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 |
|
|
26221 |
2kgc   |
16201 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 MET 1 HT1 MET 1 -19.993 11.032 2.345
2 H2 MET 1 HT2 MET 1 -19.451 9.844 1.266
3 H3 MET 1 HT3 MET 1 -20.089 11.294 0.670
4 HA MET 1 HA MET 1 -17.733 11.352 0.466
5 HB2 MET 1 HB2 MET 1 -18.786 13.097 2.701
6 HB3 MET 1 HB1 MET 1 -17.226 13.336 1.932
7 HG2 MET 1 HG2 MET 1 -18.757 14.871 0.971
8 HG3 MET 1 HG1 MET 1 -18.408 13.634 -0.235
9 HE1 MET 1 HE1 MET 1 -20.825 15.660 -0.479
10 HE2 MET 1 HE2 MET 1 -22.132 14.596 -0.996
11 HE3 MET 1 HE3 MET 1 -20.514 14.401 -1.674
12 H ALA 2 HN ALA 2 -15.829 10.553 1.106
13 HA ALA 2 HA ALA 2 -15.276 10.108 3.921
14 HB1 ALA 2 HB1 ALA 2 -15.233 7.803 1.972
15 HB2 ALA 2 HB2 ALA 2 -16.408 8.035 3.267
16 HB3 ALA 2 HB3 ALA 2 -14.711 7.755 3.656
17 H THR 3 HN THR 3 -12.991 9.393 4.240
18 HA THR 3 HA THR 3 -11.279 10.913 2.491
19 HB THR 3 HB THR 3 -10.485 9.247 4.854
20 HG1 THR 3 HG1 THR 3 -11.943 11.578 4.710
21 HG21 THR 3 HG21 THR 3 -8.618 10.023 3.472
22 HG22 THR 3 HG22 THR 3 -8.632 10.846 5.032
23 HG23 THR 3 HG23 THR 3 -9.218 11.680 3.592
24 H LEU 4 HN LEU 4 -10.749 9.976 0.603
25 HA LEU 4 HA LEU 4 -10.436 7.125 0.355
26 HB2 LEU 4 HB2 LEU 4 -9.939 9.327 -1.647
27 HB3 LEU 4 HB1 LEU 4 -9.965 7.614 -2.009
28 HG LEU 4 HG LEU 4 -12.318 9.268 -1.081
29 HD11 LEU 4 HD11 LEU 4 -11.686 7.981 -3.729
30 HD12 LEU 4 HD12 LEU 4 -11.706 9.710 -3.381
31 HD13 LEU 4 HD13 LEU 4 -13.204 8.777 -3.313
32 HD21 LEU 4 HD21 LEU 4 -12.454 7.012 -0.192
33 HD22 LEU 4 HD22 LEU 4 -12.148 6.343 -1.795
34 HD23 LEU 4 HD23 LEU 4 -13.634 7.240 -1.481
35 H LEU 5 HN LEU 5 -8.492 6.244 -0.805
36 HA LEU 5 HA LEU 5 -6.083 7.044 0.603
37 HB2 LEU 5 HB2 LEU 5 -7.093 4.646 -0.102
38 HB3 LEU 5 HB1 LEU 5 -6.060 4.929 -1.489
39 HG LEU 5 HG LEU 5 -5.148 4.850 1.392
40 HD11 LEU 5 HD11 LEU 5 -4.101 2.748 0.815
41 HD12 LEU 5 HD12 LEU 5 -4.718 2.859 -0.832
42 HD13 LEU 5 HD13 LEU 5 -5.839 2.659 0.516
43 HD21 LEU 5 HD21 LEU 5 -3.535 5.050 -1.146
44 HD22 LEU 5 HD22 LEU 5 -2.895 4.905 0.492
45 HD23 LEU 5 HD23 LEU 5 -3.788 6.350 0.016
46 H THR 6 HN THR 6 -4.573 8.385 -0.270
47 HA THR 6 HA THR 6 -4.793 8.978 -3.145
48 HB THR 6 HB THR 6 -3.695 11.106 -2.687
49 HG1 THR 6 HG1 THR 6 -3.828 11.015 0.041
50 HG21 THR 6 HG21 THR 6 -6.117 11.063 -2.457
51 HG22 THR 6 HG22 THR 6 -5.416 12.158 -1.264
52 HG23 THR 6 HG23 THR 6 -5.968 10.555 -0.774
53 H THR 7 HN THR 7 -2.611 9.797 -4.097
54 HA THR 7 HA THR 7 -0.738 7.713 -4.132
55 HB THR 7 HB THR 7 0.793 9.538 -5.145
56 HG1 THR 7 HG1 THR 7 -0.944 11.241 -5.931
57 HG21 THR 7 HG21 THR 7 -1.874 8.958 -6.437
58 HG22 THR 7 HG22 THR 7 -0.463 7.895 -6.463
59 HG23 THR 7 HG23 THR 7 -0.401 9.465 -7.264
60 H ASP 8 HN ASP 8 -0.460 10.948 -2.695
61 HA ASP 8 HA ASP 8 2.053 10.517 -1.510
62 HB2 ASP 8 HB2 ASP 8 1.075 12.754 -1.954
63 HB3 ASP 8 HB1 ASP 8 -0.070 12.487 -0.645
64 H ASP 9 HN ASP 9 -1.230 10.098 -0.267
65 HA ASP 9 HA ASP 9 -0.564 9.570 2.415
66 HB2 ASP 9 HB2 ASP 9 -2.911 9.373 0.764
67 HB3 ASP 9 HB1 ASP 9 -2.767 7.925 1.754
68 H LEU 10 HN LEU 10 -0.948 7.382 -0.357
69 HA LEU 10 HA LEU 10 -0.299 4.999 0.990
70 HB2 LEU 10 HB2 LEU 10 -1.311 5.113 -1.272
71 HB3 LEU 10 HB1 LEU 10 0.206 5.723 -1.901
72 HG LEU 10 HG LEU 10 1.300 3.594 -1.272
73 HD11 LEU 10 HD11 LEU 10 -0.151 2.934 0.562
74 HD12 LEU 10 HD12 LEU 10 -0.097 1.674 -0.670
75 HD13 LEU 10 HD13 LEU 10 -1.501 2.735 -0.556
76 HD21 LEU 10 HD21 LEU 10 -1.124 3.341 -3.048
77 HD22 LEU 10 HD22 LEU 10 0.243 2.228 -3.022
78 HD23 LEU 10 HD23 LEU 10 0.479 3.899 -3.532
79 H ARG 11 HN ARG 11 1.686 7.299 -0.816
80 HA ARG 11 HA ARG 11 4.160 6.060 -0.590
81 HB2 ARG 11 HB2 ARG 11 3.838 7.958 -2.044
82 HB3 ARG 11 HB1 ARG 11 3.447 8.995 -0.681
83 HG2 ARG 11 HG2 ARG 11 5.680 8.978 0.091
84 HG3 ARG 11 HG1 ARG 11 6.125 7.671 -1.008
85 HD2 ARG 11 HD2 ARG 11 6.937 9.852 -1.796
86 HD3 ARG 11 HD1 ARG 11 5.791 9.131 -2.923
87 HE ARG 11 HE ARG 11 4.496 10.901 -1.102
88 HH11 ARG 11 HH11 ARG 11 6.462 10.820 -3.998
89 HH12 ARG 11 HH12 ARG 11 5.919 12.366 -4.577
90 HH21 ARG 11 HH21 ARG 11 3.757 12.926 -1.852
91 HH22 ARG 11 HH22 ARG 11 4.353 13.557 -3.372
92 H ARG 12 HN ARG 12 2.527 8.245 1.667
93 HA ARG 12 HA ARG 12 4.671 8.381 3.512
94 HB2 ARG 12 HB2 ARG 12 1.718 8.833 3.973
95 HB3 ARG 12 HB1 ARG 12 2.991 9.229 5.117
96 HG2 ARG 12 HG2 ARG 12 2.570 10.452 2.400
97 HG3 ARG 12 HG1 ARG 12 2.287 11.215 3.965
98 HD2 ARG 12 HD2 ARG 12 4.955 10.273 2.915
99 HD3 ARG 12 HD1 ARG 12 4.400 11.946 2.966
100 HE ARG 12 HE ARG 12 4.284 10.809 5.555
101 HH11 ARG 12 HH11 ARG 12 6.550 12.021 3.190
102 HH12 ARG 12 HH12 ARG 12 7.770 12.425 4.365
103 HH21 ARG 12 HH21 ARG 12 5.855 11.354 7.113
104 HH22 ARG 12 HH22 ARG 12 7.365 12.046 6.603
105 H ALA 13 HN ALA 13 1.839 6.276 3.252
106 HA ALA 13 HA ALA 13 1.994 5.142 5.802
107 HB1 ALA 13 HB1 ALA 13 0.024 4.988 4.353
108 HB2 ALA 13 HB2 ALA 13 0.528 3.411 4.960
109 HB3 ALA 13 HB3 ALA 13 0.899 3.877 3.299
110 H LEU 14 HN LEU 14 3.439 4.078 2.743
111 HA LEU 14 HA LEU 14 4.579 1.693 3.669
112 HB2 LEU 14 HB2 LEU 14 5.185 3.576 1.444
113 HB3 LEU 14 HB1 LEU 14 6.384 2.366 1.847
114 HG LEU 14 HG LEU 14 5.009 1.595 0.014
115 HD11 LEU 14 HD11 LEU 14 5.825 -0.079 1.575
116 HD12 LEU 14 HD12 LEU 14 4.254 -0.537 0.916
117 HD13 LEU 14 HD13 LEU 14 4.367 0.110 2.552
118 HD21 LEU 14 HD21 LEU 14 2.661 1.898 1.879
119 HD22 LEU 14 HD22 LEU 14 2.622 1.179 0.269
120 HD23 LEU 14 HD23 LEU 14 2.994 2.893 0.461
121 H VAL 15 HN VAL 15 5.855 4.996 3.639
122 HA VAL 15 HA VAL 15 8.393 4.350 4.734
123 HB VAL 15 HB VAL 15 6.935 7.002 4.820
124 HG11 VAL 15 HG11 VAL 15 9.150 7.986 5.097
125 HG12 VAL 15 HG12 VAL 15 9.883 6.383 5.062
126 HG13 VAL 15 HG13 VAL 15 8.824 6.838 6.397
127 HG21 VAL 15 HG21 VAL 15 8.215 7.559 2.802
128 HG22 VAL 15 HG22 VAL 15 7.156 6.174 2.531
129 HG23 VAL 15 HG23 VAL 15 8.884 5.926 2.779
130 H GLU 16 HN GLU 16 5.393 5.618 6.170
131 HA GLU 16 HA GLU 16 6.319 6.004 8.774
132 HB2 GLU 16 HB2 GLU 16 3.546 5.250 7.836
133 HB3 GLU 16 HB1 GLU 16 3.932 5.838 9.447
134 HG2 GLU 16 HG2 GLU 16 4.657 7.959 8.529
135 HG3 GLU 16 HG1 GLU 16 4.363 7.369 6.894
136 H SER 17 HN SER 17 5.318 3.075 7.152
137 HA SER 17 HA SER 17 5.115 1.547 9.589
138 HB2 SER 17 HB2 SER 17 5.221 0.575 6.726
139 HB3 SER 17 HB1 SER 17 4.668 -0.340 8.129
140 HG SER 17 HG SER 17 3.441 1.832 6.813
141 H ALA 18 HN ALA 18 7.355 1.551 6.809
142 HA ALA 18 HA ALA 18 9.053 -0.383 8.103
143 HB1 ALA 18 HB1 ALA 18 9.436 1.126 5.520
144 HB2 ALA 18 HB2 ALA 18 8.691 -0.464 5.695
145 HB3 ALA 18 HB3 ALA 18 10.399 -0.245 6.072
146 H GLY 19 HN GLY 19 9.668 2.892 6.816
147 HA2 GLY 19 HA2 GLY 19 10.931 4.568 7.899
148 HA3 GLY 19 HA1 GLY 19 11.515 3.358 9.034
149 H GLU 20 HN GLU 20 11.770 1.874 6.183
150 HA GLU 20 HA GLU 20 14.576 2.113 5.973
151 HB2 GLU 20 HB2 GLU 20 12.742 1.174 3.764
152 HB3 GLU 20 HB1 GLU 20 14.406 0.697 4.060
153 HG2 GLU 20 HG2 GLU 20 12.025 0.000 5.762
154 HG3 GLU 20 HG1 GLU 20 12.875 -1.079 4.656
155 H THR 21 HN THR 21 15.539 3.988 5.375
156 HA THR 21 HA THR 21 14.371 5.427 3.082
157 HB THR 21 HB THR 21 15.815 6.855 5.307
158 HG1 THR 21 HG1 THR 21 13.845 5.597 6.001
159 HG21 THR 21 HG21 THR 21 14.555 8.783 4.482
160 HG22 THR 21 HG22 THR 21 13.729 7.760 3.306
161 HG23 THR 21 HG23 THR 21 15.464 8.039 3.167
162 H ASP 22 HN ASP 22 16.473 3.412 3.162
163 HA ASP 22 HA ASP 22 18.663 5.067 2.113
164 HB2 ASP 22 HB2 ASP 22 20.253 3.331 2.793
165 HB3 ASP 22 HB1 ASP 22 19.371 3.949 4.181
166 H GLY 23 HN GLY 23 18.875 4.894 -0.001
167 HA2 GLY 23 HA2 GLY 23 19.391 3.729 -1.962
168 HA3 GLY 23 HA1 GLY 23 18.825 2.244 -1.212
169 H THR 24 HN THR 24 16.263 3.072 -0.424
170 HA THR 24 HA THR 24 14.965 3.047 -3.037
171 HB THR 24 HB THR 24 14.296 1.263 -1.565
172 HG1 THR 24 HG1 THR 24 12.105 1.537 -1.718
173 HG21 THR 24 HG21 THR 24 13.152 1.697 0.580
174 HG22 THR 24 HG22 THR 24 13.543 3.410 0.415
175 HG23 THR 24 HG23 THR 24 14.835 2.223 0.584
176 H ASP 25 HN ASP 25 14.192 4.841 -3.877
177 HA ASP 25 HA ASP 25 13.240 6.941 -2.051
178 HB2 ASP 25 HB2 ASP 25 14.424 7.186 -4.819
179 HB3 ASP 25 HB1 ASP 25 13.583 8.505 -4.014
180 H LEU 26 HN LEU 26 11.119 6.959 -1.933
181 HA LEU 26 HA LEU 26 9.495 6.103 -4.189
182 HB2 LEU 26 HB2 LEU 26 8.803 6.899 -1.364
183 HB3 LEU 26 HB1 LEU 26 7.581 6.599 -2.582
184 HG LEU 26 HG LEU 26 8.627 4.280 -2.835
185 HD11 LEU 26 HD11 LEU 26 9.842 5.030 -0.185
186 HD12 LEU 26 HD12 LEU 26 10.725 4.742 -1.684
187 HD13 LEU 26 HD13 LEU 26 9.840 3.424 -0.914
188 HD21 LEU 26 HD21 LEU 26 7.384 3.413 -0.915
189 HD22 LEU 26 HD22 LEU 26 6.479 4.658 -1.775
190 HD23 LEU 26 HD23 LEU 26 7.276 5.043 -0.250
191 H SER 27 HN SER 27 11.107 8.710 -3.871
192 HA SER 27 HA SER 27 9.085 10.766 -4.029
193 HB2 SER 27 HB2 SER 27 12.047 10.985 -4.600
194 HB3 SER 27 HB1 SER 27 10.934 12.295 -4.207
195 HG SER 27 HG SER 27 12.184 11.605 -2.403
196 H GLY 28 HN GLY 28 9.681 8.473 -6.107
197 HA2 GLY 28 HA2 GLY 28 9.348 10.248 -8.430
198 HA3 GLY 28 HA1 GLY 28 10.475 8.901 -8.495
199 H ASP 29 HN ASP 29 9.729 7.137 -9.415
200 HA ASP 29 HA ASP 29 6.819 6.772 -9.558
201 HB2 ASP 29 HB2 ASP 29 9.024 5.995 -11.459
202 HB3 ASP 29 HB1 ASP 29 7.425 5.257 -11.544
203 H PHE 30 HN PHE 30 6.119 5.387 -8.139
204 HA PHE 30 HA PHE 30 7.775 3.034 -7.508
205 HB2 PHE 30 HB2 PHE 30 6.976 3.158 -5.198
206 HB3 PHE 30 HB1 PHE 30 7.780 4.651 -5.655
207 HD1 PHE 30 HD2 PHE 30 6.144 6.508 -6.591
208 HD2 PHE 30 HD1 PHE 30 4.975 3.302 -4.057
209 HE1 PHE 30 HE2 PHE 30 4.172 7.794 -5.877
210 HE2 PHE 30 HE1 PHE 30 2.999 4.584 -3.340
211 HZ PHE 30 HZ PHE 30 2.597 6.813 -4.219
212 H LEU 31 HN LEU 31 4.588 4.303 -8.128
213 HA LEU 31 HA LEU 31 3.003 2.163 -7.314
214 HB2 LEU 31 HB2 LEU 31 2.608 4.157 -9.534
215 HB3 LEU 31 HB1 LEU 31 1.375 3.014 -9.035
216 HG LEU 31 HG LEU 31 2.565 5.209 -7.337
217 HD11 LEU 31 HD11 LEU 31 -0.193 4.840 -8.494
218 HD12 LEU 31 HD12 LEU 31 1.009 6.024 -9.010
219 HD13 LEU 31 HD13 LEU 31 0.299 6.131 -7.398
220 HD21 LEU 31 HD21 LEU 31 0.887 4.522 -5.667
221 HD22 LEU 31 HD22 LEU 31 2.096 3.275 -5.963
222 HD23 LEU 31 HD23 LEU 31 0.487 3.126 -6.668
223 H ASP 32 HN ASP 32 4.977 2.492 -10.166
224 HA ASP 32 HA ASP 32 3.633 0.278 -11.496
225 HB2 ASP 32 HB2 ASP 32 5.160 0.786 -13.375
226 HB3 ASP 32 HB1 ASP 32 4.235 2.194 -12.862
227 H LEU 33 HN LEU 33 6.334 0.806 -9.472
228 HA LEU 33 HA LEU 33 7.701 -1.626 -10.284
229 HB2 LEU 33 HB2 LEU 33 8.196 0.312 -8.021
230 HB3 LEU 33 HB1 LEU 33 9.189 -1.095 -8.343
231 HG LEU 33 HG LEU 33 8.816 1.252 -10.205
232 HD11 LEU 33 HD11 LEU 33 10.142 1.773 -8.209
233 HD12 LEU 33 HD12 LEU 33 11.133 1.762 -9.665
234 HD13 LEU 33 HD13 LEU 33 11.191 0.397 -8.551
235 HD21 LEU 33 HD21 LEU 33 10.597 -1.174 -10.419
236 HD22 LEU 33 HD22 LEU 33 10.572 0.195 -11.531
237 HD23 LEU 33 HD23 LEU 33 9.162 -0.856 -11.396
238 H ARG 34 HN ARG 34 7.894 -3.478 -8.934
239 HA ARG 34 HA ARG 34 5.544 -4.067 -7.400
240 HB2 ARG 34 HB2 ARG 34 8.109 -5.645 -7.648
241 HB3 ARG 34 HB1 ARG 34 6.586 -6.245 -7.008
242 HG2 ARG 34 HG2 ARG 34 5.555 -6.156 -9.132
243 HG3 ARG 34 HG1 ARG 34 6.900 -5.238 -9.819
244 HD2 ARG 34 HD2 ARG 34 6.981 -8.083 -8.825
245 HD3 ARG 34 HD1 ARG 34 7.045 -7.554 -10.508
246 HE ARG 34 HE ARG 34 9.136 -6.249 -9.473
247 HH11 ARG 34 HH11 ARG 34 8.169 -9.610 -9.137
248 HH12 ARG 34 HH12 ARG 34 9.797 -10.175 -8.914
249 HH21 ARG 34 HH21 ARG 34 11.244 -6.981 -9.141
250 HH22 ARG 34 HH22 ARG 34 11.552 -8.684 -8.909
251 H PHE 35 HN PHE 35 5.658 -4.864 -5.148
252 HA PHE 35 HA PHE 35 6.688 -2.967 -3.400
253 HB2 PHE 35 HB2 PHE 35 6.042 -5.851 -2.761
254 HB3 PHE 35 HB1 PHE 35 6.142 -4.532 -1.603
255 HD1 PHE 35 HD2 PHE 35 4.582 -2.470 -2.201
256 HD2 PHE 35 HD1 PHE 35 3.980 -6.469 -3.522
257 HE1 PHE 35 HE2 PHE 35 2.200 -1.988 -2.558
258 HE2 PHE 35 HE1 PHE 35 1.596 -5.989 -3.885
259 HZ PHE 35 HZ PHE 35 0.698 -3.750 -3.403
260 H GLU 36 HN GLU 36 8.014 -6.152 -4.233
261 HA GLU 36 HA GLU 36 10.301 -5.925 -2.606
262 HB2 GLU 36 HB2 GLU 36 11.219 -7.763 -4.047
263 HB3 GLU 36 HB1 GLU 36 9.675 -8.095 -3.280
264 HG2 GLU 36 HG2 GLU 36 8.524 -7.629 -5.373
265 HG3 GLU 36 HG1 GLU 36 10.068 -7.271 -6.148
266 H ASP 37 HN ASP 37 9.564 -4.496 -5.668
267 HA ASP 37 HA ASP 37 12.315 -4.150 -6.468
268 HB2 ASP 37 HB2 ASP 37 9.752 -2.941 -7.524
269 HB3 ASP 37 HB1 ASP 37 11.338 -2.563 -8.181
270 H ILE 38 HN ILE 38 9.842 -2.307 -4.800
271 HA ILE 38 HA ILE 38 11.593 0.002 -4.606
272 HB ILE 38 HB ILE 38 9.740 0.959 -3.173
273 HG12 ILE 38 HG12 ILE 38 8.261 -1.469 -4.202
274 HG13 ILE 38 HG11 ILE 38 8.709 -1.188 -2.524
275 HG21 ILE 38 HG21 ILE 38 8.323 1.460 -5.096
276 HG22 ILE 38 HG22 ILE 38 9.054 0.122 -5.983
277 HG23 ILE 38 HG23 ILE 38 10.033 1.517 -5.528
278 HD11 ILE 38 HD11 ILE 38 6.788 0.460 -4.155
279 HD12 ILE 38 HD12 ILE 38 7.250 0.788 -2.485
280 HD13 ILE 38 HD13 ILE 38 6.370 -0.689 -2.885
281 H GLY 39 HN GLY 39 11.875 -2.794 -3.276
282 HA2 GLY 39 HA2 GLY 39 13.235 -3.453 -1.552
283 HA3 GLY 39 HA1 GLY 39 13.443 -1.763 -1.132
284 H TYR 40 HN TYR 40 10.298 -3.345 -1.265
285 HA TYR 40 HA TYR 40 10.181 -3.050 1.652
286 HB2 TYR 40 HB2 TYR 40 8.075 -2.760 -0.460
287 HB3 TYR 40 HB1 TYR 40 7.617 -3.172 1.191
288 HD1 TYR 40 HD1 TYR 40 9.023 -0.564 -0.975
289 HD2 TYR 40 HD2 TYR 40 7.905 -1.581 3.002
290 HE1 TYR 40 HE1 TYR 40 9.183 1.804 -0.329
291 HE2 TYR 40 HE2 TYR 40 8.055 0.782 3.656
292 HH TYR 40 HH TYR 40 9.237 2.839 2.874
293 H ASP 41 HN ASP 41 10.275 -4.784 2.789
294 HA ASP 41 HA ASP 41 10.111 -7.404 1.708
295 HB2 ASP 41 HB2 ASP 41 10.134 -6.456 4.586
296 HB3 ASP 41 HB1 ASP 41 10.252 -8.141 4.093
297 H SER 42 HN SER 42 8.583 -9.028 2.143
298 HA SER 42 HA SER 42 5.913 -8.396 1.811
299 HB2 SER 42 HB2 SER 42 5.526 -10.784 2.600
300 HB3 SER 42 HB1 SER 42 6.685 -10.594 1.277
301 H LEU 43 HN LEU 43 7.626 -9.184 4.814
302 HA LEU 43 HA LEU 43 5.375 -9.135 6.507
303 HB2 LEU 43 HB2 LEU 43 7.766 -10.041 6.913
304 HB3 LEU 43 HB1 LEU 43 8.149 -8.403 7.396
305 HG LEU 43 HG LEU 43 7.647 -9.991 9.274
306 HD11 LEU 43 HD11 LEU 43 7.523 -7.582 9.603
307 HD12 LEU 43 HD12 LEU 43 6.288 -8.418 10.545
308 HD13 LEU 43 HD13 LEU 43 5.847 -7.588 9.054
309 HD21 LEU 43 HD21 LEU 43 5.856 -11.256 8.251
310 HD22 LEU 43 HD22 LEU 43 4.849 -9.810 8.168
311 HD23 LEU 43 HD23 LEU 43 5.285 -10.494 9.734
312 H ALA 44 HN ALA 44 7.811 -6.629 5.802
313 HA ALA 44 HA ALA 44 6.646 -4.614 7.391
314 HB1 ALA 44 HB1 ALA 44 8.941 -4.461 6.579
315 HB2 ALA 44 HB2 ALA 44 8.011 -3.048 6.078
316 HB3 ALA 44 HB3 ALA 44 8.358 -4.333 4.921
317 H LEU 45 HN LEU 45 6.044 -5.720 4.145
318 HA LEU 45 HA LEU 45 4.400 -3.610 3.268
319 HB2 LEU 45 HB2 LEU 45 5.311 -5.135 1.683
320 HB3 LEU 45 HB1 LEU 45 4.603 -6.514 2.498
321 HG LEU 45 HG LEU 45 2.354 -5.733 1.814
322 HD11 LEU 45 HD11 LEU 45 2.134 -3.981 0.149
323 HD12 LEU 45 HD12 LEU 45 3.871 -3.667 0.222
324 HD13 LEU 45 HD13 LEU 45 2.853 -3.342 1.628
325 HD21 LEU 45 HD21 LEU 45 4.322 -6.071 -0.444
326 HD22 LEU 45 HD22 LEU 45 2.582 -6.340 -0.533
327 HD23 LEU 45 HD23 LEU 45 3.587 -7.374 0.485
328 H MET 46 HN MET 46 3.582 -6.718 4.842
329 HA MET 46 HA MET 46 0.793 -6.154 4.805
330 HB2 MET 46 HB2 MET 46 0.473 -8.127 6.094
331 HB3 MET 46 HB1 MET 46 1.760 -8.458 4.948
332 HG2 MET 46 HG2 MET 46 3.420 -8.195 6.685
333 HG3 MET 46 HG1 MET 46 2.164 -7.766 7.845
334 HE1 MET 46 HE1 MET 46 -0.138 -9.849 6.794
335 HE2 MET 46 HE2 MET 46 0.160 -9.482 8.494
336 HE3 MET 46 HE3 MET 46 0.112 -11.157 7.950
337 H GLU 47 HN GLU 47 3.381 -5.403 7.017
338 HA GLU 47 HA GLU 47 1.789 -4.507 9.172
339 HB2 GLU 47 HB2 GLU 47 4.505 -3.606 8.195
340 HB3 GLU 47 HB1 GLU 47 3.758 -2.991 9.664
341 HG2 GLU 47 HG2 GLU 47 3.678 -5.330 10.512
342 HG3 GLU 47 HG1 GLU 47 4.595 -5.820 9.086
343 H THR 48 HN THR 48 2.936 -2.950 6.233
344 HA THR 48 HA THR 48 1.934 -0.370 6.662
345 HB THR 48 HB THR 48 2.223 -1.804 4.010
346 HG1 THR 48 HG1 THR 48 4.176 -1.736 5.343
347 HG21 THR 48 HG21 THR 48 2.260 1.136 4.697
348 HG22 THR 48 HG22 THR 48 0.947 0.285 3.882
349 HG23 THR 48 HG23 THR 48 2.520 0.446 3.096
350 H ALA 49 HN ALA 49 0.471 -3.266 5.272
351 HA ALA 49 HA ALA 49 -1.924 -2.196 4.339
352 HB1 ALA 49 HB1 ALA 49 -1.194 -4.487 3.873
353 HB2 ALA 49 HB2 ALA 49 -2.837 -4.441 4.507
354 HB3 ALA 49 HB3 ALA 49 -1.505 -4.927 5.553
355 H ALA 50 HN ALA 50 -1.063 -3.318 7.574
356 HA ALA 50 HA ALA 50 -3.607 -3.097 8.755
357 HB1 ALA 50 HB1 ALA 50 -2.373 -3.063 10.892
358 HB2 ALA 50 HB2 ALA 50 -0.866 -2.865 9.997
359 HB3 ALA 50 HB3 ALA 50 -1.815 -4.341 9.811
360 H ARG 51 HN ARG 51 -1.068 -0.800 8.110
361 HA ARG 51 HA ARG 51 -2.042 1.312 9.740
362 HB2 ARG 51 HB2 ARG 51 -0.409 1.561 7.213
363 HB3 ARG 51 HB1 ARG 51 -0.502 2.711 8.534
364 HG2 ARG 51 HG2 ARG 51 0.616 -0.065 8.791
365 HG3 ARG 51 HG1 ARG 51 1.585 1.372 8.464
366 HD2 ARG 51 HD2 ARG 51 0.983 2.334 10.575
367 HD3 ARG 51 HD1 ARG 51 -0.193 1.051 10.876
368 HE ARG 51 HE ARG 51 1.722 -0.496 10.992
369 HH11 ARG 51 HH11 ARG 51 2.350 2.928 11.422
370 HH12 ARG 51 HH12 ARG 51 3.806 2.667 12.328
371 HH21 ARG 51 HH21 ARG 51 3.631 -0.830 12.175
372 HH22 ARG 51 HH22 ARG 51 4.534 0.547 12.755
373 H LEU 52 HN LEU 52 -2.533 0.358 6.388
374 HA LEU 52 HA LEU 52 -4.075 2.567 5.556
375 HB2 LEU 52 HB2 LEU 52 -4.278 -0.299 4.617
376 HB3 LEU 52 HB1 LEU 52 -4.880 1.109 3.766
377 HG LEU 52 HG LEU 52 -1.965 0.558 4.334
378 HD11 LEU 52 HD11 LEU 52 -1.797 0.068 1.950
379 HD12 LEU 52 HD12 LEU 52 -3.539 0.274 1.778
380 HD13 LEU 52 HD13 LEU 52 -2.900 -1.051 2.753
381 HD21 LEU 52 HD21 LEU 52 -1.537 2.398 2.811
382 HD22 LEU 52 HD22 LEU 52 -2.529 2.943 4.162
383 HD23 LEU 52 HD23 LEU 52 -3.269 2.645 2.591
384 H GLU 53 HN GLU 53 -5.019 -0.605 6.832
385 HA GLU 53 HA GLU 53 -7.780 -0.231 6.794
386 HB2 GLU 53 HB2 GLU 53 -6.131 -1.855 8.742
387 HB3 GLU 53 HB1 GLU 53 -7.869 -2.003 8.510
388 HG2 GLU 53 HG2 GLU 53 -7.510 -2.715 6.208
389 HG3 GLU 53 HG1 GLU 53 -5.768 -2.544 6.419
390 H SER 54 HN SER 54 -5.391 0.543 9.291
391 HA SER 54 HA SER 54 -7.247 1.343 11.274
392 HB2 SER 54 HB2 SER 54 -4.339 2.102 10.944
393 HB3 SER 54 HB1 SER 54 -5.297 2.319 12.408
394 HG SER 54 HG SER 54 -4.755 -0.165 11.143
395 H ARG 55 HN ARG 55 -5.949 3.005 8.513
396 HA ARG 55 HA ARG 55 -6.537 5.626 9.630
397 HB2 ARG 55 HB2 ARG 55 -4.482 5.288 8.292
398 HB3 ARG 55 HB1 ARG 55 -5.472 4.899 6.893
399 HG2 ARG 55 HG2 ARG 55 -6.353 7.123 6.817
400 HG3 ARG 55 HG1 ARG 55 -5.567 7.537 8.342
401 HD2 ARG 55 HD2 ARG 55 -4.165 6.805 5.769
402 HD3 ARG 55 HD1 ARG 55 -4.342 8.437 6.415
403 HE ARG 55 HE ARG 55 -3.132 6.889 8.387
404 HH11 ARG 55 HH11 ARG 55 -2.388 8.107 5.168
405 HH12 ARG 55 HH12 ARG 55 -0.670 8.063 5.429
406 HH21 ARG 55 HH21 ARG 55 -0.862 6.851 8.711
407 HH22 ARG 55 HH22 ARG 55 0.203 7.356 7.427
408 H TYR 56 HN TYR 56 -7.633 3.590 6.936
409 HA TYR 56 HA TYR 56 -9.679 5.580 6.306
410 HB2 TYR 56 HB2 TYR 56 -8.862 3.106 4.777
411 HB3 TYR 56 HB1 TYR 56 -9.956 4.365 4.208
412 HD1 TYR 56 HD2 TYR 56 -9.002 6.748 4.024
413 HD2 TYR 56 HD1 TYR 56 -6.570 3.279 4.385
414 HE1 TYR 56 HE2 TYR 56 -7.084 8.008 3.136
415 HE2 TYR 56 HE1 TYR 56 -4.648 4.525 3.504
416 HH TYR 56 HH TYR 56 -4.554 7.862 3.264
417 H GLY 57 HN GLY 57 -9.400 2.838 8.154
418 HA2 GLY 57 HA2 GLY 57 -11.008 1.701 9.352
419 HA3 GLY 57 HA1 GLY 57 -12.230 2.708 8.590
420 H VAL 58 HN VAL 58 -9.967 0.933 6.661
421 HA VAL 58 HA VAL 58 -12.194 -0.664 5.635
422 HB VAL 58 HB VAL 58 -10.742 -1.155 3.704
423 HG11 VAL 58 HG11 VAL 58 -10.959 1.781 4.359
424 HG12 VAL 58 HG12 VAL 58 -12.190 0.786 3.580
425 HG13 VAL 58 HG13 VAL 58 -10.665 1.114 2.754
426 HG21 VAL 58 HG21 VAL 58 -8.603 0.026 3.441
427 HG22 VAL 58 HG22 VAL 58 -8.577 -1.079 4.817
428 HG23 VAL 58 HG23 VAL 58 -8.754 0.655 5.083
429 H SER 59 HN SER 59 -11.040 -2.825 4.579
430 HA SER 59 HA SER 59 -9.085 -3.995 6.324
431 HB2 SER 59 HB2 SER 59 -11.366 -4.333 7.461
432 HB3 SER 59 HB1 SER 59 -11.737 -5.425 6.124
433 HG SER 59 HG SER 59 -9.288 -5.846 7.353
434 H ILE 60 HN ILE 60 -7.886 -5.443 5.228
435 HA ILE 60 HA ILE 60 -8.644 -5.868 2.422
436 HB ILE 60 HB ILE 60 -5.950 -6.262 3.731
437 HG12 ILE 60 HG12 ILE 60 -6.935 -3.950 2.037
438 HG13 ILE 60 HG11 ILE 60 -6.796 -3.905 3.790
439 HG21 ILE 60 HG21 ILE 60 -6.777 -6.145 0.834
440 HG22 ILE 60 HG22 ILE 60 -6.219 -7.573 1.705
441 HG23 ILE 60 HG23 ILE 60 -5.114 -6.228 1.414
442 HD11 ILE 60 HD11 ILE 60 -4.528 -4.287 1.850
443 HD12 ILE 60 HD12 ILE 60 -4.392 -4.241 3.609
444 HD13 ILE 60 HD13 ILE 60 -4.917 -2.806 2.730
445 HA PRO 61 HA PRO 61 -9.766 -10.071 3.452
446 HB2 PRO 61 HB2 PRO 61 -9.725 -10.378 0.509
447 HB3 PRO 61 HB1 PRO 61 -11.036 -10.674 1.657
448 HG2 PRO 61 HG2 PRO 61 -11.090 -8.559 0.048
449 HG3 PRO 61 HG1 PRO 61 -11.656 -8.445 1.726
450 HD2 PRO 61 HD2 PRO 61 -9.049 -7.556 0.542
451 HD3 PRO 61 HD1 PRO 61 -10.093 -6.723 1.714
452 H ASP 62 HN ASP 62 -8.979 -12.167 3.258
453 HA ASP 62 HA ASP 62 -6.212 -12.385 3.465
454 HB2 ASP 62 HB2 ASP 62 -7.801 -13.913 4.554
455 HB3 ASP 62 HB1 ASP 62 -8.246 -14.577 2.989
456 H ASP 63 HN ASP 63 -8.277 -13.650 0.825
457 HA ASP 63 HA ASP 63 -6.052 -14.857 -0.479
458 HB2 ASP 63 HB2 ASP 63 -8.828 -14.315 -1.557
459 HB3 ASP 63 HB1 ASP 63 -7.628 -15.349 -2.314
460 H VAL 64 HN VAL 64 -7.838 -11.860 -1.011
461 HA VAL 64 HA VAL 64 -6.639 -11.386 -3.554
462 HB VAL 64 HB VAL 64 -8.874 -10.474 -2.814
463 HG11 VAL 64 HG11 VAL 64 -8.865 -8.329 -1.627
464 HG12 VAL 64 HG12 VAL 64 -7.130 -8.498 -1.370
465 HG13 VAL 64 HG13 VAL 64 -8.245 -9.647 -0.632
466 HG21 VAL 64 HG21 VAL 64 -6.865 -8.538 -3.949
467 HG22 VAL 64 HG22 VAL 64 -8.617 -8.370 -4.054
468 HG23 VAL 64 HG23 VAL 64 -7.810 -9.718 -4.857
469 H ALA 65 HN ALA 65 -5.734 -10.740 -0.285
470 HA ALA 65 HA ALA 65 -4.017 -8.553 -0.646
471 HB1 ALA 65 HB1 ALA 65 -3.851 -10.777 1.380
472 HB2 ALA 65 HB2 ALA 65 -4.746 -9.267 1.557
473 HB3 ALA 65 HB3 ALA 65 -2.984 -9.245 1.472
474 H GLY 66 HN GLY 66 -3.490 -12.005 -0.951
475 HA2 GLY 66 HA2 GLY 66 -0.661 -11.626 -1.504
476 HA3 GLY 66 HA1 GLY 66 -1.508 -13.163 -1.404
477 H ARG 67 HN ARG 67 -3.333 -11.200 -3.339
478 HA ARG 67 HA ARG 67 -2.177 -12.482 -5.703
479 HB2 ARG 67 HB2 ARG 67 -4.927 -11.415 -5.122
480 HB3 ARG 67 HB1 ARG 67 -4.407 -11.818 -6.754
481 HG2 ARG 67 HG2 ARG 67 -3.900 -14.123 -5.943
482 HG3 ARG 67 HG1 ARG 67 -4.625 -13.675 -4.395
483 HD2 ARG 67 HD2 ARG 67 -6.194 -14.865 -5.907
484 HD3 ARG 67 HD1 ARG 67 -6.745 -13.252 -5.456
485 HE ARG 67 HE ARG 67 -5.274 -13.244 -7.909
486 HH11 ARG 67 HH11 ARG 67 -8.419 -13.995 -6.550
487 HH12 ARG 67 HH12 ARG 67 -9.283 -13.573 -7.994
488 HH21 ARG 67 HH21 ARG 67 -6.407 -12.654 -9.795
489 HH22 ARG 67 HH22 ARG 67 -8.144 -12.783 -9.833
490 H VAL 68 HN VAL 68 -1.938 -9.570 -4.219
491 HA VAL 68 HA VAL 68 -1.940 -8.024 -6.687
492 HB VAL 68 HB VAL 68 -1.302 -6.082 -5.272
493 HG11 VAL 68 HG11 VAL 68 -3.757 -7.577 -4.345
494 HG12 VAL 68 HG12 VAL 68 -3.648 -6.549 -5.773
495 HG13 VAL 68 HG13 VAL 68 -3.468 -5.845 -4.168
496 HG21 VAL 68 HG21 VAL 68 -0.149 -7.362 -3.506
497 HG22 VAL 68 HG22 VAL 68 -1.709 -7.983 -2.965
498 HG23 VAL 68 HG23 VAL 68 -1.360 -6.256 -2.862
499 H ASP 69 HN ASP 69 0.056 -6.453 -6.829
500 HA ASP 69 HA ASP 69 2.543 -7.874 -6.317
501 HB2 ASP 69 HB2 ASP 69 1.704 -8.859 -8.414
502 HB3 ASP 69 HB1 ASP 69 1.601 -7.256 -9.130
503 H THR 70 HN THR 70 1.070 -5.130 -8.051
504 HA THR 70 HA THR 70 3.331 -3.476 -7.176
505 HB THR 70 HB THR 70 2.535 -1.878 -8.957
506 HG1 THR 70 HG1 THR 70 1.170 -2.962 -10.583
507 HG21 THR 70 HG21 THR 70 3.285 -4.643 -9.926
508 HG22 THR 70 HG22 THR 70 4.421 -3.434 -9.330
509 HG23 THR 70 HG23 THR 70 3.511 -3.127 -10.808
510 HA PRO 71 HA PRO 71 0.911 -1.055 -4.329
511 HB2 PRO 71 HB2 PRO 71 2.152 1.237 -5.788
512 HB3 PRO 71 HB1 PRO 71 2.060 0.935 -4.051
513 HG2 PRO 71 HG2 PRO 71 4.330 0.501 -5.333
514 HG3 PRO 71 HG1 PRO 71 3.770 -0.665 -4.117
515 HD2 PRO 71 HD2 PRO 71 3.685 -0.847 -7.103
516 HD3 PRO 71 HD1 PRO 71 4.013 -2.115 -5.904
517 H ARG 72 HN ARG 72 0.985 -0.020 -7.727
518 HA ARG 72 HA ARG 72 -1.147 1.764 -7.703
519 HB2 ARG 72 HB2 ARG 72 0.401 1.310 -9.634
520 HB3 ARG 72 HB1 ARG 72 -0.530 -0.146 -9.958
521 HG2 ARG 72 HG2 ARG 72 -2.519 1.662 -9.871
522 HG3 ARG 72 HG1 ARG 72 -1.201 2.682 -10.452
523 HD2 ARG 72 HD2 ARG 72 -2.104 0.086 -11.674
524 HD3 ARG 72 HD1 ARG 72 -2.470 1.690 -12.295
525 HE ARG 72 HE ARG 72 0.021 1.931 -12.551
526 HH11 ARG 72 HH11 ARG 72 -1.474 -1.266 -12.590
527 HH12 ARG 72 HH12 ARG 72 -0.309 -1.920 -13.703
528 HH21 ARG 72 HH21 ARG 72 1.567 1.029 -13.980
529 HH22 ARG 72 HH22 ARG 72 1.428 -0.631 -14.467
530 H GLU 73 HN GLU 73 -1.180 -1.726 -8.350
531 HA GLU 73 HA GLU 73 -3.961 -1.923 -8.762
532 HB2 GLU 73 HB2 GLU 73 -2.137 -4.118 -7.771
533 HB3 GLU 73 HB1 GLU 73 -3.664 -4.311 -8.618
534 HG2 GLU 73 HG2 GLU 73 -1.093 -3.218 -9.742
535 HG3 GLU 73 HG1 GLU 73 -1.853 -4.760 -10.124
536 H LEU 74 HN LEU 74 -1.972 -2.142 -5.867
537 HA LEU 74 HA LEU 74 -3.983 -3.033 -4.079
538 HB2 LEU 74 HB2 LEU 74 -1.316 -2.578 -3.877
539 HB3 LEU 74 HB1 LEU 74 -1.929 -1.150 -3.072
540 HG LEU 74 HG LEU 74 -2.425 -4.019 -2.277
541 HD11 LEU 74 HD11 LEU 74 -1.196 -3.405 -0.268
542 HD12 LEU 74 HD12 LEU 74 -0.964 -1.774 -0.894
543 HD13 LEU 74 HD13 LEU 74 -0.215 -3.144 -1.710
544 HD21 LEU 74 HD21 LEU 74 -3.500 -1.477 -1.057
545 HD22 LEU 74 HD22 LEU 74 -3.634 -3.086 -0.346
546 HD23 LEU 74 HD23 LEU 74 -4.439 -2.725 -1.874
547 H LEU 75 HN LEU 75 -2.795 0.192 -4.938
548 HA LEU 75 HA LEU 75 -4.555 1.719 -3.404
549 HB2 LEU 75 HB2 LEU 75 -2.581 2.620 -4.578
550 HB3 LEU 75 HB1 LEU 75 -3.375 2.347 -6.117
551 HG LEU 75 HG LEU 75 -5.166 3.953 -5.361
552 HD11 LEU 75 HD11 LEU 75 -4.754 3.862 -2.974
553 HD12 LEU 75 HD12 LEU 75 -4.575 5.512 -3.573
554 HD13 LEU 75 HD13 LEU 75 -3.146 4.545 -3.211
555 HD21 LEU 75 HD21 LEU 75 -3.432 4.591 -6.949
556 HD22 LEU 75 HD22 LEU 75 -2.348 4.999 -5.618
557 HD23 LEU 75 HD23 LEU 75 -3.822 5.934 -5.876
558 H ASP 76 HN ASP 76 -4.833 0.613 -6.760
559 HA ASP 76 HA ASP 76 -7.306 1.735 -7.380
560 HB2 ASP 76 HB2 ASP 76 -5.760 0.743 -9.033
561 HB3 ASP 76 HB1 ASP 76 -6.134 -0.858 -8.406
562 H LEU 77 HN LEU 77 -6.520 -1.379 -5.930
563 HA LEU 77 HA LEU 77 -9.086 -2.499 -5.959
564 HB2 LEU 77 HB2 LEU 77 -7.084 -3.818 -5.540
565 HB3 LEU 77 HB1 LEU 77 -6.787 -2.941 -4.053
566 HG LEU 77 HG LEU 77 -8.920 -3.879 -3.143
567 HD11 LEU 77 HD11 LEU 77 -9.913 -5.803 -4.267
568 HD12 LEU 77 HD12 LEU 77 -8.812 -5.584 -5.629
569 HD13 LEU 77 HD13 LEU 77 -10.024 -4.354 -5.267
570 HD21 LEU 77 HD21 LEU 77 -6.886 -5.921 -4.030
571 HD22 LEU 77 HD22 LEU 77 -8.000 -6.071 -2.671
572 HD23 LEU 77 HD23 LEU 77 -6.724 -4.856 -2.634
573 H ILE 78 HN ILE 78 -7.409 -0.730 -3.356
574 HA ILE 78 HA ILE 78 -9.634 -0.917 -1.584
575 HB ILE 78 HB ILE 78 -7.276 0.975 -1.438
576 HG12 ILE 78 HG12 ILE 78 -7.715 -1.771 -0.239
577 HG13 ILE 78 HG11 ILE 78 -6.594 -1.379 -1.534
578 HG21 ILE 78 HG21 ILE 78 -7.798 1.082 0.955
579 HG22 ILE 78 HG22 ILE 78 -9.210 0.058 0.696
580 HG23 ILE 78 HG23 ILE 78 -9.147 1.670 -0.017
581 HD11 ILE 78 HD11 ILE 78 -5.344 0.055 0.027
582 HD12 ILE 78 HD12 ILE 78 -5.406 -1.636 0.526
583 HD13 ILE 78 HD13 ILE 78 -6.439 -0.446 1.320
584 H ASN 79 HN ASN 79 -8.518 1.539 -3.881
585 HA ASN 79 HA ASN 79 -10.380 3.548 -3.189
586 HB2 ASN 79 HB2 ASN 79 -8.851 2.897 -5.681
587 HB3 ASN 79 HB1 ASN 79 -10.154 4.074 -5.769
588 HD21 ASN 79 HD21 ASN 79 -7.998 3.592 -3.019
589 HD22 ASN 79 HD22 ASN 79 -7.223 5.135 -3.139
590 H GLY 80 HN GLY 80 -10.545 0.888 -5.529
591 HA2 GLY 80 HA2 GLY 80 -13.147 1.451 -6.467
592 HA3 GLY 80 HA1 GLY 80 -12.322 -0.096 -6.593
593 H ALA 81 HN ALA 81 -11.988 -0.469 -3.748
594 HA ALA 81 HA ALA 81 -14.479 -1.698 -3.159
595 HB1 ALA 81 HB1 ALA 81 -12.148 -1.176 -1.315
596 HB2 ALA 81 HB2 ALA 81 -12.339 -2.589 -2.352
597 HB3 ALA 81 HB3 ALA 81 -13.472 -2.305 -1.030
598 H LEU 82 HN LEU 82 -12.950 1.309 -2.154
599 HA LEU 82 HA LEU 82 -14.940 2.006 -0.233
600 HB2 LEU 82 HB2 LEU 82 -12.876 3.618 -1.719
601 HB3 LEU 82 HB1 LEU 82 -13.970 4.332 -0.550
602 HG LEU 82 HG LEU 82 -11.976 2.145 0.058
603 HD11 LEU 82 HD11 LEU 82 -10.857 4.247 -0.446
604 HD12 LEU 82 HD12 LEU 82 -10.758 3.886 1.276
605 HD13 LEU 82 HD13 LEU 82 -11.904 5.094 0.697
606 HD21 LEU 82 HD21 LEU 82 -13.713 3.790 1.894
607 HD22 LEU 82 HD22 LEU 82 -12.540 2.566 2.381
608 HD23 LEU 82 HD23 LEU 82 -13.980 2.097 1.477
609 H ALA 83 HN ALA 83 -14.532 2.466 -3.669
610 HA ALA 83 HA ALA 83 -16.544 4.416 -4.052
611 HB1 ALA 83 HB1 ALA 83 -15.442 2.394 -6.003
612 HB2 ALA 83 HB2 ALA 83 -14.811 4.015 -5.711
613 HB3 ALA 83 HB3 ALA 83 -16.411 3.804 -6.423
614 H GLU 84 HN GLU 84 -16.693 1.037 -3.456
615 HA GLU 84 HA GLU 84 -19.322 0.700 -4.610
616 HB2 GLU 84 HB2 GLU 84 -17.707 -1.150 -2.846
617 HB3 GLU 84 HB1 GLU 84 -19.201 -1.570 -3.670
618 HG2 GLU 84 HG2 GLU 84 -18.106 -1.183 -5.831
619 HG3 GLU 84 HG1 GLU 84 -16.601 -0.819 -4.991
620 H ALA 85 HN ALA 85 -18.214 2.187 -1.910
621 HA ALA 85 HA ALA 85 -20.490 1.367 -0.238
622 HB1 ALA 85 HB1 ALA 85 -19.281 2.338 1.640
623 HB2 ALA 85 HB2 ALA 85 -18.000 2.876 0.554
624 HB3 ALA 85 HB3 ALA 85 -18.273 1.152 0.807
625 H ALA 86 HN ALA 86 -21.950 2.865 0.498
626 HA ALA 86 HA ALA 86 -21.615 5.647 -0.367
627 HB1 ALA 86 HB1 ALA 86 -23.953 5.722 -1.106
628 HB2 ALA 86 HB2 ALA 86 -24.106 3.996 -0.781
629 HB3 ALA 86 HB3 ALA 86 -23.011 4.559 -2.043
630 H28 SXO 87 H28B SXO 87 5.967 -11.887 5.010
631 H28A SXO 87 H28A SXO 87 6.745 -13.390 5.512
632 H30 SXO 87 H30A SXO 87 4.101 -11.933 6.403
633 H30A SXO 87 H30C SXO 87 3.214 -13.427 6.720
634 H30B SXO 87 H30B SXO 87 4.894 -13.274 7.235
635 H31 SXO 87 H31A SXO 87 4.017 -13.497 3.081
636 H31A SXO 87 H31B SXO 87 3.556 -12.081 4.028
637 H31B SXO 87 H31C SXO 87 2.690 -13.602 4.235
638 H32 SXO 87 H32A SXO 87 5.314 -15.415 6.056
639 HO33 SXO 87 H33A SXO 87 4.691 -15.969 3.413
640 HN36 SXO 87 H36A SXO 87 3.199 -15.301 7.220
641 H37 SXO 87 H37A SXO 87 0.794 -16.090 5.837
642 H37A SXO 87 H37B SXO 87 1.512 -17.364 6.824
643 H38 SXO 87 H38B SXO 87 1.346 -14.866 8.261
644 H38A SXO 87 H38A SXO 87 0.733 -16.454 8.705
645 HN41 SXO 87 H41A SXO 87 -0.001 -14.396 5.984
646 H42 SXO 87 H42A SXO 87 -2.520 -14.663 5.400
647 H42A SXO 87 H42B SXO 87 -2.694 -13.778 6.919
648 H43 SXO 87 H43B SXO 87 -2.732 -12.305 4.913
649 H43A SXO 87 H43A SXO 87 -1.396 -11.930 6.016
650 H2 SXO 87 H2A SXO 87 1.082 -12.018 2.300
651 H2A SXO 87 H2B SXO 87 1.614 -10.582 3.166
652 H3 SXO 87 H3B SXO 87 1.160 -10.248 0.726
653 H3A SXO 87 H3A SXO 87 -0.544 -10.553 1.063
654 H4 SXO 87 H4A SXO 87 1.060 -8.406 2.443
655 H4A SXO 87 H4B SXO 87 -0.692 -8.627 2.456
656 H5 SXO 87 H5B SXO 87 0.957 -7.957 0.021
657 H5A SXO 87 H5A SXO 87 -0.800 -8.130 0.077
658 H6 SXO 87 H6A SXO 87 0.076 -5.762 0.141
659 H6A SXO 87 H6B SXO 87 0.712 -6.132 1.744
660 H7 SXO 87 H7A SXO 87 -1.407 -5.072 2.052
661 H7A SXO 87 H7B SXO 87 -1.624 -6.791 2.414
662 H8 SXO 87 H8C SXO 87 -3.455 -5.910 1.051
663 H8A SXO 87 H8A SXO 87 -2.542 -7.146 0.184
664 H8B SXO 87 H8B SXO 87 -2.299 -5.440 -0.195
Start of MODEL 2
1 H1 MET 1 HT1 MET 1 -17.453 14.533 5.110
2 H2 MET 1 HT2 MET 1 -16.030 13.835 5.710
3 H3 MET 1 HT3 MET 1 -17.388 12.864 5.406
4 HA MET 1 HA MET 1 -17.235 13.338 3.053
5 HB2 MET 1 HB2 MET 1 -14.728 14.811 3.907
6 HB3 MET 1 HB1 MET 1 -15.107 14.394 2.243
7 HG2 MET 1 HG2 MET 1 -16.759 16.182 4.010
8 HG3 MET 1 HG1 MET 1 -15.622 16.724 2.777
9 HE1 MET 1 HE1 MET 1 -17.553 18.209 1.648
10 HE2 MET 1 HE2 MET 1 -18.642 17.666 2.924
11 HE3 MET 1 HE3 MET 1 -19.141 17.563 1.236
12 H ALA 2 HN ALA 2 -16.416 11.634 1.932
13 HA ALA 2 HA ALA 2 -14.893 9.700 3.431
14 HB1 ALA 2 HB1 ALA 2 -15.215 8.244 1.510
15 HB2 ALA 2 HB2 ALA 2 -15.842 9.598 0.570
16 HB3 ALA 2 HB3 ALA 2 -16.736 9.006 1.971
17 H THR 3 HN THR 3 -12.836 10.429 3.739
18 HA THR 3 HA THR 3 -11.234 11.487 1.616
19 HB THR 3 HB THR 3 -9.353 11.117 3.303
20 HG1 THR 3 HG1 THR 3 -10.502 9.452 4.474
21 HG21 THR 3 HG21 THR 3 -10.510 13.273 3.048
22 HG22 THR 3 HG22 THR 3 -10.069 12.963 4.728
23 HG23 THR 3 HG23 THR 3 -11.736 12.741 4.199
24 H LEU 4 HN LEU 4 -10.772 10.176 -0.037
25 HA LEU 4 HA LEU 4 -10.427 7.347 0.324
26 HB2 LEU 4 HB2 LEU 4 -9.875 8.960 -2.157
27 HB3 LEU 4 HB1 LEU 4 -10.183 7.235 -2.054
28 HG LEU 4 HG LEU 4 -12.174 9.450 -1.546
29 HD11 LEU 4 HD11 LEU 4 -12.007 7.367 -3.715
30 HD12 LEU 4 HD12 LEU 4 -11.669 9.088 -3.898
31 HD13 LEU 4 HD13 LEU 4 -13.301 8.547 -3.507
32 HD21 LEU 4 HD21 LEU 4 -12.555 7.563 -0.032
33 HD22 LEU 4 HD22 LEU 4 -12.572 6.462 -1.409
34 HD23 LEU 4 HD23 LEU 4 -13.827 7.691 -1.246
35 H LEU 5 HN LEU 5 -8.464 6.334 -0.901
36 HA LEU 5 HA LEU 5 -6.119 7.236 0.515
37 HB2 LEU 5 HB2 LEU 5 -7.078 4.804 -0.209
38 HB3 LEU 5 HB1 LEU 5 -5.926 5.079 -1.498
39 HG LEU 5 HG LEU 5 -5.298 5.048 1.454
40 HD11 LEU 5 HD11 LEU 5 -5.814 2.844 0.604
41 HD12 LEU 5 HD12 LEU 5 -4.083 2.984 0.904
42 HD13 LEU 5 HD13 LEU 5 -4.702 3.073 -0.745
43 HD21 LEU 5 HD21 LEU 5 -3.445 5.285 -0.912
44 HD22 LEU 5 HD22 LEU 5 -2.976 5.205 0.787
45 HD23 LEU 5 HD23 LEU 5 -3.874 6.597 0.182
46 H THR 6 HN THR 6 -4.585 8.548 -0.336
47 HA THR 6 HA THR 6 -4.778 9.176 -3.194
48 HB THR 6 HB THR 6 -3.658 11.255 -2.708
49 HG1 THR 6 HG1 THR 6 -3.578 11.023 0.040
50 HG21 THR 6 HG21 THR 6 -6.064 11.224 -2.282
51 HG22 THR 6 HG22 THR 6 -5.245 12.302 -1.153
52 HG23 THR 6 HG23 THR 6 -5.774 10.706 -0.622
53 H THR 7 HN THR 7 -2.549 10.003 -4.056
54 HA THR 7 HA THR 7 -0.720 7.909 -4.240
55 HB THR 7 HB THR 7 0.843 9.856 -5.009
56 HG1 THR 7 HG1 THR 7 -0.052 11.710 -4.375
57 HG21 THR 7 HG21 THR 7 -0.295 8.319 -6.535
58 HG22 THR 7 HG22 THR 7 -0.322 9.965 -7.166
59 HG23 THR 7 HG23 THR 7 -1.769 9.284 -6.422
60 H ASP 8 HN ASP 8 -0.454 10.957 -2.472
61 HA ASP 8 HA ASP 8 2.075 10.421 -1.355
62 HB2 ASP 8 HB2 ASP 8 -0.061 12.376 -0.481
63 HB3 ASP 8 HB1 ASP 8 1.615 12.398 0.058
64 H ASP 9 HN ASP 9 -1.212 10.077 -0.054
65 HA ASP 9 HA ASP 9 -0.438 9.369 2.560
66 HB2 ASP 9 HB2 ASP 9 -2.929 8.853 0.964
67 HB3 ASP 9 HB1 ASP 9 -2.732 8.179 2.577
68 H LEU 10 HN LEU 10 -0.792 7.482 -0.374
69 HA LEU 10 HA LEU 10 -0.587 4.923 0.804
70 HB2 LEU 10 HB2 LEU 10 -1.071 5.821 -1.699
71 HB3 LEU 10 HB1 LEU 10 0.609 5.360 -1.873
72 HG LEU 10 HG LEU 10 -1.644 3.544 -1.018
73 HD11 LEU 10 HD11 LEU 10 -0.041 3.648 -3.565
74 HD12 LEU 10 HD12 LEU 10 -1.728 4.131 -3.376
75 HD13 LEU 10 HD13 LEU 10 -1.263 2.445 -3.154
76 HD21 LEU 10 HD21 LEU 10 1.268 2.922 -1.500
77 HD22 LEU 10 HD22 LEU 10 -0.003 1.743 -1.174
78 HD23 LEU 10 HD23 LEU 10 0.448 2.915 0.063
79 H ARG 11 HN ARG 11 1.810 7.017 -0.743
80 HA ARG 11 HA ARG 11 4.096 5.488 -0.281
81 HB2 ARG 11 HB2 ARG 11 3.989 7.441 -1.781
82 HB3 ARG 11 HB1 ARG 11 3.848 8.503 -0.391
83 HG2 ARG 11 HG2 ARG 11 6.080 7.794 0.353
84 HG3 ARG 11 HG1 ARG 11 6.217 6.783 -1.090
85 HD2 ARG 11 HD2 ARG 11 7.352 8.944 -1.382
86 HD3 ARG 11 HD1 ARG 11 6.013 8.745 -2.513
87 HE ARG 11 HE ARG 11 5.800 10.341 -0.030
88 HH11 ARG 11 HH11 ARG 11 5.231 9.931 -3.462
89 HH12 ARG 11 HH12 ARG 11 4.330 11.409 -3.621
90 HH21 ARG 11 HH21 ARG 11 4.613 12.277 -0.244
91 HH22 ARG 11 HH22 ARG 11 3.963 12.731 -1.794
92 H ARG 12 HN ARG 12 2.507 7.870 1.790
93 HA ARG 12 HA ARG 12 4.477 7.972 3.799
94 HB2 ARG 12 HB2 ARG 12 1.508 8.461 3.966
95 HB3 ARG 12 HB1 ARG 12 2.647 8.822 5.258
96 HG2 ARG 12 HG2 ARG 12 3.813 10.387 3.789
97 HG3 ARG 12 HG1 ARG 12 2.659 10.032 2.501
98 HD2 ARG 12 HD2 ARG 12 2.021 12.077 3.582
99 HD3 ARG 12 HD1 ARG 12 0.841 10.828 3.976
100 HE ARG 12 HE ARG 12 2.747 10.834 6.004
101 HH11 ARG 12 HH11 ARG 12 0.277 12.955 4.714
102 HH12 ARG 12 HH12 ARG 12 0.073 13.834 6.202
103 HH21 ARG 12 HH21 ARG 12 2.472 11.979 7.973
104 HH22 ARG 12 HH22 ARG 12 1.303 13.271 8.046
105 H ALA 13 HN ALA 13 1.683 5.855 3.352
106 HA ALA 13 HA ALA 13 1.728 4.627 5.874
107 HB1 ALA 13 HB1 ALA 13 -0.133 4.427 4.273
108 HB2 ALA 13 HB2 ALA 13 0.408 2.867 4.887
109 HB3 ALA 13 HB3 ALA 13 0.872 3.385 3.265
110 H LEU 14 HN LEU 14 3.545 3.986 2.942
111 HA LEU 14 HA LEU 14 4.814 1.606 3.790
112 HB2 LEU 14 HB2 LEU 14 5.413 3.715 1.758
113 HB3 LEU 14 HB1 LEU 14 6.680 2.584 2.185
114 HG LEU 14 HG LEU 14 5.564 1.834 0.186
115 HD11 LEU 14 HD11 LEU 14 4.895 -0.402 0.866
116 HD12 LEU 14 HD12 LEU 14 4.791 0.135 2.543
117 HD13 LEU 14 HD13 LEU 14 6.348 0.125 1.716
118 HD21 LEU 14 HD21 LEU 14 3.422 2.931 0.469
119 HD22 LEU 14 HD22 LEU 14 3.028 1.858 1.812
120 HD23 LEU 14 HD23 LEU 14 3.199 1.206 0.182
121 H VAL 15 HN VAL 15 5.874 4.991 3.886
122 HA VAL 15 HA VAL 15 8.340 4.495 5.170
123 HB VAL 15 HB VAL 15 6.714 7.050 5.078
124 HG11 VAL 15 HG11 VAL 15 9.631 6.628 5.733
125 HG12 VAL 15 HG12 VAL 15 8.370 7.151 6.849
126 HG13 VAL 15 HG13 VAL 15 8.848 8.194 5.510
127 HG21 VAL 15 HG21 VAL 15 7.231 6.229 2.857
128 HG22 VAL 15 HG22 VAL 15 8.932 6.053 3.290
129 HG23 VAL 15 HG23 VAL 15 8.202 7.657 3.216
130 H GLU 16 HN GLU 16 5.147 5.387 6.455
131 HA GLU 16 HA GLU 16 5.970 5.824 9.112
132 HB2 GLU 16 HB2 GLU 16 3.317 5.037 7.917
133 HB3 GLU 16 HB1 GLU 16 3.525 5.292 9.646
134 HG2 GLU 16 HG2 GLU 16 4.168 7.583 9.282
135 HG3 GLU 16 HG1 GLU 16 4.152 7.345 7.536
136 H SER 17 HN SER 17 5.306 2.885 7.355
137 HA SER 17 HA SER 17 5.500 1.237 9.733
138 HB2 SER 17 HB2 SER 17 5.489 0.391 6.824
139 HB3 SER 17 HB1 SER 17 5.195 -0.637 8.229
140 HG SER 17 HG SER 17 3.521 1.190 6.975
141 H ALA 18 HN ALA 18 7.435 2.035 6.893
142 HA ALA 18 HA ALA 18 9.893 1.571 8.337
143 HB1 ALA 18 HB1 ALA 18 10.797 -0.065 6.764
144 HB2 ALA 18 HB2 ALA 18 9.251 -0.103 5.913
145 HB3 ALA 18 HB3 ALA 18 9.361 -0.695 7.572
146 H GLY 19 HN GLY 19 10.753 3.524 7.871
147 HA2 GLY 19 HA2 GLY 19 10.807 4.319 5.030
148 HA3 GLY 19 HA1 GLY 19 10.445 5.469 6.307
149 H GLU 20 HN GLU 20 12.959 3.184 5.276
150 HA GLU 20 HA GLU 20 15.008 4.665 6.669
151 HB2 GLU 20 HB2 GLU 20 15.157 2.211 6.432
152 HB3 GLU 20 HB1 GLU 20 15.244 2.391 4.684
153 HG2 GLU 20 HG2 GLU 20 17.363 3.467 4.826
154 HG3 GLU 20 HG1 GLU 20 17.248 3.578 6.582
155 H THR 21 HN THR 21 15.959 6.432 5.891
156 HA THR 21 HA THR 21 15.493 7.151 3.098
157 HB THR 21 HB THR 21 16.508 9.378 3.940
158 HG1 THR 21 HG1 THR 21 17.279 8.943 5.926
159 HG21 THR 21 HG21 THR 21 14.131 9.031 3.389
160 HG22 THR 21 HG22 THR 21 14.334 10.110 4.768
161 HG23 THR 21 HG23 THR 21 13.851 8.433 5.025
162 H ASP 22 HN ASP 22 17.665 5.332 4.323
163 HA ASP 22 HA ASP 22 20.127 6.657 3.673
164 HB2 ASP 22 HB2 ASP 22 19.492 3.797 4.421
165 HB3 ASP 22 HB1 ASP 22 21.123 4.379 4.102
166 H GLY 23 HN GLY 23 18.239 4.001 2.243
167 HA2 GLY 23 HA2 GLY 23 19.431 4.663 -0.348
168 HA3 GLY 23 HA1 GLY 23 19.646 3.026 0.254
169 H THR 24 HN THR 24 16.698 4.530 1.118
170 HA THR 24 HA THR 24 15.322 2.914 -0.917
171 HB THR 24 HB THR 24 14.213 3.852 1.742
172 HG1 THR 24 HG1 THR 24 14.506 1.236 1.748
173 HG21 THR 24 HG21 THR 24 12.501 3.400 0.058
174 HG22 THR 24 HG22 THR 24 12.475 2.163 1.315
175 HG23 THR 24 HG23 THR 24 13.206 1.813 -0.251
176 H ASP 25 HN ASP 25 15.059 4.351 -2.558
177 HA ASP 25 HA ASP 25 14.084 7.055 -1.945
178 HB2 ASP 25 HB2 ASP 25 16.114 6.728 -3.408
179 HB3 ASP 25 HB1 ASP 25 15.053 5.985 -4.602
180 H LEU 26 HN LEU 26 11.979 7.407 -2.088
181 HA LEU 26 HA LEU 26 10.392 5.791 -3.972
182 HB2 LEU 26 HB2 LEU 26 9.544 7.044 -1.358
183 HB3 LEU 26 HB1 LEU 26 8.471 6.204 -2.461
184 HG LEU 26 HG LEU 26 10.798 4.969 -0.993
185 HD11 LEU 26 HD11 LEU 26 9.053 3.752 0.239
186 HD12 LEU 26 HD12 LEU 26 7.824 4.715 -0.582
187 HD13 LEU 26 HD13 LEU 26 8.975 5.494 0.504
188 HD21 LEU 26 HD21 LEU 26 10.442 3.917 -3.158
189 HD22 LEU 26 HD22 LEU 26 8.730 3.710 -2.791
190 HD23 LEU 26 HD23 LEU 26 9.943 2.845 -1.849
191 H SER 27 HN SER 27 11.796 8.273 -4.569
192 HA SER 27 HA SER 27 9.750 10.346 -4.591
193 HB2 SER 27 HB2 SER 27 12.411 10.595 -5.958
194 HB3 SER 27 HB1 SER 27 11.470 11.828 -5.117
195 HG SER 27 HG SER 27 13.049 9.747 -4.033
196 H GLY 28 HN GLY 28 10.547 7.763 -6.527
197 HA2 GLY 28 HA2 GLY 28 9.914 9.156 -9.033
198 HA3 GLY 28 HA1 GLY 28 10.711 7.598 -8.911
199 H ASP 29 HN ASP 29 9.147 6.934 -10.519
200 HA ASP 29 HA ASP 29 6.355 6.857 -9.910
201 HB2 ASP 29 HB2 ASP 29 7.825 5.212 -11.981
202 HB3 ASP 29 HB1 ASP 29 6.117 5.633 -11.969
203 H PHE 30 HN PHE 30 6.520 5.833 -7.790
204 HA PHE 30 HA PHE 30 7.562 3.182 -7.561
205 HB2 PHE 30 HB2 PHE 30 6.792 3.239 -5.269
206 HB3 PHE 30 HB1 PHE 30 7.538 4.781 -5.662
207 HD1 PHE 30 HD2 PHE 30 5.937 6.710 -6.316
208 HD2 PHE 30 HD1 PHE 30 4.693 3.167 -4.310
209 HE1 PHE 30 HE2 PHE 30 3.908 7.869 -5.540
210 HE2 PHE 30 HE1 PHE 30 2.662 4.317 -3.526
211 HZ PHE 30 HZ PHE 30 2.267 6.670 -4.146
212 H LEU 31 HN LEU 31 4.472 4.536 -8.298
213 HA LEU 31 HA LEU 31 2.750 2.487 -7.558
214 HB2 LEU 31 HB2 LEU 31 2.578 4.427 -9.854
215 HB3 LEU 31 HB1 LEU 31 1.264 3.374 -9.368
216 HG LEU 31 HG LEU 31 2.522 5.469 -7.596
217 HD11 LEU 31 HD11 LEU 31 1.310 6.455 -9.485
218 HD12 LEU 31 HD12 LEU 31 0.491 6.741 -7.949
219 HD13 LEU 31 HD13 LEU 31 -0.114 5.505 -9.053
220 HD21 LEU 31 HD21 LEU 31 0.088 3.720 -7.243
221 HD22 LEU 31 HD22 LEU 31 0.544 5.050 -6.179
222 HD23 LEU 31 HD23 LEU 31 1.587 3.634 -6.320
223 H ASP 32 HN ASP 32 4.879 2.692 -10.322
224 HA ASP 32 HA ASP 32 3.618 0.386 -11.595
225 HB2 ASP 32 HB2 ASP 32 5.751 2.320 -12.478
226 HB3 ASP 32 HB1 ASP 32 5.417 0.840 -13.369
227 H LEU 33 HN LEU 33 6.026 0.955 -9.356
228 HA LEU 33 HA LEU 33 7.703 -1.278 -10.204
229 HB2 LEU 33 HB2 LEU 33 7.936 0.591 -7.845
230 HB3 LEU 33 HB1 LEU 33 9.084 -0.674 -8.233
231 HG LEU 33 HG LEU 33 8.479 1.704 -9.992
232 HD11 LEU 33 HD11 LEU 33 10.721 2.466 -9.340
233 HD12 LEU 33 HD12 LEU 33 10.825 1.132 -8.191
234 HD13 LEU 33 HD13 LEU 33 9.615 2.394 -7.969
235 HD21 LEU 33 HD21 LEU 33 9.183 -0.257 -11.266
236 HD22 LEU 33 HD22 LEU 33 10.587 -0.445 -10.213
237 HD23 LEU 33 HD23 LEU 33 10.446 0.974 -11.252
238 H ARG 34 HN ARG 34 7.782 -3.247 -9.168
239 HA ARG 34 HA ARG 34 5.521 -3.952 -7.552
240 HB2 ARG 34 HB2 ARG 34 8.027 -5.570 -8.024
241 HB3 ARG 34 HB1 ARG 34 6.464 -6.169 -7.496
242 HG2 ARG 34 HG2 ARG 34 5.501 -5.864 -9.615
243 HG3 ARG 34 HG1 ARG 34 6.831 -4.835 -10.157
244 HD2 ARG 34 HD2 ARG 34 6.906 -7.795 -9.611
245 HD3 ARG 34 HD1 ARG 34 7.121 -6.981 -11.162
246 HE ARG 34 HE ARG 34 9.154 -5.938 -10.062
247 HH11 ARG 34 HH11 ARG 34 7.942 -9.109 -9.160
248 HH12 ARG 34 HH12 ARG 34 9.480 -9.665 -8.576
249 HH21 ARG 34 HH21 ARG 34 11.165 -6.649 -9.277
250 HH22 ARG 34 HH22 ARG 34 11.326 -8.281 -8.670
251 H PHE 35 HN PHE 35 5.776 -5.025 -5.420
252 HA PHE 35 HA PHE 35 7.045 -3.375 -3.560
253 HB2 PHE 35 HB2 PHE 35 6.142 -6.238 -3.211
254 HB3 PHE 35 HB1 PHE 35 6.486 -5.103 -1.907
255 HD1 PHE 35 HD2 PHE 35 5.155 -2.873 -1.962
256 HD2 PHE 35 HD1 PHE 35 3.989 -6.401 -4.031
257 HE1 PHE 35 HE2 PHE 35 2.856 -2.014 -2.109
258 HE2 PHE 35 HE1 PHE 35 1.688 -5.547 -4.193
259 HZ PHE 35 HZ PHE 35 1.118 -3.352 -3.234
260 H GLU 36 HN GLU 36 8.173 -6.361 -5.088
261 HA GLU 36 HA GLU 36 10.544 -6.683 -3.626
262 HB2 GLU 36 HB2 GLU 36 9.888 -7.374 -6.485
263 HB3 GLU 36 HB1 GLU 36 11.420 -7.785 -5.731
264 HG2 GLU 36 HG2 GLU 36 9.994 -8.966 -3.953
265 HG3 GLU 36 HG1 GLU 36 8.684 -8.838 -5.129
266 H ASP 37 HN ASP 37 9.724 -4.470 -6.210
267 HA ASP 37 HA ASP 37 12.483 -3.913 -6.876
268 HB2 ASP 37 HB2 ASP 37 9.961 -2.520 -7.811
269 HB3 ASP 37 HB1 ASP 37 11.566 -2.315 -8.499
270 H ILE 38 HN ILE 38 9.971 -2.531 -4.898
271 HA ILE 38 HA ILE 38 11.500 -0.097 -4.490
272 HB ILE 38 HB ILE 38 9.679 0.567 -2.946
273 HG12 ILE 38 HG12 ILE 38 8.419 -2.046 -3.817
274 HG13 ILE 38 HG11 ILE 38 8.998 -1.671 -2.198
275 HG21 ILE 38 HG21 ILE 38 9.602 1.194 -5.288
276 HG22 ILE 38 HG22 ILE 38 7.975 0.872 -4.689
277 HG23 ILE 38 HG23 ILE 38 8.800 -0.325 -5.688
278 HD11 ILE 38 HD11 ILE 38 6.731 -0.290 -3.618
279 HD12 ILE 38 HD12 ILE 38 7.312 0.081 -1.995
280 HD13 ILE 38 HD13 ILE 38 6.581 -1.488 -2.333
281 H GLY 39 HN GLY 39 11.973 -3.073 -3.485
282 HA2 GLY 39 HA2 GLY 39 13.242 -3.981 -1.820
283 HA3 GLY 39 HA1 GLY 39 13.766 -2.343 -1.470
284 H TYR 40 HN TYR 40 10.560 -3.886 -1.161
285 HA TYR 40 HA TYR 40 10.702 -3.243 1.704
286 HB2 TYR 40 HB2 TYR 40 8.493 -3.020 -0.263
287 HB3 TYR 40 HB1 TYR 40 8.062 -3.549 1.362
288 HD1 TYR 40 HD1 TYR 40 9.420 -0.767 -0.635
289 HD2 TYR 40 HD2 TYR 40 8.229 -2.056 3.242
290 HE1 TYR 40 HE1 TYR 40 9.472 1.559 0.152
291 HE2 TYR 40 HE2 TYR 40 8.279 0.270 4.035
292 HH TYR 40 HH TYR 40 9.239 2.383 3.479
293 H ASP 41 HN ASP 41 10.939 -4.875 2.971
294 HA ASP 41 HA ASP 41 10.749 -7.573 2.216
295 HB2 ASP 41 HB2 ASP 41 10.800 -6.296 4.956
296 HB3 ASP 41 HB1 ASP 41 10.932 -8.027 4.676
297 H SER 42 HN SER 42 9.268 -9.169 2.718
298 HA SER 42 HA SER 42 6.566 -8.672 2.520
299 HB2 SER 42 HB2 SER 42 6.316 -11.011 3.451
300 HB3 SER 42 HB1 SER 42 7.463 -10.874 2.110
301 H LEU 43 HN LEU 43 8.486 -9.207 5.447
302 HA LEU 43 HA LEU 43 6.491 -9.111 7.367
303 HB2 LEU 43 HB2 LEU 43 8.843 -9.689 7.798
304 HB3 LEU 43 HB1 LEU 43 9.297 -8.014 7.554
305 HG LEU 43 HG LEU 43 7.809 -7.444 9.524
306 HD11 LEU 43 HD11 LEU 43 6.491 -9.517 9.498
307 HD12 LEU 43 HD12 LEU 43 7.249 -9.234 11.065
308 HD13 LEU 43 HD13 LEU 43 7.929 -10.426 9.957
309 HD21 LEU 43 HD21 LEU 43 9.489 -8.093 11.159
310 HD22 LEU 43 HD22 LEU 43 10.257 -7.544 9.670
311 HD23 LEU 43 HD23 LEU 43 10.159 -9.269 10.029
312 H ALA 44 HN ALA 44 8.430 -6.411 6.102
313 HA ALA 44 HA ALA 44 7.097 -4.394 7.566
314 HB1 ALA 44 HB1 ALA 44 9.330 -4.098 6.591
315 HB2 ALA 44 HB2 ALA 44 8.216 -2.832 6.076
316 HB3 ALA 44 HB3 ALA 44 8.624 -4.148 4.975
317 H LEU 45 HN LEU 45 6.449 -5.971 4.533
318 HA LEU 45 HA LEU 45 4.681 -4.034 3.476
319 HB2 LEU 45 HB2 LEU 45 5.858 -5.773 2.156
320 HB3 LEU 45 HB1 LEU 45 4.807 -6.981 2.865
321 HG LEU 45 HG LEU 45 2.871 -5.996 1.786
322 HD11 LEU 45 HD11 LEU 45 4.803 -3.981 0.649
323 HD12 LEU 45 HD12 LEU 45 3.550 -3.657 1.846
324 HD13 LEU 45 HD13 LEU 45 3.103 -4.143 0.210
325 HD21 LEU 45 HD21 LEU 45 4.145 -7.655 0.549
326 HD22 LEU 45 HD22 LEU 45 5.178 -6.389 -0.112
327 HD23 LEU 45 HD23 LEU 45 3.469 -6.449 -0.546
328 H MET 46 HN MET 46 4.102 -7.031 5.335
329 HA MET 46 HA MET 46 1.276 -6.771 5.226
330 HB2 MET 46 HB2 MET 46 1.150 -8.513 6.865
331 HB3 MET 46 HB1 MET 46 2.444 -8.915 5.748
332 HG2 MET 46 HG2 MET 46 4.107 -8.371 7.336
333 HG3 MET 46 HG1 MET 46 2.934 -7.597 8.401
334 HE1 MET 46 HE1 MET 46 3.490 -8.877 10.577
335 HE2 MET 46 HE2 MET 46 4.883 -9.543 9.726
336 HE3 MET 46 HE3 MET 46 3.819 -10.609 10.643
337 H GLU 47 HN GLU 47 3.736 -5.496 7.355
338 HA GLU 47 HA GLU 47 2.010 -4.426 9.324
339 HB2 GLU 47 HB2 GLU 47 4.780 -3.648 8.412
340 HB3 GLU 47 HB1 GLU 47 3.951 -2.824 9.727
341 HG2 GLU 47 HG2 GLU 47 4.573 -5.764 9.641
342 HG3 GLU 47 HG1 GLU 47 5.511 -4.548 10.512
343 H THR 48 HN THR 48 3.219 -3.218 6.255
344 HA THR 48 HA THR 48 2.210 -0.592 6.414
345 HB THR 48 HB THR 48 2.660 -2.271 3.935
346 HG1 THR 48 HG1 THR 48 4.540 -2.071 5.280
347 HG21 THR 48 HG21 THR 48 2.956 -0.113 2.809
348 HG22 THR 48 HG22 THR 48 2.560 0.724 4.311
349 HG23 THR 48 HG23 THR 48 1.341 -0.261 3.503
350 H ALA 49 HN ALA 49 0.771 -3.627 5.334
351 HA ALA 49 HA ALA 49 -1.546 -2.655 4.128
352 HB1 ALA 49 HB1 ALA 49 -1.227 -5.187 5.730
353 HB2 ALA 49 HB2 ALA 49 -0.829 -4.995 4.023
354 HB3 ALA 49 HB3 ALA 49 -2.503 -4.852 4.562
355 H ALA 50 HN ALA 50 -0.884 -3.410 7.510
356 HA ALA 50 HA ALA 50 -3.488 -3.089 8.511
357 HB1 ALA 50 HB1 ALA 50 -2.439 -2.940 10.707
358 HB2 ALA 50 HB2 ALA 50 -0.866 -2.686 9.950
359 HB3 ALA 50 HB3 ALA 50 -1.702 -4.226 9.750
360 H ARG 51 HN ARG 51 -0.961 -0.831 7.760
361 HA ARG 51 HA ARG 51 -1.814 1.420 9.185
362 HB2 ARG 51 HB2 ARG 51 -0.442 1.190 6.506
363 HB3 ARG 51 HB1 ARG 51 -0.665 2.704 7.359
364 HG2 ARG 51 HG2 ARG 51 0.840 0.347 8.446
365 HG3 ARG 51 HG1 ARG 51 1.580 1.724 7.631
366 HD2 ARG 51 HD2 ARG 51 0.679 3.217 9.344
367 HD3 ARG 51 HD1 ARG 51 -0.049 1.835 10.162
368 HE ARG 51 HE ARG 51 2.676 1.325 9.849
369 HH11 ARG 51 HH11 ARG 51 0.617 3.568 11.570
370 HH12 ARG 51 HH12 ARG 51 1.704 3.726 12.916
371 HH21 ARG 51 HH21 ARG 51 4.109 1.563 11.623
372 HH22 ARG 51 HH22 ARG 51 3.669 2.597 12.939
373 H LEU 52 HN LEU 52 -2.557 0.443 5.845
374 HA LEU 52 HA LEU 52 -4.171 2.664 5.257
375 HB2 LEU 52 HB2 LEU 52 -4.260 -0.088 4.024
376 HB3 LEU 52 HB1 LEU 52 -4.940 1.373 3.333
377 HG LEU 52 HG LEU 52 -2.002 0.887 3.831
378 HD11 LEU 52 HD11 LEU 52 -2.890 -0.500 2.028
379 HD12 LEU 52 HD12 LEU 52 -1.828 0.761 1.403
380 HD13 LEU 52 HD13 LEU 52 -3.577 0.931 1.260
381 HD21 LEU 52 HD21 LEU 52 -1.698 2.947 2.511
382 HD22 LEU 52 HD22 LEU 52 -2.554 3.235 4.026
383 HD23 LEU 52 HD23 LEU 52 -3.446 3.181 2.507
384 H GLU 53 HN GLU 53 -4.996 -0.580 6.402
385 HA GLU 53 HA GLU 53 -7.778 -0.309 6.278
386 HB2 GLU 53 HB2 GLU 53 -6.076 -1.994 8.115
387 HB3 GLU 53 HB1 GLU 53 -7.819 -2.160 7.940
388 HG2 GLU 53 HG2 GLU 53 -7.540 -2.704 5.581
389 HG3 GLU 53 HG1 GLU 53 -5.796 -2.522 5.747
390 H SER 54 HN SER 54 -5.626 0.090 9.109
391 HA SER 54 HA SER 54 -7.679 0.928 10.857
392 HB2 SER 54 HB2 SER 54 -5.493 0.006 11.589
393 HB3 SER 54 HB1 SER 54 -4.702 1.478 11.031
394 HG SER 54 HG SER 54 -6.718 1.337 13.045
395 H ARG 55 HN ARG 55 -5.662 2.650 8.599
396 HA ARG 55 HA ARG 55 -5.897 5.247 9.711
397 HB2 ARG 55 HB2 ARG 55 -4.142 4.400 8.121
398 HB3 ARG 55 HB1 ARG 55 -5.339 4.475 6.845
399 HG2 ARG 55 HG2 ARG 55 -5.402 6.824 6.899
400 HG3 ARG 55 HG1 ARG 55 -4.528 6.891 8.436
401 HD2 ARG 55 HD2 ARG 55 -2.532 6.037 7.413
402 HD3 ARG 55 HD1 ARG 55 -3.381 5.722 5.906
403 HE ARG 55 HE ARG 55 -3.624 8.236 5.782
404 HH11 ARG 55 HH11 ARG 55 -1.034 6.747 7.606
405 HH12 ARG 55 HH12 ARG 55 0.145 7.964 7.202
406 HH21 ARG 55 HH21 ARG 55 -2.054 9.857 5.222
407 HH22 ARG 55 HH22 ARG 55 -0.453 9.724 5.885
408 H TYR 56 HN TYR 56 -7.769 3.496 7.255
409 HA TYR 56 HA TYR 56 -9.545 5.845 7.082
410 HB2 TYR 56 HB2 TYR 56 -8.944 3.775 4.967
411 HB3 TYR 56 HB1 TYR 56 -10.123 5.075 4.800
412 HD1 TYR 56 HD2 TYR 56 -9.255 7.483 5.075
413 HD2 TYR 56 HD1 TYR 56 -6.709 4.145 4.379
414 HE1 TYR 56 HE2 TYR 56 -7.477 9.000 4.319
415 HE2 TYR 56 HE1 TYR 56 -4.922 5.658 3.628
416 HH TYR 56 HH TYR 56 -4.703 7.939 2.713
417 H GLY 57 HN GLY 57 -9.433 2.979 8.523
418 HA2 GLY 57 HA2 GLY 57 -11.065 1.698 9.520
419 HA3 GLY 57 HA1 GLY 57 -12.241 2.868 8.940
420 H VAL 58 HN VAL 58 -10.022 0.960 6.962
421 HA VAL 58 HA VAL 58 -12.375 -0.254 5.677
422 HB VAL 58 HB VAL 58 -10.944 -0.657 3.705
423 HG11 VAL 58 HG11 VAL 58 -10.793 1.660 2.947
424 HG12 VAL 58 HG12 VAL 58 -10.982 2.216 4.611
425 HG13 VAL 58 HG13 VAL 58 -12.300 1.358 3.811
426 HG21 VAL 58 HG21 VAL 58 -8.760 0.428 3.522
427 HG22 VAL 58 HG22 VAL 58 -8.773 -0.777 4.809
428 HG23 VAL 58 HG23 VAL 58 -8.868 0.939 5.207
429 H SER 59 HN SER 59 -11.295 -2.336 4.366
430 HA SER 59 HA SER 59 -9.615 -3.918 6.090
431 HB2 SER 59 HB2 SER 59 -11.340 -5.792 6.111
432 HB3 SER 59 HB1 SER 59 -11.694 -4.421 7.160
433 HG SER 59 HG SER 59 -12.703 -4.655 4.521
434 H ILE 60 HN ILE 60 -8.325 -5.112 4.844
435 HA ILE 60 HA ILE 60 -8.930 -5.239 1.987
436 HB ILE 60 HB ILE 60 -6.398 -6.001 3.458
437 HG12 ILE 60 HG12 ILE 60 -7.081 -3.495 1.896
438 HG13 ILE 60 HG11 ILE 60 -6.939 -3.605 3.649
439 HG21 ILE 60 HG21 ILE 60 -6.889 -5.610 0.504
440 HG22 ILE 60 HG22 ILE 60 -6.639 -7.157 1.313
441 HG23 ILE 60 HG23 ILE 60 -5.336 -5.972 1.263
442 HD11 ILE 60 HD11 ILE 60 -4.723 -4.028 1.656
443 HD12 ILE 60 HD12 ILE 60 -4.569 -4.189 3.406
444 HD13 ILE 60 HD13 ILE 60 -4.952 -2.622 2.693
445 HA PRO 61 HA PRO 61 -10.570 -9.350 2.208
446 HB2 PRO 61 HB2 PRO 61 -9.336 -9.569 -0.496
447 HB3 PRO 61 HB1 PRO 61 -10.986 -9.932 0.022
448 HG2 PRO 61 HG2 PRO 61 -10.447 -7.715 -1.340
449 HG3 PRO 61 HG1 PRO 61 -11.625 -7.708 -0.015
450 HD2 PRO 61 HD2 PRO 61 -8.830 -6.660 -0.067
451 HD3 PRO 61 HD1 PRO 61 -10.258 -6.032 0.781
452 H ASP 62 HN ASP 62 -9.875 -11.272 2.808
453 HA ASP 62 HA ASP 62 -7.320 -11.619 3.786
454 HB2 ASP 62 HB2 ASP 62 -9.271 -12.839 4.593
455 HB3 ASP 62 HB1 ASP 62 -9.370 -13.722 3.076
456 H ASP 63 HN ASP 63 -8.691 -13.177 0.886
457 HA ASP 63 HA ASP 63 -6.175 -14.406 0.242
458 HB2 ASP 63 HB2 ASP 63 -8.236 -15.570 -0.300
459 HB3 ASP 63 HB1 ASP 63 -8.766 -14.230 -1.311
460 H VAL 64 HN VAL 64 -7.980 -11.601 -0.864
461 HA VAL 64 HA VAL 64 -6.457 -11.225 -3.244
462 HB VAL 64 HB VAL 64 -8.201 -9.226 -1.800
463 HG11 VAL 64 HG11 VAL 64 -6.746 -8.179 -3.464
464 HG12 VAL 64 HG12 VAL 64 -8.433 -8.146 -3.978
465 HG13 VAL 64 HG13 VAL 64 -7.321 -9.316 -4.686
466 HG21 VAL 64 HG21 VAL 64 -9.426 -11.265 -2.297
467 HG22 VAL 64 HG22 VAL 64 -8.910 -11.176 -3.982
468 HG23 VAL 64 HG23 VAL 64 -9.973 -9.935 -3.318
469 H ALA 65 HN ALA 65 -5.928 -10.409 0.043
470 HA ALA 65 HA ALA 65 -4.423 -8.064 -0.185
471 HB1 ALA 65 HB1 ALA 65 -4.099 -10.261 1.848
472 HB2 ALA 65 HB2 ALA 65 -5.234 -8.916 1.959
473 HB3 ALA 65 HB3 ALA 65 -3.498 -8.608 1.999
474 H GLY 66 HN GLY 66 -3.437 -11.435 -0.354
475 HA2 GLY 66 HA2 GLY 66 -0.656 -10.634 -0.806
476 HA3 GLY 66 HA1 GLY 66 -1.222 -12.263 -0.471
477 H ARG 67 HN ARG 67 -2.626 -10.133 -2.894
478 HA ARG 67 HA ARG 67 -1.372 -11.774 -4.986
479 HB2 ARG 67 HB2 ARG 67 -4.304 -11.020 -4.949
480 HB3 ARG 67 HB1 ARG 67 -3.483 -11.974 -6.177
481 HG2 ARG 67 HG2 ARG 67 -3.010 -13.700 -4.489
482 HG3 ARG 67 HG1 ARG 67 -3.914 -12.758 -3.304
483 HD2 ARG 67 HD2 ARG 67 -5.436 -14.357 -4.069
484 HD3 ARG 67 HD1 ARG 67 -5.859 -12.891 -4.948
485 HE ARG 67 HE ARG 67 -4.334 -13.969 -6.752
486 HH11 ARG 67 HH11 ARG 67 -6.555 -15.628 -4.615
487 HH12 ARG 67 HH12 ARG 67 -6.810 -16.952 -5.714
488 HH21 ARG 67 HH21 ARG 67 -4.669 -15.704 -8.210
489 HH22 ARG 67 HH22 ARG 67 -5.758 -16.993 -7.767
490 H VAL 68 HN VAL 68 -1.477 -8.851 -3.788
491 HA VAL 68 HA VAL 68 -1.797 -7.411 -6.309
492 HB VAL 68 HB VAL 68 -1.343 -5.369 -4.926
493 HG11 VAL 68 HG11 VAL 68 -3.511 -5.418 -3.751
494 HG12 VAL 68 HG12 VAL 68 -3.595 -7.158 -4.021
495 HG13 VAL 68 HG13 VAL 68 -3.619 -6.051 -5.394
496 HG21 VAL 68 HG21 VAL 68 -0.032 -6.418 -3.146
497 HG22 VAL 68 HG22 VAL 68 -1.457 -7.314 -2.622
498 HG23 VAL 68 HG23 VAL 68 -1.423 -5.556 -2.486
499 H ASP 69 HN ASP 69 -0.111 -6.763 -7.535
500 HA ASP 69 HA ASP 69 2.541 -7.615 -6.622
501 HB2 ASP 69 HB2 ASP 69 1.556 -8.459 -8.784
502 HB3 ASP 69 HB1 ASP 69 1.710 -6.822 -9.414
503 H THR 70 HN THR 70 0.949 -4.816 -8.108
504 HA THR 70 HA THR 70 3.234 -3.179 -7.228
505 HB THR 70 HB THR 70 2.580 -1.564 -8.999
506 HG1 THR 70 HG1 THR 70 0.771 -3.660 -9.721
507 HG21 THR 70 HG21 THR 70 4.347 -3.204 -9.442
508 HG22 THR 70 HG22 THR 70 3.416 -2.870 -10.904
509 HG23 THR 70 HG23 THR 70 3.140 -4.360 -10.002
510 HA PRO 71 HA PRO 71 0.736 -0.629 -4.530
511 HB2 PRO 71 HB2 PRO 71 1.759 1.594 -6.254
512 HB3 PRO 71 HB1 PRO 71 1.691 1.485 -4.491
513 HG2 PRO 71 HG2 PRO 71 3.986 1.085 -5.749
514 HG3 PRO 71 HG1 PRO 71 3.526 0.047 -4.387
515 HD2 PRO 71 HD2 PRO 71 3.514 -0.546 -7.308
516 HD3 PRO 71 HD1 PRO 71 3.852 -1.618 -5.936
517 H ARG 72 HN ARG 72 0.647 0.109 -8.012
518 HA ARG 72 HA ARG 72 -1.675 1.599 -8.175
519 HB2 ARG 72 HB2 ARG 72 -0.269 1.212 -10.109
520 HB3 ARG 72 HB1 ARG 72 -0.640 -0.500 -10.080
521 HG2 ARG 72 HG2 ARG 72 -2.918 -0.094 -10.686
522 HG3 ARG 72 HG1 ARG 72 -2.703 1.650 -10.524
523 HD2 ARG 72 HD2 ARG 72 -1.193 -0.054 -12.488
524 HD3 ARG 72 HD1 ARG 72 -2.689 0.793 -12.873
525 HE ARG 72 HE ARG 72 -1.479 2.880 -12.269
526 HH11 ARG 72 HH11 ARG 72 0.330 0.068 -13.427
527 HH12 ARG 72 HH12 ARG 72 1.705 1.022 -13.893
528 HH21 ARG 72 HH21 ARG 72 0.314 4.082 -12.940
529 HH22 ARG 72 HH22 ARG 72 1.703 3.280 -13.608
530 H GLU 73 HN GLU 73 -1.330 -1.911 -8.330
531 HA GLU 73 HA GLU 73 -4.045 -2.556 -8.639
532 HB2 GLU 73 HB2 GLU 73 -1.840 -4.152 -7.330
533 HB3 GLU 73 HB1 GLU 73 -3.391 -4.799 -7.847
534 HG2 GLU 73 HG2 GLU 73 -2.870 -4.625 -10.084
535 HG3 GLU 73 HG1 GLU 73 -1.630 -3.398 -9.804
536 H LEU 74 HN LEU 74 -2.025 -2.422 -5.732
537 HA LEU 74 HA LEU 74 -3.931 -3.177 -3.846
538 HB2 LEU 74 HB2 LEU 74 -1.308 -2.532 -3.774
539 HB3 LEU 74 HB1 LEU 74 -1.989 -1.074 -3.081
540 HG LEU 74 HG LEU 74 -2.426 -3.867 -2.007
541 HD11 LEU 74 HD11 LEU 74 -0.653 -1.619 -1.070
542 HD12 LEU 74 HD12 LEU 74 -0.140 -3.193 -1.678
543 HD13 LEU 74 HD13 LEU 74 -1.002 -3.079 -0.143
544 HD21 LEU 74 HD21 LEU 74 -3.166 -1.180 -0.854
545 HD22 LEU 74 HD22 LEU 74 -3.418 -2.749 -0.089
546 HD23 LEU 74 HD23 LEU 74 -4.296 -2.333 -1.562
547 H LEU 75 HN LEU 75 -2.973 0.096 -4.873
548 HA LEU 75 HA LEU 75 -4.845 1.537 -3.381
549 HB2 LEU 75 HB2 LEU 75 -2.908 2.532 -4.494
550 HB3 LEU 75 HB1 LEU 75 -3.617 2.182 -6.057
551 HG LEU 75 HG LEU 75 -5.489 3.728 -5.509
552 HD11 LEU 75 HD11 LEU 75 -5.248 5.270 -3.651
553 HD12 LEU 75 HD12 LEU 75 -3.778 4.444 -3.136
554 HD13 LEU 75 HD13 LEU 75 -5.330 3.607 -3.068
555 HD21 LEU 75 HD21 LEU 75 -4.170 5.786 -5.799
556 HD22 LEU 75 HD22 LEU 75 -3.648 4.489 -6.874
557 HD23 LEU 75 HD23 LEU 75 -2.705 4.875 -5.434
558 H ASP 76 HN ASP 76 -5.005 0.451 -6.755
559 HA ASP 76 HA ASP 76 -7.435 1.617 -7.432
560 HB2 ASP 76 HB2 ASP 76 -5.755 0.658 -9.011
561 HB3 ASP 76 HB1 ASP 76 -6.296 -0.950 -8.542
562 H LEU 77 HN LEU 77 -6.785 -1.613 -6.125
563 HA LEU 77 HA LEU 77 -9.429 -2.566 -6.265
564 HB2 LEU 77 HB2 LEU 77 -7.170 -3.322 -4.417
565 HB3 LEU 77 HB1 LEU 77 -8.697 -4.183 -4.494
566 HG LEU 77 HG LEU 77 -6.732 -3.895 -6.767
567 HD11 LEU 77 HD11 LEU 77 -7.441 -6.280 -5.065
568 HD12 LEU 77 HD12 LEU 77 -5.930 -5.376 -4.996
569 HD13 LEU 77 HD13 LEU 77 -6.350 -6.284 -6.449
570 HD21 LEU 77 HD21 LEU 77 -9.290 -5.480 -6.592
571 HD22 LEU 77 HD22 LEU 77 -8.162 -5.463 -7.946
572 HD23 LEU 77 HD23 LEU 77 -9.058 -4.003 -7.529
573 H ILE 78 HN ILE 78 -7.697 -0.871 -3.665
574 HA ILE 78 HA ILE 78 -9.851 -0.968 -1.822
575 HB ILE 78 HB ILE 78 -7.588 1.037 -1.963
576 HG12 ILE 78 HG12 ILE 78 -7.872 -1.531 -0.377
577 HG13 ILE 78 HG11 ILE 78 -6.800 -1.282 -1.752
578 HG21 ILE 78 HG21 ILE 78 -8.077 1.444 0.409
579 HG22 ILE 78 HG22 ILE 78 -9.450 0.341 0.310
580 HG23 ILE 78 HG23 ILE 78 -9.459 1.843 -0.615
581 HD11 ILE 78 HD11 ILE 78 -5.594 -1.177 0.350
582 HD12 ILE 78 HD12 ILE 78 -6.632 0.142 0.892
583 HD13 ILE 78 HD13 ILE 78 -5.551 0.374 -0.482
584 H ASN 79 HN ASN 79 -8.820 1.429 -4.230
585 HA ASN 79 HA ASN 79 -10.781 3.380 -3.710
586 HB2 ASN 79 HB2 ASN 79 -9.418 2.653 -6.311
587 HB3 ASN 79 HB1 ASN 79 -10.455 4.058 -6.111
588 HD21 ASN 79 HD21 ASN 79 -9.456 4.518 -3.363
589 HD22 ASN 79 HD22 ASN 79 -7.889 5.215 -3.568
590 H GLY 80 HN GLY 80 -10.880 0.432 -5.628
591 HA2 GLY 80 HA2 GLY 80 -13.390 0.843 -6.846
592 HA3 GLY 80 HA1 GLY 80 -12.637 -0.718 -6.561
593 H ALA 81 HN ALA 81 -12.487 -0.546 -3.739
594 HA ALA 81 HA ALA 81 -15.121 -1.396 -3.056
595 HB1 ALA 81 HB1 ALA 81 -13.098 -2.385 -2.058
596 HB2 ALA 81 HB2 ALA 81 -14.216 -1.781 -0.836
597 HB3 ALA 81 HB3 ALA 81 -12.771 -0.857 -1.238
598 H LEU 82 HN LEU 82 -13.240 1.515 -2.579
599 HA LEU 82 HA LEU 82 -15.027 2.768 -0.766
600 HB2 LEU 82 HB2 LEU 82 -12.931 3.930 -2.599
601 HB3 LEU 82 HB1 LEU 82 -13.771 4.827 -1.345
602 HG LEU 82 HG LEU 82 -12.015 2.422 -0.839
603 HD11 LEU 82 HD11 LEU 82 -11.434 5.350 -0.432
604 HD12 LEU 82 HD12 LEU 82 -10.705 4.310 -1.657
605 HD13 LEU 82 HD13 LEU 82 -10.398 4.008 0.053
606 HD21 LEU 82 HD21 LEU 82 -13.783 2.740 0.821
607 HD22 LEU 82 HD22 LEU 82 -13.268 4.409 1.055
608 HD23 LEU 82 HD23 LEU 82 -12.194 3.083 1.503
609 H ALA 83 HN ALA 83 -14.671 2.808 -4.289
610 HA ALA 83 HA ALA 83 -16.710 4.726 -4.785
611 HB1 ALA 83 HB1 ALA 83 -15.740 2.509 -6.590
612 HB2 ALA 83 HB2 ALA 83 -15.006 4.107 -6.455
613 HB3 ALA 83 HB3 ALA 83 -16.646 3.939 -7.085
614 H GLU 84 HN GLU 84 -16.696 1.261 -4.290
615 HA GLU 84 HA GLU 84 -19.413 0.796 -5.008
616 HB2 GLU 84 HB2 GLU 84 -17.528 -0.916 -4.820
617 HB3 GLU 84 HB1 GLU 84 -17.749 -0.833 -3.078
618 HG2 GLU 84 HG2 GLU 84 -19.802 -1.878 -3.159
619 HG3 GLU 84 HG1 GLU 84 -20.070 -1.445 -4.850
620 H ALA 85 HN ALA 85 -17.762 1.085 -1.877
621 HA ALA 85 HA ALA 85 -18.291 2.210 0.007
622 HB1 ALA 85 HB1 ALA 85 -20.677 3.281 -1.480
623 HB2 ALA 85 HB2 ALA 85 -19.062 3.987 -1.505
624 HB3 ALA 85 HB3 ALA 85 -19.973 3.929 0.003
625 H ALA 86 HN ALA 86 -21.611 1.515 -1.125
626 HA ALA 86 HA ALA 86 -21.996 0.061 1.400
627 HB1 ALA 86 HB1 ALA 86 -22.870 2.338 1.630
628 HB2 ALA 86 HB2 ALA 86 -24.157 1.135 1.695
629 HB3 ALA 86 HB3 ALA 86 -23.907 2.076 0.226
630 H28 SXO 87 H28B SXO 87 6.406 -11.920 5.646
631 H28A SXO 87 H28A SXO 87 7.475 -13.078 6.438
632 H30 SXO 87 H30A SXO 87 4.627 -12.170 7.066
633 H30A SXO 87 H30C SXO 87 3.953 -13.741 7.509
634 H30B SXO 87 H30B SXO 87 5.547 -13.270 8.098
635 H31 SXO 87 H31A SXO 87 4.196 -12.830 4.655
636 H31A SXO 87 H31B SXO 87 3.625 -14.419 5.167
637 H31B SXO 87 H31C SXO 87 4.953 -14.288 4.011
638 H32 SXO 87 H32A SXO 87 6.491 -15.297 7.297
639 HO33 SXO 87 H33A SXO 87 6.467 -16.523 4.895
640 HN36 SXO 87 H36A SXO 87 4.060 -15.365 8.032
641 H37 SXO 87 H37A SXO 87 3.059 -17.994 7.393
642 H37A SXO 87 H37B SXO 87 2.466 -16.909 8.650
643 H38 SXO 87 H38B SXO 87 0.841 -17.383 6.816
644 H38A SXO 87 H38A SXO 87 1.930 -16.559 5.705
645 HN41 SXO 87 H41A SXO 87 -0.129 -15.392 5.422
646 H42 SXO 87 H42A SXO 87 -1.451 -13.730 7.111
647 H42A SXO 87 H42B SXO 87 -0.006 -12.815 6.675
648 H43 SXO 87 H43B SXO 87 -1.957 -13.999 4.703
649 H43A SXO 87 H43A SXO 87 -1.922 -12.304 5.208
650 H2 SXO 87 H2A SXO 87 1.772 -11.265 2.845
651 H2A SXO 87 H2B SXO 87 2.024 -10.020 4.073
652 H3 SXO 87 H3B SXO 87 -0.146 -10.070 1.980
653 H3A SXO 87 H3A SXO 87 0.018 -8.847 3.238
654 H4 SXO 87 H4A SXO 87 2.092 -9.453 1.137
655 H4A SXO 87 H4B SXO 87 2.167 -8.171 2.348
656 H5 SXO 87 H5B SXO 87 1.471 -7.268 0.201
657 H5A SXO 87 H5A SXO 87 0.141 -8.424 0.125
658 H6 SXO 87 H6A SXO 87 0.486 -6.253 2.198
659 H6A SXO 87 H6B SXO 87 -0.838 -7.417 2.136
660 H7 SXO 87 H7A SXO 87 -1.461 -6.541 -0.091
661 H7A SXO 87 H7B SXO 87 -0.196 -5.310 0.067
662 H8 SXO 87 H8C SXO 87 -2.544 -5.690 1.917
663 H8A SXO 87 H8A SXO 87 -2.384 -4.427 0.697
664 H8B SXO 87 H8B SXO 87 -1.290 -4.463 2.079
Start of MODEL 3
1 H1 MET 1 HT1 MET 1 -16.307 10.740 -2.284
2 H2 MET 1 HT2 MET 1 -17.908 10.808 -2.851
3 H3 MET 1 HT3 MET 1 -17.363 9.448 -2.014
4 HA MET 1 HA MET 1 -17.531 12.158 -0.848
5 HB2 MET 1 HB2 MET 1 -19.769 11.318 -1.351
6 HB3 MET 1 HB1 MET 1 -19.398 9.796 -0.555
7 HG2 MET 1 HG2 MET 1 -19.134 10.993 1.573
8 HG3 MET 1 HG1 MET 1 -19.573 12.498 0.763
9 HE1 MET 1 HE1 MET 1 -22.692 11.590 3.025
10 HE2 MET 1 HE2 MET 1 -21.467 12.811 2.677
11 HE3 MET 1 HE3 MET 1 -20.995 11.267 3.383
12 H ALA 2 HN ALA 2 -17.069 8.665 -0.375
13 HA ALA 2 HA ALA 2 -16.320 8.858 2.357
14 HB1 ALA 2 HB1 ALA 2 -17.149 6.778 1.372
15 HB2 ALA 2 HB2 ALA 2 -15.566 6.552 2.115
16 HB3 ALA 2 HB3 ALA 2 -15.708 6.682 0.362
17 H THR 3 HN THR 3 -14.190 8.396 3.234
18 HA THR 3 HA THR 3 -12.157 9.961 1.990
19 HB THR 3 HB THR 3 -12.329 9.996 4.388
20 HG1 THR 3 HG1 THR 3 -10.089 9.538 3.114
21 HG21 THR 3 HG21 THR 3 -11.758 7.034 4.316
22 HG22 THR 3 HG22 THR 3 -13.271 7.799 4.800
23 HG23 THR 3 HG23 THR 3 -11.821 8.026 5.776
24 H LEU 4 HN LEU 4 -11.163 9.224 0.252
25 HA LEU 4 HA LEU 4 -10.723 6.393 -0.160
26 HB2 LEU 4 HB2 LEU 4 -9.961 8.757 -1.879
27 HB3 LEU 4 HB1 LEU 4 -9.830 7.074 -2.348
28 HG LEU 4 HG LEU 4 -12.391 8.572 -1.799
29 HD11 LEU 4 HD11 LEU 4 -11.234 7.447 -4.342
30 HD12 LEU 4 HD12 LEU 4 -11.320 9.156 -3.913
31 HD13 LEU 4 HD13 LEU 4 -12.803 8.235 -4.176
32 HD21 LEU 4 HD21 LEU 4 -13.512 6.528 -2.551
33 HD22 LEU 4 HD22 LEU 4 -12.579 6.252 -1.079
34 HD23 LEU 4 HD23 LEU 4 -11.953 5.708 -2.635
35 H LEU 5 HN LEU 5 -8.597 5.611 -0.909
36 HA LEU 5 HA LEU 5 -6.428 6.644 0.737
37 HB2 LEU 5 HB2 LEU 5 -7.064 4.141 0.159
38 HB3 LEU 5 HB1 LEU 5 -6.144 4.451 -1.298
39 HG LEU 5 HG LEU 5 -5.070 4.675 1.517
40 HD11 LEU 5 HD11 LEU 5 -5.556 2.381 0.961
41 HD12 LEU 5 HD12 LEU 5 -3.814 2.645 0.934
42 HD13 LEU 5 HD13 LEU 5 -4.711 2.543 -0.580
43 HD21 LEU 5 HD21 LEU 5 -3.607 4.781 -1.120
44 HD22 LEU 5 HD22 LEU 5 -2.893 4.895 0.489
45 HD23 LEU 5 HD23 LEU 5 -3.957 6.173 -0.097
46 H THR 6 HN THR 6 -5.073 8.171 -0.060
47 HA THR 6 HA THR 6 -5.082 8.603 -2.954
48 HB THR 6 HB THR 6 -3.915 10.843 -1.921
49 HG1 THR 6 HG1 THR 6 -4.331 10.691 0.188
50 HG21 THR 6 HG21 THR 6 -6.856 10.301 -2.334
51 HG22 THR 6 HG22 THR 6 -5.701 10.777 -3.579
52 HG23 THR 6 HG23 THR 6 -6.107 11.898 -2.279
53 H THR 7 HN THR 7 -3.088 9.458 -3.927
54 HA THR 7 HA THR 7 -1.070 7.562 -3.753
55 HB THR 7 HB THR 7 0.215 9.489 -5.076
56 HG1 THR 7 HG1 THR 7 -1.048 11.217 -5.063
57 HG21 THR 7 HG21 THR 7 -2.193 8.003 -6.131
58 HG22 THR 7 HG22 THR 7 -0.553 7.360 -6.022
59 HG23 THR 7 HG23 THR 7 -0.909 8.703 -7.112
60 H ASP 8 HN ASP 8 -0.975 10.962 -2.617
61 HA ASP 8 HA ASP 8 1.664 10.891 -1.664
62 HB2 ASP 8 HB2 ASP 8 0.579 13.011 -1.883
63 HB3 ASP 8 HB1 ASP 8 -0.706 12.536 -0.776
64 H ASP 9 HN ASP 9 -1.368 10.165 -0.020
65 HA ASP 9 HA ASP 9 -0.255 9.718 2.533
66 HB2 ASP 9 HB2 ASP 9 -2.806 8.605 1.350
67 HB3 ASP 9 HB1 ASP 9 -2.391 8.630 3.064
68 H LEU 10 HN LEU 10 -0.776 7.629 -0.239
69 HA LEU 10 HA LEU 10 0.000 5.207 1.025
70 HB2 LEU 10 HB2 LEU 10 -1.227 5.298 -1.118
71 HB3 LEU 10 HB1 LEU 10 0.186 5.996 -1.885
72 HG LEU 10 HG LEU 10 1.447 3.927 -1.444
73 HD11 LEU 10 HD11 LEU 10 0.250 1.926 -0.675
74 HD12 LEU 10 HD12 LEU 10 -1.182 2.910 -0.371
75 HD13 LEU 10 HD13 LEU 10 0.292 3.185 0.560
76 HD21 LEU 10 HD21 LEU 10 0.305 2.526 -3.078
77 HD22 LEU 10 HD22 LEU 10 0.262 4.221 -3.568
78 HD23 LEU 10 HD23 LEU 10 -1.171 3.467 -2.869
79 H ARG 11 HN ARG 11 1.744 7.643 -0.862
80 HA ARG 11 HA ARG 11 4.293 6.540 -0.850
81 HB2 ARG 11 HB2 ARG 11 3.827 8.489 -2.161
82 HB3 ARG 11 HB1 ARG 11 3.360 9.407 -0.737
83 HG2 ARG 11 HG2 ARG 11 5.625 9.485 0.035
84 HG3 ARG 11 HG1 ARG 11 6.146 8.388 -1.246
85 HD2 ARG 11 HD2 ARG 11 6.719 10.706 -1.771
86 HD3 ARG 11 HD1 ARG 11 5.563 10.051 -2.929
87 HE ARG 11 HE ARG 11 4.217 11.424 -0.841
88 HH11 ARG 11 HH11 ARG 11 6.148 11.997 -3.720
89 HH12 ARG 11 HH12 ARG 11 5.433 13.557 -4.032
90 HH21 ARG 11 HH21 ARG 11 3.290 13.485 -1.260
91 HH22 ARG 11 HH22 ARG 11 3.826 14.388 -2.655
92 H ARG 12 HN ARG 12 2.685 8.523 1.603
93 HA ARG 12 HA ARG 12 4.912 8.674 3.363
94 HB2 ARG 12 HB2 ARG 12 1.957 9.030 3.867
95 HB3 ARG 12 HB1 ARG 12 3.207 9.381 5.051
96 HG2 ARG 12 HG2 ARG 12 4.126 11.096 3.585
97 HG3 ARG 12 HG1 ARG 12 2.890 10.729 2.377
98 HD2 ARG 12 HD2 ARG 12 2.339 12.703 3.774
99 HD3 ARG 12 HD1 ARG 12 1.141 11.415 3.882
100 HE ARG 12 HE ARG 12 3.201 11.395 5.932
101 HH11 ARG 12 HH11 ARG 12 -0.035 12.431 5.035
102 HH12 ARG 12 HH12 ARG 12 -0.567 12.577 6.686
103 HH21 ARG 12 HH21 ARG 12 2.506 11.616 8.078
104 HH22 ARG 12 HH22 ARG 12 0.891 12.149 8.417
105 H ALA 13 HN ALA 13 2.360 6.338 2.917
106 HA ALA 13 HA ALA 13 2.246 5.260 5.492
107 HB1 ALA 13 HB1 ALA 13 1.099 3.372 4.483
108 HB2 ALA 13 HB2 ALA 13 1.650 3.877 2.886
109 HB3 ALA 13 HB3 ALA 13 0.528 4.892 3.793
110 H LEU 14 HN LEU 14 4.163 4.213 2.683
111 HA LEU 14 HA LEU 14 5.277 1.937 3.913
112 HB2 LEU 14 HB2 LEU 14 6.168 3.648 1.609
113 HB3 LEU 14 HB1 LEU 14 7.134 2.298 2.162
114 HG LEU 14 HG LEU 14 5.877 1.583 0.270
115 HD11 LEU 14 HD11 LEU 14 4.615 0.507 2.781
116 HD12 LEU 14 HD12 LEU 14 6.109 -0.059 2.033
117 HD13 LEU 14 HD13 LEU 14 4.571 -0.262 1.193
118 HD21 LEU 14 HD21 LEU 14 4.139 3.267 0.276
119 HD22 LEU 14 HD22 LEU 14 3.414 2.541 1.709
120 HD23 LEU 14 HD23 LEU 14 3.434 1.653 0.186
121 H VAL 15 HN VAL 15 6.288 5.310 3.819
122 HA VAL 15 HA VAL 15 8.849 4.908 5.000
123 HB VAL 15 HB VAL 15 7.165 7.420 4.937
124 HG11 VAL 15 HG11 VAL 15 9.300 8.599 5.204
125 HG12 VAL 15 HG12 VAL 15 10.134 7.052 5.352
126 HG13 VAL 15 HG13 VAL 15 8.963 7.546 6.576
127 HG21 VAL 15 HG21 VAL 15 9.256 6.427 3.001
128 HG22 VAL 15 HG22 VAL 15 8.497 8.019 2.953
129 HG23 VAL 15 HG23 VAL 15 7.526 6.569 2.693
130 H GLU 16 HN GLU 16 5.696 5.944 6.277
131 HA GLU 16 HA GLU 16 6.558 6.351 8.933
132 HB2 GLU 16 HB2 GLU 16 3.801 5.711 7.873
133 HB3 GLU 16 HB1 GLU 16 4.146 6.253 9.510
134 HG2 GLU 16 HG2 GLU 16 5.038 8.348 8.633
135 HG3 GLU 16 HG1 GLU 16 4.698 7.804 6.992
136 H SER 17 HN SER 17 5.503 3.481 7.224
137 HA SER 17 HA SER 17 5.177 1.928 9.620
138 HB2 SER 17 HB2 SER 17 5.369 1.009 6.744
139 HB3 SER 17 HB1 SER 17 4.791 0.050 8.109
140 HG SER 17 HG SER 17 3.595 2.281 6.862
141 H ALA 18 HN ALA 18 7.673 2.289 7.144
142 HA ALA 18 HA ALA 18 9.354 0.228 8.156
143 HB1 ALA 18 HB1 ALA 18 11.057 1.145 6.696
144 HB2 ALA 18 HB2 ALA 18 10.112 2.618 6.482
145 HB3 ALA 18 HB3 ALA 18 9.509 1.087 5.849
146 H GLY 19 HN GLY 19 8.928 3.617 8.855
147 HA2 GLY 19 HA2 GLY 19 9.438 4.550 10.963
148 HA3 GLY 19 HA1 GLY 19 10.612 3.267 11.224
149 H GLU 20 HN GLU 20 9.995 6.012 9.075
150 HA GLU 20 HA GLU 20 11.308 7.679 8.280
151 HB2 GLU 20 HB2 GLU 20 11.750 8.015 10.722
152 HB3 GLU 20 HB1 GLU 20 13.162 6.980 10.573
153 HG2 GLU 20 HG2 GLU 20 13.827 9.288 10.560
154 HG3 GLU 20 HG1 GLU 20 14.138 8.567 8.981
155 H THR 21 HN THR 21 11.743 6.494 6.357
156 HA THR 21 HA THR 21 14.528 5.628 6.106
157 HB THR 21 HB THR 21 13.718 3.719 4.640
158 HG1 THR 21 HG1 THR 21 11.561 4.351 4.425
159 HG21 THR 21 HG21 THR 21 14.658 3.309 6.856
160 HG22 THR 21 HG22 THR 21 13.323 2.199 6.542
161 HG23 THR 21 HG23 THR 21 13.084 3.596 7.593
162 H ASP 22 HN ASP 22 14.640 7.736 5.028
163 HA ASP 22 HA ASP 22 13.359 7.900 2.421
164 HB2 ASP 22 HB2 ASP 22 14.304 10.075 2.229
165 HB3 ASP 22 HB1 ASP 22 13.807 9.928 3.912
166 H GLY 23 HN GLY 23 14.729 8.244 0.467
167 HA2 GLY 23 HA2 GLY 23 17.091 8.068 -0.358
168 HA3 GLY 23 HA1 GLY 23 17.190 6.619 0.633
169 H THR 24 HN THR 24 15.052 5.193 0.122
170 HA THR 24 HA THR 24 15.418 4.117 -2.441
171 HB THR 24 HB THR 24 12.927 3.801 -0.751
172 HG1 THR 24 HG1 THR 24 14.631 1.814 -0.311
173 HG21 THR 24 HG21 THR 24 12.863 2.824 -3.020
174 HG22 THR 24 HG22 THR 24 12.825 1.585 -1.766
175 HG23 THR 24 HG23 THR 24 14.319 1.900 -2.648
176 H ASP 25 HN ASP 25 14.133 4.232 -4.312
177 HA ASP 25 HA ASP 25 12.930 6.752 -4.827
178 HB2 ASP 25 HB2 ASP 25 13.014 4.211 -6.456
179 HB3 ASP 25 HB1 ASP 25 12.295 5.711 -7.031
180 H LEU 26 HN LEU 26 11.363 6.850 -3.221
181 HA LEU 26 HA LEU 26 8.825 5.580 -4.003
182 HB2 LEU 26 HB2 LEU 26 9.764 4.521 -1.963
183 HB3 LEU 26 HB1 LEU 26 9.800 6.090 -1.184
184 HG LEU 26 HG LEU 26 7.282 6.160 -1.474
185 HD11 LEU 26 HD11 LEU 26 6.182 3.965 -1.712
186 HD12 LEU 26 HD12 LEU 26 7.740 3.261 -2.147
187 HD13 LEU 26 HD13 LEU 26 7.007 4.490 -3.179
188 HD21 LEU 26 HD21 LEU 26 8.376 5.688 0.655
189 HD22 LEU 26 HD22 LEU 26 8.464 3.977 0.236
190 HD23 LEU 26 HD23 LEU 26 6.895 4.749 0.474
191 H SER 27 HN SER 27 10.541 8.326 -3.797
192 HA SER 27 HA SER 27 8.647 10.027 -2.434
193 HB2 SER 27 HB2 SER 27 11.143 10.813 -3.956
194 HB3 SER 27 HB1 SER 27 10.277 11.781 -2.761
195 HG SER 27 HG SER 27 11.628 10.895 -1.410
196 H GLY 28 HN GLY 28 9.878 9.643 -5.753
197 HA2 GLY 28 HA2 GLY 28 7.831 11.559 -6.644
198 HA3 GLY 28 HA1 GLY 28 9.268 11.111 -7.546
199 H ASP 29 HN ASP 29 8.803 8.214 -6.977
200 HA ASP 29 HA ASP 29 6.431 7.707 -8.604
201 HB2 ASP 29 HB2 ASP 29 8.776 8.118 -9.906
202 HB3 ASP 29 HB1 ASP 29 8.887 6.387 -9.597
203 H PHE 30 HN PHE 30 5.679 5.554 -8.425
204 HA PHE 30 HA PHE 30 7.206 3.508 -7.185
205 HB2 PHE 30 HB2 PHE 30 5.874 3.370 -5.054
206 HB3 PHE 30 HB1 PHE 30 6.994 4.723 -5.154
207 HD1 PHE 30 HD2 PHE 30 6.173 7.012 -5.331
208 HD2 PHE 30 HD1 PHE 30 3.487 3.724 -5.056
209 HE1 PHE 30 HE2 PHE 30 4.330 8.557 -4.802
210 HE2 PHE 30 HE1 PHE 30 1.642 5.265 -4.542
211 HZ PHE 30 HZ PHE 30 2.084 7.707 -4.388
212 H LEU 31 HN LEU 31 4.116 4.694 -8.294
213 HA LEU 31 HA LEU 31 2.441 2.646 -7.460
214 HB2 LEU 31 HB2 LEU 31 2.262 4.493 -9.808
215 HB3 LEU 31 HB1 LEU 31 1.022 3.302 -9.472
216 HG LEU 31 HG LEU 31 1.862 5.538 -7.624
217 HD11 LEU 31 HD11 LEU 31 -0.645 5.125 -9.238
218 HD12 LEU 31 HD12 LEU 31 0.609 6.328 -9.546
219 HD13 LEU 31 HD13 LEU 31 -0.367 6.426 -8.079
220 HD21 LEU 31 HD21 LEU 31 -0.234 3.392 -7.329
221 HD22 LEU 31 HD22 LEU 31 -0.138 4.833 -6.319
222 HD23 LEU 31 HD23 LEU 31 1.177 3.660 -6.306
223 H ASP 32 HN ASP 32 4.584 2.632 -10.262
224 HA ASP 32 HA ASP 32 3.366 0.090 -11.107
225 HB2 ASP 32 HB2 ASP 32 4.406 0.387 -13.245
226 HB3 ASP 32 HB1 ASP 32 3.614 1.898 -12.813
227 H LEU 33 HN LEU 33 5.710 0.986 -9.071
228 HA LEU 33 HA LEU 33 7.663 -1.015 -9.884
229 HB2 LEU 33 HB2 LEU 33 7.590 0.855 -7.515
230 HB3 LEU 33 HB1 LEU 33 8.888 -0.275 -7.843
231 HG LEU 33 HG LEU 33 8.088 2.000 -9.661
232 HD11 LEU 33 HD11 LEU 33 9.041 2.843 -7.605
233 HD12 LEU 33 HD12 LEU 33 10.194 3.027 -8.926
234 HD13 LEU 33 HD13 LEU 33 10.402 1.729 -7.749
235 HD21 LEU 33 HD21 LEU 33 9.059 0.137 -10.880
236 HD22 LEU 33 HD22 LEU 33 10.416 0.081 -9.757
237 HD23 LEU 33 HD23 LEU 33 10.203 1.479 -10.810
238 H ARG 34 HN ARG 34 7.780 -3.018 -9.073
239 HA ARG 34 HA ARG 34 5.640 -4.034 -7.492
240 HB2 ARG 34 HB2 ARG 34 8.254 -5.310 -8.321
241 HB3 ARG 34 HB1 ARG 34 6.908 -6.167 -7.585
242 HG2 ARG 34 HG2 ARG 34 5.512 -5.715 -9.487
243 HG3 ARG 34 HG1 ARG 34 6.760 -4.695 -10.204
244 HD2 ARG 34 HD2 ARG 34 6.775 -6.859 -11.267
245 HD3 ARG 34 HD1 ARG 34 8.250 -6.644 -10.329
246 HE ARG 34 HE ARG 34 6.264 -7.978 -8.791
247 HH11 ARG 34 HH11 ARG 34 8.617 -8.457 -11.337
248 HH12 ARG 34 HH12 ARG 34 8.702 -10.176 -11.124
249 HH21 ARG 34 HH21 ARG 34 6.438 -10.226 -8.431
250 HH22 ARG 34 HH22 ARG 34 7.496 -11.186 -9.416
251 H PHE 35 HN PHE 35 5.587 -4.621 -5.362
252 HA PHE 35 HA PHE 35 7.151 -3.313 -3.471
253 HB2 PHE 35 HB2 PHE 35 5.609 -5.897 -3.154
254 HB3 PHE 35 HB1 PHE 35 6.234 -4.927 -1.823
255 HD1 PHE 35 HD2 PHE 35 5.549 -2.288 -2.175
256 HD2 PHE 35 HD1 PHE 35 3.354 -5.693 -3.497
257 HE1 PHE 35 HE2 PHE 35 3.482 -0.950 -2.186
258 HE2 PHE 35 HE1 PHE 35 1.290 -4.355 -3.511
259 HZ PHE 35 HZ PHE 35 1.338 -2.000 -2.812
260 H GLU 36 HN GLU 36 7.517 -6.546 -4.827
261 HA GLU 36 HA GLU 36 9.681 -7.440 -3.301
262 HB2 GLU 36 HB2 GLU 36 8.924 -7.993 -6.173
263 HB3 GLU 36 HB1 GLU 36 10.236 -8.824 -5.354
264 HG2 GLU 36 HG2 GLU 36 7.385 -8.827 -4.407
265 HG3 GLU 36 HG1 GLU 36 8.096 -10.077 -5.429
266 H ASP 37 HN ASP 37 9.580 -5.256 -6.048
267 HA ASP 37 HA ASP 37 12.444 -5.418 -6.448
268 HB2 ASP 37 HB2 ASP 37 10.213 -4.017 -7.885
269 HB3 ASP 37 HB1 ASP 37 11.887 -3.566 -8.190
270 H ILE 38 HN ILE 38 10.269 -3.419 -4.691
271 HA ILE 38 HA ILE 38 12.290 -1.321 -4.475
272 HB ILE 38 HB ILE 38 10.588 -0.112 -3.096
273 HG12 ILE 38 HG12 ILE 38 8.765 -2.335 -4.056
274 HG13 ILE 38 HG11 ILE 38 9.272 -2.080 -2.390
275 HG21 ILE 38 HG21 ILE 38 10.921 0.394 -5.434
276 HG22 ILE 38 HG22 ILE 38 9.206 0.506 -5.035
277 HG23 ILE 38 HG23 ILE 38 9.821 -0.903 -5.901
278 HD11 ILE 38 HD11 ILE 38 8.122 0.072 -2.371
279 HD12 ILE 38 HD12 ILE 38 7.023 -1.252 -2.762
280 HD13 ILE 38 HD13 ILE 38 7.616 -0.189 -4.038
281 H GLY 39 HN GLY 39 12.086 -4.180 -3.181
282 HA2 GLY 39 HA2 GLY 39 13.155 -5.115 -1.380
283 HA3 GLY 39 HA1 GLY 39 13.793 -3.522 -1.025
284 H TYR 40 HN TYR 40 10.453 -4.797 -1.014
285 HA TYR 40 HA TYR 40 10.342 -4.065 1.837
286 HB2 TYR 40 HB2 TYR 40 8.364 -3.660 -0.354
287 HB3 TYR 40 HB1 TYR 40 7.758 -3.984 1.268
288 HD1 TYR 40 HD1 TYR 40 9.634 -1.608 -0.818
289 HD2 TYR 40 HD2 TYR 40 8.003 -2.371 3.029
290 HE1 TYR 40 HE1 TYR 40 9.962 0.753 -0.220
291 HE2 TYR 40 HE2 TYR 40 8.324 -0.011 3.642
292 HH TYR 40 HH TYR 40 9.706 1.891 2.977
293 H ASP 41 HN ASP 41 10.326 -5.742 3.081
294 HA ASP 41 HA ASP 41 9.846 -8.390 2.259
295 HB2 ASP 41 HB2 ASP 41 9.750 -7.316 5.089
296 HB3 ASP 41 HB1 ASP 41 10.032 -8.983 4.604
297 H SER 42 HN SER 42 8.175 -9.814 2.843
298 HA SER 42 HA SER 42 5.571 -8.977 2.469
299 HB2 SER 42 HB2 SER 42 4.964 -11.225 3.479
300 HB3 SER 42 HB1 SER 42 6.126 -11.277 2.147
301 H LEU 43 HN LEU 43 7.267 -9.566 5.530
302 HA LEU 43 HA LEU 43 5.051 -9.108 7.209
303 HB2 LEU 43 HB2 LEU 43 7.115 -10.222 7.957
304 HB3 LEU 43 HB1 LEU 43 7.983 -8.706 7.807
305 HG LEU 43 HG LEU 43 6.509 -7.733 9.560
306 HD11 LEU 43 HD11 LEU 43 4.578 -9.179 9.268
307 HD12 LEU 43 HD12 LEU 43 5.161 -9.252 10.932
308 HD13 LEU 43 HD13 LEU 43 5.518 -10.568 9.814
309 HD21 LEU 43 HD21 LEU 43 8.696 -8.612 10.145
310 HD22 LEU 43 HD22 LEU 43 8.011 -10.226 10.340
311 HD23 LEU 43 HD23 LEU 43 7.534 -8.929 11.434
312 H ALA 44 HN ALA 44 7.635 -6.936 6.088
313 HA ALA 44 HA ALA 44 6.711 -4.640 7.437
314 HB1 ALA 44 HB1 ALA 44 8.116 -3.386 5.877
315 HB2 ALA 44 HB2 ALA 44 8.297 -4.832 4.884
316 HB3 ALA 44 HB3 ALA 44 8.958 -4.798 6.517
317 H LEU 45 HN LEU 45 5.768 -6.178 4.477
318 HA LEU 45 HA LEU 45 4.302 -4.009 3.382
319 HB2 LEU 45 HB2 LEU 45 5.140 -5.993 2.114
320 HB3 LEU 45 HB1 LEU 45 3.911 -6.962 2.898
321 HG LEU 45 HG LEU 45 2.158 -5.582 1.838
322 HD11 LEU 45 HD11 LEU 45 4.491 -4.241 0.474
323 HD12 LEU 45 HD12 LEU 45 3.354 -3.493 1.596
324 HD13 LEU 45 HD13 LEU 45 2.799 -4.049 0.016
325 HD21 LEU 45 HD21 LEU 45 2.872 -7.627 0.736
326 HD22 LEU 45 HD22 LEU 45 4.167 -6.755 -0.084
327 HD23 LEU 45 HD23 LEU 45 2.482 -6.387 -0.455
328 H MET 46 HN MET 46 3.368 -6.816 5.376
329 HA MET 46 HA MET 46 0.617 -6.049 5.471
330 HB2 MET 46 HB2 MET 46 0.315 -7.779 7.128
331 HB3 MET 46 HB1 MET 46 1.348 -8.390 5.847
332 HG2 MET 46 HG2 MET 46 3.305 -8.075 7.245
333 HG3 MET 46 HG1 MET 46 2.298 -7.390 8.521
334 HE1 MET 46 HE1 MET 46 0.136 -10.471 9.602
335 HE2 MET 46 HE2 MET 46 -0.267 -9.185 8.464
336 HE3 MET 46 HE3 MET 46 0.565 -8.802 9.969
337 H GLU 47 HN GLU 47 3.442 -5.279 7.360
338 HA GLU 47 HA GLU 47 2.224 -4.030 9.553
339 HB2 GLU 47 HB2 GLU 47 4.807 -3.519 8.089
340 HB3 GLU 47 HB1 GLU 47 4.323 -2.519 9.450
341 HG2 GLU 47 HG2 GLU 47 4.614 -5.511 9.589
342 HG3 GLU 47 HG1 GLU 47 5.897 -4.374 10.001
343 H THR 48 HN THR 48 3.213 -2.709 6.422
344 HA THR 48 HA THR 48 2.233 -0.112 6.780
345 HB THR 48 HB THR 48 2.418 -1.613 4.156
346 HG1 THR 48 HG1 THR 48 4.418 -1.776 5.165
347 HG21 THR 48 HG21 THR 48 1.274 0.566 4.039
348 HG22 THR 48 HG22 THR 48 2.826 0.601 3.203
349 HG23 THR 48 HG23 THR 48 2.671 1.333 4.799
350 H ALA 49 HN ALA 49 0.717 -3.031 5.483
351 HA ALA 49 HA ALA 49 -1.647 -1.975 4.486
352 HB1 ALA 49 HB1 ALA 49 -0.885 -4.295 4.162
353 HB2 ALA 49 HB2 ALA 49 -2.563 -4.199 4.696
354 HB3 ALA 49 HB3 ALA 49 -1.300 -4.645 5.843
355 H ALA 50 HN ALA 50 -0.966 -3.155 7.769
356 HA ALA 50 HA ALA 50 -3.583 -2.932 8.770
357 HB1 ALA 50 HB1 ALA 50 -0.995 -2.751 10.305
358 HB2 ALA 50 HB2 ALA 50 -1.803 -4.251 9.847
359 HB3 ALA 50 HB3 ALA 50 -2.584 -3.133 10.967
360 H ARG 51 HN ARG 51 -0.986 -0.659 8.420
361 HA ARG 51 HA ARG 51 -1.929 1.362 10.154
362 HB2 ARG 51 HB2 ARG 51 -0.296 1.755 7.642
363 HB3 ARG 51 HB1 ARG 51 -0.370 2.817 9.030
364 HG2 ARG 51 HG2 ARG 51 0.853 0.084 8.897
365 HG3 ARG 51 HG1 ARG 51 1.693 1.621 9.086
366 HD2 ARG 51 HD2 ARG 51 0.783 1.922 11.280
367 HD3 ARG 51 HD1 ARG 51 -0.283 0.531 11.080
368 HE ARG 51 HE ARG 51 2.648 0.272 11.114
369 HH11 ARG 51 HH11 ARG 51 -0.525 -0.683 12.267
370 HH12 ARG 51 HH12 ARG 51 0.070 -2.098 13.084
371 HH21 ARG 51 HH21 ARG 51 3.420 -1.581 12.233
372 HH22 ARG 51 HH22 ARG 51 2.298 -2.590 13.087
373 H LEU 52 HN LEU 52 -2.515 0.610 6.774
374 HA LEU 52 HA LEU 52 -3.999 3.038 6.319
375 HB2 LEU 52 HB2 LEU 52 -3.703 0.601 4.571
376 HB3 LEU 52 HB1 LEU 52 -4.365 2.149 4.078
377 HG LEU 52 HG LEU 52 -1.509 1.588 4.886
378 HD11 LEU 52 HD11 LEU 52 -2.017 0.825 2.664
379 HD12 LEU 52 HD12 LEU 52 -1.034 2.290 2.577
380 HD13 LEU 52 HD13 LEU 52 -2.772 2.370 2.274
381 HD21 LEU 52 HD21 LEU 52 -1.082 3.941 4.332
382 HD22 LEU 52 HD22 LEU 52 -2.178 3.779 5.705
383 HD23 LEU 52 HD23 LEU 52 -2.813 4.198 4.113
384 H GLU 53 HN GLU 53 -4.734 -0.364 6.888
385 HA GLU 53 HA GLU 53 -7.498 -0.258 6.447
386 HB2 GLU 53 HB2 GLU 53 -5.950 -1.902 8.465
387 HB3 GLU 53 HB1 GLU 53 -7.640 -2.161 8.049
388 HG2 GLU 53 HG2 GLU 53 -7.001 -2.645 5.743
389 HG3 GLU 53 HG1 GLU 53 -5.306 -2.388 6.156
390 H SER 54 HN SER 54 -5.570 0.454 9.323
391 HA SER 54 HA SER 54 -7.713 1.171 11.011
392 HB2 SER 54 HB2 SER 54 -4.854 2.159 11.083
393 HB3 SER 54 HB1 SER 54 -6.011 2.217 12.412
394 HG SER 54 HG SER 54 -4.795 -0.050 11.225
395 H ARG 55 HN ARG 55 -5.762 3.035 8.722
396 HA ARG 55 HA ARG 55 -6.638 5.582 9.565
397 HB2 ARG 55 HB2 ARG 55 -5.150 4.485 7.249
398 HB3 ARG 55 HB1 ARG 55 -5.853 6.078 7.073
399 HG2 ARG 55 HG2 ARG 55 -4.659 6.778 9.139
400 HG3 ARG 55 HG1 ARG 55 -3.868 5.200 9.149
401 HD2 ARG 55 HD2 ARG 55 -2.871 5.645 6.991
402 HD3 ARG 55 HD1 ARG 55 -3.730 7.181 6.884
403 HE ARG 55 HE ARG 55 -2.280 7.323 9.216
404 HH11 ARG 55 HH11 ARG 55 -1.507 6.879 5.809
405 HH12 ARG 55 HH12 ARG 55 0.066 7.595 5.960
406 HH21 ARG 55 HH21 ARG 55 -0.228 8.263 9.380
407 HH22 ARG 55 HH22 ARG 55 0.808 8.359 7.977
408 H TYR 56 HN TYR 56 -7.581 3.586 6.765
409 HA TYR 56 HA TYR 56 -9.597 5.606 6.108
410 HB2 TYR 56 HB2 TYR 56 -8.749 3.235 4.439
411 HB3 TYR 56 HB1 TYR 56 -9.614 4.675 3.903
412 HD1 TYR 56 HD2 TYR 56 -8.318 6.959 4.343
413 HD2 TYR 56 HD1 TYR 56 -6.463 3.130 4.062
414 HE1 TYR 56 HE2 TYR 56 -6.199 8.036 3.753
415 HE2 TYR 56 HE1 TYR 56 -4.334 4.209 3.466
416 HH TYR 56 HH TYR 56 -3.754 7.499 3.861
417 H GLY 57 HN GLY 57 -9.458 2.854 7.889
418 HA2 GLY 57 HA2 GLY 57 -11.150 1.642 8.884
419 HA3 GLY 57 HA1 GLY 57 -12.299 2.666 8.035
420 H VAL 58 HN VAL 58 -9.805 0.741 6.491
421 HA VAL 58 HA VAL 58 -11.955 -0.706 5.117
422 HB VAL 58 HB VAL 58 -10.382 -1.111 3.288
423 HG11 VAL 58 HG11 VAL 58 -11.769 0.896 3.226
424 HG12 VAL 58 HG12 VAL 58 -10.207 1.176 2.456
425 HG13 VAL 58 HG13 VAL 58 -10.516 1.796 4.078
426 HG21 VAL 58 HG21 VAL 58 -8.297 -1.166 4.558
427 HG22 VAL 58 HG22 VAL 58 -8.441 0.559 4.895
428 HG23 VAL 58 HG23 VAL 58 -8.194 0.001 3.240
429 H SER 59 HN SER 59 -10.757 -2.821 4.075
430 HA SER 59 HA SER 59 -9.097 -4.180 5.992
431 HB2 SER 59 HB2 SER 59 -11.856 -5.213 5.279
432 HB3 SER 59 HB1 SER 59 -10.642 -6.098 6.197
433 HG SER 59 HG SER 59 -10.924 -3.732 7.345
434 H ILE 60 HN ILE 60 -7.624 -5.258 4.862
435 HA ILE 60 HA ILE 60 -8.106 -5.688 2.009
436 HB ILE 60 HB ILE 60 -5.542 -5.971 3.592
437 HG12 ILE 60 HG12 ILE 60 -6.484 -3.743 1.758
438 HG13 ILE 60 HG11 ILE 60 -6.392 -3.651 3.515
439 HG21 ILE 60 HG21 ILE 60 -5.567 -7.357 1.591
440 HG22 ILE 60 HG22 ILE 60 -4.449 -6.007 1.401
441 HG23 ILE 60 HG23 ILE 60 -6.026 -5.963 0.613
442 HD11 ILE 60 HD11 ILE 60 -4.054 -4.056 1.666
443 HD12 ILE 60 HD12 ILE 60 -3.982 -3.895 3.421
444 HD13 ILE 60 HD13 ILE 60 -4.513 -2.535 2.431
445 HA PRO 61 HA PRO 61 -9.212 -9.931 2.924
446 HB2 PRO 61 HB2 PRO 61 -8.827 -10.157 -0.012
447 HB3 PRO 61 HB1 PRO 61 -10.216 -10.610 0.979
448 HG2 PRO 61 HG2 PRO 61 -10.302 -8.439 -0.556
449 HG3 PRO 61 HG1 PRO 61 -11.035 -8.439 1.061
450 HD2 PRO 61 HD2 PRO 61 -8.437 -7.258 0.156
451 HD3 PRO 61 HD1 PRO 61 -9.636 -6.605 1.291
452 H ASP 62 HN ASP 62 -8.039 -11.692 3.346
453 HA ASP 62 HA ASP 62 -5.242 -11.592 3.269
454 HB2 ASP 62 HB2 ASP 62 -6.459 -12.885 4.927
455 HB3 ASP 62 HB1 ASP 62 -7.095 -13.944 3.674
456 H ASP 63 HN ASP 63 -7.536 -13.204 1.134
457 HA ASP 63 HA ASP 63 -5.503 -14.627 -0.307
458 HB2 ASP 63 HB2 ASP 63 -7.606 -15.694 -0.267
459 HB3 ASP 63 HB1 ASP 63 -8.458 -14.224 -0.731
460 H VAL 64 HN VAL 64 -7.373 -11.684 -0.841
461 HA VAL 64 HA VAL 64 -6.388 -11.277 -3.488
462 HB VAL 64 HB VAL 64 -7.629 -9.229 -1.640
463 HG11 VAL 64 HG11 VAL 64 -6.469 -8.262 -3.571
464 HG12 VAL 64 HG12 VAL 64 -8.216 -8.060 -3.711
465 HG13 VAL 64 HG13 VAL 64 -7.393 -9.304 -4.651
466 HG21 VAL 64 HG21 VAL 64 -9.129 -11.116 -1.873
467 HG22 VAL 64 HG22 VAL 64 -8.923 -11.105 -3.625
468 HG23 VAL 64 HG23 VAL 64 -9.742 -9.763 -2.823
469 H ALA 65 HN ALA 65 -5.290 -10.475 -0.294
470 HA ALA 65 HA ALA 65 -3.423 -8.478 -0.933
471 HB1 ALA 65 HB1 ALA 65 -3.281 -10.533 1.264
472 HB2 ALA 65 HB2 ALA 65 -4.119 -8.984 1.361
473 HB3 ALA 65 HB3 ALA 65 -2.365 -9.029 1.187
474 H GLY 66 HN GLY 66 -3.211 -11.981 -0.901
475 HA2 GLY 66 HA2 GLY 66 -0.380 -11.926 -1.553
476 HA3 GLY 66 HA1 GLY 66 -1.352 -13.355 -1.245
477 H ARG 67 HN ARG 67 -2.281 -10.877 -3.564
478 HA ARG 67 HA ARG 67 -1.184 -12.455 -5.749
479 HB2 ARG 67 HB2 ARG 67 -3.330 -12.471 -6.980
480 HB3 ARG 67 HB1 ARG 67 -3.374 -13.433 -5.511
481 HG2 ARG 67 HG2 ARG 67 -4.565 -11.644 -4.367
482 HG3 ARG 67 HG1 ARG 67 -4.501 -10.660 -5.827
483 HD2 ARG 67 HD2 ARG 67 -6.667 -11.676 -5.687
484 HD3 ARG 67 HD1 ARG 67 -5.781 -12.426 -7.014
485 HE ARG 67 HE ARG 67 -5.857 -13.745 -4.384
486 HH11 ARG 67 HH11 ARG 67 -6.759 -13.672 -7.760
487 HH12 ARG 67 HH12 ARG 67 -7.244 -15.337 -7.803
488 HH21 ARG 67 HH21 ARG 67 -6.540 -15.936 -4.405
489 HH22 ARG 67 HH22 ARG 67 -7.118 -16.623 -5.894
490 H VAL 68 HN VAL 68 -1.205 -9.615 -4.387
491 HA VAL 68 HA VAL 68 -1.518 -8.055 -6.849
492 HB VAL 68 HB VAL 68 -1.244 -6.049 -5.486
493 HG11 VAL 68 HG11 VAL 68 -3.306 -6.193 -4.192
494 HG12 VAL 68 HG12 VAL 68 -3.272 -7.952 -4.327
495 HG13 VAL 68 HG13 VAL 68 -3.480 -6.959 -5.771
496 HG21 VAL 68 HG21 VAL 68 -1.125 -6.167 -3.049
497 HG22 VAL 68 HG22 VAL 68 0.285 -6.918 -3.797
498 HG23 VAL 68 HG23 VAL 68 -1.004 -7.925 -3.136
499 H ASP 69 HN ASP 69 0.272 -6.213 -6.977
500 HA ASP 69 HA ASP 69 2.890 -7.164 -6.188
501 HB2 ASP 69 HB2 ASP 69 1.897 -7.834 -8.742
502 HB3 ASP 69 HB1 ASP 69 3.070 -6.543 -8.998
503 H THR 70 HN THR 70 1.205 -4.834 -8.285
504 HA THR 70 HA THR 70 3.181 -2.815 -7.550
505 HB THR 70 HB THR 70 1.906 -1.502 -9.398
506 HG1 THR 70 HG1 THR 70 0.380 -2.587 -10.413
507 HG21 THR 70 HG21 THR 70 3.513 -3.968 -10.075
508 HG22 THR 70 HG22 THR 70 4.168 -2.378 -9.683
509 HG23 THR 70 HG23 THR 70 3.225 -2.607 -11.156
510 HA PRO 71 HA PRO 71 0.601 -0.589 -4.680
511 HB2 PRO 71 HB2 PRO 71 1.706 1.731 -6.213
512 HB3 PRO 71 HB1 PRO 71 1.598 1.498 -4.465
513 HG2 PRO 71 HG2 PRO 71 3.912 1.147 -5.688
514 HG3 PRO 71 HG1 PRO 71 3.396 -0.003 -4.438
515 HD2 PRO 71 HD2 PRO 71 3.395 -0.306 -7.408
516 HD3 PRO 71 HD1 PRO 71 3.749 -1.506 -6.148
517 H ARG 72 HN ARG 72 0.564 0.210 -8.120
518 HA ARG 72 HA ARG 72 -1.644 1.878 -8.268
519 HB2 ARG 72 HB2 ARG 72 -0.190 1.336 -10.194
520 HB3 ARG 72 HB1 ARG 72 -0.890 -0.277 -10.249
521 HG2 ARG 72 HG2 ARG 72 -3.147 0.927 -10.490
522 HG3 ARG 72 HG1 ARG 72 -2.179 2.346 -10.887
523 HD2 ARG 72 HD2 ARG 72 -2.105 -0.305 -12.317
524 HD3 ARG 72 HD1 ARG 72 -2.893 1.160 -12.891
525 HE ARG 72 HE ARG 72 -0.056 1.383 -12.348
526 HH11 ARG 72 HH11 ARG 72 -2.591 0.925 -14.716
527 HH12 ARG 72 HH12 ARG 72 -1.557 1.246 -16.082
528 HH21 ARG 72 HH21 ARG 72 1.309 1.844 -14.153
529 HH22 ARG 72 HH22 ARG 72 0.663 1.737 -15.763
530 H GLU 73 HN GLU 73 -1.590 -1.656 -8.624
531 HA GLU 73 HA GLU 73 -4.361 -1.986 -8.907
532 HB2 GLU 73 HB2 GLU 73 -2.856 -4.145 -7.520
533 HB3 GLU 73 HB1 GLU 73 -3.976 -4.249 -8.866
534 HG2 GLU 73 HG2 GLU 73 -1.087 -3.413 -8.979
535 HG3 GLU 73 HG1 GLU 73 -1.785 -4.914 -9.577
536 H LEU 74 HN LEU 74 -2.268 -2.096 -6.084
537 HA LEU 74 HA LEU 74 -4.146 -2.859 -4.150
538 HB2 LEU 74 HB2 LEU 74 -1.554 -2.618 -4.082
539 HB3 LEU 74 HB1 LEU 74 -1.877 -0.965 -3.608
540 HG LEU 74 HG LEU 74 -1.383 -2.573 -1.739
541 HD11 LEU 74 HD11 LEU 74 -4.057 -1.190 -1.616
542 HD12 LEU 74 HD12 LEU 74 -2.489 -0.422 -1.363
543 HD13 LEU 74 HD13 LEU 74 -3.053 -1.663 -0.244
544 HD21 LEU 74 HD21 LEU 74 -3.186 -4.043 -0.992
545 HD22 LEU 74 HD22 LEU 74 -2.613 -4.492 -2.599
546 HD23 LEU 74 HD23 LEU 74 -4.131 -3.614 -2.418
547 H LEU 75 HN LEU 75 -3.101 0.334 -5.242
548 HA LEU 75 HA LEU 75 -4.668 1.906 -3.541
549 HB2 LEU 75 HB2 LEU 75 -2.777 2.672 -4.985
550 HB3 LEU 75 HB1 LEU 75 -3.834 2.535 -6.375
551 HG LEU 75 HG LEU 75 -5.338 4.230 -5.293
552 HD11 LEU 75 HD11 LEU 75 -2.995 4.484 -3.417
553 HD12 LEU 75 HD12 LEU 75 -4.635 3.986 -2.997
554 HD13 LEU 75 HD13 LEU 75 -4.323 5.636 -3.536
555 HD21 LEU 75 HD21 LEU 75 -3.887 6.137 -5.862
556 HD22 LEU 75 HD22 LEU 75 -3.828 4.859 -7.075
557 HD23 LEU 75 HD23 LEU 75 -2.504 5.042 -5.924
558 H ASP 76 HN ASP 76 -5.320 0.860 -6.886
559 HA ASP 76 HA ASP 76 -7.863 2.145 -7.000
560 HB2 ASP 76 HB2 ASP 76 -6.474 1.676 -9.007
561 HB3 ASP 76 HB1 ASP 76 -6.784 -0.044 -8.792
562 H LEU 77 HN LEU 77 -6.799 -1.030 -6.032
563 HA LEU 77 HA LEU 77 -9.269 -2.380 -6.137
564 HB2 LEU 77 HB2 LEU 77 -7.137 -3.530 -5.849
565 HB3 LEU 77 HB1 LEU 77 -6.913 -2.762 -4.290
566 HG LEU 77 HG LEU 77 -8.937 -3.980 -3.466
567 HD11 LEU 77 HD11 LEU 77 -8.690 -5.419 -6.105
568 HD12 LEU 77 HD12 LEU 77 -10.027 -4.384 -5.602
569 HD13 LEU 77 HD13 LEU 77 -9.723 -5.903 -4.759
570 HD21 LEU 77 HD21 LEU 77 -6.667 -5.655 -4.531
571 HD22 LEU 77 HD22 LEU 77 -7.786 -6.127 -3.252
572 HD23 LEU 77 HD23 LEU 77 -6.686 -4.772 -3.004
573 H ILE 78 HN ILE 78 -7.643 -0.822 -3.372
574 HA ILE 78 HA ILE 78 -9.753 -1.202 -1.547
575 HB ILE 78 HB ILE 78 -7.599 0.928 -1.541
576 HG12 ILE 78 HG12 ILE 78 -7.757 -1.776 -0.185
577 HG13 ILE 78 HG11 ILE 78 -6.716 -1.364 -1.545
578 HG21 ILE 78 HG21 ILE 78 -9.330 -0.044 0.733
579 HG22 ILE 78 HG22 ILE 78 -9.512 1.501 -0.098
580 HG23 ILE 78 HG23 ILE 78 -8.050 1.167 0.830
581 HD11 ILE 78 HD11 ILE 78 -5.501 0.208 -0.147
582 HD12 ILE 78 HD12 ILE 78 -5.498 -1.407 0.560
583 HD13 ILE 78 HD13 ILE 78 -6.565 -0.161 1.211
584 H ASN 79 HN ASN 79 -8.885 1.591 -3.573
585 HA ASN 79 HA ASN 79 -11.070 3.203 -2.764
586 HB2 ASN 79 HB2 ASN 79 -9.326 3.275 -5.224
587 HB3 ASN 79 HB1 ASN 79 -10.580 4.469 -4.903
588 HD21 ASN 79 HD21 ASN 79 -7.743 4.916 -5.150
589 HD22 ASN 79 HD22 ASN 79 -7.204 5.576 -3.643
590 H GLY 80 HN GLY 80 -10.814 0.548 -4.933
591 HA2 GLY 80 HA2 GLY 80 -13.122 1.096 -6.515
592 HA3 GLY 80 HA1 GLY 80 -12.341 -0.469 -6.322
593 H ALA 81 HN ALA 81 -12.584 -0.548 -3.462
594 HA ALA 81 HA ALA 81 -15.260 -1.519 -3.212
595 HB1 ALA 81 HB1 ALA 81 -13.171 -1.073 -1.082
596 HB2 ALA 81 HB2 ALA 81 -13.397 -2.556 -2.009
597 HB3 ALA 81 HB3 ALA 81 -14.655 -2.009 -0.901
598 H LEU 82 HN LEU 82 -13.565 1.403 -2.385
599 HA LEU 82 HA LEU 82 -15.730 2.431 -0.755
600 HB2 LEU 82 HB2 LEU 82 -13.194 3.752 -1.717
601 HB3 LEU 82 HB1 LEU 82 -14.306 4.429 -0.546
602 HG LEU 82 HG LEU 82 -12.721 1.892 -0.155
603 HD11 LEU 82 HD11 LEU 82 -12.295 4.648 0.992
604 HD12 LEU 82 HD12 LEU 82 -11.282 3.854 -0.214
605 HD13 LEU 82 HD13 LEU 82 -11.386 3.195 1.418
606 HD21 LEU 82 HD21 LEU 82 -14.411 3.466 1.784
607 HD22 LEU 82 HD22 LEU 82 -13.467 2.022 2.155
608 HD23 LEU 82 HD23 LEU 82 -14.847 1.918 1.061
609 H ALA 83 HN ALA 83 -15.042 2.273 -4.033
610 HA ALA 83 HA ALA 83 -15.857 4.815 -4.938
611 HB1 ALA 83 HB1 ALA 83 -15.954 2.172 -6.386
612 HB2 ALA 83 HB2 ALA 83 -14.574 3.269 -6.321
613 HB3 ALA 83 HB3 ALA 83 -16.059 3.768 -7.130
614 H GLU 84 HN GLU 84 -17.648 2.127 -3.766
615 HA GLU 84 HA GLU 84 -20.134 2.732 -4.995
616 HB2 GLU 84 HB2 GLU 84 -19.492 1.274 -2.430
617 HB3 GLU 84 HB1 GLU 84 -21.095 1.353 -3.151
618 HG2 GLU 84 HG2 GLU 84 -18.663 0.194 -4.494
619 HG3 GLU 84 HG1 GLU 84 -19.894 -0.744 -3.651
620 H ALA 85 HN ALA 85 -18.333 4.158 -2.478
621 HA ALA 85 HA ALA 85 -20.641 5.786 -1.641
622 HB1 ALA 85 HB1 ALA 85 -18.066 5.213 -0.177
623 HB2 ALA 85 HB2 ALA 85 -19.656 4.544 0.194
624 HB3 ALA 85 HB3 ALA 85 -19.356 6.269 0.399
625 H ALA 86 HN ALA 86 -18.819 6.032 -4.002
626 HA ALA 86 HA ALA 86 -17.322 8.444 -3.524
627 HB1 ALA 86 HB1 ALA 86 -16.600 6.774 -5.204
628 HB2 ALA 86 HB2 ALA 86 -16.809 8.385 -5.889
629 HB3 ALA 86 HB3 ALA 86 -18.036 7.149 -6.160
630 H28 SXO 87 H28B SXO 87 4.972 -12.076 5.617
631 H28A SXO 87 H28A SXO 87 5.266 -13.654 6.354
632 H30 SXO 87 H30A SXO 87 1.667 -13.025 6.754
633 H30A SXO 87 H30C SXO 87 3.187 -13.316 7.597
634 H30B SXO 87 H30B SXO 87 2.921 -11.785 6.759
635 H31 SXO 87 H31A SXO 87 3.193 -13.127 3.355
636 H31A SXO 87 H31B SXO 87 2.813 -11.703 4.323
637 H31B SXO 87 H31C SXO 87 1.647 -13.018 4.197
638 H32 SXO 87 H32A SXO 87 3.293 -15.399 6.384
639 HO33 SXO 87 H33A SXO 87 4.560 -14.910 4.117
640 HN36 SXO 87 H36A SXO 87 0.973 -14.441 6.748
641 H37 SXO 87 H37A SXO 87 -1.061 -14.674 4.820
642 H37A SXO 87 H37B SXO 87 -0.948 -16.169 5.745
643 H38 SXO 87 H38B SXO 87 -1.275 -14.932 7.818
644 H38A SXO 87 H38A SXO 87 -2.612 -14.678 6.698
645 HN41 SXO 87 H41A SXO 87 -1.601 -12.857 5.008
646 H42 SXO 87 H42A SXO 87 -2.257 -10.422 5.800
647 H42A SXO 87 H42B SXO 87 -0.624 -10.530 6.463
648 H43 SXO 87 H43B SXO 87 0.279 -10.918 4.237
649 H43A SXO 87 H43A SXO 87 -1.356 -10.895 3.556
650 H2 SXO 87 H2A SXO 87 0.304 -7.553 0.854
651 H2A SXO 87 H2B SXO 87 0.787 -6.757 2.349
652 H3 SXO 87 H3B SXO 87 -2.056 -7.497 2.181
653 H3A SXO 87 H3A SXO 87 -1.291 -6.034 2.805
654 H4 SXO 87 H4A SXO 87 -2.639 -5.548 0.822
655 H4A SXO 87 H4B SXO 87 -1.708 -6.723 -0.107
656 H5 SXO 87 H5B SXO 87 0.331 -5.363 0.313
657 H5A SXO 87 H5A SXO 87 -0.900 -4.537 -0.644
658 H6 SXO 87 H6A SXO 87 -0.308 -4.148 2.288
659 H6A SXO 87 H6B SXO 87 -1.680 -3.420 1.449
660 H7 SXO 87 H7A SXO 87 -0.160 -2.239 -0.049
661 H7A SXO 87 H7B SXO 87 1.229 -2.985 0.764
662 H8 SXO 87 H8C SXO 87 -0.819 -1.198 2.081
663 H8A SXO 87 H8A SXO 87 0.794 -0.696 1.572
664 H8B SXO 87 H8B SXO 87 0.606 -1.900 2.847
Start of MODEL 4
1 H1 MET 1 HT1 MET 1 -16.224 14.678 3.338
2 H2 MET 1 HT2 MET 1 -17.727 15.335 2.919
3 H3 MET 1 HT3 MET 1 -17.103 14.027 2.039
4 HA MET 1 HA MET 1 -17.956 13.999 4.877
5 HB2 MET 1 HB2 MET 1 -19.117 12.724 2.392
6 HB3 MET 1 HB1 MET 1 -19.642 12.353 4.029
7 HG2 MET 1 HG2 MET 1 -20.354 14.654 4.344
8 HG3 MET 1 HG1 MET 1 -19.786 15.061 2.727
9 HE1 MET 1 HE1 MET 1 -20.876 14.156 0.501
10 HE2 MET 1 HE2 MET 1 -22.251 13.054 0.450
11 HE3 MET 1 HE3 MET 1 -20.688 12.488 1.042
12 H ALA 2 HN ALA 2 -16.461 12.289 2.181
13 HA ALA 2 HA ALA 2 -15.040 10.620 4.116
14 HB1 ALA 2 HB1 ALA 2 -15.353 8.614 2.723
15 HB2 ALA 2 HB2 ALA 2 -16.447 9.521 1.678
16 HB3 ALA 2 HB3 ALA 2 -16.883 9.215 3.359
17 H THR 3 HN THR 3 -13.113 9.564 3.049
18 HA THR 3 HA THR 3 -12.193 11.089 0.726
19 HB THR 3 HB THR 3 -11.352 12.223 2.779
20 HG1 THR 3 HG1 THR 3 -9.047 11.130 1.650
21 HG21 THR 3 HG21 THR 3 -9.848 9.641 3.206
22 HG22 THR 3 HG22 THR 3 -11.115 10.290 4.247
23 HG23 THR 3 HG23 THR 3 -9.574 11.139 4.094
24 H LEU 4 HN LEU 4 -10.945 9.986 -0.664
25 HA LEU 4 HA LEU 4 -10.786 7.119 -0.355
26 HB2 LEU 4 HB2 LEU 4 -9.890 8.919 -2.605
27 HB3 LEU 4 HB1 LEU 4 -9.926 7.169 -2.663
28 HG LEU 4 HG LEU 4 -12.334 8.978 -2.413
29 HD11 LEU 4 HD11 LEU 4 -11.347 9.046 -4.631
30 HD12 LEU 4 HD12 LEU 4 -12.872 8.159 -4.662
31 HD13 LEU 4 HD13 LEU 4 -11.341 7.282 -4.702
32 HD21 LEU 4 HD21 LEU 4 -12.678 6.890 -1.221
33 HD22 LEU 4 HD22 LEU 4 -12.145 5.976 -2.632
34 HD23 LEU 4 HD23 LEU 4 -13.637 6.915 -2.703
35 H LEU 5 HN LEU 5 -8.728 6.062 -1.162
36 HA LEU 5 HA LEU 5 -6.427 7.075 0.273
37 HB2 LEU 5 HB2 LEU 5 -6.678 4.750 0.438
38 HB3 LEU 5 HB1 LEU 5 -7.108 4.582 -1.250
39 HG LEU 5 HG LEU 5 -4.780 4.949 -1.901
40 HD11 LEU 5 HD11 LEU 5 -3.021 4.956 -0.160
41 HD12 LEU 5 HD12 LEU 5 -4.280 5.174 1.059
42 HD13 LEU 5 HD13 LEU 5 -4.015 6.412 -0.170
43 HD21 LEU 5 HD21 LEU 5 -5.119 2.841 0.225
44 HD22 LEU 5 HD22 LEU 5 -3.858 2.870 -1.008
45 HD23 LEU 5 HD23 LEU 5 -5.547 2.682 -1.478
46 H THR 6 HN THR 6 -5.041 8.467 -0.649
47 HA THR 6 HA THR 6 -4.993 8.636 -3.563
48 HB THR 6 HB THR 6 -3.585 10.816 -2.499
49 HG1 THR 6 HG1 THR 6 -4.425 10.889 -0.523
50 HG21 THR 6 HG21 THR 6 -5.038 10.794 -4.486
51 HG22 THR 6 HG22 THR 6 -5.471 12.095 -3.376
52 HG23 THR 6 HG23 THR 6 -6.446 10.626 -3.437
53 H THR 7 HN THR 7 -2.842 9.540 -4.409
54 HA THR 7 HA THR 7 -0.910 7.560 -4.292
55 HB THR 7 HB THR 7 0.536 9.539 -5.279
56 HG1 THR 7 HG1 THR 7 -0.564 11.351 -5.631
57 HG21 THR 7 HG21 THR 7 -1.938 8.481 -6.662
58 HG22 THR 7 HG22 THR 7 -0.384 7.654 -6.566
59 HG23 THR 7 HG23 THR 7 -0.521 9.170 -7.454
60 H ASP 8 HN ASP 8 -0.699 10.853 -2.921
61 HA ASP 8 HA ASP 8 1.762 10.487 -1.631
62 HB2 ASP 8 HB2 ASP 8 -0.496 12.408 -1.081
63 HB3 ASP 8 HB1 ASP 8 1.042 12.464 -0.226
64 H ASP 9 HN ASP 9 -1.530 9.962 -0.519
65 HA ASP 9 HA ASP 9 -0.999 9.501 2.188
66 HB2 ASP 9 HB2 ASP 9 -3.179 8.431 0.393
67 HB3 ASP 9 HB1 ASP 9 -3.151 8.183 2.134
68 H LEU 10 HN LEU 10 -1.169 7.223 -0.538
69 HA LEU 10 HA LEU 10 -0.517 4.927 0.964
70 HB2 LEU 10 HB2 LEU 10 -1.432 4.810 -1.314
71 HB3 LEU 10 HB1 LEU 10 0.043 5.518 -1.946
72 HG LEU 10 HG LEU 10 1.288 3.517 -1.069
73 HD11 LEU 10 HD11 LEU 10 -0.338 2.815 0.607
74 HD12 LEU 10 HD12 LEU 10 0.009 1.517 -0.535
75 HD13 LEU 10 HD13 LEU 10 -1.494 2.430 -0.669
76 HD21 LEU 10 HD21 LEU 10 -0.895 2.946 -3.073
77 HD22 LEU 10 HD22 LEU 10 0.621 2.058 -2.898
78 HD23 LEU 10 HD23 LEU 10 0.638 3.740 -3.428
79 H ARG 11 HN ARG 11 1.479 7.218 -0.865
80 HA ARG 11 HA ARG 11 3.955 6.008 -0.541
81 HB2 ARG 11 HB2 ARG 11 3.636 7.866 -2.055
82 HB3 ARG 11 HB1 ARG 11 3.280 8.948 -0.717
83 HG2 ARG 11 HG2 ARG 11 5.500 8.986 -0.004
84 HG3 ARG 11 HG1 ARG 11 5.908 7.532 -0.913
85 HD2 ARG 11 HD2 ARG 11 6.857 9.462 -1.997
86 HD3 ARG 11 HD1 ARG 11 5.592 8.772 -3.005
87 HE ARG 11 HE ARG 11 4.280 10.717 -1.678
88 HH11 ARG 11 HH11 ARG 11 7.304 10.649 -3.419
89 HH12 ARG 11 HH12 ARG 11 7.180 12.293 -3.986
90 HH21 ARG 11 HH21 ARG 11 4.100 12.905 -2.396
91 HH22 ARG 11 HH22 ARG 11 5.358 13.564 -3.400
92 H ARG 12 HN ARG 12 2.169 8.027 1.724
93 HA ARG 12 HA ARG 12 4.313 8.322 3.567
94 HB2 ARG 12 HB2 ARG 12 1.328 8.594 3.892
95 HB3 ARG 12 HB1 ARG 12 2.477 8.942 5.174
96 HG2 ARG 12 HG2 ARG 12 2.456 10.317 2.496
97 HG3 ARG 12 HG1 ARG 12 1.677 10.948 3.948
98 HD2 ARG 12 HD2 ARG 12 3.782 12.028 3.773
99 HD3 ARG 12 HD1 ARG 12 3.925 10.844 5.067
100 HE ARG 12 HE ARG 12 4.791 9.656 2.691
101 HH11 ARG 12 HH11 ARG 12 5.793 12.133 4.959
102 HH12 ARG 12 HH12 ARG 12 7.474 12.002 4.546
103 HH21 ARG 12 HH21 ARG 12 7.010 9.516 2.144
104 HH22 ARG 12 HH22 ARG 12 8.172 10.511 2.966
105 H ALA 13 HN ALA 13 1.839 5.891 3.074
106 HA ALA 13 HA ALA 13 1.960 4.645 5.594
107 HB1 ALA 13 HB1 ALA 13 0.131 4.254 4.054
108 HB2 ALA 13 HB2 ALA 13 0.906 2.725 4.471
109 HB3 ALA 13 HB3 ALA 13 1.228 3.482 2.911
110 H LEU 14 HN LEU 14 3.827 4.138 2.633
111 HA LEU 14 HA LEU 14 5.218 1.831 3.527
112 HB2 LEU 14 HB2 LEU 14 5.840 3.885 1.408
113 HB3 LEU 14 HB1 LEU 14 6.909 2.540 1.739
114 HG LEU 14 HG LEU 14 5.663 1.872 -0.126
115 HD11 LEU 14 HD11 LEU 14 5.773 0.121 1.544
116 HD12 LEU 14 HD12 LEU 14 4.266 0.020 0.634
117 HD13 LEU 14 HD13 LEU 14 4.268 0.691 2.266
118 HD21 LEU 14 HD21 LEU 14 3.180 2.820 1.280
119 HD22 LEU 14 HD22 LEU 14 3.227 2.007 -0.284
120 HD23 LEU 14 HD23 LEU 14 3.970 3.595 -0.093
121 H VAL 15 HN VAL 15 5.567 5.189 4.136
122 HA VAL 15 HA VAL 15 8.303 5.000 5.071
123 HB VAL 15 HB VAL 15 6.373 7.323 5.206
124 HG11 VAL 15 HG11 VAL 15 8.414 8.686 5.523
125 HG12 VAL 15 HG12 VAL 15 9.351 7.198 5.654
126 HG13 VAL 15 HG13 VAL 15 8.119 7.572 6.859
127 HG21 VAL 15 HG21 VAL 15 6.832 6.658 2.915
128 HG22 VAL 15 HG22 VAL 15 8.567 6.710 3.239
129 HG23 VAL 15 HG23 VAL 15 7.617 8.195 3.287
130 H GLU 16 HN GLU 16 5.094 4.853 6.336
131 HA GLU 16 HA GLU 16 5.808 5.225 9.078
132 HB2 GLU 16 HB2 GLU 16 3.395 3.967 7.775
133 HB3 GLU 16 HB1 GLU 16 3.554 4.225 9.507
134 HG2 GLU 16 HG2 GLU 16 3.662 6.610 9.188
135 HG3 GLU 16 HG1 GLU 16 3.648 6.408 7.436
136 H SER 17 HN SER 17 5.554 2.456 6.920
137 HA SER 17 HA SER 17 5.989 0.559 9.047
138 HB2 SER 17 HB2 SER 17 6.142 -1.070 7.106
139 HB3 SER 17 HB1 SER 17 4.620 -0.190 7.246
140 HG SER 17 HG SER 17 5.145 0.030 5.150
141 H ALA 18 HN ALA 18 7.832 1.365 6.095
142 HA ALA 18 HA ALA 18 10.247 0.351 7.427
143 HB1 ALA 18 HB1 ALA 18 9.760 -0.636 5.261
144 HB2 ALA 18 HB2 ALA 18 11.243 0.317 5.180
145 HB3 ALA 18 HB3 ALA 18 9.742 0.962 4.514
146 H GLY 19 HN GLY 19 9.305 3.059 5.305
147 HA2 GLY 19 HA2 GLY 19 9.706 5.337 5.930
148 HA3 GLY 19 HA1 GLY 19 11.060 4.791 6.908
149 H GLU 20 HN GLU 20 11.088 6.870 4.982
150 HA GLU 20 HA GLU 20 12.328 6.010 2.582
151 HB2 GLU 20 HB2 GLU 20 12.408 8.706 3.956
152 HB3 GLU 20 HB1 GLU 20 12.925 8.390 2.304
153 HG2 GLU 20 HG2 GLU 20 10.686 7.816 1.655
154 HG3 GLU 20 HG1 GLU 20 10.125 7.953 3.322
155 H THR 21 HN THR 21 14.177 4.925 2.623
156 HA THR 21 HA THR 21 16.271 5.770 4.500
157 HB THR 21 HB THR 21 17.198 3.418 4.014
158 HG1 THR 21 HG1 THR 21 14.583 2.589 3.570
159 HG21 THR 21 HG21 THR 21 15.736 2.417 5.729
160 HG22 THR 21 HG22 THR 21 14.628 3.778 5.551
161 HG23 THR 21 HG23 THR 21 16.259 4.045 6.164
162 H ASP 22 HN ASP 22 16.997 3.565 1.990
163 HA ASP 22 HA ASP 22 18.208 5.604 0.292
164 HB2 ASP 22 HB2 ASP 22 19.811 4.800 2.207
165 HB3 ASP 22 HB1 ASP 22 19.961 3.345 1.229
166 H GLY 23 HN GLY 23 18.982 4.674 -1.764
167 HA2 GLY 23 HA2 GLY 23 18.927 3.136 -3.503
168 HA3 GLY 23 HA1 GLY 23 18.335 1.932 -2.366
169 H THR 24 HN THR 24 16.020 2.521 -1.547
170 HA THR 24 HA THR 24 14.413 2.827 -3.972
171 HB THR 24 HB THR 24 13.943 0.791 -2.834
172 HG1 THR 24 HG1 THR 24 11.690 1.571 -1.874
173 HG21 THR 24 HG21 THR 24 13.529 2.418 -0.325
174 HG22 THR 24 HG22 THR 24 14.848 1.288 -0.642
175 HG23 THR 24 HG23 THR 24 13.193 0.695 -0.488
176 H ASP 25 HN ASP 25 14.366 5.035 -4.207
177 HA ASP 25 HA ASP 25 13.266 6.642 -2.028
178 HB2 ASP 25 HB2 ASP 25 15.158 7.656 -3.054
179 HB3 ASP 25 HB1 ASP 25 14.524 7.366 -4.670
180 H LEU 26 HN LEU 26 11.289 7.534 -2.054
181 HA LEU 26 HA LEU 26 9.473 6.538 -4.122
182 HB2 LEU 26 HB2 LEU 26 8.971 7.527 -1.314
183 HB3 LEU 26 HB1 LEU 26 7.686 7.151 -2.443
184 HG LEU 26 HG LEU 26 8.643 4.799 -2.558
185 HD11 LEU 26 HD11 LEU 26 10.108 5.721 -0.092
186 HD12 LEU 26 HD12 LEU 26 10.850 5.275 -1.628
187 HD13 LEU 26 HD13 LEU 26 9.997 4.061 -0.674
188 HD21 LEU 26 HD21 LEU 26 7.580 4.142 -0.426
189 HD22 LEU 26 HD22 LEU 26 6.609 5.277 -1.363
190 HD23 LEU 26 HD23 LEU 26 7.522 5.845 0.033
191 H SER 27 HN SER 27 11.226 9.169 -3.814
192 HA SER 27 HA SER 27 9.198 11.198 -4.126
193 HB2 SER 27 HB2 SER 27 12.174 11.422 -4.617
194 HB3 SER 27 HB1 SER 27 11.038 12.746 -4.359
195 HG SER 27 HG SER 27 11.898 10.774 -2.504
196 H GLY 28 HN GLY 28 8.055 10.397 -5.934
197 HA2 GLY 28 HA2 GLY 28 8.192 11.474 -8.302
198 HA3 GLY 28 HA1 GLY 28 9.523 10.334 -8.471
199 H ASP 29 HN ASP 29 9.003 8.515 -9.448
200 HA ASP 29 HA ASP 29 6.209 7.599 -9.339
201 HB2 ASP 29 HB2 ASP 29 6.709 6.303 -11.364
202 HB3 ASP 29 HB1 ASP 29 7.065 8.010 -11.606
203 H PHE 30 HN PHE 30 5.812 5.324 -9.026
204 HA PHE 30 HA PHE 30 7.827 3.551 -8.133
205 HB2 PHE 30 HB2 PHE 30 7.528 3.571 -5.760
206 HB3 PHE 30 HB1 PHE 30 7.828 5.234 -6.246
207 HD1 PHE 30 HD2 PHE 30 5.730 6.743 -6.571
208 HD2 PHE 30 HD1 PHE 30 5.716 3.053 -4.434
209 HE1 PHE 30 HE2 PHE 30 3.679 7.428 -5.393
210 HE2 PHE 30 HE1 PHE 30 3.667 3.738 -3.261
211 HZ PHE 30 HZ PHE 30 2.650 5.926 -3.736
212 H LEU 31 HN LEU 31 4.519 4.486 -8.426
213 HA LEU 31 HA LEU 31 3.172 2.261 -7.446
214 HB2 LEU 31 HB2 LEU 31 2.473 4.008 -9.801
215 HB3 LEU 31 HB1 LEU 31 1.369 2.896 -9.020
216 HG LEU 31 HG LEU 31 2.640 5.270 -7.664
217 HD11 LEU 31 HD11 LEU 31 1.100 5.956 -9.425
218 HD12 LEU 31 HD12 LEU 31 0.446 6.304 -7.825
219 HD13 LEU 31 HD13 LEU 31 -0.149 4.916 -8.736
220 HD21 LEU 31 HD21 LEU 31 0.893 4.841 -5.954
221 HD22 LEU 31 HD22 LEU 31 2.107 3.568 -6.068
222 HD23 LEU 31 HD23 LEU 31 0.513 3.332 -6.784
223 H ASP 32 HN ASP 32 5.137 2.553 -10.250
224 HA ASP 32 HA ASP 32 3.955 0.249 -11.596
225 HB2 ASP 32 HB2 ASP 32 6.319 1.951 -12.427
226 HB3 ASP 32 HB1 ASP 32 5.477 0.776 -13.429
227 H LEU 33 HN LEU 33 6.347 0.921 -9.348
228 HA LEU 33 HA LEU 33 8.138 -1.214 -10.128
229 HB2 LEU 33 HB2 LEU 33 8.138 0.567 -7.689
230 HB3 LEU 33 HB1 LEU 33 9.413 -0.554 -8.132
231 HG LEU 33 HG LEU 33 8.596 1.870 -9.745
232 HD11 LEU 33 HD11 LEU 33 10.990 1.391 -7.974
233 HD12 LEU 33 HD12 LEU 33 9.660 2.503 -7.650
234 HD13 LEU 33 HD13 LEU 33 10.746 2.797 -9.008
235 HD21 LEU 33 HD21 LEU 33 10.890 -0.064 -10.080
236 HD22 LEU 33 HD22 LEU 33 10.631 1.403 -11.023
237 HD23 LEU 33 HD23 LEU 33 9.482 0.071 -11.135
238 H ARG 34 HN ARG 34 7.998 -3.235 -9.405
239 HA ARG 34 HA ARG 34 5.802 -4.091 -7.823
240 HB2 ARG 34 HB2 ARG 34 8.324 -5.625 -8.486
241 HB3 ARG 34 HB1 ARG 34 6.785 -6.310 -7.974
242 HG2 ARG 34 HG2 ARG 34 5.744 -5.625 -10.029
243 HG3 ARG 34 HG1 ARG 34 7.200 -4.752 -10.514
244 HD2 ARG 34 HD2 ARG 34 8.419 -6.949 -10.400
245 HD3 ARG 34 HD1 ARG 34 6.848 -7.728 -10.219
246 HE ARG 34 HE ARG 34 6.272 -6.813 -12.415
247 HH11 ARG 34 HH11 ARG 34 9.661 -6.990 -11.519
248 HH12 ARG 34 HH12 ARG 34 10.221 -6.935 -13.164
249 HH21 ARG 34 HH21 ARG 34 6.997 -6.789 -14.567
250 HH22 ARG 34 HH22 ARG 34 8.704 -6.837 -14.905
251 H PHE 35 HN PHE 35 5.811 -5.025 -5.737
252 HA PHE 35 HA PHE 35 7.229 -3.687 -3.768
253 HB2 PHE 35 HB2 PHE 35 5.921 -6.411 -3.655
254 HB3 PHE 35 HB1 PHE 35 6.535 -5.561 -2.240
255 HD1 PHE 35 HD2 PHE 35 5.635 -3.065 -2.012
256 HD2 PHE 35 HD1 PHE 35 3.696 -6.177 -4.163
257 HE1 PHE 35 HE2 PHE 35 3.494 -1.872 -1.792
258 HE2 PHE 35 HE1 PHE 35 1.547 -4.991 -3.952
259 HZ PHE 35 HZ PHE 35 1.452 -2.816 -2.782
260 H GLU 36 HN GLU 36 8.074 -6.617 -5.500
261 HA GLU 36 HA GLU 36 10.271 -7.476 -4.004
262 HB2 GLU 36 HB2 GLU 36 9.852 -7.609 -7.000
263 HB3 GLU 36 HB1 GLU 36 11.049 -8.534 -6.106
264 HG2 GLU 36 HG2 GLU 36 9.187 -9.591 -4.838
265 HG3 GLU 36 HG1 GLU 36 8.056 -8.752 -5.899
266 H ASP 37 HN ASP 37 9.939 -4.801 -6.218
267 HA ASP 37 HA ASP 37 12.804 -4.521 -6.607
268 HB2 ASP 37 HB2 ASP 37 10.464 -2.891 -7.611
269 HB3 ASP 37 HB1 ASP 37 12.141 -2.521 -7.982
270 H ILE 38 HN ILE 38 10.226 -3.002 -4.780
271 HA ILE 38 HA ILE 38 11.967 -0.811 -4.001
272 HB ILE 38 HB ILE 38 10.011 0.001 -2.677
273 HG12 ILE 38 HG12 ILE 38 8.561 -2.271 -4.062
274 HG13 ILE 38 HG11 ILE 38 8.941 -2.215 -2.345
275 HG21 ILE 38 HG21 ILE 38 9.494 -0.531 -5.603
276 HG22 ILE 38 HG22 ILE 38 10.488 0.772 -4.952
277 HG23 ILE 38 HG23 ILE 38 8.756 0.738 -4.627
278 HD11 ILE 38 HD11 ILE 38 6.620 -1.607 -2.807
279 HD12 ILE 38 HD12 ILE 38 7.180 -0.254 -3.790
280 HD13 ILE 38 HD13 ILE 38 7.518 -0.287 -2.059
281 H GLY 39 HN GLY 39 12.065 -3.804 -3.129
282 HA2 GLY 39 HA2 GLY 39 13.247 -4.768 -1.414
283 HA3 GLY 39 HA1 GLY 39 13.469 -3.164 -0.744
284 H TYR 40 HN TYR 40 10.343 -4.748 -1.310
285 HA TYR 40 HA TYR 40 10.001 -4.756 1.604
286 HB2 TYR 40 HB2 TYR 40 8.053 -4.412 -0.640
287 HB3 TYR 40 HB1 TYR 40 7.496 -5.026 0.917
288 HD1 TYR 40 HD1 TYR 40 9.237 -2.173 -0.695
289 HD2 TYR 40 HD2 TYR 40 7.142 -3.567 2.728
290 HE1 TYR 40 HE1 TYR 40 9.103 0.130 0.156
291 HE2 TYR 40 HE2 TYR 40 7.007 -1.270 3.596
292 HH TYR 40 HH TYR 40 7.730 1.451 1.679
293 H ASP 41 HN ASP 41 10.021 -6.554 2.634
294 HA ASP 41 HA ASP 41 10.434 -9.002 1.209
295 HB2 ASP 41 HB2 ASP 41 10.921 -9.946 3.431
296 HB3 ASP 41 HB1 ASP 41 11.804 -8.453 3.154
297 H SER 42 HN SER 42 8.203 -8.110 3.812
298 HA SER 42 HA SER 42 5.862 -9.221 2.840
299 HB2 SER 42 HB2 SER 42 5.793 -11.388 4.099
300 HB3 SER 42 HB1 SER 42 7.010 -11.392 2.816
301 H LEU 43 HN LEU 43 7.902 -9.229 5.729
302 HA LEU 43 HA LEU 43 5.845 -8.722 7.594
303 HB2 LEU 43 HB2 LEU 43 8.417 -9.430 7.801
304 HB3 LEU 43 HB1 LEU 43 8.604 -7.713 8.088
305 HG LEU 43 HG LEU 43 8.460 -8.968 10.179
306 HD11 LEU 43 HD11 LEU 43 6.674 -7.687 11.256
307 HD12 LEU 43 HD12 LEU 43 6.053 -7.230 9.670
308 HD13 LEU 43 HD13 LEU 43 7.652 -6.689 10.181
309 HD21 LEU 43 HD21 LEU 43 7.115 -10.833 9.432
310 HD22 LEU 43 HD22 LEU 43 5.726 -9.771 9.200
311 HD23 LEU 43 HD23 LEU 43 6.358 -10.056 10.823
312 H ALA 44 HN ALA 44 8.145 -6.588 5.911
313 HA ALA 44 HA ALA 44 7.186 -4.173 7.015
314 HB1 ALA 44 HB1 ALA 44 8.333 -3.071 5.162
315 HB2 ALA 44 HB2 ALA 44 8.514 -4.625 4.349
316 HB3 ALA 44 HB3 ALA 44 9.341 -4.330 5.878
317 H LEU 45 HN LEU 45 5.987 -6.231 4.513
318 HA LEU 45 HA LEU 45 4.337 -4.267 3.244
319 HB2 LEU 45 HB2 LEU 45 5.188 -6.312 2.108
320 HB3 LEU 45 HB1 LEU 45 4.141 -7.279 3.130
321 HG LEU 45 HG LEU 45 2.177 -6.078 2.146
322 HD11 LEU 45 HD11 LEU 45 2.478 -4.834 0.084
323 HD12 LEU 45 HD12 LEU 45 4.226 -5.021 0.208
324 HD13 LEU 45 HD13 LEU 45 3.354 -4.062 1.405
325 HD21 LEU 45 HD21 LEU 45 2.834 -8.284 1.360
326 HD22 LEU 45 HD22 LEU 45 3.966 -7.553 0.222
327 HD23 LEU 45 HD23 LEU 45 2.233 -7.298 0.026
328 H MET 46 HN MET 46 3.771 -6.902 5.580
329 HA MET 46 HA MET 46 0.975 -6.466 5.732
330 HB2 MET 46 HB2 MET 46 0.992 -7.966 7.645
331 HB3 MET 46 HB1 MET 46 1.988 -8.607 6.349
332 HG2 MET 46 HG2 MET 46 3.992 -7.929 7.495
333 HG3 MET 46 HG1 MET 46 3.043 -7.155 8.763
334 HE1 MET 46 HE1 MET 46 0.682 -9.240 9.167
335 HE2 MET 46 HE2 MET 46 1.548 -8.498 10.514
336 HE3 MET 46 HE3 MET 46 1.327 -10.247 10.461
337 H GLU 47 HN GLU 47 3.698 -5.121 7.496
338 HA GLU 47 HA GLU 47 2.228 -3.884 9.559
339 HB2 GLU 47 HB2 GLU 47 4.830 -3.039 8.270
340 HB3 GLU 47 HB1 GLU 47 4.182 -2.357 9.754
341 HG2 GLU 47 HG2 GLU 47 4.996 -5.224 9.335
342 HG3 GLU 47 HG1 GLU 47 5.916 -3.997 10.204
343 H THR 48 HN THR 48 3.053 -2.878 6.295
344 HA THR 48 HA THR 48 2.102 -0.241 6.433
345 HB THR 48 HB THR 48 2.146 -2.030 3.996
346 HG1 THR 48 HG1 THR 48 4.224 -2.040 4.727
347 HG21 THR 48 HG21 THR 48 0.923 0.048 3.649
348 HG22 THR 48 HG22 THR 48 2.454 0.087 2.775
349 HG23 THR 48 HG23 THR 48 2.281 0.973 4.290
350 H ALA 49 HN ALA 49 0.481 -3.292 5.863
351 HA ALA 49 HA ALA 49 -1.915 -2.442 4.745
352 HB1 ALA 49 HB1 ALA 49 -2.852 -4.526 5.516
353 HB2 ALA 49 HB2 ALA 49 -1.558 -4.708 6.702
354 HB3 ALA 49 HB3 ALA 49 -1.193 -4.794 4.981
355 H ALA 50 HN ALA 50 -0.980 -2.665 8.153
356 HA ALA 50 HA ALA 50 -3.514 -2.162 9.267
357 HB1 ALA 50 HB1 ALA 50 -1.712 -3.111 10.581
358 HB2 ALA 50 HB2 ALA 50 -2.285 -1.620 11.327
359 HB3 ALA 50 HB3 ALA 50 -0.778 -1.626 10.412
360 H ARG 51 HN ARG 51 -1.022 -0.086 8.043
361 HA ARG 51 HA ARG 51 -1.894 2.335 9.220
362 HB2 ARG 51 HB2 ARG 51 -0.256 1.811 6.736
363 HB3 ARG 51 HB1 ARG 51 -0.468 3.389 7.472
364 HG2 ARG 51 HG2 ARG 51 0.789 1.013 8.813
365 HG3 ARG 51 HG1 ARG 51 1.666 2.356 8.075
366 HD2 ARG 51 HD2 ARG 51 0.862 3.897 9.666
367 HD3 ARG 51 HD1 ARG 51 -0.386 2.787 10.224
368 HE ARG 51 HE ARG 51 1.596 1.410 11.039
369 HH11 ARG 51 HH11 ARG 51 1.646 4.916 10.824
370 HH12 ARG 51 HH12 ARG 51 2.685 5.096 12.213
371 HH21 ARG 51 HH21 ARG 51 2.947 1.651 12.838
372 HH22 ARG 51 HH22 ARG 51 3.447 3.241 13.348
373 H LEU 52 HN LEU 52 -2.743 0.622 6.292
374 HA LEU 52 HA LEU 52 -4.331 2.817 5.271
375 HB2 LEU 52 HB2 LEU 52 -4.204 -0.047 4.320
376 HB3 LEU 52 HB1 LEU 52 -4.894 1.313 3.452
377 HG LEU 52 HG LEU 52 -1.970 1.063 4.167
378 HD11 LEU 52 HD11 LEU 52 -3.360 0.560 1.540
379 HD12 LEU 52 HD12 LEU 52 -2.629 -0.665 2.579
380 HD13 LEU 52 HD13 LEU 52 -1.617 0.556 1.807
381 HD21 LEU 52 HD21 LEU 52 -1.671 2.918 2.634
382 HD22 LEU 52 HD22 LEU 52 -2.797 3.367 3.915
383 HD23 LEU 52 HD23 LEU 52 -3.405 2.958 2.311
384 H GLU 53 HN GLU 53 -4.905 -0.403 6.632
385 HA GLU 53 HA GLU 53 -7.682 -0.433 6.383
386 HB2 GLU 53 HB2 GLU 53 -5.933 -1.780 8.446
387 HB3 GLU 53 HB1 GLU 53 -7.628 -2.160 8.171
388 HG2 GLU 53 HG2 GLU 53 -7.122 -2.870 5.905
389 HG3 GLU 53 HG1 GLU 53 -5.428 -2.446 6.138
390 H SER 54 HN SER 54 -5.698 0.502 9.194
391 HA SER 54 HA SER 54 -7.912 1.120 10.845
392 HB2 SER 54 HB2 SER 54 -5.608 0.558 11.652
393 HB3 SER 54 HB1 SER 54 -5.079 2.152 11.117
394 HG SER 54 HG SER 54 -7.066 1.576 13.068
395 H ARG 55 HN ARG 55 -6.368 2.864 8.327
396 HA ARG 55 HA ARG 55 -7.056 5.480 9.350
397 HB2 ARG 55 HB2 ARG 55 -5.005 5.152 8.044
398 HB3 ARG 55 HB1 ARG 55 -5.960 4.645 6.659
399 HG2 ARG 55 HG2 ARG 55 -6.903 6.842 6.436
400 HG3 ARG 55 HG1 ARG 55 -6.117 7.374 7.925
401 HD2 ARG 55 HD2 ARG 55 -4.737 6.490 5.394
402 HD3 ARG 55 HD1 ARG 55 -4.882 8.150 5.978
403 HE ARG 55 HE ARG 55 -3.694 6.907 8.045
404 HH11 ARG 55 HH11 ARG 55 -2.935 7.014 4.627
405 HH12 ARG 55 HH12 ARG 55 -1.237 6.769 4.879
406 HH21 ARG 55 HH21 ARG 55 -1.484 6.606 8.371
407 HH22 ARG 55 HH22 ARG 55 -0.399 6.525 7.010
408 H TYR 56 HN TYR 56 -8.135 3.381 6.685
409 HA TYR 56 HA TYR 56 -10.265 5.307 6.103
410 HB2 TYR 56 HB2 TYR 56 -9.330 2.920 4.508
411 HB3 TYR 56 HB1 TYR 56 -10.534 4.096 3.988
412 HD1 TYR 56 HD2 TYR 56 -9.827 6.470 3.574
413 HD2 TYR 56 HD1 TYR 56 -7.004 3.362 4.267
414 HE1 TYR 56 HE2 TYR 56 -8.057 7.866 2.594
415 HE2 TYR 56 HE1 TYR 56 -5.227 4.752 3.284
416 HH TYR 56 HH TYR 56 -4.920 6.612 1.852
417 H GLY 57 HN GLY 57 -9.915 2.771 8.080
418 HA2 GLY 57 HA2 GLY 57 -11.463 1.528 9.245
419 HA3 GLY 57 HA1 GLY 57 -12.720 2.405 8.387
420 H VAL 58 HN VAL 58 -10.177 0.509 6.900
421 HA VAL 58 HA VAL 58 -12.259 -1.240 5.772
422 HB VAL 58 HB VAL 58 -10.804 -1.598 3.853
423 HG11 VAL 58 HG11 VAL 58 -12.363 0.254 3.756
424 HG12 VAL 58 HG12 VAL 58 -10.884 0.645 2.876
425 HG13 VAL 58 HG13 VAL 58 -11.163 1.325 4.479
426 HG21 VAL 58 HG21 VAL 58 -8.737 -0.305 3.558
427 HG22 VAL 58 HG22 VAL 58 -8.636 -1.403 4.936
428 HG23 VAL 58 HG23 VAL 58 -8.903 0.321 5.199
429 H SER 59 HN SER 59 -10.860 -3.262 4.770
430 HA SER 59 HA SER 59 -8.799 -4.218 6.514
431 HB2 SER 59 HB2 SER 59 -10.066 -6.355 6.984
432 HB3 SER 59 HB1 SER 59 -10.643 -4.934 7.851
433 HG SER 59 HG SER 59 -11.859 -5.284 5.419
434 H ILE 60 HN ILE 60 -7.474 -5.566 5.421
435 HA ILE 60 HA ILE 60 -8.144 -5.966 2.596
436 HB ILE 60 HB ILE 60 -5.468 -6.273 3.970
437 HG12 ILE 60 HG12 ILE 60 -6.535 -3.965 2.327
438 HG13 ILE 60 HG11 ILE 60 -6.358 -3.959 4.078
439 HG21 ILE 60 HG21 ILE 60 -6.206 -6.120 1.050
440 HG22 ILE 60 HG22 ILE 60 -5.631 -7.550 1.907
441 HG23 ILE 60 HG23 ILE 60 -4.563 -6.164 1.687
442 HD11 ILE 60 HD11 ILE 60 -4.129 -4.217 2.078
443 HD12 ILE 60 HD12 ILE 60 -3.947 -4.210 3.834
444 HD13 ILE 60 HD13 ILE 60 -4.544 -2.774 3.001
445 HA PRO 61 HA PRO 61 -8.902 -10.302 3.557
446 HB2 PRO 61 HB2 PRO 61 -9.089 -10.506 0.621
447 HB3 PRO 61 HB1 PRO 61 -10.283 -10.923 1.853
448 HG2 PRO 61 HG2 PRO 61 -10.594 -8.778 0.287
449 HG3 PRO 61 HG1 PRO 61 -11.094 -8.764 1.985
450 HD2 PRO 61 HD2 PRO 61 -8.645 -7.595 0.728
451 HD3 PRO 61 HD1 PRO 61 -9.700 -6.916 1.985
452 H ASP 62 HN ASP 62 -7.529 -11.984 3.666
453 HA ASP 62 HA ASP 62 -4.824 -11.598 3.009
454 HB2 ASP 62 HB2 ASP 62 -4.526 -13.926 3.827
455 HB3 ASP 62 HB1 ASP 62 -5.454 -12.916 4.929
456 H ASP 63 HN ASP 63 -7.406 -13.070 1.218
457 HA ASP 63 HA ASP 63 -5.686 -14.454 -0.634
458 HB2 ASP 63 HB2 ASP 63 -7.974 -15.236 -0.368
459 HB3 ASP 63 HB1 ASP 63 -8.602 -13.658 -0.829
460 H VAL 64 HN VAL 64 -7.554 -11.455 -0.695
461 HA VAL 64 HA VAL 64 -6.827 -10.812 -3.366
462 HB VAL 64 HB VAL 64 -7.884 -8.914 -1.278
463 HG11 VAL 64 HG11 VAL 64 -7.086 -7.831 -3.302
464 HG12 VAL 64 HG12 VAL 64 -8.845 -7.742 -3.209
465 HG13 VAL 64 HG13 VAL 64 -8.077 -8.906 -4.288
466 HG21 VAL 64 HG21 VAL 64 -9.309 -10.884 -1.362
467 HG22 VAL 64 HG22 VAL 64 -9.425 -10.746 -3.116
468 HG23 VAL 64 HG23 VAL 64 -10.125 -9.498 -2.086
469 H ALA 65 HN ALA 65 -5.457 -10.152 -0.235
470 HA ALA 65 HA ALA 65 -3.758 -8.010 -0.865
471 HB1 ALA 65 HB1 ALA 65 -2.466 -8.696 1.096
472 HB2 ALA 65 HB2 ALA 65 -3.329 -10.235 1.124
473 HB3 ALA 65 HB3 ALA 65 -4.198 -8.730 1.424
474 H GLY 66 HN GLY 66 -3.449 -11.444 -1.388
475 HA2 GLY 66 HA2 GLY 66 -0.661 -11.183 -2.204
476 HA3 GLY 66 HA1 GLY 66 -1.561 -12.682 -2.052
477 H ARG 67 HN ARG 67 -3.299 -10.330 -3.730
478 HA ARG 67 HA ARG 67 -2.853 -11.773 -6.220
479 HB2 ARG 67 HB2 ARG 67 -4.883 -9.652 -5.498
480 HB3 ARG 67 HB1 ARG 67 -4.820 -10.503 -7.033
481 HG2 ARG 67 HG2 ARG 67 -5.286 -11.797 -4.355
482 HG3 ARG 67 HG1 ARG 67 -6.542 -11.379 -5.519
483 HD2 ARG 67 HD2 ARG 67 -5.629 -12.907 -7.129
484 HD3 ARG 67 HD1 ARG 67 -4.248 -13.241 -6.089
485 HE ARG 67 HE ARG 67 -6.461 -13.906 -4.591
486 HH11 ARG 67 HH11 ARG 67 -5.220 -14.855 -7.723
487 HH12 ARG 67 HH12 ARG 67 -5.755 -16.503 -7.584
488 HH21 ARG 67 HH21 ARG 67 -7.182 -16.072 -4.394
489 HH22 ARG 67 HH22 ARG 67 -6.904 -17.184 -5.705
490 H VAL 68 HN VAL 68 -2.111 -8.741 -4.734
491 HA VAL 68 HA VAL 68 -1.465 -7.512 -7.305
492 HB VAL 68 HB VAL 68 -1.075 -5.446 -6.034
493 HG11 VAL 68 HG11 VAL 68 -3.712 -6.785 -5.455
494 HG12 VAL 68 HG12 VAL 68 -3.286 -5.884 -6.911
495 HG13 VAL 68 HG13 VAL 68 -3.404 -5.049 -5.362
496 HG21 VAL 68 HG21 VAL 68 -1.689 -5.338 -3.647
497 HG22 VAL 68 HG22 VAL 68 -0.291 -6.373 -3.938
498 HG23 VAL 68 HG23 VAL 68 -1.872 -7.093 -3.634
499 H ASP 69 HN ASP 69 0.579 -6.544 -7.703
500 HA ASP 69 HA ASP 69 2.776 -7.359 -5.931
501 HB2 ASP 69 HB2 ASP 69 4.177 -7.933 -7.843
502 HB3 ASP 69 HB1 ASP 69 2.725 -8.919 -7.848
503 H THR 70 HN THR 70 1.196 -4.967 -7.675
504 HA THR 70 HA THR 70 3.486 -3.155 -7.337
505 HB THR 70 HB THR 70 2.525 -1.848 -9.294
506 HG1 THR 70 HG1 THR 70 1.053 -4.276 -9.540
507 HG21 THR 70 HG21 THR 70 3.601 -3.302 -10.969
508 HG22 THR 70 HG22 THR 70 3.615 -4.621 -9.796
509 HG23 THR 70 HG23 THR 70 4.563 -3.162 -9.496
510 HA PRO 71 HA PRO 71 1.134 -0.788 -4.512
511 HB2 PRO 71 HB2 PRO 71 2.249 1.532 -6.021
512 HB3 PRO 71 HB1 PRO 71 2.247 1.226 -4.282
513 HG2 PRO 71 HG2 PRO 71 4.456 0.840 -5.690
514 HG3 PRO 71 HG1 PRO 71 3.989 -0.320 -4.430
515 HD2 PRO 71 HD2 PRO 71 3.783 -0.562 -7.403
516 HD3 PRO 71 HD1 PRO 71 4.159 -1.801 -6.189
517 H ARG 72 HN ARG 72 1.016 0.447 -7.854
518 HA ARG 72 HA ARG 72 -1.133 2.181 -7.594
519 HB2 ARG 72 HB2 ARG 72 0.184 2.174 -9.600
520 HB3 ARG 72 HB1 ARG 72 -0.285 0.522 -9.971
521 HG2 ARG 72 HG2 ARG 72 -2.605 1.259 -10.278
522 HG3 ARG 72 HG1 ARG 72 -2.111 2.917 -9.934
523 HD2 ARG 72 HD2 ARG 72 -1.055 1.232 -12.191
524 HD3 ARG 72 HD1 ARG 72 -2.324 2.442 -12.342
525 HE ARG 72 HE ARG 72 -0.677 4.120 -11.671
526 HH11 ARG 72 HH11 ARG 72 0.580 1.047 -12.881
527 HH12 ARG 72 HH12 ARG 72 2.101 1.743 -13.370
528 HH21 ARG 72 HH21 ARG 72 1.320 4.997 -12.345
529 HH22 ARG 72 HH22 ARG 72 2.533 3.950 -13.039
530 H GLU 73 HN GLU 73 -1.170 -1.271 -8.357
531 HA GLU 73 HA GLU 73 -3.946 -1.420 -8.859
532 HB2 GLU 73 HB2 GLU 73 -2.305 -3.737 -7.872
533 HB3 GLU 73 HB1 GLU 73 -3.663 -3.750 -8.988
534 HG2 GLU 73 HG2 GLU 73 -0.888 -2.722 -9.541
535 HG3 GLU 73 HG1 GLU 73 -1.622 -4.189 -10.180
536 H LEU 74 HN LEU 74 -1.975 -1.893 -5.993
537 HA LEU 74 HA LEU 74 -3.997 -2.886 -4.286
538 HB2 LEU 74 HB2 LEU 74 -1.471 -2.936 -3.965
539 HB3 LEU 74 HB1 LEU 74 -1.584 -1.258 -3.483
540 HG LEU 74 HG LEU 74 -1.435 -2.983 -1.621
541 HD11 LEU 74 HD11 LEU 74 -3.788 -1.099 -1.599
542 HD12 LEU 74 HD12 LEU 74 -2.120 -0.686 -1.196
543 HD13 LEU 74 HD13 LEU 74 -3.019 -1.815 -0.183
544 HD21 LEU 74 HD21 LEU 74 -4.298 -3.470 -2.428
545 HD22 LEU 74 HD22 LEU 74 -3.518 -4.081 -0.969
546 HD23 LEU 74 HD23 LEU 74 -2.973 -4.626 -2.557
547 H LEU 75 HN LEU 75 -2.740 0.365 -4.889
548 HA LEU 75 HA LEU 75 -4.325 1.783 -3.075
549 HB2 LEU 75 HB2 LEU 75 -2.319 2.529 -4.522
550 HB3 LEU 75 HB1 LEU 75 -3.505 2.849 -5.768
551 HG LEU 75 HG LEU 75 -3.730 4.127 -3.053
552 HD11 LEU 75 HD11 LEU 75 -2.224 5.185 -5.443
553 HD12 LEU 75 HD12 LEU 75 -1.493 4.627 -3.939
554 HD13 LEU 75 HD13 LEU 75 -2.533 6.054 -3.941
555 HD21 LEU 75 HD21 LEU 75 -4.990 5.792 -4.238
556 HD22 LEU 75 HD22 LEU 75 -5.665 4.197 -4.575
557 HD23 LEU 75 HD23 LEU 75 -4.657 5.000 -5.780
558 H ASP 76 HN ASP 76 -4.914 1.055 -6.509
559 HA ASP 76 HA ASP 76 -7.436 2.326 -6.667
560 HB2 ASP 76 HB2 ASP 76 -6.057 1.783 -8.641
561 HB3 ASP 76 HB1 ASP 76 -6.317 0.068 -8.345
562 H LEU 77 HN LEU 77 -6.430 -0.886 -5.748
563 HA LEU 77 HA LEU 77 -8.860 -2.246 -5.918
564 HB2 LEU 77 HB2 LEU 77 -6.779 -3.422 -5.645
565 HB3 LEU 77 HB1 LEU 77 -6.465 -2.616 -4.121
566 HG LEU 77 HG LEU 77 -8.463 -3.801 -3.174
567 HD11 LEU 77 HD11 LEU 77 -9.621 -4.313 -5.241
568 HD12 LEU 77 HD12 LEU 77 -9.259 -5.794 -4.353
569 HD13 LEU 77 HD13 LEU 77 -8.285 -5.344 -5.753
570 HD21 LEU 77 HD21 LEU 77 -6.199 -5.496 -4.222
571 HD22 LEU 77 HD22 LEU 77 -7.287 -5.935 -2.906
572 HD23 LEU 77 HD23 LEU 77 -6.198 -4.559 -2.728
573 H ILE 78 HN ILE 78 -7.362 -0.680 -3.079
574 HA ILE 78 HA ILE 78 -9.491 -1.262 -1.320
575 HB ILE 78 HB ILE 78 -7.443 0.951 -1.118
576 HG12 ILE 78 HG12 ILE 78 -7.478 -1.869 -0.023
577 HG13 ILE 78 HG11 ILE 78 -6.415 -1.254 -1.284
578 HG21 ILE 78 HG21 ILE 78 -7.944 0.957 1.267
579 HG22 ILE 78 HG22 ILE 78 -9.178 -0.278 1.022
580 HG23 ILE 78 HG23 ILE 78 -9.388 1.330 0.326
581 HD11 ILE 78 HD11 ILE 78 -6.433 -0.435 1.613
582 HD12 ILE 78 HD12 ILE 78 -5.414 0.282 0.363
583 HD13 ILE 78 HD13 ILE 78 -5.219 -1.417 0.792
584 H ASN 79 HN ASN 79 -8.833 1.487 -3.420
585 HA ASN 79 HA ASN 79 -10.881 3.160 -2.413
586 HB2 ASN 79 HB2 ASN 79 -9.355 3.123 -5.005
587 HB3 ASN 79 HB1 ASN 79 -10.665 4.271 -4.735
588 HD21 ASN 79 HD21 ASN 79 -7.818 4.762 -5.095
589 HD22 ASN 79 HD22 ASN 79 -7.281 5.605 -3.683
590 H GLY 80 HN GLY 80 -10.897 0.509 -4.667
591 HA2 GLY 80 HA2 GLY 80 -13.346 0.968 -5.945
592 HA3 GLY 80 HA1 GLY 80 -12.667 -0.620 -5.614
593 H ALA 81 HN ALA 81 -12.643 -0.430 -2.781
594 HA ALA 81 HA ALA 81 -15.349 -1.189 -2.242
595 HB1 ALA 81 HB1 ALA 81 -14.539 -1.643 0.025
596 HB2 ALA 81 HB2 ALA 81 -13.010 -0.854 -0.364
597 HB3 ALA 81 HB3 ALA 81 -13.474 -2.339 -1.196
598 H LEU 82 HN LEU 82 -13.458 1.687 -1.796
599 HA LEU 82 HA LEU 82 -15.284 2.892 0.085
600 HB2 LEU 82 HB2 LEU 82 -12.988 4.077 -1.479
601 HB3 LEU 82 HB1 LEU 82 -13.874 4.900 -0.212
602 HG LEU 82 HG LEU 82 -12.207 2.408 0.185
603 HD11 LEU 82 HD11 LEU 82 -10.659 3.906 1.363
604 HD12 LEU 82 HD12 LEU 82 -11.641 5.291 0.878
605 HD13 LEU 82 HD13 LEU 82 -10.814 4.325 -0.343
606 HD21 LEU 82 HD21 LEU 82 -13.558 4.225 2.180
607 HD22 LEU 82 HD22 LEU 82 -12.559 2.819 2.555
608 HD23 LEU 82 HD23 LEU 82 -14.103 2.611 1.731
609 H ALA 83 HN ALA 83 -14.655 3.028 -3.366
610 HA ALA 83 HA ALA 83 -16.163 5.346 -3.944
611 HB1 ALA 83 HB1 ALA 83 -15.539 3.035 -5.775
612 HB2 ALA 83 HB2 ALA 83 -14.469 4.399 -5.458
613 HB3 ALA 83 HB3 ALA 83 -16.018 4.661 -6.261
614 H GLU 84 HN GLU 84 -17.072 1.998 -3.521
615 HA GLU 84 HA GLU 84 -19.762 2.519 -4.496
616 HB2 GLU 84 HB2 GLU 84 -18.425 0.024 -3.451
617 HB3 GLU 84 HB1 GLU 84 -20.130 0.095 -3.871
618 HG2 GLU 84 HG2 GLU 84 -19.440 0.824 -6.168
619 HG3 GLU 84 HG1 GLU 84 -17.775 0.468 -5.706
620 H ALA 85 HN ALA 85 -18.201 3.191 -1.720
621 HA ALA 85 HA ALA 85 -20.432 2.488 0.048
622 HB1 ALA 85 HB1 ALA 85 -18.187 1.881 0.819
623 HB2 ALA 85 HB2 ALA 85 -18.931 3.068 1.890
624 HB3 ALA 85 HB3 ALA 85 -17.699 3.575 0.734
625 H ALA 86 HN ALA 86 -18.256 5.307 -0.308
626 HA ALA 86 HA ALA 86 -20.619 7.041 -0.081
627 HB1 ALA 86 HB1 ALA 86 -18.031 7.410 1.426
628 HB2 ALA 86 HB2 ALA 86 -19.576 6.916 2.120
629 HB3 ALA 86 HB3 ALA 86 -19.393 8.527 1.426
630 H28 SXO 87 H28B SXO 87 5.815 -11.712 6.470
631 H28A SXO 87 H28A SXO 87 6.710 -12.798 7.539
632 H30 SXO 87 H30A SXO 87 3.112 -13.171 8.345
633 H30A SXO 87 H30C SXO 87 4.690 -12.804 9.033
634 H30B SXO 87 H30B SXO 87 3.960 -11.698 7.867
635 H31 SXO 87 H31A SXO 87 3.608 -12.499 5.493
636 H31A SXO 87 H31B SXO 87 2.910 -14.019 6.043
637 H31B SXO 87 H31C SXO 87 4.320 -14.033 4.983
638 H32 SXO 87 H32A SXO 87 5.567 -14.925 8.412
639 HO33 SXO 87 H33A SXO 87 6.350 -14.851 5.955
640 HN36 SXO 87 H36A SXO 87 3.113 -14.670 9.032
641 H37 SXO 87 H37A SXO 87 1.863 -17.233 8.687
642 H37A SXO 87 H37B SXO 87 1.301 -15.905 9.703
643 H38 SXO 87 H38B SXO 87 -0.288 -16.398 7.925
644 H38A SXO 87 H38A SXO 87 0.962 -16.128 6.716
645 HN41 SXO 87 H41A SXO 87 -0.626 -14.675 5.875
646 H42 SXO 87 H42A SXO 87 -1.379 -12.247 7.155
647 H42A SXO 87 H42B SXO 87 -0.017 -12.015 6.058
648 H43 SXO 87 H43B SXO 87 -2.707 -13.170 5.325
649 H43A SXO 87 H43A SXO 87 -2.098 -11.567 4.894
650 H2 SXO 87 H2A SXO 87 -1.661 -10.695 3.279
651 H2A SXO 87 H2B SXO 87 -0.371 -10.241 2.168
652 H3 SXO 87 H3B SXO 87 -0.185 -9.955 5.161
653 H3A SXO 87 H3A SXO 87 0.937 -9.328 3.949
654 H4 SXO 87 H4A SXO 87 -0.632 -7.629 4.897
655 H4A SXO 87 H4B SXO 87 -1.960 -8.519 4.153
656 H5 SXO 87 H5B SXO 87 0.280 -7.043 2.801
657 H5A SXO 87 H5A SXO 87 -0.708 -8.233 1.946
658 H6 SXO 87 H6A SXO 87 -1.847 -5.865 3.427
659 H6A SXO 87 H6B SXO 87 -2.698 -6.970 2.351
660 H7 SXO 87 H7A SXO 87 -2.293 -4.955 1.133
661 H7A SXO 87 H7B SXO 87 -1.187 -6.185 0.502
662 H8 SXO 87 H8C SXO 87 -0.066 -4.029 0.827
663 H8A SXO 87 H8A SXO 87 0.612 -5.277 1.875
664 H8B SXO 87 H8B SXO 87 -0.491 -4.070 2.538
Start of MODEL 5
1 H1 MET 1 HT1 MET 1 -14.831 16.878 5.838
2 H2 MET 1 HT2 MET 1 -13.293 16.249 5.510
3 H3 MET 1 HT3 MET 1 -14.240 15.572 6.742
4 HA MET 1 HA MET 1 -15.847 14.801 5.162
5 HB2 MET 1 HB2 MET 1 -13.946 15.958 3.111
6 HB3 MET 1 HB1 MET 1 -15.369 14.991 2.748
7 HG2 MET 1 HG2 MET 1 -16.809 16.703 3.675
8 HG3 MET 1 HG1 MET 1 -15.405 17.654 4.151
9 HE1 MET 1 HE1 MET 1 -16.023 15.631 0.820
10 HE2 MET 1 HE2 MET 1 -16.674 16.900 -0.221
11 HE3 MET 1 HE3 MET 1 -17.594 16.353 1.178
12 H ALA 2 HN ALA 2 -15.242 12.956 3.426
13 HA ALA 2 HA ALA 2 -13.255 11.347 4.834
14 HB1 ALA 2 HB1 ALA 2 -15.297 10.607 2.740
15 HB2 ALA 2 HB2 ALA 2 -15.429 10.350 4.479
16 HB3 ALA 2 HB3 ALA 2 -14.218 9.470 3.545
17 H THR 3 HN THR 3 -11.369 10.670 3.971
18 HA THR 3 HA THR 3 -10.805 11.556 1.231
19 HB THR 3 HB THR 3 -9.359 12.646 2.865
20 HG1 THR 3 HG1 THR 3 -7.765 10.688 1.562
21 HG21 THR 3 HG21 THR 3 -8.442 9.865 3.609
22 HG22 THR 3 HG22 THR 3 -9.424 10.926 4.622
23 HG23 THR 3 HG23 THR 3 -7.767 11.379 4.214
24 H LEU 4 HN LEU 4 -10.228 10.128 -0.271
25 HA LEU 4 HA LEU 4 -10.248 7.308 0.346
26 HB2 LEU 4 HB2 LEU 4 -9.726 8.773 -2.243
27 HB3 LEU 4 HB1 LEU 4 -9.886 7.034 -2.088
28 HG LEU 4 HG LEU 4 -12.052 9.067 -1.547
29 HD11 LEU 4 HD11 LEU 4 -13.132 8.019 -3.507
30 HD12 LEU 4 HD12 LEU 4 -11.661 7.082 -3.779
31 HD13 LEU 4 HD13 LEU 4 -11.622 8.841 -3.902
32 HD21 LEU 4 HD21 LEU 4 -13.520 7.119 -1.279
33 HD22 LEU 4 HD22 LEU 4 -12.259 7.171 -0.048
34 HD23 LEU 4 HD23 LEU 4 -12.119 6.054 -1.408
35 H LEU 5 HN LEU 5 -8.396 6.103 -1.083
36 HA LEU 5 HA LEU 5 -5.951 6.797 0.306
37 HB2 LEU 5 HB2 LEU 5 -6.931 4.439 -0.081
38 HB3 LEU 5 HB1 LEU 5 -6.313 4.586 -1.713
39 HG LEU 5 HG LEU 5 -4.556 4.799 0.735
40 HD11 LEU 5 HD11 LEU 5 -5.150 2.385 -0.969
41 HD12 LEU 5 HD12 LEU 5 -5.603 2.611 0.720
42 HD13 LEU 5 HD13 LEU 5 -3.903 2.483 0.272
43 HD21 LEU 5 HD21 LEU 5 -3.929 4.276 -2.168
44 HD22 LEU 5 HD22 LEU 5 -2.764 4.307 -0.844
45 HD23 LEU 5 HD23 LEU 5 -3.627 5.778 -1.294
46 H THR 6 HN THR 6 -4.443 8.078 -0.536
47 HA THR 6 HA THR 6 -4.481 8.547 -3.447
48 HB THR 6 HB THR 6 -3.524 10.739 -3.040
49 HG1 THR 6 HG1 THR 6 -3.826 10.499 -0.243
50 HG21 THR 6 HG21 THR 6 -5.381 11.797 -1.844
51 HG22 THR 6 HG22 THR 6 -5.875 10.223 -1.221
52 HG23 THR 6 HG23 THR 6 -5.954 10.550 -2.952
53 H THR 7 HN THR 7 -2.290 9.163 -4.369
54 HA THR 7 HA THR 7 -0.343 7.240 -3.794
55 HB THR 7 HB THR 7 1.240 8.870 -5.035
56 HG1 THR 7 HG1 THR 7 -0.755 10.521 -4.657
57 HG21 THR 7 HG21 THR 7 0.250 8.245 -7.189
58 HG22 THR 7 HG22 THR 7 -1.247 7.797 -6.369
59 HG23 THR 7 HG23 THR 7 0.238 6.896 -6.052
60 H ASP 8 HN ASP 8 -0.808 10.481 -2.489
61 HA ASP 8 HA ASP 8 1.741 10.582 -1.194
62 HB2 ASP 8 HB2 ASP 8 0.475 12.636 -1.710
63 HB3 ASP 8 HB1 ASP 8 -0.775 12.144 -0.569
64 H ASP 9 HN ASP 9 -1.545 9.769 -0.117
65 HA ASP 9 HA ASP 9 -0.947 9.238 2.565
66 HB2 ASP 9 HB2 ASP 9 -3.071 8.234 0.698
67 HB3 ASP 9 HB1 ASP 9 -2.925 7.554 2.315
68 H LEU 10 HN LEU 10 -1.053 7.027 -0.211
69 HA LEU 10 HA LEU 10 -0.240 4.723 1.165
70 HB2 LEU 10 HB2 LEU 10 -1.209 4.747 -1.113
71 HB3 LEU 10 HB1 LEU 10 0.272 5.462 -1.719
72 HG LEU 10 HG LEU 10 1.510 3.422 -1.069
73 HD11 LEU 10 HD11 LEU 10 -1.212 2.296 -0.408
74 HD12 LEU 10 HD12 LEU 10 0.040 2.702 0.768
75 HD13 LEU 10 HD13 LEU 10 0.318 1.417 -0.408
76 HD21 LEU 10 HD21 LEU 10 -0.886 2.934 -2.830
77 HD22 LEU 10 HD22 LEU 10 0.601 1.985 -2.820
78 HD23 LEU 10 HD23 LEU 10 0.633 3.674 -3.326
79 H ARG 11 HN ARG 11 1.637 7.159 -0.596
80 HA ARG 11 HA ARG 11 4.177 6.095 -0.347
81 HB2 ARG 11 HB2 ARG 11 3.656 8.064 -1.711
82 HB3 ARG 11 HB1 ARG 11 3.348 9.000 -0.255
83 HG2 ARG 11 HG2 ARG 11 5.638 8.908 0.376
84 HG3 ARG 11 HG1 ARG 11 6.002 7.756 -0.912
85 HD2 ARG 11 HD2 ARG 11 6.728 9.982 -1.534
86 HD3 ARG 11 HD1 ARG 11 5.419 9.444 -2.579
87 HE ARG 11 HE ARG 11 4.211 10.881 -0.575
88 HH11 ARG 11 HH11 ARG 11 6.623 11.506 -3.061
89 HH12 ARG 11 HH12 ARG 11 6.241 13.201 -3.164
90 HH21 ARG 11 HH21 ARG 11 3.706 13.113 -0.747
91 HH22 ARG 11 HH22 ARG 11 4.610 14.101 -1.864
92 H ARG 12 HN ARG 12 2.465 8.261 1.903
93 HA ARG 12 HA ARG 12 4.578 8.341 3.799
94 HB2 ARG 12 HB2 ARG 12 1.634 8.945 4.114
95 HB3 ARG 12 HB1 ARG 12 2.850 9.265 5.341
96 HG2 ARG 12 HG2 ARG 12 4.014 10.749 3.722
97 HG3 ARG 12 HG1 ARG 12 2.666 10.512 2.607
98 HD2 ARG 12 HD2 ARG 12 2.354 12.578 3.823
99 HD3 ARG 12 HD1 ARG 12 1.134 11.409 4.329
100 HE ARG 12 HE ARG 12 3.300 11.186 6.067
101 HH11 ARG 12 HH11 ARG 12 0.856 13.538 5.193
102 HH12 ARG 12 HH12 ARG 12 0.852 14.290 6.760
103 HH21 ARG 12 HH21 ARG 12 3.295 12.194 8.134
104 HH22 ARG 12 HH22 ARG 12 2.221 13.534 8.425
105 H ALA 13 HN ALA 13 1.760 6.290 3.381
106 HA ALA 13 HA ALA 13 1.709 5.062 5.886
107 HB1 ALA 13 HB1 ALA 13 0.951 3.891 3.206
108 HB2 ALA 13 HB2 ALA 13 -0.095 4.855 4.255
109 HB3 ALA 13 HB3 ALA 13 0.460 3.267 4.783
110 H LEU 14 HN LEU 14 3.488 4.216 2.954
111 HA LEU 14 HA LEU 14 4.628 1.834 3.962
112 HB2 LEU 14 HB2 LEU 14 5.468 3.689 1.744
113 HB3 LEU 14 HB1 LEU 14 6.247 2.152 2.074
114 HG LEU 14 HG LEU 14 3.337 1.962 1.764
115 HD11 LEU 14 HD11 LEU 14 5.055 2.893 -0.526
116 HD12 LEU 14 HD12 LEU 14 3.618 3.675 0.137
117 HD13 LEU 14 HD13 LEU 14 3.471 2.141 -0.721
118 HD21 LEU 14 HD21 LEU 14 3.957 0.041 0.402
119 HD22 LEU 14 HD22 LEU 14 4.831 0.024 1.931
120 HD23 LEU 14 HD23 LEU 14 5.649 0.530 0.453
121 H VAL 15 HN VAL 15 5.634 5.204 4.016
122 HA VAL 15 HA VAL 15 8.242 4.708 5.075
123 HB VAL 15 HB VAL 15 6.609 7.250 5.171
124 HG11 VAL 15 HG11 VAL 15 9.571 6.809 5.516
125 HG12 VAL 15 HG12 VAL 15 8.433 7.277 6.779
126 HG13 VAL 15 HG13 VAL 15 8.770 8.377 5.442
127 HG21 VAL 15 HG21 VAL 15 8.669 6.345 3.160
128 HG22 VAL 15 HG22 VAL 15 7.873 7.918 3.183
129 HG23 VAL 15 HG23 VAL 15 6.932 6.458 2.882
130 H GLU 16 HN GLU 16 5.094 5.480 6.470
131 HA GLU 16 HA GLU 16 5.863 5.764 9.152
132 HB2 GLU 16 HB2 GLU 16 3.290 4.739 7.936
133 HB3 GLU 16 HB1 GLU 16 3.492 5.062 9.652
134 HG2 GLU 16 HG2 GLU 16 3.744 7.373 9.296
135 HG3 GLU 16 HG1 GLU 16 3.963 7.164 7.560
136 H SER 17 HN SER 17 5.288 2.930 7.185
137 HA SER 17 HA SER 17 5.446 1.094 9.411
138 HB2 SER 17 HB2 SER 17 5.557 0.495 6.449
139 HB3 SER 17 HB1 SER 17 5.144 -0.627 7.748
140 HG SER 17 HG SER 17 3.657 1.561 6.751
141 H ALA 18 HN ALA 18 7.428 1.757 6.525
142 HA ALA 18 HA ALA 18 9.772 0.802 8.025
143 HB1 ALA 18 HB1 ALA 18 9.259 0.422 5.075
144 HB2 ALA 18 HB2 ALA 18 9.112 -0.831 6.309
145 HB3 ALA 18 HB3 ALA 18 10.685 -0.111 5.967
146 H GLY 19 HN GLY 19 10.398 2.855 8.632
147 HA2 GLY 19 HA2 GLY 19 11.075 4.688 6.418
148 HA3 GLY 19 HA1 GLY 19 10.650 5.213 8.041
149 H GLU 20 HN GLU 20 13.116 3.667 6.079
150 HA GLU 20 HA GLU 20 15.044 4.252 8.220
151 HB2 GLU 20 HB2 GLU 20 16.508 2.533 7.121
152 HB3 GLU 20 HB1 GLU 20 15.044 1.904 7.853
153 HG2 GLU 20 HG2 GLU 20 14.976 0.757 5.915
154 HG3 GLU 20 HG1 GLU 20 14.123 2.207 5.392
155 H THR 21 HN THR 21 17.329 4.614 7.239
156 HA THR 21 HA THR 21 16.975 6.731 5.219
157 HB THR 21 HB THR 21 19.190 6.621 7.238
158 HG1 THR 21 HG1 THR 21 16.510 7.212 7.616
159 HG21 THR 21 HG21 THR 21 17.891 8.889 5.719
160 HG22 THR 21 HG22 THR 21 19.476 8.187 5.387
161 HG23 THR 21 HG23 THR 21 19.201 9.068 6.890
162 H ASP 22 HN ASP 22 17.345 4.398 4.077
163 HA ASP 22 HA ASP 22 20.119 4.579 3.139
164 HB2 ASP 22 HB2 ASP 22 19.959 2.637 4.652
165 HB3 ASP 22 HB1 ASP 22 18.640 1.999 3.677
166 H GLY 23 HN GLY 23 17.082 2.818 2.408
167 HA2 GLY 23 HA2 GLY 23 17.467 3.639 -0.412
168 HA3 GLY 23 HA1 GLY 23 17.097 1.975 0.007
169 H THR 24 HN THR 24 15.497 4.101 2.058
170 HA THR 24 HA THR 24 12.969 3.451 0.853
171 HB THR 24 HB THR 24 13.486 5.325 3.168
172 HG1 THR 24 HG1 THR 24 14.365 3.246 3.595
173 HG21 THR 24 HG21 THR 24 11.035 3.723 2.415
174 HG22 THR 24 HG22 THR 24 11.221 5.467 2.225
175 HG23 THR 24 HG23 THR 24 11.205 4.751 3.836
176 H ASP 25 HN ASP 25 13.309 4.552 -1.222
177 HA ASP 25 HA ASP 25 12.669 7.420 -0.989
178 HB2 ASP 25 HB2 ASP 25 14.857 7.131 -2.037
179 HB3 ASP 25 HB1 ASP 25 14.159 6.049 -3.238
180 H LEU 26 HN LEU 26 10.583 7.660 -1.316
181 HA LEU 26 HA LEU 26 9.382 6.330 -3.654
182 HB2 LEU 26 HB2 LEU 26 8.024 7.204 -1.098
183 HB3 LEU 26 HB1 LEU 26 7.206 6.532 -2.494
184 HG LEU 26 HG LEU 26 9.206 5.067 -0.761
185 HD11 LEU 26 HD11 LEU 26 7.256 3.766 -0.046
186 HD12 LEU 26 HD12 LEU 26 6.209 4.832 -0.983
187 HD13 LEU 26 HD13 LEU 26 7.111 5.468 0.394
188 HD21 LEU 26 HD21 LEU 26 8.533 3.092 -2.033
189 HD22 LEU 26 HD22 LEU 26 9.259 4.305 -3.086
190 HD23 LEU 26 HD23 LEU 26 7.508 4.092 -3.060
191 H SER 27 HN SER 27 10.852 8.668 -3.815
192 HA SER 27 HA SER 27 9.582 11.067 -3.297
193 HB2 SER 27 HB2 SER 27 11.112 11.925 -5.187
194 HB3 SER 27 HB1 SER 27 11.875 11.158 -3.793
195 HG SER 27 HG SER 27 12.352 9.403 -4.981
196 H GLY 28 HN GLY 28 9.856 9.657 -6.571
197 HA2 GLY 28 HA2 GLY 28 7.652 11.369 -7.411
198 HA3 GLY 28 HA1 GLY 28 8.697 10.426 -8.465
199 H ASP 29 HN ASP 29 7.935 8.582 -9.265
200 HA ASP 29 HA ASP 29 5.379 7.602 -8.201
201 HB2 ASP 29 HB2 ASP 29 5.220 8.279 -10.523
202 HB3 ASP 29 HB1 ASP 29 6.598 7.268 -10.949
203 H PHE 30 HN PHE 30 5.030 5.422 -7.930
204 HA PHE 30 HA PHE 30 7.272 3.581 -8.129
205 HB2 PHE 30 HB2 PHE 30 6.914 2.830 -5.757
206 HB3 PHE 30 HB1 PHE 30 7.593 4.449 -5.903
207 HD1 PHE 30 HD2 PHE 30 6.248 6.415 -5.355
208 HD2 PHE 30 HD1 PHE 30 4.708 2.477 -4.866
209 HE1 PHE 30 HE2 PHE 30 4.436 7.298 -3.942
210 HE2 PHE 30 HE1 PHE 30 2.899 3.358 -3.456
211 HZ PHE 30 HZ PHE 30 2.757 5.773 -3.000
212 H LEU 31 HN LEU 31 4.085 4.283 -8.596
213 HA LEU 31 HA LEU 31 2.693 2.047 -7.622
214 HB2 LEU 31 HB2 LEU 31 2.054 3.738 -10.032
215 HB3 LEU 31 HB1 LEU 31 0.946 2.623 -9.255
216 HG LEU 31 HG LEU 31 2.029 5.217 -8.161
217 HD11 LEU 31 HD11 LEU 31 -0.760 4.219 -8.705
218 HD12 LEU 31 HD12 LEU 31 0.128 5.410 -9.658
219 HD13 LEU 31 HD13 LEU 31 -0.343 5.780 -8.000
220 HD21 LEU 31 HD21 LEU 31 2.093 3.630 -6.345
221 HD22 LEU 31 HD22 LEU 31 0.461 3.078 -6.724
222 HD23 LEU 31 HD23 LEU 31 0.720 4.717 -6.124
223 H ASP 32 HN ASP 32 4.766 2.351 -10.349
224 HA ASP 32 HA ASP 32 3.631 0.038 -11.712
225 HB2 ASP 32 HB2 ASP 32 4.263 2.005 -13.040
226 HB3 ASP 32 HB1 ASP 32 5.922 1.866 -12.473
227 H LEU 33 HN LEU 33 6.054 0.703 -9.442
228 HA LEU 33 HA LEU 33 7.802 -1.473 -10.267
229 HB2 LEU 33 HB2 LEU 33 7.967 0.555 -8.045
230 HB3 LEU 33 HB1 LEU 33 9.091 -0.783 -8.176
231 HG LEU 33 HG LEU 33 10.171 1.119 -9.092
232 HD11 LEU 33 HD11 LEU 33 9.130 -0.589 -11.342
233 HD12 LEU 33 HD12 LEU 33 10.548 -0.907 -10.344
234 HD13 LEU 33 HD13 LEU 33 10.531 0.479 -11.435
235 HD21 LEU 33 HD21 LEU 33 8.280 2.569 -9.454
236 HD22 LEU 33 HD22 LEU 33 7.709 1.550 -10.775
237 HD23 LEU 33 HD23 LEU 33 9.222 2.444 -10.941
238 H ARG 34 HN ARG 34 7.923 -3.427 -9.310
239 HA ARG 34 HA ARG 34 5.731 -4.286 -7.702
240 HB2 ARG 34 HB2 ARG 34 8.298 -5.756 -8.326
241 HB3 ARG 34 HB1 ARG 34 6.795 -6.474 -7.756
242 HG2 ARG 34 HG2 ARG 34 5.689 -5.815 -9.831
243 HG3 ARG 34 HG1 ARG 34 7.189 -5.077 -10.397
244 HD2 ARG 34 HD2 ARG 34 7.089 -7.194 -11.425
245 HD3 ARG 34 HD1 ARG 34 8.257 -7.352 -10.113
246 HE ARG 34 HE ARG 34 5.845 -8.134 -9.044
247 HH11 ARG 34 HH11 ARG 34 7.905 -9.154 -11.688
248 HH12 ARG 34 HH12 ARG 34 7.331 -10.792 -11.662
249 HH21 ARG 34 HH21 ARG 34 5.093 -10.283 -9.008
250 HH22 ARG 34 HH22 ARG 34 5.744 -11.437 -10.149
251 H PHE 35 HN PHE 35 5.680 -4.893 -5.556
252 HA PHE 35 HA PHE 35 7.137 -3.422 -3.712
253 HB2 PHE 35 HB2 PHE 35 5.746 -6.074 -3.273
254 HB3 PHE 35 HB1 PHE 35 6.258 -4.977 -1.997
255 HD1 PHE 35 HD2 PHE 35 5.355 -2.484 -2.337
256 HD2 PHE 35 HD1 PHE 35 3.541 -6.002 -3.894
257 HE1 PHE 35 HE2 PHE 35 3.205 -1.301 -2.492
258 HE2 PHE 35 HE1 PHE 35 1.385 -4.824 -4.058
259 HZ PHE 35 HZ PHE 35 1.193 -2.510 -3.293
260 H GLU 36 HN GLU 36 7.739 -6.658 -4.953
261 HA GLU 36 HA GLU 36 9.705 -7.537 -3.198
262 HB2 GLU 36 HB2 GLU 36 9.673 -8.095 -6.167
263 HB3 GLU 36 HB1 GLU 36 10.314 -9.123 -4.895
264 HG2 GLU 36 HG2 GLU 36 7.403 -8.420 -5.171
265 HG3 GLU 36 HG1 GLU 36 8.138 -9.858 -5.872
266 H ASP 37 HN ASP 37 9.932 -5.294 -5.876
267 HA ASP 37 HA ASP 37 12.828 -5.454 -5.980
268 HB2 ASP 37 HB2 ASP 37 10.725 -4.107 -7.610
269 HB3 ASP 37 HB1 ASP 37 12.366 -3.467 -7.662
270 H ILE 38 HN ILE 38 10.375 -3.263 -4.754
271 HA ILE 38 HA ILE 38 12.307 -1.120 -4.434
272 HB ILE 38 HB ILE 38 10.331 0.125 -3.451
273 HG12 ILE 38 HG12 ILE 38 8.821 -2.252 -4.569
274 HG13 ILE 38 HG11 ILE 38 9.000 -1.881 -2.858
275 HG21 ILE 38 HG21 ILE 38 10.129 -0.918 -6.267
276 HG22 ILE 38 HG22 ILE 38 11.132 0.430 -5.732
277 HG23 ILE 38 HG23 ILE 38 9.373 0.554 -5.657
278 HD11 ILE 38 HD11 ILE 38 7.593 -0.179 -4.904
279 HD12 ILE 38 HD12 ILE 38 7.786 0.213 -3.195
280 HD13 ILE 38 HD13 ILE 38 6.829 -1.187 -3.674
281 H GLY 39 HN GLY 39 12.365 -3.665 -2.809
282 HA2 GLY 39 HA2 GLY 39 13.388 -4.109 -0.815
283 HA3 GLY 39 HA1 GLY 39 13.561 -2.379 -0.586
284 H TYR 40 HN TYR 40 10.462 -4.051 -0.947
285 HA TYR 40 HA TYR 40 9.980 -3.495 1.899
286 HB2 TYR 40 HB2 TYR 40 8.089 -3.506 -0.435
287 HB3 TYR 40 HB1 TYR 40 7.507 -3.675 1.220
288 HD1 TYR 40 HD2 TYR 40 8.126 -1.864 2.892
289 HD2 TYR 40 HD1 TYR 40 8.571 -1.371 -1.307
290 HE1 TYR 40 HE2 TYR 40 8.217 0.570 3.202
291 HE2 TYR 40 HE1 TYR 40 8.670 1.067 -1.017
292 HH TYR 40 HH TYR 40 9.089 2.542 2.025
293 H ASP 41 HN ASP 41 10.203 -5.176 3.096
294 HA ASP 41 HA ASP 41 10.069 -7.845 2.050
295 HB2 ASP 41 HB2 ASP 41 11.567 -6.753 3.985
296 HB3 ASP 41 HB1 ASP 41 10.245 -7.353 4.983
297 H SER 42 HN SER 42 8.849 -9.539 3.464
298 HA SER 42 HA SER 42 6.154 -9.218 2.938
299 HB2 SER 42 HB2 SER 42 6.197 -11.117 4.957
300 HB3 SER 42 HB1 SER 42 6.411 -11.425 3.233
301 H LEU 43 HN LEU 43 7.717 -9.017 6.147
302 HA LEU 43 HA LEU 43 5.361 -8.427 7.559
303 HB2 LEU 43 HB2 LEU 43 7.505 -9.177 8.572
304 HB3 LEU 43 HB1 LEU 43 8.175 -7.590 8.248
305 HG LEU 43 HG LEU 43 6.450 -6.599 9.742
306 HD11 LEU 43 HD11 LEU 43 5.241 -8.128 11.258
307 HD12 LEU 43 HD12 LEU 43 5.813 -9.493 10.300
308 HD13 LEU 43 HD13 LEU 43 4.739 -8.295 9.576
309 HD21 LEU 43 HD21 LEU 43 8.696 -7.101 10.563
310 HD22 LEU 43 HD22 LEU 43 8.178 -8.732 10.988
311 HD23 LEU 43 HD23 LEU 43 7.484 -7.342 11.822
312 H ALA 44 HN ALA 44 7.819 -6.289 6.156
313 HA ALA 44 HA ALA 44 6.757 -3.865 7.095
314 HB1 ALA 44 HB1 ALA 44 8.348 -4.345 4.574
315 HB2 ALA 44 HB2 ALA 44 9.025 -4.086 6.182
316 HB3 ALA 44 HB3 ALA 44 8.124 -2.795 5.387
317 H LEU 45 HN LEU 45 6.049 -5.780 4.228
318 HA LEU 45 HA LEU 45 4.450 -3.849 2.922
319 HB2 LEU 45 HB2 LEU 45 5.444 -5.751 1.763
320 HB3 LEU 45 HB1 LEU 45 4.459 -6.858 2.694
321 HG LEU 45 HG LEU 45 2.440 -6.023 1.613
322 HD11 LEU 45 HD11 LEU 45 3.112 -3.705 1.263
323 HD12 LEU 45 HD12 LEU 45 2.586 -4.437 -0.255
324 HD13 LEU 45 HD13 LEU 45 4.307 -4.216 0.070
325 HD21 LEU 45 HD21 LEU 45 4.621 -6.719 -0.349
326 HD22 LEU 45 HD22 LEU 45 2.886 -6.837 -0.649
327 HD23 LEU 45 HD23 LEU 45 3.642 -7.861 0.572
328 H MET 46 HN MET 46 3.637 -6.542 5.108
329 HA MET 46 HA MET 46 0.823 -6.007 4.938
330 HB2 MET 46 HB2 MET 46 0.539 -7.745 6.585
331 HB3 MET 46 HB1 MET 46 1.697 -8.276 5.380
332 HG2 MET 46 HG2 MET 46 2.719 -8.982 7.283
333 HG3 MET 46 HG1 MET 46 3.445 -7.388 7.112
334 HE1 MET 46 HE1 MET 46 -0.251 -8.133 8.265
335 HE2 MET 46 HE2 MET 46 -0.030 -8.302 10.009
336 HE3 MET 46 HE3 MET 46 0.671 -9.490 8.912
337 H GLU 47 HN GLU 47 3.427 -5.002 7.050
338 HA GLU 47 HA GLU 47 1.900 -3.808 9.085
339 HB2 GLU 47 HB2 GLU 47 4.625 -3.289 7.947
340 HB3 GLU 47 HB1 GLU 47 3.955 -2.191 9.148
341 HG2 GLU 47 HG2 GLU 47 4.230 -5.157 9.576
342 HG3 GLU 47 HG1 GLU 47 5.467 -3.984 10.031
343 H THR 48 HN THR 48 2.982 -2.615 5.950
344 HA THR 48 HA THR 48 1.989 -0.005 6.128
345 HB THR 48 HB THR 48 2.178 -1.707 3.635
346 HG1 THR 48 HG1 THR 48 4.197 -1.598 4.726
347 HG21 THR 48 HG21 THR 48 2.460 0.457 2.503
348 HG22 THR 48 HG22 THR 48 2.202 1.281 4.041
349 HG23 THR 48 HG23 THR 48 0.899 0.340 3.316
350 H ALA 49 HN ALA 49 0.483 -3.016 5.036
351 HA ALA 49 HA ALA 49 -1.980 -2.031 4.195
352 HB1 ALA 49 HB1 ALA 49 -2.839 -4.278 4.611
353 HB2 ALA 49 HB2 ALA 49 -1.401 -4.659 5.555
354 HB3 ALA 49 HB3 ALA 49 -1.259 -4.333 3.829
355 H ALA 50 HN ALA 50 -0.876 -2.911 7.446
356 HA ALA 50 HA ALA 50 -3.353 -2.607 8.761
357 HB1 ALA 50 HB1 ALA 50 -1.476 -3.800 9.774
358 HB2 ALA 50 HB2 ALA 50 -2.049 -2.503 10.823
359 HB3 ALA 50 HB3 ALA 50 -0.570 -2.288 9.885
360 H ARG 51 HN ARG 51 -0.729 -0.387 8.031
361 HA ARG 51 HA ARG 51 -1.660 1.846 9.459
362 HB2 ARG 51 HB2 ARG 51 -0.107 1.776 6.864
363 HB3 ARG 51 HB1 ARG 51 -0.272 3.168 7.918
364 HG2 ARG 51 HG2 ARG 51 1.087 0.573 8.613
365 HG3 ARG 51 HG1 ARG 51 1.888 2.085 8.187
366 HD2 ARG 51 HD2 ARG 51 0.061 1.713 10.556
367 HD3 ARG 51 HD1 ARG 51 1.820 1.656 10.629
368 HE ARG 51 HE ARG 51 1.055 4.087 9.446
369 HH11 ARG 51 HH11 ARG 51 0.920 2.484 12.569
370 HH12 ARG 51 HH12 ARG 51 0.925 3.976 13.464
371 HH21 ARG 51 HH21 ARG 51 1.088 6.031 10.613
372 HH22 ARG 51 HH22 ARG 51 1.033 5.985 12.356
373 H LEU 52 HN LEU 52 -2.454 0.593 6.277
374 HA LEU 52 HA LEU 52 -3.999 2.841 5.443
375 HB2 LEU 52 HB2 LEU 52 -4.059 -0.015 4.460
376 HB3 LEU 52 HB1 LEU 52 -4.790 1.354 3.651
377 HG LEU 52 HG LEU 52 -1.825 1.040 4.132
378 HD11 LEU 52 HD11 LEU 52 -2.597 -0.617 2.549
379 HD12 LEU 52 HD12 LEU 52 -1.709 0.654 1.704
380 HD13 LEU 52 HD13 LEU 52 -3.473 0.617 1.643
381 HD21 LEU 52 HD21 LEU 52 -1.668 2.918 2.535
382 HD22 LEU 52 HD22 LEU 52 -2.488 3.358 4.032
383 HD23 LEU 52 HD23 LEU 52 -3.425 3.060 2.567
384 H GLU 53 HN GLU 53 -4.879 -0.411 6.637
385 HA GLU 53 HA GLU 53 -7.648 -0.038 6.634
386 HB2 GLU 53 HB2 GLU 53 -6.038 -1.725 8.559
387 HB3 GLU 53 HB1 GLU 53 -7.755 -1.888 8.229
388 HG2 GLU 53 HG2 GLU 53 -7.179 -2.419 5.865
389 HG3 GLU 53 HG1 GLU 53 -5.483 -2.421 6.338
390 H SER 54 HN SER 54 -5.245 0.647 9.134
391 HA SER 54 HA SER 54 -7.068 1.407 11.147
392 HB2 SER 54 HB2 SER 54 -4.725 0.787 11.594
393 HB3 SER 54 HB1 SER 54 -4.185 2.261 10.791
394 HG SER 54 HG SER 54 -5.819 3.190 12.489
395 H ARG 55 HN ARG 55 -6.010 3.076 8.338
396 HA ARG 55 HA ARG 55 -6.591 5.705 9.449
397 HB2 ARG 55 HB2 ARG 55 -4.622 5.411 8.002
398 HB3 ARG 55 HB1 ARG 55 -5.669 4.915 6.683
399 HG2 ARG 55 HG2 ARG 55 -6.651 7.108 6.561
400 HG3 ARG 55 HG1 ARG 55 -5.784 7.621 8.008
401 HD2 ARG 55 HD2 ARG 55 -4.570 6.875 5.343
402 HD3 ARG 55 HD1 ARG 55 -4.663 8.492 6.049
403 HE ARG 55 HE ARG 55 -3.333 6.722 7.803
404 HH11 ARG 55 HH11 ARG 55 -2.821 8.562 4.856
405 HH12 ARG 55 HH12 ARG 55 -1.097 8.602 5.054
406 HH21 ARG 55 HH21 ARG 55 -1.074 6.804 8.054
407 HH22 ARG 55 HH22 ARG 55 -0.095 7.615 6.874
408 H TYR 56 HN TYR 56 -7.800 3.564 6.878
409 HA TYR 56 HA TYR 56 -9.939 5.475 6.333
410 HB2 TYR 56 HB2 TYR 56 -9.195 2.938 4.865
411 HB3 TYR 56 HB1 TYR 56 -10.359 4.145 4.326
412 HD1 TYR 56 HD2 TYR 56 -9.526 6.476 3.818
413 HD2 TYR 56 HD1 TYR 56 -6.897 3.181 4.384
414 HE1 TYR 56 HE2 TYR 56 -7.731 7.720 2.691
415 HE2 TYR 56 HE1 TYR 56 -5.096 4.419 3.260
416 HH TYR 56 HH TYR 56 -5.339 7.763 2.540
417 H GLY 57 HN GLY 57 -9.425 2.516 7.979
418 HA2 GLY 57 HA2 GLY 57 -10.930 1.349 9.316
419 HA3 GLY 57 HA1 GLY 57 -12.226 2.358 8.690
420 H VAL 58 HN VAL 58 -9.953 0.545 6.725
421 HA VAL 58 HA VAL 58 -12.235 -0.872 5.545
422 HB VAL 58 HB VAL 58 -10.767 -1.278 3.600
423 HG11 VAL 58 HG11 VAL 58 -12.184 0.659 3.536
424 HG12 VAL 58 HG12 VAL 58 -10.622 1.079 2.830
425 HG13 VAL 58 HG13 VAL 58 -11.017 1.595 4.470
426 HG21 VAL 58 HG21 VAL 58 -8.615 -1.299 4.742
427 HG22 VAL 58 HG22 VAL 58 -8.776 0.421 5.099
428 HG23 VAL 58 HG23 VAL 58 -8.613 -0.121 3.428
429 H SER 59 HN SER 59 -11.208 -2.972 4.359
430 HA SER 59 HA SER 59 -9.443 -4.443 6.132
431 HB2 SER 59 HB2 SER 59 -11.113 -6.397 6.061
432 HB3 SER 59 HB1 SER 59 -11.490 -5.061 7.147
433 HG SER 59 HG SER 59 -12.608 -5.600 4.590
434 H ILE 60 HN ILE 60 -8.034 -5.550 4.930
435 HA ILE 60 HA ILE 60 -8.575 -5.776 2.064
436 HB ILE 60 HB ILE 60 -5.995 -6.288 3.549
437 HG12 ILE 60 HG12 ILE 60 -6.925 -3.835 2.035
438 HG13 ILE 60 HG11 ILE 60 -6.746 -3.957 3.780
439 HG21 ILE 60 HG21 ILE 60 -6.111 -7.426 1.392
440 HG22 ILE 60 HG22 ILE 60 -4.950 -6.099 1.344
441 HG23 ILE 60 HG23 ILE 60 -6.540 -5.905 0.605
442 HD11 ILE 60 HD11 ILE 60 -4.516 -4.176 1.775
443 HD12 ILE 60 HD12 ILE 60 -4.346 -4.261 3.529
444 HD13 ILE 60 HD13 ILE 60 -4.889 -2.767 2.766
445 HA PRO 61 HA PRO 61 -9.820 -10.032 2.597
446 HB2 PRO 61 HB2 PRO 61 -9.259 -10.108 -0.316
447 HB3 PRO 61 HB1 PRO 61 -10.724 -10.556 0.561
448 HG2 PRO 61 HG2 PRO 61 -10.638 -8.302 -0.841
449 HG3 PRO 61 HG1 PRO 61 -11.454 -8.357 0.733
450 HD2 PRO 61 HD2 PRO 61 -8.756 -7.253 0.032
451 HD3 PRO 61 HD1 PRO 61 -9.992 -6.601 1.130
452 H ASP 62 HN ASP 62 -8.797 -11.912 2.919
453 HA ASP 62 HA ASP 62 -6.028 -12.098 3.076
454 HB2 ASP 62 HB2 ASP 62 -7.952 -14.413 2.769
455 HB3 ASP 62 HB1 ASP 62 -6.355 -14.467 3.506
456 H ASP 63 HN ASP 63 -8.214 -13.093 0.525
457 HA ASP 63 HA ASP 63 -6.239 -14.692 -0.805
458 HB2 ASP 63 HB2 ASP 63 -8.022 -15.088 -2.463
459 HB3 ASP 63 HB1 ASP 63 -8.567 -15.383 -0.818
460 H VAL 64 HN VAL 64 -7.871 -11.608 -1.488
461 HA VAL 64 HA VAL 64 -6.607 -11.306 -4.032
462 HB VAL 64 HB VAL 64 -7.951 -9.163 -2.382
463 HG11 VAL 64 HG11 VAL 64 -6.615 -8.315 -4.246
464 HG12 VAL 64 HG12 VAL 64 -8.339 -8.068 -4.521
465 HG13 VAL 64 HG13 VAL 64 -7.492 -9.371 -5.353
466 HG21 VAL 64 HG21 VAL 64 -9.452 -11.058 -2.670
467 HG22 VAL 64 HG22 VAL 64 -9.156 -11.045 -4.409
468 HG23 VAL 64 HG23 VAL 64 -9.980 -9.687 -3.645
469 H ALA 65 HN ALA 65 -5.794 -10.427 -0.783
470 HA ALA 65 HA ALA 65 -4.134 -8.227 -1.217
471 HB1 ALA 65 HB1 ALA 65 -4.933 -8.876 0.993
472 HB2 ALA 65 HB2 ALA 65 -3.179 -8.704 0.971
473 HB3 ALA 65 HB3 ALA 65 -3.907 -10.309 0.946
474 H GLY 66 HN GLY 66 -3.362 -11.658 -1.279
475 HA2 GLY 66 HA2 GLY 66 -0.534 -11.056 -1.671
476 HA3 GLY 66 HA1 GLY 66 -1.222 -12.641 -1.378
477 H ARG 67 HN ARG 67 -2.948 -10.955 -3.728
478 HA ARG 67 HA ARG 67 -1.614 -12.527 -5.822
479 HB2 ARG 67 HB2 ARG 67 -4.449 -11.545 -5.547
480 HB3 ARG 67 HB1 ARG 67 -3.809 -12.143 -7.069
481 HG2 ARG 67 HG2 ARG 67 -3.380 -14.305 -6.102
482 HG3 ARG 67 HG1 ARG 67 -3.861 -13.724 -4.509
483 HD2 ARG 67 HD2 ARG 67 -5.621 -15.047 -5.631
484 HD3 ARG 67 HD1 ARG 67 -6.127 -13.399 -5.255
485 HE ARG 67 HE ARG 67 -5.077 -13.558 -7.890
486 HH11 ARG 67 HH11 ARG 67 -7.894 -14.500 -6.024
487 HH12 ARG 67 HH12 ARG 67 -8.995 -14.306 -7.362
488 HH21 ARG 67 HH21 ARG 67 -6.495 -13.334 -9.635
489 HH22 ARG 67 HH22 ARG 67 -8.195 -13.642 -9.425
490 H VAL 68 HN VAL 68 -1.564 -9.481 -4.696
491 HA VAL 68 HA VAL 68 -1.616 -8.166 -7.304
492 HB VAL 68 HB VAL 68 -1.375 -6.062 -6.108
493 HG11 VAL 68 HG11 VAL 68 -3.476 -6.079 -4.846
494 HG12 VAL 68 HG12 VAL 68 -3.465 -7.844 -4.874
495 HG13 VAL 68 HG13 VAL 68 -3.616 -6.939 -6.381
496 HG21 VAL 68 HG21 VAL 68 -1.253 -7.724 -3.591
497 HG22 VAL 68 HG22 VAL 68 -1.309 -5.962 -3.669
498 HG23 VAL 68 HG23 VAL 68 0.090 -6.830 -4.303
499 H ASP 69 HN ASP 69 0.215 -6.422 -7.543
500 HA ASP 69 HA ASP 69 2.783 -7.419 -6.552
501 HB2 ASP 69 HB2 ASP 69 1.927 -7.363 -9.400
502 HB3 ASP 69 HB1 ASP 69 3.578 -6.863 -9.047
503 H THR 70 HN THR 70 1.036 -4.902 -8.284
504 HA THR 70 HA THR 70 3.226 -3.033 -7.680
505 HB THR 70 HB THR 70 2.172 -1.566 -9.392
506 HG1 THR 70 HG1 THR 70 0.413 -3.797 -9.621
507 HG21 THR 70 HG21 THR 70 2.854 -2.894 -11.337
508 HG22 THR 70 HG22 THR 70 2.839 -4.352 -10.347
509 HG23 THR 70 HG23 THR 70 4.005 -3.071 -10.012
510 HA PRO 71 HA PRO 71 0.940 -0.840 -4.573
511 HB2 PRO 71 HB2 PRO 71 2.049 1.540 -5.973
512 HB3 PRO 71 HB1 PRO 71 2.091 1.129 -4.255
513 HG2 PRO 71 HG2 PRO 71 4.258 0.832 -5.765
514 HG3 PRO 71 HG1 PRO 71 3.845 -0.368 -4.526
515 HD2 PRO 71 HD2 PRO 71 3.550 -0.524 -7.489
516 HD3 PRO 71 HD1 PRO 71 3.956 -1.800 -6.324
517 H ARG 72 HN ARG 72 0.747 0.116 -7.959
518 HA ARG 72 HA ARG 72 -1.427 1.863 -7.837
519 HB2 ARG 72 HB2 ARG 72 0.096 1.188 -9.843
520 HB3 ARG 72 HB1 ARG 72 -1.092 -0.076 -10.115
521 HG2 ARG 72 HG2 ARG 72 -1.823 2.838 -9.941
522 HG3 ARG 72 HG1 ARG 72 -1.391 2.040 -11.454
523 HD2 ARG 72 HD2 ARG 72 -3.279 0.661 -11.401
524 HD3 ARG 72 HD1 ARG 72 -3.539 0.933 -9.677
525 HE ARG 72 HE ARG 72 -3.830 3.397 -10.886
526 HH11 ARG 72 HH11 ARG 72 -5.372 0.273 -11.274
527 HH12 ARG 72 HH12 ARG 72 -6.947 0.948 -11.525
528 HH21 ARG 72 HH21 ARG 72 -5.897 4.276 -11.244
529 HH22 ARG 72 HH22 ARG 72 -7.249 3.212 -11.534
530 H GLU 73 HN GLU 73 -1.358 -1.667 -8.169
531 HA GLU 73 HA GLU 73 -4.143 -2.043 -8.430
532 HB2 GLU 73 HB2 GLU 73 -2.075 -3.952 -7.324
533 HB3 GLU 73 HB1 GLU 73 -3.668 -4.389 -7.921
534 HG2 GLU 73 HG2 GLU 73 -3.085 -3.840 -10.147
535 HG3 GLU 73 HG1 GLU 73 -1.586 -3.068 -9.631
536 H LEU 74 HN LEU 74 -1.992 -2.052 -5.628
537 HA LEU 74 HA LEU 74 -3.866 -2.853 -3.689
538 HB2 LEU 74 HB2 LEU 74 -1.234 -2.448 -3.626
539 HB3 LEU 74 HB1 LEU 74 -1.717 -0.882 -3.012
540 HG LEU 74 HG LEU 74 -1.143 -2.465 -1.213
541 HD11 LEU 74 HD11 LEU 74 -2.733 -0.689 -0.752
542 HD12 LEU 74 HD12 LEU 74 -3.122 -2.144 0.165
543 HD13 LEU 74 HD13 LEU 74 -4.061 -1.726 -1.270
544 HD21 LEU 74 HD21 LEU 74 -1.794 -4.534 -2.280
545 HD22 LEU 74 HD22 LEU 74 -3.489 -4.041 -2.260
546 HD23 LEU 74 HD23 LEU 74 -2.641 -4.352 -0.744
547 H LEU 75 HN LEU 75 -2.833 0.361 -4.752
548 HA LEU 75 HA LEU 75 -4.502 1.911 -3.139
549 HB2 LEU 75 HB2 LEU 75 -2.586 2.747 -4.446
550 HB3 LEU 75 HB1 LEU 75 -3.477 2.469 -5.928
551 HG LEU 75 HG LEU 75 -4.611 4.331 -3.876
552 HD11 LEU 75 HD11 LEU 75 -2.466 5.032 -5.884
553 HD12 LEU 75 HD12 LEU 75 -2.273 5.021 -4.131
554 HD13 LEU 75 HD13 LEU 75 -3.362 6.182 -4.893
555 HD21 LEU 75 HD21 LEU 75 -4.649 4.268 -6.896
556 HD22 LEU 75 HD22 LEU 75 -5.485 5.441 -5.881
557 HD23 LEU 75 HD23 LEU 75 -5.957 3.743 -5.834
558 H ASP 76 HN ASP 76 -5.017 0.632 -6.404
559 HA ASP 76 HA ASP 76 -7.552 1.793 -6.829
560 HB2 ASP 76 HB2 ASP 76 -6.171 1.000 -8.676
561 HB3 ASP 76 HB1 ASP 76 -6.289 -0.653 -8.088
562 H LEU 77 HN LEU 77 -6.574 -1.314 -5.474
563 HA LEU 77 HA LEU 77 -9.078 -2.570 -5.456
564 HB2 LEU 77 HB2 LEU 77 -6.979 -3.757 -5.054
565 HB3 LEU 77 HB1 LEU 77 -6.752 -2.883 -3.552
566 HG LEU 77 HG LEU 77 -8.810 -3.971 -2.663
567 HD11 LEU 77 HD11 LEU 77 -9.675 -5.948 -3.832
568 HD12 LEU 77 HD12 LEU 77 -8.638 -5.577 -5.208
569 HD13 LEU 77 HD13 LEU 77 -9.932 -4.468 -4.753
570 HD21 LEU 77 HD21 LEU 77 -6.634 -5.833 -3.603
571 HD22 LEU 77 HD22 LEU 77 -7.775 -6.147 -2.295
572 HD23 LEU 77 HD23 LEU 77 -6.598 -4.842 -2.144
573 H ILE 78 HN ILE 78 -7.465 -0.721 -2.868
574 HA ILE 78 HA ILE 78 -9.636 -0.982 -1.051
575 HB ILE 78 HB ILE 78 -7.394 1.052 -1.050
576 HG12 ILE 78 HG12 ILE 78 -7.685 -1.633 0.319
577 HG13 ILE 78 HG11 ILE 78 -6.568 -1.243 -0.984
578 HG21 ILE 78 HG21 ILE 78 -7.892 1.344 1.314
579 HG22 ILE 78 HG22 ILE 78 -9.226 0.197 1.195
580 HG23 ILE 78 HG23 ILE 78 -9.309 1.736 0.338
581 HD11 ILE 78 HD11 ILE 78 -5.426 -1.315 1.143
582 HD12 ILE 78 HD12 ILE 78 -6.521 -0.097 1.794
583 HD13 ILE 78 HD13 ILE 78 -5.409 0.323 0.490
584 H ASN 79 HN ASN 79 -8.725 1.431 -3.442
585 HA ASN 79 HA ASN 79 -10.631 3.394 -2.724
586 HB2 ASN 79 HB2 ASN 79 -8.949 2.861 -5.116
587 HB3 ASN 79 HB1 ASN 79 -10.372 3.859 -5.365
588 HD21 ASN 79 HD21 ASN 79 -7.299 3.609 -3.781
589 HD22 ASN 79 HD22 ASN 79 -7.162 5.287 -3.374
590 H GLY 80 HN GLY 80 -10.768 0.619 -4.904
591 HA2 GLY 80 HA2 GLY 80 -13.250 1.183 -6.100
592 HA3 GLY 80 HA1 GLY 80 -12.525 -0.411 -5.952
593 H ALA 81 HN ALA 81 -12.461 -0.541 -3.123
594 HA ALA 81 HA ALA 81 -15.105 -1.482 -2.663
595 HB1 ALA 81 HB1 ALA 81 -13.141 -2.575 -1.699
596 HB2 ALA 81 HB2 ALA 81 -14.293 -2.100 -0.449
597 HB3 ALA 81 HB3 ALA 81 -12.833 -1.147 -0.710
598 H LEU 82 HN LEU 82 -13.440 1.478 -1.962
599 HA LEU 82 HA LEU 82 -15.444 2.384 -0.074
600 HB2 LEU 82 HB2 LEU 82 -13.053 3.757 -1.301
601 HB3 LEU 82 HB1 LEU 82 -14.118 4.508 -0.130
602 HG LEU 82 HG LEU 82 -12.485 2.024 0.389
603 HD11 LEU 82 HD11 LEU 82 -12.022 4.888 1.219
604 HD12 LEU 82 HD12 LEU 82 -11.048 3.963 0.075
605 HD13 LEU 82 HD13 LEU 82 -11.094 3.497 1.776
606 HD21 LEU 82 HD21 LEU 82 -14.521 2.143 1.724
607 HD22 LEU 82 HD22 LEU 82 -14.113 3.786 2.221
608 HD23 LEU 82 HD23 LEU 82 -13.100 2.435 2.729
609 H ALA 83 HN ALA 83 -14.715 2.676 -3.456
610 HA ALA 83 HA ALA 83 -16.122 5.054 -4.014
611 HB1 ALA 83 HB1 ALA 83 -14.472 4.076 -5.539
612 HB2 ALA 83 HB2 ALA 83 -16.014 4.361 -6.347
613 HB3 ALA 83 HB3 ALA 83 -15.566 2.730 -5.850
614 H GLU 84 HN GLU 84 -17.138 1.658 -4.038
615 HA GLU 84 HA GLU 84 -19.816 2.429 -4.892
616 HB2 GLU 84 HB2 GLU 84 -18.628 -0.299 -4.343
617 HB3 GLU 84 HB1 GLU 84 -20.247 -0.007 -4.960
618 HG2 GLU 84 HG2 GLU 84 -17.683 0.739 -6.347
619 HG3 GLU 84 HG1 GLU 84 -18.699 -0.650 -6.729
620 H ALA 85 HN ALA 85 -18.479 2.832 -2.109
621 HA ALA 85 HA ALA 85 -20.158 1.226 -0.388
622 HB1 ALA 85 HB1 ALA 85 -18.254 3.442 0.343
623 HB2 ALA 85 HB2 ALA 85 -17.846 1.728 0.255
624 HB3 ALA 85 HB3 ALA 85 -19.007 2.299 1.455
625 H ALA 86 HN ALA 86 -19.655 4.777 -0.559
626 HA ALA 86 HA ALA 86 -22.533 5.101 -0.087
627 HB1 ALA 86 HB1 ALA 86 -20.393 6.541 1.481
628 HB2 ALA 86 HB2 ALA 86 -21.447 5.266 2.094
629 HB3 ALA 86 HB3 ALA 86 -22.129 6.816 1.599
630 H28 SXO 87 H28B SXO 87 5.896 -11.385 6.190
631 H28A SXO 87 H28A SXO 87 6.628 -11.119 7.773
632 H30 SXO 87 H30A SXO 87 4.494 -11.463 8.816
633 H30A SXO 87 H30C SXO 87 3.735 -11.765 7.252
634 H30B SXO 87 H30B SXO 87 3.567 -12.940 8.558
635 H31 SXO 87 H31A SXO 87 4.464 -14.713 6.992
636 H31A SXO 87 H31B SXO 87 6.031 -14.465 6.220
637 H31B SXO 87 H31C SXO 87 4.644 -13.496 5.729
638 H32 SXO 87 H32A SXO 87 6.240 -12.940 9.655
639 HO33 SXO 87 H33A SXO 87 7.757 -13.587 7.617
640 HN36 SXO 87 H36A SXO 87 3.926 -13.776 9.928
641 H37 SXO 87 H37A SXO 87 3.715 -16.709 9.860
642 H37A SXO 87 H37B SXO 87 3.453 -15.831 11.361
643 H38 SXO 87 H38B SXO 87 1.660 -14.521 10.142
644 H38A SXO 87 H38A SXO 87 1.310 -16.220 10.475
645 HN41 SXO 87 H41A SXO 87 0.071 -14.591 8.575
646 H42 SXO 87 H42A SXO 87 0.832 -15.816 6.005
647 H42A SXO 87 H42B SXO 87 -0.836 -15.757 6.573
648 H43 SXO 87 H43B SXO 87 -0.553 -13.981 5.009
649 H43A SXO 87 H43A SXO 87 -0.624 -13.248 6.618
650 H2 SXO 87 H2A SXO 87 2.395 -11.541 3.782
651 H2A SXO 87 H2B SXO 87 2.337 -10.053 4.726
652 H3 SXO 87 H3B SXO 87 0.228 -10.971 2.777
653 H3A SXO 87 H3A SXO 87 0.205 -9.469 3.704
654 H4 SXO 87 H4A SXO 87 2.245 -10.252 1.622
655 H4A SXO 87 H4B SXO 87 2.278 -8.770 2.578
656 H5 SXO 87 H5B SXO 87 1.344 -8.431 0.315
657 H5A SXO 87 H5A SXO 87 0.046 -9.563 0.710
658 H6 SXO 87 H6A SXO 87 0.635 -6.998 2.192
659 H6A SXO 87 H6B SXO 87 -0.703 -8.107 2.504
660 H7 SXO 87 H7A SXO 87 -1.605 -7.659 0.273
661 H7A SXO 87 H7B SXO 87 -0.257 -6.552 -0.046
662 H8 SXO 87 H8C SXO 87 -2.314 -6.261 2.137
663 H8A SXO 87 H8A SXO 87 -2.270 -5.340 0.634
664 H8B SXO 87 H8B SXO 87 -0.980 -5.153 1.824
Start of MODEL 6
1 H1 MET 1 HT1 MET 1 -18.242 13.237 -0.485
2 H2 MET 1 HT2 MET 1 -18.015 11.554 -0.547
3 H3 MET 1 HT3 MET 1 -16.673 12.594 -0.527
4 HA MET 1 HA MET 1 -17.190 13.325 1.678
5 HB2 MET 1 HB2 MET 1 -19.610 13.118 1.567
6 HB3 MET 1 HB1 MET 1 -19.483 11.368 1.446
7 HG2 MET 1 HG2 MET 1 -18.600 11.241 3.690
8 HG3 MET 1 HG1 MET 1 -18.598 13.003 3.814
9 HE1 MET 1 HE1 MET 1 -20.810 14.480 3.830
10 HE2 MET 1 HE2 MET 1 -22.438 13.806 3.713
11 HE3 MET 1 HE3 MET 1 -21.346 13.714 2.333
12 H ALA 2 HN ALA 2 -17.438 10.067 0.329
13 HA ALA 2 HA ALA 2 -16.010 8.796 2.442
14 HB1 ALA 2 HB1 ALA 2 -17.490 7.565 0.899
15 HB2 ALA 2 HB2 ALA 2 -15.863 6.887 0.952
16 HB3 ALA 2 HB3 ALA 2 -16.358 7.885 -0.416
17 H THR 3 HN THR 3 -13.946 8.997 2.884
18 HA THR 3 HA THR 3 -12.145 10.382 1.164
19 HB THR 3 HB THR 3 -10.498 9.489 3.040
20 HG1 THR 3 HG1 THR 3 -11.561 8.900 4.906
21 HG21 THR 3 HG21 THR 3 -11.099 11.425 4.408
22 HG22 THR 3 HG22 THR 3 -12.661 11.529 3.597
23 HG23 THR 3 HG23 THR 3 -11.177 11.835 2.693
24 H LEU 4 HN LEU 4 -11.510 9.364 -0.644
25 HA LEU 4 HA LEU 4 -10.962 6.549 -0.750
26 HB2 LEU 4 HB2 LEU 4 -10.210 8.715 -2.724
27 HB3 LEU 4 HB1 LEU 4 -10.224 6.991 -3.036
28 HG LEU 4 HG LEU 4 -12.658 8.688 -2.460
29 HD11 LEU 4 HD11 LEU 4 -11.664 7.450 -5.023
30 HD12 LEU 4 HD12 LEU 4 -11.709 9.173 -4.641
31 HD13 LEU 4 HD13 LEU 4 -13.213 8.265 -4.809
32 HD21 LEU 4 HD21 LEU 4 -12.921 6.403 -1.658
33 HD22 LEU 4 HD22 LEU 4 -12.421 5.783 -3.232
34 HD23 LEU 4 HD23 LEU 4 -13.925 6.690 -3.079
35 H LEU 5 HN LEU 5 -8.766 5.753 -1.471
36 HA LEU 5 HA LEU 5 -6.818 6.781 0.391
37 HB2 LEU 5 HB2 LEU 5 -7.292 4.316 -0.176
38 HB3 LEU 5 HB1 LEU 5 -6.386 4.598 -1.647
39 HG LEU 5 HG LEU 5 -5.186 5.087 1.074
40 HD11 LEU 5 HD11 LEU 5 -5.129 2.548 -0.549
41 HD12 LEU 5 HD12 LEU 5 -5.965 2.777 0.987
42 HD13 LEU 5 HD13 LEU 5 -4.204 2.860 0.919
43 HD21 LEU 5 HD21 LEU 5 -4.022 6.083 -0.825
44 HD22 LEU 5 HD22 LEU 5 -3.982 4.516 -1.632
45 HD23 LEU 5 HD23 LEU 5 -3.085 4.758 -0.131
46 H THR 6 HN THR 6 -5.349 8.255 -0.062
47 HA THR 6 HA THR 6 -5.007 9.092 -2.831
48 HB THR 6 HB THR 6 -3.542 10.779 -1.136
49 HG1 THR 6 HG1 THR 6 -4.485 10.474 0.758
50 HG21 THR 6 HG21 THR 6 -6.324 11.062 -2.268
51 HG22 THR 6 HG22 THR 6 -4.816 11.500 -3.071
52 HG23 THR 6 HG23 THR 6 -5.343 12.387 -1.641
53 H THR 7 HN THR 7 -3.021 9.311 -3.817
54 HA THR 7 HA THR 7 -1.038 7.420 -3.329
55 HB THR 7 HB THR 7 0.363 8.954 -4.854
56 HG1 THR 7 HG1 THR 7 -0.460 10.892 -5.128
57 HG21 THR 7 HG21 THR 7 -0.925 8.327 -6.824
58 HG22 THR 7 HG22 THR 7 -2.347 8.035 -5.824
59 HG23 THR 7 HG23 THR 7 -0.924 7.005 -5.655
60 H ASP 8 HN ASP 8 -1.344 10.759 -2.321
61 HA ASP 8 HA ASP 8 1.210 11.183 -1.264
62 HB2 ASP 8 HB2 ASP 8 -1.425 12.320 -0.305
63 HB3 ASP 8 HB1 ASP 8 0.169 12.999 0.013
64 H ASP 9 HN ASP 9 -1.749 9.986 0.303
65 HA ASP 9 HA ASP 9 -0.602 9.568 2.845
66 HB2 ASP 9 HB2 ASP 9 -3.051 8.521 1.475
67 HB3 ASP 9 HB1 ASP 9 -2.549 7.835 3.017
68 H LEU 10 HN LEU 10 -1.086 7.411 0.076
69 HA LEU 10 HA LEU 10 -0.096 5.079 1.252
70 HB2 LEU 10 HB2 LEU 10 -1.312 5.205 -0.903
71 HB3 LEU 10 HB1 LEU 10 0.110 5.918 -1.638
72 HG LEU 10 HG LEU 10 1.370 3.858 -1.247
73 HD11 LEU 10 HD11 LEU 10 0.247 1.853 -0.424
74 HD12 LEU 10 HD12 LEU 10 -1.221 2.785 -0.131
75 HD13 LEU 10 HD13 LEU 10 0.241 3.125 0.799
76 HD21 LEU 10 HD21 LEU 10 -1.289 3.400 -2.598
77 HD22 LEU 10 HD22 LEU 10 0.161 2.425 -2.829
78 HD23 LEU 10 HD23 LEU 10 0.141 4.113 -3.342
79 H ARG 11 HN ARG 11 1.567 7.647 -0.521
80 HA ARG 11 HA ARG 11 4.149 6.640 -0.575
81 HB2 ARG 11 HB2 ARG 11 3.368 8.766 -1.648
82 HB3 ARG 11 HB1 ARG 11 3.391 9.522 -0.062
83 HG2 ARG 11 HG2 ARG 11 5.822 8.969 0.076
84 HG3 ARG 11 HG1 ARG 11 5.735 8.443 -1.605
85 HD2 ARG 11 HD2 ARG 11 5.178 11.207 -0.533
86 HD3 ARG 11 HD1 ARG 11 6.552 10.712 -1.524
87 HE ARG 11 HE ARG 11 4.053 10.191 -2.811
88 HH11 ARG 11 HH11 ARG 11 6.464 12.658 -2.189
89 HH12 ARG 11 HH12 ARG 11 5.943 13.672 -3.502
90 HH21 ARG 11 HH21 ARG 11 3.381 11.525 -4.561
91 HH22 ARG 11 HH22 ARG 11 4.203 13.038 -4.850
92 H ARG 12 HN ARG 12 2.439 8.332 2.019
93 HA ARG 12 HA ARG 12 4.697 8.460 3.763
94 HB2 ARG 12 HB2 ARG 12 1.748 8.791 4.295
95 HB3 ARG 12 HB1 ARG 12 2.988 9.020 5.516
96 HG2 ARG 12 HG2 ARG 12 3.981 10.779 4.026
97 HG3 ARG 12 HG1 ARG 12 2.528 10.635 3.028
98 HD2 ARG 12 HD2 ARG 12 2.280 12.460 4.607
99 HD3 ARG 12 HD1 ARG 12 1.150 11.164 4.993
100 HE ARG 12 HE ARG 12 3.721 11.343 6.421
101 HH11 ARG 12 HH11 ARG 12 0.218 11.430 6.460
102 HH12 ARG 12 HH12 ARG 12 0.098 11.383 8.189
103 HH21 ARG 12 HH21 ARG 12 3.566 11.281 8.713
104 HH22 ARG 12 HH22 ARG 12 2.005 11.292 9.467
105 H ALA 13 HN ALA 13 1.983 6.259 3.368
106 HA ALA 13 HA ALA 13 2.146 4.932 5.818
107 HB1 ALA 13 HB1 ALA 13 1.217 3.842 3.165
108 HB2 ALA 13 HB2 ALA 13 0.236 4.739 4.323
109 HB3 ALA 13 HB3 ALA 13 0.866 3.149 4.748
110 H LEU 14 HN LEU 14 3.821 4.291 2.771
111 HA LEU 14 HA LEU 14 5.060 1.887 3.550
112 HB2 LEU 14 HB2 LEU 14 5.685 3.985 1.503
113 HB3 LEU 14 HB1 LEU 14 6.854 2.723 1.829
114 HG LEU 14 HG LEU 14 5.509 2.179 -0.121
115 HD11 LEU 14 HD11 LEU 14 4.691 -0.039 0.587
116 HD12 LEU 14 HD12 LEU 14 4.950 0.437 2.266
117 HD13 LEU 14 HD13 LEU 14 6.317 0.330 1.157
118 HD21 LEU 14 HD21 LEU 14 3.140 2.243 1.738
119 HD22 LEU 14 HD22 LEU 14 3.131 1.709 0.057
120 HD23 LEU 14 HD23 LEU 14 3.478 3.393 0.444
121 H VAL 15 HN VAL 15 6.161 5.259 3.765
122 HA VAL 15 HA VAL 15 8.681 4.656 4.919
123 HB VAL 15 HB VAL 15 7.131 7.247 5.106
124 HG11 VAL 15 HG11 VAL 15 10.078 6.663 5.385
125 HG12 VAL 15 HG12 VAL 15 8.979 7.136 6.681
126 HG13 VAL 15 HG13 VAL 15 9.349 8.270 5.382
127 HG21 VAL 15 HG21 VAL 15 7.366 6.609 2.784
128 HG22 VAL 15 HG22 VAL 15 9.085 6.287 3.016
129 HG23 VAL 15 HG23 VAL 15 8.473 7.935 3.143
130 H GLU 16 HN GLU 16 5.552 5.625 6.283
131 HA GLU 16 HA GLU 16 6.300 5.820 8.968
132 HB2 GLU 16 HB2 GLU 16 3.665 4.990 7.743
133 HB3 GLU 16 HB1 GLU 16 3.892 5.307 9.455
134 HG2 GLU 16 HG2 GLU 16 4.483 7.603 8.991
135 HG3 GLU 16 HG1 GLU 16 4.368 7.307 7.257
136 H SER 17 HN SER 17 5.435 2.999 7.048
137 HA SER 17 HA SER 17 5.421 1.236 9.324
138 HB2 SER 17 HB2 SER 17 5.478 0.543 6.379
139 HB3 SER 17 HB1 SER 17 5.010 -0.522 7.708
140 HG SER 17 HG SER 17 3.643 1.674 6.603
141 H ALA 18 HN ALA 18 7.691 2.145 6.795
142 HA ALA 18 HA ALA 18 9.618 0.141 7.316
143 HB1 ALA 18 HB1 ALA 18 11.160 1.536 6.064
144 HB2 ALA 18 HB2 ALA 18 10.047 2.899 6.175
145 HB3 ALA 18 HB3 ALA 18 9.596 1.466 5.250
146 H GLY 19 HN GLY 19 9.264 3.483 8.465
147 HA2 GLY 19 HA2 GLY 19 9.880 4.302 10.570
148 HA3 GLY 19 HA1 GLY 19 10.722 2.791 10.886
149 H GLU 20 HN GLU 20 11.537 3.926 7.865
150 HA GLU 20 HA GLU 20 13.723 5.604 8.782
151 HB2 GLU 20 HB2 GLU 20 14.519 3.236 8.903
152 HB3 GLU 20 HB1 GLU 20 14.226 3.092 7.176
153 HG2 GLU 20 HG2 GLU 20 16.583 3.497 7.712
154 HG3 GLU 20 HG1 GLU 20 15.887 4.768 6.705
155 H THR 21 HN THR 21 14.792 6.718 7.025
156 HA THR 21 HA THR 21 12.983 7.046 4.722
157 HB THR 21 HB THR 21 13.379 9.008 6.216
158 HG1 THR 21 HG1 THR 21 14.014 9.032 3.462
159 HG21 THR 21 HG21 THR 21 16.169 8.877 5.078
160 HG22 THR 21 HG22 THR 21 15.716 8.622 6.765
161 HG23 THR 21 HG23 THR 21 15.510 10.210 6.025
162 H ASP 22 HN ASP 22 15.684 5.493 5.467
163 HA ASP 22 HA ASP 22 17.317 6.215 3.184
164 HB2 ASP 22 HB2 ASP 22 18.540 5.741 5.167
165 HB3 ASP 22 HB1 ASP 22 17.662 4.241 5.439
166 H GLY 23 HN GLY 23 16.776 5.470 1.246
167 HA2 GLY 23 HA2 GLY 23 16.762 3.620 -0.272
168 HA3 GLY 23 HA1 GLY 23 16.128 2.612 1.018
169 H THR 24 HN THR 24 14.263 4.978 1.634
170 HA THR 24 HA THR 24 12.075 3.935 0.093
171 HB THR 24 HB THR 24 10.728 5.602 1.409
172 HG1 THR 24 HG1 THR 24 12.344 7.135 1.816
173 HG21 THR 24 HG21 THR 24 12.513 3.749 2.992
174 HG22 THR 24 HG22 THR 24 11.016 3.300 2.175
175 HG23 THR 24 HG23 THR 24 10.974 4.412 3.544
176 H ASP 25 HN ASP 25 13.155 4.705 -1.976
177 HA ASP 25 HA ASP 25 12.768 7.533 -2.542
178 HB2 ASP 25 HB2 ASP 25 14.699 6.151 -3.475
179 HB3 ASP 25 HB1 ASP 25 13.519 5.397 -4.541
180 H LEU 26 HN LEU 26 10.583 7.764 -2.303
181 HA LEU 26 HA LEU 26 8.926 6.483 -4.374
182 HB2 LEU 26 HB2 LEU 26 8.237 7.590 -1.655
183 HB3 LEU 26 HB1 LEU 26 7.012 7.364 -2.885
184 HG LEU 26 HG LEU 26 7.652 4.925 -2.955
185 HD11 LEU 26 HD11 LEU 26 9.150 5.628 -0.441
186 HD12 LEU 26 HD12 LEU 26 9.869 5.095 -1.961
187 HD13 LEU 26 HD13 LEU 26 8.832 4.002 -1.043
188 HD21 LEU 26 HD21 LEU 26 5.680 5.755 -1.764
189 HD22 LEU 26 HD22 LEU 26 6.662 5.972 -0.314
190 HD23 LEU 26 HD23 LEU 26 6.403 4.356 -0.970
191 H SER 27 HN SER 27 10.535 8.452 -5.209
192 HA SER 27 HA SER 27 9.533 11.083 -4.839
193 HB2 SER 27 HB2 SER 27 11.392 10.074 -6.999
194 HB3 SER 27 HB1 SER 27 11.238 11.734 -6.419
195 HG SER 27 HG SER 27 12.520 9.540 -5.276
196 H GLY 28 HN GLY 28 7.369 11.134 -5.456
197 HA2 GLY 28 HA2 GLY 28 5.789 11.840 -7.000
198 HA3 GLY 28 HA1 GLY 28 6.958 11.567 -8.283
199 H ASP 29 HN ASP 29 7.442 9.225 -8.730
200 HA ASP 29 HA ASP 29 4.894 7.761 -8.765
201 HB2 ASP 29 HB2 ASP 29 5.762 6.571 -10.711
202 HB3 ASP 29 HB1 ASP 29 5.865 8.308 -10.975
203 H PHE 30 HN PHE 30 4.976 5.437 -8.518
204 HA PHE 30 HA PHE 30 7.157 3.970 -7.618
205 HB2 PHE 30 HB2 PHE 30 6.780 3.808 -5.210
206 HB3 PHE 30 HB1 PHE 30 7.152 5.463 -5.665
207 HD1 PHE 30 HD2 PHE 30 5.307 7.155 -5.743
208 HD2 PHE 30 HD1 PHE 30 4.751 3.249 -4.133
209 HE1 PHE 30 HE2 PHE 30 3.273 7.918 -4.588
210 HE2 PHE 30 HE1 PHE 30 2.718 4.010 -2.984
211 HZ PHE 30 HZ PHE 30 2.003 6.355 -3.154
212 H LEU 31 HN LEU 31 3.763 4.526 -7.751
213 HA LEU 31 HA LEU 31 2.661 2.137 -6.900
214 HB2 LEU 31 HB2 LEU 31 1.790 3.800 -9.262
215 HB3 LEU 31 HB1 LEU 31 0.807 2.614 -8.430
216 HG LEU 31 HG LEU 31 1.841 5.176 -7.208
217 HD11 LEU 31 HD11 LEU 31 0.135 5.578 -8.906
218 HD12 LEU 31 HD12 LEU 31 -0.487 5.898 -7.287
219 HD13 LEU 31 HD13 LEU 31 -0.925 4.407 -8.123
220 HD21 LEU 31 HD21 LEU 31 0.391 4.635 -5.343
221 HD22 LEU 31 HD22 LEU 31 1.569 3.343 -5.593
222 HD23 LEU 31 HD23 LEU 31 -0.098 3.136 -6.134
223 H ASP 32 HN ASP 32 4.619 2.711 -9.644
224 HA ASP 32 HA ASP 32 3.497 0.558 -11.231
225 HB2 ASP 32 HB2 ASP 32 5.894 2.262 -11.895
226 HB3 ASP 32 HB1 ASP 32 4.826 1.412 -13.007
227 H LEU 33 HN LEU 33 6.026 1.020 -8.990
228 HA LEU 33 HA LEU 33 7.685 -1.115 -10.085
229 HB2 LEU 33 HB2 LEU 33 8.035 0.550 -7.587
230 HB3 LEU 33 HB1 LEU 33 9.208 -0.583 -8.235
231 HG LEU 33 HG LEU 33 8.285 1.965 -9.570
232 HD11 LEU 33 HD11 LEU 33 10.911 1.238 -8.278
233 HD12 LEU 33 HD12 LEU 33 9.719 2.378 -7.654
234 HD13 LEU 33 HD13 LEU 33 10.572 2.729 -9.156
235 HD21 LEU 33 HD21 LEU 33 8.800 0.234 -11.203
236 HD22 LEU 33 HD22 LEU 33 10.361 -0.050 -10.431
237 HD23 LEU 33 HD23 LEU 33 10.030 1.497 -11.213
238 H ARG 34 HN ARG 34 8.182 -3.029 -8.909
239 HA ARG 34 HA ARG 34 6.035 -4.150 -7.409
240 HB2 ARG 34 HB2 ARG 34 8.768 -5.013 -8.201
241 HB3 ARG 34 HB1 ARG 34 8.032 -5.836 -6.835
242 HG2 ARG 34 HG2 ARG 34 6.096 -6.388 -8.287
243 HG3 ARG 34 HG1 ARG 34 6.977 -5.683 -9.646
244 HD2 ARG 34 HD2 ARG 34 8.744 -7.289 -9.408
245 HD3 ARG 34 HD1 ARG 34 8.038 -7.907 -7.919
246 HE ARG 34 HE ARG 34 6.057 -8.431 -9.562
247 HH11 ARG 34 HH11 ARG 34 9.499 -8.792 -10.066
248 HH12 ARG 34 HH12 ARG 34 9.345 -10.123 -11.173
249 HH21 ARG 34 HH21 ARG 34 5.829 -10.199 -11.013
250 HH22 ARG 34 HH22 ARG 34 7.245 -10.919 -11.720
251 H PHE 35 HN PHE 35 5.985 -4.741 -5.212
252 HA PHE 35 HA PHE 35 7.054 -2.979 -3.325
253 HB2 PHE 35 HB2 PHE 35 6.096 -5.822 -2.967
254 HB3 PHE 35 HB1 PHE 35 6.458 -4.727 -1.639
255 HD1 PHE 35 HD2 PHE 35 5.207 -2.398 -1.779
256 HD2 PHE 35 HD1 PHE 35 3.919 -5.984 -3.687
257 HE1 PHE 35 HE2 PHE 35 2.914 -1.514 -1.884
258 HE2 PHE 35 HE1 PHE 35 1.624 -5.102 -3.796
259 HZ PHE 35 HZ PHE 35 1.113 -2.889 -2.871
260 H GLU 36 HN GLU 36 8.219 -6.127 -4.446
261 HA GLU 36 HA GLU 36 10.444 -6.366 -2.754
262 HB2 GLU 36 HB2 GLU 36 11.347 -7.922 -4.421
263 HB3 GLU 36 HB1 GLU 36 9.635 -8.223 -4.143
264 HG2 GLU 36 HG2 GLU 36 9.018 -7.412 -6.211
265 HG3 GLU 36 HG1 GLU 36 10.484 -6.452 -6.389
266 H ASP 37 HN ASP 37 9.883 -4.253 -5.399
267 HA ASP 37 HA ASP 37 12.685 -3.944 -6.097
268 HB2 ASP 37 HB2 ASP 37 10.748 -3.892 -7.764
269 HB3 ASP 37 HB1 ASP 37 10.363 -2.301 -7.121
270 H ILE 38 HN ILE 38 10.159 -2.263 -4.362
271 HA ILE 38 HA ILE 38 11.875 0.039 -3.924
272 HB ILE 38 HB ILE 38 9.921 0.868 -2.522
273 HG12 ILE 38 HG12 ILE 38 8.503 -1.398 -3.935
274 HG13 ILE 38 HG11 ILE 38 8.875 -1.373 -2.214
275 HG21 ILE 38 HG21 ILE 38 8.656 1.542 -4.510
276 HG22 ILE 38 HG22 ILE 38 9.520 0.330 -5.458
277 HG23 ILE 38 HG23 ILE 38 10.398 1.687 -4.750
278 HD11 ILE 38 HD11 ILE 38 7.093 0.591 -3.636
279 HD12 ILE 38 HD12 ILE 38 7.424 0.542 -1.903
280 HD13 ILE 38 HD13 ILE 38 6.552 -0.785 -2.676
281 H GLY 39 HN GLY 39 12.088 -2.838 -2.698
282 HA2 GLY 39 HA2 GLY 39 13.471 -3.459 -0.953
283 HA3 GLY 39 HA1 GLY 39 13.428 -1.808 -0.367
284 H TYR 40 HN TYR 40 10.434 -3.543 -0.890
285 HA TYR 40 HA TYR 40 10.180 -3.757 2.035
286 HB2 TYR 40 HB2 TYR 40 8.081 -3.253 -0.073
287 HB3 TYR 40 HB1 TYR 40 7.683 -3.707 1.583
288 HD1 TYR 40 HD1 TYR 40 9.021 -1.075 -0.571
289 HD2 TYR 40 HD2 TYR 40 8.042 -2.161 3.421
290 HE1 TYR 40 HE1 TYR 40 9.170 1.281 0.098
291 HE2 TYR 40 HE2 TYR 40 8.190 0.196 4.107
292 HH TYR 40 HH TYR 40 8.336 2.752 1.857
293 H ASP 41 HN ASP 41 10.187 -5.698 2.842
294 HA ASP 41 HA ASP 41 9.922 -7.979 1.046
295 HB2 ASP 41 HB2 ASP 41 11.867 -7.505 2.759
296 HB3 ASP 41 HB1 ASP 41 10.751 -8.226 3.914
297 H SER 42 HN SER 42 9.243 -9.993 2.746
298 HA SER 42 HA SER 42 6.500 -10.065 2.465
299 HB2 SER 42 HB2 SER 42 6.590 -12.073 3.910
300 HB3 SER 42 HB1 SER 42 7.891 -12.063 2.715
301 H LEU 43 HN LEU 43 8.211 -9.806 5.571
302 HA LEU 43 HA LEU 43 5.937 -9.497 7.154
303 HB2 LEU 43 HB2 LEU 43 8.132 -10.129 8.027
304 HB3 LEU 43 HB1 LEU 43 8.746 -8.527 7.668
305 HG LEU 43 HG LEU 43 7.128 -7.585 9.307
306 HD11 LEU 43 HD11 LEU 43 6.045 -9.109 10.885
307 HD12 LEU 43 HD12 LEU 43 6.619 -10.489 9.949
308 HD13 LEU 43 HD13 LEU 43 5.463 -9.361 9.240
309 HD21 LEU 43 HD21 LEU 43 8.348 -8.343 11.292
310 HD22 LEU 43 HD22 LEU 43 9.436 -8.026 9.941
311 HD23 LEU 43 HD23 LEU 43 9.017 -9.685 10.364
312 H ALA 44 HN ALA 44 8.143 -7.004 5.916
313 HA ALA 44 HA ALA 44 6.883 -4.833 7.166
314 HB1 ALA 44 HB1 ALA 44 8.510 -4.828 4.629
315 HB2 ALA 44 HB2 ALA 44 9.162 -4.752 6.266
316 HB3 ALA 44 HB3 ALA 44 8.163 -3.434 5.652
317 H LEU 45 HN LEU 45 6.198 -6.526 4.205
318 HA LEU 45 HA LEU 45 4.672 -4.559 2.911
319 HB2 LEU 45 HB2 LEU 45 5.537 -6.620 1.848
320 HB3 LEU 45 HB1 LEU 45 4.369 -7.559 2.756
321 HG LEU 45 HG LEU 45 2.530 -6.470 1.579
322 HD11 LEU 45 HD11 LEU 45 2.951 -4.937 -0.264
323 HD12 LEU 45 HD12 LEU 45 4.681 -4.992 0.069
324 HD13 LEU 45 HD13 LEU 45 3.579 -4.285 1.250
325 HD21 LEU 45 HD21 LEU 45 2.906 -7.404 -0.637
326 HD22 LEU 45 HD22 LEU 45 3.534 -8.487 0.605
327 HD23 LEU 45 HD23 LEU 45 4.640 -7.478 -0.326
328 H MET 46 HN MET 46 3.616 -7.270 5.005
329 HA MET 46 HA MET 46 0.881 -6.496 4.903
330 HB2 MET 46 HB2 MET 46 0.463 -8.135 6.625
331 HB3 MET 46 HB1 MET 46 1.561 -8.809 5.432
332 HG2 MET 46 HG2 MET 46 3.401 -8.649 6.880
333 HG3 MET 46 HG1 MET 46 2.532 -7.594 7.990
334 HE1 MET 46 HE1 MET 46 0.596 -8.398 9.609
335 HE2 MET 46 HE2 MET 46 -0.063 -10.033 9.599
336 HE3 MET 46 HE3 MET 46 -0.299 -8.980 8.204
337 H GLU 47 HN GLU 47 3.545 -5.680 7.037
338 HA GLU 47 HA GLU 47 2.002 -4.517 9.103
339 HB2 GLU 47 HB2 GLU 47 4.824 -3.887 8.214
340 HB3 GLU 47 HB1 GLU 47 4.092 -3.320 9.709
341 HG2 GLU 47 HG2 GLU 47 3.808 -5.657 10.425
342 HG3 GLU 47 HG1 GLU 47 4.612 -6.186 8.949
343 H THR 48 HN THR 48 3.377 -3.242 6.121
344 HA THR 48 HA THR 48 2.634 -0.556 6.448
345 HB THR 48 HB THR 48 2.794 -2.083 3.841
346 HG1 THR 48 HG1 THR 48 4.745 -2.290 5.006
347 HG21 THR 48 HG21 THR 48 1.758 0.124 3.627
348 HG22 THR 48 HG22 THR 48 3.355 0.108 2.882
349 HG23 THR 48 HG23 THR 48 3.129 0.855 4.463
350 H ALA 49 HN ALA 49 0.888 -3.313 5.081
351 HA ALA 49 HA ALA 49 -1.316 -2.006 4.006
352 HB1 ALA 49 HB1 ALA 49 -1.299 -4.725 5.298
353 HB2 ALA 49 HB2 ALA 49 -0.773 -4.382 3.649
354 HB3 ALA 49 HB3 ALA 49 -2.458 -4.130 4.109
355 H ALA 50 HN ALA 50 -0.713 -3.025 7.322
356 HA ALA 50 HA ALA 50 -3.334 -2.728 8.305
357 HB1 ALA 50 HB1 ALA 50 -2.310 -2.712 10.527
358 HB2 ALA 50 HB2 ALA 50 -0.718 -2.503 9.797
359 HB3 ALA 50 HB3 ALA 50 -1.634 -3.985 9.513
360 H ARG 51 HN ARG 51 -0.764 -0.466 7.730
361 HA ARG 51 HA ARG 51 -1.715 1.646 9.356
362 HB2 ARG 51 HB2 ARG 51 0.013 1.727 6.880
363 HB3 ARG 51 HB1 ARG 51 -0.215 3.051 8.001
364 HG2 ARG 51 HG2 ARG 51 0.992 0.400 8.731
365 HG3 ARG 51 HG1 ARG 51 1.912 1.841 8.305
366 HD2 ARG 51 HD2 ARG 51 1.860 1.721 10.679
367 HD3 ARG 51 HD1 ARG 51 0.779 3.024 10.196
368 HE ARG 51 HE ARG 51 -1.011 1.167 10.474
369 HH11 ARG 51 HH11 ARG 51 1.857 1.535 12.434
370 HH12 ARG 51 HH12 ARG 51 1.110 0.937 13.886
371 HH21 ARG 51 HH21 ARG 51 -2.002 0.321 12.368
372 HH22 ARG 51 HH22 ARG 51 -1.073 0.191 13.835
373 H LEU 52 HN LEU 52 -2.334 0.656 6.052
374 HA LEU 52 HA LEU 52 -3.803 2.968 5.284
375 HB2 LEU 52 HB2 LEU 52 -3.885 0.162 4.162
376 HB3 LEU 52 HB1 LEU 52 -4.566 1.583 3.396
377 HG LEU 52 HG LEU 52 -1.627 1.195 3.967
378 HD11 LEU 52 HD11 LEU 52 -1.413 0.878 1.553
379 HD12 LEU 52 HD12 LEU 52 -3.170 0.933 1.391
380 HD13 LEU 52 HD13 LEU 52 -2.406 -0.379 2.289
381 HD21 LEU 52 HD21 LEU 52 -3.105 3.296 2.387
382 HD22 LEU 52 HD22 LEU 52 -1.353 3.133 2.493
383 HD23 LEU 52 HD23 LEU 52 -2.290 3.530 3.934
384 H GLU 53 HN GLU 53 -4.690 -0.231 6.510
385 HA GLU 53 HA GLU 53 -7.466 0.012 6.332
386 HB2 GLU 53 HB2 GLU 53 -5.823 -1.501 8.369
387 HB3 GLU 53 HB1 GLU 53 -7.548 -1.706 8.125
388 HG2 GLU 53 HG2 GLU 53 -7.128 -2.461 5.833
389 HG3 GLU 53 HG1 GLU 53 -5.396 -2.281 6.107
390 H SER 54 HN SER 54 -5.300 0.803 9.050
391 HA SER 54 HA SER 54 -7.305 1.541 10.870
392 HB2 SER 54 HB2 SER 54 -4.473 2.598 10.753
393 HB3 SER 54 HB1 SER 54 -5.525 2.551 12.167
394 HG SER 54 HG SER 54 -5.373 0.081 11.158
395 H ARG 55 HN ARG 55 -5.677 3.367 8.349
396 HA ARG 55 HA ARG 55 -6.430 5.940 9.365
397 HB2 ARG 55 HB2 ARG 55 -4.379 5.574 8.043
398 HB3 ARG 55 HB1 ARG 55 -5.360 5.166 6.642
399 HG2 ARG 55 HG2 ARG 55 -6.179 7.391 6.462
400 HG3 ARG 55 HG1 ARG 55 -5.507 7.829 8.034
401 HD2 ARG 55 HD2 ARG 55 -3.914 7.057 5.588
402 HD3 ARG 55 HD1 ARG 55 -4.134 8.698 6.198
403 HE ARG 55 HE ARG 55 -3.113 7.234 8.302
404 HH11 ARG 55 HH11 ARG 55 -2.058 8.237 5.112
405 HH12 ARG 55 HH12 ARG 55 -0.370 8.102 5.497
406 HH21 ARG 55 HH21 ARG 55 -0.892 7.087 8.804
407 HH22 ARG 55 HH22 ARG 55 0.302 7.467 7.595
408 H TYR 56 HN TYR 56 -7.609 3.854 6.747
409 HA TYR 56 HA TYR 56 -9.669 5.846 6.145
410 HB2 TYR 56 HB2 TYR 56 -8.713 3.432 4.609
411 HB3 TYR 56 HB1 TYR 56 -10.079 4.429 4.112
412 HD1 TYR 56 HD2 TYR 56 -9.676 6.868 3.589
413 HD2 TYR 56 HD1 TYR 56 -6.498 4.095 4.144
414 HE1 TYR 56 HE2 TYR 56 -8.139 8.405 2.441
415 HE2 TYR 56 HE1 TYR 56 -4.951 5.624 2.998
416 HH TYR 56 HH TYR 56 -5.038 7.481 1.396
417 H GLY 57 HN GLY 57 -9.333 3.053 7.964
418 HA2 GLY 57 HA2 GLY 57 -10.911 1.890 9.171
419 HA3 GLY 57 HA1 GLY 57 -12.138 2.963 8.513
420 H VAL 58 HN VAL 58 -9.884 0.800 6.868
421 HA VAL 58 HA VAL 58 -12.215 -0.516 5.636
422 HB VAL 58 HB VAL 58 -10.827 -1.021 3.690
423 HG11 VAL 58 HG11 VAL 58 -10.741 1.891 4.458
424 HG12 VAL 58 HG12 VAL 58 -12.074 1.055 3.658
425 HG13 VAL 58 HG13 VAL 58 -10.531 1.259 2.825
426 HG21 VAL 58 HG21 VAL 58 -8.667 -1.181 4.832
427 HG22 VAL 58 HG22 VAL 58 -8.672 0.564 5.083
428 HG23 VAL 58 HG23 VAL 58 -8.587 -0.092 3.448
429 H SER 59 HN SER 59 -11.245 -2.723 4.581
430 HA SER 59 HA SER 59 -9.568 -4.116 6.515
431 HB2 SER 59 HB2 SER 59 -12.275 -5.144 5.615
432 HB3 SER 59 HB1 SER 59 -11.159 -5.962 6.702
433 HG SER 59 HG SER 59 -12.873 -4.832 7.790
434 H ILE 60 HN ILE 60 -8.002 -5.064 5.365
435 HA ILE 60 HA ILE 60 -8.446 -5.516 2.512
436 HB ILE 60 HB ILE 60 -5.889 -5.706 4.121
437 HG12 ILE 60 HG12 ILE 60 -6.869 -3.568 2.208
438 HG13 ILE 60 HG11 ILE 60 -6.813 -3.421 3.961
439 HG21 ILE 60 HG21 ILE 60 -4.748 -5.792 1.962
440 HG22 ILE 60 HG22 ILE 60 -6.303 -5.772 1.128
441 HG23 ILE 60 HG23 ILE 60 -5.860 -7.150 2.137
442 HD11 ILE 60 HD11 ILE 60 -4.947 -2.272 2.919
443 HD12 ILE 60 HD12 ILE 60 -4.436 -3.775 2.151
444 HD13 ILE 60 HD13 ILE 60 -4.387 -3.622 3.907
445 HA PRO 61 HA PRO 61 -9.279 -9.820 3.504
446 HB2 PRO 61 HB2 PRO 61 -9.536 -10.066 0.583
447 HB3 PRO 61 HB1 PRO 61 -10.730 -10.380 1.846
448 HG2 PRO 61 HG2 PRO 61 -10.925 -8.266 0.201
449 HG3 PRO 61 HG1 PRO 61 -11.451 -8.193 1.894
450 HD2 PRO 61 HD2 PRO 61 -8.930 -7.164 0.645
451 HD3 PRO 61 HD1 PRO 61 -9.968 -6.408 1.873
452 H ASP 62 HN ASP 62 -7.752 -11.304 3.805
453 HA ASP 62 HA ASP 62 -5.187 -11.089 2.645
454 HB2 ASP 62 HB2 ASP 62 -4.672 -13.202 3.807
455 HB3 ASP 62 HB1 ASP 62 -5.454 -12.037 4.869
456 H ASP 63 HN ASP 63 -8.017 -12.389 1.409
457 HA ASP 63 HA ASP 63 -6.881 -14.373 -0.310
458 HB2 ASP 63 HB2 ASP 63 -9.437 -12.766 -0.575
459 HB3 ASP 63 HB1 ASP 63 -8.998 -14.131 -1.596
460 H VAL 64 HN VAL 64 -8.022 -11.040 -0.836
461 HA VAL 64 HA VAL 64 -6.946 -10.959 -3.493
462 HB VAL 64 HB VAL 64 -7.820 -8.541 -1.942
463 HG11 VAL 64 HG11 VAL 64 -8.479 -7.723 -4.155
464 HG12 VAL 64 HG12 VAL 64 -7.927 -9.234 -4.878
465 HG13 VAL 64 HG13 VAL 64 -6.770 -8.149 -4.107
466 HG21 VAL 64 HG21 VAL 64 -9.614 -10.481 -3.397
467 HG22 VAL 64 HG22 VAL 64 -10.103 -8.920 -2.737
468 HG23 VAL 64 HG23 VAL 64 -9.570 -10.208 -1.657
469 H ALA 65 HN ALA 65 -5.793 -10.246 -0.349
470 HA ALA 65 HA ALA 65 -3.791 -8.372 -0.899
471 HB1 ALA 65 HB1 ALA 65 -4.460 -8.917 1.368
472 HB2 ALA 65 HB2 ALA 65 -2.726 -9.161 1.168
473 HB3 ALA 65 HB3 ALA 65 -3.816 -10.549 1.187
474 H GLY 66 HN GLY 66 -3.959 -11.789 -1.462
475 HA2 GLY 66 HA2 GLY 66 -1.120 -11.879 -2.195
476 HA3 GLY 66 HA1 GLY 66 -2.187 -13.266 -2.025
477 H ARG 67 HN ARG 67 -3.619 -10.711 -3.716
478 HA ARG 67 HA ARG 67 -3.108 -12.104 -6.256
479 HB2 ARG 67 HB2 ARG 67 -5.430 -10.343 -5.439
480 HB3 ARG 67 HB1 ARG 67 -5.219 -11.044 -7.039
481 HG2 ARG 67 HG2 ARG 67 -5.366 -13.284 -6.083
482 HG3 ARG 67 HG1 ARG 67 -5.552 -12.590 -4.473
483 HD2 ARG 67 HD2 ARG 67 -7.704 -13.275 -5.438
484 HD3 ARG 67 HD1 ARG 67 -7.640 -11.540 -5.138
485 HE ARG 67 HE ARG 67 -6.881 -12.255 -7.818
486 HH11 ARG 67 HH11 ARG 67 -9.646 -11.705 -5.727
487 HH12 ARG 67 HH12 ARG 67 -10.659 -11.134 -7.022
488 HH21 ARG 67 HH21 ARG 67 -8.217 -11.535 -9.503
489 HH22 ARG 67 HH22 ARG 67 -9.848 -11.048 -9.171
490 H VAL 68 HN VAL 68 -2.227 -9.394 -4.568
491 HA VAL 68 HA VAL 68 -1.962 -7.719 -6.958
492 HB VAL 68 HB VAL 68 -1.336 -5.894 -5.444
493 HG11 VAL 68 HG11 VAL 68 -3.877 -7.318 -4.666
494 HG12 VAL 68 HG12 VAL 68 -3.675 -6.164 -5.987
495 HG13 VAL 68 HG13 VAL 68 -3.509 -5.631 -4.313
496 HG21 VAL 68 HG21 VAL 68 -0.247 -7.180 -3.688
497 HG22 VAL 68 HG22 VAL 68 -1.790 -7.905 -3.239
498 HG23 VAL 68 HG23 VAL 68 -1.528 -6.177 -3.007
499 H ASP 69 HN ASP 69 0.126 -6.489 -7.135
500 HA ASP 69 HA ASP 69 2.457 -7.825 -6.009
501 HB2 ASP 69 HB2 ASP 69 1.899 -8.972 -8.192
502 HB3 ASP 69 HB1 ASP 69 2.181 -7.438 -9.001
503 H THR 70 HN THR 70 1.070 -5.257 -7.969
504 HA THR 70 HA THR 70 3.278 -3.492 -7.138
505 HB THR 70 HB THR 70 2.493 -2.004 -9.020
506 HG1 THR 70 HG1 THR 70 0.880 -4.301 -9.524
507 HG21 THR 70 HG21 THR 70 4.453 -3.434 -9.282
508 HG22 THR 70 HG22 THR 70 3.545 -3.345 -10.794
509 HG23 THR 70 HG23 THR 70 3.419 -4.775 -9.771
510 HA PRO 71 HA PRO 71 0.566 -1.073 -4.545
511 HB2 PRO 71 HB2 PRO 71 1.894 1.272 -5.805
512 HB3 PRO 71 HB1 PRO 71 1.717 0.863 -4.096
513 HG2 PRO 71 HG2 PRO 71 4.052 0.566 -5.339
514 HG3 PRO 71 HG1 PRO 71 3.508 -0.605 -4.124
515 HD2 PRO 71 HD2 PRO 71 3.554 -0.831 -7.098
516 HD3 PRO 71 HD1 PRO 71 3.855 -2.069 -5.864
517 H ARG 72 HN ARG 72 0.979 -0.297 -7.934
518 HA ARG 72 HA ARG 72 -1.153 1.400 -8.411
519 HB2 ARG 72 HB2 ARG 72 0.710 0.084 -9.933
520 HB3 ARG 72 HB1 ARG 72 -0.773 -0.721 -10.421
521 HG2 ARG 72 HG2 ARG 72 -0.733 2.250 -10.378
522 HG3 ARG 72 HG1 ARG 72 0.129 1.413 -11.669
523 HD2 ARG 72 HD2 ARG 72 -2.022 1.847 -12.513
524 HD3 ARG 72 HD1 ARG 72 -2.020 0.140 -12.078
525 HE ARG 72 HE ARG 72 -3.019 1.374 -9.869
526 HH11 ARG 72 HH11 ARG 72 -3.859 1.385 -13.267
527 HH12 ARG 72 HH12 ARG 72 -5.555 1.659 -12.980
528 HH21 ARG 72 HH21 ARG 72 -5.251 1.743 -9.493
529 HH22 ARG 72 HH22 ARG 72 -6.343 1.838 -10.836
530 H GLU 73 HN GLU 73 -1.109 -2.146 -8.345
531 HA GLU 73 HA GLU 73 -3.883 -2.499 -8.851
532 HB2 GLU 73 HB2 GLU 73 -1.943 -4.370 -7.487
533 HB3 GLU 73 HB1 GLU 73 -3.493 -4.817 -8.187
534 HG2 GLU 73 HG2 GLU 73 -2.711 -4.371 -10.388
535 HG3 GLU 73 HG1 GLU 73 -1.230 -3.639 -9.769
536 H LEU 74 HN LEU 74 -1.930 -2.474 -5.904
537 HA LEU 74 HA LEU 74 -3.902 -3.188 -4.060
538 HB2 LEU 74 HB2 LEU 74 -1.350 -2.904 -3.777
539 HB3 LEU 74 HB1 LEU 74 -1.703 -1.218 -3.466
540 HG LEU 74 HG LEU 74 -1.369 -2.646 -1.431
541 HD11 LEU 74 HD11 LEU 74 -3.186 -1.667 -0.169
542 HD12 LEU 74 HD12 LEU 74 -4.070 -1.331 -1.660
543 HD13 LEU 74 HD13 LEU 74 -2.547 -0.505 -1.328
544 HD21 LEU 74 HD21 LEU 74 -3.984 -3.835 -2.338
545 HD22 LEU 74 HD22 LEU 74 -3.288 -4.048 -0.730
546 HD23 LEU 74 HD23 LEU 74 -2.442 -4.668 -2.150
547 H LEU 75 HN LEU 75 -2.914 -0.004 -5.217
548 HA LEU 75 HA LEU 75 -4.648 1.591 -3.744
549 HB2 LEU 75 HB2 LEU 75 -2.825 2.467 -5.107
550 HB3 LEU 75 HB1 LEU 75 -3.641 1.947 -6.566
551 HG LEU 75 HG LEU 75 -5.488 3.550 -6.010
552 HD11 LEU 75 HD11 LEU 75 -4.986 5.339 -4.405
553 HD12 LEU 75 HD12 LEU 75 -3.519 4.482 -3.924
554 HD13 LEU 75 HD13 LEU 75 -5.100 3.760 -3.629
555 HD21 LEU 75 HD21 LEU 75 -4.208 5.541 -6.711
556 HD22 LEU 75 HD22 LEU 75 -3.821 4.107 -7.662
557 HD23 LEU 75 HD23 LEU 75 -2.711 4.659 -6.408
558 H ASP 76 HN ASP 76 -5.159 -0.047 -6.840
559 HA ASP 76 HA ASP 76 -7.698 1.133 -7.346
560 HB2 ASP 76 HB2 ASP 76 -6.052 0.069 -9.010
561 HB3 ASP 76 HB1 ASP 76 -6.750 -1.470 -8.519
562 H LEU 77 HN LEU 77 -6.626 -1.672 -5.621
563 HA LEU 77 HA LEU 77 -9.072 -3.069 -5.446
564 HB2 LEU 77 HB2 LEU 77 -6.992 -4.149 -4.872
565 HB3 LEU 77 HB1 LEU 77 -6.687 -2.982 -3.601
566 HG LEU 77 HG LEU 77 -8.635 -3.860 -2.355
567 HD11 LEU 77 HD11 LEU 77 -9.592 -6.029 -3.048
568 HD12 LEU 77 HD12 LEU 77 -8.726 -5.892 -4.578
569 HD13 LEU 77 HD13 LEU 77 -9.974 -4.718 -4.161
570 HD21 LEU 77 HD21 LEU 77 -6.434 -4.680 -1.817
571 HD22 LEU 77 HD22 LEU 77 -6.522 -5.870 -3.114
572 HD23 LEU 77 HD23 LEU 77 -7.593 -6.006 -1.719
573 H ILE 78 HN ILE 78 -7.498 -0.929 -3.068
574 HA ILE 78 HA ILE 78 -9.710 -1.012 -1.291
575 HB ILE 78 HB ILE 78 -7.436 0.979 -1.385
576 HG12 ILE 78 HG12 ILE 78 -7.769 -1.619 0.142
577 HG13 ILE 78 HG11 ILE 78 -6.636 -1.321 -1.175
578 HG21 ILE 78 HG21 ILE 78 -9.357 0.291 0.838
579 HG22 ILE 78 HG22 ILE 78 -9.321 1.798 -0.078
580 HG23 ILE 78 HG23 ILE 78 -7.972 1.376 0.978
581 HD11 ILE 78 HD11 ILE 78 -5.509 -1.275 0.970
582 HD12 ILE 78 HD12 ILE 78 -6.597 -0.006 1.539
583 HD13 ILE 78 HD13 ILE 78 -5.472 0.320 0.219
584 H ASN 79 HN ASN 79 -8.589 1.433 -3.623
585 HA ASN 79 HA ASN 79 -10.580 3.345 -3.095
586 HB2 ASN 79 HB2 ASN 79 -8.924 2.804 -5.555
587 HB3 ASN 79 HB1 ASN 79 -10.090 4.120 -5.485
588 HD21 ASN 79 HD21 ASN 79 -8.484 5.687 -5.694
589 HD22 ASN 79 HD22 ASN 79 -7.384 6.055 -4.409
590 H GLY 80 HN GLY 80 -10.553 0.528 -5.211
591 HA2 GLY 80 HA2 GLY 80 -12.899 1.065 -6.659
592 HA3 GLY 80 HA1 GLY 80 -12.232 -0.534 -6.365
593 H ALA 81 HN ALA 81 -12.419 -0.420 -3.507
594 HA ALA 81 HA ALA 81 -15.138 -1.236 -3.181
595 HB1 ALA 81 HB1 ALA 81 -12.952 -0.827 -1.138
596 HB2 ALA 81 HB2 ALA 81 -13.349 -2.336 -1.959
597 HB3 ALA 81 HB3 ALA 81 -14.500 -1.615 -0.833
598 H LEU 82 HN LEU 82 -13.220 1.537 -2.071
599 HA LEU 82 HA LEU 82 -15.261 2.671 -0.459
600 HB2 LEU 82 HB2 LEU 82 -12.820 3.939 -1.693
601 HB3 LEU 82 HB1 LEU 82 -13.825 4.684 -0.467
602 HG LEU 82 HG LEU 82 -12.274 2.126 -0.079
603 HD11 LEU 82 HD11 LEU 82 -11.665 4.926 0.858
604 HD12 LEU 82 HD12 LEU 82 -10.787 4.037 -0.387
605 HD13 LEU 82 HD13 LEU 82 -10.763 3.472 1.285
606 HD21 LEU 82 HD21 LEU 82 -12.797 2.467 2.286
607 HD22 LEU 82 HD22 LEU 82 -14.265 2.291 1.324
608 HD23 LEU 82 HD23 LEU 82 -13.756 3.889 1.871
609 H ALA 83 HN ALA 83 -14.507 2.905 -3.847
610 HA ALA 83 HA ALA 83 -15.848 5.343 -4.395
611 HB1 ALA 83 HB1 ALA 83 -15.692 4.694 -6.739
612 HB2 ALA 83 HB2 ALA 83 -15.239 3.057 -6.264
613 HB3 ALA 83 HB3 ALA 83 -14.168 4.410 -5.899
614 H GLU 84 HN GLU 84 -17.132 2.423 -3.430
615 HA GLU 84 HA GLU 84 -19.548 2.549 -5.014
616 HB2 GLU 84 HB2 GLU 84 -18.556 0.400 -4.147
617 HB3 GLU 84 HB1 GLU 84 -19.016 0.910 -2.528
618 HG2 GLU 84 HG2 GLU 84 -21.355 0.922 -3.175
619 HG3 GLU 84 HG1 GLU 84 -20.915 0.464 -4.820
620 H ALA 85 HN ALA 85 -18.330 4.101 -2.274
621 HA ALA 85 HA ALA 85 -21.038 4.811 -1.353
622 HB1 ALA 85 HB1 ALA 85 -18.416 5.074 0.118
623 HB2 ALA 85 HB2 ALA 85 -19.623 3.814 0.378
624 HB3 ALA 85 HB3 ALA 85 -20.007 5.494 0.750
625 H ALA 86 HN ALA 86 -21.167 7.121 -0.509
626 HA ALA 86 HA ALA 86 -20.066 8.866 -2.567
627 HB1 ALA 86 HB1 ALA 86 -21.754 10.488 -1.796
628 HB2 ALA 86 HB2 ALA 86 -22.254 9.347 -0.545
629 HB3 ALA 86 HB3 ALA 86 -22.472 8.942 -2.246
630 H28 SXO 87 H28B SXO 87 6.181 -11.768 5.947
631 H28A SXO 87 H28A SXO 87 6.765 -12.529 7.427
632 H30 SXO 87 H30A SXO 87 3.978 -11.481 6.422
633 H30A SXO 87 H30C SXO 87 3.022 -12.682 7.292
634 H30B SXO 87 H30B SXO 87 4.379 -11.886 8.090
635 H31 SXO 87 H31A SXO 87 3.473 -14.414 5.508
636 H31A SXO 87 H31B SXO 87 5.133 -14.665 4.969
637 H31B SXO 87 H31C SXO 87 4.315 -13.140 4.624
638 H32 SXO 87 H32A SXO 87 5.372 -14.092 8.658
639 HO33 SXO 87 H33A SXO 87 5.590 -16.065 6.641
640 HN36 SXO 87 H36A SXO 87 3.033 -13.678 9.001
641 H37 SXO 87 H37A SXO 87 1.283 -15.968 8.343
642 H37A SXO 87 H37B SXO 87 1.408 -15.316 9.972
643 H38 SXO 87 H38B SXO 87 0.715 -13.073 8.910
644 H38A SXO 87 H38A SXO 87 -0.516 -14.317 9.155
645 HN41 SXO 87 H41A SXO 87 0.322 -12.041 7.119
646 H42 SXO 87 H42A SXO 87 0.021 -13.441 4.585
647 H42A SXO 87 H42B SXO 87 -1.313 -12.401 5.072
648 H43 SXO 87 H43B SXO 87 0.265 -10.497 5.203
649 H43A SXO 87 H43A SXO 87 1.541 -11.559 4.585
650 H2 SXO 87 H2A SXO 87 -0.266 -9.500 0.882
651 H2A SXO 87 H2B SXO 87 1.377 -8.895 0.681
652 H3 SXO 87 H3B SXO 87 -0.714 -7.591 2.420
653 H3A SXO 87 H3A SXO 87 0.879 -6.951 2.010
654 H4 SXO 87 H4A SXO 87 -1.403 -7.449 0.099
655 H4A SXO 87 H4B SXO 87 0.206 -6.896 -0.369
656 H5 SXO 87 H5B SXO 87 -1.488 -5.078 -0.179
657 H5A SXO 87 H5A SXO 87 -1.598 -5.424 1.548
658 H6 SXO 87 H6A SXO 87 0.913 -4.602 0.082
659 H6A SXO 87 H6B SXO 87 0.768 -4.896 1.818
660 H7 SXO 87 H7A SXO 87 -0.800 -3.033 2.019
661 H7A SXO 87 H7B SXO 87 -0.693 -2.749 0.272
662 H8 SXO 87 H8C SXO 87 1.606 -2.607 2.216
663 H8A SXO 87 H8A SXO 87 0.746 -1.221 1.546
664 H8B SXO 87 H8B SXO 87 1.680 -2.276 0.485
Start of MODEL 7
1 H1 MET 1 HT1 MET 1 -18.307 12.806 2.811
2 H2 MET 1 HT2 MET 1 -19.285 11.955 1.720
3 H3 MET 1 HT3 MET 1 -19.539 13.611 1.970
4 HA MET 1 HA MET 1 -18.427 13.275 -0.112
5 HB2 MET 1 HB2 MET 1 -16.562 14.380 2.006
6 HB3 MET 1 HB1 MET 1 -16.433 14.682 0.280
7 HG2 MET 1 HG2 MET 1 -18.695 15.524 2.073
8 HG3 MET 1 HG1 MET 1 -17.433 16.565 1.420
9 HE1 MET 1 HE1 MET 1 -20.746 17.640 -0.451
10 HE2 MET 1 HE2 MET 1 -19.412 18.203 0.556
11 HE3 MET 1 HE3 MET 1 -20.597 17.070 1.210
12 H ALA 2 HN ALA 2 -16.510 12.038 2.599
13 HA ALA 2 HA ALA 2 -15.147 10.261 2.840
14 HB1 ALA 2 HB1 ALA 2 -16.283 9.310 0.219
15 HB2 ALA 2 HB2 ALA 2 -16.973 9.003 1.813
16 HB3 ALA 2 HB3 ALA 2 -15.396 8.337 1.391
17 H THR 3 HN THR 3 -13.145 11.084 2.777
18 HA THR 3 HA THR 3 -11.813 11.589 0.261
19 HB THR 3 HB THR 3 -11.243 13.071 2.069
20 HG1 THR 3 HG1 THR 3 -8.982 11.377 1.852
21 HG21 THR 3 HG21 THR 3 -11.765 11.646 3.975
22 HG22 THR 3 HG22 THR 3 -10.138 12.311 4.125
23 HG23 THR 3 HG23 THR 3 -10.361 10.635 3.622
24 H LEU 4 HN LEU 4 -11.148 9.933 -0.908
25 HA LEU 4 HA LEU 4 -10.756 7.326 0.236
26 HB2 LEU 4 HB2 LEU 4 -10.201 8.239 -2.585
27 HB3 LEU 4 HB1 LEU 4 -10.383 6.584 -2.034
28 HG LEU 4 HG LEU 4 -12.547 8.688 -2.192
29 HD11 LEU 4 HD11 LEU 4 -13.545 7.107 -3.798
30 HD12 LEU 4 HD12 LEU 4 -12.106 6.094 -3.667
31 HD13 LEU 4 HD13 LEU 4 -11.982 7.722 -4.336
32 HD21 LEU 4 HD21 LEU 4 -14.077 6.969 -1.401
33 HD22 LEU 4 HD22 LEU 4 -12.836 7.301 -0.193
34 HD23 LEU 4 HD23 LEU 4 -12.730 5.849 -1.187
35 H LEU 5 HN LEU 5 -8.764 6.131 -0.939
36 HA LEU 5 HA LEU 5 -6.446 7.185 0.420
37 HB2 LEU 5 HB2 LEU 5 -7.371 4.701 0.017
38 HB3 LEU 5 HB1 LEU 5 -6.317 4.811 -1.375
39 HG LEU 5 HG LEU 5 -5.422 5.191 1.484
40 HD11 LEU 5 HD11 LEU 5 -5.148 2.814 -0.345
41 HD12 LEU 5 HD12 LEU 5 -6.143 2.910 1.107
42 HD13 LEU 5 HD13 LEU 5 -4.386 2.987 1.236
43 HD21 LEU 5 HD21 LEU 5 -3.169 4.954 0.557
44 HD22 LEU 5 HD22 LEU 5 -4.000 6.371 -0.084
45 HD23 LEU 5 HD23 LEU 5 -3.846 4.916 -1.070
46 H THR 6 HN THR 6 -4.964 8.496 -0.562
47 HA THR 6 HA THR 6 -4.929 8.586 -3.499
48 HB THR 6 HB THR 6 -3.899 10.768 -3.331
49 HG1 THR 6 HG1 THR 6 -4.088 10.735 -0.503
50 HG21 THR 6 HG21 THR 6 -6.200 10.560 -1.386
51 HG22 THR 6 HG22 THR 6 -6.343 10.700 -3.138
52 HG23 THR 6 HG23 THR 6 -5.665 12.030 -2.199
53 H THR 7 HN THR 7 -2.693 9.147 -4.444
54 HA THR 7 HA THR 7 -0.836 7.145 -3.764
55 HB THR 7 HB THR 7 0.760 8.708 -5.163
56 HG1 THR 7 HG1 THR 7 -1.478 9.628 -6.459
57 HG21 THR 7 HG21 THR 7 -1.654 7.322 -6.326
58 HG22 THR 7 HG22 THR 7 -0.109 6.568 -5.930
59 HG23 THR 7 HG23 THR 7 -0.203 7.767 -7.221
60 H ASP 8 HN ASP 8 -1.075 10.547 -2.782
61 HA ASP 8 HA ASP 8 1.457 10.577 -1.453
62 HB2 ASP 8 HB2 ASP 8 0.371 12.675 -2.132
63 HB3 ASP 8 HB1 ASP 8 -0.948 12.368 -1.004
64 H ASP 9 HN ASP 9 -1.849 9.920 -0.471
65 HA ASP 9 HA ASP 9 -1.466 9.550 2.272
66 HB2 ASP 9 HB2 ASP 9 -3.384 8.459 0.262
67 HB3 ASP 9 HB1 ASP 9 -3.324 7.703 1.846
68 H LEU 10 HN LEU 10 -1.149 7.283 -0.417
69 HA LEU 10 HA LEU 10 -0.316 5.072 1.156
70 HB2 LEU 10 HB2 LEU 10 -1.255 4.984 -1.180
71 HB3 LEU 10 HB1 LEU 10 0.285 5.586 -1.755
72 HG LEU 10 HG LEU 10 1.397 3.570 -0.866
73 HD11 LEU 10 HD11 LEU 10 -1.412 2.703 -0.196
74 HD12 LEU 10 HD12 LEU 10 -0.115 3.045 0.948
75 HD13 LEU 10 HD13 LEU 10 0.015 1.667 -0.147
76 HD21 LEU 10 HD21 LEU 10 -0.920 3.058 -2.728
77 HD22 LEU 10 HD22 LEU 10 0.469 1.993 -2.511
78 HD23 LEU 10 HD23 LEU 10 0.694 3.607 -3.182
79 H ARG 11 HN ARG 11 1.394 7.630 -0.591
80 HA ARG 11 HA ARG 11 4.010 6.755 -0.383
81 HB2 ARG 11 HB2 ARG 11 3.334 8.763 -1.646
82 HB3 ARG 11 HB1 ARG 11 3.001 9.601 -0.137
83 HG2 ARG 11 HG2 ARG 11 5.365 9.443 0.475
84 HG3 ARG 11 HG1 ARG 11 5.694 8.600 -1.037
85 HD2 ARG 11 HD2 ARG 11 6.317 10.880 -1.334
86 HD3 ARG 11 HD1 ARG 11 4.847 10.604 -2.259
87 HE ARG 11 HE ARG 11 3.621 11.827 -0.571
88 HH11 ARG 11 HH11 ARG 11 7.116 12.040 -0.363
89 HH12 ARG 11 HH12 ARG 11 7.107 13.523 0.540
90 HH21 ARG 11 HH21 ARG 11 3.592 13.784 0.562
91 HH22 ARG 11 HH22 ARG 11 5.087 14.536 1.058
92 H ARG 12 HN ARG 12 2.209 8.778 1.918
93 HA ARG 12 HA ARG 12 4.215 8.921 3.878
94 HB2 ARG 12 HB2 ARG 12 1.223 9.182 4.018
95 HB3 ARG 12 HB1 ARG 12 2.230 9.327 5.447
96 HG2 ARG 12 HG2 ARG 12 3.500 11.116 4.140
97 HG3 ARG 12 HG1 ARG 12 2.118 11.103 3.042
98 HD2 ARG 12 HD2 ARG 12 1.820 12.842 4.695
99 HD3 ARG 12 HD1 ARG 12 0.629 11.569 4.958
100 HE ARG 12 HE ARG 12 2.510 10.781 6.652
101 HH11 ARG 12 HH11 ARG 12 1.163 13.974 6.124
102 HH12 ARG 12 HH12 ARG 12 1.580 14.545 7.711
103 HH21 ARG 12 HH21 ARG 12 3.041 11.507 8.734
104 HH22 ARG 12 HH22 ARG 12 2.643 13.144 9.201
105 H ALA 13 HN ALA 13 1.631 6.586 3.348
106 HA ALA 13 HA ALA 13 1.737 5.316 5.840
107 HB1 ALA 13 HB1 ALA 13 0.493 3.514 4.806
108 HB2 ALA 13 HB2 ALA 13 0.917 4.112 3.203
109 HB3 ALA 13 HB3 ALA 13 -0.123 5.072 4.257
110 H LEU 14 HN LEU 14 3.514 4.665 2.856
111 HA LEU 14 HA LEU 14 4.757 2.304 3.857
112 HB2 LEU 14 HB2 LEU 14 5.199 4.060 1.479
113 HB3 LEU 14 HB1 LEU 14 6.438 2.905 1.922
114 HG LEU 14 HG LEU 14 5.009 1.997 0.180
115 HD11 LEU 14 HD11 LEU 14 4.383 -0.108 1.235
116 HD12 LEU 14 HD12 LEU 14 4.528 0.639 2.826
117 HD13 LEU 14 HD13 LEU 14 5.955 0.451 1.809
118 HD21 LEU 14 HD21 LEU 14 2.977 3.258 0.651
119 HD22 LEU 14 HD22 LEU 14 2.743 2.343 2.140
120 HD23 LEU 14 HD23 LEU 14 2.644 1.526 0.580
121 H VAL 15 HN VAL 15 5.849 5.671 3.499
122 HA VAL 15 HA VAL 15 8.488 5.246 4.391
123 HB VAL 15 HB VAL 15 6.830 7.775 4.484
124 HG11 VAL 15 HG11 VAL 15 8.761 7.916 5.970
125 HG12 VAL 15 HG12 VAL 15 8.954 8.965 4.566
126 HG13 VAL 15 HG13 VAL 15 9.819 7.430 4.644
127 HG21 VAL 15 HG21 VAL 15 7.029 6.856 2.235
128 HG22 VAL 15 HG22 VAL 15 8.783 6.782 2.411
129 HG23 VAL 15 HG23 VAL 15 7.964 8.343 2.392
130 H GLU 16 HN GLU 16 5.648 6.506 6.144
131 HA GLU 16 HA GLU 16 7.030 6.811 8.600
132 HB2 GLU 16 HB2 GLU 16 4.081 6.697 7.972
133 HB3 GLU 16 HB1 GLU 16 4.723 7.059 9.569
134 HG2 GLU 16 HG2 GLU 16 5.825 9.029 8.729
135 HG3 GLU 16 HG1 GLU 16 5.327 8.645 7.084
136 H SER 17 HN SER 17 5.496 4.060 7.123
137 HA SER 17 HA SER 17 5.309 2.606 9.615
138 HB2 SER 17 HB2 SER 17 3.753 2.279 7.614
139 HB3 SER 17 HB1 SER 17 5.094 1.436 6.837
140 HG SER 17 HG SER 17 4.854 -0.210 8.159
141 H ALA 18 HN ALA 18 7.565 2.967 6.982
142 HA ALA 18 HA ALA 18 9.133 0.664 7.628
143 HB1 ALA 18 HB1 ALA 18 9.093 1.618 5.366
144 HB2 ALA 18 HB2 ALA 18 10.731 1.533 6.017
145 HB3 ALA 18 HB3 ALA 18 9.878 3.075 5.976
146 H GLY 19 HN GLY 19 9.891 4.153 7.844
147 HA2 GLY 19 HA2 GLY 19 10.588 4.992 10.064
148 HA3 GLY 19 HA1 GLY 19 11.506 3.505 10.236
149 H GLU 20 HN GLU 20 11.201 6.293 8.074
150 HA GLU 20 HA GLU 20 12.695 7.650 7.075
151 HB2 GLU 20 HB2 GLU 20 14.609 6.541 9.137
152 HB3 GLU 20 HB1 GLU 20 14.933 7.923 8.098
153 HG2 GLU 20 HG2 GLU 20 12.677 7.763 10.086
154 HG3 GLU 20 HG1 GLU 20 14.224 8.559 10.373
155 H THR 21 HN THR 21 12.583 6.574 5.119
156 HA THR 21 HA THR 21 14.455 4.428 4.543
157 HB THR 21 HB THR 21 12.720 5.777 2.507
158 HG1 THR 21 HG1 THR 21 11.449 3.686 3.599
159 HG21 THR 21 HG21 THR 21 12.603 3.536 1.565
160 HG22 THR 21 HG22 THR 21 13.520 2.897 2.927
161 HG23 THR 21 HG23 THR 21 14.284 4.014 1.795
162 H ASP 22 HN ASP 22 16.487 5.076 4.257
163 HA ASP 22 HA ASP 22 17.069 7.674 3.072
164 HB2 ASP 22 HB2 ASP 22 18.205 6.914 5.171
165 HB3 ASP 22 HB1 ASP 22 18.984 5.644 4.234
166 H GLY 23 HN GLY 23 17.233 7.773 0.934
167 HA2 GLY 23 HA2 GLY 23 18.479 7.404 -1.036
168 HA3 GLY 23 HA1 GLY 23 18.983 5.846 -0.401
169 H THR 24 HN THR 24 15.638 6.762 -0.280
170 HA THR 24 HA THR 24 15.027 5.163 -2.655
171 HB THR 24 HB THR 24 13.722 4.617 0.017
172 HG1 THR 24 HG1 THR 24 16.073 3.717 -1.025
173 HG21 THR 24 HG21 THR 24 12.846 2.615 -1.162
174 HG22 THR 24 HG22 THR 24 13.564 3.214 -2.658
175 HG23 THR 24 HG23 THR 24 12.277 4.127 -1.872
176 H ASP 25 HN ASP 25 14.069 6.777 -3.781
177 HA ASP 25 HA ASP 25 12.236 8.604 -2.470
178 HB2 ASP 25 HB2 ASP 25 13.745 9.452 -4.225
179 HB3 ASP 25 HB1 ASP 25 12.985 8.376 -5.396
180 H LEU 26 HN LEU 26 10.207 8.151 -2.163
181 HA LEU 26 HA LEU 26 8.781 6.520 -4.155
182 HB2 LEU 26 HB2 LEU 26 8.257 6.810 -1.192
183 HB3 LEU 26 HB1 LEU 26 7.199 5.963 -2.307
184 HG LEU 26 HG LEU 26 10.048 5.180 -1.664
185 HD11 LEU 26 HD11 LEU 26 9.016 3.280 -0.512
186 HD12 LEU 26 HD12 LEU 26 7.419 3.957 -0.832
187 HD13 LEU 26 HD13 LEU 26 8.550 4.817 0.214
188 HD21 LEU 26 HD21 LEU 26 9.537 3.147 -2.928
189 HD22 LEU 26 HD22 LEU 26 9.402 4.583 -3.945
190 HD23 LEU 26 HD23 LEU 26 7.948 3.795 -3.335
191 H SER 27 HN SER 27 9.314 9.409 -4.108
192 HA SER 27 HA SER 27 6.702 10.539 -3.448
193 HB2 SER 27 HB2 SER 27 8.933 11.605 -2.739
194 HB3 SER 27 HB1 SER 27 9.095 12.082 -4.428
195 HG SER 27 HG SER 27 7.182 13.262 -4.242
196 H GLY 28 HN GLY 28 8.740 9.689 -6.115
197 HA2 GLY 28 HA2 GLY 28 7.165 11.051 -8.099
198 HA3 GLY 28 HA1 GLY 28 8.406 9.843 -8.403
199 H ASP 29 HN ASP 29 6.786 9.162 -10.057
200 HA ASP 29 HA ASP 29 4.369 7.926 -9.092
201 HB2 ASP 29 HB2 ASP 29 5.630 7.683 -11.836
202 HB3 ASP 29 HB1 ASP 29 3.974 7.275 -11.402
203 H PHE 30 HN PHE 30 5.070 6.367 -7.624
204 HA PHE 30 HA PHE 30 7.011 4.389 -8.517
205 HB2 PHE 30 HB2 PHE 30 7.039 3.645 -6.182
206 HB3 PHE 30 HB1 PHE 30 7.298 5.382 -6.295
207 HD1 PHE 30 HD2 PHE 30 5.393 6.931 -5.749
208 HD2 PHE 30 HD1 PHE 30 5.236 2.753 -4.960
209 HE1 PHE 30 HE2 PHE 30 3.546 7.303 -4.166
210 HE2 PHE 30 HE1 PHE 30 3.387 3.116 -3.379
211 HZ PHE 30 HZ PHE 30 2.540 5.393 -2.976
212 H LEU 31 HN LEU 31 3.821 4.653 -8.939
213 HA LEU 31 HA LEU 31 2.674 2.329 -7.928
214 HB2 LEU 31 HB2 LEU 31 2.012 3.840 -10.442
215 HB3 LEU 31 HB1 LEU 31 1.025 2.549 -9.788
216 HG LEU 31 HG LEU 31 1.534 5.269 -8.614
217 HD11 LEU 31 HD11 LEU 31 -0.244 5.044 -10.277
218 HD12 LEU 31 HD12 LEU 31 -0.870 5.442 -8.676
219 HD13 LEU 31 HD13 LEU 31 -0.993 3.791 -9.285
220 HD21 LEU 31 HD21 LEU 31 0.279 4.586 -6.646
221 HD22 LEU 31 HD22 LEU 31 1.752 3.626 -6.815
222 HD23 LEU 31 HD23 LEU 31 0.192 2.935 -7.264
223 H ASP 32 HN ASP 32 4.886 2.654 -10.573
224 HA ASP 32 HA ASP 32 4.162 0.049 -11.669
225 HB2 ASP 32 HB2 ASP 32 6.071 2.201 -12.567
226 HB3 ASP 32 HB1 ASP 32 6.043 0.606 -13.315
227 H LEU 33 HN LEU 33 6.216 1.289 -9.344
228 HA LEU 33 HA LEU 33 8.312 -0.686 -9.710
229 HB2 LEU 33 HB2 LEU 33 7.904 1.351 -7.517
230 HB3 LEU 33 HB1 LEU 33 9.319 0.341 -7.716
231 HG LEU 33 HG LEU 33 8.407 2.440 -9.684
232 HD11 LEU 33 HD11 LEU 33 9.202 3.438 -7.613
233 HD12 LEU 33 HD12 LEU 33 10.351 3.709 -8.924
234 HD13 LEU 33 HD13 LEU 33 10.679 2.480 -7.703
235 HD21 LEU 33 HD21 LEU 33 9.588 0.612 -10.764
236 HD22 LEU 33 HD22 LEU 33 10.907 0.758 -9.604
237 HD23 LEU 33 HD23 LEU 33 10.581 2.069 -10.740
238 H ARG 34 HN ARG 34 8.020 -2.687 -9.028
239 HA ARG 34 HA ARG 34 5.796 -3.433 -7.418
240 HB2 ARG 34 HB2 ARG 34 8.216 -5.146 -7.947
241 HB3 ARG 34 HB1 ARG 34 6.574 -5.670 -7.617
242 HG2 ARG 34 HG2 ARG 34 5.868 -4.721 -9.781
243 HG3 ARG 34 HG1 ARG 34 7.554 -4.306 -10.113
244 HD2 ARG 34 HD2 ARG 34 6.361 -7.047 -9.747
245 HD3 ARG 34 HD1 ARG 34 7.124 -6.382 -11.190
246 HE ARG 34 HE ARG 34 9.227 -6.341 -9.816
247 HH11 ARG 34 HH11 ARG 34 6.609 -8.532 -8.981
248 HH12 ARG 34 HH12 ARG 34 7.676 -9.756 -8.361
249 HH21 ARG 34 HH21 ARG 34 10.620 -7.949 -8.991
250 HH22 ARG 34 HH22 ARG 34 9.957 -9.432 -8.361
251 H PHE 35 HN PHE 35 5.727 -4.237 -5.323
252 HA PHE 35 HA PHE 35 7.271 -3.030 -3.372
253 HB2 PHE 35 HB2 PHE 35 5.785 -5.660 -3.183
254 HB3 PHE 35 HB1 PHE 35 6.348 -4.713 -1.811
255 HD1 PHE 35 HD2 PHE 35 5.479 -2.266 -1.687
256 HD2 PHE 35 HD1 PHE 35 3.644 -5.340 -3.987
257 HE1 PHE 35 HE2 PHE 35 3.367 -0.997 -1.691
258 HE2 PHE 35 HE1 PHE 35 1.534 -4.077 -3.997
259 HZ PHE 35 HZ PHE 35 1.390 -1.913 -2.841
260 H GLU 36 HN GLU 36 7.652 -6.225 -4.821
261 HA GLU 36 HA GLU 36 9.760 -7.229 -3.349
262 HB2 GLU 36 HB2 GLU 36 9.102 -7.532 -6.275
263 HB3 GLU 36 HB1 GLU 36 10.337 -8.478 -5.462
264 HG2 GLU 36 HG2 GLU 36 7.447 -8.434 -4.634
265 HG3 GLU 36 HG1 GLU 36 8.143 -9.619 -5.740
266 H ASP 37 HN ASP 37 9.839 -4.868 -5.970
267 HA ASP 37 HA ASP 37 12.716 -5.091 -6.228
268 HB2 ASP 37 HB2 ASP 37 10.692 -3.328 -7.616
269 HB3 ASP 37 HB1 ASP 37 12.421 -3.257 -7.934
270 H ILE 38 HN ILE 38 10.393 -3.022 -4.662
271 HA ILE 38 HA ILE 38 12.443 -1.018 -4.135
272 HB ILE 38 HB ILE 38 10.596 0.265 -3.024
273 HG12 ILE 38 HG12 ILE 38 8.898 -1.942 -4.202
274 HG13 ILE 38 HG11 ILE 38 9.119 -1.608 -2.490
275 HG21 ILE 38 HG21 ILE 38 9.534 0.912 -5.151
276 HG22 ILE 38 HG22 ILE 38 10.232 -0.519 -5.912
277 HG23 ILE 38 HG23 ILE 38 11.284 0.754 -5.288
278 HD11 ILE 38 HD11 ILE 38 8.010 0.546 -2.772
279 HD12 ILE 38 HD12 ILE 38 6.981 -0.790 -3.282
280 HD13 ILE 38 HD13 ILE 38 7.793 0.207 -4.491
281 H GLY 39 HN GLY 39 12.152 -3.825 -2.878
282 HA2 GLY 39 HA2 GLY 39 13.296 -4.548 -0.994
283 HA3 GLY 39 HA1 GLY 39 13.307 -2.899 -0.396
284 H TYR 40 HN TYR 40 10.174 -3.526 -1.198
285 HA TYR 40 HA TYR 40 9.534 -4.018 1.590
286 HB2 TYR 40 HB2 TYR 40 7.885 -3.124 -0.762
287 HB3 TYR 40 HB1 TYR 40 7.136 -3.630 0.751
288 HD1 TYR 40 HD2 TYR 40 7.842 -2.433 2.885
289 HD2 TYR 40 HD1 TYR 40 8.705 -0.932 -1.001
290 HE1 TYR 40 HE2 TYR 40 8.219 -0.205 3.838
291 HE2 TYR 40 HE1 TYR 40 9.091 1.303 -0.057
292 HH TYR 40 HH TYR 40 8.434 2.593 1.949
293 H ASP 41 HN ASP 41 9.770 -6.081 2.078
294 HA ASP 41 HA ASP 41 8.952 -8.169 0.246
295 HB2 ASP 41 HB2 ASP 41 9.936 -9.706 1.789
296 HB3 ASP 41 HB1 ASP 41 11.014 -8.316 1.707
297 H SER 42 HN SER 42 7.834 -10.089 1.496
298 HA SER 42 HA SER 42 5.169 -9.491 1.780
299 HB2 SER 42 HB2 SER 42 5.037 -11.736 2.945
300 HB3 SER 42 HB1 SER 42 5.866 -11.748 1.384
301 H LEU 43 HN LEU 43 7.612 -9.820 4.357
302 HA LEU 43 HA LEU 43 5.769 -9.552 6.500
303 HB2 LEU 43 HB2 LEU 43 7.999 -10.566 6.738
304 HB3 LEU 43 HB1 LEU 43 8.738 -9.002 6.463
305 HG LEU 43 HG LEU 43 7.677 -8.157 8.530
306 HD11 LEU 43 HD11 LEU 43 6.797 -11.018 8.903
307 HD12 LEU 43 HD12 LEU 43 5.740 -9.647 8.571
308 HD13 LEU 43 HD13 LEU 43 6.639 -9.719 10.086
309 HD21 LEU 43 HD21 LEU 43 9.325 -10.657 8.879
310 HD22 LEU 43 HD22 LEU 43 9.083 -9.405 10.097
311 HD23 LEU 43 HD23 LEU 43 9.943 -9.029 8.603
312 H ALA 44 HN ALA 44 7.968 -7.223 4.932
313 HA ALA 44 HA ALA 44 7.258 -5.035 6.574
314 HB1 ALA 44 HB1 ALA 44 9.293 -5.084 5.186
315 HB2 ALA 44 HB2 ALA 44 8.328 -3.633 4.912
316 HB3 ALA 44 HB3 ALA 44 8.295 -4.950 3.737
317 H LEU 45 HN LEU 45 5.890 -6.361 3.639
318 HA LEU 45 HA LEU 45 4.160 -4.194 3.056
319 HB2 LEU 45 HB2 LEU 45 4.844 -5.931 1.431
320 HB3 LEU 45 HB1 LEU 45 3.896 -7.111 2.314
321 HG LEU 45 HG LEU 45 1.848 -5.827 1.792
322 HD11 LEU 45 HD11 LEU 45 3.685 -4.158 0.076
323 HD12 LEU 45 HD12 LEU 45 2.865 -3.618 1.542
324 HD13 LEU 45 HD13 LEU 45 1.925 -4.061 0.117
325 HD21 LEU 45 HD21 LEU 45 2.499 -7.693 0.393
326 HD22 LEU 45 HD22 LEU 45 3.513 -6.634 -0.586
327 HD23 LEU 45 HD23 LEU 45 1.761 -6.421 -0.583
328 H MET 46 HN MET 46 3.664 -7.270 4.789
329 HA MET 46 HA MET 46 0.899 -6.863 5.239
330 HB2 MET 46 HB2 MET 46 0.980 -8.762 6.695
331 HB3 MET 46 HB1 MET 46 2.038 -9.084 5.331
332 HG2 MET 46 HG2 MET 46 3.368 -9.813 7.006
333 HG3 MET 46 HG1 MET 46 3.864 -8.127 6.977
334 HE1 MET 46 HE1 MET 46 0.781 -9.763 9.998
335 HE2 MET 46 HE2 MET 46 1.598 -10.799 8.830
336 HE3 MET 46 HE3 MET 46 0.477 -9.556 8.271
337 H GLU 47 HN GLU 47 3.762 -5.941 7.046
338 HA GLU 47 HA GLU 47 2.526 -5.031 9.406
339 HB2 GLU 47 HB2 GLU 47 4.970 -4.022 7.932
340 HB3 GLU 47 HB1 GLU 47 4.520 -3.506 9.552
341 HG2 GLU 47 HG2 GLU 47 4.960 -6.396 8.910
342 HG3 GLU 47 HG1 GLU 47 6.313 -5.324 9.256
343 H THR 48 HN THR 48 3.230 -3.425 6.345
344 HA THR 48 HA THR 48 2.269 -0.876 7.057
345 HB THR 48 HB THR 48 2.504 -2.029 4.273
346 HG1 THR 48 HG1 THR 48 4.499 -2.267 5.244
347 HG21 THR 48 HG21 THR 48 2.884 0.298 3.617
348 HG22 THR 48 HG22 THR 48 2.641 0.811 5.287
349 HG23 THR 48 HG23 THR 48 1.308 0.098 4.378
350 H ALA 49 HN ALA 49 0.602 -3.757 6.162
351 HA ALA 49 HA ALA 49 -1.677 -2.755 4.899
352 HB1 ALA 49 HB1 ALA 49 -1.565 -5.101 6.790
353 HB2 ALA 49 HB2 ALA 49 -1.125 -5.158 5.085
354 HB3 ALA 49 HB3 ALA 49 -2.787 -4.799 5.555
355 H ALA 50 HN ALA 50 -0.903 -3.037 8.318
356 HA ALA 50 HA ALA 50 -3.452 -2.488 9.368
357 HB1 ALA 50 HB1 ALA 50 -0.778 -1.883 10.627
358 HB2 ALA 50 HB2 ALA 50 -1.571 -3.460 10.655
359 HB3 ALA 50 HB3 ALA 50 -2.320 -2.081 11.461
360 H ARG 51 HN ARG 51 -0.949 -0.478 8.106
361 HA ARG 51 HA ARG 51 -1.576 1.956 9.357
362 HB2 ARG 51 HB2 ARG 51 -0.355 1.522 6.625
363 HB3 ARG 51 HB1 ARG 51 -0.265 2.993 7.579
364 HG2 ARG 51 HG2 ARG 51 0.916 0.341 8.371
365 HG3 ARG 51 HG1 ARG 51 1.808 1.686 7.654
366 HD2 ARG 51 HD2 ARG 51 1.221 3.092 9.568
367 HD3 ARG 51 HD1 ARG 51 0.325 1.751 10.282
368 HE ARG 51 HE ARG 51 3.056 1.088 9.714
369 HH11 ARG 51 HH11 ARG 51 0.929 2.655 12.022
370 HH12 ARG 51 HH12 ARG 51 1.984 2.366 13.380
371 HH21 ARG 51 HH21 ARG 51 4.457 0.756 11.492
372 HH22 ARG 51 HH22 ARG 51 4.008 1.334 13.071
373 H LEU 52 HN LEU 52 -2.764 0.417 6.427
374 HA LEU 52 HA LEU 52 -4.256 2.759 5.621
375 HB2 LEU 52 HB2 LEU 52 -4.298 -0.029 4.473
376 HB3 LEU 52 HB1 LEU 52 -4.976 1.406 3.727
377 HG LEU 52 HG LEU 52 -2.042 0.928 4.255
378 HD11 LEU 52 HD11 LEU 52 -1.867 0.766 1.822
379 HD12 LEU 52 HD12 LEU 52 -3.622 0.903 1.689
380 HD13 LEU 52 HD13 LEU 52 -2.903 -0.497 2.484
381 HD21 LEU 52 HD21 LEU 52 -1.669 2.951 2.963
382 HD22 LEU 52 HD22 LEU 52 -2.663 3.302 4.379
383 HD23 LEU 52 HD23 LEU 52 -3.409 3.179 2.786
384 H GLU 53 HN GLU 53 -5.012 -0.495 6.819
385 HA GLU 53 HA GLU 53 -7.785 -0.348 6.629
386 HB2 GLU 53 HB2 GLU 53 -6.063 -1.859 8.589
387 HB3 GLU 53 HB1 GLU 53 -7.799 -2.086 8.438
388 HG2 GLU 53 HG2 GLU 53 -7.507 -2.763 6.110
389 HG3 GLU 53 HG1 GLU 53 -5.766 -2.552 6.275
390 H SER 54 HN SER 54 -5.757 0.365 9.477
391 HA SER 54 HA SER 54 -7.907 1.142 11.131
392 HB2 SER 54 HB2 SER 54 -5.774 0.505 12.094
393 HB3 SER 54 HB1 SER 54 -4.967 1.846 11.284
394 HG SER 54 HG SER 54 -5.711 3.200 12.739
395 H ARG 55 HN ARG 55 -5.946 2.890 8.828
396 HA ARG 55 HA ARG 55 -6.399 5.499 9.777
397 HB2 ARG 55 HB2 ARG 55 -4.667 4.564 8.071
398 HB3 ARG 55 HB1 ARG 55 -5.926 4.866 6.883
399 HG2 ARG 55 HG2 ARG 55 -5.937 7.215 7.435
400 HG3 ARG 55 HG1 ARG 55 -4.748 6.944 8.713
401 HD2 ARG 55 HD2 ARG 55 -3.194 6.056 6.990
402 HD3 ARG 55 HD1 ARG 55 -4.366 6.516 5.759
403 HE ARG 55 HE ARG 55 -3.612 8.690 7.482
404 HH11 ARG 55 HH11 ARG 55 -2.788 6.877 4.603
405 HH12 ARG 55 HH12 ARG 55 -1.837 8.144 3.910
406 HH21 ARG 55 HH21 ARG 55 -2.344 10.388 6.565
407 HH22 ARG 55 HH22 ARG 55 -1.613 10.146 5.011
408 H TYR 56 HN TYR 56 -7.977 3.682 7.138
409 HA TYR 56 HA TYR 56 -9.907 5.871 6.867
410 HB2 TYR 56 HB2 TYR 56 -9.513 3.461 5.083
411 HB3 TYR 56 HB1 TYR 56 -10.495 4.880 4.730
412 HD1 TYR 56 HD2 TYR 56 -9.416 7.049 4.267
413 HD2 TYR 56 HD1 TYR 56 -7.134 3.495 4.782
414 HE1 TYR 56 HE2 TYR 56 -7.489 8.139 3.206
415 HE2 TYR 56 HE1 TYR 56 -5.201 4.578 3.718
416 HH TYR 56 HH TYR 56 -4.663 6.385 2.271
417 H GLY 57 HN GLY 57 -9.653 2.799 8.276
418 HA2 GLY 57 HA2 GLY 57 -11.273 1.742 9.589
419 HA3 GLY 57 HA1 GLY 57 -12.495 2.798 8.892
420 H VAL 58 HN VAL 58 -10.191 0.876 7.085
421 HA VAL 58 HA VAL 58 -12.446 -0.586 5.891
422 HB VAL 58 HB VAL 58 -11.008 -0.999 3.949
423 HG11 VAL 58 HG11 VAL 58 -10.852 1.283 3.102
424 HG12 VAL 58 HG12 VAL 58 -11.089 1.905 4.736
425 HG13 VAL 58 HG13 VAL 58 -12.375 0.997 3.941
426 HG21 VAL 58 HG21 VAL 58 -8.822 0.082 3.742
427 HG22 VAL 58 HG22 VAL 58 -8.845 -1.057 5.086
428 HG23 VAL 58 HG23 VAL 58 -8.952 0.676 5.398
429 H SER 59 HN SER 59 -11.259 -2.698 4.759
430 HA SER 59 HA SER 59 -9.291 -3.924 6.462
431 HB2 SER 59 HB2 SER 59 -11.532 -4.409 7.567
432 HB3 SER 59 HB1 SER 59 -11.934 -5.352 6.132
433 HG SER 59 HG SER 59 -9.483 -5.910 7.302
434 H ILE 60 HN ILE 60 -8.085 -5.354 5.327
435 HA ILE 60 HA ILE 60 -8.751 -5.559 2.479
436 HB ILE 60 HB ILE 60 -6.133 -6.228 3.834
437 HG12 ILE 60 HG12 ILE 60 -6.936 -3.678 2.405
438 HG13 ILE 60 HG11 ILE 60 -6.783 -3.846 4.149
439 HG21 ILE 60 HG21 ILE 60 -6.841 -5.734 0.943
440 HG22 ILE 60 HG22 ILE 60 -6.414 -7.286 1.665
441 HG23 ILE 60 HG23 ILE 60 -5.212 -5.997 1.566
442 HD11 ILE 60 HD11 ILE 60 -4.408 -4.332 3.891
443 HD12 ILE 60 HD12 ILE 60 -4.837 -2.769 3.197
444 HD13 ILE 60 HD13 ILE 60 -4.565 -4.156 2.142
445 HA PRO 61 HA PRO 61 -10.171 -9.771 3.049
446 HB2 PRO 61 HB2 PRO 61 -9.395 -9.844 0.166
447 HB3 PRO 61 HB1 PRO 61 -10.894 -10.370 0.942
448 HG2 PRO 61 HG2 PRO 61 -10.819 -8.093 -0.421
449 HG3 PRO 61 HG1 PRO 61 -11.731 -8.216 1.095
450 HD2 PRO 61 HD2 PRO 61 -9.100 -6.907 0.570
451 HD3 PRO 61 HD1 PRO 61 -10.402 -6.426 1.676
452 H ASP 62 HN ASP 62 -9.114 -11.572 3.597
453 HA ASP 62 HA ASP 62 -6.384 -11.510 4.047
454 HB2 ASP 62 HB2 ASP 62 -7.975 -14.064 3.811
455 HB3 ASP 62 HB1 ASP 62 -6.579 -13.750 4.833
456 H ASP 63 HN ASP 63 -8.135 -13.321 1.544
457 HA ASP 63 HA ASP 63 -5.714 -14.486 0.530
458 HB2 ASP 63 HB2 ASP 63 -7.877 -15.685 0.518
459 HB3 ASP 63 HB1 ASP 63 -8.505 -14.513 -0.635
460 H VAL 64 HN VAL 64 -7.870 -11.882 -0.430
461 HA VAL 64 HA VAL 64 -6.741 -11.515 -3.025
462 HB VAL 64 HB VAL 64 -8.398 -9.560 -1.419
463 HG11 VAL 64 HG11 VAL 64 -7.880 -9.740 -4.387
464 HG12 VAL 64 HG12 VAL 64 -7.281 -8.493 -3.295
465 HG13 VAL 64 HG13 VAL 64 -9.010 -8.629 -3.613
466 HG21 VAL 64 HG21 VAL 64 -9.278 -11.652 -3.398
467 HG22 VAL 64 HG22 VAL 64 -10.322 -10.464 -2.618
468 HG23 VAL 64 HG23 VAL 64 -9.525 -11.709 -1.654
469 H ALA 65 HN ALA 65 -5.911 -10.451 0.146
470 HA ALA 65 HA ALA 65 -4.515 -8.087 -0.418
471 HB1 ALA 65 HB1 ALA 65 -5.134 -8.802 1.849
472 HB2 ALA 65 HB2 ALA 65 -3.420 -8.405 1.728
473 HB3 ALA 65 HB3 ALA 65 -3.935 -10.092 1.758
474 H GLY 66 HN GLY 66 -3.641 -11.406 -0.847
475 HA2 GLY 66 HA2 GLY 66 -0.849 -10.648 -1.387
476 HA3 GLY 66 HA1 GLY 66 -1.404 -12.271 -1.000
477 H ARG 67 HN ARG 67 -3.293 -10.409 -3.192
478 HA ARG 67 HA ARG 67 -2.489 -12.199 -5.356
479 HB2 ARG 67 HB2 ARG 67 -4.860 -12.129 -4.773
480 HB3 ARG 67 HB1 ARG 67 -4.887 -10.391 -5.028
481 HG2 ARG 67 HG2 ARG 67 -5.808 -11.189 -6.961
482 HG3 ARG 67 HG1 ARG 67 -4.122 -10.965 -7.414
483 HD2 ARG 67 HD2 ARG 67 -5.481 -13.552 -6.678
484 HD3 ARG 67 HD1 ARG 67 -4.922 -13.070 -8.277
485 HE ARG 67 HE ARG 67 -3.072 -13.539 -6.027
486 HH11 ARG 67 HH11 ARG 67 -3.963 -13.893 -9.389
487 HH12 ARG 67 HH12 ARG 67 -2.587 -14.881 -9.782
488 HH21 ARG 67 HH21 ARG 67 -1.248 -14.816 -6.540
489 HH22 ARG 67 HH22 ARG 67 -1.057 -15.417 -8.162
490 H VAL 68 HN VAL 68 -1.971 -9.047 -4.280
491 HA VAL 68 HA VAL 68 -1.788 -7.868 -6.937
492 HB VAL 68 HB VAL 68 -1.247 -5.762 -5.791
493 HG11 VAL 68 HG11 VAL 68 -3.580 -6.312 -6.194
494 HG12 VAL 68 HG12 VAL 68 -3.407 -5.431 -4.676
495 HG13 VAL 68 HG13 VAL 68 -3.656 -7.177 -4.660
496 HG21 VAL 68 HG21 VAL 68 -1.471 -7.399 -3.266
497 HG22 VAL 68 HG22 VAL 68 -1.369 -5.639 -3.326
498 HG23 VAL 68 HG23 VAL 68 -0.014 -6.621 -3.887
499 H ASP 69 HN ASP 69 0.201 -6.383 -7.250
500 HA ASP 69 HA ASP 69 2.665 -7.618 -6.283
501 HB2 ASP 69 HB2 ASP 69 2.255 -8.870 -8.299
502 HB3 ASP 69 HB1 ASP 69 1.906 -7.406 -9.206
503 H THR 70 HN THR 70 1.202 -5.120 -8.323
504 HA THR 70 HA THR 70 3.424 -3.330 -7.627
505 HB THR 70 HB THR 70 2.492 -1.859 -9.439
506 HG1 THR 70 HG1 THR 70 0.837 -4.153 -9.841
507 HG21 THR 70 HG21 THR 70 3.326 -4.653 -10.217
508 HG22 THR 70 HG22 THR 70 4.401 -3.301 -9.860
509 HG23 THR 70 HG23 THR 70 3.356 -3.246 -11.280
510 HA PRO 71 HA PRO 71 1.104 -0.829 -4.826
511 HB2 PRO 71 HB2 PRO 71 2.191 1.504 -6.314
512 HB3 PRO 71 HB1 PRO 71 2.279 1.124 -4.591
513 HG2 PRO 71 HG2 PRO 71 4.406 0.826 -6.166
514 HG3 PRO 71 HG1 PRO 71 4.057 -0.327 -4.864
515 HD2 PRO 71 HD2 PRO 71 3.656 -0.608 -7.807
516 HD3 PRO 71 HD1 PRO 71 4.164 -1.819 -6.613
517 H ARG 72 HN ARG 72 0.997 0.027 -8.251
518 HA ARG 72 HA ARG 72 -1.258 1.659 -8.220
519 HB2 ARG 72 HB2 ARG 72 0.086 1.451 -10.212
520 HB3 ARG 72 HB1 ARG 72 -0.297 -0.255 -10.347
521 HG2 ARG 72 HG2 ARG 72 -2.596 0.248 -10.856
522 HG3 ARG 72 HG1 ARG 72 -2.308 1.966 -10.580
523 HD2 ARG 72 HD2 ARG 72 -0.964 0.305 -12.700
524 HD3 ARG 72 HD1 ARG 72 -2.330 1.379 -12.976
525 HE ARG 72 HE ARG 72 -0.845 3.218 -12.215
526 HH11 ARG 72 HH11 ARG 72 0.613 0.299 -13.539
527 HH12 ARG 72 HH12 ARG 72 2.083 1.099 -14.008
528 HH21 ARG 72 HH21 ARG 72 1.071 4.254 -12.852
529 HH22 ARG 72 HH22 ARG 72 2.358 3.331 -13.594
530 H GLU 73 HN GLU 73 -1.036 -1.862 -8.522
531 HA GLU 73 HA GLU 73 -3.811 -2.336 -8.775
532 HB2 GLU 73 HB2 GLU 73 -1.662 -4.155 -7.677
533 HB3 GLU 73 HB1 GLU 73 -3.261 -4.661 -8.216
534 HG2 GLU 73 HG2 GLU 73 -2.752 -4.090 -10.474
535 HG3 GLU 73 HG1 GLU 73 -1.227 -3.339 -9.999
536 H LEU 74 HN LEU 74 -1.632 -2.250 -6.003
537 HA LEU 74 HA LEU 74 -3.441 -3.052 -4.013
538 HB2 LEU 74 HB2 LEU 74 -0.899 -2.748 -3.899
539 HB3 LEU 74 HB1 LEU 74 -1.219 -1.048 -3.641
540 HG LEU 74 HG LEU 74 -0.730 -2.403 -1.576
541 HD11 LEU 74 HD11 LEU 74 -1.825 -0.226 -1.450
542 HD12 LEU 74 HD12 LEU 74 -2.427 -1.325 -0.208
543 HD13 LEU 74 HD13 LEU 74 -3.396 -1.002 -1.647
544 HD21 LEU 74 HD21 LEU 74 -1.942 -4.421 -2.157
545 HD22 LEU 74 HD22 LEU 74 -3.468 -3.535 -2.140
546 HD23 LEU 74 HD23 LEU 74 -2.555 -3.747 -0.646
547 H LEU 75 HN LEU 75 -2.534 0.201 -5.123
548 HA LEU 75 HA LEU 75 -4.265 1.655 -3.472
549 HB2 LEU 75 HB2 LEU 75 -2.418 2.644 -4.774
550 HB3 LEU 75 HB1 LEU 75 -3.315 2.351 -6.251
551 HG LEU 75 HG LEU 75 -5.109 3.887 -5.388
552 HD11 LEU 75 HD11 LEU 75 -3.041 4.481 -3.278
553 HD12 LEU 75 HD12 LEU 75 -4.606 3.712 -3.018
554 HD13 LEU 75 HD13 LEU 75 -4.526 5.392 -3.552
555 HD21 LEU 75 HD21 LEU 75 -3.832 5.941 -5.838
556 HD22 LEU 75 HD22 LEU 75 -3.475 4.664 -6.999
557 HD23 LEU 75 HD23 LEU 75 -2.333 5.023 -5.704
558 H ASP 76 HN ASP 76 -4.715 0.549 -6.818
559 HA ASP 76 HA ASP 76 -7.242 1.723 -7.193
560 HB2 ASP 76 HB2 ASP 76 -5.644 0.838 -8.970
561 HB3 ASP 76 HB1 ASP 76 -6.269 -0.765 -8.598
562 H LEU 77 HN LEU 77 -6.293 -1.419 -5.918
563 HA LEU 77 HA LEU 77 -8.830 -2.641 -5.978
564 HB2 LEU 77 HB2 LEU 77 -6.589 -3.755 -5.600
565 HB3 LEU 77 HB1 LEU 77 -6.642 -3.150 -3.958
566 HG LEU 77 HG LEU 77 -7.309 -5.574 -4.307
567 HD11 LEU 77 HD11 LEU 77 -9.106 -5.514 -2.678
568 HD12 LEU 77 HD12 LEU 77 -9.345 -3.794 -2.980
569 HD13 LEU 77 HD13 LEU 77 -7.843 -4.359 -2.249
570 HD21 LEU 77 HD21 LEU 77 -9.783 -4.293 -5.448
571 HD22 LEU 77 HD22 LEU 77 -9.595 -6.002 -5.049
572 HD23 LEU 77 HD23 LEU 77 -8.619 -5.280 -6.330
573 H ILE 78 HN ILE 78 -7.134 -1.001 -3.302
574 HA ILE 78 HA ILE 78 -9.342 -1.145 -1.524
575 HB ILE 78 HB ILE 78 -6.980 0.746 -1.450
576 HG12 ILE 78 HG12 ILE 78 -7.411 -1.929 -0.094
577 HG13 ILE 78 HG11 ILE 78 -6.362 -1.653 -1.480
578 HG21 ILE 78 HG21 ILE 78 -8.844 1.494 -0.046
579 HG22 ILE 78 HG22 ILE 78 -7.484 0.954 0.934
580 HG23 ILE 78 HG23 ILE 78 -8.894 -0.086 0.735
581 HD11 ILE 78 HD11 ILE 78 -6.023 -0.485 1.276
582 HD12 ILE 78 HD12 ILE 78 -4.981 -0.158 -0.111
583 HD13 ILE 78 HD13 ILE 78 -5.073 -1.786 0.556
584 H ASN 79 HN ASN 79 -8.189 1.330 -3.753
585 HA ASN 79 HA ASN 79 -9.979 3.388 -3.027
586 HB2 ASN 79 HB2 ASN 79 -7.905 3.536 -4.513
587 HB3 ASN 79 HB1 ASN 79 -8.896 2.889 -5.810
588 HD21 ASN 79 HD21 ASN 79 -8.116 5.628 -3.892
589 HD22 ASN 79 HD22 ASN 79 -9.100 6.773 -4.734
590 H GLY 80 HN GLY 80 -10.179 0.787 -5.427
591 HA2 GLY 80 HA2 GLY 80 -12.714 1.483 -6.480
592 HA3 GLY 80 HA1 GLY 80 -11.930 -0.083 -6.613
593 H ALA 81 HN ALA 81 -11.729 -0.499 -3.748
594 HA ALA 81 HA ALA 81 -14.243 -1.715 -3.278
595 HB1 ALA 81 HB1 ALA 81 -12.048 -1.134 -1.281
596 HB2 ALA 81 HB2 ALA 81 -12.138 -2.565 -2.310
597 HB3 ALA 81 HB3 ALA 81 -13.370 -2.284 -1.079
598 H LEU 82 HN LEU 82 -12.734 1.257 -2.180
599 HA LEU 82 HA LEU 82 -14.801 2.034 -0.385
600 HB2 LEU 82 HB2 LEU 82 -12.636 3.594 -1.788
601 HB3 LEU 82 HB1 LEU 82 -13.714 4.299 -0.604
602 HG LEU 82 HG LEU 82 -11.793 2.034 -0.081
603 HD11 LEU 82 HD11 LEU 82 -10.647 4.153 -0.469
604 HD12 LEU 82 HD12 LEU 82 -10.541 3.665 1.222
605 HD13 LEU 82 HD13 LEU 82 -11.669 4.934 0.739
606 HD21 LEU 82 HD21 LEU 82 -12.374 2.375 2.259
607 HD22 LEU 82 HD22 LEU 82 -13.786 1.914 1.308
608 HD23 LEU 82 HD23 LEU 82 -13.560 3.596 1.795
609 H ALA 83 HN ALA 83 -14.187 2.509 -3.802
610 HA ALA 83 HA ALA 83 -16.094 4.543 -4.263
611 HB1 ALA 83 HB1 ALA 83 -14.998 2.491 -6.188
612 HB2 ALA 83 HB2 ALA 83 -14.292 4.069 -5.837
613 HB3 ALA 83 HB3 ALA 83 -15.865 3.963 -6.631
614 H GLU 84 HN GLU 84 -16.445 1.181 -3.680
615 HA GLU 84 HA GLU 84 -19.188 1.216 -4.743
616 HB2 GLU 84 HB2 GLU 84 -17.406 -1.123 -4.030
617 HB3 GLU 84 HB1 GLU 84 -19.069 -1.259 -4.582
618 HG2 GLU 84 HG2 GLU 84 -18.454 -0.229 -6.705
619 HG3 GLU 84 HG1 GLU 84 -16.784 -0.095 -6.155
620 H ALA 85 HN ALA 85 -17.943 2.143 -2.052
621 HA ALA 85 HA ALA 85 -19.833 0.676 -0.339
622 HB1 ALA 85 HB1 ALA 85 -18.284 0.859 1.516
623 HB2 ALA 85 HB2 ALA 85 -17.121 1.701 0.493
624 HB3 ALA 85 HB3 ALA 85 -17.523 0.015 0.168
625 H ALA 86 HN ALA 86 -20.548 1.885 1.562
626 HA ALA 86 HA ALA 86 -20.216 4.762 1.509
627 HB1 ALA 86 HB1 ALA 86 -22.069 4.408 -0.065
628 HB2 ALA 86 HB2 ALA 86 -22.596 5.253 1.389
629 HB3 ALA 86 HB3 ALA 86 -22.957 3.539 1.189
630 H28 SXO 87 H28B SXO 87 5.790 -12.674 5.138
631 H28A SXO 87 H28A SXO 87 6.822 -13.993 5.695
632 H30 SXO 87 H30A SXO 87 5.291 -14.054 7.668
633 H30A SXO 87 H30C SXO 87 4.274 -12.818 6.925
634 H30B SXO 87 H30B SXO 87 3.567 -14.350 7.437
635 H31 SXO 87 H31A SXO 87 2.659 -14.722 5.140
636 H31A SXO 87 H31B SXO 87 3.744 -14.659 3.753
637 H31B SXO 87 H31C SXO 87 3.350 -13.179 4.625
638 H32 SXO 87 H32A SXO 87 5.710 -16.152 6.579
639 HO33 SXO 87 H33A SXO 87 5.836 -15.687 3.986
640 HN36 SXO 87 H36A SXO 87 3.583 -16.063 7.863
641 H37 SXO 87 H37A SXO 87 1.287 -17.445 6.761
642 H37A SXO 87 H37B SXO 87 2.236 -18.375 7.907
643 H38 SXO 87 H38B SXO 87 1.947 -16.195 9.369
644 H38A SXO 87 H38A SXO 87 0.740 -17.478 9.344
645 HN41 SXO 87 H41A SXO 87 1.139 -15.508 6.620
646 H42 SXO 87 H42A SXO 87 -1.370 -14.775 6.048
647 H42A SXO 87 H42B SXO 87 -0.914 -13.576 7.258
648 H43 SXO 87 H43B SXO 87 0.944 -12.842 5.867
649 H43A SXO 87 H43A SXO 87 0.551 -14.085 4.666
650 H2 SXO 87 H2A SXO 87 -1.585 -10.492 2.897
651 H2A SXO 87 H2B SXO 87 -0.310 -10.690 1.696
652 H3 SXO 87 H3B SXO 87 -0.112 -8.911 4.119
653 H3A SXO 87 H3A SXO 87 1.043 -9.027 2.792
654 H4 SXO 87 H4A SXO 87 -1.819 -8.116 2.506
655 H4A SXO 87 H4B SXO 87 -0.587 -8.134 1.242
656 H5 SXO 87 H5B SXO 87 -0.463 -6.504 3.774
657 H5A SXO 87 H5A SXO 87 0.731 -6.507 2.477
658 H6 SXO 87 H6A SXO 87 -2.149 -5.641 2.210
659 H6A SXO 87 H6B SXO 87 -0.925 -5.602 0.937
660 H7 SXO 87 H7A SXO 87 0.389 -3.997 2.208
661 H7A SXO 87 H7B SXO 87 -0.776 -4.071 3.540
662 H8 SXO 87 H8C SXO 87 -1.122 -2.100 2.125
663 H8A SXO 87 H8A SXO 87 -2.507 -3.188 2.079
664 H8B SXO 87 H8B SXO 87 -1.369 -3.151 0.731
Start of MODEL 8
1 H1 MET 1 HT1 MET 1 -18.584 12.903 2.219
2 H2 MET 1 HT2 MET 1 -18.533 14.484 1.604
3 H3 MET 1 HT3 MET 1 -17.800 14.124 3.090
4 HA MET 1 HA MET 1 -16.967 13.048 0.470
5 HB2 MET 1 HB2 MET 1 -15.713 15.146 2.253
6 HB3 MET 1 HB1 MET 1 -14.913 14.418 0.868
7 HG2 MET 1 HG2 MET 1 -16.591 15.344 -0.617
8 HG3 MET 1 HG1 MET 1 -17.453 16.029 0.760
9 HE1 MET 1 HE1 MET 1 -14.166 16.174 -1.416
10 HE2 MET 1 HE2 MET 1 -13.564 15.812 0.201
11 HE3 MET 1 HE3 MET 1 -13.229 17.378 -0.535
12 H ALA 2 HN ALA 2 -15.639 11.344 0.557
13 HA ALA 2 HA ALA 2 -14.955 10.326 3.230
14 HB1 ALA 2 HB1 ALA 2 -15.042 8.893 0.572
15 HB2 ALA 2 HB2 ALA 2 -16.292 8.843 1.815
16 HB3 ALA 2 HB3 ALA 2 -14.703 8.148 2.137
17 H THR 3 HN THR 3 -12.851 9.632 3.706
18 HA THR 3 HA THR 3 -10.758 10.926 2.188
19 HB THR 3 HB THR 3 -9.274 9.932 3.976
20 HG1 THR 3 HG1 THR 3 -10.790 8.186 4.460
21 HG21 THR 3 HG21 THR 3 -10.058 11.433 5.742
22 HG22 THR 3 HG22 THR 3 -11.624 11.568 4.941
23 HG23 THR 3 HG23 THR 3 -10.178 12.208 4.161
24 H LEU 4 HN LEU 4 -10.324 9.920 0.319
25 HA LEU 4 HA LEU 4 -10.254 7.034 0.128
26 HB2 LEU 4 HB2 LEU 4 -9.569 9.147 -1.919
27 HB3 LEU 4 HB1 LEU 4 -9.683 7.426 -2.234
28 HG LEU 4 HG LEU 4 -11.953 9.249 -1.438
29 HD11 LEU 4 HD11 LEU 4 -11.349 7.789 -4.005
30 HD12 LEU 4 HD12 LEU 4 -11.240 9.531 -3.746
31 HD13 LEU 4 HD13 LEU 4 -12.807 8.722 -3.670
32 HD21 LEU 4 HD21 LEU 4 -13.395 7.305 -1.736
33 HD22 LEU 4 HD22 LEU 4 -12.214 7.015 -0.458
34 HD23 LEU 4 HD23 LEU 4 -11.982 6.295 -2.049
35 H LEU 5 HN LEU 5 -8.376 5.952 -0.835
36 HA LEU 5 HA LEU 5 -5.885 6.837 0.343
37 HB2 LEU 5 HB2 LEU 5 -6.275 4.508 0.479
38 HB3 LEU 5 HB1 LEU 5 -6.789 4.410 -1.191
39 HG LEU 5 HG LEU 5 -4.494 4.701 -1.953
40 HD11 LEU 5 HD11 LEU 5 -2.637 4.707 -0.353
41 HD12 LEU 5 HD12 LEU 5 -3.793 4.846 0.973
42 HD13 LEU 5 HD13 LEU 5 -3.645 6.144 -0.213
43 HD21 LEU 5 HD21 LEU 5 -4.803 2.584 0.170
44 HD22 LEU 5 HD22 LEU 5 -3.562 2.596 -1.083
45 HD23 LEU 5 HD23 LEU 5 -5.264 2.450 -1.525
46 H THR 6 HN THR 6 -4.549 8.198 -0.733
47 HA THR 6 HA THR 6 -4.758 8.220 -3.667
48 HB THR 6 HB THR 6 -3.968 10.525 -3.657
49 HG1 THR 6 HG1 THR 6 -4.146 10.420 -0.799
50 HG21 THR 6 HG21 THR 6 -5.921 11.604 -2.594
51 HG22 THR 6 HG22 THR 6 -6.310 10.072 -1.808
52 HG23 THR 6 HG23 THR 6 -6.365 10.203 -3.566
53 H THR 7 HN THR 7 -2.640 9.352 -4.561
54 HA THR 7 HA THR 7 -0.544 7.541 -4.403
55 HB THR 7 HB THR 7 0.762 9.574 -5.390
56 HG1 THR 7 HG1 THR 7 -0.642 11.239 -6.102
57 HG21 THR 7 HG21 THR 7 -1.712 8.469 -6.728
58 HG22 THR 7 HG22 THR 7 -0.101 7.753 -6.748
59 HG23 THR 7 HG23 THR 7 -0.390 9.294 -7.554
60 H ASP 8 HN ASP 8 -0.705 10.838 -3.057
61 HA ASP 8 HA ASP 8 1.760 10.639 -1.695
62 HB2 ASP 8 HB2 ASP 8 -0.545 12.559 -1.401
63 HB3 ASP 8 HB1 ASP 8 0.939 12.698 -0.462
64 H ASP 9 HN ASP 9 -1.494 9.778 -0.771
65 HA ASP 9 HA ASP 9 -1.035 9.494 2.000
66 HB2 ASP 9 HB2 ASP 9 -2.986 8.217 0.109
67 HB3 ASP 9 HB1 ASP 9 -2.898 7.712 1.792
68 H LEU 10 HN LEU 10 -0.959 7.073 -0.605
69 HA LEU 10 HA LEU 10 0.091 4.969 0.934
70 HB2 LEU 10 HB2 LEU 10 -0.921 4.821 -1.369
71 HB3 LEU 10 HB1 LEU 10 0.569 5.486 -2.008
72 HG LEU 10 HG LEU 10 1.773 3.505 -1.013
73 HD11 LEU 10 HD11 LEU 10 0.443 1.547 -0.437
74 HD12 LEU 10 HD12 LEU 10 -1.038 2.482 -0.642
75 HD13 LEU 10 HD13 LEU 10 0.094 2.894 0.646
76 HD21 LEU 10 HD21 LEU 10 1.125 1.987 -2.794
77 HD22 LEU 10 HD22 LEU 10 1.191 3.647 -3.388
78 HD23 LEU 10 HD23 LEU 10 -0.367 2.896 -3.046
79 H ARG 11 HN ARG 11 1.567 7.529 -0.923
80 HA ARG 11 HA ARG 11 4.266 6.968 -0.766
81 HB2 ARG 11 HB2 ARG 11 3.101 8.811 -2.007
82 HB3 ARG 11 HB1 ARG 11 2.930 9.665 -0.487
83 HG2 ARG 11 HG2 ARG 11 5.357 9.858 -0.315
84 HG3 ARG 11 HG1 ARG 11 5.532 8.983 -1.845
85 HD2 ARG 11 HD2 ARG 11 4.064 10.740 -2.886
86 HD3 ARG 11 HD1 ARG 11 4.198 11.645 -1.383
87 HE ARG 11 HE ARG 11 6.783 11.080 -2.260
88 HH11 ARG 11 HH11 ARG 11 3.984 12.961 -3.273
89 HH12 ARG 11 HH12 ARG 11 4.930 14.099 -4.191
90 HH21 ARG 11 HH21 ARG 11 8.020 12.621 -3.420
91 HH22 ARG 11 HH22 ARG 11 7.226 13.906 -4.280
92 H ARG 12 HN ARG 12 2.125 8.341 1.694
93 HA ARG 12 HA ARG 12 4.282 8.799 3.558
94 HB2 ARG 12 HB2 ARG 12 1.287 8.893 3.915
95 HB3 ARG 12 HB1 ARG 12 2.446 9.328 5.159
96 HG2 ARG 12 HG2 ARG 12 2.242 10.696 2.484
97 HG3 ARG 12 HG1 ARG 12 1.444 11.259 3.953
98 HD2 ARG 12 HD2 ARG 12 3.448 12.513 3.723
99 HD3 ARG 12 HD1 ARG 12 3.713 11.357 5.025
100 HE ARG 12 HE ARG 12 4.849 9.990 3.182
101 HH11 ARG 12 HH11 ARG 12 4.815 13.501 3.296
102 HH12 ARG 12 HH12 ARG 12 6.351 13.656 2.482
103 HH21 ARG 12 HH21 ARG 12 6.885 10.227 2.112
104 HH22 ARG 12 HH22 ARG 12 7.509 11.824 1.828
105 H ALA 13 HN ALA 13 1.740 6.372 3.100
106 HA ALA 13 HA ALA 13 1.881 5.180 5.623
107 HB1 ALA 13 HB1 ALA 13 1.048 3.909 3.025
108 HB2 ALA 13 HB2 ALA 13 0.011 4.848 4.099
109 HB3 ALA 13 HB3 ALA 13 0.678 3.307 4.640
110 H LEU 14 HN LEU 14 3.634 4.363 2.642
111 HA LEU 14 HA LEU 14 4.892 2.048 3.654
112 HB2 LEU 14 HB2 LEU 14 5.576 3.958 1.445
113 HB3 LEU 14 HB1 LEU 14 6.727 2.726 1.918
114 HG LEU 14 HG LEU 14 5.501 1.946 0.011
115 HD11 LEU 14 HD11 LEU 14 6.060 0.272 1.670
116 HD12 LEU 14 HD12 LEU 14 4.525 -0.116 0.888
117 HD13 LEU 14 HD13 LEU 14 4.542 0.576 2.511
118 HD21 LEU 14 HD21 LEU 14 2.995 2.395 1.619
119 HD22 LEU 14 HD22 LEU 14 3.086 1.660 0.019
120 HD23 LEU 14 HD23 LEU 14 3.521 3.356 0.236
121 H VAL 15 HN VAL 15 5.719 5.452 3.815
122 HA VAL 15 HA VAL 15 8.317 5.110 4.905
123 HB VAL 15 HB VAL 15 6.482 7.512 5.074
124 HG11 VAL 15 HG11 VAL 15 9.451 7.264 5.540
125 HG12 VAL 15 HG12 VAL 15 8.224 7.636 6.751
126 HG13 VAL 15 HG13 VAL 15 8.561 8.784 5.454
127 HG21 VAL 15 HG21 VAL 15 6.919 6.907 2.775
128 HG22 VAL 15 HG22 VAL 15 8.647 6.798 3.102
129 HG23 VAL 15 HG23 VAL 15 7.832 8.359 3.183
130 H GLU 16 HN GLU 16 5.093 5.440 6.284
131 HA GLU 16 HA GLU 16 5.766 5.936 8.944
132 HB2 GLU 16 HB2 GLU 16 3.469 4.253 7.931
133 HB3 GLU 16 HB1 GLU 16 3.600 4.955 9.534
134 HG2 GLU 16 HG2 GLU 16 3.592 7.209 8.476
135 HG3 GLU 16 HG1 GLU 16 3.276 6.419 6.930
136 H SER 17 HN SER 17 5.491 2.887 7.196
137 HA SER 17 HA SER 17 5.981 1.319 9.559
138 HB2 SER 17 HB2 SER 17 5.866 0.444 6.665
139 HB3 SER 17 HB1 SER 17 5.753 -0.599 8.083
140 HG SER 17 HG SER 17 3.842 1.001 6.903
141 H ALA 18 HN ALA 18 7.861 2.568 6.895
142 HA ALA 18 HA ALA 18 10.056 0.732 7.320
143 HB1 ALA 18 HB1 ALA 18 11.146 1.918 5.507
144 HB2 ALA 18 HB2 ALA 18 9.898 3.164 5.550
145 HB3 ALA 18 HB3 ALA 18 9.484 1.519 5.070
146 H GLY 19 HN GLY 19 9.535 4.252 7.739
147 HA2 GLY 19 HA2 GLY 19 10.678 5.783 9.042
148 HA3 GLY 19 HA1 GLY 19 11.328 4.419 9.944
149 H GLU 20 HN GLU 20 11.767 4.572 6.527
150 HA GLU 20 HA GLU 20 14.635 4.706 6.892
151 HB2 GLU 20 HB2 GLU 20 13.697 3.038 5.371
152 HB3 GLU 20 HB1 GLU 20 12.936 4.301 4.419
153 HG2 GLU 20 HG2 GLU 20 14.939 3.421 3.344
154 HG3 GLU 20 HG1 GLU 20 15.101 5.132 3.737
155 H THR 21 HN THR 21 15.960 6.321 6.160
156 HA THR 21 HA THR 21 14.661 8.705 5.024
157 HB THR 21 HB THR 21 16.771 8.894 7.181
158 HG1 THR 21 HG1 THR 21 14.113 8.278 7.369
159 HG21 THR 21 HG21 THR 21 16.474 10.885 5.760
160 HG22 THR 21 HG22 THR 21 15.928 11.182 7.411
161 HG23 THR 21 HG23 THR 21 14.752 10.886 6.130
162 H ASP 22 HN ASP 22 16.832 6.375 4.487
163 HA ASP 22 HA ASP 22 18.773 8.153 3.183
164 HB2 ASP 22 HB2 ASP 22 19.665 6.373 4.703
165 HB3 ASP 22 HB1 ASP 22 18.978 5.167 3.616
166 H GLY 23 HN GLY 23 17.170 5.048 2.522
167 HA2 GLY 23 HA2 GLY 23 17.175 5.714 -0.339
168 HA3 GLY 23 HA1 GLY 23 16.974 4.107 0.341
169 H THR 24 HN THR 24 15.072 3.505 -0.481
170 HA THR 24 HA THR 24 12.881 3.472 -1.052
171 HB THR 24 HB THR 24 11.289 4.124 0.763
172 HG1 THR 24 HG1 THR 24 13.220 5.664 1.579
173 HG21 THR 24 HG21 THR 24 12.316 1.888 0.647
174 HG22 THR 24 HG22 THR 24 11.981 2.388 2.304
175 HG23 THR 24 HG23 THR 24 13.629 2.458 1.679
176 H ASP 25 HN ASP 25 13.634 5.173 -2.673
177 HA ASP 25 HA ASP 25 12.718 7.843 -2.255
178 HB2 ASP 25 HB2 ASP 25 14.556 7.531 -3.763
179 HB3 ASP 25 HB1 ASP 25 13.634 6.406 -4.754
180 H LEU 26 HN LEU 26 10.571 7.591 -1.646
181 HA LEU 26 HA LEU 26 8.733 6.815 -3.773
182 HB2 LEU 26 HB2 LEU 26 8.352 7.373 -0.845
183 HB3 LEU 26 HB1 LEU 26 6.990 7.395 -1.945
184 HG LEU 26 HG LEU 26 7.655 5.016 -2.586
185 HD11 LEU 26 HD11 LEU 26 9.261 5.262 -0.049
186 HD12 LEU 26 HD12 LEU 26 9.913 5.036 -1.672
187 HD13 LEU 26 HD13 LEU 26 8.935 3.770 -0.930
188 HD21 LEU 26 HD21 LEU 26 6.728 5.578 0.228
189 HD22 LEU 26 HD22 LEU 26 6.504 4.065 -0.650
190 HD23 LEU 26 HD23 LEU 26 5.715 5.538 -1.215
191 H SER 27 HN SER 27 9.819 8.736 -4.831
192 HA SER 27 HA SER 27 8.213 11.129 -4.237
193 HB2 SER 27 HB2 SER 27 10.709 11.288 -3.710
194 HB3 SER 27 HB1 SER 27 10.977 11.198 -5.450
195 HG SER 27 HG SER 27 10.548 13.232 -5.532
196 H GLY 28 HN GLY 28 10.008 9.394 -6.782
197 HA2 GLY 28 HA2 GLY 28 8.510 10.743 -8.862
198 HA3 GLY 28 HA1 GLY 28 9.747 9.518 -9.094
199 H ASP 29 HN ASP 29 8.701 8.156 -10.451
200 HA ASP 29 HA ASP 29 5.973 7.374 -9.881
201 HB2 ASP 29 HB2 ASP 29 6.215 5.966 -11.957
202 HB3 ASP 29 HB1 ASP 29 6.397 7.698 -12.189
203 H PHE 30 HN PHE 30 6.172 6.314 -7.935
204 HA PHE 30 HA PHE 30 7.809 3.912 -7.811
205 HB2 PHE 30 HB2 PHE 30 6.973 3.826 -5.422
206 HB3 PHE 30 HB1 PHE 30 7.925 5.244 -5.843
207 HD1 PHE 30 HD1 PHE 30 4.479 4.029 -5.238
208 HD2 PHE 30 HD2 PHE 30 7.030 7.412 -5.655
209 HE1 PHE 30 HE1 PHE 30 2.678 5.487 -4.411
210 HE2 PHE 30 HE2 PHE 30 5.232 8.871 -4.827
211 HZ PHE 30 HZ PHE 30 3.057 7.909 -4.200
212 H LEU 31 HN LEU 31 4.516 4.807 -8.302
213 HA LEU 31 HA LEU 31 3.158 2.560 -7.382
214 HB2 LEU 31 HB2 LEU 31 2.549 4.406 -9.674
215 HB3 LEU 31 HB1 LEU 31 1.447 3.152 -9.133
216 HG LEU 31 HG LEU 31 2.388 5.521 -7.511
217 HD11 LEU 31 HD11 LEU 31 0.767 6.136 -9.196
218 HD12 LEU 31 HD12 LEU 31 0.022 6.172 -7.599
219 HD13 LEU 31 HD13 LEU 31 -0.296 4.822 -8.685
220 HD21 LEU 31 HD21 LEU 31 0.528 3.263 -6.776
221 HD22 LEU 31 HD22 LEU 31 0.774 4.731 -5.830
222 HD23 LEU 31 HD23 LEU 31 2.106 3.601 -6.064
223 H ASP 32 HN ASP 32 5.117 2.929 -10.210
224 HA ASP 32 HA ASP 32 3.973 0.564 -11.476
225 HB2 ASP 32 HB2 ASP 32 6.134 2.419 -12.495
226 HB3 ASP 32 HB1 ASP 32 5.288 1.187 -13.425
227 H LEU 33 HN LEU 33 6.352 1.255 -9.277
228 HA LEU 33 HA LEU 33 8.175 -0.846 -10.154
229 HB2 LEU 33 HB2 LEU 33 8.254 0.931 -7.710
230 HB3 LEU 33 HB1 LEU 33 9.508 -0.201 -8.186
231 HG LEU 33 HG LEU 33 8.660 2.219 -9.783
232 HD11 LEU 33 HD11 LEU 33 11.153 1.746 -8.156
233 HD12 LEU 33 HD12 LEU 33 9.805 2.778 -7.680
234 HD13 LEU 33 HD13 LEU 33 10.769 3.185 -9.100
235 HD21 LEU 33 HD21 LEU 33 10.570 1.723 -11.178
236 HD22 LEU 33 HD22 LEU 33 9.493 0.326 -11.131
237 HD23 LEU 33 HD23 LEU 33 10.976 0.328 -10.177
238 H ARG 34 HN ARG 34 8.113 -2.876 -9.367
239 HA ARG 34 HA ARG 34 5.803 -3.686 -7.907
240 HB2 ARG 34 HB2 ARG 34 8.254 -5.337 -8.551
241 HB3 ARG 34 HB1 ARG 34 6.644 -5.936 -8.177
242 HG2 ARG 34 HG2 ARG 34 5.823 -4.785 -10.235
243 HG3 ARG 34 HG1 ARG 34 7.504 -4.420 -10.627
244 HD2 ARG 34 HD2 ARG 34 6.280 -7.153 -10.306
245 HD3 ARG 34 HD1 ARG 34 6.785 -6.398 -11.816
246 HE ARG 34 HE ARG 34 9.090 -6.527 -10.978
247 HH11 ARG 34 HH11 ARG 34 6.639 -8.518 -9.484
248 HH12 ARG 34 HH12 ARG 34 7.766 -9.685 -8.854
249 HH21 ARG 34 HH21 ARG 34 10.604 -8.085 -10.208
250 HH22 ARG 34 HH22 ARG 34 10.026 -9.452 -9.301
251 H PHE 35 HN PHE 35 5.757 -4.836 -5.875
252 HA PHE 35 HA PHE 35 6.966 -3.452 -3.797
253 HB2 PHE 35 HB2 PHE 35 5.738 -6.206 -3.830
254 HB3 PHE 35 HB1 PHE 35 6.247 -5.397 -2.354
255 HD1 PHE 35 HD2 PHE 35 5.354 -2.785 -2.392
256 HD2 PHE 35 HD1 PHE 35 3.486 -6.157 -4.186
257 HE1 PHE 35 HE2 PHE 35 3.182 -1.639 -2.272
258 HE2 PHE 35 HE1 PHE 35 1.310 -5.017 -4.070
259 HZ PHE 35 HZ PHE 35 1.154 -2.755 -3.111
260 H GLU 36 HN GLU 36 7.856 -6.713 -4.958
261 HA GLU 36 HA GLU 36 10.086 -7.005 -3.273
262 HB2 GLU 36 HB2 GLU 36 10.797 -8.796 -4.790
263 HB3 GLU 36 HB1 GLU 36 9.084 -8.911 -4.406
264 HG2 GLU 36 HG2 GLU 36 8.501 -7.978 -6.550
265 HG3 GLU 36 HG1 GLU 36 10.203 -7.712 -6.927
266 H ASP 37 HN ASP 37 9.625 -5.096 -6.056
267 HA ASP 37 HA ASP 37 12.393 -5.020 -6.883
268 HB2 ASP 37 HB2 ASP 37 10.611 -4.866 -8.548
269 HB3 ASP 37 HB1 ASP 37 9.962 -3.438 -7.755
270 H ILE 38 HN ILE 38 10.132 -3.028 -5.070
271 HA ILE 38 HA ILE 38 12.127 -0.950 -4.697
272 HB ILE 38 HB ILE 38 10.344 0.089 -3.205
273 HG12 ILE 38 HG12 ILE 38 8.699 -2.117 -4.464
274 HG13 ILE 38 HG11 ILE 38 9.031 -1.911 -2.748
275 HG21 ILE 38 HG21 ILE 38 10.789 0.848 -5.468
276 HG22 ILE 38 HG22 ILE 38 9.060 0.909 -5.118
277 HG23 ILE 38 HG23 ILE 38 9.714 -0.396 -6.109
278 HD11 ILE 38 HD11 ILE 38 7.754 0.174 -2.763
279 HD12 ILE 38 HD12 ILE 38 6.781 -1.197 -3.294
280 HD13 ILE 38 HD13 ILE 38 7.414 -0.054 -4.478
281 H GLY 39 HN GLY 39 11.809 -3.880 -3.433
282 HA2 GLY 39 HA2 GLY 39 12.959 -4.844 -1.692
283 HA3 GLY 39 HA1 GLY 39 13.564 -3.249 -1.281
284 H TYR 40 HN TYR 40 10.196 -4.411 -1.379
285 HA TYR 40 HA TYR 40 10.083 -3.850 1.504
286 HB2 TYR 40 HB2 TYR 40 8.074 -3.470 -0.668
287 HB3 TYR 40 HB1 TYR 40 7.499 -3.825 0.962
288 HD1 TYR 40 HD2 TYR 40 7.838 -2.249 2.774
289 HD2 TYR 40 HD1 TYR 40 9.187 -1.353 -1.160
290 HE1 TYR 40 HE2 TYR 40 8.129 0.104 3.415
291 HE2 TYR 40 HE1 TYR 40 9.487 1.001 -0.526
292 HH TYR 40 HH TYR 40 8.626 2.574 1.149
293 H ASP 41 HN ASP 41 9.917 -5.482 2.809
294 HA ASP 41 HA ASP 41 9.618 -8.153 1.816
295 HB2 ASP 41 HB2 ASP 41 9.785 -7.137 4.661
296 HB3 ASP 41 HB1 ASP 41 9.900 -8.823 4.175
297 H SER 42 HN SER 42 8.120 -9.703 2.736
298 HA SER 42 HA SER 42 5.429 -9.155 2.550
299 HB2 SER 42 HB2 SER 42 5.192 -11.280 3.963
300 HB3 SER 42 HB1 SER 42 6.194 -11.425 2.512
301 H LEU 43 HN LEU 43 7.391 -9.404 5.472
302 HA LEU 43 HA LEU 43 5.508 -8.821 7.405
303 HB2 LEU 43 HB2 LEU 43 7.794 -9.610 7.844
304 HB3 LEU 43 HB1 LEU 43 8.429 -8.049 7.362
305 HG LEU 43 HG LEU 43 7.226 -7.010 9.270
306 HD11 LEU 43 HD11 LEU 43 6.346 -8.464 11.035
307 HD12 LEU 43 HD12 LEU 43 6.613 -9.869 10.000
308 HD13 LEU 43 HD13 LEU 43 5.444 -8.634 9.531
309 HD21 LEU 43 HD21 LEU 43 9.571 -7.637 9.465
310 HD22 LEU 43 HD22 LEU 43 9.104 -9.257 9.980
311 HD23 LEU 43 HD23 LEU 43 8.731 -7.869 10.999
312 H ALA 44 HN ALA 44 7.688 -6.522 5.763
313 HA ALA 44 HA ALA 44 6.707 -4.229 7.061
314 HB1 ALA 44 HB1 ALA 44 7.893 -2.971 5.349
315 HB2 ALA 44 HB2 ALA 44 8.052 -4.430 4.369
316 HB3 ALA 44 HB3 ALA 44 8.877 -4.318 5.923
317 H LEU 45 HN LEU 45 5.718 -5.885 4.127
318 HA LEU 45 HA LEU 45 4.024 -3.828 3.160
319 HB2 LEU 45 HB2 LEU 45 4.965 -5.617 1.751
320 HB3 LEU 45 HB1 LEU 45 3.978 -6.793 2.594
321 HG LEU 45 HG LEU 45 1.949 -5.805 1.691
322 HD11 LEU 45 HD11 LEU 45 2.043 -3.989 0.064
323 HD12 LEU 45 HD12 LEU 45 3.782 -3.841 0.319
324 HD13 LEU 45 HD13 LEU 45 2.663 -3.473 1.633
325 HD21 LEU 45 HD21 LEU 45 4.045 -6.257 -0.435
326 HD22 LEU 45 HD22 LEU 45 2.298 -6.333 -0.671
327 HD23 LEU 45 HD23 LEU 45 3.098 -7.507 0.372
328 H MET 46 HN MET 46 3.465 -6.675 5.222
329 HA MET 46 HA MET 46 0.638 -6.329 5.299
330 HB2 MET 46 HB2 MET 46 0.547 -8.094 6.794
331 HB3 MET 46 HB1 MET 46 2.048 -8.431 5.947
332 HG2 MET 46 HG2 MET 46 3.335 -7.564 7.779
333 HG3 MET 46 HG1 MET 46 1.872 -7.032 8.607
334 HE1 MET 46 HE1 MET 46 3.887 -8.638 10.239
335 HE2 MET 46 HE2 MET 46 2.892 -9.892 10.982
336 HE3 MET 46 HE3 MET 46 2.281 -8.243 10.850
337 H GLU 47 HN GLU 47 3.300 -5.133 7.274
338 HA GLU 47 HA GLU 47 1.742 -3.955 9.297
339 HB2 GLU 47 HB2 GLU 47 4.452 -3.197 8.207
340 HB3 GLU 47 HB1 GLU 47 3.745 -2.487 9.650
341 HG2 GLU 47 HG2 GLU 47 4.290 -5.425 9.301
342 HG3 GLU 47 HG1 GLU 47 5.385 -4.296 10.091
343 H THR 48 HN THR 48 2.888 -2.770 6.182
344 HA THR 48 HA THR 48 1.862 -0.165 6.316
345 HB THR 48 HB THR 48 2.145 -1.900 3.848
346 HG1 THR 48 HG1 THR 48 4.139 -1.812 4.890
347 HG21 THR 48 HG21 THR 48 2.171 1.100 4.194
348 HG22 THR 48 HG22 THR 48 0.868 0.156 3.474
349 HG23 THR 48 HG23 THR 48 2.442 0.236 2.681
350 H ALA 49 HN ALA 49 0.434 -3.190 5.134
351 HA ALA 49 HA ALA 49 -2.021 -2.218 4.245
352 HB1 ALA 49 HB1 ALA 49 -1.440 -4.874 5.559
353 HB2 ALA 49 HB2 ALA 49 -1.263 -4.505 3.842
354 HB3 ALA 49 HB3 ALA 49 -2.861 -4.489 4.588
355 H ALA 50 HN ALA 50 -1.022 -3.227 7.485
356 HA ALA 50 HA ALA 50 -3.526 -2.997 8.747
357 HB1 ALA 50 HB1 ALA 50 -0.764 -2.684 9.927
358 HB2 ALA 50 HB2 ALA 50 -1.651 -4.198 9.743
359 HB3 ALA 50 HB3 ALA 50 -2.251 -2.955 10.838
360 H ARG 51 HN ARG 51 -0.957 -0.694 8.107
361 HA ARG 51 HA ARG 51 -1.901 1.494 9.587
362 HB2 ARG 51 HB2 ARG 51 -0.462 1.490 6.921
363 HB3 ARG 51 HB1 ARG 51 -0.637 2.876 7.977
364 HG2 ARG 51 HG2 ARG 51 0.812 0.342 8.691
365 HG3 ARG 51 HG1 ARG 51 1.579 1.823 8.121
366 HD2 ARG 51 HD2 ARG 51 -0.139 1.685 10.587
367 HD3 ARG 51 HD1 ARG 51 1.609 1.464 10.610
368 HE ARG 51 HE ARG 51 0.615 3.925 9.396
369 HH11 ARG 51 HH11 ARG 51 2.038 2.334 12.170
370 HH12 ARG 51 HH12 ARG 51 2.545 3.810 12.930
371 HH21 ARG 51 HH21 ARG 51 1.287 5.883 10.382
372 HH22 ARG 51 HH22 ARG 51 2.123 5.829 11.912
373 H LEU 52 HN LEU 52 -2.581 0.447 6.272
374 HA LEU 52 HA LEU 52 -4.283 2.591 5.578
375 HB2 LEU 52 HB2 LEU 52 -4.240 -0.213 4.457
376 HB3 LEU 52 HB1 LEU 52 -4.981 1.183 3.700
377 HG LEU 52 HG LEU 52 -2.026 0.885 4.237
378 HD11 LEU 52 HD11 LEU 52 -3.568 0.612 1.663
379 HD12 LEU 52 HD12 LEU 52 -2.798 -0.701 2.556
380 HD13 LEU 52 HD13 LEU 52 -1.813 0.571 1.834
381 HD21 LEU 52 HD21 LEU 52 -2.755 3.199 4.234
382 HD22 LEU 52 HD22 LEU 52 -3.581 2.955 2.695
383 HD23 LEU 52 HD23 LEU 52 -1.823 2.848 2.778
384 H GLU 53 HN GLU 53 -4.959 -0.671 6.803
385 HA GLU 53 HA GLU 53 -7.724 -0.655 6.578
386 HB2 GLU 53 HB2 GLU 53 -5.948 -2.000 8.610
387 HB3 GLU 53 HB1 GLU 53 -7.678 -2.296 8.507
388 HG2 GLU 53 HG2 GLU 53 -7.405 -3.135 6.236
389 HG3 GLU 53 HG1 GLU 53 -5.674 -2.811 6.319
390 H SER 54 HN SER 54 -5.871 0.083 9.543
391 HA SER 54 HA SER 54 -8.178 0.920 10.958
392 HB2 SER 54 HB2 SER 54 -6.197 0.067 12.117
393 HB3 SER 54 HB1 SER 54 -5.262 1.453 11.563
394 HG SER 54 HG SER 54 -7.187 2.618 12.675
395 H ARG 55 HN ARG 55 -6.113 2.558 8.717
396 HA ARG 55 HA ARG 55 -6.605 5.188 9.755
397 HB2 ARG 55 HB2 ARG 55 -4.557 4.602 8.438
398 HB3 ARG 55 HB1 ARG 55 -5.580 4.437 7.013
399 HG2 ARG 55 HG2 ARG 55 -6.216 6.766 7.169
400 HG3 ARG 55 HG1 ARG 55 -5.244 6.957 8.629
401 HD2 ARG 55 HD2 ARG 55 -3.229 6.402 7.326
402 HD3 ARG 55 HD1 ARG 55 -4.224 6.244 5.876
403 HE ARG 55 HE ARG 55 -4.238 8.792 7.339
404 HH11 ARG 55 HH11 ARG 55 -3.196 6.965 4.544
405 HH12 ARG 55 HH12 ARG 55 -2.992 8.368 3.546
406 HH21 ARG 55 HH21 ARG 55 -3.980 10.644 5.996
407 HH22 ARG 55 HH22 ARG 55 -3.464 10.440 4.343
408 H TYR 56 HN TYR 56 -7.827 3.301 7.014
409 HA TYR 56 HA TYR 56 -9.654 5.480 6.350
410 HB2 TYR 56 HB2 TYR 56 -9.002 2.923 4.876
411 HB3 TYR 56 HB1 TYR 56 -10.126 4.156 4.302
412 HD1 TYR 56 HD2 TYR 56 -9.200 6.523 3.948
413 HD2 TYR 56 HD1 TYR 56 -6.734 3.089 4.407
414 HE1 TYR 56 HE2 TYR 56 -7.333 7.730 2.898
415 HE2 TYR 56 HE1 TYR 56 -4.863 4.282 3.360
416 HH TYR 56 HH TYR 56 -4.371 6.115 2.025
417 H GLY 57 HN GLY 57 -9.656 2.562 8.071
418 HA2 GLY 57 HA2 GLY 57 -11.430 1.654 9.279
419 HA3 GLY 57 HA1 GLY 57 -12.535 2.713 8.413
420 H VAL 58 HN VAL 58 -10.185 0.311 7.325
421 HA VAL 58 HA VAL 58 -12.360 -1.139 5.968
422 HB VAL 58 HB VAL 58 -10.930 -1.544 4.031
423 HG11 VAL 58 HG11 VAL 58 -11.177 1.381 4.691
424 HG12 VAL 58 HG12 VAL 58 -12.388 0.367 3.906
425 HG13 VAL 58 HG13 VAL 58 -10.869 0.725 3.083
426 HG21 VAL 58 HG21 VAL 58 -8.749 -1.460 5.105
427 HG22 VAL 58 HG22 VAL 58 -8.933 0.271 5.386
428 HG23 VAL 58 HG23 VAL 58 -8.800 -0.344 3.738
429 H SER 59 HN SER 59 -11.027 -3.210 4.909
430 HA SER 59 HA SER 59 -8.973 -4.229 6.620
431 HB2 SER 59 HB2 SER 59 -11.105 -4.800 7.856
432 HB3 SER 59 HB1 SER 59 -11.559 -5.800 6.474
433 HG SER 59 HG SER 59 -9.063 -6.131 7.753
434 H ILE 60 HN ILE 60 -7.697 -5.613 5.513
435 HA ILE 60 HA ILE 60 -8.469 -6.139 2.734
436 HB ILE 60 HB ILE 60 -5.763 -6.397 4.063
437 HG12 ILE 60 HG12 ILE 60 -6.929 -4.247 2.262
438 HG13 ILE 60 HG11 ILE 60 -6.516 -4.075 3.965
439 HG21 ILE 60 HG21 ILE 60 -5.999 -7.902 2.159
440 HG22 ILE 60 HG22 ILE 60 -4.890 -6.584 1.781
441 HG23 ILE 60 HG23 ILE 60 -6.536 -6.559 1.150
442 HD11 ILE 60 HD11 ILE 60 -4.156 -4.433 3.412
443 HD12 ILE 60 HD12 ILE 60 -4.835 -3.037 2.577
444 HD13 ILE 60 HD13 ILE 60 -4.585 -4.552 1.704
445 HA PRO 61 HA PRO 61 -9.516 -10.307 3.878
446 HB2 PRO 61 HB2 PRO 61 -9.317 -10.842 0.982
447 HB3 PRO 61 HB1 PRO 61 -10.696 -11.020 2.070
448 HG2 PRO 61 HG2 PRO 61 -10.595 -9.053 0.259
449 HG3 PRO 61 HG1 PRO 61 -11.323 -8.809 1.858
450 HD2 PRO 61 HD2 PRO 61 -8.625 -7.973 0.854
451 HD3 PRO 61 HD1 PRO 61 -9.773 -7.080 1.874
452 H ASP 62 HN ASP 62 -8.525 -12.243 4.128
453 HA ASP 62 HA ASP 62 -5.745 -12.294 4.233
454 HB2 ASP 62 HB2 ASP 62 -7.624 -14.666 4.194
455 HB3 ASP 62 HB1 ASP 62 -5.976 -14.660 4.810
456 H ASP 63 HN ASP 63 -7.951 -13.604 1.805
457 HA ASP 63 HA ASP 63 -5.799 -14.956 0.405
458 HB2 ASP 63 HB2 ASP 63 -8.720 -14.606 -0.278
459 HB3 ASP 63 HB1 ASP 63 -7.587 -15.576 -1.212
460 H VAL 64 HN VAL 64 -7.900 -12.165 -0.133
461 HA VAL 64 HA VAL 64 -7.025 -11.732 -2.810
462 HB VAL 64 HB VAL 64 -8.420 -9.749 -1.006
463 HG11 VAL 64 HG11 VAL 64 -7.490 -8.764 -3.041
464 HG12 VAL 64 HG12 VAL 64 -9.252 -8.785 -3.096
465 HG13 VAL 64 HG13 VAL 64 -8.326 -9.973 -4.014
466 HG21 VAL 64 HG21 VAL 64 -9.613 -11.820 -2.845
467 HG22 VAL 64 HG22 VAL 64 -10.512 -10.594 -1.953
468 HG23 VAL 64 HG23 VAL 64 -9.648 -11.863 -1.083
469 H ALA 65 HN ALA 65 -5.660 -11.008 0.214
470 HA ALA 65 HA ALA 65 -4.177 -8.696 -0.366
471 HB1 ALA 65 HB1 ALA 65 -3.376 -10.997 1.406
472 HB2 ALA 65 HB2 ALA 65 -4.400 -9.644 1.889
473 HB3 ALA 65 HB3 ALA 65 -2.714 -9.362 1.449
474 H GLY 66 HN GLY 66 -3.647 -12.055 -1.137
475 HA2 GLY 66 HA2 GLY 66 -0.977 -11.488 -2.203
476 HA3 GLY 66 HA1 GLY 66 -1.679 -13.081 -1.965
477 H ARG 67 HN ARG 67 -2.838 -10.196 -3.698
478 HA ARG 67 HA ARG 67 -2.819 -11.765 -6.190
479 HB2 ARG 67 HB2 ARG 67 -5.126 -10.161 -5.071
480 HB3 ARG 67 HB1 ARG 67 -5.042 -10.676 -6.748
481 HG2 ARG 67 HG2 ARG 67 -5.049 -12.513 -4.359
482 HG3 ARG 67 HG1 ARG 67 -6.443 -12.147 -5.376
483 HD2 ARG 67 HD2 ARG 67 -3.886 -13.456 -6.302
484 HD3 ARG 67 HD1 ARG 67 -5.406 -14.287 -5.982
485 HE ARG 67 HE ARG 67 -5.495 -12.156 -7.957
486 HH11 ARG 67 HH11 ARG 67 -5.221 -15.591 -7.342
487 HH12 ARG 67 HH12 ARG 67 -5.742 -16.044 -8.941
488 HH21 ARG 67 HH21 ARG 67 -6.186 -12.736 -10.039
489 HH22 ARG 67 HH22 ARG 67 -6.305 -14.413 -10.481
490 H VAL 68 HN VAL 68 -1.339 -9.408 -4.856
491 HA VAL 68 HA VAL 68 -1.338 -7.712 -7.245
492 HB VAL 68 HB VAL 68 -1.151 -5.668 -5.886
493 HG11 VAL 68 HG11 VAL 68 -3.488 -5.510 -5.163
494 HG12 VAL 68 HG12 VAL 68 -3.640 -7.260 -5.293
495 HG13 VAL 68 HG13 VAL 68 -3.341 -6.291 -6.737
496 HG21 VAL 68 HG21 VAL 68 -0.241 -6.654 -3.841
497 HG22 VAL 68 HG22 VAL 68 -1.789 -7.444 -3.529
498 HG23 VAL 68 HG23 VAL 68 -1.675 -5.684 -3.502
499 H ASP 69 HN ASP 69 0.677 -6.672 -7.660
500 HA ASP 69 HA ASP 69 2.865 -7.408 -5.844
501 HB2 ASP 69 HB2 ASP 69 4.290 -8.105 -7.657
502 HB3 ASP 69 HB1 ASP 69 2.812 -9.046 -7.700
503 H THR 70 HN THR 70 1.268 -5.040 -7.521
504 HA THR 70 HA THR 70 3.591 -3.245 -7.258
505 HB THR 70 HB THR 70 2.646 -1.875 -9.104
506 HG1 THR 70 HG1 THR 70 0.854 -4.092 -9.311
507 HG21 THR 70 HG21 THR 70 3.302 -3.384 -10.937
508 HG22 THR 70 HG22 THR 70 3.284 -4.743 -9.809
509 HG23 THR 70 HG23 THR 70 4.442 -3.428 -9.593
510 HA PRO 71 HA PRO 71 1.188 -0.749 -4.463
511 HB2 PRO 71 HB2 PRO 71 2.316 1.543 -5.994
512 HB3 PRO 71 HB1 PRO 71 2.350 1.229 -4.257
513 HG2 PRO 71 HG2 PRO 71 4.535 0.874 -5.725
514 HG3 PRO 71 HG1 PRO 71 4.122 -0.266 -4.428
515 HD2 PRO 71 HD2 PRO 71 3.802 -0.562 -7.390
516 HD3 PRO 71 HD1 PRO 71 4.297 -1.768 -6.182
517 H ARG 72 HN ARG 72 1.216 0.025 -7.896
518 HA ARG 72 HA ARG 72 -0.947 1.754 -8.070
519 HB2 ARG 72 HB2 ARG 72 0.756 0.767 -9.864
520 HB3 ARG 72 HB1 ARG 72 -0.585 -0.318 -10.191
521 HG2 ARG 72 HG2 ARG 72 -0.784 2.684 -10.258
522 HG3 ARG 72 HG1 ARG 72 -0.472 1.674 -11.670
523 HD2 ARG 72 HD2 ARG 72 -2.614 0.557 -11.354
524 HD3 ARG 72 HD1 ARG 72 -2.913 1.517 -9.902
525 HE ARG 72 HE ARG 72 -2.411 3.131 -12.223
526 HH11 ARG 72 HH11 ARG 72 -4.876 1.333 -10.499
527 HH12 ARG 72 HH12 ARG 72 -6.194 2.256 -11.139
528 HH21 ARG 72 HH21 ARG 72 -4.138 4.348 -13.083
529 HH22 ARG 72 HH22 ARG 72 -5.776 3.979 -12.627
530 H GLU 73 HN GLU 73 -0.898 -1.792 -8.142
531 HA GLU 73 HA GLU 73 -3.669 -2.148 -8.578
532 HB2 GLU 73 HB2 GLU 73 -1.666 -3.993 -7.263
533 HB3 GLU 73 HB1 GLU 73 -3.259 -4.463 -7.838
534 HG2 GLU 73 HG2 GLU 73 -2.646 -4.073 -10.101
535 HG3 GLU 73 HG1 GLU 73 -1.127 -3.318 -9.617
536 H LEU 74 HN LEU 74 -1.692 -2.222 -5.642
537 HA LEU 74 HA LEU 74 -3.660 -2.884 -3.785
538 HB2 LEU 74 HB2 LEU 74 -1.071 -2.637 -3.586
539 HB3 LEU 74 HB1 LEU 74 -1.427 -0.978 -3.160
540 HG LEU 74 HG LEU 74 -2.478 -3.379 -1.647
541 HD11 LEU 74 HD11 LEU 74 -0.050 -3.245 -1.492
542 HD12 LEU 74 HD12 LEU 74 -0.800 -2.795 0.040
543 HD13 LEU 74 HD13 LEU 74 -0.160 -1.546 -1.027
544 HD21 LEU 74 HD21 LEU 74 -3.859 -1.369 -1.428
545 HD22 LEU 74 HD22 LEU 74 -2.436 -0.440 -0.954
546 HD23 LEU 74 HD23 LEU 74 -3.021 -1.743 0.080
547 H LEU 75 HN LEU 75 -2.478 0.317 -4.756
548 HA LEU 75 HA LEU 75 -4.150 1.849 -3.117
549 HB2 LEU 75 HB2 LEU 75 -2.063 2.446 -4.580
550 HB3 LEU 75 HB1 LEU 75 -3.250 2.791 -5.816
551 HG LEU 75 HG LEU 75 -3.379 4.108 -3.116
552 HD11 LEU 75 HD11 LEU 75 -2.181 6.004 -4.136
553 HD12 LEU 75 HD12 LEU 75 -1.856 5.008 -5.555
554 HD13 LEU 75 HD13 LEU 75 -1.173 4.567 -3.991
555 HD21 LEU 75 HD21 LEU 75 -4.596 5.820 -4.322
556 HD22 LEU 75 HD22 LEU 75 -5.364 4.247 -4.544
557 HD23 LEU 75 HD23 LEU 75 -4.378 4.935 -5.834
558 H ASP 76 HN ASP 76 -4.589 0.697 -6.431
559 HA ASP 76 HA ASP 76 -6.988 2.083 -6.980
560 HB2 ASP 76 HB2 ASP 76 -5.546 1.147 -8.721
561 HB3 ASP 76 HB1 ASP 76 -5.906 -0.482 -8.161
562 H LEU 77 HN LEU 77 -6.370 -1.162 -5.736
563 HA LEU 77 HA LEU 77 -8.965 -2.167 -6.007
564 HB2 LEU 77 HB2 LEU 77 -7.001 -3.581 -5.674
565 HB3 LEU 77 HB1 LEU 77 -6.812 -2.957 -4.046
566 HG LEU 77 HG LEU 77 -8.980 -3.970 -3.424
567 HD11 LEU 77 HD11 LEU 77 -10.024 -3.945 -5.640
568 HD12 LEU 77 HD12 LEU 77 -10.059 -5.555 -4.924
569 HD13 LEU 77 HD13 LEU 77 -8.887 -5.176 -6.187
570 HD21 LEU 77 HD21 LEU 77 -8.205 -6.296 -3.446
571 HD22 LEU 77 HD22 LEU 77 -6.909 -5.177 -3.021
572 HD23 LEU 77 HD23 LEU 77 -6.981 -5.869 -4.642
573 H ILE 78 HN ILE 78 -7.389 -0.671 -3.180
574 HA ILE 78 HA ILE 78 -9.639 -1.071 -1.487
575 HB ILE 78 HB ILE 78 -7.392 0.919 -1.120
576 HG12 ILE 78 HG12 ILE 78 -7.672 -1.957 -0.219
577 HG13 ILE 78 HG11 ILE 78 -6.514 -1.341 -1.394
578 HG21 ILE 78 HG21 ILE 78 -9.267 -0.317 0.897
579 HG22 ILE 78 HG22 ILE 78 -9.354 1.340 0.299
580 HG23 ILE 78 HG23 ILE 78 -7.961 0.816 1.244
581 HD11 ILE 78 HD11 ILE 78 -5.414 -0.053 0.345
582 HD12 ILE 78 HD12 ILE 78 -5.482 -1.764 0.776
583 HD13 ILE 78 HD13 ILE 78 -6.594 -0.618 1.526
584 H ASN 79 HN ASN 79 -8.737 1.429 -3.728
585 HA ASN 79 HA ASN 79 -10.525 3.430 -2.787
586 HB2 ASN 79 HB2 ASN 79 -8.905 3.018 -5.236
587 HB3 ASN 79 HB1 ASN 79 -10.309 4.066 -5.398
588 HD21 ASN 79 HD21 ASN 79 -7.239 3.614 -3.840
589 HD22 ASN 79 HD22 ASN 79 -7.042 5.256 -3.323
590 H GLY 80 HN GLY 80 -10.820 0.758 -5.059
591 HA2 GLY 80 HA2 GLY 80 -13.280 1.431 -6.222
592 HA3 GLY 80 HA1 GLY 80 -12.653 -0.204 -6.049
593 H ALA 81 HN ALA 81 -12.545 -0.229 -3.193
594 HA ALA 81 HA ALA 81 -15.247 -1.005 -2.689
595 HB1 ALA 81 HB1 ALA 81 -13.404 -2.262 -1.743
596 HB2 ALA 81 HB2 ALA 81 -14.428 -1.622 -0.457
597 HB3 ALA 81 HB3 ALA 81 -12.886 -0.849 -0.823
598 H LEU 82 HN LEU 82 -13.189 1.662 -1.628
599 HA LEU 82 HA LEU 82 -15.002 2.756 0.244
600 HB2 LEU 82 HB2 LEU 82 -12.778 4.058 -1.325
601 HB3 LEU 82 HB1 LEU 82 -13.635 4.825 -0.002
602 HG LEU 82 HG LEU 82 -11.980 2.314 0.243
603 HD11 LEU 82 HD11 LEU 82 -10.611 4.283 -0.240
604 HD12 LEU 82 HD12 LEU 82 -10.377 3.716 1.413
605 HD13 LEU 82 HD13 LEU 82 -11.371 5.139 1.100
606 HD21 LEU 82 HD21 LEU 82 -13.274 4.051 2.346
607 HD22 LEU 82 HD22 LEU 82 -12.268 2.633 2.641
608 HD23 LEU 82 HD23 LEU 82 -13.833 2.452 1.849
609 H ALA 83 HN ALA 83 -14.572 3.166 -3.205
610 HA ALA 83 HA ALA 83 -16.179 5.488 -3.484
611 HB1 ALA 83 HB1 ALA 83 -14.494 4.788 -5.142
612 HB2 ALA 83 HB2 ALA 83 -16.078 5.076 -5.863
613 HB3 ALA 83 HB3 ALA 83 -15.522 3.426 -5.586
614 H GLU 84 HN GLU 84 -17.082 2.365 -2.687
615 HA GLU 84 HA GLU 84 -19.654 2.511 -4.050
616 HB2 GLU 84 HB2 GLU 84 -18.524 0.375 -2.241
617 HB3 GLU 84 HB1 GLU 84 -20.068 0.280 -3.073
618 HG2 GLU 84 HG2 GLU 84 -18.773 0.540 -5.223
619 HG3 GLU 84 HG1 GLU 84 -17.317 0.279 -4.261
620 H ALA 85 HN ALA 85 -18.314 2.760 -0.806
621 HA ALA 85 HA ALA 85 -21.024 3.361 0.179
622 HB1 ALA 85 HB1 ALA 85 -20.468 2.274 2.283
623 HB2 ALA 85 HB2 ALA 85 -18.870 1.865 1.659
624 HB3 ALA 85 HB3 ALA 85 -20.309 1.148 0.933
625 H ALA 86 HN ALA 86 -20.648 5.587 -0.056
626 HA ALA 86 HA ALA 86 -19.627 6.860 2.250
627 HB1 ALA 86 HB1 ALA 86 -18.000 7.248 -0.261
628 HB2 ALA 86 HB2 ALA 86 -17.470 6.393 1.187
629 HB3 ALA 86 HB3 ALA 86 -17.795 8.127 1.252
630 H28 SXO 87 H28B SXO 87 5.971 -11.512 6.511
631 H28A SXO 87 H28A SXO 87 7.031 -12.636 7.364
632 H30 SXO 87 H30A SXO 87 5.486 -12.052 9.316
633 H30A SXO 87 H30C SXO 87 4.458 -11.133 8.216
634 H30B SXO 87 H30B SXO 87 3.768 -12.430 9.192
635 H31 SXO 87 H31A SXO 87 2.902 -13.664 7.142
636 H31A SXO 87 H31B SXO 87 3.981 -13.863 5.762
637 H31B SXO 87 H31C SXO 87 3.447 -12.251 6.239
638 H32 SXO 87 H32A SXO 87 5.916 -14.345 9.007
639 HO33 SXO 87 H33A SXO 87 6.135 -14.758 6.360
640 HN36 SXO 87 H36A SXO 87 3.518 -13.866 9.832
641 H37 SXO 87 H37A SXO 87 2.101 -16.429 9.778
642 H37A SXO 87 H37B SXO 87 1.947 -15.179 11.011
643 H38 SXO 87 H38B SXO 87 -0.058 -15.419 9.570
644 H38A SXO 87 H38A SXO 87 0.921 -14.953 8.185
645 HN41 SXO 87 H41A SXO 87 -0.774 -13.355 8.016
646 H42 SXO 87 H42A SXO 87 -1.545 -11.326 9.594
647 H42A SXO 87 H42B SXO 87 0.062 -10.812 9.082
648 H43 SXO 87 H43B SXO 87 -2.243 -11.496 7.260
649 H43A SXO 87 H43A SXO 87 -1.628 -9.870 7.608
650 H2 SXO 87 H2A SXO 87 -1.147 -10.111 2.841
651 H2A SXO 87 H2B SXO 87 -0.080 -11.422 3.343
652 H3 SXO 87 H3B SXO 87 0.365 -8.500 3.924
653 H3A SXO 87 H3A SXO 87 1.446 -9.826 4.345
654 H4 SXO 87 H4A SXO 87 1.759 -10.328 1.973
655 H4A SXO 87 H4B SXO 87 2.218 -8.664 2.339
656 H5 SXO 87 H5B SXO 87 0.945 -8.802 0.254
657 H5A SXO 87 H5A SXO 87 -0.399 -9.547 1.118
658 H6 SXO 87 H6A SXO 87 0.701 -6.785 1.638
659 H6A SXO 87 H6B SXO 87 -0.675 -7.526 2.455
660 H7 SXO 87 H7A SXO 87 -1.877 -7.643 0.322
661 H7A SXO 87 H7B SXO 87 -0.491 -6.899 -0.494
662 H8 SXO 87 H8C SXO 87 -2.228 -5.252 0.017
663 H8A SXO 87 H8A SXO 87 -0.742 -4.917 0.907
664 H8B SXO 87 H8B SXO 87 -2.111 -5.667 1.728
Start of MODEL 9
1 H1 MET 1 HT1 MET 1 -14.777 15.131 5.081
2 H2 MET 1 HT2 MET 1 -16.309 14.422 5.234
3 H3 MET 1 HT3 MET 1 -16.171 16.046 4.758
4 HA MET 1 HA MET 1 -16.693 14.685 2.871
5 HB2 MET 1 HB2 MET 1 -13.836 15.682 2.899
6 HB3 MET 1 HB1 MET 1 -14.710 15.226 1.444
7 HG2 MET 1 HG2 MET 1 -15.496 17.439 3.333
8 HG3 MET 1 HG1 MET 1 -14.655 17.650 1.796
9 HE1 MET 1 HE1 MET 1 -17.367 16.550 -0.798
10 HE2 MET 1 HE2 MET 1 -16.063 15.578 -0.113
11 HE3 MET 1 HE3 MET 1 -15.764 17.251 -0.580
12 H ALA 2 HN ALA 2 -16.561 12.757 1.858
13 HA ALA 2 HA ALA 2 -15.033 10.657 3.073
14 HB1 ALA 2 HB1 ALA 2 -16.078 9.208 1.407
15 HB2 ALA 2 HB2 ALA 2 -16.707 10.621 0.560
16 HB3 ALA 2 HB3 ALA 2 -17.276 10.241 2.185
17 H THR 3 HN THR 3 -12.919 10.624 2.761
18 HA THR 3 HA THR 3 -11.851 11.310 0.125
19 HB THR 3 HB THR 3 -9.653 11.199 1.665
20 HG1 THR 3 HG1 THR 3 -11.599 12.225 3.463
21 HG21 THR 3 HG21 THR 3 -9.860 13.630 1.947
22 HG22 THR 3 HG22 THR 3 -11.576 13.527 1.553
23 HG23 THR 3 HG23 THR 3 -10.365 13.125 0.335
24 H LEU 4 HN LEU 4 -11.050 9.768 -1.137
25 HA LEU 4 HA LEU 4 -10.919 7.043 -0.209
26 HB2 LEU 4 HB2 LEU 4 -10.118 8.204 -2.880
27 HB3 LEU 4 HB1 LEU 4 -10.319 6.502 -2.515
28 HG LEU 4 HG LEU 4 -12.518 8.574 -2.547
29 HD11 LEU 4 HD11 LEU 4 -11.692 7.970 -4.771
30 HD12 LEU 4 HD12 LEU 4 -13.327 7.371 -4.494
31 HD13 LEU 4 HD13 LEU 4 -11.956 6.267 -4.403
32 HD21 LEU 4 HD21 LEU 4 -14.021 6.655 -2.264
33 HD22 LEU 4 HD22 LEU 4 -12.976 6.898 -0.866
34 HD23 LEU 4 HD23 LEU 4 -12.625 5.608 -2.019
35 H LEU 5 HN LEU 5 -8.841 5.868 -1.354
36 HA LEU 5 HA LEU 5 -6.644 6.727 0.295
37 HB2 LEU 5 HB2 LEU 5 -7.321 4.327 -0.152
38 HB3 LEU 5 HB1 LEU 5 -6.682 4.520 -1.769
39 HG LEU 5 HG LEU 5 -4.943 4.973 0.642
40 HD11 LEU 5 HD11 LEU 5 -4.232 2.651 0.485
41 HD12 LEU 5 HD12 LEU 5 -5.429 2.360 -0.778
42 HD13 LEU 5 HD13 LEU 5 -5.952 2.755 0.858
43 HD21 LEU 5 HD21 LEU 5 -4.083 5.735 -1.512
44 HD22 LEU 5 HD22 LEU 5 -4.364 4.135 -2.199
45 HD23 LEU 5 HD23 LEU 5 -3.165 4.349 -0.924
46 H THR 6 HN THR 6 -5.051 8.036 -0.310
47 HA THR 6 HA THR 6 -5.005 8.879 -3.115
48 HB THR 6 HB THR 6 -3.927 10.901 -2.385
49 HG1 THR 6 HG1 THR 6 -3.993 10.509 0.319
50 HG21 THR 6 HG21 THR 6 -5.596 11.831 -0.855
51 HG22 THR 6 HG22 THR 6 -6.148 10.203 -0.462
52 HG23 THR 6 HG23 THR 6 -6.358 10.834 -2.096
53 H THR 7 HN THR 7 -2.887 9.473 -4.033
54 HA THR 7 HA THR 7 -1.005 7.435 -4.050
55 HB THR 7 HB THR 7 0.506 9.296 -5.039
56 HG1 THR 7 HG1 THR 7 -0.328 11.200 -4.469
57 HG21 THR 7 HG21 THR 7 -0.744 7.708 -6.419
58 HG22 THR 7 HG22 THR 7 -0.773 9.319 -7.138
59 HG23 THR 7 HG23 THR 7 -2.187 8.711 -6.277
60 H ASP 8 HN ASP 8 -0.955 10.547 -2.361
61 HA ASP 8 HA ASP 8 1.633 10.244 -1.276
62 HB2 ASP 8 HB2 ASP 8 -0.666 12.054 -0.557
63 HB3 ASP 8 HB1 ASP 8 0.903 12.141 0.238
64 H ASP 9 HN ASP 9 -1.610 9.689 0.085
65 HA ASP 9 HA ASP 9 -0.736 9.023 2.677
66 HB2 ASP 9 HB2 ASP 9 -3.218 8.425 1.126
67 HB3 ASP 9 HB1 ASP 9 -2.929 7.584 2.645
68 H LEU 10 HN LEU 10 -1.148 7.058 -0.219
69 HA LEU 10 HA LEU 10 -0.512 4.578 0.976
70 HB2 LEU 10 HB2 LEU 10 -1.520 4.813 -1.265
71 HB3 LEU 10 HB1 LEU 10 -0.029 5.526 -1.853
72 HG LEU 10 HG LEU 10 1.148 3.399 -1.390
73 HD11 LEU 10 HD11 LEU 10 -0.116 1.392 -0.871
74 HD12 LEU 10 HD12 LEU 10 -1.604 2.334 -0.776
75 HD13 LEU 10 HD13 LEU 10 -0.321 2.595 0.404
76 HD21 LEU 10 HD21 LEU 10 -1.282 3.148 -3.160
77 HD22 LEU 10 HD22 LEU 10 0.157 2.131 -3.233
78 HD23 LEU 10 HD23 LEU 10 0.273 3.849 -3.617
79 H ARG 11 HN ARG 11 1.481 6.937 -0.780
80 HA ARG 11 HA ARG 11 3.922 5.626 -0.626
81 HB2 ARG 11 HB2 ARG 11 3.589 7.525 -2.084
82 HB3 ARG 11 HB1 ARG 11 3.339 8.588 -0.706
83 HG2 ARG 11 HG2 ARG 11 5.619 8.398 -0.046
84 HG3 ARG 11 HG1 ARG 11 5.915 7.126 -1.231
85 HD2 ARG 11 HD2 ARG 11 6.790 9.308 -1.958
86 HD3 ARG 11 HD1 ARG 11 5.553 8.678 -3.048
87 HE ARG 11 HE ARG 11 4.335 10.370 -1.159
88 HH11 ARG 11 HH11 ARG 11 6.502 10.522 -3.895
89 HH12 ARG 11 HH12 ARG 11 6.024 12.128 -4.359
90 HH21 ARG 11 HH21 ARG 11 3.682 12.512 -1.776
91 HH22 ARG 11 HH22 ARG 11 4.450 13.250 -3.143
92 H ARG 12 HN ARG 12 2.553 7.999 1.659
93 HA ARG 12 HA ARG 12 4.852 8.044 3.318
94 HB2 ARG 12 HB2 ARG 12 3.415 9.167 4.979
95 HB3 ARG 12 HB1 ARG 12 3.304 9.894 3.383
96 HG2 ARG 12 HG2 ARG 12 1.181 8.939 2.997
97 HG3 ARG 12 HG1 ARG 12 1.327 7.891 4.410
98 HD2 ARG 12 HD2 ARG 12 1.371 10.885 4.642
99 HD3 ARG 12 HD1 ARG 12 -0.139 9.979 4.625
100 HE ARG 12 HE ARG 12 1.538 8.825 6.547
101 HH11 ARG 12 HH11 ARG 12 -0.153 11.865 6.017
102 HH12 ARG 12 HH12 ARG 12 -0.392 12.160 7.718
103 HH21 ARG 12 HH21 ARG 12 1.264 9.238 8.762
104 HH22 ARG 12 HH22 ARG 12 0.444 10.690 9.274
105 H ALA 13 HN ALA 13 2.092 5.929 3.171
106 HA ALA 13 HA ALA 13 2.154 4.927 5.794
107 HB1 ALA 13 HB1 ALA 13 0.875 3.032 4.929
108 HB2 ALA 13 HB2 ALA 13 1.261 3.519 3.277
109 HB3 ALA 13 HB3 ALA 13 0.262 4.560 4.294
110 H LEU 14 HN LEU 14 3.956 4.037 2.912
111 HA LEU 14 HA LEU 14 5.126 1.666 3.897
112 HB2 LEU 14 HB2 LEU 14 5.902 3.629 1.763
113 HB3 LEU 14 HB1 LEU 14 6.997 2.337 2.209
114 HG LEU 14 HG LEU 14 5.782 1.675 0.255
115 HD11 LEU 14 HD11 LEU 14 4.650 -0.366 1.082
116 HD12 LEU 14 HD12 LEU 14 4.798 0.265 2.722
117 HD13 LEU 14 HD13 LEU 14 6.244 -0.104 1.784
118 HD21 LEU 14 HD21 LEU 14 3.264 2.192 1.824
119 HD22 LEU 14 HD22 LEU 14 3.352 1.482 0.211
120 HD23 LEU 14 HD23 LEU 14 3.862 3.150 0.471
121 H VAL 15 HN VAL 15 6.135 5.046 4.025
122 HA VAL 15 HA VAL 15 8.667 4.512 5.216
123 HB VAL 15 HB VAL 15 7.134 7.118 5.230
124 HG11 VAL 15 HG11 VAL 15 10.085 6.556 5.509
125 HG12 VAL 15 HG12 VAL 15 8.996 7.040 6.808
126 HG13 VAL 15 HG13 VAL 15 9.331 8.151 5.479
127 HG21 VAL 15 HG21 VAL 15 7.384 6.283 2.948
128 HG22 VAL 15 HG22 VAL 15 9.120 6.093 3.201
129 HG23 VAL 15 HG23 VAL 15 8.394 7.701 3.222
130 H GLU 16 HN GLU 16 5.464 5.230 6.445
131 HA GLU 16 HA GLU 16 6.258 5.874 9.085
132 HB2 GLU 16 HB2 GLU 16 3.612 4.896 8.010
133 HB3 GLU 16 HB1 GLU 16 3.864 5.481 9.652
134 HG2 GLU 16 HG2 GLU 16 4.563 7.651 8.763
135 HG3 GLU 16 HG1 GLU 16 4.284 7.062 7.124
136 H SER 17 HN SER 17 5.369 2.825 7.528
137 HA SER 17 HA SER 17 5.694 1.368 10.000
138 HB2 SER 17 HB2 SER 17 5.266 0.441 7.159
139 HB3 SER 17 HB1 SER 17 5.400 -0.650 8.541
140 HG SER 17 HG SER 17 3.286 -0.320 8.457
141 H ALA 18 HN ALA 18 7.726 2.475 7.492
142 HA ALA 18 HA ALA 18 9.792 0.509 7.799
143 HB1 ALA 18 HB1 ALA 18 11.139 1.997 6.420
144 HB2 ALA 18 HB2 ALA 18 9.925 3.265 6.583
145 HB3 ALA 18 HB3 ALA 18 9.533 1.776 5.721
146 H GLY 19 HN GLY 19 9.237 3.802 9.000
147 HA2 GLY 19 HA2 GLY 19 9.960 4.752 10.985
148 HA3 GLY 19 HA1 GLY 19 10.754 3.232 11.378
149 H GLU 20 HN GLU 20 11.062 5.824 8.976
150 HA GLU 20 HA GLU 20 12.798 7.077 8.259
151 HB2 GLU 20 HB2 GLU 20 14.124 6.076 10.781
152 HB3 GLU 20 HB1 GLU 20 14.871 7.229 9.682
153 HG2 GLU 20 HG2 GLU 20 13.062 8.797 10.060
154 HG3 GLU 20 HG1 GLU 20 12.252 7.637 11.114
155 H THR 21 HN THR 21 14.170 6.787 6.660
156 HA THR 21 HA THR 21 15.651 4.264 6.499
157 HB THR 21 HB THR 21 15.210 4.355 3.987
158 HG1 THR 21 HG1 THR 21 14.309 6.322 3.639
159 HG21 THR 21 HG21 THR 21 14.139 2.688 5.406
160 HG22 THR 21 HG22 THR 21 13.007 3.262 4.179
161 HG23 THR 21 HG23 THR 21 12.881 3.842 5.841
162 H ASP 22 HN ASP 22 17.081 4.610 4.265
163 HA ASP 22 HA ASP 22 18.410 7.211 4.627
164 HB2 ASP 22 HB2 ASP 22 20.557 6.142 4.252
165 HB3 ASP 22 HB1 ASP 22 19.722 5.334 5.573
166 H GLY 23 HN GLY 23 18.031 4.508 2.301
167 HA2 GLY 23 HA2 GLY 23 18.227 6.535 0.158
168 HA3 GLY 23 HA1 GLY 23 18.812 4.887 -0.004
169 H THR 24 HN THR 24 16.004 4.686 1.699
170 HA THR 24 HA THR 24 14.553 3.692 -0.561
171 HB THR 24 HB THR 24 13.460 4.149 2.221
172 HG1 THR 24 HG1 THR 24 14.265 1.612 1.702
173 HG21 THR 24 HG21 THR 24 11.804 3.591 0.486
174 HG22 THR 24 HG22 THR 24 11.979 2.284 1.657
175 HG23 THR 24 HG23 THR 24 12.733 2.151 0.068
176 H ASP 25 HN ASP 25 14.560 5.696 -1.792
177 HA ASP 25 HA ASP 25 12.671 7.725 -0.850
178 HB2 ASP 25 HB2 ASP 25 14.851 8.533 -1.644
179 HB3 ASP 25 HB1 ASP 25 14.584 7.750 -3.198
180 H LEU 26 HN LEU 26 10.690 7.915 -1.702
181 HA LEU 26 HA LEU 26 10.021 6.122 -3.942
182 HB2 LEU 26 HB2 LEU 26 8.272 7.109 -1.682
183 HB3 LEU 26 HB1 LEU 26 7.728 6.097 -3.008
184 HG LEU 26 HG LEU 26 9.792 5.298 -0.945
185 HD11 LEU 26 HD11 LEU 26 8.065 3.816 -0.088
186 HD12 LEU 26 HD12 LEU 26 6.924 4.431 -1.283
187 HD13 LEU 26 HD13 LEU 26 7.531 5.496 -0.016
188 HD21 LEU 26 HD21 LEU 26 9.569 3.069 -1.923
189 HD22 LEU 26 HD22 LEU 26 10.150 4.228 -3.118
190 HD23 LEU 26 HD23 LEU 26 8.465 3.707 -3.142
191 H SER 27 HN SER 27 10.921 9.038 -3.888
192 HA SER 27 HA SER 27 8.635 10.431 -4.959
193 HB2 SER 27 HB2 SER 27 10.463 11.627 -3.749
194 HB3 SER 27 HB1 SER 27 11.555 11.235 -5.078
195 HG SER 27 HG SER 27 10.247 13.366 -4.998
196 H GLY 28 HN GLY 28 7.865 9.491 -6.739
197 HA2 GLY 28 HA2 GLY 28 8.639 9.987 -9.241
198 HA3 GLY 28 HA1 GLY 28 9.620 8.577 -8.861
199 H ASP 29 HN ASP 29 8.573 7.270 -10.382
200 HA ASP 29 HA ASP 29 5.709 6.866 -10.114
201 HB2 ASP 29 HB2 ASP 29 7.712 5.565 -11.981
202 HB3 ASP 29 HB1 ASP 29 5.975 5.279 -12.013
203 H PHE 30 HN PHE 30 6.116 6.174 -7.834
204 HA PHE 30 HA PHE 30 7.355 3.646 -7.367
205 HB2 PHE 30 HB2 PHE 30 6.492 3.838 -5.089
206 HB3 PHE 30 HB1 PHE 30 7.225 5.351 -5.599
207 HD1 PHE 30 HD2 PHE 30 5.727 7.261 -6.274
208 HD2 PHE 30 HD1 PHE 30 4.239 3.743 -4.385
209 HE1 PHE 30 HE2 PHE 30 3.665 8.459 -5.664
210 HE2 PHE 30 HE1 PHE 30 2.177 4.940 -3.780
211 HZ PHE 30 HZ PHE 30 1.900 7.301 -4.385
212 H LEU 31 HN LEU 31 4.122 4.732 -8.078
213 HA LEU 31 HA LEU 31 2.638 2.463 -7.399
214 HB2 LEU 31 HB2 LEU 31 2.240 4.445 -9.637
215 HB3 LEU 31 HB1 LEU 31 1.042 3.267 -9.136
216 HG LEU 31 HG LEU 31 2.148 5.440 -7.349
217 HD11 LEU 31 HD11 LEU 31 0.846 6.376 -9.193
218 HD12 LEU 31 HD12 LEU 31 -0.009 6.537 -7.657
219 HD13 LEU 31 HD13 LEU 31 -0.488 5.290 -8.808
220 HD21 LEU 31 HD21 LEU 31 -0.179 3.551 -6.989
221 HD22 LEU 31 HD22 LEU 31 0.282 4.851 -5.889
222 HD23 LEU 31 HD23 LEU 31 1.360 3.477 -6.131
223 H ASP 32 HN ASP 32 4.940 2.895 -9.902
224 HA ASP 32 HA ASP 32 3.864 0.711 -11.524
225 HB2 ASP 32 HB2 ASP 32 4.667 2.820 -12.602
226 HB3 ASP 32 HB1 ASP 32 6.284 2.472 -12.004
227 H LEU 33 HN LEU 33 6.172 1.289 -9.090
228 HA LEU 33 HA LEU 33 7.901 -0.926 -9.849
229 HB2 LEU 33 HB2 LEU 33 8.052 0.974 -7.508
230 HB3 LEU 33 HB1 LEU 33 9.268 -0.217 -7.927
231 HG LEU 33 HG LEU 33 8.483 2.139 -9.648
232 HD11 LEU 33 HD11 LEU 33 10.681 3.023 -9.054
233 HD12 LEU 33 HD12 LEU 33 10.942 1.658 -7.969
234 HD13 LEU 33 HD13 LEU 33 9.665 2.827 -7.626
235 HD21 LEU 33 HD21 LEU 33 10.423 1.511 -10.986
236 HD22 LEU 33 HD22 LEU 33 9.231 0.212 -10.945
237 HD23 LEU 33 HD23 LEU 33 10.685 0.106 -9.954
238 H ARG 34 HN ARG 34 7.817 -2.911 -8.960
239 HA ARG 34 HA ARG 34 5.672 -3.670 -7.273
240 HB2 ARG 34 HB2 ARG 34 8.212 -5.080 -8.055
241 HB3 ARG 34 HB1 ARG 34 6.987 -5.822 -7.040
242 HG2 ARG 34 HG2 ARG 34 5.361 -5.649 -8.823
243 HG3 ARG 34 HG1 ARG 34 6.545 -4.825 -9.842
244 HD2 ARG 34 HD2 ARG 34 7.924 -6.757 -9.953
245 HD3 ARG 34 HD1 ARG 34 6.996 -7.568 -8.694
246 HE ARG 34 HE ARG 34 5.101 -7.471 -10.395
247 HH11 ARG 34 HH11 ARG 34 8.502 -7.757 -11.244
248 HH12 ARG 34 HH12 ARG 34 8.193 -8.619 -12.724
249 HH21 ARG 34 HH21 ARG 34 4.701 -8.634 -12.336
250 HH22 ARG 34 HH22 ARG 34 6.037 -9.108 -13.348
251 H PHE 35 HN PHE 35 5.583 -4.167 -5.102
252 HA PHE 35 HA PHE 35 7.069 -2.711 -3.274
253 HB2 PHE 35 HB2 PHE 35 5.586 -5.308 -2.850
254 HB3 PHE 35 HB1 PHE 35 6.148 -4.257 -1.556
255 HD1 PHE 35 HD2 PHE 35 5.249 -1.855 -1.523
256 HD2 PHE 35 HD1 PHE 35 3.501 -4.994 -3.810
257 HE1 PHE 35 HE2 PHE 35 3.153 -0.579 -1.674
258 HE2 PHE 35 HE1 PHE 35 1.405 -3.717 -3.967
259 HZ PHE 35 HZ PHE 35 1.199 -1.545 -2.816
260 H GLU 36 HN GLU 36 7.534 -6.033 -4.364
261 HA GLU 36 HA GLU 36 9.532 -6.898 -2.663
262 HB2 GLU 36 HB2 GLU 36 9.295 -7.498 -5.617
263 HB3 GLU 36 HB1 GLU 36 10.158 -8.464 -4.429
264 HG2 GLU 36 HG2 GLU 36 7.211 -7.939 -4.280
265 HG3 GLU 36 HG1 GLU 36 7.904 -9.312 -5.135
266 H ASP 37 HN ASP 37 9.764 -4.704 -5.394
267 HA ASP 37 HA ASP 37 12.655 -5.011 -5.521
268 HB2 ASP 37 HB2 ASP 37 11.039 -4.774 -7.544
269 HB3 ASP 37 HB1 ASP 37 11.083 -3.054 -7.166
270 H ILE 38 HN ILE 38 10.285 -2.786 -4.289
271 HA ILE 38 HA ILE 38 12.241 -0.661 -4.015
272 HB ILE 38 HB ILE 38 10.385 0.615 -2.913
273 HG12 ILE 38 HG12 ILE 38 8.708 -1.737 -3.815
274 HG13 ILE 38 HG11 ILE 38 9.097 -1.358 -2.142
275 HG21 ILE 38 HG21 ILE 38 9.817 -0.461 -5.674
276 HG22 ILE 38 HG22 ILE 38 10.926 0.852 -5.281
277 HG23 ILE 38 HG23 ILE 38 9.198 1.047 -4.993
278 HD11 ILE 38 HD11 ILE 38 6.854 -0.634 -2.732
279 HD12 ILE 38 HD12 ILE 38 7.511 0.388 -4.013
280 HD13 ILE 38 HD13 ILE 38 7.882 0.737 -2.324
281 H GLY 39 HN GLY 39 12.252 -3.325 -2.487
282 HA2 GLY 39 HA2 GLY 39 13.510 -3.765 -0.583
283 HA3 GLY 39 HA1 GLY 39 13.393 -2.069 -0.147
284 H TYR 40 HN TYR 40 10.453 -3.727 -0.876
285 HA TYR 40 HA TYR 40 9.941 -3.945 2.010
286 HB2 TYR 40 HB2 TYR 40 8.070 -3.148 -0.215
287 HB3 TYR 40 HB1 TYR 40 7.492 -3.661 1.373
288 HD1 TYR 40 HD2 TYR 40 8.152 -2.356 3.397
289 HD2 TYR 40 HD1 TYR 40 8.942 -0.965 -0.543
290 HE1 TYR 40 HE2 TYR 40 8.527 -0.099 4.275
291 HE2 TYR 40 HE1 TYR 40 9.325 1.299 0.323
292 HH TYR 40 HH TYR 40 9.626 1.961 3.667
293 H ASP 41 HN ASP 41 10.367 -5.966 2.417
294 HA ASP 41 HA ASP 41 9.617 -8.121 0.660
295 HB2 ASP 41 HB2 ASP 41 11.631 -7.866 2.392
296 HB3 ASP 41 HB1 ASP 41 10.465 -8.612 3.479
297 H SER 42 HN SER 42 8.625 -10.116 2.050
298 HA SER 42 HA SER 42 5.904 -9.660 2.213
299 HB2 SER 42 HB2 SER 42 5.856 -11.854 3.477
300 HB3 SER 42 HB1 SER 42 6.757 -11.889 1.958
301 H LEU 43 HN LEU 43 8.209 -9.869 4.895
302 HA LEU 43 HA LEU 43 6.390 -9.520 6.993
303 HB2 LEU 43 HB2 LEU 43 8.686 -10.327 7.290
304 HB3 LEU 43 HB1 LEU 43 9.308 -8.747 6.851
305 HG LEU 43 HG LEU 43 8.184 -7.800 8.856
306 HD11 LEU 43 HD11 LEU 43 6.443 -9.493 9.125
307 HD12 LEU 43 HD12 LEU 43 7.404 -9.329 10.595
308 HD13 LEU 43 HD13 LEU 43 7.672 -10.697 9.515
309 HD21 LEU 43 HD21 LEU 43 10.124 -10.048 9.374
310 HD22 LEU 43 HD22 LEU 43 9.804 -8.688 10.451
311 HD23 LEU 43 HD23 LEU 43 10.550 -8.411 8.876
312 H ALA 44 HN ALA 44 8.434 -7.096 5.362
313 HA ALA 44 HA ALA 44 7.505 -4.899 6.868
314 HB1 ALA 44 HB1 ALA 44 8.668 -4.899 4.083
315 HB2 ALA 44 HB2 ALA 44 9.598 -4.879 5.581
316 HB3 ALA 44 HB3 ALA 44 8.556 -3.517 5.172
317 H LEU 45 HN LEU 45 6.414 -6.381 3.879
318 HA LEU 45 HA LEU 45 4.648 -4.352 3.060
319 HB2 LEU 45 HB2 LEU 45 5.469 -6.200 1.633
320 HB3 LEU 45 HB1 LEU 45 4.470 -7.320 2.538
321 HG LEU 45 HG LEU 45 2.448 -6.137 1.750
322 HD11 LEU 45 HD11 LEU 45 2.609 -4.440 0.029
323 HD12 LEU 45 HD12 LEU 45 4.369 -4.534 0.069
324 HD13 LEU 45 HD13 LEU 45 3.486 -3.926 1.469
325 HD21 LEU 45 HD21 LEU 45 2.559 -6.872 -0.584
326 HD22 LEU 45 HD22 LEU 45 3.284 -8.060 0.498
327 HD23 LEU 45 HD23 LEU 45 4.315 -6.999 -0.459
328 H MET 46 HN MET 46 4.071 -7.297 5.002
329 HA MET 46 HA MET 46 1.273 -6.912 5.193
330 HB2 MET 46 HB2 MET 46 1.280 -8.597 6.937
331 HB3 MET 46 HB1 MET 46 2.354 -9.093 5.638
332 HG2 MET 46 HG2 MET 46 4.284 -8.510 6.927
333 HG3 MET 46 HG1 MET 46 3.280 -7.790 8.185
334 HE1 MET 46 HE1 MET 46 1.533 -10.904 9.751
335 HE2 MET 46 HE2 MET 46 0.907 -9.859 8.480
336 HE3 MET 46 HE3 MET 46 1.773 -9.156 9.850
337 H GLU 47 HN GLU 47 3.942 -5.848 7.257
338 HA GLU 47 HA GLU 47 2.317 -4.864 9.355
339 HB2 GLU 47 HB2 GLU 47 5.103 -4.027 8.526
340 HB3 GLU 47 HB1 GLU 47 4.326 -3.589 10.041
341 HG2 GLU 47 HG2 GLU 47 4.125 -6.072 10.494
342 HG3 GLU 47 HG1 GLU 47 5.218 -6.301 9.129
343 H THR 48 HN THR 48 3.369 -3.513 6.316
344 HA THR 48 HA THR 48 2.669 -0.826 6.847
345 HB THR 48 HB THR 48 2.775 -2.241 4.178
346 HG1 THR 48 HG1 THR 48 4.774 -2.425 5.191
347 HG21 THR 48 HG21 THR 48 1.637 -0.048 4.113
348 HG22 THR 48 HG22 THR 48 3.174 -0.017 3.252
349 HG23 THR 48 HG23 THR 48 3.051 0.697 4.860
350 H ALA 49 HN ALA 49 0.790 -3.616 6.002
351 HA ALA 49 HA ALA 49 -1.372 -2.458 4.673
352 HB1 ALA 49 HB1 ALA 49 -2.593 -4.473 5.212
353 HB2 ALA 49 HB2 ALA 49 -1.434 -4.871 6.483
354 HB3 ALA 49 HB3 ALA 49 -0.928 -4.878 4.793
355 H ALA 50 HN ALA 50 -0.684 -2.687 8.100
356 HA ALA 50 HA ALA 50 -3.268 -2.233 9.108
357 HB1 ALA 50 HB1 ALA 50 -1.461 -3.133 10.479
358 HB2 ALA 50 HB2 ALA 50 -2.148 -1.682 11.211
359 HB3 ALA 50 HB3 ALA 50 -0.603 -1.596 10.366
360 H ARG 51 HN ARG 51 -0.904 -0.134 7.749
361 HA ARG 51 HA ARG 51 -1.611 2.286 9.031
362 HB2 ARG 51 HB2 ARG 51 -0.271 1.807 6.365
363 HB3 ARG 51 HB1 ARG 51 -0.354 3.352 7.188
364 HG2 ARG 51 HG2 ARG 51 0.997 0.895 8.265
365 HG3 ARG 51 HG1 ARG 51 1.808 2.247 7.472
366 HD2 ARG 51 HD2 ARG 51 1.065 3.757 9.211
367 HD3 ARG 51 HD1 ARG 51 0.157 2.461 9.988
368 HE ARG 51 HE ARG 51 2.867 1.713 9.744
369 HH11 ARG 51 HH11 ARG 51 0.816 3.926 11.527
370 HH12 ARG 51 HH12 ARG 51 1.839 3.936 12.938
371 HH21 ARG 51 HH21 ARG 51 4.191 1.701 11.610
372 HH22 ARG 51 HH22 ARG 51 3.745 2.654 12.989
373 H LEU 52 HN LEU 52 -2.780 0.656 6.160
374 HA LEU 52 HA LEU 52 -4.254 2.966 5.243
375 HB2 LEU 52 HB2 LEU 52 -4.333 0.121 4.248
376 HB3 LEU 52 HB1 LEU 52 -4.981 1.526 3.427
377 HG LEU 52 HG LEU 52 -2.052 1.058 4.001
378 HD11 LEU 52 HD11 LEU 52 -2.859 -0.513 2.354
379 HD12 LEU 52 HD12 LEU 52 -1.873 0.723 1.570
380 HD13 LEU 52 HD13 LEU 52 -3.632 0.789 1.452
381 HD21 LEU 52 HD21 LEU 52 -1.708 2.961 2.492
382 HD22 LEU 52 HD22 LEU 52 -2.612 3.420 3.935
383 HD23 LEU 52 HD23 LEU 52 -3.453 3.197 2.400
384 H GLU 53 HN GLU 53 -4.975 -0.211 6.597
385 HA GLU 53 HA GLU 53 -7.737 -0.148 6.477
386 HB2 GLU 53 HB2 GLU 53 -6.023 -1.420 8.617
387 HB3 GLU 53 HB1 GLU 53 -7.697 -1.822 8.272
388 HG2 GLU 53 HG2 GLU 53 -6.998 -2.516 5.995
389 HG3 GLU 53 HG1 GLU 53 -5.325 -2.261 6.484
390 H SER 54 HN SER 54 -5.671 0.776 9.232
391 HA SER 54 HA SER 54 -7.819 1.551 10.899
392 HB2 SER 54 HB2 SER 54 -6.015 2.587 12.299
393 HB3 SER 54 HB1 SER 54 -5.708 0.901 11.870
394 HG SER 54 HG SER 54 -4.101 1.497 10.578
395 H ARG 55 HN ARG 55 -6.182 3.168 8.352
396 HA ARG 55 HA ARG 55 -6.638 5.833 9.341
397 HB2 ARG 55 HB2 ARG 55 -4.684 5.208 7.915
398 HB3 ARG 55 HB1 ARG 55 -5.796 4.953 6.578
399 HG2 ARG 55 HG2 ARG 55 -6.383 7.270 6.530
400 HG3 ARG 55 HG1 ARG 55 -5.474 7.579 8.011
401 HD2 ARG 55 HD2 ARG 55 -4.365 6.759 5.327
402 HD3 ARG 55 HD1 ARG 55 -4.153 8.311 6.139
403 HE ARG 55 HE ARG 55 -3.202 6.031 7.625
404 HH11 ARG 55 HH11 ARG 55 -2.380 8.519 5.287
405 HH12 ARG 55 HH12 ARG 55 -0.680 8.439 5.641
406 HH21 ARG 55 HH21 ARG 55 -0.978 5.924 8.071
407 HH22 ARG 55 HH22 ARG 55 0.135 6.951 7.216
408 H TYR 56 HN TYR 56 -7.935 3.880 6.651
409 HA TYR 56 HA TYR 56 -9.947 5.950 6.181
410 HB2 TYR 56 HB2 TYR 56 -9.240 3.468 4.605
411 HB3 TYR 56 HB1 TYR 56 -10.482 4.626 4.141
412 HD1 TYR 56 HD2 TYR 56 -9.766 7.039 3.736
413 HD2 TYR 56 HD1 TYR 56 -6.997 3.818 3.987
414 HE1 TYR 56 HE2 TYR 56 -8.082 8.403 2.576
415 HE2 TYR 56 HE1 TYR 56 -5.307 5.176 2.831
416 HH TYR 56 HH TYR 56 -5.658 8.522 2.322
417 H GLY 57 HN GLY 57 -9.678 3.192 8.007
418 HA2 GLY 57 HA2 GLY 57 -11.266 1.987 9.177
419 HA3 GLY 57 HA1 GLY 57 -12.504 3.025 8.474
420 H VAL 58 HN VAL 58 -10.104 0.879 7.022
421 HA VAL 58 HA VAL 58 -12.291 -0.613 5.726
422 HB VAL 58 HB VAL 58 -10.937 -0.870 3.715
423 HG11 VAL 58 HG11 VAL 58 -11.151 2.019 4.542
424 HG12 VAL 58 HG12 VAL 58 -12.421 1.046 3.797
425 HG13 VAL 58 HG13 VAL 58 -10.958 1.435 2.889
426 HG21 VAL 58 HG21 VAL 58 -8.831 0.391 3.421
427 HG22 VAL 58 HG22 VAL 58 -8.714 -0.839 4.679
428 HG23 VAL 58 HG23 VAL 58 -8.897 0.858 5.123
429 H SER 59 HN SER 59 -10.991 -2.643 4.582
430 HA SER 59 HA SER 59 -8.839 -3.615 6.231
431 HB2 SER 59 HB2 SER 59 -10.997 -4.317 7.396
432 HB3 SER 59 HB1 SER 59 -11.319 -5.335 5.987
433 HG SER 59 HG SER 59 -8.814 -5.528 7.223
434 H ILE 60 HN ILE 60 -7.505 -4.892 5.085
435 HA ILE 60 HA ILE 60 -8.183 -5.275 2.268
436 HB ILE 60 HB ILE 60 -5.530 -5.624 3.681
437 HG12 ILE 60 HG12 ILE 60 -6.498 -3.368 1.901
438 HG13 ILE 60 HG11 ILE 60 -6.384 -3.285 3.658
439 HG21 ILE 60 HG21 ILE 60 -5.683 -6.992 1.678
440 HG22 ILE 60 HG22 ILE 60 -4.581 -5.642 1.413
441 HG23 ILE 60 HG23 ILE 60 -6.210 -5.596 0.741
442 HD11 ILE 60 HD11 ILE 60 -4.504 -2.195 2.573
443 HD12 ILE 60 HD12 ILE 60 -4.084 -3.705 1.766
444 HD13 ILE 60 HD13 ILE 60 -3.976 -3.584 3.523
445 HA PRO 61 HA PRO 61 -9.352 -9.511 3.144
446 HB2 PRO 61 HB2 PRO 61 -8.878 -9.688 0.202
447 HB3 PRO 61 HB1 PRO 61 -10.273 -10.212 1.154
448 HG2 PRO 61 HG2 PRO 61 -10.393 -8.008 -0.324
449 HG3 PRO 61 HG1 PRO 61 -11.159 -8.071 1.275
450 HD2 PRO 61 HD2 PRO 61 -8.609 -6.747 0.446
451 HD3 PRO 61 HD1 PRO 61 -9.826 -6.216 1.627
452 H ASP 62 HN ASP 62 -8.093 -11.096 3.786
453 HA ASP 62 HA ASP 62 -5.311 -10.994 3.600
454 HB2 ASP 62 HB2 ASP 62 -5.358 -13.217 4.703
455 HB3 ASP 62 HB1 ASP 62 -6.386 -12.029 5.487
456 H ASP 63 HN ASP 63 -7.643 -12.828 1.712
457 HA ASP 63 HA ASP 63 -5.639 -14.401 0.390
458 HB2 ASP 63 HB2 ASP 63 -7.978 -15.177 0.632
459 HB3 ASP 63 HB1 ASP 63 -8.509 -13.881 -0.433
460 H VAL 64 HN VAL 64 -7.525 -11.529 -0.430
461 HA VAL 64 HA VAL 64 -6.552 -11.358 -3.102
462 HB VAL 64 HB VAL 64 -7.841 -9.180 -1.435
463 HG11 VAL 64 HG11 VAL 64 -7.586 -9.490 -4.425
464 HG12 VAL 64 HG12 VAL 64 -6.727 -8.319 -3.423
465 HG13 VAL 64 HG13 VAL 64 -8.479 -8.219 -3.592
466 HG21 VAL 64 HG21 VAL 64 -9.260 -11.145 -1.516
467 HG22 VAL 64 HG22 VAL 64 -9.086 -11.221 -3.269
468 HG23 VAL 64 HG23 VAL 64 -9.932 -9.864 -2.527
469 H ALA 65 HN ALA 65 -5.376 -10.317 -0.024
470 HA ALA 65 HA ALA 65 -3.623 -8.268 -0.818
471 HB1 ALA 65 HB1 ALA 65 -2.432 -8.721 1.272
472 HB2 ALA 65 HB2 ALA 65 -3.326 -10.231 1.448
473 HB3 ALA 65 HB3 ALA 65 -4.178 -8.690 1.517
474 H GLY 66 HN GLY 66 -3.471 -11.690 -1.203
475 HA2 GLY 66 HA2 GLY 66 -0.629 -11.632 -1.904
476 HA3 GLY 66 HA1 GLY 66 -1.639 -13.065 -1.772
477 H ARG 67 HN ARG 67 -3.482 -10.991 -3.436
478 HA ARG 67 HA ARG 67 -2.669 -12.160 -5.994
479 HB2 ARG 67 HB2 ARG 67 -5.225 -11.097 -4.902
480 HB3 ARG 67 HB1 ARG 67 -4.952 -10.919 -6.627
481 HG2 ARG 67 HG2 ARG 67 -6.183 -12.914 -6.327
482 HG3 ARG 67 HG1 ARG 67 -4.532 -13.384 -6.722
483 HD2 ARG 67 HD2 ARG 67 -5.355 -13.147 -3.863
484 HD3 ARG 67 HD1 ARG 67 -5.828 -14.570 -4.788
485 HE ARG 67 HE ARG 67 -3.035 -14.025 -5.028
486 HH11 ARG 67 HH11 ARG 67 -5.457 -15.402 -2.898
487 HH12 ARG 67 HH12 ARG 67 -4.344 -16.488 -2.126
488 HH21 ARG 67 HH21 ARG 67 -1.562 -15.497 -4.044
489 HH22 ARG 67 HH22 ARG 67 -2.134 -16.557 -2.777
490 H VAL 68 HN VAL 68 -2.380 -9.289 -4.265
491 HA VAL 68 HA VAL 68 -2.233 -7.599 -6.631
492 HB VAL 68 HB VAL 68 -1.758 -5.750 -5.119
493 HG11 VAL 68 HG11 VAL 68 -3.872 -5.729 -3.865
494 HG12 VAL 68 HG12 VAL 68 -4.055 -7.458 -4.164
495 HG13 VAL 68 HG13 VAL 68 -4.084 -6.321 -5.513
496 HG21 VAL 68 HG21 VAL 68 -1.735 -6.063 -2.682
497 HG22 VAL 68 HG22 VAL 68 -0.407 -6.921 -3.464
498 HG23 VAL 68 HG23 VAL 68 -1.827 -7.809 -2.913
499 H ASP 69 HN ASP 69 -0.268 -6.326 -7.038
500 HA ASP 69 HA ASP 69 2.200 -7.585 -6.103
501 HB2 ASP 69 HB2 ASP 69 1.682 -8.843 -8.081
502 HB3 ASP 69 HB1 ASP 69 1.303 -7.379 -8.975
503 H THR 70 HN THR 70 0.783 -5.081 -8.181
504 HA THR 70 HA THR 70 3.049 -3.316 -7.536
505 HB THR 70 HB THR 70 2.166 -1.877 -9.377
506 HG1 THR 70 HG1 THR 70 0.367 -4.078 -9.704
507 HG21 THR 70 HG21 THR 70 2.760 -4.746 -10.100
508 HG22 THR 70 HG22 THR 70 3.947 -3.472 -9.816
509 HG23 THR 70 HG23 THR 70 2.861 -3.374 -11.203
510 HA PRO 71 HA PRO 71 0.752 -0.727 -4.758
511 HB2 PRO 71 HB2 PRO 71 1.904 1.526 -6.334
512 HB3 PRO 71 HB1 PRO 71 1.936 1.243 -4.591
513 HG2 PRO 71 HG2 PRO 71 4.107 0.814 -6.048
514 HG3 PRO 71 HG1 PRO 71 3.664 -0.307 -4.743
515 HD2 PRO 71 HD2 PRO 71 3.345 -0.620 -7.702
516 HD3 PRO 71 HD1 PRO 71 3.801 -1.827 -6.481
517 H ARG 72 HN ARG 72 0.705 0.014 -8.208
518 HA ARG 72 HA ARG 72 -1.507 1.675 -8.372
519 HB2 ARG 72 HB2 ARG 72 -0.017 0.985 -10.262
520 HB3 ARG 72 HB1 ARG 72 -0.845 -0.561 -10.289
521 HG2 ARG 72 HG2 ARG 72 -1.776 0.784 -12.010
522 HG3 ARG 72 HG1 ARG 72 -2.976 0.660 -10.723
523 HD2 ARG 72 HD2 ARG 72 -2.987 2.932 -11.375
524 HD3 ARG 72 HD1 ARG 72 -2.071 2.875 -9.867
525 HE ARG 72 HE ARG 72 -0.230 2.613 -11.926
526 HH11 ARG 72 HH11 ARG 72 -2.540 5.058 -10.873
527 HH12 ARG 72 HH12 ARG 72 -1.590 6.383 -11.486
528 HH21 ARG 72 HH21 ARG 72 1.000 4.361 -12.739
529 HH22 ARG 72 HH22 ARG 72 0.398 5.989 -12.573
530 H GLU 73 HN GLU 73 -1.429 -1.880 -8.511
531 HA GLU 73 HA GLU 73 -4.193 -2.301 -8.740
532 HB2 GLU 73 HB2 GLU 73 -2.091 -4.081 -7.485
533 HB3 GLU 73 HB1 GLU 73 -3.709 -4.596 -7.948
534 HG2 GLU 73 HG2 GLU 73 -3.228 -4.302 -10.250
535 HG3 GLU 73 HG1 GLU 73 -1.714 -3.466 -9.890
536 H LEU 74 HN LEU 74 -2.101 -2.008 -5.928
537 HA LEU 74 HA LEU 74 -3.971 -2.743 -3.959
538 HB2 LEU 74 HB2 LEU 74 -1.407 -2.439 -3.824
539 HB3 LEU 74 HB1 LEU 74 -1.754 -0.748 -3.535
540 HG LEU 74 HG LEU 74 -1.308 -2.135 -1.493
541 HD11 LEU 74 HD11 LEU 74 -3.985 -0.775 -1.645
542 HD12 LEU 74 HD12 LEU 74 -2.434 0.006 -1.337
543 HD13 LEU 74 HD13 LEU 74 -3.093 -1.139 -0.168
544 HD21 LEU 74 HD21 LEU 74 -4.011 -3.297 -2.144
545 HD22 LEU 74 HD22 LEU 74 -3.100 -3.563 -0.657
546 HD23 LEU 74 HD23 LEU 74 -2.472 -4.157 -2.195
547 H LEU 75 HN LEU 75 -3.020 0.445 -5.209
548 HA LEU 75 HA LEU 75 -4.795 1.982 -3.669
549 HB2 LEU 75 HB2 LEU 75 -2.797 2.696 -5.147
550 HB3 LEU 75 HB1 LEU 75 -3.946 2.687 -6.467
551 HG LEU 75 HG LEU 75 -4.390 4.351 -3.992
552 HD11 LEU 75 HD11 LEU 75 -2.981 5.161 -6.533
553 HD12 LEU 75 HD12 LEU 75 -2.223 4.959 -4.953
554 HD13 LEU 75 HD13 LEU 75 -3.420 6.231 -5.202
555 HD21 LEU 75 HD21 LEU 75 -5.815 5.653 -5.474
556 HD22 LEU 75 HD22 LEU 75 -6.326 3.966 -5.456
557 HD23 LEU 75 HD23 LEU 75 -5.408 4.595 -6.824
558 H ASP 76 HN ASP 76 -5.108 0.701 -6.991
559 HA ASP 76 HA ASP 76 -7.663 1.640 -7.562
560 HB2 ASP 76 HB2 ASP 76 -6.157 -0.790 -8.499
561 HB3 ASP 76 HB1 ASP 76 -7.786 -0.458 -9.060
562 H LEU 77 HN LEU 77 -6.677 -1.326 -5.927
563 HA LEU 77 HA LEU 77 -9.174 -2.590 -5.852
564 HB2 LEU 77 HB2 LEU 77 -7.089 -3.758 -5.394
565 HB3 LEU 77 HB1 LEU 77 -6.836 -2.792 -3.954
566 HG LEU 77 HG LEU 77 -8.900 -3.810 -2.984
567 HD11 LEU 77 HD11 LEU 77 -9.984 -4.462 -5.070
568 HD12 LEU 77 HD12 LEU 77 -9.781 -5.845 -3.995
569 HD13 LEU 77 HD13 LEU 77 -8.702 -5.635 -5.373
570 HD21 LEU 77 HD21 LEU 77 -6.676 -4.629 -2.395
571 HD22 LEU 77 HD22 LEU 77 -6.711 -5.730 -3.771
572 HD23 LEU 77 HD23 LEU 77 -7.847 -5.950 -2.441
573 H ILE 78 HN ILE 78 -7.552 -0.645 -3.338
574 HA ILE 78 HA ILE 78 -9.734 -0.871 -1.535
575 HB ILE 78 HB ILE 78 -7.453 1.116 -1.521
576 HG12 ILE 78 HG12 ILE 78 -7.849 -1.559 -0.156
577 HG13 ILE 78 HG11 ILE 78 -6.672 -1.188 -1.410
578 HG21 ILE 78 HG21 ILE 78 -9.376 0.348 0.678
579 HG22 ILE 78 HG22 ILE 78 -9.348 1.891 -0.176
580 HG23 ILE 78 HG23 ILE 78 -7.988 1.425 0.847
581 HD11 ILE 78 HD11 ILE 78 -5.548 0.352 0.130
582 HD12 ILE 78 HD12 ILE 78 -5.604 -1.299 0.746
583 HD13 ILE 78 HD13 ILE 78 -6.707 -0.080 1.387
584 H ASN 79 HN ASN 79 -8.864 1.494 -3.997
585 HA ASN 79 HA ASN 79 -10.847 3.411 -3.265
586 HB2 ASN 79 HB2 ASN 79 -9.261 2.919 -5.769
587 HB3 ASN 79 HB1 ASN 79 -10.615 4.040 -5.796
588 HD21 ASN 79 HD21 ASN 79 -8.408 3.530 -3.087
589 HD22 ASN 79 HD22 ASN 79 -7.712 5.113 -3.137
590 H GLY 80 HN GLY 80 -10.785 0.704 -5.554
591 HA2 GLY 80 HA2 GLY 80 -13.360 1.109 -6.625
592 HA3 GLY 80 HA1 GLY 80 -12.466 -0.403 -6.646
593 H ALA 81 HN ALA 81 -12.260 -0.609 -3.767
594 HA ALA 81 HA ALA 81 -14.711 -1.930 -3.222
595 HB1 ALA 81 HB1 ALA 81 -12.514 -1.170 -1.295
596 HB2 ALA 81 HB2 ALA 81 -12.548 -2.641 -2.268
597 HB3 ALA 81 HB3 ALA 81 -13.771 -2.377 -1.024
598 H LEU 82 HN LEU 82 -13.331 1.171 -2.247
599 HA LEU 82 HA LEU 82 -15.451 1.829 -0.451
600 HB2 LEU 82 HB2 LEU 82 -13.295 3.490 -1.744
601 HB3 LEU 82 HB1 LEU 82 -14.443 4.137 -0.590
602 HG LEU 82 HG LEU 82 -12.463 1.931 -0.024
603 HD11 LEU 82 HD11 LEU 82 -11.401 4.123 -0.327
604 HD12 LEU 82 HD12 LEU 82 -11.320 3.577 1.347
605 HD13 LEU 82 HD13 LEU 82 -12.491 4.810 0.878
606 HD21 LEU 82 HD21 LEU 82 -14.419 3.370 1.759
607 HD22 LEU 82 HD22 LEU 82 -13.152 2.284 2.324
608 HD23 LEU 82 HD23 LEU 82 -14.457 1.665 1.311
609 H ALA 83 HN ALA 83 -14.759 2.520 -3.825
610 HA ALA 83 HA ALA 83 -16.755 4.487 -4.210
611 HB1 ALA 83 HB1 ALA 83 -15.512 2.659 -6.255
612 HB2 ALA 83 HB2 ALA 83 -14.824 4.182 -5.695
613 HB3 ALA 83 HB3 ALA 83 -16.352 4.177 -6.575
614 H GLU 84 HN GLU 84 -17.102 1.248 -3.567
615 HA GLU 84 HA GLU 84 -19.400 0.800 -5.280
616 HB2 GLU 84 HB2 GLU 84 -17.715 -0.973 -4.852
617 HB3 GLU 84 HB1 GLU 84 -18.178 -0.974 -3.160
618 HG2 GLU 84 HG2 GLU 84 -20.367 -1.781 -3.695
619 HG3 GLU 84 HG1 GLU 84 -20.048 -1.613 -5.422
620 H ALA 85 HN ALA 85 -18.803 2.222 -2.330
621 HA ALA 85 HA ALA 85 -21.551 1.700 -1.406
622 HB1 ALA 85 HB1 ALA 85 -20.771 2.093 0.878
623 HB2 ALA 85 HB2 ALA 85 -19.128 2.326 0.281
624 HB3 ALA 85 HB3 ALA 85 -19.908 0.751 0.129
625 H ALA 86 HN ALA 86 -22.528 3.477 -0.194
626 HA ALA 86 HA ALA 86 -23.315 5.597 -0.075
627 HB1 ALA 86 HB1 ALA 86 -21.692 7.384 0.273
628 HB2 ALA 86 HB2 ALA 86 -20.398 6.328 -0.298
629 HB3 ALA 86 HB3 ALA 86 -21.259 5.945 1.193
630 H28 SXO 87 H28B SXO 87 6.708 -12.304 5.920
631 H28A SXO 87 H28A SXO 87 7.674 -13.596 6.633
632 H30 SXO 87 H30A SXO 87 4.348 -13.353 8.366
633 H30A SXO 87 H30C SXO 87 6.078 -13.137 8.612
634 H30B SXO 87 H30B SXO 87 5.190 -12.022 7.575
635 H31 SXO 87 H31A SXO 87 4.616 -14.488 4.853
636 H31A SXO 87 H31B SXO 87 4.165 -12.891 5.448
637 H31B SXO 87 H31C SXO 87 3.504 -14.336 6.215
638 H32 SXO 87 H32A SXO 87 6.417 -15.385 8.071
639 HO33 SXO 87 H33A SXO 87 6.089 -17.021 6.077
640 HN36 SXO 87 H36A SXO 87 3.998 -14.772 8.824
641 H37 SXO 87 H37A SXO 87 2.482 -17.251 8.757
642 H37A SXO 87 H37B SXO 87 2.232 -15.881 9.840
643 H38 SXO 87 H38B SXO 87 0.348 -16.069 8.348
644 H38A SXO 87 H38A SXO 87 1.419 -16.072 6.946
645 HN41 SXO 87 H41A SXO 87 0.230 -14.361 6.129
646 H42 SXO 87 H42A SXO 87 -0.422 -11.915 7.085
647 H42A SXO 87 H42B SXO 87 1.301 -11.769 6.746
648 H43 SXO 87 H43B SXO 87 0.798 -12.623 4.424
649 H43A SXO 87 H43A SXO 87 -0.915 -12.397 4.806
650 H2 SXO 87 H2A SXO 87 0.051 -9.540 1.053
651 H2A SXO 87 H2B SXO 87 1.406 -9.265 2.143
652 H3 SXO 87 H3B SXO 87 -1.356 -8.148 2.603
653 H3A SXO 87 H3A SXO 87 0.126 -7.741 3.473
654 H4 SXO 87 H4A SXO 87 -0.477 -7.180 0.567
655 H4A SXO 87 H4B SXO 87 1.065 -6.849 1.355
656 H5 SXO 87 H5B SXO 87 -1.574 -5.665 2.201
657 H5A SXO 87 H5A SXO 87 0.019 -5.260 2.840
658 H6 SXO 87 H6A SXO 87 -0.972 -4.785 0.030
659 H6A SXO 87 H6B SXO 87 0.678 -4.489 0.572
660 H7 SXO 87 H7A SXO 87 -1.747 -3.185 1.805
661 H7A SXO 87 H7B SXO 87 -0.772 -2.447 0.523
662 H8 SXO 87 H8C SXO 87 0.222 -3.302 3.240
663 H8A SXO 87 H8A SXO 87 -0.097 -1.643 2.731
664 H8B SXO 87 H8B SXO 87 1.198 -2.566 1.969
Start of MODEL 10
1 H1 MET 1 HT1 MET 1 -18.539 13.563 -1.988
2 H2 MET 1 HT2 MET 1 -18.143 14.521 -3.330
3 H3 MET 1 HT3 MET 1 -17.978 15.151 -1.764
4 HA MET 1 HA MET 1 -16.394 12.970 -2.986
5 HB2 MET 1 HB2 MET 1 -15.643 15.731 -2.000
6 HB3 MET 1 HB1 MET 1 -14.496 14.521 -2.552
7 HG2 MET 1 HG2 MET 1 -15.447 14.590 -4.779
8 HG3 MET 1 HG1 MET 1 -16.672 15.736 -4.237
9 HE1 MET 1 HE1 MET 1 -14.408 17.937 -6.546
10 HE2 MET 1 HE2 MET 1 -16.035 17.331 -6.243
11 HE3 MET 1 HE3 MET 1 -14.770 16.228 -6.785
12 H ALA 2 HN ALA 2 -14.865 11.972 -1.614
13 HA ALA 2 HA ALA 2 -15.304 12.350 1.268
14 HB1 ALA 2 HB1 ALA 2 -16.819 10.569 0.573
15 HB2 ALA 2 HB2 ALA 2 -15.527 9.926 1.586
16 HB3 ALA 2 HB3 ALA 2 -15.476 9.693 -0.162
17 H THR 3 HN THR 3 -13.672 11.137 2.563
18 HA THR 3 HA THR 3 -11.053 11.534 1.498
19 HB THR 3 HB THR 3 -11.494 11.906 3.873
20 HG1 THR 3 HG1 THR 3 -9.385 11.387 3.464
21 HG21 THR 3 HG21 THR 3 -11.893 10.061 5.414
22 HG22 THR 3 HG22 THR 3 -11.935 8.923 4.067
23 HG23 THR 3 HG23 THR 3 -13.185 10.159 4.217
24 H LEU 4 HN LEU 4 -9.718 10.105 0.555
25 HA LEU 4 HA LEU 4 -10.394 7.261 0.502
26 HB2 LEU 4 HB2 LEU 4 -10.109 8.981 -1.969
27 HB3 LEU 4 HB1 LEU 4 -10.239 7.235 -1.971
28 HG LEU 4 HG LEU 4 -12.404 9.087 -0.969
29 HD11 LEU 4 HD11 LEU 4 -12.130 7.684 -3.624
30 HD12 LEU 4 HD12 LEU 4 -12.087 9.426 -3.345
31 HD13 LEU 4 HD13 LEU 4 -13.573 8.523 -3.053
32 HD21 LEU 4 HD21 LEU 4 -13.814 7.111 -1.058
33 HD22 LEU 4 HD22 LEU 4 -12.436 6.835 0.008
34 HD23 LEU 4 HD23 LEU 4 -12.449 6.141 -1.613
35 H LEU 5 HN LEU 5 -8.633 6.258 -1.190
36 HA LEU 5 HA LEU 5 -6.117 6.881 0.122
37 HB2 LEU 5 HB2 LEU 5 -7.160 4.548 -0.458
38 HB3 LEU 5 HB1 LEU 5 -6.480 4.828 -2.046
39 HG LEU 5 HG LEU 5 -4.830 4.835 0.479
40 HD11 LEU 5 HD11 LEU 5 -4.157 2.563 -0.140
41 HD12 LEU 5 HD12 LEU 5 -5.341 2.574 -1.446
42 HD13 LEU 5 HD13 LEU 5 -5.879 2.661 0.230
43 HD21 LEU 5 HD21 LEU 5 -2.966 4.497 -1.045
44 HD22 LEU 5 HD22 LEU 5 -3.833 5.985 -1.431
45 HD23 LEU 5 HD23 LEU 5 -4.068 4.543 -2.421
46 H THR 6 HN THR 6 -4.650 8.257 -0.736
47 HA THR 6 HA THR 6 -4.799 8.800 -3.624
48 HB THR 6 HB THR 6 -3.792 10.962 -3.228
49 HG1 THR 6 HG1 THR 6 -3.881 10.783 -0.438
50 HG21 THR 6 HG21 THR 6 -6.013 10.479 -1.234
51 HG22 THR 6 HG22 THR 6 -6.219 10.850 -2.946
52 HG23 THR 6 HG23 THR 6 -5.514 12.048 -1.863
53 H THR 7 HN THR 7 -2.667 9.337 -4.636
54 HA THR 7 HA THR 7 -0.741 7.368 -4.269
55 HB THR 7 HB THR 7 -0.064 10.092 -5.364
56 HG1 THR 7 HG1 THR 7 -1.384 8.021 -6.816
57 HG21 THR 7 HG21 THR 7 1.749 8.480 -5.254
58 HG22 THR 7 HG22 THR 7 1.283 8.739 -6.935
59 HG23 THR 7 HG23 THR 7 0.764 7.281 -6.089
60 H ASP 8 HN ASP 8 -0.937 10.633 -2.925
61 HA ASP 8 HA ASP 8 1.618 10.576 -1.674
62 HB2 ASP 8 HB2 ASP 8 -0.802 12.319 -1.188
63 HB3 ASP 8 HB1 ASP 8 0.753 12.553 -0.393
64 H ASP 9 HN ASP 9 -1.677 9.871 -0.559
65 HA ASP 9 HA ASP 9 -1.046 9.390 2.143
66 HB2 ASP 9 HB2 ASP 9 -3.252 8.460 0.343
67 HB3 ASP 9 HB1 ASP 9 -3.077 7.743 1.938
68 H LEU 10 HN LEU 10 -1.092 7.260 -0.671
69 HA LEU 10 HA LEU 10 -0.387 4.890 0.670
70 HB2 LEU 10 HB2 LEU 10 -1.278 5.008 -1.646
71 HB3 LEU 10 HB1 LEU 10 0.249 5.685 -2.171
72 HG LEU 10 HG LEU 10 1.394 3.596 -1.513
73 HD11 LEU 10 HD11 LEU 10 -1.395 2.614 -0.925
74 HD12 LEU 10 HD12 LEU 10 -0.106 2.873 0.252
75 HD13 LEU 10 HD13 LEU 10 0.058 1.613 -0.973
76 HD21 LEU 10 HD21 LEU 10 0.638 3.897 -3.809
77 HD22 LEU 10 HD22 LEU 10 -0.935 3.216 -3.391
78 HD23 LEU 10 HD23 LEU 10 0.510 2.209 -3.319
79 H ARG 11 HN ARG 11 1.566 7.343 -0.982
80 HA ARG 11 HA ARG 11 4.092 6.263 -0.611
81 HB2 ARG 11 HB2 ARG 11 3.688 8.240 -1.991
82 HB3 ARG 11 HB1 ARG 11 3.274 9.177 -0.561
83 HG2 ARG 11 HG2 ARG 11 5.623 8.682 0.265
84 HG3 ARG 11 HG1 ARG 11 5.958 8.103 -1.367
85 HD2 ARG 11 HD2 ARG 11 4.950 10.859 -0.671
86 HD3 ARG 11 HD1 ARG 11 6.624 10.449 -1.040
87 HE ARG 11 HE ARG 11 5.456 9.602 -3.250
88 HH11 ARG 11 HH11 ARG 11 4.846 12.539 -1.449
89 HH12 ARG 11 HH12 ARG 11 4.397 13.454 -2.854
90 HH21 ARG 11 HH21 ARG 11 4.898 10.829 -5.118
91 HH22 ARG 11 HH22 ARG 11 4.446 12.500 -4.928
92 H ARG 12 HN ARG 12 2.345 8.514 1.542
93 HA ARG 12 HA ARG 12 4.426 8.632 3.460
94 HB2 ARG 12 HB2 ARG 12 2.894 9.847 4.852
95 HB3 ARG 12 HB1 ARG 12 2.665 10.372 3.189
96 HG2 ARG 12 HG2 ARG 12 0.678 9.009 2.993
97 HG3 ARG 12 HG1 ARG 12 0.943 8.366 4.612
98 HD2 ARG 12 HD2 ARG 12 0.386 11.249 3.927
99 HD3 ARG 12 HD1 ARG 12 -0.770 10.107 4.612
100 HE ARG 12 HE ARG 12 1.488 10.194 6.275
101 HH11 ARG 12 HH11 ARG 12 -1.249 12.197 5.331
102 HH12 ARG 12 HH12 ARG 12 -1.213 13.131 6.796
103 HH21 ARG 12 HH21 ARG 12 1.548 11.420 8.168
104 HH22 ARG 12 HH22 ARG 12 0.396 12.709 8.416
105 H ALA 13 HN ALA 13 1.747 6.471 2.981
106 HA ALA 13 HA ALA 13 1.564 5.412 5.578
107 HB1 ALA 13 HB1 ALA 13 0.404 3.535 4.549
108 HB2 ALA 13 HB2 ALA 13 0.971 4.045 2.959
109 HB3 ALA 13 HB3 ALA 13 -0.149 5.065 3.863
110 H LEU 14 HN LEU 14 3.434 4.357 2.750
111 HA LEU 14 HA LEU 14 4.633 2.120 3.964
112 HB2 LEU 14 HB2 LEU 14 5.293 3.829 1.599
113 HB3 LEU 14 HB1 LEU 14 6.500 2.702 2.183
114 HG LEU 14 HG LEU 14 5.248 1.727 0.341
115 HD11 LEU 14 HD11 LEU 14 4.543 -0.353 1.392
116 HD12 LEU 14 HD12 LEU 14 4.544 0.436 2.969
117 HD13 LEU 14 HD13 LEU 14 6.055 0.235 2.082
118 HD21 LEU 14 HD21 LEU 14 2.814 2.147 2.067
119 HD22 LEU 14 HD22 LEU 14 2.856 1.203 0.579
120 HD23 LEU 14 HD23 LEU 14 3.169 2.938 0.530
121 H VAL 15 HN VAL 15 5.636 5.487 3.747
122 HA VAL 15 HA VAL 15 8.197 5.177 4.896
123 HB VAL 15 HB VAL 15 6.429 7.633 4.824
124 HG11 VAL 15 HG11 VAL 15 8.229 7.809 6.472
125 HG12 VAL 15 HG12 VAL 15 8.480 8.906 5.115
126 HG13 VAL 15 HG13 VAL 15 9.411 7.412 5.225
127 HG21 VAL 15 HG21 VAL 15 7.738 8.261 2.842
128 HG22 VAL 15 HG22 VAL 15 6.844 6.762 2.591
129 HG23 VAL 15 HG23 VAL 15 8.578 6.710 2.911
130 H GLU 16 HN GLU 16 5.140 6.381 6.305
131 HA GLU 16 HA GLU 16 6.345 6.713 8.881
132 HB2 GLU 16 HB2 GLU 16 3.463 6.912 8.013
133 HB3 GLU 16 HB1 GLU 16 4.086 7.419 9.576
134 HG2 GLU 16 HG2 GLU 16 5.462 9.102 8.531
135 HG3 GLU 16 HG1 GLU 16 4.966 8.556 6.931
136 H SER 17 HN SER 17 5.029 4.034 7.297
137 HA SER 17 HA SER 17 4.114 2.673 9.672
138 HB2 SER 17 HB2 SER 17 3.176 2.101 7.462
139 HB3 SER 17 HB1 SER 17 4.769 1.583 6.918
140 HG SER 17 HG SER 17 4.177 -0.290 7.650
141 H ALA 18 HN ALA 18 7.017 2.729 7.672
142 HA ALA 18 HA ALA 18 8.307 0.706 9.298
143 HB1 ALA 18 HB1 ALA 18 10.181 0.951 7.745
144 HB2 ALA 18 HB2 ALA 18 9.375 2.319 6.977
145 HB3 ALA 18 HB3 ALA 18 8.663 0.708 6.884
146 H GLY 19 HN GLY 19 8.725 4.159 8.583
147 HA2 GLY 19 HA2 GLY 19 9.338 5.760 10.225
148 HA3 GLY 19 HA1 GLY 19 10.009 4.461 11.201
149 H GLU 20 HN GLU 20 10.513 6.370 8.279
150 HA GLU 20 HA GLU 20 13.090 5.469 7.662
151 HB2 GLU 20 HB2 GLU 20 11.856 6.773 6.058
152 HB3 GLU 20 HB1 GLU 20 11.788 8.145 7.160
153 HG2 GLU 20 HG2 GLU 20 14.264 8.288 7.038
154 HG3 GLU 20 HG1 GLU 20 14.231 7.025 5.807
155 H THR 21 HN THR 21 14.916 5.631 8.769
156 HA THR 21 HA THR 21 15.405 8.104 10.278
157 HB THR 21 HB THR 21 16.475 5.450 11.222
158 HG1 THR 21 HG1 THR 21 13.889 6.173 11.197
159 HG21 THR 21 HG21 THR 21 16.502 6.641 13.392
160 HG22 THR 21 HG22 THR 21 15.910 8.091 12.579
161 HG23 THR 21 HG23 THR 21 17.496 7.434 12.171
162 H ASP 22 HN ASP 22 16.114 7.266 7.577
163 HA ASP 22 HA ASP 22 19.020 7.519 7.760
164 HB2 ASP 22 HB2 ASP 22 17.617 5.401 6.109
165 HB3 ASP 22 HB1 ASP 22 19.324 5.803 5.972
166 H GLY 23 HN GLY 23 16.896 6.780 5.024
167 HA2 GLY 23 HA2 GLY 23 16.336 9.200 3.942
168 HA3 GLY 23 HA1 GLY 23 18.020 8.947 3.489
169 H THR 24 HN THR 24 14.736 7.866 3.098
170 HA THR 24 HA THR 24 15.582 5.793 1.182
171 HB THR 24 HB THR 24 12.872 6.164 2.469
172 HG1 THR 24 HG1 THR 24 14.689 5.710 3.933
173 HG21 THR 24 HG21 THR 24 12.821 4.832 0.422
174 HG22 THR 24 HG22 THR 24 12.540 3.806 1.832
175 HG23 THR 24 HG23 THR 24 14.117 3.808 1.040
176 H ASP 25 HN ASP 25 15.716 6.757 -0.796
177 HA ASP 25 HA ASP 25 13.930 8.768 -1.714
178 HB2 ASP 25 HB2 ASP 25 15.858 6.959 -3.178
179 HB3 ASP 25 HB1 ASP 25 14.863 8.152 -4.006
180 H LEU 26 HN LEU 26 11.894 7.816 -1.160
181 HA LEU 26 HA LEU 26 10.984 5.654 -2.919
182 HB2 LEU 26 HB2 LEU 26 10.525 5.656 -0.438
183 HB3 LEU 26 HB1 LEU 26 9.491 7.049 -0.691
184 HG LEU 26 HG LEU 26 8.064 5.669 -2.181
185 HD11 LEU 26 HD11 LEU 26 9.841 3.422 -1.233
186 HD12 LEU 26 HD12 LEU 26 9.733 4.041 -2.880
187 HD13 LEU 26 HD13 LEU 26 8.346 3.234 -2.149
188 HD21 LEU 26 HD21 LEU 26 7.031 4.367 -0.394
189 HD22 LEU 26 HD22 LEU 26 7.485 5.977 0.164
190 HD23 LEU 26 HD23 LEU 26 8.472 4.582 0.600
191 H SER 27 HN SER 27 11.485 8.737 -3.263
192 HA SER 27 HA SER 27 8.931 9.548 -4.384
193 HB2 SER 27 HB2 SER 27 10.673 11.594 -4.906
194 HB3 SER 27 HB1 SER 27 9.726 11.437 -3.423
195 HG SER 27 HG SER 27 12.448 10.992 -3.867
196 H GLY 28 HN GLY 28 11.397 7.701 -5.451
197 HA2 GLY 28 HA2 GLY 28 11.551 8.837 -8.145
198 HA3 GLY 28 HA1 GLY 28 12.515 7.507 -7.521
199 H ASP 29 HN ASP 29 9.027 7.948 -7.461
200 HA ASP 29 HA ASP 29 7.281 6.777 -8.285
201 HB2 ASP 29 HB2 ASP 29 8.260 6.986 -10.512
202 HB3 ASP 29 HB1 ASP 29 9.298 5.596 -10.212
203 H PHE 30 HN PHE 30 6.321 4.637 -8.274
204 HA PHE 30 HA PHE 30 7.734 2.427 -7.176
205 HB2 PHE 30 HB2 PHE 30 6.541 2.440 -4.950
206 HB3 PHE 30 HB1 PHE 30 7.785 3.669 -5.131
207 HD1 PHE 30 HD2 PHE 30 7.204 6.018 -5.277
208 HD2 PHE 30 HD1 PHE 30 4.197 3.045 -4.801
209 HE1 PHE 30 HE2 PHE 30 5.586 7.763 -4.654
210 HE2 PHE 30 HE1 PHE 30 2.573 4.790 -4.186
211 HZ PHE 30 HZ PHE 30 3.265 7.146 -4.108
212 H LEU 31 HN LEU 31 4.819 4.031 -8.099
213 HA LEU 31 HA LEU 31 2.891 2.169 -7.384
214 HB2 LEU 31 HB2 LEU 31 2.948 4.104 -9.689
215 HB3 LEU 31 HB1 LEU 31 1.536 3.168 -9.244
216 HG LEU 31 HG LEU 31 2.919 5.136 -7.419
217 HD11 LEU 31 HD11 LEU 31 1.885 6.267 -9.316
218 HD12 LEU 31 HD12 LEU 31 1.000 6.580 -7.821
219 HD13 LEU 31 HD13 LEU 31 0.368 5.423 -8.996
220 HD21 LEU 31 HD21 LEU 31 0.290 3.680 -7.160
221 HD22 LEU 31 HD22 LEU 31 0.910 4.901 -6.047
222 HD23 LEU 31 HD23 LEU 31 1.751 3.362 -6.225
223 H ASP 32 HN ASP 32 4.914 2.238 -10.288
224 HA ASP 32 HA ASP 32 3.460 -0.053 -11.378
225 HB2 ASP 32 HB2 ASP 32 4.097 1.916 -12.807
226 HB3 ASP 32 HB1 ASP 32 5.781 1.454 -12.601
227 H LEU 33 HN LEU 33 6.183 0.576 -9.496
228 HA LEU 33 HA LEU 33 7.681 -1.755 -10.353
229 HB2 LEU 33 HB2 LEU 33 8.163 0.195 -8.096
230 HB3 LEU 33 HB1 LEU 33 9.255 -1.099 -8.552
231 HG LEU 33 HG LEU 33 8.492 1.220 -10.330
232 HD11 LEU 33 HD11 LEU 33 11.020 0.710 -8.767
233 HD12 LEU 33 HD12 LEU 33 9.817 1.954 -8.424
234 HD13 LEU 33 HD13 LEU 33 10.761 2.028 -9.913
235 HD21 LEU 33 HD21 LEU 33 10.594 -0.921 -10.675
236 HD22 LEU 33 HD22 LEU 33 10.278 0.420 -11.774
237 HD23 LEU 33 HD23 LEU 33 9.064 -0.838 -11.549
238 H ARG 34 HN ARG 34 8.027 -3.597 -9.082
239 HA ARG 34 HA ARG 34 5.767 -4.389 -7.530
240 HB2 ARG 34 HB2 ARG 34 8.423 -5.820 -7.694
241 HB3 ARG 34 HB1 ARG 34 6.853 -6.514 -7.307
242 HG2 ARG 34 HG2 ARG 34 6.094 -6.029 -9.587
243 HG3 ARG 34 HG1 ARG 34 7.692 -5.382 -9.967
244 HD2 ARG 34 HD2 ARG 34 7.713 -7.577 -10.779
245 HD3 ARG 34 HD1 ARG 34 8.599 -7.650 -9.259
246 HE ARG 34 HE ARG 34 5.743 -8.302 -9.240
247 HH11 ARG 34 HH11 ARG 34 9.072 -9.402 -9.118
248 HH12 ARG 34 HH12 ARG 34 8.667 -10.945 -8.429
249 HH21 ARG 34 HH21 ARG 34 5.216 -10.344 -8.360
250 HH22 ARG 34 HH22 ARG 34 6.478 -11.493 -8.012
251 H PHE 35 HN PHE 35 5.650 -4.883 -5.315
252 HA PHE 35 HA PHE 35 6.935 -3.214 -3.497
253 HB2 PHE 35 HB2 PHE 35 5.672 -5.922 -3.049
254 HB3 PHE 35 HB1 PHE 35 6.195 -4.857 -1.744
255 HD1 PHE 35 HD2 PHE 35 5.218 -2.395 -1.908
256 HD2 PHE 35 HD1 PHE 35 3.477 -5.852 -3.687
257 HE1 PHE 35 HE2 PHE 35 3.034 -1.268 -1.953
258 HE2 PHE 35 HE1 PHE 35 1.285 -4.724 -3.734
259 HZ PHE 35 HZ PHE 35 1.061 -2.434 -2.864
260 H GLU 36 HN GLU 36 7.791 -6.418 -4.623
261 HA GLU 36 HA GLU 36 9.864 -7.087 -2.907
262 HB2 GLU 36 HB2 GLU 36 9.951 -7.634 -5.870
263 HB3 GLU 36 HB1 GLU 36 10.578 -8.625 -4.564
264 HG2 GLU 36 HG2 GLU 36 7.659 -8.135 -5.112
265 HG3 GLU 36 HG1 GLU 36 8.564 -9.556 -5.622
266 H ASP 37 HN ASP 37 9.796 -4.759 -5.498
267 HA ASP 37 HA ASP 37 12.703 -4.674 -5.695
268 HB2 ASP 37 HB2 ASP 37 10.533 -3.350 -7.324
269 HB3 ASP 37 HB1 ASP 37 12.249 -3.040 -7.563
270 H ILE 38 HN ILE 38 10.119 -2.853 -4.266
271 HA ILE 38 HA ILE 38 11.736 -0.448 -4.132
272 HB ILE 38 HB ILE 38 9.800 0.540 -2.891
273 HG12 ILE 38 HG12 ILE 38 8.434 -2.057 -3.648
274 HG13 ILE 38 HG11 ILE 38 8.878 -1.588 -2.009
275 HG21 ILE 38 HG21 ILE 38 8.361 0.682 -4.891
276 HG22 ILE 38 HG22 ILE 38 9.276 -0.638 -5.618
277 HG23 ILE 38 HG23 ILE 38 10.071 0.895 -5.261
278 HD11 ILE 38 HD11 ILE 38 7.348 0.293 -2.119
279 HD12 ILE 38 HD12 ILE 38 6.514 -1.221 -2.464
280 HD13 ILE 38 HD13 ILE 38 6.934 -0.127 -3.781
281 H GLY 39 HN GLY 39 12.360 -3.017 -2.652
282 HA2 GLY 39 HA2 GLY 39 13.737 -3.330 -0.833
283 HA3 GLY 39 HA1 GLY 39 13.522 -1.636 -0.439
284 H TYR 40 HN TYR 40 10.610 -3.448 -0.757
285 HA TYR 40 HA TYR 40 10.393 -3.459 2.170
286 HB2 TYR 40 HB2 TYR 40 8.330 -3.126 0.006
287 HB3 TYR 40 HB1 TYR 40 7.868 -3.606 1.637
288 HD1 TYR 40 HD2 TYR 40 8.282 -2.082 3.532
289 HD2 TYR 40 HD1 TYR 40 8.961 -0.877 -0.486
290 HE1 TYR 40 HE2 TYR 40 8.305 0.267 4.250
291 HE2 TYR 40 HE1 TYR 40 8.994 1.479 0.213
292 HH TYR 40 HH TYR 40 9.239 2.426 3.448
293 H ASP 41 HN ASP 41 10.649 -5.338 3.077
294 HA ASP 41 HA ASP 41 10.438 -7.815 1.658
295 HB2 ASP 41 HB2 ASP 41 10.686 -7.270 4.629
296 HB3 ASP 41 HB1 ASP 41 10.846 -8.854 3.877
297 H SER 42 HN SER 42 9.028 -9.583 2.350
298 HA SER 42 HA SER 42 6.349 -9.046 2.177
299 HB2 SER 42 HB2 SER 42 6.473 -11.413 3.638
300 HB3 SER 42 HB1 SER 42 6.493 -11.267 1.880
301 H LEU 43 HN LEU 43 8.233 -9.575 5.143
302 HA LEU 43 HA LEU 43 6.178 -9.380 7.000
303 HB2 LEU 43 HB2 LEU 43 8.462 -10.067 7.549
304 HB3 LEU 43 HB1 LEU 43 9.043 -8.447 7.225
305 HG LEU 43 HG LEU 43 7.682 -7.612 9.132
306 HD11 LEU 43 HD11 LEU 43 7.157 -10.543 9.590
307 HD12 LEU 43 HD12 LEU 43 5.967 -9.309 9.176
308 HD13 LEU 43 HD13 LEU 43 6.793 -9.249 10.733
309 HD21 LEU 43 HD21 LEU 43 9.627 -9.821 9.799
310 HD22 LEU 43 HD22 LEU 43 9.123 -8.523 10.881
311 HD23 LEU 43 HD23 LEU 43 10.041 -8.148 9.424
312 H ALA 44 HN ALA 44 8.340 -6.759 5.911
313 HA ALA 44 HA ALA 44 7.034 -4.709 7.329
314 HB1 ALA 44 HB1 ALA 44 8.303 -3.175 5.909
315 HB2 ALA 44 HB2 ALA 44 8.726 -4.514 4.843
316 HB3 ALA 44 HB3 ALA 44 9.315 -4.491 6.506
317 H LEU 45 HN LEU 45 6.421 -6.165 4.227
318 HA LEU 45 HA LEU 45 4.753 -4.179 3.130
319 HB2 LEU 45 HB2 LEU 45 5.714 -5.947 1.780
320 HB3 LEU 45 HB1 LEU 45 4.837 -7.165 2.685
321 HG LEU 45 HG LEU 45 2.722 -6.330 1.790
322 HD11 LEU 45 HD11 LEU 45 2.681 -4.639 0.041
323 HD12 LEU 45 HD12 LEU 45 4.423 -4.406 0.207
324 HD13 LEU 45 HD13 LEU 45 3.344 -3.973 1.536
325 HD21 LEU 45 HD21 LEU 45 3.053 -7.007 -0.542
326 HD22 LEU 45 HD22 LEU 45 3.890 -8.081 0.580
327 HD23 LEU 45 HD23 LEU 45 4.799 -6.871 -0.325
328 H MET 46 HN MET 46 3.950 -7.149 4.976
329 HA MET 46 HA MET 46 1.160 -6.544 4.938
330 HB2 MET 46 HB2 MET 46 0.827 -8.444 6.333
331 HB3 MET 46 HB1 MET 46 2.064 -8.859 5.159
332 HG2 MET 46 HG2 MET 46 3.782 -8.715 6.780
333 HG3 MET 46 HG1 MET 46 2.705 -7.958 7.950
334 HE1 MET 46 HE1 MET 46 3.348 -11.367 9.684
335 HE2 MET 46 HE2 MET 46 3.332 -9.613 9.859
336 HE3 MET 46 HE3 MET 46 4.508 -10.383 8.793
337 H GLU 47 HN GLU 47 3.787 -5.704 7.035
338 HA GLU 47 HA GLU 47 2.338 -4.899 9.317
339 HB2 GLU 47 HB2 GLU 47 4.914 -3.813 8.141
340 HB3 GLU 47 HB1 GLU 47 4.290 -3.369 9.722
341 HG2 GLU 47 HG2 GLU 47 4.906 -6.210 8.967
342 HG3 GLU 47 HG1 GLU 47 6.108 -5.119 9.656
343 H THR 48 HN THR 48 3.304 -3.188 6.389
344 HA THR 48 HA THR 48 2.234 -0.682 7.033
345 HB THR 48 HB THR 48 2.630 -1.864 4.282
346 HG1 THR 48 HG1 THR 48 4.616 -1.938 5.220
347 HG21 THR 48 HG21 THR 48 1.312 0.179 4.234
348 HG22 THR 48 HG22 THR 48 2.929 0.489 3.601
349 HG23 THR 48 HG23 THR 48 2.506 1.001 5.237
350 H ALA 49 HN ALA 49 0.758 -3.564 5.758
351 HA ALA 49 HA ALA 49 -1.530 -2.514 4.554
352 HB1 ALA 49 HB1 ALA 49 -2.517 -4.708 4.879
353 HB2 ALA 49 HB2 ALA 49 -1.279 -5.108 6.070
354 HB3 ALA 49 HB3 ALA 49 -0.832 -4.861 4.381
355 H ALA 50 HN ALA 50 -0.873 -3.296 7.923
356 HA ALA 50 HA ALA 50 -3.496 -3.055 8.903
357 HB1 ALA 50 HB1 ALA 50 -0.894 -2.615 10.360
358 HB2 ALA 50 HB2 ALA 50 -1.697 -4.169 10.137
359 HB3 ALA 50 HB3 ALA 50 -2.465 -2.909 11.105
360 H ARG 51 HN ARG 51 -1.047 -0.742 8.125
361 HA ARG 51 HA ARG 51 -2.083 1.401 9.699
362 HB2 ARG 51 HB2 ARG 51 -0.313 1.615 7.261
363 HB3 ARG 51 HB1 ARG 51 -0.498 2.787 8.551
364 HG2 ARG 51 HG2 ARG 51 0.767 0.072 8.774
365 HG3 ARG 51 HG1 ARG 51 1.596 1.627 8.790
366 HD2 ARG 51 HD2 ARG 51 -0.417 0.715 10.840
367 HD3 ARG 51 HD1 ARG 51 1.332 0.634 11.038
368 HE ARG 51 HE ARG 51 -0.106 3.189 10.673
369 HH11 ARG 51 HH11 ARG 51 2.308 1.219 12.267
370 HH12 ARG 51 HH12 ARG 51 2.792 2.472 13.368
371 HH21 ARG 51 HH21 ARG 51 0.534 4.850 12.122
372 HH22 ARG 51 HH22 ARG 51 1.786 4.540 13.286
373 H LEU 52 HN LEU 52 -2.505 0.311 6.375
374 HA LEU 52 HA LEU 52 -3.987 2.564 5.485
375 HB2 LEU 52 HB2 LEU 52 -4.144 -0.271 4.457
376 HB3 LEU 52 HB1 LEU 52 -4.673 1.171 3.618
377 HG LEU 52 HG LEU 52 -1.796 0.646 4.363
378 HD11 LEU 52 HD11 LEU 52 -3.256 0.163 1.769
379 HD12 LEU 52 HD12 LEU 52 -2.492 -1.048 2.799
380 HD13 LEU 52 HD13 LEU 52 -1.505 0.144 1.958
381 HD21 LEU 52 HD21 LEU 52 -2.370 2.999 4.081
382 HD22 LEU 52 HD22 LEU 52 -3.089 2.646 2.510
383 HD23 LEU 52 HD23 LEU 52 -1.354 2.437 2.754
384 H GLU 53 HN GLU 53 -4.926 -0.626 6.704
385 HA GLU 53 HA GLU 53 -7.698 -0.326 6.534
386 HB2 GLU 53 HB2 GLU 53 -6.063 -1.912 8.522
387 HB3 GLU 53 HB1 GLU 53 -7.795 -2.083 8.294
388 HG2 GLU 53 HG2 GLU 53 -7.445 -2.820 6.008
389 HG3 GLU 53 HG1 GLU 53 -5.705 -2.604 6.194
390 H SER 54 HN SER 54 -5.485 0.371 9.224
391 HA SER 54 HA SER 54 -7.465 1.273 11.016
392 HB2 SER 54 HB2 SER 54 -4.529 2.010 10.925
393 HB3 SER 54 HB1 SER 54 -5.596 2.172 12.321
394 HG SER 54 HG SER 54 -4.650 -0.190 11.070
395 H ARG 55 HN ARG 55 -5.737 2.870 8.435
396 HA ARG 55 HA ARG 55 -6.224 5.550 9.297
397 HB2 ARG 55 HB2 ARG 55 -4.414 4.700 7.682
398 HB3 ARG 55 HB1 ARG 55 -5.673 4.662 6.458
399 HG2 ARG 55 HG2 ARG 55 -4.925 7.144 7.988
400 HG3 ARG 55 HG1 ARG 55 -4.194 6.688 6.453
401 HD2 ARG 55 HD2 ARG 55 -6.693 6.542 5.667
402 HD3 ARG 55 HD1 ARG 55 -6.961 7.618 7.036
403 HE ARG 55 HE ARG 55 -4.826 8.497 5.341
404 HH11 ARG 55 HH11 ARG 55 -8.307 8.556 5.793
405 HH12 ARG 55 HH12 ARG 55 -8.537 9.926 4.749
406 HH21 ARG 55 HH21 ARG 55 -5.136 10.305 3.978
407 HH22 ARG 55 HH22 ARG 55 -6.746 10.934 3.756
408 H TYR 56 HN TYR 56 -7.700 3.488 6.782
409 HA TYR 56 HA TYR 56 -9.704 5.555 6.293
410 HB2 TYR 56 HB2 TYR 56 -9.167 2.967 4.819
411 HB3 TYR 56 HB1 TYR 56 -10.290 4.229 4.315
412 HD1 TYR 56 HD2 TYR 56 -9.374 6.499 3.710
413 HD2 TYR 56 HD1 TYR 56 -6.869 3.111 4.291
414 HE1 TYR 56 HE2 TYR 56 -7.559 7.642 2.507
415 HE2 TYR 56 HE1 TYR 56 -5.046 4.246 3.092
416 HH TYR 56 HH TYR 56 -5.083 7.548 2.404
417 H GLY 57 HN GLY 57 -9.438 2.842 8.224
418 HA2 GLY 57 HA2 GLY 57 -11.034 1.750 9.496
419 HA3 GLY 57 HA1 GLY 57 -12.257 2.782 8.762
420 H VAL 58 HN VAL 58 -9.962 0.756 7.061
421 HA VAL 58 HA VAL 58 -12.239 -0.722 5.922
422 HB VAL 58 HB VAL 58 -10.939 -1.043 3.898
423 HG11 VAL 58 HG11 VAL 58 -10.808 1.263 3.091
424 HG12 VAL 58 HG12 VAL 58 -10.939 1.846 4.751
425 HG13 VAL 58 HG13 VAL 58 -12.284 0.973 4.013
426 HG21 VAL 58 HG21 VAL 58 -8.763 0.020 3.566
427 HG22 VAL 58 HG22 VAL 58 -8.711 -1.153 4.882
428 HG23 VAL 58 HG23 VAL 58 -8.773 0.572 5.241
429 H SER 59 HN SER 59 -11.217 -2.810 4.785
430 HA SER 59 HA SER 59 -9.017 -3.938 6.315
431 HB2 SER 59 HB2 SER 59 -11.221 -4.678 7.383
432 HB3 SER 59 HB1 SER 59 -11.527 -5.570 5.891
433 HG SER 59 HG SER 59 -9.025 -5.968 7.000
434 H ILE 60 HN ILE 60 -7.745 -5.267 5.099
435 HA ILE 60 HA ILE 60 -8.302 -5.199 2.232
436 HB ILE 60 HB ILE 60 -5.799 -6.046 3.704
437 HG12 ILE 60 HG12 ILE 60 -6.432 -3.477 2.227
438 HG13 ILE 60 HG11 ILE 60 -6.363 -3.650 3.978
439 HG21 ILE 60 HG21 ILE 60 -6.243 -5.522 0.764
440 HG22 ILE 60 HG22 ILE 60 -5.997 -7.103 1.504
441 HG23 ILE 60 HG23 ILE 60 -4.698 -5.910 1.521
442 HD11 ILE 60 HD11 ILE 60 -4.346 -2.630 3.062
443 HD12 ILE 60 HD12 ILE 60 -4.062 -4.072 2.088
444 HD13 ILE 60 HD13 ILE 60 -3.997 -4.170 3.849
445 HA PRO 61 HA PRO 61 -9.964 -9.346 2.404
446 HB2 PRO 61 HB2 PRO 61 -9.285 -9.192 -0.494
447 HB3 PRO 61 HB1 PRO 61 -10.797 -9.671 0.284
448 HG2 PRO 61 HG2 PRO 61 -10.571 -7.286 -0.870
449 HG3 PRO 61 HG1 PRO 61 -11.459 -7.484 0.652
450 HD2 PRO 61 HD2 PRO 61 -8.741 -6.343 0.184
451 HD3 PRO 61 HD1 PRO 61 -9.984 -5.860 1.357
452 H ASP 62 HN ASP 62 -8.834 -10.994 3.086
453 HA ASP 62 HA ASP 62 -6.074 -11.233 2.967
454 HB2 ASP 62 HB2 ASP 62 -6.486 -13.578 3.799
455 HB3 ASP 62 HB1 ASP 62 -7.284 -12.307 4.722
456 H ASP 63 HN ASP 63 -8.522 -12.709 0.896
457 HA ASP 63 HA ASP 63 -6.626 -14.436 -0.409
458 HB2 ASP 63 HB2 ASP 63 -8.989 -15.078 -0.176
459 HB3 ASP 63 HB1 ASP 63 -9.464 -13.698 -1.158
460 H VAL 64 HN VAL 64 -8.214 -11.374 -1.109
461 HA VAL 64 HA VAL 64 -7.258 -11.244 -3.803
462 HB VAL 64 HB VAL 64 -8.371 -8.978 -2.149
463 HG11 VAL 64 HG11 VAL 64 -7.275 -8.243 -4.195
464 HG12 VAL 64 HG12 VAL 64 -9.022 -8.056 -4.341
465 HG13 VAL 64 HG13 VAL 64 -8.212 -9.405 -5.136
466 HG21 VAL 64 HG21 VAL 64 -9.802 -11.020 -3.846
467 HG22 VAL 64 HG22 VAL 64 -10.542 -9.565 -3.178
468 HG23 VAL 64 HG23 VAL 64 -9.933 -10.820 -2.099
469 H ALA 65 HN ALA 65 -6.068 -10.196 -0.705
470 HA ALA 65 HA ALA 65 -4.283 -8.195 -1.526
471 HB1 ALA 65 HB1 ALA 65 -4.004 -10.100 0.796
472 HB2 ALA 65 HB2 ALA 65 -4.883 -8.569 0.820
473 HB3 ALA 65 HB3 ALA 65 -3.133 -8.580 0.589
474 H GLY 66 HN GLY 66 -3.984 -11.674 -1.427
475 HA2 GLY 66 HA2 GLY 66 -1.165 -11.671 -2.022
476 HA3 GLY 66 HA1 GLY 66 -2.216 -13.077 -1.949
477 H ARG 67 HN ARG 67 -3.526 -10.692 -3.917
478 HA ARG 67 HA ARG 67 -2.673 -12.157 -6.311
479 HB2 ARG 67 HB2 ARG 67 -4.937 -10.175 -5.999
480 HB3 ARG 67 HB1 ARG 67 -4.592 -11.139 -7.426
481 HG2 ARG 67 HG2 ARG 67 -5.075 -13.178 -6.164
482 HG3 ARG 67 HG1 ARG 67 -5.435 -12.202 -4.737
483 HD2 ARG 67 HD2 ARG 67 -7.204 -11.049 -6.060
484 HD3 ARG 67 HD1 ARG 67 -6.891 -12.178 -7.376
485 HE ARG 67 HE ARG 67 -7.514 -13.456 -4.868
486 HH11 ARG 67 HH11 ARG 67 -8.844 -12.031 -7.785
487 HH12 ARG 67 HH12 ARG 67 -10.337 -12.924 -7.691
488 HH21 ARG 67 HH21 ARG 67 -9.482 -14.588 -4.711
489 HH22 ARG 67 HH22 ARG 67 -10.700 -14.378 -5.947
490 H VAL 68 HN VAL 68 -2.133 -9.223 -4.655
491 HA VAL 68 HA VAL 68 -1.443 -7.786 -7.113
492 HB VAL 68 HB VAL 68 -1.230 -5.780 -5.789
493 HG11 VAL 68 HG11 VAL 68 -3.722 -7.296 -5.025
494 HG12 VAL 68 HG12 VAL 68 -3.472 -6.410 -6.528
495 HG13 VAL 68 HG13 VAL 68 -3.526 -5.543 -4.993
496 HG21 VAL 68 HG21 VAL 68 -1.658 -5.765 -3.369
497 HG22 VAL 68 HG22 VAL 68 -0.237 -6.726 -3.774
498 HG23 VAL 68 HG23 VAL 68 -1.760 -7.525 -3.382
499 H ASP 69 HN ASP 69 0.595 -6.694 -7.305
500 HA ASP 69 HA ASP 69 2.697 -7.480 -5.446
501 HB2 ASP 69 HB2 ASP 69 4.181 -8.210 -7.158
502 HB3 ASP 69 HB1 ASP 69 2.665 -9.044 -7.449
503 H THR 70 HN THR 70 1.068 -5.103 -6.915
504 HA THR 70 HA THR 70 3.362 -3.287 -6.978
505 HB THR 70 HB THR 70 2.089 -2.224 -9.013
506 HG1 THR 70 HG1 THR 70 1.416 -4.959 -9.402
507 HG21 THR 70 HG21 THR 70 3.703 -4.760 -9.304
508 HG22 THR 70 HG22 THR 70 4.364 -3.138 -9.091
509 HG23 THR 70 HG23 THR 70 3.457 -3.535 -10.549
510 HA PRO 71 HA PRO 71 0.940 -0.642 -4.343
511 HB2 PRO 71 HB2 PRO 71 2.250 1.425 -6.061
512 HB3 PRO 71 HB1 PRO 71 2.111 1.363 -4.301
513 HG2 PRO 71 HG2 PRO 71 4.396 0.702 -5.439
514 HG3 PRO 71 HG1 PRO 71 3.760 -0.296 -4.113
515 HD2 PRO 71 HD2 PRO 71 3.762 -0.826 -7.057
516 HD3 PRO 71 HD1 PRO 71 4.010 -1.953 -5.705
517 H ARG 72 HN ARG 72 1.083 0.135 -7.818
518 HA ARG 72 HA ARG 72 -1.024 1.931 -7.957
519 HB2 ARG 72 HB2 ARG 72 0.606 1.277 -9.791
520 HB3 ARG 72 HB1 ARG 72 -0.417 -0.122 -10.077
521 HG2 ARG 72 HG2 ARG 72 -2.280 1.287 -10.643
522 HG3 ARG 72 HG1 ARG 72 -1.353 2.730 -10.234
523 HD2 ARG 72 HD2 ARG 72 0.289 2.052 -12.021
524 HD3 ARG 72 HD1 ARG 72 -0.864 0.804 -12.500
525 HE ARG 72 HE ARG 72 -2.324 3.096 -12.490
526 HH11 ARG 72 HH11 ARG 72 0.673 2.161 -14.040
527 HH12 ARG 72 HH12 ARG 72 0.403 3.157 -15.435
528 HH21 ARG 72 HH21 ARG 72 -2.659 4.427 -14.292
529 HH22 ARG 72 HH22 ARG 72 -1.478 4.454 -15.571
530 H GLU 73 HN GLU 73 -1.144 -1.594 -8.446
531 HA GLU 73 HA GLU 73 -3.932 -1.726 -8.848
532 HB2 GLU 73 HB2 GLU 73 -1.936 -3.811 -7.967
533 HB3 GLU 73 HB1 GLU 73 -3.622 -4.171 -8.312
534 HG2 GLU 73 HG2 GLU 73 -1.646 -3.007 -10.263
535 HG3 GLU 73 HG1 GLU 73 -2.172 -4.691 -10.202
536 H LEU 74 HN LEU 74 -1.961 -1.741 -5.979
537 HA LEU 74 HA LEU 74 -3.923 -2.712 -4.168
538 HB2 LEU 74 HB2 LEU 74 -1.408 -2.617 -3.849
539 HB3 LEU 74 HB1 LEU 74 -1.584 -0.903 -3.546
540 HG LEU 74 HG LEU 74 -1.354 -2.407 -1.521
541 HD11 LEU 74 HD11 LEU 74 -2.138 -0.110 -1.353
542 HD12 LEU 74 HD12 LEU 74 -2.964 -1.156 -0.197
543 HD13 LEU 74 HD13 LEU 74 -3.788 -0.644 -1.670
544 HD21 LEU 74 HD21 LEU 74 -3.412 -3.507 -0.744
545 HD22 LEU 74 HD22 LEU 74 -2.775 -4.225 -2.224
546 HD23 LEU 74 HD23 LEU 74 -4.170 -3.146 -2.296
547 H LEU 75 HN LEU 75 -2.909 0.520 -5.167
548 HA LEU 75 HA LEU 75 -4.469 2.033 -3.414
549 HB2 LEU 75 HB2 LEU 75 -2.612 2.851 -4.884
550 HB3 LEU 75 HB1 LEU 75 -3.707 2.749 -6.244
551 HG LEU 75 HG LEU 75 -4.402 4.474 -3.880
552 HD11 LEU 75 HD11 LEU 75 -2.651 5.247 -6.214
553 HD12 LEU 75 HD12 LEU 75 -2.143 5.116 -4.529
554 HD13 LEU 75 HD13 LEU 75 -3.306 6.353 -5.005
555 HD21 LEU 75 HD21 LEU 75 -6.124 4.068 -5.572
556 HD22 LEU 75 HD22 LEU 75 -5.030 4.648 -6.829
557 HD23 LEU 75 HD23 LEU 75 -5.604 5.754 -5.580
558 H ASP 76 HN ASP 76 -5.189 1.119 -6.793
559 HA ASP 76 HA ASP 76 -7.797 2.201 -6.773
560 HB2 ASP 76 HB2 ASP 76 -6.353 0.284 -8.576
561 HB3 ASP 76 HB1 ASP 76 -8.066 0.602 -8.808
562 H LEU 77 HN LEU 77 -6.528 -0.865 -5.738
563 HA LEU 77 HA LEU 77 -8.897 -2.387 -5.850
564 HB2 LEU 77 HB2 LEU 77 -6.670 -3.369 -5.555
565 HB3 LEU 77 HB1 LEU 77 -6.547 -2.635 -3.970
566 HG LEU 77 HG LEU 77 -8.481 -4.020 -3.225
567 HD11 LEU 77 HD11 LEU 77 -8.127 -5.394 -5.888
568 HD12 LEU 77 HD12 LEU 77 -9.489 -4.367 -5.445
569 HD13 LEU 77 HD13 LEU 77 -9.213 -5.884 -4.589
570 HD21 LEU 77 HD21 LEU 77 -6.200 -4.725 -2.769
571 HD22 LEU 77 HD22 LEU 77 -6.118 -5.527 -4.337
572 HD23 LEU 77 HD23 LEU 77 -7.226 -6.121 -3.102
573 H ILE 78 HN ILE 78 -7.428 -0.606 -3.137
574 HA ILE 78 HA ILE 78 -9.518 -1.211 -1.315
575 HB ILE 78 HB ILE 78 -7.465 1.011 -1.206
576 HG12 ILE 78 HG12 ILE 78 -7.515 -1.756 0.032
577 HG13 ILE 78 HG11 ILE 78 -6.476 -1.232 -1.289
578 HG21 ILE 78 HG21 ILE 78 -7.945 1.058 1.209
579 HG22 ILE 78 HG22 ILE 78 -9.255 -0.097 0.956
580 HG23 ILE 78 HG23 ILE 78 -9.350 1.514 0.245
581 HD11 ILE 78 HD11 ILE 78 -5.231 -1.296 0.761
582 HD12 ILE 78 HD12 ILE 78 -6.404 -0.246 1.556
583 HD13 ILE 78 HD13 ILE 78 -5.407 0.379 0.241
584 H ASN 79 HN ASN 79 -8.822 1.618 -3.340
585 HA ASN 79 HA ASN 79 -10.985 3.183 -2.410
586 HB2 ASN 79 HB2 ASN 79 -9.250 3.287 -4.844
587 HB3 ASN 79 HB1 ASN 79 -10.675 4.317 -4.745
588 HD21 ASN 79 HD21 ASN 79 -7.830 4.971 -4.774
589 HD22 ASN 79 HD22 ASN 79 -7.537 5.905 -3.355
590 H GLY 80 HN GLY 80 -10.745 0.732 -4.918
591 HA2 GLY 80 HA2 GLY 80 -13.221 1.189 -6.162
592 HA3 GLY 80 HA1 GLY 80 -12.388 -0.356 -6.098
593 H ALA 81 HN ALA 81 -12.377 -0.591 -3.244
594 HA ALA 81 HA ALA 81 -15.002 -1.643 -2.807
595 HB1 ALA 81 HB1 ALA 81 -14.155 -2.335 -0.645
596 HB2 ALA 81 HB2 ALA 81 -12.735 -1.308 -0.842
597 HB3 ALA 81 HB3 ALA 81 -12.972 -2.699 -1.902
598 H LEU 82 HN LEU 82 -13.311 1.275 -1.950
599 HA LEU 82 HA LEU 82 -15.152 2.157 0.044
600 HB2 LEU 82 HB2 LEU 82 -13.101 3.642 -1.597
601 HB3 LEU 82 HB1 LEU 82 -14.022 4.368 -0.291
602 HG LEU 82 HG LEU 82 -12.105 2.051 0.004
603 HD11 LEU 82 HD11 LEU 82 -10.694 3.671 1.184
604 HD12 LEU 82 HD12 LEU 82 -11.829 4.954 0.765
605 HD13 LEU 82 HD13 LEU 82 -10.937 4.115 -0.504
606 HD21 LEU 82 HD21 LEU 82 -13.604 3.652 2.075
607 HD22 LEU 82 HD22 LEU 82 -12.425 2.381 2.398
608 HD23 LEU 82 HD23 LEU 82 -13.951 1.988 1.607
609 H ALA 83 HN ALA 83 -14.736 2.821 -3.412
610 HA ALA 83 HA ALA 83 -16.855 4.684 -3.643
611 HB1 ALA 83 HB1 ALA 83 -16.720 4.217 -6.063
612 HB2 ALA 83 HB2 ALA 83 -15.620 2.882 -5.722
613 HB3 ALA 83 HB3 ALA 83 -15.142 4.536 -5.342
614 H GLU 84 HN GLU 84 -16.787 1.277 -3.343
615 HA GLU 84 HA GLU 84 -19.210 0.572 -4.591
616 HB2 GLU 84 HB2 GLU 84 -17.448 -1.029 -3.892
617 HB3 GLU 84 HB1 GLU 84 -17.852 -0.713 -2.212
618 HG2 GLU 84 HG2 GLU 84 -18.848 -2.768 -2.837
619 HG3 GLU 84 HG1 GLU 84 -20.133 -1.574 -2.662
620 H ALA 85 HN ALA 85 -18.488 2.158 -1.630
621 HA ALA 85 HA ALA 85 -21.274 1.868 -0.723
622 HB1 ALA 85 HB1 ALA 85 -19.587 0.922 0.809
623 HB2 ALA 85 HB2 ALA 85 -20.487 2.254 1.530
624 HB3 ALA 85 HB3 ALA 85 -18.846 2.520 0.945
625 H ALA 86 HN ALA 86 -20.002 3.851 -2.635
626 HA ALA 86 HA ALA 86 -20.522 6.325 -1.119
627 HB1 ALA 86 HB1 ALA 86 -19.179 7.497 -2.764
628 HB2 ALA 86 HB2 ALA 86 -18.974 6.013 -3.693
629 HB3 ALA 86 HB3 ALA 86 -18.259 6.154 -2.087
630 H28 SXO 87 H28B SXO 87 6.628 -11.493 5.204
631 H28A SXO 87 H28A SXO 87 7.369 -12.323 6.575
632 H30 SXO 87 H30A SXO 87 5.009 -12.443 7.491
633 H30A SXO 87 H30C SXO 87 4.520 -11.626 6.007
634 H30B SXO 87 H30B SXO 87 3.736 -13.131 6.481
635 H31 SXO 87 H31A SXO 87 4.344 -14.356 4.383
636 H31A SXO 87 H31B SXO 87 5.961 -14.137 3.716
637 H31B SXO 87 H31C SXO 87 4.861 -12.763 3.830
638 H32 SXO 87 H32A SXO 87 6.047 -14.506 7.517
639 HO33 SXO 87 H33A SXO 87 7.263 -15.743 5.295
640 HN36 SXO 87 H36A SXO 87 3.553 -14.638 6.845
641 H37 SXO 87 H37A SXO 87 3.005 -17.419 6.067
642 H37A SXO 87 H37B SXO 87 1.980 -16.401 7.079
643 H38 SXO 87 H38B SXO 87 0.937 -16.627 4.925
644 H38A SXO 87 H38A SXO 87 2.429 -16.166 4.105
645 HN41 SXO 87 H41A SXO 87 1.139 -14.623 3.032
646 H42 SXO 87 H42A SXO 87 -0.349 -12.544 3.997
647 H42A SXO 87 H42B SXO 87 1.321 -12.013 4.169
648 H43 SXO 87 H43B SXO 87 1.648 -12.512 1.734
649 H43A SXO 87 H43A SXO 87 -0.096 -12.782 1.620
650 H2 SXO 87 H2A SXO 87 0.509 -9.074 -1.366
651 H2A SXO 87 H2B SXO 87 1.623 -8.660 -0.060
652 H3 SXO 87 H3B SXO 87 -1.380 -8.519 0.128
653 H3A SXO 87 H3A SXO 87 -0.220 -8.028 1.366
654 H4 SXO 87 H4A SXO 87 -0.498 -6.806 -1.382
655 H4A SXO 87 H4B SXO 87 0.660 -6.312 -0.145
656 H5 SXO 87 H5B SXO 87 -1.379 -4.870 -0.283
657 H5A SXO 87 H5A SXO 87 -2.333 -6.264 0.222
658 H6 SXO 87 H6A SXO 87 -0.898 -6.378 2.283
659 H6A SXO 87 H6B SXO 87 -1.918 -4.944 2.165
660 H7 SXO 87 H7A SXO 87 0.997 -5.035 1.385
661 H7A SXO 87 H7B SXO 87 0.380 -4.434 2.933
662 H8 SXO 87 H8C SXO 87 -0.909 -2.724 1.747
663 H8A SXO 87 H8A SXO 87 -0.301 -3.334 0.207
664 H8B SXO 87 H8B SXO 87 0.809 -2.606 1.365
Start of MODEL 11
1 H1 MET 1 HT1 MET 1 -15.947 16.780 -0.200
2 H2 MET 1 HT2 MET 1 -14.685 15.786 0.346
3 H3 MET 1 HT3 MET 1 -15.514 16.784 1.441
4 HA MET 1 HA MET 1 -17.506 15.536 1.216
5 HB2 MET 1 HB2 MET 1 -17.269 15.023 -1.181
6 HB3 MET 1 HB1 MET 1 -15.954 13.914 -0.815
7 HG2 MET 1 HG2 MET 1 -17.558 12.573 0.540
8 HG3 MET 1 HG1 MET 1 -18.847 13.616 -0.053
9 HE1 MET 1 HE1 MET 1 -16.266 10.934 -2.788
10 HE2 MET 1 HE2 MET 1 -16.165 10.873 -1.029
11 HE3 MET 1 HE3 MET 1 -15.649 12.321 -1.894
12 H ALA 2 HN ALA 2 -14.676 13.506 0.580
13 HA ALA 2 HA ALA 2 -14.265 12.804 3.317
14 HB1 ALA 2 HB1 ALA 2 -14.883 10.441 3.143
15 HB2 ALA 2 HB2 ALA 2 -15.503 10.714 1.516
16 HB3 ALA 2 HB3 ALA 2 -16.291 11.477 2.897
17 H THR 3 HN THR 3 -12.150 12.420 3.454
18 HA THR 3 HA THR 3 -10.576 12.245 1.081
19 HB THR 3 HB THR 3 -8.713 11.880 2.886
20 HG1 THR 3 HG1 THR 3 -9.991 11.425 4.658
21 HG21 THR 3 HG21 THR 3 -8.652 14.303 3.300
22 HG22 THR 3 HG22 THR 3 -10.308 14.442 2.709
23 HG23 THR 3 HG23 THR 3 -9.019 13.939 1.615
24 H LEU 4 HN LEU 4 -10.670 10.418 -0.024
25 HA LEU 4 HA LEU 4 -10.660 7.811 1.177
26 HB2 LEU 4 HB2 LEU 4 -10.136 8.628 -1.687
27 HB3 LEU 4 HB1 LEU 4 -10.471 7.002 -1.126
28 HG LEU 4 HG LEU 4 -12.412 9.305 -0.980
29 HD11 LEU 4 HD11 LEU 4 -12.253 6.994 -2.906
30 HD12 LEU 4 HD12 LEU 4 -12.008 8.700 -3.282
31 HD13 LEU 4 HD13 LEU 4 -13.600 8.124 -2.785
32 HD21 LEU 4 HD21 LEU 4 -14.059 7.590 -0.431
33 HD22 LEU 4 HD22 LEU 4 -12.759 7.620 0.761
34 HD23 LEU 4 HD23 LEU 4 -12.798 6.357 -0.469
35 H LEU 5 HN LEU 5 -8.897 6.289 -0.066
36 HA LEU 5 HA LEU 5 -6.347 7.176 0.961
37 HB2 LEU 5 HB2 LEU 5 -7.409 4.737 0.827
38 HB3 LEU 5 HB1 LEU 5 -6.646 4.735 -0.751
39 HG LEU 5 HG LEU 5 -5.204 5.162 1.872
40 HD11 LEU 5 HD11 LEU 5 -4.296 2.931 1.517
41 HD12 LEU 5 HD12 LEU 5 -5.308 2.743 0.085
42 HD13 LEU 5 HD13 LEU 5 -6.054 2.899 1.675
43 HD21 LEU 5 HD21 LEU 5 -3.162 4.913 0.585
44 HD22 LEU 5 HD22 LEU 5 -4.107 6.269 -0.028
45 HD23 LEU 5 HD23 LEU 5 -4.094 4.737 -0.903
46 H THR 6 HN THR 6 -4.935 8.323 -0.210
47 HA THR 6 HA THR 6 -5.191 8.234 -3.139
48 HB THR 6 HB THR 6 -6.027 10.381 -2.298
49 HG1 THR 6 HG1 THR 6 -3.734 11.422 -3.324
50 HG21 THR 6 HG21 THR 6 -4.557 11.960 -1.165
51 HG22 THR 6 HG22 THR 6 -3.267 10.761 -1.141
52 HG23 THR 6 HG23 THR 6 -4.742 10.487 -0.215
53 H THR 7 HN THR 7 -3.207 8.790 -4.299
54 HA THR 7 HA THR 7 -1.093 7.141 -3.595
55 HB THR 7 HB THR 7 -0.761 9.526 -5.396
56 HG1 THR 7 HG1 THR 7 -1.657 7.384 -6.745
57 HG21 THR 7 HG21 THR 7 0.252 6.690 -5.526
58 HG22 THR 7 HG22 THR 7 1.189 8.106 -5.051
59 HG23 THR 7 HG23 THR 7 0.590 7.960 -6.702
60 H ASP 8 HN ASP 8 -1.610 10.544 -2.943
61 HA ASP 8 HA ASP 8 0.956 11.347 -2.176
62 HB2 ASP 8 HB2 ASP 8 -1.576 12.268 -0.818
63 HB3 ASP 8 HB1 ASP 8 -0.101 13.183 -1.095
64 H ASP 9 HN ASP 9 -1.730 10.407 -0.069
65 HA ASP 9 HA ASP 9 -0.177 10.232 2.278
66 HB2 ASP 9 HB2 ASP 9 -2.932 9.242 1.571
67 HB3 ASP 9 HB1 ASP 9 -2.231 9.012 3.171
68 H LEU 10 HN LEU 10 -1.019 7.914 -0.193
69 HA LEU 10 HA LEU 10 -0.294 5.559 1.156
70 HB2 LEU 10 HB2 LEU 10 -1.447 5.648 -1.047
71 HB3 LEU 10 HB1 LEU 10 0.047 6.193 -1.782
72 HG LEU 10 HG LEU 10 1.116 4.039 -1.124
73 HD11 LEU 10 HD11 LEU 10 -1.687 3.319 -0.285
74 HD12 LEU 10 HD12 LEU 10 -0.282 3.470 0.768
75 HD13 LEU 10 HD13 LEU 10 -0.345 2.186 -0.438
76 HD21 LEU 10 HD21 LEU 10 -0.020 2.680 -2.811
77 HD22 LEU 10 HD22 LEU 10 0.185 4.341 -3.364
78 HD23 LEU 10 HD23 LEU 10 -1.390 3.789 -2.792
79 H ARG 11 HN ARG 11 1.593 7.827 -0.793
80 HA ARG 11 HA ARG 11 4.082 6.604 -0.678
81 HB2 ARG 11 HB2 ARG 11 3.622 8.506 -2.119
82 HB3 ARG 11 HB1 ARG 11 3.372 9.543 -0.725
83 HG2 ARG 11 HG2 ARG 11 5.672 9.501 -0.164
84 HG3 ARG 11 HG1 ARG 11 5.993 8.187 -1.298
85 HD2 ARG 11 HD2 ARG 11 6.769 10.297 -2.206
86 HD3 ARG 11 HD1 ARG 11 5.430 9.668 -3.165
87 HE ARG 11 HE ARG 11 4.221 11.347 -1.409
88 HH11 ARG 11 HH11 ARG 11 6.871 11.690 -3.663
89 HH12 ARG 11 HH12 ARG 11 6.581 13.378 -3.955
90 HH21 ARG 11 HH21 ARG 11 3.783 13.571 -1.839
91 HH22 ARG 11 HH22 ARG 11 4.835 14.441 -2.913
92 H ARG 12 HN ARG 12 2.397 8.506 1.729
93 HA ARG 12 HA ARG 12 4.662 8.766 3.476
94 HB2 ARG 12 HB2 ARG 12 1.752 9.398 3.671
95 HB3 ARG 12 HB1 ARG 12 2.717 9.343 5.139
96 HG2 ARG 12 HG2 ARG 12 3.352 11.050 2.744
97 HG3 ARG 12 HG1 ARG 12 2.492 11.604 4.181
98 HD2 ARG 12 HD2 ARG 12 5.296 10.495 4.117
99 HD3 ARG 12 HD1 ARG 12 4.862 12.195 4.282
100 HE ARG 12 HE ARG 12 3.569 11.125 6.356
101 HH11 ARG 12 HH11 ARG 12 6.845 10.659 5.243
102 HH12 ARG 12 HH12 ARG 12 7.495 10.392 6.833
103 HH21 ARG 12 HH21 ARG 12 4.390 10.785 8.452
104 HH22 ARG 12 HH22 ARG 12 6.085 10.456 8.659
105 H ALA 13 HN ALA 13 1.853 6.636 3.273
106 HA ALA 13 HA ALA 13 2.043 5.481 5.817
107 HB1 ALA 13 HB1 ALA 13 0.613 3.706 4.924
108 HB2 ALA 13 HB2 ALA 13 0.911 4.293 3.287
109 HB3 ALA 13 HB3 ALA 13 0.048 5.307 4.446
110 H LEU 14 HN LEU 14 3.546 4.548 2.763
111 HA LEU 14 HA LEU 14 4.623 2.094 3.627
112 HB2 LEU 14 HB2 LEU 14 5.280 3.999 1.424
113 HB3 LEU 14 HB1 LEU 14 6.406 2.712 1.792
114 HG LEU 14 HG LEU 14 4.951 2.073 -0.051
115 HD11 LEU 14 HD11 LEU 14 5.728 0.304 1.388
116 HD12 LEU 14 HD12 LEU 14 4.086 -0.043 0.847
117 HD13 LEU 14 HD13 LEU 14 4.369 0.556 2.482
118 HD21 LEU 14 HD21 LEU 14 3.010 3.447 0.511
119 HD22 LEU 14 HD22 LEU 14 2.671 2.402 1.892
120 HD23 LEU 14 HD23 LEU 14 2.560 1.761 0.252
121 H VAL 15 HN VAL 15 5.816 5.404 3.845
122 HA VAL 15 HA VAL 15 8.360 4.676 4.937
123 HB VAL 15 HB VAL 15 6.909 7.328 5.123
124 HG11 VAL 15 HG11 VAL 15 8.672 7.104 6.797
125 HG12 VAL 15 HG12 VAL 15 9.150 8.257 5.548
126 HG13 VAL 15 HG13 VAL 15 9.816 6.623 5.545
127 HG21 VAL 15 HG21 VAL 15 8.992 6.388 3.144
128 HG22 VAL 15 HG22 VAL 15 8.302 8.009 3.234
129 HG23 VAL 15 HG23 VAL 15 7.278 6.641 2.797
130 H GLU 16 HN GLU 16 5.228 5.617 6.246
131 HA GLU 16 HA GLU 16 5.960 5.863 8.943
132 HB2 GLU 16 HB2 GLU 16 3.331 5.099 7.671
133 HB3 GLU 16 HB1 GLU 16 3.522 5.453 9.383
134 HG2 GLU 16 HG2 GLU 16 4.167 7.714 8.901
135 HG3 GLU 16 HG1 GLU 16 4.174 7.387 7.170
136 H SER 17 HN SER 17 4.992 3.032 7.040
137 HA SER 17 HA SER 17 4.958 1.303 9.335
138 HB2 SER 17 HB2 SER 17 4.810 -0.507 7.565
139 HB3 SER 17 HB1 SER 17 3.523 0.697 7.540
140 HG SER 17 HG SER 17 4.567 0.124 5.456
141 H ALA 18 HN ALA 18 7.239 1.988 6.719
142 HA ALA 18 HA ALA 18 9.133 0.016 7.458
143 HB1 ALA 18 HB1 ALA 18 9.575 2.587 5.942
144 HB2 ALA 18 HB2 ALA 18 9.104 1.040 5.237
145 HB3 ALA 18 HB3 ALA 18 10.682 1.217 6.006
146 H GLY 19 HN GLY 19 9.171 3.550 7.947
147 HA2 GLY 19 HA2 GLY 19 9.800 4.676 9.891
148 HA3 GLY 19 HA1 GLY 19 10.391 3.163 10.557
149 H GLU 20 HN GLU 20 11.816 2.885 7.802
150 HA GLU 20 HA GLU 20 14.233 4.247 8.710
151 HB2 GLU 20 HB2 GLU 20 14.323 1.809 8.235
152 HB3 GLU 20 HB1 GLU 20 13.917 2.143 6.556
153 HG2 GLU 20 HG2 GLU 20 16.313 1.761 6.881
154 HG3 GLU 20 HG1 GLU 20 15.972 3.380 6.267
155 H THR 21 HN THR 21 15.461 5.570 7.343
156 HA THR 21 HA THR 21 14.009 6.653 5.011
157 HB THR 21 HB THR 21 15.538 8.535 6.741
158 HG1 THR 21 HG1 THR 21 14.309 7.477 8.308
159 HG21 THR 21 HG21 THR 21 14.511 9.325 4.685
160 HG22 THR 21 HG22 THR 21 13.711 10.052 6.077
161 HG23 THR 21 HG23 THR 21 12.939 8.723 5.215
162 H ASP 22 HN ASP 22 16.303 4.822 5.179
163 HA ASP 22 HA ASP 22 18.623 6.456 4.576
164 HB2 ASP 22 HB2 ASP 22 18.730 4.344 5.968
165 HB3 ASP 22 HB1 ASP 22 18.454 3.442 4.479
166 H GLY 23 HN GLY 23 17.297 3.588 2.904
167 HA2 GLY 23 HA2 GLY 23 17.986 4.946 0.368
168 HA3 GLY 23 HA1 GLY 23 18.013 3.203 0.594
169 H THR 24 HN THR 24 15.415 4.127 2.261
170 HA THR 24 HA THR 24 13.630 3.339 0.118
171 HB THR 24 HB THR 24 11.954 3.559 2.156
172 HG1 THR 24 HG1 THR 24 13.010 4.175 3.889
173 HG21 THR 24 HG21 THR 24 12.482 1.237 2.773
174 HG22 THR 24 HG22 THR 24 14.022 1.368 1.924
175 HG23 THR 24 HG23 THR 24 12.508 1.463 1.024
176 H ASP 25 HN ASP 25 14.109 5.513 -0.952
177 HA ASP 25 HA ASP 25 12.304 7.570 0.112
178 HB2 ASP 25 HB2 ASP 25 13.421 9.197 -1.151
179 HB3 ASP 25 HB1 ASP 25 14.726 8.140 -0.631
180 H LEU 26 HN LEU 26 10.449 8.031 -0.863
181 HA LEU 26 HA LEU 26 9.811 6.568 -3.325
182 HB2 LEU 26 HB2 LEU 26 8.200 7.402 -0.950
183 HB3 LEU 26 HB1 LEU 26 7.391 7.266 -2.497
184 HG LEU 26 HG LEU 26 8.062 4.900 -2.643
185 HD11 LEU 26 HD11 LEU 26 10.105 4.925 -1.346
186 HD12 LEU 26 HD12 LEU 26 8.969 3.765 -0.660
187 HD13 LEU 26 HD13 LEU 26 9.204 5.332 0.116
188 HD21 LEU 26 HD21 LEU 26 5.903 5.473 -1.693
189 HD22 LEU 26 HD22 LEU 26 6.630 5.644 -0.095
190 HD23 LEU 26 HD23 LEU 26 6.579 4.064 -0.877
191 H SER 27 HN SER 27 11.294 8.888 -3.573
192 HA SER 27 HA SER 27 9.648 11.181 -3.996
193 HB2 SER 27 HB2 SER 27 12.086 11.313 -3.520
194 HB3 SER 27 HB1 SER 27 12.415 10.589 -5.090
195 HG SER 27 HG SER 27 12.372 12.547 -5.816
196 H GLY 28 HN GLY 28 10.553 8.431 -5.911
197 HA2 GLY 28 HA2 GLY 28 9.292 9.628 -8.282
198 HA3 GLY 28 HA1 GLY 28 10.335 8.211 -8.294
199 H ASP 29 HN ASP 29 8.585 7.253 -9.560
200 HA ASP 29 HA ASP 29 6.065 6.728 -8.241
201 HB2 ASP 29 HB2 ASP 29 6.117 7.042 -10.686
202 HB3 ASP 29 HB1 ASP 29 7.168 5.637 -10.847
203 H PHE 30 HN PHE 30 5.562 4.993 -7.092
204 HA PHE 30 HA PHE 30 7.462 2.752 -7.058
205 HB2 PHE 30 HB2 PHE 30 6.680 2.367 -4.701
206 HB3 PHE 30 HB1 PHE 30 7.553 3.875 -4.941
207 HD1 PHE 30 HD2 PHE 30 6.306 6.023 -4.991
208 HD2 PHE 30 HD1 PHE 30 4.424 2.338 -3.979
209 HE1 PHE 30 HE2 PHE 30 4.433 7.256 -3.990
210 HE2 PHE 30 HE1 PHE 30 2.548 3.573 -2.974
211 HZ PHE 30 HZ PHE 30 2.554 6.044 -2.986
212 H LEU 31 HN LEU 31 4.210 3.731 -7.520
213 HA LEU 31 HA LEU 31 2.828 1.398 -6.814
214 HB2 LEU 31 HB2 LEU 31 2.102 3.413 -8.926
215 HB3 LEU 31 HB1 LEU 31 1.017 2.212 -8.255
216 HG LEU 31 HG LEU 31 1.860 3.518 -6.005
217 HD11 LEU 31 HD11 LEU 31 3.070 5.183 -7.282
218 HD12 LEU 31 HD12 LEU 31 1.665 5.918 -6.509
219 HD13 LEU 31 HD13 LEU 31 1.624 5.538 -8.229
220 HD21 LEU 31 HD21 LEU 31 -0.354 4.555 -6.038
221 HD22 LEU 31 HD22 LEU 31 -0.426 2.874 -6.569
222 HD23 LEU 31 HD23 LEU 31 -0.510 4.177 -7.754
223 H ASP 32 HN ASP 32 4.683 2.167 -9.671
224 HA ASP 32 HA ASP 32 3.452 0.009 -11.199
225 HB2 ASP 32 HB2 ASP 32 4.033 2.214 -12.232
226 HB3 ASP 32 HB1 ASP 32 5.731 1.843 -11.968
227 H LEU 33 HN LEU 33 6.165 0.535 -9.201
228 HA LEU 33 HA LEU 33 7.639 -1.750 -10.234
229 HB2 LEU 33 HB2 LEU 33 8.206 -0.002 -7.837
230 HB3 LEU 33 HB1 LEU 33 9.288 -1.202 -8.514
231 HG LEU 33 HG LEU 33 8.398 1.338 -9.887
232 HD11 LEU 33 HD11 LEU 33 11.036 0.555 -8.653
233 HD12 LEU 33 HD12 LEU 33 9.927 1.795 -8.069
234 HD13 LEU 33 HD13 LEU 33 10.751 2.006 -9.614
235 HD21 LEU 33 HD21 LEU 33 10.036 0.750 -11.600
236 HD22 LEU 33 HD22 LEU 33 8.782 -0.486 -11.468
237 HD23 LEU 33 HD23 LEU 33 10.374 -0.765 -10.762
238 H ARG 34 HN ARG 34 8.054 -3.643 -8.936
239 HA ARG 34 HA ARG 34 5.789 -4.446 -7.376
240 HB2 ARG 34 HB2 ARG 34 8.445 -5.856 -7.726
241 HB3 ARG 34 HB1 ARG 34 6.967 -6.568 -7.092
242 HG2 ARG 34 HG2 ARG 34 5.876 -6.203 -9.259
243 HG3 ARG 34 HG1 ARG 34 7.386 -5.535 -9.887
244 HD2 ARG 34 HD2 ARG 34 8.460 -7.744 -9.229
245 HD3 ARG 34 HD1 ARG 34 6.818 -8.353 -8.998
246 HE ARG 34 HE ARG 34 6.870 -7.224 -11.521
247 HH11 ARG 34 HH11 ARG 34 8.436 -9.864 -9.839
248 HH12 ARG 34 HH12 ARG 34 8.786 -10.747 -11.289
249 HH21 ARG 34 HH21 ARG 34 7.377 -8.344 -13.431
250 HH22 ARG 34 HH22 ARG 34 8.196 -9.875 -13.348
251 H PHE 35 HN PHE 35 5.839 -5.147 -5.153
252 HA PHE 35 HA PHE 35 6.873 -3.244 -3.405
253 HB2 PHE 35 HB2 PHE 35 5.972 -6.072 -2.841
254 HB3 PHE 35 HB1 PHE 35 6.292 -4.866 -1.595
255 HD1 PHE 35 HD2 PHE 35 4.954 -2.700 -1.688
256 HD2 PHE 35 HD1 PHE 35 3.884 -6.216 -3.829
257 HE1 PHE 35 HE2 PHE 35 2.651 -1.868 -1.899
258 HE2 PHE 35 HE1 PHE 35 1.577 -5.389 -4.049
259 HZ PHE 35 HZ PHE 35 0.960 -3.212 -3.079
260 H GLU 36 HN GLU 36 8.027 -6.569 -3.952
261 HA GLU 36 HA GLU 36 10.248 -6.440 -2.236
262 HB2 GLU 36 HB2 GLU 36 10.382 -8.052 -4.758
263 HB3 GLU 36 HB1 GLU 36 10.933 -8.467 -3.142
264 HG2 GLU 36 HG2 GLU 36 9.120 -9.846 -3.401
265 HG3 GLU 36 HG1 GLU 36 8.402 -8.473 -2.561
266 H ASP 37 HN ASP 37 9.700 -5.024 -5.293
267 HA ASP 37 HA ASP 37 12.472 -4.928 -6.114
268 HB2 ASP 37 HB2 ASP 37 10.283 -5.073 -7.575
269 HB3 ASP 37 HB1 ASP 37 10.288 -3.324 -7.400
270 H ILE 38 HN ILE 38 10.069 -2.816 -4.655
271 HA ILE 38 HA ILE 38 11.958 -0.595 -4.598
272 HB ILE 38 HB ILE 38 10.114 0.603 -3.357
273 HG12 ILE 38 HG12 ILE 38 8.533 -1.835 -4.201
274 HG13 ILE 38 HG11 ILE 38 8.907 -1.364 -2.544
275 HG21 ILE 38 HG21 ILE 38 9.474 -0.423 -6.114
276 HG22 ILE 38 HG22 ILE 38 10.554 0.919 -5.735
277 HG23 ILE 38 HG23 ILE 38 8.834 1.043 -5.373
278 HD11 ILE 38 HD11 ILE 38 6.622 -0.787 -3.141
279 HD12 ILE 38 HD12 ILE 38 7.212 0.194 -4.483
280 HD13 ILE 38 HD13 ILE 38 7.580 0.660 -2.824
281 H GLY 39 HN GLY 39 11.997 -3.261 -2.959
282 HA2 GLY 39 HA2 GLY 39 13.328 -3.690 -1.099
283 HA3 GLY 39 HA1 GLY 39 13.311 -1.975 -0.728
284 H TYR 40 HN TYR 40 10.241 -3.464 -1.232
285 HA TYR 40 HA TYR 40 9.840 -3.484 1.679
286 HB2 TYR 40 HB2 TYR 40 7.949 -2.924 -0.589
287 HB3 TYR 40 HB1 TYR 40 7.345 -3.417 0.991
288 HD1 TYR 40 HD2 TYR 40 7.641 -1.955 2.944
289 HD2 TYR 40 HD1 TYR 40 8.918 -0.760 -0.933
290 HE1 TYR 40 HE2 TYR 40 7.779 0.377 3.713
291 HE2 TYR 40 HE1 TYR 40 9.060 1.569 -0.178
292 HH TYR 40 HH TYR 40 8.262 3.012 1.528
293 H ASP 41 HN ASP 41 10.149 -5.438 2.419
294 HA ASP 41 HA ASP 41 9.555 -7.756 0.768
295 HB2 ASP 41 HB2 ASP 41 11.657 -7.294 2.315
296 HB3 ASP 41 HB1 ASP 41 10.617 -8.007 3.546
297 H SER 42 HN SER 42 8.941 -9.686 2.594
298 HA SER 42 HA SER 42 6.175 -9.592 2.595
299 HB2 SER 42 HB2 SER 42 6.307 -11.590 4.072
300 HB3 SER 42 HB1 SER 42 7.434 -11.680 2.713
301 H LEU 43 HN LEU 43 8.312 -9.237 5.411
302 HA LEU 43 HA LEU 43 6.287 -8.846 7.306
303 HB2 LEU 43 HB2 LEU 43 8.589 -9.461 7.878
304 HB3 LEU 43 HB1 LEU 43 9.146 -7.880 7.369
305 HG LEU 43 HG LEU 43 7.805 -6.853 9.185
306 HD11 LEU 43 HD11 LEU 43 6.866 -8.275 10.934
307 HD12 LEU 43 HD12 LEU 43 7.319 -9.714 10.019
308 HD13 LEU 43 HD13 LEU 43 6.104 -8.609 9.378
309 HD21 LEU 43 HD21 LEU 43 9.753 -8.984 10.069
310 HD22 LEU 43 HD22 LEU 43 9.252 -7.585 11.020
311 HD23 LEU 43 HD23 LEU 43 10.167 -7.355 9.529
312 H ALA 44 HN ALA 44 8.214 -6.481 5.499
313 HA ALA 44 HA ALA 44 7.193 -4.192 6.784
314 HB1 ALA 44 HB1 ALA 44 9.257 -4.190 5.451
315 HB2 ALA 44 HB2 ALA 44 8.126 -2.944 4.922
316 HB3 ALA 44 HB3 ALA 44 8.298 -4.430 3.989
317 H LEU 45 HN LEU 45 6.108 -6.046 4.014
318 HA LEU 45 HA LEU 45 4.205 -4.174 3.079
319 HB2 LEU 45 HB2 LEU 45 5.113 -5.990 1.691
320 HB3 LEU 45 HB1 LEU 45 4.293 -7.172 2.698
321 HG LEU 45 HG LEU 45 2.119 -6.231 2.007
322 HD11 LEU 45 HD11 LEU 45 2.038 -4.657 0.134
323 HD12 LEU 45 HD12 LEU 45 3.795 -4.501 0.199
324 HD13 LEU 45 HD13 LEU 45 2.807 -3.955 1.557
325 HD21 LEU 45 HD21 LEU 45 3.103 -8.123 0.798
326 HD22 LEU 45 HD22 LEU 45 3.891 -6.997 -0.309
327 HD23 LEU 45 HD23 LEU 45 2.130 -7.099 -0.257
328 H MET 46 HN MET 46 3.919 -7.018 5.211
329 HA MET 46 HA MET 46 1.097 -6.851 5.396
330 HB2 MET 46 HB2 MET 46 1.260 -8.481 7.195
331 HB3 MET 46 HB1 MET 46 2.288 -8.940 5.847
332 HG2 MET 46 HG2 MET 46 3.644 -9.402 7.633
333 HG3 MET 46 HG1 MET 46 4.156 -7.768 7.233
334 HE1 MET 46 HE1 MET 46 1.334 -8.798 10.741
335 HE2 MET 46 HE2 MET 46 2.052 -10.004 9.676
336 HE3 MET 46 HE3 MET 46 0.838 -8.887 9.049
337 H GLU 47 HN GLU 47 3.696 -5.452 7.333
338 HA GLU 47 HA GLU 47 2.020 -4.423 9.363
339 HB2 GLU 47 HB2 GLU 47 4.719 -3.527 8.357
340 HB3 GLU 47 HB1 GLU 47 3.908 -2.774 9.726
341 HG2 GLU 47 HG2 GLU 47 3.845 -5.026 10.814
342 HG3 GLU 47 HG1 GLU 47 4.859 -5.619 9.498
343 H THR 48 HN THR 48 2.947 -3.242 6.206
344 HA THR 48 HA THR 48 1.951 -0.618 6.431
345 HB THR 48 HB THR 48 2.159 -2.312 3.930
346 HG1 THR 48 HG1 THR 48 4.204 -2.182 4.806
347 HG21 THR 48 HG21 THR 48 0.796 -0.312 3.609
348 HG22 THR 48 HG22 THR 48 2.348 -0.140 2.787
349 HG23 THR 48 HG23 THR 48 2.067 0.680 4.324
350 H ALA 49 HN ALA 49 0.398 -3.676 5.672
351 HA ALA 49 HA ALA 49 -2.070 -2.779 4.743
352 HB1 ALA 49 HB1 ALA 49 -2.973 -4.906 5.519
353 HB2 ALA 49 HB2 ALA 49 -1.539 -5.168 6.511
354 HB3 ALA 49 HB3 ALA 49 -1.402 -5.138 4.754
355 H ALA 50 HN ALA 50 -1.003 -3.373 8.076
356 HA ALA 50 HA ALA 50 -3.411 -2.628 9.341
357 HB1 ALA 50 HB1 ALA 50 -2.087 -2.504 11.386
358 HB2 ALA 50 HB2 ALA 50 -0.601 -2.566 10.438
359 HB3 ALA 50 HB3 ALA 50 -1.690 -3.952 10.463
360 H ARG 51 HN ARG 51 -0.781 -0.828 8.031
361 HA ARG 51 HA ARG 51 -1.262 1.596 9.454
362 HB2 ARG 51 HB2 ARG 51 0.227 1.037 6.889
363 HB3 ARG 51 HB1 ARG 51 0.168 2.610 7.658
364 HG2 ARG 51 HG2 ARG 51 1.252 0.134 8.970
365 HG3 ARG 51 HG1 ARG 51 2.236 1.317 8.115
366 HD2 ARG 51 HD2 ARG 51 2.372 1.810 10.444
367 HD3 ARG 51 HD1 ARG 51 1.382 3.059 9.693
368 HE ARG 51 HE ARG 51 -0.028 0.812 10.891
369 HH11 ARG 51 HH11 ARG 51 1.056 4.109 11.158
370 HH12 ARG 51 HH12 ARG 51 -0.003 4.508 12.474
371 HH21 ARG 51 HH21 ARG 51 -1.482 1.330 12.609
372 HH22 ARG 51 HH22 ARG 51 -1.466 2.927 13.286
373 H LEU 52 HN LEU 52 -2.385 0.239 6.403
374 HA LEU 52 HA LEU 52 -3.732 2.687 5.651
375 HB2 LEU 52 HB2 LEU 52 -3.904 -0.070 4.435
376 HB3 LEU 52 HB1 LEU 52 -4.547 1.401 3.732
377 HG LEU 52 HG LEU 52 -1.614 0.891 4.240
378 HD11 LEU 52 HD11 LEU 52 -1.435 0.634 1.820
379 HD12 LEU 52 HD12 LEU 52 -3.183 0.791 1.664
380 HD13 LEU 52 HD13 LEU 52 -2.494 -0.594 2.511
381 HD21 LEU 52 HD21 LEU 52 -3.029 3.092 2.742
382 HD22 LEU 52 HD22 LEU 52 -1.282 2.876 2.856
383 HD23 LEU 52 HD23 LEU 52 -2.221 3.252 4.301
384 H GLU 53 HN GLU 53 -4.701 -0.556 6.747
385 HA GLU 53 HA GLU 53 -7.457 -0.223 6.428
386 HB2 GLU 53 HB2 GLU 53 -5.934 -2.013 8.328
387 HB3 GLU 53 HB1 GLU 53 -7.671 -2.104 8.075
388 HG2 GLU 53 HG2 GLU 53 -7.287 -2.588 5.703
389 HG3 GLU 53 HG1 GLU 53 -5.548 -2.553 5.993
390 H SER 54 HN SER 54 -5.552 0.064 9.433
391 HA SER 54 HA SER 54 -7.735 0.877 11.026
392 HB2 SER 54 HB2 SER 54 -4.788 1.375 11.492
393 HB3 SER 54 HB1 SER 54 -6.059 1.400 12.716
394 HG SER 54 HG SER 54 -6.435 -0.850 12.120
395 H ARG 55 HN ARG 55 -5.814 2.576 8.776
396 HA ARG 55 HA ARG 55 -6.059 5.174 10.006
397 HB2 ARG 55 HB2 ARG 55 -4.095 4.484 8.680
398 HB3 ARG 55 HB1 ARG 55 -5.110 4.357 7.255
399 HG2 ARG 55 HG2 ARG 55 -5.456 6.725 7.212
400 HG3 ARG 55 HG1 ARG 55 -4.646 6.916 8.773
401 HD2 ARG 55 HD2 ARG 55 -2.560 6.167 7.842
402 HD3 ARG 55 HD1 ARG 55 -3.335 5.776 6.313
403 HE ARG 55 HE ARG 55 -3.799 8.340 6.330
404 HH11 ARG 55 HH11 ARG 55 -0.950 6.773 7.594
405 HH12 ARG 55 HH12 ARG 55 0.146 8.024 7.088
406 HH21 ARG 55 HH21 ARG 55 -2.362 10.011 5.641
407 HH22 ARG 55 HH22 ARG 55 -0.667 9.855 5.983
408 H TYR 56 HN TYR 56 -7.432 3.526 7.176
409 HA TYR 56 HA TYR 56 -9.201 5.819 6.734
410 HB2 TYR 56 HB2 TYR 56 -8.509 3.477 4.959
411 HB3 TYR 56 HB1 TYR 56 -9.632 4.762 4.525
412 HD1 TYR 56 HD2 TYR 56 -8.801 7.062 4.169
413 HD2 TYR 56 HD1 TYR 56 -6.152 3.820 4.895
414 HE1 TYR 56 HE2 TYR 56 -6.935 8.406 3.300
415 HE2 TYR 56 HE1 TYR 56 -4.272 5.146 4.028
416 HH TYR 56 HH TYR 56 -4.469 8.487 3.505
417 H GLY 57 HN GLY 57 -9.265 2.795 8.190
418 HA2 GLY 57 HA2 GLY 57 -11.039 1.699 9.199
419 HA3 GLY 57 HA1 GLY 57 -12.109 2.944 8.569
420 H VAL 58 HN VAL 58 -9.972 0.549 7.036
421 HA VAL 58 HA VAL 58 -12.300 -0.397 5.495
422 HB VAL 58 HB VAL 58 -10.811 -0.861 3.595
423 HG11 VAL 58 HG11 VAL 58 -11.977 1.253 3.605
424 HG12 VAL 58 HG12 VAL 58 -10.363 1.470 2.922
425 HG13 VAL 58 HG13 VAL 58 -10.696 1.984 4.576
426 HG21 VAL 58 HG21 VAL 58 -8.528 0.061 3.558
427 HG22 VAL 58 HG22 VAL 58 -8.715 -1.195 4.783
428 HG23 VAL 58 HG23 VAL 58 -8.693 0.503 5.256
429 H SER 59 HN SER 59 -11.335 -2.557 4.269
430 HA SER 59 HA SER 59 -9.816 -4.201 6.109
431 HB2 SER 59 HB2 SER 59 -12.598 -4.956 5.155
432 HB3 SER 59 HB1 SER 59 -11.513 -6.003 6.065
433 HG SER 59 HG SER 59 -11.709 -3.736 7.412
434 H ILE 60 HN ILE 60 -8.297 -5.134 4.908
435 HA ILE 60 HA ILE 60 -8.650 -5.230 2.014
436 HB ILE 60 HB ILE 60 -6.197 -5.796 3.684
437 HG12 ILE 60 HG12 ILE 60 -6.975 -3.355 2.063
438 HG13 ILE 60 HG11 ILE 60 -6.987 -3.456 3.821
439 HG21 ILE 60 HG21 ILE 60 -4.980 -5.585 1.555
440 HG22 ILE 60 HG22 ILE 60 -6.524 -5.468 0.707
441 HG23 ILE 60 HG23 ILE 60 -6.095 -6.952 1.561
442 HD11 ILE 60 HD11 ILE 60 -5.024 -2.286 3.026
443 HD12 ILE 60 HD12 ILE 60 -4.562 -3.685 2.058
444 HD13 ILE 60 HD13 ILE 60 -4.571 -3.795 3.818
445 HA PRO 61 HA PRO 61 -9.906 -9.514 2.078
446 HB2 PRO 61 HB2 PRO 61 -8.975 -9.352 -0.741
447 HB3 PRO 61 HB1 PRO 61 -10.527 -9.896 -0.094
448 HG2 PRO 61 HG2 PRO 61 -10.309 -7.525 -1.288
449 HG3 PRO 61 HG1 PRO 61 -11.341 -7.738 0.139
450 HD2 PRO 61 HD2 PRO 61 -8.634 -6.489 -0.078
451 HD3 PRO 61 HD1 PRO 61 -10.022 -6.011 0.921
452 H ASP 62 HN ASP 62 -8.812 -11.237 2.671
453 HA ASP 62 HA ASP 62 -6.050 -11.259 2.998
454 HB2 ASP 62 HB2 ASP 62 -7.280 -12.649 4.433
455 HB3 ASP 62 HB1 ASP 62 -8.144 -13.417 3.108
456 H ASP 63 HN ASP 63 -7.969 -13.025 0.546
457 HA ASP 63 HA ASP 63 -5.571 -14.252 -0.483
458 HB2 ASP 63 HB2 ASP 63 -7.796 -15.416 -0.400
459 HB3 ASP 63 HB1 ASP 63 -8.336 -14.346 -1.691
460 H VAL 64 HN VAL 64 -7.578 -11.536 -1.348
461 HA VAL 64 HA VAL 64 -6.591 -11.288 -4.023
462 HB VAL 64 HB VAL 64 -7.888 -9.155 -2.309
463 HG11 VAL 64 HG11 VAL 64 -6.718 -8.275 -4.271
464 HG12 VAL 64 HG12 VAL 64 -8.466 -8.093 -4.421
465 HG13 VAL 64 HG13 VAL 64 -7.634 -9.372 -5.307
466 HG21 VAL 64 HG21 VAL 64 -9.158 -11.092 -4.246
467 HG22 VAL 64 HG22 VAL 64 -9.981 -9.782 -3.398
468 HG23 VAL 64 HG23 VAL 64 -9.309 -11.134 -2.488
469 H ALA 65 HN ALA 65 -5.697 -9.989 -0.885
470 HA ALA 65 HA ALA 65 -3.850 -8.053 -1.763
471 HB1 ALA 65 HB1 ALA 65 -3.048 -8.046 0.528
472 HB2 ALA 65 HB2 ALA 65 -3.912 -9.550 0.849
473 HB3 ALA 65 HB3 ALA 65 -4.810 -8.078 0.481
474 H GLY 66 HN GLY 66 -3.663 -11.457 -1.771
475 HA2 GLY 66 HA2 GLY 66 -0.756 -11.528 -1.608
476 HA3 GLY 66 HA1 GLY 66 -1.825 -12.908 -1.823
477 H ARG 67 HN ARG 67 -3.053 -10.950 -4.003
478 HA ARG 67 HA ARG 67 -1.427 -12.142 -6.130
479 HB2 ARG 67 HB2 ARG 67 -4.127 -10.808 -6.356
480 HB3 ARG 67 HB1 ARG 67 -3.314 -11.755 -7.593
481 HG2 ARG 67 HG2 ARG 67 -3.505 -13.752 -6.190
482 HG3 ARG 67 HG1 ARG 67 -4.329 -12.791 -4.957
483 HD2 ARG 67 HD2 ARG 67 -6.052 -12.223 -6.685
484 HD3 ARG 67 HD1 ARG 67 -5.278 -13.399 -7.748
485 HE ARG 67 HE ARG 67 -5.865 -14.602 -5.258
486 HH11 ARG 67 HH11 ARG 67 -7.356 -13.522 -8.223
487 HH12 ARG 67 HH12 ARG 67 -8.759 -14.536 -8.047
488 HH21 ARG 67 HH21 ARG 67 -7.707 -15.937 -5.000
489 HH22 ARG 67 HH22 ARG 67 -8.947 -15.931 -6.227
490 H VAL 68 HN VAL 68 -1.707 -9.232 -4.538
491 HA VAL 68 HA VAL 68 -1.272 -7.582 -6.902
492 HB VAL 68 HB VAL 68 -1.221 -5.664 -5.274
493 HG11 VAL 68 HG11 VAL 68 -3.240 -6.250 -6.470
494 HG12 VAL 68 HG12 VAL 68 -3.636 -5.722 -4.836
495 HG13 VAL 68 HG13 VAL 68 -3.655 -7.440 -5.237
496 HG21 VAL 68 HG21 VAL 68 -0.529 -6.845 -3.272
497 HG22 VAL 68 HG22 VAL 68 -2.008 -7.806 -3.299
498 HG23 VAL 68 HG23 VAL 68 -2.089 -6.066 -3.009
499 H ASP 69 HN ASP 69 0.691 -7.695 -7.714
500 HA ASP 69 HA ASP 69 3.010 -7.948 -5.973
501 HB2 ASP 69 HB2 ASP 69 4.266 -8.273 -8.063
502 HB3 ASP 69 HB1 ASP 69 2.881 -9.355 -7.984
503 H THR 70 HN THR 70 1.196 -5.537 -7.426
504 HA THR 70 HA THR 70 3.375 -3.592 -7.100
505 HB THR 70 HB THR 70 2.290 -2.312 -9.016
506 HG1 THR 70 HG1 THR 70 1.153 -4.880 -9.530
507 HG21 THR 70 HG21 THR 70 3.616 -4.958 -9.612
508 HG22 THR 70 HG22 THR 70 4.426 -3.417 -9.320
509 HG23 THR 70 HG23 THR 70 3.434 -3.632 -10.761
510 HA PRO 71 HA PRO 71 0.557 -1.421 -4.423
511 HB2 PRO 71 HB2 PRO 71 1.887 0.997 -5.537
512 HB3 PRO 71 HB1 PRO 71 1.684 0.501 -3.855
513 HG2 PRO 71 HG2 PRO 71 4.046 0.301 -5.069
514 HG3 PRO 71 HG1 PRO 71 3.497 -0.938 -3.921
515 HD2 PRO 71 HD2 PRO 71 3.584 -1.012 -6.906
516 HD3 PRO 71 HD1 PRO 71 3.895 -2.310 -5.733
517 H ARG 72 HN ARG 72 0.983 -0.688 -7.786
518 HA ARG 72 HA ARG 72 -0.946 1.208 -8.308
519 HB2 ARG 72 HB2 ARG 72 0.668 0.145 -9.932
520 HB3 ARG 72 HB1 ARG 72 -0.410 -1.238 -9.999
521 HG2 ARG 72 HG2 ARG 72 -0.825 0.133 -11.907
522 HG3 ARG 72 HG1 ARG 72 -2.210 0.271 -10.820
523 HD2 ARG 72 HD2 ARG 72 -1.583 2.454 -11.696
524 HD3 ARG 72 HD1 ARG 72 -1.313 2.371 -9.955
525 HE ARG 72 HE ARG 72 1.068 1.660 -11.201
526 HH11 ARG 72 HH11 ARG 72 -0.981 4.500 -11.090
527 HH12 ARG 72 HH12 ARG 72 0.356 5.615 -11.106
528 HH21 ARG 72 HH21 ARG 72 2.822 3.135 -11.252
529 HH22 ARG 72 HH22 ARG 72 2.516 4.842 -11.195
530 H GLU 73 HN GLU 73 -1.369 -2.327 -8.361
531 HA GLU 73 HA GLU 73 -4.164 -2.279 -8.793
532 HB2 GLU 73 HB2 GLU 73 -2.365 -4.455 -7.705
533 HB3 GLU 73 HB1 GLU 73 -4.050 -4.694 -8.144
534 HG2 GLU 73 HG2 GLU 73 -1.870 -3.811 -10.012
535 HG3 GLU 73 HG1 GLU 73 -2.509 -5.448 -9.880
536 H LEU 74 HN LEU 74 -2.196 -2.455 -5.878
537 HA LEU 74 HA LEU 74 -4.193 -3.187 -4.045
538 HB2 LEU 74 HB2 LEU 74 -1.547 -2.864 -3.871
539 HB3 LEU 74 HB1 LEU 74 -2.032 -1.320 -3.202
540 HG LEU 74 HG LEU 74 -2.934 -3.995 -2.124
541 HD11 LEU 74 HD11 LEU 74 -0.555 -3.769 -1.814
542 HD12 LEU 74 HD12 LEU 74 -1.373 -3.513 -0.270
543 HD13 LEU 74 HD13 LEU 74 -0.758 -2.134 -1.187
544 HD21 LEU 74 HD21 LEU 74 -3.635 -2.687 -0.178
545 HD22 LEU 74 HD22 LEU 74 -4.485 -2.188 -1.641
546 HD23 LEU 74 HD23 LEU 74 -3.164 -1.205 -1.010
547 H LEU 75 HN LEU 75 -2.957 0.053 -4.895
548 HA LEU 75 HA LEU 75 -4.760 1.526 -3.338
549 HB2 LEU 75 HB2 LEU 75 -2.722 2.447 -4.399
550 HB3 LEU 75 HB1 LEU 75 -3.496 2.320 -5.967
551 HG LEU 75 HG LEU 75 -5.232 3.927 -5.196
552 HD11 LEU 75 HD11 LEU 75 -5.086 3.527 -2.804
553 HD12 LEU 75 HD12 LEU 75 -4.818 5.232 -3.170
554 HD13 LEU 75 HD13 LEU 75 -3.452 4.189 -2.780
555 HD21 LEU 75 HD21 LEU 75 -3.807 5.908 -5.316
556 HD22 LEU 75 HD22 LEU 75 -3.308 4.688 -6.488
557 HD23 LEU 75 HD23 LEU 75 -2.388 4.908 -5.001
558 H ASP 76 HN ASP 76 -4.944 0.476 -6.716
559 HA ASP 76 HA ASP 76 -7.328 1.707 -7.460
560 HB2 ASP 76 HB2 ASP 76 -5.736 0.551 -8.997
561 HB3 ASP 76 HB1 ASP 76 -6.311 -0.992 -8.378
562 H LEU 77 HN LEU 77 -6.753 -1.388 -5.896
563 HA LEU 77 HA LEU 77 -9.373 -2.378 -5.946
564 HB2 LEU 77 HB2 LEU 77 -7.497 -3.807 -5.450
565 HB3 LEU 77 HB1 LEU 77 -7.104 -2.868 -4.022
566 HG LEU 77 HG LEU 77 -9.247 -3.597 -2.994
567 HD11 LEU 77 HD11 LEU 77 -9.432 -5.412 -5.391
568 HD12 LEU 77 HD12 LEU 77 -10.478 -4.030 -5.063
569 HD13 LEU 77 HD13 LEU 77 -10.496 -5.427 -3.985
570 HD21 LEU 77 HD21 LEU 77 -8.529 -5.875 -2.509
571 HD22 LEU 77 HD22 LEU 77 -7.158 -4.765 -2.509
572 HD23 LEU 77 HD23 LEU 77 -7.432 -5.831 -3.887
573 H ILE 78 HN ILE 78 -7.643 -0.724 -3.297
574 HA ILE 78 HA ILE 78 -9.814 -0.703 -1.515
575 HB ILE 78 HB ILE 78 -7.451 1.183 -1.605
576 HG12 ILE 78 HG12 ILE 78 -7.887 -1.393 -0.074
577 HG13 ILE 78 HG11 ILE 78 -6.835 -1.209 -1.471
578 HG21 ILE 78 HG21 ILE 78 -9.285 2.048 -0.233
579 HG22 ILE 78 HG22 ILE 78 -7.916 1.561 0.766
580 HG23 ILE 78 HG23 ILE 78 -9.339 0.526 0.656
581 HD11 ILE 78 HD11 ILE 78 -6.498 0.107 1.215
582 HD12 ILE 78 HD12 ILE 78 -5.467 0.383 -0.191
583 HD13 ILE 78 HD13 ILE 78 -5.538 -1.215 0.553
584 H ASN 79 HN ASN 79 -8.697 1.704 -3.860
585 HA ASN 79 HA ASN 79 -10.527 3.737 -3.253
586 HB2 ASN 79 HB2 ASN 79 -9.149 2.962 -5.818
587 HB3 ASN 79 HB1 ASN 79 -10.235 4.345 -5.733
588 HD21 ASN 79 HD21 ASN 79 -9.418 4.945 -2.974
589 HD22 ASN 79 HD22 ASN 79 -7.853 5.677 -3.097
590 H GLY 80 HN GLY 80 -10.797 1.046 -5.573
591 HA2 GLY 80 HA2 GLY 80 -13.349 1.730 -6.559
592 HA3 GLY 80 HA1 GLY 80 -12.624 0.131 -6.629
593 H ALA 81 HN ALA 81 -12.368 -0.153 -3.764
594 HA ALA 81 HA ALA 81 -14.942 -1.223 -3.212
595 HB1 ALA 81 HB1 ALA 81 -12.872 -2.225 -2.350
596 HB2 ALA 81 HB2 ALA 81 -14.012 -1.853 -1.056
597 HB3 ALA 81 HB3 ALA 81 -12.620 -0.805 -1.333
598 H LEU 82 HN LEU 82 -13.262 1.714 -2.332
599 HA LEU 82 HA LEU 82 -15.235 2.549 -0.418
600 HB2 LEU 82 HB2 LEU 82 -12.941 4.002 -1.731
601 HB3 LEU 82 HB1 LEU 82 -13.979 4.723 -0.516
602 HG LEU 82 HG LEU 82 -12.224 2.298 -0.088
603 HD11 LEU 82 HD11 LEU 82 -11.908 5.145 0.858
604 HD12 LEU 82 HD12 LEU 82 -10.904 4.329 -0.343
605 HD13 LEU 82 HD13 LEU 82 -10.893 3.782 1.334
606 HD21 LEU 82 HD21 LEU 82 -12.796 2.606 2.276
607 HD22 LEU 82 HD22 LEU 82 -14.213 2.233 1.297
608 HD23 LEU 82 HD23 LEU 82 -13.921 3.888 1.829
609 H ALA 83 HN ALA 83 -14.734 2.859 -3.821
610 HA ALA 83 HA ALA 83 -16.303 5.142 -4.322
611 HB1 ALA 83 HB1 ALA 83 -14.724 4.200 -5.938
612 HB2 ALA 83 HB2 ALA 83 -16.335 4.386 -6.632
613 HB3 ALA 83 HB3 ALA 83 -15.765 2.792 -6.134
614 H GLU 84 HN GLU 84 -17.122 1.767 -3.885
615 HA GLU 84 HA GLU 84 -19.912 2.270 -4.614
616 HB2 GLU 84 HB2 GLU 84 -18.536 -0.299 -3.805
617 HB3 GLU 84 HB1 GLU 84 -20.198 -0.163 -4.355
618 HG2 GLU 84 HG2 GLU 84 -19.326 0.701 -6.526
619 HG3 GLU 84 HG1 GLU 84 -17.699 0.335 -5.950
620 H ALA 85 HN ALA 85 -18.166 2.833 -1.965
621 HA ALA 85 HA ALA 85 -19.797 1.472 0.004
622 HB1 ALA 85 HB1 ALA 85 -17.410 1.740 0.425
623 HB2 ALA 85 HB2 ALA 85 -18.360 2.569 1.659
624 HB3 ALA 85 HB3 ALA 85 -17.587 3.491 0.371
625 H ALA 86 HN ALA 86 -21.730 2.217 0.502
626 HA ALA 86 HA ALA 86 -22.050 5.079 1.030
627 HB1 ALA 86 HB1 ALA 86 -24.245 5.085 -0.073
628 HB2 ALA 86 HB2 ALA 86 -23.986 3.421 -0.599
629 HB3 ALA 86 HB3 ALA 86 -22.952 4.711 -1.213
630 H28 SXO 87 H28B SXO 87 6.444 -11.483 6.447
631 H28A SXO 87 H28A SXO 87 7.519 -12.257 7.612
632 H30 SXO 87 H30A SXO 87 3.970 -12.534 8.792
633 H30A SXO 87 H30C SXO 87 5.479 -11.659 9.046
634 H30B SXO 87 H30B SXO 87 4.473 -11.295 7.643
635 H31 SXO 87 H31A SXO 87 5.222 -14.391 5.798
636 H31A SXO 87 H31B SXO 87 4.297 -12.889 5.780
637 H31B SXO 87 H31C SXO 87 3.820 -14.205 6.853
638 H32 SXO 87 H32A SXO 87 6.559 -13.885 9.262
639 HO33 SXO 87 H33A SXO 87 6.554 -16.030 7.620
640 HN36 SXO 87 H36A SXO 87 4.188 -13.628 10.007
641 H37 SXO 87 H37A SXO 87 2.710 -16.183 9.837
642 H37A SXO 87 H37B SXO 87 2.998 -15.352 11.364
643 H38 SXO 87 H38B SXO 87 1.794 -13.361 10.356
644 H38A SXO 87 H38A SXO 87 0.812 -14.771 10.761
645 HN41 SXO 87 H41A SXO 87 0.250 -12.638 8.940
646 H42 SXO 87 H42A SXO 87 0.513 -13.492 6.232
647 H42A SXO 87 H42B SXO 87 -1.077 -13.876 6.896
648 H43 SXO 87 H43B SXO 87 -1.470 -11.533 7.396
649 H43A SXO 87 H43A SXO 87 0.163 -11.122 6.832
650 H2 SXO 87 H2A SXO 87 -2.624 -8.415 4.006
651 H2A SXO 87 H2B SXO 87 -3.142 -10.040 3.567
652 H3 SXO 87 H3B SXO 87 -0.925 -10.431 2.542
653 H3A SXO 87 H3A SXO 87 -1.809 -9.105 1.785
654 H4 SXO 87 H4A SXO 87 0.593 -8.601 2.140
655 H4A SXO 87 H4B SXO 87 0.344 -8.776 3.876
656 H5 SXO 87 H5B SXO 87 -1.334 -6.950 3.778
657 H5A SXO 87 H5A SXO 87 0.284 -6.430 3.308
658 H6 SXO 87 H6A SXO 87 -1.911 -7.185 1.380
659 H6A SXO 87 H6B SXO 87 -0.319 -6.551 0.967
660 H7 SXO 87 H7A SXO 87 -2.413 -5.077 2.574
661 H7A SXO 87 H7B SXO 87 -2.058 -4.806 0.860
662 H8 SXO 87 H8C SXO 87 -0.135 -4.440 3.156
663 H8A SXO 87 H8A SXO 87 -0.938 -3.150 2.264
664 H8B SXO 87 H8B SXO 87 0.237 -4.183 1.453
Start of MODEL 12
1 H1 MET 1 HT1 MET 1 -20.212 10.535 -0.813
2 H2 MET 1 HT2 MET 1 -19.912 11.327 0.656
3 H3 MET 1 HT3 MET 1 -19.471 9.703 0.465
4 HA MET 1 HA MET 1 -17.886 10.306 -1.247
5 HB2 MET 1 HB2 MET 1 -18.998 12.353 -2.009
6 HB3 MET 1 HB1 MET 1 -18.664 13.125 -0.467
7 HG2 MET 1 HG2 MET 1 -16.267 12.980 -0.911
8 HG3 MET 1 HG1 MET 1 -16.601 12.212 -2.463
9 HE1 MET 1 HE1 MET 1 -14.778 14.820 -2.099
10 HE2 MET 1 HE2 MET 1 -15.326 15.792 -3.467
11 HE3 MET 1 HE3 MET 1 -15.080 14.053 -3.655
12 H ALA 2 HN ALA 2 -16.559 9.239 0.140
13 HA ALA 2 HA ALA 2 -15.643 10.659 2.543
14 HB1 ALA 2 HB1 ALA 2 -16.490 8.371 2.854
15 HB2 ALA 2 HB2 ALA 2 -14.789 8.510 3.297
16 HB3 ALA 2 HB3 ALA 2 -15.242 7.768 1.763
17 H THR 3 HN THR 3 -13.265 10.235 3.062
18 HA THR 3 HA THR 3 -11.671 11.254 0.923
19 HB THR 3 HB THR 3 -9.802 10.981 2.622
20 HG1 THR 3 HG1 THR 3 -10.883 9.261 3.796
21 HG21 THR 3 HG21 THR 3 -10.990 13.095 2.391
22 HG22 THR 3 HG22 THR 3 -10.651 12.780 4.094
23 HG23 THR 3 HG23 THR 3 -12.272 12.514 3.451
24 H LEU 4 HN LEU 4 -11.147 9.923 -0.700
25 HA LEU 4 HA LEU 4 -10.756 7.105 -0.325
26 HB2 LEU 4 HB2 LEU 4 -10.162 8.821 -2.736
27 HB3 LEU 4 HB1 LEU 4 -10.242 7.070 -2.713
28 HG LEU 4 HG LEU 4 -12.563 8.934 -2.196
29 HD11 LEU 4 HD11 LEU 4 -11.945 7.192 -4.572
30 HD12 LEU 4 HD12 LEU 4 -11.835 8.950 -4.523
31 HD13 LEU 4 HD13 LEU 4 -13.402 8.160 -4.341
32 HD21 LEU 4 HD21 LEU 4 -13.934 6.903 -2.289
33 HD22 LEU 4 HD22 LEU 4 -12.791 6.862 -0.946
34 HD23 LEU 4 HD23 LEU 4 -12.469 5.926 -2.406
35 H LEU 5 HN LEU 5 -8.723 6.103 -1.372
36 HA LEU 5 HA LEU 5 -6.475 7.047 0.176
37 HB2 LEU 5 HB2 LEU 5 -7.332 4.568 -0.517
38 HB3 LEU 5 HB1 LEU 5 -6.127 4.828 -1.759
39 HG LEU 5 HG LEU 5 -5.638 4.878 1.225
40 HD11 LEU 5 HD11 LEU 5 -4.761 2.934 -0.899
41 HD12 LEU 5 HD12 LEU 5 -6.033 2.654 0.292
42 HD13 LEU 5 HD13 LEU 5 -4.361 2.858 0.818
43 HD21 LEU 5 HD21 LEU 5 -4.178 6.463 0.065
44 HD22 LEU 5 HD22 LEU 5 -3.677 5.188 -1.047
45 HD23 LEU 5 HD23 LEU 5 -3.275 5.071 0.666
46 H THR 6 HN THR 6 -4.879 8.315 -0.577
47 HA THR 6 HA THR 6 -4.774 8.762 -3.475
48 HB THR 6 HB THR 6 -3.699 10.919 -2.979
49 HG1 THR 6 HG1 THR 6 -4.388 10.845 -0.284
50 HG21 THR 6 HG21 THR 6 -6.320 10.463 -1.550
51 HG22 THR 6 HG22 THR 6 -6.107 10.874 -3.252
52 HG23 THR 6 HG23 THR 6 -5.672 12.040 -2.003
53 H THR 7 HN THR 7 -2.585 9.424 -4.296
54 HA THR 7 HA THR 7 -0.715 7.387 -3.985
55 HB THR 7 HB THR 7 0.827 9.299 -5.006
56 HG1 THR 7 HG1 THR 7 -0.248 11.061 -5.533
57 HG21 THR 7 HG21 THR 7 -0.055 8.713 -7.210
58 HG22 THR 7 HG22 THR 7 -1.507 8.052 -6.457
59 HG23 THR 7 HG23 THR 7 0.060 7.290 -6.171
60 H ASP 8 HN ASP 8 -0.471 10.749 -2.822
61 HA ASP 8 HA ASP 8 2.000 10.392 -1.534
62 HB2 ASP 8 HB2 ASP 8 -0.158 12.468 -1.188
63 HB3 ASP 8 HB1 ASP 8 1.366 12.528 -0.309
64 H ASP 9 HN ASP 9 -1.296 9.940 -0.421
65 HA ASP 9 HA ASP 9 -0.775 9.667 2.340
66 HB2 ASP 9 HB2 ASP 9 -3.044 9.719 0.981
67 HB3 ASP 9 HB1 ASP 9 -2.832 7.975 0.972
68 H LEU 10 HN LEU 10 -0.966 7.303 -0.288
69 HA LEU 10 HA LEU 10 -0.259 5.022 1.165
70 HB2 LEU 10 HB2 LEU 10 -1.197 4.983 -1.112
71 HB3 LEU 10 HB1 LEU 10 0.299 5.650 -1.735
72 HG LEU 10 HG LEU 10 1.496 3.614 -1.013
73 HD11 LEU 10 HD11 LEU 10 -1.255 2.639 -0.267
74 HD12 LEU 10 HD12 LEU 10 0.079 2.954 0.842
75 HD13 LEU 10 HD13 LEU 10 0.199 1.646 -0.336
76 HD21 LEU 10 HD21 LEU 10 0.540 2.113 -2.705
77 HD22 LEU 10 HD22 LEU 10 0.658 3.773 -3.289
78 HD23 LEU 10 HD23 LEU 10 -0.900 3.128 -2.777
79 H ARG 11 HN ARG 11 1.735 7.366 -0.585
80 HA ARG 11 HA ARG 11 4.228 6.209 -0.294
81 HB2 ARG 11 HB2 ARG 11 3.901 8.185 -1.641
82 HB3 ARG 11 HB1 ARG 11 3.449 9.126 -0.228
83 HG2 ARG 11 HG2 ARG 11 5.727 8.866 0.655
84 HG3 ARG 11 HG1 ARG 11 6.173 7.964 -0.796
85 HD2 ARG 11 HD2 ARG 11 5.047 10.753 -0.908
86 HD3 ARG 11 HD1 ARG 11 6.771 10.443 -0.729
87 HE ARG 11 HE ARG 11 6.533 9.148 -2.888
88 HH11 ARG 11 HH11 ARG 11 4.437 11.843 -2.082
89 HH12 ARG 11 HH12 ARG 11 4.174 12.304 -3.727
90 HH21 ARG 11 HH21 ARG 11 6.206 9.763 -5.074
91 HH22 ARG 11 HH22 ARG 11 5.183 11.115 -5.433
92 H ARG 12 HN ARG 12 2.412 8.184 2.024
93 HA ARG 12 HA ARG 12 4.495 8.276 3.966
94 HB2 ARG 12 HB2 ARG 12 1.513 8.692 4.224
95 HB3 ARG 12 HB1 ARG 12 2.664 8.987 5.518
96 HG2 ARG 12 HG2 ARG 12 2.547 10.418 2.868
97 HG3 ARG 12 HG1 ARG 12 2.073 11.059 4.441
98 HD2 ARG 12 HD2 ARG 12 4.848 10.192 3.659
99 HD3 ARG 12 HD1 ARG 12 4.283 11.857 3.759
100 HE ARG 12 HE ARG 12 4.051 10.256 6.179
101 HH11 ARG 12 HH11 ARG 12 5.876 12.645 4.369
102 HH12 ARG 12 HH12 ARG 12 6.739 13.223 5.763
103 HH21 ARG 12 HH21 ARG 12 5.192 11.022 8.013
104 HH22 ARG 12 HH22 ARG 12 6.347 12.306 7.826
105 H ALA 13 HN ALA 13 1.870 6.048 3.307
106 HA ALA 13 HA ALA 13 1.915 4.625 5.740
107 HB1 ALA 13 HB1 ALA 13 0.730 2.874 4.540
108 HB2 ALA 13 HB2 ALA 13 1.151 3.627 3.002
109 HB3 ALA 13 HB3 ALA 13 0.081 4.462 4.128
110 H LEU 14 HN LEU 14 3.748 4.246 2.740
111 HA LEU 14 HA LEU 14 5.082 1.859 3.461
112 HB2 LEU 14 HB2 LEU 14 5.629 4.053 1.490
113 HB3 LEU 14 HB1 LEU 14 6.877 2.865 1.814
114 HG LEU 14 HG LEU 14 5.731 2.148 -0.139
115 HD11 LEU 14 HD11 LEU 14 4.738 0.000 0.561
116 HD12 LEU 14 HD12 LEU 14 4.751 0.568 2.231
117 HD13 LEU 14 HD13 LEU 14 6.272 0.342 1.366
118 HD21 LEU 14 HD21 LEU 14 3.300 1.767 -0.201
119 HD22 LEU 14 HD22 LEU 14 3.712 3.464 0.044
120 HD23 LEU 14 HD23 LEU 14 3.162 2.486 1.404
121 H VAL 15 HN VAL 15 5.842 5.270 3.936
122 HA VAL 15 HA VAL 15 8.397 4.953 5.060
123 HB VAL 15 HB VAL 15 6.349 7.129 5.540
124 HG11 VAL 15 HG11 VAL 15 9.297 7.122 6.204
125 HG12 VAL 15 HG12 VAL 15 7.982 7.048 7.375
126 HG13 VAL 15 HG13 VAL 15 8.194 8.487 6.379
127 HG21 VAL 15 HG21 VAL 15 7.051 6.966 3.234
128 HG22 VAL 15 HG22 VAL 15 8.747 6.962 3.724
129 HG23 VAL 15 HG23 VAL 15 7.758 8.401 3.978
130 H GLU 16 HN GLU 16 5.210 5.176 6.605
131 HA GLU 16 HA GLU 16 6.111 4.918 9.254
132 HB2 GLU 16 HB2 GLU 16 3.465 4.269 7.966
133 HB3 GLU 16 HB1 GLU 16 3.735 4.168 9.703
134 HG2 GLU 16 HG2 GLU 16 4.165 6.497 9.852
135 HG3 GLU 16 HG1 GLU 16 4.209 6.661 8.097
136 H SER 17 HN SER 17 5.898 2.603 6.753
137 HA SER 17 HA SER 17 5.791 0.314 8.513
138 HB2 SER 17 HB2 SER 17 6.355 0.451 5.540
139 HB3 SER 17 HB1 SER 17 6.008 -1.012 6.465
140 HG SER 17 HG SER 17 4.263 1.202 6.059
141 H ALA 18 HN ALA 18 8.179 2.439 7.409
142 HA ALA 18 HA ALA 18 10.261 0.643 8.408
143 HB1 ALA 18 HB1 ALA 18 11.771 1.231 6.567
144 HB2 ALA 18 HB2 ALA 18 10.463 2.119 5.785
145 HB3 ALA 18 HB3 ALA 18 10.339 0.375 6.000
146 H GLY 19 HN GLY 19 10.680 3.750 6.750
147 HA2 GLY 19 HA2 GLY 19 10.663 5.868 7.874
148 HA3 GLY 19 HA1 GLY 19 11.058 5.038 9.369
149 H GLU 20 HN GLU 20 13.002 3.516 7.366
150 HA GLU 20 HA GLU 20 15.222 5.304 7.995
151 HB2 GLU 20 HB2 GLU 20 15.413 2.992 8.753
152 HB3 GLU 20 HB1 GLU 20 15.192 2.417 7.107
153 HG2 GLU 20 HG2 GLU 20 17.538 2.363 7.860
154 HG3 GLU 20 HG1 GLU 20 17.283 3.357 6.425
155 H THR 21 HN THR 21 16.469 6.252 6.455
156 HA THR 21 HA THR 21 15.515 6.002 3.674
157 HB THR 21 HB THR 21 17.305 8.191 4.637
158 HG1 THR 21 HG1 THR 21 15.465 8.117 6.066
159 HG21 THR 21 HG21 THR 21 15.165 8.043 2.513
160 HG22 THR 21 HG22 THR 21 16.908 7.990 2.240
161 HG23 THR 21 HG23 THR 21 16.158 9.460 2.865
162 H ASP 22 HN ASP 22 16.822 4.030 3.664
163 HA ASP 22 HA ASP 22 19.631 4.042 3.922
164 HB2 ASP 22 HB2 ASP 22 18.367 1.964 4.077
165 HB3 ASP 22 HB1 ASP 22 17.835 2.128 2.407
166 H GLY 23 HN GLY 23 17.564 4.110 1.036
167 HA2 GLY 23 HA2 GLY 23 18.989 5.981 -0.402
168 HA3 GLY 23 HA1 GLY 23 19.733 4.433 -0.789
169 H THR 24 HN THR 24 16.417 5.631 -0.342
170 HA THR 24 HA THR 24 15.678 4.267 -2.845
171 HB THR 24 HB THR 24 13.935 4.443 -0.385
172 HG1 THR 24 HG1 THR 24 15.551 2.257 -1.295
173 HG21 THR 24 HG21 THR 24 12.665 2.656 -1.519
174 HG22 THR 24 HG22 THR 24 13.756 2.782 -2.900
175 HG23 THR 24 HG23 THR 24 12.718 4.142 -2.470
176 H ASP 25 HN ASP 25 15.016 5.778 -4.279
177 HA ASP 25 HA ASP 25 14.127 8.373 -3.486
178 HB2 ASP 25 HB2 ASP 25 13.940 7.032 -6.198
179 HB3 ASP 25 HB1 ASP 25 13.698 8.746 -5.881
180 H LEU 26 HN LEU 26 12.414 7.495 -2.026
181 HA LEU 26 HA LEU 26 10.036 6.435 -3.275
182 HB2 LEU 26 HB2 LEU 26 10.753 5.766 -0.995
183 HB3 LEU 26 HB1 LEU 26 10.489 7.410 -0.446
184 HG LEU 26 HG LEU 26 8.078 7.172 -0.986
185 HD11 LEU 26 HD11 LEU 26 8.253 5.475 -2.719
186 HD12 LEU 26 HD12 LEU 26 7.178 4.936 -1.428
187 HD13 LEU 26 HD13 LEU 26 8.821 4.302 -1.531
188 HD21 LEU 26 HD21 LEU 26 7.535 5.717 0.894
189 HD22 LEU 26 HD22 LEU 26 8.898 6.769 1.279
190 HD23 LEU 26 HD23 LEU 26 9.176 5.072 0.881
191 H SER 27 HN SER 27 11.372 9.464 -2.925
192 HA SER 27 HA SER 27 9.024 11.018 -2.488
193 HB2 SER 27 HB2 SER 27 10.538 12.886 -3.346
194 HB3 SER 27 HB1 SER 27 11.112 12.018 -1.920
195 HG SER 27 HG SER 27 12.142 12.105 -4.487
196 H GLY 28 HN GLY 28 10.415 9.434 -5.208
197 HA2 GLY 28 HA2 GLY 28 8.791 11.031 -7.067
198 HA3 GLY 28 HA1 GLY 28 10.140 9.997 -7.521
199 H ASP 29 HN ASP 29 9.791 7.880 -7.961
200 HA ASP 29 HA ASP 29 6.977 7.181 -8.345
201 HB2 ASP 29 HB2 ASP 29 8.552 7.168 -10.292
202 HB3 ASP 29 HB1 ASP 29 9.442 5.870 -9.509
203 H PHE 30 HN PHE 30 6.378 4.907 -8.089
204 HA PHE 30 HA PHE 30 7.707 3.107 -6.418
205 HB2 PHE 30 HB2 PHE 30 6.531 3.406 -4.287
206 HB3 PHE 30 HB1 PHE 30 7.451 4.852 -4.679
207 HD1 PHE 30 HD2 PHE 30 6.146 6.802 -5.767
208 HD2 PHE 30 HD1 PHE 30 4.279 3.555 -3.746
209 HE1 PHE 30 HE2 PHE 30 4.118 8.158 -5.469
210 HE2 PHE 30 HE1 PHE 30 2.249 4.910 -3.444
211 HZ PHE 30 HZ PHE 30 2.164 7.216 -4.302
212 H LEU 31 HN LEU 31 4.770 4.485 -7.631
213 HA LEU 31 HA LEU 31 2.885 2.592 -6.905
214 HB2 LEU 31 HB2 LEU 31 3.069 4.469 -9.222
215 HB3 LEU 31 HB1 LEU 31 1.717 3.366 -9.062
216 HG LEU 31 HG LEU 31 2.504 5.516 -7.100
217 HD11 LEU 31 HD11 LEU 31 0.305 6.447 -7.788
218 HD12 LEU 31 HD12 LEU 31 0.235 5.223 -9.055
219 HD13 LEU 31 HD13 LEU 31 1.514 6.440 -9.069
220 HD21 LEU 31 HD21 LEU 31 1.580 3.606 -5.921
221 HD22 LEU 31 HD22 LEU 31 0.220 3.545 -7.042
222 HD23 LEU 31 HD23 LEU 31 0.406 4.922 -5.956
223 H ASP 32 HN ASP 32 4.885 2.637 -9.858
224 HA ASP 32 HA ASP 32 3.467 0.246 -10.751
225 HB2 ASP 32 HB2 ASP 32 3.886 2.282 -12.239
226 HB3 ASP 32 HB1 ASP 32 5.562 1.746 -12.317
227 H LEU 33 HN LEU 33 6.071 0.866 -8.905
228 HA LEU 33 HA LEU 33 7.739 -1.313 -9.861
229 HB2 LEU 33 HB2 LEU 33 7.948 0.518 -7.472
230 HB3 LEU 33 HB1 LEU 33 9.073 -0.791 -7.787
231 HG LEU 33 HG LEU 33 8.604 1.574 -9.605
232 HD11 LEU 33 HD11 LEU 33 9.721 2.234 -7.549
233 HD12 LEU 33 HD12 LEU 33 10.855 2.266 -8.901
234 HD13 LEU 33 HD13 LEU 33 10.894 0.932 -7.746
235 HD21 LEU 33 HD21 LEU 33 9.248 -0.432 -10.832
236 HD22 LEU 33 HD22 LEU 33 10.624 -0.667 -9.754
237 HD23 LEU 33 HD23 LEU 33 10.561 0.741 -10.816
238 H ARG 34 HN ARG 34 7.880 -3.304 -8.909
239 HA ARG 34 HA ARG 34 5.649 -4.187 -7.370
240 HB2 ARG 34 HB2 ARG 34 8.267 -5.593 -7.898
241 HB3 ARG 34 HB1 ARG 34 6.789 -6.346 -7.318
242 HG2 ARG 34 HG2 ARG 34 5.689 -5.910 -9.419
243 HG3 ARG 34 HG1 ARG 34 7.086 -4.994 -9.998
244 HD2 ARG 34 HD2 ARG 34 6.992 -7.940 -9.339
245 HD3 ARG 34 HD1 ARG 34 7.137 -7.216 -10.943
246 HE ARG 34 HE ARG 34 9.255 -6.214 -9.495
247 HH11 ARG 34 HH11 ARG 34 8.152 -9.391 -10.487
248 HH12 ARG 34 HH12 ARG 34 9.745 -10.082 -10.490
249 HH21 ARG 34 HH21 ARG 34 11.334 -7.132 -9.437
250 HH22 ARG 34 HH22 ARG 34 11.557 -8.807 -9.859
251 H PHE 35 HN PHE 35 5.825 -5.221 -5.251
252 HA PHE 35 HA PHE 35 6.886 -3.488 -3.341
253 HB2 PHE 35 HB2 PHE 35 6.049 -6.374 -3.004
254 HB3 PHE 35 HB1 PHE 35 6.292 -5.220 -1.692
255 HD1 PHE 35 HD2 PHE 35 4.904 -3.024 -1.834
256 HD2 PHE 35 HD1 PHE 35 3.961 -6.593 -3.949
257 HE1 PHE 35 HE2 PHE 35 2.566 -2.285 -2.034
258 HE2 PHE 35 HE1 PHE 35 1.624 -5.860 -4.153
259 HZ PHE 35 HZ PHE 35 0.967 -3.594 -3.339
260 H GLU 36 HN GLU 36 8.184 -6.559 -4.584
261 HA GLU 36 HA GLU 36 10.492 -6.601 -2.948
262 HB2 GLU 36 HB2 GLU 36 11.455 -8.082 -4.725
263 HB3 GLU 36 HB1 GLU 36 9.900 -8.605 -4.097
264 HG2 GLU 36 HG2 GLU 36 9.907 -6.908 -6.525
265 HG3 GLU 36 HG1 GLU 36 10.450 -8.576 -6.683
266 H ASP 37 HN ASP 37 9.694 -4.706 -5.742
267 HA ASP 37 HA ASP 37 12.450 -4.181 -6.469
268 HB2 ASP 37 HB2 ASP 37 9.863 -2.973 -7.480
269 HB3 ASP 37 HB1 ASP 37 11.454 -2.564 -8.104
270 H ILE 38 HN ILE 38 9.906 -2.696 -4.602
271 HA ILE 38 HA ILE 38 11.496 -0.285 -4.231
272 HB ILE 38 HB ILE 38 9.636 0.466 -2.741
273 HG12 ILE 38 HG12 ILE 38 8.310 -2.065 -3.733
274 HG13 ILE 38 HG11 ILE 38 8.795 -1.742 -2.075
275 HG21 ILE 38 HG21 ILE 38 8.897 -0.346 -5.544
276 HG22 ILE 38 HG22 ILE 38 9.727 1.136 -5.066
277 HG23 ILE 38 HG23 ILE 38 8.054 0.863 -4.577
278 HD11 ILE 38 HD11 ILE 38 6.416 -1.437 -2.330
279 HD12 ILE 38 HD12 ILE 38 6.675 -0.277 -3.633
280 HD13 ILE 38 HD13 ILE 38 7.184 0.113 -1.990
281 H GLY 39 HN GLY 39 11.668 -3.282 -3.034
282 HA2 GLY 39 HA2 GLY 39 13.053 -4.086 -1.387
283 HA3 GLY 39 HA1 GLY 39 13.442 -2.426 -0.978
284 H TYR 40 HN TYR 40 10.348 -4.238 -0.836
285 HA TYR 40 HA TYR 40 10.360 -3.659 2.050
286 HB2 TYR 40 HB2 TYR 40 8.126 -3.493 0.061
287 HB3 TYR 40 HB1 TYR 40 7.764 -3.851 1.751
288 HD1 TYR 40 HD1 TYR 40 9.256 -1.358 -0.531
289 HD2 TYR 40 HD2 TYR 40 7.888 -2.152 3.417
290 HE1 TYR 40 HE1 TYR 40 9.346 1.046 -0.021
291 HE2 TYR 40 HE2 TYR 40 7.977 0.246 3.941
292 HH TYR 40 HH TYR 40 9.048 2.270 3.167
293 H ASP 41 HN ASP 41 10.418 -5.305 3.334
294 HA ASP 41 HA ASP 41 10.350 -7.999 2.403
295 HB2 ASP 41 HB2 ASP 41 10.377 -6.879 5.216
296 HB3 ASP 41 HB1 ASP 41 10.588 -8.579 4.819
297 H SER 42 HN SER 42 9.012 -9.692 3.445
298 HA SER 42 HA SER 42 6.285 -9.397 3.104
299 HB2 SER 42 HB2 SER 42 6.129 -11.492 4.505
300 HB3 SER 42 HB1 SER 42 7.312 -11.587 3.193
301 H LEU 43 HN LEU 43 8.127 -9.357 6.133
302 HA LEU 43 HA LEU 43 6.021 -8.877 7.893
303 HB2 LEU 43 HB2 LEU 43 8.298 -9.604 8.525
304 HB3 LEU 43 HB1 LEU 43 8.877 -7.983 8.185
305 HG LEU 43 HG LEU 43 7.493 -7.080 9.976
306 HD11 LEU 43 HD11 LEU 43 5.624 -8.634 9.867
307 HD12 LEU 43 HD12 LEU 43 6.292 -8.584 11.498
308 HD13 LEU 43 HD13 LEU 43 6.660 -9.945 10.436
309 HD21 LEU 43 HD21 LEU 43 8.673 -8.087 11.849
310 HD22 LEU 43 HD22 LEU 43 9.750 -7.844 10.475
311 HD23 LEU 43 HD23 LEU 43 9.126 -9.454 10.833
312 H ALA 44 HN ALA 44 8.071 -6.610 6.123
313 HA ALA 44 HA ALA 44 7.048 -4.257 7.313
314 HB1 ALA 44 HB1 ALA 44 9.164 -4.285 6.102
315 HB2 ALA 44 HB2 ALA 44 8.062 -3.098 5.403
316 HB3 ALA 44 HB3 ALA 44 8.313 -4.647 4.601
317 H LEU 45 HN LEU 45 6.147 -6.135 4.485
318 HA LEU 45 HA LEU 45 4.354 -4.291 3.349
319 HB2 LEU 45 HB2 LEU 45 5.336 -6.143 2.104
320 HB3 LEU 45 HB1 LEU 45 4.468 -7.292 3.104
321 HG LEU 45 HG LEU 45 2.333 -6.444 2.209
322 HD11 LEU 45 HD11 LEU 45 4.103 -4.742 0.463
323 HD12 LEU 45 HD12 LEU 45 2.988 -4.172 1.706
324 HD13 LEU 45 HD13 LEU 45 2.363 -4.958 0.253
325 HD21 LEU 45 HD21 LEU 45 2.561 -7.373 -0.046
326 HD22 LEU 45 HD22 LEU 45 3.394 -8.365 1.152
327 HD23 LEU 45 HD23 LEU 45 4.317 -7.290 0.103
328 H MET 46 HN MET 46 3.838 -6.907 5.700
329 HA MET 46 HA MET 46 1.004 -6.698 5.623
330 HB2 MET 46 HB2 MET 46 0.993 -8.098 7.630
331 HB3 MET 46 HB1 MET 46 2.061 -8.747 6.400
332 HG2 MET 46 HG2 MET 46 3.310 -9.048 8.287
333 HG3 MET 46 HG1 MET 46 3.911 -7.489 7.730
334 HE1 MET 46 HE1 MET 46 0.851 -7.982 11.152
335 HE2 MET 46 HE2 MET 46 1.552 -9.340 10.268
336 HE3 MET 46 HE3 MET 46 0.448 -8.232 9.455
337 H GLU 47 HN GLU 47 3.495 -5.110 7.533
338 HA GLU 47 HA GLU 47 1.734 -3.729 9.258
339 HB2 GLU 47 HB2 GLU 47 4.557 -3.278 8.368
340 HB3 GLU 47 HB1 GLU 47 3.719 -2.036 9.289
341 HG2 GLU 47 HG2 GLU 47 4.126 -4.884 10.173
342 HG3 GLU 47 HG1 GLU 47 5.070 -3.494 10.712
343 H THR 48 HN THR 48 3.033 -3.006 6.061
344 HA THR 48 HA THR 48 2.053 -0.422 5.733
345 HB THR 48 HB THR 48 2.205 -2.541 3.578
346 HG1 THR 48 HG1 THR 48 4.156 -1.125 4.983
347 HG21 THR 48 HG21 THR 48 1.042 -0.501 2.887
348 HG22 THR 48 HG22 THR 48 2.610 -0.630 2.087
349 HG23 THR 48 HG23 THR 48 2.400 0.471 3.449
350 H ALA 49 HN ALA 49 0.467 -3.541 5.181
351 HA ALA 49 HA ALA 49 -1.970 -2.657 4.151
352 HB1 ALA 49 HB1 ALA 49 -1.340 -5.017 4.205
353 HB2 ALA 49 HB2 ALA 49 -2.902 -4.770 4.986
354 HB3 ALA 49 HB3 ALA 49 -1.457 -5.018 5.964
355 H ALA 50 HN ALA 50 -0.964 -3.167 7.510
356 HA ALA 50 HA ALA 50 -3.416 -2.536 8.725
357 HB1 ALA 50 HB1 ALA 50 -2.136 -2.322 10.788
358 HB2 ALA 50 HB2 ALA 50 -0.634 -2.294 9.863
359 HB3 ALA 50 HB3 ALA 50 -1.636 -3.746 9.877
360 H ARG 51 HN ARG 51 -0.732 -0.586 7.669
361 HA ARG 51 HA ARG 51 -1.301 1.839 8.923
362 HB2 ARG 51 HB2 ARG 51 -0.168 1.363 6.161
363 HB3 ARG 51 HB1 ARG 51 -0.106 2.880 7.029
364 HG2 ARG 51 HG2 ARG 51 1.177 0.343 7.997
365 HG3 ARG 51 HG1 ARG 51 2.006 1.579 7.054
366 HD2 ARG 51 HD2 ARG 51 2.579 2.061 9.263
367 HD3 ARG 51 HD1 ARG 51 1.292 3.206 8.893
368 HE ARG 51 HE ARG 51 0.607 0.700 10.244
369 HH11 ARG 51 HH11 ARG 51 1.022 4.184 10.387
370 HH12 ARG 51 HH12 ARG 51 0.144 4.347 11.877
371 HH21 ARG 51 HH21 ARG 51 -0.528 0.917 12.203
372 HH22 ARG 51 HH22 ARG 51 -0.774 2.497 12.895
373 H LEU 52 HN LEU 52 -2.495 0.493 5.875
374 HA LEU 52 HA LEU 52 -4.000 2.827 5.184
375 HB2 LEU 52 HB2 LEU 52 -4.201 0.028 4.070
376 HB3 LEU 52 HB1 LEU 52 -4.843 1.486 3.333
377 HG LEU 52 HG LEU 52 -1.909 0.916 3.783
378 HD11 LEU 52 HD11 LEU 52 -3.542 0.854 1.250
379 HD12 LEU 52 HD12 LEU 52 -2.877 -0.548 2.090
380 HD13 LEU 52 HD13 LEU 52 -1.795 0.643 1.366
381 HD21 LEU 52 HD21 LEU 52 -1.566 2.887 2.355
382 HD22 LEU 52 HD22 LEU 52 -2.407 3.290 3.853
383 HD23 LEU 52 HD23 LEU 52 -3.309 3.168 2.341
384 H GLU 53 HN GLU 53 -4.821 -0.396 6.411
385 HA GLU 53 HA GLU 53 -7.583 -0.182 6.480
386 HB2 GLU 53 HB2 GLU 53 -5.828 -1.617 8.481
387 HB3 GLU 53 HB1 GLU 53 -7.535 -1.924 8.190
388 HG2 GLU 53 HG2 GLU 53 -6.987 -2.618 5.894
389 HG3 GLU 53 HG1 GLU 53 -5.277 -2.381 6.248
390 H SER 54 HN SER 54 -5.220 0.647 9.000
391 HA SER 54 HA SER 54 -7.099 1.381 10.960
392 HB2 SER 54 HB2 SER 54 -4.749 0.827 11.471
393 HB3 SER 54 HB1 SER 54 -4.224 2.287 10.643
394 HG SER 54 HG SER 54 -6.124 2.616 12.646
395 H ARG 55 HN ARG 55 -5.589 3.216 8.368
396 HA ARG 55 HA ARG 55 -6.335 5.757 9.460
397 HB2 ARG 55 HB2 ARG 55 -4.338 5.495 8.058
398 HB3 ARG 55 HB1 ARG 55 -5.354 5.066 6.691
399 HG2 ARG 55 HG2 ARG 55 -6.243 7.244 6.533
400 HG3 ARG 55 HG1 ARG 55 -5.598 7.699 8.111
401 HD2 ARG 55 HD2 ARG 55 -3.945 7.016 5.681
402 HD3 ARG 55 HD1 ARG 55 -4.287 8.647 6.262
403 HE ARG 55 HE ARG 55 -3.202 7.554 8.432
404 HH11 ARG 55 HH11 ARG 55 -2.121 7.559 5.078
405 HH12 ARG 55 HH12 ARG 55 -0.450 7.343 5.519
406 HH21 ARG 55 HH21 ARG 55 -1.039 7.287 8.974
407 HH22 ARG 55 HH22 ARG 55 0.180 7.191 7.734
408 H TYR 56 HN TYR 56 -7.533 3.791 6.741
409 HA TYR 56 HA TYR 56 -9.584 5.804 6.238
410 HB2 TYR 56 HB2 TYR 56 -8.705 3.365 4.702
411 HB3 TYR 56 HB1 TYR 56 -10.084 4.352 4.228
412 HD1 TYR 56 HD2 TYR 56 -9.713 6.743 3.584
413 HD2 TYR 56 HD1 TYR 56 -6.499 4.043 4.247
414 HE1 TYR 56 HE2 TYR 56 -8.200 8.261 2.378
415 HE2 TYR 56 HE1 TYR 56 -4.973 5.552 3.051
416 HH TYR 56 HH TYR 56 -5.391 7.474 1.131
417 H GLY 57 HN GLY 57 -9.364 3.187 8.209
418 HA2 GLY 57 HA2 GLY 57 -10.965 1.974 9.345
419 HA3 GLY 57 HA1 GLY 57 -12.178 3.013 8.606
420 H VAL 58 HN VAL 58 -9.833 1.078 6.880
421 HA VAL 58 HA VAL 58 -12.045 -0.500 5.749
422 HB VAL 58 HB VAL 58 -10.627 -0.857 3.761
423 HG11 VAL 58 HG11 VAL 58 -10.815 1.368 2.810
424 HG12 VAL 58 HG12 VAL 58 -11.015 2.055 4.422
425 HG13 VAL 58 HG13 VAL 58 -12.243 0.968 3.768
426 HG21 VAL 58 HG21 VAL 58 -8.738 1.079 5.095
427 HG22 VAL 58 HG22 VAL 58 -8.611 0.504 3.433
428 HG23 VAL 58 HG23 VAL 58 -8.437 -0.628 4.773
429 H SER 59 HN SER 59 -10.725 -2.516 4.559
430 HA SER 59 HA SER 59 -8.643 -3.587 6.214
431 HB2 SER 59 HB2 SER 59 -10.831 -4.209 7.393
432 HB3 SER 59 HB1 SER 59 -11.187 -5.211 5.992
433 HG SER 59 HG SER 59 -8.662 -5.552 7.099
434 H ILE 60 HN ILE 60 -7.407 -4.999 5.081
435 HA ILE 60 HA ILE 60 -8.117 -5.298 2.256
436 HB ILE 60 HB ILE 60 -5.473 -5.791 3.641
437 HG12 ILE 60 HG12 ILE 60 -6.377 -3.470 1.914
438 HG13 ILE 60 HG11 ILE 60 -6.162 -3.417 3.660
439 HG21 ILE 60 HG21 ILE 60 -4.541 -5.844 1.365
440 HG22 ILE 60 HG22 ILE 60 -6.170 -5.695 0.705
441 HG23 ILE 60 HG23 ILE 60 -5.719 -7.133 1.620
442 HD11 ILE 60 HD11 ILE 60 -3.993 -3.920 1.636
443 HD12 ILE 60 HD12 ILE 60 -3.783 -3.847 3.385
444 HD13 ILE 60 HD13 ILE 60 -4.285 -2.409 2.498
445 HA PRO 61 HA PRO 61 -9.331 -9.505 3.302
446 HB2 PRO 61 HB2 PRO 61 -9.584 -9.699 0.360
447 HB3 PRO 61 HB1 PRO 61 -10.784 -10.031 1.615
448 HG2 PRO 61 HG2 PRO 61 -10.944 -7.855 0.059
449 HG3 PRO 61 HG1 PRO 61 -11.423 -7.813 1.766
450 HD2 PRO 61 HD2 PRO 61 -8.922 -6.803 0.471
451 HD3 PRO 61 HD1 PRO 61 -9.873 -6.092 1.789
452 H ASP 62 HN ASP 62 -7.788 -10.935 3.730
453 HA ASP 62 HA ASP 62 -5.268 -10.886 2.449
454 HB2 ASP 62 HB2 ASP 62 -4.765 -12.888 3.879
455 HB3 ASP 62 HB1 ASP 62 -5.284 -11.452 4.744
456 H ASP 63 HN ASP 63 -8.105 -12.328 1.472
457 HA ASP 63 HA ASP 63 -6.951 -14.577 0.104
458 HB2 ASP 63 HB2 ASP 63 -9.622 -13.191 -0.143
459 HB3 ASP 63 HB1 ASP 63 -9.158 -14.541 -1.170
460 H VAL 64 HN VAL 64 -8.296 -11.472 -0.995
461 HA VAL 64 HA VAL 64 -7.197 -11.812 -3.633
462 HB VAL 64 HB VAL 64 -8.407 -9.287 -2.498
463 HG11 VAL 64 HG11 VAL 64 -8.191 -10.329 -5.320
464 HG12 VAL 64 HG12 VAL 64 -7.266 -8.998 -4.627
465 HG13 VAL 64 HG13 VAL 64 -9.011 -8.846 -4.834
466 HG21 VAL 64 HG21 VAL 64 -9.816 -11.623 -3.789
467 HG22 VAL 64 HG22 VAL 64 -10.562 -10.074 -3.394
468 HG23 VAL 64 HG23 VAL 64 -9.958 -11.117 -2.106
469 H ALA 65 HN ALA 65 -5.990 -10.712 -0.695
470 HA ALA 65 HA ALA 65 -4.355 -8.559 -1.445
471 HB1 ALA 65 HB1 ALA 65 -3.166 -8.931 0.622
472 HB2 ALA 65 HB2 ALA 65 -3.843 -10.556 0.745
473 HB3 ALA 65 HB3 ALA 65 -4.896 -9.150 0.882
474 H GLY 66 HN GLY 66 -3.780 -12.023 -1.516
475 HA2 GLY 66 HA2 GLY 66 -1.010 -11.690 -2.297
476 HA3 GLY 66 HA1 GLY 66 -1.873 -13.215 -2.144
477 H ARG 67 HN ARG 67 -2.818 -10.409 -4.041
478 HA ARG 67 HA ARG 67 -2.182 -11.773 -6.546
479 HB2 ARG 67 HB2 ARG 67 -4.959 -10.951 -5.689
480 HB3 ARG 67 HB1 ARG 67 -4.528 -11.226 -7.371
481 HG2 ARG 67 HG2 ARG 67 -4.094 -13.519 -6.985
482 HG3 ARG 67 HG1 ARG 67 -4.163 -13.305 -5.234
483 HD2 ARG 67 HD2 ARG 67 -6.203 -14.350 -6.150
484 HD3 ARG 67 HD1 ARG 67 -6.522 -12.811 -5.350
485 HE ARG 67 HE ARG 67 -6.104 -12.535 -8.177
486 HH11 ARG 67 HH11 ARG 67 -8.446 -13.388 -5.741
487 HH12 ARG 67 HH12 ARG 67 -9.820 -12.890 -6.678
488 HH21 ARG 67 HH21 ARG 67 -7.895 -11.915 -9.453
489 HH22 ARG 67 HH22 ARG 67 -9.503 -12.071 -8.818
490 H VAL 68 HN VAL 68 -1.155 -9.432 -5.174
491 HA VAL 68 HA VAL 68 -1.759 -7.416 -7.220
492 HB VAL 68 HB VAL 68 -2.968 -6.748 -5.211
493 HG11 VAL 68 HG11 VAL 68 -0.303 -6.842 -3.806
494 HG12 VAL 68 HG12 VAL 68 -1.705 -7.863 -3.487
495 HG13 VAL 68 HG13 VAL 68 -1.776 -6.136 -3.141
496 HG21 VAL 68 HG21 VAL 68 -0.539 -5.061 -5.765
497 HG22 VAL 68 HG22 VAL 68 -1.970 -4.512 -4.894
498 HG23 VAL 68 HG23 VAL 68 -2.099 -4.990 -6.586
499 H ASP 69 HN ASP 69 0.005 -6.670 -8.196
500 HA ASP 69 HA ASP 69 2.598 -7.540 -7.164
501 HB2 ASP 69 HB2 ASP 69 1.729 -6.444 -9.836
502 HB3 ASP 69 HB1 ASP 69 3.412 -6.751 -9.430
503 H THR 70 HN THR 70 0.918 -4.584 -8.131
504 HA THR 70 HA THR 70 3.184 -3.057 -7.032
505 HB THR 70 HB THR 70 2.791 -1.336 -8.777
506 HG1 THR 70 HG1 THR 70 1.111 -3.297 -10.009
507 HG21 THR 70 HG21 THR 70 3.345 -4.102 -9.864
508 HG22 THR 70 HG22 THR 70 4.528 -3.024 -9.127
509 HG23 THR 70 HG23 THR 70 3.764 -2.581 -10.654
510 HA PRO 71 HA PRO 71 0.505 -0.637 -4.401
511 HB2 PRO 71 HB2 PRO 71 1.993 1.584 -5.768
512 HB3 PRO 71 HB1 PRO 71 1.618 1.383 -4.052
513 HG2 PRO 71 HG2 PRO 71 4.037 0.800 -4.931
514 HG3 PRO 71 HG1 PRO 71 3.242 -0.279 -3.769
515 HD2 PRO 71 HD2 PRO 71 3.669 -0.638 -6.698
516 HD3 PRO 71 HD1 PRO 71 3.661 -1.851 -5.404
517 H ARG 72 HN ARG 72 1.011 0.407 -7.752
518 HA ARG 72 HA ARG 72 -1.148 2.149 -7.997
519 HB2 ARG 72 HB2 ARG 72 0.818 1.065 -9.682
520 HB3 ARG 72 HB1 ARG 72 -0.720 0.671 -10.440
521 HG2 ARG 72 HG2 ARG 72 -0.183 3.447 -9.478
522 HG3 ARG 72 HG1 ARG 72 0.452 2.892 -11.028
523 HD2 ARG 72 HD2 ARG 72 -2.424 2.468 -10.380
524 HD3 ARG 72 HD1 ARG 72 -1.887 4.071 -10.890
525 HE ARG 72 HE ARG 72 -0.884 2.134 -12.668
526 HH11 ARG 72 HH11 ARG 72 -3.898 3.699 -11.782
527 HH12 ARG 72 HH12 ARG 72 -4.630 3.463 -13.336
528 HH21 ARG 72 HH21 ARG 72 -1.823 1.850 -14.716
529 HH22 ARG 72 HH22 ARG 72 -3.447 2.398 -15.015
530 H GLU 73 HN GLU 73 -1.000 -1.349 -8.477
531 HA GLU 73 HA GLU 73 -3.720 -1.710 -9.215
532 HB2 GLU 73 HB2 GLU 73 -1.783 -3.617 -7.886
533 HB3 GLU 73 HB1 GLU 73 -3.304 -4.076 -8.634
534 HG2 GLU 73 HG2 GLU 73 -2.505 -3.714 -10.773
535 HG3 GLU 73 HG1 GLU 73 -1.199 -2.668 -10.217
536 H LEU 74 HN LEU 74 -1.969 -2.088 -6.165
537 HA LEU 74 HA LEU 74 -3.988 -2.951 -4.494
538 HB2 LEU 74 HB2 LEU 74 -1.352 -2.089 -4.231
539 HB3 LEU 74 HB1 LEU 74 -2.263 -1.003 -3.204
540 HG LEU 74 HG LEU 74 -2.053 -3.993 -2.994
541 HD11 LEU 74 HD11 LEU 74 -1.422 -1.758 -1.072
542 HD12 LEU 74 HD12 LEU 74 -0.243 -2.667 -2.011
543 HD13 LEU 74 HD13 LEU 74 -1.197 -3.481 -0.770
544 HD21 LEU 74 HD21 LEU 74 -4.379 -3.418 -2.647
545 HD22 LEU 74 HD22 LEU 74 -3.921 -2.133 -1.531
546 HD23 LEU 74 HD23 LEU 74 -3.629 -3.820 -1.102
547 H LEU 75 HN LEU 75 -3.055 0.347 -5.293
548 HA LEU 75 HA LEU 75 -4.682 1.745 -3.541
549 HB2 LEU 75 HB2 LEU 75 -2.859 2.643 -5.034
550 HB3 LEU 75 HB1 LEU 75 -4.012 2.591 -6.355
551 HG LEU 75 HG LEU 75 -5.479 4.107 -4.929
552 HD11 LEU 75 HD11 LEU 75 -4.288 5.471 -3.276
553 HD12 LEU 75 HD12 LEU 75 -2.876 4.428 -3.453
554 HD13 LEU 75 HD13 LEU 75 -4.382 3.776 -2.806
555 HD21 LEU 75 HD21 LEU 75 -4.321 4.908 -6.900
556 HD22 LEU 75 HD22 LEU 75 -2.836 5.116 -5.975
557 HD23 LEU 75 HD23 LEU 75 -4.242 6.121 -5.622
558 H ASP 76 HN ASP 76 -5.376 0.876 -6.923
559 HA ASP 76 HA ASP 76 -7.965 1.997 -6.963
560 HB2 ASP 76 HB2 ASP 76 -6.583 1.478 -8.978
561 HB3 ASP 76 HB1 ASP 76 -6.904 -0.233 -8.709
562 H LEU 77 HN LEU 77 -6.778 -1.221 -6.206
563 HA LEU 77 HA LEU 77 -9.247 -2.556 -6.165
564 HB2 LEU 77 HB2 LEU 77 -7.057 -3.685 -6.200
565 HB3 LEU 77 HB1 LEU 77 -6.755 -3.142 -4.562
566 HG LEU 77 HG LEU 77 -8.671 -4.485 -3.778
567 HD11 LEU 77 HD11 LEU 77 -10.005 -4.487 -5.817
568 HD12 LEU 77 HD12 LEU 77 -9.679 -6.135 -5.282
569 HD13 LEU 77 HD13 LEU 77 -8.775 -5.454 -6.634
570 HD21 LEU 77 HD21 LEU 77 -6.434 -5.415 -3.700
571 HD22 LEU 77 HD22 LEU 77 -6.594 -5.988 -5.360
572 HD23 LEU 77 HD23 LEU 77 -7.605 -6.677 -4.091
573 H ILE 78 HN ILE 78 -7.406 -1.001 -3.542
574 HA ILE 78 HA ILE 78 -9.263 -1.613 -1.501
575 HB ILE 78 HB ILE 78 -7.226 0.618 -1.653
576 HG12 ILE 78 HG12 ILE 78 -7.169 -2.085 -0.290
577 HG13 ILE 78 HG11 ILE 78 -6.284 -1.648 -1.749
578 HG21 ILE 78 HG21 ILE 78 -8.770 -0.387 0.740
579 HG22 ILE 78 HG22 ILE 78 -8.981 1.177 -0.048
580 HG23 ILE 78 HG23 ILE 78 -7.468 0.801 0.775
581 HD11 ILE 78 HD11 ILE 78 -5.047 0.033 -0.456
582 HD12 ILE 78 HD12 ILE 78 -4.813 -1.609 0.144
583 HD13 ILE 78 HD13 ILE 78 -5.887 -0.501 1.001
584 H ASN 79 HN ASN 79 -8.961 1.114 -3.724
585 HA ASN 79 HA ASN 79 -10.917 2.775 -2.554
586 HB2 ASN 79 HB2 ASN 79 -9.844 2.522 -5.353
587 HB3 ASN 79 HB1 ASN 79 -11.192 3.601 -5.009
588 HD21 ASN 79 HD21 ASN 79 -8.533 2.965 -2.799
589 HD22 ASN 79 HD22 ASN 79 -7.847 4.549 -2.882
590 H GLY 80 HN GLY 80 -11.160 0.175 -4.943
591 HA2 GLY 80 HA2 GLY 80 -13.883 0.469 -5.576
592 HA3 GLY 80 HA1 GLY 80 -12.949 -1.010 -5.739
593 H ALA 81 HN ALA 81 -12.284 -1.381 -3.017
594 HA ALA 81 HA ALA 81 -14.672 -2.691 -2.152
595 HB1 ALA 81 HB1 ALA 81 -13.353 -3.447 -0.273
596 HB2 ALA 81 HB2 ALA 81 -12.099 -2.263 -0.638
597 HB3 ALA 81 HB3 ALA 81 -12.412 -3.593 -1.756
598 H LEU 82 HN LEU 82 -13.024 0.265 -1.294
599 HA LEU 82 HA LEU 82 -14.557 0.716 1.084
600 HB2 LEU 82 HB2 LEU 82 -12.635 1.796 1.425
601 HB3 LEU 82 HB1 LEU 82 -12.258 1.838 -0.282
602 HG LEU 82 HG LEU 82 -13.864 3.819 -0.410
603 HD11 LEU 82 HD11 LEU 82 -13.381 3.760 2.568
604 HD12 LEU 82 HD12 LEU 82 -14.935 3.567 1.756
605 HD13 LEU 82 HD13 LEU 82 -14.084 5.112 1.681
606 HD21 LEU 82 HD21 LEU 82 -11.269 4.070 1.111
607 HD22 LEU 82 HD22 LEU 82 -12.098 5.376 0.267
608 HD23 LEU 82 HD23 LEU 82 -11.448 4.014 -0.643
609 H ALA 83 HN ALA 83 -14.783 1.554 -2.281
610 HA ALA 83 HA ALA 83 -16.454 3.809 -2.079
611 HB1 ALA 83 HB1 ALA 83 -16.228 1.824 -4.340
612 HB2 ALA 83 HB2 ALA 83 -15.202 3.240 -4.095
613 HB3 ALA 83 HB3 ALA 83 -16.919 3.445 -4.443
614 H GLU 84 HN GLU 84 -17.148 0.399 -1.894
615 HA GLU 84 HA GLU 84 -20.014 0.909 -2.165
616 HB2 GLU 84 HB2 GLU 84 -20.250 -1.551 -2.134
617 HB3 GLU 84 HB1 GLU 84 -19.186 -0.986 -3.416
618 HG2 GLU 84 HG2 GLU 84 -17.244 -1.602 -2.094
619 HG3 GLU 84 HG1 GLU 84 -18.295 -2.131 -0.780
620 H ALA 85 HN ALA 85 -17.852 1.132 0.247
621 HA ALA 85 HA ALA 85 -19.357 -0.291 2.282
622 HB1 ALA 85 HB1 ALA 85 -16.903 -0.284 2.341
623 HB2 ALA 85 HB2 ALA 85 -17.600 0.408 3.804
624 HB3 ALA 85 HB3 ALA 85 -16.920 1.464 2.567
625 H ALA 86 HN ALA 86 -18.850 2.988 1.171
626 HA ALA 86 HA ALA 86 -20.417 4.044 3.409
627 HB1 ALA 86 HB1 ALA 86 -19.641 6.252 2.643
628 HB2 ALA 86 HB2 ALA 86 -18.747 5.468 1.337
629 HB3 ALA 86 HB3 ALA 86 -18.308 5.161 3.018
630 H28 SXO 87 H28B SXO 87 6.493 -12.050 7.110
631 H28A SXO 87 H28A SXO 87 7.734 -12.979 7.951
632 H30 SXO 87 H30A SXO 87 4.830 -12.186 8.632
633 H30A SXO 87 H30C SXO 87 4.345 -13.684 9.424
634 H30B SXO 87 H30B SXO 87 5.912 -12.961 9.791
635 H31 SXO 87 H31A SXO 87 3.983 -14.894 7.292
636 H31A SXO 87 H31B SXO 87 5.195 -14.783 6.012
637 H31B SXO 87 H31C SXO 87 4.283 -13.352 6.494
638 H32 SXO 87 H32A SXO 87 6.972 -15.014 9.366
639 HO33 SXO 87 H33A SXO 87 7.109 -16.688 7.278
640 HN36 SXO 87 H36A SXO 87 4.487 -15.142 10.045
641 H37 SXO 87 H37A SXO 87 3.275 -17.690 9.231
642 H37A SXO 87 H37B SXO 87 3.659 -17.422 10.930
643 H38 SXO 87 H38B SXO 87 2.192 -15.440 10.920
644 H38A SXO 87 H38A SXO 87 1.333 -16.933 10.548
645 HN41 SXO 87 H41A SXO 87 0.289 -14.503 9.994
646 H42 SXO 87 H42A SXO 87 0.681 -13.457 7.417
647 H42A SXO 87 H42B SXO 87 -0.576 -14.695 7.356
648 H43 SXO 87 H43B SXO 87 -1.838 -13.498 9.087
649 H43A SXO 87 H43A SXO 87 -0.572 -12.261 9.140
650 H2 SXO 87 H2A SXO 87 -0.189 -9.183 5.816
651 H2A SXO 87 H2B SXO 87 -1.902 -9.518 6.090
652 H3 SXO 87 H3B SXO 87 -0.065 -10.803 4.076
653 H3A SXO 87 H3A SXO 87 -1.677 -11.416 4.447
654 H4 SXO 87 H4A SXO 87 -2.611 -9.213 3.809
655 H4A SXO 87 H4B SXO 87 -1.785 -10.025 2.478
656 H5 SXO 87 H5B SXO 87 -0.638 -7.837 4.206
657 H5A SXO 87 H5A SXO 87 0.207 -8.654 2.887
658 H6 SXO 87 H6A SXO 87 -2.306 -7.001 2.653
659 H6A SXO 87 H6B SXO 87 -1.518 -7.851 1.321
660 H7 SXO 87 H7A SXO 87 0.491 -6.486 1.626
661 H7A SXO 87 H7B SXO 87 -0.285 -5.644 2.978
662 H8 SXO 87 H8C SXO 87 -2.035 -4.854 1.463
663 H8A SXO 87 H8A SXO 87 -1.239 -5.675 0.122
664 H8B SXO 87 H8B SXO 87 -0.434 -4.334 0.935
Start of MODEL 13
1 H1 MET 1 HT1 MET 1 -17.097 13.183 -0.686
2 H2 MET 1 HT2 MET 1 -15.937 14.389 -0.423
3 H3 MET 1 HT3 MET 1 -17.546 14.815 -0.746
4 HA MET 1 HA MET 1 -17.007 15.083 1.579
5 HB2 MET 1 HB2 MET 1 -18.923 13.947 2.486
6 HB3 MET 1 HB1 MET 1 -19.314 14.494 0.864
7 HG2 MET 1 HG2 MET 1 -18.995 12.250 0.005
8 HG3 MET 1 HG1 MET 1 -18.527 11.686 1.609
9 HE1 MET 1 HE1 MET 1 -20.350 9.736 1.512
10 HE2 MET 1 HE2 MET 1 -20.794 10.264 -0.111
11 HE3 MET 1 HE3 MET 1 -22.042 10.012 1.111
12 H ALA 2 HN ALA 2 -16.219 11.929 0.299
13 HA ALA 2 HA ALA 2 -15.436 10.978 2.954
14 HB1 ALA 2 HB1 ALA 2 -16.817 9.513 1.527
15 HB2 ALA 2 HB2 ALA 2 -15.266 8.789 1.948
16 HB3 ALA 2 HB3 ALA 2 -15.510 9.473 0.342
17 H THR 3 HN THR 3 -13.363 10.101 3.342
18 HA THR 3 HA THR 3 -11.273 11.291 1.660
19 HB THR 3 HB THR 3 -11.107 11.966 3.957
20 HG1 THR 3 HG1 THR 3 -9.148 10.002 3.303
21 HG21 THR 3 HG21 THR 3 -11.056 9.037 4.675
22 HG22 THR 3 HG22 THR 3 -12.353 10.179 5.027
23 HG23 THR 3 HG23 THR 3 -10.777 10.372 5.796
24 H LEU 4 HN LEU 4 -10.721 9.939 0.097
25 HA LEU 4 HA LEU 4 -10.688 7.069 0.481
26 HB2 LEU 4 HB2 LEU 4 -9.853 8.698 -1.925
27 HB3 LEU 4 HB1 LEU 4 -10.128 6.967 -1.886
28 HG LEU 4 HG LEU 4 -12.266 9.041 -1.410
29 HD11 LEU 4 HD11 LEU 4 -13.081 8.424 -3.636
30 HD12 LEU 4 HD12 LEU 4 -11.665 7.397 -3.864
31 HD13 LEU 4 HD13 LEU 4 -11.472 9.143 -3.703
32 HD21 LEU 4 HD21 LEU 4 -12.696 6.906 -0.302
33 HD22 LEU 4 HD22 LEU 4 -12.441 6.061 -1.829
34 HD23 LEU 4 HD23 LEU 4 -13.805 7.165 -1.648
35 H LEU 5 HN LEU 5 -8.684 5.926 -0.568
36 HA LEU 5 HA LEU 5 -6.298 6.872 0.785
37 HB2 LEU 5 HB2 LEU 5 -7.211 4.386 0.374
38 HB3 LEU 5 HB1 LEU 5 -6.255 4.545 -1.083
39 HG LEU 5 HG LEU 5 -5.182 4.884 1.722
40 HD11 LEU 5 HD11 LEU 5 -4.930 2.565 -0.186
41 HD12 LEU 5 HD12 LEU 5 -5.897 2.594 1.289
42 HD13 LEU 5 HD13 LEU 5 -4.140 2.711 1.383
43 HD21 LEU 5 HD21 LEU 5 -3.946 6.134 0.000
44 HD22 LEU 5 HD22 LEU 5 -3.726 4.638 -0.912
45 HD23 LEU 5 HD23 LEU 5 -2.998 4.818 0.685
46 H THR 6 HN THR 6 -4.833 8.148 -0.208
47 HA THR 6 HA THR 6 -5.106 8.537 -3.106
48 HB THR 6 HB THR 6 -3.662 10.674 -2.291
49 HG1 THR 6 HG1 THR 6 -3.944 11.041 -0.204
50 HG21 THR 6 HG21 THR 6 -5.748 10.716 -3.611
51 HG22 THR 6 HG22 THR 6 -5.755 11.932 -2.335
52 HG23 THR 6 HG23 THR 6 -6.676 10.441 -2.137
53 H THR 7 HN THR 7 -3.102 9.258 -4.242
54 HA THR 7 HA THR 7 -1.154 7.280 -4.215
55 HB THR 7 HB THR 7 0.138 9.175 -5.544
56 HG1 THR 7 HG1 THR 7 -1.740 10.507 -6.459
57 HG21 THR 7 HG21 THR 7 -0.808 7.178 -6.557
58 HG22 THR 7 HG22 THR 7 -1.185 8.597 -7.535
59 HG23 THR 7 HG23 THR 7 -2.423 7.891 -6.496
60 H ASP 8 HN ASP 8 -0.759 10.691 -3.210
61 HA ASP 8 HA ASP 8 1.882 10.391 -2.300
62 HB2 ASP 8 HB2 ASP 8 -0.196 12.426 -1.459
63 HB3 ASP 8 HB1 ASP 8 1.522 12.532 -1.099
64 H ASP 9 HN ASP 9 -1.205 10.160 -0.634
65 HA ASP 9 HA ASP 9 -0.130 9.774 1.950
66 HB2 ASP 9 HB2 ASP 9 -2.821 9.151 0.743
67 HB3 ASP 9 HB1 ASP 9 -2.446 8.820 2.433
68 H LEU 10 HN LEU 10 -0.763 7.609 -0.721
69 HA LEU 10 HA LEU 10 -0.325 5.201 0.730
70 HB2 LEU 10 HB2 LEU 10 -1.408 5.262 -1.490
71 HB3 LEU 10 HB1 LEU 10 0.107 5.779 -2.206
72 HG LEU 10 HG LEU 10 1.137 3.635 -1.554
73 HD11 LEU 10 HD11 LEU 10 -0.221 3.145 0.402
74 HD12 LEU 10 HD12 LEU 10 -0.278 1.808 -0.747
75 HD13 LEU 10 HD13 LEU 10 -1.639 2.923 -0.621
76 HD21 LEU 10 HD21 LEU 10 -1.414 3.366 -3.139
77 HD22 LEU 10 HD22 LEU 10 -0.064 2.232 -3.165
78 HD23 LEU 10 HD23 LEU 10 0.153 3.875 -3.769
79 H ARG 11 HN ARG 11 1.758 7.368 -1.157
80 HA ARG 11 HA ARG 11 4.198 6.070 -0.832
81 HB2 ARG 11 HB2 ARG 11 3.828 8.114 -2.219
82 HB3 ARG 11 HB1 ARG 11 3.721 9.060 -0.741
83 HG2 ARG 11 HG2 ARG 11 6.028 8.464 -0.188
84 HG3 ARG 11 HG1 ARG 11 6.140 7.517 -1.670
85 HD2 ARG 11 HD2 ARG 11 7.136 9.550 -2.219
86 HD3 ARG 11 HD1 ARG 11 5.507 9.683 -2.876
87 HE ARG 11 HE ARG 11 6.374 10.936 -0.346
88 HH11 ARG 11 HH11 ARG 11 4.425 10.914 -3.247
89 HH12 ARG 11 HH12 ARG 11 3.780 12.504 -2.994
90 HH21 ARG 11 HH21 ARG 11 5.597 13.058 -0.032
91 HH22 ARG 11 HH22 ARG 11 4.464 13.738 -1.171
92 H ARG 12 HN ARG 12 2.530 8.355 1.274
93 HA ARG 12 HA ARG 12 4.339 8.465 3.386
94 HB2 ARG 12 HB2 ARG 12 1.340 8.667 3.283
95 HB3 ARG 12 HB1 ARG 12 2.227 8.824 4.792
96 HG2 ARG 12 HG2 ARG 12 3.451 10.731 3.861
97 HG3 ARG 12 HG1 ARG 12 2.533 10.571 2.360
98 HD2 ARG 12 HD2 ARG 12 1.607 12.319 3.816
99 HD3 ARG 12 HD1 ARG 12 0.462 11.008 3.549
100 HE ARG 12 HE ARG 12 1.729 10.341 5.887
101 HH11 ARG 12 HH11 ARG 12 -0.126 13.092 4.740
102 HH12 ARG 12 HH12 ARG 12 -0.657 13.549 6.332
103 HH21 ARG 12 HH21 ARG 12 1.025 10.938 7.963
104 HH22 ARG 12 HH22 ARG 12 -0.008 12.327 8.169
105 H ALA 13 HN ALA 13 1.884 6.077 2.620
106 HA ALA 13 HA ALA 13 1.696 4.833 5.108
107 HB1 ALA 13 HB1 ALA 13 0.642 3.006 3.939
108 HB2 ALA 13 HB2 ALA 13 1.303 3.569 2.403
109 HB3 ALA 13 HB3 ALA 13 0.102 4.540 3.254
110 H LEU 14 HN LEU 14 3.828 4.134 2.354
111 HA LEU 14 HA LEU 14 4.994 1.817 3.443
112 HB2 LEU 14 HB2 LEU 14 5.961 3.819 1.418
113 HB3 LEU 14 HB1 LEU 14 6.977 2.488 1.931
114 HG LEU 14 HG LEU 14 5.976 1.826 -0.107
115 HD11 LEU 14 HD11 LEU 14 6.054 0.072 1.547
116 HD12 LEU 14 HD12 LEU 14 4.618 -0.115 0.540
117 HD13 LEU 14 HD13 LEU 14 4.476 0.548 2.168
118 HD21 LEU 14 HD21 LEU 14 3.562 1.837 -0.505
119 HD22 LEU 14 HD22 LEU 14 4.172 3.461 -0.189
120 HD23 LEU 14 HD23 LEU 14 3.306 2.587 1.073
121 H VAL 15 HN VAL 15 6.004 5.208 3.559
122 HA VAL 15 HA VAL 15 8.378 4.829 5.033
123 HB VAL 15 HB VAL 15 6.591 7.273 4.956
124 HG11 VAL 15 HG11 VAL 15 9.523 7.006 5.605
125 HG12 VAL 15 HG12 VAL 15 8.230 7.373 6.748
126 HG13 VAL 15 HG13 VAL 15 8.631 8.521 5.470
127 HG21 VAL 15 HG21 VAL 15 8.900 6.522 3.165
128 HG22 VAL 15 HG22 VAL 15 8.002 8.039 3.114
129 HG23 VAL 15 HG23 VAL 15 7.198 6.522 2.711
130 H GLU 16 HN GLU 16 5.109 5.792 6.054
131 HA GLU 16 HA GLU 16 5.725 6.072 8.785
132 HB2 GLU 16 HB2 GLU 16 3.094 5.603 7.389
133 HB3 GLU 16 HB1 GLU 16 3.236 5.961 9.103
134 HG2 GLU 16 HG2 GLU 16 4.280 8.112 8.560
135 HG3 GLU 16 HG1 GLU 16 4.118 7.751 6.840
136 H SER 17 HN SER 17 5.186 3.229 6.923
137 HA SER 17 HA SER 17 4.440 1.663 9.253
138 HB2 SER 17 HB2 SER 17 4.890 0.810 6.393
139 HB3 SER 17 HB1 SER 17 4.261 -0.215 7.683
140 HG SER 17 HG SER 17 3.048 1.894 6.309
141 H ALA 18 HN ALA 18 7.024 1.388 6.776
142 HA ALA 18 HA ALA 18 8.451 -0.469 8.467
143 HB1 ALA 18 HB1 ALA 18 9.278 0.719 5.825
144 HB2 ALA 18 HB2 ALA 18 8.363 -0.775 6.031
145 HB3 ALA 18 HB3 ALA 18 10.018 -0.663 6.632
146 H GLY 19 HN GLY 19 9.229 2.718 7.048
147 HA2 GLY 19 HA2 GLY 19 10.110 4.434 8.515
148 HA3 GLY 19 HA1 GLY 19 10.921 3.162 9.415
149 H GLU 20 HN GLU 20 11.276 2.432 6.181
150 HA GLU 20 HA GLU 20 14.007 3.276 6.171
151 HB2 GLU 20 HB2 GLU 20 13.196 1.218 4.975
152 HB3 GLU 20 HB1 GLU 20 12.408 2.267 3.803
153 HG2 GLU 20 HG2 GLU 20 14.533 3.174 3.117
154 HG3 GLU 20 HG1 GLU 20 15.364 2.279 4.385
155 H THR 21 HN THR 21 14.739 5.212 5.669
156 HA THR 21 HA THR 21 12.885 7.239 4.833
157 HB THR 21 HB THR 21 14.867 8.762 5.157
158 HG1 THR 21 HG1 THR 21 16.318 6.738 4.842
159 HG21 THR 21 HG21 THR 21 14.883 8.547 7.583
160 HG22 THR 21 HG22 THR 21 14.210 6.923 7.457
161 HG23 THR 21 HG23 THR 21 13.251 8.315 6.958
162 H ASP 22 HN ASP 22 15.888 8.139 3.719
163 HA ASP 22 HA ASP 22 15.050 8.147 0.994
164 HB2 ASP 22 HB2 ASP 22 17.799 8.747 2.114
165 HB3 ASP 22 HB1 ASP 22 17.180 9.220 0.535
166 H GLY 23 HN GLY 23 14.712 5.825 0.826
167 HA2 GLY 23 HA2 GLY 23 17.158 4.230 0.594
168 HA3 GLY 23 HA1 GLY 23 15.513 3.610 0.591
169 H THR 24 HN THR 24 14.395 5.259 -1.356
170 HA THR 24 HA THR 24 15.949 5.082 -3.758
171 HB THR 24 HB THR 24 15.235 2.721 -3.463
172 HG1 THR 24 HG1 THR 24 14.991 2.572 -5.574
173 HG21 THR 24 HG21 THR 24 12.883 2.106 -3.720
174 HG22 THR 24 HG22 THR 24 12.437 3.812 -3.781
175 HG23 THR 24 HG23 THR 24 13.112 3.132 -2.302
176 H ASP 25 HN ASP 25 13.907 5.161 -5.634
177 HA ASP 25 HA ASP 25 12.896 7.832 -5.118
178 HB2 ASP 25 HB2 ASP 25 13.346 6.179 -7.507
179 HB3 ASP 25 HB1 ASP 25 11.922 7.208 -7.583
180 H LEU 26 HN LEU 26 11.439 7.111 -3.435
181 HA LEU 26 HA LEU 26 9.095 5.625 -4.235
182 HB2 LEU 26 HB2 LEU 26 10.088 5.477 -1.954
183 HB3 LEU 26 HB1 LEU 26 9.641 7.150 -1.681
184 HG LEU 26 HG LEU 26 7.254 6.498 -1.957
185 HD11 LEU 26 HD11 LEU 26 6.668 4.122 -1.838
186 HD12 LEU 26 HD12 LEU 26 8.373 3.701 -1.990
187 HD13 LEU 26 HD13 LEU 26 7.547 4.511 -3.320
188 HD21 LEU 26 HD21 LEU 26 7.059 5.405 0.222
189 HD22 LEU 26 HD22 LEU 26 8.251 6.704 0.257
190 HD23 LEU 26 HD23 LEU 26 8.781 5.024 0.186
191 H SER 27 HN SER 27 10.150 8.826 -4.387
192 HA SER 27 HA SER 27 7.514 10.020 -4.214
193 HB2 SER 27 HB2 SER 27 10.154 11.299 -4.951
194 HB3 SER 27 HB1 SER 27 8.671 12.134 -4.497
195 HG SER 27 HG SER 27 10.187 11.930 -2.759
196 H GLY 28 HN GLY 28 9.326 8.474 -6.572
197 HA2 GLY 28 HA2 GLY 28 8.216 10.037 -8.786
198 HA3 GLY 28 HA1 GLY 28 9.402 8.744 -8.920
199 H ASP 29 HN ASP 29 8.464 7.336 -10.287
200 HA ASP 29 HA ASP 29 5.648 6.731 -10.132
201 HB2 ASP 29 HB2 ASP 29 7.857 5.549 -11.822
202 HB3 ASP 29 HB1 ASP 29 6.160 5.090 -11.948
203 H PHE 30 HN PHE 30 6.267 6.106 -7.733
204 HA PHE 30 HA PHE 30 7.479 3.580 -7.303
205 HB2 PHE 30 HB2 PHE 30 6.728 3.759 -5.033
206 HB3 PHE 30 HB1 PHE 30 7.206 5.364 -5.559
207 HD1 PHE 30 HD2 PHE 30 5.228 6.877 -6.456
208 HD2 PHE 30 HD1 PHE 30 4.744 3.482 -3.939
209 HE1 PHE 30 HE2 PHE 30 3.042 7.738 -5.722
210 HE2 PHE 30 HE1 PHE 30 2.557 4.330 -3.202
211 HZ PHE 30 HZ PHE 30 1.707 6.460 -4.094
212 H LEU 31 HN LEU 31 4.260 4.608 -8.047
213 HA LEU 31 HA LEU 31 2.775 2.324 -7.484
214 HB2 LEU 31 HB2 LEU 31 2.464 4.249 -9.784
215 HB3 LEU 31 HB1 LEU 31 1.248 3.110 -9.248
216 HG LEU 31 HG LEU 31 2.310 5.413 -7.616
217 HD11 LEU 31 HD11 LEU 31 0.964 6.147 -9.514
218 HD12 LEU 31 HD12 LEU 31 0.131 6.421 -7.984
219 HD13 LEU 31 HD13 LEU 31 -0.333 5.064 -9.009
220 HD21 LEU 31 HD21 LEU 31 0.102 3.431 -7.075
221 HD22 LEU 31 HD22 LEU 31 0.425 4.875 -6.116
222 HD23 LEU 31 HD23 LEU 31 1.622 3.583 -6.194
223 H ASP 32 HN ASP 32 5.187 2.838 -9.876
224 HA ASP 32 HA ASP 32 4.139 0.776 -11.661
225 HB2 ASP 32 HB2 ASP 32 4.982 3.059 -12.440
226 HB3 ASP 32 HB1 ASP 32 6.599 2.475 -12.067
227 H LEU 33 HN LEU 33 6.591 1.278 -9.288
228 HA LEU 33 HA LEU 33 8.106 -1.080 -10.080
229 HB2 LEU 33 HB2 LEU 33 8.466 1.008 -7.950
230 HB3 LEU 33 HB1 LEU 33 9.368 -0.493 -7.896
231 HG LEU 33 HG LEU 33 10.757 1.196 -8.866
232 HD11 LEU 33 HD11 LEU 33 11.244 0.207 -11.065
233 HD12 LEU 33 HD12 LEU 33 9.723 -0.684 -10.983
234 HD13 LEU 33 HD13 LEU 33 11.003 -1.012 -9.814
235 HD21 LEU 33 HD21 LEU 33 8.566 1.632 -10.887
236 HD22 LEU 33 HD22 LEU 33 10.161 2.382 -10.918
237 HD23 LEU 33 HD23 LEU 33 9.038 2.749 -9.609
238 H ARG 34 HN ARG 34 8.342 -2.922 -8.718
239 HA ARG 34 HA ARG 34 5.970 -3.649 -7.302
240 HB2 ARG 34 HB2 ARG 34 8.628 -4.943 -7.760
241 HB3 ARG 34 HB1 ARG 34 7.507 -5.627 -6.594
242 HG2 ARG 34 HG2 ARG 34 5.865 -5.966 -8.331
243 HG3 ARG 34 HG1 ARG 34 6.915 -5.169 -9.510
244 HD2 ARG 34 HD2 ARG 34 8.324 -6.940 -9.666
245 HD3 ARG 34 HD1 ARG 34 8.091 -7.411 -7.982
246 HE ARG 34 HE ARG 34 5.751 -7.854 -9.568
247 HH11 ARG 34 HH11 ARG 34 8.900 -9.163 -8.696
248 HH12 ARG 34 HH12 ARG 34 8.433 -10.809 -8.996
249 HH21 ARG 34 HH21 ARG 34 5.152 -10.017 -9.943
250 HH22 ARG 34 HH22 ARG 34 6.311 -11.298 -9.721
251 H PHE 35 HN PHE 35 5.795 -4.223 -5.086
252 HA PHE 35 HA PHE 35 6.923 -2.549 -3.179
253 HB2 PHE 35 HB2 PHE 35 5.820 -5.346 -2.849
254 HB3 PHE 35 HB1 PHE 35 6.173 -4.251 -1.517
255 HD1 PHE 35 HD2 PHE 35 4.953 -2.009 -1.479
256 HD2 PHE 35 HD1 PHE 35 3.750 -5.281 -3.908
257 HE1 PHE 35 HE2 PHE 35 2.705 -1.026 -1.672
258 HE2 PHE 35 HE1 PHE 35 1.497 -4.308 -4.111
259 HZ PHE 35 HZ PHE 35 0.974 -2.173 -2.990
260 H GLU 36 HN GLU 36 7.931 -5.781 -4.211
261 HA GLU 36 HA GLU 36 10.105 -6.099 -2.476
262 HB2 GLU 36 HB2 GLU 36 10.942 -7.732 -4.148
263 HB3 GLU 36 HB1 GLU 36 9.253 -7.974 -3.728
264 HG2 GLU 36 HG2 GLU 36 8.506 -7.092 -5.776
265 HG3 GLU 36 HG1 GLU 36 10.094 -6.431 -6.155
266 H ASP 37 HN ASP 37 9.762 -4.191 -5.365
267 HA ASP 37 HA ASP 37 12.600 -4.033 -5.862
268 HB2 ASP 37 HB2 ASP 37 10.247 -2.602 -7.102
269 HB3 ASP 37 HB1 ASP 37 11.913 -2.259 -7.545
270 H ILE 38 HN ILE 38 10.146 -2.147 -4.244
271 HA ILE 38 HA ILE 38 12.018 0.023 -3.782
272 HB ILE 38 HB ILE 38 10.165 1.034 -2.421
273 HG12 ILE 38 HG12 ILE 38 8.583 -1.292 -3.539
274 HG13 ILE 38 HG11 ILE 38 9.000 -1.061 -1.845
275 HG21 ILE 38 HG21 ILE 38 9.583 0.315 -5.291
276 HG22 ILE 38 HG22 ILE 38 10.522 1.691 -4.713
277 HG23 ILE 38 HG23 ILE 38 8.790 1.608 -4.390
278 HD11 ILE 38 HD11 ILE 38 7.651 0.958 -1.781
279 HD12 ILE 38 HD12 ILE 38 6.695 -0.431 -2.302
280 HD13 ILE 38 HD13 ILE 38 7.250 0.756 -3.485
281 H GLY 39 HN GLY 39 11.766 -2.937 -2.555
282 HA2 GLY 39 HA2 GLY 39 13.153 -3.756 -0.878
283 HA3 GLY 39 HA1 GLY 39 13.324 -2.126 -0.255
284 H TYR 40 HN TYR 40 10.228 -3.747 -0.799
285 HA TYR 40 HA TYR 40 9.911 -3.855 2.125
286 HB2 TYR 40 HB2 TYR 40 7.921 -3.106 -0.006
287 HB3 TYR 40 HB1 TYR 40 7.416 -3.598 1.610
288 HD1 TYR 40 HD1 TYR 40 9.531 -1.129 -0.198
289 HD2 TYR 40 HD2 TYR 40 7.390 -2.034 3.365
290 HE1 TYR 40 HE1 TYR 40 9.859 1.181 0.582
291 HE2 TYR 40 HE2 TYR 40 7.718 0.267 4.155
292 HH TYR 40 HH TYR 40 9.069 2.161 3.809
293 H ASP 41 HN ASP 41 9.647 -5.767 2.952
294 HA ASP 41 HA ASP 41 9.257 -8.054 1.184
295 HB2 ASP 41 HB2 ASP 41 10.217 -9.369 2.900
296 HB3 ASP 41 HB1 ASP 41 11.127 -7.861 2.944
297 H SER 42 HN SER 42 8.169 -9.935 2.690
298 HA SER 42 HA SER 42 5.428 -9.489 2.607
299 HB2 SER 42 HB2 SER 42 5.287 -11.619 3.916
300 HB3 SER 42 HB1 SER 42 6.347 -11.724 2.506
301 H LEU 43 HN LEU 43 7.648 -9.444 5.385
302 HA LEU 43 HA LEU 43 5.641 -9.095 7.350
303 HB2 LEU 43 HB2 LEU 43 7.900 -9.922 7.853
304 HB3 LEU 43 HB1 LEU 43 8.570 -8.356 7.442
305 HG LEU 43 HG LEU 43 7.357 -7.352 9.342
306 HD11 LEU 43 HD11 LEU 43 6.554 -10.197 9.951
307 HD12 LEU 43 HD12 LEU 43 5.473 -8.907 9.426
308 HD13 LEU 43 HD13 LEU 43 6.280 -8.800 10.991
309 HD21 LEU 43 HD21 LEU 43 9.649 -8.152 9.616
310 HD22 LEU 43 HD22 LEU 43 9.038 -9.739 10.083
311 HD23 LEU 43 HD23 LEU 43 8.719 -8.333 11.102
312 H ALA 44 HN ALA 44 7.865 -6.752 5.829
313 HA ALA 44 HA ALA 44 6.797 -4.484 7.099
314 HB1 ALA 44 HB1 ALA 44 8.123 -4.648 4.398
315 HB2 ALA 44 HB2 ALA 44 8.955 -4.462 5.943
316 HB3 ALA 44 HB3 ALA 44 7.889 -3.185 5.352
317 H LEU 45 HN LEU 45 5.866 -6.209 4.190
318 HA LEU 45 HA LEU 45 4.085 -4.268 3.170
319 HB2 LEU 45 HB2 LEU 45 5.064 -6.258 1.946
320 HB3 LEU 45 HB1 LEU 45 3.874 -7.246 2.775
321 HG LEU 45 HG LEU 45 2.067 -5.954 1.714
322 HD11 LEU 45 HD11 LEU 45 3.220 -3.840 1.451
323 HD12 LEU 45 HD12 LEU 45 2.604 -4.404 -0.104
324 HD13 LEU 45 HD13 LEU 45 4.320 -4.562 0.276
325 HD21 LEU 45 HD21 LEU 45 2.837 -7.988 0.643
326 HD22 LEU 45 HD22 LEU 45 4.102 -7.093 -0.199
327 HD23 LEU 45 HD23 LEU 45 2.407 -6.786 -0.574
328 H MET 46 HN MET 46 3.539 -7.111 5.258
329 HA MET 46 HA MET 46 0.733 -6.701 5.395
330 HB2 MET 46 HB2 MET 46 0.699 -8.342 7.187
331 HB3 MET 46 HB1 MET 46 1.713 -8.897 5.863
332 HG2 MET 46 HG2 MET 46 3.696 -8.473 7.089
333 HG3 MET 46 HG1 MET 46 2.817 -7.575 8.325
334 HE1 MET 46 HE1 MET 46 0.803 -10.391 10.127
335 HE2 MET 46 HE2 MET 46 0.249 -9.412 8.768
336 HE3 MET 46 HE3 MET 46 1.180 -8.668 10.066
337 H GLU 47 HN GLU 47 3.434 -5.594 7.398
338 HA GLU 47 HA GLU 47 1.825 -4.414 9.409
339 HB2 GLU 47 HB2 GLU 47 4.631 -3.788 8.492
340 HB3 GLU 47 HB1 GLU 47 3.857 -2.966 9.842
341 HG2 GLU 47 HG2 GLU 47 3.503 -5.236 10.866
342 HG3 GLU 47 HG1 GLU 47 4.573 -5.874 9.616
343 H THR 48 HN THR 48 3.009 -3.254 6.308
344 HA THR 48 HA THR 48 2.106 -0.595 6.507
345 HB THR 48 HB THR 48 2.292 -2.288 4.004
346 HG1 THR 48 HG1 THR 48 4.289 -2.207 5.110
347 HG21 THR 48 HG21 THR 48 1.025 -0.204 3.691
348 HG22 THR 48 HG22 THR 48 2.569 -0.156 2.840
349 HG23 THR 48 HG23 THR 48 2.374 0.713 4.363
350 H ALA 49 HN ALA 49 0.505 -3.562 5.429
351 HA ALA 49 HA ALA 49 -1.919 -2.510 4.548
352 HB1 ALA 49 HB1 ALA 49 -1.505 -5.114 6.011
353 HB2 ALA 49 HB2 ALA 49 -1.255 -4.862 4.287
354 HB3 ALA 49 HB3 ALA 49 -2.871 -4.699 4.974
355 H ALA 50 HN ALA 50 -1.015 -3.602 7.804
356 HA ALA 50 HA ALA 50 -3.430 -3.052 9.101
357 HB1 ALA 50 HB1 ALA 50 -1.652 -4.405 10.085
358 HB2 ALA 50 HB2 ALA 50 -2.143 -3.103 11.168
359 HB3 ALA 50 HB3 ALA 50 -0.644 -2.968 10.253
360 H ARG 51 HN ARG 51 -0.885 -0.940 8.086
361 HA ARG 51 HA ARG 51 -1.548 1.251 9.788
362 HB2 ARG 51 HB2 ARG 51 0.648 1.423 9.177
363 HB3 ARG 51 HB1 ARG 51 0.389 0.613 7.643
364 HG2 ARG 51 HG2 ARG 51 1.002 2.749 7.032
365 HG3 ARG 51 HG1 ARG 51 -0.756 2.759 6.918
366 HD2 ARG 51 HD2 ARG 51 -0.038 4.789 7.984
367 HD3 ARG 51 HD1 ARG 51 -0.847 3.775 9.182
368 HE ARG 51 HE ARG 51 1.999 3.411 9.111
369 HH11 ARG 51 HH11 ARG 51 -0.586 5.359 10.441
370 HH12 ARG 51 HH12 ARG 51 0.345 5.895 11.806
371 HH21 ARG 51 HH21 ARG 51 3.236 4.118 10.907
372 HH22 ARG 51 HH22 ARG 51 2.506 5.171 12.080
373 H LEU 52 HN LEU 52 -2.475 0.085 6.642
374 HA LEU 52 HA LEU 52 -3.734 2.553 5.836
375 HB2 LEU 52 HB2 LEU 52 -3.812 -0.215 4.637
376 HB3 LEU 52 HB1 LEU 52 -4.532 1.208 3.908
377 HG LEU 52 HG LEU 52 -1.581 0.829 4.438
378 HD11 LEU 52 HD11 LEU 52 -1.412 0.676 1.991
379 HD12 LEU 52 HD12 LEU 52 -3.172 0.694 1.880
380 HD13 LEU 52 HD13 LEU 52 -2.355 -0.647 2.680
381 HD21 LEU 52 HD21 LEU 52 -1.331 2.854 3.084
382 HD22 LEU 52 HD22 LEU 52 -2.251 3.160 4.556
383 HD23 LEU 52 HD23 LEU 52 -3.086 3.016 3.010
384 H GLU 53 HN GLU 53 -4.704 -0.575 7.096
385 HA GLU 53 HA GLU 53 -7.437 -0.466 6.641
386 HB2 GLU 53 HB2 GLU 53 -5.984 -1.712 8.979
387 HB3 GLU 53 HB1 GLU 53 -7.643 -2.058 8.514
388 HG2 GLU 53 HG2 GLU 53 -6.855 -2.939 6.368
389 HG3 GLU 53 HG1 GLU 53 -5.193 -2.603 6.855
390 H SER 54 HN SER 54 -5.750 0.426 9.654
391 HA SER 54 HA SER 54 -8.093 1.404 10.919
392 HB2 SER 54 HB2 SER 54 -6.356 2.392 12.534
393 HB3 SER 54 HB1 SER 54 -6.371 0.640 12.337
394 HG SER 54 HG SER 54 -4.344 0.884 11.858
395 H ARG 55 HN ARG 55 -5.780 2.845 8.798
396 HA ARG 55 HA ARG 55 -6.236 5.543 9.652
397 HB2 ARG 55 HB2 ARG 55 -4.078 4.806 8.716
398 HB3 ARG 55 HB1 ARG 55 -4.863 4.466 7.184
399 HG2 ARG 55 HG2 ARG 55 -5.256 6.773 6.770
400 HG3 ARG 55 HG1 ARG 55 -4.765 7.207 8.409
401 HD2 ARG 55 HD2 ARG 55 -2.510 6.693 7.983
402 HD3 ARG 55 HD1 ARG 55 -2.905 5.817 6.506
403 HE ARG 55 HE ARG 55 -3.704 8.262 5.850
404 HH11 ARG 55 HH11 ARG 55 -0.834 7.294 7.588
405 HH12 ARG 55 HH12 ARG 55 0.193 8.488 6.855
406 HH21 ARG 55 HH21 ARG 55 -2.371 9.871 4.876
407 HH22 ARG 55 HH22 ARG 55 -0.697 9.965 5.322
408 H TYR 56 HN TYR 56 -7.301 3.546 6.912
409 HA TYR 56 HA TYR 56 -8.937 5.812 6.007
410 HB2 TYR 56 HB2 TYR 56 -8.062 3.355 4.480
411 HB3 TYR 56 HB1 TYR 56 -8.998 4.694 3.822
412 HD1 TYR 56 HD2 TYR 56 -7.951 6.966 3.683
413 HD2 TYR 56 HD1 TYR 56 -5.701 3.494 4.656
414 HE1 TYR 56 HE2 TYR 56 -5.882 8.149 3.097
415 HE2 TYR 56 HE1 TYR 56 -3.623 4.670 4.070
416 HH TYR 56 HH TYR 56 -3.484 8.025 3.591
417 H GLY 57 HN GLY 57 -9.246 3.058 7.779
418 HA2 GLY 57 HA2 GLY 57 -11.170 2.175 8.702
419 HA3 GLY 57 HA1 GLY 57 -12.104 3.249 7.674
420 H VAL 58 HN VAL 58 -9.818 0.591 6.980
421 HA VAL 58 HA VAL 58 -12.042 -0.818 5.680
422 HB VAL 58 HB VAL 58 -10.308 -1.674 3.981
423 HG11 VAL 58 HG11 VAL 58 -11.263 1.170 3.803
424 HG12 VAL 58 HG12 VAL 58 -12.185 -0.270 3.373
425 HG13 VAL 58 HG13 VAL 58 -10.741 0.159 2.457
426 HG21 VAL 58 HG21 VAL 58 -8.899 0.763 5.029
427 HG22 VAL 58 HG22 VAL 58 -8.633 0.143 3.400
428 HG23 VAL 58 HG23 VAL 58 -8.265 -0.868 4.797
429 H SER 59 HN SER 59 -11.027 -3.065 4.919
430 HA SER 59 HA SER 59 -9.275 -4.215 6.937
431 HB2 SER 59 HB2 SER 59 -11.652 -4.509 7.747
432 HB3 SER 59 HB1 SER 59 -11.978 -5.442 6.286
433 HG SER 59 HG SER 59 -11.437 -6.930 7.796
434 H ILE 60 HN ILE 60 -7.777 -5.311 5.819
435 HA ILE 60 HA ILE 60 -8.365 -5.861 3.002
436 HB ILE 60 HB ILE 60 -5.743 -5.547 4.464
437 HG12 ILE 60 HG12 ILE 60 -6.911 -3.860 2.246
438 HG13 ILE 60 HG11 ILE 60 -7.190 -3.492 3.945
439 HG21 ILE 60 HG21 ILE 60 -6.237 -6.099 1.539
440 HG22 ILE 60 HG22 ILE 60 -5.509 -7.210 2.700
441 HG23 ILE 60 HG23 ILE 60 -4.676 -5.718 2.266
442 HD11 ILE 60 HD11 ILE 60 -4.761 -3.254 4.255
443 HD12 ILE 60 HD12 ILE 60 -5.390 -2.141 3.041
444 HD13 ILE 60 HD13 ILE 60 -4.519 -3.591 2.542
445 HA PRO 61 HA PRO 61 -8.540 -10.166 4.284
446 HB2 PRO 61 HB2 PRO 61 -9.466 -10.681 1.577
447 HB3 PRO 61 HB1 PRO 61 -10.350 -10.812 3.098
448 HG2 PRO 61 HG2 PRO 61 -10.891 -8.912 1.239
449 HG3 PRO 61 HG1 PRO 61 -11.140 -8.660 2.979
450 HD2 PRO 61 HD2 PRO 61 -8.868 -7.758 1.234
451 HD3 PRO 61 HD1 PRO 61 -9.732 -6.869 2.509
452 H ASP 62 HN ASP 62 -7.433 -12.027 3.857
453 HA ASP 62 HA ASP 62 -4.828 -11.790 2.906
454 HB2 ASP 62 HB2 ASP 62 -6.316 -14.405 3.122
455 HB3 ASP 62 HB1 ASP 62 -4.602 -14.104 3.389
456 H ASP 63 HN ASP 63 -7.627 -13.407 1.416
457 HA ASP 63 HA ASP 63 -6.076 -14.458 -0.742
458 HB2 ASP 63 HB2 ASP 63 -9.067 -14.267 -0.337
459 HB3 ASP 63 HB1 ASP 63 -8.323 -15.077 -1.710
460 H VAL 64 HN VAL 64 -7.983 -11.604 -0.259
461 HA VAL 64 HA VAL 64 -8.027 -10.914 -3.049
462 HB VAL 64 HB VAL 64 -8.589 -9.152 -0.655
463 HG11 VAL 64 HG11 VAL 64 -9.358 -8.843 -3.556
464 HG12 VAL 64 HG12 VAL 64 -8.147 -7.890 -2.698
465 HG13 VAL 64 HG13 VAL 64 -9.843 -7.781 -2.233
466 HG21 VAL 64 HG21 VAL 64 -10.037 -11.093 -0.655
467 HG22 VAL 64 HG22 VAL 64 -10.454 -10.807 -2.345
468 HG23 VAL 64 HG23 VAL 64 -10.950 -9.652 -1.105
469 H ALA 65 HN ALA 65 -6.099 -10.088 -0.221
470 HA ALA 65 HA ALA 65 -4.691 -7.917 -1.371
471 HB1 ALA 65 HB1 ALA 65 -3.842 -9.698 0.899
472 HB2 ALA 65 HB2 ALA 65 -4.876 -8.278 1.052
473 HB3 ALA 65 HB3 ALA 65 -3.201 -8.099 0.525
474 H GLY 66 HN GLY 66 -3.921 -11.337 -1.017
475 HA2 GLY 66 HA2 GLY 66 -1.284 -11.057 -2.121
476 HA3 GLY 66 HA1 GLY 66 -2.095 -12.565 -1.728
477 H ARG 67 HN ARG 67 -3.323 -10.086 -3.910
478 HA ARG 67 HA ARG 67 -2.673 -11.815 -6.191
479 HB2 ARG 67 HB2 ARG 67 -5.372 -10.622 -5.552
480 HB3 ARG 67 HB1 ARG 67 -4.941 -11.189 -7.163
481 HG2 ARG 67 HG2 ARG 67 -4.478 -13.424 -6.184
482 HG3 ARG 67 HG1 ARG 67 -5.077 -12.824 -4.638
483 HD2 ARG 67 HD2 ARG 67 -6.690 -12.805 -7.176
484 HD3 ARG 67 HD1 ARG 67 -6.738 -14.115 -6.002
485 HE ARG 67 HE ARG 67 -7.416 -12.237 -4.392
486 HH11 ARG 67 HH11 ARG 67 -8.199 -12.331 -7.801
487 HH12 ARG 67 HH12 ARG 67 -9.744 -11.558 -7.603
488 HH21 ARG 67 HH21 ARG 67 -9.481 -11.237 -4.125
489 HH22 ARG 67 HH22 ARG 67 -10.459 -10.912 -5.518
490 H VAL 68 HN VAL 68 -2.139 -8.972 -4.816
491 HA VAL 68 HA VAL 68 -2.221 -7.383 -7.266
492 HB VAL 68 HB VAL 68 -1.386 -5.514 -5.910
493 HG11 VAL 68 HG11 VAL 68 -3.724 -6.929 -4.640
494 HG12 VAL 68 HG12 VAL 68 -3.791 -5.862 -6.043
495 HG13 VAL 68 HG13 VAL 68 -3.338 -5.217 -4.464
496 HG21 VAL 68 HG21 VAL 68 -1.472 -7.436 -3.585
497 HG22 VAL 68 HG22 VAL 68 -1.090 -5.717 -3.506
498 HG23 VAL 68 HG23 VAL 68 -0.005 -6.824 -4.347
499 H ASP 69 HN ASP 69 -0.047 -5.941 -7.388
500 HA ASP 69 HA ASP 69 2.298 -7.611 -6.948
501 HB2 ASP 69 HB2 ASP 69 1.325 -8.116 -9.251
502 HB3 ASP 69 HB1 ASP 69 1.757 -6.468 -9.693
503 H THR 70 HN THR 70 1.235 -4.625 -8.563
504 HA THR 70 HA THR 70 3.443 -3.204 -7.246
505 HB THR 70 HB THR 70 2.979 -1.412 -8.963
506 HG1 THR 70 HG1 THR 70 1.842 -2.611 -10.880
507 HG21 THR 70 HG21 THR 70 4.086 -2.618 -10.804
508 HG22 THR 70 HG22 THR 70 3.747 -4.147 -9.993
509 HG23 THR 70 HG23 THR 70 4.829 -2.972 -9.244
510 HA PRO 71 HA PRO 71 0.860 -0.676 -4.642
511 HB2 PRO 71 HB2 PRO 71 2.066 1.629 -6.118
512 HB3 PRO 71 HB1 PRO 71 1.889 1.385 -4.378
513 HG2 PRO 71 HG2 PRO 71 4.242 1.023 -5.518
514 HG3 PRO 71 HG1 PRO 71 3.678 -0.123 -4.288
515 HD2 PRO 71 HD2 PRO 71 3.773 -0.421 -7.260
516 HD3 PRO 71 HD1 PRO 71 4.079 -1.632 -5.998
517 H ARG 72 HN ARG 72 1.055 0.165 -8.067
518 HA ARG 72 HA ARG 72 -1.193 1.741 -8.399
519 HB2 ARG 72 HB2 ARG 72 0.409 1.250 -10.183
520 HB3 ARG 72 HB1 ARG 72 -0.135 -0.416 -10.232
521 HG2 ARG 72 HG2 ARG 72 -2.358 0.353 -10.950
522 HG3 ARG 72 HG1 ARG 72 -1.762 2.015 -10.946
523 HD2 ARG 72 HD2 ARG 72 -0.652 -0.236 -12.615
524 HD3 ARG 72 HD1 ARG 72 -1.737 1.031 -13.196
525 HE ARG 72 HE ARG 72 0.178 2.561 -12.330
526 HH11 ARG 72 HH11 ARG 72 0.545 -0.481 -14.011
527 HH12 ARG 72 HH12 ARG 72 2.112 -0.088 -14.630
528 HH21 ARG 72 HH21 ARG 72 2.231 3.077 -13.151
529 HH22 ARG 72 HH22 ARG 72 3.096 1.913 -14.121
530 H GLU 73 HN GLU 73 -0.972 -1.782 -8.645
531 HA GLU 73 HA GLU 73 -3.721 -2.271 -9.017
532 HB2 GLU 73 HB2 GLU 73 -1.742 -4.153 -7.733
533 HB3 GLU 73 HB1 GLU 73 -3.189 -4.578 -8.635
534 HG2 GLU 73 HG2 GLU 73 -0.735 -3.271 -9.794
535 HG3 GLU 73 HG1 GLU 73 -1.117 -4.989 -9.880
536 H LEU 74 HN LEU 74 -1.668 -2.248 -6.148
537 HA LEU 74 HA LEU 74 -3.531 -3.194 -4.268
538 HB2 LEU 74 HB2 LEU 74 -1.004 -2.917 -4.063
539 HB3 LEU 74 HB1 LEU 74 -1.310 -1.232 -3.719
540 HG LEU 74 HG LEU 74 -0.893 -2.747 -1.731
541 HD11 LEU 74 HD11 LEU 74 -2.606 -1.686 -0.340
542 HD12 LEU 74 HD12 LEU 74 -3.463 -1.178 -1.796
543 HD13 LEU 74 HD13 LEU 74 -1.856 -0.541 -1.450
544 HD21 LEU 74 HD21 LEU 74 -3.688 -3.672 -2.376
545 HD22 LEU 74 HD22 LEU 74 -2.776 -4.064 -0.917
546 HD23 LEU 74 HD23 LEU 74 -2.222 -4.644 -2.489
547 H LEU 75 HN LEU 75 -2.668 0.121 -5.204
548 HA LEU 75 HA LEU 75 -4.337 1.461 -3.430
549 HB2 LEU 75 HB2 LEU 75 -2.563 2.510 -4.800
550 HB3 LEU 75 HB1 LEU 75 -3.571 2.308 -6.220
551 HG LEU 75 HG LEU 75 -5.245 3.830 -5.251
552 HD11 LEU 75 HD11 LEU 75 -4.686 5.133 -3.250
553 HD12 LEU 75 HD12 LEU 75 -3.245 4.142 -3.013
554 HD13 LEU 75 HD13 LEU 75 -4.848 3.414 -2.893
555 HD21 LEU 75 HD21 LEU 75 -3.918 5.896 -5.426
556 HD22 LEU 75 HD22 LEU 75 -3.549 4.748 -6.714
557 HD23 LEU 75 HD23 LEU 75 -2.441 4.938 -5.353
558 H ASP 76 HN ASP 76 -4.973 0.470 -6.776
559 HA ASP 76 HA ASP 76 -7.573 1.554 -6.897
560 HB2 ASP 76 HB2 ASP 76 -6.125 0.924 -8.859
561 HB3 ASP 76 HB1 ASP 76 -6.518 -0.760 -8.525
562 H LEU 77 HN LEU 77 -6.361 -1.573 -5.868
563 HA LEU 77 HA LEU 77 -8.778 -3.005 -5.859
564 HB2 LEU 77 HB2 LEU 77 -6.565 -4.044 -5.609
565 HB3 LEU 77 HB1 LEU 77 -6.375 -3.284 -4.044
566 HG LEU 77 HG LEU 77 -8.342 -4.602 -3.234
567 HD11 LEU 77 HD11 LEU 77 -8.034 -6.017 -5.877
568 HD12 LEU 77 HD12 LEU 77 -9.406 -5.027 -5.379
569 HD13 LEU 77 HD13 LEU 77 -9.055 -6.536 -4.537
570 HD21 LEU 77 HD21 LEU 77 -6.032 -6.212 -4.312
571 HD22 LEU 77 HD22 LEU 77 -7.107 -6.680 -2.993
572 HD23 LEU 77 HD23 LEU 77 -6.034 -5.294 -2.805
573 H ILE 78 HN ILE 78 -7.237 -0.992 -3.405
574 HA ILE 78 HA ILE 78 -9.348 -1.421 -1.497
575 HB ILE 78 HB ILE 78 -7.079 0.583 -1.456
576 HG12 ILE 78 HG12 ILE 78 -7.374 -2.129 -0.143
577 HG13 ILE 78 HG11 ILE 78 -6.325 -1.756 -1.506
578 HG21 ILE 78 HG21 ILE 78 -8.959 -0.307 0.737
579 HG22 ILE 78 HG22 ILE 78 -8.878 1.295 0.003
580 HG23 ILE 78 HG23 ILE 78 -7.530 0.700 0.970
581 HD11 ILE 78 HD11 ILE 78 -6.073 -0.748 1.321
582 HD12 ILE 78 HD12 ILE 78 -5.087 -0.190 -0.033
583 HD13 ILE 78 HD13 ILE 78 -5.009 -1.877 0.477
584 H ASN 79 HN ASN 79 -8.427 1.082 -3.813
585 HA ASN 79 HA ASN 79 -10.286 3.052 -3.128
586 HB2 ASN 79 HB2 ASN 79 -9.128 2.260 -5.799
587 HB3 ASN 79 HB1 ASN 79 -10.241 3.608 -5.627
588 HD21 ASN 79 HD21 ASN 79 -9.106 4.307 -2.981
589 HD22 ASN 79 HD22 ASN 79 -7.612 5.104 -3.335
590 H GLY 80 HN GLY 80 -10.626 0.207 -5.205
591 HA2 GLY 80 HA2 GLY 80 -13.145 0.669 -6.262
592 HA3 GLY 80 HA1 GLY 80 -12.465 -0.922 -5.965
593 H ALA 81 HN ALA 81 -12.316 -0.762 -3.136
594 HA ALA 81 HA ALA 81 -15.024 -1.450 -2.496
595 HB1 ALA 81 HB1 ALA 81 -14.156 -1.995 -0.291
596 HB2 ALA 81 HB2 ALA 81 -12.628 -1.199 -0.674
597 HB3 ALA 81 HB3 ALA 81 -13.112 -2.653 -1.548
598 H LEU 82 HN LEU 82 -12.841 1.190 -1.642
599 HA LEU 82 HA LEU 82 -14.617 2.458 0.171
600 HB2 LEU 82 HB2 LEU 82 -12.146 3.301 -1.306
601 HB3 LEU 82 HB1 LEU 82 -13.062 4.468 -0.376
602 HG LEU 82 HG LEU 82 -11.834 1.941 0.731
603 HD11 LEU 82 HD11 LEU 82 -10.248 3.439 1.836
604 HD12 LEU 82 HD12 LEU 82 -10.950 4.815 0.986
605 HD13 LEU 82 HD13 LEU 82 -10.124 3.545 0.081
606 HD21 LEU 82 HD21 LEU 82 -13.205 4.252 2.103
607 HD22 LEU 82 HD22 LEU 82 -12.384 2.919 2.914
608 HD23 LEU 82 HD23 LEU 82 -13.827 2.610 1.949
609 H ALA 83 HN ALA 83 -14.239 2.540 -3.284
610 HA ALA 83 HA ALA 83 -15.650 4.943 -3.797
611 HB1 ALA 83 HB1 ALA 83 -15.758 4.166 -6.096
612 HB2 ALA 83 HB2 ALA 83 -15.270 2.548 -5.586
613 HB3 ALA 83 HB3 ALA 83 -14.154 3.901 -5.418
614 H GLU 84 HN GLU 84 -16.726 1.861 -2.804
615 HA GLU 84 HA GLU 84 -19.308 1.984 -4.063
616 HB2 GLU 84 HB2 GLU 84 -18.344 0.199 -1.819
617 HB3 GLU 84 HB1 GLU 84 -19.825 -0.013 -2.743
618 HG2 GLU 84 HG2 GLU 84 -18.467 -0.309 -4.780
619 HG3 GLU 84 HG1 GLU 84 -17.011 -0.210 -3.789
620 H ALA 85 HN ALA 85 -17.942 3.458 -1.362
621 HA ALA 85 HA ALA 85 -20.068 3.376 0.489
622 HB1 ALA 85 HB1 ALA 85 -18.924 5.238 1.591
623 HB2 ALA 85 HB2 ALA 85 -17.903 5.448 0.168
624 HB3 ALA 85 HB3 ALA 85 -17.786 3.972 1.124
625 H ALA 86 HN ALA 86 -21.884 4.495 0.651
626 HA ALA 86 HA ALA 86 -22.200 7.076 -0.634
627 HB1 ALA 86 HB1 ALA 86 -24.068 4.774 -1.203
628 HB2 ALA 86 HB2 ALA 86 -22.954 5.511 -2.355
629 HB3 ALA 86 HB3 ALA 86 -24.304 6.446 -1.713
630 H28 SXO 87 H28B SXO 87 5.235 -12.161 5.932
631 H28A SXO 87 H28A SXO 87 6.011 -13.350 6.981
632 H30 SXO 87 H30A SXO 87 2.285 -13.516 7.415
633 H30A SXO 87 H30C SXO 87 3.779 -13.000 8.199
634 H30B SXO 87 H30B SXO 87 3.130 -12.078 6.843
635 H31 SXO 87 H31A SXO 87 3.957 -14.506 4.229
636 H31A SXO 87 H31B SXO 87 3.087 -13.019 4.606
637 H31B SXO 87 H31C SXO 87 2.411 -14.579 5.082
638 H32 SXO 87 H32A SXO 87 4.613 -15.264 7.905
639 HO33 SXO 87 H33A SXO 87 4.859 -16.440 5.345
640 HN36 SXO 87 H36A SXO 87 2.109 -14.925 8.135
641 H37 SXO 87 H37A SXO 87 0.798 -17.451 7.415
642 H37A SXO 87 H37B SXO 87 0.345 -16.360 8.721
643 H38 SXO 87 H38B SXO 87 -0.352 -14.707 6.948
644 H38A SXO 87 H38A SXO 87 -1.341 -16.161 7.100
645 HN41 SXO 87 H41A SXO 87 -0.851 -14.271 4.893
646 H42 SXO 87 H42A SXO 87 0.656 -15.277 2.805
647 H42A SXO 87 H42B SXO 87 -0.918 -16.072 2.724
648 H43 SXO 87 H43B SXO 87 -0.783 -14.044 1.311
649 H43A SXO 87 H43A SXO 87 -2.023 -13.916 2.570
650 H2 SXO 87 H2A SXO 87 -0.458 -9.962 3.424
651 H2A SXO 87 H2B SXO 87 -2.141 -9.801 2.923
652 H3 SXO 87 H3B SXO 87 0.288 -9.126 1.268
653 H3A SXO 87 H3A SXO 87 -1.387 -9.007 0.726
654 H4 SXO 87 H4A SXO 87 -0.122 -7.486 2.999
655 H4A SXO 87 H4B SXO 87 -1.832 -7.420 2.560
656 H5 SXO 87 H5B SXO 87 0.461 -6.639 0.759
657 H5A SXO 87 H5A SXO 87 -1.257 -6.538 0.363
658 H6 SXO 87 H6A SXO 87 0.109 -5.041 2.603
659 H6A SXO 87 H6B SXO 87 -1.594 -4.922 2.152
660 H7 SXO 87 H7A SXO 87 -0.999 -4.003 -0.004
661 H7A SXO 87 H7B SXO 87 0.722 -4.197 0.361
662 H8 SXO 87 H8C SXO 87 -1.236 -2.464 1.866
663 H8A SXO 87 H8A SXO 87 -0.016 -1.893 0.729
664 H8B SXO 87 H8B SXO 87 0.477 -2.650 2.244
Start of MODEL 14
1 H1 MET 1 HT1 MET 1 -19.202 13.740 2.933
2 H2 MET 1 HT2 MET 1 -17.892 13.624 4.007
3 H3 MET 1 HT3 MET 1 -18.954 12.318 3.824
4 HA MET 1 HA MET 1 -18.270 12.029 1.538
5 HB2 MET 1 HB2 MET 1 -16.361 13.270 0.661
6 HB3 MET 1 HB1 MET 1 -17.652 14.374 1.091
7 HG2 MET 1 HG2 MET 1 -16.496 14.957 3.151
8 HG3 MET 1 HG1 MET 1 -15.209 13.820 2.755
9 HE1 MET 1 HE1 MET 1 -13.537 17.354 2.295
10 HE2 MET 1 HE2 MET 1 -13.413 15.789 3.098
11 HE3 MET 1 HE3 MET 1 -14.737 16.884 3.497
12 H ALA 2 HN ALA 2 -16.720 10.454 1.150
13 HA ALA 2 HA ALA 2 -15.360 9.488 3.535
14 HB1 ALA 2 HB1 ALA 2 -15.032 7.431 2.271
15 HB2 ALA 2 HB2 ALA 2 -15.686 8.201 0.826
16 HB3 ALA 2 HB3 ALA 2 -16.724 7.930 2.225
17 H THR 3 HN THR 3 -13.170 9.199 3.705
18 HA THR 3 HA THR 3 -11.570 10.870 1.966
19 HB THR 3 HB THR 3 -11.136 11.153 4.299
20 HG1 THR 3 HG1 THR 3 -9.060 9.619 3.096
21 HG21 THR 3 HG21 THR 3 -10.621 8.184 4.444
22 HG22 THR 3 HG22 THR 3 -11.996 9.039 5.140
23 HG23 THR 3 HG23 THR 3 -10.370 9.332 5.761
24 H LEU 4 HN LEU 4 -10.897 10.006 0.133
25 HA LEU 4 HA LEU 4 -10.544 7.188 -0.242
26 HB2 LEU 4 HB2 LEU 4 -9.905 9.540 -2.023
27 HB3 LEU 4 HB1 LEU 4 -9.758 7.863 -2.510
28 HG LEU 4 HG LEU 4 -12.337 9.201 -1.683
29 HD11 LEU 4 HD11 LEU 4 -12.924 9.080 -4.048
30 HD12 LEU 4 HD12 LEU 4 -11.321 8.443 -4.420
31 HD13 LEU 4 HD13 LEU 4 -11.498 10.083 -3.795
32 HD21 LEU 4 HD21 LEU 4 -12.316 6.816 -1.208
33 HD22 LEU 4 HD22 LEU 4 -11.779 6.475 -2.852
34 HD23 LEU 4 HD23 LEU 4 -13.380 7.161 -2.571
35 H LEU 5 HN LEU 5 -8.606 6.136 -0.834
36 HA LEU 5 HA LEU 5 -6.238 7.146 0.481
37 HB2 LEU 5 HB2 LEU 5 -6.842 4.785 0.683
38 HB3 LEU 5 HB1 LEU 5 -6.746 4.596 -1.056
39 HG LEU 5 HG LEU 5 -4.333 5.046 -0.976
40 HD11 LEU 5 HD11 LEU 5 -4.288 6.498 0.979
41 HD12 LEU 5 HD12 LEU 5 -3.175 5.143 1.173
42 HD13 LEU 5 HD13 LEU 5 -4.729 5.135 2.008
43 HD21 LEU 5 HD21 LEU 5 -5.118 2.744 -0.834
44 HD22 LEU 5 HD22 LEU 5 -5.236 2.885 0.920
45 HD23 LEU 5 HD23 LEU 5 -3.660 2.975 0.133
46 H THR 6 HN THR 6 -4.585 8.178 -0.548
47 HA THR 6 HA THR 6 -4.783 8.386 -3.480
48 HB THR 6 HB THR 6 -3.734 10.545 -3.333
49 HG1 THR 6 HG1 THR 6 -3.713 10.667 -0.544
50 HG21 THR 6 HG21 THR 6 -6.135 10.525 -2.976
51 HG22 THR 6 HG22 THR 6 -5.390 11.781 -1.986
52 HG23 THR 6 HG23 THR 6 -5.900 10.262 -1.248
53 H THR 7 HN THR 7 -2.604 9.078 -4.456
54 HA THR 7 HA THR 7 -0.659 7.102 -4.229
55 HB THR 7 HB THR 7 -0.194 9.947 -5.160
56 HG1 THR 7 HG1 THR 7 -0.771 8.766 -7.269
57 HG21 THR 7 HG21 THR 7 1.056 7.319 -5.964
58 HG22 THR 7 HG22 THR 7 1.823 8.594 -5.019
59 HG23 THR 7 HG23 THR 7 1.402 8.882 -6.706
60 H ASP 8 HN ASP 8 -0.655 10.433 -2.936
61 HA ASP 8 HA ASP 8 1.922 10.171 -1.755
62 HB2 ASP 8 HB2 ASP 8 1.018 12.351 -2.439
63 HB3 ASP 8 HB1 ASP 8 -0.231 12.224 -1.204
64 H ASP 9 HN ASP 9 -1.382 9.883 -0.490
65 HA ASP 9 HA ASP 9 -0.660 9.617 2.222
66 HB2 ASP 9 HB2 ASP 9 -3.046 8.637 0.664
67 HB3 ASP 9 HB1 ASP 9 -2.850 8.280 2.377
68 H LEU 10 HN LEU 10 -0.929 7.258 -0.385
69 HA LEU 10 HA LEU 10 -0.283 4.966 1.114
70 HB2 LEU 10 HB2 LEU 10 -1.145 4.836 -1.162
71 HB3 LEU 10 HB1 LEU 10 0.287 5.634 -1.776
72 HG LEU 10 HG LEU 10 1.644 3.682 -1.045
73 HD11 LEU 10 HD11 LEU 10 0.505 1.602 -0.465
74 HD12 LEU 10 HD12 LEU 10 -1.041 2.452 -0.456
75 HD13 LEU 10 HD13 LEU 10 0.200 2.865 0.729
76 HD21 LEU 10 HD21 LEU 10 0.884 2.181 -2.828
77 HD22 LEU 10 HD22 LEU 10 0.879 3.867 -3.348
78 HD23 LEU 10 HD23 LEU 10 -0.636 3.071 -2.922
79 H ARG 11 HN ARG 11 1.721 7.260 -0.674
80 HA ARG 11 HA ARG 11 4.250 6.234 -0.217
81 HB2 ARG 11 HB2 ARG 11 3.890 8.056 -1.733
82 HB3 ARG 11 HB1 ARG 11 3.271 9.080 -0.448
83 HG2 ARG 11 HG2 ARG 11 5.530 9.060 0.578
84 HG3 ARG 11 HG1 ARG 11 6.108 8.156 -0.826
85 HD2 ARG 11 HD2 ARG 11 4.789 10.867 -0.934
86 HD3 ARG 11 HD1 ARG 11 6.529 10.589 -0.997
87 HE ARG 11 HE ARG 11 6.014 9.250 -3.074
88 HH11 ARG 11 HH11 ARG 11 3.955 11.905 -2.022
89 HH12 ARG 11 HH12 ARG 11 3.451 12.301 -3.637
90 HH21 ARG 11 HH21 ARG 11 5.312 9.767 -5.182
91 HH22 ARG 11 HH22 ARG 11 4.213 11.084 -5.433
92 H ARG 12 HN ARG 12 2.138 7.933 1.980
93 HA ARG 12 HA ARG 12 4.212 8.507 3.897
94 HB2 ARG 12 HB2 ARG 12 1.208 8.644 4.195
95 HB3 ARG 12 HB1 ARG 12 2.380 9.293 5.331
96 HG2 ARG 12 HG2 ARG 12 2.091 10.200 2.474
97 HG3 ARG 12 HG1 ARG 12 1.353 11.004 3.861
98 HD2 ARG 12 HD2 ARG 12 3.377 12.154 3.252
99 HD3 ARG 12 HD1 ARG 12 3.612 11.354 4.804
100 HE ARG 12 HE ARG 12 4.503 9.647 2.773
101 HH11 ARG 12 HH11 ARG 12 5.364 12.722 4.212
102 HH12 ARG 12 HH12 ARG 12 7.072 12.515 3.932
103 HH21 ARG 12 HH21 ARG 12 6.755 9.366 2.432
104 HH22 ARG 12 HH22 ARG 12 7.862 10.600 2.952
105 H ALA 13 HN ALA 13 1.843 5.989 3.379
106 HA ALA 13 HA ALA 13 1.743 4.937 5.977
107 HB1 ALA 13 HB1 ALA 13 0.129 4.415 4.200
108 HB2 ALA 13 HB2 ALA 13 0.777 2.966 4.971
109 HB3 ALA 13 HB3 ALA 13 1.365 3.461 3.382
110 H LEU 14 HN LEU 14 3.929 4.257 3.291
111 HA LEU 14 HA LEU 14 5.201 2.011 4.418
112 HB2 LEU 14 HB2 LEU 14 6.119 4.052 2.403
113 HB3 LEU 14 HB1 LEU 14 7.147 2.731 2.916
114 HG LEU 14 HG LEU 14 6.176 2.094 0.846
115 HD11 LEU 14 HD11 LEU 14 4.922 0.097 1.408
116 HD12 LEU 14 HD12 LEU 14 4.657 0.711 3.040
117 HD13 LEU 14 HD13 LEU 14 6.288 0.321 2.499
118 HD21 LEU 14 HD21 LEU 14 3.798 2.044 0.410
119 HD22 LEU 14 HD22 LEU 14 4.324 3.678 0.812
120 HD23 LEU 14 HD23 LEU 14 3.471 2.706 2.012
121 H VAL 15 HN VAL 15 5.680 5.454 4.850
122 HA VAL 15 HA VAL 15 8.159 5.153 6.304
123 HB VAL 15 HB VAL 15 6.383 7.594 6.133
124 HG11 VAL 15 HG11 VAL 15 8.069 7.631 7.926
125 HG12 VAL 15 HG12 VAL 15 8.379 8.843 6.684
126 HG13 VAL 15 HG13 VAL 15 9.329 7.359 6.724
127 HG21 VAL 15 HG21 VAL 15 6.950 6.880 3.891
128 HG22 VAL 15 HG22 VAL 15 8.652 6.753 4.336
129 HG23 VAL 15 HG23 VAL 15 7.863 8.329 4.308
130 H GLU 16 HN GLU 16 4.754 5.722 7.032
131 HA GLU 16 HA GLU 16 4.948 6.150 9.792
132 HB2 GLU 16 HB2 GLU 16 2.748 4.808 8.204
133 HB3 GLU 16 HB1 GLU 16 2.601 5.309 9.882
134 HG2 GLU 16 HG2 GLU 16 2.948 7.627 9.234
135 HG3 GLU 16 HG1 GLU 16 3.112 7.137 7.546
136 H SER 17 HN SER 17 4.929 3.214 7.907
137 HA SER 17 HA SER 17 4.744 1.523 10.242
138 HB2 SER 17 HB2 SER 17 5.277 0.717 7.386
139 HB3 SER 17 HB1 SER 17 4.652 -0.296 8.691
140 HG SER 17 HG SER 17 3.370 1.746 7.237
141 H ALA 18 HN ALA 18 7.150 1.978 7.629
142 HA ALA 18 HA ALA 18 9.142 0.749 9.420
143 HB1 ALA 18 HB1 ALA 18 8.696 -0.593 7.437
144 HB2 ALA 18 HB2 ALA 18 10.341 0.041 7.407
145 HB3 ALA 18 HB3 ALA 18 9.096 0.780 6.403
146 H GLY 19 HN GLY 19 9.343 2.766 6.493
147 HA2 GLY 19 HA2 GLY 19 10.301 4.860 6.210
148 HA3 GLY 19 HA1 GLY 19 10.560 4.942 7.943
149 H GLU 20 HN GLU 20 12.461 4.134 8.826
150 HA GLU 20 HA GLU 20 14.676 3.725 8.952
151 HB2 GLU 20 HB2 GLU 20 14.047 2.211 6.426
152 HB3 GLU 20 HB1 GLU 20 15.674 2.269 7.073
153 HG2 GLU 20 HG2 GLU 20 14.635 1.438 9.257
154 HG3 GLU 20 HG1 GLU 20 13.232 1.033 8.267
155 H THR 21 HN THR 21 16.776 3.777 7.228
156 HA THR 21 HA THR 21 16.927 6.549 6.551
157 HB THR 21 HB THR 21 19.284 5.867 5.840
158 HG1 THR 21 HG1 THR 21 19.130 3.694 5.459
159 HG21 THR 21 HG21 THR 21 18.843 6.819 8.041
160 HG22 THR 21 HG22 THR 21 20.046 5.534 8.164
161 HG23 THR 21 HG23 THR 21 18.379 5.230 8.650
162 H ASP 22 HN ASP 22 18.600 6.501 4.302
163 HA ASP 22 HA ASP 22 16.640 6.206 2.234
164 HB2 ASP 22 HB2 ASP 22 19.551 7.027 2.105
165 HB3 ASP 22 HB1 ASP 22 18.450 7.039 0.729
166 H GLY 23 HN GLY 23 16.490 3.830 2.741
167 HA2 GLY 23 HA2 GLY 23 18.539 2.209 1.441
168 HA3 GLY 23 HA1 GLY 23 17.091 1.611 2.245
169 H THR 24 HN THR 24 15.631 3.779 0.658
170 HA THR 24 HA THR 24 15.810 2.955 -2.076
171 HB THR 24 HB THR 24 14.510 1.070 -1.073
172 HG1 THR 24 HG1 THR 24 12.687 1.323 -2.581
173 HG21 THR 24 HG21 THR 24 12.222 1.466 -0.285
174 HG22 THR 24 HG22 THR 24 12.447 3.204 -0.480
175 HG23 THR 24 HG23 THR 24 13.389 2.323 0.722
176 H ASP 25 HN ASP 25 13.530 3.970 -3.128
177 HA ASP 25 HA ASP 25 13.123 6.544 -1.787
178 HB2 ASP 25 HB2 ASP 25 13.965 7.791 -3.453
179 HB3 ASP 25 HB1 ASP 25 14.746 6.314 -3.992
180 H LEU 26 HN LEU 26 11.132 7.390 -1.907
181 HA LEU 26 HA LEU 26 9.083 5.772 -3.280
182 HB2 LEU 26 HB2 LEU 26 8.821 7.462 -0.785
183 HB3 LEU 26 HB1 LEU 26 7.518 6.570 -1.544
184 HG LEU 26 HG LEU 26 9.974 5.332 -0.295
185 HD11 LEU 26 HD11 LEU 26 8.513 6.332 1.372
186 HD12 LEU 26 HD12 LEU 26 8.425 4.573 1.445
187 HD13 LEU 26 HD13 LEU 26 7.125 5.490 0.684
188 HD21 LEU 26 HD21 LEU 26 8.775 3.221 -0.594
189 HD22 LEU 26 HD22 LEU 26 9.092 4.008 -2.140
190 HD23 LEU 26 HD23 LEU 26 7.479 4.074 -1.432
191 H SER 27 HN SER 27 10.709 8.150 -4.186
192 HA SER 27 HA SER 27 8.568 10.134 -4.525
193 HB2 SER 27 HB2 SER 27 10.430 11.625 -5.341
194 HB3 SER 27 HB1 SER 27 10.581 11.120 -3.663
195 HG SER 27 HG SER 27 11.822 9.296 -5.132
196 H GLY 28 HN GLY 28 10.542 7.841 -6.208
197 HA2 GLY 28 HA2 GLY 28 9.899 8.830 -8.836
198 HA3 GLY 28 HA1 GLY 28 10.715 7.321 -8.453
199 H ASP 29 HN ASP 29 9.356 6.504 -10.207
200 HA ASP 29 HA ASP 29 6.515 6.344 -9.756
201 HB2 ASP 29 HB2 ASP 29 6.610 4.861 -11.834
202 HB3 ASP 29 HB1 ASP 29 7.104 6.539 -12.030
203 H PHE 30 HN PHE 30 6.626 5.287 -7.690
204 HA PHE 30 HA PHE 30 7.582 2.579 -7.549
205 HB2 PHE 30 HB2 PHE 30 6.606 2.613 -5.252
206 HB3 PHE 30 HB1 PHE 30 7.741 3.919 -5.557
207 HD1 PHE 30 HD2 PHE 30 6.959 6.225 -5.743
208 HD2 PHE 30 HD1 PHE 30 4.284 3.042 -4.863
209 HE1 PHE 30 HE2 PHE 30 5.266 7.858 -5.011
210 HE2 PHE 30 HE1 PHE 30 2.588 4.662 -4.136
211 HZ PHE 30 HZ PHE 30 3.106 7.090 -4.170
212 H LEU 31 HN LEU 31 4.487 4.143 -8.008
213 HA LEU 31 HA LEU 31 2.725 2.041 -7.542
214 HB2 LEU 31 HB2 LEU 31 2.594 4.227 -9.619
215 HB3 LEU 31 HB1 LEU 31 1.264 3.149 -9.252
216 HG LEU 31 HG LEU 31 2.519 4.962 -7.213
217 HD11 LEU 31 HD11 LEU 31 1.601 6.338 -8.977
218 HD12 LEU 31 HD12 LEU 31 0.568 6.419 -7.549
219 HD13 LEU 31 HD13 LEU 31 0.092 5.429 -8.928
220 HD21 LEU 31 HD21 LEU 31 1.356 3.235 -6.121
221 HD22 LEU 31 HD22 LEU 31 0.031 3.288 -7.280
222 HD23 LEU 31 HD23 LEU 31 0.252 4.608 -6.133
223 H ASP 32 HN ASP 32 4.897 2.583 -10.193
224 HA ASP 32 HA ASP 32 3.473 0.723 -11.935
225 HB2 ASP 32 HB2 ASP 32 4.368 3.097 -12.555
226 HB3 ASP 32 HB1 ASP 32 5.926 2.292 -12.680
227 H LEU 33 HN LEU 33 5.273 0.089 -9.547
228 HA LEU 33 HA LEU 33 6.774 -2.056 -10.858
229 HB2 LEU 33 HB2 LEU 33 7.878 -0.186 -8.750
230 HB3 LEU 33 HB1 LEU 33 8.647 -1.676 -9.247
231 HG LEU 33 HG LEU 33 8.164 0.678 -11.079
232 HD11 LEU 33 HD11 LEU 33 10.546 1.126 -10.837
233 HD12 LEU 33 HD12 LEU 33 10.693 -0.199 -9.682
234 HD13 LEU 33 HD13 LEU 33 9.734 1.222 -9.272
235 HD21 LEU 33 HD21 LEU 33 8.301 -1.523 -12.184
236 HD22 LEU 33 HD22 LEU 33 9.871 -1.789 -11.423
237 HD23 LEU 33 HD23 LEU 33 9.664 -0.480 -12.588
238 H ARG 34 HN ARG 34 7.284 -3.808 -9.267
239 HA ARG 34 HA ARG 34 5.010 -4.264 -7.572
240 HB2 ARG 34 HB2 ARG 34 7.581 -5.839 -7.727
241 HB3 ARG 34 HB1 ARG 34 6.083 -6.369 -6.984
242 HG2 ARG 34 HG2 ARG 34 5.005 -6.288 -9.210
243 HG3 ARG 34 HG1 ARG 34 6.585 -5.908 -9.911
244 HD2 ARG 34 HD2 ARG 34 7.453 -7.985 -8.797
245 HD3 ARG 34 HD1 ARG 34 5.785 -8.383 -8.395
246 HE ARG 34 HE ARG 34 5.835 -7.974 -11.124
247 HH11 ARG 34 HH11 ARG 34 7.356 -10.110 -8.800
248 HH12 ARG 34 HH12 ARG 34 7.560 -11.408 -9.941
249 HH21 ARG 34 HH21 ARG 34 6.091 -9.691 -12.625
250 HH22 ARG 34 HH22 ARG 34 6.852 -11.170 -12.113
251 H PHE 35 HN PHE 35 5.121 -4.725 -5.275
252 HA PHE 35 HA PHE 35 6.539 -2.931 -3.679
253 HB2 PHE 35 HB2 PHE 35 5.461 -5.665 -2.951
254 HB3 PHE 35 HB1 PHE 35 5.990 -4.455 -1.789
255 HD1 PHE 35 HD2 PHE 35 4.784 -2.189 -1.826
256 HD2 PHE 35 HD1 PHE 35 3.265 -5.698 -3.703
257 HE1 PHE 35 HE2 PHE 35 2.529 -1.207 -1.829
258 HE2 PHE 35 HE1 PHE 35 1.006 -4.719 -3.708
259 HZ PHE 35 HZ PHE 35 0.632 -2.484 -2.743
260 H GLU 36 HN GLU 36 7.351 -6.212 -4.686
261 HA GLU 36 HA GLU 36 9.731 -6.470 -3.213
262 HB2 GLU 36 HB2 GLU 36 10.262 -8.305 -4.766
263 HB3 GLU 36 HB1 GLU 36 8.622 -8.403 -4.149
264 HG2 GLU 36 HG2 GLU 36 7.827 -7.378 -6.266
265 HG3 GLU 36 HG1 GLU 36 9.478 -7.474 -6.875
266 H ASP 37 HN ASP 37 9.015 -4.643 -6.040
267 HA ASP 37 HA ASP 37 11.730 -4.591 -7.035
268 HB2 ASP 37 HB2 ASP 37 9.252 -3.058 -7.834
269 HB3 ASP 37 HB1 ASP 37 10.824 -2.784 -8.570
270 H ILE 38 HN ILE 38 9.641 -2.619 -5.048
271 HA ILE 38 HA ILE 38 11.625 -0.492 -4.957
272 HB ILE 38 HB ILE 38 9.970 0.648 -3.439
273 HG12 ILE 38 HG12 ILE 38 8.205 -1.636 -4.352
274 HG13 ILE 38 HG11 ILE 38 8.746 -1.347 -2.703
275 HG21 ILE 38 HG21 ILE 38 9.054 -0.102 -6.208
276 HG22 ILE 38 HG22 ILE 38 10.194 1.181 -5.808
277 HG23 ILE 38 HG23 ILE 38 8.511 1.301 -5.290
278 HD11 ILE 38 HD11 ILE 38 7.467 0.701 -2.607
279 HD12 ILE 38 HD12 ILE 38 6.429 -0.645 -3.085
280 HD13 ILE 38 HD13 ILE 38 6.996 0.505 -4.295
281 H GLY 39 HN GLY 39 11.453 -3.354 -3.552
282 HA2 GLY 39 HA2 GLY 39 12.878 -4.177 -1.937
283 HA3 GLY 39 HA1 GLY 39 13.326 -2.531 -1.534
284 H TYR 40 HN TYR 40 10.187 -4.243 -1.403
285 HA TYR 40 HA TYR 40 10.223 -3.751 1.491
286 HB2 TYR 40 HB2 TYR 40 8.005 -3.286 -0.466
287 HB3 TYR 40 HB1 TYR 40 7.632 -3.676 1.211
288 HD1 TYR 40 HD2 TYR 40 8.238 -2.126 3.012
289 HD2 TYR 40 HD1 TYR 40 8.993 -1.181 -1.057
290 HE1 TYR 40 HE2 TYR 40 8.565 0.231 3.627
291 HE2 TYR 40 HE1 TYR 40 9.329 1.175 -0.458
292 HH TYR 40 HH TYR 40 8.588 2.719 1.398
293 H ASP 41 HN ASP 41 10.449 -5.549 2.503
294 HA ASP 41 HA ASP 41 9.799 -8.116 1.472
295 HB2 ASP 41 HB2 ASP 41 10.505 -7.246 4.285
296 HB3 ASP 41 HB1 ASP 41 10.414 -8.917 3.737
297 H SER 42 HN SER 42 8.390 -9.665 2.561
298 HA SER 42 HA SER 42 5.749 -8.886 2.591
299 HB2 SER 42 HB2 SER 42 5.891 -11.152 4.250
300 HB3 SER 42 HB1 SER 42 5.578 -11.107 2.514
301 H LEU 43 HN LEU 43 7.876 -9.410 5.394
302 HA LEU 43 HA LEU 43 5.992 -9.006 7.403
303 HB2 LEU 43 HB2 LEU 43 8.256 -9.857 7.795
304 HB3 LEU 43 HB1 LEU 43 8.919 -8.279 7.419
305 HG LEU 43 HG LEU 43 7.771 -7.335 9.391
306 HD11 LEU 43 HD11 LEU 43 6.756 -8.828 11.029
307 HD12 LEU 43 HD12 LEU 43 7.001 -10.198 9.944
308 HD13 LEU 43 HD13 LEU 43 5.900 -8.899 9.490
309 HD21 LEU 43 HD21 LEU 43 10.076 -8.113 9.561
310 HD22 LEU 43 HD22 LEU 43 9.509 -9.732 9.966
311 HD23 LEU 43 HD23 LEU 43 9.203 -8.391 11.068
312 H ALA 44 HN ALA 44 8.185 -6.585 5.976
313 HA ALA 44 HA ALA 44 7.158 -4.399 7.433
314 HB1 ALA 44 HB1 ALA 44 9.349 -4.359 6.343
315 HB2 ALA 44 HB2 ALA 44 8.351 -3.000 5.828
316 HB3 ALA 44 HB3 ALA 44 8.564 -4.391 4.764
317 H LEU 45 HN LEU 45 6.252 -5.886 4.399
318 HA LEU 45 HA LEU 45 4.537 -3.854 3.460
319 HB2 LEU 45 HB2 LEU 45 5.388 -5.601 2.001
320 HB3 LEU 45 HB1 LEU 45 4.545 -6.825 2.933
321 HG LEU 45 HG LEU 45 2.386 -5.871 2.222
322 HD11 LEU 45 HD11 LEU 45 2.327 -4.231 0.405
323 HD12 LEU 45 HD12 LEU 45 4.080 -4.048 0.515
324 HD13 LEU 45 HD13 LEU 45 3.056 -3.566 1.868
325 HD21 LEU 45 HD21 LEU 45 3.374 -7.704 0.970
326 HD22 LEU 45 HD22 LEU 45 4.261 -6.560 -0.038
327 HD23 LEU 45 HD23 LEU 45 2.499 -6.614 -0.101
328 H MET 46 HN MET 46 3.906 -6.768 5.417
329 HA MET 46 HA MET 46 1.090 -6.328 5.482
330 HB2 MET 46 HB2 MET 46 0.973 -8.139 7.071
331 HB3 MET 46 HB1 MET 46 2.094 -8.563 5.789
332 HG2 MET 46 HG2 MET 46 3.220 -9.304 7.631
333 HG3 MET 46 HG1 MET 46 3.894 -7.689 7.465
334 HE1 MET 46 HE1 MET 46 0.305 -8.650 8.807
335 HE2 MET 46 HE2 MET 46 0.633 -8.822 10.531
336 HE3 MET 46 HE3 MET 46 1.340 -9.958 9.383
337 H GLU 47 HN GLU 47 3.756 -5.395 7.584
338 HA GLU 47 HA GLU 47 2.205 -4.350 9.687
339 HB2 GLU 47 HB2 GLU 47 4.950 -3.600 8.671
340 HB3 GLU 47 HB1 GLU 47 4.240 -2.911 10.128
341 HG2 GLU 47 HG2 GLU 47 4.098 -5.157 11.103
342 HG3 GLU 47 HG1 GLU 47 4.818 -5.827 9.641
343 H THR 48 HN THR 48 3.311 -2.992 6.643
344 HA THR 48 HA THR 48 2.419 -0.351 7.061
345 HB THR 48 HB THR 48 2.720 -1.820 4.433
346 HG1 THR 48 HG1 THR 48 4.677 -1.827 5.589
347 HG21 THR 48 HG21 THR 48 2.731 1.133 5.070
348 HG22 THR 48 HG22 THR 48 1.435 0.262 4.248
349 HG23 THR 48 HG23 THR 48 3.015 0.419 3.483
350 H ALA 49 HN ALA 49 0.837 -3.242 5.819
351 HA ALA 49 HA ALA 49 -1.439 -2.095 4.700
352 HB1 ALA 49 HB1 ALA 49 -0.809 -4.456 4.425
353 HB2 ALA 49 HB2 ALA 49 -2.488 -4.267 4.931
354 HB3 ALA 49 HB3 ALA 49 -1.265 -4.759 6.101
355 H ALA 50 HN ALA 50 -0.742 -2.931 8.042
356 HA ALA 50 HA ALA 50 -3.331 -2.700 9.093
357 HB1 ALA 50 HB1 ALA 50 -1.439 -3.721 10.300
358 HB2 ALA 50 HB2 ALA 50 -2.268 -2.495 11.261
359 HB3 ALA 50 HB3 ALA 50 -0.723 -2.122 10.497
360 H ARG 51 HN ARG 51 -0.915 -0.348 8.276
361 HA ARG 51 HA ARG 51 -1.930 1.889 9.636
362 HB2 ARG 51 HB2 ARG 51 -0.286 1.532 7.152
363 HB3 ARG 51 HB1 ARG 51 -0.824 3.128 7.639
364 HG2 ARG 51 HG2 ARG 51 0.782 1.277 9.375
365 HG3 ARG 51 HG1 ARG 51 1.464 2.568 8.381
366 HD2 ARG 51 HD2 ARG 51 0.140 4.217 9.596
367 HD3 ARG 51 HD1 ARG 51 -0.577 2.936 10.571
368 HE ARG 51 HE ARG 51 2.088 2.646 11.005
369 HH11 ARG 51 HH11 ARG 51 -0.070 5.381 11.153
370 HH12 ARG 51 HH12 ARG 51 0.724 6.113 12.515
371 HH21 ARG 51 HH21 ARG 51 3.182 3.630 12.782
372 HH22 ARG 51 HH22 ARG 51 2.586 5.127 13.417
373 H LEU 52 HN LEU 52 -2.344 0.975 6.221
374 HA LEU 52 HA LEU 52 -4.166 3.015 5.603
375 HB2 LEU 52 HB2 LEU 52 -3.862 0.319 4.279
376 HB3 LEU 52 HB1 LEU 52 -4.664 1.718 3.589
377 HG LEU 52 HG LEU 52 -1.721 1.534 4.247
378 HD11 LEU 52 HD11 LEU 52 -1.442 1.589 1.802
379 HD12 LEU 52 HD12 LEU 52 -3.193 1.486 1.616
380 HD13 LEU 52 HD13 LEU 52 -2.304 0.150 2.346
381 HD21 LEU 52 HD21 LEU 52 -1.554 3.678 3.078
382 HD22 LEU 52 HD22 LEU 52 -2.594 3.804 4.499
383 HD23 LEU 52 HD23 LEU 52 -3.308 3.712 2.890
384 H GLU 53 HN GLU 53 -4.689 -0.353 6.568
385 HA GLU 53 HA GLU 53 -7.460 -0.417 6.242
386 HB2 GLU 53 HB2 GLU 53 -5.723 -1.948 8.180
387 HB3 GLU 53 HB1 GLU 53 -7.418 -2.301 7.876
388 HG2 GLU 53 HG2 GLU 53 -6.886 -2.677 5.504
389 HG3 GLU 53 HG1 GLU 53 -5.181 -2.436 5.872
390 H SER 54 HN SER 54 -5.635 0.151 9.262
391 HA SER 54 HA SER 54 -7.954 0.672 10.793
392 HB2 SER 54 HB2 SER 54 -5.132 1.576 11.391
393 HB3 SER 54 HB1 SER 54 -6.436 1.306 12.553
394 HG SER 54 HG SER 54 -4.786 -0.509 11.254
395 H ARG 55 HN ARG 55 -5.892 2.718 8.853
396 HA ARG 55 HA ARG 55 -6.675 5.182 10.079
397 HB2 ARG 55 HB2 ARG 55 -4.504 4.892 8.973
398 HB3 ARG 55 HB1 ARG 55 -5.313 4.644 7.435
399 HG2 ARG 55 HG2 ARG 55 -6.097 6.924 7.425
400 HG3 ARG 55 HG1 ARG 55 -5.447 7.184 9.045
401 HD2 ARG 55 HD2 ARG 55 -3.210 6.966 8.282
402 HD3 ARG 55 HD1 ARG 55 -3.735 6.372 6.709
403 HE ARG 55 HE ARG 55 -4.833 8.879 6.921
404 HH11 ARG 55 HH11 ARG 55 -1.587 7.570 7.106
405 HH12 ARG 55 HH12 ARG 55 -0.842 8.979 6.444
406 HH21 ARG 55 HH21 ARG 55 -3.851 10.755 6.065
407 HH22 ARG 55 HH22 ARG 55 -2.133 10.806 5.841
408 H TYR 56 HN TYR 56 -7.601 3.504 7.076
409 HA TYR 56 HA TYR 56 -9.537 5.643 6.563
410 HB2 TYR 56 HB2 TYR 56 -8.357 3.526 4.771
411 HB3 TYR 56 HB1 TYR 56 -9.715 4.539 4.280
412 HD1 TYR 56 HD2 TYR 56 -9.405 6.944 3.929
413 HD2 TYR 56 HD1 TYR 56 -6.149 4.423 4.968
414 HE1 TYR 56 HE2 TYR 56 -7.830 8.687 3.200
415 HE2 TYR 56 HE1 TYR 56 -4.566 6.148 4.240
416 HH TYR 56 HH TYR 56 -5.515 9.345 3.546
417 H GLY 57 HN GLY 57 -9.485 2.709 8.050
418 HA2 GLY 57 HA2 GLY 57 -11.256 1.543 8.969
419 HA3 GLY 57 HA1 GLY 57 -12.350 2.644 8.148
420 H VAL 58 HN VAL 58 -9.869 0.565 6.723
421 HA VAL 58 HA VAL 58 -12.034 -0.788 5.250
422 HB VAL 58 HB VAL 58 -10.460 -1.187 3.418
423 HG11 VAL 58 HG11 VAL 58 -10.639 1.716 4.213
424 HG12 VAL 58 HG12 VAL 58 -11.858 0.795 3.332
425 HG13 VAL 58 HG13 VAL 58 -10.290 1.113 2.592
426 HG21 VAL 58 HG21 VAL 58 -8.287 -0.035 3.366
427 HG22 VAL 58 HG22 VAL 58 -8.374 -1.232 4.658
428 HG23 VAL 58 HG23 VAL 58 -8.534 0.483 5.034
429 H SER 59 HN SER 59 -11.127 -2.957 4.308
430 HA SER 59 HA SER 59 -9.386 -4.313 6.214
431 HB2 SER 59 HB2 SER 59 -12.109 -5.345 5.373
432 HB3 SER 59 HB1 SER 59 -10.939 -6.221 6.350
433 HG SER 59 HG SER 59 -11.102 -4.379 7.849
434 H ILE 60 HN ILE 60 -7.820 -5.212 5.055
435 HA ILE 60 HA ILE 60 -8.318 -5.911 2.250
436 HB ILE 60 HB ILE 60 -5.702 -5.905 3.775
437 HG12 ILE 60 HG12 ILE 60 -6.792 -3.850 1.828
438 HG13 ILE 60 HG11 ILE 60 -6.720 -3.642 3.575
439 HG21 ILE 60 HG21 ILE 60 -6.267 -6.094 0.817
440 HG22 ILE 60 HG22 ILE 60 -5.721 -7.412 1.853
441 HG23 ILE 60 HG23 ILE 60 -4.668 -6.027 1.562
442 HD11 ILE 60 HD11 ILE 60 -4.284 -3.774 3.495
443 HD12 ILE 60 HD12 ILE 60 -4.899 -2.475 2.471
444 HD13 ILE 60 HD13 ILE 60 -4.353 -3.988 1.745
445 HA PRO 61 HA PRO 61 -8.981 -10.082 3.819
446 HB2 PRO 61 HB2 PRO 61 -9.321 -10.656 0.945
447 HB3 PRO 61 HB1 PRO 61 -10.433 -10.944 2.285
448 HG2 PRO 61 HG2 PRO 61 -10.876 -9.007 0.488
449 HG3 PRO 61 HG1 PRO 61 -11.305 -8.808 2.198
450 HD2 PRO 61 HD2 PRO 61 -8.960 -7.719 0.688
451 HD3 PRO 61 HD1 PRO 61 -9.956 -6.942 1.937
452 H ASP 62 HN ASP 62 -7.631 -11.767 4.021
453 HA ASP 62 HA ASP 62 -4.972 -11.591 3.144
454 HB2 ASP 62 HB2 ASP 62 -4.694 -13.833 4.073
455 HB3 ASP 62 HB1 ASP 62 -5.662 -12.835 5.154
456 H ASP 63 HN ASP 63 -7.721 -12.630 1.489
457 HA ASP 63 HA ASP 63 -6.494 -14.573 -0.217
458 HB2 ASP 63 HB2 ASP 63 -8.876 -14.684 0.166
459 HB3 ASP 63 HB1 ASP 63 -9.089 -13.038 -0.418
460 H VAL 64 HN VAL 64 -7.762 -11.293 -0.861
461 HA VAL 64 HA VAL 64 -6.485 -11.181 -3.411
462 HB VAL 64 HB VAL 64 -8.624 -10.013 -2.829
463 HG11 VAL 64 HG11 VAL 64 -8.469 -7.811 -1.772
464 HG12 VAL 64 HG12 VAL 64 -6.766 -8.113 -1.426
465 HG13 VAL 64 HG13 VAL 64 -8.009 -9.118 -0.680
466 HG21 VAL 64 HG21 VAL 64 -6.412 -8.341 -4.009
467 HG22 VAL 64 HG22 VAL 64 -8.137 -8.015 -4.176
468 HG23 VAL 64 HG23 VAL 64 -7.447 -9.481 -4.870
469 H ALA 65 HN ALA 65 -5.473 -10.536 -0.238
470 HA ALA 65 HA ALA 65 -3.563 -8.524 -0.640
471 HB1 ALA 65 HB1 ALA 65 -3.443 -10.799 1.334
472 HB2 ALA 65 HB2 ALA 65 -4.309 -9.283 1.576
473 HB3 ALA 65 HB3 ALA 65 -2.552 -9.280 1.428
474 H GLY 66 HN GLY 66 -3.519 -11.930 -1.318
475 HA2 GLY 66 HA2 GLY 66 -0.658 -11.851 -1.954
476 HA3 GLY 66 HA1 GLY 66 -1.656 -13.296 -1.867
477 H ARG 67 HN ARG 67 -2.638 -10.415 -3.590
478 HA ARG 67 HA ARG 67 -2.119 -11.774 -6.153
479 HB2 ARG 67 HB2 ARG 67 -4.647 -10.299 -5.393
480 HB3 ARG 67 HB1 ARG 67 -4.298 -10.967 -6.982
481 HG2 ARG 67 HG2 ARG 67 -4.364 -12.696 -4.535
482 HG3 ARG 67 HG1 ARG 67 -5.832 -12.282 -5.418
483 HD2 ARG 67 HD2 ARG 67 -5.130 -14.359 -6.279
484 HD3 ARG 67 HD1 ARG 67 -4.681 -13.162 -7.488
485 HE ARG 67 HE ARG 67 -2.517 -13.660 -5.711
486 HH11 ARG 67 HH11 ARG 67 -4.278 -15.071 -8.391
487 HH12 ARG 67 HH12 ARG 67 -2.926 -16.002 -8.961
488 HH21 ARG 67 HH21 ARG 67 -0.736 -14.910 -6.451
489 HH22 ARG 67 HH22 ARG 67 -0.922 -15.921 -7.848
490 H VAL 68 HN VAL 68 -1.973 -8.951 -4.266
491 HA VAL 68 HA VAL 68 -1.858 -7.150 -6.550
492 HB VAL 68 HB VAL 68 -1.614 -5.359 -4.799
493 HG11 VAL 68 HG11 VAL 68 -4.005 -7.186 -4.595
494 HG12 VAL 68 HG12 VAL 68 -3.775 -5.884 -5.762
495 HG13 VAL 68 HG13 VAL 68 -3.955 -5.511 -4.047
496 HG21 VAL 68 HG21 VAL 68 -2.185 -5.972 -2.466
497 HG22 VAL 68 HG22 VAL 68 -0.644 -6.648 -2.993
498 HG23 VAL 68 HG23 VAL 68 -2.076 -7.675 -2.917
499 H ASP 69 HN ASP 69 0.018 -7.056 -7.615
500 HA ASP 69 HA ASP 69 2.491 -7.516 -6.144
501 HB2 ASP 69 HB2 ASP 69 3.575 -7.779 -8.301
502 HB3 ASP 69 HB1 ASP 69 2.112 -8.753 -8.264
503 H THR 70 HN THR 70 1.005 -5.008 -8.179
504 HA THR 70 HA THR 70 3.168 -3.186 -7.402
505 HB THR 70 HB THR 70 2.269 -1.653 -9.134
506 HG1 THR 70 HG1 THR 70 0.744 -3.314 -10.536
507 HG21 THR 70 HG21 THR 70 2.940 -2.959 -11.084
508 HG22 THR 70 HG22 THR 70 2.808 -4.446 -10.147
509 HG23 THR 70 HG23 THR 70 4.029 -3.246 -9.727
510 HA PRO 71 HA PRO 71 0.660 -0.797 -4.536
511 HB2 PRO 71 HB2 PRO 71 2.012 1.414 -6.039
512 HB3 PRO 71 HB1 PRO 71 1.801 1.221 -4.294
513 HG2 PRO 71 HG2 PRO 71 4.141 0.685 -5.387
514 HG3 PRO 71 HG1 PRO 71 3.473 -0.413 -4.160
515 HD2 PRO 71 HD2 PRO 71 3.586 -0.735 -7.132
516 HD3 PRO 71 HD1 PRO 71 3.808 -1.950 -5.859
517 H ARG 72 HN ARG 72 0.932 0.022 -7.976
518 HA ARG 72 HA ARG 72 -1.340 1.583 -8.294
519 HB2 ARG 72 HB2 ARG 72 -0.180 1.573 -10.244
520 HB3 ARG 72 HB1 ARG 72 0.365 -0.078 -10.035
521 HG2 ARG 72 HG2 ARG 72 -0.976 -0.067 -11.973
522 HG3 ARG 72 HG1 ARG 72 -1.966 -0.800 -10.714
523 HD2 ARG 72 HD2 ARG 72 -3.360 0.706 -11.907
524 HD3 ARG 72 HD1 ARG 72 -3.000 1.454 -10.351
525 HE ARG 72 HE ARG 72 -1.089 2.411 -12.075
526 HH11 ARG 72 HH11 ARG 72 -4.596 2.406 -12.020
527 HH12 ARG 72 HH12 ARG 72 -4.730 3.936 -12.836
528 HH21 ARG 72 HH21 ARG 72 -1.274 4.387 -13.204
529 HH22 ARG 72 HH22 ARG 72 -2.848 5.038 -13.543
530 H GLU 73 HN GLU 73 -1.054 -1.972 -8.459
531 HA GLU 73 HA GLU 73 -3.786 -2.482 -8.955
532 HB2 GLU 73 HB2 GLU 73 -1.715 -4.209 -7.575
533 HB3 GLU 73 HB1 GLU 73 -3.290 -4.775 -8.106
534 HG2 GLU 73 HG2 GLU 73 -1.170 -3.658 -9.923
535 HG3 GLU 73 HG1 GLU 73 -1.446 -5.374 -9.628
536 H LEU 74 HN LEU 74 -1.891 -2.289 -6.000
537 HA LEU 74 HA LEU 74 -3.870 -3.089 -4.178
538 HB2 LEU 74 HB2 LEU 74 -1.339 -2.843 -3.866
539 HB3 LEU 74 HB1 LEU 74 -1.645 -1.141 -3.591
540 HG LEU 74 HG LEU 74 -1.360 -2.658 -1.552
541 HD11 LEU 74 HD11 LEU 74 -3.825 -0.941 -1.744
542 HD12 LEU 74 HD12 LEU 74 -2.189 -0.372 -1.407
543 HD13 LEU 74 HD13 LEU 74 -3.008 -1.431 -0.258
544 HD21 LEU 74 HD21 LEU 74 -3.387 -3.798 -0.793
545 HD22 LEU 74 HD22 LEU 74 -2.770 -4.486 -2.296
546 HD23 LEU 74 HD23 LEU 74 -4.173 -3.416 -2.325
547 H LEU 75 HN LEU 75 -2.815 0.165 -5.140
548 HA LEU 75 HA LEU 75 -4.620 1.627 -3.581
549 HB2 LEU 75 HB2 LEU 75 -2.646 2.564 -4.790
550 HB3 LEU 75 HB1 LEU 75 -3.524 2.387 -6.295
551 HG LEU 75 HG LEU 75 -5.248 3.973 -5.411
552 HD11 LEU 75 HD11 LEU 75 -4.656 5.345 -3.475
553 HD12 LEU 75 HD12 LEU 75 -3.233 4.341 -3.202
554 HD13 LEU 75 HD13 LEU 75 -4.845 3.648 -3.034
555 HD21 LEU 75 HD21 LEU 75 -2.417 5.013 -5.514
556 HD22 LEU 75 HD22 LEU 75 -3.885 5.961 -5.749
557 HD23 LEU 75 HD23 LEU 75 -3.451 4.706 -6.908
558 H ASP 76 HN ASP 76 -4.887 0.521 -6.944
559 HA ASP 76 HA ASP 76 -7.366 1.619 -7.554
560 HB2 ASP 76 HB2 ASP 76 -5.843 0.598 -9.197
561 HB3 ASP 76 HB1 ASP 76 -6.196 -0.992 -8.531
562 H LEU 77 HN LEU 77 -6.571 -1.449 -6.019
563 HA LEU 77 HA LEU 77 -9.133 -2.591 -6.018
564 HB2 LEU 77 HB2 LEU 77 -7.133 -3.888 -5.574
565 HB3 LEU 77 HB1 LEU 77 -6.811 -2.959 -4.123
566 HG LEU 77 HG LEU 77 -8.972 -3.857 -3.185
567 HD11 LEU 77 HD11 LEU 77 -9.895 -5.872 -4.190
568 HD12 LEU 77 HD12 LEU 77 -8.761 -5.738 -5.535
569 HD13 LEU 77 HD13 LEU 77 -10.006 -4.509 -5.305
570 HD21 LEU 77 HD21 LEU 77 -6.755 -4.720 -2.569
571 HD22 LEU 77 HD22 LEU 77 -6.861 -5.890 -3.885
572 HD23 LEU 77 HD23 LEU 77 -7.996 -5.972 -2.539
573 H ILE 78 HN ILE 78 -7.434 -0.878 -3.393
574 HA ILE 78 HA ILE 78 -9.630 -0.954 -1.606
575 HB ILE 78 HB ILE 78 -7.250 0.911 -1.577
576 HG12 ILE 78 HG12 ILE 78 -7.685 -1.755 -0.208
577 HG13 ILE 78 HG11 ILE 78 -6.607 -1.473 -1.571
578 HG21 ILE 78 HG21 ILE 78 -9.085 1.695 -0.171
579 HG22 ILE 78 HG22 ILE 78 -7.730 1.141 0.812
580 HG23 ILE 78 HG23 ILE 78 -9.156 0.121 0.624
581 HD11 ILE 78 HD11 ILE 78 -5.387 -1.597 0.522
582 HD12 ILE 78 HD12 ILE 78 -6.335 -0.256 1.166
583 HD13 ILE 78 HD13 ILE 78 -5.252 0.006 -0.201
584 H ASN 79 HN ASN 79 -8.403 1.542 -3.801
585 HA ASN 79 HA ASN 79 -10.098 3.629 -2.976
586 HB2 ASN 79 HB2 ASN 79 -8.036 3.743 -4.493
587 HB3 ASN 79 HB1 ASN 79 -9.105 3.256 -5.802
588 HD21 ASN 79 HD21 ASN 79 -8.093 5.792 -3.729
589 HD22 ASN 79 HD22 ASN 79 -9.041 7.044 -4.446
590 H GLY 80 HN GLY 80 -10.465 1.139 -5.471
591 HA2 GLY 80 HA2 GLY 80 -12.950 2.054 -6.478
592 HA3 GLY 80 HA1 GLY 80 -12.295 0.432 -6.671
593 H ALA 81 HN ALA 81 -12.107 -0.012 -3.770
594 HA ALA 81 HA ALA 81 -14.758 -0.987 -3.332
595 HB1 ALA 81 HB1 ALA 81 -12.805 -2.200 -2.498
596 HB2 ALA 81 HB2 ALA 81 -13.903 -1.781 -1.183
597 HB3 ALA 81 HB3 ALA 81 -12.422 -0.856 -1.424
598 H LEU 82 HN LEU 82 -12.923 1.799 -2.287
599 HA LEU 82 HA LEU 82 -14.717 2.636 -0.249
600 HB2 LEU 82 HB2 LEU 82 -12.648 4.132 -1.850
601 HB3 LEU 82 HB1 LEU 82 -13.557 4.850 -0.533
602 HG LEU 82 HG LEU 82 -11.738 2.461 -0.250
603 HD11 LEU 82 HD11 LEU 82 -10.211 3.991 0.883
604 HD12 LEU 82 HD12 LEU 82 -11.283 5.342 0.516
605 HD13 LEU 82 HD13 LEU 82 -10.475 4.478 -0.793
606 HD21 LEU 82 HD21 LEU 82 -13.541 2.492 1.378
607 HD22 LEU 82 HD22 LEU 82 -13.145 4.157 1.803
608 HD23 LEU 82 HD23 LEU 82 -11.997 2.862 2.146
609 H ALA 83 HN ALA 83 -14.728 2.882 -3.684
610 HA ALA 83 HA ALA 83 -16.395 5.141 -3.983
611 HB1 ALA 83 HB1 ALA 83 -16.755 4.372 -6.245
612 HB2 ALA 83 HB2 ALA 83 -16.138 2.775 -5.831
613 HB3 ALA 83 HB3 ALA 83 -15.056 4.169 -5.811
614 H GLU 84 HN GLU 84 -17.029 1.981 -2.876
615 HA GLU 84 HA GLU 84 -19.924 2.370 -3.246
616 HB2 GLU 84 HB2 GLU 84 -18.348 -0.163 -2.749
617 HB3 GLU 84 HB1 GLU 84 -20.101 -0.079 -2.846
618 HG2 GLU 84 HG2 GLU 84 -19.945 0.677 -5.160
619 HG3 GLU 84 HG1 GLU 84 -18.186 0.616 -5.064
620 H ALA 85 HN ALA 85 -17.847 3.244 -1.100
621 HA ALA 85 HA ALA 85 -19.407 2.305 1.219
622 HB1 ALA 85 HB1 ALA 85 -17.094 1.521 1.284
623 HB2 ALA 85 HB2 ALA 85 -17.404 2.676 2.581
624 HB3 ALA 85 HB3 ALA 85 -16.522 3.181 1.138
625 H ALA 86 HN ALA 86 -19.612 4.662 -0.709
626 HA ALA 86 HA ALA 86 -19.387 6.880 1.196
627 HB1 ALA 86 HB1 ALA 86 -19.739 6.887 -1.803
628 HB2 ALA 86 HB2 ALA 86 -18.270 7.281 -0.909
629 HB3 ALA 86 HB3 ALA 86 -19.682 8.331 -0.792
630 H28 SXO 87 H28B SXO 87 5.893 -11.757 5.380
631 H28A SXO 87 H28A SXO 87 6.991 -11.757 6.761
632 H30 SXO 87 H30A SXO 87 4.024 -13.549 7.947
633 H30A SXO 87 H30C SXO 87 5.087 -12.166 8.203
634 H30B SXO 87 H30B SXO 87 4.017 -12.205 6.804
635 H31 SXO 87 H31A SXO 87 4.524 -15.154 6.027
636 H31A SXO 87 H31B SXO 87 5.861 -14.777 4.939
637 H31B SXO 87 H31C SXO 87 4.425 -13.754 4.961
638 H32 SXO 87 H32A SXO 87 6.907 -13.783 8.440
639 HO33 SXO 87 H33A SXO 87 7.882 -14.213 6.040
640 HN36 SXO 87 H36A SXO 87 4.688 -14.579 9.185
641 H37 SXO 87 H37A SXO 87 4.646 -17.518 9.262
642 H37A SXO 87 H37B SXO 87 3.907 -16.434 10.440
643 H38 SXO 87 H38B SXO 87 2.193 -17.510 9.105
644 H38A SXO 87 H38A SXO 87 2.962 -16.952 7.621
645 HN41 SXO 87 H41A SXO 87 1.560 -15.642 6.768
646 H42 SXO 87 H42A SXO 87 -0.440 -14.123 7.522
647 H42A SXO 87 H42B SXO 87 0.899 -13.144 8.123
648 H43 SXO 87 H43B SXO 87 1.847 -13.140 5.822
649 H43A SXO 87 H43A SXO 87 0.371 -13.939 5.267
650 H2 SXO 87 H2A SXO 87 0.693 -9.728 2.912
651 H2A SXO 87 H2B SXO 87 1.028 -9.306 4.591
652 H3 SXO 87 H3B SXO 87 -1.685 -9.872 3.397
653 H3A SXO 87 H3A SXO 87 -1.375 -9.522 5.100
654 H4 SXO 87 H4A SXO 87 -0.460 -7.327 4.457
655 H4A SXO 87 H4B SXO 87 -2.136 -7.524 3.944
656 H5 SXO 87 H5B SXO 87 0.286 -7.911 2.189
657 H5A SXO 87 H5A SXO 87 -1.398 -8.060 1.683
658 H6 SXO 87 H6A SXO 87 -0.066 -5.559 2.715
659 H6A SXO 87 H6B SXO 87 -1.767 -5.700 2.264
660 H7 SXO 87 H7A SXO 87 -1.141 -6.202 -0.038
661 H7A SXO 87 H7B SXO 87 0.574 -6.137 0.401
662 H8 SXO 87 H8C SXO 87 0.323 -3.788 1.021
663 H8A SXO 87 H8A SXO 87 -1.389 -3.857 0.609
664 H8B SXO 87 H8B SXO 87 -0.174 -4.050 -0.653
Start of MODEL 15
1 H1 MET 1 HT1 MET 1 -15.131 16.874 -2.797
2 H2 MET 1 HT2 MET 1 -14.959 16.202 -1.250
3 H3 MET 1 HT3 MET 1 -16.223 15.691 -2.258
4 HA MET 1 HA MET 1 -14.533 14.857 -3.849
5 HB2 MET 1 HB2 MET 1 -12.715 15.318 -1.473
6 HB3 MET 1 HB1 MET 1 -12.265 14.521 -2.974
7 HG2 MET 1 HG2 MET 1 -12.570 16.581 -4.198
8 HG3 MET 1 HG1 MET 1 -13.132 17.393 -2.740
9 HE1 MET 1 HE1 MET 1 -10.188 14.789 -3.081
10 HE2 MET 1 HE2 MET 1 -8.816 15.868 -3.351
11 HE3 MET 1 HE3 MET 1 -10.091 15.736 -4.564
12 H ALA 2 HN ALA 2 -14.112 12.597 -3.765
13 HA ALA 2 HA ALA 2 -15.715 11.205 -1.851
14 HB1 ALA 2 HB1 ALA 2 -15.078 9.201 -3.050
15 HB2 ALA 2 HB2 ALA 2 -13.814 10.087 -3.905
16 HB3 ALA 2 HB3 ALA 2 -15.511 10.476 -4.188
17 H THR 3 HN THR 3 -15.134 10.013 -0.119
18 HA THR 3 HA THR 3 -12.505 10.410 0.979
19 HB THR 3 HB THR 3 -14.670 8.692 2.126
20 HG1 THR 3 HG1 THR 3 -14.339 11.511 2.429
21 HG21 THR 3 HG21 THR 3 -12.426 10.279 3.365
22 HG22 THR 3 HG22 THR 3 -12.518 8.524 3.232
23 HG23 THR 3 HG23 THR 3 -13.653 9.389 4.269
24 H LEU 4 HN LEU 4 -10.917 9.194 0.106
25 HA LEU 4 HA LEU 4 -11.047 6.341 0.412
26 HB2 LEU 4 HB2 LEU 4 -10.357 5.992 -2.018
27 HB3 LEU 4 HB1 LEU 4 -12.046 6.300 -1.676
28 HG LEU 4 HG LEU 4 -11.599 8.725 -2.301
29 HD11 LEU 4 HD11 LEU 4 -9.168 8.692 -2.155
30 HD12 LEU 4 HD12 LEU 4 -9.706 9.156 -3.769
31 HD13 LEU 4 HD13 LEU 4 -9.096 7.527 -3.478
32 HD21 LEU 4 HD21 LEU 4 -11.785 8.255 -4.695
33 HD22 LEU 4 HD22 LEU 4 -12.819 7.199 -3.734
34 HD23 LEU 4 HD23 LEU 4 -11.305 6.584 -4.400
35 H LEU 5 HN LEU 5 -8.901 5.471 -0.850
36 HA LEU 5 HA LEU 5 -6.772 6.674 0.675
37 HB2 LEU 5 HB2 LEU 5 -7.324 4.125 0.008
38 HB3 LEU 5 HB1 LEU 5 -6.245 4.520 -1.314
39 HG LEU 5 HG LEU 5 -5.539 4.694 1.620
40 HD11 LEU 5 HD11 LEU 5 -4.163 2.741 1.199
41 HD12 LEU 5 HD12 LEU 5 -4.721 2.692 -0.473
42 HD13 LEU 5 HD13 LEU 5 -5.858 2.400 0.841
43 HD21 LEU 5 HD21 LEU 5 -3.841 5.055 -0.850
44 HD22 LEU 5 HD22 LEU 5 -3.248 5.013 0.811
45 HD23 LEU 5 HD23 LEU 5 -4.311 6.319 0.289
46 H THR 6 HN THR 6 -5.294 8.084 -0.108
47 HA THR 6 HA THR 6 -5.422 8.715 -2.969
48 HB THR 6 HB THR 6 -4.409 10.856 -2.430
49 HG1 THR 6 HG1 THR 6 -4.559 10.552 0.324
50 HG21 THR 6 HG21 THR 6 -6.175 11.832 -1.052
51 HG22 THR 6 HG22 THR 6 -6.653 10.224 -0.507
52 HG23 THR 6 HG23 THR 6 -6.848 10.676 -2.201
53 H THR 7 HN THR 7 -3.491 9.075 -4.151
54 HA THR 7 HA THR 7 -1.439 7.209 -3.791
55 HB THR 7 HB THR 7 -1.282 9.815 -5.324
56 HG1 THR 7 HG1 THR 7 -2.574 7.383 -5.806
57 HG21 THR 7 HG21 THR 7 0.896 8.762 -5.064
58 HG22 THR 7 HG22 THR 7 0.339 8.582 -6.730
59 HG23 THR 7 HG23 THR 7 0.240 7.222 -5.613
60 H ASP 8 HN ASP 8 -1.701 10.582 -2.761
61 HA ASP 8 HA ASP 8 1.002 10.813 -1.894
62 HB2 ASP 8 HB2 ASP 8 -0.532 12.734 -2.448
63 HB3 ASP 8 HB1 ASP 8 -1.350 12.437 -0.915
64 H ASP 9 HN ASP 9 -2.045 10.027 -0.230
65 HA ASP 9 HA ASP 9 -1.004 9.710 2.364
66 HB2 ASP 9 HB2 ASP 9 -3.410 8.747 0.928
67 HB3 ASP 9 HB1 ASP 9 -2.921 7.797 2.327
68 H LEU 10 HN LEU 10 -1.277 7.476 -0.337
69 HA LEU 10 HA LEU 10 -0.272 5.184 0.897
70 HB2 LEU 10 HB2 LEU 10 -1.015 5.993 -1.692
71 HB3 LEU 10 HB1 LEU 10 0.641 5.451 -1.840
72 HG LEU 10 HG LEU 10 -1.718 3.849 -0.852
73 HD11 LEU 10 HD11 LEU 10 -1.607 4.088 -3.259
74 HD12 LEU 10 HD12 LEU 10 -1.208 2.437 -2.784
75 HD13 LEU 10 HD13 LEU 10 0.075 3.554 -3.253
76 HD21 LEU 10 HD21 LEU 10 1.188 3.057 -0.985
77 HD22 LEU 10 HD22 LEU 10 -0.161 1.969 -0.657
78 HD23 LEU 10 HD23 LEU 10 0.223 3.261 0.479
79 H ARG 11 HN ARG 11 1.429 7.708 -0.957
80 HA ARG 11 HA ARG 11 4.032 6.784 -0.637
81 HB2 ARG 11 HB2 ARG 11 3.496 8.573 -2.171
82 HB3 ARG 11 HB1 ARG 11 2.991 9.614 -0.848
83 HG2 ARG 11 HG2 ARG 11 5.270 9.721 -0.024
84 HG3 ARG 11 HG1 ARG 11 5.793 8.607 -1.284
85 HD2 ARG 11 HD2 ARG 11 4.496 11.254 -1.882
86 HD3 ARG 11 HD1 ARG 11 6.238 11.062 -1.703
87 HE ARG 11 HE ARG 11 5.042 9.267 -3.615
88 HH11 ARG 11 HH11 ARG 11 6.340 12.484 -3.154
89 HH12 ARG 11 HH12 ARG 11 6.938 12.618 -4.785
90 HH21 ARG 11 HH21 ARG 11 5.827 9.456 -5.780
91 HH22 ARG 11 HH22 ARG 11 6.637 10.909 -6.263
92 H ARG 12 HN ARG 12 2.108 8.835 1.524
93 HA ARG 12 HA ARG 12 4.117 9.296 3.442
94 HB2 ARG 12 HB2 ARG 12 1.119 9.218 3.630
95 HB3 ARG 12 HB1 ARG 12 2.126 9.531 5.034
96 HG2 ARG 12 HG2 ARG 12 2.030 11.178 2.517
97 HG3 ARG 12 HG1 ARG 12 1.297 11.588 4.065
98 HD2 ARG 12 HD2 ARG 12 3.235 12.791 4.215
99 HD3 ARG 12 HD1 ARG 12 3.762 11.269 4.935
100 HE ARG 12 HE ARG 12 4.275 11.030 2.247
101 HH11 ARG 12 HH11 ARG 12 5.297 13.165 4.839
102 HH12 ARG 12 HH12 ARG 12 6.794 13.581 4.060
103 HH21 ARG 12 HH21 ARG 12 6.247 11.598 1.240
104 HH22 ARG 12 HH22 ARG 12 7.339 12.699 2.032
105 H ALA 13 HN ALA 13 1.659 6.740 3.204
106 HA ALA 13 HA ALA 13 2.139 5.589 5.715
107 HB1 ALA 13 HB1 ALA 13 1.020 4.251 3.257
108 HB2 ALA 13 HB2 ALA 13 0.099 5.212 4.414
109 HB3 ALA 13 HB3 ALA 13 0.844 3.696 4.923
110 H LEU 14 HN LEU 14 3.529 4.849 2.538
111 HA LEU 14 HA LEU 14 4.982 2.566 3.286
112 HB2 LEU 14 HB2 LEU 14 5.209 4.576 1.105
113 HB3 LEU 14 HB1 LEU 14 6.598 3.553 1.400
114 HG LEU 14 HG LEU 14 5.293 2.578 -0.355
115 HD11 LEU 14 HD11 LEU 14 4.910 1.075 2.226
116 HD12 LEU 14 HD12 LEU 14 6.310 0.999 1.152
117 HD13 LEU 14 HD13 LEU 14 4.747 0.389 0.611
118 HD21 LEU 14 HD21 LEU 14 2.974 1.904 -0.058
119 HD22 LEU 14 HD22 LEU 14 3.162 3.648 0.117
120 HD23 LEU 14 HD23 LEU 14 2.959 2.636 1.547
121 H VAL 15 HN VAL 15 5.811 5.990 3.424
122 HA VAL 15 HA VAL 15 8.468 5.635 4.362
123 HB VAL 15 HB VAL 15 6.609 8.011 4.568
124 HG11 VAL 15 HG11 VAL 15 8.312 8.133 6.320
125 HG12 VAL 15 HG12 VAL 15 8.598 9.347 5.073
126 HG13 VAL 15 HG13 VAL 15 9.576 7.880 5.115
127 HG21 VAL 15 HG21 VAL 15 8.925 7.450 2.723
128 HG22 VAL 15 HG22 VAL 15 7.927 8.904 2.730
129 HG23 VAL 15 HG23 VAL 15 7.217 7.350 2.286
130 H GLU 16 HN GLU 16 5.433 6.473 6.015
131 HA GLU 16 HA GLU 16 6.453 6.655 8.613
132 HB2 GLU 16 HB2 GLU 16 3.685 5.859 7.694
133 HB3 GLU 16 HB1 GLU 16 4.102 6.326 9.338
134 HG2 GLU 16 HG2 GLU 16 4.678 8.548 8.610
135 HG3 GLU 16 HG1 GLU 16 4.422 8.098 6.924
136 H SER 17 HN SER 17 5.563 3.854 6.731
137 HA SER 17 HA SER 17 5.482 2.111 9.036
138 HB2 SER 17 HB2 SER 17 4.001 1.823 7.011
139 HB3 SER 17 HB1 SER 17 5.435 1.307 6.123
140 HG SER 17 HG SER 17 5.632 -0.254 7.999
141 H ALA 18 HN ALA 18 7.797 2.971 6.530
142 HA ALA 18 HA ALA 18 9.516 0.753 7.411
143 HB1 ALA 18 HB1 ALA 18 8.975 0.756 5.034
144 HB2 ALA 18 HB2 ALA 18 10.701 0.995 5.302
145 HB3 ALA 18 HB3 ALA 18 9.675 2.365 4.871
146 H GLY 19 HN GLY 19 10.326 3.880 5.913
147 HA2 GLY 19 HA2 GLY 19 11.983 4.569 8.201
148 HA3 GLY 19 HA1 GLY 19 12.840 4.207 6.710
149 H GLU 20 HN GLU 20 12.531 6.710 8.305
150 HA GLU 20 HA GLU 20 10.853 8.438 6.729
151 HB2 GLU 20 HB2 GLU 20 12.765 9.020 8.992
152 HB3 GLU 20 HB1 GLU 20 11.742 10.229 8.223
153 HG2 GLU 20 HG2 GLU 20 9.756 9.020 8.924
154 HG3 GLU 20 HG1 GLU 20 10.763 7.766 9.651
155 H THR 21 HN THR 21 11.820 8.143 4.692
156 HA THR 21 HA THR 21 12.845 9.114 2.914
157 HB THR 21 HB THR 21 14.318 10.978 4.778
158 HG1 THR 21 HG1 THR 21 12.424 11.745 5.314
159 HG21 THR 21 HG21 THR 21 13.285 11.325 1.958
160 HG22 THR 21 HG22 THR 21 14.967 11.028 2.399
161 HG23 THR 21 HG23 THR 21 14.175 12.525 2.893
162 H ASP 22 HN ASP 22 14.328 7.327 5.192
163 HA ASP 22 HA ASP 22 16.775 7.138 3.577
164 HB2 ASP 22 HB2 ASP 22 17.220 8.322 5.743
165 HB3 ASP 22 HB1 ASP 22 16.706 6.863 6.587
166 H GLY 23 HN GLY 23 16.645 5.261 2.580
167 HA2 GLY 23 HA2 GLY 23 17.138 2.839 3.185
168 HA3 GLY 23 HA1 GLY 23 15.634 2.928 4.091
169 H THR 24 HN THR 24 13.794 3.906 2.674
170 HA THR 24 HA THR 24 13.845 2.501 0.100
171 HB THR 24 HB THR 24 11.292 2.581 0.364
172 HG1 THR 24 HG1 THR 24 10.555 2.810 2.492
173 HG21 THR 24 HG21 THR 24 11.299 0.564 1.790
174 HG22 THR 24 HG22 THR 24 12.972 0.903 2.236
175 HG23 THR 24 HG23 THR 24 12.565 0.526 0.562
176 H ASP 25 HN ASP 25 14.628 4.176 -1.142
177 HA ASP 25 HA ASP 25 13.548 6.823 -1.013
178 HB2 ASP 25 HB2 ASP 25 15.843 6.529 -1.717
179 HB3 ASP 25 HB1 ASP 25 15.343 5.492 -3.047
180 H LEU 26 HN LEU 26 11.388 6.724 -1.343
181 HA LEU 26 HA LEU 26 10.456 5.892 -4.008
182 HB2 LEU 26 HB2 LEU 26 9.117 6.187 -1.341
183 HB3 LEU 26 HB1 LEU 26 8.163 6.358 -2.798
184 HG LEU 26 HG LEU 26 8.805 4.078 -3.487
185 HD11 LEU 26 HD11 LEU 26 9.940 2.580 -1.990
186 HD12 LEU 26 HD12 LEU 26 10.103 3.853 -0.782
187 HD13 LEU 26 HD13 LEU 26 10.971 3.975 -2.313
188 HD21 LEU 26 HD21 LEU 26 7.484 2.883 -1.824
189 HD22 LEU 26 HD22 LEU 26 6.746 4.427 -2.244
190 HD23 LEU 26 HD23 LEU 26 7.621 4.251 -0.721
191 H SER 27 HN SER 27 11.961 8.305 -3.489
192 HA SER 27 HA SER 27 10.160 10.526 -3.318
193 HB2 SER 27 HB2 SER 27 13.058 10.567 -4.184
194 HB3 SER 27 HB1 SER 27 12.122 11.894 -3.493
195 HG SER 27 HG SER 27 13.389 9.771 -2.255
196 H GLY 28 HN GLY 28 10.903 8.436 -5.799
197 HA2 GLY 28 HA2 GLY 28 10.297 10.466 -7.850
198 HA3 GLY 28 HA1 GLY 28 11.032 8.901 -8.173
199 H ASP 29 HN ASP 29 9.733 7.017 -8.047
200 HA ASP 29 HA ASP 29 6.841 7.462 -7.802
201 HB2 ASP 29 HB2 ASP 29 6.314 6.203 -9.725
202 HB3 ASP 29 HB1 ASP 29 7.610 7.274 -10.246
203 H PHE 30 HN PHE 30 5.870 5.004 -7.949
204 HA PHE 30 HA PHE 30 7.441 3.006 -6.710
205 HB2 PHE 30 HB2 PHE 30 6.426 2.952 -4.496
206 HB3 PHE 30 HB1 PHE 30 7.216 4.498 -4.756
207 HD1 PHE 30 HD2 PHE 30 5.653 6.433 -5.592
208 HD2 PHE 30 HD1 PHE 30 4.285 2.897 -3.656
209 HE1 PHE 30 HE2 PHE 30 3.569 7.581 -4.970
210 HE2 PHE 30 HE1 PHE 30 2.204 4.046 -3.031
211 HZ PHE 30 HZ PHE 30 1.841 6.390 -3.686
212 H LEU 31 HN LEU 31 4.319 4.308 -7.522
213 HA LEU 31 HA LEU 31 2.631 2.200 -7.019
214 HB2 LEU 31 HB2 LEU 31 2.576 4.169 -9.291
215 HB3 LEU 31 HB1 LEU 31 1.254 3.082 -8.910
216 HG LEU 31 HG LEU 31 2.334 5.224 -7.069
217 HD11 LEU 31 HD11 LEU 31 0.202 6.350 -7.529
218 HD12 LEU 31 HD12 LEU 31 -0.153 5.130 -8.757
219 HD13 LEU 31 HD13 LEU 31 1.227 6.209 -8.958
220 HD21 LEU 31 HD21 LEU 31 1.410 3.397 -5.802
221 HD22 LEU 31 HD22 LEU 31 -0.033 3.371 -6.815
222 HD23 LEU 31 HD23 LEU 31 0.284 4.752 -5.766
223 H ASP 32 HN ASP 32 4.864 2.558 -9.712
224 HA ASP 32 HA ASP 32 3.635 0.289 -11.076
225 HB2 ASP 32 HB2 ASP 32 5.916 2.047 -11.989
226 HB3 ASP 32 HB1 ASP 32 5.040 0.876 -12.968
227 H LEU 33 HN LEU 33 6.155 0.885 -8.923
228 HA LEU 33 HA LEU 33 7.872 -1.245 -9.917
229 HB2 LEU 33 HB2 LEU 33 8.112 0.549 -7.504
230 HB3 LEU 33 HB1 LEU 33 9.305 -0.646 -7.976
231 HG LEU 33 HG LEU 33 8.506 1.764 -9.612
232 HD11 LEU 33 HD11 LEU 33 10.735 2.601 -9.073
233 HD12 LEU 33 HD12 LEU 33 11.005 1.214 -8.018
234 HD13 LEU 33 HD13 LEU 33 9.754 2.394 -7.625
235 HD21 LEU 33 HD21 LEU 33 10.431 1.149 -11.009
236 HD22 LEU 33 HD22 LEU 33 9.175 -0.087 -11.023
237 HD23 LEU 33 HD23 LEU 33 10.635 -0.327 -10.063
238 H ARG 34 HN ARG 34 8.383 -3.122 -8.706
239 HA ARG 34 HA ARG 34 6.094 -4.256 -7.404
240 HB2 ARG 34 HB2 ARG 34 8.845 -5.477 -7.488
241 HB3 ARG 34 HB1 ARG 34 7.294 -6.296 -7.394
242 HG2 ARG 34 HG2 ARG 34 6.801 -5.431 -9.693
243 HG3 ARG 34 HG1 ARG 34 8.475 -4.874 -9.759
244 HD2 ARG 34 HD2 ARG 34 8.250 -7.052 -10.813
245 HD3 ARG 34 HD1 ARG 34 9.255 -7.153 -9.365
246 HE ARG 34 HE ARG 34 6.408 -7.783 -9.093
247 HH11 ARG 34 HH11 ARG 34 9.715 -8.913 -9.291
248 HH12 ARG 34 HH12 ARG 34 9.359 -10.479 -8.647
249 HH21 ARG 34 HH21 ARG 34 5.928 -9.815 -8.207
250 HH22 ARG 34 HH22 ARG 34 7.206 -10.997 -8.003
251 H PHE 35 HN PHE 35 5.847 -4.835 -5.248
252 HA PHE 35 HA PHE 35 6.949 -3.228 -3.272
253 HB2 PHE 35 HB2 PHE 35 5.689 -5.958 -3.072
254 HB3 PHE 35 HB1 PHE 35 6.120 -4.994 -1.665
255 HD1 PHE 35 HD2 PHE 35 5.221 -2.433 -1.943
256 HD2 PHE 35 HD1 PHE 35 3.488 -5.922 -3.639
257 HE1 PHE 35 HE2 PHE 35 3.043 -1.289 -2.051
258 HE2 PHE 35 HE1 PHE 35 1.302 -4.794 -3.755
259 HZ PHE 35 HZ PHE 35 1.080 -2.469 -2.962
260 H GLU 36 HN GLU 36 7.797 -6.616 -3.961
261 HA GLU 36 HA GLU 36 9.881 -6.746 -2.080
262 HB2 GLU 36 HB2 GLU 36 10.585 -8.788 -3.428
263 HB3 GLU 36 HB1 GLU 36 8.975 -8.794 -2.729
264 HG2 GLU 36 HG2 GLU 36 8.554 -9.621 -4.812
265 HG3 GLU 36 HG1 GLU 36 8.257 -7.907 -5.076
266 H ASP 37 HN ASP 37 9.780 -5.351 -5.202
267 HA ASP 37 HA ASP 37 12.635 -5.495 -5.639
268 HB2 ASP 37 HB2 ASP 37 11.148 -5.659 -7.558
269 HB3 ASP 37 HB1 ASP 37 10.431 -4.100 -7.169
270 H ILE 38 HN ILE 38 10.307 -3.231 -4.349
271 HA ILE 38 HA ILE 38 12.319 -1.122 -4.271
272 HB ILE 38 HB ILE 38 10.506 0.247 -3.164
273 HG12 ILE 38 HG12 ILE 38 8.745 -2.018 -4.116
274 HG13 ILE 38 HG11 ILE 38 9.138 -1.707 -2.433
275 HG21 ILE 38 HG21 ILE 38 9.338 0.646 -5.290
276 HG22 ILE 38 HG22 ILE 38 10.024 -0.849 -5.928
277 HG23 ILE 38 HG23 ILE 38 11.082 0.495 -5.497
278 HD11 ILE 38 HD11 ILE 38 8.032 0.473 -2.590
279 HD12 ILE 38 HD12 ILE 38 6.942 -0.857 -2.987
280 HD13 ILE 38 HD13 ILE 38 7.629 0.132 -4.274
281 H GLY 39 HN GLY 39 12.337 -3.676 -2.634
282 HA2 GLY 39 HA2 GLY 39 13.554 -4.119 -0.730
283 HA3 GLY 39 HA1 GLY 39 13.616 -2.394 -0.410
284 H TYR 40 HN TYR 40 10.759 -4.497 -0.742
285 HA TYR 40 HA TYR 40 10.266 -4.080 2.131
286 HB2 TYR 40 HB2 TYR 40 8.303 -3.852 -0.147
287 HB3 TYR 40 HB1 TYR 40 7.780 -4.156 1.505
288 HD1 TYR 40 HD2 TYR 40 8.149 -2.455 3.253
289 HD2 TYR 40 HD1 TYR 40 9.040 -1.687 -0.824
290 HE1 TYR 40 HE2 TYR 40 8.208 -0.045 3.731
291 HE2 TYR 40 HE1 TYR 40 9.103 0.724 -0.372
292 HH TYR 40 HH TYR 40 8.164 2.299 1.306
293 H ASP 41 HN ASP 41 10.470 -5.929 3.113
294 HA ASP 41 HA ASP 41 10.126 -8.469 1.857
295 HB2 ASP 41 HB2 ASP 41 10.402 -7.689 4.763
296 HB3 ASP 41 HB1 ASP 41 10.287 -9.357 4.219
297 H SER 42 HN SER 42 8.615 -10.116 2.652
298 HA SER 42 HA SER 42 5.964 -9.450 2.354
299 HB2 SER 42 HB2 SER 42 5.585 -11.698 3.556
300 HB3 SER 42 HB1 SER 42 6.561 -11.707 2.082
301 H LEU 43 HN LEU 43 7.759 -9.894 5.380
302 HA LEU 43 HA LEU 43 5.637 -9.438 7.155
303 HB2 LEU 43 HB2 LEU 43 7.783 -10.387 7.845
304 HB3 LEU 43 HB1 LEU 43 8.579 -8.865 7.499
305 HG LEU 43 HG LEU 43 7.197 -7.796 9.277
306 HD11 LEU 43 HD11 LEU 43 6.062 -9.231 10.891
307 HD12 LEU 43 HD12 LEU 43 6.404 -10.637 9.882
308 HD13 LEU 43 HD13 LEU 43 5.341 -9.361 9.286
309 HD21 LEU 43 HD21 LEU 43 8.884 -10.129 10.160
310 HD22 LEU 43 HD22 LEU 43 8.447 -8.732 11.143
311 HD23 LEU 43 HD23 LEU 43 9.478 -8.527 9.726
312 H ALA 44 HN ALA 44 7.958 -7.186 5.690
313 HA ALA 44 HA ALA 44 7.053 -4.879 7.045
314 HB1 ALA 44 HB1 ALA 44 8.427 -5.095 4.367
315 HB2 ALA 44 HB2 ALA 44 9.223 -4.961 5.939
316 HB3 ALA 44 HB3 ALA 44 8.253 -3.623 5.322
317 H LEU 45 HN LEU 45 5.988 -6.536 4.174
318 HA LEU 45 HA LEU 45 4.399 -4.436 3.126
319 HB2 LEU 45 HB2 LEU 45 5.258 -6.337 1.800
320 HB3 LEU 45 HB1 LEU 45 4.168 -7.405 2.660
321 HG LEU 45 HG LEU 45 2.241 -6.243 1.713
322 HD11 LEU 45 HD11 LEU 45 2.533 -4.531 -0.003
323 HD12 LEU 45 HD12 LEU 45 4.278 -4.569 0.247
324 HD13 LEU 45 HD13 LEU 45 3.215 -4.007 1.538
325 HD21 LEU 45 HD21 LEU 45 3.157 -8.125 0.482
326 HD22 LEU 45 HD22 LEU 45 4.300 -7.062 -0.338
327 HD23 LEU 45 HD23 LEU 45 2.572 -6.899 -0.643
328 H MET 46 HN MET 46 3.637 -7.266 5.163
329 HA MET 46 HA MET 46 0.854 -6.722 5.268
330 HB2 MET 46 HB2 MET 46 0.748 -8.292 7.122
331 HB3 MET 46 HB1 MET 46 1.763 -8.936 5.844
332 HG2 MET 46 HG2 MET 46 3.750 -8.386 7.092
333 HG3 MET 46 HG1 MET 46 2.784 -7.612 8.346
334 HE1 MET 46 HE1 MET 46 0.911 -10.623 9.960
335 HE2 MET 46 HE2 MET 46 0.314 -9.604 8.649
336 HE3 MET 46 HE3 MET 46 1.196 -8.884 9.997
337 H GLU 47 HN GLU 47 3.601 -5.568 7.071
338 HA GLU 47 HA GLU 47 2.219 -4.234 9.133
339 HB2 GLU 47 HB2 GLU 47 4.900 -3.754 7.840
340 HB3 GLU 47 HB1 GLU 47 4.298 -2.747 9.150
341 HG2 GLU 47 HG2 GLU 47 4.674 -5.724 9.309
342 HG3 GLU 47 HG1 GLU 47 5.820 -4.523 9.905
343 H THR 48 HN THR 48 3.169 -3.254 5.877
344 HA THR 48 HA THR 48 2.327 -0.568 6.074
345 HB THR 48 HB THR 48 2.394 -2.243 3.562
346 HG1 THR 48 HG1 THR 48 4.401 -1.976 5.083
347 HG21 THR 48 HG21 THR 48 1.311 -0.092 3.276
348 HG22 THR 48 HG22 THR 48 2.894 -0.063 2.494
349 HG23 THR 48 HG23 THR 48 2.661 0.722 4.060
350 H ALA 49 HN ALA 49 0.669 -3.537 5.102
351 HA ALA 49 HA ALA 49 -1.752 -2.445 4.242
352 HB1 ALA 49 HB1 ALA 49 -2.737 -4.621 4.720
353 HB2 ALA 49 HB2 ALA 49 -1.339 -5.049 5.705
354 HB3 ALA 49 HB3 ALA 49 -1.152 -4.806 3.970
355 H ALA 50 HN ALA 50 -0.689 -3.335 7.495
356 HA ALA 50 HA ALA 50 -3.085 -2.810 8.858
357 HB1 ALA 50 HB1 ALA 50 -1.672 -2.637 10.873
358 HB2 ALA 50 HB2 ALA 50 -0.237 -2.642 9.847
359 HB3 ALA 50 HB3 ALA 50 -1.289 -4.058 9.903
360 H ARG 51 HN ARG 51 -0.433 -0.763 7.853
361 HA ARG 51 HA ARG 51 -1.058 1.578 9.248
362 HB2 ARG 51 HB2 ARG 51 0.293 1.086 6.601
363 HB3 ARG 51 HB1 ARG 51 0.102 2.701 7.253
364 HG2 ARG 51 HG2 ARG 51 1.518 0.449 8.652
365 HG3 ARG 51 HG1 ARG 51 2.310 1.722 7.721
366 HD2 ARG 51 HD2 ARG 51 1.661 3.392 9.223
367 HD3 ARG 51 HD1 ARG 51 0.445 2.369 9.975
368 HE ARG 51 HE ARG 51 3.305 1.759 10.270
369 HH11 ARG 51 HH11 ARG 51 0.161 2.465 11.609
370 HH12 ARG 51 HH12 ARG 51 0.639 2.210 13.251
371 HH21 ARG 51 HH21 ARG 51 3.978 1.456 12.452
372 HH22 ARG 51 HH22 ARG 51 2.818 1.640 13.736
373 H LEU 52 HN LEU 52 -2.214 0.348 6.160
374 HA LEU 52 HA LEU 52 -3.678 2.701 5.497
375 HB2 LEU 52 HB2 LEU 52 -3.914 -0.111 4.434
376 HB3 LEU 52 HB1 LEU 52 -4.646 1.311 3.710
377 HG LEU 52 HG LEU 52 -1.677 0.819 4.001
378 HD11 LEU 52 HD11 LEU 52 -3.458 0.736 1.573
379 HD12 LEU 52 HD12 LEU 52 -2.705 -0.653 2.358
380 HD13 LEU 52 HD13 LEU 52 -1.702 0.569 1.576
381 HD21 LEU 52 HD21 LEU 52 -3.197 3.051 2.653
382 HD22 LEU 52 HD22 LEU 52 -1.453 2.799 2.554
383 HD23 LEU 52 HD23 LEU 52 -2.202 3.188 4.102
384 H GLU 53 HN GLU 53 -4.602 -0.494 6.757
385 HA GLU 53 HA GLU 53 -7.362 -0.003 6.831
386 HB2 GLU 53 HB2 GLU 53 -5.702 -1.891 8.493
387 HB3 GLU 53 HB1 GLU 53 -7.459 -1.860 8.507
388 HG2 GLU 53 HG2 GLU 53 -7.331 -2.241 6.002
389 HG3 GLU 53 HG1 GLU 53 -5.630 -2.626 6.259
390 H SER 54 HN SER 54 -4.871 0.551 9.290
391 HA SER 54 HA SER 54 -6.673 1.238 11.355
392 HB2 SER 54 HB2 SER 54 -3.776 2.035 11.027
393 HB3 SER 54 HB1 SER 54 -4.704 2.093 12.527
394 HG SER 54 HG SER 54 -3.838 -0.162 11.057
395 H ARG 55 HN ARG 55 -5.420 3.075 8.680
396 HA ARG 55 HA ARG 55 -6.000 5.621 9.937
397 HB2 ARG 55 HB2 ARG 55 -4.074 5.478 8.470
398 HB3 ARG 55 HB1 ARG 55 -5.090 4.959 7.133
399 HG2 ARG 55 HG2 ARG 55 -6.165 7.092 7.031
400 HG3 ARG 55 HG1 ARG 55 -5.370 7.618 8.515
401 HD2 ARG 55 HD2 ARG 55 -3.968 6.948 5.926
402 HD3 ARG 55 HD1 ARG 55 -4.331 8.577 6.498
403 HE ARG 55 HE ARG 55 -2.905 7.304 8.517
404 HH11 ARG 55 HH11 ARG 55 -2.385 8.507 5.264
405 HH12 ARG 55 HH12 ARG 55 -0.663 8.605 5.450
406 HH21 ARG 55 HH21 ARG 55 -0.637 7.477 8.760
407 HH22 ARG 55 HH22 ARG 55 0.340 8.036 7.433
408 H TYR 56 HN TYR 56 -7.341 3.663 7.292
409 HA TYR 56 HA TYR 56 -9.457 5.652 6.958
410 HB2 TYR 56 HB2 TYR 56 -8.705 3.236 5.316
411 HB3 TYR 56 HB1 TYR 56 -10.073 4.283 4.957
412 HD1 TYR 56 HD2 TYR 56 -9.682 6.628 4.259
413 HD2 TYR 56 HD1 TYR 56 -6.465 3.887 4.764
414 HE1 TYR 56 HE2 TYR 56 -8.216 8.115 2.959
415 HE2 TYR 56 HE1 TYR 56 -4.990 5.364 3.465
416 HH TYR 56 HH TYR 56 -5.764 8.558 2.706
417 H GLY 57 HN GLY 57 -8.965 2.597 8.446
418 HA2 GLY 57 HA2 GLY 57 -10.421 1.299 9.674
419 HA3 GLY 57 HA1 GLY 57 -11.677 2.488 9.360
420 H VAL 58 HN VAL 58 -9.771 0.659 7.023
421 HA VAL 58 HA VAL 58 -12.286 -0.176 5.786
422 HB VAL 58 HB VAL 58 -10.911 -0.732 3.797
423 HG11 VAL 58 HG11 VAL 58 -10.369 1.576 3.168
424 HG12 VAL 58 HG12 VAL 58 -10.552 2.068 4.853
425 HG13 VAL 58 HG13 VAL 58 -11.944 1.458 3.955
426 HG21 VAL 58 HG21 VAL 58 -8.806 -1.235 4.948
427 HG22 VAL 58 HG22 VAL 58 -8.644 0.462 5.397
428 HG23 VAL 58 HG23 VAL 58 -8.572 -0.010 3.700
429 H SER 59 HN SER 59 -11.788 -2.340 4.421
430 HA SER 59 HA SER 59 -10.574 -4.296 6.233
431 HB2 SER 59 HB2 SER 59 -12.481 -5.853 5.493
432 HB3 SER 59 HB1 SER 59 -12.882 -4.589 6.655
433 HG SER 59 HG SER 59 -13.794 -4.978 4.104
434 H ILE 60 HN ILE 60 -8.839 -4.928 5.127
435 HA ILE 60 HA ILE 60 -8.990 -5.306 2.238
436 HB ILE 60 HB ILE 60 -6.659 -5.677 4.136
437 HG12 ILE 60 HG12 ILE 60 -7.266 -3.428 2.195
438 HG13 ILE 60 HG11 ILE 60 -7.442 -3.333 3.944
439 HG21 ILE 60 HG21 ILE 60 -6.725 -5.646 1.120
440 HG22 ILE 60 HG22 ILE 60 -6.452 -7.060 2.136
441 HG23 ILE 60 HG23 ILE 60 -5.276 -5.745 2.120
442 HD11 ILE 60 HD11 ILE 60 -5.388 -2.272 3.178
443 HD12 ILE 60 HD12 ILE 60 -4.859 -3.800 2.474
444 HD13 ILE 60 HD13 ILE 60 -5.052 -3.655 4.220
445 HA PRO 61 HA PRO 61 -10.038 -9.627 3.091
446 HB2 PRO 61 HB2 PRO 61 -10.215 -9.793 0.166
447 HB3 PRO 61 HB1 PRO 61 -11.465 -10.078 1.378
448 HG2 PRO 61 HG2 PRO 61 -11.509 -7.925 -0.242
449 HG3 PRO 61 HG1 PRO 61 -12.117 -7.869 1.425
450 HD2 PRO 61 HD2 PRO 61 -9.493 -6.900 0.325
451 HD3 PRO 61 HD1 PRO 61 -10.565 -6.135 1.518
452 H ASP 62 HN ASP 62 -8.446 -11.020 3.480
453 HA ASP 62 HA ASP 62 -5.871 -10.771 2.343
454 HB2 ASP 62 HB2 ASP 62 -5.268 -12.725 3.660
455 HB3 ASP 62 HB1 ASP 62 -6.248 -11.626 4.624
456 H ASP 63 HN ASP 63 -8.592 -12.105 1.011
457 HA ASP 63 HA ASP 63 -7.468 -14.347 -0.351
458 HB2 ASP 63 HB2 ASP 63 -9.907 -12.661 -0.963
459 HB3 ASP 63 HB1 ASP 63 -9.467 -14.113 -1.854
460 H VAL 64 HN VAL 64 -8.642 -11.274 -1.694
461 HA VAL 64 HA VAL 64 -7.088 -11.601 -4.076
462 HB VAL 64 HB VAL 64 -8.588 -9.133 -3.193
463 HG11 VAL 64 HG11 VAL 64 -7.049 -8.831 -5.091
464 HG12 VAL 64 HG12 VAL 64 -8.738 -8.644 -5.565
465 HG13 VAL 64 HG13 VAL 64 -7.874 -10.133 -5.948
466 HG21 VAL 64 HG21 VAL 64 -10.494 -10.007 -4.465
467 HG22 VAL 64 HG22 VAL 64 -10.084 -11.056 -3.109
468 HG23 VAL 64 HG23 VAL 64 -9.614 -11.509 -4.747
469 H ALA 65 HN ALA 65 -6.516 -10.238 -1.008
470 HA ALA 65 HA ALA 65 -4.758 -8.151 -1.635
471 HB1 ALA 65 HB1 ALA 65 -4.706 -9.926 0.795
472 HB2 ALA 65 HB2 ALA 65 -5.724 -8.500 0.595
473 HB3 ALA 65 HB3 ALA 65 -3.968 -8.329 0.646
474 H GLY 66 HN GLY 66 -4.282 -11.599 -1.431
475 HA2 GLY 66 HA2 GLY 66 -1.397 -11.392 -1.565
476 HA3 GLY 66 HA1 GLY 66 -2.342 -12.874 -1.598
477 H ARG 67 HN ARG 67 -2.995 -10.225 -3.782
478 HA ARG 67 HA ARG 67 -1.671 -11.667 -5.963
479 HB2 ARG 67 HB2 ARG 67 -4.542 -10.717 -6.017
480 HB3 ARG 67 HB1 ARG 67 -3.664 -11.369 -7.396
481 HG2 ARG 67 HG2 ARG 67 -3.421 -13.505 -6.228
482 HG3 ARG 67 HG1 ARG 67 -4.321 -12.855 -4.856
483 HD2 ARG 67 HD2 ARG 67 -5.752 -14.207 -6.311
484 HD3 ARG 67 HD1 ARG 67 -6.270 -12.520 -6.280
485 HE ARG 67 HE ARG 67 -4.609 -13.595 -8.473
486 HH11 ARG 67 HH11 ARG 67 -7.484 -11.960 -7.338
487 HH12 ARG 67 HH12 ARG 67 -7.977 -11.435 -8.915
488 HH21 ARG 67 HH21 ARG 67 -5.236 -12.908 -10.546
489 HH22 ARG 67 HH22 ARG 67 -6.674 -11.946 -10.743
490 H VAL 68 HN VAL 68 -1.879 -8.873 -4.339
491 HA VAL 68 HA VAL 68 -1.713 -7.137 -6.684
492 HB VAL 68 HB VAL 68 -1.570 -5.263 -5.020
493 HG11 VAL 68 HG11 VAL 68 -3.954 -5.373 -4.422
494 HG12 VAL 68 HG12 VAL 68 -3.968 -7.082 -4.856
495 HG13 VAL 68 HG13 VAL 68 -3.661 -5.862 -6.091
496 HG21 VAL 68 HG21 VAL 68 -2.283 -5.743 -2.706
497 HG22 VAL 68 HG22 VAL 68 -0.720 -6.462 -3.095
498 HG23 VAL 68 HG23 VAL 68 -2.168 -7.468 -3.051
499 H ASP 69 HN ASP 69 0.162 -6.975 -7.635
500 HA ASP 69 HA ASP 69 2.597 -7.635 -6.183
501 HB2 ASP 69 HB2 ASP 69 2.076 -8.649 -8.410
502 HB3 ASP 69 HB1 ASP 69 2.222 -7.051 -9.132
503 H THR 70 HN THR 70 1.173 -4.924 -7.905
504 HA THR 70 HA THR 70 3.420 -3.235 -7.034
505 HB THR 70 HB THR 70 2.758 -1.701 -8.893
506 HG1 THR 70 HG1 THR 70 1.304 -3.784 -10.098
507 HG21 THR 70 HG21 THR 70 4.588 -3.298 -9.208
508 HG22 THR 70 HG22 THR 70 3.682 -3.079 -10.705
509 HG23 THR 70 HG23 THR 70 3.433 -4.526 -9.732
510 HA PRO 71 HA PRO 71 0.747 -0.763 -4.463
511 HB2 PRO 71 HB2 PRO 71 2.109 1.520 -5.815
512 HB3 PRO 71 HB1 PRO 71 1.870 1.222 -4.090
513 HG2 PRO 71 HG2 PRO 71 4.242 0.802 -5.179
514 HG3 PRO 71 HG1 PRO 71 3.591 -0.360 -4.006
515 HD2 PRO 71 HD2 PRO 71 3.733 -0.561 -6.992
516 HD3 PRO 71 HD1 PRO 71 4.007 -1.815 -5.765
517 H ARG 72 HN ARG 72 1.061 -0.069 -7.911
518 HA ARG 72 HA ARG 72 -1.110 1.623 -8.303
519 HB2 ARG 72 HB2 ARG 72 0.450 0.983 -10.096
520 HB3 ARG 72 HB1 ARG 72 -0.194 -0.653 -10.080
521 HG2 ARG 72 HG2 ARG 72 -2.418 0.297 -10.670
522 HG3 ARG 72 HG1 ARG 72 -1.635 1.864 -10.874
523 HD2 ARG 72 HD2 ARG 72 -0.838 -0.632 -12.359
524 HD3 ARG 72 HD1 ARG 72 -1.980 0.556 -12.975
525 HE ARG 72 HE ARG 72 0.650 1.567 -12.226
526 HH11 ARG 72 HH11 ARG 72 -1.486 0.438 -14.771
527 HH12 ARG 72 HH12 ARG 72 -0.573 1.174 -16.051
528 HH21 ARG 72 HH21 ARG 72 1.872 2.513 -13.892
529 HH22 ARG 72 HH22 ARG 72 1.352 2.351 -15.549
530 H GLU 73 HN GLU 73 -1.072 -1.918 -8.500
531 HA GLU 73 HA GLU 73 -3.855 -2.268 -8.689
532 HB2 GLU 73 HB2 GLU 73 -1.723 -4.132 -7.626
533 HB3 GLU 73 HB1 GLU 73 -3.374 -4.612 -7.983
534 HG2 GLU 73 HG2 GLU 73 -1.403 -3.536 -9.982
535 HG3 GLU 73 HG1 GLU 73 -1.811 -5.234 -9.756
536 H LEU 74 HN LEU 74 -1.663 -2.199 -5.931
537 HA LEU 74 HA LEU 74 -3.413 -2.943 -3.897
538 HB2 LEU 74 HB2 LEU 74 -0.886 -2.530 -3.841
539 HB3 LEU 74 HB1 LEU 74 -1.269 -0.836 -3.633
540 HG LEU 74 HG LEU 74 -0.687 -2.125 -1.540
541 HD11 LEU 74 HD11 LEU 74 -1.767 0.027 -1.399
542 HD12 LEU 74 HD12 LEU 74 -2.437 -1.060 -0.181
543 HD13 LEU 74 HD13 LEU 74 -3.344 -0.720 -1.654
544 HD21 LEU 74 HD21 LEU 74 -2.443 -3.481 -0.529
545 HD22 LEU 74 HD22 LEU 74 -1.898 -4.172 -2.059
546 HD23 LEU 74 HD23 LEU 74 -3.427 -3.295 -1.982
547 H LEU 75 HN LEU 75 -2.618 0.342 -5.008
548 HA LEU 75 HA LEU 75 -4.445 1.721 -3.403
549 HB2 LEU 75 HB2 LEU 75 -2.590 2.781 -4.618
550 HB3 LEU 75 HB1 LEU 75 -3.394 2.451 -6.139
551 HG LEU 75 HG LEU 75 -5.251 3.949 -5.445
552 HD11 LEU 75 HD11 LEU 75 -3.448 4.591 -3.117
553 HD12 LEU 75 HD12 LEU 75 -4.991 3.743 -3.029
554 HD13 LEU 75 HD13 LEU 75 -4.940 5.430 -3.539
555 HD21 LEU 75 HD21 LEU 75 -3.456 4.775 -6.853
556 HD22 LEU 75 HD22 LEU 75 -2.493 5.168 -5.428
557 HD23 LEU 75 HD23 LEU 75 -3.998 6.032 -5.741
558 H ASP 76 HN ASP 76 -4.772 0.635 -6.773
559 HA ASP 76 HA ASP 76 -7.334 1.691 -7.212
560 HB2 ASP 76 HB2 ASP 76 -5.746 0.969 -8.986
561 HB3 ASP 76 HB1 ASP 76 -6.080 -0.706 -8.561
562 H LEU 77 HN LEU 77 -6.287 -1.412 -5.933
563 HA LEU 77 HA LEU 77 -8.755 -2.752 -6.001
564 HB2 LEU 77 HB2 LEU 77 -6.510 -3.767 -5.555
565 HB3 LEU 77 HB1 LEU 77 -6.541 -3.048 -3.962
566 HG LEU 77 HG LEU 77 -7.117 -5.517 -4.137
567 HD11 LEU 77 HD11 LEU 77 -9.073 -3.670 -2.786
568 HD12 LEU 77 HD12 LEU 77 -7.558 -4.277 -2.117
569 HD13 LEU 77 HD13 LEU 77 -8.887 -5.390 -2.443
570 HD21 LEU 77 HD21 LEU 77 -9.445 -6.048 -4.693
571 HD22 LEU 77 HD22 LEU 77 -8.551 -5.433 -6.083
572 HD23 LEU 77 HD23 LEU 77 -9.686 -4.387 -5.229
573 H ILE 78 HN ILE 78 -7.232 -0.829 -3.427
574 HA ILE 78 HA ILE 78 -9.422 -1.109 -1.640
575 HB ILE 78 HB ILE 78 -7.175 0.910 -1.643
576 HG12 ILE 78 HG12 ILE 78 -7.505 -1.679 -0.111
577 HG13 ILE 78 HG11 ILE 78 -6.498 -1.484 -1.542
578 HG21 ILE 78 HG21 ILE 78 -9.083 1.667 -0.302
579 HG22 ILE 78 HG22 ILE 78 -7.712 1.243 0.721
580 HG23 ILE 78 HG23 ILE 78 -9.074 0.135 0.572
581 HD11 ILE 78 HD11 ILE 78 -6.114 -0.060 1.080
582 HD12 ILE 78 HD12 ILE 78 -5.095 0.097 -0.354
583 HD13 ILE 78 HD13 ILE 78 -5.188 -1.445 0.500
584 H ASN 79 HN ASN 79 -8.461 1.359 -3.995
585 HA ASN 79 HA ASN 79 -10.454 3.244 -3.386
586 HB2 ASN 79 HB2 ASN 79 -8.989 2.628 -5.947
587 HB3 ASN 79 HB1 ASN 79 -10.218 3.882 -5.866
588 HD21 ASN 79 HD21 ASN 79 -9.452 4.543 -3.077
589 HD22 ASN 79 HD22 ASN 79 -7.991 5.459 -3.221
590 H GLY 80 HN GLY 80 -10.492 0.441 -5.565
591 HA2 GLY 80 HA2 GLY 80 -13.040 0.862 -6.673
592 HA3 GLY 80 HA1 GLY 80 -12.221 -0.688 -6.551
593 H ALA 81 HN ALA 81 -12.048 -0.757 -3.716
594 HA ALA 81 HA ALA 81 -14.598 -1.854 -3.099
595 HB1 ALA 81 HB1 ALA 81 -13.659 -2.295 -0.891
596 HB2 ALA 81 HB2 ALA 81 -12.288 -1.245 -1.249
597 HB3 ALA 81 HB3 ALA 81 -12.513 -2.741 -2.155
598 H LEU 82 HN LEU 82 -12.890 1.073 -2.078
599 HA LEU 82 HA LEU 82 -14.914 1.914 -0.266
600 HB2 LEU 82 HB2 LEU 82 -12.651 3.401 -1.581
601 HB3 LEU 82 HB1 LEU 82 -13.702 4.106 -0.369
602 HG LEU 82 HG LEU 82 -11.869 1.743 0.044
603 HD11 LEU 82 HD11 LEU 82 -11.744 4.580 1.062
604 HD12 LEU 82 HD12 LEU 82 -10.660 3.847 -0.121
605 HD13 LEU 82 HD13 LEU 82 -10.667 3.268 1.545
606 HD21 LEU 82 HD21 LEU 82 -12.540 1.888 2.383
607 HD22 LEU 82 HD22 LEU 82 -13.931 1.562 1.348
608 HD23 LEU 82 HD23 LEU 82 -13.667 3.184 1.988
609 H ALA 83 HN ALA 83 -14.341 2.422 -3.664
610 HA ALA 83 HA ALA 83 -15.922 4.718 -4.037
611 HB1 ALA 83 HB1 ALA 83 -15.359 2.526 -6.025
612 HB2 ALA 83 HB2 ALA 83 -14.292 3.885 -5.677
613 HB3 ALA 83 HB3 ALA 83 -15.876 4.173 -6.395
614 H GLU 84 HN GLU 84 -16.802 1.434 -3.531
615 HA GLU 84 HA GLU 84 -19.399 1.610 -4.742
616 HB2 GLU 84 HB2 GLU 84 -18.114 -0.515 -4.507
617 HB3 GLU 84 HB1 GLU 84 -18.348 -0.429 -2.767
618 HG2 GLU 84 HG2 GLU 84 -19.923 -1.966 -3.728
619 HG3 GLU 84 HG1 GLU 84 -20.777 -0.550 -3.114
620 H ALA 85 HN ALA 85 -18.054 2.579 -1.741
621 HA ALA 85 HA ALA 85 -20.772 2.877 -0.631
622 HB1 ALA 85 HB1 ALA 85 -19.870 2.480 1.596
623 HB2 ALA 85 HB2 ALA 85 -18.264 2.226 0.912
624 HB3 ALA 85 HB3 ALA 85 -19.572 1.105 0.535
625 H ALA 86 HN ALA 86 -18.323 4.561 -1.903
626 HA ALA 86 HA ALA 86 -18.381 6.742 0.042
627 HB1 ALA 86 HB1 ALA 86 -16.573 7.725 -1.292
628 HB2 ALA 86 HB2 ALA 86 -16.696 6.391 -2.439
629 HB3 ALA 86 HB3 ALA 86 -16.182 6.083 -0.779
630 H28 SXO 87 H28B SXO 87 6.272 -12.330 5.952
631 H28A SXO 87 H28A SXO 87 7.259 -13.614 6.648
632 H30 SXO 87 H30A SXO 87 5.559 -12.986 8.566
633 H30A SXO 87 H30C SXO 87 4.631 -12.030 7.410
634 H30B SXO 87 H30B SXO 87 3.852 -13.339 8.299
635 H31 SXO 87 H31A SXO 87 4.318 -14.695 4.879
636 H31A SXO 87 H31B SXO 87 3.735 -13.106 5.369
637 H31B SXO 87 H31C SXO 87 3.146 -14.548 6.193
638 H32 SXO 87 H32A SXO 87 6.148 -15.301 8.133
639 HO33 SXO 87 H33A SXO 87 5.395 -16.575 5.719
640 HN36 SXO 87 H36A SXO 87 3.877 -14.690 9.135
641 H37 SXO 87 H37A SXO 87 2.055 -17.005 8.883
642 H37A SXO 87 H37B SXO 87 2.456 -16.222 10.409
643 H38 SXO 87 H38B SXO 87 1.415 -14.125 9.508
644 H38A SXO 87 H38A SXO 87 0.298 -15.464 9.777
645 HN41 SXO 87 H41A SXO 87 -0.192 -13.262 8.145
646 H42 SXO 87 H42A SXO 87 0.093 -14.041 5.364
647 H42A SXO 87 H42B SXO 87 -1.541 -14.122 6.023
648 H43 SXO 87 H43B SXO 87 -1.410 -11.739 6.614
649 H43A SXO 87 H43A SXO 87 0.212 -11.666 5.905
650 H2 SXO 87 H2A SXO 87 -2.037 -8.434 3.215
651 H2A SXO 87 H2B SXO 87 -3.191 -9.762 3.104
652 H3 SXO 87 H3B SXO 87 -1.550 -11.035 1.771
653 H3A SXO 87 H3A SXO 87 -2.037 -9.522 1.006
654 H4 SXO 87 H4A SXO 87 0.396 -9.970 0.855
655 H4A SXO 87 H4B SXO 87 0.486 -9.900 2.614
656 H5 SXO 87 H5B SXO 87 -0.366 -7.587 2.540
657 H5A SXO 87 H5A SXO 87 1.163 -7.778 1.680
658 H6 SXO 87 H6A SXO 87 -1.591 -7.639 0.448
659 H6A SXO 87 H6B SXO 87 -0.107 -7.966 -0.444
660 H7 SXO 87 H7A SXO 87 -0.723 -5.620 -0.653
661 H7A SXO 87 H7B SXO 87 0.781 -5.774 0.267
662 H8 SXO 87 H8C SXO 87 -0.489 -5.551 2.349
663 H8A SXO 87 H8A SXO 87 -1.979 -5.379 1.421
664 H8B SXO 87 H8B SXO 87 -0.716 -4.153 1.298
Start of MODEL 16
1 H1 MET 1 HT1 MET 1 -11.540 11.479 -6.998
2 H2 MET 1 HT2 MET 1 -11.061 12.865 -6.144
3 H3 MET 1 HT3 MET 1 -11.634 13.006 -7.730
4 HA MET 1 HA MET 1 -13.301 13.711 -6.161
5 HB2 MET 1 HB2 MET 1 -13.984 12.636 -8.276
6 HB3 MET 1 HB1 MET 1 -13.979 11.068 -7.476
7 HG2 MET 1 HG2 MET 1 -15.764 11.804 -5.994
8 HG3 MET 1 HG1 MET 1 -15.750 13.394 -6.750
9 HE1 MET 1 HE1 MET 1 -19.137 11.859 -7.992
10 HE2 MET 1 HE2 MET 1 -18.370 13.213 -7.163
11 HE3 MET 1 HE3 MET 1 -18.388 11.613 -6.416
12 H ALA 2 HN ALA 2 -13.914 13.642 -4.145
13 HA ALA 2 HA ALA 2 -14.523 12.938 -2.079
14 HB1 ALA 2 HB1 ALA 2 -15.770 11.135 -3.173
15 HB2 ALA 2 HB2 ALA 2 -15.077 10.618 -1.636
16 HB3 ALA 2 HB3 ALA 2 -14.323 10.125 -3.152
17 H THR 3 HN THR 3 -13.677 11.697 -0.170
18 HA THR 3 HA THR 3 -10.796 11.940 -0.119
19 HB THR 3 HB THR 3 -11.150 11.425 2.348
20 HG1 THR 3 HG1 THR 3 -13.208 10.385 2.054
21 HG21 THR 3 HG21 THR 3 -10.940 13.724 1.465
22 HG22 THR 3 HG22 THR 3 -12.033 13.635 2.847
23 HG23 THR 3 HG23 THR 3 -12.687 13.764 1.215
24 H LEU 4 HN LEU 4 -9.667 10.238 -0.823
25 HA LEU 4 HA LEU 4 -10.407 7.554 0.096
26 HB2 LEU 4 HB2 LEU 4 -9.668 8.219 -2.762
27 HB3 LEU 4 HB1 LEU 4 -10.039 6.630 -2.131
28 HG LEU 4 HG LEU 4 -12.023 8.902 -2.314
29 HD11 LEU 4 HD11 LEU 4 -13.001 7.618 -4.159
30 HD12 LEU 4 HD12 LEU 4 -11.662 6.475 -4.069
31 HD13 LEU 4 HD13 LEU 4 -11.362 8.151 -4.532
32 HD21 LEU 4 HD21 LEU 4 -12.559 7.343 -0.537
33 HD22 LEU 4 HD22 LEU 4 -12.364 5.983 -1.646
34 HD23 LEU 4 HD23 LEU 4 -13.677 7.135 -1.886
35 H LEU 5 HN LEU 5 -8.513 6.044 -0.893
36 HA LEU 5 HA LEU 5 -6.068 7.033 0.284
37 HB2 LEU 5 HB2 LEU 5 -7.166 4.591 0.188
38 HB3 LEU 5 HB1 LEU 5 -6.194 4.482 -1.262
39 HG LEU 5 HG LEU 5 -5.133 5.029 1.512
40 HD11 LEU 5 HD11 LEU 5 -5.037 2.560 -0.210
41 HD12 LEU 5 HD12 LEU 5 -5.923 2.758 1.303
42 HD13 LEU 5 HD13 LEU 5 -4.160 2.778 1.303
43 HD21 LEU 5 HD21 LEU 5 -2.927 4.670 0.496
44 HD22 LEU 5 HD22 LEU 5 -3.740 6.088 -0.162
45 HD23 LEU 5 HD23 LEU 5 -3.686 4.593 -1.096
46 H THR 6 HN THR 6 -4.497 8.064 -0.864
47 HA THR 6 HA THR 6 -4.572 7.787 -3.796
48 HB THR 6 HB THR 6 -3.940 10.111 -4.044
49 HG1 THR 6 HG1 THR 6 -4.231 10.432 -1.217
50 HG21 THR 6 HG21 THR 6 -6.303 9.792 -2.187
51 HG22 THR 6 HG22 THR 6 -6.323 9.633 -3.944
52 HG23 THR 6 HG23 THR 6 -5.982 11.196 -3.204
53 H THR 7 HN THR 7 -2.429 8.954 -4.666
54 HA THR 7 HA THR 7 -0.282 7.267 -4.141
55 HB THR 7 HB THR 7 -0.112 10.061 -5.278
56 HG1 THR 7 HG1 THR 7 -0.534 9.019 -7.291
57 HG21 THR 7 HG21 THR 7 2.051 9.021 -4.845
58 HG22 THR 7 HG22 THR 7 1.754 9.136 -6.580
59 HG23 THR 7 HG23 THR 7 1.559 7.590 -5.750
60 H ASP 8 HN ASP 8 -0.700 10.684 -3.213
61 HA ASP 8 HA ASP 8 1.692 10.894 -1.742
62 HB2 ASP 8 HB2 ASP 8 0.469 12.850 -2.573
63 HB3 ASP 8 HB1 ASP 8 -0.861 12.493 -1.476
64 H ASP 9 HN ASP 9 -1.565 9.948 -0.813
65 HA ASP 9 HA ASP 9 -1.126 9.861 1.980
66 HB2 ASP 9 HB2 ASP 9 -3.091 8.479 0.171
67 HB3 ASP 9 HB1 ASP 9 -3.049 8.154 1.901
68 H LEU 10 HN LEU 10 -0.841 7.388 -0.551
69 HA LEU 10 HA LEU 10 -0.104 5.249 1.126
70 HB2 LEU 10 HB2 LEU 10 -0.825 5.041 -1.240
71 HB3 LEU 10 HB1 LEU 10 0.692 5.761 -1.743
72 HG LEU 10 HG LEU 10 1.888 3.826 -0.697
73 HD11 LEU 10 HD11 LEU 10 0.167 3.161 0.891
74 HD12 LEU 10 HD12 LEU 10 0.580 1.821 -0.180
75 HD13 LEU 10 HD13 LEU 10 -0.909 2.730 -0.438
76 HD21 LEU 10 HD21 LEU 10 1.390 2.281 -2.496
77 HD22 LEU 10 HD22 LEU 10 1.387 3.936 -3.106
78 HD23 LEU 10 HD23 LEU 10 -0.137 3.102 -2.810
79 H ARG 11 HN ARG 11 1.718 7.788 -0.448
80 HA ARG 11 HA ARG 11 4.335 6.998 -0.014
81 HB2 ARG 11 HB2 ARG 11 3.788 8.912 -1.365
82 HB3 ARG 11 HB1 ARG 11 3.075 9.741 0.006
83 HG2 ARG 11 HG2 ARG 11 5.291 9.886 1.050
84 HG3 ARG 11 HG1 ARG 11 5.989 9.098 -0.366
85 HD2 ARG 11 HD2 ARG 11 4.431 11.681 -0.456
86 HD3 ARG 11 HD1 ARG 11 6.190 11.590 -0.377
87 HE ARG 11 HE ARG 11 5.919 10.243 -2.540
88 HH11 ARG 11 HH11 ARG 11 3.691 12.791 -1.597
89 HH12 ARG 11 HH12 ARG 11 3.413 13.310 -3.228
90 HH21 ARG 11 HH21 ARG 11 5.527 10.916 -4.684
91 HH22 ARG 11 HH22 ARG 11 4.443 12.251 -4.986
92 H ARG 12 HN ARG 12 1.992 8.121 2.300
93 HA ARG 12 HA ARG 12 3.947 8.798 4.308
94 HB2 ARG 12 HB2 ARG 12 0.959 8.450 4.557
95 HB3 ARG 12 HB1 ARG 12 2.016 9.162 5.768
96 HG2 ARG 12 HG2 ARG 12 1.704 10.277 2.994
97 HG3 ARG 12 HG1 ARG 12 0.709 10.782 4.359
98 HD2 ARG 12 HD2 ARG 12 2.538 12.337 4.030
99 HD3 ARG 12 HD1 ARG 12 2.740 11.482 5.557
100 HE ARG 12 HE ARG 12 4.319 10.015 4.160
101 HH11 ARG 12 HH11 ARG 12 3.811 13.435 3.657
102 HH12 ARG 12 HH12 ARG 12 5.413 13.715 3.028
103 HH21 ARG 12 HH21 ARG 12 6.434 10.366 3.372
104 HH22 ARG 12 HH22 ARG 12 6.927 11.965 2.901
105 H ALA 13 HN ALA 13 1.753 6.089 3.686
106 HA ALA 13 HA ALA 13 2.004 4.897 6.225
107 HB1 ALA 13 HB1 ALA 13 1.249 3.566 3.635
108 HB2 ALA 13 HB2 ALA 13 0.148 4.466 4.680
109 HB3 ALA 13 HB3 ALA 13 0.902 2.981 5.262
110 H LEU 14 HN LEU 14 3.813 4.399 3.227
111 HA LEU 14 HA LEU 14 5.262 2.130 4.070
112 HB2 LEU 14 HB2 LEU 14 5.767 4.247 2.006
113 HB3 LEU 14 HB1 LEU 14 6.996 3.053 2.360
114 HG LEU 14 HG LEU 14 5.799 2.349 0.420
115 HD11 LEU 14 HD11 LEU 14 4.955 0.174 1.133
116 HD12 LEU 14 HD12 LEU 14 4.906 0.739 2.803
117 HD13 LEU 14 HD13 LEU 14 6.451 0.594 1.968
118 HD21 LEU 14 HD21 LEU 14 3.395 1.943 0.411
119 HD22 LEU 14 HD22 LEU 14 3.759 3.639 0.737
120 HD23 LEU 14 HD23 LEU 14 3.277 2.570 2.054
121 H VAL 15 HN VAL 15 5.695 5.543 4.605
122 HA VAL 15 HA VAL 15 8.366 5.291 5.633
123 HB VAL 15 HB VAL 15 6.412 7.599 5.687
124 HG11 VAL 15 HG11 VAL 15 7.975 7.819 7.526
125 HG12 VAL 15 HG12 VAL 15 8.339 9.002 6.269
126 HG13 VAL 15 HG13 VAL 15 9.333 7.554 6.431
127 HG21 VAL 15 HG21 VAL 15 8.828 7.082 3.951
128 HG22 VAL 15 HG22 VAL 15 7.829 8.535 3.919
129 HG23 VAL 15 HG23 VAL 15 7.142 6.983 3.439
130 H GLU 16 HN GLU 16 5.104 5.567 6.968
131 HA GLU 16 HA GLU 16 5.725 5.967 9.651
132 HB2 GLU 16 HB2 GLU 16 3.483 4.309 8.497
133 HB3 GLU 16 HB1 GLU 16 3.578 4.855 10.161
134 HG2 GLU 16 HG2 GLU 16 3.506 7.192 9.337
135 HG3 GLU 16 HG1 GLU 16 3.246 6.561 7.707
136 H SER 17 HN SER 17 5.468 2.968 7.815
137 HA SER 17 HA SER 17 5.874 1.369 10.193
138 HB2 SER 17 HB2 SER 17 5.618 -0.522 8.430
139 HB3 SER 17 HB1 SER 17 4.214 0.468 8.829
140 HG SER 17 HG SER 17 4.475 1.605 6.936
141 H ALA 18 HN ALA 18 7.662 2.118 7.213
142 HA ALA 18 HA ALA 18 9.813 0.360 8.208
143 HB1 ALA 18 HB1 ALA 18 10.324 -0.263 5.949
144 HB2 ALA 18 HB2 ALA 18 9.089 0.834 5.328
145 HB3 ALA 18 HB3 ALA 18 8.620 -0.580 6.277
146 H GLY 19 HN GLY 19 9.284 3.064 5.933
147 HA2 GLY 19 HA2 GLY 19 12.122 3.557 5.828
148 HA3 GLY 19 HA1 GLY 19 10.878 4.419 4.947
149 H GLU 20 HN GLU 20 11.802 4.011 8.387
150 HA GLU 20 HA GLU 20 11.160 6.775 8.907
151 HB2 GLU 20 HB2 GLU 20 10.832 5.080 10.671
152 HB3 GLU 20 HB1 GLU 20 12.566 4.777 10.694
153 HG2 GLU 20 HG2 GLU 20 12.887 7.193 11.275
154 HG3 GLU 20 HG1 GLU 20 11.142 7.310 11.468
155 H THR 21 HN THR 21 12.449 8.124 7.823
156 HA THR 21 HA THR 21 14.260 9.347 7.238
157 HB THR 21 HB THR 21 15.945 9.716 9.035
158 HG1 THR 21 HG1 THR 21 15.100 7.442 9.947
159 HG21 THR 21 HG21 THR 21 14.356 10.834 10.570
160 HG22 THR 21 HG22 THR 21 13.032 9.967 9.791
161 HG23 THR 21 HG23 THR 21 13.984 11.135 8.872
162 H ASP 22 HN ASP 22 14.391 6.718 6.283
163 HA ASP 22 HA ASP 22 17.277 6.169 6.353
164 HB2 ASP 22 HB2 ASP 22 15.941 4.214 6.911
165 HB3 ASP 22 HB1 ASP 22 14.994 4.405 5.439
166 H GLY 23 HN GLY 23 18.464 6.767 4.671
167 HA2 GLY 23 HA2 GLY 23 17.204 8.106 2.459
168 HA3 GLY 23 HA1 GLY 23 18.931 7.932 2.730
169 H THR 24 HN THR 24 16.187 5.746 2.068
170 HA THR 24 HA THR 24 17.859 4.187 0.279
171 HB THR 24 HB THR 24 16.223 3.091 1.833
172 HG1 THR 24 HG1 THR 24 16.659 1.693 0.290
173 HG21 THR 24 HG21 THR 24 13.839 3.055 1.167
174 HG22 THR 24 HG22 THR 24 14.177 4.313 -0.022
175 HG23 THR 24 HG23 THR 24 14.377 4.648 1.698
176 H ASP 25 HN ASP 25 16.065 3.457 -1.718
177 HA ASP 25 HA ASP 25 15.652 6.038 -3.071
178 HB2 ASP 25 HB2 ASP 25 17.352 4.460 -4.087
179 HB3 ASP 25 HB1 ASP 25 16.015 3.370 -4.436
180 H LEU 26 HN LEU 26 13.622 6.456 -2.458
181 HA LEU 26 HA LEU 26 11.519 4.608 -3.358
182 HB2 LEU 26 HB2 LEU 26 11.870 4.264 -0.958
183 HB3 LEU 26 HB1 LEU 26 11.646 5.976 -0.667
184 HG LEU 26 HG LEU 26 9.301 5.744 -1.514
185 HD11 LEU 26 HD11 LEU 26 9.881 2.793 -1.327
186 HD12 LEU 26 HD12 LEU 26 9.654 3.695 -2.824
187 HD13 LEU 26 HD13 LEU 26 8.324 3.540 -1.678
188 HD21 LEU 26 HD21 LEU 26 8.448 4.759 0.531
189 HD22 LEU 26 HD22 LEU 26 9.852 5.770 0.879
190 HD23 LEU 26 HD23 LEU 26 10.017 4.015 0.850
191 H SER 27 HN SER 27 12.785 7.708 -3.369
192 HA SER 27 HA SER 27 10.233 9.092 -3.421
193 HB2 SER 27 HB2 SER 27 13.016 10.208 -3.848
194 HB3 SER 27 HB1 SER 27 11.546 11.136 -3.546
195 HG SER 27 HG SER 27 11.763 9.358 -1.606
196 H GLY 28 HN GLY 28 9.410 7.992 -5.292
197 HA2 GLY 28 HA2 GLY 28 9.747 9.533 -7.662
198 HA3 GLY 28 HA1 GLY 28 10.501 7.953 -7.833
199 H ASP 29 HN ASP 29 8.924 7.539 -9.526
200 HA ASP 29 HA ASP 29 6.154 7.305 -8.742
201 HB2 ASP 29 HB2 ASP 29 5.857 6.360 -11.053
202 HB3 ASP 29 HB1 ASP 29 6.527 7.984 -11.002
203 H PHE 30 HN PHE 30 6.338 5.884 -7.018
204 HA PHE 30 HA PHE 30 7.546 3.298 -7.328
205 HB2 PHE 30 HB2 PHE 30 6.576 2.969 -4.974
206 HB3 PHE 30 HB1 PHE 30 7.795 4.220 -5.180
207 HD1 PHE 30 HD1 PHE 30 4.091 3.800 -5.236
208 HD2 PHE 30 HD2 PHE 30 7.390 6.310 -4.276
209 HE1 PHE 30 HE1 PHE 30 2.550 5.437 -4.232
210 HE2 PHE 30 HE2 PHE 30 5.861 7.943 -3.258
211 HZ PHE 30 HZ PHE 30 3.444 7.560 -3.308
212 H LEU 31 HN LEU 31 4.472 4.573 -7.954
213 HA LEU 31 HA LEU 31 2.744 2.574 -7.143
214 HB2 LEU 31 HB2 LEU 31 2.590 4.457 -9.474
215 HB3 LEU 31 HB1 LEU 31 1.285 3.366 -9.058
216 HG LEU 31 HG LEU 31 2.382 5.575 -7.321
217 HD11 LEU 31 HD11 LEU 31 0.166 6.560 -7.620
218 HD12 LEU 31 HD12 LEU 31 -0.268 5.248 -8.719
219 HD13 LEU 31 HD13 LEU 31 1.011 6.380 -9.160
220 HD21 LEU 31 HD21 LEU 31 0.159 3.608 -6.790
221 HD22 LEU 31 HD22 LEU 31 0.553 5.004 -5.789
222 HD23 LEU 31 HD23 LEU 31 1.709 3.682 -5.950
223 H ASP 32 HN ASP 32 4.646 2.738 -10.124
224 HA ASP 32 HA ASP 32 3.449 0.204 -10.980
225 HB2 ASP 32 HB2 ASP 32 5.082 2.265 -12.458
226 HB3 ASP 32 HB1 ASP 32 4.698 0.691 -13.145
227 H LEU 33 HN LEU 33 5.909 1.076 -9.102
228 HA LEU 33 HA LEU 33 7.768 -0.977 -10.026
229 HB2 LEU 33 HB2 LEU 33 7.881 0.873 -7.634
230 HB3 LEU 33 HB1 LEU 33 9.136 -0.261 -8.098
231 HG LEU 33 HG LEU 33 8.234 2.098 -9.758
232 HD11 LEU 33 HD11 LEU 33 10.380 3.084 -9.163
233 HD12 LEU 33 HD12 LEU 33 10.736 1.706 -8.119
234 HD13 LEU 33 HD13 LEU 33 9.401 2.791 -7.727
235 HD21 LEU 33 HD21 LEU 33 10.529 0.176 -10.131
236 HD22 LEU 33 HD22 LEU 33 10.190 1.592 -11.126
237 HD23 LEU 33 HD23 LEU 33 9.063 0.236 -11.106
238 H ARG 34 HN ARG 34 7.979 -2.949 -9.025
239 HA ARG 34 HA ARG 34 5.794 -3.798 -7.396
240 HB2 ARG 34 HB2 ARG 34 8.272 -5.125 -8.429
241 HB3 ARG 34 HB1 ARG 34 7.346 -5.896 -7.152
242 HG2 ARG 34 HG2 ARG 34 5.339 -5.754 -8.620
243 HG3 ARG 34 HG1 ARG 34 6.398 -5.185 -9.911
244 HD2 ARG 34 HD2 ARG 34 7.568 -7.216 -9.997
245 HD3 ARG 34 HD1 ARG 34 6.932 -7.740 -8.437
246 HE ARG 34 HE ARG 34 4.803 -7.356 -10.252
247 HH11 ARG 34 HH11 ARG 34 7.470 -9.539 -9.589
248 HH12 ARG 34 HH12 ARG 34 6.678 -10.922 -10.286
249 HH21 ARG 34 HH21 ARG 34 3.741 -9.176 -11.123
250 HH22 ARG 34 HH22 ARG 34 4.542 -10.718 -11.142
251 H PHE 35 HN PHE 35 5.848 -4.520 -5.249
252 HA PHE 35 HA PHE 35 7.361 -3.110 -3.382
253 HB2 PHE 35 HB2 PHE 35 6.136 -5.861 -3.034
254 HB3 PHE 35 HB1 PHE 35 6.581 -4.749 -1.742
255 HD1 PHE 35 HD2 PHE 35 5.453 -2.381 -1.878
256 HD2 PHE 35 HD1 PHE 35 3.946 -5.885 -3.763
257 HE1 PHE 35 HE2 PHE 35 3.212 -1.366 -1.957
258 HE2 PHE 35 HE1 PHE 35 1.699 -4.875 -3.845
259 HZ PHE 35 HZ PHE 35 1.330 -2.610 -2.990
260 H GLU 36 HN GLU 36 7.940 -6.140 -5.008
261 HA GLU 36 HA GLU 36 10.225 -7.051 -3.715
262 HB2 GLU 36 HB2 GLU 36 9.542 -7.232 -6.655
263 HB3 GLU 36 HB1 GLU 36 10.717 -8.230 -5.809
264 HG2 GLU 36 HG2 GLU 36 9.001 -9.262 -4.502
265 HG3 GLU 36 HG1 GLU 36 7.785 -8.153 -5.136
266 H ASP 37 HN ASP 37 9.825 -4.453 -6.024
267 HA ASP 37 HA ASP 37 12.644 -4.322 -6.681
268 HB2 ASP 37 HB2 ASP 37 10.394 -2.421 -7.398
269 HB3 ASP 37 HB1 ASP 37 12.021 -2.370 -8.057
270 H ILE 38 HN ILE 38 10.309 -2.543 -4.739
271 HA ILE 38 HA ILE 38 12.265 -0.494 -4.111
272 HB ILE 38 HB ILE 38 10.395 0.494 -2.743
273 HG12 ILE 38 HG12 ILE 38 8.793 -1.673 -4.123
274 HG13 ILE 38 HG11 ILE 38 9.107 -1.575 -2.396
275 HG21 ILE 38 HG21 ILE 38 9.177 1.292 -4.741
276 HG22 ILE 38 HG22 ILE 38 9.973 0.038 -5.693
277 HG23 ILE 38 HG23 ILE 38 10.929 1.314 -4.944
278 HD11 ILE 38 HD11 ILE 38 7.846 0.503 -2.284
279 HD12 ILE 38 HD12 ILE 38 6.870 -0.816 -2.930
280 HD13 ILE 38 HD13 ILE 38 7.532 0.409 -4.016
281 H GLY 39 HN GLY 39 12.172 -3.433 -3.065
282 HA2 GLY 39 HA2 GLY 39 13.218 -4.406 -1.272
283 HA3 GLY 39 HA1 GLY 39 13.571 -2.793 -0.675
284 H TYR 40 HN TYR 40 10.294 -3.912 -1.284
285 HA TYR 40 HA TYR 40 9.882 -3.980 1.631
286 HB2 TYR 40 HB2 TYR 40 8.070 -3.057 -0.585
287 HB3 TYR 40 HB1 TYR 40 7.415 -3.557 0.970
288 HD1 TYR 40 HD2 TYR 40 8.040 -2.316 3.023
289 HD2 TYR 40 HD1 TYR 40 9.134 -0.934 -0.844
290 HE1 TYR 40 HE2 TYR 40 8.480 -0.086 3.950
291 HE2 TYR 40 HE1 TYR 40 9.580 1.304 0.068
292 HH TYR 40 HH TYR 40 9.848 1.911 3.377
293 H ASP 41 HN ASP 41 9.884 -5.992 2.273
294 HA ASP 41 HA ASP 41 8.976 -8.110 0.521
295 HB2 ASP 41 HB2 ASP 41 10.245 -8.139 3.255
296 HB3 ASP 41 HB1 ASP 41 9.705 -9.597 2.432
297 H SER 42 HN SER 42 7.886 -9.968 1.896
298 HA SER 42 HA SER 42 5.209 -9.402 2.016
299 HB2 SER 42 HB2 SER 42 5.090 -11.580 3.332
300 HB3 SER 42 HB1 SER 42 5.946 -11.649 1.786
301 H LEU 43 HN LEU 43 7.317 -9.913 4.861
302 HA LEU 43 HA LEU 43 5.357 -9.408 6.786
303 HB2 LEU 43 HB2 LEU 43 7.509 -10.497 7.270
304 HB3 LEU 43 HB1 LEU 43 8.335 -8.972 7.008
305 HG LEU 43 HG LEU 43 7.107 -8.003 8.932
306 HD11 LEU 43 HD11 LEU 43 5.135 -9.428 8.869
307 HD12 LEU 43 HD12 LEU 43 5.911 -9.493 10.452
308 HD13 LEU 43 HD13 LEU 43 6.115 -10.825 9.312
309 HD21 LEU 43 HD21 LEU 43 9.345 -8.928 9.234
310 HD22 LEU 43 HD22 LEU 43 8.653 -10.522 9.543
311 HD23 LEU 43 HD23 LEU 43 8.353 -9.194 10.665
312 H ALA 44 HN ALA 44 7.762 -7.181 5.391
313 HA ALA 44 HA ALA 44 7.037 -4.952 6.937
314 HB1 ALA 44 HB1 ALA 44 8.256 -5.015 4.179
315 HB2 ALA 44 HB2 ALA 44 9.137 -5.060 5.707
316 HB3 ALA 44 HB3 ALA 44 8.219 -3.621 5.262
317 H LEU 45 HN LEU 45 5.861 -6.167 3.854
318 HA LEU 45 HA LEU 45 4.269 -3.945 3.174
319 HB2 LEU 45 HB2 LEU 45 4.954 -5.663 1.566
320 HB3 LEU 45 HB1 LEU 45 3.948 -6.841 2.388
321 HG LEU 45 HG LEU 45 1.945 -5.538 1.784
322 HD11 LEU 45 HD11 LEU 45 2.100 -3.712 0.196
323 HD12 LEU 45 HD12 LEU 45 3.858 -3.838 0.184
324 HD13 LEU 45 HD13 LEU 45 3.017 -3.328 1.650
325 HD21 LEU 45 HD21 LEU 45 3.749 -6.290 -0.512
326 HD22 LEU 45 HD22 LEU 45 2.004 -6.051 -0.625
327 HD23 LEU 45 HD23 LEU 45 2.654 -7.361 0.360
328 H MET 46 HN MET 46 3.504 -6.936 4.970
329 HA MET 46 HA MET 46 0.740 -6.297 5.171
330 HB2 MET 46 HB2 MET 46 0.554 -8.091 6.790
331 HB3 MET 46 HB1 MET 46 1.537 -8.608 5.430
332 HG2 MET 46 HG2 MET 46 3.539 -8.406 6.713
333 HG3 MET 46 HG1 MET 46 2.672 -7.650 8.047
334 HE1 MET 46 HE1 MET 46 0.875 -8.986 9.570
335 HE2 MET 46 HE2 MET 46 0.427 -10.661 9.261
336 HE3 MET 46 HE3 MET 46 0.022 -9.411 8.084
337 H GLU 47 HN GLU 47 3.540 -5.498 7.117
338 HA GLU 47 HA GLU 47 2.119 -4.399 9.305
339 HB2 GLU 47 HB2 GLU 47 4.876 -3.795 8.224
340 HB3 GLU 47 HB1 GLU 47 4.249 -3.140 9.732
341 HG2 GLU 47 HG2 GLU 47 3.942 -5.471 10.540
342 HG3 GLU 47 HG1 GLU 47 4.742 -6.033 9.076
343 H THR 48 HN THR 48 3.388 -2.996 6.297
344 HA THR 48 HA THR 48 2.460 -0.372 6.710
345 HB THR 48 HB THR 48 2.815 -1.817 4.074
346 HG1 THR 48 HG1 THR 48 4.622 -0.448 5.794
347 HG21 THR 48 HG21 THR 48 3.190 0.443 3.169
348 HG22 THR 48 HG22 THR 48 2.785 1.125 4.744
349 HG23 THR 48 HG23 THR 48 1.563 0.249 3.822
350 H ALA 49 HN ALA 49 0.914 -3.234 5.341
351 HA ALA 49 HA ALA 49 -1.405 -2.126 4.296
352 HB1 ALA 49 HB1 ALA 49 -2.402 -4.323 4.551
353 HB2 ALA 49 HB2 ALA 49 -1.136 -4.787 5.686
354 HB3 ALA 49 HB3 ALA 49 -0.732 -4.467 4.000
355 H ALA 50 HN ALA 50 -0.652 -2.994 7.630
356 HA ALA 50 HA ALA 50 -3.240 -2.779 8.706
357 HB1 ALA 50 HB1 ALA 50 -0.583 -2.308 10.057
358 HB2 ALA 50 HB2 ALA 50 -1.382 -3.869 9.865
359 HB3 ALA 50 HB3 ALA 50 -2.120 -2.620 10.867
360 H ARG 51 HN ARG 51 -0.787 -0.454 7.943
361 HA ARG 51 HA ARG 51 -1.773 1.736 9.420
362 HB2 ARG 51 HB2 ARG 51 -0.176 1.746 6.850
363 HB3 ARG 51 HB1 ARG 51 -0.386 3.105 7.936
364 HG2 ARG 51 HG2 ARG 51 1.049 0.536 8.549
365 HG3 ARG 51 HG1 ARG 51 1.782 2.115 8.262
366 HD2 ARG 51 HD2 ARG 51 -0.073 1.408 10.529
367 HD3 ARG 51 HD1 ARG 51 1.676 1.582 10.646
368 HE ARG 51 HE ARG 51 0.734 3.976 9.608
369 HH11 ARG 51 HH11 ARG 51 0.228 2.091 12.532
370 HH12 ARG 51 HH12 ARG 51 -0.011 3.486 13.537
371 HH21 ARG 51 HH21 ARG 51 0.390 5.807 10.925
372 HH22 ARG 51 HH22 ARG 51 0.079 5.593 12.627
373 H LEU 52 HN LEU 52 -2.338 0.607 6.121
374 HA LEU 52 HA LEU 52 -3.923 2.823 5.326
375 HB2 LEU 52 HB2 LEU 52 -3.943 0.014 4.218
376 HB3 LEU 52 HB1 LEU 52 -4.572 1.448 3.424
377 HG LEU 52 HG LEU 52 -1.669 0.969 4.098
378 HD11 LEU 52 HD11 LEU 52 -3.135 0.833 1.473
379 HD12 LEU 52 HD12 LEU 52 -2.410 -0.520 2.344
380 HD13 LEU 52 HD13 LEU 52 -1.386 0.750 1.672
381 HD21 LEU 52 HD21 LEU 52 -1.291 2.947 2.676
382 HD22 LEU 52 HD22 LEU 52 -2.205 3.323 4.137
383 HD23 LEU 52 HD23 LEU 52 -3.036 3.193 2.587
384 H GLU 53 HN GLU 53 -4.735 -0.438 6.490
385 HA GLU 53 HA GLU 53 -7.518 -0.179 6.325
386 HB2 GLU 53 HB2 GLU 53 -5.822 -1.817 8.216
387 HB3 GLU 53 HB1 GLU 53 -7.571 -1.938 8.139
388 HG2 GLU 53 HG2 GLU 53 -7.377 -2.602 5.763
389 HG3 GLU 53 HG1 GLU 53 -5.623 -2.596 5.948
390 H SER 54 HN SER 54 -5.348 0.366 9.091
391 HA SER 54 HA SER 54 -7.359 1.078 10.915
392 HB2 SER 54 HB2 SER 54 -5.085 0.327 11.551
393 HB3 SER 54 HB1 SER 54 -4.431 1.849 10.953
394 HG SER 54 HG SER 54 -5.937 1.322 13.243
395 H ARG 55 HN ARG 55 -5.406 3.045 8.707
396 HA ARG 55 HA ARG 55 -6.081 5.532 9.877
397 HB2 ARG 55 HB2 ARG 55 -4.125 5.114 8.363
398 HB3 ARG 55 HB1 ARG 55 -5.251 5.057 7.010
399 HG2 ARG 55 HG2 ARG 55 -5.957 7.362 7.555
400 HG3 ARG 55 HG1 ARG 55 -4.734 7.405 8.824
401 HD2 ARG 55 HD2 ARG 55 -3.009 6.952 7.087
402 HD3 ARG 55 HD1 ARG 55 -4.266 7.104 5.860
403 HE ARG 55 HE ARG 55 -3.733 9.318 7.723
404 HH11 ARG 55 HH11 ARG 55 -3.881 8.059 4.460
405 HH12 ARG 55 HH12 ARG 55 -3.624 9.610 3.711
406 HH21 ARG 55 HH21 ARG 55 -3.352 11.346 6.751
407 HH22 ARG 55 HH22 ARG 55 -3.304 11.470 5.019
408 H TYR 56 HN TYR 56 -7.474 3.734 7.163
409 HA TYR 56 HA TYR 56 -9.376 5.910 6.708
410 HB2 TYR 56 HB2 TYR 56 -8.719 3.435 5.113
411 HB3 TYR 56 HB1 TYR 56 -10.011 4.550 4.687
412 HD1 TYR 56 HD1 TYR 56 -6.350 4.181 5.005
413 HD2 TYR 56 HD2 TYR 56 -9.545 6.651 3.648
414 HE1 TYR 56 HE1 TYR 56 -4.745 5.567 3.763
415 HE2 TYR 56 HE2 TYR 56 -7.945 8.047 2.408
416 HH TYR 56 HH TYR 56 -5.660 8.574 2.285
417 H GLY 57 HN GLY 57 -9.240 2.816 8.181
418 HA2 GLY 57 HA2 GLY 57 -10.922 1.799 9.441
419 HA3 GLY 57 HA1 GLY 57 -12.077 2.954 8.787
420 H VAL 58 HN VAL 58 -9.877 0.912 6.952
421 HA VAL 58 HA VAL 58 -12.221 -0.331 5.684
422 HB VAL 58 HB VAL 58 -10.800 -0.770 3.732
423 HG11 VAL 58 HG11 VAL 58 -12.066 1.293 3.763
424 HG12 VAL 58 HG12 VAL 58 -10.505 1.557 2.980
425 HG13 VAL 58 HG13 VAL 58 -10.764 2.106 4.636
426 HG21 VAL 58 HG21 VAL 58 -8.564 0.246 3.564
427 HG22 VAL 58 HG22 VAL 58 -8.632 -0.983 4.825
428 HG23 VAL 58 HG23 VAL 58 -8.661 0.727 5.258
429 H SER 59 HN SER 59 -11.136 -2.462 4.451
430 HA SER 59 HA SER 59 -9.464 -3.993 6.220
431 HB2 SER 59 HB2 SER 59 -11.766 -4.251 7.202
432 HB3 SER 59 HB1 SER 59 -12.283 -4.970 5.673
433 HG SER 59 HG SER 59 -10.012 -6.069 6.804
434 H ILE 60 HN ILE 60 -8.218 -5.255 5.009
435 HA ILE 60 HA ILE 60 -8.880 -5.533 2.164
436 HB ILE 60 HB ILE 60 -6.269 -6.094 3.590
437 HG12 ILE 60 HG12 ILE 60 -7.092 -3.705 1.907
438 HG13 ILE 60 HG11 ILE 60 -6.913 -3.703 3.658
439 HG21 ILE 60 HG21 ILE 60 -6.949 -5.939 0.656
440 HG22 ILE 60 HG22 ILE 60 -6.469 -7.379 1.556
441 HG23 ILE 60 HG23 ILE 60 -5.316 -6.067 1.311
442 HD11 ILE 60 HD11 ILE 60 -4.717 -4.190 1.659
443 HD12 ILE 60 HD12 ILE 60 -4.538 -4.209 3.413
444 HD13 ILE 60 HD13 ILE 60 -4.981 -2.714 2.590
445 HA PRO 61 HA PRO 61 -10.150 -9.780 2.866
446 HB2 PRO 61 HB2 PRO 61 -9.719 -9.889 -0.065
447 HB3 PRO 61 HB1 PRO 61 -11.145 -10.334 0.878
448 HG2 PRO 61 HG2 PRO 61 -11.117 -8.101 -0.573
449 HG3 PRO 61 HG1 PRO 61 -11.895 -8.146 1.020
450 HD2 PRO 61 HD2 PRO 61 -9.244 -6.999 0.239
451 HD3 PRO 61 HD1 PRO 61 -10.452 -6.371 1.380
452 H ASP 62 HN ASP 62 -8.889 -11.436 3.419
453 HA ASP 62 HA ASP 62 -6.093 -11.316 3.059
454 HB2 ASP 62 HB2 ASP 62 -6.070 -13.550 4.168
455 HB3 ASP 62 HB1 ASP 62 -6.967 -12.318 5.049
456 H ASP 63 HN ASP 63 -8.488 -12.547 0.997
457 HA ASP 63 HA ASP 63 -6.805 -14.440 -0.370
458 HB2 ASP 63 HB2 ASP 63 -9.410 -13.109 -1.125
459 HB3 ASP 63 HB1 ASP 63 -8.558 -14.202 -2.206
460 H VAL 64 HN VAL 64 -7.801 -11.092 -0.854
461 HA VAL 64 HA VAL 64 -6.469 -10.827 -3.374
462 HB VAL 64 HB VAL 64 -7.458 -8.605 -1.588
463 HG11 VAL 64 HG11 VAL 64 -6.997 -8.734 -4.564
464 HG12 VAL 64 HG12 VAL 64 -6.034 -7.834 -3.390
465 HG13 VAL 64 HG13 VAL 64 -7.708 -7.373 -3.698
466 HG21 VAL 64 HG21 VAL 64 -9.250 -10.213 -1.964
467 HG22 VAL 64 HG22 VAL 64 -8.970 -10.129 -3.704
468 HG23 VAL 64 HG23 VAL 64 -9.558 -8.710 -2.833
469 H ALA 65 HN ALA 65 -5.509 -10.581 -0.107
470 HA ALA 65 HA ALA 65 -3.495 -8.656 -0.214
471 HB1 ALA 65 HB1 ALA 65 -2.572 -9.731 1.772
472 HB2 ALA 65 HB2 ALA 65 -3.583 -11.147 1.479
473 HB3 ALA 65 HB3 ALA 65 -4.328 -9.598 1.879
474 H GLY 66 HN GLY 66 -3.533 -11.952 -1.311
475 HA2 GLY 66 HA2 GLY 66 -0.651 -11.789 -1.899
476 HA3 GLY 66 HA1 GLY 66 -1.573 -13.280 -1.777
477 H ARG 67 HN ARG 67 -3.048 -10.667 -3.462
478 HA ARG 67 HA ARG 67 -2.623 -12.129 -5.979
479 HB2 ARG 67 HB2 ARG 67 -4.809 -10.213 -5.170
480 HB3 ARG 67 HB1 ARG 67 -4.641 -10.884 -6.785
481 HG2 ARG 67 HG2 ARG 67 -5.222 -12.371 -4.235
482 HG3 ARG 67 HG1 ARG 67 -6.300 -12.139 -5.611
483 HD2 ARG 67 HD2 ARG 67 -3.779 -13.782 -5.501
484 HD3 ARG 67 HD1 ARG 67 -5.428 -14.364 -5.705
485 HE ARG 67 HE ARG 67 -4.304 -12.595 -7.745
486 HH11 ARG 67 HH11 ARG 67 -5.445 -15.765 -6.796
487 HH12 ARG 67 HH12 ARG 67 -5.434 -16.395 -8.420
488 HH21 ARG 67 HH21 ARG 67 -4.265 -13.434 -9.895
489 HH22 ARG 67 HH22 ARG 67 -4.773 -15.068 -10.171
490 H VAL 68 HN VAL 68 -1.847 -9.193 -4.412
491 HA VAL 68 HA VAL 68 -1.655 -7.704 -6.903
492 HB VAL 68 HB VAL 68 -0.995 -5.782 -5.496
493 HG11 VAL 68 HG11 VAL 68 -3.513 -7.169 -4.591
494 HG12 VAL 68 HG12 VAL 68 -3.342 -6.181 -6.042
495 HG13 VAL 68 HG13 VAL 68 -3.169 -5.444 -4.448
496 HG21 VAL 68 HG21 VAL 68 0.093 -7.011 -3.685
497 HG22 VAL 68 HG22 VAL 68 -1.464 -7.678 -3.197
498 HG23 VAL 68 HG23 VAL 68 -1.167 -5.945 -3.061
499 H ASP 69 HN ASP 69 0.349 -6.293 -7.132
500 HA ASP 69 HA ASP 69 2.802 -7.595 -6.250
501 HB2 ASP 69 HB2 ASP 69 3.677 -7.903 -8.410
502 HB3 ASP 69 HB1 ASP 69 2.030 -8.495 -8.533
503 H THR 70 HN THR 70 1.123 -4.879 -7.632
504 HA THR 70 HA THR 70 3.373 -3.117 -6.937
505 HB THR 70 HB THR 70 2.434 -1.654 -8.850
506 HG1 THR 70 HG1 THR 70 1.450 -4.220 -9.671
507 HG21 THR 70 HG21 THR 70 3.834 -4.247 -9.510
508 HG22 THR 70 HG22 THR 70 4.613 -2.776 -8.927
509 HG23 THR 70 HG23 THR 70 3.823 -2.791 -10.503
510 HA PRO 71 HA PRO 71 0.635 -0.673 -4.424
511 HB2 PRO 71 HB2 PRO 71 1.877 1.613 -5.894
512 HB3 PRO 71 HB1 PRO 71 1.667 1.377 -4.156
513 HG2 PRO 71 HG2 PRO 71 4.040 1.018 -5.278
514 HG3 PRO 71 HG1 PRO 71 3.470 -0.083 -4.009
515 HD2 PRO 71 HD2 PRO 71 3.630 -0.513 -6.960
516 HD3 PRO 71 HD1 PRO 71 3.891 -1.665 -5.633
517 H ARG 72 HN ARG 72 1.004 0.319 -7.812
518 HA ARG 72 HA ARG 72 -1.262 1.894 -8.078
519 HB2 ARG 72 HB2 ARG 72 0.603 1.574 -9.745
520 HB3 ARG 72 HB1 ARG 72 -0.160 0.061 -10.205
521 HG2 ARG 72 HG2 ARG 72 -2.118 1.205 -10.978
522 HG3 ARG 72 HG1 ARG 72 -1.513 2.744 -10.362
523 HD2 ARG 72 HD2 ARG 72 0.339 2.665 -11.936
524 HD3 ARG 72 HD1 ARG 72 -0.209 1.092 -12.520
525 HE ARG 72 HE ARG 72 -2.218 3.123 -12.734
526 HH11 ARG 72 HH11 ARG 72 0.639 1.832 -14.286
527 HH12 ARG 72 HH12 ARG 72 0.119 2.268 -15.887
528 HH21 ARG 72 HH21 ARG 72 -2.901 3.704 -14.853
529 HH22 ARG 72 HH22 ARG 72 -1.881 3.328 -16.206
530 H GLU 73 HN GLU 73 -0.938 -1.578 -8.763
531 HA GLU 73 HA GLU 73 -3.663 -2.002 -9.366
532 HB2 GLU 73 HB2 GLU 73 -1.565 -3.950 -8.398
533 HB3 GLU 73 HB1 GLU 73 -3.137 -4.411 -9.035
534 HG2 GLU 73 HG2 GLU 73 -1.007 -2.920 -10.552
535 HG3 GLU 73 HG1 GLU 73 -1.344 -4.643 -10.691
536 H LEU 74 HN LEU 74 -1.799 -2.381 -6.384
537 HA LEU 74 HA LEU 74 -3.753 -3.554 -4.770
538 HB2 LEU 74 HB2 LEU 74 -1.215 -2.986 -4.356
539 HB3 LEU 74 HB1 LEU 74 -1.853 -1.505 -3.684
540 HG LEU 74 HG LEU 74 -2.500 -4.279 -2.684
541 HD11 LEU 74 HD11 LEU 74 -1.149 -3.577 -0.720
542 HD12 LEU 74 HD12 LEU 74 -0.624 -2.175 -1.650
543 HD13 LEU 74 HD13 LEU 74 -0.222 -3.800 -2.203
544 HD21 LEU 74 HD21 LEU 74 -3.145 -1.592 -1.479
545 HD22 LEU 74 HD22 LEU 74 -3.528 -3.170 -0.789
546 HD23 LEU 74 HD23 LEU 74 -4.303 -2.650 -2.286
547 H LEU 75 HN LEU 75 -3.053 -0.164 -5.428
548 HA LEU 75 HA LEU 75 -4.741 1.046 -3.603
549 HB2 LEU 75 HB2 LEU 75 -2.992 2.125 -5.050
550 HB3 LEU 75 HB1 LEU 75 -4.128 2.043 -6.383
551 HG LEU 75 HG LEU 75 -5.690 3.488 -5.111
552 HD11 LEU 75 HD11 LEU 75 -3.402 3.680 -3.158
553 HD12 LEU 75 HD12 LEU 75 -4.967 2.927 -2.857
554 HD13 LEU 75 HD13 LEU 75 -4.863 4.667 -3.130
555 HD21 LEU 75 HD21 LEU 75 -4.392 5.553 -5.364
556 HD22 LEU 75 HD22 LEU 75 -4.176 4.470 -6.739
557 HD23 LEU 75 HD23 LEU 75 -2.916 4.602 -5.511
558 H ASP 76 HN ASP 76 -5.454 -0.165 -6.845
559 HA ASP 76 HA ASP 76 -7.987 0.994 -7.183
560 HB2 ASP 76 HB2 ASP 76 -6.793 0.026 -9.063
561 HB3 ASP 76 HB1 ASP 76 -6.857 -1.568 -8.322
562 H LEU 77 HN LEU 77 -6.985 -1.920 -5.516
563 HA LEU 77 HA LEU 77 -9.519 -3.134 -5.330
564 HB2 LEU 77 HB2 LEU 77 -6.961 -3.406 -3.818
565 HB3 LEU 77 HB1 LEU 77 -8.406 -4.158 -3.173
566 HG LEU 77 HG LEU 77 -7.127 -5.777 -4.422
567 HD11 LEU 77 HD11 LEU 77 -9.547 -5.981 -4.483
568 HD12 LEU 77 HD12 LEU 77 -8.829 -6.535 -5.996
569 HD13 LEU 77 HD13 LEU 77 -9.610 -4.956 -5.916
570 HD21 LEU 77 HD21 LEU 77 -6.765 -5.540 -6.841
571 HD22 LEU 77 HD22 LEU 77 -5.913 -4.305 -5.914
572 HD23 LEU 77 HD23 LEU 77 -7.406 -3.898 -6.762
573 H ILE 78 HN ILE 78 -7.831 -0.913 -3.138
574 HA ILE 78 HA ILE 78 -9.999 -0.962 -1.249
575 HB ILE 78 HB ILE 78 -7.646 0.937 -1.343
576 HG12 ILE 78 HG12 ILE 78 -8.033 -1.698 0.096
577 HG13 ILE 78 HG11 ILE 78 -6.836 -1.334 -1.143
578 HG21 ILE 78 HG21 ILE 78 -9.459 1.810 0.004
579 HG22 ILE 78 HG22 ILE 78 -8.147 1.269 1.053
580 HG23 ILE 78 HG23 ILE 78 -9.592 0.276 0.863
581 HD11 ILE 78 HD11 ILE 78 -6.940 -0.232 1.660
582 HD12 ILE 78 HD12 ILE 78 -5.803 0.293 0.415
583 HD13 ILE 78 HD13 ILE 78 -5.766 -1.371 0.995
584 H ASN 79 HN ASN 79 -8.863 1.203 -3.799
585 HA ASN 79 HA ASN 79 -10.645 3.331 -3.312
586 HB2 ASN 79 HB2 ASN 79 -9.337 2.358 -5.851
587 HB3 ASN 79 HB1 ASN 79 -10.395 3.761 -5.830
588 HD21 ASN 79 HD21 ASN 79 -9.416 4.533 -3.129
589 HD22 ASN 79 HD22 ASN 79 -7.851 5.220 -3.402
590 H GLY 80 HN GLY 80 -10.975 0.431 -5.327
591 HA2 GLY 80 HA2 GLY 80 -13.475 1.061 -6.450
592 HA3 GLY 80 HA1 GLY 80 -12.809 -0.557 -6.286
593 H ALA 81 HN ALA 81 -12.639 -0.595 -3.439
594 HA ALA 81 HA ALA 81 -15.283 -1.467 -2.862
595 HB1 ALA 81 HB1 ALA 81 -14.420 -1.991 -0.645
596 HB2 ALA 81 HB2 ALA 81 -12.962 -1.056 -0.976
597 HB3 ALA 81 HB3 ALA 81 -13.294 -2.527 -1.891
598 H LEU 82 HN LEU 82 -13.437 1.406 -2.103
599 HA LEU 82 HA LEU 82 -15.368 2.476 -0.283
600 HB2 LEU 82 HB2 LEU 82 -13.066 3.751 -1.758
601 HB3 LEU 82 HB1 LEU 82 -14.049 4.587 -0.574
602 HG LEU 82 HG LEU 82 -12.355 2.149 -0.005
603 HD11 LEU 82 HD11 LEU 82 -11.909 5.044 0.718
604 HD12 LEU 82 HD12 LEU 82 -11.020 4.152 -0.515
605 HD13 LEU 82 HD13 LEU 82 -10.886 3.685 1.181
606 HD21 LEU 82 HD21 LEU 82 -12.855 2.633 2.331
607 HD22 LEU 82 HD22 LEU 82 -14.339 2.332 1.426
608 HD23 LEU 82 HD23 LEU 82 -13.879 3.982 1.843
609 H ALA 83 HN ALA 83 -14.768 2.715 -3.724
610 HA ALA 83 HA ALA 83 -16.368 4.968 -4.260
611 HB1 ALA 83 HB1 ALA 83 -14.699 4.086 -5.818
612 HB2 ALA 83 HB2 ALA 83 -16.280 4.255 -6.580
613 HB3 ALA 83 HB3 ALA 83 -15.704 2.662 -6.087
614 H GLU 84 HN GLU 84 -17.129 1.496 -4.268
615 HA GLU 84 HA GLU 84 -19.892 2.099 -4.962
616 HB2 GLU 84 HB2 GLU 84 -20.162 -0.371 -5.058
617 HB3 GLU 84 HB1 GLU 84 -18.924 0.250 -6.140
618 HG2 GLU 84 HG2 GLU 84 -17.190 -0.470 -4.610
619 HG3 GLU 84 HG1 GLU 84 -18.412 -1.025 -3.461
620 H ALA 85 HN ALA 85 -18.516 2.637 -2.272
621 HA ALA 85 HA ALA 85 -20.291 1.089 -0.526
622 HB1 ALA 85 HB1 ALA 85 -17.937 1.171 0.111
623 HB2 ALA 85 HB2 ALA 85 -18.943 1.972 1.318
624 HB3 ALA 85 HB3 ALA 85 -18.007 2.931 0.172
625 H ALA 86 HN ALA 86 -20.648 3.704 -2.317
626 HA ALA 86 HA ALA 86 -22.413 5.011 -0.382
627 HB1 ALA 86 HB1 ALA 86 -20.324 6.313 -0.414
628 HB2 ALA 86 HB2 ALA 86 -21.681 7.230 -1.068
629 HB3 ALA 86 HB3 ALA 86 -20.489 6.520 -2.157
630 H28 SXO 87 H28B SXO 87 5.572 -12.360 5.326
631 H28A SXO 87 H28A SXO 87 6.343 -13.743 6.101
632 H30 SXO 87 H30A SXO 87 2.712 -13.675 7.016
633 H30A SXO 87 H30C SXO 87 4.330 -13.301 7.613
634 H30B SXO 87 H30B SXO 87 3.545 -12.224 6.456
635 H31 SXO 87 H31A SXO 87 2.416 -14.323 4.588
636 H31A SXO 87 H31B SXO 87 3.838 -14.440 3.550
637 H31B SXO 87 H31C SXO 87 3.290 -12.865 4.124
638 H32 SXO 87 H32A SXO 87 4.895 -15.633 6.953
639 HO33 SXO 87 H33A SXO 87 4.654 -16.948 4.612
640 HN36 SXO 87 H36A SXO 87 2.605 -15.315 7.788
641 H37 SXO 87 H37A SXO 87 0.525 -16.817 6.365
642 H37A SXO 87 H37B SXO 87 1.044 -17.399 7.940
643 H38 SXO 87 H38B SXO 87 0.548 -14.745 8.413
644 H38A SXO 87 H38A SXO 87 -0.540 -16.085 8.782
645 HN41 SXO 87 H41A SXO 87 0.324 -14.949 5.621
646 H42 SXO 87 H42A SXO 87 -2.073 -14.998 4.361
647 H42A SXO 87 H42B SXO 87 -2.065 -13.419 5.145
648 H43 SXO 87 H43B SXO 87 0.055 -14.404 3.237
649 H43A SXO 87 H43A SXO 87 -1.275 -13.312 2.814
650 H2 SXO 87 H2A SXO 87 2.570 -10.663 1.772
651 H2A SXO 87 H2B SXO 87 2.780 -10.936 3.500
652 H3 SXO 87 H3B SXO 87 0.781 -9.523 3.905
653 H3A SXO 87 H3A SXO 87 2.118 -8.659 3.151
654 H4 SXO 87 H4A SXO 87 -0.298 -9.765 1.729
655 H4A SXO 87 H4B SXO 87 1.041 -8.911 0.963
656 H5 SXO 87 H5B SXO 87 -0.854 -7.789 3.022
657 H5A SXO 87 H5A SXO 87 0.528 -6.929 2.339
658 H6 SXO 87 H6A SXO 87 -1.836 -7.985 0.781
659 H6A SXO 87 H6B SXO 87 -0.462 -7.107 0.108
660 H7 SXO 87 H7A SXO 87 -2.373 -5.988 2.167
661 H7A SXO 87 H7B SXO 87 -2.434 -5.646 0.428
662 H8 SXO 87 H8C SXO 87 -0.121 -5.058 2.266
663 H8A SXO 87 H8A SXO 87 -1.277 -3.874 1.660
664 H8B SXO 87 H8B SXO 87 -0.191 -4.700 0.542
Start of MODEL 17
1 H1 MET 1 HT1 MET 1 -16.672 11.885 -1.833
2 H2 MET 1 HT2 MET 1 -18.230 11.581 -2.432
3 H3 MET 1 HT3 MET 1 -17.314 10.315 -1.767
4 HA MET 1 HA MET 1 -18.410 12.659 -0.333
5 HB2 MET 1 HB2 MET 1 -19.065 9.716 -0.218
6 HB3 MET 1 HB1 MET 1 -19.631 10.887 0.964
7 HG2 MET 1 HG2 MET 1 -20.796 12.099 -0.830
8 HG3 MET 1 HG1 MET 1 -20.262 10.876 -1.980
9 HE1 MET 1 HE1 MET 1 -21.476 10.320 1.756
10 HE2 MET 1 HE2 MET 1 -23.207 10.106 1.491
11 HE3 MET 1 HE3 MET 1 -22.442 11.658 1.143
12 H ALA 2 HN ALA 2 -16.206 9.910 -0.263
13 HA ALA 2 HA ALA 2 -15.474 10.673 2.491
14 HB1 ALA 2 HB1 ALA 2 -15.196 7.958 1.216
15 HB2 ALA 2 HB2 ALA 2 -16.497 8.440 2.305
16 HB3 ALA 2 HB3 ALA 2 -14.834 8.379 2.891
17 H THR 3 HN THR 3 -13.231 10.224 3.097
18 HA THR 3 HA THR 3 -11.377 11.262 1.186
19 HB THR 3 HB THR 3 -9.926 10.295 3.354
20 HG1 THR 3 HG1 THR 3 -11.250 10.220 5.030
21 HG21 THR 3 HG21 THR 3 -11.275 12.977 3.008
22 HG22 THR 3 HG22 THR 3 -9.715 12.509 2.327
23 HG23 THR 3 HG23 THR 3 -9.911 12.642 4.075
24 H LEU 4 HN LEU 4 -10.708 9.993 -0.415
25 HA LEU 4 HA LEU 4 -10.544 7.130 -0.140
26 HB2 LEU 4 HB2 LEU 4 -9.717 8.880 -2.461
27 HB3 LEU 4 HB1 LEU 4 -9.943 7.142 -2.501
28 HG LEU 4 HG LEU 4 -12.138 9.165 -2.023
29 HD11 LEU 4 HD11 LEU 4 -12.904 8.522 -4.263
30 HD12 LEU 4 HD12 LEU 4 -11.458 7.532 -4.465
31 HD13 LEU 4 HD13 LEU 4 -11.314 9.283 -4.299
32 HD21 LEU 4 HD21 LEU 4 -12.537 7.016 -0.918
33 HD22 LEU 4 HD22 LEU 4 -12.269 6.180 -2.447
34 HD23 LEU 4 HD23 LEU 4 -13.645 7.268 -2.267
35 H LEU 5 HN LEU 5 -8.648 5.890 -0.522
36 HA LEU 5 HA LEU 5 -6.196 7.052 0.497
37 HB2 LEU 5 HB2 LEU 5 -7.212 4.635 0.806
38 HB3 LEU 5 HB1 LEU 5 -6.422 4.318 -0.722
39 HG LEU 5 HG LEU 5 -5.054 5.157 1.846
40 HD11 LEU 5 HD11 LEU 5 -4.110 2.893 1.763
41 HD12 LEU 5 HD12 LEU 5 -5.084 2.545 0.333
42 HD13 LEU 5 HD13 LEU 5 -5.869 2.866 1.881
43 HD21 LEU 5 HD21 LEU 5 -3.892 6.050 -0.121
44 HD22 LEU 5 HD22 LEU 5 -3.848 4.433 -0.824
45 HD23 LEU 5 HD23 LEU 5 -2.960 4.771 0.661
46 H THR 6 HN THR 6 -4.759 8.077 -0.893
47 HA THR 6 HA THR 6 -4.714 7.091 -3.676
48 HB THR 6 HB THR 6 -4.076 9.331 -4.446
49 HG1 THR 6 HG1 THR 6 -4.333 9.945 -1.673
50 HG21 THR 6 HG21 THR 6 -6.438 8.716 -4.464
51 HG22 THR 6 HG22 THR 6 -6.238 10.435 -4.135
52 HG23 THR 6 HG23 THR 6 -6.618 9.326 -2.819
53 H THR 7 HN THR 7 -2.551 8.087 -4.754
54 HA THR 7 HA THR 7 -0.454 6.568 -3.721
55 HB THR 7 HB THR 7 -0.157 8.966 -5.534
56 HG1 THR 7 HG1 THR 7 -1.643 7.696 -6.539
57 HG21 THR 7 HG21 THR 7 1.952 8.055 -4.710
58 HG22 THR 7 HG22 THR 7 1.756 7.717 -6.429
59 HG23 THR 7 HG23 THR 7 1.475 6.441 -5.244
60 H ASP 8 HN ASP 8 -1.331 9.925 -3.147
61 HA ASP 8 HA ASP 8 1.131 10.674 -1.941
62 HB2 ASP 8 HB2 ASP 8 -0.462 12.334 -2.849
63 HB3 ASP 8 HB1 ASP 8 -1.597 11.919 -1.567
64 H ASP 9 HN ASP 9 -1.973 9.558 -0.675
65 HA ASP 9 HA ASP 9 -1.332 9.691 2.059
66 HB2 ASP 9 HB2 ASP 9 -3.152 7.693 0.703
67 HB3 ASP 9 HB1 ASP 9 -3.178 8.146 2.402
68 H LEU 10 HN LEU 10 -1.050 7.089 -0.309
69 HA LEU 10 HA LEU 10 -0.016 5.121 1.397
70 HB2 LEU 10 HB2 LEU 10 -0.919 4.837 -0.950
71 HB3 LEU 10 HB1 LEU 10 0.610 5.456 -1.537
72 HG LEU 10 HG LEU 10 1.762 3.549 -0.437
73 HD11 LEU 10 HD11 LEU 10 0.438 1.649 0.329
74 HD12 LEU 10 HD12 LEU 10 -1.046 2.567 0.066
75 HD13 LEU 10 HD13 LEU 10 0.106 3.086 1.298
76 HD21 LEU 10 HD21 LEU 10 1.032 1.862 -2.059
77 HD22 LEU 10 HD22 LEU 10 1.188 3.453 -2.802
78 HD23 LEU 10 HD23 LEU 10 -0.409 2.820 -2.403
79 H ARG 11 HN ARG 11 1.552 7.629 -0.526
80 HA ARG 11 HA ARG 11 4.212 6.952 -0.240
81 HB2 ARG 11 HB2 ARG 11 3.396 8.762 -1.664
82 HB3 ARG 11 HB1 ARG 11 2.961 9.703 -0.245
83 HG2 ARG 11 HG2 ARG 11 5.300 9.895 0.375
84 HG3 ARG 11 HG1 ARG 11 5.762 8.867 -0.985
85 HD2 ARG 11 HD2 ARG 11 6.127 11.199 -1.532
86 HD3 ARG 11 HD1 ARG 11 4.849 10.529 -2.539
87 HE ARG 11 HE ARG 11 3.258 11.686 -1.050
88 HH11 ARG 11 HH11 ARG 11 6.582 12.757 -1.135
89 HH12 ARG 11 HH12 ARG 11 6.218 14.379 -0.620
90 HH21 ARG 11 HH21 ARG 11 2.744 13.822 -0.406
91 HH22 ARG 11 HH22 ARG 11 4.027 14.985 -0.213
92 H ARG 12 HN ARG 12 2.118 8.684 2.034
93 HA ARG 12 HA ARG 12 4.251 9.149 3.900
94 HB2 ARG 12 HB2 ARG 12 1.444 9.854 3.683
95 HB3 ARG 12 HB1 ARG 12 1.863 9.355 5.311
96 HG2 ARG 12 HG2 ARG 12 3.777 11.000 5.180
97 HG3 ARG 12 HG1 ARG 12 3.029 11.604 3.702
98 HD2 ARG 12 HD2 ARG 12 2.340 12.965 5.578
99 HD3 ARG 12 HD1 ARG 12 0.962 12.050 4.965
100 HE ARG 12 HE ARG 12 1.827 10.453 6.941
101 HH11 ARG 12 HH11 ARG 12 1.242 13.919 6.874
102 HH12 ARG 12 HH12 ARG 12 0.762 13.989 8.547
103 HH21 ARG 12 HH21 ARG 12 1.240 10.548 9.128
104 HH22 ARG 12 HH22 ARG 12 0.773 12.070 9.838
105 H ALA 13 HN ALA 13 1.719 6.747 3.496
106 HA ALA 13 HA ALA 13 1.746 5.658 6.073
107 HB1 ALA 13 HB1 ALA 13 0.602 3.753 5.117
108 HB2 ALA 13 HB2 ALA 13 1.105 4.234 3.497
109 HB3 ALA 13 HB3 ALA 13 -0.013 5.248 4.411
110 H LEU 14 HN LEU 14 3.762 4.940 3.270
111 HA LEU 14 HA LEU 14 4.991 2.636 4.439
112 HB2 LEU 14 HB2 LEU 14 5.556 4.335 2.040
113 HB3 LEU 14 HB1 LEU 14 6.762 3.195 2.595
114 HG LEU 14 HG LEU 14 5.466 2.219 0.797
115 HD11 LEU 14 HD11 LEU 14 4.738 0.966 3.439
116 HD12 LEU 14 HD12 LEU 14 6.245 0.718 2.559
117 HD13 LEU 14 HD13 LEU 14 4.719 0.166 1.868
118 HD21 LEU 14 HD21 LEU 14 3.407 3.522 1.077
119 HD22 LEU 14 HD22 LEU 14 3.040 2.611 2.542
120 HD23 LEU 14 HD23 LEU 14 3.086 1.791 0.981
121 H VAL 15 HN VAL 15 5.545 6.054 4.613
122 HA VAL 15 HA VAL 15 8.248 5.753 5.634
123 HB VAL 15 HB VAL 15 6.555 8.248 5.388
124 HG11 VAL 15 HG11 VAL 15 8.281 8.591 7.028
125 HG12 VAL 15 HG12 VAL 15 8.722 9.444 5.549
126 HG13 VAL 15 HG13 VAL 15 9.503 7.914 5.951
127 HG21 VAL 15 HG21 VAL 15 6.941 7.295 3.215
128 HG22 VAL 15 HG22 VAL 15 8.662 7.108 3.553
129 HG23 VAL 15 HG23 VAL 15 7.960 8.721 3.406
130 H GLU 16 HN GLU 16 5.025 6.105 6.867
131 HA GLU 16 HA GLU 16 5.924 6.784 9.531
132 HB2 GLU 16 HB2 GLU 16 3.188 6.104 8.442
133 HB3 GLU 16 HB1 GLU 16 3.503 6.572 10.109
134 HG2 GLU 16 HG2 GLU 16 4.264 8.738 9.418
135 HG3 GLU 16 HG1 GLU 16 4.157 8.281 7.720
136 H SER 17 HN SER 17 5.309 3.945 7.712
137 HA SER 17 HA SER 17 5.105 2.251 10.060
138 HB2 SER 17 HB2 SER 17 5.087 0.410 8.281
139 HB3 SER 17 HB1 SER 17 3.731 1.537 8.275
140 HG SER 17 HG SER 17 4.410 2.392 6.439
141 H ALA 18 HN ALA 18 7.239 2.255 7.201
142 HA ALA 18 HA ALA 18 9.297 0.857 8.672
143 HB1 ALA 18 HB1 ALA 18 8.850 0.343 6.306
144 HB2 ALA 18 HB2 ALA 18 10.521 0.843 6.569
145 HB3 ALA 18 HB3 ALA 18 9.362 1.972 5.866
146 H GLY 19 HN GLY 19 9.394 3.841 6.734
147 HA2 GLY 19 HA2 GLY 19 10.003 5.972 7.483
148 HA3 GLY 19 HA1 GLY 19 10.593 5.258 8.971
149 H GLU 20 HN GLU 20 11.973 7.201 7.755
150 HA GLU 20 HA GLU 20 14.053 7.823 7.132
151 HB2 GLU 20 HB2 GLU 20 14.789 4.976 7.815
152 HB3 GLU 20 HB1 GLU 20 15.901 6.331 7.657
153 HG2 GLU 20 HG2 GLU 20 14.717 7.453 9.514
154 HG3 GLU 20 HG1 GLU 20 13.744 5.996 9.724
155 H THR 21 HN THR 21 13.620 8.211 4.955
156 HA THR 21 HA THR 21 14.318 6.051 3.102
157 HB THR 21 HB THR 21 13.452 7.667 1.352
158 HG1 THR 21 HG1 THR 21 13.513 9.595 2.490
159 HG21 THR 21 HG21 THR 21 11.076 7.230 1.896
160 HG22 THR 21 HG22 THR 21 11.565 6.730 3.516
161 HG23 THR 21 HG23 THR 21 12.095 5.806 2.110
162 H ASP 22 HN ASP 22 16.571 6.273 3.716
163 HA ASP 22 HA ASP 22 18.038 8.648 3.115
164 HB2 ASP 22 HB2 ASP 22 18.872 5.805 3.670
165 HB3 ASP 22 HB1 ASP 22 20.037 7.065 3.286
166 H GLY 23 HN GLY 23 17.195 5.744 1.360
167 HA2 GLY 23 HA2 GLY 23 17.986 6.999 -1.131
168 HA3 GLY 23 HA1 GLY 23 18.890 5.548 -0.710
169 H THR 24 HN THR 24 15.487 6.553 -0.563
170 HA THR 24 HA THR 24 14.700 4.305 -2.222
171 HB THR 24 HB THR 24 13.508 4.559 0.543
172 HG1 THR 24 HG1 THR 24 15.700 2.995 -0.374
173 HG21 THR 24 HG21 THR 24 13.465 2.293 -1.454
174 HG22 THR 24 HG22 THR 24 12.155 3.443 -1.199
175 HG23 THR 24 HG23 THR 24 12.626 2.344 0.096
176 H ASP 25 HN ASP 25 13.929 5.924 -3.623
177 HA ASP 25 HA ASP 25 12.203 8.005 -2.666
178 HB2 ASP 25 HB2 ASP 25 13.217 7.229 -5.381
179 HB3 ASP 25 HB1 ASP 25 11.946 8.433 -5.203
180 H LEU 26 HN LEU 26 10.318 7.187 -1.885
181 HA LEU 26 HA LEU 26 8.553 5.871 -3.836
182 HB2 LEU 26 HB2 LEU 26 8.490 6.120 -0.854
183 HB3 LEU 26 HB1 LEU 26 6.987 5.892 -1.724
184 HG LEU 26 HG LEU 26 8.052 3.820 -2.747
185 HD11 LEU 26 HD11 LEU 26 9.871 2.803 -1.473
186 HD12 LEU 26 HD12 LEU 26 10.015 4.275 -0.509
187 HD13 LEU 26 HD13 LEU 26 10.362 4.313 -2.238
188 HD21 LEU 26 HD21 LEU 26 6.339 3.722 -1.026
189 HD22 LEU 26 HD22 LEU 26 7.566 3.893 0.230
190 HD23 LEU 26 HD23 LEU 26 7.541 2.452 -0.790
191 H SER 27 HN SER 27 9.478 8.740 -3.684
192 HA SER 27 HA SER 27 6.906 10.097 -3.264
193 HB2 SER 27 HB2 SER 27 9.219 10.797 -2.195
194 HB3 SER 27 HB1 SER 27 9.472 11.563 -3.763
195 HG SER 27 HG SER 27 8.513 12.997 -2.270
196 H GLY 28 HN GLY 28 7.513 8.447 -5.582
197 HA2 GLY 28 HA2 GLY 28 6.860 10.400 -7.635
198 HA3 GLY 28 HA1 GLY 28 8.333 9.475 -7.901
199 H ASP 29 HN ASP 29 7.456 8.516 -9.771
200 HA ASP 29 HA ASP 29 5.013 7.028 -9.683
201 HB2 ASP 29 HB2 ASP 29 7.233 6.843 -11.735
202 HB3 ASP 29 HB1 ASP 29 5.576 6.283 -11.922
203 H PHE 30 HN PHE 30 5.437 5.669 -7.833
204 HA PHE 30 HA PHE 30 7.297 3.461 -8.398
205 HB2 PHE 30 HB2 PHE 30 7.323 2.977 -6.041
206 HB3 PHE 30 HB1 PHE 30 7.625 4.693 -6.256
207 HD1 PHE 30 HD2 PHE 30 5.795 6.323 -5.776
208 HD2 PHE 30 HD1 PHE 30 5.489 2.197 -4.776
209 HE1 PHE 30 HE2 PHE 30 3.957 6.840 -4.222
210 HE2 PHE 30 HE1 PHE 30 3.650 2.707 -3.224
211 HZ PHE 30 HZ PHE 30 2.926 5.009 -2.890
212 H LEU 31 HN LEU 31 4.069 4.255 -8.518
213 HA LEU 31 HA LEU 31 2.672 2.069 -7.540
214 HB2 LEU 31 HB2 LEU 31 2.071 3.724 -9.985
215 HB3 LEU 31 HB1 LEU 31 0.940 2.627 -9.224
216 HG LEU 31 HG LEU 31 2.085 5.121 -7.960
217 HD11 LEU 31 HD11 LEU 31 0.474 5.522 -9.782
218 HD12 LEU 31 HD12 LEU 31 -0.161 5.994 -8.206
219 HD13 LEU 31 HD13 LEU 31 -0.687 4.484 -8.952
220 HD21 LEU 31 HD21 LEU 31 0.419 4.697 -6.202
221 HD22 LEU 31 HD22 LEU 31 1.624 3.411 -6.293
222 HD23 LEU 31 HD23 LEU 31 0.014 3.163 -6.976
223 H ASP 32 HN ASP 32 4.716 2.209 -10.302
224 HA ASP 32 HA ASP 32 3.378 -0.003 -11.645
225 HB2 ASP 32 HB2 ASP 32 4.157 2.099 -12.831
226 HB3 ASP 32 HB1 ASP 32 5.804 1.532 -12.577
227 H LEU 33 HN LEU 33 6.027 0.529 -9.566
228 HA LEU 33 HA LEU 33 7.515 -1.793 -10.512
229 HB2 LEU 33 HB2 LEU 33 8.160 0.067 -8.226
230 HB3 LEU 33 HB1 LEU 33 9.231 -1.122 -8.943
231 HG LEU 33 HG LEU 33 8.227 1.421 -10.214
232 HD11 LEU 33 HD11 LEU 33 10.042 1.718 -8.622
233 HD12 LEU 33 HD12 LEU 33 10.588 2.019 -10.272
234 HD13 LEU 33 HD13 LEU 33 10.999 0.503 -9.469
235 HD21 LEU 33 HD21 LEU 33 9.924 -0.754 -11.438
236 HD22 LEU 33 HD22 LEU 33 9.550 0.806 -12.171
237 HD23 LEU 33 HD23 LEU 33 8.262 -0.361 -11.877
238 H ARG 34 HN ARG 34 8.153 -3.484 -9.008
239 HA ARG 34 HA ARG 34 5.970 -4.385 -7.400
240 HB2 ARG 34 HB2 ARG 34 8.721 -5.410 -7.973
241 HB3 ARG 34 HB1 ARG 34 7.792 -6.110 -6.656
242 HG2 ARG 34 HG2 ARG 34 5.989 -6.624 -8.258
243 HG3 ARG 34 HG1 ARG 34 7.015 -6.016 -9.561
244 HD2 ARG 34 HD2 ARG 34 8.588 -7.736 -9.269
245 HD3 ARG 34 HD1 ARG 34 7.947 -8.168 -7.687
246 HE ARG 34 HE ARG 34 5.897 -8.578 -9.519
247 HH11 ARG 34 HH11 ARG 34 9.109 -9.823 -8.850
248 HH12 ARG 34 HH12 ARG 34 8.766 -11.405 -9.481
249 HH21 ARG 34 HH21 ARG 34 5.440 -10.688 -10.318
250 HH22 ARG 34 HH22 ARG 34 6.684 -11.901 -10.296
251 H PHE 35 HN PHE 35 5.714 -4.435 -5.214
252 HA PHE 35 HA PHE 35 6.890 -2.592 -3.511
253 HB2 PHE 35 HB2 PHE 35 5.601 -5.254 -2.882
254 HB3 PHE 35 HB1 PHE 35 6.083 -4.103 -1.643
255 HD1 PHE 35 HD2 PHE 35 5.043 -1.780 -1.711
256 HD2 PHE 35 HD1 PHE 35 3.522 -5.086 -3.919
257 HE1 PHE 35 HE2 PHE 35 2.867 -0.648 -1.900
258 HE2 PHE 35 HE1 PHE 35 1.339 -3.955 -4.112
259 HZ PHE 35 HZ PHE 35 1.019 -1.732 -3.100
260 H GLU 36 HN GLU 36 7.618 -6.056 -3.753
261 HA GLU 36 HA GLU 36 9.722 -6.132 -1.926
262 HB2 GLU 36 HB2 GLU 36 9.494 -7.880 -4.374
263 HB3 GLU 36 HB1 GLU 36 10.252 -8.278 -2.838
264 HG2 GLU 36 HG2 GLU 36 7.313 -7.895 -3.359
265 HG3 GLU 36 HG1 GLU 36 8.142 -9.411 -3.009
266 H ASP 37 HN ASP 37 9.648 -4.902 -5.137
267 HA ASP 37 HA ASP 37 12.461 -5.342 -5.648
268 HB2 ASP 37 HB2 ASP 37 10.717 -5.461 -7.440
269 HB3 ASP 37 HB1 ASP 37 10.485 -3.726 -7.262
270 H ILE 38 HN ILE 38 10.396 -2.759 -4.523
271 HA ILE 38 HA ILE 38 12.543 -0.811 -4.794
272 HB ILE 38 HB ILE 38 10.937 0.823 -3.853
273 HG12 ILE 38 HG12 ILE 38 8.998 -1.503 -3.932
274 HG13 ILE 38 HG11 ILE 38 9.608 -0.729 -2.476
275 HG21 ILE 38 HG21 ILE 38 9.939 -0.772 -6.201
276 HG22 ILE 38 HG22 ILE 38 11.120 0.536 -6.246
277 HG23 ILE 38 HG23 ILE 38 9.447 0.873 -5.799
278 HD11 ILE 38 HD11 ILE 38 7.895 0.575 -4.576
279 HD12 ILE 38 HD12 ILE 38 8.507 1.351 -3.116
280 HD13 ILE 38 HD13 ILE 38 7.358 0.019 -2.990
281 H GLY 39 HN GLY 39 12.412 -3.200 -2.846
282 HA2 GLY 39 HA2 GLY 39 13.958 -3.380 -1.069
283 HA3 GLY 39 HA1 GLY 39 13.750 -1.667 -0.746
284 H TYR 40 HN TYR 40 11.183 -4.102 -1.057
285 HA TYR 40 HA TYR 40 10.699 -3.792 1.825
286 HB2 TYR 40 HB2 TYR 40 8.688 -3.707 -0.412
287 HB3 TYR 40 HB1 TYR 40 8.213 -4.125 1.235
288 HD1 TYR 40 HD2 TYR 40 8.483 -2.453 3.055
289 HD2 TYR 40 HD1 TYR 40 9.185 -1.455 -1.021
290 HE1 TYR 40 HE2 TYR 40 8.346 -0.066 3.621
291 HE2 TYR 40 HE1 TYR 40 9.053 0.938 -0.465
292 HH TYR 40 HH TYR 40 9.136 2.079 2.720
293 H ASP 41 HN ASP 41 9.525 -5.544 2.812
294 HA ASP 41 HA ASP 41 9.881 -8.116 1.418
295 HB2 ASP 41 HB2 ASP 41 10.127 -7.672 4.405
296 HB3 ASP 41 HB1 ASP 41 10.429 -9.168 3.535
297 H SER 42 HN SER 42 8.357 -9.768 2.069
298 HA SER 42 HA SER 42 5.713 -9.100 2.208
299 HB2 SER 42 HB2 SER 42 5.713 -11.503 3.488
300 HB3 SER 42 HB1 SER 42 5.912 -11.315 1.744
301 H LEU 43 HN LEU 43 7.903 -9.677 4.934
302 HA LEU 43 HA LEU 43 6.074 -9.467 7.023
303 HB2 LEU 43 HB2 LEU 43 8.398 -10.196 7.310
304 HB3 LEU 43 HB1 LEU 43 8.963 -8.573 6.960
305 HG LEU 43 HG LEU 43 7.801 -7.765 8.995
306 HD11 LEU 43 HD11 LEU 43 6.079 -9.482 9.155
307 HD12 LEU 43 HD12 LEU 43 7.015 -9.386 10.645
308 HD13 LEU 43 HD13 LEU 43 7.308 -10.699 9.504
309 HD21 LEU 43 HD21 LEU 43 10.165 -8.322 9.054
310 HD22 LEU 43 HD22 LEU 43 9.773 -10.000 9.435
311 HD23 LEU 43 HD23 LEU 43 9.390 -8.719 10.587
312 H ALA 44 HN ALA 44 8.148 -6.859 5.712
313 HA ALA 44 HA ALA 44 6.985 -4.806 7.244
314 HB1 ALA 44 HB1 ALA 44 8.405 -4.616 4.594
315 HB2 ALA 44 HB2 ALA 44 9.159 -4.545 6.188
316 HB3 ALA 44 HB3 ALA 44 8.061 -3.263 5.669
317 H LEU 45 HN LEU 45 6.181 -6.140 4.094
318 HA LEU 45 HA LEU 45 4.417 -4.137 3.237
319 HB2 LEU 45 HB2 LEU 45 5.401 -5.949 1.831
320 HB3 LEU 45 HB1 LEU 45 4.300 -7.082 2.591
321 HG LEU 45 HG LEU 45 2.391 -5.784 1.687
322 HD11 LEU 45 HD11 LEU 45 2.804 -4.139 -0.077
323 HD12 LEU 45 HD12 LEU 45 4.537 -4.243 0.237
324 HD13 LEU 45 HD13 LEU 45 3.451 -3.612 1.475
325 HD21 LEU 45 HD21 LEU 45 2.702 -6.485 -0.656
326 HD22 LEU 45 HD22 LEU 45 3.162 -7.733 0.502
327 HD23 LEU 45 HD23 LEU 45 4.407 -6.787 -0.316
328 H MET 46 HN MET 46 3.769 -7.198 4.962
329 HA MET 46 HA MET 46 0.968 -6.785 5.052
330 HB2 MET 46 HB2 MET 46 0.878 -8.657 6.585
331 HB3 MET 46 HB1 MET 46 1.983 -9.020 5.269
332 HG2 MET 46 HG2 MET 46 3.194 -9.803 7.016
333 HG3 MET 46 HG1 MET 46 3.770 -8.140 6.990
334 HE1 MET 46 HE1 MET 46 0.279 -9.469 8.241
335 HE2 MET 46 HE2 MET 46 0.615 -9.730 9.955
336 HE3 MET 46 HE3 MET 46 1.411 -10.727 8.740
337 H GLU 47 HN GLU 47 3.576 -5.944 7.287
338 HA GLU 47 HA GLU 47 1.919 -5.050 9.395
339 HB2 GLU 47 HB2 GLU 47 4.726 -4.241 8.620
340 HB3 GLU 47 HB1 GLU 47 3.932 -3.706 10.094
341 HG2 GLU 47 HG2 GLU 47 3.680 -6.115 10.726
342 HG3 GLU 47 HG1 GLU 47 4.682 -6.517 9.332
343 H THR 48 HN THR 48 3.094 -3.502 6.474
344 HA THR 48 HA THR 48 2.309 -0.868 7.094
345 HB THR 48 HB THR 48 2.501 -2.150 4.360
346 HG1 THR 48 HG1 THR 48 4.473 -2.294 5.541
347 HG21 THR 48 HG21 THR 48 2.651 0.743 5.209
348 HG22 THR 48 HG22 THR 48 1.308 -0.012 4.351
349 HG23 THR 48 HG23 THR 48 2.884 0.132 3.570
350 H ALA 49 HN ALA 49 0.547 -3.608 5.787
351 HA ALA 49 HA ALA 49 -1.676 -2.323 4.722
352 HB1 ALA 49 HB1 ALA 49 -1.581 -4.993 6.119
353 HB2 ALA 49 HB2 ALA 49 -1.204 -4.699 4.422
354 HB3 ALA 49 HB3 ALA 49 -2.845 -4.443 5.017
355 H ALA 50 HN ALA 50 -1.009 -3.303 8.038
356 HA ALA 50 HA ALA 50 -3.563 -2.802 9.108
357 HB1 ALA 50 HB1 ALA 50 -2.466 -2.871 11.279
358 HB2 ALA 50 HB2 ALA 50 -0.890 -2.720 10.500
359 HB3 ALA 50 HB3 ALA 50 -1.869 -4.164 10.238
360 H ARG 51 HN ARG 51 -0.911 -0.751 8.299
361 HA ARG 51 HA ARG 51 -1.643 1.468 9.924
362 HB2 ARG 51 HB2 ARG 51 0.098 1.257 7.469
363 HB3 ARG 51 HB1 ARG 51 -0.091 2.725 8.409
364 HG2 ARG 51 HG2 ARG 51 0.903 0.144 9.575
365 HG3 ARG 51 HG1 ARG 51 1.966 1.368 8.887
366 HD2 ARG 51 HD2 ARG 51 1.906 1.669 11.259
367 HD3 ARG 51 HD1 ARG 51 1.039 3.006 10.514
368 HE ARG 51 HE ARG 51 -1.019 1.577 11.092
369 HH11 ARG 51 HH11 ARG 51 1.914 1.748 12.989
370 HH12 ARG 51 HH12 ARG 51 1.102 1.407 14.495
371 HH21 ARG 51 HH21 ARG 51 -2.089 1.168 13.098
372 HH22 ARG 51 HH22 ARG 51 -1.151 1.099 14.554
373 H LEU 52 HN LEU 52 -2.348 0.470 6.624
374 HA LEU 52 HA LEU 52 -3.730 2.862 5.902
375 HB2 LEU 52 HB2 LEU 52 -3.953 0.084 4.726
376 HB3 LEU 52 HB1 LEU 52 -4.566 1.554 3.990
377 HG LEU 52 HG LEU 52 -1.652 0.961 4.512
378 HD11 LEU 52 HD11 LEU 52 -2.595 -0.459 2.767
379 HD12 LEU 52 HD12 LEU 52 -1.489 0.734 2.086
380 HD13 LEU 52 HD13 LEU 52 -3.232 0.964 1.943
381 HD21 LEU 52 HD21 LEU 52 -1.253 2.970 3.160
382 HD22 LEU 52 HD22 LEU 52 -2.162 3.342 4.627
383 HD23 LEU 52 HD23 LEU 52 -2.995 3.252 3.075
384 H GLU 53 HN GLU 53 -4.742 -0.353 6.964
385 HA GLU 53 HA GLU 53 -7.494 0.063 6.813
386 HB2 GLU 53 HB2 GLU 53 -6.006 -1.738 8.722
387 HB3 GLU 53 HB1 GLU 53 -7.708 -1.860 8.300
388 HG2 GLU 53 HG2 GLU 53 -7.065 -2.303 5.953
389 HG3 GLU 53 HG1 GLU 53 -5.373 -2.264 6.444
390 H SER 54 HN SER 54 -5.277 0.571 9.554
391 HA SER 54 HA SER 54 -7.281 1.234 11.415
392 HB2 SER 54 HB2 SER 54 -5.359 2.308 12.690
393 HB3 SER 54 HB1 SER 54 -5.176 0.601 12.293
394 HG SER 54 HG SER 54 -3.726 1.097 10.739
395 H ARG 55 HN ARG 55 -5.573 3.195 9.062
396 HA ARG 55 HA ARG 55 -6.281 5.709 10.202
397 HB2 ARG 55 HB2 ARG 55 -4.356 5.513 8.719
398 HB3 ARG 55 HB1 ARG 55 -5.400 5.017 7.391
399 HG2 ARG 55 HG2 ARG 55 -6.468 7.198 7.382
400 HG3 ARG 55 HG1 ARG 55 -5.486 7.699 8.760
401 HD2 ARG 55 HD2 ARG 55 -4.323 6.820 6.123
402 HD3 ARG 55 HD1 ARG 55 -4.688 8.500 6.514
403 HE ARG 55 HE ARG 55 -3.115 7.528 8.573
404 HH11 ARG 55 HH11 ARG 55 -2.774 8.015 5.119
405 HH12 ARG 55 HH12 ARG 55 -1.082 8.376 5.210
406 HH21 ARG 55 HH21 ARG 55 -0.888 7.976 8.698
407 HH22 ARG 55 HH22 ARG 55 0.004 8.353 7.252
408 H TYR 56 HN TYR 56 -7.661 3.762 7.572
409 HA TYR 56 HA TYR 56 -9.707 5.821 7.169
410 HB2 TYR 56 HB2 TYR 56 -9.015 3.399 5.497
411 HB3 TYR 56 HB1 TYR 56 -10.209 4.622 5.072
412 HD1 TYR 56 HD2 TYR 56 -9.495 6.884 4.431
413 HD2 TYR 56 HD1 TYR 56 -6.647 3.828 5.263
414 HE1 TYR 56 HE2 TYR 56 -7.734 8.236 3.369
415 HE2 TYR 56 HE1 TYR 56 -4.889 5.173 4.205
416 HH TYR 56 HH TYR 56 -5.414 8.475 3.242
417 H GLY 57 HN GLY 57 -9.327 2.776 8.651
418 HA2 GLY 57 HA2 GLY 57 -10.887 1.573 9.887
419 HA3 GLY 57 HA1 GLY 57 -12.135 2.680 9.322
420 H VAL 58 HN VAL 58 -9.886 0.723 7.410
421 HA VAL 58 HA VAL 58 -12.229 -0.491 6.110
422 HB VAL 58 HB VAL 58 -10.804 -0.884 4.145
423 HG11 VAL 58 HG11 VAL 58 -12.116 1.160 4.256
424 HG12 VAL 58 HG12 VAL 58 -10.592 1.441 3.414
425 HG13 VAL 58 HG13 VAL 58 -10.790 1.978 5.083
426 HG21 VAL 58 HG21 VAL 58 -8.642 -1.053 5.295
427 HG22 VAL 58 HG22 VAL 58 -8.702 0.673 5.654
428 HG23 VAL 58 HG23 VAL 58 -8.587 0.122 3.982
429 H SER 59 HN SER 59 -11.181 -2.585 4.804
430 HA SER 59 HA SER 59 -9.447 -4.152 6.495
431 HB2 SER 59 HB2 SER 59 -12.286 -5.015 5.874
432 HB3 SER 59 HB1 SER 59 -11.056 -6.040 6.602
433 HG SER 59 HG SER 59 -11.209 -3.738 7.968
434 H ILE 60 HN ILE 60 -8.165 -5.389 5.251
435 HA ILE 60 HA ILE 60 -8.724 -5.440 2.373
436 HB ILE 60 HB ILE 60 -6.199 -6.157 3.882
437 HG12 ILE 60 HG12 ILE 60 -6.942 -3.686 2.295
438 HG13 ILE 60 HG11 ILE 60 -6.776 -3.773 4.042
439 HG21 ILE 60 HG21 ILE 60 -6.343 -7.356 1.775
440 HG22 ILE 60 HG22 ILE 60 -5.113 -6.096 1.681
441 HG23 ILE 60 HG23 ILE 60 -6.685 -5.852 0.920
442 HD11 ILE 60 HD11 ILE 60 -4.574 -4.127 2.020
443 HD12 ILE 60 HD12 ILE 60 -4.389 -4.289 3.765
444 HD13 ILE 60 HD13 ILE 60 -4.835 -2.730 3.067
445 HA PRO 61 HA PRO 61 -10.211 -9.626 2.844
446 HB2 PRO 61 HB2 PRO 61 -10.176 -9.645 -0.098
447 HB3 PRO 61 HB1 PRO 61 -11.537 -9.841 1.010
448 HG2 PRO 61 HG2 PRO 61 -11.228 -7.615 -0.453
449 HG3 PRO 61 HG1 PRO 61 -11.890 -7.567 1.191
450 HD2 PRO 61 HD2 PRO 61 -9.122 -6.912 0.245
451 HD3 PRO 61 HD1 PRO 61 -10.138 -6.059 1.428
452 H ASP 62 HN ASP 62 -9.319 -11.602 2.831
453 HA ASP 62 HA ASP 62 -6.567 -11.931 2.571
454 HB2 ASP 62 HB2 ASP 62 -8.666 -14.105 2.503
455 HB3 ASP 62 HB1 ASP 62 -6.976 -14.299 2.954
456 H ASP 63 HN ASP 63 -9.051 -12.309 0.170
457 HA ASP 63 HA ASP 63 -7.584 -14.101 -1.505
458 HB2 ASP 63 HB2 ASP 63 -10.112 -12.527 -1.807
459 HB3 ASP 63 HB1 ASP 63 -9.365 -13.238 -3.234
460 H VAL 64 HN VAL 64 -8.509 -10.675 -1.936
461 HA VAL 64 HA VAL 64 -6.908 -10.474 -4.284
462 HB VAL 64 HB VAL 64 -7.982 -8.132 -2.733
463 HG11 VAL 64 HG11 VAL 64 -6.476 -7.604 -4.573
464 HG12 VAL 64 HG12 VAL 64 -8.126 -7.116 -4.967
465 HG13 VAL 64 HG13 VAL 64 -7.448 -8.585 -5.668
466 HG21 VAL 64 HG21 VAL 64 -9.455 -9.866 -4.709
467 HG22 VAL 64 HG22 VAL 64 -10.042 -8.339 -4.052
468 HG23 VAL 64 HG23 VAL 64 -9.800 -9.723 -2.984
469 H ALA 65 HN ALA 65 -6.308 -10.014 -0.923
470 HA ALA 65 HA ALA 65 -4.292 -8.077 -1.004
471 HB1 ALA 65 HB1 ALA 65 -4.544 -10.357 0.949
472 HB2 ALA 65 HB2 ALA 65 -5.407 -8.823 1.059
473 HB3 ALA 65 HB3 ALA 65 -3.650 -8.857 1.194
474 H GLY 66 HN GLY 66 -4.159 -11.550 -1.452
475 HA2 GLY 66 HA2 GLY 66 -1.243 -11.493 -1.616
476 HA3 GLY 66 HA1 GLY 66 -2.262 -12.926 -1.654
477 H ARG 67 HN ARG 67 -3.649 -10.790 -3.724
478 HA ARG 67 HA ARG 67 -2.363 -12.150 -5.984
479 HB2 ARG 67 HB2 ARG 67 -5.043 -10.778 -5.801
480 HB3 ARG 67 HB1 ARG 67 -4.393 -11.510 -7.262
481 HG2 ARG 67 HG2 ARG 67 -4.295 -13.680 -6.043
482 HG3 ARG 67 HG1 ARG 67 -5.131 -12.898 -4.701
483 HD2 ARG 67 HD2 ARG 67 -6.975 -12.324 -6.248
484 HD3 ARG 67 HD1 ARG 67 -6.153 -13.228 -7.517
485 HE ARG 67 HE ARG 67 -6.631 -14.756 -5.126
486 HH11 ARG 67 HH11 ARG 67 -7.891 -13.771 -8.253
487 HH12 ARG 67 HH12 ARG 67 -9.108 -15.017 -8.300
488 HH21 ARG 67 HH21 ARG 67 -8.194 -16.403 -5.191
489 HH22 ARG 67 HH22 ARG 67 -9.281 -16.514 -6.547
490 H VAL 68 HN VAL 68 -2.051 -9.302 -4.434
491 HA VAL 68 HA VAL 68 -1.885 -7.646 -6.814
492 HB VAL 68 HB VAL 68 -1.192 -5.822 -5.335
493 HG11 VAL 68 HG11 VAL 68 -3.618 -7.314 -4.347
494 HG12 VAL 68 HG12 VAL 68 -3.563 -6.188 -5.703
495 HG13 VAL 68 HG13 VAL 68 -3.277 -5.609 -4.062
496 HG21 VAL 68 HG21 VAL 68 -1.133 -6.099 -2.914
497 HG22 VAL 68 HG22 VAL 68 0.061 -7.143 -3.686
498 HG23 VAL 68 HG23 VAL 68 -1.453 -7.826 -3.090
499 H ASP 69 HN ASP 69 0.150 -6.278 -7.036
500 HA ASP 69 HA ASP 69 2.595 -7.710 -6.379
501 HB2 ASP 69 HB2 ASP 69 1.531 -8.602 -8.566
502 HB3 ASP 69 HB1 ASP 69 2.002 -7.054 -9.259
503 H THR 70 HN THR 70 1.189 -5.150 -8.377
504 HA THR 70 HA THR 70 3.342 -3.345 -7.561
505 HB THR 70 HB THR 70 2.450 -1.884 -9.415
506 HG1 THR 70 HG1 THR 70 0.878 -2.667 -10.737
507 HG21 THR 70 HG21 THR 70 4.384 -3.341 -9.771
508 HG22 THR 70 HG22 THR 70 3.391 -3.248 -11.228
509 HG23 THR 70 HG23 THR 70 3.308 -4.673 -10.193
510 HA PRO 71 HA PRO 71 0.764 -0.931 -4.847
511 HB2 PRO 71 HB2 PRO 71 1.962 1.426 -6.191
512 HB3 PRO 71 HB1 PRO 71 1.911 1.013 -4.472
513 HG2 PRO 71 HG2 PRO 71 4.166 0.747 -5.845
514 HG3 PRO 71 HG1 PRO 71 3.689 -0.471 -4.642
515 HD2 PRO 71 HD2 PRO 71 3.493 -0.581 -7.630
516 HD3 PRO 71 HD1 PRO 71 3.974 -1.849 -6.484
517 H ARG 72 HN ARG 72 0.899 -0.081 -8.266
518 HA ARG 72 HA ARG 72 -1.280 1.651 -8.374
519 HB2 ARG 72 HB2 ARG 72 0.452 0.795 -10.211
520 HB3 ARG 72 HB1 ARG 72 -0.887 -0.270 -10.618
521 HG2 ARG 72 HG2 ARG 72 -1.040 2.733 -10.490
522 HG3 ARG 72 HG1 ARG 72 -0.863 1.780 -11.964
523 HD2 ARG 72 HD2 ARG 72 -3.009 0.945 -11.835
524 HD3 ARG 72 HD1 ARG 72 -3.121 1.221 -10.096
525 HE ARG 72 HE ARG 72 -2.907 3.717 -11.190
526 HH11 ARG 72 HH11 ARG 72 -5.067 0.998 -11.640
527 HH12 ARG 72 HH12 ARG 72 -6.454 1.991 -11.967
528 HH21 ARG 72 HH21 ARG 72 -4.732 5.026 -11.687
529 HH22 ARG 72 HH22 ARG 72 -6.265 4.270 -11.999
530 H GLU 73 HN GLU 73 -1.213 -1.883 -8.809
531 HA GLU 73 HA GLU 73 -4.002 -2.125 -9.218
532 HB2 GLU 73 HB2 GLU 73 -2.152 -4.282 -8.197
533 HB3 GLU 73 HB1 GLU 73 -3.674 -4.499 -9.052
534 HG2 GLU 73 HG2 GLU 73 -1.112 -3.393 -10.176
535 HG3 GLU 73 HG1 GLU 73 -1.849 -4.951 -10.544
536 H LEU 74 HN LEU 74 -1.948 -2.514 -6.362
537 HA LEU 74 HA LEU 74 -3.879 -3.324 -4.514
538 HB2 LEU 74 HB2 LEU 74 -1.507 -3.314 -3.989
539 HB3 LEU 74 HB1 LEU 74 -1.454 -1.567 -4.122
540 HG LEU 74 HG LEU 74 -3.011 -1.434 -2.181
541 HD11 LEU 74 HD11 LEU 74 -2.475 -4.389 -2.008
542 HD12 LEU 74 HD12 LEU 74 -4.023 -3.622 -2.356
543 HD13 LEU 74 HD13 LEU 74 -3.277 -3.419 -0.771
544 HD21 LEU 74 HD21 LEU 74 -0.392 -2.844 -1.722
545 HD22 LEU 74 HD22 LEU 74 -1.332 -2.010 -0.484
546 HD23 LEU 74 HD23 LEU 74 -0.654 -1.101 -1.833
547 H LEU 75 HN LEU 75 -2.759 -0.036 -5.252
548 HA LEU 75 HA LEU 75 -4.551 1.356 -3.645
549 HB2 LEU 75 HB2 LEU 75 -2.527 2.256 -4.826
550 HB3 LEU 75 HB1 LEU 75 -3.467 2.266 -6.306
551 HG LEU 75 HG LEU 75 -5.103 3.781 -5.093
552 HD11 LEU 75 HD11 LEU 75 -4.392 3.334 -2.825
553 HD12 LEU 75 HD12 LEU 75 -4.182 5.044 -3.201
554 HD13 LEU 75 HD13 LEU 75 -2.784 3.971 -3.184
555 HD21 LEU 75 HD21 LEU 75 -3.619 4.634 -6.798
556 HD22 LEU 75 HD22 LEU 75 -2.298 4.736 -5.636
557 HD23 LEU 75 HD23 LEU 75 -3.704 5.783 -5.459
558 H ASP 76 HN ASP 76 -4.822 0.422 -7.066
559 HA ASP 76 HA ASP 76 -7.263 1.643 -7.648
560 HB2 ASP 76 HB2 ASP 76 -5.808 0.721 -9.387
561 HB3 ASP 76 HB1 ASP 76 -6.110 -0.910 -8.796
562 H LEU 77 HN LEU 77 -6.617 -1.633 -6.454
563 HA LEU 77 HA LEU 77 -9.281 -2.536 -6.475
564 HB2 LEU 77 HB2 LEU 77 -7.167 -3.908 -6.245
565 HB3 LEU 77 HB1 LEU 77 -7.110 -3.404 -4.571
566 HG LEU 77 HG LEU 77 -8.063 -5.711 -5.058
567 HD11 LEU 77 HD11 LEU 77 -8.343 -4.639 -2.894
568 HD12 LEU 77 HD12 LEU 77 -9.792 -5.542 -3.344
569 HD13 LEU 77 HD13 LEU 77 -9.766 -3.784 -3.489
570 HD21 LEU 77 HD21 LEU 77 -10.404 -4.059 -5.982
571 HD22 LEU 77 HD22 LEU 77 -10.425 -5.798 -5.695
572 HD23 LEU 77 HD23 LEU 77 -9.419 -5.130 -6.979
573 H ILE 78 HN ILE 78 -7.329 -1.014 -3.923
574 HA ILE 78 HA ILE 78 -9.375 -1.108 -1.954
575 HB ILE 78 HB ILE 78 -6.928 0.660 -2.120
576 HG12 ILE 78 HG12 ILE 78 -7.485 -1.913 -0.618
577 HG13 ILE 78 HG11 ILE 78 -6.432 -1.742 -2.018
578 HG21 ILE 78 HG21 ILE 78 -7.258 1.104 0.252
579 HG22 ILE 78 HG22 ILE 78 -8.724 0.124 0.246
580 HG23 ILE 78 HG23 ILE 78 -8.668 1.630 -0.669
581 HD11 ILE 78 HD11 ILE 78 -4.978 -0.264 -0.689
582 HD12 ILE 78 HD12 ILE 78 -5.114 -1.889 -0.021
583 HD13 ILE 78 HD13 ILE 78 -6.008 -0.555 0.716
584 H ASN 79 HN ASN 79 -8.456 1.269 -4.402
585 HA ASN 79 HA ASN 79 -10.206 3.327 -3.576
586 HB2 ASN 79 HB2 ASN 79 -8.865 2.643 -6.161
587 HB3 ASN 79 HB1 ASN 79 -10.156 3.843 -6.169
588 HD21 ASN 79 HD21 ASN 79 -7.947 3.328 -3.501
589 HD22 ASN 79 HD22 ASN 79 -7.151 4.861 -3.621
590 H GLY 80 HN GLY 80 -10.661 0.591 -5.765
591 HA2 GLY 80 HA2 GLY 80 -13.309 1.119 -6.527
592 HA3 GLY 80 HA1 GLY 80 -12.570 -0.475 -6.455
593 H ALA 81 HN ALA 81 -12.005 -0.375 -3.634
594 HA ALA 81 HA ALA 81 -14.516 -1.285 -2.636
595 HB1 ALA 81 HB1 ALA 81 -11.929 -0.798 -1.162
596 HB2 ALA 81 HB2 ALA 81 -12.399 -2.309 -1.941
597 HB3 ALA 81 HB3 ALA 81 -13.312 -1.709 -0.555
598 H LEU 82 HN LEU 82 -12.420 1.503 -1.900
599 HA LEU 82 HA LEU 82 -14.088 2.677 0.020
600 HB2 LEU 82 HB2 LEU 82 -11.871 3.603 -1.735
601 HB3 LEU 82 HB1 LEU 82 -12.840 4.820 -0.928
602 HG LEU 82 HG LEU 82 -10.678 4.090 0.192
603 HD11 LEU 82 HD11 LEU 82 -13.256 3.923 1.743
604 HD12 LEU 82 HD12 LEU 82 -12.387 5.400 1.328
605 HD13 LEU 82 HD13 LEU 82 -11.661 4.229 2.431
606 HD21 LEU 82 HD21 LEU 82 -10.819 2.114 1.626
607 HD22 LEU 82 HD22 LEU 82 -10.876 1.699 -0.087
608 HD23 LEU 82 HD23 LEU 82 -12.356 1.690 0.873
609 H ALA 83 HN ALA 83 -14.084 2.876 -3.489
610 HA ALA 83 HA ALA 83 -15.956 4.965 -3.756
611 HB1 ALA 83 HB1 ALA 83 -14.581 4.176 -5.618
612 HB2 ALA 83 HB2 ALA 83 -16.297 4.139 -6.024
613 HB3 ALA 83 HB3 ALA 83 -15.453 2.644 -5.619
614 H GLU 84 HN GLU 84 -16.378 1.429 -3.669
615 HA GLU 84 HA GLU 84 -19.260 1.685 -3.805
616 HB2 GLU 84 HB2 GLU 84 -17.480 -0.732 -3.476
617 HB3 GLU 84 HB1 GLU 84 -19.231 -0.802 -3.623
618 HG2 GLU 84 HG2 GLU 84 -17.300 0.232 -5.688
619 HG3 GLU 84 HG1 GLU 84 -18.176 -1.296 -5.741
620 H ALA 85 HN ALA 85 -17.275 2.340 -1.401
621 HA ALA 85 HA ALA 85 -18.392 0.854 0.761
622 HB1 ALA 85 HB1 ALA 85 -16.915 3.477 0.844
623 HB2 ALA 85 HB2 ALA 85 -16.150 1.889 0.842
624 HB3 ALA 85 HB3 ALA 85 -17.176 2.372 2.193
625 H ALA 86 HN ALA 86 -19.214 3.760 -0.938
626 HA ALA 86 HA ALA 86 -21.358 4.334 0.987
627 HB1 ALA 86 HB1 ALA 86 -19.869 6.217 0.528
628 HB2 ALA 86 HB2 ALA 86 -21.502 6.544 -0.060
629 HB3 ALA 86 HB3 ALA 86 -20.224 6.090 -1.191
630 H28 SXO 87 H28B SXO 87 5.423 -11.824 4.699
631 H28A SXO 87 H28A SXO 87 6.220 -12.304 6.200
632 H30 SXO 87 H30A SXO 87 3.905 -12.362 7.164
633 H30A SXO 87 H30C SXO 87 3.269 -11.966 5.567
634 H30B SXO 87 H30B SXO 87 2.676 -13.388 6.423
635 H31 SXO 87 H31A SXO 87 3.737 -13.448 3.645
636 H31A SXO 87 H31B SXO 87 3.318 -14.924 4.514
637 H31B SXO 87 H31C SXO 87 4.917 -14.752 3.791
638 H32 SXO 87 H32A SXO 87 5.191 -14.334 7.551
639 HO33 SXO 87 H33A SXO 87 6.457 -15.188 5.185
640 HN36 SXO 87 H36A SXO 87 2.699 -14.698 7.331
641 H37 SXO 87 H37A SXO 87 2.132 -17.538 6.754
642 H37A SXO 87 H37B SXO 87 1.480 -16.676 8.149
643 H38 SXO 87 H38B SXO 87 -0.199 -16.874 6.406
644 H38A SXO 87 H38A SXO 87 0.884 -16.097 5.250
645 HN41 SXO 87 H41A SXO 87 -0.575 -14.496 4.824
646 H42 SXO 87 H42A SXO 87 -2.121 -12.767 5.567
647 H42A SXO 87 H42B SXO 87 -1.060 -12.507 6.952
648 H43 SXO 87 H43B SXO 87 -0.733 -10.732 5.331
649 H43A SXO 87 H43A SXO 87 0.720 -11.739 5.406
650 H2 SXO 87 H2A SXO 87 -0.127 -11.099 0.939
651 H2A SXO 87 H2B SXO 87 1.589 -10.699 0.946
652 H3 SXO 87 H3B SXO 87 1.068 -8.400 1.540
653 H3A SXO 87 H3A SXO 87 0.241 -8.872 0.055
654 H4 SXO 87 H4A SXO 87 -0.947 -8.676 2.820
655 H4A SXO 87 H4B SXO 87 -1.794 -9.329 1.418
656 H5 SXO 87 H5B SXO 87 -1.505 -7.172 0.263
657 H5A SXO 87 H5A SXO 87 -2.444 -7.028 1.750
658 H6 SXO 87 H6A SXO 87 0.482 -6.353 1.428
659 H6A SXO 87 H6B SXO 87 -0.440 -6.227 2.926
660 H7 SXO 87 H7A SXO 87 -1.919 -4.576 1.873
661 H7A SXO 87 H7B SXO 87 -0.984 -4.693 0.375
662 H8 SXO 87 H8C SXO 87 1.000 -3.917 1.577
663 H8A SXO 87 H8A SXO 87 0.056 -3.786 3.062
664 H8B SXO 87 H8B SXO 87 -0.314 -2.745 1.683
Start of MODEL 18
1 H1 MET 1 HT1 MET 1 -14.616 15.886 4.809
2 H2 MET 1 HT2 MET 1 -14.128 15.755 3.191
3 H3 MET 1 HT3 MET 1 -13.535 14.666 4.344
4 HA MET 1 HA MET 1 -15.759 13.793 4.702
5 HB2 MET 1 HB2 MET 1 -16.489 15.613 2.391
6 HB3 MET 1 HB1 MET 1 -17.545 14.404 3.108
7 HG2 MET 1 HG2 MET 1 -16.453 16.857 4.468
8 HG3 MET 1 HG1 MET 1 -18.106 16.616 3.902
9 HE1 MET 1 HE1 MET 1 -19.798 14.885 4.956
10 HE2 MET 1 HE2 MET 1 -19.407 13.819 6.307
11 HE3 MET 1 HE3 MET 1 -18.649 13.566 4.735
12 H ALA 2 HN ALA 2 -15.299 11.809 4.099
13 HA ALA 2 HA ALA 2 -14.929 9.960 2.844
14 HB1 ALA 2 HB1 ALA 2 -15.598 9.920 0.513
15 HB2 ALA 2 HB2 ALA 2 -15.670 11.682 0.485
16 HB3 ALA 2 HB3 ALA 2 -16.801 10.769 1.484
17 H THR 3 HN THR 3 -12.745 9.974 3.410
18 HA THR 3 HA THR 3 -10.859 11.225 1.574
19 HB THR 3 HB THR 3 -10.264 9.686 4.080
20 HG1 THR 3 HG1 THR 3 -11.465 12.065 3.821
21 HG21 THR 3 HG21 THR 3 -8.155 10.926 4.053
22 HG22 THR 3 HG22 THR 3 -8.651 11.743 2.570
23 HG23 THR 3 HG23 THR 3 -8.357 10.004 2.563
24 H LEU 4 HN LEU 4 -10.615 10.017 -0.230
25 HA LEU 4 HA LEU 4 -10.418 7.131 -0.112
26 HB2 LEU 4 HB2 LEU 4 -10.003 9.053 -2.404
27 HB3 LEU 4 HB1 LEU 4 -10.012 7.307 -2.548
28 HG LEU 4 HG LEU 4 -12.348 9.047 -1.754
29 HD11 LEU 4 HD11 LEU 4 -11.870 9.148 -4.120
30 HD12 LEU 4 HD12 LEU 4 -13.334 8.205 -3.837
31 HD13 LEU 4 HD13 LEU 4 -11.818 7.386 -4.211
32 HD21 LEU 4 HD21 LEU 4 -13.660 6.975 -1.783
33 HD22 LEU 4 HD22 LEU 4 -12.432 6.963 -0.519
34 HD23 LEU 4 HD23 LEU 4 -12.177 6.046 -2.005
35 H LEU 5 HN LEU 5 -8.525 6.040 -1.160
36 HA LEU 5 HA LEU 5 -6.072 7.017 0.043
37 HB2 LEU 5 HB2 LEU 5 -7.019 4.565 -0.147
38 HB3 LEU 5 HB1 LEU 5 -6.266 4.602 -1.727
39 HG LEU 5 HG LEU 5 -4.777 5.095 0.854
40 HD11 LEU 5 HD11 LEU 5 -3.930 2.821 0.593
41 HD12 LEU 5 HD12 LEU 5 -4.989 2.583 -0.796
42 HD13 LEU 5 HD13 LEU 5 -5.682 2.836 0.807
43 HD21 LEU 5 HD21 LEU 5 -3.724 6.067 -1.125
44 HD22 LEU 5 HD22 LEU 5 -3.816 4.510 -1.945
45 HD23 LEU 5 HD23 LEU 5 -2.796 4.696 -0.518
46 H THR 6 HN THR 6 -4.617 8.263 -1.066
47 HA THR 6 HA THR 6 -4.781 8.175 -4.010
48 HB THR 6 HB THR 6 -4.108 10.531 -4.086
49 HG1 THR 6 HG1 THR 6 -4.348 10.396 -1.231
50 HG21 THR 6 HG21 THR 6 -6.555 9.936 -2.426
51 HG22 THR 6 HG22 THR 6 -6.464 10.090 -4.181
52 HG23 THR 6 HG23 THR 6 -6.212 11.504 -3.158
53 H THR 7 HN THR 7 -2.681 9.576 -4.792
54 HA THR 7 HA THR 7 -0.535 7.822 -4.729
55 HB THR 7 HB THR 7 0.728 9.991 -5.493
56 HG1 THR 7 HG1 THR 7 -0.549 11.664 -5.060
57 HG21 THR 7 HG21 THR 7 0.029 8.197 -7.000
58 HG22 THR 7 HG22 THR 7 -0.259 9.777 -7.727
59 HG23 THR 7 HG23 THR 7 -1.604 8.862 -7.046
60 H ASP 8 HN ASP 8 -0.807 10.981 -3.171
61 HA ASP 8 HA ASP 8 1.617 10.975 -1.804
62 HB2 ASP 8 HB2 ASP 8 -0.967 12.347 -1.019
63 HB3 ASP 8 HB1 ASP 8 0.644 12.787 -0.468
64 H ASP 9 HN ASP 9 -1.561 9.808 -0.867
65 HA ASP 9 HA ASP 9 -1.001 9.192 1.826
66 HB2 ASP 9 HB2 ASP 9 -3.017 8.069 -0.122
67 HB3 ASP 9 HB1 ASP 9 -2.938 7.569 1.563
68 H LEU 10 HN LEU 10 -0.825 7.270 -1.131
69 HA LEU 10 HA LEU 10 -0.251 4.772 -0.063
70 HB2 LEU 10 HB2 LEU 10 -0.662 5.605 -2.521
71 HB3 LEU 10 HB1 LEU 10 1.080 5.741 -2.570
72 HG LEU 10 HG LEU 10 0.230 3.641 -3.561
73 HD11 LEU 10 HD11 LEU 10 2.493 3.701 -2.684
74 HD12 LEU 10 HD12 LEU 10 1.757 2.115 -2.444
75 HD13 LEU 10 HD13 LEU 10 1.895 3.236 -1.090
76 HD21 LEU 10 HD21 LEU 10 -0.650 3.032 -0.744
77 HD22 LEU 10 HD22 LEU 10 -0.623 1.879 -2.079
78 HD23 LEU 10 HD23 LEU 10 -1.698 3.274 -2.142
79 H ARG 11 HN ARG 11 1.962 7.323 -1.125
80 HA ARG 11 HA ARG 11 4.404 6.152 -0.545
81 HB2 ARG 11 HB2 ARG 11 4.173 8.289 -1.723
82 HB3 ARG 11 HB1 ARG 11 3.590 9.054 -0.253
83 HG2 ARG 11 HG2 ARG 11 5.816 8.438 0.785
84 HG3 ARG 11 HG1 ARG 11 6.356 8.056 -0.850
85 HD2 ARG 11 HD2 ARG 11 5.296 10.713 0.105
86 HD3 ARG 11 HD1 ARG 11 6.982 10.331 -0.220
87 HE ARG 11 HE ARG 11 4.997 10.155 -2.378
88 HH11 ARG 11 HH11 ARG 11 7.832 11.639 -0.984
89 HH12 ARG 11 HH12 ARG 11 8.280 12.489 -2.436
90 HH21 ARG 11 HH21 ARG 11 5.545 11.290 -4.304
91 HH22 ARG 11 HH22 ARG 11 6.974 12.273 -4.331
92 H ARG 12 HN ARG 12 2.221 7.906 1.608
93 HA ARG 12 HA ARG 12 3.952 8.098 3.821
94 HB2 ARG 12 HB2 ARG 12 0.945 8.109 3.645
95 HB3 ARG 12 HB1 ARG 12 1.831 8.415 5.130
96 HG2 ARG 12 HG2 ARG 12 2.903 10.344 4.099
97 HG3 ARG 12 HG1 ARG 12 2.016 10.038 2.605
98 HD2 ARG 12 HD2 ARG 12 0.941 11.786 3.917
99 HD3 ARG 12 HD1 ARG 12 -0.095 10.365 3.792
100 HE ARG 12 HE ARG 12 0.993 9.848 6.124
101 HH11 ARG 12 HH11 ARG 12 -0.013 12.961 4.894
102 HH12 ARG 12 HH12 ARG 12 -0.373 13.609 6.458
103 HH21 ARG 12 HH21 ARG 12 0.498 10.670 8.171
104 HH22 ARG 12 HH22 ARG 12 -0.088 12.305 8.338
105 H ALA 13 HN ALA 13 1.638 5.616 2.859
106 HA ALA 13 HA ALA 13 1.506 4.254 5.303
107 HB1 ALA 13 HB1 ALA 13 0.681 2.349 3.992
108 HB2 ALA 13 HB2 ALA 13 1.176 3.168 2.511
109 HB3 ALA 13 HB3 ALA 13 -0.094 3.860 3.519
110 H LEU 14 HN LEU 14 3.726 3.976 2.595
111 HA LEU 14 HA LEU 14 5.126 1.708 3.514
112 HB2 LEU 14 HB2 LEU 14 5.781 3.920 1.605
113 HB3 LEU 14 HB1 LEU 14 6.996 2.739 2.033
114 HG LEU 14 HG LEU 14 6.070 2.005 -0.003
115 HD11 LEU 14 HD11 LEU 14 6.378 0.221 1.620
116 HD12 LEU 14 HD12 LEU 14 5.011 -0.120 0.558
117 HD13 LEU 14 HD13 LEU 14 4.729 0.451 2.202
118 HD21 LEU 14 HD21 LEU 14 3.338 2.383 1.215
119 HD22 LEU 14 HD22 LEU 14 3.672 1.713 -0.381
120 HD23 LEU 14 HD23 LEU 14 4.073 3.394 -0.030
121 H VAL 15 HN VAL 15 5.770 5.178 3.857
122 HA VAL 15 HA VAL 15 8.173 4.865 5.332
123 HB VAL 15 HB VAL 15 6.294 7.231 5.254
124 HG11 VAL 15 HG11 VAL 15 8.233 8.542 5.961
125 HG12 VAL 15 HG12 VAL 15 9.191 7.066 6.085
126 HG13 VAL 15 HG13 VAL 15 7.817 7.319 7.162
127 HG21 VAL 15 HG21 VAL 15 8.734 6.598 3.598
128 HG22 VAL 15 HG22 VAL 15 7.852 8.124 3.565
129 HG23 VAL 15 HG23 VAL 15 7.067 6.638 3.030
130 H GLU 16 HN GLU 16 4.838 5.605 6.346
131 HA GLU 16 HA GLU 16 5.383 5.863 9.091
132 HB2 GLU 16 HB2 GLU 16 2.836 5.126 7.648
133 HB3 GLU 16 HB1 GLU 16 2.922 5.502 9.363
134 HG2 GLU 16 HG2 GLU 16 3.650 7.755 8.870
135 HG3 GLU 16 HG1 GLU 16 3.708 7.386 7.146
136 H SER 17 HN SER 17 4.970 3.069 7.084
137 HA SER 17 HA SER 17 4.474 1.275 9.288
138 HB2 SER 17 HB2 SER 17 3.534 0.793 7.073
139 HB3 SER 17 HB1 SER 17 5.157 0.701 6.393
140 HG SER 17 HG SER 17 4.746 -1.353 6.831
141 H ALA 18 HN ALA 18 7.125 1.564 6.907
142 HA ALA 18 HA ALA 18 8.799 -0.253 8.327
143 HB1 ALA 18 HB1 ALA 18 9.538 1.681 6.133
144 HB2 ALA 18 HB2 ALA 18 8.897 0.058 5.884
145 HB3 ALA 18 HB3 ALA 18 10.470 0.276 6.651
146 H GLY 19 HN GLY 19 9.118 3.262 7.724
147 HA2 GLY 19 HA2 GLY 19 9.659 4.714 9.606
148 HA3 GLY 19 HA1 GLY 19 10.644 3.407 10.246
149 H GLU 20 HN GLU 20 10.956 6.322 9.098
150 HA GLU 20 HA GLU 20 12.664 7.562 8.296
151 HB2 GLU 20 HB2 GLU 20 14.242 4.993 8.495
152 HB3 GLU 20 HB1 GLU 20 14.930 6.583 8.195
153 HG2 GLU 20 HG2 GLU 20 14.054 7.342 10.365
154 HG3 GLU 20 HG1 GLU 20 13.465 5.707 10.672
155 H THR 21 HN THR 21 14.476 7.499 6.474
156 HA THR 21 HA THR 21 13.349 6.169 4.110
157 HB THR 21 HB THR 21 14.173 8.308 2.872
158 HG1 THR 21 HG1 THR 21 14.150 10.176 4.118
159 HG21 THR 21 HG21 THR 21 11.688 8.306 4.586
160 HG22 THR 21 HG22 THR 21 11.845 7.667 2.949
161 HG23 THR 21 HG23 THR 21 11.985 9.401 3.234
162 H ASP 22 HN ASP 22 14.962 4.573 4.287
163 HA ASP 22 HA ASP 22 17.700 5.058 4.630
164 HB2 ASP 22 HB2 ASP 22 16.639 2.860 4.976
165 HB3 ASP 22 HB1 ASP 22 16.389 2.714 3.238
166 H GLY 23 HN GLY 23 15.954 4.271 1.617
167 HA2 GLY 23 HA2 GLY 23 16.794 6.128 -0.080
168 HA3 GLY 23 HA1 GLY 23 18.258 5.173 0.080
169 H THR 24 HN THR 24 15.762 5.680 -1.885
170 HA THR 24 HA THR 24 16.240 3.533 -3.566
171 HB THR 24 HB THR 24 15.139 2.174 -1.777
172 HG1 THR 24 HG1 THR 24 14.280 0.933 -3.273
173 HG21 THR 24 HG21 THR 24 13.546 3.790 -0.927
174 HG22 THR 24 HG22 THR 24 12.694 2.355 -1.496
175 HG23 THR 24 HG23 THR 24 12.708 3.819 -2.479
176 H ASP 25 HN ASP 25 13.841 3.231 -4.893
177 HA ASP 25 HA ASP 25 13.321 5.950 -5.810
178 HB2 ASP 25 HB2 ASP 25 12.863 3.224 -6.959
179 HB3 ASP 25 HB1 ASP 25 11.840 4.549 -7.509
180 H LEU 26 HN LEU 26 11.989 6.889 -4.340
181 HA LEU 26 HA LEU 26 9.272 5.858 -4.178
182 HB2 LEU 26 HB2 LEU 26 10.533 4.839 -2.295
183 HB3 LEU 26 HB1 LEU 26 10.924 6.446 -1.718
184 HG LEU 26 HG LEU 26 8.487 6.868 -1.416
185 HD11 LEU 26 HD11 LEU 26 6.977 4.939 -1.355
186 HD12 LEU 26 HD12 LEU 26 8.262 3.926 -2.018
187 HD13 LEU 26 HD13 LEU 26 7.599 5.253 -2.974
188 HD21 LEU 26 HD21 LEU 26 9.632 4.527 0.100
189 HD22 LEU 26 HD22 LEU 26 8.284 5.536 0.623
190 HD23 LEU 26 HD23 LEU 26 9.897 6.233 0.462
191 H SER 27 HN SER 27 11.189 8.340 -4.881
192 HA SER 27 HA SER 27 9.957 10.448 -3.341
193 HB2 SER 27 HB2 SER 27 12.376 10.441 -4.110
194 HB3 SER 27 HB1 SER 27 11.779 10.747 -5.738
195 HG SER 27 HG SER 27 12.195 12.723 -4.875
196 H GLY 28 HN GLY 28 8.903 8.656 -5.867
197 HA2 GLY 28 HA2 GLY 28 6.651 10.163 -6.394
198 HA3 GLY 28 HA1 GLY 28 7.832 10.639 -7.606
199 H ASP 29 HN ASP 29 9.104 8.299 -8.139
200 HA ASP 29 HA ASP 29 7.063 6.832 -9.603
201 HB2 ASP 29 HB2 ASP 29 10.002 6.166 -9.617
202 HB3 ASP 29 HB1 ASP 29 8.818 5.960 -10.905
203 H PHE 30 HN PHE 30 5.985 5.467 -8.193
204 HA PHE 30 HA PHE 30 7.585 3.283 -7.131
205 HB2 PHE 30 HB2 PHE 30 6.468 3.442 -4.879
206 HB3 PHE 30 HB1 PHE 30 7.652 4.693 -5.225
207 HD1 PHE 30 HD1 PHE 30 4.054 3.969 -4.930
208 HD2 PHE 30 HD2 PHE 30 7.034 6.987 -5.288
209 HE1 PHE 30 HE1 PHE 30 2.374 5.690 -4.402
210 HE2 PHE 30 HE2 PHE 30 5.365 8.707 -4.749
211 HZ PHE 30 HZ PHE 30 3.063 8.069 -4.226
212 H LEU 31 HN LEU 31 4.447 4.618 -7.899
213 HA LEU 31 HA LEU 31 2.791 2.512 -7.180
214 HB2 LEU 31 HB2 LEU 31 2.561 4.413 -9.500
215 HB3 LEU 31 HB1 LEU 31 1.297 3.299 -9.029
216 HG LEU 31 HG LEU 31 2.369 5.575 -7.368
217 HD11 LEU 31 HD11 LEU 31 0.962 6.319 -9.196
218 HD12 LEU 31 HD12 LEU 31 0.114 6.492 -7.659
219 HD13 LEU 31 HD13 LEU 31 -0.280 5.155 -8.736
220 HD21 LEU 31 HD21 LEU 31 1.769 3.801 -5.886
221 HD22 LEU 31 HD22 LEU 31 0.272 3.501 -6.767
222 HD23 LEU 31 HD23 LEU 31 0.474 4.997 -5.854
223 H ASP 32 HN ASP 32 5.031 2.685 -9.819
224 HA ASP 32 HA ASP 32 3.709 0.561 -11.316
225 HB2 ASP 32 HB2 ASP 32 6.090 2.323 -11.876
226 HB3 ASP 32 HB1 ASP 32 5.650 0.986 -12.926
227 H LEU 33 HN LEU 33 6.202 0.906 -9.011
228 HA LEU 33 HA LEU 33 7.694 -1.416 -9.938
229 HB2 LEU 33 HB2 LEU 33 8.128 0.497 -7.643
230 HB3 LEU 33 HB1 LEU 33 9.125 -0.916 -7.906
231 HG LEU 33 HG LEU 33 10.332 0.906 -8.768
232 HD11 LEU 33 HD11 LEU 33 10.417 -1.041 -10.189
233 HD12 LEU 33 HD12 LEU 33 10.472 0.422 -11.173
234 HD13 LEU 33 HD13 LEU 33 8.977 -0.506 -11.055
235 HD21 LEU 33 HD21 LEU 33 9.429 2.471 -10.428
236 HD22 LEU 33 HD22 LEU 33 8.569 2.552 -8.890
237 HD23 LEU 33 HD23 LEU 33 7.843 1.713 -10.260
238 H ARG 34 HN ARG 34 7.794 -3.374 -8.856
239 HA ARG 34 HA ARG 34 5.545 -4.076 -7.254
240 HB2 ARG 34 HB2 ARG 34 8.103 -5.632 -7.680
241 HB3 ARG 34 HB1 ARG 34 6.573 -6.281 -7.109
242 HG2 ARG 34 HG2 ARG 34 5.558 -5.762 -9.278
243 HG3 ARG 34 HG1 ARG 34 7.104 -5.127 -9.843
244 HD2 ARG 34 HD2 ARG 34 6.967 -7.327 -10.679
245 HD3 ARG 34 HD1 ARG 34 8.083 -7.390 -9.318
246 HE ARG 34 HE ARG 34 5.424 -8.006 -8.513
247 HH11 ARG 34 HH11 ARG 34 8.255 -9.352 -10.058
248 HH12 ARG 34 HH12 ARG 34 7.815 -10.997 -9.735
249 HH21 ARG 34 HH21 ARG 34 4.821 -10.153 -8.081
250 HH22 ARG 34 HH22 ARG 34 5.848 -11.457 -8.621
251 H PHE 35 HN PHE 35 5.468 -4.552 -5.044
252 HA PHE 35 HA PHE 35 6.886 -2.941 -3.295
253 HB2 PHE 35 HB2 PHE 35 5.524 -5.580 -2.740
254 HB3 PHE 35 HB1 PHE 35 6.074 -4.469 -1.494
255 HD1 PHE 35 HD2 PHE 35 5.158 -2.016 -1.722
256 HD2 PHE 35 HD1 PHE 35 3.354 -5.455 -3.461
257 HE1 PHE 35 HE2 PHE 35 3.013 -0.814 -1.861
258 HE2 PHE 35 HE1 PHE 35 1.206 -4.265 -3.609
259 HZ PHE 35 HZ PHE 35 1.026 -1.944 -2.744
260 H GLU 36 HN GLU 36 7.566 -6.268 -4.236
261 HA GLU 36 HA GLU 36 9.702 -6.791 -2.511
262 HB2 GLU 36 HB2 GLU 36 9.417 -7.786 -5.348
263 HB3 GLU 36 HB1 GLU 36 10.312 -8.554 -4.044
264 HG2 GLU 36 HG2 GLU 36 8.200 -8.921 -2.844
265 HG3 GLU 36 HG1 GLU 36 7.329 -8.213 -4.204
266 H ASP 37 HN ASP 37 9.524 -4.918 -5.435
267 HA ASP 37 HA ASP 37 12.366 -5.121 -5.968
268 HB2 ASP 37 HB2 ASP 37 10.375 -5.019 -7.679
269 HB3 ASP 37 HB1 ASP 37 10.516 -3.280 -7.446
270 H ILE 38 HN ILE 38 10.123 -2.939 -4.479
271 HA ILE 38 HA ILE 38 12.109 -0.821 -4.371
272 HB ILE 38 HB ILE 38 10.370 0.414 -3.029
273 HG12 ILE 38 HG12 ILE 38 8.589 -1.853 -3.948
274 HG13 ILE 38 HG11 ILE 38 9.124 -1.615 -2.291
275 HG21 ILE 38 HG21 ILE 38 8.985 0.912 -5.001
276 HG22 ILE 38 HG22 ILE 38 9.644 -0.513 -5.805
277 HG23 ILE 38 HG23 ILE 38 10.703 0.835 -5.391
278 HD11 ILE 38 HD11 ILE 38 6.864 -0.811 -2.586
279 HD12 ILE 38 HD12 ILE 38 7.390 0.257 -3.887
280 HD13 ILE 38 HD13 ILE 38 7.945 0.538 -2.237
281 H GLY 39 HN GLY 39 11.860 -3.613 -2.838
282 HA2 GLY 39 HA2 GLY 39 13.378 -4.249 -1.183
283 HA3 GLY 39 HA1 GLY 39 13.567 -2.564 -0.745
284 H TYR 40 HN TYR 40 10.351 -3.949 -0.911
285 HA TYR 40 HA TYR 40 10.282 -3.792 2.018
286 HB2 TYR 40 HB2 TYR 40 8.140 -3.439 -0.059
287 HB3 TYR 40 HB1 TYR 40 7.731 -3.791 1.619
288 HD1 TYR 40 HD1 TYR 40 9.228 -1.319 -0.655
289 HD2 TYR 40 HD2 TYR 40 8.047 -2.154 3.343
290 HE1 TYR 40 HE1 TYR 40 9.491 1.058 -0.091
291 HE2 TYR 40 HE2 TYR 40 8.300 0.217 3.921
292 HH TYR 40 HH TYR 40 8.677 2.651 1.588
293 H ASP 41 HN ASP 41 10.407 -5.576 3.062
294 HA ASP 41 HA ASP 41 10.115 -8.127 1.770
295 HB2 ASP 41 HB2 ASP 41 10.675 -7.561 4.687
296 HB3 ASP 41 HB1 ASP 41 11.005 -9.052 3.809
297 H SER 42 HN SER 42 9.131 -9.881 3.339
298 HA SER 42 HA SER 42 6.393 -9.801 3.169
299 HB2 SER 42 HB2 SER 42 6.438 -11.716 4.775
300 HB3 SER 42 HB1 SER 42 7.629 -11.874 3.479
301 H LEU 43 HN LEU 43 8.240 -9.507 6.185
302 HA LEU 43 HA LEU 43 6.183 -8.869 7.908
303 HB2 LEU 43 HB2 LEU 43 8.432 -9.425 8.643
304 HB3 LEU 43 HB1 LEU 43 9.052 -7.940 7.952
305 HG LEU 43 HG LEU 43 7.641 -6.670 9.576
306 HD11 LEU 43 HD11 LEU 43 7.201 -9.403 10.762
307 HD12 LEU 43 HD12 LEU 43 5.971 -8.352 10.060
308 HD13 LEU 43 HD13 LEU 43 6.798 -7.873 11.543
309 HD21 LEU 43 HD21 LEU 43 9.674 -8.584 10.709
310 HD22 LEU 43 HD22 LEU 43 9.107 -7.111 11.494
311 HD23 LEU 43 HD23 LEU 43 10.002 -7.011 9.979
312 H ALA 44 HN ALA 44 8.256 -6.616 6.103
313 HA ALA 44 HA ALA 44 7.186 -4.259 7.194
314 HB1 ALA 44 HB1 ALA 44 9.353 -4.359 6.061
315 HB2 ALA 44 HB2 ALA 44 8.314 -3.114 5.370
316 HB3 ALA 44 HB3 ALA 44 8.537 -4.645 4.525
317 H LEU 45 HN LEU 45 6.337 -6.117 4.316
318 HA LEU 45 HA LEU 45 4.580 -4.178 3.237
319 HB2 LEU 45 HB2 LEU 45 5.629 -5.961 1.915
320 HB3 LEU 45 HB1 LEU 45 4.670 -7.154 2.765
321 HG LEU 45 HG LEU 45 2.621 -6.242 1.796
322 HD11 LEU 45 HD11 LEU 45 4.453 -4.308 0.382
323 HD12 LEU 45 HD12 LEU 45 3.295 -3.905 1.647
324 HD13 LEU 45 HD13 LEU 45 2.723 -4.494 0.084
325 HD21 LEU 45 HD21 LEU 45 4.772 -6.779 -0.254
326 HD22 LEU 45 HD22 LEU 45 3.036 -6.869 -0.539
327 HD23 LEU 45 HD23 LEU 45 3.802 -7.995 0.581
328 H MET 46 HN MET 46 4.029 -7.015 5.303
329 HA MET 46 HA MET 46 1.197 -6.786 5.148
330 HB2 MET 46 HB2 MET 46 1.105 -8.490 6.886
331 HB3 MET 46 HB1 MET 46 2.261 -8.931 5.641
332 HG2 MET 46 HG2 MET 46 3.422 -9.498 7.511
333 HG3 MET 46 HG1 MET 46 3.977 -7.840 7.290
334 HE1 MET 46 HE1 MET 46 1.483 -10.176 9.283
335 HE2 MET 46 HE2 MET 46 0.441 -8.952 8.555
336 HE3 MET 46 HE3 MET 46 0.667 -8.985 10.302
337 H GLU 47 HN GLU 47 3.613 -5.513 7.370
338 HA GLU 47 HA GLU 47 1.810 -4.404 9.237
339 HB2 GLU 47 HB2 GLU 47 4.611 -3.674 8.413
340 HB3 GLU 47 HB1 GLU 47 3.744 -2.790 9.659
341 HG2 GLU 47 HG2 GLU 47 4.264 -5.752 9.748
342 HG3 GLU 47 HG1 GLU 47 5.291 -4.540 10.511
343 H THR 48 HN THR 48 3.096 -3.264 6.179
344 HA THR 48 HA THR 48 2.160 -0.625 6.264
345 HB THR 48 HB THR 48 2.482 -2.368 3.813
346 HG1 THR 48 HG1 THR 48 4.434 -2.345 4.900
347 HG21 THR 48 HG21 THR 48 2.559 0.634 4.153
348 HG22 THR 48 HG22 THR 48 1.260 -0.285 3.391
349 HG23 THR 48 HG23 THR 48 2.861 -0.240 2.650
350 H ALA 49 HN ALA 49 0.628 -3.630 5.204
351 HA ALA 49 HA ALA 49 -1.716 -2.592 4.106
352 HB1 ALA 49 HB1 ALA 49 -1.430 -5.170 5.651
353 HB2 ALA 49 HB2 ALA 49 -1.047 -4.954 3.942
354 HB3 ALA 49 HB3 ALA 49 -2.709 -4.767 4.502
355 H ALA 50 HN ALA 50 -1.000 -3.501 7.454
356 HA ALA 50 HA ALA 50 -3.563 -3.048 8.513
357 HB1 ALA 50 HB1 ALA 50 -0.880 -2.920 9.893
358 HB2 ALA 50 HB2 ALA 50 -1.877 -4.360 9.683
359 HB3 ALA 50 HB3 ALA 50 -2.447 -3.034 10.695
360 H ARG 51 HN ARG 51 -0.867 -0.938 7.851
361 HA ARG 51 HA ARG 51 -1.625 1.325 9.297
362 HB2 ARG 51 HB2 ARG 51 -0.141 0.991 6.701
363 HB3 ARG 51 HB1 ARG 51 -0.441 2.571 7.392
364 HG2 ARG 51 HG2 ARG 51 1.103 0.340 8.680
365 HG3 ARG 51 HG1 ARG 51 1.779 1.796 7.950
366 HD2 ARG 51 HD2 ARG 51 -0.028 1.675 10.364
367 HD3 ARG 51 HD1 ARG 51 1.702 2.009 10.372
368 HE ARG 51 HE ARG 51 0.878 3.999 8.842
369 HH11 ARG 51 HH11 ARG 51 -0.527 2.750 11.782
370 HH12 ARG 51 HH12 ARG 51 -1.227 4.261 12.260
371 HH21 ARG 51 HH21 ARG 51 -0.008 6.019 9.448
372 HH22 ARG 51 HH22 ARG 51 -0.947 6.133 10.918
373 H LEU 52 HN LEU 52 -2.376 0.491 5.906
374 HA LEU 52 HA LEU 52 -3.983 2.770 5.443
375 HB2 LEU 52 HB2 LEU 52 -3.991 0.104 4.030
376 HB3 LEU 52 HB1 LEU 52 -4.768 1.560 3.442
377 HG LEU 52 HG LEU 52 -1.798 1.279 3.891
378 HD11 LEU 52 HD11 LEU 52 -3.406 1.204 1.346
379 HD12 LEU 52 HD12 LEU 52 -2.551 -0.156 2.077
380 HD13 LEU 52 HD13 LEU 52 -1.646 1.225 1.450
381 HD21 LEU 52 HD21 LEU 52 -2.664 3.571 4.117
382 HD22 LEU 52 HD22 LEU 52 -3.413 3.431 2.526
383 HD23 LEU 52 HD23 LEU 52 -1.657 3.382 2.680
384 H GLU 53 HN GLU 53 -4.772 -0.543 6.397
385 HA GLU 53 HA GLU 53 -7.545 -0.366 6.197
386 HB2 GLU 53 HB2 GLU 53 -5.888 -1.979 8.135
387 HB3 GLU 53 HB1 GLU 53 -7.598 -2.232 7.824
388 HG2 GLU 53 HG2 GLU 53 -7.141 -2.825 5.539
389 HG3 GLU 53 HG1 GLU 53 -5.431 -2.455 5.754
390 H SER 54 HN SER 54 -5.515 0.072 9.085
391 HA SER 54 HA SER 54 -7.662 0.829 10.761
392 HB2 SER 54 HB2 SER 54 -4.721 1.418 11.152
393 HB3 SER 54 HB1 SER 54 -5.966 1.335 12.402
394 HG SER 54 HG SER 54 -4.805 -0.747 10.896
395 H ARG 55 HN ARG 55 -5.651 2.594 8.570
396 HA ARG 55 HA ARG 55 -5.913 5.156 9.787
397 HB2 ARG 55 HB2 ARG 55 -4.069 4.468 8.228
398 HB3 ARG 55 HB1 ARG 55 -5.231 4.536 6.909
399 HG2 ARG 55 HG2 ARG 55 -5.586 6.906 7.335
400 HG3 ARG 55 HG1 ARG 55 -4.429 6.844 8.667
401 HD2 ARG 55 HD2 ARG 55 -2.654 6.240 7.134
402 HD3 ARG 55 HD1 ARG 55 -3.798 6.189 5.793
403 HE ARG 55 HE ARG 55 -3.268 8.677 7.292
404 HH11 ARG 55 HH11 ARG 55 -3.438 6.927 4.266
405 HH12 ARG 55 HH12 ARG 55 -3.311 8.359 3.294
406 HH21 ARG 55 HH21 ARG 55 -3.116 10.560 5.980
407 HH22 ARG 55 HH22 ARG 55 -3.143 10.395 4.245
408 H TYR 56 HN TYR 56 -7.526 3.585 7.027
409 HA TYR 56 HA TYR 56 -9.290 5.898 6.746
410 HB2 TYR 56 HB2 TYR 56 -8.995 3.401 5.069
411 HB3 TYR 56 HB1 TYR 56 -10.114 4.710 4.718
412 HD1 TYR 56 HD2 TYR 56 -9.277 6.895 3.976
413 HD2 TYR 56 HD1 TYR 56 -6.649 3.610 4.615
414 HE1 TYR 56 HE2 TYR 56 -7.535 8.042 2.679
415 HE2 TYR 56 HE1 TYR 56 -4.903 4.751 3.318
416 HH TYR 56 HH TYR 56 -5.211 8.048 2.353
417 H GLY 57 HN GLY 57 -9.277 2.762 8.113
418 HA2 GLY 57 HA2 GLY 57 -10.966 1.828 9.446
419 HA3 GLY 57 HA1 GLY 57 -12.107 2.990 8.777
420 H VAL 58 HN VAL 58 -9.926 0.638 7.261
421 HA VAL 58 HA VAL 58 -12.274 -0.580 5.963
422 HB VAL 58 HB VAL 58 -11.025 -0.917 3.920
423 HG11 VAL 58 HG11 VAL 58 -12.213 1.187 4.102
424 HG12 VAL 58 HG12 VAL 58 -10.732 1.392 3.167
425 HG13 VAL 58 HG13 VAL 58 -10.798 1.940 4.842
426 HG21 VAL 58 HG21 VAL 58 -8.728 0.471 5.295
427 HG22 VAL 58 HG22 VAL 58 -8.785 0.036 3.586
428 HG23 VAL 58 HG23 VAL 58 -8.796 -1.226 4.818
429 H SER 59 HN SER 59 -11.207 -2.692 4.741
430 HA SER 59 HA SER 59 -9.260 -4.036 6.390
431 HB2 SER 59 HB2 SER 59 -12.046 -5.152 5.977
432 HB3 SER 59 HB1 SER 59 -10.696 -6.023 6.700
433 HG SER 59 HG SER 59 -10.935 -3.687 7.949
434 H ILE 60 HN ILE 60 -7.987 -5.320 5.166
435 HA ILE 60 HA ILE 60 -8.683 -5.519 2.329
436 HB ILE 60 HB ILE 60 -6.059 -6.101 3.717
437 HG12 ILE 60 HG12 ILE 60 -6.919 -3.742 2.025
438 HG13 ILE 60 HG11 ILE 60 -6.729 -3.722 3.773
439 HG21 ILE 60 HG21 ILE 60 -6.779 -6.004 0.791
440 HG22 ILE 60 HG22 ILE 60 -6.223 -7.409 1.702
441 HG23 ILE 60 HG23 ILE 60 -5.130 -6.054 1.409
442 HD11 ILE 60 HD11 ILE 60 -4.822 -2.706 2.724
443 HD12 ILE 60 HD12 ILE 60 -4.557 -4.145 1.739
444 HD13 ILE 60 HD13 ILE 60 -4.336 -4.222 3.488
445 HA PRO 61 HA PRO 61 -10.099 -9.710 2.846
446 HB2 PRO 61 HB2 PRO 61 -9.391 -9.840 -0.036
447 HB3 PRO 61 HB1 PRO 61 -10.908 -10.250 0.771
448 HG2 PRO 61 HG2 PRO 61 -10.686 -8.007 -0.653
449 HG3 PRO 61 HG1 PRO 61 -11.616 -8.045 0.858
450 HD2 PRO 61 HD2 PRO 61 -8.885 -6.941 0.333
451 HD3 PRO 61 HD1 PRO 61 -10.167 -6.316 1.388
452 H ASP 62 HN ASP 62 -9.076 -11.534 3.347
453 HA ASP 62 HA ASP 62 -6.345 -11.539 3.745
454 HB2 ASP 62 HB2 ASP 62 -8.233 -13.893 3.584
455 HB3 ASP 62 HB1 ASP 62 -6.598 -13.970 4.234
456 H ASP 63 HN ASP 63 -8.128 -13.369 1.253
457 HA ASP 63 HA ASP 63 -5.672 -14.407 0.177
458 HB2 ASP 63 HB2 ASP 63 -8.526 -14.626 -0.791
459 HB3 ASP 63 HB1 ASP 63 -7.162 -15.449 -1.540
460 H VAL 64 HN VAL 64 -7.851 -11.808 -0.600
461 HA VAL 64 HA VAL 64 -6.839 -11.386 -3.241
462 HB VAL 64 HB VAL 64 -8.398 -9.429 -1.532
463 HG11 VAL 64 HG11 VAL 64 -7.330 -8.405 -3.475
464 HG12 VAL 64 HG12 VAL 64 -9.081 -8.457 -3.671
465 HG13 VAL 64 HG13 VAL 64 -8.061 -9.615 -4.526
466 HG21 VAL 64 HG21 VAL 64 -9.388 -11.550 -3.440
467 HG22 VAL 64 HG22 VAL 64 -10.391 -10.285 -2.733
468 HG23 VAL 64 HG23 VAL 64 -9.643 -11.497 -1.694
469 H ALA 65 HN ALA 65 -5.810 -10.545 -0.091
470 HA ALA 65 HA ALA 65 -4.368 -8.195 -0.589
471 HB1 ALA 65 HB1 ALA 65 -3.133 -8.721 1.446
472 HB2 ALA 65 HB2 ALA 65 -3.762 -10.369 1.409
473 HB3 ALA 65 HB3 ALA 65 -4.859 -9.011 1.660
474 H GLY 66 HN GLY 66 -3.655 -11.528 -1.240
475 HA2 GLY 66 HA2 GLY 66 -0.876 -10.962 -1.915
476 HA3 GLY 66 HA1 GLY 66 -1.652 -12.538 -1.928
477 H ARG 67 HN ARG 67 -3.300 -9.951 -3.468
478 HA ARG 67 HA ARG 67 -2.508 -11.036 -6.093
479 HB2 ARG 67 HB2 ARG 67 -5.175 -9.902 -5.226
480 HB3 ARG 67 HB1 ARG 67 -4.780 -10.397 -6.866
481 HG2 ARG 67 HG2 ARG 67 -4.743 -12.260 -4.496
482 HG3 ARG 67 HG1 ARG 67 -6.134 -12.035 -5.555
483 HD2 ARG 67 HD2 ARG 67 -4.999 -13.971 -6.314
484 HD3 ARG 67 HD1 ARG 67 -4.658 -12.695 -7.477
485 HE ARG 67 HE ARG 67 -2.626 -12.834 -5.497
486 HH11 ARG 67 HH11 ARG 67 -3.795 -14.462 -8.370
487 HH12 ARG 67 HH12 ARG 67 -2.237 -15.122 -8.774
488 HH21 ARG 67 HH21 ARG 67 -0.586 -13.718 -6.037
489 HH22 ARG 67 HH22 ARG 67 -0.434 -14.694 -7.465
490 H VAL 68 HN VAL 68 -1.336 -8.778 -4.563
491 HA VAL 68 HA VAL 68 -1.695 -6.717 -6.616
492 HB VAL 68 HB VAL 68 -1.498 -4.951 -4.820
493 HG11 VAL 68 HG11 VAL 68 -3.617 -5.420 -5.928
494 HG12 VAL 68 HG12 VAL 68 -3.878 -5.018 -4.230
495 HG13 VAL 68 HG13 VAL 68 -3.957 -6.697 -4.761
496 HG21 VAL 68 HG21 VAL 68 -2.226 -7.236 -2.979
497 HG22 VAL 68 HG22 VAL 68 -2.136 -5.531 -2.538
498 HG23 VAL 68 HG23 VAL 68 -0.674 -6.398 -3.009
499 H ASP 69 HN ASP 69 0.231 -6.704 -7.581
500 HA ASP 69 HA ASP 69 2.658 -7.115 -6.021
501 HB2 ASP 69 HB2 ASP 69 2.205 -6.863 -9.000
502 HB3 ASP 69 HB1 ASP 69 3.787 -7.089 -8.260
503 H THR 70 HN THR 70 1.173 -4.645 -8.067
504 HA THR 70 HA THR 70 3.300 -2.783 -7.277
505 HB THR 70 HB THR 70 2.503 -1.359 -9.142
506 HG1 THR 70 HG1 THR 70 0.933 -2.145 -10.543
507 HG21 THR 70 HG21 THR 70 3.151 -4.196 -9.944
508 HG22 THR 70 HG22 THR 70 4.321 -2.948 -9.513
509 HG23 THR 70 HG23 THR 70 3.331 -2.766 -10.961
510 HA PRO 71 HA PRO 71 0.697 -0.512 -4.482
511 HB2 PRO 71 HB2 PRO 71 2.015 1.807 -5.829
512 HB3 PRO 71 HB1 PRO 71 1.820 1.474 -4.107
513 HG2 PRO 71 HG2 PRO 71 4.162 1.064 -5.247
514 HG3 PRO 71 HG1 PRO 71 3.523 -0.125 -4.093
515 HD2 PRO 71 HD2 PRO 71 3.624 -0.238 -7.079
516 HD3 PRO 71 HD1 PRO 71 3.891 -1.532 -5.891
517 H ARG 72 HN ARG 72 0.934 0.463 -7.873
518 HA ARG 72 HA ARG 72 -1.210 2.212 -8.041
519 HB2 ARG 72 HB2 ARG 72 0.396 1.702 -9.875
520 HB3 ARG 72 HB1 ARG 72 -0.445 0.183 -10.143
521 HG2 ARG 72 HG2 ARG 72 -2.540 1.593 -10.475
522 HG3 ARG 72 HG1 ARG 72 -1.453 2.976 -10.574
523 HD2 ARG 72 HD2 ARG 72 -1.295 0.526 -12.319
524 HD3 ARG 72 HD1 ARG 72 -2.071 2.040 -12.776
525 HE ARG 72 HE ARG 72 0.666 2.374 -11.969
526 HH11 ARG 72 HH11 ARG 72 -1.462 1.568 -14.621
527 HH12 ARG 72 HH12 ARG 72 -0.315 1.992 -15.855
528 HH21 ARG 72 HH21 ARG 72 2.192 2.958 -13.588
529 HH22 ARG 72 HH22 ARG 72 1.747 2.809 -15.268
530 H GLU 73 HN GLU 73 -1.224 -1.305 -8.562
531 HA GLU 73 HA GLU 73 -4.022 -1.482 -8.981
532 HB2 GLU 73 HB2 GLU 73 -2.217 -3.704 -8.006
533 HB3 GLU 73 HB1 GLU 73 -3.736 -3.866 -8.870
534 HG2 GLU 73 HG2 GLU 73 -1.109 -2.887 -9.942
535 HG3 GLU 73 HG1 GLU 73 -1.994 -4.342 -10.398
536 H LEU 74 HN LEU 74 -1.963 -1.932 -6.153
537 HA LEU 74 HA LEU 74 -3.891 -2.865 -4.354
538 HB2 LEU 74 HB2 LEU 74 -1.411 -2.844 -4.015
539 HB3 LEU 74 HB1 LEU 74 -1.498 -1.117 -3.754
540 HG LEU 74 HG LEU 74 -1.324 -2.679 -1.710
541 HD11 LEU 74 HD11 LEU 74 -3.468 -0.560 -1.826
542 HD12 LEU 74 HD12 LEU 74 -1.752 -0.298 -1.517
543 HD13 LEU 74 HD13 LEU 74 -2.730 -1.196 -0.356
544 HD21 LEU 74 HD21 LEU 74 -3.056 -4.251 -2.353
545 HD22 LEU 74 HD22 LEU 74 -4.260 -2.964 -2.332
546 HD23 LEU 74 HD23 LEU 74 -3.473 -3.461 -0.833
547 H LEU 75 HN LEU 75 -2.857 0.428 -5.119
548 HA LEU 75 HA LEU 75 -4.493 1.823 -3.348
549 HB2 LEU 75 HB2 LEU 75 -2.613 2.752 -4.699
550 HB3 LEU 75 HB1 LEU 75 -3.631 2.666 -6.118
551 HG LEU 75 HG LEU 75 -4.518 4.288 -3.755
552 HD11 LEU 75 HD11 LEU 75 -2.611 5.192 -5.911
553 HD12 LEU 75 HD12 LEU 75 -2.230 5.001 -4.200
554 HD13 LEU 75 HD13 LEU 75 -3.383 6.232 -4.713
555 HD21 LEU 75 HD21 LEU 75 -4.921 4.557 -6.735
556 HD22 LEU 75 HD22 LEU 75 -5.613 5.608 -5.499
557 HD23 LEU 75 HD23 LEU 75 -6.095 3.915 -5.586
558 H ASP 76 HN ASP 76 -5.118 0.728 -6.664
559 HA ASP 76 HA ASP 76 -7.693 1.907 -6.888
560 HB2 ASP 76 HB2 ASP 76 -6.310 1.199 -8.840
561 HB3 ASP 76 HB1 ASP 76 -6.617 -0.479 -8.406
562 H LEU 77 HN LEU 77 -6.566 -1.246 -5.824
563 HA LEU 77 HA LEU 77 -9.014 -2.592 -5.793
564 HB2 LEU 77 HB2 LEU 77 -6.835 -3.693 -5.534
565 HB3 LEU 77 HB1 LEU 77 -6.639 -2.943 -3.963
566 HG LEU 77 HG LEU 77 -8.618 -4.211 -3.152
567 HD11 LEU 77 HD11 LEU 77 -9.733 -4.546 -5.300
568 HD12 LEU 77 HD12 LEU 77 -9.450 -6.083 -4.484
569 HD13 LEU 77 HD13 LEU 77 -8.417 -5.594 -5.827
570 HD21 LEU 77 HD21 LEU 77 -7.475 -6.357 -3.004
571 HD22 LEU 77 HD22 LEU 77 -6.346 -5.021 -2.776
572 HD23 LEU 77 HD23 LEU 77 -6.395 -5.883 -4.314
573 H ILE 78 HN ILE 78 -7.401 -0.767 -3.203
574 HA ILE 78 HA ILE 78 -9.480 -1.185 -1.317
575 HB ILE 78 HB ILE 78 -7.326 0.930 -1.387
576 HG12 ILE 78 HG12 ILE 78 -7.548 -1.708 0.083
577 HG13 ILE 78 HG11 ILE 78 -6.468 -1.354 -1.261
578 HG21 ILE 78 HG21 ILE 78 -7.800 1.260 0.999
579 HG22 ILE 78 HG22 ILE 78 -9.159 0.141 0.879
580 HG23 ILE 78 HG23 ILE 78 -9.195 1.669 -0.002
581 HD11 ILE 78 HD11 ILE 78 -5.303 0.292 0.128
582 HD12 ILE 78 HD12 ILE 78 -5.260 -1.324 0.829
583 HD13 ILE 78 HD13 ILE 78 -6.364 -0.111 1.480
584 H ASN 79 HN ASN 79 -8.802 1.365 -3.659
585 HA ASN 79 HA ASN 79 -10.850 3.140 -2.856
586 HB2 ASN 79 HB2 ASN 79 -9.207 2.779 -5.311
587 HB3 ASN 79 HB1 ASN 79 -10.675 3.741 -5.451
588 HD21 ASN 79 HD21 ASN 79 -7.525 3.514 -3.997
589 HD22 ASN 79 HD22 ASN 79 -7.427 5.169 -3.492
590 H GLY 80 HN GLY 80 -10.804 0.394 -5.072
591 HA2 GLY 80 HA2 GLY 80 -13.411 0.711 -6.114
592 HA3 GLY 80 HA1 GLY 80 -12.499 -0.790 -6.063
593 H ALA 81 HN ALA 81 -12.208 -0.870 -3.212
594 HA ALA 81 HA ALA 81 -14.689 -2.096 -2.515
595 HB1 ALA 81 HB1 ALA 81 -12.322 -1.440 -0.760
596 HB2 ALA 81 HB2 ALA 81 -12.533 -2.928 -1.681
597 HB3 ALA 81 HB3 ALA 81 -13.638 -2.544 -0.362
598 H LEU 82 HN LEU 82 -13.251 1.035 -1.995
599 HA LEU 82 HA LEU 82 -15.151 1.848 0.010
600 HB2 LEU 82 HB2 LEU 82 -13.191 3.419 -1.665
601 HB3 LEU 82 HB1 LEU 82 -14.202 4.130 -0.421
602 HG LEU 82 HG LEU 82 -12.113 1.996 0.043
603 HD11 LEU 82 HD11 LEU 82 -10.860 3.774 1.162
604 HD12 LEU 82 HD12 LEU 82 -12.086 4.944 0.675
605 HD13 LEU 82 HD13 LEU 82 -11.112 4.129 -0.548
606 HD21 LEU 82 HD21 LEU 82 -12.515 2.449 2.415
607 HD22 LEU 82 HD22 LEU 82 -13.967 1.846 1.616
608 HD23 LEU 82 HD23 LEU 82 -13.811 3.565 1.984
609 H ALA 83 HN ALA 83 -14.755 2.255 -3.470
610 HA ALA 83 HA ALA 83 -16.906 4.021 -3.896
611 HB1 ALA 83 HB1 ALA 83 -16.754 3.394 -6.228
612 HB2 ALA 83 HB2 ALA 83 -15.792 1.975 -5.811
613 HB3 ALA 83 HB3 ALA 83 -15.136 3.592 -5.553
614 H GLU 84 HN GLU 84 -16.852 0.767 -3.011
615 HA GLU 84 HA GLU 84 -19.261 -0.203 -4.080
616 HB2 GLU 84 HB2 GLU 84 -17.626 -1.656 -3.013
617 HB3 GLU 84 HB1 GLU 84 -17.839 -0.820 -1.482
618 HG2 GLU 84 HG2 GLU 84 -18.987 -2.895 -1.372
619 HG3 GLU 84 HG1 GLU 84 -20.189 -1.608 -1.445
620 H ALA 85 HN ALA 85 -18.565 1.394 -0.971
621 HA ALA 85 HA ALA 85 -21.455 1.600 -0.472
622 HB1 ALA 85 HB1 ALA 85 -19.143 1.861 1.452
623 HB2 ALA 85 HB2 ALA 85 -20.175 0.444 1.253
624 HB3 ALA 85 HB3 ALA 85 -20.853 1.947 1.876
625 H ALA 86 HN ALA 86 -19.175 3.424 -1.839
626 HA ALA 86 HA ALA 86 -20.150 5.916 -0.621
627 HB1 ALA 86 HB1 ALA 86 -17.505 5.455 -1.992
628 HB2 ALA 86 HB2 ALA 86 -17.755 5.588 -0.251
629 HB3 ALA 86 HB3 ALA 86 -18.062 6.975 -1.293
630 H28 SXO 87 H28B SXO 87 6.475 -12.127 6.976
631 H28A SXO 87 H28A SXO 87 7.312 -13.186 8.115
632 H30 SXO 87 H30A SXO 87 4.914 -12.956 9.078
633 H30A SXO 87 H30C SXO 87 4.267 -12.281 7.584
634 H30B SXO 87 H30B SXO 87 3.588 -13.768 8.246
635 H31 SXO 87 H31A SXO 87 4.681 -13.389 5.424
636 H31A SXO 87 H31B SXO 87 4.043 -14.922 6.018
637 H31B SXO 87 H31C SXO 87 5.673 -14.844 5.345
638 H32 SXO 87 H32A SXO 87 5.995 -15.157 9.082
639 HO33 SXO 87 H33A SXO 87 6.685 -16.855 7.119
640 HN36 SXO 87 H36A SXO 87 3.503 -15.181 9.112
641 H37 SXO 87 H37A SXO 87 2.432 -17.649 7.898
642 H37A SXO 87 H37B SXO 87 2.101 -17.179 9.568
643 H38 SXO 87 H38B SXO 87 0.914 -15.206 8.804
644 H38A SXO 87 H38A SXO 87 0.224 -16.650 8.063
645 HN41 SXO 87 H41A SXO 87 0.385 -13.740 7.351
646 H42 SXO 87 H42A SXO 87 1.963 -13.457 5.000
647 H42A SXO 87 H42B SXO 87 0.271 -13.780 4.611
648 H43 SXO 87 H43B SXO 87 -0.447 -11.770 5.606
649 H43A SXO 87 H43A SXO 87 1.061 -11.598 6.524
650 H2 SXO 87 H2A SXO 87 0.016 -11.227 0.900
651 H2A SXO 87 H2B SXO 87 1.707 -11.286 1.396
652 H3 SXO 87 H3B SXO 87 1.552 -9.060 2.332
653 H3A SXO 87 H3A SXO 87 1.025 -9.043 0.648
654 H4 SXO 87 H4A SXO 87 -0.798 -9.127 3.055
655 H4A SXO 87 H4B SXO 87 -1.309 -9.078 1.368
656 H5 SXO 87 H5B SXO 87 -1.446 -6.866 2.411
657 H5A SXO 87 H5A SXO 87 0.276 -6.938 2.793
658 H6 SXO 87 H6A SXO 87 -0.921 -7.000 0.019
659 H6A SXO 87 H6B SXO 87 0.802 -7.047 0.403
660 H7 SXO 87 H7A SXO 87 0.177 -4.791 -0.236
661 H7A SXO 87 H7B SXO 87 0.576 -4.822 1.491
662 H8 SXO 87 H8C SXO 87 -1.808 -4.961 2.023
663 H8A SXO 87 H8A SXO 87 -2.196 -4.921 0.301
664 H8B SXO 87 H8B SXO 87 -1.450 -3.522 1.073
Start of MODEL 19
1 H1 MET 1 HT1 MET 1 -18.615 14.656 0.836
2 H2 MET 1 HT2 MET 1 -18.915 13.200 0.021
3 H3 MET 1 HT3 MET 1 -18.816 14.649 -0.850
4 HA MET 1 HA MET 1 -16.826 13.371 -1.139
5 HB2 MET 1 HB2 MET 1 -15.199 15.062 -0.460
6 HB3 MET 1 HB1 MET 1 -16.643 15.811 -1.118
7 HG2 MET 1 HG2 MET 1 -17.419 16.247 1.181
8 HG3 MET 1 HG1 MET 1 -15.901 15.581 1.786
9 HE1 MET 1 HE1 MET 1 -16.475 17.773 -1.450
10 HE2 MET 1 HE2 MET 1 -16.160 19.391 -0.824
11 HE3 MET 1 HE3 MET 1 -17.580 18.497 -0.282
12 H ALA 2 HN ALA 2 -15.161 12.166 -0.315
13 HA ALA 2 HA ALA 2 -15.016 11.804 2.579
14 HB1 ALA 2 HB1 ALA 2 -15.124 9.377 2.395
15 HB2 ALA 2 HB2 ALA 2 -15.405 9.507 0.659
16 HB3 ALA 2 HB3 ALA 2 -16.611 10.112 1.794
17 H THR 3 HN THR 3 -13.030 10.911 3.280
18 HA THR 3 HA THR 3 -10.809 11.590 1.613
19 HB THR 3 HB THR 3 -9.490 10.541 3.536
20 HG1 THR 3 HG1 THR 3 -11.377 9.259 4.221
21 HG21 THR 3 HG21 THR 3 -9.896 12.950 3.326
22 HG22 THR 3 HG22 THR 3 -9.915 12.439 5.015
23 HG23 THR 3 HG23 THR 3 -11.430 12.770 4.173
24 H LEU 4 HN LEU 4 -10.480 10.329 -0.110
25 HA LEU 4 HA LEU 4 -10.615 7.439 0.037
26 HB2 LEU 4 HB2 LEU 4 -9.769 9.290 -2.196
27 HB3 LEU 4 HB1 LEU 4 -9.902 7.551 -2.341
28 HG LEU 4 HG LEU 4 -12.191 9.441 -1.776
29 HD11 LEU 4 HD11 LEU 4 -11.481 7.880 -4.254
30 HD12 LEU 4 HD12 LEU 4 -11.373 9.630 -4.059
31 HD13 LEU 4 HD13 LEU 4 -12.947 8.831 -4.018
32 HD21 LEU 4 HD21 LEU 4 -13.603 7.464 -2.090
33 HD22 LEU 4 HD22 LEU 4 -12.518 7.279 -0.709
34 HD23 LEU 4 HD23 LEU 4 -12.160 6.461 -2.231
35 H LEU 5 HN LEU 5 -8.647 6.286 -1.097
36 HA LEU 5 HA LEU 5 -6.257 7.100 0.369
37 HB2 LEU 5 HB2 LEU 5 -7.146 4.709 0.257
38 HB3 LEU 5 HB1 LEU 5 -6.627 4.690 -1.413
39 HG LEU 5 HG LEU 5 -4.709 5.214 0.854
40 HD11 LEU 5 HD11 LEU 5 -4.113 2.843 0.709
41 HD12 LEU 5 HD12 LEU 5 -5.441 2.581 -0.420
42 HD13 LEU 5 HD13 LEU 5 -5.778 3.066 1.243
43 HD21 LEU 5 HD21 LEU 5 -3.973 5.830 -1.426
44 HD22 LEU 5 HD22 LEU 5 -4.269 4.170 -1.946
45 HD23 LEU 5 HD23 LEU 5 -3.028 4.510 -0.740
46 H THR 6 HN THR 6 -4.723 8.322 -0.616
47 HA THR 6 HA THR 6 -4.738 8.365 -3.562
48 HB THR 6 HB THR 6 -5.433 10.510 -2.495
49 HG1 THR 6 HG1 THR 6 -3.395 11.632 -3.611
50 HG21 THR 6 HG21 THR 6 -3.739 11.898 -1.401
51 HG22 THR 6 HG22 THR 6 -2.580 10.577 -1.518
52 HG23 THR 6 HG23 THR 6 -4.011 10.404 -0.503
53 H THR 7 HN THR 7 -2.604 9.151 -4.471
54 HA THR 7 HA THR 7 -0.630 7.249 -4.008
55 HB THR 7 HB THR 7 0.805 9.065 -5.281
56 HG1 THR 7 HG1 THR 7 -0.313 10.865 -5.520
57 HG21 THR 7 HG21 THR 7 -0.194 8.315 -7.385
58 HG22 THR 7 HG22 THR 7 -1.610 7.734 -6.510
59 HG23 THR 7 HG23 THR 7 -0.043 6.973 -6.247
60 H ASP 8 HN ASP 8 -0.934 10.551 -2.807
61 HA ASP 8 HA ASP 8 1.613 10.823 -1.668
62 HB2 ASP 8 HB2 ASP 8 -0.977 12.047 -0.690
63 HB3 ASP 8 HB1 ASP 8 0.647 12.627 -0.334
64 H ASP 9 HN ASP 9 -1.427 9.652 -0.271
65 HA ASP 9 HA ASP 9 -0.423 9.163 2.318
66 HB2 ASP 9 HB2 ASP 9 -2.775 7.983 0.844
67 HB3 ASP 9 HB1 ASP 9 -2.404 7.616 2.526
68 H LEU 10 HN LEU 10 -0.645 7.152 -0.560
69 HA LEU 10 HA LEU 10 0.108 4.731 0.621
70 HB2 LEU 10 HB2 LEU 10 -0.807 5.121 -1.701
71 HB3 LEU 10 HB1 LEU 10 0.805 5.624 -2.168
72 HG LEU 10 HG LEU 10 1.678 3.403 -1.645
73 HD11 LEU 10 HD11 LEU 10 0.151 1.580 -1.069
74 HD12 LEU 10 HD12 LEU 10 -1.183 2.727 -0.970
75 HD13 LEU 10 HD13 LEU 10 0.155 2.830 0.174
76 HD21 LEU 10 HD21 LEU 10 0.579 2.174 -3.436
77 HD22 LEU 10 HD22 LEU 10 0.815 3.861 -3.897
78 HD23 LEU 10 HD23 LEU 10 -0.778 3.298 -3.391
79 H ARG 11 HN ARG 11 2.065 7.288 -0.872
80 HA ARG 11 HA ARG 11 4.580 6.137 -0.573
81 HB2 ARG 11 HB2 ARG 11 4.387 8.094 -1.906
82 HB3 ARG 11 HB1 ARG 11 3.699 9.018 -0.579
83 HG2 ARG 11 HG2 ARG 11 5.783 9.135 0.539
84 HG3 ARG 11 HG1 ARG 11 6.495 7.927 -0.530
85 HD2 ARG 11 HD2 ARG 11 7.191 10.270 -1.021
86 HD3 ARG 11 HD1 ARG 11 6.455 9.428 -2.380
87 HE ARG 11 HE ARG 11 4.348 10.709 -1.490
88 HH11 ARG 11 HH11 ARG 11 7.633 11.882 -1.643
89 HH12 ARG 11 HH12 ARG 11 7.184 13.517 -2.014
90 HH21 ARG 11 HH21 ARG 11 3.736 12.872 -2.037
91 HH22 ARG 11 HH22 ARG 11 4.974 14.066 -2.263
92 H ARG 12 HN ARG 12 2.833 8.236 1.732
93 HA ARG 12 HA ARG 12 4.975 8.231 3.604
94 HB2 ARG 12 HB2 ARG 12 3.304 9.253 5.168
95 HB3 ARG 12 HB1 ARG 12 3.514 10.104 3.643
96 HG2 ARG 12 HG2 ARG 12 1.487 9.116 2.782
97 HG3 ARG 12 HG1 ARG 12 1.270 8.202 4.272
98 HD2 ARG 12 HD2 ARG 12 1.378 11.208 4.148
99 HD3 ARG 12 HD1 ARG 12 -0.119 10.279 4.099
100 HE ARG 12 HE ARG 12 1.171 9.387 6.345
101 HH11 ARG 12 HH11 ARG 12 0.061 12.494 5.166
102 HH12 ARG 12 HH12 ARG 12 -0.148 13.175 6.744
103 HH21 ARG 12 HH21 ARG 12 0.866 10.247 8.433
104 HH22 ARG 12 HH22 ARG 12 0.281 11.880 8.618
105 H ALA 13 HN ALA 13 2.225 6.167 3.097
106 HA ALA 13 HA ALA 13 1.938 5.135 5.686
107 HB1 ALA 13 HB1 ALA 13 0.676 3.338 4.680
108 HB2 ALA 13 HB2 ALA 13 1.344 3.717 3.094
109 HB3 ALA 13 HB3 ALA 13 0.266 4.862 3.892
110 H LEU 14 HN LEU 14 4.049 4.170 3.035
111 HA LEU 14 HA LEU 14 4.973 1.753 4.186
112 HB2 LEU 14 HB2 LEU 14 6.010 3.583 2.056
113 HB3 LEU 14 HB1 LEU 14 7.021 2.282 2.650
114 HG LEU 14 HG LEU 14 5.907 1.595 0.616
115 HD11 LEU 14 HD11 LEU 14 4.812 -0.449 1.397
116 HD12 LEU 14 HD12 LEU 14 4.739 0.219 3.029
117 HD13 LEU 14 HD13 LEU 14 6.300 -0.121 2.283
118 HD21 LEU 14 HD21 LEU 14 3.321 2.142 2.061
119 HD22 LEU 14 HD22 LEU 14 3.481 1.382 0.478
120 HD23 LEU 14 HD23 LEU 14 3.968 3.063 0.704
121 H VAL 15 HN VAL 15 5.802 5.077 4.673
122 HA VAL 15 HA VAL 15 8.252 4.470 6.106
123 HB VAL 15 HB VAL 15 6.817 7.116 5.832
124 HG11 VAL 15 HG11 VAL 15 8.989 8.096 6.385
125 HG12 VAL 15 HG12 VAL 15 9.667 6.482 6.584
126 HG13 VAL 15 HG13 VAL 15 8.407 7.049 7.681
127 HG21 VAL 15 HG21 VAL 15 7.392 6.198 3.634
128 HG22 VAL 15 HG22 VAL 15 9.065 5.997 4.158
129 HG23 VAL 15 HG23 VAL 15 8.370 7.612 4.023
130 H GLU 16 HN GLU 16 4.923 5.293 6.758
131 HA GLU 16 HA GLU 16 5.313 5.802 9.552
132 HB2 GLU 16 HB2 GLU 16 2.785 5.370 7.950
133 HB3 GLU 16 HB1 GLU 16 2.835 5.889 9.632
134 HG2 GLU 16 HG2 GLU 16 4.015 7.912 8.996
135 HG3 GLU 16 HG1 GLU 16 4.037 7.389 7.312
136 H SER 17 HN SER 17 5.011 2.975 7.707
137 HA SER 17 HA SER 17 3.962 1.378 9.877
138 HB2 SER 17 HB2 SER 17 4.539 -0.533 8.292
139 HB3 SER 17 HB1 SER 17 3.341 0.624 7.710
140 HG SER 17 HG SER 17 4.916 0.165 6.117
141 H ALA 18 HN ALA 18 7.012 1.317 8.030
142 HA ALA 18 HA ALA 18 8.299 -0.164 10.161
143 HB1 ALA 18 HB1 ALA 18 9.428 0.838 7.551
144 HB2 ALA 18 HB2 ALA 18 8.719 -0.755 7.823
145 HB3 ALA 18 HB3 ALA 18 10.205 -0.298 8.655
146 H GLY 19 HN GLY 19 9.252 2.774 8.368
147 HA2 GLY 19 HA2 GLY 19 9.797 4.847 9.432
148 HA3 GLY 19 HA1 GLY 19 10.159 3.958 10.902
149 H GLU 20 HN GLU 20 11.843 5.891 9.601
150 HA GLU 20 HA GLU 20 14.012 6.234 9.081
151 HB2 GLU 20 HB2 GLU 20 14.232 3.407 10.114
152 HB3 GLU 20 HB1 GLU 20 15.633 4.323 9.594
153 HG2 GLU 20 HG2 GLU 20 15.047 6.069 11.254
154 HG3 GLU 20 HG1 GLU 20 13.764 5.011 11.839
155 H THR 21 HN THR 21 15.945 4.753 7.814
156 HA THR 21 HA THR 21 16.701 4.027 5.847
157 HB THR 21 HB THR 21 15.413 2.347 4.577
158 HG1 THR 21 HG1 THR 21 13.358 3.259 6.073
159 HG21 THR 21 HG21 THR 21 15.680 1.837 7.540
160 HG22 THR 21 HG22 THR 21 16.953 1.664 6.330
161 HG23 THR 21 HG23 THR 21 15.550 0.593 6.296
162 H ASP 22 HN ASP 22 15.958 6.469 5.728
163 HA ASP 22 HA ASP 22 14.171 7.007 3.529
164 HB2 ASP 22 HB2 ASP 22 16.081 8.845 4.996
165 HB3 ASP 22 HB1 ASP 22 14.893 9.359 3.807
166 H GLY 23 HN GLY 23 15.265 5.613 1.984
167 HA2 GLY 23 HA2 GLY 23 17.133 7.117 0.402
168 HA3 GLY 23 HA1 GLY 23 17.866 5.717 1.170
169 H THR 24 HN THR 24 14.922 6.521 -0.674
170 HA THR 24 HA THR 24 15.634 4.733 -2.765
171 HB THR 24 HB THR 24 14.735 3.123 -1.028
172 HG1 THR 24 HG1 THR 24 14.662 2.337 -3.051
173 HG21 THR 24 HG21 THR 24 12.947 4.562 -0.135
174 HG22 THR 24 HG22 THR 24 12.321 3.014 -0.700
175 HG23 THR 24 HG23 THR 24 12.106 4.461 -1.682
176 H ASP 25 HN ASP 25 13.654 4.573 -4.356
177 HA ASP 25 HA ASP 25 12.694 7.333 -4.527
178 HB2 ASP 25 HB2 ASP 25 13.248 5.251 -6.614
179 HB3 ASP 25 HB1 ASP 25 12.223 6.639 -6.972
180 H LEU 26 HN LEU 26 10.967 7.039 -3.106
181 HA LEU 26 HA LEU 26 8.672 5.565 -4.208
182 HB2 LEU 26 HB2 LEU 26 9.026 6.974 -1.553
183 HB3 LEU 26 HB1 LEU 26 7.588 6.106 -2.051
184 HG LEU 26 HG LEU 26 10.306 4.854 -1.635
185 HD11 LEU 26 HD11 LEU 26 7.822 4.758 0.066
186 HD12 LEU 26 HD12 LEU 26 9.313 5.619 0.455
187 HD13 LEU 26 HD13 LEU 26 9.313 3.859 0.350
188 HD21 LEU 26 HD21 LEU 26 9.087 2.737 -1.803
189 HD22 LEU 26 HD22 LEU 26 8.969 3.670 -3.295
190 HD23 LEU 26 HD23 LEU 26 7.607 3.620 -2.178
191 H SER 27 HN SER 27 10.090 8.276 -4.837
192 HA SER 27 HA SER 27 7.881 10.136 -4.426
193 HB2 SER 27 HB2 SER 27 9.815 11.709 -5.341
194 HB3 SER 27 HB1 SER 27 9.778 11.171 -3.659
195 HG SER 27 HG SER 27 11.612 10.635 -5.599
196 H GLY 28 HN GLY 28 8.193 8.008 -6.695
197 HA2 GLY 28 HA2 GLY 28 6.745 9.411 -8.603
198 HA3 GLY 28 HA1 GLY 28 8.428 9.524 -9.085
199 H ASP 29 HN ASP 29 5.805 8.051 -9.911
200 HA ASP 29 HA ASP 29 5.281 6.236 -11.142
201 HB2 ASP 29 HB2 ASP 29 8.250 6.395 -11.605
202 HB3 ASP 29 HB1 ASP 29 7.243 5.210 -12.429
203 H PHE 30 HN PHE 30 5.777 5.726 -8.332
204 HA PHE 30 HA PHE 30 7.180 3.205 -8.223
205 HB2 PHE 30 HB2 PHE 30 6.824 3.268 -5.828
206 HB3 PHE 30 HB1 PHE 30 7.383 4.841 -6.374
207 HD1 PHE 30 HD2 PHE 30 5.588 6.658 -6.735
208 HD2 PHE 30 HD1 PHE 30 4.925 3.076 -4.538
209 HE1 PHE 30 HE2 PHE 30 3.678 7.710 -5.601
210 HE2 PHE 30 HE1 PHE 30 3.016 4.124 -3.397
211 HZ PHE 30 HZ PHE 30 2.390 6.445 -3.927
212 H LEU 31 HN LEU 31 3.929 4.251 -8.630
213 HA LEU 31 HA LEU 31 2.516 2.069 -7.607
214 HB2 LEU 31 HB2 LEU 31 1.816 3.720 -10.035
215 HB3 LEU 31 HB1 LEU 31 0.725 2.654 -9.178
216 HG LEU 31 HG LEU 31 1.927 5.228 -8.169
217 HD11 LEU 31 HD11 LEU 31 0.010 5.475 -9.643
218 HD12 LEU 31 HD12 LEU 31 -0.421 5.891 -7.985
219 HD13 LEU 31 HD13 LEU 31 -0.910 4.336 -8.658
220 HD21 LEU 31 HD21 LEU 31 0.230 3.228 -6.673
221 HD22 LEU 31 HD22 LEU 31 0.718 4.819 -6.084
222 HD23 LEU 31 HD23 LEU 31 1.933 3.571 -6.368
223 H ASP 32 HN ASP 32 4.439 2.307 -10.481
224 HA ASP 32 HA ASP 32 3.276 -0.115 -11.629
225 HB2 ASP 32 HB2 ASP 32 3.641 1.677 -13.190
226 HB3 ASP 32 HB1 ASP 32 5.310 1.864 -12.669
227 H LEU 33 HN LEU 33 5.908 0.869 -9.719
228 HA LEU 33 HA LEU 33 7.596 -1.380 -10.416
229 HB2 LEU 33 HB2 LEU 33 7.874 0.660 -8.202
230 HB3 LEU 33 HB1 LEU 33 9.094 -0.501 -8.684
231 HG LEU 33 HG LEU 33 8.059 1.746 -10.423
232 HD11 LEU 33 HD11 LEU 33 10.673 1.447 -8.954
233 HD12 LEU 33 HD12 LEU 33 9.372 2.562 -8.535
234 HD13 LEU 33 HD13 LEU 33 10.246 2.755 -10.056
235 HD21 LEU 33 HD21 LEU 33 9.948 1.128 -11.874
236 HD22 LEU 33 HD22 LEU 33 8.760 -0.168 -11.728
237 HD23 LEU 33 HD23 LEU 33 10.278 -0.256 -10.832
238 H ARG 34 HN ARG 34 7.667 -3.278 -9.334
239 HA ARG 34 HA ARG 34 5.593 -3.921 -7.503
240 HB2 ARG 34 HB2 ARG 34 8.103 -5.491 -8.110
241 HB3 ARG 34 HB1 ARG 34 6.654 -6.112 -7.333
242 HG2 ARG 34 HG2 ARG 34 5.400 -5.629 -9.424
243 HG3 ARG 34 HG1 ARG 34 6.932 -5.188 -10.186
244 HD2 ARG 34 HD2 ARG 34 7.777 -7.469 -9.529
245 HD3 ARG 34 HD1 ARG 34 6.123 -7.866 -9.073
246 HE ARG 34 HE ARG 34 6.545 -6.898 -11.791
247 HH11 ARG 34 HH11 ARG 34 5.876 -9.598 -9.646
248 HH12 ARG 34 HH12 ARG 34 5.595 -10.707 -10.952
249 HH21 ARG 34 HH21 ARG 34 6.146 -8.362 -13.484
250 HH22 ARG 34 HH22 ARG 34 5.771 -10.022 -13.124
251 H PHE 35 HN PHE 35 5.795 -4.553 -5.296
252 HA PHE 35 HA PHE 35 7.303 -2.937 -3.626
253 HB2 PHE 35 HB2 PHE 35 6.317 -5.726 -2.973
254 HB3 PHE 35 HB1 PHE 35 6.711 -4.458 -1.817
255 HD1 PHE 35 HD2 PHE 35 5.389 -2.206 -2.187
256 HD2 PHE 35 HD1 PHE 35 4.117 -6.028 -3.551
257 HE1 PHE 35 HE2 PHE 35 3.067 -1.395 -2.273
258 HE2 PHE 35 HE1 PHE 35 1.792 -5.229 -3.643
259 HZ PHE 35 HZ PHE 35 1.262 -2.914 -3.012
260 H GLU 36 HN GLU 36 8.188 -5.859 -5.227
261 HA GLU 36 HA GLU 36 10.471 -6.649 -3.850
262 HB2 GLU 36 HB2 GLU 36 9.793 -6.768 -6.791
263 HB3 GLU 36 HB1 GLU 36 11.157 -7.604 -6.065
264 HG2 GLU 36 HG2 GLU 36 8.334 -8.041 -5.144
265 HG3 GLU 36 HG1 GLU 36 9.060 -8.955 -6.468
266 H ASP 37 HN ASP 37 10.020 -4.048 -6.191
267 HA ASP 37 HA ASP 37 12.877 -3.729 -6.587
268 HB2 ASP 37 HB2 ASP 37 11.382 -3.455 -8.509
269 HB3 ASP 37 HB1 ASP 37 10.552 -2.137 -7.687
270 H ILE 38 HN ILE 38 10.321 -2.266 -4.745
271 HA ILE 38 HA ILE 38 11.984 0.017 -4.061
272 HB ILE 38 HB ILE 38 10.049 0.725 -2.640
273 HG12 ILE 38 HG12 ILE 38 8.680 -1.617 -3.981
274 HG13 ILE 38 HG11 ILE 38 9.079 -1.518 -2.268
275 HG21 ILE 38 HG21 ILE 38 9.492 0.200 -5.556
276 HG22 ILE 38 HG22 ILE 38 10.371 1.578 -4.895
277 HG23 ILE 38 HG23 ILE 38 8.651 1.378 -4.550
278 HD11 ILE 38 HD11 ILE 38 7.564 0.396 -2.043
279 HD12 ILE 38 HD12 ILE 38 6.734 -1.042 -2.638
280 HD13 ILE 38 HD13 ILE 38 7.151 0.261 -3.752
281 H GLY 39 HN GLY 39 12.168 -3.008 -3.160
282 HA2 GLY 39 HA2 GLY 39 13.337 -3.999 -1.461
283 HA3 GLY 39 HA1 GLY 39 13.750 -2.386 -0.903
284 H TYR 40 HN TYR 40 10.616 -4.108 -1.101
285 HA TYR 40 HA TYR 40 10.466 -3.803 1.817
286 HB2 TYR 40 HB2 TYR 40 8.371 -3.295 -0.257
287 HB3 TYR 40 HB1 TYR 40 7.887 -3.817 1.355
288 HD1 TYR 40 HD2 TYR 40 8.298 -2.383 3.297
289 HD2 TYR 40 HD1 TYR 40 9.315 -1.110 -0.631
290 HE1 TYR 40 HE2 TYR 40 8.487 -0.066 4.103
291 HE2 TYR 40 HE1 TYR 40 9.509 1.205 0.161
292 HH TYR 40 HH TYR 40 8.700 2.601 1.985
293 H ASP 41 HN ASP 41 10.362 -5.584 2.915
294 HA ASP 41 HA ASP 41 9.934 -8.133 1.651
295 HB2 ASP 41 HB2 ASP 41 10.646 -7.250 4.426
296 HB3 ASP 41 HB1 ASP 41 10.121 -8.906 4.142
297 H SER 42 HN SER 42 8.507 -9.740 2.613
298 HA SER 42 HA SER 42 5.841 -9.107 2.365
299 HB2 SER 42 HB2 SER 42 5.415 -11.323 3.411
300 HB3 SER 42 HB1 SER 42 6.693 -11.385 2.194
301 H LEU 43 HN LEU 43 7.622 -9.607 5.383
302 HA LEU 43 HA LEU 43 5.523 -9.230 7.167
303 HB2 LEU 43 HB2 LEU 43 7.800 -10.129 7.685
304 HB3 LEU 43 HB1 LEU 43 8.408 -8.488 7.632
305 HG LEU 43 HG LEU 43 6.914 -7.896 9.515
306 HD11 LEU 43 HD11 LEU 43 6.327 -10.852 9.580
307 HD12 LEU 43 HD12 LEU 43 5.194 -9.587 9.110
308 HD13 LEU 43 HD13 LEU 43 5.799 -9.656 10.766
309 HD21 LEU 43 HD21 LEU 43 8.764 -10.229 10.001
310 HD22 LEU 43 HD22 LEU 43 8.171 -9.113 11.231
311 HD23 LEU 43 HD23 LEU 43 9.220 -8.525 9.941
312 H ALA 44 HN ALA 44 7.885 -6.834 6.008
313 HA ALA 44 HA ALA 44 6.818 -4.661 7.456
314 HB1 ALA 44 HB1 ALA 44 9.079 -4.639 6.506
315 HB2 ALA 44 HB2 ALA 44 8.143 -3.244 5.970
316 HB3 ALA 44 HB3 ALA 44 8.395 -4.610 4.881
317 H LEU 45 HN LEU 45 6.086 -6.045 4.326
318 HA LEU 45 HA LEU 45 4.448 -3.982 3.341
319 HB2 LEU 45 HB2 LEU 45 5.348 -5.808 1.959
320 HB3 LEU 45 HB1 LEU 45 4.313 -6.951 2.793
321 HG LEU 45 HG LEU 45 2.330 -5.692 1.908
322 HD11 LEU 45 HD11 LEU 45 3.458 -3.561 1.507
323 HD12 LEU 45 HD12 LEU 45 2.673 -4.165 0.049
324 HD13 LEU 45 HD13 LEU 45 4.421 -4.313 0.235
325 HD21 LEU 45 HD21 LEU 45 3.146 -7.747 0.853
326 HD22 LEU 45 HD22 LEU 45 4.228 -6.795 -0.161
327 HD23 LEU 45 HD23 LEU 45 2.481 -6.623 -0.333
328 H MET 46 HN MET 46 3.645 -6.942 5.163
329 HA MET 46 HA MET 46 0.851 -6.486 5.138
330 HB2 MET 46 HB2 MET 46 0.641 -8.295 6.672
331 HB3 MET 46 HB1 MET 46 1.958 -8.704 5.586
332 HG2 MET 46 HG2 MET 46 3.580 -8.105 7.271
333 HG3 MET 46 HG1 MET 46 2.294 -7.576 8.351
334 HE1 MET 46 HE1 MET 46 0.456 -11.004 9.054
335 HE2 MET 46 HE2 MET 46 0.104 -9.919 7.708
336 HE3 MET 46 HE3 MET 46 0.420 -9.261 9.313
337 H GLU 47 HN GLU 47 3.392 -5.482 7.344
338 HA GLU 47 HA GLU 47 1.697 -4.497 9.382
339 HB2 GLU 47 HB2 GLU 47 4.495 -3.676 8.596
340 HB3 GLU 47 HB1 GLU 47 3.677 -3.129 10.053
341 HG2 GLU 47 HG2 GLU 47 3.493 -5.475 10.785
342 HG3 GLU 47 HG1 GLU 47 4.405 -5.958 9.358
343 H THR 48 HN THR 48 3.037 -3.058 6.465
344 HA THR 48 HA THR 48 2.124 -0.432 6.851
345 HB THR 48 HB THR 48 2.456 -1.850 4.203
346 HG1 THR 48 HG1 THR 48 4.387 -2.070 5.330
347 HG21 THR 48 HG21 THR 48 3.000 0.405 3.384
348 HG22 THR 48 HG22 THR 48 2.654 1.057 4.987
349 HG23 THR 48 HG23 THR 48 1.362 0.324 4.038
350 H ALA 49 HN ALA 49 0.539 -3.309 5.630
351 HA ALA 49 HA ALA 49 -1.742 -2.204 4.482
352 HB1 ALA 49 HB1 ALA 49 -1.154 -4.574 4.306
353 HB2 ALA 49 HB2 ALA 49 -2.807 -4.362 4.886
354 HB3 ALA 49 HB3 ALA 49 -1.525 -4.790 6.017
355 H ALA 50 HN ALA 50 -1.095 -3.059 7.856
356 HA ALA 50 HA ALA 50 -3.695 -2.678 8.852
357 HB1 ALA 50 HB1 ALA 50 -2.662 -2.631 11.057
358 HB2 ALA 50 HB2 ALA 50 -1.075 -2.414 10.322
359 HB3 ALA 50 HB3 ALA 50 -1.965 -3.914 10.069
360 H ARG 51 HN ARG 51 -1.103 -0.478 8.185
361 HA ARG 51 HA ARG 51 -1.956 1.752 9.671
362 HB2 ARG 51 HB2 ARG 51 -0.430 1.563 7.071
363 HB3 ARG 51 HB1 ARG 51 -0.646 3.052 7.965
364 HG2 ARG 51 HG2 ARG 51 0.807 0.596 8.904
365 HG3 ARG 51 HG1 ARG 51 1.528 2.127 8.408
366 HD2 ARG 51 HD2 ARG 51 0.237 3.221 10.261
367 HD3 ARG 51 HD1 ARG 51 -0.197 1.604 10.816
368 HE ARG 51 HE ARG 51 2.582 2.583 10.644
369 HH11 ARG 51 HH11 ARG 51 0.070 0.746 12.255
370 HH12 ARG 51 HH12 ARG 51 1.114 0.247 13.559
371 HH21 ARG 51 HH21 ARG 51 3.934 1.923 12.336
372 HH22 ARG 51 HH22 ARG 51 3.295 0.940 13.616
373 H LEU 52 HN LEU 52 -2.571 0.823 6.307
374 HA LEU 52 HA LEU 52 -4.239 3.059 5.761
375 HB2 LEU 52 HB2 LEU 52 -3.835 0.452 4.307
376 HB3 LEU 52 HB1 LEU 52 -4.807 1.772 3.692
377 HG LEU 52 HG LEU 52 -1.855 1.946 4.291
378 HD11 LEU 52 HD11 LEU 52 -2.216 0.464 2.438
379 HD12 LEU 52 HD12 LEU 52 -1.624 2.010 1.826
380 HD13 LEU 52 HD13 LEU 52 -3.334 1.603 1.694
381 HD21 LEU 52 HD21 LEU 52 -2.986 4.090 4.520
382 HD22 LEU 52 HD22 LEU 52 -3.747 3.876 2.943
383 HD23 LEU 52 HD23 LEU 52 -1.999 4.073 3.057
384 H GLU 53 HN GLU 53 -4.817 -0.274 6.733
385 HA GLU 53 HA GLU 53 -7.573 -0.390 6.351
386 HB2 GLU 53 HB2 GLU 53 -5.824 -1.720 8.416
387 HB3 GLU 53 HB1 GLU 53 -7.543 -2.058 8.266
388 HG2 GLU 53 HG2 GLU 53 -7.180 -2.801 5.962
389 HG3 GLU 53 HG1 GLU 53 -5.454 -2.496 6.146
390 H SER 54 HN SER 54 -5.834 0.386 9.362
391 HA SER 54 HA SER 54 -8.163 1.019 10.819
392 HB2 SER 54 HB2 SER 54 -6.056 0.359 11.898
393 HB3 SER 54 HB1 SER 54 -5.297 1.847 11.338
394 HG SER 54 HG SER 54 -7.650 1.927 12.892
395 H ARG 55 HN ARG 55 -6.032 2.957 8.807
396 HA ARG 55 HA ARG 55 -6.830 5.456 9.901
397 HB2 ARG 55 HB2 ARG 55 -4.671 5.151 8.747
398 HB3 ARG 55 HB1 ARG 55 -5.521 4.894 7.235
399 HG2 ARG 55 HG2 ARG 55 -6.332 7.142 7.230
400 HG3 ARG 55 HG1 ARG 55 -5.687 7.427 8.849
401 HD2 ARG 55 HD2 ARG 55 -3.437 7.237 8.053
402 HD3 ARG 55 HD1 ARG 55 -3.991 6.707 6.466
403 HE ARG 55 HE ARG 55 -4.921 9.325 7.282
404 HH11 ARG 55 HH11 ARG 55 -2.314 7.572 5.731
405 HH12 ARG 55 HH12 ARG 55 -1.946 8.861 4.625
406 HH21 ARG 55 HH21 ARG 55 -4.387 11.042 5.845
407 HH22 ARG 55 HH22 ARG 55 -3.128 10.807 4.665
408 H TYR 56 HN TYR 56 -7.839 3.673 6.986
409 HA TYR 56 HA TYR 56 -9.828 5.783 6.513
410 HB2 TYR 56 HB2 TYR 56 -8.496 3.835 4.640
411 HB3 TYR 56 HB1 TYR 56 -9.926 4.756 4.175
412 HD1 TYR 56 HD2 TYR 56 -9.802 7.309 4.548
413 HD2 TYR 56 HD1 TYR 56 -6.377 4.800 4.323
414 HE1 TYR 56 HE2 TYR 56 -8.416 9.273 4.049
415 HE2 TYR 56 HE1 TYR 56 -4.964 6.757 3.837
416 HH TYR 56 HH TYR 56 -5.344 9.151 2.834
417 H GLY 57 HN GLY 57 -9.816 3.155 8.198
418 HA2 GLY 57 HA2 GLY 57 -11.510 1.830 9.006
419 HA3 GLY 57 HA1 GLY 57 -12.620 2.865 8.124
420 H VAL 58 HN VAL 58 -10.028 0.866 6.844
421 HA VAL 58 HA VAL 58 -12.063 -0.692 5.392
422 HB VAL 58 HB VAL 58 -10.466 -1.018 3.585
423 HG11 VAL 58 HG11 VAL 58 -10.757 1.898 4.286
424 HG12 VAL 58 HG12 VAL 58 -11.950 0.906 3.444
425 HG13 VAL 58 HG13 VAL 58 -10.393 1.249 2.688
426 HG21 VAL 58 HG21 VAL 58 -8.619 0.794 5.134
427 HG22 VAL 58 HG22 VAL 58 -8.337 0.176 3.509
428 HG23 VAL 58 HG23 VAL 58 -8.397 -0.937 4.876
429 H SER 59 HN SER 59 -10.748 -2.772 4.481
430 HA SER 59 HA SER 59 -8.801 -3.774 6.347
431 HB2 SER 59 HB2 SER 59 -11.122 -4.329 7.307
432 HB3 SER 59 HB1 SER 59 -11.297 -5.424 5.936
433 HG SER 59 HG SER 59 -8.902 -5.782 7.137
434 H ILE 60 HN ILE 60 -7.389 -5.072 5.303
435 HA ILE 60 HA ILE 60 -7.933 -5.497 2.453
436 HB ILE 60 HB ILE 60 -5.332 -5.746 3.981
437 HG12 ILE 60 HG12 ILE 60 -6.374 -3.572 2.140
438 HG13 ILE 60 HG11 ILE 60 -6.164 -3.439 3.881
439 HG21 ILE 60 HG21 ILE 60 -5.873 -5.830 1.011
440 HG22 ILE 60 HG22 ILE 60 -5.362 -7.185 2.017
441 HG23 ILE 60 HG23 ILE 60 -4.277 -5.818 1.763
442 HD11 ILE 60 HD11 ILE 60 -3.755 -3.707 3.605
443 HD12 ILE 60 HD12 ILE 60 -4.375 -2.324 2.704
444 HD13 ILE 60 HD13 ILE 60 -3.975 -3.819 1.861
445 HA PRO 61 HA PRO 61 -9.008 -9.693 3.520
446 HB2 PRO 61 HB2 PRO 61 -9.017 -10.008 0.581
447 HB3 PRO 61 HB1 PRO 61 -10.304 -10.314 1.751
448 HG2 PRO 61 HG2 PRO 61 -10.396 -8.196 0.119
449 HG3 PRO 61 HG1 PRO 61 -10.974 -8.093 1.792
450 HD2 PRO 61 HD2 PRO 61 -8.396 -7.140 0.610
451 HD3 PRO 61 HD1 PRO 61 -9.451 -6.352 1.805
452 H ASP 62 HN ASP 62 -7.744 -11.325 3.958
453 HA ASP 62 HA ASP 62 -5.049 -11.555 3.339
454 HB2 ASP 62 HB2 ASP 62 -6.087 -12.667 5.232
455 HB3 ASP 62 HB1 ASP 62 -7.068 -13.654 4.157
456 H ASP 63 HN ASP 63 -7.844 -12.685 1.589
457 HA ASP 63 HA ASP 63 -6.471 -14.596 -0.029
458 HB2 ASP 63 HB2 ASP 63 -9.183 -13.289 -0.311
459 HB3 ASP 63 HB1 ASP 63 -8.593 -14.545 -1.391
460 H VAL 64 HN VAL 64 -7.718 -11.321 -0.619
461 HA VAL 64 HA VAL 64 -6.910 -11.315 -3.363
462 HB VAL 64 HB VAL 64 -7.732 -8.953 -1.666
463 HG11 VAL 64 HG11 VAL 64 -6.659 -8.347 -3.784
464 HG12 VAL 64 HG12 VAL 64 -8.376 -7.937 -3.793
465 HG13 VAL 64 HG13 VAL 64 -7.806 -9.367 -4.654
466 HG21 VAL 64 HG21 VAL 64 -9.435 -10.689 -1.571
467 HG22 VAL 64 HG22 VAL 64 -9.433 -10.805 -3.330
468 HG23 VAL 64 HG23 VAL 64 -9.994 -9.328 -2.546
469 H ALA 65 HN ALA 65 -5.442 -10.427 -0.367
470 HA ALA 65 HA ALA 65 -3.621 -8.492 -1.231
471 HB1 ALA 65 HB1 ALA 65 -3.279 -10.491 0.990
472 HB2 ALA 65 HB2 ALA 65 -4.123 -8.948 1.119
473 HB3 ALA 65 HB3 ALA 65 -2.388 -8.981 0.799
474 H GLY 66 HN GLY 66 -3.415 -11.990 -1.270
475 HA2 GLY 66 HA2 GLY 66 -0.612 -12.007 -1.956
476 HA3 GLY 66 HA1 GLY 66 -1.668 -13.404 -1.846
477 H ARG 67 HN ARG 67 -2.190 -10.537 -3.847
478 HA ARG 67 HA ARG 67 -1.521 -12.081 -6.247
479 HB2 ARG 67 HB2 ARG 67 -4.159 -10.639 -5.899
480 HB3 ARG 67 HB1 ARG 67 -3.611 -11.458 -7.355
481 HG2 ARG 67 HG2 ARG 67 -3.627 -13.592 -6.139
482 HG3 ARG 67 HG1 ARG 67 -4.238 -12.752 -4.712
483 HD2 ARG 67 HD2 ARG 67 -6.072 -13.799 -5.900
484 HD3 ARG 67 HD1 ARG 67 -6.216 -12.043 -5.996
485 HE ARG 67 HE ARG 67 -5.069 -13.626 -8.205
486 HH11 ARG 67 HH11 ARG 67 -7.345 -11.240 -7.024
487 HH12 ARG 67 HH12 ARG 67 -7.932 -10.824 -8.609
488 HH21 ARG 67 HH21 ARG 67 -5.837 -13.084 -10.284
489 HH22 ARG 67 HH22 ARG 67 -7.065 -11.867 -10.455
490 H VAL 68 HN VAL 68 -1.214 -9.282 -4.519
491 HA VAL 68 HA VAL 68 -1.197 -7.532 -6.872
492 HB VAL 68 HB VAL 68 -2.619 -6.748 -5.068
493 HG11 VAL 68 HG11 VAL 68 -1.710 -6.070 -2.905
494 HG12 VAL 68 HG12 VAL 68 -0.135 -6.716 -3.365
495 HG13 VAL 68 HG13 VAL 68 -1.513 -7.801 -3.175
496 HG21 VAL 68 HG21 VAL 68 -1.675 -4.506 -4.771
497 HG22 VAL 68 HG22 VAL 68 -1.534 -5.075 -6.434
498 HG23 VAL 68 HG23 VAL 68 -0.124 -5.089 -5.373
499 H ASP 69 HN ASP 69 0.678 -7.268 -7.821
500 HA ASP 69 HA ASP 69 3.161 -7.365 -6.277
501 HB2 ASP 69 HB2 ASP 69 2.582 -7.263 -9.235
502 HB3 ASP 69 HB1 ASP 69 4.200 -7.017 -8.601
503 H THR 70 HN THR 70 1.163 -5.134 -8.058
504 HA THR 70 HA THR 70 3.167 -3.020 -7.717
505 HB THR 70 HB THR 70 1.808 -1.861 -9.535
506 HG1 THR 70 HG1 THR 70 0.925 -4.283 -10.500
507 HG21 THR 70 HG21 THR 70 3.196 -4.457 -10.205
508 HG22 THR 70 HG22 THR 70 3.979 -2.894 -9.963
509 HG23 THR 70 HG23 THR 70 2.888 -3.136 -11.329
510 HA PRO 71 HA PRO 71 0.636 -0.881 -4.740
511 HB2 PRO 71 HB2 PRO 71 1.890 1.477 -6.072
512 HB3 PRO 71 HB1 PRO 71 1.786 1.073 -4.353
513 HG2 PRO 71 HG2 PRO 71 4.061 0.746 -5.683
514 HG3 PRO 71 HG1 PRO 71 3.541 -0.434 -4.467
515 HD2 PRO 71 HD2 PRO 71 3.470 -0.623 -7.443
516 HD3 PRO 71 HD1 PRO 71 3.790 -1.887 -6.239
517 H ARG 72 HN ARG 72 0.700 -0.067 -8.165
518 HA ARG 72 HA ARG 72 -1.439 1.698 -8.327
519 HB2 ARG 72 HB2 ARG 72 0.003 1.087 -10.237
520 HB3 ARG 72 HB1 ARG 72 -0.732 -0.507 -10.277
521 HG2 ARG 72 HG2 ARG 72 -1.723 0.823 -11.991
522 HG3 ARG 72 HG1 ARG 72 -2.921 0.569 -10.720
523 HD2 ARG 72 HD2 ARG 72 -1.566 2.915 -10.019
524 HD3 ARG 72 HD1 ARG 72 -1.844 3.027 -11.755
525 HE ARG 72 HE ARG 72 -4.074 2.344 -9.955
526 HH11 ARG 72 HH11 ARG 72 -2.620 4.630 -12.210
527 HH12 ARG 72 HH12 ARG 72 -4.082 5.538 -12.410
528 HH21 ARG 72 HH21 ARG 72 -5.964 3.529 -10.217
529 HH22 ARG 72 HH22 ARG 72 -5.993 4.927 -11.264
530 H GLU 73 HN GLU 73 -1.543 -1.839 -8.680
531 HA GLU 73 HA GLU 73 -4.340 -2.042 -8.837
532 HB2 GLU 73 HB2 GLU 73 -2.258 -4.053 -7.953
533 HB3 GLU 73 HB1 GLU 73 -3.951 -4.449 -8.216
534 HG2 GLU 73 HG2 GLU 73 -2.125 -3.310 -10.321
535 HG3 GLU 73 HG1 GLU 73 -2.474 -5.028 -10.120
536 H LEU 74 HN LEU 74 -2.131 -2.209 -6.099
537 HA LEU 74 HA LEU 74 -3.921 -3.011 -4.113
538 HB2 LEU 74 HB2 LEU 74 -1.341 -2.704 -4.094
539 HB3 LEU 74 HB1 LEU 74 -1.689 -1.052 -3.635
540 HG LEU 74 HG LEU 74 -1.117 -2.561 -1.730
541 HD11 LEU 74 HD11 LEU 74 -2.922 -1.808 -0.255
542 HD12 LEU 74 HD12 LEU 74 -3.878 -1.351 -1.667
543 HD13 LEU 74 HD13 LEU 74 -2.358 -0.522 -1.323
544 HD21 LEU 74 HD21 LEU 74 -2.165 -4.592 -2.522
545 HD22 LEU 74 HD22 LEU 74 -3.758 -3.841 -2.414
546 HD23 LEU 74 HD23 LEU 74 -2.822 -4.142 -0.949
547 H LEU 75 HN LEU 75 -2.948 0.263 -5.097
548 HA LEU 75 HA LEU 75 -4.588 1.697 -3.347
549 HB2 LEU 75 HB2 LEU 75 -2.709 2.622 -4.669
550 HB3 LEU 75 HB1 LEU 75 -3.675 2.480 -6.122
551 HG LEU 75 HG LEU 75 -4.723 4.136 -3.862
552 HD11 LEU 75 HD11 LEU 75 -2.384 4.829 -4.117
553 HD12 LEU 75 HD12 LEU 75 -3.498 6.072 -4.689
554 HD13 LEU 75 HD13 LEU 75 -2.644 5.053 -5.849
555 HD21 LEU 75 HD21 LEU 75 -5.643 5.442 -5.721
556 HD22 LEU 75 HD22 LEU 75 -6.123 3.747 -5.826
557 HD23 LEU 75 HD23 LEU 75 -4.845 4.370 -6.872
558 H ASP 76 HN ASP 76 -5.213 0.521 -6.628
559 HA ASP 76 HA ASP 76 -7.743 1.746 -6.921
560 HB2 ASP 76 HB2 ASP 76 -6.295 -0.442 -8.358
561 HB3 ASP 76 HB1 ASP 76 -7.983 -0.123 -8.724
562 H LEU 77 HN LEU 77 -6.780 -1.418 -5.691
563 HA LEU 77 HA LEU 77 -9.340 -2.588 -5.682
564 HB2 LEU 77 HB2 LEU 77 -6.945 -3.092 -3.914
565 HB3 LEU 77 HB1 LEU 77 -8.388 -4.088 -3.905
566 HG LEU 77 HG LEU 77 -6.568 -3.692 -6.283
567 HD11 LEU 77 HD11 LEU 77 -5.911 -6.028 -5.879
568 HD12 LEU 77 HD12 LEU 77 -6.864 -6.026 -4.394
569 HD13 LEU 77 HD13 LEU 77 -5.460 -4.970 -4.542
570 HD21 LEU 77 HD21 LEU 77 -7.857 -5.509 -7.285
571 HD22 LEU 77 HD22 LEU 77 -8.886 -4.126 -6.921
572 HD23 LEU 77 HD23 LEU 77 -8.918 -5.544 -5.877
573 H ILE 78 HN ILE 78 -7.590 -0.780 -3.178
574 HA ILE 78 HA ILE 78 -9.682 -0.980 -1.258
575 HB ILE 78 HB ILE 78 -7.420 1.023 -1.385
576 HG12 ILE 78 HG12 ILE 78 -7.621 -1.624 0.063
577 HG13 ILE 78 HG11 ILE 78 -6.672 -1.331 -1.390
578 HG21 ILE 78 HG21 ILE 78 -9.230 1.720 0.114
579 HG22 ILE 78 HG22 ILE 78 -7.772 1.290 1.011
580 HG23 ILE 78 HG23 ILE 78 -9.130 0.169 0.951
581 HD11 ILE 78 HD11 ILE 78 -6.237 -0.028 1.289
582 HD12 ILE 78 HD12 ILE 78 -5.268 0.229 -0.164
583 HD13 ILE 78 HD13 ILE 78 -5.293 -1.355 0.610
584 H ASN 79 HN ASN 79 -8.782 1.452 -3.665
585 HA ASN 79 HA ASN 79 -10.680 3.391 -2.835
586 HB2 ASN 79 HB2 ASN 79 -8.910 3.027 -5.180
587 HB3 ASN 79 HB1 ASN 79 -10.341 4.021 -5.434
588 HD21 ASN 79 HD21 ASN 79 -7.349 3.703 -3.690
589 HD22 ASN 79 HD22 ASN 79 -7.263 5.352 -3.174
590 H GLY 80 HN GLY 80 -10.878 0.593 -4.910
591 HA2 GLY 80 HA2 GLY 80 -13.297 1.214 -6.233
592 HA3 GLY 80 HA1 GLY 80 -12.656 -0.401 -5.970
593 H ALA 81 HN ALA 81 -12.628 -0.366 -3.154
594 HA ALA 81 HA ALA 81 -15.357 -1.008 -2.610
595 HB1 ALA 81 HB1 ALA 81 -13.013 -0.791 -0.719
596 HB2 ALA 81 HB2 ALA 81 -13.511 -2.244 -1.586
597 HB3 ALA 81 HB3 ALA 81 -14.568 -1.544 -0.360
598 H LEU 82 HN LEU 82 -13.260 1.716 -1.946
599 HA LEU 82 HA LEU 82 -15.139 2.986 -0.161
600 HB2 LEU 82 HB2 LEU 82 -12.575 3.978 -1.404
601 HB3 LEU 82 HB1 LEU 82 -13.527 4.884 -0.243
602 HG LEU 82 HG LEU 82 -12.198 2.226 0.292
603 HD11 LEU 82 HD11 LEU 82 -11.476 4.991 1.254
604 HD12 LEU 82 HD12 LEU 82 -10.596 4.065 0.035
605 HD13 LEU 82 HD13 LEU 82 -10.675 3.484 1.698
606 HD21 LEU 82 HD21 LEU 82 -13.674 4.106 2.129
607 HD22 LEU 82 HD22 LEU 82 -12.814 2.644 2.618
608 HD23 LEU 82 HD23 LEU 82 -14.239 2.526 1.585
609 H ALA 83 HN ALA 83 -14.927 2.697 -3.481
610 HA ALA 83 HA ALA 83 -15.650 5.301 -4.335
611 HB1 ALA 83 HB1 ALA 83 -16.253 4.255 -6.442
612 HB2 ALA 83 HB2 ALA 83 -16.213 2.665 -5.681
613 HB3 ALA 83 HB3 ALA 83 -14.727 3.600 -5.846
614 H GLU 84 HN GLU 84 -17.471 2.578 -3.141
615 HA GLU 84 HA GLU 84 -19.974 4.034 -3.657
616 HB2 GLU 84 HB2 GLU 84 -19.552 1.095 -3.085
617 HB3 GLU 84 HB1 GLU 84 -21.100 1.867 -3.405
618 HG2 GLU 84 HG2 GLU 84 -20.258 2.528 -5.638
619 HG3 GLU 84 HG1 GLU 84 -18.785 1.617 -5.310
620 H ALA 85 HN ALA 85 -17.983 4.321 -1.399
621 HA ALA 85 HA ALA 85 -19.625 3.528 0.889
622 HB1 ALA 85 HB1 ALA 85 -16.856 4.729 0.783
623 HB2 ALA 85 HB2 ALA 85 -17.253 3.029 1.046
624 HB3 ALA 85 HB3 ALA 85 -17.703 4.238 2.249
625 H ALA 86 HN ALA 86 -20.743 4.937 2.095
626 HA ALA 86 HA ALA 86 -20.213 7.774 2.030
627 HB1 ALA 86 HB1 ALA 86 -22.823 6.699 0.961
628 HB2 ALA 86 HB2 ALA 86 -21.585 7.545 0.032
629 HB3 ALA 86 HB3 ALA 86 -22.478 8.393 1.297
630 H28 SXO 87 H28B SXO 87 5.070 -11.914 5.420
631 H28A SXO 87 H28A SXO 87 5.432 -13.309 6.440
632 H30 SXO 87 H30A SXO 87 1.740 -13.043 6.243
633 H30A SXO 87 H30C SXO 87 3.127 -12.971 7.329
634 H30B SXO 87 H30B SXO 87 2.859 -11.679 6.158
635 H31 SXO 87 H31A SXO 87 3.153 -12.106 3.740
636 H31A SXO 87 H31B SXO 87 2.090 -13.511 3.804
637 H31B SXO 87 H31C SXO 87 3.733 -13.677 3.183
638 H32 SXO 87 H32A SXO 87 3.680 -15.211 6.619
639 HO33 SXO 87 H33A SXO 87 5.131 -15.024 4.397
640 HN36 SXO 87 H36A SXO 87 1.250 -14.602 6.598
641 H37 SXO 87 H37A SXO 87 -0.219 -16.620 5.087
642 H37A SXO 87 H37B SXO 87 -0.791 -15.730 6.495
643 H38 SXO 87 H38B SXO 87 -1.990 -15.031 4.505
644 H38A SXO 87 H38A SXO 87 -0.468 -14.653 3.702
645 HN41 SXO 87 H41A SXO 87 -1.803 -12.675 3.464
646 H42 SXO 87 H42A SXO 87 -2.702 -10.731 4.831
647 H42A SXO 87 H42B SXO 87 -1.083 -10.715 5.533
648 H43 SXO 87 H43B SXO 87 -0.106 -10.211 3.385
649 H43A SXO 87 H43A SXO 87 -1.688 -10.365 2.598
650 H2 SXO 87 H2A SXO 87 -2.105 -6.113 2.708
651 H2A SXO 87 H2B SXO 87 -1.831 -6.477 1.004
652 H3 SXO 87 H3B SXO 87 0.205 -5.287 2.882
653 H3A SXO 87 H3A SXO 87 0.423 -5.597 1.157
654 H4 SXO 87 H4A SXO 87 -1.659 -3.757 2.331
655 H4A SXO 87 H4B SXO 87 -1.324 -4.014 0.618
656 H5 SXO 87 H5B SXO 87 0.631 -2.886 2.618
657 H5A SXO 87 H5A SXO 87 0.897 -3.079 0.884
658 H6 SXO 87 H6A SXO 87 -1.194 -1.326 2.166
659 H6A SXO 87 H6B SXO 87 -0.947 -1.531 0.433
660 H7 SXO 87 H7A SXO 87 1.106 -0.431 2.357
661 H7A SXO 87 H7B SXO 87 0.095 0.538 1.275
662 H8 SXO 87 H8C SXO 87 2.073 -1.574 0.433
663 H8A SXO 87 H8A SXO 87 2.320 0.167 0.336
664 H8B SXO 87 H8B SXO 87 1.074 -0.601 -0.647
Start of MODEL 20
1 H1 MET 1 HT1 MET 1 -19.648 12.568 2.178
2 H2 MET 1 HT2 MET 1 -18.582 11.887 3.304
3 H3 MET 1 HT3 MET 1 -19.113 10.972 1.980
4 HA MET 1 HA MET 1 -17.958 12.344 0.453
5 HB2 MET 1 HB2 MET 1 -18.270 14.449 1.757
6 HB3 MET 1 HB1 MET 1 -17.019 13.911 2.866
7 HG2 MET 1 HG2 MET 1 -16.074 15.472 1.321
8 HG3 MET 1 HG1 MET 1 -15.421 13.868 0.987
9 HE1 MET 1 HE1 MET 1 -15.262 16.382 -1.041
10 HE2 MET 1 HE2 MET 1 -15.596 15.558 -2.564
11 HE3 MET 1 HE3 MET 1 -14.547 14.802 -1.365
12 H ALA 2 HN ALA 2 -16.355 12.177 3.635
13 HA ALA 2 HA ALA 2 -14.692 10.881 4.462
14 HB1 ALA 2 HB1 ALA 2 -15.295 9.072 2.123
15 HB2 ALA 2 HB2 ALA 2 -15.994 8.961 3.739
16 HB3 ALA 2 HB3 ALA 2 -14.272 8.665 3.501
17 H THR 3 HN THR 3 -12.625 9.482 3.280
18 HA THR 3 HA THR 3 -11.428 11.232 1.288
19 HB THR 3 HB THR 3 -10.680 12.280 3.320
20 HG1 THR 3 HG1 THR 3 -9.105 11.610 1.534
21 HG21 THR 3 HG21 THR 3 -9.739 9.554 4.224
22 HG22 THR 3 HG22 THR 3 -11.058 10.496 4.923
23 HG23 THR 3 HG23 THR 3 -9.398 11.078 5.047
24 H LEU 4 HN LEU 4 -10.592 10.004 -0.228
25 HA LEU 4 HA LEU 4 -10.297 7.156 0.167
26 HB2 LEU 4 HB2 LEU 4 -9.722 8.819 -2.288
27 HB3 LEU 4 HB1 LEU 4 -9.848 7.071 -2.225
28 HG LEU 4 HG LEU 4 -12.074 9.065 -1.829
29 HD11 LEU 4 HD11 LEU 4 -11.484 8.718 -4.143
30 HD12 LEU 4 HD12 LEU 4 -13.025 7.927 -3.800
31 HD13 LEU 4 HD13 LEU 4 -11.549 6.968 -3.926
32 HD21 LEU 4 HD21 LEU 4 -13.562 7.178 -1.517
33 HD22 LEU 4 HD22 LEU 4 -12.313 7.178 -0.272
34 HD23 LEU 4 HD23 LEU 4 -12.203 6.060 -1.631
35 H LEU 5 HN LEU 5 -8.329 6.029 -0.615
36 HA LEU 5 HA LEU 5 -5.988 7.143 0.662
37 HB2 LEU 5 HB2 LEU 5 -6.873 4.656 0.533
38 HB3 LEU 5 HB1 LEU 5 -5.990 4.628 -0.978
39 HG LEU 5 HG LEU 5 -4.768 5.243 1.715
40 HD11 LEU 5 HD11 LEU 5 -4.734 2.713 0.086
41 HD12 LEU 5 HD12 LEU 5 -5.547 2.959 1.630
42 HD13 LEU 5 HD13 LEU 5 -3.787 3.008 1.547
43 HD21 LEU 5 HD21 LEU 5 -3.526 6.267 -0.096
44 HD22 LEU 5 HD22 LEU 5 -3.502 4.739 -0.977
45 HD23 LEU 5 HD23 LEU 5 -2.633 4.892 0.550
46 H THR 6 HN THR 6 -4.483 8.354 -0.414
47 HA THR 6 HA THR 6 -4.596 8.326 -3.353
48 HB THR 6 HB THR 6 -3.742 10.571 -3.358
49 HG1 THR 6 HG1 THR 6 -3.812 10.850 -0.564
50 HG21 THR 6 HG21 THR 6 -5.532 11.757 -2.162
51 HG22 THR 6 HG22 THR 6 -5.915 10.277 -1.284
52 HG23 THR 6 HG23 THR 6 -6.147 10.348 -3.029
53 H THR 7 HN THR 7 -2.407 9.175 -4.306
54 HA THR 7 HA THR 7 -0.430 7.242 -3.837
55 HB THR 7 HB THR 7 1.019 8.918 -5.189
56 HG1 THR 7 HG1 THR 7 -0.712 10.259 -6.419
57 HG21 THR 7 HG21 THR 7 -0.011 6.909 -6.123
58 HG22 THR 7 HG22 THR 7 -0.108 8.254 -7.260
59 HG23 THR 7 HG23 THR 7 -1.530 7.779 -6.333
60 H ASP 8 HN ASP 8 -0.436 10.722 -3.012
61 HA ASP 8 HA ASP 8 2.040 10.585 -1.636
62 HB2 ASP 8 HB2 ASP 8 1.438 12.843 -0.758
63 HB3 ASP 8 HB1 ASP 8 1.345 12.711 -2.510
64 H ASP 9 HN ASP 9 -1.286 10.127 -0.637
65 HA ASP 9 HA ASP 9 -0.873 9.990 2.144
66 HB2 ASP 9 HB2 ASP 9 -2.872 8.917 0.227
67 HB3 ASP 9 HB1 ASP 9 -2.752 8.073 1.766
68 H LEU 10 HN LEU 10 -0.787 7.464 -0.327
69 HA LEU 10 HA LEU 10 -0.015 5.324 1.315
70 HB2 LEU 10 HB2 LEU 10 -0.907 5.263 -1.059
71 HB3 LEU 10 HB1 LEU 10 0.709 5.684 -1.591
72 HG LEU 10 HG LEU 10 1.552 3.599 -0.510
73 HD11 LEU 10 HD11 LEU 10 -0.230 3.304 1.124
74 HD12 LEU 10 HD12 LEU 10 -0.060 1.875 0.108
75 HD13 LEU 10 HD13 LEU 10 -1.387 3.002 -0.171
76 HD21 LEU 10 HD21 LEU 10 1.093 3.670 -2.895
77 HD22 LEU 10 HD22 LEU 10 -0.597 3.256 -2.604
78 HD23 LEU 10 HD23 LEU 10 0.675 2.090 -2.237
79 H ARG 11 HN ARG 11 1.881 7.669 -0.518
80 HA ARG 11 HA ARG 11 4.439 6.674 -0.218
81 HB2 ARG 11 HB2 ARG 11 4.018 8.616 -1.580
82 HB3 ARG 11 HB1 ARG 11 3.464 9.535 -0.189
83 HG2 ARG 11 HG2 ARG 11 5.694 9.572 0.732
84 HG3 ARG 11 HG1 ARG 11 6.280 8.538 -0.572
85 HD2 ARG 11 HD2 ARG 11 6.836 10.916 -0.921
86 HD3 ARG 11 HD1 ARG 11 5.821 10.260 -2.205
87 HE ARG 11 HE ARG 11 3.932 11.355 -0.847
88 HH11 ARG 11 HH11 ARG 11 7.184 12.624 -1.093
89 HH12 ARG 11 HH12 ARG 11 6.693 14.282 -0.899
90 HH21 ARG 11 HH21 ARG 11 3.278 13.546 -0.618
91 HH22 ARG 11 HH22 ARG 11 4.474 14.799 -0.641
92 H ARG 12 HN ARG 12 2.526 8.505 2.122
93 HA ARG 12 HA ARG 12 4.690 8.667 4.012
94 HB2 ARG 12 HB2 ARG 12 1.752 9.313 4.184
95 HB3 ARG 12 HB1 ARG 12 2.841 9.473 5.556
96 HG2 ARG 12 HG2 ARG 12 3.462 10.821 2.961
97 HG3 ARG 12 HG1 ARG 12 2.319 11.536 4.099
98 HD2 ARG 12 HD2 ARG 12 4.626 12.394 4.353
99 HD3 ARG 12 HD1 ARG 12 3.997 11.637 5.810
100 HE ARG 12 HE ARG 12 5.376 9.645 4.560
101 HH11 ARG 12 HH11 ARG 12 6.178 12.890 5.567
102 HH12 ARG 12 HH12 ARG 12 7.832 12.502 5.962
103 HH21 ARG 12 HH21 ARG 12 7.536 9.113 5.110
104 HH22 ARG 12 HH22 ARG 12 8.591 10.337 5.743
105 H ALA 13 HN ALA 13 1.838 6.652 3.567
106 HA ALA 13 HA ALA 13 1.829 5.421 6.089
107 HB1 ALA 13 HB1 ALA 13 0.838 4.325 3.462
108 HB2 ALA 13 HB2 ALA 13 -0.073 5.356 4.566
109 HB3 ALA 13 HB3 ALA 13 0.399 3.731 5.064
110 H LEU 14 HN LEU 14 3.350 4.403 3.035
111 HA LEU 14 HA LEU 14 4.402 1.971 3.942
112 HB2 LEU 14 HB2 LEU 14 5.099 3.853 1.743
113 HB3 LEU 14 HB1 LEU 14 6.279 2.630 2.167
114 HG LEU 14 HG LEU 14 4.906 1.904 0.293
115 HD11 LEU 14 HD11 LEU 14 5.741 0.208 1.795
116 HD12 LEU 14 HD12 LEU 14 4.149 -0.244 1.186
117 HD13 LEU 14 HD13 LEU 14 4.320 0.385 2.826
118 HD21 LEU 14 HD21 LEU 14 2.892 3.169 0.774
119 HD22 LEU 14 HD22 LEU 14 2.579 2.163 2.188
120 HD23 LEU 14 HD23 LEU 14 2.524 1.457 0.571
121 H VAL 15 HN VAL 15 5.747 5.233 4.070
122 HA VAL 15 HA VAL 15 8.286 4.446 5.045
123 HB VAL 15 HB VAL 15 6.912 7.129 5.268
124 HG11 VAL 15 HG11 VAL 15 8.714 6.877 6.903
125 HG12 VAL 15 HG12 VAL 15 9.148 8.030 5.640
126 HG13 VAL 15 HG13 VAL 15 9.818 6.398 5.612
127 HG21 VAL 15 HG21 VAL 15 8.343 7.729 3.349
128 HG22 VAL 15 HG22 VAL 15 7.202 6.442 2.958
129 HG23 VAL 15 HG23 VAL 15 8.896 6.057 3.263
130 H GLU 16 HN GLU 16 5.283 5.429 6.645
131 HA GLU 16 HA GLU 16 6.305 5.713 9.233
132 HB2 GLU 16 HB2 GLU 16 3.565 4.814 8.340
133 HB3 GLU 16 HB1 GLU 16 3.974 5.255 9.991
134 HG2 GLU 16 HG2 GLU 16 4.538 7.515 9.237
135 HG3 GLU 16 HG1 GLU 16 4.100 7.066 7.591
136 H SER 17 HN SER 17 5.290 2.858 7.455
137 HA SER 17 HA SER 17 5.518 1.159 9.783
138 HB2 SER 17 HB2 SER 17 3.768 0.831 8.019
139 HB3 SER 17 HB1 SER 17 5.049 0.350 6.907
140 HG SER 17 HG SER 17 5.580 -1.300 8.482
141 H ALA 18 HN ALA 18 7.751 2.511 7.791
142 HA ALA 18 HA ALA 18 9.562 0.193 8.013
143 HB1 ALA 18 HB1 ALA 18 10.611 0.831 5.939
144 HB2 ALA 18 HB2 ALA 18 9.555 2.238 5.804
145 HB3 ALA 18 HB3 ALA 18 8.880 0.613 5.687
146 H GLY 19 HN GLY 19 9.825 3.668 7.265
147 HA2 GLY 19 HA2 GLY 19 10.879 5.154 8.911
148 HA3 GLY 19 HA1 GLY 19 11.988 3.835 9.268
149 H GLU 20 HN GLU 20 13.117 2.997 7.206
150 HA GLU 20 HA GLU 20 13.599 4.772 5.050
151 HB2 GLU 20 HB2 GLU 20 14.820 5.957 6.899
152 HB3 GLU 20 HB1 GLU 20 15.838 4.535 7.068
153 HG2 GLU 20 HG2 GLU 20 16.769 4.840 4.902
154 HG3 GLU 20 HG1 GLU 20 15.597 6.097 4.510
155 H THR 21 HN THR 21 13.663 3.199 3.558
156 HA THR 21 HA THR 21 15.225 0.783 4.189
157 HB THR 21 HB THR 21 12.759 0.724 2.501
158 HG1 THR 21 HG1 THR 21 11.519 0.445 4.292
159 HG21 THR 21 HG21 THR 21 14.205 -1.225 2.403
160 HG22 THR 21 HG22 THR 21 12.709 -1.630 3.243
161 HG23 THR 21 HG23 THR 21 14.187 -1.351 4.163
162 H ASP 22 HN ASP 22 16.676 2.429 2.945
163 HA ASP 22 HA ASP 22 18.134 2.577 1.212
164 HB2 ASP 22 HB2 ASP 22 18.021 0.124 1.172
165 HB3 ASP 22 HB1 ASP 22 16.622 0.199 0.107
166 H GLY 23 HN GLY 23 15.441 1.386 -0.752
167 HA2 GLY 23 HA2 GLY 23 15.746 3.795 -2.398
168 HA3 GLY 23 HA1 GLY 23 15.026 2.281 -2.921
169 H THR 24 HN THR 24 14.517 4.828 -0.502
170 HA THR 24 HA THR 24 11.645 4.360 -0.631
171 HB THR 24 HB THR 24 13.042 6.413 1.083
172 HG1 THR 24 HG1 THR 24 13.224 3.685 1.159
173 HG21 THR 24 HG21 THR 24 10.501 4.816 1.489
174 HG22 THR 24 HG22 THR 24 10.567 6.490 0.942
175 HG23 THR 24 HG23 THR 24 11.129 6.070 2.561
176 H ASP 25 HN ASP 25 12.689 5.253 -2.982
177 HA ASP 25 HA ASP 25 12.306 8.121 -3.224
178 HB2 ASP 25 HB2 ASP 25 12.888 6.013 -5.330
179 HB3 ASP 25 HB1 ASP 25 12.865 7.749 -5.611
180 H LEU 26 HN LEU 26 10.009 7.334 -2.300
181 HA LEU 26 HA LEU 26 8.203 6.343 -4.331
182 HB2 LEU 26 HB2 LEU 26 7.960 7.034 -1.431
183 HB3 LEU 26 HB1 LEU 26 6.515 6.855 -2.405
184 HG LEU 26 HG LEU 26 7.288 4.543 -2.994
185 HD11 LEU 26 HD11 LEU 26 9.300 5.023 -0.795
186 HD12 LEU 26 HD12 LEU 26 9.673 4.812 -2.506
187 HD13 LEU 26 HD13 LEU 26 8.973 3.482 -1.585
188 HD21 LEU 26 HD21 LEU 26 5.586 4.950 -1.311
189 HD22 LEU 26 HD22 LEU 26 6.832 5.152 -0.078
190 HD23 LEU 26 HD23 LEU 26 6.602 3.584 -0.851
191 H SER 27 HN SER 27 9.467 9.012 -4.697
192 HA SER 27 HA SER 27 7.190 10.819 -4.383
193 HB2 SER 27 HB2 SER 27 10.022 11.409 -5.274
194 HB3 SER 27 HB1 SER 27 8.771 12.604 -4.933
195 HG SER 27 HG SER 27 10.368 12.055 -3.203
196 H GLY 28 HN GLY 28 9.388 9.631 -6.917
197 HA2 GLY 28 HA2 GLY 28 7.965 11.095 -8.965
198 HA3 GLY 28 HA1 GLY 28 9.353 10.046 -9.202
199 H ASP 29 HN ASP 29 6.194 9.368 -7.761
200 HA ASP 29 HA ASP 29 4.529 7.930 -8.242
201 HB2 ASP 29 HB2 ASP 29 5.489 8.587 -11.002
202 HB3 ASP 29 HB1 ASP 29 4.193 7.413 -10.757
203 H PHE 30 HN PHE 30 4.763 6.051 -7.371
204 HA PHE 30 HA PHE 30 6.792 4.198 -8.432
205 HB2 PHE 30 HB2 PHE 30 6.815 3.244 -6.133
206 HB3 PHE 30 HB1 PHE 30 7.261 4.947 -6.160
207 HD1 PHE 30 HD2 PHE 30 5.504 6.659 -5.528
208 HD2 PHE 30 HD1 PHE 30 5.024 2.494 -4.829
209 HE1 PHE 30 HE2 PHE 30 3.756 7.147 -3.867
210 HE2 PHE 30 HE1 PHE 30 3.271 2.971 -3.172
211 HZ PHE 30 HZ PHE 30 2.639 5.305 -2.687
212 H LEU 31 HN LEU 31 3.592 4.669 -8.658
213 HA LEU 31 HA LEU 31 2.319 2.433 -7.651
214 HB2 LEU 31 HB2 LEU 31 1.659 4.038 -10.107
215 HB3 LEU 31 HB1 LEU 31 0.605 2.810 -9.433
216 HG LEU 31 HG LEU 31 1.397 5.442 -8.202
217 HD11 LEU 31 HD11 LEU 31 -1.023 5.781 -8.141
218 HD12 LEU 31 HD12 LEU 31 -1.261 4.205 -8.898
219 HD13 LEU 31 HD13 LEU 31 -0.449 5.495 -9.786
220 HD21 LEU 31 HD21 LEU 31 1.528 3.757 -6.460
221 HD22 LEU 31 HD22 LEU 31 -0.062 3.141 -6.909
222 HD23 LEU 31 HD23 LEU 31 0.101 4.763 -6.233
223 H ASP 32 HN ASP 32 4.104 2.698 -10.687
224 HA ASP 32 HA ASP 32 3.174 0.053 -11.485
225 HB2 ASP 32 HB2 ASP 32 4.675 2.236 -12.879
226 HB3 ASP 32 HB1 ASP 32 4.729 0.596 -13.516
227 H LEU 33 HN LEU 33 5.541 1.121 -9.507
228 HA LEU 33 HA LEU 33 7.500 -0.885 -10.323
229 HB2 LEU 33 HB2 LEU 33 7.521 1.073 -8.020
230 HB3 LEU 33 HB1 LEU 33 8.828 -0.029 -8.418
231 HG LEU 33 HG LEU 33 7.834 2.220 -10.174
232 HD11 LEU 33 HD11 LEU 33 9.975 3.269 -9.664
233 HD12 LEU 33 HD12 LEU 33 10.368 1.946 -8.566
234 HD13 LEU 33 HD13 LEU 33 9.018 3.022 -8.203
235 HD21 LEU 33 HD21 LEU 33 10.147 0.314 -10.526
236 HD22 LEU 33 HD22 LEU 33 9.797 1.707 -11.549
237 HD23 LEU 33 HD23 LEU 33 8.670 0.353 -11.488
238 H ARG 34 HN ARG 34 7.690 -2.847 -9.327
239 HA ARG 34 HA ARG 34 5.511 -3.690 -7.674
240 HB2 ARG 34 HB2 ARG 34 8.074 -5.126 -8.400
241 HB3 ARG 34 HB1 ARG 34 6.708 -5.861 -7.574
242 HG2 ARG 34 HG2 ARG 34 5.312 -5.332 -9.563
243 HG3 ARG 34 HG1 ARG 34 6.779 -4.783 -10.380
244 HD2 ARG 34 HD2 ARG 34 7.773 -7.023 -9.975
245 HD3 ARG 34 HD1 ARG 34 6.228 -7.551 -9.310
246 HE ARG 34 HE ARG 34 6.466 -6.577 -12.087
247 HH11 ARG 34 HH11 ARG 34 5.445 -9.016 -9.772
248 HH12 ARG 34 HH12 ARG 34 4.702 -10.026 -10.972
249 HH21 ARG 34 HH21 ARG 34 5.495 -7.910 -13.673
250 HH22 ARG 34 HH22 ARG 34 4.711 -9.381 -13.198
251 H PHE 35 HN PHE 35 5.839 -4.770 -5.558
252 HA PHE 35 HA PHE 35 7.166 -3.166 -3.700
253 HB2 PHE 35 HB2 PHE 35 6.344 -6.066 -3.438
254 HB3 PHE 35 HB1 PHE 35 6.816 -5.024 -2.099
255 HD1 PHE 35 HD2 PHE 35 5.514 -2.592 -2.366
256 HD2 PHE 35 HD1 PHE 35 4.070 -6.426 -3.524
257 HE1 PHE 35 HE2 PHE 35 3.200 -1.770 -2.190
258 HE2 PHE 35 HE1 PHE 35 1.760 -5.609 -3.355
259 HZ PHE 35 HZ PHE 35 1.318 -3.282 -2.693
260 H GLU 36 HN GLU 36 8.238 -5.899 -5.560
261 HA GLU 36 HA GLU 36 10.723 -6.419 -4.411
262 HB2 GLU 36 HB2 GLU 36 9.975 -6.446 -7.342
263 HB3 GLU 36 HB1 GLU 36 11.374 -7.241 -6.638
264 HG2 GLU 36 HG2 GLU 36 8.510 -7.877 -5.990
265 HG3 GLU 36 HG1 GLU 36 9.537 -8.791 -7.097
266 H ASP 37 HN ASP 37 9.674 -3.772 -6.449
267 HA ASP 37 HA ASP 37 12.346 -2.944 -7.156
268 HB2 ASP 37 HB2 ASP 37 9.639 -1.669 -7.584
269 HB3 ASP 37 HB1 ASP 37 11.143 -0.917 -8.094
270 H ILE 38 HN ILE 38 9.812 -1.903 -4.932
271 HA ILE 38 HA ILE 38 11.471 0.290 -3.995
272 HB ILE 38 HB ILE 38 9.541 0.819 -2.495
273 HG12 ILE 38 HG12 ILE 38 8.191 -1.402 -4.057
274 HG13 ILE 38 HG11 ILE 38 8.600 -1.456 -2.342
275 HG21 ILE 38 HG21 ILE 38 8.945 0.600 -5.446
276 HG22 ILE 38 HG22 ILE 38 9.830 1.904 -4.657
277 HG23 ILE 38 HG23 ILE 38 8.119 1.664 -4.305
278 HD11 ILE 38 HD11 ILE 38 6.231 -0.980 -2.742
279 HD12 ILE 38 HD12 ILE 38 6.682 0.489 -3.608
280 HD13 ILE 38 HD13 ILE 38 7.043 0.330 -1.888
281 H GLY 39 HN GLY 39 11.560 -2.860 -3.430
282 HA2 GLY 39 HA2 GLY 39 12.681 -4.084 -1.853
283 HA3 GLY 39 HA1 GLY 39 13.268 -2.560 -1.217
284 H TYR 40 HN TYR 40 9.955 -3.865 -1.365
285 HA TYR 40 HA TYR 40 9.905 -3.641 1.568
286 HB2 TYR 40 HB2 TYR 40 7.826 -3.085 -0.491
287 HB3 TYR 40 HB1 TYR 40 7.306 -3.675 1.086
288 HD1 TYR 40 HD1 TYR 40 8.937 -0.907 -0.698
289 HD2 TYR 40 HD2 TYR 40 7.520 -2.310 3.058
290 HE1 TYR 40 HE1 TYR 40 9.158 1.361 0.227
291 HE2 TYR 40 HE2 TYR 40 7.729 -0.048 3.989
292 HH TYR 40 HH TYR 40 8.233 2.698 2.057
293 H ASP 41 HN ASP 41 10.078 -5.444 2.565
294 HA ASP 41 HA ASP 41 9.739 -7.993 1.374
295 HB2 ASP 41 HB2 ASP 41 10.000 -7.249 4.296
296 HB3 ASP 41 HB1 ASP 41 10.160 -8.875 3.642
297 H SER 42 HN SER 42 8.401 -9.696 2.210
298 HA SER 42 HA SER 42 5.680 -9.371 2.206
299 HB2 SER 42 HB2 SER 42 5.716 -11.584 3.511
300 HB3 SER 42 HB1 SER 42 6.610 -11.549 1.986
301 H LEU 43 HN LEU 43 7.730 -9.721 5.079
302 HA LEU 43 HA LEU 43 5.766 -9.354 7.025
303 HB2 LEU 43 HB2 LEU 43 8.033 -10.210 7.461
304 HB3 LEU 43 HB1 LEU 43 8.692 -8.615 7.146
305 HG LEU 43 HG LEU 43 7.405 -7.748 9.095
306 HD11 LEU 43 HD11 LEU 43 5.641 -9.431 9.121
307 HD12 LEU 43 HD12 LEU 43 6.462 -9.345 10.679
308 HD13 LEU 43 HD13 LEU 43 6.816 -10.667 9.567
309 HD21 LEU 43 HD21 LEU 43 8.872 -8.731 10.784
310 HD22 LEU 43 HD22 LEU 43 9.752 -8.376 9.296
311 HD23 LEU 43 HD23 LEU 43 9.284 -10.035 9.668
312 H ALA 44 HN ALA 44 7.778 -6.971 5.337
313 HA ALA 44 HA ALA 44 6.990 -4.727 6.842
314 HB1 ALA 44 HB1 ALA 44 7.882 -4.860 3.964
315 HB2 ALA 44 HB2 ALA 44 8.932 -4.688 5.372
316 HB3 ALA 44 HB3 ALA 44 7.804 -3.399 4.950
317 H LEU 45 HN LEU 45 5.627 -6.282 4.007
318 HA LEU 45 HA LEU 45 3.709 -4.340 3.361
319 HB2 LEU 45 HB2 LEU 45 3.822 -7.306 2.860
320 HB3 LEU 45 HB1 LEU 45 2.538 -6.287 2.244
321 HG LEU 45 HG LEU 45 5.454 -5.871 1.608
322 HD11 LEU 45 HD11 LEU 45 3.299 -7.216 -0.018
323 HD12 LEU 45 HD12 LEU 45 4.706 -7.998 0.703
324 HD13 LEU 45 HD13 LEU 45 4.922 -6.815 -0.586
325 HD21 LEU 45 HD21 LEU 45 4.599 -4.396 -0.125
326 HD22 LEU 45 HD22 LEU 45 4.044 -3.869 1.466
327 HD23 LEU 45 HD23 LEU 45 2.944 -4.729 0.384
328 H MET 46 HN MET 46 3.447 -7.287 5.367
329 HA MET 46 HA MET 46 0.680 -6.969 5.865
330 HB2 MET 46 HB2 MET 46 0.904 -8.664 7.557
331 HB3 MET 46 HB1 MET 46 1.885 -9.114 6.170
332 HG2 MET 46 HG2 MET 46 3.885 -8.340 7.339
333 HG3 MET 46 HG1 MET 46 2.897 -7.889 8.727
334 HE1 MET 46 HE1 MET 46 1.563 -9.661 10.228
335 HE2 MET 46 HE2 MET 46 1.553 -11.395 9.898
336 HE3 MET 46 HE3 MET 46 0.778 -10.277 8.773
337 H GLU 47 HN GLU 47 3.535 -5.772 7.567
338 HA GLU 47 HA GLU 47 2.118 -4.651 9.750
339 HB2 GLU 47 HB2 GLU 47 4.749 -3.826 8.514
340 HB3 GLU 47 HB1 GLU 47 4.121 -3.208 10.034
341 HG2 GLU 47 HG2 GLU 47 4.852 -6.074 9.456
342 HG3 GLU 47 HG1 GLU 47 5.805 -4.921 10.388
343 H THR 48 HN THR 48 3.090 -3.392 6.584
344 HA THR 48 HA THR 48 2.189 -0.754 6.941
345 HB THR 48 HB THR 48 2.367 -2.291 4.341
346 HG1 THR 48 HG1 THR 48 4.354 -2.273 5.507
347 HG21 THR 48 HG21 THR 48 2.445 0.673 4.924
348 HG22 THR 48 HG22 THR 48 1.120 -0.195 4.148
349 HG23 THR 48 HG23 THR 48 2.685 -0.072 3.343
350 H ALA 49 HN ALA 49 0.527 -3.666 5.869
351 HA ALA 49 HA ALA 49 -1.778 -2.574 4.782
352 HB1 ALA 49 HB1 ALA 49 -1.611 -5.097 6.414
353 HB2 ALA 49 HB2 ALA 49 -1.178 -4.961 4.709
354 HB3 ALA 49 HB3 ALA 49 -2.845 -4.690 5.221
355 H ALA 50 HN ALA 50 -0.970 -3.157 8.157
356 HA ALA 50 HA ALA 50 -3.545 -2.802 9.244
357 HB1 ALA 50 HB1 ALA 50 -2.383 -2.505 11.387
358 HB2 ALA 50 HB2 ALA 50 -0.848 -2.363 10.528
359 HB3 ALA 50 HB3 ALA 50 -1.747 -3.879 10.483
360 H ARG 51 HN ARG 51 -1.069 -0.573 8.281
361 HA ARG 51 HA ARG 51 -1.996 1.675 9.747
362 HB2 ARG 51 HB2 ARG 51 -0.477 1.931 7.172
363 HB3 ARG 51 HB1 ARG 51 -0.358 2.899 8.627
364 HG2 ARG 51 HG2 ARG 51 0.647 0.084 8.309
365 HG3 ARG 51 HG1 ARG 51 1.633 1.546 8.285
366 HD2 ARG 51 HD2 ARG 51 1.229 1.970 10.572
367 HD3 ARG 51 HD1 ARG 51 -0.099 0.806 10.628
368 HE ARG 51 HE ARG 51 2.195 -0.572 9.875
369 HH11 ARG 51 HH11 ARG 51 1.026 1.172 12.676
370 HH12 ARG 51 HH12 ARG 51 1.888 0.171 13.810
371 HH21 ARG 51 HH21 ARG 51 3.316 -1.885 11.342
372 HH22 ARG 51 HH22 ARG 51 3.193 -1.582 13.049
373 H LEU 52 HN LEU 52 -2.448 0.494 6.457
374 HA LEU 52 HA LEU 52 -3.969 2.712 5.536
375 HB2 LEU 52 HB2 LEU 52 -4.029 -0.109 4.462
376 HB3 LEU 52 HB1 LEU 52 -4.454 1.361 3.607
377 HG LEU 52 HG LEU 52 -1.678 0.629 4.535
378 HD11 LEU 52 HD11 LEU 52 -2.899 0.625 1.780
379 HD12 LEU 52 HD12 LEU 52 -2.440 -0.795 2.717
380 HD13 LEU 52 HD13 LEU 52 -1.201 0.325 2.149
381 HD21 LEU 52 HD21 LEU 52 -2.639 2.937 2.846
382 HD22 LEU 52 HD22 LEU 52 -0.958 2.552 3.218
383 HD23 LEU 52 HD23 LEU 52 -2.055 3.044 4.507
384 H GLU 53 HN GLU 53 -4.836 -0.532 6.681
385 HA GLU 53 HA GLU 53 -7.584 -0.372 6.260
386 HB2 GLU 53 HB2 GLU 53 -6.053 -1.910 8.369
387 HB3 GLU 53 HB1 GLU 53 -7.761 -2.138 8.025
388 HG2 GLU 53 HG2 GLU 53 -7.235 -2.830 5.757
389 HG3 GLU 53 HG1 GLU 53 -5.521 -2.562 6.061
390 H SER 54 HN SER 54 -5.747 0.371 9.221
391 HA SER 54 HA SER 54 -8.031 1.061 10.732
392 HB2 SER 54 HB2 SER 54 -5.790 0.388 11.655
393 HB3 SER 54 HB1 SER 54 -5.193 1.989 11.215
394 HG SER 54 HG SER 54 -7.096 2.736 12.537
395 H ARG 55 HN ARG 55 -5.758 3.012 8.816
396 HA ARG 55 HA ARG 55 -6.720 5.503 9.796
397 HB2 ARG 55 HB2 ARG 55 -4.467 5.303 8.907
398 HB3 ARG 55 HB1 ARG 55 -5.101 4.866 7.326
399 HG2 ARG 55 HG2 ARG 55 -6.023 7.056 7.014
400 HG3 ARG 55 HG1 ARG 55 -5.604 7.517 8.664
401 HD2 ARG 55 HD2 ARG 55 -3.628 6.774 6.508
402 HD3 ARG 55 HD1 ARG 55 -4.025 8.420 6.994
403 HE ARG 55 HE ARG 55 -3.267 7.283 9.319
404 HH11 ARG 55 HH11 ARG 55 -1.727 7.443 6.155
405 HH12 ARG 55 HH12 ARG 55 -0.115 7.388 6.808
406 HH21 ARG 55 HH21 ARG 55 -1.150 7.217 10.148
407 HH22 ARG 55 HH22 ARG 55 0.217 7.255 9.066
408 H TYR 56 HN TYR 56 -7.317 3.729 6.761
409 HA TYR 56 HA TYR 56 -9.110 5.876 5.922
410 HB2 TYR 56 HB2 TYR 56 -8.142 3.460 4.372
411 HB3 TYR 56 HB1 TYR 56 -9.048 4.824 3.715
412 HD1 TYR 56 HD2 TYR 56 -7.985 7.018 3.458
413 HD2 TYR 56 HD1 TYR 56 -5.772 3.666 4.866
414 HE1 TYR 56 HE2 TYR 56 -5.891 8.201 2.964
415 HE2 TYR 56 HE1 TYR 56 -3.666 4.843 4.364
416 HH TYR 56 HH TYR 56 -2.770 6.611 3.201
417 H GLY 57 HN GLY 57 -9.451 3.339 7.818
418 HA2 GLY 57 HA2 GLY 57 -11.314 2.289 8.644
419 HA3 GLY 57 HA1 GLY 57 -12.273 3.369 7.645
420 H VAL 58 HN VAL 58 -9.891 0.884 6.760
421 HA VAL 58 HA VAL 58 -12.027 -0.432 5.220
422 HB VAL 58 HB VAL 58 -10.456 -0.898 3.405
423 HG11 VAL 58 HG11 VAL 58 -10.238 1.362 2.497
424 HG12 VAL 58 HG12 VAL 58 -10.606 2.027 4.088
425 HG13 VAL 58 HG13 VAL 58 -11.822 1.088 3.221
426 HG21 VAL 58 HG21 VAL 58 -8.374 -0.936 4.625
427 HG22 VAL 58 HG22 VAL 58 -8.518 0.783 4.989
428 HG23 VAL 58 HG23 VAL 58 -8.272 0.252 3.325
429 H SER 59 HN SER 59 -10.983 -2.590 4.300
430 HA SER 59 HA SER 59 -9.064 -3.798 6.080
431 HB2 SER 59 HB2 SER 59 -10.549 -5.839 6.319
432 HB3 SER 59 HB1 SER 59 -11.066 -4.430 7.241
433 HG SER 59 HG SER 59 -12.765 -5.510 6.068
434 H ILE 60 HN ILE 60 -7.793 -5.230 4.999
435 HA ILE 60 HA ILE 60 -8.254 -5.369 2.122
436 HB ILE 60 HB ILE 60 -5.817 -6.210 3.706
437 HG12 ILE 60 HG12 ILE 60 -6.343 -3.700 2.092
438 HG13 ILE 60 HG11 ILE 60 -6.285 -3.792 3.851
439 HG21 ILE 60 HG21 ILE 60 -6.007 -7.374 1.571
440 HG22 ILE 60 HG22 ILE 60 -4.671 -6.223 1.539
441 HG23 ILE 60 HG23 ILE 60 -6.194 -5.834 0.736
442 HD11 ILE 60 HD11 ILE 60 -4.232 -2.888 2.944
443 HD12 ILE 60 HD12 ILE 60 -3.997 -4.346 1.979
444 HD13 ILE 60 HD13 ILE 60 -3.939 -4.434 3.740
445 HA PRO 61 HA PRO 61 -10.113 -9.427 2.574
446 HB2 PRO 61 HB2 PRO 61 -9.429 -9.458 -0.324
447 HB3 PRO 61 HB1 PRO 61 -10.960 -9.831 0.475
448 HG2 PRO 61 HG2 PRO 61 -10.643 -7.523 -0.810
449 HG3 PRO 61 HG1 PRO 61 -11.530 -7.599 0.725
450 HD2 PRO 61 HD2 PRO 61 -8.763 -6.617 0.180
451 HD3 PRO 61 HD1 PRO 61 -9.977 -5.994 1.314
452 H ASP 62 HN ASP 62 -9.144 -11.219 3.189
453 HA ASP 62 HA ASP 62 -6.359 -11.522 3.113
454 HB2 ASP 62 HB2 ASP 62 -6.796 -13.787 4.065
455 HB3 ASP 62 HB1 ASP 62 -7.598 -12.478 4.926
456 H ASP 63 HN ASP 63 -8.766 -12.479 0.838
457 HA ASP 63 HA ASP 63 -7.133 -14.452 -0.473
458 HB2 ASP 63 HB2 ASP 63 -9.688 -13.036 -1.176
459 HB3 ASP 63 HB1 ASP 63 -8.827 -13.958 -2.402
460 H VAL 64 HN VAL 64 -8.064 -11.105 -1.208
461 HA VAL 64 HA VAL 64 -6.468 -11.027 -3.584
462 HB VAL 64 HB VAL 64 -7.689 -8.670 -2.140
463 HG11 VAL 64 HG11 VAL 64 -7.747 -7.645 -4.359
464 HG12 VAL 64 HG12 VAL 64 -6.956 -9.068 -5.038
465 HG13 VAL 64 HG13 VAL 64 -6.102 -8.053 -3.873
466 HG21 VAL 64 HG21 VAL 64 -8.966 -10.445 -4.220
467 HG22 VAL 64 HG22 VAL 64 -9.665 -8.979 -3.531
468 HG23 VAL 64 HG23 VAL 64 -9.388 -10.389 -2.509
469 H ALA 65 HN ALA 65 -5.859 -10.458 -0.264
470 HA ALA 65 HA ALA 65 -3.914 -8.451 -0.355
471 HB1 ALA 65 HB1 ALA 65 -3.205 -9.245 1.830
472 HB2 ALA 65 HB2 ALA 65 -4.089 -10.752 1.584
473 HB3 ALA 65 HB3 ALA 65 -4.965 -9.227 1.718
474 H GLY 66 HN GLY 66 -3.630 -11.919 -0.769
475 HA2 GLY 66 HA2 GLY 66 -0.744 -11.613 -1.216
476 HA3 GLY 66 HA1 GLY 66 -1.580 -13.134 -0.933
477 H ARG 67 HN ARG 67 -2.560 -10.614 -3.195
478 HA ARG 67 HA ARG 67 -1.738 -12.253 -5.480
479 HB2 ARG 67 HB2 ARG 67 -4.579 -11.463 -4.819
480 HB3 ARG 67 HB1 ARG 67 -4.083 -11.861 -6.459
481 HG2 ARG 67 HG2 ARG 67 -3.615 -14.080 -5.901
482 HG3 ARG 67 HG1 ARG 67 -3.599 -13.734 -4.174
483 HD2 ARG 67 HD2 ARG 67 -5.622 -14.923 -4.768
484 HD3 ARG 67 HD1 ARG 67 -6.004 -13.285 -4.246
485 HE ARG 67 HE ARG 67 -5.933 -12.958 -6.888
486 HH11 ARG 67 HH11 ARG 67 -7.332 -15.565 -5.014
487 HH12 ARG 67 HH12 ARG 67 -8.677 -15.796 -6.091
488 HH21 ARG 67 HH21 ARG 67 -7.694 -13.262 -8.322
489 HH22 ARG 67 HH22 ARG 67 -8.889 -14.477 -7.968
490 H VAL 68 HN VAL 68 -0.588 -9.879 -4.635
491 HA VAL 68 HA VAL 68 -1.215 -8.146 -6.903
492 HB VAL 68 HB VAL 68 -0.912 -6.104 -5.508
493 HG11 VAL 68 HG11 VAL 68 -3.153 -6.866 -6.141
494 HG12 VAL 68 HG12 VAL 68 -3.151 -6.069 -4.568
495 HG13 VAL 68 HG13 VAL 68 -3.238 -7.828 -4.664
496 HG21 VAL 68 HG21 VAL 68 -1.110 -6.232 -3.095
497 HG22 VAL 68 HG22 VAL 68 0.278 -7.174 -3.638
498 HG23 VAL 68 HG23 VAL 68 -1.212 -7.992 -3.174
499 H ASP 69 HN ASP 69 0.535 -6.491 -7.247
500 HA ASP 69 HA ASP 69 3.148 -7.343 -6.202
501 HB2 ASP 69 HB2 ASP 69 2.284 -7.285 -9.061
502 HB3 ASP 69 HB1 ASP 69 3.932 -6.795 -8.680
503 H THR 70 HN THR 70 1.302 -4.947 -8.023
504 HA THR 70 HA THR 70 3.332 -2.932 -7.325
505 HB THR 70 HB THR 70 2.336 -1.559 -9.132
506 HG1 THR 70 HG1 THR 70 0.694 -3.880 -9.442
507 HG21 THR 70 HG21 THR 70 3.153 -2.905 -11.015
508 HG22 THR 70 HG22 THR 70 3.150 -4.345 -9.997
509 HG23 THR 70 HG23 THR 70 4.248 -3.012 -9.636
510 HA PRO 71 HA PRO 71 0.531 -0.691 -4.652
511 HB2 PRO 71 HB2 PRO 71 1.674 1.698 -5.992
512 HB3 PRO 71 HB1 PRO 71 1.569 1.308 -4.273
513 HG2 PRO 71 HG2 PRO 71 3.893 1.142 -5.568
514 HG3 PRO 71 HG1 PRO 71 3.453 -0.040 -4.321
515 HD2 PRO 71 HD2 PRO 71 3.415 -0.310 -7.297
516 HD3 PRO 71 HD1 PRO 71 3.859 -1.504 -6.059
517 H ARG 72 HN ARG 72 0.797 -0.066 -8.107
518 HA ARG 72 HA ARG 72 -1.470 1.476 -8.553
519 HB2 ARG 72 HB2 ARG 72 0.085 0.940 -10.335
520 HB3 ARG 72 HB1 ARG 72 -0.317 -0.761 -10.225
521 HG2 ARG 72 HG2 ARG 72 -1.373 0.173 -12.160
522 HG3 ARG 72 HG1 ARG 72 -2.610 -0.239 -10.976
523 HD2 ARG 72 HD2 ARG 72 -1.483 2.538 -11.258
524 HD3 ARG 72 HD1 ARG 72 -2.873 1.977 -12.180
525 HE ARG 72 HE ARG 72 -2.856 1.955 -9.234
526 HH11 ARG 72 HH11 ARG 72 -4.398 2.952 -12.248
527 HH12 ARG 72 HH12 ARG 72 -5.867 3.432 -11.454
528 HH21 ARG 72 HH21 ARG 72 -4.762 2.647 -8.226
529 HH22 ARG 72 HH22 ARG 72 -6.071 3.280 -9.175
530 H GLU 73 HN GLU 73 -1.195 -2.049 -8.586
531 HA GLU 73 HA GLU 73 -3.944 -2.600 -8.859
532 HB2 GLU 73 HB2 GLU 73 -1.780 -4.325 -7.627
533 HB3 GLU 73 HB1 GLU 73 -3.334 -4.888 -8.227
534 HG2 GLU 73 HG2 GLU 73 -2.742 -4.571 -10.444
535 HG3 GLU 73 HG1 GLU 73 -1.443 -3.450 -10.041
536 H LEU 74 HN LEU 74 -1.827 -2.500 -6.028
537 HA LEU 74 HA LEU 74 -3.666 -3.284 -4.083
538 HB2 LEU 74 HB2 LEU 74 -1.097 -2.902 -4.004
539 HB3 LEU 74 HB1 LEU 74 -1.509 -1.258 -3.573
540 HG LEU 74 HG LEU 74 -0.944 -2.755 -1.648
541 HD11 LEU 74 HD11 LEU 74 -2.732 -1.967 -0.211
542 HD12 LEU 74 HD12 LEU 74 -3.723 -1.596 -1.621
543 HD13 LEU 74 HD13 LEU 74 -2.227 -0.705 -1.337
544 HD21 LEU 74 HD21 LEU 74 -2.628 -4.352 -0.881
545 HD22 LEU 74 HD22 LEU 74 -1.989 -4.798 -2.462
546 HD23 LEU 74 HD23 LEU 74 -3.580 -4.050 -2.333
547 H LEU 75 HN LEU 75 -2.750 -0.006 -5.111
548 HA LEU 75 HA LEU 75 -4.447 1.430 -3.415
549 HB2 LEU 75 HB2 LEU 75 -2.577 2.392 -4.719
550 HB3 LEU 75 HB1 LEU 75 -3.503 2.164 -6.188
551 HG LEU 75 HG LEU 75 -5.226 3.733 -5.258
552 HD11 LEU 75 HD11 LEU 75 -4.555 5.200 -3.425
553 HD12 LEU 75 HD12 LEU 75 -3.090 4.245 -3.197
554 HD13 LEU 75 HD13 LEU 75 -4.671 3.520 -2.902
555 HD21 LEU 75 HD21 LEU 75 -2.433 4.821 -5.601
556 HD22 LEU 75 HD22 LEU 75 -3.925 5.749 -5.739
557 HD23 LEU 75 HD23 LEU 75 -3.575 4.465 -6.897
558 H ASP 76 HN ASP 76 -4.982 0.153 -6.664
559 HA ASP 76 HA ASP 76 -7.458 1.457 -7.115
560 HB2 ASP 76 HB2 ASP 76 -5.962 0.512 -8.888
561 HB3 ASP 76 HB1 ASP 76 -6.469 -1.099 -8.390
562 H LEU 77 HN LEU 77 -6.586 -1.675 -5.783
563 HA LEU 77 HA LEU 77 -9.154 -2.813 -5.706
564 HB2 LEU 77 HB2 LEU 77 -6.968 -4.000 -5.369
565 HB3 LEU 77 HB1 LEU 77 -6.869 -3.280 -3.780
566 HG LEU 77 HG LEU 77 -7.643 -5.698 -3.907
567 HD11 LEU 77 HD11 LEU 77 -7.926 -4.351 -1.896
568 HD12 LEU 77 HD12 LEU 77 -9.289 -5.445 -2.134
569 HD13 LEU 77 HD13 LEU 77 -9.456 -3.733 -2.521
570 HD21 LEU 77 HD21 LEU 77 -9.133 -5.500 -5.811
571 HD22 LEU 77 HD22 LEU 77 -10.161 -4.382 -4.915
572 HD23 LEU 77 HD23 LEU 77 -10.018 -6.059 -4.392
573 H ILE 78 HN ILE 78 -7.333 -1.044 -3.203
574 HA ILE 78 HA ILE 78 -9.375 -1.122 -1.257
575 HB ILE 78 HB ILE 78 -7.161 0.914 -1.556
576 HG12 ILE 78 HG12 ILE 78 -7.278 -1.699 -0.023
577 HG13 ILE 78 HG11 ILE 78 -6.300 -1.378 -1.450
578 HG21 ILE 78 HG21 ILE 78 -8.951 1.647 -0.052
579 HG22 ILE 78 HG22 ILE 78 -7.466 1.303 0.836
580 HG23 ILE 78 HG23 ILE 78 -8.798 0.145 0.861
581 HD11 ILE 78 HD11 ILE 78 -4.919 -1.299 0.504
582 HD12 ILE 78 HD12 ILE 78 -5.991 -0.123 1.265
583 HD13 ILE 78 HD13 ILE 78 -5.062 0.327 -0.166
584 H ASN 79 HN ASN 79 -8.476 1.382 -3.618
585 HA ASN 79 HA ASN 79 -10.420 3.271 -2.890
586 HB2 ASN 79 HB2 ASN 79 -8.641 2.818 -5.188
587 HB3 ASN 79 HB1 ASN 79 -10.116 3.696 -5.577
588 HD21 ASN 79 HD21 ASN 79 -7.155 3.740 -3.749
589 HD22 ASN 79 HD22 ASN 79 -7.176 5.430 -3.378
590 H GLY 80 HN GLY 80 -10.555 0.519 -5.106
591 HA2 GLY 80 HA2 GLY 80 -13.092 1.084 -6.226
592 HA3 GLY 80 HA1 GLY 80 -12.313 -0.490 -6.184
593 H ALA 81 HN ALA 81 -12.111 -0.702 -3.352
594 HA ALA 81 HA ALA 81 -14.713 -1.709 -2.770
595 HB1 ALA 81 HB1 ALA 81 -12.329 -1.344 -0.954
596 HB2 ALA 81 HB2 ALA 81 -12.708 -2.783 -1.902
597 HB3 ALA 81 HB3 ALA 81 -13.770 -2.290 -0.584
598 H LEU 82 HN LEU 82 -13.023 1.248 -2.070
599 HA LEU 82 HA LEU 82 -14.790 2.155 -0.012
600 HB2 LEU 82 HB2 LEU 82 -12.732 3.532 -1.723
601 HB3 LEU 82 HB1 LEU 82 -13.716 4.408 -0.568
602 HG LEU 82 HG LEU 82 -11.884 2.122 0.144
603 HD11 LEU 82 HD11 LEU 82 -11.491 5.094 0.486
604 HD12 LEU 82 HD12 LEU 82 -10.611 4.054 -0.636
605 HD13 LEU 82 HD13 LEU 82 -10.427 3.829 1.104
606 HD21 LEU 82 HD21 LEU 82 -13.395 4.092 1.853
607 HD22 LEU 82 HD22 LEU 82 -12.282 2.854 2.438
608 HD23 LEU 82 HD23 LEU 82 -13.787 2.386 1.646
609 H ALA 83 HN ALA 83 -14.957 2.057 -3.427
610 HA ALA 83 HA ALA 83 -16.580 4.316 -3.910
611 HB1 ALA 83 HB1 ALA 83 -16.385 1.752 -5.482
612 HB2 ALA 83 HB2 ALA 83 -15.373 3.182 -5.689
613 HB3 ALA 83 HB3 ALA 83 -17.097 3.262 -6.052
614 H GLU 84 HN GLU 84 -17.333 1.139 -2.675
615 HA GLU 84 HA GLU 84 -20.199 1.715 -2.936
616 HB2 GLU 84 HB2 GLU 84 -20.576 -0.613 -2.311
617 HB3 GLU 84 HB1 GLU 84 -19.491 -0.499 -3.687
618 HG2 GLU 84 HG2 GLU 84 -17.586 -0.930 -2.257
619 HG3 GLU 84 HG1 GLU 84 -18.634 -0.960 -0.838
620 H ALA 85 HN ALA 85 -17.913 2.562 -0.905
621 HA ALA 85 HA ALA 85 -19.327 1.943 1.579
622 HB1 ALA 85 HB1 ALA 85 -16.693 3.355 1.143
623 HB2 ALA 85 HB2 ALA 85 -16.899 1.654 1.561
624 HB3 ALA 85 HB3 ALA 85 -17.382 2.907 2.704
625 H ALA 86 HN ALA 86 -19.523 4.156 -0.801
626 HA ALA 86 HA ALA 86 -20.044 6.453 0.924
627 HB1 ALA 86 HB1 ALA 86 -20.071 6.270 -2.095
628 HB2 ALA 86 HB2 ALA 86 -18.718 6.834 -1.113
629 HB3 ALA 86 HB3 ALA 86 -20.229 7.741 -1.139
630 H28 SXO 87 H28B SXO 87 6.428 -12.127 5.740
631 H28A SXO 87 H28A SXO 87 7.433 -13.355 6.517
632 H30 SXO 87 H30A SXO 87 3.841 -13.431 7.745
633 H30A SXO 87 H30C SXO 87 5.468 -12.969 8.242
634 H30B SXO 87 H30B SXO 87 4.619 -12.023 7.018
635 H31 SXO 87 H31A SXO 87 3.480 -14.573 5.533
636 H31A SXO 87 H31B SXO 87 4.812 -14.614 4.375
637 H31B SXO 87 H31C SXO 87 4.076 -13.075 4.817
638 H32 SXO 87 H32A SXO 87 6.190 -15.181 7.869
639 HO33 SXO 87 H33A SXO 87 6.176 -16.714 5.603
640 HN36 SXO 87 H36A SXO 87 3.704 -14.913 8.369
641 H37 SXO 87 H37A SXO 87 2.453 -17.523 7.985
642 H37A SXO 87 H37B SXO 87 2.012 -16.304 9.183
643 H38 SXO 87 H38B SXO 87 0.307 -16.600 7.424
644 H38A SXO 87 H38A SXO 87 1.490 -16.097 6.222
645 HN41 SXO 87 H41A SXO 87 0.043 -14.485 5.633
646 H42 SXO 87 H42A SXO 87 -1.195 -12.520 7.025
647 H42A SXO 87 H42B SXO 87 0.467 -11.939 6.891
648 H43 SXO 87 H43B SXO 87 -1.147 -12.823 4.501
649 H43A SXO 87 H43A SXO 87 -1.124 -11.151 5.094
650 H2 SXO 87 H2A SXO 87 0.581 -10.570 0.750
651 H2A SXO 87 H2B SXO 87 2.032 -10.812 1.726
652 H3 SXO 87 H3B SXO 87 1.305 -9.067 3.263
653 H3A SXO 87 H3A SXO 87 1.398 -8.450 1.611
654 H4 SXO 87 H4A SXO 87 -1.106 -9.292 3.084
655 H4A SXO 87 H4B SXO 87 -1.049 -8.780 1.395
656 H5 SXO 87 H5B SXO 87 -1.747 -6.985 2.989
657 H5A SXO 87 H5A SXO 87 -0.139 -7.068 3.703
658 H6 SXO 87 H6A SXO 87 -0.715 -6.441 0.810
659 H6A SXO 87 H6B SXO 87 0.872 -6.455 1.583
660 H7 SXO 87 H7A SXO 87 0.185 -4.615 3.049
661 H7A SXO 87 H7B SXO 87 -1.416 -4.604 2.290
662 H8 SXO 87 H8C SXO 87 0.030 -2.859 1.369
663 H8A SXO 87 H8A SXO 87 -0.390 -4.054 0.145
664 H8B SXO 87 H8B SXO 87 1.207 -4.082 0.894
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