NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
595958 |
2mvu   |
25284 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 MET 1 HT1 MET 1 19.365 -5.831 6.031
2 H2 MET 1 HT2 MET 1 18.149 -6.037 7.201
3 H3 MET 1 HT3 MET 1 19.746 -6.277 7.616
4 HA MET 1 HA MET 1 18.903 -4.197 8.449
5 HB2 MET 1 HB2 MET 1 21.287 -4.482 7.933
6 HB3 MET 1 HB1 MET 1 21.003 -3.918 6.294
7 HG2 MET 1 HG2 MET 1 20.418 -1.729 7.113
8 HG3 MET 1 HG1 MET 1 20.560 -2.290 8.782
9 HE1 MET 1 HE1 MET 1 24.382 -3.065 9.068
10 HE2 MET 1 HE2 MET 1 23.105 -4.192 8.615
11 HE3 MET 1 HE3 MET 1 22.836 -3.025 9.912
12 H ALA 2 HN ALA 2 19.047 -4.211 4.857
13 HA ALA 2 HA ALA 2 17.395 -1.881 4.724
14 HB1 ALA 2 HB1 ALA 2 17.377 -2.348 2.299
15 HB2 ALA 2 HB2 ALA 2 18.199 -3.883 2.597
16 HB3 ALA 2 HB3 ALA 2 19.022 -2.362 2.940
17 H THR 3 HN THR 3 15.389 -2.053 5.342
18 HA THR 3 HA THR 3 14.110 -4.634 5.299
19 HB THR 3 HB THR 3 13.926 -3.361 7.359
20 HG1 THR 3 HG1 THR 3 11.513 -3.895 6.014
21 HG21 THR 3 HG21 THR 3 12.641 -1.259 7.541
22 HG22 THR 3 HG22 THR 3 12.495 -1.211 5.782
23 HG23 THR 3 HG23 THR 3 14.084 -1.085 6.543
24 H LEU 4 HN LEU 4 14.207 -4.670 2.990
25 HA LEU 4 HA LEU 4 12.624 -3.077 1.281
26 HB2 LEU 4 HB2 LEU 4 14.399 -4.793 0.642
27 HB3 LEU 4 HB1 LEU 4 13.182 -6.034 0.932
28 HG LEU 4 HG LEU 4 11.825 -4.808 -0.841
29 HD11 LEU 4 HD11 LEU 4 14.521 -3.551 -1.358
30 HD12 LEU 4 HD12 LEU 4 13.075 -2.717 -0.810
31 HD13 LEU 4 HD13 LEU 4 13.116 -3.440 -2.417
32 HD21 LEU 4 HD21 LEU 4 13.035 -5.917 -2.664
33 HD22 LEU 4 HD22 LEU 4 12.927 -6.947 -1.234
34 HD23 LEU 4 HD23 LEU 4 14.436 -6.119 -1.610
35 H LEU 5 HN LEU 5 10.447 -3.001 1.126
36 HA LEU 5 HA LEU 5 8.917 -4.394 3.087
37 HB2 LEU 5 HB2 LEU 5 8.678 -1.982 2.074
38 HB3 LEU 5 HB1 LEU 5 7.773 -2.774 0.811
39 HG LEU 5 HG LEU 5 7.010 -2.781 3.746
40 HD11 LEU 5 HD11 LEU 5 5.262 -1.226 3.090
41 HD12 LEU 5 HD12 LEU 5 5.894 -1.211 1.443
42 HD13 LEU 5 HD13 LEU 5 6.863 -0.565 2.767
43 HD21 LEU 5 HD21 LEU 5 5.457 -3.622 1.316
44 HD22 LEU 5 HD22 LEU 5 4.879 -3.616 2.986
45 HD23 LEU 5 HD23 LEU 5 6.174 -4.713 2.496
46 H THR 6 HN THR 6 8.173 -6.376 2.845
47 HA THR 6 HA THR 6 8.054 -7.538 0.172
48 HB THR 6 HB THR 6 7.806 -9.711 1.385
49 HG1 THR 6 HG1 THR 6 8.262 -8.079 3.696
50 HG21 THR 6 HG21 THR 6 10.115 -9.786 2.257
51 HG22 THR 6 HG22 THR 6 10.170 -8.022 2.239
52 HG23 THR 6 HG23 THR 6 10.033 -8.917 0.726
53 H THR 7 HN THR 7 6.196 -9.356 0.057
54 HA THR 7 HA THR 7 3.740 -8.092 0.007
55 HB THR 7 HB THR 7 4.214 -11.075 0.181
56 HG1 THR 7 HG1 THR 7 4.741 -10.949 -2.029
57 HG21 THR 7 HG21 THR 7 2.283 -9.368 -1.418
58 HG22 THR 7 HG22 THR 7 1.875 -10.313 0.018
59 HG23 THR 7 HG23 THR 7 2.370 -11.129 -1.461
60 H ASP 8 HN ASP 8 5.352 -10.160 2.386
61 HA ASP 8 HA ASP 8 3.117 -10.566 4.074
62 HB2 ASP 8 HB2 ASP 8 6.077 -10.834 4.661
63 HB3 ASP 8 HB1 ASP 8 4.800 -11.336 5.760
64 H ASP 9 HN ASP 9 5.689 -8.156 3.985
65 HA ASP 9 HA ASP 9 4.983 -6.916 6.478
66 HB2 ASP 9 HB2 ASP 9 6.326 -5.576 4.105
67 HB3 ASP 9 HB1 ASP 9 6.211 -4.916 5.723
68 H LEU 10 HN LEU 10 4.106 -6.380 3.119
69 HA LEU 10 HA LEU 10 2.527 -4.090 3.562
70 HB2 LEU 10 HB2 LEU 10 3.371 -4.784 1.344
71 HB3 LEU 10 HB1 LEU 10 2.261 -6.139 1.359
72 HG LEU 10 HG LEU 10 0.362 -4.518 1.448
73 HD11 LEU 10 HD11 LEU 10 2.513 -2.464 0.987
74 HD12 LEU 10 HD12 LEU 10 1.514 -2.635 2.432
75 HD13 LEU 10 HD13 LEU 10 0.773 -2.179 0.898
76 HD21 LEU 10 HD21 LEU 10 1.046 -5.503 -0.670
77 HD22 LEU 10 HD22 LEU 10 2.258 -4.239 -0.887
78 HD23 LEU 10 HD23 LEU 10 0.543 -3.828 -0.907
79 H ARG 11 HN ARG 11 1.790 -7.535 3.554
80 HA ARG 11 HA ARG 11 -0.987 -7.375 3.749
81 HB2 ARG 11 HB2 ARG 11 0.425 -9.456 3.376
82 HB3 ARG 11 HB1 ARG 11 0.728 -9.470 5.100
83 HG2 ARG 11 HG2 ARG 11 -1.675 -9.716 5.531
84 HG3 ARG 11 HG1 ARG 11 -1.985 -9.696 3.796
85 HD2 ARG 11 HD2 ARG 11 -1.984 -11.973 4.473
86 HD3 ARG 11 HD1 ARG 11 -0.469 -11.696 3.610
87 HE ARG 11 HE ARG 11 -0.760 -11.837 6.517
88 HH11 ARG 11 HH11 ARG 11 1.215 -12.369 3.584
89 HH12 ARG 11 HH12 ARG 11 2.513 -13.051 4.451
90 HH21 ARG 11 HH21 ARG 11 1.025 -12.861 7.639
91 HH22 ARG 11 HH22 ARG 11 2.408 -13.336 6.796
92 H ARG 12 HN ARG 12 1.485 -6.939 6.161
93 HA ARG 12 HA ARG 12 -0.377 -6.806 8.375
94 HB2 ARG 12 HB2 ARG 12 2.482 -5.831 8.165
95 HB3 ARG 12 HB1 ARG 12 1.542 -5.935 9.645
96 HG2 ARG 12 HG2 ARG 12 1.500 -8.385 9.406
97 HG3 ARG 12 HG1 ARG 12 2.482 -8.237 7.946
98 HD2 ARG 12 HD2 ARG 12 4.254 -7.167 9.199
99 HD3 ARG 12 HD1 ARG 12 3.285 -7.203 10.661
100 HE ARG 12 HE ARG 12 4.275 -9.609 9.289
101 HH11 ARG 12 HH11 ARG 12 3.523 -7.836 12.279
102 HH12 ARG 12 HH12 ARG 12 4.134 -9.054 13.318
103 HH21 ARG 12 HH21 ARG 12 5.057 -11.296 10.711
104 HH22 ARG 12 HH22 ARG 12 4.975 -11.105 12.388
105 H ALA 13 HN ALA 13 1.685 -4.457 6.716
106 HA ALA 13 HA ALA 13 0.808 -2.209 8.104
107 HB1 ALA 13 HB1 ALA 13 2.915 -2.316 6.869
108 HB2 ALA 13 HB2 ALA 13 1.950 -0.891 6.450
109 HB3 ALA 13 HB3 ALA 13 1.995 -2.263 5.356
110 H LEU 14 HN LEU 14 -0.469 -3.561 5.109
111 HA LEU 14 HA LEU 14 -2.038 -1.377 4.347
112 HB2 LEU 14 HB2 LEU 14 -1.420 -3.484 3.056
113 HB3 LEU 14 HB1 LEU 14 -2.648 -4.312 3.979
114 HG LEU 14 HG LEU 14 -4.363 -2.848 2.983
115 HD11 LEU 14 HD11 LEU 14 -3.786 -1.452 1.067
116 HD12 LEU 14 HD12 LEU 14 -2.077 -1.818 1.300
117 HD13 LEU 14 HD13 LEU 14 -2.958 -0.899 2.523
118 HD21 LEU 14 HD21 LEU 14 -2.599 -4.285 1.005
119 HD22 LEU 14 HD22 LEU 14 -4.288 -3.836 0.749
120 HD23 LEU 14 HD23 LEU 14 -3.865 -5.009 1.993
121 H VAL 15 HN VAL 15 -2.609 -4.104 6.503
122 HA VAL 15 HA VAL 15 -5.344 -3.557 7.106
123 HB VAL 15 HB VAL 15 -3.272 -5.153 8.645
124 HG11 VAL 15 HG11 VAL 15 -6.313 -5.245 8.825
125 HG12 VAL 15 HG12 VAL 15 -5.235 -4.588 10.057
126 HG13 VAL 15 HG13 VAL 15 -5.202 -6.311 9.683
127 HG21 VAL 15 HG21 VAL 15 -4.288 -7.105 7.571
128 HG22 VAL 15 HG22 VAL 15 -3.561 -5.976 6.423
129 HG23 VAL 15 HG23 VAL 15 -5.318 -6.026 6.622
130 H GLU 16 HN GLU 16 -2.298 -2.554 8.380
131 HA GLU 16 HA GLU 16 -3.219 -1.522 10.866
132 HB2 GLU 16 HB2 GLU 16 -0.688 -0.917 9.337
133 HB3 GLU 16 HB1 GLU 16 -0.996 -0.496 11.016
134 HG2 GLU 16 HG2 GLU 16 -0.895 -3.270 9.877
135 HG3 GLU 16 HG1 GLU 16 0.372 -2.522 10.842
136 H SER 17 HN SER 17 -3.636 -0.415 7.763
137 HA SER 17 HA SER 17 -3.899 2.343 8.681
138 HB2 SER 17 HB2 SER 17 -3.565 1.304 5.869
139 HB3 SER 17 HB1 SER 17 -3.540 2.993 6.389
140 HG SER 17 HG SER 17 -1.653 0.953 6.852
141 H ALA 18 HN ALA 18 -5.731 -0.257 8.506
142 HA ALA 18 HA ALA 18 -8.069 1.190 7.480
143 HB1 ALA 18 HB1 ALA 18 -7.519 -1.779 7.298
144 HB2 ALA 18 HB2 ALA 18 -7.498 -0.645 5.947
145 HB3 ALA 18 HB3 ALA 18 -9.010 -0.984 6.790
146 H GLY 19 HN GLY 19 -9.519 1.503 9.007
147 HA2 GLY 19 HA2 GLY 19 -9.121 0.124 11.557
148 HA3 GLY 19 HA1 GLY 19 -9.976 1.634 11.320
149 H GLU 20 HN GLU 20 -11.905 1.119 9.550
150 HA GLU 20 HA GLU 20 -13.511 -0.731 11.127
151 HB2 GLU 20 HB2 GLU 20 -15.498 0.359 10.065
152 HB3 GLU 20 HB1 GLU 20 -14.524 1.424 11.055
153 HG2 GLU 20 HG2 GLU 20 -14.262 1.300 8.060
154 HG3 GLU 20 HG1 GLU 20 -15.398 2.371 8.887
155 H THR 21 HN THR 21 -11.900 -0.659 8.415
156 HA THR 21 HA THR 21 -13.568 -2.634 7.076
157 HB THR 21 HB THR 21 -11.036 -1.246 6.189
158 HG1 THR 21 HG1 THR 21 -13.777 -0.869 5.511
159 HG21 THR 21 HG21 THR 21 -11.564 -2.187 3.956
160 HG22 THR 21 HG22 THR 21 -12.997 -2.970 4.639
161 HG23 THR 21 HG23 THR 21 -11.396 -3.478 5.153
162 H ASP 22 HN ASP 22 -13.234 -3.913 8.889
163 HA ASP 22 HA ASP 22 -10.693 -5.344 8.791
164 HB2 ASP 22 HB2 ASP 22 -10.946 -4.413 10.976
165 HB3 ASP 22 HB1 ASP 22 -12.623 -4.942 11.072
166 H GLY 23 HN GLY 23 -10.779 -7.347 8.247
167 HA2 GLY 23 HA2 GLY 23 -11.855 -9.510 8.463
168 HA3 GLY 23 HA1 GLY 23 -13.398 -8.657 8.310
169 H THR 24 HN THR 24 -10.731 -7.885 6.214
170 HA THR 24 HA THR 24 -12.269 -8.866 3.986
171 HB THR 24 HB THR 24 -10.363 -7.729 2.710
172 HG1 THR 24 HG1 THR 24 -9.132 -6.256 4.075
173 HG21 THR 24 HG21 THR 24 -11.194 -5.466 3.188
174 HG22 THR 24 HG22 THR 24 -11.939 -6.052 4.675
175 HG23 THR 24 HG23 THR 24 -12.528 -6.619 3.112
176 H ASP 25 HN ASP 25 -10.213 -9.630 2.222
177 HA ASP 25 HA ASP 25 -8.795 -11.679 3.745
178 HB2 ASP 25 HB2 ASP 25 -10.613 -12.763 2.380
179 HB3 ASP 25 HB1 ASP 25 -9.833 -12.124 0.933
180 H LEU 26 HN LEU 26 -6.778 -11.394 3.643
181 HA LEU 26 HA LEU 26 -5.654 -10.110 1.250
182 HB2 LEU 26 HB2 LEU 26 -5.945 -8.891 3.628
183 HB3 LEU 26 HB1 LEU 26 -4.479 -9.782 3.964
184 HG LEU 26 HG LEU 26 -3.412 -8.670 2.003
185 HD11 LEU 26 HD11 LEU 26 -5.964 -7.072 2.014
186 HD12 LEU 26 HD12 LEU 26 -5.431 -8.166 0.745
187 HD13 LEU 26 HD13 LEU 26 -4.520 -6.688 1.080
188 HD21 LEU 26 HD21 LEU 26 -3.087 -7.823 4.264
189 HD22 LEU 26 HD22 LEU 26 -4.546 -6.851 4.124
190 HD23 LEU 26 HD23 LEU 26 -3.151 -6.499 3.102
191 H SER 27 HN SER 27 -6.041 -12.956 2.168
192 HA SER 27 HA SER 27 -3.223 -13.618 2.593
193 HB2 SER 27 HB2 SER 27 -4.683 -14.005 4.609
194 HB3 SER 27 HB1 SER 27 -5.546 -15.221 3.678
195 HG SER 27 HG SER 27 -4.086 -16.424 4.631
196 H GLY 28 HN GLY 28 -5.891 -14.127 0.743
197 HA2 GLY 28 HA2 GLY 28 -4.778 -16.543 -0.517
198 HA3 GLY 28 HA1 GLY 28 -6.386 -15.900 -0.812
199 H ASP 29 HN ASP 29 -3.090 -14.726 -1.020
200 HA ASP 29 HA ASP 29 -1.941 -13.489 -2.503
201 HB2 ASP 29 HB2 ASP 29 -2.148 -15.499 -3.932
202 HB3 ASP 29 HB1 ASP 29 -3.625 -14.841 -4.628
203 H PHE 30 HN PHE 30 -2.469 -11.517 -1.953
204 HA PHE 30 HA PHE 30 -4.776 -10.255 -3.255
205 HB2 PHE 30 HB2 PHE 30 -4.598 -8.536 -1.560
206 HB3 PHE 30 HB1 PHE 30 -4.568 -10.109 -0.780
207 HD1 PHE 30 HD2 PHE 30 -2.309 -11.027 -0.017
208 HD2 PHE 30 HD1 PHE 30 -2.866 -6.989 -1.233
209 HE1 PHE 30 HE2 PHE 30 -0.239 -10.394 1.144
210 HE2 PHE 30 HE1 PHE 30 -0.795 -6.350 -0.076
211 HZ PHE 30 HZ PHE 30 0.519 -8.049 1.118
212 H LEU 31 HN LEU 31 -1.632 -10.730 -3.889
213 HA LEU 31 HA LEU 31 -0.582 -8.112 -4.067
214 HB2 LEU 31 HB2 LEU 31 0.739 -10.199 -3.770
215 HB3 LEU 31 HB1 LEU 31 0.422 -10.587 -5.447
216 HG LEU 31 HG LEU 31 1.657 -8.556 -6.128
217 HD11 LEU 31 HD11 LEU 31 1.269 -7.212 -4.130
218 HD12 LEU 31 HD12 LEU 31 2.991 -7.352 -4.466
219 HD13 LEU 31 HD13 LEU 31 2.262 -8.320 -3.181
220 HD21 LEU 31 HD21 LEU 31 3.880 -9.385 -5.552
221 HD22 LEU 31 HD22 LEU 31 2.803 -10.710 -5.981
222 HD23 LEU 31 HD23 LEU 31 3.179 -10.394 -4.287
223 H ASP 32 HN ASP 32 -2.141 -10.185 -6.452
224 HA ASP 32 HA ASP 32 -1.940 -7.976 -8.389
225 HB2 ASP 32 HB2 ASP 32 -2.365 -10.917 -8.827
226 HB3 ASP 32 HB1 ASP 32 -2.733 -9.728 -10.076
227 H LEU 33 HN LEU 33 -3.889 -8.666 -6.119
228 HA LEU 33 HA LEU 33 -6.374 -8.766 -7.626
229 HB2 LEU 33 HB2 LEU 33 -5.941 -10.021 -5.415
230 HB3 LEU 33 HB1 LEU 33 -6.002 -8.457 -4.636
231 HG LEU 33 HG LEU 33 -8.342 -8.186 -5.340
232 HD11 LEU 33 HD11 LEU 33 -8.246 -9.482 -7.404
233 HD12 LEU 33 HD12 LEU 33 -9.541 -10.058 -6.355
234 HD13 LEU 33 HD13 LEU 33 -8.033 -10.967 -6.472
235 HD21 LEU 33 HD21 LEU 33 -7.861 -9.219 -3.178
236 HD22 LEU 33 HD22 LEU 33 -7.770 -10.803 -3.950
237 HD23 LEU 33 HD23 LEU 33 -9.300 -9.932 -3.913
238 H ARG 34 HN ARG 34 -8.038 -6.895 -6.970
239 HA ARG 34 HA ARG 34 -6.406 -4.486 -7.258
240 HB2 ARG 34 HB2 ARG 34 -9.373 -4.792 -7.788
241 HB3 ARG 34 HB1 ARG 34 -8.345 -3.434 -8.243
242 HG2 ARG 34 HG2 ARG 34 -7.104 -4.924 -9.773
243 HG3 ARG 34 HG1 ARG 34 -8.208 -6.234 -9.341
244 HD2 ARG 34 HD2 ARG 34 -8.973 -5.321 -11.397
245 HD3 ARG 34 HD1 ARG 34 -10.090 -4.792 -10.144
246 HE ARG 34 HE ARG 34 -7.989 -2.922 -10.622
247 HH11 ARG 34 HH11 ARG 34 -11.046 -4.036 -11.991
248 HH12 ARG 34 HH12 ARG 34 -11.465 -2.529 -12.675
249 HH21 ARG 34 HH21 ARG 34 -8.515 -0.923 -11.555
250 HH22 ARG 34 HH22 ARG 34 -9.985 -0.673 -12.431
251 H PHE 35 HN PHE 35 -6.978 -2.604 -6.055
252 HA PHE 35 HA PHE 35 -7.460 -3.115 -3.354
253 HB2 PHE 35 HB2 PHE 35 -7.475 -0.505 -4.855
254 HB3 PHE 35 HB1 PHE 35 -7.802 -0.575 -3.130
255 HD1 PHE 35 HD2 PHE 35 -6.021 -1.399 -1.580
256 HD2 PHE 35 HD1 PHE 35 -5.284 -0.711 -5.713
257 HE1 PHE 35 HE2 PHE 35 -3.607 -1.370 -1.142
258 HE2 PHE 35 HE1 PHE 35 -2.865 -0.683 -5.283
259 HZ PHE 35 HZ PHE 35 -2.034 -1.042 -2.933
260 H GLU 36 HN GLU 36 -9.756 -2.477 -5.837
261 HA GLU 36 HA GLU 36 -11.949 -1.795 -4.156
262 HB2 GLU 36 HB2 GLU 36 -13.357 -2.312 -6.086
263 HB3 GLU 36 HB1 GLU 36 -11.976 -1.340 -6.580
264 HG2 GLU 36 HG2 GLU 36 -10.920 -3.177 -7.593
265 HG3 GLU 36 HG1 GLU 36 -11.999 -4.330 -6.808
266 H ASP 37 HN ASP 37 -10.462 -4.807 -5.103
267 HA ASP 37 HA ASP 37 -12.736 -6.447 -4.416
268 HB2 ASP 37 HB2 ASP 37 -9.875 -7.325 -4.886
269 HB3 ASP 37 HB1 ASP 37 -11.297 -8.352 -4.850
270 H ILE 38 HN ILE 38 -9.744 -5.388 -3.026
271 HA ILE 38 HA ILE 38 -10.182 -7.029 -0.704
272 HB ILE 38 HB ILE 38 -8.062 -6.089 0.194
273 HG12 ILE 38 HG12 ILE 38 -7.934 -4.648 -2.469
274 HG13 ILE 38 HG11 ILE 38 -8.138 -3.880 -0.898
275 HG21 ILE 38 HG21 ILE 38 -7.876 -7.190 -2.610
276 HG22 ILE 38 HG22 ILE 38 -8.078 -8.133 -1.132
277 HG23 ILE 38 HG23 ILE 38 -6.595 -7.217 -1.394
278 HD11 ILE 38 HD11 ILE 38 -5.917 -4.671 -0.244
279 HD12 ILE 38 HD12 ILE 38 -5.859 -3.658 -1.685
280 HD13 ILE 38 HD13 ILE 38 -5.714 -5.411 -1.829
281 H GLY 39 HN GLY 39 -11.773 -4.546 -1.592
282 HA2 GLY 39 HA2 GLY 39 -13.163 -3.078 -0.528
283 HA3 GLY 39 HA1 GLY 39 -12.794 -3.943 0.951
284 H TYR 40 HN TYR 40 -10.580 -2.063 -1.102
285 HA TYR 40 HA TYR 40 -10.095 -0.518 1.282
286 HB2 TYR 40 HB2 TYR 40 -8.297 -1.332 -0.897
287 HB3 TYR 40 HB1 TYR 40 -8.021 0.267 -0.201
288 HD1 TYR 40 HD2 TYR 40 -8.639 -3.243 0.799
289 HD2 TYR 40 HD1 TYR 40 -6.788 0.457 1.738
290 HE1 TYR 40 HE2 TYR 40 -7.521 -4.316 2.650
291 HE2 TYR 40 HE1 TYR 40 -5.621 -0.577 3.612
292 HH TYR 40 HH TYR 40 -5.625 -3.992 4.105
293 H ASP 41 HN ASP 41 -10.227 1.470 1.518
294 HA ASP 41 HA ASP 41 -11.913 2.891 -0.327
295 HB2 ASP 41 HB2 ASP 41 -12.026 2.978 2.275
296 HB3 ASP 41 HB1 ASP 41 -10.602 4.024 2.111
297 H SER 42 HN SER 42 -11.262 5.233 -0.526
298 HA SER 42 HA SER 42 -8.963 5.319 -2.253
299 HB2 SER 42 HB2 SER 42 -11.312 6.295 -2.632
300 HB3 SER 42 HB1 SER 42 -10.872 7.519 -1.455
301 H LEU 43 HN LEU 43 -10.213 6.859 0.699
302 HA LEU 43 HA LEU 43 -7.919 8.477 1.190
303 HB2 LEU 43 HB2 LEU 43 -10.179 7.636 3.015
304 HB3 LEU 43 HB1 LEU 43 -8.980 8.852 3.396
305 HG LEU 43 HG LEU 43 -10.944 9.065 1.113
306 HD11 LEU 43 HD11 LEU 43 -12.082 9.113 3.268
307 HD12 LEU 43 HD12 LEU 43 -12.081 10.714 2.525
308 HD13 LEU 43 HD13 LEU 43 -10.967 10.352 3.842
309 HD21 LEU 43 HD21 LEU 43 -10.225 11.416 1.079
310 HD22 LEU 43 HD22 LEU 43 -8.884 10.318 0.754
311 HD23 LEU 43 HD23 LEU 43 -9.049 11.062 2.343
312 H ALA 44 HN ALA 44 -9.040 5.361 2.242
313 HA ALA 44 HA ALA 44 -7.273 4.814 4.308
314 HB1 ALA 44 HB1 ALA 44 -7.752 2.464 3.932
315 HB2 ALA 44 HB2 ALA 44 -8.409 2.834 2.342
316 HB3 ALA 44 HB3 ALA 44 -9.228 3.416 3.792
317 H LEU 45 HN LEU 45 -6.803 4.537 0.834
318 HA LEU 45 HA LEU 45 -4.366 3.124 1.101
319 HB2 LEU 45 HB2 LEU 45 -5.751 2.958 -0.853
320 HB3 LEU 45 HB1 LEU 45 -5.470 4.644 -1.227
321 HG LEU 45 HG LEU 45 -3.367 4.224 -2.141
322 HD11 LEU 45 HD11 LEU 45 -1.942 2.356 -1.526
323 HD12 LEU 45 HD12 LEU 45 -3.204 1.654 -0.507
324 HD13 LEU 45 HD13 LEU 45 -2.425 3.178 -0.047
325 HD21 LEU 45 HD21 LEU 45 -4.727 1.676 -2.099
326 HD22 LEU 45 HD22 LEU 45 -3.487 2.116 -3.292
327 HD23 LEU 45 HD23 LEU 45 -5.090 2.942 -3.285
328 H MET 46 HN MET 46 -5.277 6.520 0.781
329 HA MET 46 HA MET 46 -2.725 7.713 0.321
330 HB2 MET 46 HB2 MET 46 -4.831 8.953 2.092
331 HB3 MET 46 HB1 MET 46 -3.696 9.773 1.025
332 HG2 MET 46 HG2 MET 46 -4.929 8.734 -0.884
333 HG3 MET 46 HG1 MET 46 -6.051 8.143 0.340
334 HE1 MET 46 HE1 MET 46 -5.449 12.679 -0.359
335 HE2 MET 46 HE2 MET 46 -4.553 11.455 -1.251
336 HE3 MET 46 HE3 MET 46 -4.283 11.657 0.482
337 H GLU 47 HN GLU 47 -4.561 6.975 3.112
338 HA GLU 47 HA GLU 47 -2.841 7.687 5.153
339 HB2 GLU 47 HB2 GLU 47 -5.166 6.137 4.604
340 HB3 GLU 47 HB1 GLU 47 -4.492 5.772 6.218
341 HG2 GLU 47 HG2 GLU 47 -4.649 8.306 6.549
342 HG3 GLU 47 HG1 GLU 47 -5.486 8.354 5.005
343 H THR 48 HN THR 48 -3.375 4.529 3.615
344 HA THR 48 HA THR 48 -1.522 2.934 4.938
345 HB THR 48 HB THR 48 -2.342 2.931 2.014
346 HG1 THR 48 HG1 THR 48 -4.052 2.609 3.522
347 HG21 THR 48 HG21 THR 48 -0.276 1.628 2.305
348 HG22 THR 48 HG22 THR 48 -1.645 0.616 1.897
349 HG23 THR 48 HG23 THR 48 -1.049 0.659 3.568
350 H ALA 49 HN ALA 49 -1.097 4.978 2.139
351 HA ALA 49 HA ALA 49 1.601 4.408 1.601
352 HB1 ALA 49 HB1 ALA 49 1.589 6.411 0.193
353 HB2 ALA 49 HB2 ALA 49 0.066 6.920 0.924
354 HB3 ALA 49 HB3 ALA 49 0.125 5.450 -0.051
355 H ALA 50 HN ALA 50 0.110 7.149 3.315
356 HA ALA 50 HA ALA 50 2.431 8.503 4.060
357 HB1 ALA 50 HB1 ALA 50 1.056 9.598 5.768
358 HB2 ALA 50 HB2 ALA 50 -0.191 8.366 5.556
359 HB3 ALA 50 HB3 ALA 50 0.191 9.473 4.235
360 H ARG 51 HN ARG 51 0.732 5.888 5.633
361 HA ARG 51 HA ARG 51 2.092 5.758 8.024
362 HB2 ARG 51 HB2 ARG 51 0.079 4.459 7.634
363 HB3 ARG 51 HB1 ARG 51 0.834 3.586 6.323
364 HG2 ARG 51 HG2 ARG 51 0.805 2.012 7.983
365 HG3 ARG 51 HG1 ARG 51 2.418 2.685 8.175
366 HD2 ARG 51 HD2 ARG 51 1.164 2.278 10.230
367 HD3 ARG 51 HD1 ARG 51 1.700 3.931 10.181
368 HE ARG 51 HE ARG 51 -0.911 3.550 9.066
369 HH11 ARG 51 HH11 ARG 51 0.818 3.984 12.133
370 HH12 ARG 51 HH12 ARG 51 -0.578 4.422 13.012
371 HH21 ARG 51 HH21 ARG 51 -2.836 4.299 10.281
372 HH22 ARG 51 HH22 ARG 51 -2.655 4.604 11.937
373 H LEU 52 HN LEU 52 2.674 4.134 4.956
374 HA LEU 52 HA LEU 52 4.995 2.735 5.736
375 HB2 LEU 52 HB2 LEU 52 4.002 3.458 2.985
376 HB3 LEU 52 HB1 LEU 52 5.276 2.305 3.333
377 HG LEU 52 HG LEU 52 2.398 2.038 4.184
378 HD11 LEU 52 HD11 LEU 52 2.649 1.744 1.798
379 HD12 LEU 52 HD12 LEU 52 2.318 0.197 2.581
380 HD13 LEU 52 HD13 LEU 52 3.955 0.591 2.057
381 HD21 LEU 52 HD21 LEU 52 3.034 -0.217 4.872
382 HD22 LEU 52 HD22 LEU 52 3.920 1.017 5.772
383 HD23 LEU 52 HD23 LEU 52 4.713 0.132 4.465
384 H GLU 53 HN GLU 53 4.463 5.810 4.083
385 HA GLU 53 HA GLU 53 7.084 6.486 3.412
386 HB2 GLU 53 HB2 GLU 53 4.864 8.298 4.383
387 HB3 GLU 53 HB1 GLU 53 6.363 8.865 3.681
388 HG2 GLU 53 HG2 GLU 53 5.766 7.784 1.570
389 HG3 GLU 53 HG1 GLU 53 4.253 7.230 2.296
390 H SER 54 HN SER 54 5.333 7.105 6.423
391 HA SER 54 HA SER 54 7.512 8.469 7.611
392 HB2 SER 54 HB2 SER 54 5.133 8.939 8.127
393 HB3 SER 54 HB1 SER 54 5.016 7.368 8.918
394 HG SER 54 HG SER 54 6.885 9.370 9.646
395 H ARG 55 HN ARG 55 6.416 5.115 7.705
396 HA ARG 55 HA ARG 55 8.156 4.500 9.903
397 HB2 ARG 55 HB2 ARG 55 6.165 3.148 9.706
398 HB3 ARG 55 HB1 ARG 55 6.607 2.660 8.071
399 HG2 ARG 55 HG2 ARG 55 8.522 1.423 8.938
400 HG3 ARG 55 HG1 ARG 55 8.151 1.959 10.572
401 HD2 ARG 55 HD2 ARG 55 6.120 0.696 10.599
402 HD3 ARG 55 HD1 ARG 55 6.266 0.326 8.879
403 HE ARG 55 HE ARG 55 8.546 -0.687 9.899
404 HH11 ARG 55 HH11 ARG 55 5.184 -1.159 11.065
405 HH12 ARG 55 HH12 ARG 55 5.476 -2.811 11.423
406 HH21 ARG 55 HH21 ARG 55 8.813 -2.931 10.396
407 HH22 ARG 55 HH22 ARG 55 7.479 -3.806 11.042
408 H TYR 56 HN TYR 56 8.333 3.899 6.398
409 HA TYR 56 HA TYR 56 10.892 2.621 6.877
410 HB2 TYR 56 HB2 TYR 56 9.289 2.840 4.323
411 HB3 TYR 56 HB1 TYR 56 10.827 1.997 4.476
412 HD1 TYR 56 HD1 TYR 56 10.958 0.049 6.128
413 HD2 TYR 56 HD2 TYR 56 7.279 1.760 4.858
414 HE1 TYR 56 HE1 TYR 56 9.774 -1.987 6.816
415 HE2 TYR 56 HE2 TYR 56 6.086 -0.277 5.550
416 HH TYR 56 HH TYR 56 7.454 -2.643 7.502
417 H GLY 57 HN GLY 57 9.802 5.704 6.051
418 HA2 GLY 57 HA2 GLY 57 11.126 7.596 5.859
419 HA3 GLY 57 HA1 GLY 57 12.546 6.570 5.707
420 H VAL 58 HN VAL 58 9.536 7.073 3.929
421 HA VAL 58 HA VAL 58 11.068 7.605 1.498
422 HB VAL 58 HB VAL 58 9.624 6.186 0.096
423 HG11 VAL 58 HG11 VAL 58 10.713 4.602 2.390
424 HG12 VAL 58 HG12 VAL 58 11.641 5.142 0.977
425 HG13 VAL 58 HG13 VAL 58 10.336 3.962 0.792
426 HG21 VAL 58 HG21 VAL 58 8.312 5.267 2.660
427 HG22 VAL 58 HG22 VAL 58 8.010 4.600 1.057
428 HG23 VAL 58 HG23 VAL 58 7.579 6.274 1.412
429 H SER 59 HN SER 59 9.087 8.109 -0.289
430 HA SER 59 HA SER 59 6.907 9.400 0.976
431 HB2 SER 59 HB2 SER 59 8.724 11.132 1.031
432 HB3 SER 59 HB1 SER 59 8.771 11.066 -0.737
433 HG SER 59 HG SER 59 6.305 11.452 0.522
434 H ILE 60 HN ILE 60 5.203 9.586 -0.359
435 HA ILE 60 HA ILE 60 5.502 8.909 -3.203
436 HB ILE 60 HB ILE 60 3.360 7.767 -1.367
437 HG12 ILE 60 HG12 ILE 60 5.609 6.305 -2.773
438 HG13 ILE 60 HG11 ILE 60 5.519 6.622 -1.039
439 HG21 ILE 60 HG21 ILE 60 2.616 6.483 -3.327
440 HG22 ILE 60 HG22 ILE 60 3.830 7.298 -4.314
441 HG23 ILE 60 HG23 ILE 60 2.513 8.227 -3.605
442 HD11 ILE 60 HD11 ILE 60 3.505 5.250 -0.903
443 HD12 ILE 60 HD12 ILE 60 4.871 4.340 -1.553
444 HD13 ILE 60 HD13 ILE 60 3.608 4.926 -2.634
445 HA PRO 61 HA PRO 61 2.861 12.610 -3.411
446 HB2 PRO 61 HB2 PRO 61 2.334 11.373 -6.087
447 HB3 PRO 61 HB1 PRO 61 2.772 13.041 -5.698
448 HG2 PRO 61 HG2 PRO 61 4.578 11.422 -6.751
449 HG3 PRO 61 HG1 PRO 61 5.023 12.526 -5.438
450 HD2 PRO 61 HD2 PRO 61 4.500 9.584 -5.336
451 HD3 PRO 61 HD1 PRO 61 5.736 10.539 -4.493
452 H ASP 62 HN ASP 62 0.719 12.724 -2.836
453 HA ASP 62 HA ASP 62 -0.540 10.309 -2.149
454 HB2 ASP 62 HB2 ASP 62 -2.412 11.598 -1.314
455 HB3 ASP 62 HB1 ASP 62 -0.894 12.321 -0.795
456 H ASP 63 HN ASP 63 -0.931 12.307 -4.967
457 HA ASP 63 HA ASP 63 -3.361 11.049 -5.764
458 HB2 ASP 63 HB2 ASP 63 -3.183 12.161 -7.848
459 HB3 ASP 63 HB1 ASP 63 -2.532 13.279 -6.665
460 H VAL 64 HN VAL 64 -0.023 10.216 -6.042
461 HA VAL 64 HA VAL 64 -0.391 8.337 -8.170
462 HB VAL 64 HB VAL 64 1.966 8.613 -6.254
463 HG11 VAL 64 HG11 VAL 64 1.801 7.119 -8.879
464 HG12 VAL 64 HG12 VAL 64 1.900 6.383 -7.281
465 HG13 VAL 64 HG13 VAL 64 3.254 7.333 -7.899
466 HG21 VAL 64 HG21 VAL 64 1.581 9.638 -9.062
467 HG22 VAL 64 HG22 VAL 64 3.062 9.768 -8.107
468 HG23 VAL 64 HG23 VAL 64 1.599 10.604 -7.587
469 H ALA 65 HN ALA 65 -0.849 8.294 -4.797
470 HA ALA 65 HA ALA 65 -0.762 5.502 -4.375
471 HB1 ALA 65 HB1 ALA 65 -2.076 6.023 -2.379
472 HB2 ALA 65 HB2 ALA 65 -2.263 7.688 -2.952
473 HB3 ALA 65 HB3 ALA 65 -0.654 7.073 -2.540
474 H GLY 66 HN GLY 66 -3.134 7.781 -5.532
475 HA2 GLY 66 HA2 GLY 66 -5.242 5.799 -5.566
476 HA3 GLY 66 HA1 GLY 66 -5.379 7.473 -6.096
477 H ARG 67 HN ARG 67 -2.630 6.441 -7.488
478 HA ARG 67 HA ARG 67 -3.987 5.915 -9.993
479 HB2 ARG 67 HB2 ARG 67 -1.097 6.498 -9.367
480 HB3 ARG 67 HB1 ARG 67 -1.680 6.094 -10.976
481 HG2 ARG 67 HG2 ARG 67 -3.148 8.076 -10.893
482 HG3 ARG 67 HG1 ARG 67 -2.460 8.480 -9.319
483 HD2 ARG 67 HD2 ARG 67 -1.395 9.783 -11.074
484 HD3 ARG 67 HD1 ARG 67 -0.239 8.662 -10.350
485 HE ARG 67 HE ARG 67 -1.374 7.414 -12.590
486 HH11 ARG 67 HH11 ARG 67 0.772 10.232 -11.965
487 HH12 ARG 67 HH12 ARG 67 1.568 10.059 -13.452
488 HH21 ARG 67 HH21 ARG 67 -0.266 7.301 -14.660
489 HH22 ARG 67 HH22 ARG 67 0.971 8.405 -15.002
490 H VAL 68 HN VAL 68 -2.529 4.149 -7.504
491 HA VAL 68 HA VAL 68 -1.699 2.064 -9.266
492 HB VAL 68 HB VAL 68 -1.083 0.730 -7.292
493 HG11 VAL 68 HG11 VAL 68 0.720 2.194 -6.485
494 HG12 VAL 68 HG12 VAL 68 -0.098 3.571 -7.232
495 HG13 VAL 68 HG13 VAL 68 0.516 2.262 -8.240
496 HG21 VAL 68 HG21 VAL 68 -2.111 3.076 -5.694
497 HG22 VAL 68 HG22 VAL 68 -1.141 1.757 -5.054
498 HG23 VAL 68 HG23 VAL 68 -2.766 1.436 -5.683
499 H ASP 69 HN ASP 69 -2.520 -0.138 -9.166
500 HA ASP 69 HA ASP 69 -5.463 -0.076 -8.835
501 HB2 ASP 69 HB2 ASP 69 -4.436 -0.316 -11.176
502 HB3 ASP 69 HB1 ASP 69 -3.844 -1.863 -10.614
503 H THR 70 HN THR 70 -2.566 -2.002 -8.783
504 HA THR 70 HA THR 70 -3.838 -3.900 -6.959
505 HB THR 70 HB THR 70 -2.259 -5.588 -7.889
506 HG1 THR 70 HG1 THR 70 -1.472 -3.353 -9.489
507 HG21 THR 70 HG21 THR 70 -4.490 -5.390 -8.891
508 HG22 THR 70 HG22 THR 70 -3.301 -5.776 -10.136
509 HG23 THR 70 HG23 THR 70 -3.895 -4.119 -9.956
510 HA PRO 71 HA PRO 71 -1.063 -2.787 -3.706
511 HB2 PRO 71 HB2 PRO 71 -0.633 -5.735 -3.490
512 HB3 PRO 71 HB1 PRO 71 -1.002 -4.562 -2.214
513 HG2 PRO 71 HG2 PRO 71 -2.914 -6.102 -3.126
514 HG3 PRO 71 HG1 PRO 71 -3.243 -4.367 -2.900
515 HD2 PRO 71 HD2 PRO 71 -2.677 -5.887 -5.414
516 HD3 PRO 71 HD1 PRO 71 -3.864 -4.599 -5.122
517 H ARG 72 HN ARG 72 0.154 -5.073 -6.147
518 HA ARG 72 HA ARG 72 2.837 -4.981 -5.270
519 HB2 ARG 72 HB2 ARG 72 3.520 -5.904 -7.417
520 HB3 ARG 72 HB1 ARG 72 2.101 -6.731 -6.815
521 HG2 ARG 72 HG2 ARG 72 0.710 -5.741 -8.450
522 HG3 ARG 72 HG1 ARG 72 1.925 -4.526 -8.857
523 HD2 ARG 72 HD2 ARG 72 1.908 -6.202 -10.601
524 HD3 ARG 72 HD1 ARG 72 3.398 -6.342 -9.680
525 HE ARG 72 HE ARG 72 1.120 -8.184 -9.640
526 HH11 ARG 72 HH11 ARG 72 4.533 -7.559 -8.729
527 HH12 ARG 72 HH12 ARG 72 4.807 -9.199 -8.324
528 HH21 ARG 72 HH21 ARG 72 1.585 -10.352 -9.117
529 HH22 ARG 72 HH22 ARG 72 3.125 -10.829 -8.563
530 H GLU 73 HN GLU 73 0.990 -2.769 -7.185
531 HA GLU 73 HA GLU 73 3.230 -1.375 -8.287
532 HB2 GLU 73 HB2 GLU 73 0.351 -0.552 -7.956
533 HB3 GLU 73 HB1 GLU 73 1.542 0.266 -8.960
534 HG2 GLU 73 HG2 GLU 73 1.700 -1.602 -10.417
535 HG3 GLU 73 HG1 GLU 73 0.706 -2.588 -9.344
536 H LEU 74 HN LEU 74 1.123 -1.026 -5.525
537 HA LEU 74 HA LEU 74 2.035 1.486 -4.565
538 HB2 LEU 74 HB2 LEU 74 -0.029 0.043 -3.853
539 HB3 LEU 74 HB1 LEU 74 1.181 -0.813 -2.892
540 HG LEU 74 HG LEU 74 -0.271 0.902 -1.632
541 HD11 LEU 74 HD11 LEU 74 2.704 1.252 -1.494
542 HD12 LEU 74 HD12 LEU 74 1.758 0.027 -0.651
543 HD13 LEU 74 HD13 LEU 74 1.543 1.731 -0.254
544 HD21 LEU 74 HD21 LEU 74 -0.250 2.663 -3.312
545 HD22 LEU 74 HD22 LEU 74 1.496 2.831 -3.132
546 HD23 LEU 74 HD23 LEU 74 0.426 3.241 -1.787
547 H LEU 75 HN LEU 75 2.843 -1.853 -3.908
548 HA LEU 75 HA LEU 75 4.814 -1.634 -1.985
549 HB2 LEU 75 HB2 LEU 75 3.581 -3.627 -2.685
550 HB3 LEU 75 HB1 LEU 75 4.414 -3.601 -4.221
551 HG LEU 75 HG LEU 75 6.500 -3.861 -2.987
552 HD11 LEU 75 HD11 LEU 75 4.608 -4.497 -0.722
553 HD12 LEU 75 HD12 LEU 75 5.750 -3.151 -0.787
554 HD13 LEU 75 HD13 LEU 75 6.342 -4.810 -0.696
555 HD21 LEU 75 HD21 LEU 75 6.183 -6.292 -2.700
556 HD22 LEU 75 HD22 LEU 75 5.426 -5.646 -4.172
557 HD23 LEU 75 HD23 LEU 75 4.434 -6.019 -2.766
558 H ASP 76 HN ASP 76 4.918 -1.552 -5.485
559 HA ASP 76 HA ASP 76 7.707 -1.533 -5.899
560 HB2 ASP 76 HB2 ASP 76 6.250 -2.111 -7.722
561 HB3 ASP 76 HB1 ASP 76 5.399 -0.580 -7.599
562 H LEU 77 HN LEU 77 5.331 0.985 -5.403
563 HA LEU 77 HA LEU 77 6.954 3.210 -5.961
564 HB2 LEU 77 HB2 LEU 77 4.635 2.929 -4.065
565 HB3 LEU 77 HB1 LEU 77 5.326 4.447 -4.578
566 HG LEU 77 HG LEU 77 3.973 2.443 -6.347
567 HD11 LEU 77 HD11 LEU 77 2.160 4.095 -6.490
568 HD12 LEU 77 HD12 LEU 77 3.011 5.113 -5.321
569 HD13 LEU 77 HD13 LEU 77 2.410 3.529 -4.840
570 HD21 LEU 77 HD21 LEU 77 4.069 4.212 -8.068
571 HD22 LEU 77 HD22 LEU 77 5.674 3.701 -7.548
572 HD23 LEU 77 HD23 LEU 77 4.996 5.214 -6.950
573 H ILE 78 HN ILE 78 6.209 1.538 -2.954
574 HA ILE 78 HA ILE 78 7.719 3.099 -1.209
575 HB ILE 78 HB ILE 78 7.110 0.135 -1.020
576 HG12 ILE 78 HG12 ILE 78 5.104 1.577 -1.119
577 HG13 ILE 78 HG11 ILE 78 5.281 0.812 0.458
578 HG21 ILE 78 HG21 ILE 78 7.566 0.358 1.397
579 HG22 ILE 78 HG22 ILE 78 8.079 2.029 1.134
580 HG23 ILE 78 HG23 ILE 78 8.991 0.707 0.420
581 HD11 ILE 78 HD11 ILE 78 6.016 3.649 -0.224
582 HD12 ILE 78 HD12 ILE 78 6.170 2.892 1.362
583 HD13 ILE 78 HD13 ILE 78 4.576 3.130 0.651
584 H ASN 79 HN ASN 79 8.569 -0.100 -2.532
585 HA ASN 79 HA ASN 79 11.215 0.006 -1.607
586 HB2 ASN 79 HB2 ASN 79 10.023 -1.750 -3.759
587 HB3 ASN 79 HB1 ASN 79 11.661 -1.932 -3.137
588 HD21 ASN 79 HD21 ASN 79 9.633 -3.903 -3.006
589 HD22 ASN 79 HD22 ASN 79 9.250 -4.188 -1.347
590 H GLY 80 HN GLY 80 9.814 1.198 -4.532
591 HA2 GLY 80 HA2 GLY 80 12.174 1.567 -6.025
592 HA3 GLY 80 HA1 GLY 80 10.696 2.514 -6.179
593 H ALA 81 HN ALA 81 10.431 3.775 -3.846
594 HA ALA 81 HA ALA 81 12.371 5.847 -4.004
595 HB1 ALA 81 HB1 ALA 81 10.040 6.291 -3.390
596 HB2 ALA 81 HB2 ALA 81 11.152 6.861 -2.139
597 HB3 ALA 81 HB3 ALA 81 10.258 5.366 -1.901
598 H LEU 82 HN LEU 82 11.902 3.094 -1.884
599 HA LEU 82 HA LEU 82 13.728 3.751 0.123
600 HB2 LEU 82 HB2 LEU 82 12.013 2.051 0.353
601 HB3 LEU 82 HB1 LEU 82 12.732 1.115 -0.944
602 HG LEU 82 HG LEU 82 14.710 0.806 0.417
603 HD11 LEU 82 HD11 LEU 82 14.603 1.256 2.852
604 HD12 LEU 82 HD12 LEU 82 13.052 2.065 2.611
605 HD13 LEU 82 HD13 LEU 82 14.519 2.740 1.896
606 HD21 LEU 82 HD21 LEU 82 13.722 -0.862 1.945
607 HD22 LEU 82 HD22 LEU 82 13.012 -0.921 0.332
608 HD23 LEU 82 HD23 LEU 82 12.136 -0.153 1.659
609 H ALA 83 HN ALA 83 14.036 1.968 -2.931
610 HA ALA 83 HA ALA 83 16.733 1.299 -2.568
611 HB1 ALA 83 HB1 ALA 83 16.727 0.682 -4.934
612 HB2 ALA 83 HB2 ALA 83 15.164 1.487 -5.148
613 HB3 ALA 83 HB3 ALA 83 15.302 0.074 -4.103
614 H GLU 84 HN GLU 84 15.203 4.280 -3.549
615 HA GLU 84 HA GLU 84 17.500 5.367 -4.809
616 HB2 GLU 84 HB2 GLU 84 14.957 6.602 -3.751
617 HB3 GLU 84 HB1 GLU 84 16.216 7.495 -4.590
618 HG2 GLU 84 HG2 GLU 84 15.872 6.052 -6.569
619 HG3 GLU 84 HG1 GLU 84 14.570 5.239 -5.707
620 H ALA 85 HN ALA 85 16.254 5.119 -1.575
621 HA ALA 85 HA ALA 85 18.125 7.033 -0.470
622 HB1 ALA 85 HB1 ALA 85 17.296 6.251 1.708
623 HB2 ALA 85 HB2 ALA 85 16.400 4.959 0.904
624 HB3 ALA 85 HB3 ALA 85 15.953 6.646 0.636
625 H ALA 86 HN ALA 86 17.834 3.640 -1.013
626 HA ALA 86 HA ALA 86 19.269 1.953 -1.213
627 HB1 ALA 86 HB1 ALA 86 21.423 4.063 -1.053
628 HB2 ALA 86 HB2 ALA 86 20.645 3.482 -2.533
629 HB3 ALA 86 HB3 ALA 86 21.645 2.396 -1.570
630 H28A SDO 101 H28A SDO 42 -11.302 10.696 -2.952
631 H28B SDO 101 H28B SDO 42 -9.742 10.022 -2.476
632 H30A SDO 101 H30A SDO 42 -10.634 12.810 -1.888
633 H30B SDO 101 H30B SDO 42 -9.142 13.636 -2.343
634 H30C SDO 101 H30C SDO 42 -9.078 12.108 -1.450
635 H31A SDO 101 H31A SDO 42 -7.616 11.146 -3.172
636 H31B SDO 101 H31B SDO 42 -7.673 12.613 -4.150
637 H31C SDO 101 H31C SDO 42 -8.141 11.065 -4.854
638 H32A SDO 101 H32A SDO 42 -10.379 12.126 -5.555
639 H33A SDO 101 H33A SDO 42 -9.800 14.590 -4.317
640 H36A SDO 101 H36A SDO 42 -11.569 14.692 -5.484
641 H37A SDO 101 H37A SDO 42 -14.000 14.852 -5.689
642 H37B SDO 101 H37B SDO 42 -14.123 14.164 -4.064
643 H38A SDO 101 H38A SDO 42 -12.845 16.839 -4.738
644 H38B SDO 101 H38B SDO 42 -14.506 16.633 -4.267
645 H41A SDO 101 H41A SDO 42 -13.245 14.321 -2.524
646 H42A SDO 101 H42A SDO 42 -11.646 15.117 -0.550
647 H42B SDO 101 H42B SDO 42 -13.241 15.697 -0.022
648 H43A SDO 101 H43A SDO 42 -12.591 12.922 -0.932
649 H43B SDO 101 H43B SDO 42 -14.080 13.406 -0.125
650 H1A SDO 101 H1A SDO 42 -11.748 14.282 3.327
651 H1B SDO 101 H1B SDO 42 -10.343 13.702 2.469
652 H2A SDO 101 H2A SDO 42 -12.059 15.998 1.619
653 H2B SDO 101 H2B SDO 42 -10.616 15.436 0.816
654 H4A SDO 101 H4A SDO 42 -9.830 17.142 4.648
655 H4B SDO 101 H4B SDO 42 -8.421 16.542 3.825
656 H5A SDO 101 H5A SDO 42 -9.228 14.252 4.027
657 H5B SDO 101 H5B SDO 42 -10.632 14.843 4.920
658 H6A SDO 101 H6A SDO 42 -9.151 15.806 6.608
659 H6B SDO 101 H6B SDO 42 -7.754 15.213 5.734
660 H8A SDO 101 H8A SDO 42 -9.517 12.467 5.123
661 H8B SDO 101 H8B SDO 42 -10.740 12.751 6.370
662 H8C SDO 101 H8C SDO 42 -9.404 11.628 6.676
Start of MODEL 2
1 H1 MET 1 HT1 MET 1 21.444 -4.189 1.897
2 H2 MET 1 HT2 MET 1 20.882 -5.046 3.248
3 H3 MET 1 HT3 MET 1 22.526 -4.779 3.059
4 HA MET 1 HA MET 1 21.540 -3.332 4.715
5 HB2 MET 1 HB2 MET 1 22.399 -1.881 2.193
6 HB3 MET 1 HB1 MET 1 22.219 -1.111 3.759
7 HG2 MET 1 HG2 MET 1 24.521 -1.489 3.428
8 HG3 MET 1 HG1 MET 1 23.987 -2.695 4.598
9 HE1 MET 1 HE1 MET 1 23.524 -2.635 0.679
10 HE2 MET 1 HE2 MET 1 24.935 -3.556 0.155
11 HE3 MET 1 HE3 MET 1 25.147 -1.980 0.913
12 H ALA 2 HN ALA 2 19.459 -4.066 2.245
13 HA ALA 2 HA ALA 2 17.926 -1.610 2.502
14 HB1 ALA 2 HB1 ALA 2 18.394 -2.416 0.254
15 HB2 ALA 2 HB2 ALA 2 16.663 -2.421 0.604
16 HB3 ALA 2 HB3 ALA 2 17.575 -3.931 0.627
17 H THR 3 HN THR 3 16.443 -1.566 4.014
18 HA THR 3 HA THR 3 15.202 -3.951 5.043
19 HB THR 3 HB THR 3 13.897 -2.201 6.368
20 HG1 THR 3 HG1 THR 3 14.148 -0.545 4.868
21 HG21 THR 3 HG21 THR 3 16.924 -2.059 6.484
22 HG22 THR 3 HG22 THR 3 15.907 -3.255 7.293
23 HG23 THR 3 HG23 THR 3 15.822 -1.557 7.766
24 H LEU 4 HN LEU 4 14.385 -4.546 2.943
25 HA LEU 4 HA LEU 4 12.659 -2.727 1.483
26 HB2 LEU 4 HB2 LEU 4 14.520 -4.366 0.640
27 HB3 LEU 4 HB1 LEU 4 13.237 -5.556 0.708
28 HG LEU 4 HG LEU 4 11.933 -4.056 -0.813
29 HD11 LEU 4 HD11 LEU 4 14.620 -2.681 -1.038
30 HD12 LEU 4 HD12 LEU 4 13.144 -1.982 -0.367
31 HD13 LEU 4 HD13 LEU 4 13.232 -2.380 -2.080
32 HD21 LEU 4 HD21 LEU 4 14.578 -5.121 -1.818
33 HD22 LEU 4 HD22 LEU 4 13.182 -4.743 -2.814
34 HD23 LEU 4 HD23 LEU 4 13.088 -6.047 -1.617
35 H LEU 5 HN LEU 5 10.466 -3.160 1.048
36 HA LEU 5 HA LEU 5 9.145 -4.859 2.969
37 HB2 LEU 5 HB2 LEU 5 8.182 -2.892 0.940
38 HB3 LEU 5 HB1 LEU 5 7.072 -4.021 1.672
39 HG LEU 5 HG LEU 5 8.702 -1.976 3.178
40 HD11 LEU 5 HD11 LEU 5 5.764 -2.093 2.493
41 HD12 LEU 5 HD12 LEU 5 6.937 -1.024 1.731
42 HD13 LEU 5 HD13 LEU 5 6.560 -0.839 3.447
43 HD21 LEU 5 HD21 LEU 5 8.212 -3.990 4.474
44 HD22 LEU 5 HD22 LEU 5 6.504 -3.842 4.051
45 HD23 LEU 5 HD23 LEU 5 7.278 -2.610 5.048
46 H THR 6 HN THR 6 8.424 -6.791 2.614
47 HA THR 6 HA THR 6 8.409 -7.802 -0.109
48 HB THR 6 HB THR 6 8.033 -10.027 1.158
49 HG1 THR 6 HG1 THR 6 9.189 -8.558 3.304
50 HG21 THR 6 HG21 THR 6 10.164 -9.437 0.078
51 HG22 THR 6 HG22 THR 6 10.452 -10.264 1.608
52 HG23 THR 6 HG23 THR 6 10.633 -8.515 1.507
53 H THR 7 HN THR 7 6.506 -9.594 -0.268
54 HA THR 7 HA THR 7 4.146 -8.044 -0.175
55 HB THR 7 HB THR 7 4.411 -11.028 -0.689
56 HG1 THR 7 HG1 THR 7 4.884 -10.438 -2.801
57 HG21 THR 7 HG21 THR 7 2.405 -10.683 -2.100
58 HG22 THR 7 HG22 THR 7 2.395 -8.977 -1.672
59 HG23 THR 7 HG23 THR 7 2.070 -10.197 -0.435
60 H ASP 8 HN ASP 8 5.495 -10.564 1.890
61 HA ASP 8 HA ASP 8 3.250 -10.986 3.569
62 HB2 ASP 8 HB2 ASP 8 6.196 -11.389 3.943
63 HB3 ASP 8 HB1 ASP 8 5.126 -11.493 5.333
64 H ASP 9 HN ASP 9 5.966 -8.746 3.794
65 HA ASP 9 HA ASP 9 5.082 -7.712 6.324
66 HB2 ASP 9 HB2 ASP 9 7.491 -7.677 5.220
67 HB3 ASP 9 HB1 ASP 9 6.936 -6.117 4.601
68 H LEU 10 HN LEU 10 4.741 -6.726 2.962
69 HA LEU 10 HA LEU 10 3.423 -4.278 3.451
70 HB2 LEU 10 HB2 LEU 10 4.251 -4.910 1.216
71 HB3 LEU 10 HB1 LEU 10 3.051 -6.187 1.139
72 HG LEU 10 HG LEU 10 1.288 -4.402 1.341
73 HD11 LEU 10 HD11 LEU 10 2.640 -2.637 2.270
74 HD12 LEU 10 HD12 LEU 10 1.885 -2.120 0.758
75 HD13 LEU 10 HD13 LEU 10 3.592 -2.557 0.786
76 HD21 LEU 10 HD21 LEU 10 1.803 -5.468 -0.790
77 HD22 LEU 10 HD22 LEU 10 3.090 -4.290 -1.082
78 HD23 LEU 10 HD23 LEU 10 1.407 -3.766 -1.025
79 H ARG 11 HN ARG 11 2.286 -7.601 3.162
80 HA ARG 11 HA ARG 11 -0.450 -7.185 3.312
81 HB2 ARG 11 HB2 ARG 11 0.643 -9.373 2.872
82 HB3 ARG 11 HB1 ARG 11 1.127 -9.441 4.554
83 HG2 ARG 11 HG2 ARG 11 -1.178 -9.562 5.270
84 HG3 ARG 11 HG1 ARG 11 -1.732 -9.369 3.611
85 HD2 ARG 11 HD2 ARG 11 -1.828 -11.708 4.272
86 HD3 ARG 11 HD1 ARG 11 -0.617 -11.473 3.008
87 HE ARG 11 HE ARG 11 0.435 -11.313 5.657
88 HH11 ARG 11 HH11 ARG 11 -0.385 -13.566 3.010
89 HH12 ARG 11 HH12 ARG 11 0.623 -14.812 3.547
90 HH21 ARG 11 HH21 ARG 11 1.874 -13.038 6.401
91 HH22 ARG 11 HH22 ARG 11 1.982 -14.478 5.487
92 H ARG 12 HN ARG 12 1.912 -7.656 5.867
93 HA ARG 12 HA ARG 12 0.369 -7.387 8.151
94 HB2 ARG 12 HB2 ARG 12 3.131 -6.318 7.605
95 HB3 ARG 12 HB1 ARG 12 2.381 -6.307 9.184
96 HG2 ARG 12 HG2 ARG 12 2.351 -8.698 9.248
97 HG3 ARG 12 HG1 ARG 12 2.922 -8.782 7.577
98 HD2 ARG 12 HD2 ARG 12 4.685 -9.139 9.347
99 HD3 ARG 12 HD1 ARG 12 5.037 -7.895 8.147
100 HE ARG 12 HE ARG 12 4.542 -6.225 9.777
101 HH11 ARG 12 HH11 ARG 12 4.809 -9.493 11.095
102 HH12 ARG 12 HH12 ARG 12 5.238 -8.994 12.670
103 HH21 ARG 12 HH21 ARG 12 5.141 -5.501 12.019
104 HH22 ARG 12 HH22 ARG 12 5.348 -6.676 13.197
105 H ALA 13 HN ALA 13 1.907 -4.810 6.281
106 HA ALA 13 HA ALA 13 0.939 -2.643 7.818
107 HB1 ALA 13 HB1 ALA 13 2.862 -2.414 6.329
108 HB2 ALA 13 HB2 ALA 13 1.604 -1.240 5.920
109 HB3 ALA 13 HB3 ALA 13 1.817 -2.679 4.934
110 H LEU 14 HN LEU 14 -0.287 -4.202 4.892
111 HA LEU 14 HA LEU 14 -2.384 -2.366 4.566
112 HB2 LEU 14 HB2 LEU 14 -1.309 -3.905 2.841
113 HB3 LEU 14 HB1 LEU 14 -2.295 -5.180 3.509
114 HG LEU 14 HG LEU 14 -4.330 -3.945 2.883
115 HD11 LEU 14 HD11 LEU 14 -3.413 -1.676 2.999
116 HD12 LEU 14 HD12 LEU 14 -4.147 -1.980 1.425
117 HD13 LEU 14 HD13 LEU 14 -2.394 -2.011 1.601
118 HD21 LEU 14 HD21 LEU 14 -3.371 -5.586 1.349
119 HD22 LEU 14 HD22 LEU 14 -2.359 -4.334 0.637
120 HD23 LEU 14 HD23 LEU 14 -4.113 -4.252 0.466
121 H VAL 15 HN VAL 15 -2.005 -5.098 6.644
122 HA VAL 15 HA VAL 15 -4.813 -5.439 7.225
123 HB VAL 15 HB VAL 15 -2.389 -6.238 8.862
124 HG11 VAL 15 HG11 VAL 15 -3.904 -7.789 10.054
125 HG12 VAL 15 HG12 VAL 15 -5.271 -7.118 9.156
126 HG13 VAL 15 HG13 VAL 15 -4.374 -6.102 10.282
127 HG21 VAL 15 HG21 VAL 15 -4.105 -7.866 7.000
128 HG22 VAL 15 HG22 VAL 15 -2.817 -8.507 8.031
129 HG23 VAL 15 HG23 VAL 15 -2.428 -7.369 6.744
130 H GLU 16 HN GLU 16 -2.188 -3.520 8.450
131 HA GLU 16 HA GLU 16 -3.138 -2.637 10.916
132 HB2 GLU 16 HB2 GLU 16 -1.429 -1.204 8.884
133 HB3 GLU 16 HB1 GLU 16 -1.626 -0.708 10.557
134 HG2 GLU 16 HG2 GLU 16 -0.676 -3.447 9.876
135 HG3 GLU 16 HG1 GLU 16 0.452 -2.098 9.883
136 H SER 17 HN SER 17 -3.644 -1.290 7.694
137 HA SER 17 HA SER 17 -5.318 0.822 8.745
138 HB2 SER 17 HB2 SER 17 -4.688 0.085 5.880
139 HB3 SER 17 HB1 SER 17 -5.384 1.605 6.444
140 HG SER 17 HG SER 17 -3.495 2.142 7.402
141 H ALA 18 HN ALA 18 -5.732 -2.395 7.822
142 HA ALA 18 HA ALA 18 -8.337 -2.162 6.623
143 HB1 ALA 18 HB1 ALA 18 -8.335 -4.599 6.552
144 HB2 ALA 18 HB2 ALA 18 -6.881 -4.635 7.558
145 HB3 ALA 18 HB3 ALA 18 -6.812 -3.954 5.934
146 H GLY 19 HN GLY 19 -7.352 -1.782 9.642
147 HA2 GLY 19 HA2 GLY 19 -9.115 -3.235 11.269
148 HA3 GLY 19 HA1 GLY 19 -8.435 -1.667 11.682
149 H GLU 20 HN GLU 20 -9.588 -0.326 9.355
150 HA GLU 20 HA GLU 20 -12.402 -0.723 9.636
151 HB2 GLU 20 HB2 GLU 20 -11.909 0.784 11.528
152 HB3 GLU 20 HB1 GLU 20 -11.205 1.941 10.408
153 HG2 GLU 20 HG2 GLU 20 -13.358 2.215 9.320
154 HG3 GLU 20 HG1 GLU 20 -14.074 1.045 10.427
155 H THR 21 HN THR 21 -12.013 -1.363 7.515
156 HA THR 21 HA THR 21 -12.873 0.560 5.690
157 HB THR 21 HB THR 21 -10.441 1.123 5.597
158 HG1 THR 21 HG1 THR 21 -11.467 -0.175 3.291
159 HG21 THR 21 HG21 THR 21 -8.816 -0.476 4.676
160 HG22 THR 21 HG22 THR 21 -10.068 -1.722 4.645
161 HG23 THR 21 HG23 THR 21 -9.513 -1.065 6.182
162 H ASP 22 HN ASP 22 -13.788 -1.715 6.834
163 HA ASP 22 HA ASP 22 -14.889 -3.588 6.517
164 HB2 ASP 22 HB2 ASP 22 -15.537 -2.726 4.291
165 HB3 ASP 22 HB1 ASP 22 -14.150 -3.548 3.581
166 H GLY 23 HN GLY 23 -14.388 -5.434 7.226
167 HA2 GLY 23 HA2 GLY 23 -11.635 -6.079 7.155
168 HA3 GLY 23 HA1 GLY 23 -12.832 -6.940 8.128
169 H THR 24 HN THR 24 -11.285 -6.632 5.045
170 HA THR 24 HA THR 24 -12.500 -9.015 3.954
171 HB THR 24 HB THR 24 -10.981 -8.450 2.000
172 HG1 THR 24 HG1 THR 24 -10.523 -5.877 2.886
173 HG21 THR 24 HG21 THR 24 -12.276 -6.468 1.332
174 HG22 THR 24 HG22 THR 24 -12.820 -6.254 2.996
175 HG23 THR 24 HG23 THR 24 -13.313 -7.681 2.082
176 H ASP 25 HN ASP 25 -10.316 -10.124 2.554
177 HA ASP 25 HA ASP 25 -8.479 -10.904 4.677
178 HB2 ASP 25 HB2 ASP 25 -10.033 -12.762 4.462
179 HB3 ASP 25 HB1 ASP 25 -9.789 -12.809 2.711
180 H LEU 26 HN LEU 26 -6.450 -11.326 4.122
181 HA LEU 26 HA LEU 26 -5.631 -10.587 1.392
182 HB2 LEU 26 HB2 LEU 26 -4.341 -9.920 4.043
183 HB3 LEU 26 HB1 LEU 26 -3.527 -9.736 2.513
184 HG LEU 26 HG LEU 26 -5.246 -7.996 1.894
185 HD11 LEU 26 HD11 LEU 26 -7.053 -8.651 3.407
186 HD12 LEU 26 HD12 LEU 26 -6.563 -6.973 3.672
187 HD13 LEU 26 HD13 LEU 26 -6.042 -8.234 4.791
188 HD21 LEU 26 HD21 LEU 26 -4.268 -6.282 3.312
189 HD22 LEU 26 HD22 LEU 26 -3.054 -7.418 2.724
190 HD23 LEU 26 HD23 LEU 26 -3.642 -7.532 4.385
191 H SER 27 HN SER 27 -6.060 -13.241 3.079
192 HA SER 27 HA SER 27 -3.330 -14.140 3.161
193 HB2 SER 27 HB2 SER 27 -5.779 -15.602 4.165
194 HB3 SER 27 HB1 SER 27 -4.094 -15.894 4.606
195 HG SER 27 HG SER 27 -5.878 -13.974 5.414
196 H GLY 28 HN GLY 28 -6.143 -14.472 1.500
197 HA2 GLY 28 HA2 GLY 28 -5.333 -16.846 -0.036
198 HA3 GLY 28 HA1 GLY 28 -6.783 -15.895 -0.341
199 H ASP 29 HN ASP 29 -4.118 -14.024 0.052
200 HA ASP 29 HA ASP 29 -2.778 -12.816 -1.099
201 HB2 ASP 29 HB2 ASP 29 -3.204 -14.792 -3.265
202 HB3 ASP 29 HB1 ASP 29 -2.540 -13.213 -3.692
203 H PHE 30 HN PHE 30 -2.927 -10.990 -1.420
204 HA PHE 30 HA PHE 30 -5.348 -9.835 -2.609
205 HB2 PHE 30 HB2 PHE 30 -4.716 -7.844 -1.287
206 HB3 PHE 30 HB1 PHE 30 -4.871 -9.257 -0.246
207 HD1 PHE 30 HD2 PHE 30 -2.759 -10.448 0.477
208 HD2 PHE 30 HD1 PHE 30 -2.671 -6.606 -1.373
209 HE1 PHE 30 HE2 PHE 30 -0.503 -10.057 1.376
210 HE2 PHE 30 HE1 PHE 30 -0.442 -6.223 -0.474
211 HZ PHE 30 HZ PHE 30 0.708 -7.954 0.768
212 H LEU 31 HN LEU 31 -2.328 -10.702 -3.373
213 HA LEU 31 HA LEU 31 -1.159 -8.287 -4.394
214 HB2 LEU 31 HB2 LEU 31 0.102 -10.209 -3.440
215 HB3 LEU 31 HB1 LEU 31 -0.389 -11.163 -4.822
216 HG LEU 31 HG LEU 31 0.854 -9.609 -6.294
217 HD11 LEU 31 HD11 LEU 31 0.795 -7.624 -4.881
218 HD12 LEU 31 HD12 LEU 31 2.453 -8.059 -5.295
219 HD13 LEU 31 HD13 LEU 31 1.815 -8.433 -3.695
220 HD21 LEU 31 HD21 LEU 31 1.846 -11.697 -5.502
221 HD22 LEU 31 HD22 LEU 31 2.472 -10.859 -4.079
222 HD23 LEU 31 HD23 LEU 31 3.061 -10.435 -5.681
223 H ASP 32 HN ASP 32 -2.991 -10.971 -5.595
224 HA ASP 32 HA ASP 32 -2.812 -10.155 -8.402
225 HB2 ASP 32 HB2 ASP 32 -3.818 -12.368 -8.774
226 HB3 ASP 32 HB1 ASP 32 -2.362 -12.523 -7.792
227 H LEU 33 HN LEU 33 -4.301 -8.874 -6.133
228 HA LEU 33 HA LEU 33 -7.056 -9.164 -7.080
229 HB2 LEU 33 HB2 LEU 33 -6.408 -10.223 -4.841
230 HB3 LEU 33 HB1 LEU 33 -6.143 -8.597 -4.264
231 HG LEU 33 HG LEU 33 -8.530 -8.100 -4.613
232 HD11 LEU 33 HD11 LEU 33 -10.071 -9.953 -5.091
233 HD12 LEU 33 HD12 LEU 33 -8.697 -11.039 -5.319
234 HD13 LEU 33 HD13 LEU 33 -8.957 -9.695 -6.435
235 HD21 LEU 33 HD21 LEU 33 -7.905 -10.538 -2.957
236 HD22 LEU 33 HD22 LEU 33 -9.336 -9.520 -2.785
237 HD23 LEU 33 HD23 LEU 33 -7.735 -8.851 -2.459
238 H ARG 34 HN ARG 34 -8.239 -6.997 -6.005
239 HA ARG 34 HA ARG 34 -6.488 -4.754 -6.770
240 HB2 ARG 34 HB2 ARG 34 -9.463 -4.980 -7.292
241 HB3 ARG 34 HB1 ARG 34 -8.428 -3.649 -7.781
242 HG2 ARG 34 HG2 ARG 34 -7.224 -5.181 -9.299
243 HG3 ARG 34 HG1 ARG 34 -8.312 -6.482 -8.819
244 HD2 ARG 34 HD2 ARG 34 -9.109 -5.600 -10.894
245 HD3 ARG 34 HD1 ARG 34 -10.224 -5.083 -9.634
246 HE ARG 34 HE ARG 34 -8.073 -3.258 -10.347
247 HH11 ARG 34 HH11 ARG 34 -11.528 -4.054 -10.825
248 HH12 ARG 34 HH12 ARG 34 -11.915 -2.470 -11.317
249 HH21 ARG 34 HH21 ARG 34 -8.643 -1.188 -11.103
250 HH22 ARG 34 HH22 ARG 34 -10.263 -0.809 -11.522
251 H PHE 35 HN PHE 35 -7.060 -2.722 -5.712
252 HA PHE 35 HA PHE 35 -7.455 -3.055 -2.964
253 HB2 PHE 35 HB2 PHE 35 -7.533 -0.518 -4.597
254 HB3 PHE 35 HB1 PHE 35 -7.674 -0.549 -2.846
255 HD1 PHE 35 HD2 PHE 35 -5.803 -1.438 -1.478
256 HD2 PHE 35 HD1 PHE 35 -5.416 -0.706 -5.647
257 HE1 PHE 35 HE2 PHE 35 -3.361 -1.464 -1.250
258 HE2 PHE 35 HE1 PHE 35 -2.977 -0.732 -5.428
259 HZ PHE 35 HZ PHE 35 -1.939 -1.114 -3.228
260 H GLU 36 HN GLU 36 -9.829 -2.521 -5.399
261 HA GLU 36 HA GLU 36 -11.809 -1.595 -3.580
262 HB2 GLU 36 HB2 GLU 36 -13.387 -1.889 -5.438
263 HB3 GLU 36 HB1 GLU 36 -11.974 -0.940 -5.873
264 HG2 GLU 36 HG2 GLU 36 -11.006 -2.872 -6.988
265 HG3 GLU 36 HG1 GLU 36 -12.429 -3.827 -6.545
266 H ASP 37 HN ASP 37 -10.661 -4.740 -4.424
267 HA ASP 37 HA ASP 37 -13.050 -6.113 -3.585
268 HB2 ASP 37 HB2 ASP 37 -11.384 -7.179 -5.111
269 HB3 ASP 37 HB1 ASP 37 -10.233 -7.211 -3.777
270 H ILE 38 HN ILE 38 -10.015 -5.114 -2.231
271 HA ILE 38 HA ILE 38 -10.581 -6.403 0.266
272 HB ILE 38 HB ILE 38 -8.392 -5.486 1.038
273 HG12 ILE 38 HG12 ILE 38 -8.244 -4.427 -1.796
274 HG13 ILE 38 HG11 ILE 38 -8.333 -3.455 -0.335
275 HG21 ILE 38 HG21 ILE 38 -8.572 -7.698 -0.025
276 HG22 ILE 38 HG22 ILE 38 -7.029 -6.907 -0.346
277 HG23 ILE 38 HG23 ILE 38 -8.271 -6.939 -1.605
278 HD11 ILE 38 HD11 ILE 38 -6.069 -3.526 -1.226
279 HD12 ILE 38 HD12 ILE 38 -6.074 -5.290 -1.092
280 HD13 ILE 38 HD13 ILE 38 -6.152 -4.297 0.362
281 H GLY 39 HN GLY 39 -12.102 -4.048 -0.828
282 HA2 GLY 39 HA2 GLY 39 -13.504 -2.537 0.155
283 HA3 GLY 39 HA1 GLY 39 -12.862 -3.027 1.702
284 H TYR 40 HN TYR 40 -10.407 -1.942 -0.357
285 HA TYR 40 HA TYR 40 -10.021 0.234 1.394
286 HB2 TYR 40 HB2 TYR 40 -8.360 -0.985 -0.702
287 HB3 TYR 40 HB1 TYR 40 -8.056 0.718 -0.350
288 HD1 TYR 40 HD2 TYR 40 -8.162 -2.663 1.127
289 HD2 TYR 40 HD1 TYR 40 -7.127 1.416 1.664
290 HE1 TYR 40 HE2 TYR 40 -6.991 -3.252 3.177
291 HE2 TYR 40 HE1 TYR 40 -5.954 0.860 3.740
292 HH TYR 40 HH TYR 40 -5.319 -2.348 4.718
293 H ASP 41 HN ASP 41 -10.480 2.102 1.408
294 HA ASP 41 HA ASP 41 -12.039 3.391 -0.628
295 HB2 ASP 41 HB2 ASP 41 -12.273 3.746 1.929
296 HB3 ASP 41 HB1 ASP 41 -10.737 4.593 1.784
297 H SER 42 HN SER 42 -11.314 5.752 -0.933
298 HA SER 42 HA SER 42 -8.974 5.714 -2.580
299 HB2 SER 42 HB2 SER 42 -11.017 6.710 -3.397
300 HB3 SER 42 HB1 SER 42 -11.160 7.715 -1.963
301 H LEU 43 HN LEU 43 -10.142 7.463 0.302
302 HA LEU 43 HA LEU 43 -7.712 8.895 0.772
303 HB2 LEU 43 HB2 LEU 43 -10.065 8.299 2.577
304 HB3 LEU 43 HB1 LEU 43 -8.731 9.346 3.011
305 HG LEU 43 HG LEU 43 -10.659 9.856 0.745
306 HD11 LEU 43 HD11 LEU 43 -11.565 11.605 2.197
307 HD12 LEU 43 HD12 LEU 43 -10.488 11.080 3.492
308 HD13 LEU 43 HD13 LEU 43 -11.754 10.001 2.912
309 HD21 LEU 43 HD21 LEU 43 -8.510 11.551 1.986
310 HD22 LEU 43 HD22 LEU 43 -9.653 12.098 0.749
311 HD23 LEU 43 HD23 LEU 43 -8.470 10.840 0.374
312 H ALA 44 HN ALA 44 -8.999 5.839 1.620
313 HA ALA 44 HA ALA 44 -7.391 5.235 3.851
314 HB1 ALA 44 HB1 ALA 44 -8.621 3.291 1.905
315 HB2 ALA 44 HB2 ALA 44 -9.438 3.986 3.308
316 HB3 ALA 44 HB3 ALA 44 -8.050 2.926 3.530
317 H LEU 45 HN LEU 45 -6.791 4.979 0.395
318 HA LEU 45 HA LEU 45 -4.444 3.381 0.718
319 HB2 LEU 45 HB2 LEU 45 -5.803 3.453 -1.333
320 HB3 LEU 45 HB1 LEU 45 -5.261 5.092 -1.613
321 HG LEU 45 HG LEU 45 -3.244 4.384 -2.520
322 HD11 LEU 45 HD11 LEU 45 -3.365 1.913 -0.752
323 HD12 LEU 45 HD12 LEU 45 -2.450 3.373 -0.354
324 HD13 LEU 45 HD13 LEU 45 -2.018 2.423 -1.776
325 HD21 LEU 45 HD21 LEU 45 -3.519 2.312 -3.656
326 HD22 LEU 45 HD22 LEU 45 -5.110 3.152 -3.587
327 HD23 LEU 45 HD23 LEU 45 -4.684 1.877 -2.408
328 H MET 46 HN MET 46 -5.142 6.797 0.697
329 HA MET 46 HA MET 46 -2.487 7.851 0.538
330 HB2 MET 46 HB2 MET 46 -4.646 8.926 2.350
331 HB3 MET 46 HB1 MET 46 -3.355 9.839 1.573
332 HG2 MET 46 HG2 MET 46 -4.518 9.272 -0.580
333 HG3 MET 46 HG1 MET 46 -5.775 8.612 0.469
334 HE1 MET 46 HE1 MET 46 -3.648 11.747 1.434
335 HE2 MET 46 HE2 MET 46 -4.599 13.069 0.747
336 HE3 MET 46 HE3 MET 46 -3.777 11.924 -0.311
337 H GLU 47 HN GLU 47 -4.634 7.005 3.091
338 HA GLU 47 HA GLU 47 -3.055 7.320 5.314
339 HB2 GLU 47 HB2 GLU 47 -5.430 5.983 4.450
340 HB3 GLU 47 HB1 GLU 47 -4.932 5.500 6.095
341 HG2 GLU 47 HG2 GLU 47 -4.941 8.112 6.406
342 HG3 GLU 47 HG1 GLU 47 -5.882 8.099 4.909
343 H THR 48 HN THR 48 -3.449 4.475 3.229
344 HA THR 48 HA THR 48 -1.896 2.600 4.646
345 HB THR 48 HB THR 48 -2.237 2.941 1.648
346 HG1 THR 48 HG1 THR 48 -4.153 2.549 3.270
347 HG21 THR 48 HG21 THR 48 -1.792 0.562 1.477
348 HG22 THR 48 HG22 THR 48 -1.490 0.450 3.224
349 HG23 THR 48 HG23 THR 48 -0.415 1.387 2.198
350 H ALA 49 HN ALA 49 -1.074 4.700 1.910
351 HA ALA 49 HA ALA 49 1.644 4.125 1.697
352 HB1 ALA 49 HB1 ALA 49 1.812 6.163 0.357
353 HB2 ALA 49 HB2 ALA 49 0.242 6.692 0.959
354 HB3 ALA 49 HB3 ALA 49 0.357 5.253 -0.052
355 H ALA 50 HN ALA 50 0.027 6.752 3.444
356 HA ALA 50 HA ALA 50 2.269 8.089 4.388
357 HB1 ALA 50 HB1 ALA 50 0.799 9.035 6.093
358 HB2 ALA 50 HB2 ALA 50 -0.395 7.781 5.758
359 HB3 ALA 50 HB3 ALA 50 -0.011 8.981 4.525
360 H ARG 51 HN ARG 51 0.592 5.296 5.722
361 HA ARG 51 HA ARG 51 1.912 5.141 8.181
362 HB2 ARG 51 HB2 ARG 51 -0.126 3.854 7.746
363 HB3 ARG 51 HB1 ARG 51 0.662 2.961 6.464
364 HG2 ARG 51 HG2 ARG 51 0.738 1.382 8.066
365 HG3 ARG 51 HG1 ARG 51 2.233 2.211 8.461
366 HD2 ARG 51 HD2 ARG 51 0.870 1.662 10.395
367 HD3 ARG 51 HD1 ARG 51 1.112 3.398 10.329
368 HE ARG 51 HE ARG 51 -1.208 3.258 9.121
369 HH11 ARG 51 HH11 ARG 51 -0.247 1.261 11.925
370 HH12 ARG 51 HH12 ARG 51 -1.846 1.069 12.469
371 HH21 ARG 51 HH21 ARG 51 -3.344 2.986 9.897
372 HH22 ARG 51 HH22 ARG 51 -3.638 2.075 11.328
373 H LEU 52 HN LEU 52 2.701 4.003 4.992
374 HA LEU 52 HA LEU 52 4.985 2.502 5.848
375 HB2 LEU 52 HB2 LEU 52 4.004 3.270 3.106
376 HB3 LEU 52 HB1 LEU 52 5.384 2.228 3.404
377 HG LEU 52 HG LEU 52 2.534 1.614 4.222
378 HD11 LEU 52 HD11 LEU 52 2.818 1.499 1.828
379 HD12 LEU 52 HD12 LEU 52 2.650 -0.120 2.521
380 HD13 LEU 52 HD13 LEU 52 4.237 0.470 2.028
381 HD21 LEU 52 HD21 LEU 52 4.155 0.675 5.765
382 HD22 LEU 52 HD22 LEU 52 5.063 -0.021 4.420
383 HD23 LEU 52 HD23 LEU 52 3.436 -0.604 4.782
384 H GLU 53 HN GLU 53 4.366 5.638 4.351
385 HA GLU 53 HA GLU 53 7.008 6.427 3.949
386 HB2 GLU 53 HB2 GLU 53 4.643 8.171 4.692
387 HB3 GLU 53 HB1 GLU 53 6.189 8.764 4.139
388 HG2 GLU 53 HG2 GLU 53 5.814 7.606 1.987
389 HG3 GLU 53 HG1 GLU 53 4.216 7.125 2.564
390 H SER 54 HN SER 54 4.916 6.687 6.861
391 HA SER 54 HA SER 54 6.790 8.127 8.332
392 HB2 SER 54 HB2 SER 54 5.399 7.266 10.309
393 HB3 SER 54 HB1 SER 54 4.569 8.232 9.085
394 HG SER 54 HG SER 54 4.582 5.376 9.159
395 H ARG 55 HN ARG 55 6.493 4.723 7.716
396 HA ARG 55 HA ARG 55 8.181 3.952 9.910
397 HB2 ARG 55 HB2 ARG 55 6.413 2.461 9.029
398 HB3 ARG 55 HB1 ARG 55 7.292 2.332 7.516
399 HG2 ARG 55 HG2 ARG 55 9.138 1.234 8.657
400 HG3 ARG 55 HG1 ARG 55 8.306 1.419 10.206
401 HD2 ARG 55 HD2 ARG 55 6.445 0.047 9.280
402 HD3 ARG 55 HD1 ARG 55 7.420 -0.225 7.835
403 HE ARG 55 HE ARG 55 8.699 -0.940 10.327
404 HH11 ARG 55 HH11 ARG 55 6.893 -2.145 7.533
405 HH12 ARG 55 HH12 ARG 55 7.139 -3.777 7.882
406 HH21 ARG 55 HH21 ARG 55 9.038 -3.097 10.834
407 HH22 ARG 55 HH22 ARG 55 8.366 -4.375 9.910
408 H TYR 56 HN TYR 56 8.606 4.345 6.401
409 HA TYR 56 HA TYR 56 11.404 3.578 6.779
410 HB2 TYR 56 HB2 TYR 56 9.716 3.532 4.308
411 HB3 TYR 56 HB1 TYR 56 11.448 3.223 4.333
412 HD1 TYR 56 HD1 TYR 56 12.293 1.355 5.820
413 HD2 TYR 56 HD2 TYR 56 8.207 1.812 4.786
414 HE1 TYR 56 HE1 TYR 56 11.893 -0.992 6.428
415 HE2 TYR 56 HE2 TYR 56 7.788 -0.533 5.389
416 HH TYR 56 HH TYR 56 10.066 -2.427 7.088
417 H GLY 57 HN GLY 57 9.594 6.394 6.097
418 HA2 GLY 57 HA2 GLY 57 10.438 8.522 5.832
419 HA3 GLY 57 HA1 GLY 57 12.053 7.815 5.777
420 H VAL 58 HN VAL 58 9.257 7.174 3.740
421 HA VAL 58 HA VAL 58 10.897 7.937 1.435
422 HB VAL 58 HB VAL 58 9.503 6.508 0.016
423 HG11 VAL 58 HG11 VAL 58 11.483 5.529 1.011
424 HG12 VAL 58 HG12 VAL 58 10.205 4.321 0.853
425 HG13 VAL 58 HG13 VAL 58 10.542 5.048 2.426
426 HG21 VAL 58 HG21 VAL 58 7.396 6.630 1.193
427 HG22 VAL 58 HG22 VAL 58 8.070 5.733 2.559
428 HG23 VAL 58 HG23 VAL 58 7.878 4.945 0.988
429 H SER 59 HN SER 59 9.036 8.292 -0.529
430 HA SER 59 HA SER 59 7.223 10.369 0.436
431 HB2 SER 59 HB2 SER 59 9.192 10.790 -1.819
432 HB3 SER 59 HB1 SER 59 8.087 11.972 -1.139
433 HG SER 59 HG SER 59 9.243 11.873 0.802
434 H ILE 60 HN ILE 60 5.300 9.737 -0.415
435 HA ILE 60 HA ILE 60 5.249 9.103 -3.283
436 HB ILE 60 HB ILE 60 3.561 7.777 -1.130
437 HG12 ILE 60 HG12 ILE 60 5.509 6.634 -3.145
438 HG13 ILE 60 HG11 ILE 60 5.770 6.762 -1.414
439 HG21 ILE 60 HG21 ILE 60 3.273 7.492 -4.126
440 HG22 ILE 60 HG22 ILE 60 2.142 8.311 -3.050
441 HG23 ILE 60 HG23 ILE 60 2.388 6.573 -2.903
442 HD11 ILE 60 HD11 ILE 60 3.941 5.195 -1.020
443 HD12 ILE 60 HD12 ILE 60 5.187 4.498 -2.058
444 HD13 ILE 60 HD13 ILE 60 3.677 5.075 -2.760
445 HA PRO 61 HA PRO 61 2.487 12.645 -3.272
446 HB2 PRO 61 HB2 PRO 61 2.048 11.758 -6.074
447 HB3 PRO 61 HB1 PRO 61 2.576 13.330 -5.473
448 HG2 PRO 61 HG2 PRO 61 4.297 11.716 -6.687
449 HG3 PRO 61 HG1 PRO 61 4.799 12.661 -5.274
450 HD2 PRO 61 HD2 PRO 61 4.020 9.769 -5.437
451 HD3 PRO 61 HD1 PRO 61 5.386 10.522 -4.575
452 H ASP 62 HN ASP 62 0.225 12.876 -3.259
453 HA ASP 62 HA ASP 62 -1.164 10.556 -2.406
454 HB2 ASP 62 HB2 ASP 62 -3.087 11.953 -2.047
455 HB3 ASP 62 HB1 ASP 62 -1.660 12.873 -1.582
456 H ASP 63 HN ASP 63 -1.269 12.358 -5.434
457 HA ASP 63 HA ASP 63 -3.495 10.883 -6.411
458 HB2 ASP 63 HB2 ASP 63 -3.200 12.067 -8.476
459 HB3 ASP 63 HB1 ASP 63 -2.943 13.204 -7.157
460 H VAL 64 HN VAL 64 -0.163 10.324 -6.213
461 HA VAL 64 HA VAL 64 -0.100 8.410 -8.372
462 HB VAL 64 HB VAL 64 1.999 9.047 -6.249
463 HG11 VAL 64 HG11 VAL 64 3.582 7.764 -7.605
464 HG12 VAL 64 HG12 VAL 64 2.299 7.356 -8.741
465 HG13 VAL 64 HG13 VAL 64 2.246 6.735 -7.089
466 HG21 VAL 64 HG21 VAL 64 1.838 9.787 -9.167
467 HG22 VAL 64 HG22 VAL 64 3.189 10.138 -8.084
468 HG23 VAL 64 HG23 VAL 64 1.610 10.871 -7.791
469 H ALA 65 HN ALA 65 -0.698 8.441 -4.940
470 HA ALA 65 HA ALA 65 -0.618 5.632 -4.568
471 HB1 ALA 65 HB1 ALA 65 -1.998 6.106 -2.582
472 HB2 ALA 65 HB2 ALA 65 -2.193 7.774 -3.133
473 HB3 ALA 65 HB3 ALA 65 -0.594 7.177 -2.672
474 H GLY 66 HN GLY 66 -2.901 7.963 -5.732
475 HA2 GLY 66 HA2 GLY 66 -5.034 6.031 -6.040
476 HA3 GLY 66 HA1 GLY 66 -5.086 7.729 -6.501
477 H ARG 67 HN ARG 67 -2.288 6.252 -7.593
478 HA ARG 67 HA ARG 67 -3.309 6.109 -10.324
479 HB2 ARG 67 HB2 ARG 67 -0.580 6.339 -9.142
480 HB3 ARG 67 HB1 ARG 67 -0.770 5.681 -10.756
481 HG2 ARG 67 HG2 ARG 67 -1.752 8.383 -9.876
482 HG3 ARG 67 HG1 ARG 67 -0.236 8.071 -10.724
483 HD2 ARG 67 HD2 ARG 67 -3.027 7.513 -11.724
484 HD3 ARG 67 HD1 ARG 67 -1.920 8.754 -12.317
485 HE ARG 67 HE ARG 67 -1.185 5.916 -12.468
486 HH11 ARG 67 HH11 ARG 67 -1.626 9.018 -14.086
487 HH12 ARG 67 HH12 ARG 67 -1.226 8.466 -15.633
488 HH21 ARG 67 HH21 ARG 67 -0.662 5.088 -14.518
489 HH22 ARG 67 HH22 ARG 67 -0.600 6.065 -15.903
490 H VAL 68 HN VAL 68 -2.301 4.098 -7.748
491 HA VAL 68 HA VAL 68 -1.585 2.009 -9.539
492 HB VAL 68 HB VAL 68 -1.102 0.593 -7.575
493 HG11 VAL 68 HG11 VAL 68 0.621 2.030 -8.459
494 HG12 VAL 68 HG12 VAL 68 0.750 1.953 -6.702
495 HG13 VAL 68 HG13 VAL 68 0.048 3.376 -7.477
496 HG21 VAL 68 HG21 VAL 68 -2.766 1.396 -5.981
497 HG22 VAL 68 HG22 VAL 68 -1.997 2.991 -5.964
498 HG23 VAL 68 HG23 VAL 68 -1.133 1.587 -5.328
499 H ASP 69 HN ASP 69 -2.528 -0.311 -8.910
500 HA ASP 69 HA ASP 69 -5.486 -0.115 -8.664
501 HB2 ASP 69 HB2 ASP 69 -4.540 -0.313 -11.117
502 HB3 ASP 69 HB1 ASP 69 -4.116 -1.932 -10.623
503 H THR 70 HN THR 70 -2.624 -2.027 -8.884
504 HA THR 70 HA THR 70 -3.747 -4.077 -7.141
505 HB THR 70 HB THR 70 -1.993 -5.550 -8.166
506 HG1 THR 70 HG1 THR 70 -1.449 -3.126 -9.546
507 HG21 THR 70 HG21 THR 70 -4.252 -5.544 -9.105
508 HG22 THR 70 HG22 THR 70 -3.059 -5.713 -10.398
509 HG23 THR 70 HG23 THR 70 -3.836 -4.152 -10.105
510 HA PRO 71 HA PRO 71 -1.111 -2.774 -3.819
511 HB2 PRO 71 HB2 PRO 71 -0.643 -5.690 -3.413
512 HB3 PRO 71 HB1 PRO 71 -1.168 -4.453 -2.252
513 HG2 PRO 71 HG2 PRO 71 -2.958 -6.116 -3.219
514 HG3 PRO 71 HG1 PRO 71 -3.338 -4.385 -3.125
515 HD2 PRO 71 HD2 PRO 71 -2.493 -6.009 -5.501
516 HD3 PRO 71 HD1 PRO 71 -3.791 -4.805 -5.379
517 H ARG 72 HN ARG 72 0.174 -5.060 -6.106
518 HA ARG 72 HA ARG 72 2.856 -4.995 -5.209
519 HB2 ARG 72 HB2 ARG 72 3.437 -5.823 -7.511
520 HB3 ARG 72 HB1 ARG 72 2.284 -6.803 -6.614
521 HG2 ARG 72 HG2 ARG 72 0.457 -5.768 -7.921
522 HG3 ARG 72 HG1 ARG 72 1.681 -4.898 -8.868
523 HD2 ARG 72 HD2 ARG 72 2.614 -6.937 -9.656
524 HD3 ARG 72 HD1 ARG 72 1.615 -7.878 -8.549
525 HE ARG 72 HE ARG 72 0.436 -6.273 -10.690
526 HH11 ARG 72 HH11 ARG 72 0.974 -9.453 -9.128
527 HH12 ARG 72 HH12 ARG 72 -0.193 -10.262 -10.059
528 HH21 ARG 72 HH21 ARG 72 -1.196 -7.445 -11.984
529 HH22 ARG 72 HH22 ARG 72 -1.451 -9.095 -11.726
530 H GLU 73 HN GLU 73 1.045 -2.844 -7.243
531 HA GLU 73 HA GLU 73 3.292 -1.442 -8.292
532 HB2 GLU 73 HB2 GLU 73 0.414 -0.613 -7.986
533 HB3 GLU 73 HB1 GLU 73 1.609 0.188 -8.997
534 HG2 GLU 73 HG2 GLU 73 1.765 -1.683 -10.444
535 HG3 GLU 73 HG1 GLU 73 0.778 -2.668 -9.352
536 H LEU 74 HN LEU 74 1.249 -1.203 -5.492
537 HA LEU 74 HA LEU 74 1.961 1.361 -4.480
538 HB2 LEU 74 HB2 LEU 74 0.084 -0.310 -3.783
539 HB3 LEU 74 HB1 LEU 74 1.362 -1.071 -2.847
540 HG LEU 74 HG LEU 74 0.231 1.711 -2.418
541 HD11 LEU 74 HD11 LEU 74 -1.303 -0.027 -1.767
542 HD12 LEU 74 HD12 LEU 74 -0.653 0.787 -0.347
543 HD13 LEU 74 HD13 LEU 74 -0.046 -0.804 -0.802
544 HD21 LEU 74 HD21 LEU 74 2.260 0.220 -0.734
545 HD22 LEU 74 HD22 LEU 74 1.559 1.795 -0.364
546 HD23 LEU 74 HD23 LEU 74 2.612 1.601 -1.768
547 H LEU 75 HN LEU 75 2.988 -1.951 -3.772
548 HA LEU 75 HA LEU 75 4.965 -1.591 -1.897
549 HB2 LEU 75 HB2 LEU 75 3.876 -3.666 -2.530
550 HB3 LEU 75 HB1 LEU 75 4.657 -3.611 -4.090
551 HG LEU 75 HG LEU 75 6.814 -3.756 -2.938
552 HD11 LEU 75 HD11 LEU 75 5.081 -4.381 -0.544
553 HD12 LEU 75 HD12 LEU 75 6.161 -2.992 -0.728
554 HD13 LEU 75 HD13 LEU 75 6.824 -4.622 -0.623
555 HD21 LEU 75 HD21 LEU 75 5.791 -5.620 -4.000
556 HD22 LEU 75 HD22 LEU 75 4.845 -5.978 -2.557
557 HD23 LEU 75 HD23 LEU 75 6.615 -6.179 -2.535
558 H ASP 76 HN ASP 76 5.069 -1.575 -5.375
559 HA ASP 76 HA ASP 76 7.860 -1.496 -5.768
560 HB2 ASP 76 HB2 ASP 76 6.383 -2.184 -7.540
561 HB3 ASP 76 HB1 ASP 76 5.556 -0.633 -7.508
562 H LEU 77 HN LEU 77 5.420 1.000 -5.380
563 HA LEU 77 HA LEU 77 7.038 3.226 -5.995
564 HB2 LEU 77 HB2 LEU 77 4.589 2.932 -4.279
565 HB3 LEU 77 HB1 LEU 77 5.308 4.468 -4.689
566 HG LEU 77 HG LEU 77 4.163 2.503 -6.670
567 HD11 LEU 77 HD11 LEU 77 2.323 4.119 -6.893
568 HD12 LEU 77 HD12 LEU 77 3.017 5.090 -5.586
569 HD13 LEU 77 HD13 LEU 77 2.424 3.458 -5.266
570 HD21 LEU 77 HD21 LEU 77 5.939 3.895 -7.600
571 HD22 LEU 77 HD22 LEU 77 5.120 5.346 -7.011
572 HD23 LEU 77 HD23 LEU 77 4.368 4.356 -8.262
573 H ILE 78 HN ILE 78 6.219 1.600 -2.979
574 HA ILE 78 HA ILE 78 7.603 3.278 -1.191
575 HB ILE 78 HB ILE 78 7.023 0.308 -0.955
576 HG12 ILE 78 HG12 ILE 78 5.008 1.741 -1.188
577 HG13 ILE 78 HG11 ILE 78 5.104 0.970 0.390
578 HG21 ILE 78 HG21 ILE 78 7.884 2.289 1.163
579 HG22 ILE 78 HG22 ILE 78 8.816 0.915 0.568
580 HG23 ILE 78 HG23 ILE 78 7.335 0.647 1.483
581 HD11 ILE 78 HD11 ILE 78 4.366 3.273 0.579
582 HD12 ILE 78 HD12 ILE 78 5.835 3.823 -0.233
583 HD13 ILE 78 HD13 ILE 78 5.938 3.062 1.354
584 H ASN 79 HN ASN 79 8.536 0.068 -2.410
585 HA ASN 79 HA ASN 79 11.125 0.159 -1.383
586 HB2 ASN 79 HB2 ASN 79 10.023 -1.526 -3.627
587 HB3 ASN 79 HB1 ASN 79 11.652 -1.715 -2.986
588 HD21 ASN 79 HD21 ASN 79 9.723 -3.727 -2.997
589 HD22 ASN 79 HD22 ASN 79 9.324 -4.131 -1.366
590 H GLY 80 HN GLY 80 9.884 1.424 -4.363
591 HA2 GLY 80 HA2 GLY 80 12.253 1.794 -5.792
592 HA3 GLY 80 HA1 GLY 80 10.835 2.830 -5.890
593 H ALA 81 HN ALA 81 10.648 4.061 -3.587
594 HA ALA 81 HA ALA 81 12.858 5.906 -3.638
595 HB1 ALA 81 HB1 ALA 81 11.595 7.162 -1.981
596 HB2 ALA 81 HB2 ALA 81 10.492 5.805 -1.758
597 HB3 ALA 81 HB3 ALA 81 10.531 6.664 -3.296
598 H LEU 82 HN LEU 82 11.865 3.254 -1.642
599 HA LEU 82 HA LEU 82 13.378 3.859 0.630
600 HB2 LEU 82 HB2 LEU 82 11.447 2.462 0.704
601 HB3 LEU 82 HB1 LEU 82 12.168 1.334 -0.422
602 HG LEU 82 HG LEU 82 13.752 0.654 1.184
603 HD11 LEU 82 HD11 LEU 82 13.564 1.472 3.573
604 HD12 LEU 82 HD12 LEU 82 12.461 2.730 2.974
605 HD13 LEU 82 HD13 LEU 82 14.128 2.694 2.434
606 HD21 LEU 82 HD21 LEU 82 12.213 -0.410 2.788
607 HD22 LEU 82 HD22 LEU 82 11.616 -0.477 1.130
608 HD23 LEU 82 HD23 LEU 82 10.943 0.691 2.268
609 H ALA 83 HN ALA 83 14.046 1.854 -2.229
610 HA ALA 83 HA ALA 83 16.480 0.802 -1.230
611 HB1 ALA 83 HB1 ALA 83 16.858 -0.013 -3.489
612 HB2 ALA 83 HB2 ALA 83 15.562 1.026 -4.084
613 HB3 ALA 83 HB3 ALA 83 15.190 -0.305 -2.996
614 H GLU 84 HN GLU 84 15.733 3.906 -2.350
615 HA GLU 84 HA GLU 84 18.315 4.560 -3.343
616 HB2 GLU 84 HB2 GLU 84 15.938 6.178 -2.481
617 HB3 GLU 84 HB1 GLU 84 17.406 6.866 -3.127
618 HG2 GLU 84 HG2 GLU 84 17.026 5.568 -5.206
619 HG3 GLU 84 HG1 GLU 84 15.468 5.065 -4.543
620 H ALA 85 HN ALA 85 16.645 4.470 -0.324
621 HA ALA 85 HA ALA 85 18.671 6.070 1.008
622 HB1 ALA 85 HB1 ALA 85 16.338 6.458 1.593
623 HB2 ALA 85 HB2 ALA 85 17.234 5.843 2.979
624 HB3 ALA 85 HB3 ALA 85 16.164 4.770 2.079
625 H ALA 86 HN ALA 86 17.289 2.817 1.009
626 HA ALA 86 HA ALA 86 19.475 1.881 2.670
627 HB1 ALA 86 HB1 ALA 86 16.896 0.546 1.824
628 HB2 ALA 86 HB2 ALA 86 17.206 1.313 3.380
629 HB3 ALA 86 HB3 ALA 86 18.106 -0.135 2.911
630 H28A SDO 101 H28A SDO 42 -7.696 10.249 -1.973
631 H28B SDO 101 H28B SDO 42 -7.461 9.333 -3.464
632 H30A SDO 101 H30A SDO 42 -7.153 12.653 -1.958
633 H30B SDO 101 H30B SDO 42 -8.139 12.854 -3.400
634 H30C SDO 101 H30C SDO 42 -6.469 13.452 -3.383
635 H31A SDO 101 H31A SDO 42 -5.095 9.955 -3.212
636 H31B SDO 101 H31B SDO 42 -5.447 11.006 -1.840
637 H31C SDO 101 H31C SDO 42 -4.610 11.649 -3.251
638 H32A SDO 101 H32A SDO 42 -5.973 10.447 -5.445
639 H33A SDO 101 H33A SDO 42 -4.999 12.663 -4.800
640 H36A SDO 101 H36A SDO 42 -7.373 13.341 -6.241
641 H37A SDO 101 H37A SDO 42 -9.054 12.760 -8.229
642 H37B SDO 101 H37B SDO 42 -10.076 12.419 -6.833
643 H38A SDO 101 H38A SDO 42 -8.757 15.076 -7.441
644 H38B SDO 101 H38B SDO 42 -10.428 14.672 -7.758
645 H41A SDO 101 H41A SDO 42 -10.043 13.081 -5.012
646 H42A SDO 101 H42A SDO 42 -9.615 14.134 -2.794
647 H42B SDO 101 H42B SDO 42 -10.844 15.311 -3.275
648 H43A SDO 101 H43A SDO 42 -11.205 12.351 -3.091
649 H43B SDO 101 H43B SDO 42 -12.498 13.513 -3.336
650 H1A SDO 101 H1A SDO 42 -11.556 15.155 0.494
651 H1B SDO 101 H1B SDO 42 -10.349 13.910 0.682
652 H2A SDO 101 H2A SDO 42 -10.393 15.960 -1.495
653 H2B SDO 101 H2B SDO 42 -9.162 14.751 -1.245
654 H4A SDO 101 H4A SDO 42 -9.213 17.706 1.818
655 H4B SDO 101 H4B SDO 42 -8.029 16.446 2.034
656 H5A SDO 101 H5A SDO 42 -9.733 14.798 2.446
657 H5B SDO 101 H5B SDO 42 -10.994 16.008 2.178
658 H6A SDO 101 H6A SDO 42 -10.113 17.329 4.047
659 H6B SDO 101 H6B SDO 42 -8.872 16.110 4.325
660 H8A SDO 101 H8A SDO 42 -12.352 14.055 5.187
661 H8B SDO 101 H8B SDO 42 -11.148 13.670 3.943
662 H8C SDO 101 H8C SDO 42 -12.380 14.890 3.630
Start of MODEL 3
1 H1 MET 1 HT1 MET 1 19.945 -5.931 5.038
2 H2 MET 1 HT2 MET 1 20.729 -5.097 6.261
3 H3 MET 1 HT3 MET 1 21.442 -6.512 5.632
4 HA MET 1 HA MET 1 22.535 -4.541 4.773
5 HB2 MET 1 HB2 MET 1 20.680 -5.796 2.726
6 HB3 MET 1 HB1 MET 1 22.078 -4.809 2.332
7 HG2 MET 1 HG2 MET 1 23.563 -6.451 3.233
8 HG3 MET 1 HG1 MET 1 22.206 -7.407 3.837
9 HE1 MET 1 HE1 MET 1 20.131 -7.183 1.466
10 HE2 MET 1 HE2 MET 1 20.484 -8.708 2.284
11 HE3 MET 1 HE3 MET 1 20.514 -8.624 0.525
12 H ALA 2 HN ALA 2 19.109 -4.602 3.772
13 HA ALA 2 HA ALA 2 19.099 -1.684 3.926
14 HB1 ALA 2 HB1 ALA 2 17.784 -3.416 1.822
15 HB2 ALA 2 HB2 ALA 2 19.214 -2.410 1.574
16 HB3 ALA 2 HB3 ALA 2 17.667 -1.661 1.949
17 H THR 3 HN THR 3 16.533 -1.147 3.647
18 HA THR 3 HA THR 3 15.142 -2.909 5.513
19 HB THR 3 HB THR 3 15.761 -0.875 6.716
20 HG1 THR 3 HG1 THR 3 13.055 -1.094 6.014
21 HG21 THR 3 HG21 THR 3 14.392 0.675 4.502
22 HG22 THR 3 HG22 THR 3 16.123 0.664 4.866
23 HG23 THR 3 HG23 THR 3 14.990 1.385 6.006
24 H LEU 4 HN LEU 4 14.881 -3.632 3.125
25 HA LEU 4 HA LEU 4 13.107 -2.110 1.488
26 HB2 LEU 4 HB2 LEU 4 14.867 -3.573 0.591
27 HB3 LEU 4 HB1 LEU 4 13.996 -4.982 1.186
28 HG LEU 4 HG LEU 4 12.107 -4.230 -0.323
29 HD11 LEU 4 HD11 LEU 4 14.286 -2.452 -1.430
30 HD12 LEU 4 HD12 LEU 4 12.818 -1.920 -0.615
31 HD13 LEU 4 HD13 LEU 4 12.714 -2.745 -2.170
32 HD21 LEU 4 HD21 LEU 4 13.162 -5.191 -2.313
33 HD22 LEU 4 HD22 LEU 4 13.577 -6.095 -0.859
34 HD23 LEU 4 HD23 LEU 4 14.751 -4.987 -1.569
35 H LEU 5 HN LEU 5 11.009 -2.238 1.347
36 HA LEU 5 HA LEU 5 9.532 -3.803 3.260
37 HB2 LEU 5 HB2 LEU 5 9.143 -1.354 2.615
38 HB3 LEU 5 HB1 LEU 5 8.500 -1.947 1.110
39 HG LEU 5 HG LEU 5 7.321 -2.454 3.852
40 HD11 LEU 5 HD11 LEU 5 7.132 -0.157 3.291
41 HD12 LEU 5 HD12 LEU 5 5.549 -0.929 3.039
42 HD13 LEU 5 HD13 LEU 5 6.584 -0.560 1.663
43 HD21 LEU 5 HD21 LEU 5 6.163 -3.015 1.118
44 HD22 LEU 5 HD22 LEU 5 5.328 -3.214 2.659
45 HD23 LEU 5 HD23 LEU 5 6.717 -4.230 2.275
46 H THR 6 HN THR 6 8.931 -5.830 2.755
47 HA THR 6 HA THR 6 8.493 -6.522 -0.017
48 HB THR 6 HB THR 6 8.544 -8.908 1.094
49 HG1 THR 6 HG1 THR 6 8.715 -8.564 3.260
50 HG21 THR 6 HG21 THR 6 11.030 -7.193 0.848
51 HG22 THR 6 HG22 THR 6 10.246 -8.061 -0.474
52 HG23 THR 6 HG23 THR 6 11.008 -8.955 0.841
53 H THR 7 HN THR 7 6.669 -8.165 -0.375
54 HA THR 7 HA THR 7 4.242 -6.957 0.210
55 HB THR 7 HB THR 7 4.651 -9.858 -0.581
56 HG1 THR 7 HG1 THR 7 5.256 -9.125 -2.470
57 HG21 THR 7 HG21 THR 7 2.406 -7.897 -1.127
58 HG22 THR 7 HG22 THR 7 2.316 -9.270 -0.031
59 HG23 THR 7 HG23 THR 7 2.508 -9.538 -1.766
60 H ASP 8 HN ASP 8 5.836 -9.571 1.861
61 HA ASP 8 HA ASP 8 3.864 -10.399 3.606
62 HB2 ASP 8 HB2 ASP 8 5.786 -10.928 5.236
63 HB3 ASP 8 HB1 ASP 8 5.776 -11.717 3.665
64 H ASP 9 HN ASP 9 5.785 -7.454 3.913
65 HA ASP 9 HA ASP 9 4.643 -6.910 6.533
66 HB2 ASP 9 HB2 ASP 9 6.894 -6.061 5.990
67 HB3 ASP 9 HB1 ASP 9 6.189 -5.052 4.742
68 H LEU 10 HN LEU 10 4.167 -5.956 3.259
69 HA LEU 10 HA LEU 10 2.265 -3.928 3.763
70 HB2 LEU 10 HB2 LEU 10 3.257 -4.182 1.523
71 HB3 LEU 10 HB1 LEU 10 2.383 -5.693 1.307
72 HG LEU 10 HG LEU 10 0.248 -4.438 1.471
73 HD11 LEU 10 HD11 LEU 10 1.991 -1.985 1.426
74 HD12 LEU 10 HD12 LEU 10 0.985 -2.540 2.769
75 HD13 LEU 10 HD13 LEU 10 0.232 -2.009 1.271
76 HD21 LEU 10 HD21 LEU 10 1.153 -4.958 -0.706
77 HD22 LEU 10 HD22 LEU 10 2.130 -3.490 -0.677
78 HD23 LEU 10 HD23 LEU 10 0.368 -3.377 -0.743
79 H ARG 11 HN ARG 11 1.964 -7.394 3.686
80 HA ARG 11 HA ARG 11 -0.840 -7.553 3.627
81 HB2 ARG 11 HB2 ARG 11 0.783 -9.511 3.426
82 HB3 ARG 11 HB1 ARG 11 0.974 -9.420 5.168
83 HG2 ARG 11 HG2 ARG 11 -1.388 -9.882 5.496
84 HG3 ARG 11 HG1 ARG 11 -1.647 -9.947 3.756
85 HD2 ARG 11 HD2 ARG 11 0.087 -11.803 5.397
86 HD3 ARG 11 HD1 ARG 11 -1.500 -12.158 4.714
87 HE ARG 11 HE ARG 11 -0.337 -11.783 2.483
88 HH11 ARG 11 HH11 ARG 11 1.289 -13.074 5.327
89 HH12 ARG 11 HH12 ARG 11 2.336 -14.114 4.492
90 HH21 ARG 11 HH21 ARG 11 1.193 -13.264 1.199
91 HH22 ARG 11 HH22 ARG 11 2.303 -14.146 2.112
92 H ARG 12 HN ARG 12 1.352 -6.702 6.163
93 HA ARG 12 HA ARG 12 -0.591 -6.771 8.329
94 HB2 ARG 12 HB2 ARG 12 2.023 -5.271 8.187
95 HB3 ARG 12 HB1 ARG 12 1.125 -5.710 9.631
96 HG2 ARG 12 HG2 ARG 12 1.707 -8.010 9.364
97 HG3 ARG 12 HG1 ARG 12 2.406 -7.684 7.770
98 HD2 ARG 12 HD2 ARG 12 4.040 -6.186 8.806
99 HD3 ARG 12 HD1 ARG 12 3.376 -6.564 10.392
100 HE ARG 12 HE ARG 12 3.993 -8.974 9.580
101 HH11 ARG 12 HH11 ARG 12 5.893 -6.060 8.863
102 HH12 ARG 12 HH12 ARG 12 7.382 -6.773 9.234
103 HH21 ARG 12 HH21 ARG 12 6.019 -9.973 9.998
104 HH22 ARG 12 HH22 ARG 12 7.477 -9.085 9.852
105 H ALA 13 HN ALA 13 1.142 -4.355 6.468
106 HA ALA 13 HA ALA 13 0.098 -2.024 7.540
107 HB1 ALA 13 HB1 ALA 13 0.922 -0.928 5.542
108 HB2 ALA 13 HB2 ALA 13 1.062 -2.491 4.739
109 HB3 ALA 13 HB3 ALA 13 2.078 -2.114 6.132
110 H LEU 14 HN LEU 14 -1.031 -3.899 4.796
111 HA LEU 14 HA LEU 14 -3.005 -2.080 3.979
112 HB2 LEU 14 HB2 LEU 14 -1.942 -3.907 2.613
113 HB3 LEU 14 HB1 LEU 14 -2.934 -5.059 3.483
114 HG LEU 14 HG LEU 14 -4.955 -4.067 2.531
115 HD11 LEU 14 HD11 LEU 14 -3.047 -2.213 1.088
116 HD12 LEU 14 HD12 LEU 14 -4.161 -1.748 2.373
117 HD13 LEU 14 HD13 LEU 14 -4.792 -2.320 0.829
118 HD21 LEU 14 HD21 LEU 14 -4.556 -4.688 0.191
119 HD22 LEU 14 HD22 LEU 14 -3.835 -5.848 1.308
120 HD23 LEU 14 HD23 LEU 14 -2.818 -4.662 0.491
121 H VAL 15 HN VAL 15 -2.909 -4.345 6.530
122 HA VAL 15 HA VAL 15 -5.777 -4.204 6.991
123 HB VAL 15 HB VAL 15 -3.537 -5.268 8.756
124 HG11 VAL 15 HG11 VAL 15 -5.516 -4.625 10.054
125 HG12 VAL 15 HG12 VAL 15 -5.360 -6.383 10.013
126 HG13 VAL 15 HG13 VAL 15 -6.547 -5.584 8.995
127 HG21 VAL 15 HG21 VAL 15 -4.329 -7.499 8.097
128 HG22 VAL 15 HG22 VAL 15 -3.745 -6.568 6.720
129 HG23 VAL 15 HG23 VAL 15 -5.482 -6.751 6.986
130 H GLU 16 HN GLU 16 -2.793 -3.194 8.645
131 HA GLU 16 HA GLU 16 -3.665 -1.657 10.702
132 HB2 GLU 16 HB2 GLU 16 -1.288 -1.169 8.940
133 HB3 GLU 16 HB1 GLU 16 -1.539 -0.425 10.503
134 HG2 GLU 16 HG2 GLU 16 -1.547 -2.703 11.506
135 HG3 GLU 16 HG1 GLU 16 -1.162 -3.334 9.913
136 H SER 17 HN SER 17 -3.519 -0.587 7.317
137 HA SER 17 HA SER 17 -3.841 2.121 8.020
138 HB2 SER 17 HB2 SER 17 -4.331 2.375 5.539
139 HB3 SER 17 HB1 SER 17 -2.735 1.803 6.023
140 HG SER 17 HG SER 17 -4.890 0.117 5.169
141 H ALA 18 HN ALA 18 -6.084 -0.390 7.920
142 HA ALA 18 HA ALA 18 -8.253 1.527 7.553
143 HB1 ALA 18 HB1 ALA 18 -8.219 -1.458 7.247
144 HB2 ALA 18 HB2 ALA 18 -8.284 -0.274 5.935
145 HB3 ALA 18 HB3 ALA 18 -9.637 -0.434 7.060
146 H GLY 19 HN GLY 19 -10.069 1.247 8.964
147 HA2 GLY 19 HA2 GLY 19 -9.211 0.229 11.594
148 HA3 GLY 19 HA1 GLY 19 -10.319 1.576 11.369
149 H GLU 20 HN GLU 20 -11.069 -0.705 9.108
150 HA GLU 20 HA GLU 20 -12.990 -2.031 10.893
151 HB2 GLU 20 HB2 GLU 20 -14.797 -1.646 9.285
152 HB3 GLU 20 HB1 GLU 20 -14.135 -0.130 9.871
153 HG2 GLU 20 HG2 GLU 20 -12.819 0.068 7.788
154 HG3 GLU 20 HG1 GLU 20 -13.589 -1.403 7.195
155 H THR 21 HN THR 21 -10.450 -2.844 9.322
156 HA THR 21 HA THR 21 -11.689 -4.797 7.555
157 HB THR 21 HB THR 21 -8.889 -3.618 7.454
158 HG1 THR 21 HG1 THR 21 -11.287 -3.177 6.014
159 HG21 THR 21 HG21 THR 21 -8.745 -4.643 5.223
160 HG22 THR 21 HG22 THR 21 -10.369 -5.317 5.426
161 HG23 THR 21 HG23 THR 21 -9.055 -5.891 6.440
162 H ASP 22 HN ASP 22 -10.983 -4.862 10.556
163 HA ASP 22 HA ASP 22 -9.215 -7.148 10.625
164 HB2 ASP 22 HB2 ASP 22 -10.692 -5.719 12.750
165 HB3 ASP 22 HB1 ASP 22 -9.789 -7.188 13.116
166 H GLY 23 HN GLY 23 -10.272 -8.609 9.457
167 HA2 GLY 23 HA2 GLY 23 -11.626 -10.618 10.333
168 HA3 GLY 23 HA1 GLY 23 -12.926 -9.412 10.377
169 H THR 24 HN THR 24 -10.381 -9.710 7.972
170 HA THR 24 HA THR 24 -12.465 -10.144 5.964
171 HB THR 24 HB THR 24 -10.701 -9.074 4.425
172 HG1 THR 24 HG1 THR 24 -9.599 -7.876 6.707
173 HG21 THR 24 HG21 THR 24 -11.852 -7.411 6.677
174 HG22 THR 24 HG22 THR 24 -12.700 -7.865 5.192
175 HG23 THR 24 HG23 THR 24 -11.303 -6.799 5.122
176 H ASP 25 HN ASP 25 -10.667 -10.837 3.871
177 HA ASP 25 HA ASP 25 -9.405 -13.276 4.880
178 HB2 ASP 25 HB2 ASP 25 -10.154 -14.502 2.957
179 HB3 ASP 25 HB1 ASP 25 -11.571 -13.744 3.667
180 H LEU 26 HN LEU 26 -8.407 -10.697 4.514
181 HA LEU 26 HA LEU 26 -6.907 -10.433 2.102
182 HB2 LEU 26 HB2 LEU 26 -7.660 -8.559 3.542
183 HB3 LEU 26 HB1 LEU 26 -6.550 -9.099 4.789
184 HG LEU 26 HG LEU 26 -4.663 -8.632 3.247
185 HD11 LEU 26 HD11 LEU 26 -5.891 -8.894 1.157
186 HD12 LEU 26 HD12 LEU 26 -5.070 -7.334 1.232
187 HD13 LEU 26 HD13 LEU 26 -6.816 -7.434 1.509
188 HD21 LEU 26 HD21 LEU 26 -6.536 -6.325 3.771
189 HD22 LEU 26 HD22 LEU 26 -4.807 -6.195 3.441
190 HD23 LEU 26 HD23 LEU 26 -5.362 -6.990 4.907
191 H SER 27 HN SER 27 -6.528 -12.173 4.997
192 HA SER 27 HA SER 27 -3.705 -12.449 4.952
193 HB2 SER 27 HB2 SER 27 -4.271 -14.480 6.469
194 HB3 SER 27 HB1 SER 27 -4.664 -12.863 7.065
195 HG SER 27 HG SER 27 -6.730 -13.172 6.655
196 H GLY 28 HN GLY 28 -2.861 -13.143 3.159
197 HA2 GLY 28 HA2 GLY 28 -2.505 -15.620 2.357
198 HA3 GLY 28 HA1 GLY 28 -4.027 -15.201 1.554
199 H ASP 29 HN ASP 29 -2.875 -15.263 -0.497
200 HA ASP 29 HA ASP 29 -1.237 -12.907 -0.647
201 HB2 ASP 29 HB2 ASP 29 -0.959 -15.395 -2.270
202 HB3 ASP 29 HB1 ASP 29 -0.321 -13.857 -2.855
203 H PHE 30 HN PHE 30 -2.266 -11.435 -0.910
204 HA PHE 30 HA PHE 30 -4.575 -11.209 -2.599
205 HB2 PHE 30 HB2 PHE 30 -4.643 -8.906 -1.607
206 HB3 PHE 30 HB1 PHE 30 -4.655 -10.209 -0.429
207 HD1 PHE 30 HD2 PHE 30 -2.609 -10.666 0.895
208 HD2 PHE 30 HD1 PHE 30 -2.837 -7.291 -1.689
209 HE1 PHE 30 HE2 PHE 30 -0.702 -9.635 2.064
210 HE2 PHE 30 HE1 PHE 30 -0.962 -6.279 -0.532
211 HZ PHE 30 HZ PHE 30 0.186 -7.460 1.259
212 H LEU 31 HN LEU 31 -1.801 -11.533 -3.807
213 HA LEU 31 HA LEU 31 -1.072 -9.056 -4.974
214 HB2 LEU 31 HB2 LEU 31 -0.371 -11.912 -5.603
215 HB3 LEU 31 HB1 LEU 31 0.181 -10.598 -6.606
216 HG LEU 31 HG LEU 31 1.948 -11.238 -5.157
217 HD11 LEU 31 HD11 LEU 31 1.821 -8.911 -5.618
218 HD12 LEU 31 HD12 LEU 31 2.428 -9.159 -3.976
219 HD13 LEU 31 HD13 LEU 31 0.765 -8.645 -4.233
220 HD21 LEU 31 HD21 LEU 31 1.792 -11.095 -2.689
221 HD22 LEU 31 HD22 LEU 31 0.754 -12.342 -3.367
222 HD23 LEU 31 HD23 LEU 31 0.057 -10.805 -2.842
223 H ASP 32 HN ASP 32 -3.353 -11.498 -5.754
224 HA ASP 32 HA ASP 32 -3.834 -10.447 -8.461
225 HB2 ASP 32 HB2 ASP 32 -5.026 -12.877 -7.090
226 HB3 ASP 32 HB1 ASP 32 -5.285 -12.407 -8.761
227 H LEU 33 HN LEU 33 -4.590 -9.357 -5.698
228 HA LEU 33 HA LEU 33 -7.493 -9.108 -6.078
229 HB2 LEU 33 HB2 LEU 33 -6.626 -10.297 -4.024
230 HB3 LEU 33 HB1 LEU 33 -5.818 -8.822 -3.573
231 HG LEU 33 HG LEU 33 -7.999 -7.725 -3.250
232 HD11 LEU 33 HD11 LEU 33 -9.130 -10.444 -3.925
233 HD12 LEU 33 HD12 LEU 33 -9.269 -8.997 -4.925
234 HD13 LEU 33 HD13 LEU 33 -10.045 -9.050 -3.352
235 HD21 LEU 33 HD21 LEU 33 -6.908 -8.889 -1.391
236 HD22 LEU 33 HD22 LEU 33 -7.712 -10.384 -1.847
237 HD23 LEU 33 HD23 LEU 33 -8.662 -9.016 -1.280
238 H ARG 34 HN ARG 34 -8.305 -6.874 -5.694
239 HA ARG 34 HA ARG 34 -6.196 -4.901 -6.268
240 HB2 ARG 34 HB2 ARG 34 -9.157 -4.808 -6.837
241 HB3 ARG 34 HB1 ARG 34 -8.034 -3.501 -7.134
242 HG2 ARG 34 HG2 ARG 34 -6.916 -4.798 -8.816
243 HG3 ARG 34 HG1 ARG 34 -7.940 -6.202 -8.451
244 HD2 ARG 34 HD2 ARG 34 -9.912 -4.974 -9.106
245 HD3 ARG 34 HD1 ARG 34 -8.950 -3.520 -9.369
246 HE ARG 34 HE ARG 34 -8.386 -5.924 -10.895
247 HH11 ARG 34 HH11 ARG 34 -9.837 -2.672 -10.870
248 HH12 ARG 34 HH12 ARG 34 -9.530 -2.412 -12.534
249 HH21 ARG 34 HH21 ARG 34 -8.157 -5.595 -13.136
250 HH22 ARG 34 HH22 ARG 34 -8.489 -4.073 -13.846
251 H PHE 35 HN PHE 35 -6.617 -2.765 -5.356
252 HA PHE 35 HA PHE 35 -7.316 -2.819 -2.613
253 HB2 PHE 35 HB2 PHE 35 -7.002 -0.443 -4.474
254 HB3 PHE 35 HB1 PHE 35 -7.149 -0.335 -2.724
255 HD1 PHE 35 HD2 PHE 35 -5.327 -1.090 -1.277
256 HD2 PHE 35 HD1 PHE 35 -4.973 -1.139 -5.516
257 HE1 PHE 35 HE2 PHE 35 -2.895 -1.340 -1.065
258 HE2 PHE 35 HE1 PHE 35 -2.536 -1.394 -5.315
259 HZ PHE 35 HZ PHE 35 -1.496 -1.498 -3.074
260 H GLU 36 HN GLU 36 -9.001 -1.872 -5.489
261 HA GLU 36 HA GLU 36 -11.282 -0.817 -4.233
262 HB2 GLU 36 HB2 GLU 36 -12.326 -1.113 -6.522
263 HB3 GLU 36 HB1 GLU 36 -10.884 -0.110 -6.427
264 HG2 GLU 36 HG2 GLU 36 -9.564 -2.134 -7.162
265 HG3 GLU 36 HG1 GLU 36 -11.110 -2.923 -7.451
266 H ASP 37 HN ASP 37 -10.332 -4.091 -4.794
267 HA ASP 37 HA ASP 37 -13.000 -5.170 -4.579
268 HB2 ASP 37 HB2 ASP 37 -10.314 -6.546 -4.246
269 HB3 ASP 37 HB1 ASP 37 -11.859 -7.365 -4.139
270 H ILE 38 HN ILE 38 -10.326 -4.475 -2.459
271 HA ILE 38 HA ILE 38 -11.649 -5.727 -0.202
272 HB ILE 38 HB ILE 38 -9.625 -5.056 1.111
273 HG12 ILE 38 HG12 ILE 38 -8.649 -4.141 -1.598
274 HG13 ILE 38 HG11 ILE 38 -8.936 -3.123 -0.198
275 HG21 ILE 38 HG21 ILE 38 -9.842 -7.255 0.104
276 HG22 ILE 38 HG22 ILE 38 -8.174 -6.677 0.124
277 HG23 ILE 38 HG23 ILE 38 -9.098 -6.648 -1.387
278 HD11 ILE 38 HD11 ILE 38 -6.838 -5.265 -0.416
279 HD12 ILE 38 HD12 ILE 38 -7.102 -4.209 0.977
280 HD13 ILE 38 HD13 ILE 38 -6.574 -3.529 -0.557
281 H GLY 39 HN GLY 39 -12.500 -3.147 -1.540
282 HA2 GLY 39 HA2 GLY 39 -13.799 -1.431 -0.783
283 HA3 GLY 39 HA1 GLY 39 -13.506 -1.979 0.858
284 H TYR 40 HN TYR 40 -10.660 -1.421 -0.924
285 HA TYR 40 HA TYR 40 -10.127 0.802 0.753
286 HB2 TYR 40 HB2 TYR 40 -8.474 -0.872 -0.987
287 HB3 TYR 40 HB1 TYR 40 -7.961 0.827 -0.876
288 HD1 TYR 40 HD2 TYR 40 -8.858 -2.118 1.219
289 HD2 TYR 40 HD1 TYR 40 -6.817 1.588 0.951
290 HE1 TYR 40 HE2 TYR 40 -7.915 -2.506 3.429
291 HE2 TYR 40 HE1 TYR 40 -5.870 1.245 3.178
292 HH TYR 40 HH TYR 40 -6.063 -1.723 4.801
293 H ASP 41 HN ASP 41 -10.412 2.669 0.512
294 HA ASP 41 HA ASP 41 -11.361 3.704 -2.047
295 HB2 ASP 41 HB2 ASP 41 -12.841 3.581 0.055
296 HB3 ASP 41 HB1 ASP 41 -11.786 4.836 0.707
297 H SER 42 HN SER 42 -11.030 6.336 -1.682
298 HA SER 42 HA SER 42 -8.398 6.784 -2.440
299 HB2 SER 42 HB2 SER 42 -9.047 9.175 -2.209
300 HB3 SER 42 HB1 SER 42 -10.224 8.210 -3.113
301 H LEU 43 HN LEU 43 -9.990 7.969 0.455
302 HA LEU 43 HA LEU 43 -7.830 9.053 1.805
303 HB2 LEU 43 HB2 LEU 43 -10.271 7.744 2.993
304 HB3 LEU 43 HB1 LEU 43 -9.123 8.715 3.895
305 HG LEU 43 HG LEU 43 -10.823 9.726 1.607
306 HD11 LEU 43 HD11 LEU 43 -12.094 10.891 3.341
307 HD12 LEU 43 HD12 LEU 43 -11.100 10.131 4.585
308 HD13 LEU 43 HD13 LEU 43 -12.159 9.146 3.576
309 HD21 LEU 43 HD21 LEU 43 -10.079 11.938 2.348
310 HD22 LEU 43 HD22 LEU 43 -8.710 10.933 1.864
311 HD23 LEU 43 HD23 LEU 43 -9.063 11.187 3.579
312 H ALA 44 HN ALA 44 -9.090 5.800 2.055
313 HA ALA 44 HA ALA 44 -7.484 4.869 4.099
314 HB1 ALA 44 HB1 ALA 44 -9.541 3.779 3.371
315 HB2 ALA 44 HB2 ALA 44 -8.183 2.648 3.417
316 HB3 ALA 44 HB3 ALA 44 -8.743 3.293 1.873
317 H LEU 45 HN LEU 45 -6.890 4.833 0.578
318 HA LEU 45 HA LEU 45 -4.539 3.207 0.811
319 HB2 LEU 45 HB2 LEU 45 -5.897 3.303 -1.197
320 HB3 LEU 45 HB1 LEU 45 -5.431 4.967 -1.445
321 HG LEU 45 HG LEU 45 -3.360 4.374 -2.368
322 HD11 LEU 45 HD11 LEU 45 -2.539 3.168 -0.340
323 HD12 LEU 45 HD12 LEU 45 -2.149 2.336 -1.841
324 HD13 LEU 45 HD13 LEU 45 -3.484 1.753 -0.821
325 HD21 LEU 45 HD21 LEU 45 -4.953 1.962 -2.469
326 HD22 LEU 45 HD22 LEU 45 -3.642 2.340 -3.606
327 HD23 LEU 45 HD23 LEU 45 -5.163 3.308 -3.610
328 H MET 46 HN MET 46 -5.159 6.619 0.984
329 HA MET 46 HA MET 46 -2.453 7.540 0.661
330 HB2 MET 46 HB2 MET 46 -4.472 8.923 2.456
331 HB3 MET 46 HB1 MET 46 -3.206 9.652 1.478
332 HG2 MET 46 HG2 MET 46 -4.471 8.850 -0.502
333 HG3 MET 46 HG1 MET 46 -5.696 8.383 0.670
334 HE1 MET 46 HE1 MET 46 -7.108 11.637 -1.127
335 HE2 MET 46 HE2 MET 46 -7.347 9.909 -0.882
336 HE3 MET 46 HE3 MET 46 -5.993 10.479 -1.851
337 H GLU 47 HN GLU 47 -4.527 6.628 3.225
338 HA GLU 47 HA GLU 47 -2.873 7.015 5.412
339 HB2 GLU 47 HB2 GLU 47 -5.290 5.688 4.629
340 HB3 GLU 47 HB1 GLU 47 -4.778 5.262 6.293
341 HG2 GLU 47 HG2 GLU 47 -4.756 7.863 6.519
342 HG3 GLU 47 HG1 GLU 47 -5.630 7.838 4.992
343 H THR 48 HN THR 48 -3.483 4.128 3.378
344 HA THR 48 HA THR 48 -1.855 2.242 4.569
345 HB THR 48 HB THR 48 -2.264 2.817 1.624
346 HG1 THR 48 HG1 THR 48 -3.742 1.281 3.493
347 HG21 THR 48 HG21 THR 48 -1.884 0.448 1.254
348 HG22 THR 48 HG22 THR 48 -1.561 0.197 2.974
349 HG23 THR 48 HG23 THR 48 -0.460 1.184 1.995
350 H ALA 49 HN ALA 49 -1.074 4.566 2.042
351 HA ALA 49 HA ALA 49 1.611 3.958 1.746
352 HB1 ALA 49 HB1 ALA 49 1.837 6.091 0.594
353 HB2 ALA 49 HB2 ALA 49 0.288 6.622 1.248
354 HB3 ALA 49 HB3 ALA 49 0.352 5.271 0.110
355 H ALA 50 HN ALA 50 0.041 6.445 3.758
356 HA ALA 50 HA ALA 50 2.263 7.747 4.764
357 HB1 ALA 50 HB1 ALA 50 -0.054 8.533 5.041
358 HB2 ALA 50 HB2 ALA 50 0.842 8.533 6.557
359 HB3 ALA 50 HB3 ALA 50 -0.331 7.259 6.233
360 H ARG 51 HN ARG 51 0.689 4.849 6.014
361 HA ARG 51 HA ARG 51 2.189 4.526 8.386
362 HB2 ARG 51 HB2 ARG 51 0.067 3.316 7.918
363 HB3 ARG 51 HB1 ARG 51 0.831 2.454 6.611
364 HG2 ARG 51 HG2 ARG 51 1.656 2.103 9.513
365 HG3 ARG 51 HG1 ARG 51 0.388 1.145 8.750
366 HD2 ARG 51 HD2 ARG 51 2.119 0.469 7.027
367 HD3 ARG 51 HD1 ARG 51 3.323 1.235 8.055
368 HE ARG 51 HE ARG 51 1.903 -0.617 9.615
369 HH11 ARG 51 HH11 ARG 51 4.204 -0.568 6.942
370 HH12 ARG 51 HH12 ARG 51 4.717 -2.184 7.089
371 HH21 ARG 51 HH21 ARG 51 2.591 -2.858 9.874
372 HH22 ARG 51 HH22 ARG 51 3.824 -3.520 8.863
373 H LEU 52 HN LEU 52 2.828 3.735 5.079
374 HA LEU 52 HA LEU 52 5.134 2.130 5.705
375 HB2 LEU 52 HB2 LEU 52 4.234 3.179 3.029
376 HB3 LEU 52 HB1 LEU 52 5.402 1.911 3.320
377 HG LEU 52 HG LEU 52 2.442 1.769 3.885
378 HD11 LEU 52 HD11 LEU 52 2.948 1.601 1.551
379 HD12 LEU 52 HD12 LEU 52 2.431 0.042 2.190
380 HD13 LEU 52 HD13 LEU 52 4.138 0.338 1.877
381 HD21 LEU 52 HD21 LEU 52 2.908 -0.613 4.434
382 HD22 LEU 52 HD22 LEU 52 3.539 0.546 5.590
383 HD23 LEU 52 HD23 LEU 52 4.636 -0.229 4.462
384 H GLU 53 HN GLU 53 4.458 5.343 4.402
385 HA GLU 53 HA GLU 53 7.033 6.195 3.757
386 HB2 GLU 53 HB2 GLU 53 4.790 7.853 4.922
387 HB3 GLU 53 HB1 GLU 53 6.217 8.480 4.124
388 HG2 GLU 53 HG2 GLU 53 5.502 7.543 2.031
389 HG3 GLU 53 HG1 GLU 53 4.111 6.777 2.820
390 H SER 54 HN SER 54 5.263 6.700 6.806
391 HA SER 54 HA SER 54 7.372 8.073 8.063
392 HB2 SER 54 HB2 SER 54 5.040 6.685 9.376
393 HB3 SER 54 HB1 SER 54 5.962 8.059 9.987
394 HG SER 54 HG SER 54 3.864 8.029 8.351
395 H ARG 55 HN ARG 55 6.657 4.671 7.819
396 HA ARG 55 HA ARG 55 8.416 4.059 10.038
397 HB2 ARG 55 HB2 ARG 55 6.393 2.711 9.785
398 HB3 ARG 55 HB1 ARG 55 6.939 2.166 8.201
399 HG2 ARG 55 HG2 ARG 55 8.850 1.062 9.229
400 HG3 ARG 55 HG1 ARG 55 8.330 1.625 10.815
401 HD2 ARG 55 HD2 ARG 55 6.325 0.316 10.685
402 HD3 ARG 55 HD1 ARG 55 6.698 -0.161 9.024
403 HE ARG 55 HE ARG 55 8.572 -0.819 11.158
404 HH11 ARG 55 HH11 ARG 55 6.097 -1.924 8.921
405 HH12 ARG 55 HH12 ARG 55 6.567 -3.543 8.836
406 HH21 ARG 55 HH21 ARG 55 9.287 -3.089 11.140
407 HH22 ARG 55 HH22 ARG 55 8.503 -4.249 10.171
408 H TYR 56 HN TYR 56 8.511 3.865 6.517
409 HA TYR 56 HA TYR 56 11.110 2.589 6.716
410 HB2 TYR 56 HB2 TYR 56 9.242 2.926 4.388
411 HB3 TYR 56 HB1 TYR 56 10.884 2.306 4.212
412 HD1 TYR 56 HD2 TYR 56 7.621 1.685 5.806
413 HD2 TYR 56 HD1 TYR 56 11.406 0.045 4.799
414 HE1 TYR 56 HE2 TYR 56 6.794 -0.562 6.379
415 HE2 TYR 56 HE1 TYR 56 10.594 -2.206 5.361
416 HH TYR 56 HH TYR 56 8.916 -3.292 6.589
417 H GLY 57 HN GLY 57 9.756 5.669 5.869
418 HA2 GLY 57 HA2 GLY 57 11.057 7.608 5.903
419 HA3 GLY 57 HA1 GLY 57 12.487 6.645 5.553
420 H VAL 58 HN VAL 58 9.331 6.958 3.962
421 HA VAL 58 HA VAL 58 10.719 7.870 1.563
422 HB VAL 58 HB VAL 58 9.317 6.504 0.081
423 HG11 VAL 58 HG11 VAL 58 10.202 4.280 0.526
424 HG12 VAL 58 HG12 VAL 58 10.613 4.790 2.165
425 HG13 VAL 58 HG13 VAL 58 11.427 5.535 0.782
426 HG21 VAL 58 HG21 VAL 58 7.305 6.311 1.449
427 HG22 VAL 58 HG22 VAL 58 8.164 5.252 2.579
428 HG23 VAL 58 HG23 VAL 58 7.862 4.726 0.916
429 H SER 59 HN SER 59 8.624 8.369 -0.102
430 HA SER 59 HA SER 59 6.510 9.650 1.339
431 HB2 SER 59 HB2 SER 59 8.419 11.255 -0.401
432 HB3 SER 59 HB1 SER 59 6.922 11.865 0.301
433 HG SER 59 HG SER 59 8.281 10.786 2.233
434 H ILE 60 HN ILE 60 4.727 9.445 0.186
435 HA ILE 60 HA ILE 60 4.902 9.186 -2.723
436 HB ILE 60 HB ILE 60 3.198 7.377 -0.958
437 HG12 ILE 60 HG12 ILE 60 5.473 6.663 -2.837
438 HG13 ILE 60 HG11 ILE 60 5.594 6.686 -1.084
439 HG21 ILE 60 HG21 ILE 60 2.028 8.044 -2.999
440 HG22 ILE 60 HG22 ILE 60 2.453 6.326 -3.048
441 HG23 ILE 60 HG23 ILE 60 3.395 7.493 -3.978
442 HD11 ILE 60 HD11 ILE 60 3.831 4.884 -2.724
443 HD12 ILE 60 HD12 ILE 60 3.918 4.905 -0.963
444 HD13 ILE 60 HD13 ILE 60 5.331 4.422 -1.913
445 HA PRO 61 HA PRO 61 1.779 12.381 -2.096
446 HB2 PRO 61 HB2 PRO 61 1.730 12.194 -5.059
447 HB3 PRO 61 HB1 PRO 61 1.964 13.615 -4.026
448 HG2 PRO 61 HG2 PRO 61 4.000 12.550 -5.390
449 HG3 PRO 61 HG1 PRO 61 4.220 13.213 -3.756
450 HD2 PRO 61 HD2 PRO 61 3.985 10.364 -4.641
451 HD3 PRO 61 HD1 PRO 61 5.059 11.076 -3.413
452 H ASP 62 HN ASP 62 -0.425 12.268 -2.179
453 HA ASP 62 HA ASP 62 -1.635 9.744 -2.468
454 HB2 ASP 62 HB2 ASP 62 -3.818 10.984 -2.172
455 HB3 ASP 62 HB1 ASP 62 -2.634 11.214 -0.899
456 H ASP 63 HN ASP 63 -1.259 12.355 -4.705
457 HA ASP 63 HA ASP 63 -3.096 11.615 -6.683
458 HB2 ASP 63 HB2 ASP 63 -1.849 13.720 -6.820
459 HB3 ASP 63 HB1 ASP 63 -0.344 12.822 -6.992
460 H VAL 64 HN VAL 64 0.026 10.357 -5.867
461 HA VAL 64 HA VAL 64 0.249 8.670 -8.206
462 HB VAL 64 HB VAL 64 1.916 8.699 -5.677
463 HG11 VAL 64 HG11 VAL 64 2.215 6.659 -6.941
464 HG12 VAL 64 HG12 VAL 64 3.656 7.665 -7.068
465 HG13 VAL 64 HG13 VAL 64 2.520 7.582 -8.411
466 HG21 VAL 64 HG21 VAL 64 1.960 10.888 -6.703
467 HG22 VAL 64 HG22 VAL 64 2.351 10.169 -8.270
468 HG23 VAL 64 HG23 VAL 64 3.511 10.079 -6.944
469 H ALA 65 HN ALA 65 -0.363 8.319 -4.731
470 HA ALA 65 HA ALA 65 -0.413 5.565 -4.503
471 HB1 ALA 65 HB1 ALA 65 -2.025 7.597 -2.986
472 HB2 ALA 65 HB2 ALA 65 -0.381 7.088 -2.610
473 HB3 ALA 65 HB3 ALA 65 -1.728 5.933 -2.496
474 H GLY 66 HN GLY 66 -3.024 7.785 -5.418
475 HA2 GLY 66 HA2 GLY 66 -4.974 5.668 -5.478
476 HA3 GLY 66 HA1 GLY 66 -5.224 7.333 -5.978
477 H ARG 67 HN ARG 67 -2.522 5.716 -7.383
478 HA ARG 67 HA ARG 67 -4.068 5.379 -9.833
479 HB2 ARG 67 HB2 ARG 67 -1.165 5.994 -9.422
480 HB3 ARG 67 HB1 ARG 67 -1.864 5.562 -10.972
481 HG2 ARG 67 HG2 ARG 67 -3.357 7.525 -10.797
482 HG3 ARG 67 HG1 ARG 67 -2.556 7.967 -9.293
483 HD2 ARG 67 HD2 ARG 67 -1.635 9.222 -11.156
484 HD3 ARG 67 HD1 ARG 67 -0.427 8.140 -10.464
485 HE ARG 67 HE ARG 67 -1.706 6.782 -12.521
486 HH11 ARG 67 HH11 ARG 67 0.467 9.582 -12.159
487 HH12 ARG 67 HH12 ARG 67 1.147 9.389 -13.716
488 HH21 ARG 67 HH21 ARG 67 -0.684 6.507 -14.613
489 HH22 ARG 67 HH22 ARG 67 0.498 7.629 -15.122
490 H VAL 68 HN VAL 68 -2.545 3.588 -7.393
491 HA VAL 68 HA VAL 68 -1.634 1.602 -9.240
492 HB VAL 68 HB VAL 68 -1.013 0.197 -7.275
493 HG11 VAL 68 HG11 VAL 68 0.101 3.001 -7.343
494 HG12 VAL 68 HG12 VAL 68 0.608 1.652 -8.352
495 HG13 VAL 68 HG13 VAL 68 0.895 1.608 -6.615
496 HG21 VAL 68 HG21 VAL 68 -1.858 2.633 -5.702
497 HG22 VAL 68 HG22 VAL 68 -0.879 1.315 -5.070
498 HG23 VAL 68 HG23 VAL 68 -2.544 1.003 -5.581
499 H ASP 69 HN ASP 69 -2.314 -0.523 -9.377
500 HA ASP 69 HA ASP 69 -5.274 -0.698 -9.234
501 HB2 ASP 69 HB2 ASP 69 -4.014 -0.893 -11.475
502 HB3 ASP 69 HB1 ASP 69 -3.277 -2.322 -10.808
503 H THR 70 HN THR 70 -2.322 -2.441 -8.931
504 HA THR 70 HA THR 70 -3.572 -4.428 -7.179
505 HB THR 70 HB THR 70 -1.814 -5.976 -8.055
506 HG1 THR 70 HG1 THR 70 -1.197 -3.641 -9.508
507 HG21 THR 70 HG21 THR 70 -3.587 -4.711 -10.138
508 HG22 THR 70 HG22 THR 70 -4.094 -5.936 -8.975
509 HG23 THR 70 HG23 THR 70 -2.906 -6.342 -10.228
510 HA PRO 71 HA PRO 71 -0.930 -3.243 -3.871
511 HB2 PRO 71 HB2 PRO 71 -0.312 -6.148 -3.575
512 HB3 PRO 71 HB1 PRO 71 -0.919 -5.001 -2.368
513 HG2 PRO 71 HG2 PRO 71 -2.537 -6.780 -3.476
514 HG3 PRO 71 HG1 PRO 71 -3.097 -5.114 -3.205
515 HD2 PRO 71 HD2 PRO 71 -2.204 -6.460 -5.704
516 HD3 PRO 71 HD1 PRO 71 -3.535 -5.312 -5.464
517 H ARG 72 HN ARG 72 0.373 -5.530 -6.187
518 HA ARG 72 HA ARG 72 3.072 -5.514 -5.366
519 HB2 ARG 72 HB2 ARG 72 3.617 -6.446 -7.549
520 HB3 ARG 72 HB1 ARG 72 2.194 -7.228 -6.880
521 HG2 ARG 72 HG2 ARG 72 0.764 -5.988 -8.361
522 HG3 ARG 72 HG1 ARG 72 2.139 -5.058 -8.965
523 HD2 ARG 72 HD2 ARG 72 1.669 -6.751 -10.561
524 HD3 ARG 72 HD1 ARG 72 3.152 -7.202 -9.732
525 HE ARG 72 HE ARG 72 0.508 -8.398 -9.231
526 HH11 ARG 72 HH11 ARG 72 4.056 -8.712 -8.960
527 HH12 ARG 72 HH12 ARG 72 4.052 -10.388 -9.085
528 HH21 ARG 72 HH21 ARG 72 0.525 -10.786 -9.322
529 HH22 ARG 72 HH22 ARG 72 2.030 -11.581 -9.271
530 H GLU 73 HN GLU 73 1.267 -3.226 -7.221
531 HA GLU 73 HA GLU 73 3.544 -1.862 -8.323
532 HB2 GLU 73 HB2 GLU 73 0.665 -1.013 -8.067
533 HB3 GLU 73 HB1 GLU 73 1.880 -0.279 -9.111
534 HG2 GLU 73 HG2 GLU 73 2.038 -2.234 -10.433
535 HG3 GLU 73 HG1 GLU 73 1.049 -3.148 -9.300
536 H LEU 74 HN LEU 74 1.539 -1.694 -5.504
537 HA LEU 74 HA LEU 74 2.318 0.894 -4.652
538 HB2 LEU 74 HB2 LEU 74 0.274 -0.445 -3.881
539 HB3 LEU 74 HB1 LEU 74 1.353 -1.413 -2.912
540 HG LEU 74 HG LEU 74 0.115 0.289 -1.552
541 HD11 LEU 74 HD11 LEU 74 2.186 -0.517 -0.742
542 HD12 LEU 74 HD12 LEU 74 1.948 1.187 -0.322
543 HD13 LEU 74 HD13 LEU 74 3.045 0.737 -1.639
544 HD21 LEU 74 HD21 LEU 74 0.667 2.637 -1.766
545 HD22 LEU 74 HD22 LEU 74 -0.066 2.034 -3.246
546 HD23 LEU 74 HD23 LEU 74 1.675 2.292 -3.171
547 H LEU 75 HN LEU 75 3.461 -2.416 -4.135
548 HA LEU 75 HA LEU 75 5.622 -2.064 -2.381
549 HB2 LEU 75 HB2 LEU 75 5.133 -3.931 -4.653
550 HB3 LEU 75 HB1 LEU 75 6.730 -3.854 -3.969
551 HG LEU 75 HG LEU 75 5.592 -5.660 -3.183
552 HD11 LEU 75 HD11 LEU 75 5.702 -5.266 -0.695
553 HD12 LEU 75 HD12 LEU 75 5.787 -3.547 -1.023
554 HD13 LEU 75 HD13 LEU 75 7.080 -4.614 -1.583
555 HD21 LEU 75 HD21 LEU 75 3.572 -5.546 -1.743
556 HD22 LEU 75 HD22 LEU 75 3.300 -5.074 -3.420
557 HD23 LEU 75 HD23 LEU 75 3.431 -3.841 -2.167
558 H ASP 76 HN ASP 76 5.474 -1.828 -5.812
559 HA ASP 76 HA ASP 76 8.192 -1.275 -6.360
560 HB2 ASP 76 HB2 ASP 76 6.728 -1.958 -8.172
561 HB3 ASP 76 HB1 ASP 76 5.762 -0.500 -7.978
562 H LEU 77 HN LEU 77 5.470 0.880 -5.905
563 HA LEU 77 HA LEU 77 6.677 3.347 -6.224
564 HB2 LEU 77 HB2 LEU 77 4.594 2.462 -4.264
565 HB3 LEU 77 HB1 LEU 77 5.038 4.130 -4.475
566 HG LEU 77 HG LEU 77 3.717 2.305 -6.474
567 HD11 LEU 77 HD11 LEU 77 1.853 3.884 -6.277
568 HD12 LEU 77 HD12 LEU 77 2.766 4.785 -5.051
569 HD13 LEU 77 HD13 LEU 77 2.251 3.136 -4.729
570 HD21 LEU 77 HD21 LEU 77 4.560 5.186 -6.824
571 HD22 LEU 77 HD22 LEU 77 3.630 4.236 -7.981
572 HD23 LEU 77 HD23 LEU 77 5.304 3.794 -7.614
573 H ILE 78 HN ILE 78 6.432 1.397 -3.298
574 HA ILE 78 HA ILE 78 7.966 3.044 -1.591
575 HB ILE 78 HB ILE 78 7.516 0.049 -1.499
576 HG12 ILE 78 HG12 ILE 78 5.437 1.355 -1.375
577 HG13 ILE 78 HG11 ILE 78 5.771 0.528 0.138
578 HG21 ILE 78 HG21 ILE 78 8.561 1.886 0.663
579 HG22 ILE 78 HG22 ILE 78 9.468 0.633 -0.179
580 HG23 ILE 78 HG23 ILE 78 8.128 0.187 0.885
581 HD11 ILE 78 HD11 ILE 78 6.232 3.450 -0.432
582 HD12 ILE 78 HD12 ILE 78 6.601 2.641 1.083
583 HD13 ILE 78 HD13 ILE 78 4.925 2.763 0.536
584 H ASN 79 HN ASN 79 8.799 0.049 -3.295
585 HA ASN 79 HA ASN 79 11.461 -0.215 -2.575
586 HB2 ASN 79 HB2 ASN 79 9.946 -1.124 -4.996
587 HB3 ASN 79 HB1 ASN 79 11.681 -1.383 -4.904
588 HD21 ASN 79 HD21 ASN 79 9.774 -1.542 -1.976
589 HD22 ASN 79 HD22 ASN 79 9.791 -3.257 -1.824
590 H GLY 80 HN GLY 80 10.153 1.514 -5.383
591 HA2 GLY 80 HA2 GLY 80 12.572 2.277 -6.520
592 HA3 GLY 80 HA1 GLY 80 11.044 3.118 -6.696
593 H ALA 81 HN ALA 81 10.463 4.112 -4.320
594 HA ALA 81 HA ALA 81 12.162 6.364 -4.092
595 HB1 ALA 81 HB1 ALA 81 10.714 7.050 -2.256
596 HB2 ALA 81 HB2 ALA 81 10.003 5.436 -2.196
597 HB3 ALA 81 HB3 ALA 81 9.755 6.454 -3.611
598 H LEU 82 HN LEU 82 11.902 3.383 -2.259
599 HA LEU 82 HA LEU 82 13.498 4.217 -0.096
600 HB2 LEU 82 HB2 LEU 82 11.792 2.484 0.024
601 HB3 LEU 82 HB1 LEU 82 12.702 1.508 -1.107
602 HG LEU 82 HG LEU 82 14.471 1.295 0.485
603 HD11 LEU 82 HD11 LEU 82 14.183 3.380 1.754
604 HD12 LEU 82 HD12 LEU 82 14.119 2.002 2.857
605 HD13 LEU 82 HD13 LEU 82 12.629 2.805 2.366
606 HD21 LEU 82 HD21 LEU 82 12.718 -0.367 0.379
607 HD22 LEU 82 HD22 LEU 82 11.761 0.546 1.544
608 HD23 LEU 82 HD23 LEU 82 13.285 -0.187 2.039
609 H ALA 83 HN ALA 83 14.129 2.669 -3.195
610 HA ALA 83 HA ALA 83 16.814 1.977 -2.622
611 HB1 ALA 83 HB1 ALA 83 15.536 0.917 -4.438
612 HB2 ALA 83 HB2 ALA 83 17.035 1.619 -5.033
613 HB3 ALA 83 HB3 ALA 83 15.501 2.449 -5.309
614 H GLU 84 HN GLU 84 15.193 4.892 -3.578
615 HA GLU 84 HA GLU 84 17.495 6.294 -4.471
616 HB2 GLU 84 HB2 GLU 84 14.727 7.175 -3.644
617 HB3 GLU 84 HB1 GLU 84 15.946 8.213 -4.349
618 HG2 GLU 84 HG2 GLU 84 14.747 5.810 -5.709
619 HG3 GLU 84 HG1 GLU 84 14.200 7.464 -5.941
620 H ALA 85 HN ALA 85 15.738 5.784 -1.505
621 HA ALA 85 HA ALA 85 17.052 7.900 -0.052
622 HB1 ALA 85 HB1 ALA 85 15.749 7.153 1.843
623 HB2 ALA 85 HB2 ALA 85 15.271 5.700 0.979
624 HB3 ALA 85 HB3 ALA 85 14.718 7.270 0.412
625 H ALA 86 HN ALA 86 17.535 4.502 -0.546
626 HA ALA 86 HA ALA 86 19.788 4.617 1.317
627 HB1 ALA 86 HB1 ALA 86 18.066 2.214 0.684
628 HB2 ALA 86 HB2 ALA 86 18.019 3.139 2.183
629 HB3 ALA 86 HB3 ALA 86 19.472 2.231 1.754
630 H28A SDO 101 H28A SDO 42 -11.063 11.800 -0.110
631 H28B SDO 101 H28B SDO 42 -9.620 10.978 -0.709
632 H30A SDO 101 H30A SDO 42 -8.311 12.941 0.030
633 H30B SDO 101 H30B SDO 42 -9.801 13.734 0.541
634 H30C SDO 101 H30C SDO 42 -8.713 14.549 -0.575
635 H31A SDO 101 H31A SDO 42 -8.057 12.132 -2.229
636 H31B SDO 101 H31B SDO 42 -8.489 13.687 -2.943
637 H31C SDO 101 H31C SDO 42 -9.373 12.223 -3.407
638 H32A SDO 101 H32A SDO 42 -11.600 13.400 -2.680
639 H33A SDO 101 H33A SDO 42 -9.808 15.503 -2.071
640 H36A SDO 101 H36A SDO 42 -12.160 16.073 -1.714
641 H37A SDO 101 H37A SDO 42 -14.335 16.306 -0.560
642 H37B SDO 101 H37B SDO 42 -13.621 15.434 0.800
643 H38A SDO 101 H38A SDO 42 -12.667 18.133 -0.229
644 H38B SDO 101 H38B SDO 42 -13.892 17.942 0.978
645 H41A SDO 101 H41A SDO 42 -11.436 15.602 1.089
646 H42A SDO 101 H42A SDO 42 -10.426 16.605 3.627
647 H42B SDO 101 H42B SDO 42 -10.232 14.966 2.987
648 H43A SDO 101 H43A SDO 42 -8.878 17.443 1.968
649 H43B SDO 101 H43B SDO 42 -8.661 15.833 1.319
650 H1A SDO 101 H1A SDO 42 -7.110 14.514 5.008
651 H1B SDO 101 H1B SDO 42 -7.316 16.131 5.636
652 H2A SDO 101 H2A SDO 42 -9.505 14.390 4.589
653 H2B SDO 101 H2B SDO 42 -9.699 15.983 5.265
654 H4A SDO 101 H4A SDO 42 -8.441 13.076 8.134
655 H4B SDO 101 H4B SDO 42 -8.606 14.693 8.767
656 H5A SDO 101 H5A SDO 42 -6.739 15.444 7.358
657 H5B SDO 101 H5B SDO 42 -6.501 13.768 6.853
658 H6A SDO 101 H6A SDO 42 -6.120 13.105 9.162
659 H6B SDO 101 H6B SDO 42 -6.421 14.750 9.706
660 H8A SDO 101 H8A SDO 42 -4.333 14.316 6.614
661 H8B SDO 101 H8B SDO 42 -2.964 15.084 7.423
662 H8C SDO 101 H8C SDO 42 -4.482 15.974 7.218
Start of MODEL 4
1 H1 MET 1 HT1 MET 1 17.870 -3.094 1.009
2 H2 MET 1 HT2 MET 1 16.987 -4.061 -0.109
3 H3 MET 1 HT3 MET 1 18.488 -3.460 -0.511
4 HA MET 1 HA MET 1 18.350 -5.829 0.136
5 HB2 MET 1 HB2 MET 1 20.492 -4.640 0.103
6 HB3 MET 1 HB1 MET 1 20.199 -4.030 1.728
7 HG2 MET 1 HG2 MET 1 20.277 -6.342 2.580
8 HG3 MET 1 HG1 MET 1 20.627 -6.910 0.949
9 HE1 MET 1 HE1 MET 1 22.899 -6.365 -0.362
10 HE2 MET 1 HE2 MET 1 24.150 -5.292 0.264
11 HE3 MET 1 HE3 MET 1 22.563 -4.649 -0.164
12 H ALA 2 HN ALA 2 18.877 -4.158 3.289
13 HA ALA 2 HA ALA 2 17.228 -6.232 4.470
14 HB1 ALA 2 HB1 ALA 2 18.821 -4.060 5.825
15 HB2 ALA 2 HB2 ALA 2 19.400 -5.692 5.489
16 HB3 ALA 2 HB3 ALA 2 18.062 -5.439 6.615
17 H THR 3 HN THR 3 17.185 -2.719 4.075
18 HA THR 3 HA THR 3 14.612 -2.742 5.383
19 HB THR 3 HB THR 3 16.027 -0.947 6.166
20 HG1 THR 3 HG1 THR 3 14.628 0.904 4.974
21 HG21 THR 3 HG21 THR 3 16.856 0.880 4.717
22 HG22 THR 3 HG22 THR 3 16.264 -0.003 3.303
23 HG23 THR 3 HG23 THR 3 17.564 -0.677 4.289
24 H LEU 4 HN LEU 4 13.447 -3.865 3.948
25 HA LEU 4 HA LEU 4 12.642 -2.354 1.617
26 HB2 LEU 4 HB2 LEU 4 14.285 -4.026 0.856
27 HB3 LEU 4 HB1 LEU 4 13.297 -5.314 1.553
28 HG LEU 4 HG LEU 4 11.501 -4.599 -0.055
29 HD11 LEU 4 HD11 LEU 4 12.278 -2.344 -0.476
30 HD12 LEU 4 HD12 LEU 4 12.180 -3.254 -1.986
31 HD13 LEU 4 HD13 LEU 4 13.747 -2.964 -1.231
32 HD21 LEU 4 HD21 LEU 4 12.884 -6.552 -0.504
33 HD22 LEU 4 HD22 LEU 4 14.127 -5.522 -1.217
34 HD23 LEU 4 HD23 LEU 4 12.558 -5.681 -2.004
35 H LEU 5 HN LEU 5 10.514 -2.787 1.045
36 HA LEU 5 HA LEU 5 8.921 -3.899 3.231
37 HB2 LEU 5 HB2 LEU 5 8.684 -1.509 2.266
38 HB3 LEU 5 HB1 LEU 5 7.998 -2.281 0.859
39 HG LEU 5 HG LEU 5 6.819 -2.405 3.647
40 HD11 LEU 5 HD11 LEU 5 6.157 -0.726 1.266
41 HD12 LEU 5 HD12 LEU 5 6.781 -0.162 2.819
42 HD13 LEU 5 HD13 LEU 5 5.157 -0.854 2.705
43 HD21 LEU 5 HD21 LEU 5 5.625 -3.131 0.977
44 HD22 LEU 5 HD22 LEU 5 4.798 -3.161 2.537
45 HD23 LEU 5 HD23 LEU 5 6.128 -4.276 2.223
46 H THR 6 HN THR 6 7.879 -5.807 2.862
47 HA THR 6 HA THR 6 7.939 -6.900 0.152
48 HB THR 6 HB THR 6 7.863 -9.116 1.362
49 HG1 THR 6 HG1 THR 6 8.858 -8.424 3.718
50 HG21 THR 6 HG21 THR 6 9.989 -8.215 0.482
51 HG22 THR 6 HG22 THR 6 10.259 -9.094 1.981
52 HG23 THR 6 HG23 THR 6 10.235 -7.329 1.987
53 H THR 7 HN THR 7 6.206 -8.853 0.146
54 HA THR 7 HA THR 7 3.624 -7.707 0.314
55 HB THR 7 HB THR 7 4.330 -10.658 0.116
56 HG1 THR 7 HG1 THR 7 4.489 -10.293 -2.139
57 HG21 THR 7 HG21 THR 7 2.268 -10.778 -1.233
58 HG22 THR 7 HG22 THR 7 2.014 -9.050 -1.002
59 HG23 THR 7 HG23 THR 7 1.932 -10.145 0.380
60 H ASP 8 HN ASP 8 5.640 -9.487 2.418
61 HA ASP 8 HA ASP 8 3.788 -10.641 4.238
62 HB2 ASP 8 HB2 ASP 8 6.160 -11.343 3.984
63 HB3 ASP 8 HB1 ASP 8 6.668 -9.804 4.645
64 H ASP 9 HN ASP 9 5.676 -7.665 4.189
65 HA ASP 9 HA ASP 9 4.716 -6.762 6.723
66 HB2 ASP 9 HB2 ASP 9 6.941 -6.099 5.767
67 HB3 ASP 9 HB1 ASP 9 6.084 -5.094 4.613
68 H LEU 10 HN LEU 10 3.987 -5.976 3.362
69 HA LEU 10 HA LEU 10 2.245 -3.835 3.863
70 HB2 LEU 10 HB2 LEU 10 3.075 -4.298 1.611
71 HB3 LEU 10 HB1 LEU 10 2.112 -5.770 1.550
72 HG LEU 10 HG LEU 10 0.079 -4.310 1.901
73 HD11 LEU 10 HD11 LEU 10 1.990 -2.107 1.215
74 HD12 LEU 10 HD12 LEU 10 1.107 -2.326 2.727
75 HD13 LEU 10 HD13 LEU 10 0.230 -1.970 1.239
76 HD21 LEU 10 HD21 LEU 10 0.581 -5.293 -0.258
77 HD22 LEU 10 HD22 LEU 10 1.639 -3.935 -0.648
78 HD23 LEU 10 HD23 LEU 10 -0.092 -3.673 -0.453
79 H ARG 11 HN ARG 11 1.687 -7.291 3.859
80 HA ARG 11 HA ARG 11 -1.071 -7.356 3.772
81 HB2 ARG 11 HB2 ARG 11 0.437 -9.330 3.687
82 HB3 ARG 11 HB1 ARG 11 0.738 -9.127 5.396
83 HG2 ARG 11 HG2 ARG 11 -1.384 -9.808 6.010
84 HG3 ARG 11 HG1 ARG 11 -2.047 -9.513 4.399
85 HD2 ARG 11 HD2 ARG 11 -1.764 -11.911 4.858
86 HD3 ARG 11 HD1 ARG 11 -0.781 -11.361 3.501
87 HE ARG 11 HE ARG 11 0.359 -11.597 6.184
88 HH11 ARG 11 HH11 ARG 11 0.363 -12.573 2.746
89 HH12 ARG 11 HH12 ARG 11 1.755 -13.528 2.887
90 HH21 ARG 11 HH21 ARG 11 2.281 -12.846 6.342
91 HH22 ARG 11 HH22 ARG 11 2.937 -13.665 5.000
92 H ARG 12 HN ARG 12 1.009 -6.881 6.543
93 HA ARG 12 HA ARG 12 -1.218 -6.639 8.359
94 HB2 ARG 12 HB2 ARG 12 1.726 -6.069 8.738
95 HB3 ARG 12 HB1 ARG 12 0.525 -6.070 10.030
96 HG2 ARG 12 HG2 ARG 12 0.092 -8.405 9.692
97 HG3 ARG 12 HG1 ARG 12 1.147 -8.435 8.284
98 HD2 ARG 12 HD2 ARG 12 3.056 -7.869 9.746
99 HD3 ARG 12 HD1 ARG 12 1.972 -7.940 11.142
100 HE ARG 12 HE ARG 12 1.708 -10.249 10.802
101 HH11 ARG 12 HH11 ARG 12 4.152 -8.782 8.734
102 HH12 ARG 12 HH12 ARG 12 4.906 -10.209 8.250
103 HH21 ARG 12 HH21 ARG 12 2.704 -12.306 10.167
104 HH22 ARG 12 HH22 ARG 12 4.063 -12.325 9.160
105 H ALA 13 HN ALA 13 1.003 -4.516 6.698
106 HA ALA 13 HA ALA 13 0.434 -2.083 7.920
107 HB1 ALA 13 HB1 ALA 13 1.357 -1.077 5.914
108 HB2 ALA 13 HB2 ALA 13 1.212 -2.625 5.074
109 HB3 ALA 13 HB3 ALA 13 2.319 -2.463 6.440
110 H LEU 14 HN LEU 14 -1.066 -3.657 5.171
111 HA LEU 14 HA LEU 14 -2.675 -1.518 4.340
112 HB2 LEU 14 HB2 LEU 14 -1.995 -3.725 3.146
113 HB3 LEU 14 HB1 LEU 14 -3.356 -4.425 3.988
114 HG LEU 14 HG LEU 14 -4.855 -2.827 2.845
115 HD11 LEU 14 HD11 LEU 14 -3.282 -1.027 2.446
116 HD12 LEU 14 HD12 LEU 14 -3.993 -1.571 0.920
117 HD13 LEU 14 HD13 LEU 14 -2.352 -2.056 1.359
118 HD21 LEU 14 HD21 LEU 14 -3.107 -4.462 1.021
119 HD22 LEU 14 HD22 LEU 14 -4.738 -3.886 0.655
120 HD23 LEU 14 HD23 LEU 14 -4.481 -5.062 1.946
121 H VAL 15 HN VAL 15 -3.192 -4.208 6.545
122 HA VAL 15 HA VAL 15 -5.913 -3.871 7.183
123 HB VAL 15 HB VAL 15 -3.630 -4.887 8.908
124 HG11 VAL 15 HG11 VAL 15 -6.614 -5.301 9.250
125 HG12 VAL 15 HG12 VAL 15 -5.599 -4.289 10.270
126 HG13 VAL 15 HG13 VAL 15 -5.353 -6.038 10.238
127 HG21 VAL 15 HG21 VAL 15 -3.902 -6.158 6.855
128 HG22 VAL 15 HG22 VAL 15 -5.617 -6.374 7.198
129 HG23 VAL 15 HG23 VAL 15 -4.411 -7.117 8.245
130 H GLU 16 HN GLU 16 -3.038 -2.824 9.009
131 HA GLU 16 HA GLU 16 -4.081 -1.285 11.005
132 HB2 GLU 16 HB2 GLU 16 -1.614 -0.721 9.360
133 HB3 GLU 16 HB1 GLU 16 -1.962 -0.050 10.950
134 HG2 GLU 16 HG2 GLU 16 -1.885 -2.282 11.908
135 HG3 GLU 16 HG1 GLU 16 -1.585 -2.965 10.326
136 H SER 17 HN SER 17 -3.667 -0.403 7.654
137 HA SER 17 HA SER 17 -4.218 2.392 8.138
138 HB2 SER 17 HB2 SER 17 -3.636 0.915 5.600
139 HB3 SER 17 HB1 SER 17 -3.575 2.665 5.856
140 HG SER 17 HG SER 17 -1.856 0.658 6.746
141 H ALA 18 HN ALA 18 -6.123 -0.313 7.624
142 HA ALA 18 HA ALA 18 -8.119 1.120 6.039
143 HB1 ALA 18 HB1 ALA 18 -8.126 -1.715 7.073
144 HB2 ALA 18 HB2 ALA 18 -7.652 -1.222 5.446
145 HB3 ALA 18 HB3 ALA 18 -9.321 -1.002 5.990
146 H GLY 19 HN GLY 19 -7.205 0.805 9.149
147 HA2 GLY 19 HA2 GLY 19 -8.202 1.544 11.096
148 HA3 GLY 19 HA1 GLY 19 -9.695 1.817 10.192
149 H GLU 20 HN GLU 20 -11.149 0.195 9.931
150 HA GLU 20 HA GLU 20 -10.658 -2.458 10.637
151 HB2 GLU 20 HB2 GLU 20 -10.720 -1.602 12.926
152 HB3 GLU 20 HB1 GLU 20 -12.301 -0.879 12.615
153 HG2 GLU 20 HG2 GLU 20 -13.324 -2.990 12.409
154 HG3 GLU 20 HG1 GLU 20 -11.764 -3.818 12.398
155 H THR 21 HN THR 21 -11.959 -3.643 9.549
156 HA THR 21 HA THR 21 -14.682 -3.285 9.191
157 HB THR 21 HB THR 21 -14.042 -1.398 7.663
158 HG1 THR 21 HG1 THR 21 -15.834 -2.789 7.024
159 HG21 THR 21 HG21 THR 21 -11.782 -2.112 7.060
160 HG22 THR 21 HG22 THR 21 -12.729 -1.830 5.600
161 HG23 THR 21 HG23 THR 21 -12.432 -3.477 6.155
162 H ASP 22 HN ASP 22 -15.181 -4.910 7.112
163 HA ASP 22 HA ASP 22 -13.423 -7.125 7.566
164 HB2 ASP 22 HB2 ASP 22 -15.158 -8.418 6.357
165 HB3 ASP 22 HB1 ASP 22 -15.828 -7.607 7.761
166 H GLY 23 HN GLY 23 -11.705 -6.969 6.421
167 HA2 GLY 23 HA2 GLY 23 -11.733 -5.514 3.898
168 HA3 GLY 23 HA1 GLY 23 -10.303 -5.977 4.812
169 H THR 24 HN THR 24 -12.913 -8.135 3.867
170 HA THR 24 HA THR 24 -12.916 -10.095 2.715
171 HB THR 24 HB THR 24 -12.163 -9.945 0.341
172 HG1 THR 24 HG1 THR 24 -10.596 -7.927 1.354
173 HG21 THR 24 HG21 THR 24 -13.497 -8.009 -0.344
174 HG22 THR 24 HG22 THR 24 -13.485 -7.423 1.319
175 HG23 THR 24 HG23 THR 24 -14.293 -8.943 0.925
176 H ASP 25 HN ASP 25 -10.829 -11.046 0.929
177 HA ASP 25 HA ASP 25 -9.259 -12.186 3.061
178 HB2 ASP 25 HB2 ASP 25 -9.508 -13.060 0.191
179 HB3 ASP 25 HB1 ASP 25 -8.428 -13.814 1.361
180 H LEU 26 HN LEU 26 -7.897 -10.759 3.618
181 HA LEU 26 HA LEU 26 -5.961 -9.744 1.669
182 HB2 LEU 26 HB2 LEU 26 -7.221 -8.677 3.942
183 HB3 LEU 26 HB1 LEU 26 -5.553 -8.935 4.408
184 HG LEU 26 HG LEU 26 -4.837 -7.559 2.470
185 HD11 LEU 26 HD11 LEU 26 -6.755 -7.921 1.023
186 HD12 LEU 26 HD12 LEU 26 -6.514 -6.194 1.307
187 HD13 LEU 26 HD13 LEU 26 -7.793 -7.064 2.158
188 HD21 LEU 26 HD21 LEU 26 -5.532 -5.412 3.438
189 HD22 LEU 26 HD22 LEU 26 -5.072 -6.573 4.688
190 HD23 LEU 26 HD23 LEU 26 -6.777 -6.245 4.370
191 H SER 27 HN SER 27 -6.380 -12.434 3.209
192 HA SER 27 HA SER 27 -3.881 -12.675 4.628
193 HB2 SER 27 HB2 SER 27 -6.008 -13.672 5.508
194 HB3 SER 27 HB1 SER 27 -5.995 -14.791 4.141
195 HG SER 27 HG SER 27 -5.041 -15.567 6.170
196 H GLY 28 HN GLY 28 -2.174 -13.862 3.998
197 HA2 GLY 28 HA2 GLY 28 -0.788 -15.107 2.691
198 HA3 GLY 28 HA1 GLY 28 -2.208 -15.724 1.865
199 H ASP 29 HN ASP 29 -2.179 -15.358 -0.161
200 HA ASP 29 HA ASP 29 -0.566 -13.182 -1.238
201 HB2 ASP 29 HB2 ASP 29 -1.985 -15.393 -2.759
202 HB3 ASP 29 HB1 ASP 29 -0.802 -14.268 -3.399
203 H PHE 30 HN PHE 30 -1.526 -11.348 -1.538
204 HA PHE 30 HA PHE 30 -4.154 -11.237 -2.855
205 HB2 PHE 30 HB2 PHE 30 -4.891 -9.437 -1.348
206 HB3 PHE 30 HB1 PHE 30 -4.475 -10.846 -0.386
207 HD1 PHE 30 HD2 PHE 30 -2.232 -10.880 0.783
208 HD2 PHE 30 HD1 PHE 30 -3.832 -7.372 -1.009
209 HE1 PHE 30 HE2 PHE 30 -0.663 -9.515 2.055
210 HE2 PHE 30 HE1 PHE 30 -2.264 -5.995 0.276
211 HZ PHE 30 HZ PHE 30 -0.673 -7.058 1.813
212 H LEU 31 HN LEU 31 -1.226 -10.905 -3.442
213 HA LEU 31 HA LEU 31 -0.618 -8.122 -3.584
214 HB2 LEU 31 HB2 LEU 31 1.070 -9.923 -3.278
215 HB3 LEU 31 HB1 LEU 31 0.790 -10.416 -4.936
216 HG LEU 31 HG LEU 31 1.585 -8.193 -5.697
217 HD11 LEU 31 HD11 LEU 31 2.269 -7.813 -2.786
218 HD12 LEU 31 HD12 LEU 31 1.095 -6.887 -3.722
219 HD13 LEU 31 HD13 LEU 31 2.810 -6.781 -4.110
220 HD21 LEU 31 HD21 LEU 31 3.952 -8.612 -5.206
221 HD22 LEU 31 HD22 LEU 31 3.092 -10.076 -5.667
222 HD23 LEU 31 HD23 LEU 31 3.478 -9.781 -3.973
223 H ASP 32 HN ASP 32 -2.128 -10.355 -5.763
224 HA ASP 32 HA ASP 32 -2.071 -8.243 -7.792
225 HB2 ASP 32 HB2 ASP 32 -2.414 -9.908 -9.543
226 HB3 ASP 32 HB1 ASP 32 -0.983 -10.298 -8.612
227 H LEU 33 HN LEU 33 -3.875 -8.986 -5.443
228 HA LEU 33 HA LEU 33 -6.443 -9.109 -6.813
229 HB2 LEU 33 HB2 LEU 33 -5.973 -10.482 -4.753
230 HB3 LEU 33 HB1 LEU 33 -5.780 -9.000 -3.846
231 HG LEU 33 HG LEU 33 -8.165 -8.485 -4.183
232 HD11 LEU 33 HD11 LEU 33 -8.465 -9.570 -6.360
233 HD12 LEU 33 HD12 LEU 33 -9.640 -10.166 -5.182
234 HD13 LEU 33 HD13 LEU 33 -8.237 -11.148 -5.604
235 HD21 LEU 33 HD21 LEU 33 -9.073 -10.286 -2.804
236 HD22 LEU 33 HD22 LEU 33 -7.483 -9.773 -2.231
237 HD23 LEU 33 HD23 LEU 33 -7.651 -11.274 -3.150
238 H ARG 34 HN ARG 34 -7.720 -7.277 -6.993
239 HA ARG 34 HA ARG 34 -6.182 -4.837 -6.860
240 HB2 ARG 34 HB2 ARG 34 -8.986 -5.228 -7.871
241 HB3 ARG 34 HB1 ARG 34 -7.956 -3.823 -8.143
242 HG2 ARG 34 HG2 ARG 34 -6.392 -5.263 -9.396
243 HG3 ARG 34 HG1 ARG 34 -7.493 -6.620 -9.171
244 HD2 ARG 34 HD2 ARG 34 -7.898 -5.710 -11.334
245 HD3 ARG 34 HD1 ARG 34 -9.261 -5.264 -10.304
246 HE ARG 34 HE ARG 34 -7.027 -3.499 -10.993
247 HH11 ARG 34 HH11 ARG 34 -10.501 -3.890 -10.206
248 HH12 ARG 34 HH12 ARG 34 -10.820 -2.224 -10.430
249 HH21 ARG 34 HH21 ARG 34 -7.568 -1.334 -11.412
250 HH22 ARG 34 HH22 ARG 34 -9.164 -0.732 -11.210
251 H PHE 35 HN PHE 35 -6.843 -2.863 -5.976
252 HA PHE 35 HA PHE 35 -7.733 -3.052 -3.321
253 HB2 PHE 35 HB2 PHE 35 -7.322 -0.626 -5.057
254 HB3 PHE 35 HB1 PHE 35 -7.780 -0.511 -3.361
255 HD1 PHE 35 HD2 PHE 35 -6.199 -1.574 -1.649
256 HD2 PHE 35 HD1 PHE 35 -5.094 -0.831 -5.687
257 HE1 PHE 35 HE2 PHE 35 -3.827 -1.709 -1.024
258 HE2 PHE 35 HE1 PHE 35 -2.716 -0.974 -5.067
259 HZ PHE 35 HZ PHE 35 -2.090 -1.365 -2.703
260 H GLU 36 HN GLU 36 -9.522 -2.303 -6.226
261 HA GLU 36 HA GLU 36 -11.771 -1.222 -4.902
262 HB2 GLU 36 HB2 GLU 36 -11.657 -2.556 -7.619
263 HB3 GLU 36 HB1 GLU 36 -12.969 -1.545 -7.015
264 HG2 GLU 36 HG2 GLU 36 -11.371 0.337 -6.837
265 HG3 GLU 36 HG1 GLU 36 -10.146 -0.682 -7.582
266 H ASP 37 HN ASP 37 -10.752 -4.478 -5.617
267 HA ASP 37 HA ASP 37 -13.241 -5.760 -5.035
268 HB2 ASP 37 HB2 ASP 37 -10.408 -6.822 -5.050
269 HB3 ASP 37 HB1 ASP 37 -11.832 -7.817 -4.813
270 H ILE 38 HN ILE 38 -10.253 -5.148 -3.298
271 HA ILE 38 HA ILE 38 -11.204 -6.477 -0.955
272 HB ILE 38 HB ILE 38 -9.027 -5.911 0.075
273 HG12 ILE 38 HG12 ILE 38 -8.479 -4.509 -2.563
274 HG13 ILE 38 HG11 ILE 38 -8.656 -3.723 -1.000
275 HG21 ILE 38 HG21 ILE 38 -7.669 -7.276 -1.430
276 HG22 ILE 38 HG22 ILE 38 -8.809 -7.002 -2.736
277 HG23 ILE 38 HG23 ILE 38 -9.303 -7.923 -1.315
278 HD11 ILE 38 HD11 ILE 38 -6.647 -4.844 -0.204
279 HD12 ILE 38 HD12 ILE 38 -6.324 -3.893 -1.653
280 HD13 ILE 38 HD13 ILE 38 -6.468 -5.647 -1.762
281 H GLY 39 HN GLY 39 -12.272 -3.759 -1.977
282 HA2 GLY 39 HA2 GLY 39 -13.531 -2.112 -0.959
283 HA3 GLY 39 HA1 GLY 39 -13.249 -2.943 0.560
284 H TYR 40 HN TYR 40 -10.829 -1.505 -1.595
285 HA TYR 40 HA TYR 40 -10.196 0.302 0.598
286 HB2 TYR 40 HB2 TYR 40 -8.446 -1.103 -1.341
287 HB3 TYR 40 HB1 TYR 40 -7.924 0.464 -0.723
288 HD1 TYR 40 HD2 TYR 40 -9.184 -2.834 0.399
289 HD2 TYR 40 HD1 TYR 40 -6.792 0.546 1.302
290 HE1 TYR 40 HE2 TYR 40 -8.382 -3.966 2.374
291 HE2 TYR 40 HE1 TYR 40 -5.955 -0.559 3.313
292 HH TYR 40 HH TYR 40 -6.649 -3.880 4.007
293 H ASP 41 HN ASP 41 -10.811 2.189 0.382
294 HA ASP 41 HA ASP 41 -11.106 3.424 -2.240
295 HB2 ASP 41 HB2 ASP 41 -11.833 4.408 0.537
296 HB3 ASP 41 HB1 ASP 41 -12.067 5.341 -0.933
297 H SER 42 HN SER 42 -10.336 5.686 -2.408
298 HA SER 42 HA SER 42 -7.626 5.883 -2.470
299 HB2 SER 42 HB2 SER 42 -8.099 8.333 -2.705
300 HB3 SER 42 HB1 SER 42 -9.040 7.278 -3.773
301 H LEU 43 HN LEU 43 -9.779 7.253 -0.077
302 HA LEU 43 HA LEU 43 -8.023 8.611 1.558
303 HB2 LEU 43 HB2 LEU 43 -10.473 7.084 2.425
304 HB3 LEU 43 HB1 LEU 43 -9.647 8.298 3.382
305 HG LEU 43 HG LEU 43 -11.078 8.781 0.766
306 HD11 LEU 43 HD11 LEU 43 -11.777 9.549 3.593
307 HD12 LEU 43 HD12 LEU 43 -12.589 8.325 2.617
308 HD13 LEU 43 HD13 LEU 43 -12.663 10.022 2.144
309 HD21 LEU 43 HD21 LEU 43 -9.160 10.260 1.039
310 HD22 LEU 43 HD22 LEU 43 -9.709 10.687 2.652
311 HD23 LEU 43 HD23 LEU 43 -10.667 11.165 1.245
312 H ALA 44 HN ALA 44 -8.912 5.199 1.755
313 HA ALA 44 HA ALA 44 -7.403 4.666 4.098
314 HB1 ALA 44 HB1 ALA 44 -9.330 3.308 3.485
315 HB2 ALA 44 HB2 ALA 44 -7.873 2.316 3.600
316 HB3 ALA 44 HB3 ALA 44 -8.507 2.768 2.021
317 H LEU 45 HN LEU 45 -6.758 4.608 0.663
318 HA LEU 45 HA LEU 45 -4.371 3.119 0.911
319 HB2 LEU 45 HB2 LEU 45 -5.723 3.214 -1.105
320 HB3 LEU 45 HB1 LEU 45 -5.292 4.899 -1.320
321 HG LEU 45 HG LEU 45 -3.249 4.365 -2.278
322 HD11 LEU 45 HD11 LEU 45 -1.925 2.403 -1.714
323 HD12 LEU 45 HD12 LEU 45 -3.220 1.754 -0.701
324 HD13 LEU 45 HD13 LEU 45 -2.359 3.225 -0.218
325 HD21 LEU 45 HD21 LEU 45 -4.969 3.234 -3.517
326 HD22 LEU 45 HD22 LEU 45 -4.789 1.904 -2.348
327 HD23 LEU 45 HD23 LEU 45 -3.469 2.246 -3.471
328 H MET 46 HN MET 46 -5.154 6.569 0.956
329 HA MET 46 HA MET 46 -2.527 7.725 0.862
330 HB2 MET 46 HB2 MET 46 -4.676 8.735 2.731
331 HB3 MET 46 HB1 MET 46 -3.427 9.665 1.923
332 HG2 MET 46 HG2 MET 46 -4.618 9.172 -0.201
333 HG3 MET 46 HG1 MET 46 -5.852 8.409 0.816
334 HE1 MET 46 HE1 MET 46 -7.262 9.681 2.695
335 HE2 MET 46 HE2 MET 46 -7.100 11.399 3.037
336 HE3 MET 46 HE3 MET 46 -5.766 10.300 3.396
337 H GLU 47 HN GLU 47 -4.615 6.757 3.426
338 HA GLU 47 HA GLU 47 -3.071 7.041 5.665
339 HB2 GLU 47 HB2 GLU 47 -5.373 5.659 4.681
340 HB3 GLU 47 HB1 GLU 47 -4.836 4.984 6.240
341 HG2 GLU 47 HG2 GLU 47 -5.807 7.733 5.444
342 HG3 GLU 47 HG1 GLU 47 -6.540 6.620 6.596
343 H THR 48 HN THR 48 -3.414 4.268 3.496
344 HA THR 48 HA THR 48 -1.795 2.380 4.750
345 HB THR 48 HB THR 48 -2.260 2.896 1.799
346 HG1 THR 48 HG1 THR 48 -4.141 2.426 3.140
347 HG21 THR 48 HG21 THR 48 -1.678 0.548 1.443
348 HG22 THR 48 HG22 THR 48 -1.255 0.384 3.154
349 HG23 THR 48 HG23 THR 48 -0.306 1.440 2.106
350 H ALA 49 HN ALA 49 -0.974 4.747 2.291
351 HA ALA 49 HA ALA 49 1.729 4.156 2.022
352 HB1 ALA 49 HB1 ALA 49 1.948 6.332 0.954
353 HB2 ALA 49 HB2 ALA 49 0.369 6.812 1.584
354 HB3 ALA 49 HB3 ALA 49 0.489 5.501 0.406
355 H ALA 50 HN ALA 50 0.118 6.509 4.133
356 HA ALA 50 HA ALA 50 2.364 7.819 5.128
357 HB1 ALA 50 HB1 ALA 50 0.959 8.543 6.980
358 HB2 ALA 50 HB2 ALA 50 -0.208 7.277 6.601
359 HB3 ALA 50 HB3 ALA 50 0.060 8.590 5.462
360 H ARG 51 HN ARG 51 0.890 4.864 6.245
361 HA ARG 51 HA ARG 51 2.375 4.493 8.637
362 HB2 ARG 51 HB2 ARG 51 0.231 3.363 8.085
363 HB3 ARG 51 HB1 ARG 51 1.022 2.477 6.809
364 HG2 ARG 51 HG2 ARG 51 1.766 2.146 9.719
365 HG3 ARG 51 HG1 ARG 51 0.461 1.239 8.964
366 HD2 ARG 51 HD2 ARG 51 2.173 0.454 7.273
367 HD3 ARG 51 HD1 ARG 51 3.408 1.159 8.319
368 HE ARG 51 HE ARG 51 1.758 -0.506 9.846
369 HH11 ARG 51 HH11 ARG 51 4.263 -0.803 7.337
370 HH12 ARG 51 HH12 ARG 51 4.701 -2.396 7.668
371 HH21 ARG 51 HH21 ARG 51 2.266 -2.696 10.335
372 HH22 ARG 51 HH22 ARG 51 3.553 -3.507 9.560
373 H LEU 52 HN LEU 52 2.953 3.724 5.306
374 HA LEU 52 HA LEU 52 5.274 2.087 5.837
375 HB2 LEU 52 HB2 LEU 52 4.190 3.133 3.227
376 HB3 LEU 52 HB1 LEU 52 5.376 1.855 3.428
377 HG LEU 52 HG LEU 52 2.496 1.740 4.316
378 HD11 LEU 52 HD11 LEU 52 3.888 0.364 2.038
379 HD12 LEU 52 HD12 LEU 52 2.702 1.661 1.912
380 HD13 LEU 52 HD13 LEU 52 2.224 0.090 2.549
381 HD21 LEU 52 HD21 LEU 52 2.982 -0.640 4.765
382 HD22 LEU 52 HD22 LEU 52 3.893 0.457 5.795
383 HD23 LEU 52 HD23 LEU 52 4.693 -0.330 4.448
384 H GLU 53 HN GLU 53 4.572 5.255 4.445
385 HA GLU 53 HA GLU 53 7.091 6.117 3.649
386 HB2 GLU 53 HB2 GLU 53 4.866 7.751 4.895
387 HB3 GLU 53 HB1 GLU 53 6.239 8.416 4.035
388 HG2 GLU 53 HG2 GLU 53 5.481 7.375 1.977
389 HG3 GLU 53 HG1 GLU 53 4.134 6.622 2.847
390 H SER 54 HN SER 54 5.565 6.335 6.810
391 HA SER 54 HA SER 54 7.513 7.886 8.076
392 HB2 SER 54 HB2 SER 54 5.605 5.886 9.297
393 HB3 SER 54 HB1 SER 54 6.467 7.153 10.172
394 HG SER 54 HG SER 54 4.416 7.415 8.221
395 H ARG 55 HN ARG 55 7.265 4.357 7.777
396 HA ARG 55 HA ARG 55 9.440 3.924 9.622
397 HB2 ARG 55 HB2 ARG 55 7.661 2.248 9.424
398 HB3 ARG 55 HB1 ARG 55 8.120 1.953 7.745
399 HG2 ARG 55 HG2 ARG 55 10.404 1.318 8.601
400 HG3 ARG 55 HG1 ARG 55 9.724 1.374 10.219
401 HD2 ARG 55 HD2 ARG 55 8.767 -0.381 7.971
402 HD3 ARG 55 HD1 ARG 55 9.811 -0.892 9.289
403 HE ARG 55 HE ARG 55 7.577 0.143 10.492
404 HH11 ARG 55 HH11 ARG 55 8.312 -2.457 8.215
405 HH12 ARG 55 HH12 ARG 55 6.982 -3.421 8.605
406 HH21 ARG 55 HH21 ARG 55 5.703 -1.264 11.133
407 HH22 ARG 55 HH22 ARG 55 5.540 -2.774 10.365
408 H TYR 56 HN TYR 56 8.991 3.667 6.133
409 HA TYR 56 HA TYR 56 11.704 2.742 5.819
410 HB2 TYR 56 HB2 TYR 56 9.509 3.102 3.770
411 HB3 TYR 56 HB1 TYR 56 11.085 2.400 3.437
412 HD1 TYR 56 HD1 TYR 56 11.722 0.237 4.448
413 HD2 TYR 56 HD2 TYR 56 7.807 1.822 4.923
414 HE1 TYR 56 HE1 TYR 56 10.926 -1.965 5.220
415 HE2 TYR 56 HE2 TYR 56 6.999 -0.376 5.684
416 HH TYR 56 HH TYR 56 7.542 -2.666 5.733
417 H GLY 57 HN GLY 57 10.190 5.741 5.792
418 HA2 GLY 57 HA2 GLY 57 11.170 7.791 5.584
419 HA3 GLY 57 HA1 GLY 57 12.677 6.990 5.158
420 H VAL 58 HN VAL 58 9.430 7.244 3.742
421 HA VAL 58 HA VAL 58 10.665 8.256 1.306
422 HB VAL 58 HB VAL 58 9.293 6.849 -0.162
423 HG11 VAL 58 HG11 VAL 58 10.310 4.672 0.181
424 HG12 VAL 58 HG12 VAL 58 10.708 5.133 1.831
425 HG13 VAL 58 HG13 VAL 58 11.488 5.971 0.480
426 HG21 VAL 58 HG21 VAL 58 7.973 4.977 0.683
427 HG22 VAL 58 HG22 VAL 58 7.345 6.521 1.256
428 HG23 VAL 58 HG23 VAL 58 8.288 5.492 2.343
429 H SER 59 HN SER 59 8.508 8.740 -0.250
430 HA SER 59 HA SER 59 6.328 9.748 1.300
431 HB2 SER 59 HB2 SER 59 8.067 11.637 -0.330
432 HB3 SER 59 HB1 SER 59 6.535 12.060 0.421
433 HG SER 59 HG SER 59 8.032 10.927 2.247
434 H ILE 60 HN ILE 60 4.529 9.546 0.139
435 HA ILE 60 HA ILE 60 4.814 9.228 -2.772
436 HB ILE 60 HB ILE 60 2.876 7.642 -1.018
437 HG12 ILE 60 HG12 ILE 60 5.292 6.689 -2.588
438 HG13 ILE 60 HG11 ILE 60 5.217 6.825 -0.837
439 HG21 ILE 60 HG21 ILE 60 1.956 8.189 -3.229
440 HG22 ILE 60 HG22 ILE 60 2.306 6.458 -3.090
441 HG23 ILE 60 HG23 ILE 60 3.397 7.507 -3.987
442 HD11 ILE 60 HD11 ILE 60 3.448 5.137 -0.790
443 HD12 ILE 60 HD12 ILE 60 4.916 4.527 -1.559
444 HD13 ILE 60 HD13 ILE 60 3.540 5.005 -2.546
445 HA PRO 61 HA PRO 61 1.877 12.597 -2.748
446 HB2 PRO 61 HB2 PRO 61 1.675 11.940 -5.629
447 HB3 PRO 61 HB1 PRO 61 2.129 13.461 -4.854
448 HG2 PRO 61 HG2 PRO 61 3.959 11.958 -6.082
449 HG3 PRO 61 HG1 PRO 61 4.345 12.816 -4.581
450 HD2 PRO 61 HD2 PRO 61 3.660 9.927 -4.980
451 HD3 PRO 61 HD1 PRO 61 4.928 10.652 -3.966
452 H ASP 62 HN ASP 62 -0.307 12.732 -2.756
453 HA ASP 62 HA ASP 62 -1.837 10.477 -2.313
454 HB2 ASP 62 HB2 ASP 62 -3.798 11.987 -2.335
455 HB3 ASP 62 HB1 ASP 62 -2.460 12.642 -1.402
456 H ASP 63 HN ASP 63 -1.534 12.339 -5.308
457 HA ASP 63 HA ASP 63 -3.593 10.974 -6.694
458 HB2 ASP 63 HB2 ASP 63 -1.218 12.502 -7.752
459 HB3 ASP 63 HB1 ASP 63 -2.393 11.744 -8.811
460 H VAL 64 HN VAL 64 -0.224 10.324 -6.303
461 HA VAL 64 HA VAL 64 -0.104 8.204 -8.194
462 HB VAL 64 HB VAL 64 1.798 8.824 -5.916
463 HG11 VAL 64 HG11 VAL 64 3.471 7.660 -7.291
464 HG12 VAL 64 HG12 VAL 64 2.213 7.283 -8.472
465 HG13 VAL 64 HG13 VAL 64 2.132 6.606 -6.845
466 HG21 VAL 64 HG21 VAL 64 3.111 10.069 -7.572
467 HG22 VAL 64 HG22 VAL 64 1.521 10.774 -7.325
468 HG23 VAL 64 HG23 VAL 64 1.838 9.807 -8.768
469 H ALA 65 HN ALA 65 -0.532 8.442 -4.692
470 HA ALA 65 HA ALA 65 -0.469 5.713 -4.100
471 HB1 ALA 65 HB1 ALA 65 -1.748 6.313 -2.101
472 HB2 ALA 65 HB2 ALA 65 -2.041 7.919 -2.775
473 HB3 ALA 65 HB3 ALA 65 -0.398 7.424 -2.356
474 H GLY 66 HN GLY 66 -3.200 7.864 -4.890
475 HA2 GLY 66 HA2 GLY 66 -5.063 5.656 -4.986
476 HA3 GLY 66 HA1 GLY 66 -5.404 7.331 -5.397
477 H ARG 67 HN ARG 67 -2.653 6.270 -6.968
478 HA ARG 67 HA ARG 67 -4.063 6.027 -9.501
479 HB2 ARG 67 HB2 ARG 67 -2.153 7.593 -9.334
480 HB3 ARG 67 HB1 ARG 67 -1.106 6.250 -8.888
481 HG2 ARG 67 HG2 ARG 67 -1.755 5.213 -11.072
482 HG3 ARG 67 HG1 ARG 67 -2.490 6.790 -11.439
483 HD2 ARG 67 HD2 ARG 67 -0.398 7.879 -11.366
484 HD3 ARG 67 HD1 ARG 67 0.399 6.446 -10.700
485 HE ARG 67 HE ARG 67 -0.808 5.740 -13.107
486 HH11 ARG 67 HH11 ARG 67 1.931 7.746 -12.060
487 HH12 ARG 67 HH12 ARG 67 2.804 7.507 -13.486
488 HH21 ARG 67 HH21 ARG 67 0.390 5.369 -14.978
489 HH22 ARG 67 HH22 ARG 67 1.918 6.090 -15.216
490 H VAL 68 HN VAL 68 -2.609 4.055 -7.098
491 HA VAL 68 HA VAL 68 -1.642 2.201 -9.020
492 HB VAL 68 HB VAL 68 -0.854 0.771 -7.181
493 HG11 VAL 68 HG11 VAL 68 0.566 2.521 -7.973
494 HG12 VAL 68 HG12 VAL 68 0.767 2.349 -6.229
495 HG13 VAL 68 HG13 VAL 68 -0.185 3.682 -6.883
496 HG21 VAL 68 HG21 VAL 68 -0.977 1.541 -4.875
497 HG22 VAL 68 HG22 VAL 68 -2.584 1.142 -5.502
498 HG23 VAL 68 HG23 VAL 68 -2.085 2.831 -5.346
499 H ASP 69 HN ASP 69 -2.206 -0.018 -9.136
500 HA ASP 69 HA ASP 69 -5.152 -0.215 -9.192
501 HB2 ASP 69 HB2 ASP 69 -3.628 -0.521 -11.292
502 HB3 ASP 69 HB1 ASP 69 -3.223 -2.052 -10.566
503 H THR 70 HN THR 70 -2.347 -2.318 -8.775
504 HA THR 70 HA THR 70 -3.840 -3.922 -6.863
505 HB THR 70 HB THR 70 -2.369 -5.784 -7.621
506 HG1 THR 70 HG1 THR 70 -1.222 -5.312 -9.660
507 HG21 THR 70 HG21 THR 70 -4.527 -5.460 -8.738
508 HG22 THR 70 HG22 THR 70 -3.322 -6.026 -9.906
509 HG23 THR 70 HG23 THR 70 -3.772 -4.319 -9.846
510 HA PRO 71 HA PRO 71 -0.953 -2.974 -3.623
511 HB2 PRO 71 HB2 PRO 71 -0.271 -5.886 -3.586
512 HB3 PRO 71 HB1 PRO 71 -0.680 -4.813 -2.242
513 HG2 PRO 71 HG2 PRO 71 -2.495 -6.479 -3.165
514 HG3 PRO 71 HG1 PRO 71 -2.955 -4.810 -2.770
515 HD2 PRO 71 HD2 PRO 71 -2.488 -6.072 -5.436
516 HD3 PRO 71 HD1 PRO 71 -3.701 -4.865 -4.953
517 H ARG 72 HN ARG 72 0.281 -5.119 -6.176
518 HA ARG 72 HA ARG 72 3.002 -4.806 -5.455
519 HB2 ARG 72 HB2 ARG 72 3.618 -5.785 -7.566
520 HB3 ARG 72 HB1 ARG 72 2.249 -6.654 -6.902
521 HG2 ARG 72 HG2 ARG 72 0.763 -5.564 -8.491
522 HG3 ARG 72 HG1 ARG 72 2.105 -4.587 -9.096
523 HD2 ARG 72 HD2 ARG 72 1.767 -6.422 -10.610
524 HD3 ARG 72 HD1 ARG 72 3.272 -6.689 -9.734
525 HE ARG 72 HE ARG 72 0.754 -8.115 -9.406
526 HH11 ARG 72 HH11 ARG 72 4.209 -7.857 -8.525
527 HH12 ARG 72 HH12 ARG 72 4.309 -9.469 -7.945
528 HH21 ARG 72 HH21 ARG 72 1.003 -10.370 -8.639
529 HH22 ARG 72 HH22 ARG 72 2.473 -10.867 -7.951
530 H GLU 73 HN GLU 73 0.886 -2.808 -7.329
531 HA GLU 73 HA GLU 73 2.822 -1.186 -8.586
532 HB2 GLU 73 HB2 GLU 73 -0.012 -0.633 -7.687
533 HB3 GLU 73 HB1 GLU 73 0.952 0.503 -8.619
534 HG2 GLU 73 HG2 GLU 73 0.266 -2.266 -9.537
535 HG3 GLU 73 HG1 GLU 73 -0.662 -0.817 -9.950
536 H LEU 74 HN LEU 74 1.163 -1.045 -5.515
537 HA LEU 74 HA LEU 74 2.249 1.382 -4.594
538 HB2 LEU 74 HB2 LEU 74 0.152 0.313 -3.764
539 HB3 LEU 74 HB1 LEU 74 1.098 -0.954 -3.030
540 HG LEU 74 HG LEU 74 0.171 0.734 -1.435
541 HD11 LEU 74 HD11 LEU 74 2.175 1.027 -0.102
542 HD12 LEU 74 HD12 LEU 74 3.160 0.567 -1.494
543 HD13 LEU 74 HD13 LEU 74 2.054 -0.600 -0.771
544 HD21 LEU 74 HD21 LEU 74 0.383 2.726 -2.799
545 HD22 LEU 74 HD22 LEU 74 2.140 2.594 -2.752
546 HD23 LEU 74 HD23 LEU 74 1.240 2.928 -1.272
547 H LEU 75 HN LEU 75 3.119 -2.039 -4.148
548 HA LEU 75 HA LEU 75 5.319 -1.925 -2.453
549 HB2 LEU 75 HB2 LEU 75 4.394 -3.722 -4.575
550 HB3 LEU 75 HB1 LEU 75 6.108 -3.785 -4.247
551 HG LEU 75 HG LEU 75 4.901 -5.481 -3.153
552 HD11 LEU 75 HD11 LEU 75 6.914 -4.666 -2.066
553 HD12 LEU 75 HD12 LEU 75 5.743 -5.119 -0.835
554 HD13 LEU 75 HD13 LEU 75 5.989 -3.419 -1.234
555 HD21 LEU 75 HD21 LEU 75 2.762 -4.444 -2.840
556 HD22 LEU 75 HD22 LEU 75 3.446 -3.293 -1.696
557 HD23 LEU 75 HD23 LEU 75 3.363 -5.010 -1.284
558 H ASP 76 HN ASP 76 5.215 -1.781 -5.904
559 HA ASP 76 HA ASP 76 7.965 -1.512 -6.394
560 HB2 ASP 76 HB2 ASP 76 6.483 -2.211 -8.168
561 HB3 ASP 76 HB1 ASP 76 5.619 -0.680 -8.113
562 H LEU 77 HN LEU 77 5.463 0.887 -5.890
563 HA LEU 77 HA LEU 77 6.937 3.209 -6.394
564 HB2 LEU 77 HB2 LEU 77 4.742 2.618 -4.458
565 HB3 LEU 77 HB1 LEU 77 5.391 4.218 -4.650
566 HG LEU 77 HG LEU 77 3.934 2.599 -6.737
567 HD11 LEU 77 HD11 LEU 77 3.179 5.093 -5.221
568 HD12 LEU 77 HD12 LEU 77 2.506 3.484 -4.980
569 HD13 LEU 77 HD13 LEU 77 2.225 4.334 -6.498
570 HD21 LEU 77 HD21 LEU 77 4.077 4.595 -8.134
571 HD22 LEU 77 HD22 LEU 77 5.690 3.993 -7.745
572 HD23 LEU 77 HD23 LEU 77 5.052 5.401 -6.906
573 H ILE 78 HN ILE 78 6.392 1.481 -3.375
574 HA ILE 78 HA ILE 78 8.050 2.992 -1.706
575 HB ILE 78 HB ILE 78 7.310 0.058 -1.546
576 HG12 ILE 78 HG12 ILE 78 5.409 1.646 -1.490
577 HG13 ILE 78 HG11 ILE 78 5.573 0.763 0.017
578 HG21 ILE 78 HG21 ILE 78 8.509 1.819 0.603
579 HG22 ILE 78 HG22 ILE 78 9.305 0.469 -0.211
580 HG23 ILE 78 HG23 ILE 78 7.919 0.174 0.835
581 HD11 ILE 78 HD11 ILE 78 6.460 3.597 -0.490
582 HD12 ILE 78 HD12 ILE 78 6.643 2.714 1.029
583 HD13 ILE 78 HD13 ILE 78 5.031 3.090 0.411
584 H ASN 79 HN ASN 79 8.666 -0.098 -3.313
585 HA ASN 79 HA ASN 79 11.295 -0.603 -2.554
586 HB2 ASN 79 HB2 ASN 79 9.733 -1.370 -4.996
587 HB3 ASN 79 HB1 ASN 79 11.412 -1.846 -4.828
588 HD21 ASN 79 HD21 ASN 79 9.438 -1.722 -1.951
589 HD22 ASN 79 HD22 ASN 79 9.246 -3.437 -1.782
590 H GLY 80 HN GLY 80 10.163 1.230 -5.373
591 HA2 GLY 80 HA2 GLY 80 12.712 1.729 -6.449
592 HA3 GLY 80 HA1 GLY 80 11.252 2.646 -6.790
593 H ALA 81 HN ALA 81 10.683 3.696 -4.316
594 HA ALA 81 HA ALA 81 12.516 5.887 -4.208
595 HB1 ALA 81 HB1 ALA 81 10.286 5.185 -2.310
596 HB2 ALA 81 HB2 ALA 81 10.107 6.146 -3.776
597 HB3 ALA 81 HB3 ALA 81 11.089 6.748 -2.439
598 H LEU 82 HN LEU 82 11.908 3.114 -2.164
599 HA LEU 82 HA LEU 82 13.462 3.882 0.027
600 HB2 LEU 82 HB2 LEU 82 11.639 2.370 0.193
601 HB3 LEU 82 HB1 LEU 82 12.363 1.276 -0.958
602 HG LEU 82 HG LEU 82 14.043 0.676 0.618
603 HD11 LEU 82 HD11 LEU 82 14.246 2.790 1.854
604 HD12 LEU 82 HD12 LEU 82 13.906 1.464 2.971
605 HD13 LEU 82 HD13 LEU 82 12.619 2.576 2.506
606 HD21 LEU 82 HD21 LEU 82 12.582 -0.479 2.223
607 HD22 LEU 82 HD22 LEU 82 11.969 -0.556 0.572
608 HD23 LEU 82 HD23 LEU 82 11.253 0.567 1.731
609 H ALA 83 HN ALA 83 14.216 2.111 -2.928
610 HA ALA 83 HA ALA 83 16.707 1.096 -2.083
611 HB1 ALA 83 HB1 ALA 83 15.806 1.776 -4.882
612 HB2 ALA 83 HB2 ALA 83 15.515 0.243 -4.054
613 HB3 ALA 83 HB3 ALA 83 17.164 0.737 -4.452
614 H GLU 84 HN GLU 84 15.721 4.237 -3.240
615 HA GLU 84 HA GLU 84 18.383 5.178 -3.681
616 HB2 GLU 84 HB2 GLU 84 15.704 6.529 -3.578
617 HB3 GLU 84 HB1 GLU 84 17.212 7.305 -4.030
618 HG2 GLU 84 HG2 GLU 84 15.875 5.033 -5.470
619 HG3 GLU 84 HG1 GLU 84 15.896 6.724 -5.982
620 H ALA 85 HN ALA 85 15.756 5.636 -1.360
621 HA ALA 85 HA ALA 85 16.936 7.611 0.218
622 HB1 ALA 85 HB1 ALA 85 14.545 7.075 0.251
623 HB2 ALA 85 HB2 ALA 85 15.244 7.093 1.869
624 HB3 ALA 85 HB3 ALA 85 14.905 5.557 1.078
625 H ALA 86 HN ALA 86 16.997 4.075 0.614
626 HA ALA 86 HA ALA 86 19.156 4.485 2.541
627 HB1 ALA 86 HB1 ALA 86 18.318 2.585 3.824
628 HB2 ALA 86 HB2 ALA 86 16.952 2.434 2.717
629 HB3 ALA 86 HB3 ALA 86 17.107 3.867 3.731
630 H28A SDO 101 H28A SDO 42 -10.173 11.535 -1.720
631 H28B SDO 101 H28B SDO 42 -8.953 10.280 -1.487
632 H30A SDO 101 H30A SDO 42 -8.682 13.197 -0.880
633 H30B SDO 101 H30B SDO 42 -7.089 13.449 -1.587
634 H30C SDO 101 H30C SDO 42 -7.419 11.988 -0.652
635 H31A SDO 101 H31A SDO 42 -6.331 11.928 -3.496
636 H31B SDO 101 H31B SDO 42 -7.414 10.655 -4.054
637 H31C SDO 101 H31C SDO 42 -6.687 10.550 -2.454
638 H32A SDO 101 H32A SDO 42 -9.009 12.526 -4.615
639 H33A SDO 101 H33A SDO 42 -7.700 14.246 -4.832
640 H36A SDO 101 H36A SDO 42 -8.843 15.248 -2.919
641 H37A SDO 101 H37A SDO 42 -10.798 16.772 -2.966
642 H37B SDO 101 H37B SDO 42 -11.734 15.446 -2.260
643 H38A SDO 101 H38A SDO 42 -9.351 16.810 -0.954
644 H38B SDO 101 H38B SDO 42 -11.034 17.185 -0.631
645 H41A SDO 101 H41A SDO 42 -8.798 16.127 0.967
646 H42A SDO 101 H42A SDO 42 -9.899 14.861 2.991
647 H42B SDO 101 H42B SDO 42 -9.640 13.501 1.861
648 H43A SDO 101 H43A SDO 42 -7.549 15.425 2.770
649 H43B SDO 101 H43B SDO 42 -7.261 13.923 1.899
650 H1A SDO 101 H1A SDO 42 -8.767 11.833 5.292
651 H1B SDO 101 H1B SDO 42 -8.948 13.369 6.104
652 H2A SDO 101 H2A SDO 42 -10.312 12.572 3.567
653 H2B SDO 101 H2B SDO 42 -10.525 14.087 4.403
654 H4A SDO 101 H4A SDO 42 -12.044 10.722 6.560
655 H4B SDO 101 H4B SDO 42 -12.200 12.239 7.395
656 H5A SDO 101 H5A SDO 42 -9.756 12.404 7.592
657 H5B SDO 101 H5B SDO 42 -9.627 10.806 6.850
658 H6A SDO 101 H6A SDO 42 -10.950 9.841 8.649
659 H6B SDO 101 H6B SDO 42 -11.140 11.427 9.384
660 H8A SDO 101 H8A SDO 42 -7.076 10.755 9.742
661 H8B SDO 101 H8B SDO 42 -7.865 12.089 8.892
662 H8C SDO 101 H8C SDO 42 -7.693 10.507 8.104
Start of MODEL 5
1 H1 MET 1 HT1 MET 1 22.766 -4.636 4.961
2 H2 MET 1 HT2 MET 1 22.744 -4.561 3.293
3 H3 MET 1 HT3 MET 1 23.287 -5.988 4.075
4 HA MET 1 HA MET 1 21.066 -6.275 3.214
5 HB2 MET 1 HB2 MET 1 21.628 -7.450 5.296
6 HB3 MET 1 HB1 MET 1 21.225 -6.023 6.233
7 HG2 MET 1 HG2 MET 1 19.482 -7.728 6.367
8 HG3 MET 1 HG1 MET 1 18.885 -6.253 5.609
9 HE1 MET 1 HE1 MET 1 16.843 -9.072 3.806
10 HE2 MET 1 HE2 MET 1 16.765 -7.613 4.790
11 HE3 MET 1 HE3 MET 1 17.384 -9.109 5.483
12 H ALA 2 HN ALA 2 19.681 -4.957 2.262
13 HA ALA 2 HA ALA 2 19.077 -2.373 3.395
14 HB1 ALA 2 HB1 ALA 2 17.843 -2.017 1.328
15 HB2 ALA 2 HB2 ALA 2 18.068 -3.709 0.886
16 HB3 ALA 2 HB3 ALA 2 19.461 -2.627 0.979
17 H THR 3 HN THR 3 17.128 -1.760 4.230
18 HA THR 3 HA THR 3 15.438 -3.865 5.211
19 HB THR 3 HB THR 3 14.232 -1.866 6.259
20 HG1 THR 3 HG1 THR 3 14.866 -0.272 4.870
21 HG21 THR 3 HG21 THR 3 16.010 -1.466 7.911
22 HG22 THR 3 HG22 THR 3 17.195 -2.159 6.806
23 HG23 THR 3 HG23 THR 3 15.928 -3.178 7.488
24 H LEU 4 HN LEU 4 14.927 -4.418 2.933
25 HA LEU 4 HA LEU 4 13.226 -2.624 1.469
26 HB2 LEU 4 HB2 LEU 4 14.923 -4.121 0.393
27 HB3 LEU 4 HB1 LEU 4 13.930 -5.486 0.847
28 HG LEU 4 HG LEU 4 12.085 -4.544 -0.546
29 HD11 LEU 4 HD11 LEU 4 14.214 -2.600 -1.465
30 HD12 LEU 4 HD12 LEU 4 12.762 -2.204 -0.551
31 HD13 LEU 4 HD13 LEU 4 12.621 -2.821 -2.192
32 HD21 LEU 4 HD21 LEU 4 13.084 -5.193 -2.692
33 HD22 LEU 4 HD22 LEU 4 13.533 -6.303 -1.396
34 HD23 LEU 4 HD23 LEU 4 14.690 -5.104 -1.967
35 H LEU 5 HN LEU 5 11.183 -2.480 1.792
36 HA LEU 5 HA LEU 5 9.631 -4.097 3.503
37 HB2 LEU 5 HB2 LEU 5 9.345 -1.635 2.772
38 HB3 LEU 5 HB1 LEU 5 8.620 -2.263 1.320
39 HG LEU 5 HG LEU 5 7.514 -2.587 4.122
40 HD11 LEU 5 HD11 LEU 5 6.744 -0.812 1.839
41 HD12 LEU 5 HD12 LEU 5 7.343 -0.323 3.433
42 HD13 LEU 5 HD13 LEU 5 5.762 -1.095 3.264
43 HD21 LEU 5 HD21 LEU 5 5.485 -3.391 3.053
44 HD22 LEU 5 HD22 LEU 5 6.843 -4.448 2.654
45 HD23 LEU 5 HD23 LEU 5 6.253 -3.280 1.469
46 H THR 6 HN THR 6 8.979 -6.124 3.013
47 HA THR 6 HA THR 6 8.611 -6.790 0.219
48 HB THR 6 HB THR 6 8.779 -9.209 1.194
49 HG1 THR 6 HG1 THR 6 9.053 -9.172 3.300
50 HG21 THR 6 HG21 THR 6 11.174 -7.361 1.125
51 HG22 THR 6 HG22 THR 6 10.457 -8.152 -0.278
52 HG23 THR 6 HG23 THR 6 11.228 -9.118 0.983
53 H THR 7 HN THR 7 7.098 -9.068 0.290
54 HA THR 7 HA THR 7 4.531 -8.126 0.238
55 HB THR 7 HB THR 7 5.059 -11.024 0.670
56 HG1 THR 7 HG1 THR 7 5.857 -10.539 -1.798
57 HG21 THR 7 HG21 THR 7 2.883 -10.175 -0.174
58 HG22 THR 7 HG22 THR 7 3.686 -11.170 -1.393
59 HG23 THR 7 HG23 THR 7 3.715 -9.417 -1.529
60 H ASP 8 HN ASP 8 6.252 -9.953 2.772
61 HA ASP 8 HA ASP 8 4.098 -10.619 4.402
62 HB2 ASP 8 HB2 ASP 8 5.746 -10.918 6.232
63 HB3 ASP 8 HB1 ASP 8 6.259 -11.682 4.735
64 H ASP 9 HN ASP 9 6.081 -7.697 4.472
65 HA ASP 9 HA ASP 9 4.742 -6.688 6.793
66 HB2 ASP 9 HB2 ASP 9 7.023 -5.990 6.308
67 HB3 ASP 9 HB1 ASP 9 6.494 -5.223 4.823
68 H LEU 10 HN LEU 10 4.550 -6.080 3.361
69 HA LEU 10 HA LEU 10 2.657 -3.998 3.442
70 HB2 LEU 10 HB2 LEU 10 3.828 -4.632 1.371
71 HB3 LEU 10 HB1 LEU 10 2.889 -6.110 1.297
72 HG LEU 10 HG LEU 10 0.824 -4.663 1.196
73 HD11 LEU 10 HD11 LEU 10 2.831 -2.480 0.688
74 HD12 LEU 10 HD12 LEU 10 1.720 -2.613 2.049
75 HD13 LEU 10 HD13 LEU 10 1.087 -2.362 0.421
76 HD21 LEU 10 HD21 LEU 10 1.679 -5.775 -0.786
77 HD22 LEU 10 HD22 LEU 10 2.817 -4.462 -1.067
78 HD23 LEU 10 HD23 LEU 10 1.084 -4.173 -1.209
79 H ARG 11 HN ARG 11 2.187 -7.494 3.409
80 HA ARG 11 HA ARG 11 -0.569 -7.606 3.196
81 HB2 ARG 11 HB2 ARG 11 0.747 -9.599 2.993
82 HB3 ARG 11 HB1 ARG 11 1.374 -9.422 4.624
83 HG2 ARG 11 HG2 ARG 11 -0.794 -9.967 5.549
84 HG3 ARG 11 HG1 ARG 11 -1.504 -10.003 3.934
85 HD2 ARG 11 HD2 ARG 11 -0.269 -11.922 3.326
86 HD3 ARG 11 HD1 ARG 11 0.782 -11.786 4.734
87 HE ARG 11 HE ARG 11 -1.502 -12.120 5.934
88 HH11 ARG 11 HH11 ARG 11 -0.435 -13.824 2.990
89 HH12 ARG 11 HH12 ARG 11 -1.067 -15.329 3.428
90 HH21 ARG 11 HH21 ARG 11 -2.401 -14.214 6.531
91 HH22 ARG 11 HH22 ARG 11 -2.279 -15.542 5.475
92 H ARG 12 HN ARG 12 1.407 -7.078 6.025
93 HA ARG 12 HA ARG 12 -0.827 -7.089 7.853
94 HB2 ARG 12 HB2 ARG 12 1.934 -5.963 8.288
95 HB3 ARG 12 HB1 ARG 12 0.769 -6.419 9.525
96 HG2 ARG 12 HG2 ARG 12 1.001 -8.747 8.920
97 HG3 ARG 12 HG1 ARG 12 2.084 -8.308 7.596
98 HD2 ARG 12 HD2 ARG 12 3.560 -7.238 9.313
99 HD3 ARG 12 HD1 ARG 12 2.554 -8.009 10.541
100 HE ARG 12 HE ARG 12 3.154 -10.146 9.340
101 HH11 ARG 12 HH11 ARG 12 5.289 -7.376 9.605
102 HH12 ARG 12 HH12 ARG 12 6.706 -8.221 9.205
103 HH21 ARG 12 HH21 ARG 12 5.025 -11.353 8.921
104 HH22 ARG 12 HH22 ARG 12 6.569 -10.603 8.850
105 H ALA 13 HN ALA 13 1.348 -4.715 6.431
106 HA ALA 13 HA ALA 13 0.514 -2.413 7.717
107 HB1 ALA 13 HB1 ALA 13 1.594 -2.625 4.927
108 HB2 ALA 13 HB2 ALA 13 2.557 -2.588 6.409
109 HB3 ALA 13 HB3 ALA 13 1.590 -1.185 5.942
110 H LEU 14 HN LEU 14 -0.695 -3.778 4.686
111 HA LEU 14 HA LEU 14 -2.334 -1.666 3.965
112 HB2 LEU 14 HB2 LEU 14 -1.667 -3.756 2.659
113 HB3 LEU 14 HB1 LEU 14 -2.899 -4.604 3.559
114 HG LEU 14 HG LEU 14 -4.616 -3.159 2.591
115 HD11 LEU 14 HD11 LEU 14 -2.333 -1.987 1.008
116 HD12 LEU 14 HD12 LEU 14 -3.272 -1.161 2.255
117 HD13 LEU 14 HD13 LEU 14 -4.048 -1.652 0.755
118 HD21 LEU 14 HD21 LEU 14 -4.486 -4.014 0.300
119 HD22 LEU 14 HD22 LEU 14 -4.061 -5.251 1.487
120 HD23 LEU 14 HD23 LEU 14 -2.794 -4.440 0.564
121 H VAL 15 HN VAL 15 -2.947 -4.471 6.010
122 HA VAL 15 HA VAL 15 -5.666 -4.046 6.616
123 HB VAL 15 HB VAL 15 -3.537 -5.360 8.317
124 HG11 VAL 15 HG11 VAL 15 -6.544 -5.726 8.316
125 HG12 VAL 15 HG12 VAL 15 -5.603 -4.918 9.571
126 HG13 VAL 15 HG13 VAL 15 -5.410 -6.649 9.301
127 HG21 VAL 15 HG21 VAL 15 -3.579 -6.361 6.130
128 HG22 VAL 15 HG22 VAL 15 -5.335 -6.554 6.211
129 HG23 VAL 15 HG23 VAL 15 -4.287 -7.478 7.294
130 H GLU 16 HN GLU 16 -2.710 -3.238 8.403
131 HA GLU 16 HA GLU 16 -3.674 -1.985 10.679
132 HB2 GLU 16 HB2 GLU 16 -1.336 -0.940 9.084
133 HB3 GLU 16 HB1 GLU 16 -1.586 -0.807 10.818
134 HG2 GLU 16 HG2 GLU 16 -1.057 -3.342 9.302
135 HG3 GLU 16 HG1 GLU 16 0.133 -2.443 10.224
136 H SER 17 HN SER 17 -3.158 -0.643 7.494
137 HA SER 17 HA SER 17 -3.752 2.058 8.222
138 HB2 SER 17 HB2 SER 17 -3.487 0.826 5.487
139 HB3 SER 17 HB1 SER 17 -3.337 2.535 5.915
140 HG SER 17 HG SER 17 -1.602 0.385 6.465
141 H ALA 18 HN ALA 18 -5.685 -0.624 7.499
142 HA ALA 18 HA ALA 18 -7.821 0.857 6.238
143 HB1 ALA 18 HB1 ALA 18 -9.036 -1.258 6.281
144 HB2 ALA 18 HB2 ALA 18 -7.765 -1.975 7.275
145 HB3 ALA 18 HB3 ALA 18 -7.415 -1.486 5.621
146 H GLY 19 HN GLY 19 -6.817 0.013 9.412
147 HA2 GLY 19 HA2 GLY 19 -7.621 1.147 11.299
148 HA3 GLY 19 HA1 GLY 19 -9.141 1.437 10.460
149 H GLU 20 HN GLU 20 -10.816 0.117 10.850
150 HA GLU 20 HA GLU 20 -10.250 -2.175 12.586
151 HB2 GLU 20 HB2 GLU 20 -12.472 -1.918 13.539
152 HB3 GLU 20 HB1 GLU 20 -11.621 -0.390 13.642
153 HG2 GLU 20 HG2 GLU 20 -13.679 -1.061 11.546
154 HG3 GLU 20 HG1 GLU 20 -14.031 -0.210 13.048
155 H THR 21 HN THR 21 -10.623 -1.519 9.591
156 HA THR 21 HA THR 21 -12.638 -3.297 8.703
157 HB THR 21 HB THR 21 -10.281 -1.989 7.309
158 HG1 THR 21 HG1 THR 21 -12.960 -1.295 7.760
159 HG21 THR 21 HG21 THR 21 -12.766 -3.266 6.104
160 HG22 THR 21 HG22 THR 21 -11.143 -3.937 6.020
161 HG23 THR 21 HG23 THR 21 -11.509 -2.417 5.207
162 H ASP 22 HN ASP 22 -12.173 -5.239 9.784
163 HA ASP 22 HA ASP 22 -9.657 -6.553 9.170
164 HB2 ASP 22 HB2 ASP 22 -11.839 -7.223 11.045
165 HB3 ASP 22 HB1 ASP 22 -10.489 -8.322 10.798
166 H GLY 23 HN GLY 23 -11.825 -6.102 7.429
167 HA2 GLY 23 HA2 GLY 23 -12.604 -8.856 6.684
168 HA3 GLY 23 HA1 GLY 23 -13.383 -7.397 6.055
169 H THR 24 HN THR 24 -10.020 -7.343 6.296
170 HA THR 24 HA THR 24 -9.722 -7.270 3.447
171 HB THR 24 HB THR 24 -7.401 -6.519 4.150
172 HG1 THR 24 HG1 THR 24 -7.390 -7.491 6.179
173 HG21 THR 24 HG21 THR 24 -9.737 -5.005 5.329
174 HG22 THR 24 HG22 THR 24 -9.226 -4.923 3.643
175 HG23 THR 24 HG23 THR 24 -8.163 -4.325 4.920
176 H ASP 25 HN ASP 25 -10.095 -9.592 3.193
177 HA ASP 25 HA ASP 25 -8.280 -11.456 4.381
178 HB2 ASP 25 HB2 ASP 25 -10.577 -12.100 3.668
179 HB3 ASP 25 HB1 ASP 25 -10.096 -11.873 1.990
180 H LEU 26 HN LEU 26 -6.282 -10.876 3.930
181 HA LEU 26 HA LEU 26 -5.397 -10.562 1.155
182 HB2 LEU 26 HB2 LEU 26 -4.401 -9.647 3.790
183 HB3 LEU 26 HB1 LEU 26 -3.210 -9.947 2.549
184 HG LEU 26 HG LEU 26 -4.198 -8.247 1.124
185 HD11 LEU 26 HD11 LEU 26 -6.207 -7.815 3.323
186 HD12 LEU 26 HD12 LEU 26 -6.543 -8.485 1.733
187 HD13 LEU 26 HD13 LEU 26 -6.011 -6.808 1.885
188 HD21 LEU 26 HD21 LEU 26 -2.541 -7.600 2.749
189 HD22 LEU 26 HD22 LEU 26 -3.812 -7.289 3.936
190 HD23 LEU 26 HD23 LEU 26 -3.703 -6.305 2.478
191 H SER 27 HN SER 27 -5.915 -13.145 2.712
192 HA SER 27 HA SER 27 -3.344 -14.324 3.010
193 HB2 SER 27 HB2 SER 27 -6.036 -15.676 2.816
194 HB3 SER 27 HB1 SER 27 -4.555 -16.335 3.509
195 HG SER 27 HG SER 27 -6.252 -15.326 4.907
196 H GLY 28 HN GLY 28 -2.112 -14.642 1.232
197 HA2 GLY 28 HA2 GLY 28 -1.673 -16.237 -0.510
198 HA3 GLY 28 HA1 GLY 28 -3.367 -16.118 -0.962
199 H ASP 29 HN ASP 29 -3.528 -15.226 -2.862
200 HA ASP 29 HA ASP 29 -1.475 -13.374 -3.709
201 HB2 ASP 29 HB2 ASP 29 -3.694 -14.672 -5.282
202 HB3 ASP 29 HB1 ASP 29 -2.643 -13.446 -5.965
203 H PHE 30 HN PHE 30 -2.398 -12.008 -1.967
204 HA PHE 30 HA PHE 30 -4.658 -10.357 -2.699
205 HB2 PHE 30 HB2 PHE 30 -4.139 -9.029 -0.753
206 HB3 PHE 30 HB1 PHE 30 -3.890 -10.707 -0.305
207 HD1 PHE 30 HD2 PHE 30 -1.539 -11.592 -0.119
208 HD2 PHE 30 HD1 PHE 30 -2.341 -7.437 -0.634
209 HE1 PHE 30 HE2 PHE 30 0.725 -11.059 0.662
210 HE2 PHE 30 HE1 PHE 30 -0.075 -6.910 0.139
211 HZ PHE 30 HZ PHE 30 1.452 -8.656 0.774
212 H LEU 31 HN LEU 31 -1.371 -10.568 -3.349
213 HA LEU 31 HA LEU 31 -0.622 -7.891 -3.768
214 HB2 LEU 31 HB2 LEU 31 0.811 -9.974 -3.422
215 HB3 LEU 31 HB1 LEU 31 0.529 -10.320 -5.113
216 HG LEU 31 HG LEU 31 1.561 -8.104 -5.649
217 HD11 LEU 31 HD11 LEU 31 2.335 -8.199 -2.739
218 HD12 LEU 31 HD12 LEU 31 1.261 -7.029 -3.499
219 HD13 LEU 31 HD13 LEU 31 2.970 -7.071 -3.936
220 HD21 LEU 31 HD21 LEU 31 3.852 -8.898 -5.338
221 HD22 LEU 31 HD22 LEU 31 2.790 -10.192 -5.886
222 HD23 LEU 31 HD23 LEU 31 3.277 -10.115 -4.195
223 H ASP 32 HN ASP 32 -2.304 -10.244 -5.669
224 HA ASP 32 HA ASP 32 -2.219 -8.533 -8.070
225 HB2 ASP 32 HB2 ASP 32 -2.822 -11.483 -7.852
226 HB3 ASP 32 HB1 ASP 32 -2.809 -10.541 -9.337
227 H LEU 33 HN LEU 33 -3.987 -8.537 -5.614
228 HA LEU 33 HA LEU 33 -6.569 -8.916 -6.954
229 HB2 LEU 33 HB2 LEU 33 -6.069 -9.983 -4.685
230 HB3 LEU 33 HB1 LEU 33 -6.007 -8.360 -4.030
231 HG LEU 33 HG LEU 33 -8.379 -8.049 -4.584
232 HD11 LEU 33 HD11 LEU 33 -8.235 -10.914 -5.526
233 HD12 LEU 33 HD12 LEU 33 -8.506 -9.493 -6.544
234 HD13 LEU 33 HD13 LEU 33 -9.710 -9.965 -5.344
235 HD21 LEU 33 HD21 LEU 33 -7.772 -8.941 -2.400
236 HD22 LEU 33 HD22 LEU 33 -7.800 -10.581 -3.040
237 HD23 LEU 33 HD23 LEU 33 -9.289 -9.643 -2.956
238 H ARG 34 HN ARG 34 -8.148 -6.936 -6.123
239 HA ARG 34 HA ARG 34 -6.514 -4.565 -6.765
240 HB2 ARG 34 HB2 ARG 34 -9.482 -4.825 -7.123
241 HB3 ARG 34 HB1 ARG 34 -8.423 -3.594 -7.778
242 HG2 ARG 34 HG2 ARG 34 -7.382 -5.299 -9.210
243 HG3 ARG 34 HG1 ARG 34 -8.532 -6.484 -8.577
244 HD2 ARG 34 HD2 ARG 34 -10.345 -4.874 -9.304
245 HD3 ARG 34 HD1 ARG 34 -9.088 -4.020 -10.190
246 HE ARG 34 HE ARG 34 -10.200 -6.620 -10.744
247 HH11 ARG 34 HH11 ARG 34 -7.543 -4.395 -11.505
248 HH12 ARG 34 HH12 ARG 34 -7.456 -4.817 -13.124
249 HH21 ARG 34 HH21 ARG 34 -10.093 -7.212 -13.023
250 HH22 ARG 34 HH22 ARG 34 -8.933 -6.464 -14.019
251 H PHE 35 HN PHE 35 -7.007 -2.623 -5.695
252 HA PHE 35 HA PHE 35 -7.776 -2.851 -2.990
253 HB2 PHE 35 HB2 PHE 35 -7.585 -0.380 -4.734
254 HB3 PHE 35 HB1 PHE 35 -7.840 -0.334 -2.990
255 HD1 PHE 35 HD2 PHE 35 -6.044 -1.257 -1.486
256 HD2 PHE 35 HD1 PHE 35 -5.440 -0.618 -5.643
257 HE1 PHE 35 HE2 PHE 35 -3.612 -1.330 -1.141
258 HE2 PHE 35 HE1 PHE 35 -3.004 -0.694 -5.305
259 HZ PHE 35 HZ PHE 35 -2.092 -1.016 -3.024
260 H GLU 36 HN GLU 36 -9.526 -2.280 -5.859
261 HA GLU 36 HA GLU 36 -11.974 -1.323 -4.927
262 HB2 GLU 36 HB2 GLU 36 -11.330 -3.113 -7.267
263 HB3 GLU 36 HB1 GLU 36 -12.887 -2.345 -7.007
264 HG2 GLU 36 HG2 GLU 36 -11.915 -0.162 -7.247
265 HG3 GLU 36 HG1 GLU 36 -10.292 -0.849 -7.309
266 H ASP 37 HN ASP 37 -10.623 -4.574 -4.997
267 HA ASP 37 HA ASP 37 -13.125 -5.871 -4.356
268 HB2 ASP 37 HB2 ASP 37 -10.301 -6.979 -4.355
269 HB3 ASP 37 HB1 ASP 37 -11.765 -7.929 -4.137
270 H ILE 38 HN ILE 38 -10.119 -5.075 -2.730
271 HA ILE 38 HA ILE 38 -10.991 -6.297 -0.297
272 HB ILE 38 HB ILE 38 -8.806 -5.437 0.657
273 HG12 ILE 38 HG12 ILE 38 -8.405 -4.650 -2.242
274 HG13 ILE 38 HG11 ILE 38 -8.465 -3.564 -0.864
275 HG21 ILE 38 HG21 ILE 38 -9.104 -7.713 -0.165
276 HG22 ILE 38 HG22 ILE 38 -7.490 -7.115 -0.562
277 HG23 ILE 38 HG23 ILE 38 -8.736 -7.175 -1.806
278 HD11 ILE 38 HD11 ILE 38 -6.344 -5.638 -1.375
279 HD12 ILE 38 HD12 ILE 38 -6.393 -4.527 -0.003
280 HD13 ILE 38 HD13 ILE 38 -6.188 -3.904 -1.638
281 H GLY 39 HN GLY 39 -12.139 -3.678 -1.456
282 HA2 GLY 39 HA2 GLY 39 -13.482 -2.081 -0.500
283 HA3 GLY 39 HA1 GLY 39 -13.137 -2.807 1.055
284 H TYR 40 HN TYR 40 -10.793 -1.364 -1.185
285 HA TYR 40 HA TYR 40 -10.189 0.518 0.959
286 HB2 TYR 40 HB2 TYR 40 -8.430 -0.629 -1.182
287 HB3 TYR 40 HB1 TYR 40 -8.016 0.882 -0.385
288 HD1 TYR 40 HD2 TYR 40 -9.062 -2.567 0.459
289 HD2 TYR 40 HD1 TYR 40 -6.688 0.780 1.490
290 HE1 TYR 40 HE2 TYR 40 -8.107 -3.833 2.302
291 HE2 TYR 40 HE1 TYR 40 -5.717 -0.474 3.354
292 HH TYR 40 HH TYR 40 -6.091 -2.381 4.687
293 H ASP 41 HN ASP 41 -10.909 2.373 0.794
294 HA ASP 41 HA ASP 41 -11.473 3.553 -1.787
295 HB2 ASP 41 HB2 ASP 41 -11.929 4.555 1.041
296 HB3 ASP 41 HB1 ASP 41 -12.279 5.502 -0.396
297 H SER 42 HN SER 42 -10.894 6.050 -1.595
298 HA SER 42 HA SER 42 -8.255 6.388 -2.223
299 HB2 SER 42 HB2 SER 42 -8.818 8.811 -1.823
300 HB3 SER 42 HB1 SER 42 -9.926 7.930 -2.894
301 H LEU 43 HN LEU 43 -9.841 7.499 0.712
302 HA LEU 43 HA LEU 43 -7.730 8.551 2.118
303 HB2 LEU 43 HB2 LEU 43 -10.130 7.130 3.257
304 HB3 LEU 43 HB1 LEU 43 -9.054 8.182 4.161
305 HG LEU 43 HG LEU 43 -10.793 9.041 1.848
306 HD11 LEU 43 HD11 LEU 43 -12.116 8.471 3.800
307 HD12 LEU 43 HD12 LEU 43 -12.093 10.220 3.566
308 HD13 LEU 43 HD13 LEU 43 -11.084 9.477 4.813
309 HD21 LEU 43 HD21 LEU 43 -10.156 11.311 2.531
310 HD22 LEU 43 HD22 LEU 43 -8.759 10.365 2.023
311 HD23 LEU 43 HD23 LEU 43 -9.065 10.631 3.741
312 H ALA 44 HN ALA 44 -8.989 5.249 2.444
313 HA ALA 44 HA ALA 44 -7.193 4.271 4.290
314 HB1 ALA 44 HB1 ALA 44 -9.198 3.057 3.570
315 HB2 ALA 44 HB2 ALA 44 -7.757 2.044 3.474
316 HB3 ALA 44 HB3 ALA 44 -8.442 2.742 2.008
317 H LEU 45 HN LEU 45 -6.824 4.453 0.760
318 HA LEU 45 HA LEU 45 -4.359 3.047 0.798
319 HB2 LEU 45 HB2 LEU 45 -5.839 3.109 -1.117
320 HB3 LEU 45 HB1 LEU 45 -5.490 4.810 -1.338
321 HG LEU 45 HG LEU 45 -3.432 4.383 -2.347
322 HD11 LEU 45 HD11 LEU 45 -3.369 1.699 -0.914
323 HD12 LEU 45 HD12 LEU 45 -2.484 3.140 -0.388
324 HD13 LEU 45 HD13 LEU 45 -2.089 2.384 -1.928
325 HD21 LEU 45 HD21 LEU 45 -4.899 1.895 -2.496
326 HD22 LEU 45 HD22 LEU 45 -3.657 2.389 -3.674
327 HD23 LEU 45 HD23 LEU 45 -5.223 3.274 -3.563
328 H MET 46 HN MET 46 -5.215 6.476 0.894
329 HA MET 46 HA MET 46 -2.611 7.624 0.560
330 HB2 MET 46 HB2 MET 46 -4.630 8.768 2.532
331 HB3 MET 46 HB1 MET 46 -3.470 9.644 1.550
332 HG2 MET 46 HG2 MET 46 -4.788 8.879 -0.409
333 HG3 MET 46 HG1 MET 46 -5.921 8.281 0.811
334 HE1 MET 46 HE1 MET 46 -6.557 10.507 -1.517
335 HE2 MET 46 HE2 MET 46 -7.656 11.551 -0.612
336 HE3 MET 46 HE3 MET 46 -7.779 9.797 -0.462
337 H GLU 47 HN GLU 47 -4.444 6.602 3.285
338 HA GLU 47 HA GLU 47 -2.608 7.014 5.321
339 HB2 GLU 47 HB2 GLU 47 -5.049 5.677 4.761
340 HB3 GLU 47 HB1 GLU 47 -4.320 5.118 6.298
341 HG2 GLU 47 HG2 GLU 47 -4.246 7.770 6.609
342 HG3 GLU 47 HG1 GLU 47 -5.520 7.694 5.390
343 H THR 48 HN THR 48 -3.261 4.183 3.315
344 HA THR 48 HA THR 48 -1.586 2.299 4.493
345 HB THR 48 HB THR 48 -2.285 2.773 1.587
346 HG1 THR 48 HG1 THR 48 -4.038 2.287 3.044
347 HG21 THR 48 HG21 THR 48 -1.698 0.451 1.150
348 HG22 THR 48 HG22 THR 48 -1.110 0.260 2.814
349 HG23 THR 48 HG23 THR 48 -0.288 1.354 1.693
350 H ALA 49 HN ALA 49 -0.912 4.555 1.843
351 HA ALA 49 HA ALA 49 1.777 3.998 1.532
352 HB1 ALA 49 HB1 ALA 49 1.914 6.154 0.368
353 HB2 ALA 49 HB2 ALA 49 0.336 6.600 1.021
354 HB3 ALA 49 HB3 ALA 49 0.474 5.251 -0.103
355 H ALA 50 HN ALA 50 0.095 6.368 3.553
356 HA ALA 50 HA ALA 50 2.278 7.779 4.543
357 HB1 ALA 50 HB1 ALA 50 -0.026 8.552 4.729
358 HB2 ALA 50 HB2 ALA 50 0.795 8.594 6.293
359 HB3 ALA 50 HB3 ALA 50 -0.354 7.304 5.927
360 H ARG 51 HN ARG 51 0.784 4.821 5.837
361 HA ARG 51 HA ARG 51 2.328 4.708 8.217
362 HB2 ARG 51 HB2 ARG 51 0.319 3.288 7.932
363 HB3 ARG 51 HB1 ARG 51 1.072 2.433 6.608
364 HG2 ARG 51 HG2 ARG 51 2.155 2.298 9.441
365 HG3 ARG 51 HG1 ARG 51 0.896 1.215 8.862
366 HD2 ARG 51 HD2 ARG 51 2.443 0.442 7.073
367 HD3 ARG 51 HD1 ARG 51 3.689 1.498 7.727
368 HE ARG 51 HE ARG 51 2.971 -0.149 9.816
369 HH11 ARG 51 HH11 ARG 51 4.337 -0.552 6.577
370 HH12 ARG 51 HH12 ARG 51 5.057 -2.058 6.877
371 HH21 ARG 51 HH21 ARG 51 4.073 -2.318 10.260
372 HH22 ARG 51 HH22 ARG 51 4.891 -3.030 8.933
373 H LEU 52 HN LEU 52 2.937 3.721 4.959
374 HA LEU 52 HA LEU 52 5.339 2.305 5.577
375 HB2 LEU 52 HB2 LEU 52 4.449 3.374 2.893
376 HB3 LEU 52 HB1 LEU 52 5.604 2.092 3.186
377 HG LEU 52 HG LEU 52 2.622 1.990 3.646
378 HD11 LEU 52 HD11 LEU 52 3.218 1.765 1.343
379 HD12 LEU 52 HD12 LEU 52 2.631 0.236 1.987
380 HD13 LEU 52 HD13 LEU 52 4.364 0.484 1.738
381 HD21 LEU 52 HD21 LEU 52 2.979 -0.387 4.254
382 HD22 LEU 52 HD22 LEU 52 3.609 0.763 5.424
383 HD23 LEU 52 HD23 LEU 52 4.717 -0.061 4.335
384 H GLU 53 HN GLU 53 4.516 5.505 4.346
385 HA GLU 53 HA GLU 53 7.085 6.487 3.884
386 HB2 GLU 53 HB2 GLU 53 4.607 7.976 4.756
387 HB3 GLU 53 HB1 GLU 53 6.094 8.750 4.234
388 HG2 GLU 53 HG2 GLU 53 5.844 7.675 2.039
389 HG3 GLU 53 HG1 GLU 53 4.314 6.978 2.583
390 H SER 54 HN SER 54 5.103 6.728 6.802
391 HA SER 54 HA SER 54 6.978 8.246 8.239
392 HB2 SER 54 HB2 SER 54 5.524 7.585 10.216
393 HB3 SER 54 HB1 SER 54 4.713 8.416 8.886
394 HG SER 54 HG SER 54 3.704 6.619 8.326
395 H ARG 55 HN ARG 55 6.652 4.802 7.833
396 HA ARG 55 HA ARG 55 8.389 4.284 10.100
397 HB2 ARG 55 HB2 ARG 55 6.501 2.723 9.502
398 HB3 ARG 55 HB1 ARG 55 7.420 2.249 8.081
399 HG2 ARG 55 HG2 ARG 55 9.257 1.485 9.561
400 HG3 ARG 55 HG1 ARG 55 8.259 1.893 10.957
401 HD2 ARG 55 HD2 ARG 55 6.528 0.298 10.010
402 HD3 ARG 55 HD1 ARG 55 7.769 -0.230 8.878
403 HE ARG 55 HE ARG 55 8.541 -0.294 11.651
404 HH11 ARG 55 HH11 ARG 55 7.522 -2.273 8.886
405 HH12 ARG 55 HH12 ARG 55 7.490 -3.726 9.756
406 HH21 ARG 55 HH21 ARG 55 8.578 -2.295 12.810
407 HH22 ARG 55 HH22 ARG 55 8.081 -3.760 12.064
408 H TYR 56 HN TYR 56 8.582 3.994 6.554
409 HA TYR 56 HA TYR 56 11.333 3.086 6.845
410 HB2 TYR 56 HB2 TYR 56 9.551 3.089 4.408
411 HB3 TYR 56 HB1 TYR 56 11.170 2.397 4.495
412 HD1 TYR 56 HD1 TYR 56 11.589 0.481 6.064
413 HD2 TYR 56 HD2 TYR 56 7.671 1.879 5.182
414 HE1 TYR 56 HE1 TYR 56 10.665 -1.665 6.808
415 HE2 TYR 56 HE2 TYR 56 6.735 -0.263 5.935
416 HH TYR 56 HH TYR 56 8.569 -2.568 7.636
417 H GLY 57 HN GLY 57 9.925 5.990 6.595
418 HA2 GLY 57 HA2 GLY 57 10.874 8.041 6.298
419 HA3 GLY 57 HA1 GLY 57 12.394 7.243 5.952
420 H VAL 58 HN VAL 58 9.451 6.664 4.176
421 HA VAL 58 HA VAL 58 10.813 7.765 1.831
422 HB VAL 58 HB VAL 58 9.241 6.470 0.403
423 HG11 VAL 58 HG11 VAL 58 10.062 4.246 0.854
424 HG12 VAL 58 HG12 VAL 58 10.601 4.758 2.456
425 HG13 VAL 58 HG13 VAL 58 11.355 5.436 1.009
426 HG21 VAL 58 HG21 VAL 58 8.193 5.352 2.999
427 HG22 VAL 58 HG22 VAL 58 7.807 4.744 1.393
428 HG23 VAL 58 HG23 VAL 58 7.314 6.372 1.861
429 H SER 59 HN SER 59 9.127 8.585 0.104
430 HA SER 59 HA SER 59 6.818 9.862 1.267
431 HB2 SER 59 HB2 SER 59 9.060 11.498 0.065
432 HB3 SER 59 HB1 SER 59 7.460 12.117 0.471
433 HG SER 59 HG SER 59 8.389 10.798 2.536
434 H ILE 60 HN ILE 60 5.271 9.486 -0.057
435 HA ILE 60 HA ILE 60 5.771 9.531 -2.954
436 HB ILE 60 HB ILE 60 3.894 7.668 -1.423
437 HG12 ILE 60 HG12 ILE 60 5.107 5.845 -2.726
438 HG13 ILE 60 HG11 ILE 60 6.293 7.065 -3.181
439 HG21 ILE 60 HG21 ILE 60 4.065 8.012 -4.407
440 HG22 ILE 60 HG22 ILE 60 2.717 8.454 -3.358
441 HG23 ILE 60 HG23 ILE 60 3.148 6.755 -3.572
442 HD11 ILE 60 HD11 ILE 60 5.651 6.131 -0.388
443 HD12 ILE 60 HD12 ILE 60 6.847 7.354 -0.815
444 HD13 ILE 60 HD13 ILE 60 7.068 5.684 -1.341
445 HA PRO 61 HA PRO 61 2.770 12.847 -2.680
446 HB2 PRO 61 HB2 PRO 61 2.198 12.836 -5.411
447 HB3 PRO 61 HB1 PRO 61 3.486 13.768 -4.642
448 HG2 PRO 61 HG2 PRO 61 3.632 11.171 -6.094
449 HG3 PRO 61 HG1 PRO 61 4.796 12.510 -6.054
450 HD2 PRO 61 HD2 PRO 61 5.165 10.226 -4.671
451 HD3 PRO 61 HD1 PRO 61 5.728 11.790 -4.058
452 H ASP 62 HN ASP 62 0.641 12.825 -2.367
453 HA ASP 62 HA ASP 62 -0.915 10.596 -1.991
454 HB2 ASP 62 HB2 ASP 62 -1.923 13.345 -2.772
455 HB3 ASP 62 HB1 ASP 62 -2.887 12.077 -2.037
456 H ASP 63 HN ASP 63 -0.843 12.634 -4.826
457 HA ASP 63 HA ASP 63 -2.842 11.714 -6.416
458 HB2 ASP 63 HB2 ASP 63 -0.077 12.587 -7.248
459 HB3 ASP 63 HB1 ASP 63 -1.451 12.412 -8.332
460 H VAL 64 HN VAL 64 0.345 10.258 -6.019
461 HA VAL 64 HA VAL 64 -0.029 8.528 -8.271
462 HB VAL 64 HB VAL 64 2.190 8.470 -6.198
463 HG11 VAL 64 HG11 VAL 64 3.496 7.281 -7.907
464 HG12 VAL 64 HG12 VAL 64 2.079 7.240 -8.954
465 HG13 VAL 64 HG13 VAL 64 2.068 6.370 -7.424
466 HG21 VAL 64 HG21 VAL 64 2.089 10.615 -7.311
467 HG22 VAL 64 HG22 VAL 64 2.077 9.827 -8.889
468 HG23 VAL 64 HG23 VAL 64 3.503 9.716 -7.856
469 H ALA 65 HN ALA 65 -0.861 8.354 -4.980
470 HA ALA 65 HA ALA 65 -0.762 5.533 -4.674
471 HB1 ALA 65 HB1 ALA 65 -2.463 7.552 -3.202
472 HB2 ALA 65 HB2 ALA 65 -0.833 7.064 -2.745
473 HB3 ALA 65 HB3 ALA 65 -2.151 5.893 -2.696
474 H GLY 66 HN GLY 66 -3.081 7.785 -5.951
475 HA2 GLY 66 HA2 GLY 66 -5.137 5.731 -6.173
476 HA3 GLY 66 HA1 GLY 66 -5.305 7.424 -6.615
477 H ARG 67 HN ARG 67 -2.451 6.025 -7.809
478 HA ARG 67 HA ARG 67 -3.666 5.821 -10.462
479 HB2 ARG 67 HB2 ARG 67 -0.810 6.344 -9.647
480 HB3 ARG 67 HB1 ARG 67 -1.371 6.183 -11.297
481 HG2 ARG 67 HG2 ARG 67 -2.263 8.307 -9.352
482 HG3 ARG 67 HG1 ARG 67 -1.061 8.524 -10.627
483 HD2 ARG 67 HD2 ARG 67 -2.720 8.109 -12.326
484 HD3 ARG 67 HD1 ARG 67 -3.928 7.719 -11.104
485 HE ARG 67 HE ARG 67 -3.496 10.119 -10.343
486 HH11 ARG 67 HH11 ARG 67 -3.425 9.083 -13.759
487 HH12 ARG 67 HH12 ARG 67 -4.006 10.587 -14.322
488 HH21 ARG 67 HH21 ARG 67 -4.247 12.246 -11.248
489 HH22 ARG 67 HH22 ARG 67 -4.437 12.323 -12.953
490 H VAL 68 HN VAL 68 -2.912 3.848 -8.031
491 HA VAL 68 HA VAL 68 -1.809 1.828 -9.814
492 HB VAL 68 HB VAL 68 -1.244 0.449 -7.787
493 HG11 VAL 68 HG11 VAL 68 0.417 1.895 -8.778
494 HG12 VAL 68 HG12 VAL 68 0.595 1.816 -7.027
495 HG13 VAL 68 HG13 VAL 68 -0.138 3.237 -7.779
496 HG21 VAL 68 HG21 VAL 68 -2.111 2.898 -6.247
497 HG22 VAL 68 HG22 VAL 68 -1.324 1.463 -5.588
498 HG23 VAL 68 HG23 VAL 68 -2.952 1.347 -6.264
499 H ASP 69 HN ASP 69 -2.642 -0.514 -8.947
500 HA ASP 69 HA ASP 69 -5.591 -0.380 -8.812
501 HB2 ASP 69 HB2 ASP 69 -4.943 -0.675 -11.182
502 HB3 ASP 69 HB1 ASP 69 -3.915 -2.004 -10.725
503 H THR 70 HN THR 70 -2.753 -2.428 -8.803
504 HA THR 70 HA THR 70 -3.999 -4.158 -6.801
505 HB THR 70 HB THR 70 -2.443 -5.882 -7.642
506 HG1 THR 70 HG1 THR 70 -1.630 -3.818 -9.463
507 HG21 THR 70 HG21 THR 70 -3.346 -6.083 -9.956
508 HG22 THR 70 HG22 THR 70 -3.933 -4.408 -9.821
509 HG23 THR 70 HG23 THR 70 -4.593 -5.658 -8.778
510 HA PRO 71 HA PRO 71 -1.073 -2.832 -3.725
511 HB2 PRO 71 HB2 PRO 71 -0.664 -5.720 -3.115
512 HB3 PRO 71 HB1 PRO 71 -1.122 -4.391 -2.040
513 HG2 PRO 71 HG2 PRO 71 -2.946 -6.129 -2.817
514 HG3 PRO 71 HG1 PRO 71 -3.332 -4.396 -2.756
515 HD2 PRO 71 HD2 PRO 71 -2.647 -6.106 -5.121
516 HD3 PRO 71 HD1 PRO 71 -3.914 -4.875 -4.952
517 H ARG 72 HN ARG 72 -0.069 -5.330 -6.017
518 HA ARG 72 HA ARG 72 2.664 -5.214 -5.267
519 HB2 ARG 72 HB2 ARG 72 3.201 -6.419 -7.312
520 HB3 ARG 72 HB1 ARG 72 1.825 -7.149 -6.518
521 HG2 ARG 72 HG2 ARG 72 0.357 -5.981 -8.176
522 HG3 ARG 72 HG1 ARG 72 1.826 -5.469 -9.015
523 HD2 ARG 72 HD2 ARG 72 0.970 -8.312 -8.471
524 HD3 ARG 72 HD1 ARG 72 0.920 -7.489 -10.025
525 HE ARG 72 HE ARG 72 3.484 -7.303 -9.551
526 HH11 ARG 72 HH11 ARG 72 1.376 -10.136 -8.954
527 HH12 ARG 72 HH12 ARG 72 2.601 -11.284 -9.134
528 HH21 ARG 72 HH21 ARG 72 5.185 -8.962 -9.899
529 HH22 ARG 72 HH22 ARG 72 4.777 -10.615 -9.775
530 H GLU 73 HN GLU 73 0.727 -3.261 -7.340
531 HA GLU 73 HA GLU 73 2.916 -1.919 -8.589
532 HB2 GLU 73 HB2 GLU 73 0.020 -1.138 -8.257
533 HB3 GLU 73 HB1 GLU 73 1.175 -0.307 -9.290
534 HG2 GLU 73 HG2 GLU 73 1.376 -2.171 -10.723
535 HG3 GLU 73 HG1 GLU 73 0.503 -3.211 -9.600
536 H LEU 74 HN LEU 74 0.815 -1.329 -5.835
537 HA LEU 74 HA LEU 74 1.768 1.220 -5.058
538 HB2 LEU 74 HB2 LEU 74 -0.298 -0.126 -4.169
539 HB3 LEU 74 HB1 LEU 74 0.929 -0.945 -3.201
540 HG LEU 74 HG LEU 74 -0.428 0.908 -1.975
541 HD11 LEU 74 HD11 LEU 74 1.430 1.707 -0.713
542 HD12 LEU 74 HD12 LEU 74 2.533 1.134 -1.972
543 HD13 LEU 74 HD13 LEU 74 1.573 -0.024 -1.049
544 HD21 LEU 74 HD21 LEU 74 0.350 3.185 -2.308
545 HD22 LEU 74 HD22 LEU 74 -0.396 2.558 -3.776
546 HD23 LEU 74 HD23 LEU 74 1.360 2.661 -3.655
547 H LEU 75 HN LEU 75 2.602 -2.046 -4.027
548 HA LEU 75 HA LEU 75 4.576 -1.502 -2.185
549 HB2 LEU 75 HB2 LEU 75 3.494 -3.609 -2.414
550 HB3 LEU 75 HB1 LEU 75 4.104 -3.806 -4.040
551 HG LEU 75 HG LEU 75 6.351 -3.795 -3.104
552 HD11 LEU 75 HD11 LEU 75 5.956 -2.796 -0.941
553 HD12 LEU 75 HD12 LEU 75 6.604 -4.423 -0.697
554 HD13 LEU 75 HD13 LEU 75 4.879 -4.119 -0.488
555 HD21 LEU 75 HD21 LEU 75 6.222 -6.173 -2.417
556 HD22 LEU 75 HD22 LEU 75 5.265 -5.762 -3.856
557 HD23 LEU 75 HD23 LEU 75 4.463 -5.978 -2.306
558 H ASP 76 HN ASP 76 4.729 -1.924 -5.680
559 HA ASP 76 HA ASP 76 7.543 -2.033 -5.924
560 HB2 ASP 76 HB2 ASP 76 5.916 -2.772 -7.683
561 HB3 ASP 76 HB1 ASP 76 5.545 -1.079 -7.972
562 H LEU 77 HN LEU 77 5.185 0.579 -6.056
563 HA LEU 77 HA LEU 77 6.867 2.722 -6.693
564 HB2 LEU 77 HB2 LEU 77 4.481 2.656 -4.859
565 HB3 LEU 77 HB1 LEU 77 5.220 4.113 -5.467
566 HG LEU 77 HG LEU 77 3.802 2.018 -7.096
567 HD11 LEU 77 HD11 LEU 77 2.098 3.731 -7.389
568 HD12 LEU 77 HD12 LEU 77 3.020 4.837 -6.368
569 HD13 LEU 77 HD13 LEU 77 2.327 3.364 -5.677
570 HD21 LEU 77 HD21 LEU 77 5.603 3.072 -8.361
571 HD22 LEU 77 HD22 LEU 77 4.999 4.665 -7.914
572 HD23 LEU 77 HD23 LEU 77 4.031 3.614 -8.951
573 H ILE 78 HN ILE 78 5.908 1.370 -3.597
574 HA ILE 78 HA ILE 78 7.379 3.066 -1.884
575 HB ILE 78 HB ILE 78 6.640 0.162 -1.446
576 HG12 ILE 78 HG12 ILE 78 4.659 1.483 -1.980
577 HG13 ILE 78 HG11 ILE 78 4.648 1.021 -0.286
578 HG21 ILE 78 HG21 ILE 78 7.308 2.334 0.546
579 HG22 ILE 78 HG22 ILE 78 8.314 0.946 0.143
580 HG23 ILE 78 HG23 ILE 78 6.759 0.704 0.949
581 HD11 ILE 78 HD11 ILE 78 5.386 3.273 0.328
582 HD12 ILE 78 HD12 ILE 78 3.884 3.309 -0.590
583 HD13 ILE 78 HD13 ILE 78 5.410 3.729 -1.373
584 H ASN 79 HN ASN 79 8.175 -0.121 -3.217
585 HA ASN 79 HA ASN 79 10.722 -0.350 -2.104
586 HB2 ASN 79 HB2 ASN 79 9.676 -1.474 -4.710
587 HB3 ASN 79 HB1 ASN 79 11.246 -1.893 -4.038
588 HD21 ASN 79 HD21 ASN 79 10.217 -1.879 -1.271
589 HD22 ASN 79 HD22 ASN 79 9.307 -3.341 -1.119
590 H GLY 80 HN GLY 80 9.797 1.100 -5.217
591 HA2 GLY 80 HA2 GLY 80 12.388 1.822 -6.033
592 HA3 GLY 80 HA1 GLY 80 10.899 2.596 -6.557
593 H ALA 81 HN ALA 81 9.943 3.650 -4.233
594 HA ALA 81 HA ALA 81 11.488 6.005 -3.961
595 HB1 ALA 81 HB1 ALA 81 9.057 5.981 -3.747
596 HB2 ALA 81 HB2 ALA 81 9.817 6.678 -2.317
597 HB3 ALA 81 HB3 ALA 81 9.189 5.027 -2.269
598 H LEU 82 HN LEU 82 11.336 3.047 -2.124
599 HA LEU 82 HA LEU 82 12.592 3.974 0.212
600 HB2 LEU 82 HB2 LEU 82 11.152 2.057 0.197
601 HB3 LEU 82 HB1 LEU 82 12.176 1.230 -0.959
602 HG LEU 82 HG LEU 82 13.927 1.131 0.701
603 HD11 LEU 82 HD11 LEU 82 13.372 1.585 3.094
604 HD12 LEU 82 HD12 LEU 82 11.822 2.249 2.576
605 HD13 LEU 82 HD13 LEU 82 13.325 3.043 2.101
606 HD21 LEU 82 HD21 LEU 82 11.288 -0.058 1.521
607 HD22 LEU 82 HD22 LEU 82 12.862 -0.602 2.100
608 HD23 LEU 82 HD23 LEU 82 12.455 -0.741 0.391
609 H ALA 83 HN ALA 83 13.699 2.654 -2.841
610 HA ALA 83 HA ALA 83 16.357 2.168 -2.089
611 HB1 ALA 83 HB1 ALA 83 16.859 2.202 -4.495
612 HB2 ALA 83 HB2 ALA 83 15.274 2.908 -4.815
613 HB3 ALA 83 HB3 ALA 83 15.397 1.274 -4.153
614 H GLU 84 HN GLU 84 14.613 5.061 -2.963
615 HA GLU 84 HA GLU 84 16.852 6.812 -3.234
616 HB2 GLU 84 HB2 GLU 84 13.900 7.199 -2.803
617 HB3 GLU 84 HB1 GLU 84 15.026 8.519 -3.023
618 HG2 GLU 84 HG2 GLU 84 14.561 6.336 -5.032
619 HG3 GLU 84 HG1 GLU 84 13.713 7.877 -5.038
620 H ALA 85 HN ALA 85 14.453 6.037 -0.754
621 HA ALA 85 HA ALA 85 15.192 8.003 1.108
622 HB1 ALA 85 HB1 ALA 85 13.800 6.816 2.680
623 HB2 ALA 85 HB2 ALA 85 13.766 5.405 1.621
624 HB3 ALA 85 HB3 ALA 85 13.013 6.916 1.104
625 H ALA 86 HN ALA 86 16.109 4.554 0.956
626 HA ALA 86 HA ALA 86 17.888 5.044 3.222
627 HB1 ALA 86 HB1 ALA 86 17.946 2.606 3.466
628 HB2 ALA 86 HB2 ALA 86 16.934 2.439 2.034
629 HB3 ALA 86 HB3 ALA 86 16.286 3.209 3.480
630 H28A SDO 101 H28A SDO 42 -11.900 11.135 0.116
631 H28B SDO 101 H28B SDO 42 -10.235 10.677 -0.263
632 H30A SDO 101 H30A SDO 42 -10.107 14.332 -0.010
633 H30B SDO 101 H30B SDO 42 -9.505 12.806 0.644
634 H30C SDO 101 H30C SDO 42 -11.167 13.302 0.949
635 H31A SDO 101 H31A SDO 42 -9.430 13.625 -2.333
636 H31B SDO 101 H31B SDO 42 -9.940 12.045 -2.932
637 H31C SDO 101 H31C SDO 42 -8.796 12.155 -1.596
638 H32A SDO 101 H32A SDO 42 -12.472 12.684 -2.464
639 H33A SDO 101 H33A SDO 42 -11.597 15.187 -1.481
640 H36A SDO 101 H36A SDO 42 -13.765 15.106 -1.551
641 H37A SDO 101 H37A SDO 42 -16.048 14.866 -0.567
642 H37B SDO 101 H37B SDO 42 -15.264 14.115 0.825
643 H38A SDO 101 H38A SDO 42 -14.876 16.986 -0.065
644 H38B SDO 101 H38B SDO 42 -15.974 16.459 1.186
645 H41A SDO 101 H41A SDO 42 -13.625 14.374 1.719
646 H42A SDO 101 H42A SDO 42 -11.344 15.412 2.573
647 H42B SDO 101 H42B SDO 42 -12.436 15.851 3.890
648 H43A SDO 101 H43A SDO 42 -12.002 13.103 2.804
649 H43B SDO 101 H43B SDO 42 -12.903 13.492 4.264
650 H1A SDO 101 H1A SDO 42 -9.279 15.033 5.924
651 H1B SDO 101 H1B SDO 42 -8.464 14.542 4.459
652 H2A SDO 101 H2A SDO 42 -10.735 16.485 4.586
653 H2B SDO 101 H2B SDO 42 -9.840 16.035 3.164
654 H4A SDO 101 H4A SDO 42 -7.511 18.298 5.908
655 H4B SDO 101 H4B SDO 42 -6.654 17.786 4.482
656 H5A SDO 101 H5A SDO 42 -6.806 15.453 5.174
657 H5B SDO 101 H5B SDO 42 -7.628 15.970 6.649
658 H6A SDO 101 H6A SDO 42 -5.701 17.272 7.311
659 H6B SDO 101 H6B SDO 42 -4.867 16.843 5.820
660 H8A SDO 101 H8A SDO 42 -6.271 13.888 6.258
661 H8B SDO 101 H8B SDO 42 -6.452 13.925 8.020
662 H8C SDO 101 H8C SDO 42 -5.053 13.127 7.293
Start of MODEL 6
1 H1 MET 1 HT1 MET 1 20.248 -3.800 -0.542
2 H2 MET 1 HT2 MET 1 19.235 -5.121 -0.117
3 H3 MET 1 HT3 MET 1 20.566 -4.751 0.805
4 HA MET 1 HA MET 1 19.738 -2.839 1.676
5 HB2 MET 1 HB2 MET 1 17.325 -3.264 -0.110
6 HB3 MET 1 HB1 MET 1 17.459 -2.031 1.129
7 HG2 MET 1 HG2 MET 1 19.342 -1.031 -0.094
8 HG3 MET 1 HG1 MET 1 19.159 -2.263 -1.335
9 HE1 MET 1 HE1 MET 1 17.606 0.915 0.352
10 HE2 MET 1 HE2 MET 1 16.364 -0.298 0.653
11 HE3 MET 1 HE3 MET 1 16.046 1.035 -0.458
12 H ALA 2 HN ALA 2 19.580 -3.681 3.601
13 HA ALA 2 HA ALA 2 18.252 -6.147 4.115
14 HB1 ALA 2 HB1 ALA 2 20.193 -5.405 5.422
15 HB2 ALA 2 HB2 ALA 2 18.812 -5.780 6.456
16 HB3 ALA 2 HB3 ALA 2 19.223 -4.100 6.111
17 H THR 3 HN THR 3 17.415 -2.782 4.733
18 HA THR 3 HA THR 3 14.826 -3.639 5.698
19 HB THR 3 HB THR 3 14.522 -1.104 6.071
20 HG1 THR 3 HG1 THR 3 16.105 0.168 5.571
21 HG21 THR 3 HG21 THR 3 14.988 -2.680 7.889
22 HG22 THR 3 HG22 THR 3 15.837 -1.150 8.149
23 HG23 THR 3 HG23 THR 3 16.715 -2.561 7.551
24 H LEU 4 HN LEU 4 14.217 -4.497 3.633
25 HA LEU 4 HA LEU 4 13.312 -2.450 1.733
26 HB2 LEU 4 HB2 LEU 4 14.901 -4.328 0.960
27 HB3 LEU 4 HB1 LEU 4 13.585 -5.437 1.279
28 HG LEU 4 HG LEU 4 12.259 -4.114 -0.404
29 HD11 LEU 4 HD11 LEU 4 14.984 -2.942 -0.966
30 HD12 LEU 4 HD12 LEU 4 13.571 -2.074 -0.364
31 HD13 LEU 4 HD13 LEU 4 13.557 -2.761 -1.988
32 HD21 LEU 4 HD21 LEU 4 14.786 -5.484 -1.328
33 HD22 LEU 4 HD22 LEU 4 13.351 -5.199 -2.314
34 HD23 LEU 4 HD23 LEU 4 13.262 -6.277 -0.919
35 H LEU 5 HN LEU 5 11.041 -2.614 1.177
36 HA LEU 5 HA LEU 5 9.481 -3.821 3.309
37 HB2 LEU 5 HB2 LEU 5 9.180 -1.461 2.223
38 HB3 LEU 5 HB1 LEU 5 8.437 -2.320 0.907
39 HG LEU 5 HG LEU 5 7.354 -2.461 3.731
40 HD11 LEU 5 HD11 LEU 5 7.337 -0.161 2.990
41 HD12 LEU 5 HD12 LEU 5 5.699 -0.828 3.008
42 HD13 LEU 5 HD13 LEU 5 6.563 -0.639 1.482
43 HD21 LEU 5 HD21 LEU 5 5.306 -3.141 2.640
44 HD22 LEU 5 HD22 LEU 5 6.623 -4.234 2.200
45 HD23 LEU 5 HD23 LEU 5 6.084 -3.001 1.065
46 H THR 6 HN THR 6 8.567 -5.819 3.098
47 HA THR 6 HA THR 6 8.681 -7.010 0.435
48 HB THR 6 HB THR 6 8.430 -9.191 1.570
49 HG1 THR 6 HG1 THR 6 8.434 -7.612 3.957
50 HG21 THR 6 HG21 THR 6 10.614 -7.474 2.779
51 HG22 THR 6 HG22 THR 6 10.698 -8.297 1.223
52 HG23 THR 6 HG23 THR 6 10.615 -9.233 2.714
53 H THR 7 HN THR 7 6.843 -8.915 0.343
54 HA THR 7 HA THR 7 4.393 -7.642 0.038
55 HB THR 7 HB THR 7 3.883 -10.295 0.031
56 HG1 THR 7 HG1 THR 7 5.935 -11.192 -0.856
57 HG21 THR 7 HG21 THR 7 5.338 -8.752 -2.151
58 HG22 THR 7 HG22 THR 7 3.598 -8.754 -1.876
59 HG23 THR 7 HG23 THR 7 4.399 -10.228 -2.387
60 H ASP 8 HN ASP 8 5.821 -9.729 2.472
61 HA ASP 8 HA ASP 8 3.501 -10.192 4.008
62 HB2 ASP 8 HB2 ASP 8 5.484 -11.588 4.230
63 HB3 ASP 8 HB1 ASP 8 6.404 -10.234 4.864
64 H ASP 9 HN ASP 9 5.956 -7.667 4.150
65 HA ASP 9 HA ASP 9 5.086 -6.372 6.516
66 HB2 ASP 9 HB2 ASP 9 6.373 -5.104 4.073
67 HB3 ASP 9 HB1 ASP 9 6.119 -4.296 5.607
68 H LEU 10 HN LEU 10 4.259 -5.836 3.131
69 HA LEU 10 HA LEU 10 2.403 -3.777 3.680
70 HB2 LEU 10 HB2 LEU 10 3.419 -4.034 1.470
71 HB3 LEU 10 HB1 LEU 10 2.601 -5.570 1.266
72 HG LEU 10 HG LEU 10 0.420 -4.386 1.306
73 HD11 LEU 10 HD11 LEU 10 2.091 -1.884 1.344
74 HD12 LEU 10 HD12 LEU 10 1.043 -2.458 2.635
75 HD13 LEU 10 HD13 LEU 10 0.349 -1.962 1.093
76 HD21 LEU 10 HD21 LEU 10 1.522 -4.894 -0.807
77 HD22 LEU 10 HD22 LEU 10 2.394 -3.365 -0.727
78 HD23 LEU 10 HD23 LEU 10 0.639 -3.372 -0.901
79 H ARG 11 HN ARG 11 2.092 -7.262 3.337
80 HA ARG 11 HA ARG 11 -0.688 -7.474 3.369
81 HB2 ARG 11 HB2 ARG 11 0.841 -9.374 2.898
82 HB3 ARG 11 HB1 ARG 11 1.329 -9.386 4.590
83 HG2 ARG 11 HG2 ARG 11 -0.970 -9.947 5.237
84 HG3 ARG 11 HG1 ARG 11 -1.442 -9.942 3.541
85 HD2 ARG 11 HD2 ARG 11 -1.084 -12.213 4.305
86 HD3 ARG 11 HD1 ARG 11 0.138 -11.773 3.114
87 HE ARG 11 HE ARG 11 1.558 -11.308 5.175
88 HH11 ARG 11 HH11 ARG 11 -0.890 -13.891 5.036
89 HH12 ARG 11 HH12 ARG 11 -0.080 -14.885 6.141
90 HH21 ARG 11 HH21 ARG 11 2.694 -12.727 6.610
91 HH22 ARG 11 HH22 ARG 11 2.000 -14.246 7.015
92 H ARG 12 HN ARG 12 1.586 -6.960 5.939
93 HA ARG 12 HA ARG 12 -0.288 -7.325 8.064
94 HB2 ARG 12 HB2 ARG 12 2.361 -5.867 7.996
95 HB3 ARG 12 HB1 ARG 12 1.431 -6.193 9.451
96 HG2 ARG 12 HG2 ARG 12 1.689 -8.567 9.132
97 HG3 ARG 12 HG1 ARG 12 2.549 -8.285 7.613
98 HD2 ARG 12 HD2 ARG 12 4.122 -8.763 9.371
99 HD3 ARG 12 HD1 ARG 12 4.296 -7.093 8.852
100 HE ARG 12 HE ARG 12 2.585 -6.979 10.984
101 HH11 ARG 12 HH11 ARG 12 5.901 -8.175 10.473
102 HH12 ARG 12 HH12 ARG 12 6.384 -7.919 12.078
103 HH21 ARG 12 HH21 ARG 12 3.261 -6.726 13.264
104 HH22 ARG 12 HH22 ARG 12 4.852 -7.171 13.690
105 H ALA 13 HN ALA 13 1.180 -4.454 6.618
106 HA ALA 13 HA ALA 13 -0.271 -2.595 8.142
107 HB1 ALA 13 HB1 ALA 13 0.557 -0.910 6.624
108 HB2 ALA 13 HB2 ALA 13 1.001 -2.152 5.451
109 HB3 ALA 13 HB3 ALA 13 1.830 -2.063 7.003
110 H LEU 14 HN LEU 14 -0.941 -3.911 4.908
111 HA LEU 14 HA LEU 14 -3.114 -2.229 4.370
112 HB2 LEU 14 HB2 LEU 14 -1.822 -3.548 2.699
113 HB3 LEU 14 HB1 LEU 14 -2.595 -5.001 3.298
114 HG LEU 14 HG LEU 14 -4.763 -4.184 2.528
115 HD11 LEU 14 HD11 LEU 14 -4.891 -2.171 1.127
116 HD12 LEU 14 HD12 LEU 14 -3.192 -1.821 1.489
117 HD13 LEU 14 HD13 LEU 14 -4.390 -1.788 2.771
118 HD21 LEU 14 HD21 LEU 14 -2.609 -4.077 0.423
119 HD22 LEU 14 HD22 LEU 14 -4.329 -4.313 0.115
120 HD23 LEU 14 HD23 LEU 14 -3.421 -5.528 1.014
121 H VAL 15 HN VAL 15 -2.867 -4.944 6.443
122 HA VAL 15 HA VAL 15 -5.747 -5.273 6.628
123 HB VAL 15 HB VAL 15 -3.486 -6.459 8.274
124 HG11 VAL 15 HG11 VAL 15 -5.184 -7.944 9.270
125 HG12 VAL 15 HG12 VAL 15 -6.454 -7.102 8.374
126 HG13 VAL 15 HG13 VAL 15 -5.551 -6.252 9.633
127 HG21 VAL 15 HG21 VAL 15 -5.318 -7.658 6.201
128 HG22 VAL 15 HG22 VAL 15 -4.136 -8.556 7.160
129 HG23 VAL 15 HG23 VAL 15 -3.594 -7.329 6.023
130 H GLU 16 HN GLU 16 -3.096 -4.020 8.653
131 HA GLU 16 HA GLU 16 -4.521 -3.226 10.887
132 HB2 GLU 16 HB2 GLU 16 -2.066 -1.924 9.709
133 HB3 GLU 16 HB1 GLU 16 -2.652 -1.705 11.356
134 HG2 GLU 16 HG2 GLU 16 -2.373 -4.124 11.713
135 HG3 GLU 16 HG1 GLU 16 -1.715 -4.257 10.103
136 H SER 17 HN SER 17 -4.006 -1.419 7.882
137 HA SER 17 HA SER 17 -5.229 0.912 8.995
138 HB2 SER 17 HB2 SER 17 -4.230 0.360 6.203
139 HB3 SER 17 HB1 SER 17 -4.760 1.932 6.816
140 HG SER 17 HG SER 17 -3.142 1.291 8.601
141 H ALA 18 HN ALA 18 -6.740 -1.776 8.211
142 HA ALA 18 HA ALA 18 -8.912 -0.606 6.704
143 HB1 ALA 18 HB1 ALA 18 -10.014 -2.806 7.045
144 HB2 ALA 18 HB2 ALA 18 -8.674 -3.298 8.088
145 HB3 ALA 18 HB3 ALA 18 -8.393 -2.985 6.376
146 H GLY 19 HN GLY 19 -10.093 0.837 7.741
147 HA2 GLY 19 HA2 GLY 19 -10.515 0.575 10.620
148 HA3 GLY 19 HA1 GLY 19 -10.829 2.013 9.656
149 H GLU 20 HN GLU 20 -12.600 1.666 7.921
150 HA GLU 20 HA GLU 20 -14.630 -0.014 9.096
151 HB2 GLU 20 HB2 GLU 20 -16.370 1.693 8.493
152 HB3 GLU 20 HB1 GLU 20 -15.317 2.128 9.824
153 HG2 GLU 20 HG2 GLU 20 -14.103 3.661 8.428
154 HG3 GLU 20 HG1 GLU 20 -14.999 3.124 7.004
155 H THR 21 HN THR 21 -14.476 -1.575 7.822
156 HA THR 21 HA THR 21 -15.839 -1.665 5.452
157 HB THR 21 HB THR 21 -13.747 -0.503 4.572
158 HG1 THR 21 HG1 THR 21 -13.250 -2.137 2.944
159 HG21 THR 21 HG21 THR 21 -12.093 -1.411 6.122
160 HG22 THR 21 HG22 THR 21 -11.619 -1.773 4.457
161 HG23 THR 21 HG23 THR 21 -12.337 -3.028 5.462
162 H ASP 22 HN ASP 22 -14.758 -4.054 4.546
163 HA ASP 22 HA ASP 22 -14.615 -5.540 7.060
164 HB2 ASP 22 HB2 ASP 22 -16.636 -6.070 5.850
165 HB3 ASP 22 HB1 ASP 22 -15.718 -6.580 4.431
166 H GLY 23 HN GLY 23 -12.811 -6.225 7.446
167 HA2 GLY 23 HA2 GLY 23 -10.720 -6.015 5.696
168 HA3 GLY 23 HA1 GLY 23 -10.615 -6.949 7.206
169 H THR 24 HN THR 24 -10.010 -7.187 4.070
170 HA THR 24 HA THR 24 -11.383 -9.573 3.406
171 HB THR 24 HB THR 24 -9.754 -9.316 1.392
172 HG1 THR 24 HG1 THR 24 -9.310 -6.861 1.386
173 HG21 THR 24 HG21 THR 24 -11.830 -7.197 2.012
174 HG22 THR 24 HG22 THR 24 -12.160 -8.783 1.308
175 HG23 THR 24 HG23 THR 24 -11.218 -7.593 0.403
176 H ASP 25 HN ASP 25 -9.550 -11.072 2.084
177 HA ASP 25 HA ASP 25 -7.701 -11.890 4.207
178 HB2 ASP 25 HB2 ASP 25 -9.374 -13.608 3.573
179 HB3 ASP 25 HB1 ASP 25 -8.781 -13.557 1.915
180 H LEU 26 HN LEU 26 -5.650 -11.693 3.800
181 HA LEU 26 HA LEU 26 -4.825 -11.117 1.032
182 HB2 LEU 26 HB2 LEU 26 -3.810 -10.087 3.667
183 HB3 LEU 26 HB1 LEU 26 -2.845 -10.001 2.211
184 HG LEU 26 HG LEU 26 -4.601 -8.527 1.211
185 HD11 LEU 26 HD11 LEU 26 -6.521 -9.200 2.553
186 HD12 LEU 26 HD12 LEU 26 -6.238 -7.468 2.632
187 HD13 LEU 26 HD13 LEU 26 -5.776 -8.492 3.992
188 HD21 LEU 26 HD21 LEU 26 -3.991 -6.566 2.531
189 HD22 LEU 26 HD22 LEU 26 -2.608 -7.612 2.198
190 HD23 LEU 26 HD23 LEU 26 -3.358 -7.625 3.789
191 H SER 27 HN SER 27 -4.978 -13.765 2.669
192 HA SER 27 HA SER 27 -2.102 -14.232 2.747
193 HB2 SER 27 HB2 SER 27 -3.546 -14.567 4.833
194 HB3 SER 27 HB1 SER 27 -4.154 -16.010 4.022
195 HG SER 27 HG SER 27 -2.491 -16.867 4.980
196 H GLY 28 HN GLY 28 -4.700 -14.772 0.941
197 HA2 GLY 28 HA2 GLY 28 -3.816 -17.309 -0.202
198 HA3 GLY 28 HA1 GLY 28 -5.180 -16.337 -0.767
199 H ASP 29 HN ASP 29 -4.511 -14.236 -1.440
200 HA ASP 29 HA ASP 29 -1.957 -13.610 -2.444
201 HB2 ASP 29 HB2 ASP 29 -2.482 -15.184 -4.279
202 HB3 ASP 29 HB1 ASP 29 -3.988 -14.316 -4.594
203 H PHE 30 HN PHE 30 -1.879 -11.548 -2.341
204 HA PHE 30 HA PHE 30 -4.364 -10.067 -2.802
205 HB2 PHE 30 HB2 PHE 30 -3.709 -8.453 -1.112
206 HB3 PHE 30 HB1 PHE 30 -3.635 -10.062 -0.404
207 HD1 PHE 30 HD2 PHE 30 -1.286 -11.178 -0.475
208 HD2 PHE 30 HD1 PHE 30 -1.938 -6.994 -0.784
209 HE1 PHE 30 HE2 PHE 30 1.030 -10.757 0.275
210 HE2 PHE 30 HE1 PHE 30 0.379 -6.568 -0.037
211 HZ PHE 30 HZ PHE 30 1.836 -8.369 0.481
212 H LEU 31 HN LEU 31 -1.807 -10.911 -4.387
213 HA LEU 31 HA LEU 31 -0.634 -8.359 -4.910
214 HB2 LEU 31 HB2 LEU 31 -0.027 -11.115 -5.913
215 HB3 LEU 31 HB1 LEU 31 0.713 -9.687 -6.596
216 HG LEU 31 HG LEU 31 2.275 -10.594 -5.098
217 HD11 LEU 31 HD11 LEU 31 0.930 -8.265 -3.742
218 HD12 LEU 31 HD12 LEU 31 2.171 -8.217 -4.989
219 HD13 LEU 31 HD13 LEU 31 2.553 -8.867 -3.397
220 HD21 LEU 31 HD21 LEU 31 1.801 -11.082 -2.725
221 HD22 LEU 31 HD22 LEU 31 0.841 -12.081 -3.818
222 HD23 LEU 31 HD23 LEU 31 0.098 -10.708 -3.007
223 H ASP 32 HN ASP 32 -2.823 -10.601 -6.475
224 HA ASP 32 HA ASP 32 -3.105 -8.560 -8.586
225 HB2 ASP 32 HB2 ASP 32 -2.444 -10.896 -9.312
226 HB3 ASP 32 HB1 ASP 32 -4.010 -11.446 -8.731
227 H LEU 33 HN LEU 33 -4.180 -8.741 -5.898
228 HA LEU 33 HA LEU 33 -7.063 -8.748 -6.394
229 HB2 LEU 33 HB2 LEU 33 -6.166 -10.124 -4.555
230 HB3 LEU 33 HB1 LEU 33 -5.436 -8.697 -3.841
231 HG LEU 33 HG LEU 33 -7.684 -7.798 -3.417
232 HD11 LEU 33 HD11 LEU 33 -8.864 -8.870 -5.266
233 HD12 LEU 33 HD12 LEU 33 -9.642 -9.241 -3.728
234 HD13 LEU 33 HD13 LEU 33 -8.605 -10.443 -4.514
235 HD21 LEU 33 HD21 LEU 33 -6.527 -9.121 -1.728
236 HD22 LEU 33 HD22 LEU 33 -7.234 -10.597 -2.401
237 HD23 LEU 33 HD23 LEU 33 -8.273 -9.380 -1.652
238 H ARG 34 HN ARG 34 -7.964 -6.759 -6.613
239 HA ARG 34 HA ARG 34 -6.205 -4.458 -6.657
240 HB2 ARG 34 HB2 ARG 34 -9.153 -4.687 -7.189
241 HB3 ARG 34 HB1 ARG 34 -8.229 -3.210 -7.352
242 HG2 ARG 34 HG2 ARG 34 -6.967 -4.151 -9.161
243 HG3 ARG 34 HG1 ARG 34 -7.752 -5.722 -8.930
244 HD2 ARG 34 HD2 ARG 34 -9.164 -3.144 -9.617
245 HD3 ARG 34 HD1 ARG 34 -8.800 -4.439 -10.765
246 HE ARG 34 HE ARG 34 -10.121 -5.869 -9.176
247 HH11 ARG 34 HH11 ARG 34 -10.887 -2.388 -9.632
248 HH12 ARG 34 HH12 ARG 34 -12.532 -2.596 -9.271
249 HH21 ARG 34 HH21 ARG 34 -12.420 -6.094 -8.693
250 HH22 ARG 34 HH22 ARG 34 -13.432 -4.724 -8.734
251 H PHE 35 HN PHE 35 -6.358 -2.612 -5.449
252 HA PHE 35 HA PHE 35 -7.220 -2.755 -2.764
253 HB2 PHE 35 HB2 PHE 35 -6.720 -0.318 -4.492
254 HB3 PHE 35 HB1 PHE 35 -7.049 -0.241 -2.769
255 HD1 PHE 35 HD2 PHE 35 -5.425 -1.456 -1.219
256 HD2 PHE 35 HD1 PHE 35 -4.563 -0.566 -5.288
257 HE1 PHE 35 HE2 PHE 35 -3.023 -1.660 -0.748
258 HE2 PHE 35 HE1 PHE 35 -2.163 -0.768 -4.820
259 HZ PHE 35 HZ PHE 35 -1.389 -1.316 -2.551
260 H GLU 36 HN GLU 36 -8.747 -1.712 -5.668
261 HA GLU 36 HA GLU 36 -11.002 -0.378 -4.677
262 HB2 GLU 36 HB2 GLU 36 -10.850 -2.061 -7.163
263 HB3 GLU 36 HB1 GLU 36 -11.943 -0.726 -6.848
264 HG2 GLU 36 HG2 GLU 36 -9.977 0.783 -6.775
265 HG3 GLU 36 HG1 GLU 36 -8.973 -0.583 -7.273
266 H ASP 37 HN ASP 37 -10.308 -3.751 -5.339
267 HA ASP 37 HA ASP 37 -13.007 -4.673 -5.065
268 HB2 ASP 37 HB2 ASP 37 -11.280 -5.744 -6.529
269 HB3 ASP 37 HB1 ASP 37 -10.449 -6.283 -5.074
270 H ILE 38 HN ILE 38 -10.253 -4.218 -3.012
271 HA ILE 38 HA ILE 38 -11.535 -5.732 -0.891
272 HB ILE 38 HB ILE 38 -9.456 -5.444 0.422
273 HG12 ILE 38 HG12 ILE 38 -8.375 -4.128 -2.081
274 HG13 ILE 38 HG11 ILE 38 -8.691 -3.309 -0.562
275 HG21 ILE 38 HG21 ILE 38 -9.020 -6.553 -2.342
276 HG22 ILE 38 HG22 ILE 38 -9.760 -7.394 -0.971
277 HG23 ILE 38 HG23 ILE 38 -8.069 -6.895 -0.895
278 HD11 ILE 38 HD11 ILE 38 -6.971 -4.686 0.522
279 HD12 ILE 38 HD12 ILE 38 -6.318 -3.763 -0.830
280 HD13 ILE 38 HD13 ILE 38 -6.646 -5.484 -1.012
281 H GLY 39 HN GLY 39 -12.271 -3.029 -1.944
282 HA2 GLY 39 HA2 GLY 39 -13.467 -1.294 -1.060
283 HA3 GLY 39 HA1 GLY 39 -13.342 -2.098 0.490
284 H TYR 40 HN TYR 40 -10.595 -0.910 -1.426
285 HA TYR 40 HA TYR 40 -10.174 0.991 0.730
286 HB2 TYR 40 HB2 TYR 40 -8.166 -0.342 -1.078
287 HB3 TYR 40 HB1 TYR 40 -7.825 1.230 -0.395
288 HD1 TYR 40 HD2 TYR 40 -8.763 -2.227 0.593
289 HD2 TYR 40 HD1 TYR 40 -7.158 1.521 1.751
290 HE1 TYR 40 HE2 TYR 40 -8.171 -3.177 2.760
291 HE2 TYR 40 HE1 TYR 40 -6.557 0.625 3.924
292 HH TYR 40 HH TYR 40 -6.480 -2.606 4.655
293 H ASP 41 HN ASP 41 -10.799 2.853 0.488
294 HA ASP 41 HA ASP 41 -11.155 4.007 -2.145
295 HB2 ASP 41 HB2 ASP 41 -11.751 5.218 0.579
296 HB3 ASP 41 HB1 ASP 41 -12.136 5.935 -0.971
297 H SER 42 HN SER 42 -10.668 6.449 -1.984
298 HA SER 42 HA SER 42 -8.021 6.914 -2.419
299 HB2 SER 42 HB2 SER 42 -9.949 8.282 -3.139
300 HB3 SER 42 HB1 SER 42 -10.117 8.864 -1.483
301 H LEU 43 HN LEU 43 -9.859 7.877 0.497
302 HA LEU 43 HA LEU 43 -7.671 8.930 1.913
303 HB2 LEU 43 HB2 LEU 43 -10.305 7.886 2.958
304 HB3 LEU 43 HB1 LEU 43 -9.137 8.758 3.924
305 HG LEU 43 HG LEU 43 -10.560 9.888 1.515
306 HD11 LEU 43 HD11 LEU 43 -12.104 9.488 3.361
307 HD12 LEU 43 HD12 LEU 43 -11.814 11.212 3.154
308 HD13 LEU 43 HD13 LEU 43 -11.025 10.335 4.465
309 HD21 LEU 43 HD21 LEU 43 -9.637 12.024 2.277
310 HD22 LEU 43 HD22 LEU 43 -8.347 10.875 1.918
311 HD23 LEU 43 HD23 LEU 43 -8.796 11.193 3.589
312 H ALA 44 HN ALA 44 -9.246 5.782 2.167
313 HA ALA 44 HA ALA 44 -7.688 4.680 4.157
314 HB1 ALA 44 HB1 ALA 44 -8.455 2.531 3.343
315 HB2 ALA 44 HB2 ALA 44 -8.952 3.270 1.818
316 HB3 ALA 44 HB3 ALA 44 -9.768 3.712 3.324
317 H LEU 45 HN LEU 45 -6.997 4.965 0.706
318 HA LEU 45 HA LEU 45 -4.761 3.247 0.635
319 HB2 LEU 45 HB2 LEU 45 -6.077 4.432 -1.308
320 HB3 LEU 45 HB1 LEU 45 -4.984 5.764 -1.023
321 HG LEU 45 HG LEU 45 -4.084 4.681 -2.865
322 HD11 LEU 45 HD11 LEU 45 -2.589 3.503 -0.578
323 HD12 LEU 45 HD12 LEU 45 -2.314 5.084 -1.323
324 HD13 LEU 45 HD13 LEU 45 -2.013 3.599 -2.240
325 HD21 LEU 45 HD21 LEU 45 -4.473 2.024 -1.539
326 HD22 LEU 45 HD22 LEU 45 -3.732 2.356 -3.121
327 HD23 LEU 45 HD23 LEU 45 -5.445 2.717 -2.858
328 H MET 46 HN MET 46 -5.130 6.728 1.209
329 HA MET 46 HA MET 46 -2.433 7.568 1.439
330 HB2 MET 46 HB2 MET 46 -4.570 8.628 3.268
331 HB3 MET 46 HB1 MET 46 -3.224 9.503 2.546
332 HG2 MET 46 HG2 MET 46 -4.408 9.153 0.350
333 HG3 MET 46 HG1 MET 46 -5.719 8.519 1.346
334 HE1 MET 46 HE1 MET 46 -4.231 12.877 1.760
335 HE2 MET 46 HE2 MET 46 -3.554 11.733 0.603
336 HE3 MET 46 HE3 MET 46 -3.330 11.473 2.332
337 H GLU 47 HN GLU 47 -4.759 6.671 3.811
338 HA GLU 47 HA GLU 47 -3.400 6.672 6.169
339 HB2 GLU 47 HB2 GLU 47 -5.585 5.313 4.901
340 HB3 GLU 47 HB1 GLU 47 -5.224 4.699 6.543
341 HG2 GLU 47 HG2 GLU 47 -6.111 7.402 5.539
342 HG3 GLU 47 HG1 GLU 47 -6.985 6.333 6.630
343 H THR 48 HN THR 48 -3.685 3.989 3.860
344 HA THR 48 HA THR 48 -2.154 2.091 5.273
345 HB THR 48 HB THR 48 -2.583 2.374 2.280
346 HG1 THR 48 HG1 THR 48 -4.583 2.209 3.419
347 HG21 THR 48 HG21 THR 48 -0.766 0.809 2.889
348 HG22 THR 48 HG22 THR 48 -2.144 -0.015 2.168
349 HG23 THR 48 HG23 THR 48 -1.892 -0.080 3.921
350 H ALA 49 HN ALA 49 -1.335 4.272 2.582
351 HA ALA 49 HA ALA 49 1.329 3.547 2.250
352 HB1 ALA 49 HB1 ALA 49 0.077 6.228 1.668
353 HB2 ALA 49 HB2 ALA 49 0.057 4.835 0.590
354 HB3 ALA 49 HB3 ALA 49 1.589 5.611 0.998
355 H ALA 50 HN ALA 50 -0.077 6.109 4.244
356 HA ALA 50 HA ALA 50 2.208 7.440 5.057
357 HB1 ALA 50 HB1 ALA 50 -0.298 6.970 6.670
358 HB2 ALA 50 HB2 ALA 50 -0.064 8.242 5.465
359 HB3 ALA 50 HB3 ALA 50 0.894 8.244 6.940
360 H ARG 51 HN ARG 51 0.767 4.569 6.370
361 HA ARG 51 HA ARG 51 2.249 4.254 8.757
362 HB2 ARG 51 HB2 ARG 51 0.108 3.085 7.978
363 HB3 ARG 51 HB1 ARG 51 1.116 2.100 6.955
364 HG2 ARG 51 HG2 ARG 51 1.256 2.128 9.979
365 HG3 ARG 51 HG1 ARG 51 0.315 0.988 9.024
366 HD2 ARG 51 HD2 ARG 51 2.558 0.441 7.895
367 HD3 ARG 51 HD1 ARG 51 3.291 1.243 9.286
368 HE ARG 51 HE ARG 51 1.341 -0.850 9.821
369 HH11 ARG 51 HH11 ARG 51 4.680 0.208 10.146
370 HH12 ARG 51 HH12 ARG 51 5.244 -1.311 10.729
371 HH21 ARG 51 HH21 ARG 51 2.095 -2.898 10.588
372 HH22 ARG 51 HH22 ARG 51 3.765 -3.139 10.891
373 H LEU 52 HN LEU 52 2.856 3.438 5.426
374 HA LEU 52 HA LEU 52 5.230 1.882 5.977
375 HB2 LEU 52 HB2 LEU 52 4.103 2.858 3.359
376 HB3 LEU 52 HB1 LEU 52 5.377 1.668 3.554
377 HG LEU 52 HG LEU 52 2.468 1.337 4.332
378 HD11 LEU 52 HD11 LEU 52 4.111 0.052 2.181
379 HD12 LEU 52 HD12 LEU 52 2.853 1.268 1.959
380 HD13 LEU 52 HD13 LEU 52 2.434 -0.330 2.580
381 HD21 LEU 52 HD21 LEU 52 3.088 -0.985 4.861
382 HD22 LEU 52 HD22 LEU 52 3.895 0.169 5.919
383 HD23 LEU 52 HD23 LEU 52 4.794 -0.590 4.605
384 H GLU 53 HN GLU 53 4.415 4.948 4.416
385 HA GLU 53 HA GLU 53 6.868 5.909 3.570
386 HB2 GLU 53 HB2 GLU 53 4.574 7.448 4.782
387 HB3 GLU 53 HB1 GLU 53 5.923 8.169 3.926
388 HG2 GLU 53 HG2 GLU 53 5.247 7.098 1.896
389 HG3 GLU 53 HG1 GLU 53 3.949 6.240 2.726
390 H SER 54 HN SER 54 5.352 6.413 6.747
391 HA SER 54 HA SER 54 7.314 8.133 7.737
392 HB2 SER 54 HB2 SER 54 5.013 7.854 8.657
393 HB3 SER 54 HB1 SER 54 5.516 6.306 9.342
394 HG SER 54 HG SER 54 5.866 8.816 10.202
395 H ARG 55 HN ARG 55 7.028 4.615 7.983
396 HA ARG 55 HA ARG 55 9.246 4.401 9.758
397 HB2 ARG 55 HB2 ARG 55 7.539 2.708 9.881
398 HB3 ARG 55 HB1 ARG 55 7.759 2.303 8.185
399 HG2 ARG 55 HG2 ARG 55 10.002 1.469 8.664
400 HG3 ARG 55 HG1 ARG 55 9.803 1.890 10.364
401 HD2 ARG 55 HD2 ARG 55 8.116 0.245 10.651
402 HD3 ARG 55 HD1 ARG 55 7.960 0.011 8.907
403 HE ARG 55 HE ARG 55 10.595 -0.524 9.922
404 HH11 ARG 55 HH11 ARG 55 7.412 -2.071 9.651
405 HH12 ARG 55 HH12 ARG 55 8.052 -3.606 9.285
406 HH21 ARG 55 HH21 ARG 55 11.428 -2.568 9.415
407 HH22 ARG 55 HH22 ARG 55 10.405 -3.889 9.028
408 H TYR 56 HN TYR 56 8.873 3.933 6.261
409 HA TYR 56 HA TYR 56 11.636 3.104 6.088
410 HB2 TYR 56 HB2 TYR 56 9.481 3.264 3.990
411 HB3 TYR 56 HB1 TYR 56 11.143 2.794 3.641
412 HD1 TYR 56 HD1 TYR 56 12.041 0.684 4.467
413 HD2 TYR 56 HD2 TYR 56 8.000 1.774 5.206
414 HE1 TYR 56 HE1 TYR 56 11.546 -1.632 5.138
415 HE2 TYR 56 HE2 TYR 56 7.491 -0.537 5.871
416 HH TYR 56 HH TYR 56 8.381 -2.805 5.551
417 H GLY 57 HN GLY 57 10.073 6.043 5.987
418 HA2 GLY 57 HA2 GLY 57 11.023 8.129 5.769
419 HA3 GLY 57 HA1 GLY 57 12.531 7.358 5.291
420 H VAL 58 HN VAL 58 9.455 6.808 3.742
421 HA VAL 58 HA VAL 58 10.498 8.201 1.361
422 HB VAL 58 HB VAL 58 9.495 6.593 -0.122
423 HG11 VAL 58 HG11 VAL 58 10.713 5.090 2.122
424 HG12 VAL 58 HG12 VAL 58 11.623 5.871 0.817
425 HG13 VAL 58 HG13 VAL 58 10.551 4.488 0.476
426 HG21 VAL 58 HG21 VAL 58 8.168 4.691 0.588
427 HG22 VAL 58 HG22 VAL 58 7.406 6.206 1.073
428 HG23 VAL 58 HG23 VAL 58 8.267 5.220 2.275
429 H SER 59 HN SER 59 8.403 8.549 -0.222
430 HA SER 59 HA SER 59 5.990 8.826 1.242
431 HB2 SER 59 HB2 SER 59 7.291 10.999 1.682
432 HB3 SER 59 HB1 SER 59 7.103 11.343 -0.041
433 HG SER 59 HG SER 59 4.808 10.586 1.301
434 H ILE 60 HN ILE 60 4.214 8.993 -0.143
435 HA ILE 60 HA ILE 60 4.814 8.676 -3.005
436 HB ILE 60 HB ILE 60 2.598 7.277 -1.448
437 HG12 ILE 60 HG12 ILE 60 5.067 6.119 -2.769
438 HG13 ILE 60 HG11 ILE 60 4.820 6.281 -1.037
439 HG21 ILE 60 HG21 ILE 60 2.106 6.107 -3.553
440 HG22 ILE 60 HG22 ILE 60 3.337 7.067 -4.365
441 HG23 ILE 60 HG23 ILE 60 1.892 7.855 -3.717
442 HD11 ILE 60 HD11 ILE 60 3.208 4.559 -2.911
443 HD12 ILE 60 HD12 ILE 60 2.929 4.732 -1.179
444 HD13 ILE 60 HD13 ILE 60 4.430 4.005 -1.762
445 HA PRO 61 HA PRO 61 2.294 12.356 -3.356
446 HB2 PRO 61 HB2 PRO 61 1.953 11.288 -6.114
447 HB3 PRO 61 HB1 PRO 61 2.464 12.895 -5.593
448 HG2 PRO 61 HG2 PRO 61 4.221 11.169 -6.569
449 HG3 PRO 61 HG1 PRO 61 4.646 12.211 -5.200
450 HD2 PRO 61 HD2 PRO 61 3.926 9.315 -5.232
451 HD3 PRO 61 HD1 PRO 61 5.132 10.165 -4.241
452 H ASP 62 HN ASP 62 0.198 12.707 -3.059
453 HA ASP 62 HA ASP 62 -1.757 10.977 -2.383
454 HB2 ASP 62 HB2 ASP 62 -2.150 13.596 -3.823
455 HB3 ASP 62 HB1 ASP 62 -3.393 12.743 -2.927
456 H ASP 63 HN ASP 63 -1.306 12.342 -5.613
457 HA ASP 63 HA ASP 63 -3.567 11.076 -6.765
458 HB2 ASP 63 HB2 ASP 63 -2.614 13.088 -7.763
459 HB3 ASP 63 HB1 ASP 63 -1.123 12.211 -8.117
460 H VAL 64 HN VAL 64 -0.184 10.225 -6.639
461 HA VAL 64 HA VAL 64 -0.336 8.128 -8.558
462 HB VAL 64 HB VAL 64 1.801 8.611 -6.454
463 HG11 VAL 64 HG11 VAL 64 3.278 7.316 -7.948
464 HG12 VAL 64 HG12 VAL 64 1.884 6.939 -8.969
465 HG13 VAL 64 HG13 VAL 64 1.949 6.350 -7.310
466 HG21 VAL 64 HG21 VAL 64 3.047 9.701 -8.255
467 HG22 VAL 64 HG22 VAL 64 1.525 10.530 -7.920
468 HG23 VAL 64 HG23 VAL 64 1.667 9.492 -9.338
469 H ALA 65 HN ALA 65 -0.898 8.278 -5.120
470 HA ALA 65 HA ALA 65 -0.668 5.566 -4.501
471 HB1 ALA 65 HB1 ALA 65 -0.723 7.367 -2.829
472 HB2 ALA 65 HB2 ALA 65 -1.965 6.158 -2.528
473 HB3 ALA 65 HB3 ALA 65 -2.401 7.703 -3.263
474 H GLY 66 HN GLY 66 -3.243 7.529 -5.838
475 HA2 GLY 66 HA2 GLY 66 -5.110 5.289 -5.822
476 HA3 GLY 66 HA1 GLY 66 -5.457 6.947 -6.299
477 H ARG 67 HN ARG 67 -2.549 5.922 -7.670
478 HA ARG 67 HA ARG 67 -3.935 5.373 -10.171
479 HB2 ARG 67 HB2 ARG 67 -1.242 6.585 -9.646
480 HB3 ARG 67 HB1 ARG 67 -1.770 6.068 -11.236
481 HG2 ARG 67 HG2 ARG 67 -3.213 8.117 -9.564
482 HG3 ARG 67 HG1 ARG 67 -2.001 8.523 -10.769
483 HD2 ARG 67 HD2 ARG 67 -4.225 8.821 -11.695
484 HD3 ARG 67 HD1 ARG 67 -3.412 7.495 -12.506
485 HE ARG 67 HE ARG 67 -4.805 6.055 -10.920
486 HH11 ARG 67 HH11 ARG 67 -5.975 9.233 -11.942
487 HH12 ARG 67 HH12 ARG 67 -7.592 8.734 -12.147
488 HH21 ARG 67 HH21 ARG 67 -7.040 5.348 -11.222
489 HH22 ARG 67 HH22 ARG 67 -8.200 6.455 -11.761
490 H VAL 68 HN VAL 68 -2.653 3.703 -7.803
491 HA VAL 68 HA VAL 68 -1.333 1.861 -9.595
492 HB VAL 68 HB VAL 68 -0.798 0.462 -7.535
493 HG11 VAL 68 HG11 VAL 68 0.072 3.329 -7.436
494 HG12 VAL 68 HG12 VAL 68 0.785 2.047 -8.413
495 HG13 VAL 68 HG13 VAL 68 0.872 1.964 -6.656
496 HG21 VAL 68 HG21 VAL 68 -2.020 2.807 -6.078
497 HG22 VAL 68 HG22 VAL 68 -1.064 1.519 -5.348
498 HG23 VAL 68 HG23 VAL 68 -2.628 1.146 -6.073
499 H ASP 69 HN ASP 69 -2.152 -0.608 -8.419
500 HA ASP 69 HA ASP 69 -5.056 -0.522 -8.958
501 HB2 ASP 69 HB2 ASP 69 -3.595 -1.097 -11.068
502 HB3 ASP 69 HB1 ASP 69 -3.325 -2.609 -10.256
503 H THR 70 HN THR 70 -2.383 -2.758 -8.518
504 HA THR 70 HA THR 70 -3.850 -4.045 -6.396
505 HB THR 70 HB THR 70 -2.530 -6.056 -7.115
506 HG1 THR 70 HG1 THR 70 -1.731 -5.699 -9.418
507 HG21 THR 70 HG21 THR 70 -4.822 -5.686 -7.941
508 HG22 THR 70 HG22 THR 70 -3.822 -6.454 -9.184
509 HG23 THR 70 HG23 THR 70 -4.162 -4.721 -9.266
510 HA PRO 71 HA PRO 71 -0.780 -2.951 -3.379
511 HB2 PRO 71 HB2 PRO 71 -0.485 -5.911 -3.060
512 HB3 PRO 71 HB1 PRO 71 -0.620 -4.648 -1.827
513 HG2 PRO 71 HG2 PRO 71 -2.757 -6.038 -2.415
514 HG3 PRO 71 HG1 PRO 71 -2.878 -4.271 -2.254
515 HD2 PRO 71 HD2 PRO 71 -2.841 -5.949 -4.730
516 HD3 PRO 71 HD1 PRO 71 -3.772 -4.481 -4.367
517 H ARG 72 HN ARG 72 0.158 -5.361 -5.757
518 HA ARG 72 HA ARG 72 2.904 -5.440 -5.115
519 HB2 ARG 72 HB2 ARG 72 3.262 -6.515 -7.241
520 HB3 ARG 72 HB1 ARG 72 1.747 -7.113 -6.583
521 HG2 ARG 72 HG2 ARG 72 0.501 -5.676 -8.081
522 HG3 ARG 72 HG1 ARG 72 2.009 -4.994 -8.704
523 HD2 ARG 72 HD2 ARG 72 1.375 -6.588 -10.293
524 HD3 ARG 72 HD1 ARG 72 2.628 -7.371 -9.331
525 HE ARG 72 HE ARG 72 -0.130 -7.813 -8.575
526 HH11 ARG 72 HH11 ARG 72 2.882 -9.238 -9.842
527 HH12 ARG 72 HH12 ARG 72 2.165 -10.743 -10.177
528 HH21 ARG 72 HH21 ARG 72 -1.082 -9.922 -9.080
529 HH22 ARG 72 HH22 ARG 72 -0.111 -11.115 -9.809
530 H GLU 73 HN GLU 73 1.001 -3.183 -6.952
531 HA GLU 73 HA GLU 73 3.217 -1.896 -8.251
532 HB2 GLU 73 HB2 GLU 73 0.382 -0.933 -7.884
533 HB3 GLU 73 HB1 GLU 73 1.545 -0.319 -9.048
534 HG2 GLU 73 HG2 GLU 73 0.401 -3.104 -9.017
535 HG3 GLU 73 HG1 GLU 73 -0.103 -1.791 -10.075
536 H LEU 74 HN LEU 74 1.193 -1.379 -5.480
537 HA LEU 74 HA LEU 74 2.052 1.193 -4.652
538 HB2 LEU 74 HB2 LEU 74 0.071 -0.308 -3.849
539 HB3 LEU 74 HB1 LEU 74 1.340 -1.079 -2.890
540 HG LEU 74 HG LEU 74 -0.156 0.595 -1.653
541 HD11 LEU 74 HD11 LEU 74 2.798 1.088 -1.631
542 HD12 LEU 74 HD12 LEU 74 1.937 -0.147 -0.707
543 HD13 LEU 74 HD13 LEU 74 1.664 1.572 -0.366
544 HD21 LEU 74 HD21 LEU 74 0.396 2.949 -1.885
545 HD22 LEU 74 HD22 LEU 74 -0.255 2.296 -3.392
546 HD23 LEU 74 HD23 LEU 74 1.483 2.569 -3.219
547 H LEU 75 HN LEU 75 2.984 -2.078 -3.832
548 HA LEU 75 HA LEU 75 4.981 -1.728 -1.991
549 HB2 LEU 75 HB2 LEU 75 3.948 -3.807 -2.448
550 HB3 LEU 75 HB1 LEU 75 4.465 -3.765 -4.118
551 HG LEU 75 HG LEU 75 6.761 -3.889 -3.317
552 HD11 LEU 75 HD11 LEU 75 6.458 -3.172 -1.015
553 HD12 LEU 75 HD12 LEU 75 7.150 -4.795 -1.039
554 HD13 LEU 75 HD13 LEU 75 5.436 -4.572 -0.694
555 HD21 LEU 75 HD21 LEU 75 4.930 -6.174 -2.662
556 HD22 LEU 75 HD22 LEU 75 6.675 -6.322 -2.968
557 HD23 LEU 75 HD23 LEU 75 5.583 -5.757 -4.242
558 H ASP 76 HN ASP 76 5.132 -1.772 -5.523
559 HA ASP 76 HA ASP 76 7.964 -1.706 -5.675
560 HB2 ASP 76 HB2 ASP 76 6.622 -2.529 -7.565
561 HB3 ASP 76 HB1 ASP 76 5.962 -0.911 -7.796
562 H LEU 77 HN LEU 77 5.457 0.754 -5.723
563 HA LEU 77 HA LEU 77 6.954 3.022 -6.343
564 HB2 LEU 77 HB2 LEU 77 4.702 2.717 -4.377
565 HB3 LEU 77 HB1 LEU 77 5.329 4.251 -4.915
566 HG LEU 77 HG LEU 77 3.915 2.198 -6.599
567 HD11 LEU 77 HD11 LEU 77 3.073 4.936 -5.640
568 HD12 LEU 77 HD12 LEU 77 2.460 3.388 -5.056
569 HD13 LEU 77 HD13 LEU 77 2.155 3.882 -6.720
570 HD21 LEU 77 HD21 LEU 77 4.963 4.928 -7.341
571 HD22 LEU 77 HD22 LEU 77 3.979 3.894 -8.372
572 HD23 LEU 77 HD23 LEU 77 5.604 3.384 -7.909
573 H ILE 78 HN ILE 78 6.367 1.482 -3.239
574 HA ILE 78 HA ILE 78 7.738 3.246 -1.572
575 HB ILE 78 HB ILE 78 7.414 0.249 -1.262
576 HG12 ILE 78 HG12 ILE 78 5.266 1.535 -1.399
577 HG13 ILE 78 HG11 ILE 78 5.495 0.746 0.158
578 HG21 ILE 78 HG21 ILE 78 9.232 1.031 0.129
579 HG22 ILE 78 HG22 ILE 78 7.849 0.633 1.146
580 HG23 ILE 78 HG23 ILE 78 8.225 2.316 0.784
581 HD11 ILE 78 HD11 ILE 78 4.581 2.967 0.427
582 HD12 ILE 78 HD12 ILE 78 5.937 3.659 -0.457
583 HD13 ILE 78 HD13 ILE 78 6.208 2.896 1.110
584 H ASN 79 HN ASN 79 8.855 0.068 -2.757
585 HA ASN 79 HA ASN 79 11.473 0.481 -1.798
586 HB2 ASN 79 HB2 ASN 79 10.466 -1.571 -3.752
587 HB3 ASN 79 HB1 ASN 79 12.105 -1.554 -3.114
588 HD21 ASN 79 HD21 ASN 79 10.253 -3.620 -2.858
589 HD22 ASN 79 HD22 ASN 79 9.869 -3.839 -1.177
590 H GLY 80 HN GLY 80 10.012 1.254 -4.846
591 HA2 GLY 80 HA2 GLY 80 12.379 1.624 -6.338
592 HA3 GLY 80 HA1 GLY 80 10.835 2.427 -6.625
593 H ALA 81 HN ALA 81 10.459 3.786 -4.313
594 HA ALA 81 HA ALA 81 12.197 6.015 -4.628
595 HB1 ALA 81 HB1 ALA 81 10.919 7.030 -2.817
596 HB2 ALA 81 HB2 ALA 81 10.176 5.479 -2.444
597 HB3 ALA 81 HB3 ALA 81 9.833 6.270 -3.980
598 H LEU 82 HN LEU 82 11.808 3.478 -2.225
599 HA LEU 82 HA LEU 82 13.524 4.370 -0.268
600 HB2 LEU 82 HB2 LEU 82 11.860 2.655 0.041
601 HB3 LEU 82 HB1 LEU 82 12.690 1.612 -1.095
602 HG LEU 82 HG LEU 82 14.559 1.490 0.420
603 HD11 LEU 82 HD11 LEU 82 12.765 2.977 2.341
604 HD12 LEU 82 HD12 LEU 82 14.271 3.580 1.648
605 HD13 LEU 82 HD13 LEU 82 14.300 2.218 2.770
606 HD21 LEU 82 HD21 LEU 82 12.903 -0.257 0.428
607 HD22 LEU 82 HD22 LEU 82 11.907 0.658 1.568
608 HD23 LEU 82 HD23 LEU 82 13.466 0.019 2.079
609 H ALA 83 HN ALA 83 14.178 2.462 -3.177
610 HA ALA 83 HA ALA 83 16.797 1.674 -2.561
611 HB1 ALA 83 HB1 ALA 83 15.616 2.166 -5.294
612 HB2 ALA 83 HB2 ALA 83 15.464 0.672 -4.370
613 HB3 ALA 83 HB3 ALA 83 17.045 1.199 -4.932
614 H GLU 84 HN GLU 84 15.542 4.676 -3.865
615 HA GLU 84 HA GLU 84 18.155 5.697 -4.501
616 HB2 GLU 84 HB2 GLU 84 15.380 6.855 -4.611
617 HB3 GLU 84 HB1 GLU 84 16.835 7.657 -5.162
618 HG2 GLU 84 HG2 GLU 84 15.729 5.088 -6.283
619 HG3 GLU 84 HG1 GLU 84 15.523 6.685 -7.003
620 H ALA 85 HN ALA 85 15.602 5.990 -2.113
621 HA ALA 85 HA ALA 85 16.629 8.367 -0.915
622 HB1 ALA 85 HB1 ALA 85 14.440 6.548 0.048
623 HB2 ALA 85 HB2 ALA 85 14.246 7.920 -1.045
624 HB3 ALA 85 HB3 ALA 85 14.777 8.185 0.619
625 H ALA 86 HN ALA 86 16.986 4.916 -0.164
626 HA ALA 86 HA ALA 86 18.657 5.776 2.081
627 HB1 ALA 86 HB1 ALA 86 17.848 3.899 3.413
628 HB2 ALA 86 HB2 ALA 86 16.735 3.448 2.125
629 HB3 ALA 86 HB3 ALA 86 16.523 4.979 2.979
630 H28A SDO 101 H28A SDO 42 -10.767 12.248 -2.582
631 H28B SDO 101 H28B SDO 42 -9.883 11.376 -1.323
632 H30A SDO 101 H30A SDO 42 -10.695 14.739 0.020
633 H30B SDO 101 H30B SDO 42 -11.033 13.014 0.164
634 H30C SDO 101 H30C SDO 42 -11.663 13.926 -1.209
635 H31A SDO 101 H31A SDO 42 -8.298 14.290 0.110
636 H31B SDO 101 H31B SDO 42 -7.562 13.148 -1.019
637 H31C SDO 101 H31C SDO 42 -8.579 12.539 0.316
638 H32A SDO 101 H32A SDO 42 -10.067 14.751 -3.016
639 H33A SDO 101 H33A SDO 42 -8.059 13.340 -3.057
640 H36A SDO 101 H36A SDO 42 -7.076 15.621 -1.877
641 H37A SDO 101 H37A SDO 42 -6.550 17.981 -1.566
642 H37B SDO 101 H37B SDO 42 -8.014 18.119 -0.578
643 H38A SDO 101 H38A SDO 42 -5.564 16.445 0.121
644 H38B SDO 101 H38B SDO 42 -5.822 18.077 0.663
645 H41A SDO 101 H41A SDO 42 -8.826 16.837 0.608
646 H42A SDO 101 H42A SDO 42 -9.298 15.052 2.536
647 H42B SDO 101 H42B SDO 42 -9.098 16.568 3.450
648 H43A SDO 101 H43A SDO 42 -10.899 16.153 1.099
649 H43B SDO 101 H43B SDO 42 -10.938 17.542 2.173
650 H1A SDO 101 H1A SDO 42 -12.150 14.905 5.302
651 H1B SDO 101 H1B SDO 42 -12.155 13.616 4.131
652 H2A SDO 101 H2A SDO 42 -9.760 15.236 4.878
653 H2B SDO 101 H2B SDO 42 -9.798 13.895 3.765
654 H4A SDO 101 H4A SDO 42 -10.541 12.737 7.814
655 H4B SDO 101 H4B SDO 42 -10.608 11.413 6.679
656 H5A SDO 101 H5A SDO 42 -12.598 12.336 5.640
657 H5B SDO 101 H5B SDO 42 -12.573 13.673 6.785
658 H6A SDO 101 H6A SDO 42 -12.863 12.132 8.643
659 H6B SDO 101 H6B SDO 42 -12.802 10.755 7.548
660 H8A SDO 101 H8A SDO 42 -14.604 13.624 6.267
661 H8B SDO 101 H8B SDO 42 -16.218 12.979 6.582
662 H8C SDO 101 H8C SDO 42 -15.146 12.170 5.424
Start of MODEL 7
1 H1 MET 1 HT1 MET 1 17.727 -8.866 -0.297
2 H2 MET 1 HT2 MET 1 18.608 -9.714 -1.463
3 H3 MET 1 HT3 MET 1 17.610 -8.408 -1.926
4 HA MET 1 HA MET 1 20.015 -8.263 -0.225
5 HB2 MET 1 HB2 MET 1 19.445 -7.159 -2.991
6 HB3 MET 1 HB1 MET 1 20.887 -6.817 -2.045
7 HG2 MET 1 HG2 MET 1 20.062 -9.522 -3.073
8 HG3 MET 1 HG1 MET 1 21.277 -8.476 -3.803
9 HE1 MET 1 HE1 MET 1 23.575 -7.850 -2.618
10 HE2 MET 1 HE2 MET 1 24.060 -8.421 -1.022
11 HE3 MET 1 HE3 MET 1 22.716 -7.289 -1.184
12 H ALA 2 HN ALA 2 20.365 -6.347 0.779
13 HA ALA 2 HA ALA 2 19.979 -4.376 1.746
14 HB1 ALA 2 HB1 ALA 2 19.707 -3.448 -0.538
15 HB2 ALA 2 HB2 ALA 2 18.664 -2.635 0.632
16 HB3 ALA 2 HB3 ALA 2 17.987 -3.835 -0.469
17 H THR 3 HN THR 3 18.185 -3.039 2.788
18 HA THR 3 HA THR 3 16.298 -4.924 3.933
19 HB THR 3 HB THR 3 16.931 -2.074 4.783
20 HG1 THR 3 HG1 THR 3 18.622 -3.930 4.819
21 HG21 THR 3 HG21 THR 3 14.762 -3.005 5.607
22 HG22 THR 3 HG22 THR 3 15.911 -2.750 6.912
23 HG23 THR 3 HG23 THR 3 15.635 -4.375 6.294
24 H LEU 4 HN LEU 4 15.164 -4.988 1.956
25 HA LEU 4 HA LEU 4 13.733 -2.602 1.115
26 HB2 LEU 4 HB2 LEU 4 14.980 -4.135 -0.470
27 HB3 LEU 4 HB1 LEU 4 13.773 -5.351 -0.125
28 HG LEU 4 HG LEU 4 12.041 -3.812 -1.037
29 HD11 LEU 4 HD11 LEU 4 12.773 -1.881 -2.347
30 HD12 LEU 4 HD12 LEU 4 14.439 -2.177 -1.851
31 HD13 LEU 4 HD13 LEU 4 13.233 -1.717 -0.649
32 HD21 LEU 4 HD21 LEU 4 12.677 -4.135 -3.385
33 HD22 LEU 4 HD22 LEU 4 13.020 -5.573 -2.427
34 HD23 LEU 4 HD23 LEU 4 14.329 -4.490 -2.891
35 H LEU 5 HN LEU 5 11.489 -2.530 1.086
36 HA LEU 5 HA LEU 5 10.192 -4.012 3.168
37 HB2 LEU 5 HB2 LEU 5 9.823 -1.565 2.695
38 HB3 LEU 5 HB1 LEU 5 9.031 -2.016 1.204
39 HG LEU 5 HG LEU 5 7.565 -1.334 3.214
40 HD11 LEU 5 HD11 LEU 5 6.600 -2.369 1.233
41 HD12 LEU 5 HD12 LEU 5 5.819 -2.923 2.716
42 HD13 LEU 5 HD13 LEU 5 6.979 -3.964 1.887
43 HD21 LEU 5 HD21 LEU 5 8.315 -4.112 4.065
44 HD22 LEU 5 HD22 LEU 5 7.050 -3.109 4.776
45 HD23 LEU 5 HD23 LEU 5 8.732 -2.610 4.879
46 H THR 6 HN THR 6 8.983 -5.822 2.983
47 HA THR 6 HA THR 6 8.585 -6.861 0.315
48 HB THR 6 HB THR 6 8.367 -9.062 1.653
49 HG1 THR 6 HG1 THR 6 8.457 -8.696 3.743
50 HG21 THR 6 HG21 THR 6 11.001 -7.570 1.494
51 HG22 THR 6 HG22 THR 6 10.279 -8.515 0.194
52 HG23 THR 6 HG23 THR 6 10.825 -9.314 1.669
53 H THR 7 HN THR 7 6.741 -8.625 0.287
54 HA THR 7 HA THR 7 4.317 -7.233 0.346
55 HB THR 7 HB THR 7 4.725 -10.209 0.094
56 HG1 THR 7 HG1 THR 7 5.346 -9.865 -1.960
57 HG21 THR 7 HG21 THR 7 2.386 -9.475 0.113
58 HG22 THR 7 HG22 THR 7 2.841 -9.987 -1.518
59 HG23 THR 7 HG23 THR 7 2.738 -8.275 -1.131
60 H ASP 8 HN ASP 8 5.784 -9.619 2.483
61 HA ASP 8 HA ASP 8 3.460 -10.308 3.917
62 HB2 ASP 8 HB2 ASP 8 4.851 -11.417 5.481
63 HB3 ASP 8 HB1 ASP 8 5.676 -11.567 3.940
64 H ASP 9 HN ASP 9 5.763 -7.709 4.310
65 HA ASP 9 HA ASP 9 4.570 -6.823 6.797
66 HB2 ASP 9 HB2 ASP 9 7.057 -6.498 6.187
67 HB3 ASP 9 HB1 ASP 9 6.483 -5.306 5.057
68 H LEU 10 HN LEU 10 4.469 -6.059 3.423
69 HA LEU 10 HA LEU 10 3.050 -3.665 3.407
70 HB2 LEU 10 HB2 LEU 10 3.942 -4.713 1.401
71 HB3 LEU 10 HB1 LEU 10 2.785 -6.011 1.546
72 HG LEU 10 HG LEU 10 0.954 -4.254 1.351
73 HD11 LEU 10 HD11 LEU 10 3.243 -2.571 0.385
74 HD12 LEU 10 HD12 LEU 10 2.228 -2.280 1.800
75 HD13 LEU 10 HD13 LEU 10 1.535 -2.192 0.182
76 HD21 LEU 10 HD21 LEU 10 1.064 -4.238 -1.100
77 HD22 LEU 10 HD22 LEU 10 1.506 -5.819 -0.448
78 HD23 LEU 10 HD23 LEU 10 2.759 -4.720 -1.021
79 H ARG 11 HN ARG 11 1.902 -6.994 3.591
80 HA ARG 11 HA ARG 11 -0.843 -6.537 3.551
81 HB2 ARG 11 HB2 ARG 11 0.100 -8.796 3.408
82 HB3 ARG 11 HB1 ARG 11 0.621 -8.698 5.080
83 HG2 ARG 11 HG2 ARG 11 -1.674 -8.630 5.839
84 HG3 ARG 11 HG1 ARG 11 -2.262 -8.573 4.181
85 HD2 ARG 11 HD2 ARG 11 -2.470 -10.818 5.087
86 HD3 ARG 11 HD1 ARG 11 -1.299 -10.796 3.774
87 HE ARG 11 HE ARG 11 -0.353 -10.555 6.522
88 HH11 ARG 11 HH11 ARG 11 -0.566 -12.504 3.569
89 HH12 ARG 11 HH12 ARG 11 0.598 -13.647 4.066
90 HH21 ARG 11 HH21 ARG 11 1.162 -12.155 7.248
91 HH22 ARG 11 HH22 ARG 11 1.570 -13.478 6.244
92 H ARG 12 HN ARG 12 1.368 -6.585 6.271
93 HA ARG 12 HA ARG 12 -0.353 -6.197 8.411
94 HB2 ARG 12 HB2 ARG 12 2.386 -5.009 7.952
95 HB3 ARG 12 HB1 ARG 12 1.539 -4.964 9.482
96 HG2 ARG 12 HG2 ARG 12 1.665 -7.358 9.672
97 HG3 ARG 12 HG1 ARG 12 2.377 -7.473 8.053
98 HD2 ARG 12 HD2 ARG 12 4.328 -6.276 8.764
99 HD3 ARG 12 HD1 ARG 12 3.603 -5.919 10.324
100 HE ARG 12 HE ARG 12 3.601 -8.555 10.401
101 HH11 ARG 12 HH11 ARG 12 6.225 -6.426 9.236
102 HH12 ARG 12 HH12 ARG 12 7.454 -7.355 9.951
103 HH21 ARG 12 HH21 ARG 12 5.318 -9.775 11.406
104 HH22 ARG 12 HH22 ARG 12 6.948 -9.309 11.196
105 H ALA 13 HN ALA 13 1.257 -3.724 6.451
106 HA ALA 13 HA ALA 13 0.039 -1.506 7.721
107 HB1 ALA 13 HB1 ALA 13 2.133 -1.350 6.477
108 HB2 ALA 13 HB2 ALA 13 0.934 -0.185 5.912
109 HB3 ALA 13 HB3 ALA 13 1.260 -1.645 4.971
110 H LEU 14 HN LEU 14 -0.789 -3.329 4.793
111 HA LEU 14 HA LEU 14 -2.852 -1.714 3.910
112 HB2 LEU 14 HB2 LEU 14 -1.640 -3.719 2.810
113 HB3 LEU 14 HB1 LEU 14 -2.776 -4.715 3.688
114 HG LEU 14 HG LEU 14 -4.628 -3.573 2.515
115 HD11 LEU 14 HD11 LEU 14 -3.490 -1.473 2.029
116 HD12 LEU 14 HD12 LEU 14 -4.112 -2.209 0.546
117 HD13 LEU 14 HD13 LEU 14 -2.393 -2.315 0.931
118 HD21 LEU 14 HD21 LEU 14 -4.275 -4.662 0.354
119 HD22 LEU 14 HD22 LEU 14 -3.729 -5.703 1.679
120 HD23 LEU 14 HD23 LEU 14 -2.555 -4.821 0.705
121 H VAL 15 HN VAL 15 -2.857 -4.477 6.180
122 HA VAL 15 HA VAL 15 -5.599 -4.674 6.735
123 HB VAL 15 HB VAL 15 -3.258 -5.164 8.622
124 HG11 VAL 15 HG11 VAL 15 -4.802 -6.596 9.903
125 HG12 VAL 15 HG12 VAL 15 -6.125 -6.091 8.852
126 HG13 VAL 15 HG13 VAL 15 -5.321 -4.912 9.886
127 HG21 VAL 15 HG21 VAL 15 -3.569 -7.514 8.042
128 HG22 VAL 15 HG22 VAL 15 -3.155 -6.524 6.643
129 HG23 VAL 15 HG23 VAL 15 -4.826 -7.063 6.878
130 H GLU 16 HN GLU 16 -3.116 -2.876 8.506
131 HA GLU 16 HA GLU 16 -4.592 -1.671 10.510
132 HB2 GLU 16 HB2 GLU 16 -2.414 -0.312 8.929
133 HB3 GLU 16 HB1 GLU 16 -2.892 0.038 10.578
134 HG2 GLU 16 HG2 GLU 16 -1.674 -2.531 9.635
135 HG3 GLU 16 HG1 GLU 16 -0.786 -1.239 10.404
136 H SER 17 HN SER 17 -4.123 -0.638 7.192
137 HA SER 17 HA SER 17 -5.463 1.856 7.485
138 HB2 SER 17 HB2 SER 17 -4.558 0.422 5.004
139 HB3 SER 17 HB1 SER 17 -4.948 2.141 5.164
140 HG SER 17 HG SER 17 -2.744 0.698 6.117
141 H ALA 18 HN ALA 18 -6.630 -1.298 7.102
142 HA ALA 18 HA ALA 18 -8.875 -0.639 5.422
143 HB1 ALA 18 HB1 ALA 18 -8.029 -2.954 5.506
144 HB2 ALA 18 HB2 ALA 18 -9.714 -2.867 6.014
145 HB3 ALA 18 HB3 ALA 18 -8.443 -3.036 7.222
146 H GLY 19 HN GLY 19 -8.024 -0.393 8.690
147 HA2 GLY 19 HA2 GLY 19 -9.067 0.581 10.471
148 HA3 GLY 19 HA1 GLY 19 -10.220 1.238 9.319
149 H GLU 20 HN GLU 20 -12.145 0.848 10.100
150 HA GLU 20 HA GLU 20 -12.709 -1.865 11.089
151 HB2 GLU 20 HB2 GLU 20 -14.001 0.741 11.901
152 HB3 GLU 20 HB1 GLU 20 -14.466 -0.850 12.487
153 HG2 GLU 20 HG2 GLU 20 -11.843 0.561 12.974
154 HG3 GLU 20 HG1 GLU 20 -13.144 0.289 14.132
155 H THR 21 HN THR 21 -12.933 -0.427 8.382
156 HA THR 21 HA THR 21 -15.786 -0.846 7.965
157 HB THR 21 HB THR 21 -14.877 1.267 7.032
158 HG1 THR 21 HG1 THR 21 -15.457 0.786 4.696
159 HG21 THR 21 HG21 THR 21 -13.338 1.258 5.102
160 HG22 THR 21 HG22 THR 21 -13.173 -0.496 5.264
161 HG23 THR 21 HG23 THR 21 -12.588 0.564 6.544
162 H ASP 22 HN ASP 22 -15.403 -1.636 5.124
163 HA ASP 22 HA ASP 22 -15.059 -4.420 5.732
164 HB2 ASP 22 HB2 ASP 22 -16.828 -3.844 4.155
165 HB3 ASP 22 HB1 ASP 22 -15.629 -3.179 3.040
166 H GLY 23 HN GLY 23 -13.335 -5.317 5.882
167 HA2 GLY 23 HA2 GLY 23 -11.126 -4.736 4.042
168 HA3 GLY 23 HA1 GLY 23 -10.848 -5.028 5.778
169 H THR 24 HN THR 24 -11.309 -6.435 2.790
170 HA THR 24 HA THR 24 -12.634 -8.735 3.742
171 HB THR 24 HB THR 24 -13.001 -7.781 1.470
172 HG1 THR 24 HG1 THR 24 -12.472 -10.202 0.580
173 HG21 THR 24 HG21 THR 24 -10.335 -9.076 0.850
174 HG22 THR 24 HG22 THR 24 -10.692 -7.348 0.822
175 HG23 THR 24 HG23 THR 24 -11.459 -8.422 -0.344
176 H ASP 25 HN ASP 25 -11.486 -10.774 2.302
177 HA ASP 25 HA ASP 25 -9.648 -11.766 4.242
178 HB2 ASP 25 HB2 ASP 25 -11.332 -13.227 3.366
179 HB3 ASP 25 HB1 ASP 25 -10.796 -12.936 1.716
180 H LEU 26 HN LEU 26 -7.733 -10.754 4.160
181 HA LEU 26 HA LEU 26 -6.241 -10.669 1.658
182 HB2 LEU 26 HB2 LEU 26 -5.831 -9.504 4.382
183 HB3 LEU 26 HB1 LEU 26 -4.441 -9.717 3.355
184 HG LEU 26 HG LEU 26 -5.406 -8.183 1.703
185 HD11 LEU 26 HD11 LEU 26 -7.763 -8.558 2.067
186 HD12 LEU 26 HD12 LEU 26 -7.371 -6.844 2.237
187 HD13 LEU 26 HD13 LEU 26 -7.655 -7.836 3.675
188 HD21 LEU 26 HD21 LEU 26 -5.202 -6.139 3.033
189 HD22 LEU 26 HD22 LEU 26 -3.948 -7.317 3.410
190 HD23 LEU 26 HD23 LEU 26 -5.311 -7.101 4.510
191 H SER 27 HN SER 27 -6.915 -13.095 3.490
192 HA SER 27 HA SER 27 -4.213 -13.986 3.962
193 HB2 SER 27 HB2 SER 27 -6.832 -15.349 4.603
194 HB3 SER 27 HB1 SER 27 -5.229 -15.876 5.132
195 HG SER 27 HG SER 27 -5.925 -13.252 5.659
196 H GLY 28 HN GLY 28 -3.621 -14.011 1.833
197 HA2 GLY 28 HA2 GLY 28 -3.481 -16.385 0.528
198 HA3 GLY 28 HA1 GLY 28 -4.829 -15.491 -0.211
199 H ASP 29 HN ASP 29 -2.931 -15.590 -2.005
200 HA ASP 29 HA ASP 29 -1.155 -13.397 -1.379
201 HB2 ASP 29 HB2 ASP 29 -0.231 -15.465 -2.514
202 HB3 ASP 29 HB1 ASP 29 -1.103 -14.951 -3.959
203 H PHE 30 HN PHE 30 -2.427 -11.845 -1.282
204 HA PHE 30 HA PHE 30 -4.406 -11.040 -3.193
205 HB2 PHE 30 HB2 PHE 30 -4.691 -9.111 -1.682
206 HB3 PHE 30 HB1 PHE 30 -4.665 -10.635 -0.797
207 HD1 PHE 30 HD2 PHE 30 -2.730 -11.233 0.629
208 HD2 PHE 30 HD1 PHE 30 -2.912 -7.485 -1.402
209 HE1 PHE 30 HE2 PHE 30 -0.863 -10.392 1.983
210 HE2 PHE 30 HE1 PHE 30 -1.043 -6.656 -0.035
211 HZ PHE 30 HZ PHE 30 -0.026 -8.107 1.650
212 H LEU 31 HN LEU 31 -1.310 -11.000 -3.824
213 HA LEU 31 HA LEU 31 -0.530 -8.304 -3.952
214 HB2 LEU 31 HB2 LEU 31 0.941 -10.362 -3.905
215 HB3 LEU 31 HB1 LEU 31 0.592 -10.550 -5.611
216 HG LEU 31 HG LEU 31 1.630 -8.342 -6.034
217 HD11 LEU 31 HD11 LEU 31 2.366 -8.481 -3.114
218 HD12 LEU 31 HD12 LEU 31 1.239 -7.338 -3.854
219 HD13 LEU 31 HD13 LEU 31 2.951 -7.287 -4.276
220 HD21 LEU 31 HD21 LEU 31 3.942 -9.070 -5.665
221 HD22 LEU 31 HD22 LEU 31 2.949 -10.391 -6.278
222 HD23 LEU 31 HD23 LEU 31 3.373 -10.321 -4.566
223 H ASP 32 HN ASP 32 -2.069 -10.381 -6.358
224 HA ASP 32 HA ASP 32 -2.155 -8.120 -8.247
225 HB2 ASP 32 HB2 ASP 32 -2.837 -9.658 -9.980
226 HB3 ASP 32 HB1 ASP 32 -1.444 -10.329 -9.149
227 H LEU 33 HN LEU 33 -3.924 -8.895 -5.758
228 HA LEU 33 HA LEU 33 -6.539 -9.015 -6.950
229 HB2 LEU 33 HB2 LEU 33 -5.898 -10.064 -4.721
230 HB3 LEU 33 HB1 LEU 33 -5.816 -8.455 -4.062
231 HG LEU 33 HG LEU 33 -8.224 -8.156 -4.449
232 HD11 LEU 33 HD11 LEU 33 -8.144 -11.023 -5.409
233 HD12 LEU 33 HD12 LEU 33 -8.429 -9.610 -6.424
234 HD13 LEU 33 HD13 LEU 33 -9.592 -10.044 -5.171
235 HD21 LEU 33 HD21 LEU 33 -9.001 -9.762 -2.777
236 HD22 LEU 33 HD22 LEU 33 -7.436 -9.083 -2.328
237 HD23 LEU 33 HD23 LEU 33 -7.532 -10.713 -3.002
238 H ARG 34 HN ARG 34 -8.153 -7.247 -6.641
239 HA ARG 34 HA ARG 34 -6.776 -4.716 -7.196
240 HB2 ARG 34 HB2 ARG 34 -9.691 -5.434 -7.481
241 HB3 ARG 34 HB1 ARG 34 -8.919 -3.963 -8.044
242 HG2 ARG 34 HG2 ARG 34 -7.689 -5.192 -9.706
243 HG3 ARG 34 HG1 ARG 34 -8.293 -6.726 -9.052
244 HD2 ARG 34 HD2 ARG 34 -9.957 -4.530 -10.279
245 HD3 ARG 34 HD1 ARG 34 -9.566 -6.077 -11.036
246 HE ARG 34 HE ARG 34 -10.693 -6.837 -8.723
247 HH11 ARG 34 HH11 ARG 34 -11.846 -4.607 -11.260
248 HH12 ARG 34 HH12 ARG 34 -13.483 -4.851 -10.889
249 HH21 ARG 34 HH21 ARG 34 -12.920 -7.169 -8.257
250 HH22 ARG 34 HH22 ARG 34 -14.131 -6.344 -9.126
251 H PHE 35 HN PHE 35 -7.482 -2.743 -6.219
252 HA PHE 35 HA PHE 35 -8.170 -2.958 -3.472
253 HB2 PHE 35 HB2 PHE 35 -7.974 -0.546 -5.304
254 HB3 PHE 35 HB1 PHE 35 -8.452 -0.405 -3.616
255 HD1 PHE 35 HD2 PHE 35 -6.869 -1.022 -1.827
256 HD2 PHE 35 HD1 PHE 35 -5.678 -0.834 -5.901
257 HE1 PHE 35 HE2 PHE 35 -4.505 -0.946 -1.129
258 HE2 PHE 35 HE1 PHE 35 -3.319 -0.756 -5.213
259 HZ PHE 35 HZ PHE 35 -2.729 -0.814 -2.828
260 H GLU 36 HN GLU 36 -9.908 -2.541 -6.397
261 HA GLU 36 HA GLU 36 -12.475 -1.861 -5.537
262 HB2 GLU 36 HB2 GLU 36 -11.692 -3.846 -7.685
263 HB3 GLU 36 HB1 GLU 36 -13.277 -3.135 -7.500
264 HG2 GLU 36 HG2 GLU 36 -10.749 -1.657 -8.150
265 HG3 GLU 36 HG1 GLU 36 -12.026 -2.079 -9.286
266 H ASP 37 HN ASP 37 -10.796 -4.953 -5.486
267 HA ASP 37 HA ASP 37 -13.148 -6.419 -4.660
268 HB2 ASP 37 HB2 ASP 37 -10.266 -7.299 -4.893
269 HB3 ASP 37 HB1 ASP 37 -11.583 -8.359 -4.425
270 H ILE 38 HN ILE 38 -10.230 -5.172 -3.194
271 HA ILE 38 HA ILE 38 -10.924 -6.464 -0.768
272 HB ILE 38 HB ILE 38 -8.954 -5.372 0.288
273 HG12 ILE 38 HG12 ILE 38 -8.523 -4.209 -2.478
274 HG13 ILE 38 HG11 ILE 38 -8.911 -3.302 -1.023
275 HG21 ILE 38 HG21 ILE 38 -7.281 -6.617 -1.001
276 HG22 ILE 38 HG22 ILE 38 -8.419 -6.760 -2.335
277 HG23 ILE 38 HG23 ILE 38 -8.766 -7.544 -0.789
278 HD11 ILE 38 HD11 ILE 38 -6.540 -3.142 -1.571
279 HD12 ILE 38 HD12 ILE 38 -6.392 -4.895 -1.476
280 HD13 ILE 38 HD13 ILE 38 -6.777 -3.968 -0.031
281 H GLY 39 HN GLY 39 -12.194 -3.845 -2.110
282 HA2 GLY 39 HA2 GLY 39 -13.862 -2.466 -1.340
283 HA3 GLY 39 HA1 GLY 39 -13.779 -3.316 0.185
284 H TYR 40 HN TYR 40 -11.145 -1.560 -1.301
285 HA TYR 40 HA TYR 40 -10.910 -0.037 1.159
286 HB2 TYR 40 HB2 TYR 40 -9.055 -0.566 -1.111
287 HB3 TYR 40 HB1 TYR 40 -8.777 0.827 -0.074
288 HD1 TYR 40 HD2 TYR 40 -10.066 -2.503 0.957
289 HD2 TYR 40 HD1 TYR 40 -6.807 0.219 1.019
290 HE1 TYR 40 HE2 TYR 40 -8.916 -3.939 2.574
291 HE2 TYR 40 HE1 TYR 40 -5.643 -1.179 2.628
292 HH TYR 40 HH TYR 40 -6.147 -2.946 4.274
293 H ASP 41 HN ASP 41 -10.815 2.089 1.324
294 HA ASP 41 HA ASP 41 -12.179 3.666 -0.714
295 HB2 ASP 41 HB2 ASP 41 -11.165 4.405 2.037
296 HB3 ASP 41 HB1 ASP 41 -11.978 5.511 0.950
297 H SER 42 HN SER 42 -11.241 5.867 -1.040
298 HA SER 42 HA SER 42 -8.671 5.926 -2.053
299 HB2 SER 42 HB2 SER 42 -9.100 8.436 -1.764
300 HB3 SER 42 HB1 SER 42 -10.283 7.537 -2.731
301 H LEU 43 HN LEU 43 -10.074 7.145 0.898
302 HA LEU 43 HA LEU 43 -8.015 8.165 2.369
303 HB2 LEU 43 HB2 LEU 43 -10.247 6.433 3.383
304 HB3 LEU 43 HB1 LEU 43 -9.264 7.478 4.382
305 HG LEU 43 HG LEU 43 -11.127 8.412 2.201
306 HD11 LEU 43 HD11 LEU 43 -12.499 9.211 4.072
307 HD12 LEU 43 HD12 LEU 43 -11.380 8.448 5.204
308 HD13 LEU 43 HD13 LEU 43 -12.316 7.457 4.093
309 HD21 LEU 43 HD21 LEU 43 -9.212 9.902 2.550
310 HD22 LEU 43 HD22 LEU 43 -9.558 9.951 4.280
311 HD23 LEU 43 HD23 LEU 43 -10.709 10.630 3.126
312 H ALA 44 HN ALA 44 -9.132 4.840 2.384
313 HA ALA 44 HA ALA 44 -7.372 3.721 4.179
314 HB1 ALA 44 HB1 ALA 44 -8.623 2.394 1.785
315 HB2 ALA 44 HB2 ALA 44 -9.374 2.593 3.366
316 HB3 ALA 44 HB3 ALA 44 -7.949 1.571 3.186
317 H LEU 45 HN LEU 45 -6.891 4.279 0.723
318 HA LEU 45 HA LEU 45 -4.446 2.806 0.701
319 HB2 LEU 45 HB2 LEU 45 -5.865 2.976 -1.239
320 HB3 LEU 45 HB1 LEU 45 -5.585 4.706 -1.315
321 HG LEU 45 HG LEU 45 -3.513 4.442 -2.344
322 HD11 LEU 45 HD11 LEU 45 -2.069 2.518 -2.062
323 HD12 LEU 45 HD12 LEU 45 -3.308 1.653 -1.135
324 HD13 LEU 45 HD13 LEU 45 -2.524 3.085 -0.452
325 HD21 LEU 45 HD21 LEU 45 -3.663 2.585 -3.838
326 HD22 LEU 45 HD22 LEU 45 -5.288 3.314 -3.593
327 HD23 LEU 45 HD23 LEU 45 -4.773 1.863 -2.675
328 H MET 46 HN MET 46 -5.400 6.155 1.115
329 HA MET 46 HA MET 46 -2.861 7.456 0.903
330 HB2 MET 46 HB2 MET 46 -4.906 8.252 2.978
331 HB3 MET 46 HB1 MET 46 -3.810 9.297 2.088
332 HG2 MET 46 HG2 MET 46 -5.158 8.689 0.055
333 HG3 MET 46 HG1 MET 46 -6.225 7.885 1.196
334 HE1 MET 46 HE1 MET 46 -4.294 11.181 1.958
335 HE2 MET 46 HE2 MET 46 -5.451 12.437 1.488
336 HE3 MET 46 HE3 MET 46 -4.702 11.419 0.256
337 H GLU 47 HN GLU 47 -4.742 6.231 3.524
338 HA GLU 47 HA GLU 47 -3.088 6.437 5.672
339 HB2 GLU 47 HB2 GLU 47 -5.244 4.768 4.710
340 HB3 GLU 47 HB1 GLU 47 -4.597 4.284 6.315
341 HG2 GLU 47 HG2 GLU 47 -5.161 6.720 6.923
342 HG3 GLU 47 HG1 GLU 47 -5.980 6.805 5.365
343 H THR 48 HN THR 48 -3.444 3.702 3.431
344 HA THR 48 HA THR 48 -1.575 1.882 4.375
345 HB THR 48 HB THR 48 -2.321 2.560 1.517
346 HG1 THR 48 HG1 THR 48 -4.013 1.837 2.950
347 HG21 THR 48 HG21 THR 48 -1.516 0.434 0.831
348 HG22 THR 48 HG22 THR 48 -1.115 -0.029 2.486
349 HG23 THR 48 HG23 THR 48 -0.181 1.236 1.683
350 H ALA 49 HN ALA 49 -1.051 4.302 1.863
351 HA ALA 49 HA ALA 49 1.686 3.811 1.481
352 HB1 ALA 49 HB1 ALA 49 1.721 5.821 0.136
353 HB2 ALA 49 HB2 ALA 49 0.172 6.338 0.800
354 HB3 ALA 49 HB3 ALA 49 0.262 4.895 -0.209
355 H ALA 50 HN ALA 50 0.043 6.368 3.321
356 HA ALA 50 HA ALA 50 2.366 7.739 4.100
357 HB1 ALA 50 HB1 ALA 50 0.964 8.863 5.718
358 HB2 ALA 50 HB2 ALA 50 -0.273 7.619 5.542
359 HB3 ALA 50 HB3 ALA 50 0.101 8.690 4.188
360 H ARG 51 HN ARG 51 0.626 5.069 5.562
361 HA ARG 51 HA ARG 51 2.011 5.053 8.029
362 HB2 ARG 51 HB2 ARG 51 -0.247 3.935 7.270
363 HB3 ARG 51 HB1 ARG 51 0.774 2.613 6.757
364 HG2 ARG 51 HG2 ARG 51 0.757 3.662 9.581
365 HG3 ARG 51 HG1 ARG 51 -0.347 2.413 9.012
366 HD2 ARG 51 HD2 ARG 51 1.574 1.008 8.454
367 HD3 ARG 51 HD1 ARG 51 2.667 2.262 9.049
368 HE ARG 51 HE ARG 51 1.469 1.992 11.227
369 HH11 ARG 51 HH11 ARG 51 1.727 -0.721 8.955
370 HH12 ARG 51 HH12 ARG 51 1.584 -1.907 10.195
371 HH21 ARG 51 HH21 ARG 51 1.362 0.348 12.870
372 HH22 ARG 51 HH22 ARG 51 1.436 -1.293 12.427
373 H LEU 52 HN LEU 52 2.714 3.848 4.858
374 HA LEU 52 HA LEU 52 4.933 2.237 5.757
375 HB2 LEU 52 HB2 LEU 52 4.009 3.023 2.994
376 HB3 LEU 52 HB1 LEU 52 5.427 2.040 3.303
377 HG LEU 52 HG LEU 52 2.584 1.258 4.032
378 HD11 LEU 52 HD11 LEU 52 4.370 0.293 1.831
379 HD12 LEU 52 HD12 LEU 52 2.909 1.268 1.650
380 HD13 LEU 52 HD13 LEU 52 2.804 -0.379 2.275
381 HD21 LEU 52 HD21 LEU 52 4.242 0.325 5.564
382 HD22 LEU 52 HD22 LEU 52 5.198 -0.245 4.199
383 HD23 LEU 52 HD23 LEU 52 3.606 -0.934 4.502
384 H GLU 53 HN GLU 53 4.466 5.337 4.097
385 HA GLU 53 HA GLU 53 7.093 6.032 3.585
386 HB2 GLU 53 HB2 GLU 53 4.820 7.850 4.350
387 HB3 GLU 53 HB1 GLU 53 6.354 8.402 3.711
388 HG2 GLU 53 HG2 GLU 53 5.885 7.172 1.623
389 HG3 GLU 53 HG1 GLU 53 4.322 6.696 2.298
390 H SER 54 HN SER 54 5.189 6.963 6.404
391 HA SER 54 HA SER 54 7.251 8.364 7.710
392 HB2 SER 54 HB2 SER 54 4.850 8.743 8.105
393 HB3 SER 54 HB1 SER 54 4.705 7.137 8.805
394 HG SER 54 HG SER 54 6.032 9.417 9.803
395 H ARG 55 HN ARG 55 6.409 5.024 7.638
396 HA ARG 55 HA ARG 55 7.692 4.334 10.120
397 HB2 ARG 55 HB2 ARG 55 5.636 3.290 9.292
398 HB3 ARG 55 HB1 ARG 55 6.521 2.648 7.934
399 HG2 ARG 55 HG2 ARG 55 7.724 1.151 9.357
400 HG3 ARG 55 HG1 ARG 55 7.036 1.909 10.808
401 HD2 ARG 55 HD2 ARG 55 4.825 1.239 10.185
402 HD3 ARG 55 HD1 ARG 55 5.381 0.661 8.622
403 HE ARG 55 HE ARG 55 6.027 -0.570 11.205
404 HH11 ARG 55 HH11 ARG 55 5.222 -0.754 7.788
405 HH12 ARG 55 HH12 ARG 55 5.468 -2.445 7.662
406 HH21 ARG 55 HH21 ARG 55 6.176 -2.982 11.059
407 HH22 ARG 55 HH22 ARG 55 5.975 -3.717 9.515
408 H TYR 56 HN TYR 56 8.526 4.164 6.695
409 HA TYR 56 HA TYR 56 11.080 2.946 7.492
410 HB2 TYR 56 HB2 TYR 56 9.640 2.727 4.858
411 HB3 TYR 56 HB1 TYR 56 11.306 2.196 5.111
412 HD1 TYR 56 HD1 TYR 56 11.792 0.289 6.544
413 HD2 TYR 56 HD2 TYR 56 7.796 1.512 5.794
414 HE1 TYR 56 HE1 TYR 56 10.983 -1.877 7.357
415 HE2 TYR 56 HE2 TYR 56 6.972 -0.648 6.607
416 HH TYR 56 HH TYR 56 9.026 -2.913 8.222
417 H GLY 57 HN GLY 57 9.782 5.767 5.984
418 HA2 GLY 57 HA2 GLY 57 11.059 7.714 5.759
419 HA3 GLY 57 HA1 GLY 57 12.520 6.746 5.729
420 H VAL 58 HN VAL 58 9.531 6.670 3.837
421 HA VAL 58 HA VAL 58 11.179 7.085 1.445
422 HB VAL 58 HB VAL 58 9.607 5.760 0.090
423 HG11 VAL 58 HG11 VAL 58 11.533 4.622 0.994
424 HG12 VAL 58 HG12 VAL 58 10.155 3.526 0.891
425 HG13 VAL 58 HG13 VAL 58 10.629 4.205 2.452
426 HG21 VAL 58 HG21 VAL 58 8.255 5.039 2.686
427 HG22 VAL 58 HG22 VAL 58 7.856 4.399 1.087
428 HG23 VAL 58 HG23 VAL 58 7.592 6.109 1.449
429 H SER 59 HN SER 59 9.292 7.613 -0.441
430 HA SER 59 HA SER 59 7.463 9.582 0.597
431 HB2 SER 59 HB2 SER 59 9.772 10.354 -1.208
432 HB3 SER 59 HB1 SER 59 8.436 11.405 -0.756
433 HG SER 59 HG SER 59 9.427 10.394 1.447
434 H ILE 60 HN ILE 60 5.672 9.366 -0.569
435 HA ILE 60 HA ILE 60 5.872 8.829 -3.467
436 HB ILE 60 HB ILE 60 3.780 7.742 -1.538
437 HG12 ILE 60 HG12 ILE 60 5.743 6.273 -3.323
438 HG13 ILE 60 HG11 ILE 60 5.868 6.440 -1.576
439 HG21 ILE 60 HG21 ILE 60 2.699 6.691 -3.480
440 HG22 ILE 60 HG22 ILE 60 3.851 7.484 -4.556
441 HG23 ILE 60 HG23 ILE 60 2.712 8.450 -3.631
442 HD11 ILE 60 HD11 ILE 60 3.820 5.149 -1.302
443 HD12 ILE 60 HD12 ILE 60 5.023 4.247 -2.225
444 HD13 ILE 60 HD13 ILE 60 3.671 5.022 -3.053
445 HA PRO 61 HA PRO 61 3.596 12.713 -3.614
446 HB2 PRO 61 HB2 PRO 61 2.813 11.693 -6.296
447 HB3 PRO 61 HB1 PRO 61 3.559 13.236 -5.859
448 HG2 PRO 61 HG2 PRO 61 4.986 11.339 -7.059
449 HG3 PRO 61 HG1 PRO 61 5.695 12.316 -5.753
450 HD2 PRO 61 HD2 PRO 61 4.603 9.522 -5.651
451 HD3 PRO 61 HD1 PRO 61 6.072 10.189 -4.906
452 H ASP 62 HN ASP 62 1.554 13.186 -3.112
453 HA ASP 62 HA ASP 62 -0.177 11.381 -1.977
454 HB2 ASP 62 HB2 ASP 62 -1.223 13.891 -3.265
455 HB3 ASP 62 HB1 ASP 62 -1.723 13.138 -1.758
456 H ASP 63 HN ASP 63 -0.523 12.899 -5.118
457 HA ASP 63 HA ASP 63 -2.883 11.756 -6.043
458 HB2 ASP 63 HB2 ASP 63 -1.816 13.633 -7.108
459 HB3 ASP 63 HB1 ASP 63 -0.433 12.647 -7.542
460 H VAL 64 HN VAL 64 0.401 10.492 -6.154
461 HA VAL 64 HA VAL 64 -0.139 8.469 -8.089
462 HB VAL 64 HB VAL 64 2.248 8.740 -6.232
463 HG11 VAL 64 HG11 VAL 64 1.960 7.079 -8.740
464 HG12 VAL 64 HG12 VAL 64 2.042 6.459 -7.090
465 HG13 VAL 64 HG13 VAL 64 3.437 7.281 -7.787
466 HG21 VAL 64 HG21 VAL 64 3.365 9.667 -8.224
467 HG22 VAL 64 HG22 VAL 64 2.025 10.660 -7.656
468 HG23 VAL 64 HG23 VAL 64 1.820 9.637 -9.074
469 H ALA 65 HN ALA 65 -0.622 8.611 -4.703
470 HA ALA 65 HA ALA 65 -0.448 5.874 -4.092
471 HB1 ALA 65 HB1 ALA 65 -0.482 7.561 -2.371
472 HB2 ALA 65 HB2 ALA 65 -1.876 6.466 -2.177
473 HB3 ALA 65 HB3 ALA 65 -2.099 8.070 -2.868
474 H GLY 66 HN GLY 66 -2.975 7.914 -5.406
475 HA2 GLY 66 HA2 GLY 66 -4.905 5.731 -5.329
476 HA3 GLY 66 HA1 GLY 66 -5.222 7.393 -5.817
477 H ARG 67 HN ARG 67 -2.390 6.185 -7.240
478 HA ARG 67 HA ARG 67 -3.811 5.907 -9.778
479 HB2 ARG 67 HB2 ARG 67 -0.878 6.334 -9.206
480 HB3 ARG 67 HB1 ARG 67 -1.599 6.211 -10.804
481 HG2 ARG 67 HG2 ARG 67 -2.192 8.346 -8.769
482 HG3 ARG 67 HG1 ARG 67 -1.130 8.526 -10.167
483 HD2 ARG 67 HD2 ARG 67 -2.980 8.214 -11.658
484 HD3 ARG 67 HD1 ARG 67 -4.045 7.802 -10.323
485 HE ARG 67 HE ARG 67 -2.865 10.364 -10.011
486 HH11 ARG 67 HH11 ARG 67 -5.408 8.664 -11.795
487 HH12 ARG 67 HH12 ARG 67 -6.502 9.971 -11.786
488 HH21 ARG 67 HH21 ARG 67 -4.325 12.142 -9.979
489 HH22 ARG 67 HH22 ARG 67 -5.863 12.055 -10.728
490 H VAL 68 HN VAL 68 -2.785 3.937 -7.394
491 HA VAL 68 HA VAL 68 -1.854 1.966 -9.287
492 HB VAL 68 HB VAL 68 -1.205 0.525 -7.364
493 HG11 VAL 68 HG11 VAL 68 0.400 2.014 -8.335
494 HG12 VAL 68 HG12 VAL 68 0.661 1.913 -6.595
495 HG13 VAL 68 HG13 VAL 68 -0.129 3.330 -7.291
496 HG21 VAL 68 HG21 VAL 68 -2.825 1.275 -5.696
497 HG22 VAL 68 HG22 VAL 68 -2.067 2.872 -5.675
498 HG23 VAL 68 HG23 VAL 68 -1.166 1.462 -5.111
499 H ASP 69 HN ASP 69 -2.766 -0.260 -9.181
500 HA ASP 69 HA ASP 69 -5.668 -0.107 -8.585
501 HB2 ASP 69 HB2 ASP 69 -4.994 -0.308 -11.045
502 HB3 ASP 69 HB1 ASP 69 -4.312 -1.848 -10.637
503 H THR 70 HN THR 70 -2.751 -1.961 -8.509
504 HA THR 70 HA THR 70 -4.055 -3.857 -6.720
505 HB THR 70 HB THR 70 -2.540 -5.604 -7.696
506 HG1 THR 70 HG1 THR 70 -1.773 -3.367 -9.306
507 HG21 THR 70 HG21 THR 70 -4.823 -5.370 -8.544
508 HG22 THR 70 HG22 THR 70 -3.731 -5.769 -9.887
509 HG23 THR 70 HG23 THR 70 -4.294 -4.106 -9.646
510 HA PRO 71 HA PRO 71 -1.221 -2.711 -3.574
511 HB2 PRO 71 HB2 PRO 71 -0.726 -5.606 -3.082
512 HB3 PRO 71 HB1 PRO 71 -1.265 -4.353 -1.960
513 HG2 PRO 71 HG2 PRO 71 -2.999 -6.130 -2.886
514 HG3 PRO 71 HG1 PRO 71 -3.452 -4.420 -2.738
515 HD2 PRO 71 HD2 PRO 71 -2.677 -5.962 -5.186
516 HD3 PRO 71 HD1 PRO 71 -3.967 -4.760 -4.967
517 H ARG 72 HN ARG 72 -0.069 -5.140 -5.826
518 HA ARG 72 HA ARG 72 2.619 -5.117 -5.041
519 HB2 ARG 72 HB2 ARG 72 3.133 -6.048 -7.294
520 HB3 ARG 72 HB1 ARG 72 1.900 -6.912 -6.406
521 HG2 ARG 72 HG2 ARG 72 0.175 -5.809 -7.788
522 HG3 ARG 72 HG1 ARG 72 1.461 -4.999 -8.685
523 HD2 ARG 72 HD2 ARG 72 1.166 -7.985 -8.428
524 HD3 ARG 72 HD1 ARG 72 0.641 -7.034 -9.821
525 HE ARG 72 HE ARG 72 3.073 -6.316 -9.884
526 HH11 ARG 72 HH11 ARG 72 2.091 -9.620 -8.812
527 HH12 ARG 72 HH12 ARG 72 3.474 -10.355 -9.428
528 HH21 ARG 72 HH21 ARG 72 4.964 -7.379 -10.719
529 HH22 ARG 72 HH22 ARG 72 5.165 -9.072 -10.552
530 H GLU 73 HN GLU 73 0.865 -2.935 -7.075
531 HA GLU 73 HA GLU 73 3.143 -1.673 -8.237
532 HB2 GLU 73 HB2 GLU 73 0.348 -0.644 -7.828
533 HB3 GLU 73 HB1 GLU 73 1.548 0.001 -8.941
534 HG2 GLU 73 HG2 GLU 73 1.481 -1.967 -10.261
535 HG3 GLU 73 HG1 GLU 73 0.452 -2.780 -9.074
536 H LEU 74 HN LEU 74 0.987 -0.991 -5.545
537 HA LEU 74 HA LEU 74 2.018 1.471 -4.628
538 HB2 LEU 74 HB2 LEU 74 -0.091 0.094 -3.935
539 HB3 LEU 74 HB1 LEU 74 1.070 -0.742 -2.908
540 HG LEU 74 HG LEU 74 -0.385 1.056 -1.774
541 HD11 LEU 74 HD11 LEU 74 1.603 0.186 -0.690
542 HD12 LEU 74 HD12 LEU 74 1.408 1.909 -0.376
543 HD13 LEU 74 HD13 LEU 74 2.598 1.354 -1.556
544 HD21 LEU 74 HD21 LEU 74 1.476 2.865 -3.290
545 HD22 LEU 74 HD22 LEU 74 0.380 3.357 -1.994
546 HD23 LEU 74 HD23 LEU 74 -0.276 2.737 -3.512
547 H LEU 75 HN LEU 75 2.688 -1.871 -3.764
548 HA LEU 75 HA LEU 75 4.633 -1.614 -1.841
549 HB2 LEU 75 HB2 LEU 75 3.480 -3.654 -2.337
550 HB3 LEU 75 HB1 LEU 75 4.108 -3.642 -3.973
551 HG LEU 75 HG LEU 75 6.328 -3.884 -3.052
552 HD11 LEU 75 HD11 LEU 75 6.571 -4.786 -0.736
553 HD12 LEU 75 HD12 LEU 75 4.859 -4.454 -0.481
554 HD13 LEU 75 HD13 LEU 75 5.977 -3.128 -0.785
555 HD21 LEU 75 HD21 LEU 75 6.114 -6.300 -2.663
556 HD22 LEU 75 HD22 LEU 75 5.107 -5.703 -4.004
557 HD23 LEU 75 HD23 LEU 75 4.372 -6.071 -2.445
558 H ASP 76 HN ASP 76 4.864 -1.751 -5.353
559 HA ASP 76 HA ASP 76 7.708 -1.859 -5.421
560 HB2 ASP 76 HB2 ASP 76 6.299 -2.836 -7.172
561 HB3 ASP 76 HB1 ASP 76 5.743 -1.231 -7.623
562 H LEU 77 HN LEU 77 5.325 0.695 -5.567
563 HA LEU 77 HA LEU 77 6.994 2.833 -6.318
564 HB2 LEU 77 HB2 LEU 77 4.674 2.818 -4.394
565 HB3 LEU 77 HB1 LEU 77 5.407 4.262 -5.054
566 HG LEU 77 HG LEU 77 3.973 2.152 -6.637
567 HD11 LEU 77 HD11 LEU 77 2.467 3.410 -5.182
568 HD12 LEU 77 HD12 LEU 77 2.195 3.826 -6.865
569 HD13 LEU 77 HD13 LEU 77 3.101 4.930 -5.810
570 HD21 LEU 77 HD21 LEU 77 4.096 3.779 -8.474
571 HD22 LEU 77 HD22 LEU 77 5.702 3.286 -7.937
572 HD23 LEU 77 HD23 LEU 77 5.048 4.850 -7.449
573 H ILE 78 HN ILE 78 6.219 1.444 -3.208
574 HA ILE 78 HA ILE 78 7.793 3.037 -1.531
575 HB ILE 78 HB ILE 78 7.102 0.088 -1.259
576 HG12 ILE 78 HG12 ILE 78 5.125 1.568 -1.403
577 HG13 ILE 78 HG11 ILE 78 5.256 0.807 0.175
578 HG21 ILE 78 HG21 ILE 78 7.533 0.328 1.145
579 HG22 ILE 78 HG22 ILE 78 8.074 1.986 0.878
580 HG23 ILE 78 HG23 ILE 78 8.987 0.643 0.194
581 HD11 ILE 78 HD11 ILE 78 4.584 3.126 0.361
582 HD12 ILE 78 HD12 ILE 78 6.035 3.640 -0.500
583 HD13 ILE 78 HD13 ILE 78 6.168 2.877 1.087
584 H ASN 79 HN ASN 79 8.509 -0.078 -3.048
585 HA ASN 79 HA ASN 79 11.173 -0.375 -2.233
586 HB2 ASN 79 HB2 ASN 79 9.893 -1.378 -4.794
587 HB3 ASN 79 HB1 ASN 79 11.457 -1.890 -4.184
588 HD21 ASN 79 HD21 ASN 79 10.449 -1.900 -1.387
589 HD22 ASN 79 HD22 ASN 79 9.488 -3.339 -1.272
590 H GLY 80 HN GLY 80 9.868 1.275 -5.058
591 HA2 GLY 80 HA2 GLY 80 12.315 1.874 -6.304
592 HA3 GLY 80 HA1 GLY 80 10.804 2.746 -6.525
593 H ALA 81 HN ALA 81 10.238 3.929 -4.291
594 HA ALA 81 HA ALA 81 11.916 6.158 -4.202
595 HB1 ALA 81 HB1 ALA 81 9.553 6.209 -3.611
596 HB2 ALA 81 HB2 ALA 81 10.556 6.916 -2.342
597 HB3 ALA 81 HB3 ALA 81 9.898 5.289 -2.146
598 H LEU 82 HN LEU 82 11.779 3.330 -2.079
599 HA LEU 82 HA LEU 82 13.399 4.279 -0.025
600 HB2 LEU 82 HB2 LEU 82 11.929 2.373 0.192
601 HB3 LEU 82 HB1 LEU 82 12.840 1.496 -1.029
602 HG LEU 82 HG LEU 82 14.743 1.496 0.438
603 HD11 LEU 82 HD11 LEU 82 12.853 2.676 2.486
604 HD12 LEU 82 HD12 LEU 82 14.273 3.466 1.804
605 HD13 LEU 82 HD13 LEU 82 14.461 2.050 2.846
606 HD21 LEU 82 HD21 LEU 82 13.904 -0.206 2.009
607 HD22 LEU 82 HD22 LEU 82 13.240 -0.407 0.388
608 HD23 LEU 82 HD23 LEU 82 12.258 0.322 1.658
609 H ALA 83 HN ALA 83 14.130 2.510 -3.004
610 HA ALA 83 HA ALA 83 16.872 2.192 -2.338
611 HB1 ALA 83 HB1 ALA 83 17.147 1.270 -4.571
612 HB2 ALA 83 HB2 ALA 83 15.516 1.777 -5.017
613 HB3 ALA 83 HB3 ALA 83 15.755 0.568 -3.759
614 H GLU 84 HN GLU 84 15.076 4.803 -3.788
615 HA GLU 84 HA GLU 84 17.398 5.969 -4.958
616 HB2 GLU 84 HB2 GLU 84 14.616 7.013 -4.448
617 HB3 GLU 84 HB1 GLU 84 15.874 7.881 -5.297
618 HG2 GLU 84 HG2 GLU 84 15.921 6.033 -6.976
619 HG3 GLU 84 HG1 GLU 84 14.559 5.315 -6.118
620 H ALA 85 HN ALA 85 15.513 6.196 -2.017
621 HA ALA 85 HA ALA 85 16.745 8.543 -0.994
622 HB1 ALA 85 HB1 ALA 85 15.633 7.988 1.098
623 HB2 ALA 85 HB2 ALA 85 15.258 6.380 0.485
624 HB3 ALA 85 HB3 ALA 85 14.524 7.800 -0.263
625 H ALA 86 HN ALA 86 17.198 5.070 -0.142
626 HA ALA 86 HA ALA 86 19.774 5.874 0.992
627 HB1 ALA 86 HB1 ALA 86 18.199 5.119 2.734
628 HB2 ALA 86 HB2 ALA 86 19.573 4.023 2.571
629 HB3 ALA 86 HB3 ALA 86 18.008 3.586 1.879
630 H28A SDO 101 H28A SDO 42 -12.668 10.757 0.439
631 H28B SDO 101 H28B SDO 42 -10.992 10.228 0.377
632 H30A SDO 101 H30A SDO 42 -10.052 12.463 1.519
633 H30B SDO 101 H30B SDO 42 -11.707 12.045 1.801
634 H30C SDO 101 H30C SDO 42 -11.345 13.697 1.472
635 H31A SDO 101 H31A SDO 42 -10.220 11.830 -1.967
636 H31B SDO 101 H31B SDO 42 -9.206 11.884 -0.489
637 H31C SDO 101 H31C SDO 42 -9.851 13.375 -1.232
638 H32A SDO 101 H32A SDO 42 -13.249 13.219 -0.288
639 H33A SDO 101 H33A SDO 42 -13.074 13.519 -2.654
640 H36A SDO 101 H36A SDO 42 -10.466 14.688 0.111
641 H37A SDO 101 H37A SDO 42 -10.339 16.873 -1.663
642 H37B SDO 101 H37B SDO 42 -11.307 17.290 -0.262
643 H38A SDO 101 H38A SDO 42 -8.442 16.342 -0.227
644 H38B SDO 101 H38B SDO 42 -9.021 17.975 0.120
645 H41A SDO 101 H41A SDO 42 -11.339 16.441 1.607
646 H42A SDO 101 H42A SDO 42 -10.159 15.117 3.778
647 H42B SDO 101 H42B SDO 42 -10.619 16.775 4.224
648 H43A SDO 101 H43A SDO 42 -12.401 14.759 2.902
649 H43B SDO 101 H43B SDO 42 -12.925 16.261 3.645
650 H1A SDO 101 H1A SDO 42 -11.657 14.690 7.395
651 H1B SDO 101 H1B SDO 42 -11.237 13.204 6.587
652 H2A SDO 101 H2A SDO 42 -10.063 15.892 6.011
653 H2B SDO 101 H2B SDO 42 -9.605 14.395 5.243
654 H4A SDO 101 H4A SDO 42 -8.537 14.562 9.368
655 H4B SDO 101 H4B SDO 42 -8.130 13.059 8.589
656 H5A SDO 101 H5A SDO 42 -10.517 12.555 8.286
657 H5B SDO 101 H5B SDO 42 -10.909 14.018 9.187
658 H6A SDO 101 H6A SDO 42 -9.688 13.162 11.124
659 H6B SDO 101 H6B SDO 42 -9.266 11.706 10.230
660 H8A SDO 101 H8A SDO 42 -12.954 10.936 9.786
661 H8B SDO 101 H8B SDO 42 -12.350 12.459 9.125
662 H8C SDO 101 H8C SDO 42 -13.324 12.463 10.597
Start of MODEL 8
1 H1 MET 1 HT1 MET 1 20.666 -7.901 2.630
2 H2 MET 1 HT2 MET 1 19.052 -7.754 2.165
3 H3 MET 1 HT3 MET 1 19.602 -9.199 2.836
4 HA MET 1 HA MET 1 18.334 -7.909 4.429
5 HB2 MET 1 HB2 MET 1 20.238 -9.280 5.242
6 HB3 MET 1 HB1 MET 1 21.315 -7.903 5.031
7 HG2 MET 1 HG2 MET 1 20.082 -6.686 6.745
8 HG3 MET 1 HG1 MET 1 18.995 -8.059 6.940
9 HE1 MET 1 HE1 MET 1 21.496 -10.829 8.247
10 HE2 MET 1 HE2 MET 1 21.112 -10.469 6.563
11 HE3 MET 1 HE3 MET 1 19.833 -10.480 7.778
12 H ALA 2 HN ALA 2 17.466 -5.986 4.021
13 HA ALA 2 HA ALA 2 19.058 -3.612 4.560
14 HB1 ALA 2 HB1 ALA 2 19.314 -3.927 2.153
15 HB2 ALA 2 HB2 ALA 2 18.383 -2.472 2.510
16 HB3 ALA 2 HB3 ALA 2 17.561 -3.943 1.966
17 H THR 3 HN THR 3 16.391 -5.345 5.165
18 HA THR 3 HA THR 3 14.317 -5.023 5.843
19 HB THR 3 HB THR 3 15.120 -2.145 6.469
20 HG1 THR 3 HG1 THR 3 15.969 -4.572 7.454
21 HG21 THR 3 HG21 THR 3 13.181 -4.063 7.804
22 HG22 THR 3 HG22 THR 3 12.725 -2.698 6.784
23 HG23 THR 3 HG23 THR 3 13.514 -2.411 8.329
24 H LEU 4 HN LEU 4 14.294 -5.176 3.378
25 HA LEU 4 HA LEU 4 12.940 -2.904 2.139
26 HB2 LEU 4 HB2 LEU 4 14.837 -4.014 0.942
27 HB3 LEU 4 HB1 LEU 4 13.950 -5.519 0.993
28 HG LEU 4 HG LEU 4 12.201 -4.504 -0.452
29 HD11 LEU 4 HD11 LEU 4 12.564 -2.162 0.144
30 HD12 LEU 4 HD12 LEU 4 12.650 -2.416 -1.595
31 HD13 LEU 4 HD13 LEU 4 14.129 -2.195 -0.664
32 HD21 LEU 4 HD21 LEU 4 13.538 -4.542 -2.504
33 HD22 LEU 4 HD22 LEU 4 13.995 -5.850 -1.418
34 HD23 LEU 4 HD23 LEU 4 15.012 -4.416 -1.544
35 H LEU 5 HN LEU 5 10.815 -2.995 1.894
36 HA LEU 5 HA LEU 5 9.241 -4.895 3.212
37 HB2 LEU 5 HB2 LEU 5 8.481 -2.893 1.115
38 HB3 LEU 5 HB1 LEU 5 7.305 -3.848 1.971
39 HG LEU 5 HG LEU 5 9.134 -1.742 3.117
40 HD11 LEU 5 HD11 LEU 5 6.143 -1.948 2.949
41 HD12 LEU 5 HD12 LEU 5 7.165 -0.970 1.896
42 HD13 LEU 5 HD13 LEU 5 7.067 -0.598 3.622
43 HD21 LEU 5 HD21 LEU 5 8.052 -2.196 5.248
44 HD22 LEU 5 HD22 LEU 5 8.946 -3.604 4.677
45 HD23 LEU 5 HD23 LEU 5 7.187 -3.552 4.524
46 H THR 6 HN THR 6 8.864 -6.875 2.720
47 HA THR 6 HA THR 6 8.861 -7.688 -0.067
48 HB THR 6 HB THR 6 8.860 -10.018 0.840
49 HG1 THR 6 HG1 THR 6 8.917 -8.659 3.366
50 HG21 THR 6 HG21 THR 6 11.150 -9.995 1.738
51 HG22 THR 6 HG22 THR 6 11.038 -8.249 1.968
52 HG23 THR 6 HG23 THR 6 11.002 -8.931 0.339
53 H THR 7 HN THR 7 7.134 -9.809 -0.083
54 HA THR 7 HA THR 7 4.600 -8.512 -0.122
55 HB THR 7 HB THR 7 5.009 -11.499 -0.280
56 HG1 THR 7 HG1 THR 7 5.987 -9.502 -2.043
57 HG21 THR 7 HG21 THR 7 2.706 -10.628 -0.448
58 HG22 THR 7 HG22 THR 7 3.232 -11.332 -1.981
59 HG23 THR 7 HG23 THR 7 3.196 -9.588 -1.788
60 H ASP 8 HN ASP 8 6.417 -10.105 2.248
61 HA ASP 8 HA ASP 8 4.254 -11.168 3.815
62 HB2 ASP 8 HB2 ASP 8 6.534 -12.180 3.788
63 HB3 ASP 8 HB1 ASP 8 7.155 -10.728 4.560
64 H ASP 9 HN ASP 9 6.507 -8.465 3.987
65 HA ASP 9 HA ASP 9 5.609 -7.276 6.387
66 HB2 ASP 9 HB2 ASP 9 6.803 -5.870 3.988
67 HB3 ASP 9 HB1 ASP 9 6.720 -5.249 5.617
68 H LEU 10 HN LEU 10 4.856 -6.699 2.992
69 HA LEU 10 HA LEU 10 3.125 -4.529 3.296
70 HB2 LEU 10 HB2 LEU 10 4.072 -5.209 1.138
71 HB3 LEU 10 HB1 LEU 10 3.077 -6.652 1.167
72 HG LEU 10 HG LEU 10 1.060 -5.162 1.215
73 HD11 LEU 10 HD11 LEU 10 3.051 -3.023 0.536
74 HD12 LEU 10 HD12 LEU 10 2.051 -3.127 1.983
75 HD13 LEU 10 HD13 LEU 10 1.297 -2.864 0.409
76 HD21 LEU 10 HD21 LEU 10 1.751 -6.303 -0.809
77 HD22 LEU 10 HD22 LEU 10 2.859 -4.991 -1.201
78 HD23 LEU 10 HD23 LEU 10 1.120 -4.704 -1.198
79 H ARG 11 HN ARG 11 2.505 -7.986 3.416
80 HA ARG 11 HA ARG 11 -0.275 -7.938 3.227
81 HB2 ARG 11 HB2 ARG 11 1.102 -9.982 3.094
82 HB3 ARG 11 HB1 ARG 11 1.416 -9.865 4.820
83 HG2 ARG 11 HG2 ARG 11 -0.947 -10.215 5.294
84 HG3 ARG 11 HG1 ARG 11 -1.306 -10.252 3.564
85 HD2 ARG 11 HD2 ARG 11 -1.184 -12.516 4.395
86 HD3 ARG 11 HD1 ARG 11 0.178 -12.207 3.327
87 HE ARG 11 HE ARG 11 0.275 -12.273 6.255
88 HH11 ARG 11 HH11 ARG 11 1.912 -12.650 3.125
89 HH12 ARG 11 HH12 ARG 11 3.376 -13.240 3.778
90 HH21 ARG 11 HH21 ARG 11 2.270 -13.113 7.151
91 HH22 ARG 11 HH22 ARG 11 3.625 -13.367 6.127
92 H ARG 12 HN ARG 12 1.806 -7.815 6.038
93 HA ARG 12 HA ARG 12 -0.167 -7.792 8.052
94 HB2 ARG 12 HB2 ARG 12 2.435 -6.279 8.180
95 HB3 ARG 12 HB1 ARG 12 1.534 -6.979 9.513
96 HG2 ARG 12 HG2 ARG 12 2.106 -9.207 8.756
97 HG3 ARG 12 HG1 ARG 12 2.955 -8.534 7.360
98 HD2 ARG 12 HD2 ARG 12 4.318 -7.212 9.076
99 HD3 ARG 12 HD1 ARG 12 3.652 -8.324 10.266
100 HE ARG 12 HE ARG 12 4.716 -9.860 8.230
101 HH11 ARG 12 HH11 ARG 12 5.883 -7.590 10.685
102 HH12 ARG 12 HH12 ARG 12 7.472 -8.205 10.722
103 HH21 ARG 12 HH21 ARG 12 6.869 -10.637 8.195
104 HH22 ARG 12 HH22 ARG 12 8.084 -9.969 9.210
105 H ALA 13 HN ALA 13 1.577 -5.187 6.470
106 HA ALA 13 HA ALA 13 0.336 -3.070 7.834
107 HB1 ALA 13 HB1 ALA 13 1.725 -2.994 5.161
108 HB2 ALA 13 HB2 ALA 13 2.511 -2.842 6.738
109 HB3 ALA 13 HB3 ALA 13 1.380 -1.603 6.194
110 H LEU 14 HN LEU 14 -0.456 -4.565 4.712
111 HA LEU 14 HA LEU 14 -2.398 -2.609 4.072
112 HB2 LEU 14 HB2 LEU 14 -1.169 -4.067 2.447
113 HB3 LEU 14 HB1 LEU 14 -2.175 -5.403 2.981
114 HG LEU 14 HG LEU 14 -4.165 -4.145 2.202
115 HD11 LEU 14 HD11 LEU 14 -3.846 -2.238 0.711
116 HD12 LEU 14 HD12 LEU 14 -2.116 -2.268 1.021
117 HD13 LEU 14 HD13 LEU 14 -3.238 -1.882 2.329
118 HD21 LEU 14 HD21 LEU 14 -3.125 -5.842 0.821
119 HD22 LEU 14 HD22 LEU 14 -2.026 -4.640 0.142
120 HD23 LEU 14 HD23 LEU 14 -3.755 -4.531 -0.174
121 H VAL 15 HN VAL 15 -2.456 -5.362 6.093
122 HA VAL 15 HA VAL 15 -5.335 -5.596 6.159
123 HB VAL 15 HB VAL 15 -3.152 -6.719 7.958
124 HG11 VAL 15 HG11 VAL 15 -6.121 -7.345 7.978
125 HG12 VAL 15 HG12 VAL 15 -5.261 -6.446 9.226
126 HG13 VAL 15 HG13 VAL 15 -4.894 -8.156 8.953
127 HG21 VAL 15 HG21 VAL 15 -3.179 -7.695 5.733
128 HG22 VAL 15 HG22 VAL 15 -4.904 -8.023 5.875
129 HG23 VAL 15 HG23 VAL 15 -3.761 -8.867 6.915
130 H GLU 16 HN GLU 16 -2.813 -4.478 8.381
131 HA GLU 16 HA GLU 16 -4.473 -3.457 10.375
132 HB2 GLU 16 HB2 GLU 16 -1.704 -2.500 9.658
133 HB3 GLU 16 HB1 GLU 16 -2.508 -2.281 11.203
134 HG2 GLU 16 HG2 GLU 16 -2.556 -4.730 11.481
135 HG3 GLU 16 HG1 GLU 16 -1.656 -4.893 9.981
136 H SER 17 HN SER 17 -3.462 -1.955 7.361
137 HA SER 17 HA SER 17 -4.311 0.662 8.202
138 HB2 SER 17 HB2 SER 17 -3.571 -0.313 5.437
139 HB3 SER 17 HB1 SER 17 -3.691 1.368 5.959
140 HG SER 17 HG SER 17 -1.819 -0.587 6.586
141 H ALA 18 HN ALA 18 -5.881 -2.081 6.974
142 HA ALA 18 HA ALA 18 -7.982 -0.652 5.599
143 HB1 ALA 18 HB1 ALA 18 -9.035 -2.877 5.389
144 HB2 ALA 18 HB2 ALA 18 -7.751 -3.571 6.385
145 HB3 ALA 18 HB3 ALA 18 -7.371 -2.879 4.805
146 H GLY 19 HN GLY 19 -7.999 -2.939 8.269
147 HA2 GLY 19 HA2 GLY 19 -9.038 -2.993 10.294
148 HA3 GLY 19 HA1 GLY 19 -8.957 -1.250 10.255
149 H GLU 20 HN GLU 20 -10.767 -0.174 9.021
150 HA GLU 20 HA GLU 20 -13.228 -1.368 10.099
151 HB2 GLU 20 HB2 GLU 20 -14.033 0.980 10.260
152 HB3 GLU 20 HB1 GLU 20 -12.662 0.610 11.289
153 HG2 GLU 20 HG2 GLU 20 -11.161 1.727 9.729
154 HG3 GLU 20 HG1 GLU 20 -12.525 2.047 8.648
155 H THR 21 HN THR 21 -12.029 -1.590 7.357
156 HA THR 21 HA THR 21 -14.364 -0.604 5.914
157 HB THR 21 HB THR 21 -12.162 0.167 5.104
158 HG1 THR 21 HG1 THR 21 -12.533 -0.506 2.831
159 HG21 THR 21 HG21 THR 21 -11.645 -2.748 4.486
160 HG22 THR 21 HG22 THR 21 -10.771 -1.750 5.646
161 HG23 THR 21 HG23 THR 21 -10.638 -1.414 3.917
162 H ASP 22 HN ASP 22 -13.892 -2.609 3.765
163 HA ASP 22 HA ASP 22 -15.367 -4.770 4.933
164 HB2 ASP 22 HB2 ASP 22 -15.647 -4.206 2.577
165 HB3 ASP 22 HB1 ASP 22 -13.990 -4.707 2.235
166 H GLY 23 HN GLY 23 -14.635 -6.346 6.050
167 HA2 GLY 23 HA2 GLY 23 -11.789 -6.645 6.262
168 HA3 GLY 23 HA1 GLY 23 -12.969 -7.436 7.316
169 H THR 24 HN THR 24 -11.751 -7.399 4.061
170 HA THR 24 HA THR 24 -12.686 -10.022 3.449
171 HB THR 24 HB THR 24 -12.586 -8.324 1.713
172 HG1 THR 24 HG1 THR 24 -11.714 -9.504 0.117
173 HG21 THR 24 HG21 THR 24 -10.444 -7.494 0.813
174 HG22 THR 24 HG22 THR 24 -9.588 -8.343 2.100
175 HG23 THR 24 HG23 THR 24 -10.695 -7.029 2.499
176 H ASP 25 HN ASP 25 -10.532 -11.152 2.057
177 HA ASP 25 HA ASP 25 -8.681 -11.702 4.269
178 HB2 ASP 25 HB2 ASP 25 -10.205 -13.566 4.111
179 HB3 ASP 25 HB1 ASP 25 -9.821 -13.769 2.398
180 H LEU 26 HN LEU 26 -6.757 -11.253 3.855
181 HA LEU 26 HA LEU 26 -5.694 -11.271 1.111
182 HB2 LEU 26 HB2 LEU 26 -4.795 -9.900 3.657
183 HB3 LEU 26 HB1 LEU 26 -3.789 -9.999 2.238
184 HG LEU 26 HG LEU 26 -5.475 -8.636 0.999
185 HD11 LEU 26 HD11 LEU 26 -7.468 -9.195 2.298
186 HD12 LEU 26 HD12 LEU 26 -7.212 -7.456 2.176
187 HD13 LEU 26 HD13 LEU 26 -6.810 -8.304 3.677
188 HD21 LEU 26 HD21 LEU 26 -3.542 -7.619 2.049
189 HD22 LEU 26 HD22 LEU 26 -4.461 -7.419 3.549
190 HD23 LEU 26 HD23 LEU 26 -4.945 -6.546 2.095
191 H SER 27 HN SER 27 -6.038 -13.662 3.028
192 HA SER 27 HA SER 27 -3.265 -14.207 3.716
193 HB2 SER 27 HB2 SER 27 -5.676 -15.872 4.423
194 HB3 SER 27 HB1 SER 27 -4.117 -15.824 5.246
195 HG SER 27 HG SER 27 -6.299 -14.156 5.370
196 H GLY 28 HN GLY 28 -4.941 -14.550 1.082
197 HA2 GLY 28 HA2 GLY 28 -3.614 -17.075 0.352
198 HA3 GLY 28 HA1 GLY 28 -5.322 -16.869 -0.023
199 H ASP 29 HN ASP 29 -2.449 -14.863 -0.240
200 HA ASP 29 HA ASP 29 -1.633 -13.482 -1.782
201 HB2 ASP 29 HB2 ASP 29 -1.379 -15.195 -3.408
202 HB3 ASP 29 HB1 ASP 29 -3.107 -15.259 -3.721
203 H PHE 30 HN PHE 30 -1.967 -11.574 -2.105
204 HA PHE 30 HA PHE 30 -4.645 -10.524 -2.717
205 HB2 PHE 30 HB2 PHE 30 -4.347 -8.837 -0.956
206 HB3 PHE 30 HB1 PHE 30 -4.238 -10.450 -0.258
207 HD1 PHE 30 HD2 PHE 30 -1.986 -11.380 0.358
208 HD2 PHE 30 HD1 PHE 30 -2.519 -7.344 -0.849
209 HE1 PHE 30 HE2 PHE 30 0.231 -10.825 1.226
210 HE2 PHE 30 HE1 PHE 30 -0.295 -6.780 0.028
211 HZ PHE 30 HZ PHE 30 1.083 -8.528 1.063
212 H LEU 31 HN LEU 31 -1.615 -10.889 -3.770
213 HA LEU 31 HA LEU 31 -0.674 -8.161 -3.877
214 HB2 LEU 31 HB2 LEU 31 0.713 -10.311 -3.638
215 HB3 LEU 31 HB1 LEU 31 0.422 -10.553 -5.340
216 HG LEU 31 HG LEU 31 1.535 -8.372 -5.785
217 HD11 LEU 31 HD11 LEU 31 2.217 -8.520 -2.843
218 HD12 LEU 31 HD12 LEU 31 1.162 -7.337 -3.607
219 HD13 LEU 31 HD13 LEU 31 2.878 -7.365 -4.003
220 HD21 LEU 31 HD21 LEU 31 3.167 -10.415 -4.280
221 HD22 LEU 31 HD22 LEU 31 3.798 -9.208 -5.410
222 HD23 LEU 31 HD23 LEU 31 2.732 -10.489 -5.986
223 H ASP 32 HN ASP 32 -2.266 -10.465 -5.897
224 HA ASP 32 HA ASP 32 -2.181 -8.736 -8.263
225 HB2 ASP 32 HB2 ASP 32 -1.690 -11.138 -8.497
226 HB3 ASP 32 HB1 ASP 32 -3.278 -11.534 -7.853
227 H LEU 33 HN LEU 33 -3.976 -8.949 -5.564
228 HA LEU 33 HA LEU 33 -6.612 -8.959 -6.750
229 HB2 LEU 33 HB2 LEU 33 -5.954 -9.963 -4.472
230 HB3 LEU 33 HB1 LEU 33 -5.921 -8.319 -3.879
231 HG LEU 33 HG LEU 33 -8.313 -8.074 -4.301
232 HD11 LEU 33 HD11 LEU 33 -8.446 -9.495 -6.305
233 HD12 LEU 33 HD12 LEU 33 -9.637 -9.976 -5.092
234 HD13 LEU 33 HD13 LEU 33 -8.161 -10.922 -5.304
235 HD21 LEU 33 HD21 LEU 33 -9.127 -9.697 -2.678
236 HD22 LEU 33 HD22 LEU 33 -7.565 -9.051 -2.172
237 HD23 LEU 33 HD23 LEU 33 -7.665 -10.659 -2.886
238 H ARG 34 HN ARG 34 -8.101 -7.082 -6.421
239 HA ARG 34 HA ARG 34 -6.590 -4.692 -7.181
240 HB2 ARG 34 HB2 ARG 34 -9.568 -5.168 -7.430
241 HB3 ARG 34 HB1 ARG 34 -8.615 -3.952 -8.264
242 HG2 ARG 34 HG2 ARG 34 -8.441 -6.941 -8.689
243 HG3 ARG 34 HG1 ARG 34 -9.218 -5.781 -9.767
244 HD2 ARG 34 HD2 ARG 34 -7.122 -4.760 -10.285
245 HD3 ARG 34 HD1 ARG 34 -6.308 -5.677 -9.018
246 HE ARG 34 HE ARG 34 -7.293 -7.604 -10.646
247 HH11 ARG 34 HH11 ARG 34 -5.362 -4.715 -11.373
248 HH12 ARG 34 HH12 ARG 34 -4.412 -5.499 -12.557
249 HH21 ARG 34 HH21 ARG 34 -5.980 -8.638 -12.251
250 HH22 ARG 34 HH22 ARG 34 -4.735 -7.775 -13.054
251 H PHE 35 HN PHE 35 -6.956 -2.621 -6.198
252 HA PHE 35 HA PHE 35 -7.562 -2.676 -3.465
253 HB2 PHE 35 HB2 PHE 35 -7.229 -0.355 -5.350
254 HB3 PHE 35 HB1 PHE 35 -7.729 -0.087 -3.685
255 HD1 PHE 35 HD2 PHE 35 -6.173 -1.438 -1.932
256 HD2 PHE 35 HD1 PHE 35 -5.021 -0.133 -5.803
257 HE1 PHE 35 HE2 PHE 35 -3.819 -1.509 -1.254
258 HE2 PHE 35 HE1 PHE 35 -2.665 -0.206 -5.138
259 HZ PHE 35 HZ PHE 35 -2.088 -0.805 -2.738
260 H GLU 36 HN GLU 36 -9.688 -1.909 -6.161
261 HA GLU 36 HA GLU 36 -11.843 -0.976 -4.589
262 HB2 GLU 36 HB2 GLU 36 -11.967 -2.349 -7.279
263 HB3 GLU 36 HB1 GLU 36 -13.234 -1.364 -6.550
264 HG2 GLU 36 HG2 GLU 36 -11.713 0.579 -6.653
265 HG3 GLU 36 HG1 GLU 36 -10.523 -0.427 -7.477
266 H ASP 37 HN ASP 37 -10.589 -4.091 -5.166
267 HA ASP 37 HA ASP 37 -13.005 -5.558 -4.545
268 HB2 ASP 37 HB2 ASP 37 -11.178 -6.417 -6.066
269 HB3 ASP 37 HB1 ASP 37 -10.149 -6.559 -4.657
270 H ILE 38 HN ILE 38 -9.907 -4.809 -2.990
271 HA ILE 38 HA ILE 38 -10.719 -6.055 -0.518
272 HB ILE 38 HB ILE 38 -8.535 -5.245 0.406
273 HG12 ILE 38 HG12 ILE 38 -8.069 -4.335 -2.445
274 HG13 ILE 38 HG11 ILE 38 -8.224 -3.284 -1.041
275 HG21 ILE 38 HG21 ILE 38 -8.417 -6.877 -2.114
276 HG22 ILE 38 HG22 ILE 38 -8.781 -7.464 -0.488
277 HG23 ILE 38 HG23 ILE 38 -7.181 -6.829 -0.855
278 HD11 ILE 38 HD11 ILE 38 -6.173 -4.230 -0.115
279 HD12 ILE 38 HD12 ILE 38 -5.904 -3.543 -1.719
280 HD13 ILE 38 HD13 ILE 38 -6.027 -5.291 -1.516
281 H GLY 39 HN GLY 39 -12.053 -3.618 -1.557
282 HA2 GLY 39 HA2 GLY 39 -13.252 -1.912 -0.610
283 HA3 GLY 39 HA1 GLY 39 -12.814 -2.597 0.938
284 H TYR 40 HN TYR 40 -10.420 -1.332 -1.350
285 HA TYR 40 HA TYR 40 -9.867 0.601 0.682
286 HB2 TYR 40 HB2 TYR 40 -8.070 -0.352 -1.553
287 HB3 TYR 40 HB1 TYR 40 -7.901 1.265 -0.931
288 HD1 TYR 40 HD2 TYR 40 -8.306 -2.188 0.443
289 HD2 TYR 40 HD1 TYR 40 -6.551 1.661 0.787
290 HE1 TYR 40 HE2 TYR 40 -7.082 -2.929 2.446
291 HE2 TYR 40 HE1 TYR 40 -5.345 0.949 2.780
292 HH TYR 40 HH TYR 40 -5.192 -2.325 3.822
293 H ASP 41 HN ASP 41 -10.473 2.414 0.802
294 HA ASP 41 HA ASP 41 -11.717 3.767 -1.466
295 HB2 ASP 41 HB2 ASP 41 -12.819 3.379 0.864
296 HB3 ASP 41 HB1 ASP 41 -11.720 4.629 1.428
297 H SER 42 HN SER 42 -11.308 6.362 -0.879
298 HA SER 42 HA SER 42 -8.741 6.834 -1.861
299 HB2 SER 42 HB2 SER 42 -10.665 8.683 -0.504
300 HB3 SER 42 HB1 SER 42 -9.222 9.182 -1.377
301 H LEU 43 HN LEU 43 -10.003 7.889 1.327
302 HA LEU 43 HA LEU 43 -7.514 8.678 2.290
303 HB2 LEU 43 HB2 LEU 43 -10.002 7.921 3.798
304 HB3 LEU 43 HB1 LEU 43 -8.570 8.595 4.556
305 HG LEU 43 HG LEU 43 -10.266 9.969 2.473
306 HD11 LEU 43 HD11 LEU 43 -9.983 10.442 5.434
307 HD12 LEU 43 HD12 LEU 43 -11.394 9.778 4.610
308 HD13 LEU 43 HD13 LEU 43 -10.899 11.445 4.309
309 HD21 LEU 43 HD21 LEU 43 -8.894 11.947 3.025
310 HD22 LEU 43 HD22 LEU 43 -7.954 10.639 2.308
311 HD23 LEU 43 HD23 LEU 43 -7.876 10.917 4.046
312 H ALA 44 HN ALA 44 -9.025 5.585 2.342
313 HA ALA 44 HA ALA 44 -7.452 4.367 4.315
314 HB1 ALA 44 HB1 ALA 44 -8.130 2.232 3.290
315 HB2 ALA 44 HB2 ALA 44 -8.753 3.120 1.895
316 HB3 ALA 44 HB3 ALA 44 -9.496 3.335 3.483
317 H LEU 45 HN LEU 45 -6.971 4.806 0.856
318 HA LEU 45 HA LEU 45 -4.599 3.280 0.524
319 HB2 LEU 45 HB2 LEU 45 -6.209 4.348 -1.238
320 HB3 LEU 45 HB1 LEU 45 -5.294 5.811 -0.981
321 HG LEU 45 HG LEU 45 -4.423 4.966 -2.959
322 HD11 LEU 45 HD11 LEU 45 -2.589 5.493 -1.542
323 HD12 LEU 45 HD12 LEU 45 -2.208 4.104 -2.588
324 HD13 LEU 45 HD13 LEU 45 -2.643 3.843 -0.899
325 HD21 LEU 45 HD21 LEU 45 -3.785 2.781 -3.423
326 HD22 LEU 45 HD22 LEU 45 -5.502 2.809 -2.963
327 HD23 LEU 45 HD23 LEU 45 -4.258 2.205 -1.824
328 H MET 46 HN MET 46 -5.261 6.678 1.249
329 HA MET 46 HA MET 46 -2.592 7.681 1.196
330 HB2 MET 46 HB2 MET 46 -4.724 8.854 2.966
331 HB3 MET 46 HB1 MET 46 -3.440 9.682 2.092
332 HG2 MET 46 HG2 MET 46 -4.625 8.925 -0.006
333 HG3 MET 46 HG1 MET 46 -5.899 8.422 1.115
334 HE1 MET 46 HE1 MET 46 -4.601 12.845 0.700
335 HE2 MET 46 HE2 MET 46 -3.850 11.531 -0.209
336 HE3 MET 46 HE3 MET 46 -3.647 11.620 1.535
337 H GLU 47 HN GLU 47 -4.690 6.596 3.736
338 HA GLU 47 HA GLU 47 -3.084 6.973 5.947
339 HB2 GLU 47 HB2 GLU 47 -5.461 5.810 5.130
340 HB3 GLU 47 HB1 GLU 47 -4.718 4.661 6.273
341 HG2 GLU 47 HG2 GLU 47 -6.241 6.220 7.426
342 HG3 GLU 47 HG1 GLU 47 -4.576 6.531 7.906
343 H THR 48 HN THR 48 -3.447 4.120 3.863
344 HA THR 48 HA THR 48 -1.619 2.379 5.039
345 HB THR 48 HB THR 48 -2.295 2.790 2.108
346 HG1 THR 48 HG1 THR 48 -4.140 2.305 3.360
347 HG21 THR 48 HG21 THR 48 -0.270 1.404 2.424
348 HG22 THR 48 HG22 THR 48 -1.623 0.509 1.740
349 HG23 THR 48 HG23 THR 48 -1.198 0.296 3.447
350 H ALA 49 HN ALA 49 -1.134 4.630 2.334
351 HA ALA 49 HA ALA 49 1.560 4.248 1.904
352 HB1 ALA 49 HB1 ALA 49 -0.024 6.785 1.489
353 HB2 ALA 49 HB2 ALA 49 0.104 5.440 0.352
354 HB3 ALA 49 HB3 ALA 49 1.529 6.403 0.740
355 H ALA 50 HN ALA 50 -0.038 6.732 3.932
356 HA ALA 50 HA ALA 50 2.243 8.115 4.759
357 HB1 ALA 50 HB1 ALA 50 -0.057 8.936 5.020
358 HB2 ALA 50 HB2 ALA 50 0.864 9.048 6.516
359 HB3 ALA 50 HB3 ALA 50 -0.325 7.760 6.304
360 H ARG 51 HN ARG 51 0.765 5.243 6.097
361 HA ARG 51 HA ARG 51 2.310 5.173 8.461
362 HB2 ARG 51 HB2 ARG 51 0.197 3.967 8.352
363 HB3 ARG 51 HB1 ARG 51 0.750 3.019 6.991
364 HG2 ARG 51 HG2 ARG 51 2.171 2.782 9.606
365 HG3 ARG 51 HG1 ARG 51 0.602 2.003 9.413
366 HD2 ARG 51 HD2 ARG 51 1.465 0.801 7.434
367 HD3 ARG 51 HD1 ARG 51 3.014 1.605 7.657
368 HE ARG 51 HE ARG 51 3.549 0.119 9.279
369 HH11 ARG 51 HH11 ARG 51 -0.028 -0.145 8.913
370 HH12 ARG 51 HH12 ARG 51 -0.078 -1.606 9.774
371 HH21 ARG 51 HH21 ARG 51 3.325 -1.936 10.456
372 HH22 ARG 51 HH22 ARG 51 1.754 -2.604 10.612
373 H LEU 52 HN LEU 52 2.898 4.123 5.234
374 HA LEU 52 HA LEU 52 5.311 2.681 5.946
375 HB2 LEU 52 HB2 LEU 52 4.249 3.458 3.220
376 HB3 LEU 52 HB1 LEU 52 5.578 2.362 3.522
377 HG LEU 52 HG LEU 52 2.695 1.879 4.302
378 HD11 LEU 52 HD11 LEU 52 4.352 0.608 2.141
379 HD12 LEU 52 HD12 LEU 52 3.043 1.771 1.917
380 HD13 LEU 52 HD13 LEU 52 2.701 0.178 2.599
381 HD21 LEU 52 HD21 LEU 52 3.446 -0.401 4.862
382 HD22 LEU 52 HD22 LEU 52 4.222 0.813 5.877
383 HD23 LEU 52 HD23 LEU 52 5.111 0.083 4.537
384 H GLU 53 HN GLU 53 4.418 5.770 4.467
385 HA GLU 53 HA GLU 53 6.880 6.776 3.680
386 HB2 GLU 53 HB2 GLU 53 4.618 8.338 4.933
387 HB3 GLU 53 HB1 GLU 53 5.960 9.017 4.043
388 HG2 GLU 53 HG2 GLU 53 5.181 7.909 2.022
389 HG3 GLU 53 HG1 GLU 53 3.835 7.204 2.920
390 H SER 54 HN SER 54 5.249 7.258 6.770
391 HA SER 54 HA SER 54 7.236 8.918 7.851
392 HB2 SER 54 HB2 SER 54 5.983 8.480 9.998
393 HB3 SER 54 HB1 SER 54 5.020 9.104 8.655
394 HG SER 54 HG SER 54 4.044 7.227 8.419
395 H ARG 55 HN ARG 55 6.770 5.447 8.068
396 HA ARG 55 HA ARG 55 8.766 5.183 10.123
397 HB2 ARG 55 HB2 ARG 55 6.912 3.611 10.097
398 HB3 ARG 55 HB1 ARG 55 7.364 3.065 8.492
399 HG2 ARG 55 HG2 ARG 55 9.424 2.117 9.355
400 HG3 ARG 55 HG1 ARG 55 9.066 2.757 10.958
401 HD2 ARG 55 HD2 ARG 55 7.394 0.734 9.471
402 HD3 ARG 55 HD1 ARG 55 8.545 0.350 10.746
403 HE ARG 55 HE ARG 55 6.773 2.283 11.701
404 HH11 ARG 55 HH11 ARG 55 6.814 -1.188 10.917
405 HH12 ARG 55 HH12 ARG 55 5.456 -1.540 11.880
406 HH21 ARG 55 HH21 ARG 55 4.908 1.761 12.999
407 HH22 ARG 55 HH22 ARG 55 4.355 0.163 13.079
408 H TYR 56 HN TYR 56 8.679 4.662 6.633
409 HA TYR 56 HA TYR 56 11.380 3.660 6.848
410 HB2 TYR 56 HB2 TYR 56 9.444 3.548 4.553
411 HB3 TYR 56 HB1 TYR 56 11.121 3.006 4.447
412 HD1 TYR 56 HD1 TYR 56 11.911 1.261 6.124
413 HD2 TYR 56 HD2 TYR 56 7.799 2.069 5.412
414 HE1 TYR 56 HE1 TYR 56 11.323 -0.913 7.121
415 HE2 TYR 56 HE2 TYR 56 7.200 -0.098 6.409
416 HH TYR 56 HH TYR 56 8.356 -2.334 6.744
417 H GLY 57 HN GLY 57 9.821 6.553 5.888
418 HA2 GLY 57 HA2 GLY 57 11.056 8.559 5.680
419 HA3 GLY 57 HA1 GLY 57 12.476 7.612 5.264
420 H VAL 58 HN VAL 58 9.210 7.652 3.933
421 HA VAL 58 HA VAL 58 10.370 8.448 1.366
422 HB VAL 58 HB VAL 58 8.969 6.872 0.097
423 HG11 VAL 58 HG11 VAL 58 10.079 4.761 0.699
424 HG12 VAL 58 HG12 VAL 58 10.601 5.510 2.209
425 HG13 VAL 58 HG13 VAL 58 11.197 6.130 0.661
426 HG21 VAL 58 HG21 VAL 58 7.734 5.066 1.195
427 HG22 VAL 58 HG22 VAL 58 7.112 6.649 1.679
428 HG23 VAL 58 HG23 VAL 58 8.149 5.735 2.771
429 H SER 59 HN SER 59 8.314 8.822 -0.261
430 HA SER 59 HA SER 59 6.024 9.919 1.103
431 HB2 SER 59 HB2 SER 59 7.821 11.676 -0.593
432 HB3 SER 59 HB1 SER 59 6.255 12.143 0.053
433 HG SER 59 HG SER 59 7.795 11.155 1.995
434 H ILE 60 HN ILE 60 4.282 9.513 -0.086
435 HA ILE 60 HA ILE 60 4.667 9.028 -2.951
436 HB ILE 60 HB ILE 60 2.642 7.613 -1.148
437 HG12 ILE 60 HG12 ILE 60 3.859 5.505 -1.965
438 HG13 ILE 60 HG11 ILE 60 5.129 6.575 -2.532
439 HG21 ILE 60 HG21 ILE 60 3.104 7.298 -4.102
440 HG22 ILE 60 HG22 ILE 60 1.704 8.039 -3.339
441 HG23 ILE 60 HG23 ILE 60 2.023 6.306 -3.126
442 HD11 ILE 60 HD11 ILE 60 5.698 5.574 -0.405
443 HD12 ILE 60 HD12 ILE 60 4.228 6.235 0.318
444 HD13 ILE 60 HD13 ILE 60 5.501 7.317 -0.240
445 HA PRO 61 HA PRO 61 2.034 12.661 -3.053
446 HB2 PRO 61 HB2 PRO 61 2.312 12.137 -5.966
447 HB3 PRO 61 HB1 PRO 61 2.610 13.619 -5.055
448 HG2 PRO 61 HG2 PRO 61 4.647 12.202 -5.955
449 HG3 PRO 61 HG1 PRO 61 4.709 12.910 -4.329
450 HD2 PRO 61 HD2 PRO 61 4.115 10.083 -5.121
451 HD3 PRO 61 HD1 PRO 61 5.152 10.689 -3.807
452 H ASP 62 HN ASP 62 -0.043 13.169 -3.805
453 HA ASP 62 HA ASP 62 -2.072 11.334 -3.444
454 HB2 ASP 62 HB2 ASP 62 -2.230 13.833 -5.147
455 HB3 ASP 62 HB1 ASP 62 -3.587 12.941 -4.504
456 H ASP 63 HN ASP 63 -0.962 12.687 -6.483
457 HA ASP 63 HA ASP 63 -2.653 11.297 -8.202
458 HB2 ASP 63 HB2 ASP 63 0.038 12.548 -8.684
459 HB3 ASP 63 HB1 ASP 63 -0.958 11.872 -9.971
460 H VAL 64 HN VAL 64 0.285 10.272 -6.728
461 HA VAL 64 HA VAL 64 0.757 8.120 -8.594
462 HB VAL 64 HB VAL 64 2.031 8.637 -5.884
463 HG11 VAL 64 HG11 VAL 64 3.885 7.284 -6.770
464 HG12 VAL 64 HG12 VAL 64 2.925 6.946 -8.217
465 HG13 VAL 64 HG13 VAL 64 2.385 6.371 -6.642
466 HG21 VAL 64 HG21 VAL 64 2.946 9.485 -8.629
467 HG22 VAL 64 HG22 VAL 64 3.859 9.677 -7.131
468 HG23 VAL 64 HG23 VAL 64 2.341 10.545 -7.355
469 H ALA 65 HN ALA 65 -0.416 8.425 -5.206
470 HA ALA 65 HA ALA 65 -0.933 5.734 -4.758
471 HB1 ALA 65 HB1 ALA 65 -2.366 6.588 -2.955
472 HB2 ALA 65 HB2 ALA 65 -2.258 8.213 -3.633
473 HB3 ALA 65 HB3 ALA 65 -0.814 7.422 -2.996
474 H GLY 66 HN GLY 66 -2.854 8.384 -6.063
475 HA2 GLY 66 HA2 GLY 66 -5.120 6.675 -6.613
476 HA3 GLY 66 HA1 GLY 66 -4.978 8.387 -7.004
477 H ARG 67 HN ARG 67 -2.527 6.088 -7.890
478 HA ARG 67 HA ARG 67 -3.458 6.029 -10.662
479 HB2 ARG 67 HB2 ARG 67 -1.523 7.489 -10.541
480 HB3 ARG 67 HB1 ARG 67 -0.657 6.328 -9.561
481 HG2 ARG 67 HG2 ARG 67 0.195 6.350 -11.811
482 HG3 ARG 67 HG1 ARG 67 -0.550 4.797 -11.413
483 HD2 ARG 67 HD2 ARG 67 -2.629 5.617 -12.562
484 HD3 ARG 67 HD1 ARG 67 -1.701 7.016 -13.114
485 HE ARG 67 HE ARG 67 -0.458 4.520 -13.789
486 HH11 ARG 67 HH11 ARG 67 -2.873 6.843 -14.921
487 HH12 ARG 67 HH12 ARG 67 -2.922 6.248 -16.504
488 HH21 ARG 67 HH21 ARG 67 -0.457 3.736 -15.872
489 HH22 ARG 67 HH22 ARG 67 -1.436 4.364 -17.113
490 H VAL 68 HN VAL 68 -2.459 4.264 -7.852
491 HA VAL 68 HA VAL 68 -1.582 2.074 -9.454
492 HB VAL 68 HB VAL 68 -1.178 0.797 -7.353
493 HG11 VAL 68 HG11 VAL 68 0.559 2.141 -8.393
494 HG12 VAL 68 HG12 VAL 68 0.710 2.147 -6.640
495 HG13 VAL 68 HG13 VAL 68 0.039 3.551 -7.468
496 HG21 VAL 68 HG21 VAL 68 -1.223 2.001 -5.226
497 HG22 VAL 68 HG22 VAL 68 -2.851 1.809 -5.899
498 HG23 VAL 68 HG23 VAL 68 -2.024 3.366 -6.008
499 H ASP 69 HN ASP 69 -2.398 -0.230 -8.367
500 HA ASP 69 HA ASP 69 -5.312 -0.224 -8.925
501 HB2 ASP 69 HB2 ASP 69 -3.902 -0.583 -11.040
502 HB3 ASP 69 HB1 ASP 69 -3.341 -2.050 -10.271
503 H THR 70 HN THR 70 -2.528 -2.361 -8.470
504 HA THR 70 HA THR 70 -4.042 -3.983 -6.589
505 HB THR 70 HB THR 70 -2.352 -5.687 -7.161
506 HG1 THR 70 HG1 THR 70 -1.088 -4.864 -9.194
507 HG21 THR 70 HG21 THR 70 -3.565 -4.356 -9.580
508 HG22 THR 70 HG22 THR 70 -4.337 -5.590 -8.566
509 HG23 THR 70 HG23 THR 70 -2.935 -6.003 -9.553
510 HA PRO 71 HA PRO 71 -1.299 -2.698 -3.303
511 HB2 PRO 71 HB2 PRO 71 -0.714 -5.556 -2.783
512 HB3 PRO 71 HB1 PRO 71 -1.348 -4.315 -1.693
513 HG2 PRO 71 HG2 PRO 71 -2.960 -6.184 -2.630
514 HG3 PRO 71 HG1 PRO 71 -3.512 -4.499 -2.541
515 HD2 PRO 71 HD2 PRO 71 -2.502 -6.037 -4.901
516 HD3 PRO 71 HD1 PRO 71 -3.915 -4.967 -4.794
517 H ARG 72 HN ARG 72 -0.168 -5.014 -5.658
518 HA ARG 72 HA ARG 72 2.558 -4.878 -4.824
519 HB2 ARG 72 HB2 ARG 72 3.155 -6.159 -6.756
520 HB3 ARG 72 HB1 ARG 72 1.685 -6.833 -6.085
521 HG2 ARG 72 HG2 ARG 72 0.402 -5.715 -7.859
522 HG3 ARG 72 HG1 ARG 72 1.918 -5.098 -8.529
523 HD2 ARG 72 HD2 ARG 72 1.085 -7.980 -8.234
524 HD3 ARG 72 HD1 ARG 72 1.259 -7.075 -9.737
525 HE ARG 72 HE ARG 72 3.707 -6.879 -8.630
526 HH11 ARG 72 HH11 ARG 72 1.629 -9.607 -9.580
527 HH12 ARG 72 HH12 ARG 72 2.882 -10.759 -9.577
528 HH21 ARG 72 HH21 ARG 72 5.464 -8.462 -8.673
529 HH22 ARG 72 HH22 ARG 72 5.144 -10.078 -9.055
530 H GLU 73 HN GLU 73 0.593 -3.025 -7.034
531 HA GLU 73 HA GLU 73 2.739 -1.683 -8.309
532 HB2 GLU 73 HB2 GLU 73 -0.014 -0.554 -7.753
533 HB3 GLU 73 HB1 GLU 73 1.093 -0.038 -9.005
534 HG2 GLU 73 HG2 GLU 73 -0.396 -2.636 -8.859
535 HG3 GLU 73 HG1 GLU 73 -0.695 -1.304 -9.971
536 H LEU 74 HN LEU 74 0.786 -1.090 -5.481
537 HA LEU 74 HA LEU 74 1.825 1.418 -4.654
538 HB2 LEU 74 HB2 LEU 74 -0.265 0.075 -3.803
539 HB3 LEU 74 HB1 LEU 74 0.950 -0.772 -2.845
540 HG LEU 74 HG LEU 74 -0.396 1.024 -1.602
541 HD11 LEU 74 HD11 LEU 74 1.645 0.153 -0.659
542 HD12 LEU 74 HD12 LEU 74 1.478 1.881 -0.342
543 HD13 LEU 74 HD13 LEU 74 2.586 1.312 -1.597
544 HD21 LEU 74 HD21 LEU 74 -0.425 2.699 -3.356
545 HD22 LEU 74 HD22 LEU 74 1.327 2.863 -3.253
546 HD23 LEU 74 HD23 LEU 74 0.318 3.341 -1.891
547 H LEU 75 HN LEU 75 2.568 -1.909 -3.748
548 HA LEU 75 HA LEU 75 4.586 -1.466 -1.931
549 HB2 LEU 75 HB2 LEU 75 3.424 -3.527 -2.148
550 HB3 LEU 75 HB1 LEU 75 3.988 -3.719 -3.795
551 HG LEU 75 HG LEU 75 6.258 -3.810 -2.921
552 HD11 LEU 75 HD11 LEU 75 5.962 -2.814 -0.725
553 HD12 LEU 75 HD12 LEU 75 6.575 -4.456 -0.534
554 HD13 LEU 75 HD13 LEU 75 4.872 -4.114 -0.245
555 HD21 LEU 75 HD21 LEU 75 4.315 -5.923 -2.076
556 HD22 LEU 75 HD22 LEU 75 6.059 -6.182 -2.264
557 HD23 LEU 75 HD23 LEU 75 5.061 -5.704 -3.653
558 H ASP 76 HN ASP 76 4.653 -1.818 -5.438
559 HA ASP 76 HA ASP 76 7.457 -2.028 -5.714
560 HB2 ASP 76 HB2 ASP 76 5.865 -2.721 -7.480
561 HB3 ASP 76 HB1 ASP 76 5.432 -1.027 -7.726
562 H LEU 77 HN LEU 77 5.208 0.684 -5.757
563 HA LEU 77 HA LEU 77 6.986 2.763 -6.328
564 HB2 LEU 77 HB2 LEU 77 4.660 2.757 -4.428
565 HB3 LEU 77 HB1 LEU 77 5.437 4.179 -5.077
566 HG LEU 77 HG LEU 77 3.911 2.146 -6.693
567 HD11 LEU 77 HD11 LEU 77 2.477 3.381 -5.180
568 HD12 LEU 77 HD12 LEU 77 2.217 3.891 -6.849
569 HD13 LEU 77 HD13 LEU 77 3.156 4.905 -5.756
570 HD21 LEU 77 HD21 LEU 77 5.045 4.844 -7.454
571 HD22 LEU 77 HD22 LEU 77 4.072 3.797 -8.488
572 HD23 LEU 77 HD23 LEU 77 5.676 3.281 -7.974
573 H ILE 78 HN ILE 78 6.046 1.253 -3.287
574 HA ILE 78 HA ILE 78 7.600 2.858 -1.578
575 HB ILE 78 HB ILE 78 6.856 -0.048 -1.092
576 HG12 ILE 78 HG12 ILE 78 4.825 1.247 -1.606
577 HG13 ILE 78 HG11 ILE 78 4.884 0.794 0.092
578 HG21 ILE 78 HG21 ILE 78 8.521 0.742 0.465
579 HG22 ILE 78 HG22 ILE 78 6.969 0.640 1.305
580 HG23 ILE 78 HG23 ILE 78 7.586 2.198 0.778
581 HD11 ILE 78 HD11 ILE 78 5.578 3.044 0.683
582 HD12 ILE 78 HD12 ILE 78 4.066 3.070 -0.232
583 HD13 ILE 78 HD13 ILE 78 5.586 3.497 -1.019
584 H ASN 79 HN ASN 79 8.203 -0.398 -2.878
585 HA ASN 79 HA ASN 79 10.751 -0.882 -1.936
586 HB2 ASN 79 HB2 ASN 79 9.534 -1.672 -4.587
587 HB3 ASN 79 HB1 ASN 79 11.109 -2.242 -4.073
588 HD21 ASN 79 HD21 ASN 79 10.273 -2.536 -1.260
589 HD22 ASN 79 HD22 ASN 79 9.287 -3.956 -1.243
590 H GLY 80 HN GLY 80 9.904 0.787 -4.964
591 HA2 GLY 80 HA2 GLY 80 12.549 1.319 -5.794
592 HA3 GLY 80 HA1 GLY 80 11.113 2.183 -6.315
593 H ALA 81 HN ALA 81 10.312 3.270 -3.869
594 HA ALA 81 HA ALA 81 12.087 5.503 -3.727
595 HB1 ALA 81 HB1 ALA 81 9.690 4.865 -2.012
596 HB2 ALA 81 HB2 ALA 81 9.642 5.752 -3.532
597 HB3 ALA 81 HB3 ALA 81 10.492 6.432 -2.140
598 H LEU 82 HN LEU 82 11.494 2.687 -1.715
599 HA LEU 82 HA LEU 82 12.784 3.579 0.583
600 HB2 LEU 82 HB2 LEU 82 11.137 1.798 0.575
601 HB3 LEU 82 HB1 LEU 82 12.165 0.814 -0.435
602 HG LEU 82 HG LEU 82 13.770 0.630 1.306
603 HD11 LEU 82 HD11 LEU 82 13.429 2.731 2.495
604 HD12 LEU 82 HD12 LEU 82 13.196 1.396 3.633
605 HD13 LEU 82 HD13 LEU 82 11.799 2.227 2.940
606 HD21 LEU 82 HD21 LEU 82 10.975 -0.102 2.182
607 HD22 LEU 82 HD22 LEU 82 12.455 -0.787 2.853
608 HD23 LEU 82 HD23 LEU 82 12.048 -1.053 1.160
609 H ALA 83 HN ALA 83 13.978 2.436 -2.431
610 HA ALA 83 HA ALA 83 16.459 1.383 -1.620
611 HB1 ALA 83 HB1 ALA 83 15.555 1.108 -3.895
612 HB2 ALA 83 HB2 ALA 83 17.191 1.767 -3.922
613 HB3 ALA 83 HB3 ALA 83 15.810 2.829 -4.196
614 H GLU 84 HN GLU 84 15.304 4.651 -1.678
615 HA GLU 84 HA GLU 84 17.926 5.842 -1.520
616 HB2 GLU 84 HB2 GLU 84 15.115 6.880 -1.427
617 HB3 GLU 84 HB1 GLU 84 16.527 7.892 -1.219
618 HG2 GLU 84 HG2 GLU 84 15.906 6.262 -3.676
619 HG3 GLU 84 HG1 GLU 84 15.580 7.985 -3.485
620 H ALA 85 HN ALA 85 15.733 4.359 0.587
621 HA ALA 85 HA ALA 85 16.540 6.071 2.842
622 HB1 ALA 85 HB1 ALA 85 14.016 4.465 2.534
623 HB2 ALA 85 HB2 ALA 85 14.172 6.217 2.331
624 HB3 ALA 85 HB3 ALA 85 14.457 5.479 3.911
625 H ALA 86 HN ALA 86 17.134 3.136 1.518
626 HA ALA 86 HA ALA 86 17.494 1.867 4.117
627 HB1 ALA 86 HB1 ALA 86 17.576 0.661 1.340
628 HB2 ALA 86 HB2 ALA 86 16.245 0.518 2.502
629 HB3 ALA 86 HB3 ALA 86 17.799 -0.225 2.846
630 H28A SDO 101 H28A SDO 42 -9.902 12.484 -3.208
631 H28B SDO 101 H28B SDO 42 -11.594 12.521 -2.672
632 H30A SDO 101 H30A SDO 42 -10.822 12.982 0.909
633 H30B SDO 101 H30B SDO 42 -11.001 11.432 0.084
634 H30C SDO 101 H30C SDO 42 -12.113 12.746 -0.266
635 H31A SDO 101 H31A SDO 42 -8.497 13.165 0.115
636 H31B SDO 101 H31B SDO 42 -8.157 13.059 -1.604
637 H31C SDO 101 H31C SDO 42 -8.604 11.579 -0.703
638 H32A SDO 101 H32A SDO 42 -11.191 14.810 -1.756
639 H33A SDO 101 H33A SDO 42 -8.655 15.508 -1.738
640 H36A SDO 101 H36A SDO 42 -11.732 14.899 0.567
641 H37A SDO 101 H37A SDO 42 -9.968 16.284 2.486
642 H37B SDO 101 H37B SDO 42 -11.544 16.899 2.049
643 H38A SDO 101 H38A SDO 42 -10.972 14.337 3.470
644 H38B SDO 101 H38B SDO 42 -12.065 15.661 3.991
645 H41A SDO 101 H41A SDO 42 -12.742 12.931 3.994
646 H42A SDO 101 H42A SDO 42 -15.142 12.833 2.493
647 H42B SDO 101 H42B SDO 42 -13.862 11.996 1.652
648 H43A SDO 101 H43A SDO 42 -14.968 11.268 4.323
649 H43B SDO 101 H43B SDO 42 -13.415 10.762 3.738
650 H1A SDO 101 H1A SDO 42 -14.953 9.027 0.267
651 H1B SDO 101 H1B SDO 42 -16.543 9.589 0.720
652 H2A SDO 101 H2A SDO 42 -14.181 11.354 0.265
653 H2B SDO 101 H2B SDO 42 -15.798 11.878 0.646
654 H4A SDO 101 H4A SDO 42 -15.490 10.099 -3.217
655 H4B SDO 101 H4B SDO 42 -17.101 10.604 -2.783
656 H5A SDO 101 H5A SDO 42 -17.162 8.884 -1.005
657 H5B SDO 101 H5B SDO 42 -15.585 8.315 -1.565
658 H6A SDO 101 H6A SDO 42 -17.966 8.512 -3.385
659 H6B SDO 101 H6B SDO 42 -17.644 7.078 -2.427
660 H8A SDO 101 H8A SDO 42 -14.606 8.601 -4.568
661 H8B SDO 101 H8B SDO 42 -14.247 6.871 -4.524
662 H8C SDO 101 H8C SDO 42 -14.436 7.772 -3.017
Start of MODEL 9
1 H1 MET 1 HT1 MET 1 19.221 -9.760 -1.151
2 H2 MET 1 HT2 MET 1 18.982 -10.029 0.485
3 H3 MET 1 HT3 MET 1 20.143 -10.903 -0.318
4 HA MET 1 HA MET 1 21.159 -9.099 0.982
5 HB2 MET 1 HB2 MET 1 21.172 -8.407 -1.972
6 HB3 MET 1 HB1 MET 1 22.420 -8.025 -0.798
7 HG2 MET 1 HG2 MET 1 21.676 -10.763 -1.785
8 HG3 MET 1 HG1 MET 1 23.097 -9.837 -2.254
9 HE1 MET 1 HE1 MET 1 24.575 -12.776 -0.170
10 HE2 MET 1 HE2 MET 1 24.601 -11.921 -1.707
11 HE3 MET 1 HE3 MET 1 23.176 -12.849 -1.243
12 H ALA 2 HN ALA 2 18.165 -8.509 0.731
13 HA ALA 2 HA ALA 2 18.412 -5.659 0.227
14 HB1 ALA 2 HB1 ALA 2 16.225 -5.681 -0.815
15 HB2 ALA 2 HB2 ALA 2 16.134 -7.431 -0.620
16 HB3 ALA 2 HB3 ALA 2 17.344 -6.727 -1.688
17 H THR 3 HN THR 3 18.037 -4.629 2.003
18 HA THR 3 HA THR 3 16.126 -5.606 3.959
19 HB THR 3 HB THR 3 17.740 -3.017 3.937
20 HG1 THR 3 HG1 THR 3 18.555 -5.556 4.146
21 HG21 THR 3 HG21 THR 3 17.432 -3.114 6.386
22 HG22 THR 3 HG22 THR 3 16.501 -4.604 6.216
23 HG23 THR 3 HG23 THR 3 15.866 -3.092 5.573
24 H LEU 4 HN LEU 4 14.696 -5.505 2.058
25 HA LEU 4 HA LEU 4 13.541 -2.865 1.390
26 HB2 LEU 4 HB2 LEU 4 15.002 -4.262 -0.283
27 HB3 LEU 4 HB1 LEU 4 13.615 -5.323 -0.324
28 HG LEU 4 HG LEU 4 12.269 -3.397 -1.120
29 HD11 LEU 4 HD11 LEU 4 13.645 -1.578 -0.269
30 HD12 LEU 4 HD12 LEU 4 13.490 -1.452 -2.023
31 HD13 LEU 4 HD13 LEU 4 14.979 -2.071 -1.313
32 HD21 LEU 4 HD21 LEU 4 13.162 -3.466 -3.397
33 HD22 LEU 4 HD22 LEU 4 13.157 -5.068 -2.653
34 HD23 LEU 4 HD23 LEU 4 14.663 -4.163 -2.782
35 H LEU 5 HN LEU 5 11.208 -3.358 0.585
36 HA LEU 5 HA LEU 5 10.068 -5.158 2.555
37 HB2 LEU 5 HB2 LEU 5 8.773 -3.126 0.764
38 HB3 LEU 5 HB1 LEU 5 7.914 -4.092 1.934
39 HG LEU 5 HG LEU 5 9.931 -1.918 2.458
40 HD11 LEU 5 HD11 LEU 5 7.032 -2.220 3.163
41 HD12 LEU 5 HD12 LEU 5 7.700 -1.183 1.896
42 HD13 LEU 5 HD13 LEU 5 8.070 -0.860 3.593
43 HD21 LEU 5 HD21 LEU 5 8.578 -3.738 4.433
44 HD22 LEU 5 HD22 LEU 5 9.587 -2.345 4.844
45 HD23 LEU 5 HD23 LEU 5 10.295 -3.751 4.037
46 H THR 6 HN THR 6 9.288 -7.035 2.046
47 HA THR 6 HA THR 6 8.940 -7.612 -0.771
48 HB THR 6 HB THR 6 9.056 -10.010 -0.149
49 HG1 THR 6 HG1 THR 6 9.384 -8.939 2.491
50 HG21 THR 6 HG21 THR 6 11.442 -10.073 0.481
51 HG22 THR 6 HG22 THR 6 11.364 -8.349 0.864
52 HG23 THR 6 HG23 THR 6 11.110 -8.898 -0.794
53 H THR 7 HN THR 7 7.164 -9.771 -0.656
54 HA THR 7 HA THR 7 4.742 -8.444 -0.666
55 HB THR 7 HB THR 7 5.181 -11.420 -0.384
56 HG1 THR 7 HG1 THR 7 4.922 -10.250 -2.903
57 HG21 THR 7 HG21 THR 7 3.120 -11.540 -1.727
58 HG22 THR 7 HG22 THR 7 3.055 -9.782 -1.775
59 HG23 THR 7 HG23 THR 7 2.836 -10.625 -0.244
60 H ASP 8 HN ASP 8 6.058 -10.707 1.822
61 HA ASP 8 HA ASP 8 3.707 -10.544 3.415
62 HB2 ASP 8 HB2 ASP 8 4.764 -11.894 5.037
63 HB3 ASP 8 HB1 ASP 8 5.493 -12.404 3.523
64 H ASP 9 HN ASP 9 6.626 -8.643 3.301
65 HA ASP 9 HA ASP 9 6.399 -7.263 5.762
66 HB2 ASP 9 HB2 ASP 9 7.486 -6.261 3.113
67 HB3 ASP 9 HB1 ASP 9 7.568 -5.356 4.610
68 H LEU 10 HN LEU 10 5.198 -6.571 2.572
69 HA LEU 10 HA LEU 10 3.899 -4.141 3.115
70 HB2 LEU 10 HB2 LEU 10 4.510 -4.885 0.887
71 HB3 LEU 10 HB1 LEU 10 3.372 -6.210 1.004
72 HG LEU 10 HG LEU 10 1.570 -4.449 1.248
73 HD11 LEU 10 HD11 LEU 10 2.070 -2.224 0.347
74 HD12 LEU 10 HD12 LEU 10 3.783 -2.654 0.288
75 HD13 LEU 10 HD13 LEU 10 2.956 -2.560 1.837
76 HD21 LEU 10 HD21 LEU 10 1.463 -4.080 -1.164
77 HD22 LEU 10 HD22 LEU 10 1.909 -5.738 -0.769
78 HD23 LEU 10 HD23 LEU 10 3.141 -4.598 -1.313
79 H ARG 11 HN ARG 11 2.792 -7.492 3.091
80 HA ARG 11 HA ARG 11 0.044 -7.127 3.213
81 HB2 ARG 11 HB2 ARG 11 1.364 -9.329 2.999
82 HB3 ARG 11 HB1 ARG 11 1.419 -9.319 4.756
83 HG2 ARG 11 HG2 ARG 11 -1.112 -9.086 4.678
84 HG3 ARG 11 HG1 ARG 11 -0.977 -9.519 2.971
85 HD2 ARG 11 HD2 ARG 11 -0.276 -11.190 5.380
86 HD3 ARG 11 HD1 ARG 11 -1.468 -11.478 4.101
87 HE ARG 11 HE ARG 11 0.546 -11.687 2.607
88 HH11 ARG 11 HH11 ARG 11 0.569 -12.611 6.036
89 HH12 ARG 11 HH12 ARG 11 1.733 -13.835 5.846
90 HH21 ARG 11 HH21 ARG 11 2.097 -13.414 2.349
91 HH22 ARG 11 HH22 ARG 11 2.679 -14.281 3.706
92 H ARG 12 HN ARG 12 2.425 -7.099 5.770
93 HA ARG 12 HA ARG 12 0.838 -7.211 8.059
94 HB2 ARG 12 HB2 ARG 12 3.336 -5.549 7.726
95 HB3 ARG 12 HB1 ARG 12 2.691 -6.198 9.227
96 HG2 ARG 12 HG2 ARG 12 3.198 -8.448 8.495
97 HG3 ARG 12 HG1 ARG 12 3.729 -7.839 6.930
98 HD2 ARG 12 HD2 ARG 12 5.397 -6.429 8.258
99 HD3 ARG 12 HD1 ARG 12 5.006 -7.492 9.613
100 HE ARG 12 HE ARG 12 5.603 -9.156 7.529
101 HH11 ARG 12 HH11 ARG 12 7.312 -6.755 9.467
102 HH12 ARG 12 HH12 ARG 12 8.868 -7.174 8.950
103 HH21 ARG 12 HH21 ARG 12 7.712 -9.857 6.851
104 HH22 ARG 12 HH22 ARG 12 9.119 -9.048 7.394
105 H ALA 13 HN ALA 13 1.883 -4.420 6.150
106 HA ALA 13 HA ALA 13 0.688 -2.478 7.847
107 HB1 ALA 13 HB1 ALA 13 1.571 -2.204 4.982
108 HB2 ALA 13 HB2 ALA 13 2.584 -1.957 6.401
109 HB3 ALA 13 HB3 ALA 13 1.218 -0.886 6.092
110 H LEU 14 HN LEU 14 -0.396 -4.198 4.947
111 HA LEU 14 HA LEU 14 -2.705 -2.688 4.591
112 HB2 LEU 14 HB2 LEU 14 -1.681 -5.310 3.670
113 HB3 LEU 14 HB1 LEU 14 -3.384 -5.008 3.513
114 HG LEU 14 HG LEU 14 -2.234 -4.559 1.431
115 HD11 LEU 14 HD11 LEU 14 -4.183 -3.222 1.911
116 HD12 LEU 14 HD12 LEU 14 -3.001 -2.280 0.999
117 HD13 LEU 14 HD13 LEU 14 -3.185 -2.020 2.733
118 HD21 LEU 14 HD21 LEU 14 -0.014 -3.983 2.277
119 HD22 LEU 14 HD22 LEU 14 -0.655 -2.481 2.949
120 HD23 LEU 14 HD23 LEU 14 -0.625 -2.722 1.204
121 H VAL 15 HN VAL 15 -1.945 -5.529 6.518
122 HA VAL 15 HA VAL 15 -4.576 -6.060 7.388
123 HB VAL 15 HB VAL 15 -1.930 -6.647 8.783
124 HG11 VAL 15 HG11 VAL 15 -4.690 -7.753 9.350
125 HG12 VAL 15 HG12 VAL 15 -3.752 -6.703 10.417
126 HG13 VAL 15 HG13 VAL 15 -3.191 -8.337 10.072
127 HG21 VAL 15 HG21 VAL 15 -3.717 -8.400 7.096
128 HG22 VAL 15 HG22 VAL 15 -2.236 -8.922 7.900
129 HG23 VAL 15 HG23 VAL 15 -2.167 -7.722 6.605
130 H GLU 16 HN GLU 16 -1.982 -4.015 8.782
131 HA GLU 16 HA GLU 16 -3.326 -3.001 10.989
132 HB2 GLU 16 HB2 GLU 16 -1.468 -1.530 9.127
133 HB3 GLU 16 HB1 GLU 16 -1.904 -1.012 10.746
134 HG2 GLU 16 HG2 GLU 16 -0.900 -3.101 11.614
135 HG3 GLU 16 HG1 GLU 16 -0.387 -3.465 9.984
136 H SER 17 HN SER 17 -3.495 -2.070 7.632
137 HA SER 17 HA SER 17 -5.064 0.250 7.997
138 HB2 SER 17 HB2 SER 17 -3.600 -0.002 6.062
139 HB3 SER 17 HB1 SER 17 -4.496 -1.423 5.532
140 HG SER 17 HG SER 17 -4.899 0.872 4.663
141 H ALA 18 HN ALA 18 -5.827 -3.141 7.263
142 HA ALA 18 HA ALA 18 -8.597 -2.507 6.888
143 HB1 ALA 18 HB1 ALA 18 -8.953 -4.814 6.479
144 HB2 ALA 18 HB2 ALA 18 -7.330 -5.217 7.053
145 HB3 ALA 18 HB3 ALA 18 -7.542 -4.278 5.555
146 H GLY 19 HN GLY 19 -9.067 -1.618 8.779
147 HA2 GLY 19 HA2 GLY 19 -9.151 -3.356 11.157
148 HA3 GLY 19 HA1 GLY 19 -9.429 -1.613 11.162
149 H GLU 20 HN GLU 20 -11.373 -0.814 10.188
150 HA GLU 20 HA GLU 20 -13.470 -2.795 10.136
151 HB2 GLU 20 HB2 GLU 20 -15.018 -1.060 11.185
152 HB3 GLU 20 HB1 GLU 20 -13.861 -1.845 12.242
153 HG2 GLU 20 HG2 GLU 20 -12.440 0.128 12.192
154 HG3 GLU 20 HG1 GLU 20 -13.551 0.901 11.056
155 H THR 21 HN THR 21 -12.945 -2.759 8.063
156 HA THR 21 HA THR 21 -14.581 -1.022 6.462
157 HB THR 21 HB THR 21 -12.370 0.022 6.270
158 HG1 THR 21 HG1 THR 21 -12.994 0.164 4.288
159 HG21 THR 21 HG21 THR 21 -11.263 -2.705 5.572
160 HG22 THR 21 HG22 THR 21 -10.972 -1.819 7.066
161 HG23 THR 21 HG23 THR 21 -10.343 -1.197 5.540
162 H ASP 22 HN ASP 22 -13.032 -2.753 4.201
163 HA ASP 22 HA ASP 22 -14.589 -5.135 4.846
164 HB2 ASP 22 HB2 ASP 22 -14.603 -4.227 2.474
165 HB3 ASP 22 HB1 ASP 22 -12.939 -4.795 2.333
166 H GLY 23 HN GLY 23 -13.572 -6.145 6.398
167 HA2 GLY 23 HA2 GLY 23 -10.725 -6.456 6.226
168 HA3 GLY 23 HA1 GLY 23 -11.745 -6.939 7.590
169 H THR 24 HN THR 24 -11.022 -7.699 4.260
170 HA THR 24 HA THR 24 -11.994 -10.376 4.576
171 HB THR 24 HB THR 24 -12.277 -9.216 2.406
172 HG1 THR 24 HG1 THR 24 -11.608 -10.917 1.080
173 HG21 THR 24 HG21 THR 24 -10.220 -7.898 2.354
174 HG22 THR 24 HG22 THR 24 -10.350 -8.879 0.894
175 HG23 THR 24 HG23 THR 24 -9.262 -9.369 2.193
176 H ASP 25 HN ASP 25 -10.089 -11.868 3.203
177 HA ASP 25 HA ASP 25 -7.963 -11.927 5.252
178 HB2 ASP 25 HB2 ASP 25 -9.566 -13.868 5.207
179 HB3 ASP 25 HB1 ASP 25 -8.979 -14.241 3.598
180 H LEU 26 HN LEU 26 -6.217 -11.061 4.458
181 HA LEU 26 HA LEU 26 -5.669 -11.031 1.614
182 HB2 LEU 26 HB2 LEU 26 -4.439 -9.645 3.981
183 HB3 LEU 26 HB1 LEU 26 -3.646 -9.651 2.423
184 HG LEU 26 HG LEU 26 -5.613 -8.487 1.462
185 HD11 LEU 26 HD11 LEU 26 -7.325 -9.201 3.006
186 HD12 LEU 26 HD12 LEU 26 -7.235 -7.443 2.897
187 HD13 LEU 26 HD13 LEU 26 -6.553 -8.278 4.303
188 HD21 LEU 26 HD21 LEU 26 -4.321 -7.128 3.809
189 HD22 LEU 26 HD22 LEU 26 -5.137 -6.331 2.457
190 HD23 LEU 26 HD23 LEU 26 -3.668 -7.266 2.176
191 H SER 27 HN SER 27 -5.378 -13.642 2.612
192 HA SER 27 HA SER 27 -2.526 -13.978 2.962
193 HB2 SER 27 HB2 SER 27 -4.125 -15.409 4.242
194 HB3 SER 27 HB1 SER 27 -4.630 -16.139 2.719
195 HG SER 27 HG SER 27 -3.026 -17.473 3.042
196 H GLY 28 HN GLY 28 -1.489 -13.485 1.131
197 HA2 GLY 28 HA2 GLY 28 -0.384 -14.155 -0.795
198 HA3 GLY 28 HA1 GLY 28 -1.472 -15.518 -0.894
199 H ASP 29 HN ASP 29 -3.656 -14.815 -1.426
200 HA ASP 29 HA ASP 29 -3.767 -14.175 -4.154
201 HB2 ASP 29 HB2 ASP 29 -5.464 -15.474 -2.843
202 HB3 ASP 29 HB1 ASP 29 -6.091 -13.944 -2.239
203 H PHE 30 HN PHE 30 -3.813 -12.096 -1.529
204 HA PHE 30 HA PHE 30 -5.317 -9.890 -2.511
205 HB2 PHE 30 HB2 PHE 30 -4.611 -8.679 -0.622
206 HB3 PHE 30 HB1 PHE 30 -4.572 -10.348 -0.076
207 HD1 PHE 30 HD2 PHE 30 -2.254 -11.546 -0.073
208 HD2 PHE 30 HD1 PHE 30 -2.749 -7.331 -0.424
209 HE1 PHE 30 HE2 PHE 30 0.089 -11.225 0.532
210 HE2 PHE 30 HE1 PHE 30 -0.384 -7.007 0.191
211 HZ PHE 30 HZ PHE 30 1.032 -8.957 0.671
212 H LEU 31 HN LEU 31 -2.118 -10.973 -3.184
213 HA LEU 31 HA LEU 31 -0.771 -8.554 -3.619
214 HB2 LEU 31 HB2 LEU 31 0.287 -10.758 -3.333
215 HB3 LEU 31 HB1 LEU 31 -0.266 -11.211 -4.931
216 HG LEU 31 HG LEU 31 1.142 -9.393 -5.887
217 HD11 LEU 31 HD11 LEU 31 2.817 -8.336 -4.457
218 HD12 LEU 31 HD12 LEU 31 2.094 -9.106 -3.042
219 HD13 LEU 31 HD13 LEU 31 1.182 -7.909 -3.955
220 HD21 LEU 31 HD21 LEU 31 2.585 -11.377 -4.131
221 HD22 LEU 31 HD22 LEU 31 3.278 -10.526 -5.511
222 HD23 LEU 31 HD23 LEU 31 1.966 -11.683 -5.753
223 H ASP 32 HN ASP 32 -2.761 -10.477 -5.775
224 HA ASP 32 HA ASP 32 -2.407 -8.424 -7.840
225 HB2 ASP 32 HB2 ASP 32 -3.121 -10.125 -9.505
226 HB3 ASP 32 HB1 ASP 32 -1.631 -10.557 -8.679
227 H LEU 33 HN LEU 33 -4.213 -8.701 -5.494
228 HA LEU 33 HA LEU 33 -6.818 -8.614 -6.789
229 HB2 LEU 33 HB2 LEU 33 -6.449 -9.991 -4.740
230 HB3 LEU 33 HB1 LEU 33 -6.033 -8.538 -3.864
231 HG LEU 33 HG LEU 33 -8.332 -7.726 -4.116
232 HD11 LEU 33 HD11 LEU 33 -8.809 -10.378 -5.483
233 HD12 LEU 33 HD12 LEU 33 -8.831 -8.805 -6.269
234 HD13 LEU 33 HD13 LEU 33 -10.047 -9.198 -5.053
235 HD21 LEU 33 HD21 LEU 33 -9.386 -9.387 -2.649
236 HD22 LEU 33 HD22 LEU 33 -7.717 -9.085 -2.180
237 HD23 LEU 33 HD23 LEU 33 -8.127 -10.551 -3.059
238 H ARG 34 HN ARG 34 -8.153 -6.672 -6.325
239 HA ARG 34 HA ARG 34 -6.400 -4.323 -6.488
240 HB2 ARG 34 HB2 ARG 34 -9.262 -4.695 -7.390
241 HB3 ARG 34 HB1 ARG 34 -8.446 -3.151 -7.387
242 HG2 ARG 34 HG2 ARG 34 -8.510 -4.069 -9.610
243 HG3 ARG 34 HG1 ARG 34 -6.848 -4.006 -9.039
244 HD2 ARG 34 HD2 ARG 34 -7.369 -6.068 -10.256
245 HD3 ARG 34 HD1 ARG 34 -6.891 -6.349 -8.577
246 HE ARG 34 HE ARG 34 -9.593 -6.265 -8.426
247 HH11 ARG 34 HH11 ARG 34 -7.414 -8.104 -10.519
248 HH12 ARG 34 HH12 ARG 34 -8.379 -9.505 -10.521
249 HH21 ARG 34 HH21 ARG 34 -10.920 -8.164 -8.435
250 HH22 ARG 34 HH22 ARG 34 -10.455 -9.509 -9.380
251 H PHE 35 HN PHE 35 -7.070 -2.358 -5.504
252 HA PHE 35 HA PHE 35 -7.964 -2.674 -2.835
253 HB2 PHE 35 HB2 PHE 35 -7.592 -0.159 -4.469
254 HB3 PHE 35 HB1 PHE 35 -7.927 -0.173 -2.744
255 HD1 PHE 35 HD2 PHE 35 -6.270 -1.272 -1.208
256 HD2 PHE 35 HD1 PHE 35 -5.397 -0.431 -5.282
257 HE1 PHE 35 HE2 PHE 35 -3.865 -1.499 -0.736
258 HE2 PHE 35 HE1 PHE 35 -2.995 -0.653 -4.817
259 HZ PHE 35 HZ PHE 35 -2.230 -1.191 -2.546
260 H GLU 36 HN GLU 36 -9.541 -1.956 -5.781
261 HA GLU 36 HA GLU 36 -12.015 -0.883 -4.986
262 HB2 GLU 36 HB2 GLU 36 -11.546 -2.922 -7.154
263 HB3 GLU 36 HB1 GLU 36 -12.840 -1.742 -7.069
264 HG2 GLU 36 HG2 GLU 36 -11.290 0.042 -7.461
265 HG3 GLU 36 HG1 GLU 36 -9.926 -1.073 -7.393
266 H ASP 37 HN ASP 37 -10.965 -4.185 -5.559
267 HA ASP 37 HA ASP 37 -13.286 -5.587 -4.909
268 HB2 ASP 37 HB2 ASP 37 -10.391 -6.443 -4.846
269 HB3 ASP 37 HB1 ASP 37 -11.757 -7.543 -4.713
270 H ILE 38 HN ILE 38 -10.584 -4.502 -2.942
271 HA ILE 38 HA ILE 38 -11.674 -5.942 -0.668
272 HB ILE 38 HB ILE 38 -9.606 -5.274 0.574
273 HG12 ILE 38 HG12 ILE 38 -8.761 -4.150 -2.115
274 HG13 ILE 38 HG11 ILE 38 -9.094 -3.201 -0.672
275 HG21 ILE 38 HG21 ILE 38 -9.128 -6.655 -2.065
276 HG22 ILE 38 HG22 ILE 38 -9.750 -7.409 -0.595
277 HG23 ILE 38 HG23 ILE 38 -8.109 -6.759 -0.630
278 HD11 ILE 38 HD11 ILE 38 -6.857 -5.192 -1.017
279 HD12 ILE 38 HD12 ILE 38 -7.185 -4.258 0.448
280 HD13 ILE 38 HD13 ILE 38 -6.713 -3.432 -1.040
281 H GLY 39 HN GLY 39 -12.784 -3.410 -1.891
282 HA2 GLY 39 HA2 GLY 39 -14.142 -1.751 -1.102
283 HA3 GLY 39 HA1 GLY 39 -14.008 -2.507 0.471
284 H TYR 40 HN TYR 40 -11.149 -1.347 -1.121
285 HA TYR 40 HA TYR 40 -10.698 0.448 1.074
286 HB2 TYR 40 HB2 TYR 40 -9.015 -0.617 -1.114
287 HB3 TYR 40 HB1 TYR 40 -8.568 0.937 -0.442
288 HD1 TYR 40 HD2 TYR 40 -9.865 -2.210 1.136
289 HD2 TYR 40 HD1 TYR 40 -6.779 0.699 0.936
290 HE1 TYR 40 HE2 TYR 40 -8.725 -3.299 3.014
291 HE2 TYR 40 HE1 TYR 40 -5.637 -0.377 2.823
292 HH TYR 40 HH TYR 40 -6.219 -1.804 4.692
293 H ASP 41 HN ASP 41 -11.329 2.360 1.157
294 HA ASP 41 HA ASP 41 -12.224 3.919 -1.039
295 HB2 ASP 41 HB2 ASP 41 -11.559 4.703 1.815
296 HB3 ASP 41 HB1 ASP 41 -12.234 5.805 0.628
297 H SER 42 HN SER 42 -11.350 5.988 -1.596
298 HA SER 42 HA SER 42 -8.703 5.994 -2.477
299 HB2 SER 42 HB2 SER 42 -10.629 7.256 -3.424
300 HB3 SER 42 HB1 SER 42 -10.634 8.276 -1.989
301 H LEU 43 HN LEU 43 -10.317 7.581 0.226
302 HA LEU 43 HA LEU 43 -8.106 8.940 1.295
303 HB2 LEU 43 HB2 LEU 43 -10.619 7.983 2.663
304 HB3 LEU 43 HB1 LEU 43 -9.479 9.127 3.336
305 HG LEU 43 HG LEU 43 -11.055 9.599 0.809
306 HD11 LEU 43 HD11 LEU 43 -12.506 9.545 2.751
307 HD12 LEU 43 HD12 LEU 43 -12.322 11.194 2.143
308 HD13 LEU 43 HD13 LEU 43 -11.456 10.691 3.587
309 HD21 LEU 43 HD21 LEU 43 -10.249 11.903 1.058
310 HD22 LEU 43 HD22 LEU 43 -8.920 10.753 0.846
311 HD23 LEU 43 HD23 LEU 43 -9.278 11.399 2.444
312 H ALA 44 HN ALA 44 -9.348 5.708 1.869
313 HA ALA 44 HA ALA 44 -7.764 5.100 4.110
314 HB1 ALA 44 HB1 ALA 44 -8.380 2.779 3.696
315 HB2 ALA 44 HB2 ALA 44 -8.982 3.209 2.095
316 HB3 ALA 44 HB3 ALA 44 -9.788 3.826 3.537
317 H LEU 45 HN LEU 45 -7.176 4.924 0.649
318 HA LEU 45 HA LEU 45 -4.783 3.405 0.920
319 HB2 LEU 45 HB2 LEU 45 -6.104 3.451 -1.118
320 HB3 LEU 45 HB1 LEU 45 -5.707 5.139 -1.349
321 HG LEU 45 HG LEU 45 -3.621 4.644 -2.260
322 HD11 LEU 45 HD11 LEU 45 -2.782 3.518 -0.150
323 HD12 LEU 45 HD12 LEU 45 -2.236 2.771 -1.641
324 HD13 LEU 45 HD13 LEU 45 -3.550 2.026 -0.712
325 HD21 LEU 45 HD21 LEU 45 -3.758 2.633 -3.525
326 HD22 LEU 45 HD22 LEU 45 -5.386 3.395 -3.420
327 HD23 LEU 45 HD23 LEU 45 -4.916 2.059 -2.320
328 H MET 46 HN MET 46 -5.565 6.818 1.004
329 HA MET 46 HA MET 46 -2.906 7.863 0.797
330 HB2 MET 46 HB2 MET 46 -4.996 9.030 2.607
331 HB3 MET 46 HB1 MET 46 -3.734 9.875 1.725
332 HG2 MET 46 HG2 MET 46 -4.951 9.192 -0.351
333 HG3 MET 46 HG1 MET 46 -6.205 8.630 0.762
334 HE1 MET 46 HE1 MET 46 -4.157 11.745 -0.440
335 HE2 MET 46 HE2 MET 46 -3.863 11.714 1.296
336 HE3 MET 46 HE3 MET 46 -4.817 13.018 0.583
337 H GLU 47 HN GLU 47 -5.030 7.138 3.423
338 HA GLU 47 HA GLU 47 -3.506 7.438 5.649
339 HB2 GLU 47 HB2 GLU 47 -5.728 5.893 4.671
340 HB3 GLU 47 HB1 GLU 47 -5.226 5.403 6.311
341 HG2 GLU 47 HG2 GLU 47 -5.560 7.946 6.783
342 HG3 GLU 47 HG1 GLU 47 -6.322 7.981 5.204
343 H THR 48 HN THR 48 -3.861 4.558 3.640
344 HA THR 48 HA THR 48 -2.096 2.812 4.923
345 HB THR 48 HB THR 48 -2.959 3.051 2.036
346 HG1 THR 48 HG1 THR 48 -4.672 2.650 3.400
347 HG21 THR 48 HG21 THR 48 -2.316 0.750 1.701
348 HG22 THR 48 HG22 THR 48 -1.731 0.615 3.370
349 HG23 THR 48 HG23 THR 48 -0.895 1.658 2.220
350 H ALA 49 HN ALA 49 -1.499 4.965 2.098
351 HA ALA 49 HA ALA 49 1.196 4.326 1.735
352 HB1 ALA 49 HB1 ALA 49 -0.191 5.447 0.042
353 HB2 ALA 49 HB2 ALA 49 1.326 6.297 0.336
354 HB3 ALA 49 HB3 ALA 49 -0.179 6.914 1.023
355 H ALA 50 HN ALA 50 -0.297 6.980 3.573
356 HA ALA 50 HA ALA 50 2.034 8.352 4.278
357 HB1 ALA 50 HB1 ALA 50 0.713 9.376 6.050
358 HB2 ALA 50 HB2 ALA 50 -0.509 8.123 5.882
359 HB3 ALA 50 HB3 ALA 50 -0.233 9.261 4.562
360 H ARG 51 HN ARG 51 0.369 5.706 5.870
361 HA ARG 51 HA ARG 51 1.797 5.476 8.188
362 HB2 ARG 51 HB2 ARG 51 -0.191 4.184 7.836
363 HB3 ARG 51 HB1 ARG 51 0.474 3.417 6.414
364 HG2 ARG 51 HG2 ARG 51 0.404 1.764 8.053
365 HG3 ARG 51 HG1 ARG 51 2.094 2.245 7.959
366 HD2 ARG 51 HD2 ARG 51 1.106 1.827 10.179
367 HD3 ARG 51 HD1 ARG 51 1.958 3.345 10.115
368 HE ARG 51 HE ARG 51 -0.338 4.341 9.795
369 HH11 ARG 51 HH11 ARG 51 -0.043 1.096 11.267
370 HH12 ARG 51 HH12 ARG 51 -1.388 1.299 12.258
371 HH21 ARG 51 HH21 ARG 51 -2.279 4.544 11.196
372 HH22 ARG 51 HH22 ARG 51 -2.663 3.246 12.231
373 H LEU 52 HN LEU 52 2.318 3.970 5.058
374 HA LEU 52 HA LEU 52 4.651 2.516 5.662
375 HB2 LEU 52 HB2 LEU 52 3.501 3.468 3.049
376 HB3 LEU 52 HB1 LEU 52 4.879 2.391 3.154
377 HG LEU 52 HG LEU 52 2.129 1.744 4.242
378 HD11 LEU 52 HD11 LEU 52 1.905 0.257 2.355
379 HD12 LEU 52 HD12 LEU 52 3.470 0.770 1.733
380 HD13 LEU 52 HD13 LEU 52 2.128 1.913 1.795
381 HD21 LEU 52 HD21 LEU 52 4.589 0.061 3.849
382 HD22 LEU 52 HD22 LEU 52 3.025 -0.513 4.419
383 HD23 LEU 52 HD23 LEU 52 3.959 0.626 5.393
384 H GLU 53 HN GLU 53 4.135 5.710 4.270
385 HA GLU 53 HA GLU 53 6.768 6.312 3.564
386 HB2 GLU 53 HB2 GLU 53 4.639 8.197 4.520
387 HB3 GLU 53 HB1 GLU 53 6.144 8.672 3.765
388 HG2 GLU 53 HG2 GLU 53 5.445 7.469 1.738
389 HG3 GLU 53 HG1 GLU 53 3.884 7.155 2.510
390 H SER 54 HN SER 54 5.033 7.037 6.556
391 HA SER 54 HA SER 54 7.199 8.444 7.699
392 HB2 SER 54 HB2 SER 54 4.841 8.784 8.377
393 HB3 SER 54 HB1 SER 54 4.834 7.175 9.101
394 HG SER 54 HG SER 54 6.622 9.250 9.826
395 H ARG 55 HN ARG 55 6.094 5.101 7.958
396 HA ARG 55 HA ARG 55 7.874 4.409 10.033
397 HB2 ARG 55 HB2 ARG 55 5.842 3.139 9.610
398 HB3 ARG 55 HB1 ARG 55 6.460 2.621 8.043
399 HG2 ARG 55 HG2 ARG 55 8.241 1.376 9.136
400 HG3 ARG 55 HG1 ARG 55 7.690 1.936 10.711
401 HD2 ARG 55 HD2 ARG 55 6.106 0.232 8.782
402 HD3 ARG 55 HD1 ARG 55 6.940 -0.340 10.223
403 HE ARG 55 HE ARG 55 5.304 1.601 11.146
404 HH11 ARG 55 HH11 ARG 55 4.757 -1.379 9.256
405 HH12 ARG 55 HH12 ARG 55 3.174 -1.627 9.898
406 HH21 ARG 55 HH21 ARG 55 3.122 1.164 12.013
407 HH22 ARG 55 HH22 ARG 55 2.231 -0.179 11.427
408 H TYR 56 HN TYR 56 8.088 3.850 6.496
409 HA TYR 56 HA TYR 56 10.726 2.710 6.990
410 HB2 TYR 56 HB2 TYR 56 9.093 2.704 4.449
411 HB3 TYR 56 HB1 TYR 56 10.630 1.873 4.686
412 HD1 TYR 56 HD1 TYR 56 10.755 0.167 6.614
413 HD2 TYR 56 HD2 TYR 56 7.099 1.606 4.997
414 HE1 TYR 56 HE1 TYR 56 9.589 -1.757 7.582
415 HE2 TYR 56 HE2 TYR 56 5.904 -0.311 5.955
416 HH TYR 56 HH TYR 56 6.533 -2.711 6.695
417 H GLY 57 HN GLY 57 9.583 5.693 6.344
418 HA2 GLY 57 HA2 GLY 57 10.786 7.623 5.953
419 HA3 GLY 57 HA1 GLY 57 12.220 6.638 5.737
420 H VAL 58 HN VAL 58 9.199 6.412 3.956
421 HA VAL 58 HA VAL 58 10.739 7.012 1.548
422 HB VAL 58 HB VAL 58 9.113 5.670 0.240
423 HG11 VAL 58 HG11 VAL 58 10.240 4.210 2.607
424 HG12 VAL 58 HG12 VAL 58 11.114 4.584 1.117
425 HG13 VAL 58 HG13 VAL 58 9.739 3.470 1.090
426 HG21 VAL 58 HG21 VAL 58 7.143 5.962 1.649
427 HG22 VAL 58 HG22 VAL 58 7.894 4.999 2.921
428 HG23 VAL 58 HG23 VAL 58 7.480 4.255 1.382
429 H SER 59 HN SER 59 9.047 7.755 -0.337
430 HA SER 59 HA SER 59 7.100 9.618 0.759
431 HB2 SER 59 HB2 SER 59 9.381 10.498 -1.042
432 HB3 SER 59 HB1 SER 59 8.042 11.517 -0.514
433 HG SER 59 HG SER 59 10.138 10.392 1.025
434 H ILE 60 HN ILE 60 5.297 9.169 -0.315
435 HA ILE 60 HA ILE 60 5.431 8.635 -3.195
436 HB ILE 60 HB ILE 60 3.601 7.295 -1.154
437 HG12 ILE 60 HG12 ILE 60 4.406 5.168 -2.256
438 HG13 ILE 60 HG11 ILE 60 5.579 6.125 -3.134
439 HG21 ILE 60 HG21 ILE 60 2.433 6.177 -3.003
440 HG22 ILE 60 HG22 ILE 60 3.350 7.155 -4.151
441 HG23 ILE 60 HG23 ILE 60 2.223 7.930 -3.037
442 HD11 ILE 60 HD11 ILE 60 6.565 5.008 -1.230
443 HD12 ILE 60 HD12 ILE 60 5.410 5.796 -0.155
444 HD13 ILE 60 HD13 ILE 60 6.614 6.758 -1.007
445 HA PRO 61 HA PRO 61 2.877 12.316 -3.267
446 HB2 PRO 61 HB2 PRO 61 2.417 11.480 -6.072
447 HB3 PRO 61 HB1 PRO 61 3.083 12.992 -5.449
448 HG2 PRO 61 HG2 PRO 61 4.645 11.199 -6.647
449 HG3 PRO 61 HG1 PRO 61 5.227 12.121 -5.246
450 HD2 PRO 61 HD2 PRO 61 4.197 9.307 -5.388
451 HD3 PRO 61 HD1 PRO 61 5.603 9.948 -4.507
452 H ASP 62 HN ASP 62 0.703 12.705 -3.122
453 HA ASP 62 HA ASP 62 -1.039 10.599 -2.591
454 HB2 ASP 62 HB2 ASP 62 -2.879 12.248 -2.510
455 HB3 ASP 62 HB1 ASP 62 -1.475 12.738 -1.578
456 H ASP 63 HN ASP 63 -0.651 12.423 -5.553
457 HA ASP 63 HA ASP 63 -2.893 11.398 -6.911
458 HB2 ASP 63 HB2 ASP 63 -1.570 13.299 -7.758
459 HB3 ASP 63 HB1 ASP 63 -0.218 12.214 -8.042
460 H VAL 64 HN VAL 64 0.392 10.222 -6.597
461 HA VAL 64 HA VAL 64 0.049 8.116 -8.478
462 HB VAL 64 HB VAL 64 2.285 8.407 -6.448
463 HG11 VAL 64 HG11 VAL 64 3.588 7.050 -8.029
464 HG12 VAL 64 HG12 VAL 64 2.155 6.874 -9.049
465 HG13 VAL 64 HG13 VAL 64 2.176 6.180 -7.431
466 HG21 VAL 64 HG21 VAL 64 2.116 9.406 -9.292
467 HG22 VAL 64 HG22 VAL 64 3.543 9.485 -8.258
468 HG23 VAL 64 HG23 VAL 64 2.102 10.403 -7.834
469 H ALA 65 HN ALA 65 -0.442 8.359 -5.034
470 HA ALA 65 HA ALA 65 -0.515 5.632 -4.406
471 HB1 ALA 65 HB1 ALA 65 -0.507 7.381 -2.683
472 HB2 ALA 65 HB2 ALA 65 -1.909 6.327 -2.485
473 HB3 ALA 65 HB3 ALA 65 -2.101 7.919 -3.207
474 H GLY 66 HN GLY 66 -2.787 7.788 -5.947
475 HA2 GLY 66 HA2 GLY 66 -4.882 5.772 -5.923
476 HA3 GLY 66 HA1 GLY 66 -5.029 7.422 -6.493
477 H ARG 67 HN ARG 67 -2.191 6.134 -7.720
478 HA ARG 67 HA ARG 67 -3.479 5.663 -10.297
479 HB2 ARG 67 HB2 ARG 67 -0.579 6.104 -9.603
480 HB3 ARG 67 HB1 ARG 67 -1.200 5.848 -11.224
481 HG2 ARG 67 HG2 ARG 67 -1.831 8.177 -9.416
482 HG3 ARG 67 HG1 ARG 67 -0.735 8.197 -10.796
483 HD2 ARG 67 HD2 ARG 67 -2.562 7.783 -12.302
484 HD3 ARG 67 HD1 ARG 67 -3.677 7.565 -10.948
485 HE ARG 67 HE ARG 67 -2.417 10.081 -10.804
486 HH11 ARG 67 HH11 ARG 67 -4.833 8.409 -12.790
487 HH12 ARG 67 HH12 ARG 67 -5.846 9.757 -12.994
488 HH21 ARG 67 HH21 ARG 67 -3.756 11.928 -11.062
489 HH22 ARG 67 HH22 ARG 67 -5.179 11.858 -12.035
490 H VAL 68 HN VAL 68 -2.474 3.928 -7.689
491 HA VAL 68 HA VAL 68 -1.304 1.847 -9.279
492 HB VAL 68 HB VAL 68 -0.921 0.553 -7.200
493 HG11 VAL 68 HG11 VAL 68 0.759 2.029 -6.242
494 HG12 VAL 68 HG12 VAL 68 0.055 3.391 -7.118
495 HG13 VAL 68 HG13 VAL 68 0.781 2.046 -8.006
496 HG21 VAL 68 HG21 VAL 68 -1.218 1.629 -5.034
497 HG22 VAL 68 HG22 VAL 68 -2.767 1.306 -5.821
498 HG23 VAL 68 HG23 VAL 68 -2.102 2.949 -5.801
499 H ASP 69 HN ASP 69 -2.188 -0.441 -7.943
500 HA ASP 69 HA ASP 69 -5.015 -0.596 -8.709
501 HB2 ASP 69 HB2 ASP 69 -3.769 -0.933 -10.803
502 HB3 ASP 69 HB1 ASP 69 -2.804 -2.168 -10.033
503 H THR 70 HN THR 70 -2.229 -2.691 -8.202
504 HA THR 70 HA THR 70 -3.726 -4.161 -6.211
505 HB THR 70 HB THR 70 -2.177 -6.019 -6.874
506 HG1 THR 70 HG1 THR 70 -1.271 -5.305 -9.149
507 HG21 THR 70 HG21 THR 70 -3.674 -4.682 -9.128
508 HG22 THR 70 HG22 THR 70 -4.367 -5.811 -7.957
509 HG23 THR 70 HG23 THR 70 -3.165 -6.372 -9.131
510 HA PRO 71 HA PRO 71 -0.900 -2.962 -2.984
511 HB2 PRO 71 HB2 PRO 71 -0.300 -5.881 -2.692
512 HB3 PRO 71 HB1 PRO 71 -0.736 -4.697 -1.453
513 HG2 PRO 71 HG2 PRO 71 -2.551 -6.373 -2.284
514 HG3 PRO 71 HG1 PRO 71 -2.980 -4.661 -2.095
515 HD2 PRO 71 HD2 PRO 71 -2.391 -6.202 -4.590
516 HD3 PRO 71 HD1 PRO 71 -3.637 -4.972 -4.292
517 H ARG 72 HN ARG 72 0.285 -5.291 -5.326
518 HA ARG 72 HA ARG 72 3.028 -5.077 -4.621
519 HB2 ARG 72 HB2 ARG 72 3.489 -6.377 -6.565
520 HB3 ARG 72 HB1 ARG 72 1.981 -6.972 -5.886
521 HG2 ARG 72 HG2 ARG 72 0.898 -5.344 -7.595
522 HG3 ARG 72 HG1 ARG 72 2.470 -5.442 -8.390
523 HD2 ARG 72 HD2 ARG 72 0.566 -7.673 -7.767
524 HD3 ARG 72 HD1 ARG 72 1.024 -7.072 -9.352
525 HE ARG 72 HE ARG 72 3.370 -7.934 -8.243
526 HH11 ARG 72 HH11 ARG 72 0.234 -9.325 -9.042
527 HH12 ARG 72 HH12 ARG 72 0.772 -10.950 -9.012
528 HH21 ARG 72 HH21 ARG 72 4.176 -10.140 -8.384
529 HH22 ARG 72 HH22 ARG 72 3.097 -11.407 -8.738
530 H GLU 73 HN GLU 73 0.929 -3.196 -6.666
531 HA GLU 73 HA GLU 73 2.980 -1.780 -8.072
532 HB2 GLU 73 HB2 GLU 73 0.155 -0.857 -7.484
533 HB3 GLU 73 HB1 GLU 73 1.215 -0.266 -8.747
534 HG2 GLU 73 HG2 GLU 73 -0.003 -3.010 -8.589
535 HG3 GLU 73 HG1 GLU 73 -0.517 -1.695 -9.637
536 H LEU 74 HN LEU 74 1.127 -1.361 -5.167
537 HA LEU 74 HA LEU 74 1.897 1.280 -4.409
538 HB2 LEU 74 HB2 LEU 74 0.072 -0.457 -3.492
539 HB3 LEU 74 HB1 LEU 74 1.420 -0.893 -2.454
540 HG LEU 74 HG LEU 74 0.019 1.796 -2.544
541 HD11 LEU 74 HD11 LEU 74 0.021 -0.355 -0.460
542 HD12 LEU 74 HD12 LEU 74 -1.322 0.127 -1.500
543 HD13 LEU 74 HD13 LEU 74 -0.700 1.247 -0.290
544 HD21 LEU 74 HD21 LEU 74 2.387 2.100 -2.004
545 HD22 LEU 74 HD22 LEU 74 2.255 0.890 -0.725
546 HD23 LEU 74 HD23 LEU 74 1.362 2.409 -0.602
547 H LEU 75 HN LEU 75 2.957 -1.964 -3.487
548 HA LEU 75 HA LEU 75 5.056 -1.431 -1.763
549 HB2 LEU 75 HB2 LEU 75 3.988 -3.552 -2.039
550 HB3 LEU 75 HB1 LEU 75 4.526 -3.650 -3.695
551 HG LEU 75 HG LEU 75 6.830 -3.671 -2.868
552 HD11 LEU 75 HD11 LEU 75 6.517 -2.733 -0.657
553 HD12 LEU 75 HD12 LEU 75 7.216 -4.343 -0.519
554 HD13 LEU 75 HD13 LEU 75 5.502 -4.095 -0.186
555 HD21 LEU 75 HD21 LEU 75 4.999 -5.880 -2.015
556 HD22 LEU 75 HD22 LEU 75 6.751 -6.054 -2.274
557 HD23 LEU 75 HD23 LEU 75 5.673 -5.609 -3.619
558 H ASP 76 HN ASP 76 4.922 -1.606 -5.256
559 HA ASP 76 HA ASP 76 7.696 -1.673 -5.775
560 HB2 ASP 76 HB2 ASP 76 5.902 -2.272 -7.424
561 HB3 ASP 76 HB1 ASP 76 5.521 -0.556 -7.559
562 H LEU 77 HN LEU 77 5.352 0.909 -5.437
563 HA LEU 77 HA LEU 77 7.088 3.057 -6.051
564 HB2 LEU 77 HB2 LEU 77 4.665 3.001 -4.274
565 HB3 LEU 77 HB1 LEU 77 5.432 4.435 -4.911
566 HG LEU 77 HG LEU 77 3.998 2.316 -6.497
567 HD11 LEU 77 HD11 LEU 77 3.256 5.143 -5.787
568 HD12 LEU 77 HD12 LEU 77 2.516 3.669 -5.157
569 HD13 LEU 77 HD13 LEU 77 2.342 4.078 -6.856
570 HD21 LEU 77 HD21 LEU 77 4.255 3.847 -8.394
571 HD22 LEU 77 HD22 LEU 77 5.831 3.320 -7.789
572 HD23 LEU 77 HD23 LEU 77 5.224 4.926 -7.387
573 H ILE 78 HN ILE 78 6.148 1.426 -3.078
574 HA ILE 78 HA ILE 78 7.427 3.083 -1.218
575 HB ILE 78 HB ILE 78 7.048 0.071 -1.008
576 HG12 ILE 78 HG12 ILE 78 4.906 1.199 -1.394
577 HG13 ILE 78 HG11 ILE 78 5.000 0.597 0.256
578 HG21 ILE 78 HG21 ILE 78 7.161 0.434 1.426
579 HG22 ILE 78 HG22 ILE 78 7.515 2.136 1.144
580 HG23 ILE 78 HG23 ILE 78 8.654 0.897 0.613
581 HD11 ILE 78 HD11 ILE 78 5.482 2.844 1.053
582 HD12 ILE 78 HD12 ILE 78 3.979 2.812 0.131
583 HD13 ILE 78 HD13 ILE 78 5.453 3.445 -0.601
584 H ASN 79 HN ASN 79 8.555 -0.039 -2.481
585 HA ASN 79 HA ASN 79 11.164 0.158 -1.501
586 HB2 ASN 79 HB2 ASN 79 10.107 -1.408 -3.848
587 HB3 ASN 79 HB1 ASN 79 11.763 -1.534 -3.261
588 HD21 ASN 79 HD21 ASN 79 9.894 -3.611 -3.385
589 HD22 ASN 79 HD22 ASN 79 9.607 -4.170 -1.772
590 H GLY 80 HN GLY 80 9.787 1.305 -4.524
591 HA2 GLY 80 HA2 GLY 80 12.136 2.057 -5.816
592 HA3 GLY 80 HA1 GLY 80 10.566 2.830 -6.025
593 H ALA 81 HN ALA 81 10.070 3.926 -3.647
594 HA ALA 81 HA ALA 81 11.770 6.202 -3.612
595 HB1 ALA 81 HB1 ALA 81 9.602 5.394 -1.681
596 HB2 ALA 81 HB2 ALA 81 9.378 6.347 -3.147
597 HB3 ALA 81 HB3 ALA 81 10.325 6.995 -1.809
598 H LEU 82 HN LEU 82 11.650 3.249 -1.764
599 HA LEU 82 HA LEU 82 13.118 4.121 0.457
600 HB2 LEU 82 HB2 LEU 82 11.609 2.218 0.515
601 HB3 LEU 82 HB1 LEU 82 12.592 1.371 -0.659
602 HG LEU 82 HG LEU 82 14.404 1.291 0.906
603 HD11 LEU 82 HD11 LEU 82 12.448 2.481 2.902
604 HD12 LEU 82 HD12 LEU 82 13.866 3.291 2.245
605 HD13 LEU 82 HD13 LEU 82 14.063 1.879 3.286
606 HD21 LEU 82 HD21 LEU 82 11.831 0.182 2.001
607 HD22 LEU 82 HD22 LEU 82 13.442 -0.393 2.432
608 HD23 LEU 82 HD23 LEU 82 12.849 -0.575 0.782
609 H ALA 83 HN ALA 83 13.944 2.956 -2.696
610 HA ALA 83 HA ALA 83 16.600 2.182 -2.173
611 HB1 ALA 83 HB1 ALA 83 15.387 1.521 -4.208
612 HB2 ALA 83 HB2 ALA 83 16.937 2.273 -4.580
613 HB3 ALA 83 HB3 ALA 83 15.441 3.190 -4.773
614 H GLU 84 HN GLU 84 15.147 5.359 -2.828
615 HA GLU 84 HA GLU 84 17.752 6.566 -2.822
616 HB2 GLU 84 HB2 GLU 84 14.975 7.599 -3.282
617 HB3 GLU 84 HB1 GLU 84 16.349 8.662 -3.075
618 HG2 GLU 84 HG2 GLU 84 16.020 8.525 -5.389
619 HG3 GLU 84 HG1 GLU 84 17.370 7.435 -5.079
620 H ALA 85 HN ALA 85 15.831 5.409 -0.503
621 HA ALA 85 HA ALA 85 16.018 7.740 1.261
622 HB1 ALA 85 HB1 ALA 85 14.471 6.606 2.731
623 HB2 ALA 85 HB2 ALA 85 14.546 5.156 1.729
624 HB3 ALA 85 HB3 ALA 85 13.825 6.637 1.090
625 H ALA 86 HN ALA 86 17.027 4.410 0.952
626 HA ALA 86 HA ALA 86 18.781 3.289 1.687
627 HB1 ALA 86 HB1 ALA 86 20.136 5.362 1.691
628 HB2 ALA 86 HB2 ALA 86 20.614 4.242 2.968
629 HB3 ALA 86 HB3 ALA 86 19.637 5.655 3.359
630 H28A SDO 101 H28A SDO 42 -9.320 11.812 -2.406
631 H28B SDO 101 H28B SDO 42 -7.955 10.698 -2.220
632 H30A SDO 101 H30A SDO 42 -8.027 13.499 -1.155
633 H30B SDO 101 H30B SDO 42 -6.395 13.943 -1.651
634 H30C SDO 101 H30C SDO 42 -6.727 12.326 -1.017
635 H31A SDO 101 H31A SDO 42 -5.459 12.977 -3.792
636 H31B SDO 101 H31B SDO 42 -6.349 11.699 -4.622
637 H31C SDO 101 H31C SDO 42 -5.652 11.401 -3.024
638 H32A SDO 101 H32A SDO 42 -8.424 13.403 -4.793
639 H33A SDO 101 H33A SDO 42 -6.531 14.501 -4.951
640 H36A SDO 101 H36A SDO 42 -8.185 16.127 -3.524
641 H37A SDO 101 H37A SDO 42 -10.333 17.409 -3.158
642 H37B SDO 101 H37B SDO 42 -10.645 16.252 -1.860
643 H38A SDO 101 H38A SDO 42 -8.289 18.162 -2.002
644 H38B SDO 101 H38B SDO 42 -9.736 18.418 -1.044
645 H41A SDO 101 H41A SDO 42 -6.805 17.952 -0.421
646 H42A SDO 101 H42A SDO 42 -6.905 16.913 2.095
647 H42B SDO 101 H42B SDO 42 -6.736 15.510 1.045
648 H43A SDO 101 H43A SDO 42 -4.781 17.755 1.291
649 H43B SDO 101 H43B SDO 42 -4.767 16.548 0.042
650 H1A SDO 101 H1A SDO 42 -4.531 13.395 2.801
651 H1B SDO 101 H1B SDO 42 -4.588 14.556 4.108
652 H2A SDO 101 H2A SDO 42 -6.695 14.213 2.015
653 H2B SDO 101 H2B SDO 42 -6.766 15.314 3.357
654 H4A SDO 101 H4A SDO 42 -7.007 11.227 4.532
655 H4B SDO 101 H4B SDO 42 -7.019 12.354 5.865
656 H5A SDO 101 H5A SDO 42 -4.737 12.963 5.485
657 H5B SDO 101 H5B SDO 42 -4.672 11.926 4.060
658 H6A SDO 101 H6A SDO 42 -5.162 9.975 5.477
659 H6B SDO 101 H6B SDO 42 -5.182 11.021 6.892
660 H8A SDO 101 H8A SDO 42 -1.578 12.027 6.141
661 H8B SDO 101 H8B SDO 42 -2.832 12.432 4.964
662 H8C SDO 101 H8C SDO 42 -1.717 11.098 4.646
Start of MODEL 10
1 H1 MET 1 HT1 MET 1 21.154 -4.173 5.061
2 H2 MET 1 HT2 MET 1 22.198 -5.070 4.067
3 H3 MET 1 HT3 MET 1 22.344 -5.198 5.732
4 HA MET 1 HA MET 1 21.272 -7.070 4.605
5 HB2 MET 1 HB2 MET 1 19.290 -7.259 6.100
6 HB3 MET 1 HB1 MET 1 20.722 -6.736 6.962
7 HG2 MET 1 HG2 MET 1 19.870 -4.450 6.980
8 HG3 MET 1 HG1 MET 1 18.470 -4.957 6.044
9 HE1 MET 1 HE1 MET 1 16.950 -3.774 7.927
10 HE2 MET 1 HE2 MET 1 18.374 -3.376 8.894
11 HE3 MET 1 HE3 MET 1 17.003 -4.200 9.634
12 H ALA 2 HN ALA 2 18.687 -7.589 4.159
13 HA ALA 2 HA ALA 2 18.122 -5.833 1.897
14 HB1 ALA 2 HB1 ALA 2 17.149 -8.643 2.474
15 HB2 ALA 2 HB2 ALA 2 18.430 -8.213 1.339
16 HB3 ALA 2 HB3 ALA 2 16.771 -7.698 1.035
17 H THR 3 HN THR 3 17.001 -4.206 2.867
18 HA THR 3 HA THR 3 14.556 -5.022 4.237
19 HB THR 3 HB THR 3 15.923 -2.321 4.444
20 HG1 THR 3 HG1 THR 3 16.449 -4.785 5.539
21 HG21 THR 3 HG21 THR 3 13.512 -2.492 5.156
22 HG22 THR 3 HG22 THR 3 14.588 -2.138 6.510
23 HG23 THR 3 HG23 THR 3 13.978 -3.774 6.275
24 H LEU 4 HN LEU 4 14.393 -5.295 1.731
25 HA LEU 4 HA LEU 4 13.229 -2.891 0.559
26 HB2 LEU 4 HB2 LEU 4 14.791 -4.600 -0.700
27 HB3 LEU 4 HB1 LEU 4 13.380 -5.637 -0.707
28 HG LEU 4 HG LEU 4 12.171 -3.802 -1.905
29 HD11 LEU 4 HD11 LEU 4 13.553 -2.081 -3.000
30 HD12 LEU 4 HD12 LEU 4 14.947 -2.637 -2.059
31 HD13 LEU 4 HD13 LEU 4 13.542 -1.942 -1.243
32 HD21 LEU 4 HD21 LEU 4 13.247 -4.258 -4.068
33 HD22 LEU 4 HD22 LEU 4 13.039 -5.719 -3.106
34 HD23 LEU 4 HD23 LEU 4 14.628 -4.961 -3.221
35 H LEU 5 HN LEU 5 10.878 -3.078 0.000
36 HA LEU 5 HA LEU 5 9.647 -4.395 2.175
37 HB2 LEU 5 HB2 LEU 5 8.862 -2.207 1.275
38 HB3 LEU 5 HB1 LEU 5 8.206 -3.065 -0.117
39 HG LEU 5 HG LEU 5 6.765 -4.374 1.384
40 HD11 LEU 5 HD11 LEU 5 7.863 -2.573 3.522
41 HD12 LEU 5 HD12 LEU 5 8.176 -4.307 3.336
42 HD13 LEU 5 HD13 LEU 5 6.559 -3.743 3.713
43 HD21 LEU 5 HD21 LEU 5 6.503 -1.396 1.761
44 HD22 LEU 5 HD22 LEU 5 5.269 -2.617 2.081
45 HD23 LEU 5 HD23 LEU 5 5.839 -2.353 0.419
46 H THR 6 HN THR 6 8.694 -6.251 2.335
47 HA THR 6 HA THR 6 8.820 -8.078 0.107
48 HB THR 6 HB THR 6 8.311 -9.766 1.797
49 HG1 THR 6 HG1 THR 6 8.455 -8.198 4.063
50 HG21 THR 6 HG21 THR 6 10.430 -7.811 2.744
51 HG22 THR 6 HG22 THR 6 10.674 -9.090 1.561
52 HG23 THR 6 HG23 THR 6 10.312 -9.499 3.240
53 H THR 7 HN THR 7 6.857 -9.769 0.371
54 HA THR 7 HA THR 7 4.446 -8.343 -0.223
55 HB THR 7 HB THR 7 4.743 -11.312 0.264
56 HG1 THR 7 HG1 THR 7 5.446 -9.919 -2.136
57 HG21 THR 7 HG21 THR 7 3.176 -9.715 -1.776
58 HG22 THR 7 HG22 THR 7 2.502 -10.370 -0.285
59 HG23 THR 7 HG23 THR 7 3.090 -11.461 -1.546
60 H ASP 8 HN ASP 8 5.922 -10.223 2.314
61 HA ASP 8 HA ASP 8 3.736 -10.747 3.983
62 HB2 ASP 8 HB2 ASP 8 5.799 -11.985 4.148
63 HB3 ASP 8 HB1 ASP 8 6.674 -10.533 4.622
64 H ASP 9 HN ASP 9 6.218 -8.203 4.187
65 HA ASP 9 HA ASP 9 5.134 -6.922 6.450
66 HB2 ASP 9 HB2 ASP 9 6.869 -5.810 4.245
67 HB3 ASP 9 HB1 ASP 9 6.333 -4.882 5.623
68 H LEU 10 HN LEU 10 4.558 -6.479 3.024
69 HA LEU 10 HA LEU 10 2.945 -4.170 3.340
70 HB2 LEU 10 HB2 LEU 10 3.968 -4.798 1.188
71 HB3 LEU 10 HB1 LEU 10 2.888 -6.176 1.085
72 HG LEU 10 HG LEU 10 0.963 -4.551 1.144
73 HD11 LEU 10 HD11 LEU 10 3.143 -2.528 0.706
74 HD12 LEU 10 HD12 LEU 10 2.068 -2.634 2.097
75 HD13 LEU 10 HD13 LEU 10 1.418 -2.232 0.509
76 HD21 LEU 10 HD21 LEU 10 1.185 -3.957 -1.223
77 HD22 LEU 10 HD22 LEU 10 1.725 -5.613 -0.923
78 HD23 LEU 10 HD23 LEU 10 2.909 -4.327 -1.150
79 H ARG 11 HN ARG 11 2.244 -7.619 3.214
80 HA ARG 11 HA ARG 11 -0.527 -7.605 3.250
81 HB2 ARG 11 HB2 ARG 11 0.771 -9.675 3.064
82 HB3 ARG 11 HB1 ARG 11 1.378 -9.446 4.703
83 HG2 ARG 11 HG2 ARG 11 -0.818 -9.855 5.620
84 HG3 ARG 11 HG1 ARG 11 -1.516 -9.924 3.995
85 HD2 ARG 11 HD2 ARG 11 -1.193 -12.178 4.944
86 HD3 ARG 11 HD1 ARG 11 -0.223 -11.918 3.500
87 HE ARG 11 HE ARG 11 1.574 -11.340 5.353
88 HH11 ARG 11 HH11 ARG 11 -0.723 -14.096 5.330
89 HH12 ARG 11 HH12 ARG 11 0.318 -15.075 6.243
90 HH21 ARG 11 HH21 ARG 11 2.964 -12.779 6.584
91 HH22 ARG 11 HH22 ARG 11 2.362 -14.331 6.993
92 H ARG 12 HN ARG 12 1.687 -7.583 5.945
93 HA ARG 12 HA ARG 12 -0.268 -7.372 7.949
94 HB2 ARG 12 HB2 ARG 12 2.688 -6.799 7.948
95 HB3 ARG 12 HB1 ARG 12 1.697 -6.805 9.407
96 HG2 ARG 12 HG2 ARG 12 1.148 -9.101 9.129
97 HG3 ARG 12 HG1 ARG 12 1.843 -9.134 7.517
98 HD2 ARG 12 HD2 ARG 12 3.259 -10.245 9.157
99 HD3 ARG 12 HD1 ARG 12 4.049 -8.841 8.446
100 HE ARG 12 HE ARG 12 3.900 -7.723 10.447
101 HH11 ARG 12 HH11 ARG 12 2.035 -10.691 10.864
102 HH12 ARG 12 HH12 ARG 12 2.512 -10.951 12.477
103 HH21 ARG 12 HH21 ARG 12 4.565 -8.087 12.691
104 HH22 ARG 12 HH22 ARG 12 4.039 -9.476 13.537
105 H ALA 13 HN ALA 13 1.672 -4.923 6.301
106 HA ALA 13 HA ALA 13 0.785 -2.719 7.810
107 HB1 ALA 13 HB1 ALA 13 1.562 -1.357 5.938
108 HB2 ALA 13 HB2 ALA 13 1.702 -2.796 4.948
109 HB3 ALA 13 HB3 ALA 13 2.738 -2.595 6.367
110 H LEU 14 HN LEU 14 -0.477 -4.163 4.809
111 HA LEU 14 HA LEU 14 -2.463 -2.227 4.447
112 HB2 LEU 14 HB2 LEU 14 -1.471 -3.790 2.736
113 HB3 LEU 14 HB1 LEU 14 -2.440 -5.062 3.438
114 HG LEU 14 HG LEU 14 -4.472 -3.819 2.843
115 HD11 LEU 14 HD11 LEU 14 -2.532 -1.955 1.477
116 HD12 LEU 14 HD12 LEU 14 -3.561 -1.568 2.854
117 HD13 LEU 14 HD13 LEU 14 -4.282 -1.914 1.280
118 HD21 LEU 14 HD21 LEU 14 -2.590 -4.312 0.534
119 HD22 LEU 14 HD22 LEU 14 -4.350 -4.257 0.443
120 HD23 LEU 14 HD23 LEU 14 -3.556 -5.539 1.352
121 H VAL 15 HN VAL 15 -2.323 -5.172 6.337
122 HA VAL 15 HA VAL 15 -5.113 -5.335 6.995
123 HB VAL 15 HB VAL 15 -2.672 -6.310 8.536
124 HG11 VAL 15 HG11 VAL 15 -4.258 -7.788 9.766
125 HG12 VAL 15 HG12 VAL 15 -5.602 -6.999 8.943
126 HG13 VAL 15 HG13 VAL 15 -4.587 -6.078 10.052
127 HG21 VAL 15 HG21 VAL 15 -4.595 -7.838 6.777
128 HG22 VAL 15 HG22 VAL 15 -3.254 -8.523 7.697
129 HG23 VAL 15 HG23 VAL 15 -2.929 -7.397 6.378
130 H GLU 16 HN GLU 16 -2.283 -4.168 8.739
131 HA GLU 16 HA GLU 16 -3.472 -3.114 10.984
132 HB2 GLU 16 HB2 GLU 16 -0.927 -2.427 9.563
133 HB3 GLU 16 HB1 GLU 16 -1.404 -1.612 11.049
134 HG2 GLU 16 HG2 GLU 16 -1.158 -4.598 10.807
135 HG3 GLU 16 HG1 GLU 16 0.171 -3.555 11.308
136 H SER 17 HN SER 17 -3.071 -1.559 7.833
137 HA SER 17 HA SER 17 -3.986 0.946 8.967
138 HB2 SER 17 HB2 SER 17 -3.199 0.351 6.116
139 HB3 SER 17 HB1 SER 17 -3.346 1.935 6.883
140 HG SER 17 HG SER 17 -1.420 -0.043 7.180
141 H ALA 18 HN ALA 18 -5.539 -1.747 7.906
142 HA ALA 18 HA ALA 18 -7.546 -0.525 6.246
143 HB1 ALA 18 HB1 ALA 18 -7.504 -3.250 7.549
144 HB2 ALA 18 HB2 ALA 18 -6.924 -2.876 5.922
145 HB3 ALA 18 HB3 ALA 18 -8.635 -2.703 6.306
146 H GLY 19 HN GLY 19 -9.650 -0.147 6.791
147 HA2 GLY 19 HA2 GLY 19 -10.133 0.480 9.573
148 HA3 GLY 19 HA1 GLY 19 -11.199 0.843 8.224
149 H GLU 20 HN GLU 20 -13.010 -0.328 8.085
150 HA GLU 20 HA GLU 20 -12.985 -3.097 8.979
151 HB2 GLU 20 HB2 GLU 20 -13.673 -1.541 10.914
152 HB3 GLU 20 HB1 GLU 20 -15.088 -1.139 9.965
153 HG2 GLU 20 HG2 GLU 20 -14.385 -3.925 10.893
154 HG3 GLU 20 HG1 GLU 20 -15.448 -2.837 11.765
155 H THR 21 HN THR 21 -13.600 -4.034 7.152
156 HA THR 21 HA THR 21 -16.126 -3.367 6.071
157 HB THR 21 HB THR 21 -14.792 -1.703 4.909
158 HG1 THR 21 HG1 THR 21 -16.342 -2.313 3.599
159 HG21 THR 21 HG21 THR 21 -13.002 -2.324 3.282
160 HG22 THR 21 HG22 THR 21 -13.085 -3.984 3.871
161 HG23 THR 21 HG23 THR 21 -12.578 -2.693 4.956
162 H ASP 22 HN ASP 22 -16.457 -5.391 6.931
163 HA ASP 22 HA ASP 22 -16.926 -7.568 6.876
164 HB2 ASP 22 HB2 ASP 22 -15.953 -7.415 4.095
165 HB3 ASP 22 HB1 ASP 22 -16.758 -8.852 4.736
166 H GLY 23 HN GLY 23 -14.325 -6.581 7.372
167 HA2 GLY 23 HA2 GLY 23 -12.303 -7.507 8.245
168 HA3 GLY 23 HA1 GLY 23 -12.975 -9.094 7.867
169 H THR 24 HN THR 24 -13.053 -9.616 5.541
170 HA THR 24 HA THR 24 -12.073 -10.100 3.648
171 HB THR 24 HB THR 24 -10.792 -7.386 3.857
172 HG1 THR 24 HG1 THR 24 -12.965 -6.970 3.779
173 HG21 THR 24 HG21 THR 24 -10.719 -7.561 1.402
174 HG22 THR 24 HG22 THR 24 -11.374 -9.214 1.572
175 HG23 THR 24 HG23 THR 24 -9.778 -8.827 2.217
176 H ASP 25 HN ASP 25 -10.918 -11.741 4.109
177 HA ASP 25 HA ASP 25 -8.516 -11.750 5.629
178 HB2 ASP 25 HB2 ASP 25 -9.686 -13.920 3.856
179 HB3 ASP 25 HB1 ASP 25 -8.272 -14.144 4.877
180 H LEU 26 HN LEU 26 -6.745 -10.947 5.058
181 HA LEU 26 HA LEU 26 -6.127 -10.429 2.230
182 HB2 LEU 26 HB2 LEU 26 -6.305 -8.714 4.153
183 HB3 LEU 26 HB1 LEU 26 -4.763 -9.351 4.672
184 HG LEU 26 HG LEU 26 -3.818 -8.711 2.454
185 HD11 LEU 26 HD11 LEU 26 -5.089 -7.111 1.097
186 HD12 LEU 26 HD12 LEU 26 -6.483 -7.342 2.154
187 HD13 LEU 26 HD13 LEU 26 -5.889 -8.681 1.179
188 HD21 LEU 26 HD21 LEU 26 -3.506 -7.319 4.408
189 HD22 LEU 26 HD22 LEU 26 -5.061 -6.547 4.132
190 HD23 LEU 26 HD23 LEU 26 -3.747 -6.315 2.979
191 H SER 27 HN SER 27 -5.667 -13.028 3.631
192 HA SER 27 HA SER 27 -2.755 -13.116 3.338
193 HB2 SER 27 HB2 SER 27 -3.681 -13.737 5.625
194 HB3 SER 27 HB1 SER 27 -4.428 -15.135 4.851
195 HG SER 27 HG SER 27 -2.594 -16.044 5.286
196 H GLY 28 HN GLY 28 -1.908 -14.987 2.171
197 HA2 GLY 28 HA2 GLY 28 -2.218 -16.762 0.601
198 HA3 GLY 28 HA1 GLY 28 -3.884 -16.225 0.380
199 H ASP 29 HN ASP 29 -4.271 -15.119 -1.416
200 HA ASP 29 HA ASP 29 -2.063 -13.454 -2.331
201 HB2 ASP 29 HB2 ASP 29 -2.440 -15.071 -4.102
202 HB3 ASP 29 HB1 ASP 29 -4.154 -14.636 -4.163
203 H PHE 30 HN PHE 30 -2.252 -11.614 -1.881
204 HA PHE 30 HA PHE 30 -4.829 -10.204 -2.192
205 HB2 PHE 30 HB2 PHE 30 -4.278 -8.835 -0.289
206 HB3 PHE 30 HB1 PHE 30 -4.063 -10.511 0.212
207 HD1 PHE 30 HD2 PHE 30 -1.744 -11.470 0.323
208 HD2 PHE 30 HD1 PHE 30 -2.479 -7.317 -0.227
209 HE1 PHE 30 HE2 PHE 30 0.598 -10.975 0.913
210 HE2 PHE 30 HE1 PHE 30 -0.148 -6.821 0.361
211 HZ PHE 30 HZ PHE 30 1.390 -8.650 0.929
212 H LEU 31 HN LEU 31 -1.532 -10.565 -2.963
213 HA LEU 31 HA LEU 31 -0.814 -7.848 -3.334
214 HB2 LEU 31 HB2 LEU 31 0.722 -9.783 -2.821
215 HB3 LEU 31 HB1 LEU 31 0.506 -10.301 -4.472
216 HG LEU 31 HG LEU 31 1.419 -8.082 -5.195
217 HD11 LEU 31 HD11 LEU 31 2.733 -6.822 -3.551
218 HD12 LEU 31 HD12 LEU 31 2.126 -7.891 -2.287
219 HD13 LEU 31 HD13 LEU 31 1.010 -6.847 -3.168
220 HD21 LEU 31 HD21 LEU 31 2.777 -10.093 -5.239
221 HD22 LEU 31 HD22 LEU 31 3.198 -9.869 -3.545
222 HD23 LEU 31 HD23 LEU 31 3.755 -8.708 -4.751
223 H ASP 32 HN ASP 32 -1.882 -10.488 -5.435
224 HA ASP 32 HA ASP 32 -1.701 -8.748 -7.767
225 HB2 ASP 32 HB2 ASP 32 -0.892 -11.135 -7.787
226 HB3 ASP 32 HB1 ASP 32 -2.562 -11.650 -7.586
227 H LEU 33 HN LEU 33 -3.762 -9.322 -5.356
228 HA LEU 33 HA LEU 33 -6.288 -9.256 -6.757
229 HB2 LEU 33 HB2 LEU 33 -5.938 -10.426 -4.574
230 HB3 LEU 33 HB1 LEU 33 -5.602 -8.890 -3.816
231 HG LEU 33 HG LEU 33 -7.960 -8.210 -4.279
232 HD11 LEU 33 HD11 LEU 33 -9.561 -9.937 -4.918
233 HD12 LEU 33 HD12 LEU 33 -8.238 -11.066 -5.213
234 HD13 LEU 33 HD13 LEU 33 -8.408 -9.616 -6.208
235 HD21 LEU 33 HD21 LEU 33 -7.656 -10.796 -2.740
236 HD22 LEU 33 HD22 LEU 33 -8.949 -9.612 -2.543
237 HD23 LEU 33 HD23 LEU 33 -7.290 -9.193 -2.117
238 H ARG 34 HN ARG 34 -7.817 -7.284 -5.956
239 HA ARG 34 HA ARG 34 -6.166 -4.881 -6.400
240 HB2 ARG 34 HB2 ARG 34 -9.006 -5.376 -7.253
241 HB3 ARG 34 HB1 ARG 34 -8.093 -3.905 -7.522
242 HG2 ARG 34 HG2 ARG 34 -6.567 -5.100 -8.983
243 HG3 ARG 34 HG1 ARG 34 -7.440 -6.604 -8.664
244 HD2 ARG 34 HD2 ARG 34 -9.473 -5.591 -9.558
245 HD3 ARG 34 HD1 ARG 34 -8.582 -4.118 -9.911
246 HE ARG 34 HE ARG 34 -7.321 -6.311 -11.105
247 HH11 ARG 34 HH11 ARG 34 -10.172 -4.266 -11.409
248 HH12 ARG 34 HH12 ARG 34 -10.353 -4.530 -13.099
249 HH21 ARG 34 HH21 ARG 34 -7.531 -6.640 -13.430
250 HH22 ARG 34 HH22 ARG 34 -8.778 -5.877 -14.286
251 H PHE 35 HN PHE 35 -7.048 -2.893 -5.588
252 HA PHE 35 HA PHE 35 -7.954 -3.065 -2.906
253 HB2 PHE 35 HB2 PHE 35 -7.698 -0.673 -4.753
254 HB3 PHE 35 HB1 PHE 35 -8.080 -0.562 -3.041
255 HD1 PHE 35 HD2 PHE 35 -6.375 -1.181 -1.357
256 HD2 PHE 35 HD1 PHE 35 -5.488 -1.047 -5.515
257 HE1 PHE 35 HE2 PHE 35 -3.969 -1.132 -0.841
258 HE2 PHE 35 HE1 PHE 35 -3.079 -1.003 -5.003
259 HZ PHE 35 HZ PHE 35 -2.322 -1.050 -2.657
260 H GLU 36 HN GLU 36 -9.410 -2.650 -5.979
261 HA GLU 36 HA GLU 36 -11.972 -1.746 -5.427
262 HB2 GLU 36 HB2 GLU 36 -11.298 -3.979 -7.360
263 HB3 GLU 36 HB1 GLU 36 -12.689 -2.925 -7.426
264 HG2 GLU 36 HG2 GLU 36 -11.229 -1.010 -7.865
265 HG3 GLU 36 HG1 GLU 36 -9.837 -2.086 -7.805
266 H ASP 37 HN ASP 37 -10.599 -4.980 -5.071
267 HA ASP 37 HA ASP 37 -13.151 -6.177 -4.412
268 HB2 ASP 37 HB2 ASP 37 -11.320 -7.361 -5.667
269 HB3 ASP 37 HB1 ASP 37 -10.415 -7.403 -4.157
270 H ILE 38 HN ILE 38 -10.237 -5.177 -2.740
271 HA ILE 38 HA ILE 38 -11.185 -6.289 -0.255
272 HB ILE 38 HB ILE 38 -9.103 -5.395 0.771
273 HG12 ILE 38 HG12 ILE 38 -8.489 -4.512 -2.057
274 HG13 ILE 38 HG11 ILE 38 -8.763 -3.455 -0.679
275 HG21 ILE 38 HG21 ILE 38 -9.184 -7.645 -0.113
276 HG22 ILE 38 HG22 ILE 38 -7.592 -6.918 -0.352
277 HG23 ILE 38 HG23 ILE 38 -8.703 -7.056 -1.716
278 HD11 ILE 38 HD11 ILE 38 -6.470 -5.374 -1.041
279 HD12 ILE 38 HD12 ILE 38 -6.743 -4.370 0.383
280 HD13 ILE 38 HD13 ILE 38 -6.397 -3.613 -1.172
281 H GLY 39 HN GLY 39 -12.511 -3.951 -1.590
282 HA2 GLY 39 HA2 GLY 39 -13.773 -2.161 -0.926
283 HA3 GLY 39 HA1 GLY 39 -13.601 -2.815 0.693
284 H TYR 40 HN TYR 40 -11.043 -1.510 -1.391
285 HA TYR 40 HA TYR 40 -10.487 0.361 0.748
286 HB2 TYR 40 HB2 TYR 40 -8.794 -0.941 -1.255
287 HB3 TYR 40 HB1 TYR 40 -8.436 0.770 -0.998
288 HD1 TYR 40 HD2 TYR 40 -8.874 -2.453 0.748
289 HD2 TYR 40 HD1 TYR 40 -7.213 1.451 0.914
290 HE1 TYR 40 HE2 TYR 40 -7.635 -3.084 2.758
291 HE2 TYR 40 HE1 TYR 40 -5.961 0.847 2.934
292 HH TYR 40 HH TYR 40 -5.991 -0.854 4.761
293 H ASP 41 HN ASP 41 -10.613 2.395 0.689
294 HA ASP 41 HA ASP 41 -11.837 3.684 -1.650
295 HB2 ASP 41 HB2 ASP 41 -12.573 3.801 0.914
296 HB3 ASP 41 HB1 ASP 41 -11.366 5.080 0.937
297 H SER 42 HN SER 42 -11.030 6.119 -1.737
298 HA SER 42 HA SER 42 -8.300 6.015 -2.564
299 HB2 SER 42 HB2 SER 42 -8.655 8.450 -2.990
300 HB3 SER 42 HB1 SER 42 -9.922 7.437 -3.688
301 H LEU 43 HN LEU 43 -10.046 7.630 -0.023
302 HA LEU 43 HA LEU 43 -8.075 8.977 1.342
303 HB2 LEU 43 HB2 LEU 43 -10.490 7.604 2.503
304 HB3 LEU 43 HB1 LEU 43 -9.565 8.875 3.278
305 HG LEU 43 HG LEU 43 -11.169 9.165 0.736
306 HD11 LEU 43 HD11 LEU 43 -12.645 10.558 2.115
307 HD12 LEU 43 HD12 LEU 43 -11.678 10.151 3.531
308 HD13 LEU 43 HD13 LEU 43 -12.580 8.889 2.681
309 HD21 LEU 43 HD21 LEU 43 -10.680 11.567 0.973
310 HD22 LEU 43 HD22 LEU 43 -9.200 10.598 0.799
311 HD23 LEU 43 HD23 LEU 43 -9.669 11.191 2.379
312 H ALA 44 HN ALA 44 -9.132 5.647 1.739
313 HA ALA 44 HA ALA 44 -7.563 5.047 3.991
314 HB1 ALA 44 HB1 ALA 44 -8.684 3.165 1.919
315 HB2 ALA 44 HB2 ALA 44 -9.527 3.718 3.369
316 HB3 ALA 44 HB3 ALA 44 -8.081 2.716 3.517
317 H LEU 45 HN LEU 45 -6.852 4.948 0.539
318 HA LEU 45 HA LEU 45 -4.429 3.482 0.895
319 HB2 LEU 45 HB2 LEU 45 -5.678 3.464 -1.182
320 HB3 LEU 45 HB1 LEU 45 -5.336 5.167 -1.407
321 HG LEU 45 HG LEU 45 -3.197 4.749 -2.229
322 HD11 LEU 45 HD11 LEU 45 -2.373 3.649 -0.118
323 HD12 LEU 45 HD12 LEU 45 -1.808 2.854 -1.589
324 HD13 LEU 45 HD13 LEU 45 -3.126 2.136 -0.657
325 HD21 LEU 45 HD21 LEU 45 -4.484 2.163 -2.362
326 HD22 LEU 45 HD22 LEU 45 -3.196 2.721 -3.470
327 HD23 LEU 45 HD23 LEU 45 -4.830 3.470 -3.513
328 H MET 46 HN MET 46 -5.271 6.892 0.805
329 HA MET 46 HA MET 46 -2.638 8.007 0.738
330 HB2 MET 46 HB2 MET 46 -4.794 9.155 2.487
331 HB3 MET 46 HB1 MET 46 -3.555 10.020 1.584
332 HG2 MET 46 HG2 MET 46 -4.783 9.272 -0.480
333 HG3 MET 46 HG1 MET 46 -5.999 8.675 0.642
334 HE1 MET 46 HE1 MET 46 -7.089 11.948 2.560
335 HE2 MET 46 HE2 MET 46 -5.734 10.908 2.982
336 HE3 MET 46 HE3 MET 46 -7.259 10.197 2.446
337 H GLU 47 HN GLU 47 -4.817 7.150 3.271
338 HA GLU 47 HA GLU 47 -3.340 7.538 5.542
339 HB2 GLU 47 HB2 GLU 47 -5.567 5.997 4.564
340 HB3 GLU 47 HB1 GLU 47 -5.071 5.535 6.225
341 HG2 GLU 47 HG2 GLU 47 -6.141 8.105 5.041
342 HG3 GLU 47 HG1 GLU 47 -6.872 7.092 6.281
343 H THR 48 HN THR 48 -3.670 4.572 3.612
344 HA THR 48 HA THR 48 -1.935 2.876 4.974
345 HB THR 48 HB THR 48 -2.622 3.071 2.028
346 HG1 THR 48 HG1 THR 48 -4.405 2.644 3.378
347 HG21 THR 48 HG21 THR 48 -1.358 0.682 3.463
348 HG22 THR 48 HG22 THR 48 -0.575 1.726 2.279
349 HG23 THR 48 HG23 THR 48 -1.930 0.733 1.785
350 H ALA 49 HN ALA 49 -1.226 4.916 2.116
351 HA ALA 49 HA ALA 49 1.457 4.321 1.839
352 HB1 ALA 49 HB1 ALA 49 0.083 6.906 1.124
353 HB2 ALA 49 HB2 ALA 49 0.112 5.448 0.126
354 HB3 ALA 49 HB3 ALA 49 1.612 6.320 0.459
355 H ALA 50 HN ALA 50 -0.023 7.056 3.601
356 HA ALA 50 HA ALA 50 2.374 8.287 4.392
357 HB1 ALA 50 HB1 ALA 50 0.995 9.449 6.059
358 HB2 ALA 50 HB2 ALA 50 -0.320 8.314 5.755
359 HB3 ALA 50 HB3 ALA 50 0.216 9.412 4.485
360 H ARG 51 HN ARG 51 0.522 5.703 5.813
361 HA ARG 51 HA ARG 51 1.931 5.653 8.288
362 HB2 ARG 51 HB2 ARG 51 -0.451 4.853 7.810
363 HB3 ARG 51 HB1 ARG 51 0.263 3.439 7.070
364 HG2 ARG 51 HG2 ARG 51 0.947 4.141 9.883
365 HG3 ARG 51 HG1 ARG 51 -0.599 3.387 9.521
366 HD2 ARG 51 HD2 ARG 51 0.583 1.496 8.484
367 HD3 ARG 51 HD1 ARG 51 2.124 2.269 8.863
368 HE ARG 51 HE ARG 51 1.950 1.564 10.993
369 HH11 ARG 51 HH11 ARG 51 -1.305 1.282 9.565
370 HH12 ARG 51 HH12 ARG 51 -2.021 0.676 11.002
371 HH21 ARG 51 HH21 ARG 51 0.981 0.606 12.898
372 HH22 ARG 51 HH22 ARG 51 -0.655 0.168 12.908
373 H LEU 52 HN LEU 52 2.340 4.232 5.174
374 HA LEU 52 HA LEU 52 4.425 2.414 5.943
375 HB2 LEU 52 HB2 LEU 52 3.564 3.464 3.256
376 HB3 LEU 52 HB1 LEU 52 4.822 2.262 3.477
377 HG LEU 52 HG LEU 52 1.936 1.905 4.289
378 HD11 LEU 52 HD11 LEU 52 1.832 0.353 2.388
379 HD12 LEU 52 HD12 LEU 52 3.465 0.839 1.921
380 HD13 LEU 52 HD13 LEU 52 2.152 2.009 1.877
381 HD21 LEU 52 HD21 LEU 52 2.565 -0.405 4.616
382 HD22 LEU 52 HD22 LEU 52 3.543 0.657 5.639
383 HD23 LEU 52 HD23 LEU 52 4.231 -0.039 4.166
384 H GLU 53 HN GLU 53 4.267 5.586 4.403
385 HA GLU 53 HA GLU 53 6.938 6.036 3.894
386 HB2 GLU 53 HB2 GLU 53 4.793 7.973 4.686
387 HB3 GLU 53 HB1 GLU 53 6.407 8.475 4.202
388 HG2 GLU 53 HG2 GLU 53 6.076 7.346 2.051
389 HG3 GLU 53 HG1 GLU 53 4.423 6.962 2.541
390 H SER 54 HN SER 54 5.170 6.698 6.841
391 HA SER 54 HA SER 54 7.379 7.863 8.135
392 HB2 SER 54 HB2 SER 54 5.862 7.558 10.172
393 HB3 SER 54 HB1 SER 54 5.276 8.577 8.849
394 HG SER 54 HG SER 54 3.823 7.132 8.326
395 H ARG 55 HN ARG 55 6.513 4.547 7.676
396 HA ARG 55 HA ARG 55 8.062 3.627 9.941
397 HB2 ARG 55 HB2 ARG 55 6.103 2.286 9.134
398 HB3 ARG 55 HB1 ARG 55 6.966 1.974 7.635
399 HG2 ARG 55 HG2 ARG 55 8.756 0.856 8.944
400 HG3 ARG 55 HG1 ARG 55 7.799 1.090 10.399
401 HD2 ARG 55 HD2 ARG 55 5.987 -0.291 9.334
402 HD3 ARG 55 HD1 ARG 55 7.085 -0.611 7.992
403 HE ARG 55 HE ARG 55 7.933 -1.239 10.718
404 HH11 ARG 55 HH11 ARG 55 7.163 -2.569 7.430
405 HH12 ARG 55 HH12 ARG 55 7.665 -4.139 7.841
406 HH21 ARG 55 HH21 ARG 55 8.553 -3.489 11.193
407 HH22 ARG 55 HH22 ARG 55 8.439 -4.669 9.973
408 H TYR 56 HN TYR 56 8.437 3.739 6.418
409 HA TYR 56 HA TYR 56 11.086 2.511 6.682
410 HB2 TYR 56 HB2 TYR 56 9.588 3.130 4.131
411 HB3 TYR 56 HB1 TYR 56 11.021 2.106 4.306
412 HD1 TYR 56 HD1 TYR 56 10.733 0.138 6.025
413 HD2 TYR 56 HD2 TYR 56 7.525 2.093 4.056
414 HE1 TYR 56 HE1 TYR 56 9.349 -1.871 6.314
415 HE2 TYR 56 HE2 TYR 56 6.120 0.093 4.351
416 HH TYR 56 HH TYR 56 6.944 -2.446 6.404
417 H GLY 57 HN GLY 57 9.647 5.584 5.875
418 HA2 GLY 57 HA2 GLY 57 10.828 7.594 5.862
419 HA3 GLY 57 HA1 GLY 57 12.323 6.704 5.596
420 H VAL 58 HN VAL 58 9.217 6.665 3.931
421 HA VAL 58 HA VAL 58 10.686 7.326 1.496
422 HB VAL 58 HB VAL 58 9.065 6.034 0.139
423 HG11 VAL 58 HG11 VAL 58 10.334 4.394 2.313
424 HG12 VAL 58 HG12 VAL 58 11.116 4.955 0.843
425 HG13 VAL 58 HG13 VAL 58 9.790 3.789 0.749
426 HG21 VAL 58 HG21 VAL 58 7.931 5.127 2.787
427 HG22 VAL 58 HG22 VAL 58 7.512 4.458 1.212
428 HG23 VAL 58 HG23 VAL 58 7.108 6.131 1.593
429 H SER 59 HN SER 59 8.833 8.019 -0.265
430 HA SER 59 HA SER 59 6.818 9.670 0.940
431 HB2 SER 59 HB2 SER 59 9.076 10.909 -0.681
432 HB3 SER 59 HB1 SER 59 7.625 11.751 -0.132
433 HG SER 59 HG SER 59 8.565 10.636 1.976
434 H ILE 60 HN ILE 60 5.081 9.186 -0.246
435 HA ILE 60 HA ILE 60 5.394 8.895 -3.141
436 HB ILE 60 HB ILE 60 3.365 7.589 -1.285
437 HG12 ILE 60 HG12 ILE 60 5.547 6.317 -2.961
438 HG13 ILE 60 HG11 ILE 60 5.606 6.528 -1.222
439 HG21 ILE 60 HG21 ILE 60 2.367 8.200 -3.433
440 HG22 ILE 60 HG22 ILE 60 2.516 6.446 -3.276
441 HG23 ILE 60 HG23 ILE 60 3.657 7.342 -4.282
442 HD11 ILE 60 HD11 ILE 60 5.025 4.260 -1.810
443 HD12 ILE 60 HD12 ILE 60 3.627 4.833 -2.724
444 HD13 ILE 60 HD13 ILE 60 3.683 5.040 -0.972
445 HA PRO 61 HA PRO 61 2.882 12.635 -3.037
446 HB2 PRO 61 HB2 PRO 61 2.650 11.954 -5.926
447 HB3 PRO 61 HB1 PRO 61 3.121 13.479 -5.165
448 HG2 PRO 61 HG2 PRO 61 4.961 11.945 -6.317
449 HG3 PRO 61 HG1 PRO 61 5.302 12.770 -4.788
450 HD2 PRO 61 HD2 PRO 61 4.587 9.902 -5.256
451 HD3 PRO 61 HD1 PRO 61 5.801 10.582 -4.158
452 H ASP 62 HN ASP 62 0.731 13.014 -3.100
453 HA ASP 62 HA ASP 62 -1.140 11.082 -2.516
454 HB2 ASP 62 HB2 ASP 62 -1.848 13.664 -3.914
455 HB3 ASP 62 HB1 ASP 62 -2.778 12.798 -2.706
456 H ASP 63 HN ASP 63 -0.604 12.803 -5.531
457 HA ASP 63 HA ASP 63 -2.512 11.710 -7.222
458 HB2 ASP 63 HB2 ASP 63 -1.092 13.539 -7.939
459 HB3 ASP 63 HB1 ASP 63 0.326 12.506 -7.856
460 H VAL 64 HN VAL 64 0.711 10.556 -6.571
461 HA VAL 64 HA VAL 64 0.720 8.431 -8.406
462 HB VAL 64 HB VAL 64 2.419 8.856 -5.926
463 HG11 VAL 64 HG11 VAL 64 2.876 7.032 -8.289
464 HG12 VAL 64 HG12 VAL 64 2.506 6.527 -6.641
465 HG13 VAL 64 HG13 VAL 64 4.028 7.350 -6.993
466 HG21 VAL 64 HG21 VAL 64 2.910 9.540 -8.823
467 HG22 VAL 64 HG22 VAL 64 4.089 9.697 -7.519
468 HG23 VAL 64 HG23 VAL 64 2.632 10.680 -7.503
469 H ALA 65 HN ALA 65 0.136 8.474 -4.869
470 HA ALA 65 HA ALA 65 -0.169 5.773 -4.388
471 HB1 ALA 65 HB1 ALA 65 -0.073 7.496 -2.608
472 HB2 ALA 65 HB2 ALA 65 -1.453 6.415 -2.415
473 HB3 ALA 65 HB3 ALA 65 -1.687 8.027 -3.077
474 H GLY 66 HN GLY 66 -2.610 8.117 -5.458
475 HA2 GLY 66 HA2 GLY 66 -4.726 6.171 -5.253
476 HA3 GLY 66 HA1 GLY 66 -4.878 7.816 -5.845
477 H ARG 67 HN ARG 67 -2.419 5.965 -7.400
478 HA ARG 67 HA ARG 67 -4.213 5.672 -9.702
479 HB2 ARG 67 HB2 ARG 67 -1.221 5.734 -9.591
480 HB3 ARG 67 HB1 ARG 67 -2.197 5.591 -11.035
481 HG2 ARG 67 HG2 ARG 67 -3.084 7.819 -10.662
482 HG3 ARG 67 HG1 ARG 67 -2.146 7.938 -9.163
483 HD2 ARG 67 HD2 ARG 67 -1.120 7.737 -11.980
484 HD3 ARG 67 HD1 ARG 67 -0.923 9.074 -10.848
485 HE ARG 67 HE ARG 67 0.149 6.812 -9.680
486 HH11 ARG 67 HH11 ARG 67 0.897 9.081 -12.278
487 HH12 ARG 67 HH12 ARG 67 2.493 8.549 -12.502
488 HH21 ARG 67 HH21 ARG 67 2.436 6.137 -9.912
489 HH22 ARG 67 HH22 ARG 67 3.413 6.934 -11.057
490 H VAL 68 HN VAL 68 -2.732 3.817 -7.282
491 HA VAL 68 HA VAL 68 -1.946 1.776 -9.113
492 HB VAL 68 HB VAL 68 -1.265 0.394 -7.216
493 HG11 VAL 68 HG11 VAL 68 0.312 1.887 -8.246
494 HG12 VAL 68 HG12 VAL 68 0.606 1.857 -6.509
495 HG13 VAL 68 HG13 VAL 68 -0.230 3.227 -7.239
496 HG21 VAL 68 HG21 VAL 68 -1.185 1.396 -4.951
497 HG22 VAL 68 HG22 VAL 68 -2.831 1.116 -5.515
498 HG23 VAL 68 HG23 VAL 68 -2.158 2.745 -5.540
499 H ASP 69 HN ASP 69 -2.659 -0.338 -9.219
500 HA ASP 69 HA ASP 69 -5.565 -0.566 -8.825
501 HB2 ASP 69 HB2 ASP 69 -4.702 -0.877 -11.126
502 HB3 ASP 69 HB1 ASP 69 -3.613 -2.096 -10.538
503 H THR 70 HN THR 70 -2.551 -2.242 -8.395
504 HA THR 70 HA THR 70 -3.852 -4.083 -6.503
505 HB THR 70 HB THR 70 -2.176 -5.768 -7.299
506 HG1 THR 70 HG1 THR 70 -1.590 -3.629 -9.120
507 HG21 THR 70 HG21 THR 70 -3.259 -6.191 -9.479
508 HG22 THR 70 HG22 THR 70 -3.890 -4.536 -9.459
509 HG23 THR 70 HG23 THR 70 -4.450 -5.698 -8.267
510 HA PRO 71 HA PRO 71 -0.957 -2.780 -3.330
511 HB2 PRO 71 HB2 PRO 71 -0.554 -5.707 -2.885
512 HB3 PRO 71 HB1 PRO 71 -0.916 -4.432 -1.717
513 HG2 PRO 71 HG2 PRO 71 -2.818 -6.073 -2.491
514 HG3 PRO 71 HG1 PRO 71 -3.160 -4.332 -2.335
515 HD2 PRO 71 HD2 PRO 71 -2.696 -5.970 -4.797
516 HD3 PRO 71 HD1 PRO 71 -3.847 -4.651 -4.536
517 H ARG 72 HN ARG 72 0.030 -5.304 -5.576
518 HA ARG 72 HA ARG 72 2.786 -5.181 -5.013
519 HB2 ARG 72 HB2 ARG 72 3.026 -6.020 -7.476
520 HB3 ARG 72 HB1 ARG 72 2.347 -7.058 -6.233
521 HG2 ARG 72 HG2 ARG 72 0.113 -6.602 -7.028
522 HG3 ARG 72 HG1 ARG 72 0.747 -5.441 -8.199
523 HD2 ARG 72 HD2 ARG 72 1.783 -8.230 -8.228
524 HD3 ARG 72 HD1 ARG 72 0.172 -7.923 -8.878
525 HE ARG 72 HE ARG 72 1.058 -6.641 -10.543
526 HH11 ARG 72 HH11 ARG 72 3.789 -7.765 -8.454
527 HH12 ARG 72 HH12 ARG 72 4.923 -7.482 -9.673
528 HH21 ARG 72 HH21 ARG 72 2.721 -6.340 -12.165
529 HH22 ARG 72 HH22 ARG 72 4.348 -6.625 -11.762
530 H GLU 73 HN GLU 73 0.839 -3.045 -6.883
531 HA GLU 73 HA GLU 73 3.060 -1.762 -8.157
532 HB2 GLU 73 HB2 GLU 73 0.211 -0.919 -7.729
533 HB3 GLU 73 HB1 GLU 73 1.370 -0.052 -8.725
534 HG2 GLU 73 HG2 GLU 73 1.515 -1.849 -10.267
535 HG3 GLU 73 HG1 GLU 73 0.596 -2.903 -9.186
536 H LEU 74 HN LEU 74 1.047 -1.232 -5.340
537 HA LEU 74 HA LEU 74 1.978 1.254 -4.401
538 HB2 LEU 74 HB2 LEU 74 0.109 -0.438 -3.569
539 HB3 LEU 74 HB1 LEU 74 1.459 -1.063 -2.620
540 HG LEU 74 HG LEU 74 0.230 1.704 -2.393
541 HD11 LEU 74 HD11 LEU 74 -0.496 0.950 -0.187
542 HD12 LEU 74 HD12 LEU 74 0.119 -0.661 -0.555
543 HD13 LEU 74 HD13 LEU 74 -1.209 0.012 -1.498
544 HD21 LEU 74 HD21 LEU 74 2.423 0.462 -0.723
545 HD22 LEU 74 HD22 LEU 74 1.661 2.023 -0.430
546 HD23 LEU 74 HD23 LEU 74 2.635 1.771 -1.880
547 H LEU 75 HN LEU 75 2.929 -2.057 -3.812
548 HA LEU 75 HA LEU 75 5.047 -1.904 -2.085
549 HB2 LEU 75 HB2 LEU 75 3.814 -3.876 -2.803
550 HB3 LEU 75 HB1 LEU 75 4.482 -3.728 -4.405
551 HG LEU 75 HG LEU 75 6.700 -4.100 -3.417
552 HD11 LEU 75 HD11 LEU 75 6.782 -5.179 -1.195
553 HD12 LEU 75 HD12 LEU 75 5.059 -4.856 -1.001
554 HD13 LEU 75 HD13 LEU 75 6.203 -3.512 -1.113
555 HD21 LEU 75 HD21 LEU 75 4.630 -6.245 -3.093
556 HD22 LEU 75 HD22 LEU 75 6.373 -6.525 -3.230
557 HD23 LEU 75 HD23 LEU 75 5.470 -5.805 -4.577
558 H ASP 76 HN ASP 76 4.992 -1.684 -5.605
559 HA ASP 76 HA ASP 76 7.798 -1.573 -6.022
560 HB2 ASP 76 HB2 ASP 76 6.215 -2.262 -7.778
561 HB3 ASP 76 HB1 ASP 76 5.527 -0.648 -7.797
562 H LEU 77 HN LEU 77 5.275 0.810 -5.609
563 HA LEU 77 HA LEU 77 6.721 3.163 -6.152
564 HB2 LEU 77 HB2 LEU 77 4.480 2.739 -4.194
565 HB3 LEU 77 HB1 LEU 77 5.051 4.296 -4.736
566 HG LEU 77 HG LEU 77 3.666 2.208 -6.391
567 HD11 LEU 77 HD11 LEU 77 1.865 3.901 -6.497
568 HD12 LEU 77 HD12 LEU 77 2.796 4.900 -5.362
569 HD13 LEU 77 HD13 LEU 77 2.180 3.331 -4.859
570 HD21 LEU 77 HD21 LEU 77 3.689 3.852 -8.190
571 HD22 LEU 77 HD22 LEU 77 5.348 3.460 -7.697
572 HD23 LEU 77 HD23 LEU 77 4.596 4.968 -7.173
573 H ILE 78 HN ILE 78 6.151 1.376 -3.177
574 HA ILE 78 HA ILE 78 7.501 2.992 -1.343
575 HB ILE 78 HB ILE 78 7.197 -0.030 -1.367
576 HG12 ILE 78 HG12 ILE 78 5.059 1.184 -1.327
577 HG13 ILE 78 HG11 ILE 78 5.340 0.319 0.182
578 HG21 ILE 78 HG21 ILE 78 9.034 0.566 0.113
579 HG22 ILE 78 HG22 ILE 78 7.640 0.034 1.059
580 HG23 ILE 78 HG23 ILE 78 8.014 1.755 0.928
581 HD11 ILE 78 HD11 ILE 78 4.389 2.508 0.599
582 HD12 ILE 78 HD12 ILE 78 5.714 3.274 -0.278
583 HD13 ILE 78 HD13 ILE 78 6.035 2.427 1.236
584 H ASN 79 HN ASN 79 8.685 0.012 -2.866
585 HA ASN 79 HA ASN 79 11.307 0.216 -2.008
586 HB2 ASN 79 HB2 ASN 79 10.206 -1.180 -4.446
587 HB3 ASN 79 HB1 ASN 79 11.862 -1.377 -3.891
588 HD21 ASN 79 HD21 ASN 79 9.936 -3.429 -4.106
589 HD22 ASN 79 HD22 ASN 79 9.636 -4.066 -2.521
590 H GLY 80 HN GLY 80 9.864 1.475 -4.949
591 HA2 GLY 80 HA2 GLY 80 12.181 2.416 -6.210
592 HA3 GLY 80 HA1 GLY 80 10.569 3.078 -6.411
593 H ALA 81 HN ALA 81 10.169 3.951 -3.739
594 HA ALA 81 HA ALA 81 11.700 6.406 -3.794
595 HB1 ALA 81 HB1 ALA 81 9.598 5.468 -1.831
596 HB2 ALA 81 HB2 ALA 81 9.305 6.433 -3.277
597 HB3 ALA 81 HB3 ALA 81 10.260 7.100 -1.949
598 H LEU 82 HN LEU 82 11.566 3.462 -1.902
599 HA LEU 82 HA LEU 82 13.013 4.264 0.327
600 HB2 LEU 82 HB2 LEU 82 11.601 2.292 0.191
601 HB3 LEU 82 HB1 LEU 82 12.672 1.599 -1.003
602 HG LEU 82 HG LEU 82 14.429 1.503 0.627
603 HD11 LEU 82 HD11 LEU 82 12.318 2.455 2.593
604 HD12 LEU 82 HD12 LEU 82 13.791 3.312 2.133
605 HD13 LEU 82 HD13 LEU 82 13.893 1.805 3.045
606 HD21 LEU 82 HD21 LEU 82 11.873 0.163 1.468
607 HD22 LEU 82 HD22 LEU 82 13.495 -0.364 1.926
608 HD23 LEU 82 HD23 LEU 82 12.995 -0.408 0.238
609 H ALA 83 HN ALA 83 13.975 3.062 -2.818
610 HA ALA 83 HA ALA 83 16.678 2.561 -2.297
611 HB1 ALA 83 HB1 ALA 83 15.515 1.790 -4.305
612 HB2 ALA 83 HB2 ALA 83 16.985 2.690 -4.709
613 HB3 ALA 83 HB3 ALA 83 15.407 3.458 -4.875
614 H GLU 84 HN GLU 84 14.992 5.578 -2.534
615 HA GLU 84 HA GLU 84 17.316 7.136 -3.177
616 HB2 GLU 84 HB2 GLU 84 14.459 7.812 -2.516
617 HB3 GLU 84 HB1 GLU 84 15.692 8.971 -2.963
618 HG2 GLU 84 HG2 GLU 84 14.775 6.698 -4.716
619 HG3 GLU 84 HG1 GLU 84 14.165 8.345 -4.812
620 H ALA 85 HN ALA 85 16.174 5.642 -0.440
621 HA ALA 85 HA ALA 85 17.164 7.793 1.289
622 HB1 ALA 85 HB1 ALA 85 14.719 7.617 1.426
623 HB2 ALA 85 HB2 ALA 85 15.515 7.226 2.955
624 HB3 ALA 85 HB3 ALA 85 14.879 5.934 1.932
625 H ALA 86 HN ALA 86 16.395 4.282 1.342
626 HA ALA 86 HA ALA 86 18.891 3.882 2.780
627 HB1 ALA 86 HB1 ALA 86 17.790 2.271 4.258
628 HB2 ALA 86 HB2 ALA 86 16.236 2.626 3.502
629 HB3 ALA 86 HB3 ALA 86 17.074 3.873 4.428
630 H28A SDO 101 H28A SDO 42 -10.093 11.976 -1.807
631 H28B SDO 101 H28B SDO 42 -9.007 10.595 -1.698
632 H30A SDO 101 H30A SDO 42 -7.158 12.150 -1.369
633 H30B SDO 101 H30B SDO 42 -8.266 13.520 -1.526
634 H30C SDO 101 H30C SDO 42 -6.814 13.430 -2.533
635 H31A SDO 101 H31A SDO 42 -8.026 10.553 -4.549
636 H31B SDO 101 H31B SDO 42 -6.985 10.469 -3.139
637 H31C SDO 101 H31C SDO 42 -6.700 11.698 -4.374
638 H32A SDO 101 H32A SDO 42 -9.550 12.583 -4.907
639 H33A SDO 101 H33A SDO 42 -8.026 14.755 -4.582
640 H36A SDO 101 H36A SDO 42 -11.215 12.881 -2.972
641 H37A SDO 101 H37A SDO 42 -11.507 15.737 -2.199
642 H37B SDO 101 H37B SDO 42 -12.805 14.831 -2.940
643 H38A SDO 101 H38A SDO 42 -13.279 14.876 -0.673
644 H38B SDO 101 H38B SDO 42 -12.727 13.216 -1.016
645 H41A SDO 101 H41A SDO 42 -10.129 15.301 -1.014
646 H42A SDO 101 H42A SDO 42 -9.620 15.739 1.746
647 H42B SDO 101 H42B SDO 42 -8.809 14.299 1.163
648 H43A SDO 101 H43A SDO 42 -8.474 17.084 0.110
649 H43B SDO 101 H43B SDO 42 -7.871 15.653 -0.670
650 H1A SDO 101 H1A SDO 42 -5.568 14.561 2.652
651 H1B SDO 101 H1B SDO 42 -6.168 15.967 3.507
652 H2A SDO 101 H2A SDO 42 -7.836 13.760 2.410
653 H2B SDO 101 H2B SDO 42 -8.436 15.123 3.305
654 H4A SDO 101 H4A SDO 42 -6.069 12.448 5.649
655 H4B SDO 101 H4B SDO 42 -6.614 13.870 6.505
656 H5A SDO 101 H5A SDO 42 -5.161 15.305 5.339
657 H5B SDO 101 H5B SDO 42 -4.701 14.039 4.204
658 H6A SDO 101 H6A SDO 42 -2.896 14.177 5.699
659 H6B SDO 101 H6B SDO 42 -3.786 12.758 6.186
660 H8A SDO 101 H8A SDO 42 -5.947 14.716 7.810
661 H8B SDO 101 H8B SDO 42 -4.962 16.170 7.615
662 H8C SDO 101 H8C SDO 42 -4.976 15.302 9.164
Start of MODEL 11
1 H1 MET 1 HT1 MET 1 19.831 -0.522 -1.106
2 H2 MET 1 HT2 MET 1 20.287 -0.996 0.453
3 H3 MET 1 HT3 MET 1 19.294 0.361 0.217
4 HA MET 1 HA MET 1 17.512 -0.909 -0.594
5 HB2 MET 1 HB2 MET 1 19.302 -3.284 -0.042
6 HB3 MET 1 HB1 MET 1 17.588 -3.389 -0.414
7 HG2 MET 1 HG2 MET 1 18.010 -2.426 -2.615
8 HG3 MET 1 HG1 MET 1 19.728 -2.317 -2.237
9 HE1 MET 1 HE1 MET 1 17.418 -6.302 -2.671
10 HE2 MET 1 HE2 MET 1 16.698 -4.717 -2.958
11 HE3 MET 1 HE3 MET 1 17.170 -5.184 -1.324
12 H ALA 2 HN ALA 2 19.672 -1.995 2.015
13 HA ALA 2 HA ALA 2 19.510 -2.215 4.180
14 HB1 ALA 2 HB1 ALA 2 17.953 -0.882 5.501
15 HB2 ALA 2 HB2 ALA 2 17.005 -0.525 4.058
16 HB3 ALA 2 HB3 ALA 2 18.649 0.096 4.205
17 H THR 3 HN THR 3 16.081 -2.252 3.430
18 HA THR 3 HA THR 3 15.903 -5.065 3.786
19 HB THR 3 HB THR 3 15.945 -4.447 6.129
20 HG1 THR 3 HG1 THR 3 13.332 -5.235 5.307
21 HG21 THR 3 HG21 THR 3 15.317 -2.110 6.056
22 HG22 THR 3 HG22 THR 3 14.265 -2.951 7.197
23 HG23 THR 3 HG23 THR 3 13.667 -2.527 5.592
24 H LEU 4 HN LEU 4 15.027 -5.130 1.796
25 HA LEU 4 HA LEU 4 13.228 -3.161 0.876
26 HB2 LEU 4 HB2 LEU 4 14.797 -4.478 -0.566
27 HB3 LEU 4 HB1 LEU 4 13.736 -5.860 -0.365
28 HG LEU 4 HG LEU 4 11.907 -4.549 -1.413
29 HD11 LEU 4 HD11 LEU 4 12.704 -2.316 -0.893
30 HD12 LEU 4 HD12 LEU 4 12.469 -2.497 -2.630
31 HD13 LEU 4 HD13 LEU 4 14.098 -2.542 -1.948
32 HD21 LEU 4 HD21 LEU 4 13.204 -6.101 -2.765
33 HD22 LEU 4 HD22 LEU 4 14.427 -4.863 -3.044
34 HD23 LEU 4 HD23 LEU 4 12.809 -4.663 -3.709
35 H LEU 5 HN LEU 5 11.266 -2.951 1.274
36 HA LEU 5 HA LEU 5 9.630 -4.593 2.848
37 HB2 LEU 5 HB2 LEU 5 9.655 -2.033 2.233
38 HB3 LEU 5 HB1 LEU 5 8.646 -2.524 0.901
39 HG LEU 5 HG LEU 5 7.369 -1.575 2.756
40 HD11 LEU 5 HD11 LEU 5 6.234 -3.179 1.375
41 HD12 LEU 5 HD12 LEU 5 5.706 -3.316 3.053
42 HD13 LEU 5 HD13 LEU 5 6.831 -4.497 2.381
43 HD21 LEU 5 HD21 LEU 5 8.814 -2.184 4.573
44 HD22 LEU 5 HD22 LEU 5 8.441 -3.889 4.335
45 HD23 LEU 5 HD23 LEU 5 7.182 -2.773 4.876
46 H THR 6 HN THR 6 8.716 -6.556 2.179
47 HA THR 6 HA THR 6 7.920 -6.699 -0.601
48 HB THR 6 HB THR 6 8.188 -9.200 -0.457
49 HG1 THR 6 HG1 THR 6 8.953 -8.546 2.130
50 HG21 THR 6 HG21 THR 6 10.627 -9.181 -0.729
51 HG22 THR 6 HG22 THR 6 10.697 -7.569 -0.023
52 HG23 THR 6 HG23 THR 6 9.877 -7.823 -1.567
53 H THR 7 HN THR 7 6.398 -9.024 -0.558
54 HA THR 7 HA THR 7 3.895 -8.097 -0.157
55 HB THR 7 HB THR 7 4.675 -10.997 0.040
56 HG1 THR 7 HG1 THR 7 5.396 -10.896 -2.010
57 HG21 THR 7 HG21 THR 7 2.500 -9.502 -1.443
58 HG22 THR 7 HG22 THR 7 2.280 -10.375 0.068
59 HG23 THR 7 HG23 THR 7 2.702 -11.255 -1.405
60 H ASP 8 HN ASP 8 5.606 -10.436 2.002
61 HA ASP 8 HA ASP 8 3.670 -10.691 4.025
62 HB2 ASP 8 HB2 ASP 8 6.692 -10.808 4.278
63 HB3 ASP 8 HB1 ASP 8 5.613 -11.141 5.617
64 H ASP 9 HN ASP 9 6.365 -8.460 3.806
65 HA ASP 9 HA ASP 9 6.076 -7.089 6.232
66 HB2 ASP 9 HB2 ASP 9 7.035 -5.882 3.631
67 HB3 ASP 9 HB1 ASP 9 7.436 -5.359 5.255
68 H LEU 10 HN LEU 10 4.879 -6.408 2.992
69 HA LEU 10 HA LEU 10 3.539 -3.999 3.482
70 HB2 LEU 10 HB2 LEU 10 4.052 -4.816 1.229
71 HB3 LEU 10 HB1 LEU 10 2.901 -6.123 1.440
72 HG LEU 10 HG LEU 10 1.109 -4.381 1.686
73 HD11 LEU 10 HD11 LEU 10 1.554 -2.137 0.821
74 HD12 LEU 10 HD12 LEU 10 3.270 -2.532 0.714
75 HD13 LEU 10 HD13 LEU 10 2.468 -2.488 2.286
76 HD21 LEU 10 HD21 LEU 10 0.947 -3.933 -0.726
77 HD22 LEU 10 HD22 LEU 10 1.387 -5.605 -0.391
78 HD23 LEU 10 HD23 LEU 10 2.618 -4.463 -0.931
79 H ARG 11 HN ARG 11 2.415 -7.341 3.569
80 HA ARG 11 HA ARG 11 -0.299 -6.820 3.852
81 HB2 ARG 11 HB2 ARG 11 0.586 -9.054 3.285
82 HB3 ARG 11 HB1 ARG 11 1.198 -9.222 4.922
83 HG2 ARG 11 HG2 ARG 11 -0.940 -9.436 5.829
84 HG3 ARG 11 HG1 ARG 11 -1.715 -8.745 4.407
85 HD2 ARG 11 HD2 ARG 11 -2.140 -11.098 4.409
86 HD3 ARG 11 HD1 ARG 11 -1.012 -10.736 3.119
87 HE ARG 11 HE ARG 11 -0.097 -11.770 5.698
88 HH11 ARG 11 HH11 ARG 11 -0.298 -12.085 2.161
89 HH12 ARG 11 HH12 ARG 11 0.602 -13.522 2.072
90 HH21 ARG 11 HH21 ARG 11 1.076 -13.850 5.576
91 HH22 ARG 11 HH22 ARG 11 1.339 -14.544 4.027
92 H ARG 12 HN ARG 12 2.183 -6.945 6.282
93 HA ARG 12 HA ARG 12 0.566 -6.954 8.580
94 HB2 ARG 12 HB2 ARG 12 3.239 -5.597 8.187
95 HB3 ARG 12 HB1 ARG 12 2.488 -5.943 9.739
96 HG2 ARG 12 HG2 ARG 12 2.654 -8.318 9.326
97 HG3 ARG 12 HG1 ARG 12 3.311 -8.008 7.719
98 HD2 ARG 12 HD2 ARG 12 5.233 -6.883 8.733
99 HD3 ARG 12 HD1 ARG 12 4.573 -7.209 10.335
100 HE ARG 12 HE ARG 12 4.660 -9.633 9.135
101 HH11 ARG 12 HH11 ARG 12 7.141 -7.136 9.813
102 HH12 ARG 12 HH12 ARG 12 8.411 -8.259 9.973
103 HH21 ARG 12 HH21 ARG 12 6.451 -11.151 9.363
104 HH22 ARG 12 HH22 ARG 12 8.019 -10.565 9.711
105 H ALA 13 HN ALA 13 1.860 -4.239 6.709
106 HA ALA 13 HA ALA 13 0.600 -2.253 8.357
107 HB1 ALA 13 HB1 ALA 13 2.709 -1.768 7.194
108 HB2 ALA 13 HB2 ALA 13 1.430 -0.645 6.714
109 HB3 ALA 13 HB3 ALA 13 1.886 -1.964 5.644
110 H LEU 14 HN LEU 14 -0.081 -3.836 5.305
111 HA LEU 14 HA LEU 14 -2.224 -2.165 4.611
112 HB2 LEU 14 HB2 LEU 14 -0.883 -3.600 3.029
113 HB3 LEU 14 HB1 LEU 14 -1.710 -4.992 3.668
114 HG LEU 14 HG LEU 14 -3.837 -4.196 2.778
115 HD11 LEU 14 HD11 LEU 14 -3.929 -2.192 1.371
116 HD12 LEU 14 HD12 LEU 14 -2.241 -1.852 1.743
117 HD13 LEU 14 HD13 LEU 14 -3.454 -1.787 3.023
118 HD21 LEU 14 HD21 LEU 14 -2.390 -5.531 1.320
119 HD22 LEU 14 HD22 LEU 14 -1.623 -4.055 0.732
120 HD23 LEU 14 HD23 LEU 14 -3.329 -4.358 0.396
121 H VAL 15 HN VAL 15 -1.982 -4.805 6.815
122 HA VAL 15 HA VAL 15 -4.844 -5.088 7.046
123 HB VAL 15 HB VAL 15 -2.601 -6.039 8.891
124 HG11 VAL 15 HG11 VAL 15 -4.310 -7.349 10.073
125 HG12 VAL 15 HG12 VAL 15 -5.569 -6.605 9.088
126 HG13 VAL 15 HG13 VAL 15 -4.634 -5.622 10.216
127 HG21 VAL 15 HG21 VAL 15 -3.218 -8.256 8.084
128 HG22 VAL 15 HG22 VAL 15 -2.763 -7.202 6.745
129 HG23 VAL 15 HG23 VAL 15 -4.465 -7.539 7.061
130 H GLU 16 HN GLU 16 -2.280 -3.382 8.819
131 HA GLU 16 HA GLU 16 -3.752 -2.301 10.924
132 HB2 GLU 16 HB2 GLU 16 -1.514 -0.964 9.434
133 HB3 GLU 16 HB1 GLU 16 -2.089 -0.534 11.033
134 HG2 GLU 16 HG2 GLU 16 -1.410 -2.819 11.779
135 HG3 GLU 16 HG1 GLU 16 -0.684 -3.036 10.191
136 H SER 17 HN SER 17 -3.426 -1.201 7.623
137 HA SER 17 HA SER 17 -4.540 1.368 8.002
138 HB2 SER 17 HB2 SER 17 -3.035 0.803 6.132
139 HB3 SER 17 HB1 SER 17 -4.270 -0.257 5.465
140 HG SER 17 HG SER 17 -5.593 1.791 5.585
141 H ALA 18 HN ALA 18 -6.012 -1.740 7.765
142 HA ALA 18 HA ALA 18 -8.499 -0.656 6.810
143 HB1 ALA 18 HB1 ALA 18 -9.375 -2.889 7.014
144 HB2 ALA 18 HB2 ALA 18 -7.882 -3.430 7.800
145 HB3 ALA 18 HB3 ALA 18 -7.859 -2.908 6.105
146 H GLY 19 HN GLY 19 -8.814 0.791 8.330
147 HA2 GLY 19 HA2 GLY 19 -9.493 -0.146 11.042
148 HA3 GLY 19 HA1 GLY 19 -9.204 1.535 10.587
149 H GLU 20 HN GLU 20 -10.776 2.309 8.808
150 HA GLU 20 HA GLU 20 -13.421 1.405 9.562
151 HB2 GLU 20 HB2 GLU 20 -14.113 3.847 9.105
152 HB3 GLU 20 HB1 GLU 20 -13.277 3.500 10.608
153 HG2 GLU 20 HG2 GLU 20 -11.179 4.297 9.601
154 HG3 GLU 20 HG1 GLU 20 -12.063 4.701 8.131
155 H THR 21 HN THR 21 -13.772 0.101 8.001
156 HA THR 21 HA THR 21 -14.742 0.761 5.590
157 HB THR 21 HB THR 21 -12.405 1.521 5.047
158 HG1 THR 21 HG1 THR 21 -12.204 -0.003 3.118
159 HG21 THR 21 HG21 THR 21 -11.664 -1.401 5.403
160 HG22 THR 21 HG22 THR 21 -11.079 -0.052 6.376
161 HG23 THR 21 HG23 THR 21 -10.613 -0.184 4.684
162 H ASP 22 HN ASP 22 -13.804 -1.639 4.200
163 HA ASP 22 HA ASP 22 -14.978 -3.669 5.940
164 HB2 ASP 22 HB2 ASP 22 -15.633 -3.597 3.574
165 HB3 ASP 22 HB1 ASP 22 -13.969 -3.920 3.089
166 H GLY 23 HN GLY 23 -13.688 -4.591 7.334
167 HA2 GLY 23 HA2 GLY 23 -10.874 -4.567 6.883
168 HA3 GLY 23 HA1 GLY 23 -11.663 -5.217 8.341
169 H THR 24 HN THR 24 -10.353 -5.870 5.247
170 HA THR 24 HA THR 24 -11.501 -8.420 4.873
171 HB THR 24 HB THR 24 -9.601 -8.482 3.092
172 HG1 THR 24 HG1 THR 24 -9.592 -5.757 2.982
173 HG21 THR 24 HG21 THR 24 -11.978 -8.163 2.572
174 HG22 THR 24 HG22 THR 24 -10.974 -7.092 1.587
175 HG23 THR 24 HG23 THR 24 -11.837 -6.455 2.989
176 H ASP 25 HN ASP 25 -9.744 -10.115 4.090
177 HA ASP 25 HA ASP 25 -7.589 -10.386 6.030
178 HB2 ASP 25 HB2 ASP 25 -9.419 -11.860 6.800
179 HB3 ASP 25 HB1 ASP 25 -9.497 -12.607 5.205
180 H LEU 26 HN LEU 26 -5.790 -10.580 4.965
181 HA LEU 26 HA LEU 26 -5.920 -10.813 2.063
182 HB2 LEU 26 HB2 LEU 26 -3.918 -9.712 4.006
183 HB3 LEU 26 HB1 LEU 26 -3.535 -9.948 2.322
184 HG LEU 26 HG LEU 26 -5.214 -8.272 1.680
185 HD11 LEU 26 HD11 LEU 26 -6.837 -8.557 3.495
186 HD12 LEU 26 HD12 LEU 26 -6.334 -6.880 3.312
187 HD13 LEU 26 HD13 LEU 26 -5.687 -7.856 4.637
188 HD21 LEU 26 HD21 LEU 26 -4.097 -6.326 2.620
189 HD22 LEU 26 HD22 LEU 26 -2.969 -7.577 2.103
190 HD23 LEU 26 HD23 LEU 26 -3.322 -7.364 3.817
191 H SER 27 HN SER 27 -6.119 -13.260 3.455
192 HA SER 27 HA SER 27 -3.445 -14.395 3.421
193 HB2 SER 27 HB2 SER 27 -6.077 -15.787 4.012
194 HB3 SER 27 HB1 SER 27 -4.462 -16.417 4.335
195 HG SER 27 HG SER 27 -5.991 -14.573 5.643
196 H GLY 28 HN GLY 28 -2.620 -15.310 1.712
197 HA2 GLY 28 HA2 GLY 28 -2.836 -16.871 -0.134
198 HA3 GLY 28 HA1 GLY 28 -4.422 -16.156 -0.454
199 H ASP 29 HN ASP 29 -4.147 -15.176 -2.396
200 HA ASP 29 HA ASP 29 -1.824 -13.408 -2.567
201 HB2 ASP 29 HB2 ASP 29 -2.039 -14.966 -4.500
202 HB3 ASP 29 HB1 ASP 29 -3.591 -14.223 -4.889
203 H PHE 30 HN PHE 30 -2.178 -11.542 -1.967
204 HA PHE 30 HA PHE 30 -4.719 -10.211 -2.653
205 HB2 PHE 30 HB2 PHE 30 -4.364 -8.764 -0.737
206 HB3 PHE 30 HB1 PHE 30 -4.232 -10.434 -0.193
207 HD1 PHE 30 HD2 PHE 30 -1.970 -11.376 0.333
208 HD2 PHE 30 HD1 PHE 30 -2.545 -7.262 -0.602
209 HE1 PHE 30 HE2 PHE 30 0.240 -10.853 1.243
210 HE2 PHE 30 HE1 PHE 30 -0.339 -6.733 0.314
211 HZ PHE 30 HZ PHE 30 1.062 -8.532 1.240
212 H LEU 31 HN LEU 31 -1.637 -10.571 -3.602
213 HA LEU 31 HA LEU 31 -0.769 -7.827 -3.641
214 HB2 LEU 31 HB2 LEU 31 0.737 -9.793 -3.232
215 HB3 LEU 31 HB1 LEU 31 0.531 -10.229 -4.914
216 HG LEU 31 HG LEU 31 1.540 -8.027 -5.542
217 HD11 LEU 31 HD11 LEU 31 2.770 -6.787 -3.834
218 HD12 LEU 31 HD12 LEU 31 2.126 -7.856 -2.589
219 HD13 LEU 31 HD13 LEU 31 1.033 -6.809 -3.500
220 HD21 LEU 31 HD21 LEU 31 2.886 -10.071 -5.505
221 HD22 LEU 31 HD22 LEU 31 3.251 -9.807 -3.798
222 HD23 LEU 31 HD23 LEU 31 3.838 -8.668 -5.010
223 H ASP 32 HN ASP 32 -2.062 -10.215 -5.912
224 HA ASP 32 HA ASP 32 -1.808 -8.272 -8.091
225 HB2 ASP 32 HB2 ASP 32 -1.094 -10.738 -8.276
226 HB3 ASP 32 HB1 ASP 32 -2.819 -11.104 -8.276
227 H LEU 33 HN LEU 33 -3.780 -8.957 -5.703
228 HA LEU 33 HA LEU 33 -6.354 -8.935 -6.987
229 HB2 LEU 33 HB2 LEU 33 -5.798 -10.038 -4.772
230 HB3 LEU 33 HB1 LEU 33 -5.605 -8.449 -4.085
231 HG LEU 33 HG LEU 33 -8.003 -8.011 -4.393
232 HD11 LEU 33 HD11 LEU 33 -9.495 -9.792 -5.160
233 HD12 LEU 33 HD12 LEU 33 -8.107 -10.826 -5.480
234 HD13 LEU 33 HD13 LEU 33 -8.341 -9.356 -6.423
235 HD21 LEU 33 HD21 LEU 33 -7.224 -9.073 -2.315
236 HD22 LEU 33 HD22 LEU 33 -7.407 -10.656 -3.041
237 HD23 LEU 33 HD23 LEU 33 -8.826 -9.653 -2.754
238 H ARG 34 HN ARG 34 -7.872 -6.973 -6.135
239 HA ARG 34 HA ARG 34 -6.284 -4.588 -6.826
240 HB2 ARG 34 HB2 ARG 34 -9.233 -5.027 -7.315
241 HB3 ARG 34 HB1 ARG 34 -8.282 -3.644 -7.845
242 HG2 ARG 34 HG2 ARG 34 -6.924 -5.152 -9.247
243 HG3 ARG 34 HG1 ARG 34 -7.967 -6.494 -8.765
244 HD2 ARG 34 HD2 ARG 34 -8.693 -5.695 -10.901
245 HD3 ARG 34 HD1 ARG 34 -9.898 -5.235 -9.700
246 HE ARG 34 HE ARG 34 -7.840 -3.286 -10.319
247 HH11 ARG 34 HH11 ARG 34 -11.194 -4.304 -10.769
248 HH12 ARG 34 HH12 ARG 34 -11.696 -2.848 -11.470
249 HH21 ARG 34 HH21 ARG 34 -8.499 -1.309 -11.291
250 HH22 ARG 34 HH22 ARG 34 -10.124 -1.110 -11.838
251 H PHE 35 HN PHE 35 -6.635 -2.639 -5.747
252 HA PHE 35 HA PHE 35 -7.137 -2.828 -3.024
253 HB2 PHE 35 HB2 PHE 35 -6.965 -0.429 -4.811
254 HB3 PHE 35 HB1 PHE 35 -7.411 -0.251 -3.121
255 HD1 PHE 35 HD2 PHE 35 -5.816 -1.254 -1.384
256 HD2 PHE 35 HD1 PHE 35 -4.714 -0.487 -5.419
257 HE1 PHE 35 HE2 PHE 35 -3.454 -1.239 -0.725
258 HE2 PHE 35 HE1 PHE 35 -2.346 -0.464 -4.766
259 HZ PHE 35 HZ PHE 35 -1.712 -0.841 -2.416
260 H GLU 36 HN GLU 36 -9.439 -2.031 -5.549
261 HA GLU 36 HA GLU 36 -11.433 -1.078 -3.822
262 HB2 GLU 36 HB2 GLU 36 -13.047 -1.537 -5.626
263 HB3 GLU 36 HB1 GLU 36 -11.621 -0.708 -6.219
264 HG2 GLU 36 HG2 GLU 36 -10.793 -2.680 -7.245
265 HG3 GLU 36 HG1 GLU 36 -11.984 -3.682 -6.422
266 H ASP 37 HN ASP 37 -10.471 -4.338 -4.620
267 HA ASP 37 HA ASP 37 -12.920 -5.505 -3.622
268 HB2 ASP 37 HB2 ASP 37 -11.604 -6.500 -5.527
269 HB3 ASP 37 HB1 ASP 37 -10.364 -6.926 -4.364
270 H ILE 38 HN ILE 38 -9.811 -4.706 -2.382
271 HA ILE 38 HA ILE 38 -10.295 -6.361 -0.046
272 HB ILE 38 HB ILE 38 -8.074 -5.545 0.809
273 HG12 ILE 38 HG12 ILE 38 -7.814 -4.419 -1.992
274 HG13 ILE 38 HG11 ILE 38 -7.924 -3.474 -0.515
275 HG21 ILE 38 HG21 ILE 38 -8.094 -7.005 -1.820
276 HG22 ILE 38 HG22 ILE 38 -8.300 -7.698 -0.201
277 HG23 ILE 38 HG23 ILE 38 -6.759 -6.971 -0.656
278 HD11 ILE 38 HD11 ILE 38 -5.686 -5.351 -1.262
279 HD12 ILE 38 HD12 ILE 38 -5.787 -4.425 0.237
280 HD13 ILE 38 HD13 ILE 38 -5.637 -3.589 -1.310
281 H GLY 39 HN GLY 39 -11.646 -3.752 -0.867
282 HA2 GLY 39 HA2 GLY 39 -12.894 -2.311 0.384
283 HA3 GLY 39 HA1 GLY 39 -12.133 -2.962 1.827
284 H TYR 40 HN TYR 40 -10.287 -1.561 -0.855
285 HA TYR 40 HA TYR 40 -9.741 0.513 1.037
286 HB2 TYR 40 HB2 TYR 40 -7.786 -0.510 -1.067
287 HB3 TYR 40 HB1 TYR 40 -7.675 1.070 -0.356
288 HD1 TYR 40 HD2 TYR 40 -8.044 -2.472 0.754
289 HD2 TYR 40 HD1 TYR 40 -6.717 1.451 1.598
290 HE1 TYR 40 HE2 TYR 40 -7.134 -3.253 2.895
291 HE2 TYR 40 HE1 TYR 40 -5.822 0.723 3.719
292 HH TYR 40 HH TYR 40 -5.466 -2.514 4.611
293 H ASP 41 HN ASP 41 -10.491 2.190 1.009
294 HA ASP 41 HA ASP 41 -11.921 3.307 -1.242
295 HB2 ASP 41 HB2 ASP 41 -12.718 3.294 1.218
296 HB3 ASP 41 HB1 ASP 41 -11.401 4.435 1.489
297 H SER 42 HN SER 42 -11.538 5.882 -1.123
298 HA SER 42 HA SER 42 -8.987 6.284 -2.316
299 HB2 SER 42 HB2 SER 42 -11.127 7.477 -2.965
300 HB3 SER 42 HB1 SER 42 -11.011 8.375 -1.448
301 H LEU 43 HN LEU 43 -10.540 7.165 0.733
302 HA LEU 43 HA LEU 43 -8.311 8.523 1.824
303 HB2 LEU 43 HB2 LEU 43 -10.752 7.302 3.073
304 HB3 LEU 43 HB1 LEU 43 -9.476 8.006 4.044
305 HG LEU 43 HG LEU 43 -11.051 9.513 1.954
306 HD11 LEU 43 HD11 LEU 43 -11.226 9.550 4.975
307 HD12 LEU 43 HD12 LEU 43 -12.430 8.862 3.890
308 HD13 LEU 43 HD13 LEU 43 -12.116 10.599 3.871
309 HD21 LEU 43 HD21 LEU 43 -9.037 10.344 4.026
310 HD22 LEU 43 HD22 LEU 43 -9.963 11.462 3.010
311 HD23 LEU 43 HD23 LEU 43 -8.796 10.356 2.278
312 H ALA 44 HN ALA 44 -9.478 5.220 2.110
313 HA ALA 44 HA ALA 44 -7.631 4.360 4.000
314 HB1 ALA 44 HB1 ALA 44 -8.991 2.698 1.892
315 HB2 ALA 44 HB2 ALA 44 -9.671 3.132 3.464
316 HB3 ALA 44 HB3 ALA 44 -8.240 2.107 3.372
317 H LEU 45 HN LEU 45 -7.316 4.611 0.501
318 HA LEU 45 HA LEU 45 -4.924 3.161 0.185
319 HB2 LEU 45 HB2 LEU 45 -6.432 4.157 -1.635
320 HB3 LEU 45 HB1 LEU 45 -5.711 5.706 -1.287
321 HG LEU 45 HG LEU 45 -4.694 4.961 -3.274
322 HD11 LEU 45 HD11 LEU 45 -2.820 4.215 -1.128
323 HD12 LEU 45 HD12 LEU 45 -3.054 5.840 -1.791
324 HD13 LEU 45 HD13 LEU 45 -2.364 4.541 -2.802
325 HD21 LEU 45 HD21 LEU 45 -5.350 2.636 -3.260
326 HD22 LEU 45 HD22 LEU 45 -4.097 2.304 -2.026
327 HD23 LEU 45 HD23 LEU 45 -3.645 2.908 -3.628
328 H MET 46 HN MET 46 -5.545 6.553 0.973
329 HA MET 46 HA MET 46 -2.847 7.493 1.048
330 HB2 MET 46 HB2 MET 46 -5.052 8.612 2.753
331 HB3 MET 46 HB1 MET 46 -3.702 9.474 2.008
332 HG2 MET 46 HG2 MET 46 -4.718 8.871 -0.177
333 HG3 MET 46 HG1 MET 46 -6.059 8.260 0.792
334 HE1 MET 46 HE1 MET 46 -4.006 11.482 -0.183
335 HE2 MET 46 HE2 MET 46 -3.880 11.454 1.580
336 HE3 MET 46 HE3 MET 46 -4.806 12.725 0.781
337 H GLU 47 HN GLU 47 -5.103 6.418 3.413
338 HA GLU 47 HA GLU 47 -3.792 6.540 5.790
339 HB2 GLU 47 HB2 GLU 47 -5.757 5.018 4.394
340 HB3 GLU 47 HB1 GLU 47 -5.266 4.242 5.947
341 HG2 GLU 47 HG2 GLU 47 -6.335 7.028 5.464
342 HG3 GLU 47 HG1 GLU 47 -7.350 5.716 6.027
343 H THR 48 HN THR 48 -3.708 3.832 3.445
344 HA THR 48 HA THR 48 -1.819 2.208 4.710
345 HB THR 48 HB THR 48 -2.347 2.592 1.752
346 HG1 THR 48 HG1 THR 48 -3.946 1.698 3.681
347 HG21 THR 48 HG21 THR 48 -0.310 1.302 2.192
348 HG22 THR 48 HG22 THR 48 -1.579 0.290 1.504
349 HG23 THR 48 HG23 THR 48 -1.217 0.200 3.233
350 H ALA 49 HN ALA 49 -1.399 4.447 1.981
351 HA ALA 49 HA ALA 49 1.342 4.213 1.657
352 HB1 ALA 49 HB1 ALA 49 1.233 6.251 0.348
353 HB2 ALA 49 HB2 ALA 49 -0.346 6.633 1.031
354 HB3 ALA 49 HB3 ALA 49 -0.151 5.218 -0.003
355 H ALA 50 HN ALA 50 -0.427 6.586 3.615
356 HA ALA 50 HA ALA 50 1.791 8.143 4.323
357 HB1 ALA 50 HB1 ALA 50 0.386 9.076 6.063
358 HB2 ALA 50 HB2 ALA 50 -0.750 7.740 5.884
359 HB3 ALA 50 HB3 ALA 50 -0.537 8.898 4.570
360 H ARG 51 HN ARG 51 0.344 5.295 5.860
361 HA ARG 51 HA ARG 51 1.907 5.356 8.181
362 HB2 ARG 51 HB2 ARG 51 -0.052 3.832 7.998
363 HB3 ARG 51 HB1 ARG 51 0.778 2.915 6.755
364 HG2 ARG 51 HG2 ARG 51 1.337 1.548 8.424
365 HG3 ARG 51 HG1 ARG 51 2.583 2.746 8.759
366 HD2 ARG 51 HD2 ARG 51 1.554 2.224 10.779
367 HD3 ARG 51 HD1 ARG 51 0.924 3.817 10.414
368 HE ARG 51 HE ARG 51 -0.424 1.256 10.354
369 HH11 ARG 51 HH11 ARG 51 -0.679 4.790 9.988
370 HH12 ARG 51 HH12 ARG 51 -2.385 4.831 9.943
371 HH21 ARG 51 HH21 ARG 51 -2.833 1.346 10.383
372 HH22 ARG 51 HH22 ARG 51 -3.646 2.819 10.225
373 H LEU 52 HN LEU 52 2.380 3.813 5.081
374 HA LEU 52 HA LEU 52 4.817 2.538 5.674
375 HB2 LEU 52 HB2 LEU 52 3.717 3.463 3.023
376 HB3 LEU 52 HB1 LEU 52 5.073 2.367 3.228
377 HG LEU 52 HG LEU 52 2.255 1.781 4.136
378 HD11 LEU 52 HD11 LEU 52 2.401 1.861 1.717
379 HD12 LEU 52 HD12 LEU 52 2.208 0.198 2.277
380 HD13 LEU 52 HD13 LEU 52 3.789 0.778 1.750
381 HD21 LEU 52 HD21 LEU 52 3.093 -0.496 4.441
382 HD22 LEU 52 HD22 LEU 52 3.955 0.650 5.466
383 HD23 LEU 52 HD23 LEU 52 4.710 0.041 3.992
384 H GLU 53 HN GLU 53 4.064 5.707 4.310
385 HA GLU 53 HA GLU 53 6.713 6.453 3.769
386 HB2 GLU 53 HB2 GLU 53 4.322 8.186 4.355
387 HB3 GLU 53 HB1 GLU 53 5.863 8.791 3.776
388 HG2 GLU 53 HG2 GLU 53 5.595 7.425 1.736
389 HG3 GLU 53 HG1 GLU 53 4.010 6.918 2.318
390 H SER 54 HN SER 54 4.749 6.866 6.714
391 HA SER 54 HA SER 54 6.750 8.409 8.032
392 HB2 SER 54 HB2 SER 54 4.474 6.809 9.229
393 HB3 SER 54 HB1 SER 54 5.353 8.129 10.002
394 HG SER 54 HG SER 54 4.522 9.205 7.832
395 H ARG 55 HN ARG 55 5.726 5.032 8.181
396 HA ARG 55 HA ARG 55 7.467 4.260 10.283
397 HB2 ARG 55 HB2 ARG 55 5.342 3.209 9.931
398 HB3 ARG 55 HB1 ARG 55 5.797 2.712 8.322
399 HG2 ARG 55 HG2 ARG 55 7.333 1.080 9.224
400 HG3 ARG 55 HG1 ARG 55 7.010 1.650 10.872
401 HD2 ARG 55 HD2 ARG 55 4.699 1.012 10.709
402 HD3 ARG 55 HD1 ARG 55 4.887 0.610 9.009
403 HE ARG 55 HE ARG 55 6.594 -1.088 10.137
404 HH11 ARG 55 HH11 ARG 55 3.289 -0.256 11.126
405 HH12 ARG 55 HH12 ARG 55 2.829 -1.815 11.559
406 HH21 ARG 55 HH21 ARG 55 5.989 -3.336 10.769
407 HH22 ARG 55 HH22 ARG 55 4.430 -3.576 11.419
408 H TYR 56 HN TYR 56 7.787 4.000 6.722
409 HA TYR 56 HA TYR 56 10.360 2.709 7.260
410 HB2 TYR 56 HB2 TYR 56 8.703 2.540 4.737
411 HB3 TYR 56 HB1 TYR 56 10.270 1.764 4.996
412 HD1 TYR 56 HD1 TYR 56 10.466 0.181 7.017
413 HD2 TYR 56 HD2 TYR 56 6.753 1.392 5.342
414 HE1 TYR 56 HE1 TYR 56 9.368 -1.726 8.100
415 HE2 TYR 56 HE2 TYR 56 5.640 -0.516 6.419
416 HH TYR 56 HH TYR 56 6.303 -2.780 7.286
417 H GLY 57 HN GLY 57 9.220 5.653 6.573
418 HA2 GLY 57 HA2 GLY 57 10.321 7.586 6.067
419 HA3 GLY 57 HA1 GLY 57 11.812 6.659 6.061
420 H VAL 58 HN VAL 58 8.942 6.516 3.990
421 HA VAL 58 HA VAL 58 10.749 6.958 1.727
422 HB VAL 58 HB VAL 58 9.173 5.727 0.270
423 HG11 VAL 58 HG11 VAL 58 11.008 4.506 1.294
424 HG12 VAL 58 HG12 VAL 58 9.577 3.476 1.148
425 HG13 VAL 58 HG13 VAL 58 9.998 4.182 2.709
426 HG21 VAL 58 HG21 VAL 58 7.661 5.162 2.822
427 HG22 VAL 58 HG22 VAL 58 7.351 4.406 1.257
428 HG23 VAL 58 HG23 VAL 58 7.099 6.143 1.467
429 H SER 59 HN SER 59 9.079 7.606 -0.293
430 HA SER 59 HA SER 59 7.257 9.671 0.624
431 HB2 SER 59 HB2 SER 59 9.537 10.247 -1.297
432 HB3 SER 59 HB1 SER 59 8.328 11.394 -0.725
433 HG SER 59 HG SER 59 9.359 10.345 1.410
434 H ILE 60 HN ILE 60 5.428 9.301 -0.510
435 HA ILE 60 HA ILE 60 5.680 8.572 -3.343
436 HB ILE 60 HB ILE 60 3.614 7.527 -1.377
437 HG12 ILE 60 HG12 ILE 60 5.649 6.073 -3.080
438 HG13 ILE 60 HG11 ILE 60 5.742 6.287 -1.337
439 HG21 ILE 60 HG21 ILE 60 3.698 7.156 -4.376
440 HG22 ILE 60 HG22 ILE 60 2.499 8.076 -3.467
441 HG23 ILE 60 HG23 ILE 60 2.592 6.323 -3.277
442 HD11 ILE 60 HD11 ILE 60 4.981 4.060 -1.877
443 HD12 ILE 60 HD12 ILE 60 3.665 4.723 -2.846
444 HD13 ILE 60 HD13 ILE 60 3.680 4.964 -1.098
445 HA PRO 61 HA PRO 61 3.355 12.353 -3.838
446 HB2 PRO 61 HB2 PRO 61 2.911 11.210 -6.542
447 HB3 PRO 61 HB1 PRO 61 3.595 12.777 -6.088
448 HG2 PRO 61 HG2 PRO 61 5.143 10.818 -7.038
449 HG3 PRO 61 HG1 PRO 61 5.712 11.905 -5.756
450 HD2 PRO 61 HD2 PRO 61 4.721 9.096 -5.561
451 HD3 PRO 61 HD1 PRO 61 6.052 9.892 -4.688
452 H ASP 62 HN ASP 62 1.250 12.742 -3.519
453 HA ASP 62 HA ASP 62 -0.594 10.724 -2.949
454 HB2 ASP 62 HB2 ASP 62 -2.271 12.485 -2.671
455 HB3 ASP 62 HB1 ASP 62 -0.742 13.009 -1.988
456 H ASP 63 HN ASP 63 -0.042 12.532 -5.880
457 HA ASP 63 HA ASP 63 -2.293 11.843 -7.375
458 HB2 ASP 63 HB2 ASP 63 -0.779 13.505 -8.216
459 HB3 ASP 63 HB1 ASP 63 0.556 12.358 -8.204
460 H VAL 64 HN VAL 64 0.765 10.165 -6.965
461 HA VAL 64 HA VAL 64 0.124 8.103 -8.834
462 HB VAL 64 HB VAL 64 2.321 8.055 -6.748
463 HG11 VAL 64 HG11 VAL 64 1.922 5.902 -7.788
464 HG12 VAL 64 HG12 VAL 64 3.459 6.572 -8.348
465 HG13 VAL 64 HG13 VAL 64 2.043 6.632 -9.390
466 HG21 VAL 64 HG21 VAL 64 2.499 10.094 -8.049
467 HG22 VAL 64 HG22 VAL 64 2.405 9.175 -9.552
468 HG23 VAL 64 HG23 VAL 64 3.797 8.981 -8.482
469 H ALA 65 HN ALA 65 -0.154 8.464 -5.326
470 HA ALA 65 HA ALA 65 -0.580 5.855 -4.547
471 HB1 ALA 65 HB1 ALA 65 -1.759 8.422 -3.468
472 HB2 ALA 65 HB2 ALA 65 -0.228 7.701 -2.974
473 HB3 ALA 65 HB3 ALA 65 -1.754 6.879 -2.622
474 H GLY 66 HN GLY 66 -2.891 8.347 -5.572
475 HA2 GLY 66 HA2 GLY 66 -5.116 6.532 -5.424
476 HA3 GLY 66 HA1 GLY 66 -5.150 8.167 -6.062
477 H ARG 67 HN ARG 67 -2.664 6.729 -7.626
478 HA ARG 67 HA ARG 67 -4.409 6.038 -9.861
479 HB2 ARG 67 HB2 ARG 67 -1.691 7.278 -9.783
480 HB3 ARG 67 HB1 ARG 67 -2.314 6.505 -11.229
481 HG2 ARG 67 HG2 ARG 67 -4.152 8.059 -11.344
482 HG3 ARG 67 HG1 ARG 67 -3.690 8.776 -9.794
483 HD2 ARG 67 HD2 ARG 67 -2.962 10.097 -11.778
484 HD3 ARG 67 HD1 ARG 67 -1.640 9.599 -10.717
485 HE ARG 67 HE ARG 67 -2.324 8.094 -13.149
486 HH11 ARG 67 HH11 ARG 67 0.074 9.999 -11.340
487 HH12 ARG 67 HH12 ARG 67 1.402 9.328 -12.154
488 HH21 ARG 67 HH21 ARG 67 -0.554 7.223 -14.250
489 HH22 ARG 67 HH22 ARG 67 1.054 7.697 -13.892
490 H VAL 68 HN VAL 68 -2.792 4.395 -7.596
491 HA VAL 68 HA VAL 68 -1.814 2.446 -9.487
492 HB VAL 68 HB VAL 68 -1.125 1.019 -7.542
493 HG11 VAL 68 HG11 VAL 68 0.447 2.563 -8.498
494 HG12 VAL 68 HG12 VAL 68 0.676 2.452 -6.752
495 HG13 VAL 68 HG13 VAL 68 -0.144 3.848 -7.445
496 HG21 VAL 68 HG21 VAL 68 -2.784 1.708 -5.890
497 HG22 VAL 68 HG22 VAL 68 -2.096 3.336 -5.873
498 HG23 VAL 68 HG23 VAL 68 -1.137 1.970 -5.292
499 H ASP 69 HN ASP 69 -2.538 -0.023 -8.718
500 HA ASP 69 HA ASP 69 -5.491 0.101 -8.513
501 HB2 ASP 69 HB2 ASP 69 -4.576 -0.147 -10.911
502 HB3 ASP 69 HB1 ASP 69 -3.994 -1.706 -10.384
503 H THR 70 HN THR 70 -2.681 -1.964 -8.713
504 HA THR 70 HA THR 70 -3.889 -3.834 -6.824
505 HB THR 70 HB THR 70 -2.233 -5.438 -7.731
506 HG1 THR 70 HG1 THR 70 -1.536 -3.256 -9.467
507 HG21 THR 70 HG21 THR 70 -3.156 -5.600 -10.027
508 HG22 THR 70 HG22 THR 70 -3.815 -3.965 -9.849
509 HG23 THR 70 HG23 THR 70 -4.415 -5.274 -8.835
510 HA PRO 71 HA PRO 71 -1.060 -2.636 -3.593
511 HB2 PRO 71 HB2 PRO 71 -0.687 -5.577 -3.215
512 HB3 PRO 71 HB1 PRO 71 -1.073 -4.327 -2.026
513 HG2 PRO 71 HG2 PRO 71 -2.973 -5.930 -2.885
514 HG3 PRO 71 HG1 PRO 71 -3.295 -4.199 -2.684
515 HD2 PRO 71 HD2 PRO 71 -2.776 -5.752 -5.194
516 HD3 PRO 71 HD1 PRO 71 -3.937 -4.439 -4.891
517 H ARG 72 HN ARG 72 -0.047 -5.050 -5.986
518 HA ARG 72 HA ARG 72 2.664 -5.070 -5.226
519 HB2 ARG 72 HB2 ARG 72 3.213 -6.129 -7.316
520 HB3 ARG 72 HB1 ARG 72 1.699 -6.804 -6.746
521 HG2 ARG 72 HG2 ARG 72 0.466 -5.606 -8.388
522 HG3 ARG 72 HG1 ARG 72 1.877 -4.636 -8.827
523 HD2 ARG 72 HD2 ARG 72 1.699 -6.257 -10.520
524 HD3 ARG 72 HD1 ARG 72 2.998 -6.815 -9.476
525 HE ARG 72 HE ARG 72 0.300 -7.941 -9.675
526 HH11 ARG 72 HH11 ARG 72 3.590 -8.372 -8.296
527 HH12 ARG 72 HH12 ARG 72 3.438 -10.071 -8.274
528 HH21 ARG 72 HH21 ARG 72 0.232 -10.187 -9.692
529 HH22 ARG 72 HH22 ARG 72 1.497 -11.168 -9.078
530 H GLU 73 HN GLU 73 0.867 -2.875 -7.235
531 HA GLU 73 HA GLU 73 3.110 -1.499 -8.377
532 HB2 GLU 73 HB2 GLU 73 0.265 -0.616 -7.927
533 HB3 GLU 73 HB1 GLU 73 1.451 0.251 -8.889
534 HG2 GLU 73 HG2 GLU 73 1.531 -1.491 -10.489
535 HG3 GLU 73 HG1 GLU 73 0.574 -2.557 -9.453
536 H LEU 74 HN LEU 74 0.986 -0.958 -5.659
537 HA LEU 74 HA LEU 74 1.982 1.508 -4.721
538 HB2 LEU 74 HB2 LEU 74 -0.124 0.113 -4.034
539 HB3 LEU 74 HB1 LEU 74 1.041 -0.725 -3.012
540 HG LEU 74 HG LEU 74 -0.427 1.028 -1.864
541 HD11 LEU 74 HD11 LEU 74 1.345 1.904 -0.458
542 HD12 LEU 74 HD12 LEU 74 2.542 1.394 -1.655
543 HD13 LEU 74 HD13 LEU 74 1.583 0.184 -0.798
544 HD21 LEU 74 HD21 LEU 74 1.401 2.910 -3.325
545 HD22 LEU 74 HD22 LEU 74 0.265 3.360 -2.057
546 HD23 LEU 74 HD23 LEU 74 -0.334 2.735 -3.596
547 H LEU 75 HN LEU 75 2.697 -1.841 -3.905
548 HA LEU 75 HA LEU 75 4.669 -1.495 -2.004
549 HB2 LEU 75 HB2 LEU 75 3.470 -3.530 -2.371
550 HB3 LEU 75 HB1 LEU 75 4.100 -3.655 -4.002
551 HG LEU 75 HG LEU 75 6.322 -3.826 -3.022
552 HD11 LEU 75 HD11 LEU 75 6.490 -4.562 -0.655
553 HD12 LEU 75 HD12 LEU 75 4.765 -4.221 -0.465
554 HD13 LEU 75 HD13 LEU 75 5.888 -2.910 -0.820
555 HD21 LEU 75 HD21 LEU 75 5.157 -5.689 -3.895
556 HD22 LEU 75 HD22 LEU 75 4.297 -5.929 -2.374
557 HD23 LEU 75 HD23 LEU 75 6.048 -6.220 -2.460
558 H ASP 76 HN ASP 76 4.774 -1.684 -5.512
559 HA ASP 76 HA ASP 76 7.597 -1.840 -5.772
560 HB2 ASP 76 HB2 ASP 76 6.060 -2.573 -7.553
561 HB3 ASP 76 HB1 ASP 76 5.524 -0.918 -7.778
562 H LEU 77 HN LEU 77 5.295 0.809 -5.688
563 HA LEU 77 HA LEU 77 7.037 2.937 -6.246
564 HB2 LEU 77 HB2 LEU 77 4.682 2.843 -4.372
565 HB3 LEU 77 HB1 LEU 77 5.448 4.302 -4.945
566 HG LEU 77 HG LEU 77 3.987 2.301 -6.654
567 HD11 LEU 77 HD11 LEU 77 2.286 4.044 -6.850
568 HD12 LEU 77 HD12 LEU 77 3.182 5.041 -5.695
569 HD13 LEU 77 HD13 LEU 77 2.487 3.499 -5.187
570 HD21 LEU 77 HD21 LEU 77 4.185 4.002 -8.412
571 HD22 LEU 77 HD22 LEU 77 5.764 3.420 -7.884
572 HD23 LEU 77 HD23 LEU 77 5.178 4.988 -7.339
573 H ILE 78 HN ILE 78 6.096 1.404 -3.213
574 HA ILE 78 HA ILE 78 7.711 2.791 -1.403
575 HB ILE 78 HB ILE 78 6.897 -0.135 -1.390
576 HG12 ILE 78 HG12 ILE 78 4.968 1.432 -1.365
577 HG13 ILE 78 HG11 ILE 78 5.117 0.550 0.148
578 HG21 ILE 78 HG21 ILE 78 7.980 1.516 0.897
579 HG22 ILE 78 HG22 ILE 78 8.803 0.186 0.090
580 HG23 ILE 78 HG23 ILE 78 7.345 -0.125 1.034
581 HD11 ILE 78 HD11 ILE 78 6.015 3.376 -0.338
582 HD12 ILE 78 HD12 ILE 78 6.151 2.496 1.183
583 HD13 ILE 78 HD13 ILE 78 4.557 2.877 0.524
584 H ASN 79 HN ASN 79 8.344 -0.233 -3.124
585 HA ASN 79 HA ASN 79 10.945 -0.755 -2.316
586 HB2 ASN 79 HB2 ASN 79 9.685 -1.338 -5.010
587 HB3 ASN 79 HB1 ASN 79 11.234 -1.984 -4.487
588 HD21 ASN 79 HD21 ASN 79 10.238 -2.294 -1.733
589 HD22 ASN 79 HD22 ASN 79 9.218 -3.681 -1.741
590 H GLY 80 HN GLY 80 9.932 1.137 -5.122
591 HA2 GLY 80 HA2 GLY 80 12.504 1.789 -6.049
592 HA3 GLY 80 HA1 GLY 80 11.031 2.689 -6.387
593 H ALA 81 HN ALA 81 10.260 3.681 -4.044
594 HA ALA 81 HA ALA 81 11.964 5.904 -3.705
595 HB1 ALA 81 HB1 ALA 81 9.666 5.014 -1.964
596 HB2 ALA 81 HB2 ALA 81 9.545 6.029 -3.403
597 HB3 ALA 81 HB3 ALA 81 10.402 6.619 -1.981
598 H LEU 82 HN LEU 82 11.610 2.922 -1.851
599 HA LEU 82 HA LEU 82 13.082 3.816 0.382
600 HB2 LEU 82 HB2 LEU 82 11.444 2.039 0.540
601 HB3 LEU 82 HB1 LEU 82 12.343 1.072 -0.604
602 HG LEU 82 HG LEU 82 14.177 0.960 0.970
603 HD11 LEU 82 HD11 LEU 82 13.779 2.959 2.289
604 HD12 LEU 82 HD12 LEU 82 13.759 1.559 3.366
605 HD13 LEU 82 HD13 LEU 82 12.243 2.313 2.864
606 HD21 LEU 82 HD21 LEU 82 13.095 -0.657 2.503
607 HD22 LEU 82 HD22 LEU 82 12.586 -0.842 0.817
608 HD23 LEU 82 HD23 LEU 82 11.524 -0.043 1.980
609 H ALA 83 HN ALA 83 13.858 1.899 -2.507
610 HA ALA 83 HA ALA 83 16.423 1.103 -1.740
611 HB1 ALA 83 HB1 ALA 83 15.386 1.553 -4.532
612 HB2 ALA 83 HB2 ALA 83 15.181 0.084 -3.577
613 HB3 ALA 83 HB3 ALA 83 16.796 0.584 -4.082
614 H GLU 84 HN GLU 84 15.330 4.138 -3.107
615 HA GLU 84 HA GLU 84 17.963 4.995 -3.773
616 HB2 GLU 84 HB2 GLU 84 15.289 6.358 -3.763
617 HB3 GLU 84 HB1 GLU 84 16.781 7.073 -4.347
618 HG2 GLU 84 HG2 GLU 84 15.465 4.601 -5.461
619 HG3 GLU 84 HG1 GLU 84 15.401 6.213 -6.176
620 H ALA 85 HN ALA 85 15.877 5.166 -1.011
621 HA ALA 85 HA ALA 85 17.374 7.421 0.117
622 HB1 ALA 85 HB1 ALA 85 14.925 7.513 0.228
623 HB2 ALA 85 HB2 ALA 85 15.658 7.510 1.830
624 HB3 ALA 85 HB3 ALA 85 14.924 6.034 1.195
625 H ALA 86 HN ALA 86 16.977 4.011 0.431
626 HA ALA 86 HA ALA 86 18.758 4.013 2.743
627 HB1 ALA 86 HB1 ALA 86 16.544 3.059 3.217
628 HB2 ALA 86 HB2 ALA 86 17.795 1.818 3.276
629 HB3 ALA 86 HB3 ALA 86 16.740 1.935 1.873
630 H28A SDO 101 H28A SDO 42 -10.249 11.938 -1.929
631 H28B SDO 101 H28B SDO 42 -8.893 10.867 -1.579
632 H30A SDO 101 H30A SDO 42 -7.803 12.380 -0.086
633 H30B SDO 101 H30B SDO 42 -9.200 13.446 -0.232
634 H30C SDO 101 H30C SDO 42 -7.577 14.081 -0.491
635 H31A SDO 101 H31A SDO 42 -6.285 13.385 -2.566
636 H31B SDO 101 H31B SDO 42 -7.012 12.208 -3.666
637 H31C SDO 101 H31C SDO 42 -6.516 11.717 -2.043
638 H32A SDO 101 H32A SDO 42 -9.003 13.850 -3.944
639 H33A SDO 101 H33A SDO 42 -7.138 14.981 -3.381
640 H36A SDO 101 H36A SDO 42 -9.490 16.464 -2.419
641 H37A SDO 101 H37A SDO 42 -12.059 16.970 -2.524
642 H37B SDO 101 H37B SDO 42 -12.074 15.939 -1.089
643 H38A SDO 101 H38A SDO 42 -10.484 18.510 -1.383
644 H38B SDO 101 H38B SDO 42 -12.067 18.400 -0.668
645 H41A SDO 101 H41A SDO 42 -10.784 15.602 0.244
646 H42A SDO 101 H42A SDO 42 -8.864 15.570 1.995
647 H42B SDO 101 H42B SDO 42 -10.032 16.533 2.904
648 H43A SDO 101 H43A SDO 42 -10.480 13.786 1.791
649 H43B SDO 101 H43B SDO 42 -11.640 14.704 2.728
650 H1A SDO 101 H1A SDO 42 -9.000 14.710 6.035
651 H1B SDO 101 H1B SDO 42 -7.870 13.776 5.084
652 H2A SDO 101 H2A SDO 42 -8.888 16.489 4.363
653 H2B SDO 101 H2B SDO 42 -7.712 15.563 3.476
654 H4A SDO 101 H4A SDO 42 -6.261 16.891 7.258
655 H4B SDO 101 H4B SDO 42 -5.133 15.927 6.347
656 H5A SDO 101 H5A SDO 42 -6.547 13.959 6.595
657 H5B SDO 101 H5B SDO 42 -7.674 14.906 7.569
658 H6A SDO 101 H6A SDO 42 -5.879 15.367 9.183
659 H6B SDO 101 H6B SDO 42 -4.768 14.399 8.219
660 H8A SDO 101 H8A SDO 42 -7.400 12.478 7.699
661 H8B SDO 101 H8B SDO 42 -8.309 12.816 9.178
662 H8C SDO 101 H8C SDO 42 -7.249 11.404 9.090
Start of MODEL 12
1 H1 MET 1 HT1 MET 1 22.283 -0.309 5.127
2 H2 MET 1 HT2 MET 1 21.939 0.933 3.993
3 H3 MET 1 HT3 MET 1 23.206 -0.149 3.713
4 HA MET 1 HA MET 1 21.244 -0.612 2.392
5 HB2 MET 1 HB2 MET 1 22.911 -2.380 3.152
6 HB3 MET 1 HB1 MET 1 21.833 -2.739 4.483
7 HG2 MET 1 HG2 MET 1 20.109 -3.467 2.952
8 HG3 MET 1 HG1 MET 1 21.123 -3.030 1.576
9 HE1 MET 1 HE1 MET 1 21.182 -6.962 1.436
10 HE2 MET 1 HE2 MET 1 20.830 -5.480 0.550
11 HE3 MET 1 HE3 MET 1 19.819 -5.954 1.919
12 H ALA 2 HN ALA 2 19.020 -0.930 2.337
13 HA ALA 2 HA ALA 2 17.696 -0.336 4.887
14 HB1 ALA 2 HB1 ALA 2 15.946 0.731 3.578
15 HB2 ALA 2 HB2 ALA 2 16.780 0.298 2.083
16 HB3 ALA 2 HB3 ALA 2 17.519 1.438 3.207
17 H THR 3 HN THR 3 15.899 -1.506 5.468
18 HA THR 3 HA THR 3 15.590 -4.137 4.515
19 HB THR 3 HB THR 3 13.532 -4.042 6.003
20 HG1 THR 3 HG1 THR 3 13.319 -1.755 5.672
21 HG21 THR 3 HG21 THR 3 14.836 -3.846 8.085
22 HG22 THR 3 HG22 THR 3 16.160 -3.122 7.174
23 HG23 THR 3 HG23 THR 3 15.683 -4.796 6.864
24 H LEU 4 HN LEU 4 15.019 -4.152 2.345
25 HA LEU 4 HA LEU 4 13.081 -2.531 1.105
26 HB2 LEU 4 HB2 LEU 4 14.929 -4.132 0.120
27 HB3 LEU 4 HB1 LEU 4 13.675 -5.348 0.238
28 HG LEU 4 HG LEU 4 12.268 -3.865 -1.220
29 HD11 LEU 4 HD11 LEU 4 14.889 -2.396 -1.545
30 HD12 LEU 4 HD12 LEU 4 13.440 -1.768 -0.757
31 HD13 LEU 4 HD13 LEU 4 13.420 -2.115 -2.479
32 HD21 LEU 4 HD21 LEU 4 14.913 -4.809 -2.336
33 HD22 LEU 4 HD22 LEU 4 13.462 -4.473 -3.271
34 HD23 LEU 4 HD23 LEU 4 13.471 -5.804 -2.114
35 H LEU 5 HN LEU 5 10.838 -2.954 0.736
36 HA LEU 5 HA LEU 5 9.700 -4.643 2.764
37 HB2 LEU 5 HB2 LEU 5 8.494 -2.678 0.861
38 HB3 LEU 5 HB1 LEU 5 7.483 -3.754 1.786
39 HG LEU 5 HG LEU 5 8.692 -2.765 3.830
40 HD11 LEU 5 HD11 LEU 5 10.478 -1.605 2.706
41 HD12 LEU 5 HD12 LEU 5 9.453 -0.461 3.573
42 HD13 LEU 5 HD13 LEU 5 9.309 -0.624 1.822
43 HD21 LEU 5 HD21 LEU 5 6.717 -1.174 2.203
44 HD22 LEU 5 HD22 LEU 5 7.075 -0.919 3.918
45 HD23 LEU 5 HD23 LEU 5 6.376 -2.447 3.374
46 H THR 6 HN THR 6 8.634 -6.434 2.532
47 HA THR 6 HA THR 6 8.654 -7.654 -0.112
48 HB THR 6 HB THR 6 8.260 -9.780 1.091
49 HG1 THR 6 HG1 THR 6 8.473 -8.217 3.482
50 HG21 THR 6 HG21 THR 6 10.596 -9.065 0.760
51 HG22 THR 6 HG22 THR 6 10.414 -9.934 2.285
52 HG23 THR 6 HG23 THR 6 10.535 -8.175 2.280
53 H THR 7 HN THR 7 6.660 -9.424 0.002
54 HA THR 7 HA THR 7 4.309 -7.948 -0.330
55 HB THR 7 HB THR 7 4.488 -10.932 0.165
56 HG1 THR 7 HG1 THR 7 4.667 -10.514 -2.410
57 HG21 THR 7 HG21 THR 7 2.655 -11.012 -1.455
58 HG22 THR 7 HG22 THR 7 2.768 -9.274 -1.692
59 HG23 THR 7 HG23 THR 7 2.236 -9.912 -0.139
60 H ASP 8 HN ASP 8 5.753 -9.691 2.367
61 HA ASP 8 HA ASP 8 3.313 -9.777 3.882
62 HB2 ASP 8 HB2 ASP 8 6.117 -10.607 4.601
63 HB3 ASP 8 HB1 ASP 8 4.759 -10.720 5.716
64 H ASP 9 HN ASP 9 6.128 -7.758 3.761
65 HA ASP 9 HA ASP 9 5.659 -6.338 6.173
66 HB2 ASP 9 HB2 ASP 9 6.955 -5.352 3.612
67 HB3 ASP 9 HB1 ASP 9 6.914 -4.437 5.107
68 H LEU 10 HN LEU 10 4.568 -5.861 2.879
69 HA LEU 10 HA LEU 10 3.005 -3.570 3.449
70 HB2 LEU 10 HB2 LEU 10 3.727 -4.121 1.171
71 HB3 LEU 10 HB1 LEU 10 2.747 -5.575 1.212
72 HG LEU 10 HG LEU 10 0.717 -4.166 1.408
73 HD11 LEU 10 HD11 LEU 10 2.633 -1.890 0.980
74 HD12 LEU 10 HD12 LEU 10 1.680 -2.211 2.425
75 HD13 LEU 10 HD13 LEU 10 0.873 -1.779 0.914
76 HD21 LEU 10 HD21 LEU 10 0.727 -3.398 -0.916
77 HD22 LEU 10 HD22 LEU 10 1.456 -4.997 -0.769
78 HD23 LEU 10 HD23 LEU 10 2.479 -3.570 -0.966
79 H ARG 11 HN ARG 11 2.286 -7.003 3.157
80 HA ARG 11 HA ARG 11 -0.384 -7.315 3.439
81 HB2 ARG 11 HB2 ARG 11 1.066 -9.191 3.268
82 HB3 ARG 11 HB1 ARG 11 1.881 -8.783 4.761
83 HG2 ARG 11 HG2 ARG 11 -0.176 -9.381 6.001
84 HG3 ARG 11 HG1 ARG 11 -0.909 -9.880 4.468
85 HD2 ARG 11 HD2 ARG 11 0.722 -11.571 4.135
86 HD3 ARG 11 HD1 ARG 11 1.713 -10.968 5.457
87 HE ARG 11 HE ARG 11 -0.909 -11.807 6.266
88 HH11 ARG 11 HH11 ARG 11 2.452 -12.915 5.702
89 HH12 ARG 11 HH12 ARG 11 2.299 -14.238 6.750
90 HH21 ARG 11 HH21 ARG 11 -1.077 -13.622 7.599
91 HH22 ARG 11 HH22 ARG 11 0.229 -14.700 7.835
92 H ARG 12 HN ARG 12 1.837 -6.989 6.148
93 HA ARG 12 HA ARG 12 -0.026 -7.048 8.218
94 HB2 ARG 12 HB2 ARG 12 2.681 -5.774 8.017
95 HB3 ARG 12 HB1 ARG 12 1.774 -5.880 9.517
96 HG2 ARG 12 HG2 ARG 12 1.867 -8.274 9.448
97 HG3 ARG 12 HG1 ARG 12 2.622 -8.245 7.850
98 HD2 ARG 12 HD2 ARG 12 4.240 -8.608 9.687
99 HD3 ARG 12 HD1 ARG 12 4.573 -7.151 8.751
100 HE ARG 12 HE ARG 12 2.942 -6.719 11.068
101 HH11 ARG 12 HH11 ARG 12 6.271 -6.858 9.862
102 HH12 ARG 12 HH12 ARG 12 6.898 -5.875 11.101
103 HH21 ARG 12 HH21 ARG 12 3.745 -5.309 12.662
104 HH22 ARG 12 HH22 ARG 12 5.404 -4.921 12.746
105 H ALA 13 HN ALA 13 1.501 -4.208 6.737
106 HA ALA 13 HA ALA 13 0.000 -2.385 8.290
107 HB1 ALA 13 HB1 ALA 13 2.199 -1.845 7.367
108 HB2 ALA 13 HB2 ALA 13 0.970 -0.660 6.910
109 HB3 ALA 13 HB3 ALA 13 1.506 -1.870 5.743
110 H LEU 14 HN LEU 14 -0.518 -3.777 5.091
111 HA LEU 14 HA LEU 14 -2.538 -2.055 4.242
112 HB2 LEU 14 HB2 LEU 14 -1.273 -3.770 2.889
113 HB3 LEU 14 HB1 LEU 14 -2.261 -5.001 3.651
114 HG LEU 14 HG LEU 14 -4.254 -4.062 2.618
115 HD11 LEU 14 HD11 LEU 14 -4.069 -2.303 0.947
116 HD12 LEU 14 HD12 LEU 14 -2.343 -2.150 1.288
117 HD13 LEU 14 HD13 LEU 14 -3.532 -1.732 2.524
118 HD21 LEU 14 HD21 LEU 14 -2.009 -4.565 0.670
119 HD22 LEU 14 HD22 LEU 14 -3.729 -4.632 0.298
120 HD23 LEU 14 HD23 LEU 14 -3.026 -5.792 1.427
121 H VAL 15 HN VAL 15 -2.672 -5.083 6.082
122 HA VAL 15 HA VAL 15 -5.455 -5.210 6.440
123 HB VAL 15 HB VAL 15 -3.222 -6.247 8.223
124 HG11 VAL 15 HG11 VAL 15 -6.165 -6.948 8.254
125 HG12 VAL 15 HG12 VAL 15 -5.291 -6.075 9.517
126 HG13 VAL 15 HG13 VAL 15 -4.912 -7.765 9.191
127 HG21 VAL 15 HG21 VAL 15 -3.199 -7.214 5.998
128 HG22 VAL 15 HG22 VAL 15 -4.908 -7.590 6.113
129 HG23 VAL 15 HG23 VAL 15 -3.752 -8.421 7.162
130 H GLU 16 HN GLU 16 -2.918 -3.741 8.501
131 HA GLU 16 HA GLU 16 -4.598 -2.771 10.497
132 HB2 GLU 16 HB2 GLU 16 -2.035 -1.564 9.491
133 HB3 GLU 16 HB1 GLU 16 -2.825 -1.175 11.017
134 HG2 GLU 16 HG2 GLU 16 -2.551 -3.584 11.640
135 HG3 GLU 16 HG1 GLU 16 -1.575 -3.764 10.194
136 H SER 17 HN SER 17 -3.709 -1.299 7.402
137 HA SER 17 HA SER 17 -4.950 1.185 8.093
138 HB2 SER 17 HB2 SER 17 -4.488 1.752 5.665
139 HB3 SER 17 HB1 SER 17 -3.089 1.408 6.678
140 HG SER 17 HG SER 17 -2.941 -0.608 5.764
141 H ALA 18 HN ALA 18 -6.179 -1.714 7.012
142 HA ALA 18 HA ALA 18 -8.423 -0.516 5.675
143 HB1 ALA 18 HB1 ALA 18 -7.987 -3.352 6.608
144 HB2 ALA 18 HB2 ALA 18 -7.707 -2.735 4.972
145 HB3 ALA 18 HB3 ALA 18 -9.340 -2.779 5.636
146 H GLY 19 HN GLY 19 -9.328 0.793 7.044
147 HA2 GLY 19 HA2 GLY 19 -9.567 0.856 9.731
148 HA3 GLY 19 HA1 GLY 19 -10.791 1.527 8.677
149 H GLU 20 HN GLU 20 -12.121 -0.580 7.695
150 HA GLU 20 HA GLU 20 -12.900 -2.087 10.105
151 HB2 GLU 20 HB2 GLU 20 -14.476 -0.256 9.408
152 HB3 GLU 20 HB1 GLU 20 -14.708 -1.131 7.906
153 HG2 GLU 20 HG2 GLU 20 -15.616 -3.020 9.175
154 HG3 GLU 20 HG1 GLU 20 -15.416 -2.078 10.659
155 H THR 21 HN THR 21 -11.493 -2.317 7.283
156 HA THR 21 HA THR 21 -12.759 -4.825 6.474
157 HB THR 21 HB THR 21 -10.842 -3.123 4.841
158 HG1 THR 21 HG1 THR 21 -13.697 -3.160 4.831
159 HG21 THR 21 HG21 THR 21 -12.940 -5.161 4.018
160 HG22 THR 21 HG22 THR 21 -11.206 -5.461 4.078
161 HG23 THR 21 HG23 THR 21 -11.859 -4.275 2.934
162 H ASP 22 HN ASP 22 -11.144 -4.835 8.759
163 HA ASP 22 HA ASP 22 -8.709 -6.044 7.868
164 HB2 ASP 22 HB2 ASP 22 -8.217 -6.304 10.235
165 HB3 ASP 22 HB1 ASP 22 -8.484 -4.613 9.806
166 H GLY 23 HN GLY 23 -11.394 -6.965 7.639
167 HA2 GLY 23 HA2 GLY 23 -11.016 -9.770 8.508
168 HA3 GLY 23 HA1 GLY 23 -12.621 -9.018 8.497
169 H THR 24 HN THR 24 -9.901 -9.136 6.296
170 HA THR 24 HA THR 24 -11.744 -10.022 4.228
171 HB THR 24 HB THR 24 -11.182 -7.666 3.799
172 HG1 THR 24 HG1 THR 24 -11.368 -8.526 1.895
173 HG21 THR 24 HG21 THR 24 -8.870 -6.957 3.366
174 HG22 THR 24 HG22 THR 24 -8.310 -8.577 3.798
175 HG23 THR 24 HG23 THR 24 -9.069 -7.554 5.016
176 H ASP 25 HN ASP 25 -9.776 -10.470 2.273
177 HA ASP 25 HA ASP 25 -8.681 -12.964 3.430
178 HB2 ASP 25 HB2 ASP 25 -10.415 -12.964 1.513
179 HB3 ASP 25 HB1 ASP 25 -9.096 -12.403 0.489
180 H LEU 26 HN LEU 26 -7.484 -10.270 3.405
181 HA LEU 26 HA LEU 26 -5.271 -10.220 1.580
182 HB2 LEU 26 HB2 LEU 26 -6.301 -8.491 3.730
183 HB3 LEU 26 HB1 LEU 26 -4.590 -8.357 3.400
184 HG LEU 26 HG LEU 26 -5.014 -7.639 1.128
185 HD11 LEU 26 HD11 LEU 26 -7.944 -8.078 1.696
186 HD12 LEU 26 HD12 LEU 26 -6.948 -9.028 0.593
187 HD13 LEU 26 HD13 LEU 26 -7.272 -7.329 0.249
188 HD21 LEU 26 HD21 LEU 26 -5.106 -5.971 2.883
189 HD22 LEU 26 HD22 LEU 26 -6.840 -6.236 3.059
190 HD23 LEU 26 HD23 LEU 26 -6.195 -5.564 1.556
191 H SER 27 HN SER 27 -5.152 -12.589 3.024
192 HA SER 27 HA SER 27 -2.549 -12.250 4.303
193 HB2 SER 27 HB2 SER 27 -4.406 -12.745 5.986
194 HB3 SER 27 HB1 SER 27 -4.624 -14.297 5.157
195 HG SER 27 HG SER 27 -3.193 -14.802 6.709
196 H GLY 28 HN GLY 28 -1.043 -13.509 3.296
197 HA2 GLY 28 HA2 GLY 28 -0.312 -15.480 2.238
198 HA3 GLY 28 HA1 GLY 28 -1.971 -15.811 1.749
199 H ASP 29 HN ASP 29 -1.968 -15.806 -0.399
200 HA ASP 29 HA ASP 29 -0.432 -13.748 -1.754
201 HB2 ASP 29 HB2 ASP 29 -1.799 -16.187 -2.911
202 HB3 ASP 29 HB1 ASP 29 -1.037 -14.940 -3.889
203 H PHE 30 HN PHE 30 -1.604 -12.089 -1.176
204 HA PHE 30 HA PHE 30 -4.277 -11.798 -2.406
205 HB2 PHE 30 HB2 PHE 30 -4.585 -9.931 -0.837
206 HB3 PHE 30 HB1 PHE 30 -4.108 -11.376 0.051
207 HD1 PHE 30 HD2 PHE 30 -1.790 -11.572 0.930
208 HD2 PHE 30 HD1 PHE 30 -3.221 -7.975 -0.839
209 HE1 PHE 30 HE2 PHE 30 0.045 -10.330 1.981
210 HE2 PHE 30 HE1 PHE 30 -1.382 -6.732 0.213
211 HZ PHE 30 HZ PHE 30 0.314 -7.905 1.497
212 H LEU 31 HN LEU 31 -1.303 -11.464 -3.307
213 HA LEU 31 HA LEU 31 -0.841 -8.715 -3.679
214 HB2 LEU 31 HB2 LEU 31 0.879 -10.527 -3.555
215 HB3 LEU 31 HB1 LEU 31 0.449 -10.977 -5.189
216 HG LEU 31 HG LEU 31 1.165 -8.746 -5.975
217 HD11 LEU 31 HD11 LEU 31 0.748 -7.495 -3.918
218 HD12 LEU 31 HD12 LEU 31 2.410 -7.285 -4.462
219 HD13 LEU 31 HD13 LEU 31 2.056 -8.372 -3.115
220 HD21 LEU 31 HD21 LEU 31 3.225 -10.234 -4.351
221 HD22 LEU 31 HD22 LEU 31 3.565 -9.094 -5.657
222 HD23 LEU 31 HD23 LEU 31 2.723 -10.611 -5.999
223 H ASP 32 HN ASP 32 -2.587 -11.000 -5.616
224 HA ASP 32 HA ASP 32 -2.552 -9.238 -7.940
225 HB2 ASP 32 HB2 ASP 32 -2.417 -11.746 -8.194
226 HB3 ASP 32 HB1 ASP 32 -4.086 -11.832 -7.623
227 H LEU 33 HN LEU 33 -4.328 -9.589 -5.135
228 HA LEU 33 HA LEU 33 -6.937 -9.071 -6.206
229 HB2 LEU 33 HB2 LEU 33 -6.503 -10.396 -4.139
230 HB3 LEU 33 HB1 LEU 33 -5.913 -8.951 -3.357
231 HG LEU 33 HG LEU 33 -8.154 -7.978 -3.415
232 HD11 LEU 33 HD11 LEU 33 -8.958 -10.569 -4.746
233 HD12 LEU 33 HD12 LEU 33 -8.922 -8.987 -5.519
234 HD13 LEU 33 HD13 LEU 33 -10.057 -9.299 -4.201
235 HD21 LEU 33 HD21 LEU 33 -8.108 -10.817 -2.385
236 HD22 LEU 33 HD22 LEU 33 -9.227 -9.547 -1.878
237 HD23 LEU 33 HD23 LEU 33 -7.506 -9.396 -1.528
238 H ARG 34 HN ARG 34 -7.829 -7.113 -6.517
239 HA ARG 34 HA ARG 34 -5.927 -4.906 -6.454
240 HB2 ARG 34 HB2 ARG 34 -8.617 -5.017 -7.809
241 HB3 ARG 34 HB1 ARG 34 -7.350 -3.821 -8.065
242 HG2 ARG 34 HG2 ARG 34 -5.897 -5.597 -8.948
243 HG3 ARG 34 HG1 ARG 34 -7.220 -6.748 -8.754
244 HD2 ARG 34 HD2 ARG 34 -8.577 -5.208 -10.226
245 HD3 ARG 34 HD1 ARG 34 -7.067 -4.370 -10.582
246 HE ARG 34 HE ARG 34 -7.238 -7.255 -10.995
247 HH11 ARG 34 HH11 ARG 34 -6.551 -4.081 -12.378
248 HH12 ARG 34 HH12 ARG 34 -6.505 -4.621 -13.992
249 HH21 ARG 34 HH21 ARG 34 -7.163 -8.027 -13.214
250 HH22 ARG 34 HH22 ARG 34 -6.877 -6.939 -14.496
251 H PHE 35 HN PHE 35 -6.426 -2.848 -5.723
252 HA PHE 35 HA PHE 35 -7.689 -2.718 -3.199
253 HB2 PHE 35 HB2 PHE 35 -6.836 -0.470 -5.036
254 HB3 PHE 35 HB1 PHE 35 -7.410 -0.238 -3.392
255 HD1 PHE 35 HD2 PHE 35 -6.038 -0.954 -1.487
256 HD2 PHE 35 HD1 PHE 35 -4.654 -1.297 -5.490
257 HE1 PHE 35 HE2 PHE 35 -3.741 -1.288 -0.666
258 HE2 PHE 35 HE1 PHE 35 -2.361 -1.637 -4.672
259 HZ PHE 35 HZ PHE 35 -1.912 -1.515 -2.200
260 H GLU 36 HN GLU 36 -8.862 -2.214 -6.339
261 HA GLU 36 HA GLU 36 -11.090 -0.568 -5.911
262 HB2 GLU 36 HB2 GLU 36 -10.848 -2.781 -7.937
263 HB3 GLU 36 HB1 GLU 36 -11.860 -1.352 -8.031
264 HG2 GLU 36 HG2 GLU 36 -9.892 0.051 -8.227
265 HG3 GLU 36 HG1 GLU 36 -8.847 -1.365 -8.045
266 H ASP 37 HN ASP 37 -10.762 -4.137 -5.834
267 HA ASP 37 HA ASP 37 -13.604 -4.358 -5.281
268 HB2 ASP 37 HB2 ASP 37 -12.401 -5.981 -6.802
269 HB3 ASP 37 HB1 ASP 37 -11.623 -6.635 -5.365
270 H ILE 38 HN ILE 38 -10.662 -4.355 -3.521
271 HA ILE 38 HA ILE 38 -11.980 -5.495 -1.236
272 HB ILE 38 HB ILE 38 -9.833 -5.158 0.020
273 HG12 ILE 38 HG12 ILE 38 -8.822 -4.295 -2.708
274 HG13 ILE 38 HG11 ILE 38 -8.937 -3.273 -1.285
275 HG21 ILE 38 HG21 ILE 38 -10.411 -7.255 -1.037
276 HG22 ILE 38 HG22 ILE 38 -8.675 -6.968 -1.140
277 HG23 ILE 38 HG23 ILE 38 -9.695 -6.713 -2.558
278 HD11 ILE 38 HD11 ILE 38 -7.115 -5.658 -1.599
279 HD12 ILE 38 HD12 ILE 38 -7.236 -4.645 -0.165
280 HD13 ILE 38 HD13 ILE 38 -6.646 -3.958 -1.676
281 H GLY 39 HN GLY 39 -12.402 -2.726 -2.493
282 HA2 GLY 39 HA2 GLY 39 -13.550 -0.926 -1.744
283 HA3 GLY 39 HA1 GLY 39 -13.674 -1.730 -0.198
284 H TYR 40 HN TYR 40 -10.683 -0.679 -1.800
285 HA TYR 40 HA TYR 40 -10.231 0.965 0.537
286 HB2 TYR 40 HB2 TYR 40 -8.391 0.068 -1.665
287 HB3 TYR 40 HB1 TYR 40 -7.974 1.447 -0.667
288 HD1 TYR 40 HD2 TYR 40 -9.369 -1.972 -0.035
289 HD2 TYR 40 HD1 TYR 40 -6.485 0.966 1.011
290 HE1 TYR 40 HE2 TYR 40 -8.465 -3.476 1.678
291 HE2 TYR 40 HE1 TYR 40 -5.573 -0.531 2.736
292 HH TYR 40 HH TYR 40 -6.130 -2.494 4.025
293 H ASP 41 HN ASP 41 -10.664 2.951 0.644
294 HA ASP 41 HA ASP 41 -11.333 4.435 -1.766
295 HB2 ASP 41 HB2 ASP 41 -11.663 5.097 1.164
296 HB3 ASP 41 HB1 ASP 41 -12.064 6.210 -0.138
297 H SER 42 HN SER 42 -10.660 6.866 -1.527
298 HA SER 42 HA SER 42 -7.944 7.035 -1.956
299 HB2 SER 42 HB2 SER 42 -8.879 9.591 -1.151
300 HB3 SER 42 HB1 SER 42 -8.678 8.990 -2.798
301 H LEU 43 HN LEU 43 -9.854 7.925 0.901
302 HA LEU 43 HA LEU 43 -7.801 8.860 2.548
303 HB2 LEU 43 HB2 LEU 43 -10.315 7.381 3.338
304 HB3 LEU 43 HB1 LEU 43 -9.297 8.283 4.426
305 HG LEU 43 HG LEU 43 -10.857 9.472 2.139
306 HD11 LEU 43 HD11 LEU 43 -11.336 9.569 5.117
307 HD12 LEU 43 HD12 LEU 43 -12.286 8.653 3.949
308 HD13 LEU 43 HD13 LEU 43 -12.279 10.410 3.889
309 HD21 LEU 43 HD21 LEU 43 -8.794 10.698 2.658
310 HD22 LEU 43 HD22 LEU 43 -9.277 10.780 4.352
311 HD23 LEU 43 HD23 LEU 43 -10.226 11.619 3.114
312 H ALA 44 HN ALA 44 -9.162 5.631 2.229
313 HA ALA 44 HA ALA 44 -7.627 4.375 4.226
314 HB1 ALA 44 HB1 ALA 44 -9.699 3.400 3.337
315 HB2 ALA 44 HB2 ALA 44 -8.356 2.263 3.255
316 HB3 ALA 44 HB3 ALA 44 -8.888 3.101 1.798
317 H LEU 45 HN LEU 45 -7.021 4.911 0.818
318 HA LEU 45 HA LEU 45 -4.799 3.172 0.539
319 HB2 LEU 45 HB2 LEU 45 -6.223 4.402 -1.257
320 HB3 LEU 45 HB1 LEU 45 -5.160 5.758 -0.986
321 HG LEU 45 HG LEU 45 -4.360 4.746 -2.926
322 HD11 LEU 45 HD11 LEU 45 -2.516 5.221 -1.492
323 HD12 LEU 45 HD12 LEU 45 -2.198 3.796 -2.479
324 HD13 LEU 45 HD13 LEU 45 -2.626 3.607 -0.781
325 HD21 LEU 45 HD21 LEU 45 -5.613 2.702 -2.852
326 HD22 LEU 45 HD22 LEU 45 -4.491 2.055 -1.618
327 HD23 LEU 45 HD23 LEU 45 -3.909 2.445 -3.241
328 H MET 46 HN MET 46 -5.136 6.580 1.455
329 HA MET 46 HA MET 46 -2.333 7.183 1.514
330 HB2 MET 46 HB2 MET 46 -4.372 8.556 3.252
331 HB3 MET 46 HB1 MET 46 -2.895 9.236 2.565
332 HG2 MET 46 HG2 MET 46 -3.993 8.788 0.323
333 HG3 MET 46 HG1 MET 46 -5.399 8.456 1.344
334 HE1 MET 46 HE1 MET 46 -6.603 10.364 -0.307
335 HE2 MET 46 HE2 MET 46 -5.061 10.779 -1.056
336 HE3 MET 46 HE3 MET 46 -6.065 12.042 -0.349
337 H GLU 47 HN GLU 47 -4.717 6.204 3.769
338 HA GLU 47 HA GLU 47 -3.245 6.176 6.085
339 HB2 GLU 47 HB2 GLU 47 -5.643 5.191 4.940
340 HB3 GLU 47 HB1 GLU 47 -5.232 4.335 6.484
341 HG2 GLU 47 HG2 GLU 47 -5.101 6.753 7.387
342 HG3 GLU 47 HG1 GLU 47 -5.810 7.244 5.853
343 H THR 48 HN THR 48 -3.276 3.915 3.423
344 HA THR 48 HA THR 48 -1.718 1.917 4.807
345 HB THR 48 HB THR 48 -2.201 2.337 1.841
346 HG1 THR 48 HG1 THR 48 -3.665 0.846 3.783
347 HG21 THR 48 HG21 THR 48 -0.319 0.850 2.307
348 HG22 THR 48 HG22 THR 48 -1.683 -0.067 1.658
349 HG23 THR 48 HG23 THR 48 -1.332 -0.111 3.387
350 H ALA 49 HN ALA 49 -1.189 4.161 2.084
351 HA ALA 49 HA ALA 49 1.538 3.651 1.717
352 HB1 ALA 49 HB1 ALA 49 0.065 4.581 -0.001
353 HB2 ALA 49 HB2 ALA 49 1.550 5.510 0.196
354 HB3 ALA 49 HB3 ALA 49 0.033 6.111 0.874
355 H ALA 50 HN ALA 50 0.034 6.457 3.362
356 HA ALA 50 HA ALA 50 2.521 7.745 3.857
357 HB1 ALA 50 HB1 ALA 50 1.219 9.273 5.258
358 HB2 ALA 50 HB2 ALA 50 -0.167 8.181 5.159
359 HB3 ALA 50 HB3 ALA 50 0.423 8.991 3.706
360 H ARG 51 HN ARG 51 0.768 5.329 5.404
361 HA ARG 51 HA ARG 51 1.832 5.594 8.044
362 HB2 ARG 51 HB2 ARG 51 -0.306 4.404 7.022
363 HB3 ARG 51 HB1 ARG 51 0.785 3.046 6.873
364 HG2 ARG 51 HG2 ARG 51 0.196 4.450 9.461
365 HG3 ARG 51 HG1 ARG 51 -0.730 3.085 8.860
366 HD2 ARG 51 HD2 ARG 51 1.416 1.775 8.862
367 HD3 ARG 51 HD1 ARG 51 2.160 3.144 9.703
368 HE ARG 51 HE ARG 51 0.396 2.859 11.396
369 HH11 ARG 51 HH11 ARG 51 1.538 0.100 9.525
370 HH12 ARG 51 HH12 ARG 51 0.853 -1.072 10.565
371 HH21 ARG 51 HH21 ARG 51 -0.550 1.283 12.803
372 HH22 ARG 51 HH22 ARG 51 -0.372 -0.391 12.479
373 H LEU 52 HN LEU 52 2.681 4.058 5.040
374 HA LEU 52 HA LEU 52 4.864 2.501 6.105
375 HB2 LEU 52 HB2 LEU 52 4.116 3.148 3.248
376 HB3 LEU 52 HB1 LEU 52 5.326 1.987 3.749
377 HG LEU 52 HG LEU 52 2.373 1.760 4.308
378 HD11 LEU 52 HD11 LEU 52 2.411 -0.023 2.640
379 HD12 LEU 52 HD12 LEU 52 4.107 0.339 2.312
380 HD13 LEU 52 HD13 LEU 52 2.859 1.534 1.944
381 HD21 LEU 52 HD21 LEU 52 2.917 -0.519 4.993
382 HD22 LEU 52 HD22 LEU 52 3.767 0.667 5.990
383 HD23 LEU 52 HD23 LEU 52 4.627 -0.190 4.714
384 H GLU 53 HN GLU 53 4.349 5.423 4.202
385 HA GLU 53 HA GLU 53 6.907 6.194 3.540
386 HB2 GLU 53 HB2 GLU 53 4.628 7.976 4.379
387 HB3 GLU 53 HB1 GLU 53 6.103 8.539 3.626
388 HG2 GLU 53 HG2 GLU 53 5.554 7.193 1.631
389 HG3 GLU 53 HG1 GLU 53 4.028 6.740 2.398
390 H SER 54 HN SER 54 5.172 6.929 6.513
391 HA SER 54 HA SER 54 7.223 8.493 7.609
392 HB2 SER 54 HB2 SER 54 5.835 8.125 9.736
393 HB3 SER 54 HB1 SER 54 5.047 8.912 8.366
394 HG SER 54 HG SER 54 3.787 7.247 8.093
395 H ARG 55 HN ARG 55 6.171 5.191 8.378
396 HA ARG 55 HA ARG 55 8.147 4.698 10.311
397 HB2 ARG 55 HB2 ARG 55 6.149 3.329 10.244
398 HB3 ARG 55 HB1 ARG 55 6.568 2.725 8.647
399 HG2 ARG 55 HG2 ARG 55 8.566 1.644 9.602
400 HG3 ARG 55 HG1 ARG 55 8.096 2.215 11.199
401 HD2 ARG 55 HD2 ARG 55 6.077 0.866 11.116
402 HD3 ARG 55 HD1 ARG 55 6.445 0.391 9.452
403 HE ARG 55 HE ARG 55 8.492 -0.195 11.380
404 HH11 ARG 55 HH11 ARG 55 5.456 -1.505 10.074
405 HH12 ARG 55 HH12 ARG 55 5.970 -3.111 10.025
406 HH21 ARG 55 HH21 ARG 55 9.193 -2.464 11.407
407 HH22 ARG 55 HH22 ARG 55 8.166 -3.682 10.827
408 H TYR 56 HN TYR 56 8.116 3.778 6.869
409 HA TYR 56 HA TYR 56 10.684 2.499 7.215
410 HB2 TYR 56 HB2 TYR 56 8.940 2.740 4.762
411 HB3 TYR 56 HB1 TYR 56 10.461 1.860 4.818
412 HD1 TYR 56 HD1 TYR 56 10.653 -0.204 6.171
413 HD2 TYR 56 HD2 TYR 56 6.938 1.820 5.753
414 HE1 TYR 56 HE1 TYR 56 9.484 -2.202 6.974
415 HE2 TYR 56 HE2 TYR 56 5.756 -0.187 6.564
416 HH TYR 56 HH TYR 56 7.352 -2.786 8.053
417 H GLY 57 HN GLY 57 9.514 5.505 5.868
418 HA2 GLY 57 HA2 GLY 57 10.985 7.361 5.824
419 HA3 GLY 57 HA1 GLY 57 12.333 6.258 5.587
420 H VAL 58 HN VAL 58 9.256 6.944 3.922
421 HA VAL 58 HA VAL 58 10.824 7.533 1.534
422 HB VAL 58 HB VAL 58 9.321 6.319 0.021
423 HG11 VAL 58 HG11 VAL 58 9.946 4.005 0.553
424 HG12 VAL 58 HG12 VAL 58 10.445 4.537 2.164
425 HG13 VAL 58 HG13 VAL 58 11.287 5.135 0.738
426 HG21 VAL 58 HG21 VAL 58 7.666 4.715 0.835
427 HG22 VAL 58 HG22 VAL 58 7.267 6.357 1.330
428 HG23 VAL 58 HG23 VAL 58 7.970 5.231 2.493
429 H SER 59 HN SER 59 9.307 8.441 -0.238
430 HA SER 59 HA SER 59 7.033 9.912 0.865
431 HB2 SER 59 HB2 SER 59 9.288 11.157 -0.731
432 HB3 SER 59 HB1 SER 59 7.780 11.968 -0.320
433 HG SER 59 HG SER 59 9.623 10.882 1.529
434 H ILE 60 HN ILE 60 5.341 9.586 -0.336
435 HA ILE 60 HA ILE 60 5.594 9.159 -3.243
436 HB ILE 60 HB ILE 60 3.902 7.578 -1.285
437 HG12 ILE 60 HG12 ILE 60 5.994 6.635 -3.252
438 HG13 ILE 60 HG11 ILE 60 6.262 6.847 -1.529
439 HG21 ILE 60 HG21 ILE 60 3.836 7.451 -4.303
440 HG22 ILE 60 HG22 ILE 60 2.557 8.071 -3.262
441 HG23 ILE 60 HG23 ILE 60 2.981 6.360 -3.208
442 HD11 ILE 60 HD11 ILE 60 4.579 5.147 -1.074
443 HD12 ILE 60 HD12 ILE 60 5.887 4.528 -2.079
444 HD13 ILE 60 HD13 ILE 60 4.329 4.942 -2.804
445 HA PRO 61 HA PRO 61 2.447 12.380 -3.203
446 HB2 PRO 61 HB2 PRO 61 1.941 11.393 -5.949
447 HB3 PRO 61 HB1 PRO 61 2.374 13.019 -5.404
448 HG2 PRO 61 HG2 PRO 61 4.134 11.485 -6.708
449 HG3 PRO 61 HG1 PRO 61 4.630 12.567 -5.392
450 HD2 PRO 61 HD2 PRO 61 4.224 9.605 -5.358
451 HD3 PRO 61 HD1 PRO 61 5.484 10.587 -4.576
452 H ASP 62 HN ASP 62 0.476 12.043 -2.397
453 HA ASP 62 HA ASP 62 -0.757 9.515 -2.334
454 HB2 ASP 62 HB2 ASP 62 -2.845 10.798 -1.507
455 HB3 ASP 62 HB1 ASP 62 -1.396 10.825 -0.518
456 H ASP 63 HN ASP 63 -1.135 12.112 -4.518
457 HA ASP 63 HA ASP 63 -3.364 11.372 -5.998
458 HB2 ASP 63 HB2 ASP 63 -2.035 13.394 -6.448
459 HB3 ASP 63 HB1 ASP 63 -0.709 12.389 -7.026
460 H VAL 64 HN VAL 64 -0.049 10.198 -6.210
461 HA VAL 64 HA VAL 64 -0.617 8.355 -8.341
462 HB VAL 64 HB VAL 64 1.931 8.620 -6.699
463 HG11 VAL 64 HG11 VAL 64 3.047 7.540 -8.587
464 HG12 VAL 64 HG12 VAL 64 1.497 7.365 -9.409
465 HG13 VAL 64 HG13 VAL 64 1.797 6.497 -7.899
466 HG21 VAL 64 HG21 VAL 64 1.388 10.725 -7.782
467 HG22 VAL 64 HG22 VAL 64 1.222 9.900 -9.334
468 HG23 VAL 64 HG23 VAL 64 2.795 9.981 -8.539
469 H ALA 65 HN ALA 65 -0.771 8.284 -4.931
470 HA ALA 65 HA ALA 65 -0.332 5.531 -4.560
471 HB1 ALA 65 HB1 ALA 65 -0.147 7.153 -2.727
472 HB2 ALA 65 HB2 ALA 65 -1.376 5.943 -2.363
473 HB3 ALA 65 HB3 ALA 65 -1.855 7.554 -2.893
474 H GLY 66 HN GLY 66 -3.083 7.600 -5.237
475 HA2 GLY 66 HA2 GLY 66 -4.914 5.336 -5.352
476 HA3 GLY 66 HA1 GLY 66 -5.330 7.024 -5.626
477 H ARG 67 HN ARG 67 -2.603 5.635 -7.207
478 HA ARG 67 HA ARG 67 -3.993 5.692 -9.788
479 HB2 ARG 67 HB2 ARG 67 -2.245 7.342 -9.645
480 HB3 ARG 67 HB1 ARG 67 -1.129 6.181 -8.968
481 HG2 ARG 67 HG2 ARG 67 -0.513 6.686 -11.223
482 HG3 ARG 67 HG1 ARG 67 -1.063 5.014 -11.117
483 HD2 ARG 67 HD2 ARG 67 -1.938 6.040 -13.110
484 HD3 ARG 67 HD1 ARG 67 -3.249 5.697 -11.986
485 HE ARG 67 HE ARG 67 -2.479 8.307 -11.501
486 HH11 ARG 67 HH11 ARG 67 -3.717 6.497 -14.263
487 HH12 ARG 67 HH12 ARG 67 -4.627 7.770 -14.913
488 HH21 ARG 67 HH21 ARG 67 -3.633 10.160 -12.425
489 HH22 ARG 67 HH22 ARG 67 -4.517 9.938 -13.853
490 H VAL 68 HN VAL 68 -2.709 3.647 -7.439
491 HA VAL 68 HA VAL 68 -1.538 1.798 -9.292
492 HB VAL 68 HB VAL 68 -0.950 0.385 -7.385
493 HG11 VAL 68 HG11 VAL 68 0.594 1.933 -6.288
494 HG12 VAL 68 HG12 VAL 68 -0.307 3.298 -6.955
495 HG13 VAL 68 HG13 VAL 68 0.539 2.189 -8.032
496 HG21 VAL 68 HG21 VAL 68 -2.882 0.778 -5.941
497 HG22 VAL 68 HG22 VAL 68 -2.369 2.451 -5.695
498 HG23 VAL 68 HG23 VAL 68 -1.375 1.125 -5.091
499 H ASP 69 HN ASP 69 -2.038 -0.581 -8.973
500 HA ASP 69 HA ASP 69 -4.959 -0.906 -9.389
501 HB2 ASP 69 HB2 ASP 69 -3.343 -1.324 -11.361
502 HB3 ASP 69 HB1 ASP 69 -2.733 -2.666 -10.443
503 H THR 70 HN THR 70 -2.093 -2.783 -8.572
504 HA THR 70 HA THR 70 -3.629 -4.351 -6.652
505 HB THR 70 HB THR 70 -1.934 -6.109 -7.171
506 HG1 THR 70 HG1 THR 70 -1.171 -4.792 -9.523
507 HG21 THR 70 HG21 THR 70 -2.791 -6.661 -9.415
508 HG22 THR 70 HG22 THR 70 -3.395 -5.005 -9.562
509 HG23 THR 70 HG23 THR 70 -4.090 -6.093 -8.355
510 HA PRO 71 HA PRO 71 -0.748 -3.147 -3.453
511 HB2 PRO 71 HB2 PRO 71 -0.043 -6.020 -3.085
512 HB3 PRO 71 HB1 PRO 71 -0.603 -4.839 -1.897
513 HG2 PRO 71 HG2 PRO 71 -2.247 -6.713 -2.796
514 HG3 PRO 71 HG1 PRO 71 -2.829 -5.057 -2.530
515 HD2 PRO 71 HD2 PRO 71 -2.116 -6.433 -5.084
516 HD3 PRO 71 HD1 PRO 71 -3.450 -5.302 -4.740
517 H ARG 72 HN ARG 72 0.328 -5.294 -5.990
518 HA ARG 72 HA ARG 72 3.108 -5.200 -5.370
519 HB2 ARG 72 HB2 ARG 72 3.390 -6.638 -7.126
520 HB3 ARG 72 HB1 ARG 72 1.663 -6.835 -6.955
521 HG2 ARG 72 HG2 ARG 72 1.446 -5.037 -8.744
522 HG3 ARG 72 HG1 ARG 72 3.176 -5.257 -9.003
523 HD2 ARG 72 HD2 ARG 72 2.282 -6.711 -10.557
524 HD3 ARG 72 HD1 ARG 72 2.540 -7.789 -9.184
525 HE ARG 72 HE ARG 72 -0.028 -6.471 -9.599
526 HH11 ARG 72 HH11 ARG 72 1.719 -9.555 -9.046
527 HH12 ARG 72 HH12 ARG 72 0.363 -10.517 -9.275
528 HH21 ARG 72 HH21 ARG 72 -1.873 -7.839 -10.008
529 HH22 ARG 72 HH22 ARG 72 -1.757 -9.527 -9.926
530 H GLU 73 HN GLU 73 0.920 -3.182 -7.135
531 HA GLU 73 HA GLU 73 2.857 -1.575 -8.520
532 HB2 GLU 73 HB2 GLU 73 0.031 -0.879 -7.699
533 HB3 GLU 73 HB1 GLU 73 0.995 -0.063 -8.917
534 HG2 GLU 73 HG2 GLU 73 -0.003 -2.892 -9.071
535 HG3 GLU 73 HG1 GLU 73 -0.731 -1.497 -9.859
536 H LEU 74 HN LEU 74 1.070 -1.424 -5.524
537 HA LEU 74 HA LEU 74 1.793 1.159 -4.628
538 HB2 LEU 74 HB2 LEU 74 -0.040 -0.511 -3.798
539 HB3 LEU 74 HB1 LEU 74 1.303 -1.209 -2.899
540 HG LEU 74 HG LEU 74 -0.238 0.311 -1.568
541 HD11 LEU 74 HD11 LEU 74 2.663 1.090 -1.639
542 HD12 LEU 74 HD12 LEU 74 1.946 -0.222 -0.707
543 HD13 LEU 74 HD13 LEU 74 1.521 1.452 -0.343
544 HD21 LEU 74 HD21 LEU 74 0.075 2.727 -1.799
545 HD22 LEU 74 HD22 LEU 74 -0.613 2.014 -3.259
546 HD23 LEU 74 HD23 LEU 74 1.094 2.455 -3.212
547 H LEU 75 HN LEU 75 3.022 -2.071 -3.944
548 HA LEU 75 HA LEU 75 5.078 -1.419 -2.203
549 HB2 LEU 75 HB2 LEU 75 4.035 -3.600 -2.571
550 HB3 LEU 75 HB1 LEU 75 4.791 -3.673 -4.149
551 HG LEU 75 HG LEU 75 6.954 -3.515 -2.994
552 HD11 LEU 75 HD11 LEU 75 7.018 -4.219 -0.616
553 HD12 LEU 75 HD12 LEU 75 5.260 -4.146 -0.577
554 HD13 LEU 75 HD13 LEU 75 6.195 -2.676 -0.836
555 HD21 LEU 75 HD21 LEU 75 6.097 -5.493 -3.968
556 HD22 LEU 75 HD22 LEU 75 5.158 -5.853 -2.526
557 HD23 LEU 75 HD23 LEU 75 6.943 -5.925 -2.472
558 H ASP 76 HN ASP 76 4.905 -1.521 -5.700
559 HA ASP 76 HA ASP 76 7.653 -1.367 -6.338
560 HB2 ASP 76 HB2 ASP 76 6.019 -1.955 -8.048
561 HB3 ASP 76 HB1 ASP 76 5.222 -0.397 -7.860
562 H LEU 77 HN LEU 77 5.182 1.052 -5.800
563 HA LEU 77 HA LEU 77 6.746 3.349 -6.229
564 HB2 LEU 77 HB2 LEU 77 4.430 2.906 -4.366
565 HB3 LEU 77 HB1 LEU 77 5.137 4.462 -4.706
566 HG LEU 77 HG LEU 77 3.710 2.665 -6.636
567 HD11 LEU 77 HD11 LEU 77 2.024 4.492 -6.613
568 HD12 LEU 77 HD12 LEU 77 2.964 5.297 -5.353
569 HD13 LEU 77 HD13 LEU 77 2.227 3.729 -5.036
570 HD21 LEU 77 HD21 LEU 77 5.470 3.909 -7.770
571 HD22 LEU 77 HD22 LEU 77 4.895 5.411 -7.047
572 HD23 LEU 77 HD23 LEU 77 3.890 4.558 -8.214
573 H ILE 78 HN ILE 78 6.025 1.507 -3.325
574 HA ILE 78 HA ILE 78 7.392 3.042 -1.442
575 HB ILE 78 HB ILE 78 6.998 0.038 -1.439
576 HG12 ILE 78 HG12 ILE 78 4.865 1.318 -1.573
577 HG13 ILE 78 HG11 ILE 78 5.035 0.443 -0.059
578 HG21 ILE 78 HG21 ILE 78 7.669 1.902 0.832
579 HG22 ILE 78 HG22 ILE 78 8.729 0.683 0.127
580 HG23 ILE 78 HG23 ILE 78 7.275 0.190 0.993
581 HD11 ILE 78 HD11 ILE 78 4.089 2.646 0.284
582 HD12 ILE 78 HD12 ILE 78 5.511 3.392 -0.445
583 HD13 ILE 78 HD13 ILE 78 5.658 2.511 1.076
584 H ASN 79 HN ASN 79 8.520 -0.045 -2.856
585 HA ASN 79 HA ASN 79 11.108 0.222 -1.809
586 HB2 ASN 79 HB2 ASN 79 10.089 -1.592 -3.991
587 HB3 ASN 79 HB1 ASN 79 11.744 -1.656 -3.392
588 HD21 ASN 79 HD21 ASN 79 9.920 -3.783 -3.279
589 HD22 ASN 79 HD22 ASN 79 9.578 -4.133 -1.622
590 H GLY 80 HN GLY 80 9.811 1.255 -4.875
591 HA2 GLY 80 HA2 GLY 80 12.258 1.858 -6.120
592 HA3 GLY 80 HA1 GLY 80 10.703 2.601 -6.492
593 H ALA 81 HN ALA 81 10.119 3.729 -4.020
594 HA ALA 81 HA ALA 81 11.675 6.132 -4.114
595 HB1 ALA 81 HB1 ALA 81 9.542 5.259 -2.172
596 HB2 ALA 81 HB2 ALA 81 9.278 6.159 -3.668
597 HB3 ALA 81 HB3 ALA 81 10.179 6.894 -2.342
598 H LEU 82 HN LEU 82 11.621 3.267 -2.127
599 HA LEU 82 HA LEU 82 13.046 4.260 0.064
600 HB2 LEU 82 HB2 LEU 82 11.669 2.238 0.119
601 HB3 LEU 82 HB1 LEU 82 12.746 1.474 -1.032
602 HG LEU 82 HG LEU 82 14.525 1.577 0.563
603 HD11 LEU 82 HD11 LEU 82 12.405 2.559 2.500
604 HD12 LEU 82 HD12 LEU 82 13.792 3.481 1.919
605 HD13 LEU 82 HD13 LEU 82 14.046 2.080 2.958
606 HD21 LEU 82 HD21 LEU 82 13.680 -0.191 2.071
607 HD22 LEU 82 HD22 LEU 82 13.225 -0.438 0.383
608 HD23 LEU 82 HD23 LEU 82 12.041 0.178 1.532
609 H ALA 83 HN ALA 83 13.951 2.881 -3.015
610 HA ALA 83 HA ALA 83 16.708 2.571 -2.434
611 HB1 ALA 83 HB1 ALA 83 15.379 2.922 -5.139
612 HB2 ALA 83 HB2 ALA 83 15.667 1.393 -4.306
613 HB3 ALA 83 HB3 ALA 83 17.028 2.366 -4.848
614 H GLU 84 HN GLU 84 14.743 5.332 -3.455
615 HA GLU 84 HA GLU 84 16.862 7.032 -4.180
616 HB2 GLU 84 HB2 GLU 84 14.136 7.706 -3.086
617 HB3 GLU 84 HB1 GLU 84 15.233 8.783 -3.924
618 HG2 GLU 84 HG2 GLU 84 14.980 7.421 -5.960
619 HG3 GLU 84 HG1 GLU 84 13.824 6.404 -5.089
620 H ALA 85 HN ALA 85 15.240 6.160 -1.221
621 HA ALA 85 HA ALA 85 16.274 8.222 0.419
622 HB1 ALA 85 HB1 ALA 85 15.474 6.894 2.304
623 HB2 ALA 85 HB2 ALA 85 15.286 5.493 1.248
624 HB3 ALA 85 HB3 ALA 85 14.272 6.919 1.012
625 H ALA 86 HN ALA 86 17.414 5.058 -0.473
626 HA ALA 86 HA ALA 86 19.420 4.085 -0.475
627 HB1 ALA 86 HB1 ALA 86 21.468 5.368 -0.257
628 HB2 ALA 86 HB2 ALA 86 20.577 6.707 0.461
629 HB3 ALA 86 HB3 ALA 86 20.296 6.270 -1.227
630 H28A SDO 101 H28A SDO 42 -10.591 11.546 -2.109
631 H28B SDO 101 H28B SDO 42 -12.130 12.000 -1.368
632 H30A SDO 101 H30A SDO 42 -10.739 14.151 1.250
633 H30B SDO 101 H30B SDO 42 -11.230 12.461 1.415
634 H30C SDO 101 H30C SDO 42 -12.213 13.581 0.475
635 H31A SDO 101 H31A SDO 42 -8.423 12.329 -0.995
636 H31B SDO 101 H31B SDO 42 -8.989 11.791 0.586
637 H31C SDO 101 H31C SDO 42 -8.515 13.472 0.345
638 H32A SDO 101 H32A SDO 42 -9.934 13.907 -2.428
639 H33A SDO 101 H33A SDO 42 -8.664 15.201 -1.399
640 H36A SDO 101 H36A SDO 42 -10.851 16.538 -1.698
641 H37A SDO 101 H37A SDO 42 -12.823 17.357 -3.108
642 H37B SDO 101 H37B SDO 42 -13.794 16.384 -1.990
643 H38A SDO 101 H38A SDO 42 -12.020 18.725 -1.215
644 H38B SDO 101 H38B SDO 42 -13.749 18.816 -1.439
645 H41A SDO 101 H41A SDO 42 -13.567 15.900 -0.193
646 H42A SDO 101 H42A SDO 42 -12.783 15.541 2.248
647 H42B SDO 101 H42B SDO 42 -14.083 16.704 2.550
648 H43A SDO 101 H43A SDO 42 -14.296 14.049 1.157
649 H43B SDO 101 H43B SDO 42 -15.610 15.181 1.389
650 H1A SDO 101 H1A SDO 42 -15.226 14.912 5.570
651 H1B SDO 101 H1B SDO 42 -13.921 13.776 5.356
652 H2A SDO 101 H2A SDO 42 -13.958 16.597 4.341
653 H2B SDO 101 H2B SDO 42 -12.631 15.471 4.192
654 H4A SDO 101 H4A SDO 42 -13.370 16.658 8.230
655 H4B SDO 101 H4B SDO 42 -12.077 15.500 8.049
656 H5A SDO 101 H5A SDO 42 -13.657 13.797 7.304
657 H5B SDO 101 H5B SDO 42 -14.980 14.938 7.548
658 H6A SDO 101 H6A SDO 42 -14.432 15.098 9.915
659 H6B SDO 101 H6B SDO 42 -13.103 13.956 9.694
660 H8A SDO 101 H8A SDO 42 -16.839 12.672 8.517
661 H8B SDO 101 H8B SDO 42 -15.645 11.365 8.464
662 H8C SDO 101 H8C SDO 42 -15.387 12.843 7.525
Start of MODEL 13
1 H1 MET 1 HT1 MET 1 22.941 -8.415 2.137
2 H2 MET 1 HT2 MET 1 22.913 -6.798 2.629
3 H3 MET 1 HT3 MET 1 22.064 -7.260 1.239
4 HA MET 1 HA MET 1 20.527 -8.474 2.498
5 HB2 MET 1 HB2 MET 1 22.038 -9.219 4.293
6 HB3 MET 1 HB1 MET 1 22.211 -7.571 4.856
7 HG2 MET 1 HG2 MET 1 19.548 -8.958 4.845
8 HG3 MET 1 HG1 MET 1 20.690 -9.158 6.163
9 HE1 MET 1 HE1 MET 1 18.776 -8.361 7.793
10 HE2 MET 1 HE2 MET 1 17.652 -8.041 6.467
11 HE3 MET 1 HE3 MET 1 17.950 -6.805 7.691
12 H ALA 2 HN ALA 2 18.811 -7.286 2.228
13 HA ALA 2 HA ALA 2 18.945 -4.472 3.053
14 HB1 ALA 2 HB1 ALA 2 17.587 -5.584 0.596
15 HB2 ALA 2 HB2 ALA 2 19.087 -4.662 0.626
16 HB3 ALA 2 HB3 ALA 2 17.575 -3.897 1.111
17 H THR 3 HN THR 3 17.248 -3.709 4.109
18 HA THR 3 HA THR 3 15.169 -5.565 4.905
19 HB THR 3 HB THR 3 15.504 -2.661 5.746
20 HG1 THR 3 HG1 THR 3 17.434 -3.753 6.198
21 HG21 THR 3 HG21 THR 3 14.227 -5.056 7.105
22 HG22 THR 3 HG22 THR 3 13.363 -3.711 6.355
23 HG23 THR 3 HG23 THR 3 14.343 -3.437 7.795
24 H LEU 4 HN LEU 4 14.471 -5.584 2.607
25 HA LEU 4 HA LEU 4 13.001 -3.202 1.781
26 HB2 LEU 4 HB2 LEU 4 14.771 -4.369 0.293
27 HB3 LEU 4 HB1 LEU 4 13.571 -5.640 0.103
28 HG LEU 4 HG LEU 4 12.048 -3.977 -0.864
29 HD11 LEU 4 HD11 LEU 4 12.956 -1.796 -1.537
30 HD12 LEU 4 HD12 LEU 4 14.463 -2.168 -0.698
31 HD13 LEU 4 HD13 LEU 4 12.964 -1.985 0.216
32 HD21 LEU 4 HD21 LEU 4 13.258 -3.754 -3.000
33 HD22 LEU 4 HD22 LEU 4 13.423 -5.364 -2.302
34 HD23 LEU 4 HD23 LEU 4 14.751 -4.210 -2.177
35 H LEU 5 HN LEU 5 10.783 -3.568 1.011
36 HA LEU 5 HA LEU 5 9.466 -5.399 2.786
37 HB2 LEU 5 HB2 LEU 5 8.379 -3.457 0.774
38 HB3 LEU 5 HB1 LEU 5 7.389 -4.351 1.895
39 HG LEU 5 HG LEU 5 9.383 -2.193 2.521
40 HD11 LEU 5 HD11 LEU 5 7.416 -1.048 3.413
41 HD12 LEU 5 HD12 LEU 5 6.409 -2.404 2.890
42 HD13 LEU 5 HD13 LEU 5 7.251 -1.417 1.695
43 HD21 LEU 5 HD21 LEU 5 7.790 -3.885 4.439
44 HD22 LEU 5 HD22 LEU 5 8.792 -2.496 4.864
45 HD23 LEU 5 HD23 LEU 5 9.537 -3.960 4.215
46 H THR 6 HN THR 6 8.995 -7.397 2.288
47 HA THR 6 HA THR 6 8.879 -8.167 -0.490
48 HB THR 6 HB THR 6 8.691 -10.489 0.375
49 HG1 THR 6 HG1 THR 6 8.904 -9.254 2.956
50 HG21 THR 6 HG21 THR 6 10.946 -8.883 1.598
51 HG22 THR 6 HG22 THR 6 10.915 -9.584 -0.028
52 HG23 THR 6 HG23 THR 6 10.944 -10.634 1.382
53 H THR 7 HN THR 7 6.972 -10.146 -0.575
54 HA THR 7 HA THR 7 4.589 -8.700 -0.724
55 HB THR 7 HB THR 7 5.030 -11.703 -0.753
56 HG1 THR 7 HG1 THR 7 5.109 -11.251 -3.101
57 HG21 THR 7 HG21 THR 7 2.869 -9.992 -2.018
58 HG22 THR 7 HG22 THR 7 2.658 -11.016 -0.601
59 HG23 THR 7 HG23 THR 7 3.019 -11.741 -2.165
60 H ASP 8 HN ASP 8 5.980 -10.866 1.698
61 HA ASP 8 HA ASP 8 3.623 -11.126 3.269
62 HB2 ASP 8 HB2 ASP 8 5.472 -12.735 3.436
63 HB3 ASP 8 HB1 ASP 8 6.518 -11.478 4.080
64 H ASP 9 HN ASP 9 6.380 -8.949 3.304
65 HA ASP 9 HA ASP 9 5.804 -7.552 5.699
66 HB2 ASP 9 HB2 ASP 9 7.205 -6.540 3.211
67 HB3 ASP 9 HB1 ASP 9 7.092 -5.654 4.727
68 H LEU 10 HN LEU 10 4.979 -6.931 2.347
69 HA LEU 10 HA LEU 10 3.527 -4.575 2.666
70 HB2 LEU 10 HB2 LEU 10 4.257 -5.499 0.508
71 HB3 LEU 10 HB1 LEU 10 3.084 -6.791 0.679
72 HG LEU 10 HG LEU 10 1.283 -5.072 0.684
73 HD11 LEU 10 HD11 LEU 10 1.777 -2.845 -0.190
74 HD12 LEU 10 HD12 LEU 10 3.500 -3.217 -0.155
75 HD13 LEU 10 HD13 LEU 10 2.590 -3.140 1.351
76 HD21 LEU 10 HD21 LEU 10 3.046 -5.184 -1.753
77 HD22 LEU 10 HD22 LEU 10 1.341 -4.733 -1.735
78 HD23 LEU 10 HD23 LEU 10 1.828 -6.375 -1.293
79 H ARG 11 HN ARG 11 2.473 -7.960 2.765
80 HA ARG 11 HA ARG 11 -0.274 -7.538 3.034
81 HB2 ARG 11 HB2 ARG 11 0.631 -9.772 2.619
82 HB3 ARG 11 HB1 ARG 11 1.408 -9.747 4.192
83 HG2 ARG 11 HG2 ARG 11 -0.701 -9.801 5.325
84 HG3 ARG 11 HG1 ARG 11 -1.575 -9.610 3.799
85 HD2 ARG 11 HD2 ARG 11 -1.607 -11.906 4.609
86 HD3 ARG 11 HD1 ARG 11 -0.779 -11.760 3.060
87 HE ARG 11 HE ARG 11 1.199 -11.612 4.948
88 HH11 ARG 11 HH11 ARG 11 -1.421 -13.863 4.412
89 HH12 ARG 11 HH12 ARG 11 -0.498 -15.278 4.620
90 HH21 ARG 11 HH21 ARG 11 2.537 -13.528 5.392
91 HH22 ARG 11 HH22 ARG 11 1.803 -15.058 5.302
92 H ARG 12 HN ARG 12 2.193 -7.774 5.554
93 HA ARG 12 HA ARG 12 0.359 -7.564 7.688
94 HB2 ARG 12 HB2 ARG 12 3.243 -6.691 7.701
95 HB3 ARG 12 HB1 ARG 12 2.252 -7.055 9.109
96 HG2 ARG 12 HG2 ARG 12 2.097 -9.391 8.353
97 HG3 ARG 12 HG1 ARG 12 3.151 -8.988 6.991
98 HD2 ARG 12 HD2 ARG 12 3.802 -8.970 9.929
99 HD3 ARG 12 HD1 ARG 12 4.549 -9.938 8.656
100 HE ARG 12 HE ARG 12 4.935 -7.079 9.154
101 HH11 ARG 12 HH11 ARG 12 5.920 -9.987 7.238
102 HH12 ARG 12 HH12 ARG 12 7.385 -9.283 6.777
103 HH21 ARG 12 HH21 ARG 12 7.004 -6.164 8.392
104 HH22 ARG 12 HH22 ARG 12 7.934 -7.115 7.332
105 H ALA 13 HN ALA 13 2.008 -5.139 5.743
106 HA ALA 13 HA ALA 13 1.322 -2.894 7.308
107 HB1 ALA 13 HB1 ALA 13 1.711 -1.564 5.276
108 HB2 ALA 13 HB2 ALA 13 1.801 -3.046 4.329
109 HB3 ALA 13 HB3 ALA 13 3.030 -2.710 5.561
110 H LEU 14 HN LEU 14 -0.307 -4.472 4.530
111 HA LEU 14 HA LEU 14 -2.453 -2.718 4.432
112 HB2 LEU 14 HB2 LEU 14 -1.796 -5.389 3.342
113 HB3 LEU 14 HB1 LEU 14 -3.466 -4.935 3.362
114 HG LEU 14 HG LEU 14 -2.448 -4.472 1.191
115 HD11 LEU 14 HD11 LEU 14 -4.280 -3.074 1.857
116 HD12 LEU 14 HD12 LEU 14 -3.099 -2.124 0.948
117 HD13 LEU 14 HD13 LEU 14 -3.176 -1.982 2.702
118 HD21 LEU 14 HD21 LEU 14 -0.780 -2.670 0.934
119 HD22 LEU 14 HD22 LEU 14 -0.155 -4.045 1.851
120 HD23 LEU 14 HD23 LEU 14 -0.645 -2.575 2.693
121 H VAL 15 HN VAL 15 -1.775 -5.389 6.484
122 HA VAL 15 HA VAL 15 -4.454 -5.711 7.472
123 HB VAL 15 HB VAL 15 -1.792 -6.439 8.777
124 HG11 VAL 15 HG11 VAL 15 -4.590 -7.290 9.507
125 HG12 VAL 15 HG12 VAL 15 -3.548 -6.228 10.459
126 HG13 VAL 15 HG13 VAL 15 -3.117 -7.924 10.228
127 HG21 VAL 15 HG21 VAL 15 -2.320 -8.735 8.081
128 HG22 VAL 15 HG22 VAL 15 -2.171 -7.647 6.704
129 HG23 VAL 15 HG23 VAL 15 -3.767 -8.145 7.261
130 H GLU 16 HN GLU 16 -1.516 -4.161 8.729
131 HA GLU 16 HA GLU 16 -2.554 -2.938 10.967
132 HB2 GLU 16 HB2 GLU 16 -0.364 -1.974 9.170
133 HB3 GLU 16 HB1 GLU 16 -0.672 -1.400 10.802
134 HG2 GLU 16 HG2 GLU 16 -0.307 -3.742 11.593
135 HG3 GLU 16 HG1 GLU 16 0.179 -4.135 9.951
136 H SER 17 HN SER 17 -2.471 -1.646 7.620
137 HA SER 17 HA SER 17 -3.294 0.925 8.297
138 HB2 SER 17 HB2 SER 17 -3.984 0.985 5.825
139 HB3 SER 17 HB1 SER 17 -2.289 0.648 6.179
140 HG SER 17 HG SER 17 -4.312 -1.054 5.235
141 H ALA 18 HN ALA 18 -5.128 -1.963 7.486
142 HA ALA 18 HA ALA 18 -7.660 -0.642 7.580
143 HB1 ALA 18 HB1 ALA 18 -7.380 -2.685 6.261
144 HB2 ALA 18 HB2 ALA 18 -8.591 -2.936 7.515
145 HB3 ALA 18 HB3 ALA 18 -6.960 -3.582 7.715
146 H GLY 19 HN GLY 19 -5.918 -2.865 9.706
147 HA2 GLY 19 HA2 GLY 19 -5.880 -3.069 11.971
148 HA3 GLY 19 HA1 GLY 19 -6.745 -1.538 12.078
149 H GLU 20 HN GLU 20 -8.758 -1.594 12.756
150 HA GLU 20 HA GLU 20 -10.099 -4.163 12.616
151 HB2 GLU 20 HB2 GLU 20 -11.412 -3.441 14.626
152 HB3 GLU 20 HB1 GLU 20 -9.716 -3.759 14.938
153 HG2 GLU 20 HG2 GLU 20 -9.259 -1.402 15.023
154 HG3 GLU 20 HG1 GLU 20 -10.921 -1.029 14.554
155 H THR 21 HN THR 21 -11.398 -4.095 11.053
156 HA THR 21 HA THR 21 -13.555 -2.348 10.944
157 HB THR 21 HB THR 21 -11.802 -0.807 10.057
158 HG1 THR 21 HG1 THR 21 -12.903 -0.384 7.969
159 HG21 THR 21 HG21 THR 21 -11.468 -2.866 7.858
160 HG22 THR 21 HG22 THR 21 -10.249 -2.389 9.041
161 HG23 THR 21 HG23 THR 21 -10.785 -1.241 7.816
162 H ASP 22 HN ASP 22 -13.967 -2.804 8.105
163 HA ASP 22 HA ASP 22 -14.641 -5.616 8.238
164 HB2 ASP 22 HB2 ASP 22 -16.261 -4.044 7.302
165 HB3 ASP 22 HB1 ASP 22 -15.097 -3.604 6.054
166 H GLY 23 HN GLY 23 -12.825 -6.750 8.122
167 HA2 GLY 23 HA2 GLY 23 -10.978 -6.157 5.971
168 HA3 GLY 23 HA1 GLY 23 -10.624 -7.184 7.357
169 H THR 24 HN THR 24 -10.724 -7.370 4.244
170 HA THR 24 HA THR 24 -12.370 -9.685 3.827
171 HB THR 24 HB THR 24 -11.202 -9.506 1.531
172 HG1 THR 24 HG1 THR 24 -9.520 -8.311 1.619
173 HG21 THR 24 HG21 THR 24 -12.530 -7.586 0.862
174 HG22 THR 24 HG22 THR 24 -12.655 -7.048 2.528
175 HG23 THR 24 HG23 THR 24 -13.460 -8.535 2.018
176 H ASP 25 HN ASP 25 -10.707 -11.199 2.127
177 HA ASP 25 HA ASP 25 -8.759 -12.248 4.014
178 HB2 ASP 25 HB2 ASP 25 -10.282 -13.888 2.897
179 HB3 ASP 25 HB1 ASP 25 -9.631 -13.399 1.337
180 H LEU 26 HN LEU 26 -6.604 -12.270 3.579
181 HA LEU 26 HA LEU 26 -5.718 -10.783 1.206
182 HB2 LEU 26 HB2 LEU 26 -6.026 -9.505 3.478
183 HB3 LEU 26 HB1 LEU 26 -4.567 -10.343 3.947
184 HG LEU 26 HG LEU 26 -3.425 -9.280 1.983
185 HD11 LEU 26 HD11 LEU 26 -4.526 -7.339 0.955
186 HD12 LEU 26 HD12 LEU 26 -5.991 -7.697 1.878
187 HD13 LEU 26 HD13 LEU 26 -5.431 -8.830 0.654
188 HD21 LEU 26 HD21 LEU 26 -4.671 -7.447 4.026
189 HD22 LEU 26 HD22 LEU 26 -3.234 -7.092 3.070
190 HD23 LEU 26 HD23 LEU 26 -3.209 -8.401 4.256
191 H SER 27 HN SER 27 -5.819 -13.636 2.161
192 HA SER 27 HA SER 27 -3.140 -14.254 3.022
193 HB2 SER 27 HB2 SER 27 -5.072 -15.390 4.035
194 HB3 SER 27 HB1 SER 27 -5.518 -16.031 2.457
195 HG SER 27 HG SER 27 -3.538 -16.779 4.222
196 H GLY 28 HN GLY 28 -1.576 -14.998 1.783
197 HA2 GLY 28 HA2 GLY 28 -0.442 -15.925 0.039
198 HA3 GLY 28 HA1 GLY 28 -1.965 -16.609 -0.490
199 H ASP 29 HN ASP 29 -2.823 -15.857 -2.268
200 HA ASP 29 HA ASP 29 -1.341 -13.829 -3.657
201 HB2 ASP 29 HB2 ASP 29 -3.410 -15.789 -4.591
202 HB3 ASP 29 HB1 ASP 29 -2.885 -14.448 -5.605
203 H PHE 30 HN PHE 30 -1.988 -12.215 -2.262
204 HA PHE 30 HA PHE 30 -4.593 -10.983 -2.960
205 HB2 PHE 30 HB2 PHE 30 -4.337 -9.594 -1.014
206 HB3 PHE 30 HB1 PHE 30 -3.900 -11.215 -0.501
207 HD1 PHE 30 HD2 PHE 30 -1.415 -11.797 -0.373
208 HD2 PHE 30 HD1 PHE 30 -2.837 -7.809 -0.755
209 HE1 PHE 30 HE2 PHE 30 0.729 -10.962 0.502
210 HE2 PHE 30 HE1 PHE 30 -0.684 -6.967 0.118
211 HZ PHE 30 HZ PHE 30 1.121 -8.466 0.573
212 H LEU 31 HN LEU 31 -1.476 -11.092 -3.921
213 HA LEU 31 HA LEU 31 -0.692 -8.366 -3.949
214 HB2 LEU 31 HB2 LEU 31 0.794 -10.430 -3.881
215 HB3 LEU 31 HB1 LEU 31 0.471 -10.610 -5.590
216 HG LEU 31 HG LEU 31 1.456 -8.343 -5.943
217 HD11 LEU 31 HD11 LEU 31 2.193 -8.636 -3.041
218 HD12 LEU 31 HD12 LEU 31 1.111 -7.432 -3.742
219 HD13 LEU 31 HD13 LEU 31 2.830 -7.407 -4.140
220 HD21 LEU 31 HD21 LEU 31 3.777 -9.076 -5.668
221 HD22 LEU 31 HD22 LEU 31 2.783 -10.379 -6.319
222 HD23 LEU 31 HD23 LEU 31 3.245 -10.382 -4.614
223 H ASP 32 HN ASP 32 -2.303 -10.466 -6.160
224 HA ASP 32 HA ASP 32 -2.301 -8.434 -8.286
225 HB2 ASP 32 HB2 ASP 32 -1.530 -10.733 -8.852
226 HB3 ASP 32 HB1 ASP 32 -3.091 -11.362 -8.362
227 H LEU 33 HN LEU 33 -4.007 -8.882 -5.685
228 HA LEU 33 HA LEU 33 -6.682 -8.925 -6.820
229 HB2 LEU 33 HB2 LEU 33 -6.109 -10.109 -4.658
230 HB3 LEU 33 HB1 LEU 33 -5.806 -8.545 -3.939
231 HG LEU 33 HG LEU 33 -8.171 -7.941 -4.229
232 HD11 LEU 33 HD11 LEU 33 -8.670 -9.297 -6.194
233 HD12 LEU 33 HD12 LEU 33 -9.791 -9.653 -4.878
234 HD13 LEU 33 HD13 LEU 33 -8.471 -10.766 -5.240
235 HD21 LEU 33 HD21 LEU 33 -7.438 -8.952 -2.148
236 HD22 LEU 33 HD22 LEU 33 -7.715 -10.563 -2.811
237 HD23 LEU 33 HD23 LEU 33 -9.073 -9.473 -2.543
238 H ARG 34 HN ARG 34 -8.161 -6.990 -5.859
239 HA ARG 34 HA ARG 34 -6.586 -4.609 -6.536
240 HB2 ARG 34 HB2 ARG 34 -9.547 -5.021 -6.992
241 HB3 ARG 34 HB1 ARG 34 -8.538 -3.727 -7.635
242 HG2 ARG 34 HG2 ARG 34 -7.311 -5.318 -8.993
243 HG3 ARG 34 HG1 ARG 34 -8.243 -6.642 -8.293
244 HD2 ARG 34 HD2 ARG 34 -9.203 -6.227 -10.393
245 HD3 ARG 34 HD1 ARG 34 -10.289 -5.521 -9.205
246 HE ARG 34 HE ARG 34 -8.398 -3.645 -10.192
247 HH11 ARG 34 HH11 ARG 34 -11.474 -5.223 -10.861
248 HH12 ARG 34 HH12 ARG 34 -12.013 -4.097 -12.015
249 HH21 ARG 34 HH21 ARG 34 -9.124 -2.058 -11.861
250 HH22 ARG 34 HH22 ARG 34 -10.638 -2.292 -12.617
251 H PHE 35 HN PHE 35 -6.996 -2.717 -5.425
252 HA PHE 35 HA PHE 35 -7.513 -2.921 -2.685
253 HB2 PHE 35 HB2 PHE 35 -7.332 -0.520 -4.474
254 HB3 PHE 35 HB1 PHE 35 -7.748 -0.347 -2.778
255 HD1 PHE 35 HD2 PHE 35 -6.117 -0.979 -1.044
256 HD2 PHE 35 HD1 PHE 35 -5.085 -0.984 -5.164
257 HE1 PHE 35 HE2 PHE 35 -3.739 -0.986 -0.441
258 HE2 PHE 35 HE1 PHE 35 -2.698 -0.991 -4.568
259 HZ PHE 35 HZ PHE 35 -2.023 -0.992 -2.201
260 H GLU 36 HN GLU 36 -9.737 -2.300 -5.240
261 HA GLU 36 HA GLU 36 -11.859 -1.305 -3.667
262 HB2 GLU 36 HB2 GLU 36 -13.316 -2.010 -5.557
263 HB3 GLU 36 HB1 GLU 36 -11.934 -1.048 -6.064
264 HG2 GLU 36 HG2 GLU 36 -10.795 -2.991 -6.860
265 HG3 GLU 36 HG1 GLU 36 -12.033 -4.049 -6.194
266 H ASP 37 HN ASP 37 -10.750 -4.539 -4.412
267 HA ASP 37 HA ASP 37 -13.090 -5.878 -3.432
268 HB2 ASP 37 HB2 ASP 37 -10.322 -6.986 -3.956
269 HB3 ASP 37 HB1 ASP 37 -11.773 -7.940 -3.652
270 H ILE 38 HN ILE 38 -10.108 -4.761 -2.118
271 HA ILE 38 HA ILE 38 -10.642 -6.223 0.329
272 HB ILE 38 HB ILE 38 -8.409 -5.453 1.133
273 HG12 ILE 38 HG12 ILE 38 -8.126 -4.338 -1.678
274 HG13 ILE 38 HG11 ILE 38 -8.235 -3.382 -0.210
275 HG21 ILE 38 HG21 ILE 38 -7.108 -6.888 -0.379
276 HG22 ILE 38 HG22 ILE 38 -8.450 -6.887 -1.512
277 HG23 ILE 38 HG23 ILE 38 -8.645 -7.610 0.095
278 HD11 ILE 38 HD11 ILE 38 -6.102 -4.344 0.548
279 HD12 ILE 38 HD12 ILE 38 -5.946 -3.521 -1.005
280 HD13 ILE 38 HD13 ILE 38 -6.011 -5.283 -0.942
281 H GLY 39 HN GLY 39 -11.990 -3.707 -0.728
282 HA2 GLY 39 HA2 GLY 39 -13.304 -2.166 0.322
283 HA3 GLY 39 HA1 GLY 39 -12.762 -2.825 1.851
284 H TYR 40 HN TYR 40 -10.660 -1.371 -0.579
285 HA TYR 40 HA TYR 40 -10.056 0.654 1.422
286 HB2 TYR 40 HB2 TYR 40 -8.388 -0.610 -0.693
287 HB3 TYR 40 HB1 TYR 40 -8.000 1.034 -0.194
288 HD1 TYR 40 HD2 TYR 40 -8.560 -2.383 1.178
289 HD2 TYR 40 HD1 TYR 40 -6.756 1.419 1.703
290 HE1 TYR 40 HE2 TYR 40 -7.402 -3.223 3.161
291 HE2 TYR 40 HE1 TYR 40 -5.592 0.602 3.700
292 HH TYR 40 HH TYR 40 -5.482 -2.707 4.591
293 H ASP 41 HN ASP 41 -10.707 2.556 1.242
294 HA ASP 41 HA ASP 41 -11.784 3.681 -1.196
295 HB2 ASP 41 HB2 ASP 41 -11.242 4.943 1.527
296 HB3 ASP 41 HB1 ASP 41 -11.939 5.801 0.167
297 H SER 42 HN SER 42 -10.913 5.960 -1.783
298 HA SER 42 HA SER 42 -8.206 5.733 -2.556
299 HB2 SER 42 HB2 SER 42 -8.527 8.142 -3.186
300 HB3 SER 42 HB1 SER 42 -9.742 7.039 -3.868
301 H LEU 43 HN LEU 43 -9.887 7.743 -0.176
302 HA LEU 43 HA LEU 43 -7.711 8.986 1.014
303 HB2 LEU 43 HB2 LEU 43 -10.473 8.397 1.805
304 HB3 LEU 43 HB1 LEU 43 -9.371 8.636 3.142
305 HG LEU 43 HG LEU 43 -9.785 10.634 0.917
306 HD11 LEU 43 HD11 LEU 43 -10.846 10.564 3.752
307 HD12 LEU 43 HD12 LEU 43 -11.803 10.409 2.281
308 HD13 LEU 43 HD13 LEU 43 -10.982 11.928 2.645
309 HD21 LEU 43 HD21 LEU 43 -7.580 10.717 1.938
310 HD22 LEU 43 HD22 LEU 43 -8.291 10.757 3.540
311 HD23 LEU 43 HD23 LEU 43 -8.532 12.117 2.433
312 H ALA 44 HN ALA 44 -9.068 5.833 1.573
313 HA ALA 44 HA ALA 44 -7.567 5.207 3.876
314 HB1 ALA 44 HB1 ALA 44 -8.710 3.312 1.824
315 HB2 ALA 44 HB2 ALA 44 -9.568 3.946 3.226
316 HB3 ALA 44 HB3 ALA 44 -8.175 2.886 3.449
317 H LEU 45 HN LEU 45 -6.865 4.932 0.435
318 HA LEU 45 HA LEU 45 -4.449 3.477 0.869
319 HB2 LEU 45 HB2 LEU 45 -5.736 3.313 -1.189
320 HB3 LEU 45 HB1 LEU 45 -5.363 4.983 -1.546
321 HG LEU 45 HG LEU 45 -3.232 4.476 -2.319
322 HD11 LEU 45 HD11 LEU 45 -3.237 1.971 -0.570
323 HD12 LEU 45 HD12 LEU 45 -2.439 3.492 -0.147
324 HD13 LEU 45 HD13 LEU 45 -1.896 2.589 -1.553
325 HD21 LEU 45 HD21 LEU 45 -3.320 2.373 -3.455
326 HD22 LEU 45 HD22 LEU 45 -4.927 3.185 -3.497
327 HD23 LEU 45 HD23 LEU 45 -4.564 1.911 -2.295
328 H MET 46 HN MET 46 -5.278 6.881 0.429
329 HA MET 46 HA MET 46 -2.664 7.995 0.264
330 HB2 MET 46 HB2 MET 46 -4.889 9.307 1.865
331 HB3 MET 46 HB1 MET 46 -3.630 10.096 0.927
332 HG2 MET 46 HG2 MET 46 -4.704 9.098 -1.082
333 HG3 MET 46 HG1 MET 46 -5.971 8.598 0.045
334 HE1 MET 46 HE1 MET 46 -7.600 11.565 -1.966
335 HE2 MET 46 HE2 MET 46 -7.711 9.853 -1.557
336 HE3 MET 46 HE3 MET 46 -6.405 10.426 -2.589
337 H GLU 47 HN GLU 47 -4.789 7.319 2.879
338 HA GLU 47 HA GLU 47 -3.368 7.940 5.135
339 HB2 GLU 47 HB2 GLU 47 -5.727 7.324 4.653
340 HB3 GLU 47 HB1 GLU 47 -5.230 5.666 4.610
341 HG2 GLU 47 HG2 GLU 47 -6.180 6.129 6.790
342 HG3 GLU 47 HG1 GLU 47 -4.465 5.724 6.887
343 H THR 48 HN THR 48 -3.691 4.769 3.513
344 HA THR 48 HA THR 48 -1.903 3.197 4.928
345 HB THR 48 HB THR 48 -2.650 3.172 1.997
346 HG1 THR 48 HG1 THR 48 -4.414 2.844 3.328
347 HG21 THR 48 HG21 THR 48 -2.003 0.818 1.916
348 HG22 THR 48 HG22 THR 48 -1.344 0.902 3.565
349 HG23 THR 48 HG23 THR 48 -0.615 1.836 2.252
350 H ALA 49 HN ALA 49 -1.285 5.125 2.015
351 HA ALA 49 HA ALA 49 1.392 4.444 1.648
352 HB1 ALA 49 HB1 ALA 49 1.528 6.394 0.174
353 HB2 ALA 49 HB2 ALA 49 0.005 6.996 0.822
354 HB3 ALA 49 HB3 ALA 49 0.035 5.493 -0.097
355 H ALA 50 HN ALA 50 -0.044 7.341 3.208
356 HA ALA 50 HA ALA 50 2.377 8.544 3.992
357 HB1 ALA 50 HB1 ALA 50 -0.358 8.818 5.241
358 HB2 ALA 50 HB2 ALA 50 0.242 9.752 3.871
359 HB3 ALA 50 HB3 ALA 50 0.989 9.937 5.461
360 H ARG 51 HN ARG 51 0.331 6.180 5.510
361 HA ARG 51 HA ARG 51 1.427 6.167 8.100
362 HB2 ARG 51 HB2 ARG 51 -0.698 5.037 6.969
363 HB3 ARG 51 HB1 ARG 51 0.375 3.675 6.777
364 HG2 ARG 51 HG2 ARG 51 -0.215 4.967 9.426
365 HG3 ARG 51 HG1 ARG 51 -1.166 3.658 8.754
366 HD2 ARG 51 HD2 ARG 51 0.810 2.209 8.779
367 HD3 ARG 51 HD1 ARG 51 1.778 3.529 9.447
368 HE ARG 51 HE ARG 51 -0.090 3.483 11.217
369 HH11 ARG 51 HH11 ARG 51 1.533 0.713 9.805
370 HH12 ARG 51 HH12 ARG 51 1.249 -0.341 11.117
371 HH21 ARG 51 HH21 ARG 51 -0.593 2.058 12.986
372 HH22 ARG 51 HH22 ARG 51 -0.007 0.455 12.991
373 H LEU 52 HN LEU 52 2.356 4.697 5.062
374 HA LEU 52 HA LEU 52 4.472 3.121 6.221
375 HB2 LEU 52 HB2 LEU 52 3.857 3.729 3.324
376 HB3 LEU 52 HB1 LEU 52 5.054 2.572 3.888
377 HG LEU 52 HG LEU 52 2.067 2.377 4.274
378 HD11 LEU 52 HD11 LEU 52 2.236 0.442 2.785
379 HD12 LEU 52 HD12 LEU 52 3.944 0.805 2.535
380 HD13 LEU 52 HD13 LEU 52 2.711 1.951 2.004
381 HD21 LEU 52 HD21 LEU 52 3.251 1.418 6.182
382 HD22 LEU 52 HD22 LEU 52 4.253 0.456 5.093
383 HD23 LEU 52 HD23 LEU 52 2.517 0.153 5.200
384 H GLU 53 HN GLU 53 4.155 6.198 4.502
385 HA GLU 53 HA GLU 53 6.849 6.802 4.075
386 HB2 GLU 53 HB2 GLU 53 4.674 8.767 4.859
387 HB3 GLU 53 HB1 GLU 53 6.219 9.176 4.147
388 HG2 GLU 53 HG2 GLU 53 5.590 7.998 2.103
389 HG3 GLU 53 HG1 GLU 53 4.017 7.618 2.816
390 H SER 54 HN SER 54 4.827 7.544 6.904
391 HA SER 54 HA SER 54 6.832 8.807 8.425
392 HB2 SER 54 HB2 SER 54 4.415 7.297 9.449
393 HB3 SER 54 HB1 SER 54 5.295 8.559 10.301
394 HG SER 54 HG SER 54 4.643 9.636 8.023
395 H ARG 55 HN ARG 55 6.104 5.462 7.904
396 HA ARG 55 HA ARG 55 7.507 4.512 10.232
397 HB2 ARG 55 HB2 ARG 55 5.520 3.342 9.485
398 HB3 ARG 55 HB1 ARG 55 6.230 3.064 7.913
399 HG2 ARG 55 HG2 ARG 55 7.850 1.533 8.876
400 HG3 ARG 55 HG1 ARG 55 7.235 1.876 10.503
401 HD2 ARG 55 HD2 ARG 55 5.072 0.974 9.922
402 HD3 ARG 55 HD1 ARG 55 5.572 0.752 8.254
403 HE ARG 55 HE ARG 55 7.329 -0.797 9.478
404 HH11 ARG 55 HH11 ARG 55 3.992 -0.420 10.525
405 HH12 ARG 55 HH12 ARG 55 3.665 -2.082 10.657
406 HH21 ARG 55 HH21 ARG 55 6.962 -3.118 9.724
407 HH22 ARG 55 HH22 ARG 55 5.429 -3.660 10.202
408 H TYR 56 HN TYR 56 8.172 4.628 6.729
409 HA TYR 56 HA TYR 56 10.763 3.413 7.355
410 HB2 TYR 56 HB2 TYR 56 9.289 3.475 4.730
411 HB3 TYR 56 HB1 TYR 56 10.916 2.826 4.940
412 HD1 TYR 56 HD1 TYR 56 11.172 0.977 6.748
413 HD2 TYR 56 HD2 TYR 56 7.450 2.076 5.019
414 HE1 TYR 56 HE1 TYR 56 10.221 -1.181 7.445
415 HE2 TYR 56 HE2 TYR 56 6.486 -0.081 5.715
416 HH TYR 56 HH TYR 56 7.306 -2.349 6.250
417 H GLY 57 HN GLY 57 9.476 6.415 6.448
418 HA2 GLY 57 HA2 GLY 57 10.675 8.396 6.248
419 HA3 GLY 57 HA1 GLY 57 12.158 7.455 6.163
420 H VAL 58 HN VAL 58 9.194 7.518 4.215
421 HA VAL 58 HA VAL 58 10.841 8.058 1.838
422 HB VAL 58 HB VAL 58 9.330 6.635 0.465
423 HG11 VAL 58 HG11 VAL 58 11.367 5.617 1.365
424 HG12 VAL 58 HG12 VAL 58 10.038 4.450 1.213
425 HG13 VAL 58 HG13 VAL 58 10.450 5.111 2.796
426 HG21 VAL 58 HG21 VAL 58 7.741 5.106 1.521
427 HG22 VAL 58 HG22 VAL 58 7.321 6.794 1.822
428 HG23 VAL 58 HG23 VAL 58 8.082 5.836 3.093
429 H SER 59 HN SER 59 9.141 8.699 -0.072
430 HA SER 59 HA SER 59 6.869 10.133 0.989
431 HB2 SER 59 HB2 SER 59 9.040 11.526 -0.600
432 HB3 SER 59 HB1 SER 59 7.490 12.234 -0.143
433 HG SER 59 HG SER 59 8.535 11.211 2.016
434 H ILE 60 HN ILE 60 5.236 9.551 -0.138
435 HA ILE 60 HA ILE 60 5.521 9.194 -3.040
436 HB ILE 60 HB ILE 60 3.669 7.640 -1.179
437 HG12 ILE 60 HG12 ILE 60 4.738 5.618 -2.304
438 HG13 ILE 60 HG11 ILE 60 5.931 6.726 -2.977
439 HG21 ILE 60 HG21 ILE 60 3.702 7.591 -4.186
440 HG22 ILE 60 HG22 ILE 60 2.429 8.249 -3.158
441 HG23 ILE 60 HG23 ILE 60 2.757 6.516 -3.154
442 HD11 ILE 60 HD11 ILE 60 6.657 7.284 -0.720
443 HD12 ILE 60 HD12 ILE 60 6.765 5.549 -1.024
444 HD13 ILE 60 HD13 ILE 60 5.440 6.200 -0.058
445 HA PRO 61 HA PRO 61 2.798 12.756 -2.975
446 HB2 PRO 61 HB2 PRO 61 2.606 12.063 -5.858
447 HB3 PRO 61 HB1 PRO 61 3.027 13.606 -5.106
448 HG2 PRO 61 HG2 PRO 61 4.908 12.116 -6.244
449 HG3 PRO 61 HG1 PRO 61 5.233 12.964 -4.714
450 HD2 PRO 61 HD2 PRO 61 4.602 10.070 -5.175
451 HD3 PRO 61 HD1 PRO 61 5.794 10.815 -4.080
452 H ASP 62 HN ASP 62 0.641 13.095 -3.053
453 HA ASP 62 HA ASP 62 -1.114 11.136 -2.325
454 HB2 ASP 62 HB2 ASP 62 -1.855 13.682 -3.756
455 HB3 ASP 62 HB1 ASP 62 -2.898 12.729 -2.712
456 H ASP 63 HN ASP 63 -0.928 12.634 -5.544
457 HA ASP 63 HA ASP 63 -3.079 11.059 -6.533
458 HB2 ASP 63 HB2 ASP 63 -2.776 12.110 -8.652
459 HB3 ASP 63 HB1 ASP 63 -2.494 13.339 -7.419
460 H VAL 64 HN VAL 64 0.228 10.407 -6.155
461 HA VAL 64 HA VAL 64 0.465 8.628 -8.389
462 HB VAL 64 HB VAL 64 2.267 8.912 -5.952
463 HG11 VAL 64 HG11 VAL 64 2.550 6.732 -7.026
464 HG12 VAL 64 HG12 VAL 64 3.959 7.763 -7.298
465 HG13 VAL 64 HG13 VAL 64 2.772 7.524 -8.589
466 HG21 VAL 64 HG21 VAL 64 3.722 10.186 -7.454
467 HG22 VAL 64 HG22 VAL 64 2.150 10.957 -7.263
468 HG23 VAL 64 HG23 VAL 64 2.513 10.049 -8.733
469 H ALA 65 HN ALA 65 -0.313 8.348 -4.958
470 HA ALA 65 HA ALA 65 -0.248 5.520 -4.868
471 HB1 ALA 65 HB1 ALA 65 -1.720 7.483 -3.115
472 HB2 ALA 65 HB2 ALA 65 -0.055 6.938 -2.882
473 HB3 ALA 65 HB3 ALA 65 -1.390 5.784 -2.748
474 H GLY 66 HN GLY 66 -2.481 7.854 -5.986
475 HA2 GLY 66 HA2 GLY 66 -4.801 6.116 -5.890
476 HA3 GLY 66 HA1 GLY 66 -4.721 7.724 -6.588
477 H ARG 67 HN ARG 67 -2.132 6.193 -7.846
478 HA ARG 67 HA ARG 67 -3.499 5.748 -10.355
479 HB2 ARG 67 HB2 ARG 67 -0.558 5.587 -9.685
480 HB3 ARG 67 HB1 ARG 67 -1.255 5.504 -11.296
481 HG2 ARG 67 HG2 ARG 67 -2.011 7.780 -11.125
482 HG3 ARG 67 HG1 ARG 67 -1.453 7.866 -9.451
483 HD2 ARG 67 HD2 ARG 67 0.845 7.379 -10.284
484 HD3 ARG 67 HD1 ARG 67 0.230 7.532 -11.927
485 HE ARG 67 HE ARG 67 -0.500 9.818 -10.531
486 HH11 ARG 67 HH11 ARG 67 2.524 8.278 -11.637
487 HH12 ARG 67 HH12 ARG 67 3.365 9.747 -11.808
488 HH21 ARG 67 HH21 ARG 67 0.701 11.789 -10.654
489 HH22 ARG 67 HH22 ARG 67 2.330 11.815 -11.200
490 H VAL 68 HN VAL 68 -2.553 3.894 -7.687
491 HA VAL 68 HA VAL 68 -1.947 1.600 -9.319
492 HB VAL 68 HB VAL 68 -1.303 0.389 -7.304
493 HG11 VAL 68 HG11 VAL 68 0.331 1.815 -8.301
494 HG12 VAL 68 HG12 VAL 68 0.527 1.811 -6.547
495 HG13 VAL 68 HG13 VAL 68 -0.233 3.186 -7.345
496 HG21 VAL 68 HG21 VAL 68 -2.250 2.813 -5.755
497 HG22 VAL 68 HG22 VAL 68 -1.331 1.466 -5.101
498 HG23 VAL 68 HG23 VAL 68 -2.965 1.194 -5.716
499 H ASP 69 HN ASP 69 -2.943 -0.571 -8.317
500 HA ASP 69 HA ASP 69 -5.808 -0.243 -7.705
501 HB2 ASP 69 HB2 ASP 69 -5.566 -0.394 -10.208
502 HB3 ASP 69 HB1 ASP 69 -4.717 -1.889 -9.978
503 H THR 70 HN THR 70 -3.050 -2.244 -8.280
504 HA THR 70 HA THR 70 -4.054 -4.267 -6.435
505 HB THR 70 HB THR 70 -2.469 -5.786 -7.590
506 HG1 THR 70 HG1 THR 70 -1.882 -3.411 -9.068
507 HG21 THR 70 HG21 THR 70 -4.713 -5.590 -8.526
508 HG22 THR 70 HG22 THR 70 -3.542 -5.775 -9.840
509 HG23 THR 70 HG23 THR 70 -4.220 -4.187 -9.471
510 HA PRO 71 HA PRO 71 -1.106 -3.020 -3.359
511 HB2 PRO 71 HB2 PRO 71 -0.504 -5.924 -3.057
512 HB3 PRO 71 HB1 PRO 71 -0.975 -4.738 -1.830
513 HG2 PRO 71 HG2 PRO 71 -2.739 -6.491 -2.678
514 HG3 PRO 71 HG1 PRO 71 -3.226 -4.806 -2.446
515 HD2 PRO 71 HD2 PRO 71 -2.589 -6.252 -4.986
516 HD3 PRO 71 HD1 PRO 71 -3.892 -5.091 -4.649
517 H ARG 72 HN ARG 72 -0.039 -5.314 -5.797
518 HA ARG 72 HA ARG 72 2.712 -5.139 -5.159
519 HB2 ARG 72 HB2 ARG 72 3.156 -6.158 -7.362
520 HB3 ARG 72 HB1 ARG 72 1.960 -7.025 -6.424
521 HG2 ARG 72 HG2 ARG 72 0.184 -6.085 -7.773
522 HG3 ARG 72 HG1 ARG 72 1.370 -5.151 -8.693
523 HD2 ARG 72 HD2 ARG 72 1.281 -8.154 -8.491
524 HD3 ARG 72 HD1 ARG 72 0.694 -7.208 -9.855
525 HE ARG 72 HE ARG 72 3.182 -6.346 -9.755
526 HH11 ARG 72 HH11 ARG 72 2.138 -9.735 -9.342
527 HH12 ARG 72 HH12 ARG 72 3.514 -10.343 -10.164
528 HH21 ARG 72 HH21 ARG 72 4.962 -7.244 -10.859
529 HH22 ARG 72 HH22 ARG 72 5.125 -8.935 -11.057
530 H GLU 73 HN GLU 73 0.676 -3.077 -7.062
531 HA GLU 73 HA GLU 73 2.818 -1.720 -8.385
532 HB2 GLU 73 HB2 GLU 73 -0.034 -0.863 -7.837
533 HB3 GLU 73 HB1 GLU 73 1.070 -0.054 -8.929
534 HG2 GLU 73 HG2 GLU 73 1.045 -1.848 -10.447
535 HG3 GLU 73 HG1 GLU 73 0.263 -2.917 -9.274
536 H LEU 74 HN LEU 74 0.885 -1.262 -5.509
537 HA LEU 74 HA LEU 74 1.848 1.268 -4.683
538 HB2 LEU 74 HB2 LEU 74 -0.171 -0.202 -3.797
539 HB3 LEU 74 HB1 LEU 74 1.122 -0.915 -2.829
540 HG LEU 74 HG LEU 74 -0.340 0.869 -1.637
541 HD11 LEU 74 HD11 LEU 74 1.745 0.106 -0.703
542 HD12 LEU 74 HD12 LEU 74 1.486 1.830 -0.416
543 HD13 LEU 74 HD13 LEU 74 2.615 1.300 -1.662
544 HD21 LEU 74 HD21 LEU 74 -0.441 2.467 -3.473
545 HD22 LEU 74 HD22 LEU 74 1.304 2.699 -3.380
546 HD23 LEU 74 HD23 LEU 74 0.272 3.191 -2.034
547 H LEU 75 HN LEU 75 2.744 -2.061 -3.917
548 HA LEU 75 HA LEU 75 4.732 -1.653 -2.065
549 HB2 LEU 75 HB2 LEU 75 3.711 -3.753 -2.463
550 HB3 LEU 75 HB1 LEU 75 4.268 -3.777 -4.123
551 HG LEU 75 HG LEU 75 6.542 -3.777 -3.235
552 HD11 LEU 75 HD11 LEU 75 6.891 -4.612 -0.928
553 HD12 LEU 75 HD12 LEU 75 5.158 -4.444 -0.633
554 HD13 LEU 75 HD13 LEU 75 6.136 -3.016 -0.970
555 HD21 LEU 75 HD21 LEU 75 5.527 -5.695 -4.171
556 HD22 LEU 75 HD22 LEU 75 4.742 -6.096 -2.646
557 HD23 LEU 75 HD23 LEU 75 6.508 -6.221 -2.795
558 H ASP 76 HN ASP 76 4.842 -1.715 -5.590
559 HA ASP 76 HA ASP 76 7.661 -1.667 -5.853
560 HB2 ASP 76 HB2 ASP 76 6.280 -2.344 -7.743
561 HB3 ASP 76 HB1 ASP 76 5.531 -0.752 -7.799
562 H LEU 77 HN LEU 77 5.201 0.823 -5.725
563 HA LEU 77 HA LEU 77 6.839 3.041 -6.168
564 HB2 LEU 77 HB2 LEU 77 4.374 2.803 -4.447
565 HB3 LEU 77 HB1 LEU 77 5.089 4.312 -4.966
566 HG LEU 77 HG LEU 77 3.866 2.228 -6.771
567 HD11 LEU 77 HD11 LEU 77 2.064 3.845 -7.090
568 HD12 LEU 77 HD12 LEU 77 2.823 4.937 -5.925
569 HD13 LEU 77 HD13 LEU 77 2.200 3.370 -5.401
570 HD21 LEU 77 HD21 LEU 77 4.906 4.993 -7.392
571 HD22 LEU 77 HD22 LEU 77 4.077 3.927 -8.529
572 HD23 LEU 77 HD23 LEU 77 5.656 3.475 -7.882
573 H ILE 78 HN ILE 78 5.907 1.411 -3.192
574 HA ILE 78 HA ILE 78 7.339 3.027 -1.367
575 HB ILE 78 HB ILE 78 6.621 0.088 -1.101
576 HG12 ILE 78 HG12 ILE 78 4.640 1.458 -1.484
577 HG13 ILE 78 HG11 ILE 78 4.671 0.869 0.173
578 HG21 ILE 78 HG21 ILE 78 6.836 0.440 1.322
579 HG22 ILE 78 HG22 ILE 78 7.343 2.113 1.026
580 HG23 ILE 78 HG23 ILE 78 8.351 0.782 0.476
581 HD11 ILE 78 HD11 ILE 78 5.448 3.072 0.923
582 HD12 ILE 78 HD12 ILE 78 3.915 3.189 0.063
583 HD13 ILE 78 HD13 ILE 78 5.420 3.641 -0.751
584 H ASN 79 HN ASN 79 8.247 -0.291 -2.487
585 HA ASN 79 HA ASN 79 10.831 -0.167 -1.429
586 HB2 ASN 79 HB2 ASN 79 9.793 -1.839 -3.704
587 HB3 ASN 79 HB1 ASN 79 11.440 -1.975 -3.104
588 HD21 ASN 79 HD21 ASN 79 9.803 -4.107 -3.131
589 HD22 ASN 79 HD22 ASN 79 9.351 -4.556 -1.522
590 H GLY 80 HN GLY 80 9.674 1.092 -4.464
591 HA2 GLY 80 HA2 GLY 80 12.184 1.474 -5.677
592 HA3 GLY 80 HA1 GLY 80 10.727 2.394 -6.033
593 H ALA 81 HN ALA 81 10.235 3.537 -3.593
594 HA ALA 81 HA ALA 81 12.148 5.661 -3.600
595 HB1 ALA 81 HB1 ALA 81 10.743 6.635 -1.856
596 HB2 ALA 81 HB2 ALA 81 9.824 5.130 -1.756
597 HB3 ALA 81 HB3 ALA 81 9.771 6.099 -3.231
598 H LEU 82 HN LEU 82 11.289 2.993 -1.466
599 HA LEU 82 HA LEU 82 12.836 3.640 0.733
600 HB2 LEU 82 HB2 LEU 82 10.998 2.053 0.761
601 HB3 LEU 82 HB1 LEU 82 11.874 0.995 -0.323
602 HG LEU 82 HG LEU 82 13.534 0.642 1.353
603 HD11 LEU 82 HD11 LEU 82 13.122 1.373 3.713
604 HD12 LEU 82 HD12 LEU 82 11.735 2.299 3.147
605 HD13 LEU 82 HD13 LEU 82 13.355 2.732 2.623
606 HD21 LEU 82 HD21 LEU 82 12.173 -0.749 2.867
607 HD22 LEU 82 HD22 LEU 82 11.690 -0.906 1.180
608 HD23 LEU 82 HD23 LEU 82 10.722 0.067 2.284
609 H ALA 83 HN ALA 83 13.656 2.064 -2.291
610 HA ALA 83 HA ALA 83 16.050 0.857 -1.585
611 HB1 ALA 83 HB1 ALA 83 14.925 0.535 -3.749
612 HB2 ALA 83 HB2 ALA 83 16.623 0.950 -3.950
613 HB3 ALA 83 HB3 ALA 83 15.376 2.178 -4.219
614 H GLU 84 HN GLU 84 15.488 4.223 -2.737
615 HA GLU 84 HA GLU 84 18.236 4.837 -2.200
616 HB2 GLU 84 HB2 GLU 84 15.971 6.273 -3.499
617 HB3 GLU 84 HB1 GLU 84 17.404 7.137 -3.007
618 HG2 GLU 84 HG2 GLU 84 17.605 6.623 -5.326
619 HG3 GLU 84 HG1 GLU 84 18.737 5.598 -4.452
620 H ALA 85 HN ALA 85 15.329 4.912 -0.490
621 HA ALA 85 HA ALA 85 16.080 7.205 1.116
622 HB1 ALA 85 HB1 ALA 85 13.704 6.810 0.538
623 HB2 ALA 85 HB2 ALA 85 13.986 6.942 2.267
624 HB3 ALA 85 HB3 ALA 85 13.729 5.359 1.545
625 H ALA 86 HN ALA 86 16.561 3.842 1.199
626 HA ALA 86 HA ALA 86 17.109 3.827 4.044
627 HB1 ALA 86 HB1 ALA 86 17.467 1.641 1.979
628 HB2 ALA 86 HB2 ALA 86 16.062 1.840 3.025
629 HB3 ALA 86 HB3 ALA 86 17.642 1.451 3.724
630 H28A SDO 101 H28A SDO 42 -11.807 10.958 -1.348
631 H28B SDO 101 H28B SDO 42 -10.076 10.622 -1.472
632 H30A SDO 101 H30A SDO 42 -11.131 13.085 -0.241
633 H30B SDO 101 H30B SDO 42 -10.125 14.258 -1.079
634 H30C SDO 101 H30C SDO 42 -9.429 12.736 -0.521
635 H31A SDO 101 H31A SDO 42 -9.726 12.189 -4.172
636 H31B SDO 101 H31B SDO 42 -8.608 12.250 -2.804
637 H31C SDO 101 H31C SDO 42 -9.319 13.741 -3.423
638 H32A SDO 101 H32A SDO 42 -12.294 12.608 -3.744
639 H33A SDO 101 H33A SDO 42 -12.442 14.765 -3.930
640 H36A SDO 101 H36A SDO 42 -12.813 15.188 -1.946
641 H37A SDO 101 H37A SDO 42 -14.759 15.848 -0.826
642 H37B SDO 101 H37B SDO 42 -15.147 14.150 -0.488
643 H38A SDO 101 H38A SDO 42 -14.435 15.459 1.547
644 H38B SDO 101 H38B SDO 42 -13.455 14.059 1.203
645 H41A SDO 101 H41A SDO 42 -11.913 15.062 2.555
646 H42A SDO 101 H42A SDO 42 -9.751 16.202 1.181
647 H42B SDO 101 H42B SDO 42 -10.580 17.471 2.074
648 H43A SDO 101 H43A SDO 42 -9.368 14.962 3.208
649 H43B SDO 101 H43B SDO 42 -10.370 16.065 4.103
650 H1A SDO 101 H1A SDO 42 -7.752 19.274 3.416
651 H1B SDO 101 H1B SDO 42 -6.722 18.210 2.489
652 H2A SDO 101 H2A SDO 42 -9.580 18.814 1.885
653 H2B SDO 101 H2B SDO 42 -8.528 17.802 0.934
654 H4A SDO 101 H4A SDO 42 -7.433 21.922 0.848
655 H4B SDO 101 H4B SDO 42 -6.360 20.888 -0.048
656 H5A SDO 101 H5A SDO 42 -5.552 19.843 1.972
657 H5B SDO 101 H5B SDO 42 -6.649 20.840 2.934
658 H6A SDO 101 H6A SDO 42 -5.540 22.866 2.088
659 H6B SDO 101 H6B SDO 42 -4.429 21.870 1.164
660 H8A SDO 101 H8A SDO 42 -5.272 20.487 4.381
661 H8B SDO 101 H8B SDO 42 -3.843 21.068 5.239
662 H8C SDO 101 H8C SDO 42 -3.673 19.874 3.942
Start of MODEL 14
1 H1 MET 1 HT1 MET 1 16.954 -8.223 0.483
2 H2 MET 1 HT2 MET 1 17.662 -8.400 1.985
3 H3 MET 1 HT3 MET 1 18.249 -9.301 0.673
4 HA MET 1 HA MET 1 19.694 -7.486 1.274
5 HB2 MET 1 HB2 MET 1 19.946 -6.452 -0.935
6 HB3 MET 1 HB1 MET 1 19.564 -8.149 -1.120
7 HG2 MET 1 HG2 MET 1 17.602 -5.882 -1.450
8 HG3 MET 1 HG1 MET 1 18.438 -6.699 -2.768
9 HE1 MET 1 HE1 MET 1 17.933 -9.160 -3.557
10 HE2 MET 1 HE2 MET 1 16.853 -10.265 -2.706
11 HE3 MET 1 HE3 MET 1 18.356 -9.751 -1.950
12 H ALA 2 HN ALA 2 19.826 -5.651 2.325
13 HA ALA 2 HA ALA 2 19.417 -3.681 3.302
14 HB1 ALA 2 HB1 ALA 2 19.507 -2.917 0.962
15 HB2 ALA 2 HB2 ALA 2 18.529 -1.877 2.001
16 HB3 ALA 2 HB3 ALA 2 17.744 -3.007 0.894
17 H THR 3 HN THR 3 16.667 -5.558 2.687
18 HA THR 3 HA THR 3 14.735 -5.898 3.734
19 HB THR 3 HB THR 3 15.498 -3.746 5.746
20 HG1 THR 3 HG1 THR 3 16.730 -5.989 5.295
21 HG21 THR 3 HG21 THR 3 13.561 -6.072 5.901
22 HG22 THR 3 HG22 THR 3 13.117 -4.368 5.772
23 HG23 THR 3 HG23 THR 3 13.935 -4.962 7.222
24 H LEU 4 HN LEU 4 13.957 -4.999 1.648
25 HA LEU 4 HA LEU 4 12.858 -2.388 1.613
26 HB2 LEU 4 HB2 LEU 4 12.987 -4.809 -0.103
27 HB3 LEU 4 HB1 LEU 4 11.820 -3.573 -0.432
28 HG LEU 4 HG LEU 4 13.590 -3.226 -1.903
29 HD11 LEU 4 HD11 LEU 4 14.579 -1.074 -1.323
30 HD12 LEU 4 HD12 LEU 4 13.978 -1.272 0.321
31 HD13 LEU 4 HD13 LEU 4 12.845 -1.160 -1.027
32 HD21 LEU 4 HD21 LEU 4 15.527 -3.442 0.391
33 HD22 LEU 4 HD22 LEU 4 15.954 -3.014 -1.263
34 HD23 LEU 4 HD23 LEU 4 15.302 -4.614 -0.910
35 H LEU 5 HN LEU 5 10.518 -2.577 0.666
36 HA LEU 5 HA LEU 5 8.858 -3.642 2.793
37 HB2 LEU 5 HB2 LEU 5 8.523 -1.483 1.296
38 HB3 LEU 5 HB1 LEU 5 7.856 -2.610 0.142
39 HG LEU 5 HG LEU 5 6.758 -1.886 2.870
40 HD11 LEU 5 HD11 LEU 5 4.861 -1.078 1.601
41 HD12 LEU 5 HD12 LEU 5 5.685 -1.524 0.107
42 HD13 LEU 5 HD13 LEU 5 6.360 -0.278 1.148
43 HD21 LEU 5 HD21 LEU 5 5.643 -3.907 0.924
44 HD22 LEU 5 HD22 LEU 5 4.856 -3.342 2.398
45 HD23 LEU 5 HD23 LEU 5 6.346 -4.277 2.495
46 H THR 6 HN THR 6 7.895 -5.627 2.672
47 HA THR 6 HA THR 6 8.170 -7.022 0.143
48 HB THR 6 HB THR 6 8.357 -9.124 1.759
49 HG1 THR 6 HG1 THR 6 9.485 -6.969 3.216
50 HG21 THR 6 HG21 THR 6 10.800 -8.936 1.574
51 HG22 THR 6 HG22 THR 6 10.644 -7.216 1.210
52 HG23 THR 6 HG23 THR 6 10.027 -8.418 0.082
53 H THR 7 HN THR 7 6.829 -9.312 0.473
54 HA THR 7 HA THR 7 4.186 -8.487 0.020
55 HB THR 7 HB THR 7 5.139 -11.288 0.581
56 HG1 THR 7 HG1 THR 7 5.368 -10.921 -1.964
57 HG21 THR 7 HG21 THR 7 3.109 -10.087 -1.305
58 HG22 THR 7 HG22 THR 7 2.739 -10.902 0.206
59 HG23 THR 7 HG23 THR 7 3.451 -11.810 -1.139
60 H ASP 8 HN ASP 8 5.672 -10.495 2.531
61 HA ASP 8 HA ASP 8 3.345 -11.039 4.056
62 HB2 ASP 8 HB2 ASP 8 5.686 -12.149 4.097
63 HB3 ASP 8 HB1 ASP 8 6.127 -10.856 5.200
64 H ASP 9 HN ASP 9 5.722 -8.570 4.061
65 HA ASP 9 HA ASP 9 5.085 -7.244 6.472
66 HB2 ASP 9 HB2 ASP 9 7.228 -6.947 5.345
67 HB3 ASP 9 HB1 ASP 9 6.407 -6.203 3.972
68 H LEU 10 HN LEU 10 4.194 -6.573 3.080
69 HA LEU 10 HA LEU 10 2.653 -4.314 3.631
70 HB2 LEU 10 HB2 LEU 10 3.273 -4.895 1.326
71 HB3 LEU 10 HB1 LEU 10 2.181 -6.268 1.376
72 HG LEU 10 HG LEU 10 0.328 -4.607 1.879
73 HD11 LEU 10 HD11 LEU 10 2.378 -2.617 0.961
74 HD12 LEU 10 HD12 LEU 10 1.624 -2.724 2.554
75 HD13 LEU 10 HD13 LEU 10 0.651 -2.305 1.145
76 HD21 LEU 10 HD21 LEU 10 -0.004 -3.997 -0.455
77 HD22 LEU 10 HD22 LEU 10 0.536 -5.670 -0.297
78 HD23 LEU 10 HD23 LEU 10 1.670 -4.414 -0.804
79 H ARG 11 HN ARG 11 1.827 -7.700 3.688
80 HA ARG 11 HA ARG 11 -0.944 -7.572 3.780
81 HB2 ARG 11 HB2 ARG 11 0.443 -9.661 3.674
82 HB3 ARG 11 HB1 ARG 11 0.776 -9.481 5.384
83 HG2 ARG 11 HG2 ARG 11 -1.646 -9.684 5.844
84 HG3 ARG 11 HG1 ARG 11 -1.922 -9.963 4.126
85 HD2 ARG 11 HD2 ARG 11 -1.820 -12.110 5.252
86 HD3 ARG 11 HD1 ARG 11 -0.381 -11.916 4.246
87 HE ARG 11 HE ARG 11 -0.433 -11.445 7.140
88 HH11 ARG 11 HH11 ARG 11 1.098 -13.061 4.382
89 HH12 ARG 11 HH12 ARG 11 2.590 -13.267 5.223
90 HH21 ARG 11 HH21 ARG 11 1.555 -11.774 8.213
91 HH22 ARG 11 HH22 ARG 11 2.889 -12.481 7.387
92 H ARG 12 HN ARG 12 1.393 -7.230 6.399
93 HA ARG 12 HA ARG 12 -0.538 -6.950 8.461
94 HB2 ARG 12 HB2 ARG 12 2.348 -6.070 8.387
95 HB3 ARG 12 HB1 ARG 12 1.333 -6.072 9.823
96 HG2 ARG 12 HG2 ARG 12 1.092 -8.502 9.643
97 HG3 ARG 12 HG1 ARG 12 2.119 -8.497 8.209
98 HD2 ARG 12 HD2 ARG 12 3.388 -9.150 10.186
99 HD3 ARG 12 HD1 ARG 12 3.974 -7.620 9.551
100 HE ARG 12 HE ARG 12 2.135 -6.920 11.464
101 HH11 ARG 12 HH11 ARG 12 4.928 -9.092 11.600
102 HH12 ARG 12 HH12 ARG 12 5.481 -8.525 13.109
103 HH21 ARG 12 HH21 ARG 12 2.779 -6.251 13.542
104 HH22 ARG 12 HH22 ARG 12 4.175 -6.896 14.306
105 H ALA 13 HN ALA 13 1.498 -4.585 6.760
106 HA ALA 13 HA ALA 13 0.515 -2.346 8.151
107 HB1 ALA 13 HB1 ALA 13 1.810 -2.394 5.441
108 HB2 ALA 13 HB2 ALA 13 2.668 -2.377 6.987
109 HB3 ALA 13 HB3 ALA 13 1.666 -0.997 6.513
110 H LEU 14 HN LEU 14 -0.607 -3.907 5.257
111 HA LEU 14 HA LEU 14 -2.316 -1.873 4.310
112 HB2 LEU 14 HB2 LEU 14 -1.536 -3.984 3.107
113 HB3 LEU 14 HB1 LEU 14 -2.723 -4.853 4.050
114 HG LEU 14 HG LEU 14 -4.510 -3.506 2.993
115 HD11 LEU 14 HD11 LEU 14 -3.213 -1.516 2.495
116 HD12 LEU 14 HD12 LEU 14 -3.987 -2.144 1.043
117 HD13 LEU 14 HD13 LEU 14 -2.257 -2.416 1.315
118 HD21 LEU 14 HD21 LEU 14 -3.901 -5.678 2.069
119 HD22 LEU 14 HD22 LEU 14 -2.672 -4.921 1.060
120 HD23 LEU 14 HD23 LEU 14 -4.380 -4.563 0.788
121 H VAL 15 HN VAL 15 -2.836 -4.683 6.401
122 HA VAL 15 HA VAL 15 -5.544 -4.334 6.997
123 HB VAL 15 HB VAL 15 -3.313 -5.577 8.643
124 HG11 VAL 15 HG11 VAL 15 -5.112 -6.726 9.905
125 HG12 VAL 15 HG12 VAL 15 -6.305 -5.739 9.061
126 HG13 VAL 15 HG13 VAL 15 -5.138 -4.978 10.142
127 HG21 VAL 15 HG21 VAL 15 -3.761 -6.686 6.509
128 HG22 VAL 15 HG22 VAL 15 -5.468 -6.806 6.938
129 HG23 VAL 15 HG23 VAL 15 -4.264 -7.689 7.869
130 H GLU 16 HN GLU 16 -2.656 -3.114 8.649
131 HA GLU 16 HA GLU 16 -3.849 -1.821 10.808
132 HB2 GLU 16 HB2 GLU 16 -1.429 -0.881 9.275
133 HB3 GLU 16 HB1 GLU 16 -1.851 -0.438 10.917
134 HG2 GLU 16 HG2 GLU 16 -1.584 -2.820 11.557
135 HG3 GLU 16 HG1 GLU 16 -1.031 -3.138 9.918
136 H SER 17 HN SER 17 -3.410 -0.776 7.501
137 HA SER 17 HA SER 17 -4.117 1.938 8.094
138 HB2 SER 17 HB2 SER 17 -3.519 0.598 5.471
139 HB3 SER 17 HB1 SER 17 -3.648 2.338 5.758
140 HG SER 17 HG SER 17 -1.709 0.516 6.645
141 H ALA 18 HN ALA 18 -5.878 -0.823 7.447
142 HA ALA 18 HA ALA 18 -8.008 0.421 5.985
143 HB1 ALA 18 HB1 ALA 18 -7.946 -2.160 7.564
144 HB2 ALA 18 HB2 ALA 18 -7.655 -2.003 5.829
145 HB3 ALA 18 HB3 ALA 18 -9.254 -1.654 6.492
146 H GLY 19 HN GLY 19 -9.054 2.021 6.927
147 HA2 GLY 19 HA2 GLY 19 -9.081 2.551 9.679
148 HA3 GLY 19 HA1 GLY 19 -10.131 3.309 8.487
149 H GLU 20 HN GLU 20 -11.930 1.874 7.715
150 HA GLU 20 HA GLU 20 -12.762 -0.244 9.417
151 HB2 GLU 20 HB2 GLU 20 -13.420 1.788 10.786
152 HB3 GLU 20 HB1 GLU 20 -14.502 2.233 9.470
153 HG2 GLU 20 HG2 GLU 20 -15.775 0.204 9.777
154 HG3 GLU 20 HG1 GLU 20 -14.636 -0.357 10.998
155 H THR 21 HN THR 21 -13.269 -1.545 7.953
156 HA THR 21 HA THR 21 -15.454 -0.960 6.178
157 HB THR 21 HB THR 21 -13.480 -0.268 4.807
158 HG1 THR 21 HG1 THR 21 -13.863 -1.563 3.018
159 HG21 THR 21 HG21 THR 21 -12.495 -3.100 5.201
160 HG22 THR 21 HG22 THR 21 -11.748 -1.656 5.875
161 HG23 THR 21 HG23 THR 21 -11.767 -1.906 4.126
162 H ASP 22 HN ASP 22 -14.978 -3.331 4.730
163 HA ASP 22 HA ASP 22 -16.017 -5.124 6.708
164 HB2 ASP 22 HB2 ASP 22 -17.006 -5.214 4.614
165 HB3 ASP 22 HB1 ASP 22 -15.479 -5.482 3.755
166 H GLY 23 HN GLY 23 -15.092 -6.582 7.657
167 HA2 GLY 23 HA2 GLY 23 -12.487 -6.625 8.174
168 HA3 GLY 23 HA1 GLY 23 -13.481 -8.052 8.477
169 H THR 24 HN THR 24 -13.916 -8.315 5.460
170 HA THR 24 HA THR 24 -13.115 -9.629 3.831
171 HB THR 24 HB THR 24 -10.860 -8.596 2.848
172 HG1 THR 24 HG1 THR 24 -11.701 -6.638 4.695
173 HG21 THR 24 HG21 THR 24 -13.410 -7.000 3.068
174 HG22 THR 24 HG22 THR 24 -13.087 -8.269 1.885
175 HG23 THR 24 HG23 THR 24 -12.154 -6.772 1.850
176 H ASP 25 HN ASP 25 -10.544 -10.411 2.949
177 HA ASP 25 HA ASP 25 -9.111 -11.457 5.186
178 HB2 ASP 25 HB2 ASP 25 -10.673 -13.339 4.670
179 HB3 ASP 25 HB1 ASP 25 -10.130 -13.308 2.992
180 H LEU 26 HN LEU 26 -6.967 -11.946 4.593
181 HA LEU 26 HA LEU 26 -6.191 -11.001 1.923
182 HB2 LEU 26 HB2 LEU 26 -6.204 -9.239 3.829
183 HB3 LEU 26 HB1 LEU 26 -4.824 -10.121 4.457
184 HG LEU 26 HG LEU 26 -3.659 -9.665 2.286
185 HD11 LEU 26 HD11 LEU 26 -4.557 -7.892 0.860
186 HD12 LEU 26 HD12 LEU 26 -6.028 -7.851 1.828
187 HD13 LEU 26 HD13 LEU 26 -5.632 -9.290 0.900
188 HD21 LEU 26 HD21 LEU 26 -3.224 -8.326 4.272
189 HD22 LEU 26 HD22 LEU 26 -4.595 -7.289 3.884
190 HD23 LEU 26 HD23 LEU 26 -3.177 -7.317 2.825
191 H SER 27 HN SER 27 -6.374 -13.664 3.265
192 HA SER 27 HA SER 27 -3.618 -14.298 3.938
193 HB2 SER 27 HB2 SER 27 -6.073 -16.066 4.050
194 HB3 SER 27 HB1 SER 27 -4.531 -16.310 4.882
195 HG SER 27 HG SER 27 -6.681 -14.698 5.485
196 H GLY 28 HN GLY 28 -2.340 -15.004 2.315
197 HA2 GLY 28 HA2 GLY 28 -2.003 -16.940 0.842
198 HA3 GLY 28 HA1 GLY 28 -3.620 -16.642 0.223
199 H ASP 29 HN ASP 29 -3.441 -15.944 -1.821
200 HA ASP 29 HA ASP 29 -1.170 -14.231 -2.440
201 HB2 ASP 29 HB2 ASP 29 -1.413 -16.197 -3.876
202 HB3 ASP 29 HB1 ASP 29 -3.038 -15.677 -4.325
203 H PHE 30 HN PHE 30 -1.835 -12.363 -1.686
204 HA PHE 30 HA PHE 30 -4.347 -11.300 -2.701
205 HB2 PHE 30 HB2 PHE 30 -4.126 -9.565 -0.980
206 HB3 PHE 30 HB1 PHE 30 -4.033 -11.170 -0.273
207 HD1 PHE 30 HD2 PHE 30 -1.791 -12.070 0.406
208 HD2 PHE 30 HD1 PHE 30 -2.369 -8.006 -0.729
209 HE1 PHE 30 HE2 PHE 30 0.314 -11.461 1.521
210 HE2 PHE 30 HE1 PHE 30 -0.266 -7.394 0.386
211 HZ PHE 30 HZ PHE 30 1.087 -9.092 1.478
212 H LEU 31 HN LEU 31 -1.427 -11.500 -3.890
213 HA LEU 31 HA LEU 31 -0.671 -8.814 -4.364
214 HB2 LEU 31 HB2 LEU 31 0.140 -11.401 -5.688
215 HB3 LEU 31 HB1 LEU 31 0.807 -9.848 -6.126
216 HG LEU 31 HG LEU 31 2.392 -10.896 -4.770
217 HD11 LEU 31 HD11 LEU 31 2.588 -9.442 -2.817
218 HD12 LEU 31 HD12 LEU 31 0.939 -8.885 -3.099
219 HD13 LEU 31 HD13 LEU 31 2.189 -8.574 -4.303
220 HD21 LEU 31 HD21 LEU 31 0.988 -12.628 -3.748
221 HD22 LEU 31 HD22 LEU 31 0.251 -11.414 -2.695
222 HD23 LEU 31 HD23 LEU 31 1.959 -11.792 -2.532
223 H ASP 32 HN ASP 32 -2.596 -11.180 -5.998
224 HA ASP 32 HA ASP 32 -3.119 -9.350 -8.208
225 HB2 ASP 32 HB2 ASP 32 -3.498 -12.321 -7.864
226 HB3 ASP 32 HB1 ASP 32 -4.235 -11.437 -9.194
227 H LEU 33 HN LEU 33 -4.168 -9.210 -5.439
228 HA LEU 33 HA LEU 33 -7.042 -9.347 -6.010
229 HB2 LEU 33 HB2 LEU 33 -6.222 -10.631 -4.025
230 HB3 LEU 33 HB1 LEU 33 -5.574 -9.155 -3.354
231 HG LEU 33 HG LEU 33 -7.852 -8.281 -3.075
232 HD11 LEU 33 HD11 LEU 33 -9.779 -9.740 -3.461
233 HD12 LEU 33 HD12 LEU 33 -8.716 -10.977 -4.134
234 HD13 LEU 33 HD13 LEU 33 -8.905 -9.433 -4.965
235 HD21 LEU 33 HD21 LEU 33 -7.406 -11.042 -1.939
236 HD22 LEU 33 HD22 LEU 33 -8.566 -9.860 -1.332
237 HD23 LEU 33 HD23 LEU 33 -6.835 -9.518 -1.252
238 H ARG 34 HN ARG 34 -8.102 -7.397 -6.112
239 HA ARG 34 HA ARG 34 -6.267 -5.121 -6.251
240 HB2 ARG 34 HB2 ARG 34 -9.026 -5.445 -7.424
241 HB3 ARG 34 HB1 ARG 34 -7.937 -4.089 -7.704
242 HG2 ARG 34 HG2 ARG 34 -6.345 -5.559 -8.800
243 HG3 ARG 34 HG1 ARG 34 -7.372 -6.952 -8.456
244 HD2 ARG 34 HD2 ARG 34 -7.659 -6.233 -10.749
245 HD3 ARG 34 HD1 ARG 34 -9.138 -5.944 -9.836
246 HE ARG 34 HE ARG 34 -7.166 -3.898 -10.583
247 HH11 ARG 34 HH11 ARG 34 -10.536 -4.868 -9.993
248 HH12 ARG 34 HH12 ARG 34 -11.147 -3.289 -10.194
249 HH21 ARG 34 HH21 ARG 34 -8.035 -1.807 -10.960
250 HH22 ARG 34 HH22 ARG 34 -9.711 -1.485 -10.845
251 H PHE 35 HN PHE 35 -6.832 -3.044 -5.519
252 HA PHE 35 HA PHE 35 -7.775 -2.975 -2.887
253 HB2 PHE 35 HB2 PHE 35 -7.271 -0.702 -4.801
254 HB3 PHE 35 HB1 PHE 35 -7.651 -0.483 -3.095
255 HD1 PHE 35 HD2 PHE 35 -6.085 -1.505 -1.393
256 HD2 PHE 35 HD1 PHE 35 -5.093 -1.110 -5.506
257 HE1 PHE 35 HE2 PHE 35 -3.702 -1.743 -0.838
258 HE2 PHE 35 HE1 PHE 35 -2.715 -1.337 -4.961
259 HZ PHE 35 HZ PHE 35 -2.014 -1.657 -2.617
260 H GLU 36 HN GLU 36 -9.503 -2.392 -5.846
261 HA GLU 36 HA GLU 36 -11.732 -1.017 -4.781
262 HB2 GLU 36 HB2 GLU 36 -11.719 -2.945 -7.104
263 HB3 GLU 36 HB1 GLU 36 -12.913 -1.703 -6.782
264 HG2 GLU 36 HG2 GLU 36 -11.180 0.013 -7.153
265 HG3 GLU 36 HG1 GLU 36 -10.036 -1.266 -7.571
266 H ASP 37 HN ASP 37 -10.938 -4.391 -5.141
267 HA ASP 37 HA ASP 37 -13.492 -5.488 -4.501
268 HB2 ASP 37 HB2 ASP 37 -11.657 -6.573 -5.873
269 HB3 ASP 37 HB1 ASP 37 -10.776 -6.811 -4.368
270 H ILE 38 HN ILE 38 -10.501 -4.828 -2.798
271 HA ILE 38 HA ILE 38 -11.599 -5.911 -0.362
272 HB ILE 38 HB ILE 38 -9.364 -5.494 0.676
273 HG12 ILE 38 HG12 ILE 38 -8.599 -4.628 -2.133
274 HG13 ILE 38 HG11 ILE 38 -8.659 -3.589 -0.716
275 HG21 ILE 38 HG21 ILE 38 -9.343 -7.048 -1.908
276 HG22 ILE 38 HG22 ILE 38 -9.943 -7.628 -0.354
277 HG23 ILE 38 HG23 ILE 38 -8.230 -7.274 -0.560
278 HD11 ILE 38 HD11 ILE 38 -6.364 -4.199 -1.247
279 HD12 ILE 38 HD12 ILE 38 -6.760 -5.910 -1.114
280 HD13 ILE 38 HD13 ILE 38 -6.843 -4.875 0.308
281 H GLY 39 HN GLY 39 -12.347 -3.259 -1.675
282 HA2 GLY 39 HA2 GLY 39 -13.458 -1.417 -0.883
283 HA3 GLY 39 HA1 GLY 39 -13.334 -2.125 0.703
284 H TYR 40 HN TYR 40 -10.625 -1.022 -1.342
285 HA TYR 40 HA TYR 40 -10.057 0.871 0.797
286 HB2 TYR 40 HB2 TYR 40 -8.218 -0.265 -1.330
287 HB3 TYR 40 HB1 TYR 40 -7.845 1.195 -0.438
288 HD1 TYR 40 HD2 TYR 40 -9.148 -2.177 0.400
289 HD2 TYR 40 HD1 TYR 40 -6.418 0.930 1.319
290 HE1 TYR 40 HE2 TYR 40 -8.287 -3.516 2.234
291 HE2 TYR 40 HE1 TYR 40 -5.517 -0.382 3.175
292 HH TYR 40 HH TYR 40 -6.326 -3.699 3.697
293 H ASP 41 HN ASP 41 -10.497 2.824 0.663
294 HA ASP 41 HA ASP 41 -11.324 4.039 -1.838
295 HB2 ASP 41 HB2 ASP 41 -11.169 5.209 0.967
296 HB3 ASP 41 HB1 ASP 41 -11.898 5.987 -0.438
297 H SER 42 HN SER 42 -10.491 6.464 -2.009
298 HA SER 42 HA SER 42 -7.777 6.307 -2.656
299 HB2 SER 42 HB2 SER 42 -7.971 8.775 -2.966
300 HB3 SER 42 HB1 SER 42 -9.274 7.872 -3.751
301 H LEU 43 HN LEU 43 -9.415 7.900 0.010
302 HA LEU 43 HA LEU 43 -7.178 8.855 1.384
303 HB2 LEU 43 HB2 LEU 43 -9.841 8.000 2.516
304 HB3 LEU 43 HB1 LEU 43 -8.641 8.926 3.380
305 HG LEU 43 HG LEU 43 -10.066 9.854 0.895
306 HD11 LEU 43 HD11 LEU 43 -11.565 9.733 2.830
307 HD12 LEU 43 HD12 LEU 43 -11.204 11.410 2.421
308 HD13 LEU 43 HD13 LEU 43 -10.403 10.642 3.793
309 HD21 LEU 43 HD21 LEU 43 -7.829 10.799 1.096
310 HD22 LEU 43 HD22 LEU 43 -8.176 11.276 2.761
311 HD23 LEU 43 HD23 LEU 43 -9.057 12.027 1.429
312 H ALA 44 HN ALA 44 -8.674 5.698 1.437
313 HA ALA 44 HA ALA 44 -7.257 4.726 3.714
314 HB1 ALA 44 HB1 ALA 44 -9.361 3.697 2.968
315 HB2 ALA 44 HB2 ALA 44 -8.061 2.510 3.047
316 HB3 ALA 44 HB3 ALA 44 -8.570 3.159 1.487
317 H LEU 45 HN LEU 45 -6.641 4.802 0.279
318 HA LEU 45 HA LEU 45 -4.409 3.079 0.231
319 HB2 LEU 45 HB2 LEU 45 -5.803 4.141 -1.717
320 HB3 LEU 45 HB1 LEU 45 -4.743 5.509 -1.530
321 HG LEU 45 HG LEU 45 -3.799 4.443 -3.298
322 HD11 LEU 45 HD11 LEU 45 -1.781 3.273 -2.742
323 HD12 LEU 45 HD12 LEU 45 -2.357 3.081 -1.086
324 HD13 LEU 45 HD13 LEU 45 -2.033 4.702 -1.726
325 HD21 LEU 45 HD21 LEU 45 -5.271 2.573 -3.358
326 HD22 LEU 45 HD22 LEU 45 -4.286 1.746 -2.106
327 HD23 LEU 45 HD23 LEU 45 -3.592 2.165 -3.689
328 H MET 46 HN MET 46 -4.825 6.591 0.619
329 HA MET 46 HA MET 46 -2.117 7.418 0.723
330 HB2 MET 46 HB2 MET 46 -4.202 8.712 2.461
331 HB3 MET 46 HB1 MET 46 -2.833 9.457 1.659
332 HG2 MET 46 HG2 MET 46 -3.993 8.915 -0.503
333 HG3 MET 46 HG1 MET 46 -5.349 8.448 0.534
334 HE1 MET 46 HE1 MET 46 -3.050 11.461 -0.578
335 HE2 MET 46 HE2 MET 46 -2.862 11.450 1.178
336 HE3 MET 46 HE3 MET 46 -3.706 12.785 0.386
337 H GLU 47 HN GLU 47 -4.394 6.562 3.196
338 HA GLU 47 HA GLU 47 -2.887 6.791 5.480
339 HB2 GLU 47 HB2 GLU 47 -5.278 5.755 4.511
340 HB3 GLU 47 HB1 GLU 47 -4.662 4.590 5.719
341 HG2 GLU 47 HG2 GLU 47 -5.156 7.554 6.094
342 HG3 GLU 47 HG1 GLU 47 -6.182 6.263 6.715
343 H THR 48 HN THR 48 -3.190 4.057 3.255
344 HA THR 48 HA THR 48 -1.577 2.215 4.640
345 HB THR 48 HB THR 48 -2.128 2.486 1.659
346 HG1 THR 48 HG1 THR 48 -4.062 2.236 2.863
347 HG21 THR 48 HG21 THR 48 -1.622 0.093 1.547
348 HG22 THR 48 HG22 THR 48 -1.230 0.088 3.277
349 HG23 THR 48 HG23 THR 48 -0.221 0.984 2.142
350 H ALA 49 HN ALA 49 -0.838 4.352 1.874
351 HA ALA 49 HA ALA 49 1.881 3.796 1.671
352 HB1 ALA 49 HB1 ALA 49 0.595 4.995 -0.057
353 HB2 ALA 49 HB2 ALA 49 2.071 5.843 0.382
354 HB3 ALA 49 HB3 ALA 49 0.518 6.408 0.996
355 H ALA 50 HN ALA 50 0.264 6.364 3.516
356 HA ALA 50 HA ALA 50 2.554 7.643 4.483
357 HB1 ALA 50 HB1 ALA 50 0.311 8.621 4.564
358 HB2 ALA 50 HB2 ALA 50 1.103 8.668 6.139
359 HB3 ALA 50 HB3 ALA 50 -0.149 7.464 5.814
360 H ARG 51 HN ARG 51 0.868 4.817 5.651
361 HA ARG 51 HA ARG 51 2.074 4.726 8.183
362 HB2 ARG 51 HB2 ARG 51 0.032 3.450 7.672
363 HB3 ARG 51 HB1 ARG 51 0.899 2.493 6.494
364 HG2 ARG 51 HG2 ARG 51 0.449 1.191 8.473
365 HG3 ARG 51 HG1 ARG 51 2.187 1.443 8.307
366 HD2 ARG 51 HD2 ARG 51 0.938 1.667 10.554
367 HD3 ARG 51 HD1 ARG 51 2.275 2.753 10.289
368 HE ARG 51 HE ARG 51 -0.199 3.843 9.341
369 HH11 ARG 51 HH11 ARG 51 1.255 3.078 12.473
370 HH12 ARG 51 HH12 ARG 51 0.645 4.473 13.242
371 HH21 ARG 51 HH21 ARG 51 -0.987 5.712 10.340
372 HH22 ARG 51 HH22 ARG 51 -0.684 6.026 12.004
373 H LEU 52 HN LEU 52 2.856 3.488 5.053
374 HA LEU 52 HA LEU 52 5.177 2.009 5.796
375 HB2 LEU 52 HB2 LEU 52 4.253 3.043 3.121
376 HB3 LEU 52 HB1 LEU 52 5.523 1.852 3.376
377 HG LEU 52 HG LEU 52 2.662 1.431 4.213
378 HD11 LEU 52 HD11 LEU 52 4.061 0.483 1.731
379 HD12 LEU 52 HD12 LEU 52 2.766 1.683 1.819
380 HD13 LEU 52 HD13 LEU 52 2.448 0.005 2.262
381 HD21 LEU 52 HD21 LEU 52 4.304 0.104 5.441
382 HD22 LEU 52 HD22 LEU 52 4.994 -0.466 3.921
383 HD23 LEU 52 HD23 LEU 52 3.346 -0.916 4.366
384 H GLU 53 HN GLU 53 4.524 5.226 4.480
385 HA GLU 53 HA GLU 53 7.148 6.146 4.125
386 HB2 GLU 53 HB2 GLU 53 4.762 7.746 5.065
387 HB3 GLU 53 HB1 GLU 53 6.254 8.420 4.444
388 HG2 GLU 53 HG2 GLU 53 5.777 7.364 2.271
389 HG3 GLU 53 HG1 GLU 53 4.237 6.774 2.924
390 H SER 54 HN SER 54 5.085 6.165 6.965
391 HA SER 54 HA SER 54 6.808 7.572 8.671
392 HB2 SER 54 HB2 SER 54 4.682 5.535 9.365
393 HB3 SER 54 HB1 SER 54 5.402 6.679 10.484
394 HG SER 54 HG SER 54 3.960 7.399 8.122
395 H ARG 55 HN ARG 55 6.686 4.182 7.792
396 HA ARG 55 HA ARG 55 8.534 3.494 9.920
397 HB2 ARG 55 HB2 ARG 55 6.713 1.924 9.266
398 HB3 ARG 55 HB1 ARG 55 7.517 1.697 7.717
399 HG2 ARG 55 HG2 ARG 55 9.541 0.932 8.972
400 HG3 ARG 55 HG1 ARG 55 8.569 0.974 10.440
401 HD2 ARG 55 HD2 ARG 55 8.090 -0.703 7.989
402 HD3 ARG 55 HD1 ARG 55 8.652 -1.264 9.557
403 HE ARG 55 HE ARG 55 6.262 -0.127 10.121
404 HH11 ARG 55 HH11 ARG 55 7.424 -2.590 7.909
405 HH12 ARG 55 HH12 ARG 55 6.045 -3.487 7.760
406 HH21 ARG 55 HH21 ARG 55 4.157 -1.308 10.005
407 HH22 ARG 55 HH22 ARG 55 4.064 -2.704 9.037
408 H TYR 56 HN TYR 56 8.579 3.544 6.348
409 HA TYR 56 HA TYR 56 11.364 2.740 6.422
410 HB2 TYR 56 HB2 TYR 56 9.462 3.013 4.103
411 HB3 TYR 56 HB1 TYR 56 11.149 2.513 3.946
412 HD1 TYR 56 HD1 TYR 56 11.896 0.378 5.054
413 HD2 TYR 56 HD2 TYR 56 7.789 1.468 4.799
414 HE1 TYR 56 HE1 TYR 56 11.252 -1.971 5.465
415 HE2 TYR 56 HE2 TYR 56 7.143 -0.857 5.221
416 HH TYR 56 HH TYR 56 9.362 -3.306 6.208
417 H GLY 57 HN GLY 57 9.608 5.668 5.960
418 HA2 GLY 57 HA2 GLY 57 10.570 7.774 5.940
419 HA3 GLY 57 HA1 GLY 57 12.136 7.024 5.653
420 H VAL 58 HN VAL 58 9.027 7.157 3.940
421 HA VAL 58 HA VAL 58 10.527 8.081 1.616
422 HB VAL 58 HB VAL 58 9.031 6.818 0.082
423 HG11 VAL 58 HG11 VAL 58 10.518 5.093 2.055
424 HG12 VAL 58 HG12 VAL 58 11.197 5.883 0.630
425 HG13 VAL 58 HG13 VAL 58 10.004 4.599 0.441
426 HG21 VAL 58 HG21 VAL 58 7.097 6.516 1.527
427 HG22 VAL 58 HG22 VAL 58 8.033 5.473 2.597
428 HG23 VAL 58 HG23 VAL 58 7.674 4.956 0.952
429 H SER 59 HN SER 59 8.681 8.764 -0.151
430 HA SER 59 HA SER 59 6.470 10.100 1.082
431 HB2 SER 59 HB2 SER 59 8.681 11.652 -0.301
432 HB3 SER 59 HB1 SER 59 7.154 12.339 0.254
433 HG SER 59 HG SER 59 8.249 11.003 2.236
434 H ILE 60 HN ILE 60 4.920 9.502 -0.242
435 HA ILE 60 HA ILE 60 5.490 9.394 -3.131
436 HB ILE 60 HB ILE 60 3.282 8.034 -1.549
437 HG12 ILE 60 HG12 ILE 60 5.630 6.865 -3.064
438 HG13 ILE 60 HG11 ILE 60 5.474 6.956 -1.319
439 HG21 ILE 60 HG21 ILE 60 2.419 8.721 -3.718
440 HG22 ILE 60 HG22 ILE 60 2.591 6.967 -3.655
441 HG23 ILE 60 HG23 ILE 60 3.773 7.937 -4.533
442 HD11 ILE 60 HD11 ILE 60 4.979 4.733 -2.119
443 HD12 ILE 60 HD12 ILE 60 3.729 5.367 -3.181
444 HD13 ILE 60 HD13 ILE 60 3.534 5.471 -1.426
445 HA PRO 61 HA PRO 61 3.016 13.106 -3.614
446 HB2 PRO 61 HB2 PRO 61 2.596 11.836 -6.285
447 HB3 PRO 61 HB1 PRO 61 3.060 13.500 -5.904
448 HG2 PRO 61 HG2 PRO 61 4.882 11.801 -6.794
449 HG3 PRO 61 HG1 PRO 61 5.273 12.933 -5.482
450 HD2 PRO 61 HD2 PRO 61 4.680 10.001 -5.353
451 HD3 PRO 61 HD1 PRO 61 5.848 10.962 -4.415
452 H ASP 62 HN ASP 62 0.969 13.440 -3.189
453 HA ASP 62 HA ASP 62 -0.830 11.759 -2.122
454 HB2 ASP 62 HB2 ASP 62 -1.560 14.156 -3.789
455 HB3 ASP 62 HB1 ASP 62 -2.514 13.435 -2.495
456 H ASP 63 HN ASP 63 -1.019 12.929 -5.442
457 HA ASP 63 HA ASP 63 -3.409 11.554 -6.069
458 HB2 ASP 63 HB2 ASP 63 -2.697 13.580 -7.245
459 HB3 ASP 63 HB1 ASP 63 -1.328 12.708 -7.913
460 H VAL 64 HN VAL 64 -0.089 10.658 -6.288
461 HA VAL 64 HA VAL 64 -0.393 8.679 -8.298
462 HB VAL 64 HB VAL 64 1.908 9.029 -6.350
463 HG11 VAL 64 HG11 VAL 64 1.947 6.807 -7.343
464 HG12 VAL 64 HG12 VAL 64 3.270 7.792 -7.971
465 HG13 VAL 64 HG13 VAL 64 1.834 7.503 -8.956
466 HG21 VAL 64 HG21 VAL 64 1.566 11.022 -7.661
467 HG22 VAL 64 HG22 VAL 64 1.516 10.083 -9.149
468 HG23 VAL 64 HG23 VAL 64 3.015 10.194 -8.232
469 H ALA 65 HN ALA 65 -1.056 8.584 -4.911
470 HA ALA 65 HA ALA 65 -0.583 5.829 -4.526
471 HB1 ALA 65 HB1 ALA 65 -1.819 6.175 -2.432
472 HB2 ALA 65 HB2 ALA 65 -2.295 7.781 -2.977
473 HB3 ALA 65 HB3 ALA 65 -0.597 7.421 -2.668
474 H GLY 66 HN GLY 66 -3.267 7.853 -5.476
475 HA2 GLY 66 HA2 GLY 66 -5.124 5.612 -5.488
476 HA3 GLY 66 HA1 GLY 66 -5.494 7.287 -5.887
477 H ARG 67 HN ARG 67 -2.734 5.768 -7.361
478 HA ARG 67 HA ARG 67 -4.251 5.506 -9.833
479 HB2 ARG 67 HB2 ARG 67 -1.357 6.273 -9.458
480 HB3 ARG 67 HB1 ARG 67 -2.171 6.057 -10.996
481 HG2 ARG 67 HG2 ARG 67 -3.709 7.917 -10.370
482 HG3 ARG 67 HG1 ARG 67 -2.749 8.169 -8.914
483 HD2 ARG 67 HD2 ARG 67 -2.038 9.745 -10.568
484 HD3 ARG 67 HD1 ARG 67 -0.764 8.537 -10.385
485 HE ARG 67 HE ARG 67 -2.259 7.541 -12.385
486 HH11 ARG 67 HH11 ARG 67 -0.719 10.767 -11.982
487 HH12 ARG 67 HH12 ARG 67 -0.634 10.984 -13.678
488 HH21 ARG 67 HH21 ARG 67 -2.035 7.952 -14.650
489 HH22 ARG 67 HH22 ARG 67 -1.310 9.426 -15.162
490 H VAL 68 HN VAL 68 -2.915 3.728 -7.427
491 HA VAL 68 HA VAL 68 -1.743 1.815 -9.247
492 HB VAL 68 HB VAL 68 -0.999 0.500 -7.319
493 HG11 VAL 68 HG11 VAL 68 0.501 2.117 -8.296
494 HG12 VAL 68 HG12 VAL 68 0.728 2.100 -6.550
495 HG13 VAL 68 HG13 VAL 68 -0.187 3.400 -7.307
496 HG21 VAL 68 HG21 VAL 68 -1.066 1.448 -5.058
497 HG22 VAL 68 HG22 VAL 68 -2.700 1.142 -5.675
498 HG23 VAL 68 HG23 VAL 68 -2.056 2.783 -5.644
499 H ASP 69 HN ASP 69 -2.333 -0.279 -9.347
500 HA ASP 69 HA ASP 69 -5.241 -0.595 -9.056
501 HB2 ASP 69 HB2 ASP 69 -3.887 -0.945 -11.268
502 HB3 ASP 69 HB1 ASP 69 -3.462 -2.477 -10.546
503 H THR 70 HN THR 70 -2.263 -2.467 -8.528
504 HA THR 70 HA THR 70 -3.743 -4.134 -6.652
505 HB THR 70 HB THR 70 -2.267 -6.018 -7.404
506 HG1 THR 70 HG1 THR 70 -1.360 -5.448 -9.651
507 HG21 THR 70 HG21 THR 70 -3.857 -4.646 -9.568
508 HG22 THR 70 HG22 THR 70 -4.501 -5.775 -8.359
509 HG23 THR 70 HG23 THR 70 -3.383 -6.346 -9.599
510 HA PRO 71 HA PRO 71 -0.920 -3.412 -3.326
511 HB2 PRO 71 HB2 PRO 71 -0.149 -6.294 -3.549
512 HB3 PRO 71 HB1 PRO 71 -0.573 -5.353 -2.113
513 HG2 PRO 71 HG2 PRO 71 -2.359 -6.957 -3.142
514 HG3 PRO 71 HG1 PRO 71 -2.846 -5.318 -2.663
515 HD2 PRO 71 HD2 PRO 71 -2.324 -6.425 -5.387
516 HD3 PRO 71 HD1 PRO 71 -3.574 -5.282 -4.855
517 H ARG 72 HN ARG 72 0.505 -5.477 -5.817
518 HA ARG 72 HA ARG 72 3.173 -4.970 -5.031
519 HB2 ARG 72 HB2 ARG 72 3.825 -5.980 -7.227
520 HB3 ARG 72 HB1 ARG 72 2.789 -6.971 -6.218
521 HG2 ARG 72 HG2 ARG 72 0.857 -6.270 -7.589
522 HG3 ARG 72 HG1 ARG 72 1.977 -5.387 -8.637
523 HD2 ARG 72 HD2 ARG 72 3.105 -7.394 -9.249
524 HD3 ARG 72 HD1 ARG 72 2.218 -8.327 -8.047
525 HE ARG 72 HE ARG 72 0.949 -7.043 -10.349
526 HH11 ARG 72 HH11 ARG 72 1.536 -9.987 -8.415
527 HH12 ARG 72 HH12 ARG 72 0.151 -10.783 -9.007
528 HH21 ARG 72 HH21 ARG 72 -0.914 -8.157 -11.129
529 HH22 ARG 72 HH22 ARG 72 -1.228 -9.769 -10.597
530 H GLU 73 HN GLU 73 1.035 -3.205 -7.095
531 HA GLU 73 HA GLU 73 3.033 -1.683 -8.415
532 HB2 GLU 73 HB2 GLU 73 0.200 -0.807 -7.802
533 HB3 GLU 73 HB1 GLU 73 1.226 -0.282 -9.131
534 HG2 GLU 73 HG2 GLU 73 0.071 -3.034 -8.776
535 HG3 GLU 73 HG1 GLU 73 -0.534 -1.790 -9.868
536 H LEU 74 HN LEU 74 1.232 -1.427 -5.449
537 HA LEU 74 HA LEU 74 2.121 1.167 -4.690
538 HB2 LEU 74 HB2 LEU 74 0.015 0.015 -3.907
539 HB3 LEU 74 HB1 LEU 74 1.006 -1.073 -2.978
540 HG LEU 74 HG LEU 74 -0.163 0.745 -1.687
541 HD11 LEU 74 HD11 LEU 74 1.708 -0.431 -0.711
542 HD12 LEU 74 HD12 LEU 74 1.754 1.272 -0.243
543 HD13 LEU 74 HD13 LEU 74 2.833 0.668 -1.504
544 HD21 LEU 74 HD21 LEU 74 1.867 2.506 -3.062
545 HD22 LEU 74 HD22 LEU 74 0.828 2.997 -1.725
546 HD23 LEU 74 HD23 LEU 74 0.120 2.559 -3.272
547 H LEU 75 HN LEU 75 3.128 -2.143 -3.983
548 HA LEU 75 HA LEU 75 5.232 -1.925 -2.187
549 HB2 LEU 75 HB2 LEU 75 4.583 -3.692 -4.440
550 HB3 LEU 75 HB1 LEU 75 6.270 -3.642 -4.022
551 HG LEU 75 HG LEU 75 5.080 -5.490 -3.101
552 HD11 LEU 75 HD11 LEU 75 5.877 -5.260 -0.770
553 HD12 LEU 75 HD12 LEU 75 6.021 -3.525 -1.020
554 HD13 LEU 75 HD13 LEU 75 7.042 -4.633 -1.936
555 HD21 LEU 75 HD21 LEU 75 3.548 -3.449 -1.539
556 HD22 LEU 75 HD22 LEU 75 3.503 -5.188 -1.240
557 HD23 LEU 75 HD23 LEU 75 2.907 -4.539 -2.766
558 H ASP 76 HN ASP 76 5.284 -1.671 -5.626
559 HA ASP 76 HA ASP 76 8.044 -1.195 -5.936
560 HB2 ASP 76 HB2 ASP 76 6.771 -2.153 -7.749
561 HB3 ASP 76 HB1 ASP 76 5.753 -0.722 -7.838
562 H LEU 77 HN LEU 77 5.314 0.940 -5.572
563 HA LEU 77 HA LEU 77 6.615 3.360 -6.189
564 HB2 LEU 77 HB2 LEU 77 4.371 2.713 -4.328
565 HB3 LEU 77 HB1 LEU 77 4.917 4.344 -4.592
566 HG LEU 77 HG LEU 77 3.694 2.488 -6.610
567 HD11 LEU 77 HD11 LEU 77 2.724 5.058 -5.346
568 HD12 LEU 77 HD12 LEU 77 2.116 3.442 -4.991
569 HD13 LEU 77 HD13 LEU 77 1.861 4.141 -6.586
570 HD21 LEU 77 HD21 LEU 77 5.373 3.903 -7.686
571 HD22 LEU 77 HD22 LEU 77 4.648 5.331 -6.940
572 HD23 LEU 77 HD23 LEU 77 3.746 4.415 -8.141
573 H ILE 78 HN ILE 78 6.111 1.713 -3.106
574 HA ILE 78 HA ILE 78 7.513 3.550 -1.504
575 HB ILE 78 HB ILE 78 7.045 0.595 -1.053
576 HG12 ILE 78 HG12 ILE 78 4.964 1.928 -1.272
577 HG13 ILE 78 HG11 ILE 78 5.167 1.269 0.341
578 HG21 ILE 78 HG21 ILE 78 7.481 1.050 1.336
579 HG22 ILE 78 HG22 ILE 78 7.904 2.712 0.928
580 HG23 ILE 78 HG23 ILE 78 8.894 1.384 0.335
581 HD11 ILE 78 HD11 ILE 78 4.317 3.544 0.405
582 HD12 ILE 78 HD12 ILE 78 5.737 4.111 -0.477
583 HD13 ILE 78 HD13 ILE 78 5.917 3.444 1.146
584 H ASN 79 HN ASN 79 8.504 0.380 -2.787
585 HA ASN 79 HA ASN 79 11.165 0.572 -1.874
586 HB2 ASN 79 HB2 ASN 79 9.996 -1.174 -4.042
587 HB3 ASN 79 HB1 ASN 79 11.662 -1.281 -3.491
588 HD21 ASN 79 HD21 ASN 79 9.616 -3.272 -3.391
589 HD22 ASN 79 HD22 ASN 79 9.408 -3.720 -1.724
590 H GLY 80 HN GLY 80 9.662 1.812 -4.733
591 HA2 GLY 80 HA2 GLY 80 12.038 2.270 -6.196
592 HA3 GLY 80 HA1 GLY 80 10.492 3.085 -6.428
593 H ALA 81 HN ALA 81 10.065 4.259 -4.038
594 HA ALA 81 HA ALA 81 11.750 6.543 -4.173
595 HB1 ALA 81 HB1 ALA 81 10.413 7.397 -2.311
596 HB2 ALA 81 HB2 ALA 81 9.716 5.804 -2.066
597 HB3 ALA 81 HB3 ALA 81 9.370 6.696 -3.545
598 H LEU 82 HN LEU 82 11.537 3.753 -2.011
599 HA LEU 82 HA LEU 82 13.365 4.710 -0.098
600 HB2 LEU 82 HB2 LEU 82 11.619 3.077 0.377
601 HB3 LEU 82 HB1 LEU 82 12.354 1.934 -0.724
602 HG LEU 82 HG LEU 82 14.290 1.830 0.669
603 HD11 LEU 82 HD11 LEU 82 14.212 2.755 3.005
604 HD12 LEU 82 HD12 LEU 82 12.709 3.577 2.585
605 HD13 LEU 82 HD13 LEU 82 14.209 4.013 1.766
606 HD21 LEU 82 HD21 LEU 82 11.698 1.206 2.085
607 HD22 LEU 82 HD22 LEU 82 13.265 0.538 2.536
608 HD23 LEU 82 HD23 LEU 82 12.574 0.167 0.958
609 H ALA 83 HN ALA 83 13.701 3.230 -3.184
610 HA ALA 83 HA ALA 83 16.380 2.264 -2.827
611 HB1 ALA 83 HB1 ALA 83 16.406 2.096 -5.257
612 HB2 ALA 83 HB2 ALA 83 14.955 3.080 -5.336
613 HB3 ALA 83 HB3 ALA 83 14.874 1.458 -4.635
614 H GLU 84 HN GLU 84 14.816 5.197 -3.705
615 HA GLU 84 HA GLU 84 17.208 6.482 -4.722
616 HB2 GLU 84 HB2 GLU 84 14.722 6.515 -5.605
617 HB3 GLU 84 HB1 GLU 84 14.510 7.722 -4.363
618 HG2 GLU 84 HG2 GLU 84 14.901 8.637 -6.524
619 HG3 GLU 84 HG1 GLU 84 16.184 9.143 -5.410
620 H ALA 85 HN ALA 85 16.431 5.702 -1.847
621 HA ALA 85 HA ALA 85 17.524 7.940 -0.456
622 HB1 ALA 85 HB1 ALA 85 15.110 8.534 -0.590
623 HB2 ALA 85 HB2 ALA 85 15.594 8.194 1.059
624 HB3 ALA 85 HB3 ALA 85 14.702 6.977 0.129
625 H ALA 86 HN ALA 86 16.603 6.836 2.147
626 HA ALA 86 HA ALA 86 16.691 4.111 2.367
627 HB1 ALA 86 HB1 ALA 86 19.341 5.487 2.934
628 HB2 ALA 86 HB2 ALA 86 19.065 4.253 1.705
629 HB3 ALA 86 HB3 ALA 86 18.941 3.838 3.413
630 H28A SDO 101 H28A SDO 42 -7.870 10.798 -2.316
631 H28B SDO 101 H28B SDO 42 -8.378 11.240 -3.944
632 H30A SDO 101 H30A SDO 42 -7.869 12.677 -0.549
633 H30B SDO 101 H30B SDO 42 -9.355 13.349 -1.206
634 H30C SDO 101 H30C SDO 42 -7.926 14.365 -1.074
635 H31A SDO 101 H31A SDO 42 -5.976 12.149 -2.001
636 H31B SDO 101 H31B SDO 42 -5.926 13.815 -2.576
637 H31C SDO 101 H31C SDO 42 -6.046 12.484 -3.731
638 H32A SDO 101 H32A SDO 42 -8.078 13.640 -4.746
639 H33A SDO 101 H33A SDO 42 -7.182 15.132 -2.716
640 H36A SDO 101 H36A SDO 42 -9.456 15.975 -3.066
641 H37A SDO 101 H37A SDO 42 -11.552 16.982 -3.279
642 H37B SDO 101 H37B SDO 42 -12.217 15.458 -3.895
643 H38A SDO 101 H38A SDO 42 -13.095 16.085 -1.640
644 H38B SDO 101 H38B SDO 42 -12.272 14.540 -1.677
645 H41A SDO 101 H41A SDO 42 -11.917 14.590 0.512
646 H42A SDO 101 H42A SDO 42 -9.435 15.666 1.321
647 H42B SDO 101 H42B SDO 42 -10.779 16.509 2.121
648 H43A SDO 101 H43A SDO 42 -10.203 13.555 2.119
649 H43B SDO 101 H43B SDO 42 -11.551 14.324 2.928
650 H1A SDO 101 H1A SDO 42 -8.916 16.572 5.345
651 H1B SDO 101 H1B SDO 42 -7.565 15.802 4.539
652 H2A SDO 101 H2A SDO 42 -9.672 17.458 3.215
653 H2B SDO 101 H2B SDO 42 -8.299 16.737 2.423
654 H4A SDO 101 H4A SDO 42 -7.248 19.860 5.140
655 H4B SDO 101 H4B SDO 42 -5.886 19.098 4.366
656 H5A SDO 101 H5A SDO 42 -6.378 17.008 5.529
657 H5B SDO 101 H5B SDO 42 -7.682 17.823 6.397
658 H6A SDO 101 H6A SDO 42 -6.049 19.459 7.253
659 H6B SDO 101 H6B SDO 42 -4.765 18.569 6.448
660 H8A SDO 101 H8A SDO 42 -5.769 15.549 8.732
661 H8B SDO 101 H8B SDO 42 -6.662 15.997 7.271
662 H8C SDO 101 H8C SDO 42 -7.249 16.499 8.862
Start of MODEL 15
1 H1 MET 1 HT1 MET 1 18.447 -8.776 5.501
2 H2 MET 1 HT2 MET 1 19.750 -9.791 5.663
3 H3 MET 1 HT3 MET 1 19.247 -9.283 4.102
4 HA MET 1 HA MET 1 20.241 -7.586 6.324
5 HB2 MET 1 HB2 MET 1 22.224 -7.116 4.990
6 HB3 MET 1 HB1 MET 1 22.077 -8.838 5.284
7 HG2 MET 1 HG2 MET 1 21.325 -9.206 3.021
8 HG3 MET 1 HG1 MET 1 21.263 -7.469 2.728
9 HE1 MET 1 HE1 MET 1 24.049 -9.424 4.733
10 HE2 MET 1 HE2 MET 1 25.202 -9.783 3.448
11 HE3 MET 1 HE3 MET 1 23.616 -10.551 3.443
12 H ALA 2 HN ALA 2 18.458 -7.744 3.338
13 HA ALA 2 HA ALA 2 18.755 -4.923 2.868
14 HB1 ALA 2 HB1 ALA 2 17.328 -5.351 0.922
15 HB2 ALA 2 HB2 ALA 2 17.132 -7.029 1.444
16 HB3 ALA 2 HB3 ALA 2 18.720 -6.437 0.954
17 H THR 3 HN THR 3 17.599 -3.594 4.005
18 HA THR 3 HA THR 3 15.216 -4.346 5.396
19 HB THR 3 HB THR 3 16.311 -1.545 4.983
20 HG1 THR 3 HG1 THR 3 18.024 -2.343 5.890
21 HG21 THR 3 HG21 THR 3 15.329 -1.150 7.199
22 HG22 THR 3 HG22 THR 3 14.804 -2.830 7.276
23 HG23 THR 3 HG23 THR 3 14.093 -1.740 6.086
24 H LEU 4 HN LEU 4 14.044 -5.001 3.463
25 HA LEU 4 HA LEU 4 12.952 -2.757 1.909
26 HB2 LEU 4 HB2 LEU 4 14.492 -4.272 0.642
27 HB3 LEU 4 HB1 LEU 4 13.367 -5.584 0.953
28 HG LEU 4 HG LEU 4 11.639 -4.326 -0.302
29 HD11 LEU 4 HD11 LEU 4 12.341 -2.451 -1.727
30 HD12 LEU 4 HD12 LEU 4 13.943 -2.507 -0.992
31 HD13 LEU 4 HD13 LEU 4 12.540 -2.085 -0.012
32 HD21 LEU 4 HD21 LEU 4 12.925 -6.088 -1.391
33 HD22 LEU 4 HD22 LEU 4 14.185 -4.925 -1.805
34 HD23 LEU 4 HD23 LEU 4 12.577 -4.780 -2.523
35 H LEU 5 HN LEU 5 10.811 -2.724 1.620
36 HA LEU 5 HA LEU 5 9.129 -4.198 3.431
37 HB2 LEU 5 HB2 LEU 5 8.998 -1.717 2.601
38 HB3 LEU 5 HB1 LEU 5 8.243 -2.395 1.180
39 HG LEU 5 HG LEU 5 7.159 -2.488 4.002
40 HD11 LEU 5 HD11 LEU 5 7.031 -0.302 3.070
41 HD12 LEU 5 HD12 LEU 5 5.413 -1.036 3.060
42 HD13 LEU 5 HD13 LEU 5 6.360 -0.936 1.575
43 HD21 LEU 5 HD21 LEU 5 5.108 -3.378 3.018
44 HD22 LEU 5 HD22 LEU 5 6.466 -4.471 2.754
45 HD23 LEU 5 HD23 LEU 5 5.893 -3.447 1.440
46 H THR 6 HN THR 6 8.407 -6.234 2.863
47 HA THR 6 HA THR 6 8.213 -6.868 0.031
48 HB THR 6 HB THR 6 8.227 -9.246 0.910
49 HG1 THR 6 HG1 THR 6 9.586 -8.811 3.146
50 HG21 THR 6 HG21 THR 6 10.670 -7.506 1.376
51 HG22 THR 6 HG22 THR 6 10.187 -8.220 -0.163
52 HG23 THR 6 HG23 THR 6 10.686 -9.256 1.174
53 H THR 7 HN THR 7 6.607 -9.045 0.013
54 HA THR 7 HA THR 7 4.023 -7.984 0.054
55 HB THR 7 HB THR 7 4.812 -10.909 -0.026
56 HG1 THR 7 HG1 THR 7 5.094 -10.505 -2.308
57 HG21 THR 7 HG21 THR 7 2.909 -11.077 -1.561
58 HG22 THR 7 HG22 THR 7 2.652 -9.340 -1.460
59 HG23 THR 7 HG23 THR 7 2.387 -10.353 -0.036
60 H ASP 8 HN ASP 8 5.667 -10.407 2.097
61 HA ASP 8 HA ASP 8 3.560 -10.971 3.890
62 HB2 ASP 8 HB2 ASP 8 6.556 -11.139 4.248
63 HB3 ASP 8 HB1 ASP 8 5.442 -11.610 5.512
64 H ASP 9 HN ASP 9 5.959 -8.458 3.880
65 HA ASP 9 HA ASP 9 5.357 -7.498 6.494
66 HB2 ASP 9 HB2 ASP 9 7.541 -7.086 5.463
67 HB3 ASP 9 HB1 ASP 9 6.774 -6.118 4.211
68 H LEU 10 HN LEU 10 4.520 -6.461 3.226
69 HA LEU 10 HA LEU 10 2.917 -4.262 3.910
70 HB2 LEU 10 HB2 LEU 10 3.647 -4.656 1.619
71 HB3 LEU 10 HB1 LEU 10 2.668 -6.111 1.534
72 HG LEU 10 HG LEU 10 0.638 -4.680 1.818
73 HD11 LEU 10 HD11 LEU 10 1.615 -2.787 2.924
74 HD12 LEU 10 HD12 LEU 10 0.811 -2.284 1.437
75 HD13 LEU 10 HD13 LEU 10 2.569 -2.400 1.490
76 HD21 LEU 10 HD21 LEU 10 2.391 -3.999 -0.538
77 HD22 LEU 10 HD22 LEU 10 0.633 -3.813 -0.473
78 HD23 LEU 10 HD23 LEU 10 1.357 -5.420 -0.405
79 H ARG 11 HN ARG 11 2.181 -7.674 3.649
80 HA ARG 11 HA ARG 11 -0.577 -7.679 3.790
81 HB2 ARG 11 HB2 ARG 11 0.863 -9.677 3.417
82 HB3 ARG 11 HB1 ARG 11 1.289 -9.668 5.116
83 HG2 ARG 11 HG2 ARG 11 -1.002 -10.148 5.737
84 HG3 ARG 11 HG1 ARG 11 -1.504 -10.065 4.043
85 HD2 ARG 11 HD2 ARG 11 -1.245 -12.382 4.724
86 HD3 ARG 11 HD1 ARG 11 -0.002 -11.972 3.542
87 HE ARG 11 HE ARG 11 0.799 -11.636 6.281
88 HH11 ARG 11 HH11 ARG 11 0.799 -13.938 3.545
89 HH12 ARG 11 HH12 ARG 11 2.024 -14.893 4.207
90 HH21 ARG 11 HH21 ARG 11 2.417 -12.943 7.149
91 HH22 ARG 11 HH22 ARG 11 2.968 -14.357 6.359
92 H ARG 12 HN ARG 12 1.753 -7.174 6.329
93 HA ARG 12 HA ARG 12 -0.001 -7.474 8.552
94 HB2 ARG 12 HB2 ARG 12 2.478 -5.766 8.332
95 HB3 ARG 12 HB1 ARG 12 1.711 -6.278 9.826
96 HG2 ARG 12 HG2 ARG 12 2.264 -8.598 9.313
97 HG3 ARG 12 HG1 ARG 12 3.003 -8.084 7.795
98 HD2 ARG 12 HD2 ARG 12 4.590 -6.697 9.077
99 HD3 ARG 12 HD1 ARG 12 3.856 -7.284 10.562
100 HE ARG 12 HE ARG 12 4.659 -9.502 9.070
101 HH11 ARG 12 HH11 ARG 12 6.065 -6.858 10.891
102 HH12 ARG 12 HH12 ARG 12 7.565 -7.628 11.161
103 HH21 ARG 12 HH21 ARG 12 6.588 -10.587 9.459
104 HH22 ARG 12 HH22 ARG 12 7.873 -9.906 10.346
105 H ALA 13 HN ALA 13 1.233 -4.580 6.911
106 HA ALA 13 HA ALA 13 -0.366 -2.797 8.439
107 HB1 ALA 13 HB1 ALA 13 1.062 -2.263 5.832
108 HB2 ALA 13 HB2 ALA 13 1.763 -2.101 7.441
109 HB3 ALA 13 HB3 ALA 13 0.442 -1.045 6.938
110 H LEU 14 HN LEU 14 -0.809 -4.426 5.391
111 HA LEU 14 HA LEU 14 -3.012 -2.861 4.568
112 HB2 LEU 14 HB2 LEU 14 -1.451 -4.290 3.146
113 HB3 LEU 14 HB1 LEU 14 -2.388 -5.669 3.688
114 HG LEU 14 HG LEU 14 -4.400 -4.676 2.660
115 HD11 LEU 14 HD11 LEU 14 -3.762 -2.330 2.797
116 HD12 LEU 14 HD12 LEU 14 -4.132 -2.770 1.126
117 HD13 LEU 14 HD13 LEU 14 -2.453 -2.601 1.649
118 HD21 LEU 14 HD21 LEU 14 -3.728 -5.057 0.338
119 HD22 LEU 14 HD22 LEU 14 -3.042 -6.273 1.419
120 HD23 LEU 14 HD23 LEU 14 -2.033 -4.960 0.825
121 H VAL 15 HN VAL 15 -2.652 -5.487 6.792
122 HA VAL 15 HA VAL 15 -5.520 -5.917 6.940
123 HB VAL 15 HB VAL 15 -3.267 -6.903 8.734
124 HG11 VAL 15 HG11 VAL 15 -6.226 -7.637 8.775
125 HG12 VAL 15 HG12 VAL 15 -5.380 -6.713 10.020
126 HG13 VAL 15 HG13 VAL 15 -4.980 -8.411 9.751
127 HG21 VAL 15 HG21 VAL 15 -4.988 -8.362 6.728
128 HG22 VAL 15 HG22 VAL 15 -3.749 -9.103 7.747
129 HG23 VAL 15 HG23 VAL 15 -3.297 -7.923 6.514
130 H GLU 16 HN GLU 16 -2.966 -4.359 8.863
131 HA GLU 16 HA GLU 16 -4.346 -3.457 11.045
132 HB2 GLU 16 HB2 GLU 16 -2.196 -1.994 9.547
133 HB3 GLU 16 HB1 GLU 16 -2.747 -1.603 11.169
134 HG2 GLU 16 HG2 GLU 16 -2.046 -3.911 11.835
135 HG3 GLU 16 HG1 GLU 16 -1.320 -4.064 10.243
136 H SER 17 HN SER 17 -4.297 -1.984 7.844
137 HA SER 17 HA SER 17 -5.749 0.332 8.809
138 HB2 SER 17 HB2 SER 17 -4.895 -0.347 5.994
139 HB3 SER 17 HB1 SER 17 -5.340 1.248 6.621
140 HG SER 17 HG SER 17 -3.040 -0.301 7.125
141 H ALA 18 HN ALA 18 -6.627 -2.697 8.080
142 HA ALA 18 HA ALA 18 -9.231 -1.971 6.932
143 HB1 ALA 18 HB1 ALA 18 -9.250 -4.309 6.054
144 HB2 ALA 18 HB2 ALA 18 -7.618 -4.528 6.690
145 HB3 ALA 18 HB3 ALA 18 -7.914 -3.363 5.400
146 H GLY 19 HN GLY 19 -10.162 -4.715 7.589
147 HA2 GLY 19 HA2 GLY 19 -9.974 -5.877 9.861
148 HA3 GLY 19 HA1 GLY 19 -10.452 -4.304 10.473
149 H GLU 20 HN GLU 20 -12.530 -3.577 10.178
150 HA GLU 20 HA GLU 20 -14.337 -5.751 9.393
151 HB2 GLU 20 HB2 GLU 20 -16.020 -4.760 10.840
152 HB3 GLU 20 HB1 GLU 20 -14.552 -5.141 11.721
153 HG2 GLU 20 HG2 GLU 20 -13.900 -2.803 11.680
154 HG3 GLU 20 HG1 GLU 20 -15.348 -2.409 10.749
155 H THR 21 HN THR 21 -13.052 -3.245 8.055
156 HA THR 21 HA THR 21 -15.400 -2.010 6.918
157 HB THR 21 HB THR 21 -13.285 -0.723 7.280
158 HG1 THR 21 HG1 THR 21 -14.316 -0.935 4.635
159 HG21 THR 21 HG21 THR 21 -11.656 -2.437 6.698
160 HG22 THR 21 HG22 THR 21 -11.402 -1.012 5.686
161 HG23 THR 21 HG23 THR 21 -12.212 -2.434 5.025
162 H ASP 22 HN ASP 22 -13.666 -4.769 6.521
163 HA ASP 22 HA ASP 22 -15.215 -6.035 4.687
164 HB2 ASP 22 HB2 ASP 22 -13.993 -4.475 3.041
165 HB3 ASP 22 HB1 ASP 22 -12.513 -5.324 3.488
166 H GLY 23 HN GLY 23 -14.753 -8.167 5.090
167 HA2 GLY 23 HA2 GLY 23 -12.495 -8.571 6.873
168 HA3 GLY 23 HA1 GLY 23 -13.798 -9.756 6.605
169 H THR 24 HN THR 24 -11.320 -8.014 4.922
170 HA THR 24 HA THR 24 -11.079 -9.678 2.740
171 HB THR 24 HB THR 24 -8.928 -7.899 3.801
172 HG1 THR 24 HG1 THR 24 -11.502 -7.222 2.702
173 HG21 THR 24 HG21 THR 24 -10.123 -8.482 1.113
174 HG22 THR 24 HG22 THR 24 -8.588 -9.114 1.733
175 HG23 THR 24 HG23 THR 24 -8.779 -7.380 1.416
176 H ASP 25 HN ASP 25 -10.045 -11.511 2.509
177 HA ASP 25 HA ASP 25 -8.167 -12.454 4.536
178 HB2 ASP 25 HB2 ASP 25 -9.876 -14.074 4.023
179 HB3 ASP 25 HB1 ASP 25 -9.610 -13.890 2.294
180 H LEU 26 HN LEU 26 -6.194 -11.779 4.185
181 HA LEU 26 HA LEU 26 -5.198 -11.333 1.480
182 HB2 LEU 26 HB2 LEU 26 -4.166 -10.617 4.211
183 HB3 LEU 26 HB1 LEU 26 -3.131 -10.520 2.813
184 HG LEU 26 HG LEU 26 -4.695 -8.851 1.825
185 HD11 LEU 26 HD11 LEU 26 -6.326 -7.739 3.251
186 HD12 LEU 26 HD12 LEU 26 -6.034 -8.921 4.525
187 HD13 LEU 26 HD13 LEU 26 -6.742 -9.433 2.996
188 HD21 LEU 26 HD21 LEU 26 -3.997 -7.026 3.249
189 HD22 LEU 26 HD22 LEU 26 -2.691 -8.194 3.007
190 HD23 LEU 26 HD23 LEU 26 -3.576 -8.167 4.528
191 H SER 27 HN SER 27 -5.581 -14.020 2.830
192 HA SER 27 HA SER 27 -2.875 -15.041 2.913
193 HB2 SER 27 HB2 SER 27 -5.481 -16.584 2.947
194 HB3 SER 27 HB1 SER 27 -3.905 -17.151 3.503
195 HG SER 27 HG SER 27 -5.752 -15.458 4.639
196 H GLY 28 HN GLY 28 -1.964 -16.251 1.249
197 HA2 GLY 28 HA2 GLY 28 -2.008 -17.419 -0.821
198 HA3 GLY 28 HA1 GLY 28 -3.582 -16.705 -1.161
199 H ASP 29 HN ASP 29 -3.606 -15.105 -2.545
200 HA ASP 29 HA ASP 29 -1.265 -13.362 -2.624
201 HB2 ASP 29 HB2 ASP 29 -1.087 -14.764 -4.627
202 HB3 ASP 29 HB1 ASP 29 -2.721 -14.311 -5.103
203 H PHE 30 HN PHE 30 -1.749 -11.501 -2.102
204 HA PHE 30 HA PHE 30 -4.397 -10.374 -2.782
205 HB2 PHE 30 HB2 PHE 30 -4.178 -8.936 -0.804
206 HB3 PHE 30 HB1 PHE 30 -4.031 -10.622 -0.323
207 HD1 PHE 30 HD2 PHE 30 -1.769 -11.530 0.257
208 HD2 PHE 30 HD1 PHE 30 -2.415 -7.389 -0.507
209 HE1 PHE 30 HE2 PHE 30 0.385 -10.992 1.296
210 HE2 PHE 30 HE1 PHE 30 -0.269 -6.853 0.522
211 HZ PHE 30 HZ PHE 30 1.142 -8.653 1.430
212 H LEU 31 HN LEU 31 -1.106 -10.333 -3.320
213 HA LEU 31 HA LEU 31 -0.547 -7.569 -3.503
214 HB2 LEU 31 HB2 LEU 31 1.066 -9.491 -3.193
215 HB3 LEU 31 HB1 LEU 31 0.870 -9.817 -4.900
216 HG LEU 31 HG LEU 31 1.719 -7.524 -5.361
217 HD11 LEU 31 HD11 LEU 31 1.191 -6.496 -3.234
218 HD12 LEU 31 HD12 LEU 31 2.918 -6.359 -3.572
219 HD13 LEU 31 HD13 LEU 31 2.341 -7.551 -2.410
220 HD21 LEU 31 HD21 LEU 31 3.164 -9.481 -5.526
221 HD22 LEU 31 HD22 LEU 31 3.553 -9.353 -3.809
222 HD23 LEU 31 HD23 LEU 31 4.060 -8.085 -4.928
223 H ASP 32 HN ASP 32 -1.740 -9.993 -5.780
224 HA ASP 32 HA ASP 32 -1.608 -8.013 -7.936
225 HB2 ASP 32 HB2 ASP 32 -0.652 -10.384 -8.129
226 HB3 ASP 32 HB1 ASP 32 -2.319 -10.935 -8.158
227 H LEU 33 HN LEU 33 -3.548 -8.551 -5.577
228 HA LEU 33 HA LEU 33 -6.079 -8.869 -6.976
229 HB2 LEU 33 HB2 LEU 33 -5.540 -9.988 -4.764
230 HB3 LEU 33 HB1 LEU 33 -5.495 -8.408 -4.037
231 HG LEU 33 HG LEU 33 -7.898 -8.138 -4.454
232 HD11 LEU 33 HD11 LEU 33 -7.741 -10.938 -5.592
233 HD12 LEU 33 HD12 LEU 33 -8.047 -9.468 -6.514
234 HD13 LEU 33 HD13 LEU 33 -9.216 -10.011 -5.312
235 HD21 LEU 33 HD21 LEU 33 -7.151 -9.161 -2.362
236 HD22 LEU 33 HD22 LEU 33 -7.167 -10.750 -3.105
237 HD23 LEU 33 HD23 LEU 33 -8.675 -9.868 -2.885
238 H ARG 34 HN ARG 34 -7.784 -7.055 -6.163
239 HA ARG 34 HA ARG 34 -6.398 -4.567 -6.893
240 HB2 ARG 34 HB2 ARG 34 -9.353 -5.181 -6.953
241 HB3 ARG 34 HB1 ARG 34 -8.592 -3.712 -7.531
242 HG2 ARG 34 HG2 ARG 34 -7.351 -5.076 -9.204
243 HG3 ARG 34 HG1 ARG 34 -8.302 -6.479 -8.688
244 HD2 ARG 34 HD2 ARG 34 -9.299 -5.461 -10.657
245 HD3 ARG 34 HD1 ARG 34 -10.358 -5.256 -9.257
246 HE ARG 34 HE ARG 34 -8.483 -3.157 -10.084
247 HH11 ARG 34 HH11 ARG 34 -11.856 -4.151 -9.479
248 HH12 ARG 34 HH12 ARG 34 -12.439 -2.555 -9.409
249 HH21 ARG 34 HH21 ARG 34 -9.284 -1.074 -10.000
250 HH22 ARG 34 HH22 ARG 34 -10.925 -0.690 -9.680
251 H PHE 35 HN PHE 35 -6.712 -2.618 -5.758
252 HA PHE 35 HA PHE 35 -7.013 -2.817 -2.972
253 HB2 PHE 35 HB2 PHE 35 -6.903 -0.462 -4.821
254 HB3 PHE 35 HB1 PHE 35 -7.363 -0.220 -3.139
255 HD1 PHE 35 HD2 PHE 35 -5.678 -1.282 -1.399
256 HD2 PHE 35 HD1 PHE 35 -4.720 -0.321 -5.433
257 HE1 PHE 35 HE2 PHE 35 -3.286 -1.252 -0.826
258 HE2 PHE 35 HE1 PHE 35 -2.329 -0.293 -4.868
259 HZ PHE 35 HZ PHE 35 -1.643 -0.590 -2.450
260 H GLU 36 HN GLU 36 -9.295 -1.845 -5.443
261 HA GLU 36 HA GLU 36 -11.363 -1.110 -3.661
262 HB2 GLU 36 HB2 GLU 36 -11.482 -2.101 -6.502
263 HB3 GLU 36 HB1 GLU 36 -12.877 -1.504 -5.618
264 HG2 GLU 36 HG2 GLU 36 -11.824 0.668 -5.382
265 HG3 GLU 36 HG1 GLU 36 -10.392 0.072 -6.225
266 H ASP 37 HN ASP 37 -10.187 -4.154 -4.652
267 HA ASP 37 HA ASP 37 -12.598 -5.566 -3.906
268 HB2 ASP 37 HB2 ASP 37 -11.155 -6.366 -5.772
269 HB3 ASP 37 HB1 ASP 37 -9.891 -6.721 -4.599
270 H ILE 38 HN ILE 38 -9.474 -4.801 -2.535
271 HA ILE 38 HA ILE 38 -10.045 -6.408 -0.188
272 HB ILE 38 HB ILE 38 -7.863 -5.577 0.702
273 HG12 ILE 38 HG12 ILE 38 -7.635 -4.262 -2.019
274 HG13 ILE 38 HG11 ILE 38 -7.757 -3.443 -0.472
275 HG21 ILE 38 HG21 ILE 38 -7.967 -7.682 -0.431
276 HG22 ILE 38 HG22 ILE 38 -6.452 -6.864 -0.806
277 HG23 ILE 38 HG23 ILE 38 -7.757 -6.892 -2.001
278 HD11 ILE 38 HD11 ILE 38 -5.602 -4.352 0.185
279 HD12 ILE 38 HD12 ILE 38 -5.483 -3.431 -1.320
280 HD13 ILE 38 HD13 ILE 38 -5.483 -5.192 -1.361
281 H GLY 39 HN GLY 39 -11.544 -3.975 -1.014
282 HA2 GLY 39 HA2 GLY 39 -12.893 -2.522 0.169
283 HA3 GLY 39 HA1 GLY 39 -12.142 -3.110 1.634
284 H TYR 40 HN TYR 40 -9.983 -1.806 -0.752
285 HA TYR 40 HA TYR 40 -9.662 0.406 1.057
286 HB2 TYR 40 HB2 TYR 40 -7.685 -0.784 -0.874
287 HB3 TYR 40 HB1 TYR 40 -7.506 0.859 -0.269
288 HD1 TYR 40 HD2 TYR 40 -8.048 -2.608 0.979
289 HD2 TYR 40 HD1 TYR 40 -6.509 1.264 1.741
290 HE1 TYR 40 HE2 TYR 40 -7.139 -3.399 3.104
291 HE2 TYR 40 HE1 TYR 40 -5.611 0.511 3.863
292 HH TYR 40 HH TYR 40 -5.554 -2.830 4.759
293 H ASP 41 HN ASP 41 -10.394 2.111 0.838
294 HA ASP 41 HA ASP 41 -11.415 3.127 -1.698
295 HB2 ASP 41 HB2 ASP 41 -12.753 3.082 0.512
296 HB3 ASP 41 HB1 ASP 41 -11.625 4.319 1.059
297 H SER 42 HN SER 42 -11.113 5.842 -1.424
298 HA SER 42 HA SER 42 -8.405 6.162 -2.223
299 HB2 SER 42 HB2 SER 42 -9.111 8.603 -2.414
300 HB3 SER 42 HB1 SER 42 -10.048 7.453 -3.369
301 H LEU 43 HN LEU 43 -10.286 7.198 0.531
302 HA LEU 43 HA LEU 43 -8.209 8.561 1.893
303 HB2 LEU 43 HB2 LEU 43 -10.762 7.322 2.902
304 HB3 LEU 43 HB1 LEU 43 -9.696 8.294 3.899
305 HG LEU 43 HG LEU 43 -11.093 9.279 1.414
306 HD11 LEU 43 HD11 LEU 43 -12.684 8.790 3.192
307 HD12 LEU 43 HD12 LEU 43 -12.506 10.536 2.977
308 HD13 LEU 43 HD13 LEU 43 -11.719 9.728 4.330
309 HD21 LEU 43 HD21 LEU 43 -10.363 11.478 2.215
310 HD22 LEU 43 HD22 LEU 43 -9.000 10.405 1.881
311 HD23 LEU 43 HD23 LEU 43 -9.499 10.687 3.539
312 H ALA 44 HN ALA 44 -9.207 5.247 1.773
313 HA ALA 44 HA ALA 44 -7.660 4.389 4.011
314 HB1 ALA 44 HB1 ALA 44 -8.929 2.794 1.782
315 HB2 ALA 44 HB2 ALA 44 -9.680 3.207 3.321
316 HB3 ALA 44 HB3 ALA 44 -8.273 2.133 3.282
317 H LEU 45 HN LEU 45 -7.158 4.711 0.559
318 HA LEU 45 HA LEU 45 -4.795 3.215 0.287
319 HB2 LEU 45 HB2 LEU 45 -6.293 4.432 -1.494
320 HB3 LEU 45 HB1 LEU 45 -5.313 5.828 -1.143
321 HG LEU 45 HG LEU 45 -4.391 5.011 -3.083
322 HD11 LEU 45 HD11 LEU 45 -2.722 3.716 -0.999
323 HD12 LEU 45 HD12 LEU 45 -2.594 5.384 -1.578
324 HD13 LEU 45 HD13 LEU 45 -2.218 4.035 -2.658
325 HD21 LEU 45 HD21 LEU 45 -5.615 2.944 -3.232
326 HD22 LEU 45 HD22 LEU 45 -4.491 2.196 -2.062
327 HD23 LEU 45 HD23 LEU 45 -3.907 2.778 -3.630
328 H MET 46 HN MET 46 -5.412 6.589 1.148
329 HA MET 46 HA MET 46 -2.823 7.661 1.444
330 HB2 MET 46 HB2 MET 46 -5.068 8.180 3.386
331 HB3 MET 46 HB1 MET 46 -3.767 9.281 2.938
332 HG2 MET 46 HG2 MET 46 -4.793 9.344 0.676
333 HG3 MET 46 HG1 MET 46 -6.080 8.341 1.375
334 HE1 MET 46 HE1 MET 46 -5.134 12.567 2.997
335 HE2 MET 46 HE2 MET 46 -4.226 11.811 1.691
336 HE3 MET 46 HE3 MET 46 -4.157 11.135 3.320
337 H GLU 47 HN GLU 47 -4.894 6.020 3.632
338 HA GLU 47 HA GLU 47 -3.329 5.967 5.900
339 HB2 GLU 47 HB2 GLU 47 -5.720 4.991 4.791
340 HB3 GLU 47 HB1 GLU 47 -5.175 3.879 6.081
341 HG2 GLU 47 HG2 GLU 47 -5.780 6.844 6.134
342 HG3 GLU 47 HG1 GLU 47 -6.727 5.568 6.898
343 H THR 48 HN THR 48 -3.195 3.997 3.068
344 HA THR 48 HA THR 48 -1.593 1.919 4.328
345 HB THR 48 HB THR 48 -2.126 2.423 1.386
346 HG1 THR 48 HG1 THR 48 -3.957 1.989 3.111
347 HG21 THR 48 HG21 THR 48 -1.764 -0.011 1.197
348 HG22 THR 48 HG22 THR 48 -1.372 -0.074 2.926
349 HG23 THR 48 HG23 THR 48 -0.339 0.825 1.816
350 H ALA 49 HN ALA 49 -1.230 4.293 1.691
351 HA ALA 49 HA ALA 49 1.490 3.883 1.204
352 HB1 ALA 49 HB1 ALA 49 1.373 5.847 -0.199
353 HB2 ALA 49 HB2 ALA 49 -0.123 6.352 0.592
354 HB3 ALA 49 HB3 ALA 49 -0.094 4.887 -0.391
355 H ALA 50 HN ALA 50 -0.043 6.626 2.960
356 HA ALA 50 HA ALA 50 2.407 7.895 3.553
357 HB1 ALA 50 HB1 ALA 50 1.139 9.282 5.098
358 HB2 ALA 50 HB2 ALA 50 -0.213 8.153 5.029
359 HB3 ALA 50 HB3 ALA 50 0.237 9.071 3.596
360 H ARG 51 HN ARG 51 0.678 5.361 5.080
361 HA ARG 51 HA ARG 51 1.853 5.419 7.596
362 HB2 ARG 51 HB2 ARG 51 -0.098 4.023 7.140
363 HB3 ARG 51 HB1 ARG 51 0.799 3.098 5.961
364 HG2 ARG 51 HG2 ARG 51 0.762 1.640 7.709
365 HG3 ARG 51 HG1 ARG 51 2.290 2.455 8.016
366 HD2 ARG 51 HD2 ARG 51 0.811 2.074 9.957
367 HD3 ARG 51 HD1 ARG 51 1.289 3.747 9.854
368 HE ARG 51 HE ARG 51 -0.912 4.178 8.863
369 HH11 ARG 51 HH11 ARG 51 -0.501 1.122 10.660
370 HH12 ARG 51 HH12 ARG 51 -2.172 0.893 10.885
371 HH21 ARG 51 HH21 ARG 51 -3.188 3.791 9.131
372 HH22 ARG 51 HH22 ARG 51 -3.713 2.403 9.993
373 H LEU 52 HN LEU 52 2.623 3.684 4.639
374 HA LEU 52 HA LEU 52 4.953 2.378 5.586
375 HB2 LEU 52 HB2 LEU 52 4.149 2.993 2.744
376 HB3 LEU 52 HB1 LEU 52 5.326 1.797 3.258
377 HG LEU 52 HG LEU 52 2.374 1.718 3.839
378 HD11 LEU 52 HD11 LEU 52 4.022 0.081 1.936
379 HD12 LEU 52 HD12 LEU 52 2.842 1.330 1.519
380 HD13 LEU 52 HD13 LEU 52 2.312 -0.157 2.303
381 HD21 LEU 52 HD21 LEU 52 2.854 -0.591 4.654
382 HD22 LEU 52 HD22 LEU 52 3.563 0.675 5.641
383 HD23 LEU 52 HD23 LEU 52 4.585 -0.234 4.535
384 H GLU 53 HN GLU 53 4.333 5.349 3.815
385 HA GLU 53 HA GLU 53 6.931 6.141 3.248
386 HB2 GLU 53 HB2 GLU 53 4.493 7.767 3.910
387 HB3 GLU 53 HB1 GLU 53 6.014 8.481 3.387
388 HG2 GLU 53 HG2 GLU 53 5.867 7.301 1.288
389 HG3 GLU 53 HG1 GLU 53 4.386 6.501 1.821
390 H SER 54 HN SER 54 5.001 6.915 6.182
391 HA SER 54 HA SER 54 7.214 8.255 7.364
392 HB2 SER 54 HB2 SER 54 4.700 7.202 8.674
393 HB3 SER 54 HB1 SER 54 5.814 8.392 9.344
394 HG SER 54 HG SER 54 5.116 9.235 6.920
395 H ARG 55 HN ARG 55 5.998 4.995 7.469
396 HA ARG 55 HA ARG 55 7.371 4.054 9.731
397 HB2 ARG 55 HB2 ARG 55 5.455 2.931 8.701
398 HB3 ARG 55 HB1 ARG 55 6.418 2.552 7.290
399 HG2 ARG 55 HG2 ARG 55 7.832 1.107 8.660
400 HG3 ARG 55 HG1 ARG 55 6.845 1.496 10.075
401 HD2 ARG 55 HD2 ARG 55 4.870 0.565 8.981
402 HD3 ARG 55 HD1 ARG 55 5.826 0.226 7.535
403 HE ARG 55 HE ARG 55 6.405 -1.001 10.129
404 HH11 ARG 55 HH11 ARG 55 5.504 -1.335 6.716
405 HH12 ARG 55 HH12 ARG 55 5.995 -2.967 6.590
406 HH21 ARG 55 HH21 ARG 55 6.967 -3.370 9.942
407 HH22 ARG 55 HH22 ARG 55 6.792 -4.108 8.399
408 H TYR 56 HN TYR 56 8.288 3.956 6.279
409 HA TYR 56 HA TYR 56 10.898 2.925 7.085
410 HB2 TYR 56 HB2 TYR 56 9.557 3.044 4.391
411 HB3 TYR 56 HB1 TYR 56 11.258 2.630 4.583
412 HD1 TYR 56 HD2 TYR 56 7.810 1.549 5.320
413 HD2 TYR 56 HD1 TYR 56 11.924 0.494 5.411
414 HE1 TYR 56 HE2 TYR 56 7.196 -0.778 5.790
415 HE2 TYR 56 HE1 TYR 56 11.327 -1.833 5.891
416 HH TYR 56 HH TYR 56 8.075 -3.058 5.755
417 H GLY 57 HN GLY 57 9.485 5.768 5.596
418 HA2 GLY 57 HA2 GLY 57 10.613 7.849 5.865
419 HA3 GLY 57 HA1 GLY 57 12.140 6.979 5.783
420 H VAL 58 HN VAL 58 9.230 7.116 3.765
421 HA VAL 58 HA VAL 58 10.899 7.941 1.502
422 HB VAL 58 HB VAL 58 9.664 6.490 -0.068
423 HG11 VAL 58 HG11 VAL 58 10.802 4.917 2.215
424 HG12 VAL 58 HG12 VAL 58 11.721 5.595 0.864
425 HG13 VAL 58 HG13 VAL 58 10.543 4.303 0.583
426 HG21 VAL 58 HG21 VAL 58 8.306 5.330 2.370
427 HG22 VAL 58 HG22 VAL 58 8.169 4.711 0.729
428 HG23 VAL 58 HG23 VAL 58 7.551 6.319 1.122
429 H SER 59 HN SER 59 9.082 8.432 -0.425
430 HA SER 59 HA SER 59 6.753 9.666 0.737
431 HB2 SER 59 HB2 SER 59 8.835 11.286 -0.751
432 HB3 SER 59 HB1 SER 59 7.239 11.873 -0.277
433 HG SER 59 HG SER 59 8.263 10.841 1.850
434 H ILE 60 HN ILE 60 5.077 9.674 -0.613
435 HA ILE 60 HA ILE 60 5.515 9.195 -3.484
436 HB ILE 60 HB ILE 60 3.303 7.999 -1.760
437 HG12 ILE 60 HG12 ILE 60 5.555 6.593 -3.225
438 HG13 ILE 60 HG11 ILE 60 5.460 6.818 -1.483
439 HG21 ILE 60 HG21 ILE 60 3.802 7.712 -4.721
440 HG22 ILE 60 HG22 ILE 60 2.469 8.585 -3.965
441 HG23 ILE 60 HG23 ILE 60 2.583 6.829 -3.800
442 HD11 ILE 60 HD11 ILE 60 3.424 5.452 -1.439
443 HD12 ILE 60 HD12 ILE 60 4.805 4.578 -2.101
444 HD13 ILE 60 HD13 ILE 60 3.565 5.211 -3.181
445 HA PRO 61 HA PRO 61 3.097 13.011 -3.696
446 HB2 PRO 61 HB2 PRO 61 2.581 11.988 -6.448
447 HB3 PRO 61 HB1 PRO 61 3.168 13.576 -5.934
448 HG2 PRO 61 HG2 PRO 61 4.827 11.814 -7.026
449 HG3 PRO 61 HG1 PRO 61 5.350 12.826 -5.668
450 HD2 PRO 61 HD2 PRO 61 4.548 9.944 -5.687
451 HD3 PRO 61 HD1 PRO 61 5.834 10.749 -4.762
452 H ASP 62 HN ASP 62 0.914 13.521 -3.697
453 HA ASP 62 HA ASP 62 -0.725 11.544 -2.630
454 HB2 ASP 62 HB2 ASP 62 -2.482 13.223 -2.522
455 HB3 ASP 62 HB1 ASP 62 -0.938 13.905 -2.025
456 H ASP 63 HN ASP 63 -0.747 12.888 -5.892
457 HA ASP 63 HA ASP 63 -3.155 11.590 -6.691
458 HB2 ASP 63 HB2 ASP 63 -0.846 12.348 -8.484
459 HB3 ASP 63 HB1 ASP 63 -2.464 11.933 -9.003
460 H VAL 64 HN VAL 64 0.160 10.572 -6.565
461 HA VAL 64 HA VAL 64 -0.109 8.416 -8.388
462 HB VAL 64 HB VAL 64 2.061 8.787 -6.300
463 HG11 VAL 64 HG11 VAL 64 3.450 7.431 -7.787
464 HG12 VAL 64 HG12 VAL 64 2.076 7.207 -8.865
465 HG13 VAL 64 HG13 VAL 64 2.034 6.537 -7.231
466 HG21 VAL 64 HG21 VAL 64 1.882 10.751 -7.718
467 HG22 VAL 64 HG22 VAL 64 1.962 9.742 -9.157
468 HG23 VAL 64 HG23 VAL 64 3.358 9.851 -8.086
469 H ALA 65 HN ALA 65 -0.963 8.742 -5.080
470 HA ALA 65 HA ALA 65 -0.834 5.997 -4.417
471 HB1 ALA 65 HB1 ALA 65 -2.126 6.704 -2.450
472 HB2 ALA 65 HB2 ALA 65 -2.371 8.293 -3.177
473 HB3 ALA 65 HB3 ALA 65 -0.749 7.768 -2.720
474 H GLY 66 HN GLY 66 -3.191 8.246 -5.751
475 HA2 GLY 66 HA2 GLY 66 -5.306 6.259 -5.693
476 HA3 GLY 66 HA1 GLY 66 -5.430 7.907 -6.300
477 H ARG 67 HN ARG 67 -2.706 6.818 -7.600
478 HA ARG 67 HA ARG 67 -3.988 6.201 -10.132
479 HB2 ARG 67 HB2 ARG 67 -1.160 6.909 -9.419
480 HB3 ARG 67 HB1 ARG 67 -1.628 6.369 -11.019
481 HG2 ARG 67 HG2 ARG 67 -3.123 8.297 -11.235
482 HG3 ARG 67 HG1 ARG 67 -2.645 8.838 -9.621
483 HD2 ARG 67 HD2 ARG 67 -1.412 9.981 -11.461
484 HD3 ARG 67 HD1 ARG 67 -0.355 9.107 -10.342
485 HE ARG 67 HE ARG 67 -1.257 7.709 -12.716
486 HH11 ARG 67 HH11 ARG 67 1.357 9.704 -11.404
487 HH12 ARG 67 HH12 ARG 67 2.613 8.908 -12.212
488 HH21 ARG 67 HH21 ARG 67 0.402 6.585 -13.843
489 HH22 ARG 67 HH22 ARG 67 2.048 7.000 -13.669
490 H VAL 68 HN VAL 68 -2.916 4.385 -7.600
491 HA VAL 68 HA VAL 68 -1.956 2.331 -9.399
492 HB VAL 68 HB VAL 68 -1.213 1.019 -7.402
493 HG11 VAL 68 HG11 VAL 68 0.640 2.463 -6.794
494 HG12 VAL 68 HG12 VAL 68 -0.197 3.841 -7.506
495 HG13 VAL 68 HG13 VAL 68 0.325 2.497 -8.529
496 HG21 VAL 68 HG21 VAL 68 -2.045 3.461 -5.833
497 HG22 VAL 68 HG22 VAL 68 -1.149 2.078 -5.205
498 HG23 VAL 68 HG23 VAL 68 -2.819 1.874 -5.750
499 H ASP 69 HN ASP 69 -2.815 0.042 -9.055
500 HA ASP 69 HA ASP 69 -5.659 0.182 -8.216
501 HB2 ASP 69 HB2 ASP 69 -5.285 -0.109 -10.750
502 HB3 ASP 69 HB1 ASP 69 -4.583 -1.656 -10.339
503 H THR 70 HN THR 70 -2.750 -1.731 -8.468
504 HA THR 70 HA THR 70 -3.941 -3.655 -6.634
505 HB THR 70 HB THR 70 -2.333 -5.293 -7.622
506 HG1 THR 70 HG1 THR 70 -1.864 -3.584 -9.790
507 HG21 THR 70 HG21 THR 70 -3.462 -5.492 -9.829
508 HG22 THR 70 HG22 THR 70 -4.095 -3.853 -9.624
509 HG23 THR 70 HG23 THR 70 -4.607 -5.136 -8.533
510 HA PRO 71 HA PRO 71 -1.098 -2.473 -3.433
511 HB2 PRO 71 HB2 PRO 71 -0.664 -5.406 -3.099
512 HB3 PRO 71 HB1 PRO 71 -1.066 -4.182 -1.888
513 HG2 PRO 71 HG2 PRO 71 -2.925 -5.842 -2.784
514 HG3 PRO 71 HG1 PRO 71 -3.310 -4.134 -2.496
515 HD2 PRO 71 HD2 PRO 71 -2.833 -5.573 -5.071
516 HD3 PRO 71 HD1 PRO 71 -3.972 -4.262 -4.710
517 H ARG 72 HN ARG 72 -0.108 -4.838 -5.816
518 HA ARG 72 HA ARG 72 2.609 -4.856 -5.118
519 HB2 ARG 72 HB2 ARG 72 3.040 -5.989 -7.178
520 HB3 ARG 72 HB1 ARG 72 1.555 -6.606 -6.494
521 HG2 ARG 72 HG2 ARG 72 0.304 -5.165 -8.122
522 HG3 ARG 72 HG1 ARG 72 1.867 -4.777 -8.858
523 HD2 ARG 72 HD2 ARG 72 0.534 -7.466 -8.638
524 HD3 ARG 72 HD1 ARG 72 0.986 -6.596 -10.109
525 HE ARG 72 HE ARG 72 3.341 -6.862 -9.104
526 HH11 ARG 72 HH11 ARG 72 0.794 -9.304 -9.385
527 HH12 ARG 72 HH12 ARG 72 1.777 -10.625 -8.938
528 HH21 ARG 72 HH21 ARG 72 4.777 -8.778 -8.551
529 HH22 ARG 72 HH22 ARG 72 4.116 -10.310 -8.570
530 H GLU 73 HN GLU 73 0.771 -2.616 -7.037
531 HA GLU 73 HA GLU 73 3.066 -1.376 -8.229
532 HB2 GLU 73 HB2 GLU 73 0.301 -0.288 -7.786
533 HB3 GLU 73 HB1 GLU 73 1.544 0.420 -8.799
534 HG2 GLU 73 HG2 GLU 73 1.461 -1.492 -10.262
535 HG3 GLU 73 HG1 GLU 73 0.229 -2.234 -9.224
536 H LEU 74 HN LEU 74 0.951 -0.729 -5.518
537 HA LEU 74 HA LEU 74 1.988 1.723 -4.618
538 HB2 LEU 74 HB2 LEU 74 -0.094 0.303 -3.871
539 HB3 LEU 74 HB1 LEU 74 1.097 -0.479 -2.837
540 HG LEU 74 HG LEU 74 -0.366 1.298 -1.725
541 HD11 LEU 74 HD11 LEU 74 1.704 0.522 -0.700
542 HD12 LEU 74 HD12 LEU 74 1.441 2.248 -0.399
543 HD13 LEU 74 HD13 LEU 74 2.601 1.727 -1.619
544 HD21 LEU 74 HD21 LEU 74 0.253 3.626 -2.047
545 HD22 LEU 74 HD22 LEU 74 -0.329 2.918 -3.557
546 HD23 LEU 74 HD23 LEU 74 1.404 3.150 -3.297
547 H LEU 75 HN LEU 75 2.719 -1.634 -3.819
548 HA LEU 75 HA LEU 75 4.728 -1.306 -1.958
549 HB2 LEU 75 HB2 LEU 75 3.499 -3.345 -2.393
550 HB3 LEU 75 HB1 LEU 75 4.217 -3.442 -3.995
551 HG LEU 75 HG LEU 75 6.387 -3.559 -2.886
552 HD11 LEU 75 HD11 LEU 75 5.812 -2.744 -0.689
553 HD12 LEU 75 HD12 LEU 75 6.422 -4.400 -0.550
554 HD13 LEU 75 HD13 LEU 75 4.695 -4.085 -0.451
555 HD21 LEU 75 HD21 LEU 75 6.151 -5.986 -2.413
556 HD22 LEU 75 HD22 LEU 75 5.370 -5.430 -3.901
557 HD23 LEU 75 HD23 LEU 75 4.394 -5.752 -2.470
558 H ASP 76 HN ASP 76 4.789 -1.556 -5.474
559 HA ASP 76 HA ASP 76 7.576 -1.688 -5.833
560 HB2 ASP 76 HB2 ASP 76 6.042 -2.359 -7.597
561 HB3 ASP 76 HB1 ASP 76 5.403 -0.725 -7.699
562 H LEU 77 HN LEU 77 5.298 0.989 -5.827
563 HA LEU 77 HA LEU 77 6.997 3.121 -6.378
564 HB2 LEU 77 HB2 LEU 77 4.656 2.977 -4.487
565 HB3 LEU 77 HB1 LEU 77 5.381 4.464 -5.020
566 HG LEU 77 HG LEU 77 4.004 2.476 -6.819
567 HD11 LEU 77 HD11 LEU 77 2.438 3.545 -5.265
568 HD12 LEU 77 HD12 LEU 77 2.174 4.088 -6.913
569 HD13 LEU 77 HD13 LEU 77 3.011 5.135 -5.758
570 HD21 LEU 77 HD21 LEU 77 4.099 4.274 -8.483
571 HD22 LEU 77 HD22 LEU 77 5.714 3.782 -7.980
572 HD23 LEU 77 HD23 LEU 77 5.009 5.272 -7.351
573 H ILE 78 HN ILE 78 6.164 1.635 -3.287
574 HA ILE 78 HA ILE 78 7.815 3.191 -1.630
575 HB ILE 78 HB ILE 78 6.949 0.304 -1.251
576 HG12 ILE 78 HG12 ILE 78 5.047 1.878 -1.431
577 HG13 ILE 78 HG11 ILE 78 5.176 1.182 0.183
578 HG21 ILE 78 HG21 ILE 78 8.074 2.242 0.775
579 HG22 ILE 78 HG22 ILE 78 8.864 0.794 0.160
580 HG23 ILE 78 HG23 ILE 78 7.406 0.654 1.147
581 HD11 ILE 78 HD11 ILE 78 4.612 3.551 0.258
582 HD12 ILE 78 HD12 ILE 78 6.076 3.934 -0.641
583 HD13 ILE 78 HD13 ILE 78 6.190 3.254 0.985
584 H ASN 79 HN ASN 79 8.325 -0.070 -2.959
585 HA ASN 79 HA ASN 79 10.875 -0.588 -2.025
586 HB2 ASN 79 HB2 ASN 79 9.651 -1.519 -4.625
587 HB3 ASN 79 HB1 ASN 79 11.186 -2.106 -4.005
588 HD21 ASN 79 HD21 ASN 79 10.081 -2.018 -1.206
589 HD22 ASN 79 HD22 ASN 79 9.081 -3.434 -1.116
590 H GLY 80 HN GLY 80 10.036 0.973 -5.095
591 HA2 GLY 80 HA2 GLY 80 12.613 1.232 -6.097
592 HA3 GLY 80 HA1 GLY 80 11.267 2.298 -6.483
593 H ALA 81 HN ALA 81 10.774 3.473 -4.090
594 HA ALA 81 HA ALA 81 12.821 5.444 -3.994
595 HB1 ALA 81 HB1 ALA 81 10.446 5.956 -3.667
596 HB2 ALA 81 HB2 ALA 81 11.439 6.519 -2.321
597 HB3 ALA 81 HB3 ALA 81 10.469 5.055 -2.149
598 H LEU 82 HN LEU 82 11.864 2.779 -1.884
599 HA LEU 82 HA LEU 82 13.481 3.480 0.288
600 HB2 LEU 82 HB2 LEU 82 11.511 2.100 0.492
601 HB3 LEU 82 HB1 LEU 82 12.216 0.890 -0.561
602 HG LEU 82 HG LEU 82 13.883 0.413 1.083
603 HD11 LEU 82 HD11 LEU 82 14.027 2.596 2.206
604 HD12 LEU 82 HD12 LEU 82 13.699 1.329 3.387
605 HD13 LEU 82 HD13 LEU 82 12.396 2.385 2.849
606 HD21 LEU 82 HD21 LEU 82 11.852 -0.875 1.077
607 HD22 LEU 82 HD22 LEU 82 11.062 0.305 2.125
608 HD23 LEU 82 HD23 LEU 82 12.400 -0.669 2.744
609 H ALA 83 HN ALA 83 14.035 1.490 -2.581
610 HA ALA 83 HA ALA 83 16.435 0.321 -1.655
611 HB1 ALA 83 HB1 ALA 83 15.151 -0.613 -3.527
612 HB2 ALA 83 HB2 ALA 83 16.828 -0.339 -3.979
613 HB3 ALA 83 HB3 ALA 83 15.581 0.767 -4.532
614 H GLU 84 HN GLU 84 15.791 3.518 -2.870
615 HA GLU 84 HA GLU 84 18.503 4.105 -3.517
616 HB2 GLU 84 HB2 GLU 84 16.100 5.854 -3.009
617 HB3 GLU 84 HB1 GLU 84 17.648 6.405 -3.617
618 HG2 GLU 84 HG2 GLU 84 17.301 4.994 -5.629
619 HG3 GLU 84 HG1 GLU 84 15.718 4.546 -4.988
620 H ALA 85 HN ALA 85 16.390 4.266 -0.762
621 HA ALA 85 HA ALA 85 18.110 6.053 0.720
622 HB1 ALA 85 HB1 ALA 85 15.679 6.285 0.882
623 HB2 ALA 85 HB2 ALA 85 16.406 5.947 2.452
624 HB3 ALA 85 HB3 ALA 85 15.578 4.665 1.568
625 H ALA 86 HN ALA 86 17.327 2.636 0.654
626 HA ALA 86 HA ALA 86 18.773 2.129 3.080
627 HB1 ALA 86 HB1 ALA 86 18.229 -0.217 2.671
628 HB2 ALA 86 HB2 ALA 86 17.628 0.197 1.061
629 HB3 ALA 86 HB3 ALA 86 16.796 0.797 2.495
630 H28A SDO 101 H28A SDO 42 -11.298 12.108 -3.028
631 H28B SDO 101 H28B SDO 42 -11.765 12.287 -1.337
632 H30A SDO 101 H30A SDO 42 -9.487 15.070 -1.890
633 H30B SDO 101 H30B SDO 42 -11.064 14.577 -1.278
634 H30C SDO 101 H30C SDO 42 -10.712 14.459 -3.003
635 H31A SDO 101 H31A SDO 42 -8.968 11.770 -0.300
636 H31B SDO 101 H31B SDO 42 -9.988 13.102 0.325
637 H31C SDO 101 H31C SDO 42 -8.360 13.418 -0.353
638 H32A SDO 101 H32A SDO 42 -9.037 12.559 -3.789
639 H33A SDO 101 H33A SDO 42 -8.908 10.805 -2.129
640 H36A SDO 101 H36A SDO 42 -6.408 12.019 -2.151
641 H37A SDO 101 H37A SDO 42 -4.323 13.168 -2.794
642 H37B SDO 101 H37B SDO 42 -5.180 14.698 -2.578
643 H38A SDO 101 H38A SDO 42 -4.468 12.727 -0.380
644 H38B SDO 101 H38B SDO 42 -3.558 14.169 -0.772
645 H41A SDO 101 H41A SDO 42 -6.589 15.154 -1.278
646 H42A SDO 101 H42A SDO 42 -8.233 15.395 0.670
647 H42B SDO 101 H42B SDO 42 -6.935 16.384 1.349
648 H43A SDO 101 H43A SDO 42 -8.214 16.770 -1.324
649 H43B SDO 101 H43B SDO 42 -7.128 17.911 -0.526
650 H1A SDO 101 H1A SDO 42 -10.053 18.345 2.531
651 H1B SDO 101 H1B SDO 42 -11.092 17.266 1.634
652 H2A SDO 101 H2A SDO 42 -8.394 16.555 2.718
653 H2B SDO 101 H2B SDO 42 -9.485 15.480 1.878
654 H4A SDO 101 H4A SDO 42 -10.960 16.688 5.693
655 H4B SDO 101 H4B SDO 42 -12.028 15.642 4.808
656 H5A SDO 101 H5A SDO 42 -12.490 17.339 3.180
657 H5B SDO 101 H5B SDO 42 -11.326 18.428 3.940
658 H6A SDO 101 H6A SDO 42 -12.665 18.305 6.027
659 H6B SDO 101 H6B SDO 42 -13.854 17.347 5.164
660 H8A SDO 101 H8A SDO 42 -14.218 19.969 2.588
661 H8B SDO 101 H8B SDO 42 -12.523 19.566 2.918
662 H8C SDO 101 H8C SDO 42 -13.200 21.105 3.481
Start of MODEL 16
1 H1 MET 1 HT1 MET 1 21.074 -0.852 7.750
2 H2 MET 1 HT2 MET 1 21.983 -1.887 6.769
3 H3 MET 1 HT3 MET 1 21.611 -2.343 8.346
4 HA MET 1 HA MET 1 20.294 -3.457 6.633
5 HB2 MET 1 HB2 MET 1 18.841 -1.689 8.610
6 HB3 MET 1 HB1 MET 1 17.995 -2.826 7.581
7 HG2 MET 1 HG2 MET 1 19.340 -4.645 8.572
8 HG3 MET 1 HG1 MET 1 20.052 -3.463 9.672
9 HE1 MET 1 HE1 MET 1 18.475 -6.169 10.508
10 HE2 MET 1 HE2 MET 1 17.590 -5.593 11.918
11 HE3 MET 1 HE3 MET 1 19.259 -5.094 11.662
12 H ALA 2 HN ALA 2 18.057 -3.038 5.588
13 HA ALA 2 HA ALA 2 17.958 -0.450 4.235
14 HB1 ALA 2 HB1 ALA 2 17.864 -3.148 2.859
15 HB2 ALA 2 HB2 ALA 2 19.145 -1.950 2.706
16 HB3 ALA 2 HB3 ALA 2 17.531 -1.595 2.084
17 H THR 3 HN THR 3 16.522 -3.642 4.550
18 HA THR 3 HA THR 3 14.527 -4.427 4.998
19 HB THR 3 HB THR 3 13.719 -1.685 6.013
20 HG1 THR 3 HG1 THR 3 15.034 -1.941 7.578
21 HG21 THR 3 HG21 THR 3 11.944 -3.430 5.871
22 HG22 THR 3 HG22 THR 3 12.309 -2.982 7.534
23 HG23 THR 3 HG23 THR 3 12.936 -4.490 6.872
24 H LEU 4 HN LEU 4 14.504 -4.480 2.650
25 HA LEU 4 HA LEU 4 12.871 -2.657 1.174
26 HB2 LEU 4 HB2 LEU 4 14.568 -4.441 0.312
27 HB3 LEU 4 HB1 LEU 4 13.245 -5.584 0.500
28 HG LEU 4 HG LEU 4 11.948 -4.045 -1.041
29 HD11 LEU 4 HD11 LEU 4 13.352 -2.092 -0.804
30 HD12 LEU 4 HD12 LEU 4 13.292 -2.595 -2.495
31 HD13 LEU 4 HD13 LEU 4 14.720 -2.944 -1.520
32 HD21 LEU 4 HD21 LEU 4 13.006 -4.982 -3.053
33 HD22 LEU 4 HD22 LEU 4 12.833 -6.194 -1.781
34 HD23 LEU 4 HD23 LEU 4 14.403 -5.454 -2.086
35 H LEU 5 HN LEU 5 10.609 -2.810 0.845
36 HA LEU 5 HA LEU 5 9.255 -4.096 3.004
37 HB2 LEU 5 HB2 LEU 5 8.739 -1.831 1.682
38 HB3 LEU 5 HB1 LEU 5 7.803 -2.906 0.664
39 HG LEU 5 HG LEU 5 7.361 -2.451 3.623
40 HD11 LEU 5 HD11 LEU 5 5.814 -1.502 1.243
41 HD12 LEU 5 HD12 LEU 5 6.756 -0.517 2.376
42 HD13 LEU 5 HD13 LEU 5 5.307 -1.353 2.925
43 HD21 LEU 5 HD21 LEU 5 6.689 -4.694 2.940
44 HD22 LEU 5 HD22 LEU 5 5.710 -3.996 1.647
45 HD23 LEU 5 HD23 LEU 5 5.298 -3.683 3.336
46 H THR 6 HN THR 6 8.522 -6.091 3.016
47 HA THR 6 HA THR 6 8.647 -7.649 0.603
48 HB THR 6 HB THR 6 8.347 -9.572 2.204
49 HG1 THR 6 HG1 THR 6 8.777 -8.995 4.427
50 HG21 THR 6 HG21 THR 6 10.677 -7.702 2.712
51 HG22 THR 6 HG22 THR 6 10.571 -8.893 1.414
52 HG23 THR 6 HG23 THR 6 10.637 -9.420 3.099
53 H THR 7 HN THR 7 6.900 -9.678 1.072
54 HA THR 7 HA THR 7 4.454 -8.469 0.268
55 HB THR 7 HB THR 7 5.163 -11.371 0.789
56 HG1 THR 7 HG1 THR 7 5.307 -9.860 -1.641
57 HG21 THR 7 HG21 THR 7 3.339 -11.822 -0.812
58 HG22 THR 7 HG22 THR 7 3.046 -10.083 -0.948
59 HG23 THR 7 HG23 THR 7 2.755 -10.904 0.577
60 H ASP 8 HN ASP 8 5.668 -10.417 2.968
61 HA ASP 8 HA ASP 8 3.255 -10.723 4.394
62 HB2 ASP 8 HB2 ASP 8 6.095 -10.778 5.419
63 HB3 ASP 8 HB1 ASP 8 4.696 -11.127 6.414
64 H ASP 9 HN ASP 9 5.736 -8.243 4.623
65 HA ASP 9 HA ASP 9 4.590 -6.928 6.856
66 HB2 ASP 9 HB2 ASP 9 6.944 -6.585 6.117
67 HB3 ASP 9 HB1 ASP 9 6.331 -5.702 4.718
68 H LEU 10 HN LEU 10 4.250 -6.563 3.406
69 HA LEU 10 HA LEU 10 2.638 -4.260 3.413
70 HB2 LEU 10 HB2 LEU 10 3.784 -5.133 1.405
71 HB3 LEU 10 HB1 LEU 10 2.676 -6.493 1.382
72 HG LEU 10 HG LEU 10 0.801 -4.876 1.065
73 HD11 LEU 10 HD11 LEU 10 1.325 -2.617 0.302
74 HD12 LEU 10 HD12 LEU 10 3.033 -2.883 0.677
75 HD13 LEU 10 HD13 LEU 10 1.834 -2.882 1.967
76 HD21 LEU 10 HD21 LEU 10 1.765 -6.094 -0.816
77 HD22 LEU 10 HD22 LEU 10 2.970 -4.822 -1.026
78 HD23 LEU 10 HD23 LEU 10 1.257 -4.475 -1.298
79 H ARG 11 HN ARG 11 1.888 -7.681 3.582
80 HA ARG 11 HA ARG 11 -0.900 -7.565 3.411
81 HB2 ARG 11 HB2 ARG 11 0.444 -9.669 3.410
82 HB3 ARG 11 HB1 ARG 11 0.717 -9.453 5.133
83 HG2 ARG 11 HG2 ARG 11 -1.692 -9.629 5.539
84 HG3 ARG 11 HG1 ARG 11 -1.955 -9.899 3.815
85 HD2 ARG 11 HD2 ARG 11 -1.961 -12.030 4.914
86 HD3 ARG 11 HD1 ARG 11 -0.472 -11.894 3.978
87 HE ARG 11 HE ARG 11 -0.652 -11.520 6.899
88 HH11 ARG 11 HH11 ARG 11 1.174 -12.588 4.043
89 HH12 ARG 11 HH12 ARG 11 2.520 -13.113 4.967
90 HH21 ARG 11 HH21 ARG 11 1.149 -12.303 8.107
91 HH22 ARG 11 HH22 ARG 11 2.481 -13.025 7.328
92 H ARG 12 HN ARG 12 1.226 -7.394 6.223
93 HA ARG 12 HA ARG 12 -0.696 -7.095 8.225
94 HB2 ARG 12 HB2 ARG 12 2.132 -6.020 8.087
95 HB3 ARG 12 HB1 ARG 12 1.163 -6.015 9.554
96 HG2 ARG 12 HG2 ARG 12 1.046 -8.434 9.508
97 HG3 ARG 12 HG1 ARG 12 1.941 -8.457 7.989
98 HD2 ARG 12 HD2 ARG 12 3.893 -7.511 9.123
99 HD3 ARG 12 HD1 ARG 12 2.985 -7.434 10.639
100 HE ARG 12 HE ARG 12 2.743 -10.003 10.009
101 HH11 ARG 12 HH11 ARG 12 5.723 -8.015 10.179
102 HH12 ARG 12 HH12 ARG 12 6.691 -9.352 10.560
103 HH21 ARG 12 HH21 ARG 12 4.108 -11.768 10.461
104 HH22 ARG 12 HH22 ARG 12 5.786 -11.568 10.650
105 H ALA 13 HN ALA 13 0.906 -4.669 6.249
106 HA ALA 13 HA ALA 13 -0.298 -2.449 7.501
107 HB1 ALA 13 HB1 ALA 13 0.518 -1.133 5.625
108 HB2 ALA 13 HB2 ALA 13 0.791 -2.600 4.691
109 HB3 ALA 13 HB3 ALA 13 1.762 -2.279 6.127
110 H LEU 14 HN LEU 14 -1.244 -4.365 4.630
111 HA LEU 14 HA LEU 14 -3.442 -2.777 4.014
112 HB2 LEU 14 HB2 LEU 14 -2.307 -5.306 3.144
113 HB3 LEU 14 HB1 LEU 14 -4.043 -5.212 2.955
114 HG LEU 14 HG LEU 14 -3.777 -3.174 1.608
115 HD11 LEU 14 HD11 LEU 14 -0.824 -3.630 1.919
116 HD12 LEU 14 HD12 LEU 14 -1.763 -2.254 2.510
117 HD13 LEU 14 HD13 LEU 14 -1.576 -2.512 0.781
118 HD21 LEU 14 HD21 LEU 14 -2.785 -4.214 -0.367
119 HD22 LEU 14 HD22 LEU 14 -3.890 -5.295 0.468
120 HD23 LEU 14 HD23 LEU 14 -2.147 -5.510 0.644
121 H VAL 15 HN VAL 15 -3.046 -5.126 6.449
122 HA VAL 15 HA VAL 15 -5.892 -5.487 6.832
123 HB VAL 15 HB VAL 15 -3.636 -5.967 8.806
124 HG11 VAL 15 HG11 VAL 15 -5.861 -5.792 9.866
125 HG12 VAL 15 HG12 VAL 15 -5.277 -7.459 9.947
126 HG13 VAL 15 HG13 VAL 15 -6.486 -7.013 8.758
127 HG21 VAL 15 HG21 VAL 15 -4.995 -7.947 6.974
128 HG22 VAL 15 HG22 VAL 15 -3.793 -8.338 8.200
129 HG23 VAL 15 HG23 VAL 15 -3.343 -7.347 6.814
130 H GLU 16 HN GLU 16 -3.303 -3.875 8.705
131 HA GLU 16 HA GLU 16 -4.794 -2.515 10.548
132 HB2 GLU 16 HB2 GLU 16 -2.169 -1.739 9.303
133 HB3 GLU 16 HB1 GLU 16 -2.827 -1.072 10.800
134 HG2 GLU 16 HG2 GLU 16 -2.797 -3.311 11.789
135 HG3 GLU 16 HG1 GLU 16 -2.152 -3.958 10.314
136 H SER 17 HN SER 17 -4.214 -1.533 7.218
137 HA SER 17 HA SER 17 -5.072 1.162 7.765
138 HB2 SER 17 HB2 SER 17 -4.469 -0.150 5.109
139 HB3 SER 17 HB1 SER 17 -4.598 1.580 5.418
140 HG SER 17 HG SER 17 -2.637 -0.247 6.181
141 H ALA 18 HN ALA 18 -6.785 -1.654 7.415
142 HA ALA 18 HA ALA 18 -9.016 -0.302 6.059
143 HB1 ALA 18 HB1 ALA 18 -9.758 -2.485 5.320
144 HB2 ALA 18 HB2 ALA 18 -8.406 -3.245 6.157
145 HB3 ALA 18 HB3 ALA 18 -8.108 -2.173 4.781
146 H GLY 19 HN GLY 19 -11.057 -0.454 6.965
147 HA2 GLY 19 HA2 GLY 19 -11.385 -2.014 9.416
148 HA3 GLY 19 HA1 GLY 19 -11.567 -0.268 9.536
149 H GLU 20 HN GLU 20 -12.552 -2.536 7.034
150 HA GLU 20 HA GLU 20 -15.295 -2.614 7.639
151 HB2 GLU 20 HB2 GLU 20 -16.192 -1.201 5.784
152 HB3 GLU 20 HB1 GLU 20 -15.406 -0.286 7.048
153 HG2 GLU 20 HG2 GLU 20 -13.435 -0.010 5.643
154 HG3 GLU 20 HG1 GLU 20 -14.205 -0.956 4.368
155 H THR 21 HN THR 21 -13.127 -4.294 6.765
156 HA THR 21 HA THR 21 -14.393 -5.614 4.521
157 HB THR 21 HB THR 21 -12.725 -3.939 3.551
158 HG1 THR 21 HG1 THR 21 -11.713 -5.361 2.210
159 HG21 THR 21 HG21 THR 21 -10.742 -5.645 5.024
160 HG22 THR 21 HG22 THR 21 -11.061 -3.927 5.304
161 HG23 THR 21 HG23 THR 21 -10.309 -4.461 3.792
162 H ASP 22 HN ASP 22 -14.483 -6.309 7.077
163 HA ASP 22 HA ASP 22 -12.232 -7.635 8.076
164 HB2 ASP 22 HB2 ASP 22 -15.023 -7.441 8.898
165 HB3 ASP 22 HB1 ASP 22 -13.970 -8.610 9.714
166 H GLY 23 HN GLY 23 -11.428 -9.264 7.505
167 HA2 GLY 23 HA2 GLY 23 -11.247 -11.504 7.131
168 HA3 GLY 23 HA1 GLY 23 -12.990 -11.597 6.697
169 H THR 24 HN THR 24 -10.153 -9.806 5.799
170 HA THR 24 HA THR 24 -10.854 -9.573 3.052
171 HB THR 24 HB THR 24 -8.139 -9.041 4.144
172 HG1 THR 24 HG1 THR 24 -10.555 -7.755 4.950
173 HG21 THR 24 HG21 THR 24 -10.144 -7.450 2.573
174 HG22 THR 24 HG22 THR 24 -8.811 -8.384 1.880
175 HG23 THR 24 HG23 THR 24 -8.476 -6.961 2.871
176 H ASP 25 HN ASP 25 -10.436 -11.354 1.726
177 HA ASP 25 HA ASP 25 -8.590 -13.411 2.429
178 HB2 ASP 25 HB2 ASP 25 -9.746 -12.713 -0.304
179 HB3 ASP 25 HB1 ASP 25 -8.812 -14.163 0.051
180 H LEU 26 HN LEU 26 -6.778 -12.378 2.986
181 HA LEU 26 HA LEU 26 -5.312 -10.924 0.889
182 HB2 LEU 26 HB2 LEU 26 -6.249 -9.740 2.997
183 HB3 LEU 26 HB1 LEU 26 -4.994 -10.591 3.862
184 HG LEU 26 HG LEU 26 -3.303 -9.415 2.441
185 HD11 LEU 26 HD11 LEU 26 -5.727 -7.872 1.513
186 HD12 LEU 26 HD12 LEU 26 -4.747 -8.950 0.521
187 HD13 LEU 26 HD13 LEU 26 -4.045 -7.464 1.174
188 HD21 LEU 26 HD21 LEU 26 -5.227 -7.658 3.955
189 HD22 LEU 26 HD22 LEU 26 -3.533 -7.291 3.588
190 HD23 LEU 26 HD23 LEU 26 -3.924 -8.613 4.670
191 H SER 27 HN SER 27 -5.510 -13.830 2.089
192 HA SER 27 HA SER 27 -2.664 -14.186 2.545
193 HB2 SER 27 HB2 SER 27 -3.363 -16.507 3.323
194 HB3 SER 27 HB1 SER 27 -3.957 -15.184 4.323
195 HG SER 27 HG SER 27 -5.957 -15.537 3.646
196 H GLY 28 HN GLY 28 -1.782 -16.239 1.453
197 HA2 GLY 28 HA2 GLY 28 -1.417 -17.389 -0.495
198 HA3 GLY 28 HA1 GLY 28 -3.020 -16.891 -1.056
199 H ASP 29 HN ASP 29 -2.980 -15.592 -2.756
200 HA ASP 29 HA ASP 29 -0.788 -13.644 -2.917
201 HB2 ASP 29 HB2 ASP 29 -0.684 -15.179 -4.822
202 HB3 ASP 29 HB1 ASP 29 -2.372 -14.835 -5.199
203 H PHE 30 HN PHE 30 -1.421 -11.750 -2.433
204 HA PHE 30 HA PHE 30 -4.138 -10.919 -3.164
205 HB2 PHE 30 HB2 PHE 30 -3.977 -9.243 -1.359
206 HB3 PHE 30 HB1 PHE 30 -3.769 -10.869 -0.731
207 HD1 PHE 30 HD2 PHE 30 -1.495 -11.614 -0.013
208 HD2 PHE 30 HD1 PHE 30 -2.277 -7.602 -1.179
209 HE1 PHE 30 HE2 PHE 30 0.571 -10.891 1.090
210 HE2 PHE 30 HE1 PHE 30 -0.200 -6.873 -0.075
211 HZ PHE 30 HZ PHE 30 1.226 -8.517 1.049
212 H LEU 31 HN LEU 31 -1.300 -10.917 -4.456
213 HA LEU 31 HA LEU 31 -0.785 -8.120 -4.726
214 HB2 LEU 31 HB2 LEU 31 0.574 -10.574 -5.824
215 HB3 LEU 31 HB1 LEU 31 1.057 -8.946 -6.223
216 HG LEU 31 HG LEU 31 2.576 -9.735 -4.605
217 HD11 LEU 31 HD11 LEU 31 2.297 -8.224 -2.711
218 HD12 LEU 31 HD12 LEU 31 0.632 -7.935 -3.198
219 HD13 LEU 31 HD13 LEU 31 1.954 -7.446 -4.258
220 HD21 LEU 31 HD21 LEU 31 1.307 -11.617 -3.728
221 HD22 LEU 31 HD22 LEU 31 0.247 -10.513 -2.844
222 HD23 LEU 31 HD23 LEU 31 1.954 -10.635 -2.416
223 H ASP 32 HN ASP 32 -2.203 -10.750 -6.523
224 HA ASP 32 HA ASP 32 -2.671 -8.974 -8.815
225 HB2 ASP 32 HB2 ASP 32 -1.834 -11.367 -9.101
226 HB3 ASP 32 HB1 ASP 32 -3.412 -11.898 -8.527
227 H LEU 33 HN LEU 33 -3.899 -8.911 -6.108
228 HA LEU 33 HA LEU 33 -6.734 -9.136 -6.809
229 HB2 LEU 33 HB2 LEU 33 -5.794 -10.317 -4.763
230 HB3 LEU 33 HB1 LEU 33 -5.424 -8.739 -4.111
231 HG LEU 33 HG LEU 33 -7.845 -8.218 -4.058
232 HD11 LEU 33 HD11 LEU 33 -9.461 -9.990 -4.431
233 HD12 LEU 33 HD12 LEU 33 -8.173 -11.096 -4.918
234 HD13 LEU 33 HD13 LEU 33 -8.548 -9.689 -5.907
235 HD21 LEU 33 HD21 LEU 33 -8.375 -9.718 -2.217
236 HD22 LEU 33 HD22 LEU 33 -6.707 -9.160 -2.114
237 HD23 LEU 33 HD23 LEU 33 -7.066 -10.787 -2.700
238 H ARG 34 HN ARG 34 -7.969 -7.164 -6.417
239 HA ARG 34 HA ARG 34 -6.235 -4.819 -6.790
240 HB2 ARG 34 HB2 ARG 34 -9.184 -5.068 -7.334
241 HB3 ARG 34 HB1 ARG 34 -8.133 -3.748 -7.800
242 HG2 ARG 34 HG2 ARG 34 -6.893 -5.286 -9.286
243 HG3 ARG 34 HG1 ARG 34 -8.028 -6.571 -8.860
244 HD2 ARG 34 HD2 ARG 34 -8.662 -5.533 -10.964
245 HD3 ARG 34 HD1 ARG 34 -9.882 -5.208 -9.737
246 HE ARG 34 HE ARG 34 -7.748 -3.330 -10.426
247 HH11 ARG 34 HH11 ARG 34 -11.232 -3.931 -9.947
248 HH12 ARG 34 HH12 ARG 34 -11.649 -2.279 -9.912
249 HH21 ARG 34 HH21 ARG 34 -8.313 -1.152 -10.383
250 HH22 ARG 34 HH22 ARG 34 -9.911 -0.605 -10.048
251 H PHE 35 HN PHE 35 -6.555 -2.900 -5.675
252 HA PHE 35 HA PHE 35 -7.286 -3.065 -2.971
253 HB2 PHE 35 HB2 PHE 35 -6.843 -0.681 -4.758
254 HB3 PHE 35 HB1 PHE 35 -7.356 -0.487 -3.087
255 HD1 PHE 35 HD2 PHE 35 -5.873 -1.659 -1.323
256 HD2 PHE 35 HD1 PHE 35 -4.602 -0.759 -5.273
257 HE1 PHE 35 HE2 PHE 35 -3.529 -1.754 -0.579
258 HE2 PHE 35 HE1 PHE 35 -2.267 -0.849 -4.549
259 HZ PHE 35 HZ PHE 35 -1.720 -1.346 -2.198
260 H GLU 36 HN GLU 36 -9.153 -2.078 -5.744
261 HA GLU 36 HA GLU 36 -11.311 -1.038 -4.253
262 HB2 GLU 36 HB2 GLU 36 -11.176 -1.984 -7.117
263 HB3 GLU 36 HB1 GLU 36 -12.567 -1.169 -6.406
264 HG2 GLU 36 HG2 GLU 36 -11.184 0.797 -5.939
265 HG3 GLU 36 HG1 GLU 36 -9.793 -0.026 -6.642
266 H ASP 37 HN ASP 37 -10.391 -4.266 -5.008
267 HA ASP 37 HA ASP 37 -13.047 -5.294 -4.469
268 HB2 ASP 37 HB2 ASP 37 -10.474 -6.754 -5.109
269 HB3 ASP 37 HB1 ASP 37 -12.000 -7.554 -4.735
270 H ILE 38 HN ILE 38 -10.214 -4.542 -2.753
271 HA ILE 38 HA ILE 38 -11.066 -6.249 -0.548
272 HB ILE 38 HB ILE 38 -8.951 -5.648 0.620
273 HG12 ILE 38 HG12 ILE 38 -8.230 -4.286 -1.993
274 HG13 ILE 38 HG11 ILE 38 -8.517 -3.480 -0.453
275 HG21 ILE 38 HG21 ILE 38 -9.091 -7.688 -0.634
276 HG22 ILE 38 HG22 ILE 38 -7.485 -6.985 -0.737
277 HG23 ILE 38 HG23 ILE 38 -8.586 -6.849 -2.114
278 HD11 ILE 38 HD11 ILE 38 -6.286 -5.419 -1.029
279 HD12 ILE 38 HD12 ILE 38 -6.571 -4.582 0.496
280 HD13 ILE 38 HD13 ILE 38 -6.136 -3.662 -0.945
281 H GLY 39 HN GLY 39 -12.259 -3.680 -1.494
282 HA2 GLY 39 HA2 GLY 39 -13.594 -2.166 -0.454
283 HA3 GLY 39 HA1 GLY 39 -13.061 -2.804 1.083
284 H TYR 40 HN TYR 40 -10.647 -1.567 -1.169
285 HA TYR 40 HA TYR 40 -10.107 0.467 0.787
286 HB2 TYR 40 HB2 TYR 40 -8.427 -0.574 -1.490
287 HB3 TYR 40 HB1 TYR 40 -8.180 1.051 -0.902
288 HD1 TYR 40 HD2 TYR 40 -9.053 -2.019 1.024
289 HD2 TYR 40 HD1 TYR 40 -6.204 1.033 0.231
290 HE1 TYR 40 HE2 TYR 40 -7.695 -2.798 2.906
291 HE2 TYR 40 HE1 TYR 40 -4.847 0.272 2.125
292 HH TYR 40 HH TYR 40 -5.541 -2.647 3.847
293 H ASP 41 HN ASP 41 -10.401 2.440 0.738
294 HA ASP 41 HA ASP 41 -11.617 3.724 -1.599
295 HB2 ASP 41 HB2 ASP 41 -12.759 3.796 0.736
296 HB3 ASP 41 HB1 ASP 41 -11.361 4.751 1.230
297 H SER 42 HN SER 42 -10.857 6.216 -1.286
298 HA SER 42 HA SER 42 -8.147 6.279 -2.084
299 HB2 SER 42 HB2 SER 42 -9.748 7.824 -3.030
300 HB3 SER 42 HB1 SER 42 -10.169 8.423 -1.416
301 H LEU 43 HN LEU 43 -9.981 7.179 0.784
302 HA LEU 43 HA LEU 43 -8.004 8.466 2.258
303 HB2 LEU 43 HB2 LEU 43 -10.227 6.729 3.318
304 HB3 LEU 43 HB1 LEU 43 -9.285 7.870 4.257
305 HG LEU 43 HG LEU 43 -11.214 8.543 2.040
306 HD11 LEU 43 HD11 LEU 43 -11.327 8.967 5.018
307 HD12 LEU 43 HD12 LEU 43 -12.301 7.835 4.084
308 HD13 LEU 43 HD13 LEU 43 -12.495 9.576 3.850
309 HD21 LEU 43 HD21 LEU 43 -10.785 10.879 2.642
310 HD22 LEU 43 HD22 LEU 43 -9.304 10.082 2.097
311 HD23 LEU 43 HD23 LEU 43 -9.579 10.339 3.817
312 H ALA 44 HN ALA 44 -9.005 5.074 2.478
313 HA ALA 44 HA ALA 44 -7.070 4.154 4.179
314 HB1 ALA 44 HB1 ALA 44 -8.320 2.630 1.902
315 HB2 ALA 44 HB2 ALA 44 -9.037 2.869 3.494
316 HB3 ALA 44 HB3 ALA 44 -7.554 1.940 3.337
317 H LEU 45 HN LEU 45 -6.864 4.581 0.664
318 HA LEU 45 HA LEU 45 -4.430 3.199 0.284
319 HB2 LEU 45 HB2 LEU 45 -6.181 4.215 -1.426
320 HB3 LEU 45 HB1 LEU 45 -5.135 5.613 -1.354
321 HG LEU 45 HG LEU 45 -4.330 4.574 -3.223
322 HD11 LEU 45 HD11 LEU 45 -2.427 4.786 -1.778
323 HD12 LEU 45 HD12 LEU 45 -2.287 3.359 -2.832
324 HD13 LEU 45 HD13 LEU 45 -2.752 3.166 -1.139
325 HD21 LEU 45 HD21 LEU 45 -5.814 2.671 -3.116
326 HD22 LEU 45 HD22 LEU 45 -4.650 1.874 -2.008
327 HD23 LEU 45 HD23 LEU 45 -4.172 2.314 -3.655
328 H MET 46 HN MET 46 -5.129 6.665 0.747
329 HA MET 46 HA MET 46 -2.554 7.787 0.667
330 HB2 MET 46 HB2 MET 46 -4.504 8.659 2.802
331 HB3 MET 46 HB1 MET 46 -3.350 9.626 1.896
332 HG2 MET 46 HG2 MET 46 -4.760 9.324 -0.070
333 HG3 MET 46 HG1 MET 46 -5.874 8.420 0.947
334 HE1 MET 46 HE1 MET 46 -5.511 10.061 3.731
335 HE2 MET 46 HE2 MET 46 -7.043 9.418 3.156
336 HE3 MET 46 HE3 MET 46 -6.920 11.115 3.642
337 H GLU 47 HN GLU 47 -4.432 6.705 3.366
338 HA GLU 47 HA GLU 47 -2.661 6.993 5.440
339 HB2 GLU 47 HB2 GLU 47 -5.068 5.598 4.740
340 HB3 GLU 47 HB1 GLU 47 -4.397 5.139 6.351
341 HG2 GLU 47 HG2 GLU 47 -5.268 7.828 5.259
342 HG3 GLU 47 HG1 GLU 47 -6.145 6.884 6.453
343 H THR 48 HN THR 48 -3.217 4.160 3.382
344 HA THR 48 HA THR 48 -1.493 2.303 4.574
345 HB THR 48 HB THR 48 -2.090 2.763 1.623
346 HG1 THR 48 HG1 THR 48 -3.907 2.325 3.034
347 HG21 THR 48 HG21 THR 48 -1.467 0.475 1.245
348 HG22 THR 48 HG22 THR 48 -1.126 0.230 2.959
349 HG23 THR 48 HG23 THR 48 -0.096 1.299 1.999
350 H ALA 49 HN ALA 49 -0.842 4.519 1.860
351 HA ALA 49 HA ALA 49 1.894 3.978 1.627
352 HB1 ALA 49 HB1 ALA 49 0.569 5.006 -0.159
353 HB2 ALA 49 HB2 ALA 49 2.000 5.962 0.218
354 HB3 ALA 49 HB3 ALA 49 0.417 6.478 0.793
355 H ALA 50 HN ALA 50 0.165 6.564 3.316
356 HA ALA 50 HA ALA 50 2.337 8.090 4.141
357 HB1 ALA 50 HB1 ALA 50 0.861 9.086 5.759
358 HB2 ALA 50 HB2 ALA 50 -0.276 7.745 5.593
359 HB3 ALA 50 HB3 ALA 50 -0.003 8.842 4.240
360 H ARG 51 HN ARG 51 0.734 5.389 5.784
361 HA ARG 51 HA ARG 51 2.246 5.509 8.158
362 HB2 ARG 51 HB2 ARG 51 0.114 4.280 8.010
363 HB3 ARG 51 HB1 ARG 51 0.819 3.158 6.861
364 HG2 ARG 51 HG2 ARG 51 1.955 3.403 9.629
365 HG3 ARG 51 HG1 ARG 51 0.490 2.469 9.358
366 HD2 ARG 51 HD2 ARG 51 1.673 0.998 7.825
367 HD3 ARG 51 HD1 ARG 51 3.103 2.020 7.906
368 HE ARG 51 HE ARG 51 2.862 1.392 10.438
369 HH11 ARG 51 HH11 ARG 51 2.494 -0.739 7.643
370 HH12 ARG 51 HH12 ARG 51 3.114 -2.133 8.431
371 HH21 ARG 51 HH21 ARG 51 3.762 -0.566 11.528
372 HH22 ARG 51 HH22 ARG 51 3.831 -2.009 10.676
373 H LEU 52 HN LEU 52 2.838 4.104 5.058
374 HA LEU 52 HA LEU 52 5.139 2.641 5.945
375 HB2 LEU 52 HB2 LEU 52 4.202 3.273 3.149
376 HB3 LEU 52 HB1 LEU 52 5.480 2.146 3.566
377 HG LEU 52 HG LEU 52 2.558 1.825 4.306
378 HD11 LEU 52 HD11 LEU 52 4.216 0.349 2.292
379 HD12 LEU 52 HD12 LEU 52 2.941 1.508 1.937
380 HD13 LEU 52 HD13 LEU 52 2.548 -0.016 2.741
381 HD21 LEU 52 HD21 LEU 52 4.023 0.851 5.989
382 HD22 LEU 52 HD22 LEU 52 4.918 -0.007 4.741
383 HD23 LEU 52 HD23 LEU 52 3.227 -0.418 5.054
384 H GLU 53 HN GLU 53 4.528 5.776 4.456
385 HA GLU 53 HA GLU 53 7.118 6.502 3.684
386 HB2 GLU 53 HB2 GLU 53 4.937 8.286 4.785
387 HB3 GLU 53 HB1 GLU 53 6.395 8.861 4.006
388 HG2 GLU 53 HG2 GLU 53 5.677 7.724 1.933
389 HG3 GLU 53 HG1 GLU 53 4.185 7.257 2.754
390 H SER 54 HN SER 54 5.467 7.108 6.789
391 HA SER 54 HA SER 54 7.608 8.472 8.004
392 HB2 SER 54 HB2 SER 54 6.214 8.033 10.065
393 HB3 SER 54 HB1 SER 54 5.389 8.848 8.739
394 HG SER 54 HG SER 54 4.183 7.077 9.663
395 H ARG 55 HN ARG 55 6.880 5.162 7.642
396 HA ARG 55 HA ARG 55 8.559 4.342 9.841
397 HB2 ARG 55 HB2 ARG 55 6.524 3.116 9.464
398 HB3 ARG 55 HB1 ARG 55 7.011 2.738 7.827
399 HG2 ARG 55 HG2 ARG 55 8.810 1.344 8.657
400 HG3 ARG 55 HG1 ARG 55 8.402 1.778 10.321
401 HD2 ARG 55 HD2 ARG 55 6.309 0.718 10.183
402 HD3 ARG 55 HD1 ARG 55 6.435 0.528 8.436
403 HE ARG 55 HE ARG 55 8.325 -0.847 10.213
404 HH11 ARG 55 HH11 ARG 55 5.770 -0.966 7.772
405 HH12 ARG 55 HH12 ARG 55 6.038 -2.620 7.412
406 HH21 ARG 55 HH21 ARG 55 8.594 -3.126 9.771
407 HH22 ARG 55 HH22 ARG 55 7.541 -3.837 8.600
408 H TYR 56 HN TYR 56 8.614 3.970 6.297
409 HA TYR 56 HA TYR 56 11.225 2.767 6.503
410 HB2 TYR 56 HB2 TYR 56 9.403 3.243 4.148
411 HB3 TYR 56 HB1 TYR 56 11.039 2.610 3.970
412 HD1 TYR 56 HD2 TYR 56 7.669 1.903 5.231
413 HD2 TYR 56 HD1 TYR 56 11.580 0.311 4.656
414 HE1 TYR 56 HE2 TYR 56 6.806 -0.349 5.623
415 HE2 TYR 56 HE1 TYR 56 10.719 -1.951 5.049
416 HH TYR 56 HH TYR 56 8.819 -3.122 6.053
417 H GLY 57 HN GLY 57 9.923 5.896 5.721
418 HA2 GLY 57 HA2 GLY 57 11.241 7.832 5.785
419 HA3 GLY 57 HA1 GLY 57 12.667 6.854 5.427
420 H VAL 58 HN VAL 58 9.524 7.127 3.807
421 HA VAL 58 HA VAL 58 10.955 7.935 1.376
422 HB VAL 58 HB VAL 58 9.416 6.638 -0.039
423 HG11 VAL 58 HG11 VAL 58 10.639 4.937 2.100
424 HG12 VAL 58 HG12 VAL 58 11.469 5.540 0.655
425 HG13 VAL 58 HG13 VAL 58 10.145 4.374 0.505
426 HG21 VAL 58 HG21 VAL 58 8.246 5.571 2.542
427 HG22 VAL 58 HG22 VAL 58 7.854 5.010 0.916
428 HG23 VAL 58 HG23 VAL 58 7.439 6.658 1.406
429 H SER 59 HN SER 59 8.923 8.532 -0.309
430 HA SER 59 HA SER 59 6.885 10.027 1.019
431 HB2 SER 59 HB2 SER 59 8.978 11.405 -0.709
432 HB3 SER 59 HB1 SER 59 7.491 12.154 -0.133
433 HG SER 59 HG SER 59 8.675 11.049 1.931
434 H ILE 60 HN ILE 60 5.131 9.772 -0.119
435 HA ILE 60 HA ILE 60 5.312 9.274 -3.017
436 HB ILE 60 HB ILE 60 3.427 7.887 -1.065
437 HG12 ILE 60 HG12 ILE 60 5.594 6.726 -2.836
438 HG13 ILE 60 HG11 ILE 60 5.718 6.925 -1.101
439 HG21 ILE 60 HG21 ILE 60 2.542 6.667 -3.018
440 HG22 ILE 60 HG22 ILE 60 3.566 7.637 -4.074
441 HG23 ILE 60 HG23 ILE 60 2.270 8.406 -3.162
442 HD11 ILE 60 HD11 ILE 60 3.879 5.341 -0.796
443 HD12 ILE 60 HD12 ILE 60 5.220 4.634 -1.698
444 HD13 ILE 60 HD13 ILE 60 3.767 5.159 -2.546
445 HA PRO 61 HA PRO 61 2.588 12.827 -2.955
446 HB2 PRO 61 HB2 PRO 61 2.216 12.068 -5.797
447 HB3 PRO 61 HB1 PRO 61 2.772 13.601 -5.112
448 HG2 PRO 61 HG2 PRO 61 4.464 11.955 -6.365
449 HG3 PRO 61 HG1 PRO 61 4.966 12.870 -4.932
450 HD2 PRO 61 HD2 PRO 61 4.162 10.000 -5.165
451 HD3 PRO 61 HD1 PRO 61 5.487 10.719 -4.226
452 H ASP 62 HN ASP 62 0.496 12.992 -2.702
453 HA ASP 62 HA ASP 62 -1.179 10.848 -2.220
454 HB2 ASP 62 HB2 ASP 62 -3.079 12.525 -2.277
455 HB3 ASP 62 HB1 ASP 62 -1.743 12.905 -1.199
456 H ASP 63 HN ASP 63 -0.896 12.669 -5.207
457 HA ASP 63 HA ASP 63 -3.103 11.657 -6.627
458 HB2 ASP 63 HB2 ASP 63 -1.725 13.536 -7.421
459 HB3 ASP 63 HB1 ASP 63 -0.374 12.436 -7.664
460 H VAL 64 HN VAL 64 0.101 10.362 -6.091
461 HA VAL 64 HA VAL 64 -0.083 8.383 -8.132
462 HB VAL 64 HB VAL 64 1.987 8.645 -5.932
463 HG11 VAL 64 HG11 VAL 64 2.130 7.155 -8.549
464 HG12 VAL 64 HG12 VAL 64 2.011 6.423 -6.948
465 HG13 VAL 64 HG13 VAL 64 3.452 7.334 -7.394
466 HG21 VAL 64 HG21 VAL 64 2.017 9.700 -8.755
467 HG22 VAL 64 HG22 VAL 64 3.361 9.780 -7.611
468 HG23 VAL 64 HG23 VAL 64 1.865 10.651 -7.279
469 H ALA 65 HN ALA 65 -1.166 8.448 -4.865
470 HA ALA 65 HA ALA 65 -1.013 5.675 -4.388
471 HB1 ALA 65 HB1 ALA 65 -2.523 6.203 -2.521
472 HB2 ALA 65 HB2 ALA 65 -2.692 7.859 -3.130
473 HB3 ALA 65 HB3 ALA 65 -1.124 7.270 -2.559
474 H GLY 66 HN GLY 66 -3.312 7.939 -5.759
475 HA2 GLY 66 HA2 GLY 66 -5.375 5.953 -6.095
476 HA3 GLY 66 HA1 GLY 66 -5.386 7.601 -6.712
477 H ARG 67 HN ARG 67 -2.484 6.353 -7.601
478 HA ARG 67 HA ARG 67 -3.503 5.800 -10.259
479 HB2 ARG 67 HB2 ARG 67 -0.672 6.322 -9.373
480 HB3 ARG 67 HB1 ARG 67 -1.221 6.150 -11.027
481 HG2 ARG 67 HG2 ARG 67 -1.926 8.356 -9.109
482 HG3 ARG 67 HG1 ARG 67 -0.872 8.472 -10.517
483 HD2 ARG 67 HD2 ARG 67 -2.736 8.077 -11.992
484 HD3 ARG 67 HD1 ARG 67 -3.801 7.772 -10.613
485 HE ARG 67 HE ARG 67 -2.559 10.328 -10.487
486 HH11 ARG 67 HH11 ARG 67 -5.350 8.562 -11.807
487 HH12 ARG 67 HH12 ARG 67 -6.283 9.956 -12.075
488 HH21 ARG 67 HH21 ARG 67 -3.847 12.222 -10.808
489 HH22 ARG 67 HH22 ARG 67 -5.392 12.108 -11.559
490 H VAL 68 HN VAL 68 -2.686 4.041 -7.579
491 HA VAL 68 HA VAL 68 -1.511 1.961 -9.206
492 HB VAL 68 HB VAL 68 -1.114 0.628 -7.124
493 HG11 VAL 68 HG11 VAL 68 -0.074 3.436 -7.023
494 HG12 VAL 68 HG12 VAL 68 0.600 2.096 -7.953
495 HG13 VAL 68 HG13 VAL 68 0.623 2.043 -6.191
496 HG21 VAL 68 HG21 VAL 68 -1.389 1.673 -4.950
497 HG22 VAL 68 HG22 VAL 68 -2.958 1.452 -5.739
498 HG23 VAL 68 HG23 VAL 68 -2.208 3.050 -5.689
499 H ASP 69 HN ASP 69 -2.459 -0.400 -8.133
500 HA ASP 69 HA ASP 69 -5.376 -0.268 -8.429
501 HB2 ASP 69 HB2 ASP 69 -4.241 -0.538 -10.769
502 HB3 ASP 69 HB1 ASP 69 -3.772 -2.113 -10.179
503 H THR 70 HN THR 70 -2.618 -2.482 -8.528
504 HA THR 70 HA THR 70 -3.927 -4.179 -6.585
505 HB THR 70 HB THR 70 -2.339 -5.889 -7.484
506 HG1 THR 70 HG1 THR 70 -1.357 -5.125 -9.565
507 HG21 THR 70 HG21 THR 70 -3.364 -6.094 -9.726
508 HG22 THR 70 HG22 THR 70 -3.913 -4.417 -9.606
509 HG23 THR 70 HG23 THR 70 -4.569 -5.636 -8.510
510 HA PRO 71 HA PRO 71 -1.056 -2.971 -3.429
511 HB2 PRO 71 HB2 PRO 71 -0.553 -5.870 -2.972
512 HB3 PRO 71 HB1 PRO 71 -1.052 -4.612 -1.826
513 HG2 PRO 71 HG2 PRO 71 -2.830 -6.352 -2.693
514 HG3 PRO 71 HG1 PRO 71 -3.258 -4.638 -2.558
515 HD2 PRO 71 HD2 PRO 71 -2.528 -6.213 -4.992
516 HD3 PRO 71 HD1 PRO 71 -3.824 -5.017 -4.776
517 H ARG 72 HN ARG 72 0.011 -5.276 -5.813
518 HA ARG 72 HA ARG 72 2.749 -5.250 -5.069
519 HB2 ARG 72 HB2 ARG 72 3.232 -6.414 -7.079
520 HB3 ARG 72 HB1 ARG 72 1.667 -7.000 -6.556
521 HG2 ARG 72 HG2 ARG 72 0.563 -5.643 -8.219
522 HG3 ARG 72 HG1 ARG 72 2.106 -4.917 -8.680
523 HD2 ARG 72 HD2 ARG 72 1.734 -6.551 -10.295
524 HD3 ARG 72 HD1 ARG 72 2.873 -7.296 -9.184
525 HE ARG 72 HE ARG 72 0.000 -7.848 -9.338
526 HH11 ARG 72 HH11 ARG 72 3.172 -8.922 -8.086
527 HH12 ARG 72 HH12 ARG 72 2.768 -10.567 -8.164
528 HH21 ARG 72 HH21 ARG 72 -0.510 -10.071 -9.392
529 HH22 ARG 72 HH22 ARG 72 0.590 -11.262 -8.860
530 H GLU 73 HN GLU 73 0.774 -3.103 -6.937
531 HA GLU 73 HA GLU 73 2.981 -1.697 -8.128
532 HB2 GLU 73 HB2 GLU 73 0.077 -0.872 -7.848
533 HB3 GLU 73 HB1 GLU 73 1.266 -0.068 -8.857
534 HG2 GLU 73 HG2 GLU 73 0.176 -2.851 -9.213
535 HG3 GLU 73 HG1 GLU 73 -0.139 -1.439 -10.225
536 H LEU 74 HN LEU 74 0.991 -1.425 -5.282
537 HA LEU 74 HA LEU 74 1.738 1.175 -4.387
538 HB2 LEU 74 HB2 LEU 74 -0.169 -0.397 -3.547
539 HB3 LEU 74 HB1 LEU 74 1.145 -1.213 -2.707
540 HG LEU 74 HG LEU 74 -0.298 0.378 -1.280
541 HD11 LEU 74 HD11 LEU 74 2.662 0.819 -1.335
542 HD12 LEU 74 HD12 LEU 74 1.797 -0.445 -0.456
543 HD13 LEU 74 HD13 LEU 74 1.579 1.251 -0.010
544 HD21 LEU 74 HD21 LEU 74 0.294 2.748 -1.384
545 HD22 LEU 74 HD22 LEU 74 -0.470 2.191 -2.876
546 HD23 LEU 74 HD23 LEU 74 1.276 2.433 -2.817
547 H LEU 75 HN LEU 75 2.830 -2.087 -3.701
548 HA LEU 75 HA LEU 75 4.881 -1.644 -1.915
549 HB2 LEU 75 HB2 LEU 75 3.767 -3.734 -2.395
550 HB3 LEU 75 HB1 LEU 75 4.440 -3.736 -4.013
551 HG LEU 75 HG LEU 75 6.649 -3.859 -3.014
552 HD11 LEU 75 HD11 LEU 75 6.156 -2.975 -0.806
553 HD12 LEU 75 HD12 LEU 75 6.810 -4.608 -0.648
554 HD13 LEU 75 HD13 LEU 75 5.083 -4.335 -0.479
555 HD21 LEU 75 HD21 LEU 75 5.492 -5.753 -3.904
556 HD22 LEU 75 HD22 LEU 75 4.710 -6.043 -2.347
557 HD23 LEU 75 HD23 LEU 75 6.465 -6.255 -2.511
558 H ASP 76 HN ASP 76 4.774 -1.598 -5.406
559 HA ASP 76 HA ASP 76 7.528 -1.556 -5.999
560 HB2 ASP 76 HB2 ASP 76 5.929 -2.057 -7.739
561 HB3 ASP 76 HB1 ASP 76 5.160 -0.486 -7.539
562 H LEU 77 HN LEU 77 5.160 0.988 -5.485
563 HA LEU 77 HA LEU 77 6.701 3.237 -6.016
564 HB2 LEU 77 HB2 LEU 77 4.564 2.851 -3.950
565 HB3 LEU 77 HB1 LEU 77 5.160 4.404 -4.496
566 HG LEU 77 HG LEU 77 3.628 2.384 -6.118
567 HD11 LEU 77 HD11 LEU 77 2.868 5.110 -5.084
568 HD12 LEU 77 HD12 LEU 77 2.302 3.569 -4.457
569 HD13 LEU 77 HD13 LEU 77 1.865 4.062 -6.097
570 HD21 LEU 77 HD21 LEU 77 3.621 4.071 -7.893
571 HD22 LEU 77 HD22 LEU 77 5.275 3.604 -7.493
572 HD23 LEU 77 HD23 LEU 77 4.617 5.125 -6.890
573 H ILE 78 HN ILE 78 6.177 1.519 -2.991
574 HA ILE 78 HA ILE 78 7.721 3.114 -1.293
575 HB ILE 78 HB ILE 78 7.200 0.136 -1.112
576 HG12 ILE 78 HG12 ILE 78 5.139 1.491 -1.136
577 HG13 ILE 78 HG11 ILE 78 5.399 0.736 0.435
578 HG21 ILE 78 HG21 ILE 78 8.143 2.043 1.036
579 HG22 ILE 78 HG22 ILE 78 9.116 0.784 0.273
580 HG23 ILE 78 HG23 ILE 78 7.737 0.342 1.276
581 HD11 ILE 78 HD11 ILE 78 6.003 3.606 -0.250
582 HD12 ILE 78 HD12 ILE 78 6.213 2.842 1.326
583 HD13 ILE 78 HD13 ILE 78 4.596 3.030 0.642
584 H ASN 79 HN ASN 79 8.610 -0.023 -2.719
585 HA ASN 79 HA ASN 79 11.288 0.127 -1.846
586 HB2 ASN 79 HB2 ASN 79 10.090 -1.633 -3.983
587 HB3 ASN 79 HB1 ASN 79 11.721 -1.798 -3.343
588 HD21 ASN 79 HD21 ASN 79 9.731 -3.760 -3.275
589 HD22 ASN 79 HD22 ASN 79 9.345 -4.098 -1.614
590 H GLY 80 HN GLY 80 9.760 1.343 -4.679
591 HA2 GLY 80 HA2 GLY 80 12.141 1.727 -6.191
592 HA3 GLY 80 HA1 GLY 80 10.597 2.532 -6.458
593 H ALA 81 HN ALA 81 10.166 3.860 -4.144
594 HA ALA 81 HA ALA 81 11.872 6.108 -4.418
595 HB1 ALA 81 HB1 ALA 81 9.843 5.510 -2.266
596 HB2 ALA 81 HB2 ALA 81 9.513 6.322 -3.803
597 HB3 ALA 81 HB3 ALA 81 10.558 7.085 -2.604
598 H LEU 82 HN LEU 82 11.712 3.446 -2.093
599 HA LEU 82 HA LEU 82 13.381 4.482 -0.130
600 HB2 LEU 82 HB2 LEU 82 11.925 2.561 0.188
601 HB3 LEU 82 HB1 LEU 82 12.848 1.640 -0.981
602 HG LEU 82 HG LEU 82 14.775 1.806 0.448
603 HD11 LEU 82 HD11 LEU 82 12.841 3.009 2.445
604 HD12 LEU 82 HD12 LEU 82 14.237 3.803 1.711
605 HD13 LEU 82 HD13 LEU 82 14.477 2.470 2.842
606 HD21 LEU 82 HD21 LEU 82 14.006 0.151 2.129
607 HD22 LEU 82 HD22 LEU 82 13.408 -0.185 0.509
608 HD23 LEU 82 HD23 LEU 82 12.342 0.546 1.710
609 H ALA 83 HN ALA 83 14.058 2.708 -3.085
610 HA ALA 83 HA ALA 83 16.748 2.080 -2.568
611 HB1 ALA 83 HB1 ALA 83 15.410 2.428 -5.234
612 HB2 ALA 83 HB2 ALA 83 15.356 0.970 -4.253
613 HB3 ALA 83 HB3 ALA 83 16.899 1.536 -4.917
614 H GLU 84 HN GLU 84 15.281 5.100 -3.549
615 HA GLU 84 HA GLU 84 17.572 6.209 -4.791
616 HB2 GLU 84 HB2 GLU 84 15.200 7.588 -3.547
617 HB3 GLU 84 HB1 GLU 84 16.349 8.244 -4.689
618 HG2 GLU 84 HG2 GLU 84 15.497 6.667 -6.390
619 HG3 GLU 84 HG1 GLU 84 14.292 6.119 -5.218
620 H ALA 85 HN ALA 85 16.394 5.839 -1.547
621 HA ALA 85 HA ALA 85 18.229 7.915 -0.600
622 HB1 ALA 85 HB1 ALA 85 15.869 6.713 0.830
623 HB2 ALA 85 HB2 ALA 85 15.876 8.256 -0.020
624 HB3 ALA 85 HB3 ALA 85 16.886 8.034 1.408
625 H ALA 86 HN ALA 86 17.345 4.515 -0.168
626 HA ALA 86 HA ALA 86 19.784 4.193 1.403
627 HB1 ALA 86 HB1 ALA 86 17.876 4.204 2.946
628 HB2 ALA 86 HB2 ALA 86 18.622 2.601 2.852
629 HB3 ALA 86 HB3 ALA 86 17.109 2.924 2.000
630 H28A SDO 101 H28A SDO 42 -6.705 10.710 -1.368
631 H28B SDO 101 H28B SDO 42 -5.156 10.703 -2.206
632 H30A SDO 101 H30A SDO 42 -6.163 12.775 -0.266
633 H30B SDO 101 H30B SDO 42 -5.643 14.183 -1.179
634 H30C SDO 101 H30C SDO 42 -4.587 12.768 -1.062
635 H31A SDO 101 H31A SDO 42 -4.490 12.662 -3.519
636 H31B SDO 101 H31B SDO 42 -5.645 14.035 -3.682
637 H31C SDO 101 H31C SDO 42 -6.012 12.460 -4.420
638 H32A SDO 101 H32A SDO 42 -8.240 12.635 -1.621
639 H33A SDO 101 H33A SDO 42 -7.882 11.517 -3.697
640 H36A SDO 101 H36A SDO 42 -9.800 14.017 -3.218
641 H37A SDO 101 H37A SDO 42 -8.945 16.840 -3.282
642 H37B SDO 101 H37B SDO 42 -10.402 16.181 -4.027
643 H38A SDO 101 H38A SDO 42 -10.966 17.563 -2.075
644 H38B SDO 101 H38B SDO 42 -11.401 15.876 -1.796
645 H41A SDO 101 H41A SDO 42 -10.312 14.676 -0.315
646 H42A SDO 101 H42A SDO 42 -8.031 14.855 0.917
647 H42B SDO 101 H42B SDO 42 -8.943 16.082 1.816
648 H43A SDO 101 H43A SDO 42 -9.795 13.272 1.320
649 H43B SDO 101 H43B SDO 42 -10.517 14.343 2.507
650 H1A SDO 101 H1A SDO 42 -6.750 14.275 4.519
651 H1B SDO 101 H1B SDO 42 -6.204 13.125 3.329
652 H2A SDO 101 H2A SDO 42 -7.112 15.916 2.743
653 H2B SDO 101 H2B SDO 42 -6.488 14.773 1.583
654 H4A SDO 101 H4A SDO 42 -3.535 16.057 4.388
655 H4B SDO 101 H4B SDO 42 -2.968 14.882 3.228
656 H5A SDO 101 H5A SDO 42 -4.461 13.191 4.168
657 H5B SDO 101 H5B SDO 42 -4.989 14.348 5.375
658 H6A SDO 101 H6A SDO 42 -2.748 14.525 6.257
659 H6B SDO 101 H6B SDO 42 -2.154 13.402 5.037
660 H8A SDO 101 H8A SDO 42 -4.659 10.975 5.876
661 H8B SDO 101 H8B SDO 42 -5.410 12.561 6.124
662 H8C SDO 101 H8C SDO 42 -5.004 11.547 7.511
Start of MODEL 17
1 H1 MET 1 HT1 MET 1 22.783 -4.716 0.943
2 H2 MET 1 HT2 MET 1 23.033 -6.385 1.028
3 H3 MET 1 HT3 MET 1 23.033 -5.445 2.447
4 HA MET 1 HA MET 1 20.785 -5.725 0.547
5 HB2 MET 1 HB2 MET 1 19.643 -7.141 2.159
6 HB3 MET 1 HB1 MET 1 21.186 -7.863 1.747
7 HG2 MET 1 HG2 MET 1 22.129 -7.084 3.852
8 HG3 MET 1 HG1 MET 1 20.603 -6.294 4.249
9 HE1 MET 1 HE1 MET 1 18.457 -8.446 3.245
10 HE2 MET 1 HE2 MET 1 18.353 -7.603 4.792
11 HE3 MET 1 HE3 MET 1 18.205 -9.352 4.738
12 H ALA 2 HN ALA 2 18.842 -4.839 1.261
13 HA ALA 2 HA ALA 2 18.997 -2.967 3.494
14 HB1 ALA 2 HB1 ALA 2 17.760 -1.303 2.137
15 HB2 ALA 2 HB2 ALA 2 17.881 -2.378 0.741
16 HB3 ALA 2 HB3 ALA 2 19.338 -1.670 1.429
17 H THR 3 HN THR 3 16.729 -2.390 4.192
18 HA THR 3 HA THR 3 15.121 -4.756 4.292
19 HB THR 3 HB THR 3 14.408 -1.967 5.276
20 HG1 THR 3 HG1 THR 3 16.393 -2.713 6.070
21 HG21 THR 3 HG21 THR 3 13.492 -4.717 6.165
22 HG22 THR 3 HG22 THR 3 12.522 -3.573 5.242
23 HG23 THR 3 HG23 THR 3 13.003 -3.190 6.895
24 H LEU 4 HN LEU 4 14.807 -4.924 2.026
25 HA LEU 4 HA LEU 4 13.107 -3.022 0.642
26 HB2 LEU 4 HB2 LEU 4 15.056 -4.486 -0.287
27 HB3 LEU 4 HB1 LEU 4 13.866 -5.774 -0.301
28 HG LEU 4 HG LEU 4 12.467 -4.317 -1.786
29 HD11 LEU 4 HD11 LEU 4 15.004 -2.676 -1.865
30 HD12 LEU 4 HD12 LEU 4 13.435 -2.153 -1.248
31 HD13 LEU 4 HD13 LEU 4 13.642 -2.478 -2.960
32 HD21 LEU 4 HD21 LEU 4 13.796 -4.809 -3.786
33 HD22 LEU 4 HD22 LEU 4 13.822 -6.155 -2.654
34 HD23 LEU 4 HD23 LEU 4 15.212 -5.078 -2.776
35 H LEU 5 HN LEU 5 10.937 -3.164 0.798
36 HA LEU 5 HA LEU 5 9.796 -5.094 2.525
37 HB2 LEU 5 HB2 LEU 5 8.511 -3.015 0.805
38 HB3 LEU 5 HB1 LEU 5 7.586 -4.092 1.813
39 HG LEU 5 HG LEU 5 9.067 -3.145 3.718
40 HD11 LEU 5 HD11 LEU 5 9.329 -0.944 1.680
41 HD12 LEU 5 HD12 LEU 5 10.633 -1.899 2.383
42 HD13 LEU 5 HD13 LEU 5 9.701 -0.800 3.402
43 HD21 LEU 5 HD21 LEU 5 6.823 -1.610 2.412
44 HD22 LEU 5 HD22 LEU 5 7.406 -1.378 4.070
45 HD23 LEU 5 HD23 LEU 5 6.713 -2.929 3.592
46 H THR 6 HN THR 6 8.570 -6.765 2.211
47 HA THR 6 HA THR 6 8.258 -7.703 -0.521
48 HB THR 6 HB THR 6 8.129 -9.975 0.608
49 HG1 THR 6 HG1 THR 6 8.785 -10.135 2.690
50 HG21 THR 6 HG21 THR 6 10.144 -9.206 -0.580
51 HG22 THR 6 HG22 THR 6 10.561 -10.184 0.827
52 HG23 THR 6 HG23 THR 6 10.717 -8.424 0.895
53 H THR 7 HN THR 7 6.438 -9.633 -0.259
54 HA THR 7 HA THR 7 3.975 -8.525 -0.236
55 HB THR 7 HB THR 7 4.359 -11.347 0.565
56 HG1 THR 7 HG1 THR 7 5.067 -11.162 -1.998
57 HG21 THR 7 HG21 THR 7 3.047 -9.957 -1.776
58 HG22 THR 7 HG22 THR 7 2.225 -10.441 -0.299
59 HG23 THR 7 HG23 THR 7 2.896 -11.667 -1.393
60 H ASP 8 HN ASP 8 5.601 -10.448 2.280
61 HA ASP 8 HA ASP 8 3.555 -10.738 4.103
62 HB2 ASP 8 HB2 ASP 8 6.524 -10.595 4.668
63 HB3 ASP 8 HB1 ASP 8 5.315 -11.120 5.827
64 H ASP 9 HN ASP 9 5.903 -8.085 3.947
65 HA ASP 9 HA ASP 9 4.925 -6.963 6.409
66 HB2 ASP 9 HB2 ASP 9 7.310 -6.507 5.428
67 HB3 ASP 9 HB1 ASP 9 6.477 -5.400 4.370
68 H LEU 10 HN LEU 10 4.364 -6.375 3.000
69 HA LEU 10 HA LEU 10 2.827 -4.033 3.300
70 HB2 LEU 10 HB2 LEU 10 3.723 -4.769 1.128
71 HB3 LEU 10 HB1 LEU 10 2.595 -6.119 1.134
72 HG LEU 10 HG LEU 10 0.729 -4.442 1.197
73 HD11 LEU 10 HD11 LEU 10 1.917 -2.558 2.080
74 HD12 LEU 10 HD12 LEU 10 1.213 -2.140 0.521
75 HD13 LEU 10 HD13 LEU 10 2.938 -2.470 0.642
76 HD21 LEU 10 HD21 LEU 10 1.370 -5.549 -0.882
77 HD22 LEU 10 HD22 LEU 10 2.595 -4.314 -1.175
78 HD23 LEU 10 HD23 LEU 10 0.885 -3.878 -1.180
79 H ARG 11 HN ARG 11 2.006 -7.442 3.281
80 HA ARG 11 HA ARG 11 -0.752 -7.378 3.359
81 HB2 ARG 11 HB2 ARG 11 0.527 -9.437 3.212
82 HB3 ARG 11 HB1 ARG 11 1.157 -9.205 4.834
83 HG2 ARG 11 HG2 ARG 11 -1.081 -9.528 5.756
84 HG3 ARG 11 HG1 ARG 11 -1.726 -9.723 4.122
85 HD2 ARG 11 HD2 ARG 11 -1.359 -11.891 5.197
86 HD3 ARG 11 HD1 ARG 11 -0.308 -11.695 3.794
87 HE ARG 11 HE ARG 11 0.602 -11.240 6.557
88 HH11 ARG 11 HH11 ARG 11 1.026 -12.884 3.401
89 HH12 ARG 11 HH12 ARG 11 2.580 -13.460 3.789
90 HH21 ARG 11 HH21 ARG 11 2.829 -12.064 7.017
91 HH22 ARG 11 HH22 ARG 11 3.605 -12.945 5.773
92 H ARG 12 HN ARG 12 1.514 -7.138 6.017
93 HA ARG 12 HA ARG 12 -0.366 -6.872 8.161
94 HB2 ARG 12 HB2 ARG 12 2.443 -5.792 8.022
95 HB3 ARG 12 HB1 ARG 12 1.516 -6.210 9.458
96 HG2 ARG 12 HG2 ARG 12 1.668 -8.518 9.008
97 HG3 ARG 12 HG1 ARG 12 2.351 -8.224 7.398
98 HD2 ARG 12 HD2 ARG 12 4.098 -8.865 8.940
99 HD3 ARG 12 HD1 ARG 12 4.319 -7.183 8.464
100 HE ARG 12 HE ARG 12 3.015 -7.950 10.971
101 HH11 ARG 12 HH11 ARG 12 5.455 -5.913 9.249
102 HH12 ARG 12 HH12 ARG 12 6.021 -5.229 10.701
103 HH21 ARG 12 HH21 ARG 12 3.868 -6.991 12.877
104 HH22 ARG 12 HH22 ARG 12 5.123 -5.842 12.828
105 H ALA 13 HN ALA 13 1.573 -4.502 6.382
106 HA ALA 13 HA ALA 13 0.657 -2.294 7.842
107 HB1 ALA 13 HB1 ALA 13 1.842 -2.300 5.079
108 HB2 ALA 13 HB2 ALA 13 2.763 -2.316 6.586
109 HB3 ALA 13 HB3 ALA 13 1.748 -0.928 6.185
110 H LEU 14 HN LEU 14 -0.530 -3.732 4.836
111 HA LEU 14 HA LEU 14 -2.275 -1.691 4.096
112 HB2 LEU 14 HB2 LEU 14 -1.591 -3.664 2.725
113 HB3 LEU 14 HB1 LEU 14 -2.636 -4.661 3.716
114 HG LEU 14 HG LEU 14 -4.573 -3.365 2.938
115 HD11 LEU 14 HD11 LEU 14 -2.561 -2.037 1.117
116 HD12 LEU 14 HD12 LEU 14 -3.415 -1.271 2.447
117 HD13 LEU 14 HD13 LEU 14 -4.314 -1.846 1.037
118 HD21 LEU 14 HD21 LEU 14 -4.601 -4.269 0.653
119 HD22 LEU 14 HD22 LEU 14 -3.958 -5.433 1.816
120 HD23 LEU 14 HD23 LEU 14 -2.863 -4.558 0.754
121 H VAL 15 HN VAL 15 -2.667 -4.421 6.290
122 HA VAL 15 HA VAL 15 -5.440 -4.206 6.762
123 HB VAL 15 HB VAL 15 -3.297 -5.294 8.622
124 HG11 VAL 15 HG11 VAL 15 -5.113 -6.626 9.630
125 HG12 VAL 15 HG12 VAL 15 -6.283 -5.868 8.556
126 HG13 VAL 15 HG13 VAL 15 -5.464 -4.903 9.782
127 HG21 VAL 15 HG21 VAL 15 -4.964 -6.672 6.534
128 HG22 VAL 15 HG22 VAL 15 -3.898 -7.468 7.710
129 HG23 VAL 15 HG23 VAL 15 -3.223 -6.357 6.515
130 H GLU 16 HN GLU 16 -2.710 -2.543 8.076
131 HA GLU 16 HA GLU 16 -3.848 -1.553 10.443
132 HB2 GLU 16 HB2 GLU 16 -1.628 -0.369 8.785
133 HB3 GLU 16 HB1 GLU 16 -2.000 0.028 10.459
134 HG2 GLU 16 HG2 GLU 16 -1.192 -2.674 9.462
135 HG3 GLU 16 HG1 GLU 16 -0.090 -1.562 10.232
136 H SER 17 HN SER 17 -4.234 -0.506 7.140
137 HA SER 17 HA SER 17 -5.267 2.074 7.958
138 HB2 SER 17 HB2 SER 17 -5.038 0.842 5.214
139 HB3 SER 17 HB1 SER 17 -5.477 2.513 5.575
140 HG SER 17 HG SER 17 -3.481 2.607 6.756
141 H ALA 18 HN ALA 18 -6.503 -0.922 7.974
142 HA ALA 18 HA ALA 18 -9.186 -0.093 7.193
143 HB1 ALA 18 HB1 ALA 18 -8.059 -2.819 7.864
144 HB2 ALA 18 HB2 ALA 18 -8.420 -2.212 6.242
145 HB3 ALA 18 HB3 ALA 18 -9.727 -2.485 7.393
146 H GLY 19 HN GLY 19 -10.445 0.598 8.811
147 HA2 GLY 19 HA2 GLY 19 -9.441 0.283 11.534
148 HA3 GLY 19 HA1 GLY 19 -10.661 1.432 10.998
149 H GLU 20 HN GLU 20 -12.676 0.352 10.133
150 HA GLU 20 HA GLU 20 -13.484 -1.589 12.184
151 HB2 GLU 20 HB2 GLU 20 -15.799 -0.837 11.666
152 HB3 GLU 20 HB1 GLU 20 -14.768 0.454 12.263
153 HG2 GLU 20 HG2 GLU 20 -14.496 1.326 10.034
154 HG3 GLU 20 HG1 GLU 20 -15.411 -0.020 9.357
155 H THR 21 HN THR 21 -12.316 -1.683 9.321
156 HA THR 21 HA THR 21 -14.180 -3.601 8.144
157 HB THR 21 HB THR 21 -11.846 -2.123 6.906
158 HG1 THR 21 HG1 THR 21 -14.595 -1.442 7.140
159 HG21 THR 21 HG21 THR 21 -14.250 -3.498 5.651
160 HG22 THR 21 HG22 THR 21 -12.600 -4.112 5.640
161 HG23 THR 21 HG23 THR 21 -12.994 -2.628 4.772
162 H ASP 22 HN ASP 22 -13.316 -5.258 9.733
163 HA ASP 22 HA ASP 22 -10.631 -6.141 8.962
164 HB2 ASP 22 HB2 ASP 22 -10.567 -5.369 11.277
165 HB3 ASP 22 HB1 ASP 22 -11.925 -6.414 11.686
166 H GLY 23 HN GLY 23 -11.207 -7.491 7.449
167 HA2 GLY 23 HA2 GLY 23 -11.734 -10.120 8.186
168 HA3 GLY 23 HA1 GLY 23 -13.251 -9.426 7.604
169 H THR 24 HN THR 24 -10.399 -8.120 6.195
170 HA THR 24 HA THR 24 -11.056 -9.155 3.657
171 HB THR 24 HB THR 24 -8.851 -7.671 3.390
172 HG1 THR 24 HG1 THR 24 -8.675 -6.188 5.036
173 HG21 THR 24 HG21 THR 24 -11.604 -6.558 3.974
174 HG22 THR 24 HG22 THR 24 -11.048 -7.150 2.406
175 HG23 THR 24 HG23 THR 24 -10.320 -5.706 3.120
176 H ASP 25 HN ASP 25 -10.456 -11.309 3.591
177 HA ASP 25 HA ASP 25 -8.158 -12.358 4.836
178 HB2 ASP 25 HB2 ASP 25 -8.562 -14.427 3.704
179 HB3 ASP 25 HB1 ASP 25 -10.142 -13.735 4.025
180 H LEU 26 HN LEU 26 -6.108 -12.447 4.266
181 HA LEU 26 HA LEU 26 -5.369 -11.319 1.640
182 HB2 LEU 26 HB2 LEU 26 -5.655 -9.673 3.653
183 HB3 LEU 26 HB1 LEU 26 -4.097 -10.297 4.148
184 HG LEU 26 HG LEU 26 -3.196 -9.557 1.928
185 HD11 LEU 26 HD11 LEU 26 -5.318 -9.515 0.711
186 HD12 LEU 26 HD12 LEU 26 -4.524 -7.939 0.662
187 HD13 LEU 26 HD13 LEU 26 -5.888 -8.202 1.745
188 HD21 LEU 26 HD21 LEU 26 -4.438 -7.439 3.685
189 HD22 LEU 26 HD22 LEU 26 -3.119 -7.192 2.543
190 HD23 LEU 26 HD23 LEU 26 -2.886 -8.232 3.950
191 H SER 27 HN SER 27 -4.991 -13.819 3.696
192 HA SER 27 HA SER 27 -2.122 -14.056 3.670
193 HB2 SER 27 HB2 SER 27 -4.215 -16.128 4.395
194 HB3 SER 27 HB1 SER 27 -2.506 -16.149 4.831
195 HG SER 27 HG SER 27 -4.594 -14.594 5.806
196 H GLY 28 HN GLY 28 -0.919 -15.359 2.302
197 HA2 GLY 28 HA2 GLY 28 -0.651 -16.952 0.623
198 HA3 GLY 28 HA1 GLY 28 -2.360 -16.792 0.224
199 H ASP 29 HN ASP 29 -2.722 -15.812 -1.600
200 HA ASP 29 HA ASP 29 -0.699 -13.938 -2.627
201 HB2 ASP 29 HB2 ASP 29 -0.776 -15.898 -4.031
202 HB3 ASP 29 HB1 ASP 29 -2.532 -15.826 -4.115
203 H PHE 30 HN PHE 30 -1.307 -11.934 -2.706
204 HA PHE 30 HA PHE 30 -4.124 -11.274 -3.250
205 HB2 PHE 30 HB2 PHE 30 -4.164 -9.657 -1.436
206 HB3 PHE 30 HB1 PHE 30 -3.784 -11.252 -0.800
207 HD1 PHE 30 HD2 PHE 30 -1.383 -11.746 -0.139
208 HD2 PHE 30 HD1 PHE 30 -2.713 -7.830 -1.135
209 HE1 PHE 30 HE2 PHE 30 0.586 -10.794 0.970
210 HE2 PHE 30 HE1 PHE 30 -0.745 -6.873 -0.021
211 HZ PHE 30 HZ PHE 30 0.910 -8.358 1.034
212 H LEU 31 HN LEU 31 -1.399 -11.083 -4.681
213 HA LEU 31 HA LEU 31 -0.678 -8.368 -4.492
214 HB2 LEU 31 HB2 LEU 31 0.198 -10.552 -6.320
215 HB3 LEU 31 HB1 LEU 31 0.789 -8.916 -6.480
216 HG LEU 31 HG LEU 31 2.438 -10.111 -5.331
217 HD11 LEU 31 HD11 LEU 31 0.860 -8.540 -3.312
218 HD12 LEU 31 HD12 LEU 31 2.097 -7.934 -4.419
219 HD13 LEU 31 HD13 LEU 31 2.540 -9.045 -3.128
220 HD21 LEU 31 HD21 LEU 31 1.158 -12.081 -4.683
221 HD22 LEU 31 HD22 LEU 31 0.303 -11.148 -3.454
222 HD23 LEU 31 HD23 LEU 31 2.036 -11.442 -3.295
223 H ASP 32 HN ASP 32 -2.846 -10.085 -6.563
224 HA ASP 32 HA ASP 32 -3.103 -7.626 -8.158
225 HB2 ASP 32 HB2 ASP 32 -3.970 -8.888 -9.998
226 HB3 ASP 32 HB1 ASP 32 -2.545 -9.737 -9.442
227 H LEU 33 HN LEU 33 -4.250 -8.713 -5.541
228 HA LEU 33 HA LEU 33 -7.084 -8.737 -5.956
229 HB2 LEU 33 HB2 LEU 33 -5.901 -9.952 -4.108
230 HB3 LEU 33 HB1 LEU 33 -5.456 -8.413 -3.427
231 HG LEU 33 HG LEU 33 -7.807 -7.905 -2.976
232 HD11 LEU 33 HD11 LEU 33 -8.823 -9.137 -4.817
233 HD12 LEU 33 HD12 LEU 33 -9.502 -9.653 -3.276
234 HD13 LEU 33 HD13 LEU 33 -8.309 -10.661 -4.101
235 HD21 LEU 33 HD21 LEU 33 -6.933 -10.608 -1.969
236 HD22 LEU 33 HD22 LEU 33 -8.125 -9.549 -1.215
237 HD23 LEU 33 HD23 LEU 33 -6.437 -9.055 -1.298
238 H ARG 34 HN ARG 34 -8.010 -6.980 -6.546
239 HA ARG 34 HA ARG 34 -6.673 -4.468 -6.587
240 HB2 ARG 34 HB2 ARG 34 -9.526 -5.092 -7.316
241 HB3 ARG 34 HB1 ARG 34 -8.618 -3.657 -7.781
242 HG2 ARG 34 HG2 ARG 34 -7.069 -5.044 -9.068
243 HG3 ARG 34 HG1 ARG 34 -7.967 -6.494 -8.604
244 HD2 ARG 34 HD2 ARG 34 -8.624 -5.813 -10.821
245 HD3 ARG 34 HD1 ARG 34 -9.963 -5.534 -9.705
246 HE ARG 34 HE ARG 34 -8.102 -3.387 -10.337
247 HH11 ARG 34 HH11 ARG 34 -11.388 -4.683 -10.787
248 HH12 ARG 34 HH12 ARG 34 -12.074 -3.156 -11.060
249 HH21 ARG 34 HH21 ARG 34 -9.048 -1.370 -10.592
250 HH22 ARG 34 HH22 ARG 34 -10.744 -1.184 -10.820
251 H PHE 35 HN PHE 35 -6.958 -2.644 -5.480
252 HA PHE 35 HA PHE 35 -7.808 -2.777 -2.824
253 HB2 PHE 35 HB2 PHE 35 -7.290 -0.363 -4.540
254 HB3 PHE 35 HB1 PHE 35 -7.591 -0.270 -2.811
255 HD1 PHE 35 HD2 PHE 35 -6.004 -1.585 -1.287
256 HD2 PHE 35 HD1 PHE 35 -5.160 -0.706 -5.360
257 HE1 PHE 35 HE2 PHE 35 -3.612 -1.974 -0.876
258 HE2 PHE 35 HE1 PHE 35 -2.762 -1.101 -4.944
259 HZ PHE 35 HZ PHE 35 -1.983 -1.646 -2.684
260 H GLU 36 HN GLU 36 -9.519 -1.430 -5.623
261 HA GLU 36 HA GLU 36 -11.676 -0.381 -4.130
262 HB2 GLU 36 HB2 GLU 36 -12.917 -0.292 -6.237
263 HB3 GLU 36 HB1 GLU 36 -11.289 0.349 -6.419
264 HG2 GLU 36 HG2 GLU 36 -10.603 -1.449 -7.717
265 HG3 GLU 36 HG1 GLU 36 -11.882 -2.497 -7.107
266 H ASP 37 HN ASP 37 -10.909 -3.592 -5.012
267 HA ASP 37 HA ASP 37 -13.641 -4.527 -4.867
268 HB2 ASP 37 HB2 ASP 37 -12.072 -5.596 -6.437
269 HB3 ASP 37 HB1 ASP 37 -11.047 -6.081 -5.087
270 H ILE 38 HN ILE 38 -10.762 -4.429 -2.920
271 HA ILE 38 HA ILE 38 -12.012 -5.998 -0.842
272 HB ILE 38 HB ILE 38 -9.836 -5.821 0.369
273 HG12 ILE 38 HG12 ILE 38 -8.924 -4.448 -2.182
274 HG13 ILE 38 HG11 ILE 38 -9.050 -3.688 -0.603
275 HG21 ILE 38 HG21 ILE 38 -8.667 -7.340 -1.135
276 HG22 ILE 38 HG22 ILE 38 -9.695 -6.836 -2.469
277 HG23 ILE 38 HG23 ILE 38 -10.395 -7.695 -1.092
278 HD11 ILE 38 HD11 ILE 38 -7.159 -5.911 -1.353
279 HD12 ILE 38 HD12 ILE 38 -7.294 -5.177 0.244
280 HD13 ILE 38 HD13 ILE 38 -6.748 -4.211 -1.122
281 H GLY 39 HN GLY 39 -12.812 -3.191 -1.531
282 HA2 GLY 39 HA2 GLY 39 -13.962 -1.622 -0.283
283 HA3 GLY 39 HA1 GLY 39 -13.517 -2.521 1.157
284 H TYR 40 HN TYR 40 -10.988 -1.413 -0.938
285 HA TYR 40 HA TYR 40 -10.280 0.513 1.135
286 HB2 TYR 40 HB2 TYR 40 -8.628 -0.930 -0.908
287 HB3 TYR 40 HB1 TYR 40 -8.050 0.557 -0.174
288 HD1 TYR 40 HD2 TYR 40 -9.489 -2.744 0.905
289 HD2 TYR 40 HD1 TYR 40 -6.719 0.393 1.657
290 HE1 TYR 40 HE2 TYR 40 -8.617 -3.985 2.825
291 HE2 TYR 40 HE1 TYR 40 -5.839 -0.812 3.572
292 HH TYR 40 HH TYR 40 -6.354 -2.575 5.057
293 H ASP 41 HN ASP 41 -10.946 2.408 0.805
294 HA ASP 41 HA ASP 41 -11.371 3.588 -1.770
295 HB2 ASP 41 HB2 ASP 41 -11.316 4.765 1.021
296 HB3 ASP 41 HB1 ASP 41 -11.703 5.691 -0.429
297 H SER 42 HN SER 42 -10.345 5.861 -2.063
298 HA SER 42 HA SER 42 -7.606 5.682 -2.498
299 HB2 SER 42 HB2 SER 42 -7.846 8.207 -2.681
300 HB3 SER 42 HB1 SER 42 -8.973 7.269 -3.678
301 H LEU 43 HN LEU 43 -9.298 7.625 -0.172
302 HA LEU 43 HA LEU 43 -7.521 8.371 1.677
303 HB2 LEU 43 HB2 LEU 43 -10.331 7.437 2.094
304 HB3 LEU 43 HB1 LEU 43 -9.359 8.087 3.404
305 HG LEU 43 HG LEU 43 -10.033 9.569 0.861
306 HD11 LEU 43 HD11 LEU 43 -11.135 9.836 3.657
307 HD12 LEU 43 HD12 LEU 43 -12.021 9.257 2.244
308 HD13 LEU 43 HD13 LEU 43 -11.466 10.929 2.317
309 HD21 LEU 43 HD21 LEU 43 -9.078 11.496 2.066
310 HD22 LEU 43 HD22 LEU 43 -7.888 10.201 1.843
311 HD23 LEU 43 HD23 LEU 43 -8.659 10.419 3.403
312 H ALA 44 HN ALA 44 -8.643 5.057 1.349
313 HA ALA 44 HA ALA 44 -7.507 4.274 3.858
314 HB1 ALA 44 HB1 ALA 44 -8.028 1.981 3.172
315 HB2 ALA 44 HB2 ALA 44 -8.420 2.546 1.549
316 HB3 ALA 44 HB3 ALA 44 -9.418 3.036 2.919
317 H LEU 45 HN LEU 45 -6.680 3.804 0.457
318 HA LEU 45 HA LEU 45 -4.216 2.502 0.864
319 HB2 LEU 45 HB2 LEU 45 -5.416 2.377 -1.174
320 HB3 LEU 45 HB1 LEU 45 -5.268 4.095 -1.428
321 HG LEU 45 HG LEU 45 -3.085 3.917 -2.247
322 HD11 LEU 45 HD11 LEU 45 -2.209 2.695 -0.197
323 HD12 LEU 45 HD12 LEU 45 -1.551 2.168 -1.735
324 HD13 LEU 45 HD13 LEU 45 -2.796 1.185 -0.928
325 HD21 LEU 45 HD21 LEU 45 -3.051 1.972 -3.626
326 HD22 LEU 45 HD22 LEU 45 -4.722 2.657 -3.518
327 HD23 LEU 45 HD23 LEU 45 -4.211 1.291 -2.483
328 H MET 46 HN MET 46 -5.056 5.913 0.475
329 HA MET 46 HA MET 46 -2.370 6.803 0.331
330 HB2 MET 46 HB2 MET 46 -3.314 9.120 0.456
331 HB3 MET 46 HB1 MET 46 -4.312 8.101 -0.533
332 HG2 MET 46 HG2 MET 46 -5.696 9.436 0.658
333 HG3 MET 46 HG1 MET 46 -5.777 7.836 1.392
334 HE1 MET 46 HE1 MET 46 -2.860 10.414 1.919
335 HE2 MET 46 HE2 MET 46 -3.416 11.316 3.330
336 HE3 MET 46 HE3 MET 46 -4.260 11.479 1.793
337 H GLU 47 HN GLU 47 -4.399 5.920 2.950
338 HA GLU 47 HA GLU 47 -2.837 7.160 5.017
339 HB2 GLU 47 HB2 GLU 47 -5.307 6.370 5.098
340 HB3 GLU 47 HB1 GLU 47 -4.661 4.758 5.290
341 HG2 GLU 47 HG2 GLU 47 -4.093 7.027 7.162
342 HG3 GLU 47 HG1 GLU 47 -5.430 5.911 7.359
343 H THR 48 HN THR 48 -3.188 3.914 3.621
344 HA THR 48 HA THR 48 -1.269 2.389 4.842
345 HB THR 48 HB THR 48 -2.041 2.578 1.920
346 HG1 THR 48 HG1 THR 48 -3.270 1.628 4.174
347 HG21 THR 48 HG21 THR 48 -0.019 1.185 2.239
348 HG22 THR 48 HG22 THR 48 -1.424 0.285 1.686
349 HG23 THR 48 HG23 THR 48 -0.919 0.162 3.382
350 H ALA 49 HN ALA 49 -0.907 4.397 1.997
351 HA ALA 49 HA ALA 49 1.849 4.085 1.576
352 HB1 ALA 49 HB1 ALA 49 0.142 6.447 0.782
353 HB2 ALA 49 HB2 ALA 49 0.337 4.956 -0.146
354 HB3 ALA 49 HB3 ALA 49 1.718 6.027 0.116
355 H ALA 50 HN ALA 50 0.127 6.854 3.112
356 HA ALA 50 HA ALA 50 2.395 8.286 3.876
357 HB1 ALA 50 HB1 ALA 50 -0.281 8.238 5.267
358 HB2 ALA 50 HB2 ALA 50 0.112 9.208 3.855
359 HB3 ALA 50 HB3 ALA 50 0.939 9.505 5.390
360 H ARG 51 HN ARG 51 0.803 5.634 5.423
361 HA ARG 51 HA ARG 51 2.018 5.762 7.929
362 HB2 ARG 51 HB2 ARG 51 0.083 4.306 7.476
363 HB3 ARG 51 HB1 ARG 51 1.023 3.371 6.338
364 HG2 ARG 51 HG2 ARG 51 1.045 1.965 8.116
365 HG3 ARG 51 HG1 ARG 51 2.495 2.899 8.475
366 HD2 ARG 51 HD2 ARG 51 1.011 2.466 10.364
367 HD3 ARG 51 HD1 ARG 51 1.263 4.183 10.206
368 HE ARG 51 HE ARG 51 -0.994 3.878 8.832
369 HH11 ARG 51 HH11 ARG 51 -0.074 2.503 11.974
370 HH12 ARG 51 HH12 ARG 51 -1.709 2.269 12.453
371 HH21 ARG 51 HH21 ARG 51 -3.158 3.506 9.515
372 HH22 ARG 51 HH22 ARG 51 -3.463 2.844 11.066
373 H LEU 52 HN LEU 52 2.813 3.984 4.997
374 HA LEU 52 HA LEU 52 5.227 2.842 5.923
375 HB2 LEU 52 HB2 LEU 52 4.268 3.376 3.116
376 HB3 LEU 52 HB1 LEU 52 5.665 2.389 3.513
377 HG LEU 52 HG LEU 52 2.827 1.777 4.344
378 HD11 LEU 52 HD11 LEU 52 3.125 1.529 1.951
379 HD12 LEU 52 HD12 LEU 52 2.954 -0.043 2.734
380 HD13 LEU 52 HD13 LEU 52 4.546 0.520 2.219
381 HD21 LEU 52 HD21 LEU 52 4.490 0.952 5.927
382 HD22 LEU 52 HD22 LEU 52 5.367 0.172 4.611
383 HD23 LEU 52 HD23 LEU 52 3.746 -0.379 5.037
384 H GLU 53 HN GLU 53 4.488 5.856 4.290
385 HA GLU 53 HA GLU 53 7.055 6.752 3.675
386 HB2 GLU 53 HB2 GLU 53 4.700 8.353 4.645
387 HB3 GLU 53 HB1 GLU 53 6.157 9.048 3.954
388 HG2 GLU 53 HG2 GLU 53 5.646 7.814 1.861
389 HG3 GLU 53 HG1 GLU 53 4.113 7.320 2.596
390 H SER 54 HN SER 54 5.198 7.142 6.648
391 HA SER 54 HA SER 54 7.290 8.606 7.926
392 HB2 SER 54 HB2 SER 54 4.793 7.400 9.114
393 HB3 SER 54 HB1 SER 54 5.753 8.743 9.761
394 HG SER 54 HG SER 54 3.870 8.708 7.766
395 H ARG 55 HN ARG 55 6.262 5.280 7.845
396 HA ARG 55 HA ARG 55 7.702 4.432 10.155
397 HB2 ARG 55 HB2 ARG 55 5.730 3.253 9.391
398 HB3 ARG 55 HB1 ARG 55 6.491 2.889 7.856
399 HG2 ARG 55 HG2 ARG 55 8.073 1.422 8.984
400 HG3 ARG 55 HG1 ARG 55 7.330 1.810 10.546
401 HD2 ARG 55 HD2 ARG 55 5.243 0.852 9.849
402 HD3 ARG 55 HD1 ARG 55 5.833 0.637 8.208
403 HE ARG 55 HE ARG 55 7.070 -0.797 10.460
404 HH11 ARG 55 HH11 ARG 55 5.264 -0.879 7.416
405 HH12 ARG 55 HH12 ARG 55 5.645 -2.523 7.100
406 HH21 ARG 55 HH21 ARG 55 7.433 -3.070 10.055
407 HH22 ARG 55 HH22 ARG 55 6.797 -3.784 8.619
408 H TYR 56 HN TYR 56 8.408 4.379 6.670
409 HA TYR 56 HA TYR 56 11.021 3.222 7.299
410 HB2 TYR 56 HB2 TYR 56 9.500 3.358 4.708
411 HB3 TYR 56 HB1 TYR 56 11.203 2.891 4.784
412 HD1 TYR 56 HD2 TYR 56 7.776 1.969 5.688
413 HD2 TYR 56 HD1 TYR 56 11.849 0.740 5.691
414 HE1 TYR 56 HE2 TYR 56 7.075 -0.329 6.172
415 HE2 TYR 56 HE1 TYR 56 11.160 -1.560 6.168
416 HH TYR 56 HH TYR 56 9.277 -2.821 7.074
417 H GLY 57 HN GLY 57 9.641 6.126 5.932
418 HA2 GLY 57 HA2 GLY 57 10.866 8.170 6.052
419 HA3 GLY 57 HA1 GLY 57 12.354 7.244 5.877
420 H VAL 58 HN VAL 58 9.332 7.242 4.037
421 HA VAL 58 HA VAL 58 10.888 7.898 1.645
422 HB VAL 58 HB VAL 58 9.430 6.423 0.284
423 HG11 VAL 58 HG11 VAL 58 10.705 5.013 2.603
424 HG12 VAL 58 HG12 VAL 58 11.526 5.521 1.120
425 HG13 VAL 58 HG13 VAL 58 10.282 4.262 1.066
426 HG21 VAL 58 HG21 VAL 58 7.433 6.436 1.668
427 HG22 VAL 58 HG22 VAL 58 8.281 5.533 2.929
428 HG23 VAL 58 HG23 VAL 58 7.970 4.787 1.357
429 H SER 59 HN SER 59 9.065 8.403 -0.239
430 HA SER 59 HA SER 59 6.944 10.032 0.895
431 HB2 SER 59 HB2 SER 59 9.056 11.189 -0.956
432 HB3 SER 59 HB1 SER 59 7.628 12.034 -0.367
433 HG SER 59 HG SER 59 9.880 11.132 1.122
434 H ILE 60 HN ILE 60 5.216 9.338 -0.144
435 HA ILE 60 HA ILE 60 5.274 8.999 -3.063
436 HB ILE 60 HB ILE 60 3.774 7.238 -1.069
437 HG12 ILE 60 HG12 ILE 60 4.860 5.350 -2.318
438 HG13 ILE 60 HG11 ILE 60 5.902 6.517 -3.120
439 HG21 ILE 60 HG21 ILE 60 2.800 6.056 -2.994
440 HG22 ILE 60 HG22 ILE 60 3.479 7.286 -4.057
441 HG23 ILE 60 HG23 ILE 60 2.270 7.733 -2.847
442 HD11 ILE 60 HD11 ILE 60 7.032 5.408 -1.303
443 HD12 ILE 60 HD12 ILE 60 5.767 5.889 -0.181
444 HD13 ILE 60 HD13 ILE 60 6.809 7.111 -0.907
445 HA PRO 61 HA PRO 61 2.199 12.253 -2.425
446 HB2 PRO 61 HB2 PRO 61 1.935 11.941 -5.368
447 HB3 PRO 61 HB1 PRO 61 2.259 13.396 -4.418
448 HG2 PRO 61 HG2 PRO 61 4.191 12.252 -5.837
449 HG3 PRO 61 HG1 PRO 61 4.530 12.918 -4.225
450 HD2 PRO 61 HD2 PRO 61 4.116 10.064 -5.042
451 HD3 PRO 61 HD1 PRO 61 5.322 10.752 -3.939
452 H ASP 62 HN ASP 62 -0.062 12.477 -2.665
453 HA ASP 62 HA ASP 62 -1.540 10.147 -2.267
454 HB2 ASP 62 HB2 ASP 62 -3.526 11.612 -2.264
455 HB3 ASP 62 HB1 ASP 62 -2.215 12.286 -1.297
456 H ASP 63 HN ASP 63 -1.135 12.079 -5.183
457 HA ASP 63 HA ASP 63 -3.214 10.730 -6.592
458 HB2 ASP 63 HB2 ASP 63 -2.591 11.965 -8.521
459 HB3 ASP 63 HB1 ASP 63 -2.353 13.044 -7.156
460 H VAL 64 HN VAL 64 0.031 10.051 -5.928
461 HA VAL 64 HA VAL 64 0.339 8.124 -8.060
462 HB VAL 64 HB VAL 64 2.103 8.654 -5.639
463 HG11 VAL 64 HG11 VAL 64 2.729 7.146 -8.178
464 HG12 VAL 64 HG12 VAL 64 2.469 6.430 -6.592
465 HG13 VAL 64 HG13 VAL 64 3.858 7.479 -6.862
466 HG21 VAL 64 HG21 VAL 64 3.537 9.883 -7.203
467 HG22 VAL 64 HG22 VAL 64 1.939 10.611 -7.034
468 HG23 VAL 64 HG23 VAL 64 2.326 9.659 -8.469
469 H ALA 65 HN ALA 65 -0.570 8.236 -4.708
470 HA ALA 65 HA ALA 65 -0.443 5.514 -4.085
471 HB1 ALA 65 HB1 ALA 65 -0.584 7.245 -2.395
472 HB2 ALA 65 HB2 ALA 65 -1.944 6.113 -2.239
473 HB3 ALA 65 HB3 ALA 65 -2.197 7.692 -2.956
474 H GLY 66 HN GLY 66 -3.142 7.588 -5.186
475 HA2 GLY 66 HA2 GLY 66 -4.943 5.339 -5.347
476 HA3 GLY 66 HA1 GLY 66 -5.287 6.989 -5.845
477 H ARG 67 HN ARG 67 -2.460 6.276 -7.234
478 HA ARG 67 HA ARG 67 -3.595 5.953 -9.847
479 HB2 ARG 67 HB2 ARG 67 -1.692 7.430 -9.386
480 HB3 ARG 67 HB1 ARG 67 -0.741 6.042 -8.887
481 HG2 ARG 67 HG2 ARG 67 -0.089 6.680 -11.068
482 HG3 ARG 67 HG1 ARG 67 -0.954 5.142 -11.148
483 HD2 ARG 67 HD2 ARG 67 -2.986 6.354 -11.848
484 HD3 ARG 67 HD1 ARG 67 -2.070 7.865 -11.805
485 HE ARG 67 HE ARG 67 -0.822 5.877 -13.395
486 HH11 ARG 67 HH11 ARG 67 -3.263 8.470 -13.511
487 HH12 ARG 67 HH12 ARG 67 -3.152 8.676 -15.194
488 HH21 ARG 67 HH21 ARG 67 -0.731 6.105 -15.706
489 HH22 ARG 67 HH22 ARG 67 -1.703 7.256 -16.506
490 H VAL 68 HN VAL 68 -2.313 3.892 -7.395
491 HA VAL 68 HA VAL 68 -1.762 1.811 -9.317
492 HB VAL 68 HB VAL 68 -0.982 0.405 -7.459
493 HG11 VAL 68 HG11 VAL 68 0.890 1.761 -6.701
494 HG12 VAL 68 HG12 VAL 68 0.081 3.200 -7.325
495 HG13 VAL 68 HG13 VAL 68 0.587 1.925 -8.429
496 HG21 VAL 68 HG21 VAL 68 -1.805 2.682 -5.652
497 HG22 VAL 68 HG22 VAL 68 -0.928 1.230 -5.168
498 HG23 VAL 68 HG23 VAL 68 -2.588 1.102 -5.758
499 H ASP 69 HN ASP 69 -2.736 -0.371 -8.939
500 HA ASP 69 HA ASP 69 -5.594 -0.014 -8.221
501 HB2 ASP 69 HB2 ASP 69 -5.062 -0.186 -10.692
502 HB3 ASP 69 HB1 ASP 69 -4.417 -1.768 -10.359
503 H THR 70 HN THR 70 -2.771 -2.022 -8.306
504 HA THR 70 HA THR 70 -4.066 -3.924 -6.514
505 HB THR 70 HB THR 70 -2.721 -5.706 -7.638
506 HG1 THR 70 HG1 THR 70 -1.904 -3.467 -9.221
507 HG21 THR 70 HG21 THR 70 -4.428 -4.035 -9.490
508 HG22 THR 70 HG22 THR 70 -5.017 -5.286 -8.393
509 HG23 THR 70 HG23 THR 70 -3.995 -5.723 -9.767
510 HA PRO 71 HA PRO 71 -1.082 -3.133 -3.376
511 HB2 PRO 71 HB2 PRO 71 -0.640 -6.088 -3.387
512 HB3 PRO 71 HB1 PRO 71 -0.938 -4.996 -2.025
513 HG2 PRO 71 HG2 PRO 71 -2.908 -6.481 -2.928
514 HG3 PRO 71 HG1 PRO 71 -3.211 -4.772 -2.539
515 HD2 PRO 71 HD2 PRO 71 -2.875 -6.081 -5.211
516 HD3 PRO 71 HD1 PRO 71 -3.981 -4.782 -4.726
517 H ARG 72 HN ARG 72 0.017 -5.445 -5.781
518 HA ARG 72 HA ARG 72 2.736 -5.365 -5.132
519 HB2 ARG 72 HB2 ARG 72 3.103 -6.256 -7.464
520 HB3 ARG 72 HB1 ARG 72 2.012 -7.186 -6.447
521 HG2 ARG 72 HG2 ARG 72 0.101 -6.142 -7.583
522 HG3 ARG 72 HG1 ARG 72 1.223 -5.260 -8.623
523 HD2 ARG 72 HD2 ARG 72 1.082 -8.264 -8.390
524 HD3 ARG 72 HD1 ARG 72 0.289 -7.325 -9.650
525 HE ARG 72 HE ARG 72 2.663 -6.476 -10.034
526 HH11 ARG 72 HH11 ARG 72 1.956 -9.858 -9.019
527 HH12 ARG 72 HH12 ARG 72 3.136 -10.512 -10.002
528 HH21 ARG 72 HH21 ARG 72 4.363 -7.479 -11.347
529 HH22 ARG 72 HH22 ARG 72 4.581 -9.165 -11.315
530 H GLU 73 HN GLU 73 0.878 -3.170 -7.111
531 HA GLU 73 HA GLU 73 3.104 -1.888 -8.366
532 HB2 GLU 73 HB2 GLU 73 0.338 -0.866 -7.792
533 HB3 GLU 73 HB1 GLU 73 1.488 -0.149 -8.911
534 HG2 GLU 73 HG2 GLU 73 1.320 -2.009 -10.371
535 HG3 GLU 73 HG1 GLU 73 0.370 -2.917 -9.191
536 H LEU 74 HN LEU 74 1.099 -1.261 -5.564
537 HA LEU 74 HA LEU 74 2.104 1.235 -4.732
538 HB2 LEU 74 HB2 LEU 74 0.026 -0.142 -3.950
539 HB3 LEU 74 HB1 LEU 74 1.233 -0.951 -2.946
540 HG LEU 74 HG LEU 74 -0.219 0.896 -1.836
541 HD11 LEU 74 HD11 LEU 74 1.595 1.649 -0.423
542 HD12 LEU 74 HD12 LEU 74 2.762 1.043 -1.604
543 HD13 LEU 74 HD13 LEU 74 1.709 -0.087 -0.753
544 HD21 LEU 74 HD21 LEU 74 0.657 3.169 -2.074
545 HD22 LEU 74 HD22 LEU 74 -0.005 2.553 -3.590
546 HD23 LEU 74 HD23 LEU 74 1.739 2.607 -3.351
547 H LEU 75 HN LEU 75 2.923 -2.076 -3.878
548 HA LEU 75 HA LEU 75 4.825 -1.614 -1.930
549 HB2 LEU 75 HB2 LEU 75 3.692 -3.691 -2.331
550 HB3 LEU 75 HB1 LEU 75 4.465 -3.840 -3.899
551 HG LEU 75 HG LEU 75 6.605 -3.872 -2.727
552 HD11 LEU 75 HD11 LEU 75 6.600 -4.573 -0.337
553 HD12 LEU 75 HD12 LEU 75 4.857 -4.305 -0.301
554 HD13 LEU 75 HD13 LEU 75 5.943 -2.951 -0.581
555 HD21 LEU 75 HD21 LEU 75 6.392 -6.267 -2.140
556 HD22 LEU 75 HD22 LEU 75 5.636 -5.792 -3.671
557 HD23 LEU 75 HD23 LEU 75 4.629 -6.065 -2.247
558 H ASP 76 HN ASP 76 5.109 -1.882 -5.440
559 HA ASP 76 HA ASP 76 7.940 -1.901 -5.562
560 HB2 ASP 76 HB2 ASP 76 6.570 -2.691 -7.449
561 HB3 ASP 76 HB1 ASP 76 5.927 -1.069 -7.672
562 H LEU 77 HN LEU 77 5.522 0.613 -5.701
563 HA LEU 77 HA LEU 77 7.156 2.832 -6.237
564 HB2 LEU 77 HB2 LEU 77 4.685 2.700 -4.524
565 HB3 LEU 77 HB1 LEU 77 5.420 4.166 -5.125
566 HG LEU 77 HG LEU 77 4.159 2.005 -6.780
567 HD11 LEU 77 HD11 LEU 77 2.535 3.285 -5.490
568 HD12 LEU 77 HD12 LEU 77 2.415 3.676 -7.200
569 HD13 LEU 77 HD13 LEU 77 3.221 4.793 -6.096
570 HD21 LEU 77 HD21 LEU 77 4.410 3.565 -8.648
571 HD22 LEU 77 HD22 LEU 77 5.978 3.112 -7.978
572 HD23 LEU 77 HD23 LEU 77 5.277 4.685 -7.595
573 H ILE 78 HN ILE 78 6.204 1.336 -3.214
574 HA ILE 78 HA ILE 78 7.404 3.112 -1.416
575 HB ILE 78 HB ILE 78 6.991 0.119 -1.100
576 HG12 ILE 78 HG12 ILE 78 4.907 1.277 -1.565
577 HG13 ILE 78 HG11 ILE 78 4.927 0.750 0.113
578 HG21 ILE 78 HG21 ILE 78 7.071 0.529 1.331
579 HG22 ILE 78 HG22 ILE 78 7.503 2.214 1.021
580 HG23 ILE 78 HG23 ILE 78 8.593 0.922 0.535
581 HD11 ILE 78 HD11 ILE 78 5.478 3.041 0.808
582 HD12 ILE 78 HD12 ILE 78 3.967 2.968 -0.103
583 HD13 ILE 78 HD13 ILE 78 5.439 3.548 -0.882
584 H ASN 79 HN ASN 79 8.614 -0.040 -2.518
585 HA ASN 79 HA ASN 79 11.184 0.191 -1.452
586 HB2 ASN 79 HB2 ASN 79 10.223 -1.415 -3.818
587 HB3 ASN 79 HB1 ASN 79 11.861 -1.523 -3.192
588 HD21 ASN 79 HD21 ASN 79 9.916 -3.651 -3.312
589 HD22 ASN 79 HD22 ASN 79 9.618 -4.124 -1.683
590 H GLY 80 HN GLY 80 9.945 1.296 -4.546
591 HA2 GLY 80 HA2 GLY 80 12.353 2.032 -5.732
592 HA3 GLY 80 HA1 GLY 80 10.784 2.731 -6.074
593 H ALA 81 HN ALA 81 10.061 3.937 -3.806
594 HA ALA 81 HA ALA 81 11.632 6.306 -3.794
595 HB1 ALA 81 HB1 ALA 81 10.032 7.150 -2.161
596 HB2 ALA 81 HB2 ALA 81 9.390 5.522 -1.930
597 HB3 ALA 81 HB3 ALA 81 9.198 6.338 -3.488
598 H LEU 82 HN LEU 82 11.708 3.440 -1.924
599 HA LEU 82 HA LEU 82 13.108 4.520 0.329
600 HB2 LEU 82 HB2 LEU 82 11.644 2.607 0.538
601 HB3 LEU 82 HB1 LEU 82 12.576 1.722 -0.657
602 HG LEU 82 HG LEU 82 14.469 1.745 0.863
603 HD11 LEU 82 HD11 LEU 82 13.926 3.711 2.200
604 HD12 LEU 82 HD12 LEU 82 14.104 2.310 3.258
605 HD13 LEU 82 HD13 LEU 82 12.496 2.903 2.846
606 HD21 LEU 82 HD21 LEU 82 13.585 0.042 2.395
607 HD22 LEU 82 HD22 LEU 82 12.999 -0.172 0.748
608 HD23 LEU 82 HD23 LEU 82 11.947 0.540 1.978
609 H ALA 83 HN ALA 83 13.918 3.018 -2.741
610 HA ALA 83 HA ALA 83 16.626 2.554 -2.174
611 HB1 ALA 83 HB1 ALA 83 16.908 2.376 -4.599
612 HB2 ALA 83 HB2 ALA 83 15.317 3.095 -4.841
613 HB3 ALA 83 HB3 ALA 83 15.462 1.516 -4.071
614 H GLU 84 HN GLU 84 14.873 5.328 -3.520
615 HA GLU 84 HA GLU 84 17.171 6.970 -3.859
616 HB2 GLU 84 HB2 GLU 84 14.208 7.518 -3.819
617 HB3 GLU 84 HB1 GLU 84 15.435 8.710 -4.205
618 HG2 GLU 84 HG2 GLU 84 14.852 6.189 -5.741
619 HG3 GLU 84 HG1 GLU 84 14.383 7.825 -6.206
620 H ALA 85 HN ALA 85 14.852 6.248 -1.412
621 HA ALA 85 HA ALA 85 14.369 6.904 0.639
622 HB1 ALA 85 HB1 ALA 85 16.188 7.606 2.141
623 HB2 ALA 85 HB2 ALA 85 17.256 7.831 0.746
624 HB3 ALA 85 HB3 ALA 85 16.648 6.223 1.153
625 H ALA 86 HN ALA 86 13.006 8.306 -0.506
626 HA ALA 86 HA ALA 86 13.679 11.065 -0.821
627 HB1 ALA 86 HB1 ALA 86 12.095 9.961 -2.318
628 HB2 ALA 86 HB2 ALA 86 11.368 11.356 -1.516
629 HB3 ALA 86 HB3 ALA 86 10.979 9.724 -0.966
630 H28A SDO 101 H28A SDO 42 -9.710 11.741 -4.150
631 H28B SDO 101 H28B SDO 42 -10.221 12.211 -2.530
632 H30A SDO 101 H30A SDO 42 -6.842 12.970 -1.245
633 H30B SDO 101 H30B SDO 42 -7.722 11.447 -1.160
634 H30C SDO 101 H30C SDO 42 -8.571 12.948 -0.841
635 H31A SDO 101 H31A SDO 42 -6.155 12.570 -3.572
636 H31B SDO 101 H31B SDO 42 -7.364 12.141 -4.776
637 H31C SDO 101 H31C SDO 42 -6.899 10.945 -3.534
638 H32A SDO 101 H32A SDO 42 -9.301 14.443 -2.998
639 H33A SDO 101 H33A SDO 42 -7.819 14.625 -5.119
640 H36A SDO 101 H36A SDO 42 -7.563 14.933 -1.264
641 H37A SDO 101 H37A SDO 42 -5.144 16.331 -2.188
642 H37B SDO 101 H37B SDO 42 -6.368 17.185 -1.265
643 H38A SDO 101 H38A SDO 42 -4.764 14.841 -0.305
644 H38B SDO 101 H38B SDO 42 -4.706 16.508 0.308
645 H41A SDO 101 H41A SDO 42 -7.734 16.537 0.062
646 H42A SDO 101 H42A SDO 42 -9.112 14.642 1.387
647 H42B SDO 101 H42B SDO 42 -8.482 15.692 2.676
648 H43A SDO 101 H43A SDO 42 -10.047 16.524 0.249
649 H43B SDO 101 H43B SDO 42 -9.475 17.606 1.491
650 H1A SDO 101 H1A SDO 42 -11.867 15.694 4.358
651 H1B SDO 101 H1B SDO 42 -12.451 14.629 3.105
652 H2A SDO 101 H2A SDO 42 -9.604 14.876 3.984
653 H2B SDO 101 H2B SDO 42 -10.209 13.774 2.770
654 H4A SDO 101 H4A SDO 42 -11.620 12.916 6.724
655 H4B SDO 101 H4B SDO 42 -12.257 11.847 5.502
656 H5A SDO 101 H5A SDO 42 -13.506 13.682 4.484
657 H5B SDO 101 H5B SDO 42 -12.908 14.768 5.735
658 H6A SDO 101 H6A SDO 42 -13.997 13.433 7.456
659 H6B SDO 101 H6B SDO 42 -14.555 12.293 6.235
660 H8A SDO 101 H8A SDO 42 -14.751 15.892 5.352
661 H8B SDO 101 H8B SDO 42 -16.517 15.864 5.337
662 H8C SDO 101 H8C SDO 42 -15.603 14.832 4.224
Start of MODEL 18
1 H1 MET 1 HT1 MET 1 22.131 -5.929 5.101
2 H2 MET 1 HT2 MET 1 22.374 -5.567 6.732
3 H3 MET 1 HT3 MET 1 21.963 -4.346 5.625
4 HA MET 1 HA MET 1 20.252 -6.677 6.170
5 HB2 MET 1 HB2 MET 1 20.426 -5.395 8.237
6 HB3 MET 1 HB1 MET 1 20.079 -3.899 7.377
7 HG2 MET 1 HG2 MET 1 17.827 -4.748 6.860
8 HG3 MET 1 HG1 MET 1 18.196 -6.223 7.746
9 HE1 MET 1 HE1 MET 1 18.579 -4.915 11.417
10 HE2 MET 1 HE2 MET 1 19.863 -5.146 10.222
11 HE3 MET 1 HE3 MET 1 18.565 -6.334 10.369
12 H ALA 2 HN ALA 2 19.016 -6.961 4.466
13 HA ALA 2 HA ALA 2 18.549 -4.759 2.656
14 HB1 ALA 2 HB1 ALA 2 17.397 -6.390 1.249
15 HB2 ALA 2 HB2 ALA 2 17.543 -7.604 2.516
16 HB3 ALA 2 HB3 ALA 2 18.988 -6.992 1.716
17 H THR 3 HN THR 3 17.338 -3.387 3.718
18 HA THR 3 HA THR 3 14.889 -4.251 4.988
19 HB THR 3 HB THR 3 16.184 -2.643 6.250
20 HG1 THR 3 HG1 THR 3 13.876 -1.501 5.113
21 HG21 THR 3 HG21 THR 3 15.936 -0.781 3.870
22 HG22 THR 3 HG22 THR 3 17.422 -1.550 4.438
23 HG23 THR 3 HG23 THR 3 16.616 -0.345 5.437
24 H LEU 4 HN LEU 4 14.566 -4.877 2.554
25 HA LEU 4 HA LEU 4 13.251 -2.741 1.064
26 HB2 LEU 4 HB2 LEU 4 14.764 -4.533 0.007
27 HB3 LEU 4 HB1 LEU 4 13.462 -5.670 0.318
28 HG LEU 4 HG LEU 4 12.024 -4.179 -1.115
29 HD11 LEU 4 HD11 LEU 4 14.697 -2.942 -1.772
30 HD12 LEU 4 HD12 LEU 4 13.365 -2.155 -0.929
31 HD13 LEU 4 HD13 LEU 4 13.181 -2.633 -2.614
32 HD21 LEU 4 HD21 LEU 4 12.976 -5.018 -3.215
33 HD22 LEU 4 HD22 LEU 4 12.979 -6.261 -1.962
34 HD23 LEU 4 HD23 LEU 4 14.473 -5.426 -2.372
35 H LEU 5 HN LEU 5 10.960 -2.763 0.808
36 HA LEU 5 HA LEU 5 9.607 -4.090 2.954
37 HB2 LEU 5 HB2 LEU 5 9.202 -1.730 1.821
38 HB3 LEU 5 HB1 LEU 5 8.230 -2.653 0.706
39 HG LEU 5 HG LEU 5 7.772 -2.400 3.682
40 HD11 LEU 5 HD11 LEU 5 7.256 -0.369 2.586
41 HD12 LEU 5 HD12 LEU 5 5.751 -1.189 3.007
42 HD13 LEU 5 HD13 LEU 5 6.336 -1.221 1.343
43 HD21 LEU 5 HD21 LEU 5 6.081 -3.738 1.601
44 HD22 LEU 5 HD22 LEU 5 5.667 -3.530 3.302
45 HD23 LEU 5 HD23 LEU 5 7.022 -4.556 2.843
46 H THR 6 HN THR 6 8.835 -6.119 2.816
47 HA THR 6 HA THR 6 8.751 -7.413 0.227
48 HB THR 6 HB THR 6 8.541 -9.498 1.563
49 HG1 THR 6 HG1 THR 6 8.812 -9.326 3.842
50 HG21 THR 6 HG21 THR 6 10.774 -8.669 0.932
51 HG22 THR 6 HG22 THR 6 10.818 -9.441 2.522
52 HG23 THR 6 HG23 THR 6 10.827 -7.687 2.396
53 H THR 7 HN THR 7 6.975 -9.129 0.003
54 HA THR 7 HA THR 7 4.451 -7.957 -0.046
55 HB THR 7 HB THR 7 5.139 -10.921 -0.061
56 HG1 THR 7 HG1 THR 7 5.322 -10.606 -2.327
57 HG21 THR 7 HG21 THR 7 2.713 -10.438 0.101
58 HG22 THR 7 HG22 THR 7 3.140 -11.140 -1.463
59 HG23 THR 7 HG23 THR 7 2.843 -9.409 -1.330
60 H ASP 8 HN ASP 8 6.017 -10.077 2.291
61 HA ASP 8 HA ASP 8 3.810 -10.653 3.979
62 HB2 ASP 8 HB2 ASP 8 6.743 -10.468 4.684
63 HB3 ASP 8 HB1 ASP 8 5.502 -10.972 5.809
64 H ASP 9 HN ASP 9 6.179 -8.063 4.014
65 HA ASP 9 HA ASP 9 5.236 -7.029 6.493
66 HB2 ASP 9 HB2 ASP 9 7.570 -6.760 5.672
67 HB3 ASP 9 HB1 ASP 9 6.961 -5.635 4.460
68 H LEU 10 HN LEU 10 4.794 -6.172 3.122
69 HA LEU 10 HA LEU 10 3.296 -3.826 3.413
70 HB2 LEU 10 HB2 LEU 10 4.124 -4.649 1.255
71 HB3 LEU 10 HB1 LEU 10 3.000 -5.988 1.329
72 HG LEU 10 HG LEU 10 1.144 -4.259 1.379
73 HD11 LEU 10 HD11 LEU 10 3.376 -2.443 0.504
74 HD12 LEU 10 HD12 LEU 10 2.428 -2.318 1.986
75 HD13 LEU 10 HD13 LEU 10 1.657 -2.071 0.419
76 HD21 LEU 10 HD21 LEU 10 1.177 -3.971 -1.056
77 HD22 LEU 10 HD22 LEU 10 1.636 -5.608 -0.585
78 HD23 LEU 10 HD23 LEU 10 2.874 -4.458 -1.087
79 H ARG 11 HN ARG 11 2.368 -7.191 3.305
80 HA ARG 11 HA ARG 11 -0.368 -7.129 3.286
81 HB2 ARG 11 HB2 ARG 11 1.012 -9.140 3.132
82 HB3 ARG 11 HB1 ARG 11 1.445 -8.988 4.823
83 HG2 ARG 11 HG2 ARG 11 -0.878 -9.416 5.452
84 HG3 ARG 11 HG1 ARG 11 -1.311 -9.546 3.741
85 HD2 ARG 11 HD2 ARG 11 -0.978 -11.763 4.704
86 HD3 ARG 11 HD1 ARG 11 0.248 -11.421 3.484
87 HE ARG 11 HE ARG 11 0.789 -11.023 6.344
88 HH11 ARG 11 HH11 ARG 11 1.705 -12.587 3.277
89 HH12 ARG 11 HH12 ARG 11 3.183 -13.191 3.927
90 HH21 ARG 11 HH21 ARG 11 2.766 -11.866 7.136
91 HH22 ARG 11 HH22 ARG 11 3.780 -12.791 6.086
92 H ARG 12 HN ARG 12 1.775 -6.824 6.044
93 HA ARG 12 HA ARG 12 -0.131 -6.885 8.142
94 HB2 ARG 12 HB2 ARG 12 2.440 -5.284 8.067
95 HB3 ARG 12 HB1 ARG 12 1.601 -5.859 9.490
96 HG2 ARG 12 HG2 ARG 12 2.284 -8.054 9.150
97 HG3 ARG 12 HG1 ARG 12 2.726 -7.753 7.463
98 HD2 ARG 12 HD2 ARG 12 4.730 -7.922 8.805
99 HD3 ARG 12 HD1 ARG 12 4.527 -6.267 8.246
100 HE ARG 12 HE ARG 12 3.410 -6.647 10.832
101 HH11 ARG 12 HH11 ARG 12 6.472 -5.863 9.106
102 HH12 ARG 12 HH12 ARG 12 7.295 -5.572 10.558
103 HH21 ARG 12 HH21 ARG 12 4.646 -6.046 12.781
104 HH22 ARG 12 HH22 ARG 12 6.271 -5.579 12.613
105 H ALA 13 HN ALA 13 1.523 -4.113 6.703
106 HA ALA 13 HA ALA 13 -0.017 -2.245 8.139
107 HB1 ALA 13 HB1 ALA 13 1.692 -1.770 5.712
108 HB2 ALA 13 HB2 ALA 13 2.257 -1.777 7.382
109 HB3 ALA 13 HB3 ALA 13 1.117 -0.546 6.846
110 H LEU 14 HN LEU 14 -0.335 -3.575 4.896
111 HA LEU 14 HA LEU 14 -2.211 -1.785 3.881
112 HB2 LEU 14 HB2 LEU 14 -0.980 -3.616 2.659
113 HB3 LEU 14 HB1 LEU 14 -2.065 -4.767 3.393
114 HG LEU 14 HG LEU 14 -3.965 -3.687 2.239
115 HD11 LEU 14 HD11 LEU 14 -3.537 -2.076 0.473
116 HD12 LEU 14 HD12 LEU 14 -1.818 -2.095 0.852
117 HD13 LEU 14 HD13 LEU 14 -2.973 -1.456 2.025
118 HD21 LEU 14 HD21 LEU 14 -3.418 -4.509 0.010
119 HD22 LEU 14 HD22 LEU 14 -2.840 -5.626 1.250
120 HD23 LEU 14 HD23 LEU 14 -1.710 -4.549 0.434
121 H VAL 15 HN VAL 15 -2.660 -4.827 5.641
122 HA VAL 15 HA VAL 15 -5.457 -4.877 5.834
123 HB VAL 15 HB VAL 15 -3.349 -5.969 7.752
124 HG11 VAL 15 HG11 VAL 15 -6.303 -6.612 7.591
125 HG12 VAL 15 HG12 VAL 15 -5.506 -5.742 8.900
126 HG13 VAL 15 HG13 VAL 15 -5.131 -7.444 8.613
127 HG21 VAL 15 HG21 VAL 15 -3.883 -8.121 6.684
128 HG22 VAL 15 HG22 VAL 15 -3.179 -6.954 5.588
129 HG23 VAL 15 HG23 VAL 15 -4.919 -7.279 5.521
130 H GLU 16 HN GLU 16 -3.074 -3.717 8.196
131 HA GLU 16 HA GLU 16 -4.967 -2.916 10.111
132 HB2 GLU 16 HB2 GLU 16 -2.100 -2.027 9.858
133 HB3 GLU 16 HB1 GLU 16 -3.093 -1.979 11.315
134 HG2 GLU 16 HG2 GLU 16 -3.299 -4.428 11.233
135 HG3 GLU 16 HG1 GLU 16 -2.243 -4.461 9.837
136 H SER 17 HN SER 17 -3.769 -1.238 7.339
137 HA SER 17 HA SER 17 -4.583 1.357 8.342
138 HB2 SER 17 HB2 SER 17 -3.655 0.537 5.587
139 HB3 SER 17 HB1 SER 17 -3.880 2.195 6.150
140 HG SER 17 HG SER 17 -1.996 0.268 6.911
141 H ALA 18 HN ALA 18 -6.083 -1.264 6.779
142 HA ALA 18 HA ALA 18 -8.164 0.302 5.549
143 HB1 ALA 18 HB1 ALA 18 -9.242 -1.871 5.137
144 HB2 ALA 18 HB2 ALA 18 -8.023 -2.668 6.131
145 HB3 ALA 18 HB3 ALA 18 -7.557 -1.902 4.610
146 H GLY 19 HN GLY 19 -7.823 -1.846 8.322
147 HA2 GLY 19 HA2 GLY 19 -8.584 -1.228 10.480
148 HA3 GLY 19 HA1 GLY 19 -9.789 -0.198 9.717
149 H GLU 20 HN GLU 20 -11.658 -0.963 10.440
150 HA GLU 20 HA GLU 20 -12.072 -3.868 10.541
151 HB2 GLU 20 HB2 GLU 20 -13.692 -1.622 11.740
152 HB3 GLU 20 HB1 GLU 20 -13.914 -3.336 12.035
153 HG2 GLU 20 HG2 GLU 20 -11.492 -1.727 12.825
154 HG3 GLU 20 HG1 GLU 20 -12.814 -2.191 13.890
155 H THR 21 HN THR 21 -12.199 -2.075 8.153
156 HA THR 21 HA THR 21 -14.956 -1.739 7.466
157 HB THR 21 HB THR 21 -13.245 -0.129 6.752
158 HG1 THR 21 HG1 THR 21 -14.805 0.097 5.367
159 HG21 THR 21 HG21 THR 21 -11.643 -0.693 4.919
160 HG22 THR 21 HG22 THR 21 -12.158 -2.387 5.067
161 HG23 THR 21 HG23 THR 21 -11.355 -1.595 6.409
162 H ASP 22 HN ASP 22 -15.058 -4.172 8.005
163 HA ASP 22 HA ASP 22 -15.791 -6.205 7.382
164 HB2 ASP 22 HB2 ASP 22 -16.907 -5.386 5.464
165 HB3 ASP 22 HB1 ASP 22 -15.421 -5.229 4.539
166 H GLY 23 HN GLY 23 -14.779 -7.911 7.780
167 HA2 GLY 23 HA2 GLY 23 -12.019 -7.980 7.441
168 HA3 GLY 23 HA1 GLY 23 -12.981 -9.327 8.075
169 H THR 24 HN THR 24 -11.413 -7.934 5.452
170 HA THR 24 HA THR 24 -12.200 -10.054 3.623
171 HB THR 24 HB THR 24 -12.530 -7.804 2.773
172 HG1 THR 24 HG1 THR 24 -11.689 -8.048 0.924
173 HG21 THR 24 HG21 THR 24 -10.978 -6.546 4.173
174 HG22 THR 24 HG22 THR 24 -10.698 -6.179 2.473
175 HG23 THR 24 HG23 THR 24 -9.604 -7.269 3.331
176 H ASP 25 HN ASP 25 -10.771 -11.670 3.317
177 HA ASP 25 HA ASP 25 -8.370 -11.749 4.863
178 HB2 ASP 25 HB2 ASP 25 -9.719 -13.790 4.357
179 HB3 ASP 25 HB1 ASP 25 -9.156 -13.699 2.687
180 H LEU 26 HN LEU 26 -6.650 -10.704 4.396
181 HA LEU 26 HA LEU 26 -5.678 -10.597 1.613
182 HB2 LEU 26 HB2 LEU 26 -5.529 -8.650 3.877
183 HB3 LEU 26 HB1 LEU 26 -4.181 -8.716 2.766
184 HG LEU 26 HG LEU 26 -5.667 -8.107 0.914
185 HD11 LEU 26 HD11 LEU 26 -7.743 -9.064 1.728
186 HD12 LEU 26 HD12 LEU 26 -7.926 -7.353 1.323
187 HD13 LEU 26 HD13 LEU 26 -7.802 -7.857 3.012
188 HD21 LEU 26 HD21 LEU 26 -5.831 -6.269 3.280
189 HD22 LEU 26 HD22 LEU 26 -6.081 -5.808 1.591
190 HD23 LEU 26 HD23 LEU 26 -4.504 -6.375 2.125
191 H SER 27 HN SER 27 -5.426 -12.692 3.697
192 HA SER 27 HA SER 27 -2.598 -12.468 4.328
193 HB2 SER 27 HB2 SER 27 -4.266 -12.910 6.163
194 HB3 SER 27 HB1 SER 27 -4.629 -14.449 5.388
195 HG SER 27 HG SER 27 -3.152 -14.759 7.010
196 H GLY 28 HN GLY 28 -4.333 -13.463 1.895
197 HA2 GLY 28 HA2 GLY 28 -2.319 -15.392 1.069
198 HA3 GLY 28 HA1 GLY 28 -3.971 -15.978 1.144
199 H ASP 29 HN ASP 29 -1.713 -14.841 -0.844
200 HA ASP 29 HA ASP 29 -1.588 -14.021 -2.921
201 HB2 ASP 29 HB2 ASP 29 -4.135 -15.624 -3.090
202 HB3 ASP 29 HB1 ASP 29 -3.280 -15.004 -4.506
203 H PHE 30 HN PHE 30 -2.561 -12.122 -1.270
204 HA PHE 30 HA PHE 30 -4.774 -10.693 -2.474
205 HB2 PHE 30 HB2 PHE 30 -4.424 -9.068 -0.743
206 HB3 PHE 30 HB1 PHE 30 -4.215 -10.654 -0.003
207 HD1 PHE 30 HD2 PHE 30 -1.756 -11.509 0.214
208 HD2 PHE 30 HD1 PHE 30 -2.804 -7.443 -0.482
209 HE1 PHE 30 HE2 PHE 30 0.471 -10.807 0.986
210 HE2 PHE 30 HE1 PHE 30 -0.565 -6.737 0.288
211 HZ PHE 30 HZ PHE 30 1.062 -8.424 1.016
212 H LEU 31 HN LEU 31 -1.617 -11.086 -3.325
213 HA LEU 31 HA LEU 31 -0.559 -8.516 -3.607
214 HB2 LEU 31 HB2 LEU 31 0.702 -10.661 -3.648
215 HB3 LEU 31 HB1 LEU 31 0.125 -10.914 -5.285
216 HG LEU 31 HG LEU 31 1.302 -8.874 -6.008
217 HD11 LEU 31 HD11 LEU 31 2.335 -8.840 -3.169
218 HD12 LEU 31 HD12 LEU 31 1.262 -7.650 -3.901
219 HD13 LEU 31 HD13 LEU 31 2.919 -7.826 -4.487
220 HD21 LEU 31 HD21 LEU 31 3.566 -9.771 -5.819
221 HD22 LEU 31 HD22 LEU 31 2.393 -11.027 -6.199
222 HD23 LEU 31 HD23 LEU 31 3.018 -10.878 -4.553
223 H ASP 32 HN ASP 32 -2.487 -10.416 -5.854
224 HA ASP 32 HA ASP 32 -2.547 -8.074 -7.635
225 HB2 ASP 32 HB2 ASP 32 -2.824 -10.998 -8.335
226 HB3 ASP 32 HB1 ASP 32 -3.248 -9.703 -9.451
227 H LEU 33 HN LEU 33 -4.151 -8.801 -5.279
228 HA LEU 33 HA LEU 33 -6.803 -9.048 -6.436
229 HB2 LEU 33 HB2 LEU 33 -6.107 -10.261 -4.324
230 HB3 LEU 33 HB1 LEU 33 -5.938 -8.707 -3.548
231 HG LEU 33 HG LEU 33 -8.348 -8.320 -3.750
232 HD11 LEU 33 HD11 LEU 33 -8.726 -9.549 -5.846
233 HD12 LEU 33 HD12 LEU 33 -9.809 -10.105 -4.571
234 HD13 LEU 33 HD13 LEU 33 -8.397 -11.069 -5.011
235 HD21 LEU 33 HD21 LEU 33 -7.636 -11.019 -2.622
236 HD22 LEU 33 HD22 LEU 33 -9.068 -10.072 -2.216
237 HD23 LEU 33 HD23 LEU 33 -7.465 -9.468 -1.793
238 H ARG 34 HN ARG 34 -8.162 -7.203 -6.562
239 HA ARG 34 HA ARG 34 -6.533 -4.841 -6.848
240 HB2 ARG 34 HB2 ARG 34 -9.450 -5.208 -7.473
241 HB3 ARG 34 HB1 ARG 34 -8.382 -3.944 -8.066
242 HG2 ARG 34 HG2 ARG 34 -7.096 -5.595 -9.318
243 HG3 ARG 34 HG1 ARG 34 -8.141 -6.877 -8.706
244 HD2 ARG 34 HD2 ARG 34 -8.811 -6.237 -10.950
245 HD3 ARG 34 HD1 ARG 34 -10.066 -5.808 -9.785
246 HE ARG 34 HE ARG 34 -8.179 -3.736 -10.291
247 HH11 ARG 34 HH11 ARG 34 -11.112 -5.215 -11.637
248 HH12 ARG 34 HH12 ARG 34 -11.689 -3.739 -12.302
249 HH21 ARG 34 HH21 ARG 34 -8.980 -1.792 -11.161
250 HH22 ARG 34 HH22 ARG 34 -10.476 -1.726 -12.014
251 H PHE 35 HN PHE 35 -6.947 -2.857 -5.925
252 HA PHE 35 HA PHE 35 -7.890 -2.807 -3.280
253 HB2 PHE 35 HB2 PHE 35 -7.436 -0.497 -5.190
254 HB3 PHE 35 HB1 PHE 35 -7.817 -0.291 -3.485
255 HD1 PHE 35 HD2 PHE 35 -6.201 -1.936 -1.972
256 HD2 PHE 35 HD1 PHE 35 -5.241 -0.154 -5.708
257 HE1 PHE 35 HE2 PHE 35 -3.816 -2.100 -1.431
258 HE2 PHE 35 HE1 PHE 35 -2.849 -0.321 -5.171
259 HZ PHE 35 HZ PHE 35 -2.137 -1.244 -3.000
260 H GLU 36 HN GLU 36 -9.484 -2.409 -6.270
261 HA GLU 36 HA GLU 36 -11.875 -1.243 -5.331
262 HB2 GLU 36 HB2 GLU 36 -11.393 -3.029 -7.718
263 HB3 GLU 36 HB1 GLU 36 -12.835 -2.054 -7.447
264 HG2 GLU 36 HG2 GLU 36 -10.039 -0.997 -7.824
265 HG3 GLU 36 HG1 GLU 36 -11.311 -1.005 -9.043
266 H ASP 37 HN ASP 37 -10.782 -4.617 -5.742
267 HA ASP 37 HA ASP 37 -13.181 -5.944 -5.031
268 HB2 ASP 37 HB2 ASP 37 -10.307 -6.838 -4.660
269 HB3 ASP 37 HB1 ASP 37 -11.694 -7.844 -4.327
270 H ILE 38 HN ILE 38 -10.319 -5.020 -3.234
271 HA ILE 38 HA ILE 38 -11.463 -5.997 -0.796
272 HB ILE 38 HB ILE 38 -9.287 -5.402 0.263
273 HG12 ILE 38 HG12 ILE 38 -8.564 -4.551 -2.558
274 HG13 ILE 38 HG11 ILE 38 -8.673 -3.495 -1.156
275 HG21 ILE 38 HG21 ILE 38 -9.691 -7.608 -0.721
276 HG22 ILE 38 HG22 ILE 38 -8.010 -7.131 -0.912
277 HG23 ILE 38 HG23 ILE 38 -9.111 -7.021 -2.283
278 HD11 ILE 38 HD11 ILE 38 -6.660 -5.704 -1.560
279 HD12 ILE 38 HD12 ILE 38 -6.772 -4.665 -0.142
280 HD13 ILE 38 HD13 ILE 38 -6.364 -3.970 -1.708
281 H GLY 39 HN GLY 39 -12.272 -3.455 -2.273
282 HA2 GLY 39 HA2 GLY 39 -13.347 -1.517 -1.718
283 HA3 GLY 39 HA1 GLY 39 -13.585 -2.267 -0.154
284 H TYR 40 HN TYR 40 -10.654 -0.995 -1.757
285 HA TYR 40 HA TYR 40 -10.180 0.433 0.696
286 HB2 TYR 40 HB2 TYR 40 -8.318 -0.009 -1.646
287 HB3 TYR 40 HB1 TYR 40 -8.058 1.291 -0.515
288 HD1 TYR 40 HD2 TYR 40 -9.348 -2.129 0.182
289 HD2 TYR 40 HD1 TYR 40 -6.212 0.680 0.707
290 HE1 TYR 40 HE2 TYR 40 -8.259 -3.654 1.759
291 HE2 TYR 40 HE1 TYR 40 -5.106 -0.827 2.285
292 HH TYR 40 HH TYR 40 -6.041 -4.077 2.722
293 H ASP 41 HN ASP 41 -10.577 2.275 1.159
294 HA ASP 41 HA ASP 41 -11.964 4.078 -0.559
295 HB2 ASP 41 HB2 ASP 41 -12.092 3.820 2.072
296 HB3 ASP 41 HB1 ASP 41 -10.599 4.774 1.972
297 H SER 42 HN SER 42 -11.089 6.367 -0.562
298 HA SER 42 HA SER 42 -8.601 6.361 -1.945
299 HB2 SER 42 HB2 SER 42 -9.265 8.921 -1.885
300 HB3 SER 42 HB1 SER 42 -10.143 7.783 -2.926
301 H LEU 43 HN LEU 43 -9.925 7.515 1.089
302 HA LEU 43 HA LEU 43 -7.565 8.779 2.039
303 HB2 LEU 43 HB2 LEU 43 -9.854 7.547 3.575
304 HB3 LEU 43 HB1 LEU 43 -8.595 8.517 4.293
305 HG LEU 43 HG LEU 43 -10.602 9.495 2.266
306 HD11 LEU 43 HD11 LEU 43 -11.585 9.017 4.456
307 HD12 LEU 43 HD12 LEU 43 -11.526 10.751 4.143
308 HD13 LEU 43 HD13 LEU 43 -10.350 10.008 5.226
309 HD21 LEU 43 HD21 LEU 43 -8.473 10.951 3.826
310 HD22 LEU 43 HD22 LEU 43 -9.687 11.706 2.789
311 HD23 LEU 43 HD23 LEU 43 -8.460 10.652 2.090
312 H ALA 44 HN ALA 44 -8.905 5.592 2.318
313 HA ALA 44 HA ALA 44 -7.133 4.484 4.157
314 HB1 ALA 44 HB1 ALA 44 -8.542 3.043 1.914
315 HB2 ALA 44 HB2 ALA 44 -9.238 3.402 3.495
316 HB3 ALA 44 HB3 ALA 44 -7.864 2.300 3.360
317 H LEU 45 HN LEU 45 -6.845 4.795 0.648
318 HA LEU 45 HA LEU 45 -4.555 3.193 0.284
319 HB2 LEU 45 HB2 LEU 45 -6.132 4.351 -1.464
320 HB3 LEU 45 HB1 LEU 45 -5.106 5.741 -1.251
321 HG LEU 45 HG LEU 45 -4.372 4.748 -3.240
322 HD11 LEU 45 HD11 LEU 45 -2.170 3.872 -2.896
323 HD12 LEU 45 HD12 LEU 45 -2.535 3.673 -1.175
324 HD13 LEU 45 HD13 LEU 45 -2.478 5.295 -1.885
325 HD21 LEU 45 HD21 LEU 45 -3.810 2.506 -3.567
326 HD22 LEU 45 HD22 LEU 45 -5.514 2.640 -3.093
327 HD23 LEU 45 HD23 LEU 45 -4.275 2.068 -1.924
328 H MET 46 HN MET 46 -4.972 6.652 0.929
329 HA MET 46 HA MET 46 -2.262 7.512 0.891
330 HB2 MET 46 HB2 MET 46 -4.295 8.726 2.751
331 HB3 MET 46 HB1 MET 46 -3.002 9.527 1.865
332 HG2 MET 46 HG2 MET 46 -4.276 8.906 -0.200
333 HG3 MET 46 HG1 MET 46 -5.537 8.430 0.948
334 HE1 MET 46 HE1 MET 46 -5.790 10.645 -1.410
335 HE2 MET 46 HE2 MET 46 -6.776 11.871 -0.623
336 HE3 MET 46 HE3 MET 46 -7.171 10.165 -0.424
337 H GLU 47 HN GLU 47 -4.433 6.698 3.466
338 HA GLU 47 HA GLU 47 -2.757 6.936 5.631
339 HB2 GLU 47 HB2 GLU 47 -5.185 5.636 4.859
340 HB3 GLU 47 HB1 GLU 47 -4.610 5.185 6.511
341 HG2 GLU 47 HG2 GLU 47 -4.623 7.733 6.850
342 HG3 GLU 47 HG1 GLU 47 -5.450 7.830 5.299
343 H THR 48 HN THR 48 -3.274 4.164 3.514
344 HA THR 48 HA THR 48 -1.709 2.265 4.889
345 HB THR 48 HB THR 48 -2.270 2.606 1.922
346 HG1 THR 48 HG1 THR 48 -4.150 2.280 3.118
347 HG21 THR 48 HG21 THR 48 -1.301 0.138 3.385
348 HG22 THR 48 HG22 THR 48 -0.330 1.147 2.310
349 HG23 THR 48 HG23 THR 48 -1.712 0.251 1.666
350 H ALA 49 HN ALA 49 -0.918 4.323 2.091
351 HA ALA 49 HA ALA 49 1.788 3.715 1.899
352 HB1 ALA 49 HB1 ALA 49 1.980 5.742 0.536
353 HB2 ALA 49 HB2 ALA 49 0.405 6.279 1.118
354 HB3 ALA 49 HB3 ALA 49 0.523 4.832 0.121
355 H ALA 50 HN ALA 50 0.210 6.418 3.559
356 HA ALA 50 HA ALA 50 2.449 7.767 4.487
357 HB1 ALA 50 HB1 ALA 50 0.975 8.808 6.121
358 HB2 ALA 50 HB2 ALA 50 -0.240 7.562 5.842
359 HB3 ALA 50 HB3 ALA 50 0.179 8.686 4.557
360 H ARG 51 HN ARG 51 0.816 4.960 5.855
361 HA ARG 51 HA ARG 51 2.179 5.060 8.344
362 HB2 ARG 51 HB2 ARG 51 0.121 3.699 8.017
363 HB3 ARG 51 HB1 ARG 51 1.039 2.596 6.998
364 HG2 ARG 51 HG2 ARG 51 0.972 1.563 9.106
365 HG3 ARG 51 HG1 ARG 51 2.581 2.259 8.988
366 HD2 ARG 51 HD2 ARG 51 0.234 3.224 10.631
367 HD3 ARG 51 HD1 ARG 51 1.848 2.723 11.144
368 HE ARG 51 HE ARG 51 2.630 4.806 9.965
369 HH11 ARG 51 HH11 ARG 51 -0.461 4.543 11.668
370 HH12 ARG 51 HH12 ARG 51 -0.711 6.209 11.850
371 HH21 ARG 51 HH21 ARG 51 2.356 7.149 10.223
372 HH22 ARG 51 HH22 ARG 51 0.955 7.754 10.980
373 H LEU 52 HN LEU 52 2.811 3.532 5.286
374 HA LEU 52 HA LEU 52 5.120 2.101 6.113
375 HB2 LEU 52 HB2 LEU 52 4.274 3.034 3.368
376 HB3 LEU 52 HB1 LEU 52 5.541 1.872 3.694
377 HG LEU 52 HG LEU 52 2.613 1.471 4.344
378 HD11 LEU 52 HD11 LEU 52 2.632 -0.152 2.541
379 HD12 LEU 52 HD12 LEU 52 4.298 0.291 2.153
380 HD13 LEU 52 HD13 LEU 52 2.999 1.465 1.953
381 HD21 LEU 52 HD21 LEU 52 4.978 -0.395 4.554
382 HD22 LEU 52 HD22 LEU 52 3.292 -0.848 4.776
383 HD23 LEU 52 HD23 LEU 52 4.059 0.282 5.897
384 H GLU 53 HN GLU 53 4.527 5.254 4.694
385 HA GLU 53 HA GLU 53 7.150 6.123 4.308
386 HB2 GLU 53 HB2 GLU 53 4.762 7.775 5.153
387 HB3 GLU 53 HB1 GLU 53 6.242 8.392 4.453
388 HG2 GLU 53 HG2 GLU 53 5.771 7.246 2.376
389 HG3 GLU 53 HG1 GLU 53 4.318 6.540 3.082
390 H SER 54 HN SER 54 5.096 6.126 7.203
391 HA SER 54 HA SER 54 6.653 7.778 8.875
392 HB2 SER 54 HB2 SER 54 4.951 5.412 9.707
393 HB3 SER 54 HB1 SER 54 5.407 6.781 10.714
394 HG SER 54 HG SER 54 4.054 7.396 8.346
395 H ARG 55 HN ARG 55 6.799 4.356 8.193
396 HA ARG 55 HA ARG 55 8.869 3.889 10.156
397 HB2 ARG 55 HB2 ARG 55 7.180 2.244 10.034
398 HB3 ARG 55 HB1 ARG 55 7.365 2.078 8.293
399 HG2 ARG 55 HG2 ARG 55 9.546 1.059 8.625
400 HG3 ARG 55 HG1 ARG 55 9.391 1.273 10.370
401 HD2 ARG 55 HD2 ARG 55 7.558 -0.199 10.494
402 HD3 ARG 55 HD1 ARG 55 7.369 -0.239 8.746
403 HE ARG 55 HE ARG 55 9.866 -1.226 9.823
404 HH11 ARG 55 HH11 ARG 55 6.591 -2.001 8.737
405 HH12 ARG 55 HH12 ARG 55 7.014 -3.543 8.143
406 HH21 ARG 55 HH21 ARG 55 10.376 -3.511 9.066
407 HH22 ARG 55 HH22 ARG 55 9.068 -4.385 8.382
408 H TYR 56 HN TYR 56 8.572 3.514 6.615
409 HA TYR 56 HA TYR 56 11.337 2.790 6.421
410 HB2 TYR 56 HB2 TYR 56 9.180 3.134 4.356
411 HB3 TYR 56 HB1 TYR 56 10.837 2.742 3.924
412 HD1 TYR 56 HD2 TYR 56 7.868 1.546 5.736
413 HD2 TYR 56 HD1 TYR 56 11.687 0.514 4.204
414 HE1 TYR 56 HE2 TYR 56 7.362 -0.833 6.101
415 HE2 TYR 56 HE1 TYR 56 11.192 -1.870 4.554
416 HH TYR 56 HH TYR 56 9.770 -3.337 5.719
417 H GLY 57 HN GLY 57 9.591 5.773 6.125
418 HA2 GLY 57 HA2 GLY 57 10.559 7.870 6.058
419 HA3 GLY 57 HA1 GLY 57 12.111 7.120 5.702
420 H VAL 58 HN VAL 58 9.201 6.472 3.899
421 HA VAL 58 HA VAL 58 10.515 7.711 1.582
422 HB VAL 58 HB VAL 58 9.260 6.243 0.104
423 HG11 VAL 58 HG11 VAL 58 10.197 4.070 0.744
424 HG12 VAL 58 HG12 VAL 58 10.467 4.705 2.368
425 HG13 VAL 58 HG13 VAL 58 11.352 5.394 1.003
426 HG21 VAL 58 HG21 VAL 58 7.986 5.071 2.587
427 HG22 VAL 58 HG22 VAL 58 7.811 4.464 0.937
428 HG23 VAL 58 HG23 VAL 58 7.178 6.054 1.356
429 H SER 59 HN SER 59 8.508 8.121 -0.198
430 HA SER 59 HA SER 59 6.267 9.374 1.103
431 HB2 SER 59 HB2 SER 59 8.192 11.012 -0.579
432 HB3 SER 59 HB1 SER 59 6.661 11.578 0.081
433 HG SER 59 HG SER 59 8.202 10.488 2.001
434 H ILE 60 HN ILE 60 4.569 8.883 -0.088
435 HA ILE 60 HA ILE 60 4.876 8.646 -3.008
436 HB ILE 60 HB ILE 60 2.859 7.238 -1.214
437 HG12 ILE 60 HG12 ILE 60 5.085 6.121 -2.942
438 HG13 ILE 60 HG11 ILE 60 5.064 6.168 -1.183
439 HG21 ILE 60 HG21 ILE 60 2.019 6.156 -3.272
440 HG22 ILE 60 HG22 ILE 60 3.084 7.189 -4.231
441 HG23 ILE 60 HG23 ILE 60 1.784 7.909 -3.285
442 HD11 ILE 60 HD11 ILE 60 4.529 3.955 -1.993
443 HD12 ILE 60 HD12 ILE 60 3.191 4.601 -2.942
444 HD13 ILE 60 HD13 ILE 60 3.129 4.655 -1.182
445 HA PRO 61 HA PRO 61 2.277 12.301 -2.811
446 HB2 PRO 61 HB2 PRO 61 2.255 11.800 -5.744
447 HB3 PRO 61 HB1 PRO 61 2.656 13.278 -4.864
448 HG2 PRO 61 HG2 PRO 61 4.579 11.830 -6.005
449 HG3 PRO 61 HG1 PRO 61 4.826 12.576 -4.414
450 HD2 PRO 61 HD2 PRO 61 4.169 9.735 -5.092
451 HD3 PRO 61 HD1 PRO 61 5.329 10.367 -3.899
452 H ASP 62 HN ASP 62 0.083 12.470 -2.831
453 HA ASP 62 HA ASP 62 -1.538 10.181 -2.887
454 HB2 ASP 62 HB2 ASP 62 -3.466 11.635 -2.646
455 HB3 ASP 62 HB1 ASP 62 -2.151 12.312 -1.699
456 H ASP 63 HN ASP 63 -0.710 12.402 -5.343
457 HA ASP 63 HA ASP 63 -2.527 11.796 -7.370
458 HB2 ASP 63 HB2 ASP 63 -1.035 13.667 -7.561
459 HB3 ASP 63 HB1 ASP 63 0.371 12.618 -7.517
460 H VAL 64 HN VAL 64 0.421 10.143 -6.374
461 HA VAL 64 HA VAL 64 0.384 8.351 -8.635
462 HB VAL 64 HB VAL 64 2.169 8.212 -6.189
463 HG11 VAL 64 HG11 VAL 64 2.589 7.106 -8.964
464 HG12 VAL 64 HG12 VAL 64 2.167 6.178 -7.521
465 HG13 VAL 64 HG13 VAL 64 3.722 6.998 -7.615
466 HG21 VAL 64 HG21 VAL 64 2.410 10.401 -7.189
467 HG22 VAL 64 HG22 VAL 64 2.672 9.670 -8.777
468 HG23 VAL 64 HG23 VAL 64 3.852 9.434 -7.487
469 H ALA 65 HN ALA 65 -0.707 8.381 -5.324
470 HA ALA 65 HA ALA 65 -0.972 5.658 -4.845
471 HB1 ALA 65 HB1 ALA 65 -2.542 8.007 -3.790
472 HB2 ALA 65 HB2 ALA 65 -1.024 7.397 -3.127
473 HB3 ALA 65 HB3 ALA 65 -2.474 6.392 -3.076
474 H GLY 66 HN GLY 66 -2.989 8.066 -6.423
475 HA2 GLY 66 HA2 GLY 66 -5.208 6.265 -6.764
476 HA3 GLY 66 HA1 GLY 66 -5.047 7.885 -7.429
477 H ARG 67 HN ARG 67 -2.301 5.990 -8.104
478 HA ARG 67 HA ARG 67 -3.291 5.512 -10.818
479 HB2 ARG 67 HB2 ARG 67 -0.481 5.871 -9.801
480 HB3 ARG 67 HB1 ARG 67 -0.915 5.493 -11.452
481 HG2 ARG 67 HG2 ARG 67 -2.106 7.600 -11.633
482 HG3 ARG 67 HG1 ARG 67 -1.678 7.980 -9.959
483 HD2 ARG 67 HD2 ARG 67 -0.185 9.103 -11.522
484 HD3 ARG 67 HD1 ARG 67 0.694 7.928 -10.550
485 HE ARG 67 HE ARG 67 0.676 6.456 -12.445
486 HH11 ARG 67 HH11 ARG 67 -0.126 9.863 -13.063
487 HH12 ARG 67 HH12 ARG 67 0.370 9.854 -14.686
488 HH21 ARG 67 HH21 ARG 67 1.359 6.426 -14.730
489 HH22 ARG 67 HH22 ARG 67 1.248 7.851 -15.644
490 H VAL 68 HN VAL 68 -2.818 3.852 -8.019
491 HA VAL 68 HA VAL 68 -1.759 1.558 -9.454
492 HB VAL 68 HB VAL 68 -1.262 0.501 -7.246
493 HG11 VAL 68 HG11 VAL 68 0.445 1.725 -8.457
494 HG12 VAL 68 HG12 VAL 68 0.650 1.906 -6.710
495 HG13 VAL 68 HG13 VAL 68 -0.037 3.218 -7.659
496 HG21 VAL 68 HG21 VAL 68 -2.069 3.190 -6.129
497 HG22 VAL 68 HG22 VAL 68 -1.258 1.907 -5.233
498 HG23 VAL 68 HG23 VAL 68 -2.901 1.656 -5.842
499 H ASP 69 HN ASP 69 -2.715 -0.559 -9.007
500 HA ASP 69 HA ASP 69 -5.617 -0.315 -8.440
501 HB2 ASP 69 HB2 ASP 69 -4.953 -0.670 -10.889
502 HB3 ASP 69 HB1 ASP 69 -4.318 -2.211 -10.370
503 H THR 70 HN THR 70 -2.743 -2.284 -8.433
504 HA THR 70 HA THR 70 -3.993 -4.115 -6.540
505 HB THR 70 HB THR 70 -2.461 -5.855 -7.470
506 HG1 THR 70 HG1 THR 70 -1.702 -3.667 -9.142
507 HG21 THR 70 HG21 THR 70 -4.733 -5.663 -8.368
508 HG22 THR 70 HG22 THR 70 -3.606 -6.082 -9.670
509 HG23 THR 70 HG23 THR 70 -4.179 -4.420 -9.488
510 HA PRO 71 HA PRO 71 -1.114 -3.027 -3.394
511 HB2 PRO 71 HB2 PRO 71 -0.592 -5.951 -3.137
512 HB3 PRO 71 HB1 PRO 71 -1.014 -4.769 -1.886
513 HG2 PRO 71 HG2 PRO 71 -2.863 -6.412 -2.779
514 HG3 PRO 71 HG1 PRO 71 -3.251 -4.692 -2.546
515 HD2 PRO 71 HD2 PRO 71 -2.674 -6.174 -5.075
516 HD3 PRO 71 HD1 PRO 71 -3.899 -4.931 -4.742
517 H ARG 72 HN ARG 72 0.087 -5.373 -5.782
518 HA ARG 72 HA ARG 72 2.786 -5.254 -4.995
519 HB2 ARG 72 HB2 ARG 72 3.396 -6.203 -7.150
520 HB3 ARG 72 HB1 ARG 72 1.984 -7.015 -6.512
521 HG2 ARG 72 HG2 ARG 72 0.559 -5.980 -8.082
522 HG3 ARG 72 HG1 ARG 72 1.802 -4.817 -8.556
523 HD2 ARG 72 HD2 ARG 72 1.654 -6.479 -10.270
524 HD3 ARG 72 HD1 ARG 72 3.168 -6.694 -9.404
525 HE ARG 72 HE ARG 72 0.776 -8.385 -9.079
526 HH11 ARG 72 HH11 ARG 72 4.319 -7.996 -8.870
527 HH12 ARG 72 HH12 ARG 72 4.616 -9.669 -8.792
528 HH21 ARG 72 HH21 ARG 72 1.204 -10.638 -8.888
529 HH22 ARG 72 HH22 ARG 72 2.813 -11.232 -8.786
530 H GLU 73 HN GLU 73 0.906 -3.126 -7.000
531 HA GLU 73 HA GLU 73 3.103 -1.726 -8.165
532 HB2 GLU 73 HB2 GLU 73 0.219 -0.930 -7.825
533 HB3 GLU 73 HB1 GLU 73 1.387 -0.172 -8.905
534 HG2 GLU 73 HG2 GLU 73 1.510 -2.105 -10.262
535 HG3 GLU 73 HG1 GLU 73 0.604 -3.064 -9.093
536 H LEU 74 HN LEU 74 1.028 -1.304 -5.391
537 HA LEU 74 HA LEU 74 1.819 1.286 -4.553
538 HB2 LEU 74 HB2 LEU 74 -0.147 -0.237 -3.760
539 HB3 LEU 74 HB1 LEU 74 1.114 -0.986 -2.780
540 HG LEU 74 HG LEU 74 -0.417 0.707 -1.588
541 HD11 LEU 74 HD11 LEU 74 1.642 -0.051 -0.575
542 HD12 LEU 74 HD12 LEU 74 1.375 1.661 -0.247
543 HD13 LEU 74 HD13 LEU 74 2.551 1.169 -1.469
544 HD21 LEU 74 HD21 LEU 74 1.281 2.631 -3.150
545 HD22 LEU 74 HD22 LEU 74 0.208 3.059 -1.824
546 HD23 LEU 74 HD23 LEU 74 -0.462 2.402 -3.325
547 H LEU 75 HN LEU 75 2.797 -1.969 -3.651
548 HA LEU 75 HA LEU 75 4.785 -1.513 -1.796
549 HB2 LEU 75 HB2 LEU 75 3.734 -3.634 -2.229
550 HB3 LEU 75 HB1 LEU 75 4.359 -3.643 -3.862
551 HG LEU 75 HG LEU 75 6.589 -3.713 -2.940
552 HD11 LEU 75 HD11 LEU 75 6.167 -2.855 -0.711
553 HD12 LEU 75 HD12 LEU 75 6.861 -4.468 -0.581
554 HD13 LEU 75 HD13 LEU 75 5.125 -4.230 -0.343
555 HD21 LEU 75 HD21 LEU 75 6.482 -6.131 -2.399
556 HD22 LEU 75 HD22 LEU 75 5.504 -5.646 -3.799
557 HD23 LEU 75 HD23 LEU 75 4.723 -5.959 -2.256
558 H ASP 76 HN ASP 76 4.831 -1.685 -5.268
559 HA ASP 76 HA ASP 76 7.608 -1.677 -5.735
560 HB2 ASP 76 HB2 ASP 76 5.986 -2.452 -7.378
561 HB3 ASP 76 HB1 ASP 76 5.296 -0.834 -7.486
562 H LEU 77 HN LEU 77 5.180 0.834 -5.503
563 HA LEU 77 HA LEU 77 6.741 3.051 -6.263
564 HB2 LEU 77 HB2 LEU 77 4.452 2.903 -4.317
565 HB3 LEU 77 HB1 LEU 77 5.098 4.381 -4.984
566 HG LEU 77 HG LEU 77 3.727 2.194 -6.516
567 HD11 LEU 77 HD11 LEU 77 2.807 4.958 -5.745
568 HD12 LEU 77 HD12 LEU 77 2.191 3.432 -5.102
569 HD13 LEU 77 HD13 LEU 77 1.933 3.840 -6.795
570 HD21 LEU 77 HD21 LEU 77 5.424 3.330 -7.859
571 HD22 LEU 77 HD22 LEU 77 4.717 4.892 -7.438
572 HD23 LEU 77 HD23 LEU 77 3.797 3.741 -8.408
573 H ILE 78 HN ILE 78 6.067 1.627 -3.102
574 HA ILE 78 HA ILE 78 7.509 3.339 -1.450
575 HB ILE 78 HB ILE 78 7.170 0.336 -1.176
576 HG12 ILE 78 HG12 ILE 78 5.018 1.615 -1.249
577 HG13 ILE 78 HG11 ILE 78 5.298 0.812 0.292
578 HG21 ILE 78 HG21 ILE 78 7.998 2.367 0.899
579 HG22 ILE 78 HG22 ILE 78 9.010 1.102 0.201
580 HG23 ILE 78 HG23 ILE 78 7.642 0.669 1.222
581 HD11 ILE 78 HD11 ILE 78 5.734 3.733 -0.288
582 HD12 ILE 78 HD12 ILE 78 5.990 2.938 1.268
583 HD13 ILE 78 HD13 ILE 78 4.369 3.042 0.586
584 H ASN 79 HN ASN 79 8.551 0.206 -2.746
585 HA ASN 79 HA ASN 79 11.208 0.475 -1.896
586 HB2 ASN 79 HB2 ASN 79 10.014 -1.370 -3.962
587 HB3 ASN 79 HB1 ASN 79 11.692 -1.465 -3.441
588 HD21 ASN 79 HD21 ASN 79 9.703 -3.494 -3.170
589 HD22 ASN 79 HD22 ASN 79 9.481 -3.791 -1.479
590 H GLY 80 HN GLY 80 9.672 1.682 -4.736
591 HA2 GLY 80 HA2 GLY 80 12.024 2.136 -6.269
592 HA3 GLY 80 HA1 GLY 80 10.491 2.987 -6.453
593 H ALA 81 HN ALA 81 10.220 4.101 -3.951
594 HA ALA 81 HA ALA 81 11.994 6.354 -4.118
595 HB1 ALA 81 HB1 ALA 81 9.932 5.647 -2.024
596 HB2 ALA 81 HB2 ALA 81 9.649 6.632 -3.461
597 HB3 ALA 81 HB3 ALA 81 10.734 7.205 -2.197
598 H LEU 82 HN LEU 82 11.645 3.546 -2.076
599 HA LEU 82 HA LEU 82 13.353 4.228 -0.002
600 HB2 LEU 82 HB2 LEU 82 11.676 2.502 0.122
601 HB3 LEU 82 HB1 LEU 82 12.469 1.579 -1.131
602 HG LEU 82 HG LEU 82 14.365 1.274 0.338
603 HD11 LEU 82 HD11 LEU 82 14.088 3.192 1.834
604 HD12 LEU 82 HD12 LEU 82 14.081 1.697 2.780
605 HD13 LEU 82 HD13 LEU 82 12.568 2.527 2.431
606 HD21 LEU 82 HD21 LEU 82 12.702 -0.438 0.118
607 HD22 LEU 82 HD22 LEU 82 11.708 0.312 1.365
608 HD23 LEU 82 HD23 LEU 82 13.263 -0.406 1.789
609 H ALA 83 HN ALA 83 13.948 2.947 -3.210
610 HA ALA 83 HA ALA 83 16.545 1.952 -2.752
611 HB1 ALA 83 HB1 ALA 83 16.799 1.979 -5.174
612 HB2 ALA 83 HB2 ALA 83 15.349 2.972 -5.317
613 HB3 ALA 83 HB3 ALA 83 15.228 1.318 -4.713
614 H GLU 84 HN GLU 84 15.376 5.183 -3.730
615 HA GLU 84 HA GLU 84 18.034 6.162 -3.970
616 HB2 GLU 84 HB2 GLU 84 15.318 7.325 -4.176
617 HB3 GLU 84 HB1 GLU 84 16.650 8.411 -3.842
618 HG2 GLU 84 HG2 GLU 84 16.280 8.424 -6.185
619 HG3 GLU 84 HG1 GLU 84 17.771 7.544 -5.895
620 H ALA 85 HN ALA 85 15.851 5.726 -1.400
621 HA ALA 85 HA ALA 85 17.134 7.688 0.310
622 HB1 ALA 85 HB1 ALA 85 14.707 7.350 0.447
623 HB2 ALA 85 HB2 ALA 85 15.496 7.008 1.986
624 HB3 ALA 85 HB3 ALA 85 14.966 5.678 0.950
625 H ALA 86 HN ALA 86 17.763 4.598 -0.656
626 HA ALA 86 HA ALA 86 18.684 3.426 1.767
627 HB1 ALA 86 HB1 ALA 86 17.975 2.057 -0.122
628 HB2 ALA 86 HB2 ALA 86 19.652 1.698 0.319
629 HB3 ALA 86 HB3 ALA 86 19.299 2.692 -1.096
630 H28A SDO 101 H28A SDO 42 -12.249 11.391 -0.164
631 H28B SDO 101 H28B SDO 42 -10.678 10.588 -0.125
632 H30A SDO 101 H30A SDO 42 -9.697 12.494 0.975
633 H30B SDO 101 H30B SDO 42 -11.255 13.320 0.958
634 H30C SDO 101 H30C SDO 42 -9.832 14.119 0.298
635 H31A SDO 101 H31A SDO 42 -9.526 11.890 -2.649
636 H31B SDO 101 H31B SDO 42 -8.677 11.710 -1.112
637 H31C SDO 101 H31C SDO 42 -8.833 13.302 -1.846
638 H32A SDO 101 H32A SDO 42 -11.948 12.993 -2.630
639 H33A SDO 101 H33A SDO 42 -10.609 14.428 -3.214
640 H36A SDO 101 H36A SDO 42 -12.168 15.806 -1.538
641 H37A SDO 101 H37A SDO 42 -14.534 16.548 -1.042
642 H37B SDO 101 H37B SDO 42 -14.399 15.525 0.397
643 H38A SDO 101 H38A SDO 42 -12.610 17.895 -0.233
644 H38B SDO 101 H38B SDO 42 -14.010 17.954 0.817
645 H41A SDO 101 H41A SDO 42 -10.723 17.336 0.649
646 H42A SDO 101 H42A SDO 42 -10.236 17.174 3.400
647 H42B SDO 101 H42B SDO 42 -10.269 15.543 2.743
648 H43A SDO 101 H43A SDO 42 -8.440 17.750 1.894
649 H43B SDO 101 H43B SDO 42 -8.680 16.275 1.015
650 H1A SDO 101 H1A SDO 42 -7.466 13.892 4.242
651 H1B SDO 101 H1B SDO 42 -7.261 15.346 5.189
652 H2A SDO 101 H2A SDO 42 -9.835 14.490 3.931
653 H2B SDO 101 H2B SDO 42 -9.580 15.876 4.965
654 H4A SDO 101 H4A SDO 42 -9.152 12.183 7.042
655 H4B SDO 101 H4B SDO 42 -8.879 13.590 8.027
656 H5A SDO 101 H5A SDO 42 -6.842 14.117 6.846
657 H5B SDO 101 H5B SDO 42 -7.083 12.731 5.780
658 H6A SDO 101 H6A SDO 42 -7.042 11.242 7.762
659 H6B SDO 101 H6B SDO 42 -6.724 12.628 8.784
660 H8A SDO 101 H8A SDO 42 -4.893 12.482 5.523
661 H8B SDO 101 H8B SDO 42 -3.345 12.437 6.388
662 H8C SDO 101 H8C SDO 42 -4.437 13.812 6.598
Start of MODEL 19
1 H1 MET 1 HT1 MET 1 19.668 -3.140 -1.990
2 H2 MET 1 HT2 MET 1 19.277 -1.681 -2.748
3 H3 MET 1 HT3 MET 1 18.499 -2.118 -1.303
4 HA MET 1 HA MET 1 21.377 -1.588 -1.705
5 HB2 MET 1 HB2 MET 1 21.115 0.489 -0.556
6 HB3 MET 1 HB1 MET 1 19.861 0.424 -1.775
7 HG2 MET 1 HG2 MET 1 19.514 -0.081 1.168
8 HG3 MET 1 HG1 MET 1 19.032 1.362 0.300
9 HE1 MET 1 HE1 MET 1 16.633 1.151 1.411
10 HE2 MET 1 HE2 MET 1 17.174 -0.302 2.244
11 HE3 MET 1 HE3 MET 1 15.652 -0.310 1.348
12 H ALA 2 HN ALA 2 18.856 -2.890 0.440
13 HA ALA 2 HA ALA 2 20.835 -4.067 2.113
14 HB1 ALA 2 HB1 ALA 2 20.896 -1.826 3.082
15 HB2 ALA 2 HB2 ALA 2 20.200 -2.972 4.220
16 HB3 ALA 2 HB3 ALA 2 19.152 -1.869 3.325
17 H THR 3 HN THR 3 17.471 -2.890 2.448
18 HA THR 3 HA THR 3 16.577 -5.625 2.483
19 HB THR 3 HB THR 3 17.002 -5.088 4.858
20 HG1 THR 3 HG1 THR 3 15.429 -6.352 4.992
21 HG21 THR 3 HG21 THR 3 16.757 -2.652 4.825
22 HG22 THR 3 HG22 THR 3 15.714 -3.359 6.050
23 HG23 THR 3 HG23 THR 3 15.026 -2.821 4.507
24 H LEU 4 HN LEU 4 14.683 -5.784 1.358
25 HA LEU 4 HA LEU 4 13.406 -3.255 0.608
26 HB2 LEU 4 HB2 LEU 4 14.785 -4.411 -1.168
27 HB3 LEU 4 HB1 LEU 4 13.643 -5.741 -1.085
28 HG LEU 4 HG LEU 4 11.845 -4.142 -1.745
29 HD11 LEU 4 HD11 LEU 4 12.927 -2.090 -0.997
30 HD12 LEU 4 HD12 LEU 4 12.518 -1.988 -2.712
31 HD13 LEU 4 HD13 LEU 4 14.184 -2.289 -2.219
32 HD21 LEU 4 HD21 LEU 4 12.923 -5.613 -3.389
33 HD22 LEU 4 HD22 LEU 4 14.170 -4.394 -3.663
34 HD23 LEU 4 HD23 LEU 4 12.495 -4.059 -4.101
35 H LEU 5 HN LEU 5 11.286 -3.179 1.071
36 HA LEU 5 HA LEU 5 9.987 -5.106 2.590
37 HB2 LEU 5 HB2 LEU 5 8.981 -2.705 1.145
38 HB3 LEU 5 HB1 LEU 5 7.818 -3.850 1.763
39 HG LEU 5 HG LEU 5 8.806 -3.525 4.042
40 HD11 LEU 5 HD11 LEU 5 11.001 -2.714 3.401
41 HD12 LEU 5 HD12 LEU 5 10.180 -1.582 4.474
42 HD13 LEU 5 HD13 LEU 5 10.267 -1.258 2.735
43 HD21 LEU 5 HD21 LEU 5 7.740 -1.378 4.416
44 HD22 LEU 5 HD22 LEU 5 6.778 -2.412 3.356
45 HD23 LEU 5 HD23 LEU 5 7.718 -1.079 2.679
46 H THR 6 HN THR 6 8.575 -6.615 2.320
47 HA THR 6 HA THR 6 8.364 -7.732 -0.350
48 HB THR 6 HB THR 6 7.765 -9.837 0.817
49 HG1 THR 6 HG1 THR 6 8.188 -8.246 3.164
50 HG21 THR 6 HG21 THR 6 9.974 -10.295 1.812
51 HG22 THR 6 HG22 THR 6 10.308 -8.557 1.824
52 HG23 THR 6 HG23 THR 6 10.117 -9.406 0.294
53 H THR 7 HN THR 7 6.200 -9.315 -0.150
54 HA THR 7 HA THR 7 4.027 -7.491 -0.397
55 HB THR 7 HB THR 7 4.038 -10.523 -0.372
56 HG1 THR 7 HG1 THR 7 5.294 -8.822 -2.030
57 HG21 THR 7 HG21 THR 7 2.224 -8.520 -1.750
58 HG22 THR 7 HG22 THR 7 1.774 -9.501 -0.347
59 HG23 THR 7 HG23 THR 7 2.118 -10.265 -1.900
60 H ASP 8 HN ASP 8 5.223 -9.816 1.943
61 HA ASP 8 HA ASP 8 3.008 -9.966 3.668
62 HB2 ASP 8 HB2 ASP 8 4.985 -11.498 3.681
63 HB3 ASP 8 HB1 ASP 8 5.933 -10.220 4.425
64 H ASP 9 HN ASP 9 5.794 -7.823 3.531
65 HA ASP 9 HA ASP 9 5.419 -6.317 5.854
66 HB2 ASP 9 HB2 ASP 9 6.540 -5.471 3.182
67 HB3 ASP 9 HB1 ASP 9 6.524 -4.416 4.584
68 H LEU 10 HN LEU 10 4.168 -5.783 2.618
69 HA LEU 10 HA LEU 10 2.755 -3.439 3.237
70 HB2 LEU 10 HB2 LEU 10 3.288 -4.073 0.942
71 HB3 LEU 10 HB1 LEU 10 2.190 -5.433 1.053
72 HG LEU 10 HG LEU 10 0.301 -3.856 1.392
73 HD11 LEU 10 HD11 LEU 10 1.554 -2.007 2.352
74 HD12 LEU 10 HD12 LEU 10 0.598 -1.496 0.963
75 HD13 LEU 10 HD13 LEU 10 2.339 -1.729 0.799
76 HD21 LEU 10 HD21 LEU 10 0.814 -4.700 -0.839
77 HD22 LEU 10 HD22 LEU 10 1.932 -3.359 -1.093
78 HD23 LEU 10 HD23 LEU 10 0.207 -3.047 -0.914
79 H ARG 11 HN ARG 11 1.781 -6.851 3.240
80 HA ARG 11 HA ARG 11 -0.934 -6.580 3.726
81 HB2 ARG 11 HB2 ARG 11 0.069 -8.777 3.337
82 HB3 ARG 11 HB1 ARG 11 0.956 -8.668 4.850
83 HG2 ARG 11 HG2 ARG 11 -1.128 -8.755 6.102
84 HG3 ARG 11 HG1 ARG 11 -2.060 -8.768 4.618
85 HD2 ARG 11 HD2 ARG 11 -1.873 -11.001 5.613
86 HD3 ARG 11 HD1 ARG 11 -1.128 -10.941 4.019
87 HE ARG 11 HE ARG 11 1.033 -10.782 5.210
88 HH11 ARG 11 HH11 ARG 11 -1.712 -12.094 7.070
89 HH12 ARG 11 HH12 ARG 11 -0.731 -13.157 7.984
90 HH21 ARG 11 HH21 ARG 11 2.340 -12.274 6.486
91 HH22 ARG 11 HH22 ARG 11 1.583 -13.217 7.674
92 H ARG 12 HN ARG 12 1.708 -6.472 6.013
93 HA ARG 12 HA ARG 12 0.129 -6.302 8.341
94 HB2 ARG 12 HB2 ARG 12 2.976 -5.426 7.845
95 HB3 ARG 12 HB1 ARG 12 2.217 -5.488 9.436
96 HG2 ARG 12 HG2 ARG 12 1.861 -7.899 9.159
97 HG3 ARG 12 HG1 ARG 12 2.645 -7.824 7.582
98 HD2 ARG 12 HD2 ARG 12 3.943 -7.057 10.188
99 HD3 ARG 12 HD1 ARG 12 4.090 -8.638 9.442
100 HE ARG 12 HE ARG 12 4.959 -6.253 7.981
101 HH11 ARG 12 HH11 ARG 12 5.651 -9.437 9.389
102 HH12 ARG 12 HH12 ARG 12 7.293 -9.457 8.902
103 HH21 ARG 12 HH21 ARG 12 7.336 -6.333 7.257
104 HH22 ARG 12 HH22 ARG 12 8.181 -7.701 7.742
105 H ALA 13 HN ALA 13 1.635 -3.743 6.385
106 HA ALA 13 HA ALA 13 0.655 -1.661 8.097
107 HB1 ALA 13 HB1 ALA 13 2.678 -1.399 6.757
108 HB2 ALA 13 HB2 ALA 13 1.489 -0.134 6.416
109 HB3 ALA 13 HB3 ALA 13 1.702 -1.471 5.291
110 H LEU 14 HN LEU 14 -0.516 -3.214 5.170
111 HA LEU 14 HA LEU 14 -2.514 -1.393 4.493
112 HB2 LEU 14 HB2 LEU 14 -1.601 -3.343 3.152
113 HB3 LEU 14 HB1 LEU 14 -2.570 -4.397 4.151
114 HG LEU 14 HG LEU 14 -4.591 -3.229 3.331
115 HD11 LEU 14 HD11 LEU 14 -2.648 -1.907 1.454
116 HD12 LEU 14 HD12 LEU 14 -3.570 -1.106 2.729
117 HD13 LEU 14 HD13 LEU 14 -4.407 -1.806 1.345
118 HD21 LEU 14 HD21 LEU 14 -3.888 -5.310 2.319
119 HD22 LEU 14 HD22 LEU 14 -2.806 -4.436 1.229
120 HD23 LEU 14 HD23 LEU 14 -4.551 -4.231 1.091
121 H VAL 15 HN VAL 15 -2.467 -4.189 6.677
122 HA VAL 15 HA VAL 15 -5.168 -4.158 7.450
123 HB VAL 15 HB VAL 15 -2.734 -5.159 8.986
124 HG11 VAL 15 HG11 VAL 15 -4.295 -6.401 10.426
125 HG12 VAL 15 HG12 VAL 15 -5.655 -5.638 9.611
126 HG13 VAL 15 HG13 VAL 15 -4.542 -4.662 10.575
127 HG21 VAL 15 HG21 VAL 15 -3.202 -6.358 6.917
128 HG22 VAL 15 HG22 VAL 15 -4.872 -6.612 7.432
129 HG23 VAL 15 HG23 VAL 15 -3.553 -7.373 8.318
130 H GLU 16 HN GLU 16 -2.394 -2.357 8.687
131 HA GLU 16 HA GLU 16 -3.647 -1.303 10.968
132 HB2 GLU 16 HB2 GLU 16 -1.467 0.022 9.324
133 HB3 GLU 16 HB1 GLU 16 -1.888 0.401 10.983
134 HG2 GLU 16 HG2 GLU 16 -1.252 -1.979 11.558
135 HG3 GLU 16 HG1 GLU 16 -0.596 -2.105 9.932
136 H SER 17 HN SER 17 -3.703 -0.289 7.636
137 HA SER 17 HA SER 17 -5.254 2.078 8.268
138 HB2 SER 17 HB2 SER 17 -5.167 2.359 5.729
139 HB3 SER 17 HB1 SER 17 -3.644 2.475 6.612
140 HG SER 17 HG SER 17 -4.368 -0.071 5.693
141 H ALA 18 HN ALA 18 -6.071 -1.032 8.129
142 HA ALA 18 HA ALA 18 -8.473 -0.728 6.515
143 HB1 ALA 18 HB1 ALA 18 -7.489 -3.097 8.115
144 HB2 ALA 18 HB2 ALA 18 -7.253 -2.852 6.382
145 HB3 ALA 18 HB3 ALA 18 -8.877 -3.099 7.019
146 H GLY 19 HN GLY 19 -7.548 -1.427 9.849
147 HA2 GLY 19 HA2 GLY 19 -8.586 -0.246 11.636
148 HA3 GLY 19 HA1 GLY 19 -10.050 -0.153 10.675
149 H GLU 20 HN GLU 20 -11.598 -1.496 11.230
150 HA GLU 20 HA GLU 20 -10.876 -4.027 12.494
151 HB2 GLU 20 HB2 GLU 20 -12.648 -3.707 14.192
152 HB3 GLU 20 HB1 GLU 20 -11.337 -2.562 14.346
153 HG2 GLU 20 HG2 GLU 20 -13.977 -1.933 13.042
154 HG3 GLU 20 HG1 GLU 20 -13.618 -1.615 14.735
155 H THR 21 HN THR 21 -12.164 -2.914 9.905
156 HA THR 21 HA THR 21 -14.718 -4.188 9.860
157 HB THR 21 HB THR 21 -14.206 -2.273 8.364
158 HG1 THR 21 HG1 THR 21 -14.725 -3.678 6.252
159 HG21 THR 21 HG21 THR 21 -11.860 -2.725 7.877
160 HG22 THR 21 HG22 THR 21 -12.768 -2.573 6.370
161 HG23 THR 21 HG23 THR 21 -12.295 -4.168 6.965
162 H ASP 22 HN ASP 22 -14.742 -5.713 7.562
163 HA ASP 22 HA ASP 22 -13.477 -8.066 8.516
164 HB2 ASP 22 HB2 ASP 22 -14.557 -9.122 6.471
165 HB3 ASP 22 HB1 ASP 22 -15.654 -8.472 7.680
166 H GLY 23 HN GLY 23 -11.636 -8.782 8.032
167 HA2 GLY 23 HA2 GLY 23 -9.824 -7.221 6.501
168 HA3 GLY 23 HA1 GLY 23 -9.473 -8.727 7.318
169 H THR 24 HN THR 24 -11.974 -9.416 5.388
170 HA THR 24 HA THR 24 -12.278 -10.660 3.541
171 HB THR 24 HB THR 24 -12.119 -8.291 2.598
172 HG1 THR 24 HG1 THR 24 -12.841 -9.307 1.023
173 HG21 THR 24 HG21 THR 24 -9.708 -7.892 2.814
174 HG22 THR 24 HG22 THR 24 -10.213 -7.725 1.125
175 HG23 THR 24 HG23 THR 24 -9.377 -9.183 1.662
176 H ASP 25 HN ASP 25 -10.566 -11.143 1.329
177 HA ASP 25 HA ASP 25 -8.931 -13.250 2.527
178 HB2 ASP 25 HB2 ASP 25 -9.528 -12.688 -0.397
179 HB3 ASP 25 HB1 ASP 25 -8.576 -14.048 0.190
180 H LEU 26 HN LEU 26 -7.896 -11.019 3.269
181 HA LEU 26 HA LEU 26 -5.886 -10.002 1.457
182 HB2 LEU 26 HB2 LEU 26 -7.138 -8.934 3.574
183 HB3 LEU 26 HB1 LEU 26 -5.738 -9.578 4.403
184 HG LEU 26 HG LEU 26 -4.300 -8.272 2.828
185 HD11 LEU 26 HD11 LEU 26 -5.882 -8.041 1.012
186 HD12 LEU 26 HD12 LEU 26 -5.394 -6.447 1.574
187 HD13 LEU 26 HD13 LEU 26 -6.968 -7.113 2.041
188 HD21 LEU 26 HD21 LEU 26 -6.289 -6.710 4.475
189 HD22 LEU 26 HD22 LEU 26 -4.701 -6.136 3.952
190 HD23 LEU 26 HD23 LEU 26 -4.825 -7.474 5.098
191 H SER 27 HN SER 27 -6.292 -12.505 3.660
192 HA SER 27 HA SER 27 -3.453 -13.151 3.826
193 HB2 SER 27 HB2 SER 27 -5.798 -14.481 5.169
194 HB3 SER 27 HB1 SER 27 -4.093 -14.553 5.639
195 HG SER 27 HG SER 27 -5.906 -13.009 6.562
196 H GLY 28 HN GLY 28 -2.872 -14.485 2.165
197 HA2 GLY 28 HA2 GLY 28 -3.185 -16.800 1.340
198 HA3 GLY 28 HA1 GLY 28 -4.903 -16.421 1.261
199 H ASP 29 HN ASP 29 -2.150 -14.513 0.343
200 HA ASP 29 HA ASP 29 -1.352 -13.678 -1.538
201 HB2 ASP 29 HB2 ASP 29 -1.314 -15.817 -2.610
202 HB3 ASP 29 HB1 ASP 29 -3.038 -15.760 -2.941
203 H PHE 30 HN PHE 30 -1.720 -11.737 -2.018
204 HA PHE 30 HA PHE 30 -4.309 -10.953 -3.137
205 HB2 PHE 30 HB2 PHE 30 -4.656 -9.165 -1.559
206 HB3 PHE 30 HB1 PHE 30 -4.400 -10.630 -0.630
207 HD1 PHE 30 HD2 PHE 30 -1.911 -11.041 0.136
208 HD2 PHE 30 HD1 PHE 30 -3.486 -7.233 -0.951
209 HE1 PHE 30 HE2 PHE 30 -0.140 -9.945 1.422
210 HE2 PHE 30 HE1 PHE 30 -1.705 -6.135 0.324
211 HZ PHE 30 HZ PHE 30 -0.038 -7.422 1.472
212 H LEU 31 HN LEU 31 -1.239 -11.127 -3.703
213 HA LEU 31 HA LEU 31 -0.227 -8.492 -3.901
214 HB2 LEU 31 HB2 LEU 31 1.204 -10.489 -3.830
215 HB3 LEU 31 HB1 LEU 31 0.647 -10.952 -5.424
216 HG LEU 31 HG LEU 31 1.678 -8.905 -6.354
217 HD11 LEU 31 HD11 LEU 31 1.555 -7.507 -4.370
218 HD12 LEU 31 HD12 LEU 31 3.214 -7.599 -4.969
219 HD13 LEU 31 HD13 LEU 31 2.737 -8.541 -3.555
220 HD21 LEU 31 HD21 LEU 31 4.011 -9.643 -6.100
221 HD22 LEU 31 HD22 LEU 31 2.922 -10.999 -6.364
222 HD23 LEU 31 HD23 LEU 31 3.536 -10.663 -4.744
223 H ASP 32 HN ASP 32 -1.895 -10.558 -6.216
224 HA ASP 32 HA ASP 32 -1.846 -8.359 -8.140
225 HB2 ASP 32 HB2 ASP 32 -2.363 -11.306 -8.513
226 HB3 ASP 32 HB1 ASP 32 -2.582 -10.098 -9.775
227 H LEU 33 HN LEU 33 -3.640 -9.162 -5.722
228 HA LEU 33 HA LEU 33 -6.228 -9.280 -6.988
229 HB2 LEU 33 HB2 LEU 33 -5.720 -10.361 -4.764
230 HB3 LEU 33 HB1 LEU 33 -5.506 -8.762 -4.087
231 HG LEU 33 HG LEU 33 -7.877 -8.269 -4.491
232 HD11 LEU 33 HD11 LEU 33 -8.010 -11.119 -5.482
233 HD12 LEU 33 HD12 LEU 33 -8.223 -9.665 -6.462
234 HD13 LEU 33 HD13 LEU 33 -9.397 -10.060 -5.208
235 HD21 LEU 33 HD21 LEU 33 -7.405 -10.869 -3.038
236 HD22 LEU 33 HD22 LEU 33 -8.790 -9.800 -2.815
237 HD23 LEU 33 HD23 LEU 33 -7.177 -9.257 -2.366
238 H ARG 34 HN ARG 34 -7.795 -7.421 -6.488
239 HA ARG 34 HA ARG 34 -6.216 -5.002 -7.016
240 HB2 ARG 34 HB2 ARG 34 -9.071 -5.656 -7.761
241 HB3 ARG 34 HB1 ARG 34 -8.341 -4.083 -7.989
242 HG2 ARG 34 HG2 ARG 34 -8.395 -5.259 -10.089
243 HG3 ARG 34 HG1 ARG 34 -6.725 -5.095 -9.570
244 HD2 ARG 34 HD2 ARG 34 -7.191 -7.315 -10.528
245 HD3 ARG 34 HD1 ARG 34 -6.716 -7.429 -8.839
246 HE ARG 34 HE ARG 34 -9.412 -7.336 -8.681
247 HH11 ARG 34 HH11 ARG 34 -7.202 -9.505 -10.511
248 HH12 ARG 34 HH12 ARG 34 -8.355 -10.760 -10.505
249 HH21 ARG 34 HH21 ARG 34 -10.860 -9.075 -8.721
250 HH22 ARG 34 HH22 ARG 34 -10.442 -10.539 -9.470
251 H PHE 35 HN PHE 35 -6.664 -3.075 -5.986
252 HA PHE 35 HA PHE 35 -7.651 -3.212 -3.343
253 HB2 PHE 35 HB2 PHE 35 -7.162 -0.838 -5.146
254 HB3 PHE 35 HB1 PHE 35 -7.748 -0.656 -3.499
255 HD1 PHE 35 HD2 PHE 35 -6.265 -1.565 -1.630
256 HD2 PHE 35 HD1 PHE 35 -4.921 -1.042 -5.622
257 HE1 PHE 35 HE2 PHE 35 -3.930 -1.630 -0.845
258 HE2 PHE 35 HE1 PHE 35 -2.579 -1.114 -4.850
259 HZ PHE 35 HZ PHE 35 -2.109 -1.286 -2.392
260 H GLU 36 HN GLU 36 -9.129 -2.695 -6.353
261 HA GLU 36 HA GLU 36 -11.588 -1.539 -5.695
262 HB2 GLU 36 HB2 GLU 36 -11.198 -3.650 -7.818
263 HB3 GLU 36 HB1 GLU 36 -12.368 -2.345 -7.790
264 HG2 GLU 36 HG2 GLU 36 -9.399 -2.093 -8.180
265 HG3 GLU 36 HG1 GLU 36 -10.647 -1.892 -9.407
266 H ASP 37 HN ASP 37 -10.397 -4.830 -5.515
267 HA ASP 37 HA ASP 37 -12.980 -6.021 -5.012
268 HB2 ASP 37 HB2 ASP 37 -10.178 -7.134 -4.953
269 HB3 ASP 37 HB1 ASP 37 -11.599 -8.088 -4.550
270 H ILE 38 HN ILE 38 -10.207 -4.978 -3.188
271 HA ILE 38 HA ILE 38 -11.285 -6.199 -0.808
272 HB ILE 38 HB ILE 38 -9.191 -5.505 0.334
273 HG12 ILE 38 HG12 ILE 38 -8.412 -4.499 -2.418
274 HG13 ILE 38 HG11 ILE 38 -8.713 -3.480 -1.016
275 HG21 ILE 38 HG21 ILE 38 -7.727 -7.055 -0.895
276 HG22 ILE 38 HG22 ILE 38 -8.816 -6.984 -2.272
277 HG23 ILE 38 HG23 ILE 38 -9.368 -7.684 -0.748
278 HD11 ILE 38 HD11 ILE 38 -6.798 -4.502 0.118
279 HD12 ILE 38 HD12 ILE 38 -6.334 -3.745 -1.410
280 HD13 ILE 38 HD13 ILE 38 -6.489 -5.499 -1.304
281 H GLY 39 HN GLY 39 -12.207 -3.670 -2.250
282 HA2 GLY 39 HA2 GLY 39 -13.530 -1.883 -1.694
283 HA3 GLY 39 HA1 GLY 39 -13.733 -2.686 -0.153
284 H TYR 40 HN TYR 40 -10.705 -1.370 -1.375
285 HA TYR 40 HA TYR 40 -10.546 0.220 1.028
286 HB2 TYR 40 HB2 TYR 40 -8.587 -0.530 -1.060
287 HB3 TYR 40 HB1 TYR 40 -8.307 0.984 -0.206
288 HD1 TYR 40 HD2 TYR 40 -9.167 -2.571 0.544
289 HD2 TYR 40 HD1 TYR 40 -7.047 0.915 1.722
290 HE1 TYR 40 HE2 TYR 40 -8.196 -3.812 2.425
291 HE2 TYR 40 HE1 TYR 40 -6.072 -0.300 3.612
292 HH TYR 40 HH TYR 40 -6.436 -2.262 4.955
293 H ASP 41 HN ASP 41 -10.443 2.360 1.232
294 HA ASP 41 HA ASP 41 -11.688 3.900 -0.908
295 HB2 ASP 41 HB2 ASP 41 -12.382 4.092 1.612
296 HB3 ASP 41 HB1 ASP 41 -10.790 4.858 1.774
297 H SER 42 HN SER 42 -10.689 6.177 -0.951
298 HA SER 42 HA SER 42 -8.024 5.878 -1.961
299 HB2 SER 42 HB2 SER 42 -9.731 7.291 -3.075
300 HB3 SER 42 HB1 SER 42 -9.738 8.349 -1.664
301 H LEU 43 HN LEU 43 -9.678 7.463 0.743
302 HA LEU 43 HA LEU 43 -7.421 8.786 1.813
303 HB2 LEU 43 HB2 LEU 43 -9.905 7.792 3.218
304 HB3 LEU 43 HB1 LEU 43 -8.728 8.887 3.916
305 HG LEU 43 HG LEU 43 -10.516 9.472 1.552
306 HD11 LEU 43 HD11 LEU 43 -11.701 9.392 3.682
307 HD12 LEU 43 HD12 LEU 43 -11.602 11.044 3.069
308 HD13 LEU 43 HD13 LEU 43 -10.537 10.523 4.374
309 HD21 LEU 43 HD21 LEU 43 -8.324 10.584 1.402
310 HD22 LEU 43 HD22 LEU 43 -8.575 11.274 3.009
311 HD23 LEU 43 HD23 LEU 43 -9.633 11.733 1.671
312 H ALA 44 HN ALA 44 -8.866 5.683 2.306
313 HA ALA 44 HA ALA 44 -7.287 4.741 4.411
314 HB1 ALA 44 HB1 ALA 44 -8.031 2.513 3.753
315 HB2 ALA 44 HB2 ALA 44 -8.583 3.141 2.201
316 HB3 ALA 44 HB3 ALA 44 -9.368 3.658 3.691
317 H LEU 45 HN LEU 45 -6.785 4.638 0.886
318 HA LEU 45 HA LEU 45 -4.427 3.082 1.076
319 HB2 LEU 45 HB2 LEU 45 -5.883 3.179 -0.889
320 HB3 LEU 45 HB1 LEU 45 -5.382 4.829 -1.168
321 HG LEU 45 HG LEU 45 -3.422 4.179 -2.213
322 HD11 LEU 45 HD11 LEU 45 -3.382 1.646 -0.522
323 HD12 LEU 45 HD12 LEU 45 -2.475 3.119 -0.145
324 HD13 LEU 45 HD13 LEU 45 -2.120 2.225 -1.620
325 HD21 LEU 45 HD21 LEU 45 -4.968 1.718 -2.098
326 HD22 LEU 45 HD22 LEU 45 -3.752 2.076 -3.345
327 HD23 LEU 45 HD23 LEU 45 -5.279 3.008 -3.269
328 H MET 46 HN MET 46 -5.097 6.554 1.091
329 HA MET 46 HA MET 46 -2.434 7.560 0.835
330 HB2 MET 46 HB2 MET 46 -4.381 8.721 2.832
331 HB3 MET 46 HB1 MET 46 -3.125 9.548 1.933
332 HG2 MET 46 HG2 MET 46 -4.505 9.073 -0.112
333 HG3 MET 46 HG1 MET 46 -5.707 8.499 1.048
334 HE1 MET 46 HE1 MET 46 -3.263 11.527 1.673
335 HE2 MET 46 HE2 MET 46 -4.224 12.893 1.099
336 HE3 MET 46 HE3 MET 46 -3.628 11.688 -0.047
337 H GLU 47 HN GLU 47 -4.412 6.663 3.498
338 HA GLU 47 HA GLU 47 -2.644 6.968 5.598
339 HB2 GLU 47 HB2 GLU 47 -5.174 5.767 4.954
340 HB3 GLU 47 HB1 GLU 47 -4.577 5.287 6.575
341 HG2 GLU 47 HG2 GLU 47 -4.423 7.813 6.948
342 HG3 GLU 47 HG1 GLU 47 -5.240 8.007 5.404
343 H THR 48 HN THR 48 -3.332 4.090 3.607
344 HA THR 48 HA THR 48 -1.675 2.213 4.838
345 HB THR 48 HB THR 48 -2.144 2.686 1.874
346 HG1 THR 48 HG1 THR 48 -3.624 1.396 3.882
347 HG21 THR 48 HG21 THR 48 -0.228 1.158 2.379
348 HG22 THR 48 HG22 THR 48 -1.556 0.393 1.518
349 HG23 THR 48 HG23 THR 48 -1.354 0.104 3.252
350 H ALA 49 HN ALA 49 -0.955 4.370 2.109
351 HA ALA 49 HA ALA 49 1.743 3.797 1.858
352 HB1 ALA 49 HB1 ALA 49 1.881 5.802 0.492
353 HB2 ALA 49 HB2 ALA 49 0.329 6.351 1.122
354 HB3 ALA 49 HB3 ALA 49 0.410 4.898 0.119
355 H ALA 50 HN ALA 50 0.132 6.443 3.606
356 HA ALA 50 HA ALA 50 2.321 7.944 4.404
357 HB1 ALA 50 HB1 ALA 50 0.901 8.835 6.161
358 HB2 ALA 50 HB2 ALA 50 -0.216 7.490 5.962
359 HB3 ALA 50 HB3 ALA 50 -0.002 8.660 4.658
360 H ARG 51 HN ARG 51 0.937 5.122 5.912
361 HA ARG 51 HA ARG 51 2.488 5.250 8.228
362 HB2 ARG 51 HB2 ARG 51 0.479 3.935 8.228
363 HB3 ARG 51 HB1 ARG 51 1.037 2.977 6.878
364 HG2 ARG 51 HG2 ARG 51 1.047 1.692 8.941
365 HG3 ARG 51 HG1 ARG 51 2.681 1.891 8.324
366 HD2 ARG 51 HD2 ARG 51 3.238 3.417 10.032
367 HD3 ARG 51 HD1 ARG 51 1.556 3.704 10.473
368 HE ARG 51 HE ARG 51 1.877 1.057 10.861
369 HH11 ARG 51 HH11 ARG 51 3.936 3.727 11.965
370 HH12 ARG 51 HH12 ARG 51 4.120 3.118 13.548
371 HH21 ARG 51 HH21 ARG 51 2.030 0.276 12.998
372 HH22 ARG 51 HH22 ARG 51 2.988 1.068 14.183
373 H LEU 52 HN LEU 52 2.892 3.570 5.181
374 HA LEU 52 HA LEU 52 5.358 2.320 5.819
375 HB2 LEU 52 HB2 LEU 52 4.181 3.109 3.148
376 HB3 LEU 52 HB1 LEU 52 5.584 2.087 3.345
377 HG LEU 52 HG LEU 52 2.787 1.364 4.295
378 HD11 LEU 52 HD11 LEU 52 4.360 0.405 1.930
379 HD12 LEU 52 HD12 LEU 52 2.920 1.417 1.886
380 HD13 LEU 52 HD13 LEU 52 2.822 -0.237 2.489
381 HD21 LEU 52 HD21 LEU 52 5.338 -0.252 4.163
382 HD22 LEU 52 HD22 LEU 52 3.754 -0.824 4.682
383 HD23 LEU 52 HD23 LEU 52 4.612 0.383 5.639
384 H GLU 53 HN GLU 53 4.448 5.377 4.352
385 HA GLU 53 HA GLU 53 6.949 6.326 3.599
386 HB2 GLU 53 HB2 GLU 53 4.500 7.896 4.446
387 HB3 GLU 53 HB1 GLU 53 5.915 8.589 3.676
388 HG2 GLU 53 HG2 GLU 53 5.507 7.244 1.684
389 HG3 GLU 53 HG1 GLU 53 4.096 6.522 2.448
390 H SER 54 HN SER 54 5.182 6.996 6.681
391 HA SER 54 HA SER 54 7.393 8.540 7.593
392 HB2 SER 54 HB2 SER 54 4.959 7.540 9.075
393 HB3 SER 54 HB1 SER 54 6.070 8.786 9.638
394 HG SER 54 HG SER 54 5.459 9.634 7.317
395 H ARG 55 HN ARG 55 6.431 5.202 7.925
396 HA ARG 55 HA ARG 55 8.044 4.760 10.252
397 HB2 ARG 55 HB2 ARG 55 5.968 3.511 9.774
398 HB3 ARG 55 HB1 ARG 55 6.768 2.743 8.415
399 HG2 ARG 55 HG2 ARG 55 8.346 1.691 9.941
400 HG3 ARG 55 HG1 ARG 55 7.563 2.495 11.310
401 HD2 ARG 55 HD2 ARG 55 5.431 1.363 10.658
402 HD3 ARG 55 HD1 ARG 55 6.345 0.470 9.445
403 HE ARG 55 HE ARG 55 7.734 -0.035 11.641
404 HH11 ARG 55 HH11 ARG 55 4.225 -0.402 10.915
405 HH12 ARG 55 HH12 ARG 55 4.007 -1.540 12.163
406 HH21 ARG 55 HH21 ARG 55 7.301 -1.619 13.341
407 HH22 ARG 55 HH22 ARG 55 5.711 -2.255 13.482
408 H TYR 56 HN TYR 56 8.399 4.048 6.775
409 HA TYR 56 HA TYR 56 11.040 2.976 7.391
410 HB2 TYR 56 HB2 TYR 56 9.415 2.794 4.851
411 HB3 TYR 56 HB1 TYR 56 11.019 2.086 5.066
412 HD1 TYR 56 HD1 TYR 56 11.335 0.235 6.681
413 HD2 TYR 56 HD2 TYR 56 7.478 1.759 5.757
414 HE1 TYR 56 HE1 TYR 56 10.320 -1.811 7.578
415 HE2 TYR 56 HE2 TYR 56 6.446 -0.284 6.668
416 HH TYR 56 HH TYR 56 7.069 -2.597 7.036
417 H GLY 57 HN GLY 57 9.707 5.857 6.508
418 HA2 GLY 57 HA2 GLY 57 10.817 7.838 6.096
419 HA3 GLY 57 HA1 GLY 57 12.315 6.920 5.974
420 H VAL 58 HN VAL 58 9.250 6.963 4.190
421 HA VAL 58 HA VAL 58 10.762 7.528 1.757
422 HB VAL 58 HB VAL 58 9.486 5.935 0.405
423 HG11 VAL 58 HG11 VAL 58 10.679 4.595 2.800
424 HG12 VAL 58 HG12 VAL 58 11.555 5.128 1.359
425 HG13 VAL 58 HG13 VAL 58 10.378 3.816 1.245
426 HG21 VAL 58 HG21 VAL 58 7.983 4.272 1.389
427 HG22 VAL 58 HG22 VAL 58 7.393 5.908 1.685
428 HG23 VAL 58 HG23 VAL 58 8.191 5.012 2.975
429 H SER 59 HN SER 59 8.823 7.833 -0.108
430 HA SER 59 HA SER 59 6.571 9.204 1.018
431 HB2 SER 59 HB2 SER 59 8.372 10.918 1.067
432 HB3 SER 59 HB1 SER 59 8.605 10.707 -0.664
433 HG SER 59 HG SER 59 6.265 11.660 0.648
434 H ILE 60 HN ILE 60 4.900 9.149 -0.331
435 HA ILE 60 HA ILE 60 5.299 8.493 -3.181
436 HB ILE 60 HB ILE 60 3.073 7.458 -1.378
437 HG12 ILE 60 HG12 ILE 60 5.274 5.925 -2.783
438 HG13 ILE 60 HG11 ILE 60 5.169 6.208 -1.049
439 HG21 ILE 60 HG21 ILE 60 2.278 6.220 -3.357
440 HG22 ILE 60 HG22 ILE 60 3.527 7.002 -4.332
441 HG23 ILE 60 HG23 ILE 60 2.245 7.968 -3.603
442 HD11 ILE 60 HD11 ILE 60 4.439 3.968 -1.608
443 HD12 ILE 60 HD12 ILE 60 3.235 4.617 -2.721
444 HD13 ILE 60 HD13 ILE 60 3.081 4.912 -0.989
445 HA PRO 61 HA PRO 61 2.903 12.296 -3.466
446 HB2 PRO 61 HB2 PRO 61 2.441 11.320 -6.235
447 HB3 PRO 61 HB1 PRO 61 3.121 12.858 -5.683
448 HG2 PRO 61 HG2 PRO 61 4.671 10.985 -6.772
449 HG3 PRO 61 HG1 PRO 61 5.243 11.985 -5.420
450 HD2 PRO 61 HD2 PRO 61 4.257 9.164 -5.418
451 HD3 PRO 61 HD1 PRO 61 5.610 9.874 -4.523
452 H ASP 62 HN ASP 62 0.800 12.624 -3.100
453 HA ASP 62 HA ASP 62 -0.955 10.562 -2.519
454 HB2 ASP 62 HB2 ASP 62 -2.740 12.233 -2.299
455 HB3 ASP 62 HB1 ASP 62 -1.256 12.777 -1.529
456 H ASP 63 HN ASP 63 -0.495 12.124 -5.583
457 HA ASP 63 HA ASP 63 -2.957 11.328 -6.718
458 HB2 ASP 63 HB2 ASP 63 -2.147 12.108 -8.793
459 HB3 ASP 63 HB1 ASP 63 -1.374 13.144 -7.606
460 H VAL 64 HN VAL 64 0.174 9.780 -6.382
461 HA VAL 64 HA VAL 64 -0.380 7.801 -8.375
462 HB VAL 64 HB VAL 64 1.804 7.578 -6.301
463 HG11 VAL 64 HG11 VAL 64 1.441 5.628 -7.695
464 HG12 VAL 64 HG12 VAL 64 2.992 6.383 -8.066
465 HG13 VAL 64 HG13 VAL 64 1.614 6.614 -9.146
466 HG21 VAL 64 HG21 VAL 64 3.290 8.796 -7.818
467 HG22 VAL 64 HG22 VAL 64 1.966 9.812 -7.249
468 HG23 VAL 64 HG23 VAL 64 1.921 9.132 -8.876
469 H ALA 65 HN ALA 65 -0.882 8.117 -4.977
470 HA ALA 65 HA ALA 65 -1.193 5.402 -4.318
471 HB1 ALA 65 HB1 ALA 65 -0.939 7.165 -2.627
472 HB2 ALA 65 HB2 ALA 65 -2.403 6.219 -2.349
473 HB3 ALA 65 HB3 ALA 65 -2.517 7.825 -3.077
474 H GLY 66 HN GLY 66 -3.283 7.751 -5.832
475 HA2 GLY 66 HA2 GLY 66 -5.579 5.935 -5.742
476 HA3 GLY 66 HA1 GLY 66 -5.571 7.593 -6.348
477 H ARG 67 HN ARG 67 -2.896 6.072 -7.505
478 HA ARG 67 HA ARG 67 -4.218 5.527 -10.059
479 HB2 ARG 67 HB2 ARG 67 -1.523 6.657 -9.395
480 HB3 ARG 67 HB1 ARG 67 -1.828 5.915 -10.957
481 HG2 ARG 67 HG2 ARG 67 -3.501 7.546 -11.474
482 HG3 ARG 67 HG1 ARG 67 -3.436 8.200 -9.831
483 HD2 ARG 67 HD2 ARG 67 -2.218 9.581 -11.506
484 HD3 ARG 67 HD1 ARG 67 -1.207 9.015 -10.177
485 HE ARG 67 HE ARG 67 -1.236 7.572 -12.726
486 HH11 ARG 67 HH11 ARG 67 0.546 9.736 -10.507
487 HH12 ARG 67 HH12 ARG 67 2.071 9.213 -11.051
488 HH21 ARG 67 HH21 ARG 67 0.897 6.952 -13.527
489 HH22 ARG 67 HH22 ARG 67 2.286 7.572 -12.787
490 H VAL 68 HN VAL 68 -3.333 3.795 -7.576
491 HA VAL 68 HA VAL 68 -2.036 1.856 -9.281
492 HB VAL 68 HB VAL 68 -1.331 0.578 -7.269
493 HG11 VAL 68 HG11 VAL 68 -0.421 3.445 -7.408
494 HG12 VAL 68 HG12 VAL 68 0.203 2.097 -8.348
495 HG13 VAL 68 HG13 VAL 68 0.444 2.142 -6.596
496 HG21 VAL 68 HG21 VAL 68 -2.342 2.986 -5.752
497 HG22 VAL 68 HG22 VAL 68 -1.340 1.698 -5.093
498 HG23 VAL 68 HG23 VAL 68 -2.980 1.336 -5.645
499 H ASP 69 HN ASP 69 -2.679 -0.353 -9.195
500 HA ASP 69 HA ASP 69 -5.616 -0.570 -8.827
501 HB2 ASP 69 HB2 ASP 69 -4.680 -0.855 -11.195
502 HB3 ASP 69 HB1 ASP 69 -3.834 -2.252 -10.593
503 H THR 70 HN THR 70 -2.636 -2.499 -8.712
504 HA THR 70 HA THR 70 -3.893 -4.234 -6.768
505 HB THR 70 HB THR 70 -2.254 -5.926 -7.639
506 HG1 THR 70 HG1 THR 70 -1.421 -5.211 -9.812
507 HG21 THR 70 HG21 THR 70 -3.963 -4.607 -9.757
508 HG22 THR 70 HG22 THR 70 -4.526 -5.787 -8.572
509 HG23 THR 70 HG23 THR 70 -3.360 -6.269 -9.810
510 HA PRO 71 HA PRO 71 -1.119 -2.961 -3.552
511 HB2 PRO 71 HB2 PRO 71 -0.415 -5.854 -3.289
512 HB3 PRO 71 HB1 PRO 71 -0.902 -4.694 -2.046
513 HG2 PRO 71 HG2 PRO 71 -2.656 -6.430 -2.906
514 HG3 PRO 71 HG1 PRO 71 -3.143 -4.736 -2.709
515 HD2 PRO 71 HD2 PRO 71 -2.461 -6.219 -5.208
516 HD3 PRO 71 HD1 PRO 71 -3.771 -5.057 -4.908
517 H ARG 72 HN ARG 72 0.162 -5.258 -5.867
518 HA ARG 72 HA ARG 72 2.882 -5.056 -5.221
519 HB2 ARG 72 HB2 ARG 72 3.339 -5.951 -7.458
520 HB3 ARG 72 HB1 ARG 72 2.054 -6.821 -6.633
521 HG2 ARG 72 HG2 ARG 72 0.400 -5.570 -7.969
522 HG3 ARG 72 HG1 ARG 72 1.734 -4.800 -8.836
523 HD2 ARG 72 HD2 ARG 72 1.146 -7.743 -8.706
524 HD3 ARG 72 HD1 ARG 72 0.843 -6.696 -10.084
525 HE ARG 72 HE ARG 72 3.374 -6.283 -9.872
526 HH11 ARG 72 HH11 ARG 72 1.687 -9.398 -9.468
527 HH12 ARG 72 HH12 ARG 72 3.031 -10.351 -9.840
528 HH21 ARG 72 HH21 ARG 72 5.244 -7.644 -10.548
529 HH22 ARG 72 HH22 ARG 72 5.090 -9.325 -10.540
530 H GLU 73 HN GLU 73 0.851 -2.927 -7.067
531 HA GLU 73 HA GLU 73 3.000 -1.506 -8.296
532 HB2 GLU 73 HB2 GLU 73 0.121 -0.691 -7.897
533 HB3 GLU 73 HB1 GLU 73 1.247 0.034 -9.025
534 HG2 GLU 73 HG2 GLU 73 0.261 -2.809 -9.114
535 HG3 GLU 73 HG1 GLU 73 -0.308 -1.485 -10.133
536 H LEU 74 HN LEU 74 0.903 -1.059 -5.530
537 HA LEU 74 HA LEU 74 1.792 1.500 -4.672
538 HB2 LEU 74 HB2 LEU 74 -0.272 0.094 -3.921
539 HB3 LEU 74 HB1 LEU 74 0.934 -0.737 -2.932
540 HG LEU 74 HG LEU 74 -0.561 1.024 -1.773
541 HD11 LEU 74 HD11 LEU 74 1.384 0.100 -0.657
542 HD12 LEU 74 HD12 LEU 74 1.226 1.821 -0.310
543 HD13 LEU 74 HD13 LEU 74 2.420 1.260 -1.486
544 HD21 LEU 74 HD21 LEU 74 1.330 2.875 -3.206
545 HD22 LEU 74 HD22 LEU 74 0.234 3.338 -1.912
546 HD23 LEU 74 HD23 LEU 74 -0.413 2.756 -3.452
547 H LEU 75 HN LEU 75 2.685 -1.801 -3.898
548 HA LEU 75 HA LEU 75 4.562 -1.300 -1.931
549 HB2 LEU 75 HB2 LEU 75 3.486 -3.412 -2.311
550 HB3 LEU 75 HB1 LEU 75 4.224 -3.533 -3.895
551 HG LEU 75 HG LEU 75 6.375 -3.545 -2.801
552 HD11 LEU 75 HD11 LEU 75 6.472 -4.178 -0.391
553 HD12 LEU 75 HD12 LEU 75 4.733 -3.935 -0.284
554 HD13 LEU 75 HD13 LEU 75 5.799 -2.570 -0.644
555 HD21 LEU 75 HD21 LEU 75 5.351 -5.491 -3.653
556 HD22 LEU 75 HD22 LEU 75 4.434 -5.733 -2.167
557 HD23 LEU 75 HD23 LEU 75 6.199 -5.930 -2.164
558 H ASP 76 HN ASP 76 4.834 -1.470 -5.471
559 HA ASP 76 HA ASP 76 7.677 -1.402 -5.554
560 HB2 ASP 76 HB2 ASP 76 6.275 -2.115 -7.500
561 HB3 ASP 76 HB1 ASP 76 5.784 -0.429 -7.699
562 H LEU 77 HN LEU 77 5.185 1.046 -5.455
563 HA LEU 77 HA LEU 77 6.776 3.305 -5.942
564 HB2 LEU 77 HB2 LEU 77 4.417 3.030 -4.087
565 HB3 LEU 77 HB1 LEU 77 5.038 4.534 -4.732
566 HG LEU 77 HG LEU 77 3.798 2.319 -6.339
567 HD11 LEU 77 HD11 LEU 77 2.685 5.003 -5.532
568 HD12 LEU 77 HD12 LEU 77 2.170 3.430 -4.914
569 HD13 LEU 77 HD13 LEU 77 1.901 3.839 -6.605
570 HD21 LEU 77 HD21 LEU 77 5.457 3.590 -7.607
571 HD22 LEU 77 HD22 LEU 77 4.648 5.100 -7.161
572 HD23 LEU 77 HD23 LEU 77 3.822 3.923 -8.179
573 H ILE 78 HN ILE 78 6.111 1.463 -3.062
574 HA ILE 78 HA ILE 78 7.600 3.034 -1.239
575 HB ILE 78 HB ILE 78 6.815 0.099 -1.133
576 HG12 ILE 78 HG12 ILE 78 4.933 1.667 -1.183
577 HG13 ILE 78 HG11 ILE 78 5.050 0.852 0.376
578 HG21 ILE 78 HG21 ILE 78 8.725 0.447 0.304
579 HG22 ILE 78 HG22 ILE 78 7.271 0.180 1.268
580 HG23 ILE 78 HG23 ILE 78 7.922 1.814 1.087
581 HD11 ILE 78 HD11 ILE 78 5.974 3.651 -0.241
582 HD12 ILE 78 HD12 ILE 78 6.099 2.848 1.325
583 HD13 ILE 78 HD13 ILE 78 4.510 3.214 0.636
584 H ASN 79 HN ASN 79 8.289 -0.040 -2.858
585 HA ASN 79 HA ASN 79 10.896 -0.541 -2.118
586 HB2 ASN 79 HB2 ASN 79 9.672 -1.000 -4.854
587 HB3 ASN 79 HB1 ASN 79 11.192 -1.681 -4.326
588 HD21 ASN 79 HD21 ASN 79 10.176 -2.241 -1.616
589 HD22 ASN 79 HD22 ASN 79 9.132 -3.611 -1.813
590 H GLY 80 HN GLY 80 9.844 1.384 -4.897
591 HA2 GLY 80 HA2 GLY 80 12.316 2.109 -5.904
592 HA3 GLY 80 HA1 GLY 80 10.836 3.024 -6.089
593 H ALA 81 HN ALA 81 10.306 3.843 -3.553
594 HA ALA 81 HA ALA 81 12.162 6.004 -3.308
595 HB1 ALA 81 HB1 ALA 81 10.694 6.841 -1.572
596 HB2 ALA 81 HB2 ALA 81 9.859 5.293 -1.496
597 HB3 ALA 81 HB3 ALA 81 9.732 6.287 -2.947
598 H LEU 82 HN LEU 82 11.760 2.942 -1.717
599 HA LEU 82 HA LEU 82 13.157 3.594 0.648
600 HB2 LEU 82 HB2 LEU 82 11.504 1.811 0.533
601 HB3 LEU 82 HB1 LEU 82 12.494 0.954 -0.638
602 HG LEU 82 HG LEU 82 14.245 0.803 1.048
603 HD11 LEU 82 HD11 LEU 82 13.631 2.621 2.515
604 HD12 LEU 82 HD12 LEU 82 13.636 1.122 3.444
605 HD13 LEU 82 HD13 LEU 82 12.111 1.833 2.923
606 HD21 LEU 82 HD21 LEU 82 12.818 -1.080 0.603
607 HD22 LEU 82 HD22 LEU 82 11.606 -0.459 1.728
608 HD23 LEU 82 HD23 LEU 82 13.168 -1.006 2.332
609 H ALA 83 HN ALA 83 14.025 2.068 -2.427
610 HA ALA 83 HA ALA 83 16.666 1.387 -1.759
611 HB1 ALA 83 HB1 ALA 83 17.047 1.244 -4.168
612 HB2 ALA 83 HB2 ALA 83 15.577 2.162 -4.464
613 HB3 ALA 83 HB3 ALA 83 15.484 0.538 -3.764
614 H GLU 84 HN GLU 84 15.209 4.308 -2.935
615 HA GLU 84 HA GLU 84 17.564 5.807 -3.358
616 HB2 GLU 84 HB2 GLU 84 14.693 6.206 -3.435
617 HB3 GLU 84 HB1 GLU 84 15.509 7.592 -2.739
618 HG2 GLU 84 HG2 GLU 84 15.098 7.700 -5.186
619 HG3 GLU 84 HG1 GLU 84 16.773 7.951 -4.706
620 H ALA 85 HN ALA 85 15.492 5.241 -0.576
621 HA ALA 85 HA ALA 85 16.589 7.249 1.099
622 HB1 ALA 85 HB1 ALA 85 15.411 6.127 2.917
623 HB2 ALA 85 HB2 ALA 85 15.133 4.724 1.888
624 HB3 ALA 85 HB3 ALA 85 14.373 6.273 1.499
625 H ALA 86 HN ALA 86 17.295 3.856 0.600
626 HA ALA 86 HA ALA 86 19.096 2.582 0.930
627 HB1 ALA 86 HB1 ALA 86 21.308 3.540 1.141
628 HB2 ALA 86 HB2 ALA 86 20.616 5.093 1.617
629 HB3 ALA 86 HB3 ALA 86 20.365 4.485 -0.018
630 H28A SDO 101 H28A SDO 42 -9.262 11.371 -2.430
631 H28B SDO 101 H28B SDO 42 -7.895 10.713 -1.523
632 H30A SDO 101 H30A SDO 42 -9.096 13.281 -0.803
633 H30B SDO 101 H30B SDO 42 -7.632 14.262 -0.737
634 H30C SDO 101 H30C SDO 42 -7.623 12.619 -0.088
635 H31A SDO 101 H31A SDO 42 -5.666 13.665 -2.203
636 H31B SDO 101 H31B SDO 42 -5.762 12.226 -3.222
637 H31C SDO 101 H31C SDO 42 -5.706 12.064 -1.472
638 H32A SDO 101 H32A SDO 42 -7.906 13.187 -4.337
639 H33A SDO 101 H33A SDO 42 -8.018 15.583 -2.976
640 H36A SDO 101 H36A SDO 42 -9.364 15.453 -4.548
641 H37A SDO 101 H37A SDO 42 -11.743 15.399 -5.193
642 H37B SDO 101 H37B SDO 42 -12.089 14.756 -3.584
643 H38A SDO 101 H38A SDO 42 -10.938 17.486 -4.177
644 H38B SDO 101 H38B SDO 42 -12.623 17.174 -3.828
645 H41A SDO 101 H41A SDO 42 -11.731 15.056 -1.851
646 H42A SDO 101 H42A SDO 42 -10.162 15.792 0.188
647 H42B SDO 101 H42B SDO 42 -11.683 16.635 0.532
648 H43A SDO 101 H43A SDO 42 -11.364 13.712 -0.002
649 H43B SDO 101 H43B SDO 42 -12.855 14.500 0.488
650 H1A SDO 101 H1A SDO 42 -10.997 15.603 4.131
651 H1B SDO 101 H1B SDO 42 -9.568 14.738 3.627
652 H2A SDO 101 H2A SDO 42 -10.801 17.065 2.201
653 H2B SDO 101 H2B SDO 42 -9.340 16.240 1.730
654 H4A SDO 101 H4A SDO 42 -8.946 18.390 5.398
655 H4B SDO 101 H4B SDO 42 -7.517 17.520 4.913
656 H5A SDO 101 H5A SDO 42 -8.673 15.386 5.250
657 H5B SDO 101 H5B SDO 42 -10.093 16.260 5.815
658 H6A SDO 101 H6A SDO 42 -7.401 16.596 7.103
659 H6B SDO 101 H6B SDO 42 -8.515 15.335 7.596
660 H8A SDO 101 H8A SDO 42 -11.246 17.616 7.954
661 H8B SDO 101 H8B SDO 42 -10.270 18.256 6.621
662 H8C SDO 101 H8C SDO 42 -10.299 19.093 8.179
Start of MODEL 20
1 H1 MET 1 HT1 MET 1 21.375 -7.781 2.098
2 H2 MET 1 HT2 MET 1 20.454 -6.480 1.555
3 H3 MET 1 HT3 MET 1 19.835 -7.489 2.769
4 HA MET 1 HA MET 1 21.528 -6.807 4.278
5 HB2 MET 1 HB2 MET 1 23.309 -6.329 2.685
6 HB3 MET 1 HB1 MET 1 22.385 -4.979 2.029
7 HG2 MET 1 HG2 MET 1 22.620 -3.762 4.098
8 HG3 MET 1 HG1 MET 1 23.426 -5.141 4.854
9 HE1 MET 1 HE1 MET 1 26.806 -5.296 2.909
10 HE2 MET 1 HE2 MET 1 25.328 -6.183 2.552
11 HE3 MET 1 HE3 MET 1 25.850 -5.973 4.225
12 H ALA 2 HN ALA 2 19.990 -4.523 1.979
13 HA ALA 2 HA ALA 2 19.191 -2.800 4.124
14 HB1 ALA 2 HB1 ALA 2 19.656 -1.878 1.910
15 HB2 ALA 2 HB2 ALA 2 17.973 -1.586 2.360
16 HB3 ALA 2 HB3 ALA 2 18.374 -2.873 1.222
17 H THR 3 HN THR 3 17.122 -2.553 4.914
18 HA THR 3 HA THR 3 15.555 -4.943 4.879
19 HB THR 3 HB THR 3 15.013 -2.309 6.289
20 HG1 THR 3 HG1 THR 3 16.808 -4.381 6.628
21 HG21 THR 3 HG21 THR 3 13.126 -3.915 6.312
22 HG22 THR 3 HG22 THR 3 13.848 -3.757 7.918
23 HG23 THR 3 HG23 THR 3 14.210 -5.170 6.921
24 H LEU 4 HN LEU 4 15.251 -4.636 2.544
25 HA LEU 4 HA LEU 4 13.435 -2.704 1.463
26 HB2 LEU 4 HB2 LEU 4 15.219 -4.089 0.243
27 HB3 LEU 4 HB1 LEU 4 14.111 -5.439 0.364
28 HG LEU 4 HG LEU 4 12.473 -4.028 -0.950
29 HD11 LEU 4 HD11 LEU 4 14.936 -2.336 -1.374
30 HD12 LEU 4 HD12 LEU 4 13.472 -1.844 -0.532
31 HD13 LEU 4 HD13 LEU 4 13.418 -2.195 -2.257
32 HD21 LEU 4 HD21 LEU 4 13.740 -5.851 -1.957
33 HD22 LEU 4 HD22 LEU 4 15.102 -4.761 -2.236
34 HD23 LEU 4 HD23 LEU 4 13.575 -4.500 -3.079
35 H LEU 5 HN LEU 5 11.177 -2.987 1.171
36 HA LEU 5 HA LEU 5 10.007 -4.703 3.093
37 HB2 LEU 5 HB2 LEU 5 8.752 -2.949 1.011
38 HB3 LEU 5 HB1 LEU 5 7.815 -3.926 2.110
39 HG LEU 5 HG LEU 5 9.002 -2.644 3.979
40 HD11 LEU 5 HD11 LEU 5 9.766 -0.398 3.420
41 HD12 LEU 5 HD12 LEU 5 9.584 -0.753 1.704
42 HD13 LEU 5 HD13 LEU 5 10.774 -1.625 2.661
43 HD21 LEU 5 HD21 LEU 5 7.371 -0.792 3.756
44 HD22 LEU 5 HD22 LEU 5 6.738 -2.423 3.535
45 HD23 LEU 5 HD23 LEU 5 7.005 -1.399 2.124
46 H THR 6 HN THR 6 8.945 -6.492 2.922
47 HA THR 6 HA THR 6 9.203 -7.957 0.446
48 HB THR 6 HB THR 6 8.613 -9.888 1.883
49 HG1 THR 6 HG1 THR 6 8.781 -9.235 4.287
50 HG21 THR 6 HG21 THR 6 10.864 -8.167 2.962
51 HG22 THR 6 HG22 THR 6 10.986 -9.272 1.593
52 HG23 THR 6 HG23 THR 6 10.701 -9.906 3.217
53 H THR 7 HN THR 7 7.209 -9.696 0.506
54 HA THR 7 HA THR 7 4.851 -8.192 0.023
55 HB THR 7 HB THR 7 5.122 -11.207 0.171
56 HG1 THR 7 HG1 THR 7 5.464 -10.375 -2.325
57 HG21 THR 7 HG21 THR 7 3.434 -9.371 -1.554
58 HG22 THR 7 HG22 THR 7 2.855 -10.276 -0.152
59 HG23 THR 7 HG23 THR 7 3.418 -11.137 -1.585
60 H ASP 8 HN ASP 8 6.298 -9.630 2.713
61 HA ASP 8 HA ASP 8 3.887 -10.234 4.176
62 HB2 ASP 8 HB2 ASP 8 6.798 -10.255 4.991
63 HB3 ASP 8 HB1 ASP 8 5.497 -10.582 6.120
64 H ASP 9 HN ASP 9 6.397 -7.782 4.155
65 HA ASP 9 HA ASP 9 5.564 -6.352 6.429
66 HB2 ASP 9 HB2 ASP 9 7.763 -6.003 5.131
67 HB3 ASP 9 HB1 ASP 9 6.807 -5.056 4.004
68 H LEU 10 HN LEU 10 4.912 -5.816 3.007
69 HA LEU 10 HA LEU 10 3.240 -3.615 3.171
70 HB2 LEU 10 HB2 LEU 10 4.102 -4.491 1.069
71 HB3 LEU 10 HB1 LEU 10 3.093 -5.918 1.240
72 HG LEU 10 HG LEU 10 1.112 -4.332 1.233
73 HD11 LEU 10 HD11 LEU 10 2.246 -2.281 1.692
74 HD12 LEU 10 HD12 LEU 10 1.423 -2.177 0.132
75 HD13 LEU 10 HD13 LEU 10 3.169 -2.412 0.195
76 HD21 LEU 10 HD21 LEU 10 2.787 -4.550 -1.269
77 HD22 LEU 10 HD22 LEU 10 1.057 -4.212 -1.220
78 HD23 LEU 10 HD23 LEU 10 1.670 -5.769 -0.665
79 H ARG 11 HN ARG 11 2.499 -7.035 3.462
80 HA ARG 11 HA ARG 11 -0.286 -6.736 3.395
81 HB2 ARG 11 HB2 ARG 11 0.901 -8.879 2.994
82 HB3 ARG 11 HB1 ARG 11 1.252 -8.971 4.713
83 HG2 ARG 11 HG2 ARG 11 -1.044 -9.201 5.260
84 HG3 ARG 11 HG1 ARG 11 -1.547 -8.794 3.620
85 HD2 ARG 11 HD2 ARG 11 -1.734 -11.155 3.888
86 HD3 ARG 11 HD1 ARG 11 -0.379 -10.828 2.818
87 HE ARG 11 HE ARG 11 -0.226 -11.638 5.618
88 HH11 ARG 11 HH11 ARG 11 1.500 -11.132 2.571
89 HH12 ARG 11 HH12 ARG 11 2.630 -12.378 2.801
90 HH21 ARG 11 HH21 ARG 11 1.306 -13.419 5.942
91 HH22 ARG 11 HH22 ARG 11 2.529 -13.706 4.794
92 H ARG 12 HN ARG 12 2.007 -6.870 6.108
93 HA ARG 12 HA ARG 12 0.104 -6.778 8.168
94 HB2 ARG 12 HB2 ARG 12 2.876 -5.554 8.132
95 HB3 ARG 12 HB1 ARG 12 1.849 -5.632 9.552
96 HG2 ARG 12 HG2 ARG 12 1.940 -8.142 9.337
97 HG3 ARG 12 HG1 ARG 12 3.183 -7.903 8.092
98 HD2 ARG 12 HD2 ARG 12 4.526 -6.606 9.678
99 HD3 ARG 12 HD1 ARG 12 3.294 -6.830 10.912
100 HE ARG 12 HE ARG 12 5.047 -8.922 9.809
101 HH11 ARG 12 HH11 ARG 12 2.781 -7.936 12.434
102 HH12 ARG 12 HH12 ARG 12 3.518 -8.974 13.566
103 HH21 ARG 12 HH21 ARG 12 6.017 -10.323 11.529
104 HH22 ARG 12 HH22 ARG 12 5.311 -10.299 13.070
105 H ALA 13 HN ALA 13 1.703 -4.166 6.432
106 HA ALA 13 HA ALA 13 0.523 -2.067 7.911
107 HB1 ALA 13 HB1 ALA 13 1.395 -0.595 6.202
108 HB2 ALA 13 HB2 ALA 13 1.698 -1.977 5.146
109 HB3 ALA 13 HB3 ALA 13 2.598 -1.804 6.657
110 H LEU 14 HN LEU 14 -0.345 -3.577 4.803
111 HA LEU 14 HA LEU 14 -2.380 -1.824 4.082
112 HB2 LEU 14 HB2 LEU 14 -1.191 -3.634 2.737
113 HB3 LEU 14 HB1 LEU 14 -2.260 -4.784 3.498
114 HG LEU 14 HG LEU 14 -4.186 -3.633 2.454
115 HD11 LEU 14 HD11 LEU 14 -2.053 -2.006 1.072
116 HD12 LEU 14 HD12 LEU 14 -3.200 -1.410 2.268
117 HD13 LEU 14 HD13 LEU 14 -3.776 -1.985 0.706
118 HD21 LEU 14 HD21 LEU 14 -3.156 -5.556 1.348
119 HD22 LEU 14 HD22 LEU 14 -2.004 -4.483 0.554
120 HD23 LEU 14 HD23 LEU 14 -3.722 -4.378 0.161
121 H VAL 15 HN VAL 15 -2.427 -4.713 6.156
122 HA VAL 15 HA VAL 15 -5.204 -4.967 6.605
123 HB VAL 15 HB VAL 15 -2.949 -5.604 8.552
124 HG11 VAL 15 HG11 VAL 15 -4.536 -7.193 9.582
125 HG12 VAL 15 HG12 VAL 15 -5.816 -6.550 8.550
126 HG13 VAL 15 HG13 VAL 15 -5.039 -5.512 9.744
127 HG21 VAL 15 HG21 VAL 15 -2.695 -6.795 6.485
128 HG22 VAL 15 HG22 VAL 15 -4.358 -7.392 6.580
129 HG23 VAL 15 HG23 VAL 15 -3.155 -7.901 7.778
130 H GLU 16 HN GLU 16 -2.816 -2.872 8.024
131 HA GLU 16 HA GLU 16 -4.275 -2.121 10.305
132 HB2 GLU 16 HB2 GLU 16 -2.020 -0.697 8.908
133 HB3 GLU 16 HB1 GLU 16 -2.638 -0.299 10.511
134 HG2 GLU 16 HG2 GLU 16 -1.457 -2.935 9.698
135 HG3 GLU 16 HG1 GLU 16 -0.604 -1.696 10.594
136 H SER 17 HN SER 17 -4.289 -0.867 7.056
137 HA SER 17 HA SER 17 -5.944 1.346 7.925
138 HB2 SER 17 HB2 SER 17 -4.146 1.482 6.081
139 HB3 SER 17 HB1 SER 17 -5.307 0.617 5.068
140 HG SER 17 HG SER 17 -5.693 3.031 6.436
141 H ALA 18 HN ALA 18 -6.222 -1.846 6.677
142 HA ALA 18 HA ALA 18 -8.843 -1.667 5.583
143 HB1 ALA 18 HB1 ALA 18 -8.827 -4.122 5.643
144 HB2 ALA 18 HB2 ALA 18 -7.340 -4.086 6.598
145 HB3 ALA 18 HB3 ALA 18 -7.346 -3.478 4.941
146 H GLY 19 HN GLY 19 -7.616 -1.749 8.724
147 HA2 GLY 19 HA2 GLY 19 -9.823 -2.929 10.070
148 HA3 GLY 19 HA1 GLY 19 -8.570 -1.937 10.804
149 H GLU 20 HN GLU 20 -9.650 0.026 8.412
150 HA GLU 20 HA GLU 20 -11.691 1.162 10.171
151 HB2 GLU 20 HB2 GLU 20 -9.853 2.578 8.235
152 HB3 GLU 20 HB1 GLU 20 -11.105 3.354 9.195
153 HG2 GLU 20 HG2 GLU 20 -8.583 2.029 10.172
154 HG3 GLU 20 HG1 GLU 20 -9.009 3.734 10.264
155 H THR 21 HN THR 21 -11.697 -0.781 7.823
156 HA THR 21 HA THR 21 -13.988 0.376 6.546
157 HB THR 21 HB THR 21 -12.028 1.020 5.133
158 HG1 THR 21 HG1 THR 21 -12.823 -0.144 3.130
159 HG21 THR 21 HG21 THR 21 -11.626 -1.955 4.763
160 HG22 THR 21 HG22 THR 21 -10.522 -0.835 5.563
161 HG23 THR 21 HG23 THR 21 -10.817 -0.700 3.829
162 H ASP 22 HN ASP 22 -14.167 -1.781 4.661
163 HA ASP 22 HA ASP 22 -14.897 -3.897 6.482
164 HB2 ASP 22 HB2 ASP 22 -15.256 -3.517 3.569
165 HB3 ASP 22 HB1 ASP 22 -15.673 -5.058 4.317
166 H GLY 23 HN GLY 23 -13.223 -4.953 7.216
167 HA2 GLY 23 HA2 GLY 23 -10.795 -5.395 5.893
168 HA3 GLY 23 HA1 GLY 23 -11.356 -6.261 7.309
169 H THR 24 HN THR 24 -10.342 -6.648 4.287
170 HA THR 24 HA THR 24 -12.129 -8.769 3.465
171 HB THR 24 HB THR 24 -11.266 -7.132 1.784
172 HG1 THR 24 HG1 THR 24 -11.645 -9.490 1.205
173 HG21 THR 24 HG21 THR 24 -8.908 -7.192 1.081
174 HG22 THR 24 HG22 THR 24 -8.556 -8.318 2.399
175 HG23 THR 24 HG23 THR 24 -9.084 -6.675 2.756
176 H ASP 25 HN ASP 25 -10.304 -10.495 2.245
177 HA ASP 25 HA ASP 25 -8.941 -11.752 4.514
178 HB2 ASP 25 HB2 ASP 25 -9.830 -12.848 1.836
179 HB3 ASP 25 HB1 ASP 25 -8.752 -13.729 2.902
180 H LEU 26 HN LEU 26 -7.078 -10.693 4.591
181 HA LEU 26 HA LEU 26 -5.739 -10.262 2.060
182 HB2 LEU 26 HB2 LEU 26 -6.180 -8.412 3.835
183 HB3 LEU 26 HB1 LEU 26 -4.796 -9.118 4.658
184 HG LEU 26 HG LEU 26 -3.437 -8.715 2.622
185 HD11 LEU 26 HD11 LEU 26 -4.348 -7.157 0.935
186 HD12 LEU 26 HD12 LEU 26 -5.928 -7.262 1.715
187 HD13 LEU 26 HD13 LEU 26 -5.223 -8.685 0.973
188 HD21 LEU 26 HD21 LEU 26 -4.795 -6.298 3.795
189 HD22 LEU 26 HD22 LEU 26 -3.230 -6.316 2.984
190 HD23 LEU 26 HD23 LEU 26 -3.444 -7.165 4.512
191 H SER 27 HN SER 27 -5.241 -12.436 1.896
192 HA SER 27 HA SER 27 -2.678 -13.119 2.887
193 HB2 SER 27 HB2 SER 27 -4.204 -13.919 4.752
194 HB3 SER 27 HB1 SER 27 -5.034 -14.934 3.578
195 HG SER 27 HG SER 27 -3.262 -15.911 4.893
196 H GLY 28 HN GLY 28 -2.450 -15.602 1.956
197 HA2 GLY 28 HA2 GLY 28 -2.278 -16.821 -0.002
198 HA3 GLY 28 HA1 GLY 28 -3.825 -16.136 -0.481
199 H ASP 29 HN ASP 29 -3.156 -15.747 -2.640
200 HA ASP 29 HA ASP 29 -0.979 -13.819 -2.854
201 HB2 ASP 29 HB2 ASP 29 -1.025 -15.731 -4.492
202 HB3 ASP 29 HB1 ASP 29 -2.512 -15.052 -5.159
203 H PHE 30 HN PHE 30 -1.732 -12.018 -2.188
204 HA PHE 30 HA PHE 30 -4.303 -11.016 -3.167
205 HB2 PHE 30 HB2 PHE 30 -4.203 -9.425 -1.322
206 HB3 PHE 30 HB1 PHE 30 -3.872 -11.040 -0.703
207 HD1 PHE 30 HD2 PHE 30 -1.411 -11.669 -0.306
208 HD2 PHE 30 HD1 PHE 30 -2.725 -7.668 -0.936
209 HE1 PHE 30 HE2 PHE 30 0.669 -10.835 0.690
210 HE2 PHE 30 HE1 PHE 30 -0.638 -6.824 0.059
211 HZ PHE 30 HZ PHE 30 1.062 -8.414 0.873
212 H LEU 31 HN LEU 31 -1.545 -11.100 -4.576
213 HA LEU 31 HA LEU 31 -0.687 -8.403 -4.549
214 HB2 LEU 31 HB2 LEU 31 0.164 -10.799 -6.119
215 HB3 LEU 31 HB1 LEU 31 0.792 -9.202 -6.457
216 HG LEU 31 HG LEU 31 2.389 -10.359 -5.129
217 HD11 LEU 31 HD11 LEU 31 2.580 -8.915 -3.161
218 HD12 LEU 31 HD12 LEU 31 0.937 -8.344 -3.441
219 HD13 LEU 31 HD13 LEU 31 2.197 -8.027 -4.632
220 HD21 LEU 31 HD21 LEU 31 1.916 -11.248 -2.894
221 HD22 LEU 31 HD22 LEU 31 0.951 -12.070 -4.124
222 HD23 LEU 31 HD23 LEU 31 0.207 -10.849 -3.092
223 H ASP 32 HN ASP 32 -2.980 -10.109 -6.392
224 HA ASP 32 HA ASP 32 -3.160 -7.763 -8.194
225 HB2 ASP 32 HB2 ASP 32 -4.158 -10.584 -8.665
226 HB3 ASP 32 HB1 ASP 32 -4.549 -9.217 -9.699
227 H LEU 33 HN LEU 33 -4.292 -8.526 -5.435
228 HA LEU 33 HA LEU 33 -7.132 -8.599 -5.905
229 HB2 LEU 33 HB2 LEU 33 -5.938 -9.728 -3.978
230 HB3 LEU 33 HB1 LEU 33 -5.632 -8.140 -3.322
231 HG LEU 33 HG LEU 33 -8.048 -7.784 -3.057
232 HD11 LEU 33 HD11 LEU 33 -8.281 -10.638 -4.028
233 HD12 LEU 33 HD12 LEU 33 -8.846 -9.198 -4.873
234 HD13 LEU 33 HD13 LEU 33 -9.588 -9.671 -3.348
235 HD21 LEU 33 HD21 LEU 33 -6.743 -8.700 -1.212
236 HD22 LEU 33 HD22 LEU 33 -7.002 -10.332 -1.819
237 HD23 LEU 33 HD23 LEU 33 -8.365 -9.391 -1.222
238 H ARG 34 HN ARG 34 -8.054 -6.845 -6.639
239 HA ARG 34 HA ARG 34 -6.862 -4.325 -6.612
240 HB2 ARG 34 HB2 ARG 34 -9.509 -5.310 -7.458
241 HB3 ARG 34 HB1 ARG 34 -9.260 -3.577 -7.321
242 HG2 ARG 34 HG2 ARG 34 -7.310 -3.800 -8.808
243 HG3 ARG 34 HG1 ARG 34 -7.720 -5.506 -9.014
244 HD2 ARG 34 HD2 ARG 34 -9.765 -4.994 -10.044
245 HD3 ARG 34 HD1 ARG 34 -9.685 -3.308 -9.530
246 HE ARG 34 HE ARG 34 -7.459 -3.649 -11.013
247 HH11 ARG 34 HH11 ARG 34 -10.904 -4.242 -11.658
248 HH12 ARG 34 HH12 ARG 34 -10.802 -3.822 -13.304
249 HH21 ARG 34 HH21 ARG 34 -7.351 -2.965 -13.176
250 HH22 ARG 34 HH22 ARG 34 -8.706 -3.029 -14.235
251 H PHE 35 HN PHE 35 -6.956 -2.653 -5.411
252 HA PHE 35 HA PHE 35 -7.960 -2.629 -2.794
253 HB2 PHE 35 HB2 PHE 35 -7.305 -0.265 -4.553
254 HB3 PHE 35 HB1 PHE 35 -7.477 -0.221 -2.806
255 HD1 PHE 35 HD2 PHE 35 -5.885 -1.645 -1.430
256 HD2 PHE 35 HD1 PHE 35 -5.256 -0.712 -5.538
257 HE1 PHE 35 HE2 PHE 35 -3.511 -2.180 -1.189
258 HE2 PHE 35 HE1 PHE 35 -2.870 -1.253 -5.288
259 HZ PHE 35 HZ PHE 35 -1.985 -1.894 -3.133
260 H GLU 36 HN GLU 36 -9.234 -1.308 -5.787
261 HA GLU 36 HA GLU 36 -11.444 0.056 -4.719
262 HB2 GLU 36 HB2 GLU 36 -12.371 -0.025 -7.007
263 HB3 GLU 36 HB1 GLU 36 -10.703 0.509 -6.971
264 HG2 GLU 36 HG2 GLU 36 -9.931 -1.565 -7.828
265 HG3 GLU 36 HG1 GLU 36 -11.499 -2.326 -7.577
266 H ASP 37 HN ASP 37 -10.902 -3.280 -5.319
267 HA ASP 37 HA ASP 37 -13.692 -4.012 -5.413
268 HB2 ASP 37 HB2 ASP 37 -11.955 -5.196 -6.760
269 HB3 ASP 37 HB1 ASP 37 -11.213 -5.752 -5.268
270 H ILE 38 HN ILE 38 -10.904 -4.371 -3.282
271 HA ILE 38 HA ILE 38 -12.509 -5.691 -1.302
272 HB ILE 38 HB ILE 38 -10.415 -5.976 -0.008
273 HG12 ILE 38 HG12 ILE 38 -9.137 -4.629 -2.417
274 HG13 ILE 38 HG11 ILE 38 -9.222 -3.968 -0.790
275 HG21 ILE 38 HG21 ILE 38 -11.195 -7.658 -1.574
276 HG22 ILE 38 HG22 ILE 38 -9.434 -7.585 -1.568
277 HG23 ILE 38 HG23 ILE 38 -10.340 -6.857 -2.890
278 HD11 ILE 38 HD11 ILE 38 -7.769 -5.753 0.018
279 HD12 ILE 38 HD12 ILE 38 -7.004 -4.868 -1.299
280 HD13 ILE 38 HD13 ILE 38 -7.715 -6.452 -1.598
281 H GLY 39 HN GLY 39 -12.881 -2.793 -1.810
282 HA2 GLY 39 HA2 GLY 39 -13.955 -1.294 -0.384
283 HA3 GLY 39 HA1 GLY 39 -13.438 -2.277 0.968
284 H TYR 40 HN TYR 40 -10.929 -1.129 -1.186
285 HA TYR 40 HA TYR 40 -10.203 0.760 0.899
286 HB2 TYR 40 HB2 TYR 40 -8.540 -0.191 -1.484
287 HB3 TYR 40 HB1 TYR 40 -8.113 1.134 -0.446
288 HD1 TYR 40 HD2 TYR 40 -9.211 -2.402 0.002
289 HD2 TYR 40 HD1 TYR 40 -6.621 0.753 1.172
290 HE1 TYR 40 HE2 TYR 40 -8.100 -3.912 1.582
291 HE2 TYR 40 HE1 TYR 40 -5.503 -0.716 2.743
292 HH TYR 40 HH TYR 40 -5.856 -2.790 3.937
293 H ASP 41 HN ASP 41 -10.625 2.748 0.779
294 HA ASP 41 HA ASP 41 -11.632 3.971 -1.667
295 HB2 ASP 41 HB2 ASP 41 -11.052 5.265 1.012
296 HB3 ASP 41 HB1 ASP 41 -12.005 5.940 -0.295
297 H SER 42 HN SER 42 -10.628 6.212 -2.123
298 HA SER 42 HA SER 42 -7.902 5.910 -2.568
299 HB2 SER 42 HB2 SER 42 -8.321 8.597 -2.865
300 HB3 SER 42 HB1 SER 42 -8.693 7.391 -4.101
301 H LEU 43 HN LEU 43 -9.638 7.686 -0.037
302 HA LEU 43 HA LEU 43 -7.465 8.737 1.381
303 HB2 LEU 43 HB2 LEU 43 -10.099 7.680 2.399
304 HB3 LEU 43 HB1 LEU 43 -8.938 8.474 3.423
305 HG LEU 43 HG LEU 43 -10.303 9.775 1.063
306 HD11 LEU 43 HD11 LEU 43 -11.580 10.976 2.762
307 HD12 LEU 43 HD12 LEU 43 -10.814 10.008 4.022
308 HD13 LEU 43 HD13 LEU 43 -11.883 9.244 2.841
309 HD21 LEU 43 HD21 LEU 43 -8.607 10.913 3.282
310 HD22 LEU 43 HD22 LEU 43 -9.409 11.834 2.001
311 HD23 LEU 43 HD23 LEU 43 -8.105 10.714 1.600
312 H ALA 44 HN ALA 44 -8.891 5.524 1.519
313 HA ALA 44 HA ALA 44 -7.410 4.574 3.719
314 HB1 ALA 44 HB1 ALA 44 -8.617 2.987 1.457
315 HB2 ALA 44 HB2 ALA 44 -9.450 3.472 2.933
316 HB3 ALA 44 HB3 ALA 44 -8.093 2.342 3.012
317 H LEU 45 HN LEU 45 -6.683 4.720 0.295
318 HA LEU 45 HA LEU 45 -4.406 3.025 0.367
319 HB2 LEU 45 HB2 LEU 45 -5.759 4.151 -1.649
320 HB3 LEU 45 HB1 LEU 45 -4.536 5.381 -1.484
321 HG LEU 45 HG LEU 45 -3.726 4.064 -3.189
322 HD11 LEU 45 HD11 LEU 45 -1.960 4.344 -1.600
323 HD12 LEU 45 HD12 LEU 45 -1.820 2.787 -2.443
324 HD13 LEU 45 HD13 LEU 45 -2.439 2.843 -0.788
325 HD21 LEU 45 HD21 LEU 45 -4.484 1.604 -1.677
326 HD22 LEU 45 HD22 LEU 45 -3.685 1.699 -3.257
327 HD23 LEU 45 HD23 LEU 45 -5.332 2.315 -3.072
328 H MET 46 HN MET 46 -4.907 6.514 0.694
329 HA MET 46 HA MET 46 -2.261 7.491 0.931
330 HB2 MET 46 HB2 MET 46 -4.562 8.490 2.603
331 HB3 MET 46 HB1 MET 46 -3.166 9.395 2.058
332 HG2 MET 46 HG2 MET 46 -4.016 9.241 -0.241
333 HG3 MET 46 HG1 MET 46 -5.376 8.311 0.442
334 HE1 MET 46 HE1 MET 46 -3.565 11.845 0.617
335 HE2 MET 46 HE2 MET 46 -3.706 11.301 2.285
336 HE3 MET 46 HE3 MET 46 -4.648 12.689 1.725
337 H GLU 47 HN GLU 47 -4.594 6.475 3.250
338 HA GLU 47 HA GLU 47 -3.263 6.871 5.633
339 HB2 GLU 47 HB2 GLU 47 -5.669 6.358 4.809
340 HB3 GLU 47 HB1 GLU 47 -5.238 4.689 5.143
341 HG2 GLU 47 HG2 GLU 47 -5.124 6.905 7.177
342 HG3 GLU 47 HG1 GLU 47 -6.472 5.795 7.000
343 H THR 48 HN THR 48 -3.459 4.002 3.539
344 HA THR 48 HA THR 48 -1.861 2.223 5.030
345 HB THR 48 HB THR 48 -2.255 2.433 2.029
346 HG1 THR 48 HG1 THR 48 -4.217 2.131 3.330
347 HG21 THR 48 HG21 THR 48 -1.403 0.035 3.669
348 HG22 THR 48 HG22 THR 48 -0.321 1.026 2.706
349 HG23 THR 48 HG23 THR 48 -1.617 0.107 1.915
350 H ALA 49 HN ALA 49 -1.074 4.265 2.204
351 HA ALA 49 HA ALA 49 1.619 3.686 1.975
352 HB1 ALA 49 HB1 ALA 49 1.772 5.705 0.598
353 HB2 ALA 49 HB2 ALA 49 0.196 6.228 1.191
354 HB3 ALA 49 HB3 ALA 49 0.331 4.766 0.217
355 H ALA 50 HN ALA 50 0.038 6.363 3.692
356 HA ALA 50 HA ALA 50 2.276 7.783 4.532
357 HB1 ALA 50 HB1 ALA 50 -0.339 7.464 6.004
358 HB2 ALA 50 HB2 ALA 50 -0.022 8.627 4.719
359 HB3 ALA 50 HB3 ALA 50 0.835 8.756 6.255
360 H ARG 51 HN ARG 51 0.728 5.012 5.967
361 HA ARG 51 HA ARG 51 2.062 5.028 8.367
362 HB2 ARG 51 HB2 ARG 51 0.081 3.666 8.099
363 HB3 ARG 51 HB1 ARG 51 0.820 2.739 6.819
364 HG2 ARG 51 HG2 ARG 51 0.723 1.316 8.686
365 HG3 ARG 51 HG1 ARG 51 2.403 1.803 8.537
366 HD2 ARG 51 HD2 ARG 51 1.420 1.690 10.787
367 HD3 ARG 51 HD1 ARG 51 2.232 3.205 10.544
368 HE ARG 51 HE ARG 51 -0.673 3.045 10.020
369 HH11 ARG 51 HH11 ARG 51 1.862 4.179 12.238
370 HH12 ARG 51 HH12 ARG 51 0.755 5.116 13.152
371 HH21 ARG 51 HH21 ARG 51 -2.076 4.274 11.253
372 HH22 ARG 51 HH22 ARG 51 -1.481 5.200 12.598
373 H LEU 52 HN LEU 52 2.823 3.753 5.250
374 HA LEU 52 HA LEU 52 5.209 2.361 6.068
375 HB2 LEU 52 HB2 LEU 52 4.085 2.982 3.339
376 HB3 LEU 52 HB1 LEU 52 5.553 2.057 3.618
377 HG LEU 52 HG LEU 52 2.788 1.241 4.553
378 HD11 LEU 52 HD11 LEU 52 2.945 -0.474 2.849
379 HD12 LEU 52 HD12 LEU 52 4.466 0.217 2.283
380 HD13 LEU 52 HD13 LEU 52 2.971 1.146 2.151
381 HD21 LEU 52 HD21 LEU 52 4.601 0.459 6.013
382 HD22 LEU 52 HD22 LEU 52 5.454 -0.178 4.616
383 HD23 LEU 52 HD23 LEU 52 3.902 -0.873 5.096
384 H GLU 53 HN GLU 53 4.402 5.344 4.380
385 HA GLU 53 HA GLU 53 6.890 6.268 3.605
386 HB2 GLU 53 HB2 GLU 53 4.541 7.854 4.655
387 HB3 GLU 53 HB1 GLU 53 5.940 8.571 3.888
388 HG2 GLU 53 HG2 GLU 53 5.390 7.393 1.812
389 HG3 GLU 53 HG1 GLU 53 3.967 6.701 2.597
390 H SER 54 HN SER 54 5.236 6.857 6.670
391 HA SER 54 HA SER 54 7.342 8.468 7.726
392 HB2 SER 54 HB2 SER 54 5.051 7.186 9.206
393 HB3 SER 54 HB1 SER 54 5.916 8.664 9.630
394 HG SER 54 HG SER 54 4.050 8.216 7.566
395 H ARG 55 HN ARG 55 6.703 5.140 7.635
396 HA ARG 55 HA ARG 55 8.115 4.436 10.065
397 HB2 ARG 55 HB2 ARG 55 6.082 3.287 9.463
398 HB3 ARG 55 HB1 ARG 55 6.754 2.832 7.918
399 HG2 ARG 55 HG2 ARG 55 8.317 1.330 9.044
400 HG3 ARG 55 HG1 ARG 55 7.652 1.822 10.608
401 HD2 ARG 55 HD2 ARG 55 5.508 0.942 10.080
402 HD3 ARG 55 HD1 ARG 55 5.955 0.701 8.395
403 HE ARG 55 HE ARG 55 7.115 -0.843 10.629
404 HH11 ARG 55 HH11 ARG 55 5.628 -0.709 7.401
405 HH12 ARG 55 HH12 ARG 55 6.105 -2.281 6.975
406 HH21 ARG 55 HH21 ARG 55 7.675 -3.027 10.065
407 HH22 ARG 55 HH22 ARG 55 7.278 -3.588 8.489
408 H TYR 56 HN TYR 56 8.677 4.379 6.591
409 HA TYR 56 HA TYR 56 11.332 3.258 7.133
410 HB2 TYR 56 HB2 TYR 56 9.636 3.055 4.665
411 HB3 TYR 56 HB1 TYR 56 11.370 2.756 4.609
412 HD1 TYR 56 HD1 TYR 56 12.345 0.864 5.760
413 HD2 TYR 56 HD2 TYR 56 8.145 1.499 5.784
414 HE1 TYR 56 HE1 TYR 56 12.018 -1.426 6.565
415 HE2 TYR 56 HE2 TYR 56 7.793 -0.787 6.580
416 HH TYR 56 HH TYR 56 8.911 -2.939 6.759
417 H GLY 57 HN GLY 57 9.791 6.098 5.953
418 HA2 GLY 57 HA2 GLY 57 10.934 8.116 5.766
419 HA3 GLY 57 HA1 GLY 57 12.444 7.232 5.546
420 H VAL 58 HN VAL 58 9.334 6.917 3.928
421 HA VAL 58 HA VAL 58 10.647 7.655 1.421
422 HB VAL 58 HB VAL 58 9.327 6.019 0.169
423 HG11 VAL 58 HG11 VAL 58 11.454 5.221 1.000
424 HG12 VAL 58 HG12 VAL 58 10.259 3.915 1.007
425 HG13 VAL 58 HG13 VAL 58 10.672 4.745 2.512
426 HG21 VAL 58 HG21 VAL 58 7.915 4.339 1.277
427 HG22 VAL 58 HG22 VAL 58 7.311 5.974 1.545
428 HG23 VAL 58 HG23 VAL 58 8.188 5.137 2.828
429 H SER 59 HN SER 59 8.660 8.077 -0.271
430 HA SER 59 HA SER 59 6.379 9.081 1.091
431 HB2 SER 59 HB2 SER 59 8.095 10.944 1.243
432 HB3 SER 59 HB1 SER 59 8.034 11.040 -0.518
433 HG SER 59 HG SER 59 5.585 11.069 0.785
434 H ILE 60 HN ILE 60 4.672 9.125 -0.193
435 HA ILE 60 HA ILE 60 5.037 8.733 -3.072
436 HB ILE 60 HB ILE 60 2.953 7.395 -1.304
437 HG12 ILE 60 HG12 ILE 60 5.167 6.174 -2.969
438 HG13 ILE 60 HG11 ILE 60 5.118 6.242 -1.217
439 HG21 ILE 60 HG21 ILE 60 3.255 7.266 -4.305
440 HG22 ILE 60 HG22 ILE 60 1.963 8.085 -3.420
441 HG23 ILE 60 HG23 ILE 60 2.110 6.327 -3.348
442 HD11 ILE 60 HD11 ILE 60 3.157 4.800 -1.205
443 HD12 ILE 60 HD12 ILE 60 4.511 4.041 -2.039
444 HD13 ILE 60 HD13 ILE 60 3.187 4.750 -2.967
445 HA PRO 61 HA PRO 61 2.594 12.504 -2.939
446 HB2 PRO 61 HB2 PRO 61 2.184 11.637 -5.765
447 HB3 PRO 61 HB1 PRO 61 2.649 13.226 -5.142
448 HG2 PRO 61 HG2 PRO 61 4.474 11.685 -6.276
449 HG3 PRO 61 HG1 PRO 61 4.861 12.587 -4.792
450 HD2 PRO 61 HD2 PRO 61 4.231 9.688 -5.134
451 HD3 PRO 61 HD1 PRO 61 5.433 10.459 -4.074
452 H ASP 62 HN ASP 62 0.487 12.811 -2.656
453 HA ASP 62 HA ASP 62 -1.233 10.853 -1.872
454 HB2 ASP 62 HB2 ASP 62 -2.044 13.527 -3.032
455 HB3 ASP 62 HB1 ASP 62 -3.036 12.518 -1.986
456 H ASP 63 HN ASP 63 -1.182 12.397 -5.040
457 HA ASP 63 HA ASP 63 -3.443 11.109 -6.148
458 HB2 ASP 63 HB2 ASP 63 -2.533 13.108 -7.144
459 HB3 ASP 63 HB1 ASP 63 -1.021 12.281 -7.498
460 H VAL 64 HN VAL 64 -0.109 10.115 -5.894
461 HA VAL 64 HA VAL 64 -0.311 8.149 -7.937
462 HB VAL 64 HB VAL 64 1.954 8.551 -5.951
463 HG11 VAL 64 HG11 VAL 64 3.357 7.398 -7.605
464 HG12 VAL 64 HG12 VAL 64 1.932 7.097 -8.595
465 HG13 VAL 64 HG13 VAL 64 2.071 6.348 -7.004
466 HG21 VAL 64 HG21 VAL 64 1.529 10.563 -7.256
467 HG22 VAL 64 HG22 VAL 64 1.656 9.632 -8.754
468 HG23 VAL 64 HG23 VAL 64 3.061 9.824 -7.706
469 H ALA 65 HN ALA 65 -1.122 8.159 -4.626
470 HA ALA 65 HA ALA 65 -0.715 5.432 -4.059
471 HB1 ALA 65 HB1 ALA 65 -0.988 7.111 -2.297
472 HB2 ALA 65 HB2 ALA 65 -2.263 5.893 -2.188
473 HB3 ALA 65 HB3 ALA 65 -2.611 7.475 -2.884
474 H GLY 66 HN GLY 66 -3.468 7.384 -5.100
475 HA2 GLY 66 HA2 GLY 66 -5.009 4.970 -5.665
476 HA3 GLY 66 HA1 GLY 66 -5.622 6.621 -5.708
477 H ARG 67 HN ARG 67 -2.730 5.287 -7.192
478 HA ARG 67 HA ARG 67 -3.832 5.798 -9.840
479 HB2 ARG 67 HB2 ARG 67 -2.412 7.628 -8.979
480 HB3 ARG 67 HB1 ARG 67 -1.113 6.490 -8.733
481 HG2 ARG 67 HG2 ARG 67 -0.840 6.207 -11.049
482 HG3 ARG 67 HG1 ARG 67 -2.299 7.174 -11.380
483 HD2 ARG 67 HD2 ARG 67 -1.273 9.135 -10.382
484 HD3 ARG 67 HD1 ARG 67 0.140 8.200 -9.923
485 HE ARG 67 HE ARG 67 0.264 7.896 -12.519
486 HH11 ARG 67 HH11 ARG 67 -0.629 10.900 -10.794
487 HH12 ARG 67 HH12 ARG 67 0.206 11.907 -11.893
488 HH21 ARG 67 HH21 ARG 67 1.358 9.252 -13.956
489 HH22 ARG 67 HH22 ARG 67 1.355 10.935 -13.812
490 H VAL 68 HN VAL 68 -3.032 3.497 -7.806
491 HA VAL 68 HA VAL 68 -1.588 1.896 -9.770
492 HB VAL 68 HB VAL 68 -1.039 0.279 -7.953
493 HG11 VAL 68 HG11 VAL 68 0.618 1.605 -6.805
494 HG12 VAL 68 HG12 VAL 68 -0.145 3.091 -7.392
495 HG13 VAL 68 HG13 VAL 68 0.594 1.964 -8.532
496 HG21 VAL 68 HG21 VAL 68 -2.291 2.343 -6.145
497 HG22 VAL 68 HG22 VAL 68 -1.286 1.004 -5.598
498 HG23 VAL 68 HG23 VAL 68 -2.835 0.675 -6.385
499 H ASP 69 HN ASP 69 -2.262 -0.555 -9.584
500 HA ASP 69 HA ASP 69 -5.216 -0.621 -9.582
501 HB2 ASP 69 HB2 ASP 69 -3.956 -1.101 -11.748
502 HB3 ASP 69 HB1 ASP 69 -3.271 -2.497 -10.954
503 H THR 70 HN THR 70 -2.357 -2.626 -9.053
504 HA THR 70 HA THR 70 -3.844 -4.178 -7.061
505 HB THR 70 HB THR 70 -2.342 -6.028 -7.666
506 HG1 THR 70 HG1 THR 70 -1.315 -4.104 -9.532
507 HG21 THR 70 HG21 THR 70 -3.668 -4.723 -10.040
508 HG22 THR 70 HG22 THR 70 -4.467 -5.752 -8.855
509 HG23 THR 70 HG23 THR 70 -3.226 -6.432 -9.923
510 HA PRO 71 HA PRO 71 -1.077 -3.148 -3.740
511 HB2 PRO 71 HB2 PRO 71 -0.704 -6.085 -3.349
512 HB3 PRO 71 HB1 PRO 71 -1.162 -4.839 -2.175
513 HG2 PRO 71 HG2 PRO 71 -3.014 -6.446 -3.126
514 HG3 PRO 71 HG1 PRO 71 -3.343 -4.702 -2.995
515 HD2 PRO 71 HD2 PRO 71 -2.617 -6.318 -5.411
516 HD3 PRO 71 HD1 PRO 71 -3.856 -5.055 -5.235
517 H ARG 72 HN ARG 72 0.087 -5.478 -6.108
518 HA ARG 72 HA ARG 72 2.765 -5.532 -5.198
519 HB2 ARG 72 HB2 ARG 72 3.352 -6.578 -7.323
520 HB3 ARG 72 HB1 ARG 72 1.840 -7.258 -6.754
521 HG2 ARG 72 HG2 ARG 72 0.613 -5.879 -8.340
522 HG3 ARG 72 HG1 ARG 72 2.128 -5.156 -8.891
523 HD2 ARG 72 HD2 ARG 72 1.591 -6.839 -10.479
524 HD3 ARG 72 HD1 ARG 72 2.880 -7.496 -9.481
525 HE ARG 72 HE ARG 72 0.040 -8.204 -9.247
526 HH11 ARG 72 HH11 ARG 72 3.462 -9.119 -8.832
527 HH12 ARG 72 HH12 ARG 72 3.125 -10.778 -8.622
528 HH21 ARG 72 HH21 ARG 72 -0.356 -10.583 -9.065
529 HH22 ARG 72 HH22 ARG 72 0.932 -11.615 -8.739
530 H GLU 73 HN GLU 73 0.988 -3.295 -7.118
531 HA GLU 73 HA GLU 73 3.267 -1.908 -8.179
532 HB2 GLU 73 HB2 GLU 73 0.345 -1.193 -8.062
533 HB3 GLU 73 HB1 GLU 73 1.570 -0.299 -8.959
534 HG2 GLU 73 HG2 GLU 73 1.890 -2.045 -10.466
535 HG3 GLU 73 HG1 GLU 73 1.045 -3.202 -9.437
536 H LEU 74 HN LEU 74 1.082 -1.573 -5.473
537 HA LEU 74 HA LEU 74 1.767 1.017 -4.538
538 HB2 LEU 74 HB2 LEU 74 -0.102 -0.596 -3.790
539 HB3 LEU 74 HB1 LEU 74 1.174 -1.373 -2.841
540 HG LEU 74 HG LEU 74 0.172 1.490 -2.434
541 HD11 LEU 74 HD11 LEU 74 -1.524 -0.142 -1.864
542 HD12 LEU 74 HD12 LEU 74 -0.901 0.683 -0.438
543 HD13 LEU 74 HD13 LEU 74 -0.379 -0.966 -0.808
544 HD21 LEU 74 HD21 LEU 74 1.409 1.452 -0.344
545 HD22 LEU 74 HD22 LEU 74 2.499 1.149 -1.704
546 HD23 LEU 74 HD23 LEU 74 1.970 -0.188 -0.684
547 H LEU 75 HN LEU 75 2.924 -2.239 -3.775
548 HA LEU 75 HA LEU 75 4.910 -1.615 -1.945
549 HB2 LEU 75 HB2 LEU 75 3.910 -3.780 -2.226
550 HB3 LEU 75 HB1 LEU 75 4.518 -3.885 -3.862
551 HG LEU 75 HG LEU 75 6.777 -3.806 -2.935
552 HD11 LEU 75 HD11 LEU 75 7.083 -4.465 -0.558
553 HD12 LEU 75 HD12 LEU 75 5.348 -4.272 -0.309
554 HD13 LEU 75 HD13 LEU 75 6.336 -2.874 -0.729
555 HD21 LEU 75 HD21 LEU 75 5.000 -6.093 -2.171
556 HD22 LEU 75 HD22 LEU 75 6.766 -6.193 -2.336
557 HD23 LEU 75 HD23 LEU 75 5.747 -5.778 -3.733
558 H ASP 76 HN ASP 76 4.883 -1.773 -5.436
559 HA ASP 76 HA ASP 76 7.671 -1.661 -5.944
560 HB2 ASP 76 HB2 ASP 76 6.098 -2.355 -7.680
561 HB3 ASP 76 HB1 ASP 76 5.334 -0.770 -7.644
562 H LEU 77 HN LEU 77 5.218 0.743 -5.404
563 HA LEU 77 HA LEU 77 6.791 3.017 -6.063
564 HB2 LEU 77 HB2 LEU 77 4.395 2.737 -4.276
565 HB3 LEU 77 HB1 LEU 77 5.077 4.259 -4.806
566 HG LEU 77 HG LEU 77 3.827 2.159 -6.543
567 HD11 LEU 77 HD11 LEU 77 2.011 3.779 -6.833
568 HD12 LEU 77 HD12 LEU 77 2.834 4.896 -5.738
569 HD13 LEU 77 HD13 LEU 77 2.225 3.352 -5.133
570 HD21 LEU 77 HD21 LEU 77 5.576 3.360 -7.743
571 HD22 LEU 77 HD22 LEU 77 4.881 4.903 -7.255
572 HD23 LEU 77 HD23 LEU 77 3.988 3.843 -8.339
573 H ILE 78 HN ILE 78 6.002 1.335 -3.083
574 HA ILE 78 HA ILE 78 7.287 3.035 -1.296
575 HB ILE 78 HB ILE 78 6.852 0.040 -1.049
576 HG12 ILE 78 HG12 ILE 78 4.803 1.392 -1.338
577 HG13 ILE 78 HG11 ILE 78 4.871 0.619 0.247
578 HG21 ILE 78 HG21 ILE 78 8.582 0.738 0.511
579 HG22 ILE 78 HG22 ILE 78 7.091 0.414 1.401
580 HG23 ILE 78 HG23 ILE 78 7.573 2.070 1.064
581 HD11 ILE 78 HD11 ILE 78 4.032 2.894 0.402
582 HD12 ILE 78 HD12 ILE 78 5.503 3.507 -0.348
583 HD13 ILE 78 HD13 ILE 78 5.574 2.728 1.236
584 H ASN 79 HN ASN 79 8.466 -0.124 -2.502
585 HA ASN 79 HA ASN 79 11.085 0.271 -1.547
586 HB2 ASN 79 HB2 ASN 79 10.053 -1.642 -3.643
587 HB3 ASN 79 HB1 ASN 79 11.743 -1.593 -3.152
588 HD21 ASN 79 HD21 ASN 79 10.052 -3.815 -2.910
589 HD22 ASN 79 HD22 ASN 79 9.848 -4.167 -1.237
590 H GLY 80 HN GLY 80 9.570 1.233 -4.516
591 HA2 GLY 80 HA2 GLY 80 11.886 1.861 -5.978
592 HA3 GLY 80 HA1 GLY 80 10.293 2.581 -6.197
593 H ALA 81 HN ALA 81 9.932 3.771 -3.721
594 HA ALA 81 HA ALA 81 11.578 6.095 -3.956
595 HB1 ALA 81 HB1 ALA 81 10.258 6.952 -2.073
596 HB2 ALA 81 HB2 ALA 81 9.567 5.347 -1.824
597 HB3 ALA 81 HB3 ALA 81 9.219 6.239 -3.305
598 H LEU 82 HN LEU 82 11.549 3.217 -1.953
599 HA LEU 82 HA LEU 82 13.298 4.139 0.033
600 HB2 LEU 82 HB2 LEU 82 11.781 2.247 0.334
601 HB3 LEU 82 HB1 LEU 82 12.619 1.355 -0.912
602 HG LEU 82 HG LEU 82 14.607 1.346 0.439
603 HD11 LEU 82 HD11 LEU 82 14.485 1.950 2.853
604 HD12 LEU 82 HD12 LEU 82 12.855 2.566 2.584
605 HD13 LEU 82 HD13 LEU 82 14.232 3.345 1.803
606 HD21 LEU 82 HD21 LEU 82 13.827 -0.301 2.107
607 HD22 LEU 82 HD22 LEU 82 13.116 -0.555 0.512
608 HD23 LEU 82 HD23 LEU 82 12.171 0.208 1.789
609 H ALA 83 HN ALA 83 13.733 2.701 -3.126
610 HA ALA 83 HA ALA 83 16.477 2.090 -2.966
611 HB1 ALA 83 HB1 ALA 83 16.440 2.084 -5.405
612 HB2 ALA 83 HB2 ALA 83 14.885 2.920 -5.390
613 HB3 ALA 83 HB3 ALA 83 15.003 1.274 -4.767
614 H GLU 84 HN GLU 84 14.776 5.104 -3.416
615 HA GLU 84 HA GLU 84 17.014 6.572 -4.363
616 HB2 GLU 84 HB2 GLU 84 14.381 7.476 -3.203
617 HB3 GLU 84 HB1 GLU 84 15.524 8.444 -4.123
618 HG2 GLU 84 HG2 GLU 84 13.940 6.106 -5.165
619 HG3 GLU 84 HG1 GLU 84 13.609 7.805 -5.474
620 H ALA 85 HN ALA 85 16.038 5.344 -1.376
621 HA ALA 85 HA ALA 85 17.384 7.437 0.146
622 HB1 ALA 85 HB1 ALA 85 16.407 6.375 2.124
623 HB2 ALA 85 HB2 ALA 85 15.709 5.114 1.104
624 HB3 ALA 85 HB3 ALA 85 15.161 6.783 0.945
625 H ALA 86 HN ALA 86 17.667 4.156 -0.924
626 HA ALA 86 HA ALA 86 20.039 3.796 0.737
627 HB1 ALA 86 HB1 ALA 86 18.423 1.746 -0.791
628 HB2 ALA 86 HB2 ALA 86 18.330 2.034 0.948
629 HB3 ALA 86 HB3 ALA 86 19.814 1.400 0.236
630 H28A SDO 101 H28A SDO 42 -10.580 11.783 -1.233
631 H28B SDO 101 H28B SDO 42 -9.321 11.010 -0.261
632 H30A SDO 101 H30A SDO 42 -9.430 13.915 -0.509
633 H30B SDO 101 H30B SDO 42 -7.756 14.229 -0.977
634 H30C SDO 101 H30C SDO 42 -8.117 13.022 0.255
635 H31A SDO 101 H31A SDO 42 -6.873 11.312 -0.975
636 H31B SDO 101 H31B SDO 42 -6.477 12.440 -2.273
637 H31C SDO 101 H31C SDO 42 -7.277 10.916 -2.642
638 H32A SDO 101 H32A SDO 42 -9.133 12.233 -3.875
639 H33A SDO 101 H33A SDO 42 -8.515 14.679 -3.906
640 H36A SDO 101 H36A SDO 42 -11.167 12.637 -1.817
641 H37A SDO 101 H37A SDO 42 -12.838 14.636 -3.081
642 H37B SDO 101 H37B SDO 42 -13.311 13.437 -1.873
643 H38A SDO 101 H38A SDO 42 -11.704 15.938 -1.387
644 H38B SDO 101 H38B SDO 42 -13.395 15.689 -0.925
645 H41A SDO 101 H41A SDO 42 -11.115 16.451 0.578
646 H42A SDO 101 H42A SDO 42 -11.429 15.553 3.015
647 H42B SDO 101 H42B SDO 42 -10.373 14.279 2.352
648 H43A SDO 101 H43A SDO 42 -9.816 17.213 2.239
649 H43B SDO 101 H43B SDO 42 -8.647 15.935 1.935
650 H1A SDO 101 H1A SDO 42 -9.030 14.848 6.030
651 H1B SDO 101 H1B SDO 42 -10.107 16.205 6.251
652 H2A SDO 101 H2A SDO 42 -10.560 13.912 4.390
653 H2B SDO 101 H2B SDO 42 -11.651 15.240 4.661
654 H4A SDO 101 H4A SDO 42 -11.270 12.705 8.073
655 H4B SDO 101 H4B SDO 42 -12.318 14.077 8.286
656 H5A SDO 101 H5A SDO 42 -10.434 15.607 8.111
657 H5B SDO 101 H5B SDO 42 -9.350 14.228 7.924
658 H6A SDO 101 H6A SDO 42 -9.979 13.393 10.105
659 H6B SDO 101 H6B SDO 42 -11.142 14.694 10.303
660 H8A SDO 101 H8A SDO 42 -8.629 17.222 9.699
661 H8B SDO 101 H8B SDO 42 -8.355 15.862 8.601
662 H8C SDO 101 H8C SDO 42 -7.235 16.155 9.936
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