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 |
|
|
26225 |
2kgd   |
16202 | 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 17.521 -6.996 -0.859
2 H2 MET 1 HT2 MET 1 16.869 -8.380 -1.555
3 H3 MET 1 HT3 MET 1 18.523 -8.105 -1.669
4 HA MET 1 HA MET 1 17.999 -9.769 -0.005
5 HB2 MET 1 HB2 MET 1 18.725 -7.136 1.313
6 HB3 MET 1 HB1 MET 1 18.920 -8.716 2.056
7 HG2 MET 1 HG2 MET 1 20.350 -7.667 -0.373
8 HG3 MET 1 HG1 MET 1 21.034 -7.941 1.231
9 HE1 MET 1 HE1 MET 1 22.765 -10.714 -0.934
10 HE2 MET 1 HE2 MET 1 23.018 -9.371 0.182
11 HE3 MET 1 HE3 MET 1 22.361 -9.069 -1.426
12 H ALA 2 HN ALA 2 16.127 -6.777 0.376
13 HA ALA 2 HA ALA 2 14.399 -7.994 2.332
14 HB1 ALA 2 HB1 ALA 2 14.138 -5.423 0.756
15 HB2 ALA 2 HB2 ALA 2 14.826 -5.572 2.374
16 HB3 ALA 2 HB3 ALA 2 13.116 -5.903 2.110
17 H THR 3 HN THR 3 12.252 -8.710 1.911
18 HA THR 3 HA THR 3 11.909 -9.916 -0.593
19 HB THR 3 HB THR 3 9.615 -10.345 0.691
20 HG1 THR 3 HG1 THR 3 9.744 -9.940 2.808
21 HG21 THR 3 HG21 THR 3 11.313 -12.047 0.139
22 HG22 THR 3 HG22 THR 3 10.710 -12.266 1.782
23 HG23 THR 3 HG23 THR 3 12.285 -11.520 1.513
24 H LEU 4 HN LEU 4 11.345 -8.743 -2.294
25 HA LEU 4 HA LEU 4 9.956 -6.301 -2.361
26 HB2 LEU 4 HB2 LEU 4 10.070 -8.449 -4.492
27 HB3 LEU 4 HB1 LEU 4 9.580 -6.790 -4.747
28 HG LEU 4 HG LEU 4 12.348 -7.686 -3.944
29 HD11 LEU 4 HD11 LEU 4 12.976 -7.018 -6.210
30 HD12 LEU 4 HD12 LEU 4 11.285 -6.680 -6.578
31 HD13 LEU 4 HD13 LEU 4 11.797 -8.329 -6.221
32 HD21 LEU 4 HD21 LEU 4 11.295 -4.960 -4.702
33 HD22 LEU 4 HD22 LEU 4 12.984 -5.361 -4.387
34 HD23 LEU 4 HD23 LEU 4 11.795 -5.466 -3.087
35 H LEU 5 HN LEU 5 7.845 -5.830 -2.268
36 HA LEU 5 HA LEU 5 6.008 -7.599 -1.145
37 HB2 LEU 5 HB2 LEU 5 5.369 -5.113 -2.717
38 HB3 LEU 5 HB1 LEU 5 4.293 -5.958 -1.637
39 HG LEU 5 HG LEU 5 6.805 -4.516 -0.834
40 HD11 LEU 5 HD11 LEU 5 5.004 -3.059 -1.599
41 HD12 LEU 5 HD12 LEU 5 5.256 -2.922 0.137
42 HD13 LEU 5 HD13 LEU 5 3.888 -3.852 -0.488
43 HD21 LEU 5 HD21 LEU 5 6.298 -6.434 0.608
44 HD22 LEU 5 HD22 LEU 5 4.653 -5.845 0.812
45 HD23 LEU 5 HD23 LEU 5 6.009 -4.906 1.442
46 H THR 6 HN THR 6 4.860 -9.178 -1.964
47 HA THR 6 HA THR 6 4.471 -9.406 -4.805
48 HB THR 6 HB THR 6 3.459 -11.615 -4.083
49 HG1 THR 6 HG1 THR 6 4.133 -12.135 -1.804
50 HG21 THR 6 HG21 THR 6 6.289 -11.049 -3.155
51 HG22 THR 6 HG22 THR 6 5.814 -11.455 -4.805
52 HG23 THR 6 HG23 THR 6 5.627 -12.645 -3.515
53 H THR 7 HN THR 7 2.025 -10.634 -4.939
54 HA THR 7 HA THR 7 0.222 -8.500 -4.576
55 HB THR 7 HB THR 7 -1.395 -10.503 -5.204
56 HG1 THR 7 HG1 THR 7 -0.360 -12.262 -5.987
57 HG21 THR 7 HG21 THR 7 -0.842 -8.626 -6.677
58 HG22 THR 7 HG22 THR 7 -0.847 -10.146 -7.577
59 HG23 THR 7 HG23 THR 7 0.683 -9.401 -7.109
60 H ASP 8 HN ASP 8 0.646 -11.679 -3.036
61 HA ASP 8 HA ASP 8 -1.479 -11.358 -1.191
62 HB2 ASP 8 HB2 ASP 8 0.946 -13.152 -1.050
63 HB3 ASP 8 HB1 ASP 8 -0.291 -13.123 0.199
64 H ASP 9 HN ASP 9 1.931 -10.492 -1.025
65 HA ASP 9 HA ASP 9 1.770 -9.922 1.758
66 HB2 ASP 9 HB2 ASP 9 3.931 -10.370 0.375
67 HB3 ASP 9 HB1 ASP 9 3.847 -8.650 0.012
68 H LEU 10 HN LEU 10 1.480 -7.927 -1.147
69 HA LEU 10 HA LEU 10 1.237 -5.464 0.216
70 HB2 LEU 10 HB2 LEU 10 1.667 -5.644 -2.217
71 HB3 LEU 10 HB1 LEU 10 0.049 -6.277 -2.446
72 HG LEU 10 HG LEU 10 -0.855 -4.114 -1.594
73 HD11 LEU 10 HD11 LEU 10 0.623 -2.173 -1.515
74 HD12 LEU 10 HD12 LEU 10 2.014 -3.229 -1.764
75 HD13 LEU 10 HD13 LEU 10 1.045 -3.377 -0.297
76 HD21 LEU 10 HD21 LEU 10 -0.393 -2.854 -3.645
77 HD22 LEU 10 HD22 LEU 10 -0.706 -4.556 -3.984
78 HD23 LEU 10 HD23 LEU 10 0.947 -3.941 -4.008
79 H ARG 11 HN ARG 11 -1.040 -7.966 -0.689
80 HA ARG 11 HA ARG 11 -3.415 -6.654 0.009
81 HB2 ARG 11 HB2 ARG 11 -3.209 -8.772 -1.346
82 HB3 ARG 11 HB1 ARG 11 -2.813 -9.630 0.124
83 HG2 ARG 11 HG2 ARG 11 -5.434 -8.192 -0.243
84 HG3 ARG 11 HG1 ARG 11 -5.180 -9.845 -0.788
85 HD2 ARG 11 HD2 ARG 11 -4.877 -8.850 2.044
86 HD3 ARG 11 HD1 ARG 11 -6.271 -9.726 1.414
87 HE ARG 11 HE ARG 11 -4.049 -11.267 0.875
88 HH11 ARG 11 HH11 ARG 11 -5.753 -10.079 3.723
89 HH12 ARG 11 HH12 ARG 11 -5.370 -11.372 4.744
90 HH21 ARG 11 HH21 ARG 11 -3.469 -13.128 2.277
91 HH22 ARG 11 HH22 ARG 11 -3.976 -13.111 3.902
92 H ARG 12 HN ARG 12 -1.132 -8.563 1.883
93 HA ARG 12 HA ARG 12 -2.441 -8.682 4.357
94 HB2 ARG 12 HB2 ARG 12 0.522 -8.379 3.810
95 HB3 ARG 12 HB1 ARG 12 -0.163 -8.828 5.364
96 HG2 ARG 12 HG2 ARG 12 -1.030 -10.867 4.432
97 HG3 ARG 12 HG1 ARG 12 -0.477 -10.396 2.825
98 HD2 ARG 12 HD2 ARG 12 1.861 -10.422 3.669
99 HD3 ARG 12 HD1 ARG 12 1.250 -10.980 5.227
100 HE ARG 12 HE ARG 12 0.215 -12.831 3.790
101 HH11 ARG 12 HH11 ARG 12 3.488 -11.469 3.233
102 HH12 ARG 12 HH12 ARG 12 4.078 -12.899 2.581
103 HH21 ARG 12 HH21 ARG 12 1.060 -14.735 2.872
104 HH22 ARG 12 HH22 ARG 12 2.695 -14.816 2.373
105 H ALA 13 HN ALA 13 -0.335 -6.208 3.026
106 HA ALA 13 HA ALA 13 -0.279 -4.478 5.230
107 HB1 ALA 13 HB1 ALA 13 0.482 -2.786 3.672
108 HB2 ALA 13 HB2 ALA 13 -0.025 -3.791 2.312
109 HB3 ALA 13 HB3 ALA 13 1.283 -4.324 3.366
110 H LEU 14 HN LEU 14 -2.417 -4.549 2.401
111 HA LEU 14 HA LEU 14 -3.936 -2.299 3.199
112 HB2 LEU 14 HB2 LEU 14 -4.379 -4.424 1.145
113 HB3 LEU 14 HB1 LEU 14 -5.715 -3.394 1.592
114 HG LEU 14 HG LEU 14 -4.740 -2.572 -0.417
115 HD11 LEU 14 HD11 LEU 14 -5.575 -0.901 1.079
116 HD12 LEU 14 HD12 LEU 14 -4.181 -0.284 0.196
117 HD13 LEU 14 HD13 LEU 14 -4.008 -0.786 1.878
118 HD21 LEU 14 HD21 LEU 14 -2.112 -2.392 1.056
119 HD22 LEU 14 HD22 LEU 14 -2.419 -1.780 -0.570
120 HD23 LEU 14 HD23 LEU 14 -2.499 -3.513 -0.249
121 H VAL 15 HN VAL 15 -4.006 -5.498 4.304
122 HA VAL 15 HA VAL 15 -6.669 -5.241 5.401
123 HB VAL 15 HB VAL 15 -4.519 -7.350 5.873
124 HG11 VAL 15 HG11 VAL 15 -5.975 -7.149 7.844
125 HG12 VAL 15 HG12 VAL 15 -6.273 -8.660 6.988
126 HG13 VAL 15 HG13 VAL 15 -7.396 -7.311 6.812
127 HG21 VAL 15 HG21 VAL 15 -5.475 -7.384 3.636
128 HG22 VAL 15 HG22 VAL 15 -7.100 -7.434 4.321
129 HG23 VAL 15 HG23 VAL 15 -5.998 -8.792 4.564
130 H GLU 16 HN GLU 16 -3.334 -5.276 6.593
131 HA GLU 16 HA GLU 16 -3.849 -4.869 9.287
132 HB2 GLU 16 HB2 GLU 16 -1.421 -4.035 7.691
133 HB3 GLU 16 HB1 GLU 16 -1.547 -3.943 9.436
134 HG2 GLU 16 HG2 GLU 16 -1.995 -6.366 9.511
135 HG3 GLU 16 HG1 GLU 16 -1.722 -6.430 7.771
136 H SER 17 HN SER 17 -3.791 -2.466 6.729
137 HA SER 17 HA SER 17 -3.650 -0.300 8.475
138 HB2 SER 17 HB2 SER 17 -4.645 0.906 6.372
139 HB3 SER 17 HB1 SER 17 -2.995 0.289 6.382
140 HG SER 17 HG SER 17 -5.304 -0.813 5.201
141 H ALA 18 HN ALA 18 -6.302 -2.318 7.743
142 HA ALA 18 HA ALA 18 -8.068 -0.351 9.050
143 HB1 ALA 18 HB1 ALA 18 -8.791 -0.936 6.777
144 HB2 ALA 18 HB2 ALA 18 -9.960 -1.461 7.987
145 HB3 ALA 18 HB3 ALA 18 -8.871 -2.633 7.243
146 H GLY 19 HN GLY 19 -6.851 -3.602 9.093
147 HA2 GLY 19 HA2 GLY 19 -6.644 -4.818 11.135
148 HA3 GLY 19 HA1 GLY 19 -8.127 -4.033 11.703
149 H GLU 20 HN GLU 20 -10.050 -4.463 10.550
150 HA GLU 20 HA GLU 20 -10.188 -7.173 9.455
151 HB2 GLU 20 HB2 GLU 20 -12.372 -5.263 10.357
152 HB3 GLU 20 HB1 GLU 20 -12.641 -6.875 9.719
153 HG2 GLU 20 HG2 GLU 20 -11.222 -6.201 12.284
154 HG3 GLU 20 HG1 GLU 20 -12.875 -6.786 12.137
155 H THR 21 HN THR 21 -11.043 -7.381 7.343
156 HA THR 21 HA THR 21 -11.666 -4.894 5.956
157 HB THR 21 HB THR 21 -9.706 -6.881 4.801
158 HG1 THR 21 HG1 THR 21 -9.397 -4.804 6.592
159 HG21 THR 21 HG21 THR 21 -9.173 -5.028 3.258
160 HG22 THR 21 HG22 THR 21 -10.364 -4.014 4.070
161 HG23 THR 21 HG23 THR 21 -10.886 -5.444 3.178
162 H ASP 22 HN ASP 22 -13.743 -5.943 6.260
163 HA ASP 22 HA ASP 22 -14.276 -8.227 4.488
164 HB2 ASP 22 HB2 ASP 22 -16.493 -8.398 5.476
165 HB3 ASP 22 HB1 ASP 22 -15.298 -8.337 6.760
166 H GLY 23 HN GLY 23 -16.043 -8.130 3.015
167 HA2 GLY 23 HA2 GLY 23 -17.516 -7.048 1.543
168 HA3 GLY 23 HA1 GLY 23 -17.078 -5.510 2.280
169 H THR 24 HN THR 24 -14.455 -5.495 2.062
170 HA THR 24 HA THR 24 -13.870 -4.789 -0.600
171 HB THR 24 HB THR 24 -12.091 -5.285 1.782
172 HG1 THR 24 HG1 THR 24 -13.851 -3.214 1.135
173 HG21 THR 24 HG21 THR 24 -11.715 -3.659 -0.731
174 HG22 THR 24 HG22 THR 24 -10.795 -5.087 -0.244
175 HG23 THR 24 HG23 THR 24 -10.636 -3.584 0.665
176 H ASP 25 HN ASP 25 -13.994 -6.662 -1.958
177 HA ASP 25 HA ASP 25 -12.523 -9.032 -1.212
178 HB2 ASP 25 HB2 ASP 25 -14.535 -9.182 -2.713
179 HB3 ASP 25 HB1 ASP 25 -13.633 -8.303 -3.947
180 H LEU 26 HN LEU 26 -10.512 -8.844 -1.073
181 HA LEU 26 HA LEU 26 -9.094 -6.910 -2.767
182 HB2 LEU 26 HB2 LEU 26 -9.266 -6.561 -0.296
183 HB3 LEU 26 HB1 LEU 26 -8.337 -8.023 -0.079
184 HG LEU 26 HG LEU 26 -6.426 -6.950 -1.218
185 HD11 LEU 26 HD11 LEU 26 -6.498 -4.537 -1.624
186 HD12 LEU 26 HD12 LEU 26 -8.204 -4.506 -1.177
187 HD13 LEU 26 HD13 LEU 26 -7.684 -5.382 -2.618
188 HD21 LEU 26 HD21 LEU 26 -7.578 -5.403 1.103
189 HD22 LEU 26 HD22 LEU 26 -5.888 -5.427 0.609
190 HD23 LEU 26 HD23 LEU 26 -6.650 -6.899 1.214
191 H SER 27 HN SER 27 -9.309 -10.221 -1.762
192 HA SER 27 HA SER 27 -6.712 -10.808 -2.887
193 HB2 SER 27 HB2 SER 27 -8.714 -12.601 -1.510
194 HB3 SER 27 HB1 SER 27 -7.115 -13.101 -2.056
195 HG SER 27 HG SER 27 -7.752 -11.193 -0.029
196 H GLY 28 HN GLY 28 -7.375 -10.140 -5.025
197 HA2 GLY 28 HA2 GLY 28 -7.827 -12.276 -6.735
198 HA3 GLY 28 HA1 GLY 28 -9.389 -11.513 -6.463
199 H ASP 29 HN ASP 29 -6.057 -10.430 -7.005
200 HA ASP 29 HA ASP 29 -5.086 -8.976 -8.416
201 HB2 ASP 29 HB2 ASP 29 -6.102 -10.363 -10.224
202 HB3 ASP 29 HB1 ASP 29 -7.529 -9.333 -10.186
203 H PHE 30 HN PHE 30 -5.035 -7.271 -7.134
204 HA PHE 30 HA PHE 30 -7.332 -5.423 -7.187
205 HB2 PHE 30 HB2 PHE 30 -6.896 -4.938 -4.848
206 HB3 PHE 30 HB1 PHE 30 -7.149 -6.661 -5.077
207 HD1 PHE 30 HD2 PHE 30 -5.055 -8.160 -5.173
208 HD2 PHE 30 HD1 PHE 30 -4.988 -4.138 -3.779
209 HE1 PHE 30 HE2 PHE 30 -2.929 -8.592 -4.022
210 HE2 PHE 30 HE1 PHE 30 -2.867 -4.569 -2.626
211 HZ PHE 30 HZ PHE 30 -1.836 -6.798 -2.747
212 H LEU 31 HN LEU 31 -4.713 -5.366 -8.780
213 HA LEU 31 HA LEU 31 -3.187 -3.357 -7.410
214 HB2 LEU 31 HB2 LEU 31 -2.776 -4.597 -10.130
215 HB3 LEU 31 HB1 LEU 31 -1.689 -3.449 -9.388
216 HG LEU 31 HG LEU 31 -0.699 -5.541 -9.157
217 HD11 LEU 31 HD11 LEU 31 -0.581 -5.941 -6.748
218 HD12 LEU 31 HD12 LEU 31 -1.976 -4.888 -6.523
219 HD13 LEU 31 HD13 LEU 31 -0.472 -4.234 -7.175
220 HD21 LEU 31 HD21 LEU 31 -1.765 -7.522 -8.150
221 HD22 LEU 31 HD22 LEU 31 -2.589 -6.998 -9.619
222 HD23 LEU 31 HD23 LEU 31 -3.284 -6.630 -8.042
223 H ASP 32 HN ASP 32 -5.517 -3.473 -10.004
224 HA ASP 32 HA ASP 32 -5.025 -0.608 -10.389
225 HB2 ASP 32 HB2 ASP 32 -5.858 -2.677 -12.373
226 HB3 ASP 32 HB1 ASP 32 -6.316 -0.996 -12.623
227 H LEU 33 HN LEU 33 -6.940 -2.239 -8.613
228 HA LEU 33 HA LEU 33 -9.354 -0.922 -9.378
229 HB2 LEU 33 HB2 LEU 33 -10.332 -1.765 -7.230
230 HB3 LEU 33 HB1 LEU 33 -9.761 -2.997 -8.318
231 HG LEU 33 HG LEU 33 -7.753 -3.286 -6.852
232 HD11 LEU 33 HD11 LEU 33 -7.723 -1.106 -5.758
233 HD12 LEU 33 HD12 LEU 33 -7.806 -2.416 -4.579
234 HD13 LEU 33 HD13 LEU 33 -9.253 -1.481 -4.964
235 HD21 LEU 33 HD21 LEU 33 -9.667 -4.762 -6.709
236 HD22 LEU 33 HD22 LEU 33 -10.450 -3.666 -5.575
237 HD23 LEU 33 HD23 LEU 33 -8.962 -4.499 -5.113
238 H ARG 34 HN ARG 34 -10.528 0.466 -7.758
239 HA ARG 34 HA ARG 34 -8.593 2.534 -7.077
240 HB2 ARG 34 HB2 ARG 34 -11.537 2.699 -7.693
241 HB3 ARG 34 HB1 ARG 34 -10.553 4.067 -7.184
242 HG2 ARG 34 HG2 ARG 34 -10.095 2.414 -9.662
243 HG3 ARG 34 HG1 ARG 34 -10.832 4.021 -9.610
244 HD2 ARG 34 HD2 ARG 34 -8.804 4.987 -8.775
245 HD3 ARG 34 HD1 ARG 34 -8.074 3.398 -8.581
246 HE ARG 34 HE ARG 34 -8.294 3.271 -11.100
247 HH11 ARG 34 HH11 ARG 34 -7.932 6.385 -9.455
248 HH12 ARG 34 HH12 ARG 34 -6.966 7.076 -10.679
249 HH21 ARG 34 HH21 ARG 34 -6.938 4.173 -12.724
250 HH22 ARG 34 HH22 ARG 34 -6.361 5.772 -12.604
251 H PHE 35 HN PHE 35 -8.550 3.517 -5.131
252 HA PHE 35 HA PHE 35 -9.221 1.904 -2.924
253 HB2 PHE 35 HB2 PHE 35 -8.277 4.770 -3.024
254 HB3 PHE 35 HB1 PHE 35 -8.429 3.821 -1.550
255 HD1 PHE 35 HD2 PHE 35 -7.158 1.535 -1.577
256 HD2 PHE 35 HD1 PHE 35 -6.253 4.827 -4.108
257 HE1 PHE 35 HE2 PHE 35 -4.890 0.653 -1.903
258 HE2 PHE 35 HE1 PHE 35 -3.984 3.947 -4.444
259 HZ PHE 35 HZ PHE 35 -3.299 1.860 -3.335
260 H GLU 36 HN GLU 36 -10.751 4.570 -4.457
261 HA GLU 36 HA GLU 36 -12.607 5.335 -2.547
262 HB2 GLU 36 HB2 GLU 36 -13.257 5.082 -5.488
263 HB3 GLU 36 HB1 GLU 36 -13.968 6.185 -4.329
264 HG2 GLU 36 HG2 GLU 36 -12.585 7.570 -5.519
265 HG3 GLU 36 HG1 GLU 36 -11.556 7.137 -4.156
266 H ASP 37 HN ASP 37 -12.704 2.664 -4.835
267 HA ASP 37 HA ASP 37 -15.406 1.900 -4.265
268 HB2 ASP 37 HB2 ASP 37 -14.391 1.428 -6.433
269 HB3 ASP 37 HB1 ASP 37 -13.209 0.375 -5.659
270 H ILE 38 HN ILE 38 -12.267 0.947 -3.090
271 HA ILE 38 HA ILE 38 -13.481 -1.224 -1.611
272 HB ILE 38 HB ILE 38 -11.219 -1.799 -0.832
273 HG12 ILE 38 HG12 ILE 38 -10.287 0.438 -2.654
274 HG13 ILE 38 HG11 ILE 38 -10.249 0.478 -0.897
275 HG21 ILE 38 HG21 ILE 38 -11.523 -1.466 -3.815
276 HG22 ILE 38 HG22 ILE 38 -12.112 -2.819 -2.847
277 HG23 ILE 38 HG23 ILE 38 -10.374 -2.557 -3.037
278 HD11 ILE 38 HD11 ILE 38 -8.056 -0.017 -1.820
279 HD12 ILE 38 HD12 ILE 38 -8.716 -1.427 -2.651
280 HD13 ILE 38 HD13 ILE 38 -8.667 -1.387 -0.892
281 H GLY 39 HN GLY 39 -13.694 1.746 -1.159
282 HA2 GLY 39 HA2 GLY 39 -14.121 3.130 0.613
283 HA3 GLY 39 HA1 GLY 39 -14.295 1.662 1.565
284 H TYR 40 HN TYR 40 -11.485 3.047 -0.081
285 HA TYR 40 HA TYR 40 -10.206 3.027 2.524
286 HB2 TYR 40 HB2 TYR 40 -9.395 1.736 0.123
287 HB3 TYR 40 HB1 TYR 40 -8.199 2.962 0.550
288 HD1 TYR 40 HD2 TYR 40 -9.861 -0.120 1.641
289 HD2 TYR 40 HD1 TYR 40 -6.912 2.799 2.561
290 HE1 TYR 40 HE2 TYR 40 -8.980 -1.575 3.421
291 HE2 TYR 40 HE1 TYR 40 -6.031 1.363 4.338
292 HH TYR 40 HH TYR 40 -6.938 -1.889 4.664
293 H ASP 41 HN ASP 41 -9.586 4.749 3.290
294 HA ASP 41 HA ASP 41 -9.541 7.210 1.752
295 HB2 ASP 41 HB2 ASP 41 -8.946 6.662 4.673
296 HB3 ASP 41 HB1 ASP 41 -8.918 8.256 3.935
297 H SER 42 HN SER 42 -7.684 8.413 1.391
298 HA SER 42 HA SER 42 -5.332 6.948 1.085
299 HB2 SER 42 HB2 SER 42 -4.621 9.563 0.749
300 HB3 SER 42 HB1 SER 42 -5.365 8.551 -0.498
301 H LEU 43 HN LEU 43 -6.523 9.049 3.559
302 HA LEU 43 HA LEU 43 -4.255 9.298 5.167
303 HB2 LEU 43 HB2 LEU 43 -7.130 8.909 5.985
304 HB3 LEU 43 HB1 LEU 43 -5.852 9.402 7.068
305 HG LEU 43 HG LEU 43 -6.844 10.989 4.700
306 HD11 LEU 43 HD11 LEU 43 -7.765 12.482 6.387
307 HD12 LEU 43 HD12 LEU 43 -7.240 11.374 7.654
308 HD13 LEU 43 HD13 LEU 43 -8.469 10.870 6.494
309 HD21 LEU 43 HD21 LEU 43 -4.863 11.704 6.863
310 HD22 LEU 43 HD22 LEU 43 -5.470 12.797 5.617
311 HD23 LEU 43 HD23 LEU 43 -4.482 11.406 5.167
312 H ALA 44 HN ALA 44 -6.445 6.585 4.705
313 HA ALA 44 HA ALA 44 -5.300 5.019 6.821
314 HB1 ALA 44 HB1 ALA 44 -7.172 4.216 4.591
315 HB2 ALA 44 HB2 ALA 44 -7.659 4.748 6.202
316 HB3 ALA 44 HB3 ALA 44 -6.766 3.240 6.003
317 H LEU 45 HN LEU 45 -4.721 5.607 3.500
318 HA LEU 45 HA LEU 45 -3.169 3.287 2.958
319 HB2 LEU 45 HB2 LEU 45 -3.165 5.998 1.652
320 HB3 LEU 45 HB1 LEU 45 -2.270 4.615 1.055
321 HG LEU 45 HG LEU 45 -5.267 4.755 1.311
322 HD11 LEU 45 HD11 LEU 45 -3.474 4.892 -1.107
323 HD12 LEU 45 HD12 LEU 45 -4.411 6.225 -0.438
324 HD13 LEU 45 HD13 LEU 45 -5.235 4.829 -1.130
325 HD21 LEU 45 HD21 LEU 45 -4.393 2.507 1.607
326 HD22 LEU 45 HD22 LEU 45 -3.437 2.675 0.134
327 HD23 LEU 45 HD23 LEU 45 -5.200 2.654 0.044
328 H MET 46 HN MET 46 -2.554 6.269 4.531
329 HA MET 46 HA MET 46 0.298 6.095 4.482
330 HB2 MET 46 HB2 MET 46 -1.442 7.503 6.526
331 HB3 MET 46 HB1 MET 46 0.275 7.771 6.267
332 HG2 MET 46 HG2 MET 46 -0.193 8.660 4.036
333 HG3 MET 46 HG1 MET 46 -1.920 8.362 4.302
334 HE1 MET 46 HE1 MET 46 -2.462 10.835 7.425
335 HE2 MET 46 HE2 MET 46 -1.865 9.177 7.528
336 HE3 MET 46 HE3 MET 46 -3.215 9.564 6.461
337 H GLU 47 HN GLU 47 -2.241 4.753 6.390
338 HA GLU 47 HA GLU 47 -0.666 3.694 8.519
339 HB2 GLU 47 HB2 GLU 47 -3.068 4.020 8.745
340 HB3 GLU 47 HB1 GLU 47 -3.371 2.977 7.379
341 HG2 GLU 47 HG2 GLU 47 -3.944 1.834 9.408
342 HG3 GLU 47 HG1 GLU 47 -2.560 1.055 8.658
343 H THR 48 HN THR 48 -1.983 2.419 5.459
344 HA THR 48 HA THR 48 -0.995 -0.147 5.409
345 HB THR 48 HB THR 48 -1.017 1.786 3.070
346 HG1 THR 48 HG1 THR 48 -3.207 0.309 4.183
347 HG21 THR 48 HG21 THR 48 -0.096 -0.446 2.613
348 HG22 THR 48 HG22 THR 48 -1.636 -0.206 1.784
349 HG23 THR 48 HG23 THR 48 -1.568 -1.178 3.255
350 H ALA 49 HN ALA 49 0.511 2.839 4.187
351 HA ALA 49 HA ALA 49 2.991 1.837 3.447
352 HB1 ALA 49 HB1 ALA 49 2.338 4.597 4.465
353 HB2 ALA 49 HB2 ALA 49 2.157 4.046 2.801
354 HB3 ALA 49 HB3 ALA 49 3.762 4.148 3.530
355 H ALA 50 HN ALA 50 2.036 3.374 6.522
356 HA ALA 50 HA ALA 50 4.478 3.298 7.829
357 HB1 ALA 50 HB1 ALA 50 3.221 3.548 9.889
358 HB2 ALA 50 HB2 ALA 50 1.743 3.043 9.065
359 HB3 ALA 50 HB3 ALA 50 2.530 4.553 8.615
360 H ARG 51 HN ARG 51 1.934 0.857 7.763
361 HA ARG 51 HA ARG 51 2.991 -1.026 9.526
362 HB2 ARG 51 HB2 ARG 51 1.403 -1.422 6.989
363 HB3 ARG 51 HB1 ARG 51 1.810 -2.737 8.077
364 HG2 ARG 51 HG2 ARG 51 0.214 -0.306 8.839
365 HG3 ARG 51 HG1 ARG 51 -0.468 -1.878 8.401
366 HD2 ARG 51 HD2 ARG 51 0.781 -2.905 10.243
367 HD3 ARG 51 HD1 ARG 51 1.400 -1.318 10.690
368 HE ARG 51 HE ARG 51 -0.916 -0.679 11.082
369 HH11 ARG 51 HH11 ARG 51 -0.153 -4.193 11.004
370 HH12 ARG 51 HH12 ARG 51 -1.226 -4.566 12.265
371 HH21 ARG 51 HH21 ARG 51 -2.424 -1.317 12.846
372 HH22 ARG 51 HH22 ARG 51 -2.565 -2.987 13.248
373 H LEU 52 HN LEU 52 3.524 -0.648 6.111
374 HA LEU 52 HA LEU 52 5.405 -2.768 5.956
375 HB2 LEU 52 HB2 LEU 52 4.728 -0.587 4.003
376 HB3 LEU 52 HB1 LEU 52 5.784 -1.947 3.648
377 HG LEU 52 HG LEU 52 2.882 -2.201 4.441
378 HD11 LEU 52 HD11 LEU 52 3.087 -1.171 2.264
379 HD12 LEU 52 HD12 LEU 52 2.506 -2.832 2.116
380 HD13 LEU 52 HD13 LEU 52 4.192 -2.446 1.758
381 HD21 LEU 52 HD21 LEU 52 4.865 -4.234 3.437
382 HD22 LEU 52 HD22 LEU 52 3.153 -4.529 3.733
383 HD23 LEU 52 HD23 LEU 52 4.226 -4.126 5.077
384 H GLU 53 HN GLU 53 5.714 0.717 6.397
385 HA GLU 53 HA GLU 53 8.482 0.936 6.012
386 HB2 GLU 53 HB2 GLU 53 6.729 2.428 7.952
387 HB3 GLU 53 HB1 GLU 53 8.400 2.831 7.627
388 HG2 GLU 53 HG2 GLU 53 7.803 3.265 5.286
389 HG3 GLU 53 HG1 GLU 53 6.114 2.936 5.689
390 H SER 54 HN SER 54 6.713 0.490 9.048
391 HA SER 54 HA SER 54 8.975 0.140 10.660
392 HB2 SER 54 HB2 SER 54 6.182 -0.900 11.143
393 HB3 SER 54 HB1 SER 54 7.404 -0.515 12.360
394 HG SER 54 HG SER 54 5.588 1.104 11.302
395 H ARG 55 HN ARG 55 7.318 -2.020 8.600
396 HA ARG 55 HA ARG 55 8.317 -4.436 9.844
397 HB2 ARG 55 HB2 ARG 55 6.066 -4.349 8.872
398 HB3 ARG 55 HB1 ARG 55 6.751 -3.982 7.304
399 HG2 ARG 55 HG2 ARG 55 7.718 -6.189 7.180
400 HG3 ARG 55 HG1 ARG 55 7.146 -6.555 8.812
401 HD2 ARG 55 HD2 ARG 55 4.843 -6.348 8.107
402 HD3 ARG 55 HD1 ARG 55 5.345 -5.811 6.504
403 HE ARG 55 HE ARG 55 6.136 -8.437 7.485
404 HH11 ARG 55 HH11 ARG 55 3.919 -6.612 5.405
405 HH12 ARG 55 HH12 ARG 55 3.951 -7.752 4.121
406 HH21 ARG 55 HH21 ARG 55 6.010 -10.091 5.774
407 HH22 ARG 55 HH22 ARG 55 5.059 -9.781 4.375
408 H TYR 56 HN TYR 56 8.783 -2.791 6.692
409 HA TYR 56 HA TYR 56 10.939 -4.628 6.107
410 HB2 TYR 56 HB2 TYR 56 9.499 -2.616 4.412
411 HB3 TYR 56 HB1 TYR 56 10.945 -3.447 3.848
412 HD1 TYR 56 HD1 TYR 56 7.410 -3.860 4.782
413 HD2 TYR 56 HD2 TYR 56 10.901 -5.784 3.313
414 HE1 TYR 56 HE1 TYR 56 6.063 -5.812 4.136
415 HE2 TYR 56 HE2 TYR 56 9.564 -7.729 2.660
416 HH TYR 56 HH TYR 56 6.084 -7.731 2.736
417 H GLY 57 HN GLY 57 10.667 -1.404 7.253
418 HA2 GLY 57 HA2 GLY 57 12.442 -0.178 8.097
419 HA3 GLY 57 HA1 GLY 57 13.564 -1.231 7.241
420 H VAL 58 HN VAL 58 10.819 0.315 5.789
421 HA VAL 58 HA VAL 58 12.659 1.843 4.111
422 HB VAL 58 HB VAL 58 10.765 2.105 2.488
423 HG11 VAL 58 HG11 VAL 58 12.465 0.431 2.144
424 HG12 VAL 58 HG12 VAL 58 10.889 -0.161 1.607
425 HG13 VAL 58 HG13 VAL 58 11.562 -0.710 3.147
426 HG21 VAL 58 HG21 VAL 58 8.834 0.597 2.669
427 HG22 VAL 58 HG22 VAL 58 8.894 1.734 4.015
428 HG23 VAL 58 HG23 VAL 58 9.407 0.061 4.248
429 H SER 59 HN SER 59 11.465 3.883 3.159
430 HA SER 59 HA SER 59 10.300 5.311 5.441
431 HB2 SER 59 HB2 SER 59 12.318 6.403 3.470
432 HB3 SER 59 HB1 SER 59 11.709 7.192 4.927
433 HG SER 59 HG SER 59 12.718 5.572 6.164
434 H ILE 60 HN ILE 60 8.271 5.714 4.778
435 HA ILE 60 HA ILE 60 7.870 6.611 2.002
436 HB ILE 60 HB ILE 60 5.894 5.071 3.712
437 HG12 ILE 60 HG12 ILE 60 7.438 4.121 1.286
438 HG13 ILE 60 HG11 ILE 60 7.854 3.715 2.948
439 HG21 ILE 60 HG21 ILE 60 4.576 4.935 1.641
440 HG22 ILE 60 HG22 ILE 60 5.778 5.926 0.812
441 HG23 ILE 60 HG23 ILE 60 4.832 6.610 2.133
442 HD11 ILE 60 HD11 ILE 60 5.304 2.998 1.531
443 HD12 ILE 60 HD12 ILE 60 5.703 2.592 3.201
444 HD13 ILE 60 HD13 ILE 60 6.650 1.912 1.875
445 HA PRO 61 HA PRO 61 6.496 10.236 4.331
446 HB2 PRO 61 HB2 PRO 61 6.087 11.247 1.573
447 HB3 PRO 61 HB1 PRO 61 7.019 11.957 2.898
448 HG2 PRO 61 HG2 PRO 61 8.244 10.843 0.806
449 HG3 PRO 61 HG1 PRO 61 8.891 10.667 2.450
450 HD2 PRO 61 HD2 PRO 61 7.307 8.715 0.821
451 HD3 PRO 61 HD1 PRO 61 8.730 8.429 1.848
452 H ASP 62 HN ASP 62 4.516 10.832 4.848
453 HA ASP 62 HA ASP 62 2.312 9.233 4.135
454 HB2 ASP 62 HB2 ASP 62 0.991 10.609 5.639
455 HB3 ASP 62 HB1 ASP 62 2.556 10.289 6.357
456 H ASP 63 HN ASP 63 3.404 12.310 2.981
457 HA ASP 63 HA ASP 63 1.134 13.225 1.586
458 HB2 ASP 63 HB2 ASP 63 3.095 14.625 1.968
459 HB3 ASP 63 HB1 ASP 63 4.076 13.558 0.971
460 H VAL 64 HN VAL 64 3.507 10.865 0.845
461 HA VAL 64 HA VAL 64 2.968 10.582 -1.973
462 HB VAL 64 HB VAL 64 4.376 8.797 -0.030
463 HG11 VAL 64 HG11 VAL 64 3.763 7.618 -2.105
464 HG12 VAL 64 HG12 VAL 64 5.510 7.862 -2.067
465 HG13 VAL 64 HG13 VAL 64 4.497 8.899 -3.073
466 HG21 VAL 64 HG21 VAL 64 6.469 9.792 -0.910
467 HG22 VAL 64 HG22 VAL 64 5.432 10.969 -0.104
468 HG23 VAL 64 HG23 VAL 64 5.501 10.915 -1.865
469 H ALA 65 HN ALA 65 2.359 8.718 0.967
470 HA ALA 65 HA ALA 65 1.084 6.525 -0.199
471 HB1 ALA 65 HB1 ALA 65 1.945 6.511 2.079
472 HB2 ALA 65 HB2 ALA 65 0.242 6.033 2.045
473 HB3 ALA 65 HB3 ALA 65 0.697 7.655 2.560
474 H GLY 66 HN GLY 66 -0.201 9.643 0.773
475 HA2 GLY 66 HA2 GLY 66 -2.925 8.813 0.261
476 HA3 GLY 66 HA1 GLY 66 -2.384 10.422 0.715
477 H ARG 67 HN ARG 67 -0.456 9.518 -1.756
478 HA ARG 67 HA ARG 67 -2.004 11.120 -3.651
479 HB2 ARG 67 HB2 ARG 67 0.203 11.936 -3.123
480 HB3 ARG 67 HB1 ARG 67 0.910 10.374 -3.482
481 HG2 ARG 67 HG2 ARG 67 0.367 10.686 -5.853
482 HG3 ARG 67 HG1 ARG 67 -0.319 12.272 -5.473
483 HD2 ARG 67 HD2 ARG 67 1.782 13.075 -4.693
484 HD3 ARG 67 HD1 ARG 67 2.494 11.471 -4.786
485 HE ARG 67 HE ARG 67 1.595 12.308 -7.340
486 HH11 ARG 67 HH11 ARG 67 4.146 12.952 -4.977
487 HH12 ARG 67 HH12 ARG 67 5.336 13.345 -6.125
488 HH21 ARG 67 HH21 ARG 67 3.159 12.818 -8.921
489 HH22 ARG 67 HH22 ARG 67 4.747 13.296 -8.473
490 H VAL 68 HN VAL 68 -1.085 7.883 -3.081
491 HA VAL 68 HA VAL 68 -0.853 7.074 -5.801
492 HB VAL 68 HB VAL 68 -0.927 4.733 -4.983
493 HG11 VAL 68 HG11 VAL 68 0.876 6.548 -3.396
494 HG12 VAL 68 HG12 VAL 68 1.181 5.901 -5.012
495 HG13 VAL 68 HG13 VAL 68 1.113 4.815 -3.627
496 HG21 VAL 68 HG21 VAL 68 -1.005 4.267 -2.572
497 HG22 VAL 68 HG22 VAL 68 -2.515 4.989 -3.135
498 HG23 VAL 68 HG23 VAL 68 -1.342 5.969 -2.258
499 H ASP 69 HN ASP 69 -2.287 6.654 -7.240
500 HA ASP 69 HA ASP 69 -5.110 6.929 -6.687
501 HB2 ASP 69 HB2 ASP 69 -3.719 6.197 -9.278
502 HB3 ASP 69 HB1 ASP 69 -5.436 6.530 -9.111
503 H THR 70 HN THR 70 -2.989 4.316 -7.719
504 HA THR 70 HA THR 70 -5.101 2.382 -7.080
505 HB THR 70 HB THR 70 -4.011 0.934 -8.848
506 HG1 THR 70 HG1 THR 70 -2.754 2.034 -10.417
507 HG21 THR 70 HG21 THR 70 -6.127 2.091 -9.303
508 HG22 THR 70 HG22 THR 70 -5.120 2.038 -10.748
509 HG23 THR 70 HG23 THR 70 -5.238 3.526 -9.809
510 HA PRO 71 HA PRO 71 -2.110 0.400 -4.403
511 HB2 PRO 71 HB2 PRO 71 -3.019 -2.167 -5.619
512 HB3 PRO 71 HB1 PRO 71 -2.955 -1.691 -3.915
513 HG2 PRO 71 HG2 PRO 71 -5.282 -1.775 -5.157
514 HG3 PRO 71 HG1 PRO 71 -4.910 -0.426 -4.064
515 HD2 PRO 71 HD2 PRO 71 -4.821 -0.516 -7.060
516 HD3 PRO 71 HD1 PRO 71 -5.488 0.742 -5.992
517 H ARG 72 HN ARG 72 -2.208 -0.298 -7.808
518 HA ARG 72 HA ARG 72 0.156 -1.701 -8.281
519 HB2 ARG 72 HB2 ARG 72 -1.490 -1.084 -10.025
520 HB3 ARG 72 HB1 ARG 72 -1.000 0.596 -9.882
521 HG2 ARG 72 HG2 ARG 72 0.097 -0.167 -11.793
522 HG3 ARG 72 HG1 ARG 72 1.336 -0.217 -10.539
523 HD2 ARG 72 HD2 ARG 72 1.476 -2.237 -11.826
524 HD3 ARG 72 HD1 ARG 72 0.818 -2.641 -10.237
525 HE ARG 72 HE ARG 72 -1.402 -2.219 -11.728
526 HH11 ARG 72 HH11 ARG 72 1.421 -4.339 -12.316
527 HH12 ARG 72 HH12 ARG 72 0.494 -5.449 -13.199
528 HH21 ARG 72 HH21 ARG 72 -2.538 -3.670 -12.950
529 HH22 ARG 72 HH22 ARG 72 -1.793 -5.068 -13.634
530 H GLU 73 HN GLU 73 -0.401 1.763 -7.893
531 HA GLU 73 HA GLU 73 2.255 2.626 -8.370
532 HB2 GLU 73 HB2 GLU 73 0.128 3.969 -8.576
533 HB3 GLU 73 HB1 GLU 73 0.072 4.029 -6.825
534 HG2 GLU 73 HG2 GLU 73 0.977 6.081 -7.685
535 HG3 GLU 73 HG1 GLU 73 2.231 5.191 -6.821
536 H LEU 74 HN LEU 74 0.354 1.901 -5.536
537 HA LEU 74 HA LEU 74 2.147 2.689 -3.508
538 HB2 LEU 74 HB2 LEU 74 -0.384 2.080 -3.432
539 HB3 LEU 74 HB1 LEU 74 0.142 0.423 -3.346
540 HG LEU 74 HG LEU 74 0.707 2.545 -1.250
541 HD11 LEU 74 HD11 LEU 74 -1.291 0.303 -1.274
542 HD12 LEU 74 HD12 LEU 74 -1.642 2.027 -1.391
543 HD13 LEU 74 HD13 LEU 74 -0.943 1.367 0.088
544 HD21 LEU 74 HD21 LEU 74 1.385 0.677 0.168
545 HD22 LEU 74 HD22 LEU 74 2.402 0.748 -1.272
546 HD23 LEU 74 HD23 LEU 74 1.114 -0.450 -1.160
547 H LEU 75 HN LEU 75 1.558 -0.408 -5.126
548 HA LEU 75 HA LEU 75 3.409 -2.055 -3.849
549 HB2 LEU 75 HB2 LEU 75 1.632 -2.832 -5.355
550 HB3 LEU 75 HB1 LEU 75 2.451 -2.098 -6.713
551 HG LEU 75 HG LEU 75 4.355 -3.674 -6.337
552 HD11 LEU 75 HD11 LEU 75 3.971 -5.640 -4.951
553 HD12 LEU 75 HD12 LEU 75 2.442 -4.953 -4.402
554 HD13 LEU 75 HD13 LEU 75 3.963 -4.158 -3.997
555 HD21 LEU 75 HD21 LEU 75 3.207 -5.617 -7.292
556 HD22 LEU 75 HD22 LEU 75 2.665 -4.110 -8.034
557 HD23 LEU 75 HD23 LEU 75 1.653 -4.918 -6.837
558 H ASP 76 HN ASP 76 3.735 -0.291 -6.921
559 HA ASP 76 HA ASP 76 6.388 -1.006 -7.471
560 HB2 ASP 76 HB2 ASP 76 4.884 -0.081 -9.171
561 HB3 ASP 76 HB1 ASP 76 4.924 1.482 -8.363
562 H LEU 77 HN LEU 77 5.078 1.664 -5.657
563 HA LEU 77 HA LEU 77 7.326 3.267 -5.309
564 HB2 LEU 77 HB2 LEU 77 5.109 3.935 -4.594
565 HB3 LEU 77 HB1 LEU 77 5.062 2.646 -3.412
566 HG LEU 77 HG LEU 77 6.951 3.769 -2.221
567 HD11 LEU 77 HD11 LEU 77 7.396 6.117 -2.698
568 HD12 LEU 77 HD12 LEU 77 6.361 6.024 -4.122
569 HD13 LEU 77 HD13 LEU 77 7.850 5.077 -4.049
570 HD21 LEU 77 HD21 LEU 77 4.651 3.980 -1.472
571 HD22 LEU 77 HD22 LEU 77 4.404 5.345 -2.559
572 HD23 LEU 77 HD23 LEU 77 5.532 5.484 -1.210
573 H ILE 78 HN ILE 78 6.121 0.632 -3.313
574 HA ILE 78 HA ILE 78 8.388 0.817 -1.605
575 HB ILE 78 HB ILE 78 6.237 -1.317 -1.608
576 HG12 ILE 78 HG12 ILE 78 6.432 1.275 -0.063
577 HG13 ILE 78 HG11 ILE 78 5.390 1.008 -1.454
578 HG21 ILE 78 HG21 ILE 78 8.175 -0.381 0.537
579 HG22 ILE 78 HG22 ILE 78 8.278 -1.914 -0.322
580 HG23 ILE 78 HG23 ILE 78 6.918 -1.597 0.759
581 HD11 ILE 78 HD11 ILE 78 5.234 -0.434 1.170
582 HD12 ILE 78 HD12 ILE 78 4.175 -0.682 -0.216
583 HD13 ILE 78 HD13 ILE 78 4.173 0.865 0.630
584 H ASN 79 HN ASN 79 7.494 -1.196 -4.335
585 HA ASN 79 HA ASN 79 9.580 -3.100 -3.922
586 HB2 ASN 79 HB2 ASN 79 8.074 -2.342 -6.428
587 HB3 ASN 79 HB1 ASN 79 9.471 -3.399 -6.518
588 HD21 ASN 79 HD21 ASN 79 6.984 -3.358 -3.985
589 HD22 ASN 79 HD22 ASN 79 6.408 -4.954 -4.377
590 H GLY 80 HN GLY 80 9.440 -0.036 -5.610
591 HA2 GLY 80 HA2 GLY 80 12.096 -0.066 -6.552
592 HA3 GLY 80 HA1 GLY 80 11.105 1.367 -6.281
593 H ALA 81 HN ALA 81 10.600 1.324 -3.662
594 HA ALA 81 HA ALA 81 12.833 2.384 -2.456
595 HB1 ALA 81 HB1 ALA 81 10.539 2.741 -1.658
596 HB2 ALA 81 HB2 ALA 81 11.614 2.240 -0.355
597 HB3 ALA 81 HB3 ALA 81 10.492 1.080 -1.069
598 H LEU 82 HN LEU 82 11.565 -0.918 -2.131
599 HA LEU 82 HA LEU 82 13.482 -1.856 -0.301
600 HB2 LEU 82 HB2 LEU 82 11.851 -3.353 -2.341
601 HB3 LEU 82 HB1 LEU 82 12.821 -4.126 -1.106
602 HG LEU 82 HG LEU 82 10.484 -2.297 -0.549
603 HD11 LEU 82 HD11 LEU 82 9.300 -4.335 0.080
604 HD12 LEU 82 HD12 LEU 82 10.677 -5.303 -0.443
605 HD13 LEU 82 HD13 LEU 82 9.764 -4.362 -1.619
606 HD21 LEU 82 HD21 LEU 82 12.113 -4.083 1.244
607 HD22 LEU 82 HD22 LEU 82 10.679 -3.164 1.720
608 HD23 LEU 82 HD23 LEU 82 12.146 -2.318 1.217
609 H ALA 83 HN ALA 83 13.536 -1.656 -3.808
610 HA ALA 83 HA ALA 83 15.773 -3.355 -4.154
611 HB1 ALA 83 HB1 ALA 83 14.731 -1.217 -6.007
612 HB2 ALA 83 HB2 ALA 83 14.179 -2.893 -5.957
613 HB3 ALA 83 HB3 ALA 83 15.836 -2.524 -6.438
614 H GLU 84 HN GLU 84 15.448 0.019 -3.372
615 HA GLU 84 HA GLU 84 18.366 0.207 -3.487
616 HB2 GLU 84 HB2 GLU 84 16.324 2.433 -3.343
617 HB3 GLU 84 HB1 GLU 84 18.045 2.686 -3.157
618 HG2 GLU 84 HG2 GLU 84 17.747 3.244 -5.347
619 HG3 GLU 84 HG1 GLU 84 18.181 1.546 -5.496
620 H ALA 85 HN ALA 85 16.480 -0.971 -1.389
621 HA ALA 85 HA ALA 85 17.496 0.580 0.899
622 HB1 ALA 85 HB1 ALA 85 15.045 0.411 0.824
623 HB2 ALA 85 HB2 ALA 85 15.721 -0.369 2.256
624 HB3 ALA 85 HB3 ALA 85 15.176 -1.346 0.894
625 H ALA 86 HN ALA 86 16.838 -2.811 -0.049
626 HA ALA 86 HA ALA 86 19.280 -3.607 1.242
627 HB1 ALA 86 HB1 ALA 86 16.619 -4.718 2.149
628 HB2 ALA 86 HB2 ALA 86 17.671 -3.669 3.100
629 HB3 ALA 86 HB3 ALA 86 18.206 -5.290 2.660
630 H28 SXV 87 H28A SXV 87 -5.609 13.527 1.924
631 H28A SXV 87 H28B SXV 87 -5.212 12.539 3.335
632 H30 SXV 87 H30C SXV 87 -2.903 11.063 2.309
633 H30A SXV 87 H30A SXV 87 -2.972 11.920 3.850
634 H30B SXV 87 H30B SXV 87 -1.649 12.231 2.728
635 H31 SXV 87 H31C SXV 87 -3.310 12.280 0.171
636 H31A SXV 87 H31A SXV 87 -2.097 13.497 0.577
637 H31B SXV 87 H31B SXV 87 -3.747 13.989 0.201
638 H32 SXV 87 H32A SXV 87 -3.333 14.336 3.952
639 HO33 SXV 87 H33A SXV 87 -4.664 15.783 3.320
640 HN36 SXV 87 H36A SXV 87 -2.877 16.607 1.997
641 H37 SXV 87 H37B SXV 87 -0.034 16.441 1.331
642 H37A SXV 87 H37A SXV 87 -0.493 17.672 2.509
643 H38 SXV 87 H38B SXV 87 -1.561 17.427 -0.305
644 H38A SXV 87 H38A SXV 87 -0.347 18.589 0.240
645 HN41 SXV 87 H41A SXV 87 -2.750 19.164 -1.016
646 H42 SXV 87 H42B SXV 87 -3.699 21.412 -0.246
647 H42A SXV 87 H42A SXV 87 -4.524 20.415 0.943
648 H43 SXV 87 H43B SXV 87 -4.616 19.983 -2.028
649 H43A SXV 87 H43A SXV 87 -5.620 19.180 -0.840
650 H1 SXV 87 H1B SXV 87 -6.717 20.350 -3.422
651 H1A SXV 87 H1A SXV 87 -7.818 19.721 -2.184
652 H2 SXV 87 H2A SXV 87 -8.083 22.373 -3.478
653 H2A SXV 87 H2B SXV 87 -9.161 21.694 -2.250
654 H4 SXV 87 H4C SXV 87 -11.166 19.754 -4.029
655 H4A SXV 87 H4A SXV 87 -10.004 19.355 -2.757
656 H4B SXV 87 H4B SXV 87 -9.778 18.720 -4.393
Start of MODEL 2
1 H1 MET 1 HT1 MET 1 20.262 -10.564 -3.714
2 H2 MET 1 HT2 MET 1 20.593 -9.266 -4.742
3 H3 MET 1 HT3 MET 1 20.539 -10.829 -5.383
4 HA MET 1 HA MET 1 18.600 -9.556 -5.924
5 HB2 MET 1 HB2 MET 1 18.125 -11.762 -3.911
6 HB3 MET 1 HB1 MET 1 16.810 -10.977 -4.766
7 HG2 MET 1 HG2 MET 1 17.867 -11.691 -6.898
8 HG3 MET 1 HG1 MET 1 19.038 -12.610 -5.946
9 HE1 MET 1 HE1 MET 1 16.632 -15.322 -7.510
10 HE2 MET 1 HE2 MET 1 18.293 -14.745 -7.407
11 HE3 MET 1 HE3 MET 1 17.074 -13.780 -8.245
12 H ALA 2 HN ALA 2 16.389 -8.971 -4.882
13 HA ALA 2 HA ALA 2 16.843 -7.528 -2.392
14 HB1 ALA 2 HB1 ALA 2 15.403 -6.506 -4.853
15 HB2 ALA 2 HB2 ALA 2 16.951 -5.915 -4.245
16 HB3 ALA 2 HB3 ALA 2 15.485 -5.681 -3.297
17 H THR 3 HN THR 3 15.339 -8.036 -0.954
18 HA THR 3 HA THR 3 13.283 -9.894 -1.553
19 HB THR 3 HB THR 3 12.673 -9.225 0.904
20 HG1 THR 3 HG1 THR 3 13.834 -7.688 1.713
21 HG21 THR 3 HG21 THR 3 13.817 -11.317 0.290
22 HG22 THR 3 HG22 THR 3 14.490 -10.642 1.769
23 HG23 THR 3 HG23 THR 3 15.357 -10.457 0.241
24 H LEU 4 HN LEU 4 11.560 -9.235 -2.711
25 HA LEU 4 HA LEU 4 10.467 -6.564 -2.212
26 HB2 LEU 4 HB2 LEU 4 10.175 -8.333 -4.638
27 HB3 LEU 4 HB1 LEU 4 9.466 -6.746 -4.444
28 HG LEU 4 HG LEU 4 12.419 -7.353 -4.630
29 HD11 LEU 4 HD11 LEU 4 12.279 -6.208 -6.784
30 HD12 LEU 4 HD12 LEU 4 10.533 -6.053 -6.590
31 HD13 LEU 4 HD13 LEU 4 11.269 -7.651 -6.743
32 HD21 LEU 4 HD21 LEU 4 12.707 -4.926 -4.738
33 HD22 LEU 4 HD22 LEU 4 11.983 -5.415 -3.206
34 HD23 LEU 4 HD23 LEU 4 10.980 -4.703 -4.468
35 H LEU 5 HN LEU 5 8.215 -6.349 -2.090
36 HA LEU 5 HA LEU 5 6.915 -8.784 -1.274
37 HB2 LEU 5 HB2 LEU 5 5.116 -7.288 -0.343
38 HB3 LEU 5 HB1 LEU 5 6.676 -7.137 0.417
39 HG LEU 5 HG LEU 5 6.988 -5.007 -0.960
40 HD11 LEU 5 HD11 LEU 5 4.977 -3.873 -1.728
41 HD12 LEU 5 HD12 LEU 5 4.025 -5.317 -1.376
42 HD13 LEU 5 HD13 LEU 5 5.263 -5.360 -2.630
43 HD21 LEU 5 HD21 LEU 5 4.778 -5.118 1.077
44 HD22 LEU 5 HD22 LEU 5 5.663 -3.671 0.589
45 HD23 LEU 5 HD23 LEU 5 6.502 -4.986 1.410
46 H THR 6 HN THR 6 5.105 -9.527 -2.148
47 HA THR 6 HA THR 6 4.681 -8.654 -4.881
48 HB THR 6 HB THR 6 3.551 -10.873 -5.155
49 HG1 THR 6 HG1 THR 6 4.464 -11.265 -2.447
50 HG21 THR 6 HG21 THR 6 5.906 -10.582 -5.741
51 HG22 THR 6 HG22 THR 6 5.627 -12.196 -5.085
52 HG23 THR 6 HG23 THR 6 6.373 -10.950 -4.082
53 H THR 7 HN THR 7 2.120 -9.643 -5.369
54 HA THR 7 HA THR 7 0.642 -7.541 -4.203
55 HB THR 7 HB THR 7 -1.244 -8.550 -5.609
56 HG1 THR 7 HG1 THR 7 -0.484 -10.018 -7.219
57 HG21 THR 7 HG21 THR 7 -0.258 -7.739 -7.707
58 HG22 THR 7 HG22 THR 7 1.343 -7.781 -6.965
59 HG23 THR 7 HG23 THR 7 0.121 -6.663 -6.361
60 H ASP 8 HN ASP 8 0.993 -10.930 -3.639
61 HA ASP 8 HA ASP 8 -1.287 -11.213 -1.943
62 HB2 ASP 8 HB2 ASP 8 1.278 -12.840 -2.009
63 HB3 ASP 8 HB1 ASP 8 -0.105 -13.229 -1.002
64 H ASP 9 HN ASP 9 2.060 -10.390 -1.440
65 HA ASP 9 HA ASP 9 1.966 -10.206 1.396
66 HB2 ASP 9 HB2 ASP 9 3.766 -8.665 -0.489
67 HB3 ASP 9 HB1 ASP 9 3.992 -8.824 1.244
68 H LEU 10 HN LEU 10 1.587 -7.853 -1.177
69 HA LEU 10 HA LEU 10 1.220 -5.592 0.390
70 HB2 LEU 10 HB2 LEU 10 1.634 -5.606 -2.060
71 HB3 LEU 10 HB1 LEU 10 -0.007 -6.154 -2.307
72 HG LEU 10 HG LEU 10 -0.864 -4.048 -1.381
73 HD11 LEU 10 HD11 LEU 10 0.956 -3.557 0.159
74 HD12 LEU 10 HD12 LEU 10 0.673 -2.195 -0.930
75 HD13 LEU 10 HD13 LEU 10 2.043 -3.273 -1.200
76 HD21 LEU 10 HD21 LEU 10 -0.468 -4.230 -3.786
77 HD22 LEU 10 HD22 LEU 10 1.188 -3.673 -3.562
78 HD23 LEU 10 HD23 LEU 10 -0.161 -2.589 -3.219
79 H ARG 11 HN ARG 11 -1.188 -7.947 -0.755
80 HA ARG 11 HA ARG 11 -3.425 -6.629 0.334
81 HB2 ARG 11 HB2 ARG 11 -2.931 -9.513 -0.311
82 HB3 ARG 11 HB1 ARG 11 -4.412 -9.003 0.486
83 HG2 ARG 11 HG2 ARG 11 -4.864 -7.494 -1.381
84 HG3 ARG 11 HG1 ARG 11 -3.406 -8.078 -2.182
85 HD2 ARG 11 HD2 ARG 11 -5.648 -9.881 -1.318
86 HD3 ARG 11 HD1 ARG 11 -5.578 -9.128 -2.910
87 HE ARG 11 HE ARG 11 -3.716 -11.096 -1.814
88 HH11 ARG 11 HH11 ARG 11 -5.221 -9.413 -4.523
89 HH12 ARG 11 HH12 ARG 11 -4.430 -10.288 -5.746
90 HH21 ARG 11 HH21 ARG 11 -2.589 -12.386 -3.543
91 HH22 ARG 11 HH22 ARG 11 -2.891 -11.979 -5.162
92 H ARG 12 HN ARG 12 -1.345 -9.101 1.696
93 HA ARG 12 HA ARG 12 -2.737 -9.378 4.136
94 HB2 ARG 12 HB2 ARG 12 0.188 -9.878 3.573
95 HB3 ARG 12 HB1 ARG 12 -0.693 -10.455 4.978
96 HG2 ARG 12 HG2 ARG 12 -2.136 -11.795 3.506
97 HG3 ARG 12 HG1 ARG 12 -1.202 -11.236 2.115
98 HD2 ARG 12 HD2 ARG 12 -0.153 -12.831 4.451
99 HD3 ARG 12 HD1 ARG 12 -0.463 -13.443 2.825
100 HE ARG 12 HE ARG 12 1.292 -11.912 2.066
101 HH11 ARG 12 HH11 ARG 12 1.252 -12.999 5.431
102 HH12 ARG 12 HH12 ARG 12 2.894 -12.735 5.723
103 HH21 ARG 12 HH21 ARG 12 3.653 -11.556 2.434
104 HH22 ARG 12 HH22 ARG 12 4.287 -11.795 3.961
105 H ALA 13 HN ALA 13 -0.273 -7.176 3.093
106 HA ALA 13 HA ALA 13 0.263 -6.050 5.663
107 HB1 ALA 13 HB1 ALA 13 1.905 -5.985 3.891
108 HB2 ALA 13 HB2 ALA 13 1.446 -4.349 4.401
109 HB3 ALA 13 HB3 ALA 13 0.809 -5.013 2.903
110 H LEU 14 HN LEU 14 -1.818 -5.233 2.947
111 HA LEU 14 HA LEU 14 -2.574 -2.674 3.871
112 HB2 LEU 14 HB2 LEU 14 -2.811 -3.577 1.525
113 HB3 LEU 14 HB1 LEU 14 -4.158 -4.535 2.090
114 HG LEU 14 HG LEU 14 -5.388 -2.459 2.626
115 HD11 LEU 14 HD11 LEU 14 -4.533 -0.319 1.816
116 HD12 LEU 14 HD12 LEU 14 -3.022 -1.100 1.348
117 HD13 LEU 14 HD13 LEU 14 -3.475 -1.007 3.050
118 HD21 LEU 14 HD21 LEU 14 -4.343 -2.610 -0.201
119 HD22 LEU 14 HD22 LEU 14 -5.817 -1.788 0.316
120 HD23 LEU 14 HD23 LEU 14 -5.688 -3.541 0.459
121 H VAL 15 HN VAL 15 -3.777 -5.904 4.450
122 HA VAL 15 HA VAL 15 -6.173 -5.282 5.770
123 HB VAL 15 HB VAL 15 -4.360 -7.683 6.243
124 HG11 VAL 15 HG11 VAL 15 -5.926 -7.410 8.089
125 HG12 VAL 15 HG12 VAL 15 -6.354 -8.817 7.115
126 HG13 VAL 15 HG13 VAL 15 -7.269 -7.315 6.951
127 HG21 VAL 15 HG21 VAL 15 -6.766 -7.369 4.455
128 HG22 VAL 15 HG22 VAL 15 -5.884 -8.869 4.730
129 HG23 VAL 15 HG23 VAL 15 -5.091 -7.515 3.925
130 H GLU 16 HN GLU 16 -2.884 -4.995 6.822
131 HA GLU 16 HA GLU 16 -3.283 -5.169 9.606
132 HB2 GLU 16 HB2 GLU 16 -1.086 -3.743 8.083
133 HB3 GLU 16 HB1 GLU 16 -1.096 -4.042 9.808
134 HG2 GLU 16 HG2 GLU 16 -1.109 -6.456 9.396
135 HG3 GLU 16 HG1 GLU 16 -1.067 -6.147 7.662
136 H SER 17 HN SER 17 -3.993 -2.618 7.393
137 HA SER 17 HA SER 17 -4.255 -0.752 9.629
138 HB2 SER 17 HB2 SER 17 -4.423 -0.212 6.670
139 HB3 SER 17 HB1 SER 17 -4.427 1.000 7.954
140 HG SER 17 HG SER 17 -2.374 -0.002 8.598
141 H ALA 18 HN ALA 18 -6.131 -2.405 7.169
142 HA ALA 18 HA ALA 18 -8.551 -0.992 7.744
143 HB1 ALA 18 HB1 ALA 18 -8.177 -2.083 5.581
144 HB2 ALA 18 HB2 ALA 18 -9.640 -2.684 6.368
145 HB3 ALA 18 HB3 ALA 18 -8.167 -3.654 6.384
146 H GLY 19 HN GLY 19 -7.075 -3.992 8.825
147 HA2 GLY 19 HA2 GLY 19 -7.439 -5.131 10.776
148 HA3 GLY 19 HA1 GLY 19 -8.792 -4.057 11.133
149 H GLU 20 HN GLU 20 -10.689 -4.331 9.857
150 HA GLU 20 HA GLU 20 -11.148 -7.151 9.220
151 HB2 GLU 20 HB2 GLU 20 -13.007 -5.069 10.365
152 HB3 GLU 20 HB1 GLU 20 -13.549 -6.636 9.777
153 HG2 GLU 20 HG2 GLU 20 -11.537 -6.250 11.985
154 HG3 GLU 20 HG1 GLU 20 -13.261 -6.529 12.234
155 H THR 21 HN THR 21 -10.835 -7.201 7.103
156 HA THR 21 HA THR 21 -12.573 -5.532 5.464
157 HB THR 21 HB THR 21 -10.452 -4.515 5.134
158 HG1 THR 21 HG1 THR 21 -11.253 -4.693 3.147
159 HG21 THR 21 HG21 THR 21 -8.377 -5.727 4.566
160 HG22 THR 21 HG22 THR 21 -9.234 -7.258 4.749
161 HG23 THR 21 HG23 THR 21 -9.001 -6.209 6.145
162 H ASP 22 HN ASP 22 -14.045 -7.117 5.220
163 HA ASP 22 HA ASP 22 -13.107 -9.644 4.038
164 HB2 ASP 22 HB2 ASP 22 -15.010 -10.757 4.908
165 HB3 ASP 22 HB1 ASP 22 -14.480 -9.704 6.206
166 H GLY 23 HN GLY 23 -15.223 -6.901 3.598
167 HA2 GLY 23 HA2 GLY 23 -16.597 -8.026 1.332
168 HA3 GLY 23 HA1 GLY 23 -16.764 -6.398 1.966
169 H THR 24 HN THR 24 -13.811 -6.092 1.849
170 HA THR 24 HA THR 24 -13.638 -4.894 -0.715
171 HB THR 24 HB THR 24 -11.376 -5.548 1.171
172 HG1 THR 24 HG1 THR 24 -13.367 -3.522 1.298
173 HG21 THR 24 HG21 THR 24 -10.758 -4.543 -0.992
174 HG22 THR 24 HG22 THR 24 -10.464 -3.414 0.328
175 HG23 THR 24 HG23 THR 24 -11.884 -3.219 -0.701
176 H ASP 25 HN ASP 25 -13.863 -6.540 -2.264
177 HA ASP 25 HA ASP 25 -12.304 -8.939 -2.250
178 HB2 ASP 25 HB2 ASP 25 -13.733 -7.645 -4.599
179 HB3 ASP 25 HB1 ASP 25 -13.039 -9.261 -4.593
180 H LEU 26 HN LEU 26 -10.261 -8.563 -2.086
181 HA LEU 26 HA LEU 26 -8.964 -6.650 -3.901
182 HB2 LEU 26 HB2 LEU 26 -8.977 -6.440 -1.351
183 HB3 LEU 26 HB1 LEU 26 -7.904 -7.817 -1.346
184 HG LEU 26 HG LEU 26 -6.284 -6.496 -2.673
185 HD11 LEU 26 HD11 LEU 26 -7.863 -4.923 -3.694
186 HD12 LEU 26 HD12 LEU 26 -6.613 -4.059 -2.799
187 HD13 LEU 26 HD13 LEU 26 -8.224 -4.245 -2.106
188 HD21 LEU 26 HD21 LEU 26 -5.591 -5.098 -0.786
189 HD22 LEU 26 HD22 LEU 26 -6.123 -6.700 -0.265
190 HD23 LEU 26 HD23 LEU 26 -7.188 -5.309 -0.059
191 H SER 27 HN SER 27 -9.551 -9.843 -3.434
192 HA SER 27 HA SER 27 -7.117 -11.151 -3.914
193 HB2 SER 27 HB2 SER 27 -9.937 -12.023 -4.549
194 HB3 SER 27 HB1 SER 27 -8.525 -13.081 -4.430
195 HG SER 27 HG SER 27 -8.398 -12.757 -2.331
196 H GLY 28 HN GLY 28 -6.441 -12.274 -5.848
197 HA2 GLY 28 HA2 GLY 28 -6.093 -12.506 -8.127
198 HA3 GLY 28 HA1 GLY 28 -7.524 -11.516 -8.415
199 H ASP 29 HN ASP 29 -6.860 -9.865 -9.682
200 HA ASP 29 HA ASP 29 -4.407 -8.516 -8.840
201 HB2 ASP 29 HB2 ASP 29 -4.521 -9.057 -11.273
202 HB3 ASP 29 HB1 ASP 29 -5.979 -8.072 -11.396
203 H PHE 30 HN PHE 30 -4.491 -6.546 -8.053
204 HA PHE 30 HA PHE 30 -7.126 -5.309 -7.901
205 HB2 PHE 30 HB2 PHE 30 -6.666 -4.686 -5.552
206 HB3 PHE 30 HB1 PHE 30 -6.772 -6.421 -5.789
207 HD1 PHE 30 HD2 PHE 30 -4.564 -7.714 -5.934
208 HD2 PHE 30 HD1 PHE 30 -4.852 -3.730 -4.499
209 HE1 PHE 30 HE2 PHE 30 -2.423 -7.980 -4.773
210 HE2 PHE 30 HE1 PHE 30 -2.712 -3.992 -3.334
211 HZ PHE 30 HZ PHE 30 -1.495 -6.121 -3.473
212 H LEU 31 HN LEU 31 -4.515 -4.890 -9.465
213 HA LEU 31 HA LEU 31 -3.516 -2.450 -8.378
214 HB2 LEU 31 HB2 LEU 31 -2.795 -4.130 -10.736
215 HB3 LEU 31 HB1 LEU 31 -2.238 -2.473 -10.651
216 HG LEU 31 HG LEU 31 -1.079 -2.948 -8.561
217 HD11 LEU 31 HD11 LEU 31 -2.468 -4.699 -7.666
218 HD12 LEU 31 HD12 LEU 31 -0.772 -5.160 -7.717
219 HD13 LEU 31 HD13 LEU 31 -1.901 -5.813 -8.921
220 HD21 LEU 31 HD21 LEU 31 0.693 -4.370 -9.471
221 HD22 LEU 31 HD22 LEU 31 0.134 -3.165 -10.635
222 HD23 LEU 31 HD23 LEU 31 -0.381 -4.847 -10.788
223 H ASP 32 HN ASP 32 -6.139 -3.210 -10.316
224 HA ASP 32 HA ASP 32 -6.152 -0.454 -11.317
225 HB2 ASP 32 HB2 ASP 32 -7.754 -2.827 -12.300
226 HB3 ASP 32 HB1 ASP 32 -7.923 -1.181 -12.897
227 H LEU 33 HN LEU 33 -7.125 -2.112 -8.776
228 HA LEU 33 HA LEU 33 -9.827 -1.159 -8.603
229 HB2 LEU 33 HB2 LEU 33 -7.994 -2.451 -6.593
230 HB3 LEU 33 HB1 LEU 33 -9.598 -1.876 -6.180
231 HG LEU 33 HG LEU 33 -8.986 -4.045 -8.198
232 HD11 LEU 33 HD11 LEU 33 -10.153 -4.173 -5.422
233 HD12 LEU 33 HD12 LEU 33 -8.548 -4.735 -5.892
234 HD13 LEU 33 HD13 LEU 33 -9.983 -5.530 -6.536
235 HD21 LEU 33 HD21 LEU 33 -11.398 -4.395 -8.187
236 HD22 LEU 33 HD22 LEU 33 -10.995 -2.766 -8.733
237 HD23 LEU 33 HD23 LEU 33 -11.593 -3.026 -7.093
238 H ARG 34 HN ARG 34 -10.369 0.754 -8.087
239 HA ARG 34 HA ARG 34 -8.356 2.701 -7.303
240 HB2 ARG 34 HB2 ARG 34 -11.341 3.165 -7.467
241 HB3 ARG 34 HB1 ARG 34 -10.050 4.353 -7.601
242 HG2 ARG 34 HG2 ARG 34 -10.655 2.177 -9.577
243 HG3 ARG 34 HG1 ARG 34 -11.066 3.880 -9.747
244 HD2 ARG 34 HD2 ARG 34 -8.871 4.503 -10.058
245 HD3 ARG 34 HD1 ARG 34 -8.230 3.036 -9.306
246 HE ARG 34 HE ARG 34 -9.628 2.115 -11.421
247 HH11 ARG 34 HH11 ARG 34 -7.117 4.618 -11.294
248 HH12 ARG 34 HH12 ARG 34 -6.451 4.166 -12.803
249 HH21 ARG 34 HH21 ARG 34 -8.680 1.474 -13.354
250 HH22 ARG 34 HH22 ARG 34 -7.278 2.237 -13.973
251 H PHE 35 HN PHE 35 -8.172 3.588 -5.296
252 HA PHE 35 HA PHE 35 -9.151 2.048 -3.141
253 HB2 PHE 35 HB2 PHE 35 -7.848 4.769 -3.098
254 HB3 PHE 35 HB1 PHE 35 -8.188 3.792 -1.669
255 HD1 PHE 35 HD2 PHE 35 -7.078 1.585 -1.403
256 HD2 PHE 35 HD1 PHE 35 -6.013 4.337 -4.439
257 HE1 PHE 35 HE2 PHE 35 -4.953 0.389 -1.734
258 HE2 PHE 35 HE1 PHE 35 -3.933 3.172 -4.804
259 HZ PHE 35 HZ PHE 35 -3.362 1.185 -3.431
260 H GLU 36 HN GLU 36 -10.254 4.944 -4.663
261 HA GLU 36 HA GLU 36 -12.132 5.706 -2.703
262 HB2 GLU 36 HB2 GLU 36 -11.294 7.085 -4.654
263 HB3 GLU 36 HB1 GLU 36 -12.348 6.130 -5.685
264 HG2 GLU 36 HG2 GLU 36 -13.424 8.192 -5.153
265 HG3 GLU 36 HG1 GLU 36 -14.273 6.877 -4.339
266 H ASP 37 HN ASP 37 -12.139 3.350 -5.233
267 HA ASP 37 HA ASP 37 -14.985 2.863 -5.174
268 HB2 ASP 37 HB2 ASP 37 -13.841 2.626 -7.281
269 HB3 ASP 37 HB1 ASP 37 -12.718 1.463 -6.589
270 H ILE 38 HN ILE 38 -12.050 1.287 -4.006
271 HA ILE 38 HA ILE 38 -13.578 -0.950 -3.000
272 HB ILE 38 HB ILE 38 -11.471 -1.902 -2.176
273 HG12 ILE 38 HG12 ILE 38 -10.190 0.611 -3.288
274 HG13 ILE 38 HG11 ILE 38 -10.341 0.218 -1.580
275 HG21 ILE 38 HG21 ILE 38 -10.417 -2.225 -4.359
276 HG22 ILE 38 HG22 ILE 38 -11.355 -0.866 -4.989
277 HG23 ILE 38 HG23 ILE 38 -12.180 -2.328 -4.444
278 HD11 ILE 38 HD11 ILE 38 -8.888 -1.723 -1.905
279 HD12 ILE 38 HD12 ILE 38 -8.098 -0.226 -2.404
280 HD13 ILE 38 HD13 ILE 38 -8.748 -1.327 -3.618
281 H GLY 39 HN GLY 39 -13.341 1.973 -1.803
282 HA2 GLY 39 HA2 GLY 39 -14.163 2.718 0.251
283 HA3 GLY 39 HA1 GLY 39 -14.193 1.047 0.800
284 H TYR 40 HN TYR 40 -11.598 3.154 -0.364
285 HA TYR 40 HA TYR 40 -10.260 2.928 2.216
286 HB2 TYR 40 HB2 TYR 40 -9.246 2.098 -0.434
287 HB3 TYR 40 HB1 TYR 40 -8.143 3.058 0.539
288 HD1 TYR 40 HD2 TYR 40 -10.126 -0.032 0.432
289 HD2 TYR 40 HD1 TYR 40 -7.003 2.076 2.402
290 HE1 TYR 40 HE2 TYR 40 -9.562 -2.066 1.651
291 HE2 TYR 40 HE1 TYR 40 -6.402 0.044 3.639
292 HH TYR 40 HH TYR 40 -7.489 -2.064 4.343
293 H ASP 41 HN ASP 41 -8.929 4.664 2.709
294 HA ASP 41 HA ASP 41 -9.204 6.972 0.935
295 HB2 ASP 41 HB2 ASP 41 -9.632 8.449 2.755
296 HB3 ASP 41 HB1 ASP 41 -10.721 7.089 2.980
297 H SER 42 HN SER 42 -7.635 8.744 1.955
298 HA SER 42 HA SER 42 -5.074 7.899 1.185
299 HB2 SER 42 HB2 SER 42 -4.596 10.255 1.976
300 HB3 SER 42 HB1 SER 42 -5.851 10.089 0.726
301 H LEU 43 HN LEU 43 -6.506 8.919 4.218
302 HA LEU 43 HA LEU 43 -4.198 8.860 5.788
303 HB2 LEU 43 HB2 LEU 43 -7.063 8.541 6.636
304 HB3 LEU 43 HB1 LEU 43 -5.723 8.896 7.702
305 HG LEU 43 HG LEU 43 -6.766 10.685 5.511
306 HD11 LEU 43 HD11 LEU 43 -7.453 12.141 7.346
307 HD12 LEU 43 HD12 LEU 43 -6.903 10.937 8.509
308 HD13 LEU 43 HD13 LEU 43 -8.250 10.570 7.432
309 HD21 LEU 43 HD21 LEU 43 -5.196 12.342 6.393
310 HD22 LEU 43 HD22 LEU 43 -4.360 10.917 5.776
311 HD23 LEU 43 HD23 LEU 43 -4.559 11.138 7.515
312 H ALA 44 HN ALA 44 -6.639 6.394 5.169
313 HA ALA 44 HA ALA 44 -5.641 4.443 6.940
314 HB1 ALA 44 HB1 ALA 44 -7.852 4.257 5.874
315 HB2 ALA 44 HB2 ALA 44 -6.870 2.823 5.574
316 HB3 ALA 44 HB3 ALA 44 -7.071 4.032 4.309
317 H LEU 45 HN LEU 45 -4.987 5.101 3.539
318 HA LEU 45 HA LEU 45 -3.188 3.016 3.091
319 HB2 LEU 45 HB2 LEU 45 -3.388 5.709 1.763
320 HB3 LEU 45 HB1 LEU 45 -2.414 4.380 1.164
321 HG LEU 45 HG LEU 45 -5.407 4.304 1.486
322 HD11 LEU 45 HD11 LEU 45 -3.703 4.619 -0.978
323 HD12 LEU 45 HD12 LEU 45 -4.731 5.860 -0.258
324 HD13 LEU 45 HD13 LEU 45 -5.452 4.405 -0.950
325 HD21 LEU 45 HD21 LEU 45 -4.341 2.131 1.722
326 HD22 LEU 45 HD22 LEU 45 -3.466 2.394 0.211
327 HD23 LEU 45 HD23 LEU 45 -5.224 2.241 0.195
328 H MET 46 HN MET 46 -2.723 6.295 4.237
329 HA MET 46 HA MET 46 0.120 6.317 4.258
330 HB2 MET 46 HB2 MET 46 -1.834 7.903 5.929
331 HB3 MET 46 HB1 MET 46 -0.103 8.208 5.860
332 HG2 MET 46 HG2 MET 46 -0.249 8.792 3.541
333 HG3 MET 46 HG1 MET 46 -1.951 8.310 3.505
334 HE1 MET 46 HE1 MET 46 -2.717 10.544 2.467
335 HE2 MET 46 HE2 MET 46 -1.028 11.039 2.378
336 HE3 MET 46 HE3 MET 46 -2.232 12.130 3.061
337 H GLU 47 HN GLU 47 -2.277 5.196 6.488
338 HA GLU 47 HA GLU 47 -0.518 4.763 8.674
339 HB2 GLU 47 HB2 GLU 47 -2.987 5.008 8.872
340 HB3 GLU 47 HB1 GLU 47 -3.183 3.472 8.052
341 HG2 GLU 47 HG2 GLU 47 -2.134 2.306 9.867
342 HG3 GLU 47 HG1 GLU 47 -1.749 3.831 10.668
343 H THR 48 HN THR 48 -1.819 2.741 6.060
344 HA THR 48 HA THR 48 -0.567 0.332 6.641
345 HB THR 48 HB THR 48 -1.040 1.510 3.883
346 HG1 THR 48 HG1 THR 48 -2.720 0.573 5.882
347 HG21 THR 48 HG21 THR 48 -1.027 -1.351 4.898
348 HG22 THR 48 HG22 THR 48 0.205 -0.618 3.870
349 HG23 THR 48 HG23 THR 48 -1.435 -0.848 3.263
350 H ALA 49 HN ALA 49 0.473 2.981 4.528
351 HA ALA 49 HA ALA 49 2.973 2.109 3.749
352 HB1 ALA 49 HB1 ALA 49 1.866 4.080 2.837
353 HB2 ALA 49 HB2 ALA 49 3.499 4.469 3.393
354 HB3 ALA 49 HB3 ALA 49 2.105 4.925 4.368
355 H ALA 50 HN ALA 50 2.189 4.131 6.575
356 HA ALA 50 HA ALA 50 4.778 4.367 7.588
357 HB1 ALA 50 HB1 ALA 50 2.904 5.782 8.285
358 HB2 ALA 50 HB2 ALA 50 3.720 5.051 9.670
359 HB3 ALA 50 HB3 ALA 50 2.178 4.402 9.110
360 H ARG 51 HN ARG 51 2.312 1.920 8.166
361 HA ARG 51 HA ARG 51 3.853 0.603 10.152
362 HB2 ARG 51 HB2 ARG 51 1.433 0.411 10.157
363 HB3 ARG 51 HB1 ARG 51 1.459 -0.348 8.575
364 HG2 ARG 51 HG2 ARG 51 2.426 -2.316 9.433
365 HG3 ARG 51 HG1 ARG 51 2.798 -1.540 10.977
366 HD2 ARG 51 HD2 ARG 51 0.475 -1.369 11.502
367 HD3 ARG 51 HD1 ARG 51 0.025 -1.949 9.901
368 HE ARG 51 HE ARG 51 1.094 -4.079 10.536
369 HH11 ARG 51 HH11 ARG 51 0.143 -1.950 13.208
370 HH12 ARG 51 HH12 ARG 51 -0.276 -3.250 14.219
371 HH21 ARG 51 HH21 ARG 51 0.499 -5.792 11.898
372 HH22 ARG 51 HH22 ARG 51 -0.153 -5.476 13.443
373 H LEU 52 HN LEU 52 3.450 0.230 6.716
374 HA LEU 52 HA LEU 52 4.978 -2.090 6.397
375 HB2 LEU 52 HB2 LEU 52 4.275 0.172 4.576
376 HB3 LEU 52 HB1 LEU 52 5.329 -1.129 4.035
377 HG LEU 52 HG LEU 52 2.593 -1.652 5.181
378 HD11 LEU 52 HD11 LEU 52 1.817 -1.910 2.893
379 HD12 LEU 52 HD12 LEU 52 3.386 -1.380 2.285
380 HD13 LEU 52 HD13 LEU 52 2.358 -0.257 3.175
381 HD21 LEU 52 HD21 LEU 52 2.916 -3.774 4.011
382 HD22 LEU 52 HD22 LEU 52 4.140 -3.482 5.246
383 HD23 LEU 52 HD23 LEU 52 4.530 -3.248 3.540
384 H GLU 53 HN GLU 53 5.925 1.268 6.655
385 HA GLU 53 HA GLU 53 8.642 0.993 6.042
386 HB2 GLU 53 HB2 GLU 53 7.376 2.820 8.087
387 HB3 GLU 53 HB1 GLU 53 8.991 2.997 7.430
388 HG2 GLU 53 HG2 GLU 53 8.012 3.354 5.210
389 HG3 GLU 53 HG1 GLU 53 6.402 3.261 5.937
390 H SER 54 HN SER 54 6.797 0.410 8.912
391 HA SER 54 HA SER 54 9.039 -0.106 10.615
392 HB2 SER 54 HB2 SER 54 6.992 0.880 11.496
393 HB3 SER 54 HB1 SER 54 6.060 -0.513 10.961
394 HG SER 54 HG SER 54 8.019 -0.343 12.978
395 H ARG 55 HN ARG 55 6.954 -1.956 8.529
396 HA ARG 55 HA ARG 55 7.633 -4.459 9.803
397 HB2 ARG 55 HB2 ARG 55 5.375 -4.109 8.900
398 HB3 ARG 55 HB1 ARG 55 6.054 -3.989 7.280
399 HG2 ARG 55 HG2 ARG 55 6.816 -6.268 7.386
400 HG3 ARG 55 HG1 ARG 55 6.279 -6.402 9.057
401 HD2 ARG 55 HD2 ARG 55 3.958 -6.046 8.308
402 HD3 ARG 55 HD1 ARG 55 4.528 -5.977 6.637
403 HE ARG 55 HE ARG 55 5.521 -8.301 7.748
404 HH11 ARG 55 HH11 ARG 55 2.213 -7.079 7.184
405 HH12 ARG 55 HH12 ARG 55 1.589 -8.618 6.854
406 HH21 ARG 55 HH21 ARG 55 4.689 -10.323 7.230
407 HH22 ARG 55 HH22 ARG 55 3.049 -10.547 6.843
408 H TYR 56 HN TYR 56 8.192 -3.075 6.556
409 HA TYR 56 HA TYR 56 10.110 -5.240 6.143
410 HB2 TYR 56 HB2 TYR 56 8.826 -3.351 4.165
411 HB3 TYR 56 HB1 TYR 56 10.077 -4.512 3.740
412 HD1 TYR 56 HD2 TYR 56 9.571 -6.907 3.660
413 HD2 TYR 56 HD1 TYR 56 6.553 -4.088 4.678
414 HE1 TYR 56 HE2 TYR 56 7.852 -8.630 3.318
415 HE2 TYR 56 HE1 TYR 56 4.821 -5.811 4.340
416 HH TYR 56 HH TYR 56 4.501 -7.965 3.149
417 H GLY 57 HN GLY 57 10.065 -2.114 7.151
418 HA2 GLY 57 HA2 GLY 57 11.763 -0.651 7.626
419 HA3 GLY 57 HA1 GLY 57 12.897 -1.870 7.051
420 H VAL 58 HN VAL 58 10.668 0.633 5.982
421 HA VAL 58 HA VAL 58 12.422 1.105 3.720
422 HB VAL 58 HB VAL 58 10.474 1.484 2.168
423 HG11 VAL 58 HG11 VAL 58 10.764 -1.320 3.226
424 HG12 VAL 58 HG12 VAL 58 11.778 -0.553 2.003
425 HG13 VAL 58 HG13 VAL 58 10.077 -0.875 1.661
426 HG21 VAL 58 HG21 VAL 58 8.911 0.060 4.321
427 HG22 VAL 58 HG22 VAL 58 8.322 0.439 2.700
428 HG23 VAL 58 HG23 VAL 58 8.709 1.741 3.824
429 H SER 59 HN SER 59 11.566 3.192 2.502
430 HA SER 59 HA SER 59 10.931 5.161 4.583
431 HB2 SER 59 HB2 SER 59 12.585 5.597 2.074
432 HB3 SER 59 HB1 SER 59 12.383 6.715 3.425
433 HG SER 59 HG SER 59 13.292 4.831 4.691
434 H ILE 60 HN ILE 60 8.780 5.593 4.252
435 HA ILE 60 HA ILE 60 7.934 6.122 1.481
436 HB ILE 60 HB ILE 60 6.238 4.841 3.643
437 HG12 ILE 60 HG12 ILE 60 7.890 3.235 2.759
438 HG13 ILE 60 HG11 ILE 60 6.255 2.799 2.285
439 HG21 ILE 60 HG21 ILE 60 5.604 5.470 0.769
440 HG22 ILE 60 HG22 ILE 60 4.906 6.235 2.201
441 HG23 ILE 60 HG23 ILE 60 4.571 4.539 1.847
442 HD11 ILE 60 HD11 ILE 60 7.827 2.448 0.474
443 HD12 ILE 60 HD12 ILE 60 8.306 4.147 0.537
444 HD13 ILE 60 HD13 ILE 60 6.664 3.708 0.059
445 HA PRO 61 HA PRO 61 6.979 9.989 3.676
446 HB2 PRO 61 HB2 PRO 61 6.347 10.859 0.920
447 HB3 PRO 61 HB1 PRO 61 7.465 11.574 2.085
448 HG2 PRO 61 HG2 PRO 61 8.358 10.264 -0.070
449 HG3 PRO 61 HG1 PRO 61 9.201 10.162 1.487
450 HD2 PRO 61 HD2 PRO 61 7.344 8.192 0.208
451 HD3 PRO 61 HD1 PRO 61 8.865 7.904 1.084
452 H ASP 62 HN ASP 62 5.071 10.495 4.458
453 HA ASP 62 HA ASP 62 2.779 9.006 4.070
454 HB2 ASP 62 HB2 ASP 62 1.552 10.673 5.394
455 HB3 ASP 62 HB1 ASP 62 3.108 10.288 6.106
456 H ASP 63 HN ASP 63 3.608 12.028 2.463
457 HA ASP 63 HA ASP 63 1.014 12.619 1.509
458 HB2 ASP 63 HB2 ASP 63 2.006 14.342 0.228
459 HB3 ASP 63 HB1 ASP 63 2.992 14.217 1.677
460 H VAL 64 HN VAL 64 3.447 10.473 0.427
461 HA VAL 64 HA VAL 64 2.634 10.307 -2.306
462 HB VAL 64 HB VAL 64 4.128 8.294 -0.664
463 HG11 VAL 64 HG11 VAL 64 3.330 7.407 -2.804
464 HG12 VAL 64 HG12 VAL 64 5.084 7.593 -2.872
465 HG13 VAL 64 HG13 VAL 64 4.041 8.773 -3.664
466 HG21 VAL 64 HG21 VAL 64 6.201 9.321 -1.544
467 HG22 VAL 64 HG22 VAL 64 5.269 10.431 -0.540
468 HG23 VAL 64 HG23 VAL 64 5.230 10.584 -2.297
469 H ALA 65 HN ALA 65 1.810 8.650 0.668
470 HA ALA 65 HA ALA 65 0.427 6.512 -0.634
471 HB1 ALA 65 HB1 ALA 65 -0.328 5.878 1.599
472 HB2 ALA 65 HB2 ALA 65 0.295 7.397 2.245
473 HB3 ALA 65 HB3 ALA 65 1.405 6.201 1.582
474 H GLY 66 HN GLY 66 -0.329 9.719 0.049
475 HA2 GLY 66 HA2 GLY 66 -3.203 9.202 -0.237
476 HA3 GLY 66 HA1 GLY 66 -2.482 10.735 0.250
477 H ARG 67 HN ARG 67 -0.788 9.256 -2.217
478 HA ARG 67 HA ARG 67 -1.993 11.034 -4.251
479 HB2 ARG 67 HB2 ARG 67 0.399 11.407 -3.468
480 HB3 ARG 67 HB1 ARG 67 0.790 9.860 -4.187
481 HG2 ARG 67 HG2 ARG 67 -0.069 10.826 -6.374
482 HG3 ARG 67 HG1 ARG 67 -0.059 12.393 -5.558
483 HD2 ARG 67 HD2 ARG 67 2.282 10.559 -6.044
484 HD3 ARG 67 HD1 ARG 67 2.013 12.151 -6.744
485 HE ARG 67 HE ARG 67 2.056 12.650 -4.095
486 HH11 ARG 67 HH11 ARG 67 4.337 10.994 -6.314
487 HH12 ARG 67 HH12 ARG 67 5.687 11.270 -5.308
488 HH21 ARG 67 HH21 ARG 67 4.065 13.043 -2.742
489 HH22 ARG 67 HH22 ARG 67 5.530 12.435 -3.335
490 H VAL 68 HN VAL 68 -1.800 7.856 -3.263
491 HA VAL 68 HA VAL 68 -1.322 6.741 -5.888
492 HB VAL 68 HB VAL 68 -1.338 4.522 -4.782
493 HG11 VAL 68 HG11 VAL 68 0.702 4.771 -3.500
494 HG12 VAL 68 HG12 VAL 68 0.386 6.489 -3.305
495 HG13 VAL 68 HG13 VAL 68 0.741 5.851 -4.901
496 HG21 VAL 68 HG21 VAL 68 -2.941 4.955 -2.970
497 HG22 VAL 68 HG22 VAL 68 -1.781 6.044 -2.205
498 HG23 VAL 68 HG23 VAL 68 -1.422 4.323 -2.336
499 H ASP 69 HN ASP 69 -2.935 6.665 -7.264
500 HA ASP 69 HA ASP 69 -5.694 6.533 -6.417
501 HB2 ASP 69 HB2 ASP 69 -5.122 7.715 -8.527
502 HB3 ASP 69 HB1 ASP 69 -4.535 6.208 -9.196
503 H THR 70 HN THR 70 -3.267 4.330 -7.680
504 HA THR 70 HA THR 70 -5.144 2.198 -7.105
505 HB THR 70 HB THR 70 -4.292 0.960 -9.104
506 HG1 THR 70 HG1 THR 70 -2.774 3.267 -9.351
507 HG21 THR 70 HG21 THR 70 -5.644 3.582 -9.605
508 HG22 THR 70 HG22 THR 70 -6.424 2.053 -9.169
509 HG23 THR 70 HG23 THR 70 -5.619 2.224 -10.735
510 HA PRO 71 HA PRO 71 -1.979 0.340 -4.769
511 HB2 PRO 71 HB2 PRO 71 -2.731 -2.217 -6.079
512 HB3 PRO 71 HB1 PRO 71 -2.644 -1.815 -4.358
513 HG2 PRO 71 HG2 PRO 71 -4.999 -1.999 -5.509
514 HG3 PRO 71 HG1 PRO 71 -4.668 -0.647 -4.404
515 HD2 PRO 71 HD2 PRO 71 -4.653 -0.679 -7.403
516 HD3 PRO 71 HD1 PRO 71 -5.388 0.502 -6.294
517 H ARG 72 HN ARG 72 -1.963 -0.013 -8.220
518 HA ARG 72 HA ARG 72 0.472 -1.393 -8.406
519 HB2 ARG 72 HB2 ARG 72 0.641 -0.579 -10.731
520 HB3 ARG 72 HB1 ARG 72 -0.968 -1.173 -10.374
521 HG2 ARG 72 HG2 ARG 72 -1.767 1.115 -10.161
522 HG3 ARG 72 HG1 ARG 72 -0.138 1.711 -10.474
523 HD2 ARG 72 HD2 ARG 72 -1.442 1.841 -12.496
524 HD3 ARG 72 HD1 ARG 72 -0.194 0.613 -12.680
525 HE ARG 72 HE ARG 72 -3.058 0.120 -12.266
526 HH11 ARG 72 HH11 ARG 72 0.140 -1.088 -13.238
527 HH12 ARG 72 HH12 ARG 72 -0.469 -2.467 -14.023
528 HH21 ARG 72 HH21 ARG 72 -3.899 -1.718 -13.524
529 HH22 ARG 72 HH22 ARG 72 -2.821 -2.826 -14.200
530 H GLU 73 HN GLU 73 -0.333 2.016 -7.952
531 HA GLU 73 HA GLU 73 2.287 3.068 -8.208
532 HB2 GLU 73 HB2 GLU 73 -0.226 4.044 -6.896
533 HB3 GLU 73 HB1 GLU 73 1.257 4.891 -6.587
534 HG2 GLU 73 HG2 GLU 73 0.163 6.089 -8.241
535 HG3 GLU 73 HG1 GLU 73 1.423 5.199 -9.089
536 H LEU 74 HN LEU 74 0.334 2.035 -5.494
537 HA LEU 74 HA LEU 74 2.154 2.705 -3.451
538 HB2 LEU 74 HB2 LEU 74 -0.374 2.220 -3.344
539 HB3 LEU 74 HB1 LEU 74 0.051 0.531 -3.312
540 HG LEU 74 HG LEU 74 -0.550 1.484 -1.105
541 HD11 LEU 74 HD11 LEU 74 0.832 -0.498 -1.154
542 HD12 LEU 74 HD12 LEU 74 1.307 0.551 0.184
543 HD13 LEU 74 HD13 LEU 74 2.283 0.495 -1.282
544 HD21 LEU 74 HD21 LEU 74 0.337 3.713 -1.369
545 HD22 LEU 74 HD22 LEU 74 1.982 3.080 -1.425
546 HD23 LEU 74 HD23 LEU 74 1.035 2.947 0.059
547 H LEU 75 HN LEU 75 1.596 -0.290 -5.249
548 HA LEU 75 HA LEU 75 3.419 -1.973 -3.955
549 HB2 LEU 75 HB2 LEU 75 1.691 -2.706 -5.563
550 HB3 LEU 75 HB1 LEU 75 2.559 -1.911 -6.852
551 HG LEU 75 HG LEU 75 4.437 -3.507 -6.510
552 HD11 LEU 75 HD11 LEU 75 2.510 -4.865 -4.633
553 HD12 LEU 75 HD12 LEU 75 4.028 -4.086 -4.187
554 HD13 LEU 75 HD13 LEU 75 4.043 -5.528 -5.203
555 HD21 LEU 75 HD21 LEU 75 2.769 -3.884 -8.236
556 HD22 LEU 75 HD22 LEU 75 1.737 -4.724 -7.082
557 HD23 LEU 75 HD23 LEU 75 3.296 -5.414 -7.538
558 H ASP 76 HN ASP 76 3.774 -0.038 -6.918
559 HA ASP 76 HA ASP 76 6.452 -0.562 -7.496
560 HB2 ASP 76 HB2 ASP 76 5.110 0.473 -9.166
561 HB3 ASP 76 HB1 ASP 76 4.716 1.820 -8.112
562 H LEU 77 HN LEU 77 5.047 2.006 -5.576
563 HA LEU 77 HA LEU 77 7.241 3.534 -4.915
564 HB2 LEU 77 HB2 LEU 77 4.991 4.145 -4.355
565 HB3 LEU 77 HB1 LEU 77 4.824 2.756 -3.304
566 HG LEU 77 HG LEU 77 6.545 3.752 -1.813
567 HD11 LEU 77 HD11 LEU 77 6.212 6.172 -3.576
568 HD12 LEU 77 HD12 LEU 77 7.668 5.192 -3.412
569 HD13 LEU 77 HD13 LEU 77 7.072 6.122 -2.036
570 HD21 LEU 77 HD21 LEU 77 4.067 5.384 -2.335
571 HD22 LEU 77 HD22 LEU 77 5.017 5.401 -0.847
572 HD23 LEU 77 HD23 LEU 77 4.175 3.933 -1.336
573 H ILE 78 HN ILE 78 5.937 0.739 -3.132
574 HA ILE 78 HA ILE 78 8.103 0.835 -1.297
575 HB ILE 78 HB ILE 78 5.980 -1.307 -1.612
576 HG12 ILE 78 HG12 ILE 78 6.169 1.092 0.215
577 HG13 ILE 78 HG11 ILE 78 5.082 0.921 -1.156
578 HG21 ILE 78 HG21 ILE 78 6.589 -1.935 0.696
579 HG22 ILE 78 HG22 ILE 78 7.865 -0.719 0.694
580 HG23 ILE 78 HG23 ILE 78 7.974 -2.110 -0.383
581 HD11 ILE 78 HD11 ILE 78 5.082 -0.727 1.337
582 HD12 ILE 78 HD12 ILE 78 3.995 -0.940 -0.038
583 HD13 ILE 78 HD13 ILE 78 3.932 0.544 0.920
584 H ASN 79 HN ASN 79 7.389 -1.001 -4.174
585 HA ASN 79 HA ASN 79 9.425 -2.931 -3.912
586 HB2 ASN 79 HB2 ASN 79 8.244 -1.694 -6.405
587 HB3 ASN 79 HB1 ASN 79 9.454 -2.965 -6.463
588 HD21 ASN 79 HD21 ASN 79 8.384 -4.399 -4.150
589 HD22 ASN 79 HD22 ASN 79 6.925 -5.143 -4.704
590 H GLY 80 HN GLY 80 9.520 0.360 -5.127
591 HA2 GLY 80 HA2 GLY 80 12.260 0.318 -5.875
592 HA3 GLY 80 HA1 GLY 80 11.304 1.759 -5.535
593 H ALA 81 HN ALA 81 10.562 1.391 -2.987
594 HA ALA 81 HA ALA 81 12.770 2.240 -1.508
595 HB1 ALA 81 HB1 ALA 81 11.344 2.053 0.459
596 HB2 ALA 81 HB2 ALA 81 10.207 1.057 -0.447
597 HB3 ALA 81 HB3 ALA 81 10.452 2.747 -0.895
598 H LEU 82 HN LEU 82 11.306 -0.968 -1.726
599 HA LEU 82 HA LEU 82 12.877 -2.253 0.223
600 HB2 LEU 82 HB2 LEU 82 11.425 -3.311 -2.180
601 HB3 LEU 82 HB1 LEU 82 12.286 -4.350 -1.066
602 HG LEU 82 HG LEU 82 10.023 -2.539 -0.230
603 HD11 LEU 82 HD11 LEU 82 10.009 -5.478 -0.895
604 HD12 LEU 82 HD12 LEU 82 9.249 -4.200 -1.843
605 HD13 LEU 82 HD13 LEU 82 8.660 -4.563 -0.220
606 HD21 LEU 82 HD21 LEU 82 10.006 -3.970 1.743
607 HD22 LEU 82 HD22 LEU 82 11.569 -3.177 1.544
608 HD23 LEU 82 HD23 LEU 82 11.378 -4.875 1.103
609 H ALA 83 HN ALA 83 13.576 -1.442 -3.083
610 HA ALA 83 HA ALA 83 15.770 -3.273 -3.296
611 HB1 ALA 83 HB1 ALA 83 16.282 -2.112 -5.385
612 HB2 ALA 83 HB2 ALA 83 15.112 -0.855 -4.980
613 HB3 ALA 83 HB3 ALA 83 14.565 -2.504 -5.289
614 H GLU 84 HN GLU 84 15.281 -0.118 -2.091
615 HA GLU 84 HA GLU 84 18.110 0.520 -1.952
616 HB2 GLU 84 HB2 GLU 84 16.497 2.278 -2.448
617 HB3 GLU 84 HB1 GLU 84 15.656 1.954 -0.941
618 HG2 GLU 84 HG2 GLU 84 17.604 2.680 0.311
619 HG3 GLU 84 HG1 GLU 84 18.465 2.978 -1.202
620 H ALA 85 HN ALA 85 15.472 -0.476 0.091
621 HA ALA 85 HA ALA 85 16.671 -0.234 2.601
622 HB1 ALA 85 HB1 ALA 85 14.554 -2.164 1.681
623 HB2 ALA 85 HB2 ALA 85 14.272 -0.520 2.260
624 HB3 ALA 85 HB3 ALA 85 14.919 -1.741 3.353
625 H ALA 86 HN ALA 86 18.256 -1.299 3.435
626 HA ALA 86 HA ALA 86 18.820 -4.023 2.505
627 HB1 ALA 86 HB1 ALA 86 20.742 -1.985 3.648
628 HB2 ALA 86 HB2 ALA 86 20.632 -2.458 1.955
629 HB3 ALA 86 HB3 ALA 86 21.161 -3.628 3.164
630 H28 SXV 87 H28A SXV 87 -5.966 14.347 1.620
631 H28A SXV 87 H28B SXV 87 -6.166 14.479 3.362
632 H30 SXV 87 H30C SXV 87 -2.627 14.712 4.217
633 H30A SXV 87 H30A SXV 87 -3.580 13.228 4.171
634 H30B SXV 87 H30B SXV 87 -4.279 14.703 4.837
635 H31 SXV 87 H31C SXV 87 -2.231 14.559 1.711
636 H31A SXV 87 H31A SXV 87 -3.619 14.371 0.636
637 H31B SXV 87 H31B SXV 87 -3.147 13.052 1.708
638 H32 SXV 87 H32A SXV 87 -4.814 16.647 3.383
639 HO33 SXV 87 H33A SXV 87 -5.894 16.701 1.572
640 HN36 SXV 87 H36A SXV 87 -3.531 17.969 1.026
641 H37 SXV 87 H37B SXV 87 -0.692 18.066 1.738
642 H37A SXV 87 H37A SXV 87 -1.591 19.553 1.991
643 H38 SXV 87 H38B SXV 87 -2.054 19.695 -0.393
644 H38A SXV 87 H38A SXV 87 -1.325 18.093 -0.632
645 HN41 SXV 87 H41A SXV 87 -0.226 19.531 -2.241
646 H42 SXV 87 H42B SXV 87 2.303 20.428 -1.067
647 H42A SXV 87 H42A SXV 87 1.561 21.363 -2.335
648 H43 SXV 87 H43B SXV 87 2.270 18.466 -2.586
649 H43A SXV 87 H43A SXV 87 2.031 19.566 -3.922
650 H1 SXV 87 H1B SXV 87 5.605 19.609 -0.982
651 H1A SXV 87 H1A SXV 87 3.922 19.937 -0.525
652 H2 SXV 87 H2A SXV 87 4.986 17.309 -1.418
653 H2A SXV 87 H2B SXV 87 3.281 17.666 -1.138
654 H4 SXV 87 H4C SXV 87 2.945 17.425 2.109
655 H4A SXV 87 H4A SXV 87 2.822 18.852 1.073
656 H4B SXV 87 H4B SXV 87 4.063 18.777 2.333
Start of MODEL 3
1 H1 MET 1 HT1 MET 1 19.037 -8.810 -2.700
2 H2 MET 1 HT2 MET 1 20.164 -8.076 -1.694
3 H3 MET 1 HT3 MET 1 20.620 -8.531 -3.244
4 HA MET 1 HA MET 1 20.262 -6.151 -3.016
5 HB2 MET 1 HB2 MET 1 18.073 -7.466 -4.663
6 HB3 MET 1 HB1 MET 1 18.674 -5.831 -4.875
7 HG2 MET 1 HG2 MET 1 20.234 -8.367 -5.316
8 HG3 MET 1 HG1 MET 1 19.566 -7.324 -6.566
9 HE1 MET 1 HE1 MET 1 20.148 -4.421 -5.465
10 HE2 MET 1 HE2 MET 1 20.478 -4.907 -7.127
11 HE3 MET 1 HE3 MET 1 21.720 -4.080 -6.190
12 H ALA 2 HN ALA 2 16.972 -7.460 -3.170
13 HA ALA 2 HA ALA 2 16.103 -6.746 -0.638
14 HB1 ALA 2 HB1 ALA 2 15.409 -4.720 -2.788
15 HB2 ALA 2 HB2 ALA 2 16.406 -4.407 -1.367
16 HB3 ALA 2 HB3 ALA 2 14.693 -4.787 -1.176
17 H THR 3 HN THR 3 14.473 -8.090 -0.442
18 HA THR 3 HA THR 3 13.334 -9.358 -2.721
19 HB THR 3 HB THR 3 11.934 -10.422 -0.823
20 HG1 THR 3 HG1 THR 3 12.130 -9.457 0.992
21 HG21 THR 3 HG21 THR 3 13.829 -11.825 -0.097
22 HG22 THR 3 HG22 THR 3 14.954 -10.631 -0.742
23 HG23 THR 3 HG23 THR 3 13.891 -11.519 -1.833
24 H LEU 4 HN LEU 4 11.938 -8.190 -3.909
25 HA LEU 4 HA LEU 4 10.448 -6.014 -2.959
26 HB2 LEU 4 HB2 LEU 4 10.030 -7.660 -5.449
27 HB3 LEU 4 HB1 LEU 4 9.242 -6.131 -5.118
28 HG LEU 4 HG LEU 4 12.210 -6.536 -5.497
29 HD11 LEU 4 HD11 LEU 4 11.894 -5.300 -7.573
30 HD12 LEU 4 HD12 LEU 4 10.154 -5.262 -7.287
31 HD13 LEU 4 HD13 LEU 4 10.968 -6.802 -7.561
32 HD21 LEU 4 HD21 LEU 4 11.733 -4.703 -3.946
33 HD22 LEU 4 HD22 LEU 4 10.626 -3.989 -5.123
34 HD23 LEU 4 HD23 LEU 4 12.346 -4.092 -5.481
35 H LEU 5 HN LEU 5 8.372 -5.761 -2.399
36 HA LEU 5 HA LEU 5 7.162 -7.958 -1.101
37 HB2 LEU 5 HB2 LEU 5 5.498 -6.477 -0.320
38 HB3 LEU 5 HB1 LEU 5 6.986 -5.569 -0.330
39 HG LEU 5 HG LEU 5 4.887 -5.333 -2.487
40 HD11 LEU 5 HD11 LEU 5 5.284 -3.653 -0.029
41 HD12 LEU 5 HD12 LEU 5 3.919 -4.715 -0.362
42 HD13 LEU 5 HD13 LEU 5 4.186 -3.281 -1.357
43 HD21 LEU 5 HD21 LEU 5 7.232 -3.579 -1.733
44 HD22 LEU 5 HD22 LEU 5 5.969 -3.133 -2.870
45 HD23 LEU 5 HD23 LEU 5 7.025 -4.484 -3.244
46 H THR 6 HN THR 6 5.206 -8.914 -1.560
47 HA THR 6 HA THR 6 4.662 -8.999 -4.404
48 HB THR 6 HB THR 6 3.436 -11.085 -3.833
49 HG1 THR 6 HG1 THR 6 4.539 -10.732 -1.209
50 HG21 THR 6 HG21 THR 6 5.815 -11.186 -4.474
51 HG22 THR 6 HG22 THR 6 5.429 -12.429 -3.282
52 HG23 THR 6 HG23 THR 6 6.276 -10.964 -2.786
53 H THR 7 HN THR 7 2.195 -9.728 -4.679
54 HA THR 7 HA THR 7 0.494 -7.626 -4.073
55 HB THR 7 HB THR 7 -1.206 -9.502 -4.701
56 HG1 THR 7 HG1 THR 7 -0.354 -11.411 -5.182
57 HG21 THR 7 HG21 THR 7 -0.402 -7.773 -6.276
58 HG22 THR 7 HG22 THR 7 -0.573 -9.336 -7.073
59 HG23 THR 7 HG23 THR 7 1.026 -8.752 -6.610
60 H ASP 8 HN ASP 8 1.122 -10.755 -2.649
61 HA ASP 8 HA ASP 8 -0.837 -10.894 -0.668
62 HB2 ASP 8 HB2 ASP 8 0.530 -12.818 -1.217
63 HB3 ASP 8 HB1 ASP 8 1.981 -11.986 -0.672
64 H ASP 9 HN ASP 9 2.468 -9.674 -0.467
65 HA ASP 9 HA ASP 9 2.432 -8.911 2.244
66 HB2 ASP 9 HB2 ASP 9 4.045 -7.654 0.019
67 HB3 ASP 9 HB1 ASP 9 4.326 -7.396 1.734
68 H LEU 10 HN LEU 10 1.664 -7.069 -0.643
69 HA LEU 10 HA LEU 10 1.125 -4.635 0.703
70 HB2 LEU 10 HB2 LEU 10 1.656 -4.798 -1.698
71 HB3 LEU 10 HB1 LEU 10 0.134 -5.619 -1.976
72 HG LEU 10 HG LEU 10 -1.073 -3.575 -1.289
73 HD11 LEU 10 HD11 LEU 10 0.608 -2.631 0.200
74 HD12 LEU 10 HD12 LEU 10 0.158 -1.472 -1.052
75 HD13 LEU 10 HD13 LEU 10 1.681 -2.353 -1.171
76 HD21 LEU 10 HD21 LEU 10 0.964 -3.175 -3.477
77 HD22 LEU 10 HD22 LEU 10 -0.537 -2.267 -3.284
78 HD23 LEU 10 HD23 LEU 10 -0.590 -3.993 -3.640
79 H ARG 11 HN ARG 11 -0.877 -7.330 -0.362
80 HA ARG 11 HA ARG 11 -3.419 -6.380 0.253
81 HB2 ARG 11 HB2 ARG 11 -2.969 -8.448 -1.000
82 HB3 ARG 11 HB1 ARG 11 -2.353 -9.197 0.463
83 HG2 ARG 11 HG2 ARG 11 -4.593 -8.998 1.470
84 HG3 ARG 11 HG1 ARG 11 -5.184 -8.323 -0.053
85 HD2 ARG 11 HD2 ARG 11 -3.972 -11.056 0.354
86 HD3 ARG 11 HD1 ARG 11 -5.674 -10.698 0.075
87 HE ARG 11 HE ARG 11 -4.989 -9.855 -2.132
88 HH11 ARG 11 HH11 ARG 11 -2.910 -12.160 -0.446
89 HH12 ARG 11 HH12 ARG 11 -2.279 -12.879 -1.857
90 HH21 ARG 11 HH21 ARG 11 -4.013 -10.741 -4.139
91 HH22 ARG 11 HH22 ARG 11 -2.875 -11.980 -4.017
92 H ARG 12 HN ARG 12 -1.102 -8.161 2.237
93 HA ARG 12 HA ARG 12 -2.518 -8.486 4.587
94 HB2 ARG 12 HB2 ARG 12 0.418 -7.854 4.271
95 HB3 ARG 12 HB1 ARG 12 -0.322 -8.416 5.758
96 HG2 ARG 12 HG2 ARG 12 -0.918 -10.513 4.667
97 HG3 ARG 12 HG1 ARG 12 -0.182 -9.935 3.166
98 HD2 ARG 12 HD2 ARG 12 1.968 -9.744 4.273
99 HD3 ARG 12 HD1 ARG 12 1.247 -10.257 5.794
100 HE ARG 12 HE ARG 12 1.476 -11.966 3.398
101 HH11 ARG 12 HH11 ARG 12 1.343 -11.559 6.924
102 HH12 ARG 12 HH12 ARG 12 1.861 -13.137 7.287
103 HH21 ARG 12 HH21 ARG 12 2.189 -14.153 3.885
104 HH22 ARG 12 HH22 ARG 12 2.338 -14.648 5.521
105 H ALA 13 HN ALA 13 -0.436 -5.768 3.697
106 HA ALA 13 HA ALA 13 -0.892 -4.292 6.059
107 HB1 ALA 13 HB1 ALA 13 0.027 -3.282 3.379
108 HB2 ALA 13 HB2 ALA 13 1.060 -3.965 4.637
109 HB3 ALA 13 HB3 ALA 13 0.197 -2.454 4.926
110 H LEU 14 HN LEU 14 -2.502 -4.318 2.947
111 HA LEU 14 HA LEU 14 -4.151 -2.074 3.423
112 HB2 LEU 14 HB2 LEU 14 -4.464 -4.430 1.574
113 HB3 LEU 14 HB1 LEU 14 -5.622 -3.120 1.637
114 HG LEU 14 HG LEU 14 -2.706 -2.766 0.920
115 HD11 LEU 14 HD11 LEU 14 -3.866 -4.118 -0.749
116 HD12 LEU 14 HD12 LEU 14 -3.508 -2.505 -1.370
117 HD13 LEU 14 HD13 LEU 14 -5.144 -2.904 -0.847
118 HD21 LEU 14 HD21 LEU 14 -5.083 -0.920 0.699
119 HD22 LEU 14 HD22 LEU 14 -3.450 -0.570 0.135
120 HD23 LEU 14 HD23 LEU 14 -3.766 -0.771 1.859
121 H VAL 15 HN VAL 15 -4.347 -5.390 4.398
122 HA VAL 15 HA VAL 15 -7.047 -5.059 5.350
123 HB VAL 15 HB VAL 15 -5.079 -7.322 5.909
124 HG11 VAL 15 HG11 VAL 15 -8.062 -7.176 6.375
125 HG12 VAL 15 HG12 VAL 15 -6.816 -7.166 7.624
126 HG13 VAL 15 HG13 VAL 15 -7.045 -8.596 6.619
127 HG21 VAL 15 HG21 VAL 15 -7.365 -7.154 3.942
128 HG22 VAL 15 HG22 VAL 15 -6.380 -8.583 4.261
129 HG23 VAL 15 HG23 VAL 15 -5.647 -7.151 3.543
130 H GLU 16 HN GLU 16 -3.785 -5.086 6.697
131 HA GLU 16 HA GLU 16 -4.387 -4.921 9.421
132 HB2 GLU 16 HB2 GLU 16 -1.980 -3.713 8.004
133 HB3 GLU 16 HB1 GLU 16 -2.155 -3.969 9.732
134 HG2 GLU 16 HG2 GLU 16 -2.332 -6.355 9.383
135 HG3 GLU 16 HG1 GLU 16 -2.168 -6.109 7.646
136 H SER 17 HN SER 17 -4.610 -2.480 7.026
137 HA SER 17 HA SER 17 -4.675 -0.343 8.981
138 HB2 SER 17 HB2 SER 17 -5.031 -0.188 5.985
139 HB3 SER 17 HB1 SER 17 -4.658 1.142 7.083
140 HG SER 17 HG SER 17 -3.026 -1.069 6.382
141 H ALA 18 HN ALA 18 -6.902 -2.540 7.956
142 HA ALA 18 HA ALA 18 -9.122 -0.648 8.385
143 HB1 ALA 18 HB1 ALA 18 -10.470 -1.781 6.698
144 HB2 ALA 18 HB2 ALA 18 -9.133 -2.874 6.347
145 HB3 ALA 18 HB3 ALA 18 -8.983 -1.156 5.985
146 H GLY 19 HN GLY 19 -8.091 -4.021 8.447
147 HA2 GLY 19 HA2 GLY 19 -8.475 -5.519 10.165
148 HA3 GLY 19 HA1 GLY 19 -9.778 -4.487 10.761
149 H GLU 20 HN GLU 20 -11.039 -6.472 10.838
150 HA GLU 20 HA GLU 20 -11.828 -7.513 8.256
151 HB2 GLU 20 HB2 GLU 20 -13.169 -9.143 9.511
152 HB3 GLU 20 HB1 GLU 20 -11.517 -9.134 10.097
153 HG2 GLU 20 HG2 GLU 20 -13.765 -7.657 11.461
154 HG3 GLU 20 HG1 GLU 20 -13.332 -9.317 11.838
155 H THR 21 HN THR 21 -12.603 -5.216 10.354
156 HA THR 21 HA THR 21 -15.436 -5.015 9.956
157 HB THR 21 HB THR 21 -13.577 -2.946 11.153
158 HG1 THR 21 HG1 THR 21 -14.825 -5.278 12.180
159 HG21 THR 21 HG21 THR 21 -15.872 -2.167 10.670
160 HG22 THR 21 HG22 THR 21 -15.591 -2.287 12.409
161 HG23 THR 21 HG23 THR 21 -16.520 -3.533 11.578
162 H ASP 22 HN ASP 22 -15.008 -5.073 7.592
163 HA ASP 22 HA ASP 22 -15.846 -2.620 6.506
164 HB2 ASP 22 HB2 ASP 22 -13.392 -2.110 6.485
165 HB3 ASP 22 HB1 ASP 22 -13.133 -3.544 5.491
166 H GLY 23 HN GLY 23 -14.026 -5.469 5.475
167 HA2 GLY 23 HA2 GLY 23 -15.259 -7.384 4.619
168 HA3 GLY 23 HA1 GLY 23 -16.415 -6.252 3.928
169 H THR 24 HN THR 24 -13.049 -5.509 3.726
170 HA THR 24 HA THR 24 -13.139 -6.211 0.885
171 HB THR 24 HB THR 24 -11.681 -3.895 2.191
172 HG1 THR 24 HG1 THR 24 -13.657 -3.172 2.043
173 HG21 THR 24 HG21 THR 24 -11.959 -4.643 -0.733
174 HG22 THR 24 HG22 THR 24 -10.481 -4.768 0.218
175 HG23 THR 24 HG23 THR 24 -11.187 -3.183 -0.114
176 H ASP 25 HN ASP 25 -12.181 -8.275 1.242
177 HA ASP 25 HA ASP 25 -9.371 -8.197 2.051
178 HB2 ASP 25 HB2 ASP 25 -10.900 -10.210 2.613
179 HB3 ASP 25 HB1 ASP 25 -10.870 -10.575 0.889
180 H LEU 26 HN LEU 26 -7.770 -8.474 0.466
181 HA LEU 26 HA LEU 26 -8.726 -7.444 -2.069
182 HB2 LEU 26 HB2 LEU 26 -5.917 -7.643 -0.978
183 HB3 LEU 26 HB1 LEU 26 -6.297 -7.014 -2.561
184 HG LEU 26 HG LEU 26 -5.882 -5.164 -1.164
185 HD11 LEU 26 HD11 LEU 26 -7.967 -3.910 -1.196
186 HD12 LEU 26 HD12 LEU 26 -8.845 -5.409 -1.513
187 HD13 LEU 26 HD13 LEU 26 -7.675 -4.807 -2.686
188 HD21 LEU 26 HD21 LEU 26 -7.895 -6.261 0.809
189 HD22 LEU 26 HD22 LEU 26 -7.098 -4.694 0.936
190 HD23 LEU 26 HD23 LEU 26 -6.149 -6.176 1.039
191 H SER 27 HN SER 27 -9.626 -9.757 -2.177
192 HA SER 27 HA SER 27 -7.823 -11.770 -3.094
193 HB2 SER 27 HB2 SER 27 -10.045 -12.977 -3.375
194 HB3 SER 27 HB1 SER 27 -9.596 -12.492 -1.738
195 HG SER 27 HG SER 27 -11.784 -11.909 -3.011
196 H GLY 28 HN GLY 28 -8.059 -12.827 -5.141
197 HA2 GLY 28 HA2 GLY 28 -8.366 -12.928 -7.412
198 HA3 GLY 28 HA1 GLY 28 -9.473 -11.557 -7.294
199 H ASP 29 HN ASP 29 -8.800 -9.699 -8.034
200 HA ASP 29 HA ASP 29 -5.922 -9.155 -8.005
201 HB2 ASP 29 HB2 ASP 29 -6.671 -9.743 -10.335
202 HB3 ASP 29 HB1 ASP 29 -7.755 -8.354 -10.271
203 H PHE 30 HN PHE 30 -5.531 -7.331 -7.014
204 HA PHE 30 HA PHE 30 -7.797 -5.506 -6.716
205 HB2 PHE 30 HB2 PHE 30 -6.909 -4.835 -4.558
206 HB3 PHE 30 HB1 PHE 30 -7.181 -6.569 -4.610
207 HD1 PHE 30 HD2 PHE 30 -5.193 -8.082 -4.917
208 HD2 PHE 30 HD1 PHE 30 -4.797 -3.945 -4.026
209 HE1 PHE 30 HE2 PHE 30 -2.892 -8.468 -4.194
210 HE2 PHE 30 HE1 PHE 30 -2.479 -4.320 -3.298
211 HZ PHE 30 HZ PHE 30 -1.551 -6.543 -3.269
212 H LEU 31 HN LEU 31 -5.105 -5.730 -8.501
213 HA LEU 31 HA LEU 31 -3.910 -3.187 -7.805
214 HB2 LEU 31 HB2 LEU 31 -3.328 -5.029 -10.134
215 HB3 LEU 31 HB1 LEU 31 -2.425 -3.586 -9.744
216 HG LEU 31 HG LEU 31 -1.126 -5.387 -9.074
217 HD11 LEU 31 HD11 LEU 31 -0.890 -5.160 -6.658
218 HD12 LEU 31 HD12 LEU 31 -2.434 -4.309 -6.605
219 HD13 LEU 31 HD13 LEU 31 -1.071 -3.612 -7.483
220 HD21 LEU 31 HD21 LEU 31 -1.873 -7.192 -7.581
221 HD22 LEU 31 HD22 LEU 31 -2.764 -7.130 -9.108
222 HD23 LEU 31 HD23 LEU 31 -3.510 -6.519 -7.633
223 H ASP 32 HN ASP 32 -6.201 -4.477 -9.961
224 HA ASP 32 HA ASP 32 -6.164 -2.283 -11.819
225 HB2 ASP 32 HB2 ASP 32 -6.718 -4.555 -12.552
226 HB3 ASP 32 HB1 ASP 32 -8.123 -4.569 -11.497
227 H LEU 33 HN LEU 33 -7.526 -2.614 -8.733
228 HA LEU 33 HA LEU 33 -9.723 -0.871 -9.495
229 HB2 LEU 33 HB2 LEU 33 -10.803 -1.497 -7.321
230 HB3 LEU 33 HB1 LEU 33 -10.666 -2.776 -8.498
231 HG LEU 33 HG LEU 33 -8.640 -3.583 -7.157
232 HD11 LEU 33 HD11 LEU 33 -8.562 -2.975 -4.800
233 HD12 LEU 33 HD12 LEU 33 -9.799 -1.747 -5.073
234 HD13 LEU 33 HD13 LEU 33 -8.220 -1.594 -5.843
235 HD21 LEU 33 HD21 LEU 33 -10.049 -4.758 -5.540
236 HD22 LEU 33 HD22 LEU 33 -10.771 -4.731 -7.148
237 HD23 LEU 33 HD23 LEU 33 -11.374 -3.648 -5.892
238 H ARG 34 HN ARG 34 -10.226 0.943 -8.419
239 HA ARG 34 HA ARG 34 -8.011 2.413 -7.288
240 HB2 ARG 34 HB2 ARG 34 -10.914 3.092 -7.754
241 HB3 ARG 34 HB1 ARG 34 -9.783 4.205 -7.014
242 HG2 ARG 34 HG2 ARG 34 -9.395 3.033 -9.754
243 HG3 ARG 34 HG1 ARG 34 -10.238 4.555 -9.453
244 HD2 ARG 34 HD2 ARG 34 -8.216 5.425 -8.351
245 HD3 ARG 34 HD1 ARG 34 -7.384 3.920 -8.716
246 HE ARG 34 HE ARG 34 -7.572 4.464 -11.057
247 HH11 ARG 34 HH11 ARG 34 -8.441 7.166 -8.895
248 HH12 ARG 34 HH12 ARG 34 -7.839 8.370 -9.912
249 HH21 ARG 34 HH21 ARG 34 -6.780 6.141 -12.494
250 HH22 ARG 34 HH22 ARG 34 -6.899 7.776 -12.054
251 H PHE 35 HN PHE 35 -7.987 3.342 -5.170
252 HA PHE 35 HA PHE 35 -9.170 1.728 -3.131
253 HB2 PHE 35 HB2 PHE 35 -7.715 4.379 -2.940
254 HB3 PHE 35 HB1 PHE 35 -8.183 3.386 -1.561
255 HD1 PHE 35 HD2 PHE 35 -7.296 0.964 -1.559
256 HD2 PHE 35 HD1 PHE 35 -5.634 4.103 -3.886
257 HE1 PHE 35 HE2 PHE 35 -5.185 -0.283 -1.718
258 HE2 PHE 35 HE1 PHE 35 -3.521 2.867 -4.057
259 HZ PHE 35 HZ PHE 35 -3.290 0.672 -2.973
260 H GLU 36 HN GLU 36 -9.859 4.646 -4.776
261 HA GLU 36 HA GLU 36 -11.956 5.825 -3.410
262 HB2 GLU 36 HB2 GLU 36 -11.745 5.267 -6.373
263 HB3 GLU 36 HB1 GLU 36 -12.795 6.460 -5.634
264 HG2 GLU 36 HG2 GLU 36 -10.949 7.805 -5.002
265 HG3 GLU 36 HG1 GLU 36 -9.803 6.527 -5.417
266 H ASP 37 HN ASP 37 -11.866 2.938 -5.396
267 HA ASP 37 HA ASP 37 -14.689 2.531 -5.508
268 HB2 ASP 37 HB2 ASP 37 -13.267 1.761 -7.321
269 HB3 ASP 37 HB1 ASP 37 -12.397 0.697 -6.222
270 H ILE 38 HN ILE 38 -12.039 1.143 -3.633
271 HA ILE 38 HA ILE 38 -13.921 -0.580 -2.262
272 HB ILE 38 HB ILE 38 -11.970 -1.474 -1.001
273 HG12 ILE 38 HG12 ILE 38 -10.384 0.386 -2.803
274 HG13 ILE 38 HG11 ILE 38 -10.506 0.486 -1.050
275 HG21 ILE 38 HG21 ILE 38 -12.757 -2.544 -2.998
276 HG22 ILE 38 HG22 ILE 38 -10.990 -2.641 -2.908
277 HG23 ILE 38 HG23 ILE 38 -11.766 -1.467 -3.988
278 HD11 ILE 38 HD11 ILE 38 -8.373 -0.470 -1.725
279 HD12 ILE 38 HD12 ILE 38 -9.205 -1.738 -2.613
280 HD13 ILE 38 HD13 ILE 38 -9.335 -1.669 -0.856
281 H GLY 39 HN GLY 39 -13.774 2.354 -1.978
282 HA2 GLY 39 HA2 GLY 39 -14.225 3.968 -0.357
283 HA3 GLY 39 HA1 GLY 39 -14.837 2.625 0.594
284 H TYR 40 HN TYR 40 -11.555 3.371 -0.496
285 HA TYR 40 HA TYR 40 -10.692 3.070 2.294
286 HB2 TYR 40 HB2 TYR 40 -9.937 1.667 0.092
287 HB3 TYR 40 HB1 TYR 40 -8.723 2.941 0.105
288 HD1 TYR 40 HD1 TYR 40 -7.142 3.125 1.896
289 HD2 TYR 40 HD2 TYR 40 -10.015 0.004 1.844
290 HE1 TYR 40 HE1 TYR 40 -5.846 1.934 3.586
291 HE2 TYR 40 HE2 TYR 40 -8.726 -1.219 3.538
292 HH TYR 40 HH TYR 40 -6.161 0.217 5.253
293 H ASP 41 HN ASP 41 -9.612 4.722 3.229
294 HA ASP 41 HA ASP 41 -9.458 7.241 1.784
295 HB2 ASP 41 HB2 ASP 41 -9.089 6.537 4.673
296 HB3 ASP 41 HB1 ASP 41 -8.537 8.081 4.053
297 H SER 42 HN SER 42 -7.671 8.512 1.572
298 HA SER 42 HA SER 42 -5.212 7.308 0.981
299 HB2 SER 42 HB2 SER 42 -4.489 9.772 1.021
300 HB3 SER 42 HB1 SER 42 -5.799 9.339 -0.092
301 H LEU 43 HN LEU 43 -6.543 8.814 3.778
302 HA LEU 43 HA LEU 43 -4.393 9.171 5.514
303 HB2 LEU 43 HB2 LEU 43 -7.123 8.100 6.232
304 HB3 LEU 43 HB1 LEU 43 -6.003 8.895 7.313
305 HG LEU 43 HG LEU 43 -7.382 10.222 4.979
306 HD11 LEU 43 HD11 LEU 43 -8.958 9.581 6.718
307 HD12 LEU 43 HD12 LEU 43 -8.728 11.330 6.688
308 HD13 LEU 43 HD13 LEU 43 -7.948 10.359 7.936
309 HD21 LEU 43 HD21 LEU 43 -6.578 12.289 6.004
310 HD22 LEU 43 HD22 LEU 43 -5.237 11.239 5.547
311 HD23 LEU 43 HD23 LEU 43 -5.733 11.353 7.236
312 H ALA 44 HN ALA 44 -6.375 6.318 4.868
313 HA ALA 44 HA ALA 44 -5.024 4.669 6.756
314 HB1 ALA 44 HB1 ALA 44 -6.457 2.892 5.911
315 HB2 ALA 44 HB2 ALA 44 -6.978 3.929 4.583
316 HB3 ALA 44 HB3 ALA 44 -7.388 4.349 6.245
317 H LEU 45 HN LEU 45 -4.799 5.297 3.328
318 HA LEU 45 HA LEU 45 -3.157 3.134 2.600
319 HB2 LEU 45 HB2 LEU 45 -3.224 5.936 1.486
320 HB3 LEU 45 HB1 LEU 45 -2.424 4.576 0.724
321 HG LEU 45 HG LEU 45 -5.382 4.822 1.213
322 HD11 LEU 45 HD11 LEU 45 -3.763 4.983 -1.326
323 HD12 LEU 45 HD12 LEU 45 -4.580 6.330 -0.532
324 HD13 LEU 45 HD13 LEU 45 -5.522 5.008 -1.219
325 HD21 LEU 45 HD21 LEU 45 -3.768 2.711 -0.197
326 HD22 LEU 45 HD22 LEU 45 -5.529 2.790 -0.127
327 HD23 LEU 45 HD23 LEU 45 -4.599 2.524 1.347
328 H MET 46 HN MET 46 -2.465 6.265 3.952
329 HA MET 46 HA MET 46 0.343 6.149 3.917
330 HB2 MET 46 HB2 MET 46 -1.513 7.528 5.861
331 HB3 MET 46 HB1 MET 46 0.226 7.778 5.809
332 HG2 MET 46 HG2 MET 46 0.073 8.750 3.603
333 HG3 MET 46 HG1 MET 46 -1.624 8.293 3.515
334 HE1 MET 46 HE1 MET 46 0.131 9.745 6.729
335 HE2 MET 46 HE2 MET 46 -0.133 11.476 6.518
336 HE3 MET 46 HE3 MET 46 0.948 10.608 5.427
337 H GLU 47 HN GLU 47 -2.042 4.898 6.165
338 HA GLU 47 HA GLU 47 -0.120 4.025 8.071
339 HB2 GLU 47 HB2 GLU 47 -2.483 4.533 8.659
340 HB3 GLU 47 HB1 GLU 47 -2.989 3.134 7.725
341 HG2 GLU 47 HG2 GLU 47 -1.810 1.655 9.220
342 HG3 GLU 47 HG1 GLU 47 -1.166 3.027 10.118
343 H THR 48 HN THR 48 -1.839 2.534 5.374
344 HA THR 48 HA THR 48 -1.012 -0.102 5.548
345 HB THR 48 HB THR 48 -1.259 1.646 3.081
346 HG1 THR 48 HG1 THR 48 -3.055 0.744 4.841
347 HG21 THR 48 HG21 THR 48 -0.073 -0.463 2.592
348 HG22 THR 48 HG22 THR 48 -1.678 -0.444 1.860
349 HG23 THR 48 HG23 THR 48 -1.393 -1.369 3.333
350 H ALA 49 HN ALA 49 0.593 2.600 3.904
351 HA ALA 49 HA ALA 49 2.961 1.334 3.185
352 HB1 ALA 49 HB1 ALA 49 3.899 3.587 3.044
353 HB2 ALA 49 HB2 ALA 49 2.517 4.225 3.936
354 HB3 ALA 49 HB3 ALA 49 2.286 3.523 2.332
355 H ALA 50 HN ALA 50 2.108 3.135 6.108
356 HA ALA 50 HA ALA 50 4.551 3.069 7.438
357 HB1 ALA 50 HB1 ALA 50 1.795 3.073 8.652
358 HB2 ALA 50 HB2 ALA 50 2.671 4.494 8.082
359 HB3 ALA 50 HB3 ALA 50 3.290 3.566 9.450
360 H ARG 51 HN ARG 51 1.971 0.683 7.362
361 HA ARG 51 HA ARG 51 2.883 -1.055 9.393
362 HB2 ARG 51 HB2 ARG 51 1.475 -1.815 6.815
363 HB3 ARG 51 HB1 ARG 51 1.616 -2.830 8.238
364 HG2 ARG 51 HG2 ARG 51 0.083 -0.250 8.026
365 HG3 ARG 51 HG1 ARG 51 -0.597 -1.876 8.057
366 HD2 ARG 51 HD2 ARG 51 0.310 -2.201 10.303
367 HD3 ARG 51 HD1 ARG 51 0.979 -0.571 10.264
368 HE ARG 51 HE ARG 51 -1.686 -0.269 9.738
369 HH11 ARG 51 HH11 ARG 51 0.292 -1.450 12.414
370 HH12 ARG 51 HH12 ARG 51 -0.901 -1.225 13.612
371 HH21 ARG 51 HH21 ARG 51 -3.300 0.209 11.389
372 HH22 ARG 51 HH22 ARG 51 -3.000 -0.234 13.007
373 H LEU 52 HN LEU 52 3.310 -1.204 5.930
374 HA LEU 52 HA LEU 52 5.198 -3.286 6.005
375 HB2 LEU 52 HB2 LEU 52 4.541 -1.355 3.804
376 HB3 LEU 52 HB1 LEU 52 5.633 -2.718 3.610
377 HG LEU 52 HG LEU 52 2.730 -2.934 4.403
378 HD11 LEU 52 HD11 LEU 52 4.070 -3.499 1.775
379 HD12 LEU 52 HD12 LEU 52 2.917 -2.203 2.121
380 HD13 LEU 52 HD13 LEU 52 2.399 -3.884 2.184
381 HD21 LEU 52 HD21 LEU 52 3.040 -5.331 4.015
382 HD22 LEU 52 HD22 LEU 52 4.081 -4.744 5.311
383 HD23 LEU 52 HD23 LEU 52 4.756 -5.058 3.710
384 H GLU 53 HN GLU 53 5.675 0.163 6.291
385 HA GLU 53 HA GLU 53 8.373 0.354 5.677
386 HB2 GLU 53 HB2 GLU 53 6.882 1.794 7.860
387 HB3 GLU 53 HB1 GLU 53 8.525 2.174 7.385
388 HG2 GLU 53 HG2 GLU 53 7.622 2.625 5.087
389 HG3 GLU 53 HG1 GLU 53 6.011 2.498 5.800
390 H SER 54 HN SER 54 6.991 -0.165 8.895
391 HA SER 54 HA SER 54 9.396 -0.654 10.229
392 HB2 SER 54 HB2 SER 54 6.627 -1.635 10.926
393 HB3 SER 54 HB1 SER 54 7.980 -1.388 12.036
394 HG SER 54 HG SER 54 7.910 0.858 11.169
395 H ARG 55 HN ARG 55 7.460 -2.637 8.242
396 HA ARG 55 HA ARG 55 8.371 -5.116 9.367
397 HB2 ARG 55 HB2 ARG 55 6.099 -4.956 8.574
398 HB3 ARG 55 HB1 ARG 55 6.650 -4.525 6.969
399 HG2 ARG 55 HG2 ARG 55 7.466 -6.714 6.573
400 HG3 ARG 55 HG1 ARG 55 7.263 -7.168 8.268
401 HD2 ARG 55 HD2 ARG 55 5.008 -6.371 6.430
402 HD3 ARG 55 HD1 ARG 55 5.469 -8.038 6.778
403 HE ARG 55 HE ARG 55 5.095 -7.288 9.197
404 HH11 ARG 55 HH11 ARG 55 3.069 -6.319 6.429
405 HH12 ARG 55 HH12 ARG 55 1.686 -6.042 7.410
406 HH21 ARG 55 HH21 ARG 55 3.124 -6.906 10.490
407 HH22 ARG 55 HH22 ARG 55 1.694 -6.464 9.679
408 H TYR 56 HN TYR 56 9.141 -3.189 6.489
409 HA TYR 56 HA TYR 56 11.179 -5.209 5.887
410 HB2 TYR 56 HB2 TYR 56 9.678 -3.427 3.976
411 HB3 TYR 56 HB1 TYR 56 11.107 -4.355 3.510
412 HD1 TYR 56 HD2 TYR 56 11.057 -6.857 4.115
413 HD2 TYR 56 HD1 TYR 56 7.574 -4.452 3.785
414 HE1 TYR 56 HE2 TYR 56 9.712 -8.873 3.854
415 HE2 TYR 56 HE1 TYR 56 6.194 -6.485 3.529
416 HH TYR 56 HH TYR 56 6.550 -8.983 2.806
417 H GLY 57 HN GLY 57 11.057 -2.435 7.378
418 HA2 GLY 57 HA2 GLY 57 12.689 -0.988 8.038
419 HA3 GLY 57 HA1 GLY 57 13.843 -2.018 7.202
420 H VAL 58 HN VAL 58 11.108 -0.140 6.038
421 HA VAL 58 HA VAL 58 12.985 1.173 4.213
422 HB VAL 58 HB VAL 58 11.177 1.423 2.536
423 HG11 VAL 58 HG11 VAL 58 11.649 -1.416 3.408
424 HG12 VAL 58 HG12 VAL 58 12.693 -0.453 2.363
425 HG13 VAL 58 HG13 VAL 58 11.079 -0.909 1.818
426 HG21 VAL 58 HG21 VAL 58 9.255 1.354 4.047
427 HG22 VAL 58 HG22 VAL 58 9.571 -0.362 4.357
428 HG23 VAL 58 HG23 VAL 58 9.101 0.175 2.746
429 H SER 59 HN SER 59 11.890 3.279 3.231
430 HA SER 59 HA SER 59 10.542 4.694 5.376
431 HB2 SER 59 HB2 SER 59 12.858 5.745 3.727
432 HB3 SER 59 HB1 SER 59 11.962 6.643 4.955
433 HG SER 59 HG SER 59 12.893 4.255 5.847
434 H ILE 60 HN ILE 60 8.667 5.037 4.542
435 HA ILE 60 HA ILE 60 8.438 5.678 1.706
436 HB ILE 60 HB ILE 60 6.411 4.584 3.667
437 HG12 ILE 60 HG12 ILE 60 7.669 3.321 1.220
438 HG13 ILE 60 HG11 ILE 60 8.136 2.980 2.881
439 HG21 ILE 60 HG21 ILE 60 5.319 6.091 2.104
440 HG22 ILE 60 HG22 ILE 60 4.898 4.422 1.719
441 HG23 ILE 60 HG23 ILE 60 6.086 5.279 0.745
442 HD11 ILE 60 HD11 ILE 60 6.703 1.242 1.982
443 HD12 ILE 60 HD12 ILE 60 5.445 2.433 1.654
444 HD13 ILE 60 HD13 ILE 60 5.913 2.079 3.317
445 HA PRO 61 HA PRO 61 7.525 9.782 3.213
446 HB2 PRO 61 HB2 PRO 61 6.771 10.220 0.390
447 HB3 PRO 61 HB1 PRO 61 7.965 11.064 1.370
448 HG2 PRO 61 HG2 PRO 61 8.690 9.382 -0.590
449 HG3 PRO 61 HG1 PRO 61 9.634 9.551 0.901
450 HD2 PRO 61 HD2 PRO 61 7.725 7.403 0.096
451 HD3 PRO 61 HD1 PRO 61 9.264 7.276 0.975
452 H ASP 62 HN ASP 62 5.714 10.128 4.174
453 HA ASP 62 HA ASP 62 3.418 8.620 3.888
454 HB2 ASP 62 HB2 ASP 62 2.418 10.149 5.536
455 HB3 ASP 62 HB1 ASP 62 4.034 9.639 5.990
456 H ASP 63 HN ASP 63 4.167 11.747 2.515
457 HA ASP 63 HA ASP 63 1.588 12.547 1.744
458 HB2 ASP 63 HB2 ASP 63 3.516 14.043 1.713
459 HB3 ASP 63 HB1 ASP 63 4.229 13.118 0.398
460 H VAL 64 HN VAL 64 3.825 10.317 0.250
461 HA VAL 64 HA VAL 64 2.719 10.292 -2.374
462 HB VAL 64 HB VAL 64 4.059 8.020 -0.995
463 HG11 VAL 64 HG11 VAL 64 4.858 7.508 -3.363
464 HG12 VAL 64 HG12 VAL 64 3.882 8.875 -3.918
465 HG13 VAL 64 HG13 VAL 64 3.100 7.474 -3.196
466 HG21 VAL 64 HG21 VAL 64 5.393 10.020 -0.717
467 HG22 VAL 64 HG22 VAL 64 5.399 10.289 -2.463
468 HG23 VAL 64 HG23 VAL 64 6.214 8.876 -1.780
469 H ALA 65 HN ALA 65 2.039 8.558 0.570
470 HA ALA 65 HA ALA 65 0.422 6.574 -0.671
471 HB1 ALA 65 HB1 ALA 65 -0.175 5.922 1.599
472 HB2 ALA 65 HB2 ALA 65 0.575 7.393 2.221
473 HB3 ALA 65 HB3 ALA 65 1.564 6.160 1.442
474 H GLY 66 HN GLY 66 -0.080 9.815 0.198
475 HA2 GLY 66 HA2 GLY 66 -2.973 9.519 0.210
476 HA3 GLY 66 HA1 GLY 66 -2.067 11.013 0.453
477 H ARG 67 HN ARG 67 -0.700 9.419 -2.055
478 HA ARG 67 HA ARG 67 -2.274 10.889 -4.049
479 HB2 ARG 67 HB2 ARG 67 0.678 10.347 -3.908
480 HB3 ARG 67 HB1 ARG 67 -0.110 10.831 -5.397
481 HG2 ARG 67 HG2 ARG 67 -0.865 12.896 -4.290
482 HG3 ARG 67 HG1 ARG 67 0.007 12.402 -2.834
483 HD2 ARG 67 HD2 ARG 67 1.437 12.479 -5.436
484 HD3 ARG 67 HD1 ARG 67 1.131 14.006 -4.596
485 HE ARG 67 HE ARG 67 2.437 13.125 -2.765
486 HH11 ARG 67 HH11 ARG 67 2.704 11.113 -5.702
487 HH12 ARG 67 HH12 ARG 67 4.360 10.854 -5.549
488 HH21 ARG 67 HH21 ARG 67 4.788 12.760 -2.570
489 HH22 ARG 67 HH22 ARG 67 5.560 11.766 -3.729
490 H VAL 68 HN VAL 68 -0.842 7.825 -3.218
491 HA VAL 68 HA VAL 68 -0.864 6.611 -5.744
492 HB VAL 68 HB VAL 68 -0.800 4.424 -4.505
493 HG11 VAL 68 HG11 VAL 68 1.052 6.549 -3.443
494 HG12 VAL 68 HG12 VAL 68 1.246 5.672 -4.956
495 HG13 VAL 68 HG13 VAL 68 1.352 4.812 -3.420
496 HG21 VAL 68 HG21 VAL 68 -0.638 4.438 -2.053
497 HG22 VAL 68 HG22 VAL 68 -2.217 5.009 -2.588
498 HG23 VAL 68 HG23 VAL 68 -1.002 6.164 -2.039
499 H ASP 69 HN ASP 69 -2.521 6.536 -6.991
500 HA ASP 69 HA ASP 69 -5.245 6.365 -6.016
501 HB2 ASP 69 HB2 ASP 69 -4.224 6.321 -8.858
502 HB3 ASP 69 HB1 ASP 69 -5.921 6.358 -8.407
503 H THR 70 HN THR 70 -3.080 4.255 -7.752
504 HA THR 70 HA THR 70 -5.009 2.078 -7.364
505 HB THR 70 HB THR 70 -3.667 0.900 -9.168
506 HG1 THR 70 HG1 THR 70 -2.683 3.527 -9.686
507 HG21 THR 70 HG21 THR 70 -4.747 2.100 -11.029
508 HG22 THR 70 HG22 THR 70 -5.070 3.467 -9.956
509 HG23 THR 70 HG23 THR 70 -5.843 1.908 -9.664
510 HA PRO 71 HA PRO 71 -2.211 0.101 -4.544
511 HB2 PRO 71 HB2 PRO 71 -3.003 -2.422 -5.913
512 HB3 PRO 71 HB1 PRO 71 -3.080 -2.006 -4.195
513 HG2 PRO 71 HG2 PRO 71 -5.298 -2.053 -5.600
514 HG3 PRO 71 HG1 PRO 71 -5.008 -0.718 -4.466
515 HD2 PRO 71 HD2 PRO 71 -4.659 -0.771 -7.445
516 HD3 PRO 71 HD1 PRO 71 -5.447 0.457 -6.432
517 H ARG 72 HN ARG 72 -2.090 -0.600 -7.960
518 HA ARG 72 HA ARG 72 0.415 -1.917 -8.023
519 HB2 ARG 72 HB2 ARG 72 -1.164 -1.899 -9.927
520 HB3 ARG 72 HB1 ARG 72 -0.883 -0.178 -10.135
521 HG2 ARG 72 HG2 ARG 72 1.453 -0.626 -10.694
522 HG3 ARG 72 HG1 ARG 72 1.174 -2.355 -10.480
523 HD2 ARG 72 HD2 ARG 72 -0.209 -0.575 -12.482
524 HD3 ARG 72 HD1 ARG 72 1.082 -1.720 -12.840
525 HE ARG 72 HE ARG 72 -0.476 -3.446 -11.954
526 HH11 ARG 72 HH11 ARG 72 -1.677 -0.465 -13.505
527 HH12 ARG 72 HH12 ARG 72 -3.140 -1.140 -14.034
528 HH21 ARG 72 HH21 ARG 72 -2.519 -4.394 -12.704
529 HH22 ARG 72 HH22 ARG 72 -3.649 -3.453 -13.562
530 H GLU 73 HN GLU 73 -0.550 1.433 -7.960
531 HA GLU 73 HA GLU 73 2.070 2.480 -8.425
532 HB2 GLU 73 HB2 GLU 73 0.042 3.674 -9.102
533 HB3 GLU 73 HB1 GLU 73 -0.474 3.760 -7.432
534 HG2 GLU 73 HG2 GLU 73 1.300 5.259 -6.898
535 HG3 GLU 73 HG1 GLU 73 2.018 5.040 -8.494
536 H LEU 74 HN LEU 74 0.057 1.715 -5.678
537 HA LEU 74 HA LEU 74 1.715 2.873 -3.671
538 HB2 LEU 74 HB2 LEU 74 -0.756 1.895 -3.584
539 HB3 LEU 74 HB1 LEU 74 0.055 0.398 -3.198
540 HG LEU 74 HG LEU 74 0.150 2.943 -1.563
541 HD11 LEU 74 HD11 LEU 74 -2.008 1.885 -1.468
542 HD12 LEU 74 HD12 LEU 74 -1.165 1.697 0.069
543 HD13 LEU 74 HD13 LEU 74 -1.262 0.342 -1.059
544 HD21 LEU 74 HD21 LEU 74 1.246 1.608 0.166
545 HD22 LEU 74 HD22 LEU 74 2.221 1.662 -1.304
546 HD23 LEU 74 HD23 LEU 74 1.280 0.219 -0.921
547 H LEU 75 HN LEU 75 1.483 -0.312 -5.175
548 HA LEU 75 HA LEU 75 3.509 -1.717 -3.890
549 HB2 LEU 75 HB2 LEU 75 1.862 -2.649 -5.499
550 HB3 LEU 75 HB1 LEU 75 2.672 -1.807 -6.798
551 HG LEU 75 HG LEU 75 4.698 -3.212 -6.329
552 HD11 LEU 75 HD11 LEU 75 4.193 -3.831 -4.038
553 HD12 LEU 75 HD12 LEU 75 4.385 -5.264 -5.047
554 HD13 LEU 75 HD13 LEU 75 2.772 -4.725 -4.580
555 HD21 LEU 75 HD21 LEU 75 3.791 -5.200 -7.429
556 HD22 LEU 75 HD22 LEU 75 3.178 -3.718 -8.159
557 HD23 LEU 75 HD23 LEU 75 2.154 -4.654 -7.068
558 H ASP 76 HN ASP 76 3.619 0.197 -6.873
559 HA ASP 76 HA ASP 76 6.285 0.177 -7.544
560 HB2 ASP 76 HB2 ASP 76 4.664 1.203 -8.982
561 HB3 ASP 76 HB1 ASP 76 4.255 2.399 -7.759
562 H LEU 77 HN LEU 77 4.689 2.363 -5.306
563 HA LEU 77 HA LEU 77 6.845 3.977 -4.596
564 HB2 LEU 77 HB2 LEU 77 4.698 4.671 -3.967
565 HB3 LEU 77 HB1 LEU 77 4.328 3.148 -3.197
566 HG LEU 77 HG LEU 77 5.853 3.709 -1.356
567 HD11 LEU 77 HD11 LEU 77 6.179 6.390 -2.719
568 HD12 LEU 77 HD12 LEU 77 7.426 5.154 -2.519
569 HD13 LEU 77 HD13 LEU 77 6.758 5.954 -1.107
570 HD21 LEU 77 HD21 LEU 77 4.456 5.445 -0.368
571 HD22 LEU 77 HD22 LEU 77 3.495 4.217 -1.192
572 HD23 LEU 77 HD23 LEU 77 3.761 5.790 -1.951
573 H ILE 78 HN ILE 78 5.675 1.003 -3.064
574 HA ILE 78 HA ILE 78 7.770 1.077 -1.134
575 HB ILE 78 HB ILE 78 5.983 -1.295 -1.781
576 HG12 ILE 78 HG12 ILE 78 5.600 0.959 0.204
577 HG13 ILE 78 HG11 ILE 78 4.698 0.755 -1.293
578 HG21 ILE 78 HG21 ILE 78 6.485 -1.956 0.546
579 HG22 ILE 78 HG22 ILE 78 7.534 -0.547 0.724
580 HG23 ILE 78 HG23 ILE 78 7.968 -1.832 -0.403
581 HD11 ILE 78 HD11 ILE 78 4.682 -1.101 1.060
582 HD12 ILE 78 HD12 ILE 78 3.775 -1.324 -0.439
583 HD13 ILE 78 HD13 ILE 78 3.413 0.043 0.623
584 H ASN 79 HN ASN 79 7.391 -0.333 -4.256
585 HA ASN 79 HA ASN 79 9.616 -2.068 -4.274
586 HB2 ASN 79 HB2 ASN 79 8.422 -0.416 -6.520
587 HB3 ASN 79 HB1 ASN 79 9.745 -1.537 -6.772
588 HD21 ASN 79 HD21 ASN 79 8.664 -3.548 -4.935
589 HD22 ASN 79 HD22 ASN 79 7.333 -4.242 -5.803
590 H GLY 80 HN GLY 80 9.324 1.378 -4.890
591 HA2 GLY 80 HA2 GLY 80 12.070 1.839 -5.482
592 HA3 GLY 80 HA1 GLY 80 10.898 3.059 -5.000
593 H ALA 81 HN ALA 81 10.134 2.111 -2.568
594 HA ALA 81 HA ALA 81 12.124 3.059 -0.845
595 HB1 ALA 81 HB1 ALA 81 9.744 1.337 -0.151
596 HB2 ALA 81 HB2 ALA 81 9.734 3.094 -0.293
597 HB3 ALA 81 HB3 ALA 81 10.678 2.318 0.978
598 H LEU 82 HN LEU 82 11.222 -0.255 -1.687
599 HA LEU 82 HA LEU 82 12.972 -1.554 0.097
600 HB2 LEU 82 HB2 LEU 82 11.801 -2.451 -2.520
601 HB3 LEU 82 HB1 LEU 82 12.763 -3.494 -1.494
602 HG LEU 82 HG LEU 82 10.189 -2.187 -0.619
603 HD11 LEU 82 HD11 LEU 82 9.804 -3.769 -2.422
604 HD12 LEU 82 HD12 LEU 82 9.215 -4.391 -0.878
605 HD13 LEU 82 HD13 LEU 82 10.730 -4.991 -1.554
606 HD21 LEU 82 HD21 LEU 82 11.847 -4.388 0.576
607 HD22 LEU 82 HD22 LEU 82 10.311 -3.777 1.201
608 HD23 LEU 82 HD23 LEU 82 11.739 -2.732 1.176
609 H ALA 83 HN ALA 83 13.409 -0.433 -3.203
610 HA ALA 83 HA ALA 83 15.995 -1.488 -3.584
611 HB1 ALA 83 HB1 ALA 83 14.620 -0.635 -5.432
612 HB2 ALA 83 HB2 ALA 83 16.195 0.157 -5.393
613 HB3 ALA 83 HB3 ALA 83 14.768 0.999 -4.787
614 H GLU 84 HN GLU 84 14.803 1.450 -2.175
615 HA GLU 84 HA GLU 84 17.250 2.806 -1.741
616 HB2 GLU 84 HB2 GLU 84 14.970 3.812 -1.695
617 HB3 GLU 84 HB1 GLU 84 14.659 2.969 -0.190
618 HG2 GLU 84 HG2 GLU 84 15.186 5.192 0.363
619 HG3 GLU 84 HG1 GLU 84 16.600 4.223 0.783
620 H ALA 85 HN ALA 85 15.359 0.494 0.115
621 HA ALA 85 HA ALA 85 16.947 0.769 2.490
622 HB1 ALA 85 HB1 ALA 85 14.543 0.381 2.642
623 HB2 ALA 85 HB2 ALA 85 15.462 -0.895 3.443
624 HB3 ALA 85 HB3 ALA 85 14.745 -1.182 1.858
625 H ALA 86 HN ALA 86 18.947 0.086 2.113
626 HA ALA 86 HA ALA 86 19.245 -2.747 1.447
627 HB1 ALA 86 HB1 ALA 86 21.242 -0.493 1.139
628 HB2 ALA 86 HB2 ALA 86 20.360 -1.279 -0.171
629 HB3 ALA 86 HB3 ALA 86 21.546 -2.189 0.765
630 H28 SXV 87 H28A SXV 87 -5.690 13.195 3.326
631 H28A SXV 87 H28B SXV 87 -4.925 11.615 3.310
632 H30 SXV 87 H30C SXV 87 -4.168 13.670 5.205
633 H30A SXV 87 H30A SXV 87 -2.418 13.589 4.989
634 H30B SXV 87 H30B SXV 87 -3.377 12.109 4.986
635 H31 SXV 87 H31C SXV 87 -1.469 12.977 2.719
636 H31A SXV 87 H31A SXV 87 -2.582 12.517 1.430
637 H31B SXV 87 H31B SXV 87 -2.397 11.483 2.849
638 H32 SXV 87 H32A SXV 87 -4.393 15.314 3.072
639 HO33 SXV 87 H33A SXV 87 -2.606 15.278 1.174
640 HN36 SXV 87 H36A SXV 87 -2.868 15.676 5.048
641 H37 SXV 87 H37B SXV 87 -1.235 17.645 5.132
642 H37A SXV 87 H37A SXV 87 -0.162 16.517 4.294
643 H38 SXV 87 H38B SXV 87 0.432 16.473 6.570
644 H38A SXV 87 H38A SXV 87 -0.332 14.951 6.203
645 HN41 SXV 87 H41A SXV 87 -0.405 14.942 8.564
646 H42 SXV 87 H42B SXV 87 -2.860 15.039 9.652
647 H42A SXV 87 H42A SXV 87 -2.181 16.592 10.097
648 H43 SXV 87 H43B SXV 87 -0.798 13.957 10.490
649 H43A SXV 87 H43A SXV 87 -0.369 15.455 11.275
650 H1 SXV 87 H1B SXV 87 -4.136 12.907 12.191
651 H1A SXV 87 H1A SXV 87 -3.944 13.827 10.689
652 H2 SXV 87 H2A SXV 87 -2.215 11.500 11.446
653 H2A SXV 87 H2B SXV 87 -2.093 12.491 10.001
654 H4 SXV 87 H4C SXV 87 -2.745 9.346 9.992
655 H4A SXV 87 H4A SXV 87 -4.485 9.226 9.704
656 H4B SXV 87 H4B SXV 87 -3.878 9.536 11.337
Start of MODEL 4
1 H1 MET 1 HT1 MET 1 21.108 -5.287 -3.339
2 H2 MET 1 HT2 MET 1 20.252 -6.380 -4.239
3 H3 MET 1 HT3 MET 1 21.822 -6.785 -3.710
4 HA MET 1 HA MET 1 20.159 -7.898 -2.378
5 HB2 MET 1 HB2 MET 1 21.602 -5.621 -0.999
6 HB3 MET 1 HB1 MET 1 20.716 -6.853 -0.124
7 HG2 MET 1 HG2 MET 1 23.095 -7.311 -0.120
8 HG3 MET 1 HG1 MET 1 22.215 -8.565 -0.982
9 HE1 MET 1 HE1 MET 1 24.558 -9.429 -1.917
10 HE2 MET 1 HE2 MET 1 25.384 -8.126 -1.065
11 HE3 MET 1 HE3 MET 1 25.709 -8.405 -2.776
12 H ALA 2 HN ALA 2 18.047 -7.875 -2.189
13 HA ALA 2 HA ALA 2 16.709 -5.466 -1.284
14 HB1 ALA 2 HB1 ALA 2 16.034 -6.808 -3.906
15 HB2 ALA 2 HB2 ALA 2 16.777 -5.220 -3.723
16 HB3 ALA 2 HB3 ALA 2 15.130 -5.492 -3.156
17 H THR 3 HN THR 3 14.213 -6.117 -1.451
18 HA THR 3 HA THR 3 13.645 -8.874 -1.087
19 HB THR 3 HB THR 3 14.375 -8.369 1.183
20 HG1 THR 3 HG1 THR 3 11.539 -8.440 1.056
21 HG21 THR 3 HG21 THR 3 13.347 -6.607 2.598
22 HG22 THR 3 HG22 THR 3 12.448 -6.027 1.196
23 HG23 THR 3 HG23 THR 3 14.207 -5.925 1.216
24 H LEU 4 HN LEU 4 11.952 -8.953 -2.480
25 HA LEU 4 HA LEU 4 10.409 -6.492 -2.728
26 HB2 LEU 4 HB2 LEU 4 10.787 -8.713 -4.715
27 HB3 LEU 4 HB1 LEU 4 9.726 -7.340 -4.952
28 HG LEU 4 HG LEU 4 12.731 -7.224 -4.660
29 HD11 LEU 4 HD11 LEU 4 10.944 -6.786 -7.039
30 HD12 LEU 4 HD12 LEU 4 12.026 -8.156 -6.783
31 HD13 LEU 4 HD13 LEU 4 12.688 -6.537 -6.999
32 HD21 LEU 4 HD21 LEU 4 10.736 -5.023 -5.207
33 HD22 LEU 4 HD22 LEU 4 12.490 -4.853 -5.228
34 HD23 LEU 4 HD23 LEU 4 11.659 -5.239 -3.721
35 H LEU 5 HN LEU 5 8.488 -6.399 -2.012
36 HA LEU 5 HA LEU 5 7.108 -8.811 -1.371
37 HB2 LEU 5 HB2 LEU 5 5.360 -7.345 -0.383
38 HB3 LEU 5 HB1 LEU 5 6.942 -7.090 0.296
39 HG LEU 5 HG LEU 5 7.064 -4.990 -1.177
40 HD11 LEU 5 HD11 LEU 5 4.949 -3.995 -1.836
41 HD12 LEU 5 HD12 LEU 5 4.100 -5.468 -1.368
42 HD13 LEU 5 HD13 LEU 5 5.246 -5.498 -2.708
43 HD21 LEU 5 HD21 LEU 5 5.768 -3.678 0.412
44 HD22 LEU 5 HD22 LEU 5 6.729 -4.921 1.215
45 HD23 LEU 5 HD23 LEU 5 4.995 -5.153 0.995
46 H THR 6 HN THR 6 5.356 -9.600 -2.330
47 HA THR 6 HA THR 6 4.850 -8.487 -4.948
48 HB THR 6 HB THR 6 3.970 -10.830 -5.494
49 HG1 THR 6 HG1 THR 6 4.804 -11.238 -2.862
50 HG21 THR 6 HG21 THR 6 6.231 -11.725 -5.894
51 HG22 THR 6 HG22 THR 6 6.896 -10.508 -4.804
52 HG23 THR 6 HG23 THR 6 6.122 -10.014 -6.310
53 H THR 7 HN THR 7 2.445 -9.814 -5.554
54 HA THR 7 HA THR 7 0.606 -7.964 -4.804
55 HB THR 7 HB THR 7 -1.021 -9.873 -5.498
56 HG1 THR 7 HG1 THR 7 -0.049 -11.730 -5.851
57 HG21 THR 7 HG21 THR 7 -0.441 -9.470 -7.846
58 HG22 THR 7 HG22 THR 7 1.139 -8.861 -7.356
59 HG23 THR 7 HG23 THR 7 -0.320 -7.974 -6.914
60 H ASP 8 HN ASP 8 0.865 -11.286 -3.361
61 HA ASP 8 HA ASP 8 -1.256 -10.690 -1.546
62 HB2 ASP 8 HB2 ASP 8 -0.900 -13.015 -2.137
63 HB3 ASP 8 HB1 ASP 8 0.727 -12.974 -1.461
64 H ASP 9 HN ASP 9 2.163 -10.309 -1.393
65 HA ASP 9 HA ASP 9 2.413 -9.994 1.419
66 HB2 ASP 9 HB2 ASP 9 4.009 -8.600 -0.747
67 HB3 ASP 9 HB1 ASP 9 4.430 -8.625 0.954
68 H LEU 10 HN LEU 10 1.677 -7.740 -1.178
69 HA LEU 10 HA LEU 10 1.289 -5.487 0.536
70 HB2 LEU 10 HB2 LEU 10 1.828 -5.252 -1.862
71 HB3 LEU 10 HB1 LEU 10 0.290 -5.981 -2.273
72 HG LEU 10 HG LEU 10 -0.866 -4.063 -1.206
73 HD11 LEU 10 HD11 LEU 10 1.909 -2.916 -0.977
74 HD12 LEU 10 HD12 LEU 10 0.855 -3.386 0.358
75 HD13 LEU 10 HD13 LEU 10 0.405 -2.041 -0.688
76 HD21 LEU 10 HD21 LEU 10 -0.372 -2.453 -2.980
77 HD22 LEU 10 HD22 LEU 10 -0.489 -4.098 -3.605
78 HD23 LEU 10 HD23 LEU 10 1.092 -3.350 -3.382
79 H ARG 11 HN ARG 11 -0.770 -7.909 -0.904
80 HA ARG 11 HA ARG 11 -3.316 -7.051 -0.251
81 HB2 ARG 11 HB2 ARG 11 -2.877 -8.971 -1.654
82 HB3 ARG 11 HB1 ARG 11 -2.154 -9.830 -0.311
83 HG2 ARG 11 HG2 ARG 11 -4.364 -9.923 0.772
84 HG3 ARG 11 HG1 ARG 11 -5.060 -9.127 -0.651
85 HD2 ARG 11 HD2 ARG 11 -4.267 -10.932 -2.070
86 HD3 ARG 11 HD1 ARG 11 -3.526 -11.721 -0.682
87 HE ARG 11 HE ARG 11 -6.414 -11.271 -0.776
88 HH11 ARG 11 HH11 ARG 11 -3.654 -13.466 -0.388
89 HH12 ARG 11 HH12 ARG 11 -4.592 -14.874 -0.290
90 HH21 ARG 11 HH21 ARG 11 -7.733 -13.240 -0.622
91 HH22 ARG 11 HH22 ARG 11 -6.983 -14.737 -0.353
92 H ARG 12 HN ARG 12 -1.106 -9.016 1.732
93 HA ARG 12 HA ARG 12 -2.780 -9.214 4.023
94 HB2 ARG 12 HB2 ARG 12 0.243 -9.153 4.009
95 HB3 ARG 12 HB1 ARG 12 -0.783 -9.806 5.266
96 HG2 ARG 12 HG2 ARG 12 -1.476 -11.602 3.758
97 HG3 ARG 12 HG1 ARG 12 -0.433 -10.928 2.494
98 HD2 ARG 12 HD2 ARG 12 1.462 -11.099 4.134
99 HD3 ARG 12 HD1 ARG 12 0.383 -12.026 5.168
100 HE ARG 12 HE ARG 12 0.512 -13.134 2.562
101 HH11 ARG 12 HH11 ARG 12 2.246 -12.905 5.626
102 HH12 ARG 12 HH12 ARG 12 3.317 -14.190 5.355
103 HH21 ARG 12 HH21 ARG 12 1.997 -14.993 2.141
104 HH22 ARG 12 HH22 ARG 12 3.115 -15.459 3.344
105 H ALA 13 HN ALA 13 -0.223 -7.028 3.073
106 HA ALA 13 HA ALA 13 0.068 -5.518 5.388
107 HB1 ALA 13 HB1 ALA 13 1.684 -5.607 3.569
108 HB2 ALA 13 HB2 ALA 13 1.243 -3.946 3.973
109 HB3 ALA 13 HB3 ALA 13 0.567 -4.715 2.538
110 H LEU 14 HN LEU 14 -2.032 -5.030 2.605
111 HA LEU 14 HA LEU 14 -2.918 -2.453 3.315
112 HB2 LEU 14 HB2 LEU 14 -3.121 -3.573 1.069
113 HB3 LEU 14 HB1 LEU 14 -4.431 -4.528 1.729
114 HG LEU 14 HG LEU 14 -5.716 -2.451 2.123
115 HD11 LEU 14 HD11 LEU 14 -4.959 -0.369 1.083
116 HD12 LEU 14 HD12 LEU 14 -3.435 -1.142 0.648
117 HD13 LEU 14 HD13 LEU 14 -3.850 -0.903 2.346
118 HD21 LEU 14 HD21 LEU 14 -4.751 -2.850 -0.706
119 HD22 LEU 14 HD22 LEU 14 -6.234 -2.025 -0.230
120 HD23 LEU 14 HD23 LEU 14 -6.044 -3.751 0.083
121 H VAL 15 HN VAL 15 -4.002 -5.676 4.152
122 HA VAL 15 HA VAL 15 -6.450 -4.925 5.355
123 HB VAL 15 HB VAL 15 -4.827 -7.459 5.842
124 HG11 VAL 15 HG11 VAL 15 -6.484 -7.121 7.600
125 HG12 VAL 15 HG12 VAL 15 -6.938 -8.474 6.566
126 HG13 VAL 15 HG13 VAL 15 -7.747 -6.916 6.388
127 HG21 VAL 15 HG21 VAL 15 -7.093 -6.943 3.928
128 HG22 VAL 15 HG22 VAL 15 -6.326 -8.504 4.214
129 HG23 VAL 15 HG23 VAL 15 -5.401 -7.182 3.498
130 H GLU 16 HN GLU 16 -3.246 -4.595 6.411
131 HA GLU 16 HA GLU 16 -3.618 -4.780 9.186
132 HB2 GLU 16 HB2 GLU 16 -1.581 -3.171 7.643
133 HB3 GLU 16 HB1 GLU 16 -1.536 -3.487 9.373
134 HG2 GLU 16 HG2 GLU 16 -1.452 -5.583 7.218
135 HG3 GLU 16 HG1 GLU 16 -0.088 -4.963 8.146
136 H SER 17 HN SER 17 -4.278 -2.315 6.863
137 HA SER 17 HA SER 17 -4.916 -0.414 8.950
138 HB2 SER 17 HB2 SER 17 -4.875 -0.110 5.960
139 HB3 SER 17 HB1 SER 17 -5.197 1.184 7.123
140 HG SER 17 HG SER 17 -3.170 0.592 8.092
141 H ALA 18 HN ALA 18 -6.461 -2.896 7.484
142 HA ALA 18 HA ALA 18 -9.045 -1.636 7.186
143 HB1 ALA 18 HB1 ALA 18 -9.886 -3.928 6.839
144 HB2 ALA 18 HB2 ALA 18 -8.318 -4.578 7.295
145 HB3 ALA 18 HB3 ALA 18 -8.477 -3.620 5.822
146 H GLY 19 HN GLY 19 -7.153 -3.161 9.595
147 HA2 GLY 19 HA2 GLY 19 -7.568 -2.773 11.929
148 HA3 GLY 19 HA1 GLY 19 -9.299 -2.743 11.553
149 H GLU 20 HN GLU 20 -9.967 -4.742 10.363
150 HA GLU 20 HA GLU 20 -8.760 -7.149 11.450
151 HB2 GLU 20 HB2 GLU 20 -11.661 -6.313 11.590
152 HB3 GLU 20 HB1 GLU 20 -11.121 -7.969 11.812
153 HG2 GLU 20 HG2 GLU 20 -9.948 -7.398 13.789
154 HG3 GLU 20 HG1 GLU 20 -10.187 -5.674 13.500
155 H THR 21 HN THR 21 -9.750 -8.979 10.255
156 HA THR 21 HA THR 21 -9.993 -8.249 7.451
157 HB THR 21 HB THR 21 -9.811 -11.039 8.630
158 HG1 THR 21 HG1 THR 21 -7.963 -9.587 9.179
159 HG21 THR 21 HG21 THR 21 -9.115 -9.918 5.905
160 HG22 THR 21 HG22 THR 21 -10.544 -10.880 6.286
161 HG23 THR 21 HG23 THR 21 -8.941 -11.602 6.395
162 H ASP 22 HN ASP 22 -12.005 -7.314 8.304
163 HA ASP 22 HA ASP 22 -14.237 -8.880 9.128
164 HB2 ASP 22 HB2 ASP 22 -13.985 -6.468 9.616
165 HB3 ASP 22 HB1 ASP 22 -14.135 -6.118 7.901
166 H GLY 23 HN GLY 23 -13.340 -7.318 6.121
167 HA2 GLY 23 HA2 GLY 23 -14.286 -9.428 4.502
168 HA3 GLY 23 HA1 GLY 23 -15.404 -8.055 4.471
169 H THR 24 HN THR 24 -11.944 -8.650 4.402
170 HA THR 24 HA THR 24 -11.696 -6.432 2.505
171 HB THR 24 HB THR 24 -9.594 -7.328 4.493
172 HG1 THR 24 HG1 THR 24 -11.636 -5.333 4.675
173 HG21 THR 24 HG21 THR 24 -10.007 -4.745 2.955
174 HG22 THR 24 HG22 THR 24 -8.814 -5.982 2.560
175 HG23 THR 24 HG23 THR 24 -8.679 -5.078 4.068
176 H ASP 25 HN ASP 25 -12.045 -8.065 0.884
177 HA ASP 25 HA ASP 25 -9.897 -9.988 0.562
178 HB2 ASP 25 HB2 ASP 25 -12.681 -9.855 -0.489
179 HB3 ASP 25 HB1 ASP 25 -11.461 -10.720 -1.413
180 H LEU 26 HN LEU 26 -8.279 -9.281 -0.432
181 HA LEU 26 HA LEU 26 -8.612 -7.629 -2.836
182 HB2 LEU 26 HB2 LEU 26 -6.124 -8.286 -1.219
183 HB3 LEU 26 HB1 LEU 26 -6.130 -7.310 -2.665
184 HG LEU 26 HG LEU 26 -5.925 -5.788 -0.945
185 HD11 LEU 26 HD11 LEU 26 -7.554 -5.040 -2.503
186 HD12 LEU 26 HD12 LEU 26 -7.963 -4.468 -0.886
187 HD13 LEU 26 HD13 LEU 26 -8.845 -5.823 -1.591
188 HD21 LEU 26 HD21 LEU 26 -7.310 -5.713 1.089
189 HD22 LEU 26 HD22 LEU 26 -6.394 -7.216 0.956
190 HD23 LEU 26 HD23 LEU 26 -8.116 -7.196 0.577
191 H SER 27 HN SER 27 -9.066 -10.488 -2.235
192 HA SER 27 HA SER 27 -7.255 -12.224 -3.428
193 HB2 SER 27 HB2 SER 27 -10.254 -12.494 -3.236
194 HB3 SER 27 HB1 SER 27 -9.041 -13.780 -3.183
195 HG SER 27 HG SER 27 -10.052 -12.711 -1.083
196 H GLY 28 HN GLY 28 -6.759 -12.379 -5.536
197 HA2 GLY 28 HA2 GLY 28 -7.456 -12.815 -7.805
198 HA3 GLY 28 HA1 GLY 28 -8.786 -11.679 -7.561
199 H ASP 29 HN ASP 29 -8.498 -9.638 -8.193
200 HA ASP 29 HA ASP 29 -5.759 -8.645 -8.260
201 HB2 ASP 29 HB2 ASP 29 -6.306 -9.057 -10.602
202 HB3 ASP 29 HB1 ASP 29 -7.795 -8.119 -10.436
203 H PHE 30 HN PHE 30 -5.508 -6.901 -7.247
204 HA PHE 30 HA PHE 30 -7.823 -5.167 -6.814
205 HB2 PHE 30 HB2 PHE 30 -7.040 -4.689 -4.559
206 HB3 PHE 30 HB1 PHE 30 -7.296 -6.415 -4.747
207 HD1 PHE 30 HD2 PHE 30 -5.217 -7.886 -5.135
208 HD2 PHE 30 HD1 PHE 30 -5.004 -3.851 -3.792
209 HE1 PHE 30 HE2 PHE 30 -2.952 -8.295 -4.272
210 HE2 PHE 30 HE1 PHE 30 -2.742 -4.258 -2.927
211 HZ PHE 30 HZ PHE 30 -1.711 -6.482 -3.166
212 H LEU 31 HN LEU 31 -5.104 -5.417 -8.499
213 HA LEU 31 HA LEU 31 -3.771 -3.058 -7.561
214 HB2 LEU 31 HB2 LEU 31 -3.166 -4.907 -9.861
215 HB3 LEU 31 HB1 LEU 31 -2.202 -3.507 -9.456
216 HG LEU 31 HG LEU 31 -1.071 -5.404 -8.665
217 HD11 LEU 31 HD11 LEU 31 -2.373 -4.065 -6.324
218 HD12 LEU 31 HD12 LEU 31 -0.913 -3.552 -7.173
219 HD13 LEU 31 HD13 LEU 31 -0.918 -5.057 -6.254
220 HD21 LEU 31 HD21 LEU 31 -2.828 -7.054 -8.609
221 HD22 LEU 31 HD22 LEU 31 -3.583 -6.247 -7.236
222 HD23 LEU 31 HD23 LEU 31 -2.011 -7.021 -7.043
223 H ASP 32 HN ASP 32 -5.999 -3.896 -10.112
224 HA ASP 32 HA ASP 32 -5.471 -1.457 -11.591
225 HB2 ASP 32 HB2 ASP 32 -6.106 -3.502 -12.792
226 HB3 ASP 32 HB1 ASP 32 -7.655 -3.517 -11.966
227 H LEU 33 HN LEU 33 -7.657 -2.471 -9.125
228 HA LEU 33 HA LEU 33 -9.674 -0.575 -9.772
229 HB2 LEU 33 HB2 LEU 33 -10.755 -1.252 -7.622
230 HB3 LEU 33 HB1 LEU 33 -10.486 -2.541 -8.767
231 HG LEU 33 HG LEU 33 -8.470 -3.203 -7.364
232 HD11 LEU 33 HD11 LEU 33 -8.430 -2.500 -5.034
233 HD12 LEU 33 HD12 LEU 33 -9.724 -1.345 -5.354
234 HD13 LEU 33 HD13 LEU 33 -8.150 -1.142 -6.124
235 HD21 LEU 33 HD21 LEU 33 -11.199 -3.324 -6.103
236 HD22 LEU 33 HD22 LEU 33 -9.834 -4.375 -5.714
237 HD23 LEU 33 HD23 LEU 33 -10.560 -4.428 -7.320
238 H ARG 34 HN ARG 34 -10.575 0.913 -7.993
239 HA ARG 34 HA ARG 34 -8.388 2.717 -7.360
240 HB2 ARG 34 HB2 ARG 34 -11.389 3.094 -7.261
241 HB3 ARG 34 HB1 ARG 34 -10.196 4.340 -6.930
242 HG2 ARG 34 HG2 ARG 34 -10.583 2.925 -9.551
243 HG3 ARG 34 HG1 ARG 34 -11.133 4.558 -9.159
244 HD2 ARG 34 HD2 ARG 34 -8.865 5.269 -8.811
245 HD3 ARG 34 HD1 ARG 34 -8.262 3.643 -9.095
246 HE ARG 34 HE ARG 34 -9.807 4.601 -11.266
247 HH11 ARG 34 HH11 ARG 34 -6.667 4.881 -9.717
248 HH12 ARG 34 HH12 ARG 34 -5.782 5.289 -11.093
249 HH21 ARG 34 HH21 ARG 34 -8.638 5.146 -13.270
250 HH22 ARG 34 HH22 ARG 34 -6.967 5.427 -13.219
251 H PHE 35 HN PHE 35 -8.330 3.674 -5.287
252 HA PHE 35 HA PHE 35 -8.732 1.815 -3.190
253 HB2 PHE 35 HB2 PHE 35 -8.015 4.746 -3.119
254 HB3 PHE 35 HB1 PHE 35 -8.105 3.740 -1.674
255 HD1 PHE 35 HD2 PHE 35 -6.576 1.683 -1.512
256 HD2 PHE 35 HD1 PHE 35 -6.146 4.734 -4.470
257 HE1 PHE 35 HE2 PHE 35 -4.306 0.977 -1.918
258 HE2 PHE 35 HE1 PHE 35 -3.839 4.003 -4.870
259 HZ PHE 35 HZ PHE 35 -2.945 2.011 -3.545
260 H GLU 36 HN GLU 36 -10.538 4.501 -4.372
261 HA GLU 36 HA GLU 36 -12.545 4.763 -2.512
262 HB2 GLU 36 HB2 GLU 36 -12.252 6.190 -4.483
263 HB3 GLU 36 HB1 GLU 36 -12.728 4.860 -5.524
264 HG2 GLU 36 HG2 GLU 36 -14.946 4.871 -4.515
265 HG3 GLU 36 HG1 GLU 36 -14.461 6.216 -3.484
266 H ASP 37 HN ASP 37 -12.122 2.294 -5.030
267 HA ASP 37 HA ASP 37 -14.650 1.059 -4.923
268 HB2 ASP 37 HB2 ASP 37 -11.948 -0.008 -5.727
269 HB3 ASP 37 HB1 ASP 37 -13.372 -1.031 -5.709
270 H ILE 38 HN ILE 38 -11.833 0.723 -2.941
271 HA ILE 38 HA ILE 38 -13.204 -1.414 -1.502
272 HB ILE 38 HB ILE 38 -10.957 -2.004 -0.541
273 HG12 ILE 38 HG12 ILE 38 -9.977 -0.119 -2.714
274 HG13 ILE 38 HG11 ILE 38 -9.825 0.145 -0.982
275 HG21 ILE 38 HG21 ILE 38 -11.317 -2.147 -3.518
276 HG22 ILE 38 HG22 ILE 38 -11.986 -3.265 -2.332
277 HG23 ILE 38 HG23 ILE 38 -10.233 -3.185 -2.584
278 HD11 ILE 38 HD11 ILE 38 -8.349 -1.799 -0.823
279 HD12 ILE 38 HD12 ILE 38 -7.727 -0.598 -1.953
280 HD13 ILE 38 HD13 ILE 38 -8.507 -2.059 -2.559
281 H GLY 39 HN GLY 39 -13.351 1.546 -1.278
282 HA2 GLY 39 HA2 GLY 39 -13.835 3.057 0.409
283 HA3 GLY 39 HA1 GLY 39 -13.967 1.665 1.470
284 H TYR 40 HN TYR 40 -11.088 2.758 -0.253
285 HA TYR 40 HA TYR 40 -9.843 3.192 2.346
286 HB2 TYR 40 HB2 TYR 40 -8.765 2.103 -0.194
287 HB3 TYR 40 HB1 TYR 40 -7.687 3.067 0.806
288 HD1 TYR 40 HD2 TYR 40 -9.983 0.163 0.935
289 HD2 TYR 40 HD1 TYR 40 -6.581 2.070 2.607
290 HE1 TYR 40 HE2 TYR 40 -9.605 -1.794 2.314
291 HE2 TYR 40 HE1 TYR 40 -6.162 0.110 4.020
292 HH TYR 40 HH TYR 40 -7.872 -2.857 3.621
293 H ASP 41 HN ASP 41 -9.215 5.000 2.913
294 HA ASP 41 HA ASP 41 -9.175 7.262 1.044
295 HB2 ASP 41 HB2 ASP 41 -9.216 7.175 4.078
296 HB3 ASP 41 HB1 ASP 41 -9.196 8.640 3.109
297 H SER 42 HN SER 42 -7.416 8.804 1.397
298 HA SER 42 HA SER 42 -4.836 7.747 1.296
299 HB2 SER 42 HB2 SER 42 -4.264 10.187 1.783
300 HB3 SER 42 HB1 SER 42 -5.284 9.875 0.367
301 H LEU 43 HN LEU 43 -6.667 9.199 3.821
302 HA LEU 43 HA LEU 43 -4.896 9.333 5.935
303 HB2 LEU 43 HB2 LEU 43 -7.836 8.702 6.063
304 HB3 LEU 43 HB1 LEU 43 -6.862 9.334 7.377
305 HG LEU 43 HG LEU 43 -7.467 10.768 4.790
306 HD11 LEU 43 HD11 LEU 43 -9.404 10.631 6.243
307 HD12 LEU 43 HD12 LEU 43 -8.768 12.275 6.145
308 HD13 LEU 43 HD13 LEU 43 -8.455 11.297 7.581
309 HD21 LEU 43 HD21 LEU 43 -6.393 12.691 5.840
310 HD22 LEU 43 HD22 LEU 43 -5.267 11.346 5.642
311 HD23 LEU 43 HD23 LEU 43 -5.961 11.692 7.228
312 H ALA 44 HN ALA 44 -6.638 6.529 4.731
313 HA ALA 44 HA ALA 44 -5.808 4.872 6.954
314 HB1 ALA 44 HB1 ALA 44 -7.990 4.478 5.898
315 HB2 ALA 44 HB2 ALA 44 -6.944 3.063 5.752
316 HB3 ALA 44 HB3 ALA 44 -7.183 4.130 4.368
317 H LEU 45 HN LEU 45 -5.009 5.423 3.586
318 HA LEU 45 HA LEU 45 -3.250 3.297 3.199
319 HB2 LEU 45 HB2 LEU 45 -3.304 6.015 1.908
320 HB3 LEU 45 HB1 LEU 45 -2.339 4.672 1.326
321 HG LEU 45 HG LEU 45 -5.347 4.712 1.485
322 HD11 LEU 45 HD11 LEU 45 -5.247 4.822 -0.953
323 HD12 LEU 45 HD12 LEU 45 -3.490 4.944 -0.875
324 HD13 LEU 45 HD13 LEU 45 -4.493 6.234 -0.212
325 HD21 LEU 45 HD21 LEU 45 -3.426 2.707 0.323
326 HD22 LEU 45 HD22 LEU 45 -5.184 2.639 0.195
327 HD23 LEU 45 HD23 LEU 45 -4.405 2.482 1.774
328 H MET 46 HN MET 46 -2.747 6.512 4.506
329 HA MET 46 HA MET 46 0.092 6.415 4.586
330 HB2 MET 46 HB2 MET 46 -1.794 8.021 6.321
331 HB3 MET 46 HB1 MET 46 -0.053 8.235 6.274
332 HG2 MET 46 HG2 MET 46 -0.220 8.860 3.896
333 HG3 MET 46 HG1 MET 46 -1.972 8.675 4.001
334 HE1 MET 46 HE1 MET 46 -3.499 10.202 5.646
335 HE2 MET 46 HE2 MET 46 -2.845 11.512 6.629
336 HE3 MET 46 HE3 MET 46 -2.433 9.840 7.002
337 H GLU 47 HN GLU 47 -2.392 5.185 6.668
338 HA GLU 47 HA GLU 47 -0.747 4.705 8.946
339 HB2 GLU 47 HB2 GLU 47 -3.302 4.901 8.872
340 HB3 GLU 47 HB1 GLU 47 -3.328 3.317 8.141
341 HG2 GLU 47 HG2 GLU 47 -2.197 3.865 10.885
342 HG3 GLU 47 HG1 GLU 47 -3.872 3.424 10.593
343 H THR 48 HN THR 48 -1.895 2.809 6.175
344 HA THR 48 HA THR 48 -0.763 0.336 6.595
345 HB THR 48 HB THR 48 -0.787 1.778 3.928
346 HG1 THR 48 HG1 THR 48 -2.874 0.954 5.590
347 HG21 THR 48 HG21 THR 48 -1.392 -0.443 3.068
348 HG22 THR 48 HG22 THR 48 -1.363 -1.090 4.708
349 HG23 THR 48 HG23 THR 48 0.127 -0.509 3.965
350 H ALA 49 HN ALA 49 0.529 3.024 4.690
351 HA ALA 49 HA ALA 49 3.017 2.059 4.052
352 HB1 ALA 49 HB1 ALA 49 3.656 4.351 3.626
353 HB2 ALA 49 HB2 ALA 49 2.285 4.927 4.577
354 HB3 ALA 49 HB3 ALA 49 2.009 4.051 3.071
355 H ALA 50 HN ALA 50 2.190 4.087 6.861
356 HA ALA 50 HA ALA 50 4.781 4.368 7.865
357 HB1 ALA 50 HB1 ALA 50 2.895 5.747 8.574
358 HB2 ALA 50 HB2 ALA 50 3.769 5.051 9.939
359 HB3 ALA 50 HB3 ALA 50 2.223 4.362 9.434
360 H ARG 51 HN ARG 51 2.459 1.765 8.384
361 HA ARG 51 HA ARG 51 4.081 0.629 10.488
362 HB2 ARG 51 HB2 ARG 51 1.552 0.383 10.319
363 HB3 ARG 51 HB1 ARG 51 1.841 -0.746 9.001
364 HG2 ARG 51 HG2 ARG 51 3.105 -2.192 10.515
365 HG3 ARG 51 HG1 ARG 51 2.821 -1.054 11.833
366 HD2 ARG 51 HD2 ARG 51 0.350 -1.378 11.396
367 HD3 ARG 51 HD1 ARG 51 0.844 -2.692 10.320
368 HE ARG 51 HE ARG 51 2.081 -3.249 12.694
369 HH11 ARG 51 HH11 ARG 51 -1.324 -2.660 11.827
370 HH12 ARG 51 HH12 ARG 51 -1.924 -3.767 12.976
371 HH21 ARG 51 HH21 ARG 51 1.222 -4.677 14.296
372 HH22 ARG 51 HH22 ARG 51 -0.490 -4.867 14.419
373 H LEU 52 HN LEU 52 3.557 0.204 7.077
374 HA LEU 52 HA LEU 52 5.076 -2.164 6.810
375 HB2 LEU 52 HB2 LEU 52 4.477 -0.077 4.723
376 HB3 LEU 52 HB1 LEU 52 5.101 -1.685 4.413
377 HG LEU 52 HG LEU 52 2.390 -0.948 5.464
378 HD11 LEU 52 HD11 LEU 52 2.641 -0.669 3.091
379 HD12 LEU 52 HD12 LEU 52 1.592 -2.043 3.443
380 HD13 LEU 52 HD13 LEU 52 3.262 -2.313 2.940
381 HD21 LEU 52 HD21 LEU 52 1.903 -3.356 5.504
382 HD22 LEU 52 HD22 LEU 52 3.167 -2.918 6.654
383 HD23 LEU 52 HD23 LEU 52 3.594 -3.693 5.129
384 H GLU 53 HN GLU 53 5.918 1.208 6.933
385 HA GLU 53 HA GLU 53 8.480 1.144 5.919
386 HB2 GLU 53 HB2 GLU 53 7.499 2.697 8.323
387 HB3 GLU 53 HB1 GLU 53 9.019 2.989 7.500
388 HG2 GLU 53 HG2 GLU 53 7.751 3.556 5.462
389 HG3 GLU 53 HG1 GLU 53 6.258 3.357 6.384
390 H SER 54 HN SER 54 7.393 0.578 9.237
391 HA SER 54 HA SER 54 9.873 -0.081 10.343
392 HB2 SER 54 HB2 SER 54 7.116 -0.894 11.247
393 HB3 SER 54 HB1 SER 54 8.552 -0.639 12.252
394 HG SER 54 HG SER 54 8.484 1.543 11.762
395 H ARG 55 HN ARG 55 7.251 -1.991 8.965
396 HA ARG 55 HA ARG 55 8.280 -4.501 9.793
397 HB2 ARG 55 HB2 ARG 55 5.913 -4.152 9.499
398 HB3 ARG 55 HB1 ARG 55 6.139 -3.809 7.794
399 HG2 ARG 55 HG2 ARG 55 6.674 -6.070 7.328
400 HG3 ARG 55 HG1 ARG 55 6.809 -6.458 9.046
401 HD2 ARG 55 HD2 ARG 55 4.276 -5.543 7.687
402 HD3 ARG 55 HD1 ARG 55 4.675 -7.227 8.036
403 HE ARG 55 HE ARG 55 4.926 -5.811 10.409
404 HH11 ARG 55 HH11 ARG 55 2.217 -6.525 8.170
405 HH12 ARG 55 HH12 ARG 55 1.078 -6.623 9.438
406 HH21 ARG 55 HH21 ARG 55 3.314 -6.099 12.104
407 HH22 ARG 55 HH22 ARG 55 1.704 -6.461 11.680
408 H TYR 56 HN TYR 56 8.295 -2.885 6.599
409 HA TYR 56 HA TYR 56 9.892 -5.103 5.582
410 HB2 TYR 56 HB2 TYR 56 8.483 -2.856 4.146
411 HB3 TYR 56 HB1 TYR 56 9.531 -4.018 3.341
412 HD1 TYR 56 HD2 TYR 56 8.874 -6.392 3.228
413 HD2 TYR 56 HD1 TYR 56 6.254 -3.445 4.807
414 HE1 TYR 56 HE2 TYR 56 6.994 -7.947 2.981
415 HE2 TYR 56 HE1 TYR 56 4.362 -4.989 4.571
416 HH TYR 56 HH TYR 56 3.758 -7.007 3.192
417 H GLY 57 HN GLY 57 10.414 -2.049 6.863
418 HA2 GLY 57 HA2 GLY 57 12.446 -1.002 7.202
419 HA3 GLY 57 HA1 GLY 57 13.204 -2.205 6.167
420 H VAL 58 HN VAL 58 10.768 0.321 5.820
421 HA VAL 58 HA VAL 58 12.289 1.387 3.577
422 HB VAL 58 HB VAL 58 10.223 1.815 2.247
423 HG11 VAL 58 HG11 VAL 58 10.704 -1.083 2.851
424 HG12 VAL 58 HG12 VAL 58 11.597 -0.093 1.687
425 HG13 VAL 58 HG13 VAL 58 9.884 -0.449 1.426
426 HG21 VAL 58 HG21 VAL 58 8.168 0.575 2.750
427 HG22 VAL 58 HG22 VAL 58 8.568 1.727 4.021
428 HG23 VAL 58 HG23 VAL 58 8.888 0.007 4.258
429 H SER 59 HN SER 59 11.172 3.531 2.844
430 HA SER 59 HA SER 59 10.245 4.993 5.186
431 HB2 SER 59 HB2 SER 59 12.250 5.945 3.112
432 HB3 SER 59 HB1 SER 59 11.635 6.889 4.468
433 HG SER 59 HG SER 59 13.179 6.091 5.566
434 H ILE 60 HN ILE 60 8.267 5.656 4.691
435 HA ILE 60 HA ILE 60 7.693 6.474 1.927
436 HB ILE 60 HB ILE 60 5.753 4.932 3.683
437 HG12 ILE 60 HG12 ILE 60 7.196 3.991 1.187
438 HG13 ILE 60 HG11 ILE 60 7.626 3.519 2.827
439 HG21 ILE 60 HG21 ILE 60 5.558 5.846 0.804
440 HG22 ILE 60 HG22 ILE 60 4.670 6.519 2.173
441 HG23 ILE 60 HG23 ILE 60 4.360 4.864 1.649
442 HD11 ILE 60 HD11 ILE 60 5.013 2.943 1.451
443 HD12 ILE 60 HD12 ILE 60 5.451 2.451 3.088
444 HD13 ILE 60 HD13 ILE 60 6.329 1.797 1.703
445 HA PRO 61 HA PRO 61 6.524 10.060 4.422
446 HB2 PRO 61 HB2 PRO 61 6.124 11.164 1.696
447 HB3 PRO 61 HB1 PRO 61 7.079 11.812 3.033
448 HG2 PRO 61 HG2 PRO 61 8.271 10.722 0.916
449 HG3 PRO 61 HG1 PRO 61 8.907 10.462 2.552
450 HD2 PRO 61 HD2 PRO 61 7.259 8.632 0.850
451 HD3 PRO 61 HD1 PRO 61 8.667 8.258 1.872
452 H ASP 62 HN ASP 62 4.570 10.874 4.932
453 HA ASP 62 HA ASP 62 2.278 9.389 4.649
454 HB2 ASP 62 HB2 ASP 62 2.520 12.322 5.309
455 HB3 ASP 62 HB1 ASP 62 1.104 11.330 5.601
456 H ASP 63 HN ASP 63 3.023 12.455 3.069
457 HA ASP 63 HA ASP 63 0.526 12.697 1.752
458 HB2 ASP 63 HB2 ASP 63 1.364 14.596 0.648
459 HB3 ASP 63 HB1 ASP 63 2.256 14.553 2.157
460 H VAL 64 HN VAL 64 3.399 11.075 0.905
461 HA VAL 64 HA VAL 64 2.943 10.678 -1.884
462 HB VAL 64 HB VAL 64 4.512 9.045 0.094
463 HG11 VAL 64 HG11 VAL 64 4.724 9.200 -2.929
464 HG12 VAL 64 HG12 VAL 64 4.126 7.826 -1.999
465 HG13 VAL 64 HG13 VAL 64 5.823 8.295 -1.886
466 HG21 VAL 64 HG21 VAL 64 5.404 11.316 -1.679
467 HG22 VAL 64 HG22 VAL 64 6.472 10.323 -0.683
468 HG23 VAL 64 HG23 VAL 64 5.254 11.346 0.078
469 H ALA 65 HN ALA 65 2.385 8.773 1.028
470 HA ALA 65 HA ALA 65 1.240 6.498 -0.179
471 HB1 ALA 65 HB1 ALA 65 2.080 6.511 2.128
472 HB2 ALA 65 HB2 ALA 65 0.402 5.960 2.045
473 HB3 ALA 65 HB3 ALA 65 0.763 7.595 2.587
474 H GLY 66 HN GLY 66 -0.028 9.593 0.662
475 HA2 GLY 66 HA2 GLY 66 -2.776 8.765 0.277
476 HA3 GLY 66 HA1 GLY 66 -2.218 10.395 0.620
477 H ARG 67 HN ARG 67 -0.298 9.444 -1.822
478 HA ARG 67 HA ARG 67 -2.011 10.827 -3.755
479 HB2 ARG 67 HB2 ARG 67 0.287 11.702 -3.364
480 HB3 ARG 67 HB1 ARG 67 0.918 10.159 -3.944
481 HG2 ARG 67 HG2 ARG 67 -0.164 10.556 -6.117
482 HG3 ARG 67 HG1 ARG 67 -0.676 12.142 -5.544
483 HD2 ARG 67 HD2 ARG 67 1.611 12.836 -5.298
484 HD3 ARG 67 HD1 ARG 67 2.180 11.215 -5.704
485 HE ARG 67 HE ARG 67 0.548 12.683 -7.610
486 HH11 ARG 67 HH11 ARG 67 3.754 11.411 -6.721
487 HH12 ARG 67 HH12 ARG 67 4.389 11.467 -8.285
488 HH21 ARG 67 HH21 ARG 67 1.410 12.725 -9.801
489 HH22 ARG 67 HH22 ARG 67 3.041 12.283 -10.078
490 H VAL 68 HN VAL 68 -0.713 7.712 -3.081
491 HA VAL 68 HA VAL 68 -0.253 6.646 -5.579
492 HB VAL 68 HB VAL 68 -0.690 4.379 -4.581
493 HG11 VAL 68 HG11 VAL 68 1.148 4.517 -2.962
494 HG12 VAL 68 HG12 VAL 68 1.002 6.276 -2.959
495 HG13 VAL 68 HG13 VAL 68 1.493 5.434 -4.429
496 HG21 VAL 68 HG21 VAL 68 -1.144 4.226 -2.187
497 HG22 VAL 68 HG22 VAL 68 -2.491 5.001 -3.028
498 HG23 VAL 68 HG23 VAL 68 -1.339 5.976 -2.106
499 H ASP 69 HN ASP 69 -1.324 6.467 -7.239
500 HA ASP 69 HA ASP 69 -4.091 6.989 -7.555
501 HB2 ASP 69 HB2 ASP 69 -2.281 7.344 -9.291
502 HB3 ASP 69 HB1 ASP 69 -2.264 5.610 -9.517
503 H THR 70 HN THR 70 -2.296 3.981 -7.772
504 HA THR 70 HA THR 70 -4.800 2.522 -7.376
505 HB THR 70 HB THR 70 -3.942 0.817 -8.970
506 HG1 THR 70 HG1 THR 70 -2.193 1.752 -10.434
507 HG21 THR 70 HG21 THR 70 -5.527 2.512 -9.767
508 HG22 THR 70 HG22 THR 70 -4.386 2.087 -11.054
509 HG23 THR 70 HG23 THR 70 -4.183 3.593 -10.138
510 HA PRO 71 HA PRO 71 -2.296 0.255 -4.446
511 HB2 PRO 71 HB2 PRO 71 -3.409 -2.233 -5.667
512 HB3 PRO 71 HB1 PRO 71 -3.408 -1.723 -3.971
513 HG2 PRO 71 HG2 PRO 71 -5.648 -1.562 -5.329
514 HG3 PRO 71 HG1 PRO 71 -5.156 -0.189 -4.309
515 HD2 PRO 71 HD2 PRO 71 -4.834 -0.537 -7.276
516 HD3 PRO 71 HD1 PRO 71 -5.495 0.857 -6.393
517 H ARG 72 HN ARG 72 -2.262 -0.492 -7.847
518 HA ARG 72 HA ARG 72 0.115 -2.053 -7.820
519 HB2 ARG 72 HB2 ARG 72 -1.408 -2.120 -9.745
520 HB3 ARG 72 HB1 ARG 72 -1.097 -0.422 -10.067
521 HG2 ARG 72 HG2 ARG 72 1.203 -0.906 -10.629
522 HG3 ARG 72 HG1 ARG 72 0.984 -2.600 -10.187
523 HD2 ARG 72 HD2 ARG 72 -0.496 -1.168 -12.391
524 HD3 ARG 72 HD1 ARG 72 0.898 -2.223 -12.625
525 HE ARG 72 HE ARG 72 -0.535 -3.984 -11.546
526 HH11 ARG 72 HH11 ARG 72 -1.992 -1.324 -13.454
527 HH12 ARG 72 HH12 ARG 72 -3.308 -2.296 -13.938
528 HH21 ARG 72 HH21 ARG 72 -2.455 -5.211 -12.222
529 HH22 ARG 72 HH22 ARG 72 -3.604 -4.475 -13.206
530 H GLU 73 HN GLU 73 -0.561 1.395 -8.182
531 HA GLU 73 HA GLU 73 2.146 2.139 -8.552
532 HB2 GLU 73 HB2 GLU 73 0.287 3.613 -9.193
533 HB3 GLU 73 HB1 GLU 73 -0.188 3.761 -7.509
534 HG2 GLU 73 HG2 GLU 73 1.767 5.004 -6.978
535 HG3 GLU 73 HG1 GLU 73 2.485 4.656 -8.558
536 H LEU 74 HN LEU 74 0.096 1.722 -5.754
537 HA LEU 74 HA LEU 74 1.875 2.677 -3.769
538 HB2 LEU 74 HB2 LEU 74 -0.642 2.025 -3.600
539 HB3 LEU 74 HB1 LEU 74 -0.079 0.388 -3.401
540 HG LEU 74 HG LEU 74 0.524 2.673 -1.501
541 HD11 LEU 74 HD11 LEU 74 -1.453 0.420 -1.266
542 HD12 LEU 74 HD12 LEU 74 -1.827 2.129 -1.493
543 HD13 LEU 74 HD13 LEU 74 -1.063 1.585 0.000
544 HD21 LEU 74 HD21 LEU 74 1.258 0.926 0.049
545 HD22 LEU 74 HD22 LEU 74 2.231 0.907 -1.424
546 HD23 LEU 74 HD23 LEU 74 0.969 -0.299 -1.185
547 H LEU 75 HN LEU 75 1.353 -0.503 -5.208
548 HA LEU 75 HA LEU 75 3.229 -2.056 -3.871
549 HB2 LEU 75 HB2 LEU 75 1.488 -2.903 -5.384
550 HB3 LEU 75 HB1 LEU 75 2.297 -2.161 -6.743
551 HG LEU 75 HG LEU 75 4.208 -3.733 -6.378
552 HD11 LEU 75 HD11 LEU 75 3.847 -5.689 -4.973
553 HD12 LEU 75 HD12 LEU 75 2.325 -5.001 -4.403
554 HD13 LEU 75 HD13 LEU 75 3.850 -4.205 -4.021
555 HD21 LEU 75 HD21 LEU 75 1.500 -4.980 -6.814
556 HD22 LEU 75 HD22 LEU 75 3.050 -5.678 -7.291
557 HD23 LEU 75 HD23 LEU 75 2.489 -4.181 -8.038
558 H ASP 76 HN ASP 76 3.541 -0.307 -6.948
559 HA ASP 76 HA ASP 76 6.235 -0.791 -7.482
560 HB2 ASP 76 HB2 ASP 76 4.819 0.118 -9.192
561 HB3 ASP 76 HB1 ASP 76 4.506 1.566 -8.239
562 H LEU 77 HN LEU 77 4.772 1.871 -5.703
563 HA LEU 77 HA LEU 77 6.990 3.440 -5.171
564 HB2 LEU 77 HB2 LEU 77 4.742 4.135 -4.625
565 HB3 LEU 77 HB1 LEU 77 4.586 2.844 -3.455
566 HG LEU 77 HG LEU 77 6.355 3.932 -2.092
567 HD11 LEU 77 HD11 LEU 77 6.943 6.255 -2.548
568 HD12 LEU 77 HD12 LEU 77 6.063 6.176 -4.076
569 HD13 LEU 77 HD13 LEU 77 7.494 5.172 -3.827
570 HD21 LEU 77 HD21 LEU 77 3.924 5.601 -2.715
571 HD22 LEU 77 HD22 LEU 77 4.911 5.721 -1.258
572 HD23 LEU 77 HD23 LEU 77 4.001 4.248 -1.586
573 H ILE 78 HN ILE 78 5.709 0.738 -3.266
574 HA ILE 78 HA ILE 78 7.840 0.907 -1.386
575 HB ILE 78 HB ILE 78 5.911 -1.412 -1.769
576 HG12 ILE 78 HG12 ILE 78 5.784 1.015 0.040
577 HG13 ILE 78 HG11 ILE 78 4.695 0.642 -1.289
578 HG21 ILE 78 HG21 ILE 78 6.523 -1.981 0.551
579 HG22 ILE 78 HG22 ILE 78 7.674 -0.645 0.571
580 HG23 ILE 78 HG23 ILE 78 7.932 -2.015 -0.510
581 HD11 ILE 78 HD11 ILE 78 3.651 0.169 0.845
582 HD12 ILE 78 HD12 ILE 78 4.985 -0.885 1.282
583 HD13 ILE 78 HD13 ILE 78 3.907 -1.339 -0.044
584 H ASN 79 HN ASN 79 7.156 -1.179 -4.166
585 HA ASN 79 HA ASN 79 9.337 -2.916 -3.871
586 HB2 ASN 79 HB2 ASN 79 7.916 -2.010 -6.377
587 HB3 ASN 79 HB1 ASN 79 9.238 -3.167 -6.420
588 HD21 ASN 79 HD21 ASN 79 8.399 -4.422 -3.891
589 HD22 ASN 79 HD22 ASN 79 6.998 -5.361 -4.310
590 H GLY 80 HN GLY 80 9.187 0.203 -5.545
591 HA2 GLY 80 HA2 GLY 80 11.832 0.246 -6.462
592 HA3 GLY 80 HA1 GLY 80 10.841 1.662 -6.136
593 H ALA 81 HN ALA 81 10.440 1.133 -3.367
594 HA ALA 81 HA ALA 81 12.853 2.225 -2.308
595 HB1 ALA 81 HB1 ALA 81 10.410 1.201 -0.855
596 HB2 ALA 81 HB2 ALA 81 10.655 2.856 -1.412
597 HB3 ALA 81 HB3 ALA 81 11.693 2.185 -0.152
598 H LEU 82 HN LEU 82 11.273 -0.888 -2.194
599 HA LEU 82 HA LEU 82 12.970 -2.164 -0.341
600 HB2 LEU 82 HB2 LEU 82 11.208 -3.229 -2.510
601 HB3 LEU 82 HB1 LEU 82 12.075 -4.260 -1.394
602 HG LEU 82 HG LEU 82 10.049 -2.196 -0.539
603 HD11 LEU 82 HD11 LEU 82 8.558 -4.091 -0.215
604 HD12 LEU 82 HD12 LEU 82 9.790 -5.166 -0.879
605 HD13 LEU 82 HD13 LEU 82 9.034 -3.945 -1.911
606 HD21 LEU 82 HD21 LEU 82 10.112 -3.426 1.570
607 HD22 LEU 82 HD22 LEU 82 11.703 -2.783 1.163
608 HD23 LEU 82 HD23 LEU 82 11.353 -4.494 0.915
609 H ALA 83 HN ALA 83 13.188 -1.815 -3.833
610 HA ALA 83 HA ALA 83 15.376 -3.639 -4.114
611 HB1 ALA 83 HB1 ALA 83 13.865 -3.130 -5.982
612 HB2 ALA 83 HB2 ALA 83 15.540 -2.762 -6.392
613 HB3 ALA 83 HB3 ALA 83 14.428 -1.458 -5.981
614 H GLU 84 HN GLU 84 15.044 -0.493 -3.019
615 HA GLU 84 HA GLU 84 17.846 0.230 -3.475
616 HB2 GLU 84 HB2 GLU 84 16.122 1.819 -4.182
617 HB3 GLU 84 HB1 GLU 84 15.443 1.823 -2.566
618 HG2 GLU 84 HG2 GLU 84 17.450 2.881 -1.716
619 HG3 GLU 84 HG1 GLU 84 18.171 2.825 -3.325
620 H ALA 85 HN ALA 85 15.958 -1.280 -1.246
621 HA ALA 85 HA ALA 85 16.873 0.028 1.143
622 HB1 ALA 85 HB1 ALA 85 15.581 -1.673 2.314
623 HB2 ALA 85 HB2 ALA 85 15.321 -2.535 0.798
624 HB3 ALA 85 HB3 ALA 85 14.623 -0.932 1.030
625 H ALA 86 HN ALA 86 18.242 -0.817 2.637
626 HA ALA 86 HA ALA 86 20.040 -2.883 1.630
627 HB1 ALA 86 HB1 ALA 86 20.463 -0.866 3.847
628 HB2 ALA 86 HB2 ALA 86 21.104 -0.751 2.207
629 HB3 ALA 86 HB3 ALA 86 21.656 -2.036 3.282
630 H28 SXV 87 H28A SXV 87 -4.647 14.334 1.372
631 H28A SXV 87 H28B SXV 87 -5.527 14.618 2.866
632 H30 SXV 87 H30C SXV 87 -3.806 13.014 4.698
633 H30A SXV 87 H30A SXV 87 -4.422 14.636 5.013
634 H30B SXV 87 H30B SXV 87 -2.697 14.302 5.159
635 H31 SXV 87 H31C SXV 87 -1.324 13.866 3.098
636 H31A SXV 87 H31A SXV 87 -2.119 13.839 1.525
637 H31B SXV 87 H31B SXV 87 -2.432 12.556 2.697
638 H32 SXV 87 H32A SXV 87 -2.263 16.250 3.646
639 HO33 SXV 87 H33A SXV 87 -4.559 17.169 2.669
640 HN36 SXV 87 H36A SXV 87 -0.946 16.005 1.720
641 H37 SXV 87 H37B SXV 87 -1.539 17.789 -0.399
642 H37A SXV 87 H37A SXV 87 -1.798 16.128 -0.946
643 H38 SXV 87 H38B SXV 87 0.367 16.719 -1.602
644 H38A SXV 87 H38A SXV 87 0.526 15.565 -0.306
645 HN41 SXV 87 H41A SXV 87 2.717 16.592 -0.566
646 H42 SXV 87 H42B SXV 87 3.292 18.278 1.636
647 H42A SXV 87 H42A SXV 87 3.544 19.120 0.117
648 H43 SXV 87 H43B SXV 87 4.739 16.456 0.832
649 H43A SXV 87 H43A SXV 87 5.175 17.438 -0.553
650 H1 SXV 87 H1B SXV 87 4.407 18.727 3.068
651 H1A SXV 87 H1A SXV 87 5.118 17.124 3.327
652 H2 SXV 87 H2A SXV 87 6.524 19.660 4.058
653 H2A SXV 87 H2B SXV 87 7.054 18.004 4.324
654 H4 SXV 87 H4C SXV 87 4.470 20.212 6.587
655 H4A SXV 87 H4A SXV 87 6.048 20.636 5.916
656 H4B SXV 87 H4B SXV 87 5.945 19.653 7.384
Start of MODEL 5
1 H1 MET 1 HT1 MET 1 21.049 -10.138 -5.680
2 H2 MET 1 HT2 MET 1 20.962 -8.571 -5.039
3 H3 MET 1 HT3 MET 1 19.944 -9.009 -6.313
4 HA MET 1 HA MET 1 18.773 -10.517 -4.939
5 HB2 MET 1 HB2 MET 1 20.574 -11.172 -3.429
6 HB3 MET 1 HB1 MET 1 20.680 -9.532 -2.804
7 HG2 MET 1 HG2 MET 1 18.412 -9.745 -1.888
8 HG3 MET 1 HG1 MET 1 18.332 -11.395 -2.494
9 HE1 MET 1 HE1 MET 1 21.319 -10.034 0.762
10 HE2 MET 1 HE2 MET 1 20.168 -8.944 -0.011
11 HE3 MET 1 HE3 MET 1 21.492 -9.634 -0.949
12 H ALA 2 HN ALA 2 16.964 -9.446 -5.041
13 HA ALA 2 HA ALA 2 16.775 -6.887 -3.626
14 HB1 ALA 2 HB1 ALA 2 15.426 -7.625 -6.235
15 HB2 ALA 2 HB2 ALA 2 16.753 -6.480 -6.052
16 HB3 ALA 2 HB3 ALA 2 15.179 -6.127 -5.338
17 H THR 3 HN THR 3 15.474 -7.143 -1.970
18 HA THR 3 HA THR 3 13.606 -9.357 -1.857
19 HB THR 3 HB THR 3 14.171 -7.140 0.035
20 HG1 THR 3 HG1 THR 3 15.322 -9.088 1.111
21 HG21 THR 3 HG21 THR 3 12.872 -9.833 0.471
22 HG22 THR 3 HG22 THR 3 12.070 -8.263 0.514
23 HG23 THR 3 HG23 THR 3 13.245 -8.686 1.757
24 H LEU 4 HN LEU 4 11.784 -8.919 -3.012
25 HA LEU 4 HA LEU 4 10.657 -6.215 -2.772
26 HB2 LEU 4 HB2 LEU 4 10.392 -8.133 -5.085
27 HB3 LEU 4 HB1 LEU 4 9.643 -6.555 -4.977
28 HG LEU 4 HG LEU 4 12.609 -7.102 -5.155
29 HD11 LEU 4 HD11 LEU 4 12.433 -6.063 -7.355
30 HD12 LEU 4 HD12 LEU 4 10.685 -5.937 -7.150
31 HD13 LEU 4 HD13 LEU 4 11.450 -7.523 -7.240
32 HD21 LEU 4 HD21 LEU 4 12.844 -4.674 -5.380
33 HD22 LEU 4 HD22 LEU 4 12.151 -5.113 -3.819
34 HD23 LEU 4 HD23 LEU 4 11.114 -4.482 -5.096
35 H LEU 5 HN LEU 5 8.808 -6.129 -1.743
36 HA LEU 5 HA LEU 5 7.423 -8.540 -1.126
37 HB2 LEU 5 HB2 LEU 5 5.831 -7.109 0.120
38 HB3 LEU 5 HB1 LEU 5 7.489 -6.856 0.596
39 HG LEU 5 HG LEU 5 7.379 -4.760 -0.934
40 HD11 LEU 5 HD11 LEU 5 4.440 -5.214 -0.490
41 HD12 LEU 5 HD12 LEU 5 5.272 -5.257 -2.042
42 HD13 LEU 5 HD13 LEU 5 5.177 -3.747 -1.135
43 HD21 LEU 5 HD21 LEU 5 7.574 -4.658 1.457
44 HD22 LEU 5 HD22 LEU 5 5.846 -4.950 1.627
45 HD23 LEU 5 HD23 LEU 5 6.416 -3.446 0.899
46 H THR 6 HN THR 6 5.445 -9.217 -1.852
47 HA THR 6 HA THR 6 4.849 -8.170 -4.475
48 HB THR 6 HB THR 6 3.665 -10.419 -4.646
49 HG1 THR 6 HG1 THR 6 4.897 -11.861 -2.985
50 HG21 THR 6 HG21 THR 6 6.657 -10.342 -4.175
51 HG22 THR 6 HG22 THR 6 5.851 -9.925 -5.688
52 HG23 THR 6 HG23 THR 6 5.792 -11.581 -5.086
53 H THR 7 HN THR 7 2.377 -9.147 -4.909
54 HA THR 7 HA THR 7 0.638 -7.230 -3.883
55 HB THR 7 HB THR 7 -0.051 -9.921 -5.088
56 HG1 THR 7 HG1 THR 7 0.221 -8.904 -7.094
57 HG21 THR 7 HG21 THR 7 -1.997 -8.715 -5.972
58 HG22 THR 7 HG22 THR 7 -1.439 -7.234 -5.195
59 HG23 THR 7 HG23 THR 7 -1.945 -8.606 -4.211
60 H ASP 8 HN ASP 8 1.300 -10.565 -3.047
61 HA ASP 8 HA ASP 8 -0.708 -11.124 -1.211
62 HB2 ASP 8 HB2 ASP 8 0.720 -12.847 -2.086
63 HB3 ASP 8 HB1 ASP 8 2.143 -12.101 -1.369
64 H ASP 9 HN ASP 9 2.407 -9.564 -0.732
65 HA ASP 9 HA ASP 9 2.170 -9.414 2.135
66 HB2 ASP 9 HB2 ASP 9 4.287 -9.230 0.556
67 HB3 ASP 9 HB1 ASP 9 3.890 -7.514 0.614
68 H LEU 10 HN LEU 10 1.736 -7.265 -0.590
69 HA LEU 10 HA LEU 10 1.002 -4.920 0.709
70 HB2 LEU 10 HB2 LEU 10 1.465 -5.032 -1.678
71 HB3 LEU 10 HB1 LEU 10 0.068 -6.056 -1.927
72 HG LEU 10 HG LEU 10 -1.410 -4.188 -1.319
73 HD11 LEU 10 HD11 LEU 10 -0.496 -1.935 -1.099
74 HD12 LEU 10 HD12 LEU 10 1.139 -2.592 -1.169
75 HD13 LEU 10 HD13 LEU 10 0.083 -3.000 0.182
76 HD21 LEU 10 HD21 LEU 10 0.596 -3.550 -3.475
77 HD22 LEU 10 HD22 LEU 10 -1.017 -2.848 -3.329
78 HD23 LEU 10 HD23 LEU 10 -0.828 -4.573 -3.647
79 H ARG 11 HN ARG 11 -0.955 -7.659 -0.332
80 HA ARG 11 HA ARG 11 -3.491 -6.786 0.385
81 HB2 ARG 11 HB2 ARG 11 -2.962 -8.862 -0.876
82 HB3 ARG 11 HB1 ARG 11 -2.425 -9.593 0.630
83 HG2 ARG 11 HG2 ARG 11 -4.753 -9.120 1.522
84 HG3 ARG 11 HG1 ARG 11 -5.205 -8.766 -0.149
85 HD2 ARG 11 HD2 ARG 11 -4.139 -11.352 0.961
86 HD3 ARG 11 HD1 ARG 11 -5.749 -11.047 0.313
87 HE ARG 11 HE ARG 11 -4.717 -10.781 -1.861
88 HH11 ARG 11 HH11 ARG 11 -2.800 -12.343 0.675
89 HH12 ARG 11 HH12 ARG 11 -1.801 -13.231 -0.355
90 HH21 ARG 11 HH21 ARG 11 -3.345 -12.052 -3.384
91 HH22 ARG 11 HH22 ARG 11 -2.210 -13.136 -2.734
92 H ARG 12 HN ARG 12 -1.246 -8.821 2.282
93 HA ARG 12 HA ARG 12 -2.904 -8.894 4.547
94 HB2 ARG 12 HB2 ARG 12 -1.007 -9.748 5.850
95 HB3 ARG 12 HB1 ARG 12 -1.133 -10.558 4.301
96 HG2 ARG 12 HG2 ARG 12 0.707 -9.270 3.439
97 HG3 ARG 12 HG1 ARG 12 0.718 -8.323 4.935
98 HD2 ARG 12 HD2 ARG 12 1.379 -10.301 6.204
99 HD3 ARG 12 HD1 ARG 12 1.265 -11.300 4.755
100 HE ARG 12 HE ARG 12 3.072 -9.274 4.184
101 HH11 ARG 12 HH11 ARG 12 2.969 -11.870 6.629
102 HH12 ARG 12 HH12 ARG 12 4.631 -12.177 6.574
103 HH21 ARG 12 HH21 ARG 12 5.357 -9.705 4.117
104 HH22 ARG 12 HH22 ARG 12 6.032 -10.885 5.164
105 H ALA 13 HN ALA 13 -0.454 -6.545 3.708
106 HA ALA 13 HA ALA 13 -0.556 -5.213 6.241
107 HB1 ALA 13 HB1 ALA 13 0.742 -3.468 5.168
108 HB2 ALA 13 HB2 ALA 13 0.433 -4.193 3.589
109 HB3 ALA 13 HB3 ALA 13 1.398 -5.060 4.784
110 H LEU 14 HN LEU 14 -2.249 -4.890 3.193
111 HA LEU 14 HA LEU 14 -3.447 -2.398 3.810
112 HB2 LEU 14 HB2 LEU 14 -3.143 -3.286 1.496
113 HB3 LEU 14 HB1 LEU 14 -4.356 -4.500 1.837
114 HG LEU 14 HG LEU 14 -6.065 -2.740 2.057
115 HD11 LEU 14 HD11 LEU 14 -4.627 -0.939 2.867
116 HD12 LEU 14 HD12 LEU 14 -5.531 -0.438 1.437
117 HD13 LEU 14 HD13 LEU 14 -3.826 -0.866 1.299
118 HD21 LEU 14 HD21 LEU 14 -4.446 -2.530 -0.478
119 HD22 LEU 14 HD22 LEU 14 -6.139 -2.070 -0.285
120 HD23 LEU 14 HD23 LEU 14 -5.658 -3.759 -0.121
121 H VAL 15 HN VAL 15 -4.320 -5.744 4.355
122 HA VAL 15 HA VAL 15 -6.936 -5.287 5.357
123 HB VAL 15 HB VAL 15 -4.948 -7.418 6.255
124 HG11 VAL 15 HG11 VAL 15 -6.921 -8.687 6.973
125 HG12 VAL 15 HG12 VAL 15 -7.955 -7.332 6.519
126 HG13 VAL 15 HG13 VAL 15 -6.791 -7.152 7.834
127 HG21 VAL 15 HG21 VAL 15 -6.098 -8.899 4.686
128 HG22 VAL 15 HG22 VAL 15 -5.366 -7.526 3.855
129 HG23 VAL 15 HG23 VAL 15 -7.104 -7.553 4.153
130 H GLU 16 HN GLU 16 -3.765 -5.293 6.879
131 HA GLU 16 HA GLU 16 -4.497 -4.818 9.539
132 HB2 GLU 16 HB2 GLU 16 -1.901 -4.064 8.130
133 HB3 GLU 16 HB1 GLU 16 -2.195 -3.994 9.852
134 HG2 GLU 16 HG2 GLU 16 -2.518 -6.330 10.011
135 HG3 GLU 16 HG1 GLU 16 -2.486 -6.502 8.258
136 H SER 17 HN SER 17 -4.772 -2.695 6.937
137 HA SER 17 HA SER 17 -4.271 -0.296 8.448
138 HB2 SER 17 HB2 SER 17 -5.556 -0.592 5.734
139 HB3 SER 17 HB1 SER 17 -4.796 0.851 6.411
140 HG SER 17 HG SER 17 -3.247 -1.475 6.283
141 H ALA 18 HN ALA 18 -7.182 -1.502 6.710
142 HA ALA 18 HA ALA 18 -8.912 0.170 8.275
143 HB1 ALA 18 HB1 ALA 18 -10.721 -0.810 6.979
144 HB2 ALA 18 HB2 ALA 18 -9.602 -2.009 6.318
145 HB3 ALA 18 HB3 ALA 18 -9.394 -0.302 5.931
146 H GLY 19 HN GLY 19 -7.877 -3.163 8.419
147 HA2 GLY 19 HA2 GLY 19 -8.129 -4.616 10.188
148 HA3 GLY 19 HA1 GLY 19 -9.274 -3.498 10.929
149 H GLU 20 HN GLU 20 -11.246 -3.190 9.438
150 HA GLU 20 HA GLU 20 -12.352 -5.838 8.922
151 HB2 GLU 20 HB2 GLU 20 -13.692 -3.153 9.296
152 HB3 GLU 20 HB1 GLU 20 -14.542 -4.642 8.927
153 HG2 GLU 20 HG2 GLU 20 -12.872 -4.180 11.384
154 HG3 GLU 20 HG1 GLU 20 -14.625 -4.025 11.308
155 H THR 21 HN THR 21 -11.828 -6.384 6.907
156 HA THR 21 HA THR 21 -12.732 -4.605 4.768
157 HB THR 21 HB THR 21 -11.153 -5.970 3.271
158 HG1 THR 21 HG1 THR 21 -10.511 -7.099 5.763
159 HG21 THR 21 HG21 THR 21 -9.133 -4.714 3.918
160 HG22 THR 21 HG22 THR 21 -9.884 -4.318 5.463
161 HG23 THR 21 HG23 THR 21 -10.576 -3.701 3.963
162 H ASP 22 HN ASP 22 -14.706 -5.621 5.637
163 HA ASP 22 HA ASP 22 -15.113 -8.432 5.009
164 HB2 ASP 22 HB2 ASP 22 -15.891 -7.597 7.147
165 HB3 ASP 22 HB1 ASP 22 -16.920 -6.425 6.335
166 H GLY 23 HN GLY 23 -16.566 -5.302 4.167
167 HA2 GLY 23 HA2 GLY 23 -18.069 -6.580 2.013
168 HA3 GLY 23 HA1 GLY 23 -18.203 -4.899 2.534
169 H THR 24 HN THR 24 -15.106 -5.584 2.528
170 HA THR 24 HA THR 24 -14.591 -4.618 -0.202
171 HB THR 24 HB THR 24 -12.886 -4.293 2.279
172 HG1 THR 24 HG1 THR 24 -14.745 -2.508 1.086
173 HG21 THR 24 HG21 THR 24 -12.895 -2.854 -0.383
174 HG22 THR 24 HG22 THR 24 -11.708 -4.055 0.128
175 HG23 THR 24 HG23 THR 24 -11.815 -2.507 0.967
176 H ASP 25 HN ASP 25 -14.517 -6.917 -0.888
177 HA ASP 25 HA ASP 25 -12.758 -8.728 0.376
178 HB2 ASP 25 HB2 ASP 25 -14.571 -9.561 -1.047
179 HB3 ASP 25 HB1 ASP 25 -13.795 -8.847 -2.462
180 H LEU 26 HN LEU 26 -10.737 -8.819 0.379
181 HA LEU 26 HA LEU 26 -9.177 -7.471 -1.740
182 HB2 LEU 26 HB2 LEU 26 -9.277 -6.480 0.580
183 HB3 LEU 26 HB1 LEU 26 -8.452 -7.918 1.140
184 HG LEU 26 HG LEU 26 -6.587 -7.331 -0.426
185 HD11 LEU 26 HD11 LEU 26 -8.086 -4.722 -0.558
186 HD12 LEU 26 HD12 LEU 26 -7.890 -5.862 -1.885
187 HD13 LEU 26 HD13 LEU 26 -6.480 -5.039 -1.220
188 HD21 LEU 26 HD21 LEU 26 -7.316 -5.389 1.740
189 HD22 LEU 26 HD22 LEU 26 -5.683 -5.686 1.102
190 HD23 LEU 26 HD23 LEU 26 -6.567 -6.969 1.949
191 H SER 27 HN SER 27 -10.188 -10.283 -0.921
192 HA SER 27 HA SER 27 -7.933 -11.900 -0.228
193 HB2 SER 27 HB2 SER 27 -10.528 -12.890 -1.348
194 HB3 SER 27 HB1 SER 27 -9.466 -13.655 -0.164
195 HG SER 27 HG SER 27 -11.461 -11.876 0.148
196 H GLY 28 HN GLY 28 -8.055 -10.422 -2.976
197 HA2 GLY 28 HA2 GLY 28 -6.910 -12.594 -4.470
198 HA3 GLY 28 HA1 GLY 28 -8.424 -11.983 -5.125
199 H ASP 29 HN ASP 29 -8.062 -10.738 -6.730
200 HA ASP 29 HA ASP 29 -5.552 -9.249 -6.904
201 HB2 ASP 29 HB2 ASP 29 -6.175 -10.719 -8.778
202 HB3 ASP 29 HB1 ASP 29 -7.656 -9.798 -8.999
203 H PHE 30 HN PHE 30 -5.465 -7.057 -6.924
204 HA PHE 30 HA PHE 30 -7.953 -5.531 -6.986
205 HB2 PHE 30 HB2 PHE 30 -7.548 -4.514 -4.761
206 HB3 PHE 30 HB1 PHE 30 -7.915 -6.231 -4.693
207 HD1 PHE 30 HD2 PHE 30 -6.190 -7.841 -4.034
208 HD2 PHE 30 HD1 PHE 30 -5.370 -3.667 -4.116
209 HE1 PHE 30 HE2 PHE 30 -4.168 -8.215 -2.691
210 HE2 PHE 30 HE1 PHE 30 -3.347 -4.039 -2.771
211 HZ PHE 30 HZ PHE 30 -2.745 -6.312 -2.056
212 H LEU 31 HN LEU 31 -5.059 -5.598 -8.282
213 HA LEU 31 HA LEU 31 -3.841 -3.182 -7.359
214 HB2 LEU 31 HB2 LEU 31 -3.256 -4.791 -9.848
215 HB3 LEU 31 HB1 LEU 31 -2.318 -3.419 -9.315
216 HG LEU 31 HG LEU 31 -1.083 -5.301 -8.740
217 HD11 LEU 31 HD11 LEU 31 -0.972 -5.321 -6.305
218 HD12 LEU 31 HD12 LEU 31 -2.480 -4.406 -6.249
219 HD13 LEU 31 HD13 LEU 31 -1.044 -3.695 -6.989
220 HD21 LEU 31 HD21 LEU 31 -1.919 -7.208 -7.461
221 HD22 LEU 31 HD22 LEU 31 -2.776 -7.009 -8.990
222 HD23 LEU 31 HD23 LEU 31 -3.536 -6.507 -7.481
223 H ASP 32 HN ASP 32 -6.229 -3.865 -9.680
224 HA ASP 32 HA ASP 32 -5.873 -1.309 -11.067
225 HB2 ASP 32 HB2 ASP 32 -7.468 -2.098 -12.675
226 HB3 ASP 32 HB1 ASP 32 -6.328 -3.400 -12.364
227 H LEU 33 HN LEU 33 -7.377 -2.318 -8.341
228 HA LEU 33 HA LEU 33 -9.892 -0.995 -8.690
229 HB2 LEU 33 HB2 LEU 33 -8.555 -2.336 -6.369
230 HB3 LEU 33 HB1 LEU 33 -10.012 -1.387 -6.150
231 HG LEU 33 HG LEU 33 -9.829 -3.773 -8.000
232 HD11 LEU 33 HD11 LEU 33 -10.961 -3.551 -5.204
233 HD12 LEU 33 HD12 LEU 33 -9.508 -4.440 -5.655
234 HD13 LEU 33 HD13 LEU 33 -11.081 -4.957 -6.260
235 HD21 LEU 33 HD21 LEU 33 -12.277 -3.603 -7.940
236 HD22 LEU 33 HD22 LEU 33 -11.540 -2.122 -8.571
237 HD23 LEU 33 HD23 LEU 33 -12.130 -2.175 -6.911
238 H ARG 34 HN ARG 34 -10.358 1.012 -8.301
239 HA ARG 34 HA ARG 34 -8.393 2.878 -7.438
240 HB2 ARG 34 HB2 ARG 34 -11.382 3.080 -7.801
241 HB3 ARG 34 HB1 ARG 34 -10.434 4.410 -7.171
242 HG2 ARG 34 HG2 ARG 34 -10.143 3.151 -9.889
243 HG3 ARG 34 HG1 ARG 34 -10.925 4.694 -9.526
244 HD2 ARG 34 HD2 ARG 34 -8.660 5.306 -8.444
245 HD3 ARG 34 HD1 ARG 34 -8.041 3.945 -9.368
246 HE ARG 34 HE ARG 34 -9.503 6.091 -10.706
247 HH11 ARG 34 HH11 ARG 34 -6.690 4.026 -10.505
248 HH12 ARG 34 HH12 ARG 34 -5.695 4.971 -11.516
249 HH21 ARG 34 HH21 ARG 34 -8.266 7.332 -12.227
250 HH22 ARG 34 HH22 ARG 34 -6.662 6.855 -12.639
251 H PHE 35 HN PHE 35 -8.513 4.091 -5.448
252 HA PHE 35 HA PHE 35 -9.080 2.354 -3.275
253 HB2 PHE 35 HB2 PHE 35 -8.100 5.204 -3.327
254 HB3 PHE 35 HB1 PHE 35 -8.291 4.255 -1.851
255 HD1 PHE 35 HD2 PHE 35 -7.044 1.923 -1.810
256 HD2 PHE 35 HD1 PHE 35 -6.115 5.139 -4.461
257 HE1 PHE 35 HE2 PHE 35 -4.832 1.005 -2.161
258 HE2 PHE 35 HE1 PHE 35 -3.878 4.197 -4.803
259 HZ PHE 35 HZ PHE 35 -3.282 2.009 -3.619
260 H GLU 36 HN GLU 36 -10.778 4.798 -4.893
261 HA GLU 36 HA GLU 36 -12.646 5.498 -2.889
262 HB2 GLU 36 HB2 GLU 36 -12.161 6.527 -5.235
263 HB3 GLU 36 HB1 GLU 36 -13.312 5.333 -5.812
264 HG2 GLU 36 HG2 GLU 36 -14.455 7.383 -5.486
265 HG3 GLU 36 HG1 GLU 36 -14.967 6.267 -4.216
266 H ASP 37 HN ASP 37 -12.553 3.002 -5.406
267 HA ASP 37 HA ASP 37 -15.089 1.858 -5.095
268 HB2 ASP 37 HB2 ASP 37 -12.487 0.649 -6.056
269 HB3 ASP 37 HB1 ASP 37 -13.986 -0.263 -6.012
270 H ILE 38 HN ILE 38 -12.074 1.220 -3.450
271 HA ILE 38 HA ILE 38 -13.416 -0.824 -1.892
272 HB ILE 38 HB ILE 38 -11.144 -1.355 -0.951
273 HG12 ILE 38 HG12 ILE 38 -10.202 0.488 -3.158
274 HG13 ILE 38 HG11 ILE 38 -10.135 0.888 -1.453
275 HG21 ILE 38 HG21 ILE 38 -10.403 -2.482 -3.016
276 HG22 ILE 38 HG22 ILE 38 -11.534 -1.463 -3.926
277 HG23 ILE 38 HG23 ILE 38 -12.148 -2.622 -2.751
278 HD11 ILE 38 HD11 ILE 38 -8.668 -1.365 -2.822
279 HD12 ILE 38 HD12 ILE 38 -8.590 -0.995 -1.099
280 HD13 ILE 38 HD13 ILE 38 -7.966 0.160 -2.278
281 H GLY 39 HN GLY 39 -13.554 2.189 -1.653
282 HA2 GLY 39 HA2 GLY 39 -14.076 3.688 0.012
283 HA3 GLY 39 HA1 GLY 39 -14.368 2.284 1.022
284 H TYR 40 HN TYR 40 -11.356 3.312 -0.425
285 HA TYR 40 HA TYR 40 -10.235 3.368 2.259
286 HB2 TYR 40 HB2 TYR 40 -9.317 2.182 -0.191
287 HB3 TYR 40 HB1 TYR 40 -8.117 3.305 0.449
288 HD1 TYR 40 HD2 TYR 40 -9.991 0.211 1.105
289 HD2 TYR 40 HD1 TYR 40 -7.027 2.908 2.514
290 HE1 TYR 40 HE2 TYR 40 -9.306 -1.431 2.809
291 HE2 TYR 40 HE1 TYR 40 -6.335 1.283 4.209
292 HH TYR 40 HH TYR 40 -7.140 -1.891 4.174
293 H ASP 41 HN ASP 41 -9.607 5.107 3.073
294 HA ASP 41 HA ASP 41 -9.417 7.602 1.613
295 HB2 ASP 41 HB2 ASP 41 -8.685 6.919 4.477
296 HB3 ASP 41 HB1 ASP 41 -8.659 8.533 3.790
297 H SER 42 HN SER 42 -7.437 8.813 1.506
298 HA SER 42 HA SER 42 -5.143 7.187 1.011
299 HB2 SER 42 HB2 SER 42 -4.020 9.202 0.414
300 HB3 SER 42 HB1 SER 42 -5.693 9.459 -0.088
301 H LEU 43 HN LEU 43 -6.387 9.119 3.613
302 HA LEU 43 HA LEU 43 -4.266 9.124 5.418
303 HB2 LEU 43 HB2 LEU 43 -7.226 8.858 5.942
304 HB3 LEU 43 HB1 LEU 43 -6.040 9.132 7.198
305 HG LEU 43 HG LEU 43 -6.573 11.031 4.910
306 HD11 LEU 43 HD11 LEU 43 -8.484 10.878 6.432
307 HD12 LEU 43 HD12 LEU 43 -7.653 12.423 6.596
308 HD13 LEU 43 HD13 LEU 43 -7.413 11.160 7.803
309 HD21 LEU 43 HD21 LEU 43 -4.937 11.315 7.426
310 HD22 LEU 43 HD22 LEU 43 -5.223 12.579 6.229
311 HD23 LEU 43 HD23 LEU 43 -4.297 11.145 5.791
312 H ALA 44 HN ALA 44 -6.611 6.611 4.702
313 HA ALA 44 HA ALA 44 -5.692 4.821 6.717
314 HB1 ALA 44 HB1 ALA 44 -7.968 4.687 5.814
315 HB2 ALA 44 HB2 ALA 44 -7.105 3.162 5.600
316 HB3 ALA 44 HB3 ALA 44 -7.315 4.257 4.233
317 H LEU 45 HN LEU 45 -4.909 5.432 3.379
318 HA LEU 45 HA LEU 45 -3.268 3.169 2.921
319 HB2 LEU 45 HB2 LEU 45 -3.214 5.908 1.666
320 HB3 LEU 45 HB1 LEU 45 -2.319 4.526 1.070
321 HG LEU 45 HG LEU 45 -5.319 4.713 1.220
322 HD11 LEU 45 HD11 LEU 45 -4.366 6.219 -0.452
323 HD12 LEU 45 HD12 LEU 45 -5.194 4.862 -1.213
324 HD13 LEU 45 HD13 LEU 45 -3.431 4.886 -1.127
325 HD21 LEU 45 HD21 LEU 45 -3.492 2.645 0.024
326 HD22 LEU 45 HD22 LEU 45 -5.250 2.653 -0.095
327 HD23 LEU 45 HD23 LEU 45 -4.471 2.438 1.477
328 H MET 46 HN MET 46 -2.761 6.192 4.482
329 HA MET 46 HA MET 46 0.077 6.137 4.559
330 HB2 MET 46 HB2 MET 46 -1.879 7.491 6.441
331 HB3 MET 46 HB1 MET 46 -0.150 7.801 6.393
332 HG2 MET 46 HG2 MET 46 -0.313 8.717 4.177
333 HG3 MET 46 HG1 MET 46 -2.005 8.252 4.063
334 HE1 MET 46 HE1 MET 46 -1.133 11.138 3.327
335 HE2 MET 46 HE2 MET 46 -2.342 12.110 4.167
336 HE3 MET 46 HE3 MET 46 -2.817 10.617 3.357
337 H GLU 47 HN GLU 47 -2.439 4.602 6.352
338 HA GLU 47 HA GLU 47 -0.751 3.716 8.507
339 HB2 GLU 47 HB2 GLU 47 -3.260 4.109 8.688
340 HB3 GLU 47 HB1 GLU 47 -3.482 2.669 7.707
341 HG2 GLU 47 HG2 GLU 47 -3.781 2.116 10.022
342 HG3 GLU 47 HG1 GLU 47 -2.304 1.356 9.427
343 H THR 48 HN THR 48 -2.063 2.481 5.477
344 HA THR 48 HA THR 48 -1.213 -0.158 5.493
345 HB THR 48 HB THR 48 -1.172 1.744 3.136
346 HG1 THR 48 HG1 THR 48 -3.263 0.479 4.542
347 HG21 THR 48 HG21 THR 48 -1.807 -0.257 1.864
348 HG22 THR 48 HG22 THR 48 -1.769 -1.213 3.343
349 HG23 THR 48 HG23 THR 48 -0.274 -0.513 2.706
350 H ALA 49 HN ALA 49 0.390 2.735 4.198
351 HA ALA 49 HA ALA 49 2.832 1.619 3.498
352 HB1 ALA 49 HB1 ALA 49 2.114 3.860 2.802
353 HB2 ALA 49 HB2 ALA 49 3.706 3.908 3.557
354 HB3 ALA 49 HB3 ALA 49 2.286 4.433 4.461
355 H ALA 50 HN ALA 50 1.769 3.061 6.549
356 HA ALA 50 HA ALA 50 4.114 3.023 8.006
357 HB1 ALA 50 HB1 ALA 50 2.723 3.005 9.987
358 HB2 ALA 50 HB2 ALA 50 1.340 2.471 9.031
359 HB3 ALA 50 HB3 ALA 50 2.038 4.069 8.757
360 H ARG 51 HN ARG 51 1.755 0.423 7.576
361 HA ARG 51 HA ARG 51 2.838 -1.462 9.384
362 HB2 ARG 51 HB2 ARG 51 1.537 -2.127 6.727
363 HB3 ARG 51 HB1 ARG 51 1.699 -3.189 8.104
364 HG2 ARG 51 HG2 ARG 51 -0.081 -0.767 7.880
365 HG3 ARG 51 HG1 ARG 51 -0.583 -2.452 7.835
366 HD2 ARG 51 HD2 ARG 51 -1.046 -2.044 10.010
367 HD3 ARG 51 HD1 ARG 51 0.663 -2.423 10.205
368 HE ARG 51 HE ARG 51 0.026 0.356 9.728
369 HH11 ARG 51 HH11 ARG 51 0.724 -2.128 12.189
370 HH12 ARG 51 HH12 ARG 51 1.053 -0.976 13.413
371 HH21 ARG 51 HH21 ARG 51 0.283 1.871 11.466
372 HH22 ARG 51 HH22 ARG 51 0.739 1.345 13.014
373 H LEU 52 HN LEU 52 3.184 -1.195 5.932
374 HA LEU 52 HA LEU 52 5.241 -3.095 5.701
375 HB2 LEU 52 HB2 LEU 52 4.284 -1.024 3.755
376 HB3 LEU 52 HB1 LEU 52 5.532 -2.197 3.365
377 HG LEU 52 HG LEU 52 2.729 -2.912 4.234
378 HD11 LEU 52 HD11 LEU 52 2.720 -1.882 2.027
379 HD12 LEU 52 HD12 LEU 52 2.369 -3.610 1.940
380 HD13 LEU 52 HD13 LEU 52 3.965 -3.011 1.493
381 HD21 LEU 52 HD21 LEU 52 3.366 -5.164 3.511
382 HD22 LEU 52 HD22 LEU 52 4.343 -4.585 4.856
383 HD23 LEU 52 HD23 LEU 52 5.012 -4.594 3.228
384 H GLU 53 HN GLU 53 5.528 0.389 6.259
385 HA GLU 53 HA GLU 53 8.238 0.642 5.620
386 HB2 GLU 53 HB2 GLU 53 6.692 2.041 7.804
387 HB3 GLU 53 HB1 GLU 53 8.347 2.426 7.397
388 HG2 GLU 53 HG2 GLU 53 7.543 2.991 5.093
389 HG3 GLU 53 HG1 GLU 53 5.895 2.806 5.710
390 H SER 54 HN SER 54 6.787 -0.167 8.762
391 HA SER 54 HA SER 54 9.225 -0.607 10.108
392 HB2 SER 54 HB2 SER 54 6.510 -1.808 10.695
393 HB3 SER 54 HB1 SER 54 7.851 -1.646 11.826
394 HG SER 54 HG SER 54 7.322 0.794 10.819
395 H ARG 55 HN ARG 55 7.385 -2.536 7.947
396 HA ARG 55 HA ARG 55 8.371 -5.070 8.826
397 HB2 ARG 55 HB2 ARG 55 6.155 -4.733 7.791
398 HB3 ARG 55 HB1 ARG 55 6.950 -4.361 6.275
399 HG2 ARG 55 HG2 ARG 55 7.806 -6.594 6.112
400 HG3 ARG 55 HG1 ARG 55 7.194 -6.991 7.723
401 HD2 ARG 55 HD2 ARG 55 5.563 -6.270 5.292
402 HD3 ARG 55 HD1 ARG 55 5.661 -7.852 6.073
403 HE ARG 55 HE ARG 55 4.907 -6.073 8.024
404 HH11 ARG 55 HH11 ARG 55 3.452 -7.186 4.945
405 HH12 ARG 55 HH12 ARG 55 1.874 -6.977 5.532
406 HH21 ARG 55 HH21 ARG 55 2.799 -5.732 8.717
407 HH22 ARG 55 HH22 ARG 55 1.474 -6.182 7.766
408 H TYR 56 HN TYR 56 9.134 -2.902 6.109
409 HA TYR 56 HA TYR 56 11.317 -4.758 5.509
410 HB2 TYR 56 HB2 TYR 56 9.677 -3.125 3.622
411 HB3 TYR 56 HB1 TYR 56 11.263 -3.742 3.159
412 HD1 TYR 56 HD1 TYR 56 7.860 -4.708 4.162
413 HD2 TYR 56 HD2 TYR 56 11.616 -6.047 2.717
414 HE1 TYR 56 HE1 TYR 56 6.889 -6.909 3.689
415 HE2 TYR 56 HE2 TYR 56 10.658 -8.251 2.234
416 HH TYR 56 HH TYR 56 7.227 -8.813 2.494
417 H GLY 57 HN GLY 57 10.922 -1.728 6.782
418 HA2 GLY 57 HA2 GLY 57 12.616 -0.344 7.491
419 HA3 GLY 57 HA1 GLY 57 13.767 -1.334 6.607
420 H VAL 58 HN VAL 58 10.913 0.383 5.500
421 HA VAL 58 HA VAL 58 12.640 1.894 3.682
422 HB VAL 58 HB VAL 58 10.698 2.154 2.148
423 HG11 VAL 58 HG11 VAL 58 12.269 0.333 1.762
424 HG12 VAL 58 HG12 VAL 58 10.628 -0.146 1.313
425 HG13 VAL 58 HG13 VAL 58 11.325 -0.709 2.829
426 HG21 VAL 58 HG21 VAL 58 9.311 0.241 4.023
427 HG22 VAL 58 HG22 VAL 58 8.702 0.762 2.453
428 HG23 VAL 58 HG23 VAL 58 8.878 1.935 3.766
429 H SER 59 HN SER 59 11.390 4.051 2.940
430 HA SER 59 HA SER 59 10.168 5.223 5.309
431 HB2 SER 59 HB2 SER 59 12.563 5.859 5.312
432 HB3 SER 59 HB1 SER 59 12.412 6.448 3.660
433 HG SER 59 HG SER 59 11.933 7.770 5.939
434 H ILE 60 HN ILE 60 8.221 5.644 4.629
435 HA ILE 60 HA ILE 60 7.866 6.946 2.012
436 HB ILE 60 HB ILE 60 5.954 4.982 3.325
437 HG12 ILE 60 HG12 ILE 60 7.608 4.659 0.807
438 HG13 ILE 60 HG11 ILE 60 7.978 3.915 2.358
439 HG21 ILE 60 HG21 ILE 60 5.782 6.409 0.663
440 HG22 ILE 60 HG22 ILE 60 4.788 6.732 2.081
441 HG23 ILE 60 HG23 ILE 60 4.653 5.183 1.245
442 HD11 ILE 60 HD11 ILE 60 5.886 2.664 2.238
443 HD12 ILE 60 HD12 ILE 60 6.944 2.348 0.863
444 HD13 ILE 60 HD13 ILE 60 5.543 3.407 0.671
445 HA PRO 61 HA PRO 61 6.383 10.010 5.041
446 HB2 PRO 61 HB2 PRO 61 6.071 11.482 2.469
447 HB3 PRO 61 HB1 PRO 61 6.828 12.011 3.975
448 HG2 PRO 61 HG2 PRO 61 8.323 11.354 1.884
449 HG3 PRO 61 HG1 PRO 61 8.814 10.893 3.525
450 HD2 PRO 61 HD2 PRO 61 7.572 9.224 1.377
451 HD3 PRO 61 HD1 PRO 61 8.850 8.803 2.537
452 H ASP 62 HN ASP 62 4.347 10.713 5.489
453 HA ASP 62 HA ASP 62 2.220 9.075 4.777
454 HB2 ASP 62 HB2 ASP 62 2.139 11.834 5.999
455 HB3 ASP 62 HB1 ASP 62 0.720 10.820 5.814
456 H ASP 63 HN ASP 63 3.062 12.201 3.448
457 HA ASP 63 HA ASP 63 0.724 12.704 1.957
458 HB2 ASP 63 HB2 ASP 63 2.443 14.413 2.332
459 HB3 ASP 63 HB1 ASP 63 3.545 13.540 1.273
460 H VAL 64 HN VAL 64 3.392 10.607 1.300
461 HA VAL 64 HA VAL 64 3.026 10.450 -1.513
462 HB VAL 64 HB VAL 64 4.415 8.538 0.346
463 HG11 VAL 64 HG11 VAL 64 5.755 7.910 -1.662
464 HG12 VAL 64 HG12 VAL 64 4.764 8.995 -2.635
465 HG13 VAL 64 HG13 VAL 64 4.038 7.573 -1.887
466 HG21 VAL 64 HG21 VAL 64 5.330 10.754 0.611
467 HG22 VAL 64 HG22 VAL 64 5.528 10.918 -1.135
468 HG23 VAL 64 HG23 VAL 64 6.493 9.741 -0.243
469 H ALA 65 HN ALA 65 1.492 8.970 1.178
470 HA ALA 65 HA ALA 65 0.430 6.749 -0.316
471 HB1 ALA 65 HB1 ALA 65 -0.958 6.351 1.660
472 HB2 ALA 65 HB2 ALA 65 -0.446 7.899 2.329
473 HB3 ALA 65 HB3 ALA 65 0.727 6.597 2.119
474 H GLY 66 HN GLY 66 -0.461 9.989 0.490
475 HA2 GLY 66 HA2 GLY 66 -3.074 9.783 -0.793
476 HA3 GLY 66 HA1 GLY 66 -2.386 11.234 -0.051
477 H ARG 67 HN ARG 67 -1.605 8.970 -2.559
478 HA ARG 67 HA ARG 67 -1.177 10.926 -4.617
479 HB2 ARG 67 HB2 ARG 67 0.765 11.432 -3.298
480 HB3 ARG 67 HB1 ARG 67 1.140 9.729 -3.139
481 HG2 ARG 67 HG2 ARG 67 1.704 9.633 -5.506
482 HG3 ARG 67 HG1 ARG 67 1.338 11.362 -5.649
483 HD2 ARG 67 HD2 ARG 67 3.056 11.956 -4.164
484 HD3 ARG 67 HD1 ARG 67 3.274 10.294 -3.634
485 HE ARG 67 HE ARG 67 3.768 10.523 -6.390
486 HH11 ARG 67 HH11 ARG 67 5.193 11.726 -3.388
487 HH12 ARG 67 HH12 ARG 67 6.799 11.328 -3.789
488 HH21 ARG 67 HH21 ARG 67 5.989 9.995 -6.999
489 HH22 ARG 67 HH22 ARG 67 7.270 10.336 -5.942
490 H VAL 68 HN VAL 68 -0.679 7.661 -3.323
491 HA VAL 68 HA VAL 68 -0.015 6.512 -5.792
492 HB VAL 68 HB VAL 68 -0.488 4.319 -4.699
493 HG11 VAL 68 HG11 VAL 68 1.687 5.354 -4.524
494 HG12 VAL 68 HG12 VAL 68 1.290 4.502 -3.029
495 HG13 VAL 68 HG13 VAL 68 1.161 6.261 -3.104
496 HG21 VAL 68 HG21 VAL 68 -1.230 6.008 -2.300
497 HG22 VAL 68 HG22 VAL 68 -1.026 4.255 -2.301
498 HG23 VAL 68 HG23 VAL 68 -2.337 4.993 -3.225
499 H ASP 69 HN ASP 69 -1.161 6.444 -7.448
500 HA ASP 69 HA ASP 69 -3.910 6.933 -7.680
501 HB2 ASP 69 HB2 ASP 69 -2.232 7.248 -9.506
502 HB3 ASP 69 HB1 ASP 69 -2.110 5.508 -9.655
503 H THR 70 HN THR 70 -2.137 3.901 -7.554
504 HA THR 70 HA THR 70 -4.664 2.471 -7.221
505 HB THR 70 HB THR 70 -3.800 0.683 -8.712
506 HG1 THR 70 HG1 THR 70 -1.943 2.317 -9.973
507 HG21 THR 70 HG21 THR 70 -5.353 2.354 -9.627
508 HG22 THR 70 HG22 THR 70 -4.193 1.847 -10.864
509 HG23 THR 70 HG23 THR 70 -3.990 3.395 -10.031
510 HA PRO 71 HA PRO 71 -2.245 0.123 -4.214
511 HB2 PRO 71 HB2 PRO 71 -3.153 -2.369 -5.574
512 HB3 PRO 71 HB1 PRO 71 -3.303 -1.907 -3.873
513 HG2 PRO 71 HG2 PRO 71 -5.431 -1.851 -5.441
514 HG3 PRO 71 HG1 PRO 71 -5.149 -0.545 -4.271
515 HD2 PRO 71 HD2 PRO 71 -4.645 -0.584 -7.223
516 HD3 PRO 71 HD1 PRO 71 -5.371 0.698 -6.227
517 H ARG 72 HN ARG 72 -2.122 -0.628 -7.617
518 HA ARG 72 HA ARG 72 0.304 -2.095 -7.637
519 HB2 ARG 72 HB2 ARG 72 -1.246 -2.076 -9.568
520 HB3 ARG 72 HB1 ARG 72 -0.903 -0.372 -9.820
521 HG2 ARG 72 HG2 ARG 72 1.440 -0.909 -10.277
522 HG3 ARG 72 HG1 ARG 72 1.091 -2.617 -10.037
523 HD2 ARG 72 HD2 ARG 72 -0.077 -0.830 -12.166
524 HD3 ARG 72 HD1 ARG 72 1.156 -2.067 -12.404
525 HE ARG 72 HE ARG 72 -1.687 -2.442 -11.957
526 HH11 ARG 72 HH11 ARG 72 1.507 -4.001 -12.276
527 HH12 ARG 72 HH12 ARG 72 0.875 -5.527 -12.668
528 HH21 ARG 72 HH21 ARG 72 -2.533 -4.560 -12.558
529 HH22 ARG 72 HH22 ARG 72 -1.452 -5.829 -12.907
530 H GLU 73 HN GLU 73 -0.501 1.315 -7.998
531 HA GLU 73 HA GLU 73 2.037 2.399 -8.446
532 HB2 GLU 73 HB2 GLU 73 -0.210 3.563 -8.542
533 HB3 GLU 73 HB1 GLU 73 -0.176 3.624 -6.790
534 HG2 GLU 73 HG2 GLU 73 0.511 5.745 -7.608
535 HG3 GLU 73 HG1 GLU 73 1.930 4.934 -6.956
536 H LEU 74 HN LEU 74 0.291 1.730 -5.466
537 HA LEU 74 HA LEU 74 2.226 2.676 -3.640
538 HB2 LEU 74 HB2 LEU 74 -0.258 2.225 -3.212
539 HB3 LEU 74 HB1 LEU 74 0.127 0.531 -3.177
540 HG LEU 74 HG LEU 74 -0.250 1.552 -0.938
541 HD11 LEU 74 HD11 LEU 74 1.643 0.567 0.211
542 HD12 LEU 74 HD12 LEU 74 2.506 0.441 -1.322
543 HD13 LEU 74 HD13 LEU 74 1.022 -0.480 -1.065
544 HD21 LEU 74 HD21 LEU 74 2.318 3.022 -1.487
545 HD22 LEU 74 HD22 LEU 74 1.479 2.959 0.063
546 HD23 LEU 74 HD23 LEU 74 0.716 3.737 -1.324
547 H LEU 75 HN LEU 75 1.577 -0.546 -4.963
548 HA LEU 75 HA LEU 75 3.529 -2.009 -3.584
549 HB2 LEU 75 HB2 LEU 75 1.676 -2.985 -4.906
550 HB3 LEU 75 HB1 LEU 75 2.443 -2.425 -6.375
551 HG LEU 75 HG LEU 75 4.355 -3.938 -5.915
552 HD11 LEU 75 HD11 LEU 75 4.138 -4.069 -3.503
553 HD12 LEU 75 HD12 LEU 75 4.097 -5.676 -4.227
554 HD13 LEU 75 HD13 LEU 75 2.602 -4.919 -3.676
555 HD21 LEU 75 HD21 LEU 75 2.543 -4.636 -7.388
556 HD22 LEU 75 HD22 LEU 75 1.648 -5.264 -6.004
557 HD23 LEU 75 HD23 LEU 75 3.179 -6.005 -6.475
558 H ASP 76 HN ASP 76 3.599 -0.450 -6.742
559 HA ASP 76 HA ASP 76 6.204 -1.021 -7.569
560 HB2 ASP 76 HB2 ASP 76 4.454 -0.107 -9.034
561 HB3 ASP 76 HB1 ASP 76 4.496 1.411 -8.150
562 H LEU 77 HN LEU 77 4.929 1.738 -5.792
563 HA LEU 77 HA LEU 77 7.164 3.305 -5.426
564 HB2 LEU 77 HB2 LEU 77 4.964 3.999 -4.761
565 HB3 LEU 77 HB1 LEU 77 4.863 2.712 -3.581
566 HG LEU 77 HG LEU 77 6.734 3.824 -2.340
567 HD11 LEU 77 HD11 LEU 77 7.672 5.139 -4.137
568 HD12 LEU 77 HD12 LEU 77 7.182 6.174 -2.795
569 HD13 LEU 77 HD13 LEU 77 6.187 6.083 -4.250
570 HD21 LEU 77 HD21 LEU 77 4.420 4.016 -1.649
571 HD22 LEU 77 HD22 LEU 77 4.191 5.387 -2.734
572 HD23 LEU 77 HD23 LEU 77 5.283 5.525 -1.357
573 H ILE 78 HN ILE 78 5.965 0.747 -3.260
574 HA ILE 78 HA ILE 78 8.196 0.944 -1.520
575 HB ILE 78 HB ILE 78 6.341 -1.444 -1.764
576 HG12 ILE 78 HG12 ILE 78 6.113 1.056 -0.081
577 HG13 ILE 78 HG11 ILE 78 5.078 0.623 -1.432
578 HG21 ILE 78 HG21 ILE 78 6.985 -1.794 0.602
579 HG22 ILE 78 HG22 ILE 78 8.083 -0.418 0.495
580 HG23 ILE 78 HG23 ILE 78 8.386 -1.865 -0.469
581 HD11 ILE 78 HD11 ILE 78 3.996 0.189 0.694
582 HD12 ILE 78 HD12 ILE 78 5.315 -0.893 1.148
583 HD13 ILE 78 HD13 ILE 78 4.266 -1.303 -0.205
584 H ASN 79 HN ASN 79 7.470 -1.121 -4.271
585 HA ASN 79 HA ASN 79 9.719 -2.806 -3.947
586 HB2 ASN 79 HB2 ASN 79 8.026 -2.170 -6.353
587 HB3 ASN 79 HB1 ASN 79 9.489 -3.126 -6.524
588 HD21 ASN 79 HD21 ASN 79 7.363 -3.293 -3.713
589 HD22 ASN 79 HD22 ASN 79 6.806 -4.903 -4.021
590 H GLY 80 HN GLY 80 9.363 0.336 -5.371
591 HA2 GLY 80 HA2 GLY 80 11.956 0.462 -6.512
592 HA3 GLY 80 HA1 GLY 80 10.933 1.835 -6.098
593 H ALA 81 HN ALA 81 10.599 1.532 -3.439
594 HA ALA 81 HA ALA 81 12.948 2.583 -2.323
595 HB1 ALA 81 HB1 ALA 81 10.583 1.368 -0.892
596 HB2 ALA 81 HB2 ALA 81 10.702 3.038 -1.443
597 HB3 ALA 81 HB3 ALA 81 11.782 2.446 -0.182
598 H LEU 82 HN LEU 82 11.710 -0.666 -2.444
599 HA LEU 82 HA LEU 82 13.652 -1.776 -0.682
600 HB2 LEU 82 HB2 LEU 82 11.774 -3.019 -2.668
601 HB3 LEU 82 HB1 LEU 82 12.850 -3.960 -1.653
602 HG LEU 82 HG LEU 82 10.733 -2.089 -0.599
603 HD11 LEU 82 HD11 LEU 82 9.493 -4.118 -0.036
604 HD12 LEU 82 HD12 LEU 82 10.718 -5.093 -0.849
605 HD13 LEU 82 HD13 LEU 82 9.723 -3.973 -1.779
606 HD21 LEU 82 HD21 LEU 82 12.453 -4.166 0.740
607 HD22 LEU 82 HD22 LEU 82 11.187 -3.211 1.515
608 HD23 LEU 82 HD23 LEU 82 12.633 -2.419 0.886
609 H ALA 83 HN ALA 83 13.451 -1.204 -4.115
610 HA ALA 83 HA ALA 83 15.641 -2.854 -4.880
611 HB1 ALA 83 HB1 ALA 83 15.534 -1.669 -7.019
612 HB2 ALA 83 HB2 ALA 83 14.457 -0.467 -6.306
613 HB3 ALA 83 HB3 ALA 83 13.919 -2.136 -6.482
614 H GLU 84 HN GLU 84 15.293 0.432 -3.793
615 HA GLU 84 HA GLU 84 18.101 0.999 -4.245
616 HB2 GLU 84 HB2 GLU 84 17.573 3.237 -3.312
617 HB3 GLU 84 HB1 GLU 84 16.569 2.810 -4.689
618 HG2 GLU 84 HG2 GLU 84 14.740 2.251 -3.185
619 HG3 GLU 84 HG1 GLU 84 15.755 2.650 -1.801
620 H ALA 85 HN ALA 85 16.691 -0.863 -2.135
621 HA ALA 85 HA ALA 85 18.301 0.014 0.159
622 HB1 ALA 85 HB1 ALA 85 15.912 -0.300 0.642
623 HB2 ALA 85 HB2 ALA 85 16.895 -1.483 1.506
624 HB3 ALA 85 HB3 ALA 85 16.010 -1.961 0.058
625 H ALA 86 HN ALA 86 18.732 -1.690 -2.460
626 HA ALA 86 HA ALA 86 20.353 -3.721 -1.122
627 HB1 ALA 86 HB1 ALA 86 18.361 -4.820 -2.037
628 HB2 ALA 86 HB2 ALA 86 19.808 -5.300 -2.924
629 HB3 ALA 86 HB3 ALA 86 18.698 -4.122 -3.622
630 H28 SXV 87 H28A SXV 87 -3.958 12.657 1.951
631 H28A SXV 87 H28B SXV 87 -5.015 13.552 0.856
632 H30 SXV 87 H30C SXV 87 -3.664 13.423 4.226
633 H30A SXV 87 H30A SXV 87 -5.367 13.759 4.491
634 H30B SXV 87 H30B SXV 87 -4.152 15.028 4.741
635 H31 SXV 87 H31C SXV 87 -3.076 16.121 2.791
636 H31A SXV 87 H31A SXV 87 -3.322 15.465 1.170
637 H31B SXV 87 H31B SXV 87 -2.442 14.526 2.378
638 H32 SXV 87 H32A SXV 87 -6.706 15.103 2.747
639 HO33 SXV 87 H33A SXV 87 -5.774 16.841 1.053
640 HN36 SXV 87 H36A SXV 87 -5.950 16.066 4.886
641 H37 SXV 87 H37B SXV 87 -6.490 18.723 5.120
642 H37A SXV 87 H37A SXV 87 -4.733 18.638 5.050
643 H38 SXV 87 H38B SXV 87 -4.725 17.141 6.970
644 H38A SXV 87 H38A SXV 87 -6.495 17.090 6.938
645 HN41 SXV 87 H41A SXV 87 -5.941 17.576 9.183
646 H42 SXV 87 H42B SXV 87 -6.461 20.367 9.746
647 H42A SXV 87 H42A SXV 87 -5.028 19.587 10.465
648 H43 SXV 87 H43B SXV 87 -6.773 19.287 12.060
649 H43A SXV 87 H43A SXV 87 -7.875 18.756 10.766
650 H1 SXV 87 H1B SXV 87 -7.536 17.170 13.368
651 H1A SXV 87 H1A SXV 87 -8.550 16.517 12.069
652 H2 SXV 87 H2A SXV 87 -7.416 14.392 12.145
653 H2A SXV 87 H2B SXV 87 -8.171 14.812 13.673
654 H4 SXV 87 H4C SXV 87 -5.582 15.200 15.764
655 H4A SXV 87 H4A SXV 87 -6.499 16.494 14.987
656 H4B SXV 87 H4B SXV 87 -4.779 16.291 14.629
Start of MODEL 6
1 H1 MET 1 HT1 MET 1 19.555 -9.314 -5.653
2 H2 MET 1 HT2 MET 1 20.100 -7.741 -5.457
3 H3 MET 1 HT3 MET 1 20.016 -8.408 -7.015
4 HA MET 1 HA MET 1 18.232 -6.841 -6.541
5 HB2 MET 1 HB2 MET 1 16.386 -8.224 -7.317
6 HB3 MET 1 HB1 MET 1 17.849 -8.781 -8.102
7 HG2 MET 1 HG2 MET 1 17.969 -10.648 -6.504
8 HG3 MET 1 HG1 MET 1 16.477 -10.087 -5.758
9 HE1 MET 1 HE1 MET 1 17.438 -10.175 -9.591
10 HE2 MET 1 HE2 MET 1 16.775 -11.738 -10.067
11 HE3 MET 1 HE3 MET 1 18.136 -11.662 -8.950
12 H ALA 2 HN ALA 2 15.802 -7.217 -5.475
13 HA ALA 2 HA ALA 2 16.310 -7.890 -2.663
14 HB1 ALA 2 HB1 ALA 2 16.358 -5.452 -2.931
15 HB2 ALA 2 HB2 ALA 2 14.940 -5.960 -2.013
16 HB3 ALA 2 HB3 ALA 2 14.776 -5.504 -3.710
17 H THR 3 HN THR 3 14.377 -8.517 -1.509
18 HA THR 3 HA THR 3 12.524 -9.994 -3.136
19 HB THR 3 HB THR 3 12.433 -9.339 -0.241
20 HG1 THR 3 HG1 THR 3 13.894 -11.252 -1.714
21 HG21 THR 3 HG21 THR 3 11.196 -11.603 -1.812
22 HG22 THR 3 HG22 THR 3 10.340 -10.238 -1.096
23 HG23 THR 3 HG23 THR 3 11.113 -11.437 -0.058
24 H LEU 4 HN LEU 4 11.099 -8.776 -4.239
25 HA LEU 4 HA LEU 4 10.140 -6.293 -3.139
26 HB2 LEU 4 HB2 LEU 4 9.405 -7.696 -5.706
27 HB3 LEU 4 HB1 LEU 4 9.019 -6.041 -5.278
28 HG LEU 4 HG LEU 4 11.760 -7.150 -5.854
29 HD11 LEU 4 HD11 LEU 4 10.412 -6.866 -7.834
30 HD12 LEU 4 HD12 LEU 4 11.687 -5.647 -7.777
31 HD13 LEU 4 HD13 LEU 4 10.028 -5.209 -7.361
32 HD21 LEU 4 HD21 LEU 4 10.942 -4.337 -5.115
33 HD22 LEU 4 HD22 LEU 4 12.553 -4.839 -5.629
34 HD23 LEU 4 HD23 LEU 4 11.884 -5.442 -4.112
35 H LEU 5 HN LEU 5 8.193 -6.036 -2.259
36 HA LEU 5 HA LEU 5 6.817 -8.352 -1.512
37 HB2 LEU 5 HB2 LEU 5 5.134 -6.808 -0.477
38 HB3 LEU 5 HB1 LEU 5 6.771 -6.648 0.089
39 HG LEU 5 HG LEU 5 6.921 -4.583 -1.421
40 HD11 LEU 5 HD11 LEU 5 4.959 -5.008 -2.798
41 HD12 LEU 5 HD12 LEU 5 4.824 -3.476 -1.935
42 HD13 LEU 5 HD13 LEU 5 3.930 -4.888 -1.370
43 HD21 LEU 5 HD21 LEU 5 5.032 -4.638 0.905
44 HD22 LEU 5 HD22 LEU 5 5.815 -3.201 0.241
45 HD23 LEU 5 HD23 LEU 5 6.790 -4.477 0.974
46 H THR 6 HN THR 6 4.988 -9.214 -2.089
47 HA THR 6 HA THR 6 4.246 -8.669 -4.828
48 HB THR 6 HB THR 6 2.992 -10.810 -4.675
49 HG1 THR 6 HG1 THR 6 4.080 -10.841 -2.033
50 HG21 THR 6 HG21 THR 6 5.309 -10.795 -5.463
51 HG22 THR 6 HG22 THR 6 4.973 -12.268 -4.552
52 HG23 THR 6 HG23 THR 6 5.881 -10.954 -3.804
53 H THR 7 HN THR 7 1.716 -9.549 -5.012
54 HA THR 7 HA THR 7 0.234 -7.349 -4.176
55 HB THR 7 HB THR 7 -0.753 -10.046 -5.154
56 HG1 THR 7 HG1 THR 7 -0.553 -8.861 -7.252
57 HG21 THR 7 HG21 THR 7 -1.819 -7.243 -5.489
58 HG22 THR 7 HG22 THR 7 -2.479 -8.446 -4.374
59 HG23 THR 7 HG23 THR 7 -2.567 -8.711 -6.119
60 H ASP 8 HN ASP 8 0.717 -10.604 -2.920
61 HA ASP 8 HA ASP 8 -1.340 -10.514 -0.943
62 HB2 ASP 8 HB2 ASP 8 -0.508 -12.668 -1.602
63 HB3 ASP 8 HB1 ASP 8 1.128 -12.237 -1.117
64 H ASP 9 HN ASP 9 2.106 -9.817 -0.872
65 HA ASP 9 HA ASP 9 2.335 -9.419 1.916
66 HB2 ASP 9 HB2 ASP 9 3.946 -8.046 -0.258
67 HB3 ASP 9 HB1 ASP 9 4.372 -8.111 1.441
68 H LEU 10 HN LEU 10 1.691 -7.175 -0.722
69 HA LEU 10 HA LEU 10 1.375 -4.850 0.846
70 HB2 LEU 10 HB2 LEU 10 1.744 -4.790 -1.573
71 HB3 LEU 10 HB1 LEU 10 0.206 -5.579 -1.846
72 HG LEU 10 HG LEU 10 -0.944 -3.582 -0.915
73 HD11 LEU 10 HD11 LEU 10 0.828 -2.745 0.511
74 HD12 LEU 10 HD12 LEU 10 0.305 -1.508 -0.633
75 HD13 LEU 10 HD13 LEU 10 1.814 -2.377 -0.905
76 HD21 LEU 10 HD21 LEU 10 -0.654 -3.829 -3.320
77 HD22 LEU 10 HD22 LEU 10 0.923 -3.046 -3.222
78 HD23 LEU 10 HD23 LEU 10 -0.541 -2.134 -2.848
79 H ARG 11 HN ARG 11 -0.905 -7.250 -0.380
80 HA ARG 11 HA ARG 11 -3.331 -6.168 0.407
81 HB2 ARG 11 HB2 ARG 11 -2.892 -8.205 -1.025
82 HB3 ARG 11 HB1 ARG 11 -2.620 -9.097 0.458
83 HG2 ARG 11 HG2 ARG 11 -4.906 -8.636 1.154
84 HG3 ARG 11 HG1 ARG 11 -5.171 -7.725 -0.335
85 HD2 ARG 11 HD2 ARG 11 -6.058 -9.880 -0.710
86 HD3 ARG 11 HD1 ARG 11 -4.530 -9.808 -1.585
87 HE ARG 11 HE ARG 11 -4.323 -10.857 1.065
88 HH11 ARG 11 HH11 ARG 11 -4.600 -11.679 -2.374
89 HH12 ARG 11 HH12 ARG 11 -4.526 -13.365 -2.122
90 HH21 ARG 11 HH21 ARG 11 -4.119 -13.185 1.379
91 HH22 ARG 11 HH22 ARG 11 -4.270 -14.255 0.068
92 H ARG 12 HN ARG 12 -1.185 -8.364 2.163
93 HA ARG 12 HA ARG 12 -2.659 -8.746 4.486
94 HB2 ARG 12 HB2 ARG 12 0.332 -8.610 4.137
95 HB3 ARG 12 HB1 ARG 12 -0.454 -9.118 5.620
96 HG2 ARG 12 HG2 ARG 12 -1.475 -10.994 4.428
97 HG3 ARG 12 HG1 ARG 12 -0.667 -10.477 2.943
98 HD2 ARG 12 HD2 ARG 12 0.545 -12.292 4.088
99 HD3 ARG 12 HD1 ARG 12 1.502 -10.816 3.965
100 HE ARG 12 HE ARG 12 0.032 -10.991 6.400
101 HH11 ARG 12 HH11 ARG 12 3.038 -12.029 4.851
102 HH12 ARG 12 HH12 ARG 12 3.899 -12.284 6.294
103 HH21 ARG 12 HH21 ARG 12 1.225 -11.235 8.406
104 HH22 ARG 12 HH22 ARG 12 2.837 -11.783 8.396
105 H ALA 13 HN ALA 13 -0.214 -6.294 3.829
106 HA ALA 13 HA ALA 13 -0.394 -5.045 6.361
107 HB1 ALA 13 HB1 ALA 13 0.928 -3.288 5.390
108 HB2 ALA 13 HB2 ALA 13 0.622 -3.922 3.773
109 HB3 ALA 13 HB3 ALA 13 1.558 -4.868 4.932
110 H LEU 14 HN LEU 14 -2.012 -4.521 3.309
111 HA LEU 14 HA LEU 14 -3.195 -2.035 3.873
112 HB2 LEU 14 HB2 LEU 14 -3.079 -3.310 1.648
113 HB3 LEU 14 HB1 LEU 14 -4.434 -4.251 2.228
114 HG LEU 14 HG LEU 14 -5.785 -2.163 2.346
115 HD11 LEU 14 HD11 LEU 14 -3.380 -0.941 1.000
116 HD12 LEU 14 HD12 LEU 14 -3.951 -0.579 2.629
117 HD13 LEU 14 HD13 LEU 14 -4.944 -0.159 1.230
118 HD21 LEU 14 HD21 LEU 14 -4.527 -2.750 -0.328
119 HD22 LEU 14 HD22 LEU 14 -6.059 -1.918 -0.067
120 HD23 LEU 14 HD23 LEU 14 -5.886 -3.613 0.388
121 H VAL 15 HN VAL 15 -4.213 -5.350 4.470
122 HA VAL 15 HA VAL 15 -6.641 -4.776 5.803
123 HB VAL 15 HB VAL 15 -4.795 -7.171 6.162
124 HG11 VAL 15 HG11 VAL 15 -6.370 -6.962 8.016
125 HG12 VAL 15 HG12 VAL 15 -6.780 -8.345 7.002
126 HG13 VAL 15 HG13 VAL 15 -7.714 -6.853 6.877
127 HG21 VAL 15 HG21 VAL 15 -6.302 -8.316 4.598
128 HG22 VAL 15 HG22 VAL 15 -5.527 -6.923 3.849
129 HG23 VAL 15 HG23 VAL 15 -7.206 -6.818 4.377
130 H GLU 16 HN GLU 16 -3.364 -5.499 7.035
131 HA GLU 16 HA GLU 16 -3.803 -5.246 9.782
132 HB2 GLU 16 HB2 GLU 16 -1.243 -4.446 8.324
133 HB3 GLU 16 HB1 GLU 16 -1.410 -4.805 10.031
134 HG2 GLU 16 HG2 GLU 16 -2.040 -7.111 9.495
135 HG3 GLU 16 HG1 GLU 16 -1.830 -6.755 7.782
136 H SER 17 HN SER 17 -3.507 -2.780 7.418
137 HA SER 17 HA SER 17 -2.937 -0.578 9.073
138 HB2 SER 17 HB2 SER 17 -2.532 -0.675 6.656
139 HB3 SER 17 HB1 SER 17 -4.269 -0.717 6.372
140 HG SER 17 HG SER 17 -4.232 1.398 6.506
141 H ALA 18 HN ALA 18 -5.994 -1.801 7.675
142 HA ALA 18 HA ALA 18 -7.457 0.270 9.140
143 HB1 ALA 18 HB1 ALA 18 -9.361 -0.315 7.757
144 HB2 ALA 18 HB2 ALA 18 -8.466 -1.667 7.063
145 HB3 ALA 18 HB3 ALA 18 -7.941 -0.011 6.754
146 H GLY 19 HN GLY 19 -7.058 -3.185 9.029
147 HA2 GLY 19 HA2 GLY 19 -7.455 -4.570 10.873
148 HA3 GLY 19 HA1 GLY 19 -8.611 -3.390 11.488
149 H GLU 20 HN GLU 20 -10.492 -3.016 9.985
150 HA GLU 20 HA GLU 20 -11.517 -5.645 9.351
151 HB2 GLU 20 HB2 GLU 20 -12.917 -3.028 9.828
152 HB3 GLU 20 HB1 GLU 20 -13.746 -4.379 9.086
153 HG2 GLU 20 HG2 GLU 20 -14.253 -4.283 11.441
154 HG3 GLU 20 HG1 GLU 20 -13.327 -5.733 11.087
155 H THR 21 HN THR 21 -10.352 -5.933 7.464
156 HA THR 21 HA THR 21 -11.623 -4.639 5.144
157 HB THR 21 HB THR 21 -9.001 -6.199 5.103
158 HG1 THR 21 HG1 THR 21 -8.608 -3.537 4.880
159 HG21 THR 21 HG21 THR 21 -8.612 -4.927 3.027
160 HG22 THR 21 HG22 THR 21 -10.146 -4.088 3.255
161 HG23 THR 21 HG23 THR 21 -10.129 -5.823 2.940
162 H ASP 22 HN ASP 22 -13.254 -6.235 6.078
163 HA ASP 22 HA ASP 22 -12.619 -9.047 5.457
164 HB2 ASP 22 HB2 ASP 22 -13.035 -8.587 7.816
165 HB3 ASP 22 HB1 ASP 22 -14.612 -7.921 7.418
166 H GLY 23 HN GLY 23 -14.911 -6.477 4.884
167 HA2 GLY 23 HA2 GLY 23 -16.573 -8.317 3.305
168 HA3 GLY 23 HA1 GLY 23 -17.123 -6.782 3.994
169 H THR 24 HN THR 24 -14.191 -7.589 2.390
170 HA THR 24 HA THR 24 -14.774 -5.995 0.070
171 HB THR 24 HB THR 24 -12.573 -5.298 2.042
172 HG1 THR 24 HG1 THR 24 -15.074 -4.494 1.821
173 HG21 THR 24 HG21 THR 24 -11.794 -5.067 -0.287
174 HG22 THR 24 HG22 THR 24 -11.996 -3.483 0.465
175 HG23 THR 24 HG23 THR 24 -13.210 -4.084 -0.663
176 H ASP 25 HN ASP 25 -14.450 -7.792 -1.053
177 HA ASP 25 HA ASP 25 -12.393 -9.695 -0.878
178 HB2 ASP 25 HB2 ASP 25 -13.757 -8.708 -3.395
179 HB3 ASP 25 HB1 ASP 25 -12.643 -10.062 -3.357
180 H LEU 26 HN LEU 26 -10.464 -9.003 -0.502
181 HA LEU 26 HA LEU 26 -9.237 -7.012 -2.262
182 HB2 LEU 26 HB2 LEU 26 -9.345 -6.768 0.277
183 HB3 LEU 26 HB1 LEU 26 -8.223 -8.106 0.356
184 HG LEU 26 HG LEU 26 -6.579 -6.761 -0.913
185 HD11 LEU 26 HD11 LEU 26 -8.159 -5.323 -2.088
186 HD12 LEU 26 HD12 LEU 26 -6.981 -4.370 -1.182
187 HD13 LEU 26 HD13 LEU 26 -8.618 -4.571 -0.559
188 HD21 LEU 26 HD21 LEU 26 -7.651 -5.473 1.597
189 HD22 LEU 26 HD22 LEU 26 -6.035 -5.247 0.929
190 HD23 LEU 26 HD23 LEU 26 -6.528 -6.831 1.527
191 H SER 27 HN SER 27 -9.353 -10.292 -1.374
192 HA SER 27 HA SER 27 -6.759 -11.084 -2.192
193 HB2 SER 27 HB2 SER 27 -9.283 -12.725 -1.909
194 HB3 SER 27 HB1 SER 27 -7.632 -13.349 -1.972
195 HG SER 27 HG SER 27 -8.851 -11.755 0.016
196 H GLY 28 HN GLY 28 -6.107 -10.819 -4.208
197 HA2 GLY 28 HA2 GLY 28 -6.548 -12.094 -6.385
198 HA3 GLY 28 HA1 GLY 28 -8.004 -11.098 -6.394
199 H ASP 29 HN ASP 29 -7.618 -9.712 -7.981
200 HA ASP 29 HA ASP 29 -5.073 -8.285 -7.899
201 HB2 ASP 29 HB2 ASP 29 -6.784 -9.044 -10.224
202 HB3 ASP 29 HB1 ASP 29 -5.795 -7.593 -10.332
203 H PHE 30 HN PHE 30 -5.789 -6.986 -6.317
204 HA PHE 30 HA PHE 30 -7.899 -5.092 -6.958
205 HB2 PHE 30 HB2 PHE 30 -7.616 -4.269 -4.678
206 HB3 PHE 30 HB1 PHE 30 -7.766 -6.017 -4.662
207 HD1 PHE 30 HD2 PHE 30 -5.664 -7.404 -4.325
208 HD2 PHE 30 HD1 PHE 30 -5.749 -3.192 -3.752
209 HE1 PHE 30 HE2 PHE 30 -3.606 -7.543 -2.996
210 HE2 PHE 30 HE1 PHE 30 -3.687 -3.329 -2.418
211 HZ PHE 30 HZ PHE 30 -2.614 -5.507 -2.041
212 H LEU 31 HN LEU 31 -4.765 -5.445 -7.672
213 HA LEU 31 HA LEU 31 -3.576 -2.961 -7.058
214 HB2 LEU 31 HB2 LEU 31 -2.917 -4.900 -9.252
215 HB3 LEU 31 HB1 LEU 31 -1.899 -3.589 -8.712
216 HG LEU 31 HG LEU 31 -2.651 -6.030 -7.109
217 HD11 LEU 31 HD11 LEU 31 -0.293 -6.601 -7.383
218 HD12 LEU 31 HD12 LEU 31 -0.073 -5.182 -8.408
219 HD13 LEU 31 HD13 LEU 31 -1.127 -6.494 -8.933
220 HD21 LEU 31 HD21 LEU 31 -0.783 -3.750 -6.439
221 HD22 LEU 31 HD22 LEU 31 -1.013 -5.215 -5.484
222 HD23 LEU 31 HD23 LEU 31 -2.339 -4.065 -5.673
223 H ASP 32 HN ASP 32 -5.782 -3.886 -9.467
224 HA ASP 32 HA ASP 32 -5.057 -1.727 -11.309
225 HB2 ASP 32 HB2 ASP 32 -6.731 -4.209 -11.619
226 HB3 ASP 32 HB1 ASP 32 -6.673 -2.938 -12.832
227 H LEU 33 HN LEU 33 -6.744 -1.513 -8.715
228 HA LEU 33 HA LEU 33 -8.918 -0.088 -10.036
229 HB2 LEU 33 HB2 LEU 33 -10.424 -0.677 -8.110
230 HB3 LEU 33 HB1 LEU 33 -10.042 -1.986 -9.195
231 HG LEU 33 HG LEU 33 -8.366 -2.777 -7.451
232 HD11 LEU 33 HD11 LEU 33 -9.828 -0.839 -5.684
233 HD12 LEU 33 HD12 LEU 33 -8.129 -0.755 -6.148
234 HD13 LEU 33 HD13 LEU 33 -8.707 -2.088 -5.145
235 HD21 LEU 33 HD21 LEU 33 -10.492 -3.878 -7.785
236 HD22 LEU 33 HD22 LEU 33 -11.281 -2.723 -6.714
237 HD23 LEU 33 HD23 LEU 33 -10.079 -3.842 -6.070
238 H ARG 34 HN ARG 34 -9.812 1.701 -8.857
239 HA ARG 34 HA ARG 34 -7.883 3.239 -7.414
240 HB2 ARG 34 HB2 ARG 34 -10.854 3.525 -7.892
241 HB3 ARG 34 HB1 ARG 34 -9.950 4.667 -6.914
242 HG2 ARG 34 HG2 ARG 34 -9.178 4.062 -9.747
243 HG3 ARG 34 HG1 ARG 34 -10.412 5.260 -9.346
244 HD2 ARG 34 HD2 ARG 34 -7.584 5.276 -8.299
245 HD3 ARG 34 HD1 ARG 34 -8.162 6.245 -9.652
246 HE ARG 34 HE ARG 34 -9.796 6.667 -7.399
247 HH11 ARG 34 HH11 ARG 34 -6.632 7.626 -8.710
248 HH12 ARG 34 HH12 ARG 34 -6.452 8.980 -7.712
249 HH21 ARG 34 HH21 ARG 34 -9.558 8.585 -6.042
250 HH22 ARG 34 HH22 ARG 34 -8.192 9.593 -6.209
251 H PHE 35 HN PHE 35 -7.919 3.675 -5.171
252 HA PHE 35 HA PHE 35 -8.642 1.507 -3.519
253 HB2 PHE 35 HB2 PHE 35 -7.863 4.323 -2.780
254 HB3 PHE 35 HB1 PHE 35 -8.038 3.002 -1.624
255 HD1 PHE 35 HD2 PHE 35 -6.561 0.984 -1.877
256 HD2 PHE 35 HD1 PHE 35 -5.910 4.612 -3.994
257 HE1 PHE 35 HE2 PHE 35 -4.251 0.299 -2.332
258 HE2 PHE 35 HE1 PHE 35 -3.595 3.932 -4.451
259 HZ PHE 35 HZ PHE 35 -2.744 1.788 -3.533
260 H GLU 36 HN GLU 36 -10.314 4.289 -4.491
261 HA GLU 36 HA GLU 36 -12.405 4.472 -2.670
262 HB2 GLU 36 HB2 GLU 36 -11.850 5.965 -4.610
263 HB3 GLU 36 HB1 GLU 36 -12.574 4.762 -5.660
264 HG2 GLU 36 HG2 GLU 36 -14.721 5.102 -4.566
265 HG3 GLU 36 HG1 GLU 36 -13.985 6.299 -3.494
266 H ASP 37 HN ASP 37 -11.811 2.196 -5.294
267 HA ASP 37 HA ASP 37 -14.358 0.956 -5.417
268 HB2 ASP 37 HB2 ASP 37 -11.612 0.170 -6.331
269 HB3 ASP 37 HB1 ASP 37 -12.906 -1.014 -6.350
270 H ILE 38 HN ILE 38 -11.741 0.664 -3.214
271 HA ILE 38 HA ILE 38 -13.058 -1.680 -2.060
272 HB ILE 38 HB ILE 38 -10.899 -2.231 -0.919
273 HG12 ILE 38 HG12 ILE 38 -9.760 -0.149 -2.814
274 HG13 ILE 38 HG11 ILE 38 -9.851 0.002 -1.066
275 HG21 ILE 38 HG21 ILE 38 -9.862 -3.212 -2.923
276 HG22 ILE 38 HG22 ILE 38 -10.902 -2.177 -3.917
277 HG23 ILE 38 HG23 ILE 38 -11.620 -3.414 -2.886
278 HD11 ILE 38 HD11 ILE 38 -8.217 -2.024 -2.584
279 HD12 ILE 38 HD12 ILE 38 -8.296 -1.870 -0.830
280 HD13 ILE 38 HD13 ILE 38 -7.607 -0.567 -1.796
281 H GLY 39 HN GLY 39 -13.383 1.246 -1.737
282 HA2 GLY 39 HA2 GLY 39 -14.206 2.610 -0.061
283 HA3 GLY 39 HA1 GLY 39 -14.269 1.177 0.946
284 H TYR 40 HN TYR 40 -11.298 2.416 -0.435
285 HA TYR 40 HA TYR 40 -10.382 2.994 2.285
286 HB2 TYR 40 HB2 TYR 40 -9.000 2.056 -0.175
287 HB3 TYR 40 HB1 TYR 40 -8.094 3.068 0.940
288 HD1 TYR 40 HD2 TYR 40 -10.336 0.059 1.083
289 HD2 TYR 40 HD1 TYR 40 -6.838 2.006 2.489
290 HE1 TYR 40 HE2 TYR 40 -9.805 -1.910 2.453
291 HE2 TYR 40 HE1 TYR 40 -6.277 0.094 3.854
292 HH TYR 40 HH TYR 40 -7.168 -1.894 4.761
293 H ASP 41 HN ASP 41 -8.928 4.788 2.564
294 HA ASP 41 HA ASP 41 -9.137 6.894 0.596
295 HB2 ASP 41 HB2 ASP 41 -9.714 8.595 2.269
296 HB3 ASP 41 HB1 ASP 41 -10.966 7.370 2.190
297 H SER 42 HN SER 42 -7.819 8.866 2.071
298 HA SER 42 HA SER 42 -5.213 8.192 1.290
299 HB2 SER 42 HB2 SER 42 -4.741 10.444 2.264
300 HB3 SER 42 HB1 SER 42 -6.094 10.422 1.115
301 H LEU 43 HN LEU 43 -6.642 8.841 4.419
302 HA LEU 43 HA LEU 43 -4.316 8.523 5.962
303 HB2 LEU 43 HB2 LEU 43 -7.218 8.336 6.703
304 HB3 LEU 43 HB1 LEU 43 -5.906 8.421 7.851
305 HG LEU 43 HG LEU 43 -6.641 10.571 5.859
306 HD11 LEU 43 HD11 LEU 43 -7.357 11.839 7.823
307 HD12 LEU 43 HD12 LEU 43 -7.025 10.439 8.843
308 HD13 LEU 43 HD13 LEU 43 -8.295 10.359 7.622
309 HD21 LEU 43 HD21 LEU 43 -4.248 10.554 6.339
310 HD22 LEU 43 HD22 LEU 43 -4.583 10.567 8.070
311 HD23 LEU 43 HD23 LEU 43 -5.023 11.956 7.074
312 H ALA 44 HN ALA 44 -6.786 6.308 4.941
313 HA ALA 44 HA ALA 44 -6.001 4.134 6.599
314 HB1 ALA 44 HB1 ALA 44 -7.497 4.080 3.972
315 HB2 ALA 44 HB2 ALA 44 -8.229 4.254 5.567
316 HB3 ALA 44 HB3 ALA 44 -7.399 2.759 5.137
317 H LEU 45 HN LEU 45 -5.021 5.311 3.490
318 HA LEU 45 HA LEU 45 -3.429 3.060 2.756
319 HB2 LEU 45 HB2 LEU 45 -3.481 5.898 1.758
320 HB3 LEU 45 HB1 LEU 45 -2.535 4.616 1.029
321 HG LEU 45 HG LEU 45 -5.532 4.580 1.268
322 HD11 LEU 45 HD11 LEU 45 -5.513 5.058 -1.130
323 HD12 LEU 45 HD12 LEU 45 -3.757 5.225 -1.088
324 HD13 LEU 45 HD13 LEU 45 -4.775 6.374 -0.216
325 HD21 LEU 45 HD21 LEU 45 -4.465 2.397 1.196
326 HD22 LEU 45 HD22 LEU 45 -3.576 2.902 -0.247
327 HD23 LEU 45 HD23 LEU 45 -5.333 2.744 -0.307
328 H MET 46 HN MET 46 -2.855 6.185 4.224
329 HA MET 46 HA MET 46 -0.050 6.203 4.197
330 HB2 MET 46 HB2 MET 46 -1.965 7.525 6.129
331 HB3 MET 46 HB1 MET 46 -0.239 7.845 6.086
332 HG2 MET 46 HG2 MET 46 -0.397 8.724 3.862
333 HG3 MET 46 HG1 MET 46 -2.101 8.268 3.764
334 HE1 MET 46 HE1 MET 46 -2.743 10.701 2.970
335 HE2 MET 46 HE2 MET 46 -1.041 11.157 3.022
336 HE3 MET 46 HE3 MET 46 -2.249 12.173 3.807
337 H GLU 47 HN GLU 47 -2.304 4.828 6.476
338 HA GLU 47 HA GLU 47 -0.287 4.119 8.347
339 HB2 GLU 47 HB2 GLU 47 -2.728 4.511 8.848
340 HB3 GLU 47 HB1 GLU 47 -3.063 2.953 8.111
341 HG2 GLU 47 HG2 GLU 47 -2.976 2.825 10.547
342 HG3 GLU 47 HG1 GLU 47 -1.719 1.845 9.794
343 H THR 48 HN THR 48 -1.593 2.651 5.489
344 HA THR 48 HA THR 48 -0.715 -0.034 5.901
345 HB THR 48 HB THR 48 -1.047 1.493 3.295
346 HG1 THR 48 HG1 THR 48 -2.829 0.954 5.108
347 HG21 THR 48 HG21 THR 48 -1.186 -1.473 3.886
348 HG22 THR 48 HG22 THR 48 0.133 -0.656 3.046
349 HG23 THR 48 HG23 THR 48 -1.473 -0.724 2.318
350 H ALA 49 HN ALA 49 0.590 2.819 4.328
351 HA ALA 49 HA ALA 49 3.051 1.808 3.517
352 HB1 ALA 49 HB1 ALA 49 2.183 3.977 2.779
353 HB2 ALA 49 HB2 ALA 49 3.793 4.147 3.485
354 HB3 ALA 49 HB3 ALA 49 2.369 4.612 4.414
355 H ALA 50 HN ALA 50 2.119 3.471 6.513
356 HA ALA 50 HA ALA 50 4.536 3.429 7.865
357 HB1 ALA 50 HB1 ALA 50 1.778 3.163 9.047
358 HB2 ALA 50 HB2 ALA 50 2.566 4.678 8.593
359 HB3 ALA 50 HB3 ALA 50 3.232 3.691 9.898
360 H ARG 51 HN ARG 51 2.023 0.970 7.800
361 HA ARG 51 HA ARG 51 3.135 -0.859 9.591
362 HB2 ARG 51 HB2 ARG 51 0.837 -1.044 8.809
363 HB3 ARG 51 HB1 ARG 51 1.381 -1.304 7.162
364 HG2 ARG 51 HG2 ARG 51 0.612 -3.355 8.241
365 HG3 ARG 51 HG1 ARG 51 2.311 -3.445 7.777
366 HD2 ARG 51 HD2 ARG 51 2.951 -2.894 10.056
367 HD3 ARG 51 HD1 ARG 51 1.256 -2.839 10.528
368 HE ARG 51 HE ARG 51 1.529 -5.294 9.416
369 HH11 ARG 51 HH11 ARG 51 3.382 -3.640 11.962
370 HH12 ARG 51 HH12 ARG 51 3.622 -5.039 12.887
371 HH21 ARG 51 HH21 ARG 51 1.819 -7.185 10.690
372 HH22 ARG 51 HH22 ARG 51 2.721 -7.147 12.145
373 H LEU 52 HN LEU 52 3.316 -0.872 6.063
374 HA LEU 52 HA LEU 52 5.243 -2.903 5.921
375 HB2 LEU 52 HB2 LEU 52 4.413 -0.843 3.909
376 HB3 LEU 52 HB1 LEU 52 5.628 -2.060 3.554
377 HG LEU 52 HG LEU 52 2.814 -2.702 4.436
378 HD11 LEU 52 HD11 LEU 52 2.414 -3.359 2.130
379 HD12 LEU 52 HD12 LEU 52 4.015 -2.762 1.682
380 HD13 LEU 52 HD13 LEU 52 2.783 -1.637 2.253
381 HD21 LEU 52 HD21 LEU 52 3.376 -4.958 3.692
382 HD22 LEU 52 HD22 LEU 52 4.444 -4.416 4.988
383 HD23 LEU 52 HD23 LEU 52 5.017 -4.428 3.320
384 H GLU 53 HN GLU 53 5.681 0.547 6.318
385 HA GLU 53 HA GLU 53 8.409 0.796 5.834
386 HB2 GLU 53 HB2 GLU 53 6.779 2.033 8.044
387 HB3 GLU 53 HB1 GLU 53 8.439 2.469 7.697
388 HG2 GLU 53 HG2 GLU 53 7.691 3.187 5.442
389 HG3 GLU 53 HG1 GLU 53 6.028 2.895 5.972
390 H SER 54 HN SER 54 6.791 0.021 8.834
391 HA SER 54 HA SER 54 9.078 -0.448 10.351
392 HB2 SER 54 HB2 SER 54 6.291 -1.536 10.746
393 HB3 SER 54 HB1 SER 54 7.529 -1.326 11.988
394 HG SER 54 HG SER 54 5.889 0.573 10.772
395 H ARG 55 HN ARG 55 7.008 -2.629 8.490
396 HA ARG 55 HA ARG 55 8.190 -5.022 9.360
397 HB2 ARG 55 HB2 ARG 55 6.012 -5.135 8.382
398 HB3 ARG 55 HB1 ARG 55 6.576 -4.413 6.881
399 HG2 ARG 55 HG2 ARG 55 7.905 -6.396 6.401
400 HG3 ARG 55 HG1 ARG 55 7.404 -7.114 7.932
401 HD2 ARG 55 HD2 ARG 55 5.149 -7.302 7.194
402 HD3 ARG 55 HD1 ARG 55 5.469 -6.312 5.768
403 HE ARG 55 HE ARG 55 7.194 -8.384 5.503
404 HH11 ARG 55 HH11 ARG 55 3.682 -8.451 6.149
405 HH12 ARG 55 HH12 ARG 55 3.418 -9.748 5.085
406 HH21 ARG 55 HH21 ARG 55 6.767 -10.159 4.112
407 HH22 ARG 55 HH22 ARG 55 5.172 -10.736 3.899
408 H TYR 56 HN TYR 56 8.842 -3.143 6.386
409 HA TYR 56 HA TYR 56 10.963 -5.045 5.774
410 HB2 TYR 56 HB2 TYR 56 9.742 -2.833 4.148
411 HB3 TYR 56 HB1 TYR 56 11.186 -3.698 3.633
412 HD1 TYR 56 HD1 TYR 56 7.597 -4.090 4.438
413 HD2 TYR 56 HD2 TYR 56 11.020 -5.863 2.653
414 HE1 TYR 56 HE1 TYR 56 6.173 -5.842 3.466
415 HE2 TYR 56 HE2 TYR 56 9.607 -7.613 1.677
416 HH TYR 56 HH TYR 56 6.174 -7.465 1.669
417 H GLY 57 HN GLY 57 10.712 -1.882 7.102
418 HA2 GLY 57 HA2 GLY 57 12.520 -0.848 8.184
419 HA3 GLY 57 HA1 GLY 57 13.630 -1.770 7.174
420 H VAL 58 HN VAL 58 10.870 -0.109 5.938
421 HA VAL 58 HA VAL 58 12.667 1.667 4.473
422 HB VAL 58 HB VAL 58 10.893 1.950 2.760
423 HG11 VAL 58 HG11 VAL 58 12.613 0.314 2.402
424 HG12 VAL 58 HG12 VAL 58 11.070 -0.242 1.737
425 HG13 VAL 58 HG13 VAL 58 11.663 -0.901 3.268
426 HG21 VAL 58 HG21 VAL 58 8.976 0.410 2.704
427 HG22 VAL 58 HG22 VAL 58 8.918 1.491 4.091
428 HG23 VAL 58 HG23 VAL 58 9.424 -0.191 4.302
429 H SER 59 HN SER 59 11.331 3.736 3.695
430 HA SER 59 HA SER 59 9.707 4.657 5.892
431 HB2 SER 59 HB2 SER 59 12.059 5.349 6.404
432 HB3 SER 59 HB1 SER 59 12.084 6.243 4.883
433 HG SER 59 HG SER 59 10.052 6.651 6.770
434 H ILE 60 HN ILE 60 7.988 5.300 5.022
435 HA ILE 60 HA ILE 60 8.016 6.486 2.325
436 HB ILE 60 HB ILE 60 5.797 4.886 3.637
437 HG12 ILE 60 HG12 ILE 60 7.581 4.140 1.305
438 HG13 ILE 60 HG11 ILE 60 7.769 3.532 2.942
439 HG21 ILE 60 HG21 ILE 60 5.986 6.057 0.852
440 HG22 ILE 60 HG22 ILE 60 4.926 6.616 2.146
441 HG23 ILE 60 HG23 ILE 60 4.687 5.018 1.442
442 HD11 ILE 60 HD11 ILE 60 5.396 3.089 1.148
443 HD12 ILE 60 HD12 ILE 60 5.574 2.478 2.794
444 HD13 ILE 60 HD13 ILE 60 6.660 1.917 1.523
445 HA PRO 61 HA PRO 61 6.490 10.058 4.662
446 HB2 PRO 61 HB2 PRO 61 6.120 11.031 1.873
447 HB3 PRO 61 HB1 PRO 61 6.950 11.808 3.226
448 HG2 PRO 61 HG2 PRO 61 8.331 10.747 1.223
449 HG3 PRO 61 HG1 PRO 61 8.896 10.607 2.898
450 HD2 PRO 61 HD2 PRO 61 7.543 8.566 1.178
451 HD3 PRO 61 HD1 PRO 61 8.881 8.364 2.330
452 H ASP 62 HN ASP 62 4.460 10.299 5.255
453 HA ASP 62 HA ASP 62 2.379 8.704 4.338
454 HB2 ASP 62 HB2 ASP 62 0.863 10.005 5.739
455 HB3 ASP 62 HB1 ASP 62 2.382 9.729 6.581
456 H ASP 63 HN ASP 63 3.266 11.921 3.319
457 HA ASP 63 HA ASP 63 0.989 12.704 1.904
458 HB2 ASP 63 HB2 ASP 63 2.807 14.253 2.238
459 HB3 ASP 63 HB1 ASP 63 3.895 13.249 1.287
460 H VAL 64 HN VAL 64 3.480 10.440 1.006
461 HA VAL 64 HA VAL 64 2.968 10.416 -1.784
462 HB VAL 64 HB VAL 64 4.199 8.253 -0.091
463 HG11 VAL 64 HG11 VAL 64 3.633 7.482 -2.353
464 HG12 VAL 64 HG12 VAL 64 5.384 7.608 -2.190
465 HG13 VAL 64 HG13 VAL 64 4.485 8.857 -3.055
466 HG21 VAL 64 HG21 VAL 64 6.384 9.253 -0.686
467 HG22 VAL 64 HG22 VAL 64 5.373 10.338 0.266
468 HG23 VAL 64 HG23 VAL 64 5.533 10.582 -1.473
469 H ALA 65 HN ALA 65 1.392 8.952 0.893
470 HA ALA 65 HA ALA 65 0.149 6.901 -0.700
471 HB1 ALA 65 HB1 ALA 65 -0.426 7.713 2.141
472 HB2 ALA 65 HB2 ALA 65 0.730 6.477 1.646
473 HB3 ALA 65 HB3 ALA 65 -0.993 6.248 1.338
474 H GLY 66 HN GLY 66 -0.290 10.143 -0.392
475 HA2 GLY 66 HA2 GLY 66 -3.170 10.045 -0.833
476 HA3 GLY 66 HA1 GLY 66 -2.170 11.498 -0.722
477 H ARG 67 HN ARG 67 -0.252 9.928 -2.504
478 HA ARG 67 HA ARG 67 -1.127 11.058 -5.004
479 HB2 ARG 67 HB2 ARG 67 1.196 11.247 -4.541
480 HB3 ARG 67 HB1 ARG 67 1.330 9.545 -4.135
481 HG2 ARG 67 HG2 ARG 67 0.897 8.991 -6.524
482 HG3 ARG 67 HG1 ARG 67 0.907 10.717 -6.884
483 HD2 ARG 67 HD2 ARG 67 3.185 10.920 -6.231
484 HD3 ARG 67 HD1 ARG 67 3.201 9.291 -5.558
485 HE ARG 67 HE ARG 67 2.541 9.179 -8.290
486 HH11 ARG 67 HH11 ARG 67 5.344 9.975 -6.253
487 HH12 ARG 67 HH12 ARG 67 6.508 9.326 -7.312
488 HH21 ARG 67 HH21 ARG 67 4.175 8.222 -9.788
489 HH22 ARG 67 HH22 ARG 67 5.815 8.312 -9.373
490 H VAL 68 HN VAL 68 -0.724 7.841 -3.625
491 HA VAL 68 HA VAL 68 -0.684 6.370 -5.948
492 HB VAL 68 HB VAL 68 -1.315 4.398 -4.523
493 HG11 VAL 68 HG11 VAL 68 0.862 6.227 -3.525
494 HG12 VAL 68 HG12 VAL 68 0.986 5.087 -4.861
495 HG13 VAL 68 HG13 VAL 68 0.758 4.494 -3.211
496 HG21 VAL 68 HG21 VAL 68 -2.741 5.553 -2.889
497 HG22 VAL 68 HG22 VAL 68 -1.345 6.472 -2.321
498 HG23 VAL 68 HG23 VAL 68 -1.404 4.724 -2.094
499 H ASP 69 HN ASP 69 -1.970 6.449 -7.447
500 HA ASP 69 HA ASP 69 -4.801 6.856 -7.388
501 HB2 ASP 69 HB2 ASP 69 -3.423 7.417 -9.356
502 HB3 ASP 69 HB1 ASP 69 -3.020 5.726 -9.554
503 H THR 70 HN THR 70 -2.765 4.054 -7.974
504 HA THR 70 HA THR 70 -5.005 2.279 -7.342
505 HB THR 70 HB THR 70 -4.071 0.725 -9.053
506 HG1 THR 70 HG1 THR 70 -2.695 2.804 -10.305
507 HG21 THR 70 HG21 THR 70 -4.850 3.448 -10.097
508 HG22 THR 70 HG22 THR 70 -5.975 2.167 -9.634
509 HG23 THR 70 HG23 THR 70 -4.909 1.951 -11.034
510 HA PRO 71 HA PRO 71 -2.089 0.292 -4.646
511 HB2 PRO 71 HB2 PRO 71 -3.010 -2.309 -5.726
512 HB3 PRO 71 HB1 PRO 71 -2.968 -1.728 -4.057
513 HG2 PRO 71 HG2 PRO 71 -5.272 -1.868 -5.348
514 HG3 PRO 71 HG1 PRO 71 -4.907 -0.488 -4.291
515 HD2 PRO 71 HD2 PRO 71 -4.767 -0.671 -7.277
516 HD3 PRO 71 HD1 PRO 71 -5.428 0.629 -6.263
517 H ARG 72 HN ARG 72 -2.083 -0.488 -8.107
518 HA ARG 72 HA ARG 72 0.394 -1.874 -8.082
519 HB2 ARG 72 HB2 ARG 72 -0.839 -0.193 -10.264
520 HB3 ARG 72 HB1 ARG 72 0.711 -0.988 -10.446
521 HG2 ARG 72 HG2 ARG 72 -0.498 -3.145 -9.964
522 HG3 ARG 72 HG1 ARG 72 -1.994 -2.222 -10.148
523 HD2 ARG 72 HD2 ARG 72 -1.232 -1.495 -12.369
524 HD3 ARG 72 HD1 ARG 72 0.194 -2.510 -12.182
525 HE ARG 72 HE ARG 72 -2.534 -3.611 -12.156
526 HH11 ARG 72 HH11 ARG 72 0.844 -3.972 -13.099
527 HH12 ARG 72 HH12 ARG 72 0.535 -5.105 -14.330
528 HH21 ARG 72 HH21 ARG 72 -2.979 -5.086 -13.791
529 HH22 ARG 72 HH22 ARG 72 -1.734 -5.752 -14.784
530 H GLU 73 HN GLU 73 -0.448 1.499 -8.140
531 HA GLU 73 HA GLU 73 2.192 2.444 -8.544
532 HB2 GLU 73 HB2 GLU 73 0.178 3.730 -9.109
533 HB3 GLU 73 HB1 GLU 73 -0.261 3.798 -7.414
534 HG2 GLU 73 HG2 GLU 73 1.439 5.301 -6.918
535 HG3 GLU 73 HG1 GLU 73 2.309 4.951 -8.415
536 H LEU 74 HN LEU 74 0.231 1.729 -5.758
537 HA LEU 74 HA LEU 74 2.029 2.724 -3.777
538 HB2 LEU 74 HB2 LEU 74 -0.529 2.024 -3.670
539 HB3 LEU 74 HB1 LEU 74 0.117 0.446 -3.291
540 HG LEU 74 HG LEU 74 0.493 2.965 -1.655
541 HD11 LEU 74 HD11 LEU 74 -1.188 0.530 -1.147
542 HD12 LEU 74 HD12 LEU 74 -1.763 2.143 -1.565
543 HD13 LEU 74 HD13 LEU 74 -0.947 1.871 -0.026
544 HD21 LEU 74 HD21 LEU 74 2.414 1.461 -1.417
545 HD22 LEU 74 HD22 LEU 74 1.322 0.132 -1.025
546 HD23 LEU 74 HD23 LEU 74 1.453 1.518 0.061
547 H LEU 75 HN LEU 75 1.422 -0.453 -5.222
548 HA LEU 75 HA LEU 75 3.293 -2.061 -3.922
549 HB2 LEU 75 HB2 LEU 75 1.480 -2.796 -5.481
550 HB3 LEU 75 HB1 LEU 75 2.394 -2.137 -6.812
551 HG LEU 75 HG LEU 75 4.203 -3.810 -6.272
552 HD11 LEU 75 HD11 LEU 75 3.561 -5.739 -4.931
553 HD12 LEU 75 HD12 LEU 75 2.041 -4.941 -4.515
554 HD13 LEU 75 HD13 LEU 75 3.576 -4.257 -3.977
555 HD21 LEU 75 HD21 LEU 75 3.029 -5.664 -7.328
556 HD22 LEU 75 HD22 LEU 75 2.596 -4.135 -8.101
557 HD23 LEU 75 HD23 LEU 75 1.483 -4.908 -6.969
558 H ASP 76 HN ASP 76 3.505 -0.271 -6.951
559 HA ASP 76 HA ASP 76 6.130 -0.763 -7.685
560 HB2 ASP 76 HB2 ASP 76 4.478 0.216 -9.188
561 HB3 ASP 76 HB1 ASP 76 4.425 1.674 -8.208
562 H LEU 77 HN LEU 77 4.798 1.854 -5.732
563 HA LEU 77 HA LEU 77 7.056 3.382 -5.269
564 HB2 LEU 77 HB2 LEU 77 4.968 4.183 -4.505
565 HB3 LEU 77 HB1 LEU 77 4.685 2.753 -3.535
566 HG LEU 77 HG LEU 77 6.587 3.468 -2.074
567 HD11 LEU 77 HD11 LEU 77 7.309 5.784 -2.109
568 HD12 LEU 77 HD12 LEU 77 6.410 6.048 -3.609
569 HD13 LEU 77 HD13 LEU 77 7.770 4.922 -3.576
570 HD21 LEU 77 HD21 LEU 77 4.243 5.348 -2.282
571 HD22 LEU 77 HD22 LEU 77 5.298 5.152 -0.878
572 HD23 LEU 77 HD23 LEU 77 4.290 3.812 -1.413
573 H ILE 78 HN ILE 78 5.820 0.710 -3.294
574 HA ILE 78 HA ILE 78 8.078 0.867 -1.571
575 HB ILE 78 HB ILE 78 6.127 -1.447 -1.689
576 HG12 ILE 78 HG12 ILE 78 5.957 1.135 -0.117
577 HG13 ILE 78 HG11 ILE 78 4.968 0.743 -1.519
578 HG21 ILE 78 HG21 ILE 78 6.771 -1.652 0.701
579 HG22 ILE 78 HG22 ILE 78 7.876 -0.295 0.512
580 HG23 ILE 78 HG23 ILE 78 8.177 -1.800 -0.355
581 HD11 ILE 78 HD11 ILE 78 3.757 0.419 0.546
582 HD12 ILE 78 HD12 ILE 78 4.988 -0.714 1.106
583 HD13 ILE 78 HD13 ILE 78 3.988 -1.115 -0.290
584 H ASN 79 HN ASN 79 7.225 -1.151 -4.314
585 HA ASN 79 HA ASN 79 9.358 -2.985 -4.068
586 HB2 ASN 79 HB2 ASN 79 7.784 -2.034 -6.461
587 HB3 ASN 79 HB1 ASN 79 9.171 -3.082 -6.680
588 HD21 ASN 79 HD21 ASN 79 6.957 -3.369 -3.947
589 HD22 ASN 79 HD22 ASN 79 6.284 -4.881 -4.459
590 H GLY 80 HN GLY 80 9.154 0.186 -5.590
591 HA2 GLY 80 HA2 GLY 80 11.815 0.219 -6.550
592 HA3 GLY 80 HA1 GLY 80 10.780 1.620 -6.286
593 H ALA 81 HN ALA 81 10.290 1.351 -3.589
594 HA ALA 81 HA ALA 81 12.545 2.556 -2.432
595 HB1 ALA 81 HB1 ALA 81 10.168 1.344 -1.025
596 HB2 ALA 81 HB2 ALA 81 10.246 2.978 -1.678
597 HB3 ALA 81 HB3 ALA 81 11.300 2.512 -0.340
598 H LEU 82 HN LEU 82 11.512 -0.778 -2.496
599 HA LEU 82 HA LEU 82 13.278 -1.700 -0.471
600 HB2 LEU 82 HB2 LEU 82 11.969 -3.176 -2.757
601 HB3 LEU 82 HB1 LEU 82 12.883 -3.959 -1.483
602 HG LEU 82 HG LEU 82 10.364 -2.352 -1.066
603 HD11 LEU 82 HD11 LEU 82 9.907 -4.410 -2.255
604 HD12 LEU 82 HD12 LEU 82 9.306 -4.498 -0.601
605 HD13 LEU 82 HD13 LEU 82 10.800 -5.328 -1.043
606 HD21 LEU 82 HD21 LEU 82 11.972 -4.048 0.835
607 HD22 LEU 82 HD22 LEU 82 10.428 -3.276 1.195
608 HD23 LEU 82 HD23 LEU 82 11.851 -2.289 0.855
609 H ALA 83 HN ALA 83 13.620 -1.078 -3.859
610 HA ALA 83 HA ALA 83 16.225 -2.288 -4.067
611 HB1 ALA 83 HB1 ALA 83 16.264 -1.257 -6.301
612 HB2 ALA 83 HB2 ALA 83 14.799 -0.357 -5.910
613 HB3 ALA 83 HB3 ALA 83 14.749 -2.115 -6.026
614 H GLU 84 HN GLU 84 14.989 0.498 -2.744
615 HA GLU 84 HA GLU 84 17.527 1.979 -2.914
616 HB2 GLU 84 HB2 GLU 84 14.760 2.919 -2.139
617 HB3 GLU 84 HB1 GLU 84 16.198 3.924 -2.206
618 HG2 GLU 84 HG2 GLU 84 16.352 3.618 -4.587
619 HG3 GLU 84 HG1 GLU 84 14.985 2.503 -4.558
620 H ALA 85 HN ALA 85 16.424 -0.311 -1.133
621 HA ALA 85 HA ALA 85 16.359 0.859 1.484
622 HB1 ALA 85 HB1 ALA 85 16.486 -2.047 0.680
623 HB2 ALA 85 HB2 ALA 85 15.011 -1.126 0.974
624 HB3 ALA 85 HB3 ALA 85 16.139 -1.433 2.295
625 H ALA 86 HN ALA 86 18.078 1.532 2.421
626 HA ALA 86 HA ALA 86 20.532 -0.034 2.215
627 HB1 ALA 86 HB1 ALA 86 21.795 2.084 2.346
628 HB2 ALA 86 HB2 ALA 86 20.281 2.984 2.289
629 HB3 ALA 86 HB3 ALA 86 20.787 2.023 0.900
630 H28 SXV 87 H28A SXV 87 -6.296 13.371 4.837
631 H28A SXV 87 H28B SXV 87 -5.022 12.366 4.156
632 H30 SXV 87 H30C SXV 87 -3.178 13.583 4.971
633 H30A SXV 87 H30A SXV 87 -4.327 14.523 5.923
634 H30B SXV 87 H30B SXV 87 -3.127 15.344 4.923
635 H31 SXV 87 H31C SXV 87 -4.682 14.296 1.721
636 H31A SXV 87 H31A SXV 87 -3.332 13.497 2.529
637 H31B SXV 87 H31B SXV 87 -3.356 15.264 2.380
638 H32 SXV 87 H32A SXV 87 -4.916 16.667 3.819
639 HO33 SXV 87 H33A SXV 87 -6.977 15.123 5.044
640 HN36 SXV 87 H36A SXV 87 -8.086 15.501 3.820
641 H37 SXV 87 H37B SXV 87 -8.402 15.654 0.919
642 H37A SXV 87 H37A SXV 87 -9.379 16.698 1.940
643 H38 SXV 87 H38B SXV 87 -10.393 14.721 2.982
644 H38A SXV 87 H38A SXV 87 -9.247 13.714 2.077
645 HN41 SXV 87 H41A SXV 87 -9.568 15.487 -0.294
646 H42 SXV 87 H42B SXV 87 -11.806 15.915 -1.493
647 H42A SXV 87 H42A SXV 87 -11.825 14.160 -1.531
648 H43 SXV 87 H43B SXV 87 -9.786 14.133 -2.730
649 H43A SXV 87 H43A SXV 87 -10.818 15.293 -3.549
650 H1 SXV 87 H1B SXV 87 -7.190 16.794 -3.914
651 H1A SXV 87 H1A SXV 87 -7.739 15.111 -4.049
652 H2 SXV 87 H2A SXV 87 -9.705 15.752 -5.251
653 H2A SXV 87 H2B SXV 87 -8.242 16.283 -6.075
654 H4 SXV 87 H4C SXV 87 -11.268 18.594 -4.535
655 H4A SXV 87 H4A SXV 87 -11.378 17.085 -5.449
656 H4B SXV 87 H4B SXV 87 -11.098 18.612 -6.296
Start of MODEL 7
1 H1 MET 1 HT1 MET 1 20.625 -10.161 -1.704
2 H2 MET 1 HT2 MET 1 20.204 -9.450 -3.176
3 H3 MET 1 HT3 MET 1 20.690 -11.081 -3.127
4 HA MET 1 HA MET 1 18.314 -10.887 -3.393
5 HB2 MET 1 HB2 MET 1 19.239 -12.772 -2.060
6 HB3 MET 1 HB1 MET 1 19.095 -11.791 -0.608
7 HG2 MET 1 HG2 MET 1 16.652 -11.693 -0.959
8 HG3 MET 1 HG1 MET 1 16.836 -12.763 -2.347
9 HE1 MET 1 HE1 MET 1 17.110 -12.412 1.556
10 HE2 MET 1 HE2 MET 1 18.758 -12.851 1.109
11 HE3 MET 1 HE3 MET 1 17.760 -13.986 2.016
12 H ALA 2 HN ALA 2 16.647 -9.566 -3.132
13 HA ALA 2 HA ALA 2 16.774 -7.645 -0.923
14 HB1 ALA 2 HB1 ALA 2 15.355 -6.226 -2.338
15 HB2 ALA 2 HB2 ALA 2 15.370 -7.464 -3.594
16 HB3 ALA 2 HB3 ALA 2 16.864 -6.635 -3.155
17 H THR 3 HN THR 3 14.849 -7.292 0.245
18 HA THR 3 HA THR 3 13.036 -9.521 0.270
19 HB THR 3 HB THR 3 12.048 -8.000 2.147
20 HG1 THR 3 HG1 THR 3 13.449 -6.362 2.865
21 HG21 THR 3 HG21 THR 3 13.782 -8.743 3.729
22 HG22 THR 3 HG22 THR 3 14.858 -9.100 2.376
23 HG23 THR 3 HG23 THR 3 13.367 -10.019 2.585
24 H LEU 4 HN LEU 4 11.598 -9.461 -1.312
25 HA LEU 4 HA LEU 4 10.378 -6.886 -2.016
26 HB2 LEU 4 HB2 LEU 4 10.852 -9.296 -3.773
27 HB3 LEU 4 HB1 LEU 4 9.987 -7.853 -4.257
28 HG LEU 4 HG LEU 4 12.912 -7.951 -3.503
29 HD11 LEU 4 HD11 LEU 4 11.590 -7.705 -6.196
30 HD12 LEU 4 HD12 LEU 4 12.486 -9.101 -5.600
31 HD13 LEU 4 HD13 LEU 4 13.319 -7.572 -5.880
32 HD21 LEU 4 HD21 LEU 4 11.230 -5.716 -4.639
33 HD22 LEU 4 HD22 LEU 4 12.974 -5.663 -4.380
34 HD23 LEU 4 HD23 LEU 4 11.881 -5.794 -3.003
35 H LEU 5 HN LEU 5 8.231 -6.772 -1.983
36 HA LEU 5 HA LEU 5 6.877 -9.172 -1.139
37 HB2 LEU 5 HB2 LEU 5 4.984 -7.625 -0.522
38 HB3 LEU 5 HB1 LEU 5 6.427 -7.529 0.450
39 HG LEU 5 HG LEU 5 7.002 -5.416 -0.867
40 HD11 LEU 5 HD11 LEU 5 5.164 -4.236 -1.931
41 HD12 LEU 5 HD12 LEU 5 4.122 -5.641 -1.711
42 HD13 LEU 5 HD13 LEU 5 5.525 -5.742 -2.774
43 HD21 LEU 5 HD21 LEU 5 5.471 -4.048 0.453
44 HD22 LEU 5 HD22 LEU 5 6.180 -5.376 1.384
45 HD23 LEU 5 HD23 LEU 5 4.517 -5.494 0.805
46 H THR 6 HN THR 6 5.272 -10.098 -2.200
47 HA THR 6 HA THR 6 4.982 -9.333 -4.976
48 HB THR 6 HB THR 6 3.774 -11.498 -5.121
49 HG1 THR 6 HG1 THR 6 4.455 -12.575 -2.773
50 HG21 THR 6 HG21 THR 6 5.726 -12.946 -4.696
51 HG22 THR 6 HG22 THR 6 6.463 -11.669 -3.730
52 HG23 THR 6 HG23 THR 6 6.223 -11.437 -5.463
53 H THR 7 HN THR 7 2.496 -10.121 -5.650
54 HA THR 7 HA THR 7 0.802 -8.198 -4.505
55 HB THR 7 HB THR 7 -0.963 -9.410 -5.898
56 HG1 THR 7 HG1 THR 7 0.558 -10.690 -7.551
57 HG21 THR 7 HG21 THR 7 1.560 -8.440 -7.261
58 HG22 THR 7 HG22 THR 7 0.237 -7.419 -6.698
59 HG23 THR 7 HG23 THR 7 -0.030 -8.563 -8.013
60 H ASP 8 HN ASP 8 1.589 -11.437 -3.686
61 HA ASP 8 HA ASP 8 -0.815 -12.019 -2.225
62 HB2 ASP 8 HB2 ASP 8 1.951 -13.252 -2.019
63 HB3 ASP 8 HB1 ASP 8 0.588 -13.779 -1.053
64 H ASP 9 HN ASP 9 2.305 -10.642 -1.516
65 HA ASP 9 HA ASP 9 1.729 -10.493 1.289
66 HB2 ASP 9 HB2 ASP 9 4.086 -10.653 0.451
67 HB3 ASP 9 HB1 ASP 9 3.918 -9.001 -0.144
68 H LEU 10 HN LEU 10 1.698 -8.238 -1.410
69 HA LEU 10 HA LEU 10 1.031 -5.946 0.080
70 HB2 LEU 10 HB2 LEU 10 1.737 -5.990 -2.335
71 HB3 LEU 10 HB1 LEU 10 0.147 -6.603 -2.739
72 HG LEU 10 HG LEU 10 -0.839 -4.516 -1.807
73 HD11 LEU 10 HD11 LEU 10 0.949 -3.893 -0.303
74 HD12 LEU 10 HD12 LEU 10 0.625 -2.591 -1.449
75 HD13 LEU 10 HD13 LEU 10 2.033 -3.630 -1.668
76 HD21 LEU 10 HD21 LEU 10 1.164 -4.144 -4.031
77 HD22 LEU 10 HD22 LEU 10 -0.221 -3.102 -3.707
78 HD23 LEU 10 HD23 LEU 10 -0.474 -4.774 -4.207
79 H ARG 11 HN ARG 11 -0.835 -8.603 -1.145
80 HA ARG 11 HA ARG 11 -3.443 -7.676 -0.703
81 HB2 ARG 11 HB2 ARG 11 -2.729 -9.692 -2.010
82 HB3 ARG 11 HB1 ARG 11 -2.383 -10.496 -0.496
83 HG2 ARG 11 HG2 ARG 11 -4.725 -10.451 0.091
84 HG3 ARG 11 HG1 ARG 11 -5.095 -9.537 -1.378
85 HD2 ARG 11 HD2 ARG 11 -3.919 -12.318 -1.255
86 HD3 ARG 11 HD1 ARG 11 -5.575 -11.907 -1.703
87 HE ARG 11 HE ARG 11 -4.578 -10.666 -3.613
88 HH11 ARG 11 HH11 ARG 11 -3.047 -13.538 -2.309
89 HH12 ARG 11 HH12 ARG 11 -1.949 -13.757 -3.570
90 HH21 ARG 11 HH21 ARG 11 -3.142 -10.975 -5.480
91 HH22 ARG 11 HH22 ARG 11 -2.065 -12.289 -5.479
92 H ARG 12 HN ARG 12 -1.048 -9.182 1.419
93 HA ARG 12 HA ARG 12 -2.819 -9.331 3.681
94 HB2 ARG 12 HB2 ARG 12 0.208 -9.393 3.611
95 HB3 ARG 12 HB1 ARG 12 -0.759 -9.652 5.050
96 HG2 ARG 12 HG2 ARG 12 -1.783 -11.611 3.852
97 HG3 ARG 12 HG1 ARG 12 -0.530 -11.395 2.624
98 HD2 ARG 12 HD2 ARG 12 -0.050 -11.858 5.571
99 HD3 ARG 12 HD1 ARG 12 0.096 -13.077 4.314
100 HE ARG 12 HE ARG 12 1.781 -10.937 3.664
101 HH11 ARG 12 HH11 ARG 12 1.585 -13.284 6.353
102 HH12 ARG 12 HH12 ARG 12 3.292 -13.480 6.394
103 HH21 ARG 12 HH21 ARG 12 4.008 -11.165 3.891
104 HH22 ARG 12 HH22 ARG 12 4.694 -12.225 5.066
105 H ALA 13 HN ALA 13 -0.345 -7.134 2.556
106 HA ALA 13 HA ALA 13 -0.128 -5.416 4.706
107 HB1 ALA 13 HB1 ALA 13 0.087 -4.690 1.790
108 HB2 ALA 13 HB2 ALA 13 1.367 -5.407 2.774
109 HB3 ALA 13 HB3 ALA 13 0.763 -3.795 3.151
110 H LEU 14 HN LEU 14 -2.376 -5.163 1.962
111 HA LEU 14 HA LEU 14 -3.601 -2.808 2.955
112 HB2 LEU 14 HB2 LEU 14 -4.368 -4.751 0.819
113 HB3 LEU 14 HB1 LEU 14 -5.580 -3.639 1.404
114 HG LEU 14 HG LEU 14 -4.599 -2.782 -0.617
115 HD11 LEU 14 HD11 LEU 14 -3.859 -0.582 0.129
116 HD12 LEU 14 HD12 LEU 14 -3.679 -1.206 1.769
117 HD13 LEU 14 HD13 LEU 14 -5.273 -1.150 1.017
118 HD21 LEU 14 HD21 LEU 14 -1.942 -2.880 0.810
119 HD22 LEU 14 HD22 LEU 14 -2.234 -2.144 -0.767
120 HD23 LEU 14 HD23 LEU 14 -2.429 -3.884 -0.556
121 H VAL 15 HN VAL 15 -4.002 -6.069 3.864
122 HA VAL 15 HA VAL 15 -6.538 -5.480 5.117
123 HB VAL 15 HB VAL 15 -4.921 -8.062 5.195
124 HG11 VAL 15 HG11 VAL 15 -7.748 -7.552 6.139
125 HG12 VAL 15 HG12 VAL 15 -6.358 -7.864 7.178
126 HG13 VAL 15 HG13 VAL 15 -6.945 -9.122 6.088
127 HG21 VAL 15 HG21 VAL 15 -5.771 -7.539 2.986
128 HG22 VAL 15 HG22 VAL 15 -7.391 -7.319 3.643
129 HG23 VAL 15 HG23 VAL 15 -6.636 -8.913 3.676
130 H GLU 16 HN GLU 16 -3.241 -5.236 5.888
131 HA GLU 16 HA GLU 16 -3.410 -5.730 8.657
132 HB2 GLU 16 HB2 GLU 16 -1.342 -4.013 7.218
133 HB3 GLU 16 HB1 GLU 16 -1.247 -4.568 8.879
134 HG2 GLU 16 HG2 GLU 16 -1.379 -6.918 7.986
135 HG3 GLU 16 HG1 GLU 16 -1.137 -6.225 6.388
136 H SER 17 HN SER 17 -3.528 -2.678 6.824
137 HA SER 17 HA SER 17 -4.097 -1.176 9.157
138 HB2 SER 17 HB2 SER 17 -4.699 0.560 7.326
139 HB3 SER 17 HB1 SER 17 -3.023 0.020 7.471
140 HG SER 17 HG SER 17 -4.986 -0.765 5.586
141 H ALA 18 HN ALA 18 -5.988 -3.124 7.102
142 HA ALA 18 HA ALA 18 -8.499 -1.838 7.573
143 HB1 ALA 18 HB1 ALA 18 -7.918 -4.681 6.706
144 HB2 ALA 18 HB2 ALA 18 -8.186 -3.308 5.627
145 HB3 ALA 18 HB3 ALA 18 -9.498 -3.894 6.653
146 H GLY 19 HN GLY 19 -6.687 -4.475 8.983
147 HA2 GLY 19 HA2 GLY 19 -6.618 -5.249 11.118
148 HA3 GLY 19 HA1 GLY 19 -7.638 -3.897 11.587
149 H GLU 20 HN GLU 20 -9.575 -4.353 12.268
150 HA GLU 20 HA GLU 20 -10.460 -7.088 12.250
151 HB2 GLU 20 HB2 GLU 20 -11.585 -4.624 13.567
152 HB3 GLU 20 HB1 GLU 20 -12.192 -6.256 13.797
153 HG2 GLU 20 HG2 GLU 20 -9.426 -5.310 14.492
154 HG3 GLU 20 HG1 GLU 20 -10.755 -5.524 15.632
155 H THR 21 HN THR 21 -10.699 -5.003 9.939
156 HA THR 21 HA THR 21 -13.529 -4.977 9.406
157 HB THR 21 HB THR 21 -11.224 -4.401 7.524
158 HG1 THR 21 HG1 THR 21 -11.046 -2.915 9.143
159 HG21 THR 21 HG21 THR 21 -14.136 -3.570 7.427
160 HG22 THR 21 HG22 THR 21 -13.366 -4.760 6.378
161 HG23 THR 21 HG23 THR 21 -12.893 -3.063 6.282
162 H ASP 22 HN ASP 22 -14.184 -7.110 9.368
163 HA ASP 22 HA ASP 22 -12.930 -9.199 7.878
164 HB2 ASP 22 HB2 ASP 22 -14.501 -9.631 9.769
165 HB3 ASP 22 HB1 ASP 22 -15.816 -8.996 8.790
166 H GLY 23 HN GLY 23 -13.432 -9.976 5.826
167 HA2 GLY 23 HA2 GLY 23 -14.494 -9.985 3.766
168 HA3 GLY 23 HA1 GLY 23 -15.521 -8.662 4.311
169 H THR 24 HN THR 24 -12.033 -9.093 4.085
170 HA THR 24 HA THR 24 -11.964 -6.794 2.293
171 HB THR 24 HB THR 24 -9.904 -7.415 4.454
172 HG1 THR 24 HG1 THR 24 -11.453 -6.517 5.652
173 HG21 THR 24 HG21 THR 24 -9.029 -5.174 3.908
174 HG22 THR 24 HG22 THR 24 -10.256 -4.998 2.652
175 HG23 THR 24 HG23 THR 24 -8.996 -6.221 2.488
176 H ASP 25 HN ASP 25 -12.094 -8.595 0.710
177 HA ASP 25 HA ASP 25 -9.519 -9.947 0.391
178 HB2 ASP 25 HB2 ASP 25 -11.433 -11.470 0.262
179 HB3 ASP 25 HB1 ASP 25 -12.144 -10.489 -1.020
180 H LEU 26 HN LEU 26 -8.151 -9.201 -0.910
181 HA LEU 26 HA LEU 26 -8.928 -7.144 -2.817
182 HB2 LEU 26 HB2 LEU 26 -6.230 -8.131 -1.901
183 HB3 LEU 26 HB1 LEU 26 -6.402 -7.040 -3.252
184 HG LEU 26 HG LEU 26 -5.769 -5.758 -1.370
185 HD11 LEU 26 HD11 LEU 26 -7.344 -4.669 -2.788
186 HD12 LEU 26 HD12 LEU 26 -7.608 -4.178 -1.116
187 HD13 LEU 26 HD13 LEU 26 -8.692 -5.346 -1.875
188 HD21 LEU 26 HD21 LEU 26 -8.097 -6.954 0.141
189 HD22 LEU 26 HD22 LEU 26 -7.077 -5.643 0.725
190 HD23 LEU 26 HD23 LEU 26 -6.383 -7.247 0.453
191 H SER 27 HN SER 27 -8.264 -10.452 -2.747
192 HA SER 27 HA SER 27 -8.136 -12.097 -4.226
193 HB2 SER 27 HB2 SER 27 -10.141 -10.835 -5.223
194 HB3 SER 27 HB1 SER 27 -9.009 -10.163 -6.396
195 HG SER 27 HG SER 27 -9.750 -12.826 -5.943
196 H GLY 28 HN GLY 28 -7.230 -12.427 -6.739
197 HA2 GLY 28 HA2 GLY 28 -4.457 -12.400 -6.463
198 HA3 GLY 28 HA1 GLY 28 -5.309 -12.653 -7.976
199 H ASP 29 HN ASP 29 -5.900 -10.737 -9.204
200 HA ASP 29 HA ASP 29 -3.822 -8.712 -8.983
201 HB2 ASP 29 HB2 ASP 29 -4.080 -9.661 -11.204
202 HB3 ASP 29 HB1 ASP 29 -5.807 -9.315 -11.189
203 H PHE 30 HN PHE 30 -4.263 -7.021 -7.860
204 HA PHE 30 HA PHE 30 -6.961 -5.860 -7.986
205 HB2 PHE 30 HB2 PHE 30 -6.774 -5.277 -5.595
206 HB3 PHE 30 HB1 PHE 30 -6.838 -7.005 -5.868
207 HD1 PHE 30 HD2 PHE 30 -4.686 -8.326 -5.640
208 HD2 PHE 30 HD1 PHE 30 -4.992 -4.250 -4.464
209 HE1 PHE 30 HE2 PHE 30 -2.674 -8.578 -4.262
210 HE2 PHE 30 HE1 PHE 30 -2.978 -4.501 -3.079
211 HZ PHE 30 HZ PHE 30 -1.820 -6.665 -2.978
212 H LEU 31 HN LEU 31 -4.306 -5.335 -9.226
213 HA LEU 31 HA LEU 31 -3.188 -3.113 -7.892
214 HB2 LEU 31 HB2 LEU 31 -2.648 -4.234 -10.624
215 HB3 LEU 31 HB1 LEU 31 -1.810 -2.839 -9.984
216 HG LEU 31 HG LEU 31 -0.373 -4.670 -9.697
217 HD11 LEU 31 HD11 LEU 31 -1.669 -4.111 -7.054
218 HD12 LEU 31 HD12 LEU 31 -0.377 -3.189 -7.824
219 HD13 LEU 31 HD13 LEU 31 -0.079 -4.842 -7.283
220 HD21 LEU 31 HD21 LEU 31 -2.628 -6.176 -8.368
221 HD22 LEU 31 HD22 LEU 31 -0.962 -6.740 -8.506
222 HD23 LEU 31 HD23 LEU 31 -1.941 -6.517 -9.955
223 H ASP 32 HN ASP 32 -5.802 -3.306 -10.106
224 HA ASP 32 HA ASP 32 -5.532 -0.404 -10.538
225 HB2 ASP 32 HB2 ASP 32 -7.022 -0.523 -12.437
226 HB3 ASP 32 HB1 ASP 32 -5.786 -1.750 -12.636
227 H LEU 33 HN LEU 33 -6.828 -2.230 -8.297
228 HA LEU 33 HA LEU 33 -9.529 -1.309 -8.233
229 HB2 LEU 33 HB2 LEU 33 -7.808 -2.289 -5.953
230 HB3 LEU 33 HB1 LEU 33 -9.524 -1.975 -5.851
231 HG LEU 33 HG LEU 33 -8.139 -4.180 -7.351
232 HD11 LEU 33 HD11 LEU 33 -10.142 -4.122 -5.125
233 HD12 LEU 33 HD12 LEU 33 -8.427 -4.510 -4.976
234 HD13 LEU 33 HD13 LEU 33 -9.503 -5.584 -5.883
235 HD21 LEU 33 HD21 LEU 33 -10.336 -4.911 -8.072
236 HD22 LEU 33 HD22 LEU 33 -9.963 -3.317 -8.734
237 HD23 LEU 33 HD23 LEU 33 -11.069 -3.468 -7.366
238 H ARG 34 HN ARG 34 -10.278 0.511 -7.538
239 HA ARG 34 HA ARG 34 -8.294 2.535 -6.835
240 HB2 ARG 34 HB2 ARG 34 -11.255 2.967 -7.207
241 HB3 ARG 34 HB1 ARG 34 -9.982 4.176 -7.255
242 HG2 ARG 34 HG2 ARG 34 -10.366 1.968 -9.260
243 HG3 ARG 34 HG1 ARG 34 -10.878 3.638 -9.468
244 HD2 ARG 34 HD2 ARG 34 -8.598 4.390 -9.478
245 HD3 ARG 34 HD1 ARG 34 -8.001 2.779 -9.049
246 HE ARG 34 HE ARG 34 -9.356 2.237 -11.249
247 HH11 ARG 34 HH11 ARG 34 -6.961 4.837 -10.744
248 HH12 ARG 34 HH12 ARG 34 -6.520 4.883 -12.379
249 HH21 ARG 34 HH21 ARG 34 -8.754 2.406 -13.510
250 HH22 ARG 34 HH22 ARG 34 -7.524 3.519 -13.948
251 H PHE 35 HN PHE 35 -8.283 3.611 -4.914
252 HA PHE 35 HA PHE 35 -9.066 2.028 -2.753
253 HB2 PHE 35 HB2 PHE 35 -7.920 4.802 -2.769
254 HB3 PHE 35 HB1 PHE 35 -8.181 3.854 -1.302
255 HD1 PHE 35 HD2 PHE 35 -7.068 1.595 -1.147
256 HD2 PHE 35 HD1 PHE 35 -6.015 4.486 -4.061
257 HE1 PHE 35 HE2 PHE 35 -4.923 0.483 -1.458
258 HE2 PHE 35 HE1 PHE 35 -3.848 3.375 -4.392
259 HZ PHE 35 HZ PHE 35 -3.344 1.297 -3.173
260 H GLU 36 HN GLU 36 -10.751 4.644 -4.215
261 HA GLU 36 HA GLU 36 -12.517 5.285 -2.075
262 HB2 GLU 36 HB2 GLU 36 -13.254 5.165 -4.993
263 HB3 GLU 36 HB1 GLU 36 -13.965 6.179 -3.752
264 HG2 GLU 36 HG2 GLU 36 -12.044 7.563 -3.672
265 HG3 GLU 36 HG1 GLU 36 -11.123 6.446 -4.685
266 H ASP 37 HN ASP 37 -12.722 3.064 -4.795
267 HA ASP 37 HA ASP 37 -15.137 1.823 -4.247
268 HB2 ASP 37 HB2 ASP 37 -14.183 1.608 -6.398
269 HB3 ASP 37 HB1 ASP 37 -12.695 0.934 -5.756
270 H ILE 38 HN ILE 38 -11.870 0.928 -3.192
271 HA ILE 38 HA ILE 38 -13.018 -1.327 -1.777
272 HB ILE 38 HB ILE 38 -10.751 -2.016 -1.146
273 HG12 ILE 38 HG12 ILE 38 -9.832 0.417 -2.707
274 HG13 ILE 38 HG11 ILE 38 -9.740 0.246 -0.959
275 HG21 ILE 38 HG21 ILE 38 -9.956 -2.519 -3.421
276 HG22 ILE 38 HG22 ILE 38 -11.096 -1.322 -4.048
277 HG23 ILE 38 HG23 ILE 38 -11.696 -2.768 -3.237
278 HD11 ILE 38 HD11 ILE 38 -8.195 -1.629 -1.226
279 HD12 ILE 38 HD12 ILE 38 -7.589 -0.166 -1.999
280 HD13 ILE 38 HD13 ILE 38 -8.290 -1.456 -2.980
281 H GLY 39 HN GLY 39 -13.186 1.629 -0.998
282 HA2 GLY 39 HA2 GLY 39 -13.721 2.691 0.984
283 HA3 GLY 39 HA1 GLY 39 -13.665 1.114 1.754
284 H TYR 40 HN TYR 40 -11.111 2.955 0.153
285 HA TYR 40 HA TYR 40 -9.723 3.132 2.725
286 HB2 TYR 40 HB2 TYR 40 -8.831 1.899 0.236
287 HB3 TYR 40 HB1 TYR 40 -7.703 3.102 0.854
288 HD1 TYR 40 HD1 TYR 40 -6.713 2.844 3.044
289 HD2 TYR 40 HD2 TYR 40 -9.150 -0.207 1.373
290 HE1 TYR 40 HE1 TYR 40 -5.833 1.269 4.687
291 HE2 TYR 40 HE2 TYR 40 -8.264 -1.815 3.025
292 HH TYR 40 HH TYR 40 -6.372 -2.081 4.463
293 H ASP 41 HN ASP 41 -8.992 5.045 3.241
294 HA ASP 41 HA ASP 41 -9.082 7.174 1.195
295 HB2 ASP 41 HB2 ASP 41 -8.874 7.494 4.199
296 HB3 ASP 41 HB1 ASP 41 -9.046 8.789 3.024
297 H SER 42 HN SER 42 -7.379 8.834 1.455
298 HA SER 42 HA SER 42 -4.810 7.802 1.123
299 HB2 SER 42 HB2 SER 42 -4.168 10.219 1.395
300 HB3 SER 42 HB1 SER 42 -5.443 9.914 0.206
301 H LEU 43 HN LEU 43 -6.419 9.230 3.819
302 HA LEU 43 HA LEU 43 -4.376 9.403 5.693
303 HB2 LEU 43 HB2 LEU 43 -7.293 8.805 6.117
304 HB3 LEU 43 HB1 LEU 43 -6.184 9.334 7.362
305 HG LEU 43 HG LEU 43 -6.958 10.947 4.931
306 HD11 LEU 43 HD11 LEU 43 -8.813 10.690 6.471
307 HD12 LEU 43 HD12 LEU 43 -8.185 12.341 6.513
308 HD13 LEU 43 HD13 LEU 43 -7.792 11.213 7.808
309 HD21 LEU 43 HD21 LEU 43 -5.316 11.683 7.357
310 HD22 LEU 43 HD22 LEU 43 -5.808 12.788 6.072
311 HD23 LEU 43 HD23 LEU 43 -4.703 11.461 5.719
312 H ALA 44 HN ALA 44 -6.583 6.727 4.967
313 HA ALA 44 HA ALA 44 -5.479 4.975 6.910
314 HB1 ALA 44 HB1 ALA 44 -7.755 4.704 6.066
315 HB2 ALA 44 HB2 ALA 44 -6.793 3.248 5.804
316 HB3 ALA 44 HB3 ALA 44 -7.118 4.343 4.462
317 H LEU 45 HN LEU 45 -4.858 5.661 3.555
318 HA LEU 45 HA LEU 45 -3.121 3.506 3.042
319 HB2 LEU 45 HB2 LEU 45 -3.284 6.233 1.779
320 HB3 LEU 45 HB1 LEU 45 -2.316 4.910 1.154
321 HG LEU 45 HG LEU 45 -5.308 4.838 1.476
322 HD11 LEU 45 HD11 LEU 45 -5.379 4.989 -0.958
323 HD12 LEU 45 HD12 LEU 45 -3.630 5.216 -0.991
324 HD13 LEU 45 HD13 LEU 45 -4.662 6.431 -0.236
325 HD21 LEU 45 HD21 LEU 45 -3.373 2.942 0.165
326 HD22 LEU 45 HD22 LEU 45 -5.131 2.802 0.134
327 HD23 LEU 45 HD23 LEU 45 -4.260 2.659 1.664
328 H MET 46 HN MET 46 -2.610 6.685 4.397
329 HA MET 46 HA MET 46 0.217 6.564 4.569
330 HB2 MET 46 HB2 MET 46 -1.744 8.000 6.381
331 HB3 MET 46 HB1 MET 46 -0.006 8.235 6.411
332 HG2 MET 46 HG2 MET 46 -0.067 9.155 4.157
333 HG3 MET 46 HG1 MET 46 -1.799 8.802 4.080
334 HE1 MET 46 HE1 MET 46 -0.610 11.685 3.445
335 HE2 MET 46 HE2 MET 46 -1.780 12.709 4.281
336 HE3 MET 46 HE3 MET 46 -2.327 11.295 3.384
337 H GLU 47 HN GLU 47 -2.376 5.444 6.608
338 HA GLU 47 HA GLU 47 -0.869 4.543 8.807
339 HB2 GLU 47 HB2 GLU 47 -3.282 4.841 8.899
340 HB3 GLU 47 HB1 GLU 47 -3.514 3.632 7.660
341 HG2 GLU 47 HG2 GLU 47 -4.118 2.799 9.879
342 HG3 GLU 47 HG1 GLU 47 -2.806 1.876 9.158
343 H THR 48 HN THR 48 -2.049 2.836 5.893
344 HA THR 48 HA THR 48 -0.892 0.354 6.224
345 HB THR 48 HB THR 48 -1.053 1.887 3.607
346 HG1 THR 48 HG1 THR 48 -3.121 0.437 4.958
347 HG21 THR 48 HG21 THR 48 0.040 -0.319 3.500
348 HG22 THR 48 HG22 THR 48 -1.508 -0.332 2.654
349 HG23 THR 48 HG23 THR 48 -1.375 -1.054 4.255
350 H ALA 49 HN ALA 49 0.426 3.195 4.491
351 HA ALA 49 HA ALA 49 2.915 2.174 3.824
352 HB1 ALA 49 HB1 ALA 49 1.964 4.215 2.849
353 HB2 ALA 49 HB2 ALA 49 3.603 4.473 3.448
354 HB3 ALA 49 HB3 ALA 49 2.223 5.057 4.378
355 H ALA 50 HN ALA 50 2.065 4.177 6.654
356 HA ALA 50 HA ALA 50 4.581 4.386 7.813
357 HB1 ALA 50 HB1 ALA 50 3.416 4.883 9.883
358 HB2 ALA 50 HB2 ALA 50 1.925 4.212 9.221
359 HB3 ALA 50 HB3 ALA 50 2.624 5.673 8.518
360 H ARG 51 HN ARG 51 2.155 1.886 8.173
361 HA ARG 51 HA ARG 51 3.508 0.441 10.190
362 HB2 ARG 51 HB2 ARG 51 1.092 0.278 9.710
363 HB3 ARG 51 HB1 ARG 51 1.472 -0.505 8.185
364 HG2 ARG 51 HG2 ARG 51 2.442 -2.377 9.356
365 HG3 ARG 51 HG1 ARG 51 2.148 -1.578 10.908
366 HD2 ARG 51 HD2 ARG 51 -0.249 -1.532 10.401
367 HD3 ARG 51 HD1 ARG 51 0.110 -2.361 8.883
368 HE ARG 51 HE ARG 51 1.127 -4.083 10.494
369 HH11 ARG 51 HH11 ARG 51 -1.801 -2.201 11.046
370 HH12 ARG 51 HH12 ARG 51 -2.660 -3.408 11.867
371 HH21 ARG 51 HH21 ARG 51 -0.028 -5.829 11.633
372 HH22 ARG 51 HH22 ARG 51 -1.634 -5.563 12.169
373 H LEU 52 HN LEU 52 3.241 0.064 6.683
374 HA LEU 52 HA LEU 52 5.004 -2.107 6.505
375 HB2 LEU 52 HB2 LEU 52 4.248 -0.053 4.441
376 HB3 LEU 52 HB1 LEU 52 5.167 -1.504 4.090
377 HG LEU 52 HG LEU 52 2.355 -1.464 5.191
378 HD11 LEU 52 HD11 LEU 52 3.347 -2.125 2.431
379 HD12 LEU 52 HD12 LEU 52 2.478 -0.665 2.892
380 HD13 LEU 52 HD13 LEU 52 1.680 -2.231 2.994
381 HD21 LEU 52 HD21 LEU 52 2.389 -3.869 4.718
382 HD22 LEU 52 HD22 LEU 52 3.612 -3.425 5.906
383 HD23 LEU 52 HD23 LEU 52 4.082 -3.755 4.240
384 H GLU 53 HN GLU 53 5.656 1.361 6.558
385 HA GLU 53 HA GLU 53 8.372 1.305 5.907
386 HB2 GLU 53 HB2 GLU 53 6.973 3.030 7.954
387 HB3 GLU 53 HB1 GLU 53 8.621 3.280 7.415
388 HG2 GLU 53 HG2 GLU 53 7.760 3.669 5.140
389 HG3 GLU 53 HG1 GLU 53 6.118 3.520 5.781
390 H SER 54 HN SER 54 6.733 0.948 8.966
391 HA SER 54 HA SER 54 8.964 0.539 10.624
392 HB2 SER 54 HB2 SER 54 6.681 1.209 11.387
393 HB3 SER 54 HB1 SER 54 6.078 -0.376 10.936
394 HG SER 54 HG SER 54 8.037 0.202 12.917
395 H ARG 55 HN ARG 55 6.752 -1.648 8.983
396 HA ARG 55 HA ARG 55 7.770 -4.055 9.972
397 HB2 ARG 55 HB2 ARG 55 5.521 -3.909 9.189
398 HB3 ARG 55 HB1 ARG 55 6.044 -3.426 7.587
399 HG2 ARG 55 HG2 ARG 55 7.026 -5.637 7.253
400 HG3 ARG 55 HG1 ARG 55 6.487 -6.111 8.864
401 HD2 ARG 55 HD2 ARG 55 4.198 -5.951 8.238
402 HD3 ARG 55 HD1 ARG 55 4.600 -5.139 6.721
403 HE ARG 55 HE ARG 55 5.774 -7.729 7.059
404 HH11 ARG 55 HH11 ARG 55 2.707 -6.206 5.999
405 HH12 ARG 55 HH12 ARG 55 2.561 -7.247 4.665
406 HH21 ARG 55 HH21 ARG 55 5.433 -9.171 5.287
407 HH22 ARG 55 HH22 ARG 55 4.133 -8.944 4.226
408 H TYR 56 HN TYR 56 8.345 -2.476 6.787
409 HA TYR 56 HA TYR 56 10.262 -4.588 6.185
410 HB2 TYR 56 HB2 TYR 56 8.783 -2.648 4.482
411 HB3 TYR 56 HB1 TYR 56 10.302 -3.312 3.889
412 HD1 TYR 56 HD1 TYR 56 6.881 -4.097 4.924
413 HD2 TYR 56 HD2 TYR 56 10.443 -5.627 3.180
414 HE1 TYR 56 HE1 TYR 56 5.646 -6.071 4.176
415 HE2 TYR 56 HE2 TYR 56 9.218 -7.618 2.426
416 HH TYR 56 HH TYR 56 7.189 -8.865 2.913
417 H GLY 57 HN GLY 57 10.358 -1.374 7.273
418 HA2 GLY 57 HA2 GLY 57 12.258 -0.240 7.936
419 HA3 GLY 57 HA1 GLY 57 13.240 -1.453 7.125
420 H VAL 58 HN VAL 58 10.755 0.859 6.130
421 HA VAL 58 HA VAL 58 12.641 1.940 4.181
422 HB VAL 58 HB VAL 58 10.789 2.309 2.531
423 HG11 VAL 58 HG11 VAL 58 11.321 -0.562 3.246
424 HG12 VAL 58 HG12 VAL 58 12.319 0.472 2.215
425 HG13 VAL 58 HG13 VAL 58 10.689 0.014 1.704
426 HG21 VAL 58 HG21 VAL 58 9.232 0.456 4.333
427 HG22 VAL 58 HG22 VAL 58 8.727 0.986 2.729
428 HG23 VAL 58 HG23 VAL 58 8.883 2.159 4.037
429 H SER 59 HN SER 59 11.640 4.067 3.200
430 HA SER 59 HA SER 59 10.361 5.566 5.359
431 HB2 SER 59 HB2 SER 59 12.680 6.509 3.645
432 HB3 SER 59 HB1 SER 59 11.891 7.422 4.933
433 HG SER 59 HG SER 59 12.471 5.453 6.228
434 H ILE 60 HN ILE 60 8.474 6.141 4.574
435 HA ILE 60 HA ILE 60 8.271 7.093 1.791
436 HB ILE 60 HB ILE 60 6.226 5.425 3.294
437 HG12 ILE 60 HG12 ILE 60 7.846 4.733 0.826
438 HG13 ILE 60 HG11 ILE 60 8.169 4.123 2.444
439 HG21 ILE 60 HG21 ILE 60 4.922 5.469 1.209
440 HG22 ILE 60 HG22 ILE 60 6.103 6.573 0.503
441 HG23 ILE 60 HG23 ILE 60 5.138 7.083 1.889
442 HD11 ILE 60 HD11 ILE 60 5.687 3.614 0.816
443 HD12 ILE 60 HD12 ILE 60 5.999 2.998 2.439
444 HD13 ILE 60 HD13 ILE 60 7.007 2.478 1.089
445 HA PRO 61 HA PRO 61 6.866 10.689 4.169
446 HB2 PRO 61 HB2 PRO 61 6.307 11.641 1.405
447 HB3 PRO 61 HB1 PRO 61 7.204 12.433 2.704
448 HG2 PRO 61 HG2 PRO 61 8.492 11.361 0.640
449 HG3 PRO 61 HG1 PRO 61 9.142 11.233 2.284
450 HD2 PRO 61 HD2 PRO 61 7.718 9.171 0.650
451 HD3 PRO 61 HD1 PRO 61 9.108 8.980 1.738
452 H ASP 62 HN ASP 62 4.903 11.589 4.585
453 HA ASP 62 HA ASP 62 2.685 9.841 4.453
454 HB2 ASP 62 HB2 ASP 62 2.694 12.773 5.205
455 HB3 ASP 62 HB1 ASP 62 1.453 11.595 5.610
456 H ASP 63 HN ASP 63 3.453 12.842 2.853
457 HA ASP 63 HA ASP 63 1.104 13.441 1.488
458 HB2 ASP 63 HB2 ASP 63 3.951 13.835 0.534
459 HB3 ASP 63 HB1 ASP 63 2.538 14.626 -0.151
460 H VAL 64 HN VAL 64 3.718 11.326 0.606
461 HA VAL 64 HA VAL 64 3.068 10.696 -2.056
462 HB VAL 64 HB VAL 64 4.400 9.000 0.029
463 HG11 VAL 64 HG11 VAL 64 5.555 7.931 -1.913
464 HG12 VAL 64 HG12 VAL 64 4.600 8.932 -3.005
465 HG13 VAL 64 HG13 VAL 64 3.804 7.726 -1.993
466 HG21 VAL 64 HG21 VAL 64 5.484 11.149 -0.138
467 HG22 VAL 64 HG22 VAL 64 5.604 10.991 -1.891
468 HG23 VAL 64 HG23 VAL 64 6.524 9.912 -0.840
469 H ALA 65 HN ALA 65 2.311 9.069 0.999
470 HA ALA 65 HA ALA 65 0.919 6.892 -0.125
471 HB1 ALA 65 HB1 ALA 65 0.656 8.064 2.638
472 HB2 ALA 65 HB2 ALA 65 1.844 6.861 2.141
473 HB3 ALA 65 HB3 ALA 65 0.125 6.459 2.140
474 H GLY 66 HN GLY 66 -0.016 10.137 0.415
475 HA2 GLY 66 HA2 GLY 66 -2.857 9.566 0.293
476 HA3 GLY 66 HA1 GLY 66 -2.112 11.157 0.361
477 H ARG 67 HN ARG 67 -0.395 9.698 -1.943
478 HA ARG 67 HA ARG 67 -2.092 10.799 -4.072
479 HB2 ARG 67 HB2 ARG 67 0.887 10.498 -3.873
480 HB3 ARG 67 HB1 ARG 67 0.046 11.017 -5.328
481 HG2 ARG 67 HG2 ARG 67 -0.792 12.968 -4.171
482 HG3 ARG 67 HG1 ARG 67 -0.048 12.415 -2.668
483 HD2 ARG 67 HD2 ARG 67 2.149 12.567 -3.702
484 HD3 ARG 67 HD1 ARG 67 1.405 13.105 -5.209
485 HE ARG 67 HE ARG 67 0.493 14.963 -3.706
486 HH11 ARG 67 HH11 ARG 67 3.688 13.461 -3.368
487 HH12 ARG 67 HH12 ARG 67 4.448 14.847 -2.769
488 HH21 ARG 67 HH21 ARG 67 1.579 16.935 -2.953
489 HH22 ARG 67 HH22 ARG 67 3.239 16.880 -2.570
490 H VAL 68 HN VAL 68 -1.442 7.876 -2.858
491 HA VAL 68 HA VAL 68 -0.911 6.633 -5.407
492 HB VAL 68 HB VAL 68 -1.026 4.437 -4.182
493 HG11 VAL 68 HG11 VAL 68 1.032 4.740 -2.883
494 HG12 VAL 68 HG12 VAL 68 0.822 6.487 -2.976
495 HG13 VAL 68 HG13 VAL 68 1.100 5.553 -4.445
496 HG21 VAL 68 HG21 VAL 68 -1.369 6.158 -1.723
497 HG22 VAL 68 HG22 VAL 68 -1.066 4.417 -1.731
498 HG23 VAL 68 HG23 VAL 68 -2.573 5.055 -2.390
499 H ASP 69 HN ASP 69 -2.438 6.691 -6.772
500 HA ASP 69 HA ASP 69 -5.234 6.741 -6.174
501 HB2 ASP 69 HB2 ASP 69 -4.225 7.829 -8.181
502 HB3 ASP 69 HB1 ASP 69 -3.848 6.236 -8.807
503 H THR 70 HN THR 70 -2.978 4.298 -7.320
504 HA THR 70 HA THR 70 -5.058 2.248 -7.042
505 HB THR 70 HB THR 70 -3.911 1.059 -8.885
506 HG1 THR 70 HG1 THR 70 -2.422 2.288 -10.143
507 HG21 THR 70 HG21 THR 70 -4.673 2.515 -10.729
508 HG22 THR 70 HG22 THR 70 -4.785 3.865 -9.594
509 HG23 THR 70 HG23 THR 70 -5.851 2.474 -9.413
510 HA PRO 71 HA PRO 71 -2.031 0.079 -4.513
511 HB2 PRO 71 HB2 PRO 71 -2.861 -2.396 -5.930
512 HB3 PRO 71 HB1 PRO 71 -2.895 -2.030 -4.200
513 HG2 PRO 71 HG2 PRO 71 -5.147 -2.101 -5.586
514 HG3 PRO 71 HG1 PRO 71 -4.889 -0.842 -4.358
515 HD2 PRO 71 HD2 PRO 71 -4.594 -0.667 -7.339
516 HD3 PRO 71 HD1 PRO 71 -5.402 0.459 -6.230
517 H ARG 72 HN ARG 72 -2.143 -0.166 -7.969
518 HA ARG 72 HA ARG 72 0.327 -1.465 -8.371
519 HB2 ARG 72 HB2 ARG 72 -1.134 -1.329 -10.231
520 HB3 ARG 72 HB1 ARG 72 -1.305 0.408 -10.069
521 HG2 ARG 72 HG2 ARG 72 0.773 0.821 -11.048
522 HG3 ARG 72 HG1 ARG 72 1.336 -0.830 -10.762
523 HD2 ARG 72 HD2 ARG 72 -0.935 -0.108 -12.611
524 HD3 ARG 72 HD1 ARG 72 0.734 -0.369 -13.141
525 HE ARG 72 HE ARG 72 0.409 -2.576 -11.882
526 HH11 ARG 72 HH11 ARG 72 -2.130 -1.036 -13.877
527 HH12 ARG 72 HH12 ARG 72 -2.851 -2.498 -14.329
528 HH21 ARG 72 HH21 ARG 72 -0.556 -4.571 -12.546
529 HH22 ARG 72 HH22 ARG 72 -1.923 -4.602 -13.546
530 H GLU 73 HN GLU 73 -0.555 1.923 -8.034
531 HA GLU 73 HA GLU 73 2.022 3.044 -8.332
532 HB2 GLU 73 HB2 GLU 73 -0.139 4.303 -8.420
533 HB3 GLU 73 HB1 GLU 73 -0.334 4.036 -6.697
534 HG2 GLU 73 HG2 GLU 73 0.438 6.250 -7.019
535 HG3 GLU 73 HG1 GLU 73 1.774 5.334 -6.335
536 H LEU 74 HN LEU 74 0.135 1.958 -5.595
537 HA LEU 74 HA LEU 74 1.913 2.631 -3.516
538 HB2 LEU 74 HB2 LEU 74 -0.576 2.074 -3.397
539 HB3 LEU 74 HB1 LEU 74 -0.135 0.395 -3.534
540 HG LEU 74 HG LEU 74 0.700 2.170 -1.216
541 HD11 LEU 74 HD11 LEU 74 -1.718 1.999 -1.316
542 HD12 LEU 74 HD12 LEU 74 -1.077 1.072 0.040
543 HD13 LEU 74 HD13 LEU 74 -1.601 0.242 -1.425
544 HD21 LEU 74 HD21 LEU 74 1.126 0.056 -0.069
545 HD22 LEU 74 HD22 LEU 74 2.100 0.166 -1.538
546 HD23 LEU 74 HD23 LEU 74 0.650 -0.835 -1.514
547 H LEU 75 HN LEU 75 1.399 -0.438 -5.272
548 HA LEU 75 HA LEU 75 3.313 -2.017 -4.007
549 HB2 LEU 75 HB2 LEU 75 1.640 -2.930 -5.541
550 HB3 LEU 75 HB1 LEU 75 2.389 -2.097 -6.886
551 HG LEU 75 HG LEU 75 4.445 -3.528 -6.519
552 HD11 LEU 75 HD11 LEU 75 4.233 -5.543 -5.212
553 HD12 LEU 75 HD12 LEU 75 2.643 -5.029 -4.656
554 HD13 LEU 75 HD13 LEU 75 4.075 -4.103 -4.206
555 HD21 LEU 75 HD21 LEU 75 2.820 -4.051 -8.258
556 HD22 LEU 75 HD22 LEU 75 1.862 -4.969 -7.097
557 HD23 LEU 75 HD23 LEU 75 3.476 -5.523 -7.542
558 H ASP 76 HN ASP 76 3.558 -0.058 -6.940
559 HA ASP 76 HA ASP 76 6.190 -0.684 -7.631
560 HB2 ASP 76 HB2 ASP 76 4.628 0.504 -9.123
561 HB3 ASP 76 HB1 ASP 76 4.737 1.926 -8.091
562 H LEU 77 HN LEU 77 4.926 1.928 -5.666
563 HA LEU 77 HA LEU 77 7.216 3.354 -5.068
564 HB2 LEU 77 HB2 LEU 77 5.008 4.100 -4.477
565 HB3 LEU 77 HB1 LEU 77 4.790 2.742 -3.399
566 HG LEU 77 HG LEU 77 6.581 3.671 -1.950
567 HD11 LEU 77 HD11 LEU 77 6.389 6.062 -3.775
568 HD12 LEU 77 HD12 LEU 77 7.781 4.994 -3.593
569 HD13 LEU 77 HD13 LEU 77 7.254 5.993 -2.239
570 HD21 LEU 77 HD21 LEU 77 4.219 5.460 -2.493
571 HD22 LEU 77 HD22 LEU 77 5.184 5.444 -1.017
572 HD23 LEU 77 HD23 LEU 77 4.229 4.030 -1.460
573 H ILE 78 HN ILE 78 5.728 0.817 -3.114
574 HA ILE 78 HA ILE 78 7.852 0.706 -1.250
575 HB ILE 78 HB ILE 78 5.560 -1.194 -1.755
576 HG12 ILE 78 HG12 ILE 78 6.007 1.010 0.268
577 HG13 ILE 78 HG11 ILE 78 4.893 1.045 -1.090
578 HG21 ILE 78 HG21 ILE 78 7.492 -1.118 0.579
579 HG22 ILE 78 HG22 ILE 78 7.368 -2.390 -0.643
580 HG23 ILE 78 HG23 ILE 78 6.038 -2.119 0.477
581 HD11 ILE 78 HD11 ILE 78 3.737 0.663 0.990
582 HD12 ILE 78 HD12 ILE 78 4.737 -0.750 1.305
583 HD13 ILE 78 HD13 ILE 78 3.607 -0.756 -0.054
584 H ASN 79 HN ASN 79 6.871 -1.501 -3.852
585 HA ASN 79 HA ASN 79 8.787 -3.493 -3.385
586 HB2 ASN 79 HB2 ASN 79 6.752 -3.644 -4.874
587 HB3 ASN 79 HB1 ASN 79 7.653 -2.736 -6.079
588 HD21 ASN 79 HD21 ASN 79 7.189 -5.746 -4.522
589 HD22 ASN 79 HD22 ASN 79 8.242 -6.673 -5.492
590 H GLY 80 HN GLY 80 8.880 -0.630 -5.479
591 HA2 GLY 80 HA2 GLY 80 11.427 -1.116 -6.597
592 HA3 GLY 80 HA1 GLY 80 10.607 0.437 -6.534
593 H ALA 81 HN ALA 81 10.381 0.530 -3.677
594 HA ALA 81 HA ALA 81 12.930 1.631 -3.043
595 HB1 ALA 81 HB1 ALA 81 10.565 1.087 -1.241
596 HB2 ALA 81 HB2 ALA 81 10.846 2.576 -2.143
597 HB3 ALA 81 HB3 ALA 81 11.950 2.107 -0.850
598 H LEU 82 HN LEU 82 11.229 -1.319 -2.308
599 HA LEU 82 HA LEU 82 12.936 -2.317 -0.307
600 HB2 LEU 82 HB2 LEU 82 11.038 -3.693 -2.171
601 HB3 LEU 82 HB1 LEU 82 11.933 -4.539 -0.928
602 HG LEU 82 HG LEU 82 9.921 -2.345 -0.461
603 HD11 LEU 82 HD11 LEU 82 8.550 -4.145 0.467
604 HD12 LEU 82 HD12 LEU 82 9.778 -5.321 -0.005
605 HD13 LEU 82 HD13 LEU 82 8.905 -4.414 -1.237
606 HD21 LEU 82 HD21 LEU 82 11.679 -2.359 1.228
607 HD22 LEU 82 HD22 LEU 82 11.439 -4.089 1.474
608 HD23 LEU 82 HD23 LEU 82 10.161 -2.954 1.901
609 H ALA 83 HN ALA 83 13.378 -2.130 -3.678
610 HA ALA 83 HA ALA 83 15.204 -4.323 -3.893
611 HB1 ALA 83 HB1 ALA 83 14.839 -1.941 -5.711
612 HB2 ALA 83 HB2 ALA 83 13.969 -3.471 -5.831
613 HB3 ALA 83 HB3 ALA 83 15.711 -3.422 -6.107
614 H GLU 84 HN GLU 84 15.413 -1.429 -2.394
615 HA GLU 84 HA GLU 84 18.360 -1.494 -2.361
616 HB2 GLU 84 HB2 GLU 84 17.570 0.531 -3.532
617 HB3 GLU 84 HB1 GLU 84 16.535 0.925 -2.169
618 HG2 GLU 84 HG2 GLU 84 18.423 2.334 -2.035
619 HG3 GLU 84 HG1 GLU 84 18.602 1.124 -0.772
620 H ALA 85 HN ALA 85 15.460 -0.325 -0.696
621 HA ALA 85 HA ALA 85 14.852 -0.042 1.389
622 HB1 ALA 85 HB1 ALA 85 15.066 -1.927 2.916
623 HB2 ALA 85 HB2 ALA 85 16.358 -2.611 1.930
624 HB3 ALA 85 HB3 ALA 85 14.718 -2.510 1.288
625 H ALA 86 HN ALA 86 16.227 1.821 1.306
626 HA ALA 86 HA ALA 86 18.067 1.793 3.548
627 HB1 ALA 86 HB1 ALA 86 18.658 3.035 0.850
628 HB2 ALA 86 HB2 ALA 86 19.470 1.629 1.536
629 HB3 ALA 86 HB3 ALA 86 19.647 3.210 2.298
630 H28 SXV 87 H28A SXV 87 -5.751 13.915 2.866
631 H28A SXV 87 H28B SXV 87 -4.463 12.711 2.809
632 H30 SXV 87 H30C SXV 87 -4.094 15.400 3.887
633 H30A SXV 87 H30A SXV 87 -2.588 15.789 3.058
634 H30B SXV 87 H30B SXV 87 -2.850 14.164 3.693
635 H31 SXV 87 H31C SXV 87 -2.189 14.859 0.686
636 H31A SXV 87 H31A SXV 87 -3.249 13.548 0.158
637 H31B SXV 87 H31B SXV 87 -2.230 13.341 1.577
638 H32 SXV 87 H32A SXV 87 -3.919 16.610 0.970
639 HO33 SXV 87 H33A SXV 87 -6.397 16.376 1.752
640 HN36 SXV 87 H36A SXV 87 -4.003 14.988 -1.033
641 H37 SXV 87 H37B SXV 87 -5.787 15.591 -2.868
642 H37A SXV 87 H37A SXV 87 -6.685 14.370 -1.969
643 H38 SXV 87 H38B SXV 87 -4.883 12.753 -2.371
644 H38A SXV 87 H38A SXV 87 -4.004 13.963 -3.293
645 HN41 SXV 87 H41A SXV 87 -7.043 14.663 -4.069
646 H42 SXV 87 H42B SXV 87 -8.198 12.779 -5.614
647 H42A SXV 87 H42A SXV 87 -7.002 13.518 -6.674
648 H43 SXV 87 H43B SXV 87 -7.990 15.655 -6.340
649 H43A SXV 87 H43A SXV 87 -9.307 14.560 -6.724
650 H1 SXV 87 H1B SXV 87 -10.964 13.588 -4.887
651 H1A SXV 87 H1A SXV 87 -9.581 12.943 -3.986
652 H2 SXV 87 H2A SXV 87 -11.634 12.895 -2.708
653 H2A SXV 87 H2B SXV 87 -11.676 14.662 -2.727
654 H4 SXV 87 H4C SXV 87 -9.094 12.201 -0.629
655 H4A SXV 87 H4A SXV 87 -10.774 11.860 -1.059
656 H4B SXV 87 H4B SXV 87 -10.407 12.876 0.343
Start of MODEL 8
1 H1 MET 1 HT1 MET 1 20.770 -10.665 -1.779
2 H2 MET 1 HT2 MET 1 19.581 -10.094 -0.678
3 H3 MET 1 HT3 MET 1 20.674 -9.032 -1.337
4 HA MET 1 HA MET 1 19.770 -9.290 -3.511
5 HB2 MET 1 HB2 MET 1 17.787 -10.677 -3.889
6 HB3 MET 1 HB1 MET 1 19.089 -11.679 -3.267
7 HG2 MET 1 HG2 MET 1 18.071 -11.616 -1.042
8 HG3 MET 1 HG1 MET 1 16.777 -10.598 -1.662
9 HE1 MET 1 HE1 MET 1 18.434 -14.155 -1.726
10 HE2 MET 1 HE2 MET 1 18.498 -13.689 -3.426
11 HE3 MET 1 HE3 MET 1 17.438 -15.000 -2.910
12 H ALA 2 HN ALA 2 17.838 -8.086 -4.129
13 HA ALA 2 HA ALA 2 16.876 -6.457 -1.926
14 HB1 ALA 2 HB1 ALA 2 15.854 -5.067 -3.678
15 HB2 ALA 2 HB2 ALA 2 16.352 -6.239 -4.896
16 HB3 ALA 2 HB3 ALA 2 17.568 -5.330 -4.002
17 H THR 3 HN THR 3 15.328 -7.447 -0.789
18 HA THR 3 HA THR 3 13.595 -9.371 -1.910
19 HB THR 3 HB THR 3 12.660 -9.093 0.508
20 HG1 THR 3 HG1 THR 3 13.575 -7.577 1.611
21 HG21 THR 3 HG21 THR 3 14.081 -10.961 -0.219
22 HG22 THR 3 HG22 THR 3 14.526 -10.427 1.403
23 HG23 THR 3 HG23 THR 3 15.514 -9.961 0.018
24 H LEU 4 HN LEU 4 12.028 -8.651 -3.204
25 HA LEU 4 HA LEU 4 10.675 -6.128 -2.575
26 HB2 LEU 4 HB2 LEU 4 10.510 -7.820 -5.074
27 HB3 LEU 4 HB1 LEU 4 9.827 -6.224 -4.853
28 HG LEU 4 HG LEU 4 12.767 -6.892 -4.948
29 HD11 LEU 4 HD11 LEU 4 12.758 -5.641 -7.042
30 HD12 LEU 4 HD12 LEU 4 11.007 -5.455 -6.921
31 HD13 LEU 4 HD13 LEU 4 11.714 -7.060 -7.117
32 HD21 LEU 4 HD21 LEU 4 13.127 -4.471 -4.928
33 HD22 LEU 4 HD22 LEU 4 12.339 -5.021 -3.449
34 HD23 LEU 4 HD23 LEU 4 11.397 -4.216 -4.702
35 H LEU 5 HN LEU 5 8.529 -6.126 -2.036
36 HA LEU 5 HA LEU 5 7.410 -8.706 -1.466
37 HB2 LEU 5 HB2 LEU 5 5.536 -7.468 -0.366
38 HB3 LEU 5 HB1 LEU 5 7.107 -7.139 0.310
39 HG LEU 5 HG LEU 5 7.059 -4.938 -0.992
40 HD11 LEU 5 HD11 LEU 5 4.140 -5.626 -1.279
41 HD12 LEU 5 HD12 LEU 5 5.303 -5.468 -2.594
42 HD13 LEU 5 HD13 LEU 5 4.877 -4.060 -1.619
43 HD21 LEU 5 HD21 LEU 5 5.643 -3.848 0.667
44 HD22 LEU 5 HD22 LEU 5 6.690 -5.068 1.395
45 HD23 LEU 5 HD23 LEU 5 4.982 -5.416 1.128
46 H THR 6 HN THR 6 5.386 -9.439 -2.190
47 HA THR 6 HA THR 6 5.095 -8.740 -4.982
48 HB THR 6 HB THR 6 3.741 -10.820 -5.110
49 HG1 THR 6 HG1 THR 6 4.412 -11.034 -2.324
50 HG21 THR 6 HG21 THR 6 6.428 -11.164 -3.759
51 HG22 THR 6 HG22 THR 6 6.168 -10.930 -5.487
52 HG23 THR 6 HG23 THR 6 5.591 -12.399 -4.698
53 H THR 7 HN THR 7 2.600 -9.316 -5.620
54 HA THR 7 HA THR 7 1.063 -7.132 -4.700
55 HB THR 7 HB THR 7 0.177 -9.589 -6.259
56 HG1 THR 7 HG1 THR 7 1.884 -8.639 -7.356
57 HG21 THR 7 HG21 THR 7 -1.660 -8.206 -5.448
58 HG22 THR 7 HG22 THR 7 -1.498 -8.041 -7.199
59 HG23 THR 7 HG23 THR 7 -0.895 -6.774 -6.128
60 H ASP 8 HN ASP 8 1.137 -10.602 -4.113
61 HA ASP 8 HA ASP 8 -1.119 -10.910 -2.506
62 HB2 ASP 8 HB2 ASP 8 0.244 -12.755 -3.486
63 HB3 ASP 8 HB1 ASP 8 1.499 -12.407 -2.306
64 H ASP 9 HN ASP 9 2.251 -10.191 -1.640
65 HA ASP 9 HA ASP 9 1.956 -10.055 1.170
66 HB2 ASP 9 HB2 ASP 9 3.849 -8.439 -0.573
67 HB3 ASP 9 HB1 ASP 9 3.920 -8.484 1.174
68 H LEU 10 HN LEU 10 1.693 -7.549 -1.298
69 HA LEU 10 HA LEU 10 1.120 -5.395 0.391
70 HB2 LEU 10 HB2 LEU 10 1.776 -5.131 -1.954
71 HB3 LEU 10 HB1 LEU 10 0.259 -5.838 -2.467
72 HG LEU 10 HG LEU 10 -0.936 -3.925 -1.420
73 HD11 LEU 10 HD11 LEU 10 1.833 -2.804 -1.064
74 HD12 LEU 10 HD12 LEU 10 0.718 -3.278 0.219
75 HD13 LEU 10 HD13 LEU 10 0.325 -1.918 -0.836
76 HD21 LEU 10 HD21 LEU 10 -0.357 -2.306 -3.160
77 HD22 LEU 10 HD22 LEU 10 -0.462 -3.943 -3.805
78 HD23 LEU 10 HD23 LEU 10 1.114 -3.209 -3.510
79 H ARG 11 HN ARG 11 -1.024 -7.713 -1.191
80 HA ARG 11 HA ARG 11 -3.512 -6.591 -0.559
81 HB2 ARG 11 HB2 ARG 11 -3.136 -8.570 -2.028
82 HB3 ARG 11 HB1 ARG 11 -2.846 -9.531 -0.583
83 HG2 ARG 11 HG2 ARG 11 -5.190 -8.698 0.144
84 HG3 ARG 11 HG1 ARG 11 -5.395 -8.323 -1.567
85 HD2 ARG 11 HD2 ARG 11 -6.246 -10.524 -1.123
86 HD3 ARG 11 HD1 ARG 11 -4.780 -10.655 -2.100
87 HE ARG 11 HE ARG 11 -4.833 -11.017 0.808
88 HH11 ARG 11 HH11 ARG 11 -3.814 -12.097 -2.418
89 HH12 ARG 11 HH12 ARG 11 -2.704 -13.257 -1.809
90 HH21 ARG 11 HH21 ARG 11 -3.352 -12.657 1.604
91 HH22 ARG 11 HH22 ARG 11 -2.475 -13.616 0.499
92 H ARG 12 HN ARG 12 -1.459 -8.778 1.243
93 HA ARG 12 HA ARG 12 -3.150 -9.238 3.479
94 HB2 ARG 12 HB2 ARG 12 -0.135 -9.095 3.566
95 HB3 ARG 12 HB1 ARG 12 -1.187 -9.986 4.646
96 HG2 ARG 12 HG2 ARG 12 -1.733 -11.532 2.871
97 HG3 ARG 12 HG1 ARG 12 -0.759 -10.591 1.734
98 HD2 ARG 12 HD2 ARG 12 1.181 -10.960 3.334
99 HD3 ARG 12 HD1 ARG 12 0.164 -12.162 4.126
100 HE ARG 12 HE ARG 12 0.271 -12.671 1.346
101 HH11 ARG 12 HH11 ARG 12 2.260 -13.097 4.267
102 HH12 ARG 12 HH12 ARG 12 3.300 -14.207 3.479
103 HH21 ARG 12 HH21 ARG 12 1.600 -14.148 0.416
104 HH22 ARG 12 HH22 ARG 12 2.911 -14.872 1.244
105 H ALA 13 HN ALA 13 -0.501 -6.991 2.938
106 HA ALA 13 HA ALA 13 -0.502 -5.716 5.417
107 HB1 ALA 13 HB1 ALA 13 0.447 -4.696 2.769
108 HB2 ALA 13 HB2 ALA 13 1.353 -5.742 3.865
109 HB3 ALA 13 HB3 ALA 13 0.927 -4.104 4.358
110 H LEU 14 HN LEU 14 -2.200 -4.940 2.441
111 HA LEU 14 HA LEU 14 -3.024 -2.351 3.128
112 HB2 LEU 14 HB2 LEU 14 -3.117 -3.453 0.847
113 HB3 LEU 14 HB1 LEU 14 -4.541 -4.306 1.396
114 HG LEU 14 HG LEU 14 -5.695 -2.130 1.704
115 HD11 LEU 14 HD11 LEU 14 -3.740 -0.734 2.096
116 HD12 LEU 14 HD12 LEU 14 -4.697 -0.111 0.754
117 HD13 LEU 14 HD13 LEU 14 -3.206 -0.995 0.436
118 HD21 LEU 14 HD21 LEU 14 -5.985 -1.644 -0.679
119 HD22 LEU 14 HD22 LEU 14 -5.959 -3.383 -0.376
120 HD23 LEU 14 HD23 LEU 14 -4.538 -2.584 -1.045
121 H VAL 15 HN VAL 15 -4.496 -5.508 3.700
122 HA VAL 15 HA VAL 15 -6.860 -4.489 4.899
123 HB VAL 15 HB VAL 15 -5.603 -7.245 5.212
124 HG11 VAL 15 HG11 VAL 15 -7.838 -8.001 5.901
125 HG12 VAL 15 HG12 VAL 15 -8.420 -6.337 5.832
126 HG13 VAL 15 HG13 VAL 15 -7.197 -6.793 7.016
127 HG21 VAL 15 HG21 VAL 15 -7.783 -6.278 3.366
128 HG22 VAL 15 HG22 VAL 15 -7.232 -7.947 3.526
129 HG23 VAL 15 HG23 VAL 15 -6.137 -6.713 2.902
130 H GLU 16 HN GLU 16 -3.667 -5.191 6.065
131 HA GLU 16 HA GLU 16 -4.196 -5.114 8.849
132 HB2 GLU 16 HB2 GLU 16 -1.553 -4.426 7.477
133 HB3 GLU 16 HB1 GLU 16 -1.823 -4.753 9.162
134 HG2 GLU 16 HG2 GLU 16 -2.520 -7.015 8.716
135 HG3 GLU 16 HG1 GLU 16 -2.306 -6.753 6.987
136 H SER 17 HN SER 17 -4.285 -2.696 6.544
137 HA SER 17 HA SER 17 -3.566 -0.545 8.373
138 HB2 SER 17 HB2 SER 17 -4.677 -0.336 5.599
139 HB3 SER 17 HB1 SER 17 -3.687 0.836 6.476
140 HG SER 17 HG SER 17 -2.600 -1.708 6.123
141 H ALA 18 HN ALA 18 -6.329 -2.179 7.059
142 HA ALA 18 HA ALA 18 -8.149 -0.068 7.881
143 HB1 ALA 18 HB1 ALA 18 -9.877 -1.388 6.771
144 HB2 ALA 18 HB2 ALA 18 -8.709 -2.674 6.467
145 HB3 ALA 18 HB3 ALA 18 -8.512 -1.103 5.691
146 H GLY 19 HN GLY 19 -7.518 -3.507 8.488
147 HA2 GLY 19 HA2 GLY 19 -7.613 -4.531 10.568
148 HA3 GLY 19 HA1 GLY 19 -8.466 -3.130 11.206
149 H GLU 20 HN GLU 20 -10.634 -2.780 10.146
150 HA GLU 20 HA GLU 20 -12.051 -5.325 10.214
151 HB2 GLU 20 HB2 GLU 20 -12.810 -3.553 11.752
152 HB3 GLU 20 HB1 GLU 20 -13.137 -2.511 10.375
153 HG2 GLU 20 HG2 GLU 20 -14.850 -4.029 9.598
154 HG3 GLU 20 HG1 GLU 20 -14.486 -5.143 10.917
155 H THR 21 HN THR 21 -11.900 -6.153 8.282
156 HA THR 21 HA THR 21 -13.098 -4.709 6.055
157 HB THR 21 HB THR 21 -10.683 -6.549 5.954
158 HG1 THR 21 HG1 THR 21 -10.957 -3.731 5.668
159 HG21 THR 21 HG21 THR 21 -11.953 -4.827 3.809
160 HG22 THR 21 HG22 THR 21 -12.040 -6.587 3.897
161 HG23 THR 21 HG23 THR 21 -10.490 -5.793 3.617
162 H ASP 22 HN ASP 22 -14.948 -5.729 6.550
163 HA ASP 22 HA ASP 22 -15.205 -8.423 7.284
164 HB2 ASP 22 HB2 ASP 22 -17.669 -7.975 7.109
165 HB3 ASP 22 HB1 ASP 22 -16.777 -6.857 8.135
166 H GLY 23 HN GLY 23 -17.166 -7.257 4.536
167 HA2 GLY 23 HA2 GLY 23 -16.619 -9.836 3.267
168 HA3 GLY 23 HA1 GLY 23 -18.005 -8.800 2.959
169 H THR 24 HN THR 24 -14.943 -7.357 3.148
170 HA THR 24 HA THR 24 -15.059 -6.716 0.325
171 HB THR 24 HB THR 24 -13.173 -5.697 2.475
172 HG1 THR 24 HG1 THR 24 -15.726 -4.895 1.568
173 HG21 THR 24 HG21 THR 24 -13.925 -4.572 -0.241
174 HG22 THR 24 HG22 THR 24 -12.382 -5.328 0.161
175 HG23 THR 24 HG23 THR 24 -12.844 -3.806 0.923
176 H ASP 25 HN ASP 25 -14.403 -8.632 -0.614
177 HA ASP 25 HA ASP 25 -11.985 -9.937 0.251
178 HB2 ASP 25 HB2 ASP 25 -13.726 -10.481 -2.171
179 HB3 ASP 25 HB1 ASP 25 -12.337 -11.451 -1.696
180 H LEU 26 HN LEU 26 -10.050 -9.713 -0.549
181 HA LEU 26 HA LEU 26 -9.722 -7.658 -2.628
182 HB2 LEU 26 HB2 LEU 26 -9.197 -7.147 -0.181
183 HB3 LEU 26 HB1 LEU 26 -7.865 -8.264 -0.343
184 HG LEU 26 HG LEU 26 -6.935 -6.822 -2.123
185 HD11 LEU 26 HD11 LEU 26 -7.815 -4.531 -2.336
186 HD12 LEU 26 HD12 LEU 26 -9.142 -4.947 -1.254
187 HD13 LEU 26 HD13 LEU 26 -9.008 -5.732 -2.828
188 HD21 LEU 26 HD21 LEU 26 -6.143 -5.085 -0.586
189 HD22 LEU 26 HD22 LEU 26 -6.172 -6.677 0.181
190 HD23 LEU 26 HD23 LEU 26 -7.439 -5.502 0.537
191 H SER 27 HN SER 27 -9.303 -10.860 -1.830
192 HA SER 27 HA SER 27 -6.760 -11.421 -2.993
193 HB2 SER 27 HB2 SER 27 -9.081 -13.266 -2.418
194 HB3 SER 27 HB1 SER 27 -7.433 -13.768 -2.793
195 HG SER 27 HG SER 27 -8.287 -12.239 -0.553
196 H GLY 28 HN GLY 28 -6.222 -12.024 -5.010
197 HA2 GLY 28 HA2 GLY 28 -6.968 -13.196 -7.080
198 HA3 GLY 28 HA1 GLY 28 -8.381 -12.146 -7.026
199 H ASP 29 HN ASP 29 -8.273 -10.134 -7.848
200 HA ASP 29 HA ASP 29 -5.647 -9.055 -8.488
201 HB2 ASP 29 HB2 ASP 29 -6.444 -10.097 -10.598
202 HB3 ASP 29 HB1 ASP 29 -7.923 -9.145 -10.496
203 H PHE 30 HN PHE 30 -5.673 -7.449 -7.187
204 HA PHE 30 HA PHE 30 -8.067 -5.726 -7.098
205 HB2 PHE 30 HB2 PHE 30 -7.647 -5.265 -4.798
206 HB3 PHE 30 HB1 PHE 30 -7.544 -7.010 -4.972
207 HD1 PHE 30 HD2 PHE 30 -5.217 -8.056 -5.089
208 HD2 PHE 30 HD1 PHE 30 -5.876 -4.024 -3.911
209 HE1 PHE 30 HE2 PHE 30 -2.990 -7.985 -4.063
210 HE2 PHE 30 HE1 PHE 30 -3.647 -3.952 -2.883
211 HZ PHE 30 HZ PHE 30 -2.202 -5.936 -2.959
212 H LEU 31 HN LEU 31 -4.892 -5.962 -8.171
213 HA LEU 31 HA LEU 31 -3.703 -3.695 -7.230
214 HB2 LEU 31 HB2 LEU 31 -2.857 -5.865 -8.333
215 HB3 LEU 31 HB1 LEU 31 -3.172 -5.023 -9.841
216 HG LEU 31 HG LEU 31 -1.821 -3.254 -9.123
217 HD11 LEU 31 HD11 LEU 31 -0.177 -3.637 -7.234
218 HD12 LEU 31 HD12 LEU 31 -1.054 -5.114 -6.846
219 HD13 LEU 31 HD13 LEU 31 -1.856 -3.550 -6.702
220 HD21 LEU 31 HD21 LEU 31 0.366 -4.392 -9.493
221 HD22 LEU 31 HD22 LEU 31 -0.905 -4.899 -10.607
222 HD23 LEU 31 HD23 LEU 31 -0.457 -5.933 -9.251
223 H ASP 32 HN ASP 32 -6.206 -4.083 -9.482
224 HA ASP 32 HA ASP 32 -5.629 -1.528 -10.817
225 HB2 ASP 32 HB2 ASP 32 -5.868 -3.560 -12.242
226 HB3 ASP 32 HB1 ASP 32 -7.523 -3.729 -11.674
227 H LEU 33 HN LEU 33 -7.433 -2.642 -8.228
228 HA LEU 33 HA LEU 33 -9.842 -1.290 -9.011
229 HB2 LEU 33 HB2 LEU 33 -10.828 -1.919 -6.811
230 HB3 LEU 33 HB1 LEU 33 -10.332 -3.260 -7.801
231 HG LEU 33 HG LEU 33 -8.357 -3.574 -6.314
232 HD11 LEU 33 HD11 LEU 33 -8.120 -1.307 -5.451
233 HD12 LEU 33 HD12 LEU 33 -8.290 -2.479 -4.142
234 HD13 LEU 33 HD13 LEU 33 -9.658 -1.464 -4.604
235 HD21 LEU 33 HD21 LEU 33 -9.626 -4.496 -4.443
236 HD22 LEU 33 HD22 LEU 33 -10.382 -4.859 -5.994
237 HD23 LEU 33 HD23 LEU 33 -11.045 -3.591 -4.964
238 H ARG 34 HN ARG 34 -10.963 0.056 -7.126
239 HA ARG 34 HA ARG 34 -9.124 2.316 -6.903
240 HB2 ARG 34 HB2 ARG 34 -12.147 2.266 -7.011
241 HB3 ARG 34 HB1 ARG 34 -11.147 3.708 -6.909
242 HG2 ARG 34 HG2 ARG 34 -11.217 1.745 -9.190
243 HG3 ARG 34 HG1 ARG 34 -11.917 3.366 -9.174
244 HD2 ARG 34 HD2 ARG 34 -8.991 2.759 -8.797
245 HD3 ARG 34 HD1 ARG 34 -9.717 3.230 -10.344
246 HE ARG 34 HE ARG 34 -10.315 5.114 -8.341
247 HH11 ARG 34 HH11 ARG 34 -7.751 4.048 -10.541
248 HH12 ARG 34 HH12 ARG 34 -6.763 5.418 -10.292
249 HH21 ARG 34 HH21 ARG 34 -8.961 7.072 -8.056
250 HH22 ARG 34 HH22 ARG 34 -7.463 7.140 -8.900
251 H PHE 35 HN PHE 35 -8.899 3.342 -4.938
252 HA PHE 35 HA PHE 35 -9.533 1.816 -2.620
253 HB2 PHE 35 HB2 PHE 35 -8.298 4.556 -2.875
254 HB3 PHE 35 HB1 PHE 35 -8.424 3.643 -1.372
255 HD1 PHE 35 HD2 PHE 35 -7.401 1.245 -1.439
256 HD2 PHE 35 HD1 PHE 35 -6.379 4.367 -4.143
257 HE1 PHE 35 HE2 PHE 35 -5.280 0.117 -1.951
258 HE2 PHE 35 HE1 PHE 35 -4.309 3.254 -4.670
259 HZ PHE 35 HZ PHE 35 -3.719 1.125 -3.562
260 H GLU 36 HN GLU 36 -10.931 4.564 -4.198
261 HA GLU 36 HA GLU 36 -12.518 5.667 -2.172
262 HB2 GLU 36 HB2 GLU 36 -12.138 6.479 -4.557
263 HB3 GLU 36 HB1 GLU 36 -13.310 5.273 -5.056
264 HG2 GLU 36 HG2 GLU 36 -14.477 7.289 -4.938
265 HG3 GLU 36 HG1 GLU 36 -14.931 6.399 -3.485
266 H ASP 37 HN ASP 37 -13.003 3.048 -4.407
267 HA ASP 37 HA ASP 37 -15.717 2.511 -3.809
268 HB2 ASP 37 HB2 ASP 37 -14.745 2.022 -5.974
269 HB3 ASP 37 HB1 ASP 37 -13.651 0.857 -5.241
270 H ILE 38 HN ILE 38 -12.716 1.341 -2.486
271 HA ILE 38 HA ILE 38 -14.211 -0.726 -1.069
272 HB ILE 38 HB ILE 38 -12.039 -1.734 -0.439
273 HG12 ILE 38 HG12 ILE 38 -10.861 0.336 -2.321
274 HG13 ILE 38 HG11 ILE 38 -10.679 0.352 -0.574
275 HG21 ILE 38 HG21 ILE 38 -13.255 -2.527 -2.369
276 HG22 ILE 38 HG22 ILE 38 -11.519 -2.580 -2.710
277 HG23 ILE 38 HG23 ILE 38 -12.519 -1.276 -3.368
278 HD11 ILE 38 HD11 ILE 38 -9.457 -1.761 -0.687
279 HD12 ILE 38 HD12 ILE 38 -8.690 -0.508 -1.666
280 HD13 ILE 38 HD13 ILE 38 -9.648 -1.773 -2.440
281 H GLY 39 HN GLY 39 -13.758 2.252 -0.476
282 HA2 GLY 39 HA2 GLY 39 -14.035 3.471 1.492
283 HA3 GLY 39 HA1 GLY 39 -14.112 1.941 2.352
284 H TYR 40 HN TYR 40 -11.524 3.419 0.430
285 HA TYR 40 HA TYR 40 -9.847 3.439 2.840
286 HB2 TYR 40 HB2 TYR 40 -9.263 2.517 0.075
287 HB3 TYR 40 HB1 TYR 40 -7.985 3.311 0.973
288 HD1 TYR 40 HD2 TYR 40 -10.420 0.488 1.258
289 HD2 TYR 40 HD1 TYR 40 -6.642 2.087 2.330
290 HE1 TYR 40 HE2 TYR 40 -9.808 -1.663 2.289
291 HE2 TYR 40 HE1 TYR 40 -6.006 -0.007 3.355
292 HH TYR 40 HH TYR 40 -6.898 -2.051 4.153
293 H ASP 41 HN ASP 41 -9.509 5.475 3.406
294 HA ASP 41 HA ASP 41 -9.361 7.554 1.385
295 HB2 ASP 41 HB2 ASP 41 -9.016 7.638 4.398
296 HB3 ASP 41 HB1 ASP 41 -8.776 9.037 3.366
297 H SER 42 HN SER 42 -7.409 9.082 1.664
298 HA SER 42 HA SER 42 -5.072 7.726 0.968
299 HB2 SER 42 HB2 SER 42 -4.128 10.080 1.421
300 HB3 SER 42 HB1 SER 42 -5.372 9.920 0.169
301 H LEU 43 HN LEU 43 -6.237 9.178 3.903
302 HA LEU 43 HA LEU 43 -4.048 8.937 5.588
303 HB2 LEU 43 HB2 LEU 43 -6.966 8.639 6.278
304 HB3 LEU 43 HB1 LEU 43 -5.683 8.935 7.430
305 HG LEU 43 HG LEU 43 -6.521 10.827 5.232
306 HD11 LEU 43 HD11 LEU 43 -8.203 10.654 6.974
307 HD12 LEU 43 HD12 LEU 43 -7.380 12.212 7.048
308 HD13 LEU 43 HD13 LEU 43 -6.976 10.946 8.207
309 HD21 LEU 43 HD21 LEU 43 -5.039 12.423 6.343
310 HD22 LEU 43 HD22 LEU 43 -4.145 11.014 5.773
311 HD23 LEU 43 HD23 LEU 43 -4.540 11.174 7.483
312 H ALA 44 HN ALA 44 -6.423 6.508 4.652
313 HA ALA 44 HA ALA 44 -5.576 4.548 6.552
314 HB1 ALA 44 HB1 ALA 44 -7.128 4.198 3.980
315 HB2 ALA 44 HB2 ALA 44 -7.827 4.489 5.574
316 HB3 ALA 44 HB3 ALA 44 -6.957 2.987 5.253
317 H LEU 45 HN LEU 45 -4.881 5.267 3.215
318 HA LEU 45 HA LEU 45 -3.184 3.080 2.659
319 HB2 LEU 45 HB2 LEU 45 -3.226 5.840 1.438
320 HB3 LEU 45 HB1 LEU 45 -2.468 4.423 0.738
321 HG LEU 45 HG LEU 45 -5.423 4.726 1.241
322 HD11 LEU 45 HD11 LEU 45 -3.853 4.904 -1.319
323 HD12 LEU 45 HD12 LEU 45 -4.673 6.235 -0.503
324 HD13 LEU 45 HD13 LEU 45 -5.611 4.905 -1.184
325 HD21 LEU 45 HD21 LEU 45 -5.597 2.700 -0.114
326 HD22 LEU 45 HD22 LEU 45 -4.671 2.426 1.361
327 HD23 LEU 45 HD23 LEU 45 -3.838 2.602 -0.185
328 H MET 46 HN MET 46 -2.700 6.238 4.013
329 HA MET 46 HA MET 46 0.127 6.265 4.111
330 HB2 MET 46 HB2 MET 46 -1.931 7.676 5.818
331 HB3 MET 46 HB1 MET 46 -0.203 7.971 5.939
332 HG2 MET 46 HG2 MET 46 -0.113 8.890 3.745
333 HG3 MET 46 HG1 MET 46 -1.720 8.267 3.388
334 HE1 MET 46 HE1 MET 46 -0.763 9.992 6.792
335 HE2 MET 46 HE2 MET 46 -1.100 11.688 6.438
336 HE3 MET 46 HE3 MET 46 0.245 10.871 5.642
337 H GLU 47 HN GLU 47 -2.329 4.871 6.131
338 HA GLU 47 HA GLU 47 -0.593 4.245 8.304
339 HB2 GLU 47 HB2 GLU 47 -3.120 4.444 8.393
340 HB3 GLU 47 HB1 GLU 47 -3.197 2.885 7.586
341 HG2 GLU 47 HG2 GLU 47 -3.494 2.483 9.904
342 HG3 GLU 47 HG1 GLU 47 -1.877 1.924 9.483
343 H THR 48 HN THR 48 -1.722 2.620 5.369
344 HA THR 48 HA THR 48 -0.705 0.063 5.649
345 HB THR 48 HB THR 48 -0.631 1.762 3.131
346 HG1 THR 48 HG1 THR 48 -2.687 0.368 4.441
347 HG21 THR 48 HG21 THR 48 -1.011 -0.390 1.990
348 HG22 THR 48 HG22 THR 48 -0.987 -1.219 3.546
349 HG23 THR 48 HG23 THR 48 0.473 -0.437 2.941
350 H ALA 49 HN ALA 49 0.762 2.824 4.032
351 HA ALA 49 HA ALA 49 3.290 1.808 3.593
352 HB1 ALA 49 HB1 ALA 49 2.419 3.837 2.539
353 HB2 ALA 49 HB2 ALA 49 3.990 4.119 3.287
354 HB3 ALA 49 HB3 ALA 49 2.519 4.680 4.084
355 H ALA 50 HN ALA 50 2.169 3.832 6.297
356 HA ALA 50 HA ALA 50 4.572 4.083 7.632
357 HB1 ALA 50 HB1 ALA 50 2.581 5.413 8.106
358 HB2 ALA 50 HB2 ALA 50 3.290 4.716 9.565
359 HB3 ALA 50 HB3 ALA 50 1.837 4.005 8.864
360 H ARG 51 HN ARG 51 2.103 1.574 8.087
361 HA ARG 51 HA ARG 51 3.520 0.381 10.248
362 HB2 ARG 51 HB2 ARG 51 1.063 0.114 9.847
363 HB3 ARG 51 HB1 ARG 51 1.448 -0.920 8.478
364 HG2 ARG 51 HG2 ARG 51 2.576 -2.478 9.972
365 HG3 ARG 51 HG1 ARG 51 2.183 -1.443 11.346
366 HD2 ARG 51 HD2 ARG 51 -0.222 -1.737 10.807
367 HD3 ARG 51 HD1 ARG 51 0.291 -2.832 9.510
368 HE ARG 51 HE ARG 51 1.461 -3.752 11.816
369 HH11 ARG 51 HH11 ARG 51 -1.867 -3.339 10.665
370 HH12 ARG 51 HH12 ARG 51 -2.489 -4.652 11.510
371 HH21 ARG 51 HH21 ARG 51 0.618 -5.465 13.086
372 HH22 ARG 51 HH22 ARG 51 -1.005 -5.964 12.914
373 H LEU 52 HN LEU 52 3.203 -0.425 6.802
374 HA LEU 52 HA LEU 52 4.986 -2.544 6.789
375 HB2 LEU 52 HB2 LEU 52 4.354 -0.578 4.616
376 HB3 LEU 52 HB1 LEU 52 5.361 -1.994 4.374
377 HG LEU 52 HG LEU 52 2.470 -2.007 5.215
378 HD11 LEU 52 HD11 LEU 52 3.812 -2.834 2.651
379 HD12 LEU 52 HD12 LEU 52 2.789 -1.417 2.880
380 HD13 LEU 52 HD13 LEU 52 2.103 -3.036 3.036
381 HD21 LEU 52 HD21 LEU 52 3.720 -3.820 6.252
382 HD22 LEU 52 HD22 LEU 52 4.378 -4.282 4.682
383 HD23 LEU 52 HD23 LEU 52 2.649 -4.440 4.996
384 H GLU 53 HN GLU 53 5.744 0.912 6.698
385 HA GLU 53 HA GLU 53 8.432 0.767 6.093
386 HB2 GLU 53 HB2 GLU 53 7.119 2.573 8.136
387 HB3 GLU 53 HB1 GLU 53 8.759 2.768 7.552
388 HG2 GLU 53 HG2 GLU 53 7.887 3.185 5.305
389 HG3 GLU 53 HG1 GLU 53 6.243 3.007 5.929
390 H SER 54 HN SER 54 6.850 0.589 9.258
391 HA SER 54 HA SER 54 9.072 0.168 10.867
392 HB2 SER 54 HB2 SER 54 6.206 -0.704 11.258
393 HB3 SER 54 HB1 SER 54 7.411 -0.486 12.532
394 HG SER 54 HG SER 54 6.002 1.304 12.241
395 H ARG 55 HN ARG 55 7.279 -2.015 8.887
396 HA ARG 55 HA ARG 55 8.271 -4.380 10.210
397 HB2 ARG 55 HB2 ARG 55 6.020 -4.384 9.320
398 HB3 ARG 55 HB1 ARG 55 6.630 -4.058 7.707
399 HG2 ARG 55 HG2 ARG 55 7.705 -6.223 7.634
400 HG3 ARG 55 HG1 ARG 55 7.210 -6.549 9.299
401 HD2 ARG 55 HD2 ARG 55 5.380 -6.101 6.947
402 HD3 ARG 55 HD1 ARG 55 5.715 -7.653 7.728
403 HE ARG 55 HE ARG 55 4.881 -6.123 9.762
404 HH11 ARG 55 HH11 ARG 55 3.411 -6.886 6.605
405 HH12 ARG 55 HH12 ARG 55 1.817 -6.733 7.210
406 HH21 ARG 55 HH21 ARG 55 2.667 -5.860 10.495
407 HH22 ARG 55 HH22 ARG 55 1.399 -6.244 9.415
408 H TYR 56 HN TYR 56 8.670 -2.906 6.981
409 HA TYR 56 HA TYR 56 10.672 -4.905 6.343
410 HB2 TYR 56 HB2 TYR 56 9.394 -2.742 4.689
411 HB3 TYR 56 HB1 TYR 56 10.697 -3.765 4.091
412 HD1 TYR 56 HD1 TYR 56 7.194 -3.768 5.281
413 HD2 TYR 56 HD2 TYR 56 10.277 -5.991 3.383
414 HE1 TYR 56 HE1 TYR 56 5.554 -5.473 4.620
415 HE2 TYR 56 HE2 TYR 56 8.647 -7.704 2.721
416 HH TYR 56 HH TYR 56 6.530 -8.506 3.241
417 H GLY 57 HN GLY 57 10.671 -1.603 7.405
418 HA2 GLY 57 HA2 GLY 57 12.552 -0.439 8.105
419 HA3 GLY 57 HA1 GLY 57 13.571 -1.639 7.310
420 H VAL 58 HN VAL 58 11.020 0.587 6.321
421 HA VAL 58 HA VAL 58 12.802 1.627 4.259
422 HB VAL 58 HB VAL 58 10.884 1.848 2.655
423 HG11 VAL 58 HG11 VAL 58 11.510 -0.967 3.508
424 HG12 VAL 58 HG12 VAL 58 12.463 0.027 2.402
425 HG13 VAL 58 HG13 VAL 58 10.835 -0.488 1.950
426 HG21 VAL 58 HG21 VAL 58 9.446 0.051 4.608
427 HG22 VAL 58 HG22 VAL 58 8.872 0.483 2.999
428 HG23 VAL 58 HG23 VAL 58 9.036 1.726 4.239
429 H SER 59 HN SER 59 11.613 3.690 3.195
430 HA SER 59 HA SER 59 10.453 5.207 5.389
431 HB2 SER 59 HB2 SER 59 12.901 5.691 5.250
432 HB3 SER 59 HB1 SER 59 12.682 6.189 3.575
433 HG SER 59 HG SER 59 11.344 7.341 5.783
434 H ILE 60 HN ILE 60 8.520 5.656 4.669
435 HA ILE 60 HA ILE 60 8.204 6.528 1.881
436 HB ILE 60 HB ILE 60 6.177 4.984 3.538
437 HG12 ILE 60 HG12 ILE 60 7.751 4.064 1.113
438 HG13 ILE 60 HG11 ILE 60 8.109 3.598 2.770
439 HG21 ILE 60 HG21 ILE 60 5.137 6.564 1.989
440 HG22 ILE 60 HG22 ILE 60 4.868 4.905 1.455
441 HG23 ILE 60 HG23 ILE 60 6.084 5.899 0.654
442 HD11 ILE 60 HD11 ILE 60 5.935 2.491 2.919
443 HD12 ILE 60 HD12 ILE 60 6.906 1.849 1.594
444 HD13 ILE 60 HD13 ILE 60 5.582 2.967 1.258
445 HA PRO 61 HA PRO 61 7.016 10.192 4.268
446 HB2 PRO 61 HB2 PRO 61 6.562 11.156 1.490
447 HB3 PRO 61 HB1 PRO 61 7.477 11.912 2.800
448 HG2 PRO 61 HG2 PRO 61 8.739 10.759 0.767
449 HG3 PRO 61 HG1 PRO 61 9.353 10.607 2.425
450 HD2 PRO 61 HD2 PRO 61 7.843 8.624 0.772
451 HD3 PRO 61 HD1 PRO 61 9.207 8.365 1.880
452 H ASP 62 HN ASP 62 5.067 10.857 4.867
453 HA ASP 62 HA ASP 62 2.918 9.199 4.391
454 HB2 ASP 62 HB2 ASP 62 1.608 10.760 5.806
455 HB3 ASP 62 HB1 ASP 62 3.137 10.267 6.509
456 H ASP 63 HN ASP 63 3.506 12.397 2.927
457 HA ASP 63 HA ASP 63 0.894 12.584 1.800
458 HB2 ASP 63 HB2 ASP 63 2.263 14.588 2.038
459 HB3 ASP 63 HB1 ASP 63 3.466 13.933 0.934
460 H VAL 64 HN VAL 64 3.711 10.906 0.856
461 HA VAL 64 HA VAL 64 3.177 10.555 -1.926
462 HB VAL 64 HB VAL 64 4.690 8.823 -0.014
463 HG11 VAL 64 HG11 VAL 64 4.206 7.651 -2.132
464 HG12 VAL 64 HG12 VAL 64 5.927 8.029 -2.062
465 HG13 VAL 64 HG13 VAL 64 4.845 9.013 -3.051
466 HG21 VAL 64 HG21 VAL 64 6.716 10.000 -0.811
467 HG22 VAL 64 HG22 VAL 64 5.559 11.091 -0.037
468 HG23 VAL 64 HG23 VAL 64 5.692 11.047 -1.793
469 H ALA 65 HN ALA 65 2.273 8.847 0.998
470 HA ALA 65 HA ALA 65 1.093 6.628 -0.357
471 HB1 ALA 65 HB1 ALA 65 0.713 7.586 2.473
472 HB2 ALA 65 HB2 ALA 65 1.914 6.408 1.936
473 HB3 ALA 65 HB3 ALA 65 0.191 6.031 1.836
474 H GLY 66 HN GLY 66 0.158 9.811 0.244
475 HA2 GLY 66 HA2 GLY 66 -2.674 9.269 -0.155
476 HA3 GLY 66 HA1 GLY 66 -1.935 10.849 0.103
477 H ARG 67 HN ARG 67 -0.004 9.357 -2.048
478 HA ARG 67 HA ARG 67 -1.362 10.600 -4.332
479 HB2 ARG 67 HB2 ARG 67 1.546 10.025 -3.819
480 HB3 ARG 67 HB1 ARG 67 0.931 10.483 -5.395
481 HG2 ARG 67 HG2 ARG 67 0.167 12.615 -4.459
482 HG3 ARG 67 HG1 ARG 67 0.824 12.140 -2.886
483 HD2 ARG 67 HD2 ARG 67 3.043 12.020 -3.780
484 HD3 ARG 67 HD1 ARG 67 2.443 12.272 -5.414
485 HE ARG 67 HE ARG 67 1.748 14.429 -3.708
486 HH11 ARG 67 HH11 ARG 67 4.555 13.027 -5.373
487 HH12 ARG 67 HH12 ARG 67 5.270 14.516 -5.754
488 HH21 ARG 67 HH21 ARG 67 2.783 16.518 -4.165
489 HH22 ARG 67 HH22 ARG 67 4.254 16.536 -5.037
490 H VAL 68 HN VAL 68 -1.199 7.663 -3.031
491 HA VAL 68 HA VAL 68 -0.527 6.308 -5.486
492 HB VAL 68 HB VAL 68 -1.015 4.167 -4.251
493 HG11 VAL 68 HG11 VAL 68 0.944 4.278 -2.805
494 HG12 VAL 68 HG12 VAL 68 0.933 6.039 -2.937
495 HG13 VAL 68 HG13 VAL 68 1.227 5.043 -4.370
496 HG21 VAL 68 HG21 VAL 68 -1.313 5.984 -1.864
497 HG22 VAL 68 HG22 VAL 68 -1.240 4.224 -1.821
498 HG23 VAL 68 HG23 VAL 68 -2.610 5.033 -2.593
499 H ASP 69 HN ASP 69 -1.849 6.481 -6.981
500 HA ASP 69 HA ASP 69 -4.628 6.953 -6.778
501 HB2 ASP 69 HB2 ASP 69 -3.235 7.610 -8.743
502 HB3 ASP 69 HB1 ASP 69 -3.083 5.912 -9.145
503 H THR 70 HN THR 70 -2.752 4.076 -7.527
504 HA THR 70 HA THR 70 -5.133 2.452 -7.079
505 HB THR 70 HB THR 70 -4.222 0.972 -8.917
506 HG1 THR 70 HG1 THR 70 -2.905 3.090 -10.112
507 HG21 THR 70 HG21 THR 70 -5.000 3.778 -9.687
508 HG22 THR 70 HG22 THR 70 -6.140 2.508 -9.240
509 HG23 THR 70 HG23 THR 70 -5.179 2.358 -10.726
510 HA PRO 71 HA PRO 71 -2.444 -0.063 -4.537
511 HB2 PRO 71 HB2 PRO 71 -3.256 -2.447 -6.135
512 HB3 PRO 71 HB1 PRO 71 -3.354 -2.178 -4.387
513 HG2 PRO 71 HG2 PRO 71 -5.547 -2.088 -5.851
514 HG3 PRO 71 HG1 PRO 71 -5.287 -0.890 -4.566
515 HD2 PRO 71 HD2 PRO 71 -4.916 -0.594 -7.526
516 HD3 PRO 71 HD1 PRO 71 -5.670 0.529 -6.371
517 H ARG 72 HN ARG 72 -2.358 -0.478 -7.992
518 HA ARG 72 HA ARG 72 0.090 -1.822 -8.314
519 HB2 ARG 72 HB2 ARG 72 -1.622 -1.407 -10.075
520 HB3 ARG 72 HB1 ARG 72 -1.147 0.280 -10.094
521 HG2 ARG 72 HG2 ARG 72 1.083 -0.356 -10.863
522 HG3 ARG 72 HG1 ARG 72 0.603 -2.058 -10.839
523 HD2 ARG 72 HD2 ARG 72 -0.589 0.136 -12.532
524 HD3 ARG 72 HD1 ARG 72 0.418 -1.202 -13.091
525 HE ARG 72 HE ARG 72 -1.413 -2.690 -12.309
526 HH11 ARG 72 HH11 ARG 72 -2.104 0.644 -13.306
527 HH12 ARG 72 HH12 ARG 72 -3.747 0.352 -13.628
528 HH21 ARG 72 HH21 ARG 72 -3.693 -3.067 -12.759
529 HH22 ARG 72 HH22 ARG 72 -4.671 -1.788 -13.318
530 H GLU 73 HN GLU 73 -0.743 1.573 -8.102
531 HA GLU 73 HA GLU 73 1.757 2.796 -8.439
532 HB2 GLU 73 HB2 GLU 73 -0.543 3.848 -8.395
533 HB3 GLU 73 HB1 GLU 73 -0.520 3.671 -6.653
534 HG2 GLU 73 HG2 GLU 73 0.014 5.910 -7.164
535 HG3 GLU 73 HG1 GLU 73 1.501 5.131 -6.623
536 H LEU 74 HN LEU 74 0.016 1.692 -5.594
537 HA LEU 74 HA LEU 74 1.834 2.509 -3.589
538 HB2 LEU 74 HB2 LEU 74 -0.694 1.704 -3.576
539 HB3 LEU 74 HB1 LEU 74 0.018 0.139 -3.283
540 HG LEU 74 HG LEU 74 0.262 2.571 -1.504
541 HD11 LEU 74 HD11 LEU 74 -1.957 1.653 -1.486
542 HD12 LEU 74 HD12 LEU 74 -1.146 1.303 0.041
543 HD13 LEU 74 HD13 LEU 74 -1.319 0.040 -1.176
544 HD21 LEU 74 HD21 LEU 74 1.212 -0.255 -1.034
545 HD22 LEU 74 HD22 LEU 74 1.265 1.062 0.138
546 HD23 LEU 74 HD23 LEU 74 2.247 1.143 -1.327
547 H LEU 75 HN LEU 75 1.365 -0.542 -5.322
548 HA LEU 75 HA LEU 75 3.243 -2.147 -4.004
549 HB2 LEU 75 HB2 LEU 75 1.533 -3.027 -5.506
550 HB3 LEU 75 HB1 LEU 75 2.292 -2.231 -6.867
551 HG LEU 75 HG LEU 75 4.283 -3.690 -6.554
552 HD11 LEU 75 HD11 LEU 75 4.022 -4.199 -4.201
553 HD12 LEU 75 HD12 LEU 75 4.082 -5.680 -5.156
554 HD13 LEU 75 HD13 LEU 75 2.538 -5.088 -4.541
555 HD21 LEU 75 HD21 LEU 75 2.573 -4.251 -8.191
556 HD22 LEU 75 HD22 LEU 75 1.660 -5.121 -6.955
557 HD23 LEU 75 HD23 LEU 75 3.244 -5.710 -7.462
558 H ASP 76 HN ASP 76 3.528 -0.239 -6.973
559 HA ASP 76 HA ASP 76 6.221 -0.841 -7.517
560 HB2 ASP 76 HB2 ASP 76 4.710 0.145 -9.199
561 HB3 ASP 76 HB1 ASP 76 4.685 1.651 -8.288
562 H LEU 77 HN LEU 77 4.741 1.768 -5.689
563 HA LEU 77 HA LEU 77 6.970 3.280 -5.060
564 HB2 LEU 77 HB2 LEU 77 4.805 4.087 -4.495
565 HB3 LEU 77 HB1 LEU 77 4.474 2.694 -3.488
566 HG LEU 77 HG LEU 77 6.184 3.481 -1.882
567 HD11 LEU 77 HD11 LEU 77 6.317 5.948 -3.610
568 HD12 LEU 77 HD12 LEU 77 7.602 4.760 -3.367
569 HD13 LEU 77 HD13 LEU 77 7.055 5.745 -2.017
570 HD21 LEU 77 HD21 LEU 77 4.003 5.461 -2.515
571 HD22 LEU 77 HD22 LEU 77 4.867 5.328 -0.982
572 HD23 LEU 77 HD23 LEU 77 3.846 4.002 -1.532
573 H ILE 78 HN ILE 78 5.591 0.608 -3.139
574 HA ILE 78 HA ILE 78 7.740 0.744 -1.294
575 HB ILE 78 HB ILE 78 5.771 -1.539 -1.643
576 HG12 ILE 78 HG12 ILE 78 5.767 0.885 0.164
577 HG13 ILE 78 HG11 ILE 78 4.661 0.566 -1.167
578 HG21 ILE 78 HG21 ILE 78 7.804 -2.204 -0.403
579 HG22 ILE 78 HG22 ILE 78 6.404 -2.133 0.667
580 HG23 ILE 78 HG23 ILE 78 7.591 -0.828 0.680
581 HD11 ILE 78 HD11 ILE 78 3.809 -1.377 0.054
582 HD12 ILE 78 HD12 ILE 78 3.598 0.139 0.941
583 HD13 ILE 78 HD13 ILE 78 4.891 -0.973 1.393
584 H ASN 79 HN ASN 79 7.176 -1.226 -4.136
585 HA ASN 79 HA ASN 79 9.430 -2.895 -3.726
586 HB2 ASN 79 HB2 ASN 79 7.893 -2.196 -6.216
587 HB3 ASN 79 HB1 ASN 79 9.401 -3.089 -6.343
588 HD21 ASN 79 HD21 ASN 79 7.126 -3.510 -3.671
589 HD22 ASN 79 HD22 ASN 79 6.669 -5.122 -4.146
590 H GLY 80 HN GLY 80 9.110 0.241 -5.244
591 HA2 GLY 80 HA2 GLY 80 11.793 0.459 -6.124
592 HA3 GLY 80 HA1 GLY 80 10.697 1.803 -5.822
593 H ALA 81 HN ALA 81 10.175 1.354 -3.130
594 HA ALA 81 HA ALA 81 12.386 2.561 -1.865
595 HB1 ALA 81 HB1 ALA 81 10.006 1.182 -0.610
596 HB2 ALA 81 HB2 ALA 81 10.069 2.871 -1.109
597 HB3 ALA 81 HB3 ALA 81 11.102 2.301 0.203
598 H LEU 82 HN LEU 82 11.184 -0.755 -1.890
599 HA LEU 82 HA LEU 82 13.043 -1.825 -0.057
600 HB2 LEU 82 HB2 LEU 82 11.392 -3.134 -2.206
601 HB3 LEU 82 HB1 LEU 82 12.422 -4.035 -1.116
602 HG LEU 82 HG LEU 82 10.129 -2.289 -0.208
603 HD11 LEU 82 HD11 LEU 82 8.938 -4.385 0.163
604 HD12 LEU 82 HD12 LEU 82 10.277 -5.274 -0.565
605 HD13 LEU 82 HD13 LEU 82 9.324 -4.154 -1.542
606 HD21 LEU 82 HD21 LEU 82 10.417 -3.488 1.902
607 HD22 LEU 82 HD22 LEU 82 11.885 -2.615 1.461
608 HD23 LEU 82 HD23 LEU 82 11.792 -4.360 1.223
609 H ALA 83 HN ALA 83 13.417 -0.882 -3.305
610 HA ALA 83 HA ALA 83 15.649 -2.569 -3.890
611 HB1 ALA 83 HB1 ALA 83 14.817 0.033 -5.188
612 HB2 ALA 83 HB2 ALA 83 14.290 -1.575 -5.684
613 HB3 ALA 83 HB3 ALA 83 15.986 -1.116 -5.835
614 H GLU 84 HN GLU 84 15.201 0.158 -1.928
615 HA GLU 84 HA GLU 84 18.093 0.705 -1.846
616 HB2 GLU 84 HB2 GLU 84 15.754 2.349 -0.895
617 HB3 GLU 84 HB1 GLU 84 17.430 2.734 -0.557
618 HG2 GLU 84 HG2 GLU 84 17.808 2.910 -2.997
619 HG3 GLU 84 HG1 GLU 84 16.071 2.687 -3.229
620 H ALA 85 HN ALA 85 15.934 -1.205 -0.445
621 HA ALA 85 HA ALA 85 16.512 -0.590 2.320
622 HB1 ALA 85 HB1 ALA 85 14.898 -2.843 1.118
623 HB2 ALA 85 HB2 ALA 85 14.253 -1.311 1.707
624 HB3 ALA 85 HB3 ALA 85 15.000 -2.444 2.834
625 H ALA 86 HN ALA 86 18.393 -1.172 3.062
626 HA ALA 86 HA ALA 86 19.503 -3.750 2.227
627 HB1 ALA 86 HB1 ALA 86 21.725 -2.773 2.623
628 HB2 ALA 86 HB2 ALA 86 20.974 -1.226 3.018
629 HB3 ALA 86 HB3 ALA 86 20.843 -1.881 1.384
630 H28 SXV 87 H28A SXV 87 -6.338 13.892 3.194
631 H28A SXV 87 H28B SXV 87 -5.127 12.615 3.267
632 H30 SXV 87 H30C SXV 87 -2.968 15.232 4.218
633 H30A SXV 87 H30A SXV 87 -3.389 13.525 4.348
634 H30B SXV 87 H30B SXV 87 -4.546 14.761 4.848
635 H31 SXV 87 H31C SXV 87 -2.631 13.368 2.239
636 H31A SXV 87 H31A SXV 87 -2.522 15.007 1.655
637 H31B SXV 87 H31B SXV 87 -3.538 13.805 0.820
638 H32 SXV 87 H32A SXV 87 -4.008 16.680 2.304
639 HO33 SXV 87 H33A SXV 87 -6.221 17.142 3.151
640 HN36 SXV 87 H36A SXV 87 -5.011 14.815 0.071
641 H37 SXV 87 H37B SXV 87 -5.844 15.949 -1.906
642 H37A SXV 87 H37A SXV 87 -7.135 16.630 -0.956
643 H38 SXV 87 H38B SXV 87 -6.793 13.649 -1.491
644 H38A SXV 87 H38A SXV 87 -7.743 14.762 -2.500
645 HN41 SXV 87 H41A SXV 87 -8.005 15.696 0.649
646 H42 SXV 87 H42B SXV 87 -10.400 14.122 1.202
647 H42A SXV 87 H42A SXV 87 -10.500 15.879 1.182
648 H43 SXV 87 H43B SXV 87 -8.711 14.247 2.965
649 H43A SXV 87 H43A SXV 87 -8.890 15.999 3.002
650 H1 SXV 87 H1B SXV 87 -9.201 14.080 5.527
651 H1A SXV 87 H1A SXV 87 -9.392 15.839 5.649
652 H2 SXV 87 H2A SXV 87 -10.196 14.733 7.609
653 H2A SXV 87 H2B SXV 87 -11.423 13.883 6.659
654 H4 SXV 87 H4C SXV 87 -11.542 16.420 8.961
655 H4A SXV 87 H4A SXV 87 -12.224 17.734 7.995
656 H4B SXV 87 H4B SXV 87 -10.498 17.360 7.884
Start of MODEL 9
1 H1 MET 1 HT1 MET 1 20.480 -7.872 -4.303
2 H2 MET 1 HT2 MET 1 19.665 -7.543 -5.715
3 H3 MET 1 HT3 MET 1 20.604 -8.960 -5.612
4 HA MET 1 HA MET 1 18.230 -9.380 -5.455
5 HB2 MET 1 HB2 MET 1 18.241 -10.701 -3.384
6 HB3 MET 1 HB1 MET 1 19.757 -10.886 -4.247
7 HG2 MET 1 HG2 MET 1 20.813 -9.312 -2.694
8 HG3 MET 1 HG1 MET 1 19.288 -9.165 -1.824
9 HE1 MET 1 HE1 MET 1 20.461 -9.824 0.454
10 HE2 MET 1 HE2 MET 1 22.004 -9.935 -0.392
11 HE3 MET 1 HE3 MET 1 21.479 -11.250 0.660
12 H ALA 2 HN ALA 2 16.301 -9.250 -3.933
13 HA ALA 2 HA ALA 2 16.255 -6.976 -2.177
14 HB1 ALA 2 HB1 ALA 2 16.087 -5.878 -4.352
15 HB2 ALA 2 HB2 ALA 2 14.589 -5.721 -3.434
16 HB3 ALA 2 HB3 ALA 2 14.696 -6.884 -4.755
17 H THR 3 HN THR 3 14.725 -7.331 -0.638
18 HA THR 3 HA THR 3 12.845 -9.454 -1.004
19 HB THR 3 HB THR 3 13.851 -9.102 1.205
20 HG1 THR 3 HG1 THR 3 12.158 -9.817 1.946
21 HG21 THR 3 HG21 THR 3 12.527 -6.372 1.248
22 HG22 THR 3 HG22 THR 3 14.260 -6.687 1.182
23 HG23 THR 3 HG23 THR 3 13.342 -7.127 2.619
24 H LEU 4 HN LEU 4 11.227 -9.042 -2.364
25 HA LEU 4 HA LEU 4 10.144 -6.318 -2.445
26 HB2 LEU 4 HB2 LEU 4 9.956 -8.520 -4.491
27 HB3 LEU 4 HB1 LEU 4 9.229 -6.936 -4.645
28 HG LEU 4 HG LEU 4 12.190 -7.508 -4.532
29 HD11 LEU 4 HD11 LEU 4 11.154 -8.257 -6.596
30 HD12 LEU 4 HD12 LEU 4 12.159 -6.835 -6.874
31 HD13 LEU 4 HD13 LEU 4 10.405 -6.674 -6.808
32 HD21 LEU 4 HD21 LEU 4 12.448 -5.144 -5.115
33 HD22 LEU 4 HD22 LEU 4 11.636 -5.329 -3.560
34 HD23 LEU 4 HD23 LEU 4 10.703 -4.918 -5.001
35 H LEU 5 HN LEU 5 7.826 -6.240 -3.071
36 HA LEU 5 HA LEU 5 6.271 -7.983 -1.340
37 HB2 LEU 5 HB2 LEU 5 5.522 -5.559 -2.963
38 HB3 LEU 5 HB1 LEU 5 4.437 -6.443 -1.922
39 HG LEU 5 HG LEU 5 6.865 -4.925 -0.987
40 HD11 LEU 5 HD11 LEU 5 5.227 -3.316 -0.141
41 HD12 LEU 5 HD12 LEU 5 3.925 -4.256 -0.869
42 HD13 LEU 5 HD13 LEU 5 5.120 -3.462 -1.896
43 HD21 LEU 5 HD21 LEU 5 4.592 -6.222 0.492
44 HD22 LEU 5 HD22 LEU 5 5.888 -5.266 1.213
45 HD23 LEU 5 HD23 LEU 5 6.254 -6.805 0.431
46 H THR 6 HN THR 6 4.797 -9.418 -2.157
47 HA THR 6 HA THR 6 4.671 -9.696 -5.036
48 HB THR 6 HB THR 6 3.336 -11.764 -4.443
49 HG1 THR 6 HG1 THR 6 4.144 -12.176 -1.992
50 HG21 THR 6 HG21 THR 6 5.733 -11.930 -4.967
51 HG22 THR 6 HG22 THR 6 5.284 -13.086 -3.716
52 HG23 THR 6 HG23 THR 6 6.129 -11.601 -3.281
53 H THR 7 HN THR 7 2.214 -10.492 -5.561
54 HA THR 7 HA THR 7 0.539 -8.261 -5.092
55 HB THR 7 HB THR 7 -0.288 -11.033 -6.008
56 HG1 THR 7 HG1 THR 7 0.664 -8.967 -7.712
57 HG21 THR 7 HG21 THR 7 -1.890 -9.771 -7.388
58 HG22 THR 7 HG22 THR 7 -1.251 -8.259 -6.737
59 HG23 THR 7 HG23 THR 7 -2.089 -9.392 -5.676
60 H ASP 8 HN ASP 8 0.919 -11.498 -3.774
61 HA ASP 8 HA ASP 8 -1.381 -11.435 -2.123
62 HB2 ASP 8 HB2 ASP 8 -0.345 -13.524 -2.936
63 HB3 ASP 8 HB1 ASP 8 1.038 -13.219 -1.886
64 H ASP 9 HN ASP 9 2.091 -10.827 -1.465
65 HA ASP 9 HA ASP 9 1.648 -10.276 1.276
66 HB2 ASP 9 HB2 ASP 9 3.943 -9.809 -0.525
67 HB3 ASP 9 HB1 ASP 9 3.827 -8.700 0.838
68 H LEU 10 HN LEU 10 1.356 -8.277 -1.554
69 HA LEU 10 HA LEU 10 1.018 -5.829 -0.190
70 HB2 LEU 10 HB2 LEU 10 1.437 -6.028 -2.635
71 HB3 LEU 10 HB1 LEU 10 -0.170 -6.698 -2.832
72 HG LEU 10 HG LEU 10 -1.121 -4.554 -2.016
73 HD11 LEU 10 HD11 LEU 10 0.758 -3.783 -0.691
74 HD12 LEU 10 HD12 LEU 10 0.313 -2.583 -1.905
75 HD13 LEU 10 HD13 LEU 10 1.731 -3.601 -2.151
76 HD21 LEU 10 HD21 LEU 10 -0.651 -3.291 -4.054
77 HD22 LEU 10 HD22 LEU 10 -0.920 -5.002 -4.392
78 HD23 LEU 10 HD23 LEU 10 0.720 -4.349 -4.392
79 H ARG 11 HN ARG 11 -1.203 -8.408 -1.137
80 HA ARG 11 HA ARG 11 -3.629 -7.338 -0.305
81 HB2 ARG 11 HB2 ARG 11 -3.678 -9.493 -1.362
82 HB3 ARG 11 HB1 ARG 11 -2.619 -10.192 -0.142
83 HG2 ARG 11 HG2 ARG 11 -4.367 -9.956 1.538
84 HG3 ARG 11 HG1 ARG 11 -5.424 -9.205 0.351
85 HD2 ARG 11 HD2 ARG 11 -6.044 -11.511 0.683
86 HD3 ARG 11 HD1 ARG 11 -5.425 -11.282 -0.943
87 HE ARG 11 HE ARG 11 -3.332 -12.301 -0.104
88 HH11 ARG 11 HH11 ARG 11 -6.310 -12.860 1.739
89 HH12 ARG 11 HH12 ARG 11 -5.929 -14.479 2.120
90 HH21 ARG 11 HH21 ARG 11 -2.820 -14.459 0.400
91 HH22 ARG 11 HH22 ARG 11 -3.832 -15.419 1.398
92 H ARG 12 HN ARG 12 -1.227 -9.078 1.535
93 HA ARG 12 HA ARG 12 -2.450 -9.093 4.051
94 HB2 ARG 12 HB2 ARG 12 0.498 -8.997 3.392
95 HB3 ARG 12 HB1 ARG 12 -0.168 -9.407 4.965
96 HG2 ARG 12 HG2 ARG 12 -1.231 -11.368 4.030
97 HG3 ARG 12 HG1 ARG 12 -0.653 -10.934 2.423
98 HD2 ARG 12 HD2 ARG 12 1.649 -11.199 3.156
99 HD3 ARG 12 HD1 ARG 12 1.105 -11.550 4.796
100 HE ARG 12 HE ARG 12 -0.187 -13.374 3.318
101 HH11 ARG 12 HH11 ARG 12 3.247 -12.465 3.221
102 HH12 ARG 12 HH12 ARG 12 3.832 -14.064 3.200
103 HH21 ARG 12 HH21 ARG 12 0.606 -15.564 3.090
104 HH22 ARG 12 HH22 ARG 12 2.278 -15.888 3.014
105 H ALA 13 HN ALA 13 -0.322 -6.741 2.539
106 HA ALA 13 HA ALA 13 0.075 -4.992 4.685
107 HB1 ALA 13 HB1 ALA 13 -0.066 -4.361 1.741
108 HB2 ALA 13 HB2 ALA 13 1.362 -4.913 2.619
109 HB3 ALA 13 HB3 ALA 13 0.646 -3.342 2.992
110 H LEU 14 HN LEU 14 -2.436 -5.009 2.190
111 HA LEU 14 HA LEU 14 -3.685 -2.695 3.263
112 HB2 LEU 14 HB2 LEU 14 -4.477 -4.587 1.087
113 HB3 LEU 14 HB1 LEU 14 -5.645 -3.454 1.719
114 HG LEU 14 HG LEU 14 -4.727 -2.567 -0.294
115 HD11 LEU 14 HD11 LEU 14 -3.607 -1.096 2.064
116 HD12 LEU 14 HD12 LEU 14 -5.230 -0.947 1.392
117 HD13 LEU 14 HD13 LEU 14 -3.834 -0.426 0.449
118 HD21 LEU 14 HD21 LEU 14 -2.348 -2.035 -0.579
119 HD22 LEU 14 HD22 LEU 14 -2.607 -3.771 -0.392
120 HD23 LEU 14 HD23 LEU 14 -1.994 -2.820 0.961
121 H VAL 15 HN VAL 15 -3.850 -5.963 4.161
122 HA VAL 15 HA VAL 15 -6.472 -5.703 5.347
123 HB VAL 15 HB VAL 15 -4.364 -7.831 5.923
124 HG11 VAL 15 HG11 VAL 15 -7.330 -7.839 6.481
125 HG12 VAL 15 HG12 VAL 15 -6.044 -7.689 7.680
126 HG13 VAL 15 HG13 VAL 15 -6.224 -9.184 6.761
127 HG21 VAL 15 HG21 VAL 15 -4.988 -7.872 3.573
128 HG22 VAL 15 HG22 VAL 15 -6.696 -7.936 4.010
129 HG23 VAL 15 HG23 VAL 15 -5.631 -9.284 4.410
130 H GLU 16 HN GLU 16 -3.209 -5.032 6.202
131 HA GLU 16 HA GLU 16 -3.441 -5.197 8.990
132 HB2 GLU 16 HB2 GLU 16 -1.451 -3.583 7.399
133 HB3 GLU 16 HB1 GLU 16 -1.337 -3.991 9.106
134 HG2 GLU 16 HG2 GLU 16 -1.382 -6.391 8.458
135 HG3 GLU 16 HG1 GLU 16 -1.273 -5.875 6.779
136 H SER 17 HN SER 17 -3.913 -2.421 6.834
137 HA SER 17 HA SER 17 -4.476 -0.809 9.185
138 HB2 SER 17 HB2 SER 17 -4.489 0.018 6.275
139 HB3 SER 17 HB1 SER 17 -4.504 1.079 7.682
140 HG SER 17 HG SER 17 -2.484 -0.064 8.252
141 H ALA 18 HN ALA 18 -6.199 -2.842 7.215
142 HA ALA 18 HA ALA 18 -8.619 -1.224 7.218
143 HB1 ALA 18 HB1 ALA 18 -9.607 -2.965 5.854
144 HB2 ALA 18 HB2 ALA 18 -8.174 -3.974 6.074
145 HB3 ALA 18 HB3 ALA 18 -8.056 -2.457 5.185
146 H GLY 19 HN GLY 19 -7.480 -4.338 8.446
147 HA2 GLY 19 HA2 GLY 19 -8.163 -5.460 10.339
148 HA3 GLY 19 HA1 GLY 19 -9.326 -4.168 10.661
149 H GLU 20 HN GLU 20 -11.380 -4.417 10.076
150 HA GLU 20 HA GLU 20 -12.040 -6.230 7.946
151 HB2 GLU 20 HB2 GLU 20 -11.959 -7.626 10.076
152 HB3 GLU 20 HB1 GLU 20 -13.337 -6.680 10.632
153 HG2 GLU 20 HG2 GLU 20 -14.101 -8.764 9.713
154 HG3 GLU 20 HG1 GLU 20 -14.612 -7.436 8.672
155 H THR 21 HN THR 21 -12.578 -4.167 7.088
156 HA THR 21 HA THR 21 -14.748 -2.645 8.200
157 HB THR 21 HB THR 21 -14.377 -1.415 5.993
158 HG1 THR 21 HG1 THR 21 -12.188 -2.008 5.124
159 HG21 THR 21 HG21 THR 21 -12.006 -1.735 7.857
160 HG22 THR 21 HG22 THR 21 -13.371 -0.646 8.114
161 HG23 THR 21 HG23 THR 21 -12.272 -0.376 6.762
162 H ASP 22 HN ASP 22 -14.568 -3.170 4.985
163 HA ASP 22 HA ASP 22 -17.232 -4.424 4.864
164 HB2 ASP 22 HB2 ASP 22 -16.841 -2.469 3.411
165 HB3 ASP 22 HB1 ASP 22 -15.517 -3.314 2.624
166 H GLY 23 HN GLY 23 -13.914 -4.928 3.955
167 HA2 GLY 23 HA2 GLY 23 -13.498 -7.475 4.473
168 HA3 GLY 23 HA1 GLY 23 -14.478 -7.631 3.019
169 H THR 24 HN THR 24 -11.687 -5.732 4.173
170 HA THR 24 HA THR 24 -10.767 -5.654 1.464
171 HB THR 24 HB THR 24 -9.450 -4.349 3.863
172 HG1 THR 24 HG1 THR 24 -11.476 -3.510 2.054
173 HG21 THR 24 HG21 THR 24 -9.385 -3.823 0.883
174 HG22 THR 24 HG22 THR 24 -8.049 -4.459 1.843
175 HG23 THR 24 HG23 THR 24 -8.612 -2.803 2.084
176 H ASP 25 HN ASP 25 -10.595 -8.037 1.722
177 HA ASP 25 HA ASP 25 -7.756 -8.592 2.132
178 HB2 ASP 25 HB2 ASP 25 -9.002 -10.051 3.660
179 HB3 ASP 25 HB1 ASP 25 -10.075 -10.547 2.354
180 H LEU 26 HN LEU 26 -6.925 -8.388 0.300
181 HA LEU 26 HA LEU 26 -8.524 -8.452 -2.073
182 HB2 LEU 26 HB2 LEU 26 -5.630 -7.730 -1.712
183 HB3 LEU 26 HB1 LEU 26 -6.551 -7.521 -3.176
184 HG LEU 26 HG LEU 26 -6.360 -5.405 -2.251
185 HD11 LEU 26 HD11 LEU 26 -8.543 -5.770 -3.070
186 HD12 LEU 26 HD12 LEU 26 -8.614 -4.720 -1.648
187 HD13 LEU 26 HD13 LEU 26 -9.067 -6.416 -1.514
188 HD21 LEU 26 HD21 LEU 26 -7.248 -6.485 0.420
189 HD22 LEU 26 HD22 LEU 26 -6.913 -4.793 0.060
190 HD23 LEU 26 HD23 LEU 26 -5.613 -5.985 -0.009
191 H SER 27 HN SER 27 -8.657 -10.858 -1.591
192 HA SER 27 HA SER 27 -6.490 -12.456 -2.536
193 HB2 SER 27 HB2 SER 27 -9.407 -13.100 -2.081
194 HB3 SER 27 HB1 SER 27 -8.222 -14.296 -2.611
195 HG SER 27 HG SER 27 -8.334 -12.925 -0.097
196 H GLY 28 HN GLY 28 -5.809 -12.483 -4.519
197 HA2 GLY 28 HA2 GLY 28 -6.209 -13.208 -6.786
198 HA3 GLY 28 HA1 GLY 28 -7.779 -12.415 -6.703
199 H ASP 29 HN ASP 29 -7.480 -11.097 -8.429
200 HA ASP 29 HA ASP 29 -5.150 -9.377 -8.668
201 HB2 ASP 29 HB2 ASP 29 -6.060 -10.316 -10.711
202 HB3 ASP 29 HB1 ASP 29 -7.660 -9.691 -10.341
203 H PHE 30 HN PHE 30 -5.091 -7.268 -8.159
204 HA PHE 30 HA PHE 30 -7.513 -5.766 -7.681
205 HB2 PHE 30 HB2 PHE 30 -7.132 -5.229 -5.345
206 HB3 PHE 30 HB1 PHE 30 -7.301 -6.963 -5.559
207 HD1 PHE 30 HD2 PHE 30 -5.240 -8.397 -5.471
208 HD2 PHE 30 HD1 PHE 30 -5.227 -4.285 -4.392
209 HE1 PHE 30 HE2 PHE 30 -3.150 -8.728 -4.226
210 HE2 PHE 30 HE1 PHE 30 -3.142 -4.614 -3.147
211 HZ PHE 30 HZ PHE 30 -2.105 -6.838 -3.060
212 H LEU 31 HN LEU 31 -4.305 -5.809 -8.629
213 HA LEU 31 HA LEU 31 -3.317 -3.373 -7.701
214 HB2 LEU 31 HB2 LEU 31 -2.654 -5.209 -9.906
215 HB3 LEU 31 HB1 LEU 31 -2.069 -3.566 -10.057
216 HG LEU 31 HG LEU 31 -0.864 -3.781 -7.962
217 HD11 LEU 31 HD11 LEU 31 -2.285 -5.330 -6.785
218 HD12 LEU 31 HD12 LEU 31 -0.615 -5.893 -6.832
219 HD13 LEU 31 HD13 LEU 31 -1.825 -6.628 -7.894
220 HD21 LEU 31 HD21 LEU 31 0.830 -5.376 -8.708
221 HD22 LEU 31 HD22 LEU 31 0.262 -4.345 -10.023
222 HD23 LEU 31 HD23 LEU 31 -0.303 -6.012 -9.902
223 H ASP 32 HN ASP 32 -5.740 -3.917 -10.058
224 HA ASP 32 HA ASP 32 -5.305 -1.264 -11.199
225 HB2 ASP 32 HB2 ASP 32 -6.837 -3.646 -12.206
226 HB3 ASP 32 HB1 ASP 32 -6.954 -2.053 -12.948
227 H LEU 33 HN LEU 33 -6.689 -2.161 -8.643
228 HA LEU 33 HA LEU 33 -9.319 -0.962 -9.009
229 HB2 LEU 33 HB2 LEU 33 -7.890 -2.219 -6.692
230 HB3 LEU 33 HB1 LEU 33 -9.337 -1.271 -6.450
231 HG LEU 33 HG LEU 33 -9.236 -3.731 -8.198
232 HD11 LEU 33 HD11 LEU 33 -8.704 -4.258 -5.850
233 HD12 LEU 33 HD12 LEU 33 -10.301 -4.854 -6.299
234 HD13 LEU 33 HD13 LEU 33 -10.145 -3.386 -5.333
235 HD21 LEU 33 HD21 LEU 33 -11.665 -3.601 -7.953
236 HD22 LEU 33 HD22 LEU 33 -11.027 -2.110 -8.670
237 HD23 LEU 33 HD23 LEU 33 -11.470 -2.155 -6.959
238 H ARG 34 HN ARG 34 -9.915 0.649 -7.319
239 HA ARG 34 HA ARG 34 -7.750 2.533 -6.749
240 HB2 ARG 34 HB2 ARG 34 -10.759 2.841 -6.717
241 HB3 ARG 34 HB1 ARG 34 -9.635 4.062 -6.160
242 HG2 ARG 34 HG2 ARG 34 -9.810 3.013 -8.959
243 HG3 ARG 34 HG1 ARG 34 -10.557 4.501 -8.378
244 HD2 ARG 34 HD2 ARG 34 -8.272 5.255 -7.713
245 HD3 ARG 34 HD1 ARG 34 -7.612 3.871 -8.583
246 HE ARG 34 HE ARG 34 -9.445 5.671 -9.956
247 HH11 ARG 34 HH11 ARG 34 -6.223 4.310 -9.735
248 HH12 ARG 34 HH12 ARG 34 -5.593 5.173 -11.074
249 HH21 ARG 34 HH21 ARG 34 -8.582 6.903 -11.759
250 HH22 ARG 34 HH22 ARG 34 -6.947 6.735 -12.205
251 H PHE 35 HN PHE 35 -7.859 3.369 -4.547
252 HA PHE 35 HA PHE 35 -8.357 1.247 -2.709
253 HB2 PHE 35 HB2 PHE 35 -7.475 4.096 -2.291
254 HB3 PHE 35 HB1 PHE 35 -7.615 2.909 -0.993
255 HD1 PHE 35 HD2 PHE 35 -6.230 0.845 -1.098
256 HD2 PHE 35 HD1 PHE 35 -5.595 4.162 -3.668
257 HE1 PHE 35 HE2 PHE 35 -3.991 0.029 -1.576
258 HE2 PHE 35 HE1 PHE 35 -3.332 3.348 -4.171
259 HZ PHE 35 HZ PHE 35 -2.514 1.284 -3.114
260 H GLU 36 HN GLU 36 -9.918 4.061 -3.760
261 HA GLU 36 HA GLU 36 -12.001 4.580 -2.067
262 HB2 GLU 36 HB2 GLU 36 -11.544 5.728 -4.132
263 HB3 GLU 36 HB1 GLU 36 -11.944 4.294 -5.051
264 HG2 GLU 36 HG2 GLU 36 -14.268 4.503 -4.155
265 HG3 GLU 36 HG1 GLU 36 -13.785 6.081 -3.509
266 H ASP 37 HN ASP 37 -11.823 2.063 -4.566
267 HA ASP 37 HA ASP 37 -14.431 1.019 -4.194
268 HB2 ASP 37 HB2 ASP 37 -12.018 -0.190 -5.550
269 HB3 ASP 37 HB1 ASP 37 -13.631 -0.886 -5.593
270 H ILE 38 HN ILE 38 -11.481 0.504 -2.556
271 HA ILE 38 HA ILE 38 -12.663 -1.824 -1.267
272 HB ILE 38 HB ILE 38 -10.311 -2.438 -0.545
273 HG12 ILE 38 HG12 ILE 38 -9.534 -0.550 -2.771
274 HG13 ILE 38 HG11 ILE 38 -9.324 -0.160 -1.078
275 HG21 ILE 38 HG21 ILE 38 -11.496 -3.615 -2.265
276 HG22 ILE 38 HG22 ILE 38 -9.794 -3.453 -2.737
277 HG23 ILE 38 HG23 ILE 38 -11.027 -2.402 -3.454
278 HD11 ILE 38 HD11 ILE 38 -7.784 -2.087 -0.876
279 HD12 ILE 38 HD12 ILE 38 -7.241 -0.901 -2.062
280 HD13 ILE 38 HD13 ILE 38 -7.995 -2.400 -2.600
281 H GLY 39 HN GLY 39 -12.981 0.994 -0.731
282 HA2 GLY 39 HA2 GLY 39 -13.458 2.291 1.122
283 HA3 GLY 39 HA1 GLY 39 -13.354 0.805 2.051
284 H TYR 40 HN TYR 40 -10.940 2.670 0.264
285 HA TYR 40 HA TYR 40 -9.502 3.063 2.776
286 HB2 TYR 40 HB2 TYR 40 -8.620 1.755 0.327
287 HB3 TYR 40 HB1 TYR 40 -7.554 3.053 0.841
288 HD1 TYR 40 HD2 TYR 40 -9.043 -0.150 1.757
289 HD2 TYR 40 HD1 TYR 40 -6.170 2.796 2.788
290 HE1 TYR 40 HE2 TYR 40 -8.067 -1.696 3.371
291 HE2 TYR 40 HE1 TYR 40 -5.178 1.246 4.424
292 HH TYR 40 HH TYR 40 -5.725 -0.677 5.656
293 H ASP 41 HN ASP 41 -9.424 5.102 3.195
294 HA ASP 41 HA ASP 41 -9.329 7.075 1.032
295 HB2 ASP 41 HB2 ASP 41 -9.606 7.447 4.041
296 HB3 ASP 41 HB1 ASP 41 -9.579 8.753 2.866
297 H SER 42 HN SER 42 -7.685 8.846 1.365
298 HA SER 42 HA SER 42 -5.112 7.805 1.474
299 HB2 SER 42 HB2 SER 42 -4.860 10.548 1.915
300 HB3 SER 42 HB1 SER 42 -4.893 9.737 0.345
301 H LEU 43 HN LEU 43 -7.113 9.233 3.895
302 HA LEU 43 HA LEU 43 -5.541 9.655 6.089
303 HB2 LEU 43 HB2 LEU 43 -8.146 8.152 5.930
304 HB3 LEU 43 HB1 LEU 43 -7.444 8.746 7.412
305 HG LEU 43 HG LEU 43 -8.344 10.491 5.120
306 HD11 LEU 43 HD11 LEU 43 -10.225 11.050 6.579
307 HD12 LEU 43 HD12 LEU 43 -9.656 9.870 7.765
308 HD13 LEU 43 HD13 LEU 43 -10.216 9.331 6.186
309 HD21 LEU 43 HD21 LEU 43 -6.571 11.467 6.477
310 HD22 LEU 43 HD22 LEU 43 -7.500 11.135 7.939
311 HD23 LEU 43 HD23 LEU 43 -8.107 12.288 6.751
312 H ALA 44 HN ALA 44 -6.841 6.545 4.999
313 HA ALA 44 HA ALA 44 -5.428 5.069 7.026
314 HB1 ALA 44 HB1 ALA 44 -6.512 3.107 6.066
315 HB2 ALA 44 HB2 ALA 44 -7.095 4.077 4.713
316 HB3 ALA 44 HB3 ALA 44 -7.685 4.395 6.345
317 H LEU 45 HN LEU 45 -5.112 5.778 3.632
318 HA LEU 45 HA LEU 45 -3.267 3.818 2.899
319 HB2 LEU 45 HB2 LEU 45 -3.630 6.604 1.838
320 HB3 LEU 45 HB1 LEU 45 -2.569 5.418 1.106
321 HG LEU 45 HG LEU 45 -5.554 5.151 1.416
322 HD11 LEU 45 HD11 LEU 45 -5.579 5.336 -1.016
323 HD12 LEU 45 HD12 LEU 45 -3.835 5.607 -1.011
324 HD13 LEU 45 HD13 LEU 45 -4.913 6.795 -0.274
325 HD21 LEU 45 HD21 LEU 45 -4.414 3.020 1.591
326 HD22 LEU 45 HD22 LEU 45 -3.522 3.363 0.107
327 HD23 LEU 45 HD23 LEU 45 -5.271 3.146 0.056
328 H MET 46 HN MET 46 -2.725 6.949 4.378
329 HA MET 46 HA MET 46 0.105 6.812 4.204
330 HB2 MET 46 HB2 MET 46 -1.626 8.390 6.109
331 HB3 MET 46 HB1 MET 46 0.111 8.587 5.937
332 HG2 MET 46 HG2 MET 46 -0.200 9.242 3.598
333 HG3 MET 46 HG1 MET 46 -1.945 9.022 3.823
334 HE1 MET 46 HE1 MET 46 -0.556 11.703 2.722
335 HE2 MET 46 HE2 MET 46 -1.503 12.929 3.568
336 HE3 MET 46 HE3 MET 46 -2.302 11.510 2.887
337 H GLU 47 HN GLU 47 -2.222 5.549 6.422
338 HA GLU 47 HA GLU 47 -0.380 4.955 8.513
339 HB2 GLU 47 HB2 GLU 47 -2.825 5.196 8.836
340 HB3 GLU 47 HB1 GLU 47 -3.060 3.722 7.916
341 HG2 GLU 47 HG2 GLU 47 -1.710 2.475 9.547
342 HG3 GLU 47 HG1 GLU 47 -1.557 3.936 10.512
343 H THR 48 HN THR 48 -1.892 3.145 5.861
344 HA THR 48 HA THR 48 -0.792 0.653 6.223
345 HB THR 48 HB THR 48 -1.170 2.102 3.580
346 HG1 THR 48 HG1 THR 48 -2.897 0.997 5.471
347 HG21 THR 48 HG21 THR 48 -1.653 -0.153 2.710
348 HG22 THR 48 HG22 THR 48 -1.353 -0.839 4.306
349 HG23 THR 48 HG23 THR 48 -0.034 -0.088 3.406
350 H ALA 49 HN ALA 49 0.486 3.362 4.304
351 HA ALA 49 HA ALA 49 2.946 2.286 3.611
352 HB1 ALA 49 HB1 ALA 49 2.026 4.339 2.646
353 HB2 ALA 49 HB2 ALA 49 3.667 4.583 3.244
354 HB3 ALA 49 HB3 ALA 49 2.291 5.174 4.177
355 H ALA 50 HN ALA 50 2.084 4.239 6.461
356 HA ALA 50 HA ALA 50 4.626 4.429 7.601
357 HB1 ALA 50 HB1 ALA 50 2.713 5.795 8.294
358 HB2 ALA 50 HB2 ALA 50 3.495 5.011 9.670
359 HB3 ALA 50 HB3 ALA 50 1.975 4.376 9.038
360 H ARG 51 HN ARG 51 2.136 1.968 8.042
361 HA ARG 51 HA ARG 51 3.549 0.559 10.062
362 HB2 ARG 51 HB2 ARG 51 1.100 0.380 9.700
363 HB3 ARG 51 HB1 ARG 51 1.410 -0.468 8.192
364 HG2 ARG 51 HG2 ARG 51 2.453 -2.284 9.387
365 HG3 ARG 51 HG1 ARG 51 2.254 -1.422 10.916
366 HD2 ARG 51 HD2 ARG 51 -0.191 -1.449 10.553
367 HD3 ARG 51 HD1 ARG 51 0.086 -2.411 9.098
368 HE ARG 51 HE ARG 51 1.309 -3.910 10.814
369 HH11 ARG 51 HH11 ARG 51 -1.842 -2.310 11.139
370 HH12 ARG 51 HH12 ARG 51 -2.485 -3.421 12.258
371 HH21 ARG 51 HH21 ARG 51 0.434 -5.463 12.402
372 HH22 ARG 51 HH22 ARG 51 -1.138 -5.239 13.012
373 H LEU 52 HN LEU 52 3.290 0.245 6.576
374 HA LEU 52 HA LEU 52 4.880 -2.061 6.340
375 HB2 LEU 52 HB2 LEU 52 4.304 0.121 4.354
376 HB3 LEU 52 HB1 LEU 52 5.088 -1.399 3.957
377 HG LEU 52 HG LEU 52 2.299 -1.149 5.081
378 HD11 LEU 52 HD11 LEU 52 1.531 -1.762 2.866
379 HD12 LEU 52 HD12 LEU 52 3.189 -1.775 2.279
380 HD13 LEU 52 HD13 LEU 52 2.454 -0.263 2.814
381 HD21 LEU 52 HD21 LEU 52 3.397 -3.221 5.699
382 HD22 LEU 52 HD22 LEU 52 3.820 -3.516 4.011
383 HD23 LEU 52 HD23 LEU 52 2.127 -3.522 4.511
384 H GLU 53 HN GLU 53 5.702 1.336 6.560
385 HA GLU 53 HA GLU 53 8.390 1.226 5.872
386 HB2 GLU 53 HB2 GLU 53 7.114 2.856 8.066
387 HB3 GLU 53 HB1 GLU 53 8.740 3.100 7.460
388 HG2 GLU 53 HG2 GLU 53 7.786 3.618 5.251
389 HG3 GLU 53 HG1 GLU 53 6.172 3.471 5.961
390 H SER 54 HN SER 54 6.812 0.598 8.947
391 HA SER 54 HA SER 54 9.160 -0.079 10.376
392 HB2 SER 54 HB2 SER 54 7.060 0.617 11.497
393 HB3 SER 54 HB1 SER 54 6.255 -0.819 10.881
394 HG SER 54 HG SER 54 8.571 -0.946 12.493
395 H ARG 55 HN ARG 55 6.578 -1.975 8.893
396 HA ARG 55 HA ARG 55 7.414 -4.517 9.536
397 HB2 ARG 55 HB2 ARG 55 5.179 -4.062 8.808
398 HB3 ARG 55 HB1 ARG 55 5.743 -3.515 7.243
399 HG2 ARG 55 HG2 ARG 55 6.431 -5.789 6.687
400 HG3 ARG 55 HG1 ARG 55 5.897 -6.339 8.277
401 HD2 ARG 55 HD2 ARG 55 3.632 -5.911 7.781
402 HD3 ARG 55 HD1 ARG 55 4.046 -4.930 6.374
403 HE ARG 55 HE ARG 55 5.010 -7.568 6.099
404 HH11 ARG 55 HH11 ARG 55 1.911 -5.826 6.025
405 HH12 ARG 55 HH12 ARG 55 1.243 -6.738 4.776
406 HH21 ARG 55 HH21 ARG 55 4.083 -8.858 4.353
407 HH22 ARG 55 HH22 ARG 55 2.532 -8.523 3.765
408 H TYR 56 HN TYR 56 8.419 -2.599 6.704
409 HA TYR 56 HA TYR 56 10.177 -4.859 6.029
410 HB2 TYR 56 HB2 TYR 56 8.913 -2.839 4.204
411 HB3 TYR 56 HB1 TYR 56 10.276 -3.831 3.704
412 HD1 TYR 56 HD1 TYR 56 6.728 -3.833 4.590
413 HD2 TYR 56 HD2 TYR 56 10.030 -6.205 3.354
414 HE1 TYR 56 HE1 TYR 56 5.199 -5.665 4.038
415 HE2 TYR 56 HE2 TYR 56 8.506 -8.052 2.799
416 HH TYR 56 HH TYR 56 6.372 -8.835 3.146
417 H GLY 57 HN GLY 57 10.377 -1.853 7.383
418 HA2 GLY 57 HA2 GLY 57 12.251 -0.620 7.932
419 HA3 GLY 57 HA1 GLY 57 13.229 -1.838 7.121
420 H VAL 58 HN VAL 58 10.799 0.552 6.215
421 HA VAL 58 HA VAL 58 12.623 1.553 4.173
422 HB VAL 58 HB VAL 58 10.769 1.870 2.523
423 HG11 VAL 58 HG11 VAL 58 11.289 -0.975 3.323
424 HG12 VAL 58 HG12 VAL 58 12.296 0.022 2.264
425 HG13 VAL 58 HG13 VAL 58 10.667 -0.440 1.759
426 HG21 VAL 58 HG21 VAL 58 8.866 1.765 4.033
427 HG22 VAL 58 HG22 VAL 58 9.219 0.070 4.383
428 HG23 VAL 58 HG23 VAL 58 8.709 0.548 2.764
429 H SER 59 HN SER 59 11.533 3.619 3.091
430 HA SER 59 HA SER 59 10.496 5.257 5.277
431 HB2 SER 59 HB2 SER 59 12.576 6.078 3.236
432 HB3 SER 59 HB1 SER 59 11.975 7.047 4.582
433 HG SER 59 HG SER 59 14.062 5.694 4.677
434 H ILE 60 HN ILE 60 8.519 5.752 4.619
435 HA ILE 60 HA ILE 60 8.141 6.487 1.800
436 HB ILE 60 HB ILE 60 6.131 5.080 3.593
437 HG12 ILE 60 HG12 ILE 60 7.576 4.066 1.130
438 HG13 ILE 60 HG11 ILE 60 7.989 3.630 2.783
439 HG21 ILE 60 HG21 ILE 60 5.933 5.921 0.693
440 HG22 ILE 60 HG22 ILE 60 5.066 6.649 2.043
441 HG23 ILE 60 HG23 ILE 60 4.723 4.983 1.573
442 HD11 ILE 60 HD11 ILE 60 5.800 2.576 3.037
443 HD12 ILE 60 HD12 ILE 60 6.714 1.891 1.688
444 HD13 ILE 60 HD13 ILE 60 5.401 3.027 1.378
445 HA PRO 61 HA PRO 61 7.114 10.325 3.917
446 HB2 PRO 61 HB2 PRO 61 6.501 11.119 1.129
447 HB3 PRO 61 HB1 PRO 61 7.559 11.899 2.306
448 HG2 PRO 61 HG2 PRO 61 8.569 10.552 0.230
449 HG3 PRO 61 HG1 PRO 61 9.347 10.521 1.823
450 HD2 PRO 61 HD2 PRO 61 7.637 8.456 0.505
451 HD3 PRO 61 HD1 PRO 61 9.091 8.249 1.505
452 H ASP 62 HN ASP 62 5.247 10.769 4.734
453 HA ASP 62 HA ASP 62 2.964 9.259 4.257
454 HB2 ASP 62 HB2 ASP 62 1.828 10.628 5.878
455 HB3 ASP 62 HB1 ASP 62 3.486 10.408 6.408
456 H ASP 63 HN ASP 63 3.785 12.438 3.059
457 HA ASP 63 HA ASP 63 1.253 13.112 2.023
458 HB2 ASP 63 HB2 ASP 63 2.357 14.879 0.787
459 HB3 ASP 63 HB1 ASP 63 3.069 14.766 2.386
460 H VAL 64 HN VAL 64 3.785 11.152 0.773
461 HA VAL 64 HA VAL 64 2.976 11.050 -1.968
462 HB VAL 64 HB VAL 64 4.518 9.116 -0.270
463 HG11 VAL 64 HG11 VAL 64 3.685 8.017 -2.318
464 HG12 VAL 64 HG12 VAL 64 5.431 8.243 -2.437
465 HG13 VAL 64 HG13 VAL 64 4.342 9.322 -3.306
466 HG21 VAL 64 HG21 VAL 64 5.544 11.313 -0.399
467 HG22 VAL 64 HG22 VAL 64 5.497 11.252 -2.163
468 HG23 VAL 64 HG23 VAL 64 6.521 10.127 -1.268
469 H ALA 65 HN ALA 65 2.374 9.062 0.869
470 HA ALA 65 HA ALA 65 0.943 6.996 -0.409
471 HB1 ALA 65 HB1 ALA 65 0.238 6.337 1.824
472 HB2 ALA 65 HB2 ALA 65 0.779 7.889 2.465
473 HB3 ALA 65 HB3 ALA 65 1.953 6.749 1.807
474 H GLY 66 HN GLY 66 0.016 10.144 0.607
475 HA2 GLY 66 HA2 GLY 66 -2.823 9.593 0.559
476 HA3 GLY 66 HA1 GLY 66 -2.073 11.175 0.720
477 H ARG 67 HN ARG 67 -0.660 9.671 -1.874
478 HA ARG 67 HA ARG 67 -2.550 10.914 -3.755
479 HB2 ARG 67 HB2 ARG 67 -0.361 12.088 -3.505
480 HB3 ARG 67 HB1 ARG 67 0.444 10.616 -4.025
481 HG2 ARG 67 HG2 ARG 67 -0.772 10.781 -6.180
482 HG3 ARG 67 HG1 ARG 67 -1.412 12.336 -5.648
483 HD2 ARG 67 HD2 ARG 67 0.809 13.240 -5.503
484 HD3 ARG 67 HD1 ARG 67 1.511 11.666 -5.890
485 HE ARG 67 HE ARG 67 -0.306 12.957 -7.775
486 HH11 ARG 67 HH11 ARG 67 2.963 11.729 -7.036
487 HH12 ARG 67 HH12 ARG 67 3.538 11.889 -8.618
488 HH21 ARG 67 HH21 ARG 67 0.470 13.167 -9.947
489 HH22 ARG 67 HH22 ARG 67 2.086 12.761 -10.336
490 H VAL 68 HN VAL 68 -1.487 7.922 -2.727
491 HA VAL 68 HA VAL 68 -0.990 6.775 -5.312
492 HB VAL 68 HB VAL 68 -0.953 4.546 -4.180
493 HG11 VAL 68 HG11 VAL 68 1.071 4.944 -2.847
494 HG12 VAL 68 HG12 VAL 68 0.725 6.673 -2.873
495 HG13 VAL 68 HG13 VAL 68 1.079 5.820 -4.378
496 HG21 VAL 68 HG21 VAL 68 -1.463 6.122 -1.649
497 HG22 VAL 68 HG22 VAL 68 -1.026 4.414 -1.730
498 HG23 VAL 68 HG23 VAL 68 -2.568 4.963 -2.387
499 H ASP 69 HN ASP 69 -2.420 6.511 -6.752
500 HA ASP 69 HA ASP 69 -5.243 6.397 -6.190
501 HB2 ASP 69 HB2 ASP 69 -3.792 6.012 -8.810
502 HB3 ASP 69 HB1 ASP 69 -5.530 6.126 -8.634
503 H THR 70 HN THR 70 -2.856 4.091 -7.427
504 HA THR 70 HA THR 70 -4.902 1.987 -7.243
505 HB THR 70 HB THR 70 -3.494 0.758 -8.886
506 HG1 THR 70 HG1 THR 70 -2.139 2.937 -9.848
507 HG21 THR 70 HG21 THR 70 -4.146 2.080 -10.859
508 HG22 THR 70 HG22 THR 70 -4.443 3.475 -9.815
509 HG23 THR 70 HG23 THR 70 -5.440 2.031 -9.660
510 HA PRO 71 HA PRO 71 -2.239 -0.150 -4.324
511 HB2 PRO 71 HB2 PRO 71 -3.070 -2.610 -5.791
512 HB3 PRO 71 HB1 PRO 71 -3.197 -2.240 -4.065
513 HG2 PRO 71 HG2 PRO 71 -5.361 -2.216 -5.585
514 HG3 PRO 71 HG1 PRO 71 -5.123 -0.966 -4.347
515 HD2 PRO 71 HD2 PRO 71 -4.689 -0.805 -7.308
516 HD3 PRO 71 HD1 PRO 71 -5.455 0.370 -6.218
517 H ARG 72 HN ARG 72 -2.191 -0.627 -7.762
518 HA ARG 72 HA ARG 72 0.218 -2.047 -8.041
519 HB2 ARG 72 HB2 ARG 72 -1.400 -1.757 -9.884
520 HB3 ARG 72 HB1 ARG 72 -1.045 -0.035 -9.933
521 HG2 ARG 72 HG2 ARG 72 1.285 -0.579 -10.544
522 HG3 ARG 72 HG1 ARG 72 0.847 -2.282 -10.584
523 HD2 ARG 72 HD2 ARG 72 -0.359 -0.116 -12.302
524 HD3 ARG 72 HD1 ARG 72 0.876 -1.257 -12.821
525 HE ARG 72 HE ARG 72 -1.892 -1.982 -12.099
526 HH11 ARG 72 HH11 ARG 72 1.102 -2.600 -13.927
527 HH12 ARG 72 HH12 ARG 72 0.425 -3.843 -14.871
528 HH21 ARG 72 HH21 ARG 72 -2.859 -3.695 -13.520
529 HH22 ARG 72 HH22 ARG 72 -1.850 -4.428 -14.659
530 H GLU 73 HN GLU 73 -0.553 1.417 -7.935
531 HA GLU 73 HA GLU 73 2.040 2.447 -8.338
532 HB2 GLU 73 HB2 GLU 73 -0.158 3.664 -8.560
533 HB3 GLU 73 HB1 GLU 73 -0.257 3.684 -6.810
534 HG2 GLU 73 HG2 GLU 73 0.526 5.813 -7.640
535 HG3 GLU 73 HG1 GLU 73 1.792 5.006 -6.717
536 H LEU 74 HN LEU 74 0.143 1.694 -5.477
537 HA LEU 74 HA LEU 74 1.953 2.593 -3.522
538 HB2 LEU 74 HB2 LEU 74 -0.509 2.072 -3.249
539 HB3 LEU 74 HB1 LEU 74 -0.115 0.379 -3.309
540 HG LEU 74 HG LEU 74 -0.649 1.279 -1.047
541 HD11 LEU 74 HD11 LEU 74 1.157 0.174 0.164
542 HD12 LEU 74 HD12 LEU 74 2.105 0.118 -1.325
543 HD13 LEU 74 HD13 LEU 74 0.592 -0.778 -1.209
544 HD21 LEU 74 HD21 LEU 74 1.046 2.580 0.154
545 HD22 LEU 74 HD22 LEU 74 0.365 3.459 -1.213
546 HD23 LEU 74 HD23 LEU 74 1.972 2.736 -1.342
547 H LEU 75 HN LEU 75 1.474 -0.571 -5.027
548 HA LEU 75 HA LEU 75 3.405 -2.086 -3.679
549 HB2 LEU 75 HB2 LEU 75 1.641 -2.980 -5.154
550 HB3 LEU 75 HB1 LEU 75 2.445 -2.278 -6.537
551 HG LEU 75 HG LEU 75 4.384 -3.788 -6.099
552 HD11 LEU 75 HD11 LEU 75 4.043 -5.701 -4.628
553 HD12 LEU 75 HD12 LEU 75 2.500 -5.018 -4.108
554 HD13 LEU 75 HD13 LEU 75 4.006 -4.176 -3.744
555 HD21 LEU 75 HD21 LEU 75 1.717 -5.129 -6.531
556 HD22 LEU 75 HD22 LEU 75 3.291 -5.797 -6.962
557 HD23 LEU 75 HD23 LEU 75 2.698 -4.344 -7.769
558 H ASP 76 HN ASP 76 3.558 -0.210 -6.664
559 HA ASP 76 HA ASP 76 6.194 -0.799 -7.405
560 HB2 ASP 76 HB2 ASP 76 4.569 0.136 -8.963
561 HB3 ASP 76 HB1 ASP 76 4.528 1.637 -8.046
562 H LEU 77 HN LEU 77 4.871 1.905 -5.588
563 HA LEU 77 HA LEU 77 7.138 3.424 -5.145
564 HB2 LEU 77 HB2 LEU 77 4.966 4.214 -4.530
565 HB3 LEU 77 HB1 LEU 77 4.743 2.897 -3.402
566 HG LEU 77 HG LEU 77 6.549 3.863 -1.989
567 HD11 LEU 77 HD11 LEU 77 7.763 5.102 -3.677
568 HD12 LEU 77 HD12 LEU 77 7.274 6.146 -2.347
569 HD13 LEU 77 HD13 LEU 77 6.394 6.200 -3.881
570 HD21 LEU 77 HD21 LEU 77 4.220 5.677 -2.578
571 HD22 LEU 77 HD22 LEU 77 5.200 5.697 -1.111
572 HD23 LEU 77 HD23 LEU 77 4.217 4.284 -1.493
573 H ILE 78 HN ILE 78 5.867 0.803 -3.127
574 HA ILE 78 HA ILE 78 7.992 0.996 -1.259
575 HB ILE 78 HB ILE 78 6.094 -1.339 -1.643
576 HG12 ILE 78 HG12 ILE 78 5.888 1.127 0.094
577 HG13 ILE 78 HG11 ILE 78 4.910 0.777 -1.326
578 HG21 ILE 78 HG21 ILE 78 8.077 -1.860 -0.265
579 HG22 ILE 78 HG22 ILE 78 6.616 -1.804 0.723
580 HG23 ILE 78 HG23 ILE 78 7.745 -0.447 0.737
581 HD11 ILE 78 HD11 ILE 78 3.963 -1.155 -0.186
582 HD12 ILE 78 HD12 ILE 78 3.697 0.344 0.708
583 HD13 ILE 78 HD13 ILE 78 4.946 -0.782 1.233
584 H ASN 79 HN ASN 79 7.322 -1.259 -3.934
585 HA ASN 79 HA ASN 79 9.620 -2.836 -3.548
586 HB2 ASN 79 HB2 ASN 79 8.021 -2.311 -6.050
587 HB3 ASN 79 HB1 ASN 79 9.422 -3.371 -6.037
588 HD21 ASN 79 HD21 ASN 79 6.686 -3.968 -6.634
589 HD22 ASN 79 HD22 ASN 79 6.177 -5.200 -5.518
590 H GLY 80 HN GLY 80 9.203 0.241 -5.119
591 HA2 GLY 80 HA2 GLY 80 11.706 0.382 -6.417
592 HA3 GLY 80 HA1 GLY 80 10.732 1.755 -5.906
593 H ALA 81 HN ALA 81 10.733 0.912 -3.123
594 HA ALA 81 HA ALA 81 13.316 1.970 -2.348
595 HB1 ALA 81 HB1 ALA 81 11.284 2.772 -1.215
596 HB2 ALA 81 HB2 ALA 81 12.372 1.992 -0.071
597 HB3 ALA 81 HB3 ALA 81 10.943 1.137 -0.652
598 H LEU 82 HN LEU 82 11.444 -0.976 -1.963
599 HA LEU 82 HA LEU 82 13.175 -2.454 -0.335
600 HB2 LEU 82 HB2 LEU 82 11.117 -3.331 -2.332
601 HB3 LEU 82 HB1 LEU 82 11.967 -4.437 -1.279
602 HG LEU 82 HG LEU 82 10.181 -2.193 -0.333
603 HD11 LEU 82 HD11 LEU 82 9.703 -5.167 -0.479
604 HD12 LEU 82 HD12 LEU 82 8.927 -3.945 -1.485
605 HD13 LEU 82 HD13 LEU 82 8.621 -3.983 0.251
606 HD21 LEU 82 HD21 LEU 82 11.502 -4.468 1.146
607 HD22 LEU 82 HD22 LEU 82 10.382 -3.295 1.841
608 HD23 LEU 82 HD23 LEU 82 11.957 -2.769 1.247
609 H ALA 83 HN ALA 83 13.186 -1.973 -3.785
610 HA ALA 83 HA ALA 83 14.809 -4.060 -4.606
611 HB1 ALA 83 HB1 ALA 83 14.779 -1.256 -5.715
612 HB2 ALA 83 HB2 ALA 83 13.659 -2.545 -6.149
613 HB3 ALA 83 HB3 ALA 83 15.374 -2.696 -6.539
614 H GLU 84 HN GLU 84 15.697 -1.042 -3.070
615 HA GLU 84 HA GLU 84 18.402 -2.097 -2.989
616 HB2 GLU 84 HB2 GLU 84 18.267 0.078 -4.203
617 HB3 GLU 84 HB1 GLU 84 17.623 0.823 -2.746
618 HG2 GLU 84 HG2 GLU 84 19.687 0.342 -1.563
619 HG3 GLU 84 HG1 GLU 84 20.330 -0.462 -2.993
620 H ALA 85 HN ALA 85 17.385 -3.354 -1.407
621 HA ALA 85 HA ALA 85 17.927 -2.325 1.250
622 HB1 ALA 85 HB1 ALA 85 15.319 -3.695 0.522
623 HB2 ALA 85 HB2 ALA 85 15.493 -2.015 1.029
624 HB3 ALA 85 HB3 ALA 85 15.846 -3.319 2.165
625 H ALA 86 HN ALA 86 16.601 -5.051 -0.558
626 HA ALA 86 HA ALA 86 17.253 -7.136 -0.952
627 HB1 ALA 86 HB1 ALA 86 19.513 -7.938 -0.508
628 HB2 ALA 86 HB2 ALA 86 19.836 -6.535 0.511
629 HB3 ALA 86 HB3 ALA 86 19.575 -6.325 -1.223
630 H28 SXV 87 H28A SXV 87 -7.008 14.072 3.182
631 H28A SXV 87 H28B SXV 87 -7.169 12.832 4.431
632 H30 SXV 87 H30C SXV 87 -4.382 11.816 4.387
633 H30A SXV 87 H30A SXV 87 -5.311 12.222 5.831
634 H30B SXV 87 H30B SXV 87 -3.707 12.918 5.588
635 H31 SXV 87 H31C SXV 87 -4.704 15.072 2.733
636 H31A SXV 87 H31A SXV 87 -3.967 13.473 2.649
637 H31B SXV 87 H31B SXV 87 -3.350 14.664 3.794
638 H32 SXV 87 H32A SXV 87 -4.679 15.238 5.937
639 HO33 SXV 87 H33A SXV 87 -7.322 14.840 6.100
640 HN36 SXV 87 H36A SXV 87 -4.611 16.767 3.978
641 H37 SXV 87 H37B SXV 87 -6.794 18.627 4.083
642 H37A SXV 87 H37A SXV 87 -6.637 17.854 2.513
643 H38 SXV 87 H38B SXV 87 -4.458 19.414 3.930
644 H38A SXV 87 H38A SXV 87 -5.494 20.034 2.644
645 HN41 SXV 87 H41A SXV 87 -2.961 20.302 2.271
646 H42 SXV 87 H42B SXV 87 -2.366 19.312 -0.216
647 H42A SXV 87 H42A SXV 87 -1.567 18.210 0.898
648 H43 SXV 87 H43B SXV 87 -1.223 21.204 0.870
649 H43A SXV 87 H43A SXV 87 -0.287 20.070 1.827
650 H1 SXV 87 H1B SXV 87 -0.091 20.287 -2.800
651 H1A SXV 87 H1A SXV 87 -1.545 19.883 -1.873
652 H2 SXV 87 H2A SXV 87 -1.575 22.143 -0.948
653 H2A SXV 87 H2B SXV 87 -1.923 22.041 -2.676
654 H4 SXV 87 H4C SXV 87 -0.527 24.480 -0.798
655 H4A SXV 87 H4A SXV 87 1.115 24.555 -1.443
656 H4B SXV 87 H4B SXV 87 0.691 23.323 -0.245
Start of MODEL 10
1 H1 MET 1 HT1 MET 1 20.862 -6.790 -5.342
2 H2 MET 1 HT2 MET 1 20.924 -6.012 -3.849
3 H3 MET 1 HT3 MET 1 19.709 -5.594 -4.977
4 HA MET 1 HA MET 1 18.749 -7.751 -4.792
5 HB2 MET 1 HB2 MET 1 20.770 -9.013 -4.178
6 HB3 MET 1 HB1 MET 1 20.861 -8.153 -2.647
7 HG2 MET 1 HG2 MET 1 18.728 -9.157 -1.966
8 HG3 MET 1 HG1 MET 1 18.655 -10.027 -3.494
9 HE1 MET 1 HE1 MET 1 19.376 -12.848 -0.860
10 HE2 MET 1 HE2 MET 1 18.288 -12.283 -2.130
11 HE3 MET 1 HE3 MET 1 18.403 -11.398 -0.609
12 H ALA 2 HN ALA 2 16.895 -7.261 -3.947
13 HA ALA 2 HA ALA 2 16.736 -6.122 -1.267
14 HB1 ALA 2 HB1 ALA 2 16.732 -4.227 -2.803
15 HB2 ALA 2 HB2 ALA 2 15.144 -4.442 -2.069
16 HB3 ALA 2 HB3 ALA 2 15.429 -4.966 -3.728
17 H THR 3 HN THR 3 14.774 -6.712 -0.229
18 HA THR 3 HA THR 3 13.370 -8.909 -1.451
19 HB THR 3 HB THR 3 12.833 -7.424 1.060
20 HG1 THR 3 HG1 THR 3 14.932 -9.034 0.379
21 HG21 THR 3 HG21 THR 3 11.045 -8.940 0.385
22 HG22 THR 3 HG22 THR 3 11.851 -9.574 1.819
23 HG23 THR 3 HG23 THR 3 12.199 -10.265 0.235
24 H LEU 4 HN LEU 4 11.991 -8.216 -3.025
25 HA LEU 4 HA LEU 4 10.459 -5.781 -2.601
26 HB2 LEU 4 HB2 LEU 4 10.466 -7.661 -4.969
27 HB3 LEU 4 HB1 LEU 4 9.675 -6.103 -4.895
28 HG LEU 4 HG LEU 4 12.646 -6.615 -4.910
29 HD11 LEU 4 HD11 LEU 4 10.824 -5.297 -6.907
30 HD12 LEU 4 HD12 LEU 4 11.594 -6.876 -7.071
31 HD13 LEU 4 HD13 LEU 4 12.580 -5.414 -7.034
32 HD21 LEU 4 HD21 LEU 4 12.135 -4.727 -3.451
33 HD22 LEU 4 HD22 LEU 4 11.166 -3.992 -4.729
34 HD23 LEU 4 HD23 LEU 4 12.907 -4.183 -4.940
35 H LEU 5 HN LEU 5 8.543 -5.885 -1.656
36 HA LEU 5 HA LEU 5 7.355 -8.385 -1.127
37 HB2 LEU 5 HB2 LEU 5 5.467 -7.099 -0.122
38 HB3 LEU 5 HB1 LEU 5 7.033 -6.742 0.552
39 HG LEU 5 HG LEU 5 7.004 -4.604 -0.849
40 HD11 LEU 5 HD11 LEU 5 5.253 -5.204 -2.436
41 HD12 LEU 5 HD12 LEU 5 4.825 -3.751 -1.531
42 HD13 LEU 5 HD13 LEU 5 4.083 -5.295 -1.120
43 HD21 LEU 5 HD21 LEU 5 4.925 -5.015 1.267
44 HD22 LEU 5 HD22 LEU 5 5.552 -3.449 0.742
45 HD23 LEU 5 HD23 LEU 5 6.621 -4.620 1.528
46 H THR 6 HN THR 6 5.500 -9.318 -1.897
47 HA THR 6 HA THR 6 4.950 -8.561 -4.616
48 HB THR 6 HB THR 6 3.790 -10.793 -4.616
49 HG1 THR 6 HG1 THR 6 4.285 -12.144 -2.817
50 HG21 THR 6 HG21 THR 6 5.892 -12.081 -4.646
51 HG22 THR 6 HG22 THR 6 6.712 -10.764 -3.806
52 HG23 THR 6 HG23 THR 6 6.102 -10.522 -5.441
53 H THR 7 HN THR 7 2.515 -9.354 -5.121
54 HA THR 7 HA THR 7 0.849 -7.472 -3.895
55 HB THR 7 HB THR 7 -0.905 -8.788 -5.290
56 HG1 THR 7 HG1 THR 7 -0.039 -10.600 -5.977
57 HG21 THR 7 HG21 THR 7 -0.109 -7.662 -7.335
58 HG22 THR 7 HG22 THR 7 1.470 -7.428 -6.586
59 HG23 THR 7 HG23 THR 7 0.052 -6.615 -5.925
60 H ASP 8 HN ASP 8 1.709 -10.594 -2.987
61 HA ASP 8 HA ASP 8 -0.757 -11.242 -1.663
62 HB2 ASP 8 HB2 ASP 8 1.990 -12.509 -1.467
63 HB3 ASP 8 HB1 ASP 8 0.563 -13.121 -0.638
64 H ASP 9 HN ASP 9 2.448 -10.149 -0.689
65 HA ASP 9 HA ASP 9 1.780 -9.867 2.069
66 HB2 ASP 9 HB2 ASP 9 4.139 -10.058 1.278
67 HB3 ASP 9 HB1 ASP 9 3.979 -8.485 0.513
68 H LEU 10 HN LEU 10 1.862 -7.695 -0.695
69 HA LEU 10 HA LEU 10 1.200 -5.275 0.493
70 HB2 LEU 10 HB2 LEU 10 1.838 -5.523 -1.861
71 HB3 LEU 10 HB1 LEU 10 0.337 -6.361 -2.190
72 HG LEU 10 HG LEU 10 -0.879 -4.265 -1.555
73 HD11 LEU 10 HD11 LEU 10 1.880 -3.069 -1.618
74 HD12 LEU 10 HD12 LEU 10 0.834 -3.223 -0.209
75 HD13 LEU 10 HD13 LEU 10 0.365 -2.169 -1.542
76 HD21 LEU 10 HD21 LEU 10 1.059 -4.084 -3.857
77 HD22 LEU 10 HD22 LEU 10 -0.408 -3.123 -3.666
78 HD23 LEU 10 HD23 LEU 10 -0.521 -4.871 -3.877
79 H ARG 11 HN ARG 11 -0.903 -7.852 -0.721
80 HA ARG 11 HA ARG 11 -3.422 -6.756 -0.302
81 HB2 ARG 11 HB2 ARG 11 -2.969 -8.897 -1.435
82 HB3 ARG 11 HB1 ARG 11 -2.562 -9.612 0.115
83 HG2 ARG 11 HG2 ARG 11 -4.919 -9.004 0.846
84 HG3 ARG 11 HG1 ARG 11 -5.246 -8.681 -0.860
85 HD2 ARG 11 HD2 ARG 11 -4.399 -11.273 0.402
86 HD3 ARG 11 HD1 ARG 11 -5.908 -10.923 -0.438
87 HE ARG 11 HE ARG 11 -4.466 -10.601 -2.452
88 HH11 ARG 11 HH11 ARG 11 -3.630 -12.789 0.193
89 HH12 ARG 11 HH12 ARG 11 -2.589 -13.775 -0.715
90 HH21 ARG 11 HH21 ARG 11 -2.995 -11.938 -3.751
91 HH22 ARG 11 HH22 ARG 11 -2.153 -13.241 -3.024
92 H ARG 12 HN ARG 12 -1.481 -8.792 1.841
93 HA ARG 12 HA ARG 12 -3.289 -8.897 3.972
94 HB2 ARG 12 HB2 ARG 12 -0.279 -9.078 4.149
95 HB3 ARG 12 HB1 ARG 12 -1.426 -9.653 5.348
96 HG2 ARG 12 HG2 ARG 12 -2.300 -11.256 3.665
97 HG3 ARG 12 HG1 ARG 12 -1.020 -10.735 2.567
98 HD2 ARG 12 HD2 ARG 12 -0.299 -12.730 3.662
99 HD3 ARG 12 HD1 ARG 12 0.637 -11.379 4.310
100 HE ARG 12 HE ARG 12 -1.763 -12.166 5.738
101 HH11 ARG 12 HH11 ARG 12 1.790 -12.123 5.675
102 HH12 ARG 12 HH12 ARG 12 1.973 -12.723 7.250
103 HH21 ARG 12 HH21 ARG 12 -1.524 -12.936 7.929
104 HH22 ARG 12 HH22 ARG 12 0.002 -13.246 8.577
105 H ALA 13 HN ALA 13 -0.549 -6.743 3.413
106 HA ALA 13 HA ALA 13 -0.803 -5.299 5.818
107 HB1 ALA 13 HB1 ALA 13 0.406 -4.430 3.214
108 HB2 ALA 13 HB2 ALA 13 1.229 -5.338 4.483
109 HB3 ALA 13 HB3 ALA 13 0.679 -3.691 4.789
110 H LEU 14 HN LEU 14 -2.228 -4.890 2.633
111 HA LEU 14 HA LEU 14 -3.319 -2.331 3.143
112 HB2 LEU 14 HB2 LEU 14 -2.976 -3.250 0.863
113 HB3 LEU 14 HB1 LEU 14 -4.240 -4.421 1.160
114 HG LEU 14 HG LEU 14 -5.901 -2.610 1.290
115 HD11 LEU 14 HD11 LEU 14 -5.290 -0.326 0.677
116 HD12 LEU 14 HD12 LEU 14 -3.588 -0.790 0.620
117 HD13 LEU 14 HD13 LEU 14 -4.462 -0.833 2.150
118 HD21 LEU 14 HD21 LEU 14 -4.174 -2.501 -1.185
119 HD22 LEU 14 HD22 LEU 14 -5.849 -1.960 -1.067
120 HD23 LEU 14 HD23 LEU 14 -5.459 -3.666 -0.863
121 H VAL 15 HN VAL 15 -4.401 -5.579 3.792
122 HA VAL 15 HA VAL 15 -7.027 -4.813 4.649
123 HB VAL 15 HB VAL 15 -5.388 -7.241 5.496
124 HG11 VAL 15 HG11 VAL 15 -7.231 -6.787 7.028
125 HG12 VAL 15 HG12 VAL 15 -7.549 -8.244 6.087
126 HG13 VAL 15 HG13 VAL 15 -8.361 -6.735 5.675
127 HG21 VAL 15 HG21 VAL 15 -7.454 -6.973 3.309
128 HG22 VAL 15 HG22 VAL 15 -6.671 -8.473 3.806
129 HG23 VAL 15 HG23 VAL 15 -5.718 -7.181 3.075
130 H GLU 16 HN GLU 16 -3.954 -5.445 6.255
131 HA GLU 16 HA GLU 16 -4.601 -5.001 8.916
132 HB2 GLU 16 HB2 GLU 16 -1.915 -4.378 7.592
133 HB3 GLU 16 HB1 GLU 16 -2.246 -4.490 9.294
134 HG2 GLU 16 HG2 GLU 16 -2.846 -6.804 9.152
135 HG3 GLU 16 HG1 GLU 16 -2.657 -6.774 7.398
136 H SER 17 HN SER 17 -4.436 -2.683 6.445
137 HA SER 17 HA SER 17 -3.721 -0.395 7.965
138 HB2 SER 17 HB2 SER 17 -5.316 -0.533 5.416
139 HB3 SER 17 HB1 SER 17 -4.387 0.838 6.029
140 HG SER 17 HG SER 17 -3.041 -1.604 5.656
141 H ALA 18 HN ALA 18 -6.740 -2.044 7.267
142 HA ALA 18 HA ALA 18 -8.208 0.006 8.751
143 HB1 ALA 18 HB1 ALA 18 -9.236 -2.287 7.083
144 HB2 ALA 18 HB2 ALA 18 -9.118 -0.605 6.564
145 HB3 ALA 18 HB3 ALA 18 -10.224 -1.052 7.864
146 H GLY 19 HN GLY 19 -7.049 -3.220 8.840
147 HA2 GLY 19 HA2 GLY 19 -6.690 -4.318 10.906
148 HA3 GLY 19 HA1 GLY 19 -8.086 -3.465 11.563
149 H GLU 20 HN GLU 20 -9.517 -4.969 12.050
150 HA GLU 20 HA GLU 20 -9.856 -7.236 10.362
151 HB2 GLU 20 HB2 GLU 20 -11.446 -6.297 12.750
152 HB3 GLU 20 HB1 GLU 20 -11.750 -7.802 11.894
153 HG2 GLU 20 HG2 GLU 20 -9.244 -7.052 13.387
154 HG3 GLU 20 HG1 GLU 20 -10.447 -8.253 13.860
155 H THR 21 HN THR 21 -10.396 -6.601 8.449
156 HA THR 21 HA THR 21 -13.127 -5.725 8.062
157 HB THR 21 HB THR 21 -10.785 -4.411 6.675
158 HG1 THR 21 HG1 THR 21 -11.998 -3.933 9.014
159 HG21 THR 21 HG21 THR 21 -12.798 -4.544 5.264
160 HG22 THR 21 HG22 THR 21 -12.491 -2.876 5.742
161 HG23 THR 21 HG23 THR 21 -13.756 -3.806 6.547
162 H ASP 22 HN ASP 22 -13.165 -7.981 7.627
163 HA ASP 22 HA ASP 22 -11.994 -8.889 5.132
164 HB2 ASP 22 HB2 ASP 22 -13.928 -10.269 7.026
165 HB3 ASP 22 HB1 ASP 22 -13.315 -10.997 5.547
166 H GLY 23 HN GLY 23 -13.537 -9.890 3.510
167 HA2 GLY 23 HA2 GLY 23 -15.623 -9.688 2.360
168 HA3 GLY 23 HA1 GLY 23 -15.934 -8.200 3.255
169 H THR 24 HN THR 24 -13.467 -6.956 2.922
170 HA THR 24 HA THR 24 -13.625 -5.935 0.267
171 HB THR 24 HB THR 24 -11.461 -5.506 2.361
172 HG1 THR 24 HG1 THR 24 -12.962 -3.532 2.683
173 HG21 THR 24 HG21 THR 24 -10.943 -4.632 0.113
174 HG22 THR 24 HG22 THR 24 -11.206 -3.317 1.259
175 HG23 THR 24 HG23 THR 24 -12.468 -3.748 0.105
176 H ASP 25 HN ASP 25 -13.262 -7.902 -0.875
177 HA ASP 25 HA ASP 25 -10.972 -9.511 -0.541
178 HB2 ASP 25 HB2 ASP 25 -12.944 -10.445 -1.573
179 HB3 ASP 25 HB1 ASP 25 -12.813 -9.307 -2.917
180 H LEU 26 HN LEU 26 -9.017 -9.244 -1.104
181 HA LEU 26 HA LEU 26 -8.304 -7.504 -3.398
182 HB2 LEU 26 HB2 LEU 26 -6.829 -7.902 -0.803
183 HB3 LEU 26 HB1 LEU 26 -6.362 -6.845 -2.116
184 HG LEU 26 HG LEU 26 -8.905 -6.459 -0.567
185 HD11 LEU 26 HD11 LEU 26 -7.673 -4.819 0.739
186 HD12 LEU 26 HD12 LEU 26 -6.186 -5.298 -0.112
187 HD13 LEU 26 HD13 LEU 26 -7.040 -6.464 0.907
188 HD21 LEU 26 HD21 LEU 26 -7.236 -4.619 -2.289
189 HD22 LEU 26 HD22 LEU 26 -8.714 -4.176 -1.435
190 HD23 LEU 26 HD23 LEU 26 -8.773 -5.350 -2.751
191 H SER 27 HN SER 27 -8.771 -10.379 -2.909
192 HA SER 27 HA SER 27 -6.227 -11.657 -2.756
193 HB2 SER 27 HB2 SER 27 -8.823 -12.944 -3.554
194 HB3 SER 27 HB1 SER 27 -7.397 -13.737 -2.878
195 HG SER 27 HG SER 27 -9.399 -12.316 -1.680
196 H GLY 28 HN GLY 28 -7.829 -10.348 -5.277
197 HA2 GLY 28 HA2 GLY 28 -5.801 -11.121 -7.132
198 HA3 GLY 28 HA1 GLY 28 -7.270 -12.034 -7.427
199 H ASP 29 HN ASP 29 -5.658 -9.802 -8.748
200 HA ASP 29 HA ASP 29 -6.018 -8.149 -10.250
201 HB2 ASP 29 HB2 ASP 29 -8.912 -9.011 -10.080
202 HB3 ASP 29 HB1 ASP 29 -8.276 -7.900 -11.287
203 H PHE 30 HN PHE 30 -6.028 -7.587 -7.561
204 HA PHE 30 HA PHE 30 -7.982 -5.488 -7.143
205 HB2 PHE 30 HB2 PHE 30 -7.123 -5.288 -4.897
206 HB3 PHE 30 HB1 PHE 30 -7.328 -6.991 -5.273
207 HD1 PHE 30 HD2 PHE 30 -5.165 -8.185 -6.157
208 HD2 PHE 30 HD1 PHE 30 -5.161 -4.591 -3.880
209 HE1 PHE 30 HE2 PHE 30 -2.836 -8.611 -5.500
210 HE2 PHE 30 HE1 PHE 30 -2.827 -5.010 -3.226
211 HZ PHE 30 HZ PHE 30 -1.703 -6.992 -3.892
212 H LEU 31 HN LEU 31 -5.259 -5.574 -8.887
213 HA LEU 31 HA LEU 31 -4.027 -3.136 -7.931
214 HB2 LEU 31 HB2 LEU 31 -3.471 -4.750 -10.422
215 HB3 LEU 31 HB1 LEU 31 -2.517 -3.396 -9.861
216 HG LEU 31 HG LEU 31 -2.823 -6.059 -8.474
217 HD11 LEU 31 HD11 LEU 31 -1.433 -6.159 -10.463
218 HD12 LEU 31 HD12 LEU 31 -0.451 -6.325 -9.006
219 HD13 LEU 31 HD13 LEU 31 -0.477 -4.797 -9.883
220 HD21 LEU 31 HD21 LEU 31 -2.597 -4.246 -6.849
221 HD22 LEU 31 HD22 LEU 31 -1.176 -3.645 -7.702
222 HD23 LEU 31 HD23 LEU 31 -1.126 -5.219 -6.908
223 H ASP 32 HN ASP 32 -6.510 -4.041 -10.025
224 HA ASP 32 HA ASP 32 -6.437 -1.509 -11.479
225 HB2 ASP 32 HB2 ASP 32 -6.886 -3.715 -12.666
226 HB3 ASP 32 HB1 ASP 32 -8.432 -3.760 -11.828
227 H LEU 33 HN LEU 33 -7.518 -2.608 -8.644
228 HA LEU 33 HA LEU 33 -10.039 -1.238 -8.537
229 HB2 LEU 33 HB2 LEU 33 -8.321 -2.593 -6.471
230 HB3 LEU 33 HB1 LEU 33 -9.725 -1.648 -6.027
231 HG LEU 33 HG LEU 33 -9.831 -4.079 -7.823
232 HD11 LEU 33 HD11 LEU 33 -9.137 -4.660 -5.527
233 HD12 LEU 33 HD12 LEU 33 -10.779 -5.213 -5.867
234 HD13 LEU 33 HD13 LEU 33 -10.519 -3.766 -4.892
235 HD21 LEU 33 HD21 LEU 33 -11.621 -2.459 -8.173
236 HD22 LEU 33 HD22 LEU 33 -11.948 -2.450 -6.439
237 HD23 LEU 33 HD23 LEU 33 -12.232 -3.918 -7.384
238 H ARG 34 HN ARG 34 -10.393 0.716 -7.588
239 HA ARG 34 HA ARG 34 -8.014 2.304 -7.082
240 HB2 ARG 34 HB2 ARG 34 -10.923 3.038 -7.452
241 HB3 ARG 34 HB1 ARG 34 -9.619 4.178 -7.171
242 HG2 ARG 34 HG2 ARG 34 -9.823 2.363 -9.557
243 HG3 ARG 34 HG1 ARG 34 -10.339 4.052 -9.520
244 HD2 ARG 34 HD2 ARG 34 -8.078 4.714 -8.918
245 HD3 ARG 34 HD1 ARG 34 -7.542 3.044 -9.012
246 HE ARG 34 HE ARG 34 -8.333 3.195 -11.413
247 HH11 ARG 34 HH11 ARG 34 -7.277 6.053 -9.637
248 HH12 ARG 34 HH12 ARG 34 -6.679 6.900 -10.996
249 HH21 ARG 34 HH21 ARG 34 -7.515 4.336 -13.340
250 HH22 ARG 34 HH22 ARG 34 -6.822 5.871 -13.164
251 H PHE 35 HN PHE 35 -8.228 3.681 -5.125
252 HA PHE 35 HA PHE 35 -9.091 1.989 -3.011
253 HB2 PHE 35 HB2 PHE 35 -7.877 4.742 -2.925
254 HB3 PHE 35 HB1 PHE 35 -8.292 3.804 -1.485
255 HD1 PHE 35 HD2 PHE 35 -7.347 1.408 -1.370
256 HD2 PHE 35 HD1 PHE 35 -5.814 4.458 -3.878
257 HE1 PHE 35 HE2 PHE 35 -5.226 0.180 -1.555
258 HE2 PHE 35 HE1 PHE 35 -3.716 3.249 -4.093
259 HZ PHE 35 HZ PHE 35 -3.399 1.098 -2.917
260 H GLU 36 HN GLU 36 -10.487 4.541 -4.723
261 HA GLU 36 HA GLU 36 -12.568 5.278 -2.993
262 HB2 GLU 36 HB2 GLU 36 -13.812 5.862 -5.077
263 HB3 GLU 36 HB1 GLU 36 -12.164 6.479 -5.075
264 HG2 GLU 36 HG2 GLU 36 -11.455 4.673 -6.516
265 HG3 GLU 36 HG1 GLU 36 -13.062 3.969 -6.463
266 H ASP 37 HN ASP 37 -12.099 2.428 -5.002
267 HA ASP 37 HA ASP 37 -14.796 1.479 -4.934
268 HB2 ASP 37 HB2 ASP 37 -12.247 -0.035 -5.546
269 HB3 ASP 37 HB1 ASP 37 -13.871 -0.642 -5.792
270 H ILE 38 HN ILE 38 -11.991 1.089 -2.959
271 HA ILE 38 HA ILE 38 -13.417 -0.960 -1.436
272 HB ILE 38 HB ILE 38 -11.203 -1.652 -0.503
273 HG12 ILE 38 HG12 ILE 38 -10.114 0.151 -2.682
274 HG13 ILE 38 HG11 ILE 38 -10.007 0.488 -0.963
275 HG21 ILE 38 HG21 ILE 38 -10.518 -2.836 -2.552
276 HG22 ILE 38 HG22 ILE 38 -11.562 -1.751 -3.488
277 HG23 ILE 38 HG23 ILE 38 -12.271 -2.852 -2.312
278 HD11 ILE 38 HD11 ILE 38 -8.623 -1.509 -0.669
279 HD12 ILE 38 HD12 ILE 38 -7.910 -0.386 -1.828
280 HD13 ILE 38 HD13 ILE 38 -8.735 -1.837 -2.398
281 H GLY 39 HN GLY 39 -13.515 1.975 -1.246
282 HA2 GLY 39 HA2 GLY 39 -13.893 3.553 0.406
283 HA3 GLY 39 HA1 GLY 39 -14.096 2.186 1.482
284 H TYR 40 HN TYR 40 -11.178 3.217 -0.219
285 HA TYR 40 HA TYR 40 -9.900 3.603 2.387
286 HB2 TYR 40 HB2 TYR 40 -9.039 2.152 -0.004
287 HB3 TYR 40 HB1 TYR 40 -7.820 3.239 0.649
288 HD1 TYR 40 HD2 TYR 40 -9.921 0.292 1.390
289 HD2 TYR 40 HD1 TYR 40 -6.741 2.790 2.681
290 HE1 TYR 40 HE2 TYR 40 -9.342 -1.344 3.136
291 HE2 TYR 40 HE1 TYR 40 -6.144 1.166 4.411
292 HH TYR 40 HH TYR 40 -7.099 -1.887 4.425
293 H ASP 41 HN ASP 41 -9.100 5.494 2.829
294 HA ASP 41 HA ASP 41 -8.903 7.482 0.675
295 HB2 ASP 41 HB2 ASP 41 -9.024 7.836 3.679
296 HB3 ASP 41 HB1 ASP 41 -8.636 9.140 2.573
297 H SER 42 HN SER 42 -7.123 9.097 1.086
298 HA SER 42 HA SER 42 -4.621 7.971 0.660
299 HB2 SER 42 HB2 SER 42 -3.918 10.349 1.111
300 HB3 SER 42 HB1 SER 42 -5.213 10.165 -0.087
301 H LEU 43 HN LEU 43 -6.045 9.483 3.410
302 HA LEU 43 HA LEU 43 -4.006 9.410 5.289
303 HB2 LEU 43 HB2 LEU 43 -6.943 9.089 5.843
304 HB3 LEU 43 HB1 LEU 43 -5.726 9.738 6.926
305 HG LEU 43 HG LEU 43 -6.659 11.012 4.359
306 HD11 LEU 43 HD11 LEU 43 -8.323 11.143 6.105
307 HD12 LEU 43 HD12 LEU 43 -7.602 12.720 5.789
308 HD13 LEU 43 HD13 LEU 43 -7.121 11.802 7.219
309 HD21 LEU 43 HD21 LEU 43 -5.297 12.913 5.042
310 HD22 LEU 43 HD22 LEU 43 -4.314 11.472 4.780
311 HD23 LEU 43 HD23 LEU 43 -4.702 11.992 6.422
312 H ALA 44 HN ALA 44 -6.403 6.950 4.496
313 HA ALA 44 HA ALA 44 -5.602 5.123 6.524
314 HB1 ALA 44 HB1 ALA 44 -7.025 3.527 5.353
315 HB2 ALA 44 HB2 ALA 44 -7.148 4.635 3.984
316 HB3 ALA 44 HB3 ALA 44 -7.839 5.080 5.546
317 H LEU 45 HN LEU 45 -4.663 5.740 3.244
318 HA LEU 45 HA LEU 45 -3.168 3.360 2.789
319 HB2 LEU 45 HB2 LEU 45 -2.887 6.083 1.529
320 HB3 LEU 45 HB1 LEU 45 -2.221 4.586 0.899
321 HG LEU 45 HG LEU 45 -5.147 5.188 1.223
322 HD11 LEU 45 HD11 LEU 45 -3.432 5.087 -1.240
323 HD12 LEU 45 HD12 LEU 45 -4.164 6.525 -0.528
324 HD13 LEU 45 HD13 LEU 45 -5.185 5.260 -1.212
325 HD21 LEU 45 HD21 LEU 45 -3.729 2.839 -0.006
326 HD22 LEU 45 HD22 LEU 45 -5.467 3.127 -0.045
327 HD23 LEU 45 HD23 LEU 45 -4.653 2.837 1.495
328 H MET 46 HN MET 46 -2.550 6.311 4.388
329 HA MET 46 HA MET 46 0.287 6.183 4.466
330 HB2 MET 46 HB2 MET 46 -1.657 7.541 6.347
331 HB3 MET 46 HB1 MET 46 0.081 7.807 6.330
332 HG2 MET 46 HG2 MET 46 -0.024 8.790 4.138
333 HG3 MET 46 HG1 MET 46 -1.717 8.329 3.990
334 HE1 MET 46 HE1 MET 46 -1.978 12.224 4.221
335 HE2 MET 46 HE2 MET 46 -2.409 10.785 3.299
336 HE3 MET 46 HE3 MET 46 -0.724 11.285 3.416
337 H GLU 47 HN GLU 47 -2.291 4.730 6.272
338 HA GLU 47 HA GLU 47 -0.713 3.809 8.466
339 HB2 GLU 47 HB2 GLU 47 -3.191 4.138 8.545
340 HB3 GLU 47 HB1 GLU 47 -3.374 2.814 7.415
341 HG2 GLU 47 HG2 GLU 47 -3.860 2.098 9.672
342 HG3 GLU 47 HG1 GLU 47 -2.438 1.267 9.042
343 H THR 48 HN THR 48 -1.845 2.481 5.384
344 HA THR 48 HA THR 48 -0.962 -0.134 5.445
345 HB THR 48 HB THR 48 -0.687 1.712 3.063
346 HG1 THR 48 HG1 THR 48 -3.004 0.612 4.261
347 HG21 THR 48 HG21 THR 48 -1.663 -1.131 3.357
348 HG22 THR 48 HG22 THR 48 -0.058 -0.668 2.776
349 HG23 THR 48 HG23 THR 48 -1.499 -0.250 1.840
350 H ALA 49 HN ALA 49 0.677 2.713 4.130
351 HA ALA 49 HA ALA 49 3.150 1.563 3.592
352 HB1 ALA 49 HB1 ALA 49 2.395 3.691 2.647
353 HB2 ALA 49 HB2 ALA 49 3.981 3.839 3.401
354 HB3 ALA 49 HB3 ALA 49 2.549 4.447 4.232
355 H ALA 50 HN ALA 50 2.089 3.408 6.457
356 HA ALA 50 HA ALA 50 4.484 3.573 7.831
357 HB1 ALA 50 HB1 ALA 50 3.177 3.938 9.817
358 HB2 ALA 50 HB2 ALA 50 1.769 3.220 9.038
359 HB3 ALA 50 HB3 ALA 50 2.415 4.755 8.445
360 H ARG 51 HN ARG 51 2.062 1.030 7.992
361 HA ARG 51 HA ARG 51 3.403 -0.467 9.971
362 HB2 ARG 51 HB2 ARG 51 1.022 -0.729 9.579
363 HB3 ARG 51 HB1 ARG 51 1.321 -1.295 7.946
364 HG2 ARG 51 HG2 ARG 51 2.350 -3.296 8.783
365 HG3 ARG 51 HG1 ARG 51 2.212 -2.705 10.440
366 HD2 ARG 51 HD2 ARG 51 -0.138 -3.039 8.639
367 HD3 ARG 51 HD1 ARG 51 0.456 -4.370 9.644
368 HE ARG 51 HE ARG 51 -0.420 -1.777 10.790
369 HH11 ARG 51 HH11 ARG 51 -0.704 -5.345 10.710
370 HH12 ARG 51 HH12 ARG 51 -1.703 -5.405 12.084
371 HH21 ARG 51 HH21 ARG 51 -1.923 -1.937 12.642
372 HH22 ARG 51 HH22 ARG 51 -2.419 -3.463 13.168
373 H LEU 52 HN LEU 52 3.188 -0.925 6.456
374 HA LEU 52 HA LEU 52 5.093 -2.936 6.252
375 HB2 LEU 52 HB2 LEU 52 4.301 -0.820 4.284
376 HB3 LEU 52 HB1 LEU 52 5.471 -2.070 3.888
377 HG LEU 52 HG LEU 52 2.643 -2.613 4.788
378 HD11 LEU 52 HD11 LEU 52 2.224 -3.236 2.473
379 HD12 LEU 52 HD12 LEU 52 3.853 -2.730 2.033
380 HD13 LEU 52 HD13 LEU 52 2.679 -1.537 2.596
381 HD21 LEU 52 HD21 LEU 52 4.223 -4.379 5.350
382 HD22 LEU 52 HD22 LEU 52 4.789 -4.421 3.681
383 HD23 LEU 52 HD23 LEU 52 3.133 -4.892 4.064
384 H GLU 53 HN GLU 53 5.713 0.514 6.605
385 HA GLU 53 HA GLU 53 8.435 0.597 6.031
386 HB2 GLU 53 HB2 GLU 53 6.979 2.028 8.249
387 HB3 GLU 53 HB1 GLU 53 8.623 2.372 7.761
388 HG2 GLU 53 HG2 GLU 53 7.783 3.064 5.556
389 HG3 GLU 53 HG1 GLU 53 6.134 2.779 6.129
390 H SER 54 HN SER 54 6.768 -0.428 8.945
391 HA SER 54 HA SER 54 9.124 -0.793 10.494
392 HB2 SER 54 HB2 SER 54 6.364 -1.944 10.906
393 HB3 SER 54 HB1 SER 54 7.611 -1.694 12.131
394 HG SER 54 HG SER 54 7.436 0.620 11.280
395 H ARG 55 HN ARG 55 7.292 -2.722 8.280
396 HA ARG 55 HA ARG 55 8.326 -5.233 9.187
397 HB2 ARG 55 HB2 ARG 55 6.104 -5.012 8.107
398 HB3 ARG 55 HB1 ARG 55 6.901 -4.593 6.602
399 HG2 ARG 55 HG2 ARG 55 7.897 -6.798 6.474
400 HG3 ARG 55 HG1 ARG 55 7.219 -7.226 8.045
401 HD2 ARG 55 HD2 ARG 55 5.668 -6.560 5.539
402 HD3 ARG 55 HD1 ARG 55 5.856 -8.159 6.259
403 HE ARG 55 HE ARG 55 4.820 -6.509 8.217
404 HH11 ARG 55 HH11 ARG 55 3.684 -7.829 5.054
405 HH12 ARG 55 HH12 ARG 55 2.063 -7.703 5.508
406 HH21 ARG 55 HH21 ARG 55 2.551 -6.394 8.734
407 HH22 ARG 55 HH22 ARG 55 1.395 -6.903 7.606
408 H TYR 56 HN TYR 56 9.102 -3.019 6.531
409 HA TYR 56 HA TYR 56 11.284 -4.850 5.804
410 HB2 TYR 56 HB2 TYR 56 9.888 -2.787 4.115
411 HB3 TYR 56 HB1 TYR 56 11.323 -3.671 3.593
412 HD1 TYR 56 HD1 TYR 56 7.770 -3.986 4.481
413 HD2 TYR 56 HD2 TYR 56 11.193 -5.968 2.928
414 HE1 TYR 56 HE1 TYR 56 6.364 -5.862 3.790
415 HE2 TYR 56 HE2 TYR 56 9.784 -7.858 2.229
416 HH TYR 56 HH TYR 56 6.307 -7.657 2.426
417 H GLY 57 HN GLY 57 10.883 -1.945 7.392
418 HA2 GLY 57 HA2 GLY 57 12.516 -0.596 8.305
419 HA3 GLY 57 HA1 GLY 57 13.726 -1.527 7.435
420 H VAL 58 HN VAL 58 10.949 0.308 6.270
421 HA VAL 58 HA VAL 58 12.828 1.853 4.659
422 HB VAL 58 HB VAL 58 11.038 2.220 2.964
423 HG11 VAL 58 HG11 VAL 58 11.154 0.004 1.970
424 HG12 VAL 58 HG12 VAL 58 11.710 -0.652 3.510
425 HG13 VAL 58 HG13 VAL 58 12.716 0.503 2.627
426 HG21 VAL 58 HG21 VAL 58 9.541 0.118 4.526
427 HG22 VAL 58 HG22 VAL 58 9.069 0.774 2.954
428 HG23 VAL 58 HG23 VAL 58 9.086 1.817 4.375
429 H SER 59 HN SER 59 11.663 3.936 3.786
430 HA SER 59 HA SER 59 10.275 5.216 5.994
431 HB2 SER 59 HB2 SER 59 11.764 7.256 5.421
432 HB3 SER 59 HB1 SER 59 12.494 5.948 6.351
433 HG SER 59 HG SER 59 13.948 6.010 4.847
434 H ILE 60 HN ILE 60 8.363 5.684 5.163
435 HA ILE 60 HA ILE 60 8.239 6.735 2.409
436 HB ILE 60 HB ILE 60 6.142 5.020 3.786
437 HG12 ILE 60 HG12 ILE 60 7.975 4.333 1.466
438 HG13 ILE 60 HG11 ILE 60 8.177 3.754 3.114
439 HG21 ILE 60 HG21 ILE 60 6.242 6.119 0.969
440 HG22 ILE 60 HG22 ILE 60 5.158 6.649 2.253
441 HG23 ILE 60 HG23 ILE 60 5.015 5.017 1.597
442 HD11 ILE 60 HD11 ILE 60 5.854 3.156 1.296
443 HD12 ILE 60 HD12 ILE 60 6.041 2.576 2.951
444 HD13 ILE 60 HD13 ILE 60 7.175 2.058 1.703
445 HA PRO 61 HA PRO 61 6.532 10.244 4.723
446 HB2 PRO 61 HB2 PRO 61 6.349 11.333 1.970
447 HB3 PRO 61 HB1 PRO 61 7.111 12.029 3.401
448 HG2 PRO 61 HG2 PRO 61 8.579 11.025 1.410
449 HG3 PRO 61 HG1 PRO 61 9.072 10.848 3.106
450 HD2 PRO 61 HD2 PRO 61 7.805 8.847 1.281
451 HD3 PRO 61 HD1 PRO 61 9.085 8.618 2.489
452 H ASP 62 HN ASP 62 4.464 11.038 4.912
453 HA ASP 62 HA ASP 62 2.403 9.271 4.133
454 HB2 ASP 62 HB2 ASP 62 2.258 11.980 5.462
455 HB3 ASP 62 HB1 ASP 62 0.901 10.868 5.296
456 H ASP 63 HN ASP 63 3.477 12.334 2.892
457 HA ASP 63 HA ASP 63 1.251 12.880 1.202
458 HB2 ASP 63 HB2 ASP 63 4.108 13.818 1.147
459 HB3 ASP 63 HB1 ASP 63 2.969 14.283 -0.101
460 H VAL 64 HN VAL 64 3.657 10.584 0.988
461 HA VAL 64 HA VAL 64 3.614 10.276 -1.901
462 HB VAL 64 HB VAL 64 4.706 8.523 0.282
463 HG11 VAL 64 HG11 VAL 64 5.352 8.653 -2.692
464 HG12 VAL 64 HG12 VAL 64 4.463 7.360 -1.889
465 HG13 VAL 64 HG13 VAL 64 6.173 7.608 -1.532
466 HG21 VAL 64 HG21 VAL 64 5.716 10.697 0.392
467 HG22 VAL 64 HG22 VAL 64 6.093 10.650 -1.333
468 HG23 VAL 64 HG23 VAL 64 6.897 9.540 -0.221
469 H ALA 65 HN ALA 65 2.600 8.550 1.004
470 HA ALA 65 HA ALA 65 1.193 6.456 -0.227
471 HB1 ALA 65 HB1 ALA 65 0.118 6.142 1.947
472 HB2 ALA 65 HB2 ALA 65 0.702 7.718 2.469
473 HB3 ALA 65 HB3 ALA 65 1.850 6.420 2.137
474 H GLY 66 HN GLY 66 0.200 9.662 0.825
475 HA2 GLY 66 HA2 GLY 66 -2.531 9.308 -0.039
476 HA3 GLY 66 HA1 GLY 66 -1.800 10.796 0.552
477 H ARG 67 HN ARG 67 -1.243 8.644 -2.102
478 HA ARG 67 HA ARG 67 -1.757 10.715 -4.107
479 HB2 ARG 67 HB2 ARG 67 0.656 10.982 -3.466
480 HB3 ARG 67 HB1 ARG 67 0.928 9.329 -3.991
481 HG2 ARG 67 HG2 ARG 67 -0.040 10.124 -6.246
482 HG3 ARG 67 HG1 ARG 67 0.286 11.748 -5.630
483 HD2 ARG 67 HD2 ARG 67 2.193 11.117 -6.870
484 HD3 ARG 67 HD1 ARG 67 2.640 10.960 -5.170
485 HE ARG 67 HE ARG 67 1.714 8.640 -6.699
486 HH11 ARG 67 HH11 ARG 67 4.197 10.164 -4.692
487 HH12 ARG 67 HH12 ARG 67 5.313 8.886 -4.812
488 HH21 ARG 67 HH21 ARG 67 3.292 6.786 -6.838
489 HH22 ARG 67 HH22 ARG 67 4.761 6.943 -6.022
490 H VAL 68 HN VAL 68 -0.798 7.475 -3.207
491 HA VAL 68 HA VAL 68 -0.994 6.302 -5.749
492 HB VAL 68 HB VAL 68 -0.797 4.163 -4.603
493 HG11 VAL 68 HG11 VAL 68 1.232 4.491 -3.344
494 HG12 VAL 68 HG12 VAL 68 0.818 6.180 -3.088
495 HG13 VAL 68 HG13 VAL 68 1.203 5.623 -4.707
496 HG21 VAL 68 HG21 VAL 68 -0.858 3.929 -2.163
497 HG22 VAL 68 HG22 VAL 68 -2.415 4.490 -2.774
498 HG23 VAL 68 HG23 VAL 68 -1.304 5.626 -2.005
499 H ASP 69 HN ASP 69 -2.771 5.981 -6.921
500 HA ASP 69 HA ASP 69 -5.329 6.082 -5.494
501 HB2 ASP 69 HB2 ASP 69 -4.651 7.465 -7.657
502 HB3 ASP 69 HB1 ASP 69 -5.181 5.998 -8.461
503 H THR 70 HN THR 70 -3.209 3.947 -6.991
504 HA THR 70 HA THR 70 -5.228 1.819 -6.939
505 HB THR 70 HB THR 70 -4.026 0.722 -8.758
506 HG1 THR 70 HG1 THR 70 -2.372 2.528 -9.716
507 HG21 THR 70 HG21 THR 70 -5.752 2.267 -9.488
508 HG22 THR 70 HG22 THR 70 -4.398 2.346 -10.619
509 HG23 THR 70 HG23 THR 70 -4.620 3.615 -9.411
510 HA PRO 71 HA PRO 71 -2.197 -0.103 -4.196
511 HB2 PRO 71 HB2 PRO 71 -3.074 -2.694 -5.341
512 HB3 PRO 71 HB1 PRO 71 -3.133 -2.139 -3.662
513 HG2 PRO 71 HG2 PRO 71 -5.368 -2.348 -5.092
514 HG3 PRO 71 HG1 PRO 71 -5.129 -0.996 -3.965
515 HD2 PRO 71 HD2 PRO 71 -4.809 -1.052 -6.949
516 HD3 PRO 71 HD1 PRO 71 -5.607 0.166 -5.930
517 H ARG 72 HN ARG 72 -2.420 -0.492 -7.538
518 HA ARG 72 HA ARG 72 -0.149 -2.096 -8.148
519 HB2 ARG 72 HB2 ARG 72 -2.141 -1.325 -9.626
520 HB3 ARG 72 HB1 ARG 72 -1.214 0.145 -9.857
521 HG2 ARG 72 HG2 ARG 72 0.634 -1.251 -10.767
522 HG3 ARG 72 HG1 ARG 72 -0.444 -2.649 -10.654
523 HD2 ARG 72 HD2 ARG 72 -0.725 -0.202 -12.379
524 HD3 ARG 72 HD1 ARG 72 -0.625 -1.885 -12.884
525 HE ARG 72 HE ARG 72 -2.946 -0.846 -11.383
526 HH11 ARG 72 HH11 ARG 72 -1.712 -2.872 -14.024
527 HH12 ARG 72 HH12 ARG 72 -3.228 -2.978 -14.797
528 HH21 ARG 72 HH21 ARG 72 -5.030 -1.048 -12.452
529 HH22 ARG 72 HH22 ARG 72 -5.138 -1.974 -13.872
530 H GLU 73 HN GLU 73 -0.765 1.394 -8.031
531 HA GLU 73 HA GLU 73 1.843 2.358 -8.396
532 HB2 GLU 73 HB2 GLU 73 -0.139 3.750 -8.612
533 HB3 GLU 73 HB1 GLU 73 -0.546 3.476 -6.929
534 HG2 GLU 73 HG2 GLU 73 0.345 5.645 -7.013
535 HG3 GLU 73 HG1 GLU 73 1.605 4.605 -6.356
536 H LEU 74 HN LEU 74 -0.046 1.607 -5.497
537 HA LEU 74 HA LEU 74 1.763 2.440 -3.525
538 HB2 LEU 74 HB2 LEU 74 -0.735 1.664 -3.407
539 HB3 LEU 74 HB1 LEU 74 -0.074 0.066 -3.181
540 HG LEU 74 HG LEU 74 0.361 2.421 -1.323
541 HD11 LEU 74 HD11 LEU 74 -1.432 0.022 -1.050
542 HD12 LEU 74 HD12 LEU 74 -1.941 1.689 -1.311
543 HD13 LEU 74 HD13 LEU 74 -1.142 1.238 0.195
544 HD21 LEU 74 HD21 LEU 74 1.235 0.770 0.256
545 HD22 LEU 74 HD22 LEU 74 2.203 0.796 -1.220
546 HD23 LEU 74 HD23 LEU 74 1.036 -0.498 -0.952
547 H LEU 75 HN LEU 75 1.361 -0.714 -5.091
548 HA LEU 75 HA LEU 75 3.344 -2.207 -3.810
549 HB2 LEU 75 HB2 LEU 75 1.656 -3.129 -5.338
550 HB3 LEU 75 HB1 LEU 75 2.404 -2.296 -6.680
551 HG LEU 75 HG LEU 75 4.453 -3.698 -6.298
552 HD11 LEU 75 HD11 LEU 75 2.622 -5.210 -4.453
553 HD12 LEU 75 HD12 LEU 75 4.063 -4.306 -3.990
554 HD13 LEU 75 HD13 LEU 75 4.212 -5.744 -5.000
555 HD21 LEU 75 HD21 LEU 75 2.855 -4.220 -8.059
556 HD22 LEU 75 HD22 LEU 75 1.887 -5.152 -6.917
557 HD23 LEU 75 HD23 LEU 75 3.506 -5.696 -7.348
558 H ASP 76 HN ASP 76 3.458 -0.267 -6.746
559 HA ASP 76 HA ASP 76 6.136 -0.738 -7.467
560 HB2 ASP 76 HB2 ASP 76 4.410 0.122 -9.007
561 HB3 ASP 76 HB1 ASP 76 4.409 1.649 -8.127
562 H LEU 77 HN LEU 77 4.610 1.793 -5.613
563 HA LEU 77 HA LEU 77 6.610 3.619 -5.129
564 HB2 LEU 77 HB2 LEU 77 4.192 3.655 -4.411
565 HB3 LEU 77 HB1 LEU 77 4.600 2.546 -3.137
566 HG LEU 77 HG LEU 77 5.501 5.434 -3.368
567 HD11 LEU 77 HD11 LEU 77 3.150 5.181 -2.875
568 HD12 LEU 77 HD12 LEU 77 4.023 5.778 -1.464
569 HD13 LEU 77 HD13 LEU 77 3.525 4.088 -1.544
570 HD21 LEU 77 HD21 LEU 77 5.921 3.492 -1.074
571 HD22 LEU 77 HD22 LEU 77 6.348 5.204 -1.075
572 HD23 LEU 77 HD23 LEU 77 7.190 4.085 -2.146
573 H ILE 78 HN ILE 78 5.740 0.857 -3.113
574 HA ILE 78 HA ILE 78 7.955 1.112 -1.391
575 HB ILE 78 HB ILE 78 6.136 -1.288 -1.769
576 HG12 ILE 78 HG12 ILE 78 5.944 1.068 0.121
577 HG13 ILE 78 HG11 ILE 78 4.915 0.790 -1.279
578 HG21 ILE 78 HG21 ILE 78 6.808 -1.845 0.536
579 HG22 ILE 78 HG22 ILE 78 7.891 -0.455 0.557
580 HG23 ILE 78 HG23 ILE 78 8.208 -1.801 -0.537
581 HD11 ILE 78 HD11 ILE 78 4.053 -1.239 -0.230
582 HD12 ILE 78 HD12 ILE 78 3.792 0.188 0.772
583 HD13 ILE 78 HD13 ILE 78 5.085 -0.943 1.171
584 H ASN 79 HN ASN 79 7.268 -1.034 -4.125
585 HA ASN 79 HA ASN 79 9.585 -2.629 -3.933
586 HB2 ASN 79 HB2 ASN 79 7.818 -1.926 -6.267
587 HB3 ASN 79 HB1 ASN 79 9.284 -2.861 -6.516
588 HD21 ASN 79 HD21 ASN 79 7.322 -3.223 -3.618
589 HD22 ASN 79 HD22 ASN 79 6.727 -4.797 -4.021
590 H GLY 80 HN GLY 80 9.082 0.452 -5.601
591 HA2 GLY 80 HA2 GLY 80 11.663 0.618 -6.727
592 HA3 GLY 80 HA1 GLY 80 10.561 1.960 -6.447
593 H ALA 81 HN ALA 81 10.340 1.601 -3.628
594 HA ALA 81 HA ALA 81 12.630 3.065 -2.790
595 HB1 ALA 81 HB1 ALA 81 10.458 1.803 -1.108
596 HB2 ALA 81 HB2 ALA 81 10.411 3.427 -1.799
597 HB3 ALA 81 HB3 ALA 81 11.609 3.027 -0.568
598 H LEU 82 HN LEU 82 11.429 -0.161 -2.093
599 HA LEU 82 HA LEU 82 13.274 -1.114 -0.297
600 HB2 LEU 82 HB2 LEU 82 11.782 -2.533 -2.471
601 HB3 LEU 82 HB1 LEU 82 12.754 -3.376 -1.280
602 HG LEU 82 HG LEU 82 10.442 -1.580 -0.574
603 HD11 LEU 82 HD11 LEU 82 9.192 -3.640 -0.183
604 HD12 LEU 82 HD12 LEU 82 10.545 -4.584 -0.812
605 HD13 LEU 82 HD13 LEU 82 9.659 -3.488 -1.877
606 HD21 LEU 82 HD21 LEU 82 12.136 -1.856 1.133
607 HD22 LEU 82 HD22 LEU 82 12.011 -3.612 0.990
608 HD23 LEU 82 HD23 LEU 82 10.640 -2.673 1.591
609 H ALA 83 HN ALA 83 13.578 -0.927 -3.763
610 HA ALA 83 HA ALA 83 15.747 -2.586 -4.190
611 HB1 ALA 83 HB1 ALA 83 14.419 -1.585 -5.973
612 HB2 ALA 83 HB2 ALA 83 16.146 -1.313 -6.216
613 HB3 ALA 83 HB3 ALA 83 15.124 -0.009 -5.611
614 H GLU 84 HN GLU 84 15.713 0.787 -3.133
615 HA GLU 84 HA GLU 84 18.646 0.682 -2.910
616 HB2 GLU 84 HB2 GLU 84 16.844 3.061 -3.368
617 HB3 GLU 84 HB1 GLU 84 18.574 3.159 -3.074
618 HG2 GLU 84 HG2 GLU 84 17.255 1.797 -5.413
619 HG3 GLU 84 HG1 GLU 84 18.044 3.371 -5.440
620 H ALA 85 HN ALA 85 16.299 0.045 -1.048
621 HA ALA 85 HA ALA 85 17.249 1.664 1.214
622 HB1 ALA 85 HB1 ALA 85 14.514 0.433 0.830
623 HB2 ALA 85 HB2 ALA 85 14.899 2.147 0.675
624 HB3 ALA 85 HB3 ALA 85 15.052 1.346 2.241
625 H ALA 86 HN ALA 86 16.670 0.400 3.301
626 HA ALA 86 HA ALA 86 17.203 -1.260 4.706
627 HB1 ALA 86 HB1 ALA 86 15.128 -2.203 3.775
628 HB2 ALA 86 HB2 ALA 86 16.271 -3.470 4.226
629 HB3 ALA 86 HB3 ALA 86 16.070 -3.027 2.530
630 H28 SXV 87 H28A SXV 87 -4.503 14.392 0.222
631 H28A SXV 87 H28B SXV 87 -4.783 14.871 1.888
632 H30 SXV 87 H30C SXV 87 -2.637 13.834 3.370
633 H30A SXV 87 H30A SXV 87 -3.081 15.539 3.292
634 H30B SXV 87 H30B SXV 87 -1.403 15.050 3.047
635 H31 SXV 87 H31C SXV 87 -0.743 13.908 0.892
636 H31A SXV 87 H31A SXV 87 -2.020 13.362 -0.196
637 H31B SXV 87 H31B SXV 87 -1.872 12.664 1.417
638 H32 SXV 87 H32A SXV 87 -1.357 16.237 0.676
639 HO33 SXV 87 H33A SXV 87 -3.965 17.141 1.084
640 HN36 SXV 87 H36A SXV 87 -1.540 14.903 -1.433
641 H37 SXV 87 H37B SXV 87 -3.618 15.976 -3.236
642 H37A SXV 87 H37A SXV 87 -3.002 14.314 -3.284
643 H38 SXV 87 H38B SXV 87 -1.911 15.331 -5.003
644 H38A SXV 87 H38A SXV 87 -0.710 15.223 -3.765
645 HN41 SXV 87 H41A SXV 87 0.145 16.884 -5.386
646 H42 SXV 87 H42B SXV 87 0.982 19.110 -5.044
647 H42A SXV 87 H42A SXV 87 -0.680 19.584 -4.634
648 H43 SXV 87 H43B SXV 87 0.314 18.793 -7.371
649 H43A SXV 87 H43A SXV 87 -1.385 19.011 -6.910
650 H1 SXV 87 H1B SXV 87 -2.390 21.190 -5.951
651 H1A SXV 87 H1A SXV 87 -1.076 21.365 -4.774
652 H2 SXV 87 H2A SXV 87 -1.955 23.492 -6.663
653 H2A SXV 87 H2B SXV 87 -0.615 23.598 -5.520
654 H4 SXV 87 H4C SXV 87 -3.474 25.268 -5.569
655 H4A SXV 87 H4A SXV 87 -4.356 24.631 -4.176
656 H4B SXV 87 H4B SXV 87 -4.368 23.750 -5.710
Start of MODEL 11
1 H1 MET 1 HT1 MET 1 18.665 -8.939 -5.091
2 H2 MET 1 HT2 MET 1 18.667 -9.348 -3.471
3 H3 MET 1 HT3 MET 1 20.080 -9.537 -4.368
4 HA MET 1 HA MET 1 20.281 -7.651 -2.960
5 HB2 MET 1 HB2 MET 1 19.749 -6.800 -5.814
6 HB3 MET 1 HB1 MET 1 20.589 -5.829 -4.620
7 HG2 MET 1 HG2 MET 1 21.507 -8.462 -5.751
8 HG3 MET 1 HG1 MET 1 22.133 -6.870 -6.165
9 HE1 MET 1 HE1 MET 1 24.111 -9.119 -5.424
10 HE2 MET 1 HE2 MET 1 25.171 -8.317 -4.268
11 HE3 MET 1 HE3 MET 1 24.610 -7.451 -5.698
12 H ALA 2 HN ALA 2 17.207 -7.845 -4.645
13 HA ALA 2 HA ALA 2 16.224 -5.782 -2.852
14 HB1 ALA 2 HB1 ALA 2 14.830 -4.914 -4.658
15 HB2 ALA 2 HB2 ALA 2 15.567 -6.052 -5.784
16 HB3 ALA 2 HB3 ALA 2 16.543 -4.774 -5.060
17 H THR 3 HN THR 3 15.165 -7.194 -1.513
18 HA THR 3 HA THR 3 13.506 -9.299 -2.512
19 HB THR 3 HB THR 3 12.713 -8.996 -0.002
20 HG1 THR 3 HG1 THR 3 13.704 -7.033 0.303
21 HG21 THR 3 HG21 THR 3 14.620 -10.375 0.737
22 HG22 THR 3 HG22 THR 3 15.492 -9.947 -0.735
23 HG23 THR 3 HG23 THR 3 14.016 -10.909 -0.832
24 H LEU 4 HN LEU 4 11.734 -8.658 -3.664
25 HA LEU 4 HA LEU 4 10.403 -6.179 -2.900
26 HB2 LEU 4 HB2 LEU 4 10.076 -7.831 -5.403
27 HB3 LEU 4 HB1 LEU 4 9.469 -6.215 -5.115
28 HG LEU 4 HG LEU 4 12.376 -6.974 -5.395
29 HD11 LEU 4 HD11 LEU 4 12.268 -5.751 -7.500
30 HD12 LEU 4 HD12 LEU 4 10.534 -5.517 -7.270
31 HD13 LEU 4 HD13 LEU 4 11.182 -7.140 -7.492
32 HD21 LEU 4 HD21 LEU 4 12.077 -5.077 -3.900
33 HD22 LEU 4 HD22 LEU 4 11.081 -4.268 -5.107
34 HD23 LEU 4 HD23 LEU 4 12.790 -4.566 -5.427
35 H LEU 5 HN LEU 5 8.547 -6.354 -1.892
36 HA LEU 5 HA LEU 5 7.482 -8.864 -1.248
37 HB2 LEU 5 HB2 LEU 5 5.630 -7.576 -0.157
38 HB3 LEU 5 HB1 LEU 5 7.239 -7.204 0.393
39 HG LEU 5 HG LEU 5 7.124 -5.119 -1.061
40 HD11 LEU 5 HD11 LEU 5 4.194 -5.805 -1.126
41 HD12 LEU 5 HD12 LEU 5 5.287 -5.767 -2.512
42 HD13 LEU 5 HD13 LEU 5 4.920 -4.281 -1.640
43 HD21 LEU 5 HD21 LEU 5 5.807 -3.895 0.584
44 HD22 LEU 5 HD22 LEU 5 6.893 -5.062 1.342
45 HD23 LEU 5 HD23 LEU 5 5.173 -5.418 1.205
46 H THR 6 HN THR 6 5.398 -9.714 -1.661
47 HA THR 6 HA THR 6 4.741 -9.344 -4.469
48 HB THR 6 HB THR 6 3.528 -11.487 -4.263
49 HG1 THR 6 HG1 THR 6 4.313 -11.280 -1.512
50 HG21 THR 6 HG21 THR 6 5.896 -11.542 -4.884
51 HG22 THR 6 HG22 THR 6 5.474 -12.953 -3.915
52 HG23 THR 6 HG23 THR 6 6.350 -11.605 -3.180
53 H THR 7 HN THR 7 2.159 -10.190 -4.631
54 HA THR 7 HA THR 7 0.814 -7.975 -3.526
55 HB THR 7 HB THR 7 -1.241 -9.091 -4.587
56 HG1 THR 7 HG1 THR 7 -0.467 -11.175 -4.898
57 HG21 THR 7 HG21 THR 7 1.136 -8.195 -6.218
58 HG22 THR 7 HG22 THR 7 -0.137 -7.168 -5.544
59 HG23 THR 7 HG23 THR 7 -0.513 -8.324 -6.825
60 H ASP 8 HN ASP 8 1.455 -11.033 -2.353
61 HA ASP 8 HA ASP 8 -0.849 -11.258 -0.640
62 HB2 ASP 8 HB2 ASP 8 1.865 -12.574 -0.602
63 HB3 ASP 8 HB1 ASP 8 0.703 -12.814 0.696
64 H ASP 9 HN ASP 9 2.364 -10.005 -0.423
65 HA ASP 9 HA ASP 9 2.287 -9.305 2.319
66 HB2 ASP 9 HB2 ASP 9 3.958 -8.070 0.120
67 HB3 ASP 9 HB1 ASP 9 4.277 -8.006 1.847
68 H LEU 10 HN LEU 10 1.670 -7.587 -0.700
69 HA LEU 10 HA LEU 10 0.981 -5.115 0.501
70 HB2 LEU 10 HB2 LEU 10 1.586 -5.309 -1.873
71 HB3 LEU 10 HB1 LEU 10 0.127 -6.241 -2.169
72 HG LEU 10 HG LEU 10 -1.232 -4.274 -1.551
73 HD11 LEU 10 HD11 LEU 10 0.333 -3.182 -0.060
74 HD12 LEU 10 HD12 LEU 10 -0.174 -2.089 -1.347
75 HD13 LEU 10 HD13 LEU 10 1.415 -2.852 -1.412
76 HD21 LEU 10 HD21 LEU 10 0.797 -3.767 -3.716
77 HD22 LEU 10 HD22 LEU 10 -0.767 -2.966 -3.558
78 HD23 LEU 10 HD23 LEU 10 -0.692 -4.697 -3.883
79 H ARG 11 HN ARG 11 -0.915 -7.952 -0.445
80 HA ARG 11 HA ARG 11 -3.471 -7.006 0.105
81 HB2 ARG 11 HB2 ARG 11 -2.971 -9.203 -0.958
82 HB3 ARG 11 HB1 ARG 11 -2.405 -9.797 0.595
83 HG2 ARG 11 HG2 ARG 11 -4.655 -9.413 1.516
84 HG3 ARG 11 HG1 ARG 11 -5.195 -8.925 -0.090
85 HD2 ARG 11 HD2 ARG 11 -4.591 -11.135 -0.958
86 HD3 ARG 11 HD1 ARG 11 -4.064 -11.618 0.661
87 HE ARG 11 HE ARG 11 -6.792 -10.752 0.089
88 HH11 ARG 11 HH11 ARG 11 -4.616 -13.339 1.162
89 HH12 ARG 11 HH12 ARG 11 -5.818 -14.166 2.045
90 HH21 ARG 11 HH21 ARG 11 -8.454 -11.931 1.337
91 HH22 ARG 11 HH22 ARG 11 -8.012 -13.346 2.169
92 H ARG 12 HN ARG 12 -1.091 -8.592 2.211
93 HA ARG 12 HA ARG 12 -2.488 -8.543 4.604
94 HB2 ARG 12 HB2 ARG 12 0.435 -8.269 4.047
95 HB3 ARG 12 HB1 ARG 12 -0.198 -8.099 5.672
96 HG2 ARG 12 HG2 ARG 12 -1.176 -10.408 5.395
97 HG3 ARG 12 HG1 ARG 12 -0.268 -10.522 3.885
98 HD2 ARG 12 HD2 ARG 12 0.969 -11.571 5.706
99 HD3 ARG 12 HD1 ARG 12 1.824 -10.150 5.112
100 HE ARG 12 HE ARG 12 0.599 -9.031 7.166
101 HH11 ARG 12 HH11 ARG 12 2.160 -12.218 7.120
102 HH12 ARG 12 HH12 ARG 12 2.378 -12.271 8.807
103 HH21 ARG 12 HH21 ARG 12 0.959 -9.039 9.376
104 HH22 ARG 12 HH22 ARG 12 1.687 -10.364 10.154
105 H ALA 13 HN ALA 13 -0.319 -6.091 3.308
106 HA ALA 13 HA ALA 13 -0.428 -4.240 5.331
107 HB1 ALA 13 HB1 ALA 13 -0.307 -3.651 2.387
108 HB2 ALA 13 HB2 ALA 13 1.061 -4.088 3.414
109 HB3 ALA 13 HB3 ALA 13 0.196 -2.577 3.692
110 H LEU 14 HN LEU 14 -2.590 -4.437 2.547
111 HA LEU 14 HA LEU 14 -4.142 -2.240 3.451
112 HB2 LEU 14 HB2 LEU 14 -4.520 -4.192 1.208
113 HB3 LEU 14 HB1 LEU 14 -5.729 -2.979 1.587
114 HG LEU 14 HG LEU 14 -2.856 -2.266 0.960
115 HD11 LEU 14 HD11 LEU 14 -5.235 -2.261 -0.896
116 HD12 LEU 14 HD12 LEU 14 -3.859 -3.364 -0.987
117 HD13 LEU 14 HD13 LEU 14 -3.625 -1.636 -1.255
118 HD21 LEU 14 HD21 LEU 14 -3.805 -0.052 0.585
119 HD22 LEU 14 HD22 LEU 14 -4.110 -0.616 2.228
120 HD23 LEU 14 HD23 LEU 14 -5.402 -0.658 1.027
121 H VAL 15 HN VAL 15 -4.261 -5.552 4.250
122 HA VAL 15 HA VAL 15 -6.956 -5.283 5.310
123 HB VAL 15 HB VAL 15 -4.955 -7.568 5.611
124 HG11 VAL 15 HG11 VAL 15 -6.834 -8.881 6.492
125 HG12 VAL 15 HG12 VAL 15 -7.865 -7.450 6.425
126 HG13 VAL 15 HG13 VAL 15 -6.484 -7.492 7.522
127 HG21 VAL 15 HG21 VAL 15 -7.453 -7.338 3.931
128 HG22 VAL 15 HG22 VAL 15 -6.447 -8.778 4.082
129 HG23 VAL 15 HG23 VAL 15 -5.795 -7.321 3.334
130 H GLU 16 HN GLU 16 -3.639 -5.322 6.418
131 HA GLU 16 HA GLU 16 -4.245 -5.253 9.165
132 HB2 GLU 16 HB2 GLU 16 -1.603 -4.590 7.792
133 HB3 GLU 16 HB1 GLU 16 -1.846 -4.791 9.519
134 HG2 GLU 16 HG2 GLU 16 -2.669 -7.094 9.141
135 HG3 GLU 16 HG1 GLU 16 -2.297 -6.914 7.434
136 H SER 17 HN SER 17 -3.695 -2.643 6.821
137 HA SER 17 HA SER 17 -3.740 -0.652 8.849
138 HB2 SER 17 HB2 SER 17 -4.153 0.895 6.883
139 HB3 SER 17 HB1 SER 17 -2.676 -0.065 6.816
140 HG SER 17 HG SER 17 -5.132 -0.586 5.456
141 H ALA 18 HN ALA 18 -6.108 -2.593 7.523
142 HA ALA 18 HA ALA 18 -8.269 -0.744 8.105
143 HB1 ALA 18 HB1 ALA 18 -9.718 -2.567 7.295
144 HB2 ALA 18 HB2 ALA 18 -8.304 -3.611 7.132
145 HB3 ALA 18 HB3 ALA 18 -8.462 -2.175 6.121
146 H GLY 19 HN GLY 19 -6.291 -2.982 9.619
147 HA2 GLY 19 HA2 GLY 19 -6.274 -4.028 11.656
148 HA3 GLY 19 HA1 GLY 19 -7.545 -2.902 12.135
149 H GLU 20 HN GLU 20 -7.693 -5.108 9.474
150 HA GLU 20 HA GLU 20 -9.113 -6.646 8.825
151 HB2 GLU 20 HB2 GLU 20 -9.331 -7.280 11.765
152 HB3 GLU 20 HB1 GLU 20 -10.199 -8.187 10.536
153 HG2 GLU 20 HG2 GLU 20 -8.020 -8.686 9.456
154 HG3 GLU 20 HG1 GLU 20 -7.224 -7.910 10.826
155 H THR 21 HN THR 21 -10.904 -6.443 7.922
156 HA THR 21 HA THR 21 -13.195 -5.275 9.264
157 HB THR 21 HB THR 21 -12.104 -4.200 6.631
158 HG1 THR 21 HG1 THR 21 -11.359 -3.629 9.108
159 HG21 THR 21 HG21 THR 21 -13.822 -2.450 6.914
160 HG22 THR 21 HG22 THR 21 -14.365 -3.231 8.400
161 HG23 THR 21 HG23 THR 21 -14.549 -4.056 6.850
162 H ASP 22 HN ASP 22 -14.029 -7.383 9.050
163 HA ASP 22 HA ASP 22 -13.970 -8.937 6.726
164 HB2 ASP 22 HB2 ASP 22 -15.838 -10.250 7.596
165 HB3 ASP 22 HB1 ASP 22 -14.744 -9.869 8.910
166 H GLY 23 HN GLY 23 -15.076 -9.011 4.905
167 HA2 GLY 23 HA2 GLY 23 -16.987 -8.376 3.570
168 HA3 GLY 23 HA1 GLY 23 -17.089 -6.896 4.523
169 H THR 24 HN THR 24 -14.092 -6.674 4.455
170 HA THR 24 HA THR 24 -13.876 -5.732 1.701
171 HB THR 24 HB THR 24 -12.316 -4.793 4.141
172 HG1 THR 24 HG1 THR 24 -14.652 -3.850 2.840
173 HG21 THR 24 HG21 THR 24 -11.114 -4.495 2.003
174 HG22 THR 24 HG22 THR 24 -11.611 -2.940 2.674
175 HG23 THR 24 HG23 THR 24 -12.513 -3.652 1.337
176 H ASP 25 HN ASP 25 -13.290 -7.905 1.057
177 HA ASP 25 HA ASP 25 -10.628 -8.736 1.916
178 HB2 ASP 25 HB2 ASP 25 -12.278 -10.553 1.880
179 HB3 ASP 25 HB1 ASP 25 -12.715 -10.163 0.224
180 H LEU 26 HN LEU 26 -9.128 -9.296 0.128
181 HA LEU 26 HA LEU 26 -9.444 -7.432 -2.057
182 HB2 LEU 26 HB2 LEU 26 -8.269 -6.506 0.029
183 HB3 LEU 26 HB1 LEU 26 -6.982 -7.623 -0.361
184 HG LEU 26 HG LEU 26 -6.653 -6.520 -2.484
185 HD11 LEU 26 HD11 LEU 26 -8.778 -4.605 -1.480
186 HD12 LEU 26 HD12 LEU 26 -8.961 -5.714 -2.837
187 HD13 LEU 26 HD13 LEU 26 -7.806 -4.383 -2.935
188 HD21 LEU 26 HD21 LEU 26 -6.692 -4.683 -0.111
189 HD22 LEU 26 HD22 LEU 26 -5.730 -4.468 -1.578
190 HD23 LEU 26 HD23 LEU 26 -5.424 -5.843 -0.512
191 H SER 27 HN SER 27 -9.534 -8.948 -3.449
192 HA SER 27 HA SER 27 -7.857 -11.348 -3.270
193 HB2 SER 27 HB2 SER 27 -10.266 -10.853 -4.988
194 HB3 SER 27 HB1 SER 27 -9.461 -12.396 -4.699
195 HG SER 27 HG SER 27 -9.904 -11.912 -2.392
196 H GLY 28 HN GLY 28 -6.103 -11.483 -4.412
197 HA2 GLY 28 HA2 GLY 28 -4.559 -11.477 -6.112
198 HA3 GLY 28 HA1 GLY 28 -5.933 -11.960 -7.065
199 H ASP 29 HN ASP 29 -7.027 -10.335 -8.270
200 HA ASP 29 HA ASP 29 -5.147 -8.363 -9.272
201 HB2 ASP 29 HB2 ASP 29 -6.240 -9.812 -10.925
202 HB3 ASP 29 HB1 ASP 29 -7.819 -9.257 -10.388
203 H PHE 30 HN PHE 30 -5.246 -6.990 -7.554
204 HA PHE 30 HA PHE 30 -7.644 -5.277 -7.519
205 HB2 PHE 30 HB2 PHE 30 -7.258 -4.909 -5.093
206 HB3 PHE 30 HB1 PHE 30 -7.657 -6.574 -5.484
207 HD1 PHE 30 HD1 PHE 30 -4.865 -4.312 -4.538
208 HD2 PHE 30 HD2 PHE 30 -6.183 -8.337 -4.924
209 HE1 PHE 30 HE1 PHE 30 -2.882 -5.080 -3.298
210 HE2 PHE 30 HE2 PHE 30 -4.199 -9.106 -3.690
211 HZ PHE 30 HZ PHE 30 -2.551 -7.476 -2.873
212 H LEU 31 HN LEU 31 -4.767 -5.238 -8.703
213 HA LEU 31 HA LEU 31 -3.531 -3.098 -7.213
214 HB2 LEU 31 HB2 LEU 31 -2.659 -4.413 -9.776
215 HB3 LEU 31 HB1 LEU 31 -1.739 -3.229 -8.887
216 HG LEU 31 HG LEU 31 -0.760 -5.284 -8.448
217 HD11 LEU 31 HD11 LEU 31 -0.912 -3.925 -6.510
218 HD12 LEU 31 HD12 LEU 31 -1.033 -5.626 -6.059
219 HD13 LEU 31 HD13 LEU 31 -2.480 -4.615 -6.098
220 HD21 LEU 31 HD21 LEU 31 -3.483 -6.411 -7.796
221 HD22 LEU 31 HD22 LEU 31 -1.959 -7.270 -7.595
222 HD23 LEU 31 HD23 LEU 31 -2.496 -6.795 -9.206
223 H ASP 32 HN ASP 32 -5.400 -3.425 -10.076
224 HA ASP 32 HA ASP 32 -4.665 -0.685 -10.799
225 HB2 ASP 32 HB2 ASP 32 -5.826 -2.873 -12.523
226 HB3 ASP 32 HB1 ASP 32 -5.528 -1.226 -13.074
227 H LEU 33 HN LEU 33 -6.781 -1.633 -8.846
228 HA LEU 33 HA LEU 33 -9.005 -0.196 -10.069
229 HB2 LEU 33 HB2 LEU 33 -10.400 -1.088 -8.166
230 HB3 LEU 33 HB1 LEU 33 -9.804 -2.292 -9.273
231 HG LEU 33 HG LEU 33 -8.021 -2.838 -7.546
232 HD11 LEU 33 HD11 LEU 33 -9.767 -1.176 -5.740
233 HD12 LEU 33 HD12 LEU 33 -8.106 -0.816 -6.209
234 HD13 LEU 33 HD13 LEU 33 -8.456 -2.239 -5.226
235 HD21 LEU 33 HD21 LEU 33 -10.909 -3.250 -6.801
236 HD22 LEU 33 HD22 LEU 33 -9.544 -4.185 -6.190
237 HD23 LEU 33 HD23 LEU 33 -9.959 -4.244 -7.902
238 H ARG 34 HN ARG 34 -10.276 1.207 -8.366
239 HA ARG 34 HA ARG 34 -8.247 3.036 -7.303
240 HB2 ARG 34 HB2 ARG 34 -11.241 3.444 -7.323
241 HB3 ARG 34 HB1 ARG 34 -9.994 4.668 -7.192
242 HG2 ARG 34 HG2 ARG 34 -10.568 3.013 -9.636
243 HG3 ARG 34 HG1 ARG 34 -11.123 4.658 -9.364
244 HD2 ARG 34 HD2 ARG 34 -8.896 5.499 -9.451
245 HD3 ARG 34 HD1 ARG 34 -8.196 3.875 -9.457
246 HE ARG 34 HE ARG 34 -9.720 3.706 -11.582
247 HH11 ARG 34 HH11 ARG 34 -7.557 6.414 -10.762
248 HH12 ARG 34 HH12 ARG 34 -7.409 6.945 -12.358
249 HH21 ARG 34 HH21 ARG 34 -9.464 4.433 -13.758
250 HH22 ARG 34 HH22 ARG 34 -8.479 5.787 -14.112
251 H PHE 35 HN PHE 35 -8.475 3.827 -5.092
252 HA PHE 35 HA PHE 35 -9.117 1.683 -3.302
253 HB2 PHE 35 HB2 PHE 35 -8.219 4.510 -2.735
254 HB3 PHE 35 HB1 PHE 35 -8.391 3.251 -1.520
255 HD1 PHE 35 HD2 PHE 35 -6.824 1.419 -1.405
256 HD2 PHE 35 HD1 PHE 35 -6.429 4.481 -4.317
257 HE1 PHE 35 HE2 PHE 35 -4.519 0.689 -1.858
258 HE2 PHE 35 HE1 PHE 35 -4.164 3.768 -4.795
259 HZ PHE 35 HZ PHE 35 -3.176 1.859 -3.551
260 H GLU 36 HN GLU 36 -10.730 4.367 -4.554
261 HA GLU 36 HA GLU 36 -12.684 4.885 -2.622
262 HB2 GLU 36 HB2 GLU 36 -12.895 4.952 -5.635
263 HB3 GLU 36 HB1 GLU 36 -14.093 5.622 -4.540
264 HG2 GLU 36 HG2 GLU 36 -11.224 6.500 -4.697
265 HG3 GLU 36 HG1 GLU 36 -12.584 7.312 -5.476
266 H ASP 37 HN ASP 37 -12.416 2.343 -5.014
267 HA ASP 37 HA ASP 37 -15.047 1.325 -4.804
268 HB2 ASP 37 HB2 ASP 37 -13.638 0.767 -6.716
269 HB3 ASP 37 HB1 ASP 37 -12.497 -0.062 -5.662
270 H ILE 38 HN ILE 38 -12.082 0.646 -3.071
271 HA ILE 38 HA ILE 38 -13.487 -1.354 -1.488
272 HB ILE 38 HB ILE 38 -11.274 -1.925 -0.492
273 HG12 ILE 38 HG12 ILE 38 -10.196 0.020 -2.563
274 HG13 ILE 38 HG11 ILE 38 -10.164 0.264 -0.824
275 HG21 ILE 38 HG21 ILE 38 -12.155 -3.177 -2.355
276 HG22 ILE 38 HG22 ILE 38 -10.398 -3.027 -2.510
277 HG23 ILE 38 HG23 ILE 38 -11.468 -2.012 -3.486
278 HD11 ILE 38 HD11 ILE 38 -7.988 -0.436 -1.666
279 HD12 ILE 38 HD12 ILE 38 -8.705 -1.904 -2.328
280 HD13 ILE 38 HD13 ILE 38 -8.666 -1.652 -0.584
281 H GLY 39 HN GLY 39 -13.417 1.726 -1.364
282 HA2 GLY 39 HA2 GLY 39 -13.931 3.286 0.254
283 HA3 GLY 39 HA1 GLY 39 -14.251 1.936 1.325
284 H TYR 40 HN TYR 40 -11.286 3.201 -0.190
285 HA TYR 40 HA TYR 40 -10.087 3.212 2.493
286 HB2 TYR 40 HB2 TYR 40 -9.217 1.928 0.097
287 HB3 TYR 40 HB1 TYR 40 -8.036 3.153 0.550
288 HD1 TYR 40 HD1 TYR 40 -7.088 3.086 2.921
289 HD2 TYR 40 HD2 TYR 40 -9.347 -0.083 1.217
290 HE1 TYR 40 HE1 TYR 40 -6.175 1.546 4.594
291 HE2 TYR 40 HE2 TYR 40 -8.434 -1.639 2.869
292 HH TYR 40 HH TYR 40 -6.577 -0.556 5.545
293 H ASP 41 HN ASP 41 -9.315 5.021 3.242
294 HA ASP 41 HA ASP 41 -9.202 7.417 1.515
295 HB2 ASP 41 HB2 ASP 41 -8.964 7.232 4.537
296 HB3 ASP 41 HB1 ASP 41 -9.094 8.704 3.588
297 H SER 42 HN SER 42 -7.328 8.899 1.888
298 HA SER 42 HA SER 42 -4.870 7.530 1.605
299 HB2 SER 42 HB2 SER 42 -3.868 9.806 1.683
300 HB3 SER 42 HB1 SER 42 -5.220 9.683 0.549
301 H LEU 43 HN LEU 43 -6.431 9.167 4.245
302 HA LEU 43 HA LEU 43 -4.367 9.168 6.118
303 HB2 LEU 43 HB2 LEU 43 -7.335 8.897 6.512
304 HB3 LEU 43 HB1 LEU 43 -6.198 9.155 7.817
305 HG LEU 43 HG LEU 43 -6.709 11.061 5.535
306 HD11 LEU 43 HD11 LEU 43 -7.496 11.196 8.438
307 HD12 LEU 43 HD12 LEU 43 -8.577 10.912 7.075
308 HD13 LEU 43 HD13 LEU 43 -7.751 12.466 7.238
309 HD21 LEU 43 HD21 LEU 43 -5.318 12.619 6.819
310 HD22 LEU 43 HD22 LEU 43 -4.408 11.184 6.346
311 HD23 LEU 43 HD23 LEU 43 -4.992 11.349 8.002
312 H ALA 44 HN ALA 44 -6.430 6.604 5.047
313 HA ALA 44 HA ALA 44 -5.491 4.827 7.128
314 HB1 ALA 44 HB1 ALA 44 -7.224 4.244 4.727
315 HB2 ALA 44 HB2 ALA 44 -7.805 4.625 6.347
316 HB3 ALA 44 HB3 ALA 44 -6.900 3.138 6.059
317 H LEU 45 HN LEU 45 -4.995 5.436 3.709
318 HA LEU 45 HA LEU 45 -3.349 3.251 3.083
319 HB2 LEU 45 HB2 LEU 45 -3.459 6.007 1.874
320 HB3 LEU 45 HB1 LEU 45 -2.575 4.662 1.183
321 HG LEU 45 HG LEU 45 -5.561 4.746 1.599
322 HD11 LEU 45 HD11 LEU 45 -4.846 6.298 -0.135
323 HD12 LEU 45 HD12 LEU 45 -5.679 4.911 -0.837
324 HD13 LEU 45 HD13 LEU 45 -3.920 5.016 -0.914
325 HD21 LEU 45 HD21 LEU 45 -3.790 2.740 0.225
326 HD22 LEU 45 HD22 LEU 45 -5.553 2.711 0.250
327 HD23 LEU 45 HD23 LEU 45 -4.644 2.500 1.750
328 H MET 46 HN MET 46 -2.617 6.339 4.500
329 HA MET 46 HA MET 46 0.201 6.194 4.327
330 HB2 MET 46 HB2 MET 46 -1.524 7.572 6.395
331 HB3 MET 46 HB1 MET 46 0.215 7.792 6.261
332 HG2 MET 46 HG2 MET 46 -0.036 8.766 4.065
333 HG3 MET 46 HG1 MET 46 -1.764 8.406 4.092
334 HE1 MET 46 HE1 MET 46 -0.681 11.276 3.385
335 HE2 MET 46 HE2 MET 46 -1.776 12.291 4.327
336 HE3 MET 46 HE3 MET 46 -2.395 10.873 3.481
337 H GLU 47 HN GLU 47 -2.099 4.798 6.521
338 HA GLU 47 HA GLU 47 -0.108 3.906 8.375
339 HB2 GLU 47 HB2 GLU 47 -2.459 4.460 9.045
340 HB3 GLU 47 HB1 GLU 47 -3.004 3.063 8.137
341 HG2 GLU 47 HG2 GLU 47 -1.777 1.577 9.601
342 HG3 GLU 47 HG1 GLU 47 -1.114 2.955 10.479
343 H THR 48 HN THR 48 -1.887 2.600 5.607
344 HA THR 48 HA THR 48 -1.178 -0.071 5.623
345 HB THR 48 HB THR 48 -1.128 1.800 3.236
346 HG1 THR 48 HG1 THR 48 -3.316 0.445 4.464
347 HG21 THR 48 HG21 THR 48 -0.280 -0.464 2.773
348 HG22 THR 48 HG22 THR 48 -1.830 -0.193 1.972
349 HG23 THR 48 HG23 THR 48 -1.759 -1.148 3.450
350 H ALA 49 HN ALA 49 0.518 2.648 4.096
351 HA ALA 49 HA ALA 49 2.880 1.364 3.408
352 HB1 ALA 49 HB1 ALA 49 3.848 3.604 3.258
353 HB2 ALA 49 HB2 ALA 49 2.485 4.262 4.162
354 HB3 ALA 49 HB3 ALA 49 2.229 3.573 2.559
355 H ALA 50 HN ALA 50 1.996 3.100 6.365
356 HA ALA 50 HA ALA 50 4.433 3.087 7.687
357 HB1 ALA 50 HB1 ALA 50 3.176 3.432 9.726
358 HB2 ALA 50 HB2 ALA 50 1.700 2.886 8.928
359 HB3 ALA 50 HB3 ALA 50 2.487 4.377 8.406
360 H ARG 51 HN ARG 51 1.958 0.575 7.605
361 HA ARG 51 HA ARG 51 3.011 -1.142 9.576
362 HB2 ARG 51 HB2 ARG 51 1.591 -1.927 7.023
363 HB3 ARG 51 HB1 ARG 51 1.828 -2.962 8.413
364 HG2 ARG 51 HG2 ARG 51 0.151 -0.461 8.339
365 HG3 ARG 51 HG1 ARG 51 -0.454 -2.108 8.244
366 HD2 ARG 51 HD2 ARG 51 -0.781 -1.362 10.474
367 HD3 ARG 51 HD1 ARG 51 0.556 -2.506 10.500
368 HE ARG 51 HE ARG 51 2.016 -0.446 10.525
369 HH11 ARG 51 HH11 ARG 51 -1.281 -0.326 11.794
370 HH12 ARG 51 HH12 ARG 51 -0.904 0.762 13.045
371 HH21 ARG 51 HH21 ARG 51 2.498 1.156 12.207
372 HH22 ARG 51 HH22 ARG 51 1.223 1.683 13.207
373 H LEU 52 HN LEU 52 3.346 -1.256 6.109
374 HA LEU 52 HA LEU 52 5.395 -3.159 6.044
375 HB2 LEU 52 HB2 LEU 52 4.686 -1.070 3.997
376 HB3 LEU 52 HB1 LEU 52 5.761 -2.429 3.706
377 HG LEU 52 HG LEU 52 2.830 -2.643 4.423
378 HD11 LEU 52 HD11 LEU 52 3.136 -1.785 2.191
379 HD12 LEU 52 HD12 LEU 52 2.542 -3.441 2.147
380 HD13 LEU 52 HD13 LEU 52 4.242 -3.107 1.808
381 HD21 LEU 52 HD21 LEU 52 4.824 -4.775 3.661
382 HD22 LEU 52 HD22 LEU 52 3.094 -5.020 3.924
383 HD23 LEU 52 HD23 LEU 52 4.131 -4.531 5.264
384 H GLU 53 HN GLU 53 5.593 0.357 6.357
385 HA GLU 53 HA GLU 53 8.329 0.642 5.973
386 HB2 GLU 53 HB2 GLU 53 6.508 2.197 7.810
387 HB3 GLU 53 HB1 GLU 53 8.190 2.617 7.549
388 HG2 GLU 53 HG2 GLU 53 7.667 2.879 5.130
389 HG3 GLU 53 HG1 GLU 53 5.966 2.636 5.533
390 H SER 54 HN SER 54 6.595 0.189 9.052
391 HA SER 54 HA SER 54 8.927 -0.122 10.599
392 HB2 SER 54 HB2 SER 54 6.129 -1.111 11.155
393 HB3 SER 54 HB1 SER 54 7.410 -0.892 12.350
394 HG SER 54 HG SER 54 7.411 1.384 11.394
395 H ARG 55 HN ARG 55 7.146 -2.310 8.644
396 HA ARG 55 HA ARG 55 8.120 -4.723 9.784
397 HB2 ARG 55 HB2 ARG 55 6.042 -4.737 8.572
398 HB3 ARG 55 HB1 ARG 55 6.821 -4.126 7.125
399 HG2 ARG 55 HG2 ARG 55 8.025 -6.229 6.882
400 HG3 ARG 55 HG1 ARG 55 7.277 -6.828 8.367
401 HD2 ARG 55 HD2 ARG 55 5.101 -6.764 7.374
402 HD3 ARG 55 HD1 ARG 55 5.719 -5.920 5.956
403 HE ARG 55 HE ARG 55 7.039 -8.387 6.315
404 HH11 ARG 55 HH11 ARG 55 3.764 -7.330 5.477
405 HH12 ARG 55 HH12 ARG 55 3.605 -8.390 4.152
406 HH21 ARG 55 HH21 ARG 55 6.794 -9.885 4.533
407 HH22 ARG 55 HH22 ARG 55 5.417 -9.886 3.561
408 H TYR 56 HN TYR 56 9.154 -2.766 6.984
409 HA TYR 56 HA TYR 56 11.389 -4.641 6.606
410 HB2 TYR 56 HB2 TYR 56 10.204 -2.611 4.734
411 HB3 TYR 56 HB1 TYR 56 11.714 -3.455 4.407
412 HD1 TYR 56 HD2 TYR 56 11.686 -5.936 4.100
413 HD2 TYR 56 HD1 TYR 56 8.123 -3.647 4.452
414 HE1 TYR 56 HE2 TYR 56 10.398 -7.791 3.139
415 HE2 TYR 56 HE1 TYR 56 6.830 -5.496 3.498
416 HH TYR 56 HH TYR 56 7.303 -7.412 1.991
417 H GLY 57 HN GLY 57 10.798 -1.426 7.674
418 HA2 GLY 57 HA2 GLY 57 12.333 -0.019 8.649
419 HA3 GLY 57 HA1 GLY 57 13.640 -1.041 8.053
420 H VAL 58 HN VAL 58 10.966 0.585 6.432
421 HA VAL 58 HA VAL 58 12.935 1.813 4.655
422 HB VAL 58 HB VAL 58 11.227 1.860 2.836
423 HG11 VAL 58 HG11 VAL 58 11.340 -0.513 2.264
424 HG12 VAL 58 HG12 VAL 58 11.834 -0.881 3.916
425 HG13 VAL 58 HG13 VAL 58 12.881 0.092 2.878
426 HG21 VAL 58 HG21 VAL 58 9.223 0.451 3.012
427 HG22 VAL 58 HG22 VAL 58 9.201 1.749 4.208
428 HG23 VAL 58 HG23 VAL 58 9.619 0.105 4.694
429 H SER 59 HN SER 59 11.726 3.761 3.358
430 HA SER 59 HA SER 59 10.445 5.371 5.413
431 HB2 SER 59 HB2 SER 59 12.685 6.271 3.573
432 HB3 SER 59 HB1 SER 59 11.850 7.274 4.758
433 HG SER 59 HG SER 59 12.620 5.827 6.377
434 H ILE 60 HN ILE 60 8.461 5.570 4.585
435 HA ILE 60 HA ILE 60 8.192 6.329 1.759
436 HB ILE 60 HB ILE 60 6.234 4.852 3.554
437 HG12 ILE 60 HG12 ILE 60 7.720 3.871 1.099
438 HG13 ILE 60 HG11 ILE 60 8.150 3.478 2.757
439 HG21 ILE 60 HG21 ILE 60 5.961 5.655 0.656
440 HG22 ILE 60 HG22 ILE 60 5.073 6.339 2.016
441 HG23 ILE 60 HG23 ILE 60 4.820 4.654 1.558
442 HD11 ILE 60 HD11 ILE 60 6.935 1.662 1.696
443 HD12 ILE 60 HD12 ILE 60 5.574 2.742 1.386
444 HD13 ILE 60 HD13 ILE 60 6.016 2.334 3.043
445 HA PRO 61 HA PRO 61 6.906 10.119 3.841
446 HB2 PRO 61 HB2 PRO 61 6.253 10.932 1.068
447 HB3 PRO 61 HB1 PRO 61 7.297 11.728 2.248
448 HG2 PRO 61 HG2 PRO 61 8.330 10.450 0.137
449 HG3 PRO 61 HG1 PRO 61 9.127 10.408 1.721
450 HD2 PRO 61 HD2 PRO 61 7.437 8.325 0.395
451 HD3 PRO 61 HD1 PRO 61 8.931 8.134 1.337
452 H ASP 62 HN ASP 62 5.017 10.380 4.695
453 HA ASP 62 HA ASP 62 2.812 8.810 4.098
454 HB2 ASP 62 HB2 ASP 62 1.523 10.194 5.719
455 HB3 ASP 62 HB1 ASP 62 3.065 9.625 6.332
456 H ASP 63 HN ASP 63 3.447 12.097 3.002
457 HA ASP 63 HA ASP 63 0.854 12.635 2.027
458 HB2 ASP 63 HB2 ASP 63 2.545 14.400 2.255
459 HB3 ASP 63 HB1 ASP 63 3.500 13.666 0.972
460 H VAL 64 HN VAL 64 3.416 10.735 0.727
461 HA VAL 64 HA VAL 64 2.613 10.617 -1.991
462 HB VAL 64 HB VAL 64 4.199 8.691 -0.328
463 HG11 VAL 64 HG11 VAL 64 4.036 8.961 -3.360
464 HG12 VAL 64 HG12 VAL 64 3.392 7.623 -2.413
465 HG13 VAL 64 HG13 VAL 64 5.135 7.871 -2.509
466 HG21 VAL 64 HG21 VAL 64 6.183 9.765 -1.315
467 HG22 VAL 64 HG22 VAL 64 5.187 10.905 -0.401
468 HG23 VAL 64 HG23 VAL 64 5.128 10.896 -2.161
469 H ALA 65 HN ALA 65 1.641 8.914 0.886
470 HA ALA 65 HA ALA 65 0.365 6.760 -0.479
471 HB1 ALA 65 HB1 ALA 65 -0.037 7.731 2.344
472 HB2 ALA 65 HB2 ALA 65 1.157 6.538 1.832
473 HB3 ALA 65 HB3 ALA 65 -0.565 6.179 1.696
474 H GLY 66 HN GLY 66 -0.370 9.976 -0.103
475 HA2 GLY 66 HA2 GLY 66 -3.234 9.526 -0.525
476 HA3 GLY 66 HA1 GLY 66 -2.483 11.070 -0.124
477 H ARG 67 HN ARG 67 -0.677 9.349 -2.367
478 HA ARG 67 HA ARG 67 -1.818 10.909 -4.610
479 HB2 ARG 67 HB2 ARG 67 0.975 9.808 -4.355
480 HB3 ARG 67 HB1 ARG 67 0.368 10.869 -5.611
481 HG2 ARG 67 HG2 ARG 67 0.149 12.660 -4.010
482 HG3 ARG 67 HG1 ARG 67 0.687 11.582 -2.716
483 HD2 ARG 67 HD2 ARG 67 2.782 11.209 -4.009
484 HD3 ARG 67 HD1 ARG 67 2.251 12.467 -5.124
485 HE ARG 67 HE ARG 67 2.107 13.603 -2.664
486 HH11 ARG 67 HH11 ARG 67 4.718 12.034 -4.513
487 HH12 ARG 67 HH12 ARG 67 5.944 12.958 -3.801
488 HH21 ARG 67 HH21 ARG 67 3.741 14.770 -1.681
489 HH22 ARG 67 HH22 ARG 67 5.397 14.615 -2.138
490 H VAL 68 HN VAL 68 -1.468 7.853 -3.304
491 HA VAL 68 HA VAL 68 -0.951 6.512 -5.759
492 HB VAL 68 HB VAL 68 -1.325 4.394 -4.452
493 HG11 VAL 68 HG11 VAL 68 0.887 5.359 -4.699
494 HG12 VAL 68 HG12 VAL 68 0.712 4.629 -3.105
495 HG13 VAL 68 HG13 VAL 68 0.617 6.384 -3.287
496 HG21 VAL 68 HG21 VAL 68 -2.887 5.256 -2.755
497 HG22 VAL 68 HG22 VAL 68 -1.602 6.286 -2.112
498 HG23 VAL 68 HG23 VAL 68 -1.460 4.534 -2.005
499 H ASP 69 HN ASP 69 -2.286 6.588 -7.194
500 HA ASP 69 HA ASP 69 -5.084 6.907 -6.986
501 HB2 ASP 69 HB2 ASP 69 -3.803 7.689 -8.894
502 HB3 ASP 69 HB1 ASP 69 -3.339 6.043 -9.268
503 H THR 70 HN THR 70 -3.037 4.147 -7.813
504 HA THR 70 HA THR 70 -5.250 2.356 -7.196
505 HB THR 70 HB THR 70 -4.478 0.904 -9.092
506 HG1 THR 70 HG1 THR 70 -3.045 3.106 -10.134
507 HG21 THR 70 HG21 THR 70 -5.362 2.289 -10.939
508 HG22 THR 70 HG22 THR 70 -5.181 3.723 -9.912
509 HG23 THR 70 HG23 THR 70 -6.341 2.471 -9.474
510 HA PRO 71 HA PRO 71 -2.225 0.311 -4.591
511 HB2 PRO 71 HB2 PRO 71 -3.162 -2.223 -5.870
512 HB3 PRO 71 HB1 PRO 71 -2.975 -1.831 -4.152
513 HG2 PRO 71 HG2 PRO 71 -5.383 -1.842 -5.205
514 HG3 PRO 71 HG1 PRO 71 -4.910 -0.521 -4.113
515 HD2 PRO 71 HD2 PRO 71 -5.080 -0.536 -7.107
516 HD3 PRO 71 HD1 PRO 71 -5.606 0.714 -5.959
517 H ARG 72 HN ARG 72 -2.289 -0.343 -8.016
518 HA ARG 72 HA ARG 72 0.152 -1.677 -8.396
519 HB2 ARG 72 HB2 ARG 72 -1.527 -1.272 -10.189
520 HB3 ARG 72 HB1 ARG 72 -1.144 0.440 -10.151
521 HG2 ARG 72 HG2 ARG 72 -0.061 -0.515 -12.048
522 HG3 ARG 72 HG1 ARG 72 1.185 -0.140 -10.859
523 HD2 ARG 72 HD2 ARG 72 1.624 -2.306 -11.837
524 HD3 ARG 72 HD1 ARG 72 1.163 -2.510 -10.148
525 HE ARG 72 HE ARG 72 -1.037 -2.701 -11.961
526 HH11 ARG 72 HH11 ARG 72 1.621 -4.585 -10.511
527 HH12 ARG 72 HH12 ARG 72 0.877 -6.082 -10.633
528 HH21 ARG 72 HH21 ARG 72 -2.113 -4.718 -12.172
529 HH22 ARG 72 HH22 ARG 72 -1.378 -6.194 -11.687
530 H GLU 73 HN GLU 73 -0.643 1.724 -8.046
531 HA GLU 73 HA GLU 73 1.933 2.821 -8.531
532 HB2 GLU 73 HB2 GLU 73 -0.258 4.033 -8.675
533 HB3 GLU 73 HB1 GLU 73 -0.377 3.942 -6.930
534 HG2 GLU 73 HG2 GLU 73 0.348 6.125 -7.577
535 HG3 GLU 73 HG1 GLU 73 1.673 5.295 -6.761
536 H LEU 74 HN LEU 74 0.157 1.861 -5.664
537 HA LEU 74 HA LEU 74 2.044 2.777 -3.741
538 HB2 LEU 74 HB2 LEU 74 -0.445 2.346 -3.398
539 HB3 LEU 74 HB1 LEU 74 -0.086 0.641 -3.410
540 HG LEU 74 HG LEU 74 -0.512 1.609 -1.152
541 HD11 LEU 74 HD11 LEU 74 2.236 0.462 -1.498
542 HD12 LEU 74 HD12 LEU 74 0.734 -0.441 -1.306
543 HD13 LEU 74 HD13 LEU 74 1.338 0.557 0.017
544 HD21 LEU 74 HD21 LEU 74 0.496 3.789 -1.448
545 HD22 LEU 74 HD22 LEU 74 2.092 3.051 -1.601
546 HD23 LEU 74 HD23 LEU 74 1.219 2.959 -0.071
547 H LEU 75 HN LEU 75 1.382 -0.368 -5.215
548 HA LEU 75 HA LEU 75 3.310 -1.901 -3.874
549 HB2 LEU 75 HB2 LEU 75 1.453 -2.821 -5.220
550 HB3 LEU 75 HB1 LEU 75 2.203 -2.199 -6.672
551 HG LEU 75 HG LEU 75 4.086 -3.764 -6.353
552 HD11 LEU 75 HD11 LEU 75 3.897 -5.548 -4.702
553 HD12 LEU 75 HD12 LEU 75 2.440 -4.797 -4.051
554 HD13 LEU 75 HD13 LEU 75 3.991 -3.967 -3.926
555 HD21 LEU 75 HD21 LEU 75 1.356 -5.044 -6.331
556 HD22 LEU 75 HD22 LEU 75 2.846 -5.799 -6.895
557 HD23 LEU 75 HD23 LEU 75 2.192 -4.396 -7.742
558 H ASP 76 HN ASP 76 3.389 -0.077 -6.882
559 HA ASP 76 HA ASP 76 5.976 -0.645 -7.742
560 HB2 ASP 76 HB2 ASP 76 4.352 0.437 -9.173
561 HB3 ASP 76 HB1 ASP 76 4.322 1.843 -8.119
562 H LEU 77 HN LEU 77 4.791 2.039 -5.788
563 HA LEU 77 HA LEU 77 7.126 3.427 -5.284
564 HB2 LEU 77 HB2 LEU 77 5.054 4.315 -4.560
565 HB3 LEU 77 HB1 LEU 77 4.706 2.910 -3.580
566 HG LEU 77 HG LEU 77 6.559 3.572 -2.058
567 HD11 LEU 77 HD11 LEU 77 6.606 6.124 -3.661
568 HD12 LEU 77 HD12 LEU 77 7.889 4.915 -3.568
569 HD13 LEU 77 HD13 LEU 77 7.441 5.828 -2.133
570 HD21 LEU 77 HD21 LEU 77 5.319 5.373 -0.981
571 HD22 LEU 77 HD22 LEU 77 4.252 4.084 -1.533
572 HD23 LEU 77 HD23 LEU 77 4.359 5.593 -2.445
573 H ILE 78 HN ILE 78 5.767 0.757 -3.412
574 HA ILE 78 HA ILE 78 7.943 0.742 -1.606
575 HB ILE 78 HB ILE 78 5.825 -1.388 -2.018
576 HG12 ILE 78 HG12 ILE 78 6.042 0.944 -0.103
577 HG13 ILE 78 HG11 ILE 78 4.910 0.786 -1.436
578 HG21 ILE 78 HG21 ILE 78 7.737 -0.939 0.295
579 HG22 ILE 78 HG22 ILE 78 7.820 -2.268 -0.860
580 HG23 ILE 78 HG23 ILE 78 6.449 -2.143 0.242
581 HD11 ILE 78 HD11 ILE 78 5.003 -0.901 1.039
582 HD12 ILE 78 HD12 ILE 78 3.882 -1.118 -0.306
583 HD13 ILE 78 HD13 ILE 78 3.823 0.357 0.665
584 H ASN 79 HN ASN 79 7.216 -1.174 -4.484
585 HA ASN 79 HA ASN 79 9.420 -2.944 -4.171
586 HB2 ASN 79 HB2 ASN 79 7.832 -2.144 -6.618
587 HB3 ASN 79 HB1 ASN 79 9.269 -3.139 -6.777
588 HD21 ASN 79 HD21 ASN 79 7.053 -3.395 -4.069
589 HD22 ASN 79 HD22 ASN 79 6.443 -4.960 -4.493
590 H GLY 80 HN GLY 80 9.111 0.180 -5.794
591 HA2 GLY 80 HA2 GLY 80 11.721 0.351 -6.788
592 HA3 GLY 80 HA1 GLY 80 10.696 1.720 -6.369
593 H ALA 81 HN ALA 81 10.364 1.371 -3.686
594 HA ALA 81 HA ALA 81 12.742 2.400 -2.592
595 HB1 ALA 81 HB1 ALA 81 11.629 2.225 -0.426
596 HB2 ALA 81 HB2 ALA 81 10.401 1.171 -1.132
597 HB3 ALA 81 HB3 ALA 81 10.520 2.853 -1.647
598 H LEU 82 HN LEU 82 11.350 -0.852 -2.501
599 HA LEU 82 HA LEU 82 13.258 -1.962 -0.755
600 HB2 LEU 82 HB2 LEU 82 11.333 -3.238 -2.668
601 HB3 LEU 82 HB1 LEU 82 12.395 -4.159 -1.623
602 HG LEU 82 HG LEU 82 10.284 -2.222 -0.673
603 HD11 LEU 82 HD11 LEU 82 9.315 -4.217 -1.687
604 HD12 LEU 82 HD12 LEU 82 9.088 -4.219 0.061
605 HD13 LEU 82 HD13 LEU 82 10.330 -5.235 -0.668
606 HD21 LEU 82 HD21 LEU 82 12.190 -2.384 0.843
607 HD22 LEU 82 HD22 LEU 82 12.057 -4.139 0.836
608 HD23 LEU 82 HD23 LEU 82 10.762 -3.159 1.535
609 H ALA 83 HN ALA 83 13.582 -1.122 -4.004
610 HA ALA 83 HA ALA 83 15.501 -3.055 -4.773
611 HB1 ALA 83 HB1 ALA 83 14.429 -1.570 -6.415
612 HB2 ALA 83 HB2 ALA 83 16.187 -1.437 -6.498
613 HB3 ALA 83 HB3 ALA 83 15.244 -0.184 -5.691
614 H GLU 84 HN GLU 84 15.636 -0.112 -2.962
615 HA GLU 84 HA GLU 84 18.527 -0.356 -2.566
616 HB2 GLU 84 HB2 GLU 84 16.590 1.843 -1.774
617 HB3 GLU 84 HB1 GLU 84 18.340 1.894 -1.553
618 HG2 GLU 84 HG2 GLU 84 18.690 1.832 -3.938
619 HG3 GLU 84 HG1 GLU 84 16.965 1.634 -4.218
620 H ALA 85 HN ALA 85 15.437 -0.509 -1.015
621 HA ALA 85 HA ALA 85 14.610 -1.607 0.687
622 HB1 ALA 85 HB1 ALA 85 16.125 -3.440 0.024
623 HB2 ALA 85 HB2 ALA 85 15.706 -3.440 1.732
624 HB3 ALA 85 HB3 ALA 85 17.296 -2.865 1.216
625 H ALA 86 HN ALA 86 16.894 0.659 1.110
626 HA ALA 86 HA ALA 86 17.303 2.213 2.641
627 HB1 ALA 86 HB1 ALA 86 14.849 2.352 2.865
628 HB2 ALA 86 HB2 ALA 86 15.682 2.729 4.372
629 HB3 ALA 86 HB3 ALA 86 14.915 1.155 4.160
630 H28 SXV 87 H28A SXV 87 -6.213 13.688 3.642
631 H28A SXV 87 H28B SXV 87 -4.865 12.602 3.948
632 H30 SXV 87 H30C SXV 87 -5.121 14.769 5.679
633 H30A SXV 87 H30A SXV 87 -3.521 15.492 5.530
634 H30B SXV 87 H30B SXV 87 -3.699 13.738 5.537
635 H31 SXV 87 H31C SXV 87 -2.419 13.640 3.526
636 H31A SXV 87 H31A SXV 87 -2.293 15.383 3.374
637 H31B SXV 87 H31B SXV 87 -2.921 14.426 2.037
638 H32 SXV 87 H32A SXV 87 -4.203 16.860 3.562
639 HO33 SXV 87 H33A SXV 87 -6.755 16.753 3.462
640 HN36 SXV 87 H36A SXV 87 -4.717 14.530 1.235
641 H37 SXV 87 H37B SXV 87 -4.791 16.446 -0.867
642 H37A SXV 87 H37A SXV 87 -6.333 15.627 -0.737
643 H38 SXV 87 H38B SXV 87 -5.250 13.502 -1.218
644 H38A SXV 87 H38A SXV 87 -3.658 14.266 -0.987
645 HN41 SXV 87 H41A SXV 87 -3.524 13.026 -3.022
646 H42 SXV 87 H42B SXV 87 -4.083 14.732 -5.353
647 H42A SXV 87 H42A SXV 87 -3.916 12.966 -5.373
648 H43 SXV 87 H43B SXV 87 -1.742 14.942 -4.691
649 H43A SXV 87 H43A SXV 87 -1.615 13.186 -4.593
650 H1 SXV 87 H1B SXV 87 0.275 15.269 -6.109
651 H1A SXV 87 H1A SXV 87 0.635 13.538 -5.991
652 H2 SXV 87 H2A SXV 87 0.538 14.994 -8.589
653 H2A SXV 87 H2B SXV 87 1.006 13.321 -8.295
654 H4 SXV 87 H4C SXV 87 3.234 16.737 -7.731
655 H4A SXV 87 H4A SXV 87 2.128 16.339 -9.052
656 H4B SXV 87 H4B SXV 87 3.770 15.680 -9.047
Start of MODEL 12
1 H1 MET 1 HT1 MET 1 19.212 -8.991 -8.516
2 H2 MET 1 HT2 MET 1 20.685 -9.491 -7.832
3 H3 MET 1 HT3 MET 1 20.248 -7.839 -7.867
4 HA MET 1 HA MET 1 18.808 -9.899 -6.360
5 HB2 MET 1 HB2 MET 1 20.614 -7.636 -5.474
6 HB3 MET 1 HB1 MET 1 19.575 -8.547 -4.394
7 HG2 MET 1 HG2 MET 1 21.862 -9.639 -6.003
8 HG3 MET 1 HG1 MET 1 21.853 -9.315 -4.269
9 HE1 MET 1 HE1 MET 1 22.645 -11.744 -3.668
10 HE2 MET 1 HE2 MET 1 22.760 -12.101 -5.392
11 HE3 MET 1 HE3 MET 1 21.901 -13.206 -4.317
12 H ALA 2 HN ALA 2 16.880 -9.258 -5.599
13 HA ALA 2 HA ALA 2 16.090 -6.496 -5.834
14 HB1 ALA 2 HB1 ALA 2 14.624 -8.685 -7.301
15 HB2 ALA 2 HB2 ALA 2 15.562 -7.393 -8.052
16 HB3 ALA 2 HB3 ALA 2 14.095 -7.010 -7.149
17 H THR 3 HN THR 3 15.641 -6.330 -3.708
18 HA THR 3 HA THR 3 13.962 -8.258 -2.410
19 HB THR 3 HB THR 3 14.182 -6.230 -0.687
20 HG1 THR 3 HG1 THR 3 15.357 -4.690 -1.593
21 HG21 THR 3 HG21 THR 3 15.119 -8.485 -0.362
22 HG22 THR 3 HG22 THR 3 16.266 -7.242 0.143
23 HG23 THR 3 HG23 THR 3 16.480 -8.066 -1.402
24 H LEU 4 HN LEU 4 11.870 -8.161 -3.073
25 HA LEU 4 HA LEU 4 10.594 -5.519 -3.330
26 HB2 LEU 4 HB2 LEU 4 10.176 -7.881 -5.170
27 HB3 LEU 4 HB1 LEU 4 9.351 -6.344 -5.265
28 HG LEU 4 HG LEU 4 12.293 -6.801 -5.791
29 HD11 LEU 4 HD11 LEU 4 10.883 -7.744 -7.523
30 HD12 LEU 4 HD12 LEU 4 11.720 -6.307 -8.113
31 HD13 LEU 4 HD13 LEU 4 10.016 -6.215 -7.668
32 HD21 LEU 4 HD21 LEU 4 11.870 -4.584 -4.885
33 HD22 LEU 4 HD22 LEU 4 10.612 -4.320 -6.095
34 HD23 LEU 4 HD23 LEU 4 12.295 -4.495 -6.593
35 H LEU 5 HN LEU 5 8.216 -5.705 -3.127
36 HA LEU 5 HA LEU 5 7.465 -8.103 -1.666
37 HB2 LEU 5 HB2 LEU 5 5.823 -6.802 -0.371
38 HB3 LEU 5 HB1 LEU 5 7.437 -6.205 -0.114
39 HG LEU 5 HG LEU 5 6.781 -4.337 -1.801
40 HD11 LEU 5 HD11 LEU 5 4.040 -5.283 -0.994
41 HD12 LEU 5 HD12 LEU 5 4.722 -5.335 -2.620
42 HD13 LEU 5 HD13 LEU 5 4.416 -3.781 -1.843
43 HD21 LEU 5 HD21 LEU 5 5.798 -3.014 -0.014
44 HD22 LEU 5 HD22 LEU 5 7.153 -3.981 0.570
45 HD23 LEU 5 HD23 LEU 5 5.498 -4.484 0.914
46 H THR 6 HN THR 6 5.450 -8.983 -2.132
47 HA THR 6 HA THR 6 4.649 -8.268 -4.841
48 HB THR 6 HB THR 6 3.773 -10.598 -4.983
49 HG1 THR 6 HG1 THR 6 4.770 -10.679 -2.323
50 HG21 THR 6 HG21 THR 6 6.705 -10.345 -4.292
51 HG22 THR 6 HG22 THR 6 5.983 -10.046 -5.874
52 HG23 THR 6 HG23 THR 6 5.979 -11.675 -5.193
53 H THR 7 HN THR 7 2.291 -9.554 -5.065
54 HA THR 7 HA THR 7 0.441 -7.791 -4.031
55 HB THR 7 HB THR 7 -1.177 -9.667 -4.730
56 HG1 THR 7 HG1 THR 7 -0.245 -11.534 -5.158
57 HG21 THR 7 HG21 THR 7 0.853 -8.622 -6.708
58 HG22 THR 7 HG22 THR 7 -0.554 -7.736 -6.129
59 HG23 THR 7 HG23 THR 7 -0.769 -9.199 -7.097
60 H ASP 8 HN ASP 8 1.406 -10.995 -2.934
61 HA ASP 8 HA ASP 8 -0.516 -11.393 -0.937
62 HB2 ASP 8 HB2 ASP 8 2.315 -12.443 -1.114
63 HB3 ASP 8 HB1 ASP 8 1.110 -13.018 0.027
64 H ASP 9 HN ASP 9 2.642 -9.896 -0.835
65 HA ASP 9 HA ASP 9 2.767 -9.533 1.984
66 HB2 ASP 9 HB2 ASP 9 4.196 -7.940 -0.159
67 HB3 ASP 9 HB1 ASP 9 4.660 -8.072 1.529
68 H LEU 10 HN LEU 10 2.016 -7.420 -0.741
69 HA LEU 10 HA LEU 10 1.402 -5.080 0.677
70 HB2 LEU 10 HB2 LEU 10 1.826 -5.144 -1.733
71 HB3 LEU 10 HB1 LEU 10 0.353 -6.061 -1.975
72 HG LEU 10 HG LEU 10 -0.951 -4.104 -1.182
73 HD11 LEU 10 HD11 LEU 10 0.724 -3.064 0.217
74 HD12 LEU 10 HD12 LEU 10 0.141 -1.932 -1.002
75 HD13 LEU 10 HD13 LEU 10 1.713 -2.708 -1.199
76 HD21 LEU 10 HD21 LEU 10 0.914 -3.565 -3.486
77 HD22 LEU 10 HD22 LEU 10 -0.622 -2.748 -3.193
78 HD23 LEU 10 HD23 LEU 10 -0.597 -4.471 -3.561
79 H ARG 11 HN ARG 11 -0.593 -7.753 -0.403
80 HA ARG 11 HA ARG 11 -3.154 -6.926 0.188
81 HB2 ARG 11 HB2 ARG 11 -2.581 -9.013 -0.961
82 HB3 ARG 11 HB1 ARG 11 -1.954 -9.672 0.539
83 HG2 ARG 11 HG2 ARG 11 -4.257 -9.454 1.493
84 HG3 ARG 11 HG1 ARG 11 -4.811 -9.023 -0.130
85 HD2 ARG 11 HD2 ARG 11 -3.425 -11.579 0.661
86 HD3 ARG 11 HD1 ARG 11 -5.139 -11.400 0.304
87 HE ARG 11 HE ARG 11 -4.425 -10.762 -1.968
88 HH11 ARG 11 HH11 ARG 11 -2.481 -12.945 0.044
89 HH12 ARG 11 HH12 ARG 11 -1.600 -13.602 -1.261
90 HH21 ARG 11 HH21 ARG 11 -3.210 -11.698 -3.805
91 HH22 ARG 11 HH22 ARG 11 -2.041 -12.865 -3.523
92 H ARG 12 HN ARG 12 -0.860 -8.619 2.288
93 HA ARG 12 HA ARG 12 -2.609 -8.761 4.500
94 HB2 ARG 12 HB2 ARG 12 0.409 -8.846 4.527
95 HB3 ARG 12 HB1 ARG 12 -0.634 -9.300 5.865
96 HG2 ARG 12 HG2 ARG 12 -1.604 -11.077 4.426
97 HG3 ARG 12 HG1 ARG 12 -0.407 -10.663 3.195
98 HD2 ARG 12 HD2 ARG 12 1.371 -11.089 4.868
99 HD3 ARG 12 HD1 ARG 12 0.130 -11.630 5.995
100 HE ARG 12 HE ARG 12 0.561 -12.951 3.398
101 HH11 ARG 12 HH11 ARG 12 0.174 -13.213 6.944
102 HH12 ARG 12 HH12 ARG 12 0.368 -14.899 6.946
103 HH21 ARG 12 HH21 ARG 12 0.848 -15.197 3.457
104 HH22 ARG 12 HH22 ARG 12 0.790 -16.077 4.928
105 H ALA 13 HN ALA 13 -0.166 -6.364 3.655
106 HA ALA 13 HA ALA 13 -0.455 -4.861 6.063
107 HB1 ALA 13 HB1 ALA 13 0.540 -3.960 3.369
108 HB2 ALA 13 HB2 ALA 13 1.523 -4.683 4.641
109 HB3 ALA 13 HB3 ALA 13 0.763 -3.111 4.896
110 H LEU 14 HN LEU 14 -2.001 -4.817 2.942
111 HA LEU 14 HA LEU 14 -3.486 -2.432 3.323
112 HB2 LEU 14 HB2 LEU 14 -2.888 -3.484 1.125
113 HB3 LEU 14 HB1 LEU 14 -4.045 -4.742 1.462
114 HG LEU 14 HG LEU 14 -5.885 -3.130 1.375
115 HD11 LEU 14 HD11 LEU 14 -4.692 -1.166 2.210
116 HD12 LEU 14 HD12 LEU 14 -5.478 -0.823 0.667
117 HD13 LEU 14 HD13 LEU 14 -3.738 -1.106 0.728
118 HD21 LEU 14 HD21 LEU 14 -4.017 -2.946 -0.984
119 HD22 LEU 14 HD22 LEU 14 -5.747 -2.601 -1.006
120 HD23 LEU 14 HD23 LEU 14 -5.179 -4.237 -0.678
121 H VAL 15 HN VAL 15 -3.827 -5.626 4.400
122 HA VAL 15 HA VAL 15 -6.595 -5.318 5.192
123 HB VAL 15 HB VAL 15 -4.517 -7.421 5.968
124 HG11 VAL 15 HG11 VAL 15 -6.170 -7.161 7.755
125 HG12 VAL 15 HG12 VAL 15 -6.378 -8.701 6.921
126 HG13 VAL 15 HG13 VAL 15 -7.473 -7.363 6.586
127 HG21 VAL 15 HG21 VAL 15 -5.838 -8.922 4.554
128 HG22 VAL 15 HG22 VAL 15 -5.221 -7.546 3.637
129 HG23 VAL 15 HG23 VAL 15 -6.912 -7.583 4.141
130 H GLU 16 HN GLU 16 -3.425 -5.396 6.767
131 HA GLU 16 HA GLU 16 -4.070 -5.004 9.391
132 HB2 GLU 16 HB2 GLU 16 -1.667 -4.004 7.891
133 HB3 GLU 16 HB1 GLU 16 -1.853 -3.860 9.626
134 HG2 GLU 16 HG2 GLU 16 -2.009 -6.269 9.834
135 HG3 GLU 16 HG1 GLU 16 -1.844 -6.432 8.085
136 H SER 17 HN SER 17 -3.771 -2.361 6.989
137 HA SER 17 HA SER 17 -4.029 -0.390 8.973
138 HB2 SER 17 HB2 SER 17 -4.622 1.060 6.871
139 HB3 SER 17 HB1 SER 17 -2.991 0.426 7.097
140 HG SER 17 HG SER 17 -5.054 -0.697 5.493
141 H ALA 18 HN ALA 18 -6.450 -2.224 7.306
142 HA ALA 18 HA ALA 18 -8.581 -0.493 8.251
143 HB1 ALA 18 HB1 ALA 18 -8.681 -3.250 6.985
144 HB2 ALA 18 HB2 ALA 18 -8.896 -1.719 6.133
145 HB3 ALA 18 HB3 ALA 18 -10.083 -2.239 7.331
146 H GLY 19 HN GLY 19 -7.077 -3.550 8.927
147 HA2 GLY 19 HA2 GLY 19 -6.674 -3.983 11.279
148 HA3 GLY 19 HA1 GLY 19 -8.350 -3.506 11.553
149 H GLU 20 HN GLU 20 -9.290 -5.229 12.184
150 HA GLU 20 HA GLU 20 -8.780 -7.773 10.848
151 HB2 GLU 20 HB2 GLU 20 -10.057 -7.099 13.500
152 HB3 GLU 20 HB1 GLU 20 -9.860 -8.727 12.863
153 HG2 GLU 20 HG2 GLU 20 -7.594 -6.829 13.451
154 HG3 GLU 20 HG1 GLU 20 -8.142 -8.113 14.528
155 H THR 21 HN THR 21 -10.411 -5.491 9.925
156 HA THR 21 HA THR 21 -13.164 -6.005 9.954
157 HB THR 21 HB THR 21 -11.515 -4.836 7.703
158 HG1 THR 21 HG1 THR 21 -12.191 -3.866 10.254
159 HG21 THR 21 HG21 THR 21 -13.918 -5.124 7.241
160 HG22 THR 21 HG22 THR 21 -13.504 -3.414 7.372
161 HG23 THR 21 HG23 THR 21 -14.309 -4.231 8.712
162 H ASP 22 HN ASP 22 -13.539 -8.243 9.553
163 HA ASP 22 HA ASP 22 -12.331 -9.554 7.330
164 HB2 ASP 22 HB2 ASP 22 -13.740 -11.480 7.781
165 HB3 ASP 22 HB1 ASP 22 -13.170 -10.855 9.317
166 H GLY 23 HN GLY 23 -12.863 -9.565 5.346
167 HA2 GLY 23 HA2 GLY 23 -14.889 -9.717 3.807
168 HA3 GLY 23 HA1 GLY 23 -15.336 -8.182 4.555
169 H THR 24 HN THR 24 -12.806 -7.081 4.828
170 HA THR 24 HA THR 24 -12.269 -6.386 2.082
171 HB THR 24 HB THR 24 -11.071 -5.238 4.641
172 HG1 THR 24 HG1 THR 24 -12.443 -3.437 4.074
173 HG21 THR 24 HG21 THR 24 -9.622 -4.907 2.677
174 HG22 THR 24 HG22 THR 24 -10.328 -3.375 3.200
175 HG23 THR 24 HG23 THR 24 -10.976 -4.206 1.788
176 H ASP 25 HN ASP 25 -11.473 -8.491 1.608
177 HA ASP 25 HA ASP 25 -8.635 -8.746 2.315
178 HB2 ASP 25 HB2 ASP 25 -8.694 -11.103 1.891
179 HB3 ASP 25 HB1 ASP 25 -10.124 -10.793 2.864
180 H LEU 26 HN LEU 26 -7.420 -9.718 0.314
181 HA LEU 26 HA LEU 26 -8.504 -8.285 -1.983
182 HB2 LEU 26 HB2 LEU 26 -5.647 -8.198 -1.008
183 HB3 LEU 26 HB1 LEU 26 -6.185 -7.565 -2.542
184 HG LEU 26 HG LEU 26 -5.885 -5.731 -1.165
185 HD11 LEU 26 HD11 LEU 26 -8.817 -6.287 -1.176
186 HD12 LEU 26 HD12 LEU 26 -7.861 -5.513 -2.439
187 HD13 LEU 26 HD13 LEU 26 -8.078 -4.712 -0.882
188 HD21 LEU 26 HD21 LEU 26 -6.867 -5.420 1.081
189 HD22 LEU 26 HD22 LEU 26 -5.736 -6.772 1.021
190 HD23 LEU 26 HD23 LEU 26 -7.474 -7.076 1.025
191 H SER 27 HN SER 27 -9.202 -10.436 -2.621
192 HA SER 27 HA SER 27 -7.080 -12.266 -3.386
193 HB2 SER 27 HB2 SER 27 -10.092 -12.563 -3.487
194 HB3 SER 27 HB1 SER 27 -8.939 -13.815 -3.955
195 HG SER 27 HG SER 27 -9.454 -12.722 -1.390
196 H GLY 28 HN GLY 28 -6.405 -12.567 -5.375
197 HA2 GLY 28 HA2 GLY 28 -6.426 -12.591 -7.722
198 HA3 GLY 28 HA1 GLY 28 -8.010 -11.819 -7.689
199 H ASP 29 HN ASP 29 -7.597 -10.114 -9.085
200 HA ASP 29 HA ASP 29 -5.293 -8.479 -8.454
201 HB2 ASP 29 HB2 ASP 29 -5.673 -8.792 -10.851
202 HB3 ASP 29 HB1 ASP 29 -7.310 -8.155 -10.698
203 H PHE 30 HN PHE 30 -5.432 -7.098 -7.046
204 HA PHE 30 HA PHE 30 -7.898 -5.544 -6.704
205 HB2 PHE 30 HB2 PHE 30 -7.132 -5.150 -4.382
206 HB3 PHE 30 HB1 PHE 30 -7.368 -6.862 -4.702
207 HD1 PHE 30 HD2 PHE 30 -5.337 -8.326 -5.041
208 HD2 PHE 30 HD1 PHE 30 -5.028 -4.296 -3.690
209 HE1 PHE 30 HE2 PHE 30 -3.049 -8.760 -4.258
210 HE2 PHE 30 HE1 PHE 30 -2.740 -4.730 -2.915
211 HZ PHE 30 HZ PHE 30 -1.799 -7.011 -3.078
212 H LEU 31 HN LEU 31 -5.296 -5.473 -8.351
213 HA LEU 31 HA LEU 31 -3.981 -3.148 -7.301
214 HB2 LEU 31 HB2 LEU 31 -3.351 -4.868 -9.684
215 HB3 LEU 31 HB1 LEU 31 -2.395 -3.506 -9.155
216 HG LEU 31 HG LEU 31 -1.265 -5.426 -8.484
217 HD11 LEU 31 HD11 LEU 31 -2.670 -4.344 -6.071
218 HD12 LEU 31 HD12 LEU 31 -1.203 -3.720 -6.827
219 HD13 LEU 31 HD13 LEU 31 -1.189 -5.302 -6.049
220 HD21 LEU 31 HD21 LEU 31 -3.000 -7.100 -8.673
221 HD22 LEU 31 HD22 LEU 31 -3.816 -6.460 -7.251
222 HD23 LEU 31 HD23 LEU 31 -2.237 -7.227 -7.086
223 H ASP 32 HN ASP 32 -6.094 -4.040 -9.987
224 HA ASP 32 HA ASP 32 -5.622 -1.506 -11.314
225 HB2 ASP 32 HB2 ASP 32 -6.052 -3.655 -12.552
226 HB3 ASP 32 HB1 ASP 32 -7.720 -3.566 -11.998
227 H LEU 33 HN LEU 33 -7.751 -2.687 -8.975
228 HA LEU 33 HA LEU 33 -9.791 -0.767 -9.554
229 HB2 LEU 33 HB2 LEU 33 -10.869 -1.550 -7.425
230 HB3 LEU 33 HB1 LEU 33 -10.623 -2.786 -8.628
231 HG LEU 33 HG LEU 33 -8.574 -3.487 -7.255
232 HD11 LEU 33 HD11 LEU 33 -8.612 -2.941 -4.883
233 HD12 LEU 33 HD12 LEU 33 -9.928 -1.799 -5.166
234 HD13 LEU 33 HD13 LEU 33 -8.342 -1.509 -5.877
235 HD21 LEU 33 HD21 LEU 33 -11.331 -3.781 -6.079
236 HD22 LEU 33 HD22 LEU 33 -9.941 -4.803 -5.713
237 HD23 LEU 33 HD23 LEU 33 -10.616 -4.783 -7.342
238 H ARG 34 HN ARG 34 -10.547 0.515 -7.316
239 HA ARG 34 HA ARG 34 -8.196 2.248 -6.952
240 HB2 ARG 34 HB2 ARG 34 -11.079 3.017 -6.560
241 HB3 ARG 34 HB1 ARG 34 -9.693 4.076 -6.742
242 HG2 ARG 34 HG2 ARG 34 -10.874 2.329 -8.880
243 HG3 ARG 34 HG1 ARG 34 -11.128 4.060 -8.703
244 HD2 ARG 34 HD2 ARG 34 -8.874 4.528 -9.255
245 HD3 ARG 34 HD1 ARG 34 -8.386 2.832 -9.154
246 HE ARG 34 HE ARG 34 -10.456 2.882 -10.925
247 HH11 ARG 34 HH11 ARG 34 -7.173 4.443 -11.022
248 HH12 ARG 34 HH12 ARG 34 -7.223 4.573 -12.683
249 HH21 ARG 34 HH21 ARG 34 -10.409 3.152 -13.213
250 HH22 ARG 34 HH22 ARG 34 -9.061 3.879 -13.960
251 H PHE 35 HN PHE 35 -8.549 3.553 -4.818
252 HA PHE 35 HA PHE 35 -8.716 1.569 -2.759
253 HB2 PHE 35 HB2 PHE 35 -8.225 4.538 -2.592
254 HB3 PHE 35 HB1 PHE 35 -8.089 3.408 -1.240
255 HD1 PHE 35 HD2 PHE 35 -6.448 1.529 -1.408
256 HD2 PHE 35 HD1 PHE 35 -6.451 4.822 -4.101
257 HE1 PHE 35 HE2 PHE 35 -4.144 0.999 -2.063
258 HE2 PHE 35 HE1 PHE 35 -4.196 4.288 -4.774
259 HZ PHE 35 HZ PHE 35 -3.005 2.377 -3.743
260 H GLU 36 HN GLU 36 -10.826 3.622 -4.245
261 HA GLU 36 HA GLU 36 -12.693 4.189 -2.208
262 HB2 GLU 36 HB2 GLU 36 -13.128 3.835 -5.172
263 HB3 GLU 36 HB1 GLU 36 -14.204 4.668 -4.056
264 HG2 GLU 36 HG2 GLU 36 -12.537 6.364 -3.657
265 HG3 GLU 36 HG1 GLU 36 -11.379 5.500 -4.665
266 H ASP 37 HN ASP 37 -12.112 1.439 -4.315
267 HA ASP 37 HA ASP 37 -14.518 0.013 -3.982
268 HB2 ASP 37 HB2 ASP 37 -11.707 -0.995 -4.489
269 HB3 ASP 37 HB1 ASP 37 -13.150 -1.991 -4.587
270 H ILE 38 HN ILE 38 -11.518 0.061 -2.226
271 HA ILE 38 HA ILE 38 -12.518 -1.935 -0.366
272 HB ILE 38 HB ILE 38 -10.145 -2.028 0.462
273 HG12 ILE 38 HG12 ILE 38 -9.680 -0.258 -1.960
274 HG13 ILE 38 HG11 ILE 38 -9.450 0.218 -0.286
275 HG21 ILE 38 HG21 ILE 38 -9.365 -3.292 -1.507
276 HG22 ILE 38 HG22 ILE 38 -10.668 -2.558 -2.453
277 HG23 ILE 38 HG23 ILE 38 -11.055 -3.637 -1.115
278 HD11 ILE 38 HD11 ILE 38 -7.640 -1.402 -0.079
279 HD12 ILE 38 HD12 ILE 38 -7.339 -0.251 -1.382
280 HD13 ILE 38 HD13 ILE 38 -7.885 -1.887 -1.757
281 H GLY 39 HN GLY 39 -13.046 1.048 -0.495
282 HA2 GLY 39 HA2 GLY 39 -13.603 2.713 1.009
283 HA3 GLY 39 HA1 GLY 39 -13.632 1.439 2.216
284 H TYR 40 HN TYR 40 -10.908 2.654 0.334
285 HA TYR 40 HA TYR 40 -9.591 3.295 2.861
286 HB2 TYR 40 HB2 TYR 40 -8.629 2.037 0.393
287 HB3 TYR 40 HB1 TYR 40 -7.542 3.216 1.119
288 HD1 TYR 40 HD2 TYR 40 -9.212 -0.020 1.596
289 HD2 TYR 40 HD1 TYR 40 -6.538 2.845 3.208
290 HE1 TYR 40 HE2 TYR 40 -8.448 -1.671 3.247
291 HE2 TYR 40 HE1 TYR 40 -5.770 1.221 4.857
292 HH TYR 40 HH TYR 40 -6.518 -2.067 4.611
293 H ASP 41 HN ASP 41 -9.075 5.201 3.293
294 HA ASP 41 HA ASP 41 -9.294 7.333 1.311
295 HB2 ASP 41 HB2 ASP 41 -8.883 7.395 4.311
296 HB3 ASP 41 HB1 ASP 41 -8.913 8.828 3.297
297 H SER 42 HN SER 42 -7.587 9.029 1.389
298 HA SER 42 HA SER 42 -5.062 8.007 0.740
299 HB2 SER 42 HB2 SER 42 -4.506 10.509 0.924
300 HB3 SER 42 HB1 SER 42 -5.802 10.061 -0.205
301 H LEU 43 HN LEU 43 -6.367 9.581 3.562
302 HA LEU 43 HA LEU 43 -4.079 9.693 5.176
303 HB2 LEU 43 HB2 LEU 43 -6.981 9.466 5.937
304 HB3 LEU 43 HB1 LEU 43 -5.692 9.802 7.069
305 HG LEU 43 HG LEU 43 -6.464 11.571 4.745
306 HD11 LEU 43 HD11 LEU 43 -6.960 11.876 7.705
307 HD12 LEU 43 HD12 LEU 43 -8.176 11.524 6.476
308 HD13 LEU 43 HD13 LEU 43 -7.333 13.074 6.464
309 HD21 LEU 43 HD21 LEU 43 -4.523 12.010 7.015
310 HD22 LEU 43 HD22 LEU 43 -4.973 13.203 5.798
311 HD23 LEU 43 HD23 LEU 43 -4.097 11.745 5.324
312 H ALA 44 HN ALA 44 -6.316 7.075 4.554
313 HA ALA 44 HA ALA 44 -5.366 5.445 6.727
314 HB1 ALA 44 HB1 ALA 44 -6.792 3.705 5.783
315 HB2 ALA 44 HB2 ALA 44 -7.061 4.695 4.349
316 HB3 ALA 44 HB3 ALA 44 -7.666 5.231 5.916
317 H LEU 45 HN LEU 45 -4.747 5.821 3.335
318 HA LEU 45 HA LEU 45 -3.213 3.524 2.844
319 HB2 LEU 45 HB2 LEU 45 -3.053 6.255 1.596
320 HB3 LEU 45 HB1 LEU 45 -2.286 4.814 0.952
321 HG LEU 45 HG LEU 45 -5.249 5.205 1.292
322 HD11 LEU 45 HD11 LEU 45 -3.526 5.203 -1.175
323 HD12 LEU 45 HD12 LEU 45 -4.342 6.606 -0.479
324 HD13 LEU 45 HD13 LEU 45 -5.286 5.275 -1.148
325 HD21 LEU 45 HD21 LEU 45 -5.410 3.127 0.043
326 HD22 LEU 45 HD22 LEU 45 -4.538 2.900 1.566
327 HD23 LEU 45 HD23 LEU 45 -3.653 3.003 0.038
328 H MET 46 HN MET 46 -2.493 6.478 4.384
329 HA MET 46 HA MET 46 0.337 6.344 4.273
330 HB2 MET 46 HB2 MET 46 -1.438 7.736 6.296
331 HB3 MET 46 HB1 MET 46 0.276 8.051 6.049
332 HG2 MET 46 HG2 MET 46 -0.134 8.849 3.820
333 HG3 MET 46 HG1 MET 46 -1.835 8.409 3.950
334 HE1 MET 46 HE1 MET 46 -2.072 12.262 3.813
335 HE2 MET 46 HE2 MET 46 -2.682 10.733 3.185
336 HE3 MET 46 HE3 MET 46 -1.002 11.192 2.904
337 H GLU 47 HN GLU 47 -2.107 4.930 6.325
338 HA GLU 47 HA GLU 47 -0.170 4.019 8.235
339 HB2 GLU 47 HB2 GLU 47 -2.469 4.576 8.936
340 HB3 GLU 47 HB1 GLU 47 -3.082 3.267 7.936
341 HG2 GLU 47 HG2 GLU 47 -1.941 1.631 9.280
342 HG3 GLU 47 HG1 GLU 47 -1.175 2.902 10.228
343 H THR 48 HN THR 48 -1.923 2.770 5.448
344 HA THR 48 HA THR 48 -1.231 0.082 5.518
345 HB THR 48 HB THR 48 -1.274 1.896 3.084
346 HG1 THR 48 HG1 THR 48 -3.382 0.590 4.489
347 HG21 THR 48 HG21 THR 48 -0.440 -0.383 2.646
348 HG22 THR 48 HG22 THR 48 -2.021 -0.139 1.901
349 HG23 THR 48 HG23 THR 48 -1.885 -1.057 3.399
350 H ALA 49 HN ALA 49 0.475 2.833 4.049
351 HA ALA 49 HA ALA 49 2.820 1.536 3.283
352 HB1 ALA 49 HB1 ALA 49 3.804 3.773 3.208
353 HB2 ALA 49 HB2 ALA 49 2.447 4.405 4.141
354 HB3 ALA 49 HB3 ALA 49 2.181 3.769 2.517
355 H ALA 50 HN ALA 50 2.005 3.219 6.290
356 HA ALA 50 HA ALA 50 4.444 2.939 7.597
357 HB1 ALA 50 HB1 ALA 50 2.663 4.455 8.310
358 HB2 ALA 50 HB2 ALA 50 3.232 3.432 9.631
359 HB3 ALA 50 HB3 ALA 50 1.705 3.069 8.830
360 H ARG 51 HN ARG 51 1.815 0.648 7.267
361 HA ARG 51 HA ARG 51 2.622 -1.239 9.244
362 HB2 ARG 51 HB2 ARG 51 1.397 -1.864 6.535
363 HB3 ARG 51 HB1 ARG 51 1.450 -2.944 7.903
364 HG2 ARG 51 HG2 ARG 51 -0.146 -0.388 7.739
365 HG3 ARG 51 HG1 ARG 51 -0.776 -2.007 7.479
366 HD2 ARG 51 HD2 ARG 51 -1.398 -1.508 9.664
367 HD3 ARG 51 HD1 ARG 51 0.043 -2.494 9.862
368 HE ARG 51 HE ARG 51 0.587 0.313 9.816
369 HH11 ARG 51 HH11 ARG 51 -0.456 -2.390 11.903
370 HH12 ARG 51 HH12 ARG 51 -0.015 -1.636 13.348
371 HH21 ARG 51 HH21 ARG 51 1.129 1.409 11.877
372 HH22 ARG 51 HH22 ARG 51 0.906 0.550 13.328
373 H LEU 52 HN LEU 52 3.285 -0.944 5.825
374 HA LEU 52 HA LEU 52 5.141 -3.049 5.666
375 HB2 LEU 52 HB2 LEU 52 4.547 -0.765 3.802
376 HB3 LEU 52 HB1 LEU 52 5.679 -2.053 3.420
377 HG LEU 52 HG LEU 52 2.790 -2.573 4.116
378 HD11 LEU 52 HD11 LEU 52 2.421 -2.926 1.735
379 HD12 LEU 52 HD12 LEU 52 4.050 -2.328 1.394
380 HD13 LEU 52 HD13 LEU 52 2.838 -1.256 2.098
381 HD21 LEU 52 HD21 LEU 52 4.914 -4.276 2.831
382 HD22 LEU 52 HD22 LEU 52 3.234 -4.747 3.099
383 HD23 LEU 52 HD23 LEU 52 4.296 -4.441 4.474
384 H GLU 53 HN GLU 53 5.578 0.360 6.396
385 HA GLU 53 HA GLU 53 8.368 0.491 6.151
386 HB2 GLU 53 HB2 GLU 53 6.639 1.815 8.246
387 HB3 GLU 53 HB1 GLU 53 8.326 2.196 7.958
388 HG2 GLU 53 HG2 GLU 53 7.700 2.867 5.649
389 HG3 GLU 53 HG1 GLU 53 6.008 2.653 6.112
390 H SER 54 HN SER 54 6.398 -0.415 8.890
391 HA SER 54 HA SER 54 8.415 -1.165 10.679
392 HB2 SER 54 HB2 SER 54 6.182 -0.730 11.437
393 HB3 SER 54 HB1 SER 54 5.512 -1.937 10.350
394 HG SER 54 HG SER 54 7.173 -2.467 12.625
395 H ARG 55 HN ARG 55 6.696 -2.911 8.191
396 HA ARG 55 HA ARG 55 7.544 -5.508 8.896
397 HB2 ARG 55 HB2 ARG 55 5.507 -4.920 7.630
398 HB3 ARG 55 HB1 ARG 55 6.513 -4.504 6.257
399 HG2 ARG 55 HG2 ARG 55 7.264 -6.799 6.087
400 HG3 ARG 55 HG1 ARG 55 6.311 -7.226 7.514
401 HD2 ARG 55 HD2 ARG 55 4.293 -6.401 6.301
402 HD3 ARG 55 HD1 ARG 55 5.298 -6.232 4.864
403 HE ARG 55 HE ARG 55 5.623 -8.602 4.886
404 HH11 ARG 55 HH11 ARG 55 3.072 -7.346 6.995
405 HH12 ARG 55 HH12 ARG 55 2.199 -8.800 7.100
406 HH21 ARG 55 HH21 ARG 55 4.420 -10.630 4.946
407 HH22 ARG 55 HH22 ARG 55 3.042 -10.748 5.943
408 H TYR 56 HN TYR 56 8.919 -3.120 6.639
409 HA TYR 56 HA TYR 56 10.982 -5.135 5.988
410 HB2 TYR 56 HB2 TYR 56 9.931 -2.929 4.247
411 HB3 TYR 56 HB1 TYR 56 11.325 -3.927 3.849
412 HD1 TYR 56 HD2 TYR 56 10.982 -6.428 3.707
413 HD2 TYR 56 HD1 TYR 56 7.773 -3.651 3.769
414 HE1 TYR 56 HE2 TYR 56 9.497 -8.136 2.777
415 HE2 TYR 56 HE1 TYR 56 6.276 -5.359 2.849
416 HH TYR 56 HH TYR 56 6.994 -8.557 2.877
417 H GLY 57 HN GLY 57 10.603 -2.139 7.503
418 HA2 GLY 57 HA2 GLY 57 12.245 -0.857 8.475
419 HA3 GLY 57 HA1 GLY 57 13.463 -1.850 7.672
420 H VAL 58 HN VAL 58 10.758 0.023 6.466
421 HA VAL 58 HA VAL 58 12.654 1.474 4.799
422 HB VAL 58 HB VAL 58 10.910 1.774 3.048
423 HG11 VAL 58 HG11 VAL 58 12.608 0.093 2.800
424 HG12 VAL 58 HG12 VAL 58 11.079 -0.465 2.119
425 HG13 VAL 58 HG13 VAL 58 11.620 -1.069 3.688
426 HG21 VAL 58 HG21 VAL 58 8.969 0.296 3.007
427 HG22 VAL 58 HG22 VAL 58 8.913 1.385 4.395
428 HG23 VAL 58 HG23 VAL 58 9.381 -0.305 4.615
429 H SER 59 HN SER 59 11.476 3.503 3.818
430 HA SER 59 HA SER 59 10.110 4.854 6.008
431 HB2 SER 59 HB2 SER 59 12.454 5.929 4.418
432 HB3 SER 59 HB1 SER 59 11.591 6.776 5.710
433 HG SER 59 HG SER 59 12.178 4.576 6.788
434 H ILE 60 HN ILE 60 8.228 5.329 5.184
435 HA ILE 60 HA ILE 60 8.075 6.262 2.390
436 HB ILE 60 HB ILE 60 5.926 4.733 3.892
437 HG12 ILE 60 HG12 ILE 60 7.711 3.742 1.655
438 HG13 ILE 60 HG11 ILE 60 7.978 3.376 3.353
439 HG21 ILE 60 HG21 ILE 60 5.068 6.262 2.172
440 HG22 ILE 60 HG22 ILE 60 4.853 4.584 1.675
441 HG23 ILE 60 HG23 ILE 60 6.159 5.547 0.983
442 HD11 ILE 60 HD11 ILE 60 6.890 1.542 2.209
443 HD12 ILE 60 HD12 ILE 60 5.568 2.606 1.729
444 HD13 ILE 60 HD13 ILE 60 5.827 2.231 3.435
445 HA PRO 61 HA PRO 61 6.636 9.879 4.640
446 HB2 PRO 61 HB2 PRO 61 6.336 10.961 1.910
447 HB3 PRO 61 HB1 PRO 61 7.288 11.581 3.265
448 HG2 PRO 61 HG2 PRO 61 8.471 10.449 1.154
449 HG3 PRO 61 HG1 PRO 61 9.091 10.200 2.799
450 HD2 PRO 61 HD2 PRO 61 7.402 8.382 1.118
451 HD3 PRO 61 HD1 PRO 61 8.812 7.991 2.129
452 H ASP 62 HN ASP 62 4.701 10.439 5.210
453 HA ASP 62 HA ASP 62 2.389 9.045 4.671
454 HB2 ASP 62 HB2 ASP 62 2.664 11.851 5.731
455 HB3 ASP 62 HB1 ASP 62 1.165 10.937 5.741
456 H ASP 63 HN ASP 63 3.160 12.290 3.504
457 HA ASP 63 HA ASP 63 0.732 12.759 2.173
458 HB2 ASP 63 HB2 ASP 63 3.449 13.984 1.846
459 HB3 ASP 63 HB1 ASP 63 2.104 14.467 0.827
460 H VAL 64 HN VAL 64 3.447 10.947 1.155
461 HA VAL 64 HA VAL 64 3.010 11.150 -1.655
462 HB VAL 64 HB VAL 64 4.493 9.035 -0.092
463 HG11 VAL 64 HG11 VAL 64 4.016 8.323 -2.399
464 HG12 VAL 64 HG12 VAL 64 5.741 8.643 -2.202
465 HG13 VAL 64 HG13 VAL 64 4.708 9.823 -3.016
466 HG21 VAL 64 HG21 VAL 64 6.524 10.329 -0.623
467 HG22 VAL 64 HG22 VAL 64 5.382 11.235 0.371
468 HG23 VAL 64 HG23 VAL 64 5.514 11.579 -1.353
469 H ALA 65 HN ALA 65 1.599 9.292 0.878
470 HA ALA 65 HA ALA 65 0.605 7.189 -0.807
471 HB1 ALA 65 HB1 ALA 65 -0.179 7.938 2.010
472 HB2 ALA 65 HB2 ALA 65 1.083 6.789 1.564
473 HB3 ALA 65 HB3 ALA 65 -0.604 6.442 1.178
474 H GLY 66 HN GLY 66 -0.211 10.370 -0.405
475 HA2 GLY 66 HA2 GLY 66 -3.057 9.955 -0.927
476 HA3 GLY 66 HA1 GLY 66 -2.273 11.497 -0.580
477 H ARG 67 HN ARG 67 -0.467 9.662 -2.714
478 HA ARG 67 HA ARG 67 -1.588 11.137 -5.003
479 HB2 ARG 67 HB2 ARG 67 0.680 11.850 -4.094
480 HB3 ARG 67 HB1 ARG 67 1.288 10.300 -4.655
481 HG2 ARG 67 HG2 ARG 67 0.624 10.892 -6.938
482 HG3 ARG 67 HG1 ARG 67 0.066 12.456 -6.351
483 HD2 ARG 67 HD2 ARG 67 2.388 12.836 -5.487
484 HD3 ARG 67 HD1 ARG 67 2.869 11.385 -6.374
485 HE ARG 67 HE ARG 67 1.556 13.629 -7.700
486 HH11 ARG 67 HH11 ARG 67 4.267 11.372 -7.511
487 HH12 ARG 67 HH12 ARG 67 5.036 11.981 -8.914
488 HH21 ARG 67 HH21 ARG 67 2.613 14.427 -9.622
489 HH22 ARG 67 HH22 ARG 67 4.064 13.743 -10.138
490 H VAL 68 HN VAL 68 -1.479 8.130 -3.735
491 HA VAL 68 HA VAL 68 -0.722 6.794 -6.191
492 HB VAL 68 HB VAL 68 -1.012 4.651 -4.910
493 HG11 VAL 68 HG11 VAL 68 1.165 5.692 -5.118
494 HG12 VAL 68 HG12 VAL 68 0.997 4.936 -3.534
495 HG13 VAL 68 HG13 VAL 68 0.848 6.686 -3.696
496 HG21 VAL 68 HG21 VAL 68 -1.410 6.490 -2.544
497 HG22 VAL 68 HG22 VAL 68 -1.181 4.743 -2.462
498 HG23 VAL 68 HG23 VAL 68 -2.625 5.409 -3.227
499 H ASP 69 HN ASP 69 -2.093 6.482 -7.692
500 HA ASP 69 HA ASP 69 -4.888 6.875 -7.468
501 HB2 ASP 69 HB2 ASP 69 -3.479 7.221 -9.524
502 HB3 ASP 69 HB1 ASP 69 -3.349 5.481 -9.650
503 H THR 70 HN THR 70 -2.982 3.930 -8.068
504 HA THR 70 HA THR 70 -5.272 2.309 -7.156
505 HB THR 70 HB THR 70 -4.448 0.560 -8.687
506 HG1 THR 70 HG1 THR 70 -2.701 2.532 -9.781
507 HG21 THR 70 HG21 THR 70 -4.904 3.230 -10.015
508 HG22 THR 70 HG22 THR 70 -6.167 2.108 -9.501
509 HG23 THR 70 HG23 THR 70 -5.065 1.664 -10.814
510 HA PRO 71 HA PRO 71 -2.547 0.330 -4.205
511 HB2 PRO 71 HB2 PRO 71 -3.409 -2.294 -5.337
512 HB3 PRO 71 HB1 PRO 71 -3.446 -1.728 -3.660
513 HG2 PRO 71 HG2 PRO 71 -5.695 -1.826 -5.013
514 HG3 PRO 71 HG1 PRO 71 -5.340 -0.395 -4.023
515 HD2 PRO 71 HD2 PRO 71 -5.045 -0.753 -6.991
516 HD3 PRO 71 HD1 PRO 71 -5.774 0.598 -6.094
517 H ARG 72 HN ARG 72 -2.348 -0.730 -7.578
518 HA ARG 72 HA ARG 72 0.189 -2.004 -7.194
519 HB2 ARG 72 HB2 ARG 72 0.403 -2.101 -9.651
520 HB3 ARG 72 HB1 ARG 72 -1.154 -2.702 -9.112
521 HG2 ARG 72 HG2 ARG 72 -2.234 -0.686 -9.810
522 HG3 ARG 72 HG1 ARG 72 -0.682 0.055 -10.196
523 HD2 ARG 72 HD2 ARG 72 -1.807 -0.720 -12.201
524 HD3 ARG 72 HD1 ARG 72 -0.310 -1.604 -11.935
525 HE ARG 72 HE ARG 72 -1.667 -3.460 -11.139
526 HH11 ARG 72 HH11 ARG 72 -3.293 -0.936 -13.013
527 HH12 ARG 72 HH12 ARG 72 -4.552 -1.919 -13.573
528 HH21 ARG 72 HH21 ARG 72 -3.388 -4.884 -11.881
529 HH22 ARG 72 HH22 ARG 72 -4.561 -4.307 -12.930
530 H GLU 73 HN GLU 73 -0.841 1.213 -7.782
531 HA GLU 73 HA GLU 73 1.614 2.335 -8.640
532 HB2 GLU 73 HB2 GLU 73 -0.764 3.350 -8.608
533 HB3 GLU 73 HB1 GLU 73 -0.456 3.696 -6.918
534 HG2 GLU 73 HG2 GLU 73 -0.025 5.648 -8.190
535 HG3 GLU 73 HG1 GLU 73 1.519 5.012 -7.611
536 H LEU 74 HN LEU 74 0.064 1.814 -5.549
537 HA LEU 74 HA LEU 74 2.081 2.918 -3.884
538 HB2 LEU 74 HB2 LEU 74 -0.360 2.579 -3.315
539 HB3 LEU 74 HB1 LEU 74 -0.066 0.867 -3.230
540 HG LEU 74 HG LEU 74 -0.317 2.028 -1.032
541 HD11 LEU 74 HD11 LEU 74 1.533 0.935 0.104
542 HD12 LEU 74 HD12 LEU 74 2.324 0.673 -1.450
543 HD13 LEU 74 HD13 LEU 74 0.780 -0.108 -1.103
544 HD21 LEU 74 HD21 LEU 74 2.339 3.265 -1.737
545 HD22 LEU 74 HD22 LEU 74 1.552 3.339 -0.157
546 HD23 LEU 74 HD23 LEU 74 0.800 4.109 -1.554
547 H LEU 75 HN LEU 75 1.369 -0.299 -5.085
548 HA LEU 75 HA LEU 75 3.249 -1.892 -3.814
549 HB2 LEU 75 HB2 LEU 75 1.479 -2.734 -5.254
550 HB3 LEU 75 HB1 LEU 75 2.205 -1.966 -6.644
551 HG LEU 75 HG LEU 75 4.166 -3.522 -6.355
552 HD11 LEU 75 HD11 LEU 75 3.821 -4.105 -4.030
553 HD12 LEU 75 HD12 LEU 75 3.816 -5.544 -5.051
554 HD13 LEU 75 HD13 LEU 75 2.297 -4.890 -4.437
555 HD21 LEU 75 HD21 LEU 75 2.449 -3.890 -8.033
556 HD22 LEU 75 HD22 LEU 75 1.464 -4.749 -6.846
557 HD23 LEU 75 HD23 LEU 75 3.012 -5.420 -7.359
558 H ASP 76 HN ASP 76 3.550 -0.206 -6.936
559 HA ASP 76 HA ASP 76 6.227 -0.887 -7.459
560 HB2 ASP 76 HB2 ASP 76 4.699 -0.045 -9.192
561 HB3 ASP 76 HB1 ASP 76 4.724 1.546 -8.435
562 H LEU 77 HN LEU 77 4.841 1.867 -5.847
563 HA LEU 77 HA LEU 77 7.009 3.564 -5.516
564 HB2 LEU 77 HB2 LEU 77 4.618 4.008 -4.902
565 HB3 LEU 77 HB1 LEU 77 4.803 2.960 -3.526
566 HG LEU 77 HG LEU 77 6.302 5.581 -3.859
567 HD11 LEU 77 HD11 LEU 77 3.908 5.954 -3.799
568 HD12 LEU 77 HD12 LEU 77 4.657 6.484 -2.292
569 HD13 LEU 77 HD13 LEU 77 3.775 4.957 -2.350
570 HD21 LEU 77 HD21 LEU 77 6.663 5.417 -1.425
571 HD22 LEU 77 HD22 LEU 77 7.352 4.015 -2.232
572 HD23 LEU 77 HD23 LEU 77 5.813 3.874 -1.391
573 H ILE 78 HN ILE 78 5.924 0.955 -3.402
574 HA ILE 78 HA ILE 78 8.174 1.288 -1.677
575 HB ILE 78 HB ILE 78 6.195 -1.013 -1.695
576 HG12 ILE 78 HG12 ILE 78 6.130 1.608 -0.186
577 HG13 ILE 78 HG11 ILE 78 5.108 1.204 -1.559
578 HG21 ILE 78 HG21 ILE 78 8.257 -1.408 -0.389
579 HG22 ILE 78 HG22 ILE 78 6.858 -1.221 0.674
580 HG23 ILE 78 HG23 ILE 78 7.998 0.108 0.476
581 HD11 ILE 78 HD11 ILE 78 3.925 0.971 0.533
582 HD12 ILE 78 HD12 ILE 78 5.127 -0.191 1.097
583 HD13 ILE 78 HD13 ILE 78 4.093 -0.584 -0.276
584 H ASN 79 HN ASN 79 7.351 -0.819 -4.352
585 HA ASN 79 HA ASN 79 9.464 -2.668 -4.012
586 HB2 ASN 79 HB2 ASN 79 7.854 -1.855 -6.407
587 HB3 ASN 79 HB1 ASN 79 9.301 -2.816 -6.644
588 HD21 ASN 79 HD21 ASN 79 7.048 -3.132 -3.917
589 HD22 ASN 79 HD22 ASN 79 6.503 -4.717 -4.379
590 H GLY 80 HN GLY 80 9.350 0.451 -5.631
591 HA2 GLY 80 HA2 GLY 80 11.981 0.404 -6.640
592 HA3 GLY 80 HA1 GLY 80 11.042 1.853 -6.282
593 H ALA 81 HN ALA 81 10.641 1.583 -3.596
594 HA ALA 81 HA ALA 81 13.035 2.594 -2.499
595 HB1 ALA 81 HB1 ALA 81 10.605 1.547 -1.033
596 HB2 ALA 81 HB2 ALA 81 10.799 3.186 -1.648
597 HB3 ALA 81 HB3 ALA 81 11.851 2.598 -0.361
598 H LEU 82 HN LEU 82 11.455 -0.538 -2.165
599 HA LEU 82 HA LEU 82 13.136 -1.695 -0.264
600 HB2 LEU 82 HB2 LEU 82 11.421 -2.893 -2.394
601 HB3 LEU 82 HB1 LEU 82 12.348 -3.876 -1.283
602 HG LEU 82 HG LEU 82 10.206 -1.913 -0.475
603 HD11 LEU 82 HD11 LEU 82 10.195 -4.923 -0.653
604 HD12 LEU 82 HD12 LEU 82 9.321 -3.820 -1.718
605 HD13 LEU 82 HD13 LEU 82 8.897 -3.917 -0.010
606 HD21 LEU 82 HD21 LEU 82 10.413 -3.003 1.697
607 HD22 LEU 82 HD22 LEU 82 11.932 -2.247 1.212
608 HD23 LEU 82 HD23 LEU 82 11.734 -3.995 1.076
609 H ALA 83 HN ALA 83 13.650 -1.250 -3.640
610 HA ALA 83 HA ALA 83 15.590 -3.271 -4.032
611 HB1 ALA 83 HB1 ALA 83 14.414 -2.174 -5.888
612 HB2 ALA 83 HB2 ALA 83 16.166 -2.075 -6.076
613 HB3 ALA 83 HB3 ALA 83 15.256 -0.668 -5.522
614 H GLU 84 HN GLU 84 15.725 -0.239 -2.418
615 HA GLU 84 HA GLU 84 18.648 -0.456 -2.275
616 HB2 GLU 84 HB2 GLU 84 17.737 1.469 -3.642
617 HB3 GLU 84 HB1 GLU 84 17.013 2.079 -2.166
618 HG2 GLU 84 HG2 GLU 84 19.244 2.286 -1.182
619 HG3 GLU 84 HG1 GLU 84 19.949 1.713 -2.697
620 H ALA 85 HN ALA 85 16.342 -1.487 -0.673
621 HA ALA 85 HA ALA 85 16.899 -0.176 1.883
622 HB1 ALA 85 HB1 ALA 85 14.812 -1.199 2.675
623 HB2 ALA 85 HB2 ALA 85 14.573 -1.932 1.088
624 HB3 ALA 85 HB3 ALA 85 14.524 -0.177 1.264
625 H ALA 86 HN ALA 86 17.969 -1.295 3.333
626 HA ALA 86 HA ALA 86 18.694 -4.054 2.679
627 HB1 ALA 86 HB1 ALA 86 20.617 -3.717 4.167
628 HB2 ALA 86 HB2 ALA 86 20.045 -2.094 4.543
629 HB3 ALA 86 HB3 ALA 86 20.568 -2.486 2.906
630 H28 SXV 87 H28A SXV 87 -5.251 14.679 0.563
631 H28A SXV 87 H28B SXV 87 -5.879 14.932 2.185
632 H30 SXV 87 H30C SXV 87 -4.405 15.202 4.068
633 H30A SXV 87 H30A SXV 87 -2.660 15.015 3.898
634 H30B SXV 87 H30B SXV 87 -3.716 13.614 3.723
635 H31 SXV 87 H31C SXV 87 -2.580 13.180 1.680
636 H31A SXV 87 H31A SXV 87 -1.653 14.666 1.546
637 H31B SXV 87 H31B SXV 87 -2.784 14.182 0.260
638 H32 SXV 87 H32A SXV 87 -2.638 16.862 1.968
639 HO33 SXV 87 H33A SXV 87 -4.942 17.826 2.064
640 HN36 SXV 87 H36A SXV 87 -2.533 16.027 -0.469
641 H37 SXV 87 H37B SXV 87 -4.543 17.459 -2.034
642 H37A SXV 87 H37A SXV 87 -4.006 15.852 -2.497
643 H38 SXV 87 H38B SXV 87 -2.263 18.302 -2.293
644 H38A SXV 87 H38A SXV 87 -2.935 17.644 -3.790
645 HN41 SXV 87 H41A SXV 87 -0.706 17.822 -4.326
646 H42 SXV 87 H42B SXV 87 0.539 15.490 -4.888
647 H42A SXV 87 H42A SXV 87 1.253 15.975 -3.353
648 H43 SXV 87 H43B SXV 87 1.172 17.656 -5.854
649 H43A SXV 87 H43A SXV 87 1.939 18.104 -4.334
650 H1 SXV 87 H1B SXV 87 4.276 18.603 -5.523
651 H1A SXV 87 H1A SXV 87 5.057 17.488 -6.656
652 H2 SXV 87 H2A SXV 87 4.022 19.334 -7.789
653 H2A SXV 87 H2B SXV 87 2.437 18.826 -7.205
654 H4 SXV 87 H4C SXV 87 3.846 18.836 -10.291
655 H4A SXV 87 H4A SXV 87 3.896 17.113 -10.678
656 H4B SXV 87 H4B SXV 87 5.156 17.829 -9.662
Start of MODEL 13
1 H1 MET 1 HT1 MET 1 18.925 -12.455 -1.466
2 H2 MET 1 HT2 MET 1 17.387 -11.837 -1.813
3 H3 MET 1 HT3 MET 1 18.187 -11.356 -0.424
4 HA MET 1 HA MET 1 19.810 -10.193 -1.547
5 HB2 MET 1 HB2 MET 1 20.142 -11.578 -3.503
6 HB3 MET 1 HB1 MET 1 18.511 -11.258 -4.069
7 HG2 MET 1 HG2 MET 1 20.188 -10.031 -5.354
8 HG3 MET 1 HG1 MET 1 19.075 -8.953 -4.520
9 HE1 MET 1 HE1 MET 1 22.199 -10.916 -3.037
10 HE2 MET 1 HE2 MET 1 23.454 -9.687 -3.191
11 HE3 MET 1 HE3 MET 1 22.739 -10.404 -4.637
12 H ALA 2 HN ALA 2 16.726 -10.146 -3.406
13 HA ALA 2 HA ALA 2 16.124 -7.662 -2.024
14 HB1 ALA 2 HB1 ALA 2 15.384 -6.630 -4.115
15 HB2 ALA 2 HB2 ALA 2 15.894 -8.064 -5.010
16 HB3 ALA 2 HB3 ALA 2 17.094 -7.058 -4.201
17 H THR 3 HN THR 3 14.586 -8.616 -0.801
18 HA THR 3 HA THR 3 12.533 -10.216 -1.981
19 HB THR 3 HB THR 3 11.686 -9.879 0.503
20 HG1 THR 3 HG1 THR 3 12.971 -8.478 1.440
21 HG21 THR 3 HG21 THR 3 12.541 -11.993 -0.417
22 HG22 THR 3 HG22 THR 3 13.145 -11.731 1.218
23 HG23 THR 3 HG23 THR 3 14.195 -11.435 -0.166
24 H LEU 4 HN LEU 4 11.118 -9.154 -3.191
25 HA LEU 4 HA LEU 4 10.153 -6.505 -2.371
26 HB2 LEU 4 HB2 LEU 4 9.824 -7.913 -5.028
27 HB3 LEU 4 HB1 LEU 4 9.423 -6.251 -4.664
28 HG LEU 4 HG LEU 4 12.218 -7.395 -4.798
29 HD11 LEU 4 HD11 LEU 4 12.430 -6.062 -6.832
30 HD12 LEU 4 HD12 LEU 4 10.734 -5.591 -6.694
31 HD13 LEU 4 HD13 LEU 4 11.160 -7.279 -6.978
32 HD21 LEU 4 HD21 LEU 4 12.060 -5.543 -3.211
33 HD22 LEU 4 HD22 LEU 4 11.282 -4.548 -4.443
34 HD23 LEU 4 HD23 LEU 4 12.953 -5.066 -4.655
35 H LEU 5 HN LEU 5 8.062 -6.406 -1.684
36 HA LEU 5 HA LEU 5 6.660 -8.825 -1.431
37 HB2 LEU 5 HB2 LEU 5 4.778 -7.459 -0.469
38 HB3 LEU 5 HB1 LEU 5 6.298 -7.369 0.372
39 HG LEU 5 HG LEU 5 6.644 -5.092 -0.679
40 HD11 LEU 5 HD11 LEU 5 5.115 -5.303 -2.571
41 HD12 LEU 5 HD12 LEU 5 4.699 -3.923 -1.551
42 HD13 LEU 5 HD13 LEU 5 3.753 -5.407 -1.458
43 HD21 LEU 5 HD21 LEU 5 4.219 -5.527 1.028
44 HD22 LEU 5 HD22 LEU 5 5.067 -3.989 0.834
45 HD23 LEU 5 HD23 LEU 5 5.883 -5.371 1.588
46 H THR 6 HN THR 6 5.005 -9.685 -2.408
47 HA THR 6 HA THR 6 4.471 -8.660 -5.042
48 HB THR 6 HB THR 6 3.576 -10.980 -5.379
49 HG1 THR 6 HG1 THR 6 3.296 -12.131 -3.755
50 HG21 THR 6 HG21 THR 6 5.896 -10.411 -5.980
51 HG22 THR 6 HG22 THR 6 5.789 -12.064 -5.373
52 HG23 THR 6 HG23 THR 6 6.413 -10.783 -4.335
53 H THR 7 HN THR 7 1.984 -9.851 -5.586
54 HA THR 7 HA THR 7 0.210 -7.914 -4.642
55 HB THR 7 HB THR 7 -1.572 -9.383 -5.625
56 HG1 THR 7 HG1 THR 7 -1.162 -11.386 -6.062
57 HG21 THR 7 HG21 THR 7 -0.402 -7.753 -6.992
58 HG22 THR 7 HG22 THR 7 -0.768 -9.198 -7.935
59 HG23 THR 7 HG23 THR 7 0.873 -8.924 -7.337
60 H ASP 8 HN ASP 8 0.671 -11.252 -3.669
61 HA ASP 8 HA ASP 8 -1.523 -11.379 -1.905
62 HB2 ASP 8 HB2 ASP 8 0.982 -13.067 -1.998
63 HB3 ASP 8 HB1 ASP 8 -0.379 -13.392 -0.933
64 H ASP 9 HN ASP 9 1.842 -10.518 -1.410
65 HA ASP 9 HA ASP 9 1.572 -10.383 1.436
66 HB2 ASP 9 HB2 ASP 9 3.807 -10.610 0.192
67 HB3 ASP 9 HB1 ASP 9 3.659 -8.891 -0.140
68 H LEU 10 HN LEU 10 1.494 -8.043 -1.200
69 HA LEU 10 HA LEU 10 1.193 -5.726 0.336
70 HB2 LEU 10 HB2 LEU 10 1.667 -5.716 -2.084
71 HB3 LEU 10 HB1 LEU 10 0.049 -6.314 -2.398
72 HG LEU 10 HG LEU 10 -0.863 -4.232 -1.393
73 HD11 LEU 10 HD11 LEU 10 0.621 -2.314 -1.100
74 HD12 LEU 10 HD12 LEU 10 2.013 -3.355 -1.404
75 HD13 LEU 10 HD13 LEU 10 1.001 -3.627 0.014
76 HD21 LEU 10 HD21 LEU 10 -0.655 -4.459 -3.804
77 HD22 LEU 10 HD22 LEU 10 1.004 -3.864 -3.729
78 HD23 LEU 10 HD23 LEU 10 -0.337 -2.797 -3.307
79 H ARG 11 HN ARG 11 -1.164 -8.029 -0.881
80 HA ARG 11 HA ARG 11 -3.507 -6.742 -0.076
81 HB2 ARG 11 HB2 ARG 11 -3.465 -8.747 -1.502
82 HB3 ARG 11 HB1 ARG 11 -2.919 -9.704 -0.136
83 HG2 ARG 11 HG2 ARG 11 -5.030 -9.251 1.020
84 HG3 ARG 11 HG1 ARG 11 -5.578 -8.306 -0.370
85 HD2 ARG 11 HD2 ARG 11 -4.853 -11.233 -0.376
86 HD3 ARG 11 HD1 ARG 11 -6.486 -10.564 -0.451
87 HE ARG 11 HE ARG 11 -5.890 -9.580 -2.565
88 HH11 ARG 11 HH11 ARG 11 -4.020 -12.353 -1.424
89 HH12 ARG 11 HH12 ARG 11 -3.345 -12.777 -2.910
90 HH21 ARG 11 HH21 ARG 11 -5.019 -10.154 -4.733
91 HH22 ARG 11 HH22 ARG 11 -3.955 -11.469 -4.879
92 H ARG 12 HN ARG 12 -1.520 -9.128 1.642
93 HA ARG 12 HA ARG 12 -2.964 -9.191 4.071
94 HB2 ARG 12 HB2 ARG 12 0.031 -9.475 3.771
95 HB3 ARG 12 HB1 ARG 12 -0.935 -10.035 5.120
96 HG2 ARG 12 HG2 ARG 12 -1.999 -11.687 3.673
97 HG3 ARG 12 HG1 ARG 12 -1.037 -11.103 2.305
98 HD2 ARG 12 HD2 ARG 12 1.003 -11.566 3.694
99 HD3 ARG 12 HD1 ARG 12 -0.051 -12.369 4.845
100 HE ARG 12 HE ARG 12 -0.601 -13.617 2.511
101 HH11 ARG 12 HH11 ARG 12 2.392 -12.867 4.196
102 HH12 ARG 12 HH12 ARG 12 3.255 -14.254 3.707
103 HH21 ARG 12 HH21 ARG 12 0.546 -15.594 1.773
104 HH22 ARG 12 HH22 ARG 12 2.163 -15.840 2.270
105 H ALA 13 HN ALA 13 -0.279 -7.213 2.990
106 HA ALA 13 HA ALA 13 0.230 -5.751 5.314
107 HB1 ALA 13 HB1 ALA 13 1.769 -5.871 3.433
108 HB2 ALA 13 HB2 ALA 13 1.382 -4.192 3.844
109 HB3 ALA 13 HB3 ALA 13 0.632 -4.953 2.445
110 H LEU 14 HN LEU 14 -1.919 -5.091 2.598
111 HA LEU 14 HA LEU 14 -2.677 -2.534 3.561
112 HB2 LEU 14 HB2 LEU 14 -2.845 -3.374 1.174
113 HB3 LEU 14 HB1 LEU 14 -4.246 -4.295 1.679
114 HG LEU 14 HG LEU 14 -5.395 -2.189 2.278
115 HD11 LEU 14 HD11 LEU 14 -2.958 -0.886 1.071
116 HD12 LEU 14 HD12 LEU 14 -3.428 -0.836 2.771
117 HD13 LEU 14 HD13 LEU 14 -4.440 -0.058 1.553
118 HD21 LEU 14 HD21 LEU 14 -5.715 -3.178 0.081
119 HD22 LEU 14 HD22 LEU 14 -4.315 -2.298 -0.535
120 HD23 LEU 14 HD23 LEU 14 -5.756 -1.419 -0.015
121 H VAL 15 HN VAL 15 -3.829 -5.796 4.053
122 HA VAL 15 HA VAL 15 -6.186 -4.987 5.427
123 HB VAL 15 HB VAL 15 -4.806 -7.707 5.524
124 HG11 VAL 15 HG11 VAL 15 -6.300 -7.399 7.424
125 HG12 VAL 15 HG12 VAL 15 -6.961 -8.582 6.295
126 HG13 VAL 15 HG13 VAL 15 -7.612 -6.942 6.338
127 HG21 VAL 15 HG21 VAL 15 -7.135 -6.770 3.856
128 HG22 VAL 15 HG22 VAL 15 -6.513 -8.419 3.926
129 HG23 VAL 15 HG23 VAL 15 -5.509 -7.123 3.271
130 H GLU 16 HN GLU 16 -2.875 -5.232 6.314
131 HA GLU 16 HA GLU 16 -3.057 -5.613 9.088
132 HB2 GLU 16 HB2 GLU 16 -0.997 -4.027 7.514
133 HB3 GLU 16 HB1 GLU 16 -0.892 -4.322 9.234
134 HG2 GLU 16 HG2 GLU 16 -0.782 -6.727 8.824
135 HG3 GLU 16 HG1 GLU 16 -0.888 -6.435 7.089
136 H SER 17 HN SER 17 -3.646 -2.796 7.150
137 HA SER 17 HA SER 17 -4.089 -1.249 9.580
138 HB2 SER 17 HB2 SER 17 -2.620 -0.257 7.857
139 HB3 SER 17 HB1 SER 17 -3.962 -0.298 6.712
140 HG SER 17 HG SER 17 -5.081 1.121 8.025
141 H ALA 18 HN ALA 18 -5.775 -3.042 7.281
142 HA ALA 18 HA ALA 18 -8.155 -1.401 7.282
143 HB1 ALA 18 HB1 ALA 18 -7.476 -2.671 5.275
144 HB2 ALA 18 HB2 ALA 18 -9.109 -3.054 5.820
145 HB3 ALA 18 HB3 ALA 18 -7.786 -4.169 6.155
146 H GLY 19 HN GLY 19 -6.930 -4.198 8.936
147 HA2 GLY 19 HA2 GLY 19 -7.752 -5.154 10.877
148 HA3 GLY 19 HA1 GLY 19 -9.176 -4.114 10.762
149 H GLU 20 HN GLU 20 -10.983 -4.885 9.901
150 HA GLU 20 HA GLU 20 -10.902 -7.605 8.845
151 HB2 GLU 20 HB2 GLU 20 -13.154 -5.947 9.984
152 HB3 GLU 20 HB1 GLU 20 -13.445 -7.419 9.080
153 HG2 GLU 20 HG2 GLU 20 -13.577 -7.899 11.409
154 HG3 GLU 20 HG1 GLU 20 -12.132 -8.659 10.760
155 H THR 21 HN THR 21 -11.425 -7.994 6.768
156 HA THR 21 HA THR 21 -12.160 -5.660 5.201
157 HB THR 21 HB THR 21 -11.511 -7.111 3.214
158 HG1 THR 21 HG1 THR 21 -10.898 -9.055 3.530
159 HG21 THR 21 HG21 THR 21 -10.019 -5.394 4.091
160 HG22 THR 21 HG22 THR 21 -9.094 -6.802 3.566
161 HG23 THR 21 HG23 THR 21 -9.389 -6.532 5.283
162 H ASP 22 HN ASP 22 -14.299 -5.821 6.074
163 HA ASP 22 HA ASP 22 -15.893 -8.117 5.334
164 HB2 ASP 22 HB2 ASP 22 -17.738 -7.110 6.516
165 HB3 ASP 22 HB1 ASP 22 -16.303 -6.906 7.507
166 H GLY 23 HN GLY 23 -15.422 -4.816 4.313
167 HA2 GLY 23 HA2 GLY 23 -17.087 -5.426 1.953
168 HA3 GLY 23 HA1 GLY 23 -17.091 -3.841 2.725
169 H THR 24 HN THR 24 -14.428 -6.020 2.043
170 HA THR 24 HA THR 24 -13.239 -3.928 0.365
171 HB THR 24 HB THR 24 -11.667 -5.557 2.365
172 HG1 THR 24 HG1 THR 24 -12.752 -2.922 2.747
173 HG21 THR 24 HG21 THR 24 -10.422 -4.492 0.518
174 HG22 THR 24 HG22 THR 24 -10.010 -3.781 2.077
175 HG23 THR 24 HG23 THR 24 -11.098 -2.927 0.983
176 H ASP 25 HN ASP 25 -13.893 -5.347 -1.432
177 HA ASP 25 HA ASP 25 -12.815 -8.008 -1.589
178 HB2 ASP 25 HB2 ASP 25 -13.986 -6.209 -3.723
179 HB3 ASP 25 HB1 ASP 25 -13.279 -7.771 -4.106
180 H LEU 26 HN LEU 26 -10.780 -7.999 -1.219
181 HA LEU 26 HA LEU 26 -8.970 -6.384 -2.917
182 HB2 LEU 26 HB2 LEU 26 -9.201 -5.852 -0.465
183 HB3 LEU 26 HB1 LEU 26 -8.564 -7.441 -0.125
184 HG LEU 26 HG LEU 26 -6.479 -6.749 -1.344
185 HD11 LEU 26 HD11 LEU 26 -7.447 -4.925 -2.620
186 HD12 LEU 26 HD12 LEU 26 -6.114 -4.358 -1.617
187 HD13 LEU 26 HD13 LEU 26 -7.784 -4.047 -1.129
188 HD21 LEU 26 HD21 LEU 26 -7.309 -5.180 1.080
189 HD22 LEU 26 HD22 LEU 26 -5.642 -5.481 0.559
190 HD23 LEU 26 HD23 LEU 26 -6.679 -6.825 1.062
191 H SER 27 HN SER 27 -10.216 -9.286 -2.580
192 HA SER 27 HA SER 27 -8.036 -11.035 -2.054
193 HB2 SER 27 HB2 SER 27 -10.760 -11.717 -3.128
194 HB3 SER 27 HB1 SER 27 -9.650 -12.773 -2.251
195 HG SER 27 HG SER 27 -9.824 -11.074 -0.546
196 H GLY 28 HN GLY 28 -8.349 -9.372 -4.765
197 HA2 GLY 28 HA2 GLY 28 -7.136 -11.525 -6.319
198 HA3 GLY 28 HA1 GLY 28 -8.645 -10.892 -6.942
199 H ASP 29 HN ASP 29 -8.586 -9.209 -8.220
200 HA ASP 29 HA ASP 29 -5.946 -8.271 -9.068
201 HB2 ASP 29 HB2 ASP 29 -8.666 -8.077 -10.388
202 HB3 ASP 29 HB1 ASP 29 -7.168 -7.485 -11.090
203 H PHE 30 HN PHE 30 -6.339 -7.135 -6.862
204 HA PHE 30 HA PHE 30 -8.025 -4.820 -6.849
205 HB2 PHE 30 HB2 PHE 30 -7.136 -4.400 -4.632
206 HB3 PHE 30 HB1 PHE 30 -7.563 -6.094 -4.801
207 HD1 PHE 30 HD2 PHE 30 -5.692 -7.770 -5.179
208 HD2 PHE 30 HD1 PHE 30 -4.953 -3.753 -3.995
209 HE1 PHE 30 HE2 PHE 30 -3.440 -8.408 -4.428
210 HE2 PHE 30 HE1 PHE 30 -2.697 -4.390 -3.241
211 HZ PHE 30 HZ PHE 30 -1.961 -6.684 -3.376
212 H LEU 31 HN LEU 31 -5.178 -5.336 -8.329
213 HA LEU 31 HA LEU 31 -3.751 -2.936 -7.584
214 HB2 LEU 31 HB2 LEU 31 -3.265 -4.739 -9.958
215 HB3 LEU 31 HB1 LEU 31 -2.210 -3.481 -9.383
216 HG LEU 31 HG LEU 31 -1.212 -5.469 -8.773
217 HD11 LEU 31 HD11 LEU 31 -1.095 -3.874 -7.018
218 HD12 LEU 31 HD12 LEU 31 -1.186 -5.502 -6.344
219 HD13 LEU 31 HD13 LEU 31 -2.609 -4.462 -6.332
220 HD21 LEU 31 HD21 LEU 31 -2.281 -7.329 -7.642
221 HD22 LEU 31 HD22 LEU 31 -3.126 -6.933 -9.146
222 HD23 LEU 31 HD23 LEU 31 -3.808 -6.447 -7.593
223 H ASP 32 HN ASP 32 -6.167 -3.791 -9.837
224 HA ASP 32 HA ASP 32 -5.400 -1.727 -11.755
225 HB2 ASP 32 HB2 ASP 32 -5.954 -4.127 -12.369
226 HB3 ASP 32 HB1 ASP 32 -7.627 -3.738 -11.997
227 H LEU 33 HN LEU 33 -7.276 -1.847 -9.058
228 HA LEU 33 HA LEU 33 -9.261 -0.050 -10.201
229 HB2 LEU 33 HB2 LEU 33 -10.670 -0.652 -8.180
230 HB3 LEU 33 HB1 LEU 33 -10.470 -1.868 -9.414
231 HG LEU 33 HG LEU 33 -8.735 -2.953 -7.935
232 HD11 LEU 33 HD11 LEU 33 -8.183 -1.085 -6.498
233 HD12 LEU 33 HD12 LEU 33 -8.769 -2.455 -5.557
234 HD13 LEU 33 HD13 LEU 33 -9.826 -1.073 -5.854
235 HD21 LEU 33 HD21 LEU 33 -10.392 -3.985 -6.482
236 HD22 LEU 33 HD22 LEU 33 -10.974 -3.806 -8.139
237 HD23 LEU 33 HD23 LEU 33 -11.532 -2.702 -6.882
238 H ARG 34 HN ARG 34 -10.286 1.276 -8.133
239 HA ARG 34 HA ARG 34 -8.067 2.999 -7.323
240 HB2 ARG 34 HB2 ARG 34 -11.074 3.308 -7.184
241 HB3 ARG 34 HB1 ARG 34 -9.917 4.513 -6.647
242 HG2 ARG 34 HG2 ARG 34 -10.119 3.510 -9.467
243 HG3 ARG 34 HG1 ARG 34 -10.942 4.949 -8.857
244 HD2 ARG 34 HD2 ARG 34 -7.974 4.495 -8.783
245 HD3 ARG 34 HD1 ARG 34 -8.817 5.435 -10.011
246 HE ARG 34 HE ARG 34 -9.521 6.410 -7.488
247 HH11 ARG 34 HH11 ARG 34 -6.836 6.345 -9.747
248 HH12 ARG 34 HH12 ARG 34 -6.065 7.737 -9.128
249 HH21 ARG 34 HH21 ARG 34 -8.492 8.323 -6.600
250 HH22 ARG 34 HH22 ARG 34 -7.027 8.887 -7.248
251 H PHE 35 HN PHE 35 -8.072 3.704 -5.058
252 HA PHE 35 HA PHE 35 -8.564 1.560 -3.263
253 HB2 PHE 35 HB2 PHE 35 -7.903 4.466 -2.738
254 HB3 PHE 35 HB1 PHE 35 -7.972 3.224 -1.490
255 HD1 PHE 35 HD2 PHE 35 -6.338 1.319 -1.567
256 HD2 PHE 35 HD1 PHE 35 -6.032 4.729 -4.098
257 HE1 PHE 35 HE2 PHE 35 -4.002 0.763 -2.036
258 HE2 PHE 35 HE1 PHE 35 -3.685 4.169 -4.564
259 HZ PHE 35 HZ PHE 35 -2.666 2.156 -3.464
260 H GLU 36 HN GLU 36 -10.260 4.305 -4.355
261 HA GLU 36 HA GLU 36 -12.426 4.585 -2.705
262 HB2 GLU 36 HB2 GLU 36 -11.991 5.968 -4.644
263 HB3 GLU 36 HB1 GLU 36 -12.260 4.603 -5.713
264 HG2 GLU 36 HG2 GLU 36 -14.595 4.540 -5.046
265 HG3 GLU 36 HG1 GLU 36 -14.320 5.907 -3.962
266 H ASP 37 HN ASP 37 -11.839 2.098 -5.191
267 HA ASP 37 HA ASP 37 -14.416 0.937 -5.155
268 HB2 ASP 37 HB2 ASP 37 -11.754 -0.235 -6.000
269 HB3 ASP 37 HB1 ASP 37 -13.292 -1.059 -6.208
270 H ILE 38 HN ILE 38 -11.557 0.420 -3.246
271 HA ILE 38 HA ILE 38 -12.866 -1.812 -1.886
272 HB ILE 38 HB ILE 38 -10.676 -2.250 -0.788
273 HG12 ILE 38 HG12 ILE 38 -9.677 -0.064 -2.646
274 HG13 ILE 38 HG11 ILE 38 -9.745 0.007 -0.890
275 HG21 ILE 38 HG21 ILE 38 -10.659 -2.177 -3.783
276 HG22 ILE 38 HG22 ILE 38 -11.322 -3.458 -2.755
277 HG23 ILE 38 HG23 ILE 38 -9.577 -3.145 -2.771
278 HD11 ILE 38 HD11 ILE 38 -8.083 -1.750 -0.740
279 HD12 ILE 38 HD12 ILE 38 -7.488 -0.397 -1.702
280 HD13 ILE 38 HD13 ILE 38 -8.037 -1.872 -2.498
281 H GLY 39 HN GLY 39 -13.231 1.174 -1.602
282 HA2 GLY 39 HA2 GLY 39 -13.876 2.634 0.067
283 HA3 GLY 39 HA1 GLY 39 -14.089 1.212 1.071
284 H TYR 40 HN TYR 40 -11.107 2.416 -0.349
285 HA TYR 40 HA TYR 40 -9.997 2.655 2.358
286 HB2 TYR 40 HB2 TYR 40 -9.204 1.050 0.235
287 HB3 TYR 40 HB1 TYR 40 -8.094 2.412 0.174
288 HD1 TYR 40 HD1 TYR 40 -6.662 2.911 2.141
289 HD2 TYR 40 HD2 TYR 40 -9.093 -0.551 1.917
290 HE1 TYR 40 HE1 TYR 40 -5.365 1.906 3.962
291 HE2 TYR 40 HE2 TYR 40 -7.833 -1.584 3.734
292 HH TYR 40 HH TYR 40 -5.545 -1.353 4.790
293 H ASP 41 HN ASP 41 -9.123 4.583 2.869
294 HA ASP 41 HA ASP 41 -8.958 6.562 0.730
295 HB2 ASP 41 HB2 ASP 41 -9.663 6.874 3.617
296 HB3 ASP 41 HB1 ASP 41 -8.916 8.219 2.764
297 H SER 42 HN SER 42 -7.458 8.311 1.114
298 HA SER 42 HA SER 42 -4.833 7.507 0.851
299 HB2 SER 42 HB2 SER 42 -4.552 10.055 1.206
300 HB3 SER 42 HB1 SER 42 -5.553 9.499 -0.149
301 H LEU 43 HN LEU 43 -6.557 8.896 3.492
302 HA LEU 43 HA LEU 43 -4.545 9.284 5.362
303 HB2 LEU 43 HB2 LEU 43 -7.428 8.563 5.786
304 HB3 LEU 43 HB1 LEU 43 -6.359 9.164 7.032
305 HG LEU 43 HG LEU 43 -7.198 10.674 4.558
306 HD11 LEU 43 HD11 LEU 43 -9.001 10.438 6.167
307 HD12 LEU 43 HD12 LEU 43 -8.413 12.100 6.108
308 HD13 LEU 43 HD13 LEU 43 -7.953 11.051 7.449
309 HD21 LEU 43 HD21 LEU 43 -4.941 11.263 5.251
310 HD22 LEU 43 HD22 LEU 43 -5.501 11.531 6.901
311 HD23 LEU 43 HD23 LEU 43 -6.061 12.582 5.598
312 H ALA 44 HN ALA 44 -6.482 6.355 4.760
313 HA ALA 44 HA ALA 44 -5.250 4.916 6.918
314 HB1 ALA 44 HB1 ALA 44 -6.521 3.002 6.101
315 HB2 ALA 44 HB2 ALA 44 -6.957 3.905 4.649
316 HB3 ALA 44 HB3 ALA 44 -7.549 4.432 6.226
317 H LEU 45 HN LEU 45 -4.730 5.363 3.539
318 HA LEU 45 HA LEU 45 -2.929 3.253 3.101
319 HB2 LEU 45 HB2 LEU 45 -3.105 5.964 1.803
320 HB3 LEU 45 HB1 LEU 45 -2.067 4.671 1.233
321 HG LEU 45 HG LEU 45 -5.072 4.539 1.384
322 HD11 LEU 45 HD11 LEU 45 -3.230 4.861 -0.973
323 HD12 LEU 45 HD12 LEU 45 -4.302 6.101 -0.323
324 HD13 LEU 45 HD13 LEU 45 -4.976 4.644 -1.048
325 HD21 LEU 45 HD21 LEU 45 -4.788 2.469 0.117
326 HD22 LEU 45 HD22 LEU 45 -3.998 2.379 1.691
327 HD23 LEU 45 HD23 LEU 45 -3.037 2.638 0.236
328 H MET 46 HN MET 46 -2.511 6.488 4.351
329 HA MET 46 HA MET 46 0.305 6.476 4.604
330 HB2 MET 46 HB2 MET 46 -1.765 7.840 6.321
331 HB3 MET 46 HB1 MET 46 -0.040 8.116 6.455
332 HG2 MET 46 HG2 MET 46 -0.004 8.997 4.180
333 HG3 MET 46 HG1 MET 46 -1.735 8.680 4.051
334 HE1 MET 46 HE1 MET 46 -2.010 11.232 3.334
335 HE2 MET 46 HE2 MET 46 -0.289 11.519 3.592
336 HE3 MET 46 HE3 MET 46 -1.484 12.585 4.333
337 H GLU 47 HN GLU 47 -2.270 5.323 6.678
338 HA GLU 47 HA GLU 47 -0.711 4.681 8.931
339 HB2 GLU 47 HB2 GLU 47 -3.236 4.845 8.779
340 HB3 GLU 47 HB1 GLU 47 -3.211 3.265 8.012
341 HG2 GLU 47 HG2 GLU 47 -3.715 2.955 10.299
342 HG3 GLU 47 HG1 GLU 47 -2.063 2.388 10.034
343 H THR 48 HN THR 48 -1.818 2.821 6.175
344 HA THR 48 HA THR 48 -0.644 0.344 6.700
345 HB THR 48 HB THR 48 -1.018 1.661 3.983
346 HG1 THR 48 HG1 THR 48 -3.005 1.674 5.250
347 HG21 THR 48 HG21 THR 48 0.272 -0.447 3.922
348 HG22 THR 48 HG22 THR 48 -1.312 -0.659 3.186
349 HG23 THR 48 HG23 THR 48 -1.011 -1.259 4.812
350 H ALA 49 HN ALA 49 0.565 3.060 4.713
351 HA ALA 49 HA ALA 49 3.045 2.091 4.020
352 HB1 ALA 49 HB1 ALA 49 2.020 4.095 3.054
353 HB2 ALA 49 HB2 ALA 49 3.669 4.402 3.595
354 HB3 ALA 49 HB3 ALA 49 2.304 4.959 4.564
355 H ALA 50 HN ALA 50 2.254 4.146 6.833
356 HA ALA 50 HA ALA 50 4.822 4.341 7.908
357 HB1 ALA 50 HB1 ALA 50 2.212 4.307 9.409
358 HB2 ALA 50 HB2 ALA 50 2.932 5.719 8.630
359 HB3 ALA 50 HB3 ALA 50 3.744 4.951 9.996
360 H ARG 51 HN ARG 51 2.418 1.841 8.269
361 HA ARG 51 HA ARG 51 3.803 0.455 10.337
362 HB2 ARG 51 HB2 ARG 51 1.391 0.229 10.033
363 HB3 ARG 51 HB1 ARG 51 1.651 -0.481 8.445
364 HG2 ARG 51 HG2 ARG 51 2.735 -2.386 9.435
365 HG3 ARG 51 HG1 ARG 51 2.592 -1.662 11.039
366 HD2 ARG 51 HD2 ARG 51 0.160 -1.699 10.829
367 HD3 ARG 51 HD1 ARG 51 0.336 -2.423 9.224
368 HE ARG 51 HE ARG 51 1.309 -4.324 10.230
369 HH11 ARG 51 HH11 ARG 51 -0.688 -2.227 12.271
370 HH12 ARG 51 HH12 ARG 51 -0.823 -3.322 13.562
371 HH21 ARG 51 HH21 ARG 51 1.155 -5.864 12.013
372 HH22 ARG 51 HH22 ARG 51 0.284 -5.443 13.425
373 H LEU 52 HN LEU 52 3.505 0.116 6.850
374 HA LEU 52 HA LEU 52 5.171 -2.142 6.686
375 HB2 LEU 52 HB2 LEU 52 4.379 -0.149 4.580
376 HB3 LEU 52 HB1 LEU 52 5.274 -1.624 4.250
377 HG LEU 52 HG LEU 52 2.498 -1.472 5.416
378 HD11 LEU 52 HD11 LEU 52 2.559 -0.896 3.062
379 HD12 LEU 52 HD12 LEU 52 1.791 -2.464 3.315
380 HD13 LEU 52 HD13 LEU 52 3.448 -2.378 2.713
381 HD21 LEU 52 HD21 LEU 52 3.751 -3.364 6.305
382 HD22 LEU 52 HD22 LEU 52 4.182 -3.860 4.670
383 HD23 LEU 52 HD23 LEU 52 2.498 -3.912 5.190
384 H GLU 53 HN GLU 53 5.880 1.274 6.745
385 HA GLU 53 HA GLU 53 8.557 1.172 5.989
386 HB2 GLU 53 HB2 GLU 53 7.240 2.857 8.126
387 HB3 GLU 53 HB1 GLU 53 8.885 3.097 7.571
388 HG2 GLU 53 HG2 GLU 53 8.041 3.606 5.339
389 HG3 GLU 53 HG1 GLU 53 6.389 3.383 5.926
390 H SER 54 HN SER 54 7.003 0.675 9.082
391 HA SER 54 HA SER 54 9.301 0.125 10.610
392 HB2 SER 54 HB2 SER 54 7.099 0.838 11.528
393 HB3 SER 54 HB1 SER 54 6.414 -0.706 11.040
394 HG SER 54 HG SER 54 8.499 -0.255 12.893
395 H ARG 55 HN ARG 55 6.970 -1.930 8.944
396 HA ARG 55 HA ARG 55 8.025 -4.383 9.812
397 HB2 ARG 55 HB2 ARG 55 5.728 -4.194 9.083
398 HB3 ARG 55 HB1 ARG 55 6.241 -3.738 7.466
399 HG2 ARG 55 HG2 ARG 55 7.202 -5.947 7.141
400 HG3 ARG 55 HG1 ARG 55 6.728 -6.398 8.778
401 HD2 ARG 55 HD2 ARG 55 4.413 -6.284 8.224
402 HD3 ARG 55 HD1 ARG 55 4.758 -5.518 6.669
403 HE ARG 55 HE ARG 55 5.909 -8.135 7.160
404 HH11 ARG 55 HH11 ARG 55 3.032 -6.551 5.801
405 HH12 ARG 55 HH12 ARG 55 3.011 -7.522 4.395
406 HH21 ARG 55 HH21 ARG 55 5.760 -9.547 5.306
407 HH22 ARG 55 HH22 ARG 55 4.578 -9.264 4.111
408 H TYR 56 HN TYR 56 8.538 -2.633 6.725
409 HA TYR 56 HA TYR 56 10.423 -4.718 5.949
410 HB2 TYR 56 HB2 TYR 56 8.914 -2.665 4.424
411 HB3 TYR 56 HB1 TYR 56 10.392 -3.329 3.736
412 HD1 TYR 56 HD1 TYR 56 6.992 -4.230 4.956
413 HD2 TYR 56 HD2 TYR 56 10.452 -5.462 2.829
414 HE1 TYR 56 HE1 TYR 56 5.791 -6.222 4.140
415 HE2 TYR 56 HE2 TYR 56 9.274 -7.433 2.018
416 HH TYR 56 HH TYR 56 5.877 -7.869 2.396
417 H GLY 57 HN GLY 57 10.603 -1.670 7.339
418 HA2 GLY 57 HA2 GLY 57 12.504 -0.505 7.936
419 HA3 GLY 57 HA1 GLY 57 13.461 -1.645 6.996
420 H VAL 58 HN VAL 58 10.744 0.375 5.984
421 HA VAL 58 HA VAL 58 12.582 1.605 4.090
422 HB VAL 58 HB VAL 58 10.785 1.884 2.431
423 HG11 VAL 58 HG11 VAL 58 11.075 -0.928 3.381
424 HG12 VAL 58 HG12 VAL 58 12.202 -0.076 2.316
425 HG13 VAL 58 HG13 VAL 58 10.558 -0.449 1.765
426 HG21 VAL 58 HG21 VAL 58 9.096 0.211 4.281
427 HG22 VAL 58 HG22 VAL 58 8.658 0.735 2.656
428 HG23 VAL 58 HG23 VAL 58 8.848 1.933 3.940
429 H SER 59 HN SER 59 11.523 3.673 3.120
430 HA SER 59 HA SER 59 10.531 5.307 5.351
431 HB2 SER 59 HB2 SER 59 12.440 6.094 3.135
432 HB3 SER 59 HB1 SER 59 11.928 7.100 4.494
433 HG SER 59 HG SER 59 13.123 4.605 4.931
434 H ILE 60 HN ILE 60 8.506 5.969 4.837
435 HA ILE 60 HA ILE 60 7.950 6.673 2.045
436 HB ILE 60 HB ILE 60 6.025 5.161 3.850
437 HG12 ILE 60 HG12 ILE 60 7.397 4.246 1.299
438 HG13 ILE 60 HG11 ILE 60 7.837 3.730 2.920
439 HG21 ILE 60 HG21 ILE 60 5.701 6.112 0.999
440 HG22 ILE 60 HG22 ILE 60 4.878 6.764 2.416
441 HG23 ILE 60 HG23 ILE 60 4.546 5.116 1.886
442 HD11 ILE 60 HD11 ILE 60 5.206 3.204 1.553
443 HD12 ILE 60 HD12 ILE 60 5.643 2.683 3.179
444 HD13 ILE 60 HD13 ILE 60 6.512 2.044 1.783
445 HA PRO 61 HA PRO 61 6.766 10.383 4.332
446 HB2 PRO 61 HB2 PRO 61 6.249 11.299 1.557
447 HB3 PRO 61 HB1 PRO 61 7.239 12.050 2.816
448 HG2 PRO 61 HG2 PRO 61 8.370 10.846 0.727
449 HG3 PRO 61 HG1 PRO 61 9.075 10.719 2.350
450 HD2 PRO 61 HD2 PRO 61 7.417 8.729 0.846
451 HD3 PRO 61 HD1 PRO 61 8.866 8.464 1.839
452 H ASP 62 HN ASP 62 4.817 11.040 4.909
453 HA ASP 62 HA ASP 62 2.580 9.459 4.632
454 HB2 ASP 62 HB2 ASP 62 2.708 12.377 5.390
455 HB3 ASP 62 HB1 ASP 62 1.309 11.338 5.620
456 H ASP 63 HN ASP 63 3.275 12.517 2.987
457 HA ASP 63 HA ASP 63 0.772 12.780 1.751
458 HB2 ASP 63 HB2 ASP 63 1.641 14.556 0.440
459 HB3 ASP 63 HB1 ASP 63 2.545 14.608 1.939
460 H VAL 64 HN VAL 64 3.540 10.971 0.796
461 HA VAL 64 HA VAL 64 2.931 10.499 -1.933
462 HB VAL 64 HB VAL 64 4.400 8.738 0.013
463 HG11 VAL 64 HG11 VAL 64 5.546 7.874 -2.013
464 HG12 VAL 64 HG12 VAL 64 4.519 8.900 -3.014
465 HG13 VAL 64 HG13 VAL 64 3.808 7.584 -2.077
466 HG21 VAL 64 HG21 VAL 64 5.426 10.908 -1.796
467 HG22 VAL 64 HG22 VAL 64 6.430 9.823 -0.832
468 HG23 VAL 64 HG23 VAL 64 5.338 10.958 -0.037
469 H ALA 65 HN ALA 65 2.089 8.815 1.036
470 HA ALA 65 HA ALA 65 0.862 6.585 -0.185
471 HB1 ALA 65 HB1 ALA 65 -0.078 6.129 2.016
472 HB2 ALA 65 HB2 ALA 65 0.373 7.747 2.553
473 HB3 ALA 65 HB3 ALA 65 1.623 6.575 2.143
474 H GLY 66 HN GLY 66 -0.163 9.809 0.267
475 HA2 GLY 66 HA2 GLY 66 -2.955 9.089 -0.292
476 HA3 GLY 66 HA1 GLY 66 -2.395 10.663 0.265
477 H ARG 67 HN ARG 67 -0.420 9.292 -2.098
478 HA ARG 67 HA ARG 67 -1.607 10.988 -4.203
479 HB2 ARG 67 HB2 ARG 67 1.206 10.379 -3.456
480 HB3 ARG 67 HB1 ARG 67 0.811 10.916 -5.080
481 HG2 ARG 67 HG2 ARG 67 0.032 13.002 -4.278
482 HG3 ARG 67 HG1 ARG 67 -0.025 12.419 -2.615
483 HD2 ARG 67 HD2 ARG 67 1.865 13.905 -3.026
484 HD3 ARG 67 HD1 ARG 67 2.378 12.303 -2.529
485 HE ARG 67 HE ARG 67 2.363 12.372 -5.314
486 HH11 ARG 67 HH11 ARG 67 4.093 13.883 -2.600
487 HH12 ARG 67 HH12 ARG 67 5.510 14.163 -3.487
488 HH21 ARG 67 HH21 ARG 67 4.330 12.711 -6.521
489 HH22 ARG 67 HH22 ARG 67 5.653 13.499 -5.784
490 H VAL 68 HN VAL 68 -0.989 7.847 -3.316
491 HA VAL 68 HA VAL 68 -0.281 6.861 -5.904
492 HB VAL 68 HB VAL 68 -0.611 4.578 -4.863
493 HG11 VAL 68 HG11 VAL 68 1.181 6.494 -3.377
494 HG12 VAL 68 HG12 VAL 68 1.565 5.655 -4.879
495 HG13 VAL 68 HG13 VAL 68 1.343 4.737 -3.390
496 HG21 VAL 68 HG21 VAL 68 -0.892 4.427 -2.428
497 HG22 VAL 68 HG22 VAL 68 -2.297 5.185 -3.178
498 HG23 VAL 68 HG23 VAL 68 -1.104 6.177 -2.339
499 H ASP 69 HN ASP 69 -1.586 6.737 -7.473
500 HA ASP 69 HA ASP 69 -4.391 7.055 -7.265
501 HB2 ASP 69 HB2 ASP 69 -2.580 6.361 -9.541
502 HB3 ASP 69 HB1 ASP 69 -4.314 6.165 -9.738
503 H THR 70 HN THR 70 -2.574 4.159 -8.198
504 HA THR 70 HA THR 70 -4.947 2.604 -7.457
505 HB THR 70 HB THR 70 -3.977 0.885 -9.037
506 HG1 THR 70 HG1 THR 70 -2.597 2.669 -10.541
507 HG21 THR 70 HG21 THR 70 -4.789 2.003 -11.081
508 HG22 THR 70 HG22 THR 70 -4.733 3.555 -10.242
509 HG23 THR 70 HG23 THR 70 -5.862 2.309 -9.714
510 HA PRO 71 HA PRO 71 -2.418 0.375 -4.480
511 HB2 PRO 71 HB2 PRO 71 -3.558 -2.102 -5.703
512 HB3 PRO 71 HB1 PRO 71 -3.514 -1.608 -4.002
513 HG2 PRO 71 HG2 PRO 71 -5.779 -1.414 -5.312
514 HG3 PRO 71 HG1 PRO 71 -5.256 -0.069 -4.274
515 HD2 PRO 71 HD2 PRO 71 -5.055 -0.340 -7.257
516 HD3 PRO 71 HD1 PRO 71 -5.619 1.047 -6.294
517 H ARG 72 HN ARG 72 -2.384 -0.360 -7.857
518 HA ARG 72 HA ARG 72 -0.065 -1.989 -7.939
519 HB2 ARG 72 HB2 ARG 72 -1.630 -1.800 -9.820
520 HB3 ARG 72 HB1 ARG 72 -1.222 -0.101 -9.997
521 HG2 ARG 72 HG2 ARG 72 1.065 -0.718 -10.608
522 HG3 ARG 72 HG1 ARG 72 0.647 -2.425 -10.428
523 HD2 ARG 72 HD2 ARG 72 -0.627 -0.486 -12.349
524 HD3 ARG 72 HD1 ARG 72 0.568 -1.716 -12.765
525 HE ARG 72 HE ARG 72 -1.115 -3.337 -11.887
526 HH11 ARG 72 HH11 ARG 72 -2.094 -0.240 -13.340
527 HH12 ARG 72 HH12 ARG 72 -3.592 -0.798 -13.904
528 HH21 ARG 72 HH21 ARG 72 -3.215 -4.124 -12.662
529 HH22 ARG 72 HH22 ARG 72 -4.240 -3.068 -13.531
530 H GLU 73 HN GLU 73 -0.670 1.466 -7.964
531 HA GLU 73 HA GLU 73 2.060 2.197 -8.372
532 HB2 GLU 73 HB2 GLU 73 0.202 3.590 -9.154
533 HB3 GLU 73 HB1 GLU 73 -0.339 3.812 -7.501
534 HG2 GLU 73 HG2 GLU 73 1.507 5.201 -6.986
535 HG3 GLU 73 HG1 GLU 73 2.356 4.719 -8.471
536 H LEU 74 HN LEU 74 -0.031 1.648 -5.670
537 HA LEU 74 HA LEU 74 1.724 2.650 -3.654
538 HB2 LEU 74 HB2 LEU 74 -0.771 2.170 -3.416
539 HB3 LEU 74 HB1 LEU 74 -0.387 0.471 -3.403
540 HG LEU 74 HG LEU 74 -0.946 1.446 -1.179
541 HD11 LEU 74 HD11 LEU 74 0.334 -0.601 -1.254
542 HD12 LEU 74 HD12 LEU 74 0.840 0.407 0.102
543 HD13 LEU 74 HD13 LEU 74 1.836 0.320 -1.355
544 HD21 LEU 74 HD21 LEU 74 0.055 3.629 -1.424
545 HD22 LEU 74 HD22 LEU 74 1.667 2.911 -1.479
546 HD23 LEU 74 HD23 LEU 74 0.702 2.808 -0.004
547 H LEU 75 HN LEU 75 1.164 -0.531 -5.109
548 HA LEU 75 HA LEU 75 3.113 -2.081 -3.858
549 HB2 LEU 75 HB2 LEU 75 1.386 -2.931 -5.414
550 HB3 LEU 75 HB1 LEU 75 2.172 -2.107 -6.738
551 HG LEU 75 HG LEU 75 4.151 -3.606 -6.404
552 HD11 LEU 75 HD11 LEU 75 3.769 -4.222 -4.092
553 HD12 LEU 75 HD12 LEU 75 3.838 -5.653 -5.118
554 HD13 LEU 75 HD13 LEU 75 2.282 -5.053 -4.541
555 HD21 LEU 75 HD21 LEU 75 3.098 -5.548 -7.457
556 HD22 LEU 75 HD22 LEU 75 2.495 -4.038 -8.138
557 HD23 LEU 75 HD23 LEU 75 1.511 -4.942 -6.988
558 H ASP 76 HN ASP 76 3.254 -0.246 -6.850
559 HA ASP 76 HA ASP 76 5.829 -0.368 -7.740
560 HB2 ASP 76 HB2 ASP 76 4.023 0.805 -8.868
561 HB3 ASP 76 HB1 ASP 76 3.967 2.006 -7.597
562 H LEU 77 HN LEU 77 4.535 1.973 -5.444
563 HA LEU 77 HA LEU 77 6.764 3.485 -4.857
564 HB2 LEU 77 HB2 LEU 77 4.559 4.117 -4.163
565 HB3 LEU 77 HB1 LEU 77 4.415 2.697 -3.152
566 HG LEU 77 HG LEU 77 6.198 3.603 -1.690
567 HD11 LEU 77 HD11 LEU 77 7.343 5.006 -3.295
568 HD12 LEU 77 HD12 LEU 77 6.833 5.945 -1.894
569 HD13 LEU 77 HD13 LEU 77 5.934 6.060 -3.406
570 HD21 LEU 77 HD21 LEU 77 4.797 5.320 -0.650
571 HD22 LEU 77 HD22 LEU 77 3.852 3.913 -1.139
572 HD23 LEU 77 HD23 LEU 77 3.805 5.387 -2.107
573 H ILE 78 HN ILE 78 5.537 0.694 -3.055
574 HA ILE 78 HA ILE 78 7.759 0.731 -1.287
575 HB ILE 78 HB ILE 78 5.662 -1.435 -1.660
576 HG12 ILE 78 HG12 ILE 78 5.875 0.895 0.258
577 HG13 ILE 78 HG11 ILE 78 4.706 0.714 -1.040
578 HG21 ILE 78 HG21 ILE 78 6.346 -2.191 0.585
579 HG22 ILE 78 HG22 ILE 78 7.615 -0.966 0.613
580 HG23 ILE 78 HG23 ILE 78 7.694 -2.288 -0.549
581 HD11 ILE 78 HD11 ILE 78 3.690 0.261 1.087
582 HD12 ILE 78 HD12 ILE 78 4.917 -0.943 1.447
583 HD13 ILE 78 HD13 ILE 78 3.757 -1.231 0.139
584 H ASN 79 HN ASN 79 6.935 -1.173 -4.143
585 HA ASN 79 HA ASN 79 9.033 -3.036 -4.007
586 HB2 ASN 79 HB2 ASN 79 7.442 -1.930 -6.292
587 HB3 ASN 79 HB1 ASN 79 8.862 -2.899 -6.638
588 HD21 ASN 79 HD21 ASN 79 6.796 -3.530 -3.851
589 HD22 ASN 79 HD22 ASN 79 6.160 -5.011 -4.484
590 H GLY 80 HN GLY 80 8.965 0.212 -5.339
591 HA2 GLY 80 HA2 GLY 80 11.596 0.205 -6.359
592 HA3 GLY 80 HA1 GLY 80 10.665 1.636 -5.926
593 H ALA 81 HN ALA 81 10.272 1.266 -3.258
594 HA ALA 81 HA ALA 81 12.689 2.213 -2.171
595 HB1 ALA 81 HB1 ALA 81 10.487 2.862 -1.305
596 HB2 ALA 81 HB2 ALA 81 11.523 2.225 -0.029
597 HB3 ALA 81 HB3 ALA 81 10.242 1.221 -0.709
598 H LEU 82 HN LEU 82 11.185 -0.941 -2.166
599 HA LEU 82 HA LEU 82 12.835 -2.139 -0.217
600 HB2 LEU 82 HB2 LEU 82 11.221 -3.380 -2.427
601 HB3 LEU 82 HB1 LEU 82 12.057 -4.300 -1.196
602 HG LEU 82 HG LEU 82 9.810 -2.352 -0.718
603 HD11 LEU 82 HD11 LEU 82 8.530 -4.346 -0.144
604 HD12 LEU 82 HD12 LEU 82 9.905 -5.358 -0.592
605 HD13 LEU 82 HD13 LEU 82 9.084 -4.389 -1.819
606 HD21 LEU 82 HD21 LEU 82 11.282 -4.175 1.168
607 HD22 LEU 82 HD22 LEU 82 9.866 -3.199 1.564
608 HD23 LEU 82 HD23 LEU 82 11.387 -2.417 1.132
609 H ALA 83 HN ALA 83 13.507 -1.251 -3.429
610 HA ALA 83 HA ALA 83 15.514 -3.265 -3.820
611 HB1 ALA 83 HB1 ALA 83 16.126 -2.001 -5.821
612 HB2 ALA 83 HB2 ALA 83 15.061 -0.686 -5.321
613 HB3 ALA 83 HB3 ALA 83 14.382 -2.257 -5.747
614 H GLU 84 HN GLU 84 15.365 0.045 -2.688
615 HA GLU 84 HA GLU 84 18.212 0.235 -2.284
616 HB2 GLU 84 HB2 GLU 84 15.888 1.952 -1.477
617 HB3 GLU 84 HB1 GLU 84 17.449 2.190 -0.723
618 HG2 GLU 84 HG2 GLU 84 17.114 3.760 -2.513
619 HG3 GLU 84 HG1 GLU 84 18.427 2.657 -2.902
620 H ALA 85 HN ALA 85 15.377 -0.301 -0.289
621 HA ALA 85 HA ALA 85 16.936 -0.725 2.108
622 HB1 ALA 85 HB1 ALA 85 14.789 0.442 2.192
623 HB2 ALA 85 HB2 ALA 85 14.753 -1.028 3.167
624 HB3 ALA 85 HB3 ALA 85 13.977 -0.999 1.583
625 H ALA 86 HN ALA 86 17.562 -2.524 0.064
626 HA ALA 86 HA ALA 86 16.299 -5.037 0.796
627 HB1 ALA 86 HB1 ALA 86 18.377 -4.409 -1.312
628 HB2 ALA 86 HB2 ALA 86 16.646 -4.595 -1.595
629 HB3 ALA 86 HB3 ALA 86 17.605 -5.977 -1.065
630 H28 SXV 87 H28A SXV 87 -5.320 14.041 0.588
631 H28A SXV 87 H28B SXV 87 -5.987 14.303 2.200
632 H30 SXV 87 H30C SXV 87 -2.880 14.068 4.063
633 H30A SXV 87 H30A SXV 87 -4.042 12.771 3.780
634 H30B SXV 87 H30B SXV 87 -4.609 14.403 4.136
635 H31 SXV 87 H31C SXV 87 -2.839 13.549 0.353
636 H31A SXV 87 H31A SXV 87 -2.966 12.276 1.570
637 H31B SXV 87 H31B SXV 87 -1.801 13.585 1.778
638 H32 SXV 87 H32A SXV 87 -4.212 16.253 2.616
639 HO33 SXV 87 H33A SXV 87 -3.377 15.603 -0.033
640 HN36 SXV 87 H36A SXV 87 -2.230 17.276 0.732
641 H37 SXV 87 H37B SXV 87 0.398 16.770 1.884
642 H37A SXV 87 H37A SXV 87 -0.254 18.374 2.196
643 H38 SXV 87 H38B SXV 87 -0.382 18.793 -0.204
644 H38A SXV 87 H38A SXV 87 0.130 17.128 -0.517
645 HN41 SXV 87 H41A SXV 87 1.567 18.355 -1.855
646 H42 SXV 87 H42B SXV 87 4.182 18.717 -0.595
647 H42A SXV 87 H42A SXV 87 3.518 19.961 -1.674
648 H43 SXV 87 H43B SXV 87 4.125 17.109 -2.431
649 H43A SXV 87 H43A SXV 87 3.226 18.268 -3.416
650 H1 SXV 87 H1B SXV 87 7.653 18.970 -2.319
651 H1A SXV 87 H1A SXV 87 6.341 19.024 -1.130
652 H2 SXV 87 H2A SXV 87 6.021 16.660 -1.188
653 H2A SXV 87 H2B SXV 87 7.692 17.053 -0.865
654 H4 SXV 87 H4C SXV 87 9.307 16.026 -3.676
655 H4A SXV 87 H4A SXV 87 8.738 17.678 -3.416
656 H4B SXV 87 H4B SXV 87 8.044 16.700 -4.715
Start of MODEL 14
1 H1 MET 1 HT1 MET 1 18.359 -11.863 -4.925
2 H2 MET 1 HT2 MET 1 19.024 -10.691 -5.944
3 H3 MET 1 HT3 MET 1 18.329 -12.108 -6.607
4 HA MET 1 HA MET 1 16.914 -10.183 -6.888
5 HB2 MET 1 HB2 MET 1 14.865 -11.097 -5.969
6 HB3 MET 1 HB1 MET 1 15.864 -12.428 -6.533
7 HG2 MET 1 HG2 MET 1 16.498 -12.983 -4.281
8 HG3 MET 1 HG1 MET 1 15.703 -11.548 -3.653
9 HE1 MET 1 HE1 MET 1 14.325 -13.891 -6.484
10 HE2 MET 1 HE2 MET 1 13.414 -15.078 -5.548
11 HE3 MET 1 HE3 MET 1 15.172 -15.016 -5.422
12 H ALA 2 HN ALA 2 15.375 -8.784 -5.754
13 HA ALA 2 HA ALA 2 16.472 -7.721 -3.261
14 HB1 ALA 2 HB1 ALA 2 16.045 -6.128 -5.078
15 HB2 ALA 2 HB2 ALA 2 14.942 -5.830 -3.734
16 HB3 ALA 2 HB3 ALA 2 14.369 -6.672 -5.177
17 H THR 3 HN THR 3 14.866 -7.302 -1.515
18 HA THR 3 HA THR 3 12.928 -9.451 -1.415
19 HB THR 3 HB THR 3 14.211 -9.045 0.635
20 HG1 THR 3 HG1 THR 3 12.083 -9.692 0.890
21 HG21 THR 3 HG21 THR 3 13.047 -6.248 0.685
22 HG22 THR 3 HG22 THR 3 14.733 -6.665 0.390
23 HG23 THR 3 HG23 THR 3 14.015 -6.975 1.970
24 H LEU 4 HN LEU 4 11.137 -9.111 -2.533
25 HA LEU 4 HA LEU 4 9.939 -6.429 -2.473
26 HB2 LEU 4 HB2 LEU 4 9.897 -8.418 -4.746
27 HB3 LEU 4 HB1 LEU 4 9.128 -6.846 -4.735
28 HG LEU 4 HG LEU 4 12.106 -7.341 -4.676
29 HD11 LEU 4 HD11 LEU 4 12.079 -6.428 -6.937
30 HD12 LEU 4 HD12 LEU 4 10.319 -6.337 -6.880
31 HD13 LEU 4 HD13 LEU 4 11.124 -7.906 -6.819
32 HD21 LEU 4 HD21 LEU 4 11.498 -5.294 -3.492
33 HD22 LEU 4 HD22 LEU 4 10.547 -4.760 -4.877
34 HD23 LEU 4 HD23 LEU 4 12.299 -4.921 -5.019
35 H LEU 5 HN LEU 5 8.003 -6.447 -1.571
36 HA LEU 5 HA LEU 5 6.738 -8.927 -0.984
37 HB2 LEU 5 HB2 LEU 5 5.021 -7.737 0.138
38 HB3 LEU 5 HB1 LEU 5 6.510 -6.907 0.503
39 HG LEU 5 HG LEU 5 4.535 -5.924 -1.568
40 HD11 LEU 5 HD11 LEU 5 3.461 -6.108 0.606
41 HD12 LEU 5 HD12 LEU 5 3.704 -4.415 0.153
42 HD13 LEU 5 HD13 LEU 5 4.769 -5.178 1.335
43 HD21 LEU 5 HD21 LEU 5 5.610 -3.750 -1.098
44 HD22 LEU 5 HD22 LEU 5 6.709 -4.913 -1.809
45 HD23 LEU 5 HD23 LEU 5 6.787 -4.573 -0.073
46 H THR 6 HN THR 6 5.102 -9.911 -1.987
47 HA THR 6 HA THR 6 4.548 -8.995 -4.644
48 HB THR 6 HB THR 6 3.327 -11.210 -4.786
49 HG1 THR 6 HG1 THR 6 3.594 -12.640 -3.116
50 HG21 THR 6 HG21 THR 6 5.410 -12.524 -4.855
51 HG22 THR 6 HG22 THR 6 6.237 -11.251 -3.956
52 HG23 THR 6 HG23 THR 6 5.634 -10.933 -5.582
53 H THR 7 HN THR 7 1.981 -9.860 -5.157
54 HA THR 7 HA THR 7 0.497 -7.770 -3.999
55 HB THR 7 HB THR 7 -1.427 -8.923 -5.259
56 HG1 THR 7 HG1 THR 7 -0.925 -10.579 -6.509
57 HG21 THR 7 HG21 THR 7 1.041 -8.029 -6.769
58 HG22 THR 7 HG22 THR 7 -0.219 -6.971 -6.130
59 HG23 THR 7 HG23 THR 7 -0.595 -8.108 -7.425
60 H ASP 8 HN ASP 8 0.957 -11.083 -3.194
61 HA ASP 8 HA ASP 8 -1.380 -11.438 -1.595
62 HB2 ASP 8 HB2 ASP 8 1.319 -12.806 -1.353
63 HB3 ASP 8 HB1 ASP 8 -0.129 -13.288 -0.483
64 H ASP 9 HN ASP 9 1.808 -10.167 -1.045
65 HA ASP 9 HA ASP 9 1.330 -9.894 1.782
66 HB2 ASP 9 HB2 ASP 9 3.619 -10.364 0.750
67 HB3 ASP 9 HB1 ASP 9 3.620 -8.676 0.259
68 H LEU 10 HN LEU 10 1.280 -7.873 -1.076
69 HA LEU 10 HA LEU 10 0.850 -5.386 0.187
70 HB2 LEU 10 HB2 LEU 10 1.315 -5.619 -2.229
71 HB3 LEU 10 HB1 LEU 10 -0.239 -6.399 -2.451
72 HG LEU 10 HG LEU 10 -1.353 -4.290 -1.753
73 HD11 LEU 10 HD11 LEU 10 0.421 -3.330 -0.413
74 HD12 LEU 10 HD12 LEU 10 -0.062 -2.219 -1.696
75 HD13 LEU 10 HD13 LEU 10 1.430 -3.144 -1.847
76 HD21 LEU 10 HD21 LEU 10 -1.061 -4.812 -4.111
77 HD22 LEU 10 HD22 LEU 10 0.534 -4.051 -4.094
78 HD23 LEU 10 HD23 LEU 10 -0.912 -3.077 -3.833
79 H ARG 11 HN ARG 11 -1.291 -7.985 -0.762
80 HA ARG 11 HA ARG 11 -3.772 -6.947 -0.035
81 HB2 ARG 11 HB2 ARG 11 -3.385 -9.050 -1.282
82 HB3 ARG 11 HB1 ARG 11 -2.718 -9.777 0.165
83 HG2 ARG 11 HG2 ARG 11 -4.908 -9.617 1.241
84 HG3 ARG 11 HG1 ARG 11 -5.568 -8.900 -0.239
85 HD2 ARG 11 HD2 ARG 11 -4.927 -10.914 -1.487
86 HD3 ARG 11 HD1 ARG 11 -4.291 -11.624 -0.005
87 HE ARG 11 HE ARG 11 -6.894 -10.986 0.539
88 HH11 ARG 11 HH11 ARG 11 -5.255 -13.127 -1.813
89 HH12 ARG 11 HH12 ARG 11 -6.582 -14.191 -1.928
90 HH21 ARG 11 HH21 ARG 11 -8.693 -12.462 0.303
91 HH22 ARG 11 HH22 ARG 11 -8.562 -13.827 -0.657
92 H ARG 12 HN ARG 12 -1.377 -8.758 1.833
93 HA ARG 12 HA ARG 12 -2.624 -8.830 4.334
94 HB2 ARG 12 HB2 ARG 12 0.334 -8.597 3.756
95 HB3 ARG 12 HB1 ARG 12 -0.358 -9.043 5.304
96 HG2 ARG 12 HG2 ARG 12 -1.235 -11.089 4.353
97 HG3 ARG 12 HG1 ARG 12 -0.652 -10.614 2.754
98 HD2 ARG 12 HD2 ARG 12 1.652 -10.581 3.627
99 HD3 ARG 12 HD1 ARG 12 1.045 -11.108 5.192
100 HE ARG 12 HE ARG 12 0.151 -13.071 3.742
101 HH11 ARG 12 HH11 ARG 12 3.310 -11.437 3.334
102 HH12 ARG 12 HH12 ARG 12 4.128 -12.843 2.853
103 HH21 ARG 12 HH21 ARG 12 1.310 -15.018 3.005
104 HH22 ARG 12 HH22 ARG 12 2.982 -14.936 2.731
105 H ALA 13 HN ALA 13 -0.562 -6.330 2.915
106 HA ALA 13 HA ALA 13 -0.289 -4.687 5.163
107 HB1 ALA 13 HB1 ALA 13 1.066 -4.459 3.135
108 HB2 ALA 13 HB2 ALA 13 0.349 -2.933 3.649
109 HB3 ALA 13 HB3 ALA 13 -0.341 -3.811 2.281
110 H LEU 14 HN LEU 14 -2.797 -4.749 2.700
111 HA LEU 14 HA LEU 14 -4.206 -2.524 3.719
112 HB2 LEU 14 HB2 LEU 14 -4.880 -4.746 1.844
113 HB3 LEU 14 HB1 LEU 14 -6.208 -3.841 2.537
114 HG LEU 14 HG LEU 14 -5.323 -1.770 1.562
115 HD11 LEU 14 HD11 LEU 14 -2.960 -2.273 1.526
116 HD12 LEU 14 HD12 LEU 14 -3.543 -1.779 -0.059
117 HD13 LEU 14 HD13 LEU 14 -3.218 -3.488 0.268
118 HD21 LEU 14 HD21 LEU 14 -5.794 -2.283 -0.784
119 HD22 LEU 14 HD22 LEU 14 -6.947 -3.037 0.314
120 HD23 LEU 14 HD23 LEU 14 -5.668 -4.006 -0.421
121 H VAL 15 HN VAL 15 -4.343 -5.948 4.391
122 HA VAL 15 HA VAL 15 -6.533 -5.966 6.172
123 HB VAL 15 HB VAL 15 -4.092 -7.761 6.322
124 HG11 VAL 15 HG11 VAL 15 -5.623 -9.419 7.280
125 HG12 VAL 15 HG12 VAL 15 -6.930 -8.236 7.223
126 HG13 VAL 15 HG13 VAL 15 -5.536 -7.958 8.266
127 HG21 VAL 15 HG21 VAL 15 -5.308 -9.303 4.863
128 HG22 VAL 15 HG22 VAL 15 -4.963 -7.767 4.068
129 HG23 VAL 15 HG23 VAL 15 -6.585 -8.102 4.674
130 H GLU 16 HN GLU 16 -3.150 -5.230 6.600
131 HA GLU 16 HA GLU 16 -2.971 -5.145 9.391
132 HB2 GLU 16 HB2 GLU 16 -1.510 -3.446 7.388
133 HB3 GLU 16 HB1 GLU 16 -1.064 -3.648 9.075
134 HG2 GLU 16 HG2 GLU 16 -1.079 -5.765 6.944
135 HG3 GLU 16 HG1 GLU 16 0.308 -4.973 7.698
136 H SER 17 HN SER 17 -4.273 -2.874 7.106
137 HA SER 17 HA SER 17 -4.488 -0.844 9.177
138 HB2 SER 17 HB2 SER 17 -3.561 -0.238 6.921
139 HB3 SER 17 HB1 SER 17 -5.144 -0.570 6.229
140 HG SER 17 HG SER 17 -4.759 1.179 8.375
141 H ALA 18 HN ALA 18 -6.496 -2.875 7.101
142 HA ALA 18 HA ALA 18 -8.936 -1.612 7.930
143 HB1 ALA 18 HB1 ALA 18 -10.059 -3.288 6.588
144 HB2 ALA 18 HB2 ALA 18 -8.557 -4.199 6.433
145 HB3 ALA 18 HB3 ALA 18 -8.700 -2.601 5.698
146 H GLY 19 HN GLY 19 -7.188 -4.545 8.864
147 HA2 GLY 19 HA2 GLY 19 -7.361 -5.565 10.963
148 HA3 GLY 19 HA1 GLY 19 -8.927 -4.788 11.201
149 H GLU 20 HN GLU 20 -9.727 -5.621 8.493
150 HA GLU 20 HA GLU 20 -10.080 -8.503 8.797
151 HB2 GLU 20 HB2 GLU 20 -11.998 -7.421 9.903
152 HB3 GLU 20 HB1 GLU 20 -12.280 -6.446 8.472
153 HG2 GLU 20 HG2 GLU 20 -12.585 -8.674 7.250
154 HG3 GLU 20 HG1 GLU 20 -12.715 -9.379 8.862
155 H THR 21 HN THR 21 -10.380 -9.463 6.777
156 HA THR 21 HA THR 21 -10.727 -7.703 4.521
157 HB THR 21 HB THR 21 -8.354 -8.129 4.636
158 HG1 THR 21 HG1 THR 21 -9.521 -8.100 2.584
159 HG21 THR 21 HG21 THR 21 -7.373 -10.391 4.262
160 HG22 THR 21 HG22 THR 21 -8.993 -11.081 4.387
161 HG23 THR 21 HG23 THR 21 -8.267 -10.281 5.781
162 H ASP 22 HN ASP 22 -12.785 -8.393 4.935
163 HA ASP 22 HA ASP 22 -13.389 -10.921 3.550
164 HB2 ASP 22 HB2 ASP 22 -13.682 -11.305 5.986
165 HB3 ASP 22 HB1 ASP 22 -14.893 -10.023 6.016
166 H GLY 23 HN GLY 23 -14.935 -8.034 4.915
167 HA2 GLY 23 HA2 GLY 23 -16.866 -7.860 2.810
168 HA3 GLY 23 HA1 GLY 23 -16.467 -6.600 3.989
169 H THR 24 HN THR 24 -13.733 -6.613 3.538
170 HA THR 24 HA THR 24 -13.475 -5.622 0.803
171 HB THR 24 HB THR 24 -11.918 -4.750 3.272
172 HG1 THR 24 HG1 THR 24 -13.829 -3.269 1.791
173 HG21 THR 24 HG21 THR 24 -10.647 -4.481 1.184
174 HG22 THR 24 HG22 THR 24 -11.162 -2.904 1.800
175 HG23 THR 24 HG23 THR 24 -12.018 -3.644 0.452
176 H ASP 25 HN ASP 25 -13.109 -7.977 0.424
177 HA ASP 25 HA ASP 25 -10.471 -8.860 1.284
178 HB2 ASP 25 HB2 ASP 25 -12.255 -10.515 1.570
179 HB3 ASP 25 HB1 ASP 25 -12.662 -10.396 -0.142
180 H LEU 26 HN LEU 26 -8.912 -9.392 -0.175
181 HA LEU 26 HA LEU 26 -9.211 -7.867 -2.666
182 HB2 LEU 26 HB2 LEU 26 -6.700 -8.511 -1.119
183 HB3 LEU 26 HB1 LEU 26 -6.722 -7.695 -2.662
184 HG LEU 26 HG LEU 26 -6.383 -6.023 -1.092
185 HD11 LEU 26 HD11 LEU 26 -7.967 -5.343 -2.724
186 HD12 LEU 26 HD12 LEU 26 -8.349 -4.588 -1.175
187 HD13 LEU 26 HD13 LEU 26 -9.300 -5.958 -1.748
188 HD21 LEU 26 HD21 LEU 26 -7.747 -5.650 0.923
189 HD22 LEU 26 HD22 LEU 26 -6.937 -7.217 0.954
190 HD23 LEU 26 HD23 LEU 26 -8.656 -7.120 0.565
191 H SER 27 HN SER 27 -9.972 -10.711 -2.398
192 HA SER 27 HA SER 27 -7.990 -12.148 -3.875
193 HB2 SER 27 HB2 SER 27 -9.630 -13.243 -2.323
194 HB3 SER 27 HB1 SER 27 -10.910 -12.842 -3.470
195 HG SER 27 HG SER 27 -10.269 -14.354 -4.759
196 H GLY 28 HN GLY 28 -7.558 -11.309 -5.826
197 HA2 GLY 28 HA2 GLY 28 -8.603 -11.789 -8.129
198 HA3 GLY 28 HA1 GLY 28 -9.746 -10.548 -7.599
199 H ASP 29 HN ASP 29 -9.011 -9.130 -9.283
200 HA ASP 29 HA ASP 29 -6.264 -8.227 -8.866
201 HB2 ASP 29 HB2 ASP 29 -6.898 -8.488 -11.244
202 HB3 ASP 29 HB1 ASP 29 -8.155 -7.263 -11.026
203 H PHE 30 HN PHE 30 -5.936 -6.843 -7.483
204 HA PHE 30 HA PHE 30 -7.939 -4.746 -7.060
205 HB2 PHE 30 HB2 PHE 30 -7.221 -4.615 -4.727
206 HB3 PHE 30 HB1 PHE 30 -7.768 -6.239 -5.109
207 HD1 PHE 30 HD2 PHE 30 -6.009 -8.035 -5.499
208 HD2 PHE 30 HD1 PHE 30 -5.084 -4.214 -3.865
209 HE1 PHE 30 HE2 PHE 30 -3.899 -8.927 -4.610
210 HE2 PHE 30 HE1 PHE 30 -2.975 -5.108 -2.975
211 HZ PHE 30 HZ PHE 30 -2.385 -7.464 -3.346
212 H LEU 31 HN LEU 31 -4.934 -5.443 -8.320
213 HA LEU 31 HA LEU 31 -3.303 -3.495 -7.294
214 HB2 LEU 31 HB2 LEU 31 -2.768 -5.633 -8.454
215 HB3 LEU 31 HB1 LEU 31 -3.275 -4.880 -9.951
216 HG LEU 31 HG LEU 31 -1.644 -3.196 -9.591
217 HD11 LEU 31 HD11 LEU 31 -0.661 -5.061 -7.402
218 HD12 LEU 31 HD12 LEU 31 -1.256 -3.415 -7.185
219 HD13 LEU 31 HD13 LEU 31 0.273 -3.696 -8.018
220 HD21 LEU 31 HD21 LEU 31 -0.617 -6.018 -9.846
221 HD22 LEU 31 HD22 LEU 31 0.301 -4.583 -10.315
222 HD23 LEU 31 HD23 LEU 31 -1.208 -4.974 -11.139
223 H ASP 32 HN ASP 32 -5.722 -3.485 -9.862
224 HA ASP 32 HA ASP 32 -4.909 -0.762 -10.639
225 HB2 ASP 32 HB2 ASP 32 -5.109 -2.384 -12.474
226 HB3 ASP 32 HB1 ASP 32 -6.765 -2.733 -12.009
227 H LEU 33 HN LEU 33 -6.919 -2.164 -8.485
228 HA LEU 33 HA LEU 33 -9.361 -0.797 -8.957
229 HB2 LEU 33 HB2 LEU 33 -8.317 -2.340 -6.627
230 HB3 LEU 33 HB1 LEU 33 -9.787 -1.401 -6.479
231 HG LEU 33 HG LEU 33 -9.360 -3.645 -8.460
232 HD11 LEU 33 HD11 LEU 33 -10.922 -4.876 -7.033
233 HD12 LEU 33 HD12 LEU 33 -10.972 -3.518 -5.909
234 HD13 LEU 33 HD13 LEU 33 -9.475 -4.424 -6.132
235 HD21 LEU 33 HD21 LEU 33 -10.902 -1.920 -9.246
236 HD22 LEU 33 HD22 LEU 33 -11.776 -2.020 -7.720
237 HD23 LEU 33 HD23 LEU 33 -11.776 -3.400 -8.824
238 H ARG 34 HN ARG 34 -9.929 1.118 -8.566
239 HA ARG 34 HA ARG 34 -8.294 3.075 -7.350
240 HB2 ARG 34 HB2 ARG 34 -11.250 3.042 -7.987
241 HB3 ARG 34 HB1 ARG 34 -10.383 4.462 -7.423
242 HG2 ARG 34 HG2 ARG 34 -9.696 2.963 -9.942
243 HG3 ARG 34 HG1 ARG 34 -10.757 4.373 -9.884
244 HD2 ARG 34 HD2 ARG 34 -7.893 4.320 -8.939
245 HD3 ARG 34 HD1 ARG 34 -8.430 4.939 -10.505
246 HE ARG 34 HE ARG 34 -9.814 6.153 -8.311
247 HH11 ARG 34 HH11 ARG 34 -6.984 6.435 -10.394
248 HH12 ARG 34 HH12 ARG 34 -6.567 7.997 -9.841
249 HH21 ARG 34 HH21 ARG 34 -9.357 8.357 -7.662
250 HH22 ARG 34 HH22 ARG 34 -7.992 9.118 -8.315
251 H PHE 35 HN PHE 35 -8.025 3.501 -5.264
252 HA PHE 35 HA PHE 35 -9.004 1.948 -3.194
253 HB2 PHE 35 HB2 PHE 35 -7.976 4.779 -3.071
254 HB3 PHE 35 HB1 PHE 35 -8.212 3.735 -1.674
255 HD1 PHE 35 HD2 PHE 35 -6.952 1.492 -1.701
256 HD2 PHE 35 HD1 PHE 35 -5.967 4.805 -4.169
257 HE1 PHE 35 HE2 PHE 35 -4.682 0.596 -1.988
258 HE2 PHE 35 HE1 PHE 35 -3.704 3.918 -4.465
259 HZ PHE 35 HZ PHE 35 -3.054 1.814 -3.374
260 H GLU 36 HN GLU 36 -10.222 4.907 -4.493
261 HA GLU 36 HA GLU 36 -12.132 5.605 -2.603
262 HB2 GLU 36 HB2 GLU 36 -11.376 7.047 -4.377
263 HB3 GLU 36 HB1 GLU 36 -12.063 5.977 -5.579
264 HG2 GLU 36 HG2 GLU 36 -14.305 6.489 -4.696
265 HG3 GLU 36 HG1 GLU 36 -13.561 7.647 -3.584
266 H ASP 37 HN ASP 37 -12.262 3.208 -5.196
267 HA ASP 37 HA ASP 37 -15.118 2.863 -4.953
268 HB2 ASP 37 HB2 ASP 37 -13.923 2.447 -7.114
269 HB3 ASP 37 HB1 ASP 37 -13.145 1.051 -6.371
270 H ILE 38 HN ILE 38 -12.206 1.276 -3.852
271 HA ILE 38 HA ILE 38 -13.767 -0.787 -2.583
272 HB ILE 38 HB ILE 38 -11.593 -1.747 -1.793
273 HG12 ILE 38 HG12 ILE 38 -10.389 0.413 -3.542
274 HG13 ILE 38 HG11 ILE 38 -10.307 0.389 -1.792
275 HG21 ILE 38 HG21 ILE 38 -12.660 -2.517 -3.813
276 HG22 ILE 38 HG22 ILE 38 -10.902 -2.501 -4.034
277 HG23 ILE 38 HG23 ILE 38 -11.903 -1.214 -4.728
278 HD11 ILE 38 HD11 ILE 38 -8.225 -0.370 -2.782
279 HD12 ILE 38 HD12 ILE 38 -9.085 -1.640 -3.656
280 HD13 ILE 38 HD13 ILE 38 -8.998 -1.685 -1.895
281 H GLY 39 HN GLY 39 -13.604 2.094 -1.785
282 HA2 GLY 39 HA2 GLY 39 -14.201 3.209 0.152
283 HA3 GLY 39 HA1 GLY 39 -14.307 1.645 0.934
284 H TYR 40 HN TYR 40 -11.390 2.897 -0.547
285 HA TYR 40 HA TYR 40 -10.170 2.956 2.113
286 HB2 TYR 40 HB2 TYR 40 -9.200 2.076 -0.509
287 HB3 TYR 40 HB1 TYR 40 -8.058 3.059 0.398
288 HD1 TYR 40 HD2 TYR 40 -10.198 0.032 0.671
289 HD2 TYR 40 HD1 TYR 40 -6.779 2.132 2.088
290 HE1 TYR 40 HE2 TYR 40 -9.560 -1.908 2.035
291 HE2 TYR 40 HE1 TYR 40 -6.139 0.223 3.446
292 HH TYR 40 HH TYR 40 -7.214 -1.741 4.459
293 H ASP 41 HN ASP 41 -9.433 4.696 2.921
294 HA ASP 41 HA ASP 41 -9.284 7.145 1.293
295 HB2 ASP 41 HB2 ASP 41 -9.347 6.729 4.284
296 HB3 ASP 41 HB1 ASP 41 -8.822 8.243 3.576
297 H SER 42 HN SER 42 -7.428 8.514 1.548
298 HA SER 42 HA SER 42 -5.027 7.061 1.367
299 HB2 SER 42 HB2 SER 42 -4.463 9.799 1.725
300 HB3 SER 42 HB1 SER 42 -4.482 8.878 0.218
301 H LEU 43 HN LEU 43 -6.647 8.726 3.893
302 HA LEU 43 HA LEU 43 -4.667 8.996 5.814
303 HB2 LEU 43 HB2 LEU 43 -7.505 8.063 6.263
304 HB3 LEU 43 HB1 LEU 43 -6.444 8.747 7.476
305 HG LEU 43 HG LEU 43 -7.537 10.208 5.074
306 HD11 LEU 43 HD11 LEU 43 -9.244 9.736 6.731
307 HD12 LEU 43 HD12 LEU 43 -8.849 11.455 6.710
308 HD13 LEU 43 HD13 LEU 43 -8.225 10.423 7.996
309 HD21 LEU 43 HD21 LEU 43 -6.582 12.206 6.120
310 HD22 LEU 43 HD22 LEU 43 -5.329 11.030 5.719
311 HD23 LEU 43 HD23 LEU 43 -5.874 11.205 7.389
312 H ALA 44 HN ALA 44 -6.675 6.146 5.090
313 HA ALA 44 HA ALA 44 -5.363 4.445 6.958
314 HB1 ALA 44 HB1 ALA 44 -6.625 2.645 5.894
315 HB2 ALA 44 HB2 ALA 44 -7.087 3.733 4.584
316 HB3 ALA 44 HB3 ALA 44 -7.664 4.031 6.225
317 H LEU 45 HN LEU 45 -4.964 5.222 3.591
318 HA LEU 45 HA LEU 45 -3.156 3.203 2.932
319 HB2 LEU 45 HB2 LEU 45 -3.440 5.984 1.821
320 HB3 LEU 45 HB1 LEU 45 -2.368 4.777 1.134
321 HG LEU 45 HG LEU 45 -5.365 4.521 1.360
322 HD11 LEU 45 HD11 LEU 45 -3.593 5.018 -1.024
323 HD12 LEU 45 HD12 LEU 45 -4.686 6.192 -0.295
324 HD13 LEU 45 HD13 LEU 45 -5.331 4.743 -1.068
325 HD21 LEU 45 HD21 LEU 45 -5.051 2.540 -0.018
326 HD22 LEU 45 HD22 LEU 45 -4.180 2.386 1.516
327 HD23 LEU 45 HD23 LEU 45 -3.309 2.787 0.031
328 H MET 46 HN MET 46 -2.662 6.337 4.451
329 HA MET 46 HA MET 46 0.164 6.303 4.469
330 HB2 MET 46 HB2 MET 46 -1.711 7.582 6.477
331 HB3 MET 46 HB1 MET 46 0.019 7.855 6.423
332 HG2 MET 46 HG2 MET 46 -0.254 8.846 4.157
333 HG3 MET 46 HG1 MET 46 -1.993 8.583 4.328
334 HE1 MET 46 HE1 MET 46 -2.366 9.246 7.471
335 HE2 MET 46 HE2 MET 46 -3.487 9.797 6.230
336 HE3 MET 46 HE3 MET 46 -2.824 10.948 7.390
337 H GLU 47 HN GLU 47 -2.232 4.896 6.577
338 HA GLU 47 HA GLU 47 -0.378 4.009 8.550
339 HB2 GLU 47 HB2 GLU 47 -2.833 4.282 8.953
340 HB3 GLU 47 HB1 GLU 47 -3.115 2.917 7.899
341 HG2 GLU 47 HG2 GLU 47 -1.867 1.448 9.376
342 HG3 GLU 47 HG1 GLU 47 -1.535 2.800 10.454
343 H THR 48 HN THR 48 -1.921 2.575 5.750
344 HA THR 48 HA THR 48 -0.940 -0.017 5.812
345 HB THR 48 HB THR 48 -1.351 1.770 3.385
346 HG1 THR 48 HG1 THR 48 -3.236 1.549 4.825
347 HG21 THR 48 HG21 THR 48 -1.782 -0.325 2.170
348 HG22 THR 48 HG22 THR 48 -1.430 -1.251 3.627
349 HG23 THR 48 HG23 THR 48 -0.153 -0.319 2.844
350 H ALA 49 HN ALA 49 0.496 2.868 4.269
351 HA ALA 49 HA ALA 49 2.906 1.728 3.440
352 HB1 ALA 49 HB1 ALA 49 3.741 4.022 3.293
353 HB2 ALA 49 HB2 ALA 49 2.382 4.585 4.266
354 HB3 ALA 49 HB3 ALA 49 2.097 3.912 2.661
355 H ALA 50 HN ALA 50 2.117 3.466 6.448
356 HA ALA 50 HA ALA 50 4.622 3.418 7.658
357 HB1 ALA 50 HB1 ALA 50 2.729 4.759 8.472
358 HB2 ALA 50 HB2 ALA 50 3.456 3.802 9.763
359 HB3 ALA 50 HB3 ALA 50 1.937 3.286 9.034
360 H ARG 51 HN ARG 51 2.075 1.000 7.696
361 HA ARG 51 HA ARG 51 3.168 -0.815 9.539
362 HB2 ARG 51 HB2 ARG 51 1.488 -1.361 7.075
363 HB3 ARG 51 HB1 ARG 51 1.879 -2.575 8.278
364 HG2 ARG 51 HG2 ARG 51 0.326 -0.052 8.832
365 HG3 ARG 51 HG1 ARG 51 -0.392 -1.633 8.515
366 HD2 ARG 51 HD2 ARG 51 0.750 -2.545 10.441
367 HD3 ARG 51 HD1 ARG 51 1.488 -0.975 10.778
368 HE ARG 51 HE ARG 51 -1.409 -1.014 10.673
369 HH11 ARG 51 HH11 ARG 51 1.404 -1.424 12.803
370 HH12 ARG 51 HH12 ARG 51 0.627 -0.912 14.202
371 HH21 ARG 51 HH21 ARG 51 -2.546 -0.345 12.650
372 HH22 ARG 51 HH22 ARG 51 -1.674 -0.246 14.111
373 H LEU 52 HN LEU 52 3.663 -0.454 6.083
374 HA LEU 52 HA LEU 52 5.367 -2.739 5.950
375 HB2 LEU 52 HB2 LEU 52 4.749 -0.643 3.889
376 HB3 LEU 52 HB1 LEU 52 5.693 -2.095 3.590
377 HG LEU 52 HG LEU 52 2.795 -2.025 4.431
378 HD11 LEU 52 HD11 LEU 52 4.053 -2.733 1.795
379 HD12 LEU 52 HD12 LEU 52 3.097 -1.292 2.150
380 HD13 LEU 52 HD13 LEU 52 2.345 -2.884 2.202
381 HD21 LEU 52 HD21 LEU 52 2.836 -4.438 4.024
382 HD22 LEU 52 HD22 LEU 52 3.944 -3.981 5.318
383 HD23 LEU 52 HD23 LEU 52 4.569 -4.357 3.712
384 H GLU 53 HN GLU 53 5.903 0.712 6.231
385 HA GLU 53 HA GLU 53 8.645 0.849 5.587
386 HB2 GLU 53 HB2 GLU 53 7.203 2.332 7.783
387 HB3 GLU 53 HB1 GLU 53 8.771 2.745 7.124
388 HG2 GLU 53 HG2 GLU 53 7.704 3.185 4.964
389 HG3 GLU 53 HG1 GLU 53 6.133 2.848 5.710
390 H SER 54 HN SER 54 7.151 0.381 8.737
391 HA SER 54 HA SER 54 9.576 0.022 10.136
392 HB2 SER 54 HB2 SER 54 7.406 0.833 11.097
393 HB3 SER 54 HB1 SER 54 6.766 -0.794 10.927
394 HG SER 54 HG SER 54 9.124 -0.250 12.371
395 H ARG 55 HN ARG 55 7.570 -2.058 8.328
396 HA ARG 55 HA ARG 55 8.513 -4.513 9.541
397 HB2 ARG 55 HB2 ARG 55 6.193 -4.240 8.857
398 HB3 ARG 55 HB1 ARG 55 6.698 -3.988 7.199
399 HG2 ARG 55 HG2 ARG 55 7.486 -6.272 7.076
400 HG3 ARG 55 HG1 ARG 55 7.046 -6.526 8.771
401 HD2 ARG 55 HD2 ARG 55 4.722 -6.069 8.261
402 HD3 ARG 55 HD1 ARG 55 5.137 -5.728 6.586
403 HE ARG 55 HE ARG 55 5.519 -8.370 7.819
404 HH11 ARG 55 HH11 ARG 55 4.206 -6.320 5.265
405 HH12 ARG 55 HH12 ARG 55 3.962 -7.602 4.166
406 HH21 ARG 55 HH21 ARG 55 5.045 -10.181 6.308
407 HH22 ARG 55 HH22 ARG 55 4.367 -9.754 4.784
408 H TYR 56 HN TYR 56 9.281 -2.556 6.753
409 HA TYR 56 HA TYR 56 11.032 -4.717 5.830
410 HB2 TYR 56 HB2 TYR 56 9.522 -2.694 4.225
411 HB3 TYR 56 HB1 TYR 56 10.883 -3.587 3.556
412 HD1 TYR 56 HD2 TYR 56 10.727 -6.039 3.249
413 HD2 TYR 56 HD1 TYR 56 7.424 -3.746 4.626
414 HE1 TYR 56 HE2 TYR 56 9.215 -7.894 2.704
415 HE2 TYR 56 HE1 TYR 56 5.907 -5.591 4.083
416 HH TYR 56 HH TYR 56 6.998 -8.744 3.232
417 H GLY 57 HN GLY 57 11.128 -1.634 7.134
418 HA2 GLY 57 HA2 GLY 57 13.018 -0.444 7.705
419 HA3 GLY 57 HA1 GLY 57 13.981 -1.557 6.737
420 H VAL 58 HN VAL 58 11.185 0.305 5.764
421 HA VAL 58 HA VAL 58 12.882 1.787 3.898
422 HB VAL 58 HB VAL 58 11.148 1.704 2.163
423 HG11 VAL 58 HG11 VAL 58 12.822 -0.092 2.209
424 HG12 VAL 58 HG12 VAL 58 11.251 -0.651 1.589
425 HG13 VAL 58 HG13 VAL 58 11.718 -0.996 3.261
426 HG21 VAL 58 HG21 VAL 58 9.618 -0.107 4.030
427 HG22 VAL 58 HG22 VAL 58 9.173 0.291 2.368
428 HG23 VAL 58 HG23 VAL 58 9.171 1.551 3.603
429 H SER 59 HN SER 59 11.419 3.735 2.949
430 HA SER 59 HA SER 59 9.757 4.766 5.065
431 HB2 SER 59 HB2 SER 59 12.158 6.210 3.929
432 HB3 SER 59 HB1 SER 59 10.933 6.946 4.960
433 HG SER 59 HG SER 59 11.508 5.005 6.363
434 H ILE 60 HN ILE 60 8.068 5.767 4.331
435 HA ILE 60 HA ILE 60 7.978 6.707 1.553
436 HB ILE 60 HB ILE 60 5.787 5.165 3.014
437 HG12 ILE 60 HG12 ILE 60 5.806 3.783 0.826
438 HG13 ILE 60 HG11 ILE 60 7.377 4.511 0.540
439 HG21 ILE 60 HG21 ILE 60 4.748 7.005 1.898
440 HG22 ILE 60 HG22 ILE 60 4.354 5.483 1.092
441 HG23 ILE 60 HG23 ILE 60 5.548 6.570 0.380
442 HD11 ILE 60 HD11 ILE 60 6.592 2.834 2.891
443 HD12 ILE 60 HD12 ILE 60 8.188 3.546 2.620
444 HD13 ILE 60 HD13 ILE 60 7.571 2.306 1.518
445 HA PRO 61 HA PRO 61 6.841 10.373 3.886
446 HB2 PRO 61 HB2 PRO 61 6.108 11.370 1.186
447 HB3 PRO 61 HB1 PRO 61 7.214 12.071 2.373
448 HG2 PRO 61 HG2 PRO 61 8.143 10.898 0.164
449 HG3 PRO 61 HG1 PRO 61 8.984 10.720 1.716
450 HD2 PRO 61 HD2 PRO 61 7.174 8.799 0.305
451 HD3 PRO 61 HD1 PRO 61 8.693 8.486 1.176
452 H ASP 62 HN ASP 62 4.963 10.879 4.759
453 HA ASP 62 HA ASP 62 2.685 9.353 4.394
454 HB2 ASP 62 HB2 ASP 62 1.513 10.893 5.932
455 HB3 ASP 62 HB1 ASP 62 3.100 10.431 6.516
456 H ASP 63 HN ASP 63 3.355 12.493 2.978
457 HA ASP 63 HA ASP 63 0.849 13.224 1.988
458 HB2 ASP 63 HB2 ASP 63 3.466 13.532 0.517
459 HB3 ASP 63 HB1 ASP 63 2.024 14.506 0.319
460 H VAL 64 HN VAL 64 3.234 11.003 0.792
461 HA VAL 64 HA VAL 64 2.369 10.772 -1.880
462 HB VAL 64 HB VAL 64 3.991 8.879 -0.231
463 HG11 VAL 64 HG11 VAL 64 3.843 9.217 -3.258
464 HG12 VAL 64 HG12 VAL 64 3.239 7.836 -2.344
465 HG13 VAL 64 HG13 VAL 64 4.972 8.149 -2.427
466 HG21 VAL 64 HG21 VAL 64 4.964 11.076 -0.210
467 HG22 VAL 64 HG22 VAL 64 4.871 11.181 -1.967
468 HG23 VAL 64 HG23 VAL 64 5.960 10.019 -1.209
469 H ALA 65 HN ALA 65 1.240 9.277 1.014
470 HA ALA 65 HA ALA 65 0.196 6.969 -0.281
471 HB1 ALA 65 HB1 ALA 65 -0.653 8.161 2.328
472 HB2 ALA 65 HB2 ALA 65 0.701 7.041 2.129
473 HB3 ALA 65 HB3 ALA 65 -0.950 6.510 1.789
474 H GLY 66 HN GLY 66 -0.753 10.212 -0.134
475 HA2 GLY 66 HA2 GLY 66 -3.482 9.545 -0.903
476 HA3 GLY 66 HA1 GLY 66 -2.902 11.154 -0.492
477 H ARG 67 HN ARG 67 -0.642 9.674 -2.326
478 HA ARG 67 HA ARG 67 -1.380 11.214 -4.706
479 HB2 ARG 67 HB2 ARG 67 0.748 11.812 -3.736
480 HB3 ARG 67 HB1 ARG 67 1.241 10.134 -3.650
481 HG2 ARG 67 HG2 ARG 67 1.307 10.078 -6.123
482 HG3 ARG 67 HG1 ARG 67 0.912 11.797 -6.137
483 HD2 ARG 67 HD2 ARG 67 2.944 12.355 -5.028
484 HD3 ARG 67 HD1 ARG 67 3.298 10.659 -4.692
485 HE ARG 67 HE ARG 67 3.011 11.149 -7.473
486 HH11 ARG 67 HH11 ARG 67 5.387 11.759 -4.887
487 HH12 ARG 67 HH12 ARG 67 6.734 11.423 -5.876
488 HH21 ARG 67 HH21 ARG 67 4.844 10.770 -8.799
489 HH22 ARG 67 HH22 ARG 67 6.423 10.845 -8.176
490 H VAL 68 HN VAL 68 -1.270 8.034 -3.513
491 HA VAL 68 HA VAL 68 -0.644 6.814 -6.046
492 HB VAL 68 HB VAL 68 -0.915 4.642 -4.791
493 HG11 VAL 68 HG11 VAL 68 0.986 6.658 -3.603
494 HG12 VAL 68 HG12 VAL 68 1.264 5.682 -5.047
495 HG13 VAL 68 HG13 VAL 68 1.136 4.906 -3.468
496 HG21 VAL 68 HG21 VAL 68 -1.010 4.705 -2.336
497 HG22 VAL 68 HG22 VAL 68 -2.474 5.388 -3.042
498 HG23 VAL 68 HG23 VAL 68 -1.232 6.453 -2.385
499 H ASP 69 HN ASP 69 -2.119 6.798 -7.517
500 HA ASP 69 HA ASP 69 -4.929 6.930 -7.046
501 HB2 ASP 69 HB2 ASP 69 -3.337 6.333 -9.543
502 HB3 ASP 69 HB1 ASP 69 -5.090 6.395 -9.523
503 H THR 70 HN THR 70 -2.683 4.334 -7.757
504 HA THR 70 HA THR 70 -4.844 2.393 -7.396
505 HB THR 70 HB THR 70 -3.574 0.922 -8.962
506 HG1 THR 70 HG1 THR 70 -2.197 2.822 -10.298
507 HG21 THR 70 HG21 THR 70 -4.459 3.555 -10.173
508 HG22 THR 70 HG22 THR 70 -5.522 2.203 -9.783
509 HG23 THR 70 HG23 THR 70 -4.300 2.028 -11.044
510 HA PRO 71 HA PRO 71 -2.123 0.521 -4.349
511 HB2 PRO 71 HB2 PRO 71 -2.918 -2.092 -5.541
512 HB3 PRO 71 HB1 PRO 71 -3.049 -1.539 -3.865
513 HG2 PRO 71 HG2 PRO 71 -5.209 -1.707 -5.367
514 HG3 PRO 71 HG1 PRO 71 -4.979 -0.317 -4.286
515 HD2 PRO 71 HD2 PRO 71 -4.532 -0.500 -7.251
516 HD3 PRO 71 HD1 PRO 71 -5.337 0.780 -6.317
517 H ARG 72 HN ARG 72 -1.999 -0.237 -7.708
518 HA ARG 72 HA ARG 72 0.402 -1.695 -7.825
519 HB2 ARG 72 HB2 ARG 72 -1.152 -1.467 -9.721
520 HB3 ARG 72 HB1 ARG 72 -0.718 0.232 -9.860
521 HG2 ARG 72 HG2 ARG 72 1.604 -0.427 -10.333
522 HG3 ARG 72 HG1 ARG 72 1.115 -2.121 -10.257
523 HD2 ARG 72 HD2 ARG 72 0.060 -0.056 -12.168
524 HD3 ARG 72 HD1 ARG 72 1.231 -1.310 -12.552
525 HE ARG 72 HE ARG 72 -0.955 -2.624 -11.546
526 HH11 ARG 72 HH11 ARG 72 -0.250 -0.521 -14.280
527 HH12 ARG 72 HH12 ARG 72 -1.470 -1.094 -15.288
528 HH21 ARG 72 HH21 ARG 72 -2.704 -3.518 -12.940
529 HH22 ARG 72 HH22 ARG 72 -2.917 -2.852 -14.478
530 H GLU 73 HN GLU 73 -0.267 1.773 -8.085
531 HA GLU 73 HA GLU 73 2.374 2.663 -8.446
532 HB2 GLU 73 HB2 GLU 73 0.286 4.001 -8.805
533 HB3 GLU 73 HB1 GLU 73 0.087 4.086 -7.064
534 HG2 GLU 73 HG2 GLU 73 1.002 6.150 -7.853
535 HG3 GLU 73 HG1 GLU 73 2.230 5.303 -6.918
536 H LEU 74 HN LEU 74 0.443 2.052 -5.597
537 HA LEU 74 HA LEU 74 2.267 3.002 -3.653
538 HB2 LEU 74 HB2 LEU 74 -0.195 2.690 -3.330
539 HB3 LEU 74 HB1 LEU 74 0.031 0.965 -3.381
540 HG LEU 74 HG LEU 74 -0.389 1.940 -1.112
541 HD11 LEU 74 HD11 LEU 74 1.283 0.642 0.087
542 HD12 LEU 74 HD12 LEU 74 2.216 0.477 -1.401
543 HD13 LEU 74 HD13 LEU 74 0.612 -0.246 -1.281
544 HD21 LEU 74 HD21 LEU 74 0.872 3.996 -1.321
545 HD22 LEU 74 HD22 LEU 74 2.376 3.086 -1.453
546 HD23 LEU 74 HD23 LEU 74 1.458 3.059 0.053
547 H LEU 75 HN LEU 75 1.568 -0.272 -4.861
548 HA LEU 75 HA LEU 75 3.442 -1.685 -3.335
549 HB2 LEU 75 HB2 LEU 75 1.620 -2.733 -4.612
550 HB3 LEU 75 HB1 LEU 75 2.403 -2.276 -6.108
551 HG LEU 75 HG LEU 75 4.310 -3.762 -5.514
552 HD11 LEU 75 HD11 LEU 75 4.023 -5.399 -3.730
553 HD12 LEU 75 HD12 LEU 75 2.523 -4.609 -3.246
554 HD13 LEU 75 HD13 LEU 75 4.058 -3.752 -3.102
555 HD21 LEU 75 HD21 LEU 75 2.531 -4.544 -6.982
556 HD22 LEU 75 HD22 LEU 75 1.601 -5.083 -5.584
557 HD23 LEU 75 HD23 LEU 75 3.139 -5.856 -5.973
558 H ASP 76 HN ASP 76 3.655 -0.321 -6.579
559 HA ASP 76 HA ASP 76 6.252 -1.105 -7.235
560 HB2 ASP 76 HB2 ASP 76 4.657 -0.224 -8.874
561 HB3 ASP 76 HB1 ASP 76 4.738 1.360 -8.111
562 H LEU 77 HN LEU 77 5.062 1.801 -5.671
563 HA LEU 77 HA LEU 77 7.391 3.278 -5.353
564 HB2 LEU 77 HB2 LEU 77 5.202 4.134 -4.782
565 HB3 LEU 77 HB1 LEU 77 5.027 2.939 -3.518
566 HG LEU 77 HG LEU 77 6.911 4.027 -2.314
567 HD11 LEU 77 HD11 LEU 77 7.989 5.112 -4.187
568 HD12 LEU 77 HD12 LEU 77 7.557 6.280 -2.942
569 HD13 LEU 77 HD13 LEU 77 6.585 6.158 -4.410
570 HD21 LEU 77 HD21 LEU 77 5.574 5.918 -1.529
571 HD22 LEU 77 HD22 LEU 77 4.602 4.459 -1.715
572 HD23 LEU 77 HD23 LEU 77 4.505 5.741 -2.920
573 H ILE 78 HN ILE 78 5.931 0.989 -3.094
574 HA ILE 78 HA ILE 78 8.076 1.100 -1.285
575 HB ILE 78 HB ILE 78 5.863 -0.969 -1.509
576 HG12 ILE 78 HG12 ILE 78 6.193 1.494 0.219
577 HG13 ILE 78 HG11 ILE 78 5.114 1.344 -1.159
578 HG21 ILE 78 HG21 ILE 78 7.786 -1.856 -0.238
579 HG22 ILE 78 HG22 ILE 78 6.416 -1.544 0.827
580 HG23 ILE 78 HG23 ILE 78 7.776 -0.419 0.784
581 HD11 ILE 78 HD11 ILE 78 3.923 1.164 0.935
582 HD12 ILE 78 HD12 ILE 78 4.936 -0.203 1.408
583 HD13 ILE 78 HD13 ILE 78 3.840 -0.346 0.031
584 H ASN 79 HN ASN 79 7.334 -1.104 -3.934
585 HA ASN 79 HA ASN 79 9.448 -2.926 -3.492
586 HB2 ASN 79 HB2 ASN 79 7.973 -2.131 -5.994
587 HB3 ASN 79 HB1 ASN 79 9.386 -3.163 -6.107
588 HD21 ASN 79 HD21 ASN 79 7.065 -3.347 -3.442
589 HD22 ASN 79 HD22 ASN 79 6.445 -4.890 -3.912
590 H GLY 80 HN GLY 80 9.363 0.147 -5.192
591 HA2 GLY 80 HA2 GLY 80 12.017 0.110 -6.155
592 HA3 GLY 80 HA1 GLY 80 11.036 1.548 -5.893
593 H ALA 81 HN ALA 81 10.591 1.324 -3.175
594 HA ALA 81 HA ALA 81 12.987 2.354 -2.077
595 HB1 ALA 81 HB1 ALA 81 10.526 1.348 -0.635
596 HB2 ALA 81 HB2 ALA 81 10.767 2.991 -1.232
597 HB3 ALA 81 HB3 ALA 81 11.789 2.363 0.062
598 H LEU 82 HN LEU 82 11.409 -0.774 -1.876
599 HA LEU 82 HA LEU 82 13.058 -2.060 -0.018
600 HB2 LEU 82 HB2 LEU 82 11.443 -3.116 -2.315
601 HB3 LEU 82 HB1 LEU 82 12.300 -4.161 -1.203
602 HG LEU 82 HG LEU 82 10.143 -2.222 -0.374
603 HD11 LEU 82 HD11 LEU 82 8.729 -4.204 -0.162
604 HD12 LEU 82 HD12 LEU 82 10.021 -5.201 -0.830
605 HD13 LEU 82 HD13 LEU 82 9.250 -3.972 -1.829
606 HD21 LEU 82 HD21 LEU 82 10.187 -3.509 1.684
607 HD22 LEU 82 HD22 LEU 82 11.754 -2.767 1.357
608 HD23 LEU 82 HD23 LEU 82 11.509 -4.488 1.049
609 H ALA 83 HN ALA 83 13.406 -1.612 -3.456
610 HA ALA 83 HA ALA 83 15.566 -3.426 -3.764
611 HB1 ALA 83 HB1 ALA 83 15.789 -2.473 -5.992
612 HB2 ALA 83 HB2 ALA 83 14.717 -1.146 -5.544
613 HB3 ALA 83 HB3 ALA 83 14.096 -2.794 -5.616
614 H GLU 84 HN GLU 84 15.344 -0.150 -2.732
615 HA GLU 84 HA GLU 84 18.215 0.177 -3.144
616 HB2 GLU 84 HB2 GLU 84 16.856 1.959 -4.055
617 HB3 GLU 84 HB1 GLU 84 16.130 2.246 -2.478
618 HG2 GLU 84 HG2 GLU 84 18.234 2.983 -1.587
619 HG3 GLU 84 HG1 GLU 84 19.057 2.550 -3.083
620 H ALA 85 HN ALA 85 15.790 0.475 -0.557
621 HA ALA 85 HA ALA 85 17.900 0.955 1.346
622 HB1 ALA 85 HB1 ALA 85 16.137 1.246 2.993
623 HB2 ALA 85 HB2 ALA 85 14.936 0.673 1.836
624 HB3 ALA 85 HB3 ALA 85 15.783 2.192 1.547
625 H ALA 86 HN ALA 86 18.968 -1.013 0.970
626 HA ALA 86 HA ALA 86 18.415 -2.927 2.982
627 HB1 ALA 86 HB1 ALA 86 18.253 -4.896 1.506
628 HB2 ALA 86 HB2 ALA 86 18.222 -3.836 0.096
629 HB3 ALA 86 HB3 ALA 86 16.890 -3.802 1.253
630 H28 SXV 87 H28A SXV 87 -4.815 11.932 3.393
631 H28A SXV 87 H28B SXV 87 -4.085 11.092 2.029
632 H30 SXV 87 H30C SXV 87 -1.920 11.756 2.440
633 H30A SXV 87 H30A SXV 87 -2.463 12.502 3.939
634 H30B SXV 87 H30B SXV 87 -1.477 13.420 2.793
635 H31 SXV 87 H31C SXV 87 -2.491 14.174 0.600
636 H31A SXV 87 H31A SXV 87 -4.119 13.634 0.183
637 H31B SXV 87 H31B SXV 87 -2.801 12.467 0.286
638 H32 SXV 87 H32A SXV 87 -4.448 14.361 3.820
639 HO33 SXV 87 H33A SXV 87 -4.767 15.870 1.722
640 HN36 SXV 87 H36A SXV 87 -2.122 14.792 4.310
641 H37 SXV 87 H37B SXV 87 -1.314 17.324 4.489
642 H37A SXV 87 H37A SXV 87 -0.623 16.836 2.938
643 H38 SXV 87 H38B SXV 87 0.496 14.953 4.042
644 H38A SXV 87 H38A SXV 87 -0.240 15.414 5.575
645 HN41 SXV 87 H41A SXV 87 2.255 15.072 5.705
646 H42 SXV 87 H42B SXV 87 3.584 17.700 5.605
647 H42A SXV 87 H42A SXV 87 4.406 16.140 5.498
648 H43 SXV 87 H43B SXV 87 3.754 15.633 7.792
649 H43A SXV 87 H43A SXV 87 4.715 17.109 7.682
650 H1 SXV 87 H1B SXV 87 4.024 17.779 10.090
651 H1A SXV 87 H1A SXV 87 2.357 17.983 10.656
652 H2 SXV 87 H2A SXV 87 3.522 15.337 9.899
653 H2A SXV 87 H2B SXV 87 1.909 15.664 10.512
654 H4 SXV 87 H4C SXV 87 3.024 17.775 12.759
655 H4A SXV 87 H4A SXV 87 3.306 16.528 13.981
656 H4B SXV 87 H4B SXV 87 1.780 16.560 13.090
Start of MODEL 15
1 H1 MET 1 HT1 MET 1 16.664 -11.179 -3.092
2 H2 MET 1 HT2 MET 1 17.517 -11.956 -4.309
3 H3 MET 1 HT3 MET 1 16.612 -10.554 -4.625
4 HA MET 1 HA MET 1 18.916 -10.658 -2.771
5 HB2 MET 1 HB2 MET 1 18.705 -9.362 -5.517
6 HB3 MET 1 HB1 MET 1 20.078 -9.204 -4.429
7 HG2 MET 1 HG2 MET 1 20.560 -11.558 -4.615
8 HG3 MET 1 HG1 MET 1 19.115 -11.810 -5.587
9 HE1 MET 1 HE1 MET 1 22.706 -10.232 -5.458
10 HE2 MET 1 HE2 MET 1 21.690 -8.831 -5.798
11 HE3 MET 1 HE3 MET 1 22.805 -9.432 -7.026
12 H ALA 2 HN ALA 2 17.105 -8.301 -4.754
13 HA ALA 2 HA ALA 2 16.860 -6.575 -2.441
14 HB1 ALA 2 HB1 ALA 2 15.865 -6.320 -5.300
15 HB2 ALA 2 HB2 ALA 2 17.301 -5.541 -4.636
16 HB3 ALA 2 HB3 ALA 2 15.701 -5.075 -4.062
17 H THR 3 HN THR 3 15.313 -7.164 -1.048
18 HA THR 3 HA THR 3 13.312 -9.038 -1.714
19 HB THR 3 HB THR 3 13.463 -7.220 0.612
20 HG1 THR 3 HG1 THR 3 14.674 -9.807 0.397
21 HG21 THR 3 HG21 THR 3 12.397 -10.036 0.298
22 HG22 THR 3 HG22 THR 3 11.430 -8.573 0.474
23 HG23 THR 3 HG23 THR 3 12.430 -9.133 1.814
24 H LEU 4 HN LEU 4 11.791 -8.392 -3.091
25 HA LEU 4 HA LEU 4 10.505 -5.789 -2.710
26 HB2 LEU 4 HB2 LEU 4 10.349 -7.679 -5.057
27 HB3 LEU 4 HB1 LEU 4 9.632 -6.087 -4.963
28 HG LEU 4 HG LEU 4 12.574 -6.732 -5.090
29 HD11 LEU 4 HD11 LEU 4 12.459 -5.603 -7.249
30 HD12 LEU 4 HD12 LEU 4 10.719 -5.406 -7.051
31 HD13 LEU 4 HD13 LEU 4 11.413 -7.022 -7.194
32 HD21 LEU 4 HD21 LEU 4 12.916 -4.307 -5.210
33 HD22 LEU 4 HD22 LEU 4 12.190 -4.779 -3.674
34 HD23 LEU 4 HD23 LEU 4 11.193 -4.050 -4.932
35 H LEU 5 HN LEU 5 8.591 -5.846 -1.744
36 HA LEU 5 HA LEU 5 7.359 -8.330 -1.233
37 HB2 LEU 5 HB2 LEU 5 5.590 -7.018 -0.078
38 HB3 LEU 5 HB1 LEU 5 7.201 -6.727 0.511
39 HG LEU 5 HG LEU 5 7.165 -4.550 -0.797
40 HD11 LEU 5 HD11 LEU 5 5.345 -5.054 -2.341
41 HD12 LEU 5 HD12 LEU 5 4.993 -3.621 -1.373
42 HD13 LEU 5 HD13 LEU 5 4.221 -5.162 -0.985
43 HD21 LEU 5 HD21 LEU 5 5.790 -3.423 0.892
44 HD22 LEU 5 HD22 LEU 5 6.876 -4.626 1.584
45 HD23 LEU 5 HD23 LEU 5 5.161 -4.989 1.396
46 H THR 6 HN THR 6 5.127 -8.824 -1.711
47 HA THR 6 HA THR 6 4.584 -8.039 -4.444
48 HB THR 6 HB THR 6 3.612 -10.398 -4.650
49 HG1 THR 6 HG1 THR 6 4.429 -10.513 -2.078
50 HG21 THR 6 HG21 THR 6 6.589 -10.003 -4.321
51 HG22 THR 6 HG22 THR 6 5.651 -9.659 -5.774
52 HG23 THR 6 HG23 THR 6 5.824 -11.322 -5.208
53 H THR 7 HN THR 7 2.195 -9.360 -4.831
54 HA THR 7 HA THR 7 0.373 -7.489 -4.033
55 HB THR 7 HB THR 7 -1.283 -9.383 -4.677
56 HG1 THR 7 HG1 THR 7 -0.419 -11.137 -5.551
57 HG21 THR 7 HG21 THR 7 -0.793 -8.988 -7.055
58 HG22 THR 7 HG22 THR 7 0.786 -8.340 -6.619
59 HG23 THR 7 HG23 THR 7 -0.681 -7.495 -6.121
60 H ASP 8 HN ASP 8 0.752 -10.798 -2.671
61 HA ASP 8 HA ASP 8 -1.321 -10.480 -0.792
62 HB2 ASP 8 HB2 ASP 8 0.961 -12.419 -0.897
63 HB3 ASP 8 HB1 ASP 8 -0.087 -12.357 0.515
64 H ASP 9 HN ASP 9 2.014 -9.564 -0.580
65 HA ASP 9 HA ASP 9 2.201 -9.068 2.192
66 HB2 ASP 9 HB2 ASP 9 3.492 -7.485 -0.049
67 HB3 ASP 9 HB1 ASP 9 4.007 -7.511 1.627
68 H LEU 10 HN LEU 10 1.473 -6.914 -0.506
69 HA LEU 10 HA LEU 10 0.775 -4.650 1.045
70 HB2 LEU 10 HB2 LEU 10 1.478 -4.528 -1.311
71 HB3 LEU 10 HB1 LEU 10 0.022 -5.371 -1.790
72 HG LEU 10 HG LEU 10 -1.324 -3.449 -1.019
73 HD11 LEU 10 HD11 LEU 10 0.173 -2.597 0.697
74 HD12 LEU 10 HD12 LEU 10 -0.222 -1.339 -0.475
75 HD13 LEU 10 HD13 LEU 10 1.346 -2.143 -0.538
76 HD21 LEU 10 HD21 LEU 10 -0.680 -1.919 -2.818
77 HD22 LEU 10 HD22 LEU 10 -0.642 -3.598 -3.349
78 HD23 LEU 10 HD23 LEU 10 0.863 -2.757 -2.977
79 H ARG 11 HN ARG 11 -1.062 -7.240 -0.387
80 HA ARG 11 HA ARG 11 -3.698 -6.503 0.041
81 HB2 ARG 11 HB2 ARG 11 -2.993 -8.474 -1.207
82 HB3 ARG 11 HB1 ARG 11 -2.382 -9.210 0.258
83 HG2 ARG 11 HG2 ARG 11 -4.690 -9.302 1.124
84 HG3 ARG 11 HG1 ARG 11 -5.257 -8.659 -0.426
85 HD2 ARG 11 HD2 ARG 11 -4.213 -10.562 -1.575
86 HD3 ARG 11 HD1 ARG 11 -3.696 -11.208 -0.022
87 HE ARG 11 HE ARG 11 -6.473 -10.760 -0.053
88 HH11 ARG 11 HH11 ARG 11 -3.971 -13.111 -1.074
89 HH12 ARG 11 HH12 ARG 11 -5.075 -14.371 -1.360
90 HH21 ARG 11 HH21 ARG 11 -7.987 -12.524 -0.441
91 HH22 ARG 11 HH22 ARG 11 -7.412 -14.039 -0.988
92 H ARG 12 HN ARG 12 -1.566 -8.368 2.193
93 HA ARG 12 HA ARG 12 -3.479 -8.445 4.278
94 HB2 ARG 12 HB2 ARG 12 -0.525 -9.070 4.293
95 HB3 ARG 12 HB1 ARG 12 -1.607 -9.371 5.650
96 HG2 ARG 12 HG2 ARG 12 -2.908 -10.920 4.346
97 HG3 ARG 12 HG1 ARG 12 -1.977 -10.537 2.900
98 HD2 ARG 12 HD2 ARG 12 -1.240 -12.641 3.807
99 HD3 ARG 12 HD1 ARG 12 0.032 -11.440 3.991
100 HE ARG 12 HE ARG 12 -1.523 -11.509 6.330
101 HH11 ARG 12 HH11 ARG 12 0.868 -13.513 4.616
102 HH12 ARG 12 HH12 ARG 12 1.389 -14.307 6.031
103 HH21 ARG 12 HH21 ARG 12 -0.818 -12.564 8.192
104 HH22 ARG 12 HH22 ARG 12 0.440 -13.728 8.145
105 H ALA 13 HN ALA 13 -0.872 -6.270 3.492
106 HA ALA 13 HA ALA 13 -0.832 -4.845 5.939
107 HB1 ALA 13 HB1 ALA 13 0.267 -3.070 4.686
108 HB2 ALA 13 HB2 ALA 13 -0.196 -3.842 3.170
109 HB3 ALA 13 HB3 ALA 13 0.939 -4.644 4.259
110 H LEU 14 HN LEU 14 -2.809 -4.552 3.037
111 HA LEU 14 HA LEU 14 -4.187 -2.224 3.846
112 HB2 LEU 14 HB2 LEU 14 -5.066 -4.455 2.004
113 HB3 LEU 14 HB1 LEU 14 -5.964 -2.971 2.238
114 HG LEU 14 HG LEU 14 -3.191 -3.162 1.050
115 HD11 LEU 14 HD11 LEU 14 -5.857 -2.607 -0.237
116 HD12 LEU 14 HD12 LEU 14 -4.905 -4.079 -0.416
117 HD13 LEU 14 HD13 LEU 14 -4.287 -2.549 -1.041
118 HD21 LEU 14 HD21 LEU 14 -5.055 -0.809 1.344
119 HD22 LEU 14 HD22 LEU 14 -3.515 -0.803 0.486
120 HD23 LEU 14 HD23 LEU 14 -3.552 -1.057 2.231
121 H VAL 15 HN VAL 15 -4.720 -5.641 4.407
122 HA VAL 15 HA VAL 15 -7.168 -5.441 5.794
123 HB VAL 15 HB VAL 15 -4.917 -7.450 6.232
124 HG11 VAL 15 HG11 VAL 15 -7.846 -7.640 6.940
125 HG12 VAL 15 HG12 VAL 15 -6.511 -7.459 8.077
126 HG13 VAL 15 HG13 VAL 15 -6.658 -8.932 7.121
127 HG21 VAL 15 HG21 VAL 15 -5.665 -7.432 3.915
128 HG22 VAL 15 HG22 VAL 15 -7.339 -7.615 4.440
129 HG23 VAL 15 HG23 VAL 15 -6.180 -8.915 4.719
130 H GLU 16 HN GLU 16 -3.807 -5.338 6.894
131 HA GLU 16 HA GLU 16 -4.092 -5.002 9.616
132 HB2 GLU 16 HB2 GLU 16 -1.990 -3.705 7.850
133 HB3 GLU 16 HB1 GLU 16 -1.945 -3.848 9.593
134 HG2 GLU 16 HG2 GLU 16 -2.077 -6.182 7.722
135 HG3 GLU 16 HG1 GLU 16 -0.618 -5.482 8.421
136 H SER 17 HN SER 17 -4.587 -2.704 7.069
137 HA SER 17 HA SER 17 -4.604 -0.424 8.863
138 HB2 SER 17 HB2 SER 17 -5.094 -0.540 5.896
139 HB3 SER 17 HB1 SER 17 -4.721 0.893 6.861
140 HG SER 17 HG SER 17 -3.034 -1.363 6.464
141 H ALA 18 HN ALA 18 -6.844 -1.875 6.478
142 HA ALA 18 HA ALA 18 -8.984 -0.149 7.132
143 HB1 ALA 18 HB1 ALA 18 -9.049 -2.760 5.639
144 HB2 ALA 18 HB2 ALA 18 -8.713 -1.178 4.933
145 HB3 ALA 18 HB3 ALA 18 -10.297 -1.515 5.631
146 H GLY 19 HN GLY 19 -7.947 -3.172 8.471
147 HA2 GLY 19 HA2 GLY 19 -8.740 -4.182 10.408
148 HA3 GLY 19 HA1 GLY 19 -10.092 -3.046 10.420
149 H GLU 20 HN GLU 20 -11.718 -3.333 8.784
150 HA GLU 20 HA GLU 20 -12.261 -6.139 8.299
151 HB2 GLU 20 HB2 GLU 20 -14.506 -5.351 7.586
152 HB3 GLU 20 HB1 GLU 20 -14.125 -4.850 9.224
153 HG2 GLU 20 HG2 GLU 20 -13.666 -2.606 8.481
154 HG3 GLU 20 HG1 GLU 20 -13.861 -3.089 6.795
155 H THR 21 HN THR 21 -12.165 -6.976 6.327
156 HA THR 21 HA THR 21 -11.920 -5.224 4.030
157 HB THR 21 HB THR 21 -9.875 -7.429 4.572
158 HG1 THR 21 HG1 THR 21 -10.060 -4.843 5.431
159 HG21 THR 21 HG21 THR 21 -8.624 -6.349 2.751
160 HG22 THR 21 HG22 THR 21 -9.902 -5.147 2.574
161 HG23 THR 21 HG23 THR 21 -10.224 -6.836 2.188
162 H ASP 22 HN ASP 22 -14.141 -6.402 4.510
163 HA ASP 22 HA ASP 22 -14.181 -8.955 3.031
164 HB2 ASP 22 HB2 ASP 22 -15.207 -8.987 5.312
165 HB3 ASP 22 HB1 ASP 22 -16.346 -7.754 4.782
166 H GLY 23 HN GLY 23 -15.673 -5.771 3.344
167 HA2 GLY 23 HA2 GLY 23 -17.142 -6.103 0.838
168 HA3 GLY 23 HA1 GLY 23 -17.245 -4.734 1.942
169 H THR 24 HN THR 24 -14.223 -5.895 1.234
170 HA THR 24 HA THR 24 -13.646 -4.026 -0.902
171 HB THR 24 HB THR 24 -12.022 -4.303 1.670
172 HG1 THR 24 HG1 THR 24 -14.181 -2.810 1.050
173 HG21 THR 24 HG21 THR 24 -10.777 -2.367 0.802
174 HG22 THR 24 HG22 THR 24 -11.778 -2.371 -0.650
175 HG23 THR 24 HG23 THR 24 -10.692 -3.722 -0.323
176 H ASP 25 HN ASP 25 -13.415 -5.727 -2.252
177 HA ASP 25 HA ASP 25 -12.145 -8.183 -1.421
178 HB2 ASP 25 HB2 ASP 25 -14.141 -8.320 -2.790
179 HB3 ASP 25 HB1 ASP 25 -13.364 -7.387 -4.062
180 H LEU 26 HN LEU 26 -10.106 -8.377 -1.395
181 HA LEU 26 HA LEU 26 -8.381 -6.948 -3.308
182 HB2 LEU 26 HB2 LEU 26 -7.997 -8.077 -0.579
183 HB3 LEU 26 HB1 LEU 26 -6.613 -7.916 -1.629
184 HG LEU 26 HG LEU 26 -6.751 -5.531 -1.596
185 HD11 LEU 26 HD11 LEU 26 -8.518 -4.306 -0.460
186 HD12 LEU 26 HD12 LEU 26 -9.350 -5.817 -0.086
187 HD13 LEU 26 HD13 LEU 26 -9.202 -5.282 -1.760
188 HD21 LEU 26 HD21 LEU 26 -7.352 -6.712 1.057
189 HD22 LEU 26 HD22 LEU 26 -6.644 -5.107 0.810
190 HD23 LEU 26 HD23 LEU 26 -5.764 -6.573 0.307
191 H SER 27 HN SER 27 -9.866 -9.684 -3.153
192 HA SER 27 HA SER 27 -7.962 -11.724 -3.495
193 HB2 SER 27 HB2 SER 27 -10.745 -11.682 -4.647
194 HB3 SER 27 HB1 SER 27 -9.793 -13.086 -4.153
195 HG SER 27 HG SER 27 -11.405 -11.506 -2.747
196 H GLY 28 HN GLY 28 -6.973 -12.533 -5.258
197 HA2 GLY 28 HA2 GLY 28 -6.322 -12.826 -7.455
198 HA3 GLY 28 HA1 GLY 28 -7.680 -11.821 -7.951
199 H ASP 29 HN ASP 29 -7.193 -9.952 -8.794
200 HA ASP 29 HA ASP 29 -4.671 -8.682 -7.998
201 HB2 ASP 29 HB2 ASP 29 -4.639 -9.262 -10.394
202 HB3 ASP 29 HB1 ASP 29 -6.130 -8.349 -10.631
203 H PHE 30 HN PHE 30 -4.977 -7.053 -6.797
204 HA PHE 30 HA PHE 30 -7.483 -5.591 -7.030
205 HB2 PHE 30 HB2 PHE 30 -7.050 -4.784 -4.727
206 HB3 PHE 30 HB1 PHE 30 -7.146 -6.535 -4.840
207 HD1 PHE 30 HD2 PHE 30 -4.975 -7.867 -4.799
208 HD2 PHE 30 HD1 PHE 30 -5.184 -3.739 -3.809
209 HE1 PHE 30 HE2 PHE 30 -2.821 -8.041 -3.635
210 HE2 PHE 30 HE1 PHE 30 -3.041 -3.905 -2.643
211 HZ PHE 30 HZ PHE 30 -1.848 -6.059 -2.553
212 H LEU 31 HN LEU 31 -4.677 -5.405 -8.405
213 HA LEU 31 HA LEU 31 -3.822 -2.749 -7.738
214 HB2 LEU 31 HB2 LEU 31 -2.969 -4.770 -9.782
215 HB3 LEU 31 HB1 LEU 31 -2.409 -3.122 -9.882
216 HG LEU 31 HG LEU 31 -1.296 -3.358 -7.707
217 HD11 LEU 31 HD11 LEU 31 -2.183 -6.232 -7.795
218 HD12 LEU 31 HD12 LEU 31 -2.736 -4.996 -6.656
219 HD13 LEU 31 HD13 LEU 31 -1.045 -5.508 -6.653
220 HD21 LEU 31 HD21 LEU 31 0.467 -4.880 -8.436
221 HD22 LEU 31 HD22 LEU 31 -0.095 -3.828 -9.742
222 HD23 LEU 31 HD23 LEU 31 -0.612 -5.509 -9.687
223 H ASP 32 HN ASP 32 -5.798 -4.298 -10.100
224 HA ASP 32 HA ASP 32 -6.028 -2.113 -11.890
225 HB2 ASP 32 HB2 ASP 32 -6.560 -4.356 -12.629
226 HB3 ASP 32 HB1 ASP 32 -7.857 -4.478 -11.448
227 H LEU 33 HN LEU 33 -7.642 -2.838 -8.909
228 HA LEU 33 HA LEU 33 -9.735 -0.920 -9.470
229 HB2 LEU 33 HB2 LEU 33 -10.700 -1.584 -7.286
230 HB3 LEU 33 HB1 LEU 33 -10.501 -2.927 -8.378
231 HG LEU 33 HG LEU 33 -8.385 -3.478 -7.017
232 HD11 LEU 33 HD11 LEU 33 -8.376 -2.736 -4.698
233 HD12 LEU 33 HD12 LEU 33 -9.729 -1.655 -5.031
234 HD13 LEU 33 HD13 LEU 33 -8.170 -1.378 -5.806
235 HD21 LEU 33 HD21 LEU 33 -9.700 -4.683 -5.347
236 HD22 LEU 33 HD22 LEU 33 -10.405 -4.802 -6.960
237 HD23 LEU 33 HD23 LEU 33 -11.110 -3.709 -5.767
238 H ARG 34 HN ARG 34 -10.219 0.711 -7.615
239 HA ARG 34 HA ARG 34 -7.606 1.722 -6.742
240 HB2 ARG 34 HB2 ARG 34 -9.865 3.465 -7.679
241 HB3 ARG 34 HB1 ARG 34 -8.323 4.016 -7.051
242 HG2 ARG 34 HG2 ARG 34 -7.363 2.614 -9.009
243 HG3 ARG 34 HG1 ARG 34 -8.987 2.811 -9.678
244 HD2 ARG 34 HD2 ARG 34 -7.080 4.949 -8.814
245 HD3 ARG 34 HD1 ARG 34 -7.572 4.592 -10.468
246 HE ARG 34 HE ARG 34 -9.778 5.310 -8.758
247 HH11 ARG 34 HH11 ARG 34 -7.275 6.508 -10.937
248 HH12 ARG 34 HH12 ARG 34 -7.928 8.070 -11.103
249 HH21 ARG 34 HH21 ARG 34 -10.700 7.567 -8.928
250 HH22 ARG 34 HH22 ARG 34 -9.889 8.659 -9.926
251 H PHE 35 HN PHE 35 -7.691 3.303 -5.037
252 HA PHE 35 HA PHE 35 -9.064 2.185 -2.817
253 HB2 PHE 35 HB2 PHE 35 -7.447 4.725 -2.975
254 HB3 PHE 35 HB1 PHE 35 -7.870 3.850 -1.508
255 HD1 PHE 35 HD2 PHE 35 -7.089 1.359 -1.426
256 HD2 PHE 35 HD1 PHE 35 -5.458 4.330 -3.985
257 HE1 PHE 35 HE2 PHE 35 -5.041 0.018 -1.674
258 HE2 PHE 35 HE1 PHE 35 -3.431 3.013 -4.257
259 HZ PHE 35 HZ PHE 35 -3.201 0.846 -3.089
260 H GLU 36 HN GLU 36 -9.343 5.111 -4.710
261 HA GLU 36 HA GLU 36 -11.264 6.518 -3.274
262 HB2 GLU 36 HB2 GLU 36 -10.047 7.378 -5.210
263 HB3 GLU 36 HB1 GLU 36 -10.878 6.238 -6.252
264 HG2 GLU 36 HG2 GLU 36 -13.001 7.363 -5.732
265 HG3 GLU 36 HG1 GLU 36 -12.105 8.539 -4.766
266 H ASP 37 HN ASP 37 -11.563 3.913 -5.560
267 HA ASP 37 HA ASP 37 -14.400 3.945 -5.752
268 HB2 ASP 37 HB2 ASP 37 -13.024 3.120 -7.556
269 HB3 ASP 37 HB1 ASP 37 -12.379 1.855 -6.521
270 H ILE 38 HN ILE 38 -12.073 1.983 -3.943
271 HA ILE 38 HA ILE 38 -14.212 0.419 -2.770
272 HB ILE 38 HB ILE 38 -12.443 -0.820 -1.558
273 HG12 ILE 38 HG12 ILE 38 -10.556 1.059 -3.016
274 HG13 ILE 38 HG11 ILE 38 -10.811 0.997 -1.280
275 HG21 ILE 38 HG21 ILE 38 -11.997 -0.482 -4.504
276 HG22 ILE 38 HG22 ILE 38 -13.164 -1.566 -3.729
277 HG23 ILE 38 HG23 ILE 38 -11.424 -1.844 -3.531
278 HD11 ILE 38 HD11 ILE 38 -9.581 -1.172 -2.974
279 HD12 ILE 38 HD12 ILE 38 -9.847 -1.265 -1.235
280 HD13 ILE 38 HD13 ILE 38 -8.722 -0.075 -1.895
281 H GLY 39 HN GLY 39 -13.651 3.322 -2.198
282 HA2 GLY 39 HA2 GLY 39 -13.950 4.801 -0.432
283 HA3 GLY 39 HA1 GLY 39 -14.747 3.464 0.382
284 H TYR 40 HN TYR 40 -11.398 3.964 -0.623
285 HA TYR 40 HA TYR 40 -10.571 3.301 2.114
286 HB2 TYR 40 HB2 TYR 40 -9.961 1.998 -0.171
287 HB3 TYR 40 HB1 TYR 40 -8.698 3.219 -0.188
288 HD1 TYR 40 HD1 TYR 40 -7.147 3.373 1.751
289 HD2 TYR 40 HD2 TYR 40 -9.783 0.086 1.215
290 HE1 TYR 40 HE1 TYR 40 -5.775 2.055 3.271
291 HE2 TYR 40 HE2 TYR 40 -8.403 -1.267 2.745
292 HH TYR 40 HH TYR 40 -5.915 0.106 4.643
293 H ASP 41 HN ASP 41 -9.556 4.859 3.181
294 HA ASP 41 HA ASP 41 -9.122 7.443 1.894
295 HB2 ASP 41 HB2 ASP 41 -8.883 6.593 4.777
296 HB3 ASP 41 HB1 ASP 41 -8.422 8.189 4.211
297 H SER 42 HN SER 42 -7.180 8.626 2.005
298 HA SER 42 HA SER 42 -4.930 7.017 1.359
299 HB2 SER 42 HB2 SER 42 -3.788 9.067 0.916
300 HB3 SER 42 HB1 SER 42 -5.460 9.323 0.406
301 H LEU 43 HN LEU 43 -6.060 8.696 4.173
302 HA LEU 43 HA LEU 43 -3.739 8.580 5.744
303 HB2 LEU 43 HB2 LEU 43 -6.636 8.461 6.573
304 HB3 LEU 43 HB1 LEU 43 -5.309 8.587 7.709
305 HG LEU 43 HG LEU 43 -5.977 10.642 5.598
306 HD11 LEU 43 HD11 LEU 43 -6.720 12.001 7.480
307 HD12 LEU 43 HD12 LEU 43 -6.407 10.659 8.583
308 HD13 LEU 43 HD13 LEU 43 -7.669 10.519 7.357
309 HD21 LEU 43 HD21 LEU 43 -4.355 12.028 6.799
310 HD22 LEU 43 HD22 LEU 43 -3.598 10.569 6.159
311 HD23 LEU 43 HD23 LEU 43 -3.992 10.678 7.872
312 H ALA 44 HN ALA 44 -6.213 6.188 5.078
313 HA ALA 44 HA ALA 44 -5.205 4.275 6.924
314 HB1 ALA 44 HB1 ALA 44 -7.530 4.196 6.133
315 HB2 ALA 44 HB2 ALA 44 -6.684 2.690 5.767
316 HB3 ALA 44 HB3 ALA 44 -6.959 3.882 4.494
317 H LEU 45 HN LEU 45 -4.610 5.118 3.600
318 HA LEU 45 HA LEU 45 -2.943 2.928 2.929
319 HB2 LEU 45 HB2 LEU 45 -3.048 5.732 1.830
320 HB3 LEU 45 HB1 LEU 45 -2.108 4.431 1.126
321 HG LEU 45 HG LEU 45 -5.108 4.409 1.409
322 HD11 LEU 45 HD11 LEU 45 -4.351 6.090 -0.203
323 HD12 LEU 45 HD12 LEU 45 -5.111 4.722 -1.016
324 HD13 LEU 45 HD13 LEU 45 -3.356 4.876 -1.005
325 HD21 LEU 45 HD21 LEU 45 -3.190 2.581 -0.007
326 HD22 LEU 45 HD22 LEU 45 -4.949 2.464 -0.046
327 HD23 LEU 45 HD23 LEU 45 -4.080 2.204 1.469
328 H MET 46 HN MET 46 -2.355 6.012 4.445
329 HA MET 46 HA MET 46 0.487 5.826 4.489
330 HB2 MET 46 HB2 MET 46 -1.338 7.320 6.394
331 HB3 MET 46 HB1 MET 46 0.399 7.562 6.247
332 HG2 MET 46 HG2 MET 46 0.143 8.394 4.001
333 HG3 MET 46 HG1 MET 46 -1.581 7.998 4.045
334 HE1 MET 46 HE1 MET 46 -2.384 10.341 3.328
335 HE2 MET 46 HE2 MET 46 -0.696 10.802 3.098
336 HE3 MET 46 HE3 MET 46 -1.782 11.852 4.011
337 H GLU 47 HN GLU 47 -2.068 4.664 6.517
338 HA GLU 47 HA GLU 47 -0.489 3.634 8.634
339 HB2 GLU 47 HB2 GLU 47 -2.912 3.973 8.820
340 HB3 GLU 47 HB1 GLU 47 -3.190 2.801 7.551
341 HG2 GLU 47 HG2 GLU 47 -3.693 1.790 9.659
342 HG3 GLU 47 HG1 GLU 47 -2.248 1.039 8.990
343 H THR 48 HN THR 48 -1.847 2.213 5.665
344 HA THR 48 HA THR 48 -0.838 -0.353 5.730
345 HB THR 48 HB THR 48 -1.033 1.484 3.323
346 HG1 THR 48 HG1 THR 48 -2.914 0.437 4.992
347 HG21 THR 48 HG21 THR 48 -1.485 -0.579 2.077
348 HG22 THR 48 HG22 THR 48 -1.251 -1.522 3.547
349 HG23 THR 48 HG23 THR 48 0.107 -0.639 2.840
350 H ALA 49 HN ALA 49 0.609 2.545 4.284
351 HA ALA 49 HA ALA 49 3.059 1.537 3.531
352 HB1 ALA 49 HB1 ALA 49 2.235 3.745 2.870
353 HB2 ALA 49 HB2 ALA 49 3.855 3.839 3.559
354 HB3 ALA 49 HB3 ALA 49 2.456 4.320 4.523
355 H ALA 50 HN ALA 50 2.205 3.143 6.600
356 HA ALA 50 HA ALA 50 4.693 3.038 7.817
357 HB1 ALA 50 HB1 ALA 50 2.808 4.356 8.652
358 HB2 ALA 50 HB2 ALA 50 3.539 3.373 9.922
359 HB3 ALA 50 HB3 ALA 50 2.015 2.875 9.187
360 H ARG 51 HN ARG 51 2.134 0.607 7.894
361 HA ARG 51 HA ARG 51 3.391 -1.155 9.725
362 HB2 ARG 51 HB2 ARG 51 1.483 -1.869 7.472
363 HB3 ARG 51 HB1 ARG 51 1.875 -2.896 8.844
364 HG2 ARG 51 HG2 ARG 51 0.500 -0.217 9.025
365 HG3 ARG 51 HG1 ARG 51 -0.311 -1.780 9.063
366 HD2 ARG 51 HD2 ARG 51 0.720 -2.356 11.119
367 HD3 ARG 51 HD1 ARG 51 1.817 -0.972 11.041
368 HE ARG 51 HE ARG 51 -0.280 0.413 11.187
369 HH11 ARG 51 HH11 ARG 51 -0.207 -2.825 12.658
370 HH12 ARG 51 HH12 ARG 51 -1.245 -2.419 13.943
371 HH21 ARG 51 HH21 ARG 51 -1.679 0.969 12.957
372 HH22 ARG 51 HH22 ARG 51 -2.114 -0.211 14.116
373 H LEU 52 HN LEU 52 3.372 -1.075 6.208
374 HA LEU 52 HA LEU 52 5.253 -3.171 5.913
375 HB2 LEU 52 HB2 LEU 52 4.420 -1.016 3.982
376 HB3 LEU 52 HB1 LEU 52 5.480 -2.350 3.557
377 HG LEU 52 HG LEU 52 2.642 -2.653 4.542
378 HD11 LEU 52 HD11 LEU 52 3.784 -2.948 1.773
379 HD12 LEU 52 HD12 LEU 52 2.709 -1.665 2.326
380 HD13 LEU 52 HD13 LEU 52 2.134 -3.331 2.258
381 HD21 LEU 52 HD21 LEU 52 2.916 -4.989 3.879
382 HD22 LEU 52 HD22 LEU 52 4.067 -4.536 5.136
383 HD23 LEU 52 HD23 LEU 52 4.600 -4.676 3.460
384 H GLU 53 HN GLU 53 5.669 0.322 6.176
385 HA GLU 53 HA GLU 53 8.389 0.539 5.618
386 HB2 GLU 53 HB2 GLU 53 6.736 2.049 7.639
387 HB3 GLU 53 HB1 GLU 53 8.403 2.442 7.273
388 HG2 GLU 53 HG2 GLU 53 7.744 2.914 4.956
389 HG3 GLU 53 HG1 GLU 53 6.064 2.572 5.390
390 H SER 54 HN SER 54 6.725 -0.250 8.572
391 HA SER 54 HA SER 54 8.972 -0.490 10.211
392 HB2 SER 54 HB2 SER 54 6.626 -0.266 10.998
393 HB3 SER 54 HB1 SER 54 6.298 -1.891 10.412
394 HG SER 54 HG SER 54 6.720 -1.850 12.604
395 H ARG 55 HN ARG 55 7.044 -2.984 8.535
396 HA ARG 55 HA ARG 55 8.548 -5.187 9.317
397 HB2 ARG 55 HB2 ARG 55 6.302 -5.396 8.397
398 HB3 ARG 55 HB1 ARG 55 6.874 -4.870 6.819
399 HG2 ARG 55 HG2 ARG 55 8.305 -6.845 6.682
400 HG3 ARG 55 HG1 ARG 55 7.731 -7.368 8.262
401 HD2 ARG 55 HD2 ARG 55 5.457 -7.570 7.355
402 HD3 ARG 55 HD1 ARG 55 6.048 -7.042 5.774
403 HE ARG 55 HE ARG 55 7.627 -9.167 6.586
404 HH11 ARG 55 HH11 ARG 55 4.242 -8.702 5.495
405 HH12 ARG 55 HH12 ARG 55 4.050 -10.313 5.043
406 HH21 ARG 55 HH21 ARG 55 7.352 -11.316 5.938
407 HH22 ARG 55 HH22 ARG 55 5.868 -11.868 5.276
408 H TYR 56 HN TYR 56 8.949 -3.183 6.407
409 HA TYR 56 HA TYR 56 11.188 -4.900 5.660
410 HB2 TYR 56 HB2 TYR 56 9.463 -3.071 4.035
411 HB3 TYR 56 HB1 TYR 56 11.009 -3.660 3.424
412 HD1 TYR 56 HD2 TYR 56 11.324 -6.118 3.017
413 HD2 TYR 56 HD1 TYR 56 7.585 -4.482 4.214
414 HE1 TYR 56 HE2 TYR 56 10.182 -8.174 2.275
415 HE2 TYR 56 HE1 TYR 56 6.445 -6.512 3.487
416 HH TYR 56 HH TYR 56 8.055 -9.419 2.632
417 H GLY 57 HN GLY 57 10.865 -2.116 7.314
418 HA2 GLY 57 HA2 GLY 57 12.425 -0.588 8.012
419 HA3 GLY 57 HA1 GLY 57 13.641 -1.566 7.201
420 H VAL 58 HN VAL 58 10.866 0.285 6.037
421 HA VAL 58 HA VAL 58 12.742 1.751 4.353
422 HB VAL 58 HB VAL 58 11.009 2.006 2.574
423 HG11 VAL 58 HG11 VAL 58 11.191 -0.248 1.665
424 HG12 VAL 58 HG12 VAL 58 11.705 -0.838 3.242
425 HG13 VAL 58 HG13 VAL 58 12.719 0.307 2.354
426 HG21 VAL 58 HG21 VAL 58 9.008 1.626 3.926
427 HG22 VAL 58 HG22 VAL 58 9.483 -0.066 4.150
428 HG23 VAL 58 HG23 VAL 58 9.062 0.528 2.546
429 H SER 59 HN SER 59 11.482 3.822 3.376
430 HA SER 59 HA SER 59 10.061 5.059 5.570
431 HB2 SER 59 HB2 SER 59 12.488 6.249 4.190
432 HB3 SER 59 HB1 SER 59 11.519 7.021 5.449
433 HG SER 59 HG SER 59 12.130 4.805 6.528
434 H ILE 60 HN ILE 60 8.247 5.499 4.658
435 HA ILE 60 HA ILE 60 8.169 6.491 1.882
436 HB ILE 60 HB ILE 60 6.068 4.969 3.456
437 HG12 ILE 60 HG12 ILE 60 7.631 4.141 0.996
438 HG13 ILE 60 HG11 ILE 60 7.966 3.596 2.634
439 HG21 ILE 60 HG21 ILE 60 4.735 4.981 1.394
440 HG22 ILE 60 HG22 ILE 60 5.942 6.016 0.629
441 HG23 ILE 60 HG23 ILE 60 5.014 6.611 2.004
442 HD11 ILE 60 HD11 ILE 60 5.445 3.071 1.076
443 HD12 ILE 60 HD12 ILE 60 5.780 2.514 2.716
444 HD13 ILE 60 HD13 ILE 60 6.748 1.920 1.367
445 HA PRO 61 HA PRO 61 6.883 10.221 4.032
446 HB2 PRO 61 HB2 PRO 61 6.317 11.123 1.264
447 HB3 PRO 61 HB1 PRO 61 7.332 11.875 2.498
448 HG2 PRO 61 HG2 PRO 61 8.420 10.642 0.392
449 HG3 PRO 61 HG1 PRO 61 9.160 10.546 2.000
450 HD2 PRO 61 HD2 PRO 61 7.501 8.519 0.554
451 HD3 PRO 61 HD1 PRO 61 8.951 8.284 1.554
452 H ASP 62 HN ASP 62 5.005 10.636 4.816
453 HA ASP 62 HA ASP 62 2.728 9.138 4.632
454 HB2 ASP 62 HB2 ASP 62 2.877 12.058 5.380
455 HB3 ASP 62 HB1 ASP 62 1.504 11.013 5.694
456 H ASP 63 HN ASP 63 3.129 12.318 3.204
457 HA ASP 63 HA ASP 63 0.557 12.521 2.102
458 HB2 ASP 63 HB2 ASP 63 3.061 13.948 1.199
459 HB3 ASP 63 HB1 ASP 63 1.408 14.438 0.849
460 H VAL 64 HN VAL 64 3.320 10.865 0.949
461 HA VAL 64 HA VAL 64 2.666 10.896 -1.834
462 HB VAL 64 HB VAL 64 4.436 9.038 -0.260
463 HG11 VAL 64 HG11 VAL 64 3.845 8.068 -2.455
464 HG12 VAL 64 HG12 VAL 64 5.542 8.545 -2.445
465 HG13 VAL 64 HG13 VAL 64 4.346 9.555 -3.259
466 HG21 VAL 64 HG21 VAL 64 6.295 10.426 -1.044
467 HG22 VAL 64 HG22 VAL 64 5.124 11.370 -0.108
468 HG23 VAL 64 HG23 VAL 64 5.149 11.483 -1.864
469 H ALA 65 HN ALA 65 1.555 9.098 0.875
470 HA ALA 65 HA ALA 65 0.620 6.877 -0.684
471 HB1 ALA 65 HB1 ALA 65 -0.430 6.105 1.372
472 HB2 ALA 65 HB2 ALA 65 -0.106 7.660 2.137
473 HB3 ALA 65 HB3 ALA 65 1.235 6.602 1.688
474 H GLY 66 HN GLY 66 -0.326 9.998 -0.522
475 HA2 GLY 66 HA2 GLY 66 -3.169 9.405 -0.820
476 HA3 GLY 66 HA1 GLY 66 -2.452 11.008 -0.672
477 H ARG 67 HN ARG 67 -0.418 9.642 -2.716
478 HA ARG 67 HA ARG 67 -1.982 10.590 -5.007
479 HB2 ARG 67 HB2 ARG 67 0.163 11.101 -6.107
480 HB3 ARG 67 HB1 ARG 67 -0.123 12.042 -4.649
481 HG2 ARG 67 HG2 ARG 67 1.346 10.213 -3.528
482 HG3 ARG 67 HG1 ARG 67 1.851 9.864 -5.183
483 HD2 ARG 67 HD2 ARG 67 3.410 11.416 -4.190
484 HD3 ARG 67 HD1 ARG 67 2.489 12.242 -5.451
485 HE ARG 67 HE ARG 67 1.034 12.923 -3.356
486 HH11 ARG 67 HH11 ARG 67 4.596 12.802 -3.460
487 HH12 ARG 67 HH12 ARG 67 4.759 14.059 -2.322
488 HH21 ARG 67 HH21 ARG 67 1.283 14.600 -1.863
489 HH22 ARG 67 HH22 ARG 67 2.827 15.135 -1.400
490 H VAL 68 HN VAL 68 -1.479 7.837 -3.742
491 HA VAL 68 HA VAL 68 -0.747 6.521 -6.229
492 HB VAL 68 HB VAL 68 -0.651 4.409 -4.819
493 HG11 VAL 68 HG11 VAL 68 1.158 6.673 -3.974
494 HG12 VAL 68 HG12 VAL 68 1.373 5.628 -5.378
495 HG13 VAL 68 HG13 VAL 68 1.497 4.956 -3.752
496 HG21 VAL 68 HG21 VAL 68 -2.077 5.130 -2.952
497 HG22 VAL 68 HG22 VAL 68 -0.882 6.348 -2.503
498 HG23 VAL 68 HG23 VAL 68 -0.487 4.632 -2.375
499 H ASP 69 HN ASP 69 -2.393 6.345 -7.465
500 HA ASP 69 HA ASP 69 -5.102 6.353 -6.492
501 HB2 ASP 69 HB2 ASP 69 -4.006 5.983 -9.285
502 HB3 ASP 69 HB1 ASP 69 -5.720 6.028 -8.906
503 H THR 70 HN THR 70 -3.012 3.999 -8.020
504 HA THR 70 HA THR 70 -4.975 1.915 -7.383
505 HB THR 70 HB THR 70 -3.716 0.537 -9.031
506 HG1 THR 70 HG1 THR 70 -2.469 2.915 -9.898
507 HG21 THR 70 HG21 THR 70 -5.713 1.725 -9.790
508 HG22 THR 70 HG22 THR 70 -4.504 1.694 -11.074
509 HG23 THR 70 HG23 THR 70 -4.750 3.163 -10.129
510 HA PRO 71 HA PRO 71 -2.027 0.135 -4.492
511 HB2 PRO 71 HB2 PRO 71 -2.858 -2.478 -5.647
512 HB3 PRO 71 HB1 PRO 71 -2.886 -1.939 -3.963
513 HG2 PRO 71 HG2 PRO 71 -5.148 -2.124 -5.310
514 HG3 PRO 71 HG1 PRO 71 -4.857 -0.727 -4.251
515 HD2 PRO 71 HD2 PRO 71 -4.610 -0.925 -7.231
516 HD3 PRO 71 HD1 PRO 71 -5.372 0.348 -6.249
517 H ARG 72 HN ARG 72 -2.120 -0.536 -7.836
518 HA ARG 72 HA ARG 72 0.231 -2.010 -8.258
519 HB2 ARG 72 HB2 ARG 72 -1.508 -1.665 -9.938
520 HB3 ARG 72 HB1 ARG 72 -1.159 0.054 -9.971
521 HG2 ARG 72 HG2 ARG 72 1.102 -0.480 -10.831
522 HG3 ARG 72 HG1 ARG 72 0.617 -2.178 -10.909
523 HD2 ARG 72 HD2 ARG 72 -0.695 0.120 -12.349
524 HD3 ARG 72 HD1 ARG 72 0.348 -1.104 -13.073
525 HE ARG 72 HE ARG 72 -1.372 -2.738 -12.381
526 HH11 ARG 72 HH11 ARG 72 -2.285 0.672 -12.870
527 HH12 ARG 72 HH12 ARG 72 -3.878 0.315 -13.352
528 HH21 ARG 72 HH21 ARG 72 -3.640 -3.197 -12.961
529 HH22 ARG 72 HH22 ARG 72 -4.661 -1.892 -13.385
530 H GLU 73 HN GLU 73 -0.522 1.425 -8.373
531 HA GLU 73 HA GLU 73 2.068 2.421 -8.835
532 HB2 GLU 73 HB2 GLU 73 -0.024 3.523 -9.442
533 HB3 GLU 73 HB1 GLU 73 -0.450 3.669 -7.756
534 HG2 GLU 73 HG2 GLU 73 1.231 5.316 -7.408
535 HG3 GLU 73 HG1 GLU 73 1.918 5.021 -9.014
536 H LEU 74 HN LEU 74 0.182 1.775 -5.965
537 HA LEU 74 HA LEU 74 1.936 2.978 -4.071
538 HB2 LEU 74 HB2 LEU 74 -0.536 2.202 -3.810
539 HB3 LEU 74 HB1 LEU 74 0.126 0.614 -3.521
540 HG LEU 74 HG LEU 74 0.616 3.062 -1.800
541 HD11 LEU 74 HD11 LEU 74 -0.829 1.961 -0.175
542 HD12 LEU 74 HD12 LEU 74 -1.154 0.680 -1.344
543 HD13 LEU 74 HD13 LEU 74 -1.679 2.331 -1.675
544 HD21 LEU 74 HD21 LEU 74 1.315 0.168 -1.296
545 HD22 LEU 74 HD22 LEU 74 1.539 1.498 -0.160
546 HD23 LEU 74 HD23 LEU 74 2.463 1.453 -1.662
547 H LEU 75 HN LEU 75 1.555 -0.328 -5.321
548 HA LEU 75 HA LEU 75 3.506 -1.693 -3.900
549 HB2 LEU 75 HB2 LEU 75 1.825 -2.722 -5.397
550 HB3 LEU 75 HB1 LEU 75 2.659 -2.055 -6.781
551 HG LEU 75 HG LEU 75 4.629 -3.475 -6.192
552 HD11 LEU 75 HD11 LEU 75 2.706 -4.708 -4.237
553 HD12 LEU 75 HD12 LEU 75 4.163 -3.797 -3.838
554 HD13 LEU 75 HD13 LEU 75 4.292 -5.346 -4.668
555 HD21 LEU 75 HD21 LEU 75 3.048 -4.147 -7.917
556 HD22 LEU 75 HD22 LEU 75 2.027 -4.912 -6.700
557 HD23 LEU 75 HD23 LEU 75 3.639 -5.551 -7.028
558 H ASP 76 HN ASP 76 3.718 0.000 -6.981
559 HA ASP 76 HA ASP 76 6.384 -0.314 -7.636
560 HB2 ASP 76 HB2 ASP 76 4.968 0.708 -9.220
561 HB3 ASP 76 HB1 ASP 76 4.502 1.982 -8.100
562 H LEU 77 HN LEU 77 4.962 2.249 -5.666
563 HA LEU 77 HA LEU 77 7.237 3.739 -5.098
564 HB2 LEU 77 HB2 LEU 77 5.083 4.576 -4.536
565 HB3 LEU 77 HB1 LEU 77 4.746 3.210 -3.497
566 HG LEU 77 HG LEU 77 6.472 4.021 -1.919
567 HD11 LEU 77 HD11 LEU 77 7.868 5.282 -3.455
568 HD12 LEU 77 HD12 LEU 77 7.342 6.270 -2.100
569 HD13 LEU 77 HD13 LEU 77 6.575 6.465 -3.680
570 HD21 LEU 77 HD21 LEU 77 4.287 5.979 -2.585
571 HD22 LEU 77 HD22 LEU 77 5.148 5.871 -1.049
572 HD23 LEU 77 HD23 LEU 77 4.129 4.534 -1.585
573 H ILE 78 HN ILE 78 5.874 1.013 -3.293
574 HA ILE 78 HA ILE 78 7.917 1.072 -1.325
575 HB ILE 78 HB ILE 78 6.136 -1.293 -1.981
576 HG12 ILE 78 HG12 ILE 78 5.710 1.010 -0.061
577 HG13 ILE 78 HG11 ILE 78 4.787 0.699 -1.528
578 HG21 ILE 78 HG21 ILE 78 8.067 -1.836 -0.575
579 HG22 ILE 78 HG22 ILE 78 6.584 -1.886 0.383
580 HG23 ILE 78 HG23 ILE 78 7.667 -0.503 0.509
581 HD11 ILE 78 HD11 ILE 78 4.886 -1.064 0.904
582 HD12 ILE 78 HD12 ILE 78 3.946 -1.373 -0.555
583 HD13 ILE 78 HD13 ILE 78 3.570 0.020 0.462
584 H ASN 79 HN ASN 79 7.414 -0.894 -4.243
585 HA ASN 79 HA ASN 79 9.694 -2.517 -3.895
586 HB2 ASN 79 HB2 ASN 79 8.323 -1.717 -6.475
587 HB3 ASN 79 HB1 ASN 79 9.623 -2.887 -6.388
588 HD21 ASN 79 HD21 ASN 79 8.532 -3.977 -3.816
589 HD22 ASN 79 HD22 ASN 79 7.168 -4.935 -4.294
590 H GLY 80 HN GLY 80 9.321 0.686 -5.244
591 HA2 GLY 80 HA2 GLY 80 11.899 0.986 -6.309
592 HA3 GLY 80 HA1 GLY 80 10.864 2.289 -5.732
593 H ALA 81 HN ALA 81 10.607 1.784 -3.118
594 HA ALA 81 HA ALA 81 13.069 2.657 -2.021
595 HB1 ALA 81 HB1 ALA 81 10.659 1.528 -0.583
596 HB2 ALA 81 HB2 ALA 81 10.897 3.222 -1.017
597 HB3 ALA 81 HB3 ALA 81 11.964 2.455 0.158
598 H LEU 82 HN LEU 82 11.463 -0.459 -2.096
599 HA LEU 82 HA LEU 82 13.303 -1.823 -0.451
600 HB2 LEU 82 HB2 LEU 82 11.263 -2.789 -2.410
601 HB3 LEU 82 HB1 LEU 82 12.285 -3.886 -1.499
602 HG LEU 82 HG LEU 82 10.402 -1.881 -0.261
603 HD11 LEU 82 HD11 LEU 82 9.049 -3.828 0.287
604 HD12 LEU 82 HD12 LEU 82 10.187 -4.858 -0.587
605 HD13 LEU 82 HD13 LEU 82 9.231 -3.648 -1.462
606 HD21 LEU 82 HD21 LEU 82 12.337 -2.410 1.117
607 HD22 LEU 82 HD22 LEU 82 12.021 -4.133 0.911
608 HD23 LEU 82 HD23 LEU 82 10.867 -3.121 1.784
609 H ALA 83 HN ALA 83 13.519 -0.884 -3.716
610 HA ALA 83 HA ALA 83 15.374 -2.876 -4.543
611 HB1 ALA 83 HB1 ALA 83 15.900 -1.347 -6.393
612 HB2 ALA 83 HB2 ALA 83 15.003 -0.061 -5.587
613 HB3 ALA 83 HB3 ALA 83 14.157 -1.496 -6.171
614 H GLU 84 HN GLU 84 15.561 -0.041 -2.615
615 HA GLU 84 HA GLU 84 18.476 0.095 -2.740
616 HB2 GLU 84 HB2 GLU 84 16.543 1.733 -1.089
617 HB3 GLU 84 HB1 GLU 84 18.243 2.076 -1.356
618 HG2 GLU 84 HG2 GLU 84 16.042 2.181 -3.404
619 HG3 GLU 84 HG1 GLU 84 16.835 3.557 -2.649
620 H ALA 85 HN ALA 85 16.120 -1.605 -1.130
621 HA ALA 85 HA ALA 85 17.457 -1.584 1.456
622 HB1 ALA 85 HB1 ALA 85 15.036 -1.216 1.449
623 HB2 ALA 85 HB2 ALA 85 15.460 -2.708 2.290
624 HB3 ALA 85 HB3 ALA 85 14.801 -2.774 0.657
625 H ALA 86 HN ALA 86 18.466 -3.291 2.241
626 HA ALA 86 HA ALA 86 18.184 -5.930 1.235
627 HB1 ALA 86 HB1 ALA 86 20.536 -6.196 0.520
628 HB2 ALA 86 HB2 ALA 86 20.796 -4.466 0.751
629 HB3 ALA 86 HB3 ALA 86 19.691 -5.032 -0.502
630 H28 SXV 87 H28A SXV 87 -3.664 12.213 2.241
631 H28A SXV 87 H28B SXV 87 -4.597 13.361 1.288
632 H30 SXV 87 H30C SXV 87 -4.902 13.476 4.864
633 H30A SXV 87 H30A SXV 87 -3.500 14.488 5.213
634 H30B SXV 87 H30B SXV 87 -3.274 12.815 4.700
635 H31 SXV 87 H31C SXV 87 -1.998 15.241 3.299
636 H31A SXV 87 H31A SXV 87 -2.372 14.702 1.662
637 H31B SXV 87 H31B SXV 87 -1.800 13.543 2.861
638 H32 SXV 87 H32A SXV 87 -5.716 15.287 3.302
639 HO33 SXV 87 H33A SXV 87 -3.918 16.023 1.217
640 HN36 SXV 87 H36A SXV 87 -4.348 17.680 1.969
641 H37 SXV 87 H37B SXV 87 -2.918 18.813 4.274
642 H37A SXV 87 H37A SXV 87 -4.210 19.735 3.535
643 H38 SXV 87 H38B SXV 87 -2.895 19.949 1.500
644 H38A SXV 87 H38A SXV 87 -1.798 18.671 2.087
645 HN41 SXV 87 H41A SXV 87 -0.356 20.306 1.321
646 H42 SXV 87 H42B SXV 87 0.878 21.557 3.594
647 H42A SXV 87 H42A SXV 87 0.375 22.675 2.326
648 H43 SXV 87 H43B SXV 87 2.171 20.290 1.946
649 H43A SXV 87 H43A SXV 87 1.736 21.467 0.714
650 H1 SXV 87 H1B SXV 87 4.205 21.921 0.084
651 H1A SXV 87 H1A SXV 87 5.494 22.300 1.240
652 H2 SXV 87 H2A SXV 87 4.060 19.670 1.196
653 H2A SXV 87 H2B SXV 87 5.371 20.167 2.250
654 H4 SXV 87 H4C SXV 87 6.945 21.603 -0.297
655 H4A SXV 87 H4A SXV 87 7.839 20.136 -0.716
656 H4B SXV 87 H4B SXV 87 7.768 20.678 0.967
Start of MODEL 16
1 H1 MET 1 HT1 MET 1 20.986 -6.958 -2.185
2 H2 MET 1 HT2 MET 1 21.655 -8.481 -2.409
3 H3 MET 1 HT3 MET 1 20.866 -8.071 -0.966
4 HA MET 1 HA MET 1 19.445 -8.007 -3.520
5 HB2 MET 1 HB2 MET 1 19.506 -10.264 -1.487
6 HB3 MET 1 HB1 MET 1 18.306 -10.122 -2.760
7 HG2 MET 1 HG2 MET 1 20.091 -10.297 -4.440
8 HG3 MET 1 HG1 MET 1 21.271 -10.470 -3.145
9 HE1 MET 1 HE1 MET 1 21.103 -14.062 -4.756
10 HE2 MET 1 HE2 MET 1 22.148 -12.706 -4.331
11 HE3 MET 1 HE3 MET 1 20.932 -12.521 -5.596
12 H ALA 2 HN ALA 2 17.114 -7.948 -3.130
13 HA ALA 2 HA ALA 2 16.457 -6.831 -0.502
14 HB1 ALA 2 HB1 ALA 2 16.713 -5.003 -2.108
15 HB2 ALA 2 HB2 ALA 2 15.027 -5.176 -1.621
16 HB3 ALA 2 HB3 ALA 2 15.560 -5.783 -3.190
17 H THR 3 HN THR 3 14.357 -7.234 0.178
18 HA THR 3 HA THR 3 13.069 -9.539 -1.065
19 HB THR 3 HB THR 3 12.383 -8.061 1.416
20 HG1 THR 3 HG1 THR 3 14.619 -9.224 1.070
21 HG21 THR 3 HG21 THR 3 10.633 -9.555 0.620
22 HG22 THR 3 HG22 THR 3 11.341 -10.216 2.095
23 HG23 THR 3 HG23 THR 3 11.785 -10.887 0.526
24 H LEU 4 HN LEU 4 11.753 -8.847 -2.730
25 HA LEU 4 HA LEU 4 10.323 -6.345 -2.452
26 HB2 LEU 4 HB2 LEU 4 10.285 -8.358 -4.698
27 HB3 LEU 4 HB1 LEU 4 9.539 -6.774 -4.731
28 HG LEU 4 HG LEU 4 12.499 -7.331 -4.598
29 HD11 LEU 4 HD11 LEU 4 11.541 -7.841 -6.763
30 HD12 LEU 4 HD12 LEU 4 12.526 -6.379 -6.850
31 HD13 LEU 4 HD13 LEU 4 10.769 -6.256 -6.813
32 HD21 LEU 4 HD21 LEU 4 12.762 -4.913 -4.899
33 HD22 LEU 4 HD22 LEU 4 11.923 -5.286 -3.393
34 HD23 LEU 4 HD23 LEU 4 11.013 -4.707 -4.786
35 H LEU 5 HN LEU 5 8.468 -6.277 -1.483
36 HA LEU 5 HA LEU 5 6.996 -8.663 -0.987
37 HB2 LEU 5 HB2 LEU 5 5.423 -7.264 0.270
38 HB3 LEU 5 HB1 LEU 5 7.071 -7.007 0.769
39 HG LEU 5 HG LEU 5 6.982 -4.860 -0.656
40 HD11 LEU 5 HD11 LEU 5 4.948 -5.341 -1.917
41 HD12 LEU 5 HD12 LEU 5 4.775 -3.870 -0.962
42 HD13 LEU 5 HD13 LEU 5 4.017 -5.368 -0.419
43 HD21 LEU 5 HD21 LEU 5 7.031 -4.841 1.734
44 HD22 LEU 5 HD22 LEU 5 5.311 -5.198 1.803
45 HD23 LEU 5 HD23 LEU 5 5.856 -3.644 1.182
46 H THR 6 HN THR 6 4.962 -9.174 -1.704
47 HA THR 6 HA THR 6 4.399 -7.959 -4.285
48 HB THR 6 HB THR 6 3.328 -10.133 -4.884
49 HG1 THR 6 HG1 THR 6 4.242 -10.781 -2.273
50 HG21 THR 6 HG21 THR 6 5.448 -11.332 -5.230
51 HG22 THR 6 HG22 THR 6 6.234 -10.266 -4.067
52 HG23 THR 6 HG23 THR 6 5.616 -9.613 -5.586
53 H THR 7 HN THR 7 1.976 -8.999 -4.807
54 HA THR 7 HA THR 7 0.087 -7.291 -3.871
55 HB THR 7 HB THR 7 -1.411 -9.291 -4.597
56 HG1 THR 7 HG1 THR 7 -0.162 -11.095 -4.768
57 HG21 THR 7 HG21 THR 7 0.636 -8.063 -6.453
58 HG22 THR 7 HG22 THR 7 -0.901 -7.326 -5.983
59 HG23 THR 7 HG23 THR 7 -0.886 -8.803 -6.945
60 H ASP 8 HN ASP 8 0.632 -10.636 -2.841
61 HA ASP 8 HA ASP 8 -1.384 -10.823 -0.918
62 HB2 ASP 8 HB2 ASP 8 1.240 -12.341 -1.012
63 HB3 ASP 8 HB1 ASP 8 -0.253 -12.865 -0.244
64 H ASP 9 HN ASP 9 1.971 -9.894 -0.732
65 HA ASP 9 HA ASP 9 2.159 -9.699 2.093
66 HB2 ASP 9 HB2 ASP 9 3.764 -8.222 -0.012
67 HB3 ASP 9 HB1 ASP 9 4.169 -8.327 1.692
68 H LEU 10 HN LEU 10 1.557 -7.398 -0.466
69 HA LEU 10 HA LEU 10 1.278 -5.086 1.086
70 HB2 LEU 10 HB2 LEU 10 1.669 -4.982 -1.289
71 HB3 LEU 10 HB1 LEU 10 0.172 -5.823 -1.620
72 HG LEU 10 HG LEU 10 -1.102 -3.870 -0.846
73 HD11 LEU 10 HD11 LEU 10 0.035 -1.768 -0.363
74 HD12 LEU 10 HD12 LEU 10 1.594 -2.582 -0.483
75 HD13 LEU 10 HD13 LEU 10 0.467 -3.018 0.799
76 HD21 LEU 10 HD21 LEU 10 -0.523 -2.361 -2.683
77 HD22 LEU 10 HD22 LEU 10 -0.504 -4.042 -3.209
78 HD23 LEU 10 HD23 LEU 10 1.011 -3.202 -2.892
79 H ARG 11 HN ARG 11 -1.153 -7.391 -0.089
80 HA ARG 11 HA ARG 11 -3.385 -5.940 0.753
81 HB2 ARG 11 HB2 ARG 11 -4.730 -7.819 0.263
82 HB3 ARG 11 HB1 ARG 11 -3.343 -7.997 -0.794
83 HG2 ARG 11 HG2 ARG 11 -2.397 -9.662 0.624
84 HG3 ARG 11 HG1 ARG 11 -3.696 -9.439 1.799
85 HD2 ARG 11 HD2 ARG 11 -5.318 -10.129 0.084
86 HD3 ARG 11 HD1 ARG 11 -3.980 -10.424 -1.031
87 HE ARG 11 HE ARG 11 -4.349 -11.813 1.521
88 HH11 ARG 11 HH11 ARG 11 -3.529 -11.851 -1.907
89 HH12 ARG 11 HH12 ARG 11 -2.875 -13.431 -1.884
90 HH21 ARG 11 HH21 ARG 11 -3.643 -14.037 1.511
91 HH22 ARG 11 HH22 ARG 11 -3.035 -14.743 0.086
92 H ARG 12 HN ARG 12 -1.363 -8.191 2.537
93 HA ARG 12 HA ARG 12 -3.053 -8.485 4.772
94 HB2 ARG 12 HB2 ARG 12 -0.047 -8.590 4.659
95 HB3 ARG 12 HB1 ARG 12 -0.993 -9.045 6.066
96 HG2 ARG 12 HG2 ARG 12 -2.057 -10.819 4.738
97 HG3 ARG 12 HG1 ARG 12 -1.034 -10.382 3.368
98 HD2 ARG 12 HD2 ARG 12 -0.116 -11.390 6.063
99 HD3 ARG 12 HD1 ARG 12 -0.067 -12.270 4.535
100 HE ARG 12 HE ARG 12 1.499 -9.837 5.065
101 HH11 ARG 12 HH11 ARG 12 1.364 -13.178 3.864
102 HH12 ARG 12 HH12 ARG 12 2.869 -13.113 3.090
103 HH21 ARG 12 HH21 ARG 12 3.568 -9.757 4.091
104 HH22 ARG 12 HH22 ARG 12 4.166 -11.063 3.162
105 H ALA 13 HN ALA 13 -0.804 -5.937 3.909
106 HA ALA 13 HA ALA 13 -0.929 -4.713 6.536
107 HB1 ALA 13 HB1 ALA 13 0.410 -2.937 5.568
108 HB2 ALA 13 HB2 ALA 13 0.192 -3.634 3.962
109 HB3 ALA 13 HB3 ALA 13 1.096 -4.517 5.194
110 H LEU 14 HN LEU 14 -2.461 -4.457 3.475
111 HA LEU 14 HA LEU 14 -3.761 -1.989 3.874
112 HB2 LEU 14 HB2 LEU 14 -3.469 -3.544 1.749
113 HB3 LEU 14 HB1 LEU 14 -4.962 -4.265 2.311
114 HG LEU 14 HG LEU 14 -6.075 -2.074 2.117
115 HD11 LEU 14 HD11 LEU 14 -3.445 -1.196 0.931
116 HD12 LEU 14 HD12 LEU 14 -4.126 -0.659 2.467
117 HD13 LEU 14 HD13 LEU 14 -4.937 -0.253 0.953
118 HD21 LEU 14 HD21 LEU 14 -6.117 -1.982 -0.318
119 HD22 LEU 14 HD22 LEU 14 -6.149 -3.651 0.252
120 HD23 LEU 14 HD23 LEU 14 -4.655 -2.965 -0.387
121 H VAL 15 HN VAL 15 -4.537 -5.349 4.532
122 HA VAL 15 HA VAL 15 -6.980 -5.131 5.885
123 HB VAL 15 HB VAL 15 -4.674 -7.089 6.220
124 HG11 VAL 15 HG11 VAL 15 -6.227 -8.570 7.401
125 HG12 VAL 15 HG12 VAL 15 -7.453 -7.303 7.373
126 HG13 VAL 15 HG13 VAL 15 -5.965 -7.072 8.295
127 HG21 VAL 15 HG21 VAL 15 -5.771 -7.152 4.054
128 HG22 VAL 15 HG22 VAL 15 -7.340 -7.337 4.836
129 HG23 VAL 15 HG23 VAL 15 -6.129 -8.614 4.972
130 H GLU 16 HN GLU 16 -3.641 -5.001 7.121
131 HA GLU 16 HA GLU 16 -4.194 -4.589 9.838
132 HB2 GLU 16 HB2 GLU 16 -1.751 -3.660 8.278
133 HB3 GLU 16 HB1 GLU 16 -1.895 -3.690 10.023
134 HG2 GLU 16 HG2 GLU 16 -2.129 -6.096 9.996
135 HG3 GLU 16 HG1 GLU 16 -2.061 -6.098 8.236
136 H SER 17 HN SER 17 -4.743 -2.440 7.289
137 HA SER 17 HA SER 17 -4.619 -0.081 9.031
138 HB2 SER 17 HB2 SER 17 -5.114 -0.245 6.066
139 HB3 SER 17 HB1 SER 17 -4.697 1.191 7.009
140 HG SER 17 HG SER 17 -3.057 -1.112 6.786
141 H ALA 18 HN ALA 18 -6.764 -2.425 8.199
142 HA ALA 18 HA ALA 18 -9.059 -0.589 8.106
143 HB1 ALA 18 HB1 ALA 18 -10.279 -2.363 6.969
144 HB2 ALA 18 HB2 ALA 18 -8.867 -3.413 7.077
145 HB3 ALA 18 HB3 ALA 18 -8.804 -1.951 6.094
146 H GLY 19 HN GLY 19 -8.013 -3.760 9.319
147 HA2 GLY 19 HA2 GLY 19 -8.334 -4.527 11.513
148 HA3 GLY 19 HA1 GLY 19 -9.541 -3.272 11.761
149 H GLU 20 HN GLU 20 -11.336 -3.576 9.922
150 HA GLU 20 HA GLU 20 -12.386 -6.290 10.290
151 HB2 GLU 20 HB2 GLU 20 -13.770 -4.347 11.089
152 HB3 GLU 20 HB1 GLU 20 -13.844 -3.773 9.430
153 HG2 GLU 20 HG2 GLU 20 -14.939 -5.909 8.803
154 HG3 GLU 20 HG1 GLU 20 -14.981 -6.335 10.512
155 H THR 21 HN THR 21 -11.957 -7.555 8.605
156 HA THR 21 HA THR 21 -12.153 -6.467 5.904
157 HB THR 21 HB THR 21 -10.056 -7.913 5.418
158 HG1 THR 21 HG1 THR 21 -9.388 -8.825 7.217
159 HG21 THR 21 HG21 THR 21 -8.583 -5.981 5.865
160 HG22 THR 21 HG22 THR 21 -9.834 -5.274 6.888
161 HG23 THR 21 HG23 THR 21 -10.117 -5.477 5.158
162 H ASP 22 HN ASP 22 -14.066 -8.138 7.118
163 HA ASP 22 HA ASP 22 -13.537 -10.822 6.101
164 HB2 ASP 22 HB2 ASP 22 -16.073 -9.679 7.329
165 HB3 ASP 22 HB1 ASP 22 -15.888 -11.342 6.799
166 H GLY 23 HN GLY 23 -15.560 -8.050 5.470
167 HA2 GLY 23 HA2 GLY 23 -16.340 -9.197 2.885
168 HA3 GLY 23 HA1 GLY 23 -17.130 -7.844 3.698
169 H THR 24 HN THR 24 -13.799 -8.590 2.928
170 HA THR 24 HA THR 24 -13.628 -6.081 1.436
171 HB THR 24 HB THR 24 -11.450 -7.217 3.224
172 HG1 THR 24 HG1 THR 24 -13.360 -5.151 3.615
173 HG21 THR 24 HG21 THR 24 -10.647 -5.808 1.362
174 HG22 THR 24 HG22 THR 24 -10.415 -5.001 2.914
175 HG23 THR 24 HG23 THR 24 -11.748 -4.525 1.860
176 H ASP 25 HN ASP 25 -14.034 -7.443 -0.338
177 HA ASP 25 HA ASP 25 -12.242 -9.579 -0.977
178 HB2 ASP 25 HB2 ASP 25 -13.397 -9.808 -3.107
179 HB3 ASP 25 HB1 ASP 25 -14.594 -9.565 -1.850
180 H LEU 26 HN LEU 26 -10.300 -9.366 -1.560
181 HA LEU 26 HA LEU 26 -9.476 -7.078 -3.184
182 HB2 LEU 26 HB2 LEU 26 -9.100 -6.761 -0.709
183 HB3 LEU 26 HB1 LEU 26 -8.027 -8.142 -0.766
184 HG LEU 26 HG LEU 26 -6.596 -6.897 -2.349
185 HD11 LEU 26 HD11 LEU 26 -8.294 -5.377 -3.243
186 HD12 LEU 26 HD12 LEU 26 -6.943 -4.470 -2.560
187 HD13 LEU 26 HD13 LEU 26 -8.454 -4.619 -1.660
188 HD21 LEU 26 HD21 LEU 26 -5.679 -5.399 -0.652
189 HD22 LEU 26 HD22 LEU 26 -6.109 -6.971 0.027
190 HD23 LEU 26 HD23 LEU 26 -7.152 -5.575 0.299
191 H SER 27 HN SER 27 -8.398 -10.092 -1.604
192 HA SER 27 HA SER 27 -7.362 -11.953 -2.316
193 HB2 SER 27 HB2 SER 27 -9.375 -11.924 -3.856
194 HB3 SER 27 HB1 SER 27 -8.370 -11.152 -5.075
195 HG SER 27 HG SER 27 -8.109 -13.168 -5.618
196 H GLY 28 HN GLY 28 -5.959 -12.571 -4.657
197 HA2 GLY 28 HA2 GLY 28 -3.601 -10.892 -4.398
198 HA3 GLY 28 HA1 GLY 28 -3.715 -12.433 -5.255
199 H ASP 29 HN ASP 29 -2.787 -9.689 -5.996
200 HA ASP 29 HA ASP 29 -2.721 -8.276 -7.714
201 HB2 ASP 29 HB2 ASP 29 -4.188 -10.462 -9.199
202 HB3 ASP 29 HB1 ASP 29 -3.603 -8.990 -9.969
203 H PHE 30 HN PHE 30 -3.650 -6.582 -7.116
204 HA PHE 30 HA PHE 30 -6.433 -6.130 -7.817
205 HB2 PHE 30 HB2 PHE 30 -6.782 -5.092 -5.546
206 HB3 PHE 30 HB1 PHE 30 -6.621 -6.841 -5.536
207 HD1 PHE 30 HD2 PHE 30 -4.662 -7.895 -4.545
208 HD2 PHE 30 HD1 PHE 30 -5.106 -3.661 -4.539
209 HE1 PHE 30 HE2 PHE 30 -2.896 -7.715 -2.853
210 HE2 PHE 30 HE1 PHE 30 -3.340 -3.480 -2.836
211 HZ PHE 30 HZ PHE 30 -2.234 -5.508 -1.996
212 H LEU 31 HN LEU 31 -3.886 -5.303 -8.874
213 HA LEU 31 HA LEU 31 -3.166 -2.720 -7.859
214 HB2 LEU 31 HB2 LEU 31 -2.240 -4.393 -10.155
215 HB3 LEU 31 HB1 LEU 31 -1.788 -2.707 -10.074
216 HG LEU 31 HG LEU 31 -0.661 -3.103 -7.929
217 HD11 LEU 31 HD11 LEU 31 -0.250 -5.336 -7.119
218 HD12 LEU 31 HD12 LEU 31 -1.339 -5.994 -8.348
219 HD13 LEU 31 HD13 LEU 31 -1.968 -4.935 -7.078
220 HD21 LEU 31 HD21 LEU 31 0.206 -4.953 -10.136
221 HD22 LEU 31 HD22 LEU 31 1.209 -4.414 -8.792
222 HD23 LEU 31 HD23 LEU 31 0.613 -3.245 -9.974
223 H ASP 32 HN ASP 32 -5.480 -3.821 -10.009
224 HA ASP 32 HA ASP 32 -5.651 -1.285 -11.435
225 HB2 ASP 32 HB2 ASP 32 -7.339 -2.370 -12.826
226 HB3 ASP 32 HB1 ASP 32 -5.878 -3.348 -12.741
227 H LEU 33 HN LEU 33 -6.710 -2.353 -8.514
228 HA LEU 33 HA LEU 33 -9.427 -1.401 -8.678
229 HB2 LEU 33 HB2 LEU 33 -7.745 -2.217 -6.312
230 HB3 LEU 33 HB1 LEU 33 -9.389 -1.630 -6.167
231 HG LEU 33 HG LEU 33 -8.518 -4.164 -7.566
232 HD11 LEU 33 HD11 LEU 33 -9.703 -5.277 -5.760
233 HD12 LEU 33 HD12 LEU 33 -10.124 -3.722 -5.054
234 HD13 LEU 33 HD13 LEU 33 -8.441 -4.237 -5.092
235 HD21 LEU 33 HD21 LEU 33 -10.914 -4.590 -7.820
236 HD22 LEU 33 HD22 LEU 33 -10.430 -3.122 -8.675
237 HD23 LEU 33 HD23 LEU 33 -11.261 -3.005 -7.124
238 H ARG 34 HN ARG 34 -10.245 0.366 -7.423
239 HA ARG 34 HA ARG 34 -8.269 2.524 -7.205
240 HB2 ARG 34 HB2 ARG 34 -11.269 2.721 -7.559
241 HB3 ARG 34 HB1 ARG 34 -10.126 4.060 -7.560
242 HG2 ARG 34 HG2 ARG 34 -10.228 1.826 -9.541
243 HG3 ARG 34 HG1 ARG 34 -10.827 3.468 -9.820
244 HD2 ARG 34 HD2 ARG 34 -8.609 4.359 -9.576
245 HD3 ARG 34 HD1 ARG 34 -7.967 2.782 -9.126
246 HE ARG 34 HE ARG 34 -9.014 2.303 -11.536
247 HH11 ARG 34 HH11 ARG 34 -6.978 4.936 -10.400
248 HH12 ARG 34 HH12 ARG 34 -6.021 5.060 -11.771
249 HH21 ARG 34 HH21 ARG 34 -7.711 2.456 -13.555
250 HH22 ARG 34 HH22 ARG 34 -6.464 3.635 -13.624
251 H PHE 35 HN PHE 35 -7.984 3.392 -5.246
252 HA PHE 35 HA PHE 35 -8.928 1.989 -2.979
253 HB2 PHE 35 HB2 PHE 35 -7.590 4.684 -3.112
254 HB3 PHE 35 HB1 PHE 35 -7.793 3.703 -1.666
255 HD1 PHE 35 HD2 PHE 35 -6.797 1.302 -1.802
256 HD2 PHE 35 HD1 PHE 35 -5.671 4.542 -4.305
257 HE1 PHE 35 HE2 PHE 35 -4.649 0.199 -2.258
258 HE2 PHE 35 HE1 PHE 35 -3.542 3.453 -4.776
259 HZ PHE 35 HZ PHE 35 -3.016 1.277 -3.744
260 H GLU 36 HN GLU 36 -9.752 5.048 -4.444
261 HA GLU 36 HA GLU 36 -11.451 5.963 -2.381
262 HB2 GLU 36 HB2 GLU 36 -10.416 7.235 -4.390
263 HB3 GLU 36 HB1 GLU 36 -11.768 6.619 -5.315
264 HG2 GLU 36 HG2 GLU 36 -12.069 8.322 -2.845
265 HG3 GLU 36 HG1 GLU 36 -11.978 8.975 -4.473
266 H ASP 37 HN ASP 37 -11.906 3.980 -5.188
267 HA ASP 37 HA ASP 37 -14.745 3.820 -5.066
268 HB2 ASP 37 HB2 ASP 37 -13.582 3.495 -7.164
269 HB3 ASP 37 HB1 ASP 37 -12.720 2.113 -6.501
270 H ILE 38 HN ILE 38 -12.130 1.750 -3.862
271 HA ILE 38 HA ILE 38 -14.064 -0.191 -2.911
272 HB ILE 38 HB ILE 38 -12.160 -1.534 -2.098
273 HG12 ILE 38 HG12 ILE 38 -10.442 0.687 -3.253
274 HG13 ILE 38 HG11 ILE 38 -10.620 0.322 -1.545
275 HG21 ILE 38 HG21 ILE 38 -12.984 -1.851 -4.326
276 HG22 ILE 38 HG22 ILE 38 -11.221 -2.044 -4.319
277 HG23 ILE 38 HG23 ILE 38 -11.957 -0.545 -4.917
278 HD11 ILE 38 HD11 ILE 38 -9.568 -1.852 -1.895
279 HD12 ILE 38 HD12 ILE 38 -8.522 -0.535 -2.428
280 HD13 ILE 38 HD13 ILE 38 -9.404 -1.498 -3.613
281 H GLY 39 HN GLY 39 -13.863 2.504 -1.783
282 HA2 GLY 39 HA2 GLY 39 -14.407 3.450 0.265
283 HA3 GLY 39 HA1 GLY 39 -14.644 1.815 0.858
284 H TYR 40 HN TYR 40 -11.697 3.255 -0.411
285 HA TYR 40 HA TYR 40 -10.470 2.887 2.217
286 HB2 TYR 40 HB2 TYR 40 -9.648 2.051 -0.447
287 HB3 TYR 40 HB1 TYR 40 -8.413 2.967 0.403
288 HD1 TYR 40 HD2 TYR 40 -10.542 -0.039 0.555
289 HD2 TYR 40 HD1 TYR 40 -7.209 2.040 2.162
290 HE1 TYR 40 HE2 TYR 40 -9.899 -2.055 1.784
291 HE2 TYR 40 HE1 TYR 40 -6.515 0.088 3.388
292 HH TYR 40 HH TYR 40 -7.468 -2.038 4.228
293 H ASP 41 HN ASP 41 -10.390 4.865 3.063
294 HA ASP 41 HA ASP 41 -9.719 7.178 1.509
295 HB2 ASP 41 HB2 ASP 41 -9.671 6.663 4.500
296 HB3 ASP 41 HB1 ASP 41 -9.129 8.181 3.803
297 H SER 42 HN SER 42 -7.665 8.213 1.455
298 HA SER 42 HA SER 42 -5.593 6.250 1.342
299 HB2 SER 42 HB2 SER 42 -4.162 8.104 0.501
300 HB3 SER 42 HB1 SER 42 -5.673 7.946 -0.395
301 H LEU 43 HN LEU 43 -6.792 8.185 3.694
302 HA LEU 43 HA LEU 43 -4.522 8.584 5.352
303 HB2 LEU 43 HB2 LEU 43 -7.418 8.204 6.125
304 HB3 LEU 43 HB1 LEU 43 -6.166 8.860 7.159
305 HG LEU 43 HG LEU 43 -7.161 10.154 4.619
306 HD11 LEU 43 HD11 LEU 43 -8.193 11.790 6.104
307 HD12 LEU 43 HD12 LEU 43 -7.680 10.840 7.500
308 HD13 LEU 43 HD13 LEU 43 -8.849 10.173 6.361
309 HD21 LEU 43 HD21 LEU 43 -5.269 11.155 6.745
310 HD22 LEU 43 HD22 LEU 43 -5.867 12.093 5.377
311 HD23 LEU 43 HD23 LEU 43 -4.828 10.693 5.103
312 H ALA 44 HN ALA 44 -6.578 5.853 4.647
313 HA ALA 44 HA ALA 44 -5.568 4.226 6.786
314 HB1 ALA 44 HB1 ALA 44 -7.047 3.457 4.256
315 HB2 ALA 44 HB2 ALA 44 -7.786 3.775 5.823
316 HB3 ALA 44 HB3 ALA 44 -6.719 2.385 5.618
317 H LEU 45 HN LEU 45 -4.967 4.783 3.393
318 HA LEU 45 HA LEU 45 -3.148 2.764 2.895
319 HB2 LEU 45 HB2 LEU 45 -3.306 5.527 1.698
320 HB3 LEU 45 HB1 LEU 45 -2.291 4.252 1.063
321 HG LEU 45 HG LEU 45 -5.292 4.085 1.258
322 HD11 LEU 45 HD11 LEU 45 -4.568 5.817 -0.319
323 HD12 LEU 45 HD12 LEU 45 -5.234 4.416 -1.163
324 HD13 LEU 45 HD13 LEU 45 -3.489 4.657 -1.092
325 HD21 LEU 45 HD21 LEU 45 -3.233 2.408 -0.125
326 HD22 LEU 45 HD22 LEU 45 -4.976 2.174 -0.212
327 HD23 LEU 45 HD23 LEU 45 -4.128 1.938 1.324
328 H MET 46 HN MET 46 -2.742 6.013 4.173
329 HA MET 46 HA MET 46 0.071 6.187 4.303
330 HB2 MET 46 HB2 MET 46 -2.010 7.465 6.087
331 HB3 MET 46 HB1 MET 46 -0.311 7.899 6.080
332 HG2 MET 46 HG2 MET 46 -0.486 8.716 3.793
333 HG3 MET 46 HG1 MET 46 -2.150 8.140 3.716
334 HE1 MET 46 HE1 MET 46 -2.548 12.035 3.701
335 HE2 MET 46 HE2 MET 46 -2.888 10.528 2.849
336 HE3 MET 46 HE3 MET 46 -1.230 11.112 2.977
337 H GLU 47 HN GLU 47 -2.194 4.457 6.242
338 HA GLU 47 HA GLU 47 -0.307 4.007 8.389
339 HB2 GLU 47 HB2 GLU 47 -2.807 4.321 8.729
340 HB3 GLU 47 HB1 GLU 47 -3.034 2.763 7.956
341 HG2 GLU 47 HG2 GLU 47 -1.750 1.695 9.720
342 HG3 GLU 47 HG1 GLU 47 -1.495 3.262 10.489
343 H THR 48 HN THR 48 -1.834 2.355 5.666
344 HA THR 48 HA THR 48 -0.886 -0.240 5.859
345 HB THR 48 HB THR 48 -1.107 1.442 3.342
346 HG1 THR 48 HG1 THR 48 -2.964 0.491 5.113
347 HG21 THR 48 HG21 THR 48 -1.634 -0.692 2.243
348 HG22 THR 48 HG22 THR 48 -1.408 -1.536 3.773
349 HG23 THR 48 HG23 THR 48 -0.035 -0.748 2.991
350 H ALA 49 HN ALA 49 0.549 2.512 4.154
351 HA ALA 49 HA ALA 49 2.918 1.294 3.371
352 HB1 ALA 49 HB1 ALA 49 2.384 4.214 3.894
353 HB2 ALA 49 HB2 ALA 49 2.042 3.358 2.391
354 HB3 ALA 49 HB3 ALA 49 3.709 3.554 2.936
355 H ALA 50 HN ALA 50 2.079 3.046 6.319
356 HA ALA 50 HA ALA 50 4.684 3.207 7.356
357 HB1 ALA 50 HB1 ALA 50 3.636 3.682 9.508
358 HB2 ALA 50 HB2 ALA 50 2.081 3.130 8.881
359 HB3 ALA 50 HB3 ALA 50 2.841 4.577 8.211
360 H ARG 51 HN ARG 51 2.129 0.810 7.784
361 HA ARG 51 HA ARG 51 3.395 -0.895 9.597
362 HB2 ARG 51 HB2 ARG 51 1.435 -1.499 7.372
363 HB3 ARG 51 HB1 ARG 51 1.981 -2.721 8.500
364 HG2 ARG 51 HG2 ARG 51 0.618 -0.183 9.386
365 HG3 ARG 51 HG1 ARG 51 -0.268 -1.646 8.967
366 HD2 ARG 51 HD2 ARG 51 0.055 -1.504 11.382
367 HD3 ARG 51 HD1 ARG 51 0.939 -2.874 10.721
368 HE ARG 51 HE ARG 51 2.343 -0.357 11.167
369 HH11 ARG 51 HH11 ARG 51 1.666 -3.571 12.440
370 HH12 ARG 51 HH12 ARG 51 3.191 -3.780 13.182
371 HH21 ARG 51 HH21 ARG 51 4.336 -0.549 12.213
372 HH22 ARG 51 HH22 ARG 51 4.814 -1.975 13.047
373 H LEU 52 HN LEU 52 3.348 -1.040 6.088
374 HA LEU 52 HA LEU 52 5.192 -3.170 5.911
375 HB2 LEU 52 HB2 LEU 52 4.340 -1.182 3.831
376 HB3 LEU 52 HB1 LEU 52 5.370 -2.561 3.499
377 HG LEU 52 HG LEU 52 2.546 -2.708 4.543
378 HD11 LEU 52 HD11 LEU 52 2.627 -1.957 2.244
379 HD12 LEU 52 HD12 LEU 52 2.010 -3.605 2.347
380 HD13 LEU 52 HD13 LEU 52 3.666 -3.314 1.819
381 HD21 LEU 52 HD21 LEU 52 2.750 -5.104 4.129
382 HD22 LEU 52 HD22 LEU 52 3.921 -4.561 5.328
383 HD23 LEU 52 HD23 LEU 52 4.440 -4.888 3.674
384 H GLU 53 HN GLU 53 5.746 0.344 5.859
385 HA GLU 53 HA GLU 53 8.412 0.102 4.937
386 HB2 GLU 53 HB2 GLU 53 8.631 2.442 5.326
387 HB3 GLU 53 HB1 GLU 53 6.929 2.164 4.976
388 HG2 GLU 53 HG2 GLU 53 6.343 2.342 7.275
389 HG3 GLU 53 HG1 GLU 53 8.037 2.500 7.724
390 H SER 54 HN SER 54 7.017 0.195 8.080
391 HA SER 54 HA SER 54 9.435 0.206 9.566
392 HB2 SER 54 HB2 SER 54 6.744 -0.905 10.401
393 HB3 SER 54 HB1 SER 54 8.050 -0.391 11.470
394 HG SER 54 HG SER 54 6.303 1.156 9.897
395 H ARG 55 HN ARG 55 7.343 -2.323 8.353
396 HA ARG 55 HA ARG 55 8.662 -4.472 9.631
397 HB2 ARG 55 HB2 ARG 55 6.337 -4.592 9.034
398 HB3 ARG 55 HB1 ARG 55 6.721 -4.380 7.338
399 HG2 ARG 55 HG2 ARG 55 7.722 -6.547 7.234
400 HG3 ARG 55 HG1 ARG 55 7.585 -6.741 8.984
401 HD2 ARG 55 HD2 ARG 55 5.247 -6.370 7.118
402 HD3 ARG 55 HD1 ARG 55 5.819 -7.936 7.699
403 HE ARG 55 HE ARG 55 5.366 -7.018 9.989
404 HH11 ARG 55 HH11 ARG 55 3.523 -5.689 7.265
405 HH12 ARG 55 HH12 ARG 55 2.098 -5.498 8.204
406 HH21 ARG 55 HH21 ARG 55 3.465 -6.700 11.180
407 HH22 ARG 55 HH22 ARG 55 2.025 -6.104 10.424
408 H TYR 56 HN TYR 56 9.028 -3.034 6.420
409 HA TYR 56 HA TYR 56 10.954 -5.149 5.821
410 HB2 TYR 56 HB2 TYR 56 9.510 -3.280 3.952
411 HB3 TYR 56 HB1 TYR 56 10.773 -4.397 3.442
412 HD1 TYR 56 HD1 TYR 56 7.334 -4.109 4.674
413 HD2 TYR 56 HD2 TYR 56 10.362 -6.794 3.370
414 HE1 TYR 56 HE1 TYR 56 5.679 -5.878 4.527
415 HE2 TYR 56 HE2 TYR 56 8.692 -8.593 3.198
416 HH TYR 56 HH TYR 56 5.312 -7.968 3.418
417 H GLY 57 HN GLY 57 11.061 -2.098 6.985
418 HA2 GLY 57 HA2 GLY 57 12.976 -0.943 7.562
419 HA3 GLY 57 HA1 GLY 57 13.908 -2.052 6.573
420 H VAL 58 HN VAL 58 11.237 0.130 5.737
421 HA VAL 58 HA VAL 58 13.121 1.631 4.111
422 HB VAL 58 HB VAL 58 11.494 1.898 2.244
423 HG11 VAL 58 HG11 VAL 58 12.004 -0.951 2.916
424 HG12 VAL 58 HG12 VAL 58 13.172 0.124 2.123
425 HG13 VAL 58 HG13 VAL 58 11.660 -0.332 1.304
426 HG21 VAL 58 HG21 VAL 58 9.521 0.527 2.069
427 HG22 VAL 58 HG22 VAL 58 9.426 1.482 3.553
428 HG23 VAL 58 HG23 VAL 58 9.891 -0.236 3.605
429 H SER 59 HN SER 59 11.840 3.717 3.213
430 HA SER 59 HA SER 59 10.368 4.820 5.490
431 HB2 SER 59 HB2 SER 59 12.470 6.221 3.807
432 HB3 SER 59 HB1 SER 59 11.542 6.943 5.120
433 HG SER 59 HG SER 59 13.442 4.836 5.288
434 H ILE 60 HN ILE 60 8.395 5.137 4.727
435 HA ILE 60 HA ILE 60 8.104 6.052 1.945
436 HB ILE 60 HB ILE 60 6.093 4.516 3.628
437 HG12 ILE 60 HG12 ILE 60 7.671 3.631 1.194
438 HG13 ILE 60 HG11 ILE 60 8.008 3.136 2.846
439 HG21 ILE 60 HG21 ILE 60 4.745 4.423 1.575
440 HG22 ILE 60 HG22 ILE 60 5.933 5.429 0.750
441 HG23 ILE 60 HG23 ILE 60 5.009 6.088 2.099
442 HD11 ILE 60 HD11 ILE 60 5.509 2.521 1.284
443 HD12 ILE 60 HD12 ILE 60 5.824 2.032 2.947
444 HD13 ILE 60 HD13 ILE 60 6.823 1.401 1.638
445 HA PRO 61 HA PRO 61 6.696 9.727 4.082
446 HB2 PRO 61 HB2 PRO 61 6.121 10.703 1.370
447 HB3 PRO 61 HB1 PRO 61 7.228 11.361 2.574
448 HG2 PRO 61 HG2 PRO 61 8.125 10.140 0.351
449 HG3 PRO 61 HG1 PRO 61 8.984 10.030 1.897
450 HD2 PRO 61 HD2 PRO 61 7.180 8.038 0.583
451 HD3 PRO 61 HD1 PRO 61 8.709 7.778 1.452
452 H ASP 62 HN ASP 62 4.784 9.860 4.901
453 HA ASP 62 HA ASP 62 2.564 8.354 4.115
454 HB2 ASP 62 HB2 ASP 62 1.265 9.540 5.820
455 HB3 ASP 62 HB1 ASP 62 2.848 9.084 6.428
456 H ASP 63 HN ASP 63 3.328 11.685 3.347
457 HA ASP 63 HA ASP 63 0.752 12.377 2.424
458 HB2 ASP 63 HB2 ASP 63 1.812 14.344 1.408
459 HB3 ASP 63 HB1 ASP 63 2.394 14.089 3.045
460 H VAL 64 HN VAL 64 3.278 10.582 1.000
461 HA VAL 64 HA VAL 64 2.543 10.887 -1.744
462 HB VAL 64 HB VAL 64 4.027 8.687 -0.330
463 HG11 VAL 64 HG11 VAL 64 3.212 7.930 -2.539
464 HG12 VAL 64 HG12 VAL 64 4.962 8.139 -2.598
465 HG13 VAL 64 HG13 VAL 64 3.905 9.361 -3.303
466 HG21 VAL 64 HG21 VAL 64 5.078 11.058 -1.860
467 HG22 VAL 64 HG22 VAL 64 6.069 9.785 -1.141
468 HG23 VAL 64 HG23 VAL 64 5.102 10.846 -0.114
469 H ALA 65 HN ALA 65 1.527 8.870 0.906
470 HA ALA 65 HA ALA 65 0.232 6.904 -0.707
471 HB1 ALA 65 HB1 ALA 65 -0.155 7.505 2.225
472 HB2 ALA 65 HB2 ALA 65 1.029 6.382 1.551
473 HB3 ALA 65 HB3 ALA 65 -0.696 6.055 1.378
474 H GLY 66 HN GLY 66 -0.545 10.049 0.227
475 HA2 GLY 66 HA2 GLY 66 -3.417 9.695 -0.119
476 HA3 GLY 66 HA1 GLY 66 -2.581 11.209 0.223
477 H ARG 67 HN ARG 67 -0.812 9.834 -2.083
478 HA ARG 67 HA ARG 67 -2.172 11.283 -4.242
479 HB2 ARG 67 HB2 ARG 67 0.667 10.758 -3.598
480 HB3 ARG 67 HB1 ARG 67 0.198 10.980 -5.265
481 HG2 ARG 67 HG2 ARG 67 -0.664 13.218 -4.684
482 HG3 ARG 67 HG1 ARG 67 -0.110 12.967 -3.019
483 HD2 ARG 67 HD2 ARG 67 1.491 14.207 -4.598
484 HD3 ARG 67 HD1 ARG 67 2.156 12.861 -3.666
485 HE ARG 67 HE ARG 67 1.142 12.412 -6.365
486 HH11 ARG 67 HH11 ARG 67 4.068 12.804 -4.406
487 HH12 ARG 67 HH12 ARG 67 4.973 11.627 -5.212
488 HH21 ARG 67 HH21 ARG 67 2.352 10.709 -7.461
489 HH22 ARG 67 HH22 ARG 67 3.965 10.365 -7.030
490 H VAL 68 HN VAL 68 -1.477 8.097 -3.206
491 HA VAL 68 HA VAL 68 -0.689 7.139 -5.764
492 HB VAL 68 HB VAL 68 -0.886 4.842 -4.805
493 HG11 VAL 68 HG11 VAL 68 0.988 5.079 -3.245
494 HG12 VAL 68 HG12 VAL 68 0.708 6.822 -3.194
495 HG13 VAL 68 HG13 VAL 68 1.199 6.051 -4.702
496 HG21 VAL 68 HG21 VAL 68 -1.232 4.586 -2.394
497 HG22 VAL 68 HG22 VAL 68 -2.670 5.219 -3.197
498 HG23 VAL 68 HG23 VAL 68 -1.626 6.305 -2.271
499 H ASP 69 HN ASP 69 -1.810 6.928 -7.360
500 HA ASP 69 HA ASP 69 -4.652 7.114 -7.427
501 HB2 ASP 69 HB2 ASP 69 -3.277 7.893 -9.299
502 HB3 ASP 69 HB1 ASP 69 -2.703 6.263 -9.570
503 H THR 70 HN THR 70 -2.397 4.440 -7.809
504 HA THR 70 HA THR 70 -4.639 2.575 -7.522
505 HB THR 70 HB THR 70 -3.491 1.135 -9.218
506 HG1 THR 70 HG1 THR 70 -2.277 3.229 -10.486
507 HG21 THR 70 HG21 THR 70 -4.459 3.825 -10.138
508 HG22 THR 70 HG22 THR 70 -5.493 2.444 -9.757
509 HG23 THR 70 HG23 THR 70 -4.392 2.379 -11.145
510 HA PRO 71 HA PRO 71 -1.850 0.262 -4.882
511 HB2 PRO 71 HB2 PRO 71 -2.778 -2.195 -6.258
512 HB3 PRO 71 HB1 PRO 71 -2.880 -1.771 -4.543
513 HG2 PRO 71 HG2 PRO 71 -5.054 -1.770 -6.074
514 HG3 PRO 71 HG1 PRO 71 -4.812 -0.524 -4.831
515 HD2 PRO 71 HD2 PRO 71 -4.390 -0.360 -7.788
516 HD3 PRO 71 HD1 PRO 71 -5.149 0.816 -6.689
517 H ARG 72 HN ARG 72 -1.932 0.000 -8.310
518 HA ARG 72 HA ARG 72 0.372 -1.578 -8.729
519 HB2 ARG 72 HB2 ARG 72 -1.423 -0.796 -10.442
520 HB3 ARG 72 HB1 ARG 72 -0.486 0.687 -10.538
521 HG2 ARG 72 HG2 ARG 72 1.487 -0.657 -11.201
522 HG3 ARG 72 HG1 ARG 72 0.458 -2.089 -11.216
523 HD2 ARG 72 HD2 ARG 72 0.364 0.318 -13.013
524 HD3 ARG 72 HD1 ARG 72 0.586 -1.371 -13.454
525 HE ARG 72 HE ARG 72 -1.888 -0.011 -12.752
526 HH11 ARG 72 HH11 ARG 72 -0.427 -3.178 -13.617
527 HH12 ARG 72 HH12 ARG 72 -1.855 -3.740 -14.361
528 HH21 ARG 72 HH21 ARG 72 -3.819 -0.879 -13.775
529 HH22 ARG 72 HH22 ARG 72 -3.787 -2.429 -14.476
530 H GLU 73 HN GLU 73 -0.241 1.915 -8.643
531 HA GLU 73 HA GLU 73 2.430 2.766 -8.792
532 HB2 GLU 73 HB2 GLU 73 0.551 4.238 -9.349
533 HB3 GLU 73 HB1 GLU 73 -0.026 4.136 -7.699
534 HG2 GLU 73 HG2 GLU 73 1.774 5.405 -6.877
535 HG3 GLU 73 HG1 GLU 73 2.650 5.278 -8.405
536 H LEU 74 HN LEU 74 0.306 2.091 -6.086
537 HA LEU 74 HA LEU 74 2.032 2.984 -4.040
538 HB2 LEU 74 HB2 LEU 74 -0.445 2.548 -3.838
539 HB3 LEU 74 HB1 LEU 74 -0.113 0.839 -3.872
540 HG LEU 74 HG LEU 74 -0.665 1.767 -1.618
541 HD11 LEU 74 HD11 LEU 74 1.076 0.634 -0.366
542 HD12 LEU 74 HD12 LEU 74 2.068 0.551 -1.823
543 HD13 LEU 74 HD13 LEU 74 0.534 -0.314 -1.751
544 HD21 LEU 74 HD21 LEU 74 1.030 3.040 -0.397
545 HD22 LEU 74 HD22 LEU 74 0.423 3.925 -1.796
546 HD23 LEU 74 HD23 LEU 74 2.003 3.141 -1.862
547 H LEU 75 HN LEU 75 1.585 -0.242 -5.507
548 HA LEU 75 HA LEU 75 3.468 -1.604 -3.930
549 HB2 LEU 75 HB2 LEU 75 1.725 -2.670 -5.348
550 HB3 LEU 75 HB1 LEU 75 2.606 -2.165 -6.770
551 HG LEU 75 HG LEU 75 4.493 -3.618 -6.084
552 HD11 LEU 75 HD11 LEU 75 4.092 -3.637 -3.684
553 HD12 LEU 75 HD12 LEU 75 4.126 -5.280 -4.329
554 HD13 LEU 75 HD13 LEU 75 2.586 -4.520 -3.930
555 HD21 LEU 75 HD21 LEU 75 2.808 -4.414 -7.657
556 HD22 LEU 75 HD22 LEU 75 1.814 -4.979 -6.317
557 HD23 LEU 75 HD23 LEU 75 3.381 -5.727 -6.631
558 H ASP 76 HN ASP 76 3.707 0.104 -7.012
559 HA ASP 76 HA ASP 76 6.366 -0.366 -7.692
560 HB2 ASP 76 HB2 ASP 76 4.911 0.775 -9.235
561 HB3 ASP 76 HB1 ASP 76 4.658 2.093 -8.098
562 H LEU 77 HN LEU 77 4.976 2.152 -5.689
563 HA LEU 77 HA LEU 77 7.247 3.580 -5.017
564 HB2 LEU 77 HB2 LEU 77 5.096 4.426 -4.467
565 HB3 LEU 77 HB1 LEU 77 4.717 3.023 -3.493
566 HG LEU 77 HG LEU 77 6.391 3.734 -1.833
567 HD11 LEU 77 HD11 LEU 77 6.669 6.192 -3.545
568 HD12 LEU 77 HD12 LEU 77 7.900 4.953 -3.283
569 HD13 LEU 77 HD13 LEU 77 7.366 5.958 -1.941
570 HD21 LEU 77 HD21 LEU 77 4.066 4.365 -1.569
571 HD22 LEU 77 HD22 LEU 77 4.337 5.824 -2.525
572 HD23 LEU 77 HD23 LEU 77 5.133 5.630 -0.962
573 H ILE 78 HN ILE 78 5.776 0.851 -3.306
574 HA ILE 78 HA ILE 78 7.762 0.771 -1.304
575 HB ILE 78 HB ILE 78 5.914 -1.475 -2.145
576 HG12 ILE 78 HG12 ILE 78 5.596 0.678 -0.036
577 HG13 ILE 78 HG11 ILE 78 4.676 0.550 -1.531
578 HG21 ILE 78 HG21 ILE 78 7.465 -0.984 0.407
579 HG22 ILE 78 HG22 ILE 78 7.810 -2.226 -0.800
580 HG23 ILE 78 HG23 ILE 78 6.316 -2.293 0.135
581 HD11 ILE 78 HD11 ILE 78 3.393 -0.234 0.384
582 HD12 ILE 78 HD12 ILE 78 4.643 -1.427 0.739
583 HD13 ILE 78 HD13 ILE 78 3.709 -1.550 -0.750
584 H ASN 79 HN ASN 79 7.288 -1.272 -4.216
585 HA ASN 79 HA ASN 79 9.543 -2.889 -3.703
586 HB2 ASN 79 HB2 ASN 79 7.977 -2.409 -6.222
587 HB3 ASN 79 HB1 ASN 79 9.481 -3.313 -6.290
588 HD21 ASN 79 HD21 ASN 79 7.252 -3.472 -3.566
589 HD22 ASN 79 HD22 ASN 79 6.758 -5.110 -3.866
590 H GLY 80 HN GLY 80 9.285 0.130 -5.495
591 HA2 GLY 80 HA2 GLY 80 11.944 0.201 -6.407
592 HA3 GLY 80 HA1 GLY 80 10.909 1.602 -6.126
593 H ALA 81 HN ALA 81 10.429 1.474 -3.458
594 HA ALA 81 HA ALA 81 12.719 2.603 -2.312
595 HB1 ALA 81 HB1 ALA 81 11.488 2.553 -0.202
596 HB2 ALA 81 HB2 ALA 81 10.322 1.427 -0.898
597 HB3 ALA 81 HB3 ALA 81 10.440 3.072 -1.524
598 H LEU 82 HN LEU 82 11.362 -0.624 -2.058
599 HA LEU 82 HA LEU 82 13.119 -1.733 -0.168
600 HB2 LEU 82 HB2 LEU 82 11.662 -3.041 -2.462
601 HB3 LEU 82 HB1 LEU 82 12.503 -3.922 -1.203
602 HG LEU 82 HG LEU 82 10.180 -2.070 -0.686
603 HD11 LEU 82 HD11 LEU 82 10.244 -5.067 -0.946
604 HD12 LEU 82 HD12 LEU 82 9.492 -3.943 -2.082
605 HD13 LEU 82 HD13 LEU 82 8.854 -4.101 -0.443
606 HD21 LEU 82 HD21 LEU 82 10.108 -3.223 1.462
607 HD22 LEU 82 HD22 LEU 82 11.657 -2.418 1.216
608 HD23 LEU 82 HD23 LEU 82 11.530 -4.164 1.008
609 H ALA 83 HN ALA 83 13.283 -1.659 -3.704
610 HA ALA 83 HA ALA 83 15.672 -3.126 -3.958
611 HB1 ALA 83 HB1 ALA 83 14.556 -1.018 -5.813
612 HB2 ALA 83 HB2 ALA 83 14.142 -2.732 -5.838
613 HB3 ALA 83 HB3 ALA 83 15.783 -2.216 -6.227
614 H GLU 84 HN GLU 84 15.035 0.292 -3.561
615 HA GLU 84 HA GLU 84 17.793 1.039 -3.773
616 HB2 GLU 84 HB2 GLU 84 15.369 2.582 -2.864
617 HB3 GLU 84 HB1 GLU 84 16.966 3.278 -3.104
618 HG2 GLU 84 HG2 GLU 84 15.341 1.925 -5.242
619 HG3 GLU 84 HG1 GLU 84 15.429 3.665 -4.989
620 H ALA 85 HN ALA 85 16.156 -0.515 -1.363
621 HA ALA 85 HA ALA 85 17.738 0.737 0.772
622 HB1 ALA 85 HB1 ALA 85 15.315 0.745 1.163
623 HB2 ALA 85 HB2 ALA 85 16.143 -0.288 2.329
624 HB3 ALA 85 HB3 ALA 85 15.278 -1.008 0.972
625 H ALA 86 HN ALA 86 18.424 -1.336 -1.305
626 HA ALA 86 HA ALA 86 18.887 -3.721 0.225
627 HB1 ALA 86 HB1 ALA 86 19.949 -4.553 -1.816
628 HB2 ALA 86 HB2 ALA 86 19.813 -2.951 -2.545
629 HB3 ALA 86 HB3 ALA 86 18.359 -3.877 -2.159
630 H28 SXV 87 H28A SXV 87 -7.321 12.224 2.256
631 H28A SXV 87 H28B SXV 87 -5.666 11.611 2.245
632 H30 SXV 87 H30C SXV 87 -4.930 13.431 3.576
633 H30A SXV 87 H30A SXV 87 -6.586 14.036 3.639
634 H30B SXV 87 H30B SXV 87 -5.274 15.104 3.134
635 H31 SXV 87 H31C SXV 87 -3.800 13.058 1.447
636 H31A SXV 87 H31A SXV 87 -4.131 14.700 0.892
637 H31B SXV 87 H31B SXV 87 -4.645 13.320 -0.077
638 H32 SXV 87 H32A SXV 87 -7.796 14.682 1.526
639 HO33 SXV 87 H33A SXV 87 -6.988 13.140 -0.311
640 HN36 SXV 87 H36A SXV 87 -6.919 15.761 -1.111
641 H37 SXV 87 H37B SXV 87 -5.093 17.952 -0.616
642 H37A SXV 87 H37A SXV 87 -6.754 18.496 -0.753
643 H38 SXV 87 H38B SXV 87 -6.844 17.680 -3.048
644 H38A SXV 87 H38A SXV 87 -5.288 16.848 -2.807
645 HN41 SXV 87 H41A SXV 87 -5.110 18.076 -4.870
646 H42 SXV 87 H42B SXV 87 -3.225 20.178 -4.455
647 H42A SXV 87 H42A SXV 87 -4.683 20.716 -5.277
648 H43 SXV 87 H43B SXV 87 -2.976 18.389 -6.125
649 H43A SXV 87 H43A SXV 87 -4.295 19.089 -7.048
650 H1 SXV 87 H1B SXV 87 -4.193 21.581 -8.004
651 H1A SXV 87 H1A SXV 87 -3.643 22.284 -6.471
652 H2 SXV 87 H2A SXV 87 -1.698 23.204 -7.540
653 H2A SXV 87 H2B SXV 87 -3.212 23.888 -8.143
654 H4 SXV 87 H4C SXV 87 -0.518 21.488 -10.185
655 H4A SXV 87 H4A SXV 87 -0.146 22.644 -8.899
656 H4B SXV 87 H4B SXV 87 -0.397 23.216 -10.555
Start of MODEL 17
1 H1 MET 1 HT1 MET 1 20.245 -9.363 -6.550
2 H2 MET 1 HT2 MET 1 21.335 -10.466 -5.902
3 H3 MET 1 HT3 MET 1 21.143 -8.910 -5.213
4 HA MET 1 HA MET 1 19.005 -10.944 -5.354
5 HB2 MET 1 HB2 MET 1 20.592 -9.995 -2.950
6 HB3 MET 1 HB1 MET 1 19.196 -11.060 -2.886
7 HG2 MET 1 HG2 MET 1 20.463 -12.724 -4.202
8 HG3 MET 1 HG1 MET 1 21.864 -11.659 -4.134
9 HE1 MET 1 HE1 MET 1 21.453 -10.495 -1.109
10 HE2 MET 1 HE2 MET 1 23.026 -10.934 -1.776
11 HE3 MET 1 HE3 MET 1 22.518 -11.580 -0.216
12 H ALA 2 HN ALA 2 17.015 -10.207 -4.779
13 HA ALA 2 HA ALA 2 16.730 -7.553 -3.659
14 HB1 ALA 2 HB1 ALA 2 15.246 -6.769 -5.442
15 HB2 ALA 2 HB2 ALA 2 15.554 -8.246 -6.359
16 HB3 ALA 2 HB3 ALA 2 16.862 -7.098 -6.072
17 H THR 3 HN THR 3 15.090 -7.590 -2.254
18 HA THR 3 HA THR 3 13.202 -9.817 -2.377
19 HB THR 3 HB THR 3 12.697 -9.042 -0.010
20 HG1 THR 3 HG1 THR 3 13.422 -7.008 0.024
21 HG21 THR 3 HG21 THR 3 14.196 -10.938 -0.439
22 HG22 THR 3 HG22 THR 3 14.747 -10.010 0.959
23 HG23 THR 3 HG23 THR 3 15.561 -9.833 -0.594
24 H LEU 4 HN LEU 4 11.457 -9.217 -3.565
25 HA LEU 4 HA LEU 4 10.383 -6.515 -3.152
26 HB2 LEU 4 HB2 LEU 4 10.078 -8.340 -5.540
27 HB3 LEU 4 HB1 LEU 4 9.293 -6.789 -5.361
28 HG LEU 4 HG LEU 4 12.277 -7.223 -5.570
29 HD11 LEU 4 HD11 LEU 4 10.301 -6.110 -7.555
30 HD12 LEU 4 HD12 LEU 4 11.123 -7.666 -7.666
31 HD13 LEU 4 HD13 LEU 4 12.052 -6.168 -7.760
32 HD21 LEU 4 HD21 LEU 4 11.715 -5.269 -4.203
33 HD22 LEU 4 HD22 LEU 4 10.663 -4.669 -5.488
34 HD23 LEU 4 HD23 LEU 4 12.401 -4.784 -5.755
35 H LEU 5 HN LEU 5 8.477 -6.375 -2.201
36 HA LEU 5 HA LEU 5 7.176 -8.617 -1.147
37 HB2 LEU 5 HB2 LEU 5 5.615 -7.127 -0.197
38 HB3 LEU 5 HB1 LEU 5 7.142 -6.286 -0.197
39 HG LEU 5 HG LEU 5 4.979 -5.805 -2.235
40 HD11 LEU 5 HD11 LEU 5 4.437 -3.779 -0.944
41 HD12 LEU 5 HD12 LEU 5 5.574 -4.292 0.302
42 HD13 LEU 5 HD13 LEU 5 4.134 -5.255 -0.029
43 HD21 LEU 5 HD21 LEU 5 7.137 -5.037 -3.014
44 HD22 LEU 5 HD22 LEU 5 7.426 -4.199 -1.489
45 HD23 LEU 5 HD23 LEU 5 6.150 -3.645 -2.570
46 H THR 6 HN THR 6 5.255 -9.599 -1.714
47 HA THR 6 HA THR 6 4.579 -9.274 -4.519
48 HB THR 6 HB THR 6 3.299 -11.397 -4.210
49 HG1 THR 6 HG1 THR 6 4.362 -11.197 -1.548
50 HG21 THR 6 HG21 THR 6 5.620 -11.464 -4.986
51 HG22 THR 6 HG22 THR 6 5.272 -12.854 -3.958
52 HG23 THR 6 HG23 THR 6 6.189 -11.489 -3.317
53 H THR 7 HN THR 7 1.989 -9.955 -4.791
54 HA THR 7 HA THR 7 0.489 -7.760 -3.955
55 HB THR 7 HB THR 7 -0.544 -10.502 -4.768
56 HG1 THR 7 HG1 THR 7 -0.553 -9.304 -6.901
57 HG21 THR 7 HG21 THR 7 -2.435 -9.226 -5.663
58 HG22 THR 7 HG22 THR 7 -1.676 -7.727 -5.123
59 HG23 THR 7 HG23 THR 7 -2.239 -8.907 -3.936
60 H ASP 8 HN ASP 8 0.851 -11.055 -2.758
61 HA ASP 8 HA ASP 8 -0.959 -11.145 -0.653
62 HB2 ASP 8 HB2 ASP 8 0.196 -13.146 -1.172
63 HB3 ASP 8 HB1 ASP 8 1.771 -12.383 -1.008
64 H ASP 9 HN ASP 9 2.331 -9.932 -0.678
65 HA ASP 9 HA ASP 9 2.457 -9.276 2.080
66 HB2 ASP 9 HB2 ASP 9 4.059 -8.222 -0.234
67 HB3 ASP 9 HB1 ASP 9 4.426 -7.886 1.456
68 H LEU 10 HN LEU 10 1.728 -7.405 -0.797
69 HA LEU 10 HA LEU 10 1.395 -4.925 0.495
70 HB2 LEU 10 HB2 LEU 10 1.624 -5.201 -1.958
71 HB3 LEU 10 HB1 LEU 10 0.036 -5.942 -2.005
72 HG LEU 10 HG LEU 10 -0.924 -3.806 -1.158
73 HD11 LEU 10 HD11 LEU 10 0.420 -1.778 -1.274
74 HD12 LEU 10 HD12 LEU 10 1.849 -2.745 -1.644
75 HD13 LEU 10 HD13 LEU 10 1.053 -2.912 -0.080
76 HD21 LEU 10 HD21 LEU 10 -0.966 -4.344 -3.529
77 HD22 LEU 10 HD22 LEU 10 0.634 -3.630 -3.733
78 HD23 LEU 10 HD23 LEU 10 -0.737 -2.613 -3.287
79 H ARG 11 HN ARG 11 -0.885 -7.465 -0.385
80 HA ARG 11 HA ARG 11 -3.314 -6.438 0.385
81 HB2 ARG 11 HB2 ARG 11 -3.049 -8.562 -0.754
82 HB3 ARG 11 HB1 ARG 11 -2.288 -9.253 0.666
83 HG2 ARG 11 HG2 ARG 11 -4.396 -8.994 1.904
84 HG3 ARG 11 HG1 ARG 11 -5.152 -8.355 0.440
85 HD2 ARG 11 HD2 ARG 11 -3.906 -11.084 0.750
86 HD3 ARG 11 HD1 ARG 11 -5.640 -10.729 0.705
87 HE ARG 11 HE ARG 11 -5.216 -9.832 -1.550
88 HH11 ARG 11 HH11 ARG 11 -3.201 -12.428 -0.195
89 HH12 ARG 11 HH12 ARG 11 -2.684 -13.039 -1.684
90 HH21 ARG 11 HH21 ARG 11 -4.444 -10.659 -3.657
91 HH22 ARG 11 HH22 ARG 11 -3.396 -11.990 -3.722
92 H ARG 12 HN ARG 12 -0.994 -8.200 2.365
93 HA ARG 12 HA ARG 12 -2.547 -8.260 4.691
94 HB2 ARG 12 HB2 ARG 12 0.455 -8.422 4.411
95 HB3 ARG 12 HB1 ARG 12 -0.455 -8.858 5.861
96 HG2 ARG 12 HG2 ARG 12 -1.658 -10.558 4.601
97 HG3 ARG 12 HG1 ARG 12 -0.752 -10.126 3.154
98 HD2 ARG 12 HD2 ARG 12 1.310 -10.825 4.255
99 HD3 ARG 12 HD1 ARG 12 0.390 -11.261 5.701
100 HE ARG 12 HE ARG 12 0.081 -12.546 3.064
101 HH11 ARG 12 HH11 ARG 12 0.232 -12.786 6.575
102 HH12 ARG 12 HH12 ARG 12 -0.445 -14.349 6.652
103 HH21 ARG 12 HH21 ARG 12 -0.780 -14.682 3.125
104 HH22 ARG 12 HH22 ARG 12 -1.041 -15.469 4.623
105 H ALA 13 HN ALA 13 -0.478 -5.783 3.432
106 HA ALA 13 HA ALA 13 -0.345 -4.234 5.826
107 HB1 ALA 13 HB1 ALA 13 0.000 -3.397 2.968
108 HB2 ALA 13 HB2 ALA 13 1.271 -3.988 4.042
109 HB3 ALA 13 HB3 ALA 13 0.459 -2.462 4.390
110 H LEU 14 HN LEU 14 -2.477 -4.356 3.033
111 HA LEU 14 HA LEU 14 -4.005 -2.105 3.826
112 HB2 LEU 14 HB2 LEU 14 -4.639 -4.383 1.944
113 HB3 LEU 14 HB1 LEU 14 -5.837 -3.183 2.354
114 HG LEU 14 HG LEU 14 -4.963 -2.632 0.226
115 HD11 LEU 14 HD11 LEU 14 -4.016 -0.418 0.538
116 HD12 LEU 14 HD12 LEU 14 -3.759 -0.784 2.244
117 HD13 LEU 14 HD13 LEU 14 -5.396 -0.730 1.589
118 HD21 LEU 14 HD21 LEU 14 -2.199 -2.705 1.413
119 HD22 LEU 14 HD22 LEU 14 -2.602 -2.184 -0.224
120 HD23 LEU 14 HD23 LEU 14 -2.873 -3.857 0.262
121 H VAL 15 HN VAL 15 -4.255 -5.573 4.374
122 HA VAL 15 HA VAL 15 -6.619 -5.690 5.848
123 HB VAL 15 HB VAL 15 -4.082 -7.309 6.341
124 HG11 VAL 15 HG11 VAL 15 -5.605 -7.457 8.241
125 HG12 VAL 15 HG12 VAL 15 -5.555 -8.985 7.361
126 HG13 VAL 15 HG13 VAL 15 -6.930 -7.899 7.164
127 HG21 VAL 15 HG21 VAL 15 -5.148 -9.024 4.963
128 HG22 VAL 15 HG22 VAL 15 -4.903 -7.530 4.056
129 HG23 VAL 15 HG23 VAL 15 -6.506 -7.942 4.662
130 H GLU 16 HN GLU 16 -3.329 -5.008 6.981
131 HA GLU 16 HA GLU 16 -3.824 -4.697 9.681
132 HB2 GLU 16 HB2 GLU 16 -1.742 -3.363 7.944
133 HB3 GLU 16 HB1 GLU 16 -1.815 -3.204 9.688
134 HG2 GLU 16 HG2 GLU 16 -1.642 -5.842 8.278
135 HG3 GLU 16 HG1 GLU 16 -0.262 -4.920 8.872
136 H SER 17 HN SER 17 -4.590 -2.487 7.126
137 HA SER 17 HA SER 17 -5.153 -0.340 9.044
138 HB2 SER 17 HB2 SER 17 -3.666 0.136 7.097
139 HB3 SER 17 HB1 SER 17 -4.988 -0.271 6.014
140 HG SER 17 HG SER 17 -4.612 1.983 6.462
141 H ALA 18 HN ALA 18 -6.693 -2.841 7.454
142 HA ALA 18 HA ALA 18 -9.236 -1.391 7.217
143 HB1 ALA 18 HB1 ALA 18 -8.476 -4.072 6.079
144 HB2 ALA 18 HB2 ALA 18 -8.488 -2.544 5.199
145 HB3 ALA 18 HB3 ALA 18 -9.997 -3.217 5.823
146 H GLY 19 HN GLY 19 -7.768 -4.302 8.543
147 HA2 GLY 19 HA2 GLY 19 -8.381 -5.432 10.432
148 HA3 GLY 19 HA1 GLY 19 -9.801 -4.398 10.573
149 H GLU 20 HN GLU 20 -11.604 -4.812 9.280
150 HA GLU 20 HA GLU 20 -11.610 -7.172 7.647
151 HB2 GLU 20 HB2 GLU 20 -12.049 -7.893 10.080
152 HB3 GLU 20 HB1 GLU 20 -13.582 -7.045 9.921
153 HG2 GLU 20 HG2 GLU 20 -13.897 -9.390 9.488
154 HG3 GLU 20 HG1 GLU 20 -14.146 -8.470 8.000
155 H THR 21 HN THR 21 -12.536 -6.389 5.915
156 HA THR 21 HA THR 21 -15.006 -4.862 6.196
157 HB THR 21 HB THR 21 -12.806 -4.208 4.211
158 HG1 THR 21 HG1 THR 21 -13.208 -3.417 6.836
159 HG21 THR 21 HG21 THR 21 -15.342 -2.746 4.979
160 HG22 THR 21 HG22 THR 21 -15.071 -3.626 3.475
161 HG23 THR 21 HG23 THR 21 -14.139 -2.171 3.825
162 H ASP 22 HN ASP 22 -15.939 -6.934 5.745
163 HA ASP 22 HA ASP 22 -15.273 -8.302 3.332
164 HB2 ASP 22 HB2 ASP 22 -17.128 -9.816 3.791
165 HB3 ASP 22 HB1 ASP 22 -16.203 -9.558 5.256
166 H GLY 23 HN GLY 23 -16.187 -8.273 1.435
167 HA2 GLY 23 HA2 GLY 23 -18.098 -7.629 0.019
168 HA3 GLY 23 HA1 GLY 23 -18.141 -6.118 0.940
169 H THR 24 HN THR 24 -15.284 -6.179 1.224
170 HA THR 24 HA THR 24 -14.493 -5.121 -1.365
171 HB THR 24 HB THR 24 -13.344 -4.846 1.431
172 HG1 THR 24 HG1 THR 24 -14.850 -3.113 -0.242
173 HG21 THR 24 HG21 THR 24 -12.561 -3.442 -1.137
174 HG22 THR 24 HG22 THR 24 -11.599 -4.661 -0.302
175 HG23 THR 24 HG23 THR 24 -11.901 -3.098 0.464
176 H ASP 25 HN ASP 25 -13.916 -7.011 -2.428
177 HA ASP 25 HA ASP 25 -12.493 -9.144 -1.223
178 HB2 ASP 25 HB2 ASP 25 -12.855 -8.457 -4.143
179 HB3 ASP 25 HB1 ASP 25 -11.979 -9.874 -3.588
180 H LEU 26 HN LEU 26 -10.730 -8.520 -0.215
181 HA LEU 26 HA LEU 26 -8.680 -7.085 -1.693
182 HB2 LEU 26 HB2 LEU 26 -9.296 -6.507 0.682
183 HB3 LEU 26 HB1 LEU 26 -8.663 -8.064 1.167
184 HG LEU 26 HG LEU 26 -6.430 -7.385 0.356
185 HD11 LEU 26 HD11 LEU 26 -7.750 -4.705 -0.085
186 HD12 LEU 26 HD12 LEU 26 -7.130 -5.774 -1.340
187 HD13 LEU 26 HD13 LEU 26 -6.020 -5.033 -0.186
188 HD21 LEU 26 HD21 LEU 26 -5.981 -5.797 2.156
189 HD22 LEU 26 HD22 LEU 26 -7.043 -7.100 2.692
190 HD23 LEU 26 HD23 LEU 26 -7.711 -5.508 2.332
191 H SER 27 HN SER 27 -9.554 -10.181 -0.442
192 HA SER 27 HA SER 27 -7.096 -11.515 -0.938
193 HB2 SER 27 HB2 SER 27 -9.900 -12.671 -0.878
194 HB3 SER 27 HB1 SER 27 -8.389 -13.530 -0.593
195 HG SER 27 HG SER 27 -8.324 -11.614 1.168
196 H GLY 28 HN GLY 28 -6.286 -11.729 -2.912
197 HA2 GLY 28 HA2 GLY 28 -6.625 -12.757 -5.132
198 HA3 GLY 28 HA1 GLY 28 -8.108 -11.802 -5.223
199 H ASP 29 HN ASP 29 -7.011 -10.959 -7.206
200 HA ASP 29 HA ASP 29 -4.821 -9.157 -6.607
201 HB2 ASP 29 HB2 ASP 29 -4.551 -8.801 -8.946
202 HB3 ASP 29 HB1 ASP 29 -4.898 -10.511 -8.768
203 H PHE 30 HN PHE 30 -4.940 -6.998 -6.569
204 HA PHE 30 HA PHE 30 -7.521 -5.714 -7.009
205 HB2 PHE 30 HB2 PHE 30 -7.477 -4.691 -4.755
206 HB3 PHE 30 HB1 PHE 30 -7.589 -6.441 -4.667
207 HD1 PHE 30 HD2 PHE 30 -5.635 -7.776 -3.926
208 HD2 PHE 30 HD1 PHE 30 -5.583 -3.521 -3.864
209 HE1 PHE 30 HE2 PHE 30 -3.695 -7.823 -2.420
210 HE2 PHE 30 HE1 PHE 30 -3.639 -3.566 -2.363
211 HZ PHE 30 HZ PHE 30 -2.701 -5.711 -1.631
212 H LEU 31 HN LEU 31 -4.830 -5.640 -8.252
213 HA LEU 31 HA LEU 31 -3.590 -3.231 -7.210
214 HB2 LEU 31 HB2 LEU 31 -2.761 -4.838 -9.621
215 HB3 LEU 31 HB1 LEU 31 -1.838 -3.577 -8.853
216 HG LEU 31 HG LEU 31 -0.802 -5.536 -8.256
217 HD11 LEU 31 HD11 LEU 31 -2.559 -4.835 -5.940
218 HD12 LEU 31 HD12 LEU 31 -0.987 -4.142 -6.353
219 HD13 LEU 31 HD13 LEU 31 -1.108 -5.831 -5.852
220 HD21 LEU 31 HD21 LEU 31 -2.500 -7.092 -8.995
221 HD22 LEU 31 HD22 LEU 31 -3.452 -6.772 -7.541
222 HD23 LEU 31 HD23 LEU 31 -1.872 -7.548 -7.412
223 H ASP 32 HN ASP 32 -5.757 -4.116 -9.736
224 HA ASP 32 HA ASP 32 -5.097 -1.753 -11.344
225 HB2 ASP 32 HB2 ASP 32 -5.476 -4.087 -12.295
226 HB3 ASP 32 HB1 ASP 32 -7.179 -3.839 -11.934
227 H LEU 33 HN LEU 33 -7.400 -2.829 -9.071
228 HA LEU 33 HA LEU 33 -9.518 -1.177 -10.017
229 HB2 LEU 33 HB2 LEU 33 -10.708 -1.832 -7.900
230 HB3 LEU 33 HB1 LEU 33 -10.259 -3.135 -8.971
231 HG LEU 33 HG LEU 33 -8.320 -3.615 -7.430
232 HD11 LEU 33 HD11 LEU 33 -9.733 -1.692 -5.601
233 HD12 LEU 33 HD12 LEU 33 -8.137 -1.472 -6.317
234 HD13 LEU 33 HD13 LEU 33 -8.408 -2.766 -5.151
235 HD21 LEU 33 HD21 LEU 33 -10.344 -4.939 -7.383
236 HD22 LEU 33 HD22 LEU 33 -11.091 -3.793 -6.267
237 HD23 LEU 33 HD23 LEU 33 -9.692 -4.739 -5.756
238 H ARG 34 HN ARG 34 -10.683 0.175 -8.186
239 HA ARG 34 HA ARG 34 -8.731 2.278 -7.631
240 HB2 ARG 34 HB2 ARG 34 -11.733 2.409 -7.847
241 HB3 ARG 34 HB1 ARG 34 -10.678 3.783 -7.530
242 HG2 ARG 34 HG2 ARG 34 -10.670 2.069 -10.000
243 HG3 ARG 34 HG1 ARG 34 -11.263 3.731 -9.861
244 HD2 ARG 34 HD2 ARG 34 -9.107 4.539 -9.351
245 HD3 ARG 34 HD1 ARG 34 -8.437 2.926 -9.212
246 HE ARG 34 HE ARG 34 -9.238 2.921 -11.724
247 HH11 ARG 34 HH11 ARG 34 -7.677 5.432 -9.834
248 HH12 ARG 34 HH12 ARG 34 -6.654 6.012 -11.037
249 HH21 ARG 34 HH21 ARG 34 -7.855 3.752 -13.560
250 HH22 ARG 34 HH22 ARG 34 -6.819 5.067 -13.233
251 H PHE 35 HN PHE 35 -8.693 3.407 -5.662
252 HA PHE 35 HA PHE 35 -9.198 1.792 -3.366
253 HB2 PHE 35 HB2 PHE 35 -8.323 4.675 -3.598
254 HB3 PHE 35 HB1 PHE 35 -8.456 3.805 -2.075
255 HD1 PHE 35 HD2 PHE 35 -7.152 1.521 -2.028
256 HD2 PHE 35 HD1 PHE 35 -6.275 4.770 -4.628
257 HE1 PHE 35 HE2 PHE 35 -4.859 0.691 -2.296
258 HE2 PHE 35 HE1 PHE 35 -4.020 3.949 -4.909
259 HZ PHE 35 HZ PHE 35 -3.281 1.910 -3.732
260 H GLU 36 HN GLU 36 -10.685 4.507 -4.887
261 HA GLU 36 HA GLU 36 -12.621 5.180 -2.972
262 HB2 GLU 36 HB2 GLU 36 -13.207 5.214 -5.933
263 HB3 GLU 36 HB1 GLU 36 -13.768 6.325 -4.705
264 HG2 GLU 36 HG2 GLU 36 -12.244 7.578 -5.932
265 HG3 GLU 36 HG1 GLU 36 -11.308 7.066 -4.531
266 H ASP 37 HN ASP 37 -12.435 2.712 -5.384
267 HA ASP 37 HA ASP 37 -15.125 1.787 -5.253
268 HB2 ASP 37 HB2 ASP 37 -13.669 1.428 -7.211
269 HB3 ASP 37 HB1 ASP 37 -12.627 0.400 -6.235
270 H ILE 38 HN ILE 38 -12.101 0.912 -3.687
271 HA ILE 38 HA ILE 38 -13.471 -1.213 -2.263
272 HB ILE 38 HB ILE 38 -11.255 -1.895 -1.396
273 HG12 ILE 38 HG12 ILE 38 -10.189 0.233 -3.281
274 HG13 ILE 38 HG11 ILE 38 -10.145 0.319 -1.527
275 HG21 ILE 38 HG21 ILE 38 -11.525 -1.649 -4.368
276 HG22 ILE 38 HG22 ILE 38 -12.209 -2.918 -3.347
277 HG23 ILE 38 HG23 ILE 38 -10.453 -2.785 -3.538
278 HD11 ILE 38 HD11 ILE 38 -7.987 -0.317 -2.435
279 HD12 ILE 38 HD12 ILE 38 -8.715 -1.706 -3.240
280 HD13 ILE 38 HD13 ILE 38 -8.668 -1.633 -1.479
281 H GLY 39 HN GLY 39 -13.664 1.713 -1.768
282 HA2 GLY 39 HA2 GLY 39 -14.173 3.035 0.067
283 HA3 GLY 39 HA1 GLY 39 -14.262 1.541 0.984
284 H TYR 40 HN TYR 40 -11.567 3.211 -0.601
285 HA TYR 40 HA TYR 40 -10.252 3.412 2.017
286 HB2 TYR 40 HB2 TYR 40 -9.198 2.451 -0.596
287 HB3 TYR 40 HB1 TYR 40 -8.128 3.382 0.434
288 HD1 TYR 40 HD2 TYR 40 -10.273 0.332 0.393
289 HD2 TYR 40 HD1 TYR 40 -6.988 2.366 2.152
290 HE1 TYR 40 HE2 TYR 40 -9.684 -1.706 1.642
291 HE2 TYR 40 HE1 TYR 40 -6.376 0.360 3.387
292 HH TYR 40 HH TYR 40 -7.480 -1.698 4.195
293 H ASP 41 HN ASP 41 -9.583 5.354 2.571
294 HA ASP 41 HA ASP 41 -9.265 7.419 0.507
295 HB2 ASP 41 HB2 ASP 41 -9.932 7.548 3.434
296 HB3 ASP 41 HB1 ASP 41 -8.956 8.839 2.764
297 H SER 42 HN SER 42 -7.486 8.965 1.187
298 HA SER 42 HA SER 42 -4.956 7.865 1.009
299 HB2 SER 42 HB2 SER 42 -4.256 10.150 1.768
300 HB3 SER 42 HB1 SER 42 -5.482 10.178 0.488
301 H LEU 43 HN LEU 43 -6.880 8.801 3.702
302 HA LEU 43 HA LEU 43 -5.320 8.799 5.931
303 HB2 LEU 43 HB2 LEU 43 -8.029 7.524 5.704
304 HB3 LEU 43 HB1 LEU 43 -7.271 8.099 7.173
305 HG LEU 43 HG LEU 43 -8.160 9.812 4.858
306 HD11 LEU 43 HD11 LEU 43 -9.858 10.607 6.418
307 HD12 LEU 43 HD12 LEU 43 -9.289 9.445 7.618
308 HD13 LEU 43 HD13 LEU 43 -10.007 8.876 6.112
309 HD21 LEU 43 HD21 LEU 43 -6.205 10.755 5.984
310 HD22 LEU 43 HD22 LEU 43 -7.007 10.581 7.544
311 HD23 LEU 43 HD23 LEU 43 -7.650 11.701 6.342
312 H ALA 44 HN ALA 44 -6.979 5.950 4.649
313 HA ALA 44 HA ALA 44 -5.797 4.154 6.489
314 HB1 ALA 44 HB1 ALA 44 -7.182 3.587 3.873
315 HB2 ALA 44 HB2 ALA 44 -7.969 3.731 5.447
316 HB3 ALA 44 HB3 ALA 44 -6.836 2.414 5.143
317 H LEU 45 HN LEU 45 -5.079 5.152 3.219
318 HA LEU 45 HA LEU 45 -3.255 3.130 2.558
319 HB2 LEU 45 HB2 LEU 45 -3.404 5.959 1.535
320 HB3 LEU 45 HB1 LEU 45 -2.527 4.645 0.772
321 HG LEU 45 HG LEU 45 -5.515 4.786 1.133
322 HD11 LEU 45 HD11 LEU 45 -4.716 6.362 -0.530
323 HD12 LEU 45 HD12 LEU 45 -5.562 5.020 -1.302
324 HD13 LEU 45 HD13 LEU 45 -3.802 5.082 -1.326
325 HD21 LEU 45 HD21 LEU 45 -5.557 2.787 -0.272
326 HD22 LEU 45 HD22 LEU 45 -4.677 2.500 1.232
327 HD23 LEU 45 HD23 LEU 45 -3.794 2.756 -0.273
328 H MET 46 HN MET 46 -2.822 6.333 3.951
329 HA MET 46 HA MET 46 -0.008 6.377 4.043
330 HB2 MET 46 HB2 MET 46 -2.014 7.749 5.844
331 HB3 MET 46 HB1 MET 46 -0.290 8.078 5.858
332 HG2 MET 46 HG2 MET 46 -0.397 8.911 3.570
333 HG3 MET 46 HG1 MET 46 -2.113 8.477 3.503
334 HE1 MET 46 HE1 MET 46 -3.678 11.029 6.017
335 HE2 MET 46 HE2 MET 46 -3.142 9.383 6.362
336 HE3 MET 46 HE3 MET 46 -3.995 9.739 4.858
337 H GLU 47 HN GLU 47 -2.371 4.986 6.171
338 HA GLU 47 HA GLU 47 -0.547 4.419 8.293
339 HB2 GLU 47 HB2 GLU 47 -3.033 4.685 8.509
340 HB3 GLU 47 HB1 GLU 47 -3.216 3.135 7.708
341 HG2 GLU 47 HG2 GLU 47 -1.981 2.045 9.500
342 HG3 GLU 47 HG1 GLU 47 -1.797 3.597 10.317
343 H THR 48 HN THR 48 -1.973 2.594 5.618
344 HA THR 48 HA THR 48 -0.890 0.086 5.913
345 HB THR 48 HB THR 48 -1.429 1.754 3.445
346 HG1 THR 48 HG1 THR 48 -2.973 -0.320 4.568
347 HG21 THR 48 HG21 THR 48 -1.060 -1.243 3.648
348 HG22 THR 48 HG22 THR 48 0.039 -0.123 2.840
349 HG23 THR 48 HG23 THR 48 -1.591 -0.372 2.209
350 H ALA 49 HN ALA 49 0.479 2.864 4.143
351 HA ALA 49 HA ALA 49 2.861 1.728 3.294
352 HB1 ALA 49 HB1 ALA 49 2.363 4.611 4.035
353 HB2 ALA 49 HB2 ALA 49 1.984 3.869 2.482
354 HB3 ALA 49 HB3 ALA 49 3.661 4.006 3.007
355 H ALA 50 HN ALA 50 2.256 3.601 6.263
356 HA ALA 50 HA ALA 50 4.910 3.428 7.224
357 HB1 ALA 50 HB1 ALA 50 3.329 5.145 7.963
358 HB2 ALA 50 HB2 ALA 50 4.026 4.264 9.326
359 HB3 ALA 50 HB3 ALA 50 2.382 3.911 8.793
360 H ARG 51 HN ARG 51 2.184 1.318 7.491
361 HA ARG 51 HA ARG 51 3.051 -0.276 9.660
362 HB2 ARG 51 HB2 ARG 51 0.735 -0.216 8.638
363 HB3 ARG 51 HB1 ARG 51 1.371 -1.157 7.302
364 HG2 ARG 51 HG2 ARG 51 0.205 -2.597 8.842
365 HG3 ARG 51 HG1 ARG 51 1.933 -2.963 8.885
366 HD2 ARG 51 HD2 ARG 51 2.214 -1.753 10.909
367 HD3 ARG 51 HD1 ARG 51 0.581 -1.102 10.822
368 HE ARG 51 HE ARG 51 0.519 -3.942 10.918
369 HH11 ARG 51 HH11 ARG 51 1.054 -1.122 12.980
370 HH12 ARG 51 HH12 ARG 51 0.502 -1.861 14.397
371 HH21 ARG 51 HH21 ARG 51 -0.268 -4.940 12.737
372 HH22 ARG 51 HH22 ARG 51 -0.322 -4.162 14.276
373 H LEU 52 HN LEU 52 3.457 -0.520 6.174
374 HA LEU 52 HA LEU 52 5.067 -2.868 6.339
375 HB2 LEU 52 HB2 LEU 52 4.578 -0.998 4.053
376 HB3 LEU 52 HB1 LEU 52 5.653 -2.375 3.935
377 HG LEU 52 HG LEU 52 2.694 -2.434 4.471
378 HD11 LEU 52 HD11 LEU 52 4.330 -3.428 2.147
379 HD12 LEU 52 HD12 LEU 52 3.274 -2.016 2.157
380 HD13 LEU 52 HD13 LEU 52 2.592 -3.628 2.357
381 HD21 LEU 52 HD21 LEU 52 2.896 -4.878 4.451
382 HD22 LEU 52 HD22 LEU 52 3.803 -4.165 5.787
383 HD23 LEU 52 HD23 LEU 52 4.653 -4.734 4.350
384 H GLU 53 HN GLU 53 5.874 0.522 6.435
385 HA GLU 53 HA GLU 53 8.560 0.440 5.804
386 HB2 GLU 53 HB2 GLU 53 7.304 1.993 8.065
387 HB3 GLU 53 HB1 GLU 53 8.910 2.275 7.421
388 HG2 GLU 53 HG2 GLU 53 7.873 2.834 5.245
389 HG3 GLU 53 HG1 GLU 53 6.290 2.678 6.016
390 H SER 54 HN SER 54 6.990 -0.293 8.826
391 HA SER 54 HA SER 54 9.157 -0.827 10.470
392 HB2 SER 54 HB2 SER 54 6.890 -0.535 11.301
393 HB3 SER 54 HB1 SER 54 6.362 -1.992 10.466
394 HG SER 54 HG SER 54 7.738 -1.673 12.838
395 H ARG 55 HN ARG 55 7.652 -2.843 8.024
396 HA ARG 55 HA ARG 55 8.922 -5.247 9.025
397 HB2 ARG 55 HB2 ARG 55 6.623 -5.292 8.125
398 HB3 ARG 55 HB1 ARG 55 7.259 -4.843 6.548
399 HG2 ARG 55 HG2 ARG 55 8.571 -6.915 6.507
400 HG3 ARG 55 HG1 ARG 55 7.872 -7.366 8.062
401 HD2 ARG 55 HD2 ARG 55 5.638 -7.288 7.045
402 HD3 ARG 55 HD1 ARG 55 6.384 -6.914 5.488
403 HE ARG 55 HE ARG 55 7.132 -9.359 6.911
404 HH11 ARG 55 HH11 ARG 55 5.708 -7.845 4.004
405 HH12 ARG 55 HH12 ARG 55 5.539 -9.334 3.208
406 HH21 ARG 55 HH21 ARG 55 6.894 -11.349 5.725
407 HH22 ARG 55 HH22 ARG 55 6.202 -11.316 4.174
408 H TYR 56 HN TYR 56 9.291 -2.998 6.356
409 HA TYR 56 HA TYR 56 11.316 -4.775 5.195
410 HB2 TYR 56 HB2 TYR 56 10.017 -2.355 3.963
411 HB3 TYR 56 HB1 TYR 56 11.138 -3.446 3.160
412 HD1 TYR 56 HD2 TYR 56 10.412 -5.935 2.978
413 HD2 TYR 56 HD1 TYR 56 7.754 -2.760 3.903
414 HE1 TYR 56 HE2 TYR 56 8.503 -7.339 2.320
415 HE2 TYR 56 HE1 TYR 56 5.863 -4.146 3.259
416 HH TYR 56 HH TYR 56 5.397 -6.063 1.855
417 H GLY 57 HN GLY 57 11.159 -1.916 7.038
418 HA2 GLY 57 HA2 GLY 57 12.855 -0.549 7.764
419 HA3 GLY 57 HA1 GLY 57 13.998 -1.591 6.913
420 H VAL 58 HN VAL 58 11.237 0.219 5.758
421 HA VAL 58 HA VAL 58 13.007 1.604 3.881
422 HB VAL 58 HB VAL 58 11.106 1.817 2.310
423 HG11 VAL 58 HG11 VAL 58 12.639 -0.048 2.028
424 HG12 VAL 58 HG12 VAL 58 10.997 -0.518 1.580
425 HG13 VAL 58 HG13 VAL 58 11.663 -1.022 3.131
426 HG21 VAL 58 HG21 VAL 58 9.051 0.494 2.650
427 HG22 VAL 58 HG22 VAL 58 9.251 1.723 3.897
428 HG23 VAL 58 HG23 VAL 58 9.623 0.037 4.257
429 H SER 59 HN SER 59 11.774 3.759 3.053
430 HA SER 59 HA SER 59 10.499 4.927 5.375
431 HB2 SER 59 HB2 SER 59 12.776 6.170 3.822
432 HB3 SER 59 HB1 SER 59 11.887 6.922 5.153
433 HG SER 59 HG SER 59 12.597 4.582 6.009
434 H ILE 60 HN ILE 60 8.607 5.321 4.692
435 HA ILE 60 HA ILE 60 8.208 6.429 1.998
436 HB ILE 60 HB ILE 60 6.226 4.929 3.749
437 HG12 ILE 60 HG12 ILE 60 7.595 4.038 1.193
438 HG13 ILE 60 HG11 ILE 60 8.037 3.498 2.808
439 HG21 ILE 60 HG21 ILE 60 4.773 4.969 1.768
440 HG22 ILE 60 HG22 ILE 60 5.967 5.951 0.917
441 HG23 ILE 60 HG23 ILE 60 5.143 6.599 2.335
442 HD11 ILE 60 HD11 ILE 60 6.683 1.844 1.648
443 HD12 ILE 60 HD12 ILE 60 5.385 3.025 1.460
444 HD13 ILE 60 HD13 ILE 60 5.845 2.469 3.069
445 HA PRO 61 HA PRO 61 7.231 10.056 4.456
446 HB2 PRO 61 HB2 PRO 61 6.513 11.196 1.830
447 HB3 PRO 61 HB1 PRO 61 7.713 11.764 2.995
448 HG2 PRO 61 HG2 PRO 61 8.426 10.623 0.667
449 HG3 PRO 61 HG1 PRO 61 9.374 10.407 2.150
450 HD2 PRO 61 HD2 PRO 61 7.442 8.539 0.841
451 HD3 PRO 61 HD1 PRO 61 8.993 8.187 1.640
452 H ASP 62 HN ASP 62 5.443 10.002 5.456
453 HA ASP 62 HA ASP 62 3.175 8.645 5.068
454 HB2 ASP 62 HB2 ASP 62 3.702 9.657 7.157
455 HB3 ASP 62 HB1 ASP 62 3.499 11.269 6.488
456 H ASP 63 HN ASP 63 3.449 12.063 4.101
457 HA ASP 63 HA ASP 63 0.740 12.324 3.284
458 HB2 ASP 63 HB2 ASP 63 2.074 14.260 3.895
459 HB3 ASP 63 HB1 ASP 63 3.179 13.961 2.565
460 H VAL 64 HN VAL 64 3.458 10.969 1.689
461 HA VAL 64 HA VAL 64 2.632 11.428 -1.013
462 HB VAL 64 HB VAL 64 4.575 9.446 0.126
463 HG11 VAL 64 HG11 VAL 64 3.925 8.779 -2.149
464 HG12 VAL 64 HG12 VAL 64 5.584 9.375 -2.166
465 HG13 VAL 64 HG13 VAL 64 4.274 10.402 -2.744
466 HG21 VAL 64 HG21 VAL 64 5.066 12.172 -1.064
467 HG22 VAL 64 HG22 VAL 64 6.327 11.052 -0.538
468 HG23 VAL 64 HG23 VAL 64 5.199 11.729 0.636
469 H ALA 65 HN ALA 65 1.762 9.157 1.405
470 HA ALA 65 HA ALA 65 0.947 7.138 -0.454
471 HB1 ALA 65 HB1 ALA 65 1.622 6.544 1.834
472 HB2 ALA 65 HB2 ALA 65 0.005 5.966 1.447
473 HB3 ALA 65 HB3 ALA 65 0.208 7.385 2.467
474 H GLY 66 HN GLY 66 -0.245 10.099 0.207
475 HA2 GLY 66 HA2 GLY 66 -3.013 9.382 -0.361
476 HA3 GLY 66 HA1 GLY 66 -2.403 10.997 0.016
477 H ARG 67 HN ARG 67 -0.248 9.685 -2.070
478 HA ARG 67 HA ARG 67 -1.422 11.081 -4.354
479 HB2 ARG 67 HB2 ARG 67 1.345 9.994 -3.898
480 HB3 ARG 67 HB1 ARG 67 0.801 10.618 -5.440
481 HG2 ARG 67 HG2 ARG 67 0.376 12.794 -4.298
482 HG3 ARG 67 HG1 ARG 67 1.165 12.112 -2.869
483 HD2 ARG 67 HD2 ARG 67 2.745 13.398 -4.249
484 HD3 ARG 67 HD1 ARG 67 3.189 11.695 -4.152
485 HE ARG 67 HE ARG 67 1.555 12.213 -6.434
486 HH11 ARG 67 HH11 ARG 67 4.927 12.423 -5.323
487 HH12 ARG 67 HH12 ARG 67 5.581 12.416 -6.897
488 HH21 ARG 67 HH21 ARG 67 2.453 12.195 -8.569
489 HH22 ARG 67 HH22 ARG 67 4.133 12.278 -8.789
490 H VAL 68 HN VAL 68 -0.820 7.887 -3.225
491 HA VAL 68 HA VAL 68 -0.486 6.672 -5.739
492 HB VAL 68 HB VAL 68 -0.941 4.495 -4.554
493 HG11 VAL 68 HG11 VAL 68 1.291 5.415 -4.752
494 HG12 VAL 68 HG12 VAL 68 1.086 4.598 -3.198
495 HG13 VAL 68 HG13 VAL 68 1.042 6.362 -3.282
496 HG21 VAL 68 HG21 VAL 68 -2.476 5.346 -2.838
497 HG22 VAL 68 HG22 VAL 68 -1.136 6.261 -2.117
498 HG23 VAL 68 HG23 VAL 68 -1.094 4.497 -2.136
499 H ASP 69 HN ASP 69 -1.790 6.732 -7.230
500 HA ASP 69 HA ASP 69 -4.598 7.218 -6.961
501 HB2 ASP 69 HB2 ASP 69 -3.076 7.962 -8.871
502 HB3 ASP 69 HB1 ASP 69 -3.156 6.314 -9.437
503 H THR 70 HN THR 70 -2.660 4.432 -7.954
504 HA THR 70 HA THR 70 -5.014 2.746 -7.554
505 HB THR 70 HB THR 70 -4.149 1.277 -9.363
506 HG1 THR 70 HG1 THR 70 -2.537 2.258 -10.757
507 HG21 THR 70 HG21 THR 70 -5.819 2.977 -9.889
508 HG22 THR 70 HG22 THR 70 -4.713 2.746 -11.248
509 HG23 THR 70 HG23 THR 70 -4.537 4.155 -10.184
510 HA PRO 71 HA PRO 71 -2.591 0.406 -4.691
511 HB2 PRO 71 HB2 PRO 71 -3.586 -2.079 -5.986
512 HB3 PRO 71 HB1 PRO 71 -3.735 -1.553 -4.303
513 HG2 PRO 71 HG2 PRO 71 -5.844 -1.441 -5.895
514 HG3 PRO 71 HG1 PRO 71 -5.504 -0.100 -4.780
515 HD2 PRO 71 HD2 PRO 71 -4.926 -0.310 -7.716
516 HD3 PRO 71 HD1 PRO 71 -5.662 1.036 -6.814
517 H ARG 72 HN ARG 72 -2.347 -0.487 -8.078
518 HA ARG 72 HA ARG 72 0.049 -2.013 -7.816
519 HB2 ARG 72 HB2 ARG 72 -1.458 -2.058 -9.828
520 HB3 ARG 72 HB1 ARG 72 -0.882 -0.451 -10.240
521 HG2 ARG 72 HG2 ARG 72 1.399 -1.338 -10.467
522 HG3 ARG 72 HG1 ARG 72 0.796 -2.954 -10.088
523 HD2 ARG 72 HD2 ARG 72 0.014 -1.241 -12.444
524 HD3 ARG 72 HD1 ARG 72 1.021 -2.686 -12.489
525 HE ARG 72 HE ARG 72 -1.025 -3.853 -11.594
526 HH11 ARG 72 HH11 ARG 72 -1.101 -1.186 -13.923
527 HH12 ARG 72 HH12 ARG 72 -2.699 -1.474 -14.437
528 HH21 ARG 72 HH21 ARG 72 -3.254 -4.285 -12.347
529 HH22 ARG 72 HH22 ARG 72 -3.935 -3.233 -13.510
530 H GLU 73 HN GLU 73 -0.690 1.380 -8.210
531 HA GLU 73 HA GLU 73 1.952 2.287 -8.687
532 HB2 GLU 73 HB2 GLU 73 -0.177 3.529 -9.212
533 HB3 GLU 73 HB1 GLU 73 -0.396 3.752 -7.495
534 HG2 GLU 73 HG2 GLU 73 1.565 5.103 -7.348
535 HG3 GLU 73 HG1 GLU 73 1.954 4.789 -9.041
536 H LEU 74 HN LEU 74 -0.064 1.810 -5.862
537 HA LEU 74 HA LEU 74 1.659 2.894 -3.902
538 HB2 LEU 74 HB2 LEU 74 -0.833 2.232 -3.728
539 HB3 LEU 74 HB1 LEU 74 -0.282 0.596 -3.487
540 HG LEU 74 HG LEU 74 0.305 2.925 -1.630
541 HD11 LEU 74 HD11 LEU 74 -2.047 2.377 -1.640
542 HD12 LEU 74 HD12 LEU 74 -1.300 1.871 -0.127
543 HD13 LEU 74 HD13 LEU 74 -1.673 0.675 -1.368
544 HD21 LEU 74 HD21 LEU 74 1.024 1.224 -0.025
545 HD22 LEU 74 HD22 LEU 74 2.010 1.153 -1.490
546 HD23 LEU 74 HD23 LEU 74 0.741 -0.038 -1.223
547 H LEU 75 HN LEU 75 1.233 -0.361 -5.201
548 HA LEU 75 HA LEU 75 3.141 -1.730 -3.692
549 HB2 LEU 75 HB2 LEU 75 1.450 -2.812 -5.113
550 HB3 LEU 75 HB1 LEU 75 2.243 -2.194 -6.541
551 HG LEU 75 HG LEU 75 4.201 -3.635 -6.048
552 HD11 LEU 75 HD11 LEU 75 3.977 -3.756 -3.631
553 HD12 LEU 75 HD12 LEU 75 4.019 -5.372 -4.342
554 HD13 LEU 75 HD13 LEU 75 2.486 -4.682 -3.803
555 HD21 LEU 75 HD21 LEU 75 2.415 -4.425 -7.525
556 HD22 LEU 75 HD22 LEU 75 1.569 -5.115 -6.138
557 HD23 LEU 75 HD23 LEU 75 3.140 -5.752 -6.620
558 H ASP 76 HN ASP 76 3.436 -0.033 -6.781
559 HA ASP 76 HA ASP 76 6.106 -0.543 -7.408
560 HB2 ASP 76 HB2 ASP 76 4.605 0.534 -8.980
561 HB3 ASP 76 HB1 ASP 76 4.500 1.956 -7.948
562 H LEU 77 HN LEU 77 4.736 2.007 -5.423
563 HA LEU 77 HA LEU 77 6.989 3.531 -4.876
564 HB2 LEU 77 HB2 LEU 77 4.795 4.264 -4.244
565 HB3 LEU 77 HB1 LEU 77 4.570 2.875 -3.209
566 HG LEU 77 HG LEU 77 6.264 3.773 -1.658
567 HD11 LEU 77 HD11 LEU 77 6.280 6.165 -3.484
568 HD12 LEU 77 HD12 LEU 77 7.612 5.036 -3.220
569 HD13 LEU 77 HD13 LEU 77 7.053 6.062 -1.900
570 HD21 LEU 77 HD21 LEU 77 4.907 5.616 -0.801
571 HD22 LEU 77 HD22 LEU 77 3.906 4.254 -1.312
572 HD23 LEU 77 HD23 LEU 77 4.036 5.687 -2.333
573 H ILE 78 HN ILE 78 5.744 0.712 -3.172
574 HA ILE 78 HA ILE 78 7.905 0.747 -1.297
575 HB ILE 78 HB ILE 78 5.854 -1.456 -1.735
576 HG12 ILE 78 HG12 ILE 78 5.844 0.926 0.134
577 HG13 ILE 78 HG11 ILE 78 4.819 0.725 -1.278
578 HG21 ILE 78 HG21 ILE 78 7.841 -2.173 -0.443
579 HG22 ILE 78 HG22 ILE 78 6.408 -2.088 0.579
580 HG23 ILE 78 HG23 ILE 78 7.615 -0.804 0.649
581 HD11 ILE 78 HD11 ILE 78 4.781 -0.955 1.210
582 HD12 ILE 78 HD12 ILE 78 3.748 -1.191 -0.202
583 HD13 ILE 78 HD13 ILE 78 3.608 0.282 0.762
584 H ASN 79 HN ASN 79 7.184 -0.971 -4.266
585 HA ASN 79 HA ASN 79 9.277 -2.866 -4.230
586 HB2 ASN 79 HB2 ASN 79 8.012 -1.378 -6.555
587 HB3 ASN 79 HB1 ASN 79 9.285 -2.556 -6.793
588 HD21 ASN 79 HD21 ASN 79 8.311 -4.463 -4.837
589 HD22 ASN 79 HD22 ASN 79 6.868 -5.132 -5.531
590 H GLY 80 HN GLY 80 9.190 0.472 -5.397
591 HA2 GLY 80 HA2 GLY 80 11.855 0.695 -6.227
592 HA3 GLY 80 HA1 GLY 80 10.817 2.029 -5.735
593 H ALA 81 HN ALA 81 10.351 1.475 -3.118
594 HA ALA 81 HA ALA 81 12.650 2.403 -1.815
595 HB1 ALA 81 HB1 ALA 81 11.425 2.003 0.262
596 HB2 ALA 81 HB2 ALA 81 10.255 1.008 -0.604
597 HB3 ALA 81 HB3 ALA 81 10.376 2.734 -0.950
598 H LEU 82 HN LEU 82 11.369 -0.851 -2.206
599 HA LEU 82 HA LEU 82 13.275 -2.144 -0.547
600 HB2 LEU 82 HB2 LEU 82 11.510 -3.203 -2.739
601 HB3 LEU 82 HB1 LEU 82 12.562 -4.223 -1.773
602 HG LEU 82 HG LEU 82 10.297 -2.546 -0.700
603 HD11 LEU 82 HD11 LEU 82 9.518 -4.437 -2.021
604 HD12 LEU 82 HD12 LEU 82 9.211 -4.686 -0.303
605 HD13 LEU 82 HD13 LEU 82 10.559 -5.515 -1.090
606 HD21 LEU 82 HD21 LEU 82 12.112 -4.540 0.610
607 HD22 LEU 82 HD22 LEU 82 10.720 -3.740 1.358
608 HD23 LEU 82 HD23 LEU 82 12.123 -2.789 0.857
609 H ALA 83 HN ALA 83 13.192 -1.324 -3.930
610 HA ALA 83 HA ALA 83 15.498 -2.777 -4.682
611 HB1 ALA 83 HB1 ALA 83 15.539 -1.337 -6.668
612 HB2 ALA 83 HB2 ALA 83 14.365 -0.257 -5.912
613 HB3 ALA 83 HB3 ALA 83 13.899 -1.903 -6.336
614 H GLU 84 HN GLU 84 14.977 0.358 -3.260
615 HA GLU 84 HA GLU 84 17.757 1.124 -3.422
616 HB2 GLU 84 HB2 GLU 84 15.469 2.388 -1.888
617 HB3 GLU 84 HB1 GLU 84 17.061 3.101 -2.121
618 HG2 GLU 84 HG2 GLU 84 16.659 3.131 -4.548
619 HG3 GLU 84 HG1 GLU 84 15.050 2.475 -4.269
620 H ALA 85 HN ALA 85 16.081 -0.997 -1.556
621 HA ALA 85 HA ALA 85 17.772 -0.627 0.813
622 HB1 ALA 85 HB1 ALA 85 16.167 -2.087 1.967
623 HB2 ALA 85 HB2 ALA 85 15.266 -2.286 0.462
624 HB3 ALA 85 HB3 ALA 85 15.350 -0.706 1.233
625 H ALA 86 HN ALA 86 18.194 -1.947 -1.946
626 HA ALA 86 HA ALA 86 19.237 -4.492 -0.938
627 HB1 ALA 86 HB1 ALA 86 17.452 -4.819 -2.592
628 HB2 ALA 86 HB2 ALA 86 19.008 -5.353 -3.227
629 HB3 ALA 86 HB3 ALA 86 18.330 -3.806 -3.741
630 H28 SXV 87 H28A SXV 87 -5.884 13.193 4.405
631 H28A SXV 87 H28B SXV 87 -4.643 11.998 4.044
632 H30 SXV 87 H30C SXV 87 -3.185 12.847 5.705
633 H30A SXV 87 H30A SXV 87 -4.435 14.006 6.159
634 H30B SXV 87 H30B SXV 87 -2.800 14.567 5.818
635 H31 SXV 87 H31C SXV 87 -1.932 14.516 3.463
636 H31A SXV 87 H31A SXV 87 -2.923 13.769 2.207
637 H31B SXV 87 H31B SXV 87 -2.270 12.788 3.515
638 H32 SXV 87 H32A SXV 87 -3.681 16.223 4.149
639 HO33 SXV 87 H33A SXV 87 -6.360 15.576 4.184
640 HN36 SXV 87 H36A SXV 87 -3.109 15.795 1.712
641 H37 SXV 87 H37B SXV 87 -5.452 16.183 -0.049
642 H37A SXV 87 H37A SXV 87 -3.938 15.402 -0.516
643 H38 SXV 87 H38B SXV 87 -3.888 17.528 -1.478
644 H38A SXV 87 H38A SXV 87 -2.738 17.557 -0.174
645 HN41 SXV 87 H41A SXV 87 -3.321 19.935 -0.900
646 H42 SXV 87 H42B SXV 87 -4.051 21.579 0.955
647 H42A SXV 87 H42A SXV 87 -5.656 21.019 0.504
648 H43 SXV 87 H43B SXV 87 -5.331 21.819 -1.727
649 H43A SXV 87 H43A SXV 87 -4.983 23.125 -0.600
650 H1 SXV 87 H1B SXV 87 -4.161 23.105 -3.654
651 H1A SXV 87 H1A SXV 87 -3.779 24.451 -2.559
652 H2 SXV 87 H2A SXV 87 -1.780 23.068 -4.287
653 H2A SXV 87 H2B SXV 87 -1.462 24.373 -3.144
654 H4 SXV 87 H4C SXV 87 -4.034 26.124 -3.945
655 H4A SXV 87 H4A SXV 87 -3.243 26.923 -5.307
656 H4B SXV 87 H4B SXV 87 -2.401 26.776 -3.759
Start of MODEL 18
1 H1 MET 1 HT1 MET 1 20.399 -8.851 -3.969
2 H2 MET 1 HT2 MET 1 20.660 -7.351 -4.685
3 H3 MET 1 HT3 MET 1 21.130 -8.757 -5.510
4 HA MET 1 HA MET 1 19.098 -7.765 -6.366
5 HB2 MET 1 HB2 MET 1 18.648 -10.345 -4.846
6 HB3 MET 1 HB1 MET 1 17.483 -9.673 -5.972
7 HG2 MET 1 HG2 MET 1 19.197 -9.842 -7.756
8 HG3 MET 1 HG1 MET 1 20.259 -10.646 -6.595
9 HE1 MET 1 HE1 MET 1 20.490 -12.716 -8.269
10 HE2 MET 1 HE2 MET 1 19.421 -11.911 -9.416
11 HE3 MET 1 HE3 MET 1 19.109 -13.582 -8.940
12 H ALA 2 HN ALA 2 16.824 -7.323 -5.971
13 HA ALA 2 HA ALA 2 16.622 -5.848 -3.488
14 HB1 ALA 2 HB1 ALA 2 16.093 -4.736 -5.597
15 HB2 ALA 2 HB2 ALA 2 14.684 -4.811 -4.544
16 HB3 ALA 2 HB3 ALA 2 14.828 -5.924 -5.908
17 H THR 3 HN THR 3 15.091 -6.244 -1.929
18 HA THR 3 HA THR 3 13.790 -8.850 -1.950
19 HB THR 3 HB THR 3 13.678 -6.669 0.054
20 HG1 THR 3 HG1 THR 3 15.791 -8.281 -0.694
21 HG21 THR 3 HG21 THR 3 13.450 -9.673 0.328
22 HG22 THR 3 HG22 THR 3 12.127 -8.510 0.440
23 HG23 THR 3 HG23 THR 3 13.385 -8.537 1.676
24 H LEU 4 HN LEU 4 11.881 -8.740 -3.174
25 HA LEU 4 HA LEU 4 10.319 -6.279 -2.866
26 HB2 LEU 4 HB2 LEU 4 10.272 -8.270 -5.129
27 HB3 LEU 4 HB1 LEU 4 9.320 -6.803 -5.026
28 HG LEU 4 HG LEU 4 12.325 -6.954 -5.284
29 HD11 LEU 4 HD11 LEU 4 11.953 -5.996 -7.495
30 HD12 LEU 4 HD12 LEU 4 10.210 -6.098 -7.244
31 HD13 LEU 4 HD13 LEU 4 11.177 -7.572 -7.325
32 HD21 LEU 4 HD21 LEU 4 11.646 -5.012 -3.971
33 HD22 LEU 4 HD22 LEU 4 10.494 -4.556 -5.225
34 HD23 LEU 4 HD23 LEU 4 12.225 -4.521 -5.563
35 H LEU 5 HN LEU 5 8.215 -6.397 -2.333
36 HA LEU 5 HA LEU 5 7.243 -9.000 -1.522
37 HB2 LEU 5 HB2 LEU 5 5.485 -7.745 -0.271
38 HB3 LEU 5 HB1 LEU 5 7.106 -7.388 0.251
39 HG LEU 5 HG LEU 5 6.924 -5.221 -1.097
40 HD11 LEU 5 HD11 LEU 5 4.003 -5.933 -1.072
41 HD12 LEU 5 HD12 LEU 5 5.031 -5.804 -2.500
42 HD13 LEU 5 HD13 LEU 5 4.689 -4.374 -1.529
43 HD21 LEU 5 HD21 LEU 5 5.063 -5.666 1.209
44 HD22 LEU 5 HD22 LEU 5 5.655 -4.095 0.652
45 HD23 LEU 5 HD23 LEU 5 6.780 -5.286 1.310
46 H THR 6 HN THR 6 5.091 -9.664 -2.119
47 HA THR 6 HA THR 6 4.603 -8.884 -4.854
48 HB THR 6 HB THR 6 3.163 -10.961 -4.843
49 HG1 THR 6 HG1 THR 6 4.258 -12.194 -2.774
50 HG21 THR 6 HG21 THR 6 5.104 -12.476 -4.861
51 HG22 THR 6 HG22 THR 6 6.066 -11.241 -4.044
52 HG23 THR 6 HG23 THR 6 5.469 -10.957 -5.680
53 H THR 7 HN THR 7 2.051 -9.317 -5.392
54 HA THR 7 HA THR 7 0.732 -7.134 -4.195
55 HB THR 7 HB THR 7 -0.525 -9.281 -5.925
56 HG1 THR 7 HG1 THR 7 0.111 -7.915 -7.639
57 HG21 THR 7 HG21 THR 7 -1.965 -7.419 -6.651
58 HG22 THR 7 HG22 THR 7 -1.103 -6.327 -5.564
59 HG23 THR 7 HG23 THR 7 -2.072 -7.642 -4.904
60 H ASP 8 HN ASP 8 0.465 -10.670 -3.828
61 HA ASP 8 HA ASP 8 -1.711 -10.546 -2.006
62 HB2 ASP 8 HB2 ASP 8 0.162 -12.676 -2.850
63 HB3 ASP 8 HB1 ASP 8 -0.533 -12.865 -1.247
64 H ASP 9 HN ASP 9 1.602 -9.907 -1.628
65 HA ASP 9 HA ASP 9 1.585 -10.245 1.234
66 HB2 ASP 9 HB2 ASP 9 3.707 -10.361 -0.169
67 HB3 ASP 9 HB1 ASP 9 3.556 -8.626 -0.404
68 H LEU 10 HN LEU 10 1.421 -7.602 -1.077
69 HA LEU 10 HA LEU 10 1.022 -5.484 0.714
70 HB2 LEU 10 HB2 LEU 10 1.525 -5.190 -1.680
71 HB3 LEU 10 HB1 LEU 10 -0.050 -5.834 -2.094
72 HG LEU 10 HG LEU 10 -1.104 -3.892 -0.965
73 HD11 LEU 10 HD11 LEU 10 0.270 -1.959 -0.384
74 HD12 LEU 10 HD12 LEU 10 1.725 -2.898 -0.714
75 HD13 LEU 10 HD13 LEU 10 0.659 -3.362 0.612
76 HD21 LEU 10 HD21 LEU 10 0.884 -3.209 -3.129
77 HD22 LEU 10 HD22 LEU 10 -0.532 -2.252 -2.695
78 HD23 LEU 10 HD23 LEU 10 -0.733 -3.867 -3.372
79 H ARG 11 HN ARG 11 -1.198 -7.717 -0.808
80 HA ARG 11 HA ARG 11 -3.706 -6.892 -0.042
81 HB2 ARG 11 HB2 ARG 11 -3.352 -8.835 -1.427
82 HB3 ARG 11 HB1 ARG 11 -2.498 -9.648 -0.137
83 HG2 ARG 11 HG2 ARG 11 -4.619 -9.727 1.145
84 HG3 ARG 11 HG1 ARG 11 -5.442 -9.051 -0.274
85 HD2 ARG 11 HD2 ARG 11 -4.691 -10.918 -1.622
86 HD3 ARG 11 HD1 ARG 11 -3.802 -11.572 -0.251
87 HE ARG 11 HE ARG 11 -6.373 -11.379 0.616
88 HH11 ARG 11 HH11 ARG 11 -4.677 -13.085 -1.981
89 HH12 ARG 11 HH12 ARG 11 -5.845 -14.292 -2.187
90 HH21 ARG 11 HH21 ARG 11 -7.933 -13.068 0.456
91 HH22 ARG 11 HH22 ARG 11 -7.769 -14.306 -0.732
92 H ARG 12 HN ARG 12 -1.612 -9.091 1.779
93 HA ARG 12 HA ARG 12 -3.283 -9.215 4.047
94 HB2 ARG 12 HB2 ARG 12 -0.406 -9.948 3.616
95 HB3 ARG 12 HB1 ARG 12 -1.259 -10.239 5.129
96 HG2 ARG 12 HG2 ARG 12 -2.799 -11.713 4.061
97 HG3 ARG 12 HG1 ARG 12 -2.169 -11.289 2.466
98 HD2 ARG 12 HD2 ARG 12 -0.518 -12.565 4.625
99 HD3 ARG 12 HD1 ARG 12 -1.383 -13.480 3.391
100 HE ARG 12 HE ARG 12 -0.044 -12.336 1.740
101 HH11 ARG 12 HH11 ARG 12 1.155 -12.000 5.058
102 HH12 ARG 12 HH12 ARG 12 2.797 -12.120 4.635
103 HH21 ARG 12 HH21 ARG 12 2.285 -12.451 1.140
104 HH22 ARG 12 HH22 ARG 12 3.427 -12.257 2.382
105 H ALA 13 HN ALA 13 -0.507 -7.253 3.241
106 HA ALA 13 HA ALA 13 -0.126 -6.025 5.746
107 HB1 ALA 13 HB1 ALA 13 1.104 -4.338 4.500
108 HB2 ALA 13 HB2 ALA 13 0.445 -4.961 2.991
109 HB3 ALA 13 HB3 ALA 13 1.531 -5.962 3.960
110 H LEU 14 HN LEU 14 -2.174 -5.255 3.000
111 HA LEU 14 HA LEU 14 -3.031 -2.733 3.904
112 HB2 LEU 14 HB2 LEU 14 -3.177 -3.602 1.558
113 HB3 LEU 14 HB1 LEU 14 -4.471 -4.659 2.069
114 HG LEU 14 HG LEU 14 -5.835 -2.652 2.636
115 HD11 LEU 14 HD11 LEU 14 -4.017 -1.077 3.027
116 HD12 LEU 14 HD12 LEU 14 -5.127 -0.474 1.799
117 HD13 LEU 14 HD13 LEU 14 -3.571 -1.156 1.323
118 HD21 LEU 14 HD21 LEU 14 -6.313 -2.036 0.323
119 HD22 LEU 14 HD22 LEU 14 -6.085 -3.774 0.488
120 HD23 LEU 14 HD23 LEU 14 -4.798 -2.778 -0.190
121 H VAL 15 HN VAL 15 -4.019 -5.986 4.616
122 HA VAL 15 HA VAL 15 -6.483 -5.198 5.848
123 HB VAL 15 HB VAL 15 -5.020 -7.856 6.135
124 HG11 VAL 15 HG11 VAL 15 -7.189 -8.794 6.766
125 HG12 VAL 15 HG12 VAL 15 -7.911 -7.188 6.682
126 HG13 VAL 15 HG13 VAL 15 -6.679 -7.537 7.894
127 HG21 VAL 15 HG21 VAL 15 -7.213 -7.069 4.221
128 HG22 VAL 15 HG22 VAL 15 -6.556 -8.693 4.416
129 HG23 VAL 15 HG23 VAL 15 -5.530 -7.394 3.807
130 H GLU 16 HN GLU 16 -3.245 -5.128 6.818
131 HA GLU 16 HA GLU 16 -3.545 -5.527 9.599
132 HB2 GLU 16 HB2 GLU 16 -1.351 -4.130 8.057
133 HB3 GLU 16 HB1 GLU 16 -1.337 -4.378 9.796
134 HG2 GLU 16 HG2 GLU 16 -1.472 -6.564 7.734
135 HG3 GLU 16 HG1 GLU 16 -0.050 -6.059 8.653
136 H SER 17 HN SER 17 -3.719 -2.669 7.576
137 HA SER 17 HA SER 17 -3.711 -0.775 9.643
138 HB2 SER 17 HB2 SER 17 -5.016 -0.479 6.947
139 HB3 SER 17 HB1 SER 17 -4.255 0.761 7.944
140 HG SER 17 HG SER 17 -3.046 -0.209 6.106
141 H ALA 18 HN ALA 18 -6.415 -1.983 7.648
142 HA ALA 18 HA ALA 18 -8.411 -0.685 9.157
143 HB1 ALA 18 HB1 ALA 18 -8.716 -3.011 7.274
144 HB2 ALA 18 HB2 ALA 18 -8.685 -1.310 6.807
145 HB3 ALA 18 HB3 ALA 18 -9.994 -1.923 7.817
146 H GLY 19 HN GLY 19 -7.328 -4.074 9.127
147 HA2 GLY 19 HA2 GLY 19 -7.403 -5.331 11.179
148 HA3 GLY 19 HA1 GLY 19 -8.880 -4.458 11.594
149 H GLU 20 HN GLU 20 -10.743 -4.753 10.113
150 HA GLU 20 HA GLU 20 -10.651 -7.421 8.903
151 HB2 GLU 20 HB2 GLU 20 -13.043 -6.059 10.122
152 HB3 GLU 20 HB1 GLU 20 -13.077 -7.582 9.261
153 HG2 GLU 20 HG2 GLU 20 -11.461 -8.427 11.025
154 HG3 GLU 20 HG1 GLU 20 -11.882 -6.968 11.932
155 H THR 21 HN THR 21 -11.107 -7.586 6.857
156 HA THR 21 HA THR 21 -12.240 -5.281 5.501
157 HB THR 21 HB THR 21 -11.210 -6.497 3.472
158 HG1 THR 21 HG1 THR 21 -9.974 -8.132 3.822
159 HG21 THR 21 HG21 THR 21 -8.980 -5.536 3.907
160 HG22 THR 21 HG22 THR 21 -9.385 -5.382 5.619
161 HG23 THR 21 HG23 THR 21 -10.260 -4.436 4.417
162 H ASP 22 HN ASP 22 -14.264 -6.250 6.479
163 HA ASP 22 HA ASP 22 -15.169 -8.785 5.474
164 HB2 ASP 22 HB2 ASP 22 -17.237 -8.385 6.703
165 HB3 ASP 22 HB1 ASP 22 -15.856 -8.012 7.723
166 H GLY 23 HN GLY 23 -15.543 -5.463 4.598
167 HA2 GLY 23 HA2 GLY 23 -17.376 -6.279 2.442
168 HA3 GLY 23 HA1 GLY 23 -17.357 -4.671 3.172
169 H THR 24 HN THR 24 -14.812 -6.809 2.145
170 HA THR 24 HA THR 24 -13.991 -4.959 0.088
171 HB THR 24 HB THR 24 -12.205 -5.664 2.436
172 HG1 THR 24 HG1 THR 24 -13.952 -3.661 1.973
173 HG21 THR 24 HG21 THR 24 -10.969 -5.451 0.309
174 HG22 THR 24 HG22 THR 24 -10.602 -4.111 1.398
175 HG23 THR 24 HG23 THR 24 -11.705 -3.870 0.047
176 H ASP 25 HN ASP 25 -14.537 -6.822 -1.194
177 HA ASP 25 HA ASP 25 -12.931 -9.198 -0.945
178 HB2 ASP 25 HB2 ASP 25 -15.128 -9.257 -2.143
179 HB3 ASP 25 HB1 ASP 25 -14.468 -8.180 -3.368
180 H LEU 26 HN LEU 26 -10.908 -8.586 -0.821
181 HA LEU 26 HA LEU 26 -9.796 -6.597 -2.590
182 HB2 LEU 26 HB2 LEU 26 -9.330 -6.756 -0.124
183 HB3 LEU 26 HB1 LEU 26 -8.462 -8.240 -0.437
184 HG LEU 26 HG LEU 26 -6.820 -6.983 -1.777
185 HD11 LEU 26 HD11 LEU 26 -6.882 -4.539 -1.747
186 HD12 LEU 26 HD12 LEU 26 -8.429 -4.585 -0.897
187 HD13 LEU 26 HD13 LEU 26 -8.308 -5.201 -2.545
188 HD21 LEU 26 HD21 LEU 26 -6.475 -7.332 0.641
189 HD22 LEU 26 HD22 LEU 26 -7.299 -5.800 0.963
190 HD23 LEU 26 HD23 LEU 26 -5.776 -5.814 0.081
191 H SER 27 HN SER 27 -9.247 -9.969 -1.737
192 HA SER 27 HA SER 27 -8.546 -11.771 -2.872
193 HB2 SER 27 HB2 SER 27 -10.222 -11.004 -4.581
194 HB3 SER 27 HB1 SER 27 -8.945 -10.098 -5.381
195 HG SER 27 HG SER 27 -9.644 -12.403 -5.981
196 H GLY 28 HN GLY 28 -6.833 -12.268 -4.879
197 HA2 GLY 28 HA2 GLY 28 -4.354 -11.370 -3.721
198 HA3 GLY 28 HA1 GLY 28 -4.544 -12.561 -4.996
199 H ASP 29 HN ASP 29 -6.277 -10.413 -6.389
200 HA ASP 29 HA ASP 29 -4.071 -8.703 -7.238
201 HB2 ASP 29 HB2 ASP 29 -4.240 -10.479 -8.937
202 HB3 ASP 29 HB1 ASP 29 -5.952 -10.120 -9.146
203 H PHE 30 HN PHE 30 -4.584 -6.782 -6.862
204 HA PHE 30 HA PHE 30 -7.228 -5.714 -7.498
205 HB2 PHE 30 HB2 PHE 30 -7.350 -4.618 -5.271
206 HB3 PHE 30 HB1 PHE 30 -7.378 -6.370 -5.131
207 HD1 PHE 30 HD2 PHE 30 -5.323 -7.562 -4.321
208 HD2 PHE 30 HD1 PHE 30 -5.631 -3.317 -4.266
209 HE1 PHE 30 HE2 PHE 30 -3.447 -7.448 -2.736
210 HE2 PHE 30 HE1 PHE 30 -3.759 -3.203 -2.686
211 HZ PHE 30 HZ PHE 30 -2.694 -5.260 -1.885
212 H LEU 31 HN LEU 31 -4.436 -5.557 -8.573
213 HA LEU 31 HA LEU 31 -3.098 -3.361 -7.530
214 HB2 LEU 31 HB2 LEU 31 -2.275 -5.487 -8.681
215 HB3 LEU 31 HB1 LEU 31 -2.754 -4.693 -10.174
216 HG LEU 31 HG LEU 31 -1.399 -2.873 -9.634
217 HD11 LEU 31 HD11 LEU 31 -1.226 -3.119 -7.216
218 HD12 LEU 31 HD12 LEU 31 0.405 -3.175 -7.886
219 HD13 LEU 31 HD13 LEU 31 -0.400 -4.667 -7.401
220 HD21 LEU 31 HD21 LEU 31 0.020 -5.527 -9.833
221 HD22 LEU 31 HD22 LEU 31 0.771 -3.974 -10.201
222 HD23 LEU 31 HD23 LEU 31 -0.589 -4.548 -11.168
223 H ASP 32 HN ASP 32 -5.548 -3.822 -9.946
224 HA ASP 32 HA ASP 32 -4.911 -1.298 -11.292
225 HB2 ASP 32 HB2 ASP 32 -5.272 -3.293 -12.662
226 HB3 ASP 32 HB1 ASP 32 -6.887 -3.465 -11.994
227 H LEU 33 HN LEU 33 -7.093 -2.440 -8.912
228 HA LEU 33 HA LEU 33 -9.268 -0.791 -9.799
229 HB2 LEU 33 HB2 LEU 33 -10.511 -1.659 -7.807
230 HB3 LEU 33 HB1 LEU 33 -10.006 -2.848 -8.980
231 HG LEU 33 HG LEU 33 -8.133 -3.473 -7.417
232 HD11 LEU 33 HD11 LEU 33 -8.015 -1.438 -6.088
233 HD12 LEU 33 HD12 LEU 33 -8.307 -2.850 -5.072
234 HD13 LEU 33 HD13 LEU 33 -9.632 -1.750 -5.452
235 HD21 LEU 33 HD21 LEU 33 -10.161 -4.787 -7.587
236 HD22 LEU 33 HD22 LEU 33 -10.947 -3.753 -6.392
237 HD23 LEU 33 HD23 LEU 33 -9.573 -4.758 -5.927
238 H ARG 34 HN ARG 34 -10.549 0.350 -7.954
239 HA ARG 34 HA ARG 34 -8.854 2.553 -7.109
240 HB2 ARG 34 HB2 ARG 34 -11.827 2.129 -7.173
241 HB3 ARG 34 HB1 ARG 34 -11.087 3.530 -6.422
242 HG2 ARG 34 HG2 ARG 34 -10.769 2.750 -9.303
243 HG3 ARG 34 HG1 ARG 34 -11.901 3.961 -8.690
244 HD2 ARG 34 HD2 ARG 34 -9.977 5.182 -7.719
245 HD3 ARG 34 HD1 ARG 34 -8.901 4.018 -8.485
246 HE ARG 34 HE ARG 34 -10.499 4.960 -10.473
247 HH11 ARG 34 HH11 ARG 34 -8.187 6.372 -8.167
248 HH12 ARG 34 HH12 ARG 34 -7.658 7.580 -9.230
249 HH21 ARG 34 HH21 ARG 34 -9.921 6.788 -11.849
250 HH22 ARG 34 HH22 ARG 34 -8.743 7.912 -11.306
251 H PHE 35 HN PHE 35 -8.749 3.325 -5.018
252 HA PHE 35 HA PHE 35 -8.905 1.402 -2.925
253 HB2 PHE 35 HB2 PHE 35 -8.400 4.390 -2.866
254 HB3 PHE 35 HB1 PHE 35 -8.269 3.335 -1.463
255 HD1 PHE 35 HD2 PHE 35 -6.612 1.394 -1.628
256 HD2 PHE 35 HD1 PHE 35 -6.539 4.754 -4.257
257 HE1 PHE 35 HE2 PHE 35 -4.276 0.899 -2.205
258 HE2 PHE 35 HE1 PHE 35 -4.221 4.254 -4.826
259 HZ PHE 35 HZ PHE 35 -3.078 2.335 -3.802
260 H GLU 36 HN GLU 36 -10.888 3.856 -4.218
261 HA GLU 36 HA GLU 36 -12.794 4.414 -2.316
262 HB2 GLU 36 HB2 GLU 36 -12.601 5.403 -4.588
263 HB3 GLU 36 HB1 GLU 36 -13.245 3.917 -5.261
264 HG2 GLU 36 HG2 GLU 36 -14.962 5.593 -5.153
265 HG3 GLU 36 HG1 GLU 36 -15.330 4.295 -4.016
266 H ASP 37 HN ASP 37 -12.547 1.611 -4.451
267 HA ASP 37 HA ASP 37 -15.107 0.573 -3.711
268 HB2 ASP 37 HB2 ASP 37 -14.094 0.097 -5.911
269 HB3 ASP 37 HB1 ASP 37 -12.832 -0.837 -5.113
270 H ILE 38 HN ILE 38 -11.852 0.156 -2.598
271 HA ILE 38 HA ILE 38 -12.674 -2.114 -0.979
272 HB ILE 38 HB ILE 38 -10.283 -2.468 -0.472
273 HG12 ILE 38 HG12 ILE 38 -9.837 -0.181 -2.419
274 HG13 ILE 38 HG11 ILE 38 -9.540 -0.112 -0.686
275 HG21 ILE 38 HG21 ILE 38 -10.984 -2.234 -3.388
276 HG22 ILE 38 HG22 ILE 38 -11.342 -3.602 -2.332
277 HG23 ILE 38 HG23 ILE 38 -9.664 -3.213 -2.737
278 HD11 ILE 38 HD11 ILE 38 -7.473 -0.391 -1.937
279 HD12 ILE 38 HD12 ILE 38 -8.096 -1.872 -2.664
280 HD13 ILE 38 HD13 ILE 38 -7.789 -1.803 -0.929
281 H GLY 39 HN GLY 39 -13.133 0.856 -0.529
282 HA2 GLY 39 HA2 GLY 39 -13.584 2.138 1.325
283 HA3 GLY 39 HA1 GLY 39 -13.327 0.687 2.280
284 H TYR 40 HN TYR 40 -11.030 2.437 0.220
285 HA TYR 40 HA TYR 40 -9.560 3.084 2.635
286 HB2 TYR 40 HB2 TYR 40 -8.609 1.564 0.288
287 HB3 TYR 40 HB1 TYR 40 -7.508 2.792 0.912
288 HD1 TYR 40 HD1 TYR 40 -6.738 2.689 3.195
289 HD2 TYR 40 HD2 TYR 40 -9.023 -0.482 1.544
290 HE1 TYR 40 HE1 TYR 40 -6.051 1.270 5.041
291 HE2 TYR 40 HE2 TYR 40 -8.329 -1.949 3.411
292 HH TYR 40 HH TYR 40 -6.355 -2.000 5.086
293 H ASP 41 HN ASP 41 -8.500 4.960 2.740
294 HA ASP 41 HA ASP 41 -8.665 6.779 0.474
295 HB2 ASP 41 HB2 ASP 41 -10.601 7.212 2.082
296 HB3 ASP 41 HB1 ASP 41 -9.386 7.517 3.322
297 H SER 42 HN SER 42 -7.326 8.918 1.578
298 HA SER 42 HA SER 42 -4.722 7.892 1.295
299 HB2 SER 42 HB2 SER 42 -4.062 10.268 1.679
300 HB3 SER 42 HB1 SER 42 -5.215 10.008 0.365
301 H LEU 43 HN LEU 43 -6.551 9.018 4.004
302 HA LEU 43 HA LEU 43 -4.523 9.202 5.913
303 HB2 LEU 43 HB2 LEU 43 -7.403 8.397 6.221
304 HB3 LEU 43 HB1 LEU 43 -6.337 8.748 7.562
305 HG LEU 43 HG LEU 43 -7.185 10.708 5.425
306 HD11 LEU 43 HD11 LEU 43 -7.972 10.474 8.321
307 HD12 LEU 43 HD12 LEU 43 -8.999 10.121 6.932
308 HD13 LEU 43 HD13 LEU 43 -8.445 11.770 7.223
309 HD21 LEU 43 HD21 LEU 43 -4.940 11.176 6.276
310 HD22 LEU 43 HD22 LEU 43 -5.551 11.123 7.930
311 HD23 LEU 43 HD23 LEU 43 -6.098 12.387 6.828
312 H ALA 44 HN ALA 44 -6.681 6.466 5.229
313 HA ALA 44 HA ALA 44 -5.291 4.664 6.905
314 HB1 ALA 44 HB1 ALA 44 -7.654 4.417 6.278
315 HB2 ALA 44 HB2 ALA 44 -6.705 2.970 5.940
316 HB3 ALA 44 HB3 ALA 44 -7.152 4.054 4.625
317 H LEU 45 HN LEU 45 -4.837 5.654 3.625
318 HA LEU 45 HA LEU 45 -3.191 3.469 2.869
319 HB2 LEU 45 HB2 LEU 45 -3.401 6.250 1.747
320 HB3 LEU 45 HB1 LEU 45 -2.391 5.002 1.045
321 HG LEU 45 HG LEU 45 -5.389 4.885 1.322
322 HD11 LEU 45 HD11 LEU 45 -5.397 5.065 -1.108
323 HD12 LEU 45 HD12 LEU 45 -3.643 5.274 -1.097
324 HD13 LEU 45 HD13 LEU 45 -4.685 6.490 -0.351
325 HD21 LEU 45 HD21 LEU 45 -4.363 2.686 1.502
326 HD22 LEU 45 HD22 LEU 45 -3.450 2.984 0.020
327 HD23 LEU 45 HD23 LEU 45 -5.207 2.859 -0.038
328 H MET 46 HN MET 46 -2.490 6.669 4.181
329 HA MET 46 HA MET 46 0.321 6.329 4.260
330 HB2 MET 46 HB2 MET 46 -1.451 8.041 6.029
331 HB3 MET 46 HB1 MET 46 0.303 8.126 6.002
332 HG2 MET 46 HG2 MET 46 0.247 8.842 3.663
333 HG3 MET 46 HG1 MET 46 -1.518 8.695 3.688
334 HE1 MET 46 HE1 MET 46 -3.111 10.302 5.077
335 HE2 MET 46 HE2 MET 46 -2.521 11.563 6.155
336 HE3 MET 46 HE3 MET 46 -2.245 9.866 6.547
337 H GLU 47 HN GLU 47 -2.259 5.552 6.457
338 HA GLU 47 HA GLU 47 -0.811 4.581 8.627
339 HB2 GLU 47 HB2 GLU 47 -3.226 5.006 8.632
340 HB3 GLU 47 HB1 GLU 47 -3.471 3.703 7.497
341 HG2 GLU 47 HG2 GLU 47 -2.909 2.052 9.111
342 HG3 GLU 47 HG1 GLU 47 -2.349 3.278 10.253
343 H THR 48 HN THR 48 -2.017 2.860 5.761
344 HA THR 48 HA THR 48 -0.933 0.335 6.308
345 HB THR 48 HB THR 48 -1.416 1.585 3.579
346 HG1 THR 48 HG1 THR 48 -3.338 1.637 4.757
347 HG21 THR 48 HG21 THR 48 -1.709 -0.759 2.831
348 HG22 THR 48 HG22 THR 48 -1.294 -1.329 4.445
349 HG23 THR 48 HG23 THR 48 -0.089 -0.497 3.471
350 H ALA 49 HN ALA 49 0.422 3.075 4.487
351 HA ALA 49 HA ALA 49 2.831 1.933 3.688
352 HB1 ALA 49 HB1 ALA 49 2.319 4.799 4.496
353 HB2 ALA 49 HB2 ALA 49 2.032 4.117 2.895
354 HB3 ALA 49 HB3 ALA 49 3.675 4.231 3.521
355 H ALA 50 HN ALA 50 2.002 3.642 6.669
356 HA ALA 50 HA ALA 50 4.480 3.600 7.942
357 HB1 ALA 50 HB1 ALA 50 2.569 4.915 8.715
358 HB2 ALA 50 HB2 ALA 50 3.221 3.909 10.009
359 HB3 ALA 50 HB3 ALA 50 1.733 3.435 9.186
360 H ARG 51 HN ARG 51 1.887 1.227 7.901
361 HA ARG 51 HA ARG 51 2.858 -0.626 9.777
362 HB2 ARG 51 HB2 ARG 51 1.314 -1.242 7.239
363 HB3 ARG 51 HB1 ARG 51 1.482 -2.308 8.620
364 HG2 ARG 51 HG2 ARG 51 0.106 0.374 8.702
365 HG3 ARG 51 HG1 ARG 51 -0.720 -1.159 8.442
366 HD2 ARG 51 HD2 ARG 51 -0.918 -0.469 10.754
367 HD3 ARG 51 HD1 ARG 51 0.054 -1.929 10.638
368 HE ARG 51 HE ARG 51 1.512 0.560 10.711
369 HH11 ARG 51 HH11 ARG 51 0.138 -2.080 12.657
370 HH12 ARG 51 HH12 ARG 51 1.239 -1.886 13.947
371 HH21 ARG 51 HH21 ARG 51 3.010 0.846 12.503
372 HH22 ARG 51 HH22 ARG 51 2.878 -0.146 13.874
373 H LEU 52 HN LEU 52 3.313 -0.472 6.303
374 HA LEU 52 HA LEU 52 5.091 -2.664 6.279
375 HB2 LEU 52 HB2 LEU 52 4.384 -0.680 4.150
376 HB3 LEU 52 HB1 LEU 52 5.565 -1.956 3.897
377 HG LEU 52 HG LEU 52 2.686 -2.406 4.684
378 HD11 LEU 52 HD11 LEU 52 2.885 -1.622 2.386
379 HD12 LEU 52 HD12 LEU 52 2.432 -3.323 2.446
380 HD13 LEU 52 HD13 LEU 52 4.091 -2.865 2.059
381 HD21 LEU 52 HD21 LEU 52 4.192 -4.084 5.575
382 HD22 LEU 52 HD22 LEU 52 4.886 -4.331 3.975
383 HD23 LEU 52 HD23 LEU 52 3.200 -4.754 4.282
384 H GLU 53 HN GLU 53 5.678 0.751 6.657
385 HA GLU 53 HA GLU 53 8.418 0.673 6.139
386 HB2 GLU 53 HB2 GLU 53 6.969 2.344 8.191
387 HB3 GLU 53 HB1 GLU 53 8.641 2.576 7.737
388 HG2 GLU 53 HG2 GLU 53 7.850 3.030 5.412
389 HG3 GLU 53 HG1 GLU 53 6.201 3.002 6.051
390 H SER 54 HN SER 54 6.621 0.195 9.145
391 HA SER 54 HA SER 54 8.804 -0.396 10.809
392 HB2 SER 54 HB2 SER 54 5.909 -1.243 11.089
393 HB3 SER 54 HB1 SER 54 7.109 -1.187 12.381
394 HG SER 54 HG SER 54 7.287 1.147 11.491
395 H ARG 55 HN ARG 55 7.133 -2.288 8.504
396 HA ARG 55 HA ARG 55 7.961 -4.820 9.646
397 HB2 ARG 55 HB2 ARG 55 5.722 -4.615 8.729
398 HB3 ARG 55 HB1 ARG 55 6.377 -4.188 7.159
399 HG2 ARG 55 HG2 ARG 55 7.355 -6.427 6.973
400 HG3 ARG 55 HG1 ARG 55 6.676 -6.845 8.548
401 HD2 ARG 55 HD2 ARG 55 4.434 -6.536 7.722
402 HD3 ARG 55 HD1 ARG 55 5.046 -5.928 6.184
403 HE ARG 55 HE ARG 55 5.627 -8.656 7.078
404 HH11 ARG 55 HH11 ARG 55 4.097 -6.483 4.728
405 HH12 ARG 55 HH12 ARG 55 4.014 -7.680 3.499
406 HH21 ARG 55 HH21 ARG 55 5.380 -10.290 5.389
407 HH22 ARG 55 HH22 ARG 55 4.678 -9.843 3.889
408 H TYR 56 HN TYR 56 8.865 -2.790 6.867
409 HA TYR 56 HA TYR 56 10.852 -4.845 6.163
410 HB2 TYR 56 HB2 TYR 56 9.452 -2.852 4.416
411 HB3 TYR 56 HB1 TYR 56 10.925 -3.662 3.902
412 HD1 TYR 56 HD1 TYR 56 7.361 -4.113 4.679
413 HD2 TYR 56 HD2 TYR 56 10.932 -6.001 3.342
414 HE1 TYR 56 HE1 TYR 56 6.057 -6.045 3.914
415 HE2 TYR 56 HE2 TYR 56 9.630 -7.936 2.569
416 HH TYR 56 HH TYR 56 6.175 -7.909 2.394
417 H GLY 57 HN GLY 57 10.678 -1.647 7.362
418 HA2 GLY 57 HA2 GLY 57 12.481 -0.388 8.089
419 HA3 GLY 57 HA1 GLY 57 13.564 -1.483 7.240
420 H VAL 58 HN VAL 58 10.823 0.383 6.057
421 HA VAL 58 HA VAL 58 12.668 1.649 4.183
422 HB VAL 58 HB VAL 58 10.771 1.928 2.578
423 HG11 VAL 58 HG11 VAL 58 11.420 -0.908 3.353
424 HG12 VAL 58 HG12 VAL 58 12.368 0.130 2.283
425 HG13 VAL 58 HG13 VAL 58 10.754 -0.398 1.801
426 HG21 VAL 58 HG21 VAL 58 9.328 0.059 4.462
427 HG22 VAL 58 HG22 VAL 58 8.763 0.538 2.862
428 HG23 VAL 58 HG23 VAL 58 8.907 1.741 4.145
429 H SER 59 HN SER 59 11.538 3.722 3.171
430 HA SER 59 HA SER 59 10.378 5.245 5.353
431 HB2 SER 59 HB2 SER 59 12.867 5.632 5.223
432 HB3 SER 59 HB1 SER 59 12.654 6.182 3.568
433 HG SER 59 HG SER 59 11.165 7.374 5.648
434 H ILE 60 HN ILE 60 8.471 5.690 4.592
435 HA ILE 60 HA ILE 60 8.144 6.351 1.741
436 HB ILE 60 HB ILE 60 6.118 5.187 3.678
437 HG12 ILE 60 HG12 ILE 60 7.477 3.877 1.307
438 HG13 ILE 60 HG11 ILE 60 7.914 3.594 2.988
439 HG21 ILE 60 HG21 ILE 60 5.064 6.627 2.011
440 HG22 ILE 60 HG22 ILE 60 4.672 4.936 1.703
441 HG23 ILE 60 HG23 ILE 60 5.881 5.751 0.714
442 HD11 ILE 60 HD11 ILE 60 5.698 2.658 3.396
443 HD12 ILE 60 HD12 ILE 60 6.530 1.803 2.095
444 HD13 ILE 60 HD13 ILE 60 5.259 2.966 1.717
445 HA PRO 61 HA PRO 61 7.075 10.373 3.499
446 HB2 PRO 61 HB2 PRO 61 6.338 10.979 0.703
447 HB3 PRO 61 HB1 PRO 61 7.507 11.792 1.747
448 HG2 PRO 61 HG2 PRO 61 8.278 10.259 -0.325
449 HG3 PRO 61 HG1 PRO 61 9.220 10.362 1.174
450 HD2 PRO 61 HD2 PRO 61 7.375 8.203 0.234
451 HD3 PRO 61 HD1 PRO 61 8.920 8.070 1.101
452 H ASP 62 HN ASP 62 5.162 11.121 4.139
453 HA ASP 62 HA ASP 62 2.952 9.384 4.053
454 HB2 ASP 62 HB2 ASP 62 3.056 12.246 5.003
455 HB3 ASP 62 HB1 ASP 62 1.716 11.141 5.278
456 H ASP 63 HN ASP 63 3.318 12.594 2.604
457 HA ASP 63 HA ASP 63 0.807 12.853 1.443
458 HB2 ASP 63 HB2 ASP 63 2.349 14.710 1.512
459 HB3 ASP 63 HB1 ASP 63 3.475 13.870 0.455
460 H VAL 64 HN VAL 64 3.597 11.179 0.234
461 HA VAL 64 HA VAL 64 2.765 10.684 -2.413
462 HB VAL 64 HB VAL 64 4.540 9.045 -0.628
463 HG11 VAL 64 HG11 VAL 64 3.853 7.800 -2.639
464 HG12 VAL 64 HG12 VAL 64 5.556 8.229 -2.758
465 HG13 VAL 64 HG13 VAL 64 4.350 9.146 -3.663
466 HG21 VAL 64 HG21 VAL 64 5.224 11.266 -2.552
467 HG22 VAL 64 HG22 VAL 64 6.400 10.277 -1.684
468 HG23 VAL 64 HG23 VAL 64 5.305 11.335 -0.791
469 H ALA 65 HN ALA 65 2.304 8.893 0.601
470 HA ALA 65 HA ALA 65 1.176 6.575 -0.572
471 HB1 ALA 65 HB1 ALA 65 0.876 7.604 2.238
472 HB2 ALA 65 HB2 ALA 65 2.172 6.549 1.666
473 HB3 ALA 65 HB3 ALA 65 0.504 5.974 1.692
474 H GLY 66 HN GLY 66 -0.128 9.670 0.188
475 HA2 GLY 66 HA2 GLY 66 -2.865 8.677 -0.088
476 HA3 GLY 66 HA1 GLY 66 -2.391 10.325 0.317
477 H ARG 67 HN ARG 67 -0.372 9.969 -1.936
478 HA ARG 67 HA ARG 67 -1.978 11.219 -3.958
479 HB2 ARG 67 HB2 ARG 67 0.191 12.137 -3.488
480 HB3 ARG 67 HB1 ARG 67 0.968 10.589 -3.756
481 HG2 ARG 67 HG2 ARG 67 0.379 10.725 -6.134
482 HG3 ARG 67 HG1 ARG 67 -0.355 12.306 -5.844
483 HD2 ARG 67 HD2 ARG 67 1.712 13.272 -5.287
484 HD3 ARG 67 HD1 ARG 67 2.492 11.698 -5.133
485 HE ARG 67 HE ARG 67 1.469 12.139 -7.742
486 HH11 ARG 67 HH11 ARG 67 4.119 13.186 -5.679
487 HH12 ARG 67 HH12 ARG 67 5.320 13.156 -6.895
488 HH21 ARG 67 HH21 ARG 67 3.025 12.087 -9.421
489 HH22 ARG 67 HH22 ARG 67 4.665 12.492 -9.155
490 H VAL 68 HN VAL 68 -0.841 8.040 -3.344
491 HA VAL 68 HA VAL 68 -0.618 7.022 -5.947
492 HB VAL 68 HB VAL 68 -0.983 4.761 -4.971
493 HG11 VAL 68 HG11 VAL 68 0.918 4.771 -3.444
494 HG12 VAL 68 HG12 VAL 68 0.830 6.533 -3.366
495 HG13 VAL 68 HG13 VAL 68 1.219 5.731 -4.893
496 HG21 VAL 68 HG21 VAL 68 -1.305 4.494 -2.558
497 HG22 VAL 68 HG22 VAL 68 -2.685 5.311 -3.296
498 HG23 VAL 68 HG23 VAL 68 -1.488 6.239 -2.389
499 H ASP 69 HN ASP 69 -2.004 6.793 -7.498
500 HA ASP 69 HA ASP 69 -4.812 7.322 -7.148
501 HB2 ASP 69 HB2 ASP 69 -3.450 7.994 -9.192
502 HB3 ASP 69 HB1 ASP 69 -3.355 6.299 -9.584
503 H THR 70 HN THR 70 -2.865 4.558 -8.171
504 HA THR 70 HA THR 70 -5.079 2.827 -7.377
505 HB THR 70 HB THR 70 -4.332 1.302 -9.245
506 HG1 THR 70 HG1 THR 70 -3.116 3.518 -10.423
507 HG21 THR 70 HG21 THR 70 -5.384 2.638 -11.031
508 HG22 THR 70 HG22 THR 70 -5.152 4.084 -10.036
509 HG23 THR 70 HG23 THR 70 -6.261 2.818 -9.500
510 HA PRO 71 HA PRO 71 -2.244 0.600 -4.786
511 HB2 PRO 71 HB2 PRO 71 -3.100 -1.908 -6.149
512 HB3 PRO 71 HB1 PRO 71 -3.116 -1.504 -4.427
513 HG2 PRO 71 HG2 PRO 71 -5.378 -1.526 -5.775
514 HG3 PRO 71 HG1 PRO 71 -5.054 -0.217 -4.619
515 HD2 PRO 71 HD2 PRO 71 -4.820 -0.205 -7.606
516 HD3 PRO 71 HD1 PRO 71 -5.531 1.021 -6.531
517 H ARG 72 HN ARG 72 -2.157 0.116 -8.202
518 HA ARG 72 HA ARG 72 0.187 -1.393 -8.464
519 HB2 ARG 72 HB2 ARG 72 -1.424 -0.886 -10.288
520 HB3 ARG 72 HB1 ARG 72 -0.843 0.773 -10.297
521 HG2 ARG 72 HG2 ARG 72 1.370 0.001 -10.972
522 HG3 ARG 72 HG1 ARG 72 0.795 -1.670 -10.943
523 HD2 ARG 72 HD2 ARG 72 -0.259 0.540 -12.697
524 HD3 ARG 72 HD1 ARG 72 0.799 -0.773 -13.212
525 HE ARG 72 HE ARG 72 -1.049 -2.305 -12.658
526 HH11 ARG 72 HH11 ARG 72 -1.936 1.125 -13.043
527 HH12 ARG 72 HH12 ARG 72 -3.481 0.769 -13.683
528 HH21 ARG 72 HH21 ARG 72 -3.069 -2.749 -13.505
529 HH22 ARG 72 HH22 ARG 72 -4.184 -1.524 -13.958
530 H GLU 73 HN GLU 73 -0.357 2.067 -8.082
531 HA GLU 73 HA GLU 73 2.358 2.874 -8.436
532 HB2 GLU 73 HB2 GLU 73 0.320 4.341 -8.654
533 HB3 GLU 73 HB1 GLU 73 0.168 4.283 -6.907
534 HG2 GLU 73 HG2 GLU 73 1.218 6.332 -7.491
535 HG3 GLU 73 HG1 GLU 73 2.438 5.295 -6.750
536 H LEU 74 HN LEU 74 0.272 2.132 -5.728
537 HA LEU 74 HA LEU 74 2.012 2.859 -3.631
538 HB2 LEU 74 HB2 LEU 74 -0.520 2.414 -3.578
539 HB3 LEU 74 HB1 LEU 74 -0.128 0.717 -3.508
540 HG LEU 74 HG LEU 74 0.668 2.736 -1.386
541 HD11 LEU 74 HD11 LEU 74 -1.137 1.771 -0.057
542 HD12 LEU 74 HD12 LEU 74 -1.622 0.783 -1.432
543 HD13 LEU 74 HD13 LEU 74 -1.742 2.543 -1.521
544 HD21 LEU 74 HD21 LEU 74 2.084 0.721 -1.425
545 HD22 LEU 74 HD22 LEU 74 0.641 -0.287 -1.329
546 HD23 LEU 74 HD23 LEU 74 1.067 0.772 0.016
547 H LEU 75 HN LEU 75 1.401 -0.242 -5.238
548 HA LEU 75 HA LEU 75 3.209 -1.812 -3.762
549 HB2 LEU 75 HB2 LEU 75 1.441 -2.720 -5.239
550 HB3 LEU 75 HB1 LEU 75 2.315 -2.125 -6.634
551 HG LEU 75 HG LEU 75 4.206 -3.646 -6.003
552 HD11 LEU 75 HD11 LEU 75 3.734 -5.490 -4.489
553 HD12 LEU 75 HD12 LEU 75 2.190 -4.746 -4.069
554 HD13 LEU 75 HD13 LEU 75 3.699 -3.931 -3.667
555 HD21 LEU 75 HD21 LEU 75 3.127 -5.672 -6.836
556 HD22 LEU 75 HD22 LEU 75 2.633 -4.250 -7.750
557 HD23 LEU 75 HD23 LEU 75 1.547 -4.947 -6.546
558 H ASP 76 HN ASP 76 3.518 -0.037 -6.802
559 HA ASP 76 HA ASP 76 6.159 -0.762 -7.412
560 HB2 ASP 76 HB2 ASP 76 4.603 0.249 -9.039
561 HB3 ASP 76 HB1 ASP 76 4.692 1.770 -8.160
562 H LEU 77 HN LEU 77 4.829 1.990 -5.674
563 HA LEU 77 HA LEU 77 7.099 3.436 -5.104
564 HB2 LEU 77 HB2 LEU 77 4.932 4.274 -4.533
565 HB3 LEU 77 HB1 LEU 77 4.630 2.929 -3.454
566 HG LEU 77 HG LEU 77 6.425 3.782 -1.960
567 HD11 LEU 77 HD11 LEU 77 7.720 5.049 -3.565
568 HD12 LEU 77 HD12 LEU 77 7.228 6.057 -2.210
569 HD13 LEU 77 HD13 LEU 77 6.392 6.197 -3.759
570 HD21 LEU 77 HD21 LEU 77 5.099 5.621 -1.044
571 HD22 LEU 77 HD22 LEU 77 4.094 4.249 -1.500
572 HD23 LEU 77 HD23 LEU 77 4.153 5.680 -2.531
573 H ILE 78 HN ILE 78 5.657 0.863 -3.155
574 HA ILE 78 HA ILE 78 7.796 0.885 -1.312
575 HB ILE 78 HB ILE 78 5.637 -1.212 -1.706
576 HG12 ILE 78 HG12 ILE 78 5.913 1.130 0.184
577 HG13 ILE 78 HG11 ILE 78 4.778 0.995 -1.151
578 HG21 ILE 78 HG21 ILE 78 7.543 -0.807 0.617
579 HG22 ILE 78 HG22 ILE 78 7.597 -2.147 -0.526
580 HG23 ILE 78 HG23 ILE 78 6.219 -1.972 0.563
581 HD11 ILE 78 HD11 ILE 78 3.678 -0.857 0.005
582 HD12 ILE 78 HD12 ILE 78 3.685 0.629 0.958
583 HD13 ILE 78 HD13 ILE 78 4.813 -0.668 1.344
584 H ASN 79 HN ASN 79 7.089 -1.127 -4.125
585 HA ASN 79 HA ASN 79 9.245 -2.898 -3.795
586 HB2 ASN 79 HB2 ASN 79 7.876 -1.966 -6.323
587 HB3 ASN 79 HB1 ASN 79 9.221 -3.092 -6.365
588 HD21 ASN 79 HD21 ASN 79 8.307 -4.392 -3.847
589 HD22 ASN 79 HD22 ASN 79 6.952 -5.365 -4.340
590 H GLY 80 HN GLY 80 9.141 0.226 -5.449
591 HA2 GLY 80 HA2 GLY 80 11.844 0.265 -6.244
592 HA3 GLY 80 HA1 GLY 80 10.832 1.681 -6.005
593 H ALA 81 HN ALA 81 10.264 1.288 -3.266
594 HA ALA 81 HA ALA 81 12.532 2.448 -2.050
595 HB1 ALA 81 HB1 ALA 81 10.244 2.875 -1.265
596 HB2 ALA 81 HB2 ALA 81 11.262 2.270 0.040
597 HB3 ALA 81 HB3 ALA 81 10.106 1.194 -0.751
598 H LEU 82 HN LEU 82 11.141 -0.776 -1.949
599 HA LEU 82 HA LEU 82 12.979 -1.951 -0.171
600 HB2 LEU 82 HB2 LEU 82 11.235 -3.120 -2.319
601 HB3 LEU 82 HB1 LEU 82 12.208 -4.095 -1.241
602 HG LEU 82 HG LEU 82 10.006 -2.233 -0.354
603 HD11 LEU 82 HD11 LEU 82 8.745 -4.280 0.086
604 HD12 LEU 82 HD12 LEU 82 10.050 -5.237 -0.618
605 HD13 LEU 82 HD13 LEU 82 9.132 -4.122 -1.628
606 HD21 LEU 82 HD21 LEU 82 11.620 -4.298 1.131
607 HD22 LEU 82 HD22 LEU 82 10.268 -3.377 1.790
608 HD23 LEU 82 HD23 LEU 82 11.750 -2.549 1.309
609 H ALA 83 HN ALA 83 13.008 -1.480 -3.629
610 HA ALA 83 HA ALA 83 15.285 -3.052 -4.193
611 HB1 ALA 83 HB1 ALA 83 15.375 -1.820 -6.306
612 HB2 ALA 83 HB2 ALA 83 14.229 -0.639 -5.676
613 HB3 ALA 83 HB3 ALA 83 13.721 -2.307 -5.935
614 H GLU 84 HN GLU 84 14.824 0.284 -3.233
615 HA GLU 84 HA GLU 84 17.581 0.999 -3.456
616 HB2 GLU 84 HB2 GLU 84 15.783 2.671 -3.608
617 HB3 GLU 84 HB1 GLU 84 15.311 2.322 -1.953
618 HG2 GLU 84 HG2 GLU 84 17.342 3.240 -1.107
619 HG3 GLU 84 HG1 GLU 84 18.009 3.394 -2.729
620 H ALA 85 HN ALA 85 15.594 -0.487 -1.109
621 HA ALA 85 HA ALA 85 17.448 -0.139 1.075
622 HB1 ALA 85 HB1 ALA 85 15.828 -1.401 2.380
623 HB2 ALA 85 HB2 ALA 85 14.912 -1.760 0.916
624 HB3 ALA 85 HB3 ALA 85 15.038 -0.098 1.493
625 H ALA 86 HN ALA 86 17.600 -2.043 -1.565
626 HA ALA 86 HA ALA 86 19.010 -4.108 -0.077
627 HB1 ALA 86 HB1 ALA 86 18.132 -5.845 -1.557
628 HB2 ALA 86 HB2 ALA 86 17.140 -4.646 -2.386
629 HB3 ALA 86 HB3 ALA 86 16.827 -5.032 -0.694
630 H28 SXV 87 H28A SXV 87 -4.650 13.921 2.719
631 H28A SXV 87 H28B SXV 87 -3.825 12.362 2.660
632 H30 SXV 87 H30C SXV 87 -2.562 14.930 3.403
633 H30A SXV 87 H30A SXV 87 -1.097 14.758 2.437
634 H30B SXV 87 H30B SXV 87 -1.756 13.365 3.294
635 H31 SXV 87 H31C SXV 87 -1.747 12.102 1.255
636 H31A SXV 87 H31A SXV 87 -1.173 13.457 0.285
637 H31B SXV 87 H31B SXV 87 -2.667 12.621 -0.153
638 H32 SXV 87 H32A SXV 87 -2.298 15.771 0.457
639 HO33 SXV 87 H33A SXV 87 -4.849 16.065 1.252
640 HN36 SXV 87 H36A SXV 87 -2.587 14.242 -1.525
641 H37 SXV 87 H37B SXV 87 -5.202 14.710 -2.802
642 H37A SXV 87 H37A SXV 87 -4.377 13.152 -2.913
643 H38 SXV 87 H38B SXV 87 -3.967 14.388 -4.925
644 H38A SXV 87 H38A SXV 87 -2.467 14.244 -4.030
645 HN41 SXV 87 H41A SXV 87 -1.915 16.002 -5.507
646 H42 SXV 87 H42B SXV 87 -2.265 18.594 -4.236
647 H42A SXV 87 H42A SXV 87 -2.740 18.497 -5.922
648 H43 SXV 87 H43B SXV 87 -0.032 17.749 -4.850
649 H43A SXV 87 H43A SXV 87 -0.451 17.937 -6.543
650 H1 SXV 87 H1B SXV 87 -1.494 20.072 -3.459
651 H1A SXV 87 H1A SXV 87 0.210 19.764 -3.084
652 H2 SXV 87 H2A SXV 87 -0.941 22.412 -3.790
653 H2A SXV 87 H2B SXV 87 0.777 22.087 -3.524
654 H4 SXV 87 H4C SXV 87 1.059 22.137 -0.247
655 H4A SXV 87 H4A SXV 87 1.273 20.801 -1.380
656 H4B SXV 87 H4B SXV 87 0.016 20.711 -0.139
Start of MODEL 19
1 H1 MET 1 HT1 MET 1 17.764 -10.426 1.643
2 H2 MET 1 HT2 MET 1 16.891 -9.184 0.910
3 H3 MET 1 HT3 MET 1 16.103 -10.594 1.390
4 HA MET 1 HA MET 1 16.503 -10.112 3.683
5 HB2 MET 1 HB2 MET 1 18.595 -8.819 3.343
6 HB3 MET 1 HB1 MET 1 17.665 -7.524 2.610
7 HG2 MET 1 HG2 MET 1 16.508 -7.148 4.724
8 HG3 MET 1 HG1 MET 1 17.417 -8.468 5.459
9 HE1 MET 1 HE1 MET 1 18.729 -5.775 2.888
10 HE2 MET 1 HE2 MET 1 19.341 -4.529 3.977
11 HE3 MET 1 HE3 MET 1 17.610 -4.858 3.899
12 H ALA 2 HN ALA 2 15.827 -7.445 1.390
13 HA ALA 2 HA ALA 2 13.398 -6.800 2.802
14 HB1 ALA 2 HB1 ALA 2 14.633 -5.604 0.315
15 HB2 ALA 2 HB2 ALA 2 14.839 -5.003 1.961
16 HB3 ALA 2 HB3 ALA 2 13.250 -4.951 1.195
17 H THR 3 HN THR 3 11.746 -8.061 2.441
18 HA THR 3 HA THR 3 11.332 -9.660 0.159
19 HB THR 3 HB THR 3 9.470 -8.765 2.278
20 HG1 THR 3 HG1 THR 3 11.238 -11.030 2.180
21 HG21 THR 3 HG21 THR 3 8.297 -10.918 1.829
22 HG22 THR 3 HG22 THR 3 9.425 -11.220 0.507
23 HG23 THR 3 HG23 THR 3 8.314 -9.853 0.424
24 H LEU 4 HN LEU 4 10.933 -8.642 -1.765
25 HA LEU 4 HA LEU 4 9.528 -6.216 -2.085
26 HB2 LEU 4 HB2 LEU 4 9.851 -8.483 -4.073
27 HB3 LEU 4 HB1 LEU 4 9.336 -6.858 -4.452
28 HG LEU 4 HG LEU 4 12.074 -7.606 -3.423
29 HD11 LEU 4 HD11 LEU 4 12.827 -7.059 -5.683
30 HD12 LEU 4 HD12 LEU 4 11.156 -6.800 -6.176
31 HD13 LEU 4 HD13 LEU 4 11.691 -8.408 -5.686
32 HD21 LEU 4 HD21 LEU 4 10.986 -4.969 -4.420
33 HD22 LEU 4 HD22 LEU 4 12.662 -5.291 -3.975
34 HD23 LEU 4 HD23 LEU 4 11.395 -5.353 -2.748
35 H LEU 5 HN LEU 5 7.415 -5.853 -2.437
36 HA LEU 5 HA LEU 5 5.632 -7.636 -1.136
37 HB2 LEU 5 HB2 LEU 5 5.120 -5.154 -2.722
38 HB3 LEU 5 HB1 LEU 5 3.982 -5.929 -1.634
39 HG LEU 5 HG LEU 5 6.601 -4.700 -0.786
40 HD11 LEU 5 HD11 LEU 5 5.032 -3.062 -1.742
41 HD12 LEU 5 HD12 LEU 5 5.295 -2.838 -0.022
42 HD13 LEU 5 HD13 LEU 5 3.801 -3.599 -0.595
43 HD21 LEU 5 HD21 LEU 5 4.189 -5.594 0.786
44 HD22 LEU 5 HD22 LEU 5 5.666 -4.888 1.452
45 HD23 LEU 5 HD23 LEU 5 5.703 -6.473 0.673
46 H THR 6 HN THR 6 4.610 -9.250 -2.076
47 HA THR 6 HA THR 6 4.259 -9.260 -4.950
48 HB THR 6 HB THR 6 3.465 -11.619 -4.452
49 HG1 THR 6 HG1 THR 6 4.675 -12.036 -2.194
50 HG21 THR 6 HG21 THR 6 5.731 -11.138 -5.289
51 HG22 THR 6 HG22 THR 6 5.756 -12.470 -4.132
52 HG23 THR 6 HG23 THR 6 6.283 -10.863 -3.637
53 H THR 7 HN THR 7 1.924 -10.595 -5.353
54 HA THR 7 HA THR 7 0.046 -8.685 -4.475
55 HB THR 7 HB THR 7 -1.616 -10.198 -5.678
56 HG1 THR 7 HG1 THR 7 -0.869 -12.107 -6.033
57 HG21 THR 7 HG21 THR 7 -0.613 -8.249 -6.711
58 HG22 THR 7 HG22 THR 7 -0.752 -9.560 -7.892
59 HG23 THR 7 HG23 THR 7 0.812 -9.187 -7.163
60 H ASP 8 HN ASP 8 1.173 -11.562 -3.168
61 HA ASP 8 HA ASP 8 -1.136 -12.007 -1.473
62 HB2 ASP 8 HB2 ASP 8 1.647 -13.198 -1.428
63 HB3 ASP 8 HB1 ASP 8 0.437 -13.551 -0.207
64 H ASP 9 HN ASP 9 2.148 -10.735 -1.145
65 HA ASP 9 HA ASP 9 1.777 -10.201 1.621
66 HB2 ASP 9 HB2 ASP 9 4.036 -10.531 0.363
67 HB3 ASP 9 HB1 ASP 9 3.875 -8.822 -0.014
68 H LEU 10 HN LEU 10 1.560 -8.175 -1.283
69 HA LEU 10 HA LEU 10 1.139 -5.709 0.018
70 HB2 LEU 10 HB2 LEU 10 1.594 -5.913 -2.405
71 HB3 LEU 10 HB1 LEU 10 0.023 -6.652 -2.635
72 HG LEU 10 HG LEU 10 -1.006 -4.524 -1.801
73 HD11 LEU 10 HD11 LEU 10 1.792 -3.472 -2.102
74 HD12 LEU 10 HD12 LEU 10 0.877 -3.617 -0.600
75 HD13 LEU 10 HD13 LEU 10 0.345 -2.491 -1.852
76 HD21 LEU 10 HD21 LEU 10 0.689 -4.347 -4.293
77 HD22 LEU 10 HD22 LEU 10 -0.694 -3.323 -3.916
78 HD23 LEU 10 HD23 LEU 10 -0.921 -5.053 -4.173
79 H ARG 11 HN ARG 11 -1.004 -8.318 -0.865
80 HA ARG 11 HA ARG 11 -3.505 -7.197 -0.332
81 HB2 ARG 11 HB2 ARG 11 -3.200 -9.373 -1.400
82 HB3 ARG 11 HB1 ARG 11 -2.501 -10.021 0.071
83 HG2 ARG 11 HG2 ARG 11 -4.654 -9.666 1.199
84 HG3 ARG 11 HG1 ARG 11 -5.333 -9.126 -0.338
85 HD2 ARG 11 HD2 ARG 11 -4.822 -11.294 -1.335
86 HD3 ARG 11 HD1 ARG 11 -4.133 -11.845 0.204
87 HE ARG 11 HE ARG 11 -6.725 -10.830 0.496
88 HH11 ARG 11 HH11 ARG 11 -5.083 -13.784 -0.648
89 HH12 ARG 11 HH12 ARG 11 -6.434 -14.775 -0.284
90 HH21 ARG 11 HH21 ARG 11 -8.470 -12.166 0.944
91 HH22 ARG 11 HH22 ARG 11 -8.416 -13.848 0.701
92 H ARG 12 HN ARG 12 -1.226 -8.881 1.728
93 HA ARG 12 HA ARG 12 -2.667 -8.830 4.143
94 HB2 ARG 12 HB2 ARG 12 0.329 -8.867 3.709
95 HB3 ARG 12 HB1 ARG 12 -0.496 -9.299 5.199
96 HG2 ARG 12 HG2 ARG 12 -1.502 -11.219 4.154
97 HG3 ARG 12 HG1 ARG 12 -0.861 -10.743 2.580
98 HD2 ARG 12 HD2 ARG 12 0.486 -12.518 3.535
99 HD3 ARG 12 HD1 ARG 12 1.421 -11.029 3.436
100 HE ARG 12 HE ARG 12 0.081 -11.531 5.947
101 HH11 ARG 12 HH11 ARG 12 3.133 -11.792 4.115
102 HH12 ARG 12 HH12 ARG 12 4.063 -12.012 5.532
103 HH21 ARG 12 HH21 ARG 12 1.483 -11.804 7.866
104 HH22 ARG 12 HH22 ARG 12 3.162 -12.021 7.596
105 H ALA 13 HN ALA 13 -0.314 -6.624 2.725
106 HA ALA 13 HA ALA 13 0.051 -4.845 4.831
107 HB1 ALA 13 HB1 ALA 13 1.454 -4.918 2.834
108 HB2 ALA 13 HB2 ALA 13 0.878 -3.287 3.177
109 HB3 ALA 13 HB3 ALA 13 0.132 -4.236 1.886
110 H LEU 14 HN LEU 14 -2.357 -4.724 2.216
111 HA LEU 14 HA LEU 14 -3.519 -2.296 3.076
112 HB2 LEU 14 HB2 LEU 14 -4.526 -4.513 1.322
113 HB3 LEU 14 HB1 LEU 14 -5.641 -3.280 1.863
114 HG LEU 14 HG LEU 14 -4.918 -2.759 -0.354
115 HD11 LEU 14 HD11 LEU 14 -5.287 -0.875 1.076
116 HD12 LEU 14 HD12 LEU 14 -3.989 -0.527 -0.066
117 HD13 LEU 14 HD13 LEU 14 -3.609 -0.913 1.613
118 HD21 LEU 14 HD21 LEU 14 -2.585 -2.289 -0.936
119 HD22 LEU 14 HD22 LEU 14 -2.804 -3.965 -0.429
120 HD23 LEU 14 HD23 LEU 14 -2.084 -2.796 0.676
121 H VAL 15 HN VAL 15 -4.314 -5.646 3.797
122 HA VAL 15 HA VAL 15 -6.571 -5.233 5.382
123 HB VAL 15 HB VAL 15 -4.487 -7.444 5.602
124 HG11 VAL 15 HG11 VAL 15 -6.209 -8.776 6.723
125 HG12 VAL 15 HG12 VAL 15 -7.292 -7.384 6.718
126 HG13 VAL 15 HG13 VAL 15 -5.803 -7.338 7.660
127 HG21 VAL 15 HG21 VAL 15 -6.084 -8.766 4.294
128 HG22 VAL 15 HG22 VAL 15 -5.549 -7.332 3.418
129 HG23 VAL 15 HG23 VAL 15 -7.142 -7.358 4.173
130 H GLU 16 HN GLU 16 -3.183 -4.969 6.200
131 HA GLU 16 HA GLU 16 -3.237 -4.861 8.973
132 HB2 GLU 16 HB2 GLU 16 -1.528 -3.316 7.049
133 HB3 GLU 16 HB1 GLU 16 -1.247 -3.403 8.778
134 HG2 GLU 16 HG2 GLU 16 -1.259 -5.754 6.908
135 HG3 GLU 16 HG1 GLU 16 0.156 -4.867 7.475
136 H SER 17 HN SER 17 -4.341 -2.473 6.643
137 HA SER 17 HA SER 17 -4.118 -0.276 8.536
138 HB2 SER 17 HB2 SER 17 -5.057 -0.223 5.687
139 HB3 SER 17 HB1 SER 17 -4.515 1.142 6.672
140 HG SER 17 HG SER 17 -2.781 -0.962 6.547
141 H ALA 18 HN ALA 18 -6.537 -2.533 7.885
142 HA ALA 18 HA ALA 18 -8.495 -0.738 9.122
143 HB1 ALA 18 HB1 ALA 18 -9.110 -2.174 6.544
144 HB2 ALA 18 HB2 ALA 18 -8.900 -0.427 6.732
145 HB3 ALA 18 HB3 ALA 18 -10.247 -1.257 7.524
146 H GLY 19 HN GLY 19 -7.026 -3.619 9.234
147 HA2 GLY 19 HA2 GLY 19 -7.522 -5.604 10.221
148 HA3 GLY 19 HA1 GLY 19 -9.024 -4.876 10.804
149 H GLU 20 HN GLU 20 -10.658 -6.099 10.138
150 HA GLU 20 HA GLU 20 -10.944 -6.397 7.268
151 HB2 GLU 20 HB2 GLU 20 -11.570 -8.755 7.361
152 HB3 GLU 20 HB1 GLU 20 -9.961 -8.550 8.012
153 HG2 GLU 20 HG2 GLU 20 -12.494 -9.019 9.589
154 HG3 GLU 20 HG1 GLU 20 -11.236 -10.200 9.256
155 H THR 21 HN THR 21 -12.030 -4.811 9.471
156 HA THR 21 HA THR 21 -14.711 -5.818 9.768
157 HB THR 21 HB THR 21 -13.608 -5.136 11.744
158 HG1 THR 21 HG1 THR 21 -15.200 -3.879 12.617
159 HG21 THR 21 HG21 THR 21 -12.052 -3.468 10.937
160 HG22 THR 21 HG22 THR 21 -13.011 -2.774 12.246
161 HG23 THR 21 HG23 THR 21 -13.376 -2.363 10.571
162 H ASP 22 HN ASP 22 -14.811 -5.488 7.486
163 HA ASP 22 HA ASP 22 -16.699 -3.524 6.779
164 HB2 ASP 22 HB2 ASP 22 -14.828 -1.932 6.679
165 HB3 ASP 22 HB1 ASP 22 -13.910 -3.035 5.663
166 H GLY 23 HN GLY 23 -13.961 -5.123 5.358
167 HA2 GLY 23 HA2 GLY 23 -14.894 -7.396 4.344
168 HA3 GLY 23 HA1 GLY 23 -15.531 -6.211 3.190
169 H THR 24 HN THR 24 -12.578 -6.510 5.045
170 HA THR 24 HA THR 24 -11.062 -5.458 2.815
171 HB THR 24 HB THR 24 -9.999 -6.089 5.548
172 HG1 THR 24 HG1 THR 24 -11.643 -3.881 4.775
173 HG21 THR 24 HG21 THR 24 -8.497 -5.211 3.807
174 HG22 THR 24 HG22 THR 24 -8.719 -4.020 5.092
175 HG23 THR 24 HG23 THR 24 -9.581 -3.844 3.559
176 H ASP 25 HN ASP 25 -11.280 -7.499 1.663
177 HA ASP 25 HA ASP 25 -9.454 -9.492 2.758
178 HB2 ASP 25 HB2 ASP 25 -11.932 -10.045 1.174
179 HB3 ASP 25 HB1 ASP 25 -10.636 -11.227 1.284
180 H LEU 26 HN LEU 26 -10.243 -7.829 0.067
181 HA LEU 26 HA LEU 26 -9.420 -7.681 -2.072
182 HB2 LEU 26 HB2 LEU 26 -6.787 -8.113 -0.621
183 HB3 LEU 26 HB1 LEU 26 -6.913 -7.588 -2.282
184 HG LEU 26 HG LEU 26 -6.406 -5.684 -1.050
185 HD11 LEU 26 HD11 LEU 26 -8.325 -4.202 -1.296
186 HD12 LEU 26 HD12 LEU 26 -9.353 -5.613 -1.550
187 HD13 LEU 26 HD13 LEU 26 -8.064 -5.245 -2.695
188 HD21 LEU 26 HD21 LEU 26 -6.876 -6.460 1.205
189 HD22 LEU 26 HD22 LEU 26 -8.609 -6.367 0.899
190 HD23 LEU 26 HD23 LEU 26 -7.641 -4.892 0.934
191 H SER 27 HN SER 27 -10.477 -9.487 -2.773
192 HA SER 27 HA SER 27 -9.052 -12.030 -2.649
193 HB2 SER 27 HB2 SER 27 -11.410 -11.828 -1.785
194 HB3 SER 27 HB1 SER 27 -11.929 -11.491 -3.431
195 HG SER 27 HG SER 27 -11.957 -13.733 -2.445
196 H GLY 28 HN GLY 28 -7.776 -12.356 -4.337
197 HA2 GLY 28 HA2 GLY 28 -7.463 -13.037 -6.548
198 HA3 GLY 28 HA1 GLY 28 -8.897 -12.125 -7.015
199 H ASP 29 HN ASP 29 -7.787 -11.050 -8.658
200 HA ASP 29 HA ASP 29 -5.448 -9.508 -8.047
201 HB2 ASP 29 HB2 ASP 29 -5.553 -8.716 -10.317
202 HB3 ASP 29 HB1 ASP 29 -5.958 -10.425 -10.348
203 H PHE 30 HN PHE 30 -5.345 -7.271 -7.792
204 HA PHE 30 HA PHE 30 -7.816 -5.744 -7.602
205 HB2 PHE 30 HB2 PHE 30 -7.598 -5.209 -5.251
206 HB3 PHE 30 HB1 PHE 30 -7.704 -6.951 -5.436
207 HD1 PHE 30 HD2 PHE 30 -5.496 -8.289 -5.372
208 HD2 PHE 30 HD1 PHE 30 -5.813 -4.264 -4.019
209 HE1 PHE 30 HE2 PHE 30 -3.440 -8.572 -4.054
210 HE2 PHE 30 HE1 PHE 30 -3.755 -4.547 -2.697
211 HZ PHE 30 HZ PHE 30 -2.570 -6.663 -2.707
212 H LEU 31 HN LEU 31 -5.056 -5.698 -8.929
213 HA LEU 31 HA LEU 31 -3.560 -3.661 -7.550
214 HB2 LEU 31 HB2 LEU 31 -3.106 -4.899 -10.266
215 HB3 LEU 31 HB1 LEU 31 -2.021 -3.767 -9.495
216 HG LEU 31 HG LEU 31 -1.063 -5.882 -9.251
217 HD11 LEU 31 HD11 LEU 31 -2.372 -5.197 -6.646
218 HD12 LEU 31 HD12 LEU 31 -0.855 -4.558 -7.282
219 HD13 LEU 31 HD13 LEU 31 -0.979 -6.262 -6.849
220 HD21 LEU 31 HD21 LEU 31 -3.696 -6.907 -8.189
221 HD22 LEU 31 HD22 LEU 31 -2.200 -7.838 -8.268
222 HD23 LEU 31 HD23 LEU 31 -2.978 -7.289 -9.752
223 H ASP 32 HN ASP 32 -5.920 -3.750 -10.002
224 HA ASP 32 HA ASP 32 -5.305 -1.034 -10.906
225 HB2 ASP 32 HB2 ASP 32 -6.875 -1.455 -12.706
226 HB3 ASP 32 HB1 ASP 32 -5.691 -2.754 -12.625
227 H LEU 33 HN LEU 33 -6.952 -2.297 -8.431
228 HA LEU 33 HA LEU 33 -9.485 -1.004 -8.783
229 HB2 LEU 33 HB2 LEU 33 -8.219 -2.173 -6.313
230 HB3 LEU 33 HB1 LEU 33 -9.841 -1.520 -6.378
231 HG LEU 33 HG LEU 33 -8.820 -3.966 -7.818
232 HD11 LEU 33 HD11 LEU 33 -10.427 -5.128 -6.386
233 HD12 LEU 33 HD12 LEU 33 -10.815 -3.596 -5.597
234 HD13 LEU 33 HD13 LEU 33 -9.196 -4.283 -5.444
235 HD21 LEU 33 HD21 LEU 33 -10.436 -2.777 -9.209
236 HD22 LEU 33 HD22 LEU 33 -11.566 -2.712 -7.852
237 HD23 LEU 33 HD23 LEU 33 -11.123 -4.269 -8.561
238 H ARG 34 HN ARG 34 -10.250 0.750 -7.644
239 HA ARG 34 HA ARG 34 -8.225 2.702 -6.903
240 HB2 ARG 34 HB2 ARG 34 -11.236 2.907 -7.175
241 HB3 ARG 34 HB1 ARG 34 -10.195 4.242 -6.703
242 HG2 ARG 34 HG2 ARG 34 -9.988 2.766 -9.314
243 HG3 ARG 34 HG1 ARG 34 -10.880 4.270 -9.082
244 HD2 ARG 34 HD2 ARG 34 -7.951 3.929 -8.485
245 HD3 ARG 34 HD1 ARG 34 -8.583 4.556 -10.013
246 HE ARG 34 HE ARG 34 -9.580 6.016 -7.750
247 HH11 ARG 34 HH11 ARG 34 -6.852 5.750 -9.957
248 HH12 ARG 34 HH12 ARG 34 -6.234 7.303 -9.603
249 HH21 ARG 34 HH21 ARG 34 -8.888 8.041 -7.343
250 HH22 ARG 34 HH22 ARG 34 -7.461 8.722 -8.048
251 H PHE 35 HN PHE 35 -8.120 3.533 -4.822
252 HA PHE 35 HA PHE 35 -8.968 1.730 -2.783
253 HB2 PHE 35 HB2 PHE 35 -7.668 4.452 -2.618
254 HB3 PHE 35 HB1 PHE 35 -7.945 3.388 -1.241
255 HD1 PHE 35 HD2 PHE 35 -6.943 1.021 -1.408
256 HD2 PHE 35 HD1 PHE 35 -5.698 4.306 -3.798
257 HE1 PHE 35 HE2 PHE 35 -4.826 -0.118 -1.862
258 HE2 PHE 35 HE1 PHE 35 -3.571 3.169 -4.266
259 HZ PHE 35 HZ PHE 35 -3.101 0.983 -3.222
260 H GLU 36 HN GLU 36 -10.026 4.632 -4.185
261 HA GLU 36 HA GLU 36 -11.995 5.513 -2.395
262 HB2 GLU 36 HB2 GLU 36 -12.084 5.510 -5.411
263 HB3 GLU 36 HB1 GLU 36 -12.980 6.576 -4.340
264 HG2 GLU 36 HG2 GLU 36 -10.982 7.687 -3.662
265 HG3 GLU 36 HG1 GLU 36 -9.976 6.510 -4.508
266 H ASP 37 HN ASP 37 -11.943 3.020 -4.859
267 HA ASP 37 HA ASP 37 -14.708 2.365 -4.837
268 HB2 ASP 37 HB2 ASP 37 -13.313 1.900 -6.786
269 HB3 ASP 37 HB1 ASP 37 -12.293 0.832 -5.836
270 H ILE 38 HN ILE 38 -11.847 1.041 -3.231
271 HA ILE 38 HA ILE 38 -13.516 -0.940 -1.903
272 HB ILE 38 HB ILE 38 -11.386 -1.905 -0.999
273 HG12 ILE 38 HG12 ILE 38 -10.115 0.152 -2.839
274 HG13 ILE 38 HG11 ILE 38 -10.024 0.158 -1.085
275 HG21 ILE 38 HG21 ILE 38 -11.628 -1.560 -3.973
276 HG22 ILE 38 HG22 ILE 38 -12.468 -2.756 -2.989
277 HG23 ILE 38 HG23 ILE 38 -10.710 -2.845 -3.178
278 HD11 ILE 38 HD11 ILE 38 -8.769 -1.939 -1.147
279 HD12 ILE 38 HD12 ILE 38 -7.971 -0.668 -2.074
280 HD13 ILE 38 HD13 ILE 38 -8.864 -1.940 -2.908
281 H GLY 39 HN GLY 39 -13.473 1.909 -1.233
282 HA2 GLY 39 HA2 GLY 39 -13.984 3.154 0.662
283 HA3 GLY 39 HA1 GLY 39 -14.115 1.625 1.510
284 H TYR 40 HN TYR 40 -11.283 3.112 0.006
285 HA TYR 40 HA TYR 40 -10.000 3.204 2.649
286 HB2 TYR 40 HB2 TYR 40 -8.985 2.537 -0.055
287 HB3 TYR 40 HB1 TYR 40 -7.913 3.391 1.037
288 HD1 TYR 40 HD2 TYR 40 -10.049 0.405 0.753
289 HD2 TYR 40 HD1 TYR 40 -6.661 2.171 2.598
290 HE1 TYR 40 HE2 TYR 40 -9.547 -1.719 1.762
291 HE2 TYR 40 HE1 TYR 40 -6.110 0.026 3.654
292 HH TYR 40 HH TYR 40 -7.664 -2.919 2.815
293 H ASP 41 HN ASP 41 -9.319 5.086 3.354
294 HA ASP 41 HA ASP 41 -9.415 7.388 1.560
295 HB2 ASP 41 HB2 ASP 41 -9.024 7.203 4.557
296 HB3 ASP 41 HB1 ASP 41 -8.965 8.702 3.643
297 H SER 42 HN SER 42 -7.619 8.822 1.592
298 HA SER 42 HA SER 42 -5.134 7.678 1.062
299 HB2 SER 42 HB2 SER 42 -4.399 10.045 1.265
300 HB3 SER 42 HB1 SER 42 -5.783 9.800 0.196
301 H LEU 43 HN LEU 43 -6.507 9.093 3.876
302 HA LEU 43 HA LEU 43 -4.334 9.232 5.615
303 HB2 LEU 43 HB2 LEU 43 -7.254 8.775 6.181
304 HB3 LEU 43 HB1 LEU 43 -6.063 9.253 7.379
305 HG LEU 43 HG LEU 43 -6.646 10.918 4.935
306 HD11 LEU 43 HD11 LEU 43 -7.810 11.190 7.697
307 HD12 LEU 43 HD12 LEU 43 -8.678 10.701 6.230
308 HD13 LEU 43 HD13 LEU 43 -7.982 12.320 6.346
309 HD21 LEU 43 HD21 LEU 43 -4.513 11.321 6.020
310 HD22 LEU 43 HD22 LEU 43 -5.332 11.539 7.568
311 HD23 LEU 43 HD23 LEU 43 -5.612 12.679 6.253
312 H ALA 44 HN ALA 44 -6.429 6.560 4.743
313 HA ALA 44 HA ALA 44 -5.382 4.777 6.748
314 HB1 ALA 44 HB1 ALA 44 -6.701 3.054 5.600
315 HB2 ALA 44 HB2 ALA 44 -7.040 4.186 4.289
316 HB3 ALA 44 HB3 ALA 44 -7.673 4.494 5.906
317 H LEU 45 HN LEU 45 -4.928 5.452 3.362
318 HA LEU 45 HA LEU 45 -3.238 3.347 2.685
319 HB2 LEU 45 HB2 LEU 45 -3.282 6.146 1.580
320 HB3 LEU 45 HB1 LEU 45 -2.511 4.769 0.815
321 HG LEU 45 HG LEU 45 -5.459 5.076 1.332
322 HD11 LEU 45 HD11 LEU 45 -5.631 5.242 -1.097
323 HD12 LEU 45 HD12 LEU 45 -3.873 5.192 -1.224
324 HD13 LEU 45 HD13 LEU 45 -4.661 6.552 -0.424
325 HD21 LEU 45 HD21 LEU 45 -4.736 2.764 1.485
326 HD22 LEU 45 HD22 LEU 45 -3.916 2.905 -0.069
327 HD23 LEU 45 HD23 LEU 45 -5.671 3.033 0.016
328 H MET 46 HN MET 46 -2.577 6.441 4.196
329 HA MET 46 HA MET 46 0.256 6.284 4.057
330 HB2 MET 46 HB2 MET 46 -1.412 7.742 6.116
331 HB3 MET 46 HB1 MET 46 0.315 7.951 5.879
332 HG2 MET 46 HG2 MET 46 -0.155 8.756 3.579
333 HG3 MET 46 HG1 MET 46 -1.882 8.610 3.976
334 HE1 MET 46 HE1 MET 46 -2.116 11.268 6.927
335 HE2 MET 46 HE2 MET 46 -1.716 9.557 7.096
336 HE3 MET 46 HE3 MET 46 -3.005 10.057 6.004
337 H GLU 47 HN GLU 47 -2.099 4.813 6.144
338 HA GLU 47 HA GLU 47 -0.109 4.065 8.058
339 HB2 GLU 47 HB2 GLU 47 -2.515 4.326 8.665
340 HB3 GLU 47 HB1 GLU 47 -2.871 2.882 7.724
341 HG2 GLU 47 HG2 GLU 47 -1.298 1.580 9.114
342 HG3 GLU 47 HG1 GLU 47 -1.031 3.001 10.109
343 H THR 48 HN THR 48 -1.702 2.645 5.255
344 HA THR 48 HA THR 48 -0.714 0.064 5.314
345 HB THR 48 HB THR 48 -0.914 1.853 2.869
346 HG1 THR 48 HG1 THR 48 -2.825 0.681 4.549
347 HG21 THR 48 HG21 THR 48 0.082 -0.369 2.464
348 HG22 THR 48 HG22 THR 48 -1.512 -0.244 1.720
349 HG23 THR 48 HG23 THR 48 -1.311 -1.129 3.232
350 H ALA 49 HN ALA 49 0.727 2.987 3.921
351 HA ALA 49 HA ALA 49 3.213 1.941 3.190
352 HB1 ALA 49 HB1 ALA 49 2.366 4.108 2.429
353 HB2 ALA 49 HB2 ALA 49 3.966 4.260 3.157
354 HB3 ALA 49 HB3 ALA 49 2.532 4.747 4.064
355 H ALA 50 HN ALA 50 2.246 3.617 6.201
356 HA ALA 50 HA ALA 50 4.685 3.492 7.537
357 HB1 ALA 50 HB1 ALA 50 3.432 3.872 9.585
358 HB2 ALA 50 HB2 ALA 50 1.938 3.395 8.777
359 HB3 ALA 50 HB3 ALA 50 2.783 4.860 8.275
360 H ARG 51 HN ARG 51 2.068 1.122 7.483
361 HA ARG 51 HA ARG 51 2.999 -0.765 9.312
362 HB2 ARG 51 HB2 ARG 51 1.645 -1.279 6.650
363 HB3 ARG 51 HB1 ARG 51 1.876 -2.492 7.891
364 HG2 ARG 51 HG2 ARG 51 0.255 0.018 8.215
365 HG3 ARG 51 HG1 ARG 51 -0.401 -1.565 7.802
366 HD2 ARG 51 HD2 ARG 51 0.432 -2.461 9.895
367 HD3 ARG 51 HD1 ARG 51 1.122 -0.890 10.307
368 HE ARG 51 HE ARG 51 -1.516 -0.388 9.827
369 HH11 ARG 51 HH11 ARG 51 0.140 -2.625 11.991
370 HH12 ARG 51 HH12 ARG 51 -0.950 -2.419 13.280
371 HH21 ARG 51 HH21 ARG 51 -3.046 -0.174 11.456
372 HH22 ARG 51 HH22 ARG 51 -2.896 -1.022 12.950
373 H LEU 52 HN LEU 52 3.731 -0.342 5.932
374 HA LEU 52 HA LEU 52 5.493 -2.573 5.830
375 HB2 LEU 52 HB2 LEU 52 4.983 -0.395 3.822
376 HB3 LEU 52 HB1 LEU 52 5.895 -1.864 3.515
377 HG LEU 52 HG LEU 52 2.967 -1.742 4.243
378 HD11 LEU 52 HD11 LEU 52 2.578 -2.555 1.991
379 HD12 LEU 52 HD12 LEU 52 4.306 -2.422 1.658
380 HD13 LEU 52 HD13 LEU 52 3.358 -0.972 1.995
381 HD21 LEU 52 HD21 LEU 52 4.735 -4.087 3.585
382 HD22 LEU 52 HD22 LEU 52 2.975 -4.140 3.735
383 HD23 LEU 52 HD23 LEU 52 3.965 -3.711 5.132
384 H GLU 53 HN GLU 53 5.887 0.885 6.278
385 HA GLU 53 HA GLU 53 8.659 1.034 5.954
386 HB2 GLU 53 HB2 GLU 53 6.917 2.541 7.913
387 HB3 GLU 53 HB1 GLU 53 8.602 2.915 7.592
388 HG2 GLU 53 HG2 GLU 53 7.960 3.327 5.215
389 HG3 GLU 53 HG1 GLU 53 6.277 3.149 5.713
390 H SER 54 HN SER 54 6.771 0.443 8.870
391 HA SER 54 HA SER 54 8.912 -0.143 10.567
392 HB2 SER 54 HB2 SER 54 6.707 0.374 11.434
393 HB3 SER 54 HB1 SER 54 6.021 -1.037 10.635
394 HG SER 54 HG SER 54 7.487 -0.815 12.961
395 H ARG 55 HN ARG 55 6.892 -2.198 8.583
396 HA ARG 55 HA ARG 55 7.767 -4.700 9.473
397 HB2 ARG 55 HB2 ARG 55 5.666 -4.295 8.382
398 HB3 ARG 55 HB1 ARG 55 6.472 -3.798 6.921
399 HG2 ARG 55 HG2 ARG 55 7.106 -6.061 6.445
400 HG3 ARG 55 HG1 ARG 55 6.506 -6.602 8.028
401 HD2 ARG 55 HD2 ARG 55 4.269 -5.985 7.481
402 HD3 ARG 55 HD1 ARG 55 4.801 -5.155 6.033
403 HE ARG 55 HE ARG 55 5.369 -7.464 5.194
404 HH11 ARG 55 HH11 ARG 55 2.838 -7.008 7.672
405 HH12 ARG 55 HH12 ARG 55 1.825 -8.209 7.065
406 HH21 ARG 55 HH21 ARG 55 3.879 -9.080 4.286
407 HH22 ARG 55 HH22 ARG 55 2.443 -9.397 5.125
408 H TYR 56 HN TYR 56 9.018 -2.689 6.787
409 HA TYR 56 HA TYR 56 11.000 -4.821 6.399
410 HB2 TYR 56 HB2 TYR 56 9.971 -2.869 4.351
411 HB3 TYR 56 HB1 TYR 56 11.272 -4.028 4.070
412 HD1 TYR 56 HD2 TYR 56 10.742 -6.479 4.620
413 HD2 TYR 56 HD1 TYR 56 7.762 -3.528 3.934
414 HE1 TYR 56 HE2 TYR 56 9.102 -8.242 4.227
415 HE2 TYR 56 HE1 TYR 56 6.100 -5.296 3.556
416 HH TYR 56 HH TYR 56 5.974 -7.752 2.977
417 H GLY 57 HN GLY 57 10.755 -1.535 7.320
418 HA2 GLY 57 HA2 GLY 57 12.504 -0.267 8.121
419 HA3 GLY 57 HA1 GLY 57 13.640 -1.445 7.469
420 H VAL 58 HN VAL 58 11.159 0.738 6.307
421 HA VAL 58 HA VAL 58 13.015 1.791 4.337
422 HB VAL 58 HB VAL 58 11.189 1.996 2.635
423 HG11 VAL 58 HG11 VAL 58 11.785 -0.826 3.481
424 HG12 VAL 58 HG12 VAL 58 12.780 0.192 2.439
425 HG13 VAL 58 HG13 VAL 58 11.182 -0.331 1.899
426 HG21 VAL 58 HG21 VAL 58 9.253 1.853 4.104
427 HG22 VAL 58 HG22 VAL 58 9.648 0.177 4.486
428 HG23 VAL 58 HG23 VAL 58 9.166 0.617 2.848
429 H SER 59 HN SER 59 11.806 3.857 3.284
430 HA SER 59 HA SER 59 10.532 5.258 5.491
431 HB2 SER 59 HB2 SER 59 12.864 6.288 3.863
432 HB3 SER 59 HB1 SER 59 12.000 7.179 5.122
433 HG SER 59 HG SER 59 12.596 4.979 6.254
434 H ILE 60 HN ILE 60 8.627 5.673 4.703
435 HA ILE 60 HA ILE 60 8.378 6.498 1.896
436 HB ILE 60 HB ILE 60 6.288 5.259 3.717
437 HG12 ILE 60 HG12 ILE 60 7.962 3.608 3.005
438 HG13 ILE 60 HG11 ILE 60 6.407 3.289 2.253
439 HG21 ILE 60 HG21 ILE 60 4.853 5.144 1.727
440 HG22 ILE 60 HG22 ILE 60 6.077 6.019 0.806
441 HG23 ILE 60 HG23 ILE 60 5.262 6.806 2.158
442 HD11 ILE 60 HD11 ILE 60 8.778 4.608 0.936
443 HD12 ILE 60 HD12 ILE 60 7.212 4.297 0.177
444 HD13 ILE 60 HD13 ILE 60 8.224 2.948 0.690
445 HA PRO 61 HA PRO 61 7.080 10.366 3.751
446 HB2 PRO 61 HB2 PRO 61 6.387 11.147 1.006
447 HB3 PRO 61 HB1 PRO 61 7.595 11.858 2.081
448 HG2 PRO 61 HG2 PRO 61 8.271 10.434 -0.112
449 HG3 PRO 61 HG1 PRO 61 9.264 10.446 1.358
450 HD2 PRO 61 HD2 PRO 61 7.326 8.376 0.396
451 HD3 PRO 61 HD1 PRO 61 8.919 8.160 1.151
452 H ASP 62 HN ASP 62 5.236 10.240 4.695
453 HA ASP 62 HA ASP 62 3.035 8.689 4.168
454 HB2 ASP 62 HB2 ASP 62 2.991 11.329 5.648
455 HB3 ASP 62 HB1 ASP 62 1.772 10.072 5.754
456 H ASP 63 HN ASP 63 3.448 12.069 3.369
457 HA ASP 63 HA ASP 63 0.892 12.570 2.353
458 HB2 ASP 63 HB2 ASP 63 1.807 14.566 1.231
459 HB3 ASP 63 HB1 ASP 63 2.373 14.424 2.883
460 H VAL 64 HN VAL 64 3.452 10.893 0.838
461 HA VAL 64 HA VAL 64 2.564 11.174 -1.874
462 HB VAL 64 HB VAL 64 4.319 9.148 -0.537
463 HG11 VAL 64 HG11 VAL 64 3.477 8.283 -2.700
464 HG12 VAL 64 HG12 VAL 64 5.193 8.659 -2.843
465 HG13 VAL 64 HG13 VAL 64 3.991 9.766 -3.508
466 HG21 VAL 64 HG21 VAL 64 6.193 10.454 -1.480
467 HG22 VAL 64 HG22 VAL 64 5.196 11.398 -0.368
468 HG23 VAL 64 HG23 VAL 64 5.031 11.622 -2.107
469 H ALA 65 HN ALA 65 1.973 8.949 0.778
470 HA ALA 65 HA ALA 65 0.772 6.886 -0.763
471 HB1 ALA 65 HB1 ALA 65 1.711 6.465 1.467
472 HB2 ALA 65 HB2 ALA 65 0.008 5.987 1.364
473 HB3 ALA 65 HB3 ALA 65 0.451 7.487 2.166
474 H GLY 66 HN GLY 66 -0.316 9.898 0.372
475 HA2 GLY 66 HA2 GLY 66 -3.117 9.224 0.253
476 HA3 GLY 66 HA1 GLY 66 -2.438 10.836 0.451
477 H ARG 67 HN ARG 67 -0.868 9.459 -2.080
478 HA ARG 67 HA ARG 67 -2.723 10.619 -4.051
479 HB2 ARG 67 HB2 ARG 67 0.283 10.822 -3.939
480 HB3 ARG 67 HB1 ARG 67 -0.742 11.487 -5.209
481 HG2 ARG 67 HG2 ARG 67 -1.740 13.033 -3.694
482 HG3 ARG 67 HG1 ARG 67 -0.989 12.244 -2.309
483 HD2 ARG 67 HD2 ARG 67 1.226 12.900 -3.244
484 HD3 ARG 67 HD1 ARG 67 0.370 13.833 -4.475
485 HE ARG 67 HE ARG 67 -0.718 14.943 -2.453
486 HH11 ARG 67 HH11 ARG 67 2.677 13.952 -2.622
487 HH12 ARG 67 HH12 ARG 67 3.145 14.862 -1.261
488 HH21 ARG 67 HH21 ARG 67 -0.076 16.313 -0.785
489 HH22 ARG 67 HH22 ARG 67 1.546 16.360 -0.221
490 H VAL 68 HN VAL 68 -1.825 7.765 -3.086
491 HA VAL 68 HA VAL 68 -0.839 6.774 -5.612
492 HB VAL 68 HB VAL 68 -0.726 4.523 -4.538
493 HG11 VAL 68 HG11 VAL 68 1.213 5.951 -4.483
494 HG12 VAL 68 HG12 VAL 68 1.107 5.019 -2.991
495 HG13 VAL 68 HG13 VAL 68 0.640 6.720 -3.004
496 HG21 VAL 68 HG21 VAL 68 -1.014 4.299 -2.114
497 HG22 VAL 68 HG22 VAL 68 -2.536 4.738 -2.897
498 HG23 VAL 68 HG23 VAL 68 -1.598 5.959 -2.030
499 H ASP 69 HN ASP 69 -2.130 6.532 -7.144
500 HA ASP 69 HA ASP 69 -4.889 6.507 -7.188
501 HB2 ASP 69 HB2 ASP 69 -2.910 5.403 -9.161
502 HB3 ASP 69 HB1 ASP 69 -4.637 5.478 -9.468
503 H THR 70 HN THR 70 -2.826 3.736 -7.872
504 HA THR 70 HA THR 70 -5.020 1.932 -7.174
505 HB THR 70 HB THR 70 -3.837 0.432 -8.832
506 HG1 THR 70 HG1 THR 70 -2.662 2.452 -10.222
507 HG21 THR 70 HG21 THR 70 -4.772 1.568 -10.811
508 HG22 THR 70 HG22 THR 70 -4.886 3.068 -9.886
509 HG23 THR 70 HG23 THR 70 -5.878 1.678 -9.439
510 HA PRO 71 HA PRO 71 -2.192 -0.160 -4.335
511 HB2 PRO 71 HB2 PRO 71 -2.850 -2.641 -5.871
512 HB3 PRO 71 HB1 PRO 71 -2.892 -2.363 -4.123
513 HG2 PRO 71 HG2 PRO 71 -5.147 -2.434 -5.469
514 HG3 PRO 71 HG1 PRO 71 -4.898 -1.179 -4.235
515 HD2 PRO 71 HD2 PRO 71 -4.701 -0.967 -7.217
516 HD3 PRO 71 HD1 PRO 71 -5.438 0.160 -6.057
517 H ARG 72 HN ARG 72 -2.071 -0.775 -7.790
518 HA ARG 72 HA ARG 72 0.509 -1.863 -8.003
519 HB2 ARG 72 HB2 ARG 72 -1.026 -1.868 -9.899
520 HB3 ARG 72 HB1 ARG 72 -1.049 -0.114 -9.927
521 HG2 ARG 72 HG2 ARG 72 0.311 -0.961 -11.738
522 HG3 ARG 72 HG1 ARG 72 1.323 -0.103 -10.578
523 HD2 ARG 72 HD2 ARG 72 2.448 -2.116 -11.280
524 HD3 ARG 72 HD1 ARG 72 1.965 -2.276 -9.591
525 HE ARG 72 HE ARG 72 0.017 -3.344 -11.360
526 HH11 ARG 72 HH11 ARG 72 3.183 -4.094 -9.897
527 HH12 ARG 72 HH12 ARG 72 2.965 -5.784 -9.954
528 HH21 ARG 72 HH21 ARG 72 -0.242 -5.709 -11.475
529 HH22 ARG 72 HH22 ARG 72 0.987 -6.714 -10.911
530 H GLU 73 HN GLU 73 -0.618 1.484 -7.923
531 HA GLU 73 HA GLU 73 1.876 2.748 -8.364
532 HB2 GLU 73 HB2 GLU 73 -0.350 3.841 -8.620
533 HB3 GLU 73 HB1 GLU 73 -0.562 3.774 -6.880
534 HG2 GLU 73 HG2 GLU 73 0.090 6.002 -7.554
535 HG3 GLU 73 HG1 GLU 73 1.367 5.253 -6.601
536 H LEU 74 HN LEU 74 0.111 1.896 -5.430
537 HA LEU 74 HA LEU 74 1.964 2.916 -3.547
538 HB2 LEU 74 HB2 LEU 74 -0.441 2.347 -3.109
539 HB3 LEU 74 HB1 LEU 74 -0.052 0.658 -3.257
540 HG LEU 74 HG LEU 74 -0.440 1.477 -0.923
541 HD11 LEU 74 HD11 LEU 74 0.766 -0.583 -1.248
542 HD12 LEU 74 HD12 LEU 74 1.420 0.308 0.124
543 HD13 LEU 74 HD13 LEU 74 2.281 0.306 -1.415
544 HD21 LEU 74 HD21 LEU 74 1.336 2.730 0.207
545 HD22 LEU 74 HD22 LEU 74 0.594 3.664 -1.094
546 HD23 LEU 74 HD23 LEU 74 2.173 2.919 -1.333
547 H LEU 75 HN LEU 75 1.519 -0.239 -5.005
548 HA LEU 75 HA LEU 75 3.439 -1.777 -3.718
549 HB2 LEU 75 HB2 LEU 75 1.647 -2.581 -5.225
550 HB3 LEU 75 HB1 LEU 75 2.501 -1.894 -6.586
551 HG LEU 75 HG LEU 75 4.344 -3.497 -6.194
552 HD11 LEU 75 HD11 LEU 75 3.988 -3.789 -3.811
553 HD12 LEU 75 HD12 LEU 75 3.993 -5.336 -4.667
554 HD13 LEU 75 HD13 LEU 75 2.471 -4.626 -4.130
555 HD21 LEU 75 HD21 LEU 75 3.133 -5.466 -6.968
556 HD22 LEU 75 HD22 LEU 75 2.564 -4.005 -7.777
557 HD23 LEU 75 HD23 LEU 75 1.609 -4.722 -6.480
558 H ASP 76 HN ASP 76 3.655 0.016 -6.774
559 HA ASP 76 HA ASP 76 6.314 -0.544 -7.381
560 HB2 ASP 76 HB2 ASP 76 4.792 0.391 -9.032
561 HB3 ASP 76 HB1 ASP 76 4.688 1.890 -8.117
562 H LEU 77 HN LEU 77 4.951 2.157 -5.586
563 HA LEU 77 HA LEU 77 7.259 3.652 -5.132
564 HB2 LEU 77 HB2 LEU 77 5.166 4.605 -4.568
565 HB3 LEU 77 HB1 LEU 77 4.753 3.271 -3.518
566 HG LEU 77 HG LEU 77 6.486 4.016 -1.918
567 HD11 LEU 77 HD11 LEU 77 6.790 6.425 -3.706
568 HD12 LEU 77 HD12 LEU 77 7.994 5.166 -3.408
569 HD13 LEU 77 HD13 LEU 77 7.487 6.215 -2.093
570 HD21 LEU 77 HD21 LEU 77 4.432 6.102 -2.626
571 HD22 LEU 77 HD22 LEU 77 5.267 5.951 -1.078
572 HD23 LEU 77 HD23 LEU 77 4.175 4.680 -1.616
573 H ILE 78 HN ILE 78 5.797 1.239 -2.990
574 HA ILE 78 HA ILE 78 7.961 1.467 -1.193
575 HB ILE 78 HB ILE 78 5.700 -0.551 -1.220
576 HG12 ILE 78 HG12 ILE 78 6.170 2.010 0.325
577 HG13 ILE 78 HG11 ILE 78 5.048 1.805 -1.011
578 HG21 ILE 78 HG21 ILE 78 7.708 0.093 0.966
579 HG22 ILE 78 HG22 ILE 78 7.647 -1.412 0.049
580 HG23 ILE 78 HG23 ILE 78 6.319 -0.984 1.132
581 HD11 ILE 78 HD11 ILE 78 4.905 0.447 1.656
582 HD12 ILE 78 HD12 ILE 78 3.776 0.236 0.318
583 HD13 ILE 78 HD13 ILE 78 3.910 1.807 1.120
584 H ASN 79 HN ASN 79 7.183 -0.934 -3.680
585 HA ASN 79 HA ASN 79 9.362 -2.635 -3.076
586 HB2 ASN 79 HB2 ASN 79 7.958 -2.155 -5.705
587 HB3 ASN 79 HB1 ASN 79 9.325 -3.253 -5.571
588 HD21 ASN 79 HD21 ASN 79 6.702 -3.898 -6.360
589 HD22 ASN 79 HD22 ASN 79 6.085 -5.036 -5.199
590 H GLY 80 HN GLY 80 9.177 0.323 -4.873
591 HA2 GLY 80 HA2 GLY 80 11.784 0.294 -5.961
592 HA3 GLY 80 HA1 GLY 80 10.821 1.734 -5.636
593 H ALA 81 HN ALA 81 10.466 1.582 -2.965
594 HA ALA 81 HA ALA 81 12.890 2.544 -1.902
595 HB1 ALA 81 HB1 ALA 81 10.436 1.578 -0.424
596 HB2 ALA 81 HB2 ALA 81 10.697 3.217 -1.025
597 HB3 ALA 81 HB3 ALA 81 11.724 2.572 0.256
598 H LEU 82 HN LEU 82 11.237 -0.556 -1.592
599 HA LEU 82 HA LEU 82 12.955 -1.865 0.184
600 HB2 LEU 82 HB2 LEU 82 11.335 -2.988 -2.098
601 HB3 LEU 82 HB1 LEU 82 12.133 -3.968 -0.888
602 HG LEU 82 HG LEU 82 9.948 -1.969 -0.302
603 HD11 LEU 82 HD11 LEU 82 8.527 -3.922 0.031
604 HD12 LEU 82 HD12 LEU 82 9.843 -4.973 -0.487
605 HD13 LEU 82 HD13 LEU 82 9.119 -3.840 -1.627
606 HD21 LEU 82 HD21 LEU 82 9.894 -3.063 1.872
607 HD22 LEU 82 HD22 LEU 82 11.470 -2.339 1.552
608 HD23 LEU 82 HD23 LEU 82 11.251 -4.083 1.394
609 H ALA 83 HN ALA 83 13.171 -1.450 -3.292
610 HA ALA 83 HA ALA 83 15.334 -3.193 -3.748
611 HB1 ALA 83 HB1 ALA 83 13.881 -2.357 -5.542
612 HB2 ALA 83 HB2 ALA 83 15.584 -2.046 -5.885
613 HB3 ALA 83 HB3 ALA 83 14.546 -0.738 -5.319
614 H GLU 84 HN GLU 84 15.189 0.025 -2.506
615 HA GLU 84 HA GLU 84 18.068 0.401 -2.810
616 HB2 GLU 84 HB2 GLU 84 16.481 2.274 -3.295
617 HB3 GLU 84 HB1 GLU 84 15.995 2.251 -1.608
618 HG2 GLU 84 HG2 GLU 84 17.562 4.042 -1.997
619 HG3 GLU 84 HG1 GLU 84 18.294 2.822 -0.956
620 H ALA 85 HN ALA 85 15.613 -0.268 -0.442
621 HA ALA 85 HA ALA 85 16.840 0.353 1.937
622 HB1 ALA 85 HB1 ALA 85 14.479 -0.234 1.708
623 HB2 ALA 85 HB2 ALA 85 15.271 -1.152 2.989
624 HB3 ALA 85 HB3 ALA 85 14.933 -1.916 1.435
625 H ALA 86 HN ALA 86 18.741 -0.191 2.505
626 HA ALA 86 HA ALA 86 19.415 -2.902 3.059
627 HB1 ALA 86 HB1 ALA 86 20.205 -2.736 0.732
628 HB2 ALA 86 HB2 ALA 86 21.577 -2.797 1.840
629 HB3 ALA 86 HB3 ALA 86 21.085 -1.260 1.127
630 H28 SXV 87 H28A SXV 87 -3.913 11.713 2.214
631 H28A SXV 87 H28B SXV 87 -3.967 12.858 0.876
632 H30 SXV 87 H30C SXV 87 -4.426 13.574 4.435
633 H30A SXV 87 H30A SXV 87 -2.749 14.002 4.776
634 H30B SXV 87 H30B SXV 87 -3.171 12.334 4.391
635 H31 SXV 87 H31C SXV 87 -1.500 12.286 2.570
636 H31A SXV 87 H31A SXV 87 -1.053 13.969 2.866
637 H31B SXV 87 H31B SXV 87 -1.589 13.481 1.267
638 H32 SXV 87 H32A SXV 87 -4.439 15.421 2.701
639 HO33 SXV 87 H33A SXV 87 -4.281 15.666 0.647
640 HN36 SXV 87 H36A SXV 87 -2.373 17.048 1.339
641 H37 SXV 87 H37B SXV 87 -0.199 17.606 3.088
642 H37A SXV 87 H37A SXV 87 -1.541 18.695 3.434
643 H38 SXV 87 H38B SXV 87 -1.527 19.437 1.105
644 H38A SXV 87 H38A SXV 87 -0.165 18.365 0.792
645 HN41 SXV 87 H41A SXV 87 0.201 20.909 0.183
646 H42 SXV 87 H42B SXV 87 2.480 21.851 0.976
647 H42A SXV 87 H42A SXV 87 1.503 22.272 2.391
648 H43 SXV 87 H43B SXV 87 1.070 23.263 -0.411
649 H43A SXV 87 H43A SXV 87 -0.042 23.486 0.952
650 H1 SXV 87 H1B SXV 87 1.520 27.042 0.519
651 H1A SXV 87 H1A SXV 87 1.106 25.888 -0.767
652 H2 SXV 87 H2A SXV 87 -0.551 26.314 1.673
653 H2A SXV 87 H2B SXV 87 -0.906 25.239 0.321
654 H4 SXV 87 H4C SXV 87 -0.158 27.296 -1.996
655 H4A SXV 87 H4A SXV 87 -1.705 28.152 -1.981
656 H4B SXV 87 H4B SXV 87 -1.672 26.383 -1.955
Start of MODEL 20
1 H1 MET 1 HT1 MET 1 21.854 -7.477 -5.135
2 H2 MET 1 HT2 MET 1 21.341 -5.938 -4.635
3 H3 MET 1 HT3 MET 1 20.455 -6.778 -5.812
4 HA MET 1 HA MET 1 19.799 -8.393 -4.246
5 HB2 MET 1 HB2 MET 1 21.228 -6.590 -2.269
6 HB3 MET 1 HB1 MET 1 20.147 -7.903 -1.834
7 HG2 MET 1 HG2 MET 1 21.684 -9.488 -2.909
8 HG3 MET 1 HG1 MET 1 22.777 -8.154 -3.268
9 HE1 MET 1 HE1 MET 1 21.735 -9.586 0.994
10 HE2 MET 1 HE2 MET 1 21.116 -10.339 -0.476
11 HE3 MET 1 HE3 MET 1 20.596 -8.713 -0.034
12 H ALA 2 HN ALA 2 17.750 -8.077 -3.638
13 HA ALA 2 HA ALA 2 16.733 -5.547 -2.834
14 HB1 ALA 2 HB1 ALA 2 15.189 -5.282 -4.733
15 HB2 ALA 2 HB2 ALA 2 15.967 -6.634 -5.554
16 HB3 ALA 2 HB3 ALA 2 16.870 -5.149 -5.254
17 H THR 3 HN THR 3 15.525 -6.343 -1.234
18 HA THR 3 HA THR 3 14.221 -8.891 -1.577
19 HB THR 3 HB THR 3 15.225 -8.456 0.603
20 HG1 THR 3 HG1 THR 3 13.174 -9.585 0.507
21 HG21 THR 3 HG21 THR 3 14.428 -6.680 2.132
22 HG22 THR 3 HG22 THR 3 13.391 -6.057 0.850
23 HG23 THR 3 HG23 THR 3 15.145 -6.009 0.665
24 H LEU 4 HN LEU 4 12.479 -8.864 -2.795
25 HA LEU 4 HA LEU 4 10.848 -6.432 -2.869
26 HB2 LEU 4 HB2 LEU 4 10.909 -8.763 -4.779
27 HB3 LEU 4 HB1 LEU 4 9.919 -7.332 -4.960
28 HG LEU 4 HG LEU 4 12.936 -7.409 -5.032
29 HD11 LEU 4 HD11 LEU 4 12.669 -6.835 -7.386
30 HD12 LEU 4 HD12 LEU 4 10.919 -6.962 -7.219
31 HD13 LEU 4 HD13 LEU 4 11.932 -8.391 -7.008
32 HD21 LEU 4 HD21 LEU 4 12.779 -5.053 -5.699
33 HD22 LEU 4 HD22 LEU 4 12.118 -5.312 -4.084
34 HD23 LEU 4 HD23 LEU 4 11.032 -5.102 -5.457
35 H LEU 5 HN LEU 5 8.552 -6.575 -2.847
36 HA LEU 5 HA LEU 5 7.599 -8.894 -1.342
37 HB2 LEU 5 HB2 LEU 5 6.130 -7.541 -0.116
38 HB3 LEU 5 HB1 LEU 5 7.606 -6.616 -0.165
39 HG LEU 5 HG LEU 5 5.181 -6.103 -1.884
40 HD11 LEU 5 HD11 LEU 5 6.129 -4.689 0.597
41 HD12 LEU 5 HD12 LEU 5 4.679 -5.683 0.440
42 HD13 LEU 5 HD13 LEU 5 4.802 -4.155 -0.434
43 HD21 LEU 5 HD21 LEU 5 7.102 -5.202 -3.000
44 HD22 LEU 5 HD22 LEU 5 7.710 -4.499 -1.499
45 HD23 LEU 5 HD23 LEU 5 6.244 -3.864 -2.245
46 H THR 6 HN THR 6 5.445 -9.586 -1.822
47 HA THR 6 HA THR 6 4.790 -9.187 -4.629
48 HB THR 6 HB THR 6 3.397 -11.196 -4.362
49 HG1 THR 6 HG1 THR 6 4.393 -11.279 -1.676
50 HG21 THR 6 HG21 THR 6 5.779 -11.477 -4.918
51 HG22 THR 6 HG22 THR 6 5.203 -12.813 -3.920
52 HG23 THR 6 HG23 THR 6 6.173 -11.527 -3.201
53 H THR 7 HN THR 7 2.136 -9.795 -4.719
54 HA THR 7 HA THR 7 0.896 -7.413 -3.709
55 HB THR 7 HB THR 7 -0.378 -9.793 -5.123
56 HG1 THR 7 HG1 THR 7 1.462 -8.411 -6.150
57 HG21 THR 7 HG21 THR 7 -1.259 -6.902 -4.895
58 HG22 THR 7 HG22 THR 7 -1.988 -8.265 -4.043
59 HG23 THR 7 HG23 THR 7 -2.096 -8.165 -5.801
60 H ASP 8 HN ASP 8 1.271 -10.706 -2.794
61 HA ASP 8 HA ASP 8 -0.863 -10.934 -0.928
62 HB2 ASP 8 HB2 ASP 8 0.126 -12.948 -1.820
63 HB3 ASP 8 HB1 ASP 8 1.734 -12.439 -1.333
64 H ASP 9 HN ASP 9 2.497 -10.045 -0.808
65 HA ASP 9 HA ASP 9 2.687 -9.571 1.980
66 HB2 ASP 9 HB2 ASP 9 4.294 -8.397 -0.298
67 HB3 ASP 9 HB1 ASP 9 4.672 -8.170 1.401
68 H LEU 10 HN LEU 10 1.976 -7.504 -0.766
69 HA LEU 10 HA LEU 10 1.680 -5.053 0.567
70 HB2 LEU 10 HB2 LEU 10 1.804 -5.284 -1.875
71 HB3 LEU 10 HB1 LEU 10 0.261 -6.108 -1.880
72 HG LEU 10 HG LEU 10 -0.802 -4.024 -1.042
73 HD11 LEU 10 HD11 LEU 10 1.911 -2.831 -1.541
74 HD12 LEU 10 HD12 LEU 10 1.115 -3.013 0.025
75 HD13 LEU 10 HD13 LEU 10 0.438 -1.928 -1.187
76 HD21 LEU 10 HD21 LEU 10 -0.691 -2.830 -3.180
77 HD22 LEU 10 HD22 LEU 10 -0.823 -4.574 -3.418
78 HD23 LEU 10 HD23 LEU 10 0.732 -3.769 -3.625
79 H ARG 11 HN ARG 11 -0.696 -7.531 -0.260
80 HA ARG 11 HA ARG 11 -2.994 -6.361 0.681
81 HB2 ARG 11 HB2 ARG 11 -3.044 -8.326 -0.686
82 HB3 ARG 11 HB1 ARG 11 -2.215 -9.265 0.544
83 HG2 ARG 11 HG2 ARG 11 -4.154 -9.183 1.970
84 HG3 ARG 11 HG1 ARG 11 -4.979 -8.100 0.844
85 HD2 ARG 11 HD2 ARG 11 -5.701 -10.460 0.636
86 HD3 ARG 11 HD1 ARG 11 -5.013 -9.805 -0.850
87 HE ARG 11 HE ARG 11 -3.280 -11.339 0.947
88 HH11 ARG 11 HH11 ARG 11 -4.980 -11.115 -2.155
89 HH12 ARG 11 HH12 ARG 11 -4.189 -12.463 -2.839
90 HH21 ARG 11 HH21 ARG 11 -2.127 -13.165 -0.063
91 HH22 ARG 11 HH22 ARG 11 -2.544 -13.634 -1.618
92 H ARG 12 HN ARG 12 -0.654 -8.289 2.506
93 HA ARG 12 HA ARG 12 -2.145 -8.539 4.870
94 HB2 ARG 12 HB2 ARG 12 0.829 -8.440 4.488
95 HB3 ARG 12 HB1 ARG 12 0.095 -8.662 6.068
96 HG2 ARG 12 HG2 ARG 12 -1.048 -10.653 5.202
97 HG3 ARG 12 HG1 ARG 12 -0.194 -10.438 3.674
98 HD2 ARG 12 HD2 ARG 12 1.947 -10.632 4.874
99 HD3 ARG 12 HD1 ARG 12 1.054 -10.929 6.375
100 HE ARG 12 HE ARG 12 0.447 -12.996 5.620
101 HH11 ARG 12 HH11 ARG 12 2.593 -11.416 3.301
102 HH12 ARG 12 HH12 ARG 12 2.383 -12.673 2.129
103 HH21 ARG 12 HH21 ARG 12 0.282 -14.714 3.985
104 HH22 ARG 12 HH22 ARG 12 1.132 -14.466 2.497
105 H ALA 13 HN ALA 13 0.094 -5.962 3.981
106 HA ALA 13 HA ALA 13 -0.190 -4.617 6.477
107 HB1 ALA 13 HB1 ALA 13 1.021 -2.790 5.431
108 HB2 ALA 13 HB2 ALA 13 0.821 -3.553 3.850
109 HB3 ALA 13 HB3 ALA 13 1.789 -4.340 5.093
110 H LEU 14 HN LEU 14 -1.858 -4.512 3.457
111 HA LEU 14 HA LEU 14 -3.270 -2.102 3.949
112 HB2 LEU 14 HB2 LEU 14 -2.919 -3.200 1.698
113 HB3 LEU 14 HB1 LEU 14 -4.077 -4.418 2.177
114 HG LEU 14 HG LEU 14 -5.846 -2.706 2.276
115 HD11 LEU 14 HD11 LEU 14 -5.408 -0.456 1.432
116 HD12 LEU 14 HD12 LEU 14 -3.692 -0.836 1.292
117 HD13 LEU 14 HD13 LEU 14 -4.457 -0.787 2.880
118 HD21 LEU 14 HD21 LEU 14 -5.981 -2.266 -0.123
119 HD22 LEU 14 HD22 LEU 14 -5.451 -3.917 0.193
120 HD23 LEU 14 HD23 LEU 14 -4.280 -2.696 -0.299
121 H VAL 15 HN VAL 15 -3.886 -5.527 4.554
122 HA VAL 15 HA VAL 15 -6.478 -5.157 5.636
123 HB VAL 15 HB VAL 15 -4.576 -7.511 6.024
124 HG11 VAL 15 HG11 VAL 15 -6.267 -7.484 7.791
125 HG12 VAL 15 HG12 VAL 15 -6.554 -8.813 6.666
126 HG13 VAL 15 HG13 VAL 15 -7.540 -7.354 6.581
127 HG21 VAL 15 HG21 VAL 15 -5.189 -7.155 3.703
128 HG22 VAL 15 HG22 VAL 15 -6.896 -7.138 4.144
129 HG23 VAL 15 HG23 VAL 15 -5.952 -8.617 4.332
130 H GLU 16 HN GLU 16 -3.317 -4.803 6.952
131 HA GLU 16 HA GLU 16 -4.042 -4.892 9.689
132 HB2 GLU 16 HB2 GLU 16 -1.703 -3.498 8.348
133 HB3 GLU 16 HB1 GLU 16 -1.929 -3.610 10.086
134 HG2 GLU 16 HG2 GLU 16 -1.798 -6.014 9.991
135 HG3 GLU 16 HG1 GLU 16 -1.677 -5.958 8.236
136 H SER 17 HN SER 17 -4.151 -2.389 7.272
137 HA SER 17 HA SER 17 -4.991 -0.443 9.244
138 HB2 SER 17 HB2 SER 17 -3.566 0.215 7.287
139 HB3 SER 17 HB1 SER 17 -4.915 -0.176 6.221
140 HG SER 17 HG SER 17 -5.010 1.657 8.359
141 H ALA 18 HN ALA 18 -6.349 -2.536 6.794
142 HA ALA 18 HA ALA 18 -8.947 -1.490 6.730
143 HB1 ALA 18 HB1 ALA 18 -8.109 -4.343 6.258
144 HB2 ALA 18 HB2 ALA 18 -8.073 -3.058 5.050
145 HB3 ALA 18 HB3 ALA 18 -9.611 -3.589 5.727
146 H GLY 19 HN GLY 19 -7.572 -4.157 8.639
147 HA2 GLY 19 HA2 GLY 19 -8.164 -4.974 10.688
148 HA3 GLY 19 HA1 GLY 19 -9.214 -3.575 10.892
149 H GLU 20 HN GLU 20 -11.311 -3.742 10.522
150 HA GLU 20 HA GLU 20 -12.483 -6.355 10.265
151 HB2 GLU 20 HB2 GLU 20 -13.329 -4.331 11.648
152 HB3 GLU 20 HB1 GLU 20 -13.902 -3.688 10.120
153 HG2 GLU 20 HG2 GLU 20 -15.674 -4.792 11.335
154 HG3 GLU 20 HG1 GLU 20 -15.320 -5.643 9.829
155 H THR 21 HN THR 21 -12.105 -7.179 8.208
156 HA THR 21 HA THR 21 -12.339 -5.319 5.979
157 HB THR 21 HB THR 21 -10.874 -7.946 5.987
158 HG1 THR 21 HG1 THR 21 -10.105 -6.455 7.641
159 HG21 THR 21 HG21 THR 21 -9.605 -6.881 4.157
160 HG22 THR 21 HG22 THR 21 -10.582 -5.424 4.327
161 HG23 THR 21 HG23 THR 21 -11.329 -6.928 3.785
162 H ASP 22 HN ASP 22 -14.724 -5.901 6.369
163 HA ASP 22 HA ASP 22 -15.341 -7.966 4.387
164 HB2 ASP 22 HB2 ASP 22 -17.505 -8.408 5.438
165 HB3 ASP 22 HB1 ASP 22 -16.225 -8.688 6.606
166 H GLY 23 HN GLY 23 -16.973 -7.415 2.925
167 HA2 GLY 23 HA2 GLY 23 -18.291 -5.853 1.754
168 HA3 GLY 23 HA1 GLY 23 -17.746 -4.584 2.866
169 H THR 24 HN THR 24 -15.181 -4.797 2.930
170 HA THR 24 HA THR 24 -14.162 -3.950 0.393
171 HB THR 24 HB THR 24 -12.598 -4.565 2.909
172 HG1 THR 24 HG1 THR 24 -13.411 -2.893 3.872
173 HG21 THR 24 HG21 THR 24 -12.261 -2.470 0.742
174 HG22 THR 24 HG22 THR 24 -11.315 -3.951 0.895
175 HG23 THR 24 HG23 THR 24 -11.195 -2.699 2.130
176 H ASP 25 HN ASP 25 -14.683 -6.141 -0.630
177 HA ASP 25 HA ASP 25 -13.267 -8.483 0.194
178 HB2 ASP 25 HB2 ASP 25 -15.334 -8.473 -1.303
179 HB3 ASP 25 HB1 ASP 25 -14.299 -7.889 -2.602
180 H LEU 26 HN LEU 26 -11.171 -8.726 0.094
181 HA LEU 26 HA LEU 26 -9.673 -7.152 -1.898
182 HB2 LEU 26 HB2 LEU 26 -9.683 -6.205 0.407
183 HB3 LEU 26 HB1 LEU 26 -8.910 -7.668 0.967
184 HG LEU 26 HG LEU 26 -6.996 -7.136 -0.555
185 HD11 LEU 26 HD11 LEU 26 -8.158 -5.652 -2.088
186 HD12 LEU 26 HD12 LEU 26 -6.789 -4.827 -1.339
187 HD13 LEU 26 HD13 LEU 26 -8.429 -4.491 -0.787
188 HD21 LEU 26 HD21 LEU 26 -6.917 -6.703 1.835
189 HD22 LEU 26 HD22 LEU 26 -7.682 -5.131 1.588
190 HD23 LEU 26 HD23 LEU 26 -6.068 -5.438 0.947
191 H SER 27 HN SER 27 -10.385 -10.204 -0.736
192 HA SER 27 HA SER 27 -7.757 -11.294 -1.031
193 HB2 SER 27 HB2 SER 27 -9.451 -12.207 0.592
194 HB3 SER 27 HB1 SER 27 -10.391 -12.772 -0.787
195 HG SER 27 HG SER 27 -8.736 -14.176 0.376
196 H GLY 28 HN GLY 28 -7.088 -10.917 -3.059
197 HA2 GLY 28 HA2 GLY 28 -7.426 -12.726 -5.024
198 HA3 GLY 28 HA1 GLY 28 -8.637 -11.485 -5.364
199 H ASP 29 HN ASP 29 -7.741 -10.559 -7.100
200 HA ASP 29 HA ASP 29 -5.067 -9.399 -6.737
201 HB2 ASP 29 HB2 ASP 29 -5.179 -11.057 -8.595
202 HB3 ASP 29 HB1 ASP 29 -6.449 -10.093 -9.344
203 H PHE 30 HN PHE 30 -5.139 -7.324 -6.445
204 HA PHE 30 HA PHE 30 -7.542 -5.860 -7.319
205 HB2 PHE 30 HB2 PHE 30 -7.403 -4.626 -5.145
206 HB3 PHE 30 HB1 PHE 30 -7.811 -6.329 -5.000
207 HD1 PHE 30 HD2 PHE 30 -6.240 -7.896 -3.971
208 HD2 PHE 30 HD1 PHE 30 -5.280 -3.765 -4.333
209 HE1 PHE 30 HE2 PHE 30 -4.398 -8.186 -2.367
210 HE2 PHE 30 HE1 PHE 30 -3.437 -4.051 -2.732
211 HZ PHE 30 HZ PHE 30 -3.011 -6.280 -1.733
212 H LEU 31 HN LEU 31 -4.722 -5.934 -8.431
213 HA LEU 31 HA LEU 31 -3.580 -3.415 -7.634
214 HB2 LEU 31 HB2 LEU 31 -2.828 -5.257 -9.890
215 HB3 LEU 31 HB1 LEU 31 -1.926 -3.826 -9.431
216 HG LEU 31 HG LEU 31 -2.342 -6.276 -7.722
217 HD11 LEU 31 HD11 LEU 31 -0.811 -6.647 -9.563
218 HD12 LEU 31 HD12 LEU 31 0.052 -6.593 -8.025
219 HD13 LEU 31 HD13 LEU 31 0.100 -5.207 -9.114
220 HD21 LEU 31 HD21 LEU 31 -0.742 -3.772 -7.187
221 HD22 LEU 31 HD22 LEU 31 -0.772 -5.213 -6.174
222 HD23 LEU 31 HD23 LEU 31 -2.231 -4.241 -6.368
223 H ASP 32 HN ASP 32 -5.898 -4.332 -9.914
224 HA ASP 32 HA ASP 32 -5.420 -2.129 -11.736
225 HB2 ASP 32 HB2 ASP 32 -7.295 -3.074 -13.012
226 HB3 ASP 32 HB1 ASP 32 -6.038 -4.263 -12.684
227 H LEU 33 HN LEU 33 -7.199 -2.562 -8.892
228 HA LEU 33 HA LEU 33 -9.256 -0.731 -9.774
229 HB2 LEU 33 HB2 LEU 33 -10.331 -1.125 -7.540
230 HB3 LEU 33 HB1 LEU 33 -10.232 -2.514 -8.592
231 HG LEU 33 HG LEU 33 -8.249 -3.273 -7.190
232 HD11 LEU 33 HD11 LEU 33 -7.684 -1.175 -6.111
233 HD12 LEU 33 HD12 LEU 33 -8.076 -2.413 -4.917
234 HD13 LEU 33 HD13 LEU 33 -9.250 -1.155 -5.302
235 HD21 LEU 33 HD21 LEU 33 -9.674 -4.176 -5.426
236 HD22 LEU 33 HD22 LEU 33 -10.442 -4.280 -7.011
237 HD23 LEU 33 HD23 LEU 33 -10.940 -3.029 -5.868
238 H ARG 34 HN ARG 34 -9.966 0.917 -8.026
239 HA ARG 34 HA ARG 34 -7.576 2.480 -7.406
240 HB2 ARG 34 HB2 ARG 34 -10.478 3.190 -7.795
241 HB3 ARG 34 HB1 ARG 34 -9.272 4.331 -7.229
242 HG2 ARG 34 HG2 ARG 34 -9.112 2.878 -9.852
243 HG3 ARG 34 HG1 ARG 34 -9.822 4.480 -9.652
244 HD2 ARG 34 HD2 ARG 34 -6.991 3.737 -8.933
245 HD3 ARG 34 HD1 ARG 34 -7.478 4.547 -10.425
246 HE ARG 34 HE ARG 34 -7.923 5.687 -7.751
247 HH11 ARG 34 HH11 ARG 34 -6.690 6.016 -11.066
248 HH12 ARG 34 HH12 ARG 34 -6.633 7.716 -11.024
249 HH21 ARG 34 HH21 ARG 34 -7.806 8.036 -7.675
250 HH22 ARG 34 HH22 ARG 34 -7.245 8.895 -9.017
251 H PHE 35 HN PHE 35 -7.726 3.692 -5.354
252 HA PHE 35 HA PHE 35 -8.643 1.980 -3.267
253 HB2 PHE 35 HB2 PHE 35 -7.484 4.771 -3.180
254 HB3 PHE 35 HB1 PHE 35 -7.892 3.833 -1.744
255 HD1 PHE 35 HD2 PHE 35 -6.836 1.463 -1.612
256 HD2 PHE 35 HD1 PHE 35 -5.350 4.615 -4.049
257 HE1 PHE 35 HE2 PHE 35 -4.639 0.361 -1.687
258 HE2 PHE 35 HE1 PHE 35 -3.157 3.511 -4.137
259 HZ PHE 35 HZ PHE 35 -2.797 1.386 -2.951
260 H GLU 36 HN GLU 36 -9.895 4.490 -5.070
261 HA GLU 36 HA GLU 36 -12.026 5.488 -3.572
262 HB2 GLU 36 HB2 GLU 36 -11.256 6.259 -5.841
263 HB3 GLU 36 HB1 GLU 36 -11.978 4.818 -6.531
264 HG2 GLU 36 HG2 GLU 36 -13.456 6.635 -6.902
265 HG3 GLU 36 HG1 GLU 36 -14.180 5.606 -5.669
266 H ASP 37 HN ASP 37 -11.708 2.550 -5.568
267 HA ASP 37 HA ASP 37 -14.375 1.640 -5.430
268 HB2 ASP 37 HB2 ASP 37 -11.829 0.059 -5.864
269 HB3 ASP 37 HB1 ASP 37 -13.449 -0.580 -6.075
270 H ILE 38 HN ILE 38 -11.624 1.220 -3.350
271 HA ILE 38 HA ILE 38 -13.202 -0.629 -1.752
272 HB ILE 38 HB ILE 38 -11.050 -1.250 -0.603
273 HG12 ILE 38 HG12 ILE 38 -9.839 0.293 -2.926
274 HG13 ILE 38 HG11 ILE 38 -9.752 0.763 -1.237
275 HG21 ILE 38 HG21 ILE 38 -12.092 -2.637 -2.273
276 HG22 ILE 38 HG22 ILE 38 -10.333 -2.686 -2.485
277 HG23 ILE 38 HG23 ILE 38 -11.338 -1.691 -3.555
278 HD11 ILE 38 HD11 ILE 38 -8.436 -1.244 -0.753
279 HD12 ILE 38 HD12 ILE 38 -7.672 -0.238 -1.983
280 HD13 ILE 38 HD13 ILE 38 -8.527 -1.708 -2.454
281 H GLY 39 HN GLY 39 -13.129 2.362 -1.778
282 HA2 GLY 39 HA2 GLY 39 -13.767 3.967 -0.253
283 HA3 GLY 39 HA1 GLY 39 -14.036 2.658 0.875
284 H TYR 40 HN TYR 40 -10.945 3.560 -0.563
285 HA TYR 40 HA TYR 40 -9.992 4.267 2.116
286 HB2 TYR 40 HB2 TYR 40 -8.582 3.217 -0.318
287 HB3 TYR 40 HB1 TYR 40 -7.690 4.090 0.914
288 HD1 TYR 40 HD2 TYR 40 -9.996 1.180 0.522
289 HD2 TYR 40 HD1 TYR 40 -6.785 2.920 2.682
290 HE1 TYR 40 HE2 TYR 40 -9.717 -0.910 1.780
291 HE2 TYR 40 HE1 TYR 40 -6.490 0.849 3.946
292 HH TYR 40 HH TYR 40 -7.674 -1.129 4.532
293 H ASP 41 HN ASP 41 -9.417 6.229 2.532
294 HA ASP 41 HA ASP 41 -9.782 8.254 0.451
295 HB2 ASP 41 HB2 ASP 41 -9.334 8.692 3.410
296 HB3 ASP 41 HB1 ASP 41 -9.852 9.885 2.235
297 H SER 42 HN SER 42 -7.530 8.031 3.211
298 HA SER 42 HA SER 42 -5.181 8.378 1.605
299 HB2 SER 42 HB2 SER 42 -6.164 10.637 1.390
300 HB3 SER 42 HB1 SER 42 -6.179 10.783 3.150
301 H LEU 43 HN LEU 43 -6.624 9.148 4.721
302 HA LEU 43 HA LEU 43 -4.366 9.034 6.339
303 HB2 LEU 43 HB2 LEU 43 -7.226 8.413 7.055
304 HB3 LEU 43 HB1 LEU 43 -5.954 8.832 8.190
305 HG LEU 43 HG LEU 43 -6.952 10.671 6.012
306 HD11 LEU 43 HD11 LEU 43 -7.556 10.663 8.949
307 HD12 LEU 43 HD12 LEU 43 -8.694 10.292 7.636
308 HD13 LEU 43 HD13 LEU 43 -7.996 11.914 7.783
309 HD21 LEU 43 HD21 LEU 43 -5.735 12.379 7.246
310 HD22 LEU 43 HD22 LEU 43 -4.664 11.094 6.688
311 HD23 LEU 43 HD23 LEU 43 -5.165 11.154 8.378
312 H ALA 44 HN ALA 44 -6.678 6.528 5.497
313 HA ALA 44 HA ALA 44 -5.533 4.477 7.084
314 HB1 ALA 44 HB1 ALA 44 -6.911 2.954 5.746
315 HB2 ALA 44 HB2 ALA 44 -7.241 4.256 4.601
316 HB3 ALA 44 HB3 ALA 44 -7.835 4.366 6.259
317 H LEU 45 HN LEU 45 -4.906 5.716 3.902
318 HA LEU 45 HA LEU 45 -3.331 3.520 3.034
319 HB2 LEU 45 HB2 LEU 45 -3.480 6.365 2.033
320 HB3 LEU 45 HB1 LEU 45 -2.585 5.085 1.237
321 HG LEU 45 HG LEU 45 -5.573 5.102 1.668
322 HD11 LEU 45 HD11 LEU 45 -5.704 5.452 -0.746
323 HD12 LEU 45 HD12 LEU 45 -3.944 5.571 -0.824
324 HD13 LEU 45 HD13 LEU 45 -4.873 6.789 0.048
325 HD21 LEU 45 HD21 LEU 45 -4.630 2.864 1.640
326 HD22 LEU 45 HD22 LEU 45 -3.788 3.228 0.131
327 HD23 LEU 45 HD23 LEU 45 -5.548 3.178 0.168
328 H MET 46 HN MET 46 -2.716 6.550 4.680
329 HA MET 46 HA MET 46 0.120 6.458 4.618
330 HB2 MET 46 HB2 MET 46 -1.597 7.618 6.824
331 HB3 MET 46 HB1 MET 46 0.090 7.975 6.527
332 HG2 MET 46 HG2 MET 46 -0.539 9.098 4.416
333 HG3 MET 46 HG1 MET 46 -2.237 8.748 4.763
334 HE1 MET 46 HE1 MET 46 -1.834 9.058 8.074
335 HE2 MET 46 HE2 MET 46 -3.309 9.518 7.218
336 HE3 MET 46 HE3 MET 46 -2.505 10.678 8.276
337 H GLU 47 HN GLU 47 -2.295 5.284 6.896
338 HA GLU 47 HA GLU 47 -0.535 4.143 8.759
339 HB2 GLU 47 HB2 GLU 47 -2.878 4.569 9.265
340 HB3 GLU 47 HB1 GLU 47 -3.378 3.401 8.056
341 HG2 GLU 47 HG2 GLU 47 -2.449 1.599 9.353
342 HG3 GLU 47 HG1 GLU 47 -1.800 2.746 10.529
343 H THR 48 HN THR 48 -2.063 2.832 5.889
344 HA THR 48 HA THR 48 -1.127 0.203 5.982
345 HB THR 48 HB THR 48 -1.499 1.981 3.541
346 HG1 THR 48 HG1 THR 48 -3.411 1.777 4.891
347 HG21 THR 48 HG21 THR 48 -1.881 -0.129 2.324
348 HG22 THR 48 HG22 THR 48 -1.527 -1.037 3.794
349 HG23 THR 48 HG23 THR 48 -0.263 -0.076 3.025
350 H ALA 49 HN ALA 49 0.308 3.093 4.440
351 HA ALA 49 HA ALA 49 2.696 1.948 3.603
352 HB1 ALA 49 HB1 ALA 49 2.219 4.820 4.398
353 HB2 ALA 49 HB2 ALA 49 1.881 4.117 2.814
354 HB3 ALA 49 HB3 ALA 49 3.541 4.214 3.394
355 H ALA 50 HN ALA 50 1.893 3.477 6.697
356 HA ALA 50 HA ALA 50 4.434 3.438 7.865
357 HB1 ALA 50 HB1 ALA 50 2.506 4.599 8.848
358 HB2 ALA 50 HB2 ALA 50 3.282 3.527 10.018
359 HB3 ALA 50 HB3 ALA 50 1.775 3.042 9.240
360 H ARG 51 HN ARG 51 1.934 0.955 7.817
361 HA ARG 51 HA ARG 51 3.281 -1.017 9.335
362 HB2 ARG 51 HB2 ARG 51 1.164 -1.223 7.192
363 HB3 ARG 51 HB1 ARG 51 1.778 -2.627 8.047
364 HG2 ARG 51 HG2 ARG 51 0.564 -0.281 9.487
365 HG3 ARG 51 HG1 ARG 51 -0.402 -1.620 8.866
366 HD2 ARG 51 HD2 ARG 51 0.142 -1.938 11.231
367 HD3 ARG 51 HD1 ARG 51 0.856 -3.195 10.228
368 HE ARG 51 HE ARG 51 2.343 -0.889 11.287
369 HH11 ARG 51 HH11 ARG 51 2.103 -4.366 10.588
370 HH12 ARG 51 HH12 ARG 51 3.671 -4.745 11.152
371 HH21 ARG 51 HH21 ARG 51 4.507 -1.417 12.066
372 HH22 ARG 51 HH22 ARG 51 5.065 -3.040 12.011
373 H LEU 52 HN LEU 52 3.092 -0.416 5.921
374 HA LEU 52 HA LEU 52 4.745 -2.447 4.969
375 HB2 LEU 52 HB2 LEU 52 4.193 0.310 3.901
376 HB3 LEU 52 HB1 LEU 52 5.058 -0.926 3.003
377 HG LEU 52 HG LEU 52 2.279 -1.421 4.040
378 HD11 LEU 52 HD11 LEU 52 3.058 -0.209 1.397
379 HD12 LEU 52 HD12 LEU 52 2.167 0.598 2.690
380 HD13 LEU 52 HD13 LEU 52 1.446 -0.769 1.840
381 HD21 LEU 52 HD21 LEU 52 3.587 -3.348 3.318
382 HD22 LEU 52 HD22 LEU 52 3.890 -2.573 1.763
383 HD23 LEU 52 HD23 LEU 52 2.250 -3.044 2.209
384 H GLU 53 HN GLU 53 5.566 0.851 6.015
385 HA GLU 53 HA GLU 53 8.265 0.834 5.378
386 HB2 GLU 53 HB2 GLU 53 6.970 2.130 7.770
387 HB3 GLU 53 HB1 GLU 53 8.608 2.422 7.246
388 HG2 GLU 53 HG2 GLU 53 7.699 3.348 5.152
389 HG3 GLU 53 HG1 GLU 53 6.076 3.164 5.841
390 H SER 54 HN SER 54 6.725 0.201 8.475
391 HA SER 54 HA SER 54 9.015 -0.328 9.928
392 HB2 SER 54 HB2 SER 54 6.836 0.291 10.890
393 HB3 SER 54 HB1 SER 54 6.211 -1.297 10.461
394 HG SER 54 HG SER 54 8.332 -0.697 12.222
395 H ARG 55 HN ARG 55 6.914 -2.570 8.175
396 HA ARG 55 HA ARG 55 8.323 -4.820 9.247
397 HB2 ARG 55 HB2 ARG 55 5.986 -5.082 8.767
398 HB3 ARG 55 HB1 ARG 55 6.238 -4.666 7.078
399 HG2 ARG 55 HG2 ARG 55 7.509 -6.693 6.723
400 HG3 ARG 55 HG1 ARG 55 7.402 -7.088 8.439
401 HD2 ARG 55 HD2 ARG 55 5.052 -6.824 6.571
402 HD3 ARG 55 HD1 ARG 55 5.792 -8.350 7.056
403 HE ARG 55 HE ARG 55 5.132 -7.843 9.329
404 HH11 ARG 55 HH11 ARG 55 3.475 -6.035 6.752
405 HH12 ARG 55 HH12 ARG 55 2.106 -5.714 7.743
406 HH21 ARG 55 HH21 ARG 55 3.218 -7.391 10.595
407 HH22 ARG 55 HH22 ARG 55 1.946 -6.487 9.897
408 H TYR 56 HN TYR 56 8.201 -3.304 6.010
409 HA TYR 56 HA TYR 56 10.067 -5.321 5.101
410 HB2 TYR 56 HB2 TYR 56 8.750 -3.090 3.541
411 HB3 TYR 56 HB1 TYR 56 9.709 -4.401 2.847
412 HD1 TYR 56 HD2 TYR 56 8.899 -6.772 3.137
413 HD2 TYR 56 HD1 TYR 56 6.453 -3.418 4.034
414 HE1 TYR 56 HE2 TYR 56 6.928 -8.186 2.944
415 HE2 TYR 56 HE1 TYR 56 4.450 -4.822 3.834
416 HH TYR 56 HH TYR 56 4.550 -8.226 3.688
417 H GLY 57 HN GLY 57 10.313 -2.253 6.422
418 HA2 GLY 57 HA2 GLY 57 12.359 -1.363 7.107
419 HA3 GLY 57 HA1 GLY 57 13.170 -2.346 5.898
420 H VAL 58 HN VAL 58 10.458 -0.650 4.820
421 HA VAL 58 HA VAL 58 12.207 1.158 3.341
422 HB VAL 58 HB VAL 58 10.254 1.694 1.911
423 HG11 VAL 58 HG11 VAL 58 10.025 -0.440 0.801
424 HG12 VAL 58 HG12 VAL 58 10.692 -1.251 2.213
425 HG13 VAL 58 HG13 VAL 58 11.704 -0.138 1.268
426 HG21 VAL 58 HG21 VAL 58 8.462 1.367 3.535
427 HG22 VAL 58 HG22 VAL 58 8.799 -0.368 3.553
428 HG23 VAL 58 HG23 VAL 58 8.191 0.392 2.085
429 H SER 59 HN SER 59 11.133 3.384 2.914
430 HA SER 59 HA SER 59 9.511 4.189 5.161
431 HB2 SER 59 HB2 SER 59 11.907 4.811 5.690
432 HB3 SER 59 HB1 SER 59 11.873 5.871 4.279
433 HG SER 59 HG SER 59 9.818 6.074 6.157
434 H ILE 60 HN ILE 60 7.860 5.175 4.545
435 HA ILE 60 HA ILE 60 7.747 6.552 1.957
436 HB ILE 60 HB ILE 60 5.620 4.706 3.111
437 HG12 ILE 60 HG12 ILE 60 7.287 4.396 0.600
438 HG13 ILE 60 HG11 ILE 60 7.558 3.520 2.102
439 HG21 ILE 60 HG21 ILE 60 4.623 6.619 1.971
440 HG22 ILE 60 HG22 ILE 60 4.374 5.145 1.033
441 HG23 ILE 60 HG23 ILE 60 5.609 6.303 0.544
442 HD11 ILE 60 HD11 ILE 60 5.373 2.460 1.863
443 HD12 ILE 60 HD12 ILE 60 6.421 2.159 0.476
444 HD13 ILE 60 HD13 ILE 60 5.116 3.346 0.355
445 HA PRO 61 HA PRO 61 6.419 9.668 4.922
446 HB2 PRO 61 HB2 PRO 61 5.865 11.202 2.459
447 HB3 PRO 61 HB1 PRO 61 6.919 11.608 3.819
448 HG2 PRO 61 HG2 PRO 61 7.918 10.898 1.443
449 HG3 PRO 61 HG1 PRO 61 8.703 10.425 2.962
450 HD2 PRO 61 HD2 PRO 61 6.972 8.811 1.134
451 HD3 PRO 61 HD1 PRO 61 8.445 8.330 2.005
452 H ASP 62 HN ASP 62 4.472 10.134 5.734
453 HA ASP 62 HA ASP 62 2.108 8.899 5.034
454 HB2 ASP 62 HB2 ASP 62 2.486 11.511 6.530
455 HB3 ASP 62 HB1 ASP 62 0.971 10.633 6.456
456 H ASP 63 HN ASP 63 3.193 12.132 4.231
457 HA ASP 63 HA ASP 63 0.987 13.266 3.018
458 HB2 ASP 63 HB2 ASP 63 3.883 13.670 2.278
459 HB3 ASP 63 HB1 ASP 63 2.559 14.774 1.939
460 H VAL 64 HN VAL 64 3.041 10.807 1.753
461 HA VAL 64 HA VAL 64 2.481 11.379 -1.044
462 HB VAL 64 HB VAL 64 3.933 9.115 0.277
463 HG11 VAL 64 HG11 VAL 64 3.950 9.980 -2.640
464 HG12 VAL 64 HG12 VAL 64 3.230 8.500 -2.002
465 HG13 VAL 64 HG13 VAL 64 4.978 8.716 -1.963
466 HG21 VAL 64 HG21 VAL 64 6.006 10.284 -0.413
467 HG22 VAL 64 HG22 VAL 64 5.038 11.191 0.746
468 HG23 VAL 64 HG23 VAL 64 5.019 11.638 -0.961
469 H ALA 65 HN ALA 65 1.101 9.543 1.479
470 HA ALA 65 HA ALA 65 0.408 7.233 0.031
471 HB1 ALA 65 HB1 ALA 65 -0.800 8.220 2.584
472 HB2 ALA 65 HB2 ALA 65 0.681 7.273 2.441
473 HB3 ALA 65 HB3 ALA 65 -0.864 6.578 1.943
474 H GLY 66 HN GLY 66 -1.233 10.289 0.240
475 HA2 GLY 66 HA2 GLY 66 -3.728 9.090 -0.655
476 HA3 GLY 66 HA1 GLY 66 -3.448 10.792 -0.313
477 H ARG 67 HN ARG 67 -0.932 9.816 -2.165
478 HA ARG 67 HA ARG 67 -2.050 11.114 -4.526
479 HB2 ARG 67 HB2 ARG 67 0.742 10.095 -4.021
480 HB3 ARG 67 HB1 ARG 67 0.233 11.107 -5.363
481 HG2 ARG 67 HG2 ARG 67 -0.242 12.929 -3.837
482 HG3 ARG 67 HG1 ARG 67 0.183 11.901 -2.461
483 HD2 ARG 67 HD2 ARG 67 2.437 11.626 -3.428
484 HD3 ARG 67 HD1 ARG 67 1.997 12.756 -4.703
485 HE ARG 67 HE ARG 67 1.499 14.155 -2.465
486 HH11 ARG 67 HH11 ARG 67 4.342 12.395 -3.698
487 HH12 ARG 67 HH12 ARG 67 5.478 13.314 -2.852
488 HH21 ARG 67 HH21 ARG 67 3.108 15.441 -1.234
489 HH22 ARG 67 HH22 ARG 67 4.766 15.111 -1.480
490 H VAL 68 HN VAL 68 -1.063 7.999 -3.414
491 HA VAL 68 HA VAL 68 -0.630 6.773 -5.898
492 HB VAL 68 HB VAL 68 -0.797 4.597 -4.690
493 HG11 VAL 68 HG11 VAL 68 0.873 6.712 -3.345
494 HG12 VAL 68 HG12 VAL 68 1.307 5.793 -4.784
495 HG13 VAL 68 HG13 VAL 68 1.138 4.972 -3.229
496 HG21 VAL 68 HG21 VAL 68 -2.520 5.178 -3.053
497 HG22 VAL 68 HG22 VAL 68 -1.422 6.326 -2.290
498 HG23 VAL 68 HG23 VAL 68 -1.062 4.597 -2.249
499 H ASP 69 HN ASP 69 -1.875 6.324 -7.383
500 HA ASP 69 HA ASP 69 -4.694 6.628 -7.279
501 HB2 ASP 69 HB2 ASP 69 -3.028 5.416 -9.502
502 HB3 ASP 69 HB1 ASP 69 -4.654 6.070 -9.642
503 H THR 70 HN THR 70 -2.711 3.816 -8.178
504 HA THR 70 HA THR 70 -4.916 2.054 -7.390
505 HB THR 70 HB THR 70 -3.738 0.420 -8.864
506 HG1 THR 70 HG1 THR 70 -2.331 2.399 -10.191
507 HG21 THR 70 HG21 THR 70 -5.634 1.726 -9.730
508 HG22 THR 70 HG22 THR 70 -4.436 1.447 -10.993
509 HG23 THR 70 HG23 THR 70 -4.532 3.021 -10.199
510 HA PRO 71 HA PRO 71 -2.212 0.108 -4.341
511 HB2 PRO 71 HB2 PRO 71 -2.960 -2.488 -5.604
512 HB3 PRO 71 HB1 PRO 71 -3.082 -1.995 -3.910
513 HG2 PRO 71 HG2 PRO 71 -5.265 -2.142 -5.380
514 HG3 PRO 71 HG1 PRO 71 -5.033 -0.770 -4.275
515 HD2 PRO 71 HD2 PRO 71 -4.634 -0.895 -7.244
516 HD3 PRO 71 HD1 PRO 71 -5.426 0.364 -6.270
517 H ARG 72 HN ARG 72 -2.071 -0.714 -7.735
518 HA ARG 72 HA ARG 72 0.477 -1.942 -7.699
519 HB2 ARG 72 HB2 ARG 72 -0.756 -2.393 -9.646
520 HB3 ARG 72 HB1 ARG 72 -1.176 -0.703 -9.885
521 HG2 ARG 72 HG2 ARG 72 0.969 -0.183 -10.728
522 HG3 ARG 72 HG1 ARG 72 1.653 -1.695 -10.140
523 HD2 ARG 72 HD2 ARG 72 -0.521 -1.591 -12.209
524 HD3 ARG 72 HD1 ARG 72 1.196 -1.540 -12.625
525 HE ARG 72 HE ARG 72 1.122 -3.660 -11.062
526 HH11 ARG 72 HH11 ARG 72 -1.107 -2.808 -13.720
527 HH12 ARG 72 HH12 ARG 72 -1.250 -4.405 -14.292
528 HH21 ARG 72 HH21 ARG 72 0.854 -5.873 -11.808
529 HH22 ARG 72 HH22 ARG 72 -0.198 -6.200 -13.118
530 H GLU 73 HN GLU 73 -0.576 1.392 -8.125
531 HA GLU 73 HA GLU 73 1.958 2.506 -8.612
532 HB2 GLU 73 HB2 GLU 73 -0.231 3.698 -8.888
533 HB3 GLU 73 HB1 GLU 73 -0.371 3.767 -7.138
534 HG2 GLU 73 HG2 GLU 73 0.396 5.879 -7.891
535 HG3 GLU 73 HG1 GLU 73 1.744 5.074 -7.091
536 H LEU 74 HN LEU 74 0.162 1.927 -5.649
537 HA LEU 74 HA LEU 74 2.033 2.977 -3.826
538 HB2 LEU 74 HB2 LEU 74 -0.408 2.501 -3.410
539 HB3 LEU 74 HB1 LEU 74 -0.034 0.800 -3.375
540 HG LEU 74 HG LEU 74 -0.452 1.820 -1.145
541 HD11 LEU 74 HD11 LEU 74 0.825 -0.206 -1.252
542 HD12 LEU 74 HD12 LEU 74 1.426 0.838 0.039
543 HD13 LEU 74 HD13 LEU 74 2.311 0.716 -1.484
544 HD21 LEU 74 HD21 LEU 74 1.276 3.225 -0.115
545 HD22 LEU 74 HD22 LEU 74 0.503 4.006 -1.493
546 HD23 LEU 74 HD23 LEU 74 2.112 3.312 -1.667
547 H LEU 75 HN LEU 75 1.533 -0.316 -5.048
548 HA LEU 75 HA LEU 75 3.502 -1.622 -3.537
549 HB2 LEU 75 HB2 LEU 75 1.693 -2.754 -4.771
550 HB3 LEU 75 HB1 LEU 75 2.429 -2.283 -6.285
551 HG LEU 75 HG LEU 75 4.380 -3.714 -5.755
552 HD11 LEU 75 HD11 LEU 75 4.252 -5.306 -3.935
553 HD12 LEU 75 HD12 LEU 75 2.739 -4.580 -3.383
554 HD13 LEU 75 HD13 LEU 75 4.242 -3.652 -3.332
555 HD21 LEU 75 HD21 LEU 75 2.549 -4.577 -7.114
556 HD22 LEU 75 HD22 LEU 75 1.714 -5.115 -5.655
557 HD23 LEU 75 HD23 LEU 75 3.253 -5.845 -6.108
558 H ASP 76 HN ASP 76 3.627 -0.228 -6.791
559 HA ASP 76 HA ASP 76 6.240 -0.893 -7.501
560 HB2 ASP 76 HB2 ASP 76 4.631 -0.013 -9.100
561 HB3 ASP 76 HB1 ASP 76 4.609 1.530 -8.263
562 H LEU 77 HN LEU 77 5.021 1.856 -5.718
563 HA LEU 77 HA LEU 77 7.346 3.360 -5.414
564 HB2 LEU 77 HB2 LEU 77 5.137 4.157 -4.780
565 HB3 LEU 77 HB1 LEU 77 5.016 2.934 -3.538
566 HG LEU 77 HG LEU 77 6.845 4.061 -2.297
567 HD11 LEU 77 HD11 LEU 77 7.975 5.135 -4.168
568 HD12 LEU 77 HD12 LEU 77 7.521 6.313 -2.938
569 HD13 LEU 77 HD13 LEU 77 6.577 6.182 -4.423
570 HD21 LEU 77 HD21 LEU 77 5.498 5.971 -1.562
571 HD22 LEU 77 HD22 LEU 77 4.512 4.529 -1.773
572 HD23 LEU 77 HD23 LEU 77 4.478 5.804 -2.989
573 H ILE 78 HN ILE 78 6.090 0.683 -3.479
574 HA ILE 78 HA ILE 78 8.168 0.716 -1.529
575 HB ILE 78 HB ILE 78 6.394 -1.635 -2.232
576 HG12 ILE 78 HG12 ILE 78 5.909 0.640 -0.312
577 HG13 ILE 78 HG11 ILE 78 5.044 0.365 -1.822
578 HG21 ILE 78 HG21 ILE 78 6.790 -2.254 0.121
579 HG22 ILE 78 HG22 ILE 78 7.828 -0.843 0.321
580 HG23 ILE 78 HG23 ILE 78 8.308 -2.143 -0.770
581 HD11 ILE 78 HD11 ILE 78 5.067 -1.401 0.588
582 HD12 ILE 78 HD12 ILE 78 4.205 -1.751 -0.918
583 HD13 ILE 78 HD13 ILE 78 3.751 -0.355 0.075
584 H ASN 79 HN ASN 79 7.457 -1.493 -4.257
585 HA ASN 79 HA ASN 79 9.734 -3.111 -4.031
586 HB2 ASN 79 HB2 ASN 79 8.245 -2.341 -6.559
587 HB3 ASN 79 HB1 ASN 79 9.509 -3.555 -6.508
588 HD21 ASN 79 HD21 ASN 79 9.021 -5.590 -5.663
589 HD22 ASN 79 HD22 ASN 79 7.393 -6.054 -5.313
590 H GLY 80 HN GLY 80 9.354 0.006 -5.598
591 HA2 GLY 80 HA2 GLY 80 11.879 0.182 -6.803
592 HA3 GLY 80 HA1 GLY 80 10.899 1.548 -6.278
593 H ALA 81 HN ALA 81 10.792 1.345 -3.620
594 HA ALA 81 HA ALA 81 13.330 2.245 -2.764
595 HB1 ALA 81 HB1 ALA 81 10.958 1.395 -1.092
596 HB2 ALA 81 HB2 ALA 81 11.221 3.004 -1.756
597 HB3 ALA 81 HB3 ALA 81 12.322 2.364 -0.535
598 H LEU 82 HN LEU 82 11.709 -0.833 -2.510
599 HA LEU 82 HA LEU 82 13.525 -2.057 -0.738
600 HB2 LEU 82 HB2 LEU 82 11.436 -3.124 -2.581
601 HB3 LEU 82 HB1 LEU 82 12.511 -4.215 -1.729
602 HG LEU 82 HG LEU 82 10.689 -2.211 -0.387
603 HD11 LEU 82 HD11 LEU 82 9.429 -3.977 -1.511
604 HD12 LEU 82 HD12 LEU 82 9.369 -4.170 0.244
605 HD13 LEU 82 HD13 LEU 82 10.430 -5.194 -0.724
606 HD21 LEU 82 HD21 LEU 82 11.257 -3.453 1.641
607 HD22 LEU 82 HD22 LEU 82 12.696 -2.749 0.902
608 HD23 LEU 82 HD23 LEU 82 12.361 -4.469 0.715
609 H ALA 83 HN ALA 83 13.952 -1.205 -3.954
610 HA ALA 83 HA ALA 83 15.670 -3.378 -4.706
611 HB1 ALA 83 HB1 ALA 83 16.230 -2.014 -6.659
612 HB2 ALA 83 HB2 ALA 83 15.406 -0.629 -5.939
613 HB3 ALA 83 HB3 ALA 83 14.483 -2.058 -6.406
614 H GLU 84 HN GLU 84 15.993 -0.690 -2.723
615 HA GLU 84 HA GLU 84 18.905 -0.581 -2.986
616 HB2 GLU 84 HB2 GLU 84 17.549 1.520 -2.982
617 HB3 GLU 84 HB1 GLU 84 16.993 1.126 -1.369
618 HG2 GLU 84 HG2 GLU 84 18.739 2.816 -1.325
619 HG3 GLU 84 HG1 GLU 84 19.266 1.337 -0.524
620 H ALA 85 HN ALA 85 16.668 -2.388 -1.479
621 HA ALA 85 HA ALA 85 17.898 -2.402 1.155
622 HB1 ALA 85 HB1 ALA 85 15.422 -3.791 0.144
623 HB2 ALA 85 HB2 ALA 85 15.464 -2.274 1.043
624 HB3 ALA 85 HB3 ALA 85 15.993 -3.771 1.813
625 H ALA 86 HN ALA 86 19.588 -3.659 1.311
626 HA ALA 86 HA ALA 86 19.719 -6.134 -0.215
627 HB1 ALA 86 HB1 ALA 86 21.660 -4.646 -0.358
628 HB2 ALA 86 HB2 ALA 86 22.081 -6.166 0.429
629 HB3 ALA 86 HB3 ALA 86 21.838 -4.711 1.395
630 H28 SXV 87 H28A SXV 87 -3.839 12.167 4.602
631 H28A SXV 87 H28B SXV 87 -2.437 12.898 3.859
632 H30 SXV 87 H30C SXV 87 -2.718 13.244 6.661
633 H30A SXV 87 H30A SXV 87 -2.558 15.001 6.713
634 H30B SXV 87 H30B SXV 87 -1.598 14.058 5.574
635 H31 SXV 87 H31C SXV 87 -4.153 15.602 3.440
636 H31A SXV 87 H31A SXV 87 -2.432 15.532 3.824
637 H31B SXV 87 H31B SXV 87 -3.543 16.400 4.896
638 H32 SXV 87 H32A SXV 87 -5.286 13.332 6.210
639 HO33 SXV 87 H33A SXV 87 -6.536 15.203 4.916
640 HN36 SXV 87 H36A SXV 87 -4.110 14.805 8.027
641 H37 SXV 87 H37B SXV 87 -5.742 16.246 9.447
642 H37A SXV 87 H37A SXV 87 -5.323 17.464 8.253
643 H38 SXV 87 H38B SXV 87 -2.982 17.325 8.913
644 H38A SXV 87 H38A SXV 87 -3.375 16.015 10.037
645 HN41 SXV 87 H41A SXV 87 -2.087 17.969 11.090
646 H42 SXV 87 H42B SXV 87 -3.310 18.755 13.337
647 H42A SXV 87 H42A SXV 87 -3.713 20.070 12.251
648 H43 SXV 87 H43B SXV 87 -0.935 19.049 12.738
649 H43A SXV 87 H43A SXV 87 -1.347 20.554 11.949
650 H1 SXV 87 H1B SXV 87 0.815 20.400 14.068
651 H1A SXV 87 H1A SXV 87 0.291 22.007 13.536
652 H2 SXV 87 H2A SXV 87 1.733 22.106 15.464
653 H2A SXV 87 H2B SXV 87 0.532 21.230 16.414
654 H4 SXV 87 H4C SXV 87 1.644 24.390 16.565
655 H4A SXV 87 H4A SXV 87 0.198 25.325 16.166
656 H4B SXV 87 H4B SXV 87 1.183 24.627 14.873
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