Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
23619 | 2jx5 RC | 15547 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 HA MET 1 HA MET 1 2.578 0.479 -4.265
2 H1 MET 1 H MET 1 2.166 0.468 -1.374
3 HB2 MET 1 2HB MET 1 4.271 2.065 -4.290
4 HB3 MET 1 3HB MET 1 3.130 2.763 -3.149
5 HG2 MET 1 2HG MET 1 4.453 2.024 -1.289
6 HG3 MET 1 3HG MET 1 5.540 1.147 -2.363
7 HE1 MET 1 3HE MET 1 3.765 4.465 -2.340
8 HE2 MET 1 1HE MET 1 5.025 5.692 -2.473
9 HE3 MET 1 2HE MET 1 4.549 4.760 -3.893
10 H LEU 2 H LEU 2 4.392 -0.720 -4.954
11 HA LEU 2 HA LEU 2 5.270 -2.703 -2.994
12 HG LEU 2 HG LEU 2 6.601 -4.783 -4.458
13 HB2 LEU 2 2HB LEU 2 4.321 -3.077 -5.450
14 HB3 LEU 2 3HB LEU 2 6.025 -2.889 -5.859
15 HD11 LEU 2 1HD1 LEU 2 5.303 -5.368 -2.761
16 HD12 LEU 2 2HD1 LEU 2 4.094 -5.943 -3.908
17 HD13 LEU 2 3HD1 LEU 2 4.030 -4.282 -3.320
18 HD21 LEU 2 3HD2 LEU 2 5.515 -4.936 -6.877
19 HD22 LEU 2 1HD2 LEU 2 4.292 -5.845 -5.988
20 HD23 LEU 2 2HD2 LEU 2 5.976 -6.372 -5.961
21 H VAL 3 H VAL 3 7.438 -3.203 -2.633
22 HA VAL 3 HA VAL 3 9.457 -1.450 -3.823
23 HB VAL 3 HB VAL 3 9.478 -1.907 -0.855
24 HG11 VAL 3 1HG1 VAL 3 11.441 -0.889 -1.055
25 HG12 VAL 3 2HG1 VAL 3 11.166 -0.605 -2.775
26 HG13 VAL 3 3HG1 VAL 3 10.591 0.563 -1.585
27 HG21 VAL 3 3HG2 VAL 3 8.486 0.337 -0.582
28 HG22 VAL 3 1HG2 VAL 3 8.172 0.386 -2.316
29 HG23 VAL 3 2HG2 VAL 3 7.365 -0.814 -1.308
30 H ILE 4 H ILE 4 11.035 -2.683 -4.578
31 HA ILE 4 HA ILE 4 11.396 -5.380 -3.534
32 HB ILE 4 HB ILE 4 12.498 -3.971 -5.958
33 HG12 ILE 4 2HG1 ILE 4 10.127 -4.892 -5.910
34 HG13 ILE 4 3HG1 ILE 4 11.159 -5.482 -7.208
35 HG21 ILE 4 1HG2 ILE 4 13.438 -6.417 -4.595
36 HG22 ILE 4 2HG2 ILE 4 13.281 -6.502 -6.349
37 HG23 ILE 4 3HG2 ILE 4 14.314 -5.276 -5.615
38 HD11 ILE 4 3HD1 ILE 4 11.275 -7.144 -4.827
39 HD12 ILE 4 1HD1 ILE 4 9.655 -7.021 -5.514
40 HD13 ILE 4 2HD1 ILE 4 10.996 -7.586 -6.512
41 H VAL 5 H VAL 5 12.466 -5.160 -1.603
42 HA VAL 5 HA VAL 5 14.832 -3.517 -1.384
43 HB VAL 5 HB VAL 5 13.612 -5.475 0.568
44 HG11 VAL 5 1HG1 VAL 5 15.145 -3.714 2.011
45 HG12 VAL 5 2HG1 VAL 5 15.602 -5.364 1.583
46 HG13 VAL 5 3HG1 VAL 5 16.135 -4.011 0.583
47 HG21 VAL 5 3HG2 VAL 5 12.074 -3.773 0.498
48 HG22 VAL 5 1HG2 VAL 5 13.178 -3.155 1.727
49 HG23 VAL 5 2HG2 VAL 5 13.276 -2.556 0.071
50 H ARG 6 H ARG 6 16.802 -4.141 -1.945
51 HA ARG 6 HA ARG 6 17.336 -6.997 -2.325
52 HE ARG 6 HE ARG 6 19.889 -4.808 -5.539
53 HB2 ARG 6 2HB ARG 6 18.951 -4.608 -3.234
54 HB3 ARG 6 3HB ARG 6 19.250 -6.287 -3.662
55 HG2 ARG 6 2HG ARG 6 16.643 -5.929 -4.431
56 HG3 ARG 6 3HG ARG 6 17.382 -4.370 -4.800
57 HD2 ARG 6 2HD ARG 6 18.179 -7.092 -5.798
58 HD3 ARG 6 3HD ARG 6 17.628 -5.707 -6.739
59 HH11 ARG 6 1HH1 ARG 6 19.132 -7.583 -7.499
60 HH12 ARG 6 2HH1 ARG 6 20.718 -7.693 -8.188
61 HH21 ARG 6 1HH2 ARG 6 21.981 -4.942 -6.439
62 HH22 ARG 6 2HH2 ARG 6 22.338 -6.191 -7.583
63 H LEU 7 H LEU 7 18.391 -8.057 -0.793
64 HA LEU 7 HA LEU 7 19.744 -6.648 1.327
65 HG LEU 7 HG LEU 7 19.055 -7.610 3.242
66 HB2 LEU 7 2HB LEU 7 18.755 -9.348 0.834
67 HB3 LEU 7 3HB LEU 7 20.297 -9.317 1.686
68 HD11 LEU 7 1HD1 LEU 7 16.754 -7.733 3.349
69 HD12 LEU 7 2HD1 LEU 7 16.687 -9.259 2.468
70 HD13 LEU 7 3HD1 LEU 7 17.041 -7.760 1.609
71 HD21 LEU 7 3HD2 LEU 7 19.922 -9.977 3.699
72 HD22 LEU 7 1HD2 LEU 7 18.251 -10.492 3.468
73 HD23 LEU 7 2HD2 LEU 7 18.651 -9.350 4.750
74 H GLN 8 H GLN 8 21.933 -7.414 2.055
75 HA GLN 8 HA GLN 8 23.988 -6.691 0.600
76 HB2 GLN 8 2HB GLN 8 23.915 -7.991 2.880
77 HB3 GLN 8 3HB GLN 8 24.328 -9.375 1.877
78 HG2 GLN 8 2HG GLN 8 25.930 -6.959 2.532
79 HG3 GLN 8 3HG GLN 8 26.400 -8.658 2.519
80 HE21 GLN 8 1HE2 GLN 8 26.338 -5.740 0.797
81 HE22 GLN 8 2HE2 GLN 8 26.990 -6.324 -0.692
82 H ASP 9 H ASP 9 22.969 -10.108 0.433
83 HA ASP 9 HA ASP 9 23.672 -10.105 -2.416
84 HB2 ASP 9 2HB ASP 9 25.440 -11.136 -0.732
85 HB3 ASP 9 3HB ASP 9 24.354 -12.521 -0.799
86 H GLN 10 H GLN 10 21.107 -9.880 -1.386
87 HA GLN 10 HA GLN 10 19.891 -12.252 -2.510
88 HB2 GLN 10 2HB GLN 10 19.502 -11.462 0.372
89 HB3 GLN 10 3HB GLN 10 18.329 -12.439 -0.500
90 HG2 GLN 10 2HG GLN 10 20.086 -14.109 -0.937
91 HG3 GLN 10 3HG GLN 10 21.209 -13.142 0.018
92 HE21 GLN 10 1HE2 GLN 10 20.977 -13.055 2.244
93 HE22 GLN 10 2HE2 GLN 10 19.987 -14.170 3.115
94 H THR 11 H THR 11 17.421 -11.986 -2.498
95 HA THR 11 HA THR 11 16.673 -9.151 -2.705
96 HB THR 11 HB THR 11 15.886 -11.222 -4.759
97 HG1 THR 11 HG1 THR 11 17.818 -10.848 -5.535
98 HG21 THR 11 3HG2 THR 11 15.270 -8.350 -4.308
99 HG22 THR 11 1HG2 THR 11 14.252 -9.636 -4.956
100 HG23 THR 11 2HG2 THR 11 15.487 -8.890 -5.972
101 H LEU 12 H LEU 12 14.664 -8.658 -1.988
102 HA LEU 12 HA LEU 12 12.634 -10.685 -1.673
103 HG LEU 12 HG LEU 12 12.723 -11.424 1.905
104 HB2 LEU 12 2HB LEU 12 14.352 -10.478 0.397
105 HB3 LEU 12 3HB LEU 12 13.167 -9.254 0.850
106 HD11 LEU 12 1HD1 LEU 12 10.404 -11.464 0.235
107 HD12 LEU 12 2HD1 LEU 12 10.910 -9.796 0.502
108 HD13 LEU 12 3HD1 LEU 12 10.585 -10.849 1.878
109 HD21 LEU 12 3HD2 LEU 12 13.526 -12.531 -0.440
110 HD22 LEU 12 1HD2 LEU 12 11.773 -12.675 -0.574
111 HD23 LEU 12 2HD2 LEU 12 12.613 -13.381 0.808
112 HA PRO 13 HA PRO 13 10.398 -6.952 -2.615
113 HB2 PRO 13 2HB PRO 13 7.948 -8.118 -2.734
114 HB3 PRO 13 3HB PRO 13 9.139 -8.251 -4.033
115 HG2 PRO 13 2HG PRO 13 8.474 -10.205 -1.866
116 HG3 PRO 13 3HG PRO 13 8.772 -10.503 -3.588
117 HD2 PRO 13 2HD PRO 13 10.652 -10.937 -1.689
118 HD3 PRO 13 3HD PRO 13 11.061 -10.418 -3.337
119 H PHE 14 H PHE 14 8.641 -5.704 -1.663
120 HA PHE 14 HA PHE 14 7.784 -6.489 1.009
121 HD1 PHE 14 HD1 PHE 14 8.474 -5.388 3.687
122 HD2 PHE 14 HD2 PHE 14 11.507 -5.673 0.715
123 HE1 PHE 14 HE1 PHE 14 9.927 -6.564 5.288
124 HE2 PHE 14 HE2 PHE 14 12.965 -6.850 2.310
125 HZ PHE 14 HZ PHE 14 12.175 -7.297 4.600
126 HB2 PHE 14 2HB PHE 14 9.637 -4.228 0.404
127 HB3 PHE 14 3HB PHE 14 8.430 -4.002 1.666
128 H GLU 15 H GLU 15 5.804 -5.719 1.545
129 HA GLU 15 HA GLU 15 4.405 -4.181 -0.509
130 HB2 GLU 15 2HB GLU 15 3.314 -6.223 0.161
131 HB3 GLU 15 3HB GLU 15 3.407 -5.770 1.858
132 HG2 GLU 15 2HG GLU 15 1.783 -4.085 1.604
133 HG3 GLU 15 3HG GLU 15 1.879 -4.152 -0.155
134 H LEU 16 H LEU 16 4.119 -2.073 -0.282
135 HA LEU 16 HA LEU 16 4.114 -0.936 2.437
136 HG LEU 16 HG LEU 16 7.274 0.302 1.008
137 HB2 LEU 16 2HB LEU 16 5.331 0.004 -0.115
138 HB3 LEU 16 3HB LEU 16 4.775 1.201 1.053
139 HD11 LEU 16 1HD1 LEU 16 5.973 1.956 2.565
140 HD12 LEU 16 2HD1 LEU 16 7.541 1.312 3.049
141 HD13 LEU 16 3HD1 LEU 16 6.061 0.618 3.711
142 HD21 LEU 16 3HD2 LEU 16 7.652 -1.449 2.606
143 HD22 LEU 16 1HD2 LEU 16 6.543 -2.044 1.370
144 HD23 LEU 16 2HD2 LEU 16 5.926 -1.567 2.952
145 HA PRO 17 HA PRO 17 0.155 0.826 1.749
146 HB2 PRO 17 2HB PRO 17 0.385 3.267 2.915
147 HB3 PRO 17 3HB PRO 17 0.310 1.763 3.841
148 HG2 PRO 17 2HG PRO 17 2.697 3.399 3.075
149 HG3 PRO 17 3HG PRO 17 2.324 2.622 4.624
150 HD2 PRO 17 2HD PRO 17 4.042 1.544 2.831
151 HD3 PRO 17 3HD PRO 17 3.031 0.551 3.900
152 H ALA 18 H ALA 18 -0.971 2.877 0.938
153 HA ALA 18 HA ALA 18 -0.051 3.453 -1.666
154 HB1 ALA 18 1HB ALA 18 -2.373 4.067 -0.048
155 HB2 ALA 18 2HB ALA 18 -1.896 5.429 -1.062
156 HB3 ALA 18 3HB ALA 18 -2.235 3.861 -1.795
157 H GLY 19 H GLY 19 0.980 5.204 -2.533
158 HA2 GLY 19 2HA GLY 19 2.442 6.976 -2.576
159 HA3 GLY 19 3HA GLY 19 1.342 7.709 -1.418
160 H ALA 20 H ALA 20 2.935 4.743 -0.603
161 HA ALA 20 HA ALA 20 3.982 5.627 1.794
162 HB1 ALA 20 1HB ALA 20 4.131 3.252 0.208
163 HB2 ALA 20 2HB ALA 20 5.723 3.615 0.876
164 HB3 ALA 20 3HB ALA 20 4.334 3.443 1.949
165 H ARG 21 H ARG 21 6.418 5.553 2.326
166 HA ARG 21 HA ARG 21 8.092 6.741 0.262
167 HE ARG 21 HE ARG 21 5.975 10.112 5.432
168 HB2 ARG 21 2HB ARG 21 8.752 8.571 1.930
169 HB3 ARG 21 3HB ARG 21 7.213 8.750 1.098
170 HG2 ARG 21 2HG ARG 21 6.037 7.921 3.060
171 HG3 ARG 21 3HG ARG 21 7.576 7.695 3.895
172 HD2 ARG 21 2HD ARG 21 7.891 9.940 4.209
173 HD3 ARG 21 3HD ARG 21 6.967 10.379 2.773
174 HH11 ARG 21 1HH1 ARG 21 5.127 9.748 2.075
175 HH12 ARG 21 2HH1 ARG 21 3.433 9.998 2.341
176 HH21 ARG 21 1HH2 ARG 21 3.747 10.443 5.795
177 HH22 ARG 21 2HH2 ARG 21 2.649 10.394 4.457
178 H ALA 22 H ALA 22 10.339 7.255 1.298
179 HA ALA 22 HA ALA 22 11.511 4.888 2.101
180 HB1 ALA 22 1HB ALA 22 12.497 7.225 1.316
181 HB2 ALA 22 2HB ALA 22 12.765 7.401 3.051
182 HB3 ALA 22 3HB ALA 22 13.471 6.037 2.184
183 H SER 23 H SER 23 9.896 7.294 4.018
184 HA SER 23 HA SER 23 10.958 6.668 6.543
185 HG SER 23 HG SER 23 8.140 7.958 8.066
186 HB2 SER 23 2HB SER 23 9.738 8.542 6.850
187 HB3 SER 23 3HB SER 23 8.670 8.173 5.497
188 H GLN 24 H GLN 24 7.781 5.710 5.228
189 HA GLN 24 HA GLN 24 7.113 3.871 7.183
190 HB2 GLN 24 2HB GLN 24 6.104 4.655 4.648
191 HB3 GLN 24 3HB GLN 24 6.175 2.898 4.663
192 HG2 GLN 24 2HG GLN 24 4.224 2.943 5.709
193 HG3 GLN 24 3HG GLN 24 5.096 3.532 7.124
194 HE21 GLN 24 1HE2 GLN 24 2.362 4.057 6.289
195 HE22 GLN 24 2HE2 GLN 24 2.227 5.771 6.122
196 H LEU 25 H LEU 25 8.795 3.278 4.106
197 HA LEU 25 HA LEU 25 9.104 0.531 4.314
198 HG LEU 25 HG LEU 25 11.931 0.133 3.001
199 HB2 LEU 25 2HB LEU 25 9.667 2.013 2.356
200 HB3 LEU 25 3HB LEU 25 11.172 2.404 3.186
201 HD11 LEU 25 1HD1 LEU 25 9.811 -1.007 3.339
202 HD12 LEU 25 2HD1 LEU 25 10.603 -1.586 1.873
203 HD13 LEU 25 3HD1 LEU 25 9.249 -0.462 1.758
204 HD21 LEU 25 3HD2 LEU 25 12.229 1.648 1.062
205 HD22 LEU 25 1HD2 LEU 25 10.754 0.984 0.358
206 HD23 LEU 25 2HD2 LEU 25 12.156 -0.057 0.612
207 H SER 26 H SER 26 11.425 3.044 5.321
208 HA SER 26 HA SER 26 13.369 1.420 6.412
209 HG SER 26 HG SER 26 15.138 3.386 6.634
210 HB2 SER 26 2HB SER 26 12.488 4.222 6.889
211 HB3 SER 26 3HB SER 26 13.563 3.501 8.086
212 H ASN 27 H ASN 27 10.295 2.407 7.776
213 HA ASN 27 HA ASN 27 10.793 1.561 10.432
214 HB2 ASN 27 2HB ASN 27 8.948 3.109 9.702
215 HB3 ASN 27 3HB ASN 27 8.108 1.706 9.049
216 HD21 ASN 27 1HD2 ASN 27 6.531 2.701 10.652
217 HD22 ASN 27 2HD2 ASN 27 6.569 2.055 12.254
218 H LEU 28 H LEU 28 9.066 0.000 7.736
219 HA LEU 28 HA LEU 28 8.358 -2.361 8.990
220 HG LEU 28 HG LEU 28 6.676 -2.370 5.716
221 HB2 LEU 28 2HB LEU 28 8.988 -1.645 6.161
222 HB3 LEU 28 3HB LEU 28 8.700 -3.330 6.587
223 HD11 LEU 28 1HD1 LEU 28 5.336 -3.342 7.232
224 HD12 LEU 28 2HD1 LEU 28 5.931 -2.340 8.555
225 HD13 LEU 28 3HD1 LEU 28 6.850 -3.753 8.038
226 HD21 LEU 28 3HD2 LEU 28 5.569 -0.488 6.907
227 HD22 LEU 28 1HD2 LEU 28 7.067 -0.034 6.095
228 HD23 LEU 28 2HD2 LEU 28 7.048 -0.266 7.843
229 H LEU 29 H LEU 29 11.330 -1.683 7.149
230 HA LEU 29 HA LEU 29 12.512 -4.209 7.639
231 HG LEU 29 HG LEU 29 12.433 -3.601 5.282
232 HB2 LEU 29 2HB LEU 29 13.599 -1.551 6.765
233 HB3 LEU 29 3HB LEU 29 14.650 -2.942 7.022
234 HD11 LEU 29 1HD1 LEU 29 13.925 -1.098 4.766
235 HD12 LEU 29 2HD1 LEU 29 12.294 -1.568 4.291
236 HD13 LEU 29 3HD1 LEU 29 13.684 -2.190 3.402
237 HD21 LEU 29 3HD2 LEU 29 14.163 -4.527 3.935
238 HD22 LEU 29 1HD2 LEU 29 14.590 -4.835 5.618
239 HD23 LEU 29 2HD2 LEU 29 15.393 -3.541 4.728
240 H SER 30 H SER 30 12.562 -1.145 9.347
241 HA SER 30 HA SER 30 14.691 -1.739 11.108
242 HG SER 30 HG SER 30 13.669 1.018 13.096
243 HB2 SER 30 2HB SER 30 14.180 0.527 11.051
244 HB3 SER 30 3HB SER 30 12.440 0.241 11.110
245 H SER 31 H SER 31 11.254 -2.418 11.185
246 HA SER 31 HA SER 31 10.889 -3.081 13.845
247 HG SER 31 HG SER 31 8.074 -4.090 13.609
248 HB2 SER 31 2HB SER 31 9.079 -2.985 12.145
249 HB3 SER 31 3HB SER 31 9.665 -4.504 11.468
250 H SER 32 H SER 32 12.411 -4.920 11.280
251 HA SER 32 HA SER 32 12.523 -7.398 12.661
252 HG SER 32 HG SER 32 14.959 -8.460 10.350
253 HB2 SER 32 2HB SER 32 12.782 -7.116 10.179
254 HB3 SER 32 3HB SER 32 14.381 -6.433 10.476
255 H GLY 33 H GLY 33 14.883 -8.396 12.909
256 HA2 GLY 33 2HA GLY 33 16.048 -6.997 15.115
257 HA3 GLY 33 3HA GLY 33 16.620 -8.507 14.422
258 H MET 34 H MET 34 16.981 -7.521 11.755
259 HA MET 34 HA MET 34 19.560 -6.282 12.115
260 HB2 MET 34 2HB MET 34 18.192 -7.775 10.034
261 HB3 MET 34 3HB MET 34 19.021 -6.368 9.381
262 HG2 MET 34 2HG MET 34 21.098 -7.146 9.962
263 HG3 MET 34 3HG MET 34 20.473 -8.156 11.264
264 HE1 MET 34 3HE MET 34 22.444 -9.311 10.231
265 HE2 MET 34 1HE MET 34 21.735 -10.919 10.087
266 HE3 MET 34 2HE MET 34 22.473 -10.152 8.681
267 H ALA 35 H ALA 35 20.239 -4.347 11.019
268 HA ALA 35 HA ALA 35 18.213 -2.548 10.001
269 HB1 ALA 35 1HB ALA 35 19.257 -2.333 12.730
270 HB2 ALA 35 2HB ALA 35 19.349 -0.842 11.793
271 HB3 ALA 35 3HB ALA 35 17.797 -1.650 12.013
272 H PHE 36 H PHE 36 19.286 -2.253 8.114
273 HA PHE 36 HA PHE 36 21.982 -1.078 8.293
274 HD1 PHE 36 HD1 PHE 36 19.800 -2.385 4.835
275 HD2 PHE 36 HD2 PHE 36 21.348 -4.963 7.848
276 HE1 PHE 36 HE1 PHE 36 18.115 -4.078 4.247
277 HE2 PHE 36 HE2 PHE 36 19.665 -6.660 7.264
278 HZ PHE 36 HZ PHE 36 18.046 -6.220 5.462
279 HB2 PHE 36 2HB PHE 36 22.067 -2.077 5.821
280 HB3 PHE 36 3HB PHE 36 22.537 -3.026 7.228
281 H SER 37 H SER 37 22.494 0.041 6.066
282 HA SER 37 HA SER 37 20.600 2.165 5.812
283 HG SER 37 HG SER 37 22.696 4.181 4.703
284 HB2 SER 37 2HB SER 37 23.338 1.660 5.033
285 HB3 SER 37 3HB SER 37 22.435 2.366 3.693
286 H LEU 38 H LEU 38 19.381 2.759 4.005
287 HA LEU 38 HA LEU 38 19.063 0.702 1.927
288 HG LEU 38 HG LEU 38 17.858 -0.706 3.277
289 HB2 LEU 38 2HB LEU 38 16.997 1.951 3.674
290 HB3 LEU 38 3HB LEU 38 16.568 1.521 2.020
291 HD11 LEU 38 1HD1 LEU 38 15.554 0.502 4.796
292 HD12 LEU 38 2HD1 LEU 38 17.179 0.177 5.398
293 HD13 LEU 38 3HD1 LEU 38 16.109 -1.162 4.982
294 HD21 LEU 38 3HD2 LEU 38 16.455 -1.067 1.430
295 HD22 LEU 38 1HD2 LEU 38 15.140 -0.126 2.136
296 HD23 LEU 38 2HD2 LEU 38 15.558 -1.701 2.811
297 H HIS 39 H HIS 39 20.039 1.789 0.287
298 HA HIS 39 HA HIS 39 18.879 4.399 -0.441
299 HD1 HIS 39 HD1 HIS 39 21.616 2.237 -2.581
300 HD2 HIS 39 HD2 HIS 39 23.315 3.433 1.017
301 HE1 HIS 39 HE1 HIS 39 23.594 0.724 -2.236
302 HB2 HIS 39 2HB HIS 39 21.094 4.863 -1.555
303 HB3 HIS 39 3HB HIS 39 21.144 4.801 0.205
304 H THR 40 H THR 40 18.569 4.819 -2.658
305 HA THR 40 HA THR 40 18.710 2.454 -4.409
306 HB THR 40 HB THR 40 16.383 2.798 -3.714
307 HG1 THR 40 HG1 THR 40 15.557 2.730 -5.785
308 HG21 THR 40 3HG2 THR 40 17.040 5.578 -4.315
309 HG22 THR 40 1HG2 THR 40 15.764 4.913 -3.295
310 HG23 THR 40 2HG2 THR 40 15.519 5.051 -5.036
311 H GLN 41 H GLN 41 18.826 2.921 -6.695
312 HA GLN 41 HA GLN 41 19.801 3.942 -8.479
313 HB2 GLN 41 2HB GLN 41 17.873 5.695 -7.447
314 HB3 GLN 41 3HB GLN 41 19.283 6.696 -7.765
315 HG2 GLN 41 2HG GLN 41 19.322 5.604 -10.069
316 HG3 GLN 41 3HG GLN 41 17.698 5.035 -9.689
317 HE21 GLN 41 1HE2 GLN 41 16.167 6.266 -10.483
318 HE22 GLN 41 2HE2 GLN 41 16.240 7.977 -10.711
319 H GLY 42 H GLY 42 21.332 3.631 -5.949
320 HA2 GLY 42 2HA GLY 42 23.519 4.037 -5.344
321 HA3 GLY 42 3HA GLY 42 23.674 5.043 -6.776
322 H ARG 43 H ARG 43 21.067 5.876 -4.751
323 HA ARG 43 HA ARG 43 22.664 7.901 -3.348
324 HE ARG 43 HE ARG 43 22.820 10.225 -7.839
325 HB2 ARG 43 2HB ARG 43 20.135 8.422 -4.920
326 HB3 ARG 43 3HB ARG 43 20.886 9.581 -3.831
327 HG2 ARG 43 2HG ARG 43 22.894 9.592 -5.221
328 HG3 ARG 43 3HG ARG 43 22.141 8.427 -6.312
329 HD2 ARG 43 2HD ARG 43 20.343 10.052 -6.762
330 HD3 ARG 43 3HD ARG 43 21.159 11.217 -5.719
331 HH11 ARG 43 1HH1 ARG 43 20.414 12.584 -6.965
332 HH12 ARG 43 2HH1 ARG 43 20.879 13.708 -8.198
333 HH21 ARG 43 1HH2 ARG 43 23.442 11.696 -9.467
334 HH22 ARG 43 2HH2 ARG 43 22.601 13.201 -9.622
335 H VAL 44 H VAL 44 21.887 8.523 -1.344
336 HA VAL 44 HA VAL 44 20.355 6.630 0.075
337 HB VAL 44 HB VAL 44 20.901 9.471 0.936
338 HG11 VAL 44 1HG1 VAL 44 19.385 8.514 2.442
339 HG12 VAL 44 2HG1 VAL 44 20.179 6.939 2.379
340 HG13 VAL 44 3HG1 VAL 44 20.960 8.290 3.203
341 HG21 VAL 44 3HG2 VAL 44 22.662 7.034 1.007
342 HG22 VAL 44 1HG2 VAL 44 23.017 8.624 0.330
343 HG23 VAL 44 2HG2 VAL 44 22.908 8.413 2.078
344 H LEU 45 H LEU 45 18.295 6.807 1.027
345 HA LEU 45 HA LEU 45 16.437 8.445 -0.531
346 HG LEU 45 HG LEU 45 15.925 5.814 -1.530
347 HB2 LEU 45 2HB LEU 45 16.325 5.851 0.805
348 HB3 LEU 45 3HB LEU 45 14.907 6.855 1.103
349 HD11 LEU 45 1HD1 LEU 45 13.221 5.577 -0.227
350 HD12 LEU 45 2HD1 LEU 45 14.493 4.364 -0.090
351 HD13 LEU 45 3HD1 LEU 45 13.799 4.739 -1.667
352 HD21 LEU 45 3HD2 LEU 45 13.514 7.212 -1.902
353 HD22 LEU 45 1HD2 LEU 45 15.105 7.601 -2.556
354 HD23 LEU 45 2HD2 LEU 45 14.591 8.295 -1.018
355 H SER 46 H SER 46 15.245 10.051 0.325
356 HA SER 46 HA SER 46 15.925 10.991 2.961
357 HG SER 46 HG SER 46 12.855 12.477 1.299
358 HB2 SER 46 2HB SER 46 14.591 12.939 2.410
359 HB3 SER 46 3HB SER 46 15.596 12.527 1.021
360 H GLU 47 H GLU 47 14.410 11.436 4.644
361 HA GLU 47 HA GLU 47 12.723 9.316 5.289
362 HB2 GLU 47 2HB GLU 47 12.612 12.146 6.349
363 HB3 GLU 47 3HB GLU 47 11.903 10.731 7.115
364 HG2 GLU 47 2HG GLU 47 13.826 10.157 8.063
365 HG3 GLU 47 3HG GLU 47 14.724 10.373 6.562
366 H ALA 48 H ALA 48 12.137 12.156 3.404
367 HA ALA 48 HA ALA 48 9.252 11.581 3.359
368 HB1 ALA 48 1HB ALA 48 10.751 14.024 3.428
369 HB2 ALA 48 2HB ALA 48 9.741 13.977 1.982
370 HB3 ALA 48 3HB ALA 48 9.011 13.776 3.575
371 H ALA 49 H ALA 49 11.849 10.640 1.743
372 HA ALA 49 HA ALA 49 11.324 11.244 -0.959
373 HB1 ALA 49 1HB ALA 49 13.137 9.993 -1.396
374 HB2 ALA 49 2HB ALA 49 13.346 10.004 0.355
375 HB3 ALA 49 3HB ALA 49 12.560 8.635 -0.430
376 H GLU 50 H GLU 50 9.773 10.559 -2.277
377 HA GLU 50 HA GLU 50 8.446 8.000 -1.691
378 HB2 GLU 50 2HB GLU 50 6.339 9.163 -2.625
379 HB3 GLU 50 3HB GLU 50 6.820 9.507 -0.970
380 HG2 GLU 50 2HG GLU 50 7.168 11.665 -1.398
381 HG3 GLU 50 3HG GLU 50 8.003 11.326 -2.913
382 H LEU 51 H LEU 51 9.328 6.799 -3.295
383 HA LEU 51 HA LEU 51 9.735 7.800 -5.945
384 HG LEU 51 HG LEU 51 11.970 7.040 -5.524
385 HB2 LEU 51 2HB LEU 51 9.884 5.047 -4.743
386 HB3 LEU 51 3HB LEU 51 10.197 5.364 -6.448
387 HD11 LEU 51 1HD1 LEU 51 11.047 5.717 -3.123
388 HD12 LEU 51 2HD1 LEU 51 12.095 7.123 -3.307
389 HD13 LEU 51 3HD1 LEU 51 12.780 5.499 -3.368
390 HD21 LEU 51 3HD2 LEU 51 13.528 4.953 -5.210
391 HD22 LEU 51 1HD2 LEU 51 12.835 5.332 -6.787
392 HD23 LEU 51 2HD2 LEU 51 12.111 4.074 -5.785
393 H ASN 52 H ASN 52 8.148 4.718 -5.462
394 HA ASN 52 HA ASN 52 5.517 5.398 -6.046
395 HB2 ASN 52 2HB ASN 52 7.079 5.881 -8.267
396 HB3 ASN 52 3HB ASN 52 6.447 4.268 -8.582
397 HD21 ASN 52 1HD2 ASN 52 5.919 7.084 -9.634
398 HD22 ASN 52 2HD2 ASN 52 4.195 7.201 -9.626
399 H ASP 53 H ASP 53 4.627 3.328 -7.591
400 HA ASP 53 HA ASP 53 5.029 1.092 -5.821
401 HB2 ASP 53 2HB ASP 53 2.790 1.465 -6.569
402 HB3 ASP 53 3HB ASP 53 3.293 1.502 -8.257
403 H LYS 54 H LYS 54 5.742 -0.990 -6.424
404 HA LYS 54 HA LYS 54 7.184 -2.467 -7.380
405 HB2 LYS 54 2HB LYS 54 6.120 -0.996 -9.770
406 HB3 LYS 54 3HB LYS 54 7.377 -2.210 -9.967
407 HG2 LYS 54 2HG LYS 54 5.315 -3.287 -8.323
408 HG3 LYS 54 3HG LYS 54 4.591 -2.590 -9.773
409 HD2 LYS 54 2HD LYS 54 6.567 -3.857 -10.966
410 HD3 LYS 54 3HD LYS 54 6.522 -4.845 -9.503
411 HE2 LYS 54 2HE LYS 54 3.973 -4.961 -9.968
412 HE3 LYS 54 3HE LYS 54 4.418 -4.463 -11.599
413 HZ1 LYS 54 3HZ LYS 54 5.823 -6.385 -11.801
414 HZ2 LYS 54 1HZ LYS 54 4.273 -6.886 -11.344
415 HZ3 LYS 54 2HZ LYS 54 5.519 -6.840 -10.201
416 H MET 55 H MET 55 8.423 -0.372 -6.144
417 HA MET 55 HA MET 55 10.493 0.612 -7.950
418 HB2 MET 55 2HB MET 55 11.203 2.005 -6.075
419 HB3 MET 55 3HB MET 55 9.481 2.197 -6.374
420 HG2 MET 55 2HG MET 55 9.232 0.373 -4.540
421 HG3 MET 55 3HG MET 55 10.869 0.857 -4.102
422 HE1 MET 55 3HE MET 55 11.460 3.550 -3.526
423 HE2 MET 55 1HE MET 55 10.490 3.927 -2.101
424 HE3 MET 55 2HE MET 55 11.214 2.328 -2.276
425 H VAL 56 H VAL 56 12.722 0.765 -6.541
426 HA VAL 56 HA VAL 56 13.287 -1.869 -5.393
427 HB VAL 56 HB VAL 56 14.879 -0.655 -7.656
428 HG11 VAL 56 1HG1 VAL 56 15.370 -3.165 -6.057
429 HG12 VAL 56 2HG1 VAL 56 16.274 -2.668 -7.489
430 HG13 VAL 56 3HG1 VAL 56 16.344 -1.695 -6.019
431 HG21 VAL 56 3HG2 VAL 56 14.166 -2.495 -8.980
432 HG22 VAL 56 1HG2 VAL 56 13.428 -3.292 -7.590
433 HG23 VAL 56 2HG2 VAL 56 12.719 -1.813 -8.237
434 H ILE 57 H ILE 57 14.440 -1.685 -3.590
435 HA ILE 57 HA ILE 57 16.061 0.748 -3.207
436 HB ILE 57 HB ILE 57 14.558 -0.820 -1.107
437 HG12 ILE 57 2HG1 ILE 57 13.051 0.550 -2.407
438 HG13 ILE 57 3HG1 ILE 57 13.294 1.317 -0.841
439 HG21 ILE 57 1HG2 ILE 57 16.666 0.015 -0.238
440 HG22 ILE 57 2HG2 ILE 57 16.297 1.629 -0.842
441 HG23 ILE 57 3HG2 ILE 57 15.319 0.925 0.445
442 HD11 ILE 57 3HD1 ILE 57 14.968 2.810 -1.911
443 HD12 ILE 57 1HD1 ILE 57 14.521 2.111 -3.468
444 HD13 ILE 57 2HD1 ILE 57 13.325 3.001 -2.524
445 H ASP 58 H ASP 58 18.160 0.435 -2.889
446 HA ASP 58 HA ASP 58 19.162 -2.272 -2.556
447 HB2 ASP 58 2HB ASP 58 20.073 -0.045 -3.939
448 HB3 ASP 58 3HB ASP 58 21.167 -0.155 -2.562
449 H ALA 59 H ALA 59 19.418 -3.086 -0.592
450 HA ALA 59 HA ALA 59 19.803 -1.305 1.688
451 HB1 ALA 59 1HB ALA 59 19.752 -4.044 2.464
452 HB2 ALA 59 2HB ALA 59 18.552 -2.786 2.763
453 HB3 ALA 59 3HB ALA 59 18.460 -3.762 1.297
454 H PHE 60 H PHE 60 21.814 -0.784 2.223
455 HA PHE 60 HA PHE 60 23.957 -2.747 1.767
456 HD1 PHE 60 HD2 PHE 60 26.834 -1.713 2.406
457 HD2 PHE 60 HD1 PHE 60 24.312 1.658 3.035
458 HE1 PHE 60 HE2 PHE 60 28.488 -0.770 3.965
459 HE2 PHE 60 HE1 PHE 60 25.962 2.606 4.594
460 HZ PHE 60 HZ PHE 60 28.053 1.391 5.062
461 HB2 PHE 60 2HB PHE 60 24.983 -1.011 0.787
462 HB3 PHE 60 3HB PHE 60 23.772 0.121 1.382
463 H VAL 61 H VAL 61 24.817 -3.724 3.469
464 HA VAL 61 HA VAL 61 24.204 -2.720 6.145
465 HB VAL 61 HB VAL 61 24.826 -4.873 6.981
466 HG11 VAL 61 1HG1 VAL 61 22.900 -5.779 6.331
467 HG12 VAL 61 2HG1 VAL 61 22.763 -4.470 5.156
468 HG13 VAL 61 3HG1 VAL 61 23.490 -6.008 4.685
469 HG21 VAL 61 3HG2 VAL 61 25.423 -6.457 4.768
470 HG22 VAL 61 1HG2 VAL 61 26.381 -4.992 4.550
471 HG23 VAL 61 2HG2 VAL 61 26.538 -5.936 6.032
472 HA PRO 62 HA PRO 62 28.246 -1.207 6.962
473 HB2 PRO 62 2HB PRO 62 28.437 -1.693 9.627
474 HB3 PRO 62 3HB PRO 62 27.410 -0.421 8.953
475 HG2 PRO 62 2HG PRO 62 26.663 -3.169 9.875
476 HG3 PRO 62 3HG PRO 62 25.825 -1.631 10.150
477 HD2 PRO 62 2HD PRO 62 25.037 -3.402 8.259
478 HD3 PRO 62 3HD PRO 62 24.845 -1.648 8.063
479 H ALA 63 H ALA 63 30.308 -1.928 6.906
480 HA ALA 63 HA ALA 63 30.842 -4.694 7.757
481 HB1 ALA 63 1HB ALA 63 30.995 -3.606 5.088
482 HB2 ALA 63 2HB ALA 63 32.558 -4.232 5.616
483 HB3 ALA 63 3HB ALA 63 31.138 -5.278 5.633
484 H ASP 64 H ASP 64 33.313 -5.081 7.772
485 HA ASP 64 HA ASP 64 34.448 -3.163 9.562
486 HB2 ASP 64 2HB ASP 64 35.639 -5.630 8.278
487 HB3 ASP 64 3HB ASP 64 36.422 -4.682 9.539
488 H GLY 65 H GLY 65 35.760 -1.503 9.138
489 HA2 GLY 65 2HA GLY 65 37.187 -0.092 8.015
490 HA3 GLY 65 3HA GLY 65 37.616 -1.452 6.988
491 H ALA 66 H ALA 66 34.292 -0.529 7.245
492 HA ALA 66 HA ALA 66 32.823 0.422 5.786
493 HB1 ALA 66 1HB ALA 66 35.254 1.966 5.461
494 HB2 ALA 66 2HB ALA 66 34.297 1.914 3.980
495 HB3 ALA 66 3HB ALA 66 33.572 2.496 5.479
496 H GLY 67 H GLY 67 35.540 0.329 3.518
497 HA2 GLY 67 2HA GLY 67 35.410 -2.043 2.293
498 HA3 GLY 67 3HA GLY 67 33.937 -1.285 1.705
499 H LEU 68 H LEU 68 37.243 -1.674 1.212
500 HA LEU 68 HA LEU 68 37.915 0.755 -0.049
501 HG LEU 68 HG LEU 68 40.031 0.609 0.871
502 HB2 LEU 68 2HB LEU 68 39.120 -1.794 0.407
503 HB3 LEU 68 3HB LEU 68 39.346 -1.348 -1.283
504 HD11 LEU 68 1HD1 LEU 68 41.687 -1.750 0.006
505 HD12 LEU 68 2HD1 LEU 68 41.181 -1.322 1.639
506 HD13 LEU 68 3HD1 LEU 68 42.359 -0.320 0.791
507 HD21 LEU 68 3HD2 LEU 68 40.855 1.766 -0.835
508 HD22 LEU 68 1HD2 LEU 68 40.163 0.564 -1.924
509 HD23 LEU 68 2HD2 LEU 68 41.827 0.392 -1.364
510 H GLU 69 H GLU 69 37.450 -2.380 -1.683
511 HA GLU 69 HA GLU 69 37.156 -1.400 -4.246
512 HB2 GLU 69 2HB GLU 69 35.898 -3.523 -4.712
513 HB3 GLU 69 3HB GLU 69 37.448 -3.746 -3.915
514 HG2 GLU 69 2HG GLU 69 35.974 -5.211 -2.840
515 HG3 GLU 69 3HG GLU 69 36.165 -3.847 -1.739
Start of MODEL 2
1 HA MET 1 HA MET 1 1.394 -0.091 -2.060
2 H1 MET 1 H MET 1 1.808 0.000 0.855
3 HB2 MET 1 2HB MET 1 3.177 1.417 -2.420
4 HB3 MET 1 3HB MET 1 2.213 2.132 -1.135
5 HG2 MET 1 2HG MET 1 3.787 1.506 0.518
6 HG3 MET 1 3HG MET 1 4.661 0.475 -0.612
7 HE1 MET 1 3HE MET 1 3.629 3.952 -2.317
8 HE2 MET 1 1HE MET 1 3.117 3.934 -0.629
9 HE3 MET 1 2HE MET 1 4.407 5.019 -1.148
10 H LEU 2 H LEU 2 3.505 -0.785 -3.194
11 HA LEU 2 HA LEU 2 4.665 -3.039 -1.690
12 HG LEU 2 HG LEU 2 5.422 -5.114 -3.413
13 HB2 LEU 2 2HB LEU 2 3.120 -3.230 -3.903
14 HB3 LEU 2 3HB LEU 2 4.722 -3.139 -4.632
15 HD11 LEU 2 1HD1 LEU 2 3.073 -6.190 -2.382
16 HD12 LEU 2 2HD1 LEU 2 3.086 -4.515 -1.830
17 HD13 LEU 2 3HD1 LEU 2 4.451 -5.572 -1.470
18 HD21 LEU 2 3HD2 LEU 2 2.827 -6.064 -4.430
19 HD22 LEU 2 1HD2 LEU 2 4.467 -6.548 -4.864
20 HD23 LEU 2 2HD2 LEU 2 3.771 -5.078 -5.548
21 H VAL 3 H VAL 3 6.844 -3.305 -1.694
22 HA VAL 3 HA VAL 3 8.461 -1.549 -3.403
23 HB VAL 3 HB VAL 3 9.031 -1.936 -0.465
24 HG11 VAL 3 1HG1 VAL 3 10.635 -1.085 -2.610
25 HG12 VAL 3 2HG1 VAL 3 10.241 0.360 -1.677
26 HG13 VAL 3 3HG1 VAL 3 11.008 -1.019 -0.888
27 HG21 VAL 3 3HG2 VAL 3 8.336 0.418 -0.202
28 HG22 VAL 3 1HG2 VAL 3 7.781 0.418 -1.876
29 HG23 VAL 3 2HG2 VAL 3 7.005 -0.631 -0.690
30 H ILE 4 H ILE 4 9.964 -2.668 -4.445
31 HA ILE 4 HA ILE 4 10.618 -5.365 -3.533
32 HB ILE 4 HB ILE 4 11.130 -3.940 -6.140
33 HG12 ILE 4 2HG1 ILE 4 8.827 -4.879 -5.558
34 HG13 ILE 4 3HG1 ILE 4 9.541 -5.428 -7.071
35 HG21 ILE 4 1HG2 ILE 4 11.945 -6.255 -6.865
36 HG22 ILE 4 2HG2 ILE 4 13.042 -5.264 -5.904
37 HG23 ILE 4 3HG2 ILE 4 12.147 -6.580 -5.144
38 HD11 ILE 4 3HD1 ILE 4 10.168 -7.121 -4.775
39 HD12 ILE 4 1HD1 ILE 4 8.452 -7.036 -5.172
40 HD13 ILE 4 2HD1 ILE 4 9.615 -7.551 -6.393
41 H VAL 5 H VAL 5 12.083 -5.080 -1.888
42 HA VAL 5 HA VAL 5 14.379 -3.357 -2.221
43 HB VAL 5 HB VAL 5 13.666 -5.299 -0.021
44 HG11 VAL 5 1HG1 VAL 5 15.769 -5.124 0.670
45 HG12 VAL 5 2HG1 VAL 5 16.148 -3.984 -0.623
46 HG13 VAL 5 3HG1 VAL 5 15.500 -3.398 0.910
47 HG21 VAL 5 3HG2 VAL 5 12.150 -3.624 0.291
48 HG22 VAL 5 1HG2 VAL 5 13.522 -2.921 1.148
49 HG23 VAL 5 2HG2 VAL 5 13.158 -2.413 -0.501
50 H ARG 6 H ARG 6 16.330 -3.926 -2.945
51 HA ARG 6 HA ARG 6 16.824 -6.779 -3.468
52 HE ARG 6 HE ARG 6 14.496 -5.859 -7.060
53 HB2 ARG 6 2HB ARG 6 18.329 -4.517 -4.755
54 HB3 ARG 6 3HB ARG 6 18.148 -6.174 -5.314
55 HG2 ARG 6 2HG ARG 6 15.557 -5.252 -5.247
56 HG3 ARG 6 3HG ARG 6 16.477 -3.850 -5.796
57 HD2 ARG 6 2HD ARG 6 17.110 -4.855 -7.740
58 HD3 ARG 6 3HD ARG 6 17.113 -6.469 -7.030
59 HH11 ARG 6 1HH1 ARG 6 16.975 -5.683 -9.498
60 HH12 ARG 6 2HH1 ARG 6 15.883 -5.968 -10.813
61 HH21 ARG 6 1HH2 ARG 6 13.049 -6.235 -8.783
62 HH22 ARG 6 2HH2 ARG 6 13.651 -6.281 -10.405
63 H LEU 7 H LEU 7 17.928 -7.571 -1.774
64 HA LEU 7 HA LEU 7 19.904 -6.004 -0.377
65 HG LEU 7 HG LEU 7 20.059 -6.469 1.707
66 HB2 LEU 7 2HB LEU 7 18.295 -8.129 0.290
67 HB3 LEU 7 3HB LEU 7 19.884 -8.877 0.141
68 HD11 LEU 7 1HD1 LEU 7 17.979 -8.483 2.521
69 HD12 LEU 7 2HD1 LEU 7 17.801 -6.737 2.354
70 HD13 LEU 7 3HD1 LEU 7 18.774 -7.402 3.666
71 HD21 LEU 7 3HD2 LEU 7 21.774 -7.991 1.978
72 HD22 LEU 7 1HD2 LEU 7 20.683 -9.376 2.009
73 HD23 LEU 7 2HD2 LEU 7 20.784 -8.303 3.405
74 H GLN 8 H GLN 8 22.103 -6.932 0.033
75 HA GLN 8 HA GLN 8 23.811 -6.890 -1.952
76 HB2 GLN 8 2HB GLN 8 24.149 -7.633 0.545
77 HB3 GLN 8 3HB GLN 8 24.156 -9.250 -0.146
78 HG2 GLN 8 2HG GLN 8 26.119 -7.041 -0.466
79 HG3 GLN 8 3HG GLN 8 26.387 -8.754 -0.145
80 HE21 GLN 8 1HE2 GLN 8 26.399 -6.338 -2.466
81 HE22 GLN 8 2HE2 GLN 8 26.541 -7.331 -3.873
82 H ASP 9 H ASP 9 22.427 -10.052 -1.041
83 HA ASP 9 HA ASP 9 22.397 -10.782 -3.882
84 HB2 ASP 9 2HB ASP 9 24.413 -11.683 -2.387
85 HB3 ASP 9 3HB ASP 9 23.208 -12.887 -1.936
86 H GLN 10 H GLN 10 20.250 -9.952 -2.220
87 HA GLN 10 HA GLN 10 18.516 -12.244 -2.547
88 HB2 GLN 10 2HB GLN 10 19.038 -11.007 0.153
89 HB3 GLN 10 3HB GLN 10 17.595 -11.948 -0.198
90 HG2 GLN 10 2HG GLN 10 19.236 -13.782 -0.948
91 HG3 GLN 10 3HG GLN 10 20.441 -12.851 -0.061
92 HE21 GLN 10 1HE2 GLN 10 19.368 -15.528 0.438
93 HE22 GLN 10 2HE2 GLN 10 18.729 -15.490 2.042
94 H THR 11 H THR 11 17.010 -11.346 -3.795
95 HA THR 11 HA THR 11 15.976 -8.688 -3.056
96 HB THR 11 HB THR 11 15.872 -10.041 -5.760
97 HG1 THR 11 HG1 THR 11 17.638 -8.928 -6.230
98 HG21 THR 11 3HG2 THR 11 13.981 -8.492 -5.240
99 HG22 THR 11 1HG2 THR 11 14.983 -7.972 -6.594
100 HG23 THR 11 2HG2 THR 11 15.163 -7.203 -5.017
101 H LEU 12 H LEU 12 13.919 -8.517 -2.431
102 HA LEU 12 HA LEU 12 11.898 -10.364 -3.345
103 HG LEU 12 HG LEU 12 12.641 -12.379 -2.615
104 HB2 LEU 12 2HB LEU 12 13.044 -10.472 -0.615
105 HB3 LEU 12 3HB LEU 12 11.294 -10.622 -0.760
106 HD11 LEU 12 1HD1 LEU 12 13.143 -13.128 0.230
107 HD12 LEU 12 2HD1 LEU 12 14.308 -12.123 -0.632
108 HD13 LEU 12 3HD1 LEU 12 13.906 -13.727 -1.244
109 HD21 LEU 12 3HD2 LEU 12 11.281 -14.046 -1.207
110 HD22 LEU 12 1HD2 LEU 12 10.406 -12.823 -2.129
111 HD23 LEU 12 2HD2 LEU 12 10.642 -12.617 -0.394
112 HA PRO 13 HA PRO 13 9.258 -6.906 -2.774
113 HB2 PRO 13 2HB PRO 13 6.900 -8.094 -2.145
114 HB3 PRO 13 3HB PRO 13 7.596 -8.141 -3.769
115 HG2 PRO 13 2HG PRO 13 7.670 -10.218 -1.615
116 HG3 PRO 13 3HG PRO 13 7.382 -10.419 -3.353
117 HD2 PRO 13 2HD PRO 13 9.780 -10.931 -2.205
118 HD3 PRO 13 3HD PRO 13 9.627 -10.318 -3.865
119 H PHE 14 H PHE 14 7.974 -5.705 -1.231
120 HA PHE 14 HA PHE 14 8.040 -6.652 1.530
121 HD1 PHE 14 HD1 PHE 14 9.177 -5.781 3.859
122 HD2 PHE 14 HD2 PHE 14 11.668 -5.552 0.416
123 HE1 PHE 14 HE1 PHE 14 10.964 -6.952 5.079
124 HE2 PHE 14 HE2 PHE 14 13.459 -6.723 1.630
125 HZ PHE 14 HZ PHE 14 13.109 -7.426 3.964
126 HB2 PHE 14 2HB PHE 14 9.647 -4.419 0.436
127 HB3 PHE 14 3HB PHE 14 8.820 -4.099 1.957
128 H GLU 15 H GLU 15 6.227 -6.155 2.589
129 HA GLU 15 HA GLU 15 4.202 -4.597 1.250
130 HB2 GLU 15 2HB GLU 15 3.504 -6.615 2.360
131 HB3 GLU 15 3HB GLU 15 4.218 -6.086 3.876
132 HG2 GLU 15 2HG GLU 15 2.533 -4.580 4.305
133 HG3 GLU 15 3HG GLU 15 2.081 -4.441 2.607
134 H LEU 16 H LEU 16 4.036 -2.473 1.440
135 HA LEU 16 HA LEU 16 4.921 -1.209 3.951
136 HG LEU 16 HG LEU 16 7.437 -0.059 1.519
137 HB2 LEU 16 2HB LEU 16 5.238 -0.408 1.099
138 HB3 LEU 16 3HB LEU 16 5.079 0.853 2.321
139 HD11 LEU 16 1HD1 LEU 16 6.709 1.673 3.327
140 HD12 LEU 16 2HD1 LEU 16 8.345 1.016 3.338
141 HD13 LEU 16 3HD1 LEU 16 7.134 0.385 4.454
142 HD21 LEU 16 3HD2 LEU 16 6.875 -2.387 2.202
143 HD22 LEU 16 1HD2 LEU 16 6.819 -1.834 3.876
144 HD23 LEU 16 2HD2 LEU 16 8.329 -1.747 2.968
145 HA PRO 17 HA PRO 17 0.948 0.564 4.510
146 HB2 PRO 17 2HB PRO 17 1.534 3.056 5.416
147 HB3 PRO 17 3HB PRO 17 1.774 1.599 6.388
148 HG2 PRO 17 2HG PRO 17 3.771 3.169 4.803
149 HG3 PRO 17 3HG PRO 17 3.929 2.471 6.426
150 HD2 PRO 17 2HD PRO 17 4.971 1.289 4.224
151 HD3 PRO 17 3HD PRO 17 4.370 0.360 5.612
152 H ALA 18 H ALA 18 -0.395 2.581 4.010
153 HA ALA 18 HA ALA 18 -0.409 3.013 1.230
154 HB1 ALA 18 1HB ALA 18 -1.868 5.098 2.425
155 HB2 ALA 18 2HB ALA 18 -2.486 3.584 1.762
156 HB3 ALA 18 3HB ALA 18 -2.059 3.690 3.470
157 H GLY 19 H GLY 19 0.430 4.574 -0.044
158 HA2 GLY 19 2HA GLY 19 1.867 6.252 -0.679
159 HA3 GLY 19 3HA GLY 19 1.101 7.165 0.612
160 H ALA 20 H ALA 20 2.886 4.252 1.283
161 HA ALA 20 HA ALA 20 4.456 5.268 3.285
162 HB1 ALA 20 1HB ALA 20 5.947 3.284 1.823
163 HB2 ALA 20 2HB ALA 20 5.173 3.169 3.404
164 HB3 ALA 20 3HB ALA 20 4.247 2.832 1.942
165 H ARG 21 H ARG 21 6.614 5.978 3.443
166 HA ARG 21 HA ARG 21 7.758 7.022 0.937
167 HE ARG 21 HE ARG 21 5.455 10.864 0.482
168 HB2 ARG 21 2HB ARG 21 7.039 8.406 3.403
169 HB3 ARG 21 3HB ARG 21 8.712 8.682 2.937
170 HG2 ARG 21 2HG ARG 21 8.143 9.794 1.020
171 HG3 ARG 21 3HG ARG 21 6.592 8.965 0.871
172 HD2 ARG 21 2HD ARG 21 6.012 10.238 3.066
173 HD3 ARG 21 3HD ARG 21 7.343 11.292 2.591
174 HH11 ARG 21 1HH1 ARG 21 6.137 12.730 3.340
175 HH12 ARG 21 2HH1 ARG 21 5.165 14.078 2.851
176 HH21 ARG 21 1HH2 ARG 21 4.172 12.633 -0.174
177 HH22 ARG 21 2HH2 ARG 21 4.047 14.021 0.852
178 H ALA 22 H ALA 22 10.156 7.808 1.527
179 HA ALA 22 HA ALA 22 11.725 5.561 1.777
180 HB1 ALA 22 1HB ALA 22 13.274 7.679 2.785
181 HB2 ALA 22 2HB ALA 22 13.219 7.068 1.131
182 HB3 ALA 22 3HB ALA 22 12.155 8.387 1.619
183 H SER 23 H SER 23 11.007 7.951 4.322
184 HA SER 23 HA SER 23 12.444 6.881 6.401
185 HG SER 23 HG SER 23 10.987 8.255 8.777
186 HB2 SER 23 2HB SER 23 11.389 8.933 6.837
187 HB3 SER 23 3HB SER 23 9.809 8.333 6.333
188 H GLN 24 H GLN 24 9.045 6.129 5.626
189 HA GLN 24 HA GLN 24 8.576 4.209 7.543
190 HB2 GLN 24 2HB GLN 24 7.205 5.195 5.359
191 HB3 GLN 24 3HB GLN 24 7.426 3.498 4.952
192 HG2 GLN 24 2HG GLN 24 5.891 2.846 6.416
193 HG3 GLN 24 3HG GLN 24 6.564 3.857 7.694
194 HE21 GLN 24 1HE2 GLN 24 4.337 4.207 8.289
195 HE22 GLN 24 2HE2 GLN 24 3.412 5.412 7.466
196 H LEU 25 H LEU 25 9.618 3.566 4.190
197 HA LEU 25 HA LEU 25 10.013 0.842 4.410
198 HG LEU 25 HG LEU 25 12.487 0.407 2.522
199 HB2 LEU 25 2HB LEU 25 10.132 2.276 2.338
200 HB3 LEU 25 3HB LEU 25 11.780 2.681 2.812
201 HD11 LEU 25 1HD1 LEU 25 10.518 -0.736 3.350
202 HD12 LEU 25 2HD1 LEU 25 10.937 -1.334 1.745
203 HD13 LEU 25 3HD1 LEU 25 9.593 -0.210 1.943
204 HD21 LEU 25 3HD2 LEU 25 12.264 0.191 0.168
205 HD22 LEU 25 1HD2 LEU 25 12.260 1.919 0.525
206 HD23 LEU 25 2HD2 LEU 25 10.746 1.090 0.162
207 H SER 26 H SER 26 12.429 3.414 4.901
208 HA SER 26 HA SER 26 14.614 1.864 5.541
209 HG SER 26 HG SER 26 16.307 4.704 6.344
210 HB2 SER 26 2HB SER 26 14.268 4.489 5.391
211 HB3 SER 26 3HB SER 26 14.143 4.341 7.144
212 H ASN 27 H ASN 27 11.847 2.688 7.523
213 HA ASN 27 HA ASN 27 12.946 1.786 9.991
214 HB2 ASN 27 2HB ASN 27 11.012 3.370 9.772
215 HB3 ASN 27 3HB ASN 27 10.023 2.011 9.245
216 HD21 ASN 27 1HD2 ASN 27 8.845 2.916 11.199
217 HD22 ASN 27 2HD2 ASN 27 9.219 2.188 12.720
218 H LEU 28 H LEU 28 10.645 0.334 7.693
219 HA LEU 28 HA LEU 28 10.178 -2.062 8.979
220 HG LEU 28 HG LEU 28 7.887 -1.899 6.091
221 HB2 LEU 28 2HB LEU 28 10.261 -1.276 6.097
222 HB3 LEU 28 3HB LEU 28 10.005 -2.962 6.541
223 HD11 LEU 28 1HD1 LEU 28 7.833 -2.037 9.052
224 HD12 LEU 28 2HD1 LEU 28 8.368 -3.468 8.173
225 HD13 LEU 28 3HD1 LEU 28 6.772 -2.787 7.860
226 HD21 LEU 28 3HD2 LEU 28 8.463 0.408 6.503
227 HD22 LEU 28 1HD2 LEU 28 8.699 0.078 8.219
228 HD23 LEU 28 2HD2 LEU 28 7.087 -0.041 7.512
229 H LEU 29 H LEU 29 12.733 -1.355 6.601
230 HA LEU 29 HA LEU 29 13.952 -3.904 6.769
231 HG LEU 29 HG LEU 29 13.416 -3.205 4.494
232 HB2 LEU 29 2HB LEU 29 14.886 -1.227 5.785
233 HB3 LEU 29 3HB LEU 29 15.946 -2.635 5.785
234 HD11 LEU 29 1HD1 LEU 29 14.758 -0.676 3.844
235 HD12 LEU 29 2HD1 LEU 29 13.109 -1.208 3.516
236 HD13 LEU 29 3HD1 LEU 29 14.427 -1.725 2.465
237 HD21 LEU 29 3HD2 LEU 29 14.750 -4.336 3.016
238 HD22 LEU 29 1HD2 LEU 29 15.804 -4.301 4.429
239 HD23 LEU 29 2HD2 LEU 29 16.055 -3.153 3.114
240 H SER 30 H SER 30 14.655 -0.799 8.332
241 HA SER 30 HA SER 30 16.989 -1.475 9.660
242 HG SER 30 HG SER 30 16.869 -0.174 12.000
243 HB2 SER 30 2HB SER 30 16.492 0.770 9.864
244 HB3 SER 30 3HB SER 30 14.785 0.472 10.190
245 H SER 31 H SER 31 13.637 -1.818 10.801
246 HA SER 31 HA SER 31 14.345 -3.035 13.266
247 HG SER 31 HG SER 31 11.859 -2.771 14.552
248 HB2 SER 31 2HB SER 31 12.141 -1.870 12.663
249 HB3 SER 31 3HB SER 31 11.692 -3.381 11.872
250 H SER 32 H SER 32 13.809 -4.233 10.047
251 HA SER 32 HA SER 32 13.236 -6.904 10.526
252 HG SER 32 HG SER 32 15.426 -6.275 7.209
253 HB2 SER 32 2HB SER 32 13.573 -7.198 8.292
254 HB3 SER 32 3HB SER 32 13.627 -5.435 8.289
255 H GLY 33 H GLY 33 16.219 -5.165 10.905
256 HA2 GLY 33 2HA GLY 33 17.540 -6.686 12.631
257 HA3 GLY 33 3HA GLY 33 17.779 -7.618 11.160
258 H MET 34 H MET 34 19.466 -7.123 9.910
259 HA MET 34 HA MET 34 21.313 -5.126 10.726
260 HB2 MET 34 2HB MET 34 21.146 -7.066 8.457
261 HB3 MET 34 3HB MET 34 22.321 -5.760 8.374
262 HG2 MET 34 2HG MET 34 23.300 -6.499 10.481
263 HG3 MET 34 3HG MET 34 22.117 -7.801 10.576
264 HE1 MET 34 3HE MET 34 24.127 -10.483 9.650
265 HE2 MET 34 1HE MET 34 22.702 -9.767 10.405
266 HE3 MET 34 2HE MET 34 22.632 -10.313 8.729
267 H ALA 35 H ALA 35 21.367 -3.039 10.228
268 HA ALA 35 HA ALA 35 19.558 -2.020 8.178
269 HB1 ALA 35 1HB ALA 35 21.034 -0.775 10.464
270 HB2 ALA 35 2HB ALA 35 20.382 0.224 9.164
271 HB3 ALA 35 3HB ALA 35 19.303 -0.788 10.125
272 H PHE 36 H PHE 36 20.247 -1.569 6.201
273 HA PHE 36 HA PHE 36 23.087 -0.886 5.819
274 HD1 PHE 36 HD2 PHE 36 20.017 -1.977 2.943
275 HD2 PHE 36 HD1 PHE 36 21.865 -4.554 5.782
276 HE1 PHE 36 HE2 PHE 36 18.045 -3.447 2.887
277 HE2 PHE 36 HE1 PHE 36 19.896 -6.029 5.730
278 HZ PHE 36 HZ PHE 36 17.982 -5.476 4.281
279 HB2 PHE 36 2HB PHE 36 22.436 -1.890 3.401
280 HB3 PHE 36 3HB PHE 36 23.128 -2.861 4.697
281 H SER 37 H SER 37 23.333 0.101 3.478
282 HA SER 37 HA SER 37 21.793 2.520 3.508
283 HG SER 37 HG SER 37 23.945 3.208 0.508
284 HB2 SER 37 2HB SER 37 23.846 3.116 2.753
285 HB3 SER 37 3HB SER 37 24.184 1.508 2.111
286 H LEU 38 H LEU 38 20.052 3.031 2.339
287 HA LEU 38 HA LEU 38 19.134 1.089 0.330
288 HG LEU 38 HG LEU 38 16.237 1.063 2.638
289 HB2 LEU 38 2HB LEU 38 17.705 2.952 2.182
290 HB3 LEU 38 3HB LEU 38 16.915 2.384 0.713
291 HD11 LEU 38 1HD1 LEU 38 16.717 -1.147 1.749
292 HD12 LEU 38 2HD1 LEU 38 18.035 -0.488 0.780
293 HD13 LEU 38 3HD1 LEU 38 16.370 -0.013 0.443
294 HD21 LEU 38 3HD2 LEU 38 18.561 1.449 3.752
295 HD22 LEU 38 1HD2 LEU 38 19.003 -0.034 2.904
296 HD23 LEU 38 2HD2 LEU 38 17.673 -0.044 4.063
297 H HIS 39 H HIS 39 19.593 1.699 -1.677
298 HA HIS 39 HA HIS 39 19.019 4.470 -2.459
299 HD1 HIS 39 HD1 HIS 39 22.339 1.654 -1.906
300 HD2 HIS 39 HD2 HIS 39 21.570 2.880 -5.800
301 HE1 HIS 39 HE1 HIS 39 23.413 -0.077 -3.380
302 HB2 HIS 39 2HB HIS 39 21.033 4.657 -3.731
303 HB3 HIS 39 3HB HIS 39 21.494 4.110 -2.122
304 H THR 40 H THR 40 18.369 4.755 -4.618
305 HA THR 40 HA THR 40 17.639 2.261 -6.012
306 HB THR 40 HB THR 40 15.566 3.084 -6.599
307 HG1 THR 40 HG1 THR 40 16.586 5.700 -6.101
308 HG21 THR 40 3HG2 THR 40 15.967 2.954 -4.038
309 HG22 THR 40 1HG2 THR 40 14.490 3.710 -4.635
310 HG23 THR 40 2HG2 THR 40 15.839 4.712 -4.098
311 H GLN 41 H GLN 41 18.201 2.065 -8.104
312 HA GLN 41 HA GLN 41 19.336 2.472 -10.038
313 HB2 GLN 41 2HB GLN 41 17.236 4.295 -9.827
314 HB3 GLN 41 3HB GLN 41 18.614 5.267 -10.328
315 HG2 GLN 41 2HG GLN 41 18.977 3.499 -12.133
316 HG3 GLN 41 3HG GLN 41 17.351 2.945 -11.737
317 HE21 GLN 41 1HE2 GLN 41 19.249 5.325 -13.307
318 HE22 GLN 41 2HE2 GLN 41 17.948 6.251 -13.967
319 H GLY 42 H GLY 42 20.729 3.048 -7.535
320 HA2 GLY 42 2HA GLY 42 22.904 3.717 -7.092
321 HA3 GLY 42 3HA GLY 42 22.957 4.484 -8.672
322 H ARG 43 H ARG 43 20.410 5.172 -6.392
323 HA ARG 43 HA ARG 43 21.689 7.723 -5.700
324 HE ARG 43 HE ARG 43 19.374 10.664 -7.652
325 HB2 ARG 43 2HB ARG 43 18.838 7.418 -6.663
326 HB3 ARG 43 3HB ARG 43 19.568 8.908 -6.080
327 HG2 ARG 43 2HG ARG 43 21.069 8.977 -7.944
328 HG3 ARG 43 3HG ARG 43 20.545 7.380 -8.481
329 HD2 ARG 43 2HD ARG 43 19.446 8.974 -9.858
330 HD3 ARG 43 3HD ARG 43 18.239 8.333 -8.744
331 HH11 ARG 43 1HH1 ARG 43 17.262 9.644 -10.225
332 HH12 ARG 43 2HH1 ARG 43 16.374 11.132 -10.261
333 HH21 ARG 43 1HH2 ARG 43 18.212 12.626 -7.690
334 HH22 ARG 43 2HH2 ARG 43 16.916 12.828 -8.819
335 H VAL 44 H VAL 44 21.808 7.836 -3.565
336 HA VAL 44 HA VAL 44 20.582 6.154 -1.746
337 HB VAL 44 HB VAL 44 21.433 9.000 -1.194
338 HG11 VAL 44 1HG1 VAL 44 20.593 6.733 0.487
339 HG12 VAL 44 2HG1 VAL 44 22.033 7.595 1.030
340 HG13 VAL 44 3HG1 VAL 44 20.517 8.467 0.797
341 HG21 VAL 44 3HG2 VAL 44 23.568 7.764 -0.433
342 HG22 VAL 44 1HG2 VAL 44 22.994 6.459 -1.471
343 HG23 VAL 44 2HG2 VAL 44 23.326 8.049 -2.156
344 H LEU 45 H LEU 45 18.766 6.247 -0.468
345 HA LEU 45 HA LEU 45 16.617 7.930 -1.472
346 HG LEU 45 HG LEU 45 15.906 5.206 -2.177
347 HB2 LEU 45 2HB LEU 45 16.836 5.398 -0.016
348 HB3 LEU 45 3HB LEU 45 15.526 6.438 0.540
349 HD11 LEU 45 1HD1 LEU 45 14.024 3.989 -1.718
350 HD12 LEU 45 2HD1 LEU 45 13.392 5.181 -0.584
351 HD13 LEU 45 3HD1 LEU 45 14.716 4.122 -0.102
352 HD21 LEU 45 3HD2 LEU 45 14.999 7.023 -3.088
353 HD22 LEU 45 1HD2 LEU 45 14.681 7.744 -1.510
354 HD23 LEU 45 2HD2 LEU 45 13.520 6.619 -2.216
355 H SER 46 H SER 46 16.236 9.842 -0.590
356 HA SER 46 HA SER 46 17.411 10.757 1.795
357 HG SER 46 HG SER 46 17.699 12.861 1.060
358 HB2 SER 46 2HB SER 46 16.068 11.928 -0.310
359 HB3 SER 46 3HB SER 46 14.949 12.154 1.034
360 H GLU 47 H GLU 47 15.572 12.014 3.309
361 HA GLU 47 HA GLU 47 14.331 9.790 4.710
362 HB2 GLU 47 2HB GLU 47 14.493 12.703 5.501
363 HB3 GLU 47 3HB GLU 47 14.000 11.368 6.534
364 HG2 GLU 47 2HG GLU 47 16.339 10.411 6.031
365 HG3 GLU 47 3HG GLU 47 16.723 12.051 5.511
366 H ALA 48 H ALA 48 13.441 12.309 2.580
367 HA ALA 48 HA ALA 48 10.595 11.928 3.249
368 HB1 ALA 48 1HB ALA 48 11.678 14.248 1.681
369 HB2 ALA 48 2HB ALA 48 10.128 14.103 2.509
370 HB3 ALA 48 3HB ALA 48 11.616 14.258 3.443
371 H ALA 49 H ALA 49 12.691 10.609 1.303
372 HA ALA 49 HA ALA 49 11.966 10.997 -1.329
373 HB1 ALA 49 1HB ALA 49 13.675 9.338 -0.093
374 HB2 ALA 49 2HB ALA 49 12.412 8.190 -0.539
375 HB3 ALA 49 3HB ALA 49 13.200 9.161 -1.782
376 H GLU 50 H GLU 50 10.120 10.783 -2.398
377 HA GLU 50 HA GLU 50 7.870 9.447 -1.158
378 HB2 GLU 50 2HB GLU 50 6.995 11.288 -2.147
379 HB3 GLU 50 3HB GLU 50 8.272 11.372 -3.353
380 HG2 GLU 50 2HG GLU 50 7.196 9.880 -4.778
381 HG3 GLU 50 3HG GLU 50 6.152 9.266 -3.497
382 H LEU 51 H LEU 51 7.565 7.342 -1.402
383 HA LEU 51 HA LEU 51 8.734 5.933 -3.657
384 HG LEU 51 HG LEU 51 8.915 6.015 -0.396
385 HB2 LEU 51 2HB LEU 51 7.066 4.724 -1.474
386 HB3 LEU 51 3HB LEU 51 8.274 3.941 -2.490
387 HD11 LEU 51 1HD1 LEU 51 8.392 4.381 1.049
388 HD12 LEU 51 2HD1 LEU 51 9.928 3.681 0.538
389 HD13 LEU 51 3HD1 LEU 51 8.421 3.129 -0.193
390 HD21 LEU 51 3HD2 LEU 51 11.155 5.545 -0.789
391 HD22 LEU 51 1HD2 LEU 51 10.462 5.557 -2.411
392 HD23 LEU 51 2HD2 LEU 51 10.796 4.023 -1.607
393 H ASN 52 H ASN 52 6.870 3.814 -3.826
394 HA ASN 52 HA ASN 52 4.262 4.791 -4.434
395 HB2 ASN 52 2HB ASN 52 6.089 5.367 -6.396
396 HB3 ASN 52 3HB ASN 52 5.446 3.821 -6.943
397 HD21 ASN 52 1HD2 ASN 52 5.160 6.746 -7.772
398 HD22 ASN 52 2HD2 ASN 52 3.456 6.944 -7.971
399 H ASP 53 H ASP 53 3.431 2.953 -6.294
400 HA ASP 53 HA ASP 53 3.547 0.506 -4.734
401 HB2 ASP 53 2HB ASP 53 1.365 1.292 -5.489
402 HB3 ASP 53 3HB ASP 53 1.903 1.242 -7.165
403 H LYS 54 H LYS 54 4.226 -1.490 -5.495
404 HA LYS 54 HA LYS 54 5.681 -2.889 -6.553
405 HB2 LYS 54 2HB LYS 54 3.754 -2.599 -8.214
406 HB3 LYS 54 3HB LYS 54 4.826 -1.520 -9.098
407 HG2 LYS 54 2HG LYS 54 5.497 -3.342 -10.183
408 HG3 LYS 54 3HG LYS 54 6.392 -3.739 -8.714
409 HD2 LYS 54 2HD LYS 54 4.827 -5.285 -8.020
410 HD3 LYS 54 3HD LYS 54 3.522 -4.533 -8.940
411 HE2 LYS 54 2HE LYS 54 5.755 -5.595 -10.539
412 HE3 LYS 54 3HE LYS 54 4.801 -6.802 -9.678
413 HZ1 LYS 54 3HZ LYS 54 4.156 -5.828 -12.075
414 HZ2 LYS 54 1HZ LYS 54 3.272 -4.780 -11.083
415 HZ3 LYS 54 2HZ LYS 54 3.024 -6.450 -10.981
416 H MET 55 H MET 55 6.980 -0.716 -5.516
417 HA MET 55 HA MET 55 8.689 0.462 -7.526
418 HB2 MET 55 2HB MET 55 8.447 0.695 -4.547
419 HB3 MET 55 3HB MET 55 9.887 1.295 -5.357
420 HG2 MET 55 2HG MET 55 7.775 2.323 -6.836
421 HG3 MET 55 3HG MET 55 7.259 2.463 -5.157
422 HE1 MET 55 3HE MET 55 11.280 3.816 -6.694
423 HE2 MET 55 1HE MET 55 10.180 2.636 -7.407
424 HE3 MET 55 2HE MET 55 9.995 4.351 -7.777
425 H VAL 56 H VAL 56 11.143 0.460 -6.944
426 HA VAL 56 HA VAL 56 12.033 -2.187 -6.066
427 HB VAL 56 HB VAL 56 12.811 -0.959 -8.714
428 HG11 VAL 56 1HG1 VAL 56 14.733 -1.999 -7.679
429 HG12 VAL 56 2HG1 VAL 56 13.801 -3.461 -7.351
430 HG13 VAL 56 3HG1 VAL 56 14.164 -2.999 -9.015
431 HG21 VAL 56 3HG2 VAL 56 11.422 -3.576 -8.164
432 HG22 VAL 56 1HG2 VAL 56 10.587 -2.090 -8.617
433 HG23 VAL 56 2HG2 VAL 56 11.730 -2.835 -9.735
434 H ILE 57 H ILE 57 13.174 -1.513 -4.331
435 HA ILE 57 HA ILE 57 15.094 0.681 -4.679
436 HB ILE 57 HB ILE 57 14.425 -0.615 -2.052
437 HG12 ILE 57 2HG1 ILE 57 12.298 0.065 -3.043
438 HG13 ILE 57 3HG1 ILE 57 12.722 1.139 -1.714
439 HG21 ILE 57 1HG2 ILE 57 16.250 1.324 -2.809
440 HG22 ILE 57 2HG2 ILE 57 14.917 2.239 -2.106
441 HG23 ILE 57 3HG2 ILE 57 15.710 0.974 -1.167
442 HD11 ILE 57 3HD1 ILE 57 13.375 2.860 -3.223
443 HD12 ILE 57 1HD1 ILE 57 13.226 1.778 -4.607
444 HD13 ILE 57 2HD1 ILE 57 11.786 2.275 -3.717
445 H ASP 58 H ASP 58 17.264 0.425 -4.290
446 HA ASP 58 HA ASP 58 18.202 -2.354 -4.186
447 HB2 ASP 58 2HB ASP 58 18.845 -0.495 -5.998
448 HB3 ASP 58 3HB ASP 58 20.075 -0.123 -4.792
449 H ALA 59 H ALA 59 18.599 -2.986 -2.162
450 HA ALA 59 HA ALA 59 19.658 -1.097 -0.212
451 HB1 ALA 59 1HB ALA 59 17.871 -3.190 -0.020
452 HB2 ALA 59 2HB ALA 59 19.342 -3.832 0.711
453 HB3 ALA 59 3HB ALA 59 18.630 -2.340 1.326
454 H PHE 60 H PHE 60 21.788 -0.810 -0.196
455 HA PHE 60 HA PHE 60 23.540 -3.080 -0.822
456 HD1 PHE 60 HD2 PHE 60 26.572 -2.458 -0.797
457 HD2 PHE 60 HD1 PHE 60 24.727 1.284 0.046
458 HE1 PHE 60 HE2 PHE 60 28.616 -1.714 0.352
459 HE2 PHE 60 HE1 PHE 60 26.768 2.034 1.197
460 HZ PHE 60 HZ PHE 60 28.716 0.535 1.352
461 HB2 PHE 60 2HB PHE 60 24.557 -1.537 -2.095
462 HB3 PHE 60 3HB PHE 60 23.653 -0.225 -1.346
463 H VAL 61 H VAL 61 24.565 -4.092 0.764
464 HA VAL 61 HA VAL 61 24.626 -2.869 3.423
465 HB VAL 61 HB VAL 61 25.026 -5.045 4.313
466 HG11 VAL 61 1HG1 VAL 61 22.758 -4.399 2.867
467 HG12 VAL 61 2HG1 VAL 61 23.147 -6.037 2.338
468 HG13 VAL 61 3HG1 VAL 61 22.910 -5.696 4.052
469 HG21 VAL 61 3HG2 VAL 61 24.978 -6.831 2.178
470 HG22 VAL 61 1HG2 VAL 61 26.095 -5.560 1.680
471 HG23 VAL 61 2HG2 VAL 61 26.364 -6.428 3.191
472 HA PRO 62 HA PRO 62 28.939 -2.038 3.361
473 HB2 PRO 62 2HB PRO 62 29.564 -2.415 5.976
474 HB3 PRO 62 3HB PRO 62 28.642 -1.021 5.400
475 HG2 PRO 62 2HG PRO 62 27.659 -3.550 6.665
476 HG3 PRO 62 3HG PRO 62 27.147 -1.879 6.962
477 HD2 PRO 62 2HD PRO 62 25.734 -3.580 5.399
478 HD3 PRO 62 3HD PRO 62 25.791 -1.831 5.099
479 H ALA 63 H ALA 63 30.797 -3.111 2.966
480 HA ALA 63 HA ALA 63 30.797 -5.966 2.987
481 HB1 ALA 63 1HB ALA 63 32.376 -3.866 1.823
482 HB2 ALA 63 2HB ALA 63 33.419 -5.094 2.542
483 HB3 ALA 63 3HB ALA 63 32.220 -5.553 1.333
484 H ASP 64 H ASP 64 32.829 -7.127 3.845
485 HA ASP 64 HA ASP 64 32.841 -6.835 6.680
486 HB2 ASP 64 2HB ASP 64 34.291 -8.750 6.708
487 HB3 ASP 64 3HB ASP 64 33.077 -9.014 5.460
488 H GLY 65 H GLY 65 34.242 -5.819 7.991
489 HA2 GLY 65 2HA GLY 65 36.522 -5.138 8.497
490 HA3 GLY 65 3HA GLY 65 36.724 -4.759 6.793
491 H ALA 66 H ALA 66 37.499 -2.685 7.616
492 HA ALA 66 HA ALA 66 37.268 -0.471 8.112
493 HB1 ALA 66 1HB ALA 66 35.724 -0.955 6.013
494 HB2 ALA 66 2HB ALA 66 34.463 -0.461 7.144
495 HB3 ALA 66 3HB ALA 66 35.795 0.635 6.775
496 H GLY 67 H GLY 67 36.390 -2.454 10.135
497 HA2 GLY 67 2HA GLY 67 34.419 -0.800 11.585
498 HA3 GLY 67 3HA GLY 67 34.618 -2.531 11.815
499 H LEU 68 H LEU 68 36.920 0.188 11.738
500 HA LEU 68 HA LEU 68 38.535 -0.868 13.793
501 HG LEU 68 HG LEU 68 40.414 -0.326 12.564
502 HB2 LEU 68 2HB LEU 68 38.525 1.411 12.074
503 HB3 LEU 68 3HB LEU 68 38.848 1.942 13.723
504 HD11 LEU 68 1HD1 LEU 68 40.842 2.603 12.016
505 HD12 LEU 68 2HD1 LEU 68 40.629 1.303 10.844
506 HD13 LEU 68 3HD1 LEU 68 42.094 1.376 11.822
507 HD21 LEU 68 3HD2 LEU 68 40.390 1.075 14.987
508 HD22 LEU 68 1HD2 LEU 68 41.835 1.618 14.133
509 HD23 LEU 68 2HD2 LEU 68 41.584 -0.101 14.438
510 H GLU 69 H GLU 69 36.679 2.173 13.952
511 HA GLU 69 HA GLU 69 36.409 1.790 16.839
512 HB2 GLU 69 2HB GLU 69 35.776 4.133 16.925
513 HB3 GLU 69 3HB GLU 69 37.273 3.949 16.021
514 HG2 GLU 69 2HG GLU 69 36.035 4.137 13.926
515 HG3 GLU 69 3HG GLU 69 34.533 4.321 14.831
Start of MODEL 3
1 HA MET 1 HA MET 1 2.076 -0.157 -1.716
2 H1 MET 1 H MET 1 2.581 0.262 1.144
3 HB2 MET 1 2HB MET 1 3.825 1.379 -2.351
4 HB3 MET 1 3HB MET 1 2.660 2.229 -1.344
5 HG2 MET 1 2HG MET 1 4.260 2.831 0.050
6 HG3 MET 1 3HG MET 1 4.684 1.144 0.332
7 HE1 MET 1 3HE MET 1 7.282 3.471 0.306
8 HE2 MET 1 1HE MET 1 6.847 1.890 0.957
9 HE3 MET 1 2HE MET 1 8.200 2.040 -0.165
10 H LEU 2 H LEU 2 3.698 -1.333 -2.818
11 HA LEU 2 HA LEU 2 5.291 -3.021 -1.038
12 HG LEU 2 HG LEU 2 6.307 -5.173 -2.667
13 HB2 LEU 2 2HB LEU 2 3.647 -3.783 -2.959
14 HB3 LEU 2 3HB LEU 2 5.072 -3.525 -3.963
15 HD11 LEU 2 1HD1 LEU 2 5.708 -5.608 -0.578
16 HD12 LEU 2 2HD1 LEU 2 4.304 -6.474 -1.201
17 HD13 LEU 2 3HD1 LEU 2 4.175 -4.763 -0.793
18 HD21 LEU 2 3HD2 LEU 2 4.554 -5.715 -4.566
19 HD22 LEU 2 1HD2 LEU 2 3.747 -6.566 -3.249
20 HD23 LEU 2 2HD2 LEU 2 5.398 -6.997 -3.696
21 H VAL 3 H VAL 3 7.493 -3.312 -1.274
22 HA VAL 3 HA VAL 3 8.895 -1.727 -3.294
23 HB VAL 3 HB VAL 3 10.220 -1.566 -0.701
24 HG11 VAL 3 1HG1 VAL 3 10.593 -0.336 -2.977
25 HG12 VAL 3 2HG1 VAL 3 9.367 0.768 -2.352
26 HG13 VAL 3 3HG1 VAL 3 10.863 0.512 -1.454
27 HG21 VAL 3 3HG2 VAL 3 8.726 0.165 0.224
28 HG22 VAL 3 1HG2 VAL 3 7.558 -0.191 -1.048
29 HG23 VAL 3 2HG2 VAL 3 7.956 -1.420 0.152
30 H ILE 4 H ILE 4 10.082 -3.189 -4.327
31 HA ILE 4 HA ILE 4 11.009 -5.591 -3.042
32 HB ILE 4 HB ILE 4 11.352 -4.489 -5.822
33 HG12 ILE 4 2HG1 ILE 4 9.169 -5.527 -5.063
34 HG13 ILE 4 3HG1 ILE 4 9.908 -6.269 -6.478
35 HG21 ILE 4 1HG2 ILE 4 12.866 -6.614 -4.458
36 HG22 ILE 4 2HG2 ILE 4 12.242 -7.023 -6.055
37 HG23 ILE 4 3HG2 ILE 4 13.298 -5.626 -5.853
38 HD11 ILE 4 3HD1 ILE 4 10.093 -8.235 -5.466
39 HD12 ILE 4 1HD1 ILE 4 10.752 -7.515 -3.998
40 HD13 ILE 4 2HD1 ILE 4 9.007 -7.578 -4.242
41 H VAL 5 H VAL 5 12.516 -5.098 -1.496
42 HA VAL 5 HA VAL 5 14.770 -3.386 -2.139
43 HB VAL 5 HB VAL 5 14.191 -4.953 0.379
44 HG11 VAL 5 1HG1 VAL 5 15.814 -2.915 1.117
45 HG12 VAL 5 2HG1 VAL 5 16.375 -4.545 0.739
46 HG13 VAL 5 3HG1 VAL 5 16.447 -3.279 -0.488
47 HG21 VAL 5 3HG2 VAL 5 13.420 -2.869 1.320
48 HG22 VAL 5 1HG2 VAL 5 13.805 -2.013 -0.173
49 HG23 VAL 5 2HG2 VAL 5 12.510 -3.210 -0.152
50 H ARG 6 H ARG 6 16.416 -4.191 -3.256
51 HA ARG 6 HA ARG 6 17.050 -7.039 -3.052
52 HE ARG 6 HE ARG 6 14.776 -7.947 -7.371
53 HB2 ARG 6 2HB ARG 6 17.317 -4.990 -5.114
54 HB3 ARG 6 3HB ARG 6 18.779 -5.947 -4.914
55 HG2 ARG 6 2HG ARG 6 17.877 -7.566 -6.116
56 HG3 ARG 6 3HG ARG 6 16.586 -7.734 -4.924
57 HD2 ARG 6 2HD ARG 6 15.235 -6.121 -6.062
58 HD3 ARG 6 3HD ARG 6 16.559 -5.702 -7.148
59 HH11 ARG 6 1HH1 ARG 6 17.904 -6.675 -8.218
60 HH12 ARG 6 2HH1 ARG 6 18.081 -7.684 -9.615
61 HH21 ARG 6 1HH2 ARG 6 14.996 -9.281 -9.208
62 HH22 ARG 6 2HH2 ARG 6 16.426 -9.165 -10.178
63 H LEU 7 H LEU 7 18.687 -7.740 -1.855
64 HA LEU 7 HA LEU 7 20.428 -5.860 -0.532
65 HG LEU 7 HG LEU 7 19.874 -8.348 2.085
66 HB2 LEU 7 2HB LEU 7 19.695 -8.676 -0.249
67 HB3 LEU 7 3HB LEU 7 21.393 -8.347 0.087
68 HD11 LEU 7 1HD1 LEU 7 22.111 -7.121 1.832
69 HD12 LEU 7 2HD1 LEU 7 21.051 -6.648 3.159
70 HD13 LEU 7 3HD1 LEU 7 21.137 -5.656 1.704
71 HD21 LEU 7 3HD2 LEU 7 18.120 -6.996 0.640
72 HD22 LEU 7 1HD2 LEU 7 18.979 -5.617 1.327
73 HD23 LEU 7 2HD2 LEU 7 18.223 -6.803 2.391
74 H GLN 8 H GLN 8 22.815 -6.351 -0.411
75 HA GLN 8 HA GLN 8 24.226 -5.791 -2.559
76 HB2 GLN 8 2HB GLN 8 25.011 -6.571 -0.180
77 HB3 GLN 8 3HB GLN 8 25.275 -8.112 -0.985
78 HG2 GLN 8 2HG GLN 8 26.628 -6.758 -2.693
79 HG3 GLN 8 3HG GLN 8 26.617 -5.483 -1.475
80 HE21 GLN 8 1HE2 GLN 8 29.009 -6.087 -1.947
81 HE22 GLN 8 2HE2 GLN 8 29.708 -7.205 -0.831
82 H ASP 9 H ASP 9 23.477 -9.193 -1.789
83 HA ASP 9 HA ASP 9 23.408 -9.757 -4.664
84 HB2 ASP 9 2HB ASP 9 24.769 -11.735 -4.436
85 HB3 ASP 9 3HB ASP 9 25.663 -10.366 -3.779
86 H GLN 10 H GLN 10 21.203 -9.397 -3.038
87 HA GLN 10 HA GLN 10 19.940 -11.988 -3.286
88 HB2 GLN 10 2HB GLN 10 20.255 -10.603 -0.628
89 HB3 GLN 10 3HB GLN 10 18.983 -11.779 -0.930
90 HG2 GLN 10 2HG GLN 10 20.732 -13.436 -1.521
91 HG3 GLN 10 3HG GLN 10 21.950 -12.255 -1.045
92 HE21 GLN 10 1HE2 GLN 10 21.593 -14.825 0.092
93 HE22 GLN 10 2HE2 GLN 10 21.173 -14.610 1.754
94 H THR 11 H THR 11 17.546 -11.792 -2.648
95 HA THR 11 HA THR 11 16.531 -9.090 -3.202
96 HB THR 11 HB THR 11 15.471 -11.590 -4.533
97 HG1 THR 11 HG1 THR 11 17.492 -10.941 -5.407
98 HG21 THR 11 3HG2 THR 11 14.161 -9.988 -5.879
99 HG22 THR 11 1HG2 THR 11 14.775 -8.671 -4.880
100 HG23 THR 11 2HG2 THR 11 13.749 -9.915 -4.166
101 H LEU 12 H LEU 12 14.853 -8.493 -1.964
102 HA LEU 12 HA LEU 12 13.068 -10.436 -0.792
103 HG LEU 12 HG LEU 12 14.184 -10.617 2.686
104 HB2 LEU 12 2HB LEU 12 15.292 -9.936 0.647
105 HB3 LEU 12 3HB LEU 12 14.246 -8.645 1.234
106 HD11 LEU 12 1HD1 LEU 12 12.000 -9.210 1.630
107 HD12 LEU 12 2HD1 LEU 12 12.092 -10.067 3.168
108 HD13 LEU 12 3HD1 LEU 12 11.497 -10.897 1.731
109 HD21 LEU 12 3HD2 LEU 12 12.637 -12.242 0.796
110 HD22 LEU 12 1HD2 LEU 12 13.860 -12.720 1.974
111 HD23 LEU 12 2HD2 LEU 12 14.350 -12.083 0.404
112 HA PRO 13 HA PRO 13 10.530 -6.866 -1.598
113 HB2 PRO 13 2HB PRO 13 8.185 -8.024 -0.869
114 HB3 PRO 13 3HB PRO 13 8.976 -8.348 -2.416
115 HG2 PRO 13 2HG PRO 13 9.004 -9.968 0.102
116 HG3 PRO 13 3HG PRO 13 8.825 -10.512 -1.577
117 HD2 PRO 13 2HD PRO 13 11.171 -10.677 -0.234
118 HD3 PRO 13 3HD PRO 13 11.091 -10.402 -1.986
119 H PHE 14 H PHE 14 9.173 -5.423 -0.388
120 HA PHE 14 HA PHE 14 9.217 -5.803 2.523
121 HD1 PHE 14 HD1 PHE 14 12.386 -5.305 1.352
122 HD2 PHE 14 HD2 PHE 14 10.340 -3.364 4.540
123 HE1 PHE 14 HE1 PHE 14 14.235 -5.864 2.874
124 HE2 PHE 14 HE2 PHE 14 12.187 -3.919 6.067
125 HZ PHE 14 HZ PHE 14 14.138 -5.170 5.235
126 HB2 PHE 14 2HB PHE 14 10.538 -3.684 0.959
127 HB3 PHE 14 3HB PHE 14 9.583 -3.108 2.322
128 H GLU 15 H GLU 15 7.330 -5.371 3.477
129 HA GLU 15 HA GLU 15 5.182 -4.265 1.843
130 HB2 GLU 15 2HB GLU 15 4.660 -6.323 2.972
131 HB3 GLU 15 3HB GLU 15 5.186 -5.668 4.516
132 HG2 GLU 15 2HG GLU 15 3.302 -4.355 4.754
133 HG3 GLU 15 3HG GLU 15 2.949 -4.371 3.027
134 H LEU 16 H LEU 16 4.743 -2.173 1.936
135 HA LEU 16 HA LEU 16 5.243 -0.738 4.461
136 HG LEU 16 HG LEU 16 7.804 0.685 2.224
137 HB2 LEU 16 2HB LEU 16 5.718 0.015 1.620
138 HB3 LEU 16 3HB LEU 16 5.291 1.281 2.768
139 HD11 LEU 16 1HD1 LEU 16 6.825 1.228 5.023
140 HD12 LEU 16 2HD1 LEU 16 7.008 2.435 3.750
141 HD13 LEU 16 3HD1 LEU 16 8.426 1.597 4.380
142 HD21 LEU 16 3HD2 LEU 16 7.239 -1.143 4.551
143 HD22 LEU 16 1HD2 LEU 16 8.781 -0.878 3.738
144 HD23 LEU 16 2HD2 LEU 16 7.469 -1.702 2.894
145 HA PRO 17 HA PRO 17 1.057 0.568 4.607
146 HB2 PRO 17 2HB PRO 17 1.257 3.159 5.395
147 HB3 PRO 17 3HB PRO 17 1.594 1.798 6.472
148 HG2 PRO 17 2HG PRO 17 3.506 3.523 4.945
149 HG3 PRO 17 3HG PRO 17 3.615 2.939 6.616
150 HD2 PRO 17 2HD PRO 17 4.971 1.784 4.577
151 HD3 PRO 17 3HD PRO 17 4.377 0.861 5.972
152 H ALA 18 H ALA 18 -0.477 2.369 3.882
153 HA ALA 18 HA ALA 18 -0.311 2.649 1.087
154 HB1 ALA 18 1HB ALA 18 -2.204 3.279 3.168
155 HB2 ALA 18 2HB ALA 18 -2.132 4.567 1.965
156 HB3 ALA 18 3HB ALA 18 -2.484 2.913 1.465
157 H GLY 19 H GLY 19 0.372 4.271 -0.219
158 HA2 GLY 19 2HA GLY 19 1.626 6.093 -0.848
159 HA3 GLY 19 3HA GLY 19 0.676 6.948 0.359
160 H ALA 20 H ALA 20 2.795 4.310 1.213
161 HA ALA 20 HA ALA 20 4.099 5.600 3.262
162 HB1 ALA 20 1HB ALA 20 5.373 3.482 1.541
163 HB2 ALA 20 2HB ALA 20 5.695 3.832 3.240
164 HB3 ALA 20 3HB ALA 20 4.143 3.146 2.760
165 H ARG 21 H ARG 21 6.492 6.093 3.371
166 HA ARG 21 HA ARG 21 7.454 7.402 0.924
167 HE ARG 21 HE ARG 21 4.757 11.866 1.097
168 HB2 ARG 21 2HB ARG 21 6.654 8.678 3.409
169 HB3 ARG 21 3HB ARG 21 8.328 9.035 3.005
170 HG2 ARG 21 2HG ARG 21 7.769 10.162 1.083
171 HG3 ARG 21 3HG ARG 21 6.233 9.313 0.905
172 HD2 ARG 21 2HD ARG 21 6.110 10.692 3.355
173 HD3 ARG 21 3HD ARG 21 6.784 11.820 2.179
174 HH11 ARG 21 1HH1 ARG 21 4.795 9.258 3.403
175 HH12 ARG 21 2HH1 ARG 21 3.101 8.927 3.253
176 HH21 ARG 21 1HH2 ARG 21 2.526 11.440 0.890
177 HH22 ARG 21 2HH2 ARG 21 1.811 10.168 1.822
178 H ALA 22 H ALA 22 9.811 8.197 1.333
179 HA ALA 22 HA ALA 22 11.462 6.013 1.639
180 HB1 ALA 22 1HB ALA 22 13.315 7.626 1.857
181 HB2 ALA 22 2HB ALA 22 12.207 8.036 0.547
182 HB3 ALA 22 3HB ALA 22 12.136 8.920 2.072
183 H SER 23 H SER 23 10.731 8.520 4.058
184 HA SER 23 HA SER 23 12.340 7.686 6.123
185 HG SER 23 HG SER 23 11.091 9.399 8.368
186 HB2 SER 23 2HB SER 23 11.057 9.725 6.305
187 HB3 SER 23 3HB SER 23 9.540 8.827 6.252
188 H GLN 24 H GLN 24 9.022 6.593 5.441
189 HA GLN 24 HA GLN 24 8.725 4.810 7.538
190 HB2 GLN 24 2HB GLN 24 7.158 5.561 5.480
191 HB3 GLN 24 3HB GLN 24 7.625 3.961 4.921
192 HG2 GLN 24 2HG GLN 24 6.148 3.021 6.265
193 HG3 GLN 24 3HG GLN 24 6.880 3.800 7.667
194 HE21 GLN 24 1HE2 GLN 24 5.021 4.274 8.735
195 HE22 GLN 24 2HE2 GLN 24 3.840 5.395 8.158
196 H LEU 25 H LEU 25 9.734 3.991 4.213
197 HA LEU 25 HA LEU 25 10.363 1.331 4.652
198 HG LEU 25 HG LEU 25 12.866 1.043 2.651
199 HB2 LEU 25 2HB LEU 25 10.255 2.522 2.452
200 HB3 LEU 25 3HB LEU 25 11.850 3.186 2.801
201 HD11 LEU 25 1HD1 LEU 25 11.584 -1.007 2.272
202 HD12 LEU 25 2HD1 LEU 25 10.083 -0.097 2.436
203 HD13 LEU 25 3HD1 LEU 25 11.172 -0.256 3.814
204 HD21 LEU 25 3HD2 LEU 25 10.898 1.641 0.468
205 HD22 LEU 25 1HD2 LEU 25 12.009 0.275 0.356
206 HD23 LEU 25 2HD2 LEU 25 12.641 1.916 0.500
207 H SER 26 H SER 26 12.548 4.140 4.805
208 HA SER 26 HA SER 26 14.895 2.851 5.456
209 HG SER 26 HG SER 26 15.523 6.015 4.627
210 HB2 SER 26 2HB SER 26 13.818 5.567 5.816
211 HB3 SER 26 3HB SER 26 15.092 5.133 6.955
212 H ASN 27 H ASN 27 12.156 3.609 7.506
213 HA ASN 27 HA ASN 27 13.441 3.020 9.978
214 HB2 ASN 27 2HB ASN 27 11.381 4.417 9.758
215 HB3 ASN 27 3HB ASN 27 10.482 2.958 9.352
216 HD21 ASN 27 1HD2 ASN 27 11.400 4.990 11.802
217 HD22 ASN 27 2HD2 ASN 27 11.070 3.962 13.151
218 H LEU 28 H LEU 28 11.170 1.188 7.936
219 HA LEU 28 HA LEU 28 10.969 -1.116 9.437
220 HG LEU 28 HG LEU 28 8.558 -1.424 6.665
221 HB2 LEU 28 2HB LEU 28 10.856 -0.571 6.503
222 HB3 LEU 28 3HB LEU 28 10.791 -2.234 7.083
223 HD11 LEU 28 1HD1 LEU 28 7.546 -1.978 8.734
224 HD12 LEU 28 2HD1 LEU 28 8.964 -1.461 9.646
225 HD13 LEU 28 3HD1 LEU 28 9.043 -2.907 8.639
226 HD21 LEU 28 3HD2 LEU 28 9.280 0.801 8.566
227 HD22 LEU 28 1HD2 LEU 28 7.644 0.456 8.005
228 HD23 LEU 28 2HD2 LEU 28 8.885 0.947 6.852
229 H LEU 29 H LEU 29 13.360 -0.408 6.895
230 HA LEU 29 HA LEU 29 14.801 -2.825 7.234
231 HG LEU 29 HG LEU 29 14.171 -2.499 4.937
232 HB2 LEU 29 2HB LEU 29 15.402 -0.202 5.918
233 HB3 LEU 29 3HB LEU 29 16.635 -1.455 6.044
234 HD11 LEU 29 1HD1 LEU 29 15.284 0.018 3.807
235 HD12 LEU 29 2HD1 LEU 29 13.616 -0.548 3.883
236 HD13 LEU 29 3HD1 LEU 29 14.727 -1.237 2.699
237 HD21 LEU 29 3HD2 LEU 29 16.965 -2.261 3.825
238 HD22 LEU 29 1HD2 LEU 29 15.687 -3.320 3.230
239 HD23 LEU 29 2HD2 LEU 29 16.374 -3.582 4.834
240 H SER 30 H SER 30 15.214 0.445 8.514
241 HA SER 30 HA SER 30 17.687 0.138 9.747
242 HG SER 30 HG SER 30 16.240 2.197 12.292
243 HB2 SER 30 2HB SER 30 16.772 2.327 9.642
244 HB3 SER 30 3HB SER 30 15.292 1.830 10.462
245 H SER 31 H SER 31 14.457 -0.691 10.912
246 HA SER 31 HA SER 31 15.094 -1.332 13.549
247 HG SER 31 HG SER 31 12.448 -1.181 14.182
248 HB2 SER 31 2HB SER 31 12.801 -1.337 12.090
249 HB3 SER 31 3HB SER 31 13.086 -3.070 12.251
250 H SER 32 H SER 32 15.669 -3.064 10.598
251 HA SER 32 HA SER 32 15.978 -5.663 11.557
252 HG SER 32 HG SER 32 15.927 -4.018 8.374
253 HB2 SER 32 2HB SER 32 17.702 -4.473 9.385
254 HB3 SER 32 3HB SER 32 17.141 -6.137 9.542
255 H GLY 33 H GLY 33 18.281 -6.762 11.397
256 HA2 GLY 33 2HA GLY 33 19.863 -5.482 13.489
257 HA3 GLY 33 3HA GLY 33 20.012 -7.145 12.942
258 H MET 34 H MET 34 19.871 -4.755 10.489
259 HA MET 34 HA MET 34 22.802 -4.769 10.239
260 HB2 MET 34 2HB MET 34 20.801 -5.809 8.377
261 HB3 MET 34 3HB MET 34 21.907 -4.664 7.631
262 HG2 MET 34 2HG MET 34 22.869 -6.986 9.266
263 HG3 MET 34 3HG MET 34 22.536 -7.116 7.541
264 HE1 MET 34 3HE MET 34 25.142 -7.119 9.826
265 HE2 MET 34 1HE MET 34 25.464 -7.928 8.292
266 HE3 MET 34 2HE MET 34 26.519 -6.625 8.840
267 H ALA 35 H ALA 35 23.426 -3.122 8.408
268 HA ALA 35 HA ALA 35 21.707 -0.831 8.169
269 HB1 ALA 35 1HB ALA 35 22.811 0.704 9.503
270 HB2 ALA 35 2HB ALA 35 22.827 -0.749 10.504
271 HB3 ALA 35 3HB ALA 35 24.271 -0.281 9.606
272 H PHE 36 H PHE 36 22.108 -1.354 5.954
273 HA PHE 36 HA PHE 36 24.787 -0.555 5.020
274 HD1 PHE 36 HD2 PHE 36 21.642 -1.766 2.372
275 HD2 PHE 36 HD1 PHE 36 23.132 -4.190 5.537
276 HE1 PHE 36 HE2 PHE 36 19.526 -3.020 2.402
277 HE2 PHE 36 HE1 PHE 36 21.018 -5.449 5.572
278 HZ PHE 36 HZ PHE 36 19.211 -4.864 4.003
279 HB2 PHE 36 2HB PHE 36 24.044 -1.879 2.906
280 HB3 PHE 36 3HB PHE 36 24.596 -2.769 4.321
281 H SER 37 H SER 37 24.606 0.149 2.579
282 HA SER 37 HA SER 37 23.048 2.534 2.572
283 HG SER 37 HG SER 37 24.381 4.022 0.639
284 HB2 SER 37 2HB SER 37 25.189 1.396 1.005
285 HB3 SER 37 3HB SER 37 23.945 2.060 -0.053
286 H LEU 38 H LEU 38 21.130 2.973 1.647
287 HA LEU 38 HA LEU 38 19.906 0.919 -0.065
288 HG LEU 38 HG LEU 38 19.313 -0.506 1.604
289 HB2 LEU 38 2HB LEU 38 18.893 2.114 2.449
290 HB3 LEU 38 3HB LEU 38 17.727 1.874 1.150
291 HD11 LEU 38 1HD1 LEU 38 18.576 -1.080 3.791
292 HD12 LEU 38 2HD1 LEU 38 17.608 0.389 3.918
293 HD13 LEU 38 3HD1 LEU 38 19.368 0.492 3.901
294 HD21 LEU 38 3HD2 LEU 38 16.476 0.302 1.312
295 HD22 LEU 38 1HD2 LEU 38 16.807 -1.235 2.111
296 HD23 LEU 38 2HD2 LEU 38 17.393 -0.950 0.473
297 H HIS 39 H HIS 39 19.978 1.946 -1.986
298 HA HIS 39 HA HIS 39 18.506 4.475 -2.194
299 HD1 HIS 39 HD1 HIS 39 23.067 4.457 -2.090
300 HD2 HIS 39 HD2 HIS 39 20.982 2.354 -5.003
301 HE1 HIS 39 HE1 HIS 39 24.701 2.779 -3.006
302 HB2 HIS 39 2HB HIS 39 20.209 5.171 -3.962
303 HB3 HIS 39 3HB HIS 39 20.743 5.242 -2.285
304 H THR 40 H THR 40 17.758 4.933 -4.401
305 HA THR 40 HA THR 40 17.286 2.442 -5.905
306 HB THR 40 HB THR 40 15.105 2.998 -6.291
307 HG1 THR 40 HG1 THR 40 15.049 4.890 -7.295
308 HG21 THR 40 3HG2 THR 40 15.737 3.109 -3.740
309 HG22 THR 40 1HG2 THR 40 14.109 3.517 -4.281
310 HG23 THR 40 2HG2 THR 40 15.264 4.799 -3.917
311 H GLN 41 H GLN 41 17.691 2.409 -8.054
312 HA GLN 41 HA GLN 41 18.583 3.021 -10.055
313 HB2 GLN 41 2HB GLN 41 16.545 4.853 -9.456
314 HB3 GLN 41 3HB GLN 41 17.887 5.825 -10.043
315 HG2 GLN 41 2HG GLN 41 17.988 4.191 -11.999
316 HG3 GLN 41 3HG GLN 41 16.404 3.639 -11.456
317 HE21 GLN 41 1HE2 GLN 41 15.358 4.343 -13.293
318 HE22 GLN 41 2HE2 GLN 41 15.105 6.016 -13.641
319 H GLY 42 H GLY 42 20.039 3.587 -7.446
320 HA2 GLY 42 2HA GLY 42 22.332 4.105 -7.248
321 HA3 GLY 42 3HA GLY 42 22.208 5.103 -8.689
322 H ARG 43 H ARG 43 19.701 6.329 -7.480
323 HA ARG 43 HA ARG 43 21.123 8.383 -5.974
324 HE ARG 43 HE ARG 43 18.129 9.518 -9.395
325 HB2 ARG 43 2HB ARG 43 19.081 9.722 -6.287
326 HB3 ARG 43 3HB ARG 43 19.717 9.128 -7.815
327 HG2 ARG 43 2HG ARG 43 18.016 7.489 -7.989
328 HG3 ARG 43 3HG ARG 43 17.492 7.763 -6.326
329 HD2 ARG 43 2HD ARG 43 15.937 8.827 -7.820
330 HD3 ARG 43 3HD ARG 43 16.845 10.069 -6.960
331 HH11 ARG 43 1HH1 ARG 43 15.213 10.974 -8.172
332 HH12 ARG 43 2HH1 ARG 43 15.041 12.064 -9.508
333 HH21 ARG 43 1HH2 ARG 43 17.914 10.948 -11.159
334 HH22 ARG 43 2HH2 ARG 43 16.578 12.047 -11.207
335 H VAL 44 H VAL 44 20.785 8.839 -3.864
336 HA VAL 44 HA VAL 44 19.608 6.875 -2.197
337 HB VAL 44 HB VAL 44 20.263 9.692 -1.352
338 HG11 VAL 44 1HG1 VAL 44 19.387 8.763 0.520
339 HG12 VAL 44 2HG1 VAL 44 19.752 7.114 0.006
340 HG13 VAL 44 3HG1 VAL 44 21.026 8.131 0.680
341 HG21 VAL 44 3HG2 VAL 44 22.485 8.258 -0.725
342 HG22 VAL 44 1HG2 VAL 44 22.043 7.551 -2.279
343 HG23 VAL 44 2HG2 VAL 44 22.327 9.286 -2.149
344 H LEU 45 H LEU 45 17.858 7.183 -0.679
345 HA LEU 45 HA LEU 45 15.633 8.615 -1.905
346 HG LEU 45 HG LEU 45 15.213 5.685 -2.181
347 HB2 LEU 45 2HB LEU 45 15.933 6.346 -0.038
348 HB3 LEU 45 3HB LEU 45 14.522 7.374 0.207
349 HD11 LEU 45 1HD1 LEU 45 13.903 4.902 -0.070
350 HD12 LEU 45 2HD1 LEU 45 13.311 4.489 -1.679
351 HD13 LEU 45 3HD1 LEU 45 12.578 5.821 -0.785
352 HD21 LEU 45 3HD2 LEU 45 12.817 6.854 -2.784
353 HD22 LEU 45 1HD2 LEU 45 14.377 7.316 -3.465
354 HD23 LEU 45 2HD2 LEU 45 13.722 8.198 -2.085
355 H SER 46 H SER 46 15.237 10.625 -1.284
356 HA SER 46 HA SER 46 16.360 11.853 0.981
357 HG SER 46 HG SER 46 16.075 14.435 -0.623
358 HB2 SER 46 2HB SER 46 15.049 12.734 -1.270
359 HB3 SER 46 3HB SER 46 13.884 13.090 0.004
360 H GLU 47 H GLU 47 14.455 13.266 2.281
361 HA GLU 47 HA GLU 47 13.269 11.228 3.972
362 HB2 GLU 47 2HB GLU 47 13.220 14.229 4.319
363 HB3 GLU 47 3HB GLU 47 12.845 13.020 5.539
364 HG2 GLU 47 2HG GLU 47 15.206 12.212 5.330
365 HG3 GLU 47 3HG GLU 47 15.523 13.616 4.312
366 H ALA 48 H ALA 48 12.307 13.409 1.501
367 HA ALA 48 HA ALA 48 9.470 12.932 2.140
368 HB1 ALA 48 1HB ALA 48 10.409 15.331 2.034
369 HB2 ALA 48 2HB ALA 48 10.403 15.091 0.287
370 HB3 ALA 48 3HB ALA 48 8.897 14.977 1.198
371 H ALA 49 H ALA 49 11.563 11.355 0.535
372 HA ALA 49 HA ALA 49 10.874 11.427 -2.187
373 HB1 ALA 49 1HB ALA 49 11.613 8.785 -1.192
374 HB2 ALA 49 2HB ALA 49 12.401 9.807 -2.395
375 HB3 ALA 49 3HB ALA 49 12.709 10.067 -0.678
376 H GLU 50 H GLU 50 9.086 10.828 -3.211
377 HA GLU 50 HA GLU 50 7.056 9.318 -1.758
378 HB2 GLU 50 2HB GLU 50 5.831 10.936 -2.736
379 HB3 GLU 50 3HB GLU 50 7.066 11.270 -3.942
380 HG2 GLU 50 2HG GLU 50 6.281 9.578 -5.371
381 HG3 GLU 50 3HG GLU 50 5.284 8.863 -4.105
382 H LEU 51 H LEU 51 6.737 7.221 -2.068
383 HA LEU 51 HA LEU 51 7.970 5.946 -4.410
384 HG LEU 51 HG LEU 51 9.540 4.190 -1.570
385 HB2 LEU 51 2HB LEU 51 7.028 4.699 -1.833
386 HB3 LEU 51 3HB LEU 51 7.872 3.873 -3.141
387 HD11 LEU 51 1HD1 LEU 51 9.821 5.405 -3.930
388 HD12 LEU 51 2HD1 LEU 51 11.086 5.396 -2.701
389 HD13 LEU 51 3HD1 LEU 51 10.032 6.800 -2.871
390 HD21 LEU 51 3HD2 LEU 51 8.038 5.731 -0.189
391 HD22 LEU 51 1HD2 LEU 51 8.770 7.052 -1.099
392 HD23 LEU 51 2HD2 LEU 51 9.779 6.000 -0.106
393 H ASN 52 H ASN 52 6.649 3.624 -4.625
394 HA ASN 52 HA ASN 52 3.788 4.131 -4.718
395 HB2 ASN 52 2HB ASN 52 5.259 4.750 -6.948
396 HB3 ASN 52 3HB ASN 52 4.782 3.087 -7.279
397 HD21 ASN 52 1HD2 ASN 52 3.981 5.847 -8.300
398 HD22 ASN 52 2HD2 ASN 52 2.254 5.801 -8.280
399 H ASP 53 H ASP 53 3.061 2.015 -6.357
400 HA ASP 53 HA ASP 53 3.636 -0.219 -4.601
401 HB2 ASP 53 2HB ASP 53 1.319 0.249 -5.334
402 HB3 ASP 53 3HB ASP 53 1.799 -0.065 -7.000
403 H LYS 54 H LYS 54 4.501 -2.201 -5.247
404 HA LYS 54 HA LYS 54 5.977 -3.560 -6.317
405 HB2 LYS 54 2HB LYS 54 4.025 -3.116 -8.083
406 HB3 LYS 54 3HB LYS 54 5.346 -2.367 -8.970
407 HG2 LYS 54 2HG LYS 54 5.754 -4.405 -9.760
408 HG3 LYS 54 3HG LYS 54 6.439 -4.751 -8.170
409 HD2 LYS 54 2HD LYS 54 4.374 -5.690 -7.410
410 HD3 LYS 54 3HD LYS 54 3.534 -5.154 -8.867
411 HE2 LYS 54 2HE LYS 54 5.855 -6.788 -9.473
412 HE3 LYS 54 3HE LYS 54 4.700 -7.633 -8.444
413 HZ1 LYS 54 3HZ LYS 54 3.368 -7.926 -10.172
414 HZ2 LYS 54 1HZ LYS 54 4.548 -7.252 -11.180
415 HZ3 LYS 54 2HZ LYS 54 3.343 -6.270 -10.515
416 H MET 55 H MET 55 7.152 -1.352 -5.252
417 HA MET 55 HA MET 55 8.790 -0.003 -7.195
418 HB2 MET 55 2HB MET 55 8.612 0.007 -4.202
419 HB3 MET 55 3HB MET 55 9.995 0.740 -5.003
420 HG2 MET 55 2HG MET 55 7.567 1.633 -6.233
421 HG3 MET 55 3HG MET 55 7.495 1.887 -4.491
422 HE1 MET 55 3HE MET 55 9.041 3.911 -7.770
423 HE2 MET 55 1HE MET 55 10.649 3.293 -7.391
424 HE3 MET 55 2HE MET 55 9.312 2.172 -7.647
425 H VAL 56 H VAL 56 11.244 0.057 -6.732
426 HA VAL 56 HA VAL 56 12.290 -2.577 -6.002
427 HB VAL 56 HB VAL 56 12.890 -1.217 -8.633
428 HG11 VAL 56 1HG1 VAL 56 14.329 -3.156 -9.078
429 HG12 VAL 56 2HG1 VAL 56 14.896 -2.218 -7.695
430 HG13 VAL 56 3HG1 VAL 56 14.038 -3.738 -7.439
431 HG21 VAL 56 3HG2 VAL 56 10.877 -2.312 -8.975
432 HG22 VAL 56 1HG2 VAL 56 12.055 -3.537 -9.444
433 HG23 VAL 56 2HG2 VAL 56 11.281 -3.619 -7.862
434 H ILE 57 H ILE 57 13.363 -1.788 -4.237
435 HA ILE 57 HA ILE 57 15.095 0.531 -4.504
436 HB ILE 57 HB ILE 57 14.813 -1.235 -2.079
437 HG12 ILE 57 2HG1 ILE 57 12.582 -0.510 -2.690
438 HG13 ILE 57 3HG1 ILE 57 13.121 0.409 -1.290
439 HG21 ILE 57 1HG2 ILE 57 16.005 1.423 -2.662
440 HG22 ILE 57 2HG2 ILE 57 15.267 1.169 -1.082
441 HG23 ILE 57 3HG2 ILE 57 16.585 0.127 -1.616
442 HD11 ILE 57 3HD1 ILE 57 13.157 1.385 -4.136
443 HD12 ILE 57 1HD1 ILE 57 11.950 1.801 -2.918
444 HD13 ILE 57 2HD1 ILE 57 13.627 2.307 -2.708
445 H ASP 58 H ASP 58 17.323 0.511 -4.293
446 HA ASP 58 HA ASP 58 18.581 -2.113 -4.719
447 HB2 ASP 58 2HB ASP 58 18.800 0.282 -6.157
448 HB3 ASP 58 3HB ASP 58 20.312 0.141 -5.264
449 H ALA 59 H ALA 59 19.199 -2.866 -2.778
450 HA ALA 59 HA ALA 59 20.467 -1.044 -0.869
451 HB1 ALA 59 1HB ALA 59 20.339 -3.587 0.271
452 HB2 ALA 59 2HB ALA 59 19.270 -2.220 0.587
453 HB3 ALA 59 3HB ALA 59 18.839 -3.410 -0.642
454 H PHE 60 H PHE 60 22.594 -1.021 -0.530
455 HA PHE 60 HA PHE 60 24.195 -3.293 -1.503
456 HD1 PHE 60 HD2 PHE 60 27.265 -2.691 -1.886
457 HD2 PHE 60 HD1 PHE 60 25.477 1.107 -1.182
458 HE1 PHE 60 HE2 PHE 60 29.412 -1.841 -1.038
459 HE2 PHE 60 HE1 PHE 60 27.622 1.963 -0.334
460 HZ PHE 60 HZ PHE 60 29.593 0.488 -0.260
461 HB2 PHE 60 2HB PHE 60 25.113 -1.920 -3.017
462 HB3 PHE 60 3HB PHE 60 24.287 -0.523 -2.335
463 H VAL 61 H VAL 61 25.455 -4.171 -0.004
464 HA VAL 61 HA VAL 61 25.872 -2.718 2.508
465 HB VAL 61 HB VAL 61 26.315 -4.813 3.552
466 HG11 VAL 61 1HG1 VAL 61 24.191 -5.976 2.004
467 HG12 VAL 61 2HG1 VAL 61 24.150 -5.309 3.637
468 HG13 VAL 61 3HG1 VAL 61 23.903 -4.253 2.245
469 HG21 VAL 61 3HG2 VAL 61 27.492 -6.315 2.395
470 HG22 VAL 61 1HG2 VAL 61 25.961 -6.811 1.674
471 HG23 VAL 61 2HG2 VAL 61 26.984 -5.635 0.849
472 HA PRO 62 HA PRO 62 30.160 -2.080 1.805
473 HB2 PRO 62 2HB PRO 62 31.116 -2.234 4.341
474 HB3 PRO 62 3HB PRO 62 30.168 -0.863 3.754
475 HG2 PRO 62 2HG PRO 62 29.288 -3.217 5.381
476 HG3 PRO 62 3HG PRO 62 28.870 -1.505 5.574
477 HD2 PRO 62 2HD PRO 62 27.212 -3.284 4.384
478 HD3 PRO 62 3HD PRO 62 27.279 -1.576 3.907
479 H ALA 63 H ALA 63 31.929 -3.257 1.298
480 HA ALA 63 HA ALA 63 31.844 -6.095 1.580
481 HB1 ALA 63 1HB ALA 63 33.157 -5.972 -0.201
482 HB2 ALA 63 2HB ALA 63 33.241 -4.219 -0.019
483 HB3 ALA 63 3HB ALA 63 34.434 -5.246 0.776
484 H ASP 64 H ASP 64 34.214 -7.071 2.139
485 HA ASP 64 HA ASP 64 34.407 -7.133 4.890
486 HB2 ASP 64 2HB ASP 64 36.693 -7.613 2.969
487 HB3 ASP 64 3HB ASP 64 36.535 -8.256 4.601
488 H GLY 65 H GLY 65 34.714 -5.414 6.160
489 HA2 GLY 65 2HA GLY 65 37.202 -3.948 5.948
490 HA3 GLY 65 3HA GLY 65 35.763 -2.981 5.660
491 H ALA 66 H ALA 66 34.848 -2.048 7.365
492 HA ALA 66 HA ALA 66 35.158 -3.274 10.009
493 HB1 ALA 66 1HB ALA 66 35.493 -0.760 10.774
494 HB2 ALA 66 2HB ALA 66 36.854 -1.784 10.314
495 HB3 ALA 66 3HB ALA 66 36.194 -0.625 9.161
496 H GLY 67 H GLY 67 33.213 -3.474 10.892
497 HA2 GLY 67 2HA GLY 67 31.229 -1.344 10.411
498 HA3 GLY 67 3HA GLY 67 30.787 -3.037 10.242
499 H LEU 68 H LEU 68 29.546 -3.609 11.894
500 HA LEU 68 HA LEU 68 29.466 -2.299 14.379
501 HG LEU 68 HG LEU 68 27.166 -2.331 14.332
502 HB2 LEU 68 2HB LEU 68 28.094 -4.426 13.076
503 HB3 LEU 68 3HB LEU 68 28.540 -4.960 14.695
504 HD11 LEU 68 1HD1 LEU 68 25.868 -5.045 14.268
505 HD12 LEU 68 2HD1 LEU 68 25.744 -3.758 13.070
506 HD13 LEU 68 3HD1 LEU 68 25.005 -3.557 14.658
507 HD21 LEU 68 3HD2 LEU 68 28.080 -3.859 16.501
508 HD22 LEU 68 1HD2 LEU 68 26.320 -3.964 16.531
509 HD23 LEU 68 2HD2 LEU 68 27.110 -2.387 16.549
510 H GLU 69 H GLU 69 30.445 -5.687 13.844
511 HA GLU 69 HA GLU 69 31.666 -6.095 16.286
512 HB2 GLU 69 2HB GLU 69 32.770 -7.987 15.299
513 HB3 GLU 69 3HB GLU 69 31.167 -7.855 14.591
514 HG2 GLU 69 2HG GLU 69 32.189 -6.716 12.635
515 HG3 GLU 69 3HG GLU 69 33.775 -7.039 13.334
Start of MODEL 4
1 HA MET 1 HA MET 1 1.633 -1.087 -3.259
2 H1 MET 1 H MET 1 0.888 -0.927 -0.426
3 HB2 MET 1 2HB MET 1 2.454 1.094 -1.336
4 HB3 MET 1 3HB MET 1 3.215 0.824 -2.899
5 HG2 MET 1 2HG MET 1 0.796 1.048 -3.816
6 HG3 MET 1 3HG MET 1 0.483 1.842 -2.274
7 HE1 MET 1 3HE MET 1 4.082 3.236 -2.658
8 HE2 MET 1 1HE MET 1 3.097 4.634 -2.227
9 HE3 MET 1 2HE MET 1 2.807 3.079 -1.449
10 H LEU 2 H LEU 2 3.332 -2.369 -3.605
11 HA LEU 2 HA LEU 2 4.801 -3.374 -1.287
12 HG LEU 2 HG LEU 2 4.740 -5.605 -1.230
13 HB2 LEU 2 2HB LEU 2 3.993 -4.435 -3.865
14 HB3 LEU 2 3HB LEU 2 5.698 -4.733 -3.530
15 HD11 LEU 2 1HD1 LEU 2 2.592 -6.718 -1.508
16 HD12 LEU 2 2HD1 LEU 2 2.428 -6.022 -3.120
17 HD13 LEU 2 3HD1 LEU 2 2.429 -4.972 -1.702
18 HD21 LEU 2 3HD2 LEU 2 4.941 -6.971 -3.881
19 HD22 LEU 2 1HD2 LEU 2 4.397 -7.869 -2.464
20 HD23 LEU 2 2HD2 LEU 2 5.986 -7.105 -2.465
21 H VAL 3 H VAL 3 7.154 -3.754 -1.531
22 HA VAL 3 HA VAL 3 8.506 -1.896 -3.341
23 HB VAL 3 HB VAL 3 9.333 -1.938 -0.459
24 HG11 VAL 3 1HG1 VAL 3 9.708 0.568 -1.656
25 HG12 VAL 3 2HG1 VAL 3 10.938 -0.641 -1.282
26 HG13 VAL 3 3HG1 VAL 3 10.171 -0.623 -2.871
27 HG21 VAL 3 3HG2 VAL 3 8.019 0.149 -0.142
28 HG22 VAL 3 1HG2 VAL 3 7.237 -0.157 -1.693
29 HG23 VAL 3 2HG2 VAL 3 7.020 -1.289 -0.358
30 H ILE 4 H ILE 4 9.915 -3.113 -4.404
31 HA ILE 4 HA ILE 4 10.946 -5.563 -3.305
32 HB ILE 4 HB ILE 4 11.395 -4.136 -5.916
33 HG12 ILE 4 2HG1 ILE 4 9.264 -5.406 -5.488
34 HG13 ILE 4 3HG1 ILE 4 10.194 -5.979 -6.869
35 HG21 ILE 4 1HG2 ILE 4 13.440 -5.094 -5.882
36 HG22 ILE 4 2HG2 ILE 4 12.980 -6.285 -4.667
37 HG23 ILE 4 3HG2 ILE 4 12.533 -6.530 -6.355
38 HD11 ILE 4 3HD1 ILE 4 10.944 -7.370 -4.460
39 HD12 ILE 4 1HD1 ILE 4 9.211 -7.492 -4.765
40 HD13 ILE 4 2HD1 ILE 4 10.363 -8.006 -5.999
41 H VAL 5 H VAL 5 12.337 -5.226 -1.642
42 HA VAL 5 HA VAL 5 14.474 -3.263 -1.909
43 HB VAL 5 HB VAL 5 13.741 -5.077 0.393
44 HG11 VAL 5 1HG1 VAL 5 15.854 -4.716 1.043
45 HG12 VAL 5 2HG1 VAL 5 16.089 -3.408 -0.118
46 HG13 VAL 5 3HG1 VAL 5 15.300 -3.087 1.427
47 HG21 VAL 5 3HG2 VAL 5 13.257 -2.701 1.381
48 HG22 VAL 5 1HG2 VAL 5 13.099 -2.251 -0.317
49 HG23 VAL 5 2HG2 VAL 5 12.060 -3.503 0.363
50 H ARG 6 H ARG 6 16.339 -3.804 -2.810
51 HA ARG 6 HA ARG 6 17.113 -6.622 -2.938
52 HE ARG 6 HE ARG 6 18.966 -4.878 -6.674
53 HB2 ARG 6 2HB ARG 6 18.464 -4.298 -4.308
54 HB3 ARG 6 3HB ARG 6 18.601 -6.007 -4.699
55 HG2 ARG 6 2HG ARG 6 15.894 -5.493 -4.925
56 HG3 ARG 6 3HG ARG 6 16.664 -4.050 -5.588
57 HD2 ARG 6 2HD ARG 6 17.035 -6.911 -6.446
58 HD3 ARG 6 3HD ARG 6 16.371 -5.575 -7.387
59 HH11 ARG 6 1HH1 ARG 6 17.350 -7.291 -8.594
60 HH12 ARG 6 2HH1 ARG 6 18.669 -7.479 -9.702
61 HH21 ARG 6 1HH2 ARG 6 20.708 -5.117 -8.126
62 HH22 ARG 6 2HH2 ARG 6 20.578 -6.243 -9.435
63 H LEU 7 H LEU 7 18.480 -7.400 -1.487
64 HA LEU 7 HA LEU 7 20.004 -5.642 0.217
65 HG LEU 7 HG LEU 7 19.490 -6.484 2.332
66 HB2 LEU 7 2HB LEU 7 19.347 -8.521 0.129
67 HB3 LEU 7 3HB LEU 7 20.872 -8.092 0.900
68 HD11 LEU 7 1HD1 LEU 7 17.478 -6.604 0.874
69 HD12 LEU 7 2HD1 LEU 7 17.155 -6.946 2.573
70 HD13 LEU 7 3HD1 LEU 7 17.245 -8.268 1.409
71 HD21 LEU 7 3HD2 LEU 7 19.378 -8.067 3.966
72 HD22 LEU 7 1HD2 LEU 7 20.391 -8.930 2.808
73 HD23 LEU 7 2HD2 LEU 7 18.664 -9.279 2.902
74 H GLN 8 H GLN 8 22.341 -6.140 0.655
75 HA GLN 8 HA GLN 8 24.060 -5.457 -1.211
76 HB2 GLN 8 2HB GLN 8 24.462 -6.427 1.207
77 HB3 GLN 8 3HB GLN 8 24.887 -7.886 0.322
78 HG2 GLN 8 2HG GLN 8 26.535 -6.542 -0.970
79 HG3 GLN 8 3HG GLN 8 26.181 -5.182 0.094
80 HE21 GLN 8 1HE2 GLN 8 28.724 -6.210 -0.159
81 HE22 GLN 8 2HE2 GLN 8 29.185 -6.965 1.325
82 H ASP 9 H ASP 9 23.212 -8.896 -0.794
83 HA ASP 9 HA ASP 9 23.534 -9.267 -3.678
84 HB2 ASP 9 2HB ASP 9 24.704 -11.310 -1.816
85 HB3 ASP 9 3HB ASP 9 25.048 -11.037 -3.522
86 H GLN 10 H GLN 10 21.146 -9.072 -2.289
87 HA GLN 10 HA GLN 10 19.994 -11.660 -2.873
88 HB2 GLN 10 2HB GLN 10 19.971 -10.483 -0.098
89 HB3 GLN 10 3HB GLN 10 18.775 -11.657 -0.631
90 HG2 GLN 10 2HG GLN 10 20.591 -13.248 -1.115
91 HG3 GLN 10 3HG GLN 10 21.752 -12.076 -0.495
92 HE21 GLN 10 1HE2 GLN 10 22.128 -14.120 0.834
93 HE22 GLN 10 2HE2 GLN 10 21.278 -14.213 2.335
94 H THR 11 H THR 11 17.541 -11.567 -2.509
95 HA THR 11 HA THR 11 16.514 -8.850 -2.955
96 HB THR 11 HB THR 11 15.474 -11.173 -4.559
97 HG1 THR 11 HG1 THR 11 17.754 -9.585 -5.002
98 HG21 THR 11 3HG2 THR 11 14.219 -8.964 -4.264
99 HG22 THR 11 1HG2 THR 11 14.469 -9.533 -5.913
100 HG23 THR 11 2HG2 THR 11 15.486 -8.249 -5.260
101 H LEU 12 H LEU 12 14.679 -8.398 -1.888
102 HA LEU 12 HA LEU 12 12.837 -10.475 -1.094
103 HG LEU 12 HG LEU 12 13.557 -10.925 2.461
104 HB2 LEU 12 2HB LEU 12 14.861 -10.034 0.635
105 HB3 LEU 12 3HB LEU 12 13.703 -8.830 1.195
106 HD11 LEU 12 1HD1 LEU 12 11.455 -9.486 1.286
107 HD12 LEU 12 2HD1 LEU 12 11.407 -10.469 2.749
108 HD13 LEU 12 3HD1 LEU 12 11.003 -11.188 1.190
109 HD21 LEU 12 3HD2 LEU 12 13.358 -12.968 1.542
110 HD22 LEU 12 1HD2 LEU 12 14.041 -12.187 0.116
111 HD23 LEU 12 2HD2 LEU 12 12.296 -12.401 0.253
112 HA PRO 13 HA PRO 13 10.284 -6.919 -1.909
113 HB2 PRO 13 2HB PRO 13 7.913 -8.189 -1.540
114 HB3 PRO 13 3HB PRO 13 8.883 -8.371 -3.007
115 HG2 PRO 13 2HG PRO 13 8.683 -10.182 -0.631
116 HG3 PRO 13 3HG PRO 13 8.712 -10.597 -2.355
117 HD2 PRO 13 2HD PRO 13 10.897 -10.808 -0.769
118 HD3 PRO 13 3HD PRO 13 11.005 -10.399 -2.493
119 H PHE 14 H PHE 14 8.644 -5.674 -0.766
120 HA PHE 14 HA PHE 14 8.344 -6.276 2.079
121 HD1 PHE 14 HD1 PHE 14 11.762 -5.365 1.023
122 HD2 PHE 14 HD2 PHE 14 9.411 -4.594 4.487
123 HE1 PHE 14 HE1 PHE 14 13.586 -6.206 2.444
124 HE2 PHE 14 HE2 PHE 14 11.232 -5.433 5.913
125 HZ PHE 14 HZ PHE 14 13.323 -6.240 4.893
126 HB2 PHE 14 2HB PHE 14 9.796 -3.943 0.924
127 HB3 PHE 14 3HB PHE 14 8.804 -3.668 2.352
128 H GLU 15 H GLU 15 6.246 -6.199 2.494
129 HA GLU 15 HA GLU 15 4.402 -4.854 0.765
130 HB2 GLU 15 2HB GLU 15 3.712 -6.922 1.775
131 HB3 GLU 15 3HB GLU 15 4.042 -6.305 3.388
132 HG2 GLU 15 2HG GLU 15 2.175 -4.906 3.364
133 HG3 GLU 15 3HG GLU 15 2.002 -5.018 1.614
134 H LEU 16 H LEU 16 4.021 -2.749 0.823
135 HA LEU 16 HA LEU 16 4.157 -1.364 3.421
136 HG LEU 16 HG LEU 16 7.040 0.010 1.582
137 HB2 LEU 16 2HB LEU 16 5.040 -0.568 0.689
138 HB3 LEU 16 3HB LEU 16 4.483 0.682 1.800
139 HD11 LEU 16 1HD1 LEU 16 7.389 0.933 3.788
140 HD12 LEU 16 2HD1 LEU 16 5.713 0.599 4.225
141 HD13 LEU 16 3HD1 LEU 16 6.078 1.794 2.980
142 HD21 LEU 16 3HD2 LEU 16 6.077 -1.794 3.797
143 HD22 LEU 16 1HD2 LEU 16 7.739 -1.558 3.254
144 HD23 LEU 16 2HD2 LEU 16 6.571 -2.355 2.199
145 HA PRO 17 HA PRO 17 0.008 -0.008 2.984
146 HB2 PRO 17 2HB PRO 17 0.119 2.556 3.871
147 HB3 PRO 17 3HB PRO 17 0.275 1.160 4.945
148 HG2 PRO 17 2HG PRO 17 2.414 2.896 3.772
149 HG3 PRO 17 3HG PRO 17 2.266 2.263 5.422
150 HD2 PRO 17 2HD PRO 17 3.897 1.144 3.572
151 HD3 PRO 17 3HD PRO 17 3.091 0.192 4.835
152 H ALA 18 H ALA 18 -1.390 1.802 2.074
153 HA ALA 18 HA ALA 18 -0.689 2.226 -0.645
154 HB1 ALA 18 1HB ALA 18 -2.817 3.919 -0.115
155 HB2 ALA 18 2HB ALA 18 -2.914 2.257 -0.696
156 HB3 ALA 18 3HB ALA 18 -3.020 2.594 1.032
157 H GLY 19 H GLY 19 0.270 3.905 -1.622
158 HA2 GLY 19 2HA GLY 19 1.151 6.007 -1.963
159 HA3 GLY 19 3HA GLY 19 0.210 6.567 -0.589
160 H ALA 20 H ALA 20 2.118 3.890 0.180
161 HA ALA 20 HA ALA 20 3.583 5.077 2.168
162 HB1 ALA 20 1HB ALA 20 4.159 2.660 0.485
163 HB2 ALA 20 2HB ALA 20 5.225 3.154 1.801
164 HB3 ALA 20 3HB ALA 20 3.544 2.736 2.136
165 H ARG 21 H ARG 21 5.959 5.420 2.298
166 HA ARG 21 HA ARG 21 7.224 6.278 -0.184
167 HE ARG 21 HE ARG 21 6.848 9.792 4.577
168 HB2 ARG 21 2HB ARG 21 7.868 8.466 0.892
169 HB3 ARG 21 3HB ARG 21 6.172 8.316 0.451
170 HG2 ARG 21 2HG ARG 21 5.764 7.620 2.859
171 HG3 ARG 21 3HG ARG 21 7.403 8.190 3.183
172 HD2 ARG 21 2HD ARG 21 6.438 10.305 1.835
173 HD3 ARG 21 3HD ARG 21 4.946 9.708 2.561
174 HH11 ARG 21 1HH1 ARG 21 5.243 12.025 2.442
175 HH12 ARG 21 2HH1 ARG 21 5.330 13.352 3.552
176 HH21 ARG 21 1HH2 ARG 21 6.970 11.532 6.047
177 HH22 ARG 21 2HH2 ARG 21 6.314 13.071 5.602
178 H ALA 22 H ALA 22 9.495 7.314 0.534
179 HA ALA 22 HA ALA 22 11.063 5.236 1.473
180 HB1 ALA 22 1HB ALA 22 11.980 8.038 1.907
181 HB2 ALA 22 2HB ALA 22 12.858 6.649 1.265
182 HB3 ALA 22 3HB ALA 22 11.671 7.482 0.262
183 H SER 23 H SER 23 9.246 7.579 3.248
184 HA SER 23 HA SER 23 10.653 7.459 5.699
185 HG SER 23 HG SER 23 9.349 8.430 7.458
186 HB2 SER 23 2HB SER 23 9.086 9.267 5.241
187 HB3 SER 23 3HB SER 23 7.751 8.119 5.140
188 H GLN 24 H GLN 24 7.508 5.992 4.864
189 HA GLN 24 HA GLN 24 7.274 4.359 7.089
190 HB2 GLN 24 2HB GLN 24 5.939 4.676 4.584
191 HB3 GLN 24 3HB GLN 24 6.173 2.958 4.877
192 HG2 GLN 24 2HG GLN 24 4.354 3.027 6.135
193 HG3 GLN 24 3HG GLN 24 5.293 3.947 7.309
194 HE21 GLN 24 1HE2 GLN 24 3.641 4.544 4.221
195 HE22 GLN 24 2HE2 GLN 24 2.848 5.992 4.731
196 H LEU 25 H LEU 25 8.816 3.674 3.974
197 HA LEU 25 HA LEU 25 9.468 0.982 4.546
198 HG LEU 25 HG LEU 25 11.972 0.604 2.788
199 HB2 LEU 25 2HB LEU 25 9.413 2.119 2.286
200 HB3 LEU 25 3HB LEU 25 10.980 2.813 2.699
201 HD11 LEU 25 1HD1 LEU 25 9.204 -0.395 2.134
202 HD12 LEU 25 2HD1 LEU 25 10.097 -0.666 3.630
203 HD13 LEU 25 3HD1 LEU 25 10.669 -1.377 2.121
204 HD21 LEU 25 3HD2 LEU 25 10.341 1.039 0.288
205 HD22 LEU 25 1HD2 LEU 25 11.751 -0.011 0.424
206 HD23 LEU 25 2HD2 LEU 25 11.926 1.731 0.636
207 H SER 26 H SER 26 11.219 4.022 4.964
208 HA SER 26 HA SER 26 13.714 3.030 5.670
209 HG SER 26 HG SER 26 13.700 4.936 4.391
210 HB2 SER 26 2HB SER 26 12.218 5.541 6.297
211 HB3 SER 26 3HB SER 26 13.709 5.209 7.177
212 H ASN 27 H ASN 27 10.965 3.802 7.796
213 HA ASN 27 HA ASN 27 12.235 2.920 10.172
214 HB2 ASN 27 2HB ASN 27 10.396 4.459 10.338
215 HB3 ASN 27 3HB ASN 27 9.323 3.350 9.488
216 HD21 ASN 27 1HD2 ASN 27 11.467 3.342 12.318
217 HD22 ASN 27 2HD2 ASN 27 10.367 2.512 13.360
218 H LEU 28 H LEU 28 10.172 1.349 7.796
219 HA LEU 28 HA LEU 28 9.541 -0.985 9.166
220 HG LEU 28 HG LEU 28 7.593 -1.039 8.073
221 HB2 LEU 28 2HB LEU 28 9.488 -0.046 6.448
222 HB3 LEU 28 3HB LEU 28 10.002 -1.731 6.503
223 HD11 LEU 28 1HD1 LEU 28 7.791 -0.700 5.127
224 HD12 LEU 28 2HD1 LEU 28 6.811 0.173 6.304
225 HD13 LEU 28 3HD1 LEU 28 6.338 -1.447 5.793
226 HD21 LEU 28 3HD2 LEU 28 8.310 -3.298 6.206
227 HD22 LEU 28 1HD2 LEU 28 6.863 -3.207 7.210
228 HD23 LEU 28 2HD2 LEU 28 8.453 -3.318 7.965
229 H LEU 29 H LEU 29 12.303 -0.383 6.997
230 HA LEU 29 HA LEU 29 13.515 -2.911 7.583
231 HG LEU 29 HG LEU 29 13.095 -2.801 5.239
232 HB2 LEU 29 2HB LEU 29 14.381 -0.459 6.094
233 HB3 LEU 29 3HB LEU 29 15.512 -1.772 6.417
234 HD11 LEU 29 1HD1 LEU 29 14.088 -0.284 4.154
235 HD12 LEU 29 2HD1 LEU 29 12.576 -1.137 3.846
236 HD13 LEU 29 3HD1 LEU 29 14.039 -1.590 2.970
237 HD21 LEU 29 3HD2 LEU 29 15.361 -3.852 5.340
238 HD22 LEU 29 1HD2 LEU 29 15.897 -2.678 4.138
239 HD23 LEU 29 2HD2 LEU 29 14.632 -3.839 3.734
240 H SER 30 H SER 30 13.889 0.390 8.723
241 HA SER 30 HA SER 30 16.293 0.015 10.157
242 HG SER 30 HG SER 30 16.466 2.558 11.638
243 HB2 SER 30 2HB SER 30 15.653 2.256 9.707
244 HB3 SER 30 3HB SER 30 14.052 2.021 10.407
245 H SER 31 H SER 31 13.017 -0.839 10.818
246 HA SER 31 HA SER 31 12.911 -0.905 13.573
247 HG SER 31 HG SER 31 9.852 -2.038 13.194
248 HB2 SER 31 2HB SER 31 11.252 -1.731 11.579
249 HB3 SER 31 3HB SER 31 11.762 -3.281 12.247
250 H SER 32 H SER 32 14.619 -3.018 11.388
251 HA SER 32 HA SER 32 15.123 -5.117 13.233
252 HG SER 32 HG SER 32 16.509 -6.864 12.002
253 HB2 SER 32 2HB SER 32 15.311 -5.421 10.792
254 HB3 SER 32 3HB SER 32 16.689 -4.322 10.765
255 H GLY 33 H GLY 33 16.935 -2.231 12.270
256 HA2 GLY 33 2HA GLY 33 18.096 -1.243 14.317
257 HA3 GLY 33 3HA GLY 33 18.877 -2.814 14.412
258 H MET 34 H MET 34 20.859 -2.858 13.611
259 HA MET 34 HA MET 34 21.992 -0.729 12.161
260 HB2 MET 34 2HB MET 34 22.888 -3.536 12.751
261 HB3 MET 34 3HB MET 34 23.846 -2.478 11.724
262 HG2 MET 34 2HG MET 34 24.812 -1.734 13.570
263 HG3 MET 34 3HG MET 34 23.290 -0.932 13.948
264 HE1 MET 34 3HE MET 34 25.072 -1.955 16.815
265 HE2 MET 34 1HE MET 34 23.974 -0.753 16.137
266 HE3 MET 34 2HE MET 34 23.396 -1.881 17.362
267 H ALA 35 H ALA 35 20.875 -0.282 10.289
268 HA ALA 35 HA ALA 35 20.671 -2.409 8.278
269 HB1 ALA 35 1HB ALA 35 18.790 -1.441 7.553
270 HB2 ALA 35 2HB ALA 35 18.835 -0.538 9.067
271 HB3 ALA 35 3HB ALA 35 19.496 0.175 7.596
272 H PHE 36 H PHE 36 20.643 -1.002 5.958
273 HA PHE 36 HA PHE 36 23.315 0.238 5.859
274 HD1 PHE 36 HD2 PHE 36 20.610 -1.497 2.898
275 HD2 PHE 36 HD1 PHE 36 23.150 -3.520 5.650
276 HE1 PHE 36 HE2 PHE 36 19.116 -3.450 2.836
277 HE2 PHE 36 HE1 PHE 36 21.660 -5.477 5.591
278 HZ PHE 36 HZ PHE 36 19.639 -5.444 4.184
279 HB2 PHE 36 2HB PHE 36 22.917 -0.755 3.324
280 HB3 PHE 36 3HB PHE 36 23.880 -1.526 4.581
281 H SER 37 H SER 37 23.546 1.386 3.587
282 HA SER 37 HA SER 37 21.621 3.499 3.602
283 HG SER 37 HG SER 37 23.693 5.516 2.567
284 HB2 SER 37 2HB SER 37 24.201 2.948 2.292
285 HB3 SER 37 3HB SER 37 23.092 3.933 1.339
286 H LEU 38 H LEU 38 19.682 3.327 2.708
287 HA LEU 38 HA LEU 38 19.272 1.526 0.447
288 HG LEU 38 HG LEU 38 17.956 1.886 3.709
289 HB2 LEU 38 2HB LEU 38 17.175 3.121 1.895
290 HB3 LEU 38 3HB LEU 38 16.952 1.688 0.893
291 HD11 LEU 38 1HD1 LEU 38 15.697 0.616 2.262
292 HD12 LEU 38 2HD1 LEU 38 15.725 1.443 3.819
293 HD13 LEU 38 3HD1 LEU 38 16.339 -0.205 3.684
294 HD21 LEU 38 3HD2 LEU 38 19.620 0.496 2.934
295 HD22 LEU 38 1HD2 LEU 38 18.606 -0.189 1.664
296 HD23 LEU 38 2HD2 LEU 38 18.358 -0.668 3.344
297 H HIS 39 H HIS 39 19.330 2.268 -1.558
298 HA HIS 39 HA HIS 39 18.235 4.903 -2.164
299 HD1 HIS 39 HD1 HIS 39 20.682 3.592 -5.207
300 HD2 HIS 39 HD2 HIS 39 22.744 3.501 -1.601
301 HE1 HIS 39 HE1 HIS 39 22.636 2.056 -5.589
302 HB2 HIS 39 2HB HIS 39 20.175 5.603 -3.438
303 HB3 HIS 39 3HB HIS 39 20.666 5.241 -1.786
304 H THR 40 H THR 40 17.772 5.212 -4.428
305 HA THR 40 HA THR 40 17.488 2.659 -5.875
306 HB THR 40 HB THR 40 15.383 3.195 -6.562
307 HG1 THR 40 HG1 THR 40 15.585 5.017 -7.708
308 HG21 THR 40 3HG2 THR 40 15.260 5.157 -4.314
309 HG22 THR 40 1HG2 THR 40 15.657 3.475 -3.966
310 HG23 THR 40 2HG2 THR 40 14.129 3.876 -4.750
311 H GLN 41 H GLN 41 18.269 2.515 -7.899
312 HA GLN 41 HA GLN 41 19.522 3.032 -9.730
313 HB2 GLN 41 2HB GLN 41 17.255 4.663 -9.717
314 HB3 GLN 41 3HB GLN 41 18.582 5.749 -10.108
315 HG2 GLN 41 2HG GLN 41 19.250 4.009 -11.854
316 HG3 GLN 41 3HG GLN 41 17.646 3.325 -11.596
317 HE21 GLN 41 1HE2 GLN 41 19.079 4.860 -13.831
318 HE22 GLN 41 2HE2 GLN 41 17.924 6.056 -14.298
319 H GLY 42 H GLY 42 20.596 3.753 -7.095
320 HA2 GLY 42 2HA GLY 42 22.593 4.663 -6.381
321 HA3 GLY 42 3HA GLY 42 22.841 5.279 -8.008
322 H ARG 43 H ARG 43 19.960 5.998 -6.170
323 HA ARG 43 HA ARG 43 20.977 8.697 -5.613
324 HE ARG 43 HE ARG 43 18.226 10.931 -7.759
325 HB2 ARG 43 2HB ARG 43 18.297 8.057 -6.859
326 HB3 ARG 43 3HB ARG 43 18.825 9.653 -6.345
327 HG2 ARG 43 2HG ARG 43 20.544 9.690 -8.013
328 HG3 ARG 43 3HG ARG 43 20.213 8.013 -8.451
329 HD2 ARG 43 2HD ARG 43 19.251 9.728 -10.007
330 HD3 ARG 43 3HD ARG 43 18.086 8.581 -9.346
331 HH11 ARG 43 1HH1 ARG 43 16.951 9.675 -10.745
332 HH12 ARG 43 2HH1 ARG 43 15.627 10.791 -10.800
333 HH21 ARG 43 1HH2 ARG 43 16.487 12.406 -7.821
334 HH22 ARG 43 2HH2 ARG 43 15.365 12.345 -9.137
335 H VAL 44 H VAL 44 20.491 9.444 -3.638
336 HA VAL 44 HA VAL 44 19.412 7.775 -1.667
337 HB VAL 44 HB VAL 44 19.609 10.787 -1.560
338 HG11 VAL 44 1HG1 VAL 44 19.140 8.655 0.469
339 HG12 VAL 44 2HG1 VAL 44 20.044 10.097 0.933
340 HG13 VAL 44 3HG1 VAL 44 18.399 10.247 0.315
341 HG21 VAL 44 3HG2 VAL 44 21.651 8.678 -1.507
342 HG22 VAL 44 1HG2 VAL 44 21.800 10.396 -1.877
343 HG23 VAL 44 2HG2 VAL 44 21.767 9.856 -0.199
344 H LEU 45 H LEU 45 17.444 7.758 -0.587
345 HA LEU 45 HA LEU 45 15.194 8.753 -2.157
346 HG LEU 45 HG LEU 45 15.015 5.914 -2.517
347 HB2 LEU 45 2HB LEU 45 15.668 6.530 -0.333
348 HB3 LEU 45 3HB LEU 45 14.143 7.359 -0.029
349 HD11 LEU 45 1HD1 LEU 45 13.339 4.421 -2.054
350 HD12 LEU 45 2HD1 LEU 45 12.405 5.588 -1.118
351 HD13 LEU 45 3HD1 LEU 45 13.851 4.856 -0.423
352 HD21 LEU 45 3HD2 LEU 45 13.862 7.363 -3.745
353 HD22 LEU 45 1HD2 LEU 45 13.323 8.239 -2.312
354 HD23 LEU 45 2HD2 LEU 45 12.410 6.843 -2.887
355 H SER 46 H SER 46 13.864 10.343 -1.516
356 HA SER 46 HA SER 46 14.609 11.920 0.774
357 HG SER 46 HG SER 46 11.382 12.930 -1.401
358 HB2 SER 46 2HB SER 46 12.894 13.478 0.010
359 HB3 SER 46 3HB SER 46 13.884 12.963 -1.355
360 H GLU 47 H GLU 47 13.255 12.459 2.536
361 HA GLU 47 HA GLU 47 11.968 10.330 3.773
362 HB2 GLU 47 2HB GLU 47 11.678 13.300 4.247
363 HB3 GLU 47 3HB GLU 47 11.019 12.068 5.314
364 HG2 GLU 47 2HG GLU 47 13.245 11.232 5.773
365 HG3 GLU 47 3HG GLU 47 13.935 12.400 4.648
366 H ALA 48 H ALA 48 10.760 12.657 1.503
367 HA ALA 48 HA ALA 48 8.020 11.657 1.898
368 HB1 ALA 48 1HB ALA 48 7.450 13.802 1.840
369 HB2 ALA 48 2HB ALA 48 9.088 14.280 1.390
370 HB3 ALA 48 3HB ALA 48 7.927 13.827 0.142
371 H ALA 49 H ALA 49 10.542 10.792 0.182
372 HA ALA 49 HA ALA 49 9.848 10.906 -2.516
373 HB1 ALA 49 1HB ALA 49 11.193 8.466 -1.475
374 HB2 ALA 49 2HB ALA 49 11.573 9.453 -2.887
375 HB3 ALA 49 3HB ALA 49 11.997 10.023 -1.273
376 H GLU 50 H GLU 50 8.045 10.213 -3.447
377 HA GLU 50 HA GLU 50 6.871 7.676 -2.513
378 HB2 GLU 50 2HB GLU 50 5.128 9.010 -1.956
379 HB3 GLU 50 3HB GLU 50 5.645 10.305 -3.026
380 HG2 GLU 50 2HG GLU 50 4.617 9.309 -4.896
381 HG3 GLU 50 3HG GLU 50 4.381 7.783 -4.047
382 H LEU 51 H LEU 51 7.144 6.132 -3.970
383 HA LEU 51 HA LEU 51 7.427 6.837 -6.793
384 HG LEU 51 HG LEU 51 9.796 6.276 -6.623
385 HB2 LEU 51 2HB LEU 51 7.984 4.314 -5.252
386 HB3 LEU 51 3HB LEU 51 8.083 4.411 -7.009
387 HD11 LEU 51 1HD1 LEU 51 10.862 5.344 -4.222
388 HD12 LEU 51 2HD1 LEU 51 9.144 5.582 -3.906
389 HD13 LEU 51 3HD1 LEU 51 10.119 6.915 -4.523
390 HD21 LEU 51 3HD2 LEU 51 10.224 3.364 -6.071
391 HD22 LEU 51 1HD2 LEU 51 11.574 4.499 -6.037
392 HD23 LEU 51 2HD2 LEU 51 10.628 4.299 -7.512
393 H ASN 52 H ASN 52 6.174 3.793 -5.553
394 HA ASN 52 HA ASN 52 3.451 4.206 -6.001
395 HB2 ASN 52 2HB ASN 52 4.692 4.298 -8.405
396 HB3 ASN 52 3HB ASN 52 4.378 2.569 -8.286
397 HD21 ASN 52 1HD2 ASN 52 3.240 4.936 -9.863
398 HD22 ASN 52 2HD2 ASN 52 1.531 4.727 -9.717
399 H ASP 53 H ASP 53 2.942 1.620 -7.263
400 HA ASP 53 HA ASP 53 3.447 -0.043 -4.925
401 HB2 ASP 53 2HB ASP 53 1.179 -0.074 -5.636
402 HB3 ASP 53 3HB ASP 53 1.634 -0.336 -7.318
403 H LYS 54 H LYS 54 4.580 -1.943 -4.934
404 HA LYS 54 HA LYS 54 6.129 -3.482 -5.569
405 HB2 LYS 54 2HB LYS 54 4.270 -3.789 -7.378
406 HB3 LYS 54 3HB LYS 54 5.433 -3.020 -8.450
407 HG2 LYS 54 2HG LYS 54 6.903 -4.786 -8.348
408 HG3 LYS 54 3HG LYS 54 6.286 -5.347 -6.793
409 HD2 LYS 54 2HD LYS 54 4.151 -5.952 -7.979
410 HD3 LYS 54 3HD LYS 54 4.982 -5.610 -9.498
411 HE2 LYS 54 2HE LYS 54 6.428 -7.407 -9.257
412 HE3 LYS 54 3HE LYS 54 6.188 -7.495 -7.512
413 HZ1 LYS 54 3HZ LYS 54 5.074 -9.322 -8.555
414 HZ2 LYS 54 1HZ LYS 54 4.244 -8.292 -9.610
415 HZ3 LYS 54 2HZ LYS 54 3.901 -8.261 -7.954
416 H MET 55 H MET 55 7.066 -0.925 -5.150
417 HA MET 55 HA MET 55 8.639 0.111 -7.248
418 HB2 MET 55 2HB MET 55 9.194 0.372 -4.292
419 HB3 MET 55 3HB MET 55 9.712 1.462 -5.571
420 HG2 MET 55 2HG MET 55 7.665 2.442 -5.761
421 HG3 MET 55 3HG MET 55 6.803 1.003 -5.223
422 HE1 MET 55 3HE MET 55 9.093 3.977 -2.658
423 HE2 MET 55 1HE MET 55 9.804 2.363 -2.655
424 HE3 MET 55 2HE MET 55 9.595 3.231 -4.176
425 H VAL 56 H VAL 56 11.163 0.372 -6.670
426 HA VAL 56 HA VAL 56 12.291 -2.233 -5.963
427 HB VAL 56 HB VAL 56 12.890 -0.811 -8.561
428 HG11 VAL 56 1HG1 VAL 56 14.915 -1.748 -7.598
429 HG12 VAL 56 2HG1 VAL 56 14.112 -3.305 -7.381
430 HG13 VAL 56 3HG1 VAL 56 14.413 -2.685 -9.005
431 HG21 VAL 56 3HG2 VAL 56 12.083 -2.963 -9.553
432 HG22 VAL 56 1HG2 VAL 56 11.531 -3.428 -7.944
433 HG23 VAL 56 2HG2 VAL 56 10.835 -2.017 -8.742
434 H ILE 57 H ILE 57 13.288 -1.419 -4.161
435 HA ILE 57 HA ILE 57 15.063 0.890 -4.470
436 HB ILE 57 HB ILE 57 14.500 -0.558 -1.894
437 HG12 ILE 57 2HG1 ILE 57 12.337 0.054 -2.809
438 HG13 ILE 57 3HG1 ILE 57 12.733 1.138 -1.481
439 HG21 ILE 57 1HG2 ILE 57 16.001 1.780 -2.694
440 HG22 ILE 57 2HG2 ILE 57 14.801 2.168 -1.461
441 HG23 ILE 57 3HG2 ILE 57 16.001 0.912 -1.159
442 HD11 ILE 57 3HD1 ILE 57 12.844 1.721 -4.425
443 HD12 ILE 57 1HD1 ILE 57 11.785 2.443 -3.214
444 HD13 ILE 57 2HD1 ILE 57 13.515 2.789 -3.191
445 H ASP 58 H ASP 58 17.252 0.799 -4.119
446 HA ASP 58 HA ASP 58 18.410 -1.902 -4.070
447 HB2 ASP 58 2HB ASP 58 18.890 0.308 -5.741
448 HB3 ASP 58 3HB ASP 58 20.310 0.178 -4.707
449 H ALA 59 H ALA 59 19.013 -2.502 -2.097
450 HA ALA 59 HA ALA 59 19.816 -0.552 -0.112
451 HB1 ALA 59 1HB ALA 59 19.171 -2.083 1.370
452 HB2 ALA 59 2HB ALA 59 18.586 -3.029 0.001
453 HB3 ALA 59 3HB ALA 59 20.200 -3.321 0.650
454 H PHE 60 H PHE 60 21.824 0.204 -0.102
455 HA PHE 60 HA PHE 60 24.015 -1.586 -0.912
456 HD1 PHE 60 HD2 PHE 60 26.831 -0.213 -1.059
457 HD2 PHE 60 HD1 PHE 60 24.128 2.934 -0.106
458 HE1 PHE 60 HE2 PHE 60 28.668 1.042 -0.008
459 HE2 PHE 60 HE1 PHE 60 25.961 4.195 0.945
460 HZ PHE 60 HZ PHE 60 28.235 3.249 0.996
461 HB2 PHE 60 2HB PHE 60 24.594 0.125 -2.238
462 HB3 PHE 60 3HB PHE 60 23.422 1.194 -1.475
463 H VAL 61 H VAL 61 25.375 -2.276 0.596
464 HA VAL 61 HA VAL 61 25.264 -1.069 3.258
465 HB VAL 61 HB VAL 61 26.218 -3.054 4.115
466 HG11 VAL 61 1HG1 VAL 61 24.395 -4.309 3.834
467 HG12 VAL 61 2HG1 VAL 61 23.865 -3.090 2.674
468 HG13 VAL 61 3HG1 VAL 61 24.715 -4.531 2.114
469 HG21 VAL 61 3HG2 VAL 61 26.921 -3.738 1.265
470 HG22 VAL 61 1HG2 VAL 61 28.031 -3.390 2.590
471 HG23 VAL 61 2HG2 VAL 61 27.063 -4.864 2.614
472 HA PRO 62 HA PRO 62 29.183 0.894 2.968
473 HB2 PRO 62 2HB PRO 62 30.031 0.710 5.541
474 HB3 PRO 62 3HB PRO 62 28.737 1.802 5.031
475 HG2 PRO 62 2HG PRO 62 28.543 -0.893 6.321
476 HG3 PRO 62 3HG PRO 62 27.618 0.580 6.663
477 HD2 PRO 62 2HD PRO 62 26.630 -1.445 5.161
478 HD3 PRO 62 3HD PRO 62 26.197 0.253 4.877
479 H ALA 63 H ALA 63 31.248 0.369 2.484
480 HA ALA 63 HA ALA 63 32.044 -2.294 2.215
481 HB1 ALA 63 1HB ALA 63 34.313 -1.354 1.792
482 HB2 ALA 63 2HB ALA 63 33.032 -0.603 0.841
483 HB3 ALA 63 3HB ALA 63 33.688 0.230 2.250
484 H ASP 64 H ASP 64 33.625 -3.529 3.303
485 HA ASP 64 HA ASP 64 33.540 -3.269 6.151
486 HB2 ASP 64 2HB ASP 64 35.182 -5.162 4.455
487 HB3 ASP 64 3HB ASP 64 34.861 -5.323 6.180
488 H GLY 65 H GLY 65 34.803 -1.981 7.309
489 HA2 GLY 65 2HA GLY 65 37.394 -1.159 6.188
490 HA3 GLY 65 3HA GLY 65 36.507 -0.309 7.445
491 H ALA 66 H ALA 66 37.044 -3.776 7.430
492 HA ALA 66 HA ALA 66 39.166 -3.528 9.417
493 HB1 ALA 66 1HB ALA 66 38.081 -4.555 11.158
494 HB2 ALA 66 2HB ALA 66 36.758 -3.626 10.449
495 HB3 ALA 66 3HB ALA 66 36.910 -5.349 10.104
496 H GLY 67 H GLY 67 39.309 -6.143 10.247
497 HA2 GLY 67 2HA GLY 67 39.034 -8.304 8.758
498 HA3 GLY 67 3HA GLY 67 40.209 -7.433 7.783
499 H LEU 68 H LEU 68 39.850 -7.895 11.297
500 HA LEU 68 HA LEU 68 42.624 -8.129 11.745
501 HG LEU 68 HG LEU 68 42.410 -6.733 13.577
502 HB2 LEU 68 2HB LEU 68 40.225 -8.134 13.295
503 HB3 LEU 68 3HB LEU 68 41.244 -9.476 13.810
504 HD11 LEU 68 1HD1 LEU 68 41.834 -6.426 15.997
505 HD12 LEU 68 2HD1 LEU 68 40.700 -7.765 15.829
506 HD13 LEU 68 3HD1 LEU 68 40.473 -6.294 14.883
507 HD21 LEU 68 3HD2 LEU 68 43.334 -9.261 14.361
508 HD22 LEU 68 1HD2 LEU 68 43.186 -8.315 15.843
509 HD23 LEU 68 2HD2 LEU 68 44.170 -7.714 14.508
510 H GLU 69 H GLU 69 40.200 -10.684 12.301
511 HA GLU 69 HA GLU 69 42.069 -12.781 12.280
512 HB2 GLU 69 2HB GLU 69 39.101 -12.884 11.711
513 HB3 GLU 69 3HB GLU 69 40.114 -14.268 12.094
514 HG2 GLU 69 2HG GLU 69 39.637 -11.928 13.924
515 HG3 GLU 69 3HG GLU 69 38.789 -13.471 14.008
Start of MODEL 5
1 HA MET 1 HA MET 1 1.802 0.308 -2.483
2 H1 MET 1 H MET 1 1.530 0.187 0.449
3 HB2 MET 1 2HB MET 1 3.331 1.837 -0.373
4 HB3 MET 1 3HB MET 1 3.799 1.774 -2.067
5 HG2 MET 1 2HG MET 1 1.083 2.712 -1.220
6 HG3 MET 1 3HG MET 1 2.471 3.796 -1.261
7 HE1 MET 1 3HE MET 1 -0.274 2.252 -2.679
8 HE2 MET 1 1HE MET 1 -0.512 3.387 -4.008
9 HE3 MET 1 2HE MET 1 0.078 1.758 -4.336
10 H LEU 2 H LEU 2 3.221 -1.054 -3.400
11 HA LEU 2 HA LEU 2 4.631 -2.915 -1.658
12 HG LEU 2 HG LEU 2 5.708 -4.968 -3.335
13 HB2 LEU 2 2HB LEU 2 3.194 -3.383 -3.845
14 HB3 LEU 2 3HB LEU 2 4.758 -3.132 -4.616
15 HD11 LEU 2 1HD1 LEU 2 3.397 -6.210 -2.283
16 HD12 LEU 2 2HD1 LEU 2 3.426 -4.551 -1.687
17 HD13 LEU 2 3HD1 LEU 2 4.810 -5.608 -1.415
18 HD21 LEU 2 3HD2 LEU 2 3.195 -6.167 -4.353
19 HD22 LEU 2 1HD2 LEU 2 4.873 -6.606 -4.670
20 HD23 LEU 2 2HD2 LEU 2 4.158 -5.212 -5.481
21 H VAL 3 H VAL 3 6.848 -3.331 -1.784
22 HA VAL 3 HA VAL 3 8.479 -1.505 -3.390
23 HB VAL 3 HB VAL 3 9.032 -1.929 -0.455
24 HG11 VAL 3 1HG1 VAL 3 10.591 -0.954 -2.593
25 HG12 VAL 3 2HG1 VAL 3 10.171 0.434 -1.587
26 HG13 VAL 3 3HG1 VAL 3 10.984 -0.960 -0.874
27 HG21 VAL 3 3HG2 VAL 3 7.598 0.326 -1.842
28 HG22 VAL 3 1HG2 VAL 3 7.016 -0.682 -0.516
29 HG23 VAL 3 2HG2 VAL 3 8.314 0.480 -0.237
30 H ILE 4 H ILE 4 9.902 -2.674 -4.480
31 HA ILE 4 HA ILE 4 10.604 -5.344 -3.544
32 HB ILE 4 HB ILE 4 11.068 -3.924 -6.161
33 HG12 ILE 4 2HG1 ILE 4 8.801 -4.928 -5.550
34 HG13 ILE 4 3HG1 ILE 4 9.515 -5.464 -7.067
35 HG21 ILE 4 1HG2 ILE 4 11.855 -6.368 -6.777
36 HG22 ILE 4 2HG2 ILE 4 12.981 -5.169 -6.143
37 HG23 ILE 4 3HG2 ILE 4 12.305 -6.397 -5.072
38 HD11 ILE 4 3HD1 ILE 4 8.493 -7.093 -5.150
39 HD12 ILE 4 1HD1 ILE 4 9.658 -7.581 -6.381
40 HD13 ILE 4 2HD1 ILE 4 10.215 -7.125 -4.770
41 H VAL 5 H VAL 5 12.081 -5.054 -1.913
42 HA VAL 5 HA VAL 5 14.391 -3.344 -2.319
43 HB VAL 5 HB VAL 5 13.692 -5.155 -0.003
44 HG11 VAL 5 1HG1 VAL 5 16.139 -3.899 -0.683
45 HG12 VAL 5 2HG1 VAL 5 15.462 -3.045 0.705
46 HG13 VAL 5 3HG1 VAL 5 15.733 -4.787 0.785
47 HG21 VAL 5 3HG2 VAL 5 13.657 -2.257 0.391
48 HG22 VAL 5 1HG2 VAL 5 12.439 -2.840 -0.743
49 HG23 VAL 5 2HG2 VAL 5 12.497 -3.485 0.897
50 H ARG 6 H ARG 6 16.030 -4.069 -3.501
51 HA ARG 6 HA ARG 6 16.546 -6.919 -3.729
52 HE ARG 6 HE ARG 6 17.441 -4.994 -8.627
53 HB2 ARG 6 2HB ARG 6 16.780 -4.804 -5.486
54 HB3 ARG 6 3HB ARG 6 18.449 -5.117 -5.027
55 HG2 ARG 6 2HG ARG 6 18.533 -6.874 -6.368
56 HG3 ARG 6 3HG ARG 6 17.130 -7.595 -5.576
57 HD2 ARG 6 2HD ARG 6 16.181 -7.351 -7.604
58 HD3 ARG 6 3HD ARG 6 15.927 -5.692 -7.063
59 HH11 ARG 6 1HH1 ARG 6 17.809 -8.422 -8.146
60 HH12 ARG 6 2HH1 ARG 6 18.933 -8.616 -9.450
61 HH21 ARG 6 1HH2 ARG 6 18.919 -5.237 -10.348
62 HH22 ARG 6 2HH2 ARG 6 19.564 -6.804 -10.702
63 H LEU 7 H LEU 7 17.874 -7.934 -2.392
64 HA LEU 7 HA LEU 7 19.860 -6.382 -0.896
65 HG LEU 7 HG LEU 7 18.120 -8.229 1.805
66 HB2 LEU 7 2HB LEU 7 18.538 -9.034 -0.464
67 HB3 LEU 7 3HB LEU 7 20.035 -8.629 0.373
68 HD11 LEU 7 1HD1 LEU 7 20.073 -6.277 1.085
69 HD12 LEU 7 2HD1 LEU 7 19.339 -6.588 2.657
70 HD13 LEU 7 3HD1 LEU 7 18.576 -5.461 1.535
71 HD21 LEU 7 3HD2 LEU 7 16.554 -7.785 -0.138
72 HD22 LEU 7 1HD2 LEU 7 17.191 -6.140 -0.149
73 HD23 LEU 7 2HD2 LEU 7 16.357 -6.753 1.280
74 H GLN 8 H GLN 8 22.018 -6.752 -1.035
75 HA GLN 8 HA GLN 8 23.348 -7.460 -3.197
76 HB2 GLN 8 2HB GLN 8 24.181 -6.938 -0.735
77 HB3 GLN 8 3HB GLN 8 24.452 -8.675 -0.707
78 HG2 GLN 8 2HG GLN 8 26.491 -7.740 -1.365
79 HG3 GLN 8 3HG GLN 8 25.768 -8.364 -2.846
80 HE21 GLN 8 1HE2 GLN 8 27.680 -6.633 -3.245
81 HE22 GLN 8 2HE2 GLN 8 27.079 -5.075 -3.688
82 H ASP 9 H ASP 9 22.434 -9.889 -0.757
83 HA ASP 9 HA ASP 9 23.372 -12.126 -2.164
84 HB2 ASP 9 2HB ASP 9 21.523 -11.658 0.106
85 HB3 ASP 9 3HB ASP 9 21.361 -13.202 -0.726
86 H GLN 10 H GLN 10 19.983 -11.063 -1.797
87 HA GLN 10 HA GLN 10 19.445 -11.644 -4.574
88 HB2 GLN 10 2HB GLN 10 17.476 -13.036 -2.941
89 HB3 GLN 10 3HB GLN 10 18.334 -13.583 -4.375
90 HG2 GLN 10 2HG GLN 10 20.255 -14.190 -3.019
91 HG3 GLN 10 3HG GLN 10 19.437 -13.597 -1.574
92 HE21 GLN 10 1HE2 GLN 10 18.662 -15.729 -4.309
93 HE22 GLN 10 2HE2 GLN 10 18.006 -17.005 -3.347
94 H THR 11 H THR 11 16.966 -11.360 -4.963
95 HA THR 11 HA THR 11 16.272 -8.800 -3.790
96 HB THR 11 HB THR 11 14.541 -10.231 -5.777
97 HG1 THR 11 HG1 THR 11 15.889 -9.465 -7.432
98 HG21 THR 11 3HG2 THR 11 13.622 -8.185 -5.059
99 HG22 THR 11 1HG2 THR 11 14.371 -7.824 -6.614
100 HG23 THR 11 2HG2 THR 11 15.183 -7.367 -5.117
101 H LEU 12 H LEU 12 14.272 -8.338 -2.789
102 HA LEU 12 HA LEU 12 12.483 -10.492 -2.085
103 HG LEU 12 HG LEU 12 13.399 -11.256 1.368
104 HB2 LEU 12 2HB LEU 12 14.595 -10.193 -0.435
105 HB3 LEU 12 3HB LEU 12 13.469 -9.049 0.291
106 HD11 LEU 12 1HD1 LEU 12 10.771 -11.421 0.271
107 HD12 LEU 12 2HD1 LEU 12 11.226 -9.725 0.431
108 HD13 LEU 12 3HD1 LEU 12 11.285 -10.790 1.836
109 HD21 LEU 12 3HD2 LEU 12 11.985 -12.534 -0.861
110 HD22 LEU 12 1HD2 LEU 12 13.160 -13.200 0.274
111 HD23 LEU 12 2HD2 LEU 12 13.711 -12.283 -1.128
112 HA PRO 13 HA PRO 13 9.871 -6.904 -2.435
113 HB2 PRO 13 2HB PRO 13 7.531 -8.220 -2.027
114 HB3 PRO 13 3HB PRO 13 8.408 -8.273 -3.560
115 HG2 PRO 13 2HG PRO 13 8.363 -10.274 -1.334
116 HG3 PRO 13 3HG PRO 13 8.285 -10.546 -3.084
117 HD2 PRO 13 2HD PRO 13 10.565 -10.868 -1.659
118 HD3 PRO 13 3HD PRO 13 10.564 -10.319 -3.347
119 H PHE 14 H PHE 14 8.308 -5.766 -1.094
120 HA PHE 14 HA PHE 14 8.030 -6.622 1.665
121 HD1 PHE 14 HD2 PHE 14 9.476 -6.049 4.037
122 HD2 PHE 14 HD1 PHE 14 11.646 -5.435 0.427
123 HE1 PHE 14 HE2 PHE 14 11.370 -7.316 4.964
124 HE2 PHE 14 HE1 PHE 14 13.543 -6.703 1.348
125 HZ PHE 14 HZ PHE 14 13.407 -7.644 3.619
126 HB2 PHE 14 2HB PHE 14 9.657 -4.235 0.830
127 HB3 PHE 14 3HB PHE 14 8.858 -4.281 2.399
128 H GLU 15 H GLU 15 6.201 -5.863 2.602
129 HA GLU 15 HA GLU 15 4.424 -4.292 0.913
130 HB2 GLU 15 2HB GLU 15 3.479 -6.296 1.857
131 HB3 GLU 15 3HB GLU 15 3.964 -5.818 3.478
132 HG2 GLU 15 2HG GLU 15 2.338 -4.141 3.595
133 HG3 GLU 15 3HG GLU 15 2.066 -4.165 1.853
134 H LEU 16 H LEU 16 4.216 -2.175 1.152
135 HA LEU 16 HA LEU 16 4.861 -0.983 3.768
136 HG LEU 16 HG LEU 16 7.590 0.180 1.586
137 HB2 LEU 16 2HB LEU 16 5.430 -0.107 0.978
138 HB3 LEU 16 3HB LEU 16 5.184 1.118 2.221
139 HD11 LEU 16 1HD1 LEU 16 8.358 0.936 3.753
140 HD12 LEU 16 2HD1 LEU 16 6.730 0.783 4.411
141 HD13 LEU 16 3HD1 LEU 16 7.068 1.987 3.168
142 HD21 LEU 16 3HD2 LEU 16 6.950 -2.145 2.178
143 HD22 LEU 16 1HD2 LEU 16 6.740 -1.620 3.849
144 HD23 LEU 16 2HD2 LEU 16 8.331 -1.537 3.092
145 HA PRO 17 HA PRO 17 0.868 0.816 4.013
146 HB2 PRO 17 2HB PRO 17 1.388 3.287 5.010
147 HB3 PRO 17 3HB PRO 17 1.534 1.813 5.973
148 HG2 PRO 17 2HG PRO 17 3.670 3.395 4.596
149 HG3 PRO 17 3HG PRO 17 3.683 2.669 6.213
150 HD2 PRO 17 2HD PRO 17 4.905 1.517 4.089
151 HD3 PRO 17 3HD PRO 17 4.181 0.569 5.404
152 H ALA 18 H ALA 18 -0.428 2.826 3.419
153 HA ALA 18 HA ALA 18 -0.085 3.353 0.653
154 HB1 ALA 18 1HB ALA 18 -1.856 5.137 2.196
155 HB2 ALA 18 2HB ALA 18 -2.171 4.213 0.726
156 HB3 ALA 18 3HB ALA 18 -2.208 3.411 2.297
157 H GLY 19 H GLY 19 1.168 4.816 -0.297
158 HA2 GLY 19 2HA GLY 19 2.306 6.780 -0.686
159 HA3 GLY 19 3HA GLY 19 1.447 7.482 0.677
160 H ALA 20 H ALA 20 3.140 4.580 1.324
161 HA ALA 20 HA ALA 20 4.658 5.486 3.394
162 HB1 ALA 20 1HB ALA 20 4.337 3.089 2.381
163 HB2 ALA 20 2HB ALA 20 5.882 3.441 1.606
164 HB3 ALA 20 3HB ALA 20 5.751 3.470 3.364
165 H ARG 21 H ARG 21 6.820 6.142 3.679
166 HA ARG 21 HA ARG 21 8.058 7.322 1.278
167 HE ARG 21 HE ARG 21 5.319 10.243 1.475
168 HB2 ARG 21 2HB ARG 21 7.373 8.489 3.857
169 HB3 ARG 21 3HB ARG 21 9.068 8.721 3.452
170 HG2 ARG 21 2HG ARG 21 8.612 10.166 1.793
171 HG3 ARG 21 3HG ARG 21 7.167 9.290 1.284
172 HD2 ARG 21 2HD ARG 21 6.721 10.390 3.878
173 HD3 ARG 21 3HD ARG 21 7.335 11.658 2.819
174 HH11 ARG 21 1HH1 ARG 21 5.726 12.438 4.146
175 HH12 ARG 21 2HH1 ARG 21 4.140 13.120 3.997
176 HH21 ARG 21 1HH2 ARG 21 3.229 11.132 1.268
177 HH22 ARG 21 2HH2 ARG 21 2.720 12.376 2.360
178 H ALA 22 H ALA 22 10.473 7.817 1.723
179 HA ALA 22 HA ALA 22 11.875 5.452 1.927
180 HB1 ALA 22 1HB ALA 22 12.708 7.616 0.981
181 HB2 ALA 22 2HB ALA 22 13.013 8.149 2.635
182 HB3 ALA 22 3HB ALA 22 13.871 6.751 1.986
183 H SER 23 H SER 23 11.090 7.776 4.462
184 HA SER 23 HA SER 23 12.702 6.774 6.503
185 HG SER 23 HG SER 23 10.393 8.284 8.824
186 HB2 SER 23 2HB SER 23 11.763 8.716 7.225
187 HB3 SER 23 3HB SER 23 10.259 8.435 6.348
188 H GLN 24 H GLN 24 9.265 6.046 5.883
189 HA GLN 24 HA GLN 24 8.903 4.117 7.828
190 HB2 GLN 24 2HB GLN 24 7.447 5.103 5.626
191 HB3 GLN 24 3HB GLN 24 7.491 3.355 5.438
192 HG2 GLN 24 2HG GLN 24 5.856 3.181 6.909
193 HG3 GLN 24 3HG GLN 24 6.917 3.857 8.144
194 HE21 GLN 24 1HE2 GLN 24 7.067 6.287 8.106
195 HE22 GLN 24 2HE2 GLN 24 5.593 7.153 7.858
196 H LEU 25 H LEU 25 9.906 3.628 4.447
197 HA LEU 25 HA LEU 25 10.208 0.843 4.598
198 HG LEU 25 HG LEU 25 12.484 0.385 2.551
199 HB2 LEU 25 2HB LEU 25 10.132 2.271 2.525
200 HB3 LEU 25 3HB LEU 25 11.810 2.698 2.851
201 HD11 LEU 25 1HD1 LEU 25 10.486 -0.708 3.406
202 HD12 LEU 25 2HD1 LEU 25 10.884 -1.303 1.794
203 HD13 LEU 25 3HD1 LEU 25 9.567 -0.150 2.007
204 HD21 LEU 25 3HD2 LEU 25 12.194 1.984 0.601
205 HD22 LEU 25 1HD2 LEU 25 10.702 1.114 0.243
206 HD23 LEU 25 2HD2 LEU 25 12.248 0.264 0.212
207 H SER 26 H SER 26 12.492 3.477 5.192
208 HA SER 26 HA SER 26 14.836 2.032 5.467
209 HG SER 26 HG SER 26 16.390 4.168 5.518
210 HB2 SER 26 2HB SER 26 13.828 4.615 6.541
211 HB3 SER 26 3HB SER 26 15.250 3.926 7.324
212 H ASN 27 H ASN 27 12.558 2.931 8.061
213 HA ASN 27 HA ASN 27 13.850 1.480 10.093
214 HB2 ASN 27 2HB ASN 27 12.280 3.204 10.681
215 HB3 ASN 27 3HB ASN 27 10.981 2.389 9.815
216 HD21 ASN 27 1HD2 ASN 27 13.413 1.376 12.195
217 HD22 ASN 27 2HD2 ASN 27 12.286 0.659 13.292
218 H LEU 28 H LEU 28 11.358 0.586 7.776
219 HA LEU 28 HA LEU 28 10.516 -1.826 8.860
220 HG LEU 28 HG LEU 28 8.492 -1.446 7.981
221 HB2 LEU 28 2HB LEU 28 10.368 -0.483 6.322
222 HB3 LEU 28 3HB LEU 28 10.632 -2.209 6.085
223 HD11 LEU 28 1HD1 LEU 28 8.487 -0.712 5.101
224 HD12 LEU 28 2HD1 LEU 28 7.751 0.105 6.479
225 HD13 LEU 28 3HD1 LEU 28 7.003 -1.346 5.812
226 HD21 LEU 28 3HD2 LEU 28 9.013 -3.779 7.470
227 HD22 LEU 28 1HD2 LEU 28 8.697 -3.478 5.761
228 HD23 LEU 28 2HD2 LEU 28 7.387 -3.352 6.935
229 H LEU 29 H LEU 29 13.133 -1.283 6.503
230 HA LEU 29 HA LEU 29 13.999 -4.003 6.567
231 HG LEU 29 HG LEU 29 13.306 -3.100 4.346
232 HB2 LEU 29 2HB LEU 29 15.259 -1.483 5.510
233 HB3 LEU 29 3HB LEU 29 16.010 -3.071 5.366
234 HD11 LEU 29 1HD1 LEU 29 13.940 -1.725 2.296
235 HD12 LEU 29 2HD1 LEU 29 15.187 -1.002 3.312
236 HD13 LEU 29 3HD1 LEU 29 13.487 -0.841 3.754
237 HD21 LEU 29 3HD2 LEU 29 15.284 -4.680 3.963
238 HD22 LEU 29 1HD2 LEU 29 15.855 -3.475 2.808
239 HD23 LEU 29 2HD2 LEU 29 14.291 -4.254 2.568
240 H SER 30 H SER 30 15.032 -1.020 8.140
241 HA SER 30 HA SER 30 17.413 -1.957 9.277
242 HG SER 30 HG SER 30 17.243 1.498 9.406
243 HB2 SER 30 2HB SER 30 15.481 0.157 10.255
244 HB3 SER 30 3HB SER 30 17.083 -0.111 10.942
245 H SER 31 H SER 31 14.089 -2.423 10.183
246 HA SER 31 HA SER 31 14.286 -3.097 12.853
247 HG SER 31 HG SER 31 11.622 -4.216 13.321
248 HB2 SER 31 2HB SER 31 12.135 -2.937 11.728
249 HB3 SER 31 3HB SER 31 12.521 -4.339 10.730
250 H SER 32 H SER 32 15.288 -4.898 10.048
251 HA SER 32 HA SER 32 15.479 -7.460 11.169
252 HG SER 32 HG SER 32 16.183 -8.909 9.192
253 HB2 SER 32 2HB SER 32 15.708 -6.819 8.717
254 HB3 SER 32 3HB SER 32 17.367 -6.351 9.089
255 H GLY 33 H GLY 33 18.040 -8.352 10.927
256 HA2 GLY 33 2HA GLY 33 19.167 -7.880 13.405
257 HA3 GLY 33 3HA GLY 33 20.051 -8.515 12.025
258 H MET 34 H MET 34 20.137 -6.422 10.304
259 HA MET 34 HA MET 34 21.246 -4.164 11.808
260 HB2 MET 34 2HB MET 34 22.723 -6.044 10.090
261 HB3 MET 34 3HB MET 34 23.023 -4.346 9.746
262 HG2 MET 34 2HG MET 34 23.847 -3.941 11.905
263 HG3 MET 34 3HG MET 34 23.203 -5.461 12.522
264 HE1 MET 34 3HE MET 34 27.222 -5.370 12.554
265 HE2 MET 34 1HE MET 34 26.654 -3.921 11.724
266 HE3 MET 34 2HE MET 34 25.852 -4.465 13.198
267 H ALA 35 H ALA 35 21.938 -2.395 10.130
268 HA ALA 35 HA ALA 35 19.800 -2.208 8.107
269 HB1 ALA 35 1HB ALA 35 20.132 -0.588 10.309
270 HB2 ALA 35 2HB ALA 35 20.864 0.346 9.003
271 HB3 ALA 35 3HB ALA 35 19.193 -0.201 8.867
272 H PHE 36 H PHE 36 20.302 -1.367 6.102
273 HA PHE 36 HA PHE 36 23.149 -0.814 5.592
274 HD1 PHE 36 HD2 PHE 36 21.663 -4.272 5.854
275 HD2 PHE 36 HD1 PHE 36 20.084 -2.006 2.616
276 HE1 PHE 36 HE2 PHE 36 19.639 -5.670 5.868
277 HE2 PHE 36 HE1 PHE 36 18.056 -3.399 2.625
278 HZ PHE 36 HZ PHE 36 17.832 -5.235 4.252
279 HB2 PHE 36 2HB PHE 36 22.396 -1.835 3.219
280 HB3 PHE 36 3HB PHE 36 23.082 -2.816 4.510
281 H SER 37 H SER 37 23.331 0.139 3.234
282 HA SER 37 HA SER 37 21.851 2.595 3.287
283 HG SER 37 HG SER 37 23.177 3.749 0.587
284 HB2 SER 37 2HB SER 37 23.898 3.120 2.459
285 HB3 SER 37 3HB SER 37 24.158 1.503 1.804
286 H LEU 38 H LEU 38 19.884 2.833 2.481
287 HA LEU 38 HA LEU 38 18.953 1.013 0.387
288 HG LEU 38 HG LEU 38 16.201 0.831 2.854
289 HB2 LEU 38 2HB LEU 38 17.608 2.751 2.407
290 HB3 LEU 38 3HB LEU 38 16.733 2.274 0.954
291 HD11 LEU 38 1HD1 LEU 38 17.801 -0.577 0.722
292 HD12 LEU 38 2HD1 LEU 38 16.115 -0.077 0.585
293 HD13 LEU 38 3HD1 LEU 38 16.577 -1.308 1.760
294 HD21 LEU 38 3HD2 LEU 38 18.586 1.114 3.813
295 HD22 LEU 38 1HD2 LEU 38 18.990 -0.253 2.775
296 HD23 LEU 38 2HD2 LEU 38 17.758 -0.429 4.024
297 H HIS 39 H HIS 39 19.382 1.713 -1.606
298 HA HIS 39 HA HIS 39 18.579 4.448 -2.305
299 HD1 HIS 39 HD1 HIS 39 20.669 2.346 -5.183
300 HD2 HIS 39 HD2 HIS 39 22.892 2.567 -1.680
301 HE1 HIS 39 HE1 HIS 39 22.391 0.522 -5.363
302 HB2 HIS 39 2HB HIS 39 20.561 4.695 -3.740
303 HB3 HIS 39 3HB HIS 39 21.013 4.479 -2.052
304 H THR 40 H THR 40 17.745 4.709 -4.365
305 HA THR 40 HA THR 40 17.050 2.204 -5.729
306 HB THR 40 HB THR 40 15.097 3.164 -6.464
307 HG1 THR 40 HG1 THR 40 16.441 5.668 -6.279
308 HG21 THR 40 3HG2 THR 40 15.448 5.048 -4.163
309 HG22 THR 40 1HG2 THR 40 15.404 3.308 -3.885
310 HG23 THR 40 2HG2 THR 40 14.028 4.116 -4.636
311 H GLN 41 H GLN 41 17.874 1.726 -7.660
312 HA GLN 41 HA GLN 41 19.168 1.859 -9.531
313 HB2 GLN 41 2HB GLN 41 17.111 3.735 -9.732
314 HB3 GLN 41 3HB GLN 41 18.553 4.603 -10.242
315 HG2 GLN 41 2HG GLN 41 19.002 2.604 -11.763
316 HG3 GLN 41 3HG GLN 41 17.334 2.140 -11.433
317 HE21 GLN 41 1HE2 GLN 41 19.320 3.844 -13.459
318 HE22 GLN 41 2HE2 GLN 41 18.144 4.858 -14.216
319 H GLY 42 H GLY 42 20.360 2.741 -7.010
320 HA2 GLY 42 2HA GLY 42 22.521 3.413 -6.485
321 HA3 GLY 42 3HA GLY 42 22.711 3.988 -8.135
322 H ARG 43 H ARG 43 19.996 4.988 -6.202
323 HA ARG 43 HA ARG 43 21.277 7.598 -5.749
324 HE ARG 43 HE ARG 43 20.330 8.517 -10.565
325 HB2 ARG 43 2HB ARG 43 18.462 7.148 -6.760
326 HB3 ARG 43 3HB ARG 43 19.156 8.707 -6.335
327 HG2 ARG 43 2HG ARG 43 20.814 8.449 -8.118
328 HG3 ARG 43 3HG ARG 43 20.094 6.897 -8.551
329 HD2 ARG 43 2HD ARG 43 17.997 7.996 -9.093
330 HD3 ARG 43 3HD ARG 43 18.660 9.550 -8.588
331 HH11 ARG 43 1HH1 ARG 43 17.059 9.662 -10.229
332 HH12 ARG 43 2HH1 ARG 43 16.944 10.209 -11.869
333 HH21 ARG 43 1HH2 ARG 43 20.191 9.233 -12.726
334 HH22 ARG 43 2HH2 ARG 43 18.726 9.964 -13.289
335 H VAL 44 H VAL 44 21.370 7.918 -3.632
336 HA VAL 44 HA VAL 44 20.045 6.500 -1.666
337 HB VAL 44 HB VAL 44 21.042 9.346 -1.477
338 HG11 VAL 44 1HG1 VAL 44 20.151 7.354 0.571
339 HG12 VAL 44 2HG1 VAL 44 21.353 8.580 0.975
340 HG13 VAL 44 3HG1 VAL 44 19.748 9.064 0.428
341 HG21 VAL 44 3HG2 VAL 44 22.425 6.871 -1.825
342 HG22 VAL 44 1HG2 VAL 44 23.085 8.498 -1.659
343 HG23 VAL 44 2HG2 VAL 44 22.787 7.516 -0.224
344 H LEU 45 H LEU 45 18.116 6.633 -0.661
345 HA LEU 45 HA LEU 45 16.078 8.288 -1.852
346 HG LEU 45 HG LEU 45 15.268 5.623 -2.281
347 HB2 LEU 45 2HB LEU 45 16.198 5.952 -0.106
348 HB3 LEU 45 3HB LEU 45 14.922 7.087 0.330
349 HD11 LEU 45 1HD1 LEU 45 12.807 5.624 -0.605
350 HD12 LEU 45 2HD1 LEU 45 14.177 4.629 -0.114
351 HD13 LEU 45 3HD1 LEU 45 13.433 4.386 -1.694
352 HD21 LEU 45 3HD2 LEU 45 12.823 7.069 -2.150
353 HD22 LEU 45 1HD2 LEU 45 14.129 7.212 -3.326
354 HD23 LEU 45 2HD2 LEU 45 14.152 8.193 -1.861
355 H SER 46 H SER 46 15.175 10.092 -1.041
356 HA SER 46 HA SER 46 16.479 11.406 1.156
357 HG SER 46 HG SER 46 13.807 12.334 -1.556
358 HB2 SER 46 2HB SER 46 14.989 13.286 0.640
359 HB3 SER 46 3HB SER 46 15.738 12.664 -0.830
360 H GLU 47 H GLU 47 15.488 12.142 3.081
361 HA GLU 47 HA GLU 47 13.963 10.264 4.451
362 HB2 GLU 47 2HB GLU 47 14.307 13.214 5.011
363 HB3 GLU 47 3HB GLU 47 13.616 12.060 6.143
364 HG2 GLU 47 2HG GLU 47 15.739 10.813 6.127
365 HG3 GLU 47 3HG GLU 47 16.423 12.036 5.057
366 H ALA 48 H ALA 48 12.983 12.848 2.367
367 HA ALA 48 HA ALA 48 10.173 12.482 3.150
368 HB1 ALA 48 1HB ALA 48 11.693 14.782 2.491
369 HB2 ALA 48 2HB ALA 48 10.458 14.574 1.249
370 HB3 ALA 48 3HB ALA 48 9.992 14.682 2.947
371 H ALA 49 H ALA 49 12.291 11.223 1.024
372 HA ALA 49 HA ALA 49 11.163 11.366 -1.496
373 HB1 ALA 49 1HB ALA 49 12.539 9.643 -2.074
374 HB2 ALA 49 2HB ALA 49 13.298 10.121 -0.555
375 HB3 ALA 49 3HB ALA 49 12.208 8.734 -0.598
376 H GLU 50 H GLU 50 9.240 10.820 -2.268
377 HA GLU 50 HA GLU 50 7.470 9.147 -0.681
378 HB2 GLU 50 2HB GLU 50 6.085 10.750 -1.442
379 HB3 GLU 50 3HB GLU 50 7.163 11.182 -2.762
380 HG2 GLU 50 2HG GLU 50 6.278 9.516 -4.169
381 HG3 GLU 50 3HG GLU 50 5.444 8.725 -2.832
382 H LEU 51 H LEU 51 7.238 7.045 -1.012
383 HA LEU 51 HA LEU 51 8.508 5.737 -3.223
384 HG LEU 51 HG LEU 51 8.279 5.679 0.064
385 HB2 LEU 51 2HB LEU 51 6.592 4.472 -1.288
386 HB3 LEU 51 3HB LEU 51 7.900 3.706 -2.188
387 HD11 LEU 51 1HD1 LEU 51 9.286 3.221 0.828
388 HD12 LEU 51 2HD1 LEU 51 7.747 2.831 0.060
389 HD13 LEU 51 3HD1 LEU 51 7.797 3.971 1.404
390 HD21 LEU 51 3HD2 LEU 51 10.411 3.848 -0.873
391 HD22 LEU 51 1HD2 LEU 51 10.522 5.485 -0.226
392 HD23 LEU 51 2HD2 LEU 51 10.023 5.230 -1.898
393 H ASN 52 H ASN 52 6.697 3.632 -3.704
394 HA ASN 52 HA ASN 52 4.191 4.679 -4.620
395 HB2 ASN 52 2HB ASN 52 6.283 5.163 -6.326
396 HB3 ASN 52 3HB ASN 52 5.665 3.631 -6.937
397 HD21 ASN 52 1HD2 ASN 52 5.596 6.550 -7.830
398 HD22 ASN 52 2HD2 ASN 52 3.941 6.802 -8.258
399 H ASP 53 H ASP 53 3.432 2.872 -6.460
400 HA ASP 53 HA ASP 53 3.339 0.428 -4.905
401 HB2 ASP 53 2HB ASP 53 1.353 1.568 -6.106
402 HB3 ASP 53 3HB ASP 53 2.005 0.837 -7.570
403 H LYS 54 H LYS 54 4.135 -1.545 -5.501
404 HA LYS 54 HA LYS 54 5.663 -2.975 -6.408
405 HB2 LYS 54 2HB LYS 54 4.808 -1.774 -9.041
406 HB3 LYS 54 3HB LYS 54 5.421 -3.397 -8.753
407 HG2 LYS 54 2HG LYS 54 3.355 -3.708 -7.272
408 HG3 LYS 54 3HG LYS 54 2.739 -2.255 -8.063
409 HD2 LYS 54 2HD LYS 54 3.323 -3.484 -10.259
410 HD3 LYS 54 3HD LYS 54 3.369 -4.934 -9.254
411 HE2 LYS 54 2HE LYS 54 1.036 -3.044 -9.552
412 HE3 LYS 54 3HE LYS 54 1.175 -4.644 -10.279
413 HZ1 LYS 54 3HZ LYS 54 1.454 -5.439 -7.879
414 HZ2 LYS 54 1HZ LYS 54 -0.097 -4.997 -8.390
415 HZ3 LYS 54 2HZ LYS 54 0.814 -3.937 -7.437
416 H MET 55 H MET 55 6.858 -0.668 -5.491
417 HA MET 55 HA MET 55 8.573 0.488 -7.470
418 HB2 MET 55 2HB MET 55 8.359 0.646 -4.488
419 HB3 MET 55 3HB MET 55 9.806 1.253 -5.282
420 HG2 MET 55 2HG MET 55 7.777 2.372 -6.757
421 HG3 MET 55 3HG MET 55 7.142 2.400 -5.113
422 HE1 MET 55 3HE MET 55 10.226 2.993 -7.256
423 HE2 MET 55 1HE MET 55 9.344 4.480 -7.606
424 HE3 MET 55 2HE MET 55 10.859 4.545 -6.706
425 H VAL 56 H VAL 56 11.038 0.496 -6.935
426 HA VAL 56 HA VAL 56 11.967 -2.172 -6.160
427 HB VAL 56 HB VAL 56 12.704 -0.829 -8.765
428 HG11 VAL 56 1HG1 VAL 56 14.092 -2.814 -9.166
429 HG12 VAL 56 2HG1 VAL 56 14.641 -1.901 -7.758
430 HG13 VAL 56 3HG1 VAL 56 13.722 -3.392 -7.541
431 HG21 VAL 56 3HG2 VAL 56 10.612 -1.863 -9.066
432 HG22 VAL 56 1HG2 VAL 56 11.791 -3.020 -9.686
433 HG23 VAL 56 2HG2 VAL 56 11.071 -3.262 -8.095
434 H ILE 57 H ILE 57 13.039 -1.463 -4.372
435 HA ILE 57 HA ILE 57 14.963 0.727 -4.670
436 HB ILE 57 HB ILE 57 14.258 -0.661 -2.095
437 HG12 ILE 57 2HG1 ILE 57 12.180 0.160 -3.114
438 HG13 ILE 57 3HG1 ILE 57 12.608 1.113 -1.697
439 HG21 ILE 57 1HG2 ILE 57 14.796 2.068 -1.735
440 HG22 ILE 57 2HG2 ILE 57 15.813 0.700 -1.286
441 HG23 ILE 57 3HG2 ILE 57 16.017 1.471 -2.859
442 HD11 ILE 57 3HD1 ILE 57 13.236 1.949 -4.514
443 HD12 ILE 57 1HD1 ILE 57 11.772 2.421 -3.650
444 HD13 ILE 57 2HD1 ILE 57 13.353 2.919 -3.046
445 H ASP 58 H ASP 58 17.126 0.451 -4.475
446 HA ASP 58 HA ASP 58 18.097 -2.304 -4.437
447 HB2 ASP 58 2HB ASP 58 18.743 -0.337 -6.117
448 HB3 ASP 58 3HB ASP 58 19.941 -0.005 -4.869
449 H ALA 59 H ALA 59 18.507 -3.081 -2.470
450 HA ALA 59 HA ALA 59 19.485 -1.321 -0.364
451 HB1 ALA 59 1HB ALA 59 18.124 -3.913 -0.479
452 HB2 ALA 59 2HB ALA 59 19.365 -3.793 0.769
453 HB3 ALA 59 3HB ALA 59 18.036 -2.634 0.733
454 H PHE 60 H PHE 60 21.604 -0.959 -0.310
455 HA PHE 60 HA PHE 60 23.432 -3.164 -0.985
456 HD1 PHE 60 HD2 PHE 60 26.389 -2.522 -1.039
457 HD2 PHE 60 HD1 PHE 60 24.584 1.267 -0.326
458 HE1 PHE 60 HE2 PHE 60 28.468 -1.733 0.012
459 HE2 PHE 60 HE1 PHE 60 26.662 2.062 0.725
460 HZ PHE 60 HZ PHE 60 28.607 0.561 0.896
461 HB2 PHE 60 2HB PHE 60 24.335 -1.615 -2.342
462 HB3 PHE 60 3HB PHE 60 23.445 -0.307 -1.570
463 H VAL 61 H VAL 61 24.445 -4.112 0.644
464 HA VAL 61 HA VAL 61 24.579 -2.745 3.232
465 HB VAL 61 HB VAL 61 24.923 -4.870 4.244
466 HG11 VAL 61 1HG1 VAL 61 23.013 -5.989 2.400
467 HG12 VAL 61 2HG1 VAL 61 22.776 -5.418 4.052
468 HG13 VAL 61 3HG1 VAL 61 22.669 -4.287 2.703
469 HG21 VAL 61 3HG2 VAL 61 25.909 -5.590 1.607
470 HG22 VAL 61 1HG2 VAL 61 26.259 -6.306 3.181
471 HG23 VAL 61 2HG2 VAL 61 24.829 -6.811 2.281
472 HA PRO 62 HA PRO 62 28.910 -2.044 3.031
473 HB2 PRO 62 2HB PRO 62 29.584 -2.287 5.649
474 HB3 PRO 62 3HB PRO 62 28.688 -0.903 5.012
475 HG2 PRO 62 2HG PRO 62 27.665 -3.325 6.444
476 HG3 PRO 62 3HG PRO 62 27.206 -1.625 6.653
477 HD2 PRO 62 2HD PRO 62 25.712 -3.372 5.223
478 HD3 PRO 62 3HD PRO 62 25.810 -1.646 4.819
479 H ALA 63 H ALA 63 30.708 -3.204 2.628
480 HA ALA 63 HA ALA 63 30.636 -6.066 3.154
481 HB1 ALA 63 1HB ALA 63 31.336 -5.883 1.012
482 HB2 ALA 63 2HB ALA 63 32.064 -4.296 1.268
483 HB3 ALA 63 3HB ALA 63 32.917 -5.751 1.784
484 H ASP 64 H ASP 64 32.785 -7.107 3.742
485 HA ASP 64 HA ASP 64 33.602 -6.111 6.277
486 HB2 ASP 64 2HB ASP 64 34.702 -8.348 4.565
487 HB3 ASP 64 3HB ASP 64 35.226 -8.015 6.214
488 H GLY 65 H GLY 65 35.312 -4.899 6.851
489 HA2 GLY 65 2HA GLY 65 37.589 -4.593 5.082
490 HA3 GLY 65 3HA GLY 65 36.605 -3.149 5.271
491 H ALA 66 H ALA 66 37.654 -1.792 6.564
492 HA ALA 66 HA ALA 66 38.504 -2.763 9.192
493 HB1 ALA 66 1HB ALA 66 40.268 -1.063 7.434
494 HB2 ALA 66 2HB ALA 66 40.635 -1.626 9.066
495 HB3 ALA 66 3HB ALA 66 40.497 -2.785 7.743
496 H GLY 67 H GLY 67 37.478 -1.568 10.650
497 HA2 GLY 67 2HA GLY 67 37.697 1.208 10.869
498 HA3 GLY 67 3HA GLY 67 36.177 0.868 10.055
499 H LEU 68 H LEU 68 38.041 0.113 12.973
500 HA LEU 68 HA LEU 68 35.922 -1.082 14.397
501 HG LEU 68 HG LEU 68 37.415 -2.624 15.257
502 HB2 LEU 68 2HB LEU 68 38.642 -0.351 14.873
503 HB3 LEU 68 3HB LEU 68 37.655 0.193 16.229
504 HD11 LEU 68 1HD1 LEU 68 39.771 -2.428 15.494
505 HD12 LEU 68 2HD1 LEU 68 39.167 -3.219 16.949
506 HD13 LEU 68 3HD1 LEU 68 39.609 -1.512 16.992
507 HD21 LEU 68 3HD2 LEU 68 37.418 -2.196 18.095
508 HD22 LEU 68 1HD2 LEU 68 36.139 -2.833 17.060
509 HD23 LEU 68 2HD2 LEU 68 36.284 -1.093 17.314
510 H GLU 69 H GLU 69 37.405 2.077 15.129
511 HA GLU 69 HA GLU 69 34.965 2.960 16.400
512 HB2 GLU 69 2HB GLU 69 37.528 4.482 15.899
513 HB3 GLU 69 3HB GLU 69 36.224 4.968 16.973
514 HG2 GLU 69 2HG GLU 69 37.773 2.422 17.336
515 HG3 GLU 69 3HG GLU 69 38.248 3.953 18.068
Start of MODEL 6
1 HA MET 1 HA MET 1 2.053 0.317 -2.951
2 H1 MET 1 H MET 1 1.426 0.019 -0.089
3 HB2 MET 1 2HB MET 1 3.267 1.611 -0.513
4 HB3 MET 1 3HB MET 1 4.047 1.645 -2.088
5 HG2 MET 1 2HG MET 1 1.247 2.635 -1.676
6 HG3 MET 1 3HG MET 1 2.656 3.661 -1.423
7 HE1 MET 1 3HE MET 1 0.018 2.828 -3.292
8 HE2 MET 1 1HE MET 1 0.281 3.701 -4.803
9 HE3 MET 1 2HE MET 1 0.543 1.958 -4.734
10 H LEU 2 H LEU 2 3.299 -1.197 -3.820
11 HA LEU 2 HA LEU 2 4.629 -3.126 -2.107
12 HG LEU 2 HG LEU 2 5.609 -5.217 -3.766
13 HB2 LEU 2 2HB LEU 2 3.283 -3.411 -4.416
14 HB3 LEU 2 3HB LEU 2 4.925 -3.280 -5.042
15 HD11 LEU 2 1HD1 LEU 2 3.211 -6.315 -2.836
16 HD12 LEU 2 2HD1 LEU 2 3.219 -4.642 -2.281
17 HD13 LEU 2 3HD1 LEU 2 4.562 -5.710 -1.875
18 HD21 LEU 2 3HD2 LEU 2 3.065 -6.198 -4.917
19 HD22 LEU 2 1HD2 LEU 2 4.721 -6.742 -5.188
20 HD23 LEU 2 2HD2 LEU 2 4.129 -5.286 -5.989
21 H VAL 3 H VAL 3 6.823 -3.528 -2.056
22 HA VAL 3 HA VAL 3 8.590 -1.780 -3.601
23 HB VAL 3 HB VAL 3 9.210 -2.135 -0.701
24 HG11 VAL 3 1HG1 VAL 3 9.836 0.431 -1.607
25 HG12 VAL 3 2HG1 VAL 3 10.949 -0.917 -1.364
26 HG13 VAL 3 3HG1 VAL 3 10.223 -0.645 -2.949
27 HG21 VAL 3 3HG2 VAL 3 8.044 -0.007 -0.207
28 HG22 VAL 3 1HG2 VAL 3 7.324 -0.063 -1.816
29 HG23 VAL 3 2HG2 VAL 3 6.941 -1.315 -0.635
30 H ILE 4 H ILE 4 10.009 -3.046 -4.584
31 HA ILE 4 HA ILE 4 10.587 -5.694 -3.544
32 HB ILE 4 HB ILE 4 11.299 -4.296 -6.112
33 HG12 ILE 4 2HG1 ILE 4 9.009 -5.325 -5.723
34 HG13 ILE 4 3HG1 ILE 4 9.879 -5.903 -7.140
35 HG21 ILE 4 1HG2 ILE 4 13.198 -5.509 -6.057
36 HG22 ILE 4 2HG2 ILE 4 12.572 -6.631 -4.850
37 HG23 ILE 4 3HG2 ILE 4 12.130 -6.824 -6.546
38 HD11 ILE 4 3HD1 ILE 4 9.903 -7.992 -6.390
39 HD12 ILE 4 1HD1 ILE 4 10.409 -7.499 -4.774
40 HD13 ILE 4 2HD1 ILE 4 8.701 -7.459 -5.215
41 H VAL 5 H VAL 5 11.899 -5.430 -1.772
42 HA VAL 5 HA VAL 5 14.254 -3.760 -1.899
43 HB VAL 5 HB VAL 5 13.343 -5.689 0.241
44 HG11 VAL 5 1HG1 VAL 5 15.378 -5.455 1.104
45 HG12 VAL 5 2HG1 VAL 5 15.828 -4.284 -0.137
46 HG13 VAL 5 3HG1 VAL 5 15.021 -3.744 1.336
47 HG21 VAL 5 3HG2 VAL 5 11.748 -4.015 0.266
48 HG22 VAL 5 1HG2 VAL 5 12.940 -3.401 1.411
49 HG23 VAL 5 2HG2 VAL 5 12.894 -2.772 -0.236
50 H ARG 6 H ARG 6 16.213 -4.376 -2.535
51 HA ARG 6 HA ARG 6 16.674 -7.210 -3.101
52 HE ARG 6 HE ARG 6 15.457 -6.241 -7.889
53 HB2 ARG 6 2HB ARG 6 17.658 -4.661 -4.207
54 HB3 ARG 6 3HB ARG 6 18.869 -5.929 -4.077
55 HG2 ARG 6 2HG ARG 6 18.117 -6.517 -6.103
56 HG3 ARG 6 3HG ARG 6 16.828 -7.304 -5.192
57 HD2 ARG 6 2HD ARG 6 15.294 -5.659 -5.681
58 HD3 ARG 6 3HD ARG 6 16.534 -4.433 -5.937
59 HH11 ARG 6 1HH1 ARG 6 18.213 -4.304 -7.007
60 HH12 ARG 6 2HH1 ARG 6 18.788 -4.148 -8.634
61 HH21 ARG 6 1HH2 ARG 6 16.205 -6.043 -10.035
62 HH22 ARG 6 2HH2 ARG 6 17.644 -5.137 -10.356
63 H LEU 7 H LEU 7 17.742 -8.390 -1.670
64 HA LEU 7 HA LEU 7 19.229 -7.159 0.470
65 HG LEU 7 HG LEU 7 18.504 -8.392 2.419
66 HB2 LEU 7 2HB LEU 7 18.252 -9.859 -0.201
67 HB3 LEU 7 3HB LEU 7 19.730 -9.795 0.757
68 HD11 LEU 7 1HD1 LEU 7 16.461 -8.563 0.361
69 HD12 LEU 7 2HD1 LEU 7 16.612 -7.449 1.719
70 HD13 LEU 7 3HD1 LEU 7 15.866 -9.030 1.954
71 HD21 LEU 7 3HD2 LEU 7 18.490 -11.142 2.042
72 HD22 LEU 7 1HD2 LEU 7 16.812 -10.739 2.409
73 HD23 LEU 7 2HD2 LEU 7 18.095 -10.277 3.529
74 H GLN 8 H GLN 8 21.421 -8.059 1.054
75 HA GLN 8 HA GLN 8 23.435 -7.290 -0.444
76 HB2 GLN 8 2HB GLN 8 23.377 -8.782 1.749
77 HB3 GLN 8 3HB GLN 8 23.803 -10.054 0.612
78 HG2 GLN 8 2HG GLN 8 25.824 -9.020 0.038
79 HG3 GLN 8 3HG GLN 8 25.339 -7.485 0.757
80 HE21 GLN 8 1HE2 GLN 8 27.524 -7.806 1.731
81 HE22 GLN 8 2HE2 GLN 8 27.606 -8.661 3.230
82 H ASP 9 H ASP 9 22.107 -10.575 -0.841
83 HA ASP 9 HA ASP 9 22.746 -10.440 -3.688
84 HB2 ASP 9 2HB ASP 9 23.590 -12.775 -1.960
85 HB3 ASP 9 3HB ASP 9 23.848 -12.603 -3.694
86 H GLN 10 H GLN 10 20.248 -10.209 -2.532
87 HA GLN 10 HA GLN 10 18.906 -12.478 -3.721
88 HB2 GLN 10 2HB GLN 10 18.685 -11.843 -0.784
89 HB3 GLN 10 3HB GLN 10 17.436 -12.730 -1.648
90 HG2 GLN 10 2HG GLN 10 19.125 -14.418 -2.278
91 HG3 GLN 10 3HG GLN 10 20.308 -13.553 -1.299
92 HE21 GLN 10 1HE2 GLN 10 19.774 -16.171 -0.793
93 HE22 GLN 10 2HE2 GLN 10 18.923 -16.324 0.702
94 H THR 11 H THR 11 16.457 -12.144 -3.603
95 HA THR 11 HA THR 11 15.768 -9.288 -3.569
96 HB THR 11 HB THR 11 14.992 -11.191 -5.789
97 HG1 THR 11 HG1 THR 11 17.237 -10.304 -5.711
98 HG21 THR 11 3HG2 THR 11 13.803 -8.778 -4.875
99 HG22 THR 11 1HG2 THR 11 13.382 -9.737 -6.293
100 HG23 THR 11 2HG2 THR 11 14.579 -8.448 -6.423
101 H LEU 12 H LEU 12 14.107 -8.983 -2.252
102 HA LEU 12 HA LEU 12 11.921 -10.933 -2.227
103 HG LEU 12 HG LEU 12 12.953 -12.341 0.977
104 HB2 LEU 12 2HB LEU 12 13.657 -10.159 0.038
105 HB3 LEU 12 3HB LEU 12 11.930 -10.266 0.369
106 HD11 LEU 12 1HD1 LEU 12 11.624 -13.861 -0.249
107 HD12 LEU 12 2HD1 LEU 12 11.623 -12.825 -1.676
108 HD13 LEU 12 3HD1 LEU 12 10.738 -12.336 -0.231
109 HD21 LEU 12 3HD2 LEU 12 14.656 -13.288 -0.105
110 HD22 LEU 12 1HD2 LEU 12 14.732 -11.811 -1.066
111 HD23 LEU 12 2HD2 LEU 12 13.822 -13.202 -1.658
112 HA PRO 13 HA PRO 13 9.552 -7.216 -2.587
113 HB2 PRO 13 2HB PRO 13 7.108 -8.318 -2.159
114 HB3 PRO 13 3HB PRO 13 7.995 -8.508 -3.676
115 HG2 PRO 13 2HG PRO 13 7.760 -10.402 -1.370
116 HG3 PRO 13 3HG PRO 13 7.680 -10.741 -3.109
117 HD2 PRO 13 2HD PRO 13 9.910 -11.187 -1.638
118 HD3 PRO 13 3HD PRO 13 9.973 -10.711 -3.347
119 H PHE 14 H PHE 14 8.060 -5.905 -1.318
120 HA PHE 14 HA PHE 14 7.814 -6.611 1.504
121 HD1 PHE 14 HD2 PHE 14 8.558 -5.130 3.923
122 HD2 PHE 14 HD1 PHE 14 11.469 -5.874 0.909
123 HE1 PHE 14 HE2 PHE 14 10.056 -6.102 5.615
124 HE2 PHE 14 HE1 PHE 14 12.972 -6.849 2.596
125 HZ PHE 14 HZ PHE 14 12.267 -6.962 4.952
126 HB2 PHE 14 2HB PHE 14 9.598 -4.542 0.426
127 HB3 PHE 14 3HB PHE 14 8.529 -3.970 1.702
128 H GLU 15 H GLU 15 5.850 -6.131 2.231
129 HA GLU 15 HA GLU 15 4.074 -4.546 0.570
130 HB2 GLU 15 2HB GLU 15 3.175 -6.608 1.404
131 HB3 GLU 15 3HB GLU 15 3.619 -6.198 3.055
132 HG2 GLU 15 2HG GLU 15 1.971 -4.473 3.145
133 HG3 GLU 15 3HG GLU 15 1.620 -4.651 1.427
134 H LEU 16 H LEU 16 3.992 -2.421 0.825
135 HA LEU 16 HA LEU 16 4.296 -1.317 3.540
136 HG LEU 16 HG LEU 16 7.333 -0.143 1.811
137 HB2 LEU 16 2HB LEU 16 5.277 -0.381 0.887
138 HB3 LEU 16 3HB LEU 16 4.881 0.816 2.118
139 HD11 LEU 16 1HD1 LEU 16 6.370 0.146 4.622
140 HD12 LEU 16 2HD1 LEU 16 6.272 1.513 3.513
141 HD13 LEU 16 3HD1 LEU 16 7.834 0.773 3.864
142 HD21 LEU 16 3HD2 LEU 16 6.572 -2.482 2.192
143 HD22 LEU 16 1HD2 LEU 16 6.149 -2.028 3.843
144 HD23 LEU 16 2HD2 LEU 16 7.828 -1.947 3.310
145 HA PRO 17 HA PRO 17 0.352 0.584 3.275
146 HB2 PRO 17 2HB PRO 17 0.783 3.016 4.402
147 HB3 PRO 17 3HB PRO 17 0.759 1.515 5.335
148 HG2 PRO 17 2HG PRO 17 3.102 3.074 4.313
149 HG3 PRO 17 3HG PRO 17 2.872 2.309 5.897
150 HD2 PRO 17 2HD PRO 17 4.353 1.176 3.933
151 HD3 PRO 17 3HD PRO 17 3.430 0.216 5.107
152 H ALA 18 H ALA 18 -0.805 2.635 2.557
153 HA ALA 18 HA ALA 18 -0.005 3.245 -0.111
154 HB1 ALA 18 1HB ALA 18 -1.989 5.059 0.552
155 HB2 ALA 18 2HB ALA 18 -2.217 3.478 -0.198
156 HB3 ALA 18 3HB ALA 18 -2.341 3.650 1.553
157 H GLY 19 H GLY 19 1.278 4.824 -0.813
158 HA2 GLY 19 2HA GLY 19 2.207 6.956 -0.940
159 HA3 GLY 19 3HA GLY 19 1.413 7.365 0.573
160 H ALA 20 H ALA 20 2.977 4.458 0.955
161 HA ALA 20 HA ALA 20 4.752 5.286 2.883
162 HB1 ALA 20 1HB ALA 20 4.245 2.975 2.689
163 HB2 ALA 20 2HB ALA 20 4.888 2.903 1.048
164 HB3 ALA 20 3HB ALA 20 5.979 3.143 2.413
165 H ARG 21 H ARG 21 6.723 6.192 2.932
166 HA ARG 21 HA ARG 21 8.064 6.667 0.352
167 HE ARG 21 HE ARG 21 7.596 9.463 5.582
168 HB2 ARG 21 2HB ARG 21 9.139 8.612 1.685
169 HB3 ARG 21 3HB ARG 21 7.485 8.787 1.114
170 HG2 ARG 21 2HG ARG 21 6.626 8.265 3.306
171 HG3 ARG 21 3HG ARG 21 8.257 7.943 3.899
172 HD2 ARG 21 2HD ARG 21 8.773 10.354 3.175
173 HD3 ARG 21 3HD ARG 21 7.024 10.561 3.106
174 HH11 ARG 21 1HH1 ARG 21 8.341 12.375 3.825
175 HH12 ARG 21 2HH1 ARG 21 8.480 13.354 5.248
176 HH21 ARG 21 1HH2 ARG 21 7.776 10.741 7.463
177 HH22 ARG 21 2HH2 ARG 21 8.160 12.423 7.316
178 H ALA 22 H ALA 22 10.503 7.246 0.801
179 HA ALA 22 HA ALA 22 11.837 4.934 1.488
180 HB1 ALA 22 1HB ALA 22 13.784 6.079 1.120
181 HB2 ALA 22 2HB ALA 22 12.634 7.149 0.319
182 HB3 ALA 22 3HB ALA 22 13.214 7.534 1.939
183 H SER 23 H SER 23 10.664 7.467 3.554
184 HA SER 23 HA SER 23 12.272 6.951 5.818
185 HG SER 23 HG SER 23 10.372 7.918 7.934
186 HB2 SER 23 2HB SER 23 11.229 8.930 6.192
187 HB3 SER 23 3HB SER 23 9.822 8.483 5.227
188 H GLN 24 H GLN 24 8.842 6.106 5.301
189 HA GLN 24 HA GLN 24 8.537 4.426 7.471
190 HB2 GLN 24 2HB GLN 24 7.034 5.119 5.175
191 HB3 GLN 24 3HB GLN 24 7.052 3.363 5.261
192 HG2 GLN 24 2HG GLN 24 5.381 3.520 6.702
193 HG3 GLN 24 3HG GLN 24 6.546 4.156 7.862
194 HE21 GLN 24 1HE2 GLN 24 5.198 5.541 8.902
195 HE22 GLN 24 2HE2 GLN 24 4.488 6.930 8.160
196 H LEU 25 H LEU 25 9.449 3.527 4.149
197 HA LEU 25 HA LEU 25 9.713 0.791 4.527
198 HG LEU 25 HG LEU 25 12.167 0.186 2.632
199 HB2 LEU 25 2HB LEU 25 9.811 2.044 2.359
200 HB3 LEU 25 3HB LEU 25 11.470 2.484 2.761
201 HD11 LEU 25 1HD1 LEU 25 9.280 -0.481 2.075
202 HD12 LEU 25 2HD1 LEU 25 10.151 -0.840 3.565
203 HD13 LEU 25 3HD1 LEU 25 10.635 -1.610 2.055
204 HD21 LEU 25 3HD2 LEU 25 11.823 -0.233 0.286
205 HD22 LEU 25 1HD2 LEU 25 12.005 1.503 0.541
206 HD23 LEU 25 2HD2 LEU 25 10.404 0.815 0.267
207 H SER 26 H SER 26 12.256 3.279 4.751
208 HA SER 26 HA SER 26 14.383 1.672 5.454
209 HG SER 26 HG SER 26 15.794 3.556 4.589
210 HB2 SER 26 2HB SER 26 13.703 4.505 6.236
211 HB3 SER 26 3HB SER 26 15.218 3.740 6.716
212 H ASN 27 H ASN 27 11.744 2.834 7.447
213 HA ASN 27 HA ASN 27 12.859 2.125 9.954
214 HB2 ASN 27 2HB ASN 27 10.942 3.706 9.621
215 HB3 ASN 27 3HB ASN 27 9.927 2.319 9.238
216 HD21 ASN 27 1HD2 ASN 27 8.569 2.271 10.914
217 HD22 ASN 27 2HD2 ASN 27 9.044 2.126 12.569
218 H LEU 28 H LEU 28 10.493 0.485 7.858
219 HA LEU 28 HA LEU 28 10.057 -1.774 9.399
220 HG LEU 28 HG LEU 28 7.610 -1.884 6.649
221 HB2 LEU 28 2HB LEU 28 9.982 -1.244 6.460
222 HB3 LEU 28 3HB LEU 28 9.756 -2.886 7.057
223 HD11 LEU 28 1HD1 LEU 28 8.237 -3.211 8.865
224 HD12 LEU 28 2HD1 LEU 28 6.614 -2.592 8.561
225 HD13 LEU 28 3HD1 LEU 28 7.718 -1.695 9.603
226 HD21 LEU 28 3HD2 LEU 28 6.890 0.114 7.934
227 HD22 LEU 28 1HD2 LEU 28 8.168 0.450 6.766
228 HD23 LEU 28 2HD2 LEU 28 8.556 0.316 8.481
229 H LEU 29 H LEU 29 12.484 -1.320 6.831
230 HA LEU 29 HA LEU 29 13.683 -3.845 7.070
231 HG LEU 29 HG LEU 29 13.210 -3.251 4.790
232 HB2 LEU 29 2HB LEU 29 14.628 -1.199 6.029
233 HB3 LEU 29 3HB LEU 29 15.711 -2.588 6.087
234 HD11 LEU 29 1HD1 LEU 29 12.907 -1.185 3.879
235 HD12 LEU 29 2HD1 LEU 29 14.037 -1.857 2.705
236 HD13 LEU 29 3HD1 LEU 29 14.619 -0.770 3.966
237 HD21 LEU 29 3HD2 LEU 29 15.845 -3.177 3.413
238 HD22 LEU 29 1HD2 LEU 29 14.581 -4.407 3.375
239 HD23 LEU 29 2HD2 LEU 29 15.641 -4.275 4.779
240 H SER 30 H SER 30 14.516 -0.732 8.563
241 HA SER 30 HA SER 30 16.783 -1.653 9.962
242 HG SER 30 HG SER 30 16.627 1.411 11.845
243 HB2 SER 30 2HB SER 30 16.372 0.730 9.596
244 HB3 SER 30 3HB SER 30 14.928 0.653 10.605
245 H SER 31 H SER 31 13.405 -1.987 10.546
246 HA SER 31 HA SER 31 13.312 -2.285 13.309
247 HG SER 31 HG SER 31 10.780 -1.965 13.306
248 HB2 SER 31 2HB SER 31 11.481 -2.476 11.305
249 HB3 SER 31 3HB SER 31 11.632 -4.169 11.775
250 H SER 32 H SER 32 13.819 -4.788 10.828
251 HA SER 32 HA SER 32 15.362 -6.335 12.766
252 HG SER 32 HG SER 32 13.582 -9.408 12.237
253 HB2 SER 32 2HB SER 32 13.229 -7.349 13.061
254 HB3 SER 32 3HB SER 32 12.907 -7.346 11.327
255 H GLY 33 H GLY 33 16.736 -7.934 11.799
256 HA2 GLY 33 2HA GLY 33 17.996 -8.877 10.100
257 HA3 GLY 33 3HA GLY 33 16.906 -8.143 8.933
258 H MET 34 H MET 34 19.395 -7.179 11.297
259 HA MET 34 HA MET 34 20.978 -5.539 11.237
260 HB2 MET 34 2HB MET 34 21.069 -6.146 8.280
261 HB3 MET 34 3HB MET 34 22.366 -5.499 9.276
262 HG2 MET 34 2HG MET 34 22.325 -7.645 10.563
263 HG3 MET 34 3HG MET 34 21.206 -8.269 9.354
264 HE1 MET 34 3HE MET 34 25.293 -6.812 9.263
265 HE2 MET 34 1HE MET 34 24.416 -7.580 10.587
266 HE3 MET 34 2HE MET 34 25.469 -8.544 9.552
267 H ALA 35 H ALA 35 21.733 -3.638 9.437
268 HA ALA 35 HA ALA 35 19.399 -2.223 8.470
269 HB1 ALA 35 1HB ALA 35 19.614 -0.294 9.838
270 HB2 ALA 35 2HB ALA 35 19.562 -1.687 10.919
271 HB3 ALA 35 3HB ALA 35 21.100 -0.898 10.570
272 H PHE 36 H PHE 36 20.134 -1.877 6.461
273 HA PHE 36 HA PHE 36 22.757 -0.565 6.173
274 HD1 PHE 36 HD2 PHE 36 20.043 -2.520 3.300
275 HD2 PHE 36 HD1 PHE 36 22.584 -4.293 6.219
276 HE1 PHE 36 HE2 PHE 36 18.583 -4.499 3.364
277 HE2 PHE 36 HE1 PHE 36 21.128 -6.275 6.287
278 HZ PHE 36 HZ PHE 36 19.124 -6.379 4.859
279 HB2 PHE 36 2HB PHE 36 22.285 -1.673 3.708
280 HB3 PHE 36 3HB PHE 36 23.306 -2.380 4.956
281 H SER 37 H SER 37 22.842 0.495 3.853
282 HA SER 37 HA SER 37 20.816 2.523 3.868
283 HG SER 37 HG SER 37 21.855 4.481 3.001
284 HB2 SER 37 2HB SER 37 23.441 2.149 2.690
285 HB3 SER 37 3HB SER 37 22.307 2.824 1.521
286 H LEU 38 H LEU 38 19.381 3.048 2.176
287 HA LEU 38 HA LEU 38 18.809 0.838 0.313
288 HG LEU 38 HG LEU 38 15.830 0.331 2.453
289 HB2 LEU 38 2HB LEU 38 16.919 2.503 1.950
290 HB3 LEU 38 3HB LEU 38 16.390 1.619 0.520
291 HD11 LEU 38 1HD1 LEU 38 16.418 -1.565 1.459
292 HD12 LEU 38 2HD1 LEU 38 18.121 -1.312 1.838
293 HD13 LEU 38 3HD1 LEU 38 17.428 -0.605 0.378
294 HD21 LEU 38 3HD2 LEU 38 17.138 -0.001 4.274
295 HD22 LEU 38 1HD2 LEU 38 17.860 1.511 3.723
296 HD23 LEU 38 2HD2 LEU 38 18.633 -0.027 3.336
297 H HIS 39 H HIS 39 19.370 1.539 -1.644
298 HA HIS 39 HA HIS 39 18.495 4.234 -2.452
299 HD1 HIS 39 HD1 HIS 39 20.739 2.535 -5.627
300 HD2 HIS 39 HD2 HIS 39 22.331 1.680 -1.887
301 HE1 HIS 39 HE1 HIS 39 22.225 0.536 -5.970
302 HB2 HIS 39 2HB HIS 39 20.460 4.438 -3.852
303 HB3 HIS 39 3HB HIS 39 20.964 4.070 -2.205
304 H THR 40 H THR 40 17.665 4.476 -4.523
305 HA THR 40 HA THR 40 17.188 1.983 -6.019
306 HB THR 40 HB THR 40 15.120 2.594 -4.891
307 HG1 THR 40 HG1 THR 40 13.821 2.723 -6.774
308 HG21 THR 40 3HG2 THR 40 14.119 4.677 -4.964
309 HG22 THR 40 1HG2 THR 40 14.962 5.148 -6.439
310 HG23 THR 40 2HG2 THR 40 15.827 5.111 -4.902
311 H GLN 41 H GLN 41 16.980 2.186 -8.289
312 HA GLN 41 HA GLN 41 17.588 2.960 -10.339
313 HB2 GLN 41 2HB GLN 41 16.044 4.976 -9.134
314 HB3 GLN 41 3HB GLN 41 17.410 5.802 -9.872
315 HG2 GLN 41 2HG GLN 41 16.861 4.476 -11.976
316 HG3 GLN 41 3HG GLN 41 15.333 4.089 -11.187
317 HE21 GLN 41 1HE2 GLN 41 14.248 6.114 -10.218
318 HE22 GLN 41 2HE2 GLN 41 14.171 7.483 -11.268
319 H GLY 42 H GLY 42 19.539 2.911 -8.003
320 HA2 GLY 42 2HA GLY 42 21.867 3.080 -8.061
321 HA3 GLY 42 3HA GLY 42 21.733 4.115 -9.475
322 H ARG 43 H ARG 43 19.597 5.505 -7.563
323 HA ARG 43 HA ARG 43 21.603 7.270 -6.326
324 HE ARG 43 HE ARG 43 18.360 8.710 -9.493
325 HB2 ARG 43 2HB ARG 43 20.104 9.091 -6.598
326 HB3 ARG 43 3HB ARG 43 20.105 8.221 -8.127
327 HG2 ARG 43 2HG ARG 43 17.998 7.171 -7.570
328 HG3 ARG 43 3HG ARG 43 18.010 7.943 -5.983
329 HD2 ARG 43 2HD ARG 43 16.548 9.134 -7.530
330 HD3 ARG 43 3HD ARG 43 17.913 10.139 -7.044
331 HH11 ARG 43 1HH1 ARG 43 16.998 11.580 -8.069
332 HH12 ARG 43 2HH1 ARG 43 17.122 12.517 -9.520
333 HH21 ARG 43 1HH2 ARG 43 18.530 9.934 -11.411
334 HH22 ARG 43 2HH2 ARG 43 17.993 11.580 -11.421
335 H VAL 44 H VAL 44 21.258 8.052 -4.226
336 HA VAL 44 HA VAL 44 20.012 6.209 -2.450
337 HB VAL 44 HB VAL 44 21.061 8.976 -1.840
338 HG11 VAL 44 1HG1 VAL 44 19.910 6.828 -0.211
339 HG12 VAL 44 2HG1 VAL 44 21.443 7.462 0.390
340 HG13 VAL 44 3HG1 VAL 44 20.078 8.549 0.132
341 HG21 VAL 44 3HG2 VAL 44 22.404 6.329 -2.150
342 HG22 VAL 44 1HG2 VAL 44 22.936 7.930 -2.667
343 HG23 VAL 44 2HG2 VAL 44 23.022 7.478 -0.964
344 H LEU 45 H LEU 45 18.131 6.352 -1.312
345 HA LEU 45 HA LEU 45 16.152 8.218 -2.319
346 HG LEU 45 HG LEU 45 15.093 5.642 -3.107
347 HB2 LEU 45 2HB LEU 45 16.152 5.624 -1.021
348 HB3 LEU 45 3HB LEU 45 14.969 6.720 -0.310
349 HD11 LEU 45 1HD1 LEU 45 12.625 5.880 -1.478
350 HD12 LEU 45 2HD1 LEU 45 13.816 4.671 -0.998
351 HD13 LEU 45 3HD1 LEU 45 13.118 4.626 -2.617
352 HD21 LEU 45 3HD2 LEU 45 12.927 7.346 -3.038
353 HD22 LEU 45 1HD2 LEU 45 14.447 7.627 -3.887
354 HD23 LEU 45 2HD2 LEU 45 14.210 8.281 -2.266
355 H SER 46 H SER 46 15.315 9.914 -1.246
356 HA SER 46 HA SER 46 16.624 10.756 1.189
357 HG SER 46 HG SER 46 13.698 13.018 -0.324
358 HB2 SER 46 2HB SER 46 15.433 12.851 0.883
359 HB3 SER 46 3HB SER 46 16.126 12.350 -0.659
360 H GLU 47 H GLU 47 15.510 11.367 3.120
361 HA GLU 47 HA GLU 47 13.730 9.446 4.086
362 HB2 GLU 47 2HB GLU 47 14.272 12.237 5.116
363 HB3 GLU 47 3HB GLU 47 13.414 10.989 6.009
364 HG2 GLU 47 2HG GLU 47 15.366 9.628 6.131
365 HG3 GLU 47 3HG GLU 47 16.238 10.689 5.026
366 H ALA 48 H ALA 48 13.160 12.407 2.377
367 HA ALA 48 HA ALA 48 10.269 12.177 2.868
368 HB1 ALA 48 1HB ALA 48 10.179 14.397 2.941
369 HB2 ALA 48 2HB ALA 48 11.943 14.397 2.926
370 HB3 ALA 48 3HB ALA 48 11.048 14.546 1.413
371 H ALA 49 H ALA 49 12.379 10.985 0.780
372 HA ALA 49 HA ALA 49 11.519 11.735 -1.775
373 HB1 ALA 49 1HB ALA 49 13.462 10.122 -0.857
374 HB2 ALA 49 2HB ALA 49 12.301 8.915 -1.410
375 HB3 ALA 49 3HB ALA 49 12.912 10.129 -2.533
376 H GLU 50 H GLU 50 9.980 10.931 -3.174
377 HA GLU 50 HA GLU 50 7.908 9.240 -1.936
378 HB2 GLU 50 2HB GLU 50 6.615 11.038 -2.356
379 HB3 GLU 50 3HB GLU 50 7.770 11.721 -3.492
380 HG2 GLU 50 2HG GLU 50 6.919 10.444 -5.281
381 HG3 GLU 50 3HG GLU 50 5.987 9.413 -4.197
382 H LEU 51 H LEU 51 7.552 7.319 -2.825
383 HA LEU 51 HA LEU 51 8.693 6.775 -5.478
384 HG LEU 51 HG LEU 51 10.395 4.344 -3.268
385 HB2 LEU 51 2HB LEU 51 7.861 4.809 -3.351
386 HB3 LEU 51 3HB LEU 51 8.713 4.442 -4.850
387 HD11 LEU 51 1HD1 LEU 51 10.585 6.227 -5.153
388 HD12 LEU 51 2HD1 LEU 51 11.874 5.890 -3.998
389 HD13 LEU 51 3HD1 LEU 51 10.773 7.240 -3.721
390 HD21 LEU 51 3HD2 LEU 51 9.935 6.891 -1.889
391 HD22 LEU 51 1HD2 LEU 51 10.360 5.306 -1.241
392 HD23 LEU 51 2HD2 LEU 51 8.681 5.677 -1.632
393 H ASN 52 H ASN 52 7.369 4.559 -6.249
394 HA ASN 52 HA ASN 52 4.523 5.297 -6.272
395 HB2 ASN 52 2HB ASN 52 6.181 5.734 -8.413
396 HB3 ASN 52 3HB ASN 52 5.517 4.146 -8.785
397 HD21 ASN 52 1HD2 ASN 52 5.127 6.992 -9.816
398 HD22 ASN 52 2HD2 ASN 52 3.409 7.163 -9.890
399 H ASP 53 H ASP 53 3.076 3.548 -6.831
400 HA ASP 53 HA ASP 53 3.443 1.227 -5.430
401 HB2 ASP 53 2HB ASP 53 1.319 2.148 -6.571
402 HB3 ASP 53 3HB ASP 53 1.849 1.236 -7.983
403 H LYS 54 H LYS 54 4.256 -0.787 -5.799
404 HA LYS 54 HA LYS 54 5.543 -2.425 -6.715
405 HB2 LYS 54 2HB LYS 54 3.744 -1.937 -8.604
406 HB3 LYS 54 3HB LYS 54 5.158 -1.356 -9.473
407 HG2 LYS 54 2HG LYS 54 5.859 -3.843 -8.352
408 HG3 LYS 54 3HG LYS 54 4.262 -4.033 -9.079
409 HD2 LYS 54 2HD LYS 54 6.642 -2.825 -10.485
410 HD3 LYS 54 3HD LYS 54 6.145 -4.512 -10.637
411 HE2 LYS 54 2HE LYS 54 3.828 -3.048 -11.110
412 HE3 LYS 54 3HE LYS 54 5.097 -2.145 -11.935
413 HZ1 LYS 54 3HZ LYS 54 4.114 -4.857 -12.449
414 HZ2 LYS 54 1HZ LYS 54 5.739 -4.519 -12.778
415 HZ3 LYS 54 2HZ LYS 54 4.518 -3.632 -13.543
416 H MET 55 H MET 55 6.933 -0.310 -5.742
417 HA MET 55 HA MET 55 8.851 0.591 -7.720
418 HB2 MET 55 2HB MET 55 9.896 1.763 -5.778
419 HB3 MET 55 3HB MET 55 8.211 2.189 -6.046
420 HG2 MET 55 2HG MET 55 8.214 0.014 -4.265
421 HG3 MET 55 3HG MET 55 9.458 1.132 -3.708
422 HE1 MET 55 3HE MET 55 9.071 2.239 -2.019
423 HE2 MET 55 1HE MET 55 7.907 3.545 -1.802
424 HE3 MET 55 2HE MET 55 7.529 1.923 -1.223
425 H VAL 56 H VAL 56 11.250 0.554 -6.756
426 HA VAL 56 HA VAL 56 11.854 -2.114 -5.707
427 HB VAL 56 HB VAL 56 13.121 -0.966 -8.199
428 HG11 VAL 56 1HG1 VAL 56 14.756 -2.133 -6.829
429 HG12 VAL 56 2HG1 VAL 56 13.691 -3.536 -6.725
430 HG13 VAL 56 3HG1 VAL 56 14.385 -3.068 -8.277
431 HG21 VAL 56 3HG2 VAL 56 10.813 -1.979 -8.405
432 HG22 VAL 56 1HG2 VAL 56 12.067 -2.707 -9.409
433 HG23 VAL 56 2HG2 VAL 56 11.541 -3.514 -7.932
434 H ILE 57 H ILE 57 13.295 -2.004 -4.120
435 HA ILE 57 HA ILE 57 15.089 0.333 -4.016
436 HB ILE 57 HB ILE 57 13.616 -1.079 -1.815
437 HG12 ILE 57 2HG1 ILE 57 12.628 0.928 -2.898
438 HG13 ILE 57 3HG1 ILE 57 12.970 1.175 -1.189
439 HG21 ILE 57 1HG2 ILE 57 15.045 0.283 -0.235
440 HG22 ILE 57 2HG2 ILE 57 15.827 -1.109 -0.983
441 HG23 ILE 57 3HG2 ILE 57 16.155 0.515 -1.586
442 HD11 ILE 57 3HD1 ILE 57 13.695 2.834 -3.254
443 HD12 ILE 57 1HD1 ILE 57 14.351 2.859 -1.617
444 HD13 ILE 57 2HD1 ILE 57 15.184 1.963 -2.888
445 H ASP 58 H ASP 58 17.223 -0.002 -3.628
446 HA ASP 58 HA ASP 58 18.102 -2.806 -3.511
447 HB2 ASP 58 2HB ASP 58 18.777 -1.041 -5.385
448 HB3 ASP 58 3HB ASP 58 19.997 -0.607 -4.190
449 H ALA 59 H ALA 59 18.770 -3.489 -1.596
450 HA ALA 59 HA ALA 59 19.533 -1.609 0.469
451 HB1 ALA 59 1HB ALA 59 18.347 -4.140 0.442
452 HB2 ALA 59 2HB ALA 59 19.919 -4.361 1.210
453 HB3 ALA 59 3HB ALA 59 18.783 -3.175 1.852
454 H PHE 60 H PHE 60 21.540 -0.834 0.461
455 HA PHE 60 HA PHE 60 23.744 -2.620 -0.316
456 HD1 PHE 60 HD2 PHE 60 26.550 -1.288 -0.401
457 HD2 PHE 60 HD1 PHE 60 23.890 1.905 0.518
458 HE1 PHE 60 HE2 PHE 60 28.393 -0.067 0.677
459 HE2 PHE 60 HE1 PHE 60 25.729 3.132 1.596
460 HZ PHE 60 HZ PHE 60 27.985 2.146 1.678
461 HB2 PHE 60 2HB PHE 60 24.330 -0.892 -1.621
462 HB3 PHE 60 3HB PHE 60 23.164 0.175 -0.844
463 H VAL 61 H VAL 61 25.045 -3.351 1.222
464 HA VAL 61 HA VAL 61 24.927 -2.128 3.879
465 HB VAL 61 HB VAL 61 25.859 -4.147 4.747
466 HG11 VAL 61 1HG1 VAL 61 24.176 -5.583 2.887
467 HG12 VAL 61 2HG1 VAL 61 23.920 -5.231 4.597
468 HG13 VAL 61 3HG1 VAL 61 23.444 -4.054 3.372
469 HG21 VAL 61 3HG2 VAL 61 26.901 -4.424 2.070
470 HG22 VAL 61 1HG2 VAL 61 27.415 -5.210 3.563
471 HG23 VAL 61 2HG2 VAL 61 26.113 -5.910 2.600
472 HA PRO 62 HA PRO 62 28.926 -0.328 3.638
473 HB2 PRO 62 2HB PRO 62 29.727 -0.529 6.224
474 HB3 PRO 62 3HB PRO 62 28.487 0.611 5.688
475 HG2 PRO 62 2HG PRO 62 28.165 -2.065 6.991
476 HG3 PRO 62 3HG PRO 62 27.294 -0.553 7.310
477 HD2 PRO 62 2HD PRO 62 26.248 -2.547 5.806
478 HD3 PRO 62 3HD PRO 62 25.888 -0.835 5.505
479 H ALA 63 H ALA 63 30.964 -0.948 3.167
480 HA ALA 63 HA ALA 63 31.645 -3.665 2.990
481 HB1 ALA 63 1HB ALA 63 34.037 -2.612 2.714
482 HB2 ALA 63 2HB ALA 63 32.801 -2.394 1.474
483 HB3 ALA 63 3HB ALA 63 33.124 -1.105 2.633
484 H ASP 64 H ASP 64 33.306 -4.849 4.074
485 HA ASP 64 HA ASP 64 33.241 -4.517 6.911
486 HB2 ASP 64 2HB ASP 64 35.079 -6.378 5.414
487 HB3 ASP 64 3HB ASP 64 34.409 -6.573 7.032
488 H GLY 65 H GLY 65 34.556 -3.341 8.134
489 HA2 GLY 65 2HA GLY 65 36.685 -2.635 8.893
490 HA3 GLY 65 3HA GLY 65 37.328 -2.928 7.283
491 H ALA 66 H ALA 66 37.056 -0.549 9.304
492 HA ALA 66 HA ALA 66 36.537 1.429 7.199
493 HB1 ALA 66 1HB ALA 66 34.510 1.199 8.624
494 HB2 ALA 66 2HB ALA 66 35.477 1.719 10.005
495 HB3 ALA 66 3HB ALA 66 35.221 2.813 8.646
496 H GLY 67 H GLY 67 38.887 0.230 8.776
497 HA2 GLY 67 2HA GLY 67 40.996 1.165 9.140
498 HA3 GLY 67 3HA GLY 67 40.267 2.764 9.108
499 H LEU 68 H LEU 68 39.722 -0.129 11.116
500 HA LEU 68 HA LEU 68 39.266 1.354 13.471
501 HG LEU 68 HG LEU 68 37.461 -0.012 13.946
502 HB2 LEU 68 2HB LEU 68 39.278 -1.386 12.668
503 HB3 LEU 68 3HB LEU 68 40.185 -1.225 14.171
504 HD11 LEU 68 1HD1 LEU 68 37.043 -2.223 13.177
505 HD12 LEU 68 2HD1 LEU 68 36.567 -2.159 14.874
506 HD13 LEU 68 3HD1 LEU 68 38.091 -2.919 14.414
507 HD21 LEU 68 3HD2 LEU 68 39.417 -0.232 15.943
508 HD22 LEU 68 1HD2 LEU 68 38.124 -1.339 16.404
509 HD23 LEU 68 2HD2 LEU 68 37.765 0.363 16.113
510 H GLU 69 H GLU 69 41.963 -0.912 12.920
511 HA GLU 69 HA GLU 69 43.576 0.491 14.865
512 HB2 GLU 69 2HB GLU 69 44.294 -1.853 13.095
513 HB3 GLU 69 3HB GLU 69 45.220 -1.273 14.472
514 HG2 GLU 69 2HG GLU 69 42.512 -2.572 14.498
515 HG3 GLU 69 3HG GLU 69 44.018 -3.196 15.167
Start of MODEL 7
1 HA MET 1 HA MET 1 1.926 -0.002 -3.228
2 H1 MET 1 H MET 1 1.323 0.049 -0.344
3 HB2 MET 1 2HB MET 1 3.043 1.793 -1.078
4 HB3 MET 1 3HB MET 1 3.843 1.567 -2.628
5 HG2 MET 1 2HG MET 1 1.460 2.210 -3.555
6 HG3 MET 1 3HG MET 1 1.320 2.985 -1.979
7 HE1 MET 1 3HE MET 1 5.022 4.233 -2.161
8 HE2 MET 1 1HE MET 1 3.847 5.434 -1.624
9 HE3 MET 1 2HE MET 1 3.699 3.759 -1.094
10 H LEU 2 H LEU 2 3.405 -1.444 -3.848
11 HA LEU 2 HA LEU 2 4.699 -3.075 -1.827
12 HG LEU 2 HG LEU 2 5.876 -5.283 -3.084
13 HB2 LEU 2 2HB LEU 2 3.601 -3.669 -4.226
14 HB3 LEU 2 3HB LEU 2 5.301 -3.542 -4.672
15 HD11 LEU 2 1HD1 LEU 2 3.337 -6.329 -2.404
16 HD12 LEU 2 2HD1 LEU 2 3.352 -4.625 -1.953
17 HD13 LEU 2 3HD1 LEU 2 4.594 -5.712 -1.331
18 HD21 LEU 2 3HD2 LEU 2 4.575 -5.634 -5.457
19 HD22 LEU 2 1HD2 LEU 2 3.610 -6.622 -4.360
20 HD23 LEU 2 2HD2 LEU 2 5.341 -6.917 -4.519
21 H VAL 3 H VAL 3 6.979 -3.568 -1.893
22 HA VAL 3 HA VAL 3 8.671 -1.599 -3.246
23 HB VAL 3 HB VAL 3 9.871 -1.927 -0.740
24 HG11 VAL 3 1HG1 VAL 3 8.292 0.397 -1.838
25 HG12 VAL 3 2HG1 VAL 3 9.468 0.480 -0.525
26 HG13 VAL 3 3HG1 VAL 3 9.992 0.053 -2.155
27 HG21 VAL 3 3HG2 VAL 3 7.666 -2.719 0.079
28 HG22 VAL 3 1HG2 VAL 3 8.213 -1.237 0.863
29 HG23 VAL 3 2HG2 VAL 3 6.973 -1.167 -0.390
30 H ILE 4 H ILE 4 9.909 -2.870 -4.472
31 HA ILE 4 HA ILE 4 10.683 -5.516 -3.643
32 HB ILE 4 HB ILE 4 11.335 -3.869 -6.079
33 HG12 ILE 4 2HG1 ILE 4 9.051 -4.893 -5.814
34 HG13 ILE 4 3HG1 ILE 4 9.931 -5.428 -7.241
35 HG21 ILE 4 1HG2 ILE 4 13.279 -5.099 -5.928
36 HG22 ILE 4 2HG2 ILE 4 12.478 -6.469 -5.161
37 HG23 ILE 4 3HG2 ILE 4 12.255 -6.169 -6.884
38 HD11 ILE 4 3HD1 ILE 4 8.673 -7.053 -5.460
39 HD12 ILE 4 1HD1 ILE 4 9.956 -7.551 -6.562
40 HD13 ILE 4 2HD1 ILE 4 10.343 -7.116 -4.897
41 H VAL 5 H VAL 5 12.017 -5.362 -1.872
42 HA VAL 5 HA VAL 5 14.317 -3.610 -1.890
43 HB VAL 5 HB VAL 5 13.535 -5.753 0.092
44 HG11 VAL 5 1HG1 VAL 5 15.878 -4.034 -0.161
45 HG12 VAL 5 2HG1 VAL 5 15.083 -3.912 1.410
46 HG13 VAL 5 3HG1 VAL 5 15.632 -5.480 0.818
47 HG21 VAL 5 3HG2 VAL 5 13.070 -3.516 1.423
48 HG22 VAL 5 1HG2 VAL 5 12.821 -2.883 -0.204
49 HG23 VAL 5 2HG2 VAL 5 11.849 -4.236 0.375
50 H ARG 6 H ARG 6 16.138 -4.108 -2.900
51 HA ARG 6 HA ARG 6 16.735 -6.894 -3.528
52 HE ARG 6 HE ARG 6 15.016 -7.061 -7.449
53 HB2 ARG 6 2HB ARG 6 17.178 -4.397 -4.827
54 HB3 ARG 6 3HB ARG 6 18.746 -5.124 -4.502
55 HG2 ARG 6 2HG ARG 6 18.463 -6.317 -6.347
56 HG3 ARG 6 3HG ARG 6 17.210 -7.214 -5.487
57 HD2 ARG 6 2HD ARG 6 15.672 -5.252 -6.219
58 HD3 ARG 6 3HD ARG 6 16.932 -4.941 -7.412
59 HH11 ARG 6 1HH1 ARG 6 18.240 -6.159 -8.407
60 HH12 ARG 6 2HH1 ARG 6 18.302 -7.282 -9.725
61 HH21 ARG 6 1HH2 ARG 6 15.086 -8.542 -9.181
62 HH22 ARG 6 2HH2 ARG 6 16.508 -8.636 -10.165
63 H LEU 7 H LEU 7 17.910 -8.022 -2.135
64 HA LEU 7 HA LEU 7 19.579 -6.722 -0.175
65 HG LEU 7 HG LEU 7 21.108 -9.330 0.755
66 HB2 LEU 7 2HB LEU 7 18.187 -8.713 0.331
67 HB3 LEU 7 3HB LEU 7 19.222 -9.663 -0.733
68 HD11 LEU 7 1HD1 LEU 7 19.465 -7.207 1.779
69 HD12 LEU 7 2HD1 LEU 7 21.178 -7.529 2.046
70 HD13 LEU 7 3HD1 LEU 7 19.966 -8.284 3.082
71 HD21 LEU 7 3HD2 LEU 7 19.605 -11.216 1.173
72 HD22 LEU 7 1HD2 LEU 7 18.643 -10.209 2.255
73 HD23 LEU 7 2HD2 LEU 7 20.311 -10.606 2.670
74 H GLN 8 H GLN 8 21.826 -7.494 0.210
75 HA GLN 8 HA GLN 8 23.658 -6.808 -1.540
76 HB2 GLN 8 2HB GLN 8 23.855 -8.130 0.757
77 HB3 GLN 8 3HB GLN 8 24.215 -9.471 -0.323
78 HG2 GLN 8 2HG GLN 8 26.091 -8.311 -1.245
79 HG3 GLN 8 3HG GLN 8 25.673 -6.842 -0.364
80 HE21 GLN 8 1HE2 GLN 8 28.004 -7.194 0.240
81 HE22 GLN 8 2HE2 GLN 8 28.308 -8.122 1.666
82 H ASP 9 H ASP 9 22.478 -10.176 -1.518
83 HA ASP 9 HA ASP 9 22.797 -10.246 -4.427
84 HB2 ASP 9 2HB ASP 9 23.854 -12.437 -2.631
85 HB3 ASP 9 3HB ASP 9 23.980 -12.351 -4.386
86 H GLN 10 H GLN 10 20.426 -9.990 -2.980
87 HA GLN 10 HA GLN 10 19.025 -12.347 -3.898
88 HB2 GLN 10 2HB GLN 10 19.155 -11.589 -0.987
89 HB3 GLN 10 3HB GLN 10 17.813 -12.515 -1.645
90 HG2 GLN 10 2HG GLN 10 19.420 -14.223 -2.418
91 HG3 GLN 10 3HG GLN 10 20.714 -13.312 -1.640
92 HE21 GLN 10 1HE2 GLN 10 17.941 -15.336 -1.164
93 HE22 GLN 10 2HE2 GLN 10 18.199 -15.649 0.515
94 H THR 11 H THR 11 16.589 -12.066 -3.448
95 HA THR 11 HA THR 11 15.849 -9.221 -3.550
96 HB THR 11 HB THR 11 14.620 -11.298 -5.364
97 HG1 THR 11 HG1 THR 11 16.460 -9.287 -6.162
98 HG21 THR 11 3HG2 THR 11 13.656 -9.411 -6.507
99 HG22 THR 11 1HG2 THR 11 14.547 -8.282 -5.486
100 HG23 THR 11 2HG2 THR 11 13.271 -9.282 -4.791
101 H LEU 12 H LEU 12 14.029 -8.683 -2.464
102 HA LEU 12 HA LEU 12 12.059 -10.666 -1.741
103 HG LEU 12 HG LEU 12 12.721 -11.283 1.805
104 HB2 LEU 12 2HB LEU 12 14.164 -10.398 -0.030
105 HB3 LEU 12 3HB LEU 12 13.016 -9.238 0.636
106 HD11 LEU 12 1HD1 LEU 12 10.685 -10.036 0.441
107 HD12 LEU 12 2HD1 LEU 12 10.494 -11.213 1.739
108 HD13 LEU 12 3HD1 LEU 12 10.441 -11.740 0.057
109 HD21 LEU 12 3HD2 LEU 12 13.659 -12.514 -0.430
110 HD22 LEU 12 1HD2 LEU 12 11.947 -12.933 -0.493
111 HD23 LEU 12 2HD2 LEU 12 12.902 -13.343 0.932
112 HA PRO 13 HA PRO 13 9.857 -6.818 -2.356
113 HB2 PRO 13 2HB PRO 13 7.387 -7.943 -2.331
114 HB3 PRO 13 3HB PRO 13 8.456 -8.004 -3.737
115 HG2 PRO 13 2HG PRO 13 7.950 -10.090 -1.651
116 HG3 PRO 13 3HG PRO 13 8.089 -10.277 -3.409
117 HD2 PRO 13 2HD PRO 13 10.122 -10.858 -1.717
118 HD3 PRO 13 3HD PRO 13 10.393 -10.236 -3.357
119 H PHE 14 H PHE 14 8.255 -5.594 -1.163
120 HA PHE 14 HA PHE 14 7.726 -6.539 1.560
121 HD1 PHE 14 HD2 PHE 14 11.113 -5.975 1.026
122 HD2 PHE 14 HD1 PHE 14 8.590 -4.783 4.240
123 HE1 PHE 14 HE2 PHE 14 12.673 -7.002 2.627
124 HE2 PHE 14 HE1 PHE 14 10.147 -5.807 5.846
125 HZ PHE 14 HZ PHE 14 12.191 -6.919 5.041
126 HB2 PHE 14 2HB PHE 14 9.379 -4.215 0.769
127 HB3 PHE 14 3HB PHE 14 8.227 -3.930 2.069
128 H GLU 15 H GLU 15 5.873 -5.702 2.520
129 HA GLU 15 HA GLU 15 4.024 -4.417 0.644
130 HB2 GLU 15 2HB GLU 15 3.170 -6.466 1.539
131 HB3 GLU 15 3HB GLU 15 3.574 -5.986 3.181
132 HG2 GLU 15 2HG GLU 15 1.847 -4.383 3.245
133 HG3 GLU 15 3HG GLU 15 1.587 -4.487 1.505
134 H LEU 16 H LEU 16 3.936 -2.278 0.790
135 HA LEU 16 HA LEU 16 4.069 -1.048 3.465
136 HG LEU 16 HG LEU 16 7.154 0.143 1.825
137 HB2 LEU 16 2HB LEU 16 5.148 -0.203 0.818
138 HB3 LEU 16 3HB LEU 16 4.672 1.034 1.980
139 HD11 LEU 16 1HD1 LEU 16 5.745 0.661 4.440
140 HD12 LEU 16 2HD1 LEU 16 6.330 1.895 3.324
141 HD13 LEU 16 3HD1 LEU 16 7.474 0.826 4.135
142 HD21 LEU 16 3HD2 LEU 16 5.930 -1.740 3.836
143 HD22 LEU 16 1HD2 LEU 16 7.633 -1.608 3.397
144 HD23 LEU 16 2HD2 LEU 16 6.464 -2.210 2.222
145 HA PRO 17 HA PRO 17 0.094 0.728 2.930
146 HB2 PRO 17 2HB PRO 17 0.407 3.211 3.982
147 HB3 PRO 17 3HB PRO 17 0.373 1.746 4.970
148 HG2 PRO 17 2HG PRO 17 2.725 3.327 4.006
149 HG3 PRO 17 3HG PRO 17 2.434 2.616 5.605
150 HD2 PRO 17 2HD PRO 17 4.041 1.451 3.762
151 HD3 PRO 17 3HD PRO 17 3.084 0.512 4.925
152 H ALA 18 H ALA 18 -1.079 2.709 2.069
153 HA ALA 18 HA ALA 18 -0.165 3.240 -0.576
154 HB1 ALA 18 1HB ALA 18 -2.582 3.672 0.970
155 HB2 ALA 18 2HB ALA 18 -2.213 5.031 -0.093
156 HB3 ALA 18 3HB ALA 18 -2.378 3.408 -0.762
157 H GLY 19 H GLY 19 1.135 4.806 -1.270
158 HA2 GLY 19 2HA GLY 19 2.077 6.921 -1.438
159 HA3 GLY 19 3HA GLY 19 1.127 7.422 -0.047
160 H ALA 20 H ALA 20 2.766 4.559 0.584
161 HA ALA 20 HA ALA 20 4.260 5.474 2.690
162 HB1 ALA 20 1HB ALA 20 4.657 3.123 0.870
163 HB2 ALA 20 2HB ALA 20 5.739 3.434 2.229
164 HB3 ALA 20 3HB ALA 20 4.021 3.157 2.515
165 H ARG 21 H ARG 21 6.625 5.645 2.936
166 HA ARG 21 HA ARG 21 8.000 6.630 0.540
167 HE ARG 21 HE ARG 21 5.165 8.832 0.476
168 HB2 ARG 21 2HB ARG 21 7.208 8.193 2.880
169 HB3 ARG 21 3HB ARG 21 8.926 8.308 2.527
170 HG2 ARG 21 2HG ARG 21 8.563 9.658 0.806
171 HG3 ARG 21 3HG ARG 21 7.347 8.574 0.126
172 HD2 ARG 21 2HD ARG 21 6.466 10.032 2.508
173 HD3 ARG 21 3HD ARG 21 6.857 11.065 1.134
174 HH11 ARG 21 1HH1 ARG 21 5.270 12.124 1.602
175 HH12 ARG 21 2HH1 ARG 21 3.655 12.489 1.089
176 HH21 ARG 21 1HH2 ARG 21 3.038 9.299 -0.203
177 HH22 ARG 21 2HH2 ARG 21 2.387 10.880 0.063
178 H ALA 22 H ALA 22 10.396 7.243 1.343
179 HA ALA 22 HA ALA 22 11.706 4.864 1.854
180 HB1 ALA 22 1HB ALA 22 13.685 6.092 1.985
181 HB2 ALA 22 2HB ALA 22 12.635 7.089 0.977
182 HB3 ALA 22 3HB ALA 22 12.876 7.499 2.675
183 H SER 23 H SER 23 10.951 7.473 4.155
184 HA SER 23 HA SER 23 12.125 6.446 6.425
185 HG SER 23 HG SER 23 9.928 8.321 8.435
186 HB2 SER 23 2HB SER 23 11.269 8.553 6.791
187 HB3 SER 23 3HB SER 23 9.769 8.210 5.929
188 H GLN 24 H GLN 24 8.851 5.800 5.202
189 HA GLN 24 HA GLN 24 7.969 4.133 7.241
190 HB2 GLN 24 2HB GLN 24 6.952 5.016 4.839
191 HB3 GLN 24 3HB GLN 24 7.110 3.285 4.573
192 HG2 GLN 24 2HG GLN 24 5.214 2.972 5.657
193 HG3 GLN 24 3HG GLN 24 5.970 3.599 7.122
194 HE21 GLN 24 1HE2 GLN 24 6.268 6.202 6.679
195 HE22 GLN 24 2HE2 GLN 24 4.747 6.973 6.402
196 H LEU 25 H LEU 25 9.409 3.144 4.129
197 HA LEU 25 HA LEU 25 9.580 0.414 4.723
198 HG LEU 25 HG LEU 25 12.203 -0.279 3.022
199 HB2 LEU 25 2HB LEU 25 9.815 1.470 2.471
200 HB3 LEU 25 3HB LEU 25 11.435 1.982 2.940
201 HD11 LEU 25 1HD1 LEU 25 10.721 -2.174 2.529
202 HD12 LEU 25 2HD1 LEU 25 9.341 -1.078 2.511
203 HD13 LEU 25 3HD1 LEU 25 10.250 -1.327 4.002
204 HD21 LEU 25 3HD2 LEU 25 10.746 -0.701 0.565
205 HD22 LEU 25 1HD2 LEU 25 12.457 -0.354 0.815
206 HD23 LEU 25 2HD2 LEU 25 11.296 0.969 0.705
207 H SER 26 H SER 26 11.750 3.083 5.417
208 HA SER 26 HA SER 26 14.040 1.656 6.127
209 HG SER 26 HG SER 26 14.999 4.827 5.823
210 HB2 SER 26 2HB SER 26 13.018 4.361 6.505
211 HB3 SER 26 3HB SER 26 13.998 3.821 7.868
212 H ASN 27 H ASN 27 11.466 2.883 8.271
213 HA ASN 27 HA ASN 27 12.423 1.657 10.608
214 HB2 ASN 27 2HB ASN 27 9.700 2.656 9.792
215 HB3 ASN 27 3HB ASN 27 9.984 1.933 11.372
216 HD21 ASN 27 1HD2 ASN 27 9.501 4.754 10.095
217 HD22 ASN 27 2HD2 ASN 27 10.580 5.752 11.003
218 H LEU 28 H LEU 28 10.218 0.533 8.102
219 HA LEU 28 HA LEU 28 9.214 -1.746 9.339
220 HG LEU 28 HG LEU 28 7.301 -1.448 8.219
221 HB2 LEU 28 2HB LEU 28 9.357 -0.673 6.675
222 HB3 LEU 28 3HB LEU 28 9.612 -2.416 6.646
223 HD11 LEU 28 1HD1 LEU 28 6.109 -1.608 5.826
224 HD12 LEU 28 2HD1 LEU 28 7.650 -0.903 5.339
225 HD13 LEU 28 3HD1 LEU 28 6.648 -0.088 6.539
226 HD21 LEU 28 3HD2 LEU 28 6.273 -3.436 7.213
227 HD22 LEU 28 1HD2 LEU 28 7.794 -3.818 8.019
228 HD23 LEU 28 2HD2 LEU 28 7.734 -3.702 6.260
229 H LEU 29 H LEU 29 12.068 -1.471 7.222
230 HA LEU 29 HA LEU 29 12.878 -4.168 7.601
231 HG LEU 29 HG LEU 29 12.723 -3.818 5.283
232 HB2 LEU 29 2HB LEU 29 14.150 -1.718 6.457
233 HB3 LEU 29 3HB LEU 29 15.124 -3.159 6.742
234 HD11 LEU 29 1HD1 LEU 29 13.919 -2.589 3.196
235 HD12 LEU 29 2HD1 LEU 29 14.174 -1.395 4.468
236 HD13 LEU 29 3HD1 LEU 29 12.540 -1.931 4.077
237 HD21 LEU 29 3HD2 LEU 29 15.602 -3.942 4.411
238 HD22 LEU 29 1HD2 LEU 29 14.256 -4.937 3.856
239 HD23 LEU 29 2HD2 LEU 29 14.865 -5.116 5.502
240 H SER 30 H SER 30 13.865 -1.094 9.054
241 HA SER 30 HA SER 30 16.011 -1.985 10.575
242 HG SER 30 HG SER 30 15.253 0.866 12.765
243 HB2 SER 30 2HB SER 30 15.916 0.275 10.769
244 HB3 SER 30 3HB SER 30 14.156 0.310 10.669
245 H SER 31 H SER 31 12.563 -2.213 11.180
246 HA SER 31 HA SER 31 12.520 -2.854 13.866
247 HG SER 31 HG SER 31 9.811 -5.062 13.048
248 HB2 SER 31 2HB SER 31 10.458 -2.524 12.664
249 HB3 SER 31 3HB SER 31 10.792 -3.901 11.614
250 H SER 32 H SER 32 13.533 -4.786 11.153
251 HA SER 32 HA SER 32 13.518 -7.285 12.556
252 HG SER 32 HG SER 32 13.766 -9.040 10.695
253 HB2 SER 32 2HB SER 32 13.364 -6.992 10.036
254 HB3 SER 32 3HB SER 32 15.091 -6.635 10.059
255 H GLY 33 H GLY 33 15.912 -8.459 12.057
256 HA2 GLY 33 2HA GLY 33 17.554 -7.319 14.128
257 HA3 GLY 33 3HA GLY 33 17.872 -8.801 13.240
258 H MET 34 H MET 34 17.937 -7.872 10.639
259 HA MET 34 HA MET 34 20.562 -6.811 10.503
260 HB2 MET 34 2HB MET 34 18.590 -7.870 8.665
261 HB3 MET 34 3HB MET 34 19.396 -6.462 7.985
262 HG2 MET 34 2HG MET 34 21.071 -7.777 7.402
263 HG3 MET 34 3HG MET 34 21.428 -8.005 9.113
264 HE1 MET 34 3HE MET 34 21.222 -11.258 6.532
265 HE2 MET 34 1HE MET 34 21.919 -9.637 6.516
266 HE3 MET 34 2HE MET 34 22.400 -10.792 7.760
267 H ALA 35 H ALA 35 21.099 -4.867 9.131
268 HA ALA 35 HA ALA 35 19.212 -2.742 8.919
269 HB1 ALA 35 1HB ALA 35 19.696 -1.400 10.695
270 HB2 ALA 35 2HB ALA 35 19.952 -2.973 11.450
271 HB3 ALA 35 3HB ALA 35 21.331 -2.037 10.875
272 H PHE 36 H PHE 36 19.979 -2.524 6.839
273 HA PHE 36 HA PHE 36 22.717 -1.464 6.605
274 HD1 PHE 36 HD1 PHE 36 20.001 -2.626 3.494
275 HD2 PHE 36 HD2 PHE 36 21.858 -5.319 6.217
276 HE1 PHE 36 HE1 PHE 36 18.178 -4.239 3.136
277 HE2 PHE 36 HE2 PHE 36 20.038 -6.937 5.864
278 HZ PHE 36 HZ PHE 36 18.195 -6.398 4.321
279 HB2 PHE 36 2HB PHE 36 22.397 -2.427 4.143
280 HB3 PHE 36 3HB PHE 36 23.026 -3.421 5.453
281 H SER 37 H SER 37 22.915 -0.330 4.335
282 HA SER 37 HA SER 37 21.096 1.866 4.402
283 HG SER 37 HG SER 37 23.939 3.021 4.111
284 HB2 SER 37 2HB SER 37 23.619 1.219 3.100
285 HB3 SER 37 3HB SER 37 22.521 2.081 2.021
286 H LEU 38 H LEU 38 19.621 2.535 2.825
287 HA LEU 38 HA LEU 38 18.864 0.518 0.824
288 HG LEU 38 HG LEU 38 17.698 -0.920 2.050
289 HB2 LEU 38 2HB LEU 38 17.257 1.672 3.005
290 HB3 LEU 38 3HB LEU 38 16.468 1.616 1.429
291 HD11 LEU 38 1HD1 LEU 38 17.358 -0.261 4.371
292 HD12 LEU 38 2HD1 LEU 38 16.245 -1.548 3.910
293 HD13 LEU 38 3HD1 LEU 38 15.669 0.115 4.028
294 HD21 LEU 38 3HD2 LEU 38 16.064 -0.972 0.426
295 HD22 LEU 38 1HD2 LEU 38 15.008 0.139 1.299
296 HD23 LEU 38 2HD2 LEU 38 15.171 -1.531 1.841
297 H HIS 39 H HIS 39 19.588 1.583 -0.953
298 HA HIS 39 HA HIS 39 18.408 4.233 -1.471
299 HD1 HIS 39 HD1 HIS 39 20.473 1.442 -3.153
300 HD2 HIS 39 HD2 HIS 39 23.326 3.773 -1.231
301 HE1 HIS 39 HE1 HIS 39 22.560 0.041 -3.098
302 HB2 HIS 39 2HB HIS 39 20.464 4.596 -2.948
303 HB3 HIS 39 3HB HIS 39 20.716 4.660 -1.206
304 H THR 40 H THR 40 18.199 4.737 -3.814
305 HA THR 40 HA THR 40 17.678 2.309 -5.401
306 HB THR 40 HB THR 40 15.605 3.020 -6.085
307 HG1 THR 40 HG1 THR 40 15.127 5.082 -6.509
308 HG21 THR 40 3HG2 THR 40 15.915 2.950 -3.446
309 HG22 THR 40 1HG2 THR 40 14.374 3.370 -4.191
310 HG23 THR 40 2HG2 THR 40 15.443 4.642 -3.599
311 H GLN 41 H GLN 41 18.204 2.374 -7.552
312 HA GLN 41 HA GLN 41 19.414 2.989 -9.382
313 HB2 GLN 41 2HB GLN 41 17.428 4.908 -8.951
314 HB3 GLN 41 3HB GLN 41 18.883 5.836 -9.289
315 HG2 GLN 41 2HG GLN 41 19.170 4.311 -11.315
316 HG3 GLN 41 3HG GLN 41 17.500 3.827 -11.027
317 HE21 GLN 41 1HE2 GLN 41 19.531 6.069 -12.482
318 HE22 GLN 41 2HE2 GLN 41 18.342 7.241 -12.928
319 H GLY 42 H GLY 42 20.734 3.118 -6.769
320 HA2 GLY 42 2HA GLY 42 22.857 3.640 -6.044
321 HA3 GLY 42 3HA GLY 42 23.146 4.388 -7.608
322 H ARG 43 H ARG 43 20.487 5.358 -5.567
323 HA ARG 43 HA ARG 43 21.964 7.761 -4.753
324 HE ARG 43 HE ARG 43 20.374 9.271 -10.043
325 HB2 ARG 43 2HB ARG 43 19.255 7.696 -6.087
326 HB3 ARG 43 3HB ARG 43 19.904 9.107 -5.263
327 HG2 ARG 43 2HG ARG 43 21.741 9.222 -6.831
328 HG3 ARG 43 3HG ARG 43 21.185 7.746 -7.623
329 HD2 ARG 43 2HD ARG 43 19.073 8.892 -8.195
330 HD3 ARG 43 3HD ARG 43 19.707 10.370 -7.473
331 HH11 ARG 43 1HH1 ARG 43 21.442 11.323 -7.441
332 HH12 ARG 43 2HH1 ARG 43 22.520 12.244 -8.436
333 HH21 ARG 43 1HH2 ARG 43 21.791 10.476 -11.363
334 HH22 ARG 43 2HH2 ARG 43 22.717 11.762 -10.667
335 H VAL 44 H VAL 44 21.713 8.231 -2.666
336 HA VAL 44 HA VAL 44 20.405 6.604 -0.857
337 HB VAL 44 HB VAL 44 20.967 9.547 -0.469
338 HG11 VAL 44 1HG1 VAL 44 21.368 8.508 1.934
339 HG12 VAL 44 2HG1 VAL 44 19.766 9.021 1.398
340 HG13 VAL 44 3HG1 VAL 44 20.213 7.315 1.340
341 HG21 VAL 44 3HG2 VAL 44 22.736 7.131 -0.309
342 HG22 VAL 44 1HG2 VAL 44 23.023 8.667 -1.127
343 HG23 VAL 44 2HG2 VAL 44 23.082 8.581 0.634
344 H LEU 45 H LEU 45 18.473 6.741 0.293
345 HA LEU 45 HA LEU 45 16.346 8.189 -1.102
346 HG LEU 45 HG LEU 45 15.858 5.354 -1.814
347 HB2 LEU 45 2HB LEU 45 16.539 5.683 0.390
348 HB3 LEU 45 3HB LEU 45 15.113 6.638 0.789
349 HD11 LEU 45 1HD1 LEU 45 13.147 5.444 -0.577
350 HD12 LEU 45 2HD1 LEU 45 14.372 4.367 0.094
351 HD13 LEU 45 3HD1 LEU 45 13.883 4.204 -1.592
352 HD21 LEU 45 3HD2 LEU 45 13.611 6.705 -2.446
353 HD22 LEU 45 1HD2 LEU 45 15.238 7.266 -2.831
354 HD23 LEU 45 2HD2 LEU 45 14.408 7.884 -1.403
355 H SER 46 H SER 46 15.422 9.934 -0.257
356 HA SER 46 HA SER 46 16.280 10.931 2.297
357 HG SER 46 HG SER 46 13.986 12.465 -0.593
358 HB2 SER 46 2HB SER 46 14.958 12.898 1.762
359 HB3 SER 46 3HB SER 46 15.873 12.412 0.335
360 H GLU 47 H GLU 47 14.920 11.455 4.072
361 HA GLU 47 HA GLU 47 13.210 9.428 4.904
362 HB2 GLU 47 2HB GLU 47 13.153 12.285 5.884
363 HB3 GLU 47 3HB GLU 47 12.628 10.855 6.761
364 HG2 GLU 47 2HG GLU 47 15.020 10.042 6.584
365 HG3 GLU 47 3HG GLU 47 15.424 11.672 6.048
366 H ALA 48 H ALA 48 12.583 12.203 2.944
367 HA ALA 48 HA ALA 48 9.686 11.690 3.096
368 HB1 ALA 48 1HB ALA 48 10.116 14.079 1.692
369 HB2 ALA 48 2HB ALA 48 9.485 13.888 3.329
370 HB3 ALA 48 3HB ALA 48 11.215 14.118 3.072
371 H ALA 49 H ALA 49 12.112 10.624 1.367
372 HA ALA 49 HA ALA 49 11.530 11.267 -1.313
373 HB1 ALA 49 1HB ALA 49 13.198 9.844 -1.840
374 HB2 ALA 49 2HB ALA 49 13.523 9.921 -0.108
375 HB3 ALA 49 3HB ALA 49 12.600 8.574 -0.772
376 H GLU 50 H GLU 50 9.723 10.853 -2.389
377 HA GLU 50 HA GLU 50 8.245 8.383 -1.759
378 HB2 GLU 50 2HB GLU 50 6.616 9.858 -1.222
379 HB3 GLU 50 3HB GLU 50 7.356 11.163 -2.139
380 HG2 GLU 50 2HG GLU 50 6.362 10.464 -4.146
381 HG3 GLU 50 3HG GLU 50 5.924 8.893 -3.476
382 H LEU 51 H LEU 51 8.429 6.918 -3.308
383 HA LEU 51 HA LEU 51 9.086 7.734 -6.025
384 HG LEU 51 HG LEU 51 11.258 6.699 -5.680
385 HB2 LEU 51 2HB LEU 51 8.964 5.059 -4.655
386 HB3 LEU 51 3HB LEU 51 9.263 5.240 -6.382
387 HD11 LEU 51 1HD1 LEU 51 11.888 5.400 -3.306
388 HD12 LEU 51 2HD1 LEU 51 10.213 5.914 -3.105
389 HD13 LEU 51 3HD1 LEU 51 11.457 7.099 -3.504
390 HD21 LEU 51 3HD2 LEU 51 11.171 3.727 -5.193
391 HD22 LEU 51 1HD2 LEU 51 12.657 4.670 -5.299
392 HD23 LEU 51 2HD2 LEU 51 11.583 4.558 -6.694
393 H ASN 52 H ASN 52 7.163 4.905 -5.253
394 HA ASN 52 HA ASN 52 4.617 5.857 -5.840
395 HB2 ASN 52 2HB ASN 52 6.150 5.952 -8.126
396 HB3 ASN 52 3HB ASN 52 5.333 4.399 -8.280
397 HD21 ASN 52 1HD2 ASN 52 5.090 7.146 -9.580
398 HD22 ASN 52 2HD2 ASN 52 3.391 7.460 -9.548
399 H ASP 53 H ASP 53 3.236 3.912 -6.862
400 HA ASP 53 HA ASP 53 3.408 1.807 -4.994
401 HB2 ASP 53 2HB ASP 53 1.332 2.621 -6.216
402 HB3 ASP 53 3HB ASP 53 1.901 1.701 -7.606
403 H LYS 54 H LYS 54 3.653 -0.489 -5.470
404 HA LYS 54 HA LYS 54 5.184 -2.121 -6.022
405 HB2 LYS 54 2HB LYS 54 4.987 -2.775 -8.404
406 HB3 LYS 54 3HB LYS 54 3.428 -2.465 -7.651
407 HG2 LYS 54 2HG LYS 54 3.192 -0.396 -8.766
408 HG3 LYS 54 3HG LYS 54 4.879 -0.406 -9.288
409 HD2 LYS 54 2HD LYS 54 3.767 -2.791 -10.253
410 HD3 LYS 54 3HD LYS 54 2.562 -1.540 -10.566
411 HE2 LYS 54 2HE LYS 54 4.043 -0.284 -11.874
412 HE3 LYS 54 3HE LYS 54 5.455 -1.138 -11.253
413 HZ1 LYS 54 3HZ LYS 54 4.980 -3.005 -12.536
414 HZ2 LYS 54 1HZ LYS 54 4.657 -1.715 -13.582
415 HZ3 LYS 54 2HZ LYS 54 3.382 -2.533 -12.830
416 H MET 55 H MET 55 6.715 -0.062 -5.396
417 HA MET 55 HA MET 55 8.471 0.623 -7.605
418 HB2 MET 55 2HB MET 55 9.653 2.004 -5.955
419 HB3 MET 55 3HB MET 55 7.929 2.347 -5.964
420 HG2 MET 55 2HG MET 55 7.911 0.562 -4.029
421 HG3 MET 55 3HG MET 55 9.597 1.050 -3.881
422 HE1 MET 55 3HE MET 55 6.586 2.542 -1.483
423 HE2 MET 55 1HE MET 55 5.755 2.617 -3.038
424 HE3 MET 55 2HE MET 55 6.589 1.140 -2.555
425 H VAL 56 H VAL 56 10.945 0.646 -6.724
426 HA VAL 56 HA VAL 56 11.564 -1.965 -5.552
427 HB VAL 56 HB VAL 56 12.801 -1.006 -8.136
428 HG11 VAL 56 1HG1 VAL 56 14.386 -2.537 -7.841
429 HG12 VAL 56 2HG1 VAL 56 13.800 -2.737 -6.189
430 HG13 VAL 56 3HG1 VAL 56 13.195 -3.784 -7.474
431 HG21 VAL 56 3HG2 VAL 56 10.824 -1.767 -8.950
432 HG22 VAL 56 1HG2 VAL 56 11.643 -3.322 -8.800
433 HG23 VAL 56 2HG2 VAL 56 10.515 -2.794 -7.550
434 H ILE 57 H ILE 57 12.935 -1.647 -3.939
435 HA ILE 57 HA ILE 57 14.772 0.650 -4.076
436 HB ILE 57 HB ILE 57 14.044 -0.836 -1.563
437 HG12 ILE 57 2HG1 ILE 57 11.955 -0.030 -2.491
438 HG13 ILE 57 3HG1 ILE 57 12.409 0.989 -1.129
439 HG21 ILE 57 1HG2 ILE 57 15.003 1.991 -1.961
440 HG22 ILE 57 2HG2 ILE 57 14.850 1.114 -0.439
441 HG23 ILE 57 3HG2 ILE 57 16.066 0.626 -1.619
442 HD11 ILE 57 3HD1 ILE 57 13.264 2.668 -2.694
443 HD12 ILE 57 1HD1 ILE 57 12.756 1.653 -4.043
444 HD13 ILE 57 2HD1 ILE 57 11.552 2.328 -2.945
445 H ASP 58 H ASP 58 16.941 0.393 -3.629
446 HA ASP 58 HA ASP 58 17.909 -2.377 -3.728
447 HB2 ASP 58 2HB ASP 58 18.692 0.029 -5.066
448 HB3 ASP 58 3HB ASP 58 20.045 -0.544 -4.095
449 H ALA 59 H ALA 59 18.563 -3.230 -1.877
450 HA ALA 59 HA ALA 59 19.386 -1.478 0.313
451 HB1 ALA 59 1HB ALA 59 18.099 -2.911 1.435
452 HB2 ALA 59 2HB ALA 59 18.112 -4.082 0.116
453 HB3 ALA 59 3HB ALA 59 19.432 -4.056 1.285
454 H PHE 60 H PHE 60 21.463 -1.107 0.680
455 HA PHE 60 HA PHE 60 23.432 -3.096 -0.240
456 HD1 PHE 60 HD2 PHE 60 26.411 -2.150 -0.123
457 HD2 PHE 60 HD1 PHE 60 24.140 1.291 0.934
458 HE1 PHE 60 HE2 PHE 60 28.341 -1.262 1.118
459 HE2 PHE 60 HE1 PHE 60 26.067 2.186 2.176
460 HZ PHE 60 HZ PHE 60 28.170 0.908 2.271
461 HB2 PHE 60 2HB PHE 60 24.326 -1.391 -1.390
462 HB3 PHE 60 3HB PHE 60 23.273 -0.223 -0.597
463 H VAL 61 H VAL 61 24.582 -4.088 1.274
464 HA VAL 61 HA VAL 61 24.482 -3.072 4.016
465 HB VAL 61 HB VAL 61 25.114 -5.242 4.752
466 HG11 VAL 61 1HG1 VAL 61 23.440 -6.328 2.654
467 HG12 VAL 61 2HG1 VAL 61 23.101 -6.118 4.373
468 HG13 VAL 61 3HG1 VAL 61 22.828 -4.785 3.249
469 HG21 VAL 61 3HG2 VAL 61 26.276 -5.437 2.099
470 HG22 VAL 61 1HG2 VAL 61 26.677 -6.314 3.575
471 HG23 VAL 61 2HG2 VAL 61 25.368 -6.883 2.539
472 HA PRO 62 HA PRO 62 28.662 -1.724 4.082
473 HB2 PRO 62 2HB PRO 62 29.313 -2.222 6.670
474 HB3 PRO 62 3HB PRO 62 28.232 -0.909 6.187
475 HG2 PRO 62 2HG PRO 62 27.556 -3.628 7.243
476 HG3 PRO 62 3HG PRO 62 26.843 -2.058 7.657
477 HD2 PRO 62 2HD PRO 62 25.657 -3.793 5.950
478 HD3 PRO 62 3HD PRO 62 25.502 -2.032 5.783
479 H ALA 63 H ALA 63 30.648 -2.526 3.655
480 HA ALA 63 HA ALA 63 31.055 -5.411 4.079
481 HB1 ALA 63 1HB ALA 63 31.342 -3.798 1.774
482 HB2 ALA 63 2HB ALA 63 32.953 -4.341 2.246
483 HB3 ALA 63 3HB ALA 63 31.676 -5.521 1.953
484 H ASP 64 H ASP 64 33.410 -6.038 4.294
485 HA ASP 64 HA ASP 64 34.528 -4.598 6.509
486 HB2 ASP 64 2HB ASP 64 35.859 -6.854 5.014
487 HB3 ASP 64 3HB ASP 64 36.077 -6.386 6.698
488 H GLY 65 H GLY 65 35.836 -2.907 6.361
489 HA2 GLY 65 2HA GLY 65 37.758 -2.798 4.136
490 HA3 GLY 65 3HA GLY 65 36.717 -1.415 4.441
491 H ALA 66 H ALA 66 38.169 -3.465 6.908
492 HA ALA 66 HA ALA 66 39.505 -2.955 8.684
493 HB1 ALA 66 1HB ALA 66 41.095 -1.064 7.038
494 HB2 ALA 66 2HB ALA 66 41.628 -2.359 8.111
495 HB3 ALA 66 3HB ALA 66 41.000 -2.744 6.509
496 H GLY 67 H GLY 67 38.016 -1.830 9.955
497 HA2 GLY 67 2HA GLY 67 37.923 1.088 9.656
498 HA3 GLY 67 3HA GLY 67 36.826 0.116 10.626
499 H LEU 68 H LEU 68 40.348 0.675 10.466
500 HA LEU 68 HA LEU 68 40.769 0.247 13.220
501 HG LEU 68 HG LEU 68 42.674 -0.959 12.706
502 HB2 LEU 68 2HB LEU 68 42.327 0.918 10.922
503 HB3 LEU 68 3HB LEU 68 42.765 1.994 12.247
504 HD11 LEU 68 1HD1 LEU 68 44.875 0.567 11.333
505 HD12 LEU 68 2HD1 LEU 68 44.005 -0.847 10.739
506 HD13 LEU 68 3HD1 LEU 68 45.106 -1.001 12.108
507 HD21 LEU 68 3HD2 LEU 68 44.852 0.502 13.875
508 HD22 LEU 68 1HD2 LEU 68 43.551 -0.390 14.664
509 HD23 LEU 68 2HD2 LEU 68 43.321 1.303 14.229
510 H GLU 69 H GLU 69 41.197 3.342 11.502
511 HA GLU 69 HA GLU 69 41.189 4.980 13.724
512 HB2 GLU 69 2HB GLU 69 40.450 6.793 12.150
513 HB3 GLU 69 3HB GLU 69 41.850 5.876 11.613
514 HG2 GLU 69 2HG GLU 69 40.508 6.145 9.714
515 HG3 GLU 69 3HG GLU 69 40.248 4.484 10.242
Start of MODEL 8
1 HA MET 1 HA MET 1 1.727 -0.188 -2.910
2 H1 MET 1 H MET 1 1.812 -0.023 0.028
3 HB2 MET 1 2HB MET 1 3.440 1.417 -3.138
4 HB3 MET 1 3HB MET 1 2.315 2.109 -1.978
5 HG2 MET 1 2HG MET 1 3.750 1.608 -0.158
6 HG3 MET 1 3HG MET 1 4.795 0.619 -1.175
7 HE1 MET 1 3HE MET 1 4.274 5.121 -1.796
8 HE2 MET 1 1HE MET 1 3.770 4.024 -3.081
9 HE3 MET 1 2HE MET 1 3.018 3.921 -1.489
10 H LEU 2 H LEU 2 3.408 -1.334 -3.907
11 HA LEU 2 HA LEU 2 4.726 -3.256 -2.141
12 HG LEU 2 HG LEU 2 5.716 -5.378 -3.716
13 HB2 LEU 2 2HB LEU 2 3.341 -3.655 -4.412
14 HB3 LEU 2 3HB LEU 2 4.968 -3.510 -5.073
15 HD11 LEU 2 1HD1 LEU 2 4.669 -5.800 -1.805
16 HD12 LEU 2 2HD1 LEU 2 3.374 -6.534 -2.752
17 HD13 LEU 2 3HD1 LEU 2 3.272 -4.836 -2.284
18 HD21 LEU 2 3HD2 LEU 2 3.220 -6.494 -4.830
19 HD22 LEU 2 1HD2 LEU 2 4.899 -6.954 -5.113
20 HD23 LEU 2 2HD2 LEU 2 4.219 -5.551 -5.937
21 H VAL 3 H VAL 3 6.874 -3.335 -1.846
22 HA VAL 3 HA VAL 3 8.584 -1.676 -3.576
23 HB VAL 3 HB VAL 3 9.019 -1.925 -0.604
24 HG11 VAL 3 1HG1 VAL 3 10.077 0.443 -1.763
25 HG12 VAL 3 2HG1 VAL 3 10.944 -0.909 -1.034
26 HG13 VAL 3 3HG1 VAL 3 10.570 -0.927 -2.758
27 HG21 VAL 3 3HG2 VAL 3 7.588 0.256 -2.117
28 HG22 VAL 3 1HG2 VAL 3 6.908 -0.805 -0.883
29 HG23 VAL 3 2HG2 VAL 3 8.130 0.388 -0.444
30 H ILE 4 H ILE 4 10.115 -2.854 -4.499
31 HA ILE 4 HA ILE 4 10.796 -5.463 -3.390
32 HB ILE 4 HB ILE 4 11.361 -4.153 -6.038
33 HG12 ILE 4 2HG1 ILE 4 9.141 -5.292 -5.503
34 HG13 ILE 4 3HG1 ILE 4 9.980 -5.848 -6.947
35 HG21 ILE 4 1HG2 ILE 4 13.336 -5.256 -5.936
36 HG22 ILE 4 2HG2 ILE 4 12.758 -6.405 -4.730
37 HG23 ILE 4 3HG2 ILE 4 12.327 -6.616 -6.427
38 HD11 ILE 4 3HD1 ILE 4 8.966 -7.449 -4.999
39 HD12 ILE 4 1HD1 ILE 4 10.226 -7.912 -6.141
40 HD13 ILE 4 2HD1 ILE 4 10.663 -7.338 -4.532
41 H VAL 5 H VAL 5 12.187 -5.155 -1.712
42 HA VAL 5 HA VAL 5 14.456 -3.366 -1.987
43 HB VAL 5 HB VAL 5 13.629 -5.176 0.285
44 HG11 VAL 5 1HG1 VAL 5 15.368 -3.179 1.201
45 HG12 VAL 5 2HG1 VAL 5 15.680 -4.913 1.098
46 HG13 VAL 5 3HG1 VAL 5 16.123 -3.854 -0.242
47 HG21 VAL 5 3HG2 VAL 5 13.340 -2.763 1.306
48 HG22 VAL 5 1HG2 VAL 5 13.140 -2.319 -0.390
49 HG23 VAL 5 2HG2 VAL 5 12.061 -3.506 0.345
50 H ARG 6 H ARG 6 16.317 -3.981 -2.849
51 HA ARG 6 HA ARG 6 16.904 -6.832 -3.113
52 HE ARG 6 HE ARG 6 18.938 -4.989 -6.775
53 HB2 ARG 6 2HB ARG 6 18.513 -4.578 -4.294
54 HB3 ARG 6 3HB ARG 6 18.424 -6.251 -4.827
55 HG2 ARG 6 2HG ARG 6 15.813 -5.343 -5.013
56 HG3 ARG 6 3HG ARG 6 16.794 -3.984 -5.568
57 HD2 ARG 6 2HD ARG 6 16.725 -6.794 -6.639
58 HD3 ARG 6 3HD ARG 6 16.327 -5.297 -7.481
59 HH11 ARG 6 1HH1 ARG 6 17.150 -7.405 -8.532
60 HH12 ARG 6 2HH1 ARG 6 18.487 -7.846 -9.543
61 HH21 ARG 6 1HH2 ARG 6 20.705 -5.561 -8.100
62 HH22 ARG 6 2HH2 ARG 6 20.508 -6.797 -9.295
63 H LEU 7 H LEU 7 17.979 -7.702 -1.467
64 HA LEU 7 HA LEU 7 19.940 -6.090 -0.008
65 HG LEU 7 HG LEU 7 17.816 -7.533 2.638
66 HB2 LEU 7 2HB LEU 7 18.781 -8.800 0.626
67 HB3 LEU 7 3HB LEU 7 19.886 -7.890 1.654
68 HD11 LEU 7 1HD1 LEU 7 17.506 -5.252 2.530
69 HD12 LEU 7 2HD1 LEU 7 17.759 -5.191 0.786
70 HD13 LEU 7 3HD1 LEU 7 19.132 -5.426 1.868
71 HD21 LEU 7 3HD2 LEU 7 16.521 -6.883 0.009
72 HD22 LEU 7 1HD2 LEU 7 15.758 -7.283 1.548
73 HD23 LEU 7 2HD2 LEU 7 16.598 -8.533 0.630
74 H GLN 8 H GLN 8 22.083 -6.574 0.075
75 HA GLN 8 HA GLN 8 23.533 -7.536 -1.908
76 HB2 GLN 8 2HB GLN 8 24.208 -6.820 0.553
77 HB3 GLN 8 3HB GLN 8 24.386 -8.557 0.762
78 HG2 GLN 8 2HG GLN 8 26.514 -7.752 0.185
79 HG3 GLN 8 3HG GLN 8 25.881 -8.526 -1.267
80 HE21 GLN 8 1HE2 GLN 8 26.448 -7.450 -3.004
81 HE22 GLN 8 2HE2 GLN 8 26.503 -5.731 -3.172
82 H ASP 9 H ASP 9 22.305 -9.680 0.657
83 HA ASP 9 HA ASP 9 23.234 -12.079 -0.467
84 HB2 ASP 9 2HB ASP 9 22.242 -11.572 1.897
85 HB3 ASP 9 3HB ASP 9 20.703 -11.970 1.139
86 H GLN 10 H GLN 10 19.895 -10.815 -0.462
87 HA GLN 10 HA GLN 10 19.522 -11.654 -3.200
88 HB2 GLN 10 2HB GLN 10 17.371 -12.752 -1.555
89 HB3 GLN 10 3HB GLN 10 18.243 -13.478 -2.898
90 HG2 GLN 10 2HG GLN 10 20.070 -14.076 -1.409
91 HG3 GLN 10 3HG GLN 10 19.229 -13.316 -0.059
92 HE21 GLN 10 1HE2 GLN 10 19.652 -15.582 0.742
93 HE22 GLN 10 2HE2 GLN 10 18.408 -16.747 0.461
94 H THR 11 H THR 11 17.143 -11.235 -3.851
95 HA THR 11 HA THR 11 16.310 -8.710 -2.580
96 HB THR 11 HB THR 11 15.882 -9.617 -5.434
97 HG1 THR 11 HG1 THR 11 17.903 -8.883 -5.454
98 HG21 THR 11 3HG2 THR 11 15.165 -7.015 -4.078
99 HG22 THR 11 1HG2 THR 11 14.027 -8.244 -4.626
100 HG23 THR 11 2HG2 THR 11 14.999 -7.357 -5.800
101 H LEU 12 H LEU 12 14.306 -8.537 -1.772
102 HA LEU 12 HA LEU 12 12.263 -10.477 -2.566
103 HG LEU 12 HG LEU 12 12.905 -12.478 0.439
104 HB2 LEU 12 2HB LEU 12 13.321 -10.025 0.196
105 HB3 LEU 12 3HB LEU 12 11.649 -10.526 -0.044
106 HD11 LEU 12 1HD1 LEU 12 11.246 -12.595 -1.427
107 HD12 LEU 12 2HD1 LEU 12 12.505 -13.828 -1.484
108 HD13 LEU 12 3HD1 LEU 12 12.591 -12.430 -2.556
109 HD21 LEU 12 3HD2 LEU 12 15.056 -12.727 -0.058
110 HD22 LEU 12 1HD2 LEU 12 15.018 -11.113 -0.769
111 HD23 LEU 12 2HD2 LEU 12 14.740 -12.530 -1.783
112 HA PRO 13 HA PRO 13 9.572 -7.007 -2.531
113 HB2 PRO 13 2HB PRO 13 7.204 -8.210 -1.968
114 HB3 PRO 13 3HB PRO 13 8.014 -8.367 -3.532
115 HG2 PRO 13 2HG PRO 13 7.986 -10.262 -1.215
116 HG3 PRO 13 3HG PRO 13 7.825 -10.609 -2.946
117 HD2 PRO 13 2HD PRO 13 10.149 -10.956 -1.600
118 HD3 PRO 13 3HD PRO 13 10.098 -10.484 -3.311
119 H PHE 14 H PHE 14 8.116 -5.746 -1.183
120 HA PHE 14 HA PHE 14 8.021 -6.460 1.643
121 HD1 PHE 14 HD1 PHE 14 9.021 -5.295 3.993
122 HD2 PHE 14 HD2 PHE 14 11.656 -5.436 0.653
123 HE1 PHE 14 HE1 PHE 14 10.754 -6.319 5.407
124 HE2 PHE 14 HE2 PHE 14 13.392 -6.461 2.062
125 HZ PHE 14 HZ PHE 14 12.943 -6.905 4.442
126 HB2 PHE 14 2HB PHE 14 9.645 -4.268 0.488
127 HB3 PHE 14 3HB PHE 14 8.711 -3.865 1.925
128 H GLU 15 H GLU 15 6.048 -6.086 2.393
129 HA GLU 15 HA GLU 15 4.145 -4.599 0.835
130 HB2 GLU 15 2HB GLU 15 3.385 -6.599 1.931
131 HB3 GLU 15 3HB GLU 15 3.937 -6.013 3.494
132 HG2 GLU 15 2HG GLU 15 2.200 -4.492 3.684
133 HG3 GLU 15 3HG GLU 15 1.870 -4.503 1.952
134 H LEU 16 H LEU 16 3.914 -2.474 0.934
135 HA LEU 16 HA LEU 16 4.496 -1.111 3.482
136 HG LEU 16 HG LEU 16 7.234 0.022 1.296
137 HB2 LEU 16 2HB LEU 16 5.101 -0.388 0.656
138 HB3 LEU 16 3HB LEU 16 4.785 0.904 1.812
139 HD11 LEU 16 1HD1 LEU 16 6.270 1.793 2.959
140 HD12 LEU 16 2HD1 LEU 16 7.916 1.191 3.151
141 HD13 LEU 16 3HD1 LEU 16 6.622 0.554 4.165
142 HD21 LEU 16 3HD2 LEU 16 6.400 -1.687 3.635
143 HD22 LEU 16 1HD2 LEU 16 7.999 -1.591 2.895
144 HD23 LEU 16 2HD2 LEU 16 6.652 -2.293 1.998
145 HA PRO 17 HA PRO 17 0.444 0.571 3.550
146 HB2 PRO 17 2HB PRO 17 0.872 3.101 4.439
147 HB3 PRO 17 3HB PRO 17 1.036 1.678 5.475
148 HG2 PRO 17 2HG PRO 17 3.159 3.254 4.072
149 HG3 PRO 17 3HG PRO 17 3.153 2.606 5.722
150 HD2 PRO 17 2HD PRO 17 4.458 1.391 3.684
151 HD3 PRO 17 3HD PRO 17 3.728 0.485 5.026
152 H ALA 18 H ALA 18 -0.871 2.558 2.856
153 HA ALA 18 HA ALA 18 -0.582 2.912 0.075
154 HB1 ALA 18 1HB ALA 18 -2.231 4.974 1.026
155 HB2 ALA 18 2HB ALA 18 -2.724 3.418 0.356
156 HB3 ALA 18 3HB ALA 18 -2.496 3.597 2.096
157 H GLY 19 H GLY 19 0.355 4.467 -1.135
158 HA2 GLY 19 2HA GLY 19 1.794 6.183 -1.649
159 HA3 GLY 19 3HA GLY 19 0.874 7.093 -0.461
160 H ALA 20 H ALA 20 2.640 4.244 0.464
161 HA ALA 20 HA ALA 20 3.978 5.359 2.584
162 HB1 ALA 20 1HB ALA 20 3.912 2.870 1.355
163 HB2 ALA 20 2HB ALA 20 5.615 3.332 1.332
164 HB3 ALA 20 3HB ALA 20 4.734 3.286 2.859
165 H ARG 21 H ARG 21 6.309 5.763 2.877
166 HA ARG 21 HA ARG 21 7.618 6.845 0.481
167 HE ARG 21 HE ARG 21 6.852 9.178 5.900
168 HB2 ARG 21 2HB ARG 21 8.431 8.737 2.029
169 HB3 ARG 21 3HB ARG 21 6.785 8.820 1.415
170 HG2 ARG 21 2HG ARG 21 5.976 7.879 3.547
171 HG3 ARG 21 3HG ARG 21 7.632 7.909 4.156
172 HD2 ARG 21 2HD ARG 21 7.555 10.418 3.493
173 HD3 ARG 21 3HD ARG 21 5.807 10.191 3.513
174 HH11 ARG 21 1HH1 ARG 21 6.449 12.226 4.266
175 HH12 ARG 21 2HH1 ARG 21 6.349 13.146 5.730
176 HH21 ARG 21 1HH2 ARG 21 6.723 10.379 7.835
177 HH22 ARG 21 2HH2 ARG 21 6.507 12.095 7.760
178 H ALA 22 H ALA 22 9.967 7.538 1.137
179 HA ALA 22 HA ALA 22 11.417 5.266 1.739
180 HB1 ALA 22 1HB ALA 22 12.184 7.493 0.702
181 HB2 ALA 22 2HB ALA 22 12.493 7.992 2.366
182 HB3 ALA 22 3HB ALA 22 13.329 6.591 1.695
183 H SER 23 H SER 23 9.961 7.571 3.890
184 HA SER 23 HA SER 23 11.471 7.029 6.208
185 HG SER 23 HG SER 23 9.951 8.708 8.169
186 HB2 SER 23 2HB SER 23 10.065 8.999 6.096
187 HB3 SER 23 3HB SER 23 8.622 8.004 5.899
188 H GLN 24 H GLN 24 8.186 5.901 5.383
189 HA GLN 24 HA GLN 24 7.903 4.065 7.436
190 HB2 GLN 24 2HB GLN 24 6.511 4.742 5.039
191 HB3 GLN 24 3HB GLN 24 6.631 2.990 5.130
192 HG2 GLN 24 2HG GLN 24 4.935 2.973 6.541
193 HG3 GLN 24 3HG GLN 24 5.909 3.878 7.698
194 HE21 GLN 24 1HE2 GLN 24 5.835 6.210 7.575
195 HE22 GLN 24 2HE2 GLN 24 4.394 6.987 7.022
196 H LEU 25 H LEU 25 9.111 3.496 4.138
197 HA LEU 25 HA LEU 25 9.595 0.771 4.345
198 HG LEU 25 HG LEU 25 12.117 0.423 2.555
199 HB2 LEU 25 2HB LEU 25 9.739 2.256 2.297
200 HB3 LEU 25 3HB LEU 25 11.359 2.688 2.841
201 HD11 LEU 25 1HD1 LEU 25 9.266 -0.218 1.813
202 HD12 LEU 25 2HD1 LEU 25 10.122 -0.760 3.256
203 HD13 LEU 25 3HD1 LEU 25 10.635 -1.320 1.664
204 HD21 LEU 25 3HD2 LEU 25 11.961 1.982 0.580
205 HD22 LEU 25 1HD2 LEU 25 10.492 1.121 0.120
206 HD23 LEU 25 2HD2 LEU 25 12.031 0.262 0.193
207 H SER 26 H SER 26 11.894 3.439 4.905
208 HA SER 26 HA SER 26 14.094 1.959 5.667
209 HG SER 26 HG SER 26 14.872 4.787 7.833
210 HB2 SER 26 2HB SER 26 14.320 4.323 5.348
211 HB3 SER 26 3HB SER 26 13.154 4.668 6.626
212 H ASN 27 H ASN 27 11.236 2.783 7.517
213 HA ASN 27 HA ASN 27 12.233 2.026 10.061
214 HB2 ASN 27 2HB ASN 27 10.213 3.463 9.659
215 HB3 ASN 27 3HB ASN 27 9.350 2.014 9.152
216 HD21 ASN 27 1HD2 ASN 27 11.165 3.396 11.846
217 HD22 ASN 27 2HD2 ASN 27 10.280 2.585 13.089
218 H LEU 28 H LEU 28 10.151 0.325 7.725
219 HA LEU 28 HA LEU 28 9.796 -2.043 9.101
220 HG LEU 28 HG LEU 28 7.600 -2.213 6.152
221 HB2 LEU 28 2HB LEU 28 9.906 -1.349 6.201
222 HB3 LEU 28 3HB LEU 28 9.795 -3.040 6.682
223 HD11 LEU 28 1HD1 LEU 28 8.285 -3.470 8.505
224 HD12 LEU 28 2HD1 LEU 28 6.661 -3.333 7.832
225 HD13 LEU 28 3HD1 LEU 28 7.219 -2.168 9.032
226 HD21 LEU 28 3HD2 LEU 28 8.203 -0.055 8.167
227 HD22 LEU 28 1HD2 LEU 28 6.597 -0.384 7.517
228 HD23 LEU 28 2HD2 LEU 28 7.892 0.144 6.442
229 H LEU 29 H LEU 29 12.383 -1.250 6.787
230 HA LEU 29 HA LEU 29 13.765 -3.702 7.101
231 HG LEU 29 HG LEU 29 13.217 -3.067 4.783
232 HB2 LEU 29 2HB LEU 29 14.582 -1.005 6.058
233 HB3 LEU 29 3HB LEU 29 15.696 -2.370 6.112
234 HD11 LEU 29 1HD1 LEU 29 14.526 -0.523 4.061
235 HD12 LEU 29 2HD1 LEU 29 12.866 -1.063 3.808
236 HD13 LEU 29 3HD1 LEU 29 14.147 -1.616 2.729
237 HD21 LEU 29 3HD2 LEU 29 15.580 -4.134 4.782
238 HD22 LEU 29 1HD2 LEU 29 15.933 -2.939 3.534
239 HD23 LEU 29 2HD2 LEU 29 14.641 -4.115 3.288
240 H SER 30 H SER 30 13.984 -0.580 8.708
241 HA SER 30 HA SER 30 16.381 -1.054 10.116
242 HG SER 30 HG SER 30 14.535 1.167 12.457
243 HB2 SER 30 2HB SER 30 15.777 1.186 10.115
244 HB3 SER 30 3HB SER 30 14.080 0.836 10.444
245 H SER 31 H SER 31 13.018 -1.803 10.814
246 HA SER 31 HA SER 31 13.454 -2.615 13.511
247 HG SER 31 HG SER 31 10.404 -3.632 11.145
248 HB2 SER 31 2HB SER 31 11.200 -3.034 13.581
249 HB3 SER 31 3HB SER 31 11.233 -1.998 12.154
250 H SER 32 H SER 32 13.705 -4.176 10.416
251 HA SER 32 HA SER 32 13.481 -6.850 11.094
252 HG SER 32 HG SER 32 15.037 -7.707 8.067
253 HB2 SER 32 2HB SER 32 13.756 -5.964 8.777
254 HB3 SER 32 3HB SER 32 15.463 -5.688 9.122
255 H GLY 33 H GLY 33 16.449 -4.870 11.056
256 HA2 GLY 33 2HA GLY 33 17.604 -5.570 13.381
257 HA3 GLY 33 3HA GLY 33 17.939 -6.976 12.381
258 H MET 34 H MET 34 18.866 -6.364 10.143
259 HA MET 34 HA MET 34 21.312 -4.997 10.599
260 HB2 MET 34 2HB MET 34 20.105 -5.844 7.960
261 HB3 MET 34 3HB MET 34 21.795 -5.459 8.260
262 HG2 MET 34 2HG MET 34 22.216 -7.539 8.871
263 HG3 MET 34 3HG MET 34 20.933 -7.491 10.079
264 HE1 MET 34 3HE MET 34 20.511 -10.523 9.210
265 HE2 MET 34 1HE MET 34 19.802 -9.283 10.246
266 HE3 MET 34 2HE MET 34 18.801 -10.116 9.057
267 H ALA 35 H ALA 35 22.117 -3.166 9.349
268 HA ALA 35 HA ALA 35 20.045 -1.332 8.382
269 HB1 ALA 35 1HB ALA 35 21.459 -1.047 10.850
270 HB2 ALA 35 2HB ALA 35 21.913 0.262 9.759
271 HB3 ALA 35 3HB ALA 35 20.216 -0.008 10.153
272 H PHE 36 H PHE 36 20.635 -1.160 6.303
273 HA PHE 36 HA PHE 36 23.412 -0.359 5.743
274 HD1 PHE 36 HD2 PHE 36 20.335 -1.646 3.026
275 HD2 PHE 36 HD1 PHE 36 22.324 -4.151 5.834
276 HE1 PHE 36 HE2 PHE 36 18.406 -3.174 3.023
277 HE2 PHE 36 HE1 PHE 36 20.399 -5.683 5.835
278 HZ PHE 36 HZ PHE 36 18.436 -5.195 4.430
279 HB2 PHE 36 2HB PHE 36 22.787 -1.520 3.417
280 HB3 PHE 36 3HB PHE 36 23.502 -2.417 4.753
281 H SER 37 H SER 37 23.471 0.519 3.342
282 HA SER 37 HA SER 37 21.813 2.848 3.344
283 HG SER 37 HG SER 37 23.232 3.812 0.340
284 HB2 SER 37 2HB SER 37 23.731 3.510 2.350
285 HB3 SER 37 3HB SER 37 24.145 1.870 1.853
286 H LEU 38 H LEU 38 19.937 3.185 2.341
287 HA LEU 38 HA LEU 38 19.007 1.147 0.430
288 HG LEU 38 HG LEU 38 16.342 0.689 2.932
289 HB2 LEU 38 2HB LEU 38 17.612 2.746 2.526
290 HB3 LEU 38 3HB LEU 38 16.713 2.223 1.103
291 HD11 LEU 38 1HD1 LEU 38 16.907 -1.376 1.839
292 HD12 LEU 38 2HD1 LEU 38 18.166 -0.579 0.896
293 HD13 LEU 38 3HD1 LEU 38 16.471 -0.180 0.618
294 HD21 LEU 38 3HD2 LEU 38 18.571 1.211 4.029
295 HD22 LEU 38 1HD2 LEU 38 19.278 0.043 2.914
296 HD23 LEU 38 2HD2 LEU 38 18.048 -0.473 4.067
297 H HIS 39 H HIS 39 19.571 1.995 -1.513
298 HA HIS 39 HA HIS 39 18.368 4.591 -2.203
299 HD1 HIS 39 HD1 HIS 39 22.814 3.686 -1.560
300 HD2 HIS 39 HD2 HIS 39 20.799 2.288 -4.913
301 HE1 HIS 39 HE1 HIS 39 24.244 1.833 -2.479
302 HB2 HIS 39 2HB HIS 39 20.317 5.028 -3.684
303 HB3 HIS 39 3HB HIS 39 20.751 4.964 -1.978
304 H THR 40 H THR 40 17.582 4.798 -4.310
305 HA THR 40 HA THR 40 17.072 2.237 -5.643
306 HB THR 40 HB THR 40 15.095 3.073 -6.430
307 HG1 THR 40 HG1 THR 40 15.270 4.830 -7.587
308 HG21 THR 40 3HG2 THR 40 13.960 4.032 -4.673
309 HG22 THR 40 1HG2 THR 40 15.267 5.155 -4.300
310 HG23 THR 40 2HG2 THR 40 15.406 3.456 -3.845
311 H GLN 41 H GLN 41 18.049 1.732 -7.488
312 HA GLN 41 HA GLN 41 19.412 1.873 -9.309
313 HB2 GLN 41 2HB GLN 41 17.235 3.583 -9.687
314 HB3 GLN 41 3HB GLN 41 18.635 4.523 -10.188
315 HG2 GLN 41 2HG GLN 41 19.283 2.484 -11.580
316 HG3 GLN 41 3HG GLN 41 17.638 1.922 -11.289
317 HE21 GLN 41 1HE2 GLN 41 18.848 2.599 -13.804
318 HE22 GLN 41 2HE2 GLN 41 17.924 3.895 -14.475
319 H GLY 42 H GLY 42 20.418 2.967 -6.786
320 HA2 GLY 42 2HA GLY 42 22.500 3.822 -6.210
321 HA3 GLY 42 3HA GLY 42 22.719 4.335 -7.877
322 H ARG 43 H ARG 43 19.854 5.211 -6.110
323 HA ARG 43 HA ARG 43 20.910 7.937 -5.763
324 HE ARG 43 HE ARG 43 17.375 10.257 -7.895
325 HB2 ARG 43 2HB ARG 43 18.227 7.121 -6.883
326 HB3 ARG 43 3HB ARG 43 18.604 8.757 -6.359
327 HG2 ARG 43 2HG ARG 43 20.518 8.706 -8.008
328 HG3 ARG 43 3HG ARG 43 19.807 7.219 -8.639
329 HD2 ARG 43 2HD ARG 43 19.113 9.202 -9.917
330 HD3 ARG 43 3HD ARG 43 17.749 8.384 -9.156
331 HH11 ARG 43 1HH1 ARG 43 20.561 10.436 -9.289
332 HH12 ARG 43 2HH1 ARG 43 20.834 12.069 -8.779
333 HH21 ARG 43 1HH2 ARG 43 17.723 12.408 -7.218
334 HH22 ARG 43 2HH2 ARG 43 19.220 13.189 -7.600
335 H VAL 44 H VAL 44 20.918 8.420 -3.677
336 HA VAL 44 HA VAL 44 19.714 6.993 -1.636
337 HB VAL 44 HB VAL 44 20.372 9.942 -1.586
338 HG11 VAL 44 1HG1 VAL 44 20.877 9.079 0.898
339 HG12 VAL 44 2HG1 VAL 44 19.308 9.719 0.402
340 HG13 VAL 44 3HG1 VAL 44 19.570 7.975 0.471
341 HG21 VAL 44 3HG2 VAL 44 22.052 7.561 -1.694
342 HG22 VAL 44 1HG2 VAL 44 22.466 9.255 -1.959
343 HG23 VAL 44 2HG2 VAL 44 22.413 8.606 -0.320
344 H LEU 45 H LEU 45 17.787 7.048 -0.595
345 HA LEU 45 HA LEU 45 15.627 8.486 -1.906
346 HG LEU 45 HG LEU 45 15.022 5.737 -2.417
347 HB2 LEU 45 2HB LEU 45 15.892 6.104 -0.250
348 HB3 LEU 45 3HB LEU 45 14.522 7.111 0.211
349 HD11 LEU 45 1HD1 LEU 45 13.874 4.678 -0.329
350 HD12 LEU 45 2HD1 LEU 45 13.167 4.468 -1.931
351 HD13 LEU 45 3HD1 LEU 45 12.501 5.668 -0.823
352 HD21 LEU 45 3HD2 LEU 45 13.989 7.398 -3.471
353 HD22 LEU 45 1HD2 LEU 45 13.698 8.250 -1.954
354 HD23 LEU 45 2HD2 LEU 45 12.548 7.037 -2.519
355 H SER 46 H SER 46 14.606 10.219 -1.107
356 HA SER 46 HA SER 46 15.686 11.528 1.210
357 HG SER 46 HG SER 46 12.456 13.028 -0.621
358 HB2 SER 46 2HB SER 46 14.113 13.331 0.663
359 HB3 SER 46 3HB SER 46 14.986 12.808 -0.777
360 H GLU 47 H GLU 47 14.542 12.125 3.096
361 HA GLU 47 HA GLU 47 13.060 10.113 4.308
362 HB2 GLU 47 2HB GLU 47 13.135 13.058 4.985
363 HB3 GLU 47 3HB GLU 47 12.515 11.797 6.042
364 HG2 GLU 47 2HG GLU 47 15.222 11.285 5.089
365 HG3 GLU 47 3HG GLU 47 15.071 12.765 6.034
366 H ALA 48 H ALA 48 12.033 12.735 2.281
367 HA ALA 48 HA ALA 48 9.214 12.106 2.837
368 HB1 ALA 48 1HB ALA 48 9.383 14.349 1.141
369 HB2 ALA 48 2HB ALA 48 8.915 14.303 2.842
370 HB3 ALA 48 3HB ALA 48 10.602 14.564 2.398
371 H ALA 49 H ALA 49 11.512 11.069 0.846
372 HA ALA 49 HA ALA 49 10.650 11.364 -1.762
373 HB1 ALA 49 1HB ALA 49 12.707 10.113 -0.742
374 HB2 ALA 49 2HB ALA 49 11.653 8.703 -0.860
375 HB3 ALA 49 3HB ALA 49 12.054 9.628 -2.307
376 H GLU 50 H GLU 50 8.842 10.834 -2.787
377 HA GLU 50 HA GLU 50 6.975 8.984 -1.512
378 HB2 GLU 50 2HB GLU 50 5.623 10.685 -2.121
379 HB3 GLU 50 3HB GLU 50 6.751 11.275 -3.333
380 HG2 GLU 50 2HG GLU 50 5.934 9.807 -4.969
381 HG3 GLU 50 3HG GLU 50 5.083 8.825 -3.779
382 H LEU 51 H LEU 51 6.918 6.933 -2.115
383 HA LEU 51 HA LEU 51 7.999 6.186 -4.737
384 HG LEU 51 HG LEU 51 9.915 4.109 -2.357
385 HB2 LEU 51 2HB LEU 51 7.373 4.462 -2.345
386 HB3 LEU 51 3HB LEU 51 8.139 3.922 -3.837
387 HD11 LEU 51 1HD1 LEU 51 10.162 6.898 -3.298
388 HD12 LEU 51 2HD1 LEU 51 9.913 5.664 -4.532
389 HD13 LEU 51 3HD1 LEU 51 11.288 5.547 -3.433
390 HD21 LEU 51 3HD2 LEU 51 9.051 6.825 -1.419
391 HD22 LEU 51 1HD2 LEU 51 10.183 5.700 -0.668
392 HD23 LEU 51 2HD2 LEU 51 8.455 5.349 -0.657
393 H ASN 52 H ASN 52 6.901 4.182 -5.708
394 HA ASN 52 HA ASN 52 3.980 4.542 -5.553
395 HB2 ASN 52 2HB ASN 52 5.563 5.017 -7.741
396 HB3 ASN 52 3HB ASN 52 5.037 3.361 -8.028
397 HD21 ASN 52 1HD2 ASN 52 4.383 6.109 -9.183
398 HD22 ASN 52 2HD2 ASN 52 2.656 6.126 -9.235
399 H ASP 53 H ASP 53 3.200 2.402 -7.097
400 HA ASP 53 HA ASP 53 3.666 0.211 -5.254
401 HB2 ASP 53 2HB ASP 53 1.399 0.962 -6.326
402 HB3 ASP 53 3HB ASP 53 1.939 -0.007 -7.695
403 H LYS 54 H LYS 54 4.596 -1.743 -5.745
404 HA LYS 54 HA LYS 54 5.958 -3.237 -6.787
405 HB2 LYS 54 2HB LYS 54 5.191 -1.946 -9.401
406 HB3 LYS 54 3HB LYS 54 5.712 -3.603 -9.125
407 HG2 LYS 54 2HG LYS 54 3.560 -3.696 -7.628
408 HG3 LYS 54 3HG LYS 54 3.062 -2.341 -8.643
409 HD2 LYS 54 2HD LYS 54 3.665 -3.807 -10.631
410 HD3 LYS 54 3HD LYS 54 3.757 -5.145 -9.483
411 HE2 LYS 54 2HE LYS 54 1.438 -4.731 -8.821
412 HE3 LYS 54 3HE LYS 54 1.348 -3.392 -9.963
413 HZ1 LYS 54 3HZ LYS 54 1.066 -4.777 -11.678
414 HZ2 LYS 54 1HZ LYS 54 0.640 -5.927 -10.512
415 HZ3 LYS 54 2HZ LYS 54 2.217 -5.886 -11.123
416 H MET 55 H MET 55 7.148 -0.956 -5.777
417 HA MET 55 HA MET 55 8.947 0.160 -7.733
418 HB2 MET 55 2HB MET 55 8.522 0.497 -4.792
419 HB3 MET 55 3HB MET 55 10.032 1.046 -5.506
420 HG2 MET 55 2HG MET 55 7.862 1.976 -7.101
421 HG3 MET 55 3HG MET 55 7.554 2.377 -5.413
422 HE1 MET 55 3HE MET 55 9.771 4.287 -8.481
423 HE2 MET 55 1HE MET 55 11.058 3.182 -7.998
424 HE3 MET 55 2HE MET 55 9.470 2.550 -8.431
425 H VAL 56 H VAL 56 11.370 0.211 -7.049
426 HA VAL 56 HA VAL 56 12.256 -2.392 -6.044
427 HB VAL 56 HB VAL 56 13.138 -1.237 -8.693
428 HG11 VAL 56 1HG1 VAL 56 14.083 -3.702 -7.233
429 HG12 VAL 56 2HG1 VAL 56 14.546 -3.240 -8.872
430 HG13 VAL 56 3HG1 VAL 56 15.013 -2.228 -7.504
431 HG21 VAL 56 3HG2 VAL 56 10.955 -2.352 -8.771
432 HG22 VAL 56 1HG2 VAL 56 12.182 -3.258 -9.657
433 HG23 VAL 56 2HG2 VAL 56 11.672 -3.797 -8.057
434 H ILE 57 H ILE 57 13.208 -1.530 -4.249
435 HA ILE 57 HA ILE 57 15.083 0.687 -4.551
436 HB ILE 57 HB ILE 57 14.390 -0.736 -1.987
437 HG12 ILE 57 2HG1 ILE 57 12.317 0.046 -3.067
438 HG13 ILE 57 3HG1 ILE 57 12.676 0.967 -1.611
439 HG21 ILE 57 1HG2 ILE 57 14.844 1.872 -1.386
440 HG22 ILE 57 2HG2 ILE 57 16.065 0.602 -1.320
441 HG23 ILE 57 3HG2 ILE 57 15.943 1.635 -2.745
442 HD11 ILE 57 3HD1 ILE 57 13.529 2.795 -2.955
443 HD12 ILE 57 1HD1 ILE 57 13.236 1.868 -4.426
444 HD13 ILE 57 2HD1 ILE 57 11.879 2.388 -3.426
445 H ASP 58 H ASP 58 17.255 0.527 -4.298
446 HA ASP 58 HA ASP 58 18.361 -2.181 -4.218
447 HB2 ASP 58 2HB ASP 58 18.932 0.012 -5.817
448 HB3 ASP 58 3HB ASP 58 20.268 -0.021 -4.670
449 H ALA 59 H ALA 59 18.937 -2.910 -2.286
450 HA ALA 59 HA ALA 59 19.816 -1.024 -0.228
451 HB1 ALA 59 1HB ALA 59 18.140 -3.196 -0.110
452 HB2 ALA 59 2HB ALA 59 19.649 -3.827 0.551
453 HB3 ALA 59 3HB ALA 59 18.899 -2.403 1.271
454 H PHE 60 H PHE 60 21.926 -0.611 -0.201
455 HA PHE 60 HA PHE 60 23.803 -2.780 -0.843
456 HD1 PHE 60 HD1 PHE 60 26.779 -2.003 -0.900
457 HD2 PHE 60 HD2 PHE 60 24.769 1.674 -0.153
458 HE1 PHE 60 HE1 PHE 60 28.806 -1.117 0.177
459 HE2 PHE 60 HE2 PHE 60 26.793 2.566 0.924
460 HZ PHE 60 HZ PHE 60 28.816 1.170 1.090
461 HB2 PHE 60 2HB PHE 60 24.695 -1.221 -2.191
462 HB3 PHE 60 3HB PHE 60 23.739 0.062 -1.456
463 H VAL 61 H VAL 61 24.895 -3.680 0.765
464 HA VAL 61 HA VAL 61 24.931 -2.359 3.375
465 HB VAL 61 HB VAL 61 25.469 -4.475 4.334
466 HG11 VAL 61 1HG1 VAL 61 23.620 -5.638 2.422
467 HG12 VAL 61 2HG1 VAL 61 23.391 -5.259 4.130
468 HG13 VAL 61 3HG1 VAL 61 23.146 -4.011 2.909
469 HG21 VAL 61 3HG2 VAL 61 26.526 -5.024 1.702
470 HG22 VAL 61 1HG2 VAL 61 26.864 -5.820 3.239
471 HG23 VAL 61 2HG2 VAL 61 25.490 -6.336 2.263
472 HA PRO 62 HA PRO 62 29.188 -1.286 3.209
473 HB2 PRO 62 2HB PRO 62 29.872 -1.530 5.824
474 HB3 PRO 62 3HB PRO 62 28.864 -0.213 5.214
475 HG2 PRO 62 2HG PRO 62 28.047 -2.745 6.586
476 HG3 PRO 62 3HG PRO 62 27.444 -1.096 6.831
477 HD2 PRO 62 2HD PRO 62 26.108 -2.931 5.355
478 HD3 PRO 62 3HD PRO 62 26.060 -1.194 4.991
479 H ALA 63 H ALA 63 31.091 -2.271 2.809
480 HA ALA 63 HA ALA 63 31.248 -5.136 3.075
481 HB1 ALA 63 1HB ALA 63 32.084 -4.241 1.048
482 HB2 ALA 63 2HB ALA 63 33.109 -3.085 1.900
483 HB3 ALA 63 3HB ALA 63 33.484 -4.807 1.960
484 H ASP 64 H ASP 64 33.240 -6.176 3.936
485 HA ASP 64 HA ASP 64 33.624 -5.499 6.641
486 HB2 ASP 64 2HB ASP 64 35.419 -7.255 4.957
487 HB3 ASP 64 3HB ASP 64 35.223 -7.301 6.707
488 H GLY 65 H GLY 65 34.878 -4.010 7.543
489 HA2 GLY 65 2HA GLY 65 36.808 -2.580 5.909
490 HA3 GLY 65 3HA GLY 65 36.300 -2.157 7.538
491 H ALA 66 H ALA 66 38.986 -2.183 6.552
492 HA ALA 66 HA ALA 66 40.129 -4.067 8.479
493 HB1 ALA 66 1HB ALA 66 41.577 -5.090 7.028
494 HB2 ALA 66 2HB ALA 66 40.178 -4.861 5.977
495 HB3 ALA 66 3HB ALA 66 41.545 -3.752 5.879
496 H GLY 67 H GLY 67 41.019 -2.709 9.909
497 HA2 GLY 67 2HA GLY 67 43.239 -1.475 10.071
498 HA3 GLY 67 3HA GLY 67 42.536 -0.400 8.873
499 H LEU 68 H LEU 68 41.272 -1.875 11.860
500 HA LEU 68 HA LEU 68 39.788 0.408 12.590
501 HG LEU 68 HG LEU 68 38.005 -0.969 13.121
502 HB2 LEU 68 2HB LEU 68 40.244 -2.227 13.594
503 HB3 LEU 68 3HB LEU 68 40.394 -1.073 14.917
504 HD11 LEU 68 1HD1 LEU 68 38.033 -3.273 13.696
505 HD12 LEU 68 2HD1 LEU 68 36.871 -2.487 14.765
506 HD13 LEU 68 3HD1 LEU 68 38.472 -2.918 15.367
507 HD21 LEU 68 3HD2 LEU 68 37.570 -0.603 15.936
508 HD22 LEU 68 1HD2 LEU 68 37.312 0.527 14.607
509 HD23 LEU 68 2HD2 LEU 68 38.892 0.427 15.384
510 H GLU 69 H GLU 69 42.527 -0.967 14.410
511 HA GLU 69 HA GLU 69 43.400 1.789 14.984
512 HB2 GLU 69 2HB GLU 69 43.740 -0.554 16.854
513 HB3 GLU 69 3HB GLU 69 44.024 1.147 17.199
514 HG2 GLU 69 2HG GLU 69 41.594 1.555 16.878
515 HG3 GLU 69 3HG GLU 69 41.372 -0.186 16.719
Start of MODEL 9
1 HA MET 1 HA MET 1 2.439 0.805 -3.653
2 H1 MET 1 H MET 1 1.253 0.165 -1.033
3 HB2 MET 1 2HB MET 1 3.240 1.844 -0.931
4 HB3 MET 1 3HB MET 1 4.204 2.056 -2.387
5 HG2 MET 1 2HG MET 1 1.361 2.968 -2.312
6 HG3 MET 1 3HG MET 1 2.639 3.954 -1.605
7 HE1 MET 1 3HE MET 1 0.588 3.070 -4.288
8 HE2 MET 1 1HE MET 1 0.732 4.793 -4.636
9 HE3 MET 1 2HE MET 1 1.311 3.606 -5.805
10 H LEU 2 H LEU 2 3.765 -0.721 -4.361
11 HA LEU 2 HA LEU 2 4.878 -2.636 -2.438
12 HG LEU 2 HG LEU 2 5.985 -4.804 -4.034
13 HB2 LEU 2 2HB LEU 2 3.500 -3.198 -4.614
14 HB3 LEU 2 3HB LEU 2 5.073 -3.011 -5.386
15 HD11 LEU 2 1HD1 LEU 2 3.701 -4.269 -2.402
16 HD12 LEU 2 2HD1 LEU 2 5.102 -5.284 -2.060
17 HD13 LEU 2 3HD1 LEU 2 3.698 -5.967 -2.881
18 HD21 LEU 2 3HD2 LEU 2 4.457 -5.145 -6.154
19 HD22 LEU 2 1HD2 LEU 2 3.411 -5.952 -4.986
20 HD23 LEU 2 2HD2 LEU 2 5.062 -6.521 -5.230
21 H VAL 3 H VAL 3 7.057 -3.079 -2.321
22 HA VAL 3 HA VAL 3 8.874 -1.534 -4.022
23 HB VAL 3 HB VAL 3 9.843 -1.620 -1.288
24 HG11 VAL 3 1HG1 VAL 3 9.275 0.808 -2.960
25 HG12 VAL 3 2HG1 VAL 3 10.538 0.570 -1.751
26 HG13 VAL 3 3HG1 VAL 3 10.634 -0.262 -3.304
27 HG21 VAL 3 3HG2 VAL 3 8.323 0.094 -0.388
28 HG22 VAL 3 1HG2 VAL 3 7.299 -0.085 -1.813
29 HG23 VAL 3 2HG2 VAL 3 7.497 -1.434 -0.693
30 H ILE 4 H ILE 4 10.035 -3.072 -4.983
31 HA ILE 4 HA ILE 4 10.575 -5.603 -3.743
32 HB ILE 4 HB ILE 4 11.441 -4.372 -6.349
33 HG12 ILE 4 2HG1 ILE 4 9.090 -5.251 -6.011
34 HG13 ILE 4 3HG1 ILE 4 9.982 -5.972 -7.346
35 HG21 ILE 4 1HG2 ILE 4 12.539 -6.711 -4.933
36 HG22 ILE 4 2HG2 ILE 4 12.154 -6.952 -6.636
37 HG23 ILE 4 3HG2 ILE 4 13.272 -5.675 -6.157
38 HD11 ILE 4 3HD1 ILE 4 8.621 -7.338 -5.420
39 HD12 ILE 4 1HD1 ILE 4 9.889 -8.007 -6.446
40 HD13 ILE 4 2HD1 ILE 4 10.282 -7.414 -4.832
41 H VAL 5 H VAL 5 11.840 -5.309 -1.942
42 HA VAL 5 HA VAL 5 14.266 -3.749 -2.052
43 HB VAL 5 HB VAL 5 13.202 -5.568 0.114
44 HG11 VAL 5 1HG1 VAL 5 15.782 -4.392 -0.231
45 HG12 VAL 5 2HG1 VAL 5 14.979 -3.638 1.148
46 HG13 VAL 5 3HG1 VAL 5 15.185 -5.389 1.095
47 HG21 VAL 5 3HG2 VAL 5 12.910 -2.656 -0.477
48 HG22 VAL 5 1HG2 VAL 5 11.703 -3.819 0.070
49 HG23 VAL 5 2HG2 VAL 5 12.912 -3.207 1.198
50 H ARG 6 H ARG 6 16.079 -4.486 -2.922
51 HA ARG 6 HA ARG 6 16.526 -7.377 -3.078
52 HE ARG 6 HE ARG 6 18.584 -5.602 -6.816
53 HB2 ARG 6 2HB ARG 6 17.961 -5.115 -4.480
54 HB3 ARG 6 3HB ARG 6 18.241 -6.830 -4.747
55 HG2 ARG 6 2HG ARG 6 15.543 -6.597 -5.161
56 HG3 ARG 6 3HG ARG 6 16.172 -5.081 -5.811
57 HD2 ARG 6 2HD ARG 6 16.889 -7.891 -6.603
58 HD3 ARG 6 3HD ARG 6 16.181 -6.623 -7.603
59 HH11 ARG 6 1HH1 ARG 6 17.563 -8.511 -8.433
60 HH12 ARG 6 2HH1 ARG 6 19.025 -8.671 -9.349
61 HH21 ARG 6 1HH2 ARG 6 20.513 -5.801 -8.016
62 HH22 ARG 6 2HH2 ARG 6 20.703 -7.130 -9.110
63 H LEU 7 H LEU 7 17.811 -8.306 -1.640
64 HA LEU 7 HA LEU 7 19.486 -6.722 0.093
65 HG LEU 7 HG LEU 7 19.022 -7.390 2.103
66 HB2 LEU 7 2HB LEU 7 18.380 -9.408 0.058
67 HB3 LEU 7 3HB LEU 7 20.061 -9.384 0.587
68 HD11 LEU 7 1HD1 LEU 7 16.753 -8.235 1.051
69 HD12 LEU 7 2HD1 LEU 7 16.858 -7.725 2.735
70 HD13 LEU 7 3HD1 LEU 7 16.886 -9.441 2.330
71 HD21 LEU 7 3HD2 LEU 7 19.060 -8.988 3.930
72 HD22 LEU 7 1HD2 LEU 7 20.424 -9.263 2.846
73 HD23 LEU 7 2HD2 LEU 7 19.021 -10.329 2.784
74 H GLN 8 H GLN 8 21.759 -7.447 0.541
75 HA GLN 8 HA GLN 8 23.553 -6.922 -1.303
76 HB2 GLN 8 2HB GLN 8 23.747 -9.248 0.614
77 HB3 GLN 8 3HB GLN 8 25.113 -8.607 -0.289
78 HG2 GLN 8 2HG GLN 8 24.446 -6.351 0.802
79 HG3 GLN 8 3HG GLN 8 23.579 -7.369 1.950
80 HE21 GLN 8 1HE2 GLN 8 24.841 -9.050 3.036
81 HE22 GLN 8 2HE2 GLN 8 26.495 -8.728 3.415
82 H ASP 9 H ASP 9 22.531 -10.317 -0.889
83 HA ASP 9 HA ASP 9 22.804 -10.672 -3.791
84 HB2 ASP 9 2HB ASP 9 24.736 -11.587 -2.163
85 HB3 ASP 9 3HB ASP 9 23.627 -12.953 -2.079
86 H GLN 10 H GLN 10 20.414 -10.232 -2.460
87 HA GLN 10 HA GLN 10 19.007 -12.677 -3.102
88 HB2 GLN 10 2HB GLN 10 19.028 -11.520 -0.319
89 HB3 GLN 10 3HB GLN 10 17.734 -12.562 -0.896
90 HG2 GLN 10 2HG GLN 10 19.434 -14.308 -1.372
91 HG3 GLN 10 3HG GLN 10 20.645 -13.269 -0.623
92 HE21 GLN 10 1HE2 GLN 10 18.550 -15.765 -0.106
93 HE22 GLN 10 2HE2 GLN 10 18.436 -15.687 1.616
94 H THR 11 H THR 11 16.570 -12.323 -2.807
95 HA THR 11 HA THR 11 15.855 -9.508 -3.262
96 HB THR 11 HB THR 11 14.874 -11.820 -4.948
97 HG1 THR 11 HG1 THR 11 16.391 -11.261 -6.321
98 HG21 THR 11 3HG2 THR 11 13.125 -10.491 -5.360
99 HG22 THR 11 1HG2 THR 11 14.247 -9.410 -6.184
100 HG23 THR 11 2HG2 THR 11 13.855 -9.146 -4.485
101 H LEU 12 H LEU 12 13.999 -8.859 -2.316
102 HA LEU 12 HA LEU 12 11.963 -10.744 -1.523
103 HG LEU 12 HG LEU 12 12.389 -10.959 2.131
104 HB2 LEU 12 2HB LEU 12 13.879 -10.614 0.261
105 HB3 LEU 12 3HB LEU 12 13.090 -9.099 0.697
106 HD11 LEU 12 1HD1 LEU 12 10.830 -9.031 1.081
107 HD12 LEU 12 2HD1 LEU 12 10.280 -10.188 2.293
108 HD13 LEU 12 3HD1 LEU 12 9.932 -10.466 0.587
109 HD21 LEU 12 3HD2 LEU 12 11.996 -12.978 1.304
110 HD22 LEU 12 1HD2 LEU 12 12.284 -12.366 -0.325
111 HD23 LEU 12 2HD2 LEU 12 10.655 -12.342 0.351
112 HA PRO 13 HA PRO 13 9.794 -6.980 -2.538
113 HB2 PRO 13 2HB PRO 13 7.305 -8.042 -2.324
114 HB3 PRO 13 3HB PRO 13 8.348 -8.314 -3.725
115 HG2 PRO 13 2HG PRO 13 7.842 -10.089 -1.368
116 HG3 PRO 13 3HG PRO 13 7.946 -10.513 -3.086
117 HD2 PRO 13 2HD PRO 13 9.998 -10.902 -1.363
118 HD3 PRO 13 3HD PRO 13 10.251 -10.512 -3.076
119 H PHE 14 H PHE 14 8.545 -5.448 -1.441
120 HA PHE 14 HA PHE 14 7.918 -6.050 1.369
121 HD1 PHE 14 HD2 PHE 14 11.296 -5.801 0.842
122 HD2 PHE 14 HD1 PHE 14 8.853 -3.909 3.769
123 HE1 PHE 14 HE2 PHE 14 12.764 -6.662 2.618
124 HE2 PHE 14 HE1 PHE 14 10.318 -4.767 5.550
125 HZ PHE 14 HZ PHE 14 12.276 -6.146 4.976
126 HB2 PHE 14 2HB PHE 14 9.704 -3.977 0.270
127 HB3 PHE 14 3HB PHE 14 8.563 -3.406 1.484
128 H GLU 15 H GLU 15 5.810 -5.828 1.667
129 HA GLU 15 HA GLU 15 4.218 -4.204 -0.121
130 HB2 GLU 15 2HB GLU 15 3.294 -6.327 0.492
131 HB3 GLU 15 3HB GLU 15 3.511 -5.992 2.204
132 HG2 GLU 15 2HG GLU 15 1.714 -4.553 2.292
133 HG3 GLU 15 3HG GLU 15 1.763 -4.221 0.562
134 H LEU 16 H LEU 16 4.062 -2.090 0.205
135 HA LEU 16 HA LEU 16 4.014 -1.089 2.973
136 HG LEU 16 HG LEU 16 7.054 0.384 1.488
137 HB2 LEU 16 2HB LEU 16 5.082 0.027 0.425
138 HB3 LEU 16 3HB LEU 16 4.523 1.137 1.674
139 HD11 LEU 16 1HD1 LEU 16 7.355 1.123 3.690
140 HD12 LEU 16 2HD1 LEU 16 5.784 0.511 4.205
141 HD13 LEU 16 3HD1 LEU 16 5.877 1.919 3.148
142 HD21 LEU 16 3HD2 LEU 16 5.887 -1.695 3.335
143 HD22 LEU 16 1HD2 LEU 16 7.592 -1.445 2.955
144 HD23 LEU 16 2HD2 LEU 16 6.486 -2.020 1.707
145 HA PRO 17 HA PRO 17 -0.045 0.508 2.508
146 HB2 PRO 17 2HB PRO 17 0.115 2.911 3.761
147 HB3 PRO 17 3HB PRO 17 0.148 1.372 4.628
148 HG2 PRO 17 2HG PRO 17 2.423 3.150 3.839
149 HG3 PRO 17 3HG PRO 17 2.149 2.297 5.369
150 HD2 PRO 17 2HD PRO 17 3.844 1.374 3.470
151 HD3 PRO 17 3HD PRO 17 2.923 0.293 4.536
152 H ALA 18 H ALA 18 -1.338 2.391 1.709
153 HA ALA 18 HA ALA 18 -0.341 3.248 -0.821
154 HB1 ALA 18 1HB ALA 18 -2.671 2.765 -0.621
155 HB2 ALA 18 2HB ALA 18 -2.859 3.940 0.682
156 HB3 ALA 18 3HB ALA 18 -2.504 4.489 -0.956
157 H GLY 19 H GLY 19 1.001 4.891 -1.142
158 HA2 GLY 19 2HA GLY 19 1.599 7.164 -1.122
159 HA3 GLY 19 3HA GLY 19 0.560 7.402 0.275
160 H ALA 20 H ALA 20 2.545 4.685 0.590
161 HA ALA 20 HA ALA 20 3.858 5.540 2.863
162 HB1 ALA 20 1HB ALA 20 5.499 3.689 2.354
163 HB2 ALA 20 2HB ALA 20 3.798 3.222 2.400
164 HB3 ALA 20 3HB ALA 20 4.613 3.436 0.850
165 H ARG 21 H ARG 21 6.390 5.532 2.987
166 HA ARG 21 HA ARG 21 7.602 7.041 0.807
167 HE ARG 21 HE ARG 21 5.205 10.048 0.513
168 HB2 ARG 21 2HB ARG 21 6.649 8.263 3.222
169 HB3 ARG 21 3HB ARG 21 8.404 8.371 3.172
170 HG2 ARG 21 2HG ARG 21 8.393 9.855 1.490
171 HG3 ARG 21 3HG ARG 21 7.050 9.063 0.662
172 HD2 ARG 21 2HD ARG 21 6.197 10.244 3.156
173 HD3 ARG 21 3HD ARG 21 6.969 11.440 2.116
174 HH11 ARG 21 1HH1 ARG 21 5.036 12.033 3.368
175 HH12 ARG 21 2HH1 ARG 21 3.442 12.619 3.026
176 HH21 ARG 21 1HH2 ARG 21 3.105 10.812 0.051
177 HH22 ARG 21 2HH2 ARG 21 2.344 11.923 1.139
178 H ALA 22 H ALA 22 9.982 7.517 1.385
179 HA ALA 22 HA ALA 22 11.361 5.153 1.696
180 HB1 ALA 22 1HB ALA 22 12.260 7.308 0.792
181 HB2 ALA 22 2HB ALA 22 12.458 7.853 2.458
182 HB3 ALA 22 3HB ALA 22 13.353 6.448 1.877
183 H SER 23 H SER 23 10.578 7.569 4.170
184 HA SER 23 HA SER 23 12.006 6.518 6.301
185 HG SER 23 HG SER 23 10.448 7.491 8.616
186 HB2 SER 23 2HB SER 23 11.076 8.553 6.840
187 HB3 SER 23 3HB SER 23 9.543 8.181 6.053
188 H GLN 24 H GLN 24 8.625 5.840 5.405
189 HA GLN 24 HA GLN 24 8.021 3.998 7.371
190 HB2 GLN 24 2HB GLN 24 6.582 5.014 5.425
191 HB3 GLN 24 3HB GLN 24 7.046 3.544 4.578
192 HG2 GLN 24 2HG GLN 24 5.728 2.233 5.843
193 HG3 GLN 24 3HG GLN 24 6.013 3.173 7.307
194 HE21 GLN 24 1HE2 GLN 24 3.917 3.367 7.936
195 HE22 GLN 24 2HE2 GLN 24 2.728 4.254 7.051
196 H LEU 25 H LEU 25 9.315 3.316 4.121
197 HA LEU 25 HA LEU 25 9.590 0.546 4.470
198 HG LEU 25 HG LEU 25 12.039 -0.015 2.616
199 HB2 LEU 25 2HB LEU 25 9.679 1.834 2.311
200 HB3 LEU 25 3HB LEU 25 11.327 2.290 2.737
201 HD11 LEU 25 1HD1 LEU 25 10.044 -1.102 3.453
202 HD12 LEU 25 2HD1 LEU 25 10.493 -1.780 1.889
203 HD13 LEU 25 3HD1 LEU 25 9.154 -0.639 2.002
204 HD21 LEU 25 3HD2 LEU 25 12.374 0.530 0.483
205 HD22 LEU 25 1HD2 LEU 25 10.851 1.413 0.391
206 HD23 LEU 25 2HD2 LEU 25 10.876 -0.330 0.124
207 H SER 26 H SER 26 11.806 3.218 5.116
208 HA SER 26 HA SER 26 14.135 1.819 5.634
209 HG SER 26 HG SER 26 14.965 5.099 5.582
210 HB2 SER 26 2HB SER 26 13.035 4.443 6.393
211 HB3 SER 26 3HB SER 26 14.253 3.815 7.503
212 H ASN 27 H ASN 27 11.592 2.720 7.962
213 HA ASN 27 HA ASN 27 12.754 1.363 10.153
214 HB2 ASN 27 2HB ASN 27 11.188 3.043 10.692
215 HB3 ASN 27 3HB ASN 27 9.979 2.389 9.591
216 HD21 ASN 27 1HD2 ASN 27 8.356 2.094 11.020
217 HD22 ASN 27 2HD2 ASN 27 8.425 0.994 12.351
218 H LEU 28 H LEU 28 10.496 0.389 7.648
219 HA LEU 28 HA LEU 28 9.556 -1.991 8.753
220 HG LEU 28 HG LEU 28 7.597 -1.551 7.721
221 HB2 LEU 28 2HB LEU 28 9.609 -0.727 6.160
222 HB3 LEU 28 3HB LEU 28 9.840 -2.468 6.017
223 HD11 LEU 28 1HD1 LEU 28 7.892 -0.787 4.916
224 HD12 LEU 28 2HD1 LEU 28 6.787 -0.183 6.149
225 HD13 LEU 28 3HD1 LEU 28 6.402 -1.662 5.270
226 HD21 LEU 28 3HD2 LEU 28 7.904 -3.723 5.650
227 HD22 LEU 28 1HD2 LEU 28 6.516 -3.493 6.714
228 HD23 LEU 28 2HD2 LEU 28 8.086 -3.922 7.394
229 H LEU 29 H LEU 29 12.392 -1.434 6.681
230 HA LEU 29 HA LEU 29 13.239 -4.154 6.741
231 HG LEU 29 HG LEU 29 12.969 -3.412 4.477
232 HB2 LEU 29 2HB LEU 29 14.534 -1.580 5.911
233 HB3 LEU 29 3HB LEU 29 15.435 -3.094 5.928
234 HD11 LEU 29 1HD1 LEU 29 13.678 -1.945 2.552
235 HD12 LEU 29 2HD1 LEU 29 14.742 -1.116 3.687
236 HD13 LEU 29 3HD1 LEU 29 12.998 -1.109 3.947
237 HD21 LEU 29 3HD2 LEU 29 14.309 -4.552 3.020
238 HD22 LEU 29 1HD2 LEU 29 15.318 -4.612 4.465
239 HD23 LEU 29 2HD2 LEU 29 15.656 -3.428 3.202
240 H SER 30 H SER 30 14.242 -1.225 8.471
241 HA SER 30 HA SER 30 16.402 -2.214 9.877
242 HG SER 30 HG SER 30 16.491 0.381 11.949
243 HB2 SER 30 2HB SER 30 15.831 0.139 9.953
244 HB3 SER 30 3HB SER 30 14.310 -0.217 10.772
245 H SER 31 H SER 31 12.961 -2.415 10.693
246 HA SER 31 HA SER 31 13.373 -3.740 13.181
247 HG SER 31 HG SER 31 9.895 -3.992 13.543
248 HB2 SER 31 2HB SER 31 11.320 -2.481 12.737
249 HB3 SER 31 3HB SER 31 10.903 -3.593 11.433
250 H SER 32 H SER 32 13.234 -4.771 9.893
251 HA SER 32 HA SER 32 12.856 -7.569 10.650
252 HG SER 32 HG SER 32 11.254 -5.721 9.222
253 HB2 SER 32 2HB SER 32 13.147 -6.386 7.880
254 HB3 SER 32 3HB SER 32 12.608 -8.016 8.282
255 H GLY 33 H GLY 33 14.728 -8.317 11.510
256 HA2 GLY 33 2HA GLY 33 16.823 -9.285 11.400
257 HA3 GLY 33 3HA GLY 33 16.923 -8.781 9.719
258 H MET 34 H MET 34 17.892 -6.837 9.192
259 HA MET 34 HA MET 34 19.173 -5.406 11.426
260 HB2 MET 34 2HB MET 34 20.329 -6.247 8.775
261 HB3 MET 34 3HB MET 34 21.045 -4.958 9.734
262 HG2 MET 34 2HG MET 34 20.620 -7.198 11.427
263 HG3 MET 34 3HG MET 34 21.425 -7.749 9.959
264 HE1 MET 34 3HE MET 34 23.053 -7.011 13.452
265 HE2 MET 34 1HE MET 34 22.496 -8.303 12.388
266 HE3 MET 34 2HE MET 34 24.188 -7.806 12.359
267 H ALA 35 H ALA 35 20.235 -3.276 10.288
268 HA ALA 35 HA ALA 35 18.094 -2.009 8.713
269 HB1 ALA 35 1HB ALA 35 18.068 -0.094 10.053
270 HB2 ALA 35 2HB ALA 35 18.108 -1.428 11.206
271 HB3 ALA 35 3HB ALA 35 19.580 -0.523 10.854
272 H PHE 36 H PHE 36 19.006 -1.676 6.783
273 HA PHE 36 HA PHE 36 21.667 -0.410 6.719
274 HD1 PHE 36 HD2 PHE 36 21.113 -4.126 6.798
275 HD2 PHE 36 HD1 PHE 36 19.370 -2.243 3.402
276 HE1 PHE 36 HE2 PHE 36 19.520 -5.990 6.587
277 HE2 PHE 36 HE1 PHE 36 17.774 -4.103 3.186
278 HZ PHE 36 HZ PHE 36 17.848 -5.980 4.779
279 HB2 PHE 36 2HB PHE 36 21.498 -1.523 4.258
280 HB3 PHE 36 3HB PHE 36 22.246 -2.319 5.639
281 H SER 37 H SER 37 21.979 0.608 4.396
282 HA SER 37 HA SER 37 19.974 2.655 4.193
283 HG SER 37 HG SER 37 21.184 4.113 1.769
284 HB2 SER 37 2HB SER 37 21.951 3.670 3.723
285 HB3 SER 37 3HB SER 37 22.686 2.185 3.120
286 H LEU 38 H LEU 38 18.651 3.117 2.433
287 HA LEU 38 HA LEU 38 18.346 0.944 0.467
288 HG LEU 38 HG LEU 38 15.212 0.254 2.314
289 HB2 LEU 38 2HB LEU 38 16.252 2.475 1.979
290 HB3 LEU 38 3HB LEU 38 15.885 1.630 0.477
291 HD11 LEU 38 1HD1 LEU 38 15.925 -1.567 1.268
292 HD12 LEU 38 2HD1 LEU 38 17.576 -1.313 1.834
293 HD13 LEU 38 3HD1 LEU 38 17.025 -0.543 0.346
294 HD21 LEU 38 3HD2 LEU 38 17.927 -0.099 3.412
295 HD22 LEU 38 1HD2 LEU 38 16.363 -0.075 4.228
296 HD23 LEU 38 2HD2 LEU 38 17.139 1.440 3.764
297 H HIS 39 H HIS 39 18.855 1.649 -1.489
298 HA HIS 39 HA HIS 39 18.005 4.355 -2.276
299 HD1 HIS 39 HD1 HIS 39 20.931 3.073 -5.286
300 HD2 HIS 39 HD2 HIS 39 21.542 1.700 -1.413
301 HE1 HIS 39 HE1 HIS 39 22.446 1.078 -5.511
302 HB2 HIS 39 2HB HIS 39 20.063 4.665 -3.524
303 HB3 HIS 39 3HB HIS 39 20.446 4.308 -1.842
304 H THR 40 H THR 40 17.172 4.573 -4.309
305 HA THR 40 HA THR 40 17.056 2.143 -5.972
306 HB THR 40 HB THR 40 14.885 2.290 -5.037
307 HG1 THR 40 HG1 THR 40 14.818 1.986 -7.286
308 HG21 THR 40 3HG2 THR 40 13.745 4.703 -5.677
309 HG22 THR 40 1HG2 THR 40 15.374 5.168 -5.189
310 HG23 THR 40 2HG2 THR 40 14.350 4.251 -4.084
311 H GLN 41 H GLN 41 16.677 2.535 -8.258
312 HA GLN 41 HA GLN 41 17.250 3.508 -10.234
313 HB2 GLN 41 2HB GLN 41 15.586 5.303 -8.863
314 HB3 GLN 41 3HB GLN 41 16.897 6.282 -9.508
315 HG2 GLN 41 2HG GLN 41 16.439 5.123 -11.732
316 HG3 GLN 41 3HG GLN 41 14.934 4.575 -10.995
317 HE21 GLN 41 1HE2 GLN 41 16.108 6.788 -13.000
318 HE22 GLN 41 2HE2 GLN 41 15.030 8.105 -12.701
319 H GLY 42 H GLY 42 19.265 3.277 -8.039
320 HA2 GLY 42 2HA GLY 42 21.538 3.668 -7.943
321 HA3 GLY 42 3HA GLY 42 21.382 4.664 -9.383
322 H ARG 43 H ARG 43 19.253 5.530 -6.881
323 HA ARG 43 HA ARG 43 21.112 7.552 -5.845
324 HE ARG 43 HE ARG 43 20.520 10.027 -10.183
325 HB2 ARG 43 2HB ARG 43 18.315 8.087 -6.859
326 HB3 ARG 43 3HB ARG 43 19.301 9.249 -5.982
327 HG2 ARG 43 2HG ARG 43 21.006 9.035 -7.810
328 HG3 ARG 43 3HG ARG 43 19.814 8.092 -8.708
329 HD2 ARG 43 2HD ARG 43 18.274 9.961 -8.688
330 HD3 ARG 43 3HD ARG 43 19.385 10.898 -7.689
331 HH11 ARG 43 1HH1 ARG 43 18.648 12.493 -8.592
332 HH12 ARG 43 2HH1 ARG 43 19.040 13.721 -9.750
333 HH21 ARG 43 1HH2 ARG 43 21.043 11.634 -11.714
334 HH22 ARG 43 2HH2 ARG 43 20.402 13.231 -11.526
335 H VAL 44 H VAL 44 20.762 8.190 -3.730
336 HA VAL 44 HA VAL 44 19.532 6.319 -2.017
337 HB VAL 44 HB VAL 44 19.867 8.132 -0.253
338 HG11 VAL 44 1HG1 VAL 44 22.214 7.213 -1.910
339 HG12 VAL 44 2HG1 VAL 44 22.316 7.849 -0.267
340 HG13 VAL 44 3HG1 VAL 44 21.461 6.338 -0.578
341 HG21 VAL 44 3HG2 VAL 44 20.484 10.198 -0.823
342 HG22 VAL 44 1HG2 VAL 44 21.736 9.601 -1.911
343 HG23 VAL 44 2HG2 VAL 44 20.076 9.766 -2.483
344 H LEU 45 H LEU 45 17.796 6.722 -0.484
345 HA LEU 45 HA LEU 45 15.629 8.264 -1.723
346 HG LEU 45 HG LEU 45 14.919 5.451 -2.363
347 HB2 LEU 45 2HB LEU 45 15.789 5.755 -0.222
348 HB3 LEU 45 3HB LEU 45 14.463 6.806 0.271
349 HD11 LEU 45 1HD1 LEU 45 12.340 5.723 -0.879
350 HD12 LEU 45 2HD1 LEU 45 13.544 4.547 -0.355
351 HD13 LEU 45 3HD1 LEU 45 12.873 4.454 -1.983
352 HD21 LEU 45 3HD2 LEU 45 12.719 6.929 -2.844
353 HD22 LEU 45 1HD2 LEU 45 14.344 7.396 -3.348
354 HD23 LEU 45 2HD2 LEU 45 13.652 8.067 -1.871
355 H SER 46 H SER 46 14.966 10.093 -0.822
356 HA SER 46 HA SER 46 16.108 11.013 1.642
357 HG SER 46 HG SER 46 13.270 13.203 -0.208
358 HB2 SER 46 2HB SER 46 14.889 13.073 1.219
359 HB3 SER 46 3HB SER 46 15.637 12.523 -0.281
360 H GLU 47 H GLU 47 14.925 11.692 3.512
361 HA GLU 47 HA GLU 47 13.172 9.782 4.529
362 HB2 GLU 47 2HB GLU 47 13.645 12.637 5.394
363 HB3 GLU 47 3HB GLU 47 12.709 11.475 6.323
364 HG2 GLU 47 2HG GLU 47 14.590 10.146 6.765
365 HG3 GLU 47 3HG GLU 47 15.549 10.946 5.522
366 H ALA 48 H ALA 48 12.559 12.609 2.622
367 HA ALA 48 HA ALA 48 9.662 12.301 3.034
368 HB1 ALA 48 1HB ALA 48 10.175 14.607 1.499
369 HB2 ALA 48 2HB ALA 48 9.623 14.514 3.172
370 HB3 ALA 48 3HB ALA 48 11.348 14.596 2.816
371 H ALA 49 H ALA 49 11.882 11.074 1.090
372 HA ALA 49 HA ALA 49 11.065 11.658 -1.530
373 HB1 ALA 49 1HB ALA 49 13.076 10.218 -0.483
374 HB2 ALA 49 2HB ALA 49 12.004 8.913 -0.994
375 HB3 ALA 49 3HB ALA 49 12.570 10.101 -2.169
376 H GLU 50 H GLU 50 9.204 11.260 -2.516
377 HA GLU 50 HA GLU 50 7.309 9.395 -1.354
378 HB2 GLU 50 2HB GLU 50 7.150 11.767 -2.937
379 HB3 GLU 50 3HB GLU 50 6.339 10.468 -3.801
380 HG2 GLU 50 2HG GLU 50 5.210 10.031 -1.487
381 HG3 GLU 50 3HG GLU 50 5.673 11.703 -1.176
382 H LEU 51 H LEU 51 8.261 7.388 -1.784
383 HA LEU 51 HA LEU 51 9.230 6.520 -4.254
384 HG LEU 51 HG LEU 51 7.081 3.764 -3.007
385 HB2 LEU 51 2HB LEU 51 9.339 4.421 -3.334
386 HB3 LEU 51 3HB LEU 51 9.322 5.437 -1.894
387 HD11 LEU 51 1HD1 LEU 51 8.556 3.778 -0.379
388 HD12 LEU 51 2HD1 LEU 51 8.661 2.555 -1.644
389 HD13 LEU 51 3HD1 LEU 51 7.157 2.770 -0.750
390 HD21 LEU 51 3HD2 LEU 51 5.873 5.614 -2.364
391 HD22 LEU 51 1HD2 LEU 51 7.021 6.061 -1.102
392 HD23 LEU 51 2HD2 LEU 51 5.928 4.699 -0.857
393 H ASN 52 H ASN 52 7.994 4.322 -5.118
394 HA ASN 52 HA ASN 52 5.238 5.117 -5.763
395 HB2 ASN 52 2HB ASN 52 7.302 5.360 -7.553
396 HB3 ASN 52 3HB ASN 52 6.671 3.762 -7.941
397 HD21 ASN 52 1HD2 ASN 52 6.591 6.534 -9.219
398 HD22 ASN 52 2HD2 ASN 52 4.929 6.731 -9.649
399 H ASP 53 H ASP 53 4.082 3.238 -6.917
400 HA ASP 53 HA ASP 53 4.400 0.900 -5.236
401 HB2 ASP 53 2HB ASP 53 2.150 1.541 -5.487
402 HB3 ASP 53 3HB ASP 53 2.323 1.790 -7.222
403 H LYS 54 H LYS 54 4.651 -1.233 -6.008
404 HA LYS 54 HA LYS 54 5.732 -2.831 -7.218
405 HB2 LYS 54 2HB LYS 54 3.673 -2.299 -8.635
406 HB3 LYS 54 3HB LYS 54 4.752 -1.363 -9.662
407 HG2 LYS 54 2HG LYS 54 5.652 -3.190 -10.603
408 HG3 LYS 54 3HG LYS 54 5.651 -4.098 -9.090
409 HD2 LYS 54 2HD LYS 54 3.353 -4.665 -9.337
410 HD3 LYS 54 3HD LYS 54 3.152 -3.530 -10.675
411 HE2 LYS 54 2HE LYS 54 5.213 -5.626 -11.005
412 HE3 LYS 54 3HE LYS 54 3.533 -6.162 -11.019
413 HZ1 LYS 54 3HZ LYS 54 3.613 -3.930 -12.628
414 HZ2 LYS 54 1HZ LYS 54 3.473 -5.540 -13.130
415 HZ3 LYS 54 2HZ LYS 54 4.997 -4.812 -13.041
416 H MET 55 H MET 55 7.450 -0.890 -6.388
417 HA MET 55 HA MET 55 9.161 -0.347 -8.718
418 HB2 MET 55 2HB MET 55 10.145 1.438 -7.510
419 HB3 MET 55 3HB MET 55 8.412 1.574 -7.245
420 HG2 MET 55 2HG MET 55 8.561 0.874 -5.044
421 HG3 MET 55 3HG MET 55 10.128 0.108 -5.291
422 HE1 MET 55 3HE MET 55 11.872 1.760 -6.628
423 HE2 MET 55 1HE MET 55 12.414 3.229 -5.814
424 HE3 MET 55 2HE MET 55 12.581 1.666 -5.015
425 H VAL 56 H VAL 56 11.572 0.029 -7.431
426 HA VAL 56 HA VAL 56 12.140 -2.495 -6.052
427 HB VAL 56 HB VAL 56 13.662 -1.506 -8.467
428 HG11 VAL 56 1HG1 VAL 56 15.180 -2.423 -6.814
429 HG12 VAL 56 2HG1 VAL 56 14.181 -3.869 -6.666
430 HG13 VAL 56 3HG1 VAL 56 15.028 -3.532 -8.176
431 HG21 VAL 56 3HG2 VAL 56 12.246 -4.138 -8.160
432 HG22 VAL 56 1HG2 VAL 56 11.439 -2.706 -8.800
433 HG23 VAL 56 2HG2 VAL 56 12.842 -3.374 -9.634
434 H ILE 57 H ILE 57 13.426 -2.217 -4.348
435 HA ILE 57 HA ILE 57 14.985 0.279 -4.180
436 HB ILE 57 HB ILE 57 13.507 -1.254 -2.062
437 HG12 ILE 57 2HG1 ILE 57 12.421 0.626 -3.324
438 HG13 ILE 57 3HG1 ILE 57 12.498 0.873 -1.583
439 HG21 ILE 57 1HG2 ILE 57 15.811 0.642 -1.689
440 HG22 ILE 57 2HG2 ILE 57 14.633 0.305 -0.422
441 HG23 ILE 57 3HG2 ILE 57 15.633 -0.997 -1.063
442 HD11 ILE 57 3HD1 ILE 57 13.209 2.707 -3.435
443 HD12 ILE 57 1HD1 ILE 57 13.808 2.674 -1.777
444 HD13 ILE 57 2HD1 ILE 57 14.768 1.965 -3.076
445 H ASP 58 H ASP 58 17.119 0.103 -3.977
446 HA ASP 58 HA ASP 58 18.299 -2.541 -3.738
447 HB2 ASP 58 2HB ASP 58 18.990 -0.588 -5.359
448 HB3 ASP 58 3HB ASP 58 19.924 -0.039 -3.970
449 H ALA 59 H ALA 59 18.637 -3.332 -1.772
450 HA ALA 59 HA ALA 59 19.049 -1.569 0.495
451 HB1 ALA 59 1HB ALA 59 19.343 -4.113 1.461
452 HB2 ALA 59 2HB ALA 59 17.826 -3.218 1.381
453 HB3 ALA 59 3HB ALA 59 18.251 -4.349 0.096
454 H PHE 60 H PHE 60 21.025 -0.781 0.815
455 HA PHE 60 HA PHE 60 23.335 -2.543 0.329
456 HD1 PHE 60 HD2 PHE 60 26.105 -1.241 0.587
457 HD2 PHE 60 HD1 PHE 60 23.397 2.008 1.071
458 HE1 PHE 60 HE2 PHE 60 27.811 -0.013 1.867
459 HE2 PHE 60 HE1 PHE 60 25.099 3.241 2.350
460 HZ PHE 60 HZ PHE 60 27.309 2.230 2.751
461 HB2 PHE 60 2HB PHE 60 24.065 -0.834 -0.931
462 HB3 PHE 60 3HB PHE 60 22.820 0.247 -0.315
463 H VAL 61 H VAL 61 24.359 -3.261 2.066
464 HA VAL 61 HA VAL 61 23.899 -1.946 4.641
465 HB VAL 61 HB VAL 61 24.624 -3.952 5.697
466 HG11 VAL 61 1HG1 VAL 61 23.234 -5.447 3.665
467 HG12 VAL 61 2HG1 VAL 61 22.697 -4.980 5.280
468 HG13 VAL 61 3HG1 VAL 61 22.471 -3.878 3.920
469 HG21 VAL 61 3HG2 VAL 61 26.060 -4.345 3.219
470 HG22 VAL 61 1HG2 VAL 61 26.336 -5.062 4.807
471 HG23 VAL 61 2HG2 VAL 61 25.183 -5.799 3.694
472 HA PRO 62 HA PRO 62 27.939 -0.246 4.914
473 HB2 PRO 62 2HB PRO 62 28.362 -0.376 7.592
474 HB3 PRO 62 3HB PRO 62 27.241 0.773 6.851
475 HG2 PRO 62 2HG PRO 62 26.666 -1.849 8.177
476 HG3 PRO 62 3HG PRO 62 25.801 -0.308 8.323
477 HD2 PRO 62 2HD PRO 62 24.923 -2.328 6.748
478 HD3 PRO 62 3HD PRO 62 24.656 -0.620 6.346
479 H ALA 63 H ALA 63 29.997 -0.939 4.732
480 HA ALA 63 HA ALA 63 30.790 -3.443 6.029
481 HB1 ALA 63 1HB ALA 63 30.799 -4.600 4.138
482 HB2 ALA 63 2HB ALA 63 30.247 -3.183 3.243
483 HB3 ALA 63 3HB ALA 63 31.973 -3.469 3.464
484 H ASP 64 H ASP 64 33.286 -3.770 5.130
485 HA ASP 64 HA ASP 64 35.416 -3.095 5.591
486 HB2 ASP 64 2HB ASP 64 34.520 -1.668 3.483
487 HB3 ASP 64 3HB ASP 64 34.911 -0.354 4.588
488 H GLY 65 H GLY 65 36.563 -0.685 6.272
489 HA2 GLY 65 2HA GLY 65 36.561 1.019 7.903
490 HA3 GLY 65 3HA GLY 65 35.084 0.344 8.574
491 H ALA 66 H ALA 66 38.572 0.061 8.441
492 HA ALA 66 HA ALA 66 38.527 -1.234 11.054
493 HB1 ALA 66 1HB ALA 66 40.152 -2.398 8.801
494 HB2 ALA 66 2HB ALA 66 39.975 -3.029 10.438
495 HB3 ALA 66 3HB ALA 66 38.600 -3.044 9.333
496 H GLY 67 H GLY 67 41.219 -1.790 11.299
497 HA2 GLY 67 2HA GLY 67 43.142 -0.093 10.438
498 HA3 GLY 67 3HA GLY 67 42.275 0.880 11.618
499 H LEU 68 H LEU 68 44.750 -1.333 11.158
500 HA LEU 68 HA LEU 68 44.730 -2.727 13.611
501 HG LEU 68 HG LEU 68 45.480 -4.615 12.503
502 HB2 LEU 68 2HB LEU 68 46.433 -2.485 11.330
503 HB3 LEU 68 3HB LEU 68 47.407 -2.346 12.792
504 HD11 LEU 68 1HD1 LEU 68 48.194 -4.400 11.220
505 HD12 LEU 68 2HD1 LEU 68 46.652 -4.750 10.439
506 HD13 LEU 68 3HD1 LEU 68 47.376 -5.932 11.529
507 HD21 LEU 68 3HD2 LEU 68 46.459 -5.306 14.372
508 HD22 LEU 68 1HD2 LEU 68 47.346 -3.783 14.421
509 HD23 LEU 68 2HD2 LEU 68 48.057 -5.192 13.633
510 H GLU 69 H GLU 69 47.047 -0.185 12.671
511 HA GLU 69 HA GLU 69 47.105 0.665 15.488
512 HB2 GLU 69 2HB GLU 69 49.195 1.280 13.404
513 HB3 GLU 69 3HB GLU 69 49.334 1.429 15.150
514 HG2 GLU 69 2HG GLU 69 49.114 -1.044 15.313
515 HG3 GLU 69 3HG GLU 69 49.169 -1.114 13.552
Start of MODEL 10
1 HA MET 1 HA MET 1 1.486 -0.725 -3.304
2 H1 MET 1 H MET 1 0.714 -0.577 -0.484
3 HB2 MET 1 2HB MET 1 2.518 1.381 -1.395
4 HB3 MET 1 3HB MET 1 3.051 1.142 -3.053
5 HG2 MET 1 2HG MET 1 0.163 1.620 -2.568
6 HG3 MET 1 3HG MET 1 1.276 2.977 -2.407
7 HE1 MET 1 3HE MET 1 -0.080 0.356 -5.519
8 HE2 MET 1 1HE MET 1 -0.964 1.172 -4.229
9 HE3 MET 1 2HE MET 1 -0.905 1.881 -5.843
10 H LEU 2 H LEU 2 3.176 -2.031 -3.636
11 HA LEU 2 HA LEU 2 4.572 -3.084 -1.286
12 HG LEU 2 HG LEU 2 4.181 -5.328 -1.209
13 HB2 LEU 2 2HB LEU 2 3.831 -4.130 -3.930
14 HB3 LEU 2 3HB LEU 2 5.434 -4.602 -3.368
15 HD11 LEU 2 1HD1 LEU 2 1.925 -5.421 -3.205
16 HD12 LEU 2 2HD1 LEU 2 2.039 -4.289 -1.858
17 HD13 LEU 2 3HD1 LEU 2 1.896 -6.019 -1.546
18 HD21 LEU 2 3HD2 LEU 2 5.252 -6.981 -2.463
19 HD22 LEU 2 1HD2 LEU 2 4.192 -6.746 -3.853
20 HD23 LEU 2 2HD2 LEU 2 3.573 -7.521 -2.394
21 H VAL 3 H VAL 3 6.904 -3.562 -1.511
22 HA VAL 3 HA VAL 3 8.314 -1.731 -3.321
23 HB VAL 3 HB VAL 3 9.016 -1.988 -0.396
24 HG11 VAL 3 1HG1 VAL 3 10.052 0.358 -1.543
25 HG12 VAL 3 2HG1 VAL 3 10.942 -1.074 -1.021
26 HG13 VAL 3 3HG1 VAL 3 10.383 -0.941 -2.689
27 HG21 VAL 3 3HG2 VAL 3 6.858 -0.848 -0.674
28 HG22 VAL 3 1HG2 VAL 3 8.114 0.252 -0.106
29 HG23 VAL 3 2HG2 VAL 3 7.610 0.287 -1.796
30 H ILE 4 H ILE 4 9.989 -2.660 -4.307
31 HA ILE 4 HA ILE 4 10.777 -5.344 -3.485
32 HB ILE 4 HB ILE 4 11.293 -3.740 -5.979
33 HG12 ILE 4 2HG1 ILE 4 9.095 -4.964 -5.582
34 HG13 ILE 4 3HG1 ILE 4 9.950 -5.367 -7.066
35 HG21 ILE 4 1HG2 ILE 4 12.744 -6.081 -4.914
36 HG22 ILE 4 2HG2 ILE 4 12.297 -6.142 -6.619
37 HG23 ILE 4 3HG2 ILE 4 13.284 -4.811 -6.013
38 HD11 ILE 4 3HD1 ILE 4 10.458 -7.474 -6.362
39 HD12 ILE 4 1HD1 ILE 4 10.440 -7.029 -4.656
40 HD13 ILE 4 2HD1 ILE 4 8.922 -7.225 -5.533
41 H VAL 5 H VAL 5 12.218 -5.255 -1.849
42 HA VAL 5 HA VAL 5 14.414 -3.339 -1.941
43 HB VAL 5 HB VAL 5 13.626 -5.347 0.172
44 HG11 VAL 5 1HG1 VAL 5 16.054 -3.752 -0.195
45 HG12 VAL 5 2HG1 VAL 5 15.302 -3.579 1.392
46 HG13 VAL 5 3HG1 VAL 5 15.771 -5.175 0.806
47 HG21 VAL 5 3HG2 VAL 5 13.544 -2.696 1.120
48 HG22 VAL 5 1HG2 VAL 5 12.727 -2.702 -0.443
49 HG23 VAL 5 2HG2 VAL 5 12.188 -3.789 0.837
50 H ARG 6 H ARG 6 16.275 -3.839 -2.873
51 HA ARG 6 HA ARG 6 16.956 -6.662 -3.275
52 HE ARG 6 HE ARG 6 18.736 -4.689 -6.911
53 HB2 ARG 6 2HB ARG 6 18.424 -4.358 -4.522
54 HB3 ARG 6 3HB ARG 6 18.270 -6.012 -5.100
55 HG2 ARG 6 2HG ARG 6 15.671 -5.143 -5.080
56 HG3 ARG 6 3HG ARG 6 16.565 -3.700 -5.563
57 HD2 ARG 6 2HD ARG 6 16.649 -6.416 -6.868
58 HD3 ARG 6 3HD ARG 6 15.947 -4.941 -7.531
59 HH11 ARG 6 1HH1 ARG 6 16.434 -5.747 -9.299
60 HH12 ARG 6 2HH1 ARG 6 17.530 -5.560 -10.628
61 HH21 ARG 6 1HH2 ARG 6 20.188 -4.440 -8.652
62 HH22 ARG 6 2HH2 ARG 6 19.665 -4.818 -10.259
63 H LEU 7 H LEU 7 18.131 -7.463 -1.653
64 HA LEU 7 HA LEU 7 19.925 -5.817 -0.112
65 HG LEU 7 HG LEU 7 20.117 -6.411 1.941
66 HB2 LEU 7 2HB LEU 7 18.499 -8.100 0.393
67 HB3 LEU 7 3HB LEU 7 20.141 -8.715 0.217
68 HD11 LEU 7 1HD1 LEU 7 17.828 -6.990 2.440
69 HD12 LEU 7 2HD1 LEU 7 18.859 -7.424 3.802
70 HD13 LEU 7 3HD1 LEU 7 18.278 -8.675 2.703
71 HD21 LEU 7 3HD2 LEU 7 21.942 -7.789 2.169
72 HD22 LEU 7 1HD2 LEU 7 20.984 -9.263 2.025
73 HD23 LEU 7 2HD2 LEU 7 20.944 -8.328 3.521
74 H GLN 8 H GLN 8 22.189 -6.588 0.311
75 HA GLN 8 HA GLN 8 23.942 -6.256 -1.604
76 HB2 GLN 8 2HB GLN 8 24.240 -7.207 0.849
77 HB3 GLN 8 3HB GLN 8 24.470 -8.724 -0.011
78 HG2 GLN 8 2HG GLN 8 26.340 -7.854 -1.201
79 HG3 GLN 8 3HG GLN 8 26.035 -6.226 -0.598
80 HE21 GLN 8 1HE2 GLN 8 28.196 -6.206 0.172
81 HE22 GLN 8 2HE2 GLN 8 28.614 -7.005 1.646
82 H ASP 9 H ASP 9 22.603 -9.513 -1.037
83 HA ASP 9 HA ASP 9 22.712 -10.028 -3.903
84 HB2 ASP 9 2HB ASP 9 24.880 -10.799 -2.650
85 HB3 ASP 9 3HB ASP 9 23.860 -12.121 -2.090
86 H GLN 10 H GLN 10 20.523 -9.601 -2.166
87 HA GLN 10 HA GLN 10 19.061 -12.048 -2.653
88 HB2 GLN 10 2HB GLN 10 19.464 -10.964 0.134
89 HB3 GLN 10 3HB GLN 10 18.166 -12.073 -0.288
90 HG2 GLN 10 2HG GLN 10 20.111 -13.541 -1.218
91 HG3 GLN 10 3HG GLN 10 21.099 -12.560 -0.137
92 HE21 GLN 10 1HE2 GLN 10 18.067 -14.400 -0.140
93 HE22 GLN 10 2HE2 GLN 10 18.269 -15.064 1.442
94 H THR 11 H THR 11 17.269 -11.401 -3.625
95 HA THR 11 HA THR 11 16.186 -8.746 -3.023
96 HB THR 11 HB THR 11 15.331 -10.570 -5.270
97 HG1 THR 11 HG1 THR 11 16.787 -9.214 -6.533
98 HG21 THR 11 3HG2 THR 11 14.831 -8.226 -6.258
99 HG22 THR 11 1HG2 THR 11 14.915 -7.681 -4.583
100 HG23 THR 11 2HG2 THR 11 13.727 -8.896 -5.057
101 H LEU 12 H LEU 12 14.210 -8.434 -2.146
102 HA LEU 12 HA LEU 12 12.257 -10.555 -2.023
103 HG LEU 12 HG LEU 12 12.578 -11.814 1.383
104 HB2 LEU 12 2HB LEU 12 14.066 -10.580 -0.025
105 HB3 LEU 12 3HB LEU 12 12.877 -9.467 0.648
106 HD11 LEU 12 1HD1 LEU 12 10.098 -11.688 0.057
107 HD12 LEU 12 2HD1 LEU 12 10.617 -10.025 0.327
108 HD13 LEU 12 3HD1 LEU 12 10.490 -11.140 1.687
109 HD21 LEU 12 3HD2 LEU 12 12.317 -13.555 -0.022
110 HD22 LEU 12 1HD2 LEU 12 13.172 -12.510 -1.157
111 HD23 LEU 12 2HD2 LEU 12 11.412 -12.606 -1.202
112 HA PRO 13 HA PRO 13 9.835 -6.839 -2.319
113 HB2 PRO 13 2HB PRO 13 7.416 -8.069 -2.368
114 HB3 PRO 13 3HB PRO 13 8.496 -8.018 -3.766
115 HG2 PRO 13 2HG PRO 13 8.067 -10.219 -1.783
116 HG3 PRO 13 3HG PRO 13 8.225 -10.317 -3.547
117 HD2 PRO 13 2HD PRO 13 10.270 -10.889 -1.867
118 HD3 PRO 13 3HD PRO 13 10.525 -10.180 -3.474
119 H PHE 14 H PHE 14 8.138 -5.762 -1.093
120 HA PHE 14 HA PHE 14 7.568 -6.861 1.551
121 HD1 PHE 14 HD2 PHE 14 8.430 -6.194 4.147
122 HD2 PHE 14 HD1 PHE 14 11.254 -5.530 1.033
123 HE1 PHE 14 HE2 PHE 14 10.137 -7.405 5.441
124 HE2 PHE 14 HE1 PHE 14 12.965 -6.740 2.321
125 HZ PHE 14 HZ PHE 14 12.408 -7.678 4.529
126 HB2 PHE 14 2HB PHE 14 9.192 -4.413 0.999
127 HB3 PHE 14 3HB PHE 14 8.125 -4.421 2.399
128 H GLU 15 H GLU 15 5.696 -6.071 2.499
129 HA GLU 15 HA GLU 15 3.898 -4.698 0.659
130 HB2 GLU 15 2HB GLU 15 3.021 -6.705 1.649
131 HB3 GLU 15 3HB GLU 15 3.425 -6.146 3.266
132 HG2 GLU 15 2HG GLU 15 1.707 -4.567 3.280
133 HG3 GLU 15 3HG GLU 15 1.505 -4.641 1.530
134 H LEU 16 H LEU 16 3.707 -2.569 0.761
135 HA LEU 16 HA LEU 16 4.028 -1.248 3.376
136 HG LEU 16 HG LEU 16 7.003 -0.126 1.519
137 HB2 LEU 16 2HB LEU 16 4.948 -0.502 0.643
138 HB3 LEU 16 3HB LEU 16 4.523 0.782 1.773
139 HD11 LEU 16 1HD1 LEU 16 5.861 0.491 4.233
140 HD12 LEU 16 2HD1 LEU 16 6.110 1.708 2.982
141 HD13 LEU 16 3HD1 LEU 16 7.487 0.824 3.638
142 HD21 LEU 16 3HD2 LEU 16 6.316 -2.442 2.121
143 HD22 LEU 16 1HD2 LEU 16 5.898 -1.852 3.729
144 HD23 LEU 16 2HD2 LEU 16 7.568 -1.771 3.167
145 HA PRO 17 HA PRO 17 0.027 0.517 3.033
146 HB2 PRO 17 2HB PRO 17 0.405 3.043 3.953
147 HB3 PRO 17 3HB PRO 17 0.440 1.622 5.004
148 HG2 PRO 17 2HG PRO 17 2.720 3.158 3.817
149 HG3 PRO 17 3HG PRO 17 2.538 2.517 5.460
150 HD2 PRO 17 2HD PRO 17 4.020 1.272 3.566
151 HD3 PRO 17 3HD PRO 17 3.144 0.384 4.831
152 H ALA 18 H ALA 18 -1.197 2.480 2.180
153 HA ALA 18 HA ALA 18 -0.538 2.858 -0.549
154 HB1 ALA 18 1HB ALA 18 -2.739 3.512 1.219
155 HB2 ALA 18 2HB ALA 18 -2.413 4.801 0.060
156 HB3 ALA 18 3HB ALA 18 -2.743 3.165 -0.510
157 H GLY 19 H GLY 19 0.500 4.470 -1.586
158 HA2 GLY 19 2HA GLY 19 1.704 6.396 -1.931
159 HA3 GLY 19 3HA GLY 19 0.828 7.093 -0.576
160 H ALA 20 H ALA 20 2.479 4.198 0.136
161 HA ALA 20 HA ALA 20 4.017 5.192 2.179
162 HB1 ALA 20 1HB ALA 20 3.787 2.868 2.081
163 HB2 ALA 20 2HB ALA 20 4.388 2.787 0.424
164 HB3 ALA 20 3HB ALA 20 5.497 3.149 1.747
165 H ARG 21 H ARG 21 6.293 5.589 2.397
166 HA ARG 21 HA ARG 21 7.701 6.316 -0.068
167 HE ARG 21 HE ARG 21 4.914 9.615 3.597
168 HB2 ARG 21 2HB ARG 21 8.499 8.406 1.241
169 HB3 ARG 21 3HB ARG 21 6.913 8.435 0.481
170 HG2 ARG 21 2HG ARG 21 5.853 7.965 2.607
171 HG3 ARG 21 3HG ARG 21 7.431 7.838 3.386
172 HD2 ARG 21 2HD ARG 21 7.713 10.074 3.472
173 HD3 ARG 21 3HD ARG 21 6.956 10.331 1.901
174 HH11 ARG 21 1HH1 ARG 21 7.303 12.144 3.455
175 HH12 ARG 21 2HH1 ARG 21 6.310 13.307 4.268
176 HH21 ARG 21 1HH2 ARG 21 3.597 11.138 4.668
177 HH22 ARG 21 2HH2 ARG 21 4.202 12.734 4.959
178 H ALA 22 H ALA 22 10.023 7.177 0.701
179 HA ALA 22 HA ALA 22 11.430 4.983 1.632
180 HB1 ALA 22 1HB ALA 22 12.141 7.328 0.531
181 HB2 ALA 22 2HB ALA 22 12.637 7.614 2.200
182 HB3 ALA 22 3HB ALA 22 13.282 6.234 1.313
183 H SER 23 H SER 23 9.739 7.410 3.412
184 HA SER 23 HA SER 23 11.095 7.205 5.878
185 HG SER 23 HG SER 23 7.529 8.375 6.820
186 HB2 SER 23 2HB SER 23 9.741 9.000 6.087
187 HB3 SER 23 3HB SER 23 8.594 8.383 4.897
188 H GLN 24 H GLN 24 7.910 5.851 5.002
189 HA GLN 24 HA GLN 24 7.629 4.193 7.211
190 HB2 GLN 24 2HB GLN 24 6.248 4.653 4.776
191 HB3 GLN 24 3HB GLN 24 6.464 2.915 4.931
192 HG2 GLN 24 2HG GLN 24 4.716 2.875 6.279
193 HG3 GLN 24 3HG GLN 24 5.654 3.795 7.454
194 HE21 GLN 24 1HE2 GLN 24 4.570 5.458 8.197
195 HE22 GLN 24 2HE2 GLN 24 3.493 6.465 7.297
196 H LEU 25 H LEU 25 9.109 3.515 4.065
197 HA LEU 25 HA LEU 25 9.642 0.785 4.540
198 HG LEU 25 HG LEU 25 12.137 0.349 2.795
199 HB2 LEU 25 2HB LEU 25 9.670 2.019 2.329
200 HB3 LEU 25 3HB LEU 25 11.266 2.612 2.787
201 HD11 LEU 25 1HD1 LEU 25 9.332 -0.469 2.056
202 HD12 LEU 25 2HD1 LEU 25 10.180 -0.850 3.554
203 HD13 LEU 25 3HD1 LEU 25 10.742 -1.528 2.026
204 HD21 LEU 25 3HD2 LEU 25 12.156 1.594 0.692
205 HD22 LEU 25 1HD2 LEU 25 10.567 0.943 0.289
206 HD23 LEU 25 2HD2 LEU 25 11.956 -0.137 0.411
207 H SER 26 H SER 26 11.591 3.706 5.019
208 HA SER 26 HA SER 26 13.998 2.549 5.743
209 HG SER 26 HG SER 26 15.242 4.863 5.437
210 HB2 SER 26 2HB SER 26 12.654 5.129 6.454
211 HB3 SER 26 3HB SER 26 14.148 4.683 7.277
212 H ASN 27 H ASN 27 11.273 3.432 7.856
213 HA ASN 27 HA ASN 27 12.459 2.438 10.229
214 HB2 ASN 27 2HB ASN 27 10.740 4.007 10.555
215 HB3 ASN 27 3HB ASN 27 9.647 3.173 9.455
216 HD21 ASN 27 1HD2 ASN 27 7.973 2.533 10.607
217 HD22 ASN 27 2HD2 ASN 27 8.044 1.688 12.113
218 H LEU 28 H LEU 28 10.437 1.004 7.751
219 HA LEU 28 HA LEU 28 9.644 -1.321 9.077
220 HG LEU 28 HG LEU 28 7.712 -1.243 7.950
221 HB2 LEU 28 2HB LEU 28 9.688 -0.327 6.376
222 HB3 LEU 28 3HB LEU 28 10.109 -2.038 6.410
223 HD11 LEU 28 1HD1 LEU 28 6.406 -1.454 5.742
224 HD12 LEU 28 2HD1 LEU 28 7.926 -0.999 4.973
225 HD13 LEU 28 3HD1 LEU 28 7.163 0.091 6.130
226 HD21 LEU 28 3HD2 LEU 28 8.326 -3.502 6.047
227 HD22 LEU 28 1HD2 LEU 28 6.883 -3.353 7.049
228 HD23 LEU 28 2HD2 LEU 28 8.462 -3.564 7.805
229 H LEU 29 H LEU 29 12.372 -0.947 6.805
230 HA LEU 29 HA LEU 29 13.479 -3.489 7.380
231 HG LEU 29 HG LEU 29 13.037 -3.105 5.014
232 HB2 LEU 29 2HB LEU 29 14.569 -1.017 6.068
233 HB3 LEU 29 3HB LEU 29 15.547 -2.467 6.289
234 HD11 LEU 29 1HD1 LEU 29 14.420 -0.689 4.104
235 HD12 LEU 29 2HD1 LEU 29 12.782 -1.254 3.779
236 HD13 LEU 29 3HD1 LEU 29 14.135 -1.891 2.844
237 HD21 LEU 29 3HD2 LEU 29 14.376 -4.406 3.668
238 HD22 LEU 29 1HD2 LEU 29 15.368 -4.277 5.120
239 HD23 LEU 29 2HD2 LEU 29 15.722 -3.267 3.718
240 H SER 30 H SER 30 14.142 -0.235 8.586
241 HA SER 30 HA SER 30 16.442 -0.797 10.067
242 HG SER 30 HG SER 30 15.211 1.043 12.451
243 HB2 SER 30 2HB SER 30 15.857 1.488 9.733
244 HB3 SER 30 3HB SER 30 14.263 1.258 10.453
245 H SER 31 H SER 31 13.045 -1.244 10.827
246 HA SER 31 HA SER 31 13.218 -1.681 13.572
247 HG SER 31 HG SER 31 10.000 -3.174 13.446
248 HB2 SER 31 2HB SER 31 11.092 -1.459 12.296
249 HB3 SER 31 3HB SER 31 11.351 -3.074 11.638
250 H SER 32 H SER 32 13.906 -3.814 10.875
251 HA SER 32 HA SER 32 14.017 -6.247 12.263
252 HG SER 32 HG SER 32 15.778 -7.623 9.497
253 HB2 SER 32 2HB SER 32 14.022 -5.992 9.771
254 HB3 SER 32 3HB SER 32 15.700 -5.460 9.874
255 H GLY 33 H GLY 33 16.086 -7.525 12.571
256 HA2 GLY 33 2HA GLY 33 17.665 -6.308 14.538
257 HA3 GLY 33 3HA GLY 33 18.049 -7.817 13.723
258 H MET 34 H MET 34 18.256 -6.759 11.085
259 HA MET 34 HA MET 34 20.876 -5.497 11.334
260 HB2 MET 34 2HB MET 34 19.481 -6.705 8.939
261 HB3 MET 34 3HB MET 34 21.115 -6.055 8.933
262 HG2 MET 34 2HG MET 34 21.897 -7.761 10.373
263 HG3 MET 34 3HG MET 34 20.258 -8.300 10.731
264 HE1 MET 34 3HE MET 34 22.070 -11.192 8.740
265 HE2 MET 34 1HE MET 34 23.188 -9.870 9.079
266 HE3 MET 34 2HE MET 34 22.026 -10.379 10.305
267 H ALA 35 H ALA 35 21.467 -3.729 9.887
268 HA ALA 35 HA ALA 35 19.292 -2.142 8.792
269 HB1 ALA 35 1HB ALA 35 21.070 -0.578 10.549
270 HB2 ALA 35 2HB ALA 35 19.344 -0.402 10.228
271 HB3 ALA 35 3HB ALA 35 19.911 -1.633 11.357
272 H PHE 36 H PHE 36 20.002 -1.757 6.801
273 HA PHE 36 HA PHE 36 22.799 -0.896 6.459
274 HD1 PHE 36 HD1 PHE 36 19.834 -2.072 3.480
275 HD2 PHE 36 HD2 PHE 36 21.741 -4.594 6.330
276 HE1 PHE 36 HE1 PHE 36 17.941 -3.639 3.356
277 HE2 PHE 36 HE2 PHE 36 19.852 -6.165 6.208
278 HZ PHE 36 HZ PHE 36 17.949 -5.689 4.720
279 HB2 PHE 36 2HB PHE 36 22.215 -1.848 4.005
280 HB3 PHE 36 3HB PHE 36 22.949 -2.828 5.270
281 H SER 37 H SER 37 22.993 0.180 4.149
282 HA SER 37 HA SER 37 21.340 2.518 4.262
283 HG SER 37 HG SER 37 22.052 3.537 1.602
284 HB2 SER 37 2HB SER 37 23.318 3.270 3.472
285 HB3 SER 37 3HB SER 37 23.782 1.678 2.871
286 H LEU 38 H LEU 38 19.624 3.055 3.044
287 HA LEU 38 HA LEU 38 18.772 1.128 0.986
288 HG LEU 38 HG LEU 38 15.891 0.772 3.274
289 HB2 LEU 38 2HB LEU 38 17.249 2.787 2.954
290 HB3 LEU 38 3HB LEU 38 16.480 2.256 1.460
291 HD11 LEU 38 1HD1 LEU 38 16.214 -0.154 1.004
292 HD12 LEU 38 2HD1 LEU 38 16.509 -1.331 2.282
293 HD13 LEU 38 3HD1 LEU 38 17.867 -0.581 1.445
294 HD21 LEU 38 3HD2 LEU 38 17.368 -0.253 4.703
295 HD22 LEU 38 1HD2 LEU 38 18.174 1.295 4.445
296 HD23 LEU 38 2HD2 LEU 38 18.716 -0.138 3.570
297 H HIS 39 H HIS 39 19.567 1.996 -0.865
298 HA HIS 39 HA HIS 39 18.542 4.649 -1.603
299 HD1 HIS 39 HD1 HIS 39 22.834 3.294 -0.625
300 HD2 HIS 39 HD2 HIS 39 21.199 2.810 -4.413
301 HE1 HIS 39 HE1 HIS 39 24.284 1.589 -1.770
302 HB2 HIS 39 2HB HIS 39 20.635 5.206 -2.703
303 HB3 HIS 39 3HB HIS 39 20.941 4.833 -1.010
304 H THR 40 H THR 40 18.507 5.002 -3.969
305 HA THR 40 HA THR 40 18.098 2.469 -5.423
306 HB THR 40 HB THR 40 16.125 3.165 -6.312
307 HG1 THR 40 HG1 THR 40 15.833 5.139 -7.130
308 HG21 THR 40 3HG2 THR 40 15.971 5.173 -4.100
309 HG22 THR 40 1HG2 THR 40 16.134 3.460 -3.717
310 HG23 THR 40 2HG2 THR 40 14.754 4.025 -4.657
311 H GLN 41 H GLN 41 19.140 2.235 -7.306
312 HA GLN 41 HA GLN 41 20.634 2.639 -8.978
313 HB2 GLN 41 2HB GLN 41 18.468 4.376 -9.280
314 HB3 GLN 41 3HB GLN 41 19.887 5.385 -9.529
315 HG2 GLN 41 2HG GLN 41 20.674 3.568 -11.141
316 HG3 GLN 41 3HG GLN 41 19.019 2.966 -11.067
317 HE21 GLN 41 1HE2 GLN 41 17.462 3.968 -12.210
318 HE22 GLN 41 2HE2 GLN 41 17.720 5.358 -13.203
319 H GLY 42 H GLY 42 21.446 3.346 -6.266
320 HA2 GLY 42 2HA GLY 42 23.398 4.171 -5.349
321 HA3 GLY 42 3HA GLY 42 23.835 4.782 -6.938
322 H ARG 43 H ARG 43 20.807 5.605 -5.407
323 HA ARG 43 HA ARG 43 21.861 8.279 -4.779
324 HE ARG 43 HE ARG 43 20.484 9.660 -10.209
325 HB2 ARG 43 2HB ARG 43 19.260 7.663 -6.193
326 HB3 ARG 43 3HB ARG 43 19.748 9.256 -5.630
327 HG2 ARG 43 2HG ARG 43 21.836 8.866 -7.116
328 HG3 ARG 43 3HG ARG 43 20.834 7.636 -7.890
329 HD2 ARG 43 2HD ARG 43 19.144 9.289 -8.405
330 HD3 ARG 43 3HD ARG 43 20.049 10.526 -7.533
331 HH11 ARG 43 1HH1 ARG 43 22.107 10.835 -7.362
332 HH12 ARG 43 2HH1 ARG 43 23.432 11.521 -8.241
333 HH21 ARG 43 1HH2 ARG 43 22.224 10.560 -11.378
334 HH22 ARG 43 2HH2 ARG 43 23.497 11.365 -10.526
335 H VAL 44 H VAL 44 21.479 8.835 -2.745
336 HA VAL 44 HA VAL 44 20.146 7.268 -0.889
337 HB VAL 44 HB VAL 44 20.538 10.257 -0.702
338 HG11 VAL 44 1HG1 VAL 44 20.664 9.758 1.744
339 HG12 VAL 44 2HG1 VAL 44 19.076 9.488 1.024
340 HG13 VAL 44 3HG1 VAL 44 20.129 8.118 1.380
341 HG21 VAL 44 3HG2 VAL 44 22.709 9.700 -0.962
342 HG22 VAL 44 1HG2 VAL 44 22.572 9.191 0.721
343 HG23 VAL 44 2HG2 VAL 44 22.430 8.002 -0.575
344 H LEU 45 H LEU 45 18.116 7.251 -0.004
345 HA LEU 45 HA LEU 45 16.033 8.532 -1.595
346 HG LEU 45 HG LEU 45 15.709 5.777 -2.237
347 HB2 LEU 45 2HB LEU 45 16.257 6.131 0.044
348 HB3 LEU 45 3HB LEU 45 14.768 7.029 0.333
349 HD11 LEU 45 1HD1 LEU 45 14.387 4.587 -0.296
350 HD12 LEU 45 2HD1 LEU 45 13.985 4.301 -1.989
351 HD13 LEU 45 3HD1 LEU 45 13.015 5.419 -1.030
352 HD21 LEU 45 3HD2 LEU 45 14.635 7.341 -3.388
353 HD22 LEU 45 1HD2 LEU 45 14.156 8.159 -1.900
354 HD23 LEU 45 2HD2 LEU 45 13.142 6.879 -2.567
355 H SER 46 H SER 46 14.718 10.109 -0.872
356 HA SER 46 HA SER 46 15.433 11.452 1.574
357 HG SER 46 HG SER 46 13.007 12.414 -1.450
358 HB2 SER 46 2HB SER 46 13.845 13.160 0.871
359 HB3 SER 46 3HB SER 46 14.860 12.700 -0.495
360 H GLU 47 H GLU 47 14.032 11.901 3.320
361 HA GLU 47 HA GLU 47 12.573 9.745 4.295
362 HB2 GLU 47 2HB GLU 47 12.351 12.662 5.056
363 HB3 GLU 47 3HB GLU 47 11.710 11.323 5.997
364 HG2 GLU 47 2HG GLU 47 14.183 10.475 5.910
365 HG3 GLU 47 3HG GLU 47 14.532 12.172 5.585
366 H ALA 48 H ALA 48 11.625 12.287 2.160
367 HA ALA 48 HA ALA 48 8.803 11.484 2.391
368 HB1 ALA 48 1HB ALA 48 8.957 13.750 0.760
369 HB2 ALA 48 2HB ALA 48 8.397 13.667 2.430
370 HB3 ALA 48 3HB ALA 48 10.085 14.040 2.084
371 H ALA 49 H ALA 49 11.364 10.596 0.694
372 HA ALA 49 HA ALA 49 10.694 10.884 -2.009
373 HB1 ALA 49 1HB ALA 49 12.820 9.885 -0.745
374 HB2 ALA 49 2HB ALA 49 12.020 8.373 -1.173
375 HB3 ALA 49 3HB ALA 49 12.459 9.525 -2.434
376 H GLU 50 H GLU 50 8.969 10.177 -3.063
377 HA GLU 50 HA GLU 50 7.786 7.601 -2.265
378 HB2 GLU 50 2HB GLU 50 5.995 8.808 -1.628
379 HB3 GLU 50 3HB GLU 50 6.543 10.242 -2.485
380 HG2 GLU 50 2HG GLU 50 5.600 9.477 -4.530
381 HG3 GLU 50 3HG GLU 50 5.256 7.890 -3.844
382 H LEU 51 H LEU 51 7.866 6.155 -3.841
383 HA LEU 51 HA LEU 51 8.331 7.035 -6.581
384 HG LEU 51 HG LEU 51 10.590 6.142 -6.336
385 HB2 LEU 51 2HB LEU 51 8.450 4.339 -5.250
386 HB3 LEU 51 3HB LEU 51 8.665 4.572 -6.984
387 HD11 LEU 51 1HD1 LEU 51 10.841 6.526 -4.163
388 HD12 LEU 51 2HD1 LEU 51 11.406 4.863 -4.013
389 HD13 LEU 51 3HD1 LEU 51 9.707 5.245 -3.734
390 HD21 LEU 51 3HD2 LEU 51 11.041 4.063 -7.398
391 HD22 LEU 51 1HD2 LEU 51 10.688 3.161 -5.925
392 HD23 LEU 51 2HD2 LEU 51 12.124 4.182 -6.010
393 H ASN 52 H ASN 52 6.698 4.041 -5.848
394 HA ASN 52 HA ASN 52 4.042 4.785 -6.186
395 HB2 ASN 52 2HB ASN 52 5.393 5.178 -8.562
396 HB3 ASN 52 3HB ASN 52 4.677 3.583 -8.777
397 HD21 ASN 52 1HD2 ASN 52 4.144 6.402 -9.825
398 HD22 ASN 52 2HD2 ASN 52 2.434 6.580 -9.649
399 H ASP 53 H ASP 53 2.960 2.710 -7.609
400 HA ASP 53 HA ASP 53 3.058 0.584 -5.816
401 HB2 ASP 53 2HB ASP 53 2.059 -0.704 -7.881
402 HB3 ASP 53 3HB ASP 53 1.136 0.575 -7.098
403 H LYS 54 H LYS 54 4.152 -1.324 -5.720
404 HA LYS 54 HA LYS 54 5.858 -2.800 -6.010
405 HB2 LYS 54 2HB LYS 54 5.557 -1.993 -8.909
406 HB3 LYS 54 3HB LYS 54 6.465 -3.386 -8.335
407 HG2 LYS 54 2HG LYS 54 3.977 -3.726 -7.193
408 HG3 LYS 54 3HG LYS 54 3.618 -3.079 -8.796
409 HD2 LYS 54 2HD LYS 54 5.247 -4.833 -9.681
410 HD3 LYS 54 3HD LYS 54 5.147 -5.568 -8.079
411 HE2 LYS 54 2HE LYS 54 3.523 -6.715 -9.270
412 HE3 LYS 54 3HE LYS 54 2.590 -5.462 -8.453
413 HZ1 LYS 54 3HZ LYS 54 3.149 -4.194 -10.690
414 HZ2 LYS 54 1HZ LYS 54 1.796 -5.198 -10.540
415 HZ3 LYS 54 2HZ LYS 54 3.198 -5.775 -11.289
416 H MET 55 H MET 55 6.690 -0.405 -5.066
417 HA MET 55 HA MET 55 8.579 1.057 -6.418
418 HB2 MET 55 2HB MET 55 8.624 0.206 -3.518
419 HB3 MET 55 3HB MET 55 9.624 1.481 -4.201
420 HG2 MET 55 2HG MET 55 7.498 2.633 -4.885
421 HG3 MET 55 3HG MET 55 6.635 1.437 -3.920
422 HE1 MET 55 3HE MET 55 5.757 2.062 -1.864
423 HE2 MET 55 1HE MET 55 6.225 3.450 -0.882
424 HE3 MET 55 2HE MET 55 5.583 3.696 -2.506
425 H VAL 56 H VAL 56 10.986 1.023 -6.091
426 HA VAL 56 HA VAL 56 12.107 -1.671 -5.876
427 HB VAL 56 HB VAL 56 12.590 0.141 -8.246
428 HG11 VAL 56 1HG1 VAL 56 14.030 -1.663 -9.077
429 HG12 VAL 56 2HG1 VAL 56 14.634 -0.990 -7.562
430 HG13 VAL 56 3HG1 VAL 56 13.794 -2.541 -7.566
431 HG21 VAL 56 3HG2 VAL 56 10.630 -0.882 -8.822
432 HG22 VAL 56 1HG2 VAL 56 11.770 -2.117 -9.358
433 HG23 VAL 56 2HG2 VAL 56 10.940 -2.294 -7.812
434 H ILE 57 H ILE 57 13.226 -1.163 -4.034
435 HA ILE 57 HA ILE 57 15.157 1.052 -4.209
436 HB ILE 57 HB ILE 57 14.399 -0.327 -1.651
437 HG12 ILE 57 2HG1 ILE 57 12.295 0.416 -2.562
438 HG13 ILE 57 3HG1 ILE 57 12.770 1.540 -1.294
439 HG21 ILE 57 1HG2 ILE 57 15.948 1.054 -0.859
440 HG22 ILE 57 2HG2 ILE 57 16.111 1.848 -2.424
441 HG23 ILE 57 3HG2 ILE 57 14.889 2.400 -1.279
442 HD11 ILE 57 3HD1 ILE 57 13.829 2.553 -3.686
443 HD12 ILE 57 1HD1 ILE 57 12.174 2.055 -4.035
444 HD13 ILE 57 2HD1 ILE 57 12.495 3.195 -2.727
445 H ASP 58 H ASP 58 17.302 0.723 -3.523
446 HA ASP 58 HA ASP 58 18.149 -2.096 -3.595
447 HB2 ASP 58 2HB ASP 58 19.974 0.226 -4.154
448 HB3 ASP 58 3HB ASP 58 20.135 -1.453 -4.663
449 H ALA 59 H ALA 59 18.589 -2.848 -1.634
450 HA ALA 59 HA ALA 59 19.529 -1.053 0.458
451 HB1 ALA 59 1HB ALA 59 17.871 -3.281 0.446
452 HB2 ALA 59 2HB ALA 59 19.352 -3.833 1.228
453 HB3 ALA 59 3HB ALA 59 18.491 -2.431 1.862
454 H PHE 60 H PHE 60 21.642 -0.665 0.540
455 HA PHE 60 HA PHE 60 23.515 -2.808 -0.180
456 HD1 PHE 60 HD1 PHE 60 26.503 -2.059 -0.085
457 HD2 PHE 60 HD2 PHE 60 24.494 1.555 0.927
458 HE1 PHE 60 HE1 PHE 60 28.502 -1.291 1.128
459 HE2 PHE 60 HE2 PHE 60 26.490 2.329 2.140
460 HZ PHE 60 HZ PHE 60 28.497 0.906 2.241
461 HB2 PHE 60 2HB PHE 60 24.466 -1.152 -1.361
462 HB3 PHE 60 3HB PHE 60 23.497 0.076 -0.551
463 H VAL 61 H VAL 61 24.539 -3.858 1.380
464 HA VAL 61 HA VAL 61 24.521 -2.750 4.090
465 HB VAL 61 HB VAL 61 24.969 -4.949 4.895
466 HG11 VAL 61 1HG1 VAL 61 22.711 -4.314 3.414
467 HG12 VAL 61 2HG1 VAL 61 23.156 -5.929 2.861
468 HG13 VAL 61 3HG1 VAL 61 22.872 -5.630 4.576
469 HG21 VAL 61 3HG2 VAL 61 26.429 -6.163 3.710
470 HG22 VAL 61 1HG2 VAL 61 25.029 -6.696 2.778
471 HG23 VAL 61 2HG2 VAL 61 26.013 -5.351 2.200
472 HA PRO 62 HA PRO 62 28.808 -1.794 4.129
473 HB2 PRO 62 2HB PRO 62 29.407 -2.264 6.735
474 HB3 PRO 62 3HB PRO 62 28.453 -0.873 6.204
475 HG2 PRO 62 2HG PRO 62 27.527 -3.480 7.347
476 HG3 PRO 62 3HG PRO 62 26.962 -1.838 7.705
477 HD2 PRO 62 2HD PRO 62 25.622 -3.511 6.051
478 HD3 PRO 62 3HD PRO 62 25.631 -1.750 5.825
479 H ALA 63 H ALA 63 30.692 -2.802 3.699
480 HA ALA 63 HA ALA 63 30.871 -5.676 4.326
481 HB1 ALA 63 1HB ALA 63 32.663 -5.378 2.336
482 HB2 ALA 63 2HB ALA 63 30.970 -5.802 2.078
483 HB3 ALA 63 3HB ALA 63 31.497 -4.128 1.900
484 H ASP 64 H ASP 64 32.915 -6.535 4.912
485 HA ASP 64 HA ASP 64 34.341 -5.119 6.803
486 HB2 ASP 64 2HB ASP 64 35.251 -7.453 5.108
487 HB3 ASP 64 3HB ASP 64 36.101 -6.872 6.538
488 H GLY 65 H GLY 65 35.813 -3.552 6.730
489 HA2 GLY 65 2HA GLY 65 38.031 -3.244 5.250
490 HA3 GLY 65 3HA GLY 65 36.793 -2.654 4.150
491 H ALA 66 H ALA 66 39.025 -1.223 5.398
492 HA ALA 66 HA ALA 66 39.485 0.746 6.455
493 HB1 ALA 66 1HB ALA 66 38.242 2.505 5.717
494 HB2 ALA 66 2HB ALA 66 37.648 1.261 4.617
495 HB3 ALA 66 3HB ALA 66 36.705 1.701 6.041
496 H GLY 67 H GLY 67 39.744 -0.027 8.563
497 HA2 GLY 67 2HA GLY 67 38.689 1.108 10.680
498 HA3 GLY 67 3HA GLY 67 37.393 -0.019 10.311
499 H LEU 68 H LEU 68 40.944 -0.312 10.286
500 HA LEU 68 HA LEU 68 40.929 -2.948 11.285
501 HG LEU 68 HG LEU 68 42.532 -3.514 9.716
502 HB2 LEU 68 2HB LEU 68 42.857 -1.023 10.429
503 HB3 LEU 68 3HB LEU 68 43.387 -1.726 11.955
504 HD11 LEU 68 1HD1 LEU 68 44.074 -2.086 8.601
505 HD12 LEU 68 2HD1 LEU 68 44.934 -3.570 9.011
506 HD13 LEU 68 3HD1 LEU 68 45.184 -2.112 9.971
507 HD21 LEU 68 3HD2 LEU 68 43.286 -5.099 11.076
508 HD22 LEU 68 1HD2 LEU 68 43.520 -3.865 12.314
509 HD23 LEU 68 2HD2 LEU 68 44.846 -4.290 11.231
510 H GLU 69 H GLU 69 42.291 -0.100 12.943
511 HA GLU 69 HA GLU 69 41.717 -1.372 15.506
512 HB2 GLU 69 2HB GLU 69 43.289 1.128 14.856
513 HB3 GLU 69 3HB GLU 69 43.123 0.422 16.458
514 HG2 GLU 69 2HG GLU 69 44.344 -1.008 14.112
515 HG3 GLU 69 3HG GLU 69 45.266 -0.095 15.305