61 1HG1 VAL 61 -2.887 8.705 7.389
447 HG12 VAL 61 2HG1 VAL 61 -3.589 8.026 5.921
448 HG13 VAL 61 3HG1 VAL 61 -1.858 7.888 6.213
449 HG21 VAL 61 3HG2 VAL 61 -5.200 6.637 7.464
450 HG22 VAL 61 1HG2 VAL 61 -4.408 7.438 8.821
451 HG23 VAL 61 2HG2 VAL 61 -4.467 5.678 8.751
452 H GLN 62 H GLN 62 -5.235 4.208 6.273
453 HA GLN 62 HA GLN 62 -5.651 4.774 3.490
454 HB2 GLN 62 2HB GLN 62 -6.465 2.692 4.720
455 HB3 GLN 62 1HB GLN 62 -7.714 3.716 5.414
456 HG2 GLN 62 2HG GLN 62 -8.467 4.282 3.124
457 HG3 GLN 62 1HG GLN 62 -7.278 3.150 2.490
458 HE21 GLN 62 1HE2 GLN 62 -10.101 3.095 2.138
459 HE22 GLN 62 2HE2 GLN 62 -10.654 1.602 2.736
460 H ILE 63 H ILE 63 -6.831 6.389 2.643
461 HA ILE 63 HA ILE 63 -7.761 8.457 4.463
462 HB ILE 63 HB ILE 63 -7.823 8.411 1.421
463 HG12 ILE 63 2HG1 ILE 63 -5.533 8.158 2.164
464 HG13 ILE 63 1HG1 ILE 63 -5.766 9.761 1.486
465 HG21 ILE 63 1HG2 ILE 63 -7.990 10.852 1.596
466 HG22 ILE 63 2HG2 ILE 63 -7.992 10.723 3.356
467 HG23 ILE 63 3HG2 ILE 63 -9.329 10.052 2.426
468 HD11 ILE 63 3HD1 ILE 63 -5.623 9.070 4.426
469 HD12 ILE 63 1HD1 ILE 63 -5.938 10.678 3.773
470 HD13 ILE 63 2HD1 ILE 63 -4.388 9.897 3.479
471 H SER 64 H SER 64 -9.076 7.008 1.492
472 HA SER 64 HA SER 64 -11.349 6.047 2.822
473 HG SER 64 HG SER 64 -11.451 8.344 3.206
474 HB2 SER 64 2HB SER 64 -11.502 8.082 0.573
475 HB3 SER 64 1HB SER 64 -12.844 7.186 1.279