Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
578314 | 2mpc RC | 19875 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H THR 4 1H THR 4 -0.500 -0.433 -0.750
2 HA THR 4 HA THR 4 1.827 -0.474 0.910
3 HB THR 4 HB THR 4 3.111 -0.770 -1.151
4 HG1 THR 4 HG1 THR 4 0.678 -0.112 -2.505
5 HG21 THR 4 3HG2 THR 4 0.415 -2.177 -1.306
6 HG22 THR 4 1HG2 THR 4 1.913 -2.708 -2.106
7 HG23 THR 4 2HG2 THR 4 1.807 -2.702 -0.329
8 HA PRO 5 HA PRO 5 3.459 3.567 1.119
9 HB2 PRO 5 1HB PRO 5 6.010 2.420 -0.085
10 HB3 PRO 5 2HB PRO 5 5.816 3.351 1.406
11 HG2 PRO 5 1HG PRO 5 6.230 0.723 1.555
12 HG3 PRO 5 2HG PRO 5 5.055 1.477 2.640
13 HD2 PRO 5 1HD PRO 5 4.545 -0.158 0.123
14 HD3 PRO 5 2HD PRO 5 3.651 -0.161 1.648
15 H SER 6 HN SER 6 3.997 1.750 -1.867
16 HA SER 6 HA SER 6 4.552 4.052 -3.566
17 HB2 SER 6 1HB SER 6 4.339 2.666 -5.339
18 HB3 SER 6 2HB SER 6 5.194 1.791 -4.048
19 HG SER 6 HG SER 6 2.970 0.961 -3.561
20 H ASP 7 HN ASP 7 1.630 2.468 -2.355
21 HA ASP 7 HA ASP 7 -0.167 3.795 -4.240
22 HB2 ASP 7 1HB ASP 7 -0.726 2.292 -1.612
23 HB3 ASP 7 2HB ASP 7 -1.863 3.120 -2.704
24 H HIS 8 HN HIS 8 1.018 4.439 -0.977
25 HA HIS 8 HA HIS 8 -0.698 6.768 -0.604
26 HB2 HIS 8 1HB HIS 8 1.823 5.809 0.819
27 HB3 HIS 8 2HB HIS 8 0.899 7.252 1.298
28 HD1 HIS 8 HD1 HIS 8 -1.770 6.672 1.797
29 HD2 HIS 8 HD2 HIS 8 0.962 3.481 2.135
30 HE1 HIS 8 HE1 HIS 8 -2.847 5.012 3.230
31 H LEU 9 HN LEU 9 2.620 6.235 -1.737
32 HA LEU 9 HA LEU 9 3.219 9.019 -2.171
33 HB2 LEU 9 1HB LEU 9 4.079 6.479 -3.375
34 HB3 LEU 9 2HB LEU 9 4.884 7.975 -3.903
35 HG LEU 9 HG LEU 9 4.840 6.932 -1.046
36 HD11 LEU 9 1HD1 LEU 9 7.253 6.370 -1.439
37 HD12 LEU 9 2HD1 LEU 9 6.191 5.460 -2.537
38 HD13 LEU 9 3HD1 LEU 9 7.080 6.881 -3.134
39 HD21 LEU 9 3HD2 LEU 9 5.034 9.344 -1.189
40 HD22 LEU 9 1HD2 LEU 9 6.579 8.642 -0.656
41 HD23 LEU 9 2HD2 LEU 9 6.386 9.197 -2.337
42 H LEU 10 HN LEU 10 1.673 6.548 -4.190
43 HA LEU 10 HA LEU 10 1.383 8.122 -6.545
44 HB2 LEU 10 1HB LEU 10 1.007 5.790 -6.265
45 HB3 LEU 10 2HB LEU 10 -0.554 6.013 -5.442
46 HG LEU 10 HG LEU 10 0.050 7.079 -8.221
47 HD11 LEU 10 1HD1 LEU 10 -1.293 5.140 -9.076
48 HD12 LEU 10 2HD1 LEU 10 0.171 4.589 -8.229
49 HD13 LEU 10 3HD1 LEU 10 -1.410 4.509 -7.417
50 HD21 LEU 10 3HD2 LEU 10 -1.735 8.223 -7.044
51 HD22 LEU 10 1HD2 LEU 10 -2.409 7.260 -8.380
52 HD23 LEU 10 2HD2 LEU 10 -2.543 6.674 -6.704
53 H SER 11 HN SER 11 -0.912 7.713 -3.834
54 HA SER 11 HA SER 11 -2.922 9.533 -4.808
55 HB2 SER 11 1HB SER 11 -2.291 8.627 -2.065
56 HB3 SER 11 2HB SER 11 -3.701 9.590 -2.564
57 HG SER 11 HG SER 11 -4.132 7.341 -2.515
58 H THR 12 HN THR 12 -0.048 9.970 -2.727
59 HA THR 12 HA THR 12 -0.599 12.688 -1.981
60 HB THR 12 HB THR 12 2.058 11.214 -2.214
61 HG1 THR 12 HG1 THR 12 0.344 11.739 0.017
62 HG21 THR 12 3HG2 THR 12 1.341 13.804 -0.783
63 HG22 THR 12 1HG2 THR 12 2.913 12.974 -0.706
64 HG23 THR 12 2HG2 THR 12 2.347 13.668 -2.245
65 H LEU 13 HN LEU 13 1.312 11.310 -4.650
66 HA LEU 13 HA LEU 13 1.938 14.016 -5.644
67 HB2 LEU 13 1HB LEU 13 2.402 11.275 -6.618
68 HB3 LEU 13 2HB LEU 13 3.092 12.654 -7.505
69 HG LEU 13 HG LEU 13 3.783 11.757 -4.680
70 HD11 LEU 13 1HD1 LEU 13 6.058 11.370 -5.665
71 HD12 LEU 13 2HD1 LEU 13 4.821 10.390 -6.488
72 HD13 LEU 13 3HD1 LEU 13 5.438 11.873 -7.255
73 HD21 LEU 13 3HD2 LEU 13 3.771 14.178 -4.816
74 HD22 LEU 13 1HD2 LEU 13 5.445 13.585 -4.693
75 HD23 LEU 13 2HD2 LEU 13 4.806 14.131 -6.263
76 H GLU 14 HN GLU 14 -0.528 11.666 -6.074
77 HA GLU 14 HA GLU 14 -1.519 12.689 -8.606
78 HB2 GLU 14 1HB GLU 14 -2.176 10.520 -7.669
79 HB3 GLU 14 2HB GLU 14 -2.960 11.356 -6.307
80 HG2 GLU 14 1HG GLU 14 -4.569 12.431 -7.979
81 HG3 GLU 14 2HG GLU 14 -3.666 11.514 -9.207
82 H GLU 15 HN GLU 15 -2.185 13.469 -5.197
83 HA GLU 15 HA GLU 15 -4.055 15.596 -5.843
84 HB2 GLU 15 1HB GLU 15 -2.423 14.944 -3.390
85 HB3 GLU 15 2HB GLU 15 -3.562 16.308 -3.487
86 HG2 GLU 15 1HG GLU 15 -5.445 14.643 -3.901
87 HG3 GLU 15 2HG GLU 15 -4.174 13.401 -3.823
88 H LEU 16 HN LEU 16 -0.572 15.384 -5.551
89 HA LEU 16 HA LEU 16 0.059 18.139 -5.351
90 HB2 LEU 16 1HB LEU 16 1.588 16.428 -5.144
91 HB3 LEU 16 2HB LEU 16 1.513 15.883 -6.836
92 HG LEU 16 HG LEU 16 2.338 18.171 -7.512
93 HD11 LEU 16 1HD1 LEU 16 3.489 19.522 -5.738
94 HD12 LEU 16 2HD1 LEU 16 1.750 19.358 -5.400
95 HD13 LEU 16 3HD1 LEU 16 2.928 18.362 -4.512
96 HD21 LEU 16 3HD2 LEU 16 3.818 16.251 -7.477
97 HD22 LEU 16 1HD2 LEU 16 4.698 17.704 -6.947
98 HD23 LEU 16 2HD2 LEU 16 4.155 16.505 -5.748
99 H VAL 17 HN VAL 17 -0.279 19.829 -6.539
100 HA VAL 17 HA VAL 17 -1.663 19.698 -9.081
101 HB VAL 17 HB VAL 17 -0.087 21.971 -7.802
102 HG11 VAL 17 1HG1 VAL 17 -1.380 23.415 -9.336
103 HG12 VAL 17 2HG1 VAL 17 -0.372 22.260 -10.240
104 HG13 VAL 17 3HG1 VAL 17 -2.120 21.973 -10.069
105 HG21 VAL 17 3HG2 VAL 17 -1.917 21.232 -6.397
106 HG22 VAL 17 1HG2 VAL 17 -2.272 22.820 -7.115
107 HG23 VAL 17 2HG2 VAL 17 -3.045 21.356 -7.768
108 HA PRO 18 HA PRO 18 1.481 18.489 -11.795
109 HB2 PRO 18 1HB PRO 18 -0.191 20.179 -13.719
110 HB3 PRO 18 2HB PRO 18 0.427 18.537 -13.947
111 HG2 PRO 18 1HG PRO 18 -2.147 18.887 -13.357
112 HG3 PRO 18 2HG PRO 18 -1.256 17.568 -12.586
113 HD2 PRO 18 1HD PRO 18 -2.104 20.234 -11.408
114 HD3 PRO 18 2HD PRO 18 -2.006 18.652 -10.624
115 H TYR 19 HN TYR 19 0.370 21.863 -11.768
116 HA TYR 19 HA TYR 19 2.742 22.925 -13.005
117 HB2 TYR 19 1HB TYR 19 0.698 24.118 -11.128
118 HB3 TYR 19 2HB TYR 19 2.029 25.044 -11.864
119 HD1 TYR 19 HD2 TYR 19 2.137 25.156 -14.413
120 HD2 TYR 19 HD1 TYR 19 -1.310 23.768 -12.321
121 HE1 TYR 19 HE2 TYR 19 0.768 25.538 -16.436
122 HE2 TYR 19 HE1 TYR 19 -2.697 24.145 -14.340
123 HH TYR 19 HH TYR 19 -1.307 25.420 -17.367
124 H ASP 20 HN ASP 20 1.974 22.004 -9.707
125 HA ASP 20 HA ASP 20 4.500 23.118 -8.672
126 HB2 ASP 20 1HB ASP 20 2.383 21.315 -7.351
127 HB3 ASP 20 2HB ASP 20 3.939 21.899 -6.711
128 H PHE 21 HN PHE 21 3.274 20.040 -9.837
129 HA PHE 21 HA PHE 21 5.475 18.414 -8.969
130 HB2 PHE 21 1HB PHE 21 3.388 17.424 -9.820
131 HB3 PHE 21 2HB PHE 21 3.679 18.144 -11.419
132 HD1 PHE 21 HD1 PHE 21 5.147 15.790 -8.940
133 HD2 PHE 21 HD2 PHE 21 4.830 16.984 -13.029
134 HE1 PHE 21 HE1 PHE 21 6.387 13.764 -9.626
135 HE2 PHE 21 HE2 PHE 21 6.068 14.959 -13.719
136 HZ PHE 21 HZ PHE 21 6.848 13.349 -12.016
137 H GLU 22 HN GLU 22 5.039 20.522 -11.773
138 HA GLU 22 HA GLU 22 7.346 19.933 -13.249
139 HB2 GLU 22 1HB GLU 22 5.697 21.630 -13.860
140 HB3 GLU 22 2HB GLU 22 6.250 22.651 -12.511
141 HG2 GLU 22 1HG GLU 22 8.518 22.846 -13.647
142 HG3 GLU 22 2HG GLU 22 7.835 21.769 -14.887
143 H LYS 23 HN LYS 23 7.114 21.880 -10.280
144 HA LYS 23 HA LYS 23 10.029 22.275 -10.214
145 HB2 LYS 23 1HB LYS 23 7.816 22.858 -8.242
146 HB3 LYS 23 2HB LYS 23 9.533 23.237 -7.970
147 HG2 LYS 23 1HG LYS 23 9.501 24.709 -9.964
148 HG3 LYS 23 2HG LYS 23 7.767 24.365 -10.169
149 HD2 LYS 23 1HD LYS 23 7.319 25.318 -7.937
150 HD3 LYS 23 2HD LYS 23 9.052 25.680 -7.751
151 HE2 LYS 23 1HE LYS 23 8.959 27.157 -9.709
152 HE3 LYS 23 2HE LYS 23 7.231 26.789 -9.910
153 HZ1 LYS 23 3HZ LYS 23 8.439 28.124 -7.573
154 HZ2 LYS 23 1HZ LYS 23 7.569 28.869 -8.759
155 HZ3 LYS 23 2HZ LYS 23 6.836 27.782 -7.758
156 H PHE 24 HN PHE 24 7.669 20.094 -8.796
157 HA PHE 24 HA PHE 24 9.260 18.923 -6.765
158 HB2 PHE 24 1HB PHE 24 6.864 18.386 -7.091
159 HB3 PHE 24 2HB PHE 24 7.255 17.561 -8.617
160 HD1 PHE 24 HD2 PHE 24 8.438 15.443 -8.619
161 HD2 PHE 24 HD1 PHE 24 7.281 17.370 -4.986
162 HE1 PHE 24 HE2 PHE 24 8.778 13.325 -7.390
163 HE2 PHE 24 HE1 PHE 24 7.621 15.254 -3.753
164 HZ PHE 24 HZ PHE 24 8.370 13.232 -4.955
165 H LYS 25 HN LYS 25 9.033 18.004 -10.210
166 HA LYS 25 HA LYS 25 11.005 15.884 -9.892
167 HB2 LYS 25 1HB LYS 25 10.800 15.563 -12.215
168 HB3 LYS 25 2HB LYS 25 9.174 15.915 -11.583
169 HG2 LYS 25 1HG LYS 25 9.433 18.272 -12.363
170 HG3 LYS 25 2HG LYS 25 10.992 17.820 -13.095
171 HD2 LYS 25 1HD LYS 25 9.720 16.036 -14.390
172 HD3 LYS 25 2HD LYS 25 8.225 16.819 -13.823
173 HE2 LYS 25 1HE LYS 25 8.940 18.933 -14.856
174 HE3 LYS 25 2HE LYS 25 10.433 18.150 -15.425
175 HZ1 LYS 25 3HZ LYS 25 7.693 17.397 -16.218
176 HZ2 LYS 25 1HZ LYS 25 8.763 18.240 -17.148
177 HZ3 LYS 25 2HZ LYS 25 9.077 16.671 -16.746
178 H PHE 26 HN PHE 26 11.134 19.286 -10.615
179 HA PHE 26 HA PHE 26 13.858 19.284 -11.621
180 HB2 PHE 26 1HB PHE 26 12.106 21.436 -10.369
181 HB3 PHE 26 2HB PHE 26 13.754 21.736 -10.965
182 HD1 PHE 26 HD1 PHE 26 12.832 19.398 -13.170
183 HD2 PHE 26 HD2 PHE 26 11.708 23.357 -12.023
184 HE1 PHE 26 HE1 PHE 26 11.940 19.801 -15.440
185 HE2 PHE 26 HE2 PHE 26 10.813 23.763 -14.291
186 HZ PHE 26 HZ PHE 26 10.930 21.984 -16.001
187 H LYS 27 HN LYS 27 12.404 19.421 -8.411
188 HA LYS 27 HA LYS 27 15.006 19.857 -7.109
189 HB2 LYS 27 1HB LYS 27 12.246 19.178 -6.094
190 HB3 LYS 27 2HB LYS 27 13.672 19.345 -5.044
191 HG2 LYS 27 1HG LYS 27 12.553 21.526 -6.838
192 HG3 LYS 27 2HG LYS 27 12.254 21.388 -5.089
193 HD2 LYS 27 1HD LYS 27 14.698 21.545 -4.685
194 HD3 LYS 27 2HD LYS 27 14.952 21.761 -6.434
195 HE2 LYS 27 1HE LYS 27 13.587 23.801 -6.387
196 HE3 LYS 27 2HE LYS 27 13.315 23.583 -4.643
197 HZ1 LYS 27 3HZ LYS 27 15.933 24.033 -5.925
198 HZ2 LYS 27 1HZ LYS 27 15.074 25.158 -5.078
199 HZ3 LYS 27 2HZ LYS 27 15.681 23.832 -4.308
200 H LEU 28 HN LEU 28 12.964 17.145 -7.983
201 HA LEU 28 HA LEU 28 14.310 15.172 -6.376
202 HB2 LEU 28 1HB LEU 28 12.194 14.951 -7.375
203 HB3 LEU 28 2HB LEU 28 12.817 14.847 -9.038
204 HG LEU 28 HG LEU 28 14.100 12.804 -8.364
205 HD11 LEU 28 1HD1 LEU 28 13.415 11.653 -6.243
206 HD12 LEU 28 2HD1 LEU 28 14.146 13.240 -5.910
207 HD13 LEU 28 3HD1 LEU 28 12.379 13.042 -5.842
208 HD21 LEU 28 3HD2 LEU 28 11.991 12.609 -9.543
209 HD22 LEU 28 1HD2 LEU 28 12.151 11.286 -8.363
210 HD23 LEU 28 2HD2 LEU 28 11.093 12.673 -8.008
211 H GLN 29 HN GLN 29 14.955 16.511 -9.582
212 HA GLN 29 HA GLN 29 17.115 14.731 -10.237
213 HB2 GLN 29 1HB GLN 29 16.470 17.575 -11.022
214 HB3 GLN 29 2HB GLN 29 17.864 16.677 -11.667
215 HG2 GLN 29 1HG GLN 29 16.072 14.945 -12.702
216 HG3 GLN 29 2HG GLN 29 15.043 16.057 -11.769
217 HE21 GLN 29 2HE2 GLN 29 14.610 15.511 -14.475
218 HE22 GLN 29 1HE2 GLN 29 14.932 16.942 -15.397
219 H ASN 30 HN ASN 30 16.882 17.467 -8.100
220 HA ASN 30 HA ASN 30 19.860 17.551 -7.847
221 HB2 ASN 30 1HB ASN 30 17.857 19.666 -6.755
222 HB3 ASN 30 2HB ASN 30 19.602 19.340 -6.619
223 HD21 ASN 30 2HD2 ASN 30 17.063 20.609 -8.542
224 HD22 ASN 30 1HD2 ASN 30 18.030 21.161 -9.868
225 H THR 31 HN THR 31 17.722 15.592 -6.690
226 HA THR 31 HA THR 31 18.243 15.939 -3.796
227 HB THR 31 HB THR 31 16.739 13.768 -5.317
228 HG1 THR 31 HG1 THR 31 15.822 15.999 -3.777
229 HG21 THR 31 3HG2 THR 31 16.912 14.373 -2.338
230 HG22 THR 31 1HG2 THR 31 15.874 13.139 -3.090
231 HG23 THR 31 2HG2 THR 31 17.645 12.975 -3.159
232 H SER 32 HN SER 32 19.654 14.908 -2.599
233 HA SER 32 HA SER 32 21.971 13.652 -3.762
234 HB2 SER 32 1HB SER 32 22.101 14.810 -1.762
235 HB3 SER 32 2HB SER 32 20.988 13.669 -0.973
236 HG SER 32 HG SER 32 22.531 12.027 -1.411
237 H VAL 33 HN VAL 33 22.500 11.571 -4.128
238 HA VAL 33 HA VAL 33 20.396 9.510 -4.102
239 HB VAL 33 HB VAL 33 23.378 9.350 -4.712
240 HG11 VAL 33 1HG1 VAL 33 22.814 7.167 -5.726
241 HG12 VAL 33 2HG1 VAL 33 22.437 7.182 -3.987
242 HG13 VAL 33 3HG1 VAL 33 21.129 7.350 -5.184
243 HG21 VAL 33 3HG2 VAL 33 22.201 10.775 -6.279
244 HG22 VAL 33 1HG2 VAL 33 22.678 9.244 -7.051
245 HG23 VAL 33 2HG2 VAL 33 20.988 9.501 -6.555
246 H GLN 34 HN GLN 34 20.005 7.932 -2.779
247 HA GLN 34 HA GLN 34 21.084 8.140 -0.091
248 HB2 GLN 34 1HB GLN 34 19.366 6.031 -1.418
249 HB3 GLN 34 2HB GLN 34 19.729 6.115 0.322
250 HG2 GLN 34 1HG GLN 34 17.924 8.201 -1.187
251 HG3 GLN 34 2HG GLN 34 17.689 6.825 -0.084
252 HE21 GLN 34 2HE2 GLN 34 18.239 10.173 -0.363
253 HE22 GLN 34 1HE2 GLN 34 18.550 10.516 1.306
254 H LYS 35 HN LYS 35 22.218 6.614 1.110
255 HA LYS 35 HA LYS 35 24.604 5.815 -0.248
256 HB2 LYS 35 1HB LYS 35 24.467 6.398 2.136
257 HB3 LYS 35 2HB LYS 35 23.525 4.917 2.429
258 HG2 LYS 35 1HG LYS 35 25.425 3.537 1.774
259 HG3 LYS 35 2HG LYS 35 26.369 4.990 1.366
260 HD2 LYS 35 1HD LYS 35 26.305 5.718 3.699
261 HD3 LYS 35 2HD LYS 35 25.294 4.316 4.126
262 HE2 LYS 35 1HE LYS 35 27.097 2.795 3.484
263 HE3 LYS 35 2HE LYS 35 28.106 4.176 2.994
264 HZ1 LYS 35 3HZ LYS 35 27.144 3.641 5.731
265 HZ2 LYS 35 1HZ LYS 35 28.681 3.388 5.188
266 HZ3 LYS 35 2HZ LYS 35 28.079 4.922 5.277
267 H GLU 36 HN GLU 36 25.064 4.183 -1.472
268 HA GLU 36 HA GLU 36 24.972 2.080 -2.458
269 HB2 GLU 36 1HB GLU 36 23.910 1.326 0.270
270 HB3 GLU 36 2HB GLU 36 24.449 0.185 -0.986
271 HG2 GLU 36 1HG GLU 36 26.794 1.189 -0.799
272 HG3 GLU 36 2HG GLU 36 26.078 2.248 0.437
273 H HIS 37 HN HIS 37 22.776 3.830 -2.882
274 HA HIS 37 HA HIS 37 20.828 1.697 -3.663
275 HB2 HIS 37 1HB HIS 37 20.168 4.478 -2.595
276 HB3 HIS 37 2HB HIS 37 18.996 3.405 -3.396
277 HD1 HIS 37 HD1 HIS 37 18.696 1.012 -2.105
278 HD2 HIS 37 HD2 HIS 37 20.276 4.113 0.194
279 HE1 HIS 37 HE1 HIS 37 18.367 0.317 0.177
280 H SER 38 HN SER 38 19.469 2.292 -5.507
281 HA SER 38 HA SER 38 21.346 3.028 -7.671
282 HB2 SER 38 1HB SER 38 18.569 2.014 -7.709
283 HB3 SER 38 2HB SER 38 19.601 2.343 -9.119
284 HG SER 38 HG SER 38 19.694 0.158 -8.441
285 H ARG 39 HN ARG 39 21.275 4.798 -8.943
286 HA ARG 39 HA ARG 39 19.530 7.034 -8.065
287 HB2 ARG 39 1HB ARG 39 21.836 7.511 -8.248
288 HB3 ARG 39 2HB ARG 39 21.850 6.965 -9.941
289 HG2 ARG 39 1HG ARG 39 20.281 8.795 -10.515
290 HG3 ARG 39 2HG ARG 39 20.357 9.361 -8.828
291 HD2 ARG 39 1HD ARG 39 22.716 9.805 -9.080
292 HD3 ARG 39 2HD ARG 39 22.650 9.225 -10.761
293 HE ARG 39 HE ARG 39 20.856 11.509 -10.464
294 HH11 ARG 39 1HH1 ARG 39 24.262 10.769 -10.563
295 HH12 ARG 39 2HH1 ARG 39 24.594 12.359 -11.220
296 HH21 ARG 39 1HH2 ARG 39 21.221 13.337 -11.209
297 HH22 ARG 39 2HH2 ARG 39 22.862 13.825 -11.588
298 H ILE 40 HN ILE 40 17.821 7.753 -9.077
299 HA ILE 40 HA ILE 40 17.014 6.602 -11.672
300 HB ILE 40 HB ILE 40 15.818 8.849 -9.985
301 HG12 ILE 40 1HG1 ILE 40 14.901 6.009 -10.342
302 HG13 ILE 40 2HG1 ILE 40 15.815 6.624 -8.946
303 HG21 ILE 40 1HG2 ILE 40 13.835 8.576 -11.434
304 HG22 ILE 40 2HG2 ILE 40 15.258 9.063 -12.383
305 HG23 ILE 40 3HG2 ILE 40 14.710 7.371 -12.406
306 HD11 ILE 40 3HD1 ILE 40 13.061 7.562 -9.822
307 HD12 ILE 40 1HD1 ILE 40 13.407 6.493 -8.444
308 HD13 ILE 40 2HD1 ILE 40 13.976 8.179 -8.426
309 HA PRO 41 HA PRO 41 19.341 9.406 -14.134
310 HB2 PRO 41 1HB PRO 41 17.314 8.406 -16.172
311 HB3 PRO 41 2HB PRO 41 19.077 8.468 -16.308
312 HG2 PRO 41 1HG PRO 41 17.881 6.122 -15.890
313 HG3 PRO 41 2HG PRO 41 19.383 6.494 -15.033
314 HD2 PRO 41 1HD PRO 41 16.525 6.566 -13.982
315 HD3 PRO 41 2HD PRO 41 17.991 6.002 -13.171
316 H ARG 42 HN ARG 42 19.140 11.425 -14.720
317 HA ARG 42 HA ARG 42 16.796 12.870 -13.867
318 HB2 ARG 42 1HB ARG 42 19.200 13.680 -15.425
319 HB3 ARG 42 2HB ARG 42 17.851 14.779 -15.053
320 HG2 ARG 42 1HG ARG 42 18.221 14.422 -12.650
321 HG3 ARG 42 2HG ARG 42 19.569 13.320 -13.021
322 HD2 ARG 42 1HD ARG 42 20.898 15.048 -13.821
323 HD3 ARG 42 2HD ARG 42 19.524 16.174 -13.911
324 HE ARG 42 HE ARG 42 19.872 15.638 -11.130
325 HH11 ARG 42 1HH1 ARG 42 21.898 16.896 -13.674
326 HH12 ARG 42 2HH1 ARG 42 22.760 17.880 -12.509
327 HH21 ARG 42 1HH2 ARG 42 20.856 16.753 -9.782
328 HH22 ARG 42 2HH2 ARG 42 22.168 17.799 -10.289
329 H SER 43 HN SER 43 17.839 11.596 -16.973
330 HA SER 43 HA SER 43 15.915 12.917 -18.682
331 HB2 SER 43 1HB SER 43 16.336 11.289 -20.232
332 HB3 SER 43 2HB SER 43 17.856 11.805 -19.467
333 HG SER 43 HG SER 43 17.690 9.526 -19.722
334 H GLN 44 HN GLN 44 15.742 10.157 -16.466
335 HA GLN 44 HA GLN 44 13.054 9.387 -17.393
336 HB2 GLN 44 1HB GLN 44 14.720 8.550 -15.010
337 HB3 GLN 44 2HB GLN 44 13.137 7.862 -15.442
338 HG2 GLN 44 1HG GLN 44 15.764 7.413 -17.104
339 HG3 GLN 44 2HG GLN 44 14.709 6.474 -16.023
340 HE21 GLN 44 2HE2 GLN 44 15.440 7.164 -19.200
341 HE22 GLN 44 1HE2 GLN 44 13.956 6.669 -19.946
342 H ILE 45 HN ILE 45 14.493 11.154 -14.686
343 HA ILE 45 HA ILE 45 12.078 11.491 -13.164
344 HB ILE 45 HB ILE 45 14.570 13.231 -13.426
345 HG12 ILE 45 1HG1 ILE 45 13.682 11.437 -11.185
346 HG13 ILE 45 2HG1 ILE 45 14.795 10.951 -12.485
347 HG21 ILE 45 1HG2 ILE 45 13.774 14.376 -11.386
348 HG22 ILE 45 2HG2 ILE 45 12.632 14.599 -12.731
349 HG23 ILE 45 3HG2 ILE 45 12.269 13.430 -11.441
350 HD11 ILE 45 3HD1 ILE 45 15.259 13.202 -10.497
351 HD12 ILE 45 1HD1 ILE 45 16.029 11.600 -10.454
352 HD13 ILE 45 2HD1 ILE 45 16.371 12.716 -11.797
353 H GLN 46 HN GLN 46 13.460 13.457 -15.774
354 HA GLN 46 HA GLN 46 11.497 15.530 -15.634
355 HB2 GLN 46 1HB GLN 46 13.623 15.667 -16.877
356 HB3 GLN 46 2HB GLN 46 13.004 14.462 -18.031
357 HG2 GLN 46 1HG GLN 46 11.131 16.303 -18.688
358 HG3 GLN 46 2HG GLN 46 12.020 17.098 -17.368
359 HE21 GLN 46 2HE2 GLN 46 11.672 18.318 -19.837
360 HE22 GLN 46 1HE2 GLN 46 13.200 18.417 -20.648
361 H ARG 47 HN ARG 47 11.430 12.346 -17.115
362 HA ARG 47 HA ARG 47 8.916 13.068 -18.557
363 HB2 ARG 47 1HB ARG 47 10.748 10.735 -18.884
364 HB3 ARG 47 2HB ARG 47 9.206 10.975 -19.738
365 HG2 ARG 47 1HG ARG 47 10.082 13.021 -20.766
366 HG3 ARG 47 2HG ARG 47 11.620 12.807 -19.895
367 HD2 ARG 47 1HD ARG 47 11.996 10.733 -21.099
368 HD3 ARG 47 2HD ARG 47 10.475 10.986 -21.988
369 HE ARG 47 HE ARG 47 12.120 13.252 -22.593
370 HH11 ARG 47 1HH1 ARG 47 12.373 9.796 -22.988
371 HH12 ARG 47 2HH1 ARG 47 13.340 10.026 -24.432
372 HH21 ARG 47 1HH2 ARG 47 13.232 13.531 -24.240
373 HH22 ARG 47 2HH2 ARG 47 13.831 12.156 -25.146
374 H ALA 48 HN ALA 48 9.917 11.663 -15.683
375 HA ALA 48 HA ALA 48 8.016 9.488 -15.552
376 HB1 ALA 48 3HB ALA 48 9.460 10.984 -13.337
377 HB2 ALA 48 1HB ALA 48 8.580 9.450 -13.153
378 HB3 ALA 48 2HB ALA 48 10.041 9.521 -14.167
379 H ARG 49 HN ARG 49 6.008 9.355 -14.755
380 HA ARG 49 HA ARG 49 4.522 11.870 -14.395
381 HB2 ARG 49 1HB ARG 49 3.649 9.018 -14.304
382 HB3 ARG 49 2HB ARG 49 2.593 10.428 -14.057
383 HG2 ARG 49 1HG ARG 49 3.152 11.221 -16.330
384 HG3 ARG 49 2HG ARG 49 4.157 9.772 -16.573
385 HD2 ARG 49 1HD ARG 49 1.205 9.762 -16.032
386 HD3 ARG 49 2HD ARG 49 1.961 9.655 -17.639
387 HE ARG 49 HE ARG 49 2.928 7.417 -16.089
388 HH11 ARG 49 1HH1 ARG 49 -0.112 8.556 -17.362
389 HH12 ARG 49 2HH1 ARG 49 -0.675 6.903 -17.513
390 HH21 ARG 49 1HH2 ARG 49 2.294 5.519 -16.248
391 HH22 ARG 49 2HH2 ARG 49 0.696 5.170 -16.877
392 HA PRO 50 HA PRO 50 4.490 12.265 -10.031
393 HB2 PRO 50 1HB PRO 50 1.460 12.369 -10.268
394 HB3 PRO 50 2HB PRO 50 2.548 13.538 -9.507
395 HG2 PRO 50 1HG PRO 50 1.451 14.116 -11.868
396 HG3 PRO 50 2HG PRO 50 3.144 14.535 -11.571
397 HD2 PRO 50 1HD PRO 50 2.014 12.205 -13.176
398 HD3 PRO 50 2HD PRO 50 3.407 13.230 -13.541
399 H VAL 51 HN VAL 51 2.235 10.004 -11.545
400 HA VAL 51 HA VAL 51 2.072 8.424 -9.019
401 HB VAL 51 HB VAL 51 0.505 7.015 -10.255
402 HG11 VAL 51 1HG1 VAL 51 -1.263 8.677 -10.727
403 HG12 VAL 51 2HG1 VAL 51 -0.384 9.084 -9.235
404 HG13 VAL 51 3HG1 VAL 51 -0.043 9.972 -10.740
405 HG21 VAL 51 3HG2 VAL 51 1.593 7.042 -12.419
406 HG22 VAL 51 1HG2 VAL 51 -0.120 7.497 -12.567
407 HG23 VAL 51 2HG2 VAL 51 1.142 8.749 -12.646
408 H LYS 52 HN LYS 52 4.013 8.586 -11.807
409 HA LYS 52 HA LYS 52 4.737 5.731 -11.753
410 HB2 LYS 52 1HB LYS 52 4.712 7.079 -13.830
411 HB3 LYS 52 2HB LYS 52 6.032 8.069 -13.164
412 HG2 LYS 52 1HG LYS 52 7.538 6.185 -13.175
413 HG3 LYS 52 2HG LYS 52 6.221 5.076 -13.626
414 HD2 LYS 52 1HD LYS 52 5.958 6.265 -15.770
415 HD3 LYS 52 2HD LYS 52 7.284 7.363 -15.320
416 HE2 LYS 52 1HE LYS 52 8.851 5.506 -15.256
417 HE3 LYS 52 2HE LYS 52 7.538 4.352 -15.583
418 HZ1 LYS 52 3HZ LYS 52 8.452 6.474 -17.418
419 HZ2 LYS 52 1HZ LYS 52 8.787 4.866 -17.569
420 HZ3 LYS 52 2HZ LYS 52 7.234 5.403 -17.722
421 H MET 53 HN MET 53 6.023 8.786 -10.548
422 HA MET 53 HA MET 53 8.623 7.792 -9.830
423 HB2 MET 53 1HB MET 53 6.916 10.055 -8.813
424 HB3 MET 53 2HB MET 53 8.553 9.719 -8.200
425 HG2 MET 53 1HG MET 53 9.458 10.034 -10.469
426 HG3 MET 53 2HG MET 53 7.820 10.392 -11.067
427 HE1 MET 53 3HE MET 53 8.925 12.649 -12.123
428 HE2 MET 53 1HE MET 53 9.768 13.870 -11.140
429 HE3 MET 53 2HE MET 53 10.496 12.262 -11.379
430 H ALA 54 HN ALA 54 5.495 7.584 -8.275
431 HA ALA 54 HA ALA 54 6.315 6.816 -5.682
432 HB1 ALA 54 3HB ALA 54 3.963 5.797 -7.310
433 HB2 ALA 54 1HB ALA 54 4.158 5.632 -5.550
434 HB3 ALA 54 2HB ALA 54 3.974 7.246 -6.278
435 H THR 55 HN THR 55 6.001 4.873 -8.640
436 HA THR 55 HA THR 55 6.854 2.418 -7.286
437 HB THR 55 HB THR 55 6.638 3.087 -10.252
438 HG1 THR 55 HG1 THR 55 4.683 1.844 -10.033
439 HG21 THR 55 3HG2 THR 55 6.933 0.419 -8.816
440 HG22 THR 55 1HG2 THR 55 6.685 0.637 -10.564
441 HG23 THR 55 2HG2 THR 55 8.185 1.214 -9.799
442 H LEU 56 HN LEU 56 8.377 4.882 -9.329
443 HA LEU 56 HA LEU 56 10.791 3.430 -9.818
444 HB2 LEU 56 1HB LEU 56 10.099 6.283 -9.643
445 HB3 LEU 56 2HB LEU 56 11.722 5.836 -10.219
446 HG LEU 56 HG LEU 56 9.084 5.098 -11.546
447 HD11 LEU 56 1HD1 LEU 56 9.852 6.647 -13.364
448 HD12 LEU 56 2HD1 LEU 56 9.673 7.506 -11.817
449 HD13 LEU 56 3HD1 LEU 56 11.291 7.045 -12.397
450 HD21 LEU 56 3HD2 LEU 56 10.765 3.376 -11.846
451 HD22 LEU 56 1HD2 LEU 56 10.495 4.236 -13.381
452 HD23 LEU 56 2HD2 LEU 56 11.945 4.585 -12.407
453 H LEU 57 HN LEU 57 9.990 5.816 -7.294
454 HA LEU 57 HA LEU 57 12.623 5.868 -6.159
455 HB2 LEU 57 1HB LEU 57 9.917 6.376 -5.123
456 HB3 LEU 57 2HB LEU 57 11.313 6.775 -4.096
457 HG LEU 57 HG LEU 57 10.696 7.994 -6.815
458 HD11 LEU 57 1HD1 LEU 57 10.238 10.084 -5.504
459 HD12 LEU 57 2HD1 LEU 57 9.134 8.771 -5.034
460 HD13 LEU 57 3HD1 LEU 57 10.520 9.182 -3.997
461 HD21 LEU 57 3HD2 LEU 57 13.079 7.852 -6.389
462 HD22 LEU 57 1HD2 LEU 57 12.545 9.547 -6.291
463 HD23 LEU 57 2HD2 LEU 57 12.871 8.628 -4.801
464 H VAL 58 HN VAL 58 9.829 3.795 -5.576
465 HA VAL 58 HA VAL 58 10.978 2.447 -3.254
466 HB VAL 58 HB VAL 58 8.805 1.629 -5.227
467 HG11 VAL 58 1HG1 VAL 58 8.239 -0.116 -3.570
468 HG12 VAL 58 2HG1 VAL 58 9.883 -0.350 -4.210
469 HG13 VAL 58 3HG1 VAL 58 9.648 0.355 -2.592
470 HG21 VAL 58 3HG2 VAL 58 8.222 3.569 -3.899
471 HG22 VAL 58 1HG2 VAL 58 7.279 2.149 -3.391
472 HG23 VAL 58 2HG2 VAL 58 8.655 2.701 -2.406
473 H THR 59 HN THR 59 10.997 1.789 -6.735
474 HA THR 59 HA THR 59 12.340 -0.763 -6.445
475 HB THR 59 HB THR 59 12.172 1.132 -8.826
476 HG1 THR 59 HG1 THR 59 10.545 -0.400 -9.472
477 HG21 THR 59 3HG2 THR 59 12.989 -1.796 -8.665
478 HG22 THR 59 1HG2 THR 59 12.796 -0.851 -10.160
479 HG23 THR 59 2HG2 THR 59 14.079 -0.430 -8.999
480 H TYR 60 HN TYR 60 13.475 2.555 -7.013
481 HA TYR 60 HA TYR 60 16.206 1.604 -7.549
482 HB2 TYR 60 1HB TYR 60 14.792 4.244 -7.493
483 HB3 TYR 60 2HB TYR 60 16.570 4.192 -7.401
484 HD1 TYR 60 HD1 TYR 60 13.643 3.309 -9.511
485 HD2 TYR 60 HD2 TYR 60 17.884 3.718 -9.340
486 HE1 TYR 60 HE1 TYR 60 13.757 3.074 -11.974
487 HE2 TYR 60 HE2 TYR 60 18.016 3.485 -11.797
488 HH TYR 60 HH TYR 60 16.857 3.186 -13.735
489 H TYR 61 HN TYR 61 14.451 3.097 -4.872
490 HA TYR 61 HA TYR 61 17.034 3.197 -3.343
491 HB2 TYR 61 1HB TYR 61 14.598 4.966 -3.058
492 HB3 TYR 61 2HB TYR 61 16.112 5.075 -2.127
493 HD1 TYR 61 HD2 TYR 61 18.188 5.865 -3.232
494 HD2 TYR 61 HD1 TYR 61 14.445 5.888 -5.276
495 HE1 TYR 61 HE2 TYR 61 19.136 7.391 -4.930
496 HE2 TYR 61 HE1 TYR 61 15.379 7.417 -6.986
497 HH TYR 61 HH TYR 61 18.619 8.805 -6.702
498 H GLY 62 HN GLY 62 13.505 2.790 -3.037
499 HA2 GLY 62 1HA GLY 62 13.110 0.525 -1.821
500 HA3 GLY 62 2HA GLY 62 13.993 1.313 -0.493
501 H GLU 63 HN GLU 63 11.512 0.414 0.047
502 HA GLU 63 HA GLU 63 9.375 2.261 -0.534
503 HB2 GLU 63 1HB GLU 63 9.783 0.200 1.633
504 HB3 GLU 63 2HB GLU 63 8.291 1.153 1.444
505 HG2 GLU 63 1HG GLU 63 7.943 0.118 -0.836
506 HG3 GLU 63 2HG GLU 63 9.513 -0.677 -0.579
507 H GLU 64 HN GLU 64 11.401 1.835 2.378
508 HA GLU 64 HA GLU 64 10.217 4.080 3.762
509 HB2 GLU 64 1HB GLU 64 12.833 2.610 4.091
510 HB3 GLU 64 2HB GLU 64 12.281 3.912 5.172
511 HG2 GLU 64 1HG GLU 64 10.293 2.496 5.827
512 HG3 GLU 64 2HG GLU 64 10.878 1.331 4.617
513 H TYR 65 HN TYR 65 12.897 3.751 1.514
514 HA TYR 65 HA TYR 65 13.895 6.460 2.017
515 HB2 TYR 65 1HB TYR 65 14.420 4.458 -0.189
516 HB3 TYR 65 2HB TYR 65 15.249 6.025 -0.013
517 HD1 TYR 65 HD2 TYR 65 16.737 6.411 1.957
518 HD2 TYR 65 HD1 TYR 65 15.067 2.575 1.138
519 HE1 TYR 65 HE2 TYR 65 18.397 5.378 3.470
520 HE2 TYR 65 HE1 TYR 65 16.722 1.522 2.650
521 HH TYR 65 HH TYR 65 19.144 3.448 4.423
522 H ALA 66 HN ALA 66 11.635 4.938 -0.196
523 HA ALA 66 HA ALA 66 11.420 7.147 -2.014
524 HB1 ALA 66 3HB ALA 66 9.377 5.025 -1.269
525 HB2 ALA 66 1HB ALA 66 9.286 6.107 -2.678
526 HB3 ALA 66 2HB ALA 66 10.592 4.903 -2.563
527 H VAL 67 HN VAL 67 9.733 6.337 1.001
528 HA VAL 67 HA VAL 67 7.882 8.574 0.918
529 HB VAL 67 HB VAL 67 8.999 6.946 3.238
530 HG11 VAL 67 1HG1 VAL 67 7.153 7.931 4.555
531 HG12 VAL 67 2HG1 VAL 67 8.274 9.189 3.984
532 HG13 VAL 67 3HG1 VAL 67 6.710 8.954 3.168
533 HG21 VAL 67 3HG2 VAL 67 7.665 5.639 1.696
534 HG22 VAL 67 1HG2 VAL 67 6.801 5.879 3.232
535 HG23 VAL 67 2HG2 VAL 67 6.345 6.829 1.798
536 H GLN 68 HN GLN 68 11.099 8.178 2.374
537 HA GLN 68 HA GLN 68 11.112 10.815 3.546
538 HB2 GLN 68 1HB GLN 68 13.304 8.889 2.763
539 HB3 GLN 68 2HB GLN 68 13.605 10.446 3.572
540 HG2 GLN 68 1HG GLN 68 12.166 9.478 5.637
541 HG3 GLN 68 2HG GLN 68 12.005 8.191 4.418
542 HE21 GLN 68 2HE2 GLN 68 12.956 7.841 7.084
543 HE22 GLN 68 1HE2 GLN 68 14.609 7.330 6.994
544 H LEU 69 HN LEU 69 12.297 9.532 0.456
545 HA LEU 69 HA LEU 69 13.599 11.944 -0.385
546 HB2 LEU 69 1HB LEU 69 12.356 9.648 -1.726
547 HB3 LEU 69 2HB LEU 69 13.151 10.866 -2.750
548 HG LEU 69 HG LEU 69 14.517 9.252 -0.563
549 HD11 LEU 69 1HD1 LEU 69 15.637 8.046 -2.456
550 HD12 LEU 69 2HD1 LEU 69 13.873 7.823 -2.502
551 HD13 LEU 69 3HD1 LEU 69 14.654 8.976 -3.610
552 HD21 LEU 69 3HD2 LEU 69 15.525 11.429 -0.915
553 HD22 LEU 69 1HD2 LEU 69 16.602 10.154 -1.533
554 HD23 LEU 69 2HD2 LEU 69 15.632 11.128 -2.666
555 H THR 70 HN THR 70 10.325 10.703 -1.073
556 HA THR 70 HA THR 70 9.535 12.967 -2.658
557 HB THR 70 HB THR 70 7.845 11.027 -1.024
558 HG1 THR 70 HG1 THR 70 8.530 11.100 -3.801
559 HG21 THR 70 3HG2 THR 70 7.068 12.957 -3.247
560 HG22 THR 70 1HG2 THR 70 5.991 11.766 -2.479
561 HG23 THR 70 2HG2 THR 70 6.638 13.124 -1.528
562 H LEU 71 HN LEU 71 9.172 12.252 0.807
563 HA LEU 71 HA LEU 71 7.605 14.516 1.489
564 HB2 LEU 71 1HB LEU 71 8.151 12.590 2.803
565 HB3 LEU 71 2HB LEU 71 9.774 13.194 3.209
566 HG LEU 71 HG LEU 71 7.224 14.728 3.808
567 HD11 LEU 71 1HD1 LEU 71 7.478 13.923 6.170
568 HD12 LEU 71 2HD1 LEU 71 7.202 12.567 5.052
569 HD13 LEU 71 3HD1 LEU 71 8.841 12.900 5.659
570 HD21 LEU 71 3HD2 LEU 71 9.243 16.066 3.695
571 HD22 LEU 71 1HD2 LEU 71 8.676 15.964 5.379
572 HD23 LEU 71 2HD2 LEU 71 10.061 14.981 4.845
573 H GLN 72 HN GLN 72 11.153 14.190 1.356
574 HA GLN 72 HA GLN 72 11.642 16.872 2.295
575 HB2 GLN 72 1HB GLN 72 13.295 14.886 0.731
576 HB3 GLN 72 2HB GLN 72 13.905 16.480 1.237
577 HG2 GLN 72 1HG GLN 72 13.544 15.657 3.772
578 HG3 GLN 72 2HG GLN 72 12.846 14.316 2.835
579 HE21 GLN 72 2HE2 GLN 72 14.879 14.065 4.813
580 HE22 GLN 72 1HE2 GLN 72 16.316 13.496 4.030
581 H VAL 73 HN VAL 73 11.327 15.463 -0.940
582 HA VAL 73 HA VAL 73 12.028 17.916 -2.352
583 HB VAL 73 HB VAL 73 10.454 15.453 -3.211
584 HG11 VAL 73 1HG1 VAL 73 10.799 16.291 -5.512
585 HG12 VAL 73 2HG1 VAL 73 9.835 17.437 -4.550
586 HG13 VAL 73 3HG1 VAL 73 11.557 17.763 -4.862
587 HG21 VAL 73 3HG2 VAL 73 12.765 14.968 -2.669
588 HG22 VAL 73 1HG2 VAL 73 12.491 14.864 -4.424
589 HG23 VAL 73 2HG2 VAL 73 13.311 16.286 -3.735
590 H LEU 74 HN LEU 74 8.992 16.557 -1.165
591 HA LEU 74 HA LEU 74 7.286 18.560 -2.297
592 HB2 LEU 74 1HB LEU 74 7.265 16.893 0.116
593 HB3 LEU 74 2HB LEU 74 5.857 17.945 -0.159
594 HG LEU 74 HG LEU 74 6.822 15.743 -2.025
595 HD11 LEU 74 1HD1 LEU 74 4.724 14.558 -1.324
596 HD12 LEU 74 2HD1 LEU 74 5.799 14.847 0.065
597 HD13 LEU 74 3HD1 LEU 74 4.374 15.882 -0.189
598 HD21 LEU 74 3HD2 LEU 74 5.782 17.578 -3.219
599 HD22 LEU 74 1HD2 LEU 74 4.711 16.156 -3.240
600 HD23 LEU 74 2HD2 LEU 74 4.366 17.515 -2.142
601 H ARG 75 HN ARG 75 9.055 18.463 0.790
602 HA ARG 75 HA ARG 75 8.159 21.049 1.687
603 HB2 ARG 75 1HB ARG 75 10.561 19.430 2.386
604 HB3 ARG 75 2HB ARG 75 10.169 21.008 3.107
605 HG2 ARG 75 1HG ARG 75 8.093 20.127 4.005
606 HG3 ARG 75 2HG ARG 75 8.370 18.567 3.193
607 HD2 ARG 75 1HD ARG 75 8.852 18.372 5.509
608 HD3 ARG 75 2HD ARG 75 10.359 18.244 4.571
609 HE ARG 75 HE ARG 75 10.045 20.958 5.661
610 HH11 ARG 75 1HH1 ARG 75 10.955 17.717 6.568
611 HH12 ARG 75 2HH1 ARG 75 11.988 18.354 7.832
612 HH21 ARG 75 1HH2 ARG 75 11.217 21.703 7.109
613 HH22 ARG 75 2HH2 ARG 75 12.137 20.628 8.143
614 H ALA 76 HN ALA 76 10.698 20.022 -0.503
615 HA ALA 76 HA ALA 76 12.103 22.531 -0.547
616 HB1 ALA 76 3HB ALA 76 11.908 20.357 -2.660
617 HB2 ALA 76 1HB ALA 76 13.094 21.682 -2.638
618 HB3 ALA 76 2HB ALA 76 13.116 20.448 -1.356
619 H ILE 77 HN ILE 77 9.135 21.454 -1.961
620 HA ILE 77 HA ILE 77 9.056 23.924 -3.679
621 HB ILE 77 HB ILE 77 7.331 22.738 -5.006
622 HG12 ILE 77 1HG1 ILE 77 7.961 20.311 -3.353
623 HG13 ILE 77 2HG1 ILE 77 6.560 21.372 -3.075
624 HG21 ILE 77 1HG2 ILE 77 8.790 21.046 -6.064
625 HG22 ILE 77 2HG2 ILE 77 9.696 22.532 -5.695
626 HG23 ILE 77 3HG2 ILE 77 9.875 21.099 -4.655
627 HD11 ILE 77 3HD1 ILE 77 7.135 19.816 -5.621
628 HD12 ILE 77 1HD1 ILE 77 5.925 19.388 -4.390
629 HD13 ILE 77 2HD1 ILE 77 5.736 20.878 -5.344
630 H ASN 78 HN ASN 78 8.357 23.373 -0.740
631 HA ASN 78 HA ASN 78 6.900 24.494 0.684
632 HB2 ASN 78 1HB ASN 78 5.886 26.073 -1.798
633 HB3 ASN 78 2HB ASN 78 5.587 26.080 -0.042
634 HD21 ASN 78 2HD2 ASN 78 6.822 28.004 -2.037
635 HD22 ASN 78 1HD2 ASN 78 8.314 28.478 -1.294
636 H GLN 79 HN GLN 79 6.203 21.935 -0.577
637 HA GLN 79 HA GLN 79 3.243 22.126 -0.157
638 HB2 GLN 79 1HB GLN 79 4.962 19.922 -1.317
639 HB3 GLN 79 2HB GLN 79 3.208 19.816 -1.039
640 HG2 GLN 79 1HG GLN 79 4.506 21.702 -3.195
641 HG3 GLN 79 2HG GLN 79 3.686 20.123 -3.180
642 HE21 GLN 79 2HE2 GLN 79 3.275 23.365 -3.709
643 HE22 GLN 79 1HE2 GLN 79 1.570 23.494 -3.431
644 H ARG 80 HN ARG 80 3.833 22.538 2.126
645 HA ARG 80 HA ARG 80 5.017 20.350 3.652
646 HB2 ARG 80 1HB ARG 80 3.630 22.853 4.486
647 HB3 ARG 80 2HB ARG 80 4.267 21.629 5.609
648 HG2 ARG 80 1HG ARG 80 6.525 21.982 4.750
649 HG3 ARG 80 2HG ARG 80 5.907 23.159 3.566
650 HD2 ARG 80 1HD ARG 80 5.223 24.611 5.382
651 HD3 ARG 80 2HD ARG 80 5.865 23.437 6.554
652 HE ARG 80 HE ARG 80 8.097 24.213 4.944
653 HH11 ARG 80 1HH1 ARG 80 5.812 25.865 6.994
654 HH12 ARG 80 2HH1 ARG 80 7.029 27.061 7.397
655 HH21 ARG 80 1HH2 ARG 80 9.499 25.579 5.388
656 HH22 ARG 80 2HH2 ARG 80 9.132 26.899 6.481
657 H LEU 81 HN LEU 81 1.790 21.264 2.688
658 HA LEU 81 HA LEU 81 0.345 19.649 4.567
659 HB2 LEU 81 1HB LEU 81 -0.669 21.268 3.335
660 HB3 LEU 81 2HB LEU 81 -0.318 20.590 1.728
661 HG LEU 81 HG LEU 81 -1.720 18.594 2.354
662 HD11 LEU 81 1HD1 LEU 81 -3.320 18.884 4.264
663 HD12 LEU 81 2HD1 LEU 81 -1.633 18.903 4.826
664 HD13 LEU 81 3HD1 LEU 81 -2.536 20.429 4.667
665 HD21 LEU 81 3HD2 LEU 81 -2.593 20.345 0.922
666 HD22 LEU 81 1HD2 LEU 81 -3.882 19.731 1.985
667 HD23 LEU 81 2HD2 LEU 81 -3.102 21.292 2.340
668 H LEU 82 HN LEU 82 1.409 18.906 1.235
669 HA LEU 82 HA LEU 82 0.539 16.159 1.370
670 HB2 LEU 82 1HB LEU 82 2.497 17.654 -0.237
671 HB3 LEU 82 2HB LEU 82 2.175 15.955 -0.656
672 HG LEU 82 HG LEU 82 0.162 18.237 -0.706
673 HD11 LEU 82 1HD1 LEU 82 0.181 17.856 -3.186
674 HD12 LEU 82 2HD1 LEU 82 1.794 18.313 -2.590
675 HD13 LEU 82 3HD1 LEU 82 1.433 16.611 -2.969
676 HD21 LEU 82 3HD2 LEU 82 -0.878 16.146 -0.058
677 HD22 LEU 82 1HD2 LEU 82 -1.378 16.586 -1.708
678 HD23 LEU 82 2HD2 LEU 82 -0.153 15.318 -1.456
679 H ALA 83 HN ALA 83 3.568 17.780 2.166
680 HA ALA 83 HA ALA 83 5.103 15.392 2.559
681 HB1 ALA 83 3HB ALA 83 5.379 18.122 3.860
682 HB2 ALA 83 1HB ALA 83 6.607 16.835 3.873
683 HB3 ALA 83 2HB ALA 83 6.140 17.604 2.338
684 H GLU 84 HN GLU 84 3.097 17.336 4.762
685 HA GLU 84 HA GLU 84 3.593 15.695 7.087
686 HB2 GLU 84 1HB GLU 84 2.717 17.958 7.234
687 HB3 GLU 84 2HB GLU 84 1.254 17.462 6.349
688 HG2 GLU 84 1HG GLU 84 0.702 15.893 8.308
689 HG3 GLU 84 2HG GLU 84 2.180 16.557 9.042
690 H GLU 85 HN GLU 85 1.063 15.645 4.588
691 HA GLU 85 HA GLU 85 -0.460 13.527 5.815
692 HB2 GLU 85 1HB GLU 85 -0.246 14.546 2.983
693 HB3 GLU 85 2HB GLU 85 -1.352 13.241 3.476
694 HG2 GLU 85 1HG GLU 85 -1.458 16.153 4.470
695 HG3 GLU 85 2HG GLU 85 -2.505 15.294 3.317
696 H LEU 86 HN LEU 86 2.251 13.548 3.551
697 HA LEU 86 HA LEU 86 2.243 10.698 3.083
698 HB2 LEU 86 1HB LEU 86 3.304 12.190 1.696
699 HB3 LEU 86 2HB LEU 86 4.471 12.796 2.893
700 HG LEU 86 HG LEU 86 5.439 10.498 3.041
701 HD11 LEU 86 1HD1 LEU 86 4.863 8.867 1.223
702 HD12 LEU 86 2HD1 LEU 86 3.443 9.246 2.226
703 HD13 LEU 86 3HD1 LEU 86 3.627 9.997 0.622
704 HD21 LEU 86 3HD2 LEU 86 6.489 12.185 1.651
705 HD22 LEU 86 1HD2 LEU 86 6.640 10.586 0.883
706 HD23 LEU 86 2HD2 LEU 86 5.437 11.754 0.282
707 H HIS 87 HN HIS 87 3.955 12.750 5.440
708 HA HIS 87 HA HIS 87 5.253 10.629 6.841
709 HB2 HIS 87 1HB HIS 87 5.800 13.004 7.249
710 HB3 HIS 87 2HB HIS 87 4.172 13.273 7.915
711 HD1 HIS 87 HD1 HIS 87 7.305 11.233 8.640
712 HD2 HIS 87 HD2 HIS 87 4.042 12.918 10.707
713 HE1 HIS 87 HE1 HIS 87 7.708 10.793 11.009
714 H ARG 88 HN ARG 88 2.013 12.038 7.254
715 HA ARG 88 HA ARG 88 1.293 10.374 9.495
716 HB2 ARG 88 1HB ARG 88 -0.376 11.834 7.502
717 HB3 ARG 88 2HB ARG 88 -1.020 10.909 8.878
718 HG2 ARG 88 1HG ARG 88 0.182 12.367 10.437
719 HG3 ARG 88 2HG ARG 88 0.862 13.282 9.069
720 HD2 ARG 88 1HD ARG 88 -1.419 13.920 8.430
721 HD3 ARG 88 2HD ARG 88 -2.016 13.108 9.897
722 HE ARG 88 HE ARG 88 -0.713 15.777 9.889
723 HH11 ARG 88 1HH1 ARG 88 -1.607 13.021 11.830
724 HH12 ARG 88 2HH1 ARG 88 -1.488 13.997 13.281
725 HH21 ARG 88 1HH2 ARG 88 -0.581 16.909 11.540
726 HH22 ARG 88 2HH2 ARG 88 -0.904 16.215 13.117
727 H ALA 89 HN ALA 89 1.072 9.934 5.995
728 HA ALA 89 HA ALA 89 -0.379 7.462 6.101
729 HB1 ALA 89 3HB ALA 89 1.617 8.468 4.044
730 HB2 ALA 89 1HB ALA 89 0.492 7.108 3.823
731 HB3 ALA 89 2HB ALA 89 -0.138 8.759 4.033
732 H ALA 90 HN ALA 90 3.083 8.231 6.235
733 HA ALA 90 HA ALA 90 3.981 5.507 6.264
734 HB1 ALA 90 3HB ALA 90 5.259 7.996 7.446
735 HB2 ALA 90 1HB ALA 90 6.072 6.437 7.179
736 HB3 ALA 90 2HB ALA 90 5.487 7.385 5.791
737 H ILE 91 HN ILE 91 2.872 7.704 8.796
738 HA ILE 91 HA ILE 91 3.479 5.950 11.022
739 HB ILE 91 HB ILE 91 1.390 8.141 10.642
740 HG12 ILE 91 1HG1 ILE 91 3.905 8.128 12.285
741 HG13 ILE 91 2HG1 ILE 91 3.795 8.749 10.621
742 HG21 ILE 91 1HG2 ILE 91 1.079 8.031 13.092
743 HG22 ILE 91 2HG2 ILE 91 0.618 6.497 12.318
744 HG23 ILE 91 3HG2 ILE 91 2.175 6.631 13.169
745 HD11 ILE 91 3HD1 ILE 91 2.231 9.783 13.012
746 HD12 ILE 91 1HD1 ILE 91 3.636 10.577 12.265
747 HD13 ILE 91 2HD1 ILE 91 2.120 10.403 11.349
748 H GLN 92 HN GLN 92 0.616 6.287 8.956
749 HA GLN 92 HA GLN 92 -0.914 4.286 10.350
750 HB2 GLN 92 1HB GLN 92 -0.981 5.322 7.512
751 HB3 GLN 92 2HB GLN 92 -2.144 4.140 8.158
752 HG2 GLN 92 1HG GLN 92 -2.906 6.056 9.890
753 HG3 GLN 92 2HG GLN 92 -1.526 6.815 9.063
754 HE21 GLN 92 2HE2 GLN 92 -4.110 7.957 9.260
755 HE22 GLN 92 1HE2 GLN 92 -4.781 8.055 7.666
756 H LEU 93 HN LEU 93 1.434 4.119 7.716
757 HA LEU 93 HA LEU 93 1.073 1.316 7.167
758 HB2 LEU 93 1HB LEU 93 3.273 3.246 6.926
759 HB3 LEU 93 2HB LEU 93 3.552 1.596 6.324
760 HG LEU 93 HG LEU 93 1.409 3.511 5.324
761 HD11 LEU 93 1HD1 LEU 93 2.797 3.603 3.237
762 HD12 LEU 93 2HD1 LEU 93 3.703 4.209 4.643
763 HD13 LEU 93 3HD1 LEU 93 4.016 2.571 4.021
764 HD21 LEU 93 3HD2 LEU 93 0.727 1.190 5.167
765 HD22 LEU 93 1HD2 LEU 93 1.062 1.836 3.542
766 HD23 LEU 93 2HD2 LEU 93 2.246 0.770 4.339
Start of MODEL 2
1 H THR 4 1H THR 4 -0.082 1.450 1.722
2 HA THR 4 HA THR 4 2.478 2.152 2.783
3 HB THR 4 HB THR 4 3.437 1.062 0.856
4 HG1 THR 4 HG1 THR 4 0.839 1.333 -0.312
5 HG21 THR 4 3HG2 THR 4 0.789 -0.269 1.555
6 HG22 THR 4 1HG2 THR 4 2.194 -1.072 0.816
7 HG23 THR 4 2HG2 THR 4 2.306 -0.427 2.471
8 HA PRO 5 HA PRO 5 3.704 5.979 1.119
9 HB2 PRO 5 1HB PRO 5 6.053 4.536 -0.179
10 HB3 PRO 5 2HB PRO 5 6.078 5.946 0.889
11 HG2 PRO 5 1HG PRO 5 6.805 3.574 1.854
12 HG3 PRO 5 2HG PRO 5 5.801 4.637 2.848
13 HD2 PRO 5 1HD PRO 5 4.971 2.179 1.257
14 HD3 PRO 5 2HD PRO 5 4.419 2.705 2.851
15 H SER 6 HN SER 6 3.603 3.206 -1.031
16 HA SER 6 HA SER 6 3.723 4.744 -3.529
17 HB2 SER 6 1HB SER 6 3.304 2.806 -4.616
18 HB3 SER 6 2HB SER 6 4.447 2.467 -3.296
19 HG SER 6 HG SER 6 2.550 1.751 -2.096
20 H ASP 7 HN ASP 7 1.279 4.046 -1.155
21 HA ASP 7 HA ASP 7 -0.915 4.672 -3.073
22 HB2 ASP 7 1HB ASP 7 -1.080 3.835 -0.115
23 HB3 ASP 7 2HB ASP 7 -2.351 4.233 -1.295
24 H HIS 8 HN HIS 8 0.801 5.998 -0.299
25 HA HIS 8 HA HIS 8 -1.068 8.247 -0.033
26 HB2 HIS 8 1HB HIS 8 1.604 7.569 1.264
27 HB3 HIS 8 2HB HIS 8 0.725 9.083 1.583
28 HD1 HIS 8 HD1 HIS 8 -1.747 8.764 2.616
29 HD2 HIS 8 HD2 HIS 8 0.748 5.376 2.845
30 HE1 HIS 8 HE1 HIS 8 -2.694 7.347 4.367
31 H LEU 9 HN LEU 9 2.140 7.691 -1.427
32 HA LEU 9 HA LEU 9 2.496 10.502 -2.135
33 HB2 LEU 9 1HB LEU 9 4.294 9.174 -1.680
34 HB3 LEU 9 2HB LEU 9 3.989 7.947 -2.930
35 HG LEU 9 HG LEU 9 4.325 9.712 -4.668
36 HD11 LEU 9 1HD1 LEU 9 5.448 11.843 -3.966
37 HD12 LEU 9 2HD1 LEU 9 3.835 11.689 -3.230
38 HD13 LEU 9 3HD1 LEU 9 5.291 11.346 -2.264
39 HD21 LEU 9 3HD2 LEU 9 6.122 8.187 -4.099
40 HD22 LEU 9 1HD2 LEU 9 6.785 9.796 -4.469
41 HD23 LEU 9 2HD2 LEU 9 6.649 9.255 -2.778
42 H LEU 10 HN LEU 10 1.839 7.544 -4.037
43 HA LEU 10 HA LEU 10 1.753 8.806 -6.559
44 HB2 LEU 10 1HB LEU 10 1.762 6.450 -5.906
45 HB3 LEU 10 2HB LEU 10 -0.010 6.438 -5.752
46 HG LEU 10 HG LEU 10 1.524 7.192 -8.269
47 HD11 LEU 10 1HD1 LEU 10 0.703 4.997 -9.166
48 HD12 LEU 10 2HD1 LEU 10 1.748 4.765 -7.745
49 HD13 LEU 10 3HD1 LEU 10 -0.020 4.638 -7.581
50 HD21 LEU 10 3HD2 LEU 10 -0.624 8.300 -8.088
51 HD22 LEU 10 1HD2 LEU 10 -0.686 7.061 -9.363
52 HD23 LEU 10 2HD2 LEU 10 -1.433 6.745 -7.777
53 H SER 11 HN SER 11 -0.998 8.115 -4.384
54 HA SER 11 HA SER 11 -3.076 9.124 -6.077
55 HB2 SER 11 1HB SER 11 -2.932 8.903 -3.133
56 HB3 SER 11 2HB SER 11 -4.370 9.323 -4.091
57 HG SER 11 HG SER 11 -4.236 7.085 -3.626
58 H THR 12 HN THR 12 -1.017 10.717 -3.622
59 HA THR 12 HA THR 12 -2.480 13.224 -3.701
60 HB THR 12 HB THR 12 0.335 12.611 -2.705
61 HG1 THR 12 HG1 THR 12 -1.364 11.498 -1.592
62 HG21 THR 12 3HG2 THR 12 -1.496 14.989 -2.197
63 HG22 THR 12 1HG2 THR 12 0.084 14.710 -1.429
64 HG23 THR 12 2HG2 THR 12 -0.014 15.010 -3.180
65 H LEU 13 HN LEU 13 0.445 12.013 -5.292
66 HA LEU 13 HA LEU 13 1.294 14.471 -6.442
67 HB2 LEU 13 1HB LEU 13 1.397 11.657 -7.285
68 HB3 LEU 13 2HB LEU 13 2.279 12.855 -8.261
69 HG LEU 13 HG LEU 13 2.785 12.176 -5.337
70 HD11 LEU 13 1HD1 LEU 13 4.978 11.309 -6.193
71 HD12 LEU 13 2HD1 LEU 13 3.609 10.440 -6.927
72 HD13 LEU 13 3HD1 LEU 13 4.466 11.697 -7.852
73 HD21 LEU 13 3HD2 LEU 13 3.166 14.529 -5.774
74 HD22 LEU 13 1HD2 LEU 13 4.721 13.699 -5.525
75 HD23 LEU 13 2HD2 LEU 13 4.197 14.134 -7.170
76 H GLU 14 HN GLU 14 -1.188 12.188 -7.473
77 HA GLU 14 HA GLU 14 -1.706 13.487 -10.011
78 HB2 GLU 14 1HB GLU 14 -3.378 11.712 -8.230
79 HB3 GLU 14 2HB GLU 14 -3.900 12.299 -9.827
80 HG2 GLU 14 1HG GLU 14 -1.969 11.053 -10.889
81 HG3 GLU 14 2HG GLU 14 -1.493 10.632 -9.228
82 H GLU 15 HN GLU 15 -2.704 14.089 -6.715
83 HA GLU 15 HA GLU 15 -4.869 15.911 -7.570
84 HB2 GLU 15 1HB GLU 15 -3.731 15.192 -4.864
85 HB3 GLU 15 2HB GLU 15 -5.092 16.308 -5.133
86 HG2 GLU 15 1HG GLU 15 -5.097 13.300 -5.788
87 HG3 GLU 15 2HG GLU 15 -5.857 14.176 -4.441
88 H LEU 16 HN LEU 16 -1.514 16.072 -6.767
89 HA LEU 16 HA LEU 16 -1.525 18.916 -6.103
90 HB2 LEU 16 1HB LEU 16 0.516 16.966 -6.937
91 HB3 LEU 16 2HB LEU 16 1.025 18.608 -6.477
92 HG LEU 16 HG LEU 16 -0.320 16.552 -4.679
93 HD11 LEU 16 1HD1 LEU 16 1.861 16.607 -3.439
94 HD12 LEU 16 2HD1 LEU 16 2.088 16.084 -5.124
95 HD13 LEU 16 3HD1 LEU 16 2.501 17.747 -4.645
96 HD21 LEU 16 3HD2 LEU 16 -1.061 18.799 -4.144
97 HD22 LEU 16 1HD2 LEU 16 0.025 18.197 -2.868
98 HD23 LEU 16 2HD2 LEU 16 0.624 19.368 -4.069
99 H VAL 17 HN VAL 17 -0.543 20.593 -7.308
100 HA VAL 17 HA VAL 17 -1.643 20.736 -9.986
101 HB VAL 17 HB VAL 17 0.397 22.519 -8.590
102 HG11 VAL 17 1HG1 VAL 17 -0.263 24.192 -10.286
103 HG12 VAL 17 2HG1 VAL 17 0.443 22.750 -11.051
104 HG13 VAL 17 3HG1 VAL 17 -1.321 22.990 -11.061
105 HG21 VAL 17 3HG2 VAL 17 -1.695 22.416 -7.372
106 HG22 VAL 17 1HG2 VAL 17 -1.499 23.998 -8.159
107 HG23 VAL 17 2HG2 VAL 17 -2.601 22.788 -8.859
108 HA PRO 18 HA PRO 18 1.364 18.488 -12.197
109 HB2 PRO 18 1HB PRO 18 0.213 20.188 -14.456
110 HB3 PRO 18 2HB PRO 18 0.462 18.438 -14.410
111 HG2 PRO 18 1HG PRO 18 -2.001 19.408 -14.115
112 HG3 PRO 18 2HG PRO 18 -1.478 18.057 -13.100
113 HD2 PRO 18 1HD PRO 18 -1.757 20.994 -12.363
114 HD3 PRO 18 2HD PRO 18 -2.111 19.564 -11.385
115 H TYR 19 HN TYR 19 0.953 21.987 -12.610
116 HA TYR 19 HA TYR 19 3.568 22.413 -13.753
117 HB2 TYR 19 1HB TYR 19 1.678 24.200 -12.217
118 HB3 TYR 19 2HB TYR 19 3.215 24.756 -12.922
119 HD1 TYR 19 HD2 TYR 19 3.521 24.534 -15.445
120 HD2 TYR 19 HD1 TYR 19 -0.271 24.081 -13.548
121 HE1 TYR 19 HE2 TYR 19 2.402 24.911 -17.616
122 HE2 TYR 19 HE1 TYR 19 -1.410 24.458 -15.716
123 HH TYR 19 HH TYR 19 0.415 25.070 -18.719
124 H ASP 20 HN ASP 20 2.408 22.057 -10.463
125 HA ASP 20 HA ASP 20 5.061 22.799 -9.366
126 HB2 ASP 20 1HB ASP 20 2.491 21.841 -7.967
127 HB3 ASP 20 2HB ASP 20 4.102 22.179 -7.290
128 H PHE 21 HN PHE 21 3.375 19.988 -10.438
129 HA PHE 21 HA PHE 21 5.121 18.069 -9.119
130 HB2 PHE 21 1HB PHE 21 2.913 17.444 -10.111
131 HB3 PHE 21 2HB PHE 21 3.564 17.800 -11.726
132 HD1 PHE 21 HD1 PHE 21 4.489 15.796 -8.708
133 HD2 PHE 21 HD2 PHE 21 4.262 16.042 -12.966
134 HE1 PHE 21 HE1 PHE 21 5.319 13.474 -8.884
135 HE2 PHE 21 HE2 PHE 21 5.091 13.719 -13.147
136 HZ PHE 21 HZ PHE 21 5.620 12.436 -11.104
137 H GLU 22 HN GLU 22 5.267 19.917 -12.131
138 HA GLU 22 HA GLU 22 7.760 18.781 -13.042
139 HB2 GLU 22 1HB GLU 22 6.467 21.480 -13.439
140 HB3 GLU 22 2HB GLU 22 7.984 20.978 -14.227
141 HG2 GLU 22 1HG GLU 22 5.224 19.682 -14.657
142 HG3 GLU 22 2HG GLU 22 6.163 20.761 -15.713
143 H LYS 23 HN LYS 23 6.961 21.322 -10.726
144 HA LYS 23 HA LYS 23 9.738 22.024 -10.205
145 HB2 LYS 23 1HB LYS 23 7.228 22.321 -8.548
146 HB3 LYS 23 2HB LYS 23 8.818 23.007 -8.134
147 HG2 LYS 23 1HG LYS 23 8.767 24.436 -10.093
148 HG3 LYS 23 2HG LYS 23 7.257 23.678 -10.650
149 HD2 LYS 23 1HD LYS 23 6.210 24.459 -8.468
150 HD3 LYS 23 2HD LYS 23 7.681 25.427 -8.211
151 HE2 LYS 23 1HE LYS 23 7.277 26.741 -10.145
152 HE3 LYS 23 2HE LYS 23 6.028 25.621 -10.735
153 HZ1 LYS 23 3HZ LYS 23 5.816 27.312 -8.327
154 HZ2 LYS 23 1HZ LYS 23 5.066 27.598 -9.769
155 HZ3 LYS 23 2HZ LYS 23 4.657 26.273 -8.874
156 H PHE 24 HN PHE 24 7.437 19.716 -8.799
157 HA PHE 24 HA PHE 24 9.099 18.656 -6.759
158 HB2 PHE 24 1HB PHE 24 6.713 18.001 -7.134
159 HB3 PHE 24 2HB PHE 24 7.213 17.114 -8.592
160 HD1 PHE 24 HD1 PHE 24 7.361 17.218 -4.921
161 HD2 PHE 24 HD2 PHE 24 8.281 15.005 -8.458
162 HE1 PHE 24 HE1 PHE 24 7.790 15.206 -3.550
163 HE2 PHE 24 HE2 PHE 24 8.707 12.991 -7.089
164 HZ PHE 24 HZ PHE 24 8.463 13.092 -4.634
165 H LYS 25 HN LYS 25 8.988 17.843 -10.226
166 HA LYS 25 HA LYS 25 11.042 15.858 -10.159
167 HB2 LYS 25 1HB LYS 25 10.195 17.810 -12.301
168 HB3 LYS 25 2HB LYS 25 11.385 16.510 -12.550
169 HG2 LYS 25 1HG LYS 25 9.705 14.820 -12.093
170 HG3 LYS 25 2HG LYS 25 8.509 16.071 -11.679
171 HD2 LYS 25 1HD LYS 25 8.532 16.909 -13.961
172 HD3 LYS 25 2HD LYS 25 9.830 15.771 -14.397
173 HE2 LYS 25 1HE LYS 25 8.360 13.878 -13.989
174 HE3 LYS 25 2HE LYS 25 7.070 14.968 -13.431
175 HZ1 LYS 25 3HZ LYS 25 8.192 14.897 -16.157
176 HZ2 LYS 25 1HZ LYS 25 6.731 14.279 -15.706
177 HZ3 LYS 25 2HZ LYS 25 6.995 15.907 -15.641
178 H PHE 26 HN PHE 26 11.227 19.389 -10.518
179 HA PHE 26 HA PHE 26 13.956 19.537 -11.275
180 HB2 PHE 26 1HB PHE 26 12.429 21.477 -11.382
181 HB3 PHE 26 2HB PHE 26 12.331 21.508 -9.607
182 HD1 PHE 26 HD1 PHE 26 14.630 21.924 -12.483
183 HD2 PHE 26 HD2 PHE 26 13.917 22.621 -8.328
184 HE1 PHE 26 HE1 PHE 26 16.581 23.440 -12.403
185 HE2 PHE 26 HE2 PHE 26 15.866 24.140 -8.247
186 HZ PHE 26 HZ PHE 26 17.200 24.548 -10.285
187 H LYS 27 HN LYS 27 12.524 19.591 -8.008
188 HA LYS 27 HA LYS 27 15.201 19.780 -6.793
189 HB2 LYS 27 1HB LYS 27 12.432 19.449 -5.632
190 HB3 LYS 27 2HB LYS 27 13.922 19.608 -4.674
191 HG2 LYS 27 1HG LYS 27 12.860 21.691 -6.614
192 HG3 LYS 27 2HG LYS 27 12.640 21.735 -4.849
193 HD2 LYS 27 1HD LYS 27 15.109 21.746 -4.570
194 HD3 LYS 27 2HD LYS 27 15.285 21.794 -6.341
195 HE2 LYS 27 1HE LYS 27 14.068 23.922 -6.414
196 HE3 LYS 27 2HE LYS 27 13.865 23.874 -4.648
197 HZ1 LYS 27 3HZ LYS 27 16.444 24.025 -6.074
198 HZ2 LYS 27 1HZ LYS 27 15.704 25.277 -5.294
199 HZ3 LYS 27 2HZ LYS 27 16.256 23.981 -4.435
200 H LEU 28 HN LEU 28 12.912 17.296 -7.617
201 HA LEU 28 HA LEU 28 13.889 15.239 -5.875
202 HB2 LEU 28 1HB LEU 28 11.880 15.179 -7.058
203 HB3 LEU 28 2HB LEU 28 12.626 15.031 -8.665
204 HG LEU 28 HG LEU 28 13.690 12.882 -7.865
205 HD11 LEU 28 1HD1 LEU 28 12.627 11.776 -5.880
206 HD12 LEU 28 2HD1 LEU 28 13.434 13.294 -5.420
207 HD13 LEU 28 3HD1 LEU 28 11.663 13.245 -5.596
208 HD21 LEU 28 3HD2 LEU 28 11.753 12.873 -9.324
209 HD22 LEU 28 1HD2 LEU 28 11.641 11.533 -8.160
210 HD23 LEU 28 2HD2 LEU 28 10.661 13.002 -7.925
211 H GLN 29 HN GLN 29 15.064 16.495 -8.943
212 HA GLN 29 HA GLN 29 16.921 14.359 -9.472
213 HB2 GLN 29 1HB GLN 29 16.865 17.276 -10.265
214 HB3 GLN 29 2HB GLN 29 18.082 16.115 -10.847
215 HG2 GLN 29 1HG GLN 29 16.034 14.779 -11.989
216 HG3 GLN 29 2HG GLN 29 15.202 16.075 -11.098
217 HE21 GLN 29 2HE2 GLN 29 14.781 15.651 -13.813
218 HE22 GLN 29 1HE2 GLN 29 15.441 16.979 -14.708
219 H ASN 30 HN ASN 30 16.917 16.863 -7.139
220 HA ASN 30 HA ASN 30 19.900 16.756 -6.895
221 HB2 ASN 30 1HB ASN 30 18.055 18.938 -5.664
222 HB3 ASN 30 2HB ASN 30 19.778 18.494 -5.603
223 HD21 ASN 30 2HD2 ASN 30 17.290 20.067 -7.340
224 HD22 ASN 30 1HD2 ASN 30 18.244 20.611 -8.680
225 H THR 31 HN THR 31 17.756 14.800 -5.901
226 HA THR 31 HA THR 31 18.207 14.924 -2.983
227 HB THR 31 HB THR 31 16.913 12.818 -2.928
228 HG1 THR 31 HG1 THR 31 16.050 12.053 -4.948
229 HG21 THR 31 3HG2 THR 31 15.652 14.944 -4.705
230 HG22 THR 31 1HG2 THR 31 14.771 13.707 -3.777
231 HG23 THR 31 2HG2 THR 31 15.696 14.969 -2.926
232 H SER 32 HN SER 32 19.006 13.043 -1.811
233 HA SER 32 HA SER 32 21.661 12.250 -2.924
234 HB2 SER 32 1HB SER 32 22.246 11.639 -0.827
235 HB3 SER 32 2HB SER 32 21.438 13.221 -0.740
236 HG SER 32 HG SER 32 20.704 11.878 0.909
237 H VAL 33 HN VAL 33 22.364 9.987 -2.308
238 HA VAL 33 HA VAL 33 20.277 7.891 -2.303
239 HB VAL 33 HB VAL 33 20.547 8.452 -4.746
240 HG11 VAL 33 1HG1 VAL 33 22.676 7.827 -5.837
241 HG12 VAL 33 2HG1 VAL 33 22.918 9.149 -4.671
242 HG13 VAL 33 3HG1 VAL 33 23.393 7.487 -4.244
243 HG21 VAL 33 3HG2 VAL 33 19.860 6.240 -4.035
244 HG22 VAL 33 1HG2 VAL 33 20.908 6.146 -5.470
245 HG23 VAL 33 2HG2 VAL 33 21.562 5.746 -3.862
246 H GLN 34 HN GLN 34 20.876 6.031 -1.473
247 HA GLN 34 HA GLN 34 23.523 5.981 -0.176
248 HB2 GLN 34 1HB GLN 34 21.245 3.989 -0.187
249 HB3 GLN 34 2HB GLN 34 22.710 3.892 0.820
250 HG2 GLN 34 1HG GLN 34 20.445 6.034 1.227
251 HG3 GLN 34 2HG GLN 34 20.997 4.541 2.023
252 HE21 GLN 34 2HE2 GLN 34 21.312 7.925 1.811
253 HE22 GLN 34 1HE2 GLN 34 22.707 8.110 2.822
254 H LYS 35 HN LYS 35 24.854 4.038 -0.198
255 HA LYS 35 HA LYS 35 25.772 3.481 -2.830
256 HB2 LYS 35 1HB LYS 35 27.123 3.249 -0.799
257 HB3 LYS 35 2HB LYS 35 26.122 1.864 -0.301
258 HG2 LYS 35 1HG LYS 35 26.877 0.586 -2.243
259 HG3 LYS 35 2HG LYS 35 27.830 1.978 -2.810
260 HD2 LYS 35 1HD LYS 35 29.216 1.872 -0.791
261 HD3 LYS 35 2HD LYS 35 28.247 0.509 -0.184
262 HE2 LYS 35 1HE LYS 35 28.919 -0.835 -2.131
263 HE3 LYS 35 2HE LYS 35 29.894 0.526 -2.731
264 HZ1 LYS 35 3HZ LYS 35 30.331 -0.906 -0.189
265 HZ2 LYS 35 1HZ LYS 35 31.237 -1.080 -1.555
266 HZ3 LYS 35 2HZ LYS 35 31.235 0.357 -0.745
267 H GLU 36 HN GLU 36 23.671 1.560 -0.694
268 HA GLU 36 HA GLU 36 23.470 -0.610 -2.648
269 HB2 GLU 36 1HB GLU 36 21.948 0.035 -0.120
270 HB3 GLU 36 2HB GLU 36 21.694 -1.425 -1.107
271 HG2 GLU 36 1HG GLU 36 24.084 -2.128 -0.620
272 HG3 GLU 36 2HG GLU 36 24.218 -0.588 0.260
273 H HIS 37 HN HIS 37 21.727 2.325 -1.958
274 HA HIS 37 HA HIS 37 19.316 1.463 -3.399
275 HB2 HIS 37 1HB HIS 37 20.192 4.162 -2.278
276 HB3 HIS 37 2HB HIS 37 18.624 3.860 -3.063
277 HD1 HIS 37 HD1 HIS 37 18.590 4.832 -0.237
278 HD2 HIS 37 HD2 HIS 37 18.677 0.751 -1.094
279 HE1 HIS 37 HE1 HIS 37 17.697 3.768 1.731
280 H SER 38 HN SER 38 18.479 2.399 -5.281
281 HA SER 38 HA SER 38 20.588 3.086 -7.312
282 HB2 SER 38 1HB SER 38 17.771 2.232 -7.590
283 HB3 SER 38 2HB SER 38 18.869 2.711 -8.906
284 HG SER 38 HG SER 38 18.844 0.448 -8.549
285 H ARG 39 HN ARG 39 20.532 4.949 -8.502
286 HA ARG 39 HA ARG 39 18.662 7.088 -7.537
287 HB2 ARG 39 1HB ARG 39 21.031 7.481 -7.136
288 HB3 ARG 39 2HB ARG 39 21.294 7.448 -8.895
289 HG2 ARG 39 1HG ARG 39 19.843 9.382 -9.179
290 HG3 ARG 39 2HG ARG 39 19.479 9.392 -7.437
291 HD2 ARG 39 1HD ARG 39 21.831 9.854 -6.983
292 HD3 ARG 39 2HD ARG 39 22.131 9.923 -8.734
293 HE ARG 39 HE ARG 39 20.160 11.944 -8.125
294 HH11 ARG 39 1HH1 ARG 39 23.497 11.281 -7.362
295 HH12 ARG 39 2HH1 ARG 39 23.816 12.998 -7.234
296 HH21 ARG 39 1HH2 ARG 39 20.507 13.915 -7.974
297 HH22 ARG 39 2HH2 ARG 39 22.112 14.503 -7.583
298 H ILE 40 HN ILE 40 17.250 7.982 -8.827
299 HA ILE 40 HA ILE 40 16.879 6.791 -11.493
300 HB ILE 40 HB ILE 40 15.351 9.005 -10.047
301 HG12 ILE 40 1HG1 ILE 40 14.646 6.102 -10.390
302 HG13 ILE 40 2HG1 ILE 40 15.347 6.820 -8.921
303 HG21 ILE 40 1HG2 ILE 40 13.588 8.553 -11.719
304 HG22 ILE 40 2HG2 ILE 40 15.090 9.092 -12.504
305 HG23 ILE 40 3HG2 ILE 40 14.648 7.369 -12.519
306 HD11 ILE 40 3HD1 ILE 40 12.674 7.561 -10.162
307 HD12 ILE 40 1HD1 ILE 40 12.905 6.564 -8.708
308 HD13 ILE 40 2HD1 ILE 40 13.375 8.281 -8.693
309 HA PRO 41 HA PRO 41 19.352 9.647 -13.709
310 HB2 PRO 41 1HB PRO 41 17.550 8.643 -15.949
311 HB3 PRO 41 2HB PRO 41 19.316 8.730 -15.910
312 HG2 PRO 41 1HG PRO 41 18.120 6.365 -15.628
313 HG3 PRO 41 2HG PRO 41 19.523 6.751 -14.624
314 HD2 PRO 41 1HD PRO 41 16.575 6.767 -13.862
315 HD3 PRO 41 2HD PRO 41 17.964 6.231 -12.908
316 H ARG 42 HN ARG 42 19.192 11.635 -14.519
317 HA ARG 42 HA ARG 42 16.922 13.164 -13.683
318 HB2 ARG 42 1HB ARG 42 19.180 13.844 -15.506
319 HB3 ARG 42 2HB ARG 42 17.899 14.979 -15.020
320 HG2 ARG 42 1HG ARG 42 18.543 14.712 -12.668
321 HG3 ARG 42 2HG ARG 42 19.814 13.558 -13.143
322 HD2 ARG 42 1HD ARG 42 20.938 15.311 -14.376
323 HD3 ARG 42 2HD ARG 42 19.671 16.461 -13.890
324 HE ARG 42 HE ARG 42 20.899 15.476 -11.470
325 HH11 ARG 42 1HH1 ARG 42 21.839 17.339 -14.264
326 HH12 ARG 42 2HH1 ARG 42 23.013 18.210 -13.296
327 HH21 ARG 42 1HH2 ARG 42 22.244 16.458 -10.351
328 HH22 ARG 42 2HH2 ARG 42 23.246 17.707 -11.065
329 H SER 43 HN SER 43 17.721 11.643 -16.748
330 HA SER 43 HA SER 43 15.726 12.984 -18.392
331 HB2 SER 43 1HB SER 43 16.120 11.383 -19.970
332 HB3 SER 43 2HB SER 43 17.662 11.908 -19.257
333 HG SER 43 HG SER 43 17.645 9.994 -18.022
334 H GLN 44 HN GLN 44 15.673 10.320 -16.085
335 HA GLN 44 HA GLN 44 13.038 9.369 -17.046
336 HB2 GLN 44 1HB GLN 44 14.759 8.526 -14.702
337 HB3 GLN 44 2HB GLN 44 13.257 7.732 -15.232
338 HG2 GLN 44 1HG GLN 44 15.986 7.586 -16.766
339 HG3 GLN 44 2HG GLN 44 14.882 6.502 -15.888
340 HE21 GLN 44 2HE2 GLN 44 15.765 7.793 -18.899
341 HE22 GLN 44 1HE2 GLN 44 14.402 7.249 -19.820
342 H ILE 45 HN ILE 45 14.413 11.242 -14.401
343 HA ILE 45 HA ILE 45 11.893 11.544 -12.967
344 HB ILE 45 HB ILE 45 14.446 13.211 -13.043
345 HG12 ILE 45 1HG1 ILE 45 13.329 11.467 -10.867
346 HG13 ILE 45 2HG1 ILE 45 14.527 10.935 -12.070
347 HG21 ILE 45 1HG2 ILE 45 13.526 14.400 -11.082
348 HG22 ILE 45 2HG2 ILE 45 12.502 14.644 -12.516
349 HG23 ILE 45 3HG2 ILE 45 12.002 13.499 -11.249
350 HD11 ILE 45 3HD1 ILE 45 14.899 13.191 -10.068
351 HD12 ILE 45 1HD1 ILE 45 15.615 11.568 -9.952
352 HD13 ILE 45 2HD1 ILE 45 16.096 12.660 -11.272
353 H GLN 46 HN GLN 46 13.522 13.446 -15.480
354 HA GLN 46 HA GLN 46 11.576 15.555 -15.505
355 HB2 GLN 46 1HB GLN 46 13.834 15.653 -16.527
356 HB3 GLN 46 2HB GLN 46 13.287 14.500 -17.767
357 HG2 GLN 46 1HG GLN 46 12.982 16.840 -18.845
358 HG3 GLN 46 2HG GLN 46 11.553 15.954 -18.266
359 HE21 GLN 46 2HE2 GLN 46 10.328 17.863 -18.138
360 HE22 GLN 46 1HE2 GLN 46 10.583 19.029 -16.883
361 H ARG 47 HN ARG 47 11.628 12.371 -16.961
362 HA ARG 47 HA ARG 47 9.139 13.041 -18.480
363 HB2 ARG 47 1HB ARG 47 11.034 10.758 -18.791
364 HB3 ARG 47 2HB ARG 47 9.500 10.966 -19.666
365 HG2 ARG 47 1HG ARG 47 10.357 13.070 -20.636
366 HG3 ARG 47 2HG ARG 47 11.903 12.813 -19.792
367 HD2 ARG 47 1HD ARG 47 12.285 10.812 -21.067
368 HD3 ARG 47 2HD ARG 47 10.716 11.017 -21.883
369 HE ARG 47 HE ARG 47 12.311 13.340 -22.509
370 HH11 ARG 47 1HH1 ARG 47 12.422 9.904 -23.091
371 HH12 ARG 47 2HH1 ARG 47 13.255 10.182 -24.608
372 HH21 ARG 47 1HH2 ARG 47 13.271 13.674 -24.240
373 HH22 ARG 47 2HH2 ARG 47 13.741 12.331 -25.264
374 H ALA 48 HN ALA 48 9.583 12.347 -15.501
375 HA ALA 48 HA ALA 48 8.237 9.784 -15.203
376 HB1 ALA 48 3HB ALA 48 8.801 11.981 -13.183
377 HB2 ALA 48 1HB ALA 48 8.230 10.340 -12.802
378 HB3 ALA 48 2HB ALA 48 9.840 10.577 -13.522
379 H ARG 49 HN ARG 49 6.178 9.352 -14.452
380 HA ARG 49 HA ARG 49 4.263 11.660 -14.569
381 HB2 ARG 49 1HB ARG 49 3.812 8.759 -15.091
382 HB3 ARG 49 2HB ARG 49 2.521 9.960 -14.854
383 HG2 ARG 49 1HG ARG 49 3.318 11.216 -16.803
384 HG3 ARG 49 2HG ARG 49 4.627 10.033 -17.036
385 HD2 ARG 49 1HD ARG 49 2.954 8.304 -17.430
386 HD3 ARG 49 2HD ARG 49 1.678 9.533 -17.270
387 HE ARG 49 HE ARG 49 3.395 9.217 -19.689
388 HH11 ARG 49 1HH1 ARG 49 1.102 11.215 -17.984
389 HH12 ARG 49 2HH1 ARG 49 0.759 12.092 -19.462
390 HH21 ARG 49 1HH2 ARG 49 3.007 10.207 -21.391
391 HH22 ARG 49 2HH2 ARG 49 1.845 11.517 -21.407
392 HA PRO 50 HA PRO 50 3.226 11.422 -10.336
393 HB2 PRO 50 1HB PRO 50 0.342 11.073 -11.260
394 HB3 PRO 50 2HB PRO 50 0.999 12.254 -10.119
395 HG2 PRO 50 1HG PRO 50 0.352 13.045 -12.578
396 HG3 PRO 50 2HG PRO 50 1.838 13.655 -11.839
397 HD2 PRO 50 1HD PRO 50 1.513 11.494 -13.958
398 HD3 PRO 50 2HD PRO 50 2.760 12.742 -13.826
399 H VAL 51 HN VAL 51 1.768 9.057 -12.522
400 HA VAL 51 HA VAL 51 1.305 7.107 -10.368
401 HB VAL 51 HB VAL 51 1.373 6.822 -13.401
402 HG11 VAL 51 1HG1 VAL 51 0.302 4.631 -13.001
403 HG12 VAL 51 2HG1 VAL 51 1.918 4.698 -12.261
404 HG13 VAL 51 3HG1 VAL 51 0.466 4.871 -11.246
405 HG21 VAL 51 3HG2 VAL 51 -0.436 8.238 -12.632
406 HG22 VAL 51 1HG2 VAL 51 -1.059 6.677 -13.215
407 HG23 VAL 51 2HG2 VAL 51 -0.943 6.990 -11.467
408 H LYS 52 HN LYS 52 3.776 7.529 -12.892
409 HA LYS 52 HA LYS 52 5.133 5.071 -12.062
410 HB2 LYS 52 1HB LYS 52 5.917 7.312 -13.931
411 HB3 LYS 52 2HB LYS 52 6.860 5.825 -13.671
412 HG2 LYS 52 1HG LYS 52 4.990 4.481 -14.533
413 HG3 LYS 52 2HG LYS 52 4.037 5.962 -14.783
414 HD2 LYS 52 1HD LYS 52 5.697 6.782 -16.388
415 HD3 LYS 52 2HD LYS 52 6.690 5.330 -16.118
416 HE2 LYS 52 1HE LYS 52 4.833 3.925 -16.942
417 HE3 LYS 52 2HE LYS 52 3.877 5.392 -17.253
418 HZ1 LYS 52 3HZ LYS 52 6.447 4.716 -18.535
419 HZ2 LYS 52 1HZ LYS 52 4.961 4.599 -19.243
420 HZ3 LYS 52 2HZ LYS 52 5.560 6.077 -18.824
421 H MET 53 HN MET 53 5.180 8.353 -11.070
422 HA MET 53 HA MET 53 7.916 8.607 -10.273
423 HB2 MET 53 1HB MET 53 6.324 10.461 -10.440
424 HB3 MET 53 2HB MET 53 5.425 9.801 -9.053
425 HG2 MET 53 1HG MET 53 6.826 11.656 -8.333
426 HG3 MET 53 2HG MET 53 7.404 10.129 -7.625
427 HE1 MET 53 3HE MET 53 8.240 13.241 -9.680
428 HE2 MET 53 1HE MET 53 9.544 12.724 -10.776
429 HE3 MET 53 2HE MET 53 7.881 12.143 -11.035
430 H ALA 54 HN ALA 54 5.077 7.764 -8.261
431 HA ALA 54 HA ALA 54 6.627 7.176 -5.942
432 HB1 ALA 54 3HB ALA 54 3.901 6.117 -6.763
433 HB2 ALA 54 1HB ALA 54 4.599 6.036 -5.130
434 HB3 ALA 54 2HB ALA 54 4.215 7.615 -5.854
435 H THR 55 HN THR 55 5.583 5.156 -8.654
436 HA THR 55 HA THR 55 6.382 2.639 -7.533
437 HB THR 55 HB THR 55 6.264 3.530 -10.445
438 HG1 THR 55 HG1 THR 55 4.224 2.418 -10.329
439 HG21 THR 55 3HG2 THR 55 6.357 0.747 -9.215
440 HG22 THR 55 1HG2 THR 55 6.142 1.114 -10.941
441 HG23 THR 55 2HG2 THR 55 7.672 1.523 -10.128
442 H LEU 56 HN LEU 56 8.139 4.943 -9.610
443 HA LEU 56 HA LEU 56 10.518 3.302 -9.735
444 HB2 LEU 56 1HB LEU 56 9.895 6.143 -10.160
445 HB3 LEU 56 2HB LEU 56 11.550 5.586 -10.498
446 HG LEU 56 HG LEU 56 9.018 4.616 -11.880
447 HD11 LEU 56 1HD1 LEU 56 9.963 5.786 -13.889
448 HD12 LEU 56 2HD1 LEU 56 9.672 6.926 -12.555
449 HD13 LEU 56 3HD1 LEU 56 11.324 6.359 -12.896
450 HD21 LEU 56 3HD2 LEU 56 10.685 2.865 -11.703
451 HD22 LEU 56 1HD2 LEU 56 10.561 3.414 -13.391
452 HD23 LEU 56 2HD2 LEU 56 11.930 3.941 -12.382
453 H LEU 57 HN LEU 57 9.434 5.880 -7.584
454 HA LEU 57 HA LEU 57 11.979 6.271 -6.291
455 HB2 LEU 57 1HB LEU 57 9.162 6.693 -5.581
456 HB3 LEU 57 2HB LEU 57 10.394 7.211 -4.407
457 HG LEU 57 HG LEU 57 10.087 8.248 -7.252
458 HD11 LEU 57 1HD1 LEU 57 9.408 10.389 -6.135
459 HD12 LEU 57 2HD1 LEU 57 8.295 9.064 -5.722
460 HD13 LEU 57 3HD1 LEU 57 9.533 9.585 -4.552
461 HD21 LEU 57 3HD2 LEU 57 12.403 8.222 -6.537
462 HD22 LEU 57 1HD2 LEU 57 11.809 9.898 -6.605
463 HD23 LEU 57 2HD2 LEU 57 11.980 9.077 -5.034
464 H VAL 58 HN VAL 58 9.211 4.170 -5.565
465 HA VAL 58 HA VAL 58 10.408 3.046 -3.149
466 HB VAL 58 HB VAL 58 8.204 2.059 -5.005
467 HG11 VAL 58 1HG1 VAL 58 7.694 0.426 -3.220
468 HG12 VAL 58 2HG1 VAL 58 9.324 0.162 -3.884
469 HG13 VAL 58 3HG1 VAL 58 9.123 0.972 -2.312
470 HG21 VAL 58 3HG2 VAL 58 7.637 4.080 -3.795
471 HG22 VAL 58 1HG2 VAL 58 6.719 2.691 -3.170
472 HG23 VAL 58 2HG2 VAL 58 8.114 3.318 -2.259
473 H THR 59 HN THR 59 10.409 2.113 -6.562
474 HA THR 59 HA THR 59 11.770 -0.398 -6.108
475 HB THR 59 HB THR 59 11.636 1.360 -8.594
476 HG1 THR 59 HG1 THR 59 10.027 -0.216 -9.181
477 HG21 THR 59 3HG2 THR 59 12.465 -1.550 -8.255
478 HG22 THR 59 1HG2 THR 59 12.293 -0.691 -9.804
479 HG23 THR 59 2HG2 THR 59 13.553 -0.198 -8.647
480 H TYR 60 HN TYR 60 12.910 2.874 -6.907
481 HA TYR 60 HA TYR 60 15.677 1.921 -7.188
482 HB2 TYR 60 1HB TYR 60 14.249 4.547 -7.415
483 HB3 TYR 60 2HB TYR 60 16.020 4.508 -7.230
484 HD1 TYR 60 HD1 TYR 60 13.343 2.871 -9.296
485 HD2 TYR 60 HD2 TYR 60 17.291 4.478 -9.174
486 HE1 TYR 60 HE1 TYR 60 13.582 2.447 -11.725
487 HE2 TYR 60 HE2 TYR 60 17.547 4.062 -11.597
488 HH TYR 60 HH TYR 60 16.569 3.267 -13.495
489 H TYR 61 HN TYR 61 13.943 4.078 -4.918
490 HA TYR 61 HA TYR 61 16.439 4.182 -3.285
491 HB2 TYR 61 1HB TYR 61 13.898 5.818 -3.133
492 HB3 TYR 61 2HB TYR 61 15.377 6.067 -2.174
493 HD1 TYR 61 HD2 TYR 61 17.502 6.734 -3.388
494 HD2 TYR 61 HD1 TYR 61 13.687 6.774 -5.293
495 HE1 TYR 61 HE2 TYR 61 18.410 8.209 -5.151
496 HE2 TYR 61 HE1 TYR 61 14.581 8.253 -7.068
497 HH TYR 61 HH TYR 61 17.679 9.781 -6.864
498 H GLY 62 HN GLY 62 12.982 3.413 -3.026
499 HA2 GLY 62 1HA GLY 62 12.597 1.308 -1.706
500 HA3 GLY 62 2HA GLY 62 13.639 2.024 -0.455
501 H GLU 63 HN GLU 63 11.128 1.165 0.219
502 HA GLU 63 HA GLU 63 9.024 3.083 -0.140
503 HB2 GLU 63 1HB GLU 63 9.530 0.966 1.951
504 HB3 GLU 63 2HB GLU 63 8.053 1.958 1.888
505 HG2 GLU 63 1HG GLU 63 7.527 0.984 -0.389
506 HG3 GLU 63 2HG GLU 63 9.086 0.140 -0.248
507 H GLU 64 HN GLU 64 11.565 2.780 2.293
508 HA GLU 64 HA GLU 64 10.326 4.930 3.918
509 HB2 GLU 64 1HB GLU 64 11.250 2.969 5.030
510 HB3 GLU 64 2HB GLU 64 12.837 3.288 4.289
511 HG2 GLU 64 1HG GLU 64 13.009 5.426 5.621
512 HG3 GLU 64 2HG GLU 64 11.359 5.071 6.180
513 H TYR 65 HN TYR 65 13.355 4.346 2.123
514 HA TYR 65 HA TYR 65 14.507 6.881 2.901
515 HB2 TYR 65 1HB TYR 65 15.719 4.798 2.135
516 HB3 TYR 65 2HB TYR 65 15.200 5.214 0.483
517 HD1 TYR 65 HD1 TYR 65 16.972 6.728 3.423
518 HD2 TYR 65 HD2 TYR 65 16.601 6.543 -0.821
519 HE1 TYR 65 HE1 TYR 65 18.925 8.235 3.194
520 HE2 TYR 65 HE2 TYR 65 18.548 8.045 -1.068
521 HH TYR 65 HH TYR 65 20.062 9.376 0.019
522 H ALA 66 HN ALA 66 12.632 5.812 0.101
523 HA ALA 66 HA ALA 66 12.925 8.179 -1.452
524 HB1 ALA 66 3HB ALA 66 10.553 6.292 -1.248
525 HB2 ALA 66 1HB ALA 66 10.827 7.482 -2.540
526 HB3 ALA 66 2HB ALA 66 11.945 6.113 -2.342
527 H VAL 67 HN VAL 67 10.684 7.368 1.176
528 HA VAL 67 HA VAL 67 9.179 9.857 1.039
529 HB VAL 67 HB VAL 67 9.633 7.870 3.302
530 HG11 VAL 67 1HG1 VAL 67 7.739 9.007 4.412
531 HG12 VAL 67 2HG1 VAL 67 9.107 10.121 4.180
532 HG13 VAL 67 3HG1 VAL 67 7.693 10.210 3.102
533 HG21 VAL 67 3HG2 VAL 67 8.424 6.935 1.423
534 HG22 VAL 67 1HG2 VAL 67 7.345 7.166 2.819
535 HG23 VAL 67 2HG2 VAL 67 7.285 8.304 1.451
536 H GLN 68 HN GLN 68 12.063 8.855 2.839
537 HA GLN 68 HA GLN 68 12.302 11.255 4.377
538 HB2 GLN 68 1HB GLN 68 14.351 9.298 3.327
539 HB3 GLN 68 2HB GLN 68 14.742 10.646 4.420
540 HG2 GLN 68 1HG GLN 68 13.068 9.443 6.192
541 HG3 GLN 68 2HG GLN 68 12.973 8.388 4.763
542 HE21 GLN 68 2HE2 GLN 68 13.678 7.492 7.344
543 HE22 GLN 68 1HE2 GLN 68 15.329 6.967 7.308
544 H LEU 69 HN LEU 69 13.323 10.456 1.093
545 HA LEU 69 HA LEU 69 14.632 13.049 0.710
546 HB2 LEU 69 1HB LEU 69 13.651 10.930 -1.086
547 HB3 LEU 69 2HB LEU 69 14.591 12.284 -1.753
548 HG LEU 69 HG LEU 69 15.565 10.175 0.214
549 HD11 LEU 69 1HD1 LEU 69 17.116 9.550 -1.655
550 HD12 LEU 69 2HD1 LEU 69 15.415 9.388 -2.147
551 HD13 LEU 69 3HD1 LEU 69 16.364 10.797 -2.677
552 HD21 LEU 69 3HD2 LEU 69 16.529 12.338 0.734
553 HD22 LEU 69 1HD2 LEU 69 17.768 11.276 0.025
554 HD23 LEU 69 2HD2 LEU 69 17.023 12.560 -0.961
555 H THR 70 HN THR 70 11.471 11.633 -0.036
556 HA THR 70 HA THR 70 10.622 13.795 -1.747
557 HB THR 70 HB THR 70 8.959 11.809 -0.141
558 HG1 THR 70 HG1 THR 70 8.892 10.730 -2.201
559 HG21 THR 70 3HG2 THR 70 8.239 13.566 -2.521
560 HG22 THR 70 1HG2 THR 70 7.180 12.351 -1.768
561 HG23 THR 70 2HG2 THR 70 7.671 13.796 -0.850
562 H LEU 71 HN LEU 71 10.443 13.258 1.728
563 HA LEU 71 HA LEU 71 8.675 15.434 2.328
564 HB2 LEU 71 1HB LEU 71 10.878 14.080 3.722
565 HB3 LEU 71 2HB LEU 71 9.970 15.323 4.614
566 HG LEU 71 HG LEU 71 8.799 12.771 3.442
567 HD11 LEU 71 1HD1 LEU 71 8.550 12.064 5.836
568 HD12 LEU 71 2HD1 LEU 71 10.258 12.328 5.414
569 HD13 LEU 71 3HD1 LEU 71 9.371 13.558 6.347
570 HD21 LEU 71 3HD2 LEU 71 7.207 14.599 3.471
571 HD22 LEU 71 1HD2 LEU 71 6.769 13.394 4.705
572 HD23 LEU 71 2HD2 LEU 71 7.557 14.916 5.187
573 H GLN 72 HN GLN 72 12.101 15.309 1.596
574 HA GLN 72 HA GLN 72 12.514 18.123 2.341
575 HB2 GLN 72 1HB GLN 72 14.199 16.116 0.830
576 HB3 GLN 72 2HB GLN 72 14.711 17.776 1.220
577 HG2 GLN 72 1HG GLN 72 14.503 17.031 3.823
578 HG3 GLN 72 2HG GLN 72 13.981 15.575 2.944
579 HE21 GLN 72 2HE2 GLN 72 16.057 15.581 4.835
580 HE22 GLN 72 1HE2 GLN 72 17.550 15.245 4.021
581 H VAL 73 HN VAL 73 11.850 16.270 -0.578
582 HA VAL 73 HA VAL 73 12.301 18.469 -2.435
583 HB VAL 73 HB VAL 73 10.615 15.941 -2.652
584 HG11 VAL 73 1HG1 VAL 73 10.589 16.416 -5.077
585 HG12 VAL 73 2HG1 VAL 73 9.788 17.715 -4.162
586 HG13 VAL 73 3HG1 VAL 73 11.439 17.952 -4.786
587 HG21 VAL 73 3HG2 VAL 73 12.984 15.491 -2.412
588 HG22 VAL 73 1HG2 VAL 73 12.435 15.131 -4.066
589 HG23 VAL 73 2HG2 VAL 73 13.351 16.620 -3.738
590 H LEU 74 HN LEU 74 9.395 17.239 -0.800
591 HA LEU 74 HA LEU 74 7.704 19.268 -2.032
592 HB2 LEU 74 1HB LEU 74 6.059 18.539 -0.683
593 HB3 LEU 74 2HB LEU 74 6.823 17.026 -1.221
594 HG LEU 74 HG LEU 74 8.132 17.263 1.069
595 HD11 LEU 74 1HD1 LEU 74 6.652 18.222 2.855
596 HD12 LEU 74 2HD1 LEU 74 7.113 19.460 1.663
597 HD13 LEU 74 3HD1 LEU 74 5.493 18.724 1.602
598 HD21 LEU 74 3HD2 LEU 74 6.735 15.379 0.456
599 HD22 LEU 74 1HD2 LEU 74 6.427 15.838 2.147
600 HD23 LEU 74 2HD2 LEU 74 5.268 16.294 0.876
601 H ARG 75 HN ARG 75 9.914 19.267 0.564
602 HA ARG 75 HA ARG 75 8.709 21.477 2.036
603 HB2 ARG 75 1HB ARG 75 10.234 19.935 3.076
604 HB3 ARG 75 2HB ARG 75 11.538 20.522 2.019
605 HG2 ARG 75 1HG ARG 75 11.408 22.731 3.011
606 HG3 ARG 75 2HG ARG 75 10.004 22.243 3.991
607 HD2 ARG 75 1HD ARG 75 11.391 20.673 5.195
608 HD3 ARG 75 2HD ARG 75 12.793 21.156 4.214
609 HE ARG 75 HE ARG 75 11.796 23.487 5.654
610 HH11 ARG 75 1HH1 ARG 75 13.466 20.486 6.255
611 HH12 ARG 75 2HH1 ARG 75 14.283 21.208 7.628
612 HH21 ARG 75 1HH2 ARG 75 12.718 24.327 7.227
613 HH22 ARG 75 2HH2 ARG 75 13.856 23.398 8.184
614 H ALA 76 HN ALA 76 10.955 21.176 -0.665
615 HA ALA 76 HA ALA 76 11.664 23.986 -0.671
616 HB1 ALA 76 3HB ALA 76 11.862 21.888 -2.860
617 HB2 ALA 76 1HB ALA 76 12.630 23.493 -2.885
618 HB3 ALA 76 2HB ALA 76 13.127 22.288 -1.672
619 H ILE 77 HN ILE 77 9.051 22.093 -1.997
620 HA ILE 77 HA ILE 77 8.065 24.522 -3.473
621 HB ILE 77 HB ILE 77 6.645 22.935 -4.749
622 HG12 ILE 77 1HG1 ILE 77 8.151 20.748 -3.343
623 HG13 ILE 77 2HG1 ILE 77 6.517 21.290 -2.899
624 HG21 ILE 77 1HG2 ILE 77 8.435 21.846 -6.061
625 HG22 ILE 77 2HG2 ILE 77 8.875 23.518 -5.643
626 HG23 ILE 77 3HG2 ILE 77 9.590 22.159 -4.745
627 HD11 ILE 77 3HD1 ILE 77 7.336 20.129 -5.585
628 HD12 ILE 77 1HD1 ILE 77 6.431 19.276 -4.314
629 HD13 ILE 77 2HD1 ILE 77 5.702 20.673 -5.142
630 H ASN 78 HN ASN 78 7.690 22.949 -0.600
631 HA ASN 78 HA ASN 78 6.203 23.503 1.098
632 HB2 ASN 78 1HB ASN 78 6.570 25.994 -0.051
633 HB3 ASN 78 2HB ASN 78 5.029 25.362 -0.682
634 HD21 ASN 78 2HD2 ASN 78 4.346 27.425 0.358
635 HD22 ASN 78 1HD2 ASN 78 3.854 27.349 2.017
636 H GLN 79 HN GLN 79 5.368 21.343 0.032
637 HA GLN 79 HA GLN 79 2.433 21.785 -0.407
638 HB2 GLN 79 1HB GLN 79 4.161 19.446 -1.243
639 HB3 GLN 79 2HB GLN 79 2.409 19.608 -1.504
640 HG2 GLN 79 1HG GLN 79 4.577 21.286 -3.035
641 HG3 GLN 79 2HG GLN 79 3.458 19.947 -3.382
642 HE21 GLN 79 2HE2 GLN 79 3.904 23.328 -3.285
643 HE22 GLN 79 1HE2 GLN 79 2.265 23.803 -3.585
644 H ARG 80 HN ARG 80 2.006 21.908 1.796
645 HA ARG 80 HA ARG 80 2.894 19.927 3.684
646 HB2 ARG 80 1HB ARG 80 0.669 21.904 3.755
647 HB3 ARG 80 2HB ARG 80 1.014 20.756 5.070
648 HG2 ARG 80 1HG ARG 80 3.271 21.703 5.304
649 HG3 ARG 80 2HG ARG 80 2.922 22.853 3.991
650 HD2 ARG 80 1HD ARG 80 1.215 23.889 5.321
651 HD3 ARG 80 2HD ARG 80 1.489 22.708 6.624
652 HE ARG 80 HE ARG 80 3.958 24.170 6.229
653 HH11 ARG 80 1HH1 ARG 80 0.706 24.796 7.320
654 HH12 ARG 80 2HH1 ARG 80 1.297 26.068 8.370
655 HH21 ARG 80 1HH2 ARG 80 4.649 25.628 7.421
656 HH22 ARG 80 2HH2 ARG 80 3.546 26.544 8.429
657 H LEU 81 HN LEU 81 0.184 20.062 1.469
658 HA LEU 81 HA LEU 81 -1.472 18.055 2.547
659 HB2 LEU 81 1HB LEU 81 -2.085 19.315 0.763
660 HB3 LEU 81 2HB LEU 81 -0.820 18.765 -0.360
661 HG LEU 81 HG LEU 81 -1.819 16.449 -0.197
662 HD11 LEU 81 1HD1 LEU 81 -4.193 16.306 0.600
663 HD12 LEU 81 2HD1 LEU 81 -3.100 16.805 1.912
664 HD13 LEU 81 3HD1 LEU 81 -4.115 18.014 1.090
665 HD21 LEU 81 3HD2 LEU 81 -2.202 17.864 -2.128
666 HD22 LEU 81 1HD2 LEU 81 -3.671 16.929 -1.760
667 HD23 LEU 81 2HD2 LEU 81 -3.577 18.650 -1.315
668 H LEU 82 HN LEU 82 1.267 17.602 0.296
669 HA LEU 82 HA LEU 82 1.091 14.728 0.350
670 HB2 LEU 82 1HB LEU 82 2.067 15.875 -1.373
671 HB3 LEU 82 2HB LEU 82 3.371 16.626 -0.423
672 HG LEU 82 HG LEU 82 4.289 14.361 0.043
673 HD11 LEU 82 1HD1 LEU 82 3.455 12.435 -1.331
674 HD12 LEU 82 2HD1 LEU 82 2.178 13.073 -0.269
675 HD13 LEU 82 3HD1 LEU 82 2.183 13.484 -2.001
676 HD21 LEU 82 3HD2 LEU 82 5.203 15.689 -1.769
677 HD22 LEU 82 1HD2 LEU 82 5.219 13.966 -2.212
678 HD23 LEU 82 2HD2 LEU 82 3.982 15.049 -2.893
679 H ALA 83 HN ALA 83 2.927 17.066 2.268
680 HA ALA 83 HA ALA 83 4.652 15.256 3.574
681 HB1 ALA 83 3HB ALA 83 3.358 17.771 4.681
682 HB2 ALA 83 1HB ALA 83 4.777 16.945 5.365
683 HB3 ALA 83 2HB ALA 83 4.874 17.693 3.754
684 H GLU 84 HN GLU 84 1.323 16.201 4.396
685 HA GLU 84 HA GLU 84 1.239 14.740 6.880
686 HB2 GLU 84 1HB GLU 84 -0.906 15.689 4.981
687 HB3 GLU 84 2HB GLU 84 -1.242 14.893 6.538
688 HG2 GLU 84 1HG GLU 84 -0.079 16.802 7.731
689 HG3 GLU 84 2HG GLU 84 0.280 17.430 6.107
690 H GLU 85 HN GLU 85 0.444 13.871 3.542
691 HA GLU 85 HA GLU 85 -0.661 11.278 4.252
692 HB2 GLU 85 1HB GLU 85 0.381 12.474 1.687
693 HB3 GLU 85 2HB GLU 85 -0.258 10.816 1.805
694 HG2 GLU 85 1HG GLU 85 -1.870 13.382 2.352
695 HG3 GLU 85 2HG GLU 85 -1.877 12.318 0.929
696 H LEU 86 HN LEU 86 2.551 12.474 3.434
697 HA LEU 86 HA LEU 86 3.719 9.798 3.319
698 HB2 LEU 86 1HB LEU 86 4.759 12.535 3.620
699 HB3 LEU 86 2HB LEU 86 5.910 11.188 3.465
700 HG LEU 86 HG LEU 86 3.902 12.138 1.387
701 HD11 LEU 86 1HD1 LEU 86 5.960 12.614 0.035
702 HD12 LEU 86 2HD1 LEU 86 5.964 13.529 1.561
703 HD13 LEU 86 3HD1 LEU 86 6.963 12.066 1.397
704 HD21 LEU 86 3HD2 LEU 86 4.044 9.718 1.365
705 HD22 LEU 86 1HD2 LEU 86 4.843 10.386 -0.078
706 HD23 LEU 86 2HD2 LEU 86 5.821 9.794 1.288
707 H HIS 87 HN HIS 87 3.112 12.180 5.812
708 HA HIS 87 HA HIS 87 4.631 10.811 7.869
709 HB2 HIS 87 1HB HIS 87 2.273 12.739 7.991
710 HB3 HIS 87 2HB HIS 87 3.116 12.110 9.427
711 HD1 HIS 87 HD1 HIS 87 3.069 15.071 9.065
712 HD2 HIS 87 HD2 HIS 87 6.161 12.694 7.466
713 HE1 HIS 87 HE1 HIS 87 4.950 16.582 8.678
714 H ARG 88 HN ARG 88 1.304 10.555 6.670
715 HA ARG 88 HA ARG 88 0.504 8.478 8.504
716 HB2 ARG 88 1HB ARG 88 -0.466 9.257 5.801
717 HB3 ARG 88 2HB ARG 88 -1.119 7.883 6.723
718 HG2 ARG 88 1HG ARG 88 -1.884 9.322 8.477
719 HG3 ARG 88 2HG ARG 88 -1.027 10.719 7.782
720 HD2 ARG 88 1HD ARG 88 -2.527 10.863 5.994
721 HD3 ARG 88 2HD ARG 88 -3.252 9.285 6.383
722 HE ARG 88 HE ARG 88 -3.915 10.896 8.608
723 HH11 ARG 88 1HH1 ARG 88 -4.317 11.307 5.169
724 HH12 ARG 88 2HH1 ARG 88 -5.774 12.242 5.446
725 HH21 ARG 88 1HH2 ARG 88 -5.576 11.970 8.942
726 HH22 ARG 88 2HH2 ARG 88 -6.493 12.621 7.598
727 H ALA 89 HN ALA 89 2.120 8.417 5.343
728 HA ALA 89 HA ALA 89 2.294 5.558 5.183
729 HB1 ALA 89 3HB ALA 89 4.127 7.693 4.038
730 HB2 ALA 89 1HB ALA 89 4.102 5.980 3.561
731 HB3 ALA 89 2HB ALA 89 2.688 7.012 3.246
732 H ALA 90 HN ALA 90 4.347 8.017 6.696
733 HA ALA 90 HA ALA 90 6.492 6.234 7.364
734 HB1 ALA 90 3HB ALA 90 5.603 8.810 8.707
735 HB2 ALA 90 1HB ALA 90 7.164 7.994 8.955
736 HB3 ALA 90 2HB ALA 90 6.759 8.674 7.361
737 H ILE 91 HN ILE 91 3.484 7.105 9.003
738 HA ILE 91 HA ILE 91 4.008 5.633 11.439
739 HB ILE 91 HB ILE 91 1.420 6.393 10.017
740 HG12 ILE 91 1HG1 ILE 91 2.603 7.471 12.557
741 HG13 ILE 91 2HG1 ILE 91 2.894 8.175 10.949
742 HG21 ILE 91 1HG2 ILE 91 0.279 5.760 12.116
743 HG22 ILE 91 2HG2 ILE 91 1.084 4.356 11.377
744 HG23 ILE 91 3HG2 ILE 91 1.823 5.169 12.777
745 HD11 ILE 91 3HD1 ILE 91 0.186 7.871 12.294
746 HD12 ILE 91 1HD1 ILE 91 1.107 9.384 12.139
747 HD13 ILE 91 2HD1 ILE 91 0.476 8.573 10.685
748 H GLN 92 HN GLN 92 2.558 4.683 8.349
749 HA GLN 92 HA GLN 92 1.973 1.990 9.234
750 HB2 GLN 92 1HB GLN 92 2.362 3.206 6.493
751 HB3 GLN 92 2HB GLN 92 1.844 1.528 6.781
752 HG2 GLN 92 1HG GLN 92 -0.359 2.557 7.934
753 HG3 GLN 92 2HG GLN 92 0.613 4.011 7.608
754 HE21 GLN 92 2HE2 GLN 92 -1.597 4.507 6.601
755 HE22 GLN 92 1HE2 GLN 92 -1.778 4.111 4.925
756 H LEU 93 HN LEU 93 4.764 3.527 7.725
757 HA LEU 93 HA LEU 93 6.208 1.089 7.203
758 HB2 LEU 93 1HB LEU 93 6.917 3.893 7.713
759 HB3 LEU 93 2HB LEU 93 8.236 2.761 7.332
760 HG LEU 93 HG LEU 93 5.882 3.437 5.524
761 HD11 LEU 93 1HD1 LEU 93 7.616 4.549 4.092
762 HD12 LEU 93 2HD1 LEU 93 7.531 5.297 5.704
763 HD13 LEU 93 3HD1 LEU 93 8.850 4.166 5.317
764 HD21 LEU 93 3HD2 LEU 93 6.630 1.149 5.234
765 HD22 LEU 93 1HD2 LEU 93 7.095 2.123 3.819
766 HD23 LEU 93 2HD2 LEU 93 8.314 1.693 5.043
Start of MODEL 3
1 H THR 4 1H THR 4 -1.065 0.046 -0.380
2 HA THR 4 HA THR 4 1.592 -0.023 0.672
3 HB THR 4 HB THR 4 2.351 -0.008 -1.661
4 HG1 THR 4 HG1 THR 4 1.184 0.958 -3.136
5 HG21 THR 4 3HG2 THR 4 -0.223 -1.597 -1.316
6 HG22 THR 4 1HG2 THR 4 1.054 -1.931 -2.509
7 HG23 THR 4 2HG2 THR 4 1.392 -2.103 -0.769
8 HA PRO 5 HA PRO 5 2.869 4.157 0.911
9 HB2 PRO 5 1HB PRO 5 5.523 3.892 0.099
10 HB3 PRO 5 2HB PRO 5 4.982 3.389 1.706
11 HG2 PRO 5 1HG PRO 5 5.396 1.701 -0.782
12 HG3 PRO 5 2HG PRO 5 5.882 1.363 0.885
13 HD2 PRO 5 1HD PRO 5 3.649 0.212 -0.147
14 HD3 PRO 5 2HD PRO 5 3.675 0.735 1.542
15 H SER 6 HN SER 6 3.168 2.330 -2.042
16 HA SER 6 HA SER 6 3.920 4.531 -3.803
17 HB2 SER 6 1HB SER 6 3.412 3.151 -5.549
18 HB3 SER 6 2HB SER 6 4.301 2.241 -4.307
19 HG SER 6 HG SER 6 2.382 1.223 -5.314
20 H ASP 7 HN ASP 7 0.882 3.296 -2.462
21 HA ASP 7 HA ASP 7 -0.836 4.887 -4.200
22 HB2 ASP 7 1HB ASP 7 -1.385 3.491 -1.513
23 HB3 ASP 7 2HB ASP 7 -2.474 4.499 -2.496
24 H HIS 8 HN HIS 8 0.727 5.378 -1.077
25 HA HIS 8 HA HIS 8 -0.619 7.915 -0.572
26 HB2 HIS 8 1HB HIS 8 1.898 6.659 0.610
27 HB3 HIS 8 2HB HIS 8 1.173 8.183 1.175
28 HD1 HIS 8 HD1 HIS 8 -1.474 7.877 1.933
29 HD2 HIS 8 HD2 HIS 8 0.921 4.410 1.982
30 HE1 HIS 8 HE1 HIS 8 -2.579 6.317 3.454
31 H LEU 9 HN LEU 9 2.408 6.928 -2.105
32 HA LEU 9 HA LEU 9 3.410 9.589 -2.545
33 HB2 LEU 9 1HB LEU 9 3.658 7.022 -3.960
34 HB3 LEU 9 2HB LEU 9 4.667 8.391 -4.485
35 HG LEU 9 HG LEU 9 4.730 7.080 -1.739
36 HD11 LEU 9 1HD1 LEU 9 6.995 6.265 -2.447
37 HD12 LEU 9 2HD1 LEU 9 5.720 5.639 -3.517
38 HD13 LEU 9 3HD1 LEU 9 6.740 6.997 -4.048
39 HD21 LEU 9 3HD2 LEU 9 5.245 9.447 -1.640
40 HD22 LEU 9 1HD2 LEU 9 6.720 8.492 -1.354
41 HD23 LEU 9 2HD2 LEU 9 6.453 9.268 -2.935
42 H LEU 10 HN LEU 10 1.357 7.460 -4.527
43 HA LEU 10 HA LEU 10 1.040 9.278 -6.709
44 HB2 LEU 10 1HB LEU 10 0.502 7.087 -6.897
45 HB3 LEU 10 2HB LEU 10 -0.741 7.036 -5.626
46 HG LEU 10 HG LEU 10 -2.131 8.600 -6.992
47 HD11 LEU 10 1HD1 LEU 10 -1.529 8.893 -9.410
48 HD12 LEU 10 2HD1 LEU 10 -0.284 9.588 -8.345
49 HD13 LEU 10 3HD1 LEU 10 -0.011 8.011 -9.122
50 HD21 LEU 10 3HD2 LEU 10 -2.558 6.213 -7.045
51 HD22 LEU 10 1HD2 LEU 10 -2.853 6.918 -8.653
52 HD23 LEU 10 2HD2 LEU 10 -1.360 5.998 -8.343
53 H SER 11 HN SER 11 -0.836 8.887 -3.713
54 HA SER 11 HA SER 11 -2.999 10.647 -4.192
55 HB2 SER 11 1HB SER 11 -1.532 10.090 -1.688
56 HB3 SER 11 2HB SER 11 -3.043 11.015 -1.835
57 HG SER 11 HG SER 11 -3.399 8.799 -1.384
58 H THR 12 HN THR 12 0.289 11.381 -2.952
59 HA THR 12 HA THR 12 -0.334 14.209 -2.580
60 HB THR 12 HB THR 12 2.086 14.433 -2.077
61 HG1 THR 12 HG1 THR 12 3.348 12.480 -2.130
62 HG21 THR 12 3HG2 THR 12 0.794 11.999 -0.782
63 HG22 THR 12 1HG2 THR 12 2.145 12.941 -0.109
64 HG23 THR 12 2HG2 THR 12 0.541 13.693 -0.295
65 H LEU 13 HN LEU 13 0.970 12.264 -5.158
66 HA LEU 13 HA LEU 13 1.997 14.589 -6.634
67 HB2 LEU 13 1HB LEU 13 1.474 11.761 -7.262
68 HB3 LEU 13 2HB LEU 13 2.221 12.798 -8.499
69 HG LEU 13 HG LEU 13 3.403 12.066 -5.792
70 HD11 LEU 13 1HD1 LEU 13 5.128 10.873 -7.167
71 HD12 LEU 13 2HD1 LEU 13 3.500 10.221 -7.464
72 HD13 LEU 13 3HD1 LEU 13 4.245 11.327 -8.642
73 HD21 LEU 13 3HD2 LEU 13 3.989 14.334 -6.422
74 HD22 LEU 13 1HD2 LEU 13 5.415 13.277 -6.563
75 HD23 LEU 13 2HD2 LEU 13 4.530 13.780 -8.024
76 H GLU 14 HN GLU 14 -0.988 12.803 -6.403
77 HA GLU 14 HA GLU 14 -2.180 14.025 -8.773
78 HB2 GLU 14 1HB GLU 14 -3.300 12.619 -6.352
79 HB3 GLU 14 2HB GLU 14 -4.314 13.289 -7.652
80 HG2 GLU 14 1HG GLU 14 -3.173 11.716 -9.293
81 HG3 GLU 14 2HG GLU 14 -2.194 11.197 -7.903
82 H GLU 15 HN GLU 15 -1.961 14.825 -5.346
83 HA GLU 15 HA GLU 15 -3.831 17.023 -5.430
84 HB2 GLU 15 1HB GLU 15 -1.490 16.367 -3.645
85 HB3 GLU 15 2HB GLU 15 -2.535 17.788 -3.411
86 HG2 GLU 15 1HG GLU 15 -3.426 14.848 -3.219
87 HG3 GLU 15 2HG GLU 15 -3.169 16.061 -1.943
88 H LEU 16 HN LEU 16 -0.449 16.699 -6.296
89 HA LEU 16 HA LEU 16 -0.004 19.569 -6.556
90 HB2 LEU 16 1HB LEU 16 1.300 17.153 -7.625
91 HB3 LEU 16 2HB LEU 16 2.056 18.742 -7.887
92 HG LEU 16 HG LEU 16 1.588 17.372 -5.210
93 HD11 LEU 16 1HD1 LEU 16 4.094 17.315 -5.106
94 HD12 LEU 16 2HD1 LEU 16 3.485 16.418 -6.516
95 HD13 LEU 16 3HD1 LEU 16 4.161 18.051 -6.725
96 HD21 LEU 16 3HD2 LEU 16 1.304 19.773 -5.022
97 HD22 LEU 16 1HD2 LEU 16 2.822 19.279 -4.237
98 HD23 LEU 16 2HD2 LEU 16 2.859 20.051 -5.841
99 H VAL 17 HN VAL 17 -0.275 20.904 -8.198
100 HA VAL 17 HA VAL 17 -1.669 19.988 -10.635
101 HB VAL 17 HB VAL 17 -1.496 22.321 -11.344
102 HG11 VAL 17 1HG1 VAL 17 -2.711 23.408 -9.485
103 HG12 VAL 17 2HG1 VAL 17 -3.290 21.745 -9.743
104 HG13 VAL 17 3HG1 VAL 17 -2.194 22.107 -8.386
105 HG21 VAL 17 3HG2 VAL 17 0.762 22.779 -10.596
106 HG22 VAL 17 1HG2 VAL 17 -0.369 24.006 -9.979
107 HG23 VAL 17 2HG2 VAL 17 0.231 22.725 -8.898
108 HA PRO 18 HA PRO 18 1.349 18.939 -13.427
109 HB2 PRO 18 1HB PRO 18 0.517 21.349 -15.121
110 HB3 PRO 18 2HB PRO 18 0.723 19.666 -15.627
111 HG2 PRO 18 1HG PRO 18 -1.736 20.619 -15.257
112 HG3 PRO 18 2HG PRO 18 -1.350 18.989 -14.693
113 HD2 PRO 18 1HD PRO 18 -1.681 21.531 -13.074
114 HD3 PRO 18 2HD PRO 18 -2.095 19.870 -12.633
115 H TYR 19 HN TYR 19 1.210 22.433 -12.814
116 HA TYR 19 HA TYR 19 3.950 22.929 -13.557
117 HB2 TYR 19 1HB TYR 19 2.285 24.697 -13.378
118 HB3 TYR 19 2HB TYR 19 2.116 24.373 -11.635
119 HD1 TYR 19 HD1 TYR 19 4.530 25.534 -14.231
120 HD2 TYR 19 HD2 TYR 19 3.572 25.400 -10.078
121 HE1 TYR 19 HE1 TYR 19 6.366 27.131 -13.763
122 HE2 TYR 19 HE2 TYR 19 5.399 26.993 -9.594
123 HH TYR 19 HH TYR 19 7.086 28.257 -10.456
124 H ASP 20 HN ASP 20 2.425 22.337 -10.382
125 HA ASP 20 HA ASP 20 4.975 22.463 -8.984
126 HB2 ASP 20 1HB ASP 20 2.210 21.446 -8.092
127 HB3 ASP 20 2HB ASP 20 3.747 21.453 -7.193
128 H PHE 21 HN PHE 21 3.253 19.995 -10.693
129 HA PHE 21 HA PHE 21 4.599 17.735 -9.462
130 HB2 PHE 21 1HB PHE 21 2.488 17.473 -10.737
131 HB3 PHE 21 2HB PHE 21 3.318 18.003 -12.217
132 HD1 PHE 21 HD1 PHE 21 3.490 15.408 -9.546
133 HD2 PHE 21 HD2 PHE 21 4.247 16.458 -13.618
134 HE1 PHE 21 HE1 PHE 21 4.119 13.067 -10.031
135 HE2 PHE 21 HE2 PHE 21 4.874 14.117 -14.107
136 HZ PHE 21 HZ PHE 21 4.812 12.422 -12.311
137 H GLU 22 HN GLU 22 5.230 19.694 -12.368
138 HA GLU 22 HA GLU 22 7.723 18.309 -12.968
139 HB2 GLU 22 1HB GLU 22 6.594 20.985 -13.796
140 HB3 GLU 22 2HB GLU 22 8.138 20.324 -14.387
141 HG2 GLU 22 1HG GLU 22 5.363 19.085 -14.880
142 HG3 GLU 22 2HG GLU 22 6.412 20.013 -15.978
143 H LYS 23 HN LYS 23 6.821 21.133 -11.054
144 HA LYS 23 HA LYS 23 9.499 21.976 -10.428
145 HB2 LYS 23 1HB LYS 23 7.456 23.297 -10.012
146 HB3 LYS 23 2HB LYS 23 6.992 22.133 -8.748
147 HG2 LYS 23 1HG LYS 23 8.955 22.727 -7.432
148 HG3 LYS 23 2HG LYS 23 9.516 23.821 -8.718
149 HD2 LYS 23 1HD LYS 23 7.512 25.211 -8.423
150 HD3 LYS 23 2HD LYS 23 6.929 24.109 -7.153
151 HE2 LYS 23 1HE LYS 23 8.881 24.628 -5.778
152 HE3 LYS 23 2HE LYS 23 9.520 25.686 -7.057
153 HZ1 LYS 23 3HZ LYS 23 6.999 26.107 -5.583
154 HZ2 LYS 23 1HZ LYS 23 8.402 26.939 -5.340
155 HZ3 LYS 23 2HZ LYS 23 7.591 27.088 -6.770
156 H PHE 24 HN PHE 24 7.328 19.605 -8.910
157 HA PHE 24 HA PHE 24 9.012 18.813 -6.772
158 HB2 PHE 24 1HB PHE 24 6.703 17.974 -7.047
159 HB3 PHE 24 2HB PHE 24 7.196 17.079 -8.502
160 HD1 PHE 24 HD2 PHE 24 8.536 15.086 -8.347
161 HD2 PHE 24 HD1 PHE 24 7.293 17.214 -4.857
162 HE1 PHE 24 HE2 PHE 24 9.104 13.126 -6.952
163 HE2 PHE 24 HE1 PHE 24 7.864 15.256 -3.458
164 HZ PHE 24 HZ PHE 24 8.770 13.213 -4.506
165 H LYS 25 HN LYS 25 9.008 17.714 -10.160
166 HA LYS 25 HA LYS 25 11.120 15.808 -9.872
167 HB2 LYS 25 1HB LYS 25 10.236 17.501 -12.210
168 HB3 LYS 25 2HB LYS 25 11.467 16.221 -12.313
169 HG2 LYS 25 1HG LYS 25 9.832 14.536 -11.688
170 HG3 LYS 25 2HG LYS 25 8.594 15.790 -11.434
171 HD2 LYS 25 1HD LYS 25 8.667 16.382 -13.802
172 HD3 LYS 25 2HD LYS 25 9.964 15.196 -14.078
173 HE2 LYS 25 1HE LYS 25 8.482 13.370 -13.481
174 HE3 LYS 25 2HE LYS 25 7.191 14.516 -13.058
175 HZ1 LYS 25 3HZ LYS 25 8.333 14.139 -15.751
176 HZ2 LYS 25 1HZ LYS 25 6.866 13.579 -15.245
177 HZ3 LYS 25 2HZ LYS 25 7.134 15.202 -15.360
178 H PHE 26 HN PHE 26 11.185 19.292 -10.539
179 HA PHE 26 HA PHE 26 13.976 19.516 -11.066
180 HB2 PHE 26 1HB PHE 26 12.339 21.355 -11.449
181 HB3 PHE 26 2HB PHE 26 12.148 21.533 -9.690
182 HD1 PHE 26 HD1 PHE 26 14.627 21.740 -12.445
183 HD2 PHE 26 HD2 PHE 26 13.568 22.881 -8.468
184 HE1 PHE 26 HE1 PHE 26 16.511 23.340 -12.405
185 HE2 PHE 26 HE2 PHE 26 15.450 24.485 -8.425
186 HZ PHE 26 HZ PHE 26 16.923 24.712 -10.394
187 H LYS 27 HN LYS 27 12.206 19.683 -7.977
188 HA LYS 27 HA LYS 27 14.727 20.049 -6.495
189 HB2 LYS 27 1HB LYS 27 11.870 19.623 -5.607
190 HB3 LYS 27 2HB LYS 27 13.246 19.918 -4.517
191 HG2 LYS 27 1HG LYS 27 12.249 21.833 -6.656
192 HG3 LYS 27 2HG LYS 27 11.893 21.958 -4.917
193 HD2 LYS 27 1HD LYS 27 14.345 22.102 -4.474
194 HD3 LYS 27 2HD LYS 27 14.626 22.113 -6.232
195 HE2 LYS 27 1HE LYS 27 13.286 24.160 -6.437
196 HE3 LYS 27 2HE LYS 27 12.994 24.149 -4.683
197 HZ1 LYS 27 3HZ LYS 27 15.630 24.416 -5.980
198 HZ2 LYS 27 1HZ LYS 27 14.779 25.641 -5.278
199 HZ3 LYS 27 2HZ LYS 27 15.359 24.405 -4.353
200 H LEU 28 HN LEU 28 12.747 17.427 -7.549
201 HA LEU 28 HA LEU 28 13.553 15.472 -5.605
202 HB2 LEU 28 1HB LEU 28 11.755 15.199 -7.011
203 HB3 LEU 28 2HB LEU 28 12.680 15.181 -8.531
204 HG LEU 28 HG LEU 28 13.855 13.118 -7.697
205 HD11 LEU 28 1HD1 LEU 28 12.748 11.850 -5.837
206 HD12 LEU 28 2HD1 LEU 28 13.360 13.422 -5.273
207 HD13 LEU 28 3HD1 LEU 28 11.624 13.208 -5.602
208 HD21 LEU 28 3HD2 LEU 28 12.056 12.971 -9.316
209 HD22 LEU 28 1HD2 LEU 28 11.981 11.588 -8.198
210 HD23 LEU 28 2HD2 LEU 28 10.845 12.947 -8.012
211 H GLN 29 HN GLN 29 14.991 16.490 -8.691
212 HA GLN 29 HA GLN 29 17.214 14.628 -8.483
213 HB2 GLN 29 1HB GLN 29 16.785 17.171 -10.059
214 HB3 GLN 29 2HB GLN 29 18.237 16.151 -10.192
215 HG2 GLN 29 1HG GLN 29 16.592 14.202 -11.081
216 HG3 GLN 29 2HG GLN 29 15.459 15.512 -10.671
217 HE21 GLN 29 2HE2 GLN 29 15.645 14.217 -13.203
218 HE22 GLN 29 1HE2 GLN 29 16.149 15.398 -14.366
219 H ASN 30 HN ASN 30 16.605 17.909 -7.379
220 HA ASN 30 HA ASN 30 19.384 18.501 -6.777
221 HB2 ASN 30 1HB ASN 30 16.849 19.977 -5.736
222 HB3 ASN 30 2HB ASN 30 18.600 20.107 -5.443
223 HD21 ASN 30 2HD2 ASN 30 16.643 21.960 -6.663
224 HD22 ASN 30 1HD2 ASN 30 17.298 22.360 -8.216
225 H THR 31 HN THR 31 16.666 17.209 -4.904
226 HA THR 31 HA THR 31 18.035 17.241 -2.368
227 HB THR 31 HB THR 31 15.796 15.412 -3.332
228 HG1 THR 31 HG1 THR 31 15.730 17.889 -1.900
229 HG21 THR 31 3HG2 THR 31 16.731 16.151 -0.531
230 HG22 THR 31 1HG2 THR 31 15.317 15.145 -0.923
231 HG23 THR 31 2HG2 THR 31 16.956 14.571 -1.318
232 H SER 32 HN SER 32 19.514 16.021 -1.501
233 HA SER 32 HA SER 32 20.977 14.116 -3.192
234 HB2 SER 32 1HB SER 32 22.510 13.986 -1.517
235 HB3 SER 32 2HB SER 32 22.038 15.685 -1.743
236 HG SER 32 HG SER 32 22.172 15.087 0.463
237 H VAL 33 HN VAL 33 21.478 11.948 -2.580
238 HA VAL 33 HA VAL 33 19.527 10.592 -0.743
239 HB VAL 33 HB VAL 33 19.268 8.762 -2.369
240 HG11 VAL 33 1HG1 VAL 33 17.813 9.922 -3.998
241 HG12 VAL 33 2HG1 VAL 33 17.586 10.574 -2.357
242 HG13 VAL 33 3HG1 VAL 33 18.550 11.478 -3.548
243 HG21 VAL 33 3HG2 VAL 33 21.369 9.002 -3.551
244 HG22 VAL 33 1HG2 VAL 33 20.000 9.013 -4.687
245 HG23 VAL 33 2HG2 VAL 33 20.816 10.536 -4.262
246 H GLN 34 HN GLN 34 20.145 8.216 -0.541
247 HA GLN 34 HA GLN 34 22.786 8.305 0.692
248 HB2 GLN 34 1HB GLN 34 20.837 6.025 0.290
249 HB3 GLN 34 2HB GLN 34 22.296 5.978 1.309
250 HG2 GLN 34 1HG GLN 34 19.740 7.678 1.994
251 HG3 GLN 34 2HG GLN 34 20.490 6.162 2.547
252 HE21 GLN 34 2HE2 GLN 34 20.290 9.521 2.962
253 HE22 GLN 34 1HE2 GLN 34 21.649 9.730 4.017
254 H LYS 35 HN LYS 35 24.528 6.907 0.338
255 HA LYS 35 HA LYS 35 25.184 6.629 -2.478
256 HB2 LYS 35 1HB LYS 35 26.530 5.680 0.054
257 HB3 LYS 35 2HB LYS 35 27.207 5.467 -1.579
258 HG2 LYS 35 1HG LYS 35 27.273 7.907 -1.876
259 HG3 LYS 35 2HG LYS 35 26.586 8.127 -0.250
260 HD2 LYS 35 1HD LYS 35 28.545 7.026 0.740
261 HD3 LYS 35 2HD LYS 35 29.230 6.774 -0.884
262 HE2 LYS 35 1HE LYS 35 29.319 9.201 -1.232
263 HE3 LYS 35 2HE LYS 35 28.617 9.462 0.382
264 HZ1 LYS 35 3HZ LYS 35 31.211 8.171 -0.172
265 HZ2 LYS 35 1HZ LYS 35 31.007 9.704 0.400
266 HZ3 LYS 35 2HZ LYS 35 30.562 8.413 1.325
267 H GLU 36 HN GLU 36 23.730 4.557 -0.114
268 HA GLU 36 HA GLU 36 24.332 2.064 -1.509
269 HB2 GLU 36 1HB GLU 36 22.284 2.810 0.583
270 HB3 GLU 36 2HB GLU 36 22.529 1.163 -0.046
271 HG2 GLU 36 1HG GLU 36 24.892 1.201 0.882
272 HG3 GLU 36 2HG GLU 36 24.527 2.869 1.380
273 H HIS 37 HN HIS 37 22.136 4.627 -2.027
274 HA HIS 37 HA HIS 37 20.058 3.013 -3.304
275 HB2 HIS 37 1HB HIS 37 20.609 6.015 -3.303
276 HB3 HIS 37 2HB HIS 37 19.186 5.248 -4.048
277 HD1 HIS 37 HD1 HIS 37 18.632 7.250 -1.935
278 HD2 HIS 37 HD2 HIS 37 19.224 3.245 -0.934
279 HE1 HIS 37 HE1 HIS 37 17.554 6.983 0.202
280 H SER 38 HN SER 38 19.469 3.024 -5.486
281 HA SER 38 HA SER 38 21.750 2.767 -7.348
282 HB2 SER 38 1HB SER 38 18.836 2.438 -7.730
283 HB3 SER 38 2HB SER 38 20.111 2.150 -8.936
284 HG SER 38 HG SER 38 19.507 0.249 -7.811
285 H ARG 39 HN ARG 39 22.066 3.969 -9.221
286 HA ARG 39 HA ARG 39 21.279 6.807 -8.986
287 HB2 ARG 39 1HB ARG 39 23.088 5.449 -10.935
288 HB3 ARG 39 2HB ARG 39 22.765 7.194 -10.825
289 HG2 ARG 39 1HG ARG 39 23.770 7.291 -8.623
290 HG3 ARG 39 2HG ARG 39 23.981 5.523 -8.607
291 HD2 ARG 39 1HD ARG 39 25.300 7.377 -10.562
292 HD3 ARG 39 2HD ARG 39 26.031 6.818 -9.039
293 HE ARG 39 HE ARG 39 25.436 4.453 -10.550
294 HH11 ARG 39 1HH1 ARG 39 27.415 7.291 -10.986
295 HH12 ARG 39 2HH1 ARG 39 28.551 6.359 -11.941
296 HH21 ARG 39 1HH2 ARG 39 26.724 3.375 -11.648
297 HH22 ARG 39 2HH2 ARG 39 28.158 4.126 -12.320
298 H ILE 40 HN ILE 40 19.280 7.242 -9.569
299 HA ILE 40 HA ILE 40 17.985 5.895 -11.834
300 HB ILE 40 HB ILE 40 16.720 6.767 -9.816
301 HG12 ILE 40 1HG1 ILE 40 15.876 8.027 -12.411
302 HG13 ILE 40 2HG1 ILE 40 15.731 6.293 -12.040
303 HG21 ILE 40 1HG2 ILE 40 16.247 9.193 -9.734
304 HG22 ILE 40 2HG2 ILE 40 17.984 8.872 -9.526
305 HG23 ILE 40 3HG2 ILE 40 17.369 9.458 -11.090
306 HD11 ILE 40 3HD1 ILE 40 14.405 8.556 -10.507
307 HD12 ILE 40 1HD1 ILE 40 13.599 7.466 -11.657
308 HD13 ILE 40 2HD1 ILE 40 14.260 6.822 -10.135
309 HA PRO 41 HA PRO 41 19.647 8.384 -15.077
310 HB2 PRO 41 1HB PRO 41 17.151 7.267 -16.408
311 HB3 PRO 41 2HB PRO 41 18.817 7.259 -17.004
312 HG2 PRO 41 1HG PRO 41 17.749 5.001 -16.066
313 HG3 PRO 41 2HG PRO 41 19.428 5.396 -15.676
314 HD2 PRO 41 1HD PRO 41 16.955 5.658 -13.918
315 HD3 PRO 41 2HD PRO 41 18.581 5.123 -13.473
316 H ARG 42 HN ARG 42 19.229 10.301 -15.947
317 HA ARG 42 HA ARG 42 17.386 11.953 -14.477
318 HB2 ARG 42 1HB ARG 42 18.992 12.476 -16.932
319 HB3 ARG 42 2HB ARG 42 17.937 13.675 -16.147
320 HG2 ARG 42 1HG ARG 42 19.257 13.551 -14.108
321 HG3 ARG 42 2HG ARG 42 20.269 12.266 -14.811
322 HD2 ARG 42 1HD ARG 42 21.075 13.827 -16.480
323 HD3 ARG 42 2HD ARG 42 20.076 15.109 -15.757
324 HE ARG 42 HE ARG 42 21.885 14.234 -13.701
325 HH11 ARG 42 1HH1 ARG 42 22.145 15.684 -16.861
326 HH12 ARG 42 2HH1 ARG 42 23.619 16.497 -16.374
327 HH21 ARG 42 1HH2 ARG 42 23.576 15.151 -13.130
328 HH22 ARG 42 2HH2 ARG 42 24.436 16.194 -14.247
329 H SER 43 HN SER 43 17.122 10.193 -17.486
330 HA SER 43 HA SER 43 14.809 11.596 -18.580
331 HB2 SER 43 1HB SER 43 14.625 9.876 -20.074
332 HB3 SER 43 2HB SER 43 16.333 10.336 -19.894
333 HG SER 43 HG SER 43 16.023 8.068 -19.930
334 H GLN 44 HN GLN 44 15.307 9.008 -16.221
335 HA GLN 44 HA GLN 44 12.640 7.923 -16.309
336 HB2 GLN 44 1HB GLN 44 14.763 7.973 -14.158
337 HB3 GLN 44 2HB GLN 44 13.223 7.094 -14.012
338 HG2 GLN 44 1HG GLN 44 15.298 6.342 -16.251
339 HG3 GLN 44 2HG GLN 44 15.144 5.884 -14.539
340 HE21 GLN 44 2HE2 GLN 44 14.652 3.740 -14.907
341 HE22 GLN 44 1HE2 GLN 44 13.170 3.221 -15.638
342 H ILE 45 HN ILE 45 14.148 10.368 -14.198
343 HA ILE 45 HA ILE 45 11.643 10.973 -12.824
344 HB ILE 45 HB ILE 45 14.287 12.471 -13.078
345 HG12 ILE 45 1HG1 ILE 45 13.052 11.077 -10.719
346 HG13 ILE 45 2HG1 ILE 45 14.241 10.345 -11.821
347 HG21 ILE 45 1HG2 ILE 45 13.425 13.954 -11.298
348 HG22 ILE 45 2HG2 ILE 45 12.426 14.068 -12.765
349 HG23 ILE 45 3HG2 ILE 45 11.851 13.126 -11.370
350 HD11 ILE 45 3HD1 ILE 45 14.692 12.812 -10.104
351 HD12 ILE 45 1HD1 ILE 45 15.324 11.183 -9.773
352 HD13 ILE 45 2HD1 ILE 45 15.880 12.079 -11.207
353 H GLN 46 HN GLN 46 13.391 12.457 -15.530
354 HA GLN 46 HA GLN 46 11.707 14.724 -15.808
355 HB2 GLN 46 1HB GLN 46 13.859 14.387 -16.967
356 HB3 GLN 46 2HB GLN 46 13.102 13.122 -17.962
357 HG2 GLN 46 1HG GLN 46 12.953 15.241 -19.427
358 HG3 GLN 46 2HG GLN 46 11.487 14.703 -18.573
359 HE21 GLN 46 2HE2 GLN 46 10.562 16.775 -18.712
360 HE22 GLN 46 1HE2 GLN 46 11.112 18.088 -17.726
361 H ARG 47 HN ARG 47 11.320 11.426 -17.031
362 HA ARG 47 HA ARG 47 8.772 12.279 -18.352
363 HB2 ARG 47 1HB ARG 47 10.483 9.873 -18.786
364 HB3 ARG 47 2HB ARG 47 8.874 10.134 -19.500
365 HG2 ARG 47 1HG ARG 47 9.708 12.153 -20.634
366 HG3 ARG 47 2HG ARG 47 11.319 11.880 -19.927
367 HD2 ARG 47 1HD ARG 47 11.361 9.700 -21.117
368 HD3 ARG 47 2HD ARG 47 9.873 10.208 -21.950
369 HE ARG 47 HE ARG 47 12.581 11.235 -22.611
370 HH11 ARG 47 1HH1 ARG 47 9.149 11.779 -22.898
371 HH12 ARG 47 2HH1 ARG 47 9.425 12.843 -24.263
372 HH21 ARG 47 1HH2 ARG 47 12.914 12.444 -24.179
373 HH22 ARG 47 2HH2 ARG 47 11.572 13.222 -24.995
374 H ALA 48 HN ALA 48 9.433 11.559 -15.409
375 HA ALA 48 HA ALA 48 7.969 9.132 -14.888
376 HB1 ALA 48 3HB ALA 48 8.610 11.471 -13.059
377 HB2 ALA 48 1HB ALA 48 8.018 9.876 -12.539
378 HB3 ALA 48 2HB ALA 48 9.617 10.024 -13.306
379 H ARG 49 HN ARG 49 5.886 8.721 -14.694
380 HA ARG 49 HA ARG 49 3.952 10.977 -14.730
381 HB2 ARG 49 1HB ARG 49 3.544 8.025 -14.885
382 HB3 ARG 49 2HB ARG 49 2.253 9.249 -14.841
383 HG2 ARG 49 1HG ARG 49 3.229 10.248 -16.923
384 HG3 ARG 49 2HG ARG 49 4.355 8.870 -16.994
385 HD2 ARG 49 1HD ARG 49 2.602 8.444 -18.487
386 HD3 ARG 49 2HD ARG 49 2.378 7.378 -17.080
387 HE ARG 49 HE ARG 49 0.637 9.689 -16.775
388 HH11 ARG 49 1HH1 ARG 49 0.953 6.856 -18.783
389 HH12 ARG 49 2HH1 ARG 49 -0.783 6.817 -19.014
390 HH21 ARG 49 1HH2 ARG 49 -1.352 9.663 -17.036
391 HH22 ARG 49 2HH2 ARG 49 -2.100 8.419 -18.019
392 HA PRO 50 HA PRO 50 2.928 11.173 -10.488
393 HB2 PRO 50 1HB PRO 50 0.079 10.486 -11.339
394 HB3 PRO 50 2HB PRO 50 0.635 11.829 -10.331
395 HG2 PRO 50 1HG PRO 50 -0.072 12.307 -12.852
396 HG3 PRO 50 2HG PRO 50 1.362 13.105 -12.194
397 HD2 PRO 50 1HD PRO 50 1.207 10.724 -14.082
398 HD3 PRO 50 2HD PRO 50 2.360 12.065 -14.079
399 H VAL 51 HN VAL 51 1.648 8.456 -12.357
400 HA VAL 51 HA VAL 51 1.556 6.754 -9.917
401 HB VAL 51 HB VAL 51 1.066 6.119 -12.857
402 HG11 VAL 51 1HG1 VAL 51 0.135 3.996 -11.999
403 HG12 VAL 51 2HG1 VAL 51 1.856 4.158 -11.575
404 HG13 VAL 51 3HG1 VAL 51 0.603 4.458 -10.346
405 HG21 VAL 51 3HG2 VAL 51 -0.611 7.620 -11.959
406 HG22 VAL 51 1HG2 VAL 51 -1.291 5.997 -12.220
407 HG23 VAL 51 2HG2 VAL 51 -0.872 6.532 -10.575
408 H LYS 52 HN LYS 52 3.487 7.030 -12.886
409 HA LYS 52 HA LYS 52 5.005 4.631 -12.309
410 HB2 LYS 52 1HB LYS 52 5.490 6.978 -14.146
411 HB3 LYS 52 2HB LYS 52 6.539 5.544 -14.060
412 HG2 LYS 52 1HG LYS 52 4.644 4.120 -14.739
413 HG3 LYS 52 2HG LYS 52 3.605 5.562 -14.843
414 HD2 LYS 52 1HD LYS 52 5.057 6.496 -16.589
415 HD3 LYS 52 2HD LYS 52 6.119 5.074 -16.476
416 HE2 LYS 52 1HE LYS 52 4.242 3.626 -17.149
417 HE3 LYS 52 2HE LYS 52 3.193 5.057 -17.281
418 HZ1 LYS 52 3HZ LYS 52 5.617 4.557 -18.886
419 HZ2 LYS 52 1HZ LYS 52 4.064 4.394 -19.418
420 HZ3 LYS 52 2HZ LYS 52 4.645 5.884 -19.008
421 H MET 53 HN MET 53 5.318 7.981 -11.392
422 HA MET 53 HA MET 53 8.109 7.983 -10.747
423 HB2 MET 53 1HB MET 53 6.689 9.981 -10.942
424 HB3 MET 53 2HB MET 53 5.833 9.495 -9.459
425 HG2 MET 53 1HG MET 53 7.939 9.693 -8.193
426 HG3 MET 53 2HG MET 53 8.775 10.209 -9.677
427 HE1 MET 53 3HE MET 53 6.985 12.184 -11.150
428 HE2 MET 53 1HE MET 53 7.379 13.736 -10.372
429 HE3 MET 53 2HE MET 53 8.669 12.554 -10.705
430 H ALA 54 HN ALA 54 5.253 7.189 -8.773
431 HA ALA 54 HA ALA 54 6.629 6.684 -6.354
432 HB1 ALA 54 3HB ALA 54 4.157 5.309 -7.463
433 HB2 ALA 54 1HB ALA 54 4.695 5.273 -5.768
434 HB3 ALA 54 2HB ALA 54 4.183 6.809 -6.506
435 H THR 55 HN THR 55 5.949 4.504 -9.086
436 HA THR 55 HA THR 55 7.184 2.186 -7.901
437 HB THR 55 HB THR 55 6.801 2.923 -10.834
438 HG1 THR 55 HG1 THR 55 4.982 1.495 -10.586
439 HG21 THR 55 3HG2 THR 55 7.405 0.249 -9.510
440 HG22 THR 55 1HG2 THR 55 7.065 0.501 -11.238
441 HG23 THR 55 2HG2 THR 55 8.535 1.192 -10.511
442 H LEU 56 HN LEU 56 8.437 4.762 -10.004
443 HA LEU 56 HA LEU 56 11.054 3.656 -10.335
444 HB2 LEU 56 1HB LEU 56 9.937 6.373 -10.259
445 HB3 LEU 56 2HB LEU 56 11.654 6.189 -10.684
446 HG LEU 56 HG LEU 56 9.310 5.002 -12.219
447 HD11 LEU 56 1HD1 LEU 56 9.924 6.675 -13.984
448 HD12 LEU 56 2HD1 LEU 56 9.456 7.478 -12.468
449 HD13 LEU 56 3HD1 LEU 56 11.175 7.332 -12.904
450 HD21 LEU 56 3HD2 LEU 56 11.302 3.628 -12.358
451 HD22 LEU 56 1HD2 LEU 56 11.006 4.428 -13.920
452 HD23 LEU 56 2HD2 LEU 56 12.278 5.038 -12.833
453 H LEU 57 HN LEU 57 9.714 5.791 -7.833
454 HA LEU 57 HA LEU 57 12.222 6.228 -6.492
455 HB2 LEU 57 1HB LEU 57 9.407 6.230 -5.627
456 HB3 LEU 57 2HB LEU 57 10.658 6.852 -4.526
457 HG LEU 57 HG LEU 57 9.984 8.000 -7.262
458 HD11 LEU 57 1HD1 LEU 57 9.036 9.927 -5.966
459 HD12 LEU 57 2HD1 LEU 57 8.178 8.414 -5.595
460 HD13 LEU 57 3HD1 LEU 57 9.380 9.059 -4.453
461 HD21 LEU 57 3HD2 LEU 57 12.313 8.310 -6.661
462 HD22 LEU 57 1HD2 LEU 57 11.453 9.867 -6.583
463 HD23 LEU 57 2HD2 LEU 57 11.845 8.990 -5.083
464 H VAL 58 HN VAL 58 9.669 3.799 -6.065
465 HA VAL 58 HA VAL 58 10.926 2.462 -3.814
466 HB VAL 58 HB VAL 58 8.982 1.475 -5.940
467 HG11 VAL 58 1HG1 VAL 58 8.614 -0.446 -4.430
468 HG12 VAL 58 2HG1 VAL 58 10.298 -0.395 -5.000
469 HG13 VAL 58 3HG1 VAL 58 9.899 0.151 -3.354
470 HG21 VAL 58 3HG2 VAL 58 8.068 3.212 -4.520
471 HG22 VAL 58 1HG2 VAL 58 7.325 1.638 -4.152
472 HG23 VAL 58 2HG2 VAL 58 8.564 2.312 -3.066
473 H THR 59 HN THR 59 11.273 2.133 -7.313
474 HA THR 59 HA THR 59 12.738 -0.351 -7.173
475 HB THR 59 HB THR 59 12.685 1.798 -9.333
476 HG1 THR 59 HG1 THR 59 11.221 0.272 -10.303
477 HG21 THR 59 3HG2 THR 59 13.663 -1.084 -9.421
478 HG22 THR 59 1HG2 THR 59 13.550 0.019 -10.812
479 HG23 THR 59 2HG2 THR 59 14.692 0.365 -9.490
480 H TYR 60 HN TYR 60 13.785 3.053 -7.378
481 HA TYR 60 HA TYR 60 16.595 2.131 -7.611
482 HB2 TYR 60 1HB TYR 60 15.211 4.798 -7.865
483 HB3 TYR 60 2HB TYR 60 16.984 4.634 -7.819
484 HD1 TYR 60 HD2 TYR 60 18.151 3.397 -9.646
485 HD2 TYR 60 HD1 TYR 60 13.981 4.266 -9.850
486 HE1 TYR 60 HE2 TYR 60 18.182 2.929 -12.073
487 HE2 TYR 60 HE1 TYR 60 13.994 3.802 -12.283
488 HH TYR 60 HH TYR 60 16.966 2.823 -13.996
489 H TYR 61 HN TYR 61 14.453 3.687 -5.306
490 HA TYR 61 HA TYR 61 16.814 4.216 -3.532
491 HB2 TYR 61 1HB TYR 61 14.057 5.456 -3.480
492 HB3 TYR 61 2HB TYR 61 15.446 5.885 -2.451
493 HD1 TYR 61 HD2 TYR 61 17.642 6.517 -3.871
494 HD2 TYR 61 HD1 TYR 61 13.635 6.847 -5.291
495 HE1 TYR 61 HE2 TYR 61 18.383 8.177 -5.545
496 HE2 TYR 61 HE1 TYR 61 14.361 8.512 -6.975
497 HH TYR 61 HH TYR 61 17.762 9.552 -7.251
498 H GLY 62 HN GLY 62 13.398 3.176 -3.460
499 HA2 GLY 62 1HA GLY 62 13.329 0.863 -2.278
500 HA3 GLY 62 2HA GLY 62 13.992 1.768 -0.899
501 H GLU 63 HN GLU 63 11.647 0.427 -0.568
502 HA GLU 63 HA GLU 63 9.280 1.912 -1.259
503 HB2 GLU 63 1HB GLU 63 9.874 -0.115 0.897
504 HB3 GLU 63 2HB GLU 63 8.259 0.576 0.606
505 HG2 GLU 63 1HG GLU 63 8.242 -0.448 -1.692
506 HG3 GLU 63 2HG GLU 63 9.920 -0.936 -1.365
507 H GLU 64 HN GLU 64 11.146 1.747 1.783
508 HA GLU 64 HA GLU 64 9.503 3.833 3.012
509 HB2 GLU 64 1HB GLU 64 12.121 2.543 3.792
510 HB3 GLU 64 2HB GLU 64 11.260 3.752 4.775
511 HG2 GLU 64 1HG GLU 64 9.316 2.146 4.999
512 HG3 GLU 64 2HG GLU 64 10.235 1.078 3.915
513 H TYR 65 HN TYR 65 12.531 3.695 1.243
514 HA TYR 65 HA TYR 65 13.334 6.408 1.979
515 HB2 TYR 65 1HB TYR 65 14.239 4.516 -0.198
516 HB3 TYR 65 2HB TYR 65 14.971 6.105 0.133
517 HD1 TYR 65 HD2 TYR 65 15.884 6.478 2.533
518 HD2 TYR 65 HD1 TYR 65 15.046 2.621 0.922
519 HE1 TYR 65 HE2 TYR 65 17.360 5.458 4.235
520 HE2 TYR 65 HE1 TYR 65 16.521 1.582 2.620
521 HH TYR 65 HH TYR 65 18.246 3.529 5.061
522 H ALA 66 HN ALA 66 11.360 4.962 -0.511
523 HA ALA 66 HA ALA 66 11.224 7.252 -2.230
524 HB1 ALA 66 3HB ALA 66 9.147 5.108 -1.671
525 HB2 ALA 66 1HB ALA 66 9.119 6.253 -3.031
526 HB3 ALA 66 2HB ALA 66 10.416 5.040 -2.916
527 H VAL 67 HN VAL 67 9.360 6.293 0.639
528 HA VAL 67 HA VAL 67 7.575 8.605 0.544
529 HB VAL 67 HB VAL 67 8.334 6.705 2.802
530 HG11 VAL 67 1HG1 VAL 67 6.367 7.640 3.972
531 HG12 VAL 67 2HG1 VAL 67 7.591 8.897 3.672
532 HG13 VAL 67 3HG1 VAL 67 6.136 8.810 2.650
533 HG21 VAL 67 3HG2 VAL 67 7.168 5.609 0.984
534 HG22 VAL 67 1HG2 VAL 67 6.123 5.741 2.418
535 HG23 VAL 67 2HG2 VAL 67 5.884 6.842 1.040
536 H GLN 68 HN GLN 68 10.597 7.900 2.267
537 HA GLN 68 HA GLN 68 10.585 10.376 3.745
538 HB2 GLN 68 1HB GLN 68 12.783 8.472 2.919
539 HB3 GLN 68 2HB GLN 68 13.055 9.906 3.938
540 HG2 GLN 68 1HG GLN 68 11.406 8.752 5.734
541 HG3 GLN 68 2HG GLN 68 11.323 7.628 4.356
542 HE21 GLN 68 2HE2 GLN 68 12.011 6.909 7.021
543 HE22 GLN 68 1HE2 GLN 68 13.655 6.358 7.018
544 H LEU 69 HN LEU 69 12.056 9.423 0.652
545 HA LEU 69 HA LEU 69 13.396 11.933 0.216
546 HB2 LEU 69 1HB LEU 69 13.990 9.986 -0.847
547 HB3 LEU 69 2HB LEU 69 12.464 9.757 -1.733
548 HG LEU 69 HG LEU 69 12.912 11.907 -2.937
549 HD11 LEU 69 1HD1 LEU 69 15.251 12.810 -2.868
550 HD12 LEU 69 2HD1 LEU 69 14.477 12.897 -1.268
551 HD13 LEU 69 3HD1 LEU 69 15.659 11.613 -1.615
552 HD21 LEU 69 3HD2 LEU 69 13.410 9.777 -3.984
553 HD22 LEU 69 1HD2 LEU 69 14.632 10.984 -4.451
554 HD23 LEU 69 2HD2 LEU 69 15.021 9.750 -3.229
555 H THR 70 HN THR 70 10.298 10.686 -1.060
556 HA THR 70 HA THR 70 9.536 13.066 -2.420
557 HB THR 70 HB THR 70 7.778 10.998 -1.032
558 HG1 THR 70 HG1 THR 70 9.130 10.180 -2.727
559 HG21 THR 70 3HG2 THR 70 7.117 13.066 -3.165
560 HG22 THR 70 1HG2 THR 70 6.009 11.818 -2.549
561 HG23 THR 70 2HG2 THR 70 6.580 13.114 -1.469
562 H LEU 71 HN LEU 71 9.019 12.096 0.961
563 HA LEU 71 HA LEU 71 7.452 14.307 1.775
564 HB2 LEU 71 1HB LEU 71 7.970 12.329 2.985
565 HB3 LEU 71 2HB LEU 71 9.616 12.860 3.400
566 HG LEU 71 HG LEU 71 7.136 14.451 4.122
567 HD11 LEU 71 1HD1 LEU 71 7.354 13.477 6.424
568 HD12 LEU 71 2HD1 LEU 71 7.009 12.215 5.217
569 HD13 LEU 71 3HD1 LEU 71 8.664 12.425 5.837
570 HD21 LEU 71 3HD2 LEU 71 9.218 15.693 4.090
571 HD22 LEU 71 1HD2 LEU 71 8.648 15.505 5.766
572 HD23 LEU 71 2HD2 LEU 71 9.983 14.494 5.161
573 H GLN 72 HN GLN 72 11.010 14.006 1.752
574 HA GLN 72 HA GLN 72 11.444 16.667 2.766
575 HB2 GLN 72 1HB GLN 72 13.169 14.750 1.193
576 HB3 GLN 72 2HB GLN 72 13.742 16.327 1.783
577 HG2 GLN 72 1HG GLN 72 13.274 15.391 4.271
578 HG3 GLN 72 2HG GLN 72 12.670 14.073 3.241
579 HE21 GLN 72 2HE2 GLN 72 14.615 13.793 5.301
580 HE22 GLN 72 1HE2 GLN 72 16.106 13.312 4.562
581 H VAL 73 HN VAL 73 11.186 15.348 -0.506
582 HA VAL 73 HA VAL 73 11.974 17.832 -1.828
583 HB VAL 73 HB VAL 73 10.436 15.399 -2.825
584 HG11 VAL 73 1HG1 VAL 73 10.917 16.288 -5.082
585 HG12 VAL 73 2HG1 VAL 73 9.913 17.421 -4.147
586 HG13 VAL 73 3HG1 VAL 73 11.653 17.736 -4.355
587 HG21 VAL 73 3HG2 VAL 73 12.709 14.876 -2.168
588 HG22 VAL 73 1HG2 VAL 73 12.532 14.816 -3.937
589 HG23 VAL 73 2HG2 VAL 73 13.326 16.212 -3.169
590 H LEU 74 HN LEU 74 8.890 16.448 -0.810
591 HA LEU 74 HA LEU 74 7.230 18.475 -1.953
592 HB2 LEU 74 1HB LEU 74 7.132 16.759 0.420
593 HB3 LEU 74 2HB LEU 74 5.741 17.832 0.144
594 HG LEU 74 HG LEU 74 6.724 15.672 -1.761
595 HD11 LEU 74 1HD1 LEU 74 4.602 14.489 -1.136
596 HD12 LEU 74 2HD1 LEU 74 5.649 14.729 0.282
597 HD13 LEU 74 3HD1 LEU 74 4.240 15.785 0.027
598 HD21 LEU 74 3HD2 LEU 74 5.727 17.549 -2.925
599 HD22 LEU 74 1HD2 LEU 74 4.644 16.140 -3.008
600 HD23 LEU 74 2HD2 LEU 74 4.289 17.471 -1.880
601 H ARG 75 HN ARG 75 8.870 18.321 1.206
602 HA ARG 75 HA ARG 75 8.033 20.927 2.081
603 HB2 ARG 75 1HB ARG 75 10.374 19.236 2.810
604 HB3 ARG 75 2HB ARG 75 10.051 20.840 3.509
605 HG2 ARG 75 1HG ARG 75 7.883 20.039 4.346
606 HG3 ARG 75 2HG ARG 75 8.208 18.433 3.648
607 HD2 ARG 75 1HD ARG 75 10.043 18.113 5.138
608 HD3 ARG 75 2HD ARG 75 9.848 19.761 5.782
609 HE ARG 75 HE ARG 75 7.409 18.358 6.379
610 HH11 ARG 75 1HH1 ARG 75 10.786 18.043 7.188
611 HH12 ARG 75 2HH1 ARG 75 10.356 17.344 8.737
612 HH21 ARG 75 1HH2 ARG 75 6.900 17.552 8.145
613 HH22 ARG 75 2HH2 ARG 75 8.140 17.063 9.284
614 H ALA 76 HN ALA 76 10.604 19.845 -0.052
615 HA ALA 76 HA ALA 76 12.051 22.331 -0.060
616 HB1 ALA 76 3HB ALA 76 11.904 20.143 -2.160
617 HB2 ALA 76 1HB ALA 76 13.109 21.450 -2.105
618 HB3 ALA 76 2HB ALA 76 13.063 20.227 -0.813
619 H ILE 77 HN ILE 77 9.158 21.242 -1.649
620 HA ILE 77 HA ILE 77 9.142 23.740 -3.321
621 HB ILE 77 HB ILE 77 7.351 22.627 -4.619
622 HG12 ILE 77 1HG1 ILE 77 7.870 20.192 -2.940
623 HG13 ILE 77 2HG1 ILE 77 6.526 21.325 -2.671
624 HG21 ILE 77 1HG2 ILE 77 8.712 20.852 -5.673
625 HG22 ILE 77 2HG2 ILE 77 9.695 22.294 -5.327
626 HG23 ILE 77 3HG2 ILE 77 9.811 20.864 -4.274
627 HD11 ILE 77 3HD1 ILE 77 7.011 19.707 -5.197
628 HD12 ILE 77 1HD1 ILE 77 5.788 19.355 -3.955
629 HD13 ILE 77 2HD1 ILE 77 5.666 20.841 -4.929
630 H ASN 78 HN ASN 78 8.478 23.294 -0.375
631 HA ASN 78 HA ASN 78 7.097 24.509 1.049
632 HB2 ASN 78 1HB ASN 78 6.088 26.042 -1.465
633 HB3 ASN 78 2HB ASN 78 5.800 26.106 0.291
634 HD21 ASN 78 2HD2 ASN 78 7.073 27.936 -1.771
635 HD22 ASN 78 1HD2 ASN 78 8.579 28.395 -1.049
636 H GLN 79 HN GLN 79 6.279 21.946 -0.200
637 HA GLN 79 HA GLN 79 3.350 22.238 0.373
638 HB2 GLN 79 1HB GLN 79 4.884 20.039 -1.031
639 HB3 GLN 79 2HB GLN 79 3.145 20.002 -0.655
640 HG2 GLN 79 1HG GLN 79 4.416 21.970 -2.755
641 HG3 GLN 79 2HG GLN 79 3.531 20.427 -2.801
642 HE21 GLN 79 2HE2 GLN 79 3.231 23.709 -3.097
643 HE22 GLN 79 1HE2 GLN 79 1.549 23.886 -2.718
644 H ARG 80 HN ARG 80 4.083 22.467 2.633
645 HA ARG 80 HA ARG 80 5.241 20.164 3.975
646 HB2 ARG 80 1HB ARG 80 3.897 22.623 4.978
647 HB3 ARG 80 2HB ARG 80 4.458 21.305 6.032
648 HG2 ARG 80 1HG ARG 80 6.752 21.621 5.203
649 HG3 ARG 80 2HG ARG 80 6.188 22.945 4.154
650 HD2 ARG 80 1HD ARG 80 5.591 24.245 6.079
651 HD3 ARG 80 2HD ARG 80 6.071 22.911 7.153
652 HE ARG 80 HE ARG 80 8.424 23.701 5.680
653 HH11 ARG 80 1HH1 ARG 80 6.250 25.112 8.013
654 HH12 ARG 80 2HH1 ARG 80 7.556 26.099 8.642
655 HH21 ARG 80 1HH2 ARG 80 9.927 24.830 6.382
656 HH22 ARG 80 2HH2 ARG 80 9.652 25.940 7.712
657 H LEU 81 HN LEU 81 1.988 21.175 3.176
658 HA LEU 81 HA LEU 81 0.596 19.544 5.073
659 HB2 LEU 81 1HB LEU 81 0.002 20.541 2.371
660 HB3 LEU 81 2HB LEU 81 -1.293 19.724 3.277
661 HG LEU 81 HG LEU 81 0.129 22.287 4.096
662 HD11 LEU 81 1HD1 LEU 81 -2.099 23.359 3.675
663 HD12 LEU 81 2HD1 LEU 81 -1.454 22.608 2.197
664 HD13 LEU 81 3HD1 LEU 81 -2.733 21.791 3.126
665 HD21 LEU 81 3HD2 LEU 81 -0.504 20.953 6.019
666 HD22 LEU 81 1HD2 LEU 81 -1.548 22.389 5.907
667 HD23 LEU 81 2HD2 LEU 81 -2.166 20.798 5.400
668 H LEU 82 HN LEU 82 1.768 18.861 1.795
669 HA LEU 82 HA LEU 82 0.659 16.157 1.810
670 HB2 LEU 82 1HB LEU 82 2.678 17.567 0.193
671 HB3 LEU 82 2HB LEU 82 2.145 15.940 -0.291
672 HG LEU 82 HG LEU 82 0.443 18.461 -0.178
673 HD11 LEU 82 1HD1 LEU 82 0.276 18.126 -2.659
674 HD12 LEU 82 2HD1 LEU 82 1.967 18.342 -2.148
675 HD13 LEU 82 3HD1 LEU 82 1.350 16.715 -2.526
676 HD21 LEU 82 3HD2 LEU 82 -0.845 16.523 0.504
677 HD22 LEU 82 1HD2 LEU 82 -1.365 17.060 -1.111
678 HD23 LEU 82 2HD2 LEU 82 -0.320 15.629 -0.941
679 H ALA 83 HN ALA 83 3.718 17.648 2.672
680 HA ALA 83 HA ALA 83 5.205 15.210 2.936
681 HB1 ALA 83 3HB ALA 83 5.506 17.850 4.411
682 HB2 ALA 83 1HB ALA 83 6.710 16.541 4.365
683 HB3 ALA 83 2HB ALA 83 6.286 17.412 2.872
684 H GLU 84 HN GLU 84 3.042 16.960 5.120
685 HA GLU 84 HA GLU 84 3.576 15.262 7.414
686 HB2 GLU 84 1HB GLU 84 1.267 17.068 6.693
687 HB3 GLU 84 2HB GLU 84 1.429 16.216 8.247
688 HG2 GLU 84 1HG GLU 84 3.250 18.458 7.192
689 HG3 GLU 84 2HG GLU 84 2.097 18.424 8.545
690 H GLU 85 HN GLU 85 1.401 15.084 4.666
691 HA GLU 85 HA GLU 85 -0.222 12.920 5.671
692 HB2 GLU 85 1HB GLU 85 0.520 13.832 2.894
693 HB3 GLU 85 2HB GLU 85 -0.585 12.474 3.218
694 HG2 GLU 85 1HG GLU 85 -1.071 15.411 4.002
695 HG3 GLU 85 2HG GLU 85 -1.802 14.431 2.712
696 H LEU 86 HN LEU 86 2.859 13.025 3.928
697 HA LEU 86 HA LEU 86 3.044 10.120 3.730
698 HB2 LEU 86 1HB LEU 86 4.904 12.385 3.498
699 HB3 LEU 86 2HB LEU 86 5.532 10.746 3.210
700 HG LEU 86 HG LEU 86 3.419 12.224 1.597
701 HD11 LEU 86 1HD1 LEU 86 5.084 11.973 -0.262
702 HD12 LEU 86 2HD1 LEU 86 5.773 12.880 1.105
703 HD13 LEU 86 3HD1 LEU 86 6.199 11.168 0.865
704 HD21 LEU 86 3HD2 LEU 86 2.807 9.887 1.811
705 HD22 LEU 86 1HD2 LEU 86 3.356 10.222 0.151
706 HD23 LEU 86 2HD2 LEU 86 4.435 9.384 1.293
707 H HIS 87 HN HIS 87 4.138 12.571 6.023
708 HA HIS 87 HA HIS 87 5.684 10.853 7.702
709 HB2 HIS 87 1HB HIS 87 5.687 13.286 8.028
710 HB3 HIS 87 2HB HIS 87 3.951 13.259 8.422
711 HD1 HIS 87 HD1 HIS 87 7.266 11.966 9.770
712 HD2 HIS 87 HD2 HIS 87 3.431 12.992 11.182
713 HE1 HIS 87 HE1 HIS 87 7.358 11.730 12.200
714 H ARG 88 HN ARG 88 2.198 11.606 7.760
715 HA ARG 88 HA ARG 88 1.638 9.777 9.937
716 HB2 ARG 88 1HB ARG 88 -0.124 11.049 7.897
717 HB3 ARG 88 2HB ARG 88 -0.695 9.953 9.177
718 HG2 ARG 88 1HG ARG 88 0.089 11.484 10.892
719 HG3 ARG 88 2HG ARG 88 0.793 12.553 9.655
720 HD2 ARG 88 1HD ARG 88 -1.422 13.018 8.802
721 HD3 ARG 88 2HD ARG 88 -2.122 11.952 10.042
722 HE ARG 88 HE ARG 88 -0.736 14.031 11.458
723 HH11 ARG 88 1HH1 ARG 88 -3.386 13.843 9.201
724 HH12 ARG 88 2HH1 ARG 88 -4.117 15.259 9.931
725 HH21 ARG 88 1HH2 ARG 88 -1.555 15.658 12.299
726 HH22 ARG 88 2HH2 ARG 88 -3.073 16.296 11.698
727 H ALA 89 HN ALA 89 1.730 9.460 6.424
728 HA ALA 89 HA ALA 89 0.623 6.825 6.304
729 HB1 ALA 89 3HB ALA 89 2.669 8.158 4.496
730 HB2 ALA 89 1HB ALA 89 1.748 6.683 4.116
731 HB3 ALA 89 2HB ALA 89 0.900 8.236 4.315
732 H ALA 90 HN ALA 90 3.940 7.996 6.790
733 HA ALA 90 HA ALA 90 5.158 5.398 6.786
734 HB1 ALA 90 3HB ALA 90 6.031 7.961 8.164
735 HB2 ALA 90 1HB ALA 90 7.045 6.524 7.902
736 HB3 ALA 90 2HB ALA 90 6.456 7.462 6.510
737 H ILE 91 HN ILE 91 3.618 7.332 9.310
738 HA ILE 91 HA ILE 91 4.296 5.565 11.507
739 HB ILE 91 HB ILE 91 1.993 7.522 11.083
740 HG12 ILE 91 1HG1 ILE 91 4.403 7.740 12.864
741 HG13 ILE 91 2HG1 ILE 91 4.318 8.392 11.212
742 HG21 ILE 91 1HG2 ILE 91 1.579 7.285 13.509
743 HG22 ILE 91 2HG2 ILE 91 1.338 5.738 12.664
744 HG23 ILE 91 3HG2 ILE 91 2.825 6.018 13.599
745 HD11 ILE 91 3HD1 ILE 91 2.512 9.173 13.527
746 HD12 ILE 91 1HD1 ILE 91 3.858 10.142 12.884
747 HD13 ILE 91 2HD1 ILE 91 2.427 9.826 11.874
748 H GLN 92 HN GLN 92 1.525 5.680 9.296
749 HA GLN 92 HA GLN 92 0.174 3.483 10.630
750 HB2 GLN 92 1HB GLN 92 -0.105 4.734 7.893
751 HB3 GLN 92 2HB GLN 92 -1.143 3.418 8.490
752 HG2 GLN 92 1HG GLN 92 -1.956 5.133 10.406
753 HG3 GLN 92 2HG GLN 92 -0.688 6.060 9.571
754 HE21 GLN 92 2HE2 GLN 92 -3.340 6.967 9.981
755 HE22 GLN 92 1HE2 GLN 92 -4.104 7.122 8.433
756 H LEU 93 HN LEU 93 2.457 3.734 7.959
757 HA LEU 93 HA LEU 93 2.166 0.888 7.278
758 HB2 LEU 93 1HB LEU 93 4.024 3.049 6.537
759 HB3 LEU 93 2HB LEU 93 4.192 1.457 5.760
760 HG LEU 93 HG LEU 93 1.774 3.297 5.570
761 HD11 LEU 93 1HD1 LEU 93 2.461 3.541 3.169
762 HD12 LEU 93 2HD1 LEU 93 3.732 4.125 4.267
763 HD13 LEU 93 3HD1 LEU 93 3.889 2.531 3.490
764 HD21 LEU 93 3HD2 LEU 93 1.145 0.957 5.497
765 HD22 LEU 93 1HD2 LEU 93 0.952 1.687 3.886
766 HD23 LEU 93 2HD2 LEU 93 2.351 0.641 4.229
Start of MODEL 4
1 H THR 4 1H THR 4 -1.454 0.454 -0.277
2 HA THR 4 HA THR 4 1.184 0.119 0.772
3 HB THR 4 HB THR 4 1.897 -0.279 -1.520
4 HG1 THR 4 HG1 THR 4 -0.642 0.424 -2.529
5 HG21 THR 4 3HG2 THR 4 -0.936 -1.305 -1.082
6 HG22 THR 4 1HG2 THR 4 0.259 -1.998 -2.203
7 HG23 THR 4 2HG2 THR 4 0.549 -2.052 -0.447
8 HA PRO 5 HA PRO 5 3.082 4.067 0.493
9 HB2 PRO 5 1HB PRO 5 5.627 3.317 -0.359
10 HB3 PRO 5 2HB PRO 5 5.095 3.083 1.312
11 HG2 PRO 5 1HG PRO 5 5.140 1.085 -0.972
12 HG3 PRO 5 2HG PRO 5 5.653 0.866 0.706
13 HD2 PRO 5 1HD PRO 5 3.228 -0.043 -0.114
14 HD3 PRO 5 2HD PRO 5 3.413 0.649 1.503
15 H SER 6 HN SER 6 3.042 1.875 -2.231
16 HA SER 6 HA SER 6 3.775 3.848 -4.272
17 HB2 SER 6 1HB SER 6 3.132 2.317 -5.821
18 HB3 SER 6 2HB SER 6 4.039 1.489 -4.534
19 HG SER 6 HG SER 6 1.685 1.193 -3.721
20 H ASP 7 HN ASP 7 0.749 2.691 -2.770
21 HA ASP 7 HA ASP 7 -0.998 4.317 -4.423
22 HB2 ASP 7 1HB ASP 7 -1.434 3.003 -1.675
23 HB3 ASP 7 2HB ASP 7 -2.546 4.033 -2.610
24 H HIS 8 HN HIS 8 0.730 4.836 -1.389
25 HA HIS 8 HA HIS 8 -0.477 7.387 -0.797
26 HB2 HIS 8 1HB HIS 8 2.151 6.081 0.006
27 HB3 HIS 8 2HB HIS 8 1.691 7.714 0.545
28 HD1 HIS 8 HD1 HIS 8 -0.978 7.621 1.589
29 HD2 HIS 8 HD2 HIS 8 1.443 4.189 1.938
30 HE1 HIS 8 HE1 HIS 8 -1.882 6.347 3.468
31 H LEU 9 HN LEU 9 2.550 6.518 -2.475
32 HA LEU 9 HA LEU 9 3.270 9.248 -3.046
33 HB2 LEU 9 1HB LEU 9 3.891 6.636 -4.249
34 HB3 LEU 9 2HB LEU 9 4.758 8.074 -4.840
35 HG LEU 9 HG LEU 9 4.835 6.981 -2.000
36 HD11 LEU 9 1HD1 LEU 9 7.218 6.416 -2.545
37 HD12 LEU 9 2HD1 LEU 9 6.088 5.560 -3.620
38 HD13 LEU 9 3HD1 LEU 9 6.959 6.998 -4.206
39 HD21 LEU 9 3HD2 LEU 9 5.046 9.396 -2.056
40 HD22 LEU 9 1HD2 LEU 9 6.611 8.660 -1.636
41 HD23 LEU 9 2HD2 LEU 9 6.333 9.284 -3.280
42 H LEU 10 HN LEU 10 1.354 6.847 -4.789
43 HA LEU 10 HA LEU 10 1.095 8.303 -7.235
44 HB2 LEU 10 1HB LEU 10 0.550 6.009 -6.735
45 HB3 LEU 10 2HB LEU 10 -0.991 6.451 -5.964
46 HG LEU 10 HG LEU 10 -0.224 7.119 -8.830
47 HD11 LEU 10 1HD1 LEU 10 -1.887 5.350 -9.464
48 HD12 LEU 10 2HD1 LEU 10 -0.543 4.666 -8.520
49 HD13 LEU 10 3HD1 LEU 10 -2.115 4.968 -7.742
50 HD21 LEU 10 3HD2 LEU 10 -1.780 8.699 -7.849
51 HD22 LEU 10 1HD2 LEU 10 -2.612 7.705 -9.069
52 HD23 LEU 10 2HD2 LEU 10 -2.850 7.372 -7.336
53 H SER 11 HN SER 11 -1.102 8.206 -4.415
54 HA SER 11 HA SER 11 -2.960 10.186 -5.456
55 HB2 SER 11 1HB SER 11 -3.942 10.182 -3.395
56 HB3 SER 11 2HB SER 11 -3.541 8.515 -3.870
57 HG SER 11 HG SER 11 -3.031 8.962 -1.683
58 H THR 12 HN THR 12 0.013 10.316 -3.523
59 HA THR 12 HA THR 12 -0.259 13.050 -2.650
60 HB THR 12 HB THR 12 2.221 11.337 -3.101
61 HG1 THR 12 HG1 THR 12 0.757 12.030 -0.742
62 HG21 THR 12 3HG2 THR 12 1.893 13.984 -1.634
63 HG22 THR 12 1HG2 THR 12 3.373 12.997 -1.680
64 HG23 THR 12 2HG2 THR 12 2.756 13.749 -3.171
65 H LEU 13 HN LEU 13 1.459 11.607 -5.427
66 HA LEU 13 HA LEU 13 2.222 14.265 -6.408
67 HB2 LEU 13 1HB LEU 13 2.325 11.541 -7.527
68 HB3 LEU 13 2HB LEU 13 3.121 12.884 -8.378
69 HG LEU 13 HG LEU 13 3.846 11.796 -5.630
70 HD11 LEU 13 1HD1 LEU 13 5.982 11.115 -6.756
71 HD12 LEU 13 2HD1 LEU 13 4.574 10.334 -7.513
72 HD13 LEU 13 3HD1 LEU 13 5.346 11.732 -8.298
73 HD21 LEU 13 3HD2 LEU 13 4.167 14.196 -5.735
74 HD22 LEU 13 1HD2 LEU 13 5.745 13.373 -5.721
75 HD23 LEU 13 2HD2 LEU 13 5.098 14.035 -7.243
76 H GLU 14 HN GLU 14 -0.432 12.085 -6.835
77 HA GLU 14 HA GLU 14 -1.450 13.293 -9.272
78 HB2 GLU 14 1HB GLU 14 -2.150 11.089 -8.457
79 HB3 GLU 14 2HB GLU 14 -2.877 11.859 -7.025
80 HG2 GLU 14 1HG GLU 14 -4.497 13.079 -8.579
81 HG3 GLU 14 2HG GLU 14 -3.646 12.231 -9.890
82 H GLU 15 HN GLU 15 -2.028 13.871 -5.808
83 HA GLU 15 HA GLU 15 -3.920 16.038 -6.379
84 HB2 GLU 15 1HB GLU 15 -2.560 15.076 -3.862
85 HB3 GLU 15 2HB GLU 15 -3.713 16.432 -3.918
86 HG2 GLU 15 1HG GLU 15 -5.501 14.819 -4.739
87 HG3 GLU 15 2HG GLU 15 -4.220 13.586 -4.685
88 H LEU 16 HN LEU 16 -0.497 15.739 -6.046
89 HA LEU 16 HA LEU 16 0.115 18.470 -5.414
90 HB2 LEU 16 1HB LEU 16 1.629 16.726 -5.293
91 HB3 LEU 16 2HB LEU 16 1.677 16.389 -7.038
92 HG LEU 16 HG LEU 16 2.524 18.751 -7.366
93 HD11 LEU 16 1HD1 LEU 16 3.565 19.850 -5.364
94 HD12 LEU 16 2HD1 LEU 16 1.809 19.650 -5.154
95 HD13 LEU 16 3HD1 LEU 16 2.935 18.540 -4.338
96 HD21 LEU 16 3HD2 LEU 16 4.004 16.836 -7.499
97 HD22 LEU 16 1HD2 LEU 16 4.848 18.203 -6.730
98 HD23 LEU 16 2HD2 LEU 16 4.238 16.857 -5.735
99 H VAL 17 HN VAL 17 0.077 20.287 -6.488
100 HA VAL 17 HA VAL 17 -1.340 20.584 -8.954
101 HB VAL 17 HB VAL 17 0.767 22.392 -7.696
102 HG11 VAL 17 1HG1 VAL 17 -0.247 24.161 -9.095
103 HG12 VAL 17 2HG1 VAL 17 0.435 22.861 -10.101
104 HG13 VAL 17 3HG1 VAL 17 -1.323 22.955 -9.839
105 HG21 VAL 17 3HG2 VAL 17 -1.112 22.000 -6.217
106 HG22 VAL 17 1HG2 VAL 17 -1.140 23.663 -6.850
107 HG23 VAL 17 2HG2 VAL 17 -2.248 22.438 -7.514
108 HA PRO 18 HA PRO 18 1.290 18.863 -11.930
109 HB2 PRO 18 1HB PRO 18 -0.114 20.949 -13.670
110 HB3 PRO 18 2HB PRO 18 0.127 19.227 -13.994
111 HG2 PRO 18 1HG PRO 18 -2.269 20.078 -13.202
112 HG3 PRO 18 2HG PRO 18 -1.627 18.568 -12.540
113 HD2 PRO 18 1HD PRO 18 -1.813 21.296 -11.221
114 HD3 PRO 18 2HD PRO 18 -1.998 19.694 -10.495
115 H TYR 19 HN TYR 19 0.905 22.396 -11.767
116 HA TYR 19 HA TYR 19 3.421 22.947 -13.081
117 HB2 TYR 19 1HB TYR 19 1.686 24.544 -11.192
118 HB3 TYR 19 2HB TYR 19 3.171 25.173 -11.947
119 HD1 TYR 19 HD2 TYR 19 3.272 25.252 -14.497
120 HD2 TYR 19 HD1 TYR 19 -0.363 24.604 -12.366
121 HE1 TYR 19 HE2 TYR 19 1.992 25.897 -16.509
122 HE2 TYR 19 HE1 TYR 19 -1.664 25.247 -14.374
123 HH TYR 19 HH TYR 19 -0.074 26.201 -17.420
124 H ASP 20 HN ASP 20 2.535 22.145 -9.795
125 HA ASP 20 HA ASP 20 5.246 22.852 -8.811
126 HB2 ASP 20 1HB ASP 20 2.773 21.754 -7.341
127 HB3 ASP 20 2HB ASP 20 4.431 22.010 -6.739
128 H PHE 21 HN PHE 21 3.563 20.149 -10.086
129 HA PHE 21 HA PHE 21 5.371 18.128 -9.020
130 HB2 PHE 21 1HB PHE 21 3.150 17.536 -9.960
131 HB3 PHE 21 2HB PHE 21 3.676 18.117 -11.556
132 HD1 PHE 21 HD1 PHE 21 4.650 15.696 -8.890
133 HD2 PHE 21 HD2 PHE 21 4.544 16.638 -13.054
134 HE1 PHE 21 HE1 PHE 21 5.527 13.446 -9.419
135 HE2 PHE 21 HE2 PHE 21 5.418 14.388 -13.588
136 HZ PHE 21 HZ PHE 21 5.910 12.793 -11.768
137 H GLU 22 HN GLU 22 5.340 20.192 -11.909
138 HA GLU 22 HA GLU 22 7.809 19.249 -13.018
139 HB2 GLU 22 1HB GLU 22 6.445 21.939 -13.015
140 HB3 GLU 22 2HB GLU 22 7.972 21.622 -13.875
141 HG2 GLU 22 1HG GLU 22 5.286 20.231 -14.460
142 HG3 GLU 22 2HG GLU 22 6.099 21.546 -15.341
143 H LYS 23 HN LYS 23 7.121 21.593 -10.447
144 HA LYS 23 HA LYS 23 9.925 22.219 -9.986
145 HB2 LYS 23 1HB LYS 23 7.463 22.473 -8.251
146 HB3 LYS 23 2HB LYS 23 9.080 23.075 -7.814
147 HG2 LYS 23 1HG LYS 23 9.051 24.608 -9.719
148 HG3 LYS 23 2HG LYS 23 7.466 23.976 -10.224
149 HD2 LYS 23 1HD LYS 23 6.520 24.726 -8.042
150 HD3 LYS 23 2HD LYS 23 8.096 25.451 -7.645
151 HE2 LYS 23 1HE LYS 23 7.937 26.929 -9.576
152 HE3 LYS 23 2HE LYS 23 6.404 26.168 -10.059
153 HZ1 LYS 23 3HZ LYS 23 6.857 27.679 -7.566
154 HZ2 LYS 23 1HZ LYS 23 6.041 28.232 -8.888
155 HZ3 LYS 23 2HZ LYS 23 5.435 26.973 -8.013
156 H PHE 24 HN PHE 24 7.655 19.830 -8.697
157 HA PHE 24 HA PHE 24 9.329 18.734 -6.672
158 HB2 PHE 24 1HB PHE 24 7.010 18.033 -6.847
159 HB3 PHE 24 2HB PHE 24 7.274 17.408 -8.491
160 HD1 PHE 24 HD1 PHE 24 8.079 16.896 -4.920
161 HD2 PHE 24 HD2 PHE 24 8.089 15.253 -8.863
162 HE1 PHE 24 HE1 PHE 24 8.598 14.666 -3.988
163 HE2 PHE 24 HE2 PHE 24 8.605 13.020 -7.935
164 HZ PHE 24 HZ PHE 24 8.861 12.728 -5.495
165 H LYS 25 HN LYS 25 9.062 17.811 -10.114
166 HA LYS 25 HA LYS 25 11.173 15.845 -9.950
167 HB2 LYS 25 1HB LYS 25 10.025 17.375 -12.289
168 HB3 LYS 25 2HB LYS 25 11.171 16.019 -12.419
169 HG2 LYS 25 1HG LYS 25 9.501 14.550 -11.302
170 HG3 LYS 25 2HG LYS 25 8.351 15.909 -11.298
171 HD2 LYS 25 1HD LYS 25 9.616 14.688 -13.775
172 HD3 LYS 25 2HD LYS 25 7.976 14.331 -13.182
173 HE2 LYS 25 1HE LYS 25 7.473 16.790 -13.357
174 HE3 LYS 25 2HE LYS 25 9.049 16.993 -14.157
175 HZ1 LYS 25 3HZ LYS 25 6.839 15.299 -15.131
176 HZ2 LYS 25 1HZ LYS 25 7.266 16.767 -15.749
177 HZ3 LYS 25 2HZ LYS 25 8.300 15.487 -15.872
178 H PHE 26 HN PHE 26 11.111 19.290 -10.734
179 HA PHE 26 HA PHE 26 13.809 19.525 -11.638
180 HB2 PHE 26 1HB PHE 26 12.214 21.368 -11.891
181 HB3 PHE 26 2HB PHE 26 12.063 21.515 -10.126
182 HD1 PHE 26 HD1 PHE 26 14.413 21.880 -12.966
183 HD2 PHE 26 HD2 PHE 26 13.539 22.813 -8.889
184 HE1 PHE 26 HE1 PHE 26 16.262 23.520 -12.946
185 HE2 PHE 26 HE2 PHE 26 15.386 24.455 -8.866
186 HZ PHE 26 HZ PHE 26 16.749 24.808 -10.896
187 H LYS 27 HN LYS 27 12.446 19.663 -8.355
188 HA LYS 27 HA LYS 27 15.108 20.111 -7.185
189 HB2 LYS 27 1HB LYS 27 12.398 19.532 -5.983
190 HB3 LYS 27 2HB LYS 27 13.878 19.833 -5.043
191 HG2 LYS 27 1HG LYS 27 12.612 21.797 -6.985
192 HG3 LYS 27 2HG LYS 27 12.405 21.833 -5.217
193 HD2 LYS 27 1HD LYS 27 14.857 22.082 -4.956
194 HD3 LYS 27 2HD LYS 27 15.026 22.110 -6.728
195 HE2 LYS 27 1HE LYS 27 13.644 24.122 -6.849
196 HE3 LYS 27 2HE LYS 27 13.410 24.084 -5.086
197 HZ1 LYS 27 3HZ LYS 27 15.994 24.444 -6.463
198 HZ2 LYS 27 1HZ LYS 27 15.129 25.636 -5.720
199 HZ3 LYS 27 2HZ LYS 27 15.776 24.408 -4.829
200 H LEU 28 HN LEU 28 12.994 17.406 -7.844
201 HA LEU 28 HA LEU 28 14.186 15.566 -5.980
202 HB2 LEU 28 1HB LEU 28 12.108 15.239 -6.868
203 HB3 LEU 28 2HB LEU 28 12.610 15.127 -8.571
204 HG LEU 28 HG LEU 28 13.933 13.078 -7.972
205 HD11 LEU 28 1HD1 LEU 28 13.356 11.930 -5.816
206 HD12 LEU 28 2HD1 LEU 28 14.113 13.513 -5.523
207 HD13 LEU 28 3HD1 LEU 28 12.351 13.325 -5.362
208 HD21 LEU 28 3HD2 LEU 28 11.763 12.895 -9.037
209 HD22 LEU 28 1HD2 LEU 28 11.979 11.570 -7.867
210 HD23 LEU 28 2HD2 LEU 28 10.949 12.964 -7.455
211 H GLN 29 HN GLN 29 14.867 16.296 -9.390
212 HA GLN 29 HA GLN 29 16.875 14.224 -9.642
213 HB2 GLN 29 1HB GLN 29 17.379 15.190 -11.736
214 HB3 GLN 29 2HB GLN 29 15.615 15.285 -11.520
215 HG2 GLN 29 1HG GLN 29 16.057 17.901 -10.861
216 HG3 GLN 29 2HG GLN 29 17.683 17.276 -11.223
217 HE21 GLN 29 2HE2 GLN 29 18.379 17.961 -13.130
218 HE22 GLN 29 1HE2 GLN 29 17.419 18.141 -14.561
219 H ASN 30 HN ASN 30 16.867 17.311 -8.172
220 HA ASN 30 HA ASN 30 19.843 17.481 -8.275
221 HB2 ASN 30 1HB ASN 30 17.908 19.620 -7.109
222 HB3 ASN 30 2HB ASN 30 19.669 19.370 -7.206
223 HD21 ASN 30 2HD2 ASN 30 17.647 21.345 -8.365
224 HD22 ASN 30 1HD2 ASN 30 18.073 21.429 -10.042
225 H THR 31 HN THR 31 17.258 16.484 -6.217
226 HA THR 31 HA THR 31 18.562 16.863 -3.679
227 HB THR 31 HB THR 31 16.481 14.795 -4.505
228 HG1 THR 31 HG1 THR 31 16.223 17.365 -3.272
229 HG21 THR 31 3HG2 THR 31 17.321 15.811 -1.761
230 HG22 THR 31 1HG2 THR 31 15.984 14.683 -2.089
231 HG23 THR 31 2HG2 THR 31 17.663 14.194 -2.420
232 H SER 32 HN SER 32 20.155 15.896 -2.720
233 HA SER 32 HA SER 32 21.623 13.666 -3.948
234 HB2 SER 32 1HB SER 32 22.797 15.335 -2.874
235 HB3 SER 32 2HB SER 32 21.922 15.049 -1.351
236 HG SER 32 HG SER 32 23.952 13.991 -1.422
237 H VAL 33 HN VAL 33 21.684 11.556 -3.334
238 HA VAL 33 HA VAL 33 19.809 10.660 -1.151
239 HB VAL 33 HB VAL 33 19.283 8.679 -2.477
240 HG11 VAL 33 1HG1 VAL 33 17.949 9.721 -4.278
241 HG12 VAL 33 2HG1 VAL 33 17.833 10.659 -2.770
242 HG13 VAL 33 3HG1 VAL 33 18.878 11.228 -4.094
243 HG21 VAL 33 3HG2 VAL 33 21.376 8.460 -3.679
244 HG22 VAL 33 1HG2 VAL 33 19.996 8.449 -4.802
245 HG23 VAL 33 2HG2 VAL 33 20.998 9.911 -4.637
246 H GLN 34 HN GLN 34 20.250 8.527 -0.320
247 HA GLN 34 HA GLN 34 23.012 8.314 0.486
248 HB2 GLN 34 1HB GLN 34 21.128 7.551 1.858
249 HB3 GLN 34 2HB GLN 34 20.743 6.317 0.635
250 HG2 GLN 34 1HG GLN 34 22.151 5.012 2.337
251 HG3 GLN 34 2HG GLN 34 22.986 5.589 0.875
252 HE21 GLN 34 2HE2 GLN 34 24.994 5.404 1.974
253 HE22 GLN 34 1HE2 GLN 34 25.488 6.586 3.140
254 H LYS 35 HN LYS 35 24.682 7.250 -0.268
255 HA LYS 35 HA LYS 35 24.762 6.539 -3.001
256 HB2 LYS 35 1HB LYS 35 26.720 7.117 -1.650
257 HB3 LYS 35 2HB LYS 35 26.539 5.595 -0.745
258 HG2 LYS 35 1HG LYS 35 26.986 4.307 -2.775
259 HG3 LYS 35 2HG LYS 35 27.099 5.809 -3.723
260 HD2 LYS 35 1HD LYS 35 29.031 6.520 -2.380
261 HD3 LYS 35 2HD LYS 35 28.914 5.030 -1.415
262 HE2 LYS 35 1HE LYS 35 29.317 3.689 -3.436
263 HE3 LYS 35 2HE LYS 35 29.440 5.180 -4.399
264 HZ1 LYS 35 3HZ LYS 35 31.233 4.416 -2.184
265 HZ2 LYS 35 1HZ LYS 35 31.603 4.333 -3.789
266 HZ3 LYS 35 2HZ LYS 35 31.347 5.799 -3.076
267 H GLU 36 HN GLU 36 24.107 4.531 -0.172
268 HA GLU 36 HA GLU 36 24.483 1.996 -1.439
269 HB2 GLU 36 1HB GLU 36 22.728 2.873 0.855
270 HB3 GLU 36 2HB GLU 36 22.932 1.178 0.350
271 HG2 GLU 36 1HG GLU 36 25.399 1.341 0.900
272 HG3 GLU 36 2HG GLU 36 25.074 3.051 1.267
273 H HIS 37 HN HIS 37 21.767 4.224 -1.433
274 HA HIS 37 HA HIS 37 20.028 2.200 -2.731
275 HB2 HIS 37 1HB HIS 37 19.486 5.092 -1.916
276 HB3 HIS 37 2HB HIS 37 18.283 3.953 -2.565
277 HD1 HIS 37 HD1 HIS 37 17.153 2.413 -0.966
278 HD2 HIS 37 HD2 HIS 37 20.456 4.319 0.826
279 HE1 HIS 37 HE1 HIS 37 16.989 1.937 1.425
280 H SER 38 HN SER 38 18.987 2.519 -4.715
281 HA SER 38 HA SER 38 20.957 3.367 -6.756
282 HB2 SER 38 1HB SER 38 19.946 1.302 -6.986
283 HB3 SER 38 2HB SER 38 18.325 2.035 -6.967
284 HG SER 38 HG SER 38 20.367 2.536 -8.874
285 H ARG 39 HN ARG 39 20.919 5.213 -7.872
286 HA ARG 39 HA ARG 39 18.734 7.150 -7.364
287 HB2 ARG 39 1HB ARG 39 21.029 7.856 -7.138
288 HB3 ARG 39 2HB ARG 39 21.289 7.511 -8.864
289 HG2 ARG 39 1HG ARG 39 19.622 9.203 -9.465
290 HG3 ARG 39 2HG ARG 39 19.330 9.537 -7.741
291 HD2 ARG 39 1HD ARG 39 21.753 10.163 -7.596
292 HD3 ARG 39 2HD ARG 39 21.771 10.109 -9.375
293 HE ARG 39 HE ARG 39 20.489 12.231 -9.340
294 HH11 ARG 39 1HH1 ARG 39 20.728 10.908 -6.122
295 HH12 ARG 39 2HH1 ARG 39 20.185 12.433 -5.449
296 HH21 ARG 39 1HH2 ARG 39 19.858 13.980 -8.585
297 HH22 ARG 39 2HH2 ARG 39 19.688 14.185 -6.853
298 H ILE 40 HN ILE 40 17.133 7.585 -8.653
299 HA ILE 40 HA ILE 40 16.888 6.295 -11.273
300 HB ILE 40 HB ILE 40 15.244 8.492 -9.932
301 HG12 ILE 40 1HG1 ILE 40 14.662 5.560 -10.254
302 HG13 ILE 40 2HG1 ILE 40 15.280 6.330 -8.774
303 HG21 ILE 40 1HG2 ILE 40 13.542 7.960 -11.645
304 HG22 ILE 40 2HG2 ILE 40 15.045 8.543 -12.396
305 HG23 ILE 40 3HG2 ILE 40 14.666 6.805 -12.402
306 HD11 ILE 40 3HD1 ILE 40 12.624 6.939 -10.119
307 HD12 ILE 40 1HD1 ILE 40 12.846 5.975 -8.641
308 HD13 ILE 40 2HD1 ILE 40 13.243 7.710 -8.639
309 HA PRO 41 HA PRO 41 19.225 9.049 -13.722
310 HB2 PRO 41 1HB PRO 41 17.148 8.150 -15.773
311 HB3 PRO 41 2HB PRO 41 18.908 8.201 -15.937
312 HG2 PRO 41 1HG PRO 41 17.705 5.856 -15.548
313 HG3 PRO 41 2HG PRO 41 19.218 6.202 -14.700
314 HD2 PRO 41 1HD PRO 41 16.380 6.230 -13.615
315 HD3 PRO 41 2HD PRO 41 17.869 5.709 -12.817
316 H ARG 42 HN ARG 42 19.128 11.081 -14.339
317 HA ARG 42 HA ARG 42 16.974 12.614 -13.214
318 HB2 ARG 42 1HB ARG 42 19.221 13.416 -15.003
319 HB3 ARG 42 2HB ARG 42 18.033 14.534 -14.294
320 HG2 ARG 42 1HG ARG 42 18.747 13.633 -12.023
321 HG3 ARG 42 2HG ARG 42 20.101 12.845 -12.868
322 HD2 ARG 42 1HD ARG 42 19.537 15.792 -12.852
323 HD3 ARG 42 2HD ARG 42 20.701 14.953 -11.802
324 HE ARG 42 HE ARG 42 21.192 15.566 -14.680
325 HH11 ARG 42 1HH1 ARG 42 22.235 13.815 -11.851
326 HH12 ARG 42 2HH1 ARG 42 23.817 13.583 -12.571
327 HH21 ARG 42 1HH2 ARG 42 23.001 15.317 -15.514
328 HH22 ARG 42 2HH2 ARG 42 24.255 14.440 -14.659
329 H SER 43 HN SER 43 17.752 11.684 -16.545
330 HA SER 43 HA SER 43 15.654 13.244 -17.837
331 HB2 SER 43 1HB SER 43 16.080 12.029 -19.726
332 HB3 SER 43 2HB SER 43 17.611 12.488 -18.946
333 HG SER 43 HG SER 43 17.592 10.315 -19.682
334 H GLN 44 HN GLN 44 15.862 10.012 -16.364
335 HA GLN 44 HA GLN 44 13.287 9.088 -17.296
336 HB2 GLN 44 1HB GLN 44 15.101 7.634 -16.435
337 HB3 GLN 44 2HB GLN 44 14.843 8.326 -14.817
338 HG2 GLN 44 1HG GLN 44 13.453 6.136 -14.837
339 HG3 GLN 44 2HG GLN 44 12.615 7.700 -14.972
340 HE21 GLN 44 2HE2 GLN 44 10.785 6.707 -15.889
341 HE22 GLN 44 1HE2 GLN 44 10.780 6.138 -17.526
342 H ILE 45 HN ILE 45 14.354 10.812 -14.388
343 HA ILE 45 HA ILE 45 11.825 10.798 -13.029
344 HB ILE 45 HB ILE 45 14.118 12.810 -13.020
345 HG12 ILE 45 1HG1 ILE 45 13.298 10.801 -10.943
346 HG13 ILE 45 2HG1 ILE 45 14.530 10.509 -12.191
347 HG21 ILE 45 1HG2 ILE 45 13.072 13.734 -10.981
348 HG22 ILE 45 2HG2 ILE 45 11.999 13.915 -12.389
349 HG23 ILE 45 3HG2 ILE 45 11.688 12.635 -11.192
350 HD11 ILE 45 3HD1 ILE 45 14.633 12.677 -10.064
351 HD12 ILE 45 1HD1 ILE 45 15.567 11.164 -10.054
352 HD13 ILE 45 2HD1 ILE 45 15.866 12.385 -11.313
353 H GLN 46 HN GLN 46 13.146 13.068 -15.416
354 HA GLN 46 HA GLN 46 10.931 14.896 -15.211
355 HB2 GLN 46 1HB GLN 46 12.932 14.356 -17.412
356 HB3 GLN 46 2HB GLN 46 11.743 15.679 -17.446
357 HG2 GLN 46 1HG GLN 46 13.001 16.630 -15.241
358 HG3 GLN 46 2HG GLN 46 13.872 15.115 -15.575
359 HE21 GLN 46 2HE2 GLN 46 15.141 17.610 -15.338
360 HE22 GLN 46 1HE2 GLN 46 15.798 18.045 -16.881
361 H ARG 47 HN ARG 47 11.465 11.976 -17.084
362 HA ARG 47 HA ARG 47 9.130 12.577 -18.814
363 HB2 ARG 47 1HB ARG 47 11.057 10.298 -18.860
364 HB3 ARG 47 2HB ARG 47 9.695 10.548 -19.978
365 HG2 ARG 47 1HG ARG 47 11.936 12.554 -19.624
366 HG3 ARG 47 2HG ARG 47 11.994 11.237 -20.822
367 HD2 ARG 47 1HD ARG 47 9.982 12.109 -21.859
368 HD3 ARG 47 2HD ARG 47 9.957 13.437 -20.676
369 HE ARG 47 HE ARG 47 12.450 13.648 -22.100
370 HH11 ARG 47 1HH1 ARG 47 9.053 13.822 -22.863
371 HH12 ARG 47 2HH1 ARG 47 9.396 14.946 -24.163
372 HH21 ARG 47 1HH2 ARG 47 12.861 14.927 -23.591
373 HH22 ARG 47 2HH2 ARG 47 11.568 15.576 -24.580
374 H ALA 48 HN ALA 48 9.865 10.866 -15.933
375 HA ALA 48 HA ALA 48 7.857 8.799 -16.241
376 HB1 ALA 48 3HB ALA 48 9.248 9.853 -13.754
377 HB2 ALA 48 1HB ALA 48 8.278 8.365 -13.851
378 HB3 ALA 48 2HB ALA 48 9.797 8.498 -14.769
379 H ARG 49 HN ARG 49 5.831 8.617 -15.416
380 HA ARG 49 HA ARG 49 4.410 11.136 -14.896
381 HB2 ARG 49 1HB ARG 49 3.494 8.302 -15.032
382 HB3 ARG 49 2HB ARG 49 2.450 9.683 -14.622
383 HG2 ARG 49 1HG ARG 49 3.038 10.708 -16.822
384 HG3 ARG 49 2HG ARG 49 3.932 9.222 -17.228
385 HD2 ARG 49 1HD ARG 49 1.910 7.943 -17.118
386 HD3 ARG 49 2HD ARG 49 0.998 9.386 -16.620
387 HE ARG 49 HE ARG 49 2.136 9.861 -19.260
388 HH11 ARG 49 1HH1 ARG 49 -0.335 7.933 -17.729
389 HH12 ARG 49 2HH1 ARG 49 -1.270 7.945 -19.212
390 HH21 ARG 49 1HH2 ARG 49 1.080 9.876 -20.967
391 HH22 ARG 49 2HH2 ARG 49 -0.465 9.051 -21.059
392 HA PRO 50 HA PRO 50 4.326 11.146 -10.490
393 HB2 PRO 50 1HB PRO 50 1.622 11.737 -10.072
394 HB3 PRO 50 2HB PRO 50 2.802 12.974 -10.527
395 HG2 PRO 50 1HG PRO 50 0.871 11.436 -12.294
396 HG3 PRO 50 2HG PRO 50 1.251 13.164 -12.302
397 HD2 PRO 50 1HD PRO 50 2.382 11.535 -14.141
398 HD3 PRO 50 2HD PRO 50 3.341 12.836 -13.422
399 H VAL 51 HN VAL 51 2.096 9.189 -12.356
400 HA VAL 51 HA VAL 51 1.536 7.373 -10.096
401 HB VAL 51 HB VAL 51 1.108 7.096 -13.100
402 HG11 VAL 51 1HG1 VAL 51 -0.301 5.156 -12.499
403 HG12 VAL 51 2HG1 VAL 51 1.387 4.900 -12.000
404 HG13 VAL 51 3HG1 VAL 51 0.159 5.350 -10.792
405 HG21 VAL 51 3HG2 VAL 51 -0.259 8.836 -12.113
406 HG22 VAL 51 1HG2 VAL 51 -1.252 7.431 -12.565
407 HG23 VAL 51 2HG2 VAL 51 -0.825 7.706 -10.859
408 H LYS 52 HN LYS 52 3.730 7.411 -12.878
409 HA LYS 52 HA LYS 52 4.732 4.745 -12.414
410 HB2 LYS 52 1HB LYS 52 5.864 7.150 -13.843
411 HB3 LYS 52 2HB LYS 52 6.665 5.561 -13.795
412 HG2 LYS 52 1HG LYS 52 4.673 4.557 -14.884
413 HG3 LYS 52 2HG LYS 52 3.943 6.176 -14.994
414 HD2 LYS 52 1HD LYS 52 5.846 6.935 -16.369
415 HD3 LYS 52 2HD LYS 52 6.558 5.307 -16.272
416 HE2 LYS 52 1HE LYS 52 4.569 4.376 -17.385
417 HE3 LYS 52 2HE LYS 52 3.871 6.008 -17.494
418 HZ1 LYS 52 3HZ LYS 52 6.378 5.127 -18.776
419 HZ2 LYS 52 1HZ LYS 52 4.938 5.358 -19.545
420 HZ3 LYS 52 2HZ LYS 52 5.731 6.641 -18.876
421 H MET 53 HN MET 53 5.749 7.946 -11.287
422 HA MET 53 HA MET 53 8.271 7.100 -10.202
423 HB2 MET 53 1HB MET 53 6.417 9.389 -9.571
424 HB3 MET 53 2HB MET 53 7.997 9.163 -8.784
425 HG2 MET 53 1HG MET 53 7.507 9.574 -11.751
426 HG3 MET 53 2HG MET 53 8.137 10.790 -10.613
427 HE1 MET 53 3HE MET 53 10.134 9.234 -8.793
428 HE2 MET 53 1HE MET 53 11.659 9.402 -9.698
429 HE3 MET 53 2HE MET 53 10.533 10.777 -9.587
430 H ALA 54 HN ALA 54 4.997 6.932 -8.983
431 HA ALA 54 HA ALA 54 5.573 6.544 -6.233
432 HB1 ALA 54 3HB ALA 54 3.360 5.319 -7.916
433 HB2 ALA 54 1HB ALA 54 3.396 5.392 -6.140
434 HB3 ALA 54 2HB ALA 54 3.300 6.893 -7.090
435 H THR 55 HN THR 55 5.684 4.301 -8.959
436 HA THR 55 HA THR 55 6.391 2.054 -7.157
437 HB THR 55 HB THR 55 6.180 2.185 -10.195
438 HG1 THR 55 HG1 THR 55 4.218 1.012 -9.766
439 HG21 THR 55 3HG2 THR 55 6.454 -0.181 -8.301
440 HG22 THR 55 1HG2 THR 55 6.215 -0.281 -10.060
441 HG23 THR 55 2HG2 THR 55 7.715 0.418 -9.404
442 H LEU 56 HN LEU 56 7.901 4.174 -9.551
443 HA LEU 56 HA LEU 56 10.353 2.725 -9.788
444 HB2 LEU 56 1HB LEU 56 9.630 5.571 -9.993
445 HB3 LEU 56 2HB LEU 56 11.253 5.055 -10.508
446 HG LEU 56 HG LEU 56 8.623 4.128 -11.725
447 HD11 LEU 56 1HD1 LEU 56 9.351 5.462 -13.720
448 HD12 LEU 56 2HD1 LEU 56 9.156 6.497 -12.287
449 HD13 LEU 56 3HD1 LEU 56 10.782 6.005 -12.815
450 HD21 LEU 56 3HD2 LEU 56 10.340 2.419 -11.825
451 HD22 LEU 56 1HD2 LEU 56 10.047 3.081 -13.450
452 HD23 LEU 56 2HD2 LEU 56 11.491 3.576 -12.533
453 H LEU 57 HN LEU 57 9.401 5.344 -7.578
454 HA LEU 57 HA LEU 57 11.975 5.599 -6.337
455 HB2 LEU 57 1HB LEU 57 9.209 6.084 -5.457
456 HB3 LEU 57 2HB LEU 57 10.548 6.639 -4.428
457 HG LEU 57 HG LEU 57 10.023 7.563 -7.278
458 HD11 LEU 57 1HD1 LEU 57 9.342 9.730 -6.214
459 HD12 LEU 57 2HD1 LEU 57 8.287 8.395 -5.696
460 HD13 LEU 57 3HD1 LEU 57 9.564 8.994 -4.611
461 HD21 LEU 57 3HD2 LEU 57 12.371 7.623 -6.678
462 HD22 LEU 57 1HD2 LEU 57 11.729 9.279 -6.783
463 HD23 LEU 57 2HD2 LEU 57 11.998 8.528 -5.192
464 H VAL 58 HN VAL 58 9.173 3.559 -5.599
465 HA VAL 58 HA VAL 58 10.341 2.371 -3.208
466 HB VAL 58 HB VAL 58 8.183 1.394 -5.123
467 HG11 VAL 58 1HG1 VAL 58 7.632 -0.236 -3.348
468 HG12 VAL 58 2HG1 VAL 58 9.281 -0.494 -3.966
469 HG13 VAL 58 3HG1 VAL 58 9.033 0.320 -2.402
470 HG21 VAL 58 3HG2 VAL 58 7.572 3.416 -3.938
471 HG22 VAL 58 1HG2 VAL 58 6.645 2.024 -3.333
472 HG23 VAL 58 2HG2 VAL 58 8.011 2.662 -2.386
473 H THR 59 HN THR 59 10.608 1.702 -6.640
474 HA THR 59 HA THR 59 11.733 -0.947 -6.293
475 HB THR 59 HB THR 59 11.920 1.004 -8.627
476 HG1 THR 59 HG1 THR 59 10.268 -0.403 -9.465
477 HG21 THR 59 3HG2 THR 59 12.531 -1.974 -8.469
478 HG22 THR 59 1HG2 THR 59 12.542 -0.987 -9.949
479 HG23 THR 59 2HG2 THR 59 13.732 -0.676 -8.662
480 H TYR 60 HN TYR 60 13.164 2.288 -6.718
481 HA TYR 60 HA TYR 60 15.848 1.006 -6.888
482 HB2 TYR 60 1HB TYR 60 14.851 3.806 -7.439
483 HB3 TYR 60 2HB TYR 60 16.562 3.318 -7.506
484 HD1 TYR 60 HD2 TYR 60 17.144 1.371 -9.123
485 HD2 TYR 60 HD1 TYR 60 13.518 3.604 -9.357
486 HE1 TYR 60 HE2 TYR 60 16.853 0.632 -11.463
487 HE2 TYR 60 HE1 TYR 60 13.211 2.873 -11.704
488 HH TYR 60 HH TYR 60 15.552 0.729 -13.331
489 H TYR 61 HN TYR 61 13.913 3.046 -4.808
490 HA TYR 61 HA TYR 61 16.287 3.397 -3.009
491 HB2 TYR 61 1HB TYR 61 13.654 4.886 -3.063
492 HB3 TYR 61 2HB TYR 61 15.037 5.206 -1.987
493 HD1 TYR 61 HD2 TYR 61 17.232 5.953 -3.061
494 HD2 TYR 61 HD1 TYR 61 13.535 5.914 -5.185
495 HE1 TYR 61 HE2 TYR 61 18.190 7.500 -4.733
496 HE2 TYR 61 HE1 TYR 61 14.478 7.465 -6.870
497 HH TYR 61 HH TYR 61 17.622 8.982 -6.482
498 H GLY 62 HN GLY 62 12.780 2.713 -2.927
499 HA2 GLY 62 1HA GLY 62 12.370 0.490 -1.714
500 HA3 GLY 62 2HA GLY 62 13.265 1.240 -0.371
501 H GLU 63 HN GLU 63 10.806 0.355 0.210
502 HA GLU 63 HA GLU 63 8.604 2.047 -0.488
503 HB2 GLU 63 1HB GLU 63 9.091 0.215 1.862
504 HB3 GLU 63 2HB GLU 63 7.548 1.048 1.553
505 HG2 GLU 63 1HG GLU 63 7.310 -0.219 -0.613
506 HG3 GLU 63 2HG GLU 63 8.933 -0.865 -0.279
507 H GLU 64 HN GLU 64 10.703 2.035 2.397
508 HA GLU 64 HA GLU 64 9.268 4.299 3.570
509 HB2 GLU 64 1HB GLU 64 11.862 2.910 4.252
510 HB3 GLU 64 2HB GLU 64 11.172 4.258 5.187
511 HG2 GLU 64 1HG GLU 64 9.156 2.827 5.721
512 HG3 GLU 64 2HG GLU 64 9.895 1.608 4.658
513 H TYR 65 HN TYR 65 12.402 3.847 1.945
514 HA TYR 65 HA TYR 65 13.279 6.562 2.381
515 HB2 TYR 65 1HB TYR 65 14.636 4.468 1.760
516 HB3 TYR 65 2HB TYR 65 14.119 4.804 0.088
517 HD1 TYR 65 HD1 TYR 65 14.671 7.610 2.353
518 HD2 TYR 65 HD2 TYR 65 16.506 5.099 -0.564
519 HE1 TYR 65 HE1 TYR 65 16.513 9.248 2.114
520 HE2 TYR 65 HE2 TYR 65 18.353 6.722 -0.814
521 HH TYR 65 HH TYR 65 18.464 9.757 1.067
522 H ALA 66 HN ALA 66 11.408 5.005 -0.171
523 HA ALA 66 HA ALA 66 11.403 7.156 -2.023
524 HB1 ALA 66 3HB ALA 66 9.193 5.172 -1.382
525 HB2 ALA 66 1HB ALA 66 9.286 6.191 -2.837
526 HB3 ALA 66 2HB ALA 66 10.511 4.932 -2.552
527 H VAL 67 HN VAL 67 9.305 6.524 0.784
528 HA VAL 67 HA VAL 67 7.662 8.900 0.411
529 HB VAL 67 HB VAL 67 8.232 7.173 2.853
530 HG11 VAL 67 1HG1 VAL 67 6.288 8.315 3.870
531 HG12 VAL 67 2HG1 VAL 67 7.596 9.469 3.516
532 HG13 VAL 67 3HG1 VAL 67 6.172 9.381 2.450
533 HG21 VAL 67 3HG2 VAL 67 7.060 6.001 1.087
534 HG22 VAL 67 1HG2 VAL 67 5.979 6.310 2.466
535 HG23 VAL 67 2HG2 VAL 67 5.853 7.305 0.995
536 H GLN 68 HN GLN 68 10.630 8.252 2.222
537 HA GLN 68 HA GLN 68 10.653 10.800 3.569
538 HB2 GLN 68 1HB GLN 68 12.836 8.842 2.839
539 HB3 GLN 68 2HB GLN 68 13.106 10.310 3.806
540 HG2 GLN 68 1HG GLN 68 11.413 9.225 5.617
541 HG3 GLN 68 2HG GLN 68 11.382 8.042 4.289
542 HE21 GLN 68 2HE2 GLN 68 12.017 7.442 6.992
543 HE22 GLN 68 1HE2 GLN 68 13.669 6.925 7.053
544 H LEU 69 HN LEU 69 12.026 9.683 0.496
545 HA LEU 69 HA LEU 69 13.437 12.162 -0.022
546 HB2 LEU 69 1HB LEU 69 12.489 9.883 -1.613
547 HB3 LEU 69 2HB LEU 69 13.387 11.165 -2.459
548 HG LEU 69 HG LEU 69 14.448 9.449 -0.179
549 HD11 LEU 69 1HD1 LEU 69 15.938 8.463 -1.940
550 HD12 LEU 69 2HD1 LEU 69 14.221 8.185 -2.316
551 HD13 LEU 69 3HD1 LEU 69 15.124 9.462 -3.166
552 HD21 LEU 69 3HD2 LEU 69 15.391 11.683 -0.161
553 HD22 LEU 69 1HD2 LEU 69 16.621 10.509 -0.685
554 HD23 LEU 69 2HD2 LEU 69 15.816 11.550 -1.884
555 H THR 70 HN THR 70 10.319 10.848 -1.142
556 HA THR 70 HA THR 70 9.617 13.101 -2.764
557 HB THR 70 HB THR 70 7.790 11.202 -1.233
558 HG1 THR 70 HG1 THR 70 8.779 11.126 -3.917
559 HG21 THR 70 3HG2 THR 70 7.267 13.004 -3.629
560 HG22 THR 70 1HG2 THR 70 6.110 11.855 -2.922
561 HG23 THR 70 2HG2 THR 70 6.653 13.264 -1.979
562 H LEU 71 HN LEU 71 9.040 12.417 0.676
563 HA LEU 71 HA LEU 71 7.543 14.804 1.208
564 HB2 LEU 71 1HB LEU 71 7.792 12.807 2.537
565 HB3 LEU 71 2HB LEU 71 9.389 13.305 3.144
566 HG LEU 71 HG LEU 71 6.794 14.854 3.496
567 HD11 LEU 71 1HD1 LEU 71 7.015 14.211 5.912
568 HD12 LEU 71 2HD1 LEU 71 6.859 12.777 4.873
569 HD13 LEU 71 3HD1 LEU 71 8.453 13.247 5.508
570 HD21 LEU 71 3HD2 LEU 71 8.732 16.305 3.362
571 HD22 LEU 71 1HD2 LEU 71 8.114 16.272 5.031
572 HD23 LEU 71 2HD2 LEU 71 9.573 15.346 4.602
573 H GLN 72 HN GLN 72 11.033 14.135 1.312
574 HA GLN 72 HA GLN 72 11.797 16.669 2.393
575 HB2 GLN 72 1HB GLN 72 13.246 14.666 2.241
576 HB3 GLN 72 2HB GLN 72 13.302 14.877 0.475
577 HG2 GLN 72 1HG GLN 72 15.446 16.042 1.335
578 HG3 GLN 72 2HG GLN 72 14.066 17.048 0.836
579 HE21 GLN 72 2HE2 GLN 72 14.821 18.811 2.055
580 HE22 GLN 72 1HE2 GLN 72 14.706 18.843 3.783
581 H VAL 73 HN VAL 73 11.269 15.606 -0.946
582 HA VAL 73 HA VAL 73 12.175 18.131 -2.120
583 HB VAL 73 HB VAL 73 10.470 15.860 -3.226
584 HG11 VAL 73 1HG1 VAL 73 10.904 16.890 -5.432
585 HG12 VAL 73 2HG1 VAL 73 9.997 17.997 -4.375
586 HG13 VAL 73 3HG1 VAL 73 11.741 18.244 -4.636
587 HG21 VAL 73 3HG2 VAL 73 12.738 15.184 -2.708
588 HG22 VAL 73 1HG2 VAL 73 12.488 15.263 -4.468
589 HG23 VAL 73 2HG2 VAL 73 13.382 16.559 -3.637
590 H LEU 74 HN LEU 74 9.007 16.797 -1.245
591 HA LEU 74 HA LEU 74 7.526 19.102 -2.144
592 HB2 LEU 74 1HB LEU 74 7.123 17.019 -0.107
593 HB3 LEU 74 2HB LEU 74 5.801 18.170 -0.409
594 HG LEU 74 HG LEU 74 6.980 16.209 -2.416
595 HD11 LEU 74 1HD1 LEU 74 4.725 15.120 -2.285
596 HD12 LEU 74 2HD1 LEU 74 5.533 15.125 -0.700
597 HD13 LEU 74 3HD1 LEU 74 4.242 16.302 -1.046
598 HD21 LEU 74 3HD2 LEU 74 6.291 18.272 -3.488
599 HD22 LEU 74 1HD2 LEU 74 5.164 16.961 -3.911
600 HD23 LEU 74 2HD2 LEU 74 4.697 18.181 -2.702
601 H ARG 75 HN ARG 75 9.223 18.340 0.851
602 HA ARG 75 HA ARG 75 8.358 20.675 2.304
603 HB2 ARG 75 1HB ARG 75 9.371 18.782 3.373
604 HB3 ARG 75 2HB ARG 75 10.909 19.144 2.554
605 HG2 ARG 75 1HG ARG 75 11.099 21.248 3.738
606 HG3 ARG 75 2HG ARG 75 9.493 21.020 4.470
607 HD2 ARG 75 1HD ARG 75 10.306 19.128 5.708
608 HD3 ARG 75 2HD ARG 75 11.905 19.298 4.945
609 HE ARG 75 HE ARG 75 11.302 21.729 6.441
610 HH11 ARG 75 1HH1 ARG 75 12.118 18.384 6.989
611 HH12 ARG 75 2HH1 ARG 75 12.889 18.813 8.504
612 HH21 ARG 75 1HH2 ARG 75 12.174 22.236 8.176
613 HH22 ARG 75 2HH2 ARG 75 12.920 21.010 9.182
614 H ALA 76 HN ALA 76 10.858 20.132 -0.114
615 HA ALA 76 HA ALA 76 12.238 22.613 0.330
616 HB1 ALA 76 3HB ALA 76 12.061 20.892 -2.167
617 HB2 ALA 76 1HB ALA 76 13.237 22.196 -1.884
618 HB3 ALA 76 2HB ALA 76 13.267 20.736 -0.868
619 H ILE 77 HN ILE 77 9.283 21.807 -1.283
620 HA ILE 77 HA ILE 77 9.198 24.542 -2.531
621 HB ILE 77 HB ILE 77 7.401 23.643 -3.960
622 HG12 ILE 77 1HG1 ILE 77 7.918 20.973 -2.685
623 HG13 ILE 77 2HG1 ILE 77 6.591 22.063 -2.222
624 HG21 ILE 77 1HG2 ILE 77 8.726 22.040 -5.295
625 HG22 ILE 77 2HG2 ILE 77 9.732 23.402 -4.748
626 HG23 ILE 77 3HG2 ILE 77 9.847 21.826 -3.929
627 HD11 ILE 77 3HD1 ILE 77 7.018 20.851 -4.976
628 HD12 ILE 77 1HD1 ILE 77 5.811 20.323 -3.782
629 HD13 ILE 77 2HD1 ILE 77 5.691 21.942 -4.513
630 H ASN 78 HN ASN 78 8.500 23.348 0.297
631 HA ASN 78 HA ASN 78 7.136 24.203 1.974
632 HB2 ASN 78 1HB ASN 78 6.352 26.461 -0.019
633 HB3 ASN 78 2HB ASN 78 5.990 26.049 1.674
634 HD21 ASN 78 2HD2 ASN 78 7.481 28.280 0.257
635 HD22 ASN 78 1HD2 ASN 78 8.981 28.391 1.115
636 H GLN 79 HN GLN 79 6.211 22.056 0.378
637 HA GLN 79 HA GLN 79 3.273 22.552 0.292
638 HB2 GLN 79 1HB GLN 79 4.443 21.343 -1.559
639 HB3 GLN 79 2HB GLN 79 4.854 20.066 -0.389
640 HG2 GLN 79 1HG GLN 79 2.682 19.228 -1.513
641 HG3 GLN 79 2HG GLN 79 2.584 19.919 0.123
642 HE21 GLN 79 2HE2 GLN 79 0.341 20.297 -0.182
643 HE22 GLN 79 1HE2 GLN 79 -0.222 21.617 -1.150
644 H ARG 80 HN ARG 80 2.755 22.779 2.428
645 HA ARG 80 HA ARG 80 3.804 20.987 4.456
646 HB2 ARG 80 1HB ARG 80 1.661 23.052 4.485
647 HB3 ARG 80 2HB ARG 80 2.035 22.008 5.876
648 HG2 ARG 80 1HG ARG 80 4.348 22.861 5.883
649 HG3 ARG 80 2HG ARG 80 3.952 23.923 4.510
650 HD2 ARG 80 1HD ARG 80 2.409 25.149 5.855
651 HD3 ARG 80 2HD ARG 80 2.668 24.038 7.220
652 HE ARG 80 HE ARG 80 5.198 25.323 6.610
653 HH11 ARG 80 1HH1 ARG 80 2.058 26.164 7.869
654 HH12 ARG 80 2HH1 ARG 80 2.778 27.443 8.828
655 HH21 ARG 80 1HH2 ARG 80 6.037 26.789 7.694
656 HH22 ARG 80 2HH2 ARG 80 5.047 27.801 8.728
657 H LEU 81 HN LEU 81 0.817 21.116 2.572
658 HA LEU 81 HA LEU 81 -0.685 19.298 4.182
659 HB2 LEU 81 1HB LEU 81 -1.671 20.666 2.660
660 HB3 LEU 81 2HB LEU 81 -0.861 20.026 1.211
661 HG LEU 81 HG LEU 81 -1.995 17.815 1.674
662 HD11 LEU 81 1HD1 LEU 81 -4.025 17.883 3.148
663 HD12 LEU 81 2HD1 LEU 81 -2.545 18.237 4.070
664 HD13 LEU 81 3HD1 LEU 81 -3.631 19.562 3.585
665 HD21 LEU 81 3HD2 LEU 81 -2.792 19.312 -0.058
666 HD22 LEU 81 1HD2 LEU 81 -4.171 18.516 0.738
667 HD23 LEU 81 2HD2 LEU 81 -3.774 20.207 1.126
668 H LEU 82 HN LEU 82 1.111 18.637 1.156
669 HA LEU 82 HA LEU 82 0.563 15.788 1.375
670 HB2 LEU 82 1HB LEU 82 2.401 17.437 -0.228
671 HB3 LEU 82 2HB LEU 82 2.255 15.700 -0.584
672 HG LEU 82 HG LEU 82 0.080 17.814 -0.846
673 HD11 LEU 82 1HD1 LEU 82 0.190 17.220 -3.282
674 HD12 LEU 82 2HD1 LEU 82 1.757 17.821 -2.692
675 HD13 LEU 82 3HD1 LEU 82 1.504 16.075 -2.927
676 HD21 LEU 82 3HD2 LEU 82 -0.856 15.728 -0.039
677 HD22 LEU 82 1HD2 LEU 82 -1.334 15.993 -1.733
678 HD23 LEU 82 2HD2 LEU 82 -0.048 14.827 -1.342
679 H ALA 83 HN ALA 83 3.137 17.899 2.420
680 HA ALA 83 HA ALA 83 5.088 15.883 2.964
681 HB1 ALA 83 3HB ALA 83 4.560 18.509 4.398
682 HB2 ALA 83 1HB ALA 83 6.033 17.523 4.542
683 HB3 ALA 83 2HB ALA 83 5.618 18.278 2.985
684 H GLU 84 HN GLU 84 2.446 17.210 4.951
685 HA GLU 84 HA GLU 84 2.950 15.518 7.233
686 HB2 GLU 84 1HB GLU 84 1.593 17.535 7.349
687 HB3 GLU 84 2HB GLU 84 0.406 16.811 6.237
688 HG2 GLU 84 1HG GLU 84 -0.067 15.029 8.014
689 HG3 GLU 84 2HG GLU 84 1.145 15.895 8.985
690 H GLU 85 HN GLU 85 0.978 15.115 4.316
691 HA GLU 85 HA GLU 85 -0.306 12.684 5.128
692 HB2 GLU 85 1HB GLU 85 0.425 13.802 2.421
693 HB3 GLU 85 2HB GLU 85 -0.511 12.306 2.652
694 HG2 GLU 85 1HG GLU 85 -1.399 15.125 3.514
695 HG3 GLU 85 2HG GLU 85 -1.939 14.120 2.151
696 H LEU 86 HN LEU 86 2.808 13.306 3.567
697 HA LEU 86 HA LEU 86 3.391 10.454 3.264
698 HB2 LEU 86 1HB LEU 86 4.925 12.960 3.121
699 HB3 LEU 86 2HB LEU 86 5.769 11.429 2.788
700 HG LEU 86 HG LEU 86 3.459 12.618 1.204
701 HD11 LEU 86 1HD1 LEU 86 5.158 12.768 -0.635
702 HD12 LEU 86 2HD1 LEU 86 5.657 13.718 0.785
703 HD13 LEU 86 3HD1 LEU 86 6.393 12.128 0.473
704 HD21 LEU 86 3HD2 LEU 86 3.286 10.201 1.299
705 HD22 LEU 86 1HD2 LEU 86 3.778 10.711 -0.333
706 HD23 LEU 86 2HD2 LEU 86 4.983 10.032 0.788
707 H HIS 87 HN HIS 87 4.089 12.972 5.635
708 HA HIS 87 HA HIS 87 5.828 11.434 7.305
709 HB2 HIS 87 1HB HIS 87 5.502 13.839 7.682
710 HB3 HIS 87 2HB HIS 87 3.780 13.572 8.046
711 HD1 HIS 87 HD1 HIS 87 7.211 12.641 9.414
712 HD2 HIS 87 HD2 HIS 87 3.272 13.226 10.793
713 HE1 HIS 87 HE1 HIS 87 7.300 12.373 11.842
714 H ARG 88 HN ARG 88 2.281 11.632 7.177
715 HA ARG 88 HA ARG 88 1.931 9.745 9.372
716 HB2 ARG 88 1HB ARG 88 0.011 10.732 7.310
717 HB3 ARG 88 2HB ARG 88 -0.386 9.659 8.672
718 HG2 ARG 88 1HG ARG 88 0.234 11.389 10.264
719 HG3 ARG 88 2HG ARG 88 0.753 12.458 8.938
720 HD2 ARG 88 1HD ARG 88 -1.570 12.457 8.121
721 HD3 ARG 88 2HD ARG 88 -2.030 11.538 9.573
722 HE ARG 88 HE ARG 88 -1.479 14.454 9.560
723 HH11 ARG 88 1HH1 ARG 88 -1.728 11.590 11.532
724 HH12 ARG 88 2HH1 ARG 88 -1.961 12.584 12.957
725 HH21 ARG 88 1HH2 ARG 88 -1.753 15.607 11.180
726 HH22 ARG 88 2HH2 ARG 88 -1.977 14.874 12.757
727 H ALA 89 HN ALA 89 2.193 9.501 5.871
728 HA ALA 89 HA ALA 89 1.519 6.710 5.719
729 HB1 ALA 89 3HB ALA 89 3.340 8.384 3.956
730 HB2 ALA 89 1HB ALA 89 2.700 6.773 3.556
731 HB3 ALA 89 2HB ALA 89 1.589 8.152 3.735
732 H ALA 90 HN ALA 90 4.565 8.442 6.285
733 HA ALA 90 HA ALA 90 6.226 6.105 6.289
734 HB1 ALA 90 3HB ALA 90 6.600 8.766 7.705
735 HB2 ALA 90 1HB ALA 90 7.860 7.535 7.453
736 HB3 ALA 90 2HB ALA 90 7.139 8.370 6.056
737 H ILE 91 HN ILE 91 4.302 7.691 8.790
738 HA ILE 91 HA ILE 91 5.188 6.024 10.985
739 HB ILE 91 HB ILE 91 2.576 7.510 10.461
740 HG12 ILE 91 1HG1 ILE 91 4.794 8.124 12.392
741 HG13 ILE 91 2HG1 ILE 91 4.675 8.806 10.753
742 HG21 ILE 91 1HG2 ILE 91 2.075 7.120 12.850
743 HG22 ILE 91 2HG2 ILE 91 2.185 5.584 11.959
744 HG23 ILE 91 3HG2 ILE 91 3.533 6.111 12.991
745 HD11 ILE 91 3HD1 ILE 91 2.628 9.146 12.973
746 HD12 ILE 91 1HD1 ILE 91 3.794 10.376 12.436
747 HD13 ILE 91 2HD1 ILE 91 2.509 9.828 11.333
748 H GLN 92 HN GLN 92 2.686 5.608 8.526
749 HA GLN 92 HA GLN 92 1.698 3.140 9.703
750 HB2 GLN 92 1HB GLN 92 1.467 4.356 6.945
751 HB3 GLN 92 2HB GLN 92 0.670 2.841 7.436
752 HG2 GLN 92 1HG GLN 92 -0.668 4.346 9.254
753 HG3 GLN 92 2HG GLN 92 0.420 5.524 8.481
754 HE21 GLN 92 2HE2 GLN 92 -2.324 5.931 8.607
755 HE22 GLN 92 1HE2 GLN 92 -2.993 5.816 7.013
756 H LEU 93 HN LEU 93 4.288 3.972 7.519
757 HA LEU 93 HA LEU 93 4.781 1.201 6.717
758 HB2 LEU 93 1HB LEU 93 6.294 3.722 6.653
759 HB3 LEU 93 2HB LEU 93 7.034 2.268 5.945
760 HG LEU 93 HG LEU 93 4.470 3.624 5.021
761 HD11 LEU 93 1HD1 LEU 93 5.793 4.130 2.951
762 HD12 LEU 93 2HD1 LEU 93 6.538 4.864 4.390
763 HD13 LEU 93 3HD1 LEU 93 7.220 3.373 3.697
764 HD21 LEU 93 3HD2 LEU 93 4.344 1.217 4.755
765 HD22 LEU 93 1HD2 LEU 93 4.515 1.997 3.164
766 HD23 LEU 93 2HD2 LEU 93 5.916 1.199 3.920
Start of MODEL 5
1 H THR 4 1H THR 4 -1.139 -0.138 -1.489
2 HA THR 4 HA THR 4 1.097 -0.433 0.267
3 HB THR 4 HB THR 4 2.455 -0.709 -1.723
4 HG1 THR 4 HG1 THR 4 0.231 0.476 -3.071
5 HG21 THR 4 3HG2 THR 4 -0.346 -1.801 -2.204
6 HG22 THR 4 1HG2 THR 4 1.151 -2.413 -2.946
7 HG23 THR 4 2HG2 THR 4 0.904 -2.558 -1.189
8 HA PRO 5 HA PRO 5 2.975 3.458 0.833
9 HB2 PRO 5 1HB PRO 5 5.477 2.294 -0.461
10 HB3 PRO 5 2HB PRO 5 5.317 3.094 1.108
11 HG2 PRO 5 1HG PRO 5 5.592 0.447 1.023
12 HG3 PRO 5 2HG PRO 5 4.439 1.159 2.161
13 HD2 PRO 5 1HD PRO 5 3.886 -0.210 -0.502
14 HD3 PRO 5 2HD PRO 5 2.972 -0.310 1.009
15 H SER 6 HN SER 6 3.352 1.907 -2.310
16 HA SER 6 HA SER 6 4.231 4.269 -3.769
17 HB2 SER 6 1HB SER 6 3.901 3.095 -5.670
18 HB3 SER 6 2HB SER 6 4.589 1.993 -4.454
19 HG SER 6 HG SER 6 2.376 1.291 -4.104
20 H ASP 7 HN ASP 7 1.116 3.028 -2.684
21 HA ASP 7 HA ASP 7 -0.434 4.825 -4.423
22 HB2 ASP 7 1HB ASP 7 -1.341 3.140 -2.009
23 HB3 ASP 7 2HB ASP 7 -2.267 4.164 -3.135
24 H HIS 8 HN HIS 8 0.718 4.790 -1.080
25 HA HIS 8 HA HIS 8 -0.591 7.276 -0.356
26 HB2 HIS 8 1HB HIS 8 1.792 5.775 0.810
27 HB3 HIS 8 2HB HIS 8 1.134 7.275 1.509
28 HD1 HIS 8 HD1 HIS 8 1.096 4.919 3.288
29 HD2 HIS 8 HD2 HIS 8 -2.097 5.639 0.704
30 HE1 HIS 8 HE1 HIS 8 -0.764 3.741 4.262
31 H LEU 9 HN LEU 9 2.469 6.450 -1.887
32 HA LEU 9 HA LEU 9 3.467 9.178 -1.906
33 HB2 LEU 9 1HB LEU 9 3.941 6.771 -3.531
34 HB3 LEU 9 2HB LEU 9 4.951 8.209 -3.805
35 HG LEU 9 HG LEU 9 4.777 6.647 -1.199
36 HD11 LEU 9 1HD1 LEU 9 7.106 5.897 -1.758
37 HD12 LEU 9 2HD1 LEU 9 5.941 5.360 -2.990
38 HD13 LEU 9 3HD1 LEU 9 6.994 6.759 -3.309
39 HD21 LEU 9 3HD2 LEU 9 5.258 8.998 -0.857
40 HD22 LEU 9 1HD2 LEU 9 6.709 8.025 -0.516
41 HD23 LEU 9 2HD2 LEU 9 6.583 8.929 -2.044
42 H LEU 10 HN LEU 10 1.639 7.195 -4.222
43 HA LEU 10 HA LEU 10 1.474 9.193 -6.267
44 HB2 LEU 10 1HB LEU 10 1.029 6.971 -6.629
45 HB3 LEU 10 2HB LEU 10 -0.388 6.862 -5.559
46 HG LEU 10 HG LEU 10 -1.546 8.528 -7.033
47 HD11 LEU 10 1HD1 LEU 10 -0.603 8.887 -9.330
48 HD12 LEU 10 2HD1 LEU 10 0.492 9.514 -8.077
49 HD13 LEU 10 3HD1 LEU 10 0.840 7.958 -8.866
50 HD21 LEU 10 3HD2 LEU 10 -2.011 6.157 -7.233
51 HD22 LEU 10 1HD2 LEU 10 -2.062 6.923 -8.839
52 HD23 LEU 10 2HD2 LEU 10 -0.646 5.955 -8.358
53 H SER 11 HN SER 11 -0.479 8.599 -3.382
54 HA SER 11 HA SER 11 -2.750 10.216 -3.860
55 HB2 SER 11 1HB SER 11 -2.546 8.798 -2.014
56 HB3 SER 11 2HB SER 11 -1.284 9.839 -1.319
57 HG SER 11 HG SER 11 -3.370 10.299 -0.494
58 H THR 12 HN THR 12 0.445 11.167 -2.523
59 HA THR 12 HA THR 12 -0.356 13.959 -2.235
60 HB THR 12 HB THR 12 2.004 14.343 -1.625
61 HG1 THR 12 HG1 THR 12 3.424 12.501 -1.646
62 HG21 THR 12 3HG2 THR 12 0.870 11.801 -0.393
63 HG22 THR 12 1HG2 THR 12 2.115 12.844 0.334
64 HG23 THR 12 2HG2 THR 12 0.463 13.463 0.095
65 H LEU 13 HN LEU 13 1.117 12.041 -4.733
66 HA LEU 13 HA LEU 13 2.075 14.365 -6.243
67 HB2 LEU 13 1HB LEU 13 1.586 11.527 -6.855
68 HB3 LEU 13 2HB LEU 13 2.337 12.568 -8.087
69 HG LEU 13 HG LEU 13 3.497 11.842 -5.368
70 HD11 LEU 13 1HD1 LEU 13 5.252 10.675 -6.730
71 HD12 LEU 13 2HD1 LEU 13 3.634 10.007 -7.050
72 HD13 LEU 13 3HD1 LEU 13 4.380 11.128 -8.213
73 HD21 LEU 13 3HD2 LEU 13 4.065 14.119 -5.978
74 HD22 LEU 13 1HD2 LEU 13 5.503 13.079 -6.108
75 HD23 LEU 13 2HD2 LEU 13 4.631 13.581 -7.577
76 H GLU 14 HN GLU 14 -0.874 12.507 -6.018
77 HA GLU 14 HA GLU 14 -2.089 13.729 -8.379
78 HB2 GLU 14 1HB GLU 14 -3.194 12.271 -5.978
79 HB3 GLU 14 2HB GLU 14 -4.206 12.915 -7.294
80 HG2 GLU 14 1HG GLU 14 -2.987 11.383 -8.919
81 HG3 GLU 14 2HG GLU 14 -2.026 10.881 -7.509
82 H GLU 15 HN GLU 15 -1.846 14.514 -4.958
83 HA GLU 15 HA GLU 15 -3.764 16.678 -5.012
84 HB2 GLU 15 1HB GLU 15 -1.381 16.082 -3.256
85 HB3 GLU 15 2HB GLU 15 -2.485 17.455 -3.000
86 HG2 GLU 15 1HG GLU 15 -3.239 14.477 -2.814
87 HG3 GLU 15 2HG GLU 15 -3.034 15.699 -1.538
88 H LEU 16 HN LEU 16 -0.381 16.411 -5.902
89 HA LEU 16 HA LEU 16 0.015 19.277 -6.207
90 HB2 LEU 16 1HB LEU 16 1.306 16.861 -7.284
91 HB3 LEU 16 2HB LEU 16 2.029 18.449 -7.625
92 HG LEU 16 HG LEU 16 1.683 17.174 -4.884
93 HD11 LEU 16 1HD1 LEU 16 4.191 17.103 -4.890
94 HD12 LEU 16 2HD1 LEU 16 3.514 16.153 -6.234
95 HD13 LEU 16 3HD1 LEU 16 4.191 17.771 -6.539
96 HD21 LEU 16 3HD2 LEU 16 1.421 19.582 -4.782
97 HD22 LEU 16 1HD2 LEU 16 2.970 19.108 -4.045
98 HD23 LEU 16 2HD2 LEU 16 2.941 19.815 -5.679
99 H VAL 17 HN VAL 17 -0.437 20.605 -7.796
100 HA VAL 17 HA VAL 17 -1.843 19.667 -10.209
101 HB VAL 17 HB VAL 17 -1.759 22.012 -10.900
102 HG11 VAL 17 1HG1 VAL 17 -2.966 23.038 -9.002
103 HG12 VAL 17 2HG1 VAL 17 -3.495 21.359 -9.266
104 HG13 VAL 17 3HG1 VAL 17 -2.383 21.742 -7.931
105 HG21 VAL 17 3HG2 VAL 17 0.500 22.536 -10.198
106 HG22 VAL 17 1HG2 VAL 17 -0.657 23.718 -9.540
107 HG23 VAL 17 2HG2 VAL 17 0.010 22.446 -8.488
108 HA PRO 18 HA PRO 18 1.135 18.727 -13.074
109 HB2 PRO 18 1HB PRO 18 0.150 21.075 -14.772
110 HB3 PRO 18 2HB PRO 18 0.396 19.391 -15.257
111 HG2 PRO 18 1HG PRO 18 -2.080 20.269 -14.812
112 HG3 PRO 18 2HG PRO 18 -1.617 18.661 -14.239
113 HD2 PRO 18 1HD PRO 18 -1.971 21.218 -12.645
114 HD3 PRO 18 2HD PRO 18 -2.321 19.552 -12.167
115 H TYR 19 HN TYR 19 0.895 22.134 -12.230
116 HA TYR 19 HA TYR 19 3.572 22.736 -13.263
117 HB2 TYR 19 1HB TYR 19 1.645 24.254 -11.497
118 HB3 TYR 19 2HB TYR 19 3.220 24.882 -12.040
119 HD1 TYR 19 HD2 TYR 19 3.603 25.251 -14.498
120 HD2 TYR 19 HD1 TYR 19 -0.254 24.323 -12.936
121 HE1 TYR 19 HE2 TYR 19 2.571 26.064 -16.592
122 HE2 TYR 19 HE1 TYR 19 -1.306 25.134 -15.027
123 HH TYR 19 HH TYR 19 -0.967 26.029 -17.087
124 H ASP 20 HN ASP 20 2.150 21.894 -10.151
125 HA ASP 20 HA ASP 20 4.707 22.379 -8.750
126 HB2 ASP 20 1HB ASP 20 2.009 21.282 -7.753
127 HB3 ASP 20 2HB ASP 20 3.560 21.425 -6.888
128 H PHE 21 HN PHE 21 2.992 19.732 -10.232
129 HA PHE 21 HA PHE 21 4.713 17.655 -9.135
130 HB2 PHE 21 1HB PHE 21 2.521 17.105 -10.131
131 HB3 PHE 21 2HB PHE 21 3.068 17.730 -11.702
132 HD1 PHE 21 HD1 PHE 21 3.939 15.195 -9.112
133 HD2 PHE 21 HD2 PHE 21 3.980 16.308 -13.236
134 HE1 PHE 21 HE1 PHE 21 4.792 12.952 -9.707
135 HE2 PHE 21 HE2 PHE 21 4.831 14.065 -13.835
136 HZ PHE 21 HZ PHE 21 5.238 12.388 -12.069
137 H GLU 22 HN GLU 22 4.747 19.571 -12.146
138 HA GLU 22 HA GLU 22 7.222 18.602 -13.162
139 HB2 GLU 22 1HB GLU 22 5.694 20.089 -14.373
140 HB3 GLU 22 2HB GLU 22 6.088 21.403 -13.239
141 HG2 GLU 22 1HG GLU 22 8.475 21.377 -14.074
142 HG3 GLU 22 2HG GLU 22 7.981 19.988 -15.070
143 H LYS 23 HN LYS 23 6.605 21.286 -10.888
144 HA LYS 23 HA LYS 23 9.347 21.856 -10.322
145 HB2 LYS 23 1HB LYS 23 7.363 23.215 -9.659
146 HB3 LYS 23 2HB LYS 23 7.000 21.985 -8.426
147 HG2 LYS 23 1HG LYS 23 9.195 22.429 -7.366
148 HG3 LYS 23 2HG LYS 23 9.506 23.696 -8.577
149 HD2 LYS 23 1HD LYS 23 7.468 24.891 -7.802
150 HD3 LYS 23 2HD LYS 23 7.250 23.652 -6.544
151 HE2 LYS 23 1HE LYS 23 9.578 24.229 -5.733
152 HE3 LYS 23 2HE LYS 23 9.535 25.618 -6.844
153 HZ1 LYS 23 3HZ LYS 23 7.637 25.126 -4.638
154 HZ2 LYS 23 1HZ LYS 23 8.860 26.233 -4.623
155 HZ3 LYS 23 2HZ LYS 23 7.596 26.414 -5.668
156 H PHE 24 HN PHE 24 7.102 19.528 -8.835
157 HA PHE 24 HA PHE 24 8.846 18.529 -6.833
158 HB2 PHE 24 1HB PHE 24 6.441 17.916 -7.007
159 HB3 PHE 24 2HB PHE 24 6.796 16.981 -8.476
160 HD1 PHE 24 HD2 PHE 24 8.140 14.937 -8.348
161 HD2 PHE 24 HD1 PHE 24 6.895 17.064 -4.858
162 HE1 PHE 24 HE2 PHE 24 8.606 12.940 -6.966
163 HE2 PHE 24 HE1 PHE 24 7.363 15.071 -3.473
164 HZ PHE 24 HZ PHE 24 8.218 13.008 -4.528
165 H LYS 25 HN LYS 25 8.496 17.500 -10.229
166 HA LYS 25 HA LYS 25 10.427 15.383 -10.062
167 HB2 LYS 25 1HB LYS 25 9.480 17.077 -12.376
168 HB3 LYS 25 2HB LYS 25 10.553 15.667 -12.538
169 HG2 LYS 25 1HG LYS 25 8.774 14.245 -11.534
170 HG3 LYS 25 2HG LYS 25 7.701 15.664 -11.494
171 HD2 LYS 25 1HD LYS 25 8.989 14.583 -14.020
172 HD3 LYS 25 2HD LYS 25 7.361 14.126 -13.466
173 HE2 LYS 25 1HE LYS 25 6.696 16.507 -13.518
174 HE3 LYS 25 2HE LYS 25 8.310 16.929 -14.134
175 HZ1 LYS 25 3HZ LYS 25 6.358 15.187 -15.497
176 HZ2 LYS 25 1HZ LYS 25 6.703 16.748 -15.908
177 HZ3 LYS 25 2HZ LYS 25 7.855 15.578 -16.068
178 H PHE 26 HN PHE 26 10.739 18.826 -10.842
179 HA PHE 26 HA PHE 26 13.529 18.618 -11.620
180 HB2 PHE 26 1HB PHE 26 11.806 20.992 -10.793
181 HB3 PHE 26 2HB PHE 26 13.473 21.124 -11.397
182 HD1 PHE 26 HD1 PHE 26 12.355 18.477 -13.177
183 HD2 PHE 26 HD2 PHE 26 11.636 22.668 -12.781
184 HE1 PHE 26 HE1 PHE 26 11.510 18.549 -15.500
185 HE2 PHE 26 HE2 PHE 26 10.788 22.745 -15.102
186 HZ PHE 26 HZ PHE 26 10.727 20.684 -16.461
187 H LYS 27 HN LYS 27 11.852 19.029 -8.582
188 HA LYS 27 HA LYS 27 14.264 19.927 -7.163
189 HB2 LYS 27 1HB LYS 27 11.478 19.137 -6.341
190 HB3 LYS 27 2HB LYS 27 12.768 19.446 -5.154
191 HG2 LYS 27 1HG LYS 27 11.736 21.430 -7.211
192 HG3 LYS 27 2HG LYS 27 11.318 21.420 -5.481
193 HD2 LYS 27 1HD LYS 27 13.721 21.716 -4.930
194 HD3 LYS 27 2HD LYS 27 14.086 21.811 -6.669
195 HE2 LYS 27 1HE LYS 27 12.657 23.786 -6.879
196 HE3 LYS 27 2HE LYS 27 12.241 23.682 -5.153
197 HZ1 LYS 27 3HZ LYS 27 14.942 24.159 -6.239
198 HZ2 LYS 27 1HZ LYS 27 13.968 25.301 -5.556
199 HZ3 LYS 27 2HZ LYS 27 14.557 24.063 -4.638
200 H LEU 28 HN LEU 28 12.581 16.899 -7.752
201 HA LEU 28 HA LEU 28 14.073 15.302 -5.889
202 HB2 LEU 28 1HB LEU 28 12.109 14.632 -6.917
203 HB3 LEU 28 2HB LEU 28 12.769 14.566 -8.568
204 HG LEU 28 HG LEU 28 14.378 12.805 -7.772
205 HD11 LEU 28 1HD1 LEU 28 13.818 11.630 -5.627
206 HD12 LEU 28 2HD1 LEU 28 14.254 13.330 -5.338
207 HD13 LEU 28 3HD1 LEU 28 12.544 12.833 -5.318
208 HD21 LEU 28 3HD2 LEU 28 12.380 12.207 -9.009
209 HD22 LEU 28 1HD2 LEU 28 12.718 10.975 -7.770
210 HD23 LEU 28 2HD2 LEU 28 11.425 12.170 -7.507
211 H GLN 29 HN GLN 29 14.759 16.385 -9.186
212 HA GLN 29 HA GLN 29 17.170 14.868 -9.529
213 HB2 GLN 29 1HB GLN 29 16.293 17.550 -10.616
214 HB3 GLN 29 2HB GLN 29 17.764 16.693 -11.133
215 HG2 GLN 29 1HG GLN 29 16.139 14.754 -12.051
216 HG3 GLN 29 2HG GLN 29 15.001 15.847 -11.231
217 HE21 GLN 29 2HE2 GLN 29 14.734 15.011 -13.912
218 HE22 GLN 29 1HE2 GLN 29 14.929 16.393 -14.938
219 H ASN 30 HN ASN 30 16.515 17.971 -7.974
220 HA ASN 30 HA ASN 30 19.364 18.500 -7.501
221 HB2 ASN 30 1HB ASN 30 16.930 20.034 -6.314
222 HB3 ASN 30 2HB ASN 30 18.701 20.102 -6.141
223 HD21 ASN 30 2HD2 ASN 30 16.661 21.998 -7.227
224 HD22 ASN 30 1HD2 ASN 30 17.246 22.423 -8.802
225 H THR 31 HN THR 31 16.733 16.939 -5.805
226 HA THR 31 HA THR 31 17.905 16.998 -3.178
227 HB THR 31 HB THR 31 16.021 14.937 -4.401
228 HG1 THR 31 HG1 THR 31 15.505 17.297 -2.865
229 HG21 THR 31 3HG2 THR 31 16.640 15.636 -1.503
230 HG22 THR 31 1HG2 THR 31 15.413 14.471 -2.053
231 HG23 THR 31 2HG2 THR 31 17.139 14.149 -2.344
232 H SER 32 HN SER 32 19.295 15.763 -2.128
233 HA SER 32 HA SER 32 21.315 14.288 -3.584
234 HB2 SER 32 1HB SER 32 22.268 13.807 -1.579
235 HB3 SER 32 2HB SER 32 21.686 15.487 -1.551
236 HG SER 32 HG SER 32 21.214 14.350 0.381
237 H VAL 33 HN VAL 33 21.917 12.028 -2.916
238 HA VAL 33 HA VAL 33 19.470 10.271 -3.083
239 HB VAL 33 HB VAL 33 20.848 8.697 -4.348
240 HG11 VAL 33 1HG1 VAL 33 21.167 10.005 -6.422
241 HG12 VAL 33 2HG1 VAL 33 19.636 10.435 -5.622
242 HG13 VAL 33 3HG1 VAL 33 21.045 11.515 -5.487
243 HG21 VAL 33 3HG2 VAL 33 22.992 9.154 -3.316
244 HG22 VAL 33 1HG2 VAL 33 23.105 9.264 -5.089
245 HG23 VAL 33 2HG2 VAL 33 23.053 10.748 -4.107
246 H GLN 34 HN GLN 34 19.795 8.047 -2.382
247 HA GLN 34 HA GLN 34 20.832 8.213 0.381
248 HB2 GLN 34 1HB GLN 34 19.316 6.033 -1.070
249 HB3 GLN 34 2HB GLN 34 19.705 6.059 0.666
250 HG2 GLN 34 1HG GLN 34 17.631 7.999 -0.681
251 HG3 GLN 34 2HG GLN 34 17.583 6.534 0.326
252 HE21 GLN 34 2HE2 GLN 34 17.640 9.918 0.292
253 HE22 GLN 34 1HE2 GLN 34 17.969 10.188 1.972
254 H LYS 35 HN LYS 35 22.090 6.562 1.356
255 HA LYS 35 HA LYS 35 24.430 6.033 -0.315
256 HB2 LYS 35 1HB LYS 35 24.579 6.752 2.035
257 HB3 LYS 35 2HB LYS 35 23.805 5.228 2.530
258 HG2 LYS 35 1HG LYS 35 25.695 3.948 1.682
259 HG3 LYS 35 2HG LYS 35 26.455 5.433 1.062
260 HD2 LYS 35 1HD LYS 35 26.636 6.307 3.353
261 HD3 LYS 35 2HD LYS 35 25.862 4.832 3.979
262 HE2 LYS 35 1HE LYS 35 27.713 3.482 3.083
263 HE3 LYS 35 2HE LYS 35 28.488 4.958 2.466
264 HZ1 LYS 35 3HZ LYS 35 27.952 4.364 5.304
265 HZ2 LYS 35 1HZ LYS 35 29.425 4.274 4.568
266 HZ3 LYS 35 2HZ LYS 35 28.671 5.734 4.732
267 H GLU 36 HN GLU 36 25.047 4.273 -1.305
268 HA GLU 36 HA GLU 36 24.926 2.130 -2.195
269 HB2 GLU 36 1HB GLU 36 23.834 1.536 0.558
270 HB3 GLU 36 2HB GLU 36 24.305 0.312 -0.645
271 HG2 GLU 36 1HG GLU 36 26.697 1.208 -0.523
272 HG3 GLU 36 2HG GLU 36 26.045 2.359 0.664
273 H HIS 37 HN HIS 37 22.761 3.922 -2.695
274 HA HIS 37 HA HIS 37 20.865 1.771 -3.543
275 HB2 HIS 37 1HB HIS 37 20.112 4.546 -2.521
276 HB3 HIS 37 2HB HIS 37 18.995 3.434 -3.349
277 HD1 HIS 37 HD1 HIS 37 18.539 1.113 -2.081
278 HD2 HIS 37 HD2 HIS 37 20.349 4.102 0.275
279 HE1 HIS 37 HE1 HIS 37 18.137 0.475 0.243
280 H SER 38 HN SER 38 19.621 2.297 -5.457
281 HA SER 38 HA SER 38 21.523 3.104 -7.550
282 HB2 SER 38 1HB SER 38 18.720 2.174 -7.682
283 HB3 SER 38 2HB SER 38 19.801 2.505 -9.054
284 HG SER 38 HG SER 38 19.807 0.302 -8.431
285 H ARG 39 HN ARG 39 21.494 4.891 -8.813
286 HA ARG 39 HA ARG 39 19.752 7.140 -7.948
287 HB2 ARG 39 1HB ARG 39 22.086 7.111 -9.808
288 HB3 ARG 39 2HB ARG 39 21.133 8.531 -9.320
289 HG2 ARG 39 1HG ARG 39 21.825 8.180 -6.980
290 HG3 ARG 39 2HG ARG 39 22.795 6.775 -7.486
291 HD2 ARG 39 1HD ARG 39 23.228 9.569 -8.483
292 HD3 ARG 39 2HD ARG 39 24.056 8.865 -7.075
293 HE ARG 39 HE ARG 39 24.583 7.230 -9.445
294 HH11 ARG 39 1HH1 ARG 39 25.450 10.292 -8.020
295 HH12 ARG 39 2HH1 ARG 39 27.008 10.230 -8.821
296 HH21 ARG 39 1HH2 ARG 39 26.360 7.148 -10.375
297 HH22 ARG 39 2HH2 ARG 39 27.528 8.438 -10.164
298 H ILE 40 HN ILE 40 18.283 8.157 -9.155
299 HA ILE 40 HA ILE 40 17.342 6.673 -11.565
300 HB ILE 40 HB ILE 40 16.076 8.978 -10.014
301 HG12 ILE 40 1HG1 ILE 40 15.296 6.078 -9.996
302 HG13 ILE 40 2HG1 ILE 40 16.348 6.836 -8.778
303 HG21 ILE 40 1HG2 ILE 40 14.042 8.385 -11.287
304 HG22 ILE 40 2HG2 ILE 40 15.363 8.862 -12.377
305 HG23 ILE 40 3HG2 ILE 40 14.957 7.142 -12.170
306 HD11 ILE 40 3HD1 ILE 40 13.480 7.631 -9.393
307 HD12 ILE 40 1HD1 ILE 40 14.020 6.695 -7.981
308 HD13 ILE 40 2HD1 ILE 40 14.533 8.389 -8.174
309 HA PRO 41 HA PRO 41 19.290 9.434 -14.384
310 HB2 PRO 41 1HB PRO 41 17.039 8.331 -16.114
311 HB3 PRO 41 2HB PRO 41 18.766 8.433 -16.484
312 HG2 PRO 41 1HG PRO 41 17.706 6.071 -15.851
313 HG3 PRO 41 2HG PRO 41 19.294 6.509 -15.207
314 HD2 PRO 41 1HD PRO 41 16.597 6.530 -13.795
315 HD3 PRO 41 2HD PRO 41 18.175 6.043 -13.165
316 H ARG 42 HN ARG 42 19.014 11.460 -14.772
317 HA ARG 42 HA ARG 42 16.725 12.832 -13.716
318 HB2 ARG 42 1HB ARG 42 18.934 13.766 -15.485
319 HB3 ARG 42 2HB ARG 42 17.636 14.806 -14.856
320 HG2 ARG 42 1HG ARG 42 18.333 14.353 -12.570
321 HG3 ARG 42 2HG ARG 42 19.575 13.216 -13.149
322 HD2 ARG 42 1HD ARG 42 20.699 15.066 -14.271
323 HD3 ARG 42 2HD ARG 42 19.484 16.182 -13.604
324 HE ARG 42 HE ARG 42 20.756 14.930 -11.352
325 HH11 ARG 42 1HH1 ARG 42 21.739 16.957 -14.013
326 HH12 ARG 42 2HH1 ARG 42 23.000 17.660 -13.020
327 HH21 ARG 42 1HH2 ARG 42 22.200 15.720 -10.204
328 HH22 ARG 42 2HH2 ARG 42 23.264 16.956 -10.847
329 H SER 43 HN SER 43 17.540 11.717 -16.955
330 HA SER 43 HA SER 43 15.487 13.089 -18.451
331 HB2 SER 43 1HB SER 43 16.837 10.503 -18.931
332 HB3 SER 43 2HB SER 43 15.742 11.352 -20.046
333 HG SER 43 HG SER 43 17.948 11.833 -20.430
334 H GLN 44 HN GLN 44 15.520 10.115 -16.493
335 HA GLN 44 HA GLN 44 12.824 9.322 -17.308
336 HB2 GLN 44 1HB GLN 44 14.648 8.439 -15.062
337 HB3 GLN 44 2HB GLN 44 13.057 7.721 -15.406
338 HG2 GLN 44 1HG GLN 44 15.558 7.432 -17.286
339 HG3 GLN 44 2HG GLN 44 14.637 6.413 -16.156
340 HE21 GLN 44 2HE2 GLN 44 15.068 7.228 -19.354
341 HE22 GLN 44 1HE2 GLN 44 13.546 6.700 -19.990
342 H ILE 45 HN ILE 45 14.267 11.027 -14.566
343 HA ILE 45 HA ILE 45 11.931 11.076 -12.901
344 HB ILE 45 HB ILE 45 14.255 13.031 -13.184
345 HG12 ILE 45 1HG1 ILE 45 13.652 11.027 -11.028
346 HG13 ILE 45 2HG1 ILE 45 14.725 10.726 -12.415
347 HG21 ILE 45 1HG2 ILE 45 13.498 13.975 -11.029
348 HG22 ILE 45 2HG2 ILE 45 12.261 14.187 -12.289
349 HG23 ILE 45 3HG2 ILE 45 12.072 12.912 -11.063
350 HD11 ILE 45 3HD1 ILE 45 15.112 12.873 -10.298
351 HD12 ILE 45 1HD1 ILE 45 16.015 11.345 -10.409
352 HD13 ILE 45 2HD1 ILE 45 16.184 12.574 -11.686
353 H GLN 46 HN GLN 46 12.997 13.339 -15.423
354 HA GLN 46 HA GLN 46 10.743 15.120 -14.860
355 HB2 GLN 46 1HB GLN 46 11.590 16.470 -16.597
356 HB3 GLN 46 2HB GLN 46 12.988 15.856 -15.684
357 HG2 GLN 46 1HG GLN 46 13.327 14.098 -17.714
358 HG3 GLN 46 2HG GLN 46 11.840 14.958 -18.179
359 HE21 GLN 46 2HE2 GLN 46 14.106 14.751 -19.835
360 HE22 GLN 46 1HE2 GLN 46 14.789 16.330 -20.035
361 H ARG 47 HN ARG 47 11.120 12.251 -16.611
362 HA ARG 47 HA ARG 47 8.807 12.951 -18.389
363 HB2 ARG 47 1HB ARG 47 10.920 10.876 -18.770
364 HB3 ARG 47 2HB ARG 47 9.480 11.111 -19.788
365 HG2 ARG 47 1HG ARG 47 11.603 13.227 -19.338
366 HG3 ARG 47 2HG ARG 47 11.605 12.093 -20.710
367 HD2 ARG 47 1HD ARG 47 9.397 12.975 -21.354
368 HD3 ARG 47 2HD ARG 47 9.566 14.196 -20.070
369 HE ARG 47 HE ARG 47 11.813 14.500 -21.869
370 HH11 ARG 47 1HH1 ARG 47 8.347 14.877 -21.945
371 HH12 ARG 47 2HH1 ARG 47 8.506 16.143 -23.147
372 HH21 ARG 47 1HH2 ARG 47 12.011 15.941 -23.252
373 HH22 ARG 47 2HH2 ARG 47 10.595 16.750 -23.894
374 H ALA 48 HN ALA 48 9.426 11.532 -15.519
375 HA ALA 48 HA ALA 48 7.833 9.101 -15.900
376 HB1 ALA 48 3HB ALA 48 8.904 10.415 -13.380
377 HB2 ALA 48 1HB ALA 48 8.149 8.806 -13.473
378 HB3 ALA 48 2HB ALA 48 9.695 9.115 -14.302
379 H ARG 49 HN ARG 49 5.746 8.775 -15.504
380 HA ARG 49 HA ARG 49 3.998 10.995 -14.771
381 HB2 ARG 49 1HB ARG 49 3.516 8.080 -15.146
382 HB3 ARG 49 2HB ARG 49 2.273 9.230 -14.602
383 HG2 ARG 49 1HG ARG 49 2.721 10.554 -16.703
384 HG3 ARG 49 2HG ARG 49 3.744 9.205 -17.251
385 HD2 ARG 49 1HD ARG 49 1.880 7.732 -17.268
386 HD3 ARG 49 2HD ARG 49 0.835 8.982 -16.553
387 HE ARG 49 HE ARG 49 1.798 9.886 -19.164
388 HH11 ARG 49 1HH1 ARG 49 -0.445 7.624 -17.745
389 HH12 ARG 49 2HH1 ARG 49 -1.468 7.739 -19.163
390 HH21 ARG 49 1HH2 ARG 49 0.641 10.022 -20.799
391 HH22 ARG 49 2HH2 ARG 49 -0.849 9.106 -20.906
392 HA PRO 50 HA PRO 50 3.822 10.982 -10.432
393 HB2 PRO 50 1HB PRO 50 0.858 10.291 -10.725
394 HB3 PRO 50 2HB PRO 50 1.601 11.575 -9.761
395 HG2 PRO 50 1HG PRO 50 0.410 12.202 -12.058
396 HG3 PRO 50 2HG PRO 50 1.944 12.978 -11.642
397 HD2 PRO 50 1HD PRO 50 1.420 10.745 -13.632
398 HD3 PRO 50 2HD PRO 50 2.579 12.076 -13.734
399 H VAL 51 HN VAL 51 2.069 8.334 -12.026
400 HA VAL 51 HA VAL 51 2.364 6.490 -9.789
401 HB VAL 51 HB VAL 51 1.943 6.017 -12.770
402 HG11 VAL 51 1HG1 VAL 51 1.315 3.721 -12.103
403 HG12 VAL 51 2HG1 VAL 51 3.008 4.069 -11.681
404 HG13 VAL 51 3HG1 VAL 51 1.752 4.090 -10.419
405 HG21 VAL 51 3HG2 VAL 51 0.104 7.197 -11.725
406 HG22 VAL 51 1HG2 VAL 51 -0.363 5.528 -12.129
407 HG23 VAL 51 2HG2 VAL 51 0.014 5.962 -10.445
408 H LYS 52 HN LYS 52 4.341 7.211 -12.636
409 HA LYS 52 HA LYS 52 6.167 5.002 -12.119
410 HB2 LYS 52 1HB LYS 52 6.382 7.485 -13.828
411 HB3 LYS 52 2HB LYS 52 7.601 6.189 -13.773
412 HG2 LYS 52 1HG LYS 52 5.916 4.579 -14.590
413 HG3 LYS 52 2HG LYS 52 4.714 5.889 -14.670
414 HD2 LYS 52 1HD LYS 52 6.094 7.077 -16.314
415 HD3 LYS 52 2HD LYS 52 7.327 5.797 -16.216
416 HE2 LYS 52 1HE LYS 52 5.659 4.156 -17.016
417 HE3 LYS 52 2HE LYS 52 4.462 5.464 -17.162
418 HZ1 LYS 52 3HZ LYS 52 7.005 5.295 -18.648
419 HZ2 LYS 52 1HZ LYS 52 5.510 4.979 -19.268
420 HZ3 LYS 52 2HZ LYS 52 5.896 6.507 -18.782
421 H MET 53 HN MET 53 5.896 8.283 -11.006
422 HA MET 53 HA MET 53 8.641 8.646 -10.202
423 HB2 MET 53 1HB MET 53 6.036 9.829 -9.256
424 HB3 MET 53 2HB MET 53 7.626 10.319 -8.625
425 HG2 MET 53 1HG MET 53 6.792 10.493 -11.535
426 HG3 MET 53 2HG MET 53 6.709 11.846 -10.382
427 HE1 MET 53 3HE MET 53 9.219 11.826 -8.672
428 HE2 MET 53 1HE MET 53 10.394 12.716 -9.670
429 HE3 MET 53 2HE MET 53 8.698 13.254 -9.600
430 H ALA 54 HN ALA 54 5.763 7.565 -8.383
431 HA ALA 54 HA ALA 54 7.223 6.979 -5.984
432 HB1 ALA 54 3HB ALA 54 4.620 5.805 -7.022
433 HB2 ALA 54 1HB ALA 54 5.234 5.663 -5.359
434 HB3 ALA 54 2HB ALA 54 4.784 7.257 -6.007
435 H THR 55 HN THR 55 6.334 5.000 -8.800
436 HA THR 55 HA THR 55 7.314 2.511 -7.785
437 HB THR 55 HB THR 55 7.169 3.517 -10.659
438 HG1 THR 55 HG1 THR 55 5.212 2.260 -10.621
439 HG21 THR 55 3HG2 THR 55 7.444 0.696 -9.547
440 HG22 THR 55 1HG2 THR 55 7.224 1.121 -11.260
441 HG23 THR 55 2HG2 THR 55 8.711 1.602 -10.408
442 H LEU 56 HN LEU 56 8.939 5.108 -9.581
443 HA LEU 56 HA LEU 56 11.409 3.676 -9.938
444 HB2 LEU 56 1HB LEU 56 10.328 6.305 -10.195
445 HB3 LEU 56 2HB LEU 56 12.077 6.407 -9.888
446 HG LEU 56 HG LEU 56 12.617 5.286 -11.887
447 HD11 LEU 56 1HD1 LEU 56 10.905 4.124 -13.306
448 HD12 LEU 56 2HD1 LEU 56 10.955 3.440 -11.665
449 HD13 LEU 56 3HD1 LEU 56 9.650 4.561 -12.122
450 HD21 LEU 56 3HD2 LEU 56 11.885 7.564 -12.284
451 HD22 LEU 56 1HD2 LEU 56 11.443 6.535 -13.666
452 HD23 LEU 56 2HD2 LEU 56 10.203 7.019 -12.485
453 H LEU 57 HN LEU 57 10.305 5.939 -7.427
454 HA LEU 57 HA LEU 57 12.819 6.010 -6.029
455 HB2 LEU 57 1HB LEU 57 10.006 6.434 -5.283
456 HB3 LEU 57 2HB LEU 57 11.263 6.785 -4.075
457 HG LEU 57 HG LEU 57 10.955 8.147 -6.779
458 HD11 LEU 57 1HD1 LEU 57 10.326 10.160 -5.421
459 HD12 LEU 57 2HD1 LEU 57 9.189 8.818 -5.152
460 HD13 LEU 57 3HD1 LEU 57 10.443 9.179 -3.941
461 HD21 LEU 57 3HD2 LEU 57 13.274 7.993 -6.090
462 HD22 LEU 57 1HD2 LEU 57 12.714 9.678 -5.963
463 HD23 LEU 57 2HD2 LEU 57 12.877 8.681 -4.497
464 H VAL 58 HN VAL 58 9.996 3.896 -5.783
465 HA VAL 58 HA VAL 58 10.994 2.442 -3.447
466 HB VAL 58 HB VAL 58 8.913 1.755 -5.563
467 HG11 VAL 58 1HG1 VAL 58 8.247 -0.071 -4.035
468 HG12 VAL 58 2HG1 VAL 58 9.917 -0.292 -4.610
469 HG13 VAL 58 3HG1 VAL 58 9.614 0.323 -2.967
470 HG21 VAL 58 3HG2 VAL 58 8.291 3.627 -4.155
471 HG22 VAL 58 1HG2 VAL 58 7.308 2.194 -3.773
472 HG23 VAL 58 2HG2 VAL 58 8.642 2.671 -2.696
473 H THR 59 HN THR 59 11.206 1.955 -6.948
474 HA THR 59 HA THR 59 12.421 -0.669 -6.689
475 HB THR 59 HB THR 59 12.410 1.298 -9.016
476 HG1 THR 59 HG1 THR 59 10.336 0.481 -8.390
477 HG21 THR 59 3HG2 THR 59 13.111 -1.662 -8.916
478 HG22 THR 59 1HG2 THR 59 13.007 -0.667 -10.387
479 HG23 THR 59 2HG2 THR 59 14.263 -0.331 -9.171
480 H TYR 60 HN TYR 60 13.707 2.612 -7.146
481 HA TYR 60 HA TYR 60 16.423 1.566 -7.566
482 HB2 TYR 60 1HB TYR 60 15.145 4.283 -7.467
483 HB3 TYR 60 2HB TYR 60 16.915 4.102 -7.396
484 HD1 TYR 60 HD1 TYR 60 13.952 3.124 -9.468
485 HD2 TYR 60 HD2 TYR 60 18.135 3.949 -9.389
486 HE1 TYR 60 HE1 TYR 60 14.026 2.944 -11.938
487 HE2 TYR 60 HE2 TYR 60 18.228 3.773 -11.852
488 HH TYR 60 HH TYR 60 17.054 3.395 -13.768
489 H TYR 61 HN TYR 61 14.572 3.000 -4.940
490 HA TYR 61 HA TYR 61 17.053 2.923 -3.247
491 HB2 TYR 61 1HB TYR 61 14.629 4.718 -3.007
492 HB3 TYR 61 2HB TYR 61 16.048 4.705 -1.930
493 HD1 TYR 61 HD2 TYR 61 18.207 5.593 -2.712
494 HD2 TYR 61 HD1 TYR 61 14.740 5.768 -5.188
495 HE1 TYR 61 HE2 TYR 61 19.343 7.233 -4.169
496 HE2 TYR 61 HE1 TYR 61 15.864 7.412 -6.659
497 HH TYR 61 HH TYR 61 19.217 8.476 -6.079
498 H GLY 62 HN GLY 62 13.486 2.741 -3.041
499 HA2 GLY 62 1HA GLY 62 12.914 0.389 -2.023
500 HA3 GLY 62 2HA GLY 62 13.805 1.036 -0.625
501 H GLU 63 HN GLU 63 11.253 0.269 -0.215
502 HA GLU 63 HA GLU 63 9.260 2.289 -0.726
503 HB2 GLU 63 1HB GLU 63 9.465 0.086 1.329
504 HB3 GLU 63 2HB GLU 63 8.041 1.136 1.136
505 HG2 GLU 63 1HG GLU 63 7.692 0.236 -1.185
506 HG3 GLU 63 2HG GLU 63 9.232 -0.624 -0.964
507 H GLU 64 HN GLU 64 11.288 1.604 2.123
508 HA GLU 64 HA GLU 64 10.157 3.765 3.688
509 HB2 GLU 64 1HB GLU 64 12.731 2.199 3.896
510 HB3 GLU 64 2HB GLU 64 12.214 3.430 5.075
511 HG2 GLU 64 1HG GLU 64 10.182 2.023 5.618
512 HG3 GLU 64 2HG GLU 64 10.749 0.933 4.331
513 H TYR 65 HN TYR 65 12.726 3.553 1.328
514 HA TYR 65 HA TYR 65 13.789 6.212 2.072
515 HB2 TYR 65 1HB TYR 65 14.469 4.341 -0.206
516 HB3 TYR 65 2HB TYR 65 15.333 5.840 0.215
517 HD1 TYR 65 HD2 TYR 65 16.638 5.955 2.334
518 HD2 TYR 65 HD1 TYR 65 14.872 2.310 1.004
519 HE1 TYR 65 HE2 TYR 65 18.084 4.698 3.895
520 HE2 TYR 65 HE1 TYR 65 16.314 1.033 2.563
521 HH TYR 65 HH TYR 65 18.671 2.649 4.697
522 H ALA 66 HN ALA 66 11.601 4.794 -0.249
523 HA ALA 66 HA ALA 66 11.457 7.049 -2.018
524 HB1 ALA 66 3HB ALA 66 9.343 4.985 -1.309
525 HB2 ALA 66 1HB ALA 66 9.286 6.100 -2.694
526 HB3 ALA 66 2HB ALA 66 10.548 4.848 -2.612
527 H VAL 67 HN VAL 67 9.786 6.247 1.004
528 HA VAL 67 HA VAL 67 8.040 8.570 1.010
529 HB VAL 67 HB VAL 67 9.144 6.849 3.269
530 HG11 VAL 67 1HG1 VAL 67 7.388 7.900 4.657
531 HG12 VAL 67 2HG1 VAL 67 8.553 9.112 4.073
532 HG13 VAL 67 3HG1 VAL 67 6.955 8.969 3.301
533 HG21 VAL 67 3HG2 VAL 67 7.701 5.636 1.746
534 HG22 VAL 67 1HG2 VAL 67 6.897 5.892 3.313
535 HG23 VAL 67 2HG2 VAL 67 6.445 6.888 1.908
536 H GLN 68 HN GLN 68 11.282 7.998 2.342
537 HA GLN 68 HA GLN 68 11.459 10.585 3.596
538 HB2 GLN 68 1HB GLN 68 13.543 8.625 2.620
539 HB3 GLN 68 2HB GLN 68 13.931 10.128 3.492
540 HG2 GLN 68 1HG GLN 68 12.559 9.101 5.572
541 HG3 GLN 68 2HG GLN 68 12.292 7.886 4.298
542 HE21 GLN 68 2HE2 GLN 68 13.336 7.319 6.870
543 HE22 GLN 68 1HE2 GLN 68 14.969 6.773 6.682
544 H LEU 69 HN LEU 69 12.457 9.386 0.406
545 HA LEU 69 HA LEU 69 13.709 11.866 -0.392
546 HB2 LEU 69 1HB LEU 69 12.564 9.535 -1.761
547 HB3 LEU 69 2HB LEU 69 13.305 10.800 -2.766
548 HG LEU 69 HG LEU 69 14.733 9.190 -0.616
549 HD11 LEU 69 1HD1 LEU 69 15.923 8.105 -2.539
550 HD12 LEU 69 2HD1 LEU 69 14.170 7.806 -2.611
551 HD13 LEU 69 3HD1 LEU 69 14.907 9.032 -3.669
552 HD21 LEU 69 3HD2 LEU 69 15.644 11.421 -0.879
553 HD22 LEU 69 1HD2 LEU 69 16.783 10.220 -1.533
554 HD23 LEU 69 2HD2 LEU 69 15.780 11.190 -2.638
555 H THR 70 HN THR 70 10.483 10.484 -1.026
556 HA THR 70 HA THR 70 9.520 12.699 -2.565
557 HB THR 70 HB THR 70 8.010 10.729 -0.797
558 HG1 THR 70 HG1 THR 70 8.458 10.813 -3.623
559 HG21 THR 70 3HG2 THR 70 7.004 12.625 -2.958
560 HG22 THR 70 1HG2 THR 70 6.028 11.403 -2.109
561 HG23 THR 70 2HG2 THR 70 6.702 12.785 -1.211
562 H LEU 71 HN LEU 71 9.291 12.016 0.926
563 HA LEU 71 HA LEU 71 7.822 14.346 1.631
564 HB2 LEU 71 1HB LEU 71 8.365 12.377 2.925
565 HB3 LEU 71 2HB LEU 71 9.985 12.991 3.328
566 HG LEU 71 HG LEU 71 7.467 14.571 3.907
567 HD11 LEU 71 1HD1 LEU 71 7.598 13.696 6.255
568 HD12 LEU 71 2HD1 LEU 71 7.296 12.384 5.093
569 HD13 LEU 71 3HD1 LEU 71 8.928 12.621 5.764
570 HD21 LEU 71 3HD2 LEU 71 9.551 15.810 3.900
571 HD22 LEU 71 1HD2 LEU 71 8.920 15.695 5.560
572 HD23 LEU 71 2HD2 LEU 71 10.274 14.659 5.048
573 H GLN 72 HN GLN 72 11.338 13.867 1.353
574 HA GLN 72 HA GLN 72 12.071 16.489 2.220
575 HB2 GLN 72 1HB GLN 72 13.605 14.558 1.967
576 HB3 GLN 72 2HB GLN 72 13.443 14.702 0.201
577 HG2 GLN 72 1HG GLN 72 15.599 16.017 0.761
578 HG3 GLN 72 2HG GLN 72 14.112 16.925 0.401
579 HE21 GLN 72 2HE2 GLN 72 14.875 18.775 1.467
580 HE22 GLN 72 1HE2 GLN 72 14.972 18.864 3.195
581 H VAL 73 HN VAL 73 11.250 15.234 -0.995
582 HA VAL 73 HA VAL 73 11.804 17.766 -2.357
583 HB VAL 73 HB VAL 73 10.156 15.336 -3.176
584 HG11 VAL 73 1HG1 VAL 73 10.285 16.290 -5.454
585 HG12 VAL 73 2HG1 VAL 73 9.426 17.386 -4.348
586 HG13 VAL 73 3HG1 VAL 73 11.113 17.726 -4.806
587 HG21 VAL 73 3HG2 VAL 73 12.504 14.821 -2.882
588 HG22 VAL 73 1HG2 VAL 73 12.064 14.806 -4.605
589 HG23 VAL 73 2HG2 VAL 73 12.956 16.189 -3.927
590 H LEU 74 HN LEU 74 8.925 16.282 -0.943
591 HA LEU 74 HA LEU 74 7.051 18.227 -1.857
592 HB2 LEU 74 1HB LEU 74 7.329 16.551 0.536
593 HB3 LEU 74 2HB LEU 74 5.854 17.536 0.394
594 HG LEU 74 HG LEU 74 6.752 15.374 -1.550
595 HD11 LEU 74 1HD1 LEU 74 4.763 14.113 -0.685
596 HD12 LEU 74 2HD1 LEU 74 5.931 14.449 0.614
597 HD13 LEU 74 3HD1 LEU 74 4.452 15.429 0.471
598 HD21 LEU 74 3HD2 LEU 74 5.552 17.163 -2.662
599 HD22 LEU 74 1HD2 LEU 74 4.538 15.702 -2.596
600 HD23 LEU 74 2HD2 LEU 74 4.229 17.051 -1.477
601 H ARG 75 HN ARG 75 9.223 18.237 0.948
602 HA ARG 75 HA ARG 75 8.376 20.875 1.839
603 HB2 ARG 75 1HB ARG 75 10.785 19.226 2.432
604 HB3 ARG 75 2HB ARG 75 10.516 20.865 3.072
605 HG2 ARG 75 1HG ARG 75 8.458 20.110 4.167
606 HG3 ARG 75 2HG ARG 75 8.699 18.473 3.509
607 HD2 ARG 75 1HD ARG 75 10.692 18.213 4.810
608 HD3 ARG 75 2HD ARG 75 10.543 19.879 5.415
609 HE ARG 75 HE ARG 75 8.189 18.471 6.291
610 HH11 ARG 75 1HH1 ARG 75 11.633 18.238 6.788
611 HH12 ARG 75 2HH1 ARG 75 11.363 17.595 8.395
612 HH21 ARG 75 1HH2 ARG 75 7.864 17.728 8.126
613 HH22 ARG 75 2HH2 ARG 75 9.214 17.302 9.160
614 H ALA 76 HN ALA 76 10.769 19.652 -0.433
615 HA ALA 76 HA ALA 76 12.234 22.107 -0.688
616 HB1 ALA 76 3HB ALA 76 11.879 19.831 -2.668
617 HB2 ALA 76 1HB ALA 76 13.108 21.114 -2.767
618 HB3 ALA 76 2HB ALA 76 13.143 19.949 -1.422
619 H ILE 77 HN ILE 77 9.259 20.936 -2.116
620 HA ILE 77 HA ILE 77 9.212 23.197 -4.062
621 HB ILE 77 HB ILE 77 7.172 22.132 -4.923
622 HG12 ILE 77 1HG1 ILE 77 7.525 20.077 -2.757
623 HG13 ILE 77 2HG1 ILE 77 6.360 21.421 -2.711
624 HG21 ILE 77 1HG2 ILE 77 8.115 19.972 -5.671
625 HG22 ILE 77 2HG2 ILE 77 9.338 21.262 -5.738
626 HG23 ILE 77 3HG2 ILE 77 9.365 20.081 -4.409
627 HD11 ILE 77 3HD1 ILE 77 6.424 19.192 -4.776
628 HD12 ILE 77 1HD1 ILE 77 5.275 19.327 -3.425
629 HD13 ILE 77 2HD1 ILE 77 5.259 20.536 -4.730
630 H ASN 78 HN ASN 78 8.625 22.942 -0.899
631 HA ASN 78 HA ASN 78 7.488 24.377 0.543
632 HB2 ASN 78 1HB ASN 78 6.530 25.996 -1.935
633 HB3 ASN 78 2HB ASN 78 6.358 26.102 -0.166
634 HD21 ASN 78 2HD2 ASN 78 7.696 27.772 -2.316
635 HD22 ASN 78 1HD2 ASN 78 9.287 28.060 -1.694
636 H GLN 79 HN GLN 79 6.421 21.916 -0.048
637 HA GLN 79 HA GLN 79 3.561 22.611 0.497
638 HB2 GLN 79 1HB GLN 79 4.627 20.229 -1.036
639 HB3 GLN 79 2HB GLN 79 2.944 20.432 -0.495
640 HG2 GLN 79 1HG GLN 79 4.267 22.253 -2.696
641 HG3 GLN 79 2HG GLN 79 3.218 20.815 -2.683
642 HE21 GLN 79 2HE2 GLN 79 3.140 24.002 -3.180
643 HE22 GLN 79 1HE2 GLN 79 1.566 24.396 -2.573
644 H ARG 80 HN ARG 80 4.539 22.711 2.679
645 HA ARG 80 HA ARG 80 5.641 20.339 3.892
646 HB2 ARG 80 1HB ARG 80 4.473 22.814 5.073
647 HB3 ARG 80 2HB ARG 80 5.146 21.468 6.022
648 HG2 ARG 80 1HG ARG 80 7.328 21.789 4.991
649 HG3 ARG 80 2HG ARG 80 6.671 23.078 3.953
650 HD2 ARG 80 1HD ARG 80 6.236 24.427 5.914
651 HD3 ARG 80 2HD ARG 80 6.902 23.140 6.945
652 HE ARG 80 HE ARG 80 9.009 23.957 5.155
653 HH11 ARG 80 1HH1 ARG 80 7.108 25.387 7.703
654 HH12 ARG 80 2HH1 ARG 80 8.445 26.439 8.121
655 HH21 ARG 80 1HH2 ARG 80 10.548 25.161 5.615
656 HH22 ARG 80 2HH2 ARG 80 10.408 26.311 6.929
657 H LEU 81 HN LEU 81 2.366 21.512 3.458
658 HA LEU 81 HA LEU 81 1.019 19.845 5.312
659 HB2 LEU 81 1HB LEU 81 -0.008 21.538 4.179
660 HB3 LEU 81 2HB LEU 81 0.179 20.860 2.545
661 HG LEU 81 HG LEU 81 -1.256 18.920 3.285
662 HD11 LEU 81 1HD1 LEU 81 -2.688 19.284 5.312
663 HD12 LEU 81 2HD1 LEU 81 -0.963 19.226 5.742
664 HD13 LEU 81 3HD1 LEU 81 -1.806 20.791 5.646
665 HD21 LEU 81 3HD2 LEU 81 -2.157 20.707 1.917
666 HD22 LEU 81 1HD2 LEU 81 -3.385 20.153 3.079
667 HD23 LEU 81 2HD2 LEU 81 -2.511 21.677 3.367
668 H LEU 82 HN LEU 82 1.832 19.142 1.904
669 HA LEU 82 HA LEU 82 0.823 16.446 2.013
670 HB2 LEU 82 1HB LEU 82 2.786 17.870 0.348
671 HB3 LEU 82 2HB LEU 82 2.337 16.208 -0.101
672 HG LEU 82 HG LEU 82 0.488 18.624 0.003
673 HD11 LEU 82 1HD1 LEU 82 0.333 18.275 -2.477
674 HD12 LEU 82 2HD1 LEU 82 2.008 18.601 -1.973
675 HD13 LEU 82 3HD1 LEU 82 1.498 16.937 -2.346
676 HD21 LEU 82 3HD2 LEU 82 -0.668 16.607 0.693
677 HD22 LEU 82 1HD2 LEU 82 -1.228 17.106 -0.920
678 HD23 LEU 82 2HD2 LEU 82 -0.091 15.745 -0.753
679 H ALA 83 HN ALA 83 3.966 17.871 2.722
680 HA ALA 83 HA ALA 83 5.400 15.399 2.922
681 HB1 ALA 83 3HB ALA 83 5.865 18.041 4.348
682 HB2 ALA 83 1HB ALA 83 7.030 16.702 4.233
683 HB3 ALA 83 2HB ALA 83 6.529 17.572 2.765
684 H GLU 84 HN GLU 84 3.460 17.238 5.245
685 HA GLU 84 HA GLU 84 4.114 15.445 7.466
686 HB2 GLU 84 1HB GLU 84 1.992 17.559 7.080
687 HB3 GLU 84 2HB GLU 84 2.248 16.648 8.588
688 HG2 GLU 84 1HG GLU 84 4.206 18.653 7.320
689 HG3 GLU 84 2HG GLU 84 3.224 18.759 8.799
690 H GLU 85 HN GLU 85 1.549 15.710 5.066
691 HA GLU 85 HA GLU 85 -0.120 13.652 6.260
692 HB2 GLU 85 1HB GLU 85 0.092 14.829 3.491
693 HB3 GLU 85 2HB GLU 85 -1.067 13.547 3.922
694 HG2 GLU 85 1HG GLU 85 -1.020 16.396 5.088
695 HG3 GLU 85 2HG GLU 85 -2.133 15.646 3.922
696 H LEU 86 HN LEU 86 2.554 13.655 3.956
697 HA LEU 86 HA LEU 86 2.387 10.815 3.391
698 HB2 LEU 86 1HB LEU 86 3.439 12.303 1.989
699 HB3 LEU 86 2HB LEU 86 4.691 12.824 3.141
700 HG LEU 86 HG LEU 86 5.553 10.476 3.180
701 HD11 LEU 86 1HD1 LEU 86 4.822 8.937 1.338
702 HD12 LEU 86 2HD1 LEU 86 3.466 9.346 2.414
703 HD13 LEU 86 3HD1 LEU 86 3.617 10.142 0.830
704 HD21 LEU 86 3HD2 LEU 86 6.622 12.158 1.800
705 HD22 LEU 86 1HD2 LEU 86 6.663 10.581 0.975
706 HD23 LEU 86 2HD2 LEU 86 5.493 11.823 0.465
707 H HIS 87 HN HIS 87 4.235 12.749 5.742
708 HA HIS 87 HA HIS 87 5.483 10.589 7.104
709 HB2 HIS 87 1HB HIS 87 6.021 12.926 7.640
710 HB3 HIS 87 2HB HIS 87 4.361 13.198 8.221
711 HD1 HIS 87 HD1 HIS 87 7.456 11.159 9.073
712 HD2 HIS 87 HD2 HIS 87 4.036 12.713 10.984
713 HE1 HIS 87 HE1 HIS 87 7.716 10.638 11.446
714 H ARG 88 HN ARG 88 2.232 11.978 7.539
715 HA ARG 88 HA ARG 88 1.457 10.148 9.629
716 HB2 ARG 88 1HB ARG 88 -0.128 11.800 7.725
717 HB3 ARG 88 2HB ARG 88 -0.851 10.722 8.942
718 HG2 ARG 88 1HG ARG 88 0.083 11.987 10.740
719 HG3 ARG 88 2HG ARG 88 1.100 12.934 9.627
720 HD2 ARG 88 1HD ARG 88 -0.811 14.034 8.740
721 HD3 ARG 88 2HD ARG 88 -1.899 13.002 9.699
722 HE ARG 88 HE ARG 88 -0.404 14.419 11.642
723 HH11 ARG 88 1HH1 ARG 88 -2.311 15.405 8.894
724 HH12 ARG 88 2HH1 ARG 88 -2.737 16.893 9.716
725 HH21 ARG 88 1HH2 ARG 88 -0.878 16.122 12.593
726 HH22 ARG 88 2HH2 ARG 88 -1.920 17.303 11.826
727 H ALA 89 HN ALA 89 1.308 9.984 6.100
728 HA ALA 89 HA ALA 89 -0.154 7.518 5.984
729 HB1 ALA 89 3HB ALA 89 1.877 8.677 4.045
730 HB2 ALA 89 1HB ALA 89 0.750 7.346 3.698
731 HB3 ALA 89 2HB ALA 89 0.123 8.978 4.031
732 H ALA 90 HN ALA 90 3.303 8.259 6.255
733 HA ALA 90 HA ALA 90 4.199 5.543 6.043
734 HB1 ALA 90 3HB ALA 90 5.458 7.908 7.475
735 HB2 ALA 90 1HB ALA 90 6.275 6.378 7.076
736 HB3 ALA 90 2HB ALA 90 5.715 7.454 5.773
737 H ILE 91 HN ILE 91 3.064 7.499 8.757
738 HA ILE 91 HA ILE 91 3.589 5.529 10.813
739 HB ILE 91 HB ILE 91 1.512 7.752 10.588
740 HG12 ILE 91 1HG1 ILE 91 3.978 7.580 12.295
741 HG13 ILE 91 2HG1 ILE 91 3.920 8.351 10.693
742 HG21 ILE 91 1HG2 ILE 91 1.135 7.405 13.006
743 HG22 ILE 91 2HG2 ILE 91 0.698 5.953 12.076
744 HG23 ILE 91 3HG2 ILE 91 2.231 6.003 12.976
745 HD11 ILE 91 3HD1 ILE 91 2.280 9.164 13.118
746 HD12 ILE 91 1HD1 ILE 91 3.708 10.020 12.492
747 HD13 ILE 91 2HD1 ILE 91 2.222 9.936 11.516
748 H GLN 92 HN GLN 92 0.810 6.065 8.681
749 HA GLN 92 HA GLN 92 -0.762 3.926 9.800
750 HB2 GLN 92 1HB GLN 92 -0.711 5.225 7.071
751 HB3 GLN 92 2HB GLN 92 -1.897 3.993 7.560
752 HG2 GLN 92 1HG GLN 92 -2.739 5.745 9.420
753 HG3 GLN 92 2HG GLN 92 -1.322 6.572 8.732
754 HE21 GLN 92 2HE2 GLN 92 -3.890 7.725 8.911
755 HE22 GLN 92 1HE2 GLN 92 -4.495 7.967 7.305
756 H LEU 93 HN LEU 93 1.675 4.044 7.238
757 HA LEU 93 HA LEU 93 1.355 1.320 6.379
758 HB2 LEU 93 1HB LEU 93 3.571 3.248 6.444
759 HB3 LEU 93 2HB LEU 93 3.849 1.683 5.647
760 HG LEU 93 HG LEU 93 1.765 3.747 4.835
761 HD11 LEU 93 1HD1 LEU 93 3.215 4.064 2.813
762 HD12 LEU 93 2HD1 LEU 93 4.091 4.473 4.306
763 HD13 LEU 93 3HD1 LEU 93 4.392 2.918 3.495
764 HD21 LEU 93 3HD2 LEU 93 1.047 1.477 4.376
765 HD22 LEU 93 1HD2 LEU 93 1.440 2.310 2.853
766 HD23 LEU 93 2HD2 LEU 93 2.581 1.130 3.543
Start of MODEL 6
1 H THR 4 1H THR 4 0.242 -0.596 -0.472
2 HA THR 4 HA THR 4 2.926 -0.347 0.479
3 HB THR 4 HB THR 4 3.632 -0.688 -1.811
4 HG1 THR 4 HG1 THR 4 0.932 -0.033 -2.490
5 HG21 THR 4 3HG2 THR 4 1.033 -2.188 -1.296
6 HG22 THR 4 1HG2 THR 4 2.313 -2.682 -2.429
7 HG23 THR 4 2HG2 THR 4 2.637 -2.646 -0.679
8 HA PRO 5 HA PRO 5 3.942 3.878 0.066
9 HB2 PRO 5 1HB PRO 5 6.558 3.704 -0.861
10 HB3 PRO 5 2HB PRO 5 6.142 3.329 0.817
11 HG2 PRO 5 1HG PRO 5 6.539 1.430 -1.519
12 HG3 PRO 5 2HG PRO 5 7.155 1.301 0.133
13 HD2 PRO 5 1HD PRO 5 4.957 -0.105 -0.620
14 HD3 PRO 5 2HD PRO 5 5.050 0.587 1.004
15 H SER 6 HN SER 6 4.053 1.736 -2.645
16 HA SER 6 HA SER 6 4.516 3.763 -4.718
17 HB2 SER 6 1HB SER 6 4.058 2.167 -6.238
18 HB3 SER 6 2HB SER 6 5.013 1.414 -4.940
19 HG SER 6 HG SER 6 2.855 0.757 -4.107
20 H ASP 7 HN ASP 7 1.803 2.733 -2.769
21 HA ASP 7 HA ASP 7 -0.127 4.101 -4.581
22 HB2 ASP 7 1HB ASP 7 -0.649 2.562 -1.965
23 HB3 ASP 7 2HB ASP 7 -1.759 3.398 -3.080
24 H HIS 8 HN HIS 8 1.434 4.441 -1.441
25 HA HIS 8 HA HIS 8 -0.125 6.753 -0.637
26 HB2 HIS 8 1HB HIS 8 2.569 5.653 0.272
27 HB3 HIS 8 2HB HIS 8 1.793 7.082 0.998
28 HD1 HIS 8 HD1 HIS 8 2.328 4.747 2.784
29 HD2 HIS 8 HD2 HIS 8 -1.276 5.067 0.710
30 HE1 HIS 8 HE1 HIS 8 0.777 3.391 4.030
31 H LEU 9 HN LEU 9 2.994 6.327 -2.281
32 HA LEU 9 HA LEU 9 3.493 9.171 -2.541
33 HB2 LEU 9 1HB LEU 9 4.359 6.755 -3.981
34 HB3 LEU 9 2HB LEU 9 5.096 8.317 -4.409
35 HG LEU 9 HG LEU 9 5.259 6.929 -1.704
36 HD11 LEU 9 1HD1 LEU 9 7.694 6.696 -2.259
37 HD12 LEU 9 2HD1 LEU 9 6.676 5.857 -3.453
38 HD13 LEU 9 3HD1 LEU 9 7.388 7.440 -3.846
39 HD21 LEU 9 3HD2 LEU 9 5.203 9.342 -1.470
40 HD22 LEU 9 1HD2 LEU 9 6.835 8.734 -1.105
41 HD23 LEU 9 2HD2 LEU 9 6.506 9.518 -2.670
42 H LEU 10 HN LEU 10 1.815 6.773 -4.519
43 HA LEU 10 HA LEU 10 1.336 8.402 -6.802
44 HB2 LEU 10 1HB LEU 10 0.944 6.065 -6.515
45 HB3 LEU 10 2HB LEU 10 -0.547 6.313 -5.577
46 HG LEU 10 HG LEU 10 -0.035 7.170 -8.452
47 HD11 LEU 10 1HD1 LEU 10 -1.865 5.533 -8.973
48 HD12 LEU 10 2HD1 LEU 10 -0.491 4.733 -8.174
49 HD13 LEU 10 3HD1 LEU 10 -1.961 5.115 -7.246
50 HD21 LEU 10 3HD2 LEU 10 -1.385 8.816 -7.292
51 HD22 LEU 10 1HD2 LEU 10 -2.390 7.917 -8.454
52 HD23 LEU 10 2HD2 LEU 10 -2.490 7.547 -6.714
53 H SER 11 HN SER 11 -0.701 7.982 -3.894
54 HA SER 11 HA SER 11 -2.783 9.818 -4.659
55 HB2 SER 11 1HB SER 11 -1.897 8.892 -1.995
56 HB3 SER 11 2HB SER 11 -3.342 9.866 -2.349
57 HG SER 11 HG SER 11 -3.781 7.620 -2.274
58 H THR 12 HN THR 12 0.260 10.232 -2.822
59 HA THR 12 HA THR 12 -0.190 12.974 -2.085
60 HB THR 12 HB THR 12 2.427 11.467 -2.497
61 HG1 THR 12 HG1 THR 12 1.037 10.604 -0.856
62 HG21 THR 12 3HG2 THR 12 1.825 14.058 -1.015
63 HG22 THR 12 1HG2 THR 12 3.395 13.221 -1.052
64 HG23 THR 12 2HG2 THR 12 2.723 13.919 -2.544
65 H LEU 13 HN LEU 13 1.487 11.509 -4.861
66 HA LEU 13 HA LEU 13 2.167 14.115 -5.989
67 HB2 LEU 13 1HB LEU 13 2.086 11.354 -7.012
68 HB3 LEU 13 2HB LEU 13 2.762 12.643 -8.035
69 HG LEU 13 HG LEU 13 3.854 11.717 -5.349
70 HD11 LEU 13 1HD1 LEU 13 5.799 10.904 -6.709
71 HD12 LEU 13 2HD1 LEU 13 4.287 10.104 -7.199
72 HD13 LEU 13 3HD1 LEU 13 4.960 11.421 -8.191
73 HD21 LEU 13 3HD2 LEU 13 4.190 14.095 -5.682
74 HD22 LEU 13 1HD2 LEU 13 5.742 13.238 -5.828
75 HD23 LEU 13 2HD2 LEU 13 4.895 13.801 -7.290
76 H GLU 14 HN GLU 14 -0.551 11.955 -6.163
77 HA GLU 14 HA GLU 14 -1.757 13.137 -8.518
78 HB2 GLU 14 1HB GLU 14 -2.386 10.944 -7.615
79 HB3 GLU 14 2HB GLU 14 -3.012 11.739 -6.150
80 HG2 GLU 14 1HG GLU 14 -4.745 12.924 -7.603
81 HG3 GLU 14 2HG GLU 14 -3.983 12.063 -8.959
82 H GLU 15 HN GLU 15 -2.028 13.791 -5.034
83 HA GLU 15 HA GLU 15 -3.919 15.991 -5.493
84 HB2 GLU 15 1HB GLU 15 -2.371 15.071 -3.066
85 HB3 GLU 15 2HB GLU 15 -3.532 16.421 -3.074
86 HG2 GLU 15 1HG GLU 15 -5.357 14.752 -3.749
87 HG3 GLU 15 2HG GLU 15 -4.059 13.539 -3.671
88 H LEU 16 HN LEU 16 -0.493 15.593 -5.438
89 HA LEU 16 HA LEU 16 0.262 18.294 -4.845
90 HB2 LEU 16 1HB LEU 16 1.746 16.554 -4.837
91 HB3 LEU 16 2HB LEU 16 1.603 16.137 -6.560
92 HG LEU 16 HG LEU 16 2.514 18.401 -7.122
93 HD11 LEU 16 1HD1 LEU 16 3.688 19.663 -5.299
94 HD12 LEU 16 2HD1 LEU 16 1.944 19.526 -4.971
95 HD13 LEU 16 3HD1 LEU 16 3.096 18.474 -4.115
96 HD21 LEU 16 3HD2 LEU 16 3.951 16.448 -7.149
97 HD22 LEU 16 1HD2 LEU 16 4.860 17.862 -6.566
98 HD23 LEU 16 2HD2 LEU 16 4.287 16.634 -5.411
99 H VAL 17 HN VAL 17 0.104 20.122 -5.869
100 HA VAL 17 HA VAL 17 -1.445 20.446 -8.254
101 HB VAL 17 HB VAL 17 0.681 22.273 -7.059
102 HG11 VAL 17 1HG1 VAL 17 -0.451 24.050 -8.352
103 HG12 VAL 17 2HG1 VAL 17 0.206 22.793 -9.428
104 HG13 VAL 17 3HG1 VAL 17 -1.537 22.835 -9.069
105 HG21 VAL 17 3HG2 VAL 17 -1.103 21.796 -5.490
106 HG22 VAL 17 1HG2 VAL 17 -1.207 23.473 -6.076
107 HG23 VAL 17 2HG2 VAL 17 -2.320 22.238 -6.711
108 HA PRO 18 HA PRO 18 1.055 18.848 -11.394
109 HB2 PRO 18 1HB PRO 18 -0.421 20.992 -13.003
110 HB3 PRO 18 2HB PRO 18 -0.184 19.284 -13.401
111 HG2 PRO 18 1HG PRO 18 -2.552 20.086 -12.483
112 HG3 PRO 18 2HG PRO 18 -1.874 18.558 -11.905
113 HD2 PRO 18 1HD PRO 18 -2.030 21.231 -10.476
114 HD3 PRO 18 2HD PRO 18 -2.164 19.601 -9.805
115 H TYR 19 HN TYR 19 0.695 22.368 -11.068
116 HA TYR 19 HA TYR 19 3.118 22.999 -12.495
117 HB2 TYR 19 1HB TYR 19 1.540 24.456 -10.372
118 HB3 TYR 19 2HB TYR 19 2.976 25.135 -11.177
119 HD1 TYR 19 HD2 TYR 19 2.904 25.419 -13.710
120 HD2 TYR 19 HD1 TYR 19 -0.585 24.604 -11.397
121 HE1 TYR 19 HE2 TYR 19 1.494 26.223 -15.574
122 HE2 TYR 19 HE1 TYR 19 -2.013 25.406 -13.255
123 HH TYR 19 HH TYR 19 -0.626 26.599 -16.317
124 H ASP 20 HN ASP 20 2.453 22.123 -9.149
125 HA ASP 20 HA ASP 20 5.268 22.623 -8.380
126 HB2 ASP 20 1HB ASP 20 2.868 21.542 -6.786
127 HB3 ASP 20 2HB ASP 20 4.580 21.642 -6.306
128 H PHE 21 HN PHE 21 3.339 20.048 -9.607
129 HA PHE 21 HA PHE 21 5.097 17.886 -8.791
130 HB2 PHE 21 1HB PHE 21 2.793 17.455 -9.579
131 HB3 PHE 21 2HB PHE 21 3.211 18.112 -11.178
132 HD1 PHE 21 HD1 PHE 21 3.943 15.383 -8.782
133 HD2 PHE 21 HD2 PHE 21 4.194 16.785 -12.811
134 HE1 PHE 21 HE1 PHE 21 4.643 13.130 -9.521
135 HE2 PHE 21 HE2 PHE 21 4.891 14.532 -13.553
136 HZ PHE 21 HZ PHE 21 5.117 12.706 -11.908
137 H GLU 22 HN GLU 22 4.931 19.970 -11.678
138 HA GLU 22 HA GLU 22 7.276 18.954 -12.960
139 HB2 GLU 22 1HB GLU 22 6.057 21.713 -12.848
140 HB3 GLU 22 2HB GLU 22 7.456 21.290 -13.864
141 HG2 GLU 22 1HG GLU 22 6.015 19.639 -15.124
142 HG3 GLU 22 2HG GLU 22 4.734 20.056 -13.962
143 H LYS 23 HN LYS 23 6.921 21.558 -10.542
144 HA LYS 23 HA LYS 23 9.719 22.045 -10.201
145 HB2 LYS 23 1HB LYS 23 7.395 22.252 -8.284
146 HB3 LYS 23 2HB LYS 23 9.044 22.817 -7.926
147 HG2 LYS 23 1HG LYS 23 8.915 24.414 -9.784
148 HG3 LYS 23 2HG LYS 23 7.282 23.833 -10.182
149 HD2 LYS 23 1HD LYS 23 6.526 24.526 -7.911
150 HD3 LYS 23 2HD LYS 23 8.146 25.199 -7.611
151 HE2 LYS 23 1HE LYS 23 7.878 26.748 -9.477
152 HE3 LYS 23 2HE LYS 23 6.288 26.044 -9.856
153 HZ1 LYS 23 3HZ LYS 23 6.989 27.454 -7.360
154 HZ2 LYS 23 1HZ LYS 23 6.084 28.075 -8.591
155 HZ3 LYS 23 2HZ LYS 23 5.514 26.801 -7.711
156 H PHE 24 HN PHE 24 7.580 19.593 -8.826
157 HA PHE 24 HA PHE 24 9.369 18.600 -6.834
158 HB2 PHE 24 1HB PHE 24 6.941 17.978 -7.037
159 HB3 PHE 24 2HB PHE 24 7.350 17.005 -8.468
160 HD1 PHE 24 HD1 PHE 24 7.754 17.327 -4.823
161 HD2 PHE 24 HD2 PHE 24 8.358 14.883 -8.275
162 HE1 PHE 24 HE1 PHE 24 8.243 15.391 -3.365
163 HE2 PHE 24 HE2 PHE 24 8.846 12.945 -6.820
164 HZ PHE 24 HZ PHE 24 8.789 13.200 -4.364
165 H LYS 25 HN LYS 25 8.911 17.550 -10.219
166 HA LYS 25 HA LYS 25 11.079 15.602 -10.014
167 HB2 LYS 25 1HB LYS 25 10.668 15.143 -12.279
168 HB3 LYS 25 2HB LYS 25 9.086 15.407 -11.511
169 HG2 LYS 25 1HG LYS 25 9.026 17.694 -12.440
170 HG3 LYS 25 2HG LYS 25 10.596 17.407 -13.226
171 HD2 LYS 25 1HD LYS 25 9.512 15.438 -14.406
172 HD3 LYS 25 2HD LYS 25 7.953 16.028 -13.782
173 HE2 LYS 25 1HE LYS 25 8.270 18.158 -14.926
174 HE3 LYS 25 2HE LYS 25 9.871 17.636 -15.497
175 HZ1 LYS 25 3HZ LYS 25 7.300 16.382 -16.220
176 HZ2 LYS 25 1HZ LYS 25 8.192 17.371 -17.193
177 HZ3 LYS 25 2HZ LYS 25 8.785 15.897 -16.750
178 H PHE 26 HN PHE 26 10.850 18.975 -10.763
179 HA PHE 26 HA PHE 26 13.484 19.157 -12.009
180 HB2 PHE 26 1HB PHE 26 11.669 21.218 -10.689
181 HB3 PHE 26 2HB PHE 26 13.222 21.609 -11.462
182 HD1 PHE 26 HD1 PHE 26 12.410 19.176 -13.527
183 HD2 PHE 26 HD2 PHE 26 10.825 22.952 -12.307
184 HE1 PHE 26 HE1 PHE 26 11.270 19.401 -15.710
185 HE2 PHE 26 HE2 PHE 26 9.682 23.179 -14.487
186 HZ PHE 26 HZ PHE 26 9.906 21.403 -16.190
187 H LYS 27 HN LYS 27 12.298 18.909 -8.760
188 HA LYS 27 HA LYS 27 14.906 19.787 -7.638
189 HB2 LYS 27 1HB LYS 27 12.281 18.925 -6.428
190 HB3 LYS 27 2HB LYS 27 13.755 19.201 -5.468
191 HG2 LYS 27 1HG LYS 27 12.333 21.262 -7.190
192 HG3 LYS 27 2HG LYS 27 12.254 21.157 -5.416
193 HD2 LYS 27 1HD LYS 27 14.683 21.527 -5.282
194 HD3 LYS 27 2HD LYS 27 14.766 21.626 -7.057
195 HE2 LYS 27 1HE LYS 27 13.218 23.565 -6.988
196 HE3 LYS 27 2HE LYS 27 13.242 23.491 -5.211
197 HZ1 LYS 27 3HZ LYS 27 15.583 23.978 -6.939
198 HZ2 LYS 27 1HZ LYS 27 14.789 25.122 -6.055
199 HZ3 LYS 27 2HZ LYS 27 15.607 23.909 -5.291
200 H LEU 28 HN LEU 28 13.054 16.872 -8.255
201 HA LEU 28 HA LEU 28 14.455 15.023 -6.658
202 HB2 LEU 28 1HB LEU 28 13.236 14.993 -9.315
203 HB3 LEU 28 2HB LEU 28 13.977 13.465 -8.785
204 HG LEU 28 HG LEU 28 11.685 14.948 -7.441
205 HD11 LEU 28 1HD1 LEU 28 10.376 12.891 -8.033
206 HD12 LEU 28 2HD1 LEU 28 11.033 13.680 -9.487
207 HD13 LEU 28 3HD1 LEU 28 11.818 12.223 -8.833
208 HD21 LEU 28 3HD2 LEU 28 13.142 13.948 -5.782
209 HD22 LEU 28 1HD2 LEU 28 11.612 13.043 -5.870
210 HD23 LEU 28 2HD2 LEU 28 13.082 12.384 -6.630
211 H GLN 29 HN GLN 29 15.329 16.238 -9.892
212 HA GLN 29 HA GLN 29 17.693 14.559 -10.054
213 HB2 GLN 29 1HB GLN 29 18.246 15.895 -12.001
214 HB3 GLN 29 2HB GLN 29 16.550 15.360 -12.041
215 HG2 GLN 29 1HG GLN 29 16.030 17.932 -11.142
216 HG3 GLN 29 2HG GLN 29 17.775 17.902 -11.485
217 HE21 GLN 29 2HE2 GLN 29 15.876 19.651 -12.695
218 HE22 GLN 29 1HE2 GLN 29 15.825 19.287 -14.388
219 H ASN 30 HN ASN 30 16.990 17.554 -8.521
220 HA ASN 30 HA ASN 30 19.914 18.184 -8.330
221 HB2 ASN 30 1HB ASN 30 17.575 20.182 -7.853
222 HB3 ASN 30 2HB ASN 30 19.334 20.164 -7.577
223 HD21 ASN 30 2HD2 ASN 30 16.787 20.489 -9.861
224 HD22 ASN 30 1HD2 ASN 30 17.764 20.859 -11.242
225 H THR 31 HN THR 31 17.722 16.464 -6.700
226 HA THR 31 HA THR 31 18.762 17.348 -4.030
227 HB THR 31 HB THR 31 16.365 15.595 -4.721
228 HG1 THR 31 HG1 THR 31 16.548 18.237 -3.634
229 HG21 THR 31 3HG2 THR 31 17.394 16.609 -2.041
230 HG22 THR 31 1HG2 THR 31 15.887 15.700 -2.300
231 HG23 THR 31 2HG2 THR 31 17.460 14.924 -2.609
232 H SER 32 HN SER 32 20.095 16.162 -2.907
233 HA SER 32 HA SER 32 21.389 13.833 -4.136
234 HB2 SER 32 1HB SER 32 22.804 13.827 -2.357
235 HB3 SER 32 2HB SER 32 22.558 15.503 -2.897
236 HG SER 32 HG SER 32 22.502 15.288 -0.618
237 H VAL 33 HN VAL 33 21.589 11.764 -3.130
238 HA VAL 33 HA VAL 33 19.334 10.972 -1.304
239 HB VAL 33 HB VAL 33 19.053 8.896 -2.596
240 HG11 VAL 33 1HG1 VAL 33 17.924 9.849 -4.579
241 HG12 VAL 33 2HG1 VAL 33 17.592 10.820 -3.126
242 HG13 VAL 33 3HG1 VAL 33 18.777 11.390 -4.324
243 HG21 VAL 33 3HG2 VAL 33 21.284 8.717 -3.521
244 HG22 VAL 33 1HG2 VAL 33 20.058 8.633 -4.808
245 HG23 VAL 33 2HG2 VAL 33 20.988 10.130 -4.561
246 H GLN 34 HN GLN 34 19.637 8.723 -0.487
247 HA GLN 34 HA GLN 34 22.246 8.676 0.831
248 HB2 GLN 34 1HB GLN 34 19.951 6.705 0.865
249 HB3 GLN 34 2HB GLN 34 21.368 6.674 1.940
250 HG2 GLN 34 1HG GLN 34 19.094 8.838 2.093
251 HG3 GLN 34 2HG GLN 34 19.627 7.420 3.027
252 HE21 GLN 34 2HE2 GLN 34 19.856 10.767 2.650
253 HE22 GLN 34 1HE2 GLN 34 21.244 11.050 3.647
254 H LYS 35 HN LYS 35 23.595 6.776 0.977
255 HA LYS 35 HA LYS 35 24.171 5.835 -1.770
256 HB2 LYS 35 1HB LYS 35 25.644 5.525 0.851
257 HB3 LYS 35 2HB LYS 35 26.213 4.920 -0.722
258 HG2 LYS 35 1HG LYS 35 26.300 7.226 -1.580
259 HG3 LYS 35 2HG LYS 35 25.726 7.832 -0.009
260 HD2 LYS 35 1HD LYS 35 27.731 6.870 1.077
261 HD3 LYS 35 2HD LYS 35 28.312 6.320 -0.513
262 HE2 LYS 35 1HE LYS 35 28.362 8.652 -1.298
263 HE3 LYS 35 2HE LYS 35 27.791 9.198 0.295
264 HZ1 LYS 35 3HZ LYS 35 30.333 7.795 -0.225
265 HZ2 LYS 35 1HZ LYS 35 30.174 9.407 0.084
266 HZ3 LYS 35 2HZ LYS 35 29.803 8.302 1.253
267 H GLU 36 HN GLU 36 22.216 4.787 0.654
268 HA GLU 36 HA GLU 36 22.782 1.961 0.695
269 HB2 GLU 36 1HB GLU 36 21.376 3.101 2.344
270 HB3 GLU 36 2HB GLU 36 20.178 3.447 1.073
271 HG2 GLU 36 1HG GLU 36 19.356 1.479 2.326
272 HG3 GLU 36 2HG GLU 36 19.956 1.046 0.709
273 H HIS 37 HN HIS 37 20.927 4.017 -1.488
274 HA HIS 37 HA HIS 37 20.523 1.610 -3.229
275 HB2 HIS 37 1HB HIS 37 18.582 3.930 -2.823
276 HB3 HIS 37 2HB HIS 37 18.366 2.570 -3.949
277 HD1 HIS 37 HD1 HIS 37 18.042 0.174 -2.831
278 HD2 HIS 37 HD2 HIS 37 17.701 3.415 -0.159
279 HE1 HIS 37 HE1 HIS 37 16.848 -0.684 -0.879
280 H SER 38 HN SER 38 20.067 2.192 -5.514
281 HA SER 38 HA SER 38 22.188 3.933 -6.568
282 HB2 SER 38 1HB SER 38 21.532 3.274 -8.645
283 HB3 SER 38 2HB SER 38 21.566 1.860 -7.567
284 HG SER 38 HG SER 38 19.285 2.054 -7.415
285 H ARG 39 HN ARG 39 21.826 5.699 -8.007
286 HA ARG 39 HA ARG 39 19.571 7.431 -7.160
287 HB2 ARG 39 1HB ARG 39 21.784 8.345 -7.137
288 HB3 ARG 39 2HB ARG 39 21.930 8.043 -8.884
289 HG2 ARG 39 1HG ARG 39 20.126 9.610 -9.339
290 HG3 ARG 39 2HG ARG 39 19.872 9.862 -7.595
291 HD2 ARG 39 1HD ARG 39 22.159 10.770 -7.466
292 HD3 ARG 39 2HD ARG 39 22.253 10.654 -9.238
293 HE ARG 39 HE ARG 39 20.844 12.675 -9.326
294 HH11 ARG 39 1HH1 ARG 39 20.800 11.367 -6.094
295 HH12 ARG 39 2HH1 ARG 39 20.025 12.825 -5.508
296 HH21 ARG 39 1HH2 ARG 39 19.948 14.347 -8.672
297 HH22 ARG 39 2HH2 ARG 39 19.537 14.525 -6.977
298 H ILE 40 HN ILE 40 17.766 7.621 -8.199
299 HA ILE 40 HA ILE 40 17.177 6.307 -10.675
300 HB ILE 40 HB ILE 40 15.438 7.106 -9.030
301 HG12 ILE 40 1HG1 ILE 40 15.088 8.255 -11.784
302 HG13 ILE 40 2HG1 ILE 40 14.979 6.525 -11.388
303 HG21 ILE 40 1HG2 ILE 40 14.770 9.484 -9.115
304 HG22 ILE 40 2HG2 ILE 40 16.442 9.310 -8.533
305 HG23 ILE 40 3HG2 ILE 40 16.133 9.828 -10.206
306 HD11 ILE 40 3HD1 ILE 40 13.208 8.722 -10.262
307 HD12 ILE 40 1HD1 ILE 40 12.743 7.550 -11.517
308 HD13 ILE 40 2HD1 ILE 40 13.099 6.990 -9.866
309 HA PRO 41 HA PRO 41 19.245 8.702 -13.673
310 HB2 PRO 41 1HB PRO 41 16.968 7.635 -15.395
311 HB3 PRO 41 2HB PRO 41 18.709 7.573 -15.705
312 HG2 PRO 41 1HG PRO 41 17.445 5.362 -14.920
313 HG3 PRO 41 2HG PRO 41 19.040 5.730 -14.253
314 HD2 PRO 41 1HD PRO 41 16.310 6.074 -12.952
315 HD3 PRO 41 2HD PRO 41 17.827 5.529 -12.223
316 H ARG 42 HN ARG 42 19.093 10.626 -14.586
317 HA ARG 42 HA ARG 42 16.988 12.373 -13.688
318 HB2 ARG 42 1HB ARG 42 19.146 12.752 -15.710
319 HB3 ARG 42 2HB ARG 42 17.966 14.000 -15.247
320 HG2 ARG 42 1HG ARG 42 18.765 13.941 -12.945
321 HG3 ARG 42 2HG ARG 42 19.897 12.629 -13.352
322 HD2 ARG 42 1HD ARG 42 21.066 14.139 -14.860
323 HD3 ARG 42 2HD ARG 42 19.958 15.447 -14.382
324 HE ARG 42 HE ARG 42 21.267 14.594 -11.976
325 HH11 ARG 42 1HH1 ARG 42 22.253 15.931 -15.042
326 HH12 ARG 42 2HH1 ARG 42 23.615 16.718 -14.268
327 HH21 ARG 42 1HH2 ARG 42 22.826 15.483 -11.076
328 HH22 ARG 42 2HH2 ARG 42 23.942 16.463 -12.006
329 H SER 43 HN SER 43 17.517 10.588 -16.679
330 HA SER 43 HA SER 43 15.402 11.745 -18.276
331 HB2 SER 43 1HB SER 43 16.624 9.053 -18.310
332 HB3 SER 43 2HB SER 43 15.455 9.699 -19.485
333 HG SER 43 HG SER 43 17.629 9.992 -20.142
334 H GLN 44 HN GLN 44 15.504 9.036 -15.934
335 HA GLN 44 HA GLN 44 12.745 8.276 -16.259
336 HB2 GLN 44 1HB GLN 44 14.695 7.951 -13.971
337 HB3 GLN 44 2HB GLN 44 13.066 7.234 -14.004
338 HG2 GLN 44 1HG GLN 44 15.236 6.415 -16.130
339 HG3 GLN 44 2HG GLN 44 14.880 5.857 -14.478
340 HE21 GLN 44 2HE2 GLN 44 14.145 3.832 -14.978
341 HE22 GLN 44 1HE2 GLN 44 12.708 3.530 -15.897
342 H ILE 45 HN ILE 45 14.363 10.652 -14.222
343 HA ILE 45 HA ILE 45 12.049 11.256 -12.579
344 HB ILE 45 HB ILE 45 14.528 12.876 -13.314
345 HG12 ILE 45 1HG1 ILE 45 13.775 11.561 -10.720
346 HG13 ILE 45 2HG1 ILE 45 14.794 10.808 -11.969
347 HG21 ILE 45 1HG2 ILE 45 13.861 14.399 -11.485
348 HG22 ILE 45 2HG2 ILE 45 12.640 14.379 -12.777
349 HG23 ILE 45 3HG2 ILE 45 12.352 13.481 -11.269
350 HD11 ILE 45 3HD1 ILE 45 15.410 13.391 -10.490
351 HD12 ILE 45 1HD1 ILE 45 16.167 11.811 -10.186
352 HD13 ILE 45 2HD1 ILE 45 16.428 12.639 -11.740
353 H GLN 46 HN GLN 46 13.331 12.795 -15.528
354 HA GLN 46 HA GLN 46 11.332 14.898 -15.384
355 HB2 GLN 46 1HB GLN 46 13.215 13.987 -17.569
356 HB3 GLN 46 2HB GLN 46 12.150 15.407 -17.695
357 HG2 GLN 46 1HG GLN 46 13.553 16.397 -15.580
358 HG3 GLN 46 2HG GLN 46 14.296 14.805 -15.858
359 HE21 GLN 46 2HE2 GLN 46 15.960 16.899 -15.827
360 HE22 GLN 46 1HE2 GLN 46 16.489 17.312 -17.423
361 H ARG 47 HN ARG 47 11.346 11.697 -16.628
362 HA ARG 47 HA ARG 47 8.984 12.313 -18.365
363 HB2 ARG 47 1HB ARG 47 10.789 9.936 -18.381
364 HB3 ARG 47 2HB ARG 47 9.343 10.172 -19.389
365 HG2 ARG 47 1HG ARG 47 11.738 12.028 -19.421
366 HG3 ARG 47 2HG ARG 47 11.547 10.646 -20.527
367 HD2 ARG 47 1HD ARG 47 9.439 11.654 -21.311
368 HD3 ARG 47 2HD ARG 47 9.806 13.078 -20.309
369 HE ARG 47 HE ARG 47 11.999 12.712 -22.169
370 HH11 ARG 47 1HH1 ARG 47 8.613 13.543 -22.249
371 HH12 ARG 47 2HH1 ARG 47 8.880 14.514 -23.683
372 HH21 ARG 47 1HH2 ARG 47 12.319 13.814 -23.815
373 HH22 ARG 47 2HH2 ARG 47 10.993 14.669 -24.578
374 H ALA 48 HN ALA 48 9.493 11.574 -15.284
375 HA ALA 48 HA ALA 48 7.805 9.218 -15.000
376 HB1 ALA 48 3HB ALA 48 8.750 11.248 -12.946
377 HB2 ALA 48 1HB ALA 48 7.964 9.693 -12.586
378 HB3 ALA 48 2HB ALA 48 9.564 9.722 -13.364
379 H ARG 49 HN ARG 49 5.694 9.088 -15.001
380 HA ARG 49 HA ARG 49 4.016 11.496 -14.845
381 HB2 ARG 49 1HB ARG 49 3.352 8.597 -15.046
382 HB3 ARG 49 2HB ARG 49 2.153 9.903 -14.897
383 HG2 ARG 49 1HG ARG 49 3.078 10.913 -16.984
384 HG3 ARG 49 2HG ARG 49 4.138 9.493 -17.152
385 HD2 ARG 49 1HD ARG 49 2.221 8.063 -17.363
386 HD3 ARG 49 2HD ARG 49 1.137 9.454 -17.133
387 HE ARG 49 HE ARG 49 2.739 9.922 -19.515
388 HH11 ARG 49 1HH1 ARG 49 0.192 7.809 -18.415
389 HH12 ARG 49 2HH1 ARG 49 -0.414 7.676 -20.054
390 HH21 ARG 49 1HH2 ARG 49 2.062 9.773 -21.398
391 HH22 ARG 49 2HH2 ARG 49 0.653 8.794 -21.757
392 HA PRO 50 HA PRO 50 3.038 11.783 -10.607
393 HB2 PRO 50 1HB PRO 50 0.127 11.332 -11.405
394 HB3 PRO 50 2HB PRO 50 0.813 12.636 -10.424
395 HG2 PRO 50 1HG PRO 50 0.106 13.143 -12.940
396 HG3 PRO 50 2HG PRO 50 1.615 13.821 -12.316
397 HD2 PRO 50 1HD PRO 50 1.223 11.437 -14.165
398 HD3 PRO 50 2HD PRO 50 2.481 12.678 -14.206
399 H VAL 51 HN VAL 51 1.484 9.173 -12.421
400 HA VAL 51 HA VAL 51 1.337 7.502 -9.958
401 HB VAL 51 HB VAL 51 0.624 6.921 -12.863
402 HG11 VAL 51 1HG1 VAL 51 -0.429 4.876 -11.957
403 HG12 VAL 51 2HG1 VAL 51 1.322 4.889 -11.641
404 HG13 VAL 51 3HG1 VAL 51 0.179 5.281 -10.335
405 HG21 VAL 51 3HG2 VAL 51 -0.860 8.550 -11.856
406 HG22 VAL 51 1HG2 VAL 51 -1.690 6.992 -12.082
407 HG23 VAL 51 2HG2 VAL 51 -1.127 7.473 -10.463
408 H LYS 52 HN LYS 52 3.097 7.547 -13.045
409 HA LYS 52 HA LYS 52 4.496 5.090 -12.564
410 HB2 LYS 52 1HB LYS 52 4.264 6.188 -14.758
411 HB3 LYS 52 2HB LYS 52 5.339 7.490 -14.196
412 HG2 LYS 52 1HG LYS 52 7.183 5.913 -13.965
413 HG3 LYS 52 2HG LYS 52 6.118 4.563 -14.421
414 HD2 LYS 52 1HD LYS 52 5.761 5.609 -16.633
415 HD3 LYS 52 2HD LYS 52 6.863 6.929 -16.175
416 HE2 LYS 52 1HE LYS 52 8.701 5.341 -15.925
417 HE3 LYS 52 2HE LYS 52 7.609 3.992 -16.310
418 HZ1 LYS 52 3HZ LYS 52 8.313 6.201 -18.134
419 HZ2 LYS 52 1HZ LYS 52 8.902 4.662 -18.219
420 HZ3 LYS 52 2HZ LYS 52 7.300 4.949 -18.491
421 H MET 53 HN MET 53 5.167 8.421 -11.631
422 HA MET 53 HA MET 53 7.910 8.093 -10.921
423 HB2 MET 53 1HB MET 53 6.703 10.238 -11.135
424 HB3 MET 53 2HB MET 53 5.825 9.857 -9.634
425 HG2 MET 53 1HG MET 53 7.950 9.839 -8.398
426 HG3 MET 53 2HG MET 53 8.825 10.226 -9.899
427 HE1 MET 53 3HE MET 53 7.388 12.395 -11.405
428 HE2 MET 53 1HE MET 53 7.947 13.892 -10.619
429 HE3 MET 53 2HE MET 53 9.087 12.552 -10.895
430 H ALA 54 HN ALA 54 4.959 7.612 -8.993
431 HA ALA 54 HA ALA 54 6.244 7.010 -6.541
432 HB1 ALA 54 3HB ALA 54 3.648 5.897 -7.659
433 HB2 ALA 54 1HB ALA 54 4.158 5.833 -5.957
434 HB3 ALA 54 2HB ALA 54 3.829 7.403 -6.728
435 H THR 55 HN THR 55 5.349 4.865 -9.241
436 HA THR 55 HA THR 55 6.338 2.455 -8.013
437 HB THR 55 HB THR 55 6.048 3.181 -10.960
438 HG1 THR 55 HG1 THR 55 4.094 1.945 -10.703
439 HG21 THR 55 3HG2 THR 55 6.373 0.479 -9.592
440 HG22 THR 55 1HG2 THR 55 6.070 0.738 -11.327
441 HG23 THR 55 2HG2 THR 55 7.597 1.290 -10.597
442 H LEU 56 HN LEU 56 7.857 4.864 -10.134
443 HA LEU 56 HA LEU 56 10.323 3.442 -10.477
444 HB2 LEU 56 1HB LEU 56 9.545 6.278 -10.475
445 HB3 LEU 56 2HB LEU 56 11.208 5.857 -10.951
446 HG LEU 56 HG LEU 56 8.659 4.972 -12.360
447 HD11 LEU 56 1HD1 LEU 56 9.471 6.447 -14.219
448 HD12 LEU 56 2HD1 LEU 56 9.194 7.378 -12.728
449 HD13 LEU 56 3HD1 LEU 56 10.850 6.937 -13.207
450 HD21 LEU 56 3HD2 LEU 56 10.398 3.287 -12.491
451 HD22 LEU 56 1HD2 LEU 56 10.180 4.058 -14.080
452 HD23 LEU 56 2HD2 LEU 56 11.570 4.499 -13.059
453 H LEU 57 HN LEU 57 9.283 5.809 -8.042
454 HA LEU 57 HA LEU 57 11.860 6.009 -6.771
455 HB2 LEU 57 1HB LEU 57 9.077 6.434 -5.921
456 HB3 LEU 57 2HB LEU 57 10.383 6.879 -4.799
457 HG LEU 57 HG LEU 57 9.914 8.069 -7.560
458 HD11 LEU 57 1HD1 LEU 57 9.330 10.153 -6.291
459 HD12 LEU 57 2HD1 LEU 57 8.231 8.817 -5.880
460 HD13 LEU 57 3HD1 LEU 57 9.544 9.264 -4.764
461 HD21 LEU 57 3HD2 LEU 57 12.270 7.986 -6.993
462 HD22 LEU 57 1HD2 LEU 57 11.692 9.668 -6.936
463 HD23 LEU 57 2HD2 LEU 57 11.950 8.763 -5.425
464 H VAL 58 HN VAL 58 9.051 3.922 -6.202
465 HA VAL 58 HA VAL 58 10.254 2.603 -3.874
466 HB VAL 58 HB VAL 58 7.942 1.833 -5.702
467 HG11 VAL 58 1HG1 VAL 58 7.395 0.159 -3.968
468 HG12 VAL 58 2HG1 VAL 58 8.990 -0.162 -4.687
469 HG13 VAL 58 3HG1 VAL 58 8.874 0.595 -3.081
470 HG21 VAL 58 3HG2 VAL 58 7.514 3.832 -4.403
471 HG22 VAL 58 1HG2 VAL 58 6.542 2.469 -3.804
472 HG23 VAL 58 2HG2 VAL 58 7.991 2.987 -2.910
473 H THR 59 HN THR 59 10.391 2.145 -7.329
474 HA THR 59 HA THR 59 11.561 -0.517 -7.164
475 HB THR 59 HB THR 59 11.623 1.562 -9.390
476 HG1 THR 59 HG1 THR 59 9.996 0.148 -10.264
477 HG21 THR 59 3HG2 THR 59 12.335 -1.397 -9.414
478 HG22 THR 59 1HG2 THR 59 12.274 -0.330 -10.838
479 HG23 THR 59 2HG2 THR 59 13.488 -0.049 -9.565
480 H TYR 60 HN TYR 60 12.899 2.760 -7.604
481 HA TYR 60 HA TYR 60 15.627 1.673 -7.759
482 HB2 TYR 60 1HB TYR 60 14.419 4.432 -7.816
483 HB3 TYR 60 2HB TYR 60 16.177 4.170 -7.714
484 HD1 TYR 60 HD2 TYR 60 17.199 2.615 -9.555
485 HD2 TYR 60 HD1 TYR 60 13.414 4.545 -9.924
486 HE1 TYR 60 HE2 TYR 60 17.312 2.346 -12.010
487 HE2 TYR 60 HE1 TYR 60 13.513 4.284 -12.385
488 HH TYR 60 HH TYR 60 16.275 2.712 -14.004
489 H TYR 61 HN TYR 61 13.546 3.081 -5.333
490 HA TYR 61 HA TYR 61 15.851 3.008 -3.409
491 HB2 TYR 61 1HB TYR 61 13.459 4.859 -3.380
492 HB3 TYR 61 2HB TYR 61 14.802 4.827 -2.210
493 HD1 TYR 61 HD2 TYR 61 17.055 5.609 -2.894
494 HD2 TYR 61 HD1 TYR 61 13.704 5.952 -5.510
495 HE1 TYR 61 HE2 TYR 61 18.317 7.216 -4.283
496 HE2 TYR 61 HE1 TYR 61 14.956 7.565 -6.913
497 HH TYR 61 HH TYR 61 17.108 9.287 -6.345
498 H GLY 62 HN GLY 62 15.098 2.902 -1.103
499 HA2 GLY 62 1HA GLY 62 13.519 0.478 -0.840
500 HA3 GLY 62 2HA GLY 62 14.248 1.424 0.477
501 H GLU 63 HN GLU 63 11.930 0.504 1.167
502 HA GLU 63 HA GLU 63 9.608 1.949 0.234
503 HB2 GLU 63 1HB GLU 63 10.173 0.383 2.753
504 HB3 GLU 63 2HB GLU 63 8.586 1.082 2.347
505 HG2 GLU 63 1HG GLU 63 8.460 -0.404 0.318
506 HG3 GLU 63 2HG GLU 63 10.118 -0.904 0.722
507 H GLU 64 HN GLU 64 11.846 2.428 2.941
508 HA GLU 64 HA GLU 64 10.318 4.812 3.821
509 HB2 GLU 64 1HB GLU 64 12.855 3.523 4.835
510 HB3 GLU 64 2HB GLU 64 12.065 4.946 5.557
511 HG2 GLU 64 1HG GLU 64 10.031 3.495 6.062
512 HG3 GLU 64 2HG GLU 64 10.944 2.189 5.272
513 H TYR 65 HN TYR 65 12.995 4.018 1.803
514 HA TYR 65 HA TYR 65 14.280 6.651 2.054
515 HB2 TYR 65 1HB TYR 65 14.679 4.295 0.205
516 HB3 TYR 65 2HB TYR 65 15.612 5.808 0.100
517 HD1 TYR 65 HD2 TYR 65 17.205 6.407 1.883
518 HD2 TYR 65 HD1 TYR 65 15.100 2.700 1.974
519 HE1 TYR 65 HE2 TYR 65 18.784 5.565 3.589
520 HE2 TYR 65 HE1 TYR 65 16.674 1.840 3.683
521 HH TYR 65 HH TYR 65 19.372 3.816 4.924
522 H ALA 66 HN ALA 66 12.144 5.010 -0.249
523 HA ALA 66 HA ALA 66 12.070 7.161 -2.145
524 HB1 ALA 66 3HB ALA 66 9.974 5.062 -1.492
525 HB2 ALA 66 1HB ALA 66 9.992 6.101 -2.936
526 HB3 ALA 66 2HB ALA 66 11.283 4.902 -2.687
527 H VAL 67 HN VAL 67 10.147 6.437 0.748
528 HA VAL 67 HA VAL 67 8.335 8.706 0.404
529 HB VAL 67 HB VAL 67 9.050 6.997 2.821
530 HG11 VAL 67 1HG1 VAL 67 7.071 8.027 3.888
531 HG12 VAL 67 2HG1 VAL 67 8.308 9.251 3.515
532 HG13 VAL 67 3HG1 VAL 67 6.868 9.095 2.480
533 HG21 VAL 67 3HG2 VAL 67 7.903 5.776 1.072
534 HG22 VAL 67 1HG2 VAL 67 6.837 6.018 2.476
535 HG23 VAL 67 2HG2 VAL 67 6.626 7.015 1.016
536 H GLN 68 HN GLN 68 11.276 8.183 2.331
537 HA GLN 68 HA GLN 68 11.289 10.742 3.580
538 HB2 GLN 68 1HB GLN 68 12.745 8.863 4.205
539 HB3 GLN 68 2HB GLN 68 13.614 9.037 2.662
540 HG2 GLN 68 1HG GLN 68 14.380 11.473 3.573
541 HG3 GLN 68 2HG GLN 68 13.321 10.876 4.872
542 HE21 GLN 68 2HE2 GLN 68 15.860 11.711 5.466
543 HE22 GLN 68 1HE2 GLN 68 16.852 10.352 5.880
544 H LEU 69 HN LEU 69 12.802 9.701 0.519
545 HA LEU 69 HA LEU 69 13.905 12.226 -0.180
546 HB2 LEU 69 1HB LEU 69 14.484 10.287 -1.228
547 HB3 LEU 69 2HB LEU 69 12.886 9.915 -1.916
548 HG LEU 69 HG LEU 69 13.059 12.034 -3.260
549 HD11 LEU 69 1HD1 LEU 69 15.346 13.025 -3.541
550 HD12 LEU 69 2HD1 LEU 69 14.783 13.165 -1.859
551 HD13 LEU 69 3HD1 LEU 69 15.965 11.909 -2.300
552 HD21 LEU 69 3HD2 LEU 69 13.508 9.874 -4.265
553 HD22 LEU 69 1HD2 LEU 69 14.605 11.099 -4.944
554 HD23 LEU 69 2HD2 LEU 69 15.203 9.944 -3.727
555 H THR 70 HN THR 70 10.746 10.839 -1.113
556 HA THR 70 HA THR 70 9.801 13.110 -2.532
557 HB THR 70 HB THR 70 8.247 11.075 -0.879
558 HG1 THR 70 HG1 THR 70 9.434 10.230 -2.680
559 HG21 THR 70 3HG2 THR 70 7.296 13.040 -3.000
560 HG22 THR 70 1HG2 THR 70 6.301 11.787 -2.223
561 HG23 THR 70 2HG2 THR 70 6.942 13.139 -1.260
562 H LEU 71 HN LEU 71 9.515 12.324 0.930
563 HA LEU 71 HA LEU 71 7.869 14.527 1.640
564 HB2 LEU 71 1HB LEU 71 8.430 12.583 2.914
565 HB3 LEU 71 2HB LEU 71 10.034 13.205 3.364
566 HG LEU 71 HG LEU 71 7.420 14.628 3.975
567 HD11 LEU 71 1HD1 LEU 71 7.746 13.829 6.331
568 HD12 LEU 71 2HD1 LEU 71 7.540 12.464 5.208
569 HD13 LEU 71 3HD1 LEU 71 9.163 12.892 5.800
570 HD21 LEU 71 3HD2 LEU 71 9.354 16.085 3.849
571 HD22 LEU 71 1HD2 LEU 71 8.811 15.943 5.538
572 HD23 LEU 71 2HD2 LEU 71 10.247 15.047 4.984
573 H GLN 72 HN GLN 72 11.418 14.292 1.509
574 HA GLN 72 HA GLN 72 11.861 16.936 2.563
575 HB2 GLN 72 1HB GLN 72 13.534 15.078 0.867
576 HB3 GLN 72 2HB GLN 72 14.114 16.653 1.458
577 HG2 GLN 72 1HG GLN 72 13.771 15.658 3.949
578 HG3 GLN 72 2HG GLN 72 13.161 14.346 2.915
579 HE21 GLN 72 2HE2 GLN 72 15.214 14.111 4.891
580 HE22 GLN 72 1HE2 GLN 72 16.681 13.679 4.076
581 H VAL 73 HN VAL 73 11.465 15.686 -0.722
582 HA VAL 73 HA VAL 73 12.111 18.238 -2.007
583 HB VAL 73 HB VAL 73 10.639 15.771 -3.021
584 HG11 VAL 73 1HG1 VAL 73 11.020 16.738 -5.265
585 HG12 VAL 73 2HG1 VAL 73 10.005 17.808 -4.269
586 HG13 VAL 73 3HG1 VAL 73 11.726 18.190 -4.519
587 HG21 VAL 73 3HG2 VAL 73 12.948 15.311 -2.446
588 HG22 VAL 73 1HG2 VAL 73 12.720 15.295 -4.210
589 HG23 VAL 73 2HG2 VAL 73 13.487 16.696 -3.427
590 H LEU 74 HN LEU 74 9.138 16.677 -0.919
591 HA LEU 74 HA LEU 74 7.301 18.546 -2.015
592 HB2 LEU 74 1HB LEU 74 7.439 16.958 0.447
593 HB3 LEU 74 2HB LEU 74 5.956 17.901 0.171
594 HG LEU 74 HG LEU 74 7.038 15.717 -1.653
595 HD11 LEU 74 1HD1 LEU 74 5.047 14.407 -0.870
596 HD12 LEU 74 2HD1 LEU 74 6.127 14.812 0.485
597 HD13 LEU 74 3HD1 LEU 74 4.626 15.735 0.235
598 HD21 LEU 74 3HD2 LEU 74 5.842 17.439 -2.873
599 HD22 LEU 74 1HD2 LEU 74 4.876 15.944 -2.829
600 HD23 LEU 74 2HD2 LEU 74 4.458 17.306 -1.761
601 H ARG 75 HN ARG 75 9.125 18.676 1.039
602 HA ARG 75 HA ARG 75 8.109 21.253 1.835
603 HB2 ARG 75 1HB ARG 75 10.610 19.802 2.558
604 HB3 ARG 75 2HB ARG 75 10.133 21.383 3.220
605 HG2 ARG 75 1HG ARG 75 8.090 20.390 4.142
606 HG3 ARG 75 2HG ARG 75 8.546 18.809 3.463
607 HD2 ARG 75 1HD ARG 75 10.477 18.735 4.896
608 HD3 ARG 75 2HD ARG 75 10.069 20.340 5.549
609 HE ARG 75 HE ARG 75 7.858 18.599 6.172
610 HH11 ARG 75 1HH1 ARG 75 11.249 18.814 6.957
611 HH12 ARG 75 2HH1 ARG 75 10.941 18.075 8.516
612 HH21 ARG 75 1HH2 ARG 75 7.491 17.744 7.951
613 HH22 ARG 75 2HH2 ARG 75 8.798 17.464 9.084
614 H ALA 76 HN ALA 76 10.714 20.247 -0.304
615 HA ALA 76 HA ALA 76 11.958 22.838 -0.471
616 HB1 ALA 76 3HB ALA 76 11.978 20.521 -2.434
617 HB2 ALA 76 1HB ALA 76 13.071 21.923 -2.469
618 HB3 ALA 76 2HB ALA 76 13.134 20.780 -1.107
619 H ILE 77 HN ILE 77 9.150 21.428 -1.953
620 HA ILE 77 HA ILE 77 8.997 23.723 -3.889
621 HB ILE 77 HB ILE 77 7.336 22.346 -5.096
622 HG12 ILE 77 1HG1 ILE 77 7.950 20.160 -3.129
623 HG13 ILE 77 2HG1 ILE 77 6.526 21.223 -3.034
624 HG21 ILE 77 1HG2 ILE 77 8.841 20.557 -5.898
625 HG22 ILE 77 2HG2 ILE 77 9.720 22.089 -5.696
626 HG23 ILE 77 3HG2 ILE 77 9.888 20.802 -4.481
627 HD11 ILE 77 3HD1 ILE 77 7.204 19.361 -5.338
628 HD12 ILE 77 1HD1 ILE 77 5.962 19.073 -4.098
629 HD13 ILE 77 2HD1 ILE 77 5.781 20.424 -5.243
630 H ASN 78 HN ASN 78 8.301 23.592 -0.934
631 HA ASN 78 HA ASN 78 6.784 24.831 0.319
632 HB2 ASN 78 1HB ASN 78 5.675 25.952 -2.364
633 HB3 ASN 78 2HB ASN 78 5.370 26.203 -0.628
634 HD21 ASN 78 2HD2 ASN 78 6.489 27.879 -2.896
635 HD22 ASN 78 1HD2 ASN 78 7.945 28.552 -2.242
636 H GLN 79 HN GLN 79 6.259 22.122 -0.170
637 HA GLN 79 HA GLN 79 3.301 22.259 0.271
638 HB2 GLN 79 1HB GLN 79 4.875 20.089 -1.133
639 HB3 GLN 79 2HB GLN 79 3.171 19.957 -0.636
640 HG2 GLN 79 1HG GLN 79 4.146 21.942 -2.875
641 HG3 GLN 79 2HG GLN 79 3.435 20.312 -2.834
642 HE21 GLN 79 2HE2 GLN 79 2.500 23.024 -3.852
643 HE22 GLN 79 1HE2 GLN 79 0.928 23.222 -3.151
644 H ARG 80 HN ARG 80 4.338 22.662 2.457
645 HA ARG 80 HA ARG 80 5.424 20.393 3.885
646 HB2 ARG 80 1HB ARG 80 4.155 22.930 4.789
647 HB3 ARG 80 2HB ARG 80 4.686 21.647 5.901
648 HG2 ARG 80 1HG ARG 80 6.981 21.851 5.032
649 HG3 ARG 80 2HG ARG 80 6.446 23.149 3.937
650 HD2 ARG 80 1HD ARG 80 5.912 24.544 5.812
651 HD3 ARG 80 2HD ARG 80 6.359 23.239 6.936
652 HE ARG 80 HE ARG 80 8.719 23.899 5.405
653 HH11 ARG 80 1HH1 ARG 80 6.625 25.443 7.727
654 HH12 ARG 80 2HH1 ARG 80 7.970 26.404 8.310
655 HH21 ARG 80 1HH2 ARG 80 10.267 24.999 6.055
656 HH22 ARG 80 2HH2 ARG 80 10.047 26.152 7.356
657 H LEU 81 HN LEU 81 2.165 21.473 3.154
658 HA LEU 81 HA LEU 81 0.731 19.818 4.963
659 HB2 LEU 81 1HB LEU 81 -0.273 21.456 3.751
660 HB3 LEU 81 2HB LEU 81 0.062 20.790 2.137
661 HG LEU 81 HG LEU 81 -1.357 18.800 2.759
662 HD11 LEU 81 1HD1 LEU 81 -2.954 19.106 4.671
663 HD12 LEU 81 2HD1 LEU 81 -1.266 19.105 5.232
664 HD13 LEU 81 3HD1 LEU 81 -2.151 20.641 5.075
665 HD21 LEU 81 3HD2 LEU 81 -2.211 20.562 1.330
666 HD22 LEU 81 1HD2 LEU 81 -3.507 19.962 2.392
667 HD23 LEU 81 2HD2 LEU 81 -2.709 21.513 2.749
668 H LEU 82 HN LEU 82 1.761 19.079 1.621
669 HA LEU 82 HA LEU 82 0.838 16.346 1.755
670 HB2 LEU 82 1HB LEU 82 2.781 17.819 0.111
671 HB3 LEU 82 2HB LEU 82 2.421 16.129 -0.311
672 HG LEU 82 HG LEU 82 0.442 18.442 -0.296
673 HD11 LEU 82 1HD1 LEU 82 0.400 18.086 -2.779
674 HD12 LEU 82 2HD1 LEU 82 2.033 18.514 -2.214
675 HD13 LEU 82 3HD1 LEU 82 1.641 16.822 -2.603
676 HD21 LEU 82 3HD2 LEU 82 -0.612 16.357 0.354
677 HD22 LEU 82 1HD2 LEU 82 -1.142 16.821 -1.280
678 HD23 LEU 82 2HD2 LEU 82 0.070 15.534 -1.068
679 H ALA 83 HN ALA 83 3.877 17.923 2.555
680 HA ALA 83 HA ALA 83 5.445 15.558 2.847
681 HB1 ALA 83 3HB ALA 83 5.626 18.196 4.342
682 HB2 ALA 83 1HB ALA 83 6.888 16.943 4.289
683 HB3 ALA 83 2HB ALA 83 6.428 17.806 2.802
684 H GLU 84 HN GLU 84 3.389 17.313 5.167
685 HA GLU 84 HA GLU 84 3.891 15.490 7.357
686 HB2 GLU 84 1HB GLU 84 3.050 17.748 7.691
687 HB3 GLU 84 2HB GLU 84 1.572 17.342 6.785
688 HG2 GLU 84 1HG GLU 84 1.028 15.622 8.621
689 HG3 GLU 84 2HG GLU 84 2.511 16.228 9.394
690 H GLU 85 HN GLU 85 1.330 15.688 4.894
691 HA GLU 85 HA GLU 85 -0.219 13.507 5.960
692 HB2 GLU 85 1HB GLU 85 -0.004 14.723 3.206
693 HB3 GLU 85 2HB GLU 85 -1.146 13.423 3.626
694 HG2 GLU 85 1HG GLU 85 -1.146 16.263 4.814
695 HG3 GLU 85 2HG GLU 85 -2.233 15.518 3.620
696 H LEU 86 HN LEU 86 2.468 13.652 3.669
697 HA LEU 86 HA LEU 86 2.396 10.844 2.991
698 HB2 LEU 86 1HB LEU 86 3.455 12.418 1.694
699 HB3 LEU 86 2HB LEU 86 4.659 12.911 2.907
700 HG LEU 86 HG LEU 86 5.552 10.562 2.866
701 HD11 LEU 86 1HD1 LEU 86 4.942 9.140 0.890
702 HD12 LEU 86 2HD1 LEU 86 3.526 9.461 1.918
703 HD13 LEU 86 3HD1 LEU 86 3.747 10.364 0.399
704 HD21 LEU 86 3HD2 LEU 86 6.668 12.345 1.658
705 HD22 LEU 86 1HD2 LEU 86 6.774 10.827 0.735
706 HD23 LEU 86 2HD2 LEU 86 5.614 12.086 0.246
707 H HIS 87 HN HIS 87 4.191 12.691 5.453
708 HA HIS 87 HA HIS 87 5.528 10.479 6.644
709 HB2 HIS 87 1HB HIS 87 6.062 12.810 7.249
710 HB3 HIS 87 2HB HIS 87 4.441 13.011 7.957
711 HD1 HIS 87 HD1 HIS 87 7.621 10.987 8.475
712 HD2 HIS 87 HD2 HIS 87 4.331 12.383 10.706
713 HE1 HIS 87 HE1 HIS 87 8.058 10.348 10.792
714 H ARG 88 HN ARG 88 2.283 11.801 7.262
715 HA ARG 88 HA ARG 88 1.655 9.940 9.373
716 HB2 ARG 88 1HB ARG 88 -0.106 11.542 7.577
717 HB3 ARG 88 2HB ARG 88 -0.675 10.512 8.912
718 HG2 ARG 88 1HG ARG 88 0.579 11.867 10.515
719 HG3 ARG 88 2HG ARG 88 1.208 12.876 9.190
720 HD2 ARG 88 1HD ARG 88 -1.109 13.538 8.684
721 HD3 ARG 88 2HD ARG 88 -1.630 12.647 10.134
722 HE ARG 88 HE ARG 88 -0.332 15.316 10.203
723 HH11 ARG 88 1HH1 ARG 88 -1.110 12.454 12.037
724 HH12 ARG 88 2HH1 ARG 88 -0.912 13.350 13.530
725 HH21 ARG 88 1HH2 ARG 88 -0.110 16.358 11.903
726 HH22 ARG 88 2HH2 ARG 88 -0.343 15.576 13.456
727 H ALA 89 HN ALA 89 1.260 9.828 5.857
728 HA ALA 89 HA ALA 89 -0.114 7.307 5.811
729 HB1 ALA 89 3HB ALA 89 1.717 8.573 3.745
730 HB2 ALA 89 1HB ALA 89 0.622 7.201 3.461
731 HB3 ALA 89 2HB ALA 89 -0.043 8.801 3.866
732 H ALA 90 HN ALA 90 3.310 8.194 5.902
733 HA ALA 90 HA ALA 90 4.307 5.525 5.527
734 HB1 ALA 90 3HB ALA 90 5.563 7.903 6.939
735 HB2 ALA 90 1HB ALA 90 6.414 6.425 6.436
736 HB3 ALA 90 2HB ALA 90 5.717 7.510 5.211
737 H ILE 91 HN ILE 91 3.297 7.357 8.376
738 HA ILE 91 HA ILE 91 4.086 5.398 10.342
739 HB ILE 91 HB ILE 91 1.842 7.464 10.303
740 HG12 ILE 91 1HG1 ILE 91 4.425 7.445 11.836
741 HG13 ILE 91 2HG1 ILE 91 4.201 8.235 10.258
742 HG21 ILE 91 1HG2 ILE 91 1.656 7.055 12.733
743 HG22 ILE 91 2HG2 ILE 91 1.260 5.590 11.807
744 HG23 ILE 91 3HG2 ILE 91 2.844 5.737 12.604
745 HD11 ILE 91 3HD1 ILE 91 2.680 8.889 12.806
746 HD12 ILE 91 1HD1 ILE 91 3.996 9.857 12.102
747 HD13 ILE 91 2HD1 ILE 91 2.456 9.679 11.227
748 H GLN 92 HN GLN 92 1.123 5.754 8.429
749 HA GLN 92 HA GLN 92 -0.105 3.392 9.598
750 HB2 GLN 92 1HB GLN 92 -0.586 4.914 7.029
751 HB3 GLN 92 2HB GLN 92 -1.572 3.535 7.574
752 HG2 GLN 92 1HG GLN 92 -2.223 5.067 9.710
753 HG3 GLN 92 2HG GLN 92 -1.063 6.088 8.830
754 HE21 GLN 92 2HE2 GLN 92 -3.641 6.941 9.539
755 HE22 GLN 92 1HE2 GLN 92 -4.570 7.163 8.093
756 H LEU 93 HN LEU 93 2.046 3.992 6.886
757 HA LEU 93 HA LEU 93 1.727 1.486 5.559
758 HB2 LEU 93 1HB LEU 93 2.788 3.386 4.699
759 HB3 LEU 93 2HB LEU 93 4.208 3.281 5.764
760 HG LEU 93 HG LEU 93 4.634 0.981 4.771
761 HD11 LEU 93 1HD1 LEU 93 3.611 0.550 2.521
762 HD12 LEU 93 2HD1 LEU 93 2.366 0.646 3.790
763 HD13 LEU 93 3HD1 LEU 93 2.634 2.027 2.699
764 HD21 LEU 93 3HD2 LEU 93 5.967 2.913 4.164
765 HD22 LEU 93 1HD2 LEU 93 5.712 1.878 2.737
766 HD23 LEU 93 2HD2 LEU 93 4.777 3.383 2.926
Start of MODEL 7
1 H THR 4 1H THR 4 -0.718 -0.024 0.254
2 HA THR 4 HA THR 4 1.861 -0.142 1.481
3 HB THR 4 HB THR 4 2.762 -0.410 -0.770
4 HG1 THR 4 HG1 THR 4 1.236 -0.156 -2.563
5 HG21 THR 4 3HG2 THR 4 0.035 -1.739 -0.518
6 HG22 THR 4 1HG2 THR 4 1.362 -2.280 -1.572
7 HG23 THR 4 2HG2 THR 4 1.550 -2.334 0.198
8 HA PRO 5 HA PRO 5 3.370 3.988 1.358
9 HB2 PRO 5 1HB PRO 5 6.054 3.490 0.856
10 HB3 PRO 5 2HB PRO 5 5.341 3.184 2.446
11 HG2 PRO 5 1HG PRO 5 5.879 1.229 0.186
12 HG3 PRO 5 2HG PRO 5 6.197 1.043 1.916
13 HD2 PRO 5 1HD PRO 5 3.992 -0.087 0.781
14 HD3 PRO 5 2HD PRO 5 3.919 0.568 2.422
15 H SER 6 HN SER 6 3.873 1.762 -1.293
16 HA SER 6 HA SER 6 4.696 3.674 -3.315
17 HB2 SER 6 1HB SER 6 5.010 1.381 -3.589
18 HB3 SER 6 2HB SER 6 3.253 1.105 -3.573
19 HG SER 6 HG SER 6 4.109 1.273 -5.691
20 H ASP 7 HN ASP 7 1.496 2.327 -2.383
21 HA ASP 7 HA ASP 7 0.006 4.004 -4.207
22 HB2 ASP 7 1HB ASP 7 -0.882 2.428 -1.718
23 HB3 ASP 7 2HB ASP 7 -1.855 3.459 -2.795
24 H HIS 8 HN HIS 8 1.034 4.363 -0.851
25 HA HIS 8 HA HIS 8 -0.473 6.733 -0.278
26 HB2 HIS 8 1HB HIS 8 2.200 5.729 0.792
27 HB3 HIS 8 2HB HIS 8 1.333 7.141 1.441
28 HD1 HIS 8 HD1 HIS 8 1.908 4.754 3.233
29 HD2 HIS 8 HD2 HIS 8 -1.679 5.120 1.136
30 HE1 HIS 8 HE1 HIS 8 0.342 3.392 4.450
31 H LEU 9 HN LEU 9 2.792 6.300 -1.639
32 HA LEU 9 HA LEU 9 3.240 9.127 -2.038
33 HB2 LEU 9 1HB LEU 9 4.264 6.650 -3.245
34 HB3 LEU 9 2HB LEU 9 4.988 8.195 -3.746
35 HG LEU 9 HG LEU 9 4.975 7.093 -0.911
36 HD11 LEU 9 1HD1 LEU 9 7.432 6.742 -1.278
37 HD12 LEU 9 2HD1 LEU 9 6.464 5.781 -2.420
38 HD13 LEU 9 3HD1 LEU 9 7.242 7.286 -2.961
39 HD21 LEU 9 3HD2 LEU 9 4.973 9.517 -0.982
40 HD22 LEU 9 1HD2 LEU 9 6.563 8.928 -0.442
41 HD23 LEU 9 2HD2 LEU 9 6.350 9.513 -2.110
42 H LEU 10 HN LEU 10 1.783 6.588 -4.016
43 HA LEU 10 HA LEU 10 1.622 7.980 -6.472
44 HB2 LEU 10 1HB LEU 10 1.094 5.687 -5.928
45 HB3 LEU 10 2HB LEU 10 -0.525 6.114 -5.327
46 HG LEU 10 HG LEU 10 0.515 6.654 -8.135
47 HD11 LEU 10 1HD1 LEU 10 -1.101 4.865 -8.831
48 HD12 LEU 10 2HD1 LEU 10 0.135 4.224 -7.723
49 HD13 LEU 10 3HD1 LEU 10 -1.501 4.582 -7.121
50 HD21 LEU 10 3HD2 LEU 10 -1.108 8.298 -7.400
51 HD22 LEU 10 1HD2 LEU 10 -1.830 7.244 -8.638
52 HD23 LEU 10 2HD2 LEU 10 -2.239 7.011 -6.921
53 H SER 11 HN SER 11 -0.854 7.881 -3.891
54 HA SER 11 HA SER 11 -2.628 9.825 -5.098
55 HB2 SER 11 1HB SER 11 -3.348 8.240 -3.524
56 HB3 SER 11 2HB SER 11 -2.359 9.018 -2.266
57 HG SER 11 HG SER 11 -3.573 10.935 -2.662
58 H THR 12 HN THR 12 -0.171 10.073 -2.488
59 HA THR 12 HA THR 12 -0.521 12.804 -1.873
60 HB THR 12 HB THR 12 2.061 11.184 -1.871
61 HG1 THR 12 HG1 THR 12 0.364 10.362 -0.524
62 HG21 THR 12 3HG2 THR 12 1.330 13.771 -0.442
63 HG22 THR 12 1HG2 THR 12 2.842 12.857 -0.230
64 HG23 THR 12 2HG2 THR 12 2.475 13.620 -1.796
65 H LEU 13 HN LEU 13 1.477 11.334 -4.413
66 HA LEU 13 HA LEU 13 2.466 13.961 -5.283
67 HB2 LEU 13 1HB LEU 13 2.551 11.230 -6.382
68 HB3 LEU 13 2HB LEU 13 3.449 12.532 -7.195
69 HG LEU 13 HG LEU 13 3.947 11.413 -4.410
70 HD11 LEU 13 1HD1 LEU 13 6.170 10.771 -5.380
71 HD12 LEU 13 2HD1 LEU 13 4.832 10.014 -6.274
72 HD13 LEU 13 3HD1 LEU 13 5.661 11.438 -6.949
73 HD21 LEU 13 3HD2 LEU 13 4.267 13.817 -4.412
74 HD22 LEU 13 1HD2 LEU 13 5.841 12.995 -4.296
75 HD23 LEU 13 2HD2 LEU 13 5.319 13.704 -5.843
76 H GLU 14 HN GLU 14 0.010 11.638 -6.313
77 HA GLU 14 HA GLU 14 -0.759 12.901 -8.744
78 HB2 GLU 14 1HB GLU 14 -1.569 10.716 -7.973
79 HB3 GLU 14 2HB GLU 14 -2.488 11.526 -6.680
80 HG2 GLU 14 1HG GLU 14 -3.877 12.693 -8.471
81 HG3 GLU 14 2HG GLU 14 -2.840 11.834 -9.634
82 H GLU 15 HN GLU 15 -1.294 13.838 -5.422
83 HA GLU 15 HA GLU 15 -3.485 15.678 -6.103
84 HB2 GLU 15 1HB GLU 15 -1.882 15.190 -3.592
85 HB3 GLU 15 2HB GLU 15 -3.189 16.391 -3.726
86 HG2 GLU 15 1HG GLU 15 -4.874 14.634 -3.980
87 HG3 GLU 15 2HG GLU 15 -3.553 13.508 -4.366
88 H LEU 16 HN LEU 16 -0.221 15.787 -6.602
89 HA LEU 16 HA LEU 16 0.206 18.623 -6.098
90 HB2 LEU 16 1HB LEU 16 1.431 16.621 -7.879
91 HB3 LEU 16 2HB LEU 16 2.173 18.231 -7.732
92 HG LEU 16 HG LEU 16 1.853 16.193 -5.494
93 HD11 LEU 16 1HD1 LEU 16 4.356 16.053 -5.602
94 HD12 LEU 16 2HD1 LEU 16 3.613 15.566 -7.145
95 HD13 LEU 16 3HD1 LEU 16 4.344 17.180 -6.979
96 HD21 LEU 16 3HD2 LEU 16 1.685 18.469 -4.675
97 HD22 LEU 16 1HD2 LEU 16 3.232 17.753 -4.164
98 HD23 LEU 16 2HD2 LEU 16 3.190 18.913 -5.514
99 H VAL 17 HN VAL 17 0.463 20.277 -7.656
100 HA VAL 17 HA VAL 17 -1.371 19.989 -10.015
101 HB VAL 17 HB VAL 17 -1.185 22.432 -10.188
102 HG11 VAL 17 1HG1 VAL 17 -2.318 23.052 -8.080
103 HG12 VAL 17 2HG1 VAL 17 -2.925 21.498 -8.700
104 HG13 VAL 17 3HG1 VAL 17 -1.777 21.526 -7.340
105 HG21 VAL 17 3HG2 VAL 17 1.104 22.695 -9.442
106 HG22 VAL 17 1HG2 VAL 17 0.010 23.743 -8.509
107 HG23 VAL 17 2HG2 VAL 17 0.636 22.242 -7.784
108 HA PRO 18 HA PRO 18 1.487 19.632 -13.151
109 HB2 PRO 18 1HB PRO 18 0.478 22.296 -14.259
110 HB3 PRO 18 2HB PRO 18 0.660 20.752 -15.100
111 HG2 PRO 18 1HG PRO 18 -1.771 21.550 -14.363
112 HG3 PRO 18 2HG PRO 18 -1.325 19.851 -14.165
113 HD2 PRO 18 1HD PRO 18 -1.533 22.022 -12.052
114 HD3 PRO 18 2HD PRO 18 -1.926 20.302 -11.923
115 H TYR 19 HN TYR 19 1.328 22.771 -11.573
116 HA TYR 19 HA TYR 19 3.984 23.568 -12.507
117 HB2 TYR 19 1HB TYR 19 2.152 24.614 -10.343
118 HB3 TYR 19 2HB TYR 19 3.723 25.336 -10.766
119 HD1 TYR 19 HD2 TYR 19 4.038 26.290 -13.080
120 HD2 TYR 19 HD1 TYR 19 0.210 25.098 -11.628
121 HE1 TYR 19 HE2 TYR 19 2.960 27.624 -14.860
122 HE2 TYR 19 HE1 TYR 19 -0.888 26.429 -13.406
123 HH TYR 19 HH TYR 19 0.994 28.296 -15.794
124 H ASP 20 HN ASP 20 2.677 21.847 -9.753
125 HA ASP 20 HA ASP 20 5.270 22.024 -8.318
126 HB2 ASP 20 1HB ASP 20 2.573 20.770 -7.526
127 HB3 ASP 20 2HB ASP 20 4.150 20.646 -6.708
128 H PHE 21 HN PHE 21 3.560 19.883 -10.431
129 HA PHE 21 HA PHE 21 5.155 17.529 -9.918
130 HB2 PHE 21 1HB PHE 21 3.512 18.551 -12.238
131 HB3 PHE 21 2HB PHE 21 4.584 17.151 -12.458
132 HD1 PHE 21 HD2 PHE 21 4.356 15.421 -10.368
133 HD2 PHE 21 HD1 PHE 21 1.342 18.058 -11.856
134 HE1 PHE 21 HE2 PHE 21 2.606 13.934 -9.452
135 HE2 PHE 21 HE1 PHE 21 -0.410 16.574 -10.938
136 HZ PHE 21 HZ PHE 21 0.222 14.513 -9.737
137 H GLU 22 HN GLU 22 5.616 20.368 -12.003
138 HA GLU 22 HA GLU 22 8.162 19.497 -13.059
139 HB2 GLU 22 1HB GLU 22 6.924 22.224 -12.672
140 HB3 GLU 22 2HB GLU 22 8.488 21.943 -13.476
141 HG2 GLU 22 1HG GLU 22 7.322 20.625 -15.273
142 HG3 GLU 22 2HG GLU 22 5.849 20.806 -14.294
143 H LYS 23 HN LYS 23 7.302 21.629 -10.328
144 HA LYS 23 HA LYS 23 9.990 22.110 -9.477
145 HB2 LYS 23 1HB LYS 23 7.375 22.031 -7.970
146 HB3 LYS 23 2HB LYS 23 8.922 22.540 -7.253
147 HG2 LYS 23 1HG LYS 23 9.078 24.383 -8.867
148 HG3 LYS 23 2HG LYS 23 7.547 23.868 -9.614
149 HD2 LYS 23 1HD LYS 23 6.391 24.250 -7.454
150 HD3 LYS 23 2HD LYS 23 7.923 24.827 -6.756
151 HE2 LYS 23 1HE LYS 23 8.005 26.639 -8.403
152 HE3 LYS 23 2HE LYS 23 6.493 26.055 -9.134
153 HZ1 LYS 23 3HZ LYS 23 6.788 27.058 -6.375
154 HZ2 LYS 23 1HZ LYS 23 6.103 27.885 -7.628
155 HZ3 LYS 23 2HZ LYS 23 5.385 26.517 -7.052
156 H PHE 24 HN PHE 24 7.763 19.453 -8.824
157 HA PHE 24 HA PHE 24 9.332 18.249 -6.725
158 HB2 PHE 24 1HB PHE 24 6.928 17.701 -7.167
159 HB3 PHE 24 2HB PHE 24 7.417 16.906 -8.680
160 HD1 PHE 24 HD1 PHE 24 7.737 16.786 -4.996
161 HD2 PHE 24 HD2 PHE 24 8.207 14.717 -8.704
162 HE1 PHE 24 HE1 PHE 24 8.088 14.670 -3.767
163 HE2 PHE 24 HE2 PHE 24 8.557 12.598 -7.478
164 HZ PHE 24 HZ PHE 24 8.498 12.575 -5.009
165 H LYS 25 HN LYS 25 9.163 17.602 -10.232
166 HA LYS 25 HA LYS 25 11.184 15.511 -10.071
167 HB2 LYS 25 1HB LYS 25 10.997 15.360 -12.395
168 HB3 LYS 25 2HB LYS 25 9.359 15.700 -11.788
169 HG2 LYS 25 1HG LYS 25 9.655 18.086 -12.404
170 HG3 LYS 25 2HG LYS 25 11.255 17.692 -13.077
171 HD2 LYS 25 1HD LYS 25 10.077 16.014 -14.577
172 HD3 LYS 25 2HD LYS 25 8.543 16.732 -14.033
173 HE2 LYS 25 1HE LYS 25 9.307 18.938 -14.842
174 HE3 LYS 25 2HE LYS 25 10.812 18.189 -15.425
175 HZ1 LYS 25 3HZ LYS 25 8.094 17.532 -16.365
176 HZ2 LYS 25 1HZ LYS 25 9.201 18.437 -17.188
177 HZ3 LYS 25 2HZ LYS 25 9.489 16.837 -16.905
178 H PHE 26 HN PHE 26 11.259 18.961 -10.371
179 HA PHE 26 HA PHE 26 13.994 19.141 -11.331
180 HB2 PHE 26 1HB PHE 26 12.211 21.066 -9.783
181 HB3 PHE 26 2HB PHE 26 13.851 21.468 -10.340
182 HD1 PHE 26 HD1 PHE 26 12.992 19.484 -12.867
183 HD2 PHE 26 HD2 PHE 26 11.727 23.176 -11.128
184 HE1 PHE 26 HE1 PHE 26 12.078 20.197 -15.051
185 HE2 PHE 26 HE2 PHE 26 10.810 23.892 -13.309
186 HZ PHE 26 HZ PHE 26 10.988 22.402 -15.271
187 H LYS 27 HN LYS 27 12.514 18.599 -8.206
188 HA LYS 27 HA LYS 27 15.089 18.948 -6.797
189 HB2 LYS 27 1HB LYS 27 12.372 17.976 -5.899
190 HB3 LYS 27 2HB LYS 27 13.792 18.158 -4.841
191 HG2 LYS 27 1HG LYS 27 12.448 20.407 -6.379
192 HG3 LYS 27 2HG LYS 27 12.199 20.056 -4.653
193 HD2 LYS 27 1HD LYS 27 14.622 20.400 -4.257
194 HD3 LYS 27 2HD LYS 27 14.826 20.815 -5.975
195 HE2 LYS 27 1HE LYS 27 13.244 22.691 -5.693
196 HE3 LYS 27 2HE LYS 27 13.097 22.291 -3.966
197 HZ1 LYS 27 3HZ LYS 27 15.580 23.115 -5.330
198 HZ2 LYS 27 1HZ LYS 27 14.670 24.067 -4.337
199 HZ3 LYS 27 2HZ LYS 27 15.445 22.743 -3.728
200 H LEU 28 HN LEU 28 13.208 16.387 -8.231
201 HA LEU 28 HA LEU 28 14.645 14.185 -7.059
202 HB2 LEU 28 1HB LEU 28 13.297 14.671 -9.626
203 HB3 LEU 28 2HB LEU 28 13.911 13.035 -9.292
204 HG LEU 28 HG LEU 28 11.738 14.534 -7.780
205 HD11 LEU 28 1HD1 LEU 28 10.294 12.633 -8.552
206 HD12 LEU 28 2HD1 LEU 28 11.004 13.507 -9.929
207 HD13 LEU 28 3HD1 LEU 28 11.688 11.947 -9.417
208 HD21 LEU 28 3HD2 LEU 28 13.122 13.289 -6.227
209 HD22 LEU 28 1HD2 LEU 28 11.534 12.502 -6.390
210 HD23 LEU 28 2HD2 LEU 28 12.957 11.818 -7.214
211 H GLN 29 HN GLN 29 15.326 16.321 -9.787
212 HA GLN 29 HA GLN 29 17.728 14.858 -10.568
213 HB2 GLN 29 1HB GLN 29 16.753 17.664 -11.143
214 HB3 GLN 29 2HB GLN 29 18.212 16.934 -11.853
215 HG2 GLN 29 1HG GLN 29 16.549 15.139 -13.008
216 HG3 GLN 29 2HG GLN 29 15.445 16.116 -12.012
217 HE21 GLN 29 2HE2 GLN 29 14.467 17.804 -12.943
218 HE22 GLN 29 1HE2 GLN 29 14.922 18.518 -14.455
219 H ASN 30 HN ASN 30 16.944 17.182 -8.143
220 HA ASN 30 HA ASN 30 19.846 17.746 -7.690
221 HB2 ASN 30 1HB ASN 30 17.440 19.235 -6.392
222 HB3 ASN 30 2HB ASN 30 19.207 19.195 -6.169
223 HD21 ASN 30 2HD2 ASN 30 17.172 21.242 -7.129
224 HD22 ASN 30 1HD2 ASN 30 17.865 21.862 -8.590
225 H THR 31 HN THR 31 18.100 15.251 -7.041
226 HA THR 31 HA THR 31 18.289 15.109 -4.119
227 HB THR 31 HB THR 31 17.764 12.969 -6.222
228 HG1 THR 31 HG1 THR 31 16.190 14.786 -5.686
229 HG21 THR 31 3HG2 THR 31 17.518 12.864 -3.190
230 HG22 THR 31 1HG2 THR 31 17.020 11.582 -4.318
231 HG23 THR 31 2HG2 THR 31 18.740 12.012 -4.163
232 H SER 32 HN SER 32 19.936 14.596 -2.919
233 HA SER 32 HA SER 32 22.489 13.598 -4.008
234 HB2 SER 32 1HB SER 32 22.533 15.095 -2.252
235 HB3 SER 32 2HB SER 32 21.539 14.022 -1.241
236 HG SER 32 HG SER 32 23.780 13.817 -0.817
237 H VAL 33 HN VAL 33 23.158 11.537 -4.147
238 HA VAL 33 HA VAL 33 21.291 9.387 -3.149
239 HB VAL 33 HB VAL 33 22.952 9.409 -5.704
240 HG11 VAL 33 1HG1 VAL 33 21.771 7.287 -6.173
241 HG12 VAL 33 2HG1 VAL 33 22.720 7.173 -4.673
242 HG13 VAL 33 3HG1 VAL 33 20.955 7.393 -4.595
243 HG21 VAL 33 3HG2 VAL 33 21.060 10.909 -5.899
244 HG22 VAL 33 1HG2 VAL 33 20.812 9.446 -6.882
245 HG23 VAL 33 2HG2 VAL 33 19.962 9.629 -5.330
246 H GLN 34 HN GLN 34 22.035 7.971 -1.843
247 HA GLN 34 HA GLN 34 24.943 7.921 -1.294
248 HB2 GLN 34 1HB GLN 34 22.661 6.375 -0.046
249 HB3 GLN 34 2HB GLN 34 24.338 6.447 0.542
250 HG2 GLN 34 1HG GLN 34 22.326 8.856 0.699
251 HG3 GLN 34 2HG GLN 34 23.023 7.658 1.815
252 HE21 GLN 34 2HE2 GLN 34 23.344 10.734 0.439
253 HE22 GLN 34 1HE2 GLN 34 24.973 11.066 0.924
254 H LYS 35 HN LYS 35 26.037 5.843 -0.972
255 HA LYS 35 HA LYS 35 25.993 4.376 -3.450
256 HB2 LYS 35 1HB LYS 35 27.305 3.837 -0.785
257 HB3 LYS 35 2HB LYS 35 27.557 2.845 -2.240
258 HG2 LYS 35 1HG LYS 35 28.482 4.793 -3.418
259 HG3 LYS 35 2HG LYS 35 28.216 5.798 -1.972
260 HD2 LYS 35 1HD LYS 35 29.757 4.376 -0.691
261 HD3 LYS 35 2HD LYS 35 30.014 3.354 -2.124
262 HE2 LYS 35 1HE LYS 35 30.947 5.269 -3.337
263 HE3 LYS 35 2HE LYS 35 30.669 6.310 -1.922
264 HZ1 LYS 35 3HZ LYS 35 32.465 3.971 -2.003
265 HZ2 LYS 35 1HZ LYS 35 32.944 5.550 -2.034
266 HZ3 LYS 35 2HZ LYS 35 32.208 4.936 -0.690
267 H GLU 36 HN GLU 36 24.319 3.969 -0.440
268 HA GLU 36 HA GLU 36 23.724 1.150 -0.753
269 HB2 GLU 36 1HB GLU 36 22.385 3.375 0.785
270 HB3 GLU 36 2HB GLU 36 21.880 1.669 0.853
271 HG2 GLU 36 1HG GLU 36 24.131 1.061 1.824
272 HG3 GLU 36 2HG GLU 36 24.564 2.768 1.575
273 H HIS 37 HN HIS 37 22.367 4.078 -2.072
274 HA HIS 37 HA HIS 37 20.038 2.498 -3.106
275 HB2 HIS 37 1HB HIS 37 20.252 5.522 -2.772
276 HB3 HIS 37 2HB HIS 37 18.806 4.589 -3.223
277 HD1 HIS 37 HD1 HIS 37 17.644 3.205 -1.345
278 HD2 HIS 37 HD2 HIS 37 20.788 5.632 0.063
279 HE1 HIS 37 HE1 HIS 37 17.332 3.375 1.072
280 H SER 38 HN SER 38 19.172 3.193 -5.195
281 HA SER 38 HA SER 38 21.404 3.729 -7.158
282 HB2 SER 38 1HB SER 38 18.755 2.464 -7.513
283 HB3 SER 38 2HB SER 38 19.933 2.849 -8.789
284 HG SER 38 HG SER 38 20.122 0.699 -8.024
285 H ARG 39 HN ARG 39 21.204 5.322 -8.691
286 HA ARG 39 HA ARG 39 19.307 7.509 -8.034
287 HB2 ARG 39 1HB ARG 39 21.611 8.074 -8.276
288 HB3 ARG 39 2HB ARG 39 21.606 7.438 -9.939
289 HG2 ARG 39 1HG ARG 39 20.030 9.154 -10.630
290 HG3 ARG 39 2HG ARG 39 19.908 9.753 -8.957
291 HD2 ARG 39 1HD ARG 39 22.238 10.402 -9.025
292 HD3 ARG 39 2HD ARG 39 22.351 9.814 -10.700
293 HE ARG 39 HE ARG 39 21.163 11.880 -11.388
294 HH11 ARG 39 1HH1 ARG 39 21.191 11.593 -7.913
295 HH12 ARG 39 2HH1 ARG 39 20.690 13.265 -7.764
296 HH21 ARG 39 1HH2 ARG 39 20.580 13.794 -11.235
297 HH22 ARG 39 2HH2 ARG 39 20.340 14.522 -9.659
298 H ILE 40 HN ILE 40 17.553 7.995 -9.095
299 HA ILE 40 HA ILE 40 16.694 6.453 -11.423
300 HB ILE 40 HB ILE 40 15.610 9.047 -10.230
301 HG12 ILE 40 1HG1 ILE 40 14.599 6.237 -9.902
302 HG13 ILE 40 2HG1 ILE 40 15.629 7.086 -8.728
303 HG21 ILE 40 1HG2 ILE 40 13.561 8.500 -11.501
304 HG22 ILE 40 2HG2 ILE 40 14.950 8.722 -12.591
305 HG23 ILE 40 3HG2 ILE 40 14.376 7.083 -12.204
306 HD11 ILE 40 3HD1 ILE 40 12.858 7.958 -9.620
307 HD12 ILE 40 1HD1 ILE 40 13.258 7.189 -8.068
308 HD13 ILE 40 2HD1 ILE 40 13.890 8.809 -8.446
309 HA PRO 41 HA PRO 41 18.916 8.578 -14.574
310 HB2 PRO 41 1HB PRO 41 16.598 7.406 -16.169
311 HB3 PRO 41 2HB PRO 41 18.331 7.318 -16.514
312 HG2 PRO 41 1HG PRO 41 17.082 5.169 -15.553
313 HG3 PRO 41 2HG PRO 41 18.694 5.574 -14.952
314 HD2 PRO 41 1HD PRO 41 15.999 6.007 -13.608
315 HD3 PRO 41 2HD PRO 41 17.536 5.519 -12.883
316 H ARG 42 HN ARG 42 18.817 10.530 -15.291
317 HA ARG 42 HA ARG 42 16.609 12.206 -14.480
318 HB2 ARG 42 1HB ARG 42 18.986 12.750 -16.194
319 HB3 ARG 42 2HB ARG 42 17.751 13.957 -15.768
320 HG2 ARG 42 1HG ARG 42 18.269 13.663 -13.390
321 HG3 ARG 42 2HG ARG 42 19.489 12.434 -13.802
322 HD2 ARG 42 1HD ARG 42 20.565 14.481 -13.294
323 HD3 ARG 42 2HD ARG 42 20.732 14.145 -15.034
324 HE ARG 42 HE ARG 42 18.556 16.068 -14.529
325 HH11 ARG 42 1HH1 ARG 42 22.023 15.809 -14.792
326 HH12 ARG 42 2HH1 ARG 42 22.116 17.484 -15.297
327 HH21 ARG 42 1HH2 ARG 42 18.645 17.990 -15.099
328 HH22 ARG 42 2HH2 ARG 42 20.190 18.730 -15.472
329 H SER 43 HN SER 43 17.336 10.464 -17.405
330 HA SER 43 HA SER 43 15.511 11.761 -19.233
331 HB2 SER 43 1HB SER 43 15.626 9.908 -20.521
332 HB3 SER 43 2HB SER 43 17.240 10.206 -19.835
333 HG SER 43 HG SER 43 16.896 8.526 -18.398
334 H GLN 44 HN GLN 44 15.080 9.541 -16.519
335 HA GLN 44 HA GLN 44 12.245 9.056 -17.282
336 HB2 GLN 44 1HB GLN 44 13.881 7.989 -14.970
337 HB3 GLN 44 2HB GLN 44 12.245 7.472 -15.443
338 HG2 GLN 44 1HG GLN 44 14.871 6.722 -16.969
339 HG3 GLN 44 2HG GLN 44 13.546 5.925 -16.091
340 HE21 GLN 44 2HE2 GLN 44 14.675 7.155 -19.102
341 HE22 GLN 44 1HE2 GLN 44 13.256 6.816 -20.038
342 H ILE 45 HN ILE 45 14.193 10.862 -15.026
343 HA ILE 45 HA ILE 45 12.019 11.555 -13.218
344 HB ILE 45 HB ILE 45 14.682 12.902 -13.851
345 HG12 ILE 45 1HG1 ILE 45 13.809 11.380 -11.411
346 HG13 ILE 45 2HG1 ILE 45 14.709 10.675 -12.773
347 HG21 ILE 45 1HG2 ILE 45 14.270 14.266 -11.832
348 HG22 ILE 45 2HG2 ILE 45 13.029 14.566 -13.071
349 HG23 ILE 45 3HG2 ILE 45 12.655 13.537 -11.669
350 HD11 ILE 45 3HD1 ILE 45 15.663 12.952 -11.002
351 HD12 ILE 45 1HD1 ILE 45 16.220 11.264 -10.919
352 HD13 ILE 45 2HD1 ILE 45 16.563 12.245 -12.365
353 H GLN 46 HN GLN 46 13.403 13.151 -16.072
354 HA GLN 46 HA GLN 46 11.680 15.467 -15.788
355 HB2 GLN 46 1HB GLN 46 13.293 14.370 -18.098
356 HB3 GLN 46 2HB GLN 46 12.397 15.907 -18.147
357 HG2 GLN 46 1HG GLN 46 14.038 16.728 -16.155
358 HG3 GLN 46 2HG GLN 46 14.543 15.041 -16.415
359 HE21 GLN 46 2HE2 GLN 46 16.430 16.993 -16.504
360 HE22 GLN 46 1HE2 GLN 46 16.963 17.251 -18.133
361 H ARG 47 HN ARG 47 11.227 12.310 -17.065
362 HA ARG 47 HA ARG 47 8.711 13.228 -18.419
363 HB2 ARG 47 1HB ARG 47 10.312 10.755 -18.902
364 HB3 ARG 47 2HB ARG 47 8.736 11.148 -19.627
365 HG2 ARG 47 1HG ARG 47 11.215 12.861 -19.950
366 HG3 ARG 47 2HG ARG 47 10.740 11.584 -21.098
367 HD2 ARG 47 1HD ARG 47 8.611 12.770 -21.437
368 HD3 ARG 47 2HD ARG 47 9.232 14.084 -20.412
369 HE ARG 47 HE ARG 47 11.058 13.756 -22.639
370 HH11 ARG 47 1HH1 ARG 47 7.770 14.775 -22.080
371 HH12 ARG 47 2HH1 ARG 47 7.861 15.847 -23.463
372 HH21 ARG 47 1HH2 ARG 47 11.175 14.974 -24.230
373 HH22 ARG 47 2HH2 ARG 47 9.802 15.961 -24.691
374 H ALA 48 HN ALA 48 9.551 12.341 -15.505
375 HA ALA 48 HA ALA 48 8.144 9.901 -15.012
376 HB1 ALA 48 3HB ALA 48 8.789 12.187 -13.119
377 HB2 ALA 48 1HB ALA 48 8.277 10.552 -12.640
378 HB3 ALA 48 2HB ALA 48 9.833 10.790 -13.471
379 H ARG 49 HN ARG 49 6.078 9.482 -15.174
380 HA ARG 49 HA ARG 49 4.015 11.535 -14.975
381 HB2 ARG 49 1HB ARG 49 3.850 8.557 -14.991
382 HB3 ARG 49 2HB ARG 49 2.458 9.661 -14.917
383 HG2 ARG 49 1HG ARG 49 3.174 10.647 -17.083
384 HG3 ARG 49 2HG ARG 49 4.485 9.445 -17.164
385 HD2 ARG 49 1HD ARG 49 2.761 8.694 -18.548
386 HD3 ARG 49 2HD ARG 49 2.735 7.683 -17.086
387 HE ARG 49 HE ARG 49 0.701 9.793 -16.902
388 HH11 ARG 49 1HH1 ARG 49 1.339 6.731 -18.442
389 HH12 ARG 49 2HH1 ARG 49 -0.380 6.402 -18.517
390 HH21 ARG 49 1HH2 ARG 49 -1.272 9.436 -16.987
391 HH22 ARG 49 2HH2 ARG 49 -1.871 7.945 -17.688
392 HA PRO 50 HA PRO 50 3.154 11.953 -10.740
393 HB2 PRO 50 1HB PRO 50 0.352 10.922 -11.389
394 HB3 PRO 50 2HB PRO 50 0.810 12.373 -10.487
395 HG2 PRO 50 1HG PRO 50 -0.047 12.621 -12.995
396 HG3 PRO 50 2HG PRO 50 1.323 13.599 -12.452
397 HD2 PRO 50 1HD PRO 50 1.332 11.122 -14.210
398 HD3 PRO 50 2HD PRO 50 2.365 12.554 -14.302
399 H VAL 51 HN VAL 51 1.927 8.985 -12.256
400 HA VAL 51 HA VAL 51 2.127 7.496 -9.707
401 HB VAL 51 HB VAL 51 1.643 6.572 -12.570
402 HG11 VAL 51 1HG1 VAL 51 0.955 4.442 -11.520
403 HG12 VAL 51 2HG1 VAL 51 2.660 4.811 -11.165
404 HG13 VAL 51 3HG1 VAL 51 1.413 5.081 -9.924
405 HG21 VAL 51 3HG2 VAL 51 -0.158 7.964 -11.740
406 HG22 VAL 51 1HG2 VAL 51 -0.672 6.265 -11.853
407 HG23 VAL 51 2HG2 VAL 51 -0.273 6.970 -10.268
408 H LYS 52 HN LYS 52 4.036 7.866 -12.656
409 HA LYS 52 HA LYS 52 5.801 5.659 -12.089
410 HB2 LYS 52 1HB LYS 52 6.093 8.143 -13.778
411 HB3 LYS 52 2HB LYS 52 7.322 6.859 -13.688
412 HG2 LYS 52 1HG LYS 52 5.681 5.233 -14.551
413 HG3 LYS 52 2HG LYS 52 4.462 6.526 -14.655
414 HD2 LYS 52 1HD LYS 52 5.851 7.735 -16.269
415 HD3 LYS 52 2HD LYS 52 7.112 6.485 -16.139
416 HE2 LYS 52 1HE LYS 52 5.529 4.805 -16.995
417 HE3 LYS 52 2HE LYS 52 4.276 6.061 -17.136
418 HZ1 LYS 52 3HZ LYS 52 6.839 6.023 -18.599
419 HZ2 LYS 52 1HZ LYS 52 5.364 5.649 -19.237
420 HZ3 LYS 52 2HZ LYS 52 5.677 7.187 -18.729
421 H MET 53 HN MET 53 5.712 8.984 -11.015
422 HA MET 53 HA MET 53 8.386 9.208 -10.044
423 HB2 MET 53 1HB MET 53 5.768 10.352 -9.086
424 HB3 MET 53 2HB MET 53 7.345 10.777 -8.379
425 HG2 MET 53 1HG MET 53 8.093 11.683 -10.507
426 HG3 MET 53 2HG MET 53 6.577 11.174 -11.285
427 HE1 MET 53 3HE MET 53 6.336 13.686 -12.232
428 HE2 MET 53 1HE MET 53 6.345 15.130 -11.192
429 HE3 MET 53 2HE MET 53 7.828 14.164 -11.387
430 H ALA 54 HN ALA 54 5.448 8.043 -8.381
431 HA ALA 54 HA ALA 54 6.834 7.359 -5.963
432 HB1 ALA 54 3HB ALA 54 4.239 6.266 -7.104
433 HB2 ALA 54 1HB ALA 54 4.808 6.060 -5.431
434 HB3 ALA 54 2HB ALA 54 4.402 7.682 -6.039
435 H THR 55 HN THR 55 6.046 5.521 -8.893
436 HA THR 55 HA THR 55 6.898 2.965 -7.883
437 HB THR 55 HB THR 55 6.802 4.009 -10.745
438 HG1 THR 55 HG1 THR 55 4.802 2.821 -10.733
439 HG21 THR 55 3HG2 THR 55 6.971 1.169 -9.663
440 HG22 THR 55 1HG2 THR 55 6.776 1.620 -11.373
441 HG23 THR 55 2HG2 THR 55 8.274 2.039 -10.507
442 H LEU 56 HN LEU 56 8.608 5.471 -9.749
443 HA LEU 56 HA LEU 56 11.024 3.926 -10.031
444 HB2 LEU 56 1HB LEU 56 10.353 6.789 -10.092
445 HB3 LEU 56 2HB LEU 56 12.014 6.302 -10.502
446 HG LEU 56 HG LEU 56 9.496 5.461 -11.990
447 HD11 LEU 56 1HD1 LEU 56 10.382 6.922 -13.828
448 HD12 LEU 56 2HD1 LEU 56 10.065 7.862 -12.351
449 HD13 LEU 56 3HD1 LEU 56 11.732 7.403 -12.774
450 HD21 LEU 56 3HD2 LEU 56 11.223 3.760 -12.059
451 HD22 LEU 56 1HD2 LEU 56 11.064 4.527 -13.657
452 HD23 LEU 56 2HD2 LEU 56 12.424 4.959 -12.593
453 H LEU 57 HN LEU 57 9.913 6.247 -7.605
454 HA LEU 57 HA LEU 57 12.420 6.445 -6.212
455 HB2 LEU 57 1HB LEU 57 9.589 6.763 -5.500
456 HB3 LEU 57 2HB LEU 57 10.803 7.129 -4.253
457 HG LEU 57 HG LEU 57 10.562 8.519 -6.949
458 HD11 LEU 57 1HD1 LEU 57 9.784 10.489 -5.604
459 HD12 LEU 57 2HD1 LEU 57 8.685 9.102 -5.415
460 HD13 LEU 57 3HD1 LEU 57 9.856 9.494 -4.133
461 HD21 LEU 57 3HD2 LEU 57 12.844 8.443 -6.135
462 HD22 LEU 57 1HD2 LEU 57 12.214 10.103 -6.020
463 HD23 LEU 57 2HD2 LEU 57 12.334 9.093 -4.558
464 H VAL 58 HN VAL 58 9.608 4.311 -5.763
465 HA VAL 58 HA VAL 58 10.764 2.866 -3.513
466 HB VAL 58 HB VAL 58 8.592 2.129 -5.518
467 HG11 VAL 58 1HG1 VAL 58 8.031 0.308 -3.942
468 HG12 VAL 58 2HG1 VAL 58 9.675 0.107 -4.595
469 HG13 VAL 58 3HG1 VAL 58 9.442 0.735 -2.945
470 HG21 VAL 58 3HG2 VAL 58 8.009 4.006 -4.100
471 HG22 VAL 58 1HG2 VAL 58 7.069 2.561 -3.656
472 HG23 VAL 58 2HG2 VAL 58 8.446 3.070 -2.649
473 H THR 59 HN THR 59 10.961 2.495 -7.005
474 HA THR 59 HA THR 59 12.133 -0.161 -6.871
475 HB THR 59 HB THR 59 12.171 1.928 -9.090
476 HG1 THR 59 HG1 THR 59 10.511 0.535 -9.935
477 HG21 THR 59 3HG2 THR 59 12.850 -1.039 -9.139
478 HG22 THR 59 1HG2 THR 59 12.771 0.034 -10.557
479 HG23 THR 59 2HG2 THR 59 14.013 0.296 -9.308
480 H TYR 60 HN TYR 60 13.492 3.117 -7.238
481 HA TYR 60 HA TYR 60 16.174 1.926 -7.631
482 HB2 TYR 60 1HB TYR 60 14.973 4.665 -7.887
483 HB3 TYR 60 2HB TYR 60 16.738 4.450 -7.784
484 HD1 TYR 60 HD1 TYR 60 13.732 3.797 -9.834
485 HD2 TYR 60 HD2 TYR 60 17.981 3.500 -9.627
486 HE1 TYR 60 HE1 TYR 60 13.807 3.299 -12.259
487 HE2 TYR 60 HE2 TYR 60 18.074 3.001 -12.046
488 HH TYR 60 HH TYR 60 16.883 2.709 -13.965
489 H TYR 61 HN TYR 61 14.375 3.734 -5.213
490 HA TYR 61 HA TYR 61 16.853 3.855 -3.528
491 HB2 TYR 61 1HB TYR 61 14.257 5.396 -3.332
492 HB3 TYR 61 2HB TYR 61 15.656 5.557 -2.243
493 HD1 TYR 61 HD2 TYR 61 17.868 6.347 -3.263
494 HD2 TYR 61 HD1 TYR 61 14.143 6.674 -5.312
495 HE1 TYR 61 HE2 TYR 61 18.854 8.046 -4.761
496 HE2 TYR 61 HE1 TYR 61 15.115 8.380 -6.823
497 HH TYR 61 HH TYR 61 18.244 9.808 -6.285
498 H GLY 62 HN GLY 62 13.357 3.155 -3.359
499 HA2 GLY 62 1HA GLY 62 12.943 0.886 -2.277
500 HA3 GLY 62 2HA GLY 62 13.949 1.494 -0.941
501 H GLU 63 HN GLU 63 11.467 0.618 -0.331
502 HA GLU 63 HA GLU 63 9.339 2.522 -0.638
503 HB2 GLU 63 1HB GLU 63 9.841 0.333 1.380
504 HB3 GLU 63 2HB GLU 63 8.346 1.296 1.311
505 HG2 GLU 63 1HG GLU 63 7.863 0.380 -0.979
506 HG3 GLU 63 2HG GLU 63 9.467 -0.383 -0.893
507 H GLU 64 HN GLU 64 11.739 2.044 1.938
508 HA GLU 64 HA GLU 64 10.478 3.981 3.706
509 HB2 GLU 64 1HB GLU 64 13.208 2.691 3.664
510 HB3 GLU 64 2HB GLU 64 12.648 3.804 4.937
511 HG2 GLU 64 1HG GLU 64 10.834 2.165 5.555
512 HG3 GLU 64 2HG GLU 64 11.380 1.212 4.157
513 H TYR 65 HN TYR 65 13.360 4.063 1.607
514 HA TYR 65 HA TYR 65 14.046 6.781 2.312
515 HB2 TYR 65 1HB TYR 65 15.539 4.996 1.300
516 HB3 TYR 65 2HB TYR 65 14.728 5.339 -0.247
517 HD1 TYR 65 HD1 TYR 65 16.992 6.697 2.340
518 HD2 TYR 65 HD2 TYR 65 15.193 7.375 -1.466
519 HE1 TYR 65 HE1 TYR 65 18.553 8.580 1.946
520 HE2 TYR 65 HE2 TYR 65 16.743 9.256 -1.876
521 HH TYR 65 HH TYR 65 18.481 10.486 -1.068
522 H ALA 66 HN ALA 66 12.020 5.354 -0.198
523 HA ALA 66 HA ALA 66 11.661 7.692 -1.772
524 HB1 ALA 66 3HB ALA 66 9.708 5.431 -1.218
525 HB2 ALA 66 1HB ALA 66 9.581 6.615 -2.540
526 HB3 ALA 66 2HB ALA 66 10.938 5.464 -2.504
527 H VAL 67 HN VAL 67 9.919 6.545 1.108
528 HA VAL 67 HA VAL 67 7.982 8.724 1.113
529 HB VAL 67 HB VAL 67 8.945 6.836 3.300
530 HG11 VAL 67 1HG1 VAL 67 6.979 7.624 4.575
531 HG12 VAL 67 2HG1 VAL 67 8.116 8.957 4.262
532 HG13 VAL 67 3HG1 VAL 67 6.626 8.811 3.298
533 HG21 VAL 67 3HG2 VAL 67 7.767 5.721 1.500
534 HG22 VAL 67 1HG2 VAL 67 6.777 5.754 2.979
535 HG23 VAL 67 2HG2 VAL 67 6.418 6.875 1.644
536 H GLN 68 HN GLN 68 11.074 8.218 2.790
537 HA GLN 68 HA GLN 68 10.900 10.690 4.272
538 HB2 GLN 68 1HB GLN 68 13.224 8.938 3.455
539 HB3 GLN 68 2HB GLN 68 13.383 10.372 4.496
540 HG2 GLN 68 1HG GLN 68 11.785 9.078 6.249
541 HG3 GLN 68 2HG GLN 68 11.820 7.967 4.860
542 HE21 GLN 68 2HE2 GLN 68 12.513 7.284 7.536
543 HE22 GLN 68 1HE2 GLN 68 14.193 6.863 7.560
544 H LEU 69 HN LEU 69 12.471 9.818 1.201
545 HA LEU 69 HA LEU 69 13.601 12.420 0.731
546 HB2 LEU 69 1HB LEU 69 14.366 10.560 -0.335
547 HB3 LEU 69 2HB LEU 69 12.850 10.128 -1.160
548 HG LEU 69 HG LEU 69 13.010 12.310 -2.411
549 HD11 LEU 69 1HD1 LEU 69 15.263 13.412 -2.487
550 HD12 LEU 69 2HD1 LEU 69 14.572 13.462 -0.848
551 HD13 LEU 69 3HD1 LEU 69 15.842 12.278 -1.243
552 HD21 LEU 69 3HD2 LEU 69 13.633 10.211 -3.454
553 HD22 LEU 69 1HD2 LEU 69 14.719 11.509 -4.007
554 HD23 LEU 69 2HD2 LEU 69 15.281 10.337 -2.790
555 H THR 70 HN THR 70 10.583 10.929 -0.466
556 HA THR 70 HA THR 70 9.700 13.190 -1.957
557 HB THR 70 HB THR 70 8.056 11.068 -0.513
558 HG1 THR 70 HG1 THR 70 9.487 10.276 -2.151
559 HG21 THR 70 3HG2 THR 70 7.296 13.002 -2.737
560 HG22 THR 70 1HG2 THR 70 6.264 11.706 -2.088
561 HG23 THR 70 2HG2 THR 70 6.726 13.080 -1.053
562 H LEU 71 HN LEU 71 9.125 12.321 1.445
563 HA LEU 71 HA LEU 71 7.359 14.423 2.105
564 HB2 LEU 71 1HB LEU 71 7.989 12.545 3.418
565 HB3 LEU 71 2HB LEU 71 9.565 13.233 3.875
566 HG LEU 71 HG LEU 71 6.887 14.548 4.456
567 HD11 LEU 71 1HD1 LEU 71 7.247 13.799 6.823
568 HD12 LEU 71 2HD1 LEU 71 7.109 12.411 5.720
569 HD13 LEU 71 3HD1 LEU 71 8.708 12.925 6.308
570 HD21 LEU 71 3HD2 LEU 71 8.748 16.094 4.312
571 HD22 LEU 71 1HD2 LEU 71 8.209 15.950 6.002
572 HD23 LEU 71 2HD2 LEU 71 9.689 15.118 5.464
573 H GLN 72 HN GLN 72 10.925 14.433 2.159
574 HA GLN 72 HA GLN 72 11.121 17.151 3.090
575 HB2 GLN 72 1HB GLN 72 13.018 15.359 1.564
576 HB3 GLN 72 2HB GLN 72 13.445 16.989 2.141
577 HG2 GLN 72 1HG GLN 72 13.047 16.046 4.635
578 HG3 GLN 72 2HG GLN 72 12.555 14.670 3.620
579 HE21 GLN 72 2HE2 GLN 72 14.506 14.574 5.691
580 HE22 GLN 72 1HE2 GLN 72 16.035 14.204 4.966
581 H VAL 73 HN VAL 73 11.033 15.715 -0.146
582 HA VAL 73 HA VAL 73 11.543 18.216 -1.553
583 HB VAL 73 HB VAL 73 10.213 15.620 -2.433
584 HG11 VAL 73 1HG1 VAL 73 10.525 16.479 -4.730
585 HG12 VAL 73 2HG1 VAL 73 9.443 17.536 -3.792
586 HG13 VAL 73 3HG1 VAL 73 11.133 18.017 -4.072
587 HG21 VAL 73 3HG2 VAL 73 12.548 15.350 -1.844
588 HG22 VAL 73 1HG2 VAL 73 12.320 15.216 -3.604
589 HG23 VAL 73 2HG2 VAL 73 12.992 16.708 -2.904
590 H LEU 74 HN LEU 74 8.600 16.568 -0.487
591 HA LEU 74 HA LEU 74 6.736 18.258 -1.802
592 HB2 LEU 74 1HB LEU 74 6.791 16.807 0.748
593 HB3 LEU 74 2HB LEU 74 5.276 17.631 0.312
594 HG LEU 74 HG LEU 74 6.630 15.448 -1.319
595 HD11 LEU 74 1HD1 LEU 74 4.697 14.023 -0.590
596 HD12 LEU 74 2HD1 LEU 74 5.657 14.572 0.803
597 HD13 LEU 74 3HD1 LEU 74 4.110 15.364 0.420
598 HD21 LEU 74 3HD2 LEU 74 5.388 17.014 -2.691
599 HD22 LEU 74 1HD2 LEU 74 4.536 15.452 -2.630
600 HD23 LEU 74 2HD2 LEU 74 3.951 16.825 -1.658
601 H ARG 75 HN ARG 75 8.251 18.633 1.406
602 HA ARG 75 HA ARG 75 7.098 21.209 1.949
603 HB2 ARG 75 1HB ARG 75 8.064 19.857 3.662
604 HB3 ARG 75 2HB ARG 75 9.670 20.046 2.921
605 HG2 ARG 75 1HG ARG 75 9.650 22.427 3.372
606 HG3 ARG 75 2HG ARG 75 7.981 22.329 3.987
607 HD2 ARG 75 1HD ARG 75 8.716 21.008 5.845
608 HD3 ARG 75 2HD ARG 75 10.379 21.005 5.214
609 HE ARG 75 HE ARG 75 9.570 23.756 5.768
610 HH11 ARG 75 1HH1 ARG 75 10.424 20.821 7.447
611 HH12 ARG 75 2HH1 ARG 75 11.033 21.762 8.794
612 HH21 ARG 75 1HH2 ARG 75 10.257 24.847 7.306
613 HH22 ARG 75 2HH2 ARG 75 10.938 24.058 8.715
614 H ALA 76 HN ALA 76 9.975 20.207 0.161
615 HA ALA 76 HA ALA 76 11.088 22.839 -0.089
616 HB1 ALA 76 3HB ALA 76 11.404 20.408 -1.884
617 HB2 ALA 76 1HB ALA 76 12.432 21.859 -1.908
618 HB3 ALA 76 2HB ALA 76 12.411 20.808 -0.472
619 H ILE 77 HN ILE 77 8.513 21.190 -1.743
620 HA ILE 77 HA ILE 77 8.440 23.355 -3.827
621 HB ILE 77 HB ILE 77 6.974 21.834 -5.094
622 HG12 ILE 77 1HG1 ILE 77 7.419 19.827 -2.903
623 HG13 ILE 77 2HG1 ILE 77 5.961 20.831 -3.072
624 HG21 ILE 77 1HG2 ILE 77 8.600 20.043 -5.600
625 HG22 ILE 77 2HG2 ILE 77 9.415 21.613 -5.420
626 HG23 ILE 77 3HG2 ILE 77 9.483 20.420 -4.102
627 HD11 ILE 77 3HD1 ILE 77 6.981 18.820 -5.110
628 HD12 ILE 77 1HD1 ILE 77 5.604 18.581 -4.009
629 HD13 ILE 77 2HD1 ILE 77 5.522 19.825 -5.279
630 H ASN 78 HN ASN 78 7.480 23.384 -0.944
631 HA ASN 78 HA ASN 78 5.840 24.703 0.049
632 HB2 ASN 78 1HB ASN 78 4.905 25.477 -2.817
633 HB3 ASN 78 2HB ASN 78 4.422 25.879 -1.151
634 HD21 ASN 78 2HD2 ASN 78 5.625 27.422 -3.447
635 HD22 ASN 78 1HD2 ASN 78 6.986 28.237 -2.749
636 H GLN 79 HN GLN 79 5.473 21.902 -0.280
637 HA GLN 79 HA GLN 79 2.503 21.965 0.086
638 HB2 GLN 79 1HB GLN 79 4.179 19.759 -1.133
639 HB3 GLN 79 2HB GLN 79 2.470 19.604 -0.662
640 HG2 GLN 79 1HG GLN 79 3.441 21.442 -3.024
641 HG3 GLN 79 2HG GLN 79 2.742 19.813 -2.866
642 HE21 GLN 79 2HE2 GLN 79 1.804 22.447 -4.088
643 HE22 GLN 79 1HE2 GLN 79 0.220 22.679 -3.424
644 H ARG 80 HN ARG 80 3.426 22.543 2.264
645 HA ARG 80 HA ARG 80 4.660 20.485 3.862
646 HB2 ARG 80 1HB ARG 80 3.102 22.918 4.582
647 HB3 ARG 80 2HB ARG 80 3.755 21.772 5.776
648 HG2 ARG 80 1HG ARG 80 6.028 22.188 4.924
649 HG3 ARG 80 2HG ARG 80 5.368 23.346 3.744
650 HD2 ARG 80 1HD ARG 80 4.624 24.767 5.540
651 HD3 ARG 80 2HD ARG 80 5.247 23.602 6.732
652 HE ARG 80 HE ARG 80 7.491 24.486 5.141
653 HH11 ARG 80 1HH1 ARG 80 5.212 25.867 7.390
654 HH12 ARG 80 2HH1 ARG 80 6.415 27.034 7.901
655 HH21 ARG 80 1HH2 ARG 80 8.877 25.821 5.710
656 HH22 ARG 80 2HH2 ARG 80 8.505 27.010 6.944
657 H LEU 81 HN LEU 81 1.327 21.194 3.005
658 HA LEU 81 HA LEU 81 0.069 19.511 4.949
659 HB2 LEU 81 1HB LEU 81 -1.074 21.078 3.744
660 HB3 LEU 81 2HB LEU 81 -0.793 20.371 2.137
661 HG LEU 81 HG LEU 81 -2.074 18.341 2.893
662 HD11 LEU 81 1HD1 LEU 81 -3.562 18.614 4.894
663 HD12 LEU 81 2HD1 LEU 81 -1.844 18.713 5.348
664 HD13 LEU 81 3HD1 LEU 81 -2.816 20.198 5.213
665 HD21 LEU 81 3HD2 LEU 81 -3.105 20.021 1.482
666 HD22 LEU 81 1HD2 LEU 81 -4.299 19.384 2.638
667 HD23 LEU 81 2HD2 LEU 81 -3.561 20.982 2.909
668 H LEU 82 HN LEU 82 1.070 18.798 1.596
669 HA LEU 82 HA LEU 82 0.312 16.024 1.736
670 HB2 LEU 82 1HB LEU 82 2.203 17.598 0.128
671 HB3 LEU 82 2HB LEU 82 1.969 15.884 -0.287
672 HG LEU 82 HG LEU 82 -0.147 18.070 -0.358
673 HD11 LEU 82 1HD1 LEU 82 -0.119 17.646 -2.831
674 HD12 LEU 82 2HD1 LEU 82 1.476 18.179 -2.248
675 HD13 LEU 82 3HD1 LEU 82 1.184 16.458 -2.597
676 HD21 LEU 82 3HD2 LEU 82 -1.098 15.948 0.329
677 HD22 LEU 82 1HD2 LEU 82 -1.620 16.339 -1.326
678 HD23 LEU 82 2HD2 LEU 82 -0.343 15.126 -1.057
679 H ALA 83 HN ALA 83 3.289 17.748 2.520
680 HA ALA 83 HA ALA 83 4.914 15.439 2.946
681 HB1 ALA 83 3HB ALA 83 5.013 18.156 4.303
682 HB2 ALA 83 1HB ALA 83 6.304 16.932 4.329
683 HB3 ALA 83 2HB ALA 83 5.843 17.705 2.794
684 H GLU 84 HN GLU 84 2.788 17.261 5.149
685 HA GLU 84 HA GLU 84 3.304 15.575 7.440
686 HB2 GLU 84 1HB GLU 84 2.382 17.820 7.629
687 HB3 GLU 84 2HB GLU 84 0.932 17.309 6.730
688 HG2 GLU 84 1HG GLU 84 0.399 15.698 8.650
689 HG3 GLU 84 2HG GLU 84 1.873 16.351 9.400
690 H GLU 85 HN GLU 85 0.837 15.520 4.885
691 HA GLU 85 HA GLU 85 -0.691 13.368 6.045
692 HB2 GLU 85 1HB GLU 85 -0.403 14.422 3.233
693 HB3 GLU 85 2HB GLU 85 -1.500 13.089 3.672
694 HG2 GLU 85 1HG GLU 85 -1.696 15.982 4.710
695 HG3 GLU 85 2HG GLU 85 -2.679 15.132 3.497
696 H LEU 86 HN LEU 86 2.079 13.450 3.853
697 HA LEU 86 HA LEU 86 2.120 10.604 3.356
698 HB2 LEU 86 1HB LEU 86 3.186 12.140 2.013
699 HB3 LEU 86 2HB LEU 86 4.334 12.725 3.240
700 HG LEU 86 HG LEU 86 5.291 10.411 3.356
701 HD11 LEU 86 1HD1 LEU 86 4.769 8.848 1.465
702 HD12 LEU 86 2HD1 LEU 86 3.319 9.194 2.436
703 HD13 LEU 86 3HD1 LEU 86 3.554 10.001 0.867
704 HD21 LEU 86 3HD2 LEU 86 6.387 12.143 2.060
705 HD22 LEU 86 1HD2 LEU 86 6.559 10.572 1.241
706 HD23 LEU 86 2HD2 LEU 86 5.377 11.764 0.645
707 H HIS 87 HN HIS 87 3.742 12.657 5.775
708 HA HIS 87 HA HIS 87 5.059 10.551 7.175
709 HB2 HIS 87 1HB HIS 87 5.517 12.945 7.624
710 HB3 HIS 87 2HB HIS 87 3.874 13.136 8.281
711 HD1 HIS 87 HD1 HIS 87 7.075 11.195 8.986
712 HD2 HIS 87 HD2 HIS 87 3.740 12.719 11.064
713 HE1 HIS 87 HE1 HIS 87 7.477 10.718 11.349
714 H ARG 88 HN ARG 88 1.777 11.872 7.548
715 HA ARG 88 HA ARG 88 1.082 10.149 9.760
716 HB2 ARG 88 1HB ARG 88 -0.611 11.646 7.814
717 HB3 ARG 88 2HB ARG 88 -1.235 10.687 9.175
718 HG2 ARG 88 1HG ARG 88 -0.020 12.120 10.753
719 HG3 ARG 88 2HG ARG 88 0.624 13.075 9.394
720 HD2 ARG 88 1HD ARG 88 -1.684 13.687 8.809
721 HD3 ARG 88 2HD ARG 88 -2.234 12.845 10.277
722 HE ARG 88 HE ARG 88 -0.971 15.533 10.279
723 HH11 ARG 88 1HH1 ARG 88 -1.775 12.734 12.199
724 HH12 ARG 88 2HH1 ARG 88 -1.634 13.691 13.661
725 HH21 ARG 88 1HH2 ARG 88 -0.816 16.643 11.943
726 HH22 ARG 88 2HH2 ARG 88 -1.089 15.920 13.517
727 H ALA 89 HN ALA 89 0.870 9.803 6.253
728 HA ALA 89 HA ALA 89 -0.594 7.337 6.283
729 HB1 ALA 89 3HB ALA 89 1.414 8.390 4.261
730 HB2 ALA 89 1HB ALA 89 0.282 7.043 3.998
731 HB3 ALA 89 2HB ALA 89 -0.340 8.691 4.253
732 H ALA 90 HN ALA 90 2.867 8.085 6.469
733 HA ALA 90 HA ALA 90 3.750 5.353 6.424
734 HB1 ALA 90 3HB ALA 90 5.037 7.803 7.677
735 HB2 ALA 90 1HB ALA 90 5.841 6.247 7.375
736 HB3 ALA 90 2HB ALA 90 5.271 7.234 6.008
737 H ILE 91 HN ILE 91 2.659 7.498 9.011
738 HA ILE 91 HA ILE 91 3.256 5.686 11.192
739 HB ILE 91 HB ILE 91 1.190 7.907 10.875
740 HG12 ILE 91 1HG1 ILE 91 3.716 7.833 12.500
741 HG13 ILE 91 2HG1 ILE 91 3.602 8.490 10.851
742 HG21 ILE 91 1HG2 ILE 91 0.895 7.746 13.324
743 HG22 ILE 91 2HG2 ILE 91 0.412 6.234 12.521
744 HG23 ILE 91 3HG2 ILE 91 1.977 6.334 13.362
745 HD11 ILE 91 3HD1 ILE 91 2.063 9.489 13.273
746 HD12 ILE 91 1HD1 ILE 91 3.471 10.284 12.534
747 HD13 ILE 91 2HD1 ILE 91 1.948 10.146 11.623
748 H GLN 92 HN GLN 92 0.356 6.132 9.193
749 HA GLN 92 HA GLN 92 -1.129 4.059 10.561
750 HB2 GLN 92 1HB GLN 92 -1.374 5.305 7.818
751 HB3 GLN 92 2HB GLN 92 -2.513 4.102 8.465
752 HG2 GLN 92 1HG GLN 92 -3.102 5.907 10.378
753 HG3 GLN 92 2HG GLN 92 -1.773 6.699 9.499
754 HE21 GLN 92 2HE2 GLN 92 -4.286 7.890 9.960
755 HE22 GLN 92 1HE2 GLN 92 -5.084 8.095 8.436
756 H LEU 93 HN LEU 93 1.094 4.080 7.829
757 HA LEU 93 HA LEU 93 0.586 1.489 6.809
758 HB2 LEU 93 1HB LEU 93 1.944 3.115 5.833
759 HB3 LEU 93 2HB LEU 93 3.254 2.989 7.029
760 HG LEU 93 HG LEU 93 3.452 0.540 6.357
761 HD11 LEU 93 1HD1 LEU 93 2.583 -0.035 4.075
762 HD12 LEU 93 2HD1 LEU 93 1.255 0.367 5.190
763 HD13 LEU 93 3HD1 LEU 93 1.801 1.561 3.988
764 HD21 LEU 93 3HD2 LEU 93 5.081 2.203 5.681
765 HD22 LEU 93 1HD2 LEU 93 4.816 1.042 4.359
766 HD23 LEU 93 2HD2 LEU 93 4.077 2.662 4.284
Start of MODEL 8
1 H THR 4 1H THR 4 -0.377 -0.603 1.028
2 HA THR 4 HA THR 4 1.970 -0.186 2.605
3 HB THR 4 HB THR 4 3.243 -0.613 0.586
4 HG1 THR 4 HG1 THR 4 0.774 -0.092 -0.757
5 HG21 THR 4 3HG2 THR 4 0.654 -2.215 0.550
6 HG22 THR 4 1HG2 THR 4 2.192 -2.707 -0.196
7 HG23 THR 4 2HG2 THR 4 2.071 -2.553 1.572
8 HA PRO 5 HA PRO 5 3.163 3.997 2.261
9 HB2 PRO 5 1HB PRO 5 5.760 3.036 0.999
10 HB3 PRO 5 2HB PRO 5 5.539 4.072 2.416
11 HG2 PRO 5 1HG PRO 5 6.275 1.532 2.757
12 HG3 PRO 5 2HG PRO 5 5.084 2.245 3.853
13 HD2 PRO 5 1HD PRO 5 4.624 0.344 1.517
14 HD3 PRO 5 2HD PRO 5 3.836 0.367 3.100
15 H SER 6 HN SER 6 3.516 1.913 -0.538
16 HA SER 6 HA SER 6 3.968 4.052 -2.489
17 HB2 SER 6 1HB SER 6 3.797 2.483 -4.096
18 HB3 SER 6 2HB SER 6 4.696 1.769 -2.738
19 HG SER 6 HG SER 6 2.718 0.742 -2.134
20 H ASP 7 HN ASP 7 1.181 2.657 -0.885
21 HA ASP 7 HA ASP 7 -0.747 3.602 -2.890
22 HB2 ASP 7 1HB ASP 7 -1.208 2.541 -0.036
23 HB3 ASP 7 2HB ASP 7 -2.366 3.050 -1.289
24 H HIS 8 HN HIS 8 0.523 4.721 0.215
25 HA HIS 8 HA HIS 8 -1.155 7.132 0.164
26 HB2 HIS 8 1HB HIS 8 1.246 6.330 1.869
27 HB3 HIS 8 2HB HIS 8 0.322 7.837 2.075
28 HD1 HIS 8 HD1 HIS 8 -2.288 7.489 2.681
29 HD2 HIS 8 HD2 HIS 8 0.163 4.110 3.257
30 HE1 HIS 8 HE1 HIS 8 -3.497 6.036 4.229
31 H LEU 9 HN LEU 9 1.986 6.160 -1.006
32 HA LEU 9 HA LEU 9 3.048 8.782 -1.488
33 HB2 LEU 9 1HB LEU 9 4.390 6.969 -1.511
34 HB3 LEU 9 2HB LEU 9 3.557 6.061 -2.794
35 HG LEU 9 HG LEU 9 4.186 7.885 -4.398
36 HD11 LEU 9 1HD1 LEU 9 6.032 9.437 -3.709
37 HD12 LEU 9 2HD1 LEU 9 4.578 9.681 -2.713
38 HD13 LEU 9 3HD1 LEU 9 5.961 8.767 -2.063
39 HD21 LEU 9 3HD2 LEU 9 5.444 5.815 -4.311
40 HD22 LEU 9 1HD2 LEU 9 6.540 7.177 -4.638
41 HD23 LEU 9 2HD2 LEU 9 6.472 6.460 -3.010
42 H LEU 10 HN LEU 10 1.287 6.569 -3.676
43 HA LEU 10 HA LEU 10 1.249 8.459 -5.850
44 HB2 LEU 10 1HB LEU 10 -0.359 6.114 -5.100
45 HB3 LEU 10 2HB LEU 10 -0.646 6.869 -6.684
46 HG LEU 10 HG LEU 10 1.951 5.587 -5.747
47 HD11 LEU 10 1HD1 LEU 10 1.444 3.875 -7.511
48 HD12 LEU 10 2HD1 LEU 10 0.166 3.927 -6.275
49 HD13 LEU 10 3HD1 LEU 10 -0.091 4.706 -7.854
50 HD21 LEU 10 3HD2 LEU 10 2.358 7.469 -7.220
51 HD22 LEU 10 1HD2 LEU 10 2.721 5.946 -8.066
52 HD23 LEU 10 2HD2 LEU 10 1.210 6.820 -8.415
53 H SER 11 HN SER 11 -0.950 7.823 -3.171
54 HA SER 11 HA SER 11 -3.175 9.463 -4.018
55 HB2 SER 11 1HB SER 11 -3.378 7.865 -2.333
56 HB3 SER 11 2HB SER 11 -2.246 8.765 -1.299
57 HG SER 11 HG SER 11 -4.439 9.241 -0.839
58 H THR 12 HN THR 12 -0.226 10.144 -2.095
59 HA THR 12 HA THR 12 -0.877 12.895 -1.547
60 HB THR 12 HB THR 12 1.820 11.481 -1.664
61 HG1 THR 12 HG1 THR 12 0.080 12.157 0.506
62 HG21 THR 12 3HG2 THR 12 1.048 14.176 -0.477
63 HG22 THR 12 1HG2 THR 12 2.639 13.393 -0.332
64 HG23 THR 12 2HG2 THR 12 2.052 13.928 -1.925
65 H LEU 13 HN LEU 13 1.019 11.357 -4.129
66 HA LEU 13 HA LEU 13 1.732 13.911 -5.338
67 HB2 LEU 13 1HB LEU 13 1.729 11.098 -6.203
68 HB3 LEU 13 2HB LEU 13 2.397 12.328 -7.301
69 HG LEU 13 HG LEU 13 3.448 11.589 -4.542
70 HD11 LEU 13 1HD1 LEU 13 5.465 10.814 -5.818
71 HD12 LEU 13 2HD1 LEU 13 4.005 9.931 -6.319
72 HD13 LEU 13 3HD1 LEU 13 4.648 11.240 -7.339
73 HD21 LEU 13 3HD2 LEU 13 3.689 13.966 -4.954
74 HD22 LEU 13 1HD2 LEU 13 5.282 13.172 -5.025
75 HD23 LEU 13 2HD2 LEU 13 4.453 13.646 -6.529
76 H GLU 14 HN GLU 14 -0.947 11.686 -5.618
77 HA GLU 14 HA GLU 14 -2.106 12.888 -7.982
78 HB2 GLU 14 1HB GLU 14 -2.762 10.697 -7.081
79 HB3 GLU 14 2HB GLU 14 -3.422 11.505 -5.639
80 HG2 GLU 14 1HG GLU 14 -5.136 12.657 -7.103
81 HG3 GLU 14 2HG GLU 14 -4.309 11.876 -8.470
82 H GLU 15 HN GLU 15 -2.364 13.578 -4.511
83 HA GLU 15 HA GLU 15 -4.280 15.739 -4.894
84 HB2 GLU 15 1HB GLU 15 -2.442 14.969 -2.627
85 HB3 GLU 15 2HB GLU 15 -3.569 16.346 -2.566
86 HG2 GLU 15 1HG GLU 15 -4.376 13.387 -2.841
87 HG3 GLU 15 2HG GLU 15 -4.458 14.470 -1.433
88 H LEU 16 HN LEU 16 -0.799 15.459 -4.981
89 HA LEU 16 HA LEU 16 -0.116 18.198 -4.624
90 HB2 LEU 16 1HB LEU 16 1.406 16.474 -4.598
91 HB3 LEU 16 2HB LEU 16 1.220 16.009 -6.305
92 HG LEU 16 HG LEU 16 2.063 18.269 -6.959
93 HD11 LEU 16 1HD1 LEU 16 3.239 19.630 -5.209
94 HD12 LEU 16 2HD1 LEU 16 1.508 19.456 -4.837
95 HD13 LEU 16 3HD1 LEU 16 2.708 18.468 -3.971
96 HD21 LEU 16 3HD2 LEU 16 3.555 16.358 -6.950
97 HD22 LEU 16 1HD2 LEU 16 4.436 17.818 -6.439
98 HD23 LEU 16 2HD2 LEU 16 3.922 16.616 -5.228
99 H VAL 17 HN VAL 17 -0.492 19.957 -5.695
100 HA VAL 17 HA VAL 17 -2.096 19.983 -8.100
101 HB VAL 17 HB VAL 17 -0.352 22.159 -6.870
102 HG11 VAL 17 1HG1 VAL 17 -1.751 23.703 -8.201
103 HG12 VAL 17 2HG1 VAL 17 -0.861 22.577 -9.252
104 HG13 VAL 17 3HG1 VAL 17 -2.591 22.314 -8.929
105 HG21 VAL 17 3HG2 VAL 17 -2.058 21.383 -5.334
106 HG22 VAL 17 1HG2 VAL 17 -2.443 23.012 -5.936
107 HG23 VAL 17 2HG2 VAL 17 -3.308 21.598 -6.583
108 HA PRO 18 HA PRO 18 0.699 18.809 -11.161
109 HB2 PRO 18 1HB PRO 18 -1.027 20.720 -12.817
110 HB3 PRO 18 2HB PRO 18 -0.519 19.073 -13.213
111 HG2 PRO 18 1HG PRO 18 -3.009 19.498 -12.370
112 HG3 PRO 18 2HG PRO 18 -2.127 18.083 -11.779
113 HD2 PRO 18 1HD PRO 18 -2.742 20.677 -10.337
114 HD3 PRO 18 2HD PRO 18 -2.624 19.040 -9.680
115 H TYR 19 HN TYR 19 -0.166 22.235 -10.819
116 HA TYR 19 HA TYR 19 2.039 23.348 -12.202
117 HB2 TYR 19 1HB TYR 19 0.218 24.697 -11.382
118 HB3 TYR 19 2HB TYR 19 0.616 24.270 -9.701
119 HD1 TYR 19 HD1 TYR 19 2.075 25.937 -12.721
120 HD2 TYR 19 HD2 TYR 19 2.031 25.668 -8.466
121 HE1 TYR 19 HE1 TYR 19 3.590 27.893 -12.589
122 HE2 TYR 19 HE2 TYR 19 3.542 27.618 -8.316
123 HH TYR 19 HH TYR 19 4.704 29.330 -11.228
124 H ASP 20 HN ASP 20 1.835 22.383 -8.770
125 HA ASP 20 HA ASP 20 4.723 22.893 -8.429
126 HB2 ASP 20 1HB ASP 20 2.559 21.858 -6.505
127 HB3 ASP 20 2HB ASP 20 4.322 21.902 -6.262
128 H PHE 21 HN PHE 21 2.710 20.296 -9.393
129 HA PHE 21 HA PHE 21 4.495 18.143 -8.588
130 HB2 PHE 21 1HB PHE 21 1.964 18.034 -9.274
131 HB3 PHE 21 2HB PHE 21 2.596 17.982 -10.935
132 HD1 PHE 21 HD1 PHE 21 5.109 16.477 -9.250
133 HD2 PHE 21 HD2 PHE 21 1.010 15.814 -10.252
134 HE1 PHE 21 HE1 PHE 21 5.455 14.037 -9.045
135 HE2 PHE 21 HE2 PHE 21 1.351 13.374 -10.046
136 HZ PHE 21 HZ PHE 21 3.575 12.486 -9.444
137 H GLU 22 HN GLU 22 4.226 20.234 -11.418
138 HA GLU 22 HA GLU 22 6.357 18.949 -12.900
139 HB2 GLU 22 1HB GLU 22 5.267 21.763 -12.868
140 HB3 GLU 22 2HB GLU 22 6.557 21.213 -13.965
141 HG2 GLU 22 1HG GLU 22 3.666 20.154 -13.930
142 HG3 GLU 22 2HG GLU 22 4.468 21.256 -15.072
143 H LYS 23 HN LYS 23 6.273 21.431 -10.380
144 HA LYS 23 HA LYS 23 9.139 21.918 -10.460
145 HB2 LYS 23 1HB LYS 23 7.044 22.385 -8.336
146 HB3 LYS 23 2HB LYS 23 8.741 22.907 -8.214
147 HG2 LYS 23 1HG LYS 23 8.440 24.330 -10.208
148 HG3 LYS 23 2HG LYS 23 6.738 23.820 -10.307
149 HD2 LYS 23 1HD LYS 23 6.348 24.767 -8.048
150 HD3 LYS 23 2HD LYS 23 8.037 25.328 -8.012
151 HE2 LYS 23 1HE LYS 23 7.614 26.709 -10.007
152 HE3 LYS 23 2HE LYS 23 5.923 26.158 -10.026
153 HZ1 LYS 23 3HZ LYS 23 7.200 27.696 -7.856
154 HZ2 LYS 23 1HZ LYS 23 6.147 28.303 -8.971
155 HZ3 LYS 23 2HZ LYS 23 5.632 27.185 -7.873
156 H PHE 24 HN PHE 24 7.059 19.597 -8.845
157 HA PHE 24 HA PHE 24 8.916 18.513 -6.993
158 HB2 PHE 24 1HB PHE 24 6.531 17.821 -7.125
159 HB3 PHE 24 2HB PHE 24 6.860 17.021 -8.678
160 HD1 PHE 24 HD2 PHE 24 8.113 14.970 -8.784
161 HD2 PHE 24 HD1 PHE 24 7.269 16.876 -5.055
162 HE1 PHE 24 HE2 PHE 24 8.706 12.888 -7.589
163 HE2 PHE 24 HE1 PHE 24 7.864 14.797 -3.856
164 HZ PHE 24 HZ PHE 24 8.582 12.804 -5.124
165 H LYS 25 HN LYS 25 8.398 17.589 -10.408
166 HA LYS 25 HA LYS 25 10.582 15.769 -10.585
167 HB2 LYS 25 1HB LYS 25 8.885 15.956 -12.298
168 HB3 LYS 25 2HB LYS 25 9.393 17.625 -12.650
169 HG2 LYS 25 1HG LYS 25 11.580 16.801 -13.420
170 HG3 LYS 25 2HG LYS 25 11.075 15.131 -13.066
171 HD2 LYS 25 1HD LYS 25 9.441 16.872 -14.906
172 HD3 LYS 25 2HD LYS 25 10.891 16.036 -15.510
173 HE2 LYS 25 1HE LYS 25 9.928 13.895 -14.602
174 HE3 LYS 25 2HE LYS 25 8.430 14.789 -14.254
175 HZ1 LYS 25 3HZ LYS 25 9.648 14.457 -16.921
176 HZ2 LYS 25 1HZ LYS 25 8.318 13.654 -16.367
177 HZ3 LYS 25 2HZ LYS 25 8.259 15.286 -16.598
178 H PHE 26 HN PHE 26 10.485 19.285 -11.157
179 HA PHE 26 HA PHE 26 13.182 19.579 -11.998
180 HB2 PHE 26 1HB PHE 26 11.497 21.392 -12.164
181 HB3 PHE 26 2HB PHE 26 11.476 21.530 -10.391
182 HD1 PHE 26 HD1 PHE 26 13.592 21.936 -13.400
183 HD2 PHE 26 HD2 PHE 26 13.050 22.808 -9.253
184 HE1 PHE 26 HE1 PHE 26 15.433 23.582 -13.508
185 HE2 PHE 26 HE2 PHE 26 14.889 24.457 -9.358
186 HZ PHE 26 HZ PHE 26 16.082 24.843 -11.486
187 H LYS 27 HN LYS 27 11.806 19.593 -8.717
188 HA LYS 27 HA LYS 27 14.427 20.176 -7.528
189 HB2 LYS 27 1HB LYS 27 11.733 19.444 -6.378
190 HB3 LYS 27 2HB LYS 27 13.185 19.752 -5.395
191 HG2 LYS 27 1HG LYS 27 11.886 21.746 -7.284
192 HG3 LYS 27 2HG LYS 27 11.668 21.717 -5.518
193 HD2 LYS 27 1HD LYS 27 14.112 22.026 -5.235
194 HD3 LYS 27 2HD LYS 27 14.287 22.122 -7.003
195 HE2 LYS 27 1HE LYS 27 12.841 24.096 -7.055
196 HE3 LYS 27 2HE LYS 27 12.613 23.989 -5.295
197 HZ1 LYS 27 3HZ LYS 27 15.180 24.472 -6.663
198 HZ2 LYS 27 1HZ LYS 27 14.284 25.612 -5.879
199 HZ3 LYS 27 2HZ LYS 27 14.969 24.373 -5.030
200 H LEU 28 HN LEU 28 12.452 17.344 -8.158
201 HA LEU 28 HA LEU 28 13.830 15.468 -6.528
202 HB2 LEU 28 1HB LEU 28 11.856 15.021 -7.613
203 HB3 LEU 28 2HB LEU 28 12.497 15.131 -9.269
204 HG LEU 28 HG LEU 28 14.015 13.194 -8.715
205 HD11 LEU 28 1HD1 LEU 28 13.366 11.777 -6.748
206 HD12 LEU 28 2HD1 LEU 28 13.895 13.395 -6.232
207 HD13 LEU 28 3HD1 LEU 28 12.160 12.999 -6.285
208 HD21 LEU 28 3HD2 LEU 28 12.000 12.884 -10.026
209 HD22 LEU 28 1HD2 LEU 28 12.255 11.479 -8.963
210 HD23 LEU 28 2HD2 LEU 28 11.029 12.701 -8.546
211 H GLN 29 HN GLN 29 14.634 16.736 -9.740
212 HA GLN 29 HA GLN 29 16.952 15.064 -10.115
213 HB2 GLN 29 1HB GLN 29 16.194 17.785 -11.195
214 HB3 GLN 29 2HB GLN 29 17.636 16.876 -11.706
215 HG2 GLN 29 1HG GLN 29 15.953 15.005 -12.649
216 HG3 GLN 29 2HG GLN 29 14.847 16.122 -11.818
217 HE21 GLN 29 2HE2 GLN 29 14.450 15.375 -14.460
218 HE22 GLN 29 1HE2 GLN 29 14.727 16.740 -15.491
219 H ASN 30 HN ASN 30 16.371 17.936 -8.248
220 HA ASN 30 HA ASN 30 19.313 18.310 -7.860
221 HB2 ASN 30 1HB ASN 30 17.090 20.334 -7.062
222 HB3 ASN 30 2HB ASN 30 18.849 20.176 -6.842
223 HD21 ASN 30 2HD2 ASN 30 16.323 21.167 -8.885
224 HD22 ASN 30 1HD2 ASN 30 17.279 21.622 -10.256
225 H THR 31 HN THR 31 17.228 16.315 -6.618
226 HA THR 31 HA THR 31 18.043 16.845 -3.778
227 HB THR 31 HB THR 31 15.677 15.243 -4.838
228 HG1 THR 31 HG1 THR 31 15.811 17.730 -3.427
229 HG21 THR 31 3HG2 THR 31 16.538 15.907 -1.995
230 HG22 THR 31 1HG2 THR 31 15.043 15.060 -2.457
231 HG23 THR 31 2HG2 THR 31 16.627 14.303 -2.759
232 H SER 32 HN SER 32 19.125 15.394 -2.647
233 HA SER 32 HA SER 32 20.481 13.199 -4.084
234 HB2 SER 32 1HB SER 32 21.709 12.883 -2.193
235 HB3 SER 32 2HB SER 32 21.605 14.623 -2.542
236 HG SER 32 HG SER 32 21.312 14.143 -0.322
237 H VAL 33 HN VAL 33 20.563 11.026 -3.166
238 HA VAL 33 HA VAL 33 17.952 10.146 -1.940
239 HB VAL 33 HB VAL 33 18.062 8.123 -3.325
240 HG11 VAL 33 1HG1 VAL 33 17.522 9.127 -5.518
241 HG12 VAL 33 2HG1 VAL 33 16.787 10.055 -4.190
242 HG13 VAL 33 3HG1 VAL 33 18.254 10.662 -4.996
243 HG21 VAL 33 3HG2 VAL 33 20.465 7.974 -3.594
244 HG22 VAL 33 1HG2 VAL 33 19.648 7.924 -5.174
245 HG23 VAL 33 2HG2 VAL 33 20.456 9.416 -4.638
246 H GLN 34 HN GLN 34 18.126 7.800 -1.233
247 HA GLN 34 HA GLN 34 20.027 7.615 0.876
248 HB2 GLN 34 1HB GLN 34 17.899 6.345 0.690
249 HB3 GLN 34 2HB GLN 34 18.640 5.367 -0.599
250 HG2 GLN 34 1HG GLN 34 19.034 3.956 1.515
251 HG3 GLN 34 2HG GLN 34 20.395 4.930 0.914
252 HE21 GLN 34 2HE2 GLN 34 21.298 4.693 3.057
253 HE22 GLN 34 1HE2 GLN 34 20.753 5.720 4.341
254 H LYS 35 HN LYS 35 22.024 6.904 1.093
255 HA LYS 35 HA LYS 35 23.626 6.935 -1.308
256 HB2 LYS 35 1HB LYS 35 24.269 6.227 1.557
257 HB3 LYS 35 2HB LYS 35 25.476 6.347 0.255
258 HG2 LYS 35 1HG LYS 35 24.920 8.719 -0.056
259 HG3 LYS 35 2HG LYS 35 23.692 8.604 1.227
260 HD2 LYS 35 1HD LYS 35 25.433 8.035 2.861
261 HD3 LYS 35 2HD LYS 35 26.668 8.114 1.582
262 HE2 LYS 35 1HE LYS 35 26.153 10.486 1.220
263 HE3 LYS 35 2HE LYS 35 24.903 10.412 2.483
264 HZ1 LYS 35 3HZ LYS 35 27.788 9.958 2.900
265 HZ2 LYS 35 1HZ LYS 35 26.962 11.321 3.322
266 HZ3 LYS 35 2HZ LYS 35 26.629 9.889 4.072
267 H GLU 36 HN GLU 36 21.989 4.423 0.349
268 HA GLU 36 HA GLU 36 23.681 2.206 -0.288
269 HB2 GLU 36 1HB GLU 36 20.688 2.445 0.033
270 HB3 GLU 36 2HB GLU 36 21.544 0.901 -0.194
271 HG2 GLU 36 1HG GLU 36 22.787 1.300 1.975
272 HG3 GLU 36 2HG GLU 36 21.946 2.867 2.021
273 H HIS 37 HN HIS 37 21.466 4.078 -2.238
274 HA HIS 37 HA HIS 37 22.112 2.281 -4.548
275 HB2 HIS 37 1HB HIS 37 19.445 3.655 -3.984
276 HB3 HIS 37 2HB HIS 37 19.843 2.700 -5.431
277 HD1 HIS 37 HD1 HIS 37 20.306 0.100 -5.005
278 HD2 HIS 37 HD2 HIS 37 18.496 2.122 -1.782
279 HE1 HIS 37 HE1 HIS 37 19.291 -1.629 -3.610
280 H SER 38 HN SER 38 22.449 3.192 -6.517
281 HA SER 38 HA SER 38 23.501 5.892 -6.660
282 HB2 SER 38 1HB SER 38 24.328 4.232 -8.033
283 HB3 SER 38 2HB SER 38 22.735 3.980 -8.781
284 HG SER 38 HG SER 38 22.844 6.153 -9.501
285 H ARG 39 HN ARG 39 22.577 7.772 -7.257
286 HA ARG 39 HA ARG 39 19.726 8.111 -7.153
287 HB2 ARG 39 1HB ARG 39 21.334 9.834 -6.583
288 HB3 ARG 39 2HB ARG 39 21.747 9.980 -8.307
289 HG2 ARG 39 1HG ARG 39 19.605 10.828 -8.857
290 HG3 ARG 39 2HG ARG 39 18.928 10.348 -7.281
291 HD2 ARG 39 1HD ARG 39 19.149 12.656 -7.219
292 HD3 ARG 39 2HD ARG 39 20.500 12.010 -6.257
293 HE ARG 39 HE ARG 39 21.682 12.570 -8.755
294 HH11 ARG 39 1HH1 ARG 39 19.713 14.473 -6.598
295 HH12 ARG 39 2HH1 ARG 39 20.535 15.930 -7.123
296 HH21 ARG 39 1HH2 ARG 39 22.626 14.229 -9.375
297 HH22 ARG 39 2HH2 ARG 39 22.195 15.792 -8.708
298 H ILE 40 HN ILE 40 18.165 8.063 -8.585
299 HA ILE 40 HA ILE 40 18.446 6.952 -11.190
300 HB ILE 40 HB ILE 40 16.344 8.882 -10.105
301 HG12 ILE 40 1HG1 ILE 40 16.250 5.895 -10.436
302 HG13 ILE 40 2HG1 ILE 40 16.605 6.746 -8.914
303 HG21 ILE 40 1HG2 ILE 40 14.942 8.083 -11.977
304 HG22 ILE 40 2HG2 ILE 40 16.408 8.894 -12.576
305 HG23 ILE 40 3HG2 ILE 40 16.307 7.117 -12.588
306 HD11 ILE 40 3HD1 ILE 40 14.028 6.957 -10.511
307 HD12 ILE 40 1HD1 ILE 40 14.248 6.033 -9.007
308 HD13 ILE 40 2HD1 ILE 40 14.382 7.808 -8.989
309 HA PRO 41 HA PRO 41 20.590 10.033 -13.438
310 HB2 PRO 41 1HB PRO 41 19.221 8.556 -15.725
311 HB3 PRO 41 2HB PRO 41 20.931 8.973 -15.548
312 HG2 PRO 41 1HG PRO 41 20.157 6.455 -15.154
313 HG3 PRO 41 2HG PRO 41 21.362 7.169 -14.074
314 HD2 PRO 41 1HD PRO 41 18.401 6.682 -13.564
315 HD3 PRO 41 2HD PRO 41 19.764 6.500 -12.452
316 H ARG 42 HN ARG 42 20.162 11.940 -14.247
317 HA ARG 42 HA ARG 42 17.484 12.965 -13.954
318 HB2 ARG 42 1HB ARG 42 19.951 14.130 -15.147
319 HB3 ARG 42 2HB ARG 42 18.385 14.973 -15.083
320 HG2 ARG 42 1HG ARG 42 18.389 14.877 -12.655
321 HG3 ARG 42 2HG ARG 42 19.893 13.923 -12.669
322 HD2 ARG 42 1HD ARG 42 21.131 15.762 -13.477
323 HD3 ARG 42 2HD ARG 42 19.651 16.714 -13.739
324 HE ARG 42 HE ARG 42 19.754 16.284 -10.927
325 HH11 ARG 42 1HH1 ARG 42 21.929 17.676 -13.271
326 HH12 ARG 42 2HH1 ARG 42 22.557 18.764 -12.050
327 HH21 ARG 42 1HH2 ARG 42 20.470 17.518 -9.516
328 HH22 ARG 42 2HH2 ARG 42 21.727 18.676 -9.908
329 H SER 43 HN SER 43 19.283 11.698 -16.687
330 HA SER 43 HA SER 43 17.530 12.542 -18.829
331 HB2 SER 43 1HB SER 43 18.493 10.918 -20.114
332 HB3 SER 43 2HB SER 43 19.740 11.735 -19.144
333 HG SER 43 HG SER 43 20.002 9.461 -19.192
334 H GLN 44 HN GLN 44 17.358 9.999 -16.379
335 HA GLN 44 HA GLN 44 15.064 8.686 -17.692
336 HB2 GLN 44 1HB GLN 44 16.345 8.329 -14.973
337 HB3 GLN 44 2HB GLN 44 15.016 7.339 -15.618
338 HG2 GLN 44 1HG GLN 44 17.959 7.263 -16.713
339 HG3 GLN 44 2HG GLN 44 16.881 6.223 -15.752
340 HE21 GLN 44 2HE2 GLN 44 18.100 6.816 -18.797
341 HE22 GLN 44 1HE2 GLN 44 16.899 6.006 -19.746
342 H ILE 45 HN ILE 45 15.660 10.851 -14.952
343 HA ILE 45 HA ILE 45 12.915 10.875 -14.021
344 HB ILE 45 HB ILE 45 15.191 12.886 -13.727
345 HG12 ILE 45 1HG1 ILE 45 14.016 10.996 -11.710
346 HG13 ILE 45 2HG1 ILE 45 15.445 10.639 -12.706
347 HG21 ILE 45 1HG2 ILE 45 13.807 13.918 -11.958
348 HG22 ILE 45 2HG2 ILE 45 12.998 14.010 -13.540
349 HG23 ILE 45 3HG2 ILE 45 12.479 12.799 -12.344
350 HD11 ILE 45 3HD1 ILE 45 15.185 12.928 -10.724
351 HD12 ILE 45 1HD1 ILE 45 16.097 11.424 -10.464
352 HD13 ILE 45 2HD1 ILE 45 16.614 12.572 -11.721
353 H GLN 46 HN GLN 46 14.676 12.887 -16.342
354 HA GLN 46 HA GLN 46 12.675 14.911 -16.540
355 HB2 GLN 46 1HB GLN 46 15.022 15.045 -17.374
356 HB3 GLN 46 2HB GLN 46 14.566 13.936 -18.689
357 HG2 GLN 46 1HG GLN 46 14.300 16.280 -19.733
358 HG3 GLN 46 2HG GLN 46 12.832 15.424 -19.208
359 HE21 GLN 46 2HE2 GLN 46 11.636 17.336 -19.047
360 HE22 GLN 46 1HE2 GLN 46 11.898 18.483 -17.776
361 H ARG 47 HN ARG 47 13.036 11.821 -18.215
362 HA ARG 47 HA ARG 47 10.695 12.481 -19.934
363 HB2 ARG 47 1HB ARG 47 12.648 10.229 -20.033
364 HB3 ARG 47 2HB ARG 47 11.208 10.386 -21.066
365 HG2 ARG 47 1HG ARG 47 12.093 12.502 -21.964
366 HG3 ARG 47 2HG ARG 47 13.539 12.324 -20.943
367 HD2 ARG 47 1HD ARG 47 14.190 10.365 -22.137
368 HD3 ARG 47 2HD ARG 47 12.693 10.416 -23.098
369 HE ARG 47 HE ARG 47 15.081 12.108 -23.641
370 HH11 ARG 47 1HH1 ARG 47 11.677 11.636 -24.235
371 HH12 ARG 47 2HH1 ARG 47 11.780 12.648 -25.662
372 HH21 ARG 47 1HH2 ARG 47 15.216 13.263 -25.278
373 HH22 ARG 47 2HH2 ARG 47 13.797 13.576 -26.258
374 H ALA 48 HN ALA 48 11.348 11.012 -16.980
375 HA ALA 48 HA ALA 48 9.425 8.877 -17.061
376 HB1 ALA 48 3HB ALA 48 10.462 10.489 -14.704
377 HB2 ALA 48 1HB ALA 48 9.566 8.956 -14.601
378 HB3 ALA 48 2HB ALA 48 11.180 8.996 -15.350
379 H ARG 49 HN ARG 49 7.317 8.743 -16.479
380 HA ARG 49 HA ARG 49 5.696 11.157 -16.630
381 HB2 ARG 49 1HB ARG 49 5.000 8.341 -15.940
382 HB3 ARG 49 2HB ARG 49 3.841 9.687 -16.027
383 HG2 ARG 49 1HG ARG 49 4.448 10.027 -18.402
384 HG3 ARG 49 2HG ARG 49 5.547 8.630 -18.303
385 HD2 ARG 49 1HD ARG 49 3.702 7.166 -17.889
386 HD3 ARG 49 2HD ARG 49 2.578 8.546 -17.871
387 HE ARG 49 HE ARG 49 3.815 8.418 -20.496
388 HH11 ARG 49 1HH1 ARG 49 1.590 6.579 -18.540
389 HH12 ARG 49 2HH1 ARG 49 0.788 6.000 -19.987
390 HH21 ARG 49 1HH2 ARG 49 2.912 7.757 -22.162
391 HH22 ARG 49 2HH2 ARG 49 1.541 6.671 -22.053
392 HA PRO 50 HA PRO 50 5.438 12.649 -12.579
393 HB2 PRO 50 1HB PRO 50 2.415 12.301 -12.796
394 HB3 PRO 50 2HB PRO 50 3.329 13.748 -12.349
395 HG2 PRO 50 1HG PRO 50 2.252 13.591 -14.779
396 HG3 PRO 50 2HG PRO 50 3.877 14.265 -14.596
397 HD2 PRO 50 1HD PRO 50 3.060 11.512 -15.597
398 HD3 PRO 50 2HD PRO 50 4.371 12.554 -16.161
399 H VAL 51 HN VAL 51 3.472 9.803 -13.316
400 HA VAL 51 HA VAL 51 3.649 8.975 -10.435
401 HB VAL 51 HB VAL 51 2.021 7.253 -11.037
402 HG11 VAL 51 1HG1 VAL 51 0.101 8.695 -11.624
403 HG12 VAL 51 2HG1 VAL 51 1.153 9.486 -10.428
404 HG13 VAL 51 3HG1 VAL 51 1.221 9.979 -12.136
405 HG21 VAL 51 3HG2 VAL 51 2.790 6.770 -13.283
406 HG22 VAL 51 1HG2 VAL 51 1.047 7.125 -13.274
407 HG23 VAL 51 2HG2 VAL 51 2.202 8.353 -13.846
408 H LYS 52 HN LYS 52 5.020 8.337 -13.534
409 HA LYS 52 HA LYS 52 6.049 5.705 -12.936
410 HB2 LYS 52 1HB LYS 52 5.927 6.660 -15.196
411 HB3 LYS 52 2HB LYS 52 7.143 7.876 -14.734
412 HG2 LYS 52 1HG LYS 52 8.820 6.147 -14.422
413 HG3 LYS 52 2HG LYS 52 7.615 4.876 -14.734
414 HD2 LYS 52 1HD LYS 52 7.307 5.724 -17.024
415 HD3 LYS 52 2HD LYS 52 8.506 7.002 -16.713
416 HE2 LYS 52 1HE LYS 52 10.242 5.330 -16.355
417 HE3 LYS 52 2HE LYS 52 9.055 4.022 -16.569
418 HZ1 LYS 52 3HZ LYS 52 9.839 5.980 -18.632
419 HZ2 LYS 52 1HZ LYS 52 10.326 4.405 -18.569
420 HZ3 LYS 52 2HZ LYS 52 8.738 4.767 -18.831
421 H MET 53 HN MET 53 7.221 8.978 -12.294
422 HA MET 53 HA MET 53 9.813 8.290 -11.329
423 HB2 MET 53 1HB MET 53 7.881 10.473 -10.569
424 HB3 MET 53 2HB MET 53 9.538 10.355 -9.931
425 HG2 MET 53 1HG MET 53 10.358 10.434 -12.311
426 HG3 MET 53 2HG MET 53 8.688 10.793 -12.807
427 HE1 MET 53 3HE MET 53 7.535 12.705 -10.677
428 HE2 MET 53 1HE MET 53 8.023 14.302 -11.294
429 HE3 MET 53 2HE MET 53 7.467 13.042 -12.424
430 H ALA 54 HN ALA 54 6.673 8.356 -9.668
431 HA ALA 54 HA ALA 54 7.702 7.594 -7.105
432 HB1 ALA 54 3HB ALA 54 4.973 7.084 -8.338
433 HB2 ALA 54 1HB ALA 54 5.382 6.925 -6.615
434 HB3 ALA 54 2HB ALA 54 5.449 8.519 -7.401
435 H THR 55 HN THR 55 6.507 5.686 -9.860
436 HA THR 55 HA THR 55 6.795 3.118 -8.613
437 HB THR 55 HB THR 55 7.014 3.894 -11.553
438 HG1 THR 55 HG1 THR 55 4.808 3.154 -11.544
439 HG21 THR 55 3HG2 THR 55 6.542 1.192 -10.232
440 HG22 THR 55 1HG2 THR 55 6.502 1.516 -11.980
441 HG23 THR 55 2HG2 THR 55 8.026 1.691 -11.077
442 H LEU 56 HN LEU 56 9.072 5.132 -10.439
443 HA LEU 56 HA LEU 56 11.166 3.157 -10.525
444 HB2 LEU 56 1HB LEU 56 11.073 6.096 -10.596
445 HB3 LEU 56 2HB LEU 56 12.629 5.287 -10.890
446 HG LEU 56 HG LEU 56 10.113 4.984 -12.576
447 HD11 LEU 56 1HD1 LEU 56 11.426 6.222 -14.320
448 HD12 LEU 56 2HD1 LEU 56 11.202 7.209 -12.856
449 HD13 LEU 56 3HD1 LEU 56 12.762 6.408 -13.159
450 HD21 LEU 56 3HD2 LEU 56 11.442 2.957 -12.539
451 HD22 LEU 56 1HD2 LEU 56 11.571 3.738 -14.133
452 HD23 LEU 56 2HD2 LEU 56 12.907 3.874 -12.963
453 H LEU 57 HN LEU 57 10.356 5.705 -8.200
454 HA LEU 57 HA LEU 57 12.691 5.310 -6.553
455 HB2 LEU 57 1HB LEU 57 9.970 6.332 -6.109
456 HB3 LEU 57 2HB LEU 57 11.147 6.454 -4.781
457 HG LEU 57 HG LEU 57 11.387 7.768 -7.516
458 HD11 LEU 57 1HD1 LEU 57 11.088 9.906 -6.237
459 HD12 LEU 57 2HD1 LEU 57 9.671 8.845 -6.063
460 HD13 LEU 57 3HD1 LEU 57 10.861 8.965 -4.745
461 HD21 LEU 57 3HD2 LEU 57 13.550 7.145 -6.616
462 HD22 LEU 57 1HD2 LEU 57 13.355 8.913 -6.556
463 HD23 LEU 57 2HD2 LEU 57 13.171 7.946 -5.072
464 H VAL 58 HN VAL 58 9.438 3.899 -6.513
465 HA VAL 58 HA VAL 58 9.864 2.354 -4.078
466 HB VAL 58 HB VAL 58 7.911 2.039 -6.393
467 HG11 VAL 58 1HG1 VAL 58 6.713 0.458 -4.918
468 HG12 VAL 58 2HG1 VAL 58 8.343 -0.139 -5.306
469 HG13 VAL 58 3HG1 VAL 58 8.016 0.591 -3.716
470 HG21 VAL 58 3HG2 VAL 58 7.572 4.054 -5.091
471 HG22 VAL 58 1HG2 VAL 58 6.267 2.882 -4.795
472 HG23 VAL 58 2HG2 VAL 58 7.555 3.102 -3.587
473 H THR 59 HN THR 59 10.358 1.682 -7.516
474 HA THR 59 HA THR 59 10.899 -1.137 -7.073
475 HB THR 59 HB THR 59 11.616 0.679 -9.413
476 HG1 THR 59 HG1 THR 59 9.755 -0.369 -10.335
477 HG21 THR 59 3HG2 THR 59 11.572 -2.356 -9.184
478 HG22 THR 59 1HG2 THR 59 11.878 -1.430 -10.672
479 HG23 THR 59 2HG2 THR 59 13.030 -1.345 -9.318
480 H TYR 60 HN TYR 60 12.938 1.755 -7.365
481 HA TYR 60 HA TYR 60 15.362 0.066 -7.481
482 HB2 TYR 60 1HB TYR 60 14.940 3.061 -7.524
483 HB3 TYR 60 2HB TYR 60 16.518 2.249 -7.666
484 HD1 TYR 60 HD1 TYR 60 14.923 -0.065 -9.329
485 HD2 TYR 60 HD2 TYR 60 15.544 4.131 -9.754
486 HE1 TYR 60 HE1 TYR 60 14.597 -0.273 -11.776
487 HE2 TYR 60 HE2 TYR 60 15.223 3.942 -12.197
488 HH TYR 60 HH TYR 60 14.789 2.550 -13.947
489 H TYR 61 HN TYR 61 13.730 2.223 -5.213
490 HA TYR 61 HA TYR 61 15.996 1.810 -3.292
491 HB2 TYR 61 1HB TYR 61 13.863 3.952 -3.300
492 HB3 TYR 61 2HB TYR 61 15.262 3.828 -2.205
493 HD1 TYR 61 HD1 TYR 61 14.189 4.617 -5.654
494 HD2 TYR 61 HD2 TYR 61 17.465 4.516 -2.925
495 HE1 TYR 61 HE1 TYR 61 15.540 5.961 -7.237
496 HE2 TYR 61 HE2 TYR 61 18.827 5.856 -4.493
497 HH TYR 61 HH TYR 61 18.897 6.380 -6.966
498 H GLY 62 HN GLY 62 12.438 2.072 -3.444
499 HA2 GLY 62 1HA GLY 62 11.530 -0.127 -2.322
500 HA3 GLY 62 2HA GLY 62 12.292 0.580 -0.877
501 H GLU 63 HN GLU 63 9.592 0.023 -0.902
502 HA GLU 63 HA GLU 63 7.915 2.187 -1.756
503 HB2 GLU 63 1HB GLU 63 7.629 0.126 0.432
504 HB3 GLU 63 2HB GLU 63 6.356 1.292 -0.004
505 HG2 GLU 63 1HG GLU 63 6.157 0.267 -2.268
506 HG3 GLU 63 2HG GLU 63 7.618 -0.667 -1.871
507 H GLU 64 HN GLU 64 9.449 1.521 1.394
508 HA GLU 64 HA GLU 64 8.411 3.945 2.611
509 HB2 GLU 64 1HB GLU 64 10.679 2.086 3.326
510 HB3 GLU 64 2HB GLU 64 10.181 3.478 4.317
511 HG2 GLU 64 1HG GLU 64 7.924 2.405 4.665
512 HG3 GLU 64 2HG GLU 64 8.480 1.147 3.537
513 H TYR 65 HN TYR 65 11.384 3.112 0.897
514 HA TYR 65 HA TYR 65 12.748 5.591 1.514
515 HB2 TYR 65 1HB TYR 65 13.069 3.504 -0.641
516 HB3 TYR 65 2HB TYR 65 14.093 4.956 -0.538
517 HD1 TYR 65 HD2 TYR 65 15.474 5.308 1.565
518 HD2 TYR 65 HD1 TYR 65 13.534 1.610 0.703
519 HE1 TYR 65 HE2 TYR 65 16.948 4.168 3.189
520 HE2 TYR 65 HE1 TYR 65 15.003 0.451 2.328
521 HH TYR 65 HH TYR 65 17.506 2.194 4.179
522 H ALA 66 HN ALA 66 10.534 4.578 -1.039
523 HA ALA 66 HA ALA 66 10.862 6.915 -2.670
524 HB1 ALA 66 3HB ALA 66 8.460 5.084 -2.343
525 HB2 ALA 66 1HB ALA 66 8.698 6.263 -3.653
526 HB3 ALA 66 2HB ALA 66 9.794 4.869 -3.502
527 H VAL 67 HN VAL 67 8.752 6.172 0.080
528 HA VAL 67 HA VAL 67 7.274 8.680 -0.014
529 HB VAL 67 HB VAL 67 7.803 6.690 2.227
530 HG11 VAL 67 1HG1 VAL 67 6.020 7.884 3.456
531 HG12 VAL 67 2HG1 VAL 67 7.408 8.953 3.144
532 HG13 VAL 67 3HG1 VAL 67 5.935 9.096 2.155
533 HG21 VAL 67 3HG2 VAL 67 6.448 5.807 0.424
534 HG22 VAL 67 1HG2 VAL 67 5.465 6.066 1.884
535 HG23 VAL 67 2HG2 VAL 67 5.361 7.212 0.526
536 H GLN 68 HN GLN 68 10.222 7.655 1.663
537 HA GLN 68 HA GLN 68 10.529 10.114 3.130
538 HB2 GLN 68 1HB GLN 68 12.474 7.989 2.223
539 HB3 GLN 68 2HB GLN 68 12.948 9.390 3.212
540 HG2 GLN 68 1HG GLN 68 11.284 8.437 5.101
541 HG3 GLN 68 2HG GLN 68 10.989 7.330 3.740
542 HE21 GLN 68 2HE2 GLN 68 11.737 6.548 6.376
543 HE22 GLN 68 1HE2 GLN 68 13.295 5.796 6.284
544 H LEU 69 HN LEU 69 11.726 9.035 -0.033
545 HA LEU 69 HA LEU 69 13.293 11.447 -0.465
546 HB2 LEU 69 1HB LEU 69 12.203 9.323 -2.188
547 HB3 LEU 69 2HB LEU 69 13.285 10.542 -2.902
548 HG LEU 69 HG LEU 69 14.000 8.548 -0.716
549 HD11 LEU 69 1HD1 LEU 69 15.524 7.584 -2.460
550 HD12 LEU 69 2HD1 LEU 69 13.825 7.527 -2.984
551 HD13 LEU 69 3HD1 LEU 69 14.914 8.777 -3.631
552 HD21 LEU 69 3HD2 LEU 69 15.152 10.657 -0.399
553 HD22 LEU 69 1HD2 LEU 69 16.301 9.416 -0.955
554 HD23 LEU 69 2HD2 LEU 69 15.700 10.647 -2.093
555 H THR 70 HN THR 70 10.047 10.382 -1.408
556 HA THR 70 HA THR 70 9.412 12.717 -2.968
557 HB THR 70 HB THR 70 7.616 10.838 -1.376
558 HG1 THR 70 HG1 THR 70 8.760 9.900 -3.159
559 HG21 THR 70 3HG2 THR 70 6.918 12.911 -3.493
560 HG22 THR 70 1HG2 THR 70 5.785 11.754 -2.758
561 HG23 THR 70 2HG2 THR 70 6.532 13.025 -1.760
562 H LEU 71 HN LEU 71 8.939 11.959 0.480
563 HA LEU 71 HA LEU 71 7.640 14.367 1.218
564 HB2 LEU 71 1HB LEU 71 7.973 12.380 2.498
565 HB3 LEU 71 2HB LEU 71 9.664 12.775 2.885
566 HG LEU 71 HG LEU 71 7.325 14.591 3.554
567 HD11 LEU 71 1HD1 LEU 71 7.526 13.724 5.900
568 HD12 LEU 71 2HD1 LEU 71 7.072 12.429 4.769
569 HD13 LEU 71 3HD1 LEU 71 8.750 12.557 5.347
570 HD21 LEU 71 3HD2 LEU 71 9.486 15.685 3.420
571 HD22 LEU 71 1HD2 LEU 71 8.941 15.624 5.113
572 HD23 LEU 71 2HD2 LEU 71 10.191 14.493 4.538
573 H GLN 72 HN GLN 72 11.119 13.668 0.960
574 HA GLN 72 HA GLN 72 12.014 16.206 1.920
575 HB2 GLN 72 1HB GLN 72 13.429 14.200 1.624
576 HB3 GLN 72 2HB GLN 72 13.278 14.386 -0.139
577 HG2 GLN 72 1HG GLN 72 15.512 15.550 0.443
578 HG3 GLN 72 2HG GLN 72 14.087 16.559 0.103
579 HE21 GLN 72 2HE2 GLN 72 14.981 18.333 1.202
580 HE22 GLN 72 1HE2 GLN 72 15.078 18.382 2.931
581 H VAL 73 HN VAL 73 11.149 15.117 -1.344
582 HA VAL 73 HA VAL 73 11.956 17.653 -2.588
583 HB VAL 73 HB VAL 73 10.252 15.343 -3.612
584 HG11 VAL 73 1HG1 VAL 73 10.632 16.350 -5.838
585 HG12 VAL 73 2HG1 VAL 73 9.750 17.468 -4.771
586 HG13 VAL 73 3HG1 VAL 73 11.486 17.712 -5.077
587 HG21 VAL 73 3HG2 VAL 73 12.533 14.672 -3.144
588 HG22 VAL 73 1HG2 VAL 73 12.240 14.734 -4.897
589 HG23 VAL 73 2HG2 VAL 73 13.152 16.038 -4.102
590 H LEU 74 HN LEU 74 8.964 16.311 -1.317
591 HA LEU 74 HA LEU 74 7.210 18.340 -2.288
592 HB2 LEU 74 1HB LEU 74 7.355 16.661 0.112
593 HB3 LEU 74 2HB LEU 74 5.946 17.735 -0.041
594 HG LEU 74 HG LEU 74 6.729 15.516 -1.971
595 HD11 LEU 74 1HD1 LEU 74 4.641 14.399 -1.140
596 HD12 LEU 74 2HD1 LEU 74 5.803 14.661 0.181
597 HD13 LEU 74 3HD1 LEU 74 4.399 15.739 0.005
598 HD21 LEU 74 3HD2 LEU 74 5.677 17.377 -3.114
599 HD22 LEU 74 1HD2 LEU 74 4.564 15.989 -3.062
600 HD23 LEU 74 2HD2 LEU 74 4.326 17.363 -1.955
601 H ARG 75 HN ARG 75 9.207 18.229 0.657
602 HA ARG 75 HA ARG 75 8.476 20.864 1.567
603 HB2 ARG 75 1HB ARG 75 10.854 19.154 2.099
604 HB3 ARG 75 2HB ARG 75 10.626 20.778 2.788
605 HG2 ARG 75 1HG ARG 75 8.551 20.036 3.866
606 HG3 ARG 75 2HG ARG 75 8.762 18.413 3.165
607 HD2 ARG 75 1HD ARG 75 10.758 18.090 4.452
608 HD3 ARG 75 2HD ARG 75 10.625 19.738 5.109
609 HE ARG 75 HE ARG 75 8.258 18.314 5.933
610 HH11 ARG 75 1HH1 ARG 75 11.698 18.081 6.447
611 HH12 ARG 75 2HH1 ARG 75 11.420 17.402 8.038
612 HH21 ARG 75 1HH2 ARG 75 7.922 17.530 7.750
613 HH22 ARG 75 2HH2 ARG 75 9.267 17.086 8.782
614 H ALA 76 HN ALA 76 10.851 19.688 -0.750
615 HA ALA 76 HA ALA 76 12.304 22.152 -0.977
616 HB1 ALA 76 3HB ALA 76 11.921 19.918 -2.998
617 HB2 ALA 76 1HB ALA 76 13.142 21.206 -3.093
618 HB3 ALA 76 2HB ALA 76 13.207 20.015 -1.773
619 H ILE 77 HN ILE 77 9.279 21.035 -2.307
620 HA ILE 77 HA ILE 77 9.145 23.457 -4.075
621 HB ILE 77 HB ILE 77 7.196 22.344 -5.107
622 HG12 ILE 77 1HG1 ILE 77 7.768 20.018 -3.293
623 HG13 ILE 77 2HG1 ILE 77 6.497 21.229 -3.009
624 HG21 ILE 77 1HG2 ILE 77 8.359 20.429 -6.152
625 HG22 ILE 77 2HG2 ILE 77 9.440 21.835 -6.014
626 HG23 ILE 77 3HG2 ILE 77 9.593 20.479 -4.872
627 HD11 ILE 77 3HD1 ILE 77 6.696 19.392 -5.421
628 HD12 ILE 77 1HD1 ILE 77 5.574 19.198 -4.056
629 HD13 ILE 77 2HD1 ILE 77 5.425 20.604 -5.137
630 H ASN 78 HN ASN 78 8.759 23.153 -1.035
631 HA ASN 78 HA ASN 78 7.559 24.451 0.474
632 HB2 ASN 78 1HB ASN 78 6.326 26.021 -1.906
633 HB3 ASN 78 2HB ASN 78 6.427 26.151 -0.133
634 HD21 ASN 78 2HD2 ASN 78 7.800 27.016 -3.053
635 HD22 ASN 78 1HD2 ASN 78 9.319 27.613 -2.473
636 H GLN 79 HN GLN 79 6.524 21.912 -0.516
637 HA GLN 79 HA GLN 79 3.670 22.406 0.261
638 HB2 GLN 79 1HB GLN 79 4.967 20.145 -1.271
639 HB3 GLN 79 2HB GLN 79 3.312 20.079 -0.620
640 HG2 GLN 79 1HG GLN 79 4.189 22.034 -2.924
641 HG3 GLN 79 2HG GLN 79 3.330 20.480 -2.799
642 HE21 GLN 79 2HE2 GLN 79 2.697 23.472 -3.520
643 HE22 GLN 79 1HE2 GLN 79 1.191 23.743 -2.707
644 H ARG 80 HN ARG 80 4.458 22.642 2.445
645 HA ARG 80 HA ARG 80 5.626 20.329 3.788
646 HB2 ARG 80 1HB ARG 80 4.455 22.872 4.805
647 HB3 ARG 80 2HB ARG 80 5.052 21.562 5.848
648 HG2 ARG 80 1HG ARG 80 7.285 21.778 4.845
649 HG3 ARG 80 2HG ARG 80 6.688 23.089 3.799
650 HD2 ARG 80 1HD ARG 80 6.270 24.460 5.727
651 HD3 ARG 80 2HD ARG 80 6.804 23.143 6.798
652 HE ARG 80 HE ARG 80 9.044 23.837 5.109
653 HH11 ARG 80 1HH1 ARG 80 7.114 25.345 7.592
654 HH12 ARG 80 2HH1 ARG 80 8.492 26.308 8.087
655 HH21 ARG 80 1HH2 ARG 80 10.629 24.939 5.659
656 HH22 ARG 80 2HH2 ARG 80 10.497 26.079 6.984
657 H LEU 81 HN LEU 81 2.390 21.471 3.125
658 HA LEU 81 HA LEU 81 0.970 19.935 5.060
659 HB2 LEU 81 1HB LEU 81 -0.001 21.598 3.835
660 HB3 LEU 81 2HB LEU 81 0.200 20.844 2.235
661 HG LEU 81 HG LEU 81 -1.287 18.969 3.035
662 HD11 LEU 81 1HD1 LEU 81 -2.748 19.453 5.016
663 HD12 LEU 81 2HD1 LEU 81 -1.032 19.382 5.481
664 HD13 LEU 81 3HD1 LEU 81 -1.840 20.957 5.299
665 HD21 LEU 81 3HD2 LEU 81 -2.126 20.709 1.571
666 HD22 LEU 81 1HD2 LEU 81 -3.386 20.234 2.733
667 HD23 LEU 81 2HD2 LEU 81 -2.485 21.752 2.968
668 H LEU 82 HN LEU 82 1.896 19.067 1.721
669 HA LEU 82 HA LEU 82 0.772 16.395 1.985
670 HB2 LEU 82 1HB LEU 82 2.623 17.713 0.115
671 HB3 LEU 82 2HB LEU 82 2.082 16.055 -0.235
672 HG LEU 82 HG LEU 82 0.331 18.540 -0.069
673 HD11 LEU 82 1HD1 LEU 82 -0.040 18.114 -2.513
674 HD12 LEU 82 2HD1 LEU 82 1.681 18.395 -2.160
675 HD13 LEU 82 3HD1 LEU 82 1.086 16.739 -2.429
676 HD21 LEU 82 3HD2 LEU 82 -0.832 16.591 0.785
677 HD22 LEU 82 1HD2 LEU 82 -1.506 17.055 -0.794
678 HD23 LEU 82 2HD2 LEU 82 -0.406 15.661 -0.670
679 H ALA 83 HN ALA 83 3.943 17.830 2.469
680 HA ALA 83 HA ALA 83 5.377 15.376 2.807
681 HB1 ALA 83 3HB ALA 83 5.814 18.081 4.117
682 HB2 ALA 83 1HB ALA 83 6.984 16.741 4.081
683 HB3 ALA 83 2HB ALA 83 6.503 17.543 2.567
684 H GLU 84 HN GLU 84 3.489 17.365 5.066
685 HA GLU 84 HA GLU 84 3.988 15.724 7.383
686 HB2 GLU 84 1HB GLU 84 3.108 18.009 7.484
687 HB3 GLU 84 2HB GLU 84 1.615 17.461 6.683
688 HG2 GLU 84 1HG GLU 84 1.124 15.988 8.694
689 HG3 GLU 84 2HG GLU 84 2.678 16.573 9.332
690 H GLU 85 HN GLU 85 1.549 15.597 4.819
691 HA GLU 85 HA GLU 85 -0.100 13.568 5.938
692 HB2 GLU 85 1HB GLU 85 -0.641 14.879 3.934
693 HB3 GLU 85 2HB GLU 85 0.652 14.035 3.047
694 HG2 GLU 85 1HG GLU 85 -0.620 11.861 3.323
695 HG3 GLU 85 2HG GLU 85 -1.779 12.809 4.282
696 H LEU 86 HN LEU 86 2.779 13.248 3.854
697 HA LEU 86 HA LEU 86 2.747 10.365 3.886
698 HB2 LEU 86 1HB LEU 86 4.764 12.448 3.421
699 HB3 LEU 86 2HB LEU 86 5.261 10.753 3.212
700 HG LEU 86 HG LEU 86 3.142 12.250 1.623
701 HD11 LEU 86 1HD1 LEU 86 4.692 11.829 -0.304
702 HD12 LEU 86 2HD1 LEU 86 5.489 12.780 0.971
703 HD13 LEU 86 3HD1 LEU 86 5.835 11.042 0.808
704 HD21 LEU 86 3HD2 LEU 86 2.454 9.956 2.001
705 HD22 LEU 86 1HD2 LEU 86 2.923 10.175 0.298
706 HD23 LEU 86 2HD2 LEU 86 4.030 9.359 1.428
707 H HIS 87 HN HIS 87 4.304 12.789 5.942
708 HA HIS 87 HA HIS 87 5.828 10.982 7.542
709 HB2 HIS 87 1HB HIS 87 6.167 13.410 7.693
710 HB3 HIS 87 2HB HIS 87 4.505 13.627 8.294
711 HD1 HIS 87 HD1 HIS 87 7.784 11.989 9.321
712 HD2 HIS 87 HD2 HIS 87 4.317 13.584 11.109
713 HE1 HIS 87 HE1 HIS 87 8.157 11.878 11.733
714 H ARG 88 HN ARG 88 2.491 12.170 7.951
715 HA ARG 88 HA ARG 88 2.050 10.619 10.365
716 HB2 ARG 88 1HB ARG 88 0.147 11.964 8.504
717 HB3 ARG 88 2HB ARG 88 -0.313 11.108 9.994
718 HG2 ARG 88 1HG ARG 88 1.068 12.668 11.309
719 HG3 ARG 88 2HG ARG 88 1.506 13.531 9.815
720 HD2 ARG 88 1HD ARG 88 -0.895 14.022 9.491
721 HD3 ARG 88 2HD ARG 88 -1.195 13.324 11.100
722 HE ARG 88 HE ARG 88 -0.035 16.021 10.650
723 HH11 ARG 88 1HH1 ARG 88 -0.472 13.423 12.933
724 HH12 ARG 88 2HH1 ARG 88 -0.158 14.526 14.259
725 HH21 ARG 88 1HH2 ARG 88 0.318 17.299 12.157
726 HH22 ARG 88 2HH2 ARG 88 0.292 16.738 13.817
727 H ALA 89 HN ALA 89 1.565 10.033 6.925
728 HA ALA 89 HA ALA 89 0.067 7.612 7.207
729 HB1 ALA 89 3HB ALA 89 2.006 8.454 5.026
730 HB2 ALA 89 1HB ALA 89 0.829 7.126 4.913
731 HB3 ALA 89 2HB ALA 89 0.263 8.806 5.072
732 H ALA 90 HN ALA 90 3.565 8.242 7.081
733 HA ALA 90 HA ALA 90 4.357 5.494 7.172
734 HB1 ALA 90 3HB ALA 90 5.810 7.970 8.164
735 HB2 ALA 90 1HB ALA 90 6.542 6.371 7.900
736 HB3 ALA 90 2HB ALA 90 5.894 7.292 6.521
737 H ILE 91 HN ILE 91 3.526 7.825 9.692
738 HA ILE 91 HA ILE 91 4.276 6.144 11.931
739 HB ILE 91 HB ILE 91 2.239 8.398 11.647
740 HG12 ILE 91 1HG1 ILE 91 4.899 8.363 13.042
741 HG13 ILE 91 2HG1 ILE 91 4.653 8.907 11.366
742 HG21 ILE 91 1HG2 ILE 91 2.166 8.409 14.118
743 HG22 ILE 91 2HG2 ILE 91 1.579 6.862 13.467
744 HG23 ILE 91 3HG2 ILE 91 3.216 6.973 14.155
745 HD11 ILE 91 3HD1 ILE 91 3.359 10.116 13.835
746 HD12 ILE 91 1HD1 ILE 91 4.714 10.817 12.921
747 HD13 ILE 91 2HD1 ILE 91 3.112 10.659 12.159
748 H GLN 92 HN GLN 92 1.229 6.532 10.152
749 HA GLN 92 HA GLN 92 -0.194 4.643 11.823
750 HB2 GLN 92 1HB GLN 92 -0.662 5.689 9.027
751 HB3 GLN 92 2HB GLN 92 -1.775 4.587 9.872
752 HG2 GLN 92 1HG GLN 92 -2.106 6.554 11.685
753 HG3 GLN 92 2HG GLN 92 -0.844 7.220 10.620
754 HE21 GLN 92 2HE2 GLN 92 -3.290 8.516 11.246
755 HE22 GLN 92 1HE2 GLN 92 -4.216 8.651 9.788
756 H LEU 93 HN LEU 93 1.730 4.357 8.884
757 HA LEU 93 HA LEU 93 1.011 1.598 8.372
758 HB2 LEU 93 1HB LEU 93 3.264 3.354 7.676
759 HB3 LEU 93 2HB LEU 93 3.233 1.712 6.990
760 HG LEU 93 HG LEU 93 1.104 3.841 6.551
761 HD11 LEU 93 1HD1 LEU 93 2.013 3.948 4.214
762 HD12 LEU 93 2HD1 LEU 93 3.245 4.413 5.409
763 HD13 LEU 93 3HD1 LEU 93 3.286 2.794 4.673
764 HD21 LEU 93 3HD2 LEU 93 0.222 1.584 6.460
765 HD22 LEU 93 1HD2 LEU 93 0.249 2.291 4.826
766 HD23 LEU 93 2HD2 LEU 93 1.488 1.105 5.304
Start of MODEL 9
1 H THR 4 1H THR 4 -0.315 -0.389 -1.039
2 HA THR 4 HA THR 4 2.257 -0.634 0.184
3 HB THR 4 HB THR 4 3.189 -0.437 -2.048
4 HG1 THR 4 HG1 THR 4 2.051 0.444 -3.721
5 HG21 THR 4 3HG2 THR 4 0.479 -1.819 -2.157
6 HG22 THR 4 1HG2 THR 4 1.841 -2.111 -3.263
7 HG23 THR 4 2HG2 THR 4 1.987 -2.534 -1.539
8 HA PRO 5 HA PRO 5 3.622 3.501 0.870
9 HB2 PRO 5 1HB PRO 5 6.294 3.255 0.154
10 HB3 PRO 5 2HB PRO 5 5.681 2.593 1.675
11 HG2 PRO 5 1HG PRO 5 6.172 1.173 -0.963
12 HG3 PRO 5 2HG PRO 5 6.594 0.653 0.674
13 HD2 PRO 5 1HD PRO 5 4.378 -0.335 -0.563
14 HD3 PRO 5 2HD PRO 5 4.367 -0.026 1.177
15 H SER 6 HN SER 6 4.052 1.906 -2.211
16 HA SER 6 HA SER 6 4.676 4.311 -3.765
17 HB2 SER 6 1HB SER 6 4.347 3.056 -5.627
18 HB3 SER 6 2HB SER 6 5.245 2.087 -4.437
19 HG SER 6 HG SER 6 3.199 1.287 -5.704
20 H ASP 7 HN ASP 7 1.714 2.556 -2.807
21 HA ASP 7 HA ASP 7 -0.100 4.318 -4.233
22 HB2 ASP 7 1HB ASP 7 -0.556 2.432 -1.843
23 HB3 ASP 7 2HB ASP 7 -1.715 3.515 -2.654
24 H HIS 8 HN HIS 8 1.264 4.293 -0.959
25 HA HIS 8 HA HIS 8 -0.201 6.557 0.014
26 HB2 HIS 8 1HB HIS 8 2.539 5.440 0.749
27 HB3 HIS 8 2HB HIS 8 1.747 6.774 1.621
28 HD1 HIS 8 HD1 HIS 8 2.379 4.344 3.206
29 HD2 HIS 8 HD2 HIS 8 -1.262 4.671 1.199
30 HE1 HIS 8 HE1 HIS 8 0.900 2.831 4.359
31 H LEU 9 HN LEU 9 2.869 6.311 -1.753
32 HA LEU 9 HA LEU 9 3.347 9.164 -1.789
33 HB2 LEU 9 1HB LEU 9 4.147 6.878 -3.457
34 HB3 LEU 9 2HB LEU 9 4.841 8.473 -3.824
35 HG LEU 9 HG LEU 9 5.158 6.970 -1.197
36 HD11 LEU 9 1HD1 LEU 9 7.541 6.670 -1.921
37 HD12 LEU 9 2HD1 LEU 9 6.417 5.891 -3.059
38 HD13 LEU 9 3HD1 LEU 9 7.154 7.458 -3.469
39 HD21 LEU 9 3HD2 LEU 9 5.200 9.378 -0.913
40 HD22 LEU 9 1HD2 LEU 9 6.832 8.711 -0.672
41 HD23 LEU 9 2HD2 LEU 9 6.423 9.538 -2.195
42 H LEU 10 HN LEU 10 1.846 6.931 -4.127
43 HA LEU 10 HA LEU 10 1.317 8.788 -6.178
44 HB2 LEU 10 1HB LEU 10 1.027 6.406 -6.144
45 HB3 LEU 10 2HB LEU 10 -0.532 6.506 -5.293
46 HG LEU 10 HG LEU 10 0.054 7.846 -7.958
47 HD11 LEU 10 1HD1 LEU 10 -1.338 6.019 -8.968
48 HD12 LEU 10 2HD1 LEU 10 0.121 5.364 -8.190
49 HD13 LEU 10 3HD1 LEU 10 -1.455 5.245 -7.370
50 HD21 LEU 10 3HD2 LEU 10 -1.693 8.917 -6.664
51 HD22 LEU 10 1HD2 LEU 10 -2.401 8.093 -8.073
52 HD23 LEU 10 2HD2 LEU 10 -2.533 7.362 -6.456
53 H SER 11 HN SER 11 -0.550 8.151 -3.227
54 HA SER 11 HA SER 11 -2.889 9.685 -3.760
55 HB2 SER 11 1HB SER 11 -1.487 9.181 -1.207
56 HB3 SER 11 2HB SER 11 -3.091 9.926 -1.405
57 HG SER 11 HG SER 11 -3.198 7.666 -1.051
58 H THR 12 HN THR 12 0.336 10.671 -2.576
59 HA THR 12 HA THR 12 -0.627 13.445 -2.144
60 HB THR 12 HB THR 12 1.598 13.844 -1.178
61 HG1 THR 12 HG1 THR 12 3.060 12.037 -1.057
62 HG21 THR 12 3HG2 THR 12 0.376 11.230 -0.208
63 HG22 THR 12 1HG2 THR 12 1.474 12.274 0.725
64 HG23 THR 12 2HG2 THR 12 -0.144 12.862 0.273
65 H LEU 13 HN LEU 13 1.125 11.583 -4.475
66 HA LEU 13 HA LEU 13 2.304 13.976 -5.741
67 HB2 LEU 13 1HB LEU 13 2.103 11.124 -6.450
68 HB3 LEU 13 2HB LEU 13 3.041 12.225 -7.484
69 HG LEU 13 HG LEU 13 3.641 11.460 -4.600
70 HD11 LEU 13 1HD1 LEU 13 5.723 10.472 -5.593
71 HD12 LEU 13 2HD1 LEU 13 4.261 9.727 -6.282
72 HD13 LEU 13 3HD1 LEU 13 5.160 10.950 -7.212
73 HD21 LEU 13 3HD2 LEU 13 4.169 13.795 -4.985
74 HD22 LEU 13 1HD2 LEU 13 5.670 12.850 -4.841
75 HD23 LEU 13 2HD2 LEU 13 5.099 13.376 -6.443
76 H GLU 14 HN GLU 14 -0.591 12.102 -5.946
77 HA GLU 14 HA GLU 14 -1.352 13.034 -8.605
78 HB2 GLU 14 1HB GLU 14 -2.260 10.997 -7.558
79 HB3 GLU 14 2HB GLU 14 -3.037 12.008 -6.315
80 HG2 GLU 14 1HG GLU 14 -4.468 13.072 -8.112
81 HG3 GLU 14 2HG GLU 14 -3.534 12.087 -9.262
82 H GLU 15 HN GLU 15 -1.575 14.297 -5.356
83 HA GLU 15 HA GLU 15 -3.633 16.267 -6.009
84 HB2 GLU 15 1HB GLU 15 -1.709 15.980 -3.699
85 HB3 GLU 15 2HB GLU 15 -2.949 17.252 -3.823
86 HG2 GLU 15 1HG GLU 15 -3.525 14.231 -3.647
87 HG3 GLU 15 2HG GLU 15 -3.628 15.477 -2.383
88 H LEU 16 HN LEU 16 -0.226 16.062 -6.425
89 HA LEU 16 HA LEU 16 0.382 18.870 -6.469
90 HB2 LEU 16 1HB LEU 16 1.444 16.478 -7.804
91 HB3 LEU 16 2HB LEU 16 2.293 18.020 -8.054
92 HG LEU 16 HG LEU 16 1.892 16.600 -5.392
93 HD11 LEU 16 1HD1 LEU 16 4.379 16.277 -5.477
94 HD12 LEU 16 2HD1 LEU 16 3.576 15.487 -6.854
95 HD13 LEU 16 3HD1 LEU 16 4.408 17.043 -7.082
96 HD21 LEU 16 3HD2 LEU 16 1.881 19.012 -5.138
97 HD22 LEU 16 1HD2 LEU 16 3.391 18.339 -4.478
98 HD23 LEU 16 2HD2 LEU 16 3.394 19.146 -6.066
99 H VAL 17 HN VAL 17 -0.105 20.431 -7.788
100 HA VAL 17 HA VAL 17 -1.443 19.879 -10.374
101 HB VAL 17 HB VAL 17 -1.535 22.311 -10.594
102 HG11 VAL 17 1HG1 VAL 17 -2.857 22.859 -8.578
103 HG12 VAL 17 2HG1 VAL 17 -3.247 21.229 -9.176
104 HG13 VAL 17 3HG1 VAL 17 -2.195 21.428 -7.754
105 HG21 VAL 17 3HG2 VAL 17 0.660 22.855 -9.727
106 HG22 VAL 17 1HG2 VAL 17 -0.599 23.799 -8.897
107 HG23 VAL 17 2HG2 VAL 17 0.145 22.402 -8.084
108 HA PRO 18 HA PRO 18 1.656 19.754 -13.259
109 HB2 PRO 18 1HB PRO 18 0.585 22.370 -14.437
110 HB3 PRO 18 2HB PRO 18 0.963 20.859 -15.275
111 HG2 PRO 18 1HG PRO 18 -1.580 21.461 -14.772
112 HG3 PRO 18 2HG PRO 18 -1.028 19.796 -14.546
113 HD2 PRO 18 1HD PRO 18 -1.624 21.903 -12.449
114 HD3 PRO 18 2HD PRO 18 -1.860 20.152 -12.365
115 H TYR 19 HN TYR 19 1.174 23.016 -11.946
116 HA TYR 19 HA TYR 19 3.862 23.895 -12.558
117 HB2 TYR 19 1HB TYR 19 2.031 25.448 -12.148
118 HB3 TYR 19 2HB TYR 19 1.872 24.835 -10.484
119 HD1 TYR 19 HD1 TYR 19 4.204 26.610 -12.794
120 HD2 TYR 19 HD2 TYR 19 3.195 25.738 -8.744
121 HE1 TYR 19 HE1 TYR 19 5.871 28.276 -12.029
122 HE2 TYR 19 HE2 TYR 19 4.854 27.396 -7.963
123 HH TYR 19 HH TYR 19 6.426 28.929 -8.566
124 H ASP 20 HN ASP 20 2.369 22.829 -9.486
125 HA ASP 20 HA ASP 20 4.857 22.910 -8.033
126 HB2 ASP 20 1HB ASP 20 2.215 21.451 -7.433
127 HB3 ASP 20 2HB ASP 20 3.726 21.461 -6.490
128 H PHE 21 HN PHE 21 3.299 20.451 -9.992
129 HA PHE 21 HA PHE 21 5.044 18.287 -9.144
130 HB2 PHE 21 1HB PHE 21 2.854 17.839 -10.198
131 HB3 PHE 21 2HB PHE 21 3.402 18.632 -11.692
132 HD1 PHE 21 HD1 PHE 21 4.303 15.846 -9.381
133 HD2 PHE 21 HD2 PHE 21 4.302 17.377 -13.369
134 HE1 PHE 21 HE1 PHE 21 5.168 13.683 -10.209
135 HE2 PHE 21 HE2 PHE 21 5.164 15.215 -14.202
136 HZ PHE 21 HZ PHE 21 5.598 13.368 -12.621
137 H GLU 22 HN GLU 22 5.106 20.614 -11.831
138 HA GLU 22 HA GLU 22 7.490 19.661 -13.076
139 HB2 GLU 22 1HB GLU 22 5.978 21.353 -14.023
140 HB3 GLU 22 2HB GLU 22 6.498 22.500 -12.765
141 HG2 GLU 22 1HG GLU 22 8.844 22.441 -13.723
142 HG3 GLU 22 2HG GLU 22 8.213 21.224 -14.856
143 H LYS 23 HN LYS 23 7.022 21.827 -10.308
144 HA LYS 23 HA LYS 23 9.904 22.272 -10.002
145 HB2 LYS 23 1HB LYS 23 7.610 22.785 -8.102
146 HB3 LYS 23 2HB LYS 23 9.279 23.378 -7.930
147 HG2 LYS 23 1HG LYS 23 7.339 24.122 -10.147
148 HG3 LYS 23 2HG LYS 23 7.770 25.143 -8.754
149 HD2 LYS 23 1HD LYS 23 10.124 25.145 -9.491
150 HD3 LYS 23 2HD LYS 23 9.681 24.140 -10.891
151 HE2 LYS 23 1HE LYS 23 8.192 25.911 -11.703
152 HE3 LYS 23 2HE LYS 23 8.609 26.915 -10.296
153 HZ1 LYS 23 3HZ LYS 23 10.495 26.016 -12.379
154 HZ2 LYS 23 1HZ LYS 23 9.876 27.538 -12.239
155 HZ3 LYS 23 2HZ LYS 23 10.883 26.947 -11.074
156 H PHE 24 HN PHE 24 7.487 20.083 -8.669
157 HA PHE 24 HA PHE 24 9.163 18.836 -6.705
158 HB2 PHE 24 1HB PHE 24 6.720 18.413 -6.881
159 HB3 PHE 24 2HB PHE 24 6.982 17.589 -8.434
160 HD1 PHE 24 HD1 PHE 24 7.354 17.386 -4.803
161 HD2 PHE 24 HD2 PHE 24 7.960 15.404 -8.540
162 HE1 PHE 24 HE1 PHE 24 7.693 15.246 -3.612
163 HE2 PHE 24 HE2 PHE 24 8.296 13.262 -7.351
164 HZ PHE 24 HZ PHE 24 8.164 13.185 -4.886
165 H LYS 25 HN LYS 25 8.648 18.047 -10.151
166 HA LYS 25 HA LYS 25 10.531 15.934 -10.327
167 HB2 LYS 25 1HB LYS 25 8.942 16.587 -12.091
168 HB3 LYS 25 2HB LYS 25 9.896 18.062 -12.376
169 HG2 LYS 25 1HG LYS 25 11.867 16.515 -12.872
170 HG3 LYS 25 2HG LYS 25 10.684 15.185 -12.903
171 HD2 LYS 25 1HD LYS 25 10.646 17.665 -14.657
172 HD3 LYS 25 2HD LYS 25 11.128 16.031 -15.168
173 HE2 LYS 25 1HE LYS 25 8.817 15.262 -14.451
174 HE3 LYS 25 2HE LYS 25 8.389 16.982 -14.293
175 HZ1 LYS 25 3HZ LYS 25 9.327 15.667 -16.762
176 HZ2 LYS 25 1HZ LYS 25 7.769 16.104 -16.440
177 HZ3 LYS 25 2HZ LYS 25 8.932 17.261 -16.617
178 H PHE 26 HN PHE 26 11.057 19.430 -10.839
179 HA PHE 26 HA PHE 26 13.817 19.283 -11.456
180 HB2 PHE 26 1HB PHE 26 12.512 21.357 -11.717
181 HB3 PHE 26 2HB PHE 26 12.307 21.466 -9.953
182 HD1 PHE 26 HD1 PHE 26 14.810 21.549 -12.682
183 HD2 PHE 26 HD2 PHE 26 13.910 22.471 -8.608
184 HE1 PHE 26 HE1 PHE 26 16.892 22.874 -12.523
185 HE2 PHE 26 HE2 PHE 26 15.991 23.798 -8.446
186 HZ PHE 26 HZ PHE 26 17.482 23.998 -10.405
187 H LYS 27 HN LYS 27 12.233 19.527 -8.276
188 HA LYS 27 HA LYS 27 14.834 19.588 -6.906
189 HB2 LYS 27 1HB LYS 27 11.987 19.382 -5.919
190 HB3 LYS 27 2HB LYS 27 13.418 19.463 -4.866
191 HG2 LYS 27 1HG LYS 27 12.557 21.601 -6.845
192 HG3 LYS 27 2HG LYS 27 12.281 21.653 -5.087
193 HD2 LYS 27 1HD LYS 27 14.753 21.509 -4.747
194 HD3 LYS 27 2HD LYS 27 14.962 21.612 -6.512
195 HE2 LYS 27 1HE LYS 27 13.840 23.796 -6.523
196 HE3 LYS 27 2HE LYS 27 13.616 23.694 -4.762
197 HZ1 LYS 27 3HZ LYS 27 16.214 23.776 -6.157
198 HZ2 LYS 27 1HZ LYS 27 15.524 25.032 -5.338
199 HZ3 LYS 27 2HZ LYS 27 16.006 23.681 -4.523
200 H LEU 28 HN LEU 28 12.552 17.190 -7.924
201 HA LEU 28 HA LEU 28 13.405 15.088 -6.137
202 HB2 LEU 28 1HB LEU 28 11.406 15.120 -7.362
203 HB3 LEU 28 2HB LEU 28 12.185 14.923 -8.949
204 HG LEU 28 HG LEU 28 13.141 12.742 -8.097
205 HD11 LEU 28 1HD1 LEU 28 11.980 11.704 -6.130
206 HD12 LEU 28 2HD1 LEU 28 12.834 13.193 -5.664
207 HD13 LEU 28 3HD1 LEU 28 11.069 13.213 -5.891
208 HD21 LEU 28 3HD2 LEU 28 11.247 12.795 -9.609
209 HD22 LEU 28 1HD2 LEU 28 11.048 11.474 -8.434
210 HD23 LEU 28 2HD2 LEU 28 10.123 12.983 -8.242
211 H GLN 29 HN GLN 29 14.606 16.282 -9.234
212 HA GLN 29 HA GLN 29 16.630 14.197 -9.474
213 HB2 GLN 29 1HB GLN 29 16.329 16.938 -10.717
214 HB3 GLN 29 2HB GLN 29 17.631 15.794 -11.118
215 HG2 GLN 29 1HG GLN 29 15.686 14.147 -12.017
216 HG3 GLN 29 2HG GLN 29 14.764 15.516 -11.352
217 HE21 GLN 29 2HE2 GLN 29 14.447 14.584 -13.976
218 HE22 GLN 29 1HE2 GLN 29 15.012 15.802 -15.072
219 H ASN 30 HN ASN 30 16.370 17.208 -7.762
220 HA ASN 30 HA ASN 30 19.328 17.237 -7.307
221 HB2 ASN 30 1HB ASN 30 17.353 19.579 -6.761
222 HB3 ASN 30 2HB ASN 30 19.062 19.219 -6.414
223 HD21 ASN 30 2HD2 ASN 30 17.518 21.198 -8.162
224 HD22 ASN 30 1HD2 ASN 30 18.338 21.118 -9.687
225 H THR 31 HN THR 31 16.747 15.828 -5.961
226 HA THR 31 HA THR 31 16.972 16.602 -3.187
227 HB THR 31 HB THR 31 15.045 15.297 -4.330
228 HG1 THR 31 HG1 THR 31 16.105 14.290 -1.873
229 HG21 THR 31 3HG2 THR 31 16.952 13.012 -3.692
230 HG22 THR 31 1HG2 THR 31 15.254 12.840 -4.194
231 HG23 THR 31 2HG2 THR 31 16.452 13.522 -5.321
232 H SER 32 HN SER 32 17.978 15.671 -1.465
233 HA SER 32 HA SER 32 20.544 14.348 -1.813
234 HB2 SER 32 1HB SER 32 20.140 15.714 0.016
235 HB3 SER 32 2HB SER 32 18.823 14.657 0.572
236 HG SER 32 HG SER 32 20.814 14.218 1.613
237 H VAL 33 HN VAL 33 20.995 12.262 -2.111
238 HA VAL 33 HA VAL 33 18.876 10.204 -1.507
239 HB VAL 33 HB VAL 33 19.664 8.939 -3.471
240 HG11 VAL 33 1HG1 VAL 33 18.707 10.382 -5.236
241 HG12 VAL 33 2HG1 VAL 33 17.742 10.470 -3.744
242 HG13 VAL 33 3HG1 VAL 33 18.855 11.793 -4.164
243 HG21 VAL 33 3HG2 VAL 33 21.944 9.752 -3.558
244 HG22 VAL 33 1HG2 VAL 33 21.135 9.966 -5.128
245 HG23 VAL 33 2HG2 VAL 33 21.372 11.363 -4.051
246 H GLN 34 HN GLN 34 19.711 8.010 -1.352
247 HA GLN 34 HA GLN 34 21.974 8.092 0.545
248 HB2 GLN 34 1HB GLN 34 20.195 5.814 -0.353
249 HB3 GLN 34 2HB GLN 34 21.380 5.761 0.973
250 HG2 GLN 34 1HG GLN 34 18.685 7.374 1.093
251 HG3 GLN 34 2HG GLN 34 19.353 5.876 1.785
252 HE21 GLN 34 2HE2 GLN 34 18.892 9.194 2.214
253 HE22 GLN 34 1HE2 GLN 34 19.988 9.443 3.532
254 H LYS 35 HN LYS 35 23.660 6.481 0.517
255 HA LYS 35 HA LYS 35 24.752 6.286 -2.248
256 HB2 LYS 35 1HB LYS 35 26.019 5.916 0.471
257 HB3 LYS 35 2HB LYS 35 26.862 5.749 -1.087
258 HG2 LYS 35 1HG LYS 35 26.413 8.114 -1.590
259 HG3 LYS 35 2HG LYS 35 25.556 8.284 -0.039
260 HD2 LYS 35 1HD LYS 35 27.633 7.691 1.160
261 HD3 LYS 35 2HD LYS 35 28.484 7.561 -0.396
262 HE2 LYS 35 1HE LYS 35 27.973 9.932 -0.858
263 HE3 LYS 35 2HE LYS 35 27.166 10.054 0.723
264 HZ1 LYS 35 3HZ LYS 35 30.016 9.422 0.298
265 HZ2 LYS 35 1HZ LYS 35 29.422 10.873 0.811
266 HZ3 LYS 35 2HZ LYS 35 29.267 9.534 1.764
267 H GLU 36 HN GLU 36 22.969 4.399 -0.207
268 HA GLU 36 HA GLU 36 24.369 1.858 -0.669
269 HB2 GLU 36 1HB GLU 36 21.633 2.536 0.419
270 HB3 GLU 36 2HB GLU 36 22.299 0.889 0.306
271 HG2 GLU 36 1HG GLU 36 24.163 1.594 1.901
272 HG3 GLU 36 2HG GLU 36 23.381 3.191 1.878
273 H HIS 37 HN HIS 37 22.098 3.806 -2.369
274 HA HIS 37 HA HIS 37 21.678 1.555 -4.299
275 HB2 HIS 37 1HB HIS 37 19.581 3.521 -3.273
276 HB3 HIS 37 2HB HIS 37 19.354 2.438 -4.668
277 HD1 HIS 37 HD1 HIS 37 19.796 2.333 -0.930
278 HD2 HIS 37 HD2 HIS 37 18.589 -0.232 -3.989
279 HE1 HIS 37 HE1 HIS 37 18.914 0.397 0.200
280 H SER 38 HN SER 38 21.339 2.116 -6.453
281 HA SER 38 HA SER 38 22.954 4.384 -7.377
282 HB2 SER 38 1HB SER 38 22.566 3.649 -9.493
283 HB3 SER 38 2HB SER 38 22.920 2.254 -8.449
284 HG SER 38 HG SER 38 21.169 1.872 -9.874
285 H ARG 39 HN ARG 39 22.157 5.973 -8.907
286 HA ARG 39 HA ARG 39 19.671 7.212 -7.892
287 HB2 ARG 39 1HB ARG 39 21.761 8.210 -9.773
288 HB3 ARG 39 2HB ARG 39 20.291 9.094 -9.301
289 HG2 ARG 39 1HG ARG 39 21.026 9.062 -6.955
290 HG3 ARG 39 2HG ARG 39 22.498 8.179 -7.429
291 HD2 ARG 39 1HD ARG 39 21.750 10.927 -8.372
292 HD3 ARG 39 2HD ARG 39 22.848 10.564 -7.021
293 HE ARG 39 HE ARG 39 23.953 9.331 -9.392
294 HH11 ARG 39 1HH1 ARG 39 23.294 12.542 -8.205
295 HH12 ARG 39 2HH1 ARG 39 24.647 13.168 -9.127
296 HH21 ARG 39 1HH2 ARG 39 25.500 10.033 -10.460
297 HH22 ARG 39 2HH2 ARG 39 25.905 11.738 -10.414
298 H ILE 40 HN ILE 40 17.914 7.821 -9.086
299 HA ILE 40 HA ILE 40 17.184 6.098 -11.319
300 HB ILE 40 HB ILE 40 15.922 8.671 -10.264
301 HG12 ILE 40 1HG1 ILE 40 15.095 5.811 -9.845
302 HG13 ILE 40 2HG1 ILE 40 16.036 6.781 -8.687
303 HG21 ILE 40 1HG2 ILE 40 13.929 7.954 -11.539
304 HG22 ILE 40 2HG2 ILE 40 15.316 8.224 -12.619
305 HG23 ILE 40 3HG2 ILE 40 14.838 6.567 -12.183
306 HD11 ILE 40 3HD1 ILE 40 13.229 7.411 -9.669
307 HD12 ILE 40 1HD1 ILE 40 13.649 6.735 -8.078
308 HD13 ILE 40 2HD1 ILE 40 14.170 8.381 -8.511
309 HA PRO 41 HA PRO 41 19.205 8.100 -14.654
310 HB2 PRO 41 1HB PRO 41 16.808 6.894 -16.105
311 HB3 PRO 41 2HB PRO 41 18.522 6.789 -16.530
312 HG2 PRO 41 1HG PRO 41 17.313 4.678 -15.438
313 HG3 PRO 41 2HG PRO 41 18.956 5.095 -14.931
314 HD2 PRO 41 1HD PRO 41 16.333 5.574 -13.469
315 HD3 PRO 41 2HD PRO 41 17.909 5.124 -12.805
316 H ARG 42 HN ARG 42 19.012 9.911 -15.778
317 HA ARG 42 HA ARG 42 17.123 11.816 -14.751
318 HB2 ARG 42 1HB ARG 42 18.992 11.955 -17.070
319 HB3 ARG 42 2HB ARG 42 17.953 13.293 -16.524
320 HG2 ARG 42 1HG ARG 42 19.074 13.352 -14.379
321 HG3 ARG 42 2HG ARG 42 20.034 11.913 -14.802
322 HD2 ARG 42 1HD ARG 42 21.110 13.184 -16.577
323 HD3 ARG 42 2HD ARG 42 20.183 14.622 -16.086
324 HE ARG 42 HE ARG 42 21.728 13.849 -13.794
325 HH11 ARG 42 1HH1 ARG 42 22.399 14.845 -17.068
326 HH12 ARG 42 2HH1 ARG 42 23.907 15.569 -16.545
327 HH21 ARG 42 1HH2 ARG 42 23.456 14.665 -13.181
328 HH22 ARG 42 2HH2 ARG 42 24.512 15.465 -14.329
329 H SER 43 HN SER 43 17.158 9.833 -17.665
330 HA SER 43 HA SER 43 14.951 11.068 -19.071
331 HB2 SER 43 1HB SER 43 16.000 8.304 -19.123
332 HB3 SER 43 2HB SER 43 14.747 8.980 -20.189
333 HG SER 43 HG SER 43 16.846 9.110 -21.094
334 H GLN 44 HN GLN 44 15.163 8.515 -16.575
335 HA GLN 44 HA GLN 44 12.445 7.649 -16.745
336 HB2 GLN 44 1HB GLN 44 14.451 7.634 -14.485
337 HB3 GLN 44 2HB GLN 44 12.843 6.879 -14.379
338 HG2 GLN 44 1HG GLN 44 14.929 5.883 -16.508
339 HG3 GLN 44 2HG GLN 44 14.716 5.526 -14.779
340 HE21 GLN 44 2HE2 GLN 44 14.079 3.409 -15.012
341 HE22 GLN 44 1HE2 GLN 44 12.588 2.940 -15.760
342 H ILE 45 HN ILE 45 13.975 10.035 -14.578
343 HA ILE 45 HA ILE 45 11.448 10.750 -13.308
344 HB ILE 45 HB ILE 45 14.167 12.129 -13.434
345 HG12 ILE 45 1HG1 ILE 45 12.786 10.743 -11.152
346 HG13 ILE 45 2HG1 ILE 45 13.985 9.982 -12.224
347 HG21 ILE 45 1HG2 ILE 45 13.305 13.612 -11.654
348 HG22 ILE 45 2HG2 ILE 45 12.366 13.799 -13.154
349 HG23 ILE 45 3HG2 ILE 45 11.700 12.857 -11.800
350 HD11 ILE 45 3HD1 ILE 45 14.473 12.393 -10.440
351 HD12 ILE 45 1HD1 ILE 45 15.024 10.732 -10.121
352 HD13 ILE 45 2HD1 ILE 45 15.670 11.633 -11.512
353 H GLN 46 HN GLN 46 13.361 12.164 -15.935
354 HA GLN 46 HA GLN 46 11.836 14.519 -16.282
355 HB2 GLN 46 1HB GLN 46 13.953 14.020 -17.429
356 HB3 GLN 46 2HB GLN 46 13.126 12.768 -18.387
357 HG2 GLN 46 1HG GLN 46 11.664 14.795 -19.440
358 HG3 GLN 46 2HG GLN 46 12.693 15.622 -18.248
359 HE21 GLN 46 2HE2 GLN 46 12.648 16.457 -20.869
360 HE22 GLN 46 1HE2 GLN 46 14.155 16.074 -21.634
361 H ARG 47 HN ARG 47 11.164 11.223 -17.341
362 HA ARG 47 HA ARG 47 8.738 12.232 -18.779
363 HB2 ARG 47 1HB ARG 47 10.167 9.625 -19.057
364 HB3 ARG 47 2HB ARG 47 8.677 10.113 -19.898
365 HG2 ARG 47 1HG ARG 47 11.313 11.590 -20.132
366 HG3 ARG 47 2HG ARG 47 10.789 10.313 -21.258
367 HD2 ARG 47 1HD ARG 47 8.789 11.679 -21.748
368 HD3 ARG 47 2HD ARG 47 9.505 12.977 -20.764
369 HE ARG 47 HE ARG 47 11.392 12.379 -22.860
370 HH11 ARG 47 1HH1 ARG 47 8.135 13.600 -22.613
371 HH12 ARG 47 2HH1 ARG 47 8.373 14.546 -24.069
372 HH21 ARG 47 1HH2 ARG 47 11.677 13.450 -24.532
373 HH22 ARG 47 2HH2 ARG 47 10.393 14.461 -25.166
374 H ALA 48 HN ALA 48 9.446 11.321 -15.793
375 HA ALA 48 HA ALA 48 7.605 9.123 -15.376
376 HB1 ALA 48 3HB ALA 48 8.849 11.064 -13.398
377 HB2 ALA 48 1HB ALA 48 7.995 9.559 -12.982
378 HB3 ALA 48 2HB ALA 48 9.523 9.492 -13.892
379 H ARG 49 HN ARG 49 5.484 9.116 -15.088
380 HA ARG 49 HA ARG 49 3.963 11.571 -14.634
381 HB2 ARG 49 1HB ARG 49 3.248 8.685 -14.591
382 HB3 ARG 49 2HB ARG 49 2.129 9.971 -14.083
383 HG2 ARG 49 1HG ARG 49 2.500 11.027 -16.356
384 HG3 ARG 49 2HG ARG 49 3.346 9.531 -16.822
385 HD2 ARG 49 1HD ARG 49 1.376 8.255 -16.536
386 HD3 ARG 49 2HD ARG 49 0.514 9.647 -15.841
387 HE ARG 49 HE ARG 49 1.268 10.217 -18.618
388 HH11 ARG 49 1HH1 ARG 49 -1.019 8.374 -16.738
389 HH12 ARG 49 2HH1 ARG 49 -2.183 8.477 -18.044
390 HH21 ARG 49 1HH2 ARG 49 -0.051 10.336 -20.126
391 HH22 ARG 49 2HH2 ARG 49 -1.632 9.594 -19.977
392 HA PRO 50 HA PRO 50 4.060 11.960 -10.258
393 HB2 PRO 50 1HB PRO 50 1.334 12.317 -9.721
394 HB3 PRO 50 2HB PRO 50 2.355 13.616 -10.353
395 HG2 PRO 50 1HG PRO 50 0.505 11.740 -11.861
396 HG3 PRO 50 2HG PRO 50 0.697 13.489 -12.035
397 HD2 PRO 50 1HD PRO 50 1.896 11.836 -13.803
398 HD3 PRO 50 2HD PRO 50 2.757 13.275 -13.243
399 H VAL 51 HN VAL 51 2.036 9.591 -11.821
400 HA VAL 51 HA VAL 51 1.776 8.023 -9.293
401 HB VAL 51 HB VAL 51 0.451 6.479 -10.615
402 HG11 VAL 51 1HG1 VAL 51 -1.372 7.968 -11.372
403 HG12 VAL 51 2HG1 VAL 51 -0.700 8.517 -9.818
404 HG13 VAL 51 3HG1 VAL 51 -0.258 9.355 -11.325
405 HG21 VAL 51 3HG2 VAL 51 1.773 6.490 -12.646
406 HG22 VAL 51 1HG2 VAL 51 0.058 6.796 -13.005
407 HG23 VAL 51 2HG2 VAL 51 1.223 8.142 -13.017
408 H LYS 52 HN LYS 52 3.937 8.340 -11.911
409 HA LYS 52 HA LYS 52 4.905 5.541 -11.607
410 HB2 LYS 52 1HB LYS 52 5.652 7.783 -13.487
411 HB3 LYS 52 2HB LYS 52 6.436 6.186 -13.455
412 HG2 LYS 52 1HG LYS 52 4.273 5.126 -14.010
413 HG3 LYS 52 2HG LYS 52 3.513 6.734 -14.077
414 HD2 LYS 52 1HD LYS 52 5.025 7.379 -15.906
415 HD3 LYS 52 2HD LYS 52 5.801 5.780 -15.833
416 HE2 LYS 52 1HE LYS 52 3.644 4.719 -16.386
417 HE3 LYS 52 2HE LYS 52 2.890 6.326 -16.489
418 HZ1 LYS 52 3HZ LYS 52 5.085 5.349 -18.202
419 HZ2 LYS 52 1HZ LYS 52 3.505 5.492 -18.655
420 HZ3 LYS 52 2HZ LYS 52 4.385 6.841 -18.297
421 H MET 53 HN MET 53 5.700 8.801 -10.699
422 HA MET 53 HA MET 53 8.491 8.397 -10.136
423 HB2 MET 53 1HB MET 53 6.392 10.280 -9.093
424 HB3 MET 53 2HB MET 53 8.067 10.293 -8.492
425 HG2 MET 53 1HG MET 53 8.868 10.730 -10.785
426 HG3 MET 53 2HG MET 53 7.183 10.759 -11.357
427 HE1 MET 53 3HE MET 53 8.021 13.176 -12.444
428 HE2 MET 53 1HE MET 53 8.574 14.536 -11.436
429 HE3 MET 53 2HE MET 53 9.582 13.076 -11.592
430 H ALA 54 HN ALA 54 5.562 7.791 -8.255
431 HA ALA 54 HA ALA 54 6.865 7.099 -5.813
432 HB1 ALA 54 3HB ALA 54 4.278 6.033 -6.994
433 HB2 ALA 54 1HB ALA 54 4.795 5.863 -5.301
434 HB3 ALA 54 2HB ALA 54 4.446 7.476 -5.966
435 H THR 55 HN THR 55 6.014 5.143 -8.661
436 HA THR 55 HA THR 55 6.996 2.656 -7.579
437 HB THR 55 HB THR 55 6.706 3.562 -10.474
438 HG1 THR 55 HG1 THR 55 4.736 3.485 -9.257
439 HG21 THR 55 3HG2 THR 55 7.032 0.782 -9.276
440 HG22 THR 55 1HG2 THR 55 6.729 1.147 -10.991
441 HG23 THR 55 2HG2 THR 55 8.256 1.654 -10.229
442 H LEU 56 HN LEU 56 8.514 5.200 -9.536
443 HA LEU 56 HA LEU 56 10.946 3.765 -10.032
444 HB2 LEU 56 1HB LEU 56 10.207 6.604 -9.840
445 HB3 LEU 56 2HB LEU 56 11.855 6.197 -10.374
446 HG LEU 56 HG LEU 56 9.277 5.405 -11.783
447 HD11 LEU 56 1HD1 LEU 56 10.038 7.009 -13.556
448 HD12 LEU 56 2HD1 LEU 56 9.787 7.835 -12.002
449 HD13 LEU 56 3HD1 LEU 56 11.436 7.441 -12.543
450 HD21 LEU 56 3HD2 LEU 56 11.024 3.748 -12.065
451 HD22 LEU 56 1HD2 LEU 56 10.766 4.622 -13.593
452 HD23 LEU 56 2HD2 LEU 56 12.175 5.005 -12.575
453 H LEU 57 HN LEU 57 10.029 6.027 -7.447
454 HA LEU 57 HA LEU 57 12.635 6.070 -6.222
455 HB2 LEU 57 1HB LEU 57 9.884 6.545 -5.303
456 HB3 LEU 57 2HB LEU 57 11.217 6.868 -4.171
457 HG LEU 57 HG LEU 57 10.791 8.240 -6.854
458 HD11 LEU 57 1HD1 LEU 57 10.262 10.262 -5.467
459 HD12 LEU 57 2HD1 LEU 57 9.116 8.939 -5.145
460 HD13 LEU 57 3HD1 LEU 57 10.433 9.278 -3.995
461 HD21 LEU 57 3HD2 LEU 57 13.138 8.046 -6.276
462 HD22 LEU 57 1HD2 LEU 57 12.612 9.740 -6.123
463 HD23 LEU 57 2HD2 LEU 57 12.829 8.739 -4.666
464 H VAL 58 HN VAL 58 9.737 4.101 -5.621
465 HA VAL 58 HA VAL 58 10.895 2.611 -3.409
466 HB VAL 58 HB VAL 58 8.629 1.972 -5.341
467 HG11 VAL 58 1HG1 VAL 58 8.036 0.175 -3.750
468 HG12 VAL 58 2HG1 VAL 58 9.645 -0.102 -4.457
469 HG13 VAL 58 3HG1 VAL 58 9.497 0.532 -2.801
470 HG21 VAL 58 3HG2 VAL 58 8.183 3.869 -3.902
471 HG22 VAL 58 1HG2 VAL 58 7.191 2.470 -3.429
472 HG23 VAL 58 2HG2 VAL 58 8.623 2.910 -2.468
473 H THR 59 HN THR 59 10.921 2.165 -6.905
474 HA THR 59 HA THR 59 12.024 -0.525 -6.741
475 HB THR 59 HB THR 59 11.960 1.474 -9.042
476 HG1 THR 59 HG1 THR 59 10.216 0.092 -9.718
477 HG21 THR 59 3HG2 THR 59 12.566 -1.509 -9.015
478 HG22 THR 59 1HG2 THR 59 12.418 -0.491 -10.466
479 HG23 THR 59 2HG2 THR 59 13.746 -0.212 -9.314
480 H TYR 60 HN TYR 60 13.425 2.705 -7.308
481 HA TYR 60 HA TYR 60 16.036 1.462 -7.903
482 HB2 TYR 60 1HB TYR 60 14.887 4.234 -7.995
483 HB3 TYR 60 2HB TYR 60 16.650 3.984 -8.025
484 HD1 TYR 60 HD1 TYR 60 13.495 3.463 -9.873
485 HD2 TYR 60 HD2 TYR 60 17.737 3.039 -9.973
486 HE1 TYR 60 HE1 TYR 60 13.385 3.028 -12.309
487 HE2 TYR 60 HE2 TYR 60 17.647 2.604 -12.404
488 HH TYR 60 HH TYR 60 16.314 2.373 -14.238
489 H TYR 61 HN TYR 61 14.494 3.245 -5.294
490 HA TYR 61 HA TYR 61 17.109 3.240 -3.823
491 HB2 TYR 61 1HB TYR 61 14.655 4.963 -3.425
492 HB3 TYR 61 2HB TYR 61 16.161 5.036 -2.478
493 HD1 TYR 61 HD2 TYR 61 18.347 5.368 -3.992
494 HD2 TYR 61 HD1 TYR 61 14.403 6.521 -5.130
495 HE1 TYR 61 HE2 TYR 61 19.295 6.981 -5.607
496 HE2 TYR 61 HE1 TYR 61 15.336 8.142 -6.754
497 HH TYR 61 HH TYR 61 18.666 9.014 -6.840
498 H GLY 62 HN GLY 62 13.602 2.742 -3.424
499 HA2 GLY 62 1HA GLY 62 13.220 0.465 -2.286
500 HA3 GLY 62 2HA GLY 62 14.227 1.137 -0.983
501 H GLU 63 HN GLU 63 11.824 0.306 -0.216
502 HA GLU 63 HA GLU 63 9.629 2.112 -0.689
503 HB2 GLU 63 1HB GLU 63 10.174 0.091 1.488
504 HB3 GLU 63 2HB GLU 63 8.647 0.989 1.317
505 HG2 GLU 63 1HG GLU 63 8.259 -0.113 -0.916
506 HG3 GLU 63 2HG GLU 63 9.877 -0.823 -0.717
507 H GLU 64 HN GLU 64 11.830 1.749 2.100
508 HA GLU 64 HA GLU 64 10.698 3.950 3.572
509 HB2 GLU 64 1HB GLU 64 12.066 2.190 4.582
510 HB3 GLU 64 2HB GLU 64 13.473 2.753 3.649
511 HG2 GLU 64 1HG GLU 64 13.352 4.968 4.916
512 HG3 GLU 64 2HG GLU 64 11.949 4.250 5.740
513 H TYR 65 HN TYR 65 13.478 3.741 1.356
514 HA TYR 65 HA TYR 65 14.267 6.496 1.766
515 HB2 TYR 65 1HB TYR 65 14.826 4.565 -0.495
516 HB3 TYR 65 2HB TYR 65 15.612 6.146 -0.273
517 HD1 TYR 65 HD1 TYR 65 15.317 5.331 2.949
518 HD2 TYR 65 HD2 TYR 65 17.333 3.829 -0.496
519 HE1 TYR 65 HE1 TYR 65 17.018 4.281 4.413
520 HE2 TYR 65 HE2 TYR 65 19.039 2.775 0.950
521 HH TYR 65 HH TYR 65 19.717 2.365 3.087
522 H ALA 66 HN ALA 66 12.008 4.904 -0.393
523 HA ALA 66 HA ALA 66 11.646 7.061 -2.223
524 HB1 ALA 66 3HB ALA 66 9.654 4.973 -1.278
525 HB2 ALA 66 1HB ALA 66 9.474 6.007 -2.714
526 HB3 ALA 66 2HB ALA 66 10.782 4.803 -2.643
527 H VAL 67 HN VAL 67 10.016 6.299 0.852
528 HA VAL 67 HA VAL 67 8.237 8.606 0.754
529 HB VAL 67 HB VAL 67 9.188 6.862 3.064
530 HG11 VAL 67 1HG1 VAL 67 7.326 7.879 4.331
531 HG12 VAL 67 2HG1 VAL 67 8.519 9.109 3.847
532 HG13 VAL 67 3HG1 VAL 67 6.983 8.960 2.961
533 HG21 VAL 67 3HG2 VAL 67 7.873 5.653 1.427
534 HG22 VAL 67 1HG2 VAL 67 6.954 5.883 2.932
535 HG23 VAL 67 2HG2 VAL 67 6.597 6.892 1.511
536 H GLN 68 HN GLN 68 11.423 8.037 2.191
537 HA GLN 68 HA GLN 68 11.526 10.574 3.551
538 HB2 GLN 68 1HB GLN 68 13.663 8.688 2.546
539 HB3 GLN 68 2HB GLN 68 14.008 10.164 3.479
540 HG2 GLN 68 1HG GLN 68 12.612 9.038 5.491
541 HG3 GLN 68 2HG GLN 68 12.396 7.866 4.170
542 HE21 GLN 68 2HE2 GLN 68 13.406 7.249 6.755
543 HE22 GLN 68 1HE2 GLN 68 15.050 6.733 6.578
544 H LEU 69 HN LEU 69 12.523 9.530 0.317
545 HA LEU 69 HA LEU 69 13.811 12.036 -0.349
546 HB2 LEU 69 1HB LEU 69 12.970 9.587 -1.582
547 HB3 LEU 69 2HB LEU 69 13.058 10.897 -2.782
548 HG LEU 69 HG LEU 69 15.381 11.173 -2.485
549 HD11 LEU 69 1HD1 LEU 69 16.659 10.059 -0.635
550 HD12 LEU 69 2HD1 LEU 69 15.385 11.119 0.009
551 HD13 LEU 69 3HD1 LEU 69 15.141 9.357 -0.029
552 HD21 LEU 69 3HD2 LEU 69 14.842 9.182 -3.760
553 HD22 LEU 69 1HD2 LEU 69 16.340 8.923 -2.835
554 HD23 LEU 69 2HD2 LEU 69 14.811 8.203 -2.275
555 H THR 70 HN THR 70 10.580 10.706 -1.056
556 HA THR 70 HA THR 70 9.661 13.009 -2.508
557 HB THR 70 HB THR 70 8.090 10.948 -0.903
558 HG1 THR 70 HG1 THR 70 8.666 11.149 -3.699
559 HG21 THR 70 3HG2 THR 70 7.184 12.935 -3.024
560 HG22 THR 70 1HG2 THR 70 6.170 11.681 -2.272
561 HG23 THR 70 2HG2 THR 70 6.803 13.023 -1.289
562 H LEU 71 HN LEU 71 9.472 12.140 0.933
563 HA LEU 71 HA LEU 71 7.932 14.394 1.762
564 HB2 LEU 71 1HB LEU 71 8.304 12.507 3.046
565 HB3 LEU 71 2HB LEU 71 10.048 12.768 3.274
566 HG LEU 71 HG LEU 71 9.492 14.930 4.436
567 HD11 LEU 71 1HD1 LEU 71 7.146 15.195 5.286
568 HD12 LEU 71 2HD1 LEU 71 7.195 15.212 3.507
569 HD13 LEU 71 3HD1 LEU 71 6.667 13.748 4.370
570 HD21 LEU 71 3HD2 LEU 71 10.078 12.943 5.695
571 HD22 LEU 71 1HD2 LEU 71 8.828 13.865 6.564
572 HD23 LEU 71 2HD2 LEU 71 8.386 12.391 5.668
573 H GLN 72 HN GLN 72 11.451 13.988 1.434
574 HA GLN 72 HA GLN 72 12.132 16.588 2.433
575 HB2 GLN 72 1HB GLN 72 13.707 14.699 2.129
576 HB3 GLN 72 2HB GLN 72 13.553 14.894 0.367
577 HG2 GLN 72 1HG GLN 72 15.680 16.230 0.982
578 HG3 GLN 72 2HG GLN 72 14.179 17.121 0.638
579 HE21 GLN 72 2HE2 GLN 72 14.911 18.952 1.762
580 HE22 GLN 72 1HE2 GLN 72 14.990 18.993 3.493
581 H VAL 73 HN VAL 73 11.367 15.436 -0.835
582 HA VAL 73 HA VAL 73 11.949 18.008 -2.104
583 HB VAL 73 HB VAL 73 10.332 15.600 -3.037
584 HG11 VAL 73 1HG1 VAL 73 10.507 16.623 -5.280
585 HG12 VAL 73 2HG1 VAL 73 9.615 17.681 -4.161
586 HG13 VAL 73 3HG1 VAL 73 11.308 18.044 -4.570
587 HG21 VAL 73 3HG2 VAL 73 12.677 15.090 -2.705
588 HG22 VAL 73 1HG2 VAL 73 12.276 15.126 -4.438
589 HG23 VAL 73 2HG2 VAL 73 13.142 16.493 -3.697
590 H LEU 74 HN LEU 74 9.000 16.446 -0.911
591 HA LEU 74 HA LEU 74 7.181 18.471 -1.749
592 HB2 LEU 74 1HB LEU 74 7.356 16.629 0.526
593 HB3 LEU 74 2HB LEU 74 5.898 17.643 0.411
594 HG LEU 74 HG LEU 74 6.836 15.603 -1.646
595 HD11 LEU 74 1HD1 LEU 74 4.784 14.337 -0.953
596 HD12 LEU 74 2HD1 LEU 74 5.900 14.558 0.415
597 HD13 LEU 74 3HD1 LEU 74 4.449 15.580 0.274
598 HD21 LEU 74 3HD2 LEU 74 5.725 17.489 -2.687
599 HD22 LEU 74 1HD2 LEU 74 4.678 16.051 -2.763
600 HD23 LEU 74 2HD2 LEU 74 4.347 17.332 -1.570
601 H ARG 75 HN ARG 75 9.182 18.243 1.178
602 HA ARG 75 HA ARG 75 8.250 20.765 2.268
603 HB2 ARG 75 1HB ARG 75 10.682 19.134 2.828
604 HB3 ARG 75 2HB ARG 75 10.274 20.659 3.648
605 HG2 ARG 75 1HG ARG 75 8.247 19.694 4.548
606 HG3 ARG 75 2HG ARG 75 8.501 18.198 3.615
607 HD2 ARG 75 1HD ARG 75 10.490 17.732 4.908
608 HD3 ARG 75 2HD ARG 75 10.235 19.227 5.839
609 HE ARG 75 HE ARG 75 7.908 17.599 6.272
610 HH11 ARG 75 1HH1 ARG 75 11.333 17.330 6.868
611 HH12 ARG 75 2HH1 ARG 75 11.017 16.340 8.279
612 HH21 ARG 75 1HH2 ARG 75 7.529 16.459 7.880
613 HH22 ARG 75 2HH2 ARG 75 8.847 15.842 8.857
614 H ALA 76 HN ALA 76 10.797 19.837 0.027
615 HA ALA 76 HA ALA 76 12.167 22.359 0.051
616 HB1 ALA 76 3HB ALA 76 11.965 20.266 -2.143
617 HB2 ALA 76 1HB ALA 76 13.141 21.599 -2.082
618 HB3 ALA 76 2HB ALA 76 13.187 20.317 -0.849
619 H ILE 77 HN ILE 77 9.322 21.182 -1.643
620 HA ILE 77 HA ILE 77 9.198 23.706 -3.247
621 HB ILE 77 HB ILE 77 7.374 22.597 -4.468
622 HG12 ILE 77 1HG1 ILE 77 7.811 20.235 -2.661
623 HG13 ILE 77 2HG1 ILE 77 6.498 21.422 -2.482
624 HG21 ILE 77 1HG2 ILE 77 8.632 20.720 -5.467
625 HG22 ILE 77 2HG2 ILE 77 9.687 22.126 -5.201
626 HG23 ILE 77 3HG2 ILE 77 9.757 20.738 -4.089
627 HD11 ILE 77 3HD1 ILE 77 6.959 19.632 -4.894
628 HD12 ILE 77 1HD1 ILE 77 5.714 19.397 -3.646
629 HD13 ILE 77 2HD1 ILE 77 5.646 20.820 -4.714
630 H ASN 78 HN ASN 78 8.478 22.992 -0.234
631 HA ASN 78 HA ASN 78 7.145 24.136 1.288
632 HB2 ASN 78 1HB ASN 78 7.685 26.221 -0.498
633 HB3 ASN 78 2HB ASN 78 6.032 25.640 -0.815
634 HD21 ASN 78 2HD2 ASN 78 5.569 27.905 -0.265
635 HD22 ASN 78 1HD2 ASN 78 5.299 28.299 1.401
636 H GLN 79 HN GLN 79 6.132 21.806 0.093
637 HA GLN 79 HA GLN 79 3.208 22.445 0.261
638 HB2 GLN 79 1HB GLN 79 4.702 20.050 -0.820
639 HB3 GLN 79 2HB GLN 79 2.943 20.083 -0.552
640 HG2 GLN 79 1HG GLN 79 4.397 21.857 -2.705
641 HG3 GLN 79 2HG GLN 79 3.461 20.345 -2.691
642 HE21 GLN 79 2HE2 GLN 79 3.308 23.633 -3.175
643 HE22 GLN 79 1HE2 GLN 79 1.611 23.879 -2.931
644 H ARG 80 HN ARG 80 3.458 22.784 2.542
645 HA ARG 80 HA ARG 80 4.351 20.687 4.302
646 HB2 ARG 80 1HB ARG 80 4.287 22.959 4.998
647 HB3 ARG 80 2HB ARG 80 2.515 22.978 4.840
648 HG2 ARG 80 1HG ARG 80 2.288 21.362 6.629
649 HG3 ARG 80 2HG ARG 80 4.057 21.178 6.732
650 HD2 ARG 80 1HD ARG 80 4.291 23.400 7.539
651 HD3 ARG 80 2HD ARG 80 2.556 23.713 7.299
652 HE ARG 80 HE ARG 80 2.765 21.595 9.244
653 HH11 ARG 80 1HH1 ARG 80 3.689 24.948 8.993
654 HH12 ARG 80 2HH1 ARG 80 3.505 25.134 10.726
655 HH21 ARG 80 1HH2 ARG 80 2.555 21.791 11.231
656 HH22 ARG 80 2HH2 ARG 80 2.858 23.335 12.004
657 H LEU 81 HN LEU 81 1.192 21.491 2.927
658 HA LEU 81 HA LEU 81 -0.410 19.726 4.446
659 HB2 LEU 81 1HB LEU 81 -1.274 21.284 3.023
660 HB3 LEU 81 2HB LEU 81 -0.621 20.600 1.516
661 HG LEU 81 HG LEU 81 -2.006 18.537 1.965
662 HD11 LEU 81 1HD1 LEU 81 -3.938 18.801 3.544
663 HD12 LEU 81 2HD1 LEU 81 -2.382 18.931 4.398
664 HD13 LEU 81 3HD1 LEU 81 -3.313 20.399 4.016
665 HD21 LEU 81 3HD2 LEU 81 -2.688 20.189 0.327
666 HD22 LEU 81 1HD2 LEU 81 -4.117 19.542 1.167
667 HD23 LEU 81 2HD2 LEU 81 -3.488 21.153 1.590
668 H LEU 82 HN LEU 82 1.278 19.037 1.370
669 HA LEU 82 HA LEU 82 0.458 16.244 1.436
670 HB2 LEU 82 1HB LEU 82 2.471 17.788 -0.060
671 HB3 LEU 82 2HB LEU 82 2.165 16.093 -0.504
672 HG LEU 82 HG LEU 82 0.185 18.398 -0.667
673 HD11 LEU 82 1HD1 LEU 82 0.313 17.980 -3.138
674 HD12 LEU 82 2HD1 LEU 82 1.904 18.415 -2.472
675 HD13 LEU 82 3HD1 LEU 82 1.529 16.715 -2.845
676 HD21 LEU 82 3HD2 LEU 82 -0.926 16.335 -0.040
677 HD22 LEU 82 1HD2 LEU 82 -1.339 16.761 -1.717
678 HD23 LEU 82 2HD2 LEU 82 -0.152 15.474 -1.390
679 H ALA 83 HN ALA 83 3.234 18.049 2.565
680 HA ALA 83 HA ALA 83 4.948 15.793 3.015
681 HB1 ALA 83 3HB ALA 83 4.805 18.458 4.468
682 HB2 ALA 83 1HB ALA 83 6.144 17.291 4.565
683 HB3 ALA 83 2HB ALA 83 5.780 18.101 3.022
684 H GLU 84 HN GLU 84 2.509 17.401 5.044
685 HA GLU 84 HA GLU 84 2.976 15.640 7.320
686 HB2 GLU 84 1HB GLU 84 0.753 17.534 6.562
687 HB3 GLU 84 2HB GLU 84 0.755 16.571 8.060
688 HG2 GLU 84 1HG GLU 84 2.907 17.756 8.752
689 HG3 GLU 84 2HG GLU 84 2.765 18.610 7.199
690 H GLU 85 HN GLU 85 0.783 15.648 4.555
691 HA GLU 85 HA GLU 85 -0.833 13.430 5.433
692 HB2 GLU 85 1HB GLU 85 -0.148 14.571 2.730
693 HB3 GLU 85 2HB GLU 85 -1.211 13.158 2.938
694 HG2 GLU 85 1HG GLU 85 -1.769 15.994 3.999
695 HG3 GLU 85 2HG GLU 85 -2.485 15.119 2.625
696 H LEU 86 HN LEU 86 2.165 13.618 3.536
697 HA LEU 86 HA LEU 86 2.342 10.749 3.147
698 HB2 LEU 86 1HB LEU 86 3.365 12.273 1.753
699 HB3 LEU 86 2HB LEU 86 4.451 12.970 2.978
700 HG LEU 86 HG LEU 86 5.534 10.734 3.223
701 HD11 LEU 86 1HD1 LEU 86 5.113 9.025 1.435
702 HD12 LEU 86 2HD1 LEU 86 3.639 9.353 2.375
703 HD13 LEU 86 3HD1 LEU 86 3.842 10.069 0.758
704 HD21 LEU 86 3HD2 LEU 86 6.543 12.437 1.823
705 HD22 LEU 86 1HD2 LEU 86 6.807 10.828 1.108
706 HD23 LEU 86 2HD2 LEU 86 5.567 11.911 0.430
707 H HIS 87 HN HIS 87 3.667 12.999 5.552
708 HA HIS 87 HA HIS 87 5.199 11.126 7.038
709 HB2 HIS 87 1HB HIS 87 5.302 13.530 7.522
710 HB3 HIS 87 2HB HIS 87 3.592 13.529 8.014
711 HD1 HIS 87 HD1 HIS 87 6.944 12.087 9.083
712 HD2 HIS 87 HD2 HIS 87 3.208 13.057 10.773
713 HE1 HIS 87 HE1 HIS 87 7.163 11.679 11.482
714 H ARG 88 HN ARG 88 1.748 11.967 7.345
715 HA ARG 88 HA ARG 88 1.267 10.048 9.462
716 HB2 ARG 88 1HB ARG 88 -0.567 11.497 7.614
717 HB3 ARG 88 2HB ARG 88 -1.106 10.334 8.848
718 HG2 ARG 88 1HG ARG 88 -0.154 11.718 10.611
719 HG3 ARG 88 2HG ARG 88 0.485 12.857 9.402
720 HD2 ARG 88 1HD ARG 88 -1.759 13.441 8.750
721 HD3 ARG 88 2HD ARG 88 -2.413 12.279 9.929
722 HE ARG 88 HE ARG 88 -0.887 14.216 11.422
723 HH11 ARG 88 1HH1 ARG 88 -3.729 14.195 9.402
724 HH12 ARG 88 2HH1 ARG 88 -4.398 15.530 10.319
725 HH21 ARG 88 1HH2 ARG 88 -1.635 15.751 12.476
726 HH22 ARG 88 2HH2 ARG 88 -3.204 16.420 12.072
727 H ALA 89 HN ALA 89 1.128 9.907 5.940
728 HA ALA 89 HA ALA 89 -0.053 7.297 5.788
729 HB1 ALA 89 3HB ALA 89 1.846 8.694 3.873
730 HB2 ALA 89 1HB ALA 89 0.874 7.250 3.506
731 HB3 ALA 89 2HB ALA 89 0.071 8.800 3.853
732 H ALA 90 HN ALA 90 3.273 8.416 6.196
733 HA ALA 90 HA ALA 90 4.454 5.791 5.966
734 HB1 ALA 90 3HB ALA 90 5.464 8.291 7.365
735 HB2 ALA 90 1HB ALA 90 6.431 6.844 6.995
736 HB3 ALA 90 2HB ALA 90 5.774 7.839 5.672
737 H ILE 91 HN ILE 91 3.106 7.664 8.641
738 HA ILE 91 HA ILE 91 3.832 5.800 10.734
739 HB ILE 91 HB ILE 91 1.537 7.791 10.466
740 HG12 ILE 91 1HG1 ILE 91 4.005 7.901 12.175
741 HG13 ILE 91 2HG1 ILE 91 3.866 8.641 10.563
742 HG21 ILE 91 1HG2 ILE 91 1.188 7.451 12.889
743 HG22 ILE 91 2HG2 ILE 91 0.905 5.946 11.983
744 HG23 ILE 91 3HG2 ILE 91 2.421 6.169 12.888
745 HD11 ILE 91 3HD1 ILE 91 2.152 9.312 12.981
746 HD12 ILE 91 1HD1 ILE 91 3.482 10.303 12.341
747 HD13 ILE 91 2HD1 ILE 91 2.013 10.051 11.369
748 H GLN 92 HN GLN 92 0.998 6.013 8.613
749 HA GLN 92 HA GLN 92 -0.252 3.663 9.775
750 HB2 GLN 92 1HB GLN 92 -0.587 5.092 7.132
751 HB3 GLN 92 2HB GLN 92 -1.572 3.700 7.642
752 HG2 GLN 92 1HG GLN 92 -2.422 5.264 9.680
753 HG3 GLN 92 2HG GLN 92 -1.224 6.296 8.863
754 HE21 GLN 92 2HE2 GLN 92 -3.869 7.097 9.354
755 HE22 GLN 92 1HE2 GLN 92 -4.691 7.258 7.838
756 H LEU 93 HN LEU 93 2.070 4.216 7.199
757 HA LEU 93 HA LEU 93 1.957 1.675 5.940
758 HB2 LEU 93 1HB LEU 93 3.111 3.531 5.149
759 HB3 LEU 93 2HB LEU 93 4.367 3.516 6.408
760 HG LEU 93 HG LEU 93 4.946 1.162 5.595
761 HD11 LEU 93 1HD1 LEU 93 4.308 0.663 3.220
762 HD12 LEU 93 2HD1 LEU 93 2.871 0.791 4.262
763 HD13 LEU 93 3HD1 LEU 93 3.318 2.141 3.192
764 HD21 LEU 93 3HD2 LEU 93 6.364 3.080 5.161
765 HD22 LEU 93 1HD2 LEU 93 6.347 2.004 3.742
766 HD23 LEU 93 2HD2 LEU 93 5.395 3.510 3.731
Start of MODEL 10
1 H THR 4 1H THR 4 0.446 -0.942 0.954
2 HA THR 4 HA THR 4 2.750 -0.285 2.513
3 HB THR 4 HB THR 4 4.049 -0.617 0.483
4 HG1 THR 4 HG1 THR 4 1.523 -0.302 -0.798
5 HG21 THR 4 3HG2 THR 4 1.647 -2.486 0.537
6 HG22 THR 4 1HG2 THR 4 3.219 -2.834 -0.222
7 HG23 THR 4 2HG2 THR 4 3.105 -2.639 1.545
8 HA PRO 5 HA PRO 5 3.531 3.988 2.125
9 HB2 PRO 5 1HB PRO 5 6.229 3.236 0.930
10 HB3 PRO 5 2HB PRO 5 5.889 4.294 2.306
11 HG2 PRO 5 1HG PRO 5 6.845 1.847 2.749
12 HG3 PRO 5 2HG PRO 5 5.568 2.479 3.797
13 HD2 PRO 5 1HD PRO 5 5.341 0.466 1.523
14 HD3 PRO 5 2HD PRO 5 4.512 0.474 3.085
15 H SER 6 HN SER 6 4.265 1.924 -0.639
16 HA SER 6 HA SER 6 4.568 4.009 -2.624
17 HB2 SER 6 1HB SER 6 4.429 2.401 -4.202
18 HB3 SER 6 2HB SER 6 5.347 1.743 -2.827
19 HG SER 6 HG SER 6 3.360 0.709 -2.191
20 H ASP 7 HN ASP 7 1.787 2.498 -1.080
21 HA ASP 7 HA ASP 7 -0.136 3.249 -3.135
22 HB2 ASP 7 1HB ASP 7 -0.598 2.434 -0.202
23 HB3 ASP 7 2HB ASP 7 -1.759 2.776 -1.509
24 H HIS 8 HN HIS 8 1.257 4.822 -0.351
25 HA HIS 8 HA HIS 8 -0.672 7.061 -0.534
26 HB2 HIS 8 1HB HIS 8 1.812 6.642 1.191
27 HB3 HIS 8 2HB HIS 8 0.734 8.054 1.282
28 HD1 HIS 8 HD1 HIS 8 0.964 4.461 2.225
29 HD2 HIS 8 HD2 HIS 8 -1.813 7.549 2.616
30 HE1 HIS 8 HE1 HIS 8 -0.650 3.642 3.812
31 H LEU 9 HN LEU 9 2.592 6.251 -1.541
32 HA LEU 9 HA LEU 9 3.361 8.939 -2.267
33 HB2 LEU 9 1HB LEU 9 4.163 6.241 -3.124
34 HB3 LEU 9 2HB LEU 9 5.085 7.640 -3.724
35 HG LEU 9 HG LEU 9 4.791 6.820 -0.807
36 HD11 LEU 9 1HD1 LEU 9 7.224 6.231 -0.976
37 HD12 LEU 9 2HD1 LEU 9 6.244 5.260 -2.099
38 HD13 LEU 9 3HD1 LEU 9 7.187 6.641 -2.706
39 HD21 LEU 9 3HD2 LEU 9 5.012 9.220 -1.076
40 HD22 LEU 9 1HD2 LEU 9 6.506 8.546 -0.383
41 HD23 LEU 9 2HD2 LEU 9 6.449 9.002 -2.103
42 H LEU 10 HN LEU 10 1.676 6.347 -3.964
43 HA LEU 10 HA LEU 10 1.679 7.552 -6.559
44 HB2 LEU 10 1HB LEU 10 -0.150 5.804 -5.068
45 HB3 LEU 10 2HB LEU 10 -0.547 6.162 -6.765
46 HG LEU 10 HG LEU 10 1.998 4.803 -5.802
47 HD11 LEU 10 1HD1 LEU 10 1.021 2.739 -6.841
48 HD12 LEU 10 2HD1 LEU 10 -0.005 3.345 -5.521
49 HD13 LEU 10 3HD1 LEU 10 -0.462 3.648 -7.214
50 HD21 LEU 10 3HD2 LEU 10 2.320 6.079 -7.838
51 HD22 LEU 10 1HD2 LEU 10 2.376 4.337 -8.198
52 HD23 LEU 10 2HD2 LEU 10 0.920 5.283 -8.593
53 H SER 11 HN SER 11 -0.495 7.960 -3.785
54 HA SER 11 HA SER 11 -2.367 9.733 -5.220
55 HB2 SER 11 1HB SER 11 -3.473 9.964 -3.240
56 HB3 SER 11 2HB SER 11 -3.056 8.252 -3.489
57 HG SER 11 HG SER 11 -2.679 8.956 -1.342
58 H THR 12 HN THR 12 0.604 10.053 -3.365
59 HA THR 12 HA THR 12 0.311 12.767 -2.507
60 HB THR 12 HB THR 12 2.833 11.220 -3.238
61 HG1 THR 12 HG1 THR 12 1.543 11.702 -0.729
62 HG21 THR 12 3HG2 THR 12 2.459 13.770 -1.617
63 HG22 THR 12 1HG2 THR 12 3.992 12.895 -1.841
64 HG23 THR 12 2HG2 THR 12 3.194 13.665 -3.234
65 H LEU 13 HN LEU 13 1.846 11.435 -5.443
66 HA LEU 13 HA LEU 13 2.234 14.177 -6.473
67 HB2 LEU 13 1HB LEU 13 2.761 11.471 -7.511
68 HB3 LEU 13 2HB LEU 13 3.290 12.894 -8.438
69 HG LEU 13 HG LEU 13 4.286 12.012 -5.702
70 HD11 LEU 13 1HD1 LEU 13 6.477 11.759 -6.896
71 HD12 LEU 13 2HD1 LEU 13 5.226 10.719 -7.615
72 HD13 LEU 13 3HD1 LEU 13 5.687 12.241 -8.416
73 HD21 LEU 13 3HD2 LEU 13 4.130 14.428 -5.803
74 HD22 LEU 13 1HD2 LEU 13 5.838 13.929 -5.841
75 HD23 LEU 13 2HD2 LEU 13 5.028 14.452 -7.338
76 H GLU 14 HN GLU 14 -0.051 11.602 -6.742
77 HA GLU 14 HA GLU 14 -1.288 12.435 -9.212
78 HB2 GLU 14 1HB GLU 14 -1.694 10.271 -8.137
79 HB3 GLU 14 2HB GLU 14 -2.475 11.105 -6.772
80 HG2 GLU 14 1HG GLU 14 -4.274 11.934 -8.379
81 HG3 GLU 14 2HG GLU 14 -3.351 11.069 -9.630
82 H GLU 15 HN GLU 15 -1.837 13.344 -5.817
83 HA GLU 15 HA GLU 15 -3.957 15.232 -6.553
84 HB2 GLU 15 1HB GLU 15 -2.418 14.749 -4.000
85 HB3 GLU 15 2HB GLU 15 -3.738 15.931 -4.175
86 HG2 GLU 15 1HG GLU 15 -5.330 14.025 -4.695
87 HG3 GLU 15 2HG GLU 15 -3.901 12.973 -4.577
88 H LEU 16 HN LEU 16 -0.496 15.336 -6.080
89 HA LEU 16 HA LEU 16 -0.224 18.184 -5.865
90 HB2 LEU 16 1HB LEU 16 1.426 16.616 -5.350
91 HB3 LEU 16 2HB LEU 16 1.703 16.099 -7.029
92 HG LEU 16 HG LEU 16 2.363 18.464 -7.568
93 HD11 LEU 16 1HD1 LEU 16 2.982 19.946 -5.642
94 HD12 LEU 16 2HD1 LEU 16 1.245 19.562 -5.629
95 HD13 LEU 16 3HD1 LEU 16 2.351 18.722 -4.516
96 HD21 LEU 16 3HD2 LEU 16 4.038 16.747 -7.217
97 HD22 LEU 16 1HD2 LEU 16 4.614 18.299 -6.564
98 HD23 LEU 16 2HD2 LEU 16 4.011 17.038 -5.462
99 H VAL 17 HN VAL 17 -0.498 19.774 -7.209
100 HA VAL 17 HA VAL 17 -1.602 19.234 -9.866
101 HB VAL 17 HB VAL 17 -1.694 21.671 -10.084
102 HG11 VAL 17 1HG1 VAL 17 -3.107 22.193 -8.123
103 HG12 VAL 17 2HG1 VAL 17 -3.458 20.565 -8.750
104 HG13 VAL 17 3HG1 VAL 17 -2.470 20.760 -7.284
105 HG21 VAL 17 3HG2 VAL 17 0.458 22.223 -9.119
106 HG22 VAL 17 1HG2 VAL 17 -0.843 23.151 -8.336
107 HG23 VAL 17 2HG2 VAL 17 -0.125 21.752 -7.504
108 HA PRO 18 HA PRO 18 1.750 19.124 -12.527
109 HB2 PRO 18 1HB PRO 18 0.360 21.320 -14.121
110 HB3 PRO 18 2HB PRO 18 0.938 19.745 -14.684
111 HG2 PRO 18 1HG PRO 18 -1.675 20.118 -14.316
112 HG3 PRO 18 2HG PRO 18 -0.939 18.591 -13.810
113 HD2 PRO 18 1HD PRO 18 -1.787 20.955 -12.093
114 HD3 PRO 18 2HD PRO 18 -1.920 19.227 -11.745
115 H TYR 19 HN TYR 19 0.659 22.316 -11.493
116 HA TYR 19 HA TYR 19 2.942 23.765 -12.438
117 HB2 TYR 19 1HB TYR 19 0.896 24.867 -11.774
118 HB3 TYR 19 2HB TYR 19 1.082 24.266 -10.108
119 HD1 TYR 19 HD1 TYR 19 2.796 26.398 -12.665
120 HD2 TYR 19 HD2 TYR 19 2.195 25.585 -8.523
121 HE1 TYR 19 HE1 TYR 19 4.102 28.422 -12.086
122 HE2 TYR 19 HE2 TYR 19 3.495 27.600 -7.927
123 HH TYR 19 HH TYR 19 4.856 29.768 -10.415
124 H ASP 20 HN ASP 20 2.270 22.347 -9.230
125 HA ASP 20 HA ASP 20 5.053 22.969 -8.405
126 HB2 ASP 20 1HB ASP 20 2.734 21.722 -6.807
127 HB3 ASP 20 2HB ASP 20 4.416 22.069 -6.335
128 H PHE 21 HN PHE 21 3.242 20.370 -9.721
129 HA PHE 21 HA PHE 21 4.977 18.220 -8.852
130 HB2 PHE 21 1HB PHE 21 2.758 17.740 -9.786
131 HB3 PHE 21 2HB PHE 21 3.218 18.499 -11.327
132 HD1 PHE 21 HD1 PHE 21 4.187 15.736 -9.024
133 HD2 PHE 21 HD2 PHE 21 4.069 17.226 -13.026
134 HE1 PHE 21 HE1 PHE 21 4.992 13.553 -9.858
135 HE2 PHE 21 HE2 PHE 21 4.872 15.043 -13.865
136 HZ PHE 21 HZ PHE 21 5.335 13.206 -12.279
137 H GLU 22 HN GLU 22 4.990 20.383 -11.676
138 HA GLU 22 HA GLU 22 7.365 19.322 -12.879
139 HB2 GLU 22 1HB GLU 22 5.781 20.920 -13.927
140 HB3 GLU 22 2HB GLU 22 6.390 22.182 -12.828
141 HG2 GLU 22 1HG GLU 22 7.594 22.516 -14.937
142 HG3 GLU 22 2HG GLU 22 8.643 21.731 -13.735
143 H LYS 23 HN LYS 23 6.887 21.714 -10.306
144 HA LYS 23 HA LYS 23 9.712 22.282 -9.984
145 HB2 LYS 23 1HB LYS 23 7.353 22.528 -8.114
146 HB3 LYS 23 2HB LYS 23 8.998 23.096 -7.742
147 HG2 LYS 23 1HG LYS 23 8.890 24.640 -9.668
148 HG3 LYS 23 2HG LYS 23 7.232 24.088 -10.006
149 HD2 LYS 23 1HD LYS 23 6.580 24.841 -7.707
150 HD3 LYS 23 2HD LYS 23 8.212 25.526 -7.518
151 HE2 LYS 23 1HE LYS 23 7.825 26.954 -9.495
152 HE3 LYS 23 2HE LYS 23 6.179 26.294 -9.635
153 HZ1 LYS 23 3HZ LYS 23 7.222 27.821 -7.336
154 HZ2 LYS 23 1HZ LYS 23 6.195 28.404 -8.488
155 HZ3 LYS 23 2HZ LYS 23 5.696 27.207 -7.467
156 H PHE 24 HN PHE 24 7.501 19.899 -8.582
157 HA PHE 24 HA PHE 24 9.290 18.827 -6.633
158 HB2 PHE 24 1HB PHE 24 6.845 18.271 -6.807
159 HB3 PHE 24 2HB PHE 24 7.204 17.316 -8.262
160 HD1 PHE 24 HD2 PHE 24 8.580 15.284 -8.096
161 HD2 PHE 24 HD1 PHE 24 7.252 17.434 -4.651
162 HE1 PHE 24 HE2 PHE 24 9.038 13.304 -6.687
163 HE2 PHE 24 HE1 PHE 24 7.711 15.458 -3.239
164 HZ PHE 24 HZ PHE 24 8.604 13.392 -4.257
165 H LYS 25 HN LYS 25 8.823 17.956 -10.058
166 HA LYS 25 HA LYS 25 10.820 15.894 -10.097
167 HB2 LYS 25 1HB LYS 25 9.756 17.722 -12.252
168 HB3 LYS 25 2HB LYS 25 10.873 16.368 -12.547
169 HG2 LYS 25 1HG LYS 25 9.174 14.809 -11.614
170 HG3 LYS 25 2HG LYS 25 8.053 16.180 -11.435
171 HD2 LYS 25 1HD LYS 25 9.272 15.205 -14.043
172 HD3 LYS 25 2HD LYS 25 7.608 14.890 -13.494
173 HE2 LYS 25 1HE LYS 25 7.192 17.333 -13.447
174 HE3 LYS 25 2HE LYS 25 8.833 17.605 -14.074
175 HZ1 LYS 25 3HZ LYS 25 6.691 16.125 -15.461
176 HZ2 LYS 25 1HZ LYS 25 7.192 17.654 -15.827
177 HZ3 LYS 25 2HZ LYS 25 8.215 16.376 -16.044
178 H PHE 26 HN PHE 26 11.005 19.391 -10.662
179 HA PHE 26 HA PHE 26 13.736 19.439 -11.526
180 HB2 PHE 26 1HB PHE 26 12.265 21.381 -11.822
181 HB3 PHE 26 2HB PHE 26 12.096 21.552 -10.061
182 HD1 PHE 26 HD1 PHE 26 14.543 21.694 -12.844
183 HD2 PHE 26 HD2 PHE 26 13.605 22.796 -8.825
184 HE1 PHE 26 HE1 PHE 26 16.499 23.204 -12.804
185 HE2 PHE 26 HE2 PHE 26 15.560 24.309 -8.781
186 HZ PHE 26 HZ PHE 26 17.008 24.511 -10.771
187 H LYS 27 HN LYS 27 12.285 19.504 -8.296
188 HA LYS 27 HA LYS 27 14.910 19.947 -7.031
189 HB2 LYS 27 1HB LYS 27 12.166 19.355 -5.910
190 HB3 LYS 27 2HB LYS 27 13.621 19.676 -4.935
191 HG2 LYS 27 1HG LYS 27 12.332 21.611 -6.892
192 HG3 LYS 27 2HG LYS 27 12.165 21.667 -5.122
193 HD2 LYS 27 1HD LYS 27 14.625 21.938 -4.924
194 HD3 LYS 27 2HD LYS 27 14.744 21.958 -6.700
195 HE2 LYS 27 1HE LYS 27 13.299 23.949 -6.771
196 HE3 LYS 27 2HE LYS 27 13.188 23.930 -4.996
197 HZ1 LYS 27 3HZ LYS 27 15.665 24.299 -6.556
198 HZ2 LYS 27 1HZ LYS 27 14.842 25.491 -5.768
199 HZ3 LYS 27 2HZ LYS 27 15.563 24.281 -4.909
200 H LEU 28 HN LEU 28 12.845 17.265 -7.855
201 HA LEU 28 HA LEU 28 14.108 15.356 -6.069
202 HB2 LEU 28 1HB LEU 28 11.978 15.078 -6.908
203 HB3 LEU 28 2HB LEU 28 12.447 14.980 -8.621
204 HG LEU 28 HG LEU 28 13.797 12.930 -8.039
205 HD11 LEU 28 1HD1 LEU 28 13.205 11.758 -5.902
206 HD12 LEU 28 2HD1 LEU 28 13.956 13.338 -5.585
207 HD13 LEU 28 3HD1 LEU 28 12.193 13.145 -5.440
208 HD21 LEU 28 3HD2 LEU 28 11.636 12.754 -9.123
209 HD22 LEU 28 1HD2 LEU 28 11.845 11.418 -7.967
210 HD23 LEU 28 2HD2 LEU 28 10.809 12.804 -7.548
211 H GLN 29 HN GLN 29 14.603 16.258 -9.471
212 HA GLN 29 HA GLN 29 16.626 14.226 -9.912
213 HB2 GLN 29 1HB GLN 29 16.962 15.233 -12.003
214 HB3 GLN 29 2HB GLN 29 15.219 15.364 -11.662
215 HG2 GLN 29 1HG GLN 29 15.742 17.947 -10.991
216 HG3 GLN 29 2HG GLN 29 17.346 17.303 -11.412
217 HE21 GLN 29 2HE2 GLN 29 16.246 19.577 -12.625
218 HE22 GLN 29 1HE2 GLN 29 15.923 19.221 -14.288
219 H ASN 30 HN ASN 30 16.648 17.272 -8.350
220 HA ASN 30 HA ASN 30 19.602 17.511 -8.568
221 HB2 ASN 30 1HB ASN 30 17.653 19.419 -7.067
222 HB3 ASN 30 2HB ASN 30 19.418 19.235 -7.205
223 HD21 ASN 30 2HD2 ASN 30 17.356 21.298 -8.075
224 HD22 ASN 30 1HD2 ASN 30 17.757 21.611 -9.731
225 H THR 31 HN THR 31 17.364 15.846 -6.695
226 HA THR 31 HA THR 31 18.676 16.012 -4.120
227 HB THR 31 HB THR 31 16.934 13.784 -5.257
228 HG1 THR 31 HG1 THR 31 16.262 16.079 -3.684
229 HG21 THR 31 3HG2 THR 31 17.639 14.547 -2.396
230 HG22 THR 31 1HG2 THR 31 16.511 13.260 -2.880
231 HG23 THR 31 2HG2 THR 31 18.242 13.120 -3.268
232 H SER 32 HN SER 32 20.212 14.848 -3.173
233 HA SER 32 HA SER 32 22.264 13.635 -4.849
234 HB2 SER 32 1HB SER 32 23.455 13.280 -2.946
235 HB3 SER 32 2HB SER 32 22.700 14.889 -2.864
236 HG SER 32 HG SER 32 22.543 13.733 -0.894
237 H VAL 33 HN VAL 33 23.169 11.465 -4.266
238 HA VAL 33 HA VAL 33 21.049 9.414 -3.707
239 HB VAL 33 HB VAL 33 21.220 9.625 -6.180
240 HG11 VAL 33 1HG1 VAL 33 23.342 9.018 -7.293
241 HG12 VAL 33 2HG1 VAL 33 23.537 10.479 -6.298
242 HG13 VAL 33 3HG1 VAL 33 24.143 8.913 -5.709
243 HG21 VAL 33 3HG2 VAL 33 20.719 7.472 -5.189
244 HG22 VAL 33 1HG2 VAL 33 21.713 7.279 -6.653
245 HG23 VAL 33 2HG2 VAL 33 22.457 7.113 -5.044
246 H GLN 34 HN GLN 34 21.629 7.668 -2.657
247 HA GLN 34 HA GLN 34 24.300 7.753 -1.405
248 HB2 GLN 34 1HB GLN 34 21.997 5.819 -1.067
249 HB3 GLN 34 2HB GLN 34 23.464 5.896 -0.062
250 HG2 GLN 34 1HG GLN 34 21.196 8.071 -0.019
251 HG3 GLN 34 2HG GLN 34 21.764 6.744 1.022
252 HE21 GLN 34 2HE2 GLN 34 21.988 10.040 0.316
253 HE22 GLN 34 1HE2 GLN 34 23.416 10.407 1.227
254 H LYS 35 HN LYS 35 25.662 5.894 -1.222
255 HA LYS 35 HA LYS 35 26.048 4.601 -3.825
256 HB2 LYS 35 1HB LYS 35 27.446 4.320 -1.162
257 HB3 LYS 35 2HB LYS 35 27.934 3.484 -2.655
258 HG2 LYS 35 1HG LYS 35 28.355 5.653 -3.737
259 HG3 LYS 35 2HG LYS 35 27.860 6.494 -2.248
260 HD2 LYS 35 1HD LYS 35 29.703 5.427 -1.022
261 HD3 LYS 35 2HD LYS 35 30.193 4.563 -2.499
262 HE2 LYS 35 1HE LYS 35 30.619 6.711 -3.615
263 HE3 LYS 35 2HE LYS 35 30.127 7.576 -2.141
264 HZ1 LYS 35 3HZ LYS 35 32.422 5.735 -2.363
265 HZ2 LYS 35 1HZ LYS 35 32.515 7.381 -2.302
266 HZ3 LYS 35 2HZ LYS 35 31.966 6.537 -0.996
267 H GLU 36 HN GLU 36 24.285 3.890 -0.993
268 HA GLU 36 HA GLU 36 24.399 0.963 -1.363
269 HB2 GLU 36 1HB GLU 36 22.728 2.741 0.420
270 HB3 GLU 36 2HB GLU 36 22.691 0.961 0.424
271 HG2 GLU 36 1HG GLU 36 25.131 0.957 1.149
272 HG3 GLU 36 2HG GLU 36 25.023 2.729 1.039
273 H HIS 37 HN HIS 37 22.660 3.569 -2.688
274 HA HIS 37 HA HIS 37 20.521 1.680 -3.614
275 HB2 HIS 37 1HB HIS 37 20.269 4.673 -3.061
276 HB3 HIS 37 2HB HIS 37 18.985 3.612 -3.691
277 HD1 HIS 37 HD1 HIS 37 18.407 1.517 -1.974
278 HD2 HIS 37 HD2 HIS 37 20.202 4.924 -0.262
279 HE1 HIS 37 HE1 HIS 37 17.858 1.445 0.406
280 H SER 38 HN SER 38 19.374 2.615 -5.603
281 HA SER 38 HA SER 38 21.497 3.005 -7.687
282 HB2 SER 38 1HB SER 38 18.652 2.227 -7.873
283 HB3 SER 38 2HB SER 38 19.771 2.491 -9.230
284 HG SER 38 HG SER 38 19.656 0.297 -8.586
285 H ARG 39 HN ARG 39 21.370 4.636 -9.231
286 HA ARG 39 HA ARG 39 19.978 7.101 -8.298
287 HB2 ARG 39 1HB ARG 39 22.369 7.186 -8.700
288 HB3 ARG 39 2HB ARG 39 22.065 6.809 -10.412
289 HG2 ARG 39 1HG ARG 39 20.773 8.874 -10.652
290 HG3 ARG 39 2HG ARG 39 21.028 9.245 -8.929
291 HD2 ARG 39 1HD ARG 39 22.491 10.576 -10.200
292 HD3 ARG 39 2HD ARG 39 23.453 9.321 -9.383
293 HE ARG 39 HE ARG 39 22.937 8.523 -12.152
294 HH11 ARG 39 1HH1 ARG 39 24.868 10.749 -10.289
295 HH12 ARG 39 2HH1 ARG 39 26.107 10.722 -11.529
296 HH21 ARG 39 1HH2 ARG 39 24.341 8.488 -13.586
297 HH22 ARG 39 2HH2 ARG 39 25.807 9.434 -13.410
298 H ILE 40 HN ILE 40 18.266 7.918 -9.207
299 HA ILE 40 HA ILE 40 17.208 6.702 -11.700
300 HB ILE 40 HB ILE 40 16.109 8.921 -9.913
301 HG12 ILE 40 1HG1 ILE 40 15.195 6.068 -10.133
302 HG13 ILE 40 2HG1 ILE 40 16.319 6.665 -8.890
303 HG21 ILE 40 1HG2 ILE 40 14.003 8.545 -11.152
304 HG22 ILE 40 2HG2 ILE 40 15.306 9.062 -12.247
305 HG23 ILE 40 3HG2 ILE 40 14.823 7.350 -12.184
306 HD11 ILE 40 3HD1 ILE 40 13.472 7.634 -9.326
307 HD12 ILE 40 1HD1 ILE 40 14.015 6.549 -8.024
308 HD13 ILE 40 2HD1 ILE 40 14.595 8.231 -8.083
309 HA PRO 41 HA PRO 41 19.201 9.545 -14.376
310 HB2 PRO 41 1HB PRO 41 16.870 8.677 -16.135
311 HB3 PRO 41 2HB PRO 41 18.595 8.713 -16.527
312 HG2 PRO 41 1HG PRO 41 17.420 6.374 -16.025
313 HG3 PRO 41 2HG PRO 41 19.038 6.686 -15.383
314 HD2 PRO 41 1HD PRO 41 16.367 6.752 -13.925
315 HD3 PRO 41 2HD PRO 41 17.929 6.151 -13.354
316 H ARG 42 HN ARG 42 19.010 11.595 -14.786
317 HA ARG 42 HA ARG 42 16.842 13.055 -13.572
318 HB2 ARG 42 1HB ARG 42 19.021 13.942 -15.405
319 HB3 ARG 42 2HB ARG 42 17.818 15.016 -14.653
320 HG2 ARG 42 1HG ARG 42 18.614 14.101 -12.411
321 HG3 ARG 42 2HG ARG 42 19.977 13.381 -13.304
322 HD2 ARG 42 1HD ARG 42 19.298 16.304 -13.210
323 HD3 ARG 42 2HD ARG 42 20.530 15.489 -12.219
324 HE ARG 42 HE ARG 42 20.897 16.182 -15.099
325 HH11 ARG 42 1HH1 ARG 42 22.108 14.422 -12.342
326 HH12 ARG 42 2HH1 ARG 42 23.672 14.273 -13.118
327 HH21 ARG 42 1HH2 ARG 42 22.685 16.026 -15.996
328 HH22 ARG 42 2HH2 ARG 42 24.003 15.188 -15.201
329 H SER 43 HN SER 43 17.547 12.118 -16.909
330 HA SER 43 HA SER 43 15.415 13.652 -18.172
331 HB2 SER 43 1HB SER 43 15.799 12.416 -20.053
332 HB3 SER 43 2HB SER 43 17.348 12.883 -19.315
333 HG SER 43 HG SER 43 17.316 10.702 -20.022
334 H GLN 44 HN GLN 44 15.662 10.446 -16.652
335 HA GLN 44 HA GLN 44 13.075 9.484 -17.475
336 HB2 GLN 44 1HB GLN 44 14.878 8.073 -16.552
337 HB3 GLN 44 2HB GLN 44 14.675 8.880 -14.979
338 HG2 GLN 44 1HG GLN 44 13.263 6.718 -14.792
339 HG3 GLN 44 2HG GLN 44 12.432 8.272 -15.035
340 HE21 GLN 44 2HE2 GLN 44 10.574 7.250 -15.842
341 HE22 GLN 44 1HE2 GLN 44 10.531 6.543 -17.423
342 H ILE 45 HN ILE 45 14.156 11.200 -14.543
343 HA ILE 45 HA ILE 45 11.582 11.285 -13.274
344 HB ILE 45 HB ILE 45 13.974 13.173 -13.126
345 HG12 ILE 45 1HG1 ILE 45 12.988 11.157 -11.129
346 HG13 ILE 45 2HG1 ILE 45 14.228 10.820 -12.360
347 HG21 ILE 45 1HG2 ILE 45 12.906 14.085 -11.092
348 HG22 ILE 45 2HG2 ILE 45 11.892 14.363 -12.527
349 HG23 ILE 45 3HG2 ILE 45 11.478 13.064 -11.383
350 HD11 ILE 45 3HD1 ILE 45 14.415 12.927 -10.178
351 HD12 ILE 45 1HD1 ILE 45 15.256 11.359 -10.186
352 HD13 ILE 45 2HD1 ILE 45 15.654 12.589 -11.409
353 H GLN 46 HN GLN 46 13.096 13.524 -15.569
354 HA GLN 46 HA GLN 46 11.113 15.548 -15.415
355 HB2 GLN 46 1HB GLN 46 13.260 15.808 -16.558
356 HB3 GLN 46 2HB GLN 46 12.754 14.620 -17.782
357 HG2 GLN 46 1HG GLN 46 12.251 16.910 -18.869
358 HG3 GLN 46 2HG GLN 46 10.896 15.971 -18.200
359 HE21 GLN 46 2HE2 GLN 46 9.603 17.834 -18.037
360 HE22 GLN 46 1HE2 GLN 46 9.873 19.028 -16.810
361 H ARG 47 HN ARG 47 11.152 12.522 -17.235
362 HA ARG 47 HA ARG 47 8.591 13.337 -18.552
363 HB2 ARG 47 1HB ARG 47 10.633 11.303 -19.314
364 HB3 ARG 47 2HB ARG 47 9.023 11.445 -20.056
365 HG2 ARG 47 1HG ARG 47 9.547 13.717 -20.799
366 HG3 ARG 47 2HG ARG 47 11.146 13.613 -20.021
367 HD2 ARG 47 1HD ARG 47 11.753 11.820 -21.535
368 HD3 ARG 47 2HD ARG 47 10.163 11.952 -22.320
369 HE ARG 47 HE ARG 47 12.421 13.826 -22.810
370 HH11 ARG 47 1HH1 ARG 47 8.991 13.288 -23.129
371 HH12 ARG 47 2HH1 ARG 47 8.907 14.523 -24.370
372 HH21 ARG 47 1HH2 ARG 47 12.343 15.237 -24.235
373 HH22 ARG 47 2HH2 ARG 47 10.817 15.634 -25.003
374 H ALA 48 HN ALA 48 9.622 11.678 -15.900
375 HA ALA 48 HA ALA 48 7.945 9.325 -16.096
376 HB1 ALA 48 3HB ALA 48 9.144 10.702 -13.669
377 HB2 ALA 48 1HB ALA 48 8.409 9.082 -13.688
378 HB3 ALA 48 2HB ALA 48 9.897 9.394 -14.613
379 H ARG 49 HN ARG 49 5.946 8.899 -15.328
380 HA ARG 49 HA ARG 49 4.151 11.165 -14.881
381 HB2 ARG 49 1HB ARG 49 3.736 8.216 -14.819
382 HB3 ARG 49 2HB ARG 49 2.479 9.409 -14.419
383 HG2 ARG 49 1HG ARG 49 2.837 10.415 -16.700
384 HG3 ARG 49 2HG ARG 49 3.894 9.031 -17.072
385 HD2 ARG 49 1HD ARG 49 2.075 7.516 -16.813
386 HD3 ARG 49 2HD ARG 49 1.005 8.837 -16.288
387 HE ARG 49 HE ARG 49 1.908 9.342 -19.023
388 HH11 ARG 49 1HH1 ARG 49 -0.245 7.264 -17.233
389 HH12 ARG 49 2HH1 ARG 49 -1.285 7.123 -18.637
390 HH21 ARG 49 1HH2 ARG 49 0.732 9.184 -20.641
391 HH22 ARG 49 2HH2 ARG 49 -0.730 8.216 -20.581
392 HA PRO 50 HA PRO 50 4.212 11.590 -10.540
393 HB2 PRO 50 1HB PRO 50 1.460 11.709 -9.994
394 HB3 PRO 50 2HB PRO 50 2.367 13.084 -10.640
395 HG2 PRO 50 1HG PRO 50 0.685 11.042 -12.126
396 HG3 PRO 50 2HG PRO 50 0.734 12.799 -12.325
397 HD2 PRO 50 1HD PRO 50 2.065 11.231 -14.071
398 HD3 PRO 50 2HD PRO 50 2.812 12.737 -13.522
399 H VAL 51 HN VAL 51 2.470 8.994 -12.050
400 HA VAL 51 HA VAL 51 2.405 7.480 -9.459
401 HB VAL 51 HB VAL 51 1.072 5.834 -10.692
402 HG11 VAL 51 1HG1 VAL 51 -0.927 7.212 -11.154
403 HG12 VAL 51 2HG1 VAL 51 -0.113 7.744 -9.664
404 HG13 VAL 51 3HG1 VAL 51 0.085 8.676 -11.168
405 HG21 VAL 51 3HG2 VAL 51 2.136 6.030 -12.860
406 HG22 VAL 51 1HG2 VAL 51 0.373 6.221 -13.001
407 HG23 VAL 51 2HG2 VAL 51 1.431 7.650 -13.080
408 H LYS 52 HN LYS 52 4.202 7.772 -12.383
409 HA LYS 52 HA LYS 52 5.489 5.139 -12.040
410 HB2 LYS 52 1HB LYS 52 6.010 7.497 -13.851
411 HB3 LYS 52 2HB LYS 52 6.999 6.017 -13.834
412 HG2 LYS 52 1HG LYS 52 5.010 4.691 -14.455
413 HG3 LYS 52 2HG LYS 52 4.041 6.183 -14.501
414 HD2 LYS 52 1HD LYS 52 5.458 7.070 -16.293
415 HD3 LYS 52 2HD LYS 52 6.473 5.609 -16.230
416 HE2 LYS 52 1HE LYS 52 4.484 4.244 -16.817
417 HE3 LYS 52 2HE LYS 52 3.533 5.739 -16.968
418 HZ1 LYS 52 3HZ LYS 52 5.900 5.042 -18.586
419 HZ2 LYS 52 1HZ LYS 52 4.333 4.975 -19.100
420 HZ3 LYS 52 2HZ LYS 52 5.018 6.429 -18.727
421 H MET 53 HN MET 53 6.051 8.471 -11.135
422 HA MET 53 HA MET 53 8.851 8.177 -10.490
423 HB2 MET 53 1HB MET 53 6.705 10.072 -9.549
424 HB3 MET 53 2HB MET 53 8.410 10.184 -9.055
425 HG2 MET 53 1HG MET 53 9.113 10.635 -11.299
426 HG3 MET 53 2HG MET 53 7.494 10.265 -11.940
427 HE1 MET 53 3HE MET 53 9.786 12.849 -10.129
428 HE2 MET 53 1HE MET 53 8.623 14.053 -9.525
429 HE3 MET 53 2HE MET 53 8.666 12.421 -8.813
430 H ALA 54 HN ALA 54 5.870 7.712 -8.629
431 HA ALA 54 HA ALA 54 7.102 7.099 -6.140
432 HB1 ALA 54 3HB ALA 54 4.565 5.960 -7.364
433 HB2 ALA 54 1HB ALA 54 5.030 5.857 -5.650
434 HB3 ALA 54 2HB ALA 54 4.684 7.440 -6.385
435 H THR 55 HN THR 55 6.340 5.017 -8.929
436 HA THR 55 HA THR 55 7.362 2.596 -7.746
437 HB THR 55 HB THR 55 7.131 3.403 -10.675
438 HG1 THR 55 HG1 THR 55 5.203 2.112 -10.511
439 HG21 THR 55 3HG2 THR 55 7.488 0.672 -9.378
440 HG22 THR 55 1HG2 THR 55 7.225 0.974 -11.112
441 HG23 THR 55 2HG2 THR 55 8.717 1.541 -10.326
442 H LEU 56 HN LEU 56 8.870 5.153 -9.679
443 HA LEU 56 HA LEU 56 11.394 3.851 -10.032
444 HB2 LEU 56 1HB LEU 56 10.471 6.631 -9.851
445 HB3 LEU 56 2HB LEU 56 12.194 6.362 -10.200
446 HG LEU 56 HG LEU 56 9.862 5.412 -11.908
447 HD11 LEU 56 1HD1 LEU 56 10.692 7.113 -13.556
448 HD12 LEU 56 2HD1 LEU 56 10.203 7.879 -12.027
449 HD13 LEU 56 3HD1 LEU 56 11.928 7.623 -12.383
450 HD21 LEU 56 3HD2 LEU 56 11.752 3.899 -12.012
451 HD22 LEU 56 1HD2 LEU 56 11.602 4.788 -13.546
452 HD23 LEU 56 2HD2 LEU 56 12.854 5.252 -12.367
453 H LEU 57 HN LEU 57 10.226 6.026 -7.469
454 HA LEU 57 HA LEU 57 12.749 6.094 -6.071
455 HB2 LEU 57 1HB LEU 57 9.939 6.527 -5.315
456 HB3 LEU 57 2HB LEU 57 11.210 6.891 -4.125
457 HG LEU 57 HG LEU 57 10.849 8.234 -6.833
458 HD11 LEU 57 1HD1 LEU 57 10.267 10.258 -5.471
459 HD12 LEU 57 2HD1 LEU 57 9.131 8.922 -5.162
460 HD13 LEU 57 3HD1 LEU 57 10.419 9.286 -3.988
461 HD21 LEU 57 3HD2 LEU 57 13.186 8.075 -6.206
462 HD22 LEU 57 1HD2 LEU 57 12.636 9.762 -6.075
463 HD23 LEU 57 2HD2 LEU 57 12.835 8.774 -4.607
464 H VAL 58 HN VAL 58 9.913 3.997 -5.855
465 HA VAL 58 HA VAL 58 10.869 2.528 -3.515
466 HB VAL 58 HB VAL 58 8.831 1.859 -5.677
467 HG11 VAL 58 1HG1 VAL 58 8.147 0.004 -4.194
468 HG12 VAL 58 2HG1 VAL 58 9.827 -0.201 -4.745
469 HG13 VAL 58 3HG1 VAL 58 9.495 0.383 -3.097
470 HG21 VAL 58 3HG2 VAL 58 8.180 3.704 -4.247
471 HG22 VAL 58 1HG2 VAL 58 7.196 2.261 -3.907
472 HG23 VAL 58 2HG2 VAL 58 8.510 2.722 -2.799
473 H THR 59 HN THR 59 11.171 2.070 -7.012
474 HA THR 59 HA THR 59 12.374 -0.560 -6.741
475 HB THR 59 HB THR 59 12.413 1.419 -9.058
476 HG1 THR 59 HG1 THR 59 10.769 -0.025 -9.847
477 HG21 THR 59 3HG2 THR 59 13.110 -1.543 -8.958
478 HG22 THR 59 1HG2 THR 59 13.037 -0.541 -10.426
479 HG23 THR 59 2HG2 THR 59 14.267 -0.210 -9.183
480 H TYR 60 HN TYR 60 13.670 2.724 -7.141
481 HA TYR 60 HA TYR 60 16.394 1.649 -7.503
482 HB2 TYR 60 1HB TYR 60 15.155 4.393 -7.505
483 HB3 TYR 60 2HB TYR 60 16.920 4.158 -7.480
484 HD1 TYR 60 HD1 TYR 60 13.902 3.031 -9.406
485 HD2 TYR 60 HD2 TYR 60 18.038 4.061 -9.519
486 HE1 TYR 60 HE1 TYR 60 13.895 2.757 -11.868
487 HE2 TYR 60 HE2 TYR 60 18.049 3.792 -11.976
488 HH TYR 60 HH TYR 60 16.828 3.282 -13.829
489 H TYR 61 HN TYR 61 14.452 3.034 -4.956
490 HA TYR 61 HA TYR 61 16.876 3.026 -3.184
491 HB2 TYR 61 1HB TYR 61 14.437 4.811 -3.093
492 HB3 TYR 61 2HB TYR 61 15.739 4.771 -1.879
493 HD1 TYR 61 HD1 TYR 61 14.830 5.799 -5.301
494 HD2 TYR 61 HD2 TYR 61 17.911 5.758 -2.353
495 HE1 TYR 61 HE1 TYR 61 16.106 7.461 -6.623
496 HE2 TYR 61 HE2 TYR 61 19.197 7.415 -3.659
497 HH TYR 61 HH TYR 61 17.992 8.718 -6.760
498 H GLY 62 HN GLY 62 13.303 2.898 -3.023
499 HA2 GLY 62 1HA GLY 62 12.695 0.533 -2.011
500 HA3 GLY 62 2HA GLY 62 13.560 1.195 -0.605
501 H GLU 63 HN GLU 63 10.964 0.439 -0.296
502 HA GLU 63 HA GLU 63 9.020 2.479 -0.896
503 HB2 GLU 63 1HB GLU 63 9.107 0.264 1.153
504 HB3 GLU 63 2HB GLU 63 7.705 1.335 0.911
505 HG2 GLU 63 1HG GLU 63 7.456 0.461 -1.440
506 HG3 GLU 63 2HG GLU 63 8.960 -0.438 -1.141
507 H GLU 64 HN GLU 64 10.903 1.772 2.046
508 HA GLU 64 HA GLU 64 9.729 3.970 3.537
509 HB2 GLU 64 1HB GLU 64 12.232 2.324 3.914
510 HB3 GLU 64 2HB GLU 64 11.684 3.580 5.051
511 HG2 GLU 64 1HG GLU 64 9.585 2.243 5.487
512 HG3 GLU 64 2HG GLU 64 10.174 1.135 4.228
513 H TYR 65 HN TYR 65 12.541 3.617 1.454
514 HA TYR 65 HA TYR 65 13.628 6.241 2.192
515 HB2 TYR 65 1HB TYR 65 14.253 4.298 -0.038
516 HB3 TYR 65 2HB TYR 65 15.119 5.828 0.240
517 HD1 TYR 65 HD2 TYR 65 16.475 6.112 2.316
518 HD2 TYR 65 HD1 TYR 65 14.719 2.363 1.296
519 HE1 TYR 65 HE2 TYR 65 17.977 4.984 3.922
520 HE2 TYR 65 HE1 TYR 65 16.216 1.216 2.901
521 HH TYR 65 HH TYR 65 18.609 3.003 4.852
522 H ALA 66 HN ALA 66 11.428 4.969 -0.203
523 HA ALA 66 HA ALA 66 11.502 7.222 -1.978
524 HB1 ALA 66 3HB ALA 66 9.250 5.269 -1.396
525 HB2 ALA 66 1HB ALA 66 9.329 6.381 -2.781
526 HB3 ALA 66 2HB ALA 66 10.521 5.068 -2.625
527 H VAL 67 HN VAL 67 9.663 6.530 0.965
528 HA VAL 67 HA VAL 67 8.016 8.939 0.821
529 HB VAL 67 HB VAL 67 8.799 7.138 3.150
530 HG11 VAL 67 1HG1 VAL 67 6.969 8.267 4.371
531 HG12 VAL 67 2HG1 VAL 67 8.247 9.421 3.920
532 HG13 VAL 67 3HG1 VAL 67 6.727 9.366 2.992
533 HG21 VAL 67 3HG2 VAL 67 7.456 6.012 1.477
534 HG22 VAL 67 1HG2 VAL 67 6.514 6.297 2.958
535 HG23 VAL 67 2HG2 VAL 67 6.256 7.325 1.529
536 H GLN 68 HN GLN 68 11.125 8.169 2.333
537 HA GLN 68 HA GLN 68 11.405 10.723 3.633
538 HB2 GLN 68 1HB GLN 68 13.412 8.681 2.663
539 HB3 GLN 68 2HB GLN 68 13.850 10.145 3.575
540 HG2 GLN 68 1HG GLN 68 12.367 9.138 5.596
541 HG3 GLN 68 2HG GLN 68 12.104 7.956 4.293
542 HE21 GLN 68 2HE2 GLN 68 13.036 7.286 6.871
543 HE22 GLN 68 1HE2 GLN 68 14.661 6.702 6.730
544 H LEU 69 HN LEU 69 12.353 9.536 0.430
545 HA LEU 69 HA LEU 69 13.731 11.967 -0.322
546 HB2 LEU 69 1HB LEU 69 12.455 9.739 -1.752
547 HB3 LEU 69 2HB LEU 69 13.299 10.976 -2.711
548 HG LEU 69 HG LEU 69 14.571 9.198 -0.593
549 HD11 LEU 69 1HD1 LEU 69 15.724 8.108 -2.536
550 HD12 LEU 69 2HD1 LEU 69 13.957 7.935 -2.652
551 HD13 LEU 69 3HD1 LEU 69 14.800 9.146 -3.646
552 HD21 LEU 69 3HD2 LEU 69 15.640 11.369 -0.750
553 HD22 LEU 69 1HD2 LEU 69 16.707 10.117 -1.430
554 HD23 LEU 69 2HD2 LEU 69 15.796 11.197 -2.514
555 H THR 70 HN THR 70 10.435 10.759 -0.942
556 HA THR 70 HA THR 70 9.557 13.044 -2.427
557 HB THR 70 HB THR 70 7.973 11.149 -0.642
558 HG1 THR 70 HG1 THR 70 8.416 11.200 -3.468
559 HG21 THR 70 3HG2 THR 70 7.047 13.091 -2.796
560 HG22 THR 70 1HG2 THR 70 6.015 11.927 -1.932
561 HG23 THR 70 2HG2 THR 70 6.775 13.273 -1.047
562 H LEU 71 HN LEU 71 9.407 12.333 1.061
563 HA LEU 71 HA LEU 71 8.043 14.751 1.774
564 HB2 LEU 71 1HB LEU 71 8.184 12.862 3.113
565 HB3 LEU 71 2HB LEU 71 9.935 12.972 3.408
566 HG LEU 71 HG LEU 71 9.530 15.208 4.490
567 HD11 LEU 71 1HD1 LEU 71 7.187 15.706 5.234
568 HD12 LEU 71 2HD1 LEU 71 7.307 15.667 3.459
569 HD13 LEU 71 3HD1 LEU 71 6.616 14.281 4.336
570 HD21 LEU 71 3HD2 LEU 71 9.886 13.215 5.823
571 HD22 LEU 71 1HD2 LEU 71 8.690 14.270 6.615
572 HD23 LEU 71 2HD2 LEU 71 8.153 12.815 5.739
573 H GLN 72 HN GLN 72 11.485 13.992 1.419
574 HA GLN 72 HA GLN 72 12.443 16.501 2.444
575 HB2 GLN 72 1HB GLN 72 13.806 14.453 2.126
576 HB3 GLN 72 2HB GLN 72 13.672 14.679 0.366
577 HG2 GLN 72 1HG GLN 72 15.932 15.776 0.999
578 HG3 GLN 72 2HG GLN 72 14.535 16.818 0.645
579 HE21 GLN 72 2HE2 GLN 72 15.468 18.560 1.773
580 HE22 GLN 72 1HE2 GLN 72 15.532 18.594 3.504
581 H VAL 73 HN VAL 73 11.488 15.450 -0.800
582 HA VAL 73 HA VAL 73 12.286 17.973 -2.069
583 HB VAL 73 HB VAL 73 10.470 15.704 -2.982
584 HG11 VAL 73 1HG1 VAL 73 10.645 16.742 -5.219
585 HG12 VAL 73 2HG1 VAL 73 9.862 17.844 -4.062
586 HG13 VAL 73 3HG1 VAL 73 11.563 18.097 -4.519
587 HG21 VAL 73 3HG2 VAL 73 12.784 15.033 -2.729
588 HG22 VAL 73 1HG2 VAL 73 12.334 15.117 -4.448
589 HG23 VAL 73 2HG2 VAL 73 13.313 16.413 -3.720
590 H LEU 74 HN LEU 74 9.310 16.701 -0.669
591 HA LEU 74 HA LEU 74 7.602 18.833 -1.507
592 HB2 LEU 74 1HB LEU 74 7.749 17.069 0.836
593 HB3 LEU 74 2HB LEU 74 6.361 18.175 0.723
594 HG LEU 74 HG LEU 74 7.075 15.996 -1.279
595 HD11 LEU 74 1HD1 LEU 74 4.993 14.878 -0.434
596 HD12 LEU 74 2HD1 LEU 74 6.189 15.086 0.867
597 HD13 LEU 74 3HD1 LEU 74 4.793 16.184 0.756
598 HD21 LEU 74 3HD2 LEU 74 6.019 17.904 -2.339
599 HD22 LEU 74 1HD2 LEU 74 4.891 16.528 -2.304
600 HD23 LEU 74 2HD2 LEU 74 4.695 17.869 -1.150
601 H ARG 75 HN ARG 75 9.884 18.582 1.179
602 HA ARG 75 HA ARG 75 9.272 21.142 2.346
603 HB2 ARG 75 1HB ARG 75 10.529 19.480 3.511
604 HB3 ARG 75 2HB ARG 75 11.849 19.636 2.330
605 HG2 ARG 75 1HG ARG 75 12.228 21.945 3.016
606 HG3 ARG 75 2HG ARG 75 10.857 21.852 4.148
607 HD2 ARG 75 1HD ARG 75 12.023 20.212 5.457
608 HD3 ARG 75 2HD ARG 75 13.379 20.233 4.306
609 HE ARG 75 HE ARG 75 13.061 22.896 5.460
610 HH11 ARG 75 1HH1 ARG 75 14.141 19.699 6.341
611 HH12 ARG 75 2HH1 ARG 75 15.249 20.389 7.511
612 HH21 ARG 75 1HH2 ARG 75 14.318 23.700 6.803
613 HH22 ARG 75 2HH2 ARG 75 15.350 22.670 7.777
614 H ALA 76 HN ALA 76 11.375 20.159 -0.325
615 HA ALA 76 HA ALA 76 12.646 22.713 -0.629
616 HB1 ALA 76 3HB ALA 76 12.174 20.512 -2.669
617 HB2 ALA 76 1HB ALA 76 13.301 21.875 -2.852
618 HB3 ALA 76 2HB ALA 76 13.579 20.656 -1.587
619 H ILE 77 HN ILE 77 9.661 21.338 -1.918
620 HA ILE 77 HA ILE 77 9.162 23.890 -3.417
621 HB ILE 77 HB ILE 77 7.357 22.631 -4.543
622 HG12 ILE 77 1HG1 ILE 77 8.293 20.221 -3.017
623 HG13 ILE 77 2HG1 ILE 77 6.887 21.211 -2.560
624 HG21 ILE 77 1HG2 ILE 77 8.748 21.021 -5.801
625 HG22 ILE 77 2HG2 ILE 77 9.625 22.543 -5.521
626 HG23 ILE 77 3HG2 ILE 77 9.995 21.109 -4.535
627 HD11 ILE 77 3HD1 ILE 77 7.226 19.706 -5.178
628 HD12 ILE 77 1HD1 ILE 77 6.194 19.210 -3.818
629 HD13 ILE 77 2HD1 ILE 77 5.821 20.698 -4.721
630 H ASN 78 HN ASN 78 8.622 22.702 -0.413
631 HA ASN 78 HA ASN 78 7.484 23.819 1.278
632 HB2 ASN 78 1HB ASN 78 8.143 25.995 -0.347
633 HB3 ASN 78 2HB ASN 78 6.429 25.604 -0.628
634 HD21 ASN 78 2HD2 ASN 78 6.215 27.844 0.134
635 HD22 ASN 78 1HD2 ASN 78 6.054 28.113 1.837
636 H GLN 79 HN GLN 79 6.186 21.704 0.050
637 HA GLN 79 HA GLN 79 3.338 22.615 0.192
638 HB2 GLN 79 1HB GLN 79 4.478 19.939 -0.636
639 HB3 GLN 79 2HB GLN 79 2.773 20.444 -0.711
640 HG2 GLN 79 1HG GLN 79 5.013 21.509 -2.637
641 HG3 GLN 79 2HG GLN 79 3.603 20.427 -2.720
642 HE21 GLN 79 2HE2 GLN 79 4.758 23.687 -2.778
643 HE22 GLN 79 1HE2 GLN 79 3.228 24.465 -3.012
644 H ARG 80 HN ARG 80 2.838 22.816 2.265
645 HA ARG 80 HA ARG 80 3.813 20.963 4.292
646 HB2 ARG 80 1HB ARG 80 1.790 23.148 4.364
647 HB3 ARG 80 2HB ARG 80 2.171 22.097 5.747
648 HG2 ARG 80 1HG ARG 80 4.507 22.852 5.685
649 HG3 ARG 80 2HG ARG 80 4.134 23.896 4.291
650 HD2 ARG 80 1HD ARG 80 2.663 25.219 5.645
651 HD3 ARG 80 2HD ARG 80 2.945 24.147 7.036
652 HE ARG 80 HE ARG 80 5.494 25.295 6.315
653 HH11 ARG 80 1HH1 ARG 80 2.411 26.406 7.505
654 HH12 ARG 80 2HH1 ARG 80 3.205 27.723 8.347
655 HH21 ARG 80 1HH2 ARG 80 6.417 26.801 7.267
656 HH22 ARG 80 2HH2 ARG 80 5.488 27.950 8.212
657 H LEU 81 HN LEU 81 0.936 21.209 2.301
658 HA LEU 81 HA LEU 81 -0.780 19.536 3.841
659 HB2 LEU 81 1HB LEU 81 -1.560 20.847 2.163
660 HB3 LEU 81 2HB LEU 81 -0.640 20.102 0.836
661 HG LEU 81 HG LEU 81 -1.898 17.960 1.292
662 HD11 LEU 81 1HD1 LEU 81 -4.056 18.172 2.556
663 HD12 LEU 81 2HD1 LEU 81 -2.658 18.525 3.599
664 HD13 LEU 81 3HD1 LEU 81 -3.641 19.857 2.948
665 HD21 LEU 81 3HD2 LEU 81 -2.470 19.392 -0.580
666 HD22 LEU 81 1HD2 LEU 81 -3.946 18.684 0.116
667 HD23 LEU 81 2HD2 LEU 81 -3.524 20.378 0.459
668 H LEU 82 HN LEU 82 1.232 18.627 1.023
669 HA LEU 82 HA LEU 82 0.576 15.829 1.297
670 HB2 LEU 82 1HB LEU 82 2.721 17.337 -0.039
671 HB3 LEU 82 2HB LEU 82 2.588 15.588 -0.333
672 HG LEU 82 HG LEU 82 0.521 17.708 -1.039
673 HD11 LEU 82 1HD1 LEU 82 1.060 17.064 -3.404
674 HD12 LEU 82 2HD1 LEU 82 2.498 17.683 -2.559
675 HD13 LEU 82 3HD1 LEU 82 2.291 15.932 -2.798
676 HD21 LEU 82 3HD2 LEU 82 -0.543 15.636 -0.365
677 HD22 LEU 82 1HD2 LEU 82 -0.714 15.864 -2.123
678 HD23 LEU 82 2HD2 LEU 82 0.484 14.710 -1.486
679 H ALA 83 HN ALA 83 3.127 17.854 2.599
680 HA ALA 83 HA ALA 83 4.783 15.752 3.598
681 HB1 ALA 83 3HB ALA 83 4.279 18.527 4.726
682 HB2 ALA 83 1HB ALA 83 5.621 17.450 5.177
683 HB3 ALA 83 2HB ALA 83 5.515 18.093 3.521
684 H GLU 84 HN GLU 84 1.974 17.421 5.007
685 HA GLU 84 HA GLU 84 2.008 15.862 7.460
686 HB2 GLU 84 1HB GLU 84 -0.109 17.499 6.064
687 HB3 GLU 84 2HB GLU 84 -0.368 16.672 7.619
688 HG2 GLU 84 1HG GLU 84 1.427 18.098 8.666
689 HG3 GLU 84 2HG GLU 84 1.712 18.737 7.030
690 H GLU 85 HN GLU 85 0.659 15.399 4.260
691 HA GLU 85 HA GLU 85 -1.101 13.214 5.011
692 HB2 GLU 85 1HB GLU 85 0.127 14.094 2.398
693 HB3 GLU 85 2HB GLU 85 -0.973 12.702 2.550
694 HG2 GLU 85 1HG GLU 85 -1.693 15.642 3.109
695 HG3 GLU 85 2HG GLU 85 -2.154 14.573 1.764
696 H LEU 86 HN LEU 86 2.278 13.443 4.021
697 HA LEU 86 HA LEU 86 2.666 10.552 4.001
698 HB2 LEU 86 1HB LEU 86 4.394 12.921 4.215
699 HB3 LEU 86 2HB LEU 86 5.163 11.318 4.176
700 HG LEU 86 HG LEU 86 3.497 12.607 1.980
701 HD11 LEU 86 1HD1 LEU 86 5.637 12.483 0.676
702 HD12 LEU 86 2HD1 LEU 86 5.833 13.463 2.148
703 HD13 LEU 86 3HD1 LEU 86 6.448 11.794 2.101
704 HD21 LEU 86 3HD2 LEU 86 3.044 10.229 2.099
705 HD22 LEU 86 1HD2 LEU 86 4.011 10.589 0.649
706 HD23 LEU 86 2HD2 LEU 86 4.787 9.865 2.079
707 H HIS 87 HN HIS 87 2.897 13.110 6.416
708 HA HIS 87 HA HIS 87 3.887 11.384 8.522
709 HB2 HIS 87 1HB HIS 87 2.297 13.987 8.598
710 HB3 HIS 87 2HB HIS 87 2.962 13.173 10.034
711 HD1 HIS 87 HD1 HIS 87 3.856 15.967 9.550
712 HD2 HIS 87 HD2 HIS 87 5.928 12.680 7.919
713 HE1 HIS 87 HE1 HIS 87 6.099 16.780 9.020
714 H ARG 88 HN ARG 88 0.685 12.106 7.238
715 HA ARG 88 HA ARG 88 -0.695 10.498 9.249
716 HB2 ARG 88 1HB ARG 88 -1.538 11.593 6.610
717 HB3 ARG 88 2HB ARG 88 -2.559 10.550 7.629
718 HG2 ARG 88 1HG ARG 88 -2.602 12.176 9.387
719 HG3 ARG 88 2HG ARG 88 -1.359 13.163 8.582
720 HD2 ARG 88 1HD ARG 88 -2.864 13.788 6.874
721 HD3 ARG 88 2HD ARG 88 -4.091 12.642 7.463
722 HE ARG 88 HE ARG 88 -3.815 14.477 9.591
723 HH11 ARG 88 1HH1 ARG 88 -4.412 14.874 6.179
724 HH12 ARG 88 2HH1 ARG 88 -5.347 16.320 6.505
725 HH21 ARG 88 1HH2 ARG 88 -4.876 16.136 9.980
726 HH22 ARG 88 2HH2 ARG 88 -5.611 17.042 8.672
727 H ALA 89 HN ALA 89 0.768 9.906 6.101
728 HA ALA 89 HA ALA 89 -0.210 7.241 5.767
729 HB1 ALA 89 3HB ALA 89 2.413 8.476 4.858
730 HB2 ALA 89 1HB ALA 89 1.720 6.950 4.260
731 HB3 ALA 89 2HB ALA 89 0.880 8.489 3.956
732 H ALA 90 HN ALA 90 2.637 8.532 7.458
733 HA ALA 90 HA ALA 90 3.731 6.014 8.228
734 HB1 ALA 90 3HB ALA 90 3.839 8.690 9.664
735 HB2 ALA 90 1HB ALA 90 4.887 7.290 9.992
736 HB3 ALA 90 2HB ALA 90 4.976 8.119 8.419
737 H ILE 91 HN ILE 91 1.160 7.993 9.615
738 HA ILE 91 HA ILE 91 0.861 6.413 12.040
739 HB ILE 91 HB ILE 91 -1.047 8.261 10.538
740 HG12 ILE 91 1HG1 ILE 91 0.384 8.678 13.146
741 HG13 ILE 91 2HG1 ILE 91 1.002 9.217 11.568
742 HG21 ILE 91 1HG2 ILE 91 -2.449 8.173 12.572
743 HG22 ILE 91 2HG2 ILE 91 -2.307 6.566 11.823
744 HG23 ILE 91 3HG2 ILE 91 -1.354 6.958 13.274
745 HD11 ILE 91 3HD1 ILE 91 -1.614 10.087 12.844
746 HD12 ILE 91 1HD1 ILE 91 -0.126 11.056 12.758
747 HD13 ILE 91 2HD1 ILE 91 -0.997 10.626 11.265
748 H GLN 92 HN GLN 92 -0.717 6.300 8.864
749 HA GLN 92 HA GLN 92 -2.484 4.135 9.640
750 HB2 GLN 92 1HB GLN 92 -1.561 5.182 6.958
751 HB3 GLN 92 2HB GLN 92 -2.767 3.889 7.163
752 HG2 GLN 92 1HG GLN 92 -4.266 5.758 8.452
753 HG3 GLN 92 2HG GLN 92 -2.778 6.642 8.038
754 HE21 GLN 92 2HE2 GLN 92 -5.108 7.725 7.244
755 HE22 GLN 92 1HE2 GLN 92 -5.334 7.540 5.536
756 H LEU 93 HN LEU 93 0.735 4.311 8.229
757 HA LEU 93 HA LEU 93 0.774 1.441 7.608
758 HB2 LEU 93 1HB LEU 93 2.782 3.593 7.698
759 HB3 LEU 93 2HB LEU 93 3.257 1.981 7.116
760 HG LEU 93 HG LEU 93 1.152 3.763 5.832
761 HD11 LEU 93 1HD1 LEU 93 2.841 4.059 4.000
762 HD12 LEU 93 2HD1 LEU 93 3.451 4.684 5.549
763 HD13 LEU 93 3HD1 LEU 93 4.008 3.106 4.944
764 HD21 LEU 93 3HD2 LEU 93 0.721 1.399 5.507
765 HD22 LEU 93 1HD2 LEU 93 1.249 2.136 3.975
766 HD23 LEU 93 2HD2 LEU 93 2.384 1.147 4.926