Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
613919 | 5iiv RC | 30029 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 GLY 1 H1 GLY 1 25.630 5.252 -7.671
2 H2 GLY 1 H2 GLY 1 25.664 6.898 -7.295
3 H3 GLY 1 H3 GLY 1 24.429 6.279 -8.268
4 HA2 GLY 1 HA2 GLY 1 24.872 5.611 -5.417
5 HA3 GLY 1 HA3 GLY 1 23.633 6.697 -6.029
6 H SER 2 H SER 2 23.156 4.373 -4.481
7 HA SER 2 HA SER 2 21.389 2.982 -6.332
8 HB2 SER 2 HB3 SER 2 23.540 1.664 -6.178
9 HB3 SER 2 HB2 SER 2 23.183 1.414 -4.470
10 HG SER 2 HG SER 2 22.169 0.171 -6.659
11 H MET 3 H MET 3 22.490 2.986 -2.909
12 HA MET 3 HA MET 3 20.079 2.048 -1.844
13 HB2 MET 3 HB3 MET 3 22.179 3.788 -0.549
14 HB3 MET 3 HB2 MET 3 20.870 2.993 0.314
15 HG2 MET 3 HG3 MET 3 21.755 0.822 -0.604
16 HG3 MET 3 HG2 MET 3 23.170 1.725 -1.133
17 HE1 MET 3 HE1 MET 3 21.068 0.451 1.894
18 HE2 MET 3 HE2 MET 3 21.023 2.190 2.183
19 HE3 MET 3 HE3 MET 3 21.924 1.137 3.274
20 H LYS 4 H LYS 4 21.018 5.259 -2.817
21 HA LYS 4 HA LYS 4 19.011 6.711 -1.470
22 HB2 LYS 4 HB3 LYS 4 20.477 7.245 -4.053
23 HB3 LYS 4 HB2 LYS 4 19.308 8.370 -3.379
24 HG2 LYS 4 HG3 LYS 4 20.661 8.595 -1.368
25 HG3 LYS 4 HG2 LYS 4 21.827 7.442 -2.013
26 HD2 LYS 4 HD3 LYS 4 22.214 8.963 -3.926
27 HD3 LYS 4 HD2 LYS 4 21.126 10.133 -3.177
28 HE2 LYS 4 HE3 LYS 4 22.602 10.206 -1.207
29 HE3 LYS 4 HE2 LYS 4 23.700 9.084 -2.007
30 HZ1 LYS 4 HZ1 LYS 4 23.994 10.735 -3.772
31 HZ2 LYS 4 HZ2 LYS 4 24.477 11.329 -2.269
32 HZ3 LYS 4 HZ3 LYS 4 23.001 11.816 -2.934
33 H GLN 5 H GLN 5 19.009 4.864 -4.440
34 HA GLN 5 HA GLN 5 16.486 5.761 -5.395
35 HB2 GLN 5 HB3 GLN 5 17.917 3.164 -5.987
36 HB3 GLN 5 HB2 GLN 5 16.611 3.869 -6.930
37 HG2 GLN 5 HG3 GLN 5 18.029 5.769 -7.491
38 HG3 GLN 5 HG2 GLN 5 19.337 5.080 -6.531
39 HE21 GLN 5 HE21 GLN 5 17.493 4.840 -9.456
40 HE22 GLN 5 HE22 GLN 5 18.534 3.719 -10.261
41 H LEU 6 H LEU 6 17.554 3.077 -3.382
42 HA LEU 6 HA LEU 6 15.053 1.792 -3.133
43 HB2 LEU 6 HB3 LEU 6 17.540 1.804 -1.451
44 HB3 LEU 6 HB2 LEU 6 16.094 1.002 -0.880
45 HG LEU 6 HG LEU 6 17.586 -0.611 -1.874
46 HD11 LEU 6 HD11 LEU 6 15.179 -0.955 -2.138
47 HD12 LEU 6 HD12 LEU 6 16.096 -1.636 -3.481
48 HD13 LEU 6 HD13 LEU 6 15.232 -0.114 -3.687
49 HD21 LEU 6 HD21 LEU 6 18.828 0.846 -3.372
50 HD22 LEU 6 HD22 LEU 6 17.403 1.032 -4.395
51 HD23 LEU 6 HD23 LEU 6 18.181 -0.544 -4.244
52 H GLU 7 H GLU 7 16.628 4.319 -1.228
53 HA GLU 7 HA GLU 7 14.693 4.508 0.801
54 HB2 GLU 7 HB3 GLU 7 16.543 6.630 -0.297
55 HB3 GLU 7 HB2 GLU 7 15.631 6.771 1.199
56 HG2 GLU 7 HG3 GLU 7 16.834 4.860 2.121
57 HG3 GLU 7 HG2 GLU 7 17.739 4.706 0.616
58 H ASP 8 H ASP 8 14.923 6.051 -2.364
59 HA ASP 8 HA ASP 8 12.571 7.656 -1.943
60 HB2 ASP 8 HB3 ASP 8 14.245 7.054 -4.376
61 HB3 ASP 8 HB2 ASP 8 12.751 7.978 -4.484
62 H LYS 9 H LYS 9 13.228 4.451 -2.986
63 HA LYS 9 HA LYS 9 10.804 4.097 -4.482
64 HB2 LYS 9 HB3 LYS 9 12.919 2.800 -4.875
65 HB3 LYS 9 HB2 LYS 9 12.633 1.973 -3.352
66 HG2 LYS 9 HG3 LYS 9 11.894 0.571 -5.135
67 HG3 LYS 9 HG2 LYS 9 10.477 1.156 -4.262
68 HD2 LYS 9 HD3 LYS 9 10.074 2.825 -5.974
69 HD3 LYS 9 HD2 LYS 9 11.540 2.336 -6.826
70 HE2 LYS 9 HE3 LYS 9 10.577 0.098 -7.158
71 HE3 LYS 9 HE2 LYS 9 9.104 0.622 -6.345
72 HZ1 LYS 9 HZ1 LYS 9 8.856 0.720 -8.734
73 HZ2 LYS 9 HZ2 LYS 9 10.191 1.744 -8.870
74 HZ3 LYS 9 HZ3 LYS 9 8.793 2.280 -8.086
75 H VAL 10 H VAL 10 11.970 3.075 -1.276
76 HA VAL 10 HA VAL 10 9.619 1.719 -0.529
77 HB VAL 10 HB VAL 10 11.692 1.359 0.689
78 HG11 VAL 10 HG11 VAL 10 11.375 4.176 1.711
79 HG12 VAL 10 HG12 VAL 10 12.620 3.606 0.601
80 HG13 VAL 10 HG13 VAL 10 12.578 3.007 2.259
81 HG21 VAL 10 HG21 VAL 10 9.502 2.511 2.410
82 HG22 VAL 10 HG22 VAL 10 10.820 1.500 2.996
83 HG23 VAL 10 HG23 VAL 10 9.646 0.842 1.855
84 H GLU 11 H GLU 11 10.594 5.101 -0.143
85 HA GLU 11 HA GLU 11 8.372 5.908 1.403
86 HB2 GLU 11 HB3 GLU 11 10.453 7.238 1.140
87 HB3 GLU 11 HB2 GLU 11 10.013 7.562 -0.530
88 HG2 GLU 11 HG3 GLU 11 8.066 8.793 0.171
89 HG3 GLU 11 HG2 GLU 11 8.371 8.379 1.857
90 H GLU 12 H GLU 12 8.906 5.605 -2.062
91 HA GLU 12 HA GLU 12 6.526 6.798 -2.944
92 HB2 GLU 12 HB3 GLU 12 8.409 6.190 -4.428
93 HB3 GLU 12 HB2 GLU 12 8.013 4.491 -4.211
94 HG2 GLU 12 HG3 GLU 12 7.155 5.285 -6.319
95 HG3 GLU 12 HG2 GLU 12 5.824 4.879 -5.240
96 H LEU 13 H LEU 13 7.183 3.298 -2.410
97 HA LEU 13 HA LEU 13 4.473 2.573 -2.719
98 HB2 LEU 13 HB3 LEU 13 6.773 1.120 -1.444
99 HB3 LEU 13 HB2 LEU 13 5.148 0.466 -1.438
100 HG LEU 13 HG LEU 13 5.213 0.839 -3.983
101 HD11 LEU 13 HD11 LEU 13 7.434 0.649 -4.980
102 HD12 LEU 13 HD12 LEU 13 8.165 0.793 -3.382
103 HD13 LEU 13 HD13 LEU 13 7.260 2.146 -4.063
104 HD21 LEU 13 HD21 LEU 13 6.204 -1.375 -4.308
105 HD22 LEU 13 HD22 LEU 13 5.127 -1.344 -2.912
106 HD23 LEU 13 HD23 LEU 13 6.874 -1.314 -2.678
107 H LEU 14 H LEU 14 6.269 3.616 0.110
108 HA LEU 14 HA LEU 14 4.319 3.104 2.035
109 HB2 LEU 14 HB3 LEU 14 6.576 3.856 2.581
110 HB3 LEU 14 HB2 LEU 14 6.286 5.396 1.814
111 HG LEU 14 HG LEU 14 6.275 5.333 4.341
112 HD11 LEU 14 HD11 LEU 14 3.856 6.460 2.963
113 HD12 LEU 14 HD12 LEU 14 5.437 7.230 3.093
114 HD13 LEU 14 HD13 LEU 14 4.471 6.949 4.542
115 HD21 LEU 14 HD21 LEU 14 4.959 3.285 4.613
116 HD22 LEU 14 HD22 LEU 14 3.558 4.105 3.922
117 HD23 LEU 14 HD23 LEU 14 4.232 4.653 5.454
118 H SER 15 H SER 15 4.732 5.799 -0.200
119 HA SER 15 HA SER 15 2.421 7.216 0.600
120 HB2 SER 15 HB3 SER 15 3.813 7.255 -2.088
121 HB3 SER 15 HB2 SER 15 2.717 8.486 -1.459
122 HG SER 15 HG SER 15 5.267 7.761 -0.427
123 H LYS 16 H LYS 16 3.007 4.677 -1.826
124 HA LYS 16 HA LYS 16 0.538 4.797 -3.123
125 HB2 LYS 16 HB3 LYS 16 2.367 2.456 -2.615
126 HB3 LYS 16 HB2 LYS 16 0.928 2.350 -3.617
127 HG2 LYS 16 HG3 LYS 16 1.857 4.105 -5.082
128 HG3 LYS 16 HG2 LYS 16 3.325 4.104 -4.103
129 HD2 LYS 16 HD3 LYS 16 3.678 2.742 -6.061
130 HD3 LYS 16 HD2 LYS 16 3.628 1.707 -4.636
131 HE2 LYS 16 HE3 LYS 16 2.379 0.703 -6.464
132 HE3 LYS 16 HE2 LYS 16 1.300 1.130 -5.139
133 HZ1 LYS 16 HZ1 LYS 16 0.624 3.095 -6.341
134 HZ2 LYS 16 HZ2 LYS 16 0.392 1.730 -7.310
135 HZ3 LYS 16 HZ3 LYS 16 1.708 2.750 -7.593
136 H ASN 17 H ASN 17 1.473 2.686 -0.385
137 HA ASN 17 HA ASN 17 -1.158 1.624 -0.152
138 HB2 ASN 17 HB3 ASN 17 -0.400 0.397 1.716
139 HB3 ASN 17 HB2 ASN 17 0.988 0.500 0.643
140 HD21 ASN 17 HD21 ASN 17 2.774 1.693 1.270
141 HD22 ASN 17 HD22 ASN 17 2.976 2.277 2.885
142 H TYR 18 H TYR 18 0.430 4.408 1.151
143 HA TYR 18 HA TYR 18 -1.325 4.931 3.301
144 HB2 TYR 18 HB3 TYR 18 0.863 6.036 3.069
145 HB3 TYR 18 HB2 TYR 18 0.295 6.864 1.625
146 HD1 TYR 18 HD1 TYR 18 -1.042 8.833 1.780
147 HD2 TYR 18 HD2 TYR 18 -0.082 6.624 5.286
148 HE1 TYR 18 HE1 TYR 18 -1.857 10.688 3.168
149 HE2 TYR 18 HE2 TYR 18 -0.901 8.475 6.681
150 HH TYR 18 HH TYR 18 -2.730 11.044 5.440
151 H HIS 19 H HIS 19 -1.242 6.159 -0.039
152 HA HIS 19 HA HIS 19 -3.692 7.599 0.202
153 HB2 HIS 19 HB3 HIS 19 -2.026 6.748 -2.160
154 HB3 HIS 19 HB2 HIS 19 -3.562 7.581 -2.365
155 HD1 HIS 19 HD1 HIS 19 -3.383 10.033 -2.510
156 HD2 HIS 19 HD2 HIS 19 -0.186 8.380 -0.437
157 HE1 HIS 19 HE1 HIS 19 -1.858 11.955 -1.983
158 HE2 HIS 19 HE2 HIS 19 -0.037 10.958 -0.555
159 H LEU 20 H LEU 20 -2.822 4.370 -0.806
160 HA LEU 20 HA LEU 20 -5.282 3.663 -1.983
161 HB2 LEU 20 HB3 LEU 20 -3.176 2.500 -2.403
162 HB3 LEU 20 HB2 LEU 20 -3.120 1.978 -0.732
163 HG LEU 20 HG LEU 20 -5.133 0.635 -1.089
164 HD11 LEU 20 HD11 LEU 20 -5.927 0.242 -3.387
165 HD12 LEU 20 HD12 LEU 20 -4.853 1.519 -3.957
166 HD13 LEU 20 HD13 LEU 20 -6.183 1.907 -2.865
167 HD21 LEU 20 HD21 LEU 20 -4.068 -1.092 -2.428
168 HD22 LEU 20 HD22 LEU 20 -2.894 -0.325 -1.362
169 HD23 LEU 20 HD23 LEU 20 -2.934 0.090 -3.075
170 H GLU 21 H GLU 21 -4.009 3.449 1.313
171 HA GLU 21 HA GLU 21 -6.192 2.000 2.399
172 HB2 GLU 21 HB3 GLU 21 -3.989 2.286 3.528
173 HB3 GLU 21 HB2 GLU 21 -4.387 3.975 3.809
174 HG2 GLU 21 HG3 GLU 21 -6.289 3.309 5.175
175 HG3 GLU 21 HG2 GLU 21 -5.911 1.613 4.883
176 H ASN 22 H ASN 22 -5.654 5.380 1.713
177 HA ASN 22 HA ASN 22 -7.885 6.413 3.111
178 HB2 ASN 22 HB3 ASN 22 -6.452 7.476 0.670
179 HB3 ASN 22 HB2 ASN 22 -7.677 8.364 1.566
180 HD21 ASN 22 HD21 ASN 22 -4.924 9.071 1.084
181 HD22 ASN 22 HD22 ASN 22 -4.184 9.241 2.636
182 H GLU 23 H GLU 23 -7.495 4.780 0.090
183 HA GLU 23 HA GLU 23 -9.976 5.574 -1.077
184 HB2 GLU 23 HB3 GLU 23 -8.316 3.116 -1.695
185 HB3 GLU 23 HB2 GLU 23 -9.571 3.836 -2.727
186 HG2 GLU 23 HG3 GLU 23 -6.899 5.030 -2.002
187 HG3 GLU 23 HG2 GLU 23 -7.394 4.403 -3.573
188 H VAL 24 H VAL 24 -8.868 2.792 0.807
189 HA VAL 24 HA VAL 24 -11.230 1.280 0.711
190 HB VAL 24 HB VAL 24 -9.359 1.457 3.086
191 HG11 VAL 24 HG11 VAL 24 -11.164 -0.776 2.146
192 HG12 VAL 24 HG12 VAL 24 -11.460 0.283 3.526
193 HG13 VAL 24 HG13 VAL 24 -10.090 -0.827 3.546
194 HG21 VAL 24 HG21 VAL 24 -9.154 -0.338 0.672
195 HG22 VAL 24 HG22 VAL 24 -8.124 -0.401 2.100
196 HG23 VAL 24 HG23 VAL 24 -8.083 1.010 1.046
197 H ALA 25 H ALA 25 -10.247 3.997 2.697
198 HA ALA 25 HA ALA 25 -12.417 3.849 4.536
199 HB1 ALA 25 HB1 ALA 25 -10.721 6.246 3.869
200 HB2 ALA 25 HB2 ALA 25 -10.284 4.994 5.030
201 HB3 ALA 25 HB3 ALA 25 -11.697 6.007 5.317
202 H ARG 26 H ARG 26 -12.047 5.213 1.363
203 HA ARG 26 HA ARG 26 -14.265 7.014 1.617
204 HB2 ARG 26 HB3 ARG 26 -13.697 7.786 -0.447
205 HB3 ARG 26 HB2 ARG 26 -12.193 6.975 -0.057
206 HG2 ARG 26 HG3 ARG 26 -12.845 5.051 -1.376
207 HG3 ARG 26 HG2 ARG 26 -14.399 5.814 -1.735
208 HD2 ARG 26 HD2 ARG 26 -13.180 7.684 -2.811
209 HD3 ARG 26 HD1 ARG 26 -11.670 6.820 -2.531
210 HE ARG 26 HE ARG 26 -13.407 5.114 -3.911
211 HH11 ARG 26 HH11 ARG 26 -11.656 8.102 -4.454
212 HH12 ARG 26 HH12 ARG 26 -11.516 7.853 -6.163
213 HH21 ARG 26 HH21 ARG 26 -13.213 4.785 -6.157
214 HH22 ARG 26 HH22 ARG 26 -12.406 5.971 -7.132
215 H LEU 27 H LEU 27 -13.746 3.800 0.241
216 HA LEU 27 HA LEU 27 -16.412 3.432 -0.641
217 HB2 LEU 27 HB3 LEU 27 -14.215 1.503 0.030
218 HB3 LEU 27 HB2 LEU 27 -15.831 0.926 -0.303
219 HG LEU 27 HG LEU 27 -15.720 2.050 -2.528
220 HD11 LEU 27 HD11 LEU 27 -13.486 2.627 -3.394
221 HD12 LEU 27 HD12 LEU 27 -12.843 2.462 -1.759
222 HD13 LEU 27 HD13 LEU 27 -14.039 3.706 -2.115
223 HD21 LEU 27 HD21 LEU 27 -15.330 -0.318 -2.323
224 HD22 LEU 27 HD22 LEU 27 -13.632 -0.029 -1.937
225 HD23 LEU 27 HD23 LEU 27 -14.253 0.372 -3.537
226 H LYS 28 H LYS 28 -14.941 3.182 2.506
227 HA LYS 28 HA LYS 28 -16.804 1.626 3.850
228 HB2 LYS 28 HB3 LYS 28 -15.246 4.025 4.812
229 HB3 LYS 28 HB2 LYS 28 -16.209 3.011 5.874
230 HG2 LYS 28 HG3 LYS 28 -13.888 2.062 4.210
231 HG3 LYS 28 HG2 LYS 28 -13.823 2.450 5.930
232 HD2 LYS 28 HD3 LYS 28 -15.476 0.692 6.379
233 HD3 LYS 28 HD2 LYS 28 -15.518 0.299 4.660
234 HE2 LYS 28 HE3 LYS 28 -14.085 -1.270 5.781
235 HE3 LYS 28 HE2 LYS 28 -13.099 -0.220 4.768
236 HZ1 LYS 28 HZ1 LYS 28 -12.553 1.084 6.747
237 HZ2 LYS 28 HZ2 LYS 28 -12.073 -0.525 6.912
238 HZ3 LYS 28 HZ3 LYS 28 -13.460 0.025 7.704
239 H LYS 29 H LYS 29 -16.969 5.056 2.994
240 HA LYS 29 HA LYS 29 -19.460 5.463 4.345
241 HB2 LYS 29 HB3 LYS 29 -17.864 7.103 2.393
242 HB3 LYS 29 HB2 LYS 29 -19.469 7.587 2.904
243 HG2 LYS 29 HG3 LYS 29 -17.828 8.758 4.205
244 HG3 LYS 29 HG2 LYS 29 -18.689 7.624 5.244
245 HD2 LYS 29 HD3 LYS 29 -16.819 6.039 5.024
246 HD3 LYS 29 HD2 LYS 29 -15.958 7.214 4.029
247 HE2 LYS 29 HE3 LYS 29 -15.138 7.310 6.300
248 HE3 LYS 29 HE2 LYS 29 -15.998 8.799 5.912
249 HZ1 LYS 29 HZ1 LYS 29 -17.129 6.519 7.439
250 HZ2 LYS 29 HZ2 LYS 29 -17.916 7.974 7.102
251 HZ3 LYS 29 HZ3 LYS 29 -16.563 7.961 8.113
252 H LEU 30 H LEU 30 -18.430 4.550 1.140
253 HA LEU 30 HA LEU 30 -20.951 4.896 -0.133
254 HB2 LEU 30 HB3 LEU 30 -18.709 3.017 -0.889
255 HB3 LEU 30 HB2 LEU 30 -20.023 3.533 -1.927
256 HG LEU 30 HG LEU 30 -17.820 5.294 -0.846
257 HD11 LEU 30 HD11 LEU 30 -17.078 3.771 -2.599
258 HD12 LEU 30 HD12 LEU 30 -17.112 5.436 -3.175
259 HD13 LEU 30 HD13 LEU 30 -18.392 4.316 -3.640
260 HD21 LEU 30 HD21 LEU 30 -18.770 7.026 -2.294
261 HD22 LEU 30 HD22 LEU 30 -19.905 6.533 -1.038
262 HD23 LEU 30 HD23 LEU 30 -20.112 5.955 -2.691
263 H VAL 31 H VAL 31 -19.634 2.510 1.959
264 HA VAL 31 HA VAL 31 -21.759 0.602 1.362
265 HB VAL 31 HB VAL 31 -19.516 0.420 3.396
266 HG11 VAL 31 HG11 VAL 31 -20.092 -1.952 3.531
267 HG12 VAL 31 HG12 VAL 31 -21.452 -1.686 2.441
268 HG13 VAL 31 HG13 VAL 31 -21.440 -0.934 4.036
269 HG21 VAL 31 HG21 VAL 31 -18.497 -1.161 1.837
270 HG22 VAL 31 HG22 VAL 31 -18.680 0.435 1.110
271 HG23 VAL 31 HG23 VAL 31 -19.795 -0.862 0.682
272 H GLY 32 H GLY 32 -20.908 3.055 3.676
273 HA2 GLY 32 HA3 GLY 32 -22.772 2.050 5.667
274 HA3 GLY 32 HA2 GLY 32 -21.692 3.418 5.852
275 H GLU 33 H GLU 33 -22.544 4.723 3.397
276 HA GLU 33 HA GLU 33 -24.033 6.276 2.692
277 HB2 GLU 33 HB3 GLU 33 -26.030 4.583 4.199
278 HB3 GLU 33 HB2 GLU 33 -26.476 6.043 3.334
279 HG2 GLU 33 HG3 GLU 33 -26.994 4.280 1.892
280 HG3 GLU 33 HG2 GLU 33 -25.490 4.955 1.272
281 H1 GLY 1 H1 GLY 1 25.641 -5.456 6.977
282 H2 GLY 1 H2 GLY 1 25.675 -7.101 6.591
283 H3 GLY 1 H3 GLY 1 24.442 -6.489 7.570
284 HA2 GLY 1 HA2 GLY 1 24.880 -5.812 4.718
285 HA3 GLY 1 HA3 GLY 1 23.640 -6.898 5.331
286 H SER 2 H SER 2 23.162 -4.564 3.792
287 HA SER 2 HA SER 2 21.402 -3.179 5.654
288 HB2 SER 2 HB3 SER 2 23.559 -1.867 5.492
289 HB3 SER 2 HB2 SER 2 23.187 -1.604 3.789
290 HG SER 2 HG SER 2 22.213 -0.353 5.980
291 H MET 3 H MET 3 22.486 -3.175 2.223
292 HA MET 3 HA MET 3 20.072 -2.229 1.177
293 HB2 MET 3 HB3 MET 3 22.161 -3.966 -0.135
294 HB3 MET 3 HB2 MET 3 20.850 -3.167 -0.989
295 HG2 MET 3 HG3 MET 3 21.742 -0.999 -0.069
296 HG3 MET 3 HG2 MET 3 23.158 -1.905 0.451
297 HE1 MET 3 HE1 MET 3 21.044 -0.627 -2.568
298 HE2 MET 3 HE2 MET 3 21.002 -2.366 -2.858
299 HE3 MET 3 HE3 MET 3 21.899 -1.311 -3.950
300 H LYS 4 H LYS 4 21.011 -5.451 2.129
301 HA LYS 4 HA LYS 4 18.996 -6.892 0.789
302 HB2 LYS 4 HB3 LYS 4 20.476 -7.434 3.362
303 HB3 LYS 4 HB2 LYS 4 19.300 -8.556 2.697
304 HG2 LYS 4 HG3 LYS 4 20.639 -8.787 0.677
305 HG3 LYS 4 HG2 LYS 4 21.811 -7.635 1.310
306 HD2 LYS 4 HD3 LYS 4 22.207 -9.156 3.225
307 HD3 LYS 4 HD2 LYS 4 21.118 -10.326 2.477
308 HE2 LYS 4 HE3 LYS 4 22.583 -10.389 0.500
309 HE3 LYS 4 HE2 LYS 4 23.681 -9.264 1.294
310 HZ1 LYS 4 HZ1 LYS 4 23.995 -10.919 3.056
311 HZ2 LYS 4 HZ2 LYS 4 24.471 -11.503 1.545
312 HZ3 LYS 4 HZ3 LYS 4 23.003 -12.001 2.216
313 H GLN 5 H GLN 5 19.009 -5.053 3.763
314 HA GLN 5 HA GLN 5 16.489 -5.954 4.725
315 HB2 GLN 5 HB3 GLN 5 17.924 -3.360 5.318
316 HB3 GLN 5 HB2 GLN 5 16.622 -4.066 6.265
317 HG2 GLN 5 HG3 GLN 5 18.044 -5.969 6.812
318 HG3 GLN 5 HG2 GLN 5 19.348 -5.271 5.853
319 HE21 GLN 5 HE21 GLN 5 17.514 -5.060 8.781
320 HE22 GLN 5 HE22 GLN 5 18.547 -3.934 9.588
321 H LEU 6 H LEU 6 17.556 -3.265 2.713
322 HA LEU 6 HA LEU 6 15.056 -1.972 2.483
323 HB2 LEU 6 HB3 LEU 6 17.538 -1.981 0.794
324 HB3 LEU 6 HB2 LEU 6 16.091 -1.177 0.227
325 HG LEU 6 HG LEU 6 17.586 0.431 1.222
326 HD11 LEU 6 HD11 LEU 6 15.181 0.783 1.496
327 HD12 LEU 6 HD12 LEU 6 16.105 1.456 2.838
328 HD13 LEU 6 HD13 LEU 6 15.238 -0.065 3.041
329 HD21 LEU 6 HD21 LEU 6 18.828 -1.038 2.703
330 HD22 LEU 6 HD22 LEU 6 17.409 -1.224 3.733
331 HD23 LEU 6 HD23 LEU 6 18.193 0.349 3.587
332 H GLU 7 H GLU 7 16.619 -4.499 0.568
333 HA GLU 7 HA GLU 7 14.677 -4.677 -1.457
334 HB2 GLU 7 HB3 GLU 7 16.522 -6.811 -0.373
335 HB3 GLU 7 HB2 GLU 7 15.608 -6.938 -1.869
336 HG2 GLU 7 HG3 GLU 7 16.822 -5.030 -2.781
337 HG3 GLU 7 HG2 GLU 7 17.731 -4.889 -1.278
338 H ASP 8 H ASP 8 14.912 -6.227 1.705
339 HA ASP 8 HA ASP 8 12.556 -7.830 1.292
340 HB2 ASP 8 HB3 ASP 8 14.244 -7.236 3.715
341 HB3 ASP 8 HB2 ASP 8 12.749 -8.158 3.829
342 H LYS 9 H LYS 9 13.219 -4.627 2.323
343 HA LYS 9 HA LYS 9 10.806 -4.273 3.840
344 HB2 LYS 9 HB3 LYS 9 12.927 -2.982 4.226
345 HB3 LYS 9 HB2 LYS 9 12.634 -2.150 2.706
346 HG2 LYS 9 HG3 LYS 9 11.909 -0.751 4.500
347 HG3 LYS 9 HG2 LYS 9 10.487 -1.328 3.630
348 HD2 LYS 9 HD3 LYS 9 10.084 -3.000 5.338
349 HD3 LYS 9 HD2 LYS 9 11.554 -2.520 6.187
350 HE2 LYS 9 HE3 LYS 9 10.594 -0.275 6.524
351 HE3 LYS 9 HE2 LYS 9 9.114 -0.805 5.725
352 HZ1 LYS 9 HZ1 LYS 9 8.889 -0.905 8.117
353 HZ2 LYS 9 HZ2 LYS 9 10.231 -1.923 8.237
354 HZ3 LYS 9 HZ3 LYS 9 8.829 -2.466 7.469
355 H VAL 10 H VAL 10 11.961 -3.237 0.634
356 HA VAL 10 HA VAL 10 9.609 -1.881 -0.099
357 HB VAL 10 HB VAL 10 11.676 -1.520 -1.321
358 HG11 VAL 10 HG11 VAL 10 11.353 -4.333 -2.356
359 HG12 VAL 10 HG12 VAL 10 12.603 -3.768 -1.249
360 HG13 VAL 10 HG13 VAL 10 12.552 -3.163 -2.904
361 HG21 VAL 10 HG21 VAL 10 9.472 -2.658 -3.032
362 HG22 VAL 10 HG22 VAL 10 10.792 -1.653 -3.625
363 HG23 VAL 10 HG23 VAL 10 9.629 -0.993 -2.474
364 H GLU 11 H GLU 11 10.579 -5.263 -0.502
365 HA GLU 11 HA GLU 11 8.348 -6.060 -2.039
366 HB2 GLU 11 HB3 GLU 11 10.426 -7.394 -1.785
367 HB3 GLU 11 HB2 GLU 11 9.991 -7.720 -0.116
368 HG2 GLU 11 HG3 GLU 11 8.040 -8.948 -0.814
369 HG3 GLU 11 HG2 GLU 11 8.343 -8.530 -2.499
370 H GLU 12 H GLU 12 8.894 -5.763 1.420
371 HA GLU 12 HA GLU 12 6.519 -6.962 2.308
372 HB2 GLU 12 HB3 GLU 12 8.410 -6.365 3.788
373 HB3 GLU 12 HB2 GLU 12 8.011 -4.665 3.584
374 HG2 GLU 12 HG3 GLU 12 7.163 -5.474 5.689
375 HG3 GLU 12 HG2 GLU 12 5.828 -5.058 4.618
376 H LEU 13 H LEU 13 7.176 -3.460 1.789
377 HA LEU 13 HA LEU 13 4.468 -2.737 2.111
378 HB2 LEU 13 HB3 LEU 13 6.764 -1.279 0.831
379 HB3 LEU 13 HB2 LEU 13 5.139 -0.624 0.837
380 HG LEU 13 HG LEU 13 5.218 -1.008 3.380
381 HD11 LEU 13 HD11 LEU 13 7.443 -0.825 4.368
382 HD12 LEU 13 HD12 LEU 13 8.167 -0.959 2.766
383 HD13 LEU 13 HD13 LEU 13 7.266 -2.316 3.443
384 HD21 LEU 13 HD21 LEU 13 6.214 1.204 3.710
385 HD22 LEU 13 HD22 LEU 13 5.127 1.179 2.322
386 HD23 LEU 13 HD23 LEU 13 6.873 1.148 2.075
387 H LEU 14 H LEU 14 6.252 -3.774 -0.729
388 HA LEU 14 HA LEU 14 4.296 -3.250 -2.647
389 HB2 LEU 14 HB3 LEU 14 6.550 -4.002 -3.204
390 HB3 LEU 14 HB2 LEU 14 6.263 -5.544 -2.440
391 HG LEU 14 HG LEU 14 6.244 -5.480 -4.965
392 HD11 LEU 14 HD11 LEU 14 3.827 -6.601 -3.578
393 HD12 LEU 14 HD12 LEU 14 5.404 -7.377 -3.719
394 HD13 LEU 14 HD13 LEU 14 4.430 -7.087 -5.162
395 HD21 LEU 14 HD21 LEU 14 4.932 -3.427 -5.227
396 HD22 LEU 14 HD22 LEU 14 3.530 -4.248 -4.538
397 HD23 LEU 14 HD23 LEU 14 4.203 -4.791 -6.073
398 H SER 15 H SER 15 4.713 -5.953 -0.423
399 HA SER 15 HA SER 15 2.395 -7.360 -1.221
400 HB2 SER 15 HB3 SER 15 3.811 -7.419 1.453
401 HB3 SER 15 HB2 SER 15 2.701 -8.641 0.831
402 HG SER 15 HG SER 15 5.265 -7.938 -0.177
403 H LYS 16 H LYS 16 3.000 -4.832 1.214
404 HA LYS 16 HA LYS 16 0.538 -4.955 2.524
405 HB2 LYS 16 HB3 LYS 16 2.368 -2.617 2.015
406 HB3 LYS 16 HB2 LYS 16 0.933 -2.510 3.022
407 HG2 LYS 16 HG3 LYS 16 1.864 -4.271 4.479
408 HG3 LYS 16 HG2 LYS 16 3.329 -4.270 3.495
409 HD2 LYS 16 HD3 LYS 16 3.693 -2.910 5.449
410 HD3 LYS 16 HD2 LYS 16 3.630 -1.870 4.029
411 HE2 LYS 16 HE3 LYS 16 2.391 -0.872 5.864
412 HE3 LYS 16 HE2 LYS 16 1.302 -1.305 4.550
413 HZ1 LYS 16 HZ1 LYS 16 0.641 -3.269 5.763
414 HZ2 LYS 16 HZ2 LYS 16 0.420 -1.906 6.737
415 HZ3 LYS 16 HZ3 LYS 16 1.742 -2.926 7.000
416 H ASN 17 H ASN 17 1.458 -2.842 -0.218
417 HA ASN 17 HA ASN 17 -1.172 -1.773 -0.432
418 HB2 ASN 17 HB3 ASN 17 -0.420 -0.542 -2.302
419 HB3 ASN 17 HB2 ASN 17 0.973 -0.650 -1.235
420 HD21 ASN 17 HD21 ASN 17 2.755 -1.838 -1.872
421 HD22 ASN 17 HD22 ASN 17 2.948 -2.423 -3.489
422 H TYR 18 H TYR 18 0.410 -4.554 -1.753
423 HA TYR 18 HA TYR 18 -1.356 -5.070 -3.891
424 HB2 TYR 18 HB3 TYR 18 0.832 -6.175 -3.671
425 HB3 TYR 18 HB2 TYR 18 0.268 -7.010 -2.229
426 HD1 TYR 18 HD1 TYR 18 -1.073 -8.972 -2.386
427 HD2 TYR 18 HD2 TYR 18 -0.121 -6.759 -5.891
428 HE1 TYR 18 HE1 TYR 18 -1.900 -10.821 -3.771
429 HE2 TYR 18 HE2 TYR 18 -0.950 -8.605 -7.288
430 HH TYR 18 HH TYR 18 -2.789 -11.169 -6.042
431 H HIS 19 H HIS 19 -1.259 -6.316 -0.558
432 HA HIS 19 HA HIS 19 -3.716 -7.743 -0.788
433 HB2 HIS 19 HB3 HIS 19 -2.036 -6.902 1.570
434 HB3 HIS 19 HB2 HIS 19 -3.575 -7.729 1.779
435 HD1 HIS 19 HD1 HIS 19 -3.408 -10.184 1.916
436 HD2 HIS 19 HD2 HIS 19 -0.205 -8.537 -0.156
437 HE1 HIS 19 HE1 HIS 19 -1.887 -12.113 1.376
438 HE2 HIS 19 HE2 HIS 19 -0.065 -11.114 -0.047
439 H LEU 20 H LEU 20 -2.832 -4.516 0.222
440 HA LEU 20 HA LEU 20 -5.287 -3.811 1.415
441 HB2 LEU 20 HB3 LEU 20 -3.179 -2.652 1.830
442 HB3 LEU 20 HB2 LEU 20 -3.128 -2.125 0.162
443 HG LEU 20 HG LEU 20 -5.137 -0.782 0.529
444 HD11 LEU 20 HD11 LEU 20 -5.924 -0.395 2.831
445 HD12 LEU 20 HD12 LEU 20 -4.856 -1.681 3.392
446 HD13 LEU 20 HD13 LEU 20 -6.189 -2.055 2.299
447 HD21 LEU 20 HD21 LEU 20 -4.065 0.936 1.872
448 HD22 LEU 20 HD22 LEU 20 -2.899 0.173 0.796
449 HD23 LEU 20 HD23 LEU 20 -2.931 -0.252 2.507
450 H GLU 21 H GLU 21 -4.027 -3.588 -1.886
451 HA GLU 21 HA GLU 21 -6.212 -2.133 -2.957
452 HB2 GLU 21 HB3 GLU 21 -4.014 -2.420 -4.097
453 HB3 GLU 21 HB2 GLU 21 -4.419 -4.105 -4.384
454 HG2 GLU 21 HG3 GLU 21 -6.321 -3.428 -5.741
455 HG3 GLU 21 HG2 GLU 21 -5.943 -1.734 -5.439
456 H ASN 22 H ASN 22 -5.680 -5.516 -2.281
457 HA ASN 22 HA ASN 22 -7.917 -6.539 -3.680
458 HB2 ASN 22 HB3 ASN 22 -6.475 -7.614 -1.249
459 HB3 ASN 22 HB2 ASN 22 -7.705 -8.499 -2.143
460 HD21 ASN 22 HD21 ASN 22 -4.962 -9.216 -1.683
461 HD22 ASN 22 HD22 ASN 22 -4.227 -9.376 -3.240
462 H GLU 23 H GLU 23 -7.512 -4.920 -0.653
463 HA GLU 23 HA GLU 23 -9.988 -5.711 0.523
464 HB2 GLU 23 HB3 GLU 23 -8.320 -3.256 1.136
465 HB3 GLU 23 HB2 GLU 23 -9.572 -3.973 2.172
466 HG2 GLU 23 HG3 GLU 23 -6.910 -5.172 1.432
467 HG3 GLU 23 HG2 GLU 23 -7.399 -4.555 3.008
468 H VAL 24 H VAL 24 -8.888 -2.929 -1.361
469 HA VAL 24 HA VAL 24 -11.246 -1.412 -1.253
470 HB VAL 24 HB VAL 24 -9.382 -1.582 -3.634
471 HG11 VAL 24 HG11 VAL 24 -11.179 0.649 -2.682
472 HG12 VAL 24 HG12 VAL 24 -11.482 -0.404 -4.064
473 HG13 VAL 24 HG13 VAL 24 -10.111 0.704 -4.085
474 HG21 VAL 24 HG21 VAL 24 -9.167 0.206 -1.215
475 HG22 VAL 24 HG22 VAL 24 -8.141 0.269 -2.646
476 HG23 VAL 24 HG23 VAL 24 -8.100 -1.145 -1.595
477 H ALA 25 H ALA 25 -10.273 -4.122 -3.248
478 HA ALA 25 HA ALA 25 -12.453 -3.970 -5.075
479 HB1 ALA 25 HB1 ALA 25 -10.754 -6.370 -4.432
480 HB2 ALA 25 HB2 ALA 25 -10.323 -5.112 -5.589
481 HB3 ALA 25 HB3 ALA 25 -11.739 -6.122 -5.872
482 H ARG 26 H ARG 26 -12.072 -5.333 -1.908
483 HA ARG 26 HA ARG 26 -14.292 -7.137 -2.157
484 HB2 ARG 26 HB3 ARG 26 -13.716 -7.916 -0.100
485 HB3 ARG 26 HB2 ARG 26 -12.212 -7.109 -0.494
486 HG2 ARG 26 HG3 ARG 26 -12.853 -5.186 0.833
487 HG3 ARG 26 HG2 ARG 26 -14.407 -5.947 1.198
488 HD2 ARG 26 HD2 ARG 26 -13.183 -7.822 2.259
489 HD3 ARG 26 HD1 ARG 26 -11.674 -6.958 1.977
490 HE ARG 26 HE ARG 26 -13.395 -5.256 3.369
491 HH11 ARG 26 HH11 ARG 26 -11.650 -8.248 3.891
492 HH12 ARG 26 HH12 ARG 26 -11.517 -8.017 5.604
493 HH21 ARG 26 HH21 ARG 26 -13.203 -4.948 5.616
494 HH22 ARG 26 HH22 ARG 26 -12.409 -6.146 6.584
495 H LEU 27 H LEU 27 -13.764 -3.929 -0.775
496 HA LEU 27 HA LEU 27 -16.424 -3.560 0.118
497 HB2 LEU 27 HB3 LEU 27 -14.226 -1.634 -0.555
498 HB3 LEU 27 HB2 LEU 27 -15.840 -1.055 -0.214
499 HG LEU 27 HG LEU 27 -15.721 -2.184 2.008
500 HD11 LEU 27 HD11 LEU 27 -13.484 -2.772 2.860
501 HD12 LEU 27 HD12 LEU 27 -12.850 -2.603 1.221
502 HD13 LEU 27 HD13 LEU 27 -14.048 -3.845 1.581
503 HD21 LEU 27 HD21 LEU 27 -15.325 0.183 1.809
504 HD22 LEU 27 HD22 LEU 27 -13.630 -0.110 1.414
505 HD23 LEU 27 HD23 LEU 27 -14.245 -0.513 3.016
506 H LYS 28 H LYS 28 -14.963 -3.293 -3.036
507 HA LYS 28 HA LYS 28 -16.833 -1.738 -4.369
508 HB2 LYS 28 HB3 LYS 28 -15.283 -4.137 -5.343
509 HB3 LYS 28 HB2 LYS 28 -16.249 -3.117 -6.400
510 HG2 LYS 28 HG3 LYS 28 -13.921 -2.176 -4.737
511 HG3 LYS 28 HG2 LYS 28 -13.857 -2.560 -6.457
512 HD2 LYS 28 HD3 LYS 28 -15.510 -0.800 -6.900
513 HD3 LYS 28 HD2 LYS 28 -15.551 -0.412 -5.180
514 HE2 LYS 28 HE3 LYS 28 -14.119 1.162 -6.298
515 HE3 LYS 28 HE2 LYS 28 -13.133 0.111 -5.285
516 HZ1 LYS 28 HZ1 LYS 28 -12.581 -1.184 -7.263
517 HZ2 LYS 28 HZ2 LYS 28 -12.106 0.430 -7.426
518 HZ3 LYS 28 HZ3 LYS 28 -13.490 -0.129 -8.220
519 H LYS 29 H LYS 29 -16.999 -5.172 -3.528
520 HA LYS 29 HA LYS 29 -19.503 -5.557 -4.860
521 HB2 LYS 29 HB3 LYS 29 -17.904 -7.223 -2.925
522 HB3 LYS 29 HB2 LYS 29 -19.510 -7.697 -3.439
523 HG2 LYS 29 HG3 LYS 29 -17.855 -8.874 -4.729
524 HG3 LYS 29 HG2 LYS 29 -18.723 -7.760 -5.780
525 HD2 LYS 29 HD3 LYS 29 -16.860 -6.154 -5.557
526 HD3 LYS 29 HD2 LYS 29 -15.992 -7.329 -4.568
527 HE2 LYS 29 HE3 LYS 29 -15.181 -7.419 -6.840
528 HE3 LYS 29 HE2 LYS 29 -16.037 -8.909 -6.453
529 HZ1 LYS 29 HZ1 LYS 29 -17.175 -6.627 -7.969
530 HZ2 LYS 29 HZ2 LYS 29 -17.963 -8.083 -7.632
531 HZ3 LYS 29 HZ3 LYS 29 -16.616 -8.070 -8.648
532 H LEU 30 H LEU 30 -18.447 -4.670 -1.658
533 HA LEU 30 HA LEU 30 -20.958 -5.022 -0.372
534 HB2 LEU 30 HB3 LEU 30 -18.716 -3.140 0.372
535 HB3 LEU 30 HB2 LEU 30 -20.024 -3.656 1.418
536 HG LEU 30 HG LEU 30 -17.831 -5.421 0.322
537 HD11 LEU 30 HD11 LEU 30 -17.078 -3.902 2.077
538 HD12 LEU 30 HD12 LEU 30 -17.114 -5.569 2.648
539 HD13 LEU 30 HD13 LEU 30 -18.390 -4.448 3.118
540 HD21 LEU 30 HD21 LEU 30 -18.782 -7.151 1.772
541 HD22 LEU 30 HD22 LEU 30 -19.919 -6.653 0.521
542 HD23 LEU 30 HD23 LEU 30 -20.119 -6.075 2.175
543 H VAL 31 H VAL 31 -19.657 -2.622 -2.461
544 HA VAL 31 HA VAL 31 -21.781 -0.717 -1.850
545 HB VAL 31 HB VAL 31 -19.545 -0.533 -3.893
546 HG11 VAL 31 HG11 VAL 31 -20.118 1.844 -4.018
547 HG12 VAL 31 HG12 VAL 31 -21.476 1.574 -2.926
548 HG13 VAL 31 HG13 VAL 31 -21.468 0.827 -4.523
549 HG21 VAL 31 HG21 VAL 31 -18.516 1.045 -2.335
550 HG22 VAL 31 HG22 VAL 31 -18.696 -0.554 -1.614
551 HG23 VAL 31 HG23 VAL 31 -19.809 0.741 -1.174
552 H GLY 32 H GLY 32 -20.943 -3.160 -4.181
553 HA2 GLY 32 HA3 GLY 32 -22.816 -2.141 -6.163
554 HA3 GLY 32 HA2 GLY 32 -21.737 -3.512 -6.356
555 H GLU 33 H GLU 33 -22.574 -4.825 -3.900
556 HA GLU 33 HA GLU 33 -24.058 -6.386 -3.196
557 HB2 GLU 33 HB3 GLU 33 -26.066 -4.686 -4.682
558 HB3 GLU 33 HB2 GLU 33 -26.504 -6.151 -3.820
559 HG2 GLU 33 HG3 GLU 33 -27.011 -4.398 -2.369
560 HG3 GLU 33 HG2 GLU 33 -25.503 -5.073 -1.762
Start of MODEL 2
1 H1 GLY 1 H1 GLY 1 24.744 -0.807 -4.555
2 H2 GLY 1 H2 GLY 1 26.186 -0.223 -5.214
3 H3 GLY 1 H3 GLY 1 24.851 -0.502 -6.215
4 HA2 GLY 1 HA2 GLY 1 25.019 1.542 -4.075
5 HA3 GLY 1 HA3 GLY 1 25.110 1.854 -5.804
6 H SER 2 H SER 2 23.313 3.133 -5.922
7 HA SER 2 HA SER 2 21.115 3.536 -6.441
8 HB2 SER 2 HB3 SER 2 20.692 0.577 -5.930
9 HB3 SER 2 HB2 SER 2 19.533 1.672 -6.681
10 HG SER 2 HG SER 2 20.754 1.778 -8.468
11 H MET 3 H MET 3 22.313 3.572 -3.748
12 HA MET 3 HA MET 3 20.451 2.756 -1.801
13 HB2 MET 3 HB3 MET 3 22.614 4.850 -1.800
14 HB3 MET 3 HB2 MET 3 21.645 4.496 -0.371
15 HG2 MET 3 HG3 MET 3 23.477 2.614 -1.838
16 HG3 MET 3 HG2 MET 3 23.726 3.315 -0.241
17 HE1 MET 3 HE1 MET 3 20.870 1.561 1.828
18 HE2 MET 3 HE2 MET 3 20.685 3.066 0.927
19 HE3 MET 3 HE3 MET 3 22.155 2.767 1.852
20 H LYS 4 H LYS 4 20.762 5.661 -3.716
21 HA LYS 4 HA LYS 4 18.798 7.188 -2.319
22 HB2 LYS 4 HB3 LYS 4 19.881 7.412 -5.134
23 HB3 LYS 4 HB2 LYS 4 18.762 8.565 -4.424
24 HG2 LYS 4 HG3 LYS 4 20.386 9.210 -2.775
25 HG3 LYS 4 HG2 LYS 4 21.498 7.954 -3.321
26 HD2 LYS 4 HD3 LYS 4 21.577 9.045 -5.541
27 HD3 LYS 4 HD2 LYS 4 20.554 10.336 -4.910
28 HE2 LYS 4 HE3 LYS 4 22.248 10.930 -3.289
29 HE3 LYS 4 HE2 LYS 4 23.254 9.578 -3.804
30 HZ1 LYS 4 HZ1 LYS 4 23.475 10.600 -5.972
31 HZ2 LYS 4 HZ2 LYS 4 23.993 11.669 -4.770
32 HZ3 LYS 4 HZ3 LYS 4 22.486 11.889 -5.504
33 H GLN 5 H GLN 5 18.766 4.899 -4.957
34 HA GLN 5 HA GLN 5 16.074 5.430 -5.754
35 HB2 GLN 5 HB3 GLN 5 17.856 3.059 -6.340
36 HB3 GLN 5 HB2 GLN 5 16.329 3.405 -7.139
37 HG2 GLN 5 HG3 GLN 5 17.264 5.504 -7.992
38 HG3 GLN 5 HG2 GLN 5 18.799 5.125 -7.217
39 HE21 GLN 5 HE21 GLN 5 18.157 5.558 -10.029
40 HE22 GLN 5 HE22 GLN 5 18.654 4.126 -10.861
41 H LEU 6 H LEU 6 17.658 2.932 -3.790
42 HA LEU 6 HA LEU 6 15.381 1.355 -3.332
43 HB2 LEU 6 HB3 LEU 6 18.045 1.637 -2.077
44 HB3 LEU 6 HB2 LEU 6 16.803 0.894 -1.092
45 HG LEU 6 HG LEU 6 18.164 -0.777 -2.260
46 HD11 LEU 6 HD11 LEU 6 15.830 -1.279 -1.719
47 HD12 LEU 6 HD12 LEU 6 16.355 -2.098 -3.190
48 HD13 LEU 6 HD13 LEU 6 15.336 -0.664 -3.296
49 HD21 LEU 6 HD21 LEU 6 18.742 0.517 -4.243
50 HD22 LEU 6 HD22 LEU 6 17.064 0.450 -4.784
51 HD23 LEU 6 HD23 LEU 6 18.018 -1.030 -4.682
52 H GLU 7 H GLU 7 16.701 4.081 -1.466
53 HA GLU 7 HA GLU 7 14.799 3.853 0.630
54 HB2 GLU 7 HB3 GLU 7 15.575 6.017 1.380
55 HB3 GLU 7 HB2 GLU 7 16.954 5.047 0.886
56 HG2 GLU 7 HG3 GLU 7 17.035 6.251 -1.239
57 HG3 GLU 7 HG2 GLU 7 15.659 7.229 -0.732
58 H ASP 8 H ASP 8 14.734 5.321 -2.504
59 HA ASP 8 HA ASP 8 12.415 6.935 -1.966
60 HB2 ASP 8 HB3 ASP 8 14.109 6.386 -4.337
61 HB3 ASP 8 HB2 ASP 8 12.443 6.867 -4.644
62 H LYS 9 H LYS 9 13.061 3.724 -3.175
63 HA LYS 9 HA LYS 9 10.526 3.230 -4.310
64 HB2 LYS 9 HB3 LYS 9 12.566 1.336 -3.143
65 HB3 LYS 9 HB2 LYS 9 11.113 0.808 -3.980
66 HG2 LYS 9 HG3 LYS 9 11.864 1.971 -5.999
67 HG3 LYS 9 HG2 LYS 9 13.329 2.471 -5.153
68 HD2 LYS 9 HD3 LYS 9 13.937 0.117 -4.832
69 HD3 LYS 9 HD2 LYS 9 12.480 -0.372 -5.700
70 HE2 LYS 9 HE3 LYS 9 14.725 1.291 -6.836
71 HE3 LYS 9 HE2 LYS 9 14.481 -0.428 -7.129
72 HZ1 LYS 9 HZ1 LYS 9 13.624 0.919 -8.940
73 HZ2 LYS 9 HZ2 LYS 9 12.586 1.732 -7.882
74 HZ3 LYS 9 HZ3 LYS 9 12.371 0.082 -8.178
75 H VAL 10 H VAL 10 11.815 2.571 -1.064
76 HA VAL 10 HA VAL 10 9.448 1.364 -0.106
77 HB VAL 10 HB VAL 10 11.600 1.013 1.005
78 HG11 VAL 10 HG11 VAL 10 12.543 3.247 0.774
79 HG12 VAL 10 HG12 VAL 10 12.582 2.709 2.452
80 HG13 VAL 10 HG13 VAL 10 11.364 3.871 1.928
81 HG21 VAL 10 HG21 VAL 10 9.526 2.277 2.791
82 HG22 VAL 10 HG22 VAL 10 10.833 1.222 3.328
83 HG23 VAL 10 HG23 VAL 10 9.574 0.595 2.265
84 H GLU 11 H GLU 11 10.555 4.718 -0.168
85 HA GLU 11 HA GLU 11 8.359 5.706 1.391
86 HB2 GLU 11 HB3 GLU 11 10.315 7.095 -0.445
87 HB3 GLU 11 HB2 GLU 11 9.092 7.939 0.497
88 HG2 GLU 11 HG3 GLU 11 11.301 6.234 1.624
89 HG3 GLU 11 HG2 GLU 11 11.287 7.994 1.561
90 H GLU 12 H GLU 12 9.016 5.251 -2.025
91 HA GLU 12 HA GLU 12 6.830 6.578 -3.124
92 HB2 GLU 12 HB3 GLU 12 8.646 5.673 -4.482
93 HB3 GLU 12 HB2 GLU 12 8.173 4.036 -4.056
94 HG2 GLU 12 HG3 GLU 12 6.087 4.288 -5.240
95 HG3 GLU 12 HG2 GLU 12 6.468 5.971 -5.600
96 H LEU 13 H LEU 13 7.033 3.073 -2.360
97 HA LEU 13 HA LEU 13 4.234 2.758 -2.692
98 HB2 LEU 13 HB3 LEU 13 6.293 0.931 -1.494
99 HB3 LEU 13 HB2 LEU 13 4.585 0.533 -1.496
100 HG LEU 13 HG LEU 13 4.740 1.018 -4.049
101 HD11 LEU 13 HD11 LEU 13 7.003 1.890 -4.050
102 HD12 LEU 13 HD12 LEU 13 6.896 0.423 -5.022
103 HD13 LEU 13 HD13 LEU 13 7.609 0.362 -3.411
104 HD21 LEU 13 HD21 LEU 13 5.325 -1.346 -4.446
105 HD22 LEU 13 HD22 LEU 13 4.160 -1.134 -3.140
106 HD23 LEU 13 HD23 LEU 13 5.852 -1.471 -2.767
107 H LEU 14 H LEU 14 6.145 3.655 0.085
108 HA LEU 14 HA LEU 14 4.214 3.287 2.073
109 HB2 LEU 14 HB3 LEU 14 6.548 3.892 2.519
110 HB3 LEU 14 HB2 LEU 14 6.313 5.449 1.773
111 HG LEU 14 HG LEU 14 6.426 5.416 4.276
112 HD11 LEU 14 HD11 LEU 14 5.536 7.315 3.065
113 HD12 LEU 14 HD12 LEU 14 4.677 7.067 4.585
114 HD13 LEU 14 HD13 LEU 14 3.936 6.575 3.063
115 HD21 LEU 14 HD21 LEU 14 5.100 3.398 4.654
116 HD22 LEU 14 HD22 LEU 14 3.669 4.231 4.048
117 HD23 LEU 14 HD23 LEU 14 4.450 4.783 5.528
118 H SER 15 H SER 15 4.744 5.909 -0.222
119 HA SER 15 HA SER 15 2.478 7.438 0.586
120 HB2 SER 15 HB3 SER 15 3.930 7.470 -2.072
121 HB3 SER 15 HB2 SER 15 2.892 8.741 -1.426
122 HG SER 15 HG SER 15 5.400 7.870 -0.403
123 H LYS 16 H LYS 16 3.092 4.891 -1.741
124 HA LYS 16 HA LYS 16 0.708 5.008 -3.207
125 HB2 LYS 16 HB3 LYS 16 2.717 3.685 -3.818
126 HB3 LYS 16 HB2 LYS 16 2.347 2.570 -2.511
127 HG2 LYS 16 HG3 LYS 16 0.255 1.967 -3.605
128 HG3 LYS 16 HG2 LYS 16 0.621 3.089 -4.919
129 HD2 LYS 16 HD3 LYS 16 2.678 1.815 -5.398
130 HD3 LYS 16 HD2 LYS 16 2.246 0.671 -4.129
131 HE2 LYS 16 HE3 LYS 16 1.639 -0.196 -6.317
132 HE3 LYS 16 HE2 LYS 16 0.201 0.099 -5.340
133 HZ1 LYS 16 HZ1 LYS 16 -0.198 2.123 -6.539
134 HZ2 LYS 16 HZ2 LYS 16 -0.021 0.863 -7.651
135 HZ3 LYS 16 HZ3 LYS 16 1.241 1.955 -7.409
136 H ASN 17 H ASN 17 1.514 2.911 -0.400
137 HA ASN 17 HA ASN 17 -1.112 1.843 -0.248
138 HB2 ASN 17 HB3 ASN 17 -0.435 0.716 1.726
139 HB3 ASN 17 HB2 ASN 17 0.984 0.761 0.689
140 HD21 ASN 17 HD21 ASN 17 -0.472 1.942 3.606
141 HD22 ASN 17 HD22 ASN 17 0.955 2.638 4.281
142 H TYR 18 H TYR 18 0.335 4.732 0.957
143 HA TYR 18 HA TYR 18 -1.511 5.323 3.005
144 HB2 TYR 18 HB3 TYR 18 0.555 6.576 2.832
145 HB3 TYR 18 HB2 TYR 18 0.114 7.158 1.230
146 HD1 TYR 18 HD1 TYR 18 -0.900 9.230 1.022
147 HD2 TYR 18 HD2 TYR 18 -1.094 7.213 4.760
148 HE1 TYR 18 HE1 TYR 18 -1.983 11.196 2.020
149 HE2 TYR 18 HE2 TYR 18 -2.176 9.175 5.769
150 HH TYR 18 HH TYR 18 -2.406 11.549 5.398
151 H HIS 19 H HIS 19 -1.425 6.317 -0.412
152 HA HIS 19 HA HIS 19 -3.947 7.625 -0.331
153 HB2 HIS 19 HB3 HIS 19 -2.215 6.630 -2.581
154 HB3 HIS 19 HB2 HIS 19 -3.803 7.323 -2.889
155 HD1 HIS 19 HD1 HIS 19 -3.845 9.776 -3.221
156 HD2 HIS 19 HD2 HIS 19 -0.462 8.547 -1.137
157 HE1 HIS 19 HE1 HIS 19 -2.445 11.841 -2.924
158 HE2 HIS 19 HE2 HIS 19 -0.350 11.053 -1.771
159 H LEU 20 H LEU 20 -2.924 4.358 -1.005
160 HA LEU 20 HA LEU 20 -5.373 3.457 -2.095
161 HB2 LEU 20 HB3 LEU 20 -3.178 2.408 -2.486
162 HB3 LEU 20 HB2 LEU 20 -3.114 1.937 -0.801
163 HG LEU 20 HG LEU 20 -5.064 0.500 -1.134
164 HD11 LEU 20 HD11 LEU 20 -5.842 0.015 -3.412
165 HD12 LEU 20 HD12 LEU 20 -4.805 1.303 -4.026
166 HD13 LEU 20 HD13 LEU 20 -6.149 1.688 -2.950
167 HD21 LEU 20 HD21 LEU 20 -3.927 -1.214 -2.447
168 HD22 LEU 20 HD22 LEU 20 -2.805 -0.398 -1.361
169 HD23 LEU 20 HD23 LEU 20 -2.818 0.002 -3.079
170 H GLU 21 H GLU 21 -4.021 3.598 1.167
171 HA GLU 21 HA GLU 21 -6.070 2.105 2.442
172 HB2 GLU 21 HB3 GLU 21 -3.876 2.656 3.491
173 HB3 GLU 21 HB2 GLU 21 -4.388 4.334 3.608
174 HG2 GLU 21 HG3 GLU 21 -6.243 3.654 5.062
175 HG3 GLU 21 HG2 GLU 21 -5.687 1.984 4.968
176 H ASN 22 H ASN 22 -5.686 5.505 1.638
177 HA ASN 22 HA ASN 22 -8.054 6.419 2.884
178 HB2 ASN 22 HB3 ASN 22 -6.245 7.517 0.768
179 HB3 ASN 22 HB2 ASN 22 -7.790 8.301 1.083
180 HD21 ASN 22 HD21 ASN 22 -4.647 7.535 2.372
181 HD22 ASN 22 HD22 ASN 22 -4.720 8.619 3.718
182 H GLU 23 H GLU 23 -7.452 4.637 0.051
183 HA GLU 23 HA GLU 23 -9.816 5.354 -1.397
184 HB2 GLU 23 HB3 GLU 23 -7.811 4.539 -2.546
185 HB3 GLU 23 HB2 GLU 23 -7.936 2.994 -1.681
186 HG2 GLU 23 HG3 GLU 23 -8.734 2.698 -3.907
187 HG3 GLU 23 HG2 GLU 23 -10.104 2.606 -2.803
188 H VAL 24 H VAL 24 -8.857 2.728 0.775
189 HA VAL 24 HA VAL 24 -11.246 1.214 0.509
190 HB VAL 24 HB VAL 24 -9.519 1.296 2.989
191 HG11 VAL 24 HG11 VAL 24 -11.675 0.116 3.156
192 HG12 VAL 24 HG12 VAL 24 -10.298 -0.970 3.330
193 HG13 VAL 24 HG13 VAL 24 -11.196 -0.923 1.811
194 HG21 VAL 24 HG21 VAL 24 -8.158 -0.463 2.063
195 HG22 VAL 24 HG22 VAL 24 -8.107 0.932 0.987
196 HG23 VAL 24 HG23 VAL 24 -9.105 -0.463 0.578
197 H ALA 25 H ALA 25 -10.221 3.815 2.635
198 HA ALA 25 HA ALA 25 -12.258 3.623 4.544
199 HB1 ALA 25 HB1 ALA 25 -10.155 4.924 4.799
200 HB2 ALA 25 HB2 ALA 25 -11.610 5.791 5.287
201 HB3 ALA 25 HB3 ALA 25 -10.849 6.153 3.739
202 H ARG 26 H ARG 26 -12.136 5.512 1.512
203 HA ARG 26 HA ARG 26 -14.587 6.805 2.014
204 HB2 ARG 26 HB3 ARG 26 -14.578 7.009 -0.599
205 HB3 ARG 26 HB2 ARG 26 -13.508 7.967 0.398
206 HG2 ARG 26 HG3 ARG 26 -11.651 6.561 -0.142
207 HG3 ARG 26 HG2 ARG 26 -12.701 5.404 -0.984
208 HD2 ARG 26 HD2 ARG 26 -12.997 6.783 -2.783
209 HD3 ARG 26 HD1 ARG 26 -12.796 8.250 -1.834
210 HE ARG 26 HE ARG 26 -10.315 7.120 -1.857
211 HH11 ARG 26 HH11 ARG 26 -12.619 8.092 -4.302
212 HH12 ARG 26 HH12 ARG 26 -11.408 8.532 -5.463
213 HH21 ARG 26 HH21 ARG 26 -8.696 7.711 -3.394
214 HH22 ARG 26 HH22 ARG 26 -9.182 8.318 -4.945
215 H LEU 27 H LEU 27 -13.828 3.794 0.274
216 HA LEU 27 HA LEU 27 -16.490 3.305 -0.535
217 HB2 LEU 27 HB3 LEU 27 -14.138 1.496 -0.104
218 HB3 LEU 27 HB2 LEU 27 -15.724 0.832 -0.404
219 HG LEU 27 HG LEU 27 -15.847 2.000 -2.542
220 HD11 LEU 27 HD11 LEU 27 -13.026 2.876 -1.958
221 HD12 LEU 27 HD12 LEU 27 -14.443 3.923 -2.045
222 HD13 LEU 27 HD13 LEU 27 -13.877 3.085 -3.489
223 HD21 LEU 27 HD21 LEU 27 -15.033 -0.250 -2.526
224 HD22 LEU 27 HD22 LEU 27 -13.398 0.306 -2.164
225 HD23 LEU 27 HD23 LEU 27 -14.134 0.689 -3.720
226 H LYS 28 H LYS 28 -14.762 2.596 2.447
227 HA LYS 28 HA LYS 28 -16.622 0.983 3.716
228 HB2 LYS 28 HB3 LYS 28 -14.334 1.583 4.552
229 HB3 LYS 28 HB2 LYS 28 -14.973 3.147 5.032
230 HG2 LYS 28 HG3 LYS 28 -14.850 1.682 6.940
231 HG3 LYS 28 HG2 LYS 28 -16.540 2.020 6.554
232 HD2 LYS 28 HD3 LYS 28 -16.738 -0.129 5.436
233 HD3 LYS 28 HD2 LYS 28 -15.031 -0.461 5.733
234 HE2 LYS 28 HE3 LYS 28 -17.117 -0.049 7.869
235 HE3 LYS 28 HE2 LYS 28 -16.529 -1.616 7.320
236 HZ1 LYS 28 HZ1 LYS 28 -15.395 -0.966 9.318
237 HZ2 LYS 28 HZ2 LYS 28 -14.918 0.503 8.635
238 HZ3 LYS 28 HZ3 LYS 28 -14.295 -0.948 8.034
239 H LYS 29 H LYS 29 -16.580 4.495 3.348
240 HA LYS 29 HA LYS 29 -18.840 4.963 5.016
241 HB2 LYS 29 HB3 LYS 29 -17.515 6.659 2.899
242 HB3 LYS 29 HB2 LYS 29 -18.807 7.212 3.949
243 HG2 LYS 29 HG3 LYS 29 -16.117 6.245 4.885
244 HG3 LYS 29 HG2 LYS 29 -16.592 7.936 4.715
245 HD2 LYS 29 HD3 LYS 29 -18.396 7.571 6.348
246 HD3 LYS 29 HD2 LYS 29 -17.867 5.899 6.541
247 HE2 LYS 29 HE3 LYS 29 -15.703 6.671 7.352
248 HE3 LYS 29 HE2 LYS 29 -16.208 8.346 7.133
249 HZ1 LYS 29 HZ1 LYS 29 -16.443 7.683 9.425
250 HZ2 LYS 29 HZ2 LYS 29 -17.432 6.383 8.993
251 HZ3 LYS 29 HZ3 LYS 29 -17.970 7.967 8.761
252 H LEU 30 H LEU 30 -18.349 4.380 1.586
253 HA LEU 30 HA LEU 30 -20.999 5.004 0.779
254 HB2 LEU 30 HB3 LEU 30 -18.688 3.588 -0.439
255 HB3 LEU 30 HB2 LEU 30 -20.270 3.285 -1.126
256 HG LEU 30 HG LEU 30 -20.544 5.698 -1.553
257 HD11 LEU 30 HD11 LEU 30 -17.706 5.924 -0.565
258 HD12 LEU 30 HD12 LEU 30 -19.139 6.565 0.240
259 HD13 LEU 30 HD13 LEU 30 -18.646 7.208 -1.327
260 HD21 LEU 30 HD21 LEU 30 -18.023 4.485 -2.668
261 HD22 LEU 30 HD22 LEU 30 -18.877 5.869 -3.349
262 HD23 LEU 30 HD23 LEU 30 -19.655 4.288 -3.304
263 H VAL 31 H VAL 31 -19.444 2.126 2.026
264 HA VAL 31 HA VAL 31 -21.763 0.459 1.622
265 HB VAL 31 HB VAL 31 -19.352 -0.066 3.388
266 HG11 VAL 31 HG11 VAL 31 -21.300 -1.447 3.935
267 HG12 VAL 31 HG12 VAL 31 -20.003 -2.405 3.224
268 HG13 VAL 31 HG13 VAL 31 -21.405 -1.962 2.252
269 HG21 VAL 31 HG21 VAL 31 -18.689 0.288 1.069
270 HG22 VAL 31 HG22 VAL 31 -19.868 -0.914 0.542
271 HG23 VAL 31 HG23 VAL 31 -18.496 -1.401 1.539
272 H GLY 32 H GLY 32 -20.529 2.570 4.092
273 HA2 GLY 32 HA3 GLY 32 -22.189 1.508 6.199
274 HA3 GLY 32 HA2 GLY 32 -21.194 2.955 6.277
275 H GLU 33 H GLU 33 -22.098 4.576 4.406
276 HA GLU 33 HA GLU 33 -23.680 6.116 3.920
277 HB2 GLU 33 HB3 GLU 33 -24.688 4.135 2.779
278 HB3 GLU 33 HB2 GLU 33 -25.638 3.834 4.225
279 HG2 GLU 33 HG3 GLU 33 -26.971 4.960 2.563
280 HG3 GLU 33 HG2 GLU 33 -26.728 6.007 3.959
281 H1 GLY 1 H1 GLY 1 24.767 0.606 3.827
282 H2 GLY 1 H2 GLY 1 26.213 0.029 4.478
283 H3 GLY 1 H3 GLY 1 24.887 0.309 5.487
284 HA2 GLY 1 HA2 GLY 1 25.056 -1.751 3.360
285 HA3 GLY 1 HA3 GLY 1 25.142 -2.048 5.091
286 H SER 2 H SER 2 23.341 -3.325 5.237
287 HA SER 2 HA SER 2 21.140 -3.718 5.750
288 HB2 SER 2 HB3 SER 2 20.734 -0.759 5.228
289 HB3 SER 2 HB2 SER 2 19.572 -1.844 5.992
290 HG SER 2 HG SER 2 20.778 -1.925 7.775
291 H MET 3 H MET 3 22.320 -3.783 3.056
292 HA MET 3 HA MET 3 20.458 -2.961 1.109
293 HB2 MET 3 HB3 MET 3 22.618 -5.056 1.119
294 HB3 MET 3 HB2 MET 3 21.646 -4.719 -0.310
295 HG2 MET 3 HG3 MET 3 23.487 -2.826 1.131
296 HG3 MET 3 HG2 MET 3 23.727 -3.542 -0.460
297 HE1 MET 3 HE1 MET 3 20.864 -1.796 -2.529
298 HE2 MET 3 HE2 MET 3 20.674 -3.290 -1.611
299 HE3 MET 3 HE3 MET 3 22.140 -3.013 -2.550
300 H LYS 4 H LYS 4 20.781 -5.858 3.032
301 HA LYS 4 HA LYS 4 18.802 -7.386 1.664
302 HB2 LYS 4 HB3 LYS 4 19.895 -7.592 4.475
303 HB3 LYS 4 HB2 LYS 4 18.770 -8.746 3.780
304 HG2 LYS 4 HG3 LYS 4 20.384 -9.405 2.124
305 HG3 LYS 4 HG2 LYS 4 21.505 -8.153 2.662
306 HD2 LYS 4 HD3 LYS 4 21.582 -9.233 4.883
307 HD3 LYS 4 HD2 LYS 4 20.551 -10.523 4.261
308 HE2 LYS 4 HE3 LYS 4 22.240 -11.127 2.639
309 HE3 LYS 4 HE2 LYS 4 23.251 -9.780 3.152
310 HZ1 LYS 4 HZ1 LYS 4 23.468 -10.800 5.320
311 HZ2 LYS 4 HZ2 LYS 4 23.975 -11.877 4.119
312 HZ3 LYS 4 HZ3 LYS 4 22.467 -12.080 4.856
313 H GLN 5 H GLN 5 18.786 -5.079 4.286
314 HA GLN 5 HA GLN 5 16.097 -5.598 5.097
315 HB2 GLN 5 HB3 GLN 5 17.889 -3.230 5.664
316 HB3 GLN 5 HB2 GLN 5 16.361 -3.564 6.468
317 HG2 GLN 5 HG3 GLN 5 17.283 -5.659 7.339
318 HG3 GLN 5 HG2 GLN 5 18.818 -5.301 6.549
319 HE21 GLN 5 HE21 GLN 5 18.185 -5.693 9.373
320 HE22 GLN 5 HE22 GLN 5 18.722 -4.264 10.183
321 H LEU 6 H LEU 6 17.676 -3.118 3.110
322 HA LEU 6 HA LEU 6 15.401 -1.534 2.659
323 HB2 LEU 6 HB3 LEU 6 18.058 -1.832 1.393
324 HB3 LEU 6 HB2 LEU 6 16.814 -1.090 0.409
325 HG LEU 6 HG LEU 6 18.185 0.582 1.560
326 HD11 LEU 6 HD11 LEU 6 15.855 1.087 1.024
327 HD12 LEU 6 HD12 LEU 6 16.385 1.914 2.489
328 HD13 LEU 6 HD13 LEU 6 15.363 0.483 2.606
329 HD21 LEU 6 HD21 LEU 6 18.768 -0.703 3.551
330 HD22 LEU 6 HD22 LEU 6 17.094 -0.624 4.099
331 HD23 LEU 6 HD23 LEU 6 18.054 0.851 3.982
332 H GLU 7 H GLU 7 16.703 -4.271 0.799
333 HA GLU 7 HA GLU 7 14.792 -4.051 -1.290
334 HB2 GLU 7 HB3 GLU 7 15.560 -6.217 -2.033
335 HB3 GLU 7 HB2 GLU 7 16.943 -5.251 -1.547
336 HG2 GLU 7 HG3 GLU 7 17.030 -6.452 0.582
337 HG3 GLU 7 HG2 GLU 7 15.647 -7.425 0.083
338 H ASP 8 H ASP 8 14.741 -5.510 1.853
339 HA ASP 8 HA ASP 8 12.412 -7.114 1.334
340 HB2 ASP 8 HB3 ASP 8 14.117 -6.551 3.697
341 HB3 ASP 8 HB2 ASP 8 12.451 -7.027 4.012
342 H LYS 9 H LYS 9 13.072 -3.896 2.514
343 HA LYS 9 HA LYS 9 10.544 -3.389 3.664
344 HB2 LYS 9 HB3 LYS 9 12.586 -1.507 2.476
345 HB3 LYS 9 HB2 LYS 9 11.138 -0.970 3.318
346 HG2 LYS 9 HG3 LYS 9 11.897 -2.120 5.341
347 HG3 LYS 9 HG2 LYS 9 13.357 -2.628 4.491
348 HD2 LYS 9 HD3 LYS 9 13.969 -0.278 4.154
349 HD3 LYS 9 HD2 LYS 9 12.517 0.220 5.024
350 HE2 LYS 9 HE3 LYS 9 14.762 -1.442 6.162
351 HE3 LYS 9 HE2 LYS 9 14.523 0.281 6.444
352 HZ1 LYS 9 HZ1 LYS 9 13.671 -1.054 8.269
353 HZ2 LYS 9 HZ2 LYS 9 12.624 -1.869 7.219
354 HZ3 LYS 9 HZ3 LYS 9 12.415 -0.217 7.505
355 H VAL 10 H VAL 10 11.826 -2.750 0.408
356 HA VAL 10 HA VAL 10 9.458 -1.542 -0.545
357 HB VAL 10 HB VAL 10 11.608 -1.205 -1.665
358 HG11 VAL 10 HG11 VAL 10 12.540 -3.442 -1.427
359 HG12 VAL 10 HG12 VAL 10 12.574 -2.913 -3.109
360 HG13 VAL 10 HG13 VAL 10 11.353 -4.067 -2.572
361 HG21 VAL 10 HG21 VAL 10 9.524 -2.472 -3.435
362 HG22 VAL 10 HG22 VAL 10 10.833 -1.424 -3.981
363 HG23 VAL 10 HG23 VAL 10 9.578 -0.786 -2.918
364 H GLU 11 H GLU 11 10.548 -4.895 -0.450
365 HA GLU 11 HA GLU 11 8.354 -5.892 -2.013
366 HB2 GLU 11 HB3 GLU 11 10.321 -7.267 -0.179
367 HB3 GLU 11 HB2 GLU 11 9.089 -8.120 -1.094
368 HG2 GLU 11 HG3 GLU 11 11.289 -6.438 -2.273
369 HG3 GLU 11 HG2 GLU 11 11.266 -8.197 -2.192
370 H GLU 12 H GLU 12 9.014 -5.409 1.395
371 HA GLU 12 HA GLU 12 6.831 -6.731 2.508
372 HB2 GLU 12 HB3 GLU 12 8.653 -5.825 3.857
373 HB3 GLU 12 HB2 GLU 12 8.187 -4.187 3.420
374 HG2 GLU 12 HG3 GLU 12 6.107 -4.419 4.619
375 HG3 GLU 12 HG2 GLU 12 6.472 -6.104 4.979
376 H LEU 13 H LEU 13 7.043 -3.229 1.730
377 HA LEU 13 HA LEU 13 4.247 -2.902 2.069
378 HB2 LEU 13 HB3 LEU 13 6.309 -1.089 0.858
379 HB3 LEU 13 HB2 LEU 13 4.604 -0.686 0.862
380 HG LEU 13 HG LEU 13 4.765 -1.159 3.419
381 HD11 LEU 13 HD11 LEU 13 7.027 -2.036 3.418
382 HD12 LEU 13 HD12 LEU 13 6.930 -0.561 4.380
383 HD13 LEU 13 HD13 LEU 13 7.634 -0.514 2.764
384 HD21 LEU 13 HD21 LEU 13 5.361 1.206 3.800
385 HD22 LEU 13 HD22 LEU 13 4.187 0.989 2.502
386 HD23 LEU 13 HD23 LEU 13 5.879 1.321 2.118
387 H LEU 14 H LEU 14 6.145 -3.824 -0.709
388 HA LEU 14 HA LEU 14 4.208 -3.461 -2.691
389 HB2 LEU 14 HB3 LEU 14 6.539 -4.075 -3.143
390 HB3 LEU 14 HB2 LEU 14 6.304 -5.628 -2.386
391 HG LEU 14 HG LEU 14 6.405 -5.610 -4.889
392 HD11 LEU 14 HD11 LEU 14 5.518 -7.502 -3.667
393 HD12 LEU 14 HD12 LEU 14 4.647 -7.257 -5.181
394 HD13 LEU 14 HD13 LEU 14 3.919 -6.757 -3.654
395 HD21 LEU 14 HD21 LEU 14 5.083 -3.591 -5.278
396 HD22 LEU 14 HD22 LEU 14 3.652 -4.414 -4.657
397 HD23 LEU 14 HD23 LEU 14 4.423 -4.981 -6.137
398 H SER 15 H SER 15 4.740 -6.072 -0.384
399 HA SER 15 HA SER 15 2.465 -7.600 -1.173
400 HB2 SER 15 HB3 SER 15 3.932 -7.620 1.479
401 HB3 SER 15 HB2 SER 15 2.888 -8.892 0.845
402 HG SER 15 HG SER 15 5.403 -8.038 -0.174
403 H LYS 16 H LYS 16 3.096 -5.039 1.138
404 HA LYS 16 HA LYS 16 0.721 -5.143 2.612
405 HB2 LYS 16 HB3 LYS 16 2.735 -3.825 3.209
406 HB3 LYS 16 HB2 LYS 16 2.364 -2.716 1.899
407 HG2 LYS 16 HG3 LYS 16 0.276 -2.101 3.001
408 HG3 LYS 16 HG2 LYS 16 0.647 -3.218 4.318
409 HD2 LYS 16 HD3 LYS 16 2.708 -1.947 4.781
410 HD3 LYS 16 HD2 LYS 16 2.275 -0.809 3.505
411 HE2 LYS 16 HE3 LYS 16 1.677 0.074 5.689
412 HE3 LYS 16 HE2 LYS 16 0.237 -0.224 4.717
413 HZ1 LYS 16 HZ1 LYS 16 -0.169 -2.234 5.934
414 HZ2 LYS 16 HZ2 LYS 16 0.012 -0.966 7.033
415 HZ3 LYS 16 HZ3 LYS 16 1.273 -2.070 6.799
416 H ASN 17 H ASN 17 1.517 -3.063 -0.208
417 HA ASN 17 HA ASN 17 -1.108 -1.990 -0.354
418 HB2 ASN 17 HB3 ASN 17 -0.435 -0.876 -2.338
419 HB3 ASN 17 HB2 ASN 17 0.989 -0.918 -1.308
420 HD21 ASN 17 HD21 ASN 17 -0.485 -2.111 -4.209
421 HD22 ASN 17 HD22 ASN 17 0.937 -2.816 -4.885
422 H TYR 18 H TYR 18 0.329 -4.891 -1.554
423 HA TYR 18 HA TYR 18 -1.527 -5.488 -3.591
424 HB2 TYR 18 HB3 TYR 18 0.536 -6.746 -3.418
425 HB3 TYR 18 HB2 TYR 18 0.100 -7.317 -1.811
426 HD1 TYR 18 HD1 TYR 18 -0.918 -9.386 -1.584
427 HD2 TYR 18 HD2 TYR 18 -1.125 -7.389 -5.337
428 HE1 TYR 18 HE1 TYR 18 -2.014 -11.355 -2.566
429 HE2 TYR 18 HE2 TYR 18 -2.219 -9.354 -6.330
430 HH TYR 18 HH TYR 18 -2.448 -11.735 -5.937
431 H HIS 19 H HIS 19 -1.434 -6.458 -0.165
432 HA HIS 19 HA HIS 19 -3.958 -7.763 -0.225
433 HB2 HIS 19 HB3 HIS 19 -2.211 -6.758 2.010
434 HB3 HIS 19 HB2 HIS 19 -3.799 -7.445 2.331
435 HD1 HIS 19 HD1 HIS 19 -3.849 -9.889 2.673
436 HD2 HIS 19 HD2 HIS 19 -0.476 -8.685 0.565
437 HE1 HIS 19 HE1 HIS 19 -2.458 -11.962 2.377
438 HE2 HIS 19 HE2 HIS 19 -0.363 -11.183 1.223
439 H LEU 20 H LEU 20 -2.923 -4.493 0.416
440 HA LEU 20 HA LEU 20 -5.364 -3.578 1.518
441 HB2 LEU 20 HB3 LEU 20 -3.164 -2.534 1.895
442 HB3 LEU 20 HB2 LEU 20 -3.105 -2.069 0.207
443 HG LEU 20 HG LEU 20 -5.053 -0.630 0.543
444 HD11 LEU 20 HD11 LEU 20 -5.813 -0.130 2.826
445 HD12 LEU 20 HD12 LEU 20 -4.776 -1.418 3.438
446 HD13 LEU 20 HD13 LEU 20 -6.129 -1.805 2.375
447 HD21 LEU 20 HD21 LEU 20 -3.905 1.090 1.840
448 HD22 LEU 20 HD22 LEU 20 -2.790 0.266 0.752
449 HD23 LEU 20 HD23 LEU 20 -2.794 -0.124 2.471
450 H GLU 21 H GLU 21 -4.026 -3.736 -1.744
451 HA GLU 21 HA GLU 21 -6.075 -2.250 -3.020
452 HB2 GLU 21 HB3 GLU 21 -3.888 -2.814 -4.074
453 HB3 GLU 21 HB2 GLU 21 -4.403 -4.491 -4.176
454 HG2 GLU 21 HG3 GLU 21 -6.265 -3.815 -5.624
455 HG3 GLU 21 HG2 GLU 21 -5.700 -2.148 -5.547
456 H ASN 22 H ASN 22 -5.697 -5.646 -2.200
457 HA ASN 22 HA ASN 22 -8.072 -6.560 -3.432
458 HB2 ASN 22 HB3 ASN 22 -6.261 -7.650 -1.314
459 HB3 ASN 22 HB2 ASN 22 -7.810 -8.430 -1.617
460 HD21 ASN 22 HD21 ASN 22 -4.670 -7.668 -2.935
461 HD22 ASN 22 HD22 ASN 22 -4.746 -8.783 -4.256
462 H GLU 23 H GLU 23 -7.458 -4.762 -0.612
463 HA GLU 23 HA GLU 23 -9.817 -5.466 0.848
464 HB2 GLU 23 HB3 GLU 23 -7.806 -4.649 1.989
465 HB3 GLU 23 HB2 GLU 23 -7.928 -3.109 1.116
466 HG2 GLU 23 HG3 GLU 23 -8.722 -2.795 3.341
467 HG3 GLU 23 HG2 GLU 23 -10.097 -2.714 2.244
468 H VAL 24 H VAL 24 -8.859 -2.855 -1.338
469 HA VAL 24 HA VAL 24 -11.244 -1.334 -1.070
470 HB VAL 24 HB VAL 24 -9.530 -1.430 -3.556
471 HG11 VAL 24 HG11 VAL 24 -11.680 -0.243 -3.716
472 HG12 VAL 24 HG12 VAL 24 -10.301 0.836 -3.901
473 HG13 VAL 24 HG13 VAL 24 -11.190 0.802 -2.378
474 HG21 VAL 24 HG21 VAL 24 -8.156 0.329 -2.646
475 HG22 VAL 24 HG22 VAL 24 -8.102 -1.061 -1.563
476 HG23 VAL 24 HG23 VAL 24 -9.094 0.338 -1.155
477 H ALA 25 H ALA 25 -10.230 -3.947 -3.191
478 HA ALA 25 HA ALA 25 -12.279 -3.757 -5.086
479 HB1 ALA 25 HB1 ALA 25 -10.185 -5.063 -5.352
480 HB2 ALA 25 HB2 ALA 25 -11.645 -5.933 -5.821
481 HB3 ALA 25 HB3 ALA 25 -10.870 -6.285 -4.278
482 H ARG 26 H ARG 26 -12.152 -5.631 -2.049
483 HA ARG 26 HA ARG 26 -14.609 -6.922 -2.533
484 HB2 ARG 26 HB3 ARG 26 -14.590 -7.110 0.082
485 HB3 ARG 26 HB2 ARG 26 -13.527 -8.078 -0.914
486 HG2 ARG 26 HG3 ARG 26 -11.662 -6.673 -0.388
487 HG3 ARG 26 HG2 ARG 26 -12.705 -5.512 0.453
488 HD2 ARG 26 HD2 ARG 26 -12.994 -6.880 2.262
489 HD3 ARG 26 HD1 ARG 26 -12.807 -8.353 1.319
490 HE ARG 26 HE ARG 26 -10.316 -7.229 1.322
491 HH11 ARG 26 HH11 ARG 26 -12.609 -8.175 3.786
492 HH12 ARG 26 HH12 ARG 26 -11.392 -8.621 4.939
493 HH21 ARG 26 HH21 ARG 26 -8.696 -7.823 2.851
494 HH22 ARG 26 HH22 ARG 26 -9.172 -8.427 4.406
495 H LEU 27 H LEU 27 -13.831 -3.903 -0.812
496 HA LEU 27 HA LEU 27 -16.489 -3.400 0.007
497 HB2 LEU 27 HB3 LEU 27 -14.135 -1.600 -0.442
498 HB3 LEU 27 HB2 LEU 27 -15.718 -0.932 -0.138
499 HG LEU 27 HG LEU 27 -15.834 -2.087 2.007
500 HD11 LEU 27 HD11 LEU 27 -13.019 -2.971 1.416
501 HD12 LEU 27 HD12 LEU 27 -14.436 -4.015 1.516
502 HD13 LEU 27 HD13 LEU 27 -13.862 -3.168 2.952
503 HD21 LEU 27 HD21 LEU 27 -15.013 0.161 1.975
504 HD22 LEU 27 HD22 LEU 27 -13.382 -0.403 1.609
505 HD23 LEU 27 HD23 LEU 27 -14.114 -0.775 3.170
506 H LYS 28 H LYS 28 -14.769 -2.716 -2.984
507 HA LYS 28 HA LYS 28 -16.631 -1.102 -4.258
508 HB2 LYS 28 HB3 LYS 28 -14.346 -1.712 -5.100
509 HB3 LYS 28 HB2 LYS 28 -14.989 -3.278 -5.569
510 HG2 LYS 28 HG3 LYS 28 -14.875 -1.822 -7.486
511 HG3 LYS 28 HG2 LYS 28 -16.562 -2.157 -7.091
512 HD2 LYS 28 HD3 LYS 28 -16.749 -0.001 -5.979
513 HD3 LYS 28 HD2 LYS 28 -15.045 0.326 -6.292
514 HE2 LYS 28 HE3 LYS 28 -17.154 -0.093 -8.405
515 HE3 LYS 28 HE2 LYS 28 -16.553 1.475 -7.873
516 HZ1 LYS 28 HZ1 LYS 28 -15.442 0.807 -9.877
517 HZ2 LYS 28 HZ2 LYS 28 -14.965 -0.659 -9.190
518 HZ3 LYS 28 HZ3 LYS 28 -14.329 0.793 -8.606
519 H LYS 29 H LYS 29 -16.595 -4.611 -3.864
520 HA LYS 29 HA LYS 29 -18.860 -5.083 -5.522
521 HB2 LYS 29 HB3 LYS 29 -17.531 -6.769 -3.402
522 HB3 LYS 29 HB2 LYS 29 -18.829 -7.324 -4.444
523 HG2 LYS 29 HG3 LYS 29 -16.141 -6.366 -5.396
524 HG3 LYS 29 HG2 LYS 29 -16.622 -8.055 -5.217
525 HD2 LYS 29 HD3 LYS 29 -18.432 -7.690 -6.839
526 HD3 LYS 29 HD2 LYS 29 -17.896 -6.023 -7.047
527 HE2 LYS 29 HE3 LYS 29 -15.743 -6.809 -7.873
528 HE3 LYS 29 HE2 LYS 29 -16.248 -8.479 -7.626
529 HZ1 LYS 29 HZ1 LYS 29 -16.503 -7.850 -9.925
530 HZ2 LYS 29 HZ2 LYS 29 -17.485 -6.543 -9.502
531 HZ3 LYS 29 HZ3 LYS 29 -18.024 -8.122 -9.243
532 H LEU 30 H LEU 30 -18.356 -4.487 -2.096
533 HA LEU 30 HA LEU 30 -21.007 -5.094 -1.282
534 HB2 LEU 30 HB3 LEU 30 -18.688 -3.676 -0.080
535 HB3 LEU 30 HB2 LEU 30 -20.267 -3.367 0.612
536 HG LEU 30 HG LEU 30 -20.540 -5.775 1.056
537 HD11 LEU 30 HD11 LEU 30 -17.711 -6.009 0.054
538 HD12 LEU 30 HD12 LEU 30 -19.149 -6.651 -0.739
539 HD13 LEU 30 HD13 LEU 30 -18.648 -7.287 0.826
540 HD21 LEU 30 HD21 LEU 30 -18.012 -4.558 2.154
541 HD22 LEU 30 HD22 LEU 30 -18.864 -5.937 2.846
542 HD23 LEU 30 HD23 LEU 30 -19.642 -4.357 2.795
543 H VAL 31 H VAL 31 -19.448 -2.226 -2.553
544 HA VAL 31 HA VAL 31 -21.761 -0.554 -2.142
545 HB VAL 31 HB VAL 31 -19.358 -0.037 -3.921
546 HG11 VAL 31 HG11 VAL 31 -21.305 1.343 -4.463
547 HG12 VAL 31 HG12 VAL 31 -20.001 2.301 -3.763
548 HG13 VAL 31 HG13 VAL 31 -21.400 1.867 -2.781
549 HG21 VAL 31 HG21 VAL 31 -18.682 -0.384 -1.604
550 HG22 VAL 31 HG22 VAL 31 -19.855 0.823 -1.076
551 HG23 VAL 31 HG23 VAL 31 -18.487 1.303 -2.083
552 H GLY 32 H GLY 32 -20.540 -2.675 -4.608
553 HA2 GLY 32 HA3 GLY 32 -22.210 -1.623 -6.711
554 HA3 GLY 32 HA2 GLY 32 -21.224 -3.076 -6.784
555 H GLU 33 H GLU 33 -22.120 -4.679 -4.898
556 HA GLU 33 HA GLU 33 -23.700 -6.216 -4.400
557 HB2 GLU 33 HB3 GLU 33 -24.701 -4.226 -3.270
558 HB3 GLU 33 HB2 GLU 33 -25.652 -3.927 -4.716
559 HG2 GLU 33 HG3 GLU 33 -26.986 -5.035 -3.040
560 HG3 GLU 33 HG2 GLU 33 -26.757 -6.093 -4.431
Start of MODEL 3
1 H1 GLY 1 H1 GLY 1 24.780 1.771 -2.663
2 H2 GLY 1 H2 GLY 1 24.200 2.970 -1.623
3 H3 GLY 1 H3 GLY 1 25.860 2.826 -1.902
4 HA2 GLY 1 HA2 GLY 1 24.982 4.690 -3.131
5 HA3 GLY 1 HA3 GLY 1 25.558 3.434 -4.215
6 H SER 2 H SER 2 23.815 5.315 -5.127
7 HA SER 2 HA SER 2 21.871 5.557 -6.317
8 HB2 SER 2 HB3 SER 2 22.534 3.276 -7.158
9 HB3 SER 2 HB2 SER 2 21.512 2.573 -5.905
10 HG SER 2 HG SER 2 20.580 4.398 -7.876
11 H MET 3 H MET 3 21.874 6.039 -3.551
12 HA MET 3 HA MET 3 19.622 4.831 -2.289
13 HB2 MET 3 HB3 MET 3 21.618 6.875 -1.587
14 HB3 MET 3 HB2 MET 3 20.050 7.065 -0.811
15 HG2 MET 3 HG3 MET 3 21.541 5.788 0.593
16 HG3 MET 3 HG2 MET 3 20.196 4.788 0.051
17 HE1 MET 3 HE1 MET 3 22.708 3.486 1.368
18 HE2 MET 3 HE2 MET 3 23.029 2.147 0.268
19 HE3 MET 3 HE3 MET 3 21.368 2.552 0.703
20 H LYS 4 H LYS 4 20.050 7.575 -4.350
21 HA LYS 4 HA LYS 4 17.641 8.926 -3.704
22 HB2 LYS 4 HB3 LYS 4 19.301 8.873 -6.226
23 HB3 LYS 4 HB2 LYS 4 17.867 9.870 -6.051
24 HG2 LYS 4 HG3 LYS 4 20.277 10.047 -4.255
25 HG3 LYS 4 HG2 LYS 4 19.998 11.074 -5.660
26 HD2 LYS 4 HD3 LYS 4 17.890 11.851 -4.636
27 HD3 LYS 4 HD2 LYS 4 18.244 10.870 -3.213
28 HE2 LYS 4 HE3 LYS 4 19.948 13.126 -4.266
29 HE3 LYS 4 HE2 LYS 4 18.865 13.220 -2.878
30 HZ1 LYS 4 HZ1 LYS 4 21.137 12.869 -2.181
31 HZ2 LYS 4 HZ2 LYS 4 21.246 11.463 -3.111
32 HZ3 LYS 4 HZ3 LYS 4 20.198 11.521 -1.786
33 H GLN 5 H GLN 5 18.463 6.435 -6.069
34 HA GLN 5 HA GLN 5 15.802 6.197 -7.084
35 HB2 GLN 5 HB3 GLN 5 18.164 4.317 -7.263
36 HB3 GLN 5 HB2 GLN 5 16.647 4.081 -8.110
37 HG2 GLN 5 HG3 GLN 5 18.100 4.976 -9.698
38 HG3 GLN 5 HG2 GLN 5 17.079 6.324 -9.211
39 HE21 GLN 5 HE21 GLN 5 17.991 8.075 -8.216
40 HE22 GLN 5 HE22 GLN 5 19.698 8.275 -8.017
41 H LEU 6 H LEU 6 17.699 4.682 -4.582
42 HA LEU 6 HA LEU 6 16.020 2.473 -4.078
43 HB2 LEU 6 HB3 LEU 6 18.375 2.633 -3.357
44 HB3 LEU 6 HB2 LEU 6 17.932 3.876 -2.209
45 HG LEU 6 HG LEU 6 16.475 2.212 -1.052
46 HD11 LEU 6 HD11 LEU 6 16.782 -0.151 -1.538
47 HD12 LEU 6 HD12 LEU 6 17.845 0.249 -2.887
48 HD13 LEU 6 HD13 LEU 6 16.139 0.693 -2.947
49 HD21 LEU 6 HD21 LEU 6 19.399 1.520 -1.312
50 HD22 LEU 6 HD22 LEU 6 18.340 1.022 0.006
51 HD23 LEU 6 HD23 LEU 6 18.704 2.731 -0.234
52 H GLU 7 H GLU 7 16.145 5.742 -2.664
53 HA GLU 7 HA GLU 7 14.152 5.196 -0.709
54 HB2 GLU 7 HB3 GLU 7 14.085 7.585 -0.318
55 HB3 GLU 7 HB2 GLU 7 15.755 7.066 -0.490
56 HG2 GLU 7 HG3 GLU 7 15.792 7.908 -2.773
57 HG3 GLU 7 HG2 GLU 7 14.107 8.403 -2.626
58 H ASP 8 H ASP 8 14.080 6.175 -4.048
59 HA ASP 8 HA ASP 8 11.369 7.017 -4.114
60 HB2 ASP 8 HB3 ASP 8 13.415 6.316 -6.150
61 HB3 ASP 8 HB2 ASP 8 11.730 6.242 -6.653
62 H LYS 9 H LYS 9 12.896 3.914 -4.114
63 HA LYS 9 HA LYS 9 10.713 2.404 -5.138
64 HB2 LYS 9 HB3 LYS 9 12.906 1.576 -3.223
65 HB3 LYS 9 HB2 LYS 9 11.805 0.475 -4.034
66 HG2 LYS 9 HG3 LYS 9 13.794 2.267 -5.409
67 HG3 LYS 9 HG2 LYS 9 14.021 0.550 -5.078
68 HD2 LYS 9 HD3 LYS 9 13.152 0.233 -7.119
69 HD3 LYS 9 HD2 LYS 9 11.600 0.585 -6.357
70 HE2 LYS 9 HE3 LYS 9 11.886 1.910 -8.375
71 HE3 LYS 9 HE2 LYS 9 11.851 2.948 -6.951
72 HZ1 LYS 9 HZ1 LYS 9 14.324 2.040 -8.316
73 HZ2 LYS 9 HZ2 LYS 9 14.231 3.136 -7.031
74 HZ3 LYS 9 HZ3 LYS 9 13.602 3.551 -8.545
75 H VAL 10 H VAL 10 11.888 2.909 -1.834
76 HA VAL 10 HA VAL 10 9.737 1.604 -0.563
77 HB VAL 10 HB VAL 10 11.631 3.665 0.579
78 HG11 VAL 10 HG11 VAL 10 9.954 1.575 1.962
79 HG12 VAL 10 HG12 VAL 10 9.678 3.317 1.996
80 HG13 VAL 10 HG13 VAL 10 11.126 2.638 2.741
81 HG21 VAL 10 HG21 VAL 10 12.829 1.802 -0.421
82 HG22 VAL 10 HG22 VAL 10 11.841 0.658 0.486
83 HG23 VAL 10 HG23 VAL 10 12.945 1.738 1.338
84 H GLU 11 H GLU 11 10.431 5.053 -1.085
85 HA GLU 11 HA GLU 11 8.226 6.038 0.361
86 HB2 GLU 11 HB3 GLU 11 10.257 7.340 -0.395
87 HB3 GLU 11 HB2 GLU 11 9.541 7.387 -1.999
88 HG2 GLU 11 HG3 GLU 11 9.089 9.450 -0.871
89 HG3 GLU 11 HG2 GLU 11 7.583 8.553 -1.055
90 H GLU 12 H GLU 12 8.578 5.009 -2.991
91 HA GLU 12 HA GLU 12 6.130 6.014 -3.942
92 HB2 GLU 12 HB3 GLU 12 7.937 5.132 -5.399
93 HB3 GLU 12 HB2 GLU 12 7.525 3.504 -4.873
94 HG2 GLU 12 HG3 GLU 12 5.320 3.709 -5.842
95 HG3 GLU 12 HG2 GLU 12 5.651 5.380 -6.296
96 H LEU 13 H LEU 13 6.866 2.678 -2.851
97 HA LEU 13 HA LEU 13 4.186 1.833 -2.913
98 HB2 LEU 13 HB3 LEU 13 6.499 0.757 -1.310
99 HB3 LEU 13 HB2 LEU 13 4.963 -0.065 -1.549
100 HG LEU 13 HG LEU 13 6.213 0.815 -4.028
101 HD11 LEU 13 HD11 LEU 13 7.910 -0.982 -4.033
102 HD12 LEU 13 HD12 LEU 13 7.558 -1.301 -2.333
103 HD13 LEU 13 HD13 LEU 13 8.251 0.247 -2.816
104 HD21 LEU 13 HD21 LEU 13 5.548 -1.377 -4.768
105 HD22 LEU 13 HD22 LEU 13 4.230 -0.656 -3.842
106 HD23 LEU 13 HD23 LEU 13 5.256 -1.885 -3.109
107 H LEU 14 H LEU 14 6.097 3.280 -0.324
108 HA LEU 14 HA LEU 14 4.253 3.120 1.744
109 HB2 LEU 14 HB3 LEU 14 6.554 3.938 1.977
110 HB3 LEU 14 HB2 LEU 14 6.171 5.352 1.030
111 HG LEU 14 HG LEU 14 6.380 5.683 3.509
112 HD11 LEU 14 HD11 LEU 14 3.778 6.490 2.244
113 HD12 LEU 14 HD12 LEU 14 5.321 7.335 2.102
114 HD13 LEU 14 HD13 LEU 14 4.512 7.232 3.667
115 HD21 LEU 14 HD21 LEU 14 3.700 4.315 3.580
116 HD22 LEU 14 HD22 LEU 14 4.518 5.094 4.933
117 HD23 LEU 14 HD23 LEU 14 5.206 3.643 4.205
118 H SER 15 H SER 15 4.488 5.384 -0.940
119 HA SER 15 HA SER 15 2.166 6.872 -0.248
120 HB2 SER 15 HB3 SER 15 3.438 6.554 -2.975
121 HB3 SER 15 HB2 SER 15 2.345 7.840 -2.467
122 HG SER 15 HG SER 15 4.952 7.319 -1.448
123 H LYS 16 H LYS 16 2.785 4.028 -2.319
124 HA LYS 16 HA LYS 16 0.260 3.925 -3.528
125 HB2 LYS 16 HB3 LYS 16 2.189 1.708 -2.853
126 HB3 LYS 16 HB2 LYS 16 0.744 1.478 -3.828
127 HG2 LYS 16 HG3 LYS 16 1.580 3.065 -5.475
128 HG3 LYS 16 HG2 LYS 16 3.017 3.343 -4.493
129 HD2 LYS 16 HD3 LYS 16 3.511 1.803 -6.307
130 HD3 LYS 16 HD2 LYS 16 3.636 0.981 -4.753
131 HE2 LYS 16 HE3 LYS 16 2.505 -0.436 -6.360
132 HE3 LYS 16 HE2 LYS 16 1.391 0.041 -5.084
133 HZ1 LYS 16 HZ1 LYS 16 1.549 1.235 -7.798
134 HZ2 LYS 16 HZ2 LYS 16 0.506 1.745 -6.571
135 HZ3 LYS 16 HZ3 LYS 16 0.339 0.199 -7.229
136 H ASN 17 H ASN 17 1.357 2.243 -0.547
137 HA ASN 17 HA ASN 17 -1.208 1.100 -0.088
138 HB2 ASN 17 HB3 ASN 17 -0.397 0.359 2.031
139 HB3 ASN 17 HB2 ASN 17 0.935 0.214 0.895
140 HD21 ASN 17 HD21 ASN 17 -0.320 1.950 3.646
141 HD22 ASN 17 HD22 ASN 17 1.166 2.722 4.075
142 H TYR 18 H TYR 18 0.241 4.147 0.729
143 HA TYR 18 HA TYR 18 -1.600 4.960 2.715
144 HB2 TYR 18 HB3 TYR 18 0.573 6.078 2.323
145 HB3 TYR 18 HB2 TYR 18 -0.009 6.651 0.767
146 HD1 TYR 18 HD1 TYR 18 -0.451 6.958 4.423
147 HD2 TYR 18 HD2 TYR 18 -1.357 8.602 0.608
148 HE1 TYR 18 HE1 TYR 18 -1.301 8.992 5.508
149 HE2 TYR 18 HE2 TYR 18 -2.213 10.639 1.683
150 HH TYR 18 HH TYR 18 -3.165 11.278 3.917
151 H HIS 19 H HIS 19 -1.490 5.397 -0.793
152 HA HIS 19 HA HIS 19 -3.872 6.908 -0.995
153 HB2 HIS 19 HB3 HIS 19 -2.202 5.355 -2.937
154 HB3 HIS 19 HB2 HIS 19 -3.787 5.937 -3.431
155 HD1 HIS 19 HD1 HIS 19 -3.917 8.296 -4.212
156 HD2 HIS 19 HD2 HIS 19 -0.414 7.522 -2.116
157 HE1 HIS 19 HE1 HIS 19 -2.525 10.376 -4.429
158 HE2 HIS 19 HE2 HIS 19 -0.360 9.835 -3.262
159 H LEU 20 H LEU 20 -3.212 3.440 -1.372
160 HA LEU 20 HA LEU 20 -5.887 2.760 -1.987
161 HB2 LEU 20 HB3 LEU 20 -3.462 1.228 -1.187
162 HB3 LEU 20 HB2 LEU 20 -5.019 0.433 -1.079
163 HG LEU 20 HG LEU 20 -3.884 -0.081 -3.188
164 HD11 LEU 20 HD11 LEU 20 -6.321 1.646 -3.581
165 HD12 LEU 20 HD12 LEU 20 -6.328 -0.050 -3.105
166 HD13 LEU 20 HD13 LEU 20 -5.719 0.417 -4.693
167 HD21 LEU 20 HD21 LEU 20 -4.109 2.872 -3.729
168 HD22 LEU 20 HD22 LEU 20 -3.624 1.646 -4.899
169 HD23 LEU 20 HD23 LEU 20 -2.616 1.964 -3.486
170 H GLU 21 H GLU 21 -4.125 3.007 1.064
171 HA GLU 21 HA GLU 21 -6.062 1.865 2.740
172 HB2 GLU 21 HB3 GLU 21 -3.688 2.634 3.327
173 HB3 GLU 21 HB2 GLU 21 -4.366 4.247 3.487
174 HG2 GLU 21 HG3 GLU 21 -5.365 1.881 5.042
175 HG3 GLU 21 HG2 GLU 21 -4.081 2.937 5.616
176 H ASN 22 H ASN 22 -5.612 5.217 1.697
177 HA ASN 22 HA ASN 22 -7.890 6.246 3.010
178 HB2 ASN 22 HB3 ASN 22 -6.141 7.236 0.790
179 HB3 ASN 22 HB2 ASN 22 -7.633 8.088 1.171
180 HD21 ASN 22 HD21 ASN 22 -4.463 7.204 2.301
181 HD22 ASN 22 HD22 ASN 22 -4.417 8.310 3.634
182 H GLU 23 H GLU 23 -7.494 4.493 0.072
183 HA GLU 23 HA GLU 23 -10.027 5.313 -1.034
184 HB2 GLU 23 HB3 GLU 23 -8.024 4.699 -2.427
185 HB3 GLU 23 HB2 GLU 23 -8.265 3.015 -1.914
186 HG2 GLU 23 HG3 GLU 23 -10.365 2.904 -3.020
187 HG3 GLU 23 HG2 GLU 23 -10.365 4.640 -3.333
188 H VAL 24 H VAL 24 -8.734 2.587 0.787
189 HA VAL 24 HA VAL 24 -11.037 0.963 0.708
190 HB VAL 24 HB VAL 24 -8.956 1.208 2.905
191 HG11 VAL 24 HG11 VAL 24 -11.086 0.273 3.733
192 HG12 VAL 24 HG12 VAL 24 -9.779 -0.911 3.743
193 HG13 VAL 24 HG13 VAL 24 -11.010 -0.967 2.477
194 HG21 VAL 24 HG21 VAL 24 -8.012 0.446 0.814
195 HG22 VAL 24 HG22 VAL 24 -9.276 -0.773 0.659
196 HG23 VAL 24 HG23 VAL 24 -8.093 -0.892 1.961
197 H ALA 25 H ALA 25 -10.021 3.567 2.857
198 HA ALA 25 HA ALA 25 -12.059 3.337 4.758
199 HB1 ALA 25 HB1 ALA 25 -10.007 4.679 5.050
200 HB2 ALA 25 HB2 ALA 25 -11.477 5.564 5.456
201 HB3 ALA 25 HB3 ALA 25 -10.661 5.869 3.924
202 H ARG 26 H ARG 26 -11.953 5.157 1.718
203 HA ARG 26 HA ARG 26 -14.310 6.620 2.154
204 HB2 ARG 26 HB3 ARG 26 -14.148 7.333 -0.054
205 HB3 ARG 26 HB2 ARG 26 -12.498 6.945 0.369
206 HG2 ARG 26 HG3 ARG 26 -12.632 4.852 -0.851
207 HG3 ARG 26 HG2 ARG 26 -14.324 5.188 -1.241
208 HD2 ARG 26 HD2 ARG 26 -12.663 5.736 -3.050
209 HD3 ARG 26 HD1 ARG 26 -13.752 7.041 -2.586
210 HE ARG 26 HE ARG 26 -10.920 6.845 -1.775
211 HH11 ARG 26 HH11 ARG 26 -13.784 8.730 -2.478
212 HH12 ARG 26 HH12 ARG 26 -12.979 10.255 -2.305
213 HH21 ARG 26 HH21 ARG 26 -9.858 8.865 -1.545
214 HH22 ARG 26 HH22 ARG 26 -10.755 10.333 -1.773
215 H LEU 27 H LEU 27 -13.731 3.529 0.587
216 HA LEU 27 HA LEU 27 -16.459 3.057 -0.085
217 HB2 LEU 27 HB3 LEU 27 -14.196 1.102 0.263
218 HB3 LEU 27 HB2 LEU 27 -15.756 0.746 -0.441
219 HG LEU 27 HG LEU 27 -14.061 2.886 -1.619
220 HD11 LEU 27 HD11 LEU 27 -12.676 0.879 -1.400
221 HD12 LEU 27 HD12 LEU 27 -13.037 1.278 -3.080
222 HD13 LEU 27 HD13 LEU 27 -13.901 -0.034 -2.279
223 HD21 LEU 27 HD21 LEU 27 -16.365 2.724 -2.365
224 HD22 LEU 27 HD22 LEU 27 -16.146 1.006 -2.707
225 HD23 LEU 27 HD23 LEU 27 -15.273 2.213 -3.653
226 H LYS 28 H LYS 28 -14.443 2.112 2.660
227 HA LYS 28 HA LYS 28 -16.122 0.432 4.023
228 HB2 LYS 28 HB3 LYS 28 -13.856 1.020 4.769
229 HB3 LYS 28 HB2 LYS 28 -14.415 2.627 5.212
230 HG2 LYS 28 HG3 LYS 28 -14.217 1.256 7.178
231 HG3 LYS 28 HG2 LYS 28 -15.916 1.623 6.880
232 HD2 LYS 28 HD3 LYS 28 -16.177 -0.585 5.812
233 HD3 LYS 28 HD2 LYS 28 -14.494 -0.948 6.193
234 HE2 LYS 28 HE3 LYS 28 -14.986 -0.712 8.577
235 HE3 LYS 28 HE2 LYS 28 -16.667 -0.344 8.195
236 HZ1 LYS 28 HZ1 LYS 28 -15.263 -2.897 7.637
237 HZ2 LYS 28 HZ2 LYS 28 -16.852 -2.549 7.180
238 HZ3 LYS 28 HZ3 LYS 28 -16.445 -2.642 8.816
239 H LYS 29 H LYS 29 -16.221 3.989 4.038
240 HA LYS 29 HA LYS 29 -18.464 4.066 5.827
241 HB2 LYS 29 HB3 LYS 29 -16.809 6.060 4.412
242 HB3 LYS 29 HB2 LYS 29 -18.475 6.531 4.714
243 HG2 LYS 29 HG3 LYS 29 -17.066 7.328 6.493
244 HG3 LYS 29 HG2 LYS 29 -18.152 6.087 7.111
245 HD2 LYS 29 HD3 LYS 29 -16.069 5.604 8.075
246 HD3 LYS 29 HD2 LYS 29 -16.225 4.456 6.745
247 HE2 LYS 29 HE3 LYS 29 -13.985 5.402 6.806
248 HE3 LYS 29 HE2 LYS 29 -14.830 5.895 5.340
249 HZ1 LYS 29 HZ1 LYS 29 -14.554 7.564 7.781
250 HZ2 LYS 29 HZ2 LYS 29 -15.262 8.035 6.321
251 HZ3 LYS 29 HZ3 LYS 29 -13.604 7.722 6.390
252 H LEU 30 H LEU 30 -18.045 3.933 2.377
253 HA LEU 30 HA LEU 30 -20.676 4.794 1.695
254 HB2 LEU 30 HB3 LEU 30 -18.376 3.610 0.282
255 HB3 LEU 30 HB2 LEU 30 -19.943 3.265 -0.420
256 HG LEU 30 HG LEU 30 -20.394 5.614 -0.734
257 HD11 LEU 30 HD11 LEU 30 -18.743 7.337 -0.169
258 HD12 LEU 30 HD12 LEU 30 -17.758 6.116 0.639
259 HD13 LEU 30 HD13 LEU 30 -19.356 6.517 1.267
260 HD21 LEU 30 HD21 LEU 30 -17.606 4.900 -1.630
261 HD22 LEU 30 HD22 LEU 30 -18.601 6.192 -2.302
262 HD23 LEU 30 HD23 LEU 30 -19.107 4.512 -2.470
263 H VAL 31 H VAL 31 -19.214 1.658 2.373
264 HA VAL 31 HA VAL 31 -21.605 0.191 1.728
265 HB VAL 31 HB VAL 31 -19.258 -0.763 3.389
266 HG11 VAL 31 HG11 VAL 31 -21.293 -2.137 3.549
267 HG12 VAL 31 HG12 VAL 31 -19.972 -2.987 2.748
268 HG13 VAL 31 HG13 VAL 31 -21.293 -2.315 1.793
269 HG21 VAL 31 HG21 VAL 31 -19.677 -0.970 0.411
270 HG22 VAL 31 HG22 VAL 31 -18.376 -1.732 1.326
271 HG23 VAL 31 HG23 VAL 31 -18.470 0.026 1.222
272 H GLY 32 H GLY 32 -20.306 1.815 4.494
273 HA2 GLY 32 HA3 GLY 32 -22.037 0.469 6.385
274 HA3 GLY 32 HA2 GLY 32 -20.935 1.795 6.733
275 H GLU 33 H GLU 33 -21.695 3.808 5.195
276 HA GLU 33 HA GLU 33 -23.131 5.549 5.068
277 HB2 GLU 33 HB3 GLU 33 -24.491 3.972 3.723
278 HB3 GLU 33 HB2 GLU 33 -25.306 3.449 5.189
279 HG2 GLU 33 HG3 GLU 33 -26.690 5.009 3.985
280 HG3 GLU 33 HG2 GLU 33 -26.166 5.722 5.509
281 H1 GLY 1 H1 GLY 1 24.790 -1.931 2.012
282 H2 GLY 1 H2 GLY 1 24.201 -3.110 0.955
283 H3 GLY 1 H3 GLY 1 25.865 -2.976 1.230
284 HA2 GLY 1 HA2 GLY 1 24.985 -4.857 2.431
285 HA3 GLY 1 HA3 GLY 1 25.570 -3.619 3.533
286 H SER 2 H SER 2 23.828 -5.511 4.425
287 HA SER 2 HA SER 2 21.891 -5.766 5.624
288 HB2 SER 2 HB3 SER 2 22.554 -3.493 6.487
289 HB3 SER 2 HB2 SER 2 21.521 -2.779 5.255
290 HG SER 2 HG SER 2 20.599 -4.644 7.190
291 H MET 3 H MET 3 21.880 -6.216 2.850
292 HA MET 3 HA MET 3 19.620 -4.992 1.614
293 HB2 MET 3 HB3 MET 3 21.613 -7.028 0.874
294 HB3 MET 3 HB2 MET 3 20.043 -7.206 0.104
295 HG2 MET 3 HG3 MET 3 21.527 -5.910 -1.288
296 HG3 MET 3 HG2 MET 3 20.187 -4.915 -0.729
297 HE1 MET 3 HE1 MET 3 22.704 -3.600 -2.036
298 HE2 MET 3 HE2 MET 3 23.021 -2.275 -0.918
299 HE3 MET 3 HE3 MET 3 21.362 -2.678 -1.358
300 H LYS 4 H LYS 4 20.056 -7.756 3.644
301 HA LYS 4 HA LYS 4 17.647 -9.105 2.985
302 HB2 LYS 4 HB3 LYS 4 19.310 -9.081 5.505
303 HB3 LYS 4 HB2 LYS 4 17.877 -10.077 5.318
304 HG2 LYS 4 HG3 LYS 4 20.287 -10.229 3.525
305 HG3 LYS 4 HG2 LYS 4 20.006 -11.276 4.914
306 HD2 LYS 4 HD3 LYS 4 17.907 -12.044 3.876
307 HD3 LYS 4 HD2 LYS 4 18.252 -11.035 2.470
308 HE2 LYS 4 HE3 LYS 4 19.965 -13.301 3.481
309 HE3 LYS 4 HE2 LYS 4 18.884 -13.373 2.091
310 HZ1 LYS 4 HZ1 LYS 4 21.156 -13.004 1.395
311 HZ2 LYS 4 HZ2 LYS 4 21.268 -11.619 2.357
312 HZ3 LYS 4 HZ3 LYS 4 20.219 -11.645 1.032
313 H GLN 5 H GLN 5 18.478 -6.638 5.373
314 HA GLN 5 HA GLN 5 15.820 -6.420 6.402
315 HB2 GLN 5 HB3 GLN 5 18.179 -4.541 6.596
316 HB3 GLN 5 HB2 GLN 5 16.666 -4.314 7.451
317 HG2 GLN 5 HG3 GLN 5 18.130 -5.222 9.023
318 HG3 GLN 5 HG2 GLN 5 17.105 -6.568 8.529
319 HE21 GLN 5 HE21 GLN 5 18.011 -8.307 7.506
320 HE22 GLN 5 HE22 GLN 5 19.717 -8.497 7.288
321 H LEU 6 H LEU 6 17.711 -4.862 3.919
322 HA LEU 6 HA LEU 6 16.025 -2.654 3.442
323 HB2 LEU 6 HB3 LEU 6 18.378 -2.806 2.713
324 HB3 LEU 6 HB2 LEU 6 17.931 -4.035 1.552
325 HG LEU 6 HG LEU 6 16.472 -2.358 0.417
326 HD11 LEU 6 HD11 LEU 6 16.781 -0.002 0.927
327 HD12 LEU 6 HD12 LEU 6 17.849 -0.415 2.267
328 HD13 LEU 6 HD13 LEU 6 16.143 -0.859 2.329
329 HD21 LEU 6 HD21 LEU 6 19.396 -1.669 0.676
330 HD22 LEU 6 HD22 LEU 6 18.332 -1.158 -0.634
331 HD23 LEU 6 HD23 LEU 6 18.699 -2.868 -0.413
332 H GLU 7 H GLU 7 16.152 -5.906 1.985
333 HA GLU 7 HA GLU 7 14.152 -5.337 0.045
334 HB2 GLU 7 HB3 GLU 7 14.082 -7.721 -0.371
335 HB3 GLU 7 HB2 GLU 7 15.751 -7.205 -0.198
336 HG2 GLU 7 HG3 GLU 7 15.799 -8.072 2.071
337 HG3 GLU 7 HG2 GLU 7 14.111 -8.560 1.929
338 H ASP 8 H ASP 8 14.085 -6.349 3.371
339 HA ASP 8 HA ASP 8 11.377 -7.203 3.433
340 HB2 ASP 8 HB3 ASP 8 13.431 -6.529 5.471
341 HB3 ASP 8 HB2 ASP 8 11.748 -6.463 5.983
342 H LYS 9 H LYS 9 12.902 -4.098 3.473
343 HA LYS 9 HA LYS 9 10.720 -2.602 4.519
344 HB2 LYS 9 HB3 LYS 9 12.909 -1.749 2.610
345 HB3 LYS 9 HB2 LYS 9 11.810 -0.658 3.436
346 HG2 LYS 9 HG3 LYS 9 13.805 -2.464 4.784
347 HG3 LYS 9 HG2 LYS 9 14.029 -0.742 4.470
348 HD2 LYS 9 HD3 LYS 9 13.173 -0.448 6.521
349 HD3 LYS 9 HD2 LYS 9 11.616 -0.789 5.763
350 HE2 LYS 9 HE3 LYS 9 11.910 -2.143 7.760
351 HE3 LYS 9 HE2 LYS 9 11.872 -3.161 6.320
352 HZ1 LYS 9 HZ1 LYS 9 14.352 -2.265 7.680
353 HZ2 LYS 9 HZ2 LYS 9 14.246 -3.358 6.393
354 HZ3 LYS 9 HZ3 LYS 9 13.627 -3.774 7.909
355 H VAL 10 H VAL 10 11.888 -3.069 1.207
356 HA VAL 10 HA VAL 10 9.732 -1.749 -0.039
357 HB VAL 10 HB VAL 10 11.624 -3.791 -1.215
358 HG11 VAL 10 HG11 VAL 10 9.938 -1.688 -2.567
359 HG12 VAL 10 HG12 VAL 10 9.664 -3.431 -2.620
360 HG13 VAL 10 HG13 VAL 10 11.108 -2.741 -3.362
361 HG21 VAL 10 HG21 VAL 10 12.820 -1.942 -0.194
362 HG22 VAL 10 HG22 VAL 10 11.828 -0.787 -1.085
363 HG23 VAL 10 HG23 VAL 10 12.931 -1.855 -1.953
364 H GLU 11 H GLU 11 10.430 -5.203 0.440
365 HA GLU 11 HA GLU 11 8.223 -6.173 -1.011
366 HB2 GLU 11 HB3 GLU 11 10.257 -7.481 -0.274
367 HB3 GLU 11 HB2 GLU 11 9.545 -7.545 1.332
368 HG2 GLU 11 HG3 GLU 11 9.093 -9.596 0.183
369 HG3 GLU 11 HG2 GLU 11 7.587 -8.703 0.383
370 H GLU 12 H GLU 12 8.583 -5.186 2.356
371 HA GLU 12 HA GLU 12 6.139 -6.204 3.305
372 HB2 GLU 12 HB3 GLU 12 7.951 -5.328 4.762
373 HB3 GLU 12 HB2 GLU 12 7.532 -3.699 4.251
374 HG2 GLU 12 HG3 GLU 12 5.335 -3.916 5.230
375 HG3 GLU 12 HG2 GLU 12 5.669 -5.592 5.665
376 H LEU 13 H LEU 13 6.868 -2.854 2.250
377 HA LEU 13 HA LEU 13 4.191 -2.008 2.330
378 HB2 LEU 13 HB3 LEU 13 6.498 -0.913 0.732
379 HB3 LEU 13 HB2 LEU 13 4.964 -0.095 0.987
380 HG LEU 13 HG LEU 13 6.221 -1.004 3.451
381 HD11 LEU 13 HD11 LEU 13 7.917 0.794 3.471
382 HD12 LEU 13 HD12 LEU 13 7.557 1.134 1.778
383 HD13 LEU 13 HD13 LEU 13 8.255 -0.420 2.237
384 HD21 LEU 13 HD21 LEU 13 5.554 1.181 4.219
385 HD22 LEU 13 HD22 LEU 13 4.236 0.468 3.288
386 HD23 LEU 13 HD23 LEU 13 5.256 1.710 2.566
387 H LEU 14 H LEU 14 6.091 -3.425 -0.282
388 HA LEU 14 HA LEU 14 4.239 -3.242 -2.343
389 HB2 LEU 14 HB3 LEU 14 6.539 -4.060 -2.596
390 HB3 LEU 14 HB2 LEU 14 6.160 -5.483 -1.663
391 HG LEU 14 HG LEU 14 6.358 -5.785 -4.147
392 HD11 LEU 14 HD11 LEU 14 3.761 -6.611 -2.884
393 HD12 LEU 14 HD12 LEU 14 5.303 -7.458 -2.753
394 HD13 LEU 14 HD13 LEU 14 4.493 -7.336 -4.316
395 HD21 LEU 14 HD21 LEU 14 3.677 -4.417 -4.187
396 HD22 LEU 14 HD22 LEU 14 4.490 -5.178 -5.553
397 HD23 LEU 14 HD23 LEU 14 5.181 -3.738 -4.810
398 H SER 15 H SER 15 4.485 -5.540 0.313
399 HA SER 15 HA SER 15 2.158 -7.012 -0.390
400 HB2 SER 15 HB3 SER 15 3.453 -6.733 2.330
401 HB3 SER 15 HB2 SER 15 2.350 -8.011 1.814
402 HG SER 15 HG SER 15 4.965 -7.481 0.826
403 H LYS 16 H LYS 16 2.788 -4.195 1.711
404 HA LYS 16 HA LYS 16 0.268 -4.106 2.935
405 HB2 LYS 16 HB3 LYS 16 2.193 -1.881 2.278
406 HB3 LYS 16 HB2 LYS 16 0.752 -1.664 3.259
407 HG2 LYS 16 HG3 LYS 16 1.593 -3.267 4.884
408 HG3 LYS 16 HG2 LYS 16 3.026 -3.534 3.894
409 HD2 LYS 16 HD3 LYS 16 3.530 -2.017 5.720
410 HD3 LYS 16 HD2 LYS 16 3.642 -1.174 4.178
411 HE2 LYS 16 HE3 LYS 16 2.521 0.218 5.812
412 HE3 LYS 16 HE2 LYS 16 1.396 -0.246 4.539
413 HZ1 LYS 16 HZ1 LYS 16 1.579 -1.474 7.237
414 HZ2 LYS 16 HZ2 LYS 16 0.524 -1.972 6.014
415 HZ3 LYS 16 HZ3 LYS 16 0.358 -0.433 6.693
416 H ASN 17 H ASN 17 1.353 -2.394 -0.034
417 HA ASN 17 HA ASN 17 -1.215 -1.246 -0.466
418 HB2 ASN 17 HB3 ASN 17 -0.412 -0.478 -2.580
419 HB3 ASN 17 HB2 ASN 17 0.922 -0.344 -1.446
420 HD21 ASN 17 HD21 ASN 17 -0.336 -2.043 -4.213
421 HD22 ASN 17 HD22 ASN 17 1.145 -2.815 -4.655
422 H TYR 18 H TYR 18 0.234 -4.281 -1.329
423 HA TYR 18 HA TYR 18 -1.615 -5.074 -3.315
424 HB2 TYR 18 HB3 TYR 18 0.560 -6.192 -2.947
425 HB3 TYR 18 HB2 TYR 18 -0.012 -6.783 -1.391
426 HD1 TYR 18 HD1 TYR 18 -0.466 -7.053 -5.048
427 HD2 TYR 18 HD2 TYR 18 -1.365 -8.740 -1.248
428 HE1 TYR 18 HE1 TYR 18 -1.327 -9.072 -6.154
429 HE2 TYR 18 HE2 TYR 18 -2.232 -10.763 -2.345
430 HH TYR 18 HH TYR 18 -3.177 -11.396 -4.554
431 H HIS 19 H HIS 19 -1.486 -5.552 0.187
432 HA HIS 19 HA HIS 19 -3.871 -7.061 0.383
433 HB2 HIS 19 HB3 HIS 19 -2.190 -5.540 2.335
434 HB3 HIS 19 HB2 HIS 19 -3.773 -6.122 2.834
435 HD1 HIS 19 HD1 HIS 19 -3.913 -8.505 3.566
436 HD2 HIS 19 HD2 HIS 19 -0.413 -7.690 1.482
437 HE1 HIS 19 HE1 HIS 19 -2.506 -10.577 3.772
438 HE2 HIS 19 HE2 HIS 19 -0.348 -10.020 2.590
439 H LEU 20 H LEU 20 -3.211 -3.597 0.785
440 HA LEU 20 HA LEU 20 -5.886 -2.930 1.430
441 HB2 LEU 20 HB3 LEU 20 -3.466 -1.387 0.638
442 HB3 LEU 20 HB2 LEU 20 -5.023 -0.590 0.544
443 HG LEU 20 HG LEU 20 -3.876 -0.103 2.658
444 HD11 LEU 20 HD11 LEU 20 -6.316 -1.828 3.036
445 HD12 LEU 20 HD12 LEU 20 -6.321 -0.124 2.581
446 HD13 LEU 20 HD13 LEU 20 -5.708 -0.614 4.161
447 HD21 LEU 20 HD21 LEU 20 -4.111 -3.063 3.153
448 HD22 LEU 20 HD22 LEU 20 -3.625 -1.858 4.345
449 HD23 LEU 20 HD23 LEU 20 -2.615 -2.155 2.928
450 H GLU 21 H GLU 21 -4.139 -3.144 -1.632
451 HA GLU 21 HA GLU 21 -6.083 -1.977 -3.288
452 HB2 GLU 21 HB3 GLU 21 -3.708 -2.736 -3.887
453 HB3 GLU 21 HB2 GLU 21 -4.385 -4.345 -4.071
454 HG2 GLU 21 HG3 GLU 21 -5.385 -1.959 -5.593
455 HG3 GLU 21 HG2 GLU 21 -4.101 -3.008 -6.183
456 H ASN 22 H ASN 22 -5.625 -5.342 -2.288
457 HA ASN 22 HA ASN 22 -7.908 -6.359 -3.601
458 HB2 ASN 22 HB3 ASN 22 -6.143 -7.374 -1.406
459 HB3 ASN 22 HB2 ASN 22 -7.636 -8.224 -1.790
460 HD21 ASN 22 HD21 ASN 22 -4.470 -7.323 -2.924
461 HD22 ASN 22 HD22 ASN 22 -4.432 -8.407 -4.276
462 H GLU 23 H GLU 23 -7.504 -4.636 -0.651
463 HA GLU 23 HA GLU 23 -10.029 -5.474 0.462
464 HB2 GLU 23 HB3 GLU 23 -8.019 -4.874 1.855
465 HB3 GLU 23 HB2 GLU 23 -8.263 -3.185 1.359
466 HG2 GLU 23 HG3 GLU 23 -10.359 -3.089 2.477
467 HG3 GLU 23 HG2 GLU 23 -10.355 -4.826 2.772
468 H VAL 24 H VAL 24 -8.741 -2.729 -1.332
469 HA VAL 24 HA VAL 24 -11.045 -1.108 -1.226
470 HB VAL 24 HB VAL 24 -8.975 -1.326 -3.434
471 HG11 VAL 24 HG11 VAL 24 -11.106 -0.386 -4.245
472 HG12 VAL 24 HG12 VAL 24 -9.804 0.803 -4.243
473 HG13 VAL 24 HG13 VAL 24 -11.030 0.837 -2.974
474 HG21 VAL 24 HG21 VAL 24 -8.022 -0.588 -1.338
475 HG22 VAL 24 HG22 VAL 24 -9.287 0.629 -1.163
476 HG23 VAL 24 HG23 VAL 24 -8.108 0.764 -2.468
477 H ALA 25 H ALA 25 -10.037 -3.680 -3.414
478 HA ALA 25 HA ALA 25 -12.082 -3.427 -5.302
479 HB1 ALA 25 HB1 ALA 25 -10.028 -4.761 -5.621
480 HB2 ALA 25 HB2 ALA 25 -11.497 -5.642 -6.038
481 HB3 ALA 25 HB3 ALA 25 -10.677 -5.970 -4.512
482 H ARG 26 H ARG 26 -11.966 -5.280 -2.284
483 HA ARG 26 HA ARG 26 -14.325 -6.743 -2.728
484 HB2 ARG 26 HB3 ARG 26 -14.154 -7.485 -0.530
485 HB3 ARG 26 HB2 ARG 26 -12.505 -7.089 -0.955
486 HG2 ARG 26 HG3 ARG 26 -12.634 -5.008 0.296
487 HG3 ARG 26 HG2 ARG 26 -14.326 -5.354 0.687
488 HD2 ARG 26 HD2 ARG 26 -12.654 -5.920 2.483
489 HD3 ARG 26 HD1 ARG 26 -13.748 -7.217 2.012
490 HE ARG 26 HE ARG 26 -10.913 -7.022 1.200
491 HH11 ARG 26 HH11 ARG 26 -13.787 -8.905 1.881
492 HH12 ARG 26 HH12 ARG 26 -12.997 -10.431 1.659
493 HH21 ARG 26 HH21 ARG 26 -9.861 -9.039 0.937
494 HH22 ARG 26 HH22 ARG 26 -10.761 -10.510 1.129
495 H LEU 27 H LEU 27 -13.741 -3.672 -1.128
496 HA LEU 27 HA LEU 27 -16.465 -3.213 -0.435
497 HB2 LEU 27 HB3 LEU 27 -14.205 -1.250 -0.771
498 HB3 LEU 27 HB2 LEU 27 -15.763 -0.902 -0.055
499 HG LEU 27 HG LEU 27 -14.060 -3.054 1.092
500 HD11 LEU 27 HD11 LEU 27 -12.677 -1.044 0.887
501 HD12 LEU 27 HD12 LEU 27 -13.032 -1.461 2.566
502 HD13 LEU 27 HD13 LEU 27 -13.899 -0.141 1.783
503 HD21 LEU 27 HD21 LEU 27 -16.362 -2.902 1.849
504 HD22 LEU 27 HD22 LEU 27 -16.142 -1.187 2.209
505 HD23 LEU 27 HD23 LEU 27 -15.264 -2.405 3.138
506 H LYS 28 H LYS 28 -14.461 -2.234 -3.178
507 HA LYS 28 HA LYS 28 -16.145 -0.539 -4.516
508 HB2 LYS 28 HB3 LYS 28 -13.884 -1.113 -5.279
509 HB3 LYS 28 HB2 LYS 28 -14.439 -2.716 -5.737
510 HG2 LYS 28 HG3 LYS 28 -14.255 -1.324 -7.692
511 HG3 LYS 28 HG2 LYS 28 -15.953 -1.696 -7.389
512 HD2 LYS 28 HD3 LYS 28 -16.208 0.501 -6.294
513 HD3 LYS 28 HD2 LYS 28 -14.527 0.868 -6.684
514 HE2 LYS 28 HE3 LYS 28 -15.037 0.653 -9.068
515 HE3 LYS 28 HE2 LYS 28 -16.717 0.291 -8.677
516 HZ1 LYS 28 HZ1 LYS 28 -15.292 2.827 -8.097
517 HZ2 LYS 28 HZ2 LYS 28 -16.885 2.486 -7.643
518 HZ3 LYS 28 HZ3 LYS 28 -16.478 2.595 -9.280
519 H LYS 29 H LYS 29 -16.250 -4.097 -4.559
520 HA LYS 29 HA LYS 29 -18.501 -4.132 -6.340
521 HB2 LYS 29 HB3 LYS 29 -16.848 -6.168 -4.968
522 HB3 LYS 29 HB2 LYS 29 -18.513 -6.627 -5.281
523 HG2 LYS 29 HG3 LYS 29 -17.075 -7.408 -7.053
524 HG3 LYS 29 HG2 LYS 29 -18.178 -6.194 -7.682
525 HD2 LYS 29 HD3 LYS 29 -16.105 -5.664 -8.631
526 HD3 LYS 29 HD2 LYS 29 -16.264 -4.533 -7.287
527 HE2 LYS 29 HE3 LYS 29 -14.021 -5.474 -7.368
528 HE3 LYS 29 HE2 LYS 29 -14.861 -5.975 -5.902
529 HZ1 LYS 29 HZ1 LYS 29 -14.580 -7.633 -8.350
530 HZ2 LYS 29 HZ2 LYS 29 -15.297 -8.111 -6.897
531 HZ3 LYS 29 HZ3 LYS 29 -13.640 -7.794 -6.954
532 H LEU 30 H LEU 30 -18.058 -4.065 -2.898
533 HA LEU 30 HA LEU 30 -20.687 -4.921 -2.211
534 HB2 LEU 30 HB3 LEU 30 -18.381 -3.755 -0.799
535 HB3 LEU 30 HB2 LEU 30 -19.945 -3.422 -0.086
536 HG LEU 30 HG LEU 30 -20.392 -5.775 0.196
537 HD11 LEU 30 HD11 LEU 30 -18.738 -7.483 -0.397
538 HD12 LEU 30 HD12 LEU 30 -17.762 -6.252 -1.194
539 HD13 LEU 30 HD13 LEU 30 -19.363 -6.649 -1.818
540 HD21 LEU 30 HD21 LEU 30 -17.603 -5.067 1.092
541 HD22 LEU 30 HD22 LEU 30 -18.596 -6.367 1.752
542 HD23 LEU 30 HD23 LEU 30 -19.102 -4.690 1.940
543 H VAL 31 H VAL 31 -19.224 -1.781 -2.862
544 HA VAL 31 HA VAL 31 -21.612 -0.326 -2.194
545 HB VAL 31 HB VAL 31 -19.275 0.648 -3.858
546 HG11 VAL 31 HG11 VAL 31 -21.314 2.018 -3.998
547 HG12 VAL 31 HG12 VAL 31 -19.995 2.864 -3.193
548 HG13 VAL 31 HG13 VAL 31 -21.311 2.177 -2.242
549 HG21 VAL 31 HG21 VAL 31 -19.690 0.823 -0.877
550 HG22 VAL 31 HG22 VAL 31 -18.389 1.595 -1.783
551 HG23 VAL 31 HG23 VAL 31 -18.485 -0.165 -1.702
552 H GLY 32 H GLY 32 -20.324 -1.911 -4.989
553 HA2 GLY 32 HA3 GLY 32 -22.063 -0.542 -6.854
554 HA3 GLY 32 HA2 GLY 32 -20.961 -1.860 -7.226
555 H GLU 33 H GLU 33 -21.722 -3.895 -5.708
556 HA GLU 33 HA GLU 33 -23.153 -5.638 -5.603
557 HB2 GLU 33 HB3 GLU 33 -24.509 -4.080 -4.232
558 HB3 GLU 33 HB2 GLU 33 -25.334 -3.544 -5.688
559 HG2 GLU 33 HG3 GLU 33 -26.706 -5.121 -4.498
560 HG3 GLU 33 HG2 GLU 33 -26.185 -5.819 -6.028
Start of MODEL 4
1 H1 GLY 1 H1 GLY 1 24.289 7.919 -8.689
2 H2 GLY 1 H2 GLY 1 23.883 9.527 -8.357
3 H3 GLY 1 H3 GLY 1 22.815 8.546 -9.225
4 HA2 GLY 1 HA2 GLY 1 23.600 8.154 -6.398
5 HA3 GLY 1 HA3 GLY 1 22.070 8.823 -6.947
6 H SER 2 H SER 2 21.939 6.702 -5.334
7 HA SER 2 HA SER 2 20.544 4.804 -6.911
8 HB2 SER 2 HB3 SER 2 22.849 4.028 -7.372
9 HB3 SER 2 HB2 SER 2 23.115 3.827 -5.641
10 HG SER 2 HG SER 2 22.440 1.871 -6.099
11 H MET 3 H MET 3 22.305 5.094 -3.812
12 HA MET 3 HA MET 3 20.582 3.402 -2.383
13 HB2 MET 3 HB3 MET 3 22.446 5.566 -1.427
14 HB3 MET 3 HB2 MET 3 21.591 4.475 -0.347
15 HG2 MET 3 HG3 MET 3 23.629 3.728 -2.430
16 HG3 MET 3 HG2 MET 3 23.834 3.689 -0.680
17 HE1 MET 3 HE1 MET 3 20.899 2.520 0.151
18 HE2 MET 3 HE2 MET 3 22.413 2.040 0.915
19 HE3 MET 3 HE3 MET 3 21.308 0.811 0.304
20 H LYS 4 H LYS 4 20.689 6.977 -2.473
21 HA LYS 4 HA LYS 4 18.472 7.301 -0.749
22 HB2 LYS 4 HB3 LYS 4 20.095 9.102 -1.189
23 HB3 LYS 4 HB2 LYS 4 19.519 9.209 -2.846
24 HG2 LYS 4 HG3 LYS 4 17.410 10.038 -2.155
25 HG3 LYS 4 HG2 LYS 4 17.748 9.667 -0.463
26 HD2 LYS 4 HD3 LYS 4 17.990 12.051 -0.875
27 HD3 LYS 4 HD2 LYS 4 19.548 11.337 -0.467
28 HE2 LYS 4 HE3 LYS 4 19.811 12.894 -2.297
29 HE3 LYS 4 HE2 LYS 4 20.109 11.253 -2.863
30 HZ1 LYS 4 HZ1 LYS 4 18.748 12.560 -4.403
31 HZ2 LYS 4 HZ2 LYS 4 17.557 12.728 -3.215
32 HZ3 LYS 4 HZ3 LYS 4 17.922 11.198 -3.834
33 H GLN 5 H GLN 5 18.756 6.929 -4.225
34 HA GLN 5 HA GLN 5 16.063 7.509 -4.863
35 HB2 GLN 5 HB3 GLN 5 18.043 5.722 -6.290
36 HB3 GLN 5 HB2 GLN 5 16.507 6.255 -6.958
37 HG2 GLN 5 HG3 GLN 5 17.290 8.597 -6.744
38 HG3 GLN 5 HG2 GLN 5 18.858 7.981 -6.230
39 HE21 GLN 5 HE21 GLN 5 16.651 8.353 -8.875
40 HE22 GLN 5 HE22 GLN 5 17.765 7.937 -10.128
41 H LEU 6 H LEU 6 17.725 4.588 -3.839
42 HA LEU 6 HA LEU 6 15.508 2.840 -4.190
43 HB2 LEU 6 HB3 LEU 6 18.056 2.337 -3.880
44 HB3 LEU 6 HB2 LEU 6 17.690 2.398 -2.172
45 HG LEU 6 HG LEU 6 17.756 0.099 -3.139
46 HD11 LEU 6 HD11 LEU 6 15.762 -0.709 -2.031
47 HD12 LEU 6 HD12 LEU 6 15.081 0.919 -2.031
48 HD13 LEU 6 HD13 LEU 6 16.525 0.566 -1.082
49 HD21 LEU 6 HD21 LEU 6 15.929 -0.673 -4.517
50 HD22 LEU 6 HD22 LEU 6 16.772 0.651 -5.319
51 HD23 LEU 6 HD23 LEU 6 15.222 0.941 -4.532
52 H GLU 7 H GLU 7 16.734 4.804 -1.526
53 HA GLU 7 HA GLU 7 14.909 3.966 0.446
54 HB2 GLU 7 HB3 GLU 7 16.274 6.641 0.080
55 HB3 GLU 7 HB2 GLU 7 15.416 6.151 1.531
56 HG2 GLU 7 HG3 GLU 7 17.856 4.808 0.395
57 HG3 GLU 7 HG2 GLU 7 17.829 5.907 1.773
58 H ASP 8 H ASP 8 14.700 6.396 -2.093
59 HA ASP 8 HA ASP 8 12.127 7.371 -1.309
60 HB2 ASP 8 HB3 ASP 8 13.755 7.630 -3.825
61 HB3 ASP 8 HB2 ASP 8 12.104 8.232 -3.741
62 H LYS 9 H LYS 9 13.253 4.644 -3.077
63 HA LYS 9 HA LYS 9 10.864 4.115 -4.540
64 HB2 LYS 9 HB3 LYS 9 13.079 3.185 -5.156
65 HB3 LYS 9 HB2 LYS 9 13.059 2.210 -3.695
66 HG2 LYS 9 HG3 LYS 9 11.167 0.953 -4.508
67 HG3 LYS 9 HG2 LYS 9 11.051 1.995 -5.930
68 HD2 LYS 9 HD3 LYS 9 13.311 1.278 -6.608
69 HD3 LYS 9 HD2 LYS 9 13.366 0.195 -5.218
70 HE2 LYS 9 HE3 LYS 9 11.307 0.052 -7.414
71 HE3 LYS 9 HE2 LYS 9 12.770 -0.927 -7.355
72 HZ1 LYS 9 HZ1 LYS 9 10.861 -2.122 -6.493
73 HZ2 LYS 9 HZ2 LYS 9 10.613 -0.936 -5.319
74 HZ3 LYS 9 HZ3 LYS 9 12.012 -1.884 -5.280
75 H VAL 10 H VAL 10 12.100 3.214 -1.373
76 HA VAL 10 HA VAL 10 10.045 1.429 -0.629
77 HB VAL 10 HB VAL 10 11.562 3.306 1.197
78 HG11 VAL 10 HG11 VAL 10 11.125 1.609 2.911
79 HG12 VAL 10 HG12 VAL 10 10.188 0.678 1.744
80 HG13 VAL 10 HG13 VAL 10 9.628 2.271 2.250
81 HG21 VAL 10 HG21 VAL 10 13.211 1.584 1.478
82 HG22 VAL 10 HG22 VAL 10 13.060 1.935 -0.244
83 HG23 VAL 10 HG23 VAL 10 12.309 0.491 0.433
84 H GLU 11 H GLU 11 10.441 4.916 -0.158
85 HA GLU 11 HA GLU 11 7.957 5.300 1.157
86 HB2 GLU 11 HB3 GLU 11 9.707 7.289 -0.300
87 HB3 GLU 11 HB2 GLU 11 8.376 7.701 0.775
88 HG2 GLU 11 HG3 GLU 11 9.548 6.624 2.629
89 HG3 GLU 11 HG2 GLU 11 10.886 6.232 1.552
90 H GLU 12 H GLU 12 8.930 5.208 -2.177
91 HA GLU 12 HA GLU 12 6.768 6.431 -3.411
92 HB2 GLU 12 HB3 GLU 12 8.746 5.619 -4.627
93 HB3 GLU 12 HB2 GLU 12 8.245 3.960 -4.333
94 HG2 GLU 12 HG3 GLU 12 6.222 4.336 -5.649
95 HG3 GLU 12 HG2 GLU 12 6.724 6.000 -5.943
96 H LEU 13 H LEU 13 7.086 2.955 -2.585
97 HA LEU 13 HA LEU 13 4.349 2.479 -3.191
98 HB2 LEU 13 HB3 LEU 13 6.389 0.771 -1.802
99 HB3 LEU 13 HB2 LEU 13 4.712 0.285 -1.953
100 HG LEU 13 HG LEU 13 5.134 0.847 -4.496
101 HD11 LEU 13 HD11 LEU 13 7.875 0.075 -3.509
102 HD12 LEU 13 HD12 LEU 13 7.413 1.632 -4.195
103 HD13 LEU 13 HD13 LEU 13 7.375 0.181 -5.196
104 HD21 LEU 13 HD21 LEU 13 4.372 -1.289 -3.649
105 HD22 LEU 13 HD22 LEU 13 6.010 -1.694 -3.131
106 HD23 LEU 13 HD23 LEU 13 5.644 -1.529 -4.849
107 H LEU 14 H LEU 14 5.919 3.575 -0.269
108 HA LEU 14 HA LEU 14 3.754 2.982 1.445
109 HB2 LEU 14 HB3 LEU 14 6.092 3.855 2.101
110 HB3 LEU 14 HB2 LEU 14 5.446 5.448 1.714
111 HG LEU 14 HG LEU 14 3.894 3.719 3.591
112 HD11 LEU 14 HD11 LEU 14 6.248 3.579 4.381
113 HD12 LEU 14 HD12 LEU 14 5.137 4.352 5.508
114 HD13 LEU 14 HD13 LEU 14 6.244 5.337 4.557
115 HD21 LEU 14 HD21 LEU 14 2.990 5.858 2.883
116 HD22 LEU 14 HD22 LEU 14 4.425 6.679 3.501
117 HD23 LEU 14 HD23 LEU 14 3.335 5.848 4.613
118 H SER 15 H SER 15 4.522 5.699 -0.650
119 HA SER 15 HA SER 15 2.196 7.209 -0.152
120 HB2 SER 15 HB3 SER 15 3.749 7.053 -2.748
121 HB3 SER 15 HB2 SER 15 2.743 8.390 -2.190
122 HG SER 15 HG SER 15 5.262 7.534 -1.239
123 H LYS 16 H LYS 16 2.934 4.511 -2.273
124 HA LYS 16 HA LYS 16 0.582 4.424 -3.780
125 HB2 LYS 16 HB3 LYS 16 2.613 3.085 -4.222
126 HB3 LYS 16 HB2 LYS 16 2.272 2.122 -2.793
127 HG2 LYS 16 HG3 LYS 16 0.160 1.382 -3.850
128 HG3 LYS 16 HG2 LYS 16 0.626 2.264 -5.309
129 HD2 LYS 16 HD3 LYS 16 2.676 0.917 -5.450
130 HD3 LYS 16 HD2 LYS 16 2.177 0.023 -4.014
131 HE2 LYS 16 HE3 LYS 16 1.618 -1.313 -5.896
132 HE3 LYS 16 HE2 LYS 16 0.114 -0.646 -5.263
133 HZ1 LYS 16 HZ1 LYS 16 0.179 1.043 -6.994
134 HZ2 LYS 16 HZ2 LYS 16 0.183 -0.509 -7.660
135 HZ3 LYS 16 HZ3 LYS 16 1.613 0.389 -7.604
136 H ASN 17 H ASN 17 1.348 2.655 -0.732
137 HA ASN 17 HA ASN 17 -1.325 1.696 -0.493
138 HB2 ASN 17 HB3 ASN 17 -0.713 0.886 1.726
139 HB3 ASN 17 HB2 ASN 17 0.520 0.465 0.548
140 HD21 ASN 17 HD21 ASN 17 -0.264 2.527 3.256
141 HD22 ASN 17 HD22 ASN 17 1.363 2.952 3.642
142 H TYR 18 H TYR 18 0.376 4.485 0.854
143 HA TYR 18 HA TYR 18 -1.518 5.406 2.639
144 HB2 TYR 18 HB3 TYR 18 0.628 6.514 2.362
145 HB3 TYR 18 HB2 TYR 18 0.198 7.004 0.728
146 HD1 TYR 18 HD1 TYR 18 -0.912 9.035 0.344
147 HD2 TYR 18 HD2 TYR 18 -0.724 7.477 4.299
148 HE1 TYR 18 HE1 TYR 18 -1.832 11.140 1.213
149 HE2 TYR 18 HE2 TYR 18 -1.646 9.583 5.178
150 HH TYR 18 HH TYR 18 -1.825 11.930 4.524
151 H HIS 19 H HIS 19 -1.359 6.109 -0.855
152 HA HIS 19 HA HIS 19 -3.841 7.515 -0.877
153 HB2 HIS 19 HB3 HIS 19 -2.247 6.287 -3.134
154 HB3 HIS 19 HB2 HIS 19 -3.679 7.282 -3.367
155 HD1 HIS 19 HD1 HIS 19 -0.329 7.678 -3.848
156 HD2 HIS 19 HD2 HIS 19 -3.042 9.826 -1.541
157 HE1 HIS 19 HE1 HIS 19 0.711 9.942 -3.510
158 HE2 HIS 19 HE2 HIS 19 -1.024 11.273 -2.258
159 H LEU 20 H LEU 20 -2.891 4.185 -1.428
160 HA LEU 20 HA LEU 20 -5.317 3.289 -2.523
161 HB2 LEU 20 HB3 LEU 20 -3.151 2.110 -2.669
162 HB3 LEU 20 HB2 LEU 20 -3.240 1.776 -0.951
163 HG LEU 20 HG LEU 20 -5.233 0.425 -1.313
164 HD11 LEU 20 HD11 LEU 20 -4.756 1.022 -4.227
165 HD12 LEU 20 HD12 LEU 20 -6.154 1.510 -3.269
166 HD13 LEU 20 HD13 LEU 20 -5.874 -0.196 -3.616
167 HD21 LEU 20 HD21 LEU 20 -2.906 -0.331 -3.066
168 HD22 LEU 20 HD22 LEU 20 -4.123 -1.437 -2.431
169 HD23 LEU 20 HD23 LEU 20 -3.028 -0.607 -1.329
170 H GLU 21 H GLU 21 -4.143 3.642 0.796
171 HA GLU 21 HA GLU 21 -6.333 2.367 2.058
172 HB2 GLU 21 HB3 GLU 21 -4.181 2.972 3.185
173 HB3 GLU 21 HB2 GLU 21 -4.684 4.657 3.149
174 HG2 GLU 21 HG3 GLU 21 -6.603 4.132 4.547
175 HG3 GLU 21 HG2 GLU 21 -6.147 2.431 4.555
176 H ASN 22 H ASN 22 -5.871 5.572 0.747
177 HA ASN 22 HA ASN 22 -8.179 6.785 1.832
178 HB2 ASN 22 HB3 ASN 22 -6.528 7.343 -0.614
179 HB3 ASN 22 HB2 ASN 22 -8.013 8.234 -0.313
180 HD21 ASN 22 HD21 ASN 22 -5.891 7.130 2.243
181 HD22 ASN 22 HD22 ASN 22 -5.338 8.698 2.712
182 H GLU 23 H GLU 23 -7.678 4.521 -0.724
183 HA GLU 23 HA GLU 23 -10.245 4.888 -1.964
184 HB2 GLU 23 HB3 GLU 23 -8.013 2.916 -2.279
185 HB3 GLU 23 HB2 GLU 23 -9.619 2.507 -2.914
186 HG2 GLU 23 HG3 GLU 23 -8.397 3.433 -4.700
187 HG3 GLU 23 HG2 GLU 23 -9.542 4.667 -4.187
188 H VAL 24 H VAL 24 -8.890 2.791 0.510
189 HA VAL 24 HA VAL 24 -11.148 1.069 0.671
190 HB VAL 24 HB VAL 24 -9.200 1.639 2.911
191 HG11 VAL 24 HG11 VAL 24 -11.184 0.373 3.565
192 HG12 VAL 24 HG12 VAL 24 -9.742 -0.639 3.628
193 HG13 VAL 24 HG13 VAL 24 -10.875 -0.803 2.282
194 HG21 VAL 24 HG21 VAL 24 -7.854 -0.216 2.082
195 HG22 VAL 24 HG22 VAL 24 -7.958 1.070 0.880
196 HG23 VAL 24 HG23 VAL 24 -8.931 -0.390 0.697
197 H ALA 25 H ALA 25 -10.175 4.048 2.245
198 HA ALA 25 HA ALA 25 -12.105 4.024 4.304
199 HB1 ALA 25 HB1 ALA 25 -10.045 5.404 4.305
200 HB2 ALA 25 HB2 ALA 25 -11.507 6.305 4.707
201 HB3 ALA 25 HB3 ALA 25 -10.797 6.451 3.100
202 H ARG 26 H ARG 26 -12.174 5.393 1.036
203 HA ARG 26 HA ARG 26 -14.573 6.840 1.389
204 HB2 ARG 26 HB3 ARG 26 -14.629 6.799 -1.141
205 HB3 ARG 26 HB2 ARG 26 -13.225 7.540 -0.403
206 HG2 ARG 26 HG3 ARG 26 -11.998 5.408 -0.792
207 HG3 ARG 26 HG2 ARG 26 -13.394 4.817 -1.695
208 HD2 ARG 26 HD2 ARG 26 -11.730 7.249 -2.326
209 HD3 ARG 26 HD1 ARG 26 -11.736 5.726 -3.210
210 HE ARG 26 HE ARG 26 -14.321 6.545 -3.325
211 HH11 ARG 26 HH11 ARG 26 -11.267 8.061 -4.111
212 HH12 ARG 26 HH12 ARG 26 -11.932 9.044 -5.376
213 HH21 ARG 26 HH21 ARG 26 -15.206 7.846 -4.985
214 HH22 ARG 26 HH22 ARG 26 -14.173 8.922 -5.869
215 H LEU 27 H LEU 27 -13.905 3.626 0.073
216 HA LEU 27 HA LEU 27 -16.599 3.015 -0.537
217 HB2 LEU 27 HB3 LEU 27 -14.309 1.162 0.070
218 HB3 LEU 27 HB2 LEU 27 -15.850 0.697 -0.612
219 HG LEU 27 HG LEU 27 -14.145 2.703 -1.996
220 HD11 LEU 27 HD11 LEU 27 -13.151 0.923 -3.281
221 HD12 LEU 27 HD12 LEU 27 -14.018 -0.276 -2.319
222 HD13 LEU 27 HD13 LEU 27 -12.779 0.731 -1.568
223 HD21 LEU 27 HD21 LEU 27 -15.357 1.754 -3.956
224 HD22 LEU 27 HD22 LEU 27 -16.402 2.544 -2.777
225 HD23 LEU 27 HD23 LEU 27 -16.304 0.783 -2.826
226 H LYS 28 H LYS 28 -14.605 2.407 2.317
227 HA LYS 28 HA LYS 28 -16.272 0.793 3.772
228 HB2 LYS 28 HB3 LYS 28 -14.005 1.580 4.478
229 HB3 LYS 28 HB2 LYS 28 -14.732 3.114 4.936
230 HG2 LYS 28 HG3 LYS 28 -14.517 1.833 6.913
231 HG3 LYS 28 HG2 LYS 28 -16.230 1.833 6.485
232 HD2 LYS 28 HD3 LYS 28 -15.798 -0.382 5.328
233 HD3 LYS 28 HD2 LYS 28 -14.223 -0.382 6.120
234 HE2 LYS 28 HE3 LYS 28 -16.944 -0.442 7.406
235 HE3 LYS 28 HE2 LYS 28 -15.691 -1.680 7.466
236 HZ1 LYS 28 HZ1 LYS 28 -14.294 -0.003 8.656
237 HZ2 LYS 28 HZ2 LYS 28 -15.646 -0.545 9.512
238 HZ3 LYS 28 HZ3 LYS 28 -15.673 0.979 8.775
239 H LYS 29 H LYS 29 -16.370 4.363 3.715
240 HA LYS 29 HA LYS 29 -18.656 4.464 5.413
241 HB2 LYS 29 HB3 LYS 29 -18.658 6.872 4.880
242 HB3 LYS 29 HB2 LYS 29 -17.102 6.286 5.429
243 HG2 LYS 29 HG3 LYS 29 -16.406 6.160 3.028
244 HG3 LYS 29 HG2 LYS 29 -17.917 6.970 2.617
245 HD2 LYS 29 HD3 LYS 29 -15.813 8.080 4.475
246 HD3 LYS 29 HD2 LYS 29 -15.988 8.515 2.777
247 HE2 LYS 29 HE3 LYS 29 -18.108 8.900 4.885
248 HE3 LYS 29 HE2 LYS 29 -17.006 10.156 4.326
249 HZ1 LYS 29 HZ1 LYS 29 -19.124 10.323 3.214
250 HZ2 LYS 29 HZ2 LYS 29 -19.009 8.732 2.662
251 HZ3 LYS 29 HZ3 LYS 29 -17.929 9.899 2.097
252 H LEU 30 H LEU 30 -18.215 4.114 2.012
253 HA LEU 30 HA LEU 30 -20.856 4.847 1.224
254 HB2 LEU 30 HB3 LEU 30 -18.670 3.220 -0.009
255 HB3 LEU 30 HB2 LEU 30 -20.267 3.232 -0.730
256 HG LEU 30 HG LEU 30 -18.602 5.705 -0.257
257 HD11 LEU 30 HD11 LEU 30 -19.001 4.068 -2.755
258 HD12 LEU 30 HD12 LEU 30 -17.492 4.297 -1.874
259 HD13 LEU 30 HD13 LEU 30 -18.248 5.659 -2.697
260 HD21 LEU 30 HD21 LEU 30 -21.011 6.114 -0.342
261 HD22 LEU 30 HD22 LEU 30 -21.109 5.247 -1.874
262 HD23 LEU 30 HD23 LEU 30 -20.206 6.758 -1.771
263 H VAL 31 H VAL 31 -19.376 1.948 2.502
264 HA VAL 31 HA VAL 31 -21.755 0.364 2.013
265 HB VAL 31 HB VAL 31 -19.338 -0.449 3.639
266 HG11 VAL 31 HG11 VAL 31 -21.389 -1.821 3.888
267 HG12 VAL 31 HG12 VAL 31 -20.039 -2.704 3.175
268 HG13 VAL 31 HG13 VAL 31 -21.352 -2.128 2.150
269 HG21 VAL 31 HG21 VAL 31 -19.819 -0.812 0.685
270 HG22 VAL 31 HG22 VAL 31 -18.481 -1.501 1.608
271 HG23 VAL 31 HG23 VAL 31 -18.614 0.247 1.419
272 H GLY 32 H GLY 32 -20.306 2.183 4.646
273 HA2 GLY 32 HA3 GLY 32 -22.581 2.574 6.073
274 HA3 GLY 32 HA2 GLY 32 -22.038 1.005 6.635
275 H GLU 33 H GLU 33 -19.269 2.632 5.919
276 HA GLU 33 HA GLU 33 -17.694 3.767 7.070
277 HB2 GLU 33 HB3 GLU 33 -19.353 5.516 7.443
278 HB3 GLU 33 HB2 GLU 33 -19.976 4.651 8.842
279 HG2 GLU 33 HG3 GLU 33 -17.826 4.932 9.967
280 HG3 GLU 33 HG2 GLU 33 -17.218 5.813 8.570
281 H1 GLY 1 H1 GLY 1 24.311 -8.151 7.983
282 H2 GLY 1 H2 GLY 1 23.923 -9.757 7.631
283 H3 GLY 1 H3 GLY 1 22.844 -8.799 8.510
284 HA2 GLY 1 HA2 GLY 1 23.625 -8.373 5.685
285 HA3 GLY 1 HA3 GLY 1 22.097 -9.049 6.233
286 H SER 2 H SER 2 21.961 -6.908 4.636
287 HA SER 2 HA SER 2 20.564 -5.023 6.232
288 HB2 SER 2 HB3 SER 2 22.861 -4.237 6.694
289 HB3 SER 2 HB2 SER 2 23.133 -4.041 4.963
290 HG SER 2 HG SER 2 22.474 -2.081 5.449
291 H MET 3 H MET 3 22.316 -5.302 3.125
292 HA MET 3 HA MET 3 20.592 -3.596 1.711
293 HB2 MET 3 HB3 MET 3 22.453 -5.756 0.738
294 HB3 MET 3 HB2 MET 3 21.595 -4.658 -0.333
295 HG2 MET 3 HG3 MET 3 23.643 -3.925 1.744
296 HG3 MET 3 HG2 MET 3 23.838 -3.873 -0.006
297 HE1 MET 3 HE1 MET 3 20.902 -2.701 -0.818
298 HE2 MET 3 HE2 MET 3 22.417 -2.220 -1.583
299 HE3 MET 3 HE3 MET 3 21.313 -0.992 -0.966
300 H LYS 4 H LYS 4 20.688 -7.166 1.797
301 HA LYS 4 HA LYS 4 18.474 -7.479 0.064
302 HB2 LYS 4 HB3 LYS 4 20.097 -9.285 0.491
303 HB3 LYS 4 HB2 LYS 4 19.528 -9.400 2.148
304 HG2 LYS 4 HG3 LYS 4 17.413 -10.221 1.460
305 HG3 LYS 4 HG2 LYS 4 17.745 -9.845 -0.229
306 HD2 LYS 4 HD3 LYS 4 17.981 -12.230 0.170
307 HD3 LYS 4 HD2 LYS 4 19.541 -11.520 -0.240
308 HE2 LYS 4 HE3 LYS 4 19.805 -13.088 1.580
309 HE3 LYS 4 HE2 LYS 4 20.115 -11.452 2.152
310 HZ1 LYS 4 HZ1 LYS 4 18.753 -12.756 3.694
311 HZ2 LYS 4 HZ2 LYS 4 17.554 -12.912 2.512
312 HZ3 LYS 4 HZ3 LYS 4 17.934 -11.388 3.134
313 H GLN 5 H GLN 5 18.769 -7.131 3.543
314 HA GLN 5 HA GLN 5 16.080 -7.706 4.190
315 HB2 GLN 5 HB3 GLN 5 18.069 -5.934 5.619
316 HB3 GLN 5 HB2 GLN 5 16.535 -6.470 6.290
317 HG2 GLN 5 HG3 GLN 5 17.311 -8.811 6.055
318 HG3 GLN 5 HG2 GLN 5 18.879 -8.195 5.539
319 HE21 GLN 5 HE21 GLN 5 16.675 -8.573 8.188
320 HE22 GLN 5 HE22 GLN 5 17.793 -8.171 9.442
321 H LEU 6 H LEU 6 17.741 -4.786 3.177
322 HA LEU 6 HA LEU 6 15.530 -3.031 3.540
323 HB2 LEU 6 HB3 LEU 6 18.079 -2.535 3.223
324 HB3 LEU 6 HB2 LEU 6 17.705 -2.588 1.515
325 HG LEU 6 HG LEU 6 17.780 -0.292 2.490
326 HD11 LEU 6 HD11 LEU 6 15.779 0.525 1.396
327 HD12 LEU 6 HD12 LEU 6 15.097 -1.102 1.392
328 HD13 LEU 6 HD13 LEU 6 16.536 -0.746 0.438
329 HD21 LEU 6 HD21 LEU 6 15.965 0.478 3.883
330 HD22 LEU 6 HD22 LEU 6 16.804 -0.855 4.673
331 HD23 LEU 6 HD23 LEU 6 15.251 -1.131 3.890
332 H GLU 7 H GLU 7 16.745 -4.986 0.867
333 HA GLU 7 HA GLU 7 14.918 -4.130 -1.098
334 HB2 GLU 7 HB3 GLU 7 16.277 -6.809 -0.750
335 HB3 GLU 7 HB2 GLU 7 15.414 -6.309 -2.196
336 HG2 GLU 7 HG3 GLU 7 17.858 -4.972 -1.062
337 HG3 GLU 7 HG2 GLU 7 17.827 -6.068 -2.441
338 H ASP 8 H ASP 8 14.708 -6.583 1.422
339 HA ASP 8 HA ASP 8 12.131 -7.541 0.642
340 HB2 ASP 8 HB3 ASP 8 13.767 -7.813 3.152
341 HB3 ASP 8 HB2 ASP 8 12.115 -8.415 3.071
342 H LYS 9 H LYS 9 13.268 -4.830 2.429
343 HA LYS 9 HA LYS 9 10.885 -4.306 3.902
344 HB2 LYS 9 HB3 LYS 9 13.103 -3.381 4.515
345 HB3 LYS 9 HB2 LYS 9 13.080 -2.398 3.060
346 HG2 LYS 9 HG3 LYS 9 11.196 -1.141 3.888
347 HG3 LYS 9 HG2 LYS 9 11.081 -2.190 5.304
348 HD2 LYS 9 HD3 LYS 9 13.349 -1.481 5.975
349 HD3 LYS 9 HD2 LYS 9 13.397 -0.391 4.591
350 HE2 LYS 9 HE3 LYS 9 11.349 -0.256 6.796
351 HE3 LYS 9 HE2 LYS 9 12.813 0.722 6.736
352 HZ1 LYS 9 HZ1 LYS 9 10.901 1.921 5.887
353 HZ2 LYS 9 HZ2 LYS 9 10.646 0.737 4.711
354 HZ3 LYS 9 HZ3 LYS 9 12.045 1.685 4.664
355 H VAL 10 H VAL 10 12.107 -3.387 0.738
356 HA VAL 10 HA VAL 10 10.049 -1.596 0.011
357 HB VAL 10 HB VAL 10 11.559 -3.462 -1.835
358 HG11 VAL 10 HG11 VAL 10 11.114 -1.754 -3.535
359 HG12 VAL 10 HG12 VAL 10 10.184 -0.828 -2.357
360 HG13 VAL 10 HG13 VAL 10 9.621 -2.419 -2.870
361 HG21 VAL 10 HG21 VAL 10 13.207 -1.739 -2.112
362 HG22 VAL 10 HG22 VAL 10 13.061 -2.101 -0.391
363 HG23 VAL 10 HG23 VAL 10 12.311 -0.651 -1.057
364 H GLU 11 H GLU 11 10.438 -5.081 -0.472
365 HA GLU 11 HA GLU 11 7.951 -5.452 -1.788
366 HB2 GLU 11 HB3 GLU 11 9.704 -7.449 -0.351
367 HB3 GLU 11 HB2 GLU 11 8.370 -7.853 -1.423
368 HG2 GLU 11 HG3 GLU 11 9.535 -6.765 -3.276
369 HG3 GLU 11 HG2 GLU 11 10.880 -6.386 -2.199
370 H GLU 12 H GLU 12 8.937 -5.389 1.544
371 HA GLU 12 HA GLU 12 6.776 -6.610 2.778
372 HB2 GLU 12 HB3 GLU 12 8.764 -5.819 3.992
373 HB3 GLU 12 HB2 GLU 12 8.273 -4.155 3.710
374 HG2 GLU 12 HG3 GLU 12 6.250 -4.529 5.027
375 HG3 GLU 12 HG2 GLU 12 6.752 -6.194 5.319
376 H LEU 13 H LEU 13 7.102 -3.128 1.964
377 HA LEU 13 HA LEU 13 4.367 -2.650 2.589
378 HB2 LEU 13 HB3 LEU 13 6.404 -0.937 1.201
379 HB3 LEU 13 HB2 LEU 13 4.728 -0.450 1.362
380 HG LEU 13 HG LEU 13 5.162 -1.027 3.902
381 HD11 LEU 13 HD11 LEU 13 7.899 -0.253 2.908
382 HD12 LEU 13 HD12 LEU 13 7.436 -1.811 3.594
383 HD13 LEU 13 HD13 LEU 13 7.407 -0.363 4.599
384 HD21 LEU 13 HD21 LEU 13 4.394 1.112 3.072
385 HD22 LEU 13 HD22 LEU 13 6.030 1.522 2.548
386 HD23 LEU 13 HD23 LEU 13 5.672 1.348 4.266
387 H LEU 14 H LEU 14 5.925 -3.734 -0.344
388 HA LEU 14 HA LEU 14 3.752 -3.127 -2.045
389 HB2 LEU 14 HB3 LEU 14 6.084 -3.999 -2.715
390 HB3 LEU 14 HB2 LEU 14 5.437 -5.595 -2.334
391 HG LEU 14 HG LEU 14 3.877 -3.853 -4.196
392 HD11 LEU 14 HD11 LEU 14 6.231 -3.714 -4.996
393 HD12 LEU 14 HD12 LEU 14 5.110 -4.474 -6.121
394 HD13 LEU 14 HD13 LEU 14 6.218 -5.471 -5.184
395 HD21 LEU 14 HD21 LEU 14 2.977 -5.996 -3.496
396 HD22 LEU 14 HD22 LEU 14 4.412 -6.812 -4.115
397 HD23 LEU 14 HD23 LEU 14 3.321 -5.981 -5.225
398 H SER 15 H SER 15 4.525 -5.862 0.029
399 HA SER 15 HA SER 15 2.193 -7.360 -0.469
400 HB2 SER 15 HB3 SER 15 3.753 -7.222 2.123
401 HB3 SER 15 HB2 SER 15 2.742 -8.554 1.562
402 HG SER 15 HG SER 15 5.262 -7.703 0.617
403 H LYS 16 H LYS 16 2.942 -4.674 1.664
404 HA LYS 16 HA LYS 16 0.597 -4.592 3.178
405 HB2 LYS 16 HB3 LYS 16 2.632 -3.256 3.617
406 HB3 LYS 16 HB2 LYS 16 2.287 -2.284 2.197
407 HG2 LYS 16 HG3 LYS 16 0.179 -1.550 3.272
408 HG3 LYS 16 HG2 LYS 16 0.653 -2.442 4.722
409 HD2 LYS 16 HD3 LYS 16 2.702 -1.096 4.863
410 HD3 LYS 16 HD2 LYS 16 2.201 -0.192 3.434
411 HE2 LYS 16 HE3 LYS 16 1.650 1.130 5.332
412 HE3 LYS 16 HE2 LYS 16 0.143 0.475 4.690
413 HZ1 LYS 16 HZ1 LYS 16 0.198 -1.233 6.403
414 HZ2 LYS 16 HZ2 LYS 16 0.210 0.313 7.087
415 HZ3 LYS 16 HZ3 LYS 16 1.637 -0.592 7.023
416 H ASN 17 H ASN 17 1.355 -2.807 0.137
417 HA ASN 17 HA ASN 17 -1.319 -1.845 -0.084
418 HB2 ASN 17 HB3 ASN 17 -0.715 -1.023 -2.301
419 HB3 ASN 17 HB2 ASN 17 0.525 -0.613 -1.127
420 HD21 ASN 17 HD21 ASN 17 -0.275 -2.673 -3.842
421 HD22 ASN 17 HD22 ASN 17 1.350 -3.102 -4.234
422 H TYR 18 H TYR 18 0.373 -4.632 -1.449
423 HA TYR 18 HA TYR 18 -1.527 -5.542 -3.236
424 HB2 TYR 18 HB3 TYR 18 0.617 -6.654 -2.970
425 HB3 TYR 18 HB2 TYR 18 0.193 -7.153 -1.337
426 HD1 TYR 18 HD1 TYR 18 -0.913 -9.186 -0.963
427 HD2 TYR 18 HD2 TYR 18 -0.751 -7.597 -4.904
428 HE1 TYR 18 HE1 TYR 18 -1.839 -11.284 -1.841
429 HE2 TYR 18 HE2 TYR 18 -1.680 -9.693 -5.791
430 HH TYR 18 HH TYR 18 -1.847 -12.041 -5.161
431 H HIS 19 H HIS 19 -1.358 -6.256 0.257
432 HA HIS 19 HA HIS 19 -3.841 -7.662 0.280
433 HB2 HIS 19 HB3 HIS 19 -2.231 -6.441 2.532
434 HB3 HIS 19 HB2 HIS 19 -3.664 -7.435 2.771
435 HD1 HIS 19 HD1 HIS 19 -0.310 -7.837 3.217
436 HD2 HIS 19 HD2 HIS 19 -3.047 -9.973 0.933
437 HE1 HIS 19 HE1 HIS 19 0.719 -10.108 2.876
438 HE2 HIS 19 HE2 HIS 19 -1.016 -11.422 1.606
439 H LEU 20 H LEU 20 -2.881 -4.337 0.863
440 HA LEU 20 HA LEU 20 -5.303 -3.442 1.958
441 HB2 LEU 20 HB3 LEU 20 -3.135 -2.270 2.102
442 HB3 LEU 20 HB2 LEU 20 -3.229 -1.925 0.387
443 HG LEU 20 HG LEU 20 -5.223 -0.575 0.764
444 HD11 LEU 20 HD11 LEU 20 -4.729 -1.188 3.673
445 HD12 LEU 20 HD12 LEU 20 -6.132 -1.667 2.719
446 HD13 LEU 20 HD13 LEU 20 -5.847 0.036 3.073
447 HD21 LEU 20 HD21 LEU 20 -2.888 0.180 2.509
448 HD22 LEU 20 HD22 LEU 20 -4.111 1.285 1.886
449 HD23 LEU 20 HD23 LEU 20 -3.018 0.464 0.774
450 H GLU 21 H GLU 21 -4.142 -3.785 -1.366
451 HA GLU 21 HA GLU 21 -6.336 -2.497 -2.615
452 HB2 GLU 21 HB3 GLU 21 -4.191 -3.094 -3.757
453 HB3 GLU 21 HB2 GLU 21 -4.689 -4.779 -3.725
454 HG2 GLU 21 HG3 GLU 21 -6.620 -4.251 -5.111
455 HG3 GLU 21 HG2 GLU 21 -6.159 -2.550 -5.117
456 H ASN 22 H ASN 22 -5.878 -5.707 -1.318
457 HA ASN 22 HA ASN 22 -8.192 -6.906 -2.409
458 HB2 ASN 22 HB3 ASN 22 -6.528 -7.486 0.025
459 HB3 ASN 22 HB2 ASN 22 -8.017 -8.372 -0.273
460 HD21 ASN 22 HD21 ASN 22 -5.901 -7.254 -2.828
461 HD22 ASN 22 HD22 ASN 22 -5.357 -8.818 -3.314
462 H GLU 23 H GLU 23 -7.672 -4.661 0.162
463 HA GLU 23 HA GLU 23 -10.234 -5.030 1.409
464 HB2 GLU 23 HB3 GLU 23 -7.998 -3.064 1.727
465 HB3 GLU 23 HB2 GLU 23 -9.602 -2.656 2.370
466 HG2 GLU 23 HG3 GLU 23 -8.374 -3.597 4.148
467 HG3 GLU 23 HG2 GLU 23 -9.523 -4.827 3.632
468 H VAL 24 H VAL 24 -8.889 -2.926 -1.064
469 HA VAL 24 HA VAL 24 -11.146 -1.200 -1.205
470 HB VAL 24 HB VAL 24 -9.205 -1.755 -3.455
471 HG11 VAL 24 HG11 VAL 24 -11.191 -0.486 -4.092
472 HG12 VAL 24 HG12 VAL 24 -9.749 0.524 -4.157
473 HG13 VAL 24 HG13 VAL 24 -10.874 0.681 -2.806
474 HG21 VAL 24 HG21 VAL 24 -7.855 0.091 -2.618
475 HG22 VAL 24 HG22 VAL 24 -7.957 -1.203 -1.425
476 HG23 VAL 24 HG23 VAL 24 -8.925 0.257 -1.227
477 H ALA 25 H ALA 25 -10.184 -4.168 -2.800
478 HA ALA 25 HA ALA 25 -12.125 -4.129 -4.849
479 HB1 ALA 25 HB1 ALA 25 -10.066 -5.509 -4.863
480 HB2 ALA 25 HB2 ALA 25 -11.530 -6.404 -5.266
481 HB3 ALA 25 HB3 ALA 25 -10.815 -6.562 -3.663
482 H ARG 26 H ARG 26 -12.179 -5.517 -1.589
483 HA ARG 26 HA ARG 26 -14.579 -6.957 -1.942
484 HB2 ARG 26 HB3 ARG 26 -14.624 -6.932 0.590
485 HB3 ARG 26 HB2 ARG 26 -13.226 -7.672 -0.161
486 HG2 ARG 26 HG3 ARG 26 -11.990 -5.545 0.233
487 HG3 ARG 26 HG2 ARG 26 -13.378 -4.955 1.150
488 HD2 ARG 26 HD2 ARG 26 -11.707 -7.392 1.759
489 HD3 ARG 26 HD1 ARG 26 -11.712 -5.872 2.650
490 HE ARG 26 HE ARG 26 -14.295 -6.688 2.769
491 HH11 ARG 26 HH11 ARG 26 -11.249 -8.224 3.552
492 HH12 ARG 26 HH12 ARG 26 -11.927 -9.218 4.801
493 HH21 ARG 26 HH21 ARG 26 -15.186 -7.990 4.407
494 HH22 ARG 26 HH22 ARG 26 -14.164 -9.072 5.299
495 H LEU 27 H LEU 27 -13.903 -3.752 -0.605
496 HA LEU 27 HA LEU 27 -16.595 -3.145 0.017
497 HB2 LEU 27 HB3 LEU 27 -14.308 -1.286 -0.585
498 HB3 LEU 27 HB2 LEU 27 -15.847 -0.825 0.105
499 HG LEU 27 HG LEU 27 -14.137 -2.839 1.469
500 HD11 LEU 27 HD11 LEU 27 -13.133 -1.067 2.759
501 HD12 LEU 27 HD12 LEU 27 -14.001 0.137 1.804
502 HD13 LEU 27 HD13 LEU 27 -12.768 -0.870 1.044
503 HD21 LEU 27 HD21 LEU 27 -15.338 -1.903 3.441
504 HD22 LEU 27 HD22 LEU 27 -16.394 -2.677 2.260
505 HD23 LEU 27 HD23 LEU 27 -16.285 -0.917 2.323
506 H LYS 28 H LYS 28 -14.611 -2.516 -2.840
507 HA LYS 28 HA LYS 28 -16.283 -0.896 -4.282
508 HB2 LYS 28 HB3 LYS 28 -14.019 -1.679 -4.998
509 HB3 LYS 28 HB2 LYS 28 -14.747 -3.211 -5.463
510 HG2 LYS 28 HG3 LYS 28 -14.538 -1.922 -7.433
511 HG3 LYS 28 HG2 LYS 28 -16.250 -1.920 -7.001
512 HD2 LYS 28 HD3 LYS 28 -15.810 0.292 -5.840
513 HD3 LYS 28 HD2 LYS 28 -14.237 0.290 -6.637
514 HE2 LYS 28 HE3 LYS 28 -16.963 0.357 -7.915
515 HE3 LYS 28 HE2 LYS 28 -15.708 1.593 -7.979
516 HZ1 LYS 28 HZ1 LYS 28 -14.320 -0.089 -9.182
517 HZ2 LYS 28 HZ2 LYS 28 -15.678 0.452 -10.031
518 HZ3 LYS 28 HZ3 LYS 28 -15.702 -1.068 -9.289
519 H LYS 29 H LYS 29 -16.382 -4.467 -4.245
520 HA LYS 29 HA LYS 29 -18.674 -4.557 -5.934
521 HB2 LYS 29 HB3 LYS 29 -18.688 -6.966 -5.408
522 HB3 LYS 29 HB2 LYS 29 -17.130 -6.384 -5.962
523 HG2 LYS 29 HG3 LYS 29 -16.423 -6.268 -3.559
524 HG3 LYS 29 HG2 LYS 29 -17.933 -7.080 -3.148
525 HD2 LYS 29 HD3 LYS 29 -15.836 -8.179 -5.017
526 HD3 LYS 29 HD2 LYS 29 -16.005 -8.626 -3.321
527 HE2 LYS 29 HE3 LYS 29 -18.135 -8.990 -5.422
528 HE3 LYS 29 HE2 LYS 29 -17.035 -10.254 -4.882
529 HZ1 LYS 29 HZ1 LYS 29 -19.150 -10.428 -3.764
530 HZ2 LYS 29 HZ2 LYS 29 -19.030 -8.840 -3.196
531 HZ3 LYS 29 HZ3 LYS 29 -17.950 -10.016 -2.645
532 H LEU 30 H LEU 30 -18.224 -4.227 -2.531
533 HA LEU 30 HA LEU 30 -20.863 -4.955 -1.735
534 HB2 LEU 30 HB3 LEU 30 -18.669 -3.336 -0.504
535 HB3 LEU 30 HB2 LEU 30 -20.264 -3.350 0.224
536 HG LEU 30 HG LEU 30 -18.602 -5.822 -0.268
537 HD11 LEU 30 HD11 LEU 30 -18.995 -4.192 2.236
538 HD12 LEU 30 HD12 LEU 30 -17.487 -4.428 1.353
539 HD13 LEU 30 HD13 LEU 30 -18.249 -5.787 2.175
540 HD21 LEU 30 HD21 LEU 30 -21.009 -6.232 -0.182
541 HD22 LEU 30 HD22 LEU 30 -21.106 -5.371 1.353
542 HD23 LEU 30 HD23 LEU 30 -20.201 -6.881 1.244
543 H VAL 31 H VAL 31 -19.381 -2.055 -3.004
544 HA VAL 31 HA VAL 31 -21.755 -0.468 -2.501
545 HB VAL 31 HB VAL 31 -19.342 0.347 -4.130
546 HG11 VAL 31 HG11 VAL 31 -21.389 1.725 -4.365
547 HG12 VAL 31 HG12 VAL 31 -20.035 2.601 -3.656
548 HG13 VAL 31 HG13 VAL 31 -21.348 2.027 -2.627
549 HG21 VAL 31 HG21 VAL 31 -19.815 0.697 -1.173
550 HG22 VAL 31 HG22 VAL 31 -18.479 1.387 -2.097
551 HG23 VAL 31 HG23 VAL 31 -18.614 -0.363 -1.914
552 H GLY 32 H GLY 32 -20.328 -2.273 -5.148
553 HA2 GLY 32 HA3 GLY 32 -22.602 -2.659 -6.574
554 HA3 GLY 32 HA2 GLY 32 -22.063 -1.087 -7.130
555 H GLU 33 H GLU 33 -19.288 -2.716 -6.424
556 HA GLU 33 HA GLU 33 -17.718 -3.859 -7.578
557 HB2 GLU 33 HB3 GLU 33 -19.384 -5.595 -7.974
558 HB3 GLU 33 HB2 GLU 33 -20.002 -4.711 -9.364
559 HG2 GLU 33 HG3 GLU 33 -17.855 -4.997 -10.496
560 HG3 GLU 33 HG2 GLU 33 -17.247 -5.893 -9.106
Start of MODEL 5
1 H1 GLY 1 H1 GLY 1 24.908 5.832 -3.010
2 H2 GLY 1 H2 GLY 1 25.540 5.365 -4.505
3 H3 GLY 1 H3 GLY 1 26.482 5.227 -3.107
4 HA2 GLY 1 HA2 GLY 1 25.645 3.067 -3.785
5 HA3 GLY 1 HA3 GLY 1 25.008 3.551 -2.221
6 H SER 2 H SER 2 23.618 1.643 -3.414
7 HA SER 2 HA SER 2 21.486 2.881 -4.975
8 HB2 SER 2 HB3 SER 2 21.971 -0.021 -4.263
9 HB3 SER 2 HB2 SER 2 20.694 0.569 -5.327
10 HG SER 2 HG SER 2 23.245 1.428 -5.957
11 H MET 3 H MET 3 22.181 2.343 -1.766
12 HA MET 3 HA MET 3 19.705 1.477 -0.734
13 HB2 MET 3 HB3 MET 3 21.781 1.481 0.593
14 HB3 MET 3 HB2 MET 3 21.804 3.238 0.556
15 HG2 MET 3 HG3 MET 3 19.696 3.284 1.803
16 HG3 MET 3 HG2 MET 3 19.707 1.522 1.864
17 HE1 MET 3 HE1 MET 3 19.436 1.669 4.523
18 HE2 MET 3 HE2 MET 3 19.455 3.429 4.428
19 HE3 MET 3 HE3 MET 3 20.520 2.596 5.560
20 H LYS 4 H LYS 4 20.988 4.674 -1.487
21 HA LYS 4 HA LYS 4 18.855 6.195 -0.460
22 HB2 LYS 4 HB3 LYS 4 21.014 7.188 -1.049
23 HB3 LYS 4 HB2 LYS 4 20.744 6.811 -2.742
24 HG2 LYS 4 HG3 LYS 4 20.331 9.163 -2.278
25 HG3 LYS 4 HG2 LYS 4 18.860 8.347 -2.803
26 HD2 LYS 4 HD3 LYS 4 18.359 9.826 -0.959
27 HD3 LYS 4 HD2 LYS 4 18.158 8.153 -0.444
28 HE2 LYS 4 HE3 LYS 4 19.286 9.442 1.276
29 HE3 LYS 4 HE2 LYS 4 20.373 8.225 0.611
30 HZ1 LYS 4 HZ1 LYS 4 21.414 9.925 -0.734
31 HZ2 LYS 4 HZ2 LYS 4 21.466 10.366 0.896
32 HZ3 LYS 4 HZ3 LYS 4 20.349 11.097 -0.142
33 H GLN 5 H GLN 5 19.354 4.586 -3.534
34 HA GLN 5 HA GLN 5 17.117 5.699 -4.865
35 HB2 GLN 5 HB3 GLN 5 18.489 3.042 -5.326
36 HB3 GLN 5 HB2 GLN 5 17.370 3.821 -6.437
37 HG2 GLN 5 HG3 GLN 5 20.057 4.875 -5.589
38 HG3 GLN 5 HG2 GLN 5 19.663 4.149 -7.145
39 HE21 GLN 5 HE21 GLN 5 20.698 6.806 -6.497
40 HE22 GLN 5 HE22 GLN 5 19.577 7.931 -7.178
41 H LEU 6 H LEU 6 17.612 2.761 -2.964
42 HA LEU 6 HA LEU 6 14.999 1.744 -3.221
43 HB2 LEU 6 HB3 LEU 6 17.318 1.244 -1.462
44 HB3 LEU 6 HB2 LEU 6 15.757 0.760 -0.831
45 HG LEU 6 HG LEU 6 16.894 -1.103 -1.931
46 HD11 LEU 6 HD11 LEU 6 14.443 -0.998 -1.938
47 HD12 LEU 6 HD12 LEU 6 15.080 -1.825 -3.358
48 HD13 LEU 6 HD13 LEU 6 14.493 -0.168 -3.494
49 HD21 LEU 6 HD21 LEU 6 16.729 0.583 -4.425
50 HD22 LEU 6 HD22 LEU 6 17.243 -1.102 -4.350
51 HD23 LEU 6 HD23 LEU 6 18.203 0.149 -3.560
52 H GLU 7 H GLU 7 16.339 4.226 -1.172
53 HA GLU 7 HA GLU 7 14.281 4.386 0.737
54 HB2 GLU 7 HB3 GLU 7 15.953 6.622 -0.431
55 HB3 GLU 7 HB2 GLU 7 14.962 6.752 1.013
56 HG2 GLU 7 HG3 GLU 7 17.356 4.963 0.658
57 HG3 GLU 7 HG2 GLU 7 17.299 6.466 1.576
58 H ASP 8 H ASP 8 14.545 5.555 -2.554
59 HA ASP 8 HA ASP 8 12.152 7.117 -2.488
60 HB2 ASP 8 HB3 ASP 8 13.777 6.017 -4.787
61 HB3 ASP 8 HB2 ASP 8 12.348 7.021 -5.005
62 H LYS 9 H LYS 9 12.977 3.821 -3.370
63 HA LYS 9 HA LYS 9 10.528 3.059 -4.512
64 HB2 LYS 9 HB3 LYS 9 12.768 1.562 -3.205
65 HB3 LYS 9 HB2 LYS 9 11.275 0.717 -3.570
66 HG2 LYS 9 HG3 LYS 9 12.860 0.351 -5.332
67 HG3 LYS 9 HG2 LYS 9 11.532 1.337 -5.940
68 HD2 LYS 9 HD3 LYS 9 12.857 3.306 -5.881
69 HD3 LYS 9 HD2 LYS 9 14.128 2.501 -4.961
70 HE2 LYS 9 HE3 LYS 9 14.761 2.761 -7.303
71 HE3 LYS 9 HE2 LYS 9 14.610 1.061 -6.867
72 HZ1 LYS 9 HZ1 LYS 9 12.541 2.644 -8.289
73 HZ2 LYS 9 HZ2 LYS 9 12.458 0.998 -7.924
74 HZ3 LYS 9 HZ3 LYS 9 13.610 1.563 -9.021
75 H VAL 10 H VAL 10 11.724 2.615 -1.182
76 HA VAL 10 HA VAL 10 9.374 1.384 -0.252
77 HB VAL 10 HB VAL 10 11.519 1.161 0.918
78 HG11 VAL 10 HG11 VAL 10 11.097 4.022 1.766
79 HG12 VAL 10 HG12 VAL 10 12.364 3.424 0.696
80 HG13 VAL 10 HG13 VAL 10 12.339 2.935 2.390
81 HG21 VAL 10 HG21 VAL 10 9.486 0.644 2.123
82 HG22 VAL 10 HG22 VAL 10 9.314 2.329 2.609
83 HG23 VAL 10 HG23 VAL 10 10.664 1.371 3.215
84 H GLU 11 H GLU 11 10.349 4.788 -0.334
85 HA GLU 11 HA GLU 11 8.100 5.680 1.193
86 HB2 GLU 11 HB3 GLU 11 10.020 7.157 -0.603
87 HB3 GLU 11 HB2 GLU 11 8.745 7.947 0.315
88 HG2 GLU 11 HG3 GLU 11 9.728 7.111 2.389
89 HG3 GLU 11 HG2 GLU 11 11.013 6.338 1.465
90 H GLU 12 H GLU 12 8.785 5.278 -2.233
91 HA GLU 12 HA GLU 12 6.517 6.549 -3.267
92 HB2 GLU 12 HB3 GLU 12 8.383 5.775 -4.668
93 HB3 GLU 12 HB2 GLU 12 7.931 4.106 -4.350
94 HG2 GLU 12 HG3 GLU 12 5.800 4.460 -5.468
95 HG3 GLU 12 HG2 GLU 12 6.231 6.142 -5.770
96 H LEU 13 H LEU 13 6.934 3.049 -2.604
97 HA LEU 13 HA LEU 13 4.162 2.556 -2.943
98 HB2 LEU 13 HB3 LEU 13 6.343 0.850 -1.770
99 HB3 LEU 13 HB2 LEU 13 4.668 0.335 -1.817
100 HG LEU 13 HG LEU 13 4.802 0.856 -4.343
101 HD11 LEU 13 HD11 LEU 13 6.952 1.988 -4.319
102 HD12 LEU 13 HD12 LEU 13 7.009 0.544 -5.330
103 HD13 LEU 13 HD13 LEU 13 7.730 0.523 -3.721
104 HD21 LEU 13 HD21 LEU 13 5.710 -1.413 -4.775
105 HD22 LEU 13 HD22 LEU 13 4.475 -1.361 -3.518
106 HD23 LEU 13 HD23 LEU 13 6.177 -1.502 -3.077
107 H LEU 14 H LEU 14 6.043 3.465 -0.121
108 HA LEU 14 HA LEU 14 4.111 2.995 1.832
109 HB2 LEU 14 HB3 LEU 14 6.382 3.736 2.351
110 HB3 LEU 14 HB2 LEU 14 6.092 5.274 1.582
111 HG LEU 14 HG LEU 14 6.116 5.249 4.098
112 HD11 LEU 14 HD11 LEU 14 5.208 7.114 2.846
113 HD12 LEU 14 HD12 LEU 14 4.287 6.833 4.324
114 HD13 LEU 14 HD13 LEU 14 3.640 6.312 2.768
115 HD21 LEU 14 HD21 LEU 14 4.846 3.183 4.423
116 HD22 LEU 14 HD22 LEU 14 3.416 3.967 3.751
117 HD23 LEU 14 HD23 LEU 14 4.111 4.548 5.262
118 H SER 15 H SER 15 4.520 5.662 -0.426
119 HA SER 15 HA SER 15 2.214 7.101 0.380
120 HB2 SER 15 HB3 SER 15 3.583 7.128 -2.322
121 HB3 SER 15 HB2 SER 15 2.554 8.389 -1.643
122 HG SER 15 HG SER 15 5.134 7.576 -0.782
123 H LYS 16 H LYS 16 2.849 4.520 -1.920
124 HA LYS 16 HA LYS 16 0.389 4.542 -3.268
125 HB2 LYS 16 HB3 LYS 16 2.406 3.301 -4.004
126 HB3 LYS 16 HB2 LYS 16 2.163 2.166 -2.687
127 HG2 LYS 16 HG3 LYS 16 0.144 1.360 -3.646
128 HG3 LYS 16 HG2 LYS 16 0.133 2.650 -4.852
129 HD2 LYS 16 HD3 LYS 16 2.156 1.748 -5.863
130 HD3 LYS 16 HD2 LYS 16 2.232 0.491 -4.626
131 HE2 LYS 16 HE3 LYS 16 0.179 -0.476 -5.411
132 HE3 LYS 16 HE2 LYS 16 -0.062 0.849 -6.547
133 HZ1 LYS 16 HZ1 LYS 16 0.809 -1.168 -7.600
134 HZ2 LYS 16 HZ2 LYS 16 2.201 -1.074 -6.645
135 HZ3 LYS 16 HZ3 LYS 16 1.864 0.142 -7.771
136 H ASN 17 H ASN 17 1.408 2.510 -0.470
137 HA ASN 17 HA ASN 17 -1.187 1.406 -0.138
138 HB2 ASN 17 HB3 ASN 17 -0.422 0.488 1.957
139 HB3 ASN 17 HB2 ASN 17 0.862 0.319 0.768
140 HD21 ASN 17 HD21 ASN 17 -0.194 2.032 3.623
141 HD22 ASN 17 HD22 ASN 17 1.358 2.654 4.055
142 H TYR 18 H TYR 18 0.309 4.338 0.940
143 HA TYR 18 HA TYR 18 -1.501 5.035 2.985
144 HB2 TYR 18 HB3 TYR 18 0.629 6.213 2.626
145 HB3 TYR 18 HB2 TYR 18 0.038 6.825 1.087
146 HD1 TYR 18 HD1 TYR 18 -0.567 6.942 4.747
147 HD2 TYR 18 HD2 TYR 18 -1.182 8.828 0.985
148 HE1 TYR 18 HE1 TYR 18 -1.454 8.926 5.893
149 HE2 TYR 18 HE2 TYR 18 -2.073 10.817 2.121
150 HH TYR 18 HH TYR 18 -3.126 11.387 4.276
151 H HIS 19 H HIS 19 -1.442 5.871 -0.472
152 HA HIS 19 HA HIS 19 -3.948 7.204 -0.444
153 HB2 HIS 19 HB3 HIS 19 -2.351 6.009 -2.716
154 HB3 HIS 19 HB2 HIS 19 -3.831 6.933 -2.948
155 HD1 HIS 19 HD1 HIS 19 -0.352 7.401 -3.127
156 HD2 HIS 19 HD2 HIS 19 -3.464 9.605 -1.473
157 HE1 HIS 19 HE1 HIS 19 0.528 9.741 -2.894
158 HE2 HIS 19 HE2 HIS 19 -1.414 11.083 -2.012
159 H LEU 20 H LEU 20 -2.974 3.886 -0.983
160 HA LEU 20 HA LEU 20 -5.478 2.907 -1.856
161 HB2 LEU 20 HB3 LEU 20 -2.916 1.819 -1.027
162 HB3 LEU 20 HB2 LEU 20 -4.251 0.835 -0.477
163 HG LEU 20 HG LEU 20 -3.334 0.072 -2.637
164 HD11 LEU 20 HD11 LEU 20 -6.139 1.154 -2.804
165 HD12 LEU 20 HD12 LEU 20 -5.660 -0.384 -2.086
166 HD13 LEU 20 HD13 LEU 20 -5.459 -0.117 -3.819
167 HD21 LEU 20 HD21 LEU 20 -4.337 2.717 -3.675
168 HD22 LEU 20 HD22 LEU 20 -3.718 1.388 -4.654
169 HD23 LEU 20 HD23 LEU 20 -2.646 2.234 -3.536
170 H GLU 21 H GLU 21 -4.036 3.314 1.348
171 HA GLU 21 HA GLU 21 -6.096 2.111 2.842
172 HB2 GLU 21 HB3 GLU 21 -3.794 2.820 3.657
173 HB3 GLU 21 HB2 GLU 21 -4.407 4.464 3.715
174 HG2 GLU 21 HG3 GLU 21 -5.757 2.250 5.208
175 HG3 GLU 21 HG2 GLU 21 -4.360 3.088 5.877
176 H ASN 22 H ASN 22 -5.583 5.425 1.745
177 HA ASN 22 HA ASN 22 -7.915 6.563 2.822
178 HB2 ASN 22 HB3 ASN 22 -6.439 7.321 0.291
179 HB3 ASN 22 HB2 ASN 22 -7.633 8.321 1.109
180 HD21 ASN 22 HD21 ASN 22 -6.667 7.558 3.777
181 HD22 ASN 22 HD22 ASN 22 -5.185 8.420 3.997
182 H GLU 23 H GLU 23 -7.361 4.542 0.092
183 HA GLU 23 HA GLU 23 -9.750 5.200 -1.337
184 HB2 GLU 23 HB3 GLU 23 -7.600 4.341 -2.354
185 HB3 GLU 23 HB2 GLU 23 -7.998 2.754 -1.662
186 HG2 GLU 23 HG3 GLU 23 -8.634 2.771 -3.957
187 HG3 GLU 23 HG2 GLU 23 -10.099 2.780 -2.978
188 H VAL 24 H VAL 24 -8.743 2.647 0.901
189 HA VAL 24 HA VAL 24 -11.158 1.149 0.681
190 HB VAL 24 HB VAL 24 -9.237 1.199 3.028
191 HG11 VAL 24 HG11 VAL 24 -10.132 -0.979 3.569
192 HG12 VAL 24 HG12 VAL 24 -11.174 -0.949 2.148
193 HG13 VAL 24 HG13 VAL 24 -11.456 0.182 3.475
194 HG21 VAL 24 HG21 VAL 24 -8.081 0.673 0.942
195 HG22 VAL 24 HG22 VAL 24 -9.253 -0.603 0.613
196 HG23 VAL 24 HG23 VAL 24 -8.175 -0.731 2.003
197 H ALA 25 H ALA 25 -10.044 3.750 2.774
198 HA ALA 25 HA ALA 25 -12.102 3.590 4.688
199 HB1 ALA 25 HB1 ALA 25 -9.964 4.788 5.014
200 HB2 ALA 25 HB2 ALA 25 -11.380 5.743 5.450
201 HB3 ALA 25 HB3 ALA 25 -10.547 6.050 3.928
202 H ARG 26 H ARG 26 -11.889 5.409 1.653
203 HA ARG 26 HA ARG 26 -14.258 6.887 2.073
204 HB2 ARG 26 HB3 ARG 26 -14.178 7.114 -0.479
205 HB3 ARG 26 HB2 ARG 26 -12.877 7.819 0.459
206 HG2 ARG 26 HG3 ARG 26 -11.482 5.872 -0.066
207 HG3 ARG 26 HG2 ARG 26 -12.789 5.207 -1.050
208 HD2 ARG 26 HD2 ARG 26 -11.512 7.899 -1.511
209 HD3 ARG 26 HD1 ARG 26 -11.031 6.421 -2.340
210 HE ARG 26 HE ARG 26 -13.800 6.801 -2.649
211 HH11 ARG 26 HH11 ARG 26 -10.766 8.213 -3.668
212 HH12 ARG 26 HH12 ARG 26 -11.386 8.754 -5.195
213 HH21 ARG 26 HH21 ARG 26 -14.621 7.507 -4.661
214 HH22 ARG 26 HH22 ARG 26 -13.582 8.359 -5.757
215 H LEU 27 H LEU 27 -13.624 3.813 0.427
216 HA LEU 27 HA LEU 27 -16.276 3.397 -0.438
217 HB2 LEU 27 HB3 LEU 27 -13.947 1.593 0.028
218 HB3 LEU 27 HB2 LEU 27 -15.531 0.891 -0.203
219 HG LEU 27 HG LEU 27 -15.723 1.941 -2.389
220 HD11 LEU 27 HD11 LEU 27 -14.419 3.955 -1.981
221 HD12 LEU 27 HD12 LEU 27 -13.824 3.094 -3.402
222 HD13 LEU 27 HD13 LEU 27 -12.947 2.990 -1.875
223 HD21 LEU 27 HD21 LEU 27 -13.172 0.409 -1.973
224 HD22 LEU 27 HD22 LEU 27 -13.952 0.676 -3.531
225 HD23 LEU 27 HD23 LEU 27 -14.774 -0.260 -2.285
226 H LYS 28 H LYS 28 -14.674 2.751 2.625
227 HA LYS 28 HA LYS 28 -16.597 1.197 3.880
228 HB2 LYS 28 HB3 LYS 28 -14.829 3.369 4.998
229 HB3 LYS 28 HB2 LYS 28 -15.856 2.363 6.009
230 HG2 LYS 28 HG3 LYS 28 -13.673 1.338 4.206
231 HG3 LYS 28 HG2 LYS 28 -13.523 1.597 5.944
232 HD2 LYS 28 HD3 LYS 28 -15.391 -0.007 6.286
233 HD3 LYS 28 HD2 LYS 28 -15.379 -0.331 4.553
234 HE2 LYS 28 HE3 LYS 28 -14.133 -2.045 5.713
235 HE3 LYS 28 HE2 LYS 28 -13.038 -1.074 4.731
236 HZ1 LYS 28 HZ1 LYS 28 -12.138 -1.527 6.932
237 HZ2 LYS 28 HZ2 LYS 28 -13.456 -0.751 7.652
238 HZ3 LYS 28 HZ3 LYS 28 -12.373 0.130 6.700
239 H LYS 29 H LYS 29 -16.560 4.687 3.349
240 HA LYS 29 HA LYS 29 -18.906 5.178 4.879
241 HB2 LYS 29 HB3 LYS 29 -17.419 6.978 4.599
242 HB3 LYS 29 HB2 LYS 29 -17.394 6.809 2.852
243 HG2 LYS 29 HG3 LYS 29 -19.706 7.585 2.750
244 HG3 LYS 29 HG2 LYS 29 -19.739 7.734 4.507
245 HD2 LYS 29 HD3 LYS 29 -17.944 9.397 4.395
246 HD3 LYS 29 HD2 LYS 29 -17.918 9.248 2.637
247 HE2 LYS 29 HE3 LYS 29 -20.207 10.057 2.515
248 HE3 LYS 29 HE2 LYS 29 -20.289 10.145 4.272
249 HZ1 LYS 29 HZ1 LYS 29 -18.547 11.814 4.234
250 HZ2 LYS 29 HZ2 LYS 29 -19.869 12.307 3.303
251 HZ3 LYS 29 HZ3 LYS 29 -18.470 11.733 2.545
252 H LEU 30 H LEU 30 -18.289 4.322 1.557
253 HA LEU 30 HA LEU 30 -20.955 4.827 0.662
254 HB2 LEU 30 HB3 LEU 30 -18.826 3.026 -0.480
255 HB3 LEU 30 HB2 LEU 30 -20.334 3.434 -1.268
256 HG LEU 30 HG LEU 30 -18.130 5.378 -0.585
257 HD11 LEU 30 HD11 LEU 30 -17.849 5.515 -3.022
258 HD12 LEU 30 HD12 LEU 30 -19.036 4.227 -3.219
259 HD13 LEU 30 HD13 LEU 30 -17.508 3.902 -2.399
260 HD21 LEU 30 HD21 LEU 30 -19.443 6.977 -1.915
261 HD22 LEU 30 HD22 LEU 30 -20.304 6.451 -0.470
262 HD23 LEU 30 HD23 LEU 30 -20.738 5.788 -2.044
263 H VAL 31 H VAL 31 -19.250 2.129 2.092
264 HA VAL 31 HA VAL 31 -21.371 0.255 1.660
265 HB VAL 31 HB VAL 31 -18.990 0.053 3.526
266 HG11 VAL 31 HG11 VAL 31 -19.428 -2.344 3.526
267 HG12 VAL 31 HG12 VAL 31 -20.858 -2.094 2.526
268 HG13 VAL 31 HG13 VAL 31 -20.810 -1.456 4.169
269 HG21 VAL 31 HG21 VAL 31 -18.036 -1.369 1.760
270 HG22 VAL 31 HG22 VAL 31 -18.294 0.291 1.224
271 HG23 VAL 31 HG23 VAL 31 -19.411 -0.978 0.726
272 H GLY 32 H GLY 32 -20.495 2.488 4.258
273 HA2 GLY 32 HA3 GLY 32 -23.091 2.360 5.359
274 HA3 GLY 32 HA2 GLY 32 -22.022 1.345 6.305
275 H GLU 33 H GLU 33 -20.878 4.311 4.788
276 HA GLU 33 HA GLU 33 -20.173 6.286 5.634
277 HB2 GLU 33 HB3 GLU 33 -22.492 5.840 7.511
278 HB3 GLU 33 HB2 GLU 33 -21.633 7.363 7.330
279 HG2 GLU 33 HG3 GLU 33 -22.320 7.511 5.015
280 HG3 GLU 33 HG2 GLU 33 -23.110 5.940 5.128
281 H1 GLY 1 H1 GLY 1 24.926 -6.049 2.315
282 H2 GLY 1 H2 GLY 1 25.576 -5.571 3.798
283 H3 GLY 1 H3 GLY 1 26.504 -5.451 2.391
284 HA2 GLY 1 HA2 GLY 1 25.679 -3.285 3.063
285 HA3 GLY 1 HA3 GLY 1 25.038 -3.778 1.503
286 H SER 2 H SER 2 23.656 -1.860 2.705
287 HA SER 2 HA SER 2 21.523 -3.089 4.273
288 HB2 SER 2 HB3 SER 2 22.034 -0.191 3.563
289 HB3 SER 2 HB2 SER 2 20.737 -0.768 4.611
290 HG SER 2 HG SER 2 23.312 -1.619 5.234
291 H MET 3 H MET 3 22.210 -2.543 1.062
292 HA MET 3 HA MET 3 19.730 -1.690 0.037
293 HB2 MET 3 HB3 MET 3 21.803 -1.712 -1.297
294 HB3 MET 3 HB2 MET 3 21.811 -3.469 -1.252
295 HG2 MET 3 HG3 MET 3 19.701 -3.505 -2.493
296 HG3 MET 3 HG2 MET 3 19.718 -1.744 -2.556
297 HE1 MET 3 HE1 MET 3 19.435 -1.902 -5.220
298 HE2 MET 3 HE2 MET 3 19.451 -3.662 -5.110
299 HE3 MET 3 HE3 MET 3 20.514 -2.840 -6.252
300 H LYS 4 H LYS 4 21.013 -4.895 0.786
301 HA LYS 4 HA LYS 4 18.863 -6.407 -0.212
302 HB2 LYS 4 HB3 LYS 4 21.019 -7.411 0.373
303 HB3 LYS 4 HB2 LYS 4 20.755 -7.025 2.066
304 HG2 LYS 4 HG3 LYS 4 20.321 -9.375 1.616
305 HG3 LYS 4 HG2 LYS 4 18.855 -8.547 2.134
306 HD2 LYS 4 HD3 LYS 4 18.350 -10.034 0.295
307 HD3 LYS 4 HD2 LYS 4 18.159 -8.363 -0.226
308 HE2 LYS 4 HE3 LYS 4 19.285 -9.661 -1.938
309 HE3 LYS 4 HE2 LYS 4 20.375 -8.448 -1.275
310 HZ1 LYS 4 HZ1 LYS 4 21.401 -10.154 0.086
311 HZ2 LYS 4 HZ2 LYS 4 21.461 -10.593 -1.544
312 HZ3 LYS 4 HZ3 LYS 4 20.334 -11.319 -0.516
313 H GLN 5 H GLN 5 19.382 -4.788 2.856
314 HA GLN 5 HA GLN 5 17.147 -5.889 4.198
315 HB2 GLN 5 HB3 GLN 5 18.523 -3.230 4.642
316 HB3 GLN 5 HB2 GLN 5 17.410 -4.007 5.762
317 HG2 GLN 5 HG3 GLN 5 20.095 -5.066 4.903
318 HG3 GLN 5 HG2 GLN 5 19.711 -4.328 6.457
319 HE21 GLN 5 HE21 GLN 5 20.736 -6.997 5.808
320 HE22 GLN 5 HE22 GLN 5 19.619 -8.114 6.511
321 H LEU 6 H LEU 6 17.642 -2.957 2.286
322 HA LEU 6 HA LEU 6 15.032 -1.934 2.548
323 HB2 LEU 6 HB3 LEU 6 17.343 -1.448 0.777
324 HB3 LEU 6 HB2 LEU 6 15.781 -0.962 0.151
325 HG LEU 6 HG LEU 6 16.930 0.902 1.239
326 HD11 LEU 6 HD11 LEU 6 14.478 0.804 1.254
327 HD12 LEU 6 HD12 LEU 6 15.122 1.637 2.668
328 HD13 LEU 6 HD13 LEU 6 14.531 -0.018 2.815
329 HD21 LEU 6 HD21 LEU 6 16.767 -0.771 3.742
330 HD22 LEU 6 HD22 LEU 6 17.289 0.911 3.656
331 HD23 LEU 6 HD23 LEU 6 18.240 -0.348 2.870
332 H GLU 7 H GLU 7 16.354 -4.429 0.509
333 HA GLU 7 HA GLU 7 14.291 -4.589 -1.395
334 HB2 GLU 7 HB3 GLU 7 15.963 -6.825 -0.228
335 HB3 GLU 7 HB2 GLU 7 14.963 -6.959 -1.665
336 HG2 GLU 7 HG3 GLU 7 17.361 -5.174 -1.330
337 HG3 GLU 7 HG2 GLU 7 17.299 -6.679 -2.244
338 H ASP 8 H ASP 8 14.559 -5.740 1.902
339 HA ASP 8 HA ASP 8 12.157 -7.297 1.844
340 HB2 ASP 8 HB3 ASP 8 13.798 -6.200 4.133
341 HB3 ASP 8 HB2 ASP 8 12.366 -7.199 4.361
342 H LYS 9 H LYS 9 13.005 -4.005 2.721
343 HA LYS 9 HA LYS 9 10.564 -3.223 3.866
344 HB2 LYS 9 HB3 LYS 9 12.803 -1.741 2.539
345 HB3 LYS 9 HB2 LYS 9 11.315 -0.890 2.911
346 HG2 LYS 9 HG3 LYS 9 12.914 -0.523 4.662
347 HG3 LYS 9 HG2 LYS 9 11.586 -1.502 5.280
348 HD2 LYS 9 HD3 LYS 9 12.901 -3.476 5.224
349 HD3 LYS 9 HD2 LYS 9 14.172 -2.680 4.294
350 HE2 LYS 9 HE3 LYS 9 14.813 -2.930 6.635
351 HE3 LYS 9 HE2 LYS 9 14.665 -1.232 6.191
352 HZ1 LYS 9 HZ1 LYS 9 12.599 -2.810 7.624
353 HZ2 LYS 9 HZ2 LYS 9 12.511 -1.164 7.247
354 HZ3 LYS 9 HZ3 LYS 9 13.667 -1.717 8.347
355 H VAL 10 H VAL 10 11.748 -2.799 0.528
356 HA VAL 10 HA VAL 10 9.398 -1.567 -0.397
357 HB VAL 10 HB VAL 10 11.536 -1.355 -1.578
358 HG11 VAL 10 HG11 VAL 10 11.105 -4.218 -2.414
359 HG12 VAL 10 HG12 VAL 10 12.377 -3.620 -1.348
360 HG13 VAL 10 HG13 VAL 10 12.348 -3.137 -3.044
361 HG21 VAL 10 HG21 VAL 10 9.498 -0.836 -2.772
362 HG22 VAL 10 HG22 VAL 10 9.320 -2.524 -3.253
363 HG23 VAL 10 HG23 VAL 10 10.668 -1.568 -3.869
364 H GLU 11 H GLU 11 10.357 -4.973 -0.301
365 HA GLU 11 HA GLU 11 8.100 -5.866 -1.817
366 HB2 GLU 11 HB3 GLU 11 10.024 -7.340 -0.021
367 HB3 GLU 11 HB2 GLU 11 8.744 -8.130 -0.934
368 HG2 GLU 11 HG3 GLU 11 9.720 -7.307 -3.009
369 HG3 GLU 11 HG2 GLU 11 11.009 -6.528 -2.095
370 H GLU 12 H GLU 12 8.808 -5.464 1.606
371 HA GLU 12 HA GLU 12 6.537 -6.710 2.653
372 HB2 GLU 12 HB3 GLU 12 8.412 -5.933 4.046
373 HB3 GLU 12 HB2 GLU 12 7.959 -4.265 3.720
374 HG2 GLU 12 HG3 GLU 12 5.835 -4.604 4.855
375 HG3 GLU 12 HG2 GLU 12 6.254 -6.290 5.153
376 H LEU 13 H LEU 13 6.965 -3.211 1.975
377 HA LEU 13 HA LEU 13 4.194 -2.712 2.323
378 HB2 LEU 13 HB3 LEU 13 6.371 -1.013 1.132
379 HB3 LEU 13 HB2 LEU 13 4.698 -0.494 1.187
380 HG LEU 13 HG LEU 13 4.842 -1.007 3.713
381 HD11 LEU 13 HD11 LEU 13 6.991 -2.144 3.686
382 HD12 LEU 13 HD12 LEU 13 7.058 -0.695 4.688
383 HD13 LEU 13 HD13 LEU 13 7.770 -0.685 3.075
384 HD21 LEU 13 HD21 LEU 13 5.761 1.260 4.132
385 HD22 LEU 13 HD22 LEU 13 4.516 1.208 2.885
386 HD23 LEU 13 HD23 LEU 13 6.218 1.342 2.430
387 H LEU 14 H LEU 14 6.054 -3.641 -0.503
388 HA LEU 14 HA LEU 14 4.115 -3.165 -2.450
389 HB2 LEU 14 HB3 LEU 14 6.381 -3.916 -2.976
390 HB3 LEU 14 HB2 LEU 14 6.089 -5.449 -2.198
391 HG LEU 14 HG LEU 14 6.103 -5.435 -4.715
392 HD11 LEU 14 HD11 LEU 14 5.201 -7.294 -3.455
393 HD12 LEU 14 HD12 LEU 14 4.269 -7.015 -4.926
394 HD13 LEU 14 HD13 LEU 14 3.633 -6.490 -3.368
395 HD21 LEU 14 HD21 LEU 14 4.832 -3.370 -5.046
396 HD22 LEU 14 HD22 LEU 14 3.402 -4.148 -4.366
397 HD23 LEU 14 HD23 LEU 14 4.093 -4.737 -5.877
398 H SER 15 H SER 15 4.529 -5.820 -0.179
399 HA SER 15 HA SER 15 2.215 -7.257 -0.973
400 HB2 SER 15 HB3 SER 15 3.596 -7.285 1.723
401 HB3 SER 15 HB2 SER 15 2.559 -8.545 1.049
402 HG SER 15 HG SER 15 5.145 -7.744 0.202
403 H LYS 16 H LYS 16 2.868 -4.675 1.320
404 HA LYS 16 HA LYS 16 0.412 -4.684 2.671
405 HB2 LYS 16 HB3 LYS 16 2.434 -3.455 3.403
406 HB3 LYS 16 HB2 LYS 16 2.199 -2.323 2.081
407 HG2 LYS 16 HG3 LYS 16 0.183 -1.500 3.039
408 HG3 LYS 16 HG2 LYS 16 0.169 -2.782 4.252
409 HD2 LYS 16 HD3 LYS 16 2.201 -1.887 5.248
410 HD3 LYS 16 HD2 LYS 16 2.277 -0.636 4.006
411 HE2 LYS 16 HE3 LYS 16 0.229 0.340 4.795
412 HE3 LYS 16 HE2 LYS 16 -0.006 -0.976 5.943
413 HZ1 LYS 16 HZ1 LYS 16 0.880 1.045 6.979
414 HZ2 LYS 16 HZ2 LYS 16 2.262 0.940 6.009
415 HZ3 LYS 16 HZ3 LYS 16 1.934 -0.267 7.143
416 H ASN 17 H ASN 17 1.429 -2.669 -0.139
417 HA ASN 17 HA ASN 17 -1.164 -1.552 -0.462
418 HB2 ASN 17 HB3 ASN 17 -0.406 -0.645 -2.564
419 HB3 ASN 17 HB2 ASN 17 0.883 -0.475 -1.382
420 HD21 ASN 17 HD21 ASN 17 -0.189 -2.210 -4.224
421 HD22 ASN 17 HD22 ASN 17 1.362 -2.834 -4.657
422 H TYR 18 H TYR 18 0.317 -4.495 -1.543
423 HA TYR 18 HA TYR 18 -1.509 -5.192 -3.572
424 HB2 TYR 18 HB3 TYR 18 0.618 -6.373 -3.224
425 HB3 TYR 18 HB2 TYR 18 0.041 -6.977 -1.677
426 HD1 TYR 18 HD1 TYR 18 -0.585 -7.114 -5.332
427 HD2 TYR 18 HD2 TYR 18 -1.188 -8.981 -1.556
428 HE1 TYR 18 HE1 TYR 18 -1.483 -9.101 -6.465
429 HE2 TYR 18 HE2 TYR 18 -2.091 -10.972 -2.680
430 HH TYR 18 HH TYR 18 -3.157 -11.549 -4.821
431 H HIS 19 H HIS 19 -1.433 -6.013 -0.112
432 HA HIS 19 HA HIS 19 -3.944 -7.340 -0.122
433 HB2 HIS 19 HB3 HIS 19 -2.331 -6.147 2.139
434 HB3 HIS 19 HB2 HIS 19 -3.815 -7.063 2.378
435 HD1 HIS 19 HD1 HIS 19 -0.336 -7.541 2.534
436 HD2 HIS 19 HD2 HIS 19 -3.465 -9.752 0.922
437 HE1 HIS 19 HE1 HIS 19 0.536 -9.887 2.317
438 HE2 HIS 19 HE2 HIS 19 -1.420 -11.231 1.478
439 H LEU 20 H LEU 20 -2.956 -4.022 0.398
440 HA LEU 20 HA LEU 20 -5.452 -3.034 1.282
441 HB2 LEU 20 HB3 LEU 20 -2.893 -1.958 0.439
442 HB3 LEU 20 HB2 LEU 20 -4.226 -0.969 -0.112
443 HG LEU 20 HG LEU 20 -3.298 -0.203 2.042
444 HD11 LEU 20 HD11 LEU 20 -6.107 -1.275 2.224
445 HD12 LEU 20 HD12 LEU 20 -5.626 0.260 1.502
446 HD13 LEU 20 HD13 LEU 20 -5.417 -0.005 3.233
447 HD21 LEU 20 HD21 LEU 20 -4.309 -2.840 3.094
448 HD22 LEU 20 HD22 LEU 20 -3.681 -1.510 4.066
449 HD23 LEU 20 HD23 LEU 20 -2.616 -2.364 2.948
450 H GLU 21 H GLU 21 -4.031 -3.464 -1.923
451 HA GLU 21 HA GLU 21 -6.092 -2.254 -3.415
452 HB2 GLU 21 HB3 GLU 21 -3.797 -2.982 -4.231
453 HB3 GLU 21 HB2 GLU 21 -4.423 -4.619 -4.286
454 HG2 GLU 21 HG3 GLU 21 -5.760 -2.397 -5.775
455 HG3 GLU 21 HG2 GLU 21 -4.370 -3.242 -6.446
456 H ASN 22 H ASN 22 -5.588 -5.566 -2.306
457 HA ASN 22 HA ASN 22 -7.930 -6.700 -3.368
458 HB2 ASN 22 HB3 ASN 22 -6.446 -7.451 -0.840
459 HB3 ASN 22 HB2 ASN 22 -7.643 -8.452 -1.650
460 HD21 ASN 22 HD21 ASN 22 -6.682 -7.705 -4.323
461 HD22 ASN 22 HD22 ASN 22 -5.194 -8.560 -4.541
462 H GLU 23 H GLU 23 -7.353 -4.663 -0.660
463 HA GLU 23 HA GLU 23 -9.735 -5.311 0.789
464 HB2 GLU 23 HB3 GLU 23 -7.577 -4.453 1.792
465 HB3 GLU 23 HB2 GLU 23 -7.976 -2.869 1.099
466 HG2 GLU 23 HG3 GLU 23 -8.596 -2.886 3.402
467 HG3 GLU 23 HG2 GLU 23 -10.065 -2.881 2.427
468 H VAL 24 H VAL 24 -8.736 -2.773 -1.468
469 HA VAL 24 HA VAL 24 -11.144 -1.265 -1.237
470 HB VAL 24 HB VAL 24 -9.237 -1.332 -3.593
471 HG11 VAL 24 HG11 VAL 24 -10.121 0.848 -4.137
472 HG12 VAL 24 HG12 VAL 24 -11.158 0.828 -2.709
473 HG13 VAL 24 HG13 VAL 24 -11.452 -0.306 -4.031
474 HG21 VAL 24 HG21 VAL 24 -8.064 -0.804 -1.517
475 HG22 VAL 24 HG22 VAL 24 -9.229 0.479 -1.186
476 HG23 VAL 24 HG23 VAL 24 -8.160 0.597 -2.582
477 H ALA 25 H ALA 25 -10.046 -3.876 -3.329
478 HA ALA 25 HA ALA 25 -12.110 -3.720 -5.236
479 HB1 ALA 25 HB1 ALA 25 -9.976 -4.931 -5.559
480 HB2 ALA 25 HB2 ALA 25 -11.399 -5.881 -5.988
481 HB3 ALA 25 HB3 ALA 25 -10.565 -6.184 -4.465
482 H ARG 26 H ARG 26 -11.890 -5.522 -2.191
483 HA ARG 26 HA ARG 26 -14.263 -7.001 -2.597
484 HB2 ARG 26 HB3 ARG 26 -14.176 -7.223 -0.047
485 HB3 ARG 26 HB2 ARG 26 -12.877 -7.933 -0.983
486 HG2 ARG 26 HG3 ARG 26 -11.479 -5.984 -0.466
487 HG3 ARG 26 HG2 ARG 26 -12.786 -5.318 0.519
488 HD2 ARG 26 HD2 ARG 26 -11.511 -8.008 0.983
489 HD3 ARG 26 HD1 ARG 26 -11.018 -6.531 1.804
490 HE ARG 26 HE ARG 26 -13.790 -6.901 2.133
491 HH11 ARG 26 HH11 ARG 26 -10.757 -8.333 3.133
492 HH12 ARG 26 HH12 ARG 26 -11.363 -8.852 4.673
493 HH21 ARG 26 HH21 ARG 26 -14.594 -7.588 4.160
494 HH22 ARG 26 HH22 ARG 26 -13.549 -8.435 5.255
495 H LEU 27 H LEU 27 -13.612 -3.923 -0.959
496 HA LEU 27 HA LEU 27 -16.260 -3.496 -0.088
497 HB2 LEU 27 HB3 LEU 27 -13.931 -1.695 -0.570
498 HB3 LEU 27 HB2 LEU 27 -15.515 -0.994 -0.331
499 HG LEU 27 HG LEU 27 -15.694 -2.040 1.857
500 HD11 LEU 27 HD11 LEU 27 -14.394 -4.053 1.452
501 HD12 LEU 27 HD12 LEU 27 -13.788 -3.186 2.864
502 HD13 LEU 27 HD13 LEU 27 -12.922 -3.089 1.330
503 HD21 LEU 27 HD21 LEU 27 -13.148 -0.503 1.427
504 HD22 LEU 27 HD22 LEU 27 -13.921 -0.771 2.988
505 HD23 LEU 27 HD23 LEU 27 -14.751 0.162 1.744
506 H LYS 28 H LYS 28 -14.669 -2.859 -3.158
507 HA LYS 28 HA LYS 28 -16.594 -1.309 -4.411
508 HB2 LYS 28 HB3 LYS 28 -14.838 -3.490 -5.528
509 HB3 LYS 28 HB2 LYS 28 -15.864 -2.487 -6.539
510 HG2 LYS 28 HG3 LYS 28 -13.672 -1.462 -4.748
511 HG3 LYS 28 HG2 LYS 28 -13.529 -1.729 -6.485
512 HD2 LYS 28 HD3 LYS 28 -15.386 -0.117 -6.833
513 HD3 LYS 28 HD2 LYS 28 -15.379 0.210 -5.099
514 HE2 LYS 28 HE3 LYS 28 -14.123 1.919 -6.261
515 HE3 LYS 28 HE2 LYS 28 -13.033 0.946 -5.274
516 HZ1 LYS 28 HZ1 LYS 28 -12.124 1.386 -7.472
517 HZ2 LYS 28 HZ2 LYS 28 -13.447 0.624 -8.194
518 HZ3 LYS 28 HZ3 LYS 28 -12.376 -0.268 -7.240
519 H LYS 29 H LYS 29 -16.569 -4.792 -3.859
520 HA LYS 29 HA LYS 29 -18.918 -5.285 -5.385
521 HB2 LYS 29 HB3 LYS 29 -17.439 -7.091 -5.105
522 HB3 LYS 29 HB2 LYS 29 -17.402 -6.917 -3.359
523 HG2 LYS 29 HG3 LYS 29 -19.720 -7.682 -3.241
524 HG3 LYS 29 HG2 LYS 29 -19.760 -7.839 -4.997
525 HD2 LYS 29 HD3 LYS 29 -17.967 -9.504 -4.886
526 HD3 LYS 29 HD2 LYS 29 -17.937 -9.349 -3.129
527 HE2 LYS 29 HE3 LYS 29 -20.229 -10.150 -3.001
528 HE3 LYS 29 HE2 LYS 29 -20.311 -10.248 -4.759
529 HZ1 LYS 29 HZ1 LYS 29 -18.572 -11.923 -4.707
530 HZ2 LYS 29 HZ2 LYS 29 -19.891 -12.408 -3.774
531 HZ3 LYS 29 HZ3 LYS 29 -18.492 -11.830 -3.022
532 H LEU 30 H LEU 30 -18.288 -4.412 -2.068
533 HA LEU 30 HA LEU 30 -20.955 -4.916 -1.166
534 HB2 LEU 30 HB3 LEU 30 -18.815 -3.117 -0.030
535 HB3 LEU 30 HB2 LEU 30 -20.320 -3.526 0.765
536 HG LEU 30 HG LEU 30 -18.118 -5.471 0.073
537 HD11 LEU 30 HD11 LEU 30 -17.821 -5.600 2.509
538 HD12 LEU 30 HD12 LEU 30 -19.009 -4.314 2.710
539 HD13 LEU 30 HD13 LEU 30 -17.487 -3.986 1.883
540 HD21 LEU 30 HD21 LEU 30 -19.427 -7.061 1.418
541 HD22 LEU 30 HD22 LEU 30 -20.292 -6.541 -0.028
542 HD23 LEU 30 HD23 LEU 30 -20.719 -5.869 1.545
543 H VAL 31 H VAL 31 -19.245 -2.228 -2.610
544 HA VAL 31 HA VAL 31 -21.357 -0.344 -2.174
545 HB VAL 31 HB VAL 31 -18.983 -0.152 -4.050
546 HG11 VAL 31 HG11 VAL 31 -19.412 2.244 -4.054
547 HG12 VAL 31 HG12 VAL 31 -20.836 2.004 -3.040
548 HG13 VAL 31 HG13 VAL 31 -20.804 1.360 -4.682
549 HG21 VAL 31 HG21 VAL 31 -18.015 1.269 -2.292
550 HG22 VAL 31 HG22 VAL 31 -18.278 -0.387 -1.749
551 HG23 VAL 31 HG23 VAL 31 -19.387 0.888 -1.252
552 H GLY 32 H GLY 32 -20.495 -2.590 -4.761
553 HA2 GLY 32 HA3 GLY 32 -23.094 -2.453 -5.853
554 HA3 GLY 32 HA2 GLY 32 -22.021 -1.449 -6.808
555 H GLU 33 H GLU 33 -20.890 -4.416 -5.284
556 HA GLU 33 HA GLU 33 -20.203 -6.395 -6.126
557 HB2 GLU 33 HB3 GLU 33 -22.527 -5.943 -7.996
558 HB3 GLU 33 HB2 GLU 33 -21.674 -7.469 -7.810
559 HG2 GLU 33 HG3 GLU 33 -22.351 -7.607 -5.494
560 HG3 GLU 33 HG2 GLU 33 -23.136 -6.032 -5.608
Start of MODEL 6
1 H1 GLY 1 H1 GLY 1 26.312 -0.815 -5.224
2 H2 GLY 1 H2 GLY 1 24.967 -1.207 -6.170
3 H3 GLY 1 H3 GLY 1 24.793 -0.985 -4.504
4 HA2 GLY 1 HA2 GLY 1 25.383 1.342 -4.723
5 HA3 GLY 1 HA3 GLY 1 25.557 1.111 -6.456
6 H SER 2 H SER 2 23.879 3.029 -5.613
7 HA SER 2 HA SER 2 21.829 3.848 -6.233
8 HB2 SER 2 HB3 SER 2 21.212 1.019 -7.119
9 HB3 SER 2 HB2 SER 2 20.224 2.440 -7.457
10 HG SER 2 HG SER 2 22.358 3.256 -8.387
11 H MET 3 H MET 3 22.537 2.722 -3.647
12 HA MET 3 HA MET 3 20.347 1.403 -2.465
13 HB2 MET 3 HB3 MET 3 22.519 1.409 -1.413
14 HB3 MET 3 HB2 MET 3 22.498 3.160 -1.287
15 HG2 MET 3 HG3 MET 3 20.598 3.000 0.269
16 HG3 MET 3 HG2 MET 3 20.678 1.243 0.158
17 HE1 MET 3 HE1 MET 3 22.009 1.888 3.766
18 HE2 MET 3 HE2 MET 3 20.878 0.970 2.773
19 HE3 MET 3 HE3 MET 3 20.703 2.719 2.922
20 H LYS 4 H LYS 4 21.052 4.788 -3.054
21 HA LYS 4 HA LYS 4 19.027 5.900 -1.439
22 HB2 LYS 4 HB3 LYS 4 20.889 7.208 -2.430
23 HB3 LYS 4 HB2 LYS 4 20.164 6.998 -4.016
24 HG2 LYS 4 HG3 LYS 4 18.219 8.256 -3.338
25 HG3 LYS 4 HG2 LYS 4 18.846 8.391 -1.698
26 HD2 LYS 4 HD3 LYS 4 19.292 10.464 -2.750
27 HD3 LYS 4 HD2 LYS 4 20.829 9.607 -2.681
28 HE2 LYS 4 HE3 LYS 4 19.091 9.442 -5.116
29 HE3 LYS 4 HE2 LYS 4 20.149 10.826 -4.863
30 HZ1 LYS 4 HZ1 LYS 4 21.251 9.193 -6.205
31 HZ2 LYS 4 HZ2 LYS 4 20.987 7.985 -5.056
32 HZ3 LYS 4 HZ3 LYS 4 22.024 9.268 -4.704
33 H GLN 5 H GLN 5 18.999 4.457 -4.614
34 HA GLN 5 HA GLN 5 16.468 5.410 -5.446
35 HB2 GLN 5 HB3 GLN 5 17.882 2.853 -6.229
36 HB3 GLN 5 HB2 GLN 5 16.529 3.580 -7.083
37 HG2 GLN 5 HG3 GLN 5 19.274 4.769 -6.750
38 HG3 GLN 5 HG2 GLN 5 18.612 4.052 -8.217
39 HE21 GLN 5 HE21 GLN 5 19.624 6.747 -7.703
40 HE22 GLN 5 HE22 GLN 5 18.338 7.823 -8.124
41 H LEU 6 H LEU 6 17.522 2.561 -3.648
42 HA LEU 6 HA LEU 6 14.993 1.333 -3.422
43 HB2 LEU 6 HB3 LEU 6 17.501 1.181 -1.782
44 HB3 LEU 6 HB2 LEU 6 16.043 0.371 -1.251
45 HG LEU 6 HG LEU 6 16.025 -0.899 -3.401
46 HD11 LEU 6 HD11 LEU 6 18.749 0.339 -3.759
47 HD12 LEU 6 HD12 LEU 6 17.332 0.625 -4.769
48 HD13 LEU 6 HD13 LEU 6 18.077 -0.974 -4.727
49 HD21 LEU 6 HD21 LEU 6 17.843 -2.410 -2.766
50 HD22 LEU 6 HD22 LEU 6 16.909 -1.882 -1.367
51 HD23 LEU 6 HD23 LEU 6 18.491 -1.173 -1.691
52 H GLU 7 H GLU 7 16.618 3.787 -1.476
53 HA GLU 7 HA GLU 7 14.750 3.990 0.602
54 HB2 GLU 7 HB3 GLU 7 16.467 6.139 -0.651
55 HB3 GLU 7 HB2 GLU 7 15.573 6.331 0.849
56 HG2 GLU 7 HG3 GLU 7 16.888 4.497 1.832
57 HG3 GLU 7 HG2 GLU 7 17.821 4.400 0.338
58 H ASP 8 H ASP 8 14.872 5.514 -2.580
59 HA ASP 8 HA ASP 8 12.613 7.170 -2.251
60 HB2 ASP 8 HB3 ASP 8 13.936 6.030 -4.706
61 HB3 ASP 8 HB2 ASP 8 12.521 7.072 -4.803
62 H LYS 9 H LYS 9 12.996 3.870 -3.421
63 HA LYS 9 HA LYS 9 10.366 3.523 -4.355
64 HB2 LYS 9 HB3 LYS 9 12.368 1.483 -3.384
65 HB3 LYS 9 HB2 LYS 9 10.864 1.087 -4.204
66 HG2 LYS 9 HG3 LYS 9 11.648 2.408 -6.154
67 HG3 LYS 9 HG2 LYS 9 13.192 2.624 -5.328
68 HD2 LYS 9 HD3 LYS 9 13.511 0.205 -5.277
69 HD3 LYS 9 HD2 LYS 9 11.955 -0.024 -6.077
70 HE2 LYS 9 HE3 LYS 9 12.813 1.301 -7.995
71 HE3 LYS 9 HE2 LYS 9 14.387 1.356 -7.203
72 HZ1 LYS 9 HZ1 LYS 9 14.436 -1.078 -7.279
73 HZ2 LYS 9 HZ2 LYS 9 14.334 -0.401 -8.823
74 HZ3 LYS 9 HZ3 LYS 9 12.964 -1.085 -8.110
75 H VAL 10 H VAL 10 11.844 2.562 -1.243
76 HA VAL 10 HA VAL 10 9.509 1.368 -0.233
77 HB VAL 10 HB VAL 10 11.703 0.906 0.739
78 HG11 VAL 10 HG11 VAL 10 12.779 2.484 2.264
79 HG12 VAL 10 HG12 VAL 10 11.573 3.702 1.851
80 HG13 VAL 10 HG13 VAL 10 12.693 3.119 0.620
81 HG21 VAL 10 HG21 VAL 10 11.064 0.979 3.114
82 HG22 VAL 10 HG22 VAL 10 9.749 0.423 2.079
83 HG23 VAL 10 HG23 VAL 10 9.741 2.071 2.708
84 H GLU 11 H GLU 11 10.668 4.704 -0.054
85 HA GLU 11 HA GLU 11 8.566 5.563 1.696
86 HB2 GLU 11 HB3 GLU 11 10.382 7.155 -0.121
87 HB3 GLU 11 HB2 GLU 11 9.315 7.845 1.094
88 HG2 GLU 11 HG3 GLU 11 11.647 6.012 1.601
89 HG3 GLU 11 HG2 GLU 11 11.593 7.747 1.900
90 H GLU 12 H GLU 12 9.054 5.422 -1.775
91 HA GLU 12 HA GLU 12 6.818 6.866 -2.616
92 HB2 GLU 12 HB3 GLU 12 8.615 6.071 -4.116
93 HB3 GLU 12 HB2 GLU 12 8.038 4.424 -3.916
94 HG2 GLU 12 HG3 GLU 12 7.279 5.317 -6.016
95 HG3 GLU 12 HG2 GLU 12 5.906 5.057 -4.942
96 H LEU 13 H LEU 13 7.077 3.309 -2.182
97 HA LEU 13 HA LEU 13 4.293 2.909 -2.470
98 HB2 LEU 13 HB3 LEU 13 6.443 1.145 -1.336
99 HB3 LEU 13 HB2 LEU 13 4.755 0.677 -1.308
100 HG LEU 13 HG LEU 13 4.760 1.106 -3.824
101 HD11 LEU 13 HD11 LEU 13 7.731 0.898 -3.383
102 HD12 LEU 13 HD12 LEU 13 6.857 2.307 -3.985
103 HD13 LEU 13 HD13 LEU 13 6.915 0.827 -4.945
104 HD21 LEU 13 HD21 LEU 13 5.650 -1.140 -4.281
105 HD22 LEU 13 HD22 LEU 13 4.597 -1.112 -2.864
106 HD23 LEU 13 HD23 LEU 13 6.350 -1.177 -2.663
107 H LEU 14 H LEU 14 6.252 3.578 0.374
108 HA LEU 14 HA LEU 14 4.362 3.177 2.365
109 HB2 LEU 14 HB3 LEU 14 6.685 3.763 2.808
110 HB3 LEU 14 HB2 LEU 14 6.466 5.334 2.080
111 HG LEU 14 HG LEU 14 6.603 5.234 4.597
112 HD11 LEU 14 HD11 LEU 14 4.929 6.966 4.931
113 HD12 LEU 14 HD12 LEU 14 4.183 6.543 3.390
114 HD13 LEU 14 HD13 LEU 14 5.819 7.203 3.426
115 HD21 LEU 14 HD21 LEU 14 3.788 4.197 4.336
116 HD22 LEU 14 HD22 LEU 14 4.592 4.676 5.830
117 HD23 LEU 14 HD23 LEU 14 5.171 3.276 4.928
118 H SER 15 H SER 15 4.799 5.876 0.156
119 HA SER 15 HA SER 15 2.560 7.352 1.156
120 HB2 SER 15 HB3 SER 15 4.018 7.626 -1.485
121 HB3 SER 15 HB2 SER 15 2.953 8.825 -0.751
122 HG SER 15 HG SER 15 5.429 7.880 0.294
123 H LYS 16 H LYS 16 3.123 5.024 -1.440
124 HA LYS 16 HA LYS 16 0.721 5.462 -2.839
125 HB2 LYS 16 HB3 LYS 16 2.795 4.224 -3.624
126 HB3 LYS 16 HB2 LYS 16 2.202 2.845 -2.712
127 HG2 LYS 16 HG3 LYS 16 0.323 2.599 -4.101
128 HG3 LYS 16 HG2 LYS 16 0.549 4.192 -4.823
129 HD2 LYS 16 HD3 LYS 16 1.282 2.562 -6.412
130 HD3 LYS 16 HD2 LYS 16 2.713 3.367 -5.767
131 HE2 LYS 16 HE3 LYS 16 3.259 1.081 -5.805
132 HE3 LYS 16 HE2 LYS 16 2.868 1.437 -4.124
133 HZ1 LYS 16 HZ1 LYS 16 0.610 0.577 -4.578
134 HZ2 LYS 16 HZ2 LYS 16 1.822 -0.591 -4.732
135 HZ3 LYS 16 HZ3 LYS 16 1.131 0.096 -6.114
136 H ASN 17 H ASN 17 1.504 2.984 -0.346
137 HA ASN 17 HA ASN 17 -1.112 1.882 -0.431
138 HB2 ASN 17 HB3 ASN 17 -0.512 0.711 1.674
139 HB3 ASN 17 HB2 ASN 17 0.651 0.484 0.389
140 HD21 ASN 17 HD21 ASN 17 0.433 3.308 2.512
141 HD22 ASN 17 HD22 ASN 17 1.963 3.052 3.266
142 H TYR 18 H TYR 18 0.154 4.670 1.072
143 HA TYR 18 HA TYR 18 -1.784 4.923 3.142
144 HB2 TYR 18 HB3 TYR 18 0.354 6.166 3.162
145 HB3 TYR 18 HB2 TYR 18 -0.166 7.069 1.744
146 HD1 TYR 18 HD1 TYR 18 -1.530 8.987 1.959
147 HD2 TYR 18 HD2 TYR 18 -0.921 6.445 5.317
148 HE1 TYR 18 HE1 TYR 18 -2.588 10.662 3.412
149 HE2 TYR 18 HE2 TYR 18 -1.978 8.115 6.777
150 HH TYR 18 HH TYR 18 -3.727 10.777 5.564
151 H HIS 19 H HIS 19 -1.515 6.025 -0.190
152 HA HIS 19 HA HIS 19 -3.972 7.464 -0.209
153 HB2 HIS 19 HB3 HIS 19 -2.354 6.324 -2.502
154 HB3 HIS 19 HB2 HIS 19 -3.704 7.441 -2.679
155 HD1 HIS 19 HD1 HIS 19 -0.355 7.687 -3.115
156 HD2 HIS 19 HD2 HIS 19 -2.899 9.710 -0.525
157 HE1 HIS 19 HE1 HIS 19 0.833 9.820 -2.528
158 HE2 HIS 19 HE2 HIS 19 -0.658 10.955 -0.848
159 H LEU 20 H LEU 20 -3.078 4.136 -0.722
160 HA LEU 20 HA LEU 20 -5.583 3.303 -1.792
161 HB2 LEU 20 HB3 LEU 20 -3.170 1.956 -0.724
162 HB3 LEU 20 HB2 LEU 20 -4.664 1.036 -0.693
163 HG LEU 20 HG LEU 20 -4.900 1.202 -3.078
164 HD11 LEU 20 HD11 LEU 20 -2.421 2.914 -3.048
165 HD12 LEU 20 HD12 LEU 20 -4.066 3.492 -3.325
166 HD13 LEU 20 HD13 LEU 20 -3.313 2.385 -4.476
167 HD21 LEU 20 HD21 LEU 20 -2.051 0.526 -2.371
168 HD22 LEU 20 HD22 LEU 20 -2.924 -0.007 -3.806
169 HD23 LEU 20 HD23 LEU 20 -3.433 -0.557 -2.210
170 H GLU 21 H GLU 21 -4.249 3.585 1.453
171 HA GLU 21 HA GLU 21 -6.393 2.416 2.855
172 HB2 GLU 21 HB3 GLU 21 -4.506 4.645 3.630
173 HB3 GLU 21 HB2 GLU 21 -5.685 3.958 4.735
174 HG2 GLU 21 HG3 GLU 21 -4.622 1.774 4.520
175 HG3 GLU 21 HG2 GLU 21 -3.435 2.461 3.412
176 H ASN 22 H ASN 22 -5.891 5.602 1.507
177 HA ASN 22 HA ASN 22 -8.210 6.829 2.543
178 HB2 ASN 22 HB3 ASN 22 -6.625 7.428 0.039
179 HB3 ASN 22 HB2 ASN 22 -7.901 8.460 0.673
180 HD21 ASN 22 HD21 ASN 22 -7.192 8.006 3.457
181 HD22 ASN 22 HD22 ASN 22 -5.733 8.886 3.731
182 H GLU 23 H GLU 23 -7.612 4.807 -0.266
183 HA GLU 23 HA GLU 23 -10.166 5.259 -1.466
184 HB2 GLU 23 HB3 GLU 23 -8.101 3.083 -1.860
185 HB3 GLU 23 HB2 GLU 23 -9.600 3.201 -2.807
186 HG2 GLU 23 HG3 GLU 23 -8.904 5.400 -3.616
187 HG3 GLU 23 HG2 GLU 23 -7.416 5.278 -2.677
188 H VAL 24 H VAL 24 -8.810 2.768 0.660
189 HA VAL 24 HA VAL 24 -11.073 1.108 0.732
190 HB VAL 24 HB VAL 24 -9.110 1.546 2.995
191 HG11 VAL 24 HG11 VAL 24 -9.716 -0.710 3.690
192 HG12 VAL 24 HG12 VAL 24 -10.861 -0.833 2.353
193 HG13 VAL 24 HG13 VAL 24 -11.137 0.332 3.650
194 HG21 VAL 24 HG21 VAL 24 -7.861 -0.346 2.084
195 HG22 VAL 24 HG22 VAL 24 -7.936 0.983 0.926
196 HG23 VAL 24 HG23 VAL 24 -8.973 -0.429 0.720
197 H ALA 25 H ALA 25 -10.184 3.973 2.579
198 HA ALA 25 HA ALA 25 -12.331 3.769 4.446
199 HB1 ALA 25 HB1 ALA 25 -11.707 5.964 5.179
200 HB2 ALA 25 HB2 ALA 25 -10.784 6.243 3.706
201 HB3 ALA 25 HB3 ALA 25 -10.240 5.036 4.871
202 H ARG 26 H ARG 26 -11.945 5.305 1.318
203 HA ARG 26 HA ARG 26 -14.235 6.954 1.431
204 HB2 ARG 26 HB3 ARG 26 -13.640 7.587 -0.667
205 HB3 ARG 26 HB2 ARG 26 -12.163 6.732 -0.277
206 HG2 ARG 26 HG3 ARG 26 -12.653 6.003 -2.410
207 HG3 ARG 26 HG2 ARG 26 -13.281 4.697 -1.406
208 HD2 ARG 26 HD2 ARG 26 -14.859 5.256 -3.172
209 HD3 ARG 26 HD1 ARG 26 -15.539 5.665 -1.599
210 HE ARG 26 HE ARG 26 -14.453 7.604 -3.540
211 HH11 ARG 26 HH11 ARG 26 -16.511 6.855 -0.791
212 HH12 ARG 26 HH12 ARG 26 -17.291 8.404 -0.799
213 HH21 ARG 26 HH21 ARG 26 -15.485 9.631 -3.545
214 HH22 ARG 26 HH22 ARG 26 -16.707 9.980 -2.365
215 H LEU 27 H LEU 27 -13.686 3.653 0.458
216 HA LEU 27 HA LEU 27 -16.336 3.205 -0.506
217 HB2 LEU 27 HB3 LEU 27 -14.070 1.394 0.231
218 HB3 LEU 27 HB2 LEU 27 -15.620 0.785 -0.298
219 HG LEU 27 HG LEU 27 -14.085 2.735 -1.950
220 HD11 LEU 27 HD11 LEU 27 -13.896 -0.240 -2.160
221 HD12 LEU 27 HD12 LEU 27 -12.686 0.777 -1.380
222 HD13 LEU 27 HD13 LEU 27 -13.019 0.966 -3.103
223 HD21 LEU 27 HD21 LEU 27 -16.109 0.625 -2.661
224 HD22 LEU 27 HD22 LEU 27 -15.381 1.795 -3.764
225 HD23 LEU 27 HD23 LEU 27 -16.456 2.344 -2.479
226 H LYS 28 H LYS 28 -14.657 2.378 2.522
227 HA LYS 28 HA LYS 28 -16.605 1.088 3.919
228 HB2 LYS 28 HB3 LYS 28 -14.768 3.277 4.893
229 HB3 LYS 28 HB2 LYS 28 -15.779 2.330 5.971
230 HG2 LYS 28 HG3 LYS 28 -13.611 1.250 4.180
231 HG3 LYS 28 HG2 LYS 28 -13.489 1.502 5.921
232 HD2 LYS 28 HD3 LYS 28 -15.409 -0.378 4.544
233 HD3 LYS 28 HD2 LYS 28 -13.923 -0.851 5.362
234 HE2 LYS 28 HE3 LYS 28 -16.267 0.520 6.674
235 HE3 LYS 28 HE2 LYS 28 -15.942 -1.209 6.739
236 HZ1 LYS 28 HZ1 LYS 28 -14.162 0.920 7.790
237 HZ2 LYS 28 HZ2 LYS 28 -13.866 -0.741 7.865
238 HZ3 LYS 28 HZ3 LYS 28 -15.162 -0.075 8.719
239 H LYS 29 H LYS 29 -16.366 4.613 3.526
240 HA LYS 29 HA LYS 29 -18.646 5.291 4.996
241 HB2 LYS 29 HB3 LYS 29 -17.438 6.736 2.635
242 HB3 LYS 29 HB2 LYS 29 -18.525 7.427 3.826
243 HG2 LYS 29 HG3 LYS 29 -16.872 7.085 5.574
244 HG3 LYS 29 HG2 LYS 29 -15.779 6.347 4.402
245 HD2 LYS 29 HD3 LYS 29 -15.763 8.468 3.135
246 HD3 LYS 29 HD2 LYS 29 -16.777 9.195 4.384
247 HE2 LYS 29 HE3 LYS 29 -15.014 8.686 6.046
248 HE3 LYS 29 HE2 LYS 29 -13.997 8.080 4.740
249 HZ1 LYS 29 HZ1 LYS 29 -15.025 10.853 4.982
250 HZ2 LYS 29 HZ2 LYS 29 -14.047 10.273 3.734
251 HZ3 LYS 29 HZ3 LYS 29 -13.444 10.356 5.311
252 H LEU 30 H LEU 30 -18.238 4.468 1.587
253 HA LEU 30 HA LEU 30 -20.870 5.085 0.763
254 HB2 LEU 30 HB3 LEU 30 -18.805 3.221 -0.377
255 HB3 LEU 30 HB2 LEU 30 -20.334 3.556 -1.163
256 HG LEU 30 HG LEU 30 -18.182 5.590 -0.568
257 HD11 LEU 30 HD11 LEU 30 -19.061 4.331 -3.161
258 HD12 LEU 30 HD12 LEU 30 -17.532 4.051 -2.330
259 HD13 LEU 30 HD13 LEU 30 -17.893 5.642 -3.000
260 HD21 LEU 30 HD21 LEU 30 -20.809 5.854 -2.029
261 HD22 LEU 30 HD22 LEU 30 -19.551 7.088 -1.960
262 HD23 LEU 30 HD23 LEU 30 -20.387 6.600 -0.486
263 H VAL 31 H VAL 31 -19.456 2.204 2.196
264 HA VAL 31 HA VAL 31 -21.792 0.590 1.684
265 HB VAL 31 HB VAL 31 -19.560 -0.032 3.627
266 HG11 VAL 31 HG11 VAL 31 -20.192 -2.348 3.246
267 HG12 VAL 31 HG12 VAL 31 -21.448 -1.838 2.120
268 HG13 VAL 31 HG13 VAL 31 -21.574 -1.421 3.829
269 HG21 VAL 31 HG21 VAL 31 -18.490 -1.261 1.803
270 HG22 VAL 31 HG22 VAL 31 -18.603 0.461 1.441
271 HG23 VAL 31 HG23 VAL 31 -19.722 -0.674 0.686
272 H GLY 32 H GLY 32 -20.660 2.690 4.213
273 HA2 GLY 32 HA3 GLY 32 -22.836 3.457 5.423
274 HA3 GLY 32 HA2 GLY 32 -22.816 1.795 5.992
275 H GLU 33 H GLU 33 -20.046 3.901 5.499
276 HA GLU 33 HA GLU 33 -18.379 4.603 6.858
277 HB2 GLU 33 HB3 GLU 33 -20.273 6.021 7.661
278 HB3 GLU 33 HB2 GLU 33 -20.557 4.843 8.932
279 HG2 GLU 33 HG3 GLU 33 -18.268 5.251 9.769
280 HG3 GLU 33 HG2 GLU 33 -18.083 6.510 8.547
281 H1 GLY 1 H1 GLY 1 26.326 0.631 4.502
282 H2 GLY 1 H2 GLY 1 24.987 1.024 5.458
283 H3 GLY 1 H3 GLY 1 24.803 0.804 3.794
284 HA2 GLY 1 HA2 GLY 1 25.392 -1.527 4.002
285 HA3 GLY 1 HA3 GLY 1 25.566 -1.297 5.736
286 H SER 2 H SER 2 23.894 -3.214 4.919
287 HA SER 2 HA SER 2 21.840 -4.031 5.542
288 HB2 SER 2 HB3 SER 2 21.228 -1.194 6.416
289 HB3 SER 2 HB2 SER 2 20.252 -2.618 6.779
290 HG SER 2 HG SER 2 22.360 -3.429 7.718
291 H MET 3 H MET 3 22.531 -2.918 2.953
292 HA MET 3 HA MET 3 20.346 -1.591 1.773
293 HB2 MET 3 HB3 MET 3 22.514 -1.605 0.715
294 HB3 MET 3 HB2 MET 3 22.490 -3.360 0.598
295 HG2 MET 3 HG3 MET 3 20.579 -3.198 -0.950
296 HG3 MET 3 HG2 MET 3 20.673 -1.441 -0.853
297 HE1 MET 3 HE1 MET 3 21.977 -2.099 -4.460
298 HE2 MET 3 HE2 MET 3 20.854 -1.181 -3.458
299 HE3 MET 3 HE3 MET 3 20.673 -2.928 -3.611
300 H LYS 4 H LYS 4 21.047 -4.972 2.376
301 HA LYS 4 HA LYS 4 19.017 -6.089 0.771
302 HB2 LYS 4 HB3 LYS 4 20.879 -7.398 1.760
303 HB3 LYS 4 HB2 LYS 4 20.161 -7.179 3.350
304 HG2 LYS 4 HG3 LYS 4 18.206 -8.432 2.683
305 HG3 LYS 4 HG2 LYS 4 18.827 -8.575 1.042
306 HD2 LYS 4 HD3 LYS 4 19.263 -10.645 2.101
307 HD3 LYS 4 HD2 LYS 4 20.804 -9.800 2.021
308 HE2 LYS 4 HE3 LYS 4 19.081 -9.617 4.464
309 HE3 LYS 4 HE2 LYS 4 20.132 -11.006 4.210
310 HZ1 LYS 4 HZ1 LYS 4 21.246 -9.368 5.541
311 HZ2 LYS 4 HZ2 LYS 4 20.982 -8.167 4.387
312 HZ3 LYS 4 HZ3 LYS 4 22.011 -9.458 4.037
313 H GLN 5 H GLN 5 18.997 -4.635 3.940
314 HA GLN 5 HA GLN 5 16.467 -5.580 4.786
315 HB2 GLN 5 HB3 GLN 5 17.889 -3.021 5.555
316 HB3 GLN 5 HB2 GLN 5 16.542 -3.747 6.419
317 HG2 GLN 5 HG3 GLN 5 19.283 -4.938 6.071
318 HG3 GLN 5 HG2 GLN 5 18.631 -4.219 7.542
319 HE21 GLN 5 HE21 GLN 5 19.637 -6.922 7.021
320 HE22 GLN 5 HE22 GLN 5 18.351 -7.994 7.455
321 H LEU 6 H LEU 6 17.521 -2.743 2.972
322 HA LEU 6 HA LEU 6 14.994 -1.508 2.752
323 HB2 LEU 6 HB3 LEU 6 17.496 -1.368 1.102
324 HB3 LEU 6 HB2 LEU 6 16.037 -0.556 0.576
325 HG LEU 6 HG LEU 6 16.035 0.721 2.722
326 HD11 LEU 6 HD11 LEU 6 18.755 -0.526 3.066
327 HD12 LEU 6 HD12 LEU 6 17.343 -0.800 4.086
328 HD13 LEU 6 HD13 LEU 6 18.096 0.794 4.031
329 HD21 LEU 6 HD21 LEU 6 17.853 2.227 2.076
330 HD22 LEU 6 HD22 LEU 6 16.913 1.701 0.681
331 HD23 LEU 6 HD23 LEU 6 18.494 0.987 0.999
332 H GLU 7 H GLU 7 16.605 -3.976 0.811
333 HA GLU 7 HA GLU 7 14.729 -4.176 -1.260
334 HB2 GLU 7 HB3 GLU 7 16.445 -6.327 -0.011
335 HB3 GLU 7 HB2 GLU 7 15.546 -6.518 -1.509
336 HG2 GLU 7 HG3 GLU 7 16.862 -4.687 -2.499
337 HG3 GLU 7 HG2 GLU 7 17.799 -4.588 -1.006
338 H ASP 8 H ASP 8 14.864 -5.695 1.923
339 HA ASP 8 HA ASP 8 12.595 -7.342 1.618
340 HB2 ASP 8 HB3 ASP 8 13.938 -6.192 4.060
341 HB3 ASP 8 HB2 ASP 8 12.521 -7.227 4.170
342 H LYS 9 H LYS 9 12.995 -4.036 2.767
343 HA LYS 9 HA LYS 9 10.370 -3.682 3.716
344 HB2 LYS 9 HB3 LYS 9 12.370 -1.647 2.728
345 HB3 LYS 9 HB2 LYS 9 10.870 -1.248 3.555
346 HG2 LYS 9 HG3 LYS 9 11.657 -2.560 5.506
347 HG3 LYS 9 HG2 LYS 9 13.198 -2.789 4.675
348 HD2 LYS 9 HD3 LYS 9 13.531 -0.372 4.612
349 HD3 LYS 9 HD2 LYS 9 11.978 -0.131 5.414
350 HE2 LYS 9 HE3 LYS 9 12.837 -1.456 7.335
351 HE3 LYS 9 HE2 LYS 9 14.410 -1.510 6.542
352 HZ1 LYS 9 HZ1 LYS 9 14.462 0.922 6.615
353 HZ2 LYS 9 HZ2 LYS 9 14.345 0.253 8.162
354 HZ3 LYS 9 HZ3 LYS 9 12.981 0.936 7.437
355 H VAL 10 H VAL 10 11.834 -2.740 0.591
356 HA VAL 10 HA VAL 10 9.498 -1.540 -0.413
357 HB VAL 10 HB VAL 10 11.688 -1.084 -1.394
358 HG11 VAL 10 HG11 VAL 10 12.756 -2.669 -2.919
359 HG12 VAL 10 HG12 VAL 10 11.550 -3.884 -2.497
360 HG13 VAL 10 HG13 VAL 10 12.677 -3.298 -1.272
361 HG21 VAL 10 HG21 VAL 10 11.037 -1.164 -3.767
362 HG22 VAL 10 HG22 VAL 10 9.728 -0.605 -2.726
363 HG23 VAL 10 HG23 VAL 10 9.714 -2.254 -3.351
364 H GLU 11 H GLU 11 10.651 -4.879 -0.586
365 HA GLU 11 HA GLU 11 8.541 -5.743 -2.323
366 HB2 GLU 11 HB3 GLU 11 10.370 -7.322 -0.503
367 HB3 GLU 11 HB2 GLU 11 9.295 -8.022 -1.705
368 HG2 GLU 11 HG3 GLU 11 11.625 -6.193 -2.242
369 HG3 GLU 11 HG2 GLU 11 11.562 -7.929 -2.538
370 H GLU 12 H GLU 12 9.044 -5.593 1.145
371 HA GLU 12 HA GLU 12 6.807 -7.022 2.002
372 HB2 GLU 12 HB3 GLU 12 8.613 -6.227 3.492
373 HB3 GLU 12 HB2 GLU 12 8.039 -4.578 3.291
374 HG2 GLU 12 HG3 GLU 12 7.283 -5.468 5.395
375 HG3 GLU 12 HG2 GLU 12 5.908 -5.204 4.324
376 H LEU 13 H LEU 13 7.073 -3.469 1.547
377 HA LEU 13 HA LEU 13 4.290 -3.061 1.855
378 HB2 LEU 13 HB3 LEU 13 6.440 -1.304 0.704
379 HB3 LEU 13 HB2 LEU 13 4.753 -0.832 0.681
380 HG LEU 13 HG LEU 13 4.767 -1.252 3.197
381 HD11 LEU 13 HD11 LEU 13 7.738 -1.059 2.745
382 HD12 LEU 13 HD12 LEU 13 6.858 -2.461 3.356
383 HD13 LEU 13 HD13 LEU 13 6.927 -0.979 4.309
384 HD21 LEU 13 HD21 LEU 13 5.662 0.993 3.648
385 HD22 LEU 13 HD22 LEU 13 4.606 0.961 2.235
386 HD23 LEU 13 HD23 LEU 13 6.357 1.024 2.026
387 H LEU 14 H LEU 14 6.233 -3.747 -0.996
388 HA LEU 14 HA LEU 14 4.336 -3.345 -2.980
389 HB2 LEU 14 HB3 LEU 14 6.654 -3.935 -3.433
390 HB3 LEU 14 HB2 LEU 14 6.441 -5.502 -2.697
391 HG LEU 14 HG LEU 14 6.565 -5.414 -5.216
392 HD11 LEU 14 HD11 LEU 14 4.889 -7.143 -5.541
393 HD12 LEU 14 HD12 LEU 14 4.147 -6.717 -3.998
394 HD13 LEU 14 HD13 LEU 14 5.781 -7.380 -4.038
395 HD21 LEU 14 HD21 LEU 14 3.755 -4.373 -4.944
396 HD22 LEU 14 HD22 LEU 14 4.550 -4.855 -6.441
397 HD23 LEU 14 HD23 LEU 14 5.136 -3.454 -5.543
398 H SER 15 H SER 15 4.774 -6.036 -0.760
399 HA SER 15 HA SER 15 2.526 -7.505 -1.752
400 HB2 SER 15 HB3 SER 15 4.004 -7.784 0.876
401 HB3 SER 15 HB2 SER 15 2.913 -8.973 0.163
402 HG SER 15 HG SER 15 5.395 -8.072 -0.903
403 H LYS 16 H LYS 16 3.109 -5.180 0.840
404 HA LYS 16 HA LYS 16 0.711 -5.603 2.243
405 HB2 LYS 16 HB3 LYS 16 2.793 -4.372 3.016
406 HB3 LYS 16 HB2 LYS 16 2.201 -2.991 2.104
407 HG2 LYS 16 HG3 LYS 16 0.325 -2.735 3.501
408 HG3 LYS 16 HG2 LYS 16 0.552 -4.328 4.227
409 HD2 LYS 16 HD3 LYS 16 1.298 -2.699 5.807
410 HD3 LYS 16 HD2 LYS 16 2.724 -3.506 5.159
411 HE2 LYS 16 HE3 LYS 16 3.270 -1.220 5.193
412 HE3 LYS 16 HE2 LYS 16 2.877 -1.578 3.513
413 HZ1 LYS 16 HZ1 LYS 16 0.620 -0.717 3.966
414 HZ2 LYS 16 HZ2 LYS 16 1.832 0.453 4.117
415 HZ3 LYS 16 HZ3 LYS 16 1.139 -0.234 5.500
416 H ASN 17 H ASN 17 1.489 -3.133 -0.261
417 HA ASN 17 HA ASN 17 -1.124 -2.027 -0.165
418 HB2 ASN 17 HB3 ASN 17 -0.529 -0.860 -2.275
419 HB3 ASN 17 HB2 ASN 17 0.635 -0.633 -0.992
420 HD21 ASN 17 HD21 ASN 17 0.410 -3.458 -3.109
421 HD22 ASN 17 HD22 ASN 17 1.936 -3.201 -3.872
422 H TYR 18 H TYR 18 0.131 -4.819 -1.669
423 HA TYR 18 HA TYR 18 -1.821 -5.078 -3.727
424 HB2 TYR 18 HB3 TYR 18 0.317 -6.325 -3.751
425 HB3 TYR 18 HB2 TYR 18 -0.198 -7.221 -2.327
426 HD1 TYR 18 HD1 TYR 18 -1.570 -9.140 -2.532
427 HD2 TYR 18 HD2 TYR 18 -0.963 -6.609 -5.900
428 HE1 TYR 18 HE1 TYR 18 -2.635 -10.816 -3.980
429 HE2 TYR 18 HE2 TYR 18 -2.028 -8.280 -7.354
430 HH TYR 18 HH TYR 18 -3.798 -10.905 -6.150
431 H HIS 19 H HIS 19 -1.533 -6.172 -0.391
432 HA HIS 19 HA HIS 19 -3.992 -7.604 -0.354
433 HB2 HIS 19 HB3 HIS 19 -2.363 -6.458 1.926
434 HB3 HIS 19 HB2 HIS 19 -3.717 -7.568 2.113
435 HD1 HIS 19 HD1 HIS 19 -0.362 -7.821 2.535
436 HD2 HIS 19 HD2 HIS 19 -2.936 -9.854 -0.023
437 HE1 HIS 19 HE1 HIS 19 0.816 -9.963 1.948
438 HE2 HIS 19 HE2 HIS 19 -0.690 -11.094 0.277
439 H LEU 20 H LEU 20 -3.094 -4.274 0.131
440 HA LEU 20 HA LEU 20 -5.591 -3.434 1.218
441 HB2 LEU 20 HB3 LEU 20 -3.180 -2.096 0.136
442 HB3 LEU 20 HB2 LEU 20 -4.670 -1.173 0.108
443 HG LEU 20 HG LEU 20 -4.899 -1.330 2.495
444 HD11 LEU 20 HD11 LEU 20 -2.426 -3.049 2.464
445 HD12 LEU 20 HD12 LEU 20 -4.071 -3.623 2.745
446 HD13 LEU 20 HD13 LEU 20 -3.313 -2.513 3.892
447 HD21 LEU 20 HD21 LEU 20 -2.051 -0.663 1.774
448 HD22 LEU 20 HD22 LEU 20 -2.915 -0.125 3.214
449 HD23 LEU 20 HD23 LEU 20 -3.431 0.422 1.619
450 H GLU 21 H GLU 21 -4.274 -3.733 -2.034
451 HA GLU 21 HA GLU 21 -6.418 -2.558 -3.430
452 HB2 GLU 21 HB3 GLU 21 -4.547 -4.797 -4.206
453 HB3 GLU 21 HB2 GLU 21 -5.728 -4.109 -5.309
454 HG2 GLU 21 HG3 GLU 21 -4.649 -1.930 -5.107
455 HG3 GLU 21 HG2 GLU 21 -3.460 -2.620 -4.004
456 H ASN 22 H ASN 22 -5.923 -5.745 -2.081
457 HA ASN 22 HA ASN 22 -8.250 -6.969 -3.095
458 HB2 ASN 22 HB3 ASN 22 -6.657 -7.559 -0.594
459 HB3 ASN 22 HB2 ASN 22 -7.939 -8.589 -1.216
460 HD21 ASN 22 HD21 ASN 22 -7.227 -8.133 -4.006
461 HD22 ASN 22 HD22 ASN 22 -5.775 -9.028 -4.283
462 H GLU 23 H GLU 23 -7.632 -4.946 -0.292
463 HA GLU 23 HA GLU 23 -10.180 -5.381 0.923
464 HB2 GLU 23 HB3 GLU 23 -8.108 -3.209 1.295
465 HB3 GLU 23 HB2 GLU 23 -9.602 -3.320 2.251
466 HG2 GLU 23 HG3 GLU 23 -8.903 -5.515 3.066
467 HG3 GLU 23 HG2 GLU 23 -7.420 -5.399 2.119
468 H VAL 24 H VAL 24 -8.828 -2.899 -1.218
469 HA VAL 24 HA VAL 24 -11.087 -1.234 -1.286
470 HB VAL 24 HB VAL 24 -9.132 -1.683 -3.553
471 HG11 VAL 24 HG11 VAL 24 -9.738 0.569 -4.255
472 HG12 VAL 24 HG12 VAL 24 -10.876 0.699 -2.914
473 HG13 VAL 24 HG13 VAL 24 -11.162 -0.470 -4.205
474 HG21 VAL 24 HG21 VAL 24 -7.880 0.208 -2.655
475 HG22 VAL 24 HG22 VAL 24 -7.954 -1.115 -1.491
476 HG23 VAL 24 HG23 VAL 24 -8.987 0.298 -1.286
477 H ALA 25 H ALA 25 -10.215 -4.110 -3.121
478 HA ALA 25 HA ALA 25 -12.366 -3.904 -4.987
479 HB1 ALA 25 HB1 ALA 25 -11.749 -6.103 -5.717
480 HB2 ALA 25 HB2 ALA 25 -10.823 -6.379 -4.244
481 HB3 ALA 25 HB3 ALA 25 -10.278 -5.178 -5.415
482 H ARG 26 H ARG 26 -11.971 -5.435 -1.856
483 HA ARG 26 HA ARG 26 -14.265 -7.077 -1.955
484 HB2 ARG 26 HB3 ARG 26 -13.660 -7.707 0.143
485 HB3 ARG 26 HB2 ARG 26 -12.186 -6.852 -0.257
486 HG2 ARG 26 HG3 ARG 26 -12.666 -6.118 1.876
487 HG3 ARG 26 HG2 ARG 26 -13.295 -4.815 0.872
488 HD2 ARG 26 HD2 ARG 26 -14.865 -5.365 2.647
489 HD3 ARG 26 HD1 ARG 26 -15.554 -5.776 1.079
490 HE ARG 26 HE ARG 26 -14.465 -7.716 3.018
491 HH11 ARG 26 HH11 ARG 26 -16.529 -6.964 0.280
492 HH12 ARG 26 HH12 ARG 26 -17.310 -8.512 0.289
493 HH21 ARG 26 HH21 ARG 26 -15.505 -9.744 3.027
494 HH22 ARG 26 HH22 ARG 26 -16.737 -10.088 1.855
495 H LEU 27 H LEU 27 -13.705 -3.775 -0.993
496 HA LEU 27 HA LEU 27 -16.351 -3.315 -0.023
497 HB2 LEU 27 HB3 LEU 27 -14.082 -1.514 -0.775
498 HB3 LEU 27 HB2 LEU 27 -15.629 -0.895 -0.240
499 HG LEU 27 HG LEU 27 -14.093 -2.848 1.411
500 HD11 LEU 27 HD11 LEU 27 -13.894 0.126 1.612
501 HD12 LEU 27 HD12 LEU 27 -12.691 -0.896 0.829
502 HD13 LEU 27 HD13 LEU 27 -13.016 -1.080 2.555
503 HD21 LEU 27 HD21 LEU 27 -16.106 -0.731 2.127
504 HD22 LEU 27 HD22 LEU 27 -15.377 -1.902 3.228
505 HD23 LEU 27 HD23 LEU 27 -16.458 -2.449 1.948
506 H LYS 28 H LYS 28 -14.680 -2.508 -3.061
507 HA LYS 28 HA LYS 28 -16.629 -1.210 -4.455
508 HB2 LYS 28 HB3 LYS 28 -14.804 -3.411 -5.427
509 HB3 LYS 28 HB2 LYS 28 -15.814 -2.462 -6.503
510 HG2 LYS 28 HG3 LYS 28 -13.635 -1.385 -4.724
511 HG3 LYS 28 HG2 LYS 28 -13.522 -1.643 -6.464
512 HD2 LYS 28 HD3 LYS 28 -15.434 0.245 -5.088
513 HD3 LYS 28 HD2 LYS 28 -13.948 0.711 -5.914
514 HE2 LYS 28 HE3 LYS 28 -16.302 -0.660 -7.213
515 HE3 LYS 28 HE2 LYS 28 -15.967 1.067 -7.289
516 HZ1 LYS 28 HZ1 LYS 28 -14.197 -1.076 -8.338
517 HZ2 LYS 28 HZ2 LYS 28 -13.898 0.587 -8.424
518 HZ3 LYS 28 HZ3 LYS 28 -15.200 -0.080 -9.267
519 H LYS 29 H LYS 29 -16.401 -4.734 -4.050
520 HA LYS 29 HA LYS 29 -18.692 -5.410 -5.506
521 HB2 LYS 29 HB3 LYS 29 -17.472 -6.857 -3.150
522 HB3 LYS 29 HB2 LYS 29 -18.567 -7.548 -4.335
523 HG2 LYS 29 HG3 LYS 29 -16.914 -7.221 -6.087
524 HG3 LYS 29 HG2 LYS 29 -15.819 -6.475 -4.922
525 HD2 LYS 29 HD3 LYS 29 -15.805 -8.592 -3.644
526 HD3 LYS 29 HD2 LYS 29 -16.819 -9.321 -4.890
527 HE2 LYS 29 HE3 LYS 29 -15.054 -8.820 -6.553
528 HE3 LYS 29 HE2 LYS 29 -14.038 -8.211 -5.250
529 HZ1 LYS 29 HZ1 LYS 29 -15.067 -10.985 -5.486
530 HZ2 LYS 29 HZ2 LYS 29 -14.086 -10.404 -4.241
531 HZ3 LYS 29 HZ3 LYS 29 -13.488 -10.488 -5.818
532 H LEU 30 H LEU 30 -18.261 -4.577 -2.102
533 HA LEU 30 HA LEU 30 -20.890 -5.191 -1.264
534 HB2 LEU 30 HB3 LEU 30 -18.818 -3.326 -0.137
535 HB3 LEU 30 HB2 LEU 30 -20.345 -3.656 0.656
536 HG LEU 30 HG LEU 30 -18.199 -5.695 0.056
537 HD11 LEU 30 HD11 LEU 30 -19.064 -4.426 2.648
538 HD12 LEU 30 HD12 LEU 30 -17.537 -4.155 1.810
539 HD13 LEU 30 HD13 LEU 30 -17.901 -5.741 2.485
540 HD21 LEU 30 HD21 LEU 30 -20.818 -5.952 1.531
541 HD22 LEU 30 HD22 LEU 30 -19.561 -7.186 1.460
542 HD23 LEU 30 HD23 LEU 30 -20.404 -6.703 -0.011
543 H VAL 31 H VAL 31 -19.478 -2.316 -2.713
544 HA VAL 31 HA VAL 31 -21.806 -0.696 -2.188
545 HB VAL 31 HB VAL 31 -19.584 -0.085 -4.149
546 HG11 VAL 31 HG11 VAL 31 -20.208 2.234 -3.772
547 HG12 VAL 31 HG12 VAL 31 -21.461 1.732 -2.639
548 HG13 VAL 31 HG13 VAL 31 -21.597 1.309 -4.347
549 HG21 VAL 31 HG21 VAL 31 -18.506 1.149 -2.334
550 HG22 VAL 31 HG22 VAL 31 -18.620 -0.573 -1.966
551 HG23 VAL 31 HG23 VAL 31 -19.735 0.566 -1.211
552 H GLY 32 H GLY 32 -20.702 -2.808 -4.712
553 HA2 GLY 32 HA3 GLY 32 -22.875 -3.567 -5.925
554 HA3 GLY 32 HA2 GLY 32 -22.853 -1.904 -6.496
555 H GLU 33 H GLU 33 -20.085 -4.027 -6.009
556 HA GLU 33 HA GLU 33 -18.428 -4.739 -7.375
557 HB2 GLU 33 HB3 GLU 33 -20.337 -6.147 -8.171
558 HB3 GLU 33 HB2 GLU 33 -20.616 -4.969 -9.446
559 HG2 GLU 33 HG3 GLU 33 -18.326 -5.392 -10.280
560 HG3 GLU 33 HG2 GLU 33 -18.151 -6.652 -9.059
Start of MODEL 7
1 H1 GLY 1 H1 GLY 1 23.873 8.892 -7.972
2 H2 GLY 1 H2 GLY 1 22.474 8.088 -8.477
3 H3 GLY 1 H3 GLY 1 23.836 7.203 -8.012
4 HA2 GLY 1 HA2 GLY 1 23.631 8.007 -5.748
5 HA3 GLY 1 HA3 GLY 1 22.216 8.931 -6.230
6 H SER 2 H SER 2 23.331 6.002 -5.010
7 HA SER 2 HA SER 2 21.167 4.359 -5.938
8 HB2 SER 2 HB3 SER 2 22.124 2.738 -4.230
9 HB3 SER 2 HB2 SER 2 23.229 3.246 -5.506
10 HG SER 2 HG SER 2 23.878 3.299 -3.115
11 H MET 3 H MET 3 22.053 5.860 -2.845
12 HA MET 3 HA MET 3 19.850 4.860 -1.398
13 HB2 MET 3 HB3 MET 3 21.887 6.979 -0.938
14 HB3 MET 3 HB2 MET 3 20.455 6.973 0.081
15 HG2 MET 3 HG3 MET 3 22.315 4.636 -0.289
16 HG3 MET 3 HG2 MET 3 22.353 5.761 1.069
17 HE1 MET 3 HE1 MET 3 22.162 3.683 2.751
18 HE2 MET 3 HE2 MET 3 22.115 2.583 1.372
19 HE3 MET 3 HE3 MET 3 20.895 2.460 2.639
20 H LYS 4 H LYS 4 20.246 7.728 -3.372
21 HA LYS 4 HA LYS 4 17.920 9.070 -2.480
22 HB2 LYS 4 HB3 LYS 4 19.467 9.216 -5.062
23 HB3 LYS 4 HB2 LYS 4 18.049 10.209 -4.756
24 HG2 LYS 4 HG3 LYS 4 20.596 10.209 -3.149
25 HG3 LYS 4 HG2 LYS 4 20.083 11.444 -4.298
26 HD2 LYS 4 HD3 LYS 4 18.069 11.828 -2.882
27 HD3 LYS 4 HD2 LYS 4 18.738 10.706 -1.699
28 HE2 LYS 4 HE3 LYS 4 19.238 12.971 -1.036
29 HE3 LYS 4 HE2 LYS 4 20.726 12.149 -1.500
30 HZ1 LYS 4 HZ1 LYS 4 20.649 13.251 -3.630
31 HZ2 LYS 4 HZ2 LYS 4 20.596 14.398 -2.392
32 HZ3 LYS 4 HZ3 LYS 4 19.186 14.001 -3.232
33 H GLN 5 H GLN 5 18.467 7.018 -5.334
34 HA GLN 5 HA GLN 5 15.762 6.988 -6.154
35 HB2 GLN 5 HB3 GLN 5 18.000 5.040 -6.729
36 HB3 GLN 5 HB2 GLN 5 16.443 5.038 -7.546
37 HG2 GLN 5 HG3 GLN 5 16.886 7.249 -8.440
38 HG3 GLN 5 HG2 GLN 5 18.421 7.307 -7.575
39 HE21 GLN 5 HE21 GLN 5 20.130 6.042 -8.277
40 HE22 GLN 5 HE22 GLN 5 20.167 5.337 -9.858
41 H LEU 6 H LEU 6 17.603 5.074 -3.905
42 HA LEU 6 HA LEU 6 15.759 2.939 -3.645
43 HB2 LEU 6 HB3 LEU 6 18.106 2.763 -2.976
44 HB3 LEU 6 HB2 LEU 6 17.852 3.949 -1.716
45 HG LEU 6 HG LEU 6 16.239 2.371 -0.644
46 HD11 LEU 6 HD11 LEU 6 15.694 1.067 -2.650
47 HD12 LEU 6 HD12 LEU 6 16.253 0.043 -1.330
48 HD13 LEU 6 HD13 LEU 6 17.335 0.425 -2.670
49 HD21 LEU 6 HD21 LEU 6 19.055 1.374 -1.056
50 HD22 LEU 6 HD22 LEU 6 17.981 0.913 0.264
51 HD23 LEU 6 HD23 LEU 6 18.541 2.579 0.125
52 H GLU 7 H GLU 7 16.231 5.968 -1.851
53 HA GLU 7 HA GLU 7 14.302 5.478 0.125
54 HB2 GLU 7 HB3 GLU 7 16.134 7.236 0.115
55 HB3 GLU 7 HB2 GLU 7 15.102 8.179 -0.951
56 HG2 GLU 7 HG3 GLU 7 13.374 8.240 0.751
57 HG3 GLU 7 HG2 GLU 7 14.380 7.248 1.803
58 H ASP 8 H ASP 8 14.155 6.958 -3.068
59 HA ASP 8 HA ASP 8 11.536 7.948 -2.931
60 HB2 ASP 8 HB3 ASP 8 13.336 7.170 -5.190
61 HB3 ASP 8 HB2 ASP 8 11.647 7.535 -5.521
62 H LYS 9 H LYS 9 12.752 4.750 -3.759
63 HA LYS 9 HA LYS 9 10.385 3.675 -4.801
64 HB2 LYS 9 HB3 LYS 9 12.676 2.336 -3.363
65 HB3 LYS 9 HB2 LYS 9 11.370 1.456 -4.146
66 HG2 LYS 9 HG3 LYS 9 11.982 2.399 -6.288
67 HG3 LYS 9 HG2 LYS 9 13.249 3.358 -5.522
68 HD2 LYS 9 HD3 LYS 9 14.393 1.314 -4.837
69 HD3 LYS 9 HD2 LYS 9 13.115 0.343 -5.571
70 HE2 LYS 9 HE3 LYS 9 15.045 0.469 -7.041
71 HE3 LYS 9 HE2 LYS 9 13.665 1.290 -7.763
72 HZ1 LYS 9 HZ1 LYS 9 15.639 2.600 -8.054
73 HZ2 LYS 9 HZ2 LYS 9 15.964 2.579 -6.396
74 HZ3 LYS 9 HZ3 LYS 9 14.606 3.404 -6.982
75 H VAL 10 H VAL 10 11.683 3.422 -1.494
76 HA VAL 10 HA VAL 10 9.398 2.032 -0.512
77 HB VAL 10 HB VAL 10 11.599 1.801 0.540
78 HG11 VAL 10 HG11 VAL 10 11.227 4.650 1.451
79 HG12 VAL 10 HG12 VAL 10 12.432 4.065 0.304
80 HG13 VAL 10 HG13 VAL 10 12.501 3.556 1.991
81 HG21 VAL 10 HG21 VAL 10 10.884 1.964 2.886
82 HG22 VAL 10 HG22 VAL 10 9.644 1.258 1.850
83 HG23 VAL 10 HG23 VAL 10 9.500 2.935 2.380
84 H GLU 11 H GLU 11 10.332 5.446 -0.608
85 HA GLU 11 HA GLU 11 8.223 6.382 1.036
86 HB2 GLU 11 HB3 GLU 11 9.884 7.722 -1.090
87 HB3 GLU 11 HB2 GLU 11 8.625 8.574 -0.205
88 HG2 GLU 11 HG3 GLU 11 10.995 7.212 1.052
89 HG3 GLU 11 HG2 GLU 11 10.876 8.938 0.717
90 H GLU 12 H GLU 12 8.533 6.014 -2.488
91 HA GLU 12 HA GLU 12 5.931 6.862 -3.113
92 HB2 GLU 12 HB3 GLU 12 7.848 5.026 -4.512
93 HB3 GLU 12 HB2 GLU 12 6.250 5.347 -5.167
94 HG2 GLU 12 HG3 GLU 12 8.397 7.378 -4.606
95 HG3 GLU 12 HG2 GLU 12 7.883 6.799 -6.190
96 H LEU 13 H LEU 13 7.074 3.641 -2.094
97 HA LEU 13 HA LEU 13 4.512 2.476 -2.410
98 HB2 LEU 13 HB3 LEU 13 7.091 1.668 -1.282
99 HB3 LEU 13 HB2 LEU 13 5.688 0.860 -0.596
100 HG LEU 13 HG LEU 13 5.907 1.104 -3.550
101 HD11 LEU 13 HD11 LEU 13 7.163 -1.012 -3.634
102 HD12 LEU 13 HD12 LEU 13 7.332 -0.975 -1.879
103 HD13 LEU 13 HD13 LEU 13 8.103 0.269 -2.865
104 HD21 LEU 13 HD21 LEU 13 4.804 -1.038 -1.736
105 HD22 LEU 13 HD22 LEU 13 4.667 -0.982 -3.492
106 HD23 LEU 13 HD23 LEU 13 3.867 0.241 -2.506
107 H LEU 14 H LEU 14 6.048 4.108 0.358
108 HA LEU 14 HA LEU 14 3.891 3.765 2.131
109 HB2 LEU 14 HB3 LEU 14 5.709 6.139 1.734
110 HB3 LEU 14 HB2 LEU 14 4.573 6.001 3.064
111 HG LEU 14 HG LEU 14 7.212 4.688 2.683
112 HD11 LEU 14 HD11 LEU 14 7.103 6.454 4.282
113 HD12 LEU 14 HD12 LEU 14 7.206 4.944 5.182
114 HD13 LEU 14 HD13 LEU 14 5.655 5.767 5.024
115 HD21 LEU 14 HD21 LEU 14 5.806 2.722 2.729
116 HD22 LEU 14 HD22 LEU 14 4.951 3.333 4.149
117 HD23 LEU 14 HD23 LEU 14 6.652 2.890 4.266
118 H SER 15 H SER 15 4.537 6.220 -0.323
119 HA SER 15 HA SER 15 2.223 7.699 -0.178
120 HB2 SER 15 HB3 SER 15 3.740 6.909 -2.677
121 HB3 SER 15 HB2 SER 15 2.598 8.247 -2.552
122 HG SER 15 HG SER 15 4.957 8.005 -0.980
123 H LYS 16 H LYS 16 2.781 4.716 -2.128
124 HA LYS 16 HA LYS 16 0.106 4.607 -3.025
125 HB2 LYS 16 HB3 LYS 16 2.300 2.580 -2.862
126 HB3 LYS 16 HB2 LYS 16 0.675 2.092 -3.330
127 HG2 LYS 16 HG3 LYS 16 0.744 3.806 -5.132
128 HG3 LYS 16 HG2 LYS 16 2.427 4.113 -4.708
129 HD2 LYS 16 HD3 LYS 16 1.394 1.391 -5.466
130 HD3 LYS 16 HD2 LYS 16 2.038 2.537 -6.642
131 HE2 LYS 16 HE3 LYS 16 3.537 1.508 -4.239
132 HE3 LYS 16 HE2 LYS 16 3.697 0.872 -5.873
133 HZ1 LYS 16 HZ1 LYS 16 5.447 2.454 -5.346
134 HZ2 LYS 16 HZ2 LYS 16 4.299 3.664 -5.061
135 HZ3 LYS 16 HZ3 LYS 16 4.482 3.019 -6.611
136 H ASN 17 H ASN 17 1.665 2.839 -0.329
137 HA ASN 17 HA ASN 17 -0.520 1.335 0.465
138 HB2 ASN 17 HB3 ASN 17 1.749 0.993 1.322
139 HB3 ASN 17 HB2 ASN 17 1.662 2.517 2.196
140 HD21 ASN 17 HD21 ASN 17 1.994 1.576 4.179
141 HD22 ASN 17 HD22 ASN 17 0.801 0.602 4.963
142 H TYR 18 H TYR 18 0.496 4.450 1.928
143 HA TYR 18 HA TYR 18 -1.726 4.537 3.669
144 HB2 TYR 18 HB3 TYR 18 0.238 6.655 2.813
145 HB3 TYR 18 HB2 TYR 18 -1.030 6.948 3.999
146 HD1 TYR 18 HD1 TYR 18 2.275 5.680 3.461
147 HD2 TYR 18 HD2 TYR 18 -1.062 5.490 6.092
148 HE1 TYR 18 HE1 TYR 18 3.728 4.792 5.233
149 HE2 TYR 18 HE2 TYR 18 0.386 4.604 7.872
150 HH TYR 18 HH TYR 18 2.516 3.405 8.084
151 H HIS 19 H HIS 19 -1.152 6.025 0.501
152 HA HIS 19 HA HIS 19 -3.578 7.550 0.612
153 HB2 HIS 19 HB3 HIS 19 -1.590 6.993 -1.567
154 HB3 HIS 19 HB2 HIS 19 -3.115 7.796 -1.920
155 HD1 HIS 19 HD1 HIS 19 -3.093 10.260 -1.694
156 HD2 HIS 19 HD2 HIS 19 -0.055 8.476 0.514
157 HE1 HIS 19 HE1 HIS 19 -1.757 12.157 -0.727
158 HE2 HIS 19 HE2 HIS 19 0.004 11.056 0.700
159 H LEU 20 H LEU 20 -2.712 4.357 -0.521
160 HA LEU 20 HA LEU 20 -5.140 3.899 -1.920
161 HB2 LEU 20 HB3 LEU 20 -3.164 2.526 -2.315
162 HB3 LEU 20 HB2 LEU 20 -3.182 1.981 -0.651
163 HG LEU 20 HG LEU 20 -5.322 0.854 -1.059
164 HD11 LEU 20 HD11 LEU 20 -6.120 0.566 -3.359
165 HD12 LEU 20 HD12 LEU 20 -4.890 1.699 -3.919
166 HD13 LEU 20 HD13 LEU 20 -6.180 2.252 -2.852
167 HD21 LEU 20 HD21 LEU 20 -4.422 -0.956 -2.423
168 HD22 LEU 20 HD22 LEU 20 -3.219 -0.357 -1.285
169 HD23 LEU 20 HD23 LEU 20 -3.132 0.103 -2.984
170 H GLU 21 H GLU 21 -4.013 3.494 1.399
171 HA GLU 21 HA GLU 21 -6.328 2.221 2.397
172 HB2 GLU 21 HB3 GLU 21 -4.135 2.456 3.600
173 HB3 GLU 21 HB2 GLU 21 -4.560 4.132 3.918
174 HG2 GLU 21 HG3 GLU 21 -6.476 3.454 5.204
175 HG3 GLU 21 HG2 GLU 21 -6.196 1.763 4.792
176 H ASN 22 H ASN 22 -5.574 5.579 1.752
177 HA ASN 22 HA ASN 22 -7.815 6.783 2.946
178 HB2 ASN 22 HB3 ASN 22 -6.269 7.581 0.473
179 HB3 ASN 22 HB2 ASN 22 -7.488 8.590 1.238
180 HD21 ASN 22 HD21 ASN 22 -6.753 7.882 3.936
181 HD22 ASN 22 HD22 ASN 22 -5.250 8.673 4.255
182 H GLU 23 H GLU 23 -7.359 5.112 -0.073
183 HA GLU 23 HA GLU 23 -9.824 5.898 -1.272
184 HB2 GLU 23 HB3 GLU 23 -7.885 5.212 -2.609
185 HB3 GLU 23 HB2 GLU 23 -7.977 3.583 -1.907
186 HG2 GLU 23 HG3 GLU 23 -10.229 3.347 -2.919
187 HG3 GLU 23 HG2 GLU 23 -9.999 4.907 -3.708
188 H VAL 24 H VAL 24 -8.741 3.100 0.604
189 HA VAL 24 HA VAL 24 -11.131 1.608 0.223
190 HB VAL 24 HB VAL 24 -10.213 -0.008 1.484
191 HG11 VAL 24 HG11 VAL 24 -7.759 1.697 1.375
192 HG12 VAL 24 HG12 VAL 24 -8.408 0.797 0.012
193 HG13 VAL 24 HG13 VAL 24 -7.838 -0.063 1.443
194 HG21 VAL 24 HG21 VAL 24 -10.616 1.080 3.617
195 HG22 VAL 24 HG22 VAL 24 -9.137 2.021 3.428
196 HG23 VAL 24 HG23 VAL 24 -9.050 0.270 3.612
197 H ALA 25 H ALA 25 -10.082 4.030 2.471
198 HA ALA 25 HA ALA 25 -12.181 3.841 4.333
199 HB1 ALA 25 HB1 ALA 25 -10.124 5.142 4.715
200 HB2 ALA 25 HB2 ALA 25 -11.584 6.085 5.012
201 HB3 ALA 25 HB3 ALA 25 -10.673 6.320 3.523
202 H ARG 26 H ARG 26 -11.925 5.382 1.204
203 HA ARG 26 HA ARG 26 -14.301 6.906 1.292
204 HB2 ARG 26 HB3 ARG 26 -12.981 5.618 -1.109
205 HB3 ARG 26 HB2 ARG 26 -14.192 6.890 -1.166
206 HG2 ARG 26 HG3 ARG 26 -11.409 7.116 -0.038
207 HG3 ARG 26 HG2 ARG 26 -11.994 7.802 -1.555
208 HD2 ARG 26 HD2 ARG 26 -13.636 9.139 -0.252
209 HD3 ARG 26 HD1 ARG 26 -12.897 8.530 1.228
210 HE ARG 26 HE ARG 26 -10.886 9.650 -0.360
211 HH11 ARG 26 HH11 ARG 26 -13.707 10.653 1.451
212 HH12 ARG 26 HH12 ARG 26 -13.091 12.240 1.777
213 HH21 ARG 26 HH21 ARG 26 -10.077 11.739 0.059
214 HH22 ARG 26 HH22 ARG 26 -11.024 12.860 0.984
215 H LEU 27 H LEU 27 -13.618 3.695 -0.048
216 HA LEU 27 HA LEU 27 -16.220 2.998 -0.769
217 HB2 LEU 27 HB3 LEU 27 -13.982 1.207 0.178
218 HB3 LEU 27 HB2 LEU 27 -15.440 0.678 -0.627
219 HG LEU 27 HG LEU 27 -13.696 2.648 -1.998
220 HD11 LEU 27 HD11 LEU 27 -12.334 0.943 -2.937
221 HD12 LEU 27 HD12 LEU 27 -13.260 -0.317 -2.125
222 HD13 LEU 27 HD13 LEU 27 -12.254 0.781 -1.182
223 HD21 LEU 27 HD21 LEU 27 -15.497 0.414 -2.894
224 HD22 LEU 27 HD22 LEU 27 -14.582 1.472 -3.970
225 HD23 LEU 27 HD23 LEU 27 -15.860 2.140 -2.954
226 H LYS 28 H LYS 28 -14.488 2.582 2.268
227 HA LYS 28 HA LYS 28 -16.306 1.095 3.710
228 HB2 LYS 28 HB3 LYS 28 -14.060 1.760 4.499
229 HB3 LYS 28 HB2 LYS 28 -14.636 3.404 4.723
230 HG2 LYS 28 HG3 LYS 28 -14.558 2.273 6.840
231 HG3 LYS 28 HG2 LYS 28 -16.239 2.586 6.404
232 HD2 LYS 28 HD3 LYS 28 -16.481 0.281 5.644
233 HD3 LYS 28 HD2 LYS 28 -14.788 -0.035 6.037
234 HE2 LYS 28 HE3 LYS 28 -15.231 0.409 8.384
235 HE3 LYS 28 HE2 LYS 28 -16.907 0.799 8.012
236 HZ1 LYS 28 HZ1 LYS 28 -15.601 -1.844 7.679
237 HZ2 LYS 28 HZ2 LYS 28 -17.184 -1.488 7.204
238 HZ3 LYS 28 HZ3 LYS 28 -16.762 -1.430 8.840
239 H LYS 29 H LYS 29 -16.330 4.591 3.112
240 HA LYS 29 HA LYS 29 -18.536 5.126 4.826
241 HB2 LYS 29 HB3 LYS 29 -17.593 6.806 2.501
242 HB3 LYS 29 HB2 LYS 29 -18.486 7.338 3.911
243 HG2 LYS 29 HG3 LYS 29 -15.628 6.417 3.821
244 HG3 LYS 29 HG2 LYS 29 -16.214 8.052 4.115
245 HD2 LYS 29 HD3 LYS 29 -16.741 5.678 5.901
246 HD3 LYS 29 HD2 LYS 29 -15.489 6.889 6.175
247 HE2 LYS 29 HE3 LYS 29 -17.175 8.621 6.373
248 HE3 LYS 29 HE2 LYS 29 -18.447 7.453 6.014
249 HZ1 LYS 29 HZ1 LYS 29 -18.274 7.859 8.381
250 HZ2 LYS 29 HZ2 LYS 29 -16.650 7.385 8.376
251 HZ3 LYS 29 HZ3 LYS 29 -17.864 6.255 8.025
252 H LEU 30 H LEU 30 -18.150 4.321 1.445
253 HA LEU 30 HA LEU 30 -20.846 4.919 0.713
254 HB2 LEU 30 HB3 LEU 30 -18.514 3.622 -0.601
255 HB3 LEU 30 HB2 LEU 30 -20.102 3.316 -1.272
256 HG LEU 30 HG LEU 30 -18.902 5.119 -2.439
257 HD11 LEU 30 HD11 LEU 30 -20.700 6.688 -2.544
258 HD12 LEU 30 HD12 LEU 30 -21.297 6.192 -0.966
259 HD13 LEU 30 HD13 LEU 30 -21.381 5.077 -2.328
260 HD21 LEU 30 HD21 LEU 30 -17.612 6.013 -0.594
261 HD22 LEU 30 HD22 LEU 30 -19.087 6.580 0.188
262 HD23 LEU 30 HD23 LEU 30 -18.576 7.283 -1.346
263 H VAL 31 H VAL 31 -19.151 2.107 1.907
264 HA VAL 31 HA VAL 31 -21.172 0.218 1.285
265 HB VAL 31 HB VAL 31 -19.024 0.091 3.421
266 HG11 VAL 31 HG11 VAL 31 -19.434 -2.322 3.446
267 HG12 VAL 31 HG12 VAL 31 -20.786 -2.104 2.334
268 HG13 VAL 31 HG13 VAL 31 -20.862 -1.423 3.959
269 HG21 VAL 31 HG21 VAL 31 -19.163 -1.079 0.646
270 HG22 VAL 31 HG22 VAL 31 -17.884 -1.381 1.822
271 HG23 VAL 31 HG23 VAL 31 -18.121 0.243 1.176
272 H GLY 32 H GLY 32 -20.710 2.448 3.968
273 HA2 GLY 32 HA3 GLY 32 -23.345 2.538 4.721
274 HA3 GLY 32 HA2 GLY 32 -22.682 1.191 5.628
275 H GLU 33 H GLU 33 -21.236 4.309 4.764
276 HA GLU 33 HA GLU 33 -20.383 6.005 5.996
277 HB2 GLU 33 HB3 GLU 33 -22.457 5.154 8.022
278 HB3 GLU 33 HB2 GLU 33 -21.615 6.697 7.997
279 HG2 GLU 33 HG3 GLU 33 -22.644 7.214 5.836
280 HG3 GLU 33 HG2 GLU 33 -23.499 5.675 5.883
281 H1 GLY 1 H1 GLY 1 23.888 -9.158 7.223
282 H2 GLY 1 H2 GLY 1 22.497 -8.355 7.746
283 H3 GLY 1 H3 GLY 1 23.860 -7.470 7.289
284 HA2 GLY 1 HA2 GLY 1 23.641 -8.234 5.017
285 HA3 GLY 1 HA3 GLY 1 22.228 -9.167 5.490
286 H SER 2 H SER 2 23.340 -6.217 4.313
287 HA SER 2 HA SER 2 21.179 -4.589 5.277
288 HB2 SER 2 HB3 SER 2 22.129 -2.941 3.581
289 HB3 SER 2 HB2 SER 2 23.227 -3.456 4.860
290 HG SER 2 HG SER 2 23.856 -3.493 2.443
291 H MET 3 H MET 3 22.055 -6.040 2.154
292 HA MET 3 HA MET 3 19.845 -5.019 0.731
293 HB2 MET 3 HB3 MET 3 21.881 -7.130 0.229
294 HB3 MET 3 HB2 MET 3 20.445 -7.108 -0.785
295 HG2 MET 3 HG3 MET 3 22.309 -4.780 -0.381
296 HG3 MET 3 HG2 MET 3 22.339 -5.879 -1.760
297 HE1 MET 3 HE1 MET 3 22.146 -3.782 -3.410
298 HE2 MET 3 HE2 MET 3 22.113 -2.699 -2.019
299 HE3 MET 3 HE3 MET 3 20.884 -2.555 -3.277
300 H LYS 4 H LYS 4 20.248 -7.917 2.657
301 HA LYS 4 HA LYS 4 17.922 -9.246 1.749
302 HB2 LYS 4 HB3 LYS 4 19.476 -9.431 4.324
303 HB3 LYS 4 HB2 LYS 4 18.057 -10.420 4.009
304 HG2 LYS 4 HG3 LYS 4 20.599 -10.396 2.393
305 HG3 LYS 4 HG2 LYS 4 20.087 -11.648 3.526
306 HD2 LYS 4 HD3 LYS 4 18.070 -12.014 2.112
307 HD3 LYS 4 HD2 LYS 4 18.735 -10.872 0.944
308 HE2 LYS 4 HE3 LYS 4 19.236 -13.129 0.247
309 HE3 LYS 4 HE2 LYS 4 20.724 -12.307 0.713
310 HZ1 LYS 4 HZ1 LYS 4 20.663 -13.437 2.834
311 HZ2 LYS 4 HZ2 LYS 4 20.612 -14.570 1.580
312 HZ3 LYS 4 HZ3 LYS 4 19.204 -14.191 2.431
313 H GLN 5 H GLN 5 18.478 -7.242 4.634
314 HA GLN 5 HA GLN 5 15.775 -7.223 5.461
315 HB2 GLN 5 HB3 GLN 5 18.014 -5.286 6.061
316 HB3 GLN 5 HB2 GLN 5 16.462 -5.299 6.884
317 HG2 GLN 5 HG3 GLN 5 16.908 -7.526 7.735
318 HG3 GLN 5 HG2 GLN 5 18.442 -7.566 6.867
319 HE21 GLN 5 HE21 GLN 5 20.149 -6.306 7.588
320 HE22 GLN 5 HE22 GLN 5 20.185 -5.626 9.179
321 H LEU 6 H LEU 6 17.605 -5.280 3.231
322 HA LEU 6 HA LEU 6 15.763 -3.134 3.023
323 HB2 LEU 6 HB3 LEU 6 18.108 -2.944 2.347
324 HB3 LEU 6 HB2 LEU 6 17.853 -4.111 1.070
325 HG LEU 6 HG LEU 6 16.232 -2.517 0.027
326 HD11 LEU 6 HD11 LEU 6 15.697 -1.247 2.058
327 HD12 LEU 6 HD12 LEU 6 16.249 -0.200 0.752
328 HD13 LEU 6 HD13 LEU 6 17.339 -0.602 2.079
329 HD21 LEU 6 HD21 LEU 6 19.053 -1.529 0.443
330 HD22 LEU 6 HD22 LEU 6 17.972 -1.047 -0.865
331 HD23 LEU 6 HD23 LEU 6 18.532 -2.714 -0.754
332 H GLU 7 H GLU 7 16.230 -6.130 1.172
333 HA GLU 7 HA GLU 7 14.287 -5.613 -0.783
334 HB2 GLU 7 HB3 GLU 7 16.122 -7.371 -0.814
335 HB3 GLU 7 HB2 GLU 7 15.098 -8.331 0.242
336 HG2 GLU 7 HG3 GLU 7 13.360 -8.371 -1.450
337 HG3 GLU 7 HG2 GLU 7 14.356 -7.356 -2.489
338 H ASP 8 H ASP 8 14.156 -7.147 2.386
339 HA ASP 8 HA ASP 8 11.539 -8.139 2.242
340 HB2 ASP 8 HB3 ASP 8 13.346 -7.396 4.508
341 HB3 ASP 8 HB2 ASP 8 11.656 -7.761 4.838
342 H LYS 9 H LYS 9 12.752 -4.949 3.117
343 HA LYS 9 HA LYS 9 10.388 -3.889 4.184
344 HB2 LYS 9 HB3 LYS 9 12.677 -2.536 2.756
345 HB3 LYS 9 HB2 LYS 9 11.376 -1.661 3.553
346 HG2 LYS 9 HG3 LYS 9 11.989 -2.630 5.682
347 HG3 LYS 9 HG2 LYS 9 13.254 -3.585 4.905
348 HD2 LYS 9 HD3 LYS 9 14.399 -1.532 4.240
349 HD3 LYS 9 HD2 LYS 9 13.124 -0.570 4.994
350 HE2 LYS 9 HE3 LYS 9 15.058 -0.720 6.457
351 HE3 LYS 9 HE2 LYS 9 13.679 -1.554 7.169
352 HZ1 LYS 9 HZ1 LYS 9 15.655 -2.864 7.434
353 HZ2 LYS 9 HZ2 LYS 9 15.975 -2.821 5.776
354 HZ3 LYS 9 HZ3 LYS 9 14.623 -3.655 6.355
355 H VAL 10 H VAL 10 11.680 -3.584 0.879
356 HA VAL 10 HA VAL 10 9.393 -2.185 -0.074
357 HB VAL 10 HB VAL 10 11.585 -1.935 -1.132
358 HG11 VAL 10 HG11 VAL 10 11.216 -4.772 -2.084
359 HG12 VAL 10 HG12 VAL 10 12.424 -4.203 -0.931
360 HG13 VAL 10 HG13 VAL 10 12.485 -3.667 -2.611
361 HG21 VAL 10 HG21 VAL 10 10.861 -2.070 -3.477
362 HG22 VAL 10 HG22 VAL 10 9.625 -1.379 -2.428
363 HG23 VAL 10 HG23 VAL 10 9.480 -3.048 -2.977
364 H GLU 11 H GLU 11 10.324 -5.597 -0.037
365 HA GLU 11 HA GLU 11 8.209 -6.510 -1.688
366 HB2 GLU 11 HB3 GLU 11 9.875 -7.880 0.414
367 HB3 GLU 11 HB2 GLU 11 8.616 -8.719 -0.480
368 HG2 GLU 11 HG3 GLU 11 10.980 -7.337 -1.722
369 HG3 GLU 11 HG2 GLU 11 10.866 -9.068 -1.410
370 H GLU 12 H GLU 12 8.529 -6.192 1.840
371 HA GLU 12 HA GLU 12 5.929 -7.052 2.460
372 HB2 GLU 12 HB3 GLU 12 7.850 -5.241 3.883
373 HB3 GLU 12 HB2 GLU 12 6.252 -5.575 4.537
374 HG2 GLU 12 HG3 GLU 12 8.399 -7.596 3.933
375 HG3 GLU 12 HG2 GLU 12 7.897 -7.038 5.529
376 H LEU 13 H LEU 13 7.070 -3.815 1.492
377 HA LEU 13 HA LEU 13 4.510 -2.659 1.831
378 HB2 LEU 13 HB3 LEU 13 7.088 -1.833 0.710
379 HB3 LEU 13 HB2 LEU 13 5.685 -1.016 0.038
380 HG LEU 13 HG LEU 13 5.908 -1.300 2.988
381 HD11 LEU 13 HD11 LEU 13 7.162 0.817 3.098
382 HD12 LEU 13 HD12 LEU 13 7.328 0.805 1.343
383 HD13 LEU 13 HD13 LEU 13 8.101 -0.450 2.310
384 HD21 LEU 13 HD21 LEU 13 4.799 0.865 1.205
385 HD22 LEU 13 HD22 LEU 13 4.667 0.786 2.961
386 HD23 LEU 13 HD23 LEU 13 3.865 -0.423 1.962
387 H LEU 14 H LEU 14 6.033 -4.253 -0.968
388 HA LEU 14 HA LEU 14 3.873 -3.877 -2.730
389 HB2 LEU 14 HB3 LEU 14 5.694 -6.254 -2.373
390 HB3 LEU 14 HB2 LEU 14 4.556 -6.097 -3.699
391 HG LEU 14 HG LEU 14 7.197 -4.791 -3.305
392 HD11 LEU 14 HD11 LEU 14 7.080 -6.533 -4.933
393 HD12 LEU 14 HD12 LEU 14 7.179 -5.008 -5.811
394 HD13 LEU 14 HD13 LEU 14 5.629 -5.834 -5.658
395 HD21 LEU 14 HD21 LEU 14 5.792 -2.825 -3.315
396 HD22 LEU 14 HD22 LEU 14 4.930 -3.413 -4.740
397 HD23 LEU 14 HD23 LEU 14 6.631 -2.969 -4.859
398 H SER 15 H SER 15 4.525 -6.365 -0.317
399 HA SER 15 HA SER 15 2.211 -7.845 -0.477
400 HB2 SER 15 HB3 SER 15 3.736 -7.101 2.032
401 HB3 SER 15 HB2 SER 15 2.602 -8.443 1.879
402 HG SER 15 HG SER 15 4.957 -8.147 0.311
403 H LYS 16 H LYS 16 2.778 -4.890 1.515
404 HA LYS 16 HA LYS 16 0.103 -4.798 2.426
405 HB2 LYS 16 HB3 LYS 16 2.297 -2.766 2.287
406 HB3 LYS 16 HB2 LYS 16 0.675 -2.288 2.770
407 HG2 LYS 16 HG3 LYS 16 0.750 -4.028 4.543
408 HG3 LYS 16 HG2 LYS 16 2.433 -4.331 4.108
409 HD2 LYS 16 HD3 LYS 16 1.401 -1.622 4.921
410 HD3 LYS 16 HD2 LYS 16 2.059 -2.788 6.070
411 HE2 LYS 16 HE3 LYS 16 3.538 -1.711 3.674
412 HE3 LYS 16 HE2 LYS 16 3.707 -1.102 5.318
413 HZ1 LYS 16 HZ1 LYS 16 5.453 -2.672 4.749
414 HZ2 LYS 16 HZ2 LYS 16 4.305 -3.878 4.455
415 HZ3 LYS 16 HZ3 LYS 16 4.502 -3.259 6.014
416 H ASN 17 H ASN 17 1.656 -2.982 -0.244
417 HA ASN 17 HA ASN 17 -0.530 -1.472 -1.010
418 HB2 ASN 17 HB3 ASN 17 1.736 -1.118 -1.870
419 HB3 ASN 17 HB2 ASN 17 1.643 -2.627 -2.770
420 HD21 ASN 17 HD21 ASN 17 1.962 -1.653 -4.742
421 HD22 ASN 17 HD22 ASN 17 0.764 -0.660 -5.499
422 H TYR 18 H TYR 18 0.478 -4.564 -2.520
423 HA TYR 18 HA TYR 18 -1.748 -4.626 -4.260
424 HB2 TYR 18 HB3 TYR 18 0.220 -6.754 -3.439
425 HB3 TYR 18 HB2 TYR 18 -1.049 -7.032 -4.627
426 HD1 TYR 18 HD1 TYR 18 2.256 -5.769 -4.081
427 HD2 TYR 18 HD2 TYR 18 -1.093 -5.542 -6.694
428 HE1 TYR 18 HE1 TYR 18 3.700 -4.856 -5.845
429 HE2 TYR 18 HE2 TYR 18 0.346 -4.629 -8.465
430 HH TYR 18 HH TYR 18 2.482 -3.431 -8.674
431 H HIS 19 H HIS 19 -1.165 -6.154 -1.113
432 HA HIS 19 HA HIS 19 -3.591 -7.684 -1.242
433 HB2 HIS 19 HB3 HIS 19 -1.595 -7.165 0.939
434 HB3 HIS 19 HB2 HIS 19 -3.120 -7.972 1.287
435 HD1 HIS 19 HD1 HIS 19 -3.107 -10.431 1.016
436 HD2 HIS 19 HD2 HIS 19 -0.064 -8.614 -1.160
437 HE1 HIS 19 HE1 HIS 19 -1.766 -12.314 0.023
438 HE2 HIS 19 HE2 HIS 19 -0.012 -11.190 -1.393
439 H LEU 20 H LEU 20 -2.720 -4.508 -0.062
440 HA LEU 20 HA LEU 20 -5.142 -4.075 1.356
441 HB2 LEU 20 HB3 LEU 20 -3.164 -2.710 1.766
442 HB3 LEU 20 HB2 LEU 20 -3.189 -2.141 0.109
443 HG LEU 20 HG LEU 20 -5.328 -1.021 0.541
444 HD11 LEU 20 HD11 LEU 20 -6.118 -0.768 2.849
445 HD12 LEU 20 HD12 LEU 20 -4.886 -1.911 3.386
446 HD13 LEU 20 HD13 LEU 20 -6.180 -2.447 2.314
447 HD21 LEU 20 HD21 LEU 20 -4.425 0.772 1.930
448 HD22 LEU 20 HD22 LEU 20 -3.225 0.193 0.776
449 HD23 LEU 20 HD23 LEU 20 -3.129 -0.293 2.467
450 H GLU 21 H GLU 21 -4.030 -3.626 -1.962
451 HA GLU 21 HA GLU 21 -6.347 -2.336 -2.932
452 HB2 GLU 21 HB3 GLU 21 -4.155 -2.548 -4.145
453 HB3 GLU 21 HB2 GLU 21 -4.582 -4.219 -4.494
454 HG2 GLU 21 HG3 GLU 21 -6.504 -3.515 -5.757
455 HG3 GLU 21 HG2 GLU 21 -6.220 -1.833 -5.315
456 H ASN 22 H ASN 22 -5.588 -5.701 -2.343
457 HA ASN 22 HA ASN 22 -7.831 -6.886 -3.551
458 HB2 ASN 22 HB3 ASN 22 -6.267 -7.723 -1.102
459 HB3 ASN 22 HB2 ASN 22 -7.491 -8.722 -1.874
460 HD21 ASN 22 HD21 ASN 22 -6.774 -7.971 -4.570
461 HD22 ASN 22 HD22 ASN 22 -5.274 -8.759 -4.910
462 H GLU 23 H GLU 23 -7.366 -5.260 -0.510
463 HA GLU 23 HA GLU 23 -9.826 -6.068 0.688
464 HB2 GLU 23 HB3 GLU 23 -7.883 -5.398 2.034
465 HB3 GLU 23 HB2 GLU 23 -7.980 -3.758 1.360
466 HG2 GLU 23 HG3 GLU 23 -10.233 -3.543 2.376
467 HG3 GLU 23 HG2 GLU 23 -10.004 -5.118 3.135
468 H VAL 24 H VAL 24 -8.751 -3.241 -1.150
469 HA VAL 24 HA VAL 24 -11.140 -1.759 -0.733
470 HB VAL 24 HB VAL 24 -10.227 -0.120 -1.969
471 HG11 VAL 24 HG11 VAL 24 -7.772 -1.827 -1.901
472 HG12 VAL 24 HG12 VAL 24 -8.415 -0.948 -0.523
473 HG13 VAL 24 HG13 VAL 24 -7.850 -0.065 -1.943
474 HG21 VAL 24 HG21 VAL 24 -10.643 -1.171 -4.120
475 HG22 VAL 24 HG22 VAL 24 -9.165 -2.116 -3.955
476 HG23 VAL 24 HG23 VAL 24 -9.077 -0.361 -4.109
477 H ALA 25 H ALA 25 -10.099 -4.143 -3.028
478 HA ALA 25 HA ALA 25 -12.212 -3.921 -4.875
479 HB1 ALA 25 HB1 ALA 25 -10.156 -5.213 -5.291
480 HB2 ALA 25 HB2 ALA 25 -11.618 -6.151 -5.597
481 HB3 ALA 25 HB3 ALA 25 -10.697 -6.411 -4.118
482 H ARG 26 H ARG 26 -11.938 -5.517 -1.772
483 HA ARG 26 HA ARG 26 -14.316 -7.039 -1.874
484 HB2 ARG 26 HB3 ARG 26 -12.988 -5.789 0.543
485 HB3 ARG 26 HB2 ARG 26 -14.198 -7.062 0.584
486 HG2 ARG 26 HG3 ARG 26 -11.420 -7.267 -0.559
487 HG3 ARG 26 HG2 ARG 26 -11.998 -7.978 0.948
488 HD2 ARG 26 HD2 ARG 26 -13.642 -9.296 -0.367
489 HD3 ARG 26 HD1 ARG 26 -12.912 -8.660 -1.841
490 HE ARG 26 HE ARG 26 -10.888 -9.800 -0.284
491 HH11 ARG 26 HH11 ARG 26 -13.707 -10.784 -2.106
492 HH12 ARG 26 HH12 ARG 26 -13.093 -12.372 -2.441
493 HH21 ARG 26 HH21 ARG 26 -10.079 -11.886 -0.716
494 HH22 ARG 26 HH22 ARG 26 -11.032 -13.002 -1.646
495 H LEU 27 H LEU 27 -13.626 -3.846 -0.491
496 HA LEU 27 HA LEU 27 -16.229 -3.166 0.253
497 HB2 LEU 27 HB3 LEU 27 -13.994 -1.359 -0.672
498 HB3 LEU 27 HB2 LEU 27 -15.450 -0.838 0.141
499 HG LEU 27 HG LEU 27 -13.700 -2.827 1.482
500 HD11 LEU 27 HD11 LEU 27 -12.337 -1.132 2.440
501 HD12 LEU 27 HD12 LEU 27 -13.269 0.137 1.648
502 HD13 LEU 27 HD13 LEU 27 -12.263 -0.948 0.687
503 HD21 LEU 27 HD21 LEU 27 -15.505 -0.607 2.416
504 HD22 LEU 27 HD22 LEU 27 -14.584 -1.680 3.474
505 HD23 LEU 27 HD23 LEU 27 -15.863 -2.336 2.453
506 H LYS 28 H LYS 28 -14.508 -2.703 -2.784
507 HA LYS 28 HA LYS 28 -16.330 -1.192 -4.201
508 HB2 LYS 28 HB3 LYS 28 -14.086 -1.841 -5.006
509 HB3 LYS 28 HB2 LYS 28 -14.660 -3.482 -5.252
510 HG2 LYS 28 HG3 LYS 28 -14.594 -2.322 -7.354
511 HG3 LYS 28 HG2 LYS 28 -16.271 -2.644 -6.913
512 HD2 LYS 28 HD3 LYS 28 -16.512 -0.350 -6.118
513 HD3 LYS 28 HD2 LYS 28 -14.825 -0.025 -6.518
514 HE2 LYS 28 HE3 LYS 28 -15.287 -0.443 -8.869
515 HE3 LYS 28 HE2 LYS 28 -16.964 -0.830 -8.486
516 HZ1 LYS 28 HZ1 LYS 28 -15.638 1.799 -8.132
517 HZ2 LYS 28 HZ2 LYS 28 -17.218 1.450 -7.648
518 HZ3 LYS 28 HZ3 LYS 28 -16.809 1.412 -9.287
519 H LYS 29 H LYS 29 -16.357 -4.690 -3.651
520 HA LYS 29 HA LYS 29 -18.565 -5.200 -5.367
521 HB2 LYS 29 HB3 LYS 29 -17.612 -6.913 -3.073
522 HB3 LYS 29 HB2 LYS 29 -18.508 -7.424 -4.488
523 HG2 LYS 29 HG3 LYS 29 -15.650 -6.504 -4.390
524 HG3 LYS 29 HG2 LYS 29 -16.238 -8.135 -4.709
525 HD2 LYS 29 HD3 LYS 29 -16.767 -5.733 -6.454
526 HD3 LYS 29 HD2 LYS 29 -15.515 -6.940 -6.750
527 HE2 LYS 29 HE3 LYS 29 -17.202 -8.669 -6.974
528 HE3 LYS 29 HE2 LYS 29 -18.471 -7.507 -6.588
529 HZ1 LYS 29 HZ1 LYS 29 -18.308 -7.872 -8.966
530 HZ2 LYS 29 HZ2 LYS 29 -16.687 -7.390 -8.958
531 HZ3 LYS 29 HZ3 LYS 29 -17.903 -6.273 -8.582
532 H LEU 30 H LEU 30 -18.161 -4.459 -1.974
533 HA LEU 30 HA LEU 30 -20.859 -5.057 -1.238
534 HB2 LEU 30 HB3 LEU 30 -18.525 -3.774 0.090
535 HB3 LEU 30 HB2 LEU 30 -20.113 -3.489 0.768
536 HG LEU 30 HG LEU 30 -18.904 -5.309 1.903
537 HD11 LEU 30 HD11 LEU 30 -20.700 -6.880 1.984
538 HD12 LEU 30 HD12 LEU 30 -21.300 -6.361 0.415
539 HD13 LEU 30 HD13 LEU 30 -21.384 -5.266 1.795
540 HD21 LEU 30 HD21 LEU 30 -17.616 -6.172 0.037
541 HD22 LEU 30 HD22 LEU 30 -19.095 -6.726 -0.749
542 HD23 LEU 30 HD23 LEU 30 -18.579 -7.455 0.771
543 H VAL 31 H VAL 31 -19.171 -2.230 -2.397
544 HA VAL 31 HA VAL 31 -21.189 -0.350 -1.737
545 HB VAL 31 HB VAL 31 -19.050 -0.193 -3.879
546 HG11 VAL 31 HG11 VAL 31 -19.456 2.219 -3.864
547 HG12 VAL 31 HG12 VAL 31 -20.807 1.983 -2.753
548 HG13 VAL 31 HG13 VAL 31 -20.885 1.327 -4.388
549 HG21 VAL 31 HG21 VAL 31 -19.177 0.927 -1.088
550 HG22 VAL 31 HG22 VAL 31 -17.902 1.250 -2.263
551 HG23 VAL 31 HG23 VAL 31 -18.138 -0.385 -1.643
552 H GLY 32 H GLY 32 -20.734 -2.542 -4.458
553 HA2 GLY 32 HA3 GLY 32 -23.373 -2.615 -5.210
554 HA3 GLY 32 HA2 GLY 32 -22.709 -1.255 -6.096
555 H GLU 33 H GLU 33 -21.256 -4.384 -5.284
556 HA GLU 33 HA GLU 33 -20.418 -6.067 -6.538
557 HB2 GLU 33 HB3 GLU 33 -22.494 -5.186 -8.552
558 HB3 GLU 33 HB2 GLU 33 -21.651 -6.729 -8.553
559 HG2 GLU 33 HG3 GLU 33 -22.669 -7.285 -6.402
560 HG3 GLU 33 HG2 GLU 33 -23.522 -5.742 -6.412
Start of MODEL 8
1 H1 GLY 1 H1 GLY 1 25.907 -1.167 -5.612
2 H2 GLY 1 H2 GLY 1 26.420 -1.899 -4.176
3 H3 GLY 1 H3 GLY 1 26.364 -0.212 -4.295
4 HA2 GLY 1 HA2 GLY 1 24.018 -2.019 -4.394
5 HA3 GLY 1 HA3 GLY 1 24.501 -1.052 -3.007
6 H SER 2 H SER 2 22.037 -0.602 -3.770
7 HA SER 2 HA SER 2 22.190 2.075 -4.917
8 HB2 SER 2 HB3 SER 2 20.247 -0.019 -5.924
9 HB3 SER 2 HB2 SER 2 20.309 1.669 -6.436
10 HG SER 2 HG SER 2 22.746 0.611 -6.688
11 H MET 3 H MET 3 21.967 1.682 -2.319
12 HA MET 3 HA MET 3 19.393 1.218 -1.270
13 HB2 MET 3 HB3 MET 3 21.475 1.143 0.067
14 HB3 MET 3 HB2 MET 3 21.637 2.884 -0.111
15 HG2 MET 3 HG3 MET 3 19.573 3.223 1.124
16 HG3 MET 3 HG2 MET 3 19.361 1.479 1.267
17 HE1 MET 3 HE1 MET 3 19.103 1.718 3.921
18 HE2 MET 3 HE2 MET 3 19.285 3.463 3.743
19 HE3 MET 3 HE3 MET 3 20.260 2.590 4.925
20 H LYS 4 H LYS 4 20.936 4.067 -2.570
21 HA LYS 4 HA LYS 4 19.200 6.051 -1.647
22 HB2 LYS 4 HB3 LYS 4 21.274 6.610 -2.766
23 HB3 LYS 4 HB2 LYS 4 20.728 5.844 -4.249
24 HG2 LYS 4 HG3 LYS 4 20.556 8.209 -4.506
25 HG3 LYS 4 HG2 LYS 4 18.928 7.541 -4.406
26 HD2 LYS 4 HD3 LYS 4 18.959 9.512 -3.075
27 HD3 LYS 4 HD2 LYS 4 18.942 8.141 -1.965
28 HE2 LYS 4 HE3 LYS 4 20.519 9.849 -1.229
29 HE3 LYS 4 HE2 LYS 4 21.352 8.356 -1.651
30 HZ1 LYS 4 HZ1 LYS 4 22.037 9.300 -3.719
31 HZ2 LYS 4 HZ2 LYS 4 22.444 10.393 -2.496
32 HZ3 LYS 4 HZ3 LYS 4 21.098 10.684 -3.473
33 H GLN 5 H GLN 5 19.033 4.039 -4.559
34 HA GLN 5 HA GLN 5 16.676 5.166 -5.616
35 HB2 GLN 5 HB3 GLN 5 17.763 2.367 -5.972
36 HB3 GLN 5 HB2 GLN 5 16.557 3.137 -6.993
37 HG2 GLN 5 HG3 GLN 5 18.189 4.798 -7.693
38 HG3 GLN 5 HG2 GLN 5 19.400 4.061 -6.644
39 HE21 GLN 5 HE21 GLN 5 20.789 3.591 -8.310
40 HE22 GLN 5 HE22 GLN 5 20.463 2.365 -9.484
41 H LEU 6 H LEU 6 17.278 2.476 -3.429
42 HA LEU 6 HA LEU 6 14.629 1.533 -3.297
43 HB2 LEU 6 HB3 LEU 6 17.079 1.189 -1.658
44 HB3 LEU 6 HB2 LEU 6 15.552 0.774 -0.910
45 HG LEU 6 HG LEU 6 16.626 -1.193 -1.873
46 HD11 LEU 6 HD11 LEU 6 14.180 -1.075 -1.797
47 HD12 LEU 6 HD12 LEU 6 14.755 -2.032 -3.161
48 HD13 LEU 6 HD13 LEU 6 14.167 -0.391 -3.422
49 HD21 LEU 6 HD21 LEU 6 16.372 0.247 -4.511
50 HD22 LEU 6 HD22 LEU 6 16.874 -1.430 -4.294
51 HD23 LEU 6 HD23 LEU 6 17.876 -0.121 -3.666
52 H GLU 7 H GLU 7 16.330 4.045 -1.499
53 HA GLU 7 HA GLU 7 14.415 4.511 0.493
54 HB2 GLU 7 HB3 GLU 7 16.324 6.405 -0.877
55 HB3 GLU 7 HB2 GLU 7 15.342 6.857 0.507
56 HG2 GLU 7 HG3 GLU 7 17.387 4.650 0.472
57 HG3 GLU 7 HG2 GLU 7 17.638 6.269 1.124
58 H ASP 8 H ASP 8 14.638 5.693 -2.817
59 HA ASP 8 HA ASP 8 12.358 7.419 -2.606
60 HB2 ASP 8 HB3 ASP 8 13.865 6.330 -4.988
61 HB3 ASP 8 HB2 ASP 8 12.503 7.434 -5.133
62 H LYS 9 H LYS 9 12.958 4.146 -3.679
63 HA LYS 9 HA LYS 9 10.418 3.721 -4.875
64 HB2 LYS 9 HB3 LYS 9 12.597 2.458 -5.288
65 HB3 LYS 9 HB2 LYS 9 12.254 1.586 -3.802
66 HG2 LYS 9 HG3 LYS 9 10.138 0.800 -4.773
67 HG3 LYS 9 HG2 LYS 9 10.531 1.640 -6.272
68 HD2 LYS 9 HD3 LYS 9 12.145 -0.582 -5.016
69 HD3 LYS 9 HD2 LYS 9 11.080 -0.742 -6.411
70 HE2 LYS 9 HE3 LYS 9 13.547 0.991 -6.266
71 HE3 LYS 9 HE2 LYS 9 13.433 -0.569 -7.074
72 HZ1 LYS 9 HZ1 LYS 9 11.894 1.864 -7.797
73 HZ2 LYS 9 HZ2 LYS 9 11.786 0.364 -8.573
74 HZ3 LYS 9 HZ3 LYS 9 13.224 1.247 -8.636
75 H VAL 10 H VAL 10 11.782 2.915 -1.692
76 HA VAL 10 HA VAL 10 9.471 1.522 -0.795
77 HB VAL 10 HB VAL 10 11.761 1.257 0.195
78 HG11 VAL 10 HG11 VAL 10 11.123 3.869 1.555
79 HG12 VAL 10 HG12 VAL 10 12.404 3.590 0.376
80 HG13 VAL 10 HG13 VAL 10 12.471 2.802 1.953
81 HG21 VAL 10 HG21 VAL 10 9.818 0.352 1.311
82 HG22 VAL 10 HG22 VAL 10 9.519 1.901 2.101
83 HG23 VAL 10 HG23 VAL 10 10.965 0.973 2.498
84 H GLU 11 H GLU 11 10.506 4.903 -0.589
85 HA GLU 11 HA GLU 11 8.385 5.764 1.089
86 HB2 GLU 11 HB3 GLU 11 10.376 7.147 0.718
87 HB3 GLU 11 HB2 GLU 11 9.963 7.310 -0.983
88 HG2 GLU 11 HG3 GLU 11 7.912 8.495 -0.367
89 HG3 GLU 11 HG2 GLU 11 8.343 8.343 1.335
90 H GLU 12 H GLU 12 8.777 5.482 -2.401
91 HA GLU 12 HA GLU 12 6.347 6.565 -3.220
92 HB2 GLU 12 HB3 GLU 12 8.238 5.828 -4.707
93 HB3 GLU 12 HB2 GLU 12 7.705 4.171 -4.467
94 HG2 GLU 12 HG3 GLU 12 6.860 4.955 -6.558
95 HG3 GLU 12 HG2 GLU 12 5.512 4.783 -5.437
96 H LEU 13 H LEU 13 7.077 3.134 -2.472
97 HA LEU 13 HA LEU 13 4.360 2.358 -2.630
98 HB2 LEU 13 HB3 LEU 13 6.882 1.081 -1.743
99 HB3 LEU 13 HB2 LEU 13 5.364 0.326 -1.284
100 HG LEU 13 HG LEU 13 5.758 1.141 -4.114
101 HD11 LEU 13 HD11 LEU 13 6.890 -1.377 -2.875
102 HD12 LEU 13 HD12 LEU 13 7.820 -0.057 -3.585
103 HD13 LEU 13 HD13 LEU 13 6.780 -1.054 -4.605
104 HD21 LEU 13 HD21 LEU 13 4.303 -1.104 -2.730
105 HD22 LEU 13 HD22 LEU 13 4.371 -0.882 -4.477
106 HD23 LEU 13 HD23 LEU 13 3.595 0.333 -3.463
107 H LEU 14 H LEU 14 6.351 3.411 0.089
108 HA LEU 14 HA LEU 14 4.587 2.856 2.155
109 HB2 LEU 14 HB3 LEU 14 6.854 3.703 2.490
110 HB3 LEU 14 HB2 LEU 14 6.425 5.233 1.769
111 HG LEU 14 HG LEU 14 6.665 5.160 4.283
112 HD11 LEU 14 HD11 LEU 14 5.617 7.017 3.132
113 HD12 LEU 14 HD12 LEU 14 4.818 6.689 4.672
114 HD13 LEU 14 HD13 LEU 14 4.067 6.174 3.162
115 HD21 LEU 14 HD21 LEU 14 4.797 4.367 5.593
116 HD22 LEU 14 HD22 LEU 14 5.469 3.042 4.643
117 HD23 LEU 14 HD23 LEU 14 3.970 3.823 4.136
118 H SER 15 H SER 15 4.677 5.597 -0.083
119 HA SER 15 HA SER 15 2.305 6.750 1.013
120 HB2 SER 15 HB3 SER 15 2.447 8.196 -1.115
121 HB3 SER 15 HB2 SER 15 3.737 8.343 0.075
122 HG SER 15 HG SER 15 5.057 7.100 -1.214
123 H LYS 16 H LYS 16 3.011 4.597 -1.768
124 HA LYS 16 HA LYS 16 0.433 4.628 -2.878
125 HB2 LYS 16 HB3 LYS 16 2.439 2.383 -2.685
126 HB3 LYS 16 HB2 LYS 16 0.941 2.258 -3.593
127 HG2 LYS 16 HG3 LYS 16 1.630 4.101 -5.021
128 HG3 LYS 16 HG2 LYS 16 3.118 4.278 -4.092
129 HD2 LYS 16 HD3 LYS 16 3.549 3.048 -6.137
130 HD3 LYS 16 HD2 LYS 16 3.776 2.000 -4.740
131 HE2 LYS 16 HE3 LYS 16 2.585 0.843 -6.527
132 HE3 LYS 16 HE2 LYS 16 1.569 1.026 -5.099
133 HZ1 LYS 16 HZ1 LYS 16 0.449 2.871 -6.148
134 HZ2 LYS 16 HZ2 LYS 16 0.378 1.519 -7.159
135 HZ3 LYS 16 HZ3 LYS 16 1.461 2.771 -7.501
136 H ASN 17 H ASN 17 1.736 2.598 -0.269
137 HA ASN 17 HA ASN 17 -0.480 1.104 0.385
138 HB2 ASN 17 HB3 ASN 17 1.649 0.730 1.458
139 HB3 ASN 17 HB2 ASN 17 1.628 2.338 2.171
140 HD21 ASN 17 HD21 ASN 17 0.408 2.713 3.995
141 HD22 ASN 17 HD22 ASN 17 -0.305 1.439 4.921
142 H TYR 18 H TYR 18 0.350 4.363 1.569
143 HA TYR 18 HA TYR 18 -1.983 4.608 3.151
144 HB2 TYR 18 HB3 TYR 18 0.104 6.527 2.203
145 HB3 TYR 18 HB2 TYR 18 -1.377 7.149 2.933
146 HD1 TYR 18 HD1 TYR 18 -1.958 6.511 5.263
147 HD2 TYR 18 HD2 TYR 18 1.802 5.525 3.543
148 HE1 TYR 18 HE1 TYR 18 -1.050 6.091 7.507
149 HE2 TYR 18 HE2 TYR 18 2.722 5.103 5.782
150 HH TYR 18 HH TYR 18 2.312 5.650 8.078
151 H HIS 19 H HIS 19 -1.235 5.621 -0.164
152 HA HIS 19 HA HIS 19 -3.571 7.067 -0.676
153 HB2 HIS 19 HB3 HIS 19 -1.717 5.494 -2.432
154 HB3 HIS 19 HB2 HIS 19 -3.206 6.146 -3.102
155 HD1 HIS 19 HD1 HIS 19 0.215 6.988 -2.805
156 HD2 HIS 19 HD2 HIS 19 -3.332 9.118 -2.412
157 HE1 HIS 19 HE1 HIS 19 0.838 9.399 -3.116
158 HE2 HIS 19 HE2 HIS 19 -1.290 10.675 -2.697
159 H LEU 20 H LEU 20 -2.942 3.603 -0.887
160 HA LEU 20 HA LEU 20 -5.597 3.021 -1.813
161 HB2 LEU 20 HB3 LEU 20 -3.197 1.420 -1.092
162 HB3 LEU 20 HB2 LEU 20 -4.755 0.615 -1.100
163 HG LEU 20 HG LEU 20 -5.080 1.073 -3.426
164 HD11 LEU 20 HD11 LEU 20 -4.158 3.345 -3.442
165 HD12 LEU 20 HD12 LEU 20 -3.522 2.357 -4.762
166 HD13 LEU 20 HD13 LEU 20 -2.528 2.672 -3.339
167 HD21 LEU 20 HD21 LEU 20 -3.653 -0.833 -2.884
168 HD22 LEU 20 HD22 LEU 20 -2.231 0.207 -2.969
169 HD23 LEU 20 HD23 LEU 20 -3.192 -0.092 -4.416
170 H GLU 21 H GLU 21 -3.924 2.964 1.291
171 HA GLU 21 HA GLU 21 -5.936 1.747 2.812
172 HB2 GLU 21 HB3 GLU 21 -3.553 2.458 3.506
173 HB3 GLU 21 HB2 GLU 21 -4.255 4.037 3.820
174 HG2 GLU 21 HG3 GLU 21 -5.526 1.655 5.050
175 HG3 GLU 21 HG2 GLU 21 -4.000 2.227 5.715
176 H ASN 22 H ASN 22 -5.466 5.083 1.798
177 HA ASN 22 HA ASN 22 -7.714 6.199 3.061
178 HB2 ASN 22 HB3 ASN 22 -6.022 6.984 0.729
179 HB3 ASN 22 HB2 ASN 22 -7.548 7.824 0.982
180 HD21 ASN 22 HD21 ASN 22 -4.352 7.245 2.215
181 HD22 ASN 22 HD22 ASN 22 -4.366 8.518 3.391
182 H GLU 23 H GLU 23 -7.359 4.395 0.070
183 HA GLU 23 HA GLU 23 -9.980 5.029 -0.899
184 HB2 GLU 23 HB3 GLU 23 -7.986 2.910 -1.711
185 HB3 GLU 23 HB2 GLU 23 -9.551 3.152 -2.518
186 HG2 GLU 23 HG3 GLU 23 -8.864 5.466 -3.044
187 HG3 GLU 23 HG2 GLU 23 -7.287 5.133 -2.327
188 H VAL 24 H VAL 24 -8.574 2.432 1.017
189 HA VAL 24 HA VAL 24 -10.882 0.777 0.964
190 HB VAL 24 HB VAL 24 -8.846 0.876 3.196
191 HG11 VAL 24 HG11 VAL 24 -9.462 -1.459 3.538
192 HG12 VAL 24 HG12 VAL 24 -10.614 -1.366 2.204
193 HG13 VAL 24 HG13 VAL 24 -10.878 -0.413 3.669
194 HG21 VAL 24 HG21 VAL 24 -7.677 0.635 1.071
195 HG22 VAL 24 HG22 VAL 24 -8.726 -0.715 0.637
196 HG23 VAL 24 HG23 VAL 24 -7.616 -0.863 1.998
197 H ALA 25 H ALA 25 -9.787 3.418 2.991
198 HA ALA 25 HA ALA 25 -11.623 3.065 5.103
199 HB1 ALA 25 HB1 ALA 25 -9.566 4.430 5.248
200 HB2 ALA 25 HB2 ALA 25 -11.004 5.270 5.826
201 HB3 ALA 25 HB3 ALA 25 -10.344 5.648 4.237
202 H ARG 26 H ARG 26 -11.817 5.002 2.131
203 HA ARG 26 HA ARG 26 -14.205 6.320 2.837
204 HB2 ARG 26 HB3 ARG 26 -14.366 6.717 0.316
205 HB3 ARG 26 HB2 ARG 26 -12.994 7.397 1.165
206 HG2 ARG 26 HG3 ARG 26 -11.618 5.508 0.373
207 HG3 ARG 26 HG2 ARG 26 -12.999 4.906 -0.545
208 HD2 ARG 26 HD2 ARG 26 -11.743 7.624 -0.895
209 HD3 ARG 26 HD1 ARG 26 -11.418 6.223 -1.915
210 HE ARG 26 HE ARG 26 -13.978 6.327 -2.284
211 HH11 ARG 26 HH11 ARG 26 -11.850 9.087 -1.910
212 HH12 ARG 26 HH12 ARG 26 -12.832 10.134 -2.885
213 HH21 ARG 26 HH21 ARG 26 -15.263 7.700 -3.573
214 HH22 ARG 26 HH22 ARG 26 -14.771 9.345 -3.831
215 H LEU 27 H LEU 27 -13.614 3.425 0.862
216 HA LEU 27 HA LEU 27 -16.349 3.007 0.230
217 HB2 LEU 27 HB3 LEU 27 -14.081 1.028 0.286
218 HB3 LEU 27 HB2 LEU 27 -15.647 0.774 -0.445
219 HG LEU 27 HG LEU 27 -13.953 3.038 -1.356
220 HD11 LEU 27 HD11 LEU 27 -12.547 1.046 -1.392
221 HD12 LEU 27 HD12 LEU 27 -12.943 1.610 -3.016
222 HD13 LEU 27 HD13 LEU 27 -13.776 0.209 -2.340
223 HD21 LEU 27 HD21 LEU 27 -16.057 1.307 -2.631
224 HD22 LEU 27 HD22 LEU 27 -15.157 2.576 -3.466
225 HD23 LEU 27 HD23 LEU 27 -16.233 2.989 -2.132
226 H LYS 28 H LYS 28 -14.250 1.804 2.796
227 HA LYS 28 HA LYS 28 -15.860 -0.115 3.936
228 HB2 LYS 28 HB3 LYS 28 -13.510 0.645 4.607
229 HB3 LYS 28 HB2 LYS 28 -14.305 1.873 5.580
230 HG2 LYS 28 HG3 LYS 28 -13.773 0.048 7.004
231 HG3 LYS 28 HG2 LYS 28 -15.521 0.042 6.762
232 HD2 LYS 28 HD3 LYS 28 -15.324 -1.730 5.125
233 HD3 LYS 28 HD2 LYS 28 -13.565 -1.676 5.236
234 HE2 LYS 28 HE3 LYS 28 -14.358 -3.538 6.526
235 HE3 LYS 28 HE2 LYS 28 -13.749 -2.306 7.630
236 HZ1 LYS 28 HZ1 LYS 28 -15.839 -3.246 8.397
237 HZ2 LYS 28 HZ2 LYS 28 -16.609 -2.765 6.971
238 HZ3 LYS 28 HZ3 LYS 28 -16.017 -1.603 8.045
239 H LYS 29 H LYS 29 -16.096 3.395 4.244
240 HA LYS 29 HA LYS 29 -18.302 3.126 6.120
241 HB2 LYS 29 HB3 LYS 29 -16.631 4.844 6.526
242 HB3 LYS 29 HB2 LYS 29 -16.992 5.600 4.983
243 HG2 LYS 29 HG3 LYS 29 -19.249 6.104 5.773
244 HG3 LYS 29 HG2 LYS 29 -18.881 5.331 7.316
245 HD2 LYS 29 HD3 LYS 29 -17.059 6.979 7.649
246 HD3 LYS 29 HD2 LYS 29 -17.565 7.787 6.164
247 HE2 LYS 29 HE3 LYS 29 -18.500 8.920 8.091
248 HE3 LYS 29 HE2 LYS 29 -19.783 8.170 7.145
249 HZ1 LYS 29 HZ1 LYS 29 -18.596 7.055 9.629
250 HZ2 LYS 29 HZ2 LYS 29 -19.839 6.338 8.728
251 HZ3 LYS 29 HZ3 LYS 29 -20.099 7.816 9.512
252 H LEU 30 H LEU 30 -17.912 3.248 2.767
253 HA LEU 30 HA LEU 30 -20.509 4.418 2.263
254 HB2 LEU 30 HB3 LEU 30 -18.611 2.930 0.453
255 HB3 LEU 30 HB2 LEU 30 -20.133 3.626 -0.067
256 HG LEU 30 HG LEU 30 -17.790 5.176 1.037
257 HD11 LEU 30 HD11 LEU 30 -17.353 4.283 -1.184
258 HD12 LEU 30 HD12 LEU 30 -17.564 6.031 -1.235
259 HD13 LEU 30 HD13 LEU 30 -18.866 4.970 -1.768
260 HD21 LEU 30 HD21 LEU 30 -19.070 7.149 0.325
261 HD22 LEU 30 HD22 LEU 30 -19.892 6.245 1.593
262 HD23 LEU 30 HD23 LEU 30 -20.433 6.105 -0.079
263 H VAL 31 H VAL 31 -19.087 1.258 2.654
264 HA VAL 31 HA VAL 31 -21.605 -0.087 2.100
265 HB VAL 31 HB VAL 31 -19.118 -1.355 3.256
266 HG11 VAL 31 HG11 VAL 31 -21.162 -2.696 3.326
267 HG12 VAL 31 HG12 VAL 31 -19.973 -3.383 2.220
268 HG13 VAL 31 HG13 VAL 31 -21.355 -2.492 1.584
269 HG21 VAL 31 HG21 VAL 31 -18.480 -0.144 1.232
270 HG22 VAL 31 HG22 VAL 31 -19.760 -0.961 0.336
271 HG23 VAL 31 HG23 VAL 31 -18.407 -1.887 0.988
272 H GLY 32 H GLY 32 -19.798 1.140 4.782
273 HA2 GLY 32 HA3 GLY 32 -21.393 -0.397 6.704
274 HA3 GLY 32 HA2 GLY 32 -19.927 0.498 7.069
275 H GLU 33 H GLU 33 -20.502 2.966 5.978
276 HA GLU 33 HA GLU 33 -21.555 4.934 6.354
277 HB2 GLU 33 HB3 GLU 33 -23.891 3.233 7.251
278 HB3 GLU 33 HB2 GLU 33 -23.939 4.977 7.050
279 HG2 GLU 33 HG3 GLU 33 -23.361 3.006 4.850
280 HG3 GLU 33 HG2 GLU 33 -24.928 3.747 5.161
281 H1 GLY 1 H1 GLY 1 25.931 0.979 4.887
282 H2 GLY 1 H2 GLY 1 26.433 1.706 3.446
283 H3 GLY 1 H3 GLY 1 26.377 0.022 3.571
284 HA2 GLY 1 HA2 GLY 1 24.035 1.832 3.679
285 HA3 GLY 1 HA3 GLY 1 24.507 0.859 2.291
286 H SER 2 H SER 2 22.054 0.410 3.057
287 HA SER 2 HA SER 2 22.202 -2.261 4.216
288 HB2 SER 2 HB3 SER 2 20.272 -0.153 5.222
289 HB3 SER 2 HB2 SER 2 20.328 -1.839 5.740
290 HG SER 2 HG SER 2 22.768 -0.806 5.980
291 H MET 3 H MET 3 21.969 -1.890 1.618
292 HA MET 3 HA MET 3 19.394 -1.407 0.581
293 HB2 MET 3 HB3 MET 3 21.467 -1.345 -0.769
294 HB3 MET 3 HB2 MET 3 21.625 -3.085 -0.586
295 HG2 MET 3 HG3 MET 3 19.555 -3.424 -1.810
296 HG3 MET 3 HG2 MET 3 19.345 -1.679 -1.958
297 HE1 MET 3 HE1 MET 3 19.076 -1.927 -4.613
298 HE2 MET 3 HE2 MET 3 19.252 -3.671 -4.427
299 HE3 MET 3 HE3 MET 3 20.224 -2.809 -5.619
300 H LYS 4 H LYS 4 20.930 -4.260 1.874
301 HA LYS 4 HA LYS 4 19.182 -6.240 0.975
302 HB2 LYS 4 HB3 LYS 4 21.263 -6.798 2.081
303 HB3 LYS 4 HB2 LYS 4 20.728 -6.023 3.565
304 HG2 LYS 4 HG3 LYS 4 20.551 -8.385 3.837
305 HG3 LYS 4 HG2 LYS 4 18.924 -7.714 3.741
306 HD2 LYS 4 HD3 LYS 4 18.943 -9.692 2.422
307 HD3 LYS 4 HD2 LYS 4 18.923 -8.329 1.303
308 HE2 LYS 4 HE3 LYS 4 20.490 -10.052 0.571
309 HE3 LYS 4 HE2 LYS 4 21.331 -8.556 0.974
310 HZ1 LYS 4 HZ1 LYS 4 22.022 -9.482 3.044
311 HZ2 LYS 4 HZ2 LYS 4 22.420 -10.588 1.833
312 HZ3 LYS 4 HZ3 LYS 4 21.077 -10.865 2.821
313 H GLN 5 H GLN 5 19.041 -4.219 3.882
314 HA GLN 5 HA GLN 5 16.687 -5.333 4.955
315 HB2 GLN 5 HB3 GLN 5 17.779 -2.533 5.295
316 HB3 GLN 5 HB2 GLN 5 16.577 -3.298 6.322
317 HG2 GLN 5 HG3 GLN 5 18.207 -4.958 7.025
318 HG3 GLN 5 HG2 GLN 5 19.415 -4.231 5.967
319 HE21 GLN 5 HE21 GLN 5 20.819 -3.756 7.634
320 HE22 GLN 5 HE22 GLN 5 20.499 -2.517 8.798
321 H LEU 6 H LEU 6 17.282 -2.650 2.753
322 HA LEU 6 HA LEU 6 14.634 -1.706 2.630
323 HB2 LEU 6 HB3 LEU 6 17.076 -1.372 0.977
324 HB3 LEU 6 HB2 LEU 6 15.545 -0.957 0.236
325 HG LEU 6 HG LEU 6 16.627 1.012 1.187
326 HD11 LEU 6 HD11 LEU 6 14.181 0.896 1.123
327 HD12 LEU 6 HD12 LEU 6 14.764 1.857 2.481
328 HD13 LEU 6 HD13 LEU 6 14.177 0.218 2.750
329 HD21 LEU 6 HD21 LEU 6 16.385 -0.418 3.832
330 HD22 LEU 6 HD22 LEU 6 16.889 1.258 3.605
331 HD23 LEU 6 HD23 LEU 6 17.885 -0.055 2.977
332 H GLU 7 H GLU 7 16.320 -4.227 0.833
333 HA GLU 7 HA GLU 7 14.397 -4.696 -1.147
334 HB2 GLU 7 HB3 GLU 7 16.307 -6.592 0.222
335 HB3 GLU 7 HB2 GLU 7 15.315 -7.046 -1.158
336 HG2 GLU 7 HG3 GLU 7 17.361 -4.838 -1.145
337 HG3 GLU 7 HG2 GLU 7 17.612 -6.461 -1.787
338 H ASP 8 H ASP 8 14.628 -5.867 2.166
339 HA ASP 8 HA ASP 8 12.341 -7.586 1.972
340 HB2 ASP 8 HB3 ASP 8 13.867 -6.498 4.346
341 HB3 ASP 8 HB2 ASP 8 12.501 -7.599 4.498
342 H LYS 9 H LYS 9 12.955 -4.310 3.016
343 HA LYS 9 HA LYS 9 10.426 -3.873 4.233
344 HB2 LYS 9 HB3 LYS 9 12.611 -2.613 4.626
345 HB3 LYS 9 HB2 LYS 9 12.258 -1.745 3.140
346 HG2 LYS 9 HG3 LYS 9 10.151 -0.952 4.125
347 HG3 LYS 9 HG2 LYS 9 10.554 -1.793 5.622
348 HD2 LYS 9 HD3 LYS 9 12.167 0.421 4.352
349 HD3 LYS 9 HD2 LYS 9 11.107 0.592 5.751
350 HE2 LYS 9 HE3 LYS 9 13.572 -1.146 5.602
351 HE3 LYS 9 HE2 LYS 9 13.461 0.414 6.410
352 HZ1 LYS 9 HZ1 LYS 9 11.917 -2.015 7.137
353 HZ2 LYS 9 HZ2 LYS 9 11.820 -0.518 7.915
354 HZ3 LYS 9 HZ3 LYS 9 13.255 -1.410 7.974
355 H VAL 10 H VAL 10 11.775 -3.084 1.042
356 HA VAL 10 HA VAL 10 9.465 -1.690 0.148
357 HB VAL 10 HB VAL 10 11.750 -1.433 -0.851
358 HG11 VAL 10 HG11 VAL 10 11.101 -4.049 -2.194
359 HG12 VAL 10 HG12 VAL 10 12.388 -3.767 -1.023
360 HG13 VAL 10 HG13 VAL 10 12.448 -2.990 -2.605
361 HG21 VAL 10 HG21 VAL 10 9.803 -0.531 -1.963
362 HG22 VAL 10 HG22 VAL 10 9.499 -2.083 -2.745
363 HG23 VAL 10 HG23 VAL 10 10.943 -1.157 -3.155
364 H GLU 11 H GLU 11 10.489 -5.075 -0.045
365 HA GLU 11 HA GLU 11 8.361 -5.939 -1.715
366 HB2 GLU 11 HB3 GLU 11 10.349 -7.326 -1.345
367 HB3 GLU 11 HB2 GLU 11 9.943 -7.478 0.360
368 HG2 GLU 11 HG3 GLU 11 7.885 -8.658 -0.243
369 HG3 GLU 11 HG2 GLU 11 8.314 -8.523 -1.947
370 H GLU 12 H GLU 12 8.767 -5.648 1.774
371 HA GLU 12 HA GLU 12 6.339 -6.720 2.612
372 HB2 GLU 12 HB3 GLU 12 8.242 -5.977 4.080
373 HB3 GLU 12 HB2 GLU 12 7.709 -4.320 3.834
374 HG2 GLU 12 HG3 GLU 12 6.881 -5.093 5.937
375 HG3 GLU 12 HG2 GLU 12 5.522 -4.923 4.825
376 H LEU 13 H LEU 13 7.074 -3.295 1.840
377 HA LEU 13 HA LEU 13 4.360 -2.507 2.009
378 HB2 LEU 13 HB3 LEU 13 6.883 -1.242 1.105
379 HB3 LEU 13 HB2 LEU 13 5.364 -0.483 0.652
380 HG LEU 13 HG LEU 13 5.770 -1.289 3.483
381 HD11 LEU 13 HD11 LEU 13 6.899 1.225 2.231
382 HD12 LEU 13 HD12 LEU 13 7.832 -0.093 2.942
383 HD13 LEU 13 HD13 LEU 13 6.796 0.906 3.963
384 HD21 LEU 13 HD21 LEU 13 4.314 0.953 2.095
385 HD22 LEU 13 HD22 LEU 13 4.391 0.740 3.843
386 HD23 LEU 13 HD23 LEU 13 3.606 -0.480 2.840
387 H LEU 14 H LEU 14 6.335 -3.575 -0.717
388 HA LEU 14 HA LEU 14 4.563 -3.025 -2.775
389 HB2 LEU 14 HB3 LEU 14 6.826 -3.877 -3.114
390 HB3 LEU 14 HB2 LEU 14 6.397 -5.403 -2.386
391 HG LEU 14 HG LEU 14 6.628 -5.340 -4.899
392 HD11 LEU 14 HD11 LEU 14 5.581 -7.191 -3.738
393 HD12 LEU 14 HD12 LEU 14 4.776 -6.868 -5.275
394 HD13 LEU 14 HD13 LEU 14 4.033 -6.344 -3.764
395 HD21 LEU 14 HD21 LEU 14 4.755 -4.549 -6.207
396 HD22 LEU 14 HD22 LEU 14 5.433 -3.220 -5.266
397 HD23 LEU 14 HD23 LEU 14 3.937 -3.997 -4.748
398 H SER 15 H SER 15 4.655 -5.759 -0.526
399 HA SER 15 HA SER 15 2.273 -6.911 -1.609
400 HB2 SER 15 HB3 SER 15 2.426 -8.343 0.523
401 HB3 SER 15 HB2 SER 15 3.724 -8.489 -0.660
402 HG SER 15 HG SER 15 5.048 -7.306 0.630
403 H LYS 16 H LYS 16 3.001 -4.745 1.160
404 HA LYS 16 HA LYS 16 0.428 -4.766 2.287
405 HB2 LYS 16 HB3 LYS 16 2.440 -2.528 2.072
406 HB3 LYS 16 HB2 LYS 16 0.948 -2.393 2.989
407 HG2 LYS 16 HG3 LYS 16 1.639 -4.232 4.420
408 HG3 LYS 16 HG2 LYS 16 3.123 -4.414 3.486
409 HD2 LYS 16 HD3 LYS 16 3.562 -3.178 5.526
410 HD3 LYS 16 HD2 LYS 16 3.785 -2.136 4.122
411 HE2 LYS 16 HE3 LYS 16 2.601 -0.972 5.911
412 HE3 LYS 16 HE2 LYS 16 1.580 -1.156 4.486
413 HZ1 LYS 16 HZ1 LYS 16 0.455 -2.991 5.545
414 HZ2 LYS 16 HZ2 LYS 16 0.401 -1.639 6.558
415 HZ3 LYS 16 HZ3 LYS 16 1.477 -2.898 6.889
416 H ASN 17 H ASN 17 1.726 -2.745 -0.333
417 HA ASN 17 HA ASN 17 -0.490 -1.255 -0.986
418 HB2 ASN 17 HB3 ASN 17 1.635 -0.885 -2.069
419 HB3 ASN 17 HB2 ASN 17 1.608 -2.494 -2.778
420 HD21 ASN 17 HD21 ASN 17 0.382 -2.875 -4.593
421 HD22 ASN 17 HD22 ASN 17 -0.339 -1.607 -5.521
422 H TYR 18 H TYR 18 0.331 -4.520 -2.158
423 HA TYR 18 HA TYR 18 -2.012 -4.767 -3.729
424 HB2 TYR 18 HB3 TYR 18 0.075 -6.684 -2.785
425 HB3 TYR 18 HB2 TYR 18 -1.410 -7.307 -3.504
426 HD1 TYR 18 HD1 TYR 18 -2.003 -6.670 -5.829
427 HD2 TYR 18 HD2 TYR 18 1.774 -5.697 -4.140
428 HE1 TYR 18 HE1 TYR 18 -1.112 -6.260 -8.078
429 HE2 TYR 18 HE2 TYR 18 2.679 -5.284 -6.389
430 HH TYR 18 HH TYR 18 2.236 -5.855 -8.692
431 H HIS 19 H HIS 19 -1.249 -5.766 -0.413
432 HA HIS 19 HA HIS 19 -3.588 -7.202 0.112
433 HB2 HIS 19 HB3 HIS 19 -1.723 -5.625 1.852
434 HB3 HIS 19 HB2 HIS 19 -3.211 -6.274 2.531
435 HD1 HIS 19 HD1 HIS 19 0.210 -7.120 2.217
436 HD2 HIS 19 HD2 HIS 19 -3.342 -9.247 1.871
437 HE1 HIS 19 HE1 HIS 19 0.831 -9.532 2.539
438 HE2 HIS 19 HE2 HIS 19 -1.304 -10.807 2.165
439 H LEU 20 H LEU 20 -2.949 -3.736 0.297
440 HA LEU 20 HA LEU 20 -5.599 -3.152 1.240
441 HB2 LEU 20 HB3 LEU 20 -3.203 -1.551 0.505
442 HB3 LEU 20 HB2 LEU 20 -4.761 -0.746 0.520
443 HG LEU 20 HG LEU 20 -5.072 -1.201 2.848
444 HD11 LEU 20 HD11 LEU 20 -4.154 -3.475 2.864
445 HD12 LEU 20 HD12 LEU 20 -3.507 -2.485 4.178
446 HD13 LEU 20 HD13 LEU 20 -2.524 -2.806 2.749
447 HD21 LEU 20 HD21 LEU 20 -3.643 0.700 2.296
448 HD22 LEU 20 HD22 LEU 20 -2.224 -0.346 2.373
449 HD23 LEU 20 HD23 LEU 20 -3.176 -0.040 3.827
450 H GLU 21 H GLU 21 -3.942 -3.113 -1.870
451 HA GLU 21 HA GLU 21 -5.958 -1.894 -3.386
452 HB2 GLU 21 HB3 GLU 21 -3.580 -2.609 -4.094
453 HB3 GLU 21 HB2 GLU 21 -4.282 -4.190 -4.395
454 HG2 GLU 21 HG3 GLU 21 -5.562 -1.814 -5.631
455 HG3 GLU 21 HG2 GLU 21 -4.040 -2.392 -6.301
456 H ASN 22 H ASN 22 -5.494 -5.228 -2.362
457 HA ASN 22 HA ASN 22 -7.748 -6.343 -3.614
458 HB2 ASN 22 HB3 ASN 22 -6.047 -7.122 -1.289
459 HB3 ASN 22 HB2 ASN 22 -7.576 -7.960 -1.530
460 HD21 ASN 22 HD21 ASN 22 -4.389 -7.395 -2.774
461 HD22 ASN 22 HD22 ASN 22 -4.407 -8.657 -3.959
462 H GLU 23 H GLU 23 -7.375 -4.538 -0.627
463 HA GLU 23 HA GLU 23 -9.996 -5.153 0.351
464 HB2 GLU 23 HB3 GLU 23 -7.993 -3.036 1.143
465 HB3 GLU 23 HB2 GLU 23 -9.555 -3.269 1.956
466 HG2 GLU 23 HG3 GLU 23 -8.872 -5.583 2.488
467 HG3 GLU 23 HG2 GLU 23 -7.294 -5.254 1.772
468 H VAL 24 H VAL 24 -8.588 -2.565 -1.580
469 HA VAL 24 HA VAL 24 -10.895 -0.907 -1.523
470 HB VAL 24 HB VAL 24 -8.868 -1.013 -3.763
471 HG11 VAL 24 HG11 VAL 24 -9.481 1.322 -4.105
472 HG12 VAL 24 HG12 VAL 24 -10.624 1.235 -2.763
473 HG13 VAL 24 HG13 VAL 24 -10.900 0.280 -4.222
474 HG21 VAL 24 HG21 VAL 24 -7.690 -0.771 -1.642
475 HG22 VAL 24 HG22 VAL 24 -8.734 0.584 -1.209
476 HG23 VAL 24 HG23 VAL 24 -7.628 0.724 -2.575
477 H ALA 25 H ALA 25 -9.820 -3.568 -3.533
478 HA ALA 25 HA ALA 25 -11.658 -3.209 -5.648
479 HB1 ALA 25 HB1 ALA 25 -9.605 -4.578 -5.797
480 HB2 ALA 25 HB2 ALA 25 -11.049 -5.417 -6.365
481 HB3 ALA 25 HB3 ALA 25 -10.381 -5.791 -4.778
482 H ARG 26 H ARG 26 -11.843 -5.136 -2.673
483 HA ARG 26 HA ARG 26 -14.238 -6.446 -3.358
484 HB2 ARG 26 HB3 ARG 26 -14.389 -6.834 -0.835
485 HB3 ARG 26 HB2 ARG 26 -13.020 -7.516 -1.688
486 HG2 ARG 26 HG3 ARG 26 -11.640 -5.628 -0.908
487 HG3 ARG 26 HG2 ARG 26 -13.017 -5.022 0.013
488 HD2 ARG 26 HD2 ARG 26 -11.769 -7.742 0.364
489 HD3 ARG 26 HD1 ARG 26 -11.426 -6.341 1.376
490 HE ARG 26 HE ARG 26 -13.984 -6.432 1.767
491 HH11 ARG 26 HH11 ARG 26 -11.865 -9.192 1.395
492 HH12 ARG 26 HH12 ARG 26 -12.847 -10.238 2.365
493 HH21 ARG 26 HH21 ARG 26 -15.271 -7.800 3.059
494 HH22 ARG 26 HH22 ARG 26 -14.781 -9.441 3.329
495 H LEU 27 H LEU 27 -13.632 -3.546 -1.396
496 HA LEU 27 HA LEU 27 -16.362 -3.119 -0.753
497 HB2 LEU 27 HB3 LEU 27 -14.089 -1.146 -0.830
498 HB3 LEU 27 HB2 LEU 27 -15.651 -0.884 -0.092
499 HG LEU 27 HG LEU 27 -13.956 -3.150 0.819
500 HD11 LEU 27 HD11 LEU 27 -12.550 -1.160 0.843
501 HD12 LEU 27 HD12 LEU 27 -12.939 -1.715 2.472
502 HD13 LEU 27 HD13 LEU 27 -13.773 -0.318 1.791
503 HD21 LEU 27 HD21 LEU 27 -16.056 -1.413 2.095
504 HD22 LEU 27 HD22 LEU 27 -15.155 -2.679 2.934
505 HD23 LEU 27 HD23 LEU 27 -16.236 -3.098 1.606
506 H LYS 28 H LYS 28 -14.275 -1.931 -3.334
507 HA LYS 28 HA LYS 28 -15.880 -0.008 -4.472
508 HB2 LYS 28 HB3 LYS 28 -13.538 -0.780 -5.155
509 HB3 LYS 28 HB2 LYS 28 -14.343 -2.012 -6.114
510 HG2 LYS 28 HG3 LYS 28 -13.811 -0.197 -7.552
511 HG3 LYS 28 HG2 LYS 28 -15.558 -0.186 -7.303
512 HD2 LYS 28 HD3 LYS 28 -15.348 1.595 -5.675
513 HD3 LYS 28 HD2 LYS 28 -13.591 1.537 -5.800
514 HE2 LYS 28 HE3 LYS 28 -14.395 3.391 -7.094
515 HE3 LYS 28 HE2 LYS 28 -13.791 2.153 -8.193
516 HZ1 LYS 28 HZ1 LYS 28 -15.886 3.084 -8.955
517 HZ2 LYS 28 HZ2 LYS 28 -16.648 2.614 -7.523
518 HZ3 LYS 28 HZ3 LYS 28 -16.061 1.442 -8.593
519 H LYS 29 H LYS 29 -16.134 -3.515 -4.765
520 HA LYS 29 HA LYS 29 -18.347 -3.248 -6.633
521 HB2 LYS 29 HB3 LYS 29 -16.677 -4.973 -7.045
522 HB3 LYS 29 HB2 LYS 29 -17.032 -5.724 -5.499
523 HG2 LYS 29 HG3 LYS 29 -19.292 -6.234 -6.278
524 HG3 LYS 29 HG2 LYS 29 -18.933 -5.470 -7.826
525 HD2 LYS 29 HD3 LYS 29 -17.110 -7.116 -8.160
526 HD3 LYS 29 HD2 LYS 29 -17.609 -7.917 -6.668
527 HE2 LYS 29 HE3 LYS 29 -18.557 -9.057 -8.582
528 HE3 LYS 29 HE2 LYS 29 -19.832 -8.300 -7.633
529 HZ1 LYS 29 HZ1 LYS 29 -18.660 -7.210 -10.133
530 HZ2 LYS 29 HZ2 LYS 29 -19.890 -6.480 -9.228
531 HZ3 LYS 29 HZ3 LYS 29 -20.167 -7.963 -9.996
532 H LEU 30 H LEU 30 -17.938 -3.376 -3.281
533 HA LEU 30 HA LEU 30 -20.538 -4.531 -2.766
534 HB2 LEU 30 HB3 LEU 30 -18.630 -3.042 -0.967
535 HB3 LEU 30 HB2 LEU 30 -20.149 -3.736 -0.437
536 HG LEU 30 HG LEU 30 -17.812 -5.291 -1.547
537 HD11 LEU 30 HD11 LEU 30 -17.369 -4.389 0.670
538 HD12 LEU 30 HD12 LEU 30 -17.582 -6.138 0.729
539 HD13 LEU 30 HD13 LEU 30 -18.882 -5.072 1.261
540 HD21 LEU 30 HD21 LEU 30 -19.094 -7.263 -0.826
541 HD22 LEU 30 HD22 LEU 30 -19.918 -6.360 -2.096
542 HD23 LEU 30 HD23 LEU 30 -20.452 -6.215 -0.421
543 H VAL 31 H VAL 31 -19.108 -1.376 -3.168
544 HA VAL 31 HA VAL 31 -21.620 -0.022 -2.610
545 HB VAL 31 HB VAL 31 -19.136 1.234 -3.784
546 HG11 VAL 31 HG11 VAL 31 -21.176 2.581 -3.849
547 HG12 VAL 31 HG12 VAL 31 -19.980 3.269 -2.749
548 HG13 VAL 31 HG13 VAL 31 -21.363 2.383 -2.105
549 HG21 VAL 31 HG21 VAL 31 -18.490 0.031 -1.756
550 HG22 VAL 31 HG22 VAL 31 -19.764 0.857 -0.859
551 HG23 VAL 31 HG23 VAL 31 -18.413 1.777 -1.521
552 H GLY 32 H GLY 32 -19.829 -1.271 -5.294
553 HA2 GLY 32 HA3 GLY 32 -21.427 0.268 -7.213
554 HA3 GLY 32 HA2 GLY 32 -19.960 -0.624 -7.579
555 H GLU 33 H GLU 33 -20.542 -3.092 -6.476
556 HA GLU 33 HA GLU 33 -21.601 -5.056 -6.843
557 HB2 GLU 33 HB3 GLU 33 -23.931 -3.345 -7.736
558 HB3 GLU 33 HB2 GLU 33 -23.988 -5.090 -7.532
559 HG2 GLU 33 HG3 GLU 33 -23.391 -3.114 -5.341
560 HG3 GLU 33 HG2 GLU 33 -24.962 -3.855 -5.642
Start of MODEL 9
1 H1 GLY 1 H1 GLY 1 23.867 5.825 -6.811
2 H2 GLY 1 H2 GLY 1 25.193 4.880 -6.356
3 H3 GLY 1 H3 GLY 1 25.188 6.538 -6.037
4 HA2 GLY 1 HA2 GLY 1 24.735 5.280 -4.031
5 HA3 GLY 1 HA3 GLY 1 23.379 6.299 -4.491
6 H SER 2 H SER 2 24.077 3.370 -3.298
7 HA SER 2 HA SER 2 22.258 1.791 -4.910
8 HB2 SER 2 HB3 SER 2 22.814 0.022 -3.169
9 HB3 SER 2 HB2 SER 2 24.183 0.627 -4.102
10 HG SER 2 HG SER 2 24.989 0.926 -2.166
11 H MET 3 H MET 3 22.464 2.878 -1.543
12 HA MET 3 HA MET 3 19.867 1.984 -0.829
13 HB2 MET 3 HB3 MET 3 21.723 3.985 0.460
14 HB3 MET 3 HB2 MET 3 20.226 3.421 1.194
15 HG2 MET 3 HG3 MET 3 21.089 1.134 1.190
16 HG3 MET 3 HG2 MET 3 22.586 1.705 0.457
17 HE1 MET 3 HE1 MET 3 20.395 3.393 3.288
18 HE2 MET 3 HE2 MET 3 21.195 2.766 4.729
19 HE3 MET 3 HE3 MET 3 20.333 1.668 3.650
20 H LYS 4 H LYS 4 21.110 4.901 -2.238
21 HA LYS 4 HA LYS 4 19.038 6.689 -1.690
22 HB2 LYS 4 HB3 LYS 4 21.147 7.402 -2.674
23 HB3 LYS 4 HB2 LYS 4 20.806 6.486 -4.135
24 HG2 LYS 4 HG3 LYS 4 18.906 7.937 -4.610
25 HG3 LYS 4 HG2 LYS 4 19.232 8.852 -3.137
26 HD2 LYS 4 HD3 LYS 4 21.402 9.517 -4.008
27 HD3 LYS 4 HD2 LYS 4 21.137 8.548 -5.458
28 HE2 LYS 4 HE3 LYS 4 19.470 10.908 -4.591
29 HE3 LYS 4 HE2 LYS 4 20.704 10.932 -5.847
30 HZ1 LYS 4 HZ1 LYS 4 18.217 9.307 -5.899
31 HZ2 LYS 4 HZ2 LYS 4 19.400 9.329 -7.106
32 HZ3 LYS 4 HZ3 LYS 4 18.490 10.721 -6.788
33 H GLN 5 H GLN 5 19.376 4.297 -4.263
34 HA GLN 5 HA GLN 5 17.022 5.063 -5.660
35 HB2 GLN 5 HB3 GLN 5 18.628 2.503 -5.695
36 HB3 GLN 5 HB2 GLN 5 17.307 2.851 -6.800
37 HG2 GLN 5 HG3 GLN 5 18.507 4.682 -7.763
38 HG3 GLN 5 HG2 GLN 5 19.778 4.547 -6.548
39 HE21 GLN 5 HE21 GLN 5 21.289 2.917 -6.710
40 HE22 GLN 5 HE22 GLN 5 21.489 1.971 -8.147
41 H LEU 6 H LEU 6 17.764 2.546 -3.291
42 HA LEU 6 HA LEU 6 15.209 1.321 -3.418
43 HB2 LEU 6 HB3 LEU 6 17.557 1.112 -1.585
44 HB3 LEU 6 HB2 LEU 6 16.033 0.406 -1.096
45 HG LEU 6 HG LEU 6 17.466 -1.279 -2.091
46 HD11 LEU 6 HD11 LEU 6 15.183 -0.599 -3.935
47 HD12 LEU 6 HD12 LEU 6 15.043 -1.464 -2.405
48 HD13 LEU 6 HD13 LEU 6 15.945 -2.178 -3.742
49 HD21 LEU 6 HD21 LEU 6 18.819 0.140 -3.530
50 HD22 LEU 6 HD22 LEU 6 17.425 0.437 -4.569
51 HD23 LEU 6 HD23 LEU 6 18.105 -1.185 -4.449
52 H GLU 7 H GLU 7 16.572 3.845 -1.356
53 HA GLU 7 HA GLU 7 14.477 3.802 0.553
54 HB2 GLU 7 HB3 GLU 7 15.358 5.852 1.403
55 HB3 GLU 7 HB2 GLU 7 16.717 4.842 0.940
56 HG2 GLU 7 HG3 GLU 7 16.977 6.121 -1.115
57 HG3 GLU 7 HG2 GLU 7 15.600 7.126 -0.669
58 H ASP 8 H ASP 8 14.759 5.160 -2.605
59 HA ASP 8 HA ASP 8 12.526 6.955 -2.317
60 HB2 ASP 8 HB3 ASP 8 14.254 6.074 -4.588
61 HB3 ASP 8 HB2 ASP 8 12.681 6.777 -4.955
62 H LYS 9 H LYS 9 13.073 3.680 -3.396
63 HA LYS 9 HA LYS 9 10.518 3.243 -4.532
64 HB2 LYS 9 HB3 LYS 9 12.584 1.342 -3.427
65 HB3 LYS 9 HB2 LYS 9 11.098 0.808 -4.197
66 HG2 LYS 9 HG3 LYS 9 13.191 2.517 -5.522
67 HG3 LYS 9 HG2 LYS 9 13.057 0.765 -5.696
68 HD2 LYS 9 HD3 LYS 9 10.763 1.074 -6.582
69 HD3 LYS 9 HD2 LYS 9 11.000 2.820 -6.502
70 HE2 LYS 9 HE3 LYS 9 12.886 2.630 -8.048
71 HE3 LYS 9 HE2 LYS 9 12.641 0.887 -8.133
72 HZ1 LYS 9 HZ1 LYS 9 10.449 1.280 -9.075
73 HZ2 LYS 9 HZ2 LYS 9 11.644 2.011 -10.019
74 HZ3 LYS 9 HZ3 LYS 9 10.688 2.952 -8.992
75 H VAL 10 H VAL 10 11.880 2.354 -1.357
76 HA VAL 10 HA VAL 10 9.516 1.182 -0.383
77 HB VAL 10 HB VAL 10 11.655 0.704 0.658
78 HG11 VAL 10 HG11 VAL 10 12.792 2.307 2.096
79 HG12 VAL 10 HG12 VAL 10 11.615 3.546 1.657
80 HG13 VAL 10 HG13 VAL 10 12.703 2.892 0.434
81 HG21 VAL 10 HG21 VAL 10 10.999 0.971 3.038
82 HG22 VAL 10 HG22 VAL 10 9.714 0.325 2.016
83 HG23 VAL 10 HG23 VAL 10 9.679 2.016 2.514
84 H GLU 11 H GLU 11 10.736 4.507 -0.133
85 HA GLU 11 HA GLU 11 8.675 5.418 1.595
86 HB2 GLU 11 HB3 GLU 11 10.813 6.615 1.308
87 HB3 GLU 11 HB2 GLU 11 10.372 6.996 -0.349
88 HG2 GLU 11 HG3 GLU 11 8.462 8.291 0.458
89 HG3 GLU 11 HG2 GLU 11 8.916 7.920 2.120
90 H GLU 12 H GLU 12 9.039 5.264 -1.906
91 HA GLU 12 HA GLU 12 6.818 6.781 -2.640
92 HB2 GLU 12 HB3 GLU 12 8.534 5.997 -4.223
93 HB3 GLU 12 HB2 GLU 12 7.939 4.352 -4.045
94 HG2 GLU 12 HG3 GLU 12 5.835 4.953 -5.040
95 HG3 GLU 12 HG2 GLU 12 6.309 6.651 -5.099
96 H LEU 13 H LEU 13 6.973 3.202 -2.355
97 HA LEU 13 HA LEU 13 4.135 3.011 -2.516
98 HB2 LEU 13 HB3 LEU 13 6.201 0.956 -1.780
99 HB3 LEU 13 HB2 LEU 13 4.481 0.617 -1.807
100 HG LEU 13 HG LEU 13 4.678 1.650 -4.237
101 HD11 LEU 13 HD11 LEU 13 7.046 2.171 -4.089
102 HD12 LEU 13 HD12 LEU 13 6.755 0.944 -5.322
103 HD13 LEU 13 HD13 LEU 13 7.415 0.479 -3.753
104 HD21 LEU 13 HD21 LEU 13 3.807 -0.554 -3.681
105 HD22 LEU 13 HD22 LEU 13 5.452 -1.175 -3.524
106 HD23 LEU 13 HD23 LEU 13 4.861 -0.629 -5.093
107 H LEU 14 H LEU 14 6.281 3.455 0.194
108 HA LEU 14 HA LEU 14 4.506 2.769 2.240
109 HB2 LEU 14 HB3 LEU 14 6.842 3.328 2.655
110 HB3 LEU 14 HB2 LEU 14 6.595 4.962 2.100
111 HG LEU 14 HG LEU 14 6.823 4.617 4.590
112 HD11 LEU 14 HD11 LEU 14 5.977 6.685 3.665
113 HD12 LEU 14 HD12 LEU 14 5.134 6.275 5.160
114 HD13 LEU 14 HD13 LEU 14 4.348 6.009 3.603
115 HD21 LEU 14 HD21 LEU 14 4.871 3.907 5.835
116 HD22 LEU 14 HD22 LEU 14 5.427 2.614 4.771
117 HD23 LEU 14 HD23 LEU 14 4.012 3.573 4.332
118 H SER 15 H SER 15 4.888 5.752 0.371
119 HA SER 15 HA SER 15 2.686 7.079 1.597
120 HB2 SER 15 HB3 SER 15 4.588 8.250 0.477
121 HB3 SER 15 HB2 SER 15 3.998 7.650 -1.073
122 HG SER 15 HG SER 15 2.616 9.361 0.723
123 H LYS 16 H LYS 16 3.161 5.292 -1.448
124 HA LYS 16 HA LYS 16 0.615 5.658 -2.530
125 HB2 LYS 16 HB3 LYS 16 2.743 4.567 -3.538
126 HB3 LYS 16 HB2 LYS 16 2.123 3.078 -2.841
127 HG2 LYS 16 HG3 LYS 16 0.144 3.193 -4.177
128 HG3 LYS 16 HG2 LYS 16 0.571 4.805 -4.756
129 HD2 LYS 16 HD3 LYS 16 1.209 3.430 -6.519
130 HD3 LYS 16 HD2 LYS 16 2.715 3.674 -5.640
131 HE2 LYS 16 HE3 LYS 16 2.707 1.391 -6.068
132 HE3 LYS 16 HE2 LYS 16 2.109 1.495 -4.414
133 HZ1 LYS 16 HZ1 LYS 16 0.468 1.131 -6.864
134 HZ2 LYS 16 HZ2 LYS 16 -0.161 1.337 -5.313
135 HZ3 LYS 16 HZ3 LYS 16 0.764 -0.030 -5.670
136 H ASN 17 H ASN 17 1.733 3.309 -0.131
137 HA ASN 17 HA ASN 17 -0.560 1.683 -0.093
138 HB2 ASN 17 HB3 ASN 17 1.580 1.011 0.911
139 HB3 ASN 17 HB2 ASN 17 1.410 2.269 2.130
140 HD21 ASN 17 HD21 ASN 17 0.245 -0.810 1.005
141 HD22 ASN 17 HD22 ASN 17 -0.610 -1.238 2.443
142 H TYR 18 H TYR 18 0.326 4.500 1.912
143 HA TYR 18 HA TYR 18 -2.064 4.417 3.432
144 HB2 TYR 18 HB3 TYR 18 -0.013 6.577 2.997
145 HB3 TYR 18 HB2 TYR 18 -1.441 6.832 3.997
146 HD1 TYR 18 HD1 TYR 18 1.904 6.084 4.185
147 HD2 TYR 18 HD2 TYR 18 -1.831 4.688 5.661
148 HE1 TYR 18 HE1 TYR 18 3.052 5.036 6.090
149 HE2 TYR 18 HE2 TYR 18 -0.694 3.636 7.570
150 HH TYR 18 HH TYR 18 1.466 2.836 8.212
151 H HIS 19 H HIS 19 -1.186 6.006 0.424
152 HA HIS 19 HA HIS 19 -3.533 7.584 0.195
153 HB2 HIS 19 HB3 HIS 19 -1.691 6.464 -1.928
154 HB3 HIS 19 HB2 HIS 19 -3.005 7.586 -2.265
155 HD1 HIS 19 HD1 HIS 19 -0.212 8.447 -2.998
156 HD2 HIS 19 HD2 HIS 19 -1.912 9.206 0.716
157 HE1 HIS 19 HE1 HIS 19 1.047 10.412 -2.067
158 HE2 HIS 19 HE2 HIS 19 -0.128 10.966 0.088
159 H LEU 20 H LEU 20 -2.734 4.286 -0.663
160 HA LEU 20 HA LEU 20 -5.173 3.724 -2.007
161 HB2 LEU 20 HB3 LEU 20 -3.132 2.459 -2.414
162 HB3 LEU 20 HB2 LEU 20 -3.105 1.927 -0.745
163 HG LEU 20 HG LEU 20 -5.197 0.689 -1.129
164 HD11 LEU 20 HD11 LEU 20 -6.112 2.015 -2.954
165 HD12 LEU 20 HD12 LEU 20 -5.971 0.320 -3.423
166 HD13 LEU 20 HD13 LEU 20 -4.794 1.498 -4.004
167 HD21 LEU 20 HD21 LEU 20 -2.972 0.010 -3.040
168 HD22 LEU 20 HD22 LEU 20 -4.193 -1.102 -2.430
169 HD23 LEU 20 HD23 LEU 20 -3.016 -0.396 -1.327
170 H GLU 21 H GLU 21 -4.049 3.562 1.312
171 HA GLU 21 HA GLU 21 -6.254 2.143 2.377
172 HB2 GLU 21 HB3 GLU 21 -4.056 2.605 3.546
173 HB3 GLU 21 HB2 GLU 21 -4.633 4.243 3.820
174 HG2 GLU 21 HG3 GLU 21 -6.539 3.351 5.077
175 HG3 GLU 21 HG2 GLU 21 -5.928 1.717 4.823
176 H ASN 22 H ASN 22 -5.648 5.540 1.716
177 HA ASN 22 HA ASN 22 -7.979 6.639 2.816
178 HB2 ASN 22 HB3 ASN 22 -6.482 7.514 0.336
179 HB3 ASN 22 HB2 ASN 22 -7.674 8.478 1.192
180 HD21 ASN 22 HD21 ASN 22 -6.715 7.572 3.822
181 HD22 ASN 22 HD22 ASN 22 -5.229 8.414 4.086
182 H GLU 23 H GLU 23 -7.377 4.877 -0.111
183 HA GLU 23 HA GLU 23 -9.760 5.577 -1.477
184 HB2 GLU 23 HB3 GLU 23 -7.725 4.715 -2.608
185 HB3 GLU 23 HB2 GLU 23 -8.022 3.129 -1.862
186 HG2 GLU 23 HG3 GLU 23 -10.148 2.976 -3.048
187 HG3 GLU 23 HG2 GLU 23 -9.861 4.553 -3.781
188 H VAL 24 H VAL 24 -8.849 2.915 0.667
189 HA VAL 24 HA VAL 24 -11.229 1.408 0.336
190 HB VAL 24 HB VAL 24 -9.810 1.391 2.970
191 HG11 VAL 24 HG11 VAL 24 -10.873 -0.820 1.208
192 HG12 VAL 24 HG12 VAL 24 -11.700 -0.109 2.595
193 HG13 VAL 24 HG13 VAL 24 -10.204 -1.013 2.828
194 HG21 VAL 24 HG21 VAL 24 -8.186 -0.282 1.861
195 HG22 VAL 24 HG22 VAL 24 -7.879 1.443 1.703
196 HG23 VAL 24 HG23 VAL 24 -8.604 0.558 0.369
197 H ALA 25 H ALA 25 -10.306 4.117 2.329
198 HA ALA 25 HA ALA 25 -12.497 4.045 4.118
199 HB1 ALA 25 HB1 ALA 25 -10.419 5.302 4.542
200 HB2 ALA 25 HB2 ALA 25 -11.871 6.281 4.744
201 HB3 ALA 25 HB3 ALA 25 -10.890 6.451 3.289
202 H ARG 26 H ARG 26 -12.120 5.311 0.891
203 HA ARG 26 HA ARG 26 -14.394 6.992 0.860
204 HB2 ARG 26 HB3 ARG 26 -13.700 5.475 -1.611
205 HB3 ARG 26 HB2 ARG 26 -14.142 7.162 -1.426
206 HG2 ARG 26 HG3 ARG 26 -11.833 7.386 -0.282
207 HG3 ARG 26 HG2 ARG 26 -11.496 5.844 -1.084
208 HD2 ARG 26 HD2 ARG 26 -10.746 7.710 -2.454
209 HD3 ARG 26 HD1 ARG 26 -12.057 6.831 -3.240
210 HE ARG 26 HE ARG 26 -13.221 8.918 -1.821
211 HH11 ARG 26 HH11 ARG 26 -10.950 8.545 -4.455
212 HH12 ARG 26 HH12 ARG 26 -11.431 10.005 -5.252
213 HH21 ARG 26 HH21 ARG 26 -13.853 10.859 -2.863
214 HH22 ARG 26 HH22 ARG 26 -13.072 11.329 -4.338
215 H LEU 27 H LEU 27 -13.918 3.629 -0.110
216 HA LEU 27 HA LEU 27 -16.518 3.241 -1.083
217 HB2 LEU 27 HB3 LEU 27 -14.355 1.350 -0.241
218 HB3 LEU 27 HB2 LEU 27 -15.936 0.762 -0.703
219 HG LEU 27 HG LEU 27 -15.678 1.839 -2.910
220 HD11 LEU 27 HD11 LEU 27 -12.889 2.429 -1.952
221 HD12 LEU 27 HD12 LEU 27 -14.126 3.604 -2.401
222 HD13 LEU 27 HD13 LEU 27 -13.432 2.543 -3.627
223 HD21 LEU 27 HD21 LEU 27 -15.187 -0.477 -2.691
224 HD22 LEU 27 HD22 LEU 27 -13.566 -0.123 -2.090
225 HD23 LEU 27 HD23 LEU 27 -13.990 0.258 -3.760
226 H LYS 28 H LYS 28 -15.145 2.426 2.131
227 HA LYS 28 HA LYS 28 -17.490 1.107 2.960
228 HB2 LYS 28 HB3 LYS 28 -16.649 1.488 5.317
229 HB3 LYS 28 HB2 LYS 28 -15.624 0.568 4.235
230 HG2 LYS 28 HG3 LYS 28 -14.252 2.596 3.881
231 HG3 LYS 28 HG2 LYS 28 -15.251 3.432 5.078
232 HD2 LYS 28 HD3 LYS 28 -14.638 1.789 6.766
233 HD3 LYS 28 HD2 LYS 28 -13.691 0.893 5.577
234 HE2 LYS 28 HE3 LYS 28 -12.144 2.726 5.367
235 HE3 LYS 28 HE2 LYS 28 -13.136 3.737 6.419
236 HZ1 LYS 28 HZ1 LYS 28 -11.270 2.817 7.621
237 HZ2 LYS 28 HZ2 LYS 28 -11.728 1.244 7.205
238 HZ3 LYS 28 HZ3 LYS 28 -12.710 2.167 8.225
239 H LYS 29 H LYS 29 -16.750 4.522 2.889
240 HA LYS 29 HA LYS 29 -18.881 5.346 4.542
241 HB2 LYS 29 HB3 LYS 29 -17.521 6.726 2.229
242 HB3 LYS 29 HB2 LYS 29 -18.697 7.496 3.275
243 HG2 LYS 29 HG3 LYS 29 -17.204 7.020 5.206
244 HG3 LYS 29 HG2 LYS 29 -16.001 6.427 4.064
245 HD2 LYS 29 HD3 LYS 29 -17.169 9.198 3.917
246 HD3 LYS 29 HD2 LYS 29 -15.729 8.818 4.858
247 HE2 LYS 29 HE3 LYS 29 -14.892 9.608 2.828
248 HE3 LYS 29 HE2 LYS 29 -14.783 7.857 2.685
249 HZ1 LYS 29 HZ1 LYS 29 -17.001 9.485 1.567
250 HZ2 LYS 29 HZ2 LYS 29 -16.726 7.838 1.311
251 HZ3 LYS 29 HZ3 LYS 29 -15.653 8.981 0.680
252 H LEU 30 H LEU 30 -18.630 4.506 1.137
253 HA LEU 30 HA LEU 30 -21.340 5.134 0.482
254 HB2 LEU 30 HB3 LEU 30 -19.160 3.581 -0.848
255 HB3 LEU 30 HB2 LEU 30 -20.800 3.450 -1.449
256 HG LEU 30 HG LEU 30 -20.814 5.935 -1.767
257 HD11 LEU 30 HD11 LEU 30 -19.053 6.520 -0.186
258 HD12 LEU 30 HD12 LEU 30 -18.687 7.120 -1.802
259 HD13 LEU 30 HD13 LEU 30 -17.867 5.684 -1.188
260 HD21 LEU 30 HD21 LEU 30 -19.427 5.887 -3.785
261 HD22 LEU 30 HD22 LEU 30 -20.413 4.434 -3.627
262 HD23 LEU 30 HD23 LEU 30 -18.694 4.380 -3.237
263 H VAL 31 H VAL 31 -19.655 2.282 1.651
264 HA VAL 31 HA VAL 31 -21.820 0.469 1.374
265 HB VAL 31 HB VAL 31 -19.534 0.340 3.372
266 HG11 VAL 31 HG11 VAL 31 -19.983 -2.042 3.464
267 HG12 VAL 31 HG12 VAL 31 -21.310 -1.862 2.318
268 HG13 VAL 31 HG13 VAL 31 -21.427 -1.141 3.924
269 HG21 VAL 31 HG21 VAL 31 -18.444 -1.125 1.753
270 HG22 VAL 31 HG22 VAL 31 -18.717 0.483 1.085
271 HG23 VAL 31 HG23 VAL 31 -19.764 -0.855 0.615
272 H GLY 32 H GLY 32 -21.015 2.907 3.715
273 HA2 GLY 32 HA3 GLY 32 -23.226 3.659 4.776
274 HA3 GLY 32 HA2 GLY 32 -23.240 2.029 5.432
275 H GLU 33 H GLU 33 -20.557 4.298 5.036
276 HA GLU 33 HA GLU 33 -19.029 5.150 6.474
277 HB2 GLU 33 HB3 GLU 33 -21.387 5.073 8.351
278 HB3 GLU 33 HB2 GLU 33 -19.852 5.835 8.740
279 HG2 GLU 33 HG3 GLU 33 -20.131 7.357 6.849
280 HG3 GLU 33 HG2 GLU 33 -21.677 6.597 6.473
281 H1 GLY 1 H1 GLY 1 23.895 -6.034 6.107
282 H2 GLY 1 H2 GLY 1 25.211 -5.079 5.645
283 H3 GLY 1 H3 GLY 1 25.216 -6.738 5.320
284 HA2 GLY 1 HA2 GLY 1 24.740 -5.481 3.322
285 HA3 GLY 1 HA3 GLY 1 23.386 -6.499 3.793
286 H SER 2 H SER 2 24.091 -3.565 2.612
287 HA SER 2 HA SER 2 22.277 -1.994 4.232
288 HB2 SER 2 HB3 SER 2 22.833 -0.219 2.492
289 HB3 SER 2 HB2 SER 2 24.202 -0.828 3.425
290 HG SER 2 HG SER 2 24.992 -1.082 1.469
291 H MET 3 H MET 3 22.471 -3.071 0.860
292 HA MET 3 HA MET 3 19.874 -2.172 0.160
293 HB2 MET 3 HB3 MET 3 21.722 -4.168 -1.146
294 HB3 MET 3 HB2 MET 3 20.222 -3.600 -1.870
295 HG2 MET 3 HG3 MET 3 21.090 -1.315 -1.865
296 HG3 MET 3 HG2 MET 3 22.591 -1.890 -1.142
297 HE1 MET 3 HE1 MET 3 20.373 -3.555 -3.973
298 HE2 MET 3 HE2 MET 3 21.168 -2.920 -5.413
299 HE3 MET 3 HE3 MET 3 20.320 -1.826 -4.320
300 H LYS 4 H LYS 4 21.124 -5.101 1.547
301 HA LYS 4 HA LYS 4 19.041 -6.875 1.005
302 HB2 LYS 4 HB3 LYS 4 21.148 -7.601 1.980
303 HB3 LYS 4 HB2 LYS 4 20.819 -6.684 3.442
304 HG2 LYS 4 HG3 LYS 4 18.916 -8.132 3.929
305 HG3 LYS 4 HG2 LYS 4 19.229 -9.041 2.450
306 HD2 LYS 4 HD3 LYS 4 21.404 -9.714 3.301
307 HD3 LYS 4 HD2 LYS 4 21.147 -8.757 4.761
308 HE2 LYS 4 HE3 LYS 4 19.470 -11.106 3.881
309 HE3 LYS 4 HE2 LYS 4 20.712 -11.146 5.130
310 HZ1 LYS 4 HZ1 LYS 4 18.234 -9.514 5.212
311 HZ2 LYS 4 HZ2 LYS 4 19.423 -9.550 6.409
312 HZ3 LYS 4 HZ3 LYS 4 18.511 -10.933 6.088
313 H GLN 5 H GLN 5 19.395 -4.495 3.587
314 HA GLN 5 HA GLN 5 17.045 -5.265 4.991
315 HB2 GLN 5 HB3 GLN 5 18.656 -2.710 5.030
316 HB3 GLN 5 HB2 GLN 5 17.337 -3.060 6.139
317 HG2 GLN 5 HG3 GLN 5 18.535 -4.902 7.083
318 HG3 GLN 5 HG2 GLN 5 19.804 -4.758 5.868
319 HE21 GLN 5 HE21 GLN 5 21.311 -3.129 6.040
320 HE22 GLN 5 HE22 GLN 5 21.518 -2.197 7.484
321 H LEU 6 H LEU 6 17.780 -2.733 2.636
322 HA LEU 6 HA LEU 6 15.226 -1.510 2.772
323 HB2 LEU 6 HB3 LEU 6 17.568 -1.295 0.932
324 HB3 LEU 6 HB2 LEU 6 16.043 -0.586 0.450
325 HG LEU 6 HG LEU 6 17.480 1.094 1.444
326 HD11 LEU 6 HD11 LEU 6 15.206 0.407 3.297
327 HD12 LEU 6 HD12 LEU 6 15.058 1.281 1.773
328 HD13 LEU 6 HD13 LEU 6 15.969 1.985 3.109
329 HD21 LEU 6 HD21 LEU 6 18.836 -0.331 2.872
330 HD22 LEU 6 HD22 LEU 6 17.447 -0.632 3.914
331 HD23 LEU 6 HD23 LEU 6 18.129 0.991 3.800
332 H GLU 7 H GLU 7 16.579 -4.030 0.687
333 HA GLU 7 HA GLU 7 14.471 -3.973 -1.210
334 HB2 GLU 7 HB3 GLU 7 15.343 -6.025 -2.074
335 HB3 GLU 7 HB2 GLU 7 16.704 -5.013 -1.618
336 HG2 GLU 7 HG3 GLU 7 16.978 -6.299 0.436
337 HG3 GLU 7 HG2 GLU 7 15.604 -7.310 -0.013
338 H ASP 8 H ASP 8 14.765 -5.347 1.938
339 HA ASP 8 HA ASP 8 12.524 -7.132 1.654
340 HB2 ASP 8 HB3 ASP 8 14.271 -6.268 3.914
341 HB3 ASP 8 HB2 ASP 8 12.699 -6.963 4.292
342 H LYS 9 H LYS 9 13.085 -3.860 2.736
343 HA LYS 9 HA LYS 9 10.536 -3.432 3.899
344 HB2 LYS 9 HB3 LYS 9 12.599 -1.523 2.795
345 HB3 LYS 9 HB2 LYS 9 11.117 -0.992 3.575
346 HG2 LYS 9 HG3 LYS 9 13.213 -2.712 4.878
347 HG3 LYS 9 HG2 LYS 9 13.084 -0.962 5.062
348 HD2 LYS 9 HD3 LYS 9 10.793 -1.274 5.961
349 HD3 LYS 9 HD2 LYS 9 11.031 -3.020 5.872
350 HE2 LYS 9 HE3 LYS 9 12.926 -2.835 7.411
351 HE3 LYS 9 HE2 LYS 9 12.684 -1.092 7.499
352 HZ1 LYS 9 HZ1 LYS 9 10.500 -1.481 8.455
353 HZ2 LYS 9 HZ2 LYS 9 11.700 -2.220 9.388
354 HZ3 LYS 9 HZ3 LYS 9 10.733 -3.154 8.368
355 H VAL 10 H VAL 10 11.885 -2.528 0.724
356 HA VAL 10 HA VAL 10 9.518 -1.350 -0.237
357 HB VAL 10 HB VAL 10 11.655 -0.867 -1.282
358 HG11 VAL 10 HG11 VAL 10 12.786 -2.465 -2.733
359 HG12 VAL 10 HG12 VAL 10 11.609 -3.703 -2.296
360 HG13 VAL 10 HG13 VAL 10 12.703 -3.058 -1.074
361 HG21 VAL 10 HG21 VAL 10 10.989 -1.122 -3.662
362 HG22 VAL 10 HG22 VAL 10 9.714 -0.474 -2.631
363 HG23 VAL 10 HG23 VAL 10 9.667 -2.162 -3.136
364 H GLU 11 H GLU 11 10.735 -4.673 -0.504
365 HA GLU 11 HA GLU 11 8.671 -5.571 -2.235
366 HB2 GLU 11 HB3 GLU 11 10.802 -6.779 -1.960
367 HB3 GLU 11 HB2 GLU 11 10.370 -7.161 -0.300
368 HG2 GLU 11 HG3 GLU 11 8.450 -8.447 -1.102
369 HG3 GLU 11 HG2 GLU 11 8.903 -8.076 -2.764
370 H GLU 12 H GLU 12 9.044 -5.440 1.266
371 HA GLU 12 HA GLU 12 6.822 -6.955 2.004
372 HB2 GLU 12 HB3 GLU 12 8.546 -6.176 3.584
373 HB3 GLU 12 HB2 GLU 12 7.954 -4.530 3.413
374 HG2 GLU 12 HG3 GLU 12 5.851 -5.132 4.417
375 HG3 GLU 12 HG2 GLU 12 6.325 -6.829 4.472
376 H LEU 13 H LEU 13 6.982 -3.375 1.734
377 HA LEU 13 HA LEU 13 4.147 -3.180 1.907
378 HB2 LEU 13 HB3 LEU 13 6.212 -1.124 1.173
379 HB3 LEU 13 HB2 LEU 13 4.492 -0.783 1.208
380 HG LEU 13 HG LEU 13 4.698 -1.826 3.632
381 HD11 LEU 13 HD11 LEU 13 7.063 -2.351 3.470
382 HD12 LEU 13 HD12 LEU 13 6.782 -1.129 4.710
383 HD13 LEU 13 HD13 LEU 13 7.435 -0.659 3.141
384 HD21 LEU 13 HD21 LEU 13 3.829 0.385 3.089
385 HD22 LEU 13 HD22 LEU 13 5.475 1.003 2.929
386 HD23 LEU 13 HD23 LEU 13 4.889 0.449 4.497
387 H LEU 14 H LEU 14 6.280 -3.616 -0.813
388 HA LEU 14 HA LEU 14 4.495 -2.916 -2.847
389 HB2 LEU 14 HB3 LEU 14 6.827 -3.473 -3.276
390 HB3 LEU 14 HB2 LEU 14 6.584 -5.109 -2.728
391 HG LEU 14 HG LEU 14 6.801 -4.755 -5.217
392 HD11 LEU 14 HD11 LEU 14 5.955 -6.824 -4.300
393 HD12 LEU 14 HD12 LEU 14 5.103 -6.407 -5.788
394 HD13 LEU 14 HD13 LEU 14 4.328 -6.146 -4.224
395 HD21 LEU 14 HD21 LEU 14 4.845 -4.037 -6.451
396 HD22 LEU 14 HD22 LEU 14 5.407 -2.752 -5.381
397 HD23 LEU 14 HD23 LEU 14 3.992 -3.708 -4.943
398 H SER 15 H SER 15 4.881 -5.902 -0.993
399 HA SER 15 HA SER 15 2.675 -7.226 -2.218
400 HB2 SER 15 HB3 SER 15 4.588 -8.396 -1.108
401 HB3 SER 15 HB2 SER 15 3.995 -7.810 0.444
402 HG SER 15 HG SER 15 2.611 -9.505 -1.366
403 H LYS 16 H LYS 16 3.163 -5.451 0.834
404 HA LYS 16 HA LYS 16 0.620 -5.818 1.925
405 HB2 LYS 16 HB3 LYS 16 2.755 -4.736 2.926
406 HB3 LYS 16 HB2 LYS 16 2.135 -3.243 2.238
407 HG2 LYS 16 HG3 LYS 16 0.164 -3.357 3.585
408 HG3 LYS 16 HG2 LYS 16 0.588 -4.970 4.156
409 HD2 LYS 16 HD3 LYS 16 1.237 -3.605 5.920
410 HD3 LYS 16 HD2 LYS 16 2.741 -3.852 5.034
411 HE2 LYS 16 HE3 LYS 16 2.739 -1.566 5.467
412 HE3 LYS 16 HE2 LYS 16 2.133 -1.667 3.817
413 HZ1 LYS 16 HZ1 LYS 16 0.505 -1.309 6.272
414 HZ2 LYS 16 HZ2 LYS 16 -0.131 -1.511 4.724
415 HZ3 LYS 16 HZ3 LYS 16 0.793 -0.146 5.080
416 H ASN 17 H ASN 17 1.730 -3.463 -0.470
417 HA ASN 17 HA ASN 17 -0.558 -1.832 -0.486
418 HB2 ASN 17 HB3 ASN 17 1.576 -1.155 -1.498
419 HB3 ASN 17 HB2 ASN 17 1.401 -2.407 -2.722
420 HD21 ASN 17 HD21 ASN 17 0.244 0.670 -1.582
421 HD22 ASN 17 HD22 ASN 17 -0.619 1.102 -3.015
422 H TYR 18 H TYR 18 0.315 -4.640 -2.508
423 HA TYR 18 HA TYR 18 -2.079 -4.548 -4.018
424 HB2 TYR 18 HB3 TYR 18 -0.029 -6.712 -3.601
425 HB3 TYR 18 HB2 TYR 18 -1.461 -6.962 -4.595
426 HD1 TYR 18 HD1 TYR 18 1.881 -6.220 -4.795
427 HD2 TYR 18 HD2 TYR 18 -1.858 -4.805 -6.247
428 HE1 TYR 18 HE1 TYR 18 3.022 -5.170 -6.702
429 HE2 TYR 18 HE2 TYR 18 -0.727 -3.751 -8.154
430 HH TYR 18 HH TYR 18 1.440 -2.955 -8.801
431 H HIS 19 H HIS 19 -1.193 -6.158 -1.024
432 HA HIS 19 HA HIS 19 -3.544 -7.727 -0.789
433 HB2 HIS 19 HB3 HIS 19 -1.686 -6.622 1.329
434 HB3 HIS 19 HB2 HIS 19 -3.002 -7.737 1.671
435 HD1 HIS 19 HD1 HIS 19 -0.214 -8.621 2.392
436 HD2 HIS 19 HD2 HIS 19 -1.919 -9.343 -1.329
437 HE1 HIS 19 HE1 HIS 19 1.034 -10.586 1.447
438 HE2 HIS 19 HE2 HIS 19 -0.131 -11.109 -0.726
439 H LEU 20 H LEU 20 -2.733 -4.430 0.078
440 HA LEU 20 HA LEU 20 -5.166 -3.875 1.434
441 HB2 LEU 20 HB3 LEU 20 -3.123 -2.616 1.839
442 HB3 LEU 20 HB2 LEU 20 -3.101 -2.075 0.174
443 HG LEU 20 HG LEU 20 -5.191 -0.837 0.573
444 HD11 LEU 20 HD11 LEU 20 -6.098 -2.169 2.394
445 HD12 LEU 20 HD12 LEU 20 -5.952 -0.478 2.874
446 HD13 LEU 20 HD13 LEU 20 -4.773 -1.662 3.443
447 HD21 LEU 20 HD21 LEU 20 -2.957 -0.166 2.480
448 HD22 LEU 20 HD22 LEU 20 -4.180 0.949 1.877
449 HD23 LEU 20 HD23 LEU 20 -3.006 0.247 0.768
450 H GLU 21 H GLU 21 -4.057 -3.699 -1.889
451 HA GLU 21 HA GLU 21 -6.264 -2.271 -2.937
452 HB2 GLU 21 HB3 GLU 21 -4.068 -2.732 -4.114
453 HB3 GLU 21 HB2 GLU 21 -4.651 -4.367 -4.394
454 HG2 GLU 21 HG3 GLU 21 -6.558 -3.461 -5.641
455 HG3 GLU 21 HG2 GLU 21 -5.938 -1.831 -5.383
456 H ASN 22 H ASN 22 -5.661 -5.672 -2.290
457 HA ASN 22 HA ASN 22 -7.996 -6.760 -3.391
458 HB2 ASN 22 HB3 ASN 22 -6.486 -7.651 -0.922
459 HB3 ASN 22 HB2 ASN 22 -7.691 -8.608 -1.770
460 HD21 ASN 22 HD21 ASN 22 -6.748 -7.685 -4.406
461 HD22 ASN 22 HD22 ASN 22 -5.274 -8.540 -4.689
462 H GLU 23 H GLU 23 -7.379 -5.018 -0.455
463 HA GLU 23 HA GLU 23 -9.761 -5.717 0.913
464 HB2 GLU 23 HB3 GLU 23 -7.721 -4.865 2.040
465 HB3 GLU 23 HB2 GLU 23 -8.019 -3.274 1.305
466 HG2 GLU 23 HG3 GLU 23 -10.136 -3.125 2.505
467 HG3 GLU 23 HG2 GLU 23 -9.850 -4.707 3.226
468 H VAL 24 H VAL 24 -8.849 -3.044 -1.214
469 HA VAL 24 HA VAL 24 -11.228 -1.536 -0.872
470 HB VAL 24 HB VAL 24 -9.820 -1.513 -3.509
471 HG11 VAL 24 HG11 VAL 24 -10.872 0.694 -1.737
472 HG12 VAL 24 HG12 VAL 24 -11.705 -0.010 -3.122
473 HG13 VAL 24 HG13 VAL 24 -10.209 0.890 -3.359
474 HG21 VAL 24 HG21 VAL 24 -8.190 0.155 -2.403
475 HG22 VAL 24 HG22 VAL 24 -7.883 -1.572 -2.255
476 HG23 VAL 24 HG23 VAL 24 -8.599 -0.693 -0.911
477 H ALA 25 H ALA 25 -10.317 -4.237 -2.881
478 HA ALA 25 HA ALA 25 -12.516 -4.153 -4.655
479 HB1 ALA 25 HB1 ALA 25 -10.441 -5.406 -5.097
480 HB2 ALA 25 HB2 ALA 25 -11.895 -6.384 -5.294
481 HB3 ALA 25 HB3 ALA 25 -10.906 -6.560 -3.847
482 H ARG 26 H ARG 26 -12.129 -5.429 -1.434
483 HA ARG 26 HA ARG 26 -14.403 -7.112 -1.408
484 HB2 ARG 26 HB3 ARG 26 -13.701 -5.612 1.070
485 HB3 ARG 26 HB2 ARG 26 -14.144 -7.299 0.878
486 HG2 ARG 26 HG3 ARG 26 -11.837 -7.517 -0.275
487 HG3 ARG 26 HG2 ARG 26 -11.497 -5.977 0.534
488 HD2 ARG 26 HD2 ARG 26 -10.745 -7.854 1.890
489 HD3 ARG 26 HD1 ARG 26 -12.048 -6.974 2.686
490 HE ARG 26 HE ARG 26 -13.224 -9.044 1.263
491 HH11 ARG 26 HH11 ARG 26 -10.944 -8.703 3.888
492 HH12 ARG 26 HH12 ARG 26 -11.425 -10.172 4.671
493 HH21 ARG 26 HH21 ARG 26 -13.864 -10.989 2.288
494 HH22 ARG 26 HH22 ARG 26 -13.071 -11.483 3.748
495 H LEU 27 H LEU 27 -13.918 -3.753 -0.429
496 HA LEU 27 HA LEU 27 -16.513 -3.368 0.560
497 HB2 LEU 27 HB3 LEU 27 -14.352 -1.476 -0.283
498 HB3 LEU 27 HB2 LEU 27 -15.931 -0.888 0.188
499 HG LEU 27 HG LEU 27 -15.666 -1.975 2.389
500 HD11 LEU 27 HD11 LEU 27 -12.880 -2.563 1.416
501 HD12 LEU 27 HD12 LEU 27 -14.114 -3.738 1.874
502 HD13 LEU 27 HD13 LEU 27 -13.413 -2.675 3.094
503 HD21 LEU 27 HD21 LEU 27 -15.173 0.342 2.179
504 HD22 LEU 27 HD22 LEU 27 -13.554 -0.012 1.570
505 HD23 LEU 27 HD23 LEU 27 -13.973 -0.399 3.239
506 H LYS 28 H LYS 28 -15.156 -2.544 -2.654
507 HA LYS 28 HA LYS 28 -17.500 -1.216 -3.467
508 HB2 LYS 28 HB3 LYS 28 -16.670 -1.589 -5.828
509 HB3 LYS 28 HB2 LYS 28 -15.640 -0.675 -4.746
510 HG2 LYS 28 HG3 LYS 28 -14.266 -2.705 -4.409
511 HG3 LYS 28 HG2 LYS 28 -15.270 -3.535 -5.605
512 HD2 LYS 28 HD3 LYS 28 -14.663 -1.884 -7.289
513 HD3 LYS 28 HD2 LYS 28 -13.715 -0.993 -6.098
514 HE2 LYS 28 HE3 LYS 28 -12.167 -2.823 -5.896
515 HE3 LYS 28 HE2 LYS 28 -13.158 -3.830 -6.953
516 HZ1 LYS 28 HZ1 LYS 28 -11.294 -2.908 -8.148
517 HZ2 LYS 28 HZ2 LYS 28 -11.744 -1.335 -7.729
518 HZ3 LYS 28 HZ3 LYS 28 -12.729 -2.253 -8.750
519 H LYS 29 H LYS 29 -16.769 -4.630 -3.414
520 HA LYS 29 HA LYS 29 -18.919 -5.427 -5.058
521 HB2 LYS 29 HB3 LYS 29 -17.540 -6.843 -2.773
522 HB3 LYS 29 HB2 LYS 29 -18.719 -7.598 -3.826
523 HG2 LYS 29 HG3 LYS 29 -17.213 -7.126 -5.756
524 HG3 LYS 29 HG2 LYS 29 -16.017 -6.532 -4.606
525 HD2 LYS 29 HD3 LYS 29 -17.190 -9.298 -4.470
526 HD3 LYS 29 HD2 LYS 29 -15.750 -8.922 -5.408
527 HE2 LYS 29 HE3 LYS 29 -14.917 -9.717 -3.383
528 HE3 LYS 29 HE2 LYS 29 -14.807 -7.966 -3.232
529 HZ1 LYS 29 HZ1 LYS 29 -17.030 -9.598 -2.130
530 HZ2 LYS 29 HZ2 LYS 29 -16.754 -7.953 -1.865
531 HZ3 LYS 29 HZ3 LYS 29 -15.684 -9.098 -1.237
532 H LEU 30 H LEU 30 -18.633 -4.621 -1.654
533 HA LEU 30 HA LEU 30 -21.340 -5.244 -0.988
534 HB2 LEU 30 HB3 LEU 30 -19.150 -3.707 0.337
535 HB3 LEU 30 HB2 LEU 30 -20.787 -3.572 0.946
536 HG LEU 30 HG LEU 30 -20.809 -6.059 1.251
537 HD11 LEU 30 HD11 LEU 30 -19.053 -6.636 -0.340
538 HD12 LEU 30 HD12 LEU 30 -18.686 -7.249 1.273
539 HD13 LEU 30 HD13 LEU 30 -17.865 -5.810 0.668
540 HD21 LEU 30 HD21 LEU 30 -19.416 -6.023 3.266
541 HD22 LEU 30 HD22 LEU 30 -20.399 -4.567 3.116
542 HD23 LEU 30 HD23 LEU 30 -18.681 -4.515 2.722
543 H VAL 31 H VAL 31 -19.659 -2.390 -2.160
544 HA VAL 31 HA VAL 31 -21.819 -0.578 -1.858
545 HB VAL 31 HB VAL 31 -19.545 -0.442 -3.868
546 HG11 VAL 31 HG11 VAL 31 -19.996 1.942 -3.942
547 HG12 VAL 31 HG12 VAL 31 -21.319 1.754 -2.794
548 HG13 VAL 31 HG13 VAL 31 -21.440 1.041 -4.405
549 HG21 VAL 31 HG21 VAL 31 -18.448 1.014 -2.245
550 HG22 VAL 31 HG22 VAL 31 -18.718 -0.598 -1.581
551 HG23 VAL 31 HG23 VAL 31 -19.765 0.739 -1.105
552 H GLY 32 H GLY 32 -21.030 -3.003 -4.223
553 HA2 GLY 32 HA3 GLY 32 -23.258 -3.745 -5.269
554 HA3 GLY 32 HA2 GLY 32 -23.262 -2.114 -5.922
555 H GLU 33 H GLU 33 -20.583 -4.387 -5.543
556 HA GLU 33 HA GLU 33 -19.067 -5.247 -6.983
557 HB2 GLU 33 HB3 GLU 33 -21.425 -5.149 -8.860
558 HB3 GLU 33 HB2 GLU 33 -19.893 -5.914 -9.259
559 HG2 GLU 33 HG3 GLU 33 -20.171 -7.443 -7.366
560 HG3 GLU 33 HG2 GLU 33 -21.721 -6.687 -6.996
Start of MODEL 10
1 H1 GLY 1 H1 GLY 1 25.711 6.507 -5.048
2 H2 GLY 1 H2 GLY 1 26.555 6.815 -3.616
3 H3 GLY 1 H3 GLY 1 24.974 7.376 -3.801
4 HA2 GLY 1 HA2 GLY 1 25.804 4.536 -3.651
5 HA3 GLY 1 HA3 GLY 1 25.012 5.446 -2.371
6 H SER 2 H SER 2 23.666 3.326 -2.883
7 HA SER 2 HA SER 2 21.557 4.115 -4.782
8 HB2 SER 2 HB3 SER 2 22.308 1.327 -3.867
9 HB3 SER 2 HB2 SER 2 21.023 1.726 -5.008
10 HG SER 2 HG SER 2 22.537 1.537 -6.447
11 H MET 3 H MET 3 22.107 4.524 -1.743
12 HA MET 3 HA MET 3 20.050 3.084 -0.396
13 HB2 MET 3 HB3 MET 3 22.055 3.967 0.756
14 HB3 MET 3 HB2 MET 3 21.511 5.604 0.438
15 HG2 MET 3 HG3 MET 3 19.799 3.697 1.978
16 HG3 MET 3 HG2 MET 3 21.112 4.571 2.760
17 HE1 MET 3 HE1 MET 3 17.833 6.418 3.942
18 HE2 MET 3 HE2 MET 3 19.277 5.552 4.468
19 HE3 MET 3 HE3 MET 3 18.002 4.698 3.599
20 H LYS 4 H LYS 4 20.320 6.352 -1.730
21 HA LYS 4 HA LYS 4 17.758 7.185 -0.807
22 HB2 LYS 4 HB3 LYS 4 19.582 8.305 -2.931
23 HB3 LYS 4 HB2 LYS 4 18.054 9.050 -2.486
24 HG2 LYS 4 HG3 LYS 4 18.876 9.301 -0.180
25 HG3 LYS 4 HG2 LYS 4 20.424 8.615 -0.678
26 HD2 LYS 4 HD3 LYS 4 20.744 10.448 -2.252
27 HD3 LYS 4 HD2 LYS 4 19.178 11.124 -1.798
28 HE2 LYS 4 HE3 LYS 4 20.981 12.297 -0.664
29 HE3 LYS 4 HE2 LYS 4 19.979 11.427 0.495
30 HZ1 LYS 4 HZ1 LYS 4 21.633 9.688 0.588
31 HZ2 LYS 4 HZ2 LYS 4 22.343 11.176 0.955
32 HZ3 LYS 4 HZ3 LYS 4 22.583 10.481 -0.565
33 H GLN 5 H GLN 5 18.933 5.645 -3.719
34 HA GLN 5 HA GLN 5 16.624 5.935 -5.293
35 HB2 GLN 5 HB3 GLN 5 18.829 3.887 -5.262
36 HB3 GLN 5 HB2 GLN 5 17.490 3.781 -6.398
37 HG2 GLN 5 HG3 GLN 5 18.059 5.914 -7.349
38 HG3 GLN 5 HG2 GLN 5 19.315 6.157 -6.140
39 HE21 GLN 5 HE21 GLN 5 21.259 5.090 -6.340
40 HE22 GLN 5 HE22 GLN 5 21.715 4.237 -7.774
41 H LEU 6 H LEU 6 17.559 3.439 -2.955
42 HA LEU 6 HA LEU 6 15.145 1.948 -3.285
43 HB2 LEU 6 HB3 LEU 6 17.426 1.883 -1.367
44 HB3 LEU 6 HB2 LEU 6 15.935 1.092 -0.900
45 HG LEU 6 HG LEU 6 17.465 -0.521 -1.856
46 HD11 LEU 6 HD11 LEU 6 16.046 -1.478 -3.570
47 HD12 LEU 6 HD12 LEU 6 15.213 0.061 -3.771
48 HD13 LEU 6 HD13 LEU 6 15.069 -0.827 -2.254
49 HD21 LEU 6 HD21 LEU 6 17.423 1.194 -4.334
50 HD22 LEU 6 HD22 LEU 6 18.172 -0.396 -4.195
51 HD23 LEU 6 HD23 LEU 6 18.795 0.957 -3.253
52 H GLU 7 H GLU 7 16.208 4.530 -1.156
53 HA GLU 7 HA GLU 7 14.079 4.453 0.666
54 HB2 GLU 7 HB3 GLU 7 16.122 5.668 1.136
55 HB3 GLU 7 HB2 GLU 7 15.857 6.720 -0.247
56 HG2 GLU 7 HG3 GLU 7 15.283 7.926 1.709
57 HG3 GLU 7 HG2 GLU 7 13.802 7.531 0.841
58 H ASP 8 H ASP 8 14.537 6.198 -2.383
59 HA ASP 8 HA ASP 8 12.043 7.562 -2.291
60 HB2 ASP 8 HB3 ASP 8 14.054 7.022 -4.448
61 HB3 ASP 8 HB2 ASP 8 12.481 7.693 -4.867
62 H LYS 9 H LYS 9 12.989 4.377 -3.247
63 HA LYS 9 HA LYS 9 10.648 3.887 -4.854
64 HB2 LYS 9 HB3 LYS 9 12.859 2.769 -5.242
65 HB3 LYS 9 HB2 LYS 9 12.613 1.876 -3.747
66 HG2 LYS 9 HG3 LYS 9 10.579 0.882 -4.690
67 HG3 LYS 9 HG2 LYS 9 10.864 1.755 -6.195
68 HD2 LYS 9 HD3 LYS 9 12.748 -0.260 -4.971
69 HD3 LYS 9 HD2 LYS 9 11.626 -0.592 -6.291
70 HE2 LYS 9 HE3 LYS 9 12.758 1.134 -7.645
71 HE3 LYS 9 HE2 LYS 9 13.910 1.379 -6.333
72 HZ1 LYS 9 HZ1 LYS 9 13.512 -1.143 -7.848
73 HZ2 LYS 9 HZ2 LYS 9 14.598 -0.932 -6.572
74 HZ3 LYS 9 HZ3 LYS 9 14.816 -0.080 -8.014
75 H VAL 10 H VAL 10 11.780 2.974 -1.608
76 HA VAL 10 HA VAL 10 9.452 1.469 -0.980
77 HB VAL 10 HB VAL 10 11.591 1.158 0.218
78 HG11 VAL 10 HG11 VAL 10 10.968 3.807 1.510
79 HG12 VAL 10 HG12 VAL 10 12.295 3.478 0.399
80 HG13 VAL 10 HG13 VAL 10 12.261 2.705 1.982
81 HG21 VAL 10 HG21 VAL 10 9.568 0.334 1.235
82 HG22 VAL 10 HG22 VAL 10 9.250 1.912 1.957
83 HG23 VAL 10 HG23 VAL 10 10.642 0.966 2.482
84 H GLU 11 H GLU 11 10.361 4.854 -0.570
85 HA GLU 11 HA GLU 11 8.053 5.612 0.908
86 HB2 GLU 11 HB3 GLU 11 10.126 6.983 0.753
87 HB3 GLU 11 HB2 GLU 11 9.755 7.307 -0.934
88 HG2 GLU 11 HG3 GLU 11 7.715 8.455 -0.288
89 HG3 GLU 11 HG2 GLU 11 8.037 8.094 1.408
90 H GLU 12 H GLU 12 8.825 5.380 -2.512
91 HA GLU 12 HA GLU 12 6.502 6.433 -3.616
92 HB2 GLU 12 HB3 GLU 12 8.498 5.757 -4.905
93 HB3 GLU 12 HB2 GLU 12 8.110 4.071 -4.607
94 HG2 GLU 12 HG3 GLU 12 6.051 4.302 -5.871
95 HG3 GLU 12 HG2 GLU 12 6.389 6.012 -6.132
96 H LEU 13 H LEU 13 7.137 3.025 -2.673
97 HA LEU 13 HA LEU 13 4.468 2.208 -3.110
98 HB2 LEU 13 HB3 LEU 13 6.909 1.029 -2.091
99 HB3 LEU 13 HB2 LEU 13 5.483 0.447 -1.245
100 HG LEU 13 HG LEU 13 5.508 0.531 -4.228
101 HD11 LEU 13 HD11 LEU 13 6.349 -1.782 -4.246
102 HD12 LEU 13 HD12 LEU 13 6.645 -1.681 -2.510
103 HD13 LEU 13 HD13 LEU 13 7.555 -0.658 -3.621
104 HD21 LEU 13 HD21 LEU 13 3.404 0.093 -3.132
105 HD22 LEU 13 HD22 LEU 13 4.135 -1.196 -2.176
106 HD23 LEU 13 HD23 LEU 13 3.975 -1.376 -3.923
107 H LEU 14 H LEU 14 6.101 3.435 -0.213
108 HA LEU 14 HA LEU 14 4.017 3.142 1.599
109 HB2 LEU 14 HB3 LEU 14 6.206 3.951 2.255
110 HB3 LEU 14 HB2 LEU 14 6.033 5.378 1.268
111 HG LEU 14 HG LEU 14 5.808 5.646 3.781
112 HD11 LEU 14 HD11 LEU 14 3.577 6.665 2.042
113 HD12 LEU 14 HD12 LEU 14 5.172 7.395 2.228
114 HD13 LEU 14 HD13 LEU 14 4.063 7.335 3.600
115 HD21 LEU 14 HD21 LEU 14 4.382 3.702 4.186
116 HD22 LEU 14 HD22 LEU 14 3.091 4.462 3.255
117 HD23 LEU 14 HD23 LEU 14 3.636 5.192 4.763
118 H SER 15 H SER 15 4.584 5.613 -0.852
119 HA SER 15 HA SER 15 2.278 7.136 -0.401
120 HB2 SER 15 HB3 SER 15 4.218 7.870 -1.774
121 HB3 SER 15 HB2 SER 15 3.741 6.717 -3.017
122 HG SER 15 HG SER 15 2.548 9.126 -2.251
123 H LYS 16 H LYS 16 2.854 4.375 -2.655
124 HA LYS 16 HA LYS 16 0.251 4.385 -3.720
125 HB2 LYS 16 HB3 LYS 16 2.176 2.085 -3.395
126 HB3 LYS 16 HB2 LYS 16 0.674 1.990 -4.306
127 HG2 LYS 16 HG3 LYS 16 1.717 4.128 -5.492
128 HG3 LYS 16 HG2 LYS 16 3.214 3.361 -4.965
129 HD2 LYS 16 HD3 LYS 16 1.054 2.046 -6.606
130 HD3 LYS 16 HD2 LYS 16 2.569 2.685 -7.238
131 HE2 LYS 16 HE3 LYS 16 3.805 1.091 -5.837
132 HE3 LYS 16 HE2 LYS 16 2.275 0.441 -5.248
133 HZ1 LYS 16 HZ1 LYS 16 3.193 0.411 -8.073
134 HZ2 LYS 16 HZ2 LYS 16 1.724 -0.205 -7.512
135 HZ3 LYS 16 HZ3 LYS 16 3.177 -0.913 -7.025
136 H ASN 17 H ASN 17 1.551 2.560 -0.951
137 HA ASN 17 HA ASN 17 -0.747 1.237 -0.147
138 HB2 ASN 17 HB3 ASN 17 1.429 0.867 0.900
139 HB3 ASN 17 HB2 ASN 17 1.422 2.502 1.549
140 HD21 ASN 17 HD21 ASN 17 1.555 1.915 3.667
141 HD22 ASN 17 HD22 ASN 17 0.287 1.096 4.509
142 H TYR 18 H TYR 18 0.344 4.503 0.671
143 HA TYR 18 HA TYR 18 -1.786 5.240 2.328
144 HB2 TYR 18 HB3 TYR 18 0.293 6.514 2.217
145 HB3 TYR 18 HB2 TYR 18 -0.036 6.949 0.546
146 HD1 TYR 18 HD1 TYR 18 -1.617 7.215 3.920
147 HD2 TYR 18 HD2 TYR 18 -0.958 9.021 0.128
148 HE1 TYR 18 HE1 TYR 18 -2.764 9.244 4.696
149 HE2 TYR 18 HE2 TYR 18 -2.104 11.058 0.893
150 HH TYR 18 HH TYR 18 -2.862 11.611 4.182
151 H HIS 19 H HIS 19 -1.371 5.491 -1.174
152 HA HIS 19 HA HIS 19 -3.713 6.933 -1.745
153 HB2 HIS 19 HB3 HIS 19 -2.262 4.879 -3.430
154 HB3 HIS 19 HB2 HIS 19 -3.548 5.919 -4.026
155 HD1 HIS 19 HD1 HIS 19 -0.664 5.939 -5.196
156 HD2 HIS 19 HD2 HIS 19 -2.097 8.591 -2.334
157 HE1 HIS 19 HE1 HIS 19 0.791 7.981 -5.378
158 HE2 HIS 19 HE2 HIS 19 -0.031 9.533 -3.574
159 H LEU 20 H LEU 20 -3.121 3.432 -1.667
160 HA LEU 20 HA LEU 20 -5.793 2.711 -2.249
161 HB2 LEU 20 HB3 LEU 20 -3.411 1.266 -1.182
162 HB3 LEU 20 HB2 LEU 20 -4.982 0.504 -1.059
163 HG LEU 20 HG LEU 20 -3.724 -0.245 -3.042
164 HD11 LEU 20 HD11 LEU 20 -6.140 -0.323 -3.096
165 HD12 LEU 20 HD12 LEU 20 -5.510 0.097 -4.688
166 HD13 LEU 20 HD13 LEU 20 -6.206 1.347 -3.659
167 HD21 LEU 20 HD21 LEU 20 -3.434 1.283 -4.935
168 HD22 LEU 20 HD22 LEU 20 -2.483 1.779 -3.536
169 HD23 LEU 20 HD23 LEU 20 -3.981 2.622 -3.929
170 H GLU 21 H GLU 21 -4.076 3.338 0.767
171 HA GLU 21 HA GLU 21 -6.073 2.483 2.546
172 HB2 GLU 21 HB3 GLU 21 -4.008 4.668 2.766
173 HB3 GLU 21 HB2 GLU 21 -5.109 4.285 4.082
174 HG2 GLU 21 HG3 GLU 21 -4.239 2.034 4.199
175 HG3 GLU 21 HG2 GLU 21 -3.192 2.339 2.816
176 H ASN 22 H ASN 22 -5.658 5.538 0.829
177 HA ASN 22 HA ASN 22 -7.855 6.892 1.977
178 HB2 ASN 22 HB3 ASN 22 -6.552 7.230 -0.733
179 HB3 ASN 22 HB2 ASN 22 -7.752 8.330 -0.067
180 HD21 ASN 22 HD21 ASN 22 -5.015 8.840 -0.856
181 HD22 ASN 22 HD22 ASN 22 -4.217 9.462 0.544
182 H GLU 23 H GLU 23 -7.583 4.527 -0.554
183 HA GLU 23 HA GLU 23 -10.194 5.025 -1.650
184 HB2 GLU 23 HB3 GLU 23 -8.442 2.592 -2.060
185 HB3 GLU 23 HB2 GLU 23 -9.797 3.121 -3.079
186 HG2 GLU 23 HG3 GLU 23 -7.123 4.466 -2.738
187 HG3 GLU 23 HG2 GLU 23 -7.745 3.658 -4.175
188 H VAL 24 H VAL 24 -8.727 2.628 0.513
189 HA VAL 24 HA VAL 24 -11.022 1.046 0.845
190 HB VAL 24 HB VAL 24 -8.791 1.511 2.846
191 HG11 VAL 24 HG11 VAL 24 -10.827 0.563 3.871
192 HG12 VAL 24 HG12 VAL 24 -9.486 -0.580 3.868
193 HG13 VAL 24 HG13 VAL 24 -10.791 -0.750 2.693
194 HG21 VAL 24 HG21 VAL 24 -7.941 0.650 0.758
195 HG22 VAL 24 HG22 VAL 24 -9.171 -0.614 0.747
196 HG23 VAL 24 HG23 VAL 24 -7.912 -0.620 1.981
197 H ALA 25 H ALA 25 -9.894 3.941 2.486
198 HA ALA 25 HA ALA 25 -11.865 3.954 4.523
199 HB1 ALA 25 HB1 ALA 25 -9.750 5.201 4.675
200 HB2 ALA 25 HB2 ALA 25 -11.154 6.228 4.955
201 HB3 ALA 25 HB3 ALA 25 -10.315 6.286 3.406
202 H ARG 26 H ARG 26 -11.836 5.084 1.219
203 HA ARG 26 HA ARG 26 -14.087 6.819 1.493
204 HB2 ARG 26 HB3 ARG 26 -13.819 7.314 -0.738
205 HB3 ARG 26 HB2 ARG 26 -12.213 6.733 -0.345
206 HG2 ARG 26 HG3 ARG 26 -12.718 4.569 -1.322
207 HG3 ARG 26 HG2 ARG 26 -14.364 5.104 -1.673
208 HD2 ARG 26 HD2 ARG 26 -11.824 6.275 -2.802
209 HD3 ARG 26 HD1 ARG 26 -12.952 5.223 -3.654
210 HE ARG 26 HE ARG 26 -14.026 7.714 -2.597
211 HH11 ARG 26 HH11 ARG 26 -12.832 5.932 -5.364
212 HH12 ARG 26 HH12 ARG 26 -13.501 7.042 -6.519
213 HH21 ARG 26 HH21 ARG 26 -14.902 9.169 -4.114
214 HH22 ARG 26 HH22 ARG 26 -14.669 8.883 -5.813
215 H LEU 27 H LEU 27 -13.606 3.534 0.357
216 HA LEU 27 HA LEU 27 -16.339 3.113 -0.350
217 HB2 LEU 27 HB3 LEU 27 -14.118 1.144 0.138
218 HB3 LEU 27 HB2 LEU 27 -15.687 0.756 -0.532
219 HG LEU 27 HG LEU 27 -13.985 2.796 -1.866
220 HD11 LEU 27 HD11 LEU 27 -12.956 1.083 -3.204
221 HD12 LEU 27 HD12 LEU 27 -13.817 -0.166 -2.304
222 HD13 LEU 27 HD13 LEU 27 -12.594 0.818 -1.497
223 HD21 LEU 27 HD21 LEU 27 -15.193 1.910 -3.848
224 HD22 LEU 27 HD22 LEU 27 -16.254 2.613 -2.630
225 HD23 LEU 27 HD23 LEU 27 -16.106 0.860 -2.761
226 H LYS 28 H LYS 28 -14.397 2.294 2.489
227 HA LYS 28 HA LYS 28 -16.106 0.623 3.817
228 HB2 LYS 28 HB3 LYS 28 -13.816 1.337 4.553
229 HB3 LYS 28 HB2 LYS 28 -14.539 2.818 5.165
230 HG2 LYS 28 HG3 LYS 28 -14.198 1.188 6.940
231 HG3 LYS 28 HG2 LYS 28 -15.913 1.531 6.705
232 HD2 LYS 28 HD3 LYS 28 -16.170 -0.526 5.430
233 HD3 LYS 28 HD2 LYS 28 -14.443 -0.853 5.579
234 HE2 LYS 28 HE3 LYS 28 -16.379 -0.649 7.881
235 HE3 LYS 28 HE2 LYS 28 -15.811 -2.156 7.167
236 HZ1 LYS 28 HZ1 LYS 28 -14.552 -1.638 9.134
237 HZ2 LYS 28 HZ2 LYS 28 -14.138 -0.117 8.527
238 HZ3 LYS 28 HZ3 LYS 28 -13.542 -1.511 7.781
239 H LYS 29 H LYS 29 -16.262 4.183 3.787
240 HA LYS 29 HA LYS 29 -18.550 4.198 5.509
241 HB2 LYS 29 HB3 LYS 29 -18.624 6.616 4.986
242 HB3 LYS 29 HB2 LYS 29 -17.084 6.081 5.627
243 HG2 LYS 29 HG3 LYS 29 -16.145 6.090 3.376
244 HG3 LYS 29 HG2 LYS 29 -17.703 6.611 2.730
245 HD2 LYS 29 HD3 LYS 29 -17.573 8.671 3.997
246 HD3 LYS 29 HD2 LYS 29 -16.067 8.144 4.749
247 HE2 LYS 29 HE3 LYS 29 -14.984 8.125 2.562
248 HE3 LYS 29 HE2 LYS 29 -16.491 8.637 1.805
249 HZ1 LYS 29 HZ1 LYS 29 -16.389 10.689 3.050
250 HZ2 LYS 29 HZ2 LYS 29 -14.966 10.484 2.158
251 HZ3 LYS 29 HZ3 LYS 29 -14.966 10.191 3.822
252 H LEU 30 H LEU 30 -18.007 4.167 2.053
253 HA LEU 30 HA LEU 30 -20.625 4.934 1.277
254 HB2 LEU 30 HB3 LEU 30 -18.556 3.265 -0.147
255 HB3 LEU 30 HB2 LEU 30 -20.066 3.777 -0.876
256 HG LEU 30 HG LEU 30 -17.868 5.610 0.092
257 HD11 LEU 30 HD11 LEU 30 -17.561 6.104 -2.284
258 HD12 LEU 30 HD12 LEU 30 -18.766 4.882 -2.692
259 HD13 LEU 30 HD13 LEU 30 -17.252 4.406 -1.925
260 HD21 LEU 30 HD21 LEU 30 -20.042 6.644 0.362
261 HD22 LEU 30 HD22 LEU 30 -20.480 6.210 -1.289
262 HD23 LEU 30 HD23 LEU 30 -19.192 7.376 -0.997
263 H VAL 31 H VAL 31 -19.185 1.878 2.218
264 HA VAL 31 HA VAL 31 -21.544 0.339 1.604
265 HB VAL 31 HB VAL 31 -19.253 -0.425 3.437
266 HG11 VAL 31 HG11 VAL 31 -21.240 -2.141 1.950
267 HG12 VAL 31 HG12 VAL 31 -21.258 -1.812 3.683
268 HG13 VAL 31 HG13 VAL 31 -19.924 -2.718 2.971
269 HG21 VAL 31 HG21 VAL 31 -18.296 -1.585 1.502
270 HG22 VAL 31 HG22 VAL 31 -18.391 0.156 1.237
271 HG23 VAL 31 HG23 VAL 31 -19.566 -0.918 0.478
272 H GLY 32 H GLY 32 -20.385 2.270 4.200
273 HA2 GLY 32 HA3 GLY 32 -22.123 1.209 6.223
274 HA3 GLY 32 HA2 GLY 32 -21.197 2.700 6.316
275 H GLU 33 H GLU 33 -22.078 4.270 4.391
276 HA GLU 33 HA GLU 33 -24.952 4.192 4.191
277 HB2 GLU 33 HB3 GLU 33 -25.333 6.423 5.157
278 HB3 GLU 33 HB2 GLU 33 -24.769 5.274 6.353
279 HG2 GLU 33 HG3 GLU 33 -22.912 7.203 5.000
280 HG3 GLU 33 HG2 GLU 33 -23.837 7.639 6.432
281 H1 GLY 1 H1 GLY 1 25.731 -6.710 4.346
282 H2 GLY 1 H2 GLY 1 26.562 -7.033 2.912
283 H3 GLY 1 H3 GLY 1 24.976 -7.587 3.114
284 HA2 GLY 1 HA2 GLY 1 25.819 -4.750 2.940
285 HA3 GLY 1 HA3 GLY 1 25.015 -5.661 1.670
286 H SER 2 H SER 2 23.687 -3.526 2.187
287 HA SER 2 HA SER 2 21.580 -4.309 4.092
288 HB2 SER 2 HB3 SER 2 22.339 -1.527 3.174
289 HB3 SER 2 HB2 SER 2 21.053 -1.919 4.315
290 HG SER 2 HG SER 2 22.584 -1.712 5.744
291 H MET 3 H MET 3 22.117 -4.721 1.052
292 HA MET 3 HA MET 3 20.055 -3.287 -0.290
293 HB2 MET 3 HB3 MET 3 22.055 -4.177 -1.445
294 HB3 MET 3 HB2 MET 3 21.504 -5.811 -1.124
295 HG2 MET 3 HG3 MET 3 19.792 -3.902 -2.660
296 HG3 MET 3 HG2 MET 3 21.101 -4.780 -3.447
297 HE1 MET 3 HE1 MET 3 17.815 -6.626 -4.603
298 HE2 MET 3 HE2 MET 3 19.258 -5.768 -5.142
299 HE3 MET 3 HE3 MET 3 17.992 -4.906 -4.268
300 H LYS 4 H LYS 4 20.319 -6.552 1.057
301 HA LYS 4 HA LYS 4 17.751 -7.380 0.143
302 HB2 LYS 4 HB3 LYS 4 19.582 -8.499 2.262
303 HB3 LYS 4 HB2 LYS 4 18.050 -9.241 1.824
304 HG2 LYS 4 HG3 LYS 4 18.862 -9.498 -0.483
305 HG3 LYS 4 HG2 LYS 4 20.414 -8.817 0.007
306 HD2 LYS 4 HD3 LYS 4 20.732 -10.647 1.585
307 HD3 LYS 4 HD2 LYS 4 19.164 -11.319 1.137
308 HE2 LYS 4 HE3 LYS 4 20.955 -12.503 0.004
309 HE3 LYS 4 HE2 LYS 4 19.954 -11.632 -1.155
310 HZ1 LYS 4 HZ1 LYS 4 21.620 -9.905 -1.263
311 HZ2 LYS 4 HZ2 LYS 4 22.318 -11.397 -1.627
312 HZ3 LYS 4 HZ3 LYS 4 22.572 -10.698 -0.112
313 H GLN 5 H GLN 5 18.942 -5.826 3.038
314 HA GLN 5 HA GLN 5 16.643 -6.115 4.631
315 HB2 GLN 5 HB3 GLN 5 18.853 -4.075 4.586
316 HB3 GLN 5 HB2 GLN 5 17.519 -3.961 5.726
317 HG2 GLN 5 HG3 GLN 5 18.088 -6.094 6.681
318 HG3 GLN 5 HG2 GLN 5 19.337 -6.345 5.464
319 HE21 GLN 5 HE21 GLN 5 21.288 -5.288 5.656
320 HE22 GLN 5 HE22 GLN 5 21.752 -4.429 7.086
321 H LEU 6 H LEU 6 17.575 -3.623 2.286
322 HA LEU 6 HA LEU 6 15.164 -2.127 2.619
323 HB2 LEU 6 HB3 LEU 6 17.437 -2.077 0.693
324 HB3 LEU 6 HB2 LEU 6 15.947 -1.281 0.228
325 HG LEU 6 HG LEU 6 17.485 0.330 1.173
326 HD11 LEU 6 HD11 LEU 6 16.076 1.296 2.890
327 HD12 LEU 6 HD12 LEU 6 15.240 -0.241 3.100
328 HD13 LEU 6 HD13 LEU 6 15.091 0.642 1.582
329 HD21 LEU 6 HD21 LEU 6 17.452 -1.380 3.656
330 HD22 LEU 6 HD22 LEU 6 18.203 0.209 3.510
331 HD23 LEU 6 HD23 LEU 6 18.819 -1.149 2.567
332 H GLU 7 H GLU 7 16.213 -4.716 0.491
333 HA GLU 7 HA GLU 7 14.078 -4.642 -1.322
334 HB2 GLU 7 HB3 GLU 7 16.116 -5.860 -1.799
335 HB3 GLU 7 HB2 GLU 7 15.852 -6.910 -0.414
336 HG2 GLU 7 HG3 GLU 7 15.266 -8.118 -2.361
337 HG3 GLU 7 HG2 GLU 7 13.789 -7.710 -1.496
338 H ASP 8 H ASP 8 14.546 -6.376 1.733
339 HA ASP 8 HA ASP 8 12.049 -7.738 1.654
340 HB2 ASP 8 HB3 ASP 8 14.071 -7.198 3.800
341 HB3 ASP 8 HB2 ASP 8 12.500 -7.863 4.227
342 H LYS 9 H LYS 9 13.002 -4.553 2.599
343 HA LYS 9 HA LYS 9 10.670 -4.050 4.212
344 HB2 LYS 9 HB3 LYS 9 12.887 -2.937 4.581
345 HB3 LYS 9 HB2 LYS 9 12.632 -2.045 3.088
346 HG2 LYS 9 HG3 LYS 9 10.607 -1.046 4.044
347 HG3 LYS 9 HG2 LYS 9 10.899 -1.919 5.547
348 HD2 LYS 9 HD3 LYS 9 12.783 0.090 4.313
349 HD3 LYS 9 HD2 LYS 9 11.670 0.425 5.640
350 HE2 LYS 9 HE3 LYS 9 12.803 -1.306 6.986
351 HE3 LYS 9 HE2 LYS 9 13.945 -1.557 5.667
352 HZ1 LYS 9 HZ1 LYS 9 13.571 0.969 7.178
353 HZ2 LYS 9 HZ2 LYS 9 14.654 0.744 5.902
354 HZ3 LYS 9 HZ3 LYS 9 14.864 -0.105 7.348
355 H VAL 10 H VAL 10 11.788 -3.150 0.960
356 HA VAL 10 HA VAL 10 9.459 -1.641 0.332
357 HB VAL 10 HB VAL 10 11.597 -1.338 -0.872
358 HG11 VAL 10 HG11 VAL 10 10.965 -3.991 -2.154
359 HG12 VAL 10 HG12 VAL 10 12.297 -3.659 -1.049
360 HG13 VAL 10 HG13 VAL 10 12.257 -2.892 -2.635
361 HG21 VAL 10 HG21 VAL 10 9.571 -0.513 -1.883
362 HG22 VAL 10 HG22 VAL 10 9.249 -2.091 -2.601
363 HG23 VAL 10 HG23 VAL 10 10.640 -1.149 -3.134
364 H GLU 11 H GLU 11 10.363 -5.030 -0.066
365 HA GLU 11 HA GLU 11 8.048 -5.786 -1.534
366 HB2 GLU 11 HB3 GLU 11 10.115 -7.163 -1.384
367 HB3 GLU 11 HB2 GLU 11 9.750 -7.483 0.305
368 HG2 GLU 11 HG3 GLU 11 7.702 -8.623 -0.334
369 HG3 GLU 11 HG2 GLU 11 8.020 -8.268 -2.031
370 H GLU 12 H GLU 12 8.833 -5.552 1.884
371 HA GLU 12 HA GLU 12 6.512 -6.593 3.000
372 HB2 GLU 12 HB3 GLU 12 8.515 -5.923 4.277
373 HB3 GLU 12 HB2 GLU 12 8.131 -4.235 3.975
374 HG2 GLU 12 HG3 GLU 12 6.077 -4.454 5.243
375 HG3 GLU 12 HG2 GLU 12 6.412 -6.165 5.510
376 H LEU 13 H LEU 13 7.151 -3.189 2.048
377 HA LEU 13 HA LEU 13 4.484 -2.363 2.489
378 HB2 LEU 13 HB3 LEU 13 6.924 -1.191 1.458
379 HB3 LEU 13 HB2 LEU 13 5.495 -0.608 0.619
380 HG LEU 13 HG LEU 13 5.535 -0.684 3.602
381 HD11 LEU 13 HD11 LEU 13 6.384 1.629 3.604
382 HD12 LEU 13 HD12 LEU 13 6.671 1.517 1.867
383 HD13 LEU 13 HD13 LEU 13 7.583 0.497 2.980
384 HD21 LEU 13 HD21 LEU 13 3.429 -0.244 2.511
385 HD22 LEU 13 HD22 LEU 13 4.158 1.041 1.549
386 HD23 LEU 13 HD23 LEU 13 4.005 1.226 3.297
387 H LEU 14 H LEU 14 6.107 -3.604 -0.408
388 HA LEU 14 HA LEU 14 4.015 -3.306 -2.210
389 HB2 LEU 14 HB3 LEU 14 6.197 -4.124 -2.876
390 HB3 LEU 14 HB2 LEU 14 6.022 -5.549 -1.886
391 HG LEU 14 HG LEU 14 5.786 -5.818 -4.397
392 HD11 LEU 14 HD11 LEU 14 3.563 -6.828 -2.644
393 HD12 LEU 14 HD12 LEU 14 5.155 -7.560 -2.838
394 HD13 LEU 14 HD13 LEU 14 4.039 -7.501 -4.202
395 HD21 LEU 14 HD21 LEU 14 4.362 -3.874 -4.797
396 HD22 LEU 14 HD22 LEU 14 3.073 -4.629 -3.861
397 HD23 LEU 14 HD23 LEU 14 3.613 -5.363 -5.371
398 H SER 15 H SER 15 4.582 -5.773 0.242
399 HA SER 15 HA SER 15 2.271 -7.293 -0.193
400 HB2 SER 15 HB3 SER 15 4.220 -8.022 1.169
401 HB3 SER 15 HB2 SER 15 3.750 -6.868 2.413
402 HG SER 15 HG SER 15 2.538 -9.269 1.642
403 H LYS 16 H LYS 16 2.868 -4.523 2.044
404 HA LYS 16 HA LYS 16 0.269 -4.525 3.123
405 HB2 LYS 16 HB3 LYS 16 2.204 -2.234 2.788
406 HB3 LYS 16 HB2 LYS 16 0.703 -2.129 3.701
407 HG2 LYS 16 HG3 LYS 16 1.739 -4.268 4.888
408 HG3 LYS 16 HG2 LYS 16 3.238 -3.507 4.357
409 HD2 LYS 16 HD3 LYS 16 1.088 -2.184 6.008
410 HD3 LYS 16 HD2 LYS 16 2.606 -2.824 6.631
411 HE2 LYS 16 HE3 LYS 16 3.837 -1.235 5.225
412 HE3 LYS 16 HE2 LYS 16 2.308 -0.586 4.633
413 HZ1 LYS 16 HZ1 LYS 16 3.232 -0.546 7.454
414 HZ2 LYS 16 HZ2 LYS 16 1.761 0.072 6.895
415 HZ3 LYS 16 HZ3 LYS 16 3.216 0.775 6.398
416 H ASN 17 H ASN 17 1.562 -2.711 0.343
417 HA ASN 17 HA ASN 17 -0.738 -1.384 -0.452
418 HB2 ASN 17 HB3 ASN 17 1.433 -1.022 -1.513
419 HB3 ASN 17 HB2 ASN 17 1.418 -2.657 -2.159
420 HD21 ASN 17 HD21 ASN 17 1.542 -2.086 -4.272
421 HD22 ASN 17 HD22 ASN 17 0.275 -1.273 -5.119
422 H TYR 18 H TYR 18 0.338 -4.654 -1.266
423 HA TYR 18 HA TYR 18 -1.800 -5.391 -2.913
424 HB2 TYR 18 HB3 TYR 18 0.277 -6.667 -2.809
425 HB3 TYR 18 HB2 TYR 18 -0.045 -7.097 -1.133
426 HD1 TYR 18 HD1 TYR 18 -1.643 -7.370 -4.502
427 HD2 TYR 18 HD2 TYR 18 -0.965 -9.165 -0.707
428 HE1 TYR 18 HE1 TYR 18 -2.802 -9.400 -5.263
429 HE2 TYR 18 HE2 TYR 18 -2.121 -11.200 -1.457
430 HH TYR 18 HH TYR 18 -2.915 -11.761 -4.737
431 H HIS 19 H HIS 19 -1.370 -5.638 0.591
432 HA HIS 19 HA HIS 19 -3.715 -7.072 1.177
433 HB2 HIS 19 HB3 HIS 19 -2.253 -5.015 2.848
434 HB3 HIS 19 HB2 HIS 19 -3.541 -6.050 3.452
435 HD1 HIS 19 HD1 HIS 19 -0.650 -6.072 4.606
436 HD2 HIS 19 HD2 HIS 19 -2.105 -8.729 1.761
437 HE1 HIS 19 HE1 HIS 19 0.799 -8.118 4.785
438 HE2 HIS 19 HE2 HIS 19 -0.004 -9.646 2.956
439 H LEU 20 H LEU 20 -3.113 -3.573 1.078
440 HA LEU 20 HA LEU 20 -5.778 -2.843 1.679
441 HB2 LEU 20 HB3 LEU 20 -3.395 -1.405 0.602
442 HB3 LEU 20 HB2 LEU 20 -4.964 -0.640 0.479
443 HG LEU 20 HG LEU 20 -3.705 0.115 2.454
444 HD11 LEU 20 HD11 LEU 20 -6.118 0.195 2.522
445 HD12 LEU 20 HD12 LEU 20 -5.484 -0.231 4.112
446 HD13 LEU 20 HD13 LEU 20 -6.183 -1.476 3.080
447 HD21 LEU 20 HD21 LEU 20 -3.399 -1.396 4.354
448 HD22 LEU 20 HD22 LEU 20 -2.461 -1.907 2.951
449 HD23 LEU 20 HD23 LEU 20 -3.957 -2.744 3.364
450 H GLU 21 H GLU 21 -4.079 -3.477 -1.346
451 HA GLU 21 HA GLU 21 -6.082 -2.622 -3.120
452 HB2 GLU 21 HB3 GLU 21 -4.028 -4.818 -3.337
453 HB3 GLU 21 HB2 GLU 21 -5.133 -4.438 -4.649
454 HG2 GLU 21 HG3 GLU 21 -4.254 -2.190 -4.780
455 HG3 GLU 21 HG2 GLU 21 -3.195 -2.500 -3.406
456 H ASN 22 H ASN 22 -5.662 -5.675 -1.401
457 HA ASN 22 HA ASN 22 -7.870 -7.026 -2.526
458 HB2 ASN 22 HB3 ASN 22 -6.555 -7.360 0.179
459 HB3 ASN 22 HB2 ASN 22 -7.757 -8.461 -0.483
460 HD21 ASN 22 HD21 ASN 22 -5.023 -8.978 0.300
461 HD22 ASN 22 HD22 ASN 22 -4.227 -9.597 -1.104
462 H GLU 23 H GLU 23 -7.581 -4.652 -0.011
463 HA GLU 23 HA GLU 23 -10.189 -5.144 1.102
464 HB2 GLU 23 HB3 GLU 23 -8.425 -2.716 1.501
465 HB3 GLU 23 HB2 GLU 23 -9.778 -3.238 2.525
466 HG2 GLU 23 HG3 GLU 23 -7.109 -4.590 2.179
467 HG3 GLU 23 HG2 GLU 23 -7.725 -3.780 3.616
468 H VAL 24 H VAL 24 -8.723 -2.752 -1.075
469 HA VAL 24 HA VAL 24 -11.018 -1.167 -1.400
470 HB VAL 24 HB VAL 24 -8.797 -1.645 -3.409
471 HG11 VAL 24 HG11 VAL 24 -10.835 -0.695 -4.427
472 HG12 VAL 24 HG12 VAL 24 -9.490 0.445 -4.431
473 HG13 VAL 24 HG13 VAL 24 -10.791 0.621 -3.252
474 HG21 VAL 24 HG21 VAL 24 -7.937 -0.783 -1.326
475 HG22 VAL 24 HG22 VAL 24 -9.164 0.485 -1.310
476 HG23 VAL 24 HG23 VAL 24 -7.912 0.487 -2.550
477 H ALA 25 H ALA 25 -9.901 -4.064 -3.044
478 HA ALA 25 HA ALA 25 -11.884 -4.081 -5.067
479 HB1 ALA 25 HB1 ALA 25 -9.772 -5.333 -5.225
480 HB2 ALA 25 HB2 ALA 25 -11.182 -6.356 -5.495
481 HB3 ALA 25 HB3 ALA 25 -10.337 -6.412 -3.950
482 H ARG 26 H ARG 26 -11.844 -5.205 -1.757
483 HA ARG 26 HA ARG 26 -14.101 -6.934 -2.021
484 HB2 ARG 26 HB3 ARG 26 -13.824 -7.429 0.209
485 HB3 ARG 26 HB2 ARG 26 -12.218 -6.852 -0.191
486 HG2 ARG 26 HG3 ARG 26 -12.712 -4.688 0.782
487 HG3 ARG 26 HG2 ARG 26 -14.359 -5.214 1.143
488 HD2 ARG 26 HD2 ARG 26 -11.818 -6.389 2.264
489 HD3 ARG 26 HD1 ARG 26 -12.939 -5.331 3.116
490 HE ARG 26 HE ARG 26 -14.027 -7.820 2.074
491 HH11 ARG 26 HH11 ARG 26 -12.814 -6.036 4.829
492 HH12 ARG 26 HH12 ARG 26 -13.469 -7.141 5.993
493 HH21 ARG 26 HH21 ARG 26 -14.896 -9.268 3.594
494 HH22 ARG 26 HH22 ARG 26 -14.657 -8.989 5.290
495 H LEU 27 H LEU 27 -13.604 -3.648 -0.893
496 HA LEU 27 HA LEU 27 -16.333 -3.222 -0.179
497 HB2 LEU 27 HB3 LEU 27 -14.112 -1.256 -0.678
498 HB3 LEU 27 HB2 LEU 27 -15.677 -0.866 -0.001
499 HG LEU 27 HG LEU 27 -13.974 -2.905 1.331
500 HD11 LEU 27 HD11 LEU 27 -12.934 -1.194 2.659
501 HD12 LEU 27 HD12 LEU 27 -13.794 0.057 1.759
502 HD13 LEU 27 HD13 LEU 27 -12.579 -0.936 0.951
503 HD21 LEU 27 HD21 LEU 27 -15.169 -2.011 3.315
504 HD22 LEU 27 HD22 LEU 27 -16.237 -2.719 2.103
505 HD23 LEU 27 HD23 LEU 27 -16.087 -0.965 2.228
506 H LYS 28 H LYS 28 -14.403 -2.416 -3.027
507 HA LYS 28 HA LYS 28 -16.111 -0.740 -4.355
508 HB2 LYS 28 HB3 LYS 28 -13.822 -1.463 -5.096
509 HB3 LYS 28 HB2 LYS 28 -14.553 -2.943 -5.704
510 HG2 LYS 28 HG3 LYS 28 -14.215 -1.315 -7.485
511 HG3 LYS 28 HG2 LYS 28 -15.930 -1.654 -7.240
512 HD2 LYS 28 HD3 LYS 28 -16.180 0.402 -5.965
513 HD3 LYS 28 HD2 LYS 28 -14.452 0.730 -6.121
514 HE2 LYS 28 HE3 LYS 28 -16.400 0.525 -8.414
515 HE3 LYS 28 HE2 LYS 28 -15.828 2.032 -7.703
516 HZ1 LYS 28 HZ1 LYS 28 -14.577 1.520 -9.671
517 HZ2 LYS 28 HZ2 LYS 28 -14.164 -0.006 -9.076
518 HZ3 LYS 28 HZ3 LYS 28 -13.561 1.386 -8.324
519 H LYS 29 H LYS 29 -16.278 -4.300 -4.311
520 HA LYS 29 HA LYS 29 -18.571 -4.312 -6.024
521 HB2 LYS 29 HB3 LYS 29 -18.653 -6.731 -5.493
522 HB3 LYS 29 HB2 LYS 29 -17.113 -6.202 -6.139
523 HG2 LYS 29 HG3 LYS 29 -16.166 -6.207 -3.893
524 HG3 LYS 29 HG2 LYS 29 -17.721 -6.723 -3.238
525 HD2 LYS 29 HD3 LYS 29 -17.604 -8.787 -4.503
526 HD3 LYS 29 HD2 LYS 29 -16.098 -8.264 -5.260
527 HE2 LYS 29 HE3 LYS 29 -15.010 -8.240 -3.076
528 HE3 LYS 29 HE2 LYS 29 -16.514 -8.749 -2.313
529 HZ1 LYS 29 HZ1 LYS 29 -16.416 -10.804 -3.553
530 HZ2 LYS 29 HZ2 LYS 29 -14.993 -10.597 -2.665
531 HZ3 LYS 29 HZ3 LYS 29 -14.997 -10.308 -4.331
532 H LEU 30 H LEU 30 -18.015 -4.283 -2.568
533 HA LEU 30 HA LEU 30 -20.633 -5.032 -1.781
534 HB2 LEU 30 HB3 LEU 30 -18.551 -3.367 -0.370
535 HB3 LEU 30 HB2 LEU 30 -20.058 -3.870 0.368
536 HG LEU 30 HG LEU 30 -17.874 -5.715 -0.606
537 HD11 LEU 30 HD11 LEU 30 -17.556 -6.202 1.773
538 HD12 LEU 30 HD12 LEU 30 -18.756 -4.975 2.180
539 HD13 LEU 30 HD13 LEU 30 -17.242 -4.506 1.405
540 HD21 LEU 30 HD21 LEU 30 -20.052 -6.745 -0.861
541 HD22 LEU 30 HD22 LEU 30 -20.482 -6.303 0.790
542 HD23 LEU 30 HD23 LEU 30 -19.197 -7.473 0.497
543 H VAL 31 H VAL 31 -19.190 -1.981 -2.733
544 HA VAL 31 HA VAL 31 -21.542 -0.432 -2.113
545 HB VAL 31 HB VAL 31 -19.256 0.318 -3.960
546 HG11 VAL 31 HG11 VAL 31 -21.231 2.042 -2.466
547 HG12 VAL 31 HG12 VAL 31 -21.257 1.711 -4.198
548 HG13 VAL 31 HG13 VAL 31 -19.916 2.616 -3.492
549 HG21 VAL 31 HG21 VAL 31 -18.287 1.481 -2.033
550 HG22 VAL 31 HG22 VAL 31 -18.385 -0.259 -1.763
551 HG23 VAL 31 HG23 VAL 31 -19.555 0.820 -1.001
552 H GLY 32 H GLY 32 -20.398 -2.379 -4.708
553 HA2 GLY 32 HA3 GLY 32 -22.141 -1.316 -6.728
554 HA3 GLY 32 HA2 GLY 32 -21.216 -2.807 -6.822
555 H GLU 33 H GLU 33 -22.093 -4.377 -4.898
556 HA GLU 33 HA GLU 33 -24.967 -4.288 -4.681
557 HB2 GLU 33 HB3 GLU 33 -25.362 -6.522 -5.631
558 HB3 GLU 33 HB2 GLU 33 -24.799 -5.381 -6.836
559 HG2 GLU 33 HG3 GLU 33 -22.947 -7.314 -5.485
560 HG3 GLU 33 HG2 GLU 33 -23.878 -7.747 -6.915
Start of MODEL 11
1 H1 GLY 1 H1 GLY 1 21.167 1.613 4.245
2 H2 GLY 1 H2 GLY 1 22.008 2.578 3.142
3 H3 GLY 1 H3 GLY 1 22.516 0.994 3.437
4 HA2 GLY 1 HA2 GLY 1 21.363 1.138 1.327
5 HA3 GLY 1 HA3 GLY 1 20.507 0.111 2.468
6 H SER 2 H SER 2 20.599 3.322 1.022
7 HA SER 2 HA SER 2 17.713 3.449 1.096
8 HB2 SER 2 HB3 SER 2 18.519 4.345 3.330
9 HB3 SER 2 HB2 SER 2 19.292 5.653 2.438
10 HG SER 2 HG SER 2 16.598 5.166 2.934
11 H MET 3 H MET 3 20.473 5.692 0.741
12 HA MET 3 HA MET 3 21.056 7.139 -0.896
13 HB2 MET 3 HB3 MET 3 19.889 4.967 -2.649
14 HB3 MET 3 HB2 MET 3 20.850 6.312 -3.235
15 HG2 MET 3 HG3 MET 3 22.324 4.508 -3.127
16 HG3 MET 3 HG2 MET 3 22.692 5.488 -1.712
17 HE1 MET 3 HE1 MET 3 20.361 1.495 -1.583
18 HE2 MET 3 HE2 MET 3 21.060 2.180 -3.050
19 HE3 MET 3 HE3 MET 3 19.685 2.966 -2.278
20 H LYS 4 H LYS 4 19.963 8.008 -3.231
21 HA LYS 4 HA LYS 4 17.578 9.329 -2.292
22 HB2 LYS 4 HB3 LYS 4 19.039 9.502 -4.929
23 HB3 LYS 4 HB2 LYS 4 17.627 10.464 -4.524
24 HG2 LYS 4 HG3 LYS 4 20.274 10.519 -3.093
25 HG3 LYS 4 HG2 LYS 4 19.678 11.730 -4.224
26 HD2 LYS 4 HD3 LYS 4 18.437 11.014 -1.566
27 HD3 LYS 4 HD2 LYS 4 19.385 12.460 -1.909
28 HE2 LYS 4 HE3 LYS 4 17.683 13.090 -3.613
29 HE3 LYS 4 HE2 LYS 4 16.715 11.712 -3.096
30 HZ1 LYS 4 HZ1 LYS 4 16.607 12.676 -0.876
31 HZ2 LYS 4 HZ2 LYS 4 15.977 13.738 -2.026
32 HZ3 LYS 4 HZ3 LYS 4 17.518 14.005 -1.390
33 H GLN 5 H GLN 5 18.362 7.134 -4.974
34 HA GLN 5 HA GLN 5 15.745 7.113 -6.024
35 HB2 GLN 5 HB3 GLN 5 18.018 5.168 -6.397
36 HB3 GLN 5 HB2 GLN 5 16.521 5.131 -7.319
37 HG2 GLN 5 HG3 GLN 5 17.004 7.409 -8.129
38 HG3 GLN 5 HG2 GLN 5 18.544 7.358 -7.276
39 HE21 GLN 5 HE21 GLN 5 17.995 7.646 -10.119
40 HE22 GLN 5 HE22 GLN 5 18.816 6.343 -10.903
41 H LEU 6 H LEU 6 17.293 5.085 -3.570
42 HA LEU 6 HA LEU 6 15.131 3.162 -3.775
43 HB2 LEU 6 HB3 LEU 6 17.461 2.416 -3.440
44 HB3 LEU 6 HB2 LEU 6 17.494 3.236 -1.896
45 HG LEU 6 HG LEU 6 17.156 0.684 -1.943
46 HD11 LEU 6 HD11 LEU 6 15.393 2.531 -0.354
47 HD12 LEU 6 HD12 LEU 6 16.973 1.887 0.096
48 HD13 LEU 6 HD13 LEU 6 15.583 0.815 -0.012
49 HD21 LEU 6 HD21 LEU 6 15.398 0.681 -3.659
50 HD22 LEU 6 HD22 LEU 6 14.337 1.561 -2.561
51 HD23 LEU 6 HD23 LEU 6 14.859 -0.072 -2.160
52 H GLU 7 H GLU 7 16.228 5.733 -1.599
53 HA GLU 7 HA GLU 7 14.349 5.325 0.437
54 HB2 GLU 7 HB3 GLU 7 16.212 6.830 0.743
55 HB3 GLU 7 HB2 GLU 7 15.674 7.838 -0.593
56 HG2 GLU 7 HG3 GLU 7 15.130 8.935 1.441
57 HG3 GLU 7 HG2 GLU 7 13.647 8.362 0.685
58 H ASP 8 H ASP 8 14.202 7.111 -2.611
59 HA ASP 8 HA ASP 8 11.552 8.084 -2.222
60 HB2 ASP 8 HB3 ASP 8 13.369 7.868 -4.600
61 HB3 ASP 8 HB2 ASP 8 11.679 8.309 -4.818
62 H LYS 9 H LYS 9 12.908 5.124 -3.424
63 HA LYS 9 HA LYS 9 10.608 4.220 -4.826
64 HB2 LYS 9 HB3 LYS 9 12.872 3.342 -5.248
65 HB3 LYS 9 HB2 LYS 9 12.884 2.618 -3.647
66 HG2 LYS 9 HG3 LYS 9 11.000 1.189 -4.285
67 HG3 LYS 9 HG2 LYS 9 11.009 1.912 -5.894
68 HD2 LYS 9 HD3 LYS 9 13.295 0.384 -4.648
69 HD3 LYS 9 HD2 LYS 9 12.168 -0.256 -5.846
70 HE2 LYS 9 HE3 LYS 9 14.016 2.093 -6.267
71 HE3 LYS 9 HE2 LYS 9 14.307 0.453 -6.842
72 HZ1 LYS 9 HZ1 LYS 9 12.033 2.188 -7.640
73 HZ2 LYS 9 HZ2 LYS 9 12.302 0.611 -8.187
74 HZ3 LYS 9 HZ3 LYS 9 13.393 1.842 -8.583
75 H VAL 10 H VAL 10 11.936 3.374 -1.619
76 HA VAL 10 HA VAL 10 9.762 1.709 -0.911
77 HB VAL 10 HB VAL 10 11.938 1.551 0.216
78 HG11 VAL 10 HG11 VAL 10 12.596 3.169 1.925
79 HG12 VAL 10 HG12 VAL 10 11.226 4.189 1.484
80 HG13 VAL 10 HG13 VAL 10 12.524 3.906 0.325
81 HG21 VAL 10 HG21 VAL 10 11.116 1.319 2.519
82 HG22 VAL 10 HG22 VAL 10 9.993 0.643 1.338
83 HG23 VAL 10 HG23 VAL 10 9.660 2.210 2.076
84 H GLU 11 H GLU 11 10.390 5.147 -0.484
85 HA GLU 11 HA GLU 11 8.157 5.768 1.116
86 HB2 GLU 11 HB3 GLU 11 9.984 7.351 0.772
87 HB3 GLU 11 HB2 GLU 11 9.619 7.438 -0.944
88 HG2 GLU 11 HG3 GLU 11 8.785 9.404 0.113
89 HG3 GLU 11 HG2 GLU 11 7.414 8.414 -0.380
90 H GLU 12 H GLU 12 8.627 5.614 -2.377
91 HA GLU 12 HA GLU 12 6.156 6.546 -3.221
92 HB2 GLU 12 HB3 GLU 12 8.001 6.211 -4.754
93 HB3 GLU 12 HB2 GLU 12 7.949 4.475 -4.488
94 HG2 GLU 12 HG3 GLU 12 5.760 4.360 -5.530
95 HG3 GLU 12 HG2 GLU 12 5.760 6.108 -5.752
96 H LEU 13 H LEU 13 7.100 3.120 -2.679
97 HA LEU 13 HA LEU 13 4.483 2.262 -3.364
98 HB2 LEU 13 HB3 LEU 13 6.767 0.759 -2.125
99 HB3 LEU 13 HB2 LEU 13 5.241 0.019 -2.590
100 HG LEU 13 HG LEU 13 6.258 1.631 -4.736
101 HD11 LEU 13 HD11 LEU 13 8.454 1.144 -3.782
102 HD12 LEU 13 HD12 LEU 13 8.224 0.265 -5.293
103 HD13 LEU 13 HD13 LEU 13 8.074 -0.579 -3.751
104 HD21 LEU 13 HD21 LEU 13 5.860 -1.353 -4.582
105 HD22 LEU 13 HD22 LEU 13 5.856 -0.343 -6.025
106 HD23 LEU 13 HD23 LEU 13 4.559 -0.194 -4.840
107 H LEU 14 H LEU 14 5.811 3.177 -0.244
108 HA LEU 14 HA LEU 14 3.423 2.082 0.977
109 HB2 LEU 14 HB3 LEU 14 4.195 2.927 3.090
110 HB3 LEU 14 HB2 LEU 14 5.453 2.020 2.292
111 HG LEU 14 HG LEU 14 6.390 4.325 1.592
112 HD11 LEU 14 HD11 LEU 14 4.408 5.635 2.260
113 HD12 LEU 14 HD12 LEU 14 5.866 6.149 3.107
114 HD13 LEU 14 HD13 LEU 14 4.673 5.149 3.934
115 HD21 LEU 14 HD21 LEU 14 7.520 2.874 3.120
116 HD22 LEU 14 HD22 LEU 14 6.394 3.278 4.416
117 HD23 LEU 14 HD23 LEU 14 7.522 4.497 3.812
118 H SER 15 H SER 15 4.422 4.992 -0.505
119 HA SER 15 HA SER 15 2.236 6.580 0.373
120 HB2 SER 15 HB3 SER 15 4.245 7.562 -0.708
121 HB3 SER 15 HB2 SER 15 3.813 6.754 -2.213
122 HG SER 15 HG SER 15 2.686 8.987 -0.993
123 H LYS 16 H LYS 16 2.813 4.347 -2.373
124 HA LYS 16 HA LYS 16 0.300 4.431 -3.559
125 HB2 LYS 16 HB3 LYS 16 2.204 2.147 -3.060
126 HB3 LYS 16 HB2 LYS 16 0.681 1.898 -3.901
127 HG2 LYS 16 HG3 LYS 16 1.336 3.331 -5.681
128 HG3 LYS 16 HG2 LYS 16 2.746 3.896 -4.787
129 HD2 LYS 16 HD3 LYS 16 3.285 2.246 -6.569
130 HD3 LYS 16 HD2 LYS 16 3.797 1.742 -4.964
131 HE2 LYS 16 HE3 LYS 16 2.845 -0.154 -6.060
132 HE3 LYS 16 HE2 LYS 16 1.721 0.373 -4.805
133 HZ1 LYS 16 HZ1 LYS 16 0.374 1.455 -6.463
134 HZ2 LYS 16 HZ2 LYS 16 0.607 -0.161 -6.907
135 HZ3 LYS 16 HZ3 LYS 16 1.477 1.062 -7.682
136 H ASN 17 H ASN 17 1.346 2.358 -0.881
137 HA ASN 17 HA ASN 17 -1.107 1.283 -0.146
138 HB2 ASN 17 HB3 ASN 17 0.805 0.297 0.779
139 HB3 ASN 17 HB2 ASN 17 1.459 1.837 1.312
140 HD21 ASN 17 HD21 ASN 17 0.885 2.653 3.268
141 HD22 ASN 17 HD22 ASN 17 -0.018 1.760 4.438
142 H TYR 18 H TYR 18 0.394 4.316 0.863
143 HA TYR 18 HA TYR 18 -1.409 4.995 2.901
144 HB2 TYR 18 HB3 TYR 18 0.759 6.088 2.666
145 HB3 TYR 18 HB2 TYR 18 0.271 6.777 1.123
146 HD1 TYR 18 HD1 TYR 18 -0.266 6.908 4.769
147 HD2 TYR 18 HD2 TYR 18 -1.058 8.758 1.022
148 HE1 TYR 18 HE1 TYR 18 -1.112 8.899 5.938
149 HE2 TYR 18 HE2 TYR 18 -1.906 10.750 2.180
150 HH TYR 18 HH TYR 18 -1.419 11.308 5.483
151 H HIS 19 H HIS 19 -1.297 6.051 -0.497
152 HA HIS 19 HA HIS 19 -3.734 7.525 -0.312
153 HB2 HIS 19 HB3 HIS 19 -2.065 6.604 -2.647
154 HB3 HIS 19 HB2 HIS 19 -3.581 7.470 -2.868
155 HD1 HIS 19 HD1 HIS 19 -3.522 9.975 -2.633
156 HD2 HIS 19 HD2 HIS 19 -0.012 8.154 -1.353
157 HE1 HIS 19 HE1 HIS 19 -1.903 11.852 -2.208
158 HE2 HIS 19 HE2 HIS 19 0.156 10.730 -1.283
159 H LEU 20 H LEU 20 -2.900 4.249 -1.213
160 HA LEU 20 HA LEU 20 -5.354 3.530 -2.373
161 HB2 LEU 20 HB3 LEU 20 -3.204 2.293 -2.548
162 HB3 LEU 20 HB2 LEU 20 -3.381 1.814 -0.873
163 HG LEU 20 HG LEU 20 -5.443 0.621 -1.460
164 HD11 LEU 20 HD11 LEU 20 -5.909 0.177 -3.846
165 HD12 LEU 20 HD12 LEU 20 -4.686 1.372 -4.278
166 HD13 LEU 20 HD13 LEU 20 -6.136 1.871 -3.409
167 HD21 LEU 20 HD21 LEU 20 -3.355 -0.574 -1.337
168 HD22 LEU 20 HD22 LEU 20 -2.966 -0.122 -2.996
169 HD23 LEU 20 HD23 LEU 20 -4.311 -1.209 -2.672
170 H GLU 21 H GLU 21 -4.144 3.549 0.945
171 HA GLU 21 HA GLU 21 -6.366 2.301 2.165
172 HB2 GLU 21 HB3 GLU 21 -4.150 2.757 3.253
173 HB3 GLU 21 HB2 GLU 21 -4.606 4.450 3.358
174 HG2 GLU 21 HG3 GLU 21 -6.510 3.847 4.768
175 HG3 GLU 21 HG2 GLU 21 -6.042 2.150 4.667
176 H ASN 22 H ASN 22 -5.810 5.569 1.062
177 HA ASN 22 HA ASN 22 -8.036 6.792 2.296
178 HB2 ASN 22 HB3 ASN 22 -6.599 7.470 -0.278
179 HB3 ASN 22 HB2 ASN 22 -7.829 8.489 0.460
180 HD21 ASN 22 HD21 ASN 22 -6.999 7.973 3.173
181 HD22 ASN 22 HD22 ASN 22 -5.519 8.836 3.402
182 H GLU 23 H GLU 23 -7.656 4.802 -0.522
183 HA GLU 23 HA GLU 23 -10.299 5.313 -1.544
184 HB2 GLU 23 HB3 GLU 23 -8.067 3.459 -2.290
185 HB3 GLU 23 HB2 GLU 23 -9.706 3.118 -2.880
186 HG2 GLU 23 HG3 GLU 23 -8.544 4.335 -4.560
187 HG3 GLU 23 HG2 GLU 23 -9.757 5.401 -3.858
188 H VAL 24 H VAL 24 -8.739 2.894 0.479
189 HA VAL 24 HA VAL 24 -10.906 1.108 0.675
190 HB VAL 24 HB VAL 24 -8.924 1.726 2.879
191 HG11 VAL 24 HG11 VAL 24 -10.862 0.397 3.584
192 HG12 VAL 24 HG12 VAL 24 -9.375 -0.550 3.626
193 HG13 VAL 24 HG13 VAL 24 -10.525 -0.774 2.306
194 HG21 VAL 24 HG21 VAL 24 -8.680 -0.317 0.678
195 HG22 VAL 24 HG22 VAL 24 -7.541 -0.057 1.998
196 HG23 VAL 24 HG23 VAL 24 -7.771 1.189 0.773
197 H ALA 25 H ALA 25 -10.037 4.021 2.455
198 HA ALA 25 HA ALA 25 -12.087 3.848 4.397
199 HB1 ALA 25 HB1 ALA 25 -10.056 5.241 4.629
200 HB2 ALA 25 HB2 ALA 25 -11.551 6.122 4.949
201 HB3 ALA 25 HB3 ALA 25 -10.712 6.339 3.415
202 H ARG 26 H ARG 26 -11.944 5.329 1.199
203 HA ARG 26 HA ARG 26 -14.330 6.822 1.440
204 HB2 ARG 26 HB3 ARG 26 -14.047 7.403 -0.776
205 HB3 ARG 26 HB2 ARG 26 -12.418 6.934 -0.337
206 HG2 ARG 26 HG3 ARG 26 -12.601 4.854 -1.473
207 HG3 ARG 26 HG2 ARG 26 -14.340 5.083 -1.707
208 HD2 ARG 26 HD2 ARG 26 -12.951 5.535 -3.730
209 HD3 ARG 26 HD1 ARG 26 -13.991 6.865 -3.233
210 HE ARG 26 HE ARG 26 -11.502 7.285 -2.059
211 HH11 ARG 26 HH11 ARG 26 -12.881 7.098 -5.265
212 HH12 ARG 26 HH12 ARG 26 -11.764 8.226 -5.961
213 HH21 ARG 26 HH21 ARG 26 -10.016 8.781 -2.973
214 HH22 ARG 26 HH22 ARG 26 -10.134 9.181 -4.657
215 H LEU 27 H LEU 27 -13.643 3.592 0.236
216 HA LEU 27 HA LEU 27 -16.354 3.021 -0.466
217 HB2 LEU 27 HB3 LEU 27 -14.067 1.144 0.097
218 HB3 LEU 27 HB2 LEU 27 -15.608 0.701 -0.603
219 HG LEU 27 HG LEU 27 -13.905 2.747 -1.930
220 HD11 LEU 27 HD11 LEU 27 -12.886 1.008 -3.257
221 HD12 LEU 27 HD12 LEU 27 -13.741 -0.223 -2.329
222 HD13 LEU 27 HD13 LEU 27 -12.514 0.775 -1.548
223 HD21 LEU 27 HD21 LEU 27 -16.171 2.565 -2.714
224 HD22 LEU 27 HD22 LEU 27 -16.019 0.812 -2.837
225 HD23 LEU 27 HD23 LEU 27 -15.094 1.856 -3.919
226 H LYS 28 H LYS 28 -14.361 2.300 2.359
227 HA LYS 28 HA LYS 28 -16.075 0.744 3.832
228 HB2 LYS 28 HB3 LYS 28 -13.775 1.304 4.488
229 HB3 LYS 28 HB2 LYS 28 -14.281 2.945 4.856
230 HG2 LYS 28 HG3 LYS 28 -15.646 2.182 6.672
231 HG3 LYS 28 HG2 LYS 28 -15.350 0.496 6.240
232 HD2 LYS 28 HD3 LYS 28 -13.958 1.137 8.125
233 HD3 LYS 28 HD2 LYS 28 -12.962 0.812 6.706
234 HE2 LYS 28 HE3 LYS 28 -12.817 3.223 6.270
235 HE3 LYS 28 HE2 LYS 28 -13.790 3.535 7.705
236 HZ1 LYS 28 HZ1 LYS 28 -11.108 2.261 7.648
237 HZ2 LYS 28 HZ2 LYS 28 -12.047 2.479 9.035
238 HZ3 LYS 28 HZ3 LYS 28 -11.465 3.823 8.194
239 H LYS 29 H LYS 29 -16.100 4.300 3.581
240 HA LYS 29 HA LYS 29 -18.278 4.543 5.419
241 HB2 LYS 29 HB3 LYS 29 -18.189 6.882 4.967
242 HB3 LYS 29 HB2 LYS 29 -16.542 6.300 5.085
243 HG2 LYS 29 HG3 LYS 29 -16.426 6.259 2.617
244 HG3 LYS 29 HG2 LYS 29 -18.042 6.965 2.564
245 HD2 LYS 29 HD3 LYS 29 -17.147 8.864 3.943
246 HD3 LYS 29 HD2 LYS 29 -15.535 8.186 3.709
247 HE2 LYS 29 HE3 LYS 29 -15.853 9.899 2.077
248 HE3 LYS 29 HE2 LYS 29 -15.906 8.344 1.248
249 HZ1 LYS 29 HZ1 LYS 29 -17.654 9.741 0.434
250 HZ2 LYS 29 HZ2 LYS 29 -18.229 10.034 1.996
251 HZ3 LYS 29 HZ3 LYS 29 -18.355 8.488 1.328
252 H LEU 30 H LEU 30 -17.979 4.054 1.999
253 HA LEU 30 HA LEU 30 -20.633 4.886 1.335
254 HB2 LEU 30 HB3 LEU 30 -18.405 3.565 -0.066
255 HB3 LEU 30 HB2 LEU 30 -20.000 3.135 -0.642
256 HG LEU 30 HG LEU 30 -18.901 4.998 -1.898
257 HD11 LEU 30 HD11 LEU 30 -21.480 5.716 -0.510
258 HD12 LEU 30 HD12 LEU 30 -21.327 4.677 -1.926
259 HD13 LEU 30 HD13 LEU 30 -20.890 6.381 -2.032
260 HD21 LEU 30 HD21 LEU 30 -17.805 6.114 -0.033
261 HD22 LEU 30 HD22 LEU 30 -19.374 6.531 0.652
262 HD23 LEU 30 HD23 LEU 30 -18.876 7.222 -0.889
263 H VAL 31 H VAL 31 -19.136 1.814 2.213
264 HA VAL 31 HA VAL 31 -21.579 0.329 1.858
265 HB VAL 31 HB VAL 31 -19.160 -0.535 3.457
266 HG11 VAL 31 HG11 VAL 31 -19.905 -2.790 2.906
267 HG12 VAL 31 HG12 VAL 31 -21.276 -2.130 2.016
268 HG13 VAL 31 HG13 VAL 31 -21.166 -1.901 3.761
269 HG21 VAL 31 HG21 VAL 31 -19.661 -0.891 0.505
270 HG22 VAL 31 HG22 VAL 31 -18.327 -1.594 1.419
271 HG23 VAL 31 HG23 VAL 31 -18.440 0.155 1.228
272 H GLY 32 H GLY 32 -20.093 2.179 4.374
273 HA2 GLY 32 HA3 GLY 32 -21.700 1.019 6.491
274 HA3 GLY 32 HA2 GLY 32 -20.549 2.338 6.653
275 H GLU 33 H GLU 33 -21.416 4.218 4.962
276 HA GLU 33 HA GLU 33 -22.815 5.986 4.809
277 HB2 GLU 33 HB3 GLU 33 -24.942 3.864 5.126
278 HB3 GLU 33 HB2 GLU 33 -25.254 5.530 4.661
279 HG2 GLU 33 HG3 GLU 33 -23.554 3.588 3.113
280 HG3 GLU 33 HG2 GLU 33 -25.232 3.990 2.750
281 H1 GLY 1 H1 GLY 1 21.168 -1.792 -4.906
282 H2 GLY 1 H2 GLY 1 22.004 -2.764 -3.806
283 H3 GLY 1 H3 GLY 1 22.524 -1.182 -4.098
284 HA2 GLY 1 HA2 GLY 1 21.371 -1.320 -1.987
285 HA3 GLY 1 HA3 GLY 1 20.520 -0.288 -3.128
286 H SER 2 H SER 2 20.600 -3.508 -1.701
287 HA SER 2 HA SER 2 17.712 -3.624 -1.763
288 HB2 SER 2 HB3 SER 2 18.499 -4.509 -4.003
289 HB3 SER 2 HB2 SER 2 19.296 -5.813 -3.127
290 HG SER 2 HG SER 2 16.591 -5.352 -3.591
291 H MET 3 H MET 3 20.467 -5.874 -1.431
292 HA MET 3 HA MET 3 21.055 -7.333 0.199
293 HB2 MET 3 HB3 MET 3 19.898 -5.163 1.962
294 HB3 MET 3 HB2 MET 3 20.857 -6.512 2.543
295 HG2 MET 3 HG3 MET 3 22.334 -4.711 2.433
296 HG3 MET 3 HG2 MET 3 22.698 -5.685 1.015
297 HE1 MET 3 HE1 MET 3 20.378 -1.686 0.913
298 HE2 MET 3 HE2 MET 3 21.085 -2.381 2.372
299 HE3 MET 3 HE3 MET 3 19.702 -3.160 1.606
300 H LYS 4 H LYS 4 19.971 -8.210 2.530
301 HA LYS 4 HA LYS 4 17.578 -9.521 1.604
302 HB2 LYS 4 HB3 LYS 4 19.057 -9.704 4.230
303 HB3 LYS 4 HB2 LYS 4 17.643 -10.667 3.830
304 HG2 LYS 4 HG3 LYS 4 20.284 -10.711 2.383
305 HG3 LYS 4 HG2 LYS 4 19.691 -11.931 3.509
306 HD2 LYS 4 HD3 LYS 4 18.433 -11.196 0.862
307 HD3 LYS 4 HD2 LYS 4 19.384 -12.643 1.191
308 HE2 LYS 4 HE3 LYS 4 17.695 -13.291 2.901
309 HE3 LYS 4 HE2 LYS 4 16.724 -11.906 2.405
310 HZ1 LYS 4 HZ1 LYS 4 16.590 -12.850 0.180
311 HZ2 LYS 4 HZ2 LYS 4 15.976 -13.928 1.329
312 HZ3 LYS 4 HZ3 LYS 4 17.510 -14.182 0.669
313 H GLN 5 H GLN 5 18.383 -7.342 4.302
314 HA GLN 5 HA GLN 5 15.769 -7.317 5.353
315 HB2 GLN 5 HB3 GLN 5 18.042 -5.376 5.729
316 HB3 GLN 5 HB2 GLN 5 16.550 -5.344 6.657
317 HG2 GLN 5 HG3 GLN 5 17.035 -7.622 7.460
318 HG3 GLN 5 HG2 GLN 5 18.569 -7.575 6.593
319 HE21 GLN 5 HE21 GLN 5 18.052 -7.869 9.438
320 HE22 GLN 5 HE22 GLN 5 18.885 -6.567 10.215
321 H LEU 6 H LEU 6 17.312 -5.283 2.899
322 HA LEU 6 HA LEU 6 15.154 -3.355 3.121
323 HB2 LEU 6 HB3 LEU 6 17.484 -2.613 2.782
324 HB3 LEU 6 HB2 LEU 6 17.510 -3.425 1.233
325 HG LEU 6 HG LEU 6 17.176 -0.872 1.291
326 HD11 LEU 6 HD11 LEU 6 15.401 -2.712 -0.295
327 HD12 LEU 6 HD12 LEU 6 16.978 -2.068 -0.753
328 HD13 LEU 6 HD13 LEU 6 15.589 -0.995 -0.632
329 HD21 LEU 6 HD21 LEU 6 15.430 -0.871 3.016
330 HD22 LEU 6 HD22 LEU 6 14.361 -1.749 1.923
331 HD23 LEU 6 HD23 LEU 6 14.880 -0.114 1.523
332 H GLU 7 H GLU 7 16.241 -5.917 0.928
333 HA GLU 7 HA GLU 7 14.352 -5.498 -1.096
334 HB2 GLU 7 HB3 GLU 7 16.211 -7.005 -1.414
335 HB3 GLU 7 HB2 GLU 7 15.674 -8.021 -0.084
336 HG2 GLU 7 HG3 GLU 7 15.117 -9.103 -2.119
337 HG3 GLU 7 HG2 GLU 7 13.637 -8.521 -1.362
338 H ASP 8 H ASP 8 14.216 -7.289 1.947
339 HA ASP 8 HA ASP 8 11.564 -8.260 1.560
340 HB2 ASP 8 HB3 ASP 8 13.392 -8.062 3.932
341 HB3 ASP 8 HB2 ASP 8 11.701 -8.498 4.153
342 H LYS 9 H LYS 9 12.922 -5.305 2.751
343 HA LYS 9 HA LYS 9 10.632 -4.413 4.190
344 HB2 LYS 9 HB3 LYS 9 12.901 -3.543 4.606
345 HB3 LYS 9 HB2 LYS 9 12.908 -2.811 3.009
346 HG2 LYS 9 HG3 LYS 9 11.035 -1.377 3.661
347 HG3 LYS 9 HG2 LYS 9 11.043 -2.104 5.267
348 HD2 LYS 9 HD3 LYS 9 13.329 -0.576 4.020
349 HD3 LYS 9 HD2 LYS 9 12.208 0.059 5.225
350 HE2 LYS 9 HE3 LYS 9 14.062 -2.288 5.626
351 HE3 LYS 9 HE2 LYS 9 14.349 -0.654 6.212
352 HZ1 LYS 9 HZ1 LYS 9 12.088 -2.406 7.007
353 HZ2 LYS 9 HZ2 LYS 9 12.348 -0.833 7.563
354 HZ3 LYS 9 HZ3 LYS 9 13.447 -2.057 7.950
355 H VAL 10 H VAL 10 11.949 -3.549 0.980
356 HA VAL 10 HA VAL 10 9.775 -1.879 0.287
357 HB VAL 10 HB VAL 10 11.946 -1.719 -0.846
358 HG11 VAL 10 HG11 VAL 10 12.597 -3.330 -2.567
359 HG12 VAL 10 HG12 VAL 10 11.228 -4.352 -2.127
360 HG13 VAL 10 HG13 VAL 10 12.531 -4.073 -0.969
361 HG21 VAL 10 HG21 VAL 10 11.116 -1.475 -3.146
362 HG22 VAL 10 HG22 VAL 10 10.000 -0.802 -1.956
363 HG23 VAL 10 HG23 VAL 10 9.659 -2.364 -2.700
364 H GLU 11 H GLU 11 10.397 -5.314 -0.164
365 HA GLU 11 HA GLU 11 8.153 -5.923 -1.753
366 HB2 GLU 11 HB3 GLU 11 9.977 -7.514 -1.431
367 HB3 GLU 11 HB2 GLU 11 9.626 -7.605 0.287
368 HG2 GLU 11 HG3 GLU 11 8.781 -9.567 -0.777
369 HG3 GLU 11 HG2 GLU 11 7.416 -8.578 -0.261
370 H GLU 12 H GLU 12 8.639 -5.785 1.740
371 HA GLU 12 HA GLU 12 6.169 -6.722 2.589
372 HB2 GLU 12 HB3 GLU 12 8.022 -6.396 4.120
373 HB3 GLU 12 HB2 GLU 12 7.967 -4.659 3.864
374 HG2 GLU 12 HG3 GLU 12 5.776 -4.554 4.906
375 HG3 GLU 12 HG2 GLU 12 5.782 -6.302 5.124
376 H LEU 13 H LEU 13 7.117 -3.291 2.064
377 HA LEU 13 HA LEU 13 4.504 -2.432 2.757
378 HB2 LEU 13 HB3 LEU 13 6.789 -0.931 1.519
379 HB3 LEU 13 HB2 LEU 13 5.266 -0.188 1.989
380 HG LEU 13 HG LEU 13 6.283 -1.810 4.127
381 HD11 LEU 13 HD11 LEU 13 8.476 -1.328 3.167
382 HD12 LEU 13 HD12 LEU 13 8.256 -0.454 4.682
383 HD13 LEU 13 HD13 LEU 13 8.101 0.395 3.144
384 HD21 LEU 13 HD21 LEU 13 5.896 1.176 3.985
385 HD22 LEU 13 HD22 LEU 13 5.896 0.161 5.425
386 HD23 LEU 13 HD23 LEU 13 4.590 0.021 4.247
387 H LEU 14 H LEU 14 5.820 -3.337 -0.369
388 HA LEU 14 HA LEU 14 3.430 -2.233 -1.578
389 HB2 LEU 14 HB3 LEU 14 4.194 -3.068 -3.696
390 HB3 LEU 14 HB2 LEU 14 5.458 -2.169 -2.897
391 HG LEU 14 HG LEU 14 6.390 -4.480 -2.213
392 HD11 LEU 14 HD11 LEU 14 4.403 -5.781 -2.879
393 HD12 LEU 14 HD12 LEU 14 5.857 -6.294 -3.733
394 HD13 LEU 14 HD13 LEU 14 4.662 -5.288 -4.553
395 HD21 LEU 14 HD21 LEU 14 7.517 -3.026 -3.740
396 HD22 LEU 14 HD22 LEU 14 6.385 -3.422 -5.033
397 HD23 LEU 14 HD23 LEU 14 7.513 -4.646 -4.438
398 H SER 15 H SER 15 4.432 -5.147 -0.111
399 HA SER 15 HA SER 15 2.243 -6.727 -0.987
400 HB2 SER 15 HB3 SER 15 4.249 -7.724 0.085
401 HB3 SER 15 HB2 SER 15 3.824 -6.918 1.594
402 HG SER 15 HG SER 15 2.675 -9.132 0.360
403 H LYS 16 H LYS 16 2.830 -4.513 1.767
404 HA LYS 16 HA LYS 16 0.325 -4.593 2.961
405 HB2 LYS 16 HB3 LYS 16 2.227 -2.309 2.464
406 HB3 LYS 16 HB2 LYS 16 0.708 -2.065 3.315
407 HG2 LYS 16 HG3 LYS 16 1.368 -3.505 5.080
408 HG3 LYS 16 HG2 LYS 16 2.772 -4.072 4.177
409 HD2 LYS 16 HD3 LYS 16 3.327 -2.432 5.962
410 HD3 LYS 16 HD2 LYS 16 3.828 -1.921 4.358
411 HE2 LYS 16 HE3 LYS 16 2.889 -0.029 5.467
412 HE3 LYS 16 HE2 LYS 16 1.754 -0.548 4.220
413 HZ1 LYS 16 HZ1 LYS 16 0.415 -1.628 5.887
414 HZ2 LYS 16 HZ2 LYS 16 0.655 -0.015 6.325
415 HZ3 LYS 16 HZ3 LYS 16 1.526 -1.237 7.098
416 H ASN 17 H ASN 17 1.358 -2.508 0.291
417 HA ASN 17 HA ASN 17 -1.098 -1.431 -0.431
418 HB2 ASN 17 HB3 ASN 17 0.808 -0.441 -1.362
419 HB3 ASN 17 HB2 ASN 17 1.464 -1.980 -1.896
420 HD21 ASN 17 HD21 ASN 17 0.893 -2.795 -3.850
421 HD22 ASN 17 HD22 ASN 17 -0.030 -1.913 -5.012
422 H TYR 18 H TYR 18 0.395 -4.464 -1.458
423 HA TYR 18 HA TYR 18 -1.415 -5.130 -3.493
424 HB2 TYR 18 HB3 TYR 18 0.755 -6.228 -3.267
425 HB3 TYR 18 HB2 TYR 18 0.265 -6.925 -1.728
426 HD1 TYR 18 HD1 TYR 18 -0.274 -7.039 -5.377
427 HD2 TYR 18 HD2 TYR 18 -1.069 -8.900 -1.636
428 HE1 TYR 18 HE1 TYR 18 -1.134 -9.022 -6.552
429 HE2 TYR 18 HE2 TYR 18 -1.929 -10.887 -2.799
430 HH TYR 18 HH TYR 18 -1.460 -11.437 -6.104
431 H HIS 19 H HIS 19 -1.290 -6.201 -0.096
432 HA HIS 19 HA HIS 19 -3.732 -7.668 -0.282
433 HB2 HIS 19 HB3 HIS 19 -2.053 -6.765 2.049
434 HB3 HIS 19 HB2 HIS 19 -3.569 -7.626 2.273
435 HD1 HIS 19 HD1 HIS 19 -3.518 -10.142 2.019
436 HD2 HIS 19 HD2 HIS 19 -0.011 -8.313 0.732
437 HE1 HIS 19 HE1 HIS 19 -1.901 -12.012 1.581
438 HE2 HIS 19 HE2 HIS 19 0.176 -10.890 0.700
439 H LEU 20 H LEU 20 -2.893 -4.397 0.622
440 HA LEU 20 HA LEU 20 -5.339 -3.680 1.801
441 HB2 LEU 20 HB3 LEU 20 -3.184 -2.447 1.970
442 HB3 LEU 20 HB2 LEU 20 -3.372 -1.960 0.300
443 HG LEU 20 HG LEU 20 -5.427 -0.766 0.904
444 HD11 LEU 20 HD11 LEU 20 -5.883 -0.337 3.296
445 HD12 LEU 20 HD12 LEU 20 -4.662 -1.538 3.716
446 HD13 LEU 20 HD13 LEU 20 -6.117 -2.025 2.847
447 HD21 LEU 20 HD21 LEU 20 -3.338 0.430 0.782
448 HD22 LEU 20 HD22 LEU 20 -2.944 -0.030 2.437
449 HD23 LEU 20 HD23 LEU 20 -4.291 1.058 2.123
450 H GLU 21 H GLU 21 -4.144 -3.684 -1.520
451 HA GLU 21 HA GLU 21 -6.370 -2.431 -2.724
452 HB2 GLU 21 HB3 GLU 21 -4.160 -2.883 -3.827
453 HB3 GLU 21 HB2 GLU 21 -4.619 -4.575 -3.937
454 HG2 GLU 21 HG3 GLU 21 -6.530 -3.965 -5.331
455 HG3 GLU 21 HG2 GLU 21 -6.062 -2.269 -5.225
456 H ASN 22 H ASN 22 -5.814 -5.702 -1.636
457 HA ASN 22 HA ASN 22 -8.050 -6.915 -2.867
458 HB2 ASN 22 HB3 ASN 22 -6.602 -7.613 -0.306
459 HB3 ASN 22 HB2 ASN 22 -7.833 -8.625 -1.050
460 HD21 ASN 22 HD21 ASN 22 -7.008 -8.079 -3.762
461 HD22 ASN 22 HD22 ASN 22 -5.523 -8.927 -4.002
462 H GLU 23 H GLU 23 -7.649 -4.934 -0.047
463 HA GLU 23 HA GLU 23 -10.288 -5.452 0.988
464 HB2 GLU 23 HB3 GLU 23 -8.050 -3.606 1.737
465 HB3 GLU 23 HB2 GLU 23 -9.688 -3.262 2.334
466 HG2 GLU 23 HG3 GLU 23 -8.525 -4.491 4.006
467 HG3 GLU 23 HG2 GLU 23 -9.740 -5.552 3.302
468 H VAL 24 H VAL 24 -8.732 -3.027 -1.035
469 HA VAL 24 HA VAL 24 -10.900 -1.236 -1.212
470 HB VAL 24 HB VAL 24 -8.925 -1.847 -3.425
471 HG11 VAL 24 HG11 VAL 24 -10.863 -0.515 -4.117
472 HG12 VAL 24 HG12 VAL 24 -9.377 0.431 -4.162
473 HG13 VAL 24 HG13 VAL 24 -10.522 0.650 -2.836
474 HG21 VAL 24 HG21 VAL 24 -8.672 0.187 -1.217
475 HG22 VAL 24 HG22 VAL 24 -7.540 -0.067 -2.543
476 HG23 VAL 24 HG23 VAL 24 -7.762 -1.320 -1.323
477 H ALA 25 H ALA 25 -10.038 -4.136 -3.018
478 HA ALA 25 HA ALA 25 -12.096 -3.957 -4.946
479 HB1 ALA 25 HB1 ALA 25 -10.070 -5.356 -5.192
480 HB2 ALA 25 HB2 ALA 25 -11.567 -6.233 -5.509
481 HB3 ALA 25 HB3 ALA 25 -10.723 -6.455 -3.977
482 H ARG 26 H ARG 26 -11.943 -5.451 -1.753
483 HA ARG 26 HA ARG 26 -14.334 -6.935 -1.988
484 HB2 ARG 26 HB3 ARG 26 -14.043 -7.527 0.221
485 HB3 ARG 26 HB2 ARG 26 -12.415 -7.059 -0.221
486 HG2 ARG 26 HG3 ARG 26 -12.589 -4.986 0.927
487 HG3 ARG 26 HG2 ARG 26 -14.326 -5.213 1.167
488 HD2 ARG 26 HD2 ARG 26 -12.930 -5.678 3.180
489 HD3 ARG 26 HD1 ARG 26 -13.977 -7.002 2.679
490 HE ARG 26 HE ARG 26 -11.495 -7.426 1.496
491 HH11 ARG 26 HH11 ARG 26 -12.880 -7.255 4.695
492 HH12 ARG 26 HH12 ARG 26 -11.754 -8.375 5.391
493 HH21 ARG 26 HH21 ARG 26 -10.011 -8.929 2.399
494 HH22 ARG 26 HH22 ARG 26 -10.117 -9.324 4.084
495 H LEU 27 H LEU 27 -13.634 -3.712 -0.782
496 HA LEU 27 HA LEU 27 -16.342 -3.147 -0.057
497 HB2 LEU 27 HB3 LEU 27 -14.060 -1.266 -0.618
498 HB3 LEU 27 HB2 LEU 27 -15.597 -0.827 0.088
499 HG LEU 27 HG LEU 27 -13.892 -2.878 1.401
500 HD11 LEU 27 HD11 LEU 27 -12.861 -1.146 2.731
501 HD12 LEU 27 HD12 LEU 27 -13.716 0.091 1.809
502 HD13 LEU 27 HD13 LEU 27 -12.496 -0.912 1.020
503 HD21 LEU 27 HD21 LEU 27 -16.155 -2.694 2.194
504 HD22 LEU 27 HD22 LEU 27 -15.998 -0.943 2.331
505 HD23 LEU 27 HD23 LEU 27 -15.071 -1.998 3.401
506 H LYS 28 H LYS 28 -14.363 -2.410 -2.888
507 HA LYS 28 HA LYS 28 -16.083 -0.848 -4.345
508 HB2 LYS 28 HB3 LYS 28 -13.785 -1.408 -5.009
509 HB3 LYS 28 HB2 LYS 28 -14.295 -3.046 -5.390
510 HG2 LYS 28 HG3 LYS 28 -15.666 -2.262 -7.194
511 HG3 LYS 28 HG2 LYS 28 -15.359 -0.581 -6.747
512 HD2 LYS 28 HD3 LYS 28 -13.979 -1.215 -8.642
513 HD3 LYS 28 HD2 LYS 28 -12.972 -0.901 -7.228
514 HE2 LYS 28 HE3 LYS 28 -12.838 -3.317 -6.808
515 HE3 LYS 28 HE2 LYS 28 -13.820 -3.614 -8.240
516 HZ1 LYS 28 HZ1 LYS 28 -11.131 -2.363 -8.183
517 HZ2 LYS 28 HZ2 LYS 28 -12.079 -2.549 -9.570
518 HZ3 LYS 28 HZ3 LYS 28 -11.505 -3.910 -8.750
519 H LYS 29 H LYS 29 -16.107 -4.404 -4.113
520 HA LYS 29 HA LYS 29 -18.295 -4.635 -5.942
521 HB2 LYS 29 HB3 LYS 29 -18.209 -6.978 -5.497
522 HB3 LYS 29 HB2 LYS 29 -16.563 -6.397 -5.627
523 HG2 LYS 29 HG3 LYS 29 -16.428 -6.360 -3.158
524 HG3 LYS 29 HG2 LYS 29 -18.045 -7.063 -3.095
525 HD2 LYS 29 HD3 LYS 29 -17.162 -8.959 -4.488
526 HD3 LYS 29 HD2 LYS 29 -15.549 -8.287 -4.251
527 HE2 LYS 29 HE3 LYS 29 -15.874 -10.013 -2.632
528 HE3 LYS 29 HE2 LYS 29 -15.914 -8.463 -1.793
529 HZ1 LYS 29 HZ1 LYS 29 -17.670 -9.849 -0.980
530 HZ2 LYS 29 HZ2 LYS 29 -18.247 -10.141 -2.539
531 HZ3 LYS 29 HZ3 LYS 29 -18.369 -8.594 -1.874
532 H LEU 30 H LEU 30 -17.980 -4.165 -2.519
533 HA LEU 30 HA LEU 30 -20.634 -4.993 -1.845
534 HB2 LEU 30 HB3 LEU 30 -18.394 -3.685 -0.454
535 HB3 LEU 30 HB2 LEU 30 -19.985 -3.251 0.132
536 HG LEU 30 HG LEU 30 -18.882 -5.124 1.374
537 HD11 LEU 30 HD11 LEU 30 -21.469 -5.829 -0.000
538 HD12 LEU 30 HD12 LEU 30 -21.305 -4.794 1.416
539 HD13 LEU 30 HD13 LEU 30 -20.872 -6.500 1.516
540 HD21 LEU 30 HD21 LEU 30 -17.803 -6.237 -0.502
541 HD22 LEU 30 HD22 LEU 30 -19.378 -6.642 -1.181
542 HD23 LEU 30 HD23 LEU 30 -18.874 -7.344 0.355
543 H VAL 31 H VAL 31 -19.133 -1.920 -2.716
544 HA VAL 31 HA VAL 31 -21.573 -0.433 -2.347
545 HB VAL 31 HB VAL 31 -19.160 0.437 -3.951
546 HG11 VAL 31 HG11 VAL 31 -19.903 2.689 -3.387
547 HG12 VAL 31 HG12 VAL 31 -21.269 2.024 -2.493
548 HG13 VAL 31 HG13 VAL 31 -21.167 1.804 -4.240
549 HG21 VAL 31 HG21 VAL 31 -19.650 0.782 -0.997
550 HG22 VAL 31 HG22 VAL 31 -18.319 1.485 -1.914
551 HG23 VAL 31 HG23 VAL 31 -18.434 -0.264 -1.728
552 H GLY 32 H GLY 32 -20.099 -2.268 -4.877
553 HA2 GLY 32 HA3 GLY 32 -21.719 -1.103 -6.981
554 HA3 GLY 32 HA2 GLY 32 -20.569 -2.419 -7.153
555 H GLU 33 H GLU 33 -21.430 -4.307 -5.469
556 HA GLU 33 HA GLU 33 -22.830 -6.072 -5.312
557 HB2 GLU 33 HB3 GLU 33 -24.957 -3.947 -5.625
558 HB3 GLU 33 HB2 GLU 33 -25.272 -5.613 -5.163
559 HG2 GLU 33 HG3 GLU 33 -23.564 -3.678 -3.613
560 HG3 GLU 33 HG2 GLU 33 -25.241 -4.081 -3.247
Start of MODEL 12
1 H1 GLY 1 H1 GLY 1 26.648 1.852 -1.538
2 H2 GLY 1 H2 GLY 1 25.764 1.864 -0.099
3 H3 GLY 1 H3 GLY 1 27.224 2.705 -0.198
4 HA2 GLY 1 HA2 GLY 1 25.375 4.226 -0.312
5 HA3 GLY 1 HA3 GLY 1 26.286 4.220 -1.815
6 H SER 2 H SER 2 24.194 5.179 -2.532
7 HA SER 2 HA SER 2 22.444 4.984 -4.007
8 HB2 SER 2 HB3 SER 2 22.863 1.994 -3.785
9 HB3 SER 2 HB2 SER 2 21.875 2.818 -4.988
10 HG SER 2 HG SER 2 24.233 3.953 -5.103
11 H MET 3 H MET 3 22.399 4.559 -0.949
12 HA MET 3 HA MET 3 20.114 3.007 -0.338
13 HB2 MET 3 HB3 MET 3 21.653 5.112 1.155
14 HB3 MET 3 HB2 MET 3 20.207 4.379 1.838
15 HG2 MET 3 HG3 MET 3 22.664 2.877 0.960
16 HG3 MET 3 HG2 MET 3 22.286 3.329 2.623
17 HE1 MET 3 HE1 MET 3 21.708 -0.558 2.566
18 HE2 MET 3 HE2 MET 3 22.587 0.770 3.325
19 HE3 MET 3 HE3 MET 3 22.922 0.334 1.648
20 H LYS 4 H LYS 4 20.577 6.345 -1.252
21 HA LYS 4 HA LYS 4 18.175 7.456 -0.402
22 HB2 LYS 4 HB3 LYS 4 20.008 8.777 -1.358
23 HB3 LYS 4 HB2 LYS 4 19.707 8.068 -2.938
24 HG2 LYS 4 HG3 LYS 4 17.471 9.089 -2.952
25 HG3 LYS 4 HG2 LYS 4 17.814 9.831 -1.389
26 HD2 LYS 4 HD3 LYS 4 19.372 10.313 -3.929
27 HD3 LYS 4 HD2 LYS 4 18.142 11.390 -3.271
28 HE2 LYS 4 HE3 LYS 4 20.722 10.613 -1.915
29 HE3 LYS 4 HE2 LYS 4 20.398 12.151 -2.710
30 HZ1 LYS 4 HZ1 LYS 4 18.650 12.573 -1.097
31 HZ2 LYS 4 HZ2 LYS 4 20.129 12.320 -0.322
32 HZ3 LYS 4 HZ3 LYS 4 18.964 11.098 -0.334
33 H GLN 5 H GLN 5 18.902 5.880 -3.502
34 HA GLN 5 HA GLN 5 16.311 6.240 -4.574
35 HB2 GLN 5 HB3 GLN 5 18.525 4.337 -5.334
36 HB3 GLN 5 HB2 GLN 5 17.033 4.500 -6.244
37 HG2 GLN 5 HG3 GLN 5 18.639 5.802 -7.363
38 HG3 GLN 5 HG2 GLN 5 17.586 6.933 -6.520
39 HE21 GLN 5 HE21 GLN 5 20.115 5.025 -5.011
40 HE22 GLN 5 HE22 GLN 5 21.138 6.365 -4.610
41 H LEU 6 H LEU 6 17.787 3.658 -2.699
42 HA LEU 6 HA LEU 6 15.666 1.803 -3.060
43 HB2 LEU 6 HB3 LEU 6 17.991 2.024 -1.215
44 HB3 LEU 6 HB2 LEU 6 16.692 0.937 -0.768
45 HG LEU 6 HG LEU 6 18.495 -0.250 -1.913
46 HD11 LEU 6 HD11 LEU 6 16.002 -0.088 -3.601
47 HD12 LEU 6 HD12 LEU 6 16.192 -1.056 -2.139
48 HD13 LEU 6 HD13 LEU 6 17.162 -1.416 -3.568
49 HD21 LEU 6 HD21 LEU 6 19.334 1.563 -3.308
50 HD22 LEU 6 HD22 LEU 6 17.853 1.524 -4.266
51 HD23 LEU 6 HD23 LEU 6 18.950 0.144 -4.282
52 H GLU 7 H GLU 7 16.406 4.182 -0.538
53 HA GLU 7 HA GLU 7 14.166 3.567 1.083
54 HB2 GLU 7 HB3 GLU 7 15.818 6.087 0.863
55 HB3 GLU 7 HB2 GLU 7 14.590 5.819 2.093
56 HG2 GLU 7 HG3 GLU 7 15.829 3.918 2.948
57 HG3 GLU 7 HG2 GLU 7 17.043 4.125 1.687
58 H ASP 8 H ASP 8 14.680 5.874 -1.543
59 HA ASP 8 HA ASP 8 12.135 7.107 -1.373
60 HB2 ASP 8 HB3 ASP 8 14.248 6.951 -3.484
61 HB3 ASP 8 HB2 ASP 8 12.654 7.562 -3.915
62 H LYS 9 H LYS 9 13.239 4.133 -2.769
63 HA LYS 9 HA LYS 9 10.975 3.656 -4.425
64 HB2 LYS 9 HB3 LYS 9 13.250 2.518 -4.547
65 HB3 LYS 9 HB2 LYS 9 12.747 1.565 -3.159
66 HG2 LYS 9 HG3 LYS 9 10.950 0.583 -4.415
67 HG3 LYS 9 HG2 LYS 9 11.286 1.641 -5.789
68 HD2 LYS 9 HD3 LYS 9 13.568 0.627 -5.908
69 HD3 LYS 9 HD2 LYS 9 13.061 -0.527 -4.678
70 HE2 LYS 9 HE3 LYS 9 11.755 -0.161 -7.371
71 HE3 LYS 9 HE2 LYS 9 12.901 -1.434 -6.964
72 HZ1 LYS 9 HZ1 LYS 9 10.631 -2.219 -6.832
73 HZ2 LYS 9 HZ2 LYS 9 10.248 -1.026 -5.703
74 HZ3 LYS 9 HZ3 LYS 9 11.348 -2.247 -5.303
75 H VAL 10 H VAL 10 11.824 2.888 -1.094
76 HA VAL 10 HA VAL 10 9.481 1.423 -0.455
77 HB VAL 10 HB VAL 10 11.183 3.091 1.413
78 HG11 VAL 10 HG11 VAL 10 9.333 0.772 1.954
79 HG12 VAL 10 HG12 VAL 10 9.042 2.460 2.376
80 HG13 VAL 10 HG13 VAL 10 10.355 1.571 3.148
81 HG21 VAL 10 HG21 VAL 10 11.458 0.178 0.680
82 HG22 VAL 10 HG22 VAL 10 12.415 1.041 1.885
83 HG23 VAL 10 HG23 VAL 10 12.544 1.475 0.180
84 H GLU 11 H GLU 11 10.359 4.849 -0.160
85 HA GLU 11 HA GLU 11 7.940 5.700 1.020
86 HB2 GLU 11 HB3 GLU 11 9.868 7.271 -0.700
87 HB3 GLU 11 HB2 GLU 11 8.621 7.962 0.327
88 HG2 GLU 11 HG3 GLU 11 10.990 6.354 1.254
89 HG3 GLU 11 HG2 GLU 11 10.806 8.103 1.375
90 H GLU 12 H GLU 12 8.960 5.320 -2.327
91 HA GLU 12 HA GLU 12 6.734 6.371 -3.623
92 HB2 GLU 12 HB3 GLU 12 8.747 5.619 -4.806
93 HB3 GLU 12 HB2 GLU 12 8.376 3.951 -4.396
94 HG2 GLU 12 HG3 GLU 12 6.315 4.097 -5.714
95 HG3 GLU 12 HG2 GLU 12 6.722 5.757 -6.146
96 H LEU 13 H LEU 13 7.262 2.959 -2.640
97 HA LEU 13 HA LEU 13 4.599 2.216 -3.215
98 HB2 LEU 13 HB3 LEU 13 6.894 0.930 -1.867
99 HB3 LEU 13 HB2 LEU 13 5.300 0.281 -1.519
100 HG LEU 13 HG LEU 13 4.997 0.223 -4.077
101 HD11 LEU 13 HD11 LEU 13 6.934 1.541 -4.674
102 HD12 LEU 13 HD12 LEU 13 7.074 -0.088 -5.335
103 HD13 LEU 13 HD13 LEU 13 8.001 0.367 -3.905
104 HD21 LEU 13 HD21 LEU 13 5.139 -1.762 -2.698
105 HD22 LEU 13 HD22 LEU 13 6.900 -1.655 -2.683
106 HD23 LEU 13 HD23 LEU 13 6.049 -1.992 -4.191
107 H LEU 14 H LEU 14 5.945 3.816 -0.454
108 HA LEU 14 HA LEU 14 3.772 3.185 1.269
109 HB2 LEU 14 HB3 LEU 14 6.043 4.217 1.927
110 HB3 LEU 14 HB2 LEU 14 5.332 5.745 1.407
111 HG LEU 14 HG LEU 14 3.754 4.109 3.329
112 HD11 LEU 14 HD11 LEU 14 6.122 5.720 4.277
113 HD12 LEU 14 HD12 LEU 14 6.055 3.958 4.224
114 HD13 LEU 14 HD13 LEU 14 4.947 4.851 5.262
115 HD21 LEU 14 HD21 LEU 14 2.914 6.234 2.486
116 HD22 LEU 14 HD22 LEU 14 4.333 7.057 3.134
117 HD23 LEU 14 HD23 LEU 14 3.181 6.289 4.229
118 H SER 15 H SER 15 4.473 5.762 -1.029
119 HA SER 15 HA SER 15 2.048 7.165 -0.704
120 HB2 SER 15 HB3 SER 15 4.035 8.070 -1.898
121 HB3 SER 15 HB2 SER 15 3.755 6.911 -3.195
122 HG SER 15 HG SER 15 2.869 9.008 -3.602
123 H LYS 16 H LYS 16 3.019 4.403 -2.667
124 HA LYS 16 HA LYS 16 0.736 4.053 -4.210
125 HB2 LYS 16 HB3 LYS 16 2.826 2.772 -4.480
126 HB3 LYS 16 HB2 LYS 16 2.500 1.929 -2.973
127 HG2 LYS 16 HG3 LYS 16 0.490 0.943 -3.963
128 HG3 LYS 16 HG2 LYS 16 0.837 1.780 -5.478
129 HD2 LYS 16 HD3 LYS 16 2.962 0.581 -5.659
130 HD3 LYS 16 HD2 LYS 16 2.631 -0.244 -4.136
131 HE2 LYS 16 HE3 LYS 16 2.101 -1.719 -5.968
132 HE3 LYS 16 HE2 LYS 16 0.613 -1.238 -5.153
133 HZ1 LYS 16 HZ1 LYS 16 1.648 -0.063 -7.675
134 HZ2 LYS 16 HZ2 LYS 16 0.216 0.381 -6.894
135 HZ3 LYS 16 HZ3 LYS 16 0.373 -1.165 -7.551
136 H ASN 17 H ASN 17 1.407 2.802 -0.916
137 HA ASN 17 HA ASN 17 -1.232 1.646 -0.792
138 HB2 ASN 17 HB3 ASN 17 -0.659 0.727 1.305
139 HB3 ASN 17 HB2 ASN 17 0.803 0.629 0.337
140 HD21 ASN 17 HD21 ASN 17 2.602 1.672 0.987
141 HD22 ASN 17 HD22 ASN 17 2.709 2.570 2.462
142 H TYR 18 H TYR 18 0.356 4.537 0.465
143 HA TYR 18 HA TYR 18 -1.579 5.402 2.247
144 HB2 TYR 18 HB3 TYR 18 0.533 6.571 2.009
145 HB3 TYR 18 HB2 TYR 18 0.125 7.044 0.365
146 HD1 TYR 18 HD1 TYR 18 -1.119 7.394 3.866
147 HD2 TYR 18 HD2 TYR 18 -0.822 9.127 -0.009
148 HE1 TYR 18 HE1 TYR 18 -2.143 9.461 4.716
149 HE2 TYR 18 HE2 TYR 18 -1.842 11.199 0.833
150 HH TYR 18 HH TYR 18 -2.237 11.840 4.153
151 H HIS 19 H HIS 19 -1.405 6.086 -1.251
152 HA HIS 19 HA HIS 19 -3.894 7.470 -1.306
153 HB2 HIS 19 HB3 HIS 19 -2.219 6.236 -3.494
154 HB3 HIS 19 HB2 HIS 19 -3.717 7.103 -3.810
155 HD1 HIS 19 HD1 HIS 19 -0.184 7.629 -3.627
156 HD2 HIS 19 HD2 HIS 19 -3.555 9.878 -2.700
157 HE1 HIS 19 HE1 HIS 19 0.597 10.013 -3.540
158 HE2 HIS 19 HE2 HIS 19 -1.421 11.333 -2.822
159 H LEU 20 H LEU 20 -2.961 4.138 -1.610
160 HA LEU 20 HA LEU 20 -5.400 3.181 -2.692
161 HB2 LEU 20 HB3 LEU 20 -3.194 2.033 -2.809
162 HB3 LEU 20 HB2 LEU 20 -3.289 1.746 -1.085
163 HG LEU 20 HG LEU 20 -5.279 0.370 -1.430
164 HD11 LEU 20 HD11 LEU 20 -6.151 1.385 -3.452
165 HD12 LEU 20 HD12 LEU 20 -5.874 -0.337 -3.712
166 HD13 LEU 20 HD13 LEU 20 -4.737 0.846 -4.355
167 HD21 LEU 20 HD21 LEU 20 -2.902 -0.429 -3.096
168 HD22 LEU 20 HD22 LEU 20 -4.124 -1.524 -2.456
169 HD23 LEU 20 HD23 LEU 20 -3.065 -0.646 -1.355
170 H GLU 21 H GLU 21 -4.157 3.822 0.516
171 HA GLU 21 HA GLU 21 -6.224 2.594 2.005
172 HB2 GLU 21 HB3 GLU 21 -4.075 3.345 2.974
173 HB3 GLU 21 HB2 GLU 21 -4.550 5.016 2.707
174 HG2 GLU 21 HG3 GLU 21 -6.430 4.719 4.247
175 HG3 GLU 21 HG2 GLU 21 -5.927 3.052 4.526
176 H ASN 22 H ASN 22 -5.895 5.771 0.508
177 HA ASN 22 HA ASN 22 -8.249 6.930 1.505
178 HB2 ASN 22 HB3 ASN 22 -6.762 7.372 -1.080
179 HB3 ASN 22 HB2 ASN 22 -8.183 8.308 -0.632
180 HD21 ASN 22 HD21 ASN 22 -8.069 9.678 1.186
181 HD22 ASN 22 HD22 ASN 22 -6.545 10.240 1.783
182 H GLU 23 H GLU 23 -7.660 4.596 -0.973
183 HA GLU 23 HA GLU 23 -10.199 4.760 -2.264
184 HB2 GLU 23 HB3 GLU 23 -8.194 2.487 -2.205
185 HB3 GLU 23 HB2 GLU 23 -9.559 2.637 -3.329
186 HG2 GLU 23 HG3 GLU 23 -7.258 4.576 -3.136
187 HG3 GLU 23 HG2 GLU 23 -7.385 3.270 -4.313
188 H VAL 24 H VAL 24 -8.843 2.780 0.332
189 HA VAL 24 HA VAL 24 -11.116 1.090 0.597
190 HB VAL 24 HB VAL 24 -9.158 1.735 2.806
191 HG11 VAL 24 HG11 VAL 24 -10.820 -0.727 2.245
192 HG12 VAL 24 HG12 VAL 24 -11.147 0.489 3.483
193 HG13 VAL 24 HG13 VAL 24 -9.702 -0.514 3.594
194 HG21 VAL 24 HG21 VAL 24 -7.810 -0.146 2.047
195 HG22 VAL 24 HG22 VAL 24 -7.903 1.101 0.805
196 HG23 VAL 24 HG23 VAL 24 -8.875 -0.362 0.660
197 H ALA 25 H ALA 25 -10.087 4.115 2.071
198 HA ALA 25 HA ALA 25 -11.982 4.161 4.157
199 HB1 ALA 25 HB1 ALA 25 -11.380 6.434 4.500
200 HB2 ALA 25 HB2 ALA 25 -10.757 6.575 2.859
201 HB3 ALA 25 HB3 ALA 25 -9.919 5.559 4.035
202 H ARG 26 H ARG 26 -12.126 5.457 0.847
203 HA ARG 26 HA ARG 26 -14.535 6.858 1.240
204 HB2 ARG 26 HB3 ARG 26 -14.716 6.754 -1.265
205 HB3 ARG 26 HB2 ARG 26 -13.282 7.529 -0.628
206 HG2 ARG 26 HG3 ARG 26 -11.960 5.587 -1.170
207 HG3 ARG 26 HG2 ARG 26 -13.394 4.699 -1.688
208 HD2 ARG 26 HD2 ARG 26 -12.240 7.178 -2.951
209 HD3 ARG 26 HD1 ARG 26 -12.249 5.548 -3.624
210 HE ARG 26 HE ARG 26 -14.736 7.048 -3.105
211 HH11 ARG 26 HH11 ARG 26 -12.731 5.105 -5.228
212 HH12 ARG 26 HH12 ARG 26 -13.918 5.045 -6.490
213 HH21 ARG 26 HH21 ARG 26 -16.289 6.954 -4.746
214 HH22 ARG 26 HH22 ARG 26 -15.948 6.096 -6.215
215 H LEU 27 H LEU 27 -13.866 3.613 0.038
216 HA LEU 27 HA LEU 27 -16.585 2.989 -0.512
217 HB2 LEU 27 HB3 LEU 27 -14.275 1.140 0.036
218 HB3 LEU 27 HB2 LEU 27 -15.820 0.693 -0.651
219 HG LEU 27 HG LEU 27 -14.094 2.707 -2.001
220 HD11 LEU 27 HD11 LEU 27 -13.131 0.933 -3.324
221 HD12 LEU 27 HD12 LEU 27 -14.010 -0.269 -2.375
222 HD13 LEU 27 HD13 LEU 27 -12.754 0.711 -1.614
223 HD21 LEU 27 HD21 LEU 27 -16.361 2.590 -2.781
224 HD22 LEU 27 HD22 LEU 27 -16.273 0.831 -2.879
225 HD23 LEU 27 HD23 LEU 27 -15.316 1.826 -3.981
226 H LYS 28 H LYS 28 -14.488 2.444 2.274
227 HA LYS 28 HA LYS 28 -16.017 0.764 3.793
228 HB2 LYS 28 HB3 LYS 28 -13.739 1.713 4.333
229 HB3 LYS 28 HB2 LYS 28 -14.562 3.147 4.930
230 HG2 LYS 28 HG3 LYS 28 -13.975 1.671 6.757
231 HG3 LYS 28 HG2 LYS 28 -15.729 1.783 6.592
232 HD2 LYS 28 HD3 LYS 28 -15.806 -0.353 5.475
233 HD3 LYS 28 HD2 LYS 28 -14.044 -0.446 5.453
234 HE2 LYS 28 HE3 LYS 28 -14.948 -1.845 7.216
235 HE3 LYS 28 HE2 LYS 28 -14.026 -0.510 7.901
236 HZ1 LYS 28 HZ1 LYS 28 -16.083 0.644 8.370
237 HZ2 LYS 28 HZ2 LYS 28 -16.107 -0.890 9.081
238 HZ3 LYS 28 HZ3 LYS 28 -16.986 -0.601 7.666
239 H LYS 29 H LYS 29 -16.341 4.318 3.653
240 HA LYS 29 HA LYS 29 -18.526 4.307 5.495
241 HB2 LYS 29 HB3 LYS 29 -18.701 6.693 4.966
242 HB3 LYS 29 HB2 LYS 29 -17.065 6.231 5.396
243 HG2 LYS 29 HG3 LYS 29 -16.441 6.231 3.042
244 HG3 LYS 29 HG2 LYS 29 -18.094 6.667 2.600
245 HD2 LYS 29 HD3 LYS 29 -17.876 8.754 3.861
246 HD3 LYS 29 HD2 LYS 29 -16.225 8.316 4.301
247 HE2 LYS 29 HE3 LYS 29 -15.608 8.302 1.928
248 HE3 LYS 29 HE2 LYS 29 -17.254 8.767 1.503
249 HZ1 LYS 29 HZ1 LYS 29 -16.961 10.830 2.672
250 HZ2 LYS 29 HZ2 LYS 29 -15.715 10.651 1.545
251 HZ3 LYS 29 HZ3 LYS 29 -15.417 10.375 3.185
252 H LEU 30 H LEU 30 -18.219 4.045 2.045
253 HA LEU 30 HA LEU 30 -20.937 4.752 1.466
254 HB2 LEU 30 HB3 LEU 30 -18.625 3.736 -0.056
255 HB3 LEU 30 HB2 LEU 30 -20.197 3.279 -0.680
256 HG LEU 30 HG LEU 30 -20.833 5.629 -0.873
257 HD11 LEU 30 HD11 LEU 30 -18.058 6.225 0.129
258 HD12 LEU 30 HD12 LEU 30 -19.564 6.540 0.988
259 HD13 LEU 30 HD13 LEU 30 -19.202 7.406 -0.504
260 HD21 LEU 30 HD21 LEU 30 -19.248 6.275 -2.647
261 HD22 LEU 30 HD22 LEU 30 -19.778 4.600 -2.780
262 HD23 LEU 30 HD23 LEU 30 -18.178 4.969 -2.136
263 H VAL 31 H VAL 31 -19.218 1.782 2.192
264 HA VAL 31 HA VAL 31 -21.520 0.109 1.738
265 HB VAL 31 HB VAL 31 -19.025 -0.529 3.337
266 HG11 VAL 31 HG11 VAL 31 -20.951 -2.009 3.775
267 HG12 VAL 31 HG12 VAL 31 -19.611 -2.847 2.995
268 HG13 VAL 31 HG13 VAL 31 -21.027 -2.383 2.053
269 HG21 VAL 31 HG21 VAL 31 -18.435 0.080 1.064
270 HG22 VAL 31 HG22 VAL 31 -19.639 -1.043 0.431
271 HG23 VAL 31 HG23 VAL 31 -18.235 -1.655 1.305
272 H GLY 32 H GLY 32 -20.255 2.047 4.292
273 HA2 GLY 32 HA3 GLY 32 -21.802 0.813 6.384
274 HA3 GLY 32 HA2 GLY 32 -20.883 2.307 6.505
275 H GLU 33 H GLU 33 -21.928 3.977 4.745
276 HA GLU 33 HA GLU 33 -24.762 4.144 5.525
277 HB2 GLU 33 HB3 GLU 33 -22.857 6.387 4.833
278 HB3 GLU 33 HB2 GLU 33 -24.540 6.577 5.300
279 HG2 GLU 33 HG3 GLU 33 -24.013 5.591 7.496
280 HG3 GLU 33 HG2 GLU 33 -22.317 5.501 7.019
281 H1 GLY 1 H1 GLY 1 26.656 -2.060 0.814
282 H2 GLY 1 H2 GLY 1 25.763 -2.062 -0.618
283 H3 GLY 1 H3 GLY 1 27.219 -2.914 -0.531
284 HA2 GLY 1 HA2 GLY 1 25.368 -4.432 -0.400
285 HA3 GLY 1 HA3 GLY 1 26.283 -4.420 1.102
286 H SER 2 H SER 2 24.190 -5.371 1.833
287 HA SER 2 HA SER 2 22.448 -5.175 3.313
288 HB2 SER 2 HB3 SER 2 22.876 -2.185 3.093
289 HB3 SER 2 HB2 SER 2 21.887 -3.007 4.300
290 HG SER 2 HG SER 2 24.223 -4.162 4.425
291 H MET 3 H MET 3 22.391 -4.754 0.257
292 HA MET 3 HA MET 3 20.106 -3.201 -0.349
293 HB2 MET 3 HB3 MET 3 21.635 -5.313 -1.843
294 HB3 MET 3 HB2 MET 3 20.189 -4.578 -2.521
295 HG2 MET 3 HG3 MET 3 22.654 -3.083 -1.660
296 HG3 MET 3 HG2 MET 3 22.261 -3.533 -3.319
297 HE1 MET 3 HE1 MET 3 21.698 0.358 -3.259
298 HE2 MET 3 HE2 MET 3 22.570 -0.973 -4.020
299 HE3 MET 3 HE3 MET 3 22.915 -0.535 -2.347
300 H LYS 4 H LYS 4 20.557 -6.531 0.587
301 HA LYS 4 HA LYS 4 18.152 -7.639 -0.268
302 HB2 LYS 4 HB3 LYS 4 19.989 -8.968 0.675
303 HB3 LYS 4 HB2 LYS 4 19.697 -8.260 2.257
304 HG2 LYS 4 HG3 LYS 4 17.459 -9.274 2.282
305 HG3 LYS 4 HG2 LYS 4 17.797 -10.020 0.720
306 HD2 LYS 4 HD3 LYS 4 19.364 -10.495 3.256
307 HD3 LYS 4 HD2 LYS 4 18.130 -11.575 2.606
308 HE2 LYS 4 HE3 LYS 4 20.703 -10.798 1.235
309 HE3 LYS 4 HE2 LYS 4 20.385 -12.334 2.037
310 HZ1 LYS 4 HZ1 LYS 4 18.634 -12.768 0.437
311 HZ2 LYS 4 HZ2 LYS 4 20.102 -12.504 -0.353
312 HZ3 LYS 4 HZ3 LYS 4 18.928 -11.291 -0.330
313 H GLN 5 H GLN 5 18.903 -6.057 2.820
314 HA GLN 5 HA GLN 5 16.321 -6.415 3.916
315 HB2 GLN 5 HB3 GLN 5 18.546 -4.512 4.658
316 HB3 GLN 5 HB2 GLN 5 17.057 -4.669 5.577
317 HG2 GLN 5 HG3 GLN 5 18.665 -5.979 6.688
318 HG3 GLN 5 HG2 GLN 5 17.602 -7.105 5.852
319 HE21 GLN 5 HE21 GLN 5 20.137 -5.209 4.334
320 HE22 GLN 5 HE22 GLN 5 21.148 -6.553 3.920
321 H LEU 6 H LEU 6 17.788 -3.838 2.027
322 HA LEU 6 HA LEU 6 15.669 -1.977 2.392
323 HB2 LEU 6 HB3 LEU 6 17.987 -2.212 0.538
324 HB3 LEU 6 HB2 LEU 6 16.690 -1.122 0.093
325 HG LEU 6 HG LEU 6 18.500 0.064 1.228
326 HD11 LEU 6 HD11 LEU 6 16.013 -0.093 2.922
327 HD12 LEU 6 HD12 LEU 6 16.202 0.873 1.458
328 HD13 LEU 6 HD13 LEU 6 17.174 1.233 2.884
329 HD21 LEU 6 HD21 LEU 6 19.340 -1.748 2.623
330 HD22 LEU 6 HD22 LEU 6 17.865 -1.703 3.588
331 HD23 LEU 6 HD23 LEU 6 18.965 -0.324 3.596
332 H GLU 7 H GLU 7 16.399 -4.362 -0.129
333 HA GLU 7 HA GLU 7 14.154 -3.753 -1.744
334 HB2 GLU 7 HB3 GLU 7 15.797 -6.277 -1.517
335 HB3 GLU 7 HB2 GLU 7 14.566 -6.010 -2.745
336 HG2 GLU 7 HG3 GLU 7 15.812 -4.121 -3.617
337 HG3 GLU 7 HG2 GLU 7 17.031 -4.326 -2.359
338 H ASP 8 H ASP 8 14.675 -6.058 0.885
339 HA ASP 8 HA ASP 8 12.128 -7.287 0.729
340 HB2 ASP 8 HB3 ASP 8 14.243 -7.126 2.838
341 HB3 ASP 8 HB2 ASP 8 12.649 -7.738 3.269
342 H LYS 9 H LYS 9 13.238 -4.312 2.121
343 HA LYS 9 HA LYS 9 10.983 -3.820 3.783
344 HB2 LYS 9 HB3 LYS 9 13.263 -2.687 3.885
345 HB3 LYS 9 HB2 LYS 9 12.752 -1.738 2.499
346 HG2 LYS 9 HG3 LYS 9 10.968 -0.748 3.763
347 HG3 LYS 9 HG2 LYS 9 11.308 -1.802 5.139
348 HD2 LYS 9 HD3 LYS 9 13.594 -0.792 5.243
349 HD3 LYS 9 HD2 LYS 9 13.080 0.359 4.009
350 HE2 LYS 9 HE3 LYS 9 11.782 -0.001 6.707
351 HE3 LYS 9 HE2 LYS 9 12.930 1.270 6.295
352 HZ1 LYS 9 HZ1 LYS 9 10.653 2.054 6.169
353 HZ2 LYS 9 HZ2 LYS 9 10.276 0.869 5.029
354 HZ3 LYS 9 HZ3 LYS 9 11.378 2.093 4.644
355 H VAL 10 H VAL 10 11.818 -3.064 0.447
356 HA VAL 10 HA VAL 10 9.476 -1.592 -0.185
357 HB VAL 10 HB VAL 10 11.168 -3.267 -2.058
358 HG11 VAL 10 HG11 VAL 10 9.319 -0.947 -2.599
359 HG12 VAL 10 HG12 VAL 10 9.025 -2.635 -3.017
360 HG13 VAL 10 HG13 VAL 10 10.338 -1.750 -3.794
361 HG21 VAL 10 HG21 VAL 10 11.449 -0.354 -1.330
362 HG22 VAL 10 HG22 VAL 10 12.398 -1.218 -2.538
363 HG23 VAL 10 HG23 VAL 10 12.535 -1.651 -0.834
364 H GLU 11 H GLU 11 10.346 -5.021 -0.477
365 HA GLU 11 HA GLU 11 7.920 -5.868 -1.644
366 HB2 GLU 11 HB3 GLU 11 9.849 -7.440 0.073
367 HB3 GLU 11 HB2 GLU 11 8.595 -8.130 -0.947
368 HG2 GLU 11 HG3 GLU 11 10.962 -6.529 -1.889
369 HG3 GLU 11 HG2 GLU 11 10.776 -8.278 -2.002
370 H GLU 12 H GLU 12 8.957 -5.491 1.697
371 HA GLU 12 HA GLU 12 6.733 -6.527 3.005
372 HB2 GLU 12 HB3 GLU 12 8.753 -5.779 4.178
373 HB3 GLU 12 HB2 GLU 12 8.387 -4.111 3.764
374 HG2 GLU 12 HG3 GLU 12 6.333 -4.243 5.092
375 HG3 GLU 12 HG2 GLU 12 6.730 -5.905 5.522
376 H LEU 13 H LEU 13 7.267 -3.118 2.011
377 HA LEU 13 HA LEU 13 4.608 -2.370 2.598
378 HB2 LEU 13 HB3 LEU 13 6.896 -1.088 1.238
379 HB3 LEU 13 HB2 LEU 13 5.303 -0.439 0.897
380 HG LEU 13 HG LEU 13 5.009 -0.376 3.454
381 HD11 LEU 13 HD11 LEU 13 6.949 -1.699 4.047
382 HD12 LEU 13 HD12 LEU 13 7.091 -0.070 4.708
383 HD13 LEU 13 HD13 LEU 13 8.015 -0.524 3.276
384 HD21 LEU 13 HD21 LEU 13 5.152 1.606 2.070
385 HD22 LEU 13 HD22 LEU 13 6.912 1.495 2.048
386 HD23 LEU 13 HD23 LEU 13 6.070 1.839 3.558
387 H LEU 14 H LEU 14 5.937 -3.976 -0.166
388 HA LEU 14 HA LEU 14 3.757 -3.346 -1.879
389 HB2 LEU 14 HB3 LEU 14 6.024 -4.387 -2.546
390 HB3 LEU 14 HB2 LEU 14 5.309 -5.910 -2.022
391 HG LEU 14 HG LEU 14 3.726 -4.274 -3.939
392 HD11 LEU 14 HD11 LEU 14 6.090 -5.884 -4.893
393 HD12 LEU 14 HD12 LEU 14 6.019 -4.121 -4.845
394 HD13 LEU 14 HD13 LEU 14 4.908 -5.020 -5.874
395 HD21 LEU 14 HD21 LEU 14 2.893 -6.398 -3.089
396 HD22 LEU 14 HD22 LEU 14 4.307 -7.221 -3.749
397 HD23 LEU 14 HD23 LEU 14 3.147 -6.450 -4.832
398 H SER 15 H SER 15 4.458 -5.913 0.427
399 HA SER 15 HA SER 15 2.030 -7.317 0.106
400 HB2 SER 15 HB3 SER 15 4.024 -8.219 1.294
401 HB3 SER 15 HB2 SER 15 3.741 -7.065 2.594
402 HG SER 15 HG SER 15 2.856 -9.137 3.034
403 H LYS 16 H LYS 16 3.016 -4.557 2.062
404 HA LYS 16 HA LYS 16 0.739 -4.196 3.609
405 HB2 LYS 16 HB3 LYS 16 2.834 -2.920 3.869
406 HB3 LYS 16 HB2 LYS 16 2.504 -2.078 2.363
407 HG2 LYS 16 HG3 LYS 16 0.499 -1.088 3.361
408 HG3 LYS 16 HG2 LYS 16 0.852 -1.922 4.878
409 HD2 LYS 16 HD3 LYS 16 2.981 -0.728 5.043
410 HD3 LYS 16 HD2 LYS 16 2.644 0.094 3.519
411 HE2 LYS 16 HE3 LYS 16 2.125 1.576 5.349
412 HE3 LYS 16 HE2 LYS 16 0.630 1.093 4.549
413 HZ1 LYS 16 HZ1 LYS 16 1.689 -0.073 7.066
414 HZ2 LYS 16 HZ2 LYS 16 0.250 -0.522 6.303
415 HZ3 LYS 16 HZ3 LYS 16 0.412 1.031 6.952
416 H ASN 17 H ASN 17 1.402 -2.949 0.310
417 HA ASN 17 HA ASN 17 -1.237 -1.790 0.193
418 HB2 ASN 17 HB3 ASN 17 -0.667 -0.874 -1.907
419 HB3 ASN 17 HB2 ASN 17 0.801 -0.782 -0.946
420 HD21 ASN 17 HD21 ASN 17 2.589 -1.831 -1.602
421 HD22 ASN 17 HD22 ASN 17 2.688 -2.733 -3.076
422 H TYR 18 H TYR 18 0.342 -4.687 -1.064
423 HA TYR 18 HA TYR 18 -1.603 -5.552 -2.836
424 HB2 TYR 18 HB3 TYR 18 0.507 -6.724 -2.609
425 HB3 TYR 18 HB2 TYR 18 0.109 -7.193 -0.959
426 HD1 TYR 18 HD1 TYR 18 -1.158 -7.553 -4.453
427 HD2 TYR 18 HD2 TYR 18 -0.842 -9.274 -0.574
428 HE1 TYR 18 HE1 TYR 18 -2.185 -9.622 -5.293
429 HE2 TYR 18 HE2 TYR 18 -1.867 -11.345 -1.407
430 HH TYR 18 HH TYR 18 -2.297 -11.988 -4.728
431 H HIS 19 H HIS 19 -1.414 -6.229 0.664
432 HA HIS 19 HA HIS 19 -3.905 -7.609 0.730
433 HB2 HIS 19 HB3 HIS 19 -2.221 -6.371 2.909
434 HB3 HIS 19 HB2 HIS 19 -3.721 -7.233 3.234
435 HD1 HIS 19 HD1 HIS 19 -0.190 -7.773 3.044
436 HD2 HIS 19 HD2 HIS 19 -3.570 -10.014 2.124
437 HE1 HIS 19 HE1 HIS 19 0.585 -10.158 2.952
438 HE2 HIS 19 HE2 HIS 19 -1.437 -11.471 2.225
439 H LEU 20 H LEU 20 -2.962 -4.276 1.039
440 HA LEU 20 HA LEU 20 -5.395 -3.312 2.118
441 HB2 LEU 20 HB3 LEU 20 -3.188 -2.168 2.222
442 HB3 LEU 20 HB2 LEU 20 -3.291 -1.882 0.498
443 HG LEU 20 HG LEU 20 -5.277 -0.504 0.853
444 HD11 LEU 20 HD11 LEU 20 -6.140 -1.517 2.881
445 HD12 LEU 20 HD12 LEU 20 -5.861 0.205 3.136
446 HD13 LEU 20 HD13 LEU 20 -4.721 -0.978 3.777
447 HD21 LEU 20 HD21 LEU 20 -2.889 0.291 2.506
448 HD22 LEU 20 HD22 LEU 20 -4.112 1.388 1.867
449 HD23 LEU 20 HD23 LEU 20 -3.060 0.503 0.765
450 H GLU 21 H GLU 21 -4.168 -3.957 -1.091
451 HA GLU 21 HA GLU 21 -6.241 -2.731 -2.573
452 HB2 GLU 21 HB3 GLU 21 -4.098 -3.486 -3.551
453 HB3 GLU 21 HB2 GLU 21 -4.573 -5.155 -3.278
454 HG2 GLU 21 HG3 GLU 21 -6.461 -4.860 -4.805
455 HG3 GLU 21 HG2 GLU 21 -5.957 -3.195 -5.092
456 H ASN 22 H ASN 22 -5.915 -5.901 -1.064
457 HA ASN 22 HA ASN 22 -8.268 -7.065 -2.060
458 HB2 ASN 22 HB3 ASN 22 -6.777 -7.503 0.525
459 HB3 ASN 22 HB2 ASN 22 -8.202 -8.436 0.083
460 HD21 ASN 22 HD21 ASN 22 -8.096 -9.806 -1.731
461 HD22 ASN 22 HD22 ASN 22 -6.581 -10.385 -2.325
462 H GLU 23 H GLU 23 -7.672 -4.728 0.414
463 HA GLU 23 HA GLU 23 -10.206 -4.885 1.710
464 HB2 GLU 23 HB3 GLU 23 -8.207 -2.610 1.644
465 HB3 GLU 23 HB2 GLU 23 -9.563 -2.771 2.780
466 HG2 GLU 23 HG3 GLU 23 -7.254 -4.699 2.562
467 HG3 GLU 23 HG2 GLU 23 -7.367 -3.389 3.735
468 H VAL 24 H VAL 24 -8.852 -2.907 -0.887
469 HA VAL 24 HA VAL 24 -11.123 -1.217 -1.150
470 HB VAL 24 HB VAL 24 -9.173 -1.867 -3.366
471 HG11 VAL 24 HG11 VAL 24 -10.832 0.600 -2.807
472 HG12 VAL 24 HG12 VAL 24 -11.164 -0.620 -4.040
473 HG13 VAL 24 HG13 VAL 24 -9.718 0.381 -4.160
474 HG21 VAL 24 HG21 VAL 24 -7.819 0.012 -2.616
475 HG22 VAL 24 HG22 VAL 24 -7.911 -1.231 -1.369
476 HG23 VAL 24 HG23 VAL 24 -8.880 0.234 -1.227
477 H ALA 25 H ALA 25 -10.109 -4.247 -2.618
478 HA ALA 25 HA ALA 25 -12.013 -4.298 -4.696
479 HB1 ALA 25 HB1 ALA 25 -11.410 -6.570 -5.035
480 HB2 ALA 25 HB2 ALA 25 -10.783 -6.708 -3.397
481 HB3 ALA 25 HB3 ALA 25 -9.949 -5.695 -4.576
482 H ARG 26 H ARG 26 -12.148 -5.577 -1.384
483 HA ARG 26 HA ARG 26 -14.558 -6.979 -1.765
484 HB2 ARG 26 HB3 ARG 26 -14.727 -6.872 0.742
485 HB3 ARG 26 HB2 ARG 26 -13.297 -7.646 0.101
486 HG2 ARG 26 HG3 ARG 26 -11.973 -5.705 0.630
487 HG3 ARG 26 HG2 ARG 26 -13.406 -4.814 1.149
488 HD2 ARG 26 HD2 ARG 26 -12.242 -7.282 2.423
489 HD3 ARG 26 HD1 ARG 26 -12.255 -5.650 3.086
490 HE ARG 26 HE ARG 26 -14.738 -7.160 2.580
491 HH11 ARG 26 HH11 ARG 26 -12.727 -5.212 4.692
492 HH12 ARG 26 HH12 ARG 26 -13.907 -5.157 5.959
493 HH21 ARG 26 HH21 ARG 26 -16.284 -7.061 4.231
494 HH22 ARG 26 HH22 ARG 26 -15.931 -6.201 5.696
495 H LEU 27 H LEU 27 -13.881 -3.730 -0.571
496 HA LEU 27 HA LEU 27 -16.593 -3.100 -0.015
497 HB2 LEU 27 HB3 LEU 27 -14.282 -1.256 -0.576
498 HB3 LEU 27 HB2 LEU 27 -15.823 -0.803 0.119
499 HG LEU 27 HG LEU 27 -14.094 -2.822 1.463
500 HD11 LEU 27 HD11 LEU 27 -13.119 -1.047 2.779
501 HD12 LEU 27 HD12 LEU 27 -14.000 0.154 1.834
502 HD13 LEU 27 HD13 LEU 27 -12.751 -0.828 1.068
503 HD21 LEU 27 HD21 LEU 27 -16.356 -2.700 2.253
504 HD22 LEU 27 HD22 LEU 27 -16.267 -0.942 2.347
505 HD23 LEU 27 HD23 LEU 27 -15.306 -1.934 3.448
506 H LYS 28 H LYS 28 -14.510 -2.566 -2.810
507 HA LYS 28 HA LYS 28 -16.039 -0.887 -4.331
508 HB2 LYS 28 HB3 LYS 28 -13.764 -1.844 -4.874
509 HB3 LYS 28 HB2 LYS 28 -14.590 -3.279 -5.463
510 HG2 LYS 28 HG3 LYS 28 -14.011 -1.811 -7.298
511 HG3 LYS 28 HG2 LYS 28 -15.763 -1.915 -7.124
512 HD2 LYS 28 HD3 LYS 28 -15.830 0.225 -6.016
513 HD3 LYS 28 HD2 LYS 28 -14.069 0.313 -5.997
514 HE2 LYS 28 HE3 LYS 28 -14.970 1.711 -7.763
515 HE3 LYS 28 HE2 LYS 28 -14.055 0.371 -8.448
516 HZ1 LYS 28 HZ1 LYS 28 -16.114 -0.772 -8.915
517 HZ2 LYS 28 HZ2 LYS 28 -16.142 0.763 -9.621
518 HZ3 LYS 28 HZ3 LYS 28 -17.012 0.471 -8.205
519 H LYS 29 H LYS 29 -16.369 -4.439 -4.180
520 HA LYS 29 HA LYS 29 -18.565 -4.428 -6.008
521 HB2 LYS 29 HB3 LYS 29 -18.742 -6.810 -5.470
522 HB3 LYS 29 HB2 LYS 29 -17.108 -6.353 -5.912
523 HG2 LYS 29 HG3 LYS 29 -16.470 -6.348 -3.562
524 HG3 LYS 29 HG2 LYS 29 -18.120 -6.778 -3.108
525 HD2 LYS 29 HD3 LYS 29 -17.920 -8.866 -4.366
526 HD3 LYS 29 HD2 LYS 29 -16.271 -8.434 -4.818
527 HE2 LYS 29 HE3 LYS 29 -15.640 -8.423 -2.448
528 HE3 LYS 29 HE2 LYS 29 -17.283 -8.885 -2.013
529 HZ1 LYS 29 HZ1 LYS 29 -17.006 -10.947 -3.195
530 HZ2 LYS 29 HZ2 LYS 29 -15.753 -10.776 -2.074
531 HZ3 LYS 29 HZ3 LYS 29 -15.460 -10.497 -3.714
532 H LEU 30 H LEU 30 -18.240 -4.156 -2.562
533 HA LEU 30 HA LEU 30 -20.956 -4.857 -1.970
534 HB2 LEU 30 HB3 LEU 30 -18.636 -3.846 -0.459
535 HB3 LEU 30 HB2 LEU 30 -20.204 -3.381 0.170
536 HG LEU 30 HG LEU 30 -20.848 -5.729 0.373
537 HD11 LEU 30 HD11 LEU 30 -18.078 -6.338 -0.640
538 HD12 LEU 30 HD12 LEU 30 -19.589 -6.650 -1.492
539 HD13 LEU 30 HD13 LEU 30 -19.225 -7.514 0.001
540 HD21 LEU 30 HD21 LEU 30 -19.254 -6.377 2.136
541 HD22 LEU 30 HD22 LEU 30 -19.779 -4.700 2.270
542 HD23 LEU 30 HD23 LEU 30 -18.185 -5.075 1.616
543 H VAL 31 H VAL 31 -19.238 -1.891 -2.708
544 HA VAL 31 HA VAL 31 -21.535 -0.213 -2.248
545 HB VAL 31 HB VAL 31 -19.044 0.417 -3.858
546 HG11 VAL 31 HG11 VAL 31 -20.971 1.904 -4.285
547 HG12 VAL 31 HG12 VAL 31 -19.623 2.736 -3.512
548 HG13 VAL 31 HG13 VAL 31 -21.035 2.277 -2.560
549 HG21 VAL 31 HG21 VAL 31 -18.445 -0.192 -1.588
550 HG22 VAL 31 HG22 VAL 31 -19.641 0.936 -0.949
551 HG23 VAL 31 HG23 VAL 31 -18.240 1.543 -1.832
552 H GLY 32 H GLY 32 -20.281 -2.159 -4.802
553 HA2 GLY 32 HA3 GLY 32 -21.830 -0.930 -6.899
554 HA3 GLY 32 HA2 GLY 32 -20.917 -2.428 -7.013
555 H GLU 33 H GLU 33 -21.957 -4.086 -5.253
556 HA GLU 33 HA GLU 33 -24.801 -4.240 -6.006
557 HB2 GLU 33 HB3 GLU 33 -22.902 -6.494 -5.329
558 HB3 GLU 33 HB2 GLU 33 -24.588 -6.674 -5.787
559 HG2 GLU 33 HG3 GLU 33 -24.067 -5.703 -7.986
560 HG3 GLU 33 HG2 GLU 33 -22.370 -5.609 -7.518
Start of MODEL 13
1 H1 GLY 1 H1 GLY 1 23.098 8.415 -5.086
2 H2 GLY 1 H2 GLY 1 24.251 7.204 -5.316
3 H3 GLY 1 H3 GLY 1 24.631 8.564 -4.392
4 HA2 GLY 1 HA2 GLY 1 24.221 6.671 -2.966
5 HA3 GLY 1 HA3 GLY 1 23.026 7.937 -2.718
6 H SER 2 H SER 2 23.545 4.669 -3.528
7 HA SER 2 HA SER 2 21.038 4.254 -4.879
8 HB2 SER 2 HB3 SER 2 22.881 2.195 -3.638
9 HB3 SER 2 HB2 SER 2 21.615 1.896 -4.828
10 HG SER 2 HG SER 2 22.987 3.611 -6.045
11 H MET 3 H MET 3 22.326 3.841 -1.640
12 HA MET 3 HA MET 3 20.127 2.508 -0.500
13 HB2 MET 3 HB3 MET 3 22.283 2.587 0.608
14 HB3 MET 3 HB2 MET 3 22.189 4.334 0.741
15 HG2 MET 3 HG3 MET 3 21.714 3.255 2.865
16 HG3 MET 3 HG2 MET 3 20.308 4.135 2.269
17 HE1 MET 3 HE1 MET 3 21.599 0.623 0.977
18 HE2 MET 3 HE2 MET 3 20.729 -0.460 2.065
19 HE3 MET 3 HE3 MET 3 21.974 0.614 2.700
20 H LYS 4 H LYS 4 20.840 5.918 -0.992
21 HA LYS 4 HA LYS 4 18.662 6.972 0.462
22 HB2 LYS 4 HB3 LYS 4 20.216 8.060 -1.885
23 HB3 LYS 4 HB2 LYS 4 18.938 8.965 -1.090
24 HG2 LYS 4 HG3 LYS 4 20.189 8.883 1.010
25 HG3 LYS 4 HG2 LYS 4 21.472 7.986 0.209
26 HD2 LYS 4 HD3 LYS 4 22.107 10.299 0.334
27 HD3 LYS 4 HD2 LYS 4 21.769 9.892 -1.349
28 HE2 LYS 4 HE3 LYS 4 20.817 12.054 -0.786
29 HE3 LYS 4 HE2 LYS 4 19.541 10.892 -1.134
30 HZ1 LYS 4 HZ1 LYS 4 19.196 10.609 1.237
31 HZ2 LYS 4 HZ2 LYS 4 19.037 12.237 0.816
32 HZ3 LYS 4 HZ3 LYS 4 20.444 11.696 1.579
33 H GLN 5 H GLN 5 19.013 5.942 -2.894
34 HA GLN 5 HA GLN 5 16.460 6.752 -3.769
35 HB2 GLN 5 HB3 GLN 5 18.320 4.615 -4.805
36 HB3 GLN 5 HB2 GLN 5 16.833 5.089 -5.615
37 HG2 GLN 5 HG3 GLN 5 17.693 7.378 -5.822
38 HG3 GLN 5 HG2 GLN 5 19.197 6.864 -5.059
39 HE21 GLN 5 HE21 GLN 5 20.409 7.418 -6.860
40 HE22 GLN 5 HE22 GLN 5 20.376 6.485 -8.317
41 H LEU 6 H LEU 6 17.619 3.775 -2.277
42 HA LEU 6 HA LEU 6 15.199 2.330 -2.617
43 HB2 LEU 6 HB3 LEU 6 17.671 1.990 -1.015
44 HB3 LEU 6 HB2 LEU 6 16.249 1.134 -0.459
45 HG LEU 6 HG LEU 6 17.651 -0.289 -1.863
46 HD11 LEU 6 HD11 LEU 6 15.218 -0.621 -1.844
47 HD12 LEU 6 HD12 LEU 6 15.945 -1.082 -3.380
48 HD13 LEU 6 HD13 LEU 6 15.073 0.442 -3.242
49 HD21 LEU 6 HD21 LEU 6 18.658 1.428 -3.267
50 HD22 LEU 6 HD22 LEU 6 17.100 1.723 -4.040
51 HD23 LEU 6 HD23 LEU 6 17.908 0.168 -4.248
52 H GLU 7 H GLU 7 16.484 4.312 0.027
53 HA GLU 7 HA GLU 7 14.377 3.943 1.827
54 HB2 GLU 7 HB3 GLU 7 16.655 5.054 2.207
55 HB3 GLU 7 HB2 GLU 7 15.931 6.508 1.534
56 HG2 GLU 7 HG3 GLU 7 14.228 6.472 3.277
57 HG3 GLU 7 HG2 GLU 7 14.954 5.010 3.940
58 H ASP 8 H ASP 8 14.775 6.137 -0.893
59 HA ASP 8 HA ASP 8 12.333 7.562 -0.367
60 HB2 ASP 8 HB3 ASP 8 14.303 7.542 -2.628
61 HB3 ASP 8 HB2 ASP 8 12.731 8.304 -2.841
62 H LYS 9 H LYS 9 13.282 4.761 -2.211
63 HA LYS 9 HA LYS 9 10.942 4.627 -3.822
64 HB2 LYS 9 HB3 LYS 9 13.125 3.486 -4.335
65 HB3 LYS 9 HB2 LYS 9 12.762 2.341 -3.049
66 HG2 LYS 9 HG3 LYS 9 10.697 1.710 -4.254
67 HG3 LYS 9 HG2 LYS 9 11.175 2.781 -5.568
68 HD2 LYS 9 HD3 LYS 9 13.202 1.481 -5.922
69 HD3 LYS 9 HD2 LYS 9 12.778 0.425 -4.572
70 HE2 LYS 9 HE3 LYS 9 10.789 -0.318 -5.746
71 HE3 LYS 9 HE2 LYS 9 11.128 0.794 -7.069
72 HZ1 LYS 9 HZ1 LYS 9 12.836 -1.497 -6.260
73 HZ2 LYS 9 HZ2 LYS 9 13.156 -0.432 -7.533
74 HZ3 LYS 9 HZ3 LYS 9 11.813 -1.455 -7.606
75 H VAL 10 H VAL 10 11.913 3.048 -0.786
76 HA VAL 10 HA VAL 10 9.548 1.520 -0.507
77 HB VAL 10 HB VAL 10 11.596 0.996 0.744
78 HG11 VAL 10 HG11 VAL 10 10.974 3.458 2.365
79 HG12 VAL 10 HG12 VAL 10 12.341 3.252 1.269
80 HG13 VAL 10 HG13 VAL 10 12.224 2.267 2.728
81 HG21 VAL 10 HG21 VAL 10 9.176 1.561 2.440
82 HG22 VAL 10 HG22 VAL 10 10.534 0.556 2.939
83 HG23 VAL 10 HG23 VAL 10 9.542 0.076 1.562
84 H GLU 11 H GLU 11 10.372 4.817 0.374
85 HA GLU 11 HA GLU 11 7.967 5.294 1.868
86 HB2 GLU 11 HB3 GLU 11 10.256 6.611 1.827
87 HB3 GLU 11 HB2 GLU 11 9.513 7.474 0.494
88 HG2 GLU 11 HG3 GLU 11 8.306 7.242 3.240
89 HG3 GLU 11 HG2 GLU 11 9.298 8.592 2.702
90 H GLU 12 H GLU 12 9.051 5.773 -1.465
91 HA GLU 12 HA GLU 12 6.809 6.998 -2.545
92 HB2 GLU 12 HB3 GLU 12 9.032 6.427 -3.665
93 HB3 GLU 12 HB2 GLU 12 8.370 4.825 -3.944
94 HG2 GLU 12 HG3 GLU 12 6.995 7.311 -4.907
95 HG3 GLU 12 HG2 GLU 12 8.245 6.506 -5.846
96 H LEU 13 H LEU 13 7.387 3.489 -2.079
97 HA LEU 13 HA LEU 13 4.747 2.827 -2.911
98 HB2 LEU 13 HB3 LEU 13 6.870 1.243 -1.517
99 HB3 LEU 13 HB2 LEU 13 5.233 0.630 -1.631
100 HG LEU 13 HG LEU 13 5.426 1.060 -4.143
101 HD11 LEU 13 HD11 LEU 13 7.698 0.941 -5.049
102 HD12 LEU 13 HD12 LEU 13 8.351 1.077 -3.416
103 HD13 LEU 13 HD13 LEU 13 7.436 2.413 -4.117
104 HD21 LEU 13 HD21 LEU 13 6.501 -1.122 -4.485
105 HD22 LEU 13 HD22 LEU 13 5.340 -1.153 -3.158
106 HD23 LEU 13 HD23 LEU 13 7.069 -1.093 -2.816
107 H LEU 14 H LEU 14 5.862 4.195 -0.008
108 HA LEU 14 HA LEU 14 3.715 3.181 1.604
109 HB2 LEU 14 HB3 LEU 14 5.979 4.175 2.396
110 HB3 LEU 14 HB2 LEU 14 5.214 5.730 2.144
111 HG LEU 14 HG LEU 14 3.352 4.492 3.692
112 HD11 LEU 14 HD11 LEU 14 4.707 3.521 5.586
113 HD12 LEU 14 HD12 LEU 14 6.054 3.424 4.446
114 HD13 LEU 14 HD13 LEU 14 4.569 2.519 4.144
115 HD21 LEU 14 HD21 LEU 14 4.245 5.819 5.532
116 HD22 LEU 14 HD22 LEU 14 4.225 6.733 4.022
117 HD23 LEU 14 HD23 LEU 14 5.740 6.064 4.630
118 H SER 15 H SER 15 4.371 6.049 -0.344
119 HA SER 15 HA SER 15 1.801 7.197 0.131
120 HB2 SER 15 HB3 SER 15 2.456 8.471 -2.066
121 HB3 SER 15 HB2 SER 15 3.328 8.799 -0.569
122 HG SER 15 HG SER 15 4.141 7.282 -2.808
123 H LYS 16 H LYS 16 3.146 4.901 -2.188
124 HA LYS 16 HA LYS 16 0.953 4.551 -3.863
125 HB2 LYS 16 HB3 LYS 16 3.058 3.362 -4.180
126 HB3 LYS 16 HB2 LYS 16 2.819 2.483 -2.679
127 HG2 LYS 16 HG3 LYS 16 0.850 1.383 -3.663
128 HG3 LYS 16 HG2 LYS 16 1.169 2.224 -5.183
129 HD2 LYS 16 HD3 LYS 16 3.270 1.106 -5.440
130 HD3 LYS 16 HD2 LYS 16 3.168 0.427 -3.817
131 HE2 LYS 16 HE3 LYS 16 2.635 -1.265 -5.474
132 HE3 LYS 16 HE2 LYS 16 1.214 -0.890 -4.500
133 HZ1 LYS 16 HZ1 LYS 16 0.367 0.472 -6.278
134 HZ2 LYS 16 HZ2 LYS 16 0.704 -1.074 -6.868
135 HZ3 LYS 16 HZ3 LYS 16 1.755 0.205 -7.205
136 H ASN 17 H ASN 17 1.577 3.099 -0.667
137 HA ASN 17 HA ASN 17 -0.879 1.787 -0.356
138 HB2 ASN 17 HB3 ASN 17 1.161 2.838 1.572
139 HB3 ASN 17 HB2 ASN 17 -0.382 2.249 2.177
140 HD21 ASN 17 HD21 ASN 17 2.656 1.406 0.780
141 HD22 ASN 17 HD22 ASN 17 2.478 -0.308 0.928
142 H TYR 18 H TYR 18 0.127 5.059 0.576
143 HA TYR 18 HA TYR 18 -2.183 5.855 1.887
144 HB2 TYR 18 HB3 TYR 18 -0.108 7.168 1.882
145 HB3 TYR 18 HB2 TYR 18 -0.358 7.562 0.185
146 HD1 TYR 18 HD1 TYR 18 -1.605 9.452 -0.418
147 HD2 TYR 18 HD2 TYR 18 -1.896 7.945 3.550
148 HE1 TYR 18 HE1 TYR 18 -2.925 11.423 0.228
149 HE2 TYR 18 HE2 TYR 18 -3.215 9.913 4.207
150 HH TYR 18 HH TYR 18 -3.564 12.235 3.457
151 H HIS 19 H HIS 19 -1.461 5.976 -1.589
152 HA HIS 19 HA HIS 19 -3.846 7.317 -2.341
153 HB2 HIS 19 HB3 HIS 19 -2.151 5.410 -3.973
154 HB3 HIS 19 HB2 HIS 19 -3.380 6.487 -4.620
155 HD1 HIS 19 HD1 HIS 19 -0.257 6.492 -5.316
156 HD2 HIS 19 HD2 HIS 19 -2.250 9.131 -2.800
157 HE1 HIS 19 HE1 HIS 19 1.157 8.569 -5.256
158 HE2 HIS 19 HE2 HIS 19 0.003 10.099 -3.625
159 H LEU 20 H LEU 20 -2.970 3.923 -2.067
160 HA LEU 20 HA LEU 20 -5.398 2.874 -3.048
161 HB2 LEU 20 HB3 LEU 20 -3.233 1.690 -2.994
162 HB3 LEU 20 HB2 LEU 20 -3.308 1.657 -1.245
163 HG LEU 20 HG LEU 20 -5.323 0.257 -1.383
164 HD11 LEU 20 HD11 LEU 20 -5.900 -0.792 -3.530
165 HD12 LEU 20 HD12 LEU 20 -4.745 0.264 -4.340
166 HD13 LEU 20 HD13 LEU 20 -6.164 0.951 -3.550
167 HD21 LEU 20 HD21 LEU 20 -3.106 -0.734 -1.127
168 HD22 LEU 20 HD22 LEU 20 -2.934 -0.806 -2.880
169 HD23 LEU 20 HD23 LEU 20 -4.164 -1.776 -2.073
170 H GLU 21 H GLU 21 -4.208 3.810 0.112
171 HA GLU 21 HA GLU 21 -6.318 2.789 1.682
172 HB2 GLU 21 HB3 GLU 21 -4.161 3.597 2.594
173 HB3 GLU 21 HB2 GLU 21 -4.609 5.241 2.165
174 HG2 GLU 21 HG3 GLU 21 -6.523 5.094 3.697
175 HG3 GLU 21 HG2 GLU 21 -6.005 3.474 4.158
176 H ASN 22 H ASN 22 -5.910 5.803 -0.098
177 HA ASN 22 HA ASN 22 -8.238 7.109 0.759
178 HB2 ASN 22 HB3 ASN 22 -6.752 7.247 -1.865
179 HB3 ASN 22 HB2 ASN 22 -8.130 8.277 -1.489
180 HD21 ASN 22 HD21 ASN 22 -5.415 9.054 -2.056
181 HD22 ASN 22 HD22 ASN 22 -4.849 9.916 -0.671
182 H GLU 23 H GLU 23 -7.706 4.544 -1.516
183 HA GLU 23 HA GLU 23 -10.288 4.665 -2.741
184 HB2 GLU 23 HB3 GLU 23 -8.274 2.403 -2.679
185 HB3 GLU 23 HB2 GLU 23 -9.689 2.508 -3.748
186 HG2 GLU 23 HG3 GLU 23 -7.307 4.359 -3.735
187 HG3 GLU 23 HG2 GLU 23 -7.666 3.114 -4.931
188 H VAL 24 H VAL 24 -8.865 2.914 -0.036
189 HA VAL 24 HA VAL 24 -11.094 1.209 0.417
190 HB VAL 24 HB VAL 24 -9.164 2.182 2.533
191 HG11 VAL 24 HG11 VAL 24 -11.132 0.999 3.372
192 HG12 VAL 24 HG12 VAL 24 -9.664 0.054 3.620
193 HG13 VAL 24 HG13 VAL 24 -10.773 -0.367 2.313
194 HG21 VAL 24 HG21 VAL 24 -8.840 -0.197 0.713
195 HG22 VAL 24 HG22 VAL 24 -7.765 0.268 2.030
196 HG23 VAL 24 HG23 VAL 24 -7.916 1.300 0.610
197 H ALA 25 H ALA 25 -10.187 4.428 1.485
198 HA ALA 25 HA ALA 25 -12.140 4.688 3.515
199 HB1 ALA 25 HB1 ALA 25 -10.084 6.074 3.322
200 HB2 ALA 25 HB2 ALA 25 -11.559 6.998 3.597
201 HB3 ALA 25 HB3 ALA 25 -10.852 6.933 1.985
202 H ARG 26 H ARG 26 -12.171 5.590 0.069
203 HA ARG 26 HA ARG 26 -14.599 7.007 0.176
204 HB2 ARG 26 HB3 ARG 26 -14.710 6.464 -2.306
205 HB3 ARG 26 HB2 ARG 26 -13.339 7.403 -1.758
206 HG2 ARG 26 HG3 ARG 26 -11.913 5.479 -1.904
207 HG3 ARG 26 HG2 ARG 26 -13.281 4.432 -2.276
208 HD2 ARG 26 HD2 ARG 26 -12.089 4.935 -4.297
209 HD3 ARG 26 HD1 ARG 26 -13.667 5.713 -4.340
210 HE ARG 26 HE ARG 26 -11.749 7.518 -3.335
211 HH11 ARG 26 HH11 ARG 26 -12.685 5.933 -6.313
212 HH12 ARG 26 HH12 ARG 26 -12.097 7.211 -7.328
213 HH21 ARG 26 HH21 ARG 26 -10.962 9.203 -4.679
214 HH22 ARG 26 HH22 ARG 26 -11.120 9.066 -6.404
215 H LEU 27 H LEU 27 -13.888 3.609 -0.452
216 HA LEU 27 HA LEU 27 -16.593 2.898 -0.969
217 HB2 LEU 27 HB3 LEU 27 -14.286 1.173 -0.104
218 HB3 LEU 27 HB2 LEU 27 -15.821 0.613 -0.729
219 HG LEU 27 HG LEU 27 -14.101 2.409 -2.364
220 HD11 LEU 27 HD11 LEU 27 -13.976 -0.589 -2.284
221 HD12 LEU 27 HD12 LEU 27 -12.747 0.505 -1.647
222 HD13 LEU 27 HD13 LEU 27 -13.088 0.476 -3.378
223 HD21 LEU 27 HD21 LEU 27 -15.298 1.176 -4.183
224 HD22 LEU 27 HD22 LEU 27 -16.340 2.158 -3.153
225 HD23 LEU 27 HD23 LEU 27 -16.273 0.409 -2.927
226 H LYS 28 H LYS 28 -14.546 2.741 1.915
227 HA LYS 28 HA LYS 28 -16.157 1.359 3.642
228 HB2 LYS 28 HB3 LYS 28 -13.884 2.226 4.150
229 HB3 LYS 28 HB2 LYS 28 -14.570 3.832 4.343
230 HG2 LYS 28 HG3 LYS 28 -14.228 2.832 6.501
231 HG3 LYS 28 HG2 LYS 28 -15.958 2.991 6.196
232 HD2 LYS 28 HD3 LYS 28 -16.058 0.630 5.556
233 HD3 LYS 28 HD2 LYS 28 -14.326 0.474 5.854
234 HE2 LYS 28 HE3 LYS 28 -14.677 1.047 8.202
235 HE3 LYS 28 HE2 LYS 28 -16.404 1.226 7.906
236 HZ1 LYS 28 HZ1 LYS 28 -14.859 -1.288 7.567
237 HZ2 LYS 28 HZ2 LYS 28 -16.530 -1.107 7.347
238 HZ3 LYS 28 HZ3 LYS 28 -15.854 -0.920 8.884
239 H LYS 29 H LYS 29 -16.349 4.847 2.929
240 HA LYS 29 HA LYS 29 -18.568 5.227 4.688
241 HB2 LYS 29 HB3 LYS 29 -18.641 7.490 3.723
242 HB3 LYS 29 HB2 LYS 29 -17.052 7.055 4.318
243 HG2 LYS 29 HG3 LYS 29 -16.328 6.589 2.033
244 HG3 LYS 29 HG2 LYS 29 -17.928 7.031 1.440
245 HD2 LYS 29 HD3 LYS 29 -16.408 8.888 1.150
246 HD3 LYS 29 HD2 LYS 29 -17.615 9.295 2.369
247 HE2 LYS 29 HE3 LYS 29 -16.004 8.751 4.135
248 HE3 LYS 29 HE2 LYS 29 -14.801 8.354 2.908
249 HZ1 LYS 29 HZ1 LYS 29 -14.892 10.634 2.133
250 HZ2 LYS 29 HZ2 LYS 29 -14.490 10.585 3.771
251 HZ3 LYS 29 HZ3 LYS 29 -16.054 11.016 3.299
252 H LEU 30 H LEU 30 -18.213 4.353 1.351
253 HA LEU 30 HA LEU 30 -20.899 5.030 0.613
254 HB2 LEU 30 HB3 LEU 30 -18.602 3.706 -0.674
255 HB3 LEU 30 HB2 LEU 30 -20.178 3.175 -1.226
256 HG LEU 30 HG LEU 30 -20.762 5.429 -1.897
257 HD11 LEU 30 HD11 LEU 30 -19.601 6.678 -0.159
258 HD12 LEU 30 HD12 LEU 30 -19.168 7.269 -1.763
259 HD13 LEU 30 HD13 LEU 30 -18.049 6.240 -0.870
260 HD21 LEU 30 HD21 LEU 30 -18.031 4.603 -2.866
261 HD22 LEU 30 HD22 LEU 30 -19.091 5.760 -3.669
262 HD23 LEU 30 HD23 LEU 30 -19.584 4.077 -3.515
263 H VAL 31 H VAL 31 -19.268 2.159 1.831
264 HA VAL 31 HA VAL 31 -21.596 0.493 1.620
265 HB VAL 31 HB VAL 31 -19.172 0.072 3.394
266 HG11 VAL 31 HG11 VAL 31 -21.158 -1.264 3.994
267 HG12 VAL 31 HG12 VAL 31 -19.818 -2.253 3.413
268 HG13 VAL 31 HG13 VAL 31 -21.187 -1.916 2.354
269 HG21 VAL 31 HG21 VAL 31 -19.705 -0.910 0.595
270 HG22 VAL 31 HG22 VAL 31 -18.343 -1.383 1.609
271 HG23 VAL 31 HG23 VAL 31 -18.499 0.287 1.066
272 H GLY 32 H GLY 32 -20.310 2.736 3.950
273 HA2 GLY 32 HA3 GLY 32 -22.017 1.843 6.104
274 HA3 GLY 32 HA2 GLY 32 -20.972 3.257 6.112
275 H GLU 33 H GLU 33 -21.820 4.740 4.061
276 HA GLU 33 HA GLU 33 -23.377 6.188 3.310
277 HB2 GLU 33 HB3 GLU 33 -24.636 4.119 2.720
278 HB3 GLU 33 HB2 GLU 33 -25.434 4.197 4.282
279 HG2 GLU 33 HG3 GLU 33 -26.484 6.277 3.694
280 HG3 GLU 33 HG2 GLU 33 -25.590 6.340 2.176
281 H1 GLY 1 H1 GLY 1 23.103 -8.647 4.340
282 H2 GLY 1 H2 GLY 1 24.265 -7.445 4.593
283 H3 GLY 1 H3 GLY 1 24.636 -8.794 3.644
284 HA2 GLY 1 HA2 GLY 1 24.234 -6.865 2.258
285 HA3 GLY 1 HA3 GLY 1 23.042 -8.127 1.981
286 H SER 2 H SER 2 23.550 -4.878 2.842
287 HA SER 2 HA SER 2 21.049 -4.480 4.205
288 HB2 SER 2 HB3 SER 2 22.887 -2.412 2.975
289 HB3 SER 2 HB2 SER 2 21.646 -2.130 4.194
290 HG SER 2 HG SER 2 22.959 -3.787 5.435
291 H MET 3 H MET 3 22.325 -4.027 0.962
292 HA MET 3 HA MET 3 20.123 -2.675 -0.152
293 HB2 MET 3 HB3 MET 3 22.272 -2.741 -1.272
294 HB3 MET 3 HB2 MET 3 22.181 -4.487 -1.421
295 HG2 MET 3 HG3 MET 3 21.698 -3.392 -3.533
296 HG3 MET 3 HG2 MET 3 20.294 -4.275 -2.942
297 HE1 MET 3 HE1 MET 3 21.583 -0.784 -1.612
298 HE2 MET 3 HE2 MET 3 20.716 0.318 -2.680
299 HE3 MET 3 HE3 MET 3 21.962 -0.744 -3.334
300 H LYS 4 H LYS 4 20.834 -6.093 0.293
301 HA LYS 4 HA LYS 4 18.646 -7.126 -1.161
302 HB2 LYS 4 HB3 LYS 4 20.217 -8.246 1.160
303 HB3 LYS 4 HB2 LYS 4 18.933 -9.140 0.364
304 HG2 LYS 4 HG3 LYS 4 20.168 -9.037 -1.743
305 HG3 LYS 4 HG2 LYS 4 21.459 -8.146 -0.943
306 HD2 LYS 4 HD3 LYS 4 22.097 -10.457 -1.092
307 HD3 LYS 4 HD2 LYS 4 21.765 -10.070 0.596
308 HE2 LYS 4 HE3 LYS 4 20.810 -12.226 0.015
309 HE3 LYS 4 HE2 LYS 4 19.535 -11.068 0.378
310 HZ1 LYS 4 HZ1 LYS 4 19.183 -10.758 -1.985
311 HZ2 LYS 4 HZ2 LYS 4 19.024 -12.390 -1.583
312 HZ3 LYS 4 HZ3 LYS 4 20.427 -11.839 -2.345
313 H GLN 5 H GLN 5 19.017 -6.125 2.204
314 HA GLN 5 HA GLN 5 16.470 -6.958 3.081
315 HB2 GLN 5 HB3 GLN 5 18.337 -4.836 4.136
316 HB3 GLN 5 HB2 GLN 5 16.853 -5.317 4.946
317 HG2 GLN 5 HG3 GLN 5 17.713 -7.612 5.121
318 HG3 GLN 5 HG2 GLN 5 19.217 -7.087 4.363
319 HE21 GLN 5 HE21 GLN 5 20.428 -7.658 6.162
320 HE22 GLN 5 HE22 GLN 5 20.398 -6.734 7.623
321 H LEU 6 H LEU 6 17.624 -3.960 1.627
322 HA LEU 6 HA LEU 6 15.205 -2.523 1.989
323 HB2 LEU 6 HB3 LEU 6 17.670 -2.164 0.378
324 HB3 LEU 6 HB2 LEU 6 16.245 -1.298 -0.155
325 HG LEU 6 HG LEU 6 17.663 0.101 1.260
326 HD11 LEU 6 HD11 LEU 6 15.231 0.446 1.256
327 HD12 LEU 6 HD12 LEU 6 15.967 0.881 2.797
328 HD13 LEU 6 HD13 LEU 6 15.087 -0.638 2.639
329 HD21 LEU 6 HD21 LEU 6 18.669 -1.637 2.637
330 HD22 LEU 6 HD22 LEU 6 17.114 -1.938 3.410
331 HD23 LEU 6 HD23 LEU 6 17.926 -0.391 3.638
332 H GLU 7 H GLU 7 16.480 -4.473 -0.683
333 HA GLU 7 HA GLU 7 14.366 -4.077 -2.470
334 HB2 GLU 7 HB3 GLU 7 16.640 -5.186 -2.872
335 HB3 GLU 7 HB2 GLU 7 15.917 -6.646 -2.211
336 HG2 GLU 7 HG3 GLU 7 14.207 -6.589 -3.950
337 HG3 GLU 7 HG2 GLU 7 14.938 -5.124 -4.601
338 H ASP 8 H ASP 8 14.772 -6.308 0.218
339 HA ASP 8 HA ASP 8 12.324 -7.722 -0.315
340 HB2 ASP 8 HB3 ASP 8 14.307 -7.735 1.934
341 HB3 ASP 8 HB2 ASP 8 12.735 -8.498 2.148
342 H LYS 9 H LYS 9 13.282 -4.943 1.558
343 HA LYS 9 HA LYS 9 10.950 -4.828 3.183
344 HB2 LYS 9 HB3 LYS 9 13.134 -3.694 3.701
345 HB3 LYS 9 HB2 LYS 9 12.770 -2.536 2.429
346 HG2 LYS 9 HG3 LYS 9 10.712 -1.909 3.646
347 HG3 LYS 9 HG2 LYS 9 11.186 -3.001 4.946
348 HD2 LYS 9 HD3 LYS 9 13.221 -1.714 5.313
349 HD3 LYS 9 HD2 LYS 9 12.797 -0.638 3.979
350 HE2 LYS 9 HE3 LYS 9 10.816 0.097 5.167
351 HE3 LYS 9 HE2 LYS 9 11.152 -1.035 6.475
352 HZ1 LYS 9 HZ1 LYS 9 12.865 1.258 5.691
353 HZ2 LYS 9 HZ2 LYS 9 13.191 0.173 6.944
354 HZ3 LYS 9 HZ3 LYS 9 11.853 1.199 7.044
355 H VAL 10 H VAL 10 11.911 -3.211 0.164
356 HA VAL 10 HA VAL 10 9.546 -1.682 -0.088
357 HB VAL 10 HB VAL 10 11.587 -1.140 -1.340
358 HG11 VAL 10 HG11 VAL 10 10.963 -3.584 -2.983
359 HG12 VAL 10 HG12 VAL 10 12.332 -3.391 -1.890
360 HG13 VAL 10 HG13 VAL 10 12.212 -2.390 -3.338
361 HG21 VAL 10 HG21 VAL 10 9.161 -1.694 -3.029
362 HG22 VAL 10 HG22 VAL 10 10.516 -0.687 -3.527
363 HG23 VAL 10 HG23 VAL 10 9.532 -0.216 -2.142
364 H GLU 11 H GLU 11 10.368 -4.964 -1.023
365 HA GLU 11 HA GLU 11 7.954 -5.422 -2.505
366 HB2 GLU 11 HB3 GLU 11 10.244 -6.739 -2.495
367 HB3 GLU 11 HB2 GLU 11 9.506 -7.623 -1.169
368 HG2 GLU 11 HG3 GLU 11 8.287 -7.348 -3.907
369 HG3 GLU 11 HG2 GLU 11 9.276 -8.707 -3.390
370 H GLU 12 H GLU 12 9.053 -5.945 0.819
371 HA GLU 12 HA GLU 12 6.813 -7.182 1.891
372 HB2 GLU 12 HB3 GLU 12 9.039 -6.624 3.012
373 HB3 GLU 12 HB2 GLU 12 8.378 -5.026 3.310
374 HG2 GLU 12 HG3 GLU 12 7.002 -7.519 4.252
375 HG3 GLU 12 HG2 GLU 12 8.263 -6.729 5.193
376 H LEU 13 H LEU 13 7.393 -3.666 1.469
377 HA LEU 13 HA LEU 13 4.754 -3.016 2.316
378 HB2 LEU 13 HB3 LEU 13 6.871 -1.413 0.932
379 HB3 LEU 13 HB2 LEU 13 5.235 -0.802 1.060
380 HG LEU 13 HG LEU 13 5.437 -1.261 3.568
381 HD11 LEU 13 HD11 LEU 13 7.711 -1.154 4.467
382 HD12 LEU 13 HD12 LEU 13 8.360 -1.266 2.830
383 HD13 LEU 13 HD13 LEU 13 7.450 -2.614 3.513
384 HD21 LEU 13 HD21 LEU 13 6.518 0.915 3.932
385 HD22 LEU 13 HD22 LEU 13 5.353 0.966 2.609
386 HD23 LEU 13 HD23 LEU 13 7.081 0.906 2.262
387 H LEU 14 H LEU 14 5.856 -4.348 -0.607
388 HA LEU 14 HA LEU 14 3.705 -3.312 -2.199
389 HB2 LEU 14 HB3 LEU 14 5.965 -4.296 -3.012
390 HB3 LEU 14 HB2 LEU 14 5.204 -5.856 -2.772
391 HG LEU 14 HG LEU 14 3.334 -4.608 -4.303
392 HD11 LEU 14 HD11 LEU 14 4.677 -3.607 -6.188
393 HD12 LEU 14 HD12 LEU 14 6.028 -3.516 -5.053
394 HD13 LEU 14 HD13 LEU 14 4.539 -2.625 -4.733
395 HD21 LEU 14 HD21 LEU 14 4.230 -5.911 -6.160
396 HD22 LEU 14 HD22 LEU 14 4.218 -6.841 -4.663
397 HD23 LEU 14 HD23 LEU 14 5.729 -6.160 -5.266
398 H SER 15 H SER 15 4.365 -6.201 -0.287
399 HA SER 15 HA SER 15 1.793 -7.341 -0.766
400 HB2 SER 15 HB3 SER 15 2.453 -8.654 1.405
401 HB3 SER 15 HB2 SER 15 3.318 -8.956 -0.099
402 HG SER 15 HG SER 15 4.136 -7.426 2.136
403 H LYS 16 H LYS 16 3.149 -5.077 1.580
404 HA LYS 16 HA LYS 16 0.960 -4.745 3.259
405 HB2 LYS 16 HB3 LYS 16 3.069 -3.563 3.586
406 HB3 LYS 16 HB2 LYS 16 2.825 -2.665 2.098
407 HG2 LYS 16 HG3 LYS 16 0.862 -1.574 3.105
408 HG3 LYS 16 HG2 LYS 16 1.186 -2.435 4.612
409 HD2 LYS 16 HD3 LYS 16 3.287 -1.322 4.876
410 HD3 LYS 16 HD2 LYS 16 3.184 -0.624 3.260
411 HE2 LYS 16 HE3 LYS 16 2.660 1.059 4.931
412 HE3 LYS 16 HE2 LYS 16 1.231 0.685 3.967
413 HZ1 LYS 16 HZ1 LYS 16 0.390 -0.680 5.740
414 HZ2 LYS 16 HZ2 LYS 16 0.756 0.854 6.348
415 HZ3 LYS 16 HZ3 LYS 16 1.794 -0.442 6.654
416 H ASN 17 H ASN 17 1.578 -3.246 0.082
417 HA ASN 17 HA ASN 17 -0.881 -1.938 -0.203
418 HB2 ASN 17 HB3 ASN 17 1.150 -2.967 -2.154
419 HB3 ASN 17 HB2 ASN 17 -0.394 -2.365 -2.743
420 HD21 ASN 17 HD21 ASN 17 2.656 -1.550 -1.343
421 HD22 ASN 17 HD22 ASN 17 2.481 0.167 -1.472
422 H TYR 18 H TYR 18 0.121 -5.199 -1.171
423 HA TYR 18 HA TYR 18 -2.192 -5.975 -2.490
424 HB2 TYR 18 HB3 TYR 18 -0.120 -7.291 -2.510
425 HB3 TYR 18 HB2 TYR 18 -0.362 -7.706 -0.816
426 HD1 TYR 18 HD1 TYR 18 -1.616 -9.602 -0.232
427 HD2 TYR 18 HD2 TYR 18 -1.910 -8.045 -4.181
428 HE1 TYR 18 HE1 TYR 18 -2.948 -11.560 -0.902
429 HE2 TYR 18 HE2 TYR 18 -3.239 -10.000 -4.858
430 HH TYR 18 HH TYR 18 -3.582 -12.346 -4.128
431 H HIS 19 H HIS 19 -1.464 -6.132 0.985
432 HA HIS 19 HA HIS 19 -3.847 -7.490 1.725
433 HB2 HIS 19 HB3 HIS 19 -2.141 -5.610 3.375
434 HB3 HIS 19 HB2 HIS 19 -3.370 -6.694 4.013
435 HD1 HIS 19 HD1 HIS 19 -0.242 -6.715 4.687
436 HD2 HIS 19 HD2 HIS 19 -2.258 -9.318 2.149
437 HE1 HIS 19 HE1 HIS 19 1.165 -8.797 4.595
438 HE2 HIS 19 HE2 HIS 19 -0.019 -10.319 2.977
439 H LEU 20 H LEU 20 -2.969 -4.097 1.488
440 HA LEU 20 HA LEU 20 -5.393 -3.052 2.493
441 HB2 LEU 20 HB3 LEU 20 -3.225 -1.869 2.446
442 HB3 LEU 20 HB2 LEU 20 -3.303 -1.817 0.698
443 HG LEU 20 HG LEU 20 -5.321 -0.421 0.855
444 HD11 LEU 20 HD11 LEU 20 -5.886 0.610 3.018
445 HD12 LEU 20 HD12 LEU 20 -4.729 -0.459 3.810
446 HD13 LEU 20 HD13 LEU 20 -6.152 -1.133 3.019
447 HD21 LEU 20 HD21 LEU 20 -3.108 0.579 0.599
448 HD22 LEU 20 HD22 LEU 20 -2.927 0.630 2.351
449 HD23 LEU 20 HD23 LEU 20 -4.163 1.608 1.564
450 H GLU 21 H GLU 21 -4.213 -3.949 -0.686
451 HA GLU 21 HA GLU 21 -6.331 -2.912 -2.233
452 HB2 GLU 21 HB3 GLU 21 -4.178 -3.709 -3.164
453 HB3 GLU 21 HB2 GLU 21 -4.626 -5.358 -2.752
454 HG2 GLU 21 HG3 GLU 21 -6.545 -5.195 -4.277
455 HG3 GLU 21 HG2 GLU 21 -6.036 -3.566 -4.717
456 H ASN 22 H ASN 22 -5.916 -5.947 -0.490
457 HA ASN 22 HA ASN 22 -8.246 -7.243 -1.356
458 HB2 ASN 22 HB3 ASN 22 -6.754 -7.414 1.260
459 HB3 ASN 22 HB2 ASN 22 -8.134 -8.438 0.876
460 HD21 ASN 22 HD21 ASN 22 -5.430 -9.226 1.431
461 HD22 ASN 22 HD22 ASN 22 -4.861 -10.068 0.032
462 H GLU 23 H GLU 23 -7.703 -4.703 0.946
463 HA GLU 23 HA GLU 23 -10.280 -4.839 2.183
464 HB2 GLU 23 HB3 GLU 23 -8.268 -2.577 2.138
465 HB3 GLU 23 HB2 GLU 23 -9.679 -2.693 3.213
466 HG2 GLU 23 HG3 GLU 23 -7.299 -4.546 3.165
467 HG3 GLU 23 HG2 GLU 23 -7.648 -3.316 4.377
468 H VAL 24 H VAL 24 -8.868 -3.050 -0.503
469 HA VAL 24 HA VAL 24 -11.095 -1.342 -0.932
470 HB VAL 24 HB VAL 24 -9.174 -2.293 -3.065
471 HG11 VAL 24 HG11 VAL 24 -11.142 -1.104 -3.889
472 HG12 VAL 24 HG12 VAL 24 -9.675 -0.156 -4.130
473 HG13 VAL 24 HG13 VAL 24 -10.782 0.252 -2.817
474 HG21 VAL 24 HG21 VAL 24 -8.846 0.067 -1.223
475 HG22 VAL 24 HG22 VAL 24 -7.775 -0.382 -2.548
476 HG23 VAL 24 HG23 VAL 24 -7.919 -1.431 -1.138
477 H ALA 25 H ALA 25 -10.195 -4.545 -2.046
478 HA ALA 25 HA ALA 25 -12.159 -4.779 -4.065
479 HB1 ALA 25 HB1 ALA 25 -10.104 -6.170 -3.898
480 HB2 ALA 25 HB2 ALA 25 -11.582 -7.087 -4.179
481 HB3 ALA 25 HB3 ALA 25 -10.868 -7.044 -2.570
482 H ARG 26 H ARG 26 -12.180 -5.716 -0.628
483 HA ARG 26 HA ARG 26 -14.603 -7.138 -0.746
484 HB2 ARG 26 HB3 ARG 26 -14.708 -6.623 1.742
485 HB3 ARG 26 HB2 ARG 26 -13.340 -7.558 1.176
486 HG2 ARG 26 HG3 ARG 26 -11.909 -5.642 1.346
487 HG3 ARG 26 HG2 ARG 26 -13.271 -4.593 1.733
488 HD2 ARG 26 HD2 ARG 26 -12.079 -5.125 3.748
489 HD3 ARG 26 HD1 ARG 26 -13.657 -5.902 3.782
490 HE ARG 26 HE ARG 26 -11.747 -7.699 2.749
491 HH11 ARG 26 HH11 ARG 26 -12.690 -6.164 5.752
492 HH12 ARG 26 HH12 ARG 26 -12.088 -7.451 6.746
493 HH21 ARG 26 HH21 ARG 26 -10.948 -9.394 4.064
494 HH22 ARG 26 HH22 ARG 26 -11.096 -9.284 5.790
495 H LEU 27 H LEU 27 -13.891 -3.752 -0.079
496 HA LEU 27 HA LEU 27 -16.592 -3.043 0.459
497 HB2 LEU 27 HB3 LEU 27 -14.285 -1.312 -0.397
498 HB3 LEU 27 HB2 LEU 27 -15.816 -0.754 0.237
499 HG LEU 27 HG LEU 27 -14.097 -2.568 1.849
500 HD11 LEU 27 HD11 LEU 27 -13.966 0.428 1.803
501 HD12 LEU 27 HD12 LEU 27 -12.740 -0.656 1.145
502 HD13 LEU 27 HD13 LEU 27 -13.076 -0.651 2.879
503 HD21 LEU 27 HD21 LEU 27 -15.283 -1.348 3.680
504 HD22 LEU 27 HD22 LEU 27 -16.332 -2.317 2.644
505 HD23 LEU 27 HD23 LEU 27 -16.259 -0.564 2.435
506 H LYS 28 H LYS 28 -14.558 -2.851 -2.432
507 HA LYS 28 HA LYS 28 -16.179 -1.457 -4.139
508 HB2 LYS 28 HB3 LYS 28 -13.903 -2.310 -4.663
509 HB3 LYS 28 HB2 LYS 28 -14.586 -3.915 -4.875
510 HG2 LYS 28 HG3 LYS 28 -14.253 -2.891 -7.023
511 HG3 LYS 28 HG2 LYS 28 -15.982 -3.049 -6.712
512 HD2 LYS 28 HD3 LYS 28 -16.077 -0.695 -6.041
513 HD3 LYS 28 HD2 LYS 28 -14.346 -0.537 -6.347
514 HE2 LYS 28 HE3 LYS 28 -14.710 -1.081 -8.700
515 HE3 LYS 28 HE2 LYS 28 -16.437 -1.260 -8.396
516 HZ1 LYS 28 HZ1 LYS 28 -14.888 1.247 -8.033
517 HZ2 LYS 28 HZ2 LYS 28 -16.552 1.065 -7.803
518 HZ3 LYS 28 HZ3 LYS 28 -15.890 0.899 -9.349
519 H LYS 29 H LYS 29 -16.368 -4.948 -3.457
520 HA LYS 29 HA LYS 29 -18.586 -5.304 -5.225
521 HB2 LYS 29 HB3 LYS 29 -18.659 -7.580 -4.289
522 HB3 LYS 29 HB2 LYS 29 -17.069 -7.135 -4.881
523 HG2 LYS 29 HG3 LYS 29 -16.342 -6.698 -2.590
524 HG3 LYS 29 HG2 LYS 29 -17.943 -7.147 -2.000
525 HD2 LYS 29 HD3 LYS 29 -16.424 -9.007 -1.731
526 HD3 LYS 29 HD2 LYS 29 -17.630 -9.399 -2.957
527 HE2 LYS 29 HE3 LYS 29 -16.019 -8.831 -4.713
528 HE3 LYS 29 HE2 LYS 29 -14.815 -8.453 -3.483
529 HZ1 LYS 29 HZ1 LYS 29 -14.896 -10.746 -2.744
530 HZ2 LYS 29 HZ2 LYS 29 -14.515 -10.675 -4.390
531 HZ3 LYS 29 HZ3 LYS 29 -16.073 -11.109 -3.905
532 H LEU 30 H LEU 30 -18.226 -4.471 -1.879
533 HA LEU 30 HA LEU 30 -20.909 -5.152 -1.128
534 HB2 LEU 30 HB3 LEU 30 -18.601 -3.846 0.157
535 HB3 LEU 30 HB2 LEU 30 -20.173 -3.319 0.725
536 HG LEU 30 HG LEU 30 -20.754 -5.583 1.369
537 HD11 LEU 30 HD11 LEU 30 -19.597 -6.806 -0.389
538 HD12 LEU 30 HD12 LEU 30 -19.160 -7.420 1.204
539 HD13 LEU 30 HD13 LEU 30 -18.044 -6.377 0.323
540 HD21 LEU 30 HD21 LEU 30 -18.021 -4.770 2.340
541 HD22 LEU 30 HD22 LEU 30 -19.079 -5.937 3.131
542 HD23 LEU 30 HD23 LEU 30 -19.571 -4.249 3.001
543 H VAL 31 H VAL 31 -19.280 -2.266 -2.321
544 HA VAL 31 HA VAL 31 -21.608 -0.604 -2.081
545 HB VAL 31 HB VAL 31 -19.189 -0.167 -3.858
546 HG11 VAL 31 HG11 VAL 31 -21.171 1.176 -4.446
547 HG12 VAL 31 HG12 VAL 31 -19.832 2.157 -3.856
548 HG13 VAL 31 HG13 VAL 31 -21.202 1.811 -2.800
549 HG21 VAL 31 HG21 VAL 31 -19.712 0.787 -1.048
550 HG22 VAL 31 HG22 VAL 31 -18.353 1.271 -2.062
551 HG23 VAL 31 HG23 VAL 31 -18.508 -0.405 -1.538
552 H GLY 32 H GLY 32 -20.337 -2.821 -4.439
553 HA2 GLY 32 HA3 GLY 32 -22.039 -1.900 -6.583
554 HA3 GLY 32 HA2 GLY 32 -21.002 -3.318 -6.605
555 H GLU 33 H GLU 33 -21.848 -4.813 -4.571
556 HA GLU 33 HA GLU 33 -23.402 -6.272 -3.834
557 HB2 GLU 33 HB3 GLU 33 -24.656 -4.211 -3.211
558 HB3 GLU 33 HB2 GLU 33 -25.460 -4.269 -4.773
559 HG2 GLU 33 HG3 GLU 33 -26.510 -6.354 -4.216
560 HG3 GLU 33 HG2 GLU 33 -25.610 -6.442 -2.701
Start of MODEL 14
1 H1 GLY 1 H1 GLY 1 25.156 0.799 -4.571
2 H2 GLY 1 H2 GLY 1 24.799 1.203 -2.973
3 H3 GLY 1 H3 GLY 1 26.349 1.476 -3.585
4 HA2 GLY 1 HA2 GLY 1 25.143 3.547 -3.463
5 HA3 GLY 1 HA3 GLY 1 25.482 3.113 -5.134
6 H SER 2 H SER 2 23.634 4.766 -5.259
7 HA SER 2 HA SER 2 21.501 5.147 -6.019
8 HB2 SER 2 HB3 SER 2 21.783 3.090 -7.341
9 HB3 SER 2 HB2 SER 2 21.277 2.121 -5.960
10 HG SER 2 HG SER 2 19.248 3.194 -6.075
11 H MET 3 H MET 3 22.212 5.106 -3.252
12 HA MET 3 HA MET 3 20.357 3.729 -1.645
13 HB2 MET 3 HB3 MET 3 22.551 4.701 -0.905
14 HB3 MET 3 HB2 MET 3 21.802 6.290 -0.961
15 HG2 MET 3 HG3 MET 3 21.835 5.437 1.305
16 HG3 MET 3 HG2 MET 3 20.180 5.601 0.720
17 HE1 MET 3 HE1 MET 3 19.987 2.467 3.081
18 HE2 MET 3 HE2 MET 3 19.337 4.070 2.736
19 HE3 MET 3 HE3 MET 3 20.997 3.894 3.306
20 H LYS 4 H LYS 4 20.385 7.037 -2.928
21 HA LYS 4 HA LYS 4 18.081 7.916 -1.562
22 HB2 LYS 4 HB3 LYS 4 19.709 9.451 -2.609
23 HB3 LYS 4 HB2 LYS 4 19.192 8.904 -4.195
24 HG2 LYS 4 HG3 LYS 4 16.941 9.765 -3.753
25 HG3 LYS 4 HG2 LYS 4 17.486 10.344 -2.178
26 HD2 LYS 4 HD3 LYS 4 18.619 11.215 -4.835
27 HD3 LYS 4 HD2 LYS 4 17.438 12.122 -3.891
28 HE2 LYS 4 HE3 LYS 4 19.059 12.236 -2.033
29 HE3 LYS 4 HE2 LYS 4 20.240 11.402 -3.040
30 HZ1 LYS 4 HZ1 LYS 4 20.591 13.780 -3.085
31 HZ2 LYS 4 HZ2 LYS 4 19.014 14.039 -3.629
32 HZ3 LYS 4 HZ3 LYS 4 20.127 13.235 -4.615
33 H GLN 5 H GLN 5 18.558 6.317 -4.661
34 HA GLN 5 HA GLN 5 15.942 6.529 -5.647
35 HB2 GLN 5 HB3 GLN 5 18.035 4.397 -6.052
36 HB3 GLN 5 HB2 GLN 5 16.507 4.421 -6.916
37 HG2 GLN 5 HG3 GLN 5 18.607 6.574 -7.006
38 HG3 GLN 5 HG2 GLN 5 18.324 5.354 -8.245
39 HE21 GLN 5 HE21 GLN 5 17.216 8.294 -6.820
40 HE22 GLN 5 HE22 GLN 5 16.004 8.654 -7.995
41 H LEU 6 H LEU 6 17.438 4.058 -3.579
42 HA LEU 6 HA LEU 6 15.088 2.470 -3.385
43 HB2 LEU 6 HB3 LEU 6 17.698 2.561 -1.941
44 HB3 LEU 6 HB2 LEU 6 16.377 1.662 -1.220
45 HG LEU 6 HG LEU 6 16.222 0.284 -3.272
46 HD11 LEU 6 HD11 LEU 6 18.689 1.794 -4.120
47 HD12 LEU 6 HD12 LEU 6 17.105 1.859 -4.893
48 HD13 LEU 6 HD13 LEU 6 18.036 0.361 -4.914
49 HD21 LEU 6 HD21 LEU 6 18.943 0.366 -1.981
50 HD22 LEU 6 HD22 LEU 6 18.285 -0.985 -2.903
51 HD23 LEU 6 HD23 LEU 6 17.527 -0.501 -1.386
52 H GLU 7 H GLU 7 16.400 5.131 -1.497
53 HA GLU 7 HA GLU 7 14.563 4.953 0.649
54 HB2 GLU 7 HB3 GLU 7 16.082 7.333 -0.428
55 HB3 GLU 7 HB2 GLU 7 15.174 7.334 1.077
56 HG2 GLU 7 HG3 GLU 7 17.563 5.617 0.439
57 HG3 GLU 7 HG2 GLU 7 17.539 7.031 1.492
58 H ASP 8 H ASP 8 14.473 6.657 -2.449
59 HA ASP 8 HA ASP 8 11.932 7.877 -1.945
60 HB2 ASP 8 HB3 ASP 8 13.572 7.473 -4.435
61 HB3 ASP 8 HB2 ASP 8 11.946 8.145 -4.509
62 H LYS 9 H LYS 9 13.026 4.872 -3.315
63 HA LYS 9 HA LYS 9 10.655 4.042 -4.557
64 HB2 LYS 9 HB3 LYS 9 12.850 2.951 -4.875
65 HB3 LYS 9 HB2 LYS 9 12.770 2.332 -3.231
66 HG2 LYS 9 HG3 LYS 9 10.752 1.062 -3.831
67 HG3 LYS 9 HG2 LYS 9 10.904 1.639 -5.489
68 HD2 LYS 9 HD3 LYS 9 12.984 0.020 -4.018
69 HD3 LYS 9 HD2 LYS 9 11.825 -0.633 -5.177
70 HE2 LYS 9 HE3 LYS 9 13.912 1.464 -5.773
71 HE3 LYS 9 HE2 LYS 9 14.032 -0.245 -6.184
72 HZ1 LYS 9 HZ1 LYS 9 13.306 1.055 -8.073
73 HZ2 LYS 9 HZ2 LYS 9 11.981 1.642 -7.207
74 HZ3 LYS 9 HZ3 LYS 9 12.077 -0.002 -7.590
75 H VAL 10 H VAL 10 11.880 3.330 -1.277
76 HA VAL 10 HA VAL 10 9.608 1.840 -0.509
77 HB VAL 10 HB VAL 10 11.727 1.606 0.680
78 HG11 VAL 10 HG11 VAL 10 11.207 4.380 1.739
79 HG12 VAL 10 HG12 VAL 10 12.491 3.914 0.623
80 HG13 VAL 10 HG13 VAL 10 12.491 3.294 2.275
81 HG21 VAL 10 HG21 VAL 10 10.859 1.609 2.976
82 HG22 VAL 10 HG22 VAL 10 9.695 0.948 1.828
83 HG23 VAL 10 HG23 VAL 10 9.490 2.586 2.447
84 H GLU 11 H GLU 11 10.368 5.281 -0.279
85 HA GLU 11 HA GLU 11 8.099 5.974 1.289
86 HB2 GLU 11 HB3 GLU 11 9.779 7.619 -0.603
87 HB3 GLU 11 HB2 GLU 11 8.498 8.287 0.398
88 HG2 GLU 11 HG3 GLU 11 9.701 7.518 2.402
89 HG3 GLU 11 HG2 GLU 11 11.004 6.932 1.366
90 H GLU 12 H GLU 12 8.695 5.672 -2.161
91 HA GLU 12 HA GLU 12 6.271 6.702 -3.099
92 HB2 GLU 12 HB3 GLU 12 8.227 6.147 -4.521
93 HB3 GLU 12 HB2 GLU 12 7.873 4.439 -4.299
94 HG2 GLU 12 HG3 GLU 12 5.761 4.685 -5.427
95 HG3 GLU 12 HG2 GLU 12 6.001 6.427 -5.557
96 H LEU 13 H LEU 13 7.087 3.256 -2.426
97 HA LEU 13 HA LEU 13 4.407 2.406 -2.708
98 HB2 LEU 13 HB3 LEU 13 6.762 1.114 -1.361
99 HB3 LEU 13 HB2 LEU 13 5.163 0.399 -1.311
100 HG LEU 13 HG LEU 13 5.207 0.611 -3.872
101 HD11 LEU 13 HD11 LEU 13 7.177 2.010 -4.063
102 HD12 LEU 13 HD12 LEU 13 7.435 0.463 -4.870
103 HD13 LEU 13 HD13 LEU 13 8.157 0.764 -3.290
104 HD21 LEU 13 HD21 LEU 13 6.956 -1.368 -2.426
105 HD22 LEU 13 HD22 LEU 13 6.340 -1.560 -4.068
106 HD23 LEU 13 HD23 LEU 13 5.218 -1.504 -2.706
107 H LEU 14 H LEU 14 6.182 3.603 0.096
108 HA LEU 14 HA LEU 14 4.252 3.185 2.052
109 HB2 LEU 14 HB3 LEU 14 6.494 4.070 2.501
110 HB3 LEU 14 HB2 LEU 14 6.110 5.544 1.652
111 HG LEU 14 HG LEU 14 6.160 5.666 4.160
112 HD11 LEU 14 HD11 LEU 14 5.134 7.404 2.829
113 HD12 LEU 14 HD12 LEU 14 4.241 7.146 4.330
114 HD13 LEU 14 HD13 LEU 14 3.614 6.507 2.809
115 HD21 LEU 14 HD21 LEU 14 4.229 4.909 5.405
116 HD22 LEU 14 HD22 LEU 14 5.017 3.544 4.614
117 HD23 LEU 14 HD23 LEU 14 3.531 4.218 3.943
118 H SER 15 H SER 15 4.527 5.702 -0.395
119 HA SER 15 HA SER 15 2.156 7.076 0.307
120 HB2 SER 15 HB3 SER 15 3.498 6.929 -2.406
121 HB3 SER 15 HB2 SER 15 2.373 8.171 -1.854
122 HG SER 15 HG SER 15 4.770 7.643 -0.451
123 H LYS 16 H LYS 16 2.849 4.383 -1.920
124 HA LYS 16 HA LYS 16 0.325 4.270 -3.136
125 HB2 LYS 16 HB3 LYS 16 2.358 2.100 -2.636
126 HB3 LYS 16 HB2 LYS 16 0.903 1.863 -3.593
127 HG2 LYS 16 HG3 LYS 16 1.641 3.618 -5.138
128 HG3 LYS 16 HG2 LYS 16 3.112 3.823 -4.186
129 HD2 LYS 16 HD3 LYS 16 3.554 2.427 -6.126
130 HD3 LYS 16 HD2 LYS 16 3.715 1.485 -4.646
131 HE2 LYS 16 HE3 LYS 16 2.539 0.215 -6.354
132 HE3 LYS 16 HE2 LYS 16 1.477 0.557 -4.989
133 HZ1 LYS 16 HZ1 LYS 16 1.519 2.029 -7.570
134 HZ2 LYS 16 HZ2 LYS 16 0.505 2.374 -6.262
135 HZ3 LYS 16 HZ3 LYS 16 0.350 0.907 -7.087
136 H ASN 17 H ASN 17 1.530 2.356 -0.336
137 HA ASN 17 HA ASN 17 -1.029 1.159 0.038
138 HB2 ASN 17 HB3 ASN 17 -0.132 0.264 2.158
139 HB3 ASN 17 HB2 ASN 17 0.900 -0.069 0.782
140 HD21 ASN 17 HD21 ASN 17 0.732 2.948 2.657
141 HD22 ASN 17 HD22 ASN 17 2.349 2.855 3.239
142 H TYR 18 H TYR 18 0.289 4.159 0.949
143 HA TYR 18 HA TYR 18 -1.498 4.660 3.136
144 HB2 TYR 18 HB3 TYR 18 0.567 5.907 3.027
145 HB3 TYR 18 HB2 TYR 18 0.170 6.511 1.423
146 HD1 TYR 18 HD1 TYR 18 -1.180 6.529 4.909
147 HD2 TYR 18 HD2 TYR 18 -0.741 8.625 1.233
148 HE1 TYR 18 HE1 TYR 18 -2.226 8.511 5.917
149 HE2 TYR 18 HE2 TYR 18 -1.785 10.610 2.234
150 HH TYR 18 HH TYR 18 -2.356 10.876 5.619
151 H HIS 19 H HIS 19 -1.385 5.620 -0.288
152 HA HIS 19 HA HIS 19 -3.833 7.034 -0.267
153 HB2 HIS 19 HB3 HIS 19 -2.178 5.814 -2.459
154 HB3 HIS 19 HB2 HIS 19 -3.756 6.514 -2.810
155 HD1 HIS 19 HD1 HIS 19 -3.630 8.867 -3.521
156 HD2 HIS 19 HD2 HIS 19 -0.513 7.872 -0.962
157 HE1 HIS 19 HE1 HIS 19 -2.214 10.934 -3.346
158 HE2 HIS 19 HE2 HIS 19 -0.240 10.244 -1.942
159 H LEU 20 H LEU 20 -3.037 3.673 -1.053
160 HA LEU 20 HA LEU 20 -5.671 2.925 -1.760
161 HB2 LEU 20 HB3 LEU 20 -3.154 1.505 -1.129
162 HB3 LEU 20 HB2 LEU 20 -4.632 0.591 -0.923
163 HG LEU 20 HG LEU 20 -3.566 0.265 -3.144
164 HD11 LEU 20 HD11 LEU 20 -5.592 0.430 -4.419
165 HD12 LEU 20 HD12 LEU 20 -6.251 1.622 -3.300
166 HD13 LEU 20 HD13 LEU 20 -5.997 -0.039 -2.769
167 HD21 LEU 20 HD21 LEU 20 -3.734 2.050 -4.800
168 HD22 LEU 20 HD22 LEU 20 -2.680 2.512 -3.463
169 HD23 LEU 20 HD23 LEU 20 -4.321 3.152 -3.557
170 H GLU 21 H GLU 21 -3.963 3.045 1.319
171 HA GLU 21 HA GLU 21 -5.910 1.767 2.894
172 HB2 GLU 21 HB3 GLU 21 -3.638 2.358 3.697
173 HB3 GLU 21 HB2 GLU 21 -4.092 4.056 3.677
174 HG2 GLU 21 HG3 GLU 21 -5.837 3.579 5.343
175 HG3 GLU 21 HG2 GLU 21 -5.296 1.902 5.396
176 H ASN 22 H ASN 22 -5.532 5.106 1.836
177 HA ASN 22 HA ASN 22 -7.767 6.173 3.184
178 HB2 ASN 22 HB3 ASN 22 -6.405 7.082 0.640
179 HB3 ASN 22 HB2 ASN 22 -7.642 8.005 1.482
180 HD21 ASN 22 HD21 ASN 22 -4.951 8.790 0.911
181 HD22 ASN 22 HD22 ASN 22 -4.185 9.089 2.431
182 H GLU 23 H GLU 23 -7.422 4.353 0.251
183 HA GLU 23 HA GLU 23 -9.940 5.060 -0.885
184 HB2 GLU 23 HB3 GLU 23 -8.171 2.669 -1.438
185 HB3 GLU 23 HB2 GLU 23 -9.557 3.178 -2.425
186 HG2 GLU 23 HG3 GLU 23 -6.996 4.708 -1.982
187 HG3 GLU 23 HG2 GLU 23 -7.481 3.862 -3.449
188 H VAL 24 H VAL 24 -8.802 2.416 1.179
189 HA VAL 24 HA VAL 24 -11.253 0.961 1.056
190 HB VAL 24 HB VAL 24 -9.209 0.787 3.288
191 HG11 VAL 24 HG11 VAL 24 -11.376 -0.357 3.665
192 HG12 VAL 24 HG12 VAL 24 -10.026 -1.484 3.548
193 HG13 VAL 24 HG13 VAL 24 -11.127 -1.284 2.183
194 HG21 VAL 24 HG21 VAL 24 -8.075 0.567 1.147
195 HG22 VAL 24 HG22 VAL 24 -9.240 -0.658 0.644
196 HG23 VAL 24 HG23 VAL 24 -8.143 -0.983 1.985
197 H ALA 25 H ALA 25 -10.121 3.665 2.918
198 HA ALA 25 HA ALA 25 -12.327 3.590 4.780
199 HB1 ALA 25 HB1 ALA 25 -11.557 5.764 5.509
200 HB2 ALA 25 HB2 ALA 25 -10.497 5.891 4.110
201 HB3 ALA 25 HB3 ALA 25 -10.179 4.675 5.347
202 H ARG 26 H ARG 26 -11.590 4.991 1.694
203 HA ARG 26 HA ARG 26 -13.715 6.807 1.448
204 HB2 ARG 26 HB3 ARG 26 -12.043 7.122 -0.112
205 HB3 ARG 26 HB2 ARG 26 -11.846 5.405 -0.409
206 HG2 ARG 26 HG3 ARG 26 -12.711 6.573 -2.354
207 HG3 ARG 26 HG2 ARG 26 -13.859 5.379 -1.754
208 HD2 ARG 26 HD2 ARG 26 -15.112 7.181 -0.637
209 HD3 ARG 26 HD1 ARG 26 -13.959 8.361 -1.262
210 HE ARG 26 HE ARG 26 -14.943 6.940 -3.438
211 HH11 ARG 26 HH11 ARG 26 -16.185 9.094 -0.980
212 HH12 ARG 26 HH12 ARG 26 -17.455 9.716 -1.983
213 HH21 ARG 26 HH21 ARG 26 -16.607 7.757 -4.772
214 HH22 ARG 26 HH22 ARG 26 -17.691 8.958 -4.151
215 H LEU 27 H LEU 27 -13.434 3.475 0.138
216 HA LEU 27 HA LEU 27 -16.125 3.380 -0.715
217 HB2 LEU 27 HB3 LEU 27 -14.089 1.241 -0.195
218 HB3 LEU 27 HB2 LEU 27 -15.745 0.832 -0.581
219 HG LEU 27 HG LEU 27 -15.527 2.113 -2.699
220 HD11 LEU 27 HD11 LEU 27 -12.633 2.256 -1.902
221 HD12 LEU 27 HD12 LEU 27 -13.733 3.606 -2.160
222 HD13 LEU 27 HD13 LEU 27 -13.251 2.595 -3.518
223 HD21 LEU 27 HD21 LEU 27 -13.586 -0.140 -2.295
224 HD22 LEU 27 HD22 LEU 27 -14.204 0.421 -3.848
225 HD23 LEU 27 HD23 LEU 27 -15.304 -0.288 -2.667
226 H LYS 28 H LYS 28 -14.642 2.740 2.374
227 HA LYS 28 HA LYS 28 -16.644 1.256 3.601
228 HB2 LYS 28 HB3 LYS 28 -14.392 1.855 4.561
229 HB3 LYS 28 HB2 LYS 28 -15.042 3.445 4.931
230 HG2 LYS 28 HG3 LYS 28 -15.092 2.037 6.893
231 HG3 LYS 28 HG2 LYS 28 -16.736 2.410 6.369
232 HD2 LYS 28 HD3 LYS 28 -16.893 0.229 5.282
233 HD3 LYS 28 HD2 LYS 28 -15.238 -0.143 5.768
234 HE2 LYS 28 HE3 LYS 28 -17.541 0.396 7.637
235 HE3 LYS 28 HE2 LYS 28 -16.901 -1.195 7.237
236 HZ1 LYS 28 HZ1 LYS 28 -16.037 -0.386 9.340
237 HZ2 LYS 28 HZ2 LYS 28 -15.393 0.980 8.585
238 HZ3 LYS 28 HZ3 LYS 28 -14.790 -0.555 8.213
239 H LYS 29 H LYS 29 -16.408 4.739 3.075
240 HA LYS 29 HA LYS 29 -18.771 5.397 4.505
241 HB2 LYS 29 HB3 LYS 29 -17.254 6.886 2.359
242 HB3 LYS 29 HB2 LYS 29 -18.559 7.562 3.316
243 HG2 LYS 29 HG3 LYS 29 -15.978 6.513 4.448
244 HG3 LYS 29 HG2 LYS 29 -16.311 8.210 4.108
245 HD2 LYS 29 HD3 LYS 29 -17.866 6.470 6.024
246 HD3 LYS 29 HD2 LYS 29 -16.641 7.654 6.480
247 HE2 LYS 29 HE3 LYS 29 -19.255 8.221 5.085
248 HE3 LYS 29 HE2 LYS 29 -18.863 8.587 6.764
249 HZ1 LYS 29 HZ1 LYS 29 -18.643 10.548 5.412
250 HZ2 LYS 29 HZ2 LYS 29 -17.572 9.769 4.365
251 HZ3 LYS 29 HZ3 LYS 29 -17.116 10.082 5.963
252 H LEU 30 H LEU 30 -18.038 4.493 1.201
253 HA LEU 30 HA LEU 30 -20.554 5.190 0.085
254 HB2 LEU 30 HB3 LEU 30 -18.522 3.155 -0.832
255 HB3 LEU 30 HB2 LEU 30 -19.888 3.709 -1.781
256 HG LEU 30 HG LEU 30 -17.569 5.416 -0.871
257 HD11 LEU 30 HD11 LEU 30 -16.964 3.833 -2.623
258 HD12 LEU 30 HD12 LEU 30 -16.996 5.484 -3.242
259 HD13 LEU 30 HD13 LEU 30 -18.326 4.382 -3.599
260 HD21 LEU 30 HD21 LEU 30 -18.562 7.135 -2.312
261 HD22 LEU 30 HD22 LEU 30 -19.631 6.703 -0.979
262 HD23 LEU 30 HD23 LEU 30 -19.950 6.085 -2.599
263 H VAL 31 H VAL 31 -19.358 2.413 1.807
264 HA VAL 31 HA VAL 31 -21.616 0.741 1.201
265 HB VAL 31 HB VAL 31 -19.568 0.449 3.420
266 HG11 VAL 31 HG11 VAL 31 -20.240 -1.897 3.461
267 HG12 VAL 31 HG12 VAL 31 -21.459 -1.579 2.227
268 HG13 VAL 31 HG13 VAL 31 -21.604 -0.841 3.823
269 HG21 VAL 31 HG21 VAL 31 -18.466 -1.157 1.935
270 HG22 VAL 31 HG22 VAL 31 -18.501 0.461 1.233
271 HG23 VAL 31 HG23 VAL 31 -19.625 -0.772 0.663
272 H GLY 32 H GLY 32 -20.841 3.188 3.510
273 HA2 GLY 32 HA3 GLY 32 -22.986 2.414 5.324
274 HA3 GLY 32 HA2 GLY 32 -21.849 3.734 5.557
275 H GLU 33 H GLU 33 -22.119 5.330 3.454
276 HA GLU 33 HA GLU 33 -24.920 5.844 2.933
277 HB2 GLU 33 HB3 GLU 33 -24.590 6.853 5.158
278 HB3 GLU 33 HB2 GLU 33 -23.260 7.811 4.524
279 HG2 GLU 33 HG3 GLU 33 -24.795 8.967 3.026
280 HG3 GLU 33 HG2 GLU 33 -26.132 7.997 3.642
281 H1 GLY 1 H1 GLY 1 25.164 -0.983 3.891
282 H2 GLY 1 H2 GLY 1 24.798 -1.380 2.292
283 H3 GLY 1 H3 GLY 1 26.351 -1.665 2.895
284 HA2 GLY 1 HA2 GLY 1 25.130 -3.725 2.773
285 HA3 GLY 1 HA3 GLY 1 25.481 -3.301 4.442
286 H SER 2 H SER 2 23.635 -4.949 4.571
287 HA SER 2 HA SER 2 21.504 -5.344 5.327
288 HB2 SER 2 HB3 SER 2 21.790 -3.297 6.664
289 HB3 SER 2 HB2 SER 2 21.273 -2.319 5.294
290 HG SER 2 HG SER 2 19.247 -3.390 5.410
291 H MET 3 H MET 3 22.197 -5.293 2.562
292 HA MET 3 HA MET 3 20.340 -3.902 0.969
293 HB2 MET 3 HB3 MET 3 22.528 -4.874 0.216
294 HB3 MET 3 HB2 MET 3 21.778 -6.463 0.271
295 HG2 MET 3 HG3 MET 3 21.805 -5.600 -1.993
296 HG3 MET 3 HG2 MET 3 20.151 -5.773 -1.406
297 HE1 MET 3 HE1 MET 3 19.952 -2.626 -3.755
298 HE2 MET 3 HE2 MET 3 19.304 -4.231 -3.420
299 HE3 MET 3 HE3 MET 3 20.964 -4.054 -3.988
300 H LYS 4 H LYS 4 20.375 -7.218 2.224
301 HA LYS 4 HA LYS 4 18.060 -8.091 0.876
302 HB2 LYS 4 HB3 LYS 4 19.695 -9.627 1.915
303 HB3 LYS 4 HB2 LYS 4 19.180 -9.083 3.504
304 HG2 LYS 4 HG3 LYS 4 16.931 -9.945 3.066
305 HG3 LYS 4 HG2 LYS 4 17.467 -10.517 1.486
306 HD2 LYS 4 HD3 LYS 4 18.614 -11.402 4.132
307 HD3 LYS 4 HD2 LYS 4 17.426 -12.301 3.192
308 HE2 LYS 4 HE3 LYS 4 19.035 -12.408 1.323
309 HE3 LYS 4 HE2 LYS 4 20.225 -11.586 2.330
310 HZ1 LYS 4 HZ1 LYS 4 20.565 -13.966 2.348
311 HZ2 LYS 4 HZ2 LYS 4 18.993 -14.222 2.908
312 HZ3 LYS 4 HZ3 LYS 4 20.118 -13.434 3.890
313 H GLN 5 H GLN 5 18.551 -6.498 3.978
314 HA GLN 5 HA GLN 5 15.942 -6.720 4.977
315 HB2 GLN 5 HB3 GLN 5 18.037 -4.592 5.384
316 HB3 GLN 5 HB2 GLN 5 16.513 -4.616 6.256
317 HG2 GLN 5 HG3 GLN 5 18.611 -6.774 6.325
318 HG3 GLN 5 HG2 GLN 5 18.336 -5.558 7.572
319 HE21 GLN 5 HE21 GLN 5 17.212 -8.494 6.142
320 HE22 GLN 5 HE22 GLN 5 16.010 -8.856 7.328
321 H LEU 6 H LEU 6 17.428 -4.242 2.912
322 HA LEU 6 HA LEU 6 15.080 -2.647 2.736
323 HB2 LEU 6 HB3 LEU 6 17.685 -2.737 1.280
324 HB3 LEU 6 HB2 LEU 6 16.363 -1.833 0.569
325 HG LEU 6 HG LEU 6 16.220 -0.466 2.629
326 HD11 LEU 6 HD11 LEU 6 18.687 -1.982 3.455
327 HD12 LEU 6 HD12 LEU 6 17.108 -2.049 4.237
328 HD13 LEU 6 HD13 LEU 6 18.041 -0.553 4.260
329 HD21 LEU 6 HD21 LEU 6 18.934 -0.542 1.323
330 HD22 LEU 6 HD22 LEU 6 18.279 0.806 2.254
331 HD23 LEU 6 HD23 LEU 6 17.513 0.327 0.739
332 H GLU 7 H GLU 7 16.386 -5.297 0.823
333 HA GLU 7 HA GLU 7 14.538 -5.112 -1.310
334 HB2 GLU 7 HB3 GLU 7 16.056 -7.500 -0.250
335 HB3 GLU 7 HB2 GLU 7 15.145 -7.487 -1.753
336 HG2 GLU 7 HG3 GLU 7 17.541 -5.784 -1.108
337 HG3 GLU 7 HG2 GLU 7 17.508 -7.188 -2.173
338 H ASP 8 H ASP 8 14.465 -6.823 1.785
339 HA ASP 8 HA ASP 8 11.922 -8.046 1.284
340 HB2 ASP 8 HB3 ASP 8 13.577 -7.666 3.766
341 HB3 ASP 8 HB2 ASP 8 11.948 -8.323 3.848
342 H LYS 9 H LYS 9 13.019 -5.044 2.657
343 HA LYS 9 HA LYS 9 10.654 -4.221 3.918
344 HB2 LYS 9 HB3 LYS 9 12.851 -3.132 4.233
345 HB3 LYS 9 HB2 LYS 9 12.764 -2.505 2.593
346 HG2 LYS 9 HG3 LYS 9 10.746 -1.239 3.211
347 HG3 LYS 9 HG2 LYS 9 10.912 -1.824 4.866
348 HD2 LYS 9 HD3 LYS 9 12.982 -0.201 3.386
349 HD3 LYS 9 HD2 LYS 9 11.830 0.450 4.552
350 HE2 LYS 9 HE3 LYS 9 13.918 -1.648 5.135
351 HE3 LYS 9 HE2 LYS 9 14.045 0.060 5.547
352 HZ1 LYS 9 HZ1 LYS 9 13.329 -1.227 7.443
353 HZ2 LYS 9 HZ2 LYS 9 12.005 -1.833 6.584
354 HZ3 LYS 9 HZ3 LYS 9 12.087 -0.186 6.958
355 H VAL 10 H VAL 10 11.867 -3.490 0.638
356 HA VAL 10 HA VAL 10 9.593 -2.000 -0.117
357 HB VAL 10 HB VAL 10 11.704 -1.766 -1.315
358 HG11 VAL 10 HG11 VAL 10 11.180 -4.534 -2.382
359 HG12 VAL 10 HG12 VAL 10 12.469 -4.073 -1.271
360 HG13 VAL 10 HG13 VAL 10 12.460 -3.447 -2.919
361 HG21 VAL 10 HG21 VAL 10 10.824 -1.759 -3.607
362 HG22 VAL 10 HG22 VAL 10 9.667 -1.101 -2.449
363 HG23 VAL 10 HG23 VAL 10 9.457 -2.737 -3.073
364 H GLU 11 H GLU 11 10.347 -5.441 -0.369
365 HA GLU 11 HA GLU 11 8.067 -6.126 -1.923
366 HB2 GLU 11 HB3 GLU 11 9.759 -7.779 -0.048
367 HB3 GLU 11 HB2 GLU 11 8.471 -8.442 -1.041
368 HG2 GLU 11 HG3 GLU 11 9.657 -7.669 -3.054
369 HG3 GLU 11 HG2 GLU 11 10.967 -7.084 -2.027
370 H GLU 12 H GLU 12 8.679 -5.829 1.523
371 HA GLU 12 HA GLU 12 6.261 -6.869 2.464
372 HB2 GLU 12 HB3 GLU 12 8.222 -6.320 3.883
373 HB3 GLU 12 HB2 GLU 12 7.862 -4.611 3.673
374 HG2 GLU 12 HG3 GLU 12 5.756 -4.870 4.806
375 HG3 GLU 12 HG2 GLU 12 5.995 -6.611 4.923
376 H LEU 13 H LEU 13 7.072 -3.422 1.815
377 HA LEU 13 HA LEU 13 4.395 -2.569 2.104
378 HB2 LEU 13 HB3 LEU 13 6.747 -1.278 0.750
379 HB3 LEU 13 HB2 LEU 13 5.150 -0.560 0.709
380 HG LEU 13 HG LEU 13 5.206 -0.780 3.271
381 HD11 LEU 13 HD11 LEU 13 7.172 -2.184 3.447
382 HD12 LEU 13 HD12 LEU 13 7.434 -0.642 4.262
383 HD13 LEU 13 HD13 LEU 13 8.154 -0.936 2.679
384 HD21 LEU 13 HD21 LEU 13 6.955 1.203 1.828
385 HD22 LEU 13 HD22 LEU 13 6.345 1.387 3.472
386 HD23 LEU 13 HD23 LEU 13 5.220 1.342 2.114
387 H LEU 14 H LEU 14 6.157 -3.762 -0.710
388 HA LEU 14 HA LEU 14 4.224 -3.327 -2.660
389 HB2 LEU 14 HB3 LEU 14 6.460 -4.215 -3.121
390 HB3 LEU 14 HB2 LEU 14 6.079 -5.691 -2.276
391 HG LEU 14 HG LEU 14 6.121 -5.801 -4.785
392 HD11 LEU 14 HD11 LEU 14 5.099 -7.547 -3.462
393 HD12 LEU 14 HD12 LEU 14 4.197 -7.281 -4.953
394 HD13 LEU 14 HD13 LEU 14 3.581 -6.650 -3.426
395 HD21 LEU 14 HD21 LEU 14 4.183 -5.041 -6.020
396 HD22 LEU 14 HD22 LEU 14 4.975 -3.679 -5.228
397 HD23 LEU 14 HD23 LEU 14 3.492 -4.353 -4.550
398 H SER 15 H SER 15 4.502 -5.854 -0.224
399 HA SER 15 HA SER 15 2.127 -7.225 -0.922
400 HB2 SER 15 HB3 SER 15 3.484 -7.087 1.781
401 HB3 SER 15 HB2 SER 15 2.349 -8.322 1.238
402 HG SER 15 HG SER 15 4.754 -7.797 -0.156
403 H LYS 16 H LYS 16 2.835 -4.543 1.313
404 HA LYS 16 HA LYS 16 0.319 -4.428 2.539
405 HB2 LYS 16 HB3 LYS 16 2.352 -2.261 2.040
406 HB3 LYS 16 HB2 LYS 16 0.901 -2.026 3.002
407 HG2 LYS 16 HG3 LYS 16 1.640 -3.786 4.537
408 HG3 LYS 16 HG2 LYS 16 3.107 -3.991 3.581
409 HD2 LYS 16 HD3 LYS 16 3.557 -2.606 5.524
410 HD3 LYS 16 HD2 LYS 16 3.719 -1.658 4.048
411 HE2 LYS 16 HE3 LYS 16 2.550 -0.392 5.763
412 HE3 LYS 16 HE2 LYS 16 1.485 -0.722 4.399
413 HZ1 LYS 16 HZ1 LYS 16 1.524 -2.204 6.970
414 HZ2 LYS 16 HZ2 LYS 16 0.505 -2.538 5.666
415 HZ3 LYS 16 HZ3 LYS 16 0.360 -1.074 6.497
416 H ASN 17 H ASN 17 1.513 -2.507 -0.254
417 HA ASN 17 HA ASN 17 -1.045 -1.305 -0.612
418 HB2 ASN 17 HB3 ASN 17 -0.157 -0.398 -2.732
419 HB3 ASN 17 HB2 ASN 17 0.885 -0.077 -1.360
420 HD21 ASN 17 HD21 ASN 17 0.707 -3.086 -3.243
421 HD22 ASN 17 HD22 ASN 17 2.319 -2.989 -3.835
422 H TYR 18 H TYR 18 0.265 -4.304 -1.543
423 HA TYR 18 HA TYR 18 -1.535 -4.792 -3.725
424 HB2 TYR 18 HB3 TYR 18 0.531 -6.040 -3.635
425 HB3 TYR 18 HB2 TYR 18 0.142 -6.656 -2.033
426 HD1 TYR 18 HD1 TYR 18 -1.218 -6.654 -5.516
427 HD2 TYR 18 HD2 TYR 18 -0.776 -8.763 -1.848
428 HE1 TYR 18 HE1 TYR 18 -2.280 -8.630 -6.527
429 HE2 TYR 18 HE2 TYR 18 -1.834 -10.738 -2.850
430 HH TYR 18 HH TYR 18 -2.402 -11.023 -6.208
431 H HIS 19 H HIS 19 -1.407 -5.766 -0.303
432 HA HIS 19 HA HIS 19 -3.857 -7.177 -0.326
433 HB2 HIS 19 HB3 HIS 19 -2.196 -5.969 1.865
434 HB3 HIS 19 HB2 HIS 19 -3.773 -6.668 2.218
435 HD1 HIS 19 HD1 HIS 19 -3.645 -9.023 2.925
436 HD2 HIS 19 HD2 HIS 19 -0.534 -8.021 0.360
437 HE1 HIS 19 HE1 HIS 19 -2.238 -11.093 2.731
438 HE2 HIS 19 HE2 HIS 19 -0.268 -10.401 1.324
439 H LEU 20 H LEU 20 -3.055 -3.819 0.473
440 HA LEU 20 HA LEU 20 -5.684 -3.071 1.194
441 HB2 LEU 20 HB3 LEU 20 -3.169 -1.652 0.557
442 HB3 LEU 20 HB2 LEU 20 -4.647 -0.736 0.361
443 HG LEU 20 HG LEU 20 -3.571 -0.419 2.578
444 HD11 LEU 20 HD11 LEU 20 -5.591 -0.589 3.868
445 HD12 LEU 20 HD12 LEU 20 -6.257 -1.774 2.745
446 HD13 LEU 20 HD13 LEU 20 -6.005 -0.111 2.221
447 HD21 LEU 20 HD21 LEU 20 -3.730 -2.207 4.232
448 HD22 LEU 20 HD22 LEU 20 -2.684 -2.668 2.889
449 HD23 LEU 20 HD23 LEU 20 -4.326 -3.307 2.993
450 H GLU 21 H GLU 21 -3.997 -3.189 -1.890
451 HA GLU 21 HA GLU 21 -5.949 -1.896 -3.451
452 HB2 GLU 21 HB3 GLU 21 -3.681 -2.483 -4.267
453 HB3 GLU 21 HB2 GLU 21 -4.135 -4.181 -4.254
454 HG2 GLU 21 HG3 GLU 21 -5.886 -3.696 -5.916
455 HG3 GLU 21 HG2 GLU 21 -5.348 -2.018 -5.959
456 H ASN 22 H ASN 22 -5.566 -5.236 -2.406
457 HA ASN 22 HA ASN 22 -7.804 -6.300 -3.755
458 HB2 ASN 22 HB3 ASN 22 -6.432 -7.221 -1.222
459 HB3 ASN 22 HB2 ASN 22 -7.677 -8.138 -2.060
460 HD21 ASN 22 HD21 ASN 22 -4.976 -8.924 -1.504
461 HD22 ASN 22 HD22 ASN 22 -4.221 -9.224 -3.031
462 H GLU 23 H GLU 23 -7.445 -4.488 -0.821
463 HA GLU 23 HA GLU 23 -9.958 -5.202 0.326
464 HB2 GLU 23 HB3 GLU 23 -8.184 -2.816 0.886
465 HB3 GLU 23 HB2 GLU 23 -9.568 -3.326 1.875
466 HG2 GLU 23 HG3 GLU 23 -7.015 -4.862 1.414
467 HG3 GLU 23 HG2 GLU 23 -7.491 -4.023 2.889
468 H VAL 24 H VAL 24 -8.828 -2.554 -1.733
469 HA VAL 24 HA VAL 24 -11.277 -1.094 -1.594
470 HB VAL 24 HB VAL 24 -9.239 -0.913 -3.829
471 HG11 VAL 24 HG11 VAL 24 -11.404 0.237 -4.193
472 HG12 VAL 24 HG12 VAL 24 -10.052 1.360 -4.079
473 HG13 VAL 24 HG13 VAL 24 -11.147 1.157 -2.710
474 HG21 VAL 24 HG21 VAL 24 -8.098 -0.703 -1.691
475 HG22 VAL 24 HG22 VAL 24 -9.258 0.522 -1.178
476 HG23 VAL 24 HG23 VAL 24 -8.164 0.850 -2.522
477 H ALA 25 H ALA 25 -10.154 -3.792 -3.469
478 HA ALA 25 HA ALA 25 -12.370 -3.709 -5.320
479 HB1 ALA 25 HB1 ALA 25 -11.605 -5.880 -6.067
480 HB2 ALA 25 HB2 ALA 25 -10.537 -6.014 -4.673
481 HB3 ALA 25 HB3 ALA 25 -10.224 -4.793 -5.905
482 H ARG 26 H ARG 26 -11.621 -5.111 -2.243
483 HA ARG 26 HA ARG 26 -13.743 -6.932 -1.995
484 HB2 ARG 26 HB3 ARG 26 -12.066 -7.255 -0.441
485 HB3 ARG 26 HB2 ARG 26 -11.866 -5.541 -0.139
486 HG2 ARG 26 HG3 ARG 26 -12.725 -6.715 1.804
487 HG3 ARG 26 HG2 ARG 26 -13.871 -5.513 1.214
488 HD2 ARG 26 HD2 ARG 26 -15.136 -7.308 0.095
489 HD3 ARG 26 HD1 ARG 26 -13.986 -8.493 0.712
490 HE ARG 26 HE ARG 26 -14.958 -7.072 2.893
491 HH11 ARG 26 HH11 ARG 26 -16.213 -9.223 0.440
492 HH12 ARG 26 HH12 ARG 26 -17.459 -9.861 1.458
493 HH21 ARG 26 HH21 ARG 26 -16.607 -7.901 4.234
494 HH22 ARG 26 HH22 ARG 26 -17.699 -9.097 3.615
495 H LEU 27 H LEU 27 -13.456 -3.609 -0.671
496 HA LEU 27 HA LEU 27 -16.140 -3.512 0.192
497 HB2 LEU 27 HB3 LEU 27 -14.103 -1.374 -0.332
498 HB3 LEU 27 HB2 LEU 27 -15.758 -0.962 0.063
499 HG LEU 27 HG LEU 27 -15.535 -2.250 2.176
500 HD11 LEU 27 HD11 LEU 27 -12.642 -2.394 1.369
501 HD12 LEU 27 HD12 LEU 27 -13.744 -3.744 1.627
502 HD13 LEU 27 HD13 LEU 27 -13.256 -2.736 2.985
503 HD21 LEU 27 HD21 LEU 27 -13.588 -0.001 1.774
504 HD22 LEU 27 HD22 LEU 27 -14.202 -0.567 3.328
505 HD23 LEU 27 HD23 LEU 27 -15.304 0.152 2.151
506 H LYS 28 H LYS 28 -14.670 -2.862 -2.901
507 HA LYS 28 HA LYS 28 -16.675 -1.372 -4.112
508 HB2 LYS 28 HB3 LYS 28 -14.428 -1.968 -5.086
509 HB3 LYS 28 HB2 LYS 28 -15.082 -3.556 -5.459
510 HG2 LYS 28 HG3 LYS 28 -15.139 -2.143 -7.415
511 HG3 LYS 28 HG2 LYS 28 -16.782 -2.511 -6.883
512 HD2 LYS 28 HD3 LYS 28 -16.926 -0.333 -5.788
513 HD3 LYS 28 HD2 LYS 28 -15.273 0.035 -6.285
514 HE2 LYS 28 HE3 LYS 28 -17.593 -0.489 -8.137
515 HE3 LYS 28 HE2 LYS 28 -16.938 1.098 -7.737
516 HZ1 LYS 28 HZ1 LYS 28 -16.096 0.295 -9.848
517 HZ2 LYS 28 HZ2 LYS 28 -15.456 -1.081 -9.103
518 HZ3 LYS 28 HZ3 LYS 28 -14.839 0.448 -8.731
519 H LYS 29 H LYS 29 -16.444 -4.857 -3.604
520 HA LYS 29 HA LYS 29 -18.814 -5.503 -5.027
521 HB2 LYS 29 HB3 LYS 29 -17.291 -7.006 -2.895
522 HB3 LYS 29 HB2 LYS 29 -18.599 -7.675 -3.852
523 HG2 LYS 29 HG3 LYS 29 -16.028 -6.613 -4.991
524 HG3 LYS 29 HG2 LYS 29 -16.351 -8.311 -4.655
525 HD2 LYS 29 HD3 LYS 29 -17.922 -6.572 -6.553
526 HD3 LYS 29 HD2 LYS 29 -16.697 -7.752 -7.019
527 HE2 LYS 29 HE3 LYS 29 -19.304 -8.334 -5.612
528 HE3 LYS 29 HE2 LYS 29 -18.921 -8.686 -7.296
529 HZ1 LYS 29 HZ1 LYS 29 -18.688 -10.659 -5.962
530 HZ2 LYS 29 HZ2 LYS 29 -17.615 -9.887 -4.915
531 HZ3 LYS 29 HZ3 LYS 29 -17.163 -10.183 -6.516
532 H LEU 30 H LEU 30 -18.068 -4.614 -1.719
533 HA LEU 30 HA LEU 30 -20.584 -5.310 -0.598
534 HB2 LEU 30 HB3 LEU 30 -18.546 -3.281 0.322
535 HB3 LEU 30 HB2 LEU 30 -19.908 -3.841 1.272
536 HG LEU 30 HG LEU 30 -17.592 -5.543 0.342
537 HD11 LEU 30 HD11 LEU 30 -16.974 -3.971 2.099
538 HD12 LEU 30 HD12 LEU 30 -17.007 -5.625 2.710
539 HD13 LEU 30 HD13 LEU 30 -18.331 -4.522 3.081
540 HD21 LEU 30 HD21 LEU 30 -18.574 -7.269 1.783
541 HD22 LEU 30 HD22 LEU 30 -19.650 -6.832 0.456
542 HD23 LEU 30 HD23 LEU 30 -19.962 -6.223 2.081
543 H VAL 31 H VAL 31 -19.390 -2.535 -2.323
544 HA VAL 31 HA VAL 31 -21.640 -0.858 -1.696
545 HB VAL 31 HB VAL 31 -19.599 -0.557 -3.919
546 HG11 VAL 31 HG11 VAL 31 -20.272 1.788 -3.949
547 HG12 VAL 31 HG12 VAL 31 -21.487 1.465 -2.713
548 HG13 VAL 31 HG13 VAL 31 -21.638 0.735 -4.313
549 HG21 VAL 31 HG21 VAL 31 -18.491 1.039 -2.431
550 HG22 VAL 31 HG22 VAL 31 -18.527 -0.581 -1.736
551 HG23 VAL 31 HG23 VAL 31 -19.647 0.651 -1.158
552 H GLY 32 H GLY 32 -20.874 -3.293 -4.024
553 HA2 GLY 32 HA3 GLY 32 -23.027 -2.518 -5.825
554 HA3 GLY 32 HA2 GLY 32 -21.892 -3.838 -6.061
555 H GLU 33 H GLU 33 -22.155 -5.440 -3.967
556 HA GLU 33 HA GLU 33 -24.952 -5.953 -3.426
557 HB2 GLU 33 HB3 GLU 33 -24.644 -6.950 -5.661
558 HB3 GLU 33 HB2 GLU 33 -23.308 -7.909 -5.046
559 HG2 GLU 33 HG3 GLU 33 -24.828 -9.078 -3.540
560 HG3 GLU 33 HG2 GLU 33 -26.171 -8.104 -4.137
Start of MODEL 15
1 H1 GLY 1 H1 GLY 1 21.692 5.319 -11.298
2 H2 GLY 1 H2 GLY 1 21.908 6.925 -10.818
3 H3 GLY 1 H3 GLY 1 20.407 6.174 -10.610
4 HA2 GLY 1 HA2 GLY 1 22.920 5.411 -9.233
5 HA3 GLY 1 HA3 GLY 1 21.605 6.327 -8.514
6 H SER 2 H SER 2 21.656 4.536 -6.934
7 HA SER 2 HA SER 2 19.735 2.508 -7.741
8 HB2 SER 2 HB3 SER 2 21.994 1.495 -8.107
9 HB3 SER 2 HB2 SER 2 22.335 1.734 -6.394
10 HG SER 2 HG SER 2 21.290 -0.036 -6.013
11 H MET 3 H MET 3 21.864 3.351 -4.992
12 HA MET 3 HA MET 3 20.150 2.486 -2.977
13 HB2 MET 3 HB3 MET 3 22.423 2.897 -2.429
14 HB3 MET 3 HB2 MET 3 22.338 4.557 -2.998
15 HG2 MET 3 HG3 MET 3 22.408 4.375 -0.548
16 HG3 MET 3 HG2 MET 3 20.960 5.185 -1.137
17 HE1 MET 3 HE1 MET 3 21.030 0.850 0.449
18 HE2 MET 3 HE2 MET 3 22.438 1.914 0.451
19 HE3 MET 3 HE3 MET 3 21.778 1.328 -1.077
20 H LYS 4 H LYS 4 20.573 5.790 -4.242
21 HA LYS 4 HA LYS 4 18.675 6.966 -2.520
22 HB2 LYS 4 HB3 LYS 4 19.807 7.846 -5.170
23 HB3 LYS 4 HB2 LYS 4 18.658 8.819 -4.266
24 HG2 LYS 4 HG3 LYS 4 20.205 8.934 -2.389
25 HG3 LYS 4 HG2 LYS 4 21.358 7.930 -3.267
26 HD2 LYS 4 HD3 LYS 4 21.973 10.277 -3.428
27 HD3 LYS 4 HD2 LYS 4 21.515 9.648 -5.011
28 HE2 LYS 4 HE3 LYS 4 20.577 11.866 -4.650
29 HE3 LYS 4 HE2 LYS 4 19.301 10.658 -4.772
30 HZ1 LYS 4 HZ1 LYS 4 19.111 10.662 -2.366
31 HZ2 LYS 4 HZ2 LYS 4 18.892 12.223 -2.975
32 HZ3 LYS 4 HZ3 LYS 4 20.354 11.801 -2.240
33 H GLN 5 H GLN 5 18.394 5.530 -5.709
34 HA GLN 5 HA GLN 5 15.714 6.359 -6.172
35 HB2 GLN 5 HB3 GLN 5 17.353 4.133 -7.388
36 HB3 GLN 5 HB2 GLN 5 15.760 4.613 -7.960
37 HG2 GLN 5 HG3 GLN 5 16.586 6.809 -8.527
38 HG3 GLN 5 HG2 GLN 5 18.169 6.411 -7.863
39 HE21 GLN 5 HE21 GLN 5 16.280 4.112 -9.670
40 HE22 GLN 5 HE22 GLN 5 17.293 4.088 -11.071
41 H LEU 6 H LEU 6 17.193 3.401 -4.912
42 HA LEU 6 HA LEU 6 14.813 1.894 -4.746
43 HB2 LEU 6 HB3 LEU 6 17.264 1.121 -4.655
44 HB3 LEU 6 HB2 LEU 6 17.211 1.545 -2.958
45 HG LEU 6 HG LEU 6 16.866 -0.912 -3.600
46 HD11 LEU 6 HD11 LEU 6 15.224 -1.263 -1.823
47 HD12 LEU 6 HD12 LEU 6 14.847 0.459 -1.839
48 HD13 LEU 6 HD13 LEU 6 16.456 -0.088 -1.366
49 HD21 LEU 6 HD21 LEU 6 14.100 0.101 -4.241
50 HD22 LEU 6 HD22 LEU 6 14.625 -1.582 -4.202
51 HD23 LEU 6 HD23 LEU 6 15.268 -0.486 -5.424
52 H GLU 7 H GLU 7 16.439 4.069 -2.489
53 HA GLU 7 HA GLU 7 14.709 3.608 -0.295
54 HB2 GLU 7 HB3 GLU 7 16.388 6.014 -1.002
55 HB3 GLU 7 HB2 GLU 7 15.541 5.819 0.526
56 HG2 GLU 7 HG3 GLU 7 16.854 3.806 0.987
57 HG3 GLU 7 HG2 GLU 7 17.715 4.030 -0.535
58 H ASP 8 H ASP 8 14.451 5.596 -3.150
59 HA ASP 8 HA ASP 8 12.170 7.057 -2.192
60 HB2 ASP 8 HB3 ASP 8 13.605 6.845 -4.795
61 HB3 ASP 8 HB2 ASP 8 11.941 7.418 -4.817
62 H LYS 9 H LYS 9 12.726 4.049 -3.852
63 HA LYS 9 HA LYS 9 10.105 3.649 -4.837
64 HB2 LYS 9 HB3 LYS 9 12.153 1.568 -4.042
65 HB3 LYS 9 HB2 LYS 9 10.737 1.287 -5.045
66 HG2 LYS 9 HG3 LYS 9 13.043 3.092 -5.745
67 HG3 LYS 9 HG2 LYS 9 12.792 1.459 -6.360
68 HD2 LYS 9 HD3 LYS 9 10.749 2.141 -7.453
69 HD3 LYS 9 HD2 LYS 9 10.871 3.752 -6.745
70 HE2 LYS 9 HE3 LYS 9 11.605 3.757 -9.071
71 HE3 LYS 9 HE2 LYS 9 12.932 4.153 -7.981
72 HZ1 LYS 9 HZ1 LYS 9 13.760 1.914 -8.194
73 HZ2 LYS 9 HZ2 LYS 9 13.591 2.597 -9.729
74 HZ3 LYS 9 HZ3 LYS 9 12.456 1.476 -9.176
75 H VAL 10 H VAL 10 11.687 2.692 -1.807
76 HA VAL 10 HA VAL 10 9.457 1.265 -0.797
77 HB VAL 10 HB VAL 10 11.722 0.880 0.059
78 HG11 VAL 10 HG11 VAL 10 12.762 2.436 1.627
79 HG12 VAL 10 HG12 VAL 10 11.470 3.598 1.329
80 HG13 VAL 10 HG13 VAL 10 12.572 3.153 0.027
81 HG21 VAL 10 HG21 VAL 10 9.829 0.230 1.436
82 HG22 VAL 10 HG22 VAL 10 9.804 1.828 2.180
83 HG23 VAL 10 HG23 VAL 10 11.178 0.755 2.441
84 H GLU 11 H GLU 11 10.434 4.643 -0.601
85 HA GLU 11 HA GLU 11 8.366 5.382 1.245
86 HB2 GLU 11 HB3 GLU 11 10.015 7.049 -0.667
87 HB3 GLU 11 HB2 GLU 11 8.923 7.708 0.543
88 HG2 GLU 11 HG3 GLU 11 10.254 6.709 2.314
89 HG3 GLU 11 HG2 GLU 11 11.333 5.999 1.114
90 H GLU 12 H GLU 12 8.734 5.385 -2.270
91 HA GLU 12 HA GLU 12 6.326 6.604 -2.950
92 HB2 GLU 12 HB3 GLU 12 8.140 6.029 -4.551
93 HB3 GLU 12 HB2 GLU 12 7.670 4.340 -4.433
94 HG2 GLU 12 HG3 GLU 12 5.507 4.830 -5.379
95 HG3 GLU 12 HG2 GLU 12 5.876 6.553 -5.398
96 H LEU 13 H LEU 13 6.956 3.090 -2.549
97 HA LEU 13 HA LEU 13 4.222 2.411 -2.784
98 HB2 LEU 13 HB3 LEU 13 6.543 0.900 -1.615
99 HB3 LEU 13 HB2 LEU 13 4.918 0.241 -1.703
100 HG LEU 13 HG LEU 13 5.911 1.390 -4.206
101 HD11 LEU 13 HD11 LEU 13 7.280 -0.588 -4.741
102 HD12 LEU 13 HD12 LEU 13 7.092 -1.163 -3.084
103 HD13 LEU 13 HD13 LEU 13 7.968 0.334 -3.405
104 HD21 LEU 13 HD21 LEU 13 4.839 -0.597 -5.126
105 HD22 LEU 13 HD22 LEU 13 3.763 0.243 -4.008
106 HD23 LEU 13 HD23 LEU 13 4.591 -1.226 -3.499
107 H LEU 14 H LEU 14 6.134 3.368 -0.001
108 HA LEU 14 HA LEU 14 4.231 2.760 1.958
109 HB2 LEU 14 HB3 LEU 14 6.511 3.397 2.506
110 HB3 LEU 14 HB2 LEU 14 6.278 4.983 1.817
111 HG LEU 14 HG LEU 14 6.303 4.775 4.349
112 HD11 LEU 14 HD11 LEU 14 5.595 6.788 3.206
113 HD12 LEU 14 HD12 LEU 14 4.616 6.501 4.647
114 HD13 LEU 14 HD13 LEU 14 3.961 6.139 3.050
115 HD21 LEU 14 HD21 LEU 14 4.845 2.811 4.526
116 HD22 LEU 14 HD22 LEU 14 3.503 3.760 3.887
117 HD23 LEU 14 HD23 LEU 14 4.217 4.181 5.442
118 H SER 15 H SER 15 4.658 5.647 -0.085
119 HA SER 15 HA SER 15 2.292 6.881 0.897
120 HB2 SER 15 HB3 SER 15 2.538 8.365 -1.147
121 HB3 SER 15 HB2 SER 15 3.893 8.359 -0.023
122 HG SER 15 HG SER 15 4.064 6.470 -2.024
123 H LYS 16 H LYS 16 2.957 4.681 -1.841
124 HA LYS 16 HA LYS 16 0.423 4.867 -3.034
125 HB2 LYS 16 HB3 LYS 16 2.323 2.539 -2.789
126 HB3 LYS 16 HB2 LYS 16 0.828 2.448 -3.703
127 HG2 LYS 16 HG3 LYS 16 1.586 4.264 -5.143
128 HG3 LYS 16 HG2 LYS 16 3.088 4.368 -4.224
129 HD2 LYS 16 HD3 LYS 16 3.353 3.104 -6.321
130 HD3 LYS 16 HD2 LYS 16 3.692 2.120 -4.898
131 HE2 LYS 16 HE3 LYS 16 1.591 1.008 -5.067
132 HE3 LYS 16 HE2 LYS 16 1.023 2.138 -6.296
133 HZ1 LYS 16 HZ1 LYS 16 3.286 0.250 -6.646
134 HZ2 LYS 16 HZ2 LYS 16 2.641 1.271 -7.827
135 HZ3 LYS 16 HZ3 LYS 16 1.718 -0.008 -7.221
136 H ASN 17 H ASN 17 1.537 2.623 -0.505
137 HA ASN 17 HA ASN 17 -0.900 1.385 0.031
138 HB2 ASN 17 HB3 ASN 17 1.261 0.576 0.877
139 HB3 ASN 17 HB2 ASN 17 1.390 1.986 1.921
140 HD21 ASN 17 HD21 ASN 17 0.114 2.109 3.768
141 HD22 ASN 17 HD22 ASN 17 -0.706 0.732 4.410
142 H TYR 18 H TYR 18 0.497 4.350 1.362
143 HA TYR 18 HA TYR 18 -1.444 4.792 3.346
144 HB2 TYR 18 HB3 TYR 18 0.765 5.924 3.259
145 HB3 TYR 18 HB2 TYR 18 0.203 6.862 1.880
146 HD1 TYR 18 HD1 TYR 18 -0.425 6.198 5.473
147 HD2 TYR 18 HD2 TYR 18 -1.040 8.839 2.196
148 HE1 TYR 18 HE1 TYR 18 -1.345 7.882 7.010
149 HE2 TYR 18 HE2 TYR 18 -1.960 10.529 3.725
150 HH TYR 18 HH TYR 18 -3.012 10.640 5.915
151 H HIS 19 H HIS 19 -1.196 6.027 0.015
152 HA HIS 19 HA HIS 19 -3.624 7.518 0.152
153 HB2 HIS 19 HB3 HIS 19 -2.104 6.494 -2.257
154 HB3 HIS 19 HB2 HIS 19 -3.436 7.642 -2.321
155 HD1 HIS 19 HD1 HIS 19 -0.309 8.042 -3.137
156 HD2 HIS 19 HD2 HIS 19 -2.303 9.568 0.176
157 HE1 HIS 19 HE1 HIS 19 1.001 10.070 -2.432
158 HE2 HIS 19 HE2 HIS 19 -0.118 10.856 -0.314
159 H LEU 20 H LEU 20 -2.806 4.246 -0.706
160 HA LEU 20 HA LEU 20 -5.282 3.577 -1.917
161 HB2 LEU 20 HB3 LEU 20 -3.151 2.428 -2.336
162 HB3 LEU 20 HB2 LEU 20 -3.140 1.857 -0.681
163 HG LEU 20 HG LEU 20 -5.165 0.555 -1.134
164 HD11 LEU 20 HD11 LEU 20 -4.769 1.506 -3.966
165 HD12 LEU 20 HD12 LEU 20 -6.137 1.882 -2.917
166 HD13 LEU 20 HD13 LEU 20 -5.876 0.228 -3.468
167 HD21 LEU 20 HD21 LEU 20 -2.911 -0.393 -1.354
168 HD22 LEU 20 HD22 LEU 20 -2.919 0.033 -3.065
169 HD23 LEU 20 HD23 LEU 20 -4.065 -1.151 -2.445
170 H GLU 21 H GLU 21 -3.968 3.430 1.344
171 HA GLU 21 HA GLU 21 -6.116 2.032 2.549
172 HB2 GLU 21 HB3 GLU 21 -3.895 2.442 3.609
173 HB3 GLU 21 HB2 GLU 21 -4.325 4.138 3.782
174 HG2 GLU 21 HG3 GLU 21 -6.159 3.542 5.252
175 HG3 GLU 21 HG2 GLU 21 -5.789 1.833 5.046
176 H ASN 22 H ASN 22 -5.603 5.385 1.710
177 HA ASN 22 HA ASN 22 -7.909 6.447 2.951
178 HB2 ASN 22 HB3 ASN 22 -6.069 7.355 0.784
179 HB3 ASN 22 HB2 ASN 22 -7.611 8.184 0.978
180 HD21 ASN 22 HD21 ASN 22 -4.543 7.438 2.485
181 HD22 ASN 22 HD22 ASN 22 -4.635 8.661 3.702
182 H GLU 23 H GLU 23 -7.359 4.660 0.058
183 HA GLU 23 HA GLU 23 -9.794 5.385 -1.262
184 HB2 GLU 23 HB3 GLU 23 -7.715 4.665 -2.451
185 HB3 GLU 23 HB2 GLU 23 -7.969 3.030 -1.804
186 HG2 GLU 23 HG3 GLU 23 -10.034 2.831 -3.028
187 HG3 GLU 23 HG2 GLU 23 -9.906 4.498 -3.589
188 H VAL 24 H VAL 24 -8.741 2.796 0.876
189 HA VAL 24 HA VAL 24 -11.096 1.216 0.599
190 HB VAL 24 HB VAL 24 -9.338 1.355 3.056
191 HG11 VAL 24 HG11 VAL 24 -11.463 0.160 3.331
192 HG12 VAL 24 HG12 VAL 24 -10.086 -0.935 3.429
193 HG13 VAL 24 HG13 VAL 24 -11.059 -0.876 1.958
194 HG21 VAL 24 HG21 VAL 24 -7.969 0.970 1.043
195 HG22 VAL 24 HG22 VAL 24 -8.978 -0.422 0.647
196 HG23 VAL 24 HG23 VAL 24 -8.002 -0.429 2.114
197 H ALA 25 H ALA 25 -10.140 3.918 2.611
198 HA ALA 25 HA ALA 25 -12.222 3.756 4.500
199 HB1 ALA 25 HB1 ALA 25 -10.140 5.055 4.820
200 HB2 ALA 25 HB2 ALA 25 -11.603 5.971 5.175
201 HB3 ALA 25 HB3 ALA 25 -10.744 6.238 3.660
202 H ARG 26 H ARG 26 -11.955 5.600 1.461
203 HA ARG 26 HA ARG 26 -14.363 6.998 1.760
204 HB2 ARG 26 HB3 ARG 26 -14.253 7.155 -0.780
205 HB3 ARG 26 HB2 ARG 26 -12.934 7.857 0.133
206 HG2 ARG 26 HG3 ARG 26 -11.610 5.819 -0.323
207 HG3 ARG 26 HG2 ARG 26 -12.925 5.226 -1.342
208 HD2 ARG 26 HD2 ARG 26 -11.213 6.282 -2.698
209 HD3 ARG 26 HD1 ARG 26 -12.703 7.223 -2.753
210 HE ARG 26 HE ARG 26 -11.147 8.281 -0.709
211 HH11 ARG 26 HH11 ARG 26 -10.970 7.922 -4.185
212 HH12 ARG 26 HH12 ARG 26 -9.999 9.342 -4.408
213 HH21 ARG 26 HH21 ARG 26 -9.886 10.141 -0.992
214 HH22 ARG 26 HH22 ARG 26 -9.375 10.606 -2.585
215 H LEU 27 H LEU 27 -13.685 3.879 0.212
216 HA LEU 27 HA LEU 27 -16.312 3.372 -0.645
217 HB2 LEU 27 HB3 LEU 27 -13.979 1.622 -0.000
218 HB3 LEU 27 HB2 LEU 27 -15.551 0.895 -0.239
219 HG LEU 27 HG LEU 27 -15.666 1.819 -2.496
220 HD11 LEU 27 HD11 LEU 27 -13.647 2.814 -3.510
221 HD12 LEU 27 HD12 LEU 27 -12.921 2.896 -1.903
222 HD13 LEU 27 HD13 LEU 27 -14.373 3.830 -2.262
223 HD21 LEU 27 HD21 LEU 27 -14.769 -0.378 -2.240
224 HD22 LEU 27 HD22 LEU 27 -13.170 0.271 -1.873
225 HD23 LEU 27 HD23 LEU 27 -13.857 0.473 -3.486
226 H LYS 28 H LYS 28 -14.728 2.841 2.464
227 HA LYS 28 HA LYS 28 -16.774 1.380 3.695
228 HB2 LYS 28 HB3 LYS 28 -14.713 3.245 4.859
229 HB3 LYS 28 HB2 LYS 28 -15.821 2.300 5.847
230 HG2 LYS 28 HG3 LYS 28 -14.940 0.242 4.889
231 HG3 LYS 28 HG2 LYS 28 -13.848 1.180 3.872
232 HD2 LYS 28 HD3 LYS 28 -12.698 0.274 5.819
233 HD3 LYS 28 HD2 LYS 28 -12.722 2.041 5.856
234 HE2 LYS 28 HE3 LYS 28 -14.620 1.964 7.417
235 HE3 LYS 28 HE2 LYS 28 -14.560 0.204 7.391
236 HZ1 LYS 28 HZ1 LYS 28 -12.329 0.310 8.317
237 HZ2 LYS 28 HZ2 LYS 28 -13.437 1.084 9.328
238 HZ3 LYS 28 HZ3 LYS 28 -12.400 1.998 8.355
239 H LYS 29 H LYS 29 -16.546 4.833 3.077
240 HA LYS 29 HA LYS 29 -18.740 5.514 4.771
241 HB2 LYS 29 HB3 LYS 29 -17.271 6.926 2.577
242 HB3 LYS 29 HB2 LYS 29 -18.800 7.556 3.152
243 HG2 LYS 29 HG3 LYS 29 -16.991 8.685 4.252
244 HG3 LYS 29 HG2 LYS 29 -17.874 7.707 5.422
245 HD2 LYS 29 HD3 LYS 29 -16.157 6.000 5.330
246 HD3 LYS 29 HD2 LYS 29 -15.300 6.899 4.074
247 HE2 LYS 29 HE3 LYS 29 -15.792 7.821 6.903
248 HE3 LYS 29 HE2 LYS 29 -14.261 7.236 6.253
249 HZ1 LYS 29 HZ1 LYS 29 -14.259 9.109 4.714
250 HZ2 LYS 29 HZ2 LYS 29 -14.309 9.637 6.317
251 HZ3 LYS 29 HZ3 LYS 29 -15.710 9.672 5.375
252 H LEU 30 H LEU 30 -18.386 4.324 1.533
253 HA LEU 30 HA LEU 30 -21.126 4.835 0.803
254 HB2 LEU 30 HB3 LEU 30 -18.817 3.425 -0.447
255 HB3 LEU 30 HB2 LEU 30 -20.427 3.069 -1.034
256 HG LEU 30 HG LEU 30 -19.255 4.748 -2.407
257 HD11 LEU 30 HD11 LEU 30 -21.060 6.291 -2.619
258 HD12 LEU 30 HD12 LEU 30 -21.602 5.973 -0.975
259 HD13 LEU 30 HD13 LEU 30 -21.734 4.716 -2.205
260 HD21 LEU 30 HD21 LEU 30 -19.376 6.459 0.070
261 HD22 LEU 30 HD22 LEU 30 -18.903 7.007 -1.537
262 HD23 LEU 30 HD23 LEU 30 -17.917 5.817 -0.687
263 H VAL 31 H VAL 31 -19.306 2.216 2.221
264 HA VAL 31 HA VAL 31 -21.506 0.346 1.952
265 HB VAL 31 HB VAL 31 -18.932 -0.034 3.502
266 HG11 VAL 31 HG11 VAL 31 -20.909 -2.042 2.426
267 HG12 VAL 31 HG12 VAL 31 -20.715 -1.587 4.119
268 HG13 VAL 31 HG13 VAL 31 -19.408 -2.413 3.272
269 HG21 VAL 31 HG21 VAL 31 -19.570 -0.803 0.658
270 HG22 VAL 31 HG22 VAL 31 -18.107 -1.237 1.544
271 HG23 VAL 31 HG23 VAL 31 -18.442 0.453 1.167
272 H GLY 32 H GLY 32 -20.191 2.494 4.391
273 HA2 GLY 32 HA3 GLY 32 -22.233 1.499 6.268
274 HA3 GLY 32 HA2 GLY 32 -20.579 1.750 6.798
275 H GLU 33 H GLU 33 -20.069 4.182 5.430
276 HA GLU 33 HA GLU 33 -20.246 6.422 5.688
277 HB2 GLU 33 HB3 GLU 33 -22.503 6.129 4.737
278 HB3 GLU 33 HB2 GLU 33 -23.144 5.870 6.353
279 HG2 GLU 33 HG3 GLU 33 -22.540 8.128 6.985
280 HG3 GLU 33 HG2 GLU 33 -21.815 8.397 5.400
281 H1 GLY 1 H1 GLY 1 21.731 -5.569 10.608
282 H2 GLY 1 H2 GLY 1 21.944 -7.171 10.117
283 H3 GLY 1 H3 GLY 1 20.441 -6.417 9.918
284 HA2 GLY 1 HA2 GLY 1 22.953 -5.651 8.540
285 HA3 GLY 1 HA3 GLY 1 21.633 -6.561 7.819
286 H SER 2 H SER 2 21.687 -4.760 6.247
287 HA SER 2 HA SER 2 19.765 -2.738 7.073
288 HB2 SER 2 HB3 SER 2 22.022 -1.725 7.439
289 HB3 SER 2 HB2 SER 2 22.359 -1.950 5.724
290 HG SER 2 HG SER 2 21.331 -0.164 5.377
291 H MET 3 H MET 3 21.883 -3.567 4.313
292 HA MET 3 HA MET 3 20.162 -2.683 2.312
293 HB2 MET 3 HB3 MET 3 22.433 -3.094 1.754
294 HB3 MET 3 HB2 MET 3 22.345 -4.759 2.305
295 HG2 MET 3 HG3 MET 3 22.406 -4.550 -0.144
296 HG3 MET 3 HG2 MET 3 20.959 -5.365 0.444
297 HE1 MET 3 HE1 MET 3 21.033 -1.019 -1.112
298 HE2 MET 3 HE2 MET 3 22.436 -2.089 -1.127
299 HE3 MET 3 HE3 MET 3 21.787 -1.505 0.407
300 H LYS 4 H LYS 4 20.578 -5.999 3.553
301 HA LYS 4 HA LYS 4 18.673 -7.154 1.820
302 HB2 LYS 4 HB3 LYS 4 19.802 -8.062 4.460
303 HB3 LYS 4 HB2 LYS 4 18.654 -9.026 3.544
304 HG2 LYS 4 HG3 LYS 4 20.209 -9.122 1.671
305 HG3 LYS 4 HG2 LYS 4 21.359 -8.125 2.560
306 HD2 LYS 4 HD3 LYS 4 21.973 -10.472 2.700
307 HD3 LYS 4 HD2 LYS 4 21.517 -9.857 4.288
308 HE2 LYS 4 HE3 LYS 4 20.576 -12.070 3.909
309 HE3 LYS 4 HE2 LYS 4 19.302 -10.863 4.044
310 HZ1 LYS 4 HZ1 LYS 4 19.111 -10.844 1.637
311 HZ2 LYS 4 HZ2 LYS 4 18.893 -12.410 2.231
312 HZ3 LYS 4 HZ3 LYS 4 20.352 -11.984 1.502
313 H GLN 5 H GLN 5 18.410 -5.740 5.020
314 HA GLN 5 HA GLN 5 15.730 -6.565 5.492
315 HB2 GLN 5 HB3 GLN 5 17.379 -4.353 6.722
316 HB3 GLN 5 HB2 GLN 5 15.789 -4.837 7.295
317 HG2 GLN 5 HG3 GLN 5 16.613 -7.039 7.841
318 HG3 GLN 5 HG2 GLN 5 18.193 -6.640 7.169
319 HE21 GLN 5 HE21 GLN 5 16.318 -4.350 9.008
320 HE22 GLN 5 HE22 GLN 5 17.346 -4.336 10.399
321 H LEU 6 H LEU 6 17.211 -3.603 4.247
322 HA LEU 6 HA LEU 6 14.831 -2.092 4.104
323 HB2 LEU 6 HB3 LEU 6 17.283 -1.323 4.005
324 HB3 LEU 6 HB2 LEU 6 17.219 -1.731 2.306
325 HG LEU 6 HG LEU 6 16.879 0.718 2.974
326 HD11 LEU 6 HD11 LEU 6 15.231 1.087 1.205
327 HD12 LEU 6 HD12 LEU 6 14.853 -0.636 1.207
328 HD13 LEU 6 HD13 LEU 6 16.460 -0.086 0.732
329 HD21 LEU 6 HD21 LEU 6 14.114 -0.297 3.609
330 HD22 LEU 6 HD22 LEU 6 14.640 1.386 3.586
331 HD23 LEU 6 HD23 LEU 6 15.284 0.277 4.796
332 H GLU 7 H GLU 7 16.443 -4.253 1.827
333 HA GLU 7 HA GLU 7 14.708 -3.773 -0.359
334 HB2 GLU 7 HB3 GLU 7 16.387 -6.186 0.325
335 HB3 GLU 7 HB2 GLU 7 15.537 -5.974 -1.198
336 HG2 GLU 7 HG3 GLU 7 16.848 -3.962 -1.646
337 HG3 GLU 7 HG2 GLU 7 17.712 -4.195 -0.127
338 H ASP 8 H ASP 8 14.465 -5.790 2.480
339 HA ASP 8 HA ASP 8 12.175 -7.238 1.525
340 HB2 ASP 8 HB3 ASP 8 13.619 -7.046 4.126
341 HB3 ASP 8 HB2 ASP 8 11.956 -7.626 4.146
342 H LYS 9 H LYS 9 12.743 -4.241 3.195
343 HA LYS 9 HA LYS 9 10.127 -3.847 4.204
344 HB2 LYS 9 HB3 LYS 9 12.174 -1.762 3.415
345 HB3 LYS 9 HB2 LYS 9 10.761 -1.487 4.425
346 HG2 LYS 9 HG3 LYS 9 13.069 -3.298 5.105
347 HG3 LYS 9 HG2 LYS 9 12.820 -1.669 5.733
348 HD2 LYS 9 HD3 LYS 9 10.781 -2.360 6.829
349 HD3 LYS 9 HD2 LYS 9 10.898 -3.965 6.106
350 HE2 LYS 9 HE3 LYS 9 11.643 -3.990 8.428
351 HE3 LYS 9 HE2 LYS 9 12.966 -4.376 7.330
352 HZ1 LYS 9 HZ1 LYS 9 13.799 -2.141 7.569
353 HZ2 LYS 9 HZ2 LYS 9 13.627 -2.841 9.097
354 HZ3 LYS 9 HZ3 LYS 9 12.492 -1.711 8.553
355 H VAL 10 H VAL 10 11.692 -2.874 1.169
356 HA VAL 10 HA VAL 10 9.458 -1.431 0.185
357 HB VAL 10 HB VAL 10 11.719 -1.044 -0.679
358 HG11 VAL 10 HG11 VAL 10 12.749 -2.587 -2.267
359 HG12 VAL 10 HG12 VAL 10 11.456 -3.750 -1.971
360 HG13 VAL 10 HG13 VAL 10 12.568 -3.316 -0.672
361 HG21 VAL 10 HG21 VAL 10 9.823 -0.378 -2.043
362 HG22 VAL 10 HG22 VAL 10 9.790 -1.969 -2.799
363 HG23 VAL 10 HG23 VAL 10 11.167 -0.898 -3.056
364 H GLU 11 H GLU 11 10.435 -4.803 -0.046
365 HA GLU 11 HA GLU 11 8.359 -5.530 -1.886
366 HB2 GLU 11 HB3 GLU 11 10.014 -7.212 0.005
367 HB3 GLU 11 HB2 GLU 11 8.918 -7.859 -1.208
368 HG2 GLU 11 HG3 GLU 11 10.243 -6.842 -2.973
369 HG3 GLU 11 HG2 GLU 11 11.330 -6.151 -1.770
370 H GLU 12 H GLU 12 8.735 -5.557 1.628
371 HA GLU 12 HA GLU 12 6.331 -6.785 2.313
372 HB2 GLU 12 HB3 GLU 12 8.153 -6.220 3.909
373 HB3 GLU 12 HB2 GLU 12 7.683 -4.529 3.804
374 HG2 GLU 12 HG3 GLU 12 5.525 -5.027 4.760
375 HG3 GLU 12 HG2 GLU 12 5.896 -6.750 4.771
376 H LEU 13 H LEU 13 6.960 -3.270 1.933
377 HA LEU 13 HA LEU 13 4.229 -2.585 2.185
378 HB2 LEU 13 HB3 LEU 13 6.549 -1.070 1.017
379 HB3 LEU 13 HB2 LEU 13 4.925 -0.408 1.115
380 HG LEU 13 HG LEU 13 5.928 -1.575 3.605
381 HD11 LEU 13 HD11 LEU 13 7.304 0.402 4.146
382 HD12 LEU 13 HD12 LEU 13 7.107 0.982 2.493
383 HD13 LEU 13 HD13 LEU 13 7.983 -0.517 2.803
384 HD21 LEU 13 HD21 LEU 13 4.862 0.407 4.543
385 HD22 LEU 13 HD22 LEU 13 3.781 -0.425 3.425
386 HD23 LEU 13 HD23 LEU 13 4.607 1.048 2.922
387 H LEU 14 H LEU 14 6.130 -3.522 -0.614
388 HA LEU 14 HA LEU 14 4.220 -2.898 -2.560
389 HB2 LEU 14 HB3 LEU 14 6.496 -3.538 -3.121
390 HB3 LEU 14 HB2 LEU 14 6.260 -5.128 -2.446
391 HG LEU 14 HG LEU 14 6.278 -4.898 -4.974
392 HD11 LEU 14 HD11 LEU 14 5.573 -6.914 -3.844
393 HD12 LEU 14 HD12 LEU 14 4.589 -6.618 -5.279
394 HD13 LEU 14 HD13 LEU 14 3.941 -6.266 -3.675
395 HD21 LEU 14 HD21 LEU 14 4.823 -2.935 -5.137
396 HD22 LEU 14 HD22 LEU 14 3.481 -3.883 -4.497
397 HD23 LEU 14 HD23 LEU 14 4.189 -4.298 -6.057
398 H SER 15 H SER 15 4.649 -5.800 -0.539
399 HA SER 15 HA SER 15 2.279 -7.020 -1.524
400 HB2 SER 15 HB3 SER 15 2.525 -8.521 0.508
401 HB3 SER 15 HB2 SER 15 3.872 -8.511 -0.623
402 HG SER 15 HG SER 15 4.072 -6.645 1.393
403 H LYS 16 H LYS 16 2.954 -4.849 1.235
404 HA LYS 16 HA LYS 16 0.427 -5.036 2.436
405 HB2 LYS 16 HB3 LYS 16 2.329 -2.710 2.194
406 HB3 LYS 16 HB2 LYS 16 0.839 -2.622 3.118
407 HG2 LYS 16 HG3 LYS 16 1.602 -4.451 4.539
408 HG3 LYS 16 HG2 LYS 16 3.097 -4.551 3.609
409 HD2 LYS 16 HD3 LYS 16 3.380 -3.305 5.713
410 HD3 LYS 16 HD2 LYS 16 3.711 -2.310 4.297
411 HE2 LYS 16 HE3 LYS 16 1.617 -1.192 4.492
412 HE3 LYS 16 HE2 LYS 16 1.052 -2.335 5.713
413 HZ1 LYS 16 HZ1 LYS 16 3.325 -0.459 6.066
414 HZ2 LYS 16 HZ2 LYS 16 2.684 -1.487 7.242
415 HZ3 LYS 16 HZ3 LYS 16 1.760 -0.200 6.651
416 H ASN 17 H ASN 17 1.536 -2.779 -0.083
417 HA ASN 17 HA ASN 17 -0.901 -1.534 -0.601
418 HB2 ASN 17 HB3 ASN 17 1.258 -0.720 -1.448
419 HB3 ASN 17 HB2 ASN 17 1.384 -2.123 -2.503
420 HD21 ASN 17 HD21 ASN 17 0.112 -2.231 -4.349
421 HD22 ASN 17 HD22 ASN 17 -0.720 -0.852 -4.975
422 H TYR 18 H TYR 18 0.487 -4.491 -1.960
423 HA TYR 18 HA TYR 18 -1.459 -4.915 -3.941
424 HB2 TYR 18 HB3 TYR 18 0.751 -6.051 -3.867
425 HB3 TYR 18 HB2 TYR 18 0.189 -6.999 -2.493
426 HD1 TYR 18 HD1 TYR 18 -0.447 -6.303 -6.081
427 HD2 TYR 18 HD2 TYR 18 -1.054 -8.974 -2.824
428 HE1 TYR 18 HE1 TYR 18 -1.372 -7.971 -7.629
429 HE2 TYR 18 HE2 TYR 18 -1.981 -10.649 -4.368
430 HH TYR 18 HH TYR 18 -3.004 -10.779 -6.542
431 H HIS 19 H HIS 19 -1.200 -6.172 -0.623
432 HA HIS 19 HA HIS 19 -3.627 -7.664 -0.762
433 HB2 HIS 19 HB3 HIS 19 -2.095 -6.657 1.643
434 HB3 HIS 19 HB2 HIS 19 -3.427 -7.801 1.712
435 HD1 HIS 19 HD1 HIS 19 -0.312 -8.223 2.522
436 HD2 HIS 19 HD2 HIS 19 -2.299 -9.710 -0.811
437 HE1 HIS 19 HE1 HIS 19 1.001 -10.241 1.794
438 HE2 HIS 19 HE2 HIS 19 -0.120 -11.007 -0.328
439 H LEU 20 H LEU 20 -2.802 -4.395 0.116
440 HA LEU 20 HA LEU 20 -5.274 -3.739 1.348
441 HB2 LEU 20 HB3 LEU 20 -3.142 -2.589 1.771
442 HB3 LEU 20 HB2 LEU 20 -3.134 -2.007 0.121
443 HG LEU 20 HG LEU 20 -5.160 -0.709 0.586
444 HD11 LEU 20 HD11 LEU 20 -4.753 -1.680 3.411
445 HD12 LEU 20 HD12 LEU 20 -6.123 -2.047 2.364
446 HD13 LEU 20 HD13 LEU 20 -5.861 -0.398 2.927
447 HD21 LEU 20 HD21 LEU 20 -2.905 0.243 0.803
448 HD22 LEU 20 HD22 LEU 20 -2.904 -0.195 2.511
449 HD23 LEU 20 HD23 LEU 20 -4.054 0.992 1.906
450 H GLU 21 H GLU 21 -3.976 -3.565 -1.917
451 HA GLU 21 HA GLU 21 -6.128 -2.155 -3.101
452 HB2 GLU 21 HB3 GLU 21 -3.914 -2.563 -4.179
453 HB3 GLU 21 HB2 GLU 21 -4.346 -4.256 -4.357
454 HG2 GLU 21 HG3 GLU 21 -6.181 -3.661 -5.821
455 HG3 GLU 21 HG2 GLU 21 -5.823 -1.949 -5.599
456 H ASN 22 H ASN 22 -5.615 -5.513 -2.286
457 HA ASN 22 HA ASN 22 -7.926 -6.560 -3.531
458 HB2 ASN 22 HB3 ASN 22 -6.083 -7.493 -1.378
459 HB3 ASN 22 HB2 ASN 22 -7.627 -8.316 -1.580
460 HD21 ASN 22 HD21 ASN 22 -4.557 -7.572 -3.074
461 HD22 ASN 22 HD22 ASN 22 -4.654 -8.787 -4.301
462 H GLU 23 H GLU 23 -7.360 -4.799 -0.626
463 HA GLU 23 HA GLU 23 -9.790 -5.537 0.695
464 HB2 GLU 23 HB3 GLU 23 -7.712 -4.823 1.885
465 HB3 GLU 23 HB2 GLU 23 -7.967 -3.185 1.248
466 HG2 GLU 23 HG3 GLU 23 -10.025 -2.987 2.480
467 HG3 GLU 23 HG2 GLU 23 -9.906 -4.660 3.024
468 H VAL 24 H VAL 24 -8.746 -2.927 -1.418
469 HA VAL 24 HA VAL 24 -11.098 -1.349 -1.123
470 HB VAL 24 HB VAL 24 -9.348 -1.473 -3.590
471 HG11 VAL 24 HG11 VAL 24 -11.475 -0.277 -3.848
472 HG12 VAL 24 HG12 VAL 24 -10.097 0.818 -3.947
473 HG13 VAL 24 HG13 VAL 24 -11.064 0.752 -2.473
474 HG21 VAL 24 HG21 VAL 24 -7.972 -1.102 -1.578
475 HG22 VAL 24 HG22 VAL 24 -8.977 0.289 -1.172
476 HG23 VAL 24 HG23 VAL 24 -8.007 0.303 -2.642
477 H ALA 25 H ALA 25 -10.153 -4.035 -3.163
478 HA ALA 25 HA ALA 25 -12.241 -3.861 -5.042
479 HB1 ALA 25 HB1 ALA 25 -10.165 -5.163 -5.377
480 HB2 ALA 25 HB2 ALA 25 -11.632 -6.073 -5.731
481 HB3 ALA 25 HB3 ALA 25 -10.767 -6.352 -4.222
482 H ARG 26 H ARG 26 -11.965 -5.731 -2.018
483 HA ARG 26 HA ARG 26 -14.377 -7.118 -2.312
484 HB2 ARG 26 HB3 ARG 26 -14.257 -7.292 0.228
485 HB3 ARG 26 HB2 ARG 26 -12.943 -7.991 -0.695
486 HG2 ARG 26 HG3 ARG 26 -11.613 -5.961 -0.233
487 HG3 ARG 26 HG2 ARG 26 -12.921 -5.368 0.796
488 HD2 ARG 26 HD2 ARG 26 -11.206 -6.440 2.138
489 HD3 ARG 26 HD1 ARG 26 -12.700 -7.375 2.195
490 HE ARG 26 HE ARG 26 -11.163 -8.427 0.135
491 HH11 ARG 26 HH11 ARG 26 -10.945 -8.075 3.608
492 HH12 ARG 26 HH12 ARG 26 -9.972 -9.496 3.818
493 HH21 ARG 26 HH21 ARG 26 -9.903 -10.298 0.400
494 HH22 ARG 26 HH22 ARG 26 -9.392 -10.772 1.990
495 H LEU 27 H LEU 27 -13.686 -4.009 -0.748
496 HA LEU 27 HA LEU 27 -16.311 -3.505 0.124
497 HB2 LEU 27 HB3 LEU 27 -13.978 -1.755 -0.516
498 HB3 LEU 27 HB2 LEU 27 -15.549 -1.027 -0.267
499 HG LEU 27 HG LEU 27 -15.657 -1.968 1.985
500 HD11 LEU 27 HD11 LEU 27 -13.631 -2.965 2.986
501 HD12 LEU 27 HD12 LEU 27 -12.914 -3.043 1.374
502 HD13 LEU 27 HD13 LEU 27 -14.364 -3.978 1.739
503 HD21 LEU 27 HD21 LEU 27 -14.758 0.230 1.740
504 HD22 LEU 27 HD22 LEU 27 -13.164 -0.420 1.364
505 HD23 LEU 27 HD23 LEU 27 -13.843 -0.631 2.977
506 H LYS 28 H LYS 28 -14.741 -2.958 -2.984
507 HA LYS 28 HA LYS 28 -16.786 -1.481 -4.198
508 HB2 LYS 28 HB3 LYS 28 -14.735 -3.342 -5.385
509 HB3 LYS 28 HB2 LYS 28 -15.846 -2.391 -6.363
510 HG2 LYS 28 HG3 LYS 28 -14.957 -0.339 -5.397
511 HG3 LYS 28 HG2 LYS 28 -13.862 -1.284 -4.391
512 HD2 LYS 28 HD3 LYS 28 -12.717 -0.375 -6.339
513 HD3 LYS 28 HD2 LYS 28 -12.750 -2.140 -6.385
514 HE2 LYS 28 HE3 LYS 28 -14.647 -2.052 -7.942
515 HE3 LYS 28 HE2 LYS 28 -14.593 -0.291 -7.898
516 HZ1 LYS 28 HZ1 LYS 28 -12.362 -0.380 -8.830
517 HZ2 LYS 28 HZ2 LYS 28 -13.472 -1.149 -9.846
518 HZ3 LYS 28 HZ3 LYS 28 -12.432 -2.069 -8.886
519 H LYS 29 H LYS 29 -16.564 -4.943 -3.614
520 HA LYS 29 HA LYS 29 -18.773 -5.586 -5.299
521 HB2 LYS 29 HB3 LYS 29 -17.300 -7.038 -3.130
522 HB3 LYS 29 HB2 LYS 29 -18.831 -7.658 -3.706
523 HG2 LYS 29 HG3 LYS 29 -17.008 -8.786 -4.802
524 HG3 LYS 29 HG2 LYS 29 -17.898 -7.829 -5.980
525 HD2 LYS 29 HD3 LYS 29 -16.195 -6.097 -5.882
526 HD3 LYS 29 HD2 LYS 29 -15.331 -6.994 -4.631
527 HE2 LYS 29 HE3 LYS 29 -15.821 -7.903 -7.464
528 HE3 LYS 29 HE2 LYS 29 -14.293 -7.318 -6.809
529 HZ1 LYS 29 HZ1 LYS 29 -14.279 -9.200 -5.279
530 HZ2 LYS 29 HZ2 LYS 29 -14.335 -9.721 -6.887
531 HZ3 LYS 29 HZ3 LYS 29 -15.730 -9.765 -5.937
532 H LEU 30 H LEU 30 -18.392 -4.442 -2.051
533 HA LEU 30 HA LEU 30 -21.127 -4.955 -1.312
534 HB2 LEU 30 HB3 LEU 30 -18.814 -3.555 -0.058
535 HB3 LEU 30 HB2 LEU 30 -20.423 -3.201 0.534
536 HG LEU 30 HG LEU 30 -19.250 -4.894 1.892
537 HD11 LEU 30 HD11 LEU 30 -21.055 -6.439 2.099
538 HD12 LEU 30 HD12 LEU 30 -21.604 -6.105 0.460
539 HD13 LEU 30 HD13 LEU 30 -21.731 -4.858 1.702
540 HD21 LEU 30 HD21 LEU 30 -19.382 -6.584 -0.600
541 HD22 LEU 30 HD22 LEU 30 -18.901 -7.146 1.002
542 HD23 LEU 30 HD23 LEU 30 -17.920 -5.948 0.158
543 H VAL 31 H VAL 31 -19.312 -2.325 -2.717
544 HA VAL 31 HA VAL 31 -21.510 -0.458 -2.427
545 HB VAL 31 HB VAL 31 -18.944 -0.068 -3.989
546 HG11 VAL 31 HG11 VAL 31 -20.921 1.927 -2.890
547 HG12 VAL 31 HG12 VAL 31 -20.730 1.488 -4.588
548 HG13 VAL 31 HG13 VAL 31 -19.421 2.310 -3.737
549 HG21 VAL 31 HG21 VAL 31 -19.570 0.680 -1.136
550 HG22 VAL 31 HG22 VAL 31 -18.109 1.117 -2.024
551 HG23 VAL 31 HG23 VAL 31 -18.445 -0.575 -1.658
552 H GLY 32 H GLY 32 -20.207 -2.586 -4.889
553 HA2 GLY 32 HA3 GLY 32 -22.262 -1.580 -6.744
554 HA3 GLY 32 HA2 GLY 32 -20.612 -1.827 -7.285
555 H GLU 33 H GLU 33 -20.093 -4.266 -5.938
556 HA GLU 33 HA GLU 33 -20.272 -6.506 -6.213
557 HB2 GLU 33 HB3 GLU 33 -22.532 -6.220 -5.259
558 HB3 GLU 33 HB2 GLU 33 -23.171 -5.949 -6.872
559 HG2 GLU 33 HG3 GLU 33 -22.576 -8.207 -7.517
560 HG3 GLU 33 HG2 GLU 33 -21.846 -8.485 -5.935
Start of MODEL 16
1 H1 GLY 1 H1 GLY 1 21.431 -1.797 5.653
2 H2 GLY 1 H2 GLY 1 23.089 -1.578 5.387
3 H3 GLY 1 H3 GLY 1 21.993 -1.389 4.112
4 HA2 GLY 1 HA2 GLY 1 22.094 0.324 6.524
5 HA3 GLY 1 HA3 GLY 1 22.789 0.747 4.966
6 H SER 2 H SER 2 21.283 2.615 5.347
7 HA SER 2 HA SER 2 18.669 1.960 4.159
8 HB2 SER 2 HB3 SER 2 19.258 4.169 6.147
9 HB3 SER 2 HB2 SER 2 17.697 3.857 5.392
10 HG SER 2 HG SER 2 18.984 1.789 6.795
11 H MET 3 H MET 3 20.653 4.847 4.786
12 HA MET 3 HA MET 3 21.004 6.717 3.568
13 HB2 MET 3 HB3 MET 3 22.331 6.342 1.535
14 HB3 MET 3 HB2 MET 3 22.863 5.326 2.861
15 HG2 MET 3 HG3 MET 3 20.953 4.194 0.881
16 HG3 MET 3 HG2 MET 3 22.638 4.405 0.414
17 HE1 MET 3 HE1 MET 3 21.064 1.606 0.466
18 HE2 MET 3 HE2 MET 3 22.292 0.544 1.159
19 HE3 MET 3 HE3 MET 3 22.746 1.749 -0.046
20 H LYS 4 H LYS 4 20.971 7.011 0.701
21 HA LYS 4 HA LYS 4 18.326 8.023 0.500
22 HB2 LYS 4 HB3 LYS 4 20.269 9.141 -0.526
23 HB3 LYS 4 HB2 LYS 4 20.461 7.787 -1.628
24 HG2 LYS 4 HG3 LYS 4 18.253 8.264 -2.583
25 HG3 LYS 4 HG2 LYS 4 18.100 9.647 -1.500
26 HD2 LYS 4 HD3 LYS 4 20.249 9.288 -3.589
27 HD3 LYS 4 HD2 LYS 4 18.820 10.305 -3.759
28 HE2 LYS 4 HE3 LYS 4 21.016 10.640 -1.718
29 HE3 LYS 4 HE2 LYS 4 20.767 11.635 -3.150
30 HZ1 LYS 4 HZ1 LYS 4 19.891 12.721 -1.199
31 HZ2 LYS 4 HZ2 LYS 4 18.907 11.393 -0.849
32 HZ3 LYS 4 HZ3 LYS 4 18.619 12.312 -2.236
33 H GLN 5 H GLN 5 19.965 5.191 -0.715
34 HA GLN 5 HA GLN 5 18.279 4.477 -2.807
35 HB2 GLN 5 HB3 GLN 5 19.694 2.555 -0.957
36 HB3 GLN 5 HB2 GLN 5 19.183 2.247 -2.609
37 HG2 GLN 5 HG3 GLN 5 20.759 4.046 -3.337
38 HG3 GLN 5 HG2 GLN 5 21.354 4.103 -1.683
39 HE21 GLN 5 HE21 GLN 5 23.407 3.456 -2.212
40 HE22 GLN 5 HE22 GLN 5 23.781 1.846 -2.716
41 H LEU 6 H LEU 6 18.197 3.264 0.549
42 HA LEU 6 HA LEU 6 15.891 1.687 0.136
43 HB2 LEU 6 HB3 LEU 6 17.295 2.692 2.590
44 HB3 LEU 6 HB2 LEU 6 15.760 1.862 2.740
45 HG LEU 6 HG LEU 6 17.617 0.342 3.150
46 HD11 LEU 6 HD11 LEU 6 15.643 -0.629 2.207
47 HD12 LEU 6 HD12 LEU 6 17.058 -1.405 1.497
48 HD13 LEU 6 HD13 LEU 6 16.158 -0.201 0.580
49 HD21 LEU 6 HD21 LEU 6 19.336 1.414 1.810
50 HD22 LEU 6 HD22 LEU 6 18.482 0.970 0.333
51 HD23 LEU 6 HD23 LEU 6 19.167 -0.284 1.365
52 H GLU 7 H GLU 7 16.318 4.912 1.562
53 HA GLU 7 HA GLU 7 13.664 5.297 2.370
54 HB2 GLU 7 HB3 GLU 7 15.735 7.326 1.523
55 HB3 GLU 7 HB2 GLU 7 14.213 7.731 2.305
56 HG2 GLU 7 HG3 GLU 7 14.892 6.393 4.257
57 HG3 GLU 7 HG2 GLU 7 16.439 6.074 3.472
58 H ASP 8 H ASP 8 15.221 5.884 -0.738
59 HA ASP 8 HA ASP 8 12.932 7.292 -1.785
60 HB2 ASP 8 HB3 ASP 8 15.593 6.493 -2.887
61 HB3 ASP 8 HB2 ASP 8 14.309 6.981 -3.988
62 H LYS 9 H LYS 9 13.709 4.026 -1.412
63 HA LYS 9 HA LYS 9 11.860 3.285 -3.561
64 HB2 LYS 9 HB3 LYS 9 14.006 1.873 -2.125
65 HB3 LYS 9 HB2 LYS 9 12.575 0.910 -2.462
66 HG2 LYS 9 HG3 LYS 9 14.149 0.617 -4.244
67 HG3 LYS 9 HG2 LYS 9 12.766 1.529 -4.848
68 HD2 LYS 9 HD3 LYS 9 14.049 3.614 -4.561
69 HD3 LYS 9 HD2 LYS 9 15.439 2.666 -4.028
70 HE2 LYS 9 HE3 LYS 9 15.451 1.504 -6.196
71 HE3 LYS 9 HE2 LYS 9 14.093 2.498 -6.722
72 HZ1 LYS 9 HZ1 LYS 9 16.164 3.376 -7.554
73 HZ2 LYS 9 HZ2 LYS 9 16.794 3.481 -5.989
74 HZ3 LYS 9 HZ3 LYS 9 15.492 4.459 -6.442
75 H VAL 10 H VAL 10 12.348 2.493 -0.117
76 HA VAL 10 HA VAL 10 9.917 1.052 0.062
77 HB VAL 10 HB VAL 10 11.892 0.669 1.501
78 HG11 VAL 10 HG11 VAL 10 12.187 2.018 3.528
79 HG12 VAL 10 HG12 VAL 10 10.981 3.158 2.929
80 HG13 VAL 10 HG13 VAL 10 12.499 2.942 2.058
81 HG21 VAL 10 HG21 VAL 10 9.292 1.170 2.924
82 HG22 VAL 10 HG22 VAL 10 10.609 0.164 3.526
83 HG23 VAL 10 HG23 VAL 10 9.751 -0.294 2.054
84 H GLU 11 H GLU 11 10.757 4.382 0.962
85 HA GLU 11 HA GLU 11 8.140 4.848 2.090
86 HB2 GLU 11 HB3 GLU 11 10.181 5.982 2.951
87 HB3 GLU 11 HB2 GLU 11 10.326 6.833 1.421
88 HG2 GLU 11 HG3 GLU 11 8.265 7.996 1.809
89 HG3 GLU 11 HG2 GLU 11 7.954 7.045 3.260
90 H GLU 12 H GLU 12 9.849 5.507 -0.905
91 HA GLU 12 HA GLU 12 7.984 7.115 -2.196
92 HB2 GLU 12 HB3 GLU 12 10.307 6.302 -2.990
93 HB3 GLU 12 HB2 GLU 12 9.450 4.903 -3.614
94 HG2 GLU 12 HG3 GLU 12 8.788 7.736 -4.376
95 HG3 GLU 12 HG2 GLU 12 9.912 6.720 -5.271
96 H LEU 13 H LEU 13 8.200 3.527 -2.253
97 HA LEU 13 HA LEU 13 5.618 3.297 -3.416
98 HB2 LEU 13 HB3 LEU 13 7.637 1.415 -2.407
99 HB3 LEU 13 HB2 LEU 13 5.974 0.847 -2.371
100 HG LEU 13 HG LEU 13 5.887 1.708 -4.810
101 HD11 LEU 13 HD11 LEU 13 8.859 1.329 -4.415
102 HD12 LEU 13 HD12 LEU 13 8.034 2.840 -4.807
103 HD13 LEU 13 HD13 LEU 13 8.054 1.519 -5.975
104 HD21 LEU 13 HD21 LEU 13 7.324 -0.805 -3.960
105 HD22 LEU 13 HD22 LEU 13 6.802 -0.487 -5.613
106 HD23 LEU 13 HD23 LEU 13 5.607 -0.610 -4.322
107 H LEU 14 H LEU 14 6.520 4.017 -0.239
108 HA LEU 14 HA LEU 14 4.250 2.867 1.041
109 HB2 LEU 14 HB3 LEU 14 6.299 3.595 2.257
110 HB3 LEU 14 HB2 LEU 14 5.898 5.258 1.881
111 HG LEU 14 HG LEU 14 3.608 4.394 3.114
112 HD11 LEU 14 HD11 LEU 14 5.959 3.051 4.424
113 HD12 LEU 14 HD12 LEU 14 4.510 2.279 3.778
114 HD13 LEU 14 HD13 LEU 14 4.399 3.309 5.202
115 HD21 LEU 14 HD21 LEU 14 4.391 5.690 5.023
116 HD22 LEU 14 HD22 LEU 14 4.747 6.500 3.498
117 HD23 LEU 14 HD23 LEU 14 6.030 5.663 4.371
118 H SER 15 H SER 15 4.738 5.514 -1.056
119 HA SER 15 HA SER 15 2.722 7.268 -0.399
120 HB2 SER 15 HB3 SER 15 2.529 7.760 -2.821
121 HB3 SER 15 HB2 SER 15 4.205 7.673 -2.284
122 HG SER 15 HG SER 15 4.506 5.880 -3.400
123 H LYS 16 H LYS 16 2.365 4.188 -2.244
124 HA LYS 16 HA LYS 16 -0.422 4.492 -2.616
125 HB2 LYS 16 HB3 LYS 16 -0.496 2.129 -3.160
126 HB3 LYS 16 HB2 LYS 16 0.940 2.845 -3.881
127 HG2 LYS 16 HG3 LYS 16 2.330 1.896 -2.166
128 HG3 LYS 16 HG2 LYS 16 0.913 1.276 -1.314
129 HD2 LYS 16 HD3 LYS 16 0.497 -0.345 -2.920
130 HD3 LYS 16 HD2 LYS 16 1.407 0.513 -4.164
131 HE2 LYS 16 HE3 LYS 16 2.590 -0.837 -1.740
132 HE3 LYS 16 HE2 LYS 16 2.595 -1.491 -3.382
133 HZ1 LYS 16 HZ1 LYS 16 3.894 1.032 -2.513
134 HZ2 LYS 16 HZ2 LYS 16 3.867 0.434 -4.095
135 HZ3 LYS 16 HZ3 LYS 16 4.681 -0.421 -2.884
136 H ASN 17 H ASN 17 1.226 3.895 0.305
137 HA ASN 17 HA ASN 17 -0.637 2.230 1.638
138 HB2 ASN 17 HB3 ASN 17 1.729 2.959 2.398
139 HB3 ASN 17 HB2 ASN 17 0.949 4.421 2.981
140 HD21 ASN 17 HD21 ASN 17 2.364 2.406 4.467
141 HD22 ASN 17 HD22 ASN 17 1.259 1.748 5.618
142 H TYR 18 H TYR 18 -0.274 5.714 1.358
143 HA TYR 18 HA TYR 18 -2.615 6.320 2.898
144 HB2 TYR 18 HB3 TYR 18 -1.078 8.141 1.032
145 HB3 TYR 18 HB2 TYR 18 -2.166 8.627 2.327
146 HD1 TYR 18 HD1 TYR 18 -1.483 8.166 4.714
147 HD2 TYR 18 HD2 TYR 18 1.202 7.742 1.445
148 HE1 TYR 18 HE1 TYR 18 0.419 8.277 6.269
149 HE2 TYR 18 HE2 TYR 18 3.112 7.850 2.988
150 HH TYR 18 HH TYR 18 2.762 7.596 6.369
151 H HIS 19 H HIS 19 -1.746 6.126 -0.501
152 HA HIS 19 HA HIS 19 -4.077 7.288 -1.563
153 HB2 HIS 19 HB3 HIS 19 -2.211 5.252 -2.790
154 HB3 HIS 19 HB2 HIS 19 -3.456 6.122 -3.673
155 HD1 HIS 19 HD1 HIS 19 -0.659 6.460 -4.669
156 HD2 HIS 19 HD2 HIS 19 -2.278 8.898 -1.720
157 HE1 HIS 19 HE1 HIS 19 0.702 8.570 -4.715
158 HE2 HIS 19 HE2 HIS 19 -0.395 10.088 -3.032
159 H LEU 20 H LEU 20 -3.207 3.859 -1.155
160 HA LEU 20 HA LEU 20 -5.711 2.867 -2.010
161 HB2 LEU 20 HB3 LEU 20 -3.255 1.790 -0.856
162 HB3 LEU 20 HB2 LEU 20 -4.687 0.930 -0.336
163 HG LEU 20 HG LEU 20 -3.567 -0.062 -2.333
164 HD11 LEU 20 HD11 LEU 20 -5.607 -0.428 -3.602
165 HD12 LEU 20 HD12 LEU 20 -6.363 0.953 -2.808
166 HD13 LEU 20 HD13 LEU 20 -5.933 -0.477 -1.870
167 HD21 LEU 20 HD21 LEU 20 -2.849 1.999 -3.418
168 HD22 LEU 20 HD22 LEU 20 -4.532 2.444 -3.698
169 HD23 LEU 20 HD23 LEU 20 -3.852 1.030 -4.497
170 H GLU 21 H GLU 21 -4.463 3.841 1.144
171 HA GLU 21 HA GLU 21 -6.572 2.748 2.682
172 HB2 GLU 21 HB3 GLU 21 -4.384 3.623 3.578
173 HB3 GLU 21 HB2 GLU 21 -5.007 5.248 3.334
174 HG2 GLU 21 HG3 GLU 21 -6.840 4.779 4.877
175 HG3 GLU 21 HG2 GLU 21 -6.213 3.150 5.124
176 H ASN 22 H ASN 22 -6.150 5.843 1.044
177 HA ASN 22 HA ASN 22 -8.543 7.031 1.974
178 HB2 ASN 22 HB3 ASN 22 -6.616 7.616 -0.216
179 HB3 ASN 22 HB2 ASN 22 -8.201 8.376 -0.291
180 HD21 ASN 22 HD21 ASN 22 -5.212 8.149 1.459
181 HD22 ASN 22 HD22 ASN 22 -5.445 9.560 2.433
182 H GLU 23 H GLU 23 -7.887 4.689 -0.467
183 HA GLU 23 HA GLU 23 -10.356 5.068 -1.894
184 HB2 GLU 23 HB3 GLU 23 -8.516 2.657 -1.899
185 HB3 GLU 23 HB2 GLU 23 -9.789 3.020 -3.084
186 HG2 GLU 23 HG3 GLU 23 -7.217 4.525 -2.638
187 HG3 GLU 23 HG2 GLU 23 -7.652 3.538 -4.031
188 H VAL 24 H VAL 24 -9.102 2.750 0.489
189 HA VAL 24 HA VAL 24 -11.433 1.185 0.667
190 HB VAL 24 HB VAL 24 -9.368 1.618 2.844
191 HG11 VAL 24 HG11 VAL 24 -10.076 -0.520 3.702
192 HG12 VAL 24 HG12 VAL 24 -11.216 -0.722 2.371
193 HG13 VAL 24 HG13 VAL 24 -11.479 0.541 3.577
194 HG21 VAL 24 HG21 VAL 24 -8.272 -0.365 1.970
195 HG22 VAL 24 HG22 VAL 24 -8.334 0.907 0.750
196 HG23 VAL 24 HG23 VAL 24 -9.451 -0.455 0.664
197 H ALA 25 H ALA 25 -10.382 4.071 2.395
198 HA ALA 25 HA ALA 25 -12.454 4.024 4.337
199 HB1 ALA 25 HB1 ALA 25 -10.295 5.241 4.583
200 HB2 ALA 25 HB2 ALA 25 -11.723 6.201 4.970
201 HB3 ALA 25 HB3 ALA 25 -10.899 6.432 3.431
202 H ARG 26 H ARG 26 -12.256 5.306 1.086
203 HA ARG 26 HA ARG 26 -14.499 7.046 1.328
204 HB2 ARG 26 HB3 ARG 26 -14.129 7.593 -0.857
205 HB3 ARG 26 HB2 ARG 26 -12.573 6.877 -0.486
206 HG2 ARG 26 HG3 ARG 26 -13.249 4.789 -1.546
207 HG3 ARG 26 HG2 ARG 26 -14.841 5.482 -1.892
208 HD2 ARG 26 HD2 ARG 26 -13.709 7.268 -3.201
209 HD3 ARG 26 HD1 ARG 26 -12.180 6.432 -2.941
210 HE ARG 26 HE ARG 26 -14.125 4.708 -4.101
211 HH11 ARG 26 HH11 ARG 26 -11.893 7.299 -4.838
212 HH12 ARG 26 HH12 ARG 26 -11.727 6.857 -6.509
213 HH21 ARG 26 HH21 ARG 26 -13.904 4.118 -6.302
214 HH22 ARG 26 HH22 ARG 26 -12.861 5.043 -7.337
215 H LEU 27 H LEU 27 -14.040 3.748 0.231
216 HA LEU 27 HA LEU 27 -16.736 3.245 -0.459
217 HB2 LEU 27 HB3 LEU 27 -14.492 1.421 0.348
218 HB3 LEU 27 HB2 LEU 27 -16.059 0.839 -0.171
219 HG LEU 27 HG LEU 27 -14.764 2.736 -2.002
220 HD11 LEU 27 HD11 LEU 27 -12.864 1.399 -1.167
221 HD12 LEU 27 HD12 LEU 27 -13.194 1.175 -2.887
222 HD13 LEU 27 HD13 LEU 27 -13.697 -0.049 -1.726
223 HD21 LEU 27 HD21 LEU 27 -16.111 0.068 -2.352
224 HD22 LEU 27 HD22 LEU 27 -15.589 1.131 -3.658
225 HD23 LEU 27 HD23 LEU 27 -16.861 1.651 -2.555
226 H LYS 28 H LYS 28 -14.967 3.014 2.577
227 HA LYS 28 HA LYS 28 -16.803 1.763 4.209
228 HB2 LYS 28 HB3 LYS 28 -15.006 4.121 4.741
229 HB3 LYS 28 HB2 LYS 28 -16.007 3.416 5.999
230 HG2 LYS 28 HG3 LYS 28 -13.938 1.901 4.425
231 HG3 LYS 28 HG2 LYS 28 -13.662 2.627 6.010
232 HD2 LYS 28 HD3 LYS 28 -15.629 1.249 6.825
233 HD3 LYS 28 HD2 LYS 28 -15.530 0.380 5.292
234 HE2 LYS 28 HE3 LYS 28 -13.312 0.635 7.320
235 HE3 LYS 28 HE2 LYS 28 -14.330 -0.783 7.084
236 HZ1 LYS 28 HZ1 LYS 28 -12.217 -1.034 5.969
237 HZ2 LYS 28 HZ2 LYS 28 -12.479 0.377 5.078
238 HZ3 LYS 28 HZ3 LYS 28 -13.468 -0.976 4.834
239 H LYS 29 H LYS 29 -16.810 5.128 3.110
240 HA LYS 29 HA LYS 29 -19.163 5.819 4.574
241 HB2 LYS 29 HB3 LYS 29 -17.632 7.191 2.374
242 HB3 LYS 29 HB2 LYS 29 -19.068 7.874 3.108
243 HG2 LYS 29 HG3 LYS 29 -16.569 7.148 4.615
244 HG3 LYS 29 HG2 LYS 29 -16.953 8.766 4.026
245 HD2 LYS 29 HD3 LYS 29 -18.621 7.176 5.979
246 HD3 LYS 29 HD2 LYS 29 -17.509 8.475 6.410
247 HE2 LYS 29 HE3 LYS 29 -18.835 10.033 5.035
248 HE3 LYS 29 HE2 LYS 29 -19.961 8.729 4.670
249 HZ1 LYS 29 HZ1 LYS 29 -20.503 8.573 7.009
250 HZ2 LYS 29 HZ2 LYS 29 -20.760 10.153 6.459
251 HZ3 LYS 29 HZ3 LYS 29 -19.392 9.792 7.383
252 H LEU 30 H LEU 30 -18.533 4.390 1.491
253 HA LEU 30 HA LEU 30 -21.101 5.074 0.377
254 HB2 LEU 30 HB3 LEU 30 -19.042 3.068 -0.541
255 HB3 LEU 30 HB2 LEU 30 -20.471 3.533 -1.444
256 HG LEU 30 HG LEU 30 -18.188 5.372 -0.718
257 HD11 LEU 30 HD11 LEU 30 -18.970 4.133 -3.351
258 HD12 LEU 30 HD12 LEU 30 -17.540 3.742 -2.395
259 HD13 LEU 30 HD13 LEU 30 -17.707 5.341 -3.119
260 HD21 LEU 30 HD21 LEU 30 -20.653 5.839 -2.392
261 HD22 LEU 30 HD22 LEU 30 -19.299 6.957 -2.233
262 HD23 LEU 30 HD23 LEU 30 -20.294 6.573 -0.829
263 H VAL 31 H VAL 31 -19.641 2.275 1.948
264 HA VAL 31 HA VAL 31 -22.044 0.691 1.666
265 HB VAL 31 HB VAL 31 -19.626 0.116 3.401
266 HG11 VAL 31 HG11 VAL 31 -20.370 -2.206 3.267
267 HG12 VAL 31 HG12 VAL 31 -21.779 -1.702 2.334
268 HG13 VAL 31 HG13 VAL 31 -21.597 -1.178 4.009
269 HG21 VAL 31 HG21 VAL 31 -18.943 0.388 1.087
270 HG22 VAL 31 HG22 VAL 31 -20.196 -0.740 0.570
271 HG23 VAL 31 HG23 VAL 31 -18.855 -1.306 1.566
272 H GLY 32 H GLY 32 -20.604 2.815 4.029
273 HA2 GLY 32 HA3 GLY 32 -22.397 1.888 6.133
274 HA3 GLY 32 HA2 GLY 32 -21.101 3.060 6.308
275 H GLU 33 H GLU 33 -21.735 4.850 4.311
276 HA GLU 33 HA GLU 33 -22.905 6.743 3.961
277 HB2 GLU 33 HB3 GLU 33 -25.286 5.002 4.634
278 HB3 GLU 33 HB2 GLU 33 -25.365 6.585 3.874
279 HG2 GLU 33 HG3 GLU 33 -24.121 5.736 1.955
280 HG3 GLU 33 HG2 GLU 33 -24.025 4.150 2.718
281 H1 GLY 1 H1 GLY 1 21.418 1.549 -6.402
282 H2 GLY 1 H2 GLY 1 23.070 1.321 -6.121
283 H3 GLY 1 H3 GLY 1 21.964 1.152 -4.851
284 HA2 GLY 1 HA2 GLY 1 22.058 -0.583 -7.251
285 HA3 GLY 1 HA3 GLY 1 22.753 -0.997 -5.690
286 H SER 2 H SER 2 21.240 -2.857 -6.046
287 HA SER 2 HA SER 2 18.633 -2.190 -4.854
288 HB2 SER 2 HB3 SER 2 19.216 -4.404 -6.839
289 HB3 SER 2 HB2 SER 2 17.663 -4.113 -6.057
290 HG SER 2 HG SER 2 18.916 -2.053 -7.512
291 H MET 3 H MET 3 20.608 -5.090 -5.471
292 HA MET 3 HA MET 3 20.968 -6.947 -4.239
293 HB2 MET 3 HB3 MET 3 22.302 -6.554 -2.212
294 HB3 MET 3 HB2 MET 3 22.831 -5.553 -3.550
295 HG2 MET 3 HG3 MET 3 20.929 -4.400 -1.577
296 HG3 MET 3 HG2 MET 3 22.615 -4.609 -1.113
297 HE1 MET 3 HE1 MET 3 21.051 -1.807 -1.184
298 HE2 MET 3 HE2 MET 3 22.281 -0.757 -1.889
299 HE3 MET 3 HE3 MET 3 22.733 -1.956 -0.677
300 H LYS 4 H LYS 4 20.946 -7.217 -1.368
301 HA LYS 4 HA LYS 4 18.299 -8.223 -1.147
302 HB2 LYS 4 HB3 LYS 4 20.244 -9.333 -0.117
303 HB3 LYS 4 HB2 LYS 4 20.443 -7.968 0.972
304 HG2 LYS 4 HG3 LYS 4 18.238 -8.436 1.942
305 HG3 LYS 4 HG2 LYS 4 18.075 -9.825 0.868
306 HD2 LYS 4 HD3 LYS 4 20.236 -9.459 2.942
307 HD3 LYS 4 HD2 LYS 4 18.806 -10.473 3.126
308 HE2 LYS 4 HE3 LYS 4 20.989 -10.823 1.073
309 HE3 LYS 4 HE2 LYS 4 20.750 -11.809 2.513
310 HZ1 LYS 4 HZ1 LYS 4 19.859 -12.907 0.579
311 HZ2 LYS 4 HZ2 LYS 4 18.873 -11.583 0.224
312 HZ3 LYS 4 HZ3 LYS 4 18.595 -12.488 1.620
313 H GLN 5 H GLN 5 19.948 -5.386 0.041
314 HA GLN 5 HA GLN 5 18.268 -4.652 2.129
315 HB2 GLN 5 HB3 GLN 5 19.683 -2.747 0.259
316 HB3 GLN 5 HB2 GLN 5 19.178 -2.426 1.912
317 HG2 GLN 5 HG3 GLN 5 20.749 -4.218 2.654
318 HG3 GLN 5 HG2 GLN 5 21.339 -4.300 0.996
319 HE21 GLN 5 HE21 GLN 5 23.399 -3.652 1.510
320 HE22 GLN 5 HE22 GLN 5 23.781 -2.038 2.006
321 H LEU 6 H LEU 6 18.178 -3.464 -1.236
322 HA LEU 6 HA LEU 6 15.879 -1.878 -0.827
323 HB2 LEU 6 HB3 LEU 6 17.267 -2.905 -3.279
324 HB3 LEU 6 HB2 LEU 6 15.734 -2.071 -3.428
325 HG LEU 6 HG LEU 6 17.593 -0.559 -3.855
326 HD11 LEU 6 HD11 LEU 6 15.627 0.424 -2.908
327 HD12 LEU 6 HD12 LEU 6 17.050 1.202 -2.213
328 HD13 LEU 6 HD13 LEU 6 16.153 0.008 -1.281
329 HD21 LEU 6 HD21 LEU 6 19.316 -1.624 -2.517
330 HD22 LEU 6 HD22 LEU 6 18.471 -1.169 -1.038
331 HD23 LEU 6 HD23 LEU 6 19.154 0.077 -2.082
332 H GLU 7 H GLU 7 16.291 -5.115 -2.222
333 HA GLU 7 HA GLU 7 13.634 -5.501 -3.018
334 HB2 GLU 7 HB3 GLU 7 15.705 -7.524 -2.163
335 HB3 GLU 7 HB2 GLU 7 14.178 -7.932 -2.933
336 HG2 GLU 7 HG3 GLU 7 14.844 -6.613 -4.898
337 HG3 GLU 7 HG2 GLU 7 16.397 -6.290 -4.128
338 H ASP 8 H ASP 8 15.206 -6.072 0.087
339 HA ASP 8 HA ASP 8 12.916 -7.459 1.157
340 HB2 ASP 8 HB3 ASP 8 15.582 -6.653 2.246
341 HB3 ASP 8 HB2 ASP 8 14.298 -7.128 3.353
342 H LYS 9 H LYS 9 13.701 -4.199 0.752
343 HA LYS 9 HA LYS 9 11.864 -3.437 2.904
344 HB2 LYS 9 HB3 LYS 9 14.005 -2.040 1.447
345 HB3 LYS 9 HB2 LYS 9 12.579 -1.073 1.783
346 HG2 LYS 9 HG3 LYS 9 14.160 -0.768 3.553
347 HG3 LYS 9 HG2 LYS 9 12.777 -1.670 4.172
348 HD2 LYS 9 HD3 LYS 9 14.054 -3.762 3.894
349 HD3 LYS 9 HD2 LYS 9 15.444 -2.819 3.349
350 HE2 LYS 9 HE3 LYS 9 15.464 -1.642 5.507
351 HE3 LYS 9 HE2 LYS 9 14.109 -2.630 6.047
352 HZ1 LYS 9 HZ1 LYS 9 16.182 -3.506 6.875
353 HZ2 LYS 9 HZ2 LYS 9 16.807 -3.617 5.311
354 HZ3 LYS 9 HZ3 LYS 9 15.510 -4.597 5.770
355 H VAL 10 H VAL 10 12.335 -2.673 -0.551
356 HA VAL 10 HA VAL 10 9.908 -1.225 -0.733
357 HB VAL 10 HB VAL 10 11.878 -0.860 -2.184
358 HG11 VAL 10 HG11 VAL 10 12.160 -2.227 -4.202
359 HG12 VAL 10 HG12 VAL 10 10.951 -3.357 -3.592
360 HG13 VAL 10 HG13 VAL 10 12.473 -3.142 -2.726
361 HG21 VAL 10 HG21 VAL 10 9.268 -1.365 -3.591
362 HG22 VAL 10 HG22 VAL 10 10.586 -0.367 -4.207
363 HG23 VAL 10 HG23 VAL 10 9.737 0.105 -2.735
364 H GLU 11 H GLU 11 10.736 -4.566 -1.600
365 HA GLU 11 HA GLU 11 8.116 -5.033 -2.723
366 HB2 GLU 11 HB3 GLU 11 10.149 -6.185 -3.581
367 HB3 GLU 11 HB2 GLU 11 10.296 -7.021 -2.041
368 HG2 GLU 11 HG3 GLU 11 8.227 -8.180 -2.408
369 HG3 GLU 11 HG2 GLU 11 7.918 -7.243 -3.869
370 H GLU 12 H GLU 12 9.835 -5.674 0.269
371 HA GLU 12 HA GLU 12 7.969 -7.268 1.581
372 HB2 GLU 12 HB3 GLU 12 10.298 -6.457 2.362
373 HB3 GLU 12 HB2 GLU 12 9.449 -5.050 2.977
374 HG2 GLU 12 HG3 GLU 12 8.783 -7.875 3.767
375 HG3 GLU 12 HG2 GLU 12 9.905 -6.847 4.651
376 H LEU 13 H LEU 13 8.195 -3.676 1.612
377 HA LEU 13 HA LEU 13 5.618 -3.433 2.786
378 HB2 LEU 13 HB3 LEU 13 7.636 -1.562 1.754
379 HB3 LEU 13 HB2 LEU 13 5.975 -0.991 1.723
380 HG LEU 13 HG LEU 13 5.897 -1.836 4.169
381 HD11 LEU 13 HD11 LEU 13 8.868 -1.467 3.757
382 HD12 LEU 13 HD12 LEU 13 8.041 -2.974 4.162
383 HD13 LEU 13 HD13 LEU 13 8.070 -1.645 5.321
384 HD21 LEU 13 HD21 LEU 13 7.343 0.664 3.293
385 HD22 LEU 13 HD22 LEU 13 6.824 0.362 4.951
386 HD23 LEU 13 HD23 LEU 13 5.626 0.479 3.663
387 H LEU 14 H LEU 14 6.504 -4.172 -0.391
388 HA LEU 14 HA LEU 14 4.228 -3.033 -1.668
389 HB2 LEU 14 HB3 LEU 14 6.271 -3.774 -2.884
390 HB3 LEU 14 HB2 LEU 14 5.867 -5.434 -2.495
391 HG LEU 14 HG LEU 14 3.575 -4.571 -3.723
392 HD11 LEU 14 HD11 LEU 14 5.925 -3.249 -5.058
393 HD12 LEU 14 HD12 LEU 14 4.483 -2.465 -4.409
394 HD13 LEU 14 HD13 LEU 14 4.359 -3.507 -5.823
395 HD21 LEU 14 HD21 LEU 14 4.342 -5.886 -5.625
396 HD22 LEU 14 HD22 LEU 14 4.703 -6.685 -4.095
397 HD23 LEU 14 HD23 LEU 14 5.984 -5.861 -4.983
398 H SER 15 H SER 15 4.714 -5.659 0.453
399 HA SER 15 HA SER 15 2.694 -7.417 -0.184
400 HB2 SER 15 HB3 SER 15 2.508 -7.889 2.246
401 HB3 SER 15 HB2 SER 15 4.183 -7.817 1.698
402 HG SER 15 HG SER 15 4.501 -6.024 2.802
403 H LYS 16 H LYS 16 2.358 -4.320 1.633
404 HA LYS 16 HA LYS 16 -0.429 -4.616 2.020
405 HB2 LYS 16 HB3 LYS 16 -0.495 -2.248 2.546
406 HB3 LYS 16 HB2 LYS 16 0.943 -2.963 3.266
407 HG2 LYS 16 HG3 LYS 16 2.327 -2.032 1.540
408 HG3 LYS 16 HG2 LYS 16 0.910 -1.413 0.689
409 HD2 LYS 16 HD3 LYS 16 0.506 0.222 2.283
410 HD3 LYS 16 HD2 LYS 16 1.418 -0.631 3.531
411 HE2 LYS 16 HE3 LYS 16 2.597 0.695 1.093
412 HE3 LYS 16 HE2 LYS 16 2.608 1.362 2.729
413 HZ1 LYS 16 HZ1 LYS 16 3.898 -1.170 1.875
414 HZ2 LYS 16 HZ2 LYS 16 3.877 -0.559 3.454
415 HZ3 LYS 16 HZ3 LYS 16 4.688 0.284 2.233
416 H ASN 17 H ASN 17 1.208 -4.039 -0.913
417 HA ASN 17 HA ASN 17 -0.655 -2.386 -2.252
418 HB2 ASN 17 HB3 ASN 17 1.709 -3.126 -3.010
419 HB3 ASN 17 HB2 ASN 17 0.922 -4.590 -3.580
420 HD21 ASN 17 HD21 ASN 17 2.340 -2.598 -5.090
421 HD22 ASN 17 HD22 ASN 17 1.237 -1.957 -6.248
422 H TYR 18 H TYR 18 -0.301 -5.869 -1.951
423 HA TYR 18 HA TYR 18 -2.653 -6.482 -3.469
424 HB2 TYR 18 HB3 TYR 18 -1.115 -8.290 -1.593
425 HB3 TYR 18 HB2 TYR 18 -2.208 -8.785 -2.879
426 HD1 TYR 18 HD1 TYR 18 -1.534 -8.346 -5.276
427 HD2 TYR 18 HD2 TYR 18 1.168 -7.904 -2.019
428 HE1 TYR 18 HE1 TYR 18 0.361 -8.475 -6.837
429 HE2 TYR 18 HE2 TYR 18 3.071 -8.032 -3.571
430 HH TYR 18 HH TYR 18 2.712 -7.782 -6.939
431 H HIS 19 H HIS 19 -1.769 -6.253 -0.075
432 HA HIS 19 HA HIS 19 -4.097 -7.410 1.006
433 HB2 HIS 19 HB3 HIS 19 -2.222 -5.367 2.212
434 HB3 HIS 19 HB2 HIS 19 -3.462 -6.230 3.107
435 HD1 HIS 19 HD1 HIS 19 -0.663 -6.561 4.091
436 HD2 HIS 19 HD2 HIS 19 -2.307 -9.027 1.174
437 HE1 HIS 19 HE1 HIS 19 0.699 -8.672 4.143
438 HE2 HIS 19 HE2 HIS 19 -0.437 -10.215 2.508
439 H LEU 20 H LEU 20 -3.218 -3.987 0.567
440 HA LEU 20 HA LEU 20 -5.714 -2.982 1.427
441 HB2 LEU 20 HB3 LEU 20 -3.261 -1.922 0.254
442 HB3 LEU 20 HB2 LEU 20 -4.695 -1.060 -0.264
443 HG LEU 20 HG LEU 20 -3.561 -0.058 1.719
444 HD11 LEU 20 HD11 LEU 20 -5.593 0.319 2.998
445 HD12 LEU 20 HD12 LEU 20 -6.356 -1.064 2.214
446 HD13 LEU 20 HD13 LEU 20 -5.925 0.360 1.267
447 HD21 LEU 20 HD21 LEU 20 -2.840 -2.110 2.819
448 HD22 LEU 20 HD22 LEU 20 -4.523 -2.552 3.109
449 HD23 LEU 20 HD23 LEU 20 -3.839 -1.131 3.893
450 H GLU 21 H GLU 21 -4.485 -3.976 -1.727
451 HA GLU 21 HA GLU 21 -6.601 -2.897 -3.261
452 HB2 GLU 21 HB3 GLU 21 -4.418 -3.784 -4.159
453 HB3 GLU 21 HB2 GLU 21 -5.042 -5.406 -3.895
454 HG2 GLU 21 HG3 GLU 21 -6.882 -4.946 -5.436
455 HG3 GLU 21 HG2 GLU 21 -6.251 -3.324 -5.701
456 H ASN 22 H ASN 22 -6.182 -5.982 -1.603
457 HA ASN 22 HA ASN 22 -8.582 -7.169 -2.512
458 HB2 ASN 22 HB3 ASN 22 -6.646 -7.741 -0.326
459 HB3 ASN 22 HB2 ASN 22 -8.235 -8.494 -0.236
460 HD21 ASN 22 HD21 ASN 22 -5.255 -8.290 -2.014
461 HD22 ASN 22 HD22 ASN 22 -5.500 -9.717 -2.965
462 H GLU 23 H GLU 23 -7.907 -4.811 -0.094
463 HA GLU 23 HA GLU 23 -10.368 -5.171 1.350
464 HB2 GLU 23 HB3 GLU 23 -8.523 -2.765 1.329
465 HB3 GLU 23 HB2 GLU 23 -9.790 -3.119 2.523
466 HG2 GLU 23 HG3 GLU 23 -7.221 -4.630 2.077
467 HG3 GLU 23 HG2 GLU 23 -7.650 -3.630 3.463
468 H VAL 24 H VAL 24 -9.118 -2.878 -1.057
469 HA VAL 24 HA VAL 24 -11.447 -1.307 -1.232
470 HB VAL 24 HB VAL 24 -9.389 -1.756 -3.415
471 HG11 VAL 24 HG11 VAL 24 -10.101 0.377 -4.286
472 HG12 VAL 24 HG12 VAL 24 -11.232 0.590 -2.950
473 HG13 VAL 24 HG13 VAL 24 -11.506 -0.681 -4.144
474 HG21 VAL 24 HG21 VAL 24 -8.286 0.229 -2.561
475 HG22 VAL 24 HG22 VAL 24 -8.349 -1.034 -1.332
476 HG23 VAL 24 HG23 VAL 24 -9.460 0.333 -1.250
477 H ALA 25 H ALA 25 -10.408 -4.204 -2.952
478 HA ALA 25 HA ALA 25 -12.494 -4.171 -4.880
479 HB1 ALA 25 HB1 ALA 25 -10.335 -5.391 -5.127
480 HB2 ALA 25 HB2 ALA 25 -11.767 -6.350 -5.503
481 HB3 ALA 25 HB3 ALA 25 -10.938 -6.574 -3.966
482 H ARG 26 H ARG 26 -12.279 -5.431 -1.618
483 HA ARG 26 HA ARG 26 -14.530 -7.164 -1.837
484 HB2 ARG 26 HB3 ARG 26 -14.152 -7.697 0.352
485 HB3 ARG 26 HB2 ARG 26 -12.595 -6.988 -0.030
486 HG2 ARG 26 HG3 ARG 26 -13.262 -4.890 1.010
487 HG3 ARG 26 HG2 ARG 26 -14.852 -5.577 1.372
488 HD2 ARG 26 HD2 ARG 26 -13.718 -7.353 2.688
489 HD3 ARG 26 HD1 ARG 26 -12.189 -6.525 2.414
490 HE ARG 26 HE ARG 26 -14.130 -4.792 3.574
491 HH11 ARG 26 HH11 ARG 26 -11.895 -7.379 4.318
492 HH12 ARG 26 HH12 ARG 26 -11.712 -6.921 5.981
493 HH21 ARG 26 HH21 ARG 26 -13.887 -4.180 5.767
494 HH22 ARG 26 HH22 ARG 26 -12.838 -5.094 6.803
495 H LEU 27 H LEU 27 -14.056 -3.859 -0.772
496 HA LEU 27 HA LEU 27 -16.749 -3.342 -0.072
497 HB2 LEU 27 HB3 LEU 27 -14.501 -1.530 -0.902
498 HB3 LEU 27 HB2 LEU 27 -16.065 -0.939 -0.382
499 HG LEU 27 HG LEU 27 -14.766 -2.828 1.460
500 HD11 LEU 27 HD11 LEU 27 -12.868 -1.500 0.607
501 HD12 LEU 27 HD12 LEU 27 -13.190 -1.263 2.326
502 HD13 LEU 27 HD13 LEU 27 -13.697 -0.047 1.158
503 HD21 LEU 27 HD21 LEU 27 -16.107 -0.155 1.796
504 HD22 LEU 27 HD22 LEU 27 -15.580 -1.206 3.108
505 HD23 LEU 27 HD23 LEU 27 -16.860 -1.734 2.015
506 H LYS 28 H LYS 28 -14.992 -3.136 -3.116
507 HA LYS 28 HA LYS 28 -16.828 -1.897 -4.752
508 HB2 LYS 28 HB3 LYS 28 -15.044 -4.268 -5.273
509 HB3 LYS 28 HB2 LYS 28 -16.048 -3.569 -6.533
510 HG2 LYS 28 HG3 LYS 28 -13.964 -2.051 -4.980
511 HG3 LYS 28 HG2 LYS 28 -13.703 -2.786 -6.563
512 HD2 LYS 28 HD3 LYS 28 -15.668 -1.404 -7.373
513 HD3 LYS 28 HD2 LYS 28 -15.561 -0.530 -5.845
514 HE2 LYS 28 HE3 LYS 28 -13.358 -0.794 -7.888
515 HE3 LYS 28 HE2 LYS 28 -14.371 0.628 -7.645
516 HZ1 LYS 28 HZ1 LYS 28 -12.240 0.868 -6.555
517 HZ2 LYS 28 HZ2 LYS 28 -12.508 -0.534 -5.650
518 HZ3 LYS 28 HZ3 LYS 28 -13.482 0.830 -5.409
519 H LYS 29 H LYS 29 -16.843 -5.252 -3.621
520 HA LYS 29 HA LYS 29 -19.202 -5.951 -5.074
521 HB2 LYS 29 HB3 LYS 29 -17.669 -7.307 -2.865
522 HB3 LYS 29 HB2 LYS 29 -19.110 -7.993 -3.588
523 HG2 LYS 29 HG3 LYS 29 -16.615 -7.289 -5.111
524 HG3 LYS 29 HG2 LYS 29 -16.998 -8.900 -4.505
525 HD2 LYS 29 HD3 LYS 29 -18.668 -7.328 -6.468
526 HD3 LYS 29 HD2 LYS 29 -17.563 -8.635 -6.888
527 HE2 LYS 29 HE3 LYS 29 -18.889 -10.175 -5.500
528 HE3 LYS 29 HE2 LYS 29 -20.007 -8.863 -5.133
529 HZ1 LYS 29 HZ1 LYS 29 -20.563 -8.715 -7.469
530 HZ2 LYS 29 HZ2 LYS 29 -20.831 -10.286 -6.905
531 HZ3 LYS 29 HZ3 LYS 29 -19.466 -9.945 -7.843
532 H LEU 30 H LEU 30 -18.560 -4.508 -2.000
533 HA LEU 30 HA LEU 30 -21.127 -5.170 -0.871
534 HB2 LEU 30 HB3 LEU 30 -19.056 -3.163 0.020
535 HB3 LEU 30 HB2 LEU 30 -20.482 -3.618 0.933
536 HG LEU 30 HG LEU 30 -18.206 -5.466 0.210
537 HD11 LEU 30 HD11 LEU 30 -18.976 -4.204 2.836
538 HD12 LEU 30 HD12 LEU 30 -17.549 -3.824 1.873
539 HD13 LEU 30 HD13 LEU 30 -17.717 -5.417 2.611
540 HD21 LEU 30 HD21 LEU 30 -20.665 -5.913 1.897
541 HD22 LEU 30 HD22 LEU 30 -19.315 -7.036 1.742
542 HD23 LEU 30 HD23 LEU 30 -20.313 -6.660 0.338
543 H VAL 31 H VAL 31 -19.661 -2.385 -2.470
544 HA VAL 31 HA VAL 31 -22.061 -0.792 -2.195
545 HB VAL 31 HB VAL 31 -19.650 -0.233 -3.943
546 HG11 VAL 31 HG11 VAL 31 -20.390 2.092 -3.820
547 HG12 VAL 31 HG12 VAL 31 -21.797 1.597 -2.878
548 HG13 VAL 31 HG13 VAL 31 -21.621 1.062 -4.550
549 HG21 VAL 31 HG21 VAL 31 -18.957 -0.489 -1.630
550 HG22 VAL 31 HG22 VAL 31 -20.205 0.645 -1.116
551 HG23 VAL 31 HG23 VAL 31 -18.868 1.202 -2.122
552 H GLY 32 H GLY 32 -20.639 -2.944 -4.541
553 HA2 GLY 32 HA3 GLY 32 -22.431 -2.023 -6.649
554 HA3 GLY 32 HA2 GLY 32 -21.141 -3.204 -6.821
555 H GLU 33 H GLU 33 -21.774 -4.970 -4.807
556 HA GLU 33 HA GLU 33 -22.951 -6.852 -4.428
557 HB2 GLU 33 HB3 GLU 33 -25.327 -5.113 -5.118
558 HB3 GLU 33 HB2 GLU 33 -25.412 -6.691 -4.344
559 HG2 GLU 33 HG3 GLU 33 -24.147 -5.829 -2.440
560 HG3 GLU 33 HG2 GLU 33 -24.063 -4.247 -3.213
Start of MODEL 17
1 H1 GLY 1 H1 GLY 1 20.865 1.536 7.263
2 H2 GLY 1 H2 GLY 1 21.866 2.156 6.054
3 H3 GLY 1 H3 GLY 1 22.015 0.542 6.526
4 HA2 GLY 1 HA2 GLY 1 20.861 0.700 4.421
5 HA3 GLY 1 HA3 GLY 1 19.827 0.039 5.677
6 H SER 2 H SER 2 20.686 3.089 4.081
7 HA SER 2 HA SER 2 17.848 3.791 4.099
8 HB2 SER 2 HB3 SER 2 18.942 4.966 6.014
9 HB3 SER 2 HB2 SER 2 20.033 5.747 4.871
10 HG SER 2 HG SER 2 17.994 6.872 5.579
11 H MET 3 H MET 3 20.590 5.820 3.158
12 HA MET 3 HA MET 3 21.354 6.560 1.159
13 HB2 MET 3 HB3 MET 3 20.379 3.837 0.311
14 HB3 MET 3 HB2 MET 3 21.267 4.915 -0.755
15 HG2 MET 3 HG3 MET 3 23.201 4.810 0.610
16 HG3 MET 3 HG2 MET 3 22.324 3.985 1.896
17 HE1 MET 3 HE1 MET 3 21.826 3.188 -1.909
18 HE2 MET 3 HE2 MET 3 23.095 2.001 -2.202
19 HE3 MET 3 HE3 MET 3 23.518 3.678 -1.856
20 H LYS 4 H LYS 4 20.731 6.949 -1.218
21 HA LYS 4 HA LYS 4 18.231 8.299 -1.279
22 HB2 LYS 4 HB3 LYS 4 20.317 8.941 -2.545
23 HB3 LYS 4 HB2 LYS 4 20.011 7.582 -3.614
24 HG2 LYS 4 HG3 LYS 4 17.847 8.591 -4.226
25 HG3 LYS 4 HG2 LYS 4 18.244 9.983 -3.217
26 HD2 LYS 4 HD3 LYS 4 20.308 10.290 -4.595
27 HD3 LYS 4 HD2 LYS 4 19.712 9.022 -5.666
28 HE2 LYS 4 HE3 LYS 4 19.147 11.166 -6.598
29 HE3 LYS 4 HE2 LYS 4 17.671 10.368 -6.053
30 HZ1 LYS 4 HZ1 LYS 4 17.683 12.686 -5.420
31 HZ2 LYS 4 HZ2 LYS 4 19.143 12.491 -4.592
32 HZ3 LYS 4 HZ3 LYS 4 17.748 11.714 -4.037
33 H GLN 5 H GLN 5 19.374 5.181 -2.280
34 HA GLN 5 HA GLN 5 17.397 4.608 -4.202
35 HB2 GLN 5 HB3 GLN 5 19.174 2.754 -2.618
36 HB3 GLN 5 HB2 GLN 5 18.198 2.270 -4.001
37 HG2 GLN 5 HG3 GLN 5 19.432 3.888 -5.394
38 HG3 GLN 5 HG2 GLN 5 20.451 4.266 -4.009
39 HE21 GLN 5 HE21 GLN 5 21.145 3.178 -6.618
40 HE22 GLN 5 HE22 GLN 5 21.947 1.676 -6.313
41 H LEU 6 H LEU 6 17.637 3.672 -0.743
42 HA LEU 6 HA LEU 6 15.204 2.186 -0.853
43 HB2 LEU 6 HB3 LEU 6 16.758 3.284 1.485
44 HB3 LEU 6 HB2 LEU 6 15.280 2.363 1.671
45 HG LEU 6 HG LEU 6 16.434 0.469 0.452
46 HD11 LEU 6 HD11 LEU 6 18.224 1.690 -0.616
47 HD12 LEU 6 HD12 LEU 6 18.897 0.488 0.487
48 HD13 LEU 6 HD13 LEU 6 18.857 2.188 0.952
49 HD21 LEU 6 HD21 LEU 6 16.110 0.521 2.877
50 HD22 LEU 6 HD22 LEU 6 17.644 1.371 3.058
51 HD23 LEU 6 HD23 LEU 6 17.617 -0.278 2.431
52 H GLU 7 H GLU 7 16.042 5.511 -0.109
53 HA GLU 7 HA GLU 7 13.570 6.324 0.942
54 HB2 GLU 7 HB3 GLU 7 15.904 7.676 -0.255
55 HB3 GLU 7 HB2 GLU 7 14.394 8.567 -0.347
56 HG2 GLU 7 HG3 GLU 7 15.457 9.289 1.612
57 HG3 GLU 7 HG2 GLU 7 14.164 8.214 2.133
58 H ASP 8 H ASP 8 14.722 6.228 -2.419
59 HA ASP 8 HA ASP 8 12.354 7.446 -3.460
60 HB2 ASP 8 HB3 ASP 8 14.725 6.108 -4.716
61 HB3 ASP 8 HB2 ASP 8 13.322 6.537 -5.688
62 H LYS 9 H LYS 9 13.142 4.211 -2.613
63 HA LYS 9 HA LYS 9 11.026 3.170 -4.342
64 HB2 LYS 9 HB3 LYS 9 13.245 1.863 -2.804
65 HB3 LYS 9 HB2 LYS 9 11.877 0.924 -3.388
66 HG2 LYS 9 HG3 LYS 9 12.364 1.603 -5.672
67 HG3 LYS 9 HG2 LYS 9 13.712 2.588 -5.101
68 HD2 LYS 9 HD3 LYS 9 14.896 0.650 -4.350
69 HD3 LYS 9 HD2 LYS 9 13.503 -0.388 -4.663
70 HE2 LYS 9 HE3 LYS 9 13.694 0.025 -7.042
71 HE3 LYS 9 HE2 LYS 9 15.020 1.153 -6.765
72 HZ1 LYS 9 HZ1 LYS 9 15.735 -1.088 -7.480
73 HZ2 LYS 9 HZ2 LYS 9 15.112 -1.726 -6.047
74 HZ3 LYS 9 HZ3 LYS 9 16.396 -0.623 -5.997
75 H VAL 10 H VAL 10 11.986 2.976 -0.905
76 HA VAL 10 HA VAL 10 9.628 1.591 -0.144
77 HB VAL 10 HB VAL 10 11.522 3.177 1.601
78 HG11 VAL 10 HG11 VAL 10 9.392 2.746 2.705
79 HG12 VAL 10 HG12 VAL 10 10.675 1.774 3.425
80 HG13 VAL 10 HG13 VAL 10 9.523 1.030 2.315
81 HG21 VAL 10 HG21 VAL 10 12.683 1.438 0.350
82 HG22 VAL 10 HG22 VAL 10 11.505 0.244 0.892
83 HG23 VAL 10 HG23 VAL 10 12.582 1.014 2.059
84 H GLU 11 H GLU 11 10.609 5.008 0.288
85 HA GLU 11 HA GLU 11 8.153 5.732 1.535
86 HB2 GLU 11 HB3 GLU 11 10.250 7.457 0.208
87 HB3 GLU 11 HB2 GLU 11 8.906 8.068 1.163
88 HG2 GLU 11 HG3 GLU 11 9.763 6.735 3.083
89 HG3 GLU 11 HG2 GLU 11 11.182 6.351 2.111
90 H GLU 12 H GLU 12 9.139 5.360 -1.740
91 HA GLU 12 HA GLU 12 7.169 6.841 -3.061
92 HB2 GLU 12 HB3 GLU 12 9.052 5.686 -4.187
93 HB3 GLU 12 HB2 GLU 12 8.282 4.142 -3.853
94 HG2 GLU 12 HG3 GLU 12 7.881 4.800 -6.136
95 HG3 GLU 12 HG2 GLU 12 6.370 4.809 -5.229
96 H LEU 13 H LEU 13 7.050 3.384 -2.086
97 HA LEU 13 HA LEU 13 4.278 3.180 -2.578
98 HB2 LEU 13 HB3 LEU 13 6.128 1.452 -0.952
99 HB3 LEU 13 HB2 LEU 13 4.404 1.137 -1.063
100 HG LEU 13 HG LEU 13 4.823 1.279 -3.629
101 HD11 LEU 13 HD11 LEU 13 7.021 0.394 -4.274
102 HD12 LEU 13 HD12 LEU 13 7.561 0.549 -2.602
103 HD13 LEU 13 HD13 LEU 13 7.132 1.988 -3.526
104 HD21 LEU 13 HD21 LEU 13 5.649 -1.097 -1.959
105 HD22 LEU 13 HD22 LEU 13 5.221 -1.148 -3.670
106 HD23 LEU 13 HD23 LEU 13 4.008 -0.696 -2.471
107 H LEU 14 H LEU 14 6.041 4.294 0.222
108 HA LEU 14 HA LEU 14 4.076 4.273 2.158
109 HB2 LEU 14 HB3 LEU 14 6.278 6.175 1.491
110 HB3 LEU 14 HB2 LEU 14 5.108 6.652 2.695
111 HG LEU 14 HG LEU 14 7.410 5.461 3.295
112 HD11 LEU 14 HD11 LEU 14 6.369 4.807 5.425
113 HD12 LEU 14 HD12 LEU 14 4.780 5.074 4.705
114 HD13 LEU 14 HD13 LEU 14 5.907 6.417 4.885
115 HD21 LEU 14 HD21 LEU 14 7.226 3.145 3.715
116 HD22 LEU 14 HD22 LEU 14 6.719 3.379 2.041
117 HD23 LEU 14 HD23 LEU 14 5.514 3.127 3.306
118 H SER 15 H SER 15 4.611 6.705 -0.366
119 HA SER 15 HA SER 15 2.225 8.128 0.327
120 HB2 SER 15 HB3 SER 15 2.715 9.276 -1.944
121 HB3 SER 15 HB2 SER 15 3.854 9.511 -0.620
122 HG SER 15 HG SER 15 5.328 8.470 -1.705
123 H LYS 16 H LYS 16 3.089 5.619 -2.010
124 HA LYS 16 HA LYS 16 0.787 5.789 -3.602
125 HB2 LYS 16 HB3 LYS 16 2.844 4.454 -4.124
126 HB3 LYS 16 HB2 LYS 16 2.313 3.271 -2.936
127 HG2 LYS 16 HG3 LYS 16 0.345 2.773 -4.224
128 HG3 LYS 16 HG2 LYS 16 0.718 4.067 -5.364
129 HD2 LYS 16 HD3 LYS 16 1.374 1.994 -6.362
130 HD3 LYS 16 HD2 LYS 16 2.839 2.865 -5.915
131 HE2 LYS 16 HE3 LYS 16 3.159 0.597 -5.287
132 HE3 LYS 16 HE2 LYS 16 2.887 1.513 -3.807
133 HZ1 LYS 16 HZ1 LYS 16 0.931 -0.209 -5.222
134 HZ2 LYS 16 HZ2 LYS 16 0.537 0.780 -3.909
135 HZ3 LYS 16 HZ3 LYS 16 1.633 -0.495 -3.707
136 H ASN 17 H ASN 17 1.408 3.698 -0.734
137 HA ASN 17 HA ASN 17 -1.311 2.803 -0.822
138 HB2 ASN 17 HB3 ASN 17 -0.823 1.539 1.236
139 HB3 ASN 17 HB2 ASN 17 0.292 1.197 -0.072
140 HD21 ASN 17 HD21 ASN 17 0.472 4.010 2.076
141 HD22 ASN 17 HD22 ASN 17 1.944 3.534 2.831
142 H TYR 18 H TYR 18 0.268 5.483 0.571
143 HA TYR 18 HA TYR 18 -1.458 6.015 2.730
144 HB2 TYR 18 HB3 TYR 18 0.654 7.239 2.376
145 HB3 TYR 18 HB2 TYR 18 -0.025 7.995 0.939
146 HD1 TYR 18 HD1 TYR 18 -0.166 7.859 4.614
147 HD2 TYR 18 HD2 TYR 18 -1.561 9.839 1.117
148 HE1 TYR 18 HE1 TYR 18 -1.050 9.681 6.006
149 HE2 TYR 18 HE2 TYR 18 -2.447 11.665 2.501
150 HH TYR 18 HH TYR 18 -1.650 12.035 5.792
151 H HIS 19 H HIS 19 -1.545 7.274 -0.613
152 HA HIS 19 HA HIS 19 -4.065 8.557 -0.277
153 HB2 HIS 19 HB3 HIS 19 -2.544 7.749 -2.761
154 HB3 HIS 19 HB2 HIS 19 -4.058 8.645 -2.805
155 HD1 HIS 19 HD1 HIS 19 -3.929 11.134 -2.476
156 HD2 HIS 19 HD2 HIS 19 -0.373 9.206 -1.535
157 HE1 HIS 19 HE1 HIS 19 -2.242 12.962 -2.129
158 HE2 HIS 19 HE2 HIS 19 -0.154 11.773 -1.370
159 H LEU 20 H LEU 20 -3.052 5.447 -1.494
160 HA LEU 20 HA LEU 20 -5.403 4.336 -2.359
161 HB2 LEU 20 HB3 LEU 20 -3.417 3.144 -2.638
162 HB3 LEU 20 HB2 LEU 20 -2.969 3.331 -0.966
163 HG LEU 20 HG LEU 20 -3.522 1.034 -1.767
164 HD11 LEU 20 HD11 LEU 20 -4.558 0.455 0.369
165 HD12 LEU 20 HD12 LEU 20 -4.949 2.147 0.631
166 HD13 LEU 20 HD13 LEU 20 -3.266 1.629 0.558
167 HD21 LEU 20 HD21 LEU 20 -5.889 0.384 -1.714
168 HD22 LEU 20 HD22 LEU 20 -5.532 1.494 -3.037
169 HD23 LEU 20 HD23 LEU 20 -6.339 2.084 -1.585
170 H GLU 21 H GLU 21 -4.218 4.589 1.007
171 HA GLU 21 HA GLU 21 -6.367 3.085 2.079
172 HB2 GLU 21 HB3 GLU 21 -4.400 4.966 3.358
173 HB3 GLU 21 HB2 GLU 21 -5.627 4.103 4.279
174 HG2 GLU 21 HG3 GLU 21 -4.714 1.969 3.492
175 HG3 GLU 21 HG2 GLU 21 -3.486 2.839 2.575
176 H ASN 22 H ASN 22 -6.139 6.347 1.062
177 HA ASN 22 HA ASN 22 -8.397 7.340 2.495
178 HB2 ASN 22 HB3 ASN 22 -7.247 8.239 -0.160
179 HB3 ASN 22 HB2 ASN 22 -8.442 9.121 0.780
180 HD21 ASN 22 HD21 ASN 22 -5.819 9.944 -0.093
181 HD22 ASN 22 HD22 ASN 22 -4.936 10.360 1.334
182 H GLU 23 H GLU 23 -7.878 5.545 -0.435
183 HA GLU 23 HA GLU 23 -10.534 5.845 -1.460
184 HB2 GLU 23 HB3 GLU 23 -8.611 5.423 -2.936
185 HB3 GLU 23 HB2 GLU 23 -8.384 3.835 -2.176
186 HG2 GLU 23 HG3 GLU 23 -10.517 3.092 -3.028
187 HG3 GLU 23 HG2 GLU 23 -10.846 4.692 -3.690
188 H VAL 24 H VAL 24 -8.864 3.479 0.543
189 HA VAL 24 HA VAL 24 -10.929 1.532 0.515
190 HB VAL 24 HB VAL 24 -9.122 2.028 2.879
191 HG11 VAL 24 HG11 VAL 24 -9.317 -0.406 3.169
192 HG12 VAL 24 HG12 VAL 24 -10.384 -0.486 1.766
193 HG13 VAL 24 HG13 VAL 24 -10.890 0.387 3.212
194 HG21 VAL 24 HG21 VAL 24 -8.464 0.624 0.305
195 HG22 VAL 24 HG22 VAL 24 -7.544 0.423 1.791
196 HG23 VAL 24 HG23 VAL 24 -7.633 2.003 1.017
197 H ALA 25 H ALA 25 -10.309 4.431 2.382
198 HA ALA 25 HA ALA 25 -12.447 4.049 4.234
199 HB1 ALA 25 HB1 ALA 25 -12.041 6.347 4.893
200 HB2 ALA 25 HB2 ALA 25 -11.037 6.602 3.467
201 HB3 ALA 25 HB3 ALA 25 -10.513 5.483 4.725
202 H ARG 26 H ARG 26 -12.153 5.463 1.046
203 HA ARG 26 HA ARG 26 -14.536 6.965 1.063
204 HB2 ARG 26 HB3 ARG 26 -14.105 7.423 -1.137
205 HB3 ARG 26 HB2 ARG 26 -12.523 6.826 -0.675
206 HG2 ARG 26 HG3 ARG 26 -12.996 4.662 -1.662
207 HG3 ARG 26 HG2 ARG 26 -14.646 5.182 -2.040
208 HD2 ARG 26 HD2 ARG 26 -12.095 6.346 -3.152
209 HD3 ARG 26 HD1 ARG 26 -13.234 5.310 -4.010
210 HE ARG 26 HE ARG 26 -14.054 7.941 -2.983
211 HH11 ARG 26 HH11 ARG 26 -13.665 5.705 -5.649
212 HH12 ARG 26 HH12 ARG 26 -14.545 6.692 -6.768
213 HH21 ARG 26 HH21 ARG 26 -15.186 9.248 -4.452
214 HH22 ARG 26 HH22 ARG 26 -15.411 8.715 -6.087
215 H LEU 27 H LEU 27 -13.811 3.670 0.093
216 HA LEU 27 HA LEU 27 -16.482 3.005 -0.626
217 HB2 LEU 27 HB3 LEU 27 -14.188 1.211 0.134
218 HB3 LEU 27 HB2 LEU 27 -15.683 0.711 -0.619
219 HG LEU 27 HG LEU 27 -13.908 2.692 -1.961
220 HD11 LEU 27 HD11 LEU 27 -13.768 -0.290 -2.288
221 HD12 LEU 27 HD12 LEU 27 -12.599 0.669 -1.379
222 HD13 LEU 27 HD13 LEU 27 -12.791 0.923 -3.115
223 HD21 LEU 27 HD21 LEU 27 -15.012 1.702 -3.960
224 HD22 LEU 27 HD22 LEU 27 -16.126 2.505 -2.854
225 HD23 LEU 27 HD23 LEU 27 -16.013 0.743 -2.866
226 H LYS 28 H LYS 28 -14.535 2.462 2.283
227 HA LYS 28 HA LYS 28 -16.262 0.867 3.706
228 HB2 LYS 28 HB3 LYS 28 -13.925 1.541 4.337
229 HB3 LYS 28 HB2 LYS 28 -14.588 3.063 4.912
230 HG2 LYS 28 HG3 LYS 28 -15.847 1.969 6.603
231 HG3 LYS 28 HG2 LYS 28 -15.473 0.380 5.935
232 HD2 LYS 28 HD3 LYS 28 -13.083 0.784 6.426
233 HD3 LYS 28 HD2 LYS 28 -13.529 2.313 7.185
234 HE2 LYS 28 HE3 LYS 28 -14.867 1.139 8.828
235 HE3 LYS 28 HE2 LYS 28 -14.529 -0.399 8.038
236 HZ1 LYS 28 HZ1 LYS 28 -13.122 -0.108 9.953
237 HZ2 LYS 28 HZ2 LYS 28 -12.537 1.363 9.357
238 HZ3 LYS 28 HZ3 LYS 28 -12.178 -0.081 8.551
239 H LYS 29 H LYS 29 -16.299 4.432 3.500
240 HA LYS 29 HA LYS 29 -18.488 4.613 5.319
241 HB2 LYS 29 HB3 LYS 29 -18.504 6.962 4.825
242 HB3 LYS 29 HB2 LYS 29 -16.864 6.426 5.113
243 HG2 LYS 29 HG3 LYS 29 -16.434 6.434 2.711
244 HG3 LYS 29 HG2 LYS 29 -18.094 6.960 2.414
245 HD2 LYS 29 HD3 LYS 29 -17.684 9.009 3.668
246 HD3 LYS 29 HD2 LYS 29 -16.041 8.479 4.022
247 HE2 LYS 29 HE3 LYS 29 -16.050 10.089 2.205
248 HE3 LYS 29 HE2 LYS 29 -15.520 8.513 1.630
249 HZ1 LYS 29 HZ1 LYS 29 -17.702 8.137 0.704
250 HZ2 LYS 29 HZ2 LYS 29 -17.078 9.586 0.104
251 HZ3 LYS 29 HZ3 LYS 29 -18.258 9.610 1.314
252 H LEU 30 H LEU 30 -18.182 4.211 1.903
253 HA LEU 30 HA LEU 30 -20.857 4.948 1.231
254 HB2 LEU 30 HB3 LEU 30 -18.768 3.283 -0.133
255 HB3 LEU 30 HB2 LEU 30 -20.360 3.527 -0.826
256 HG LEU 30 HG LEU 30 -18.358 5.707 -0.217
257 HD11 LEU 30 HD11 LEU 30 -19.240 4.516 -2.842
258 HD12 LEU 30 HD12 LEU 30 -17.661 4.312 -2.085
259 HD13 LEU 30 HD13 LEU 30 -18.170 5.903 -2.648
260 HD21 LEU 30 HD21 LEU 30 -20.633 6.514 0.003
261 HD22 LEU 30 HD22 LEU 30 -21.057 5.812 -1.558
262 HD23 LEU 30 HD23 LEU 30 -19.908 7.146 -1.474
263 H VAL 31 H VAL 31 -19.312 2.025 2.376
264 HA VAL 31 HA VAL 31 -21.651 0.396 1.869
265 HB VAL 31 HB VAL 31 -19.240 -0.368 3.522
266 HG11 VAL 31 HG11 VAL 31 -19.866 -2.649 2.937
267 HG12 VAL 31 HG12 VAL 31 -21.241 -2.046 2.011
268 HG13 VAL 31 HG13 VAL 31 -21.192 -1.827 3.762
269 HG21 VAL 31 HG21 VAL 31 -18.298 -1.356 1.513
270 HG22 VAL 31 HG22 VAL 31 -18.514 0.382 1.310
271 HG23 VAL 31 HG23 VAL 31 -19.650 -0.742 0.562
272 H GLY 32 H GLY 32 -20.338 2.267 4.507
273 HA2 GLY 32 HA3 GLY 32 -22.723 2.013 6.009
274 HA3 GLY 32 HA2 GLY 32 -21.500 0.945 6.668
275 H GLU 33 H GLU 33 -19.332 2.906 5.942
276 HA GLU 33 HA GLU 33 -18.089 4.400 7.109
277 HB2 GLU 33 HB3 GLU 33 -19.827 5.979 6.312
278 HB3 GLU 33 HB2 GLU 33 -20.750 5.675 7.776
279 HG2 GLU 33 HG3 GLU 33 -18.912 6.579 9.116
280 HG3 GLU 33 HG2 GLU 33 -18.003 6.899 7.639
281 H1 GLY 1 H1 GLY 1 20.812 -1.779 -7.971
282 H2 GLY 1 H2 GLY 1 21.825 -2.403 -6.772
283 H3 GLY 1 H3 GLY 1 21.979 -0.791 -7.253
284 HA2 GLY 1 HA2 GLY 1 20.849 -0.934 -5.133
285 HA3 GLY 1 HA3 GLY 1 19.809 -0.270 -6.382
286 H SER 2 H SER 2 20.666 -3.316 -4.785
287 HA SER 2 HA SER 2 17.823 -4.009 -4.781
288 HB2 SER 2 HB3 SER 2 18.898 -5.197 -6.697
289 HB3 SER 2 HB2 SER 2 20.003 -5.966 -5.562
290 HG SER 2 HG SER 2 17.928 -7.077 -6.254
291 H MET 3 H MET 3 20.564 -6.038 -3.851
292 HA MET 3 HA MET 3 21.341 -6.773 -1.851
293 HB2 MET 3 HB3 MET 3 20.376 -4.043 -1.011
294 HB3 MET 3 HB2 MET 3 21.261 -5.119 0.060
295 HG2 MET 3 HG3 MET 3 23.195 -5.030 -1.313
296 HG3 MET 3 HG2 MET 3 22.317 -4.202 -2.597
297 HE1 MET 3 HE1 MET 3 21.830 -3.384 1.206
298 HE2 MET 3 HE2 MET 3 23.111 -2.207 1.492
299 HE3 MET 3 HE3 MET 3 23.517 -3.889 1.153
300 H LYS 4 H LYS 4 20.729 -7.142 0.546
301 HA LYS 4 HA LYS 4 18.221 -8.492 0.613
302 HB2 LYS 4 HB3 LYS 4 20.308 -9.138 1.875
303 HB3 LYS 4 HB2 LYS 4 20.011 -7.776 2.941
304 HG2 LYS 4 HG3 LYS 4 17.847 -8.776 3.564
305 HG3 LYS 4 HG2 LYS 4 18.236 -10.174 2.558
306 HD2 LYS 4 HD3 LYS 4 20.307 -10.479 3.929
307 HD3 LYS 4 HD2 LYS 4 19.717 -9.206 5.000
308 HE2 LYS 4 HE3 LYS 4 19.150 -11.345 5.938
309 HE3 LYS 4 HE2 LYS 4 17.674 -10.549 5.393
310 HZ1 LYS 4 HZ1 LYS 4 17.694 -12.872 4.764
311 HZ2 LYS 4 HZ2 LYS 4 19.144 -12.669 3.922
312 HZ3 LYS 4 HZ3 LYS 4 17.739 -11.899 3.385
313 H GLN 5 H GLN 5 19.380 -5.376 1.593
314 HA GLN 5 HA GLN 5 17.416 -4.787 3.524
315 HB2 GLN 5 HB3 GLN 5 19.188 -2.948 1.922
316 HB3 GLN 5 HB2 GLN 5 18.220 -2.453 3.306
317 HG2 GLN 5 HG3 GLN 5 19.455 -4.067 4.704
318 HG3 GLN 5 HG2 GLN 5 20.467 -4.453 3.317
319 HE21 GLN 5 HE21 GLN 5 21.182 -3.352 5.916
320 HE22 GLN 5 HE22 GLN 5 21.984 -1.854 5.593
321 H LEU 6 H LEU 6 17.632 -3.871 0.061
322 HA LEU 6 HA LEU 6 15.205 -2.377 0.179
323 HB2 LEU 6 HB3 LEU 6 16.748 -3.486 -2.161
324 HB3 LEU 6 HB2 LEU 6 15.271 -2.564 -2.346
325 HG LEU 6 HG LEU 6 16.436 -0.667 -1.139
326 HD11 LEU 6 HD11 LEU 6 18.229 -1.890 -0.079
327 HD12 LEU 6 HD12 LEU 6 18.897 -0.693 -1.189
328 HD13 LEU 6 HD13 LEU 6 18.849 -2.394 -1.650
329 HD21 LEU 6 HD21 LEU 6 16.099 -0.725 -3.563
330 HD22 LEU 6 HD22 LEU 6 17.630 -1.580 -3.748
331 HD23 LEU 6 HD23 LEU 6 17.609 0.070 -3.125
332 H GLU 7 H GLU 7 16.033 -5.708 -0.559
333 HA GLU 7 HA GLU 7 13.554 -6.518 -1.598
334 HB2 GLU 7 HB3 GLU 7 15.890 -7.868 -0.404
335 HB3 GLU 7 HB2 GLU 7 14.378 -8.757 -0.298
336 HG2 GLU 7 HG3 GLU 7 15.432 -9.492 -2.260
337 HG3 GLU 7 HG2 GLU 7 14.137 -8.419 -2.780
338 H ASP 8 H ASP 8 14.723 -6.416 1.757
339 HA ASP 8 HA ASP 8 12.356 -7.618 2.816
340 HB2 ASP 8 HB3 ASP 8 14.737 -6.287 4.057
341 HB3 ASP 8 HB2 ASP 8 13.333 -6.697 5.037
342 H LYS 9 H LYS 9 13.147 -4.390 1.948
343 HA LYS 9 HA LYS 9 11.044 -3.334 3.685
344 HB2 LYS 9 HB3 LYS 9 13.259 -2.036 2.134
345 HB3 LYS 9 HB2 LYS 9 11.894 -1.095 2.720
346 HG2 LYS 9 HG3 LYS 9 12.387 -1.763 5.004
347 HG3 LYS 9 HG2 LYS 9 13.731 -2.755 4.433
348 HD2 LYS 9 HD3 LYS 9 14.919 -0.825 3.673
349 HD3 LYS 9 HD2 LYS 9 13.531 0.219 3.983
350 HE2 LYS 9 HE3 LYS 9 13.726 -0.180 6.363
351 HE3 LYS 9 HE2 LYS 9 15.041 -1.320 6.091
352 HZ1 LYS 9 HZ1 LYS 9 15.783 0.916 6.792
353 HZ2 LYS 9 HZ2 LYS 9 15.154 1.553 5.357
354 HZ3 LYS 9 HZ3 LYS 9 16.426 0.439 5.303
355 H VAL 10 H VAL 10 11.989 -3.155 0.244
356 HA VAL 10 HA VAL 10 9.633 -1.763 -0.508
357 HB VAL 10 HB VAL 10 11.511 -3.363 -2.257
358 HG11 VAL 10 HG11 VAL 10 9.377 -2.932 -3.354
359 HG12 VAL 10 HG12 VAL 10 10.659 -1.965 -4.084
360 HG13 VAL 10 HG13 VAL 10 9.514 -1.216 -2.971
361 HG21 VAL 10 HG21 VAL 10 12.679 -1.624 -1.015
362 HG22 VAL 10 HG22 VAL 10 11.502 -0.427 -1.561
363 HG23 VAL 10 HG23 VAL 10 12.574 -1.205 -2.725
364 H GLU 11 H GLU 11 10.597 -5.185 -0.935
365 HA GLU 11 HA GLU 11 8.134 -5.904 -2.168
366 HB2 GLU 11 HB3 GLU 11 10.231 -7.626 -0.837
367 HB3 GLU 11 HB2 GLU 11 8.880 -8.242 -1.780
368 HG2 GLU 11 HG3 GLU 11 9.735 -6.920 -3.716
369 HG3 GLU 11 HG2 GLU 11 11.162 -6.544 -2.751
370 H GLU 12 H GLU 12 9.140 -5.534 1.107
371 HA GLU 12 HA GLU 12 7.172 -7.000 2.439
372 HB2 GLU 12 HB3 GLU 12 9.060 -5.845 3.552
373 HB3 GLU 12 HB2 GLU 12 8.293 -4.300 3.216
374 HG2 GLU 12 HG3 GLU 12 7.904 -4.950 5.503
375 HG3 GLU 12 HG2 GLU 12 6.386 -4.951 4.605
376 H LEU 13 H LEU 13 7.053 -3.548 1.455
377 HA LEU 13 HA LEU 13 4.285 -3.334 1.958
378 HB2 LEU 13 HB3 LEU 13 6.131 -1.618 0.317
379 HB3 LEU 13 HB2 LEU 13 4.411 -1.297 0.434
380 HG LEU 13 HG LEU 13 4.840 -1.428 2.998
381 HD11 LEU 13 HD11 LEU 13 7.042 -0.549 3.634
382 HD12 LEU 13 HD12 LEU 13 7.578 -0.709 1.961
383 HD13 LEU 13 HD13 LEU 13 7.148 -2.145 2.892
384 HD21 LEU 13 HD21 LEU 13 5.664 0.937 1.313
385 HD22 LEU 13 HD22 LEU 13 5.245 0.998 3.025
386 HD23 LEU 13 HD23 LEU 13 4.025 0.543 1.834
387 H LEU 14 H LEU 14 6.034 -4.463 -0.849
388 HA LEU 14 HA LEU 14 4.058 -4.445 -2.775
389 HB2 LEU 14 HB3 LEU 14 6.262 -6.346 -2.112
390 HB3 LEU 14 HB2 LEU 14 5.085 -6.828 -3.308
391 HG LEU 14 HG LEU 14 7.385 -5.643 -3.926
392 HD11 LEU 14 HD11 LEU 14 6.333 -4.992 -6.048
393 HD12 LEU 14 HD12 LEU 14 4.749 -5.258 -5.318
394 HD13 LEU 14 HD13 LEU 14 5.875 -6.602 -5.502
395 HD21 LEU 14 HD21 LEU 14 7.204 -3.327 -4.349
396 HD22 LEU 14 HD22 LEU 14 6.704 -3.556 -2.673
397 HD23 LEU 14 HD23 LEU 14 5.494 -3.306 -3.932
398 H SER 15 H SER 15 4.605 -6.866 -0.243
399 HA SER 15 HA SER 15 2.211 -8.284 -0.922
400 HB2 SER 15 HB3 SER 15 2.716 -9.422 1.353
401 HB3 SER 15 HB2 SER 15 3.839 -9.668 0.017
402 HG SER 15 HG SER 15 5.331 -8.646 1.086
403 H LYS 16 H LYS 16 3.088 -5.768 1.400
404 HA LYS 16 HA LYS 16 0.794 -5.929 3.006
405 HB2 LYS 16 HB3 LYS 16 2.861 -4.602 3.515
406 HB3 LYS 16 HB2 LYS 16 2.328 -3.419 2.328
407 HG2 LYS 16 HG3 LYS 16 0.374 -2.916 3.625
408 HG3 LYS 16 HG2 LYS 16 0.746 -4.204 4.768
409 HD2 LYS 16 HD3 LYS 16 1.407 -2.125 5.752
410 HD3 LYS 16 HD2 LYS 16 2.871 -3.002 5.306
411 HE2 LYS 16 HE3 LYS 16 3.191 -0.739 4.661
412 HE3 LYS 16 HE2 LYS 16 2.911 -1.663 3.188
413 HZ1 LYS 16 HZ1 LYS 16 0.969 0.078 4.597
414 HZ2 LYS 16 HZ2 LYS 16 0.562 -0.926 3.300
415 HZ3 LYS 16 HZ3 LYS 16 1.660 0.343 3.076
416 H ASN 17 H ASN 17 1.409 -3.848 0.130
417 HA ASN 17 HA ASN 17 -1.308 -2.944 0.228
418 HB2 ASN 17 HB3 ASN 17 -0.827 -1.691 -1.841
419 HB3 ASN 17 HB2 ASN 17 0.294 -1.343 -0.539
420 HD21 ASN 17 HD21 ASN 17 0.460 -4.169 -2.667
421 HD22 ASN 17 HD22 ASN 17 1.928 -3.702 -3.433
422 H TYR 18 H TYR 18 0.259 -5.630 -1.167
423 HA TYR 18 HA TYR 18 -1.484 -6.168 -3.310
424 HB2 TYR 18 HB3 TYR 18 0.628 -7.394 -2.967
425 HB3 TYR 18 HB2 TYR 18 -0.045 -8.145 -1.524
426 HD1 TYR 18 HD1 TYR 18 -0.207 -8.021 -5.201
427 HD2 TYR 18 HD2 TYR 18 -1.586 -9.982 -1.687
428 HE1 TYR 18 HE1 TYR 18 -1.104 -9.850 -6.577
429 HE2 TYR 18 HE2 TYR 18 -2.485 -11.813 -3.055
430 HH TYR 18 HH TYR 18 -1.724 -12.176 -6.375
431 H HIS 19 H HIS 19 -1.557 -7.412 0.040
432 HA HIS 19 HA HIS 19 -4.078 -8.700 -0.281
433 HB2 HIS 19 HB3 HIS 19 -2.542 -7.882 2.191
434 HB3 HIS 19 HB2 HIS 19 -4.058 -8.772 2.251
435 HD1 HIS 19 HD1 HIS 19 -3.941 -11.265 1.938
436 HD2 HIS 19 HD2 HIS 19 -0.380 -9.351 0.966
437 HE1 HIS 19 HE1 HIS 19 -2.266 -13.100 1.552
438 HE2 HIS 19 HE2 HIS 19 -0.160 -11.919 0.831
439 H LEU 20 H LEU 20 -3.060 -5.584 0.921
440 HA LEU 20 HA LEU 20 -5.403 -4.460 1.785
441 HB2 LEU 20 HB3 LEU 20 -3.412 -3.278 2.048
442 HB3 LEU 20 HB2 LEU 20 -2.973 -3.469 0.373
443 HG LEU 20 HG LEU 20 -3.513 -1.169 1.171
444 HD11 LEU 20 HD11 LEU 20 -4.558 -0.594 -0.961
445 HD12 LEU 20 HD12 LEU 20 -4.959 -2.285 -1.213
446 HD13 LEU 20 HD13 LEU 20 -3.273 -1.777 -1.153
447 HD21 LEU 20 HD21 LEU 20 -5.881 -0.514 1.131
448 HD22 LEU 20 HD22 LEU 20 -5.515 -1.620 2.456
449 HD23 LEU 20 HD23 LEU 20 -6.333 -2.215 1.011
450 H GLU 21 H GLU 21 -4.228 -4.730 -1.579
451 HA GLU 21 HA GLU 21 -6.377 -3.228 -2.653
452 HB2 GLU 21 HB3 GLU 21 -4.419 -5.119 -3.935
453 HB3 GLU 21 HB2 GLU 21 -5.647 -4.255 -4.853
454 HG2 GLU 21 HG3 GLU 21 -4.726 -2.122 -4.073
455 HG3 GLU 21 HG2 GLU 21 -3.496 -2.992 -3.162
456 H ASN 22 H ASN 22 -6.156 -6.482 -1.613
457 HA ASN 22 HA ASN 22 -8.419 -7.476 -3.043
458 HB2 ASN 22 HB3 ASN 22 -7.257 -8.377 -0.393
459 HB3 ASN 22 HB2 ASN 22 -8.462 -9.256 -1.323
460 HD21 ASN 22 HD21 ASN 22 -5.833 -10.087 -0.463
461 HD22 ASN 22 HD22 ASN 22 -4.966 -10.513 -1.898
462 H GLU 23 H GLU 23 -7.888 -5.665 -0.126
463 HA GLU 23 HA GLU 23 -10.541 -5.963 0.916
464 HB2 GLU 23 HB3 GLU 23 -8.608 -5.544 2.383
465 HB3 GLU 23 HB2 GLU 23 -8.380 -3.959 1.618
466 HG2 GLU 23 HG3 GLU 23 -10.506 -3.207 2.480
467 HG3 GLU 23 HG2 GLU 23 -10.836 -4.804 3.151
468 H VAL 24 H VAL 24 -8.870 -3.606 -1.100
469 HA VAL 24 HA VAL 24 -10.931 -1.656 -1.072
470 HB VAL 24 HB VAL 24 -9.138 -2.162 -3.444
471 HG11 VAL 24 HG11 VAL 24 -9.327 0.271 -3.741
472 HG12 VAL 24 HG12 VAL 24 -10.386 0.358 -2.332
473 HG13 VAL 24 HG13 VAL 24 -10.903 -0.518 -3.774
474 HG21 VAL 24 HG21 VAL 24 -8.460 -0.755 -0.877
475 HG22 VAL 24 HG22 VAL 24 -7.549 -0.559 -2.369
476 HG23 VAL 24 HG23 VAL 24 -7.639 -2.137 -1.591
477 H ALA 25 H ALA 25 -10.330 -4.562 -2.929
478 HA ALA 25 HA ALA 25 -12.474 -4.180 -4.774
479 HB1 ALA 25 HB1 ALA 25 -12.074 -6.483 -5.428
480 HB2 ALA 25 HB2 ALA 25 -11.063 -6.731 -4.007
481 HB3 ALA 25 HB3 ALA 25 -10.545 -5.618 -5.273
482 H ARG 26 H ARG 26 -12.171 -5.576 -1.581
483 HA ARG 26 HA ARG 26 -14.556 -7.079 -1.585
484 HB2 ARG 26 HB3 ARG 26 -14.115 -7.532 0.615
485 HB3 ARG 26 HB2 ARG 26 -12.533 -6.942 0.144
486 HG2 ARG 26 HG3 ARG 26 -12.997 -4.773 1.123
487 HG3 ARG 26 HG2 ARG 26 -14.645 -5.286 1.511
488 HD2 ARG 26 HD2 ARG 26 -12.090 -6.449 2.620
489 HD3 ARG 26 HD1 ARG 26 -13.224 -5.407 3.477
490 HE ARG 26 HE ARG 26 -14.043 -8.050 2.469
491 HH11 ARG 26 HH11 ARG 26 -13.662 -5.783 5.123
492 HH12 ARG 26 HH12 ARG 26 -14.550 -6.764 6.244
493 HH21 ARG 26 HH21 ARG 26 -15.189 -9.340 3.951
494 HH22 ARG 26 HH22 ARG 26 -15.422 -8.779 5.576
495 H LEU 27 H LEU 27 -13.816 -3.783 -0.632
496 HA LEU 27 HA LEU 27 -16.481 -3.106 0.099
497 HB2 LEU 27 HB3 LEU 27 -14.187 -1.320 -0.681
498 HB3 LEU 27 HB2 LEU 27 -15.677 -0.815 0.079
499 HG LEU 27 HG LEU 27 -13.899 -2.795 1.417
500 HD11 LEU 27 HD11 LEU 27 -13.752 0.188 1.733
501 HD12 LEU 27 HD12 LEU 27 -12.590 -0.775 0.822
502 HD13 LEU 27 HD13 LEU 27 -12.774 -1.023 2.559
503 HD21 LEU 27 HD21 LEU 27 -14.991 -1.792 3.419
504 HD22 LEU 27 HD22 LEU 27 -16.109 -2.603 2.323
505 HD23 LEU 27 HD23 LEU 27 -15.999 -0.841 2.323
506 H LYS 28 H LYS 28 -14.548 -2.576 -2.821
507 HA LYS 28 HA LYS 28 -16.279 -0.986 -4.244
508 HB2 LYS 28 HB3 LYS 28 -13.945 -1.668 -4.883
509 HB3 LYS 28 HB2 LYS 28 -14.614 -3.192 -5.449
510 HG2 LYS 28 HG3 LYS 28 -15.881 -2.100 -7.139
511 HG3 LYS 28 HG2 LYS 28 -15.495 -0.509 -6.479
512 HD2 LYS 28 HD3 LYS 28 -13.106 -0.929 -6.981
513 HD3 LYS 28 HD2 LYS 28 -13.564 -2.458 -7.735
514 HE2 LYS 28 HE3 LYS 28 -14.902 -1.280 -9.374
515 HE3 LYS 28 HE2 LYS 28 -14.551 0.259 -8.591
516 HZ1 LYS 28 HZ1 LYS 28 -13.159 -0.054 -10.516
517 HZ2 LYS 28 HZ2 LYS 28 -12.571 -1.516 -9.908
518 HZ3 LYS 28 HZ3 LYS 28 -12.206 -0.066 -9.121
519 H LYS 29 H LYS 29 -16.327 -4.548 -4.014
520 HA LYS 29 HA LYS 29 -18.522 -4.732 -5.828
521 HB2 LYS 29 HB3 LYS 29 -18.545 -7.080 -5.319
522 HB3 LYS 29 HB2 LYS 29 -16.907 -6.551 -5.623
523 HG2 LYS 29 HG3 LYS 29 -16.458 -6.548 -3.224
524 HG3 LYS 29 HG2 LYS 29 -18.116 -7.071 -2.912
525 HD2 LYS 29 HD3 LYS 29 -17.717 -9.122 -4.170
526 HD3 LYS 29 HD2 LYS 29 -16.073 -8.597 -4.530
527 HE2 LYS 29 HE3 LYS 29 -16.085 -10.209 -2.709
528 HE3 LYS 29 HE2 LYS 29 -15.542 -8.634 -2.142
529 HZ1 LYS 29 HZ1 LYS 29 -17.713 -8.242 -1.205
530 HZ2 LYS 29 HZ2 LYS 29 -17.097 -9.696 -0.608
531 HZ3 LYS 29 HZ3 LYS 29 -18.286 -9.714 -1.808
532 H LEU 30 H LEU 30 -18.196 -4.314 -2.417
533 HA LEU 30 HA LEU 30 -20.868 -5.043 -1.729
534 HB2 LEU 30 HB3 LEU 30 -18.766 -3.383 -0.382
535 HB3 LEU 30 HB2 LEU 30 -20.357 -3.614 0.321
536 HG LEU 30 HG LEU 30 -18.368 -5.807 -0.285
537 HD11 LEU 30 HD11 LEU 30 -19.237 -4.596 2.333
538 HD12 LEU 30 HD12 LEU 30 -17.660 -4.401 1.570
539 HD13 LEU 30 HD13 LEU 30 -18.171 -5.989 2.145
540 HD21 LEU 30 HD21 LEU 30 -20.648 -6.607 -0.493
541 HD22 LEU 30 HD22 LEU 30 -21.063 -5.897 1.065
542 HD23 LEU 30 HD23 LEU 30 -19.918 -7.234 0.983
543 H VAL 31 H VAL 31 -19.324 -2.129 -2.892
544 HA VAL 31 HA VAL 31 -21.657 -0.496 -2.376
545 HB VAL 31 HB VAL 31 -19.255 0.259 -4.050
546 HG11 VAL 31 HG11 VAL 31 -19.875 2.542 -3.469
547 HG12 VAL 31 HG12 VAL 31 -21.245 1.945 -2.534
548 HG13 VAL 31 HG13 VAL 31 -21.204 1.719 -4.284
549 HG21 VAL 31 HG21 VAL 31 -18.296 1.250 -2.047
550 HG22 VAL 31 HG22 VAL 31 -18.518 -0.486 -1.836
551 HG23 VAL 31 HG23 VAL 31 -19.644 0.644 -1.086
552 H GLY 32 H GLY 32 -20.348 -2.363 -5.025
553 HA2 GLY 32 HA3 GLY 32 -22.750 -2.123 -6.512
554 HA3 GLY 32 HA2 GLY 32 -21.528 -1.062 -7.186
555 H GLU 33 H GLU 33 -19.361 -3.025 -6.457
556 HA GLU 33 HA GLU 33 -18.128 -4.527 -7.628
557 HB2 GLU 33 HB3 GLU 33 -19.857 -6.099 -6.802
558 HB3 GLU 33 HB2 GLU 33 -20.796 -5.803 -8.254
559 HG2 GLU 33 HG3 GLU 33 -18.971 -6.713 -9.612
560 HG3 GLU 33 HG2 GLU 33 -18.053 -7.033 -8.141
Start of MODEL 18
1 H1 GLY 1 H1 GLY 1 26.433 1.508 -3.064
2 H2 GLY 1 H2 GLY 1 25.898 2.909 -2.283
3 H3 GLY 1 H3 GLY 1 27.154 2.997 -3.411
4 HA2 GLY 1 HA2 GLY 1 25.092 3.811 -4.360
5 HA3 GLY 1 HA3 GLY 1 25.675 2.376 -5.189
6 H SER 2 H SER 2 22.979 3.471 -5.000
7 HA SER 2 HA SER 2 20.897 2.520 -5.170
8 HB2 SER 2 HB3 SER 2 22.205 -0.011 -4.137
9 HB3 SER 2 HB2 SER 2 20.577 0.109 -4.803
10 HG SER 2 HG SER 2 21.381 0.407 -6.786
11 H MET 3 H MET 3 22.392 3.481 -2.631
12 HA MET 3 HA MET 3 20.783 2.430 -0.493
13 HB2 MET 3 HB3 MET 3 23.068 3.189 -0.087
14 HB3 MET 3 HB2 MET 3 22.648 4.802 -0.645
15 HG2 MET 3 HG3 MET 3 22.744 4.783 1.756
16 HG3 MET 3 HG2 MET 3 21.070 5.001 1.249
17 HE1 MET 3 HE1 MET 3 20.159 4.357 3.662
18 HE2 MET 3 HE2 MET 3 21.831 4.215 4.206
19 HE3 MET 3 HE3 MET 3 20.679 2.921 4.544
20 H LYS 4 H LYS 4 21.063 5.549 -2.161
21 HA LYS 4 HA LYS 4 18.870 6.763 -0.859
22 HB2 LYS 4 HB3 LYS 4 20.650 8.051 -1.935
23 HB3 LYS 4 HB2 LYS 4 20.184 7.415 -3.504
24 HG2 LYS 4 HG3 LYS 4 18.031 8.547 -3.336
25 HG3 LYS 4 HG2 LYS 4 18.479 9.172 -1.750
26 HD2 LYS 4 HD3 LYS 4 20.196 9.710 -4.145
27 HD3 LYS 4 HD2 LYS 4 18.763 10.685 -3.835
28 HE2 LYS 4 HE3 LYS 4 20.698 11.788 -2.913
29 HE3 LYS 4 HE2 LYS 4 19.656 11.241 -1.606
30 HZ1 LYS 4 HZ1 LYS 4 22.042 9.743 -2.530
31 HZ2 LYS 4 HZ2 LYS 4 21.126 9.459 -1.133
32 HZ3 LYS 4 HZ3 LYS 4 22.068 10.855 -1.256
33 H GLN 5 H GLN 5 19.209 5.186 -4.014
34 HA GLN 5 HA GLN 5 16.651 5.703 -4.990
35 HB2 GLN 5 HB3 GLN 5 18.550 3.430 -5.552
36 HB3 GLN 5 HB2 GLN 5 17.023 3.619 -6.399
37 HG2 GLN 5 HG3 GLN 5 18.677 4.535 -7.792
38 HG3 GLN 5 HG2 GLN 5 17.813 5.901 -7.093
39 HE21 GLN 5 HE21 GLN 5 20.774 4.093 -7.131
40 HE22 GLN 5 HE22 GLN 5 21.747 5.284 -6.336
41 H LEU 6 H LEU 6 17.830 2.923 -3.121
42 HA LEU 6 HA LEU 6 15.343 1.563 -3.145
43 HB2 LEU 6 HB3 LEU 6 17.920 1.263 -1.714
44 HB3 LEU 6 HB2 LEU 6 16.516 0.509 -0.995
45 HG LEU 6 HG LEU 6 16.154 -0.837 -2.977
46 HD11 LEU 6 HD11 LEU 6 18.548 0.587 -4.127
47 HD12 LEU 6 HD12 LEU 6 16.879 0.731 -4.682
48 HD13 LEU 6 HD13 LEU 6 17.735 -0.802 -4.847
49 HD21 LEU 6 HD21 LEU 6 17.669 -1.712 -1.298
50 HD22 LEU 6 HD22 LEU 6 19.026 -0.891 -2.070
51 HD23 LEU 6 HD23 LEU 6 18.190 -2.196 -2.911
52 H GLU 7 H GLU 7 16.798 3.907 -0.957
53 HA GLU 7 HA GLU 7 14.829 3.774 1.061
54 HB2 GLU 7 HB3 GLU 7 16.762 5.900 0.189
55 HB3 GLU 7 HB2 GLU 7 15.552 6.246 1.418
56 HG2 GLU 7 HG3 GLU 7 17.589 4.037 1.574
57 HG3 GLU 7 HG2 GLU 7 17.726 5.609 2.362
58 H ASP 8 H ASP 8 15.043 5.567 -1.959
59 HA ASP 8 HA ASP 8 12.649 7.047 -1.574
60 HB2 ASP 8 HB3 ASP 8 14.313 6.391 -3.988
61 HB3 ASP 8 HB2 ASP 8 12.755 7.195 -4.162
62 H LYS 9 H LYS 9 13.374 3.903 -2.968
63 HA LYS 9 HA LYS 9 10.907 3.392 -4.176
64 HB2 LYS 9 HB3 LYS 9 12.947 1.531 -2.971
65 HB3 LYS 9 HB2 LYS 9 11.506 0.953 -3.794
66 HG2 LYS 9 HG3 LYS 9 12.217 2.126 -5.828
67 HG3 LYS 9 HG2 LYS 9 13.682 2.650 -4.995
68 HD2 LYS 9 HD3 LYS 9 14.390 0.353 -4.720
69 HD3 LYS 9 HD2 LYS 9 12.879 -0.227 -5.425
70 HE2 LYS 9 HE3 LYS 9 14.927 1.464 -6.855
71 HE3 LYS 9 HE2 LYS 9 14.764 -0.285 -7.016
72 HZ1 LYS 9 HZ1 LYS 9 12.546 0.027 -7.897
73 HZ2 LYS 9 HZ2 LYS 9 13.661 0.906 -8.816
74 HZ3 LYS 9 HZ3 LYS 9 12.667 1.703 -7.706
75 H VAL 10 H VAL 10 12.003 2.199 -0.979
76 HA VAL 10 HA VAL 10 9.531 1.152 -0.209
77 HB VAL 10 HB VAL 10 11.535 0.563 1.005
78 HG11 VAL 10 HG11 VAL 10 12.738 2.674 0.880
79 HG12 VAL 10 HG12 VAL 10 12.640 2.103 2.545
80 HG13 VAL 10 HG13 VAL 10 11.588 3.408 1.998
81 HG21 VAL 10 HG21 VAL 10 9.547 2.002 2.755
82 HG22 VAL 10 HG22 VAL 10 10.724 0.816 3.318
83 HG23 VAL 10 HG23 VAL 10 9.448 0.330 2.201
84 H GLU 11 H GLU 11 10.841 4.405 0.184
85 HA GLU 11 HA GLU 11 8.787 5.469 1.778
86 HB2 GLU 11 HB3 GLU 11 10.944 6.581 1.444
87 HB3 GLU 11 HB2 GLU 11 10.562 6.836 -0.254
88 HG2 GLU 11 HG3 GLU 11 8.679 8.264 0.402
89 HG3 GLU 11 HG2 GLU 11 9.116 8.036 2.095
90 H GLU 12 H GLU 12 9.269 5.567 -1.748
91 HA GLU 12 HA GLU 12 6.879 6.892 -2.370
92 HB2 GLU 12 HB3 GLU 12 8.563 4.993 -3.992
93 HB3 GLU 12 HB2 GLU 12 7.166 5.831 -4.651
94 HG2 GLU 12 HG3 GLU 12 8.207 7.975 -4.182
95 HG3 GLU 12 HG2 GLU 12 9.593 7.155 -3.465
96 H LEU 13 H LEU 13 7.520 3.353 -2.245
97 HA LEU 13 HA LEU 13 4.856 2.801 -3.047
98 HB2 LEU 13 HB3 LEU 13 7.112 1.117 -2.093
99 HB3 LEU 13 HB2 LEU 13 5.502 0.428 -2.230
100 HG LEU 13 HG LEU 13 5.549 1.475 -4.614
101 HD11 LEU 13 HD11 LEU 13 8.494 1.212 -4.025
102 HD12 LEU 13 HD12 LEU 13 7.620 2.703 -4.378
103 HD13 LEU 13 HD13 LEU 13 7.787 1.463 -5.622
104 HD21 LEU 13 HD21 LEU 13 7.083 -1.004 -3.843
105 HD22 LEU 13 HD22 LEU 13 6.588 -0.607 -5.485
106 HD23 LEU 13 HD23 LEU 13 5.369 -0.887 -4.244
107 H LEU 14 H LEU 14 6.115 3.547 0.097
108 HA LEU 14 HA LEU 14 3.694 2.465 1.276
109 HB2 LEU 14 HB3 LEU 14 4.449 3.381 3.397
110 HB3 LEU 14 HB2 LEU 14 5.652 2.357 2.657
111 HG LEU 14 HG LEU 14 6.707 4.594 1.852
112 HD11 LEU 14 HD11 LEU 14 4.853 6.045 2.541
113 HD12 LEU 14 HD12 LEU 14 6.345 6.453 3.387
114 HD13 LEU 14 HD13 LEU 14 5.085 5.539 4.215
115 HD21 LEU 14 HD21 LEU 14 7.711 3.020 3.402
116 HD22 LEU 14 HD22 LEU 14 6.753 3.685 4.723
117 HD23 LEU 14 HD23 LEU 14 7.987 4.679 3.940
118 H SER 15 H SER 15 4.767 5.317 -0.208
119 HA SER 15 HA SER 15 2.782 7.078 0.737
120 HB2 SER 15 HB3 SER 15 4.720 7.950 -0.436
121 HB3 SER 15 HB2 SER 15 4.315 7.013 -1.872
122 HG SER 15 HG SER 15 3.131 9.341 -0.856
123 H LYS 16 H LYS 16 2.951 4.905 -2.147
124 HA LYS 16 HA LYS 16 0.287 5.482 -2.913
125 HB2 LYS 16 HB3 LYS 16 0.415 3.598 -4.407
126 HB3 LYS 16 HB2 LYS 16 1.970 4.413 -4.424
127 HG2 LYS 16 HG3 LYS 16 2.884 2.680 -2.959
128 HG3 LYS 16 HG2 LYS 16 1.321 1.859 -2.966
129 HD2 LYS 16 HD3 LYS 16 1.488 1.748 -5.465
130 HD3 LYS 16 HD2 LYS 16 3.134 2.362 -5.325
131 HE2 LYS 16 HE3 LYS 16 3.831 0.406 -4.116
132 HE3 LYS 16 HE2 LYS 16 2.162 -0.155 -3.981
133 HZ1 LYS 16 HZ1 LYS 16 3.307 -1.345 -5.714
134 HZ2 LYS 16 HZ2 LYS 16 3.724 0.097 -6.491
135 HZ3 LYS 16 HZ3 LYS 16 2.103 -0.376 -6.398
136 H ASN 17 H ASN 17 1.475 3.490 -0.337
137 HA ASN 17 HA ASN 17 -0.791 1.855 0.043
138 HB2 ASN 17 HB3 ASN 17 1.483 2.726 1.745
139 HB3 ASN 17 HB2 ASN 17 0.034 2.192 2.584
140 HD21 ASN 17 HD21 ASN 17 2.752 1.256 0.718
141 HD22 ASN 17 HD22 ASN 17 2.483 -0.450 0.789
142 H TYR 18 H TYR 18 -0.011 5.132 1.084
143 HA TYR 18 HA TYR 18 -2.236 5.466 2.793
144 HB2 TYR 18 HB3 TYR 18 -0.657 7.554 1.272
145 HB3 TYR 18 HB2 TYR 18 -1.799 7.895 2.567
146 HD1 TYR 18 HD1 TYR 18 1.506 7.911 1.956
147 HD2 TYR 18 HD2 TYR 18 -1.215 6.108 4.677
148 HE1 TYR 18 HE1 TYR 18 3.321 7.660 3.596
149 HE2 TYR 18 HE2 TYR 18 0.588 5.853 6.326
150 HH TYR 18 HH TYR 18 3.570 7.427 6.044
151 H HIS 19 H HIS 19 -1.690 6.156 -0.621
152 HA HIS 19 HA HIS 19 -4.224 7.308 -1.117
153 HB2 HIS 19 HB3 HIS 19 -2.268 5.945 -2.978
154 HB3 HIS 19 HB2 HIS 19 -3.730 6.758 -3.525
155 HD1 HIS 19 HD1 HIS 19 -0.451 7.464 -3.764
156 HD2 HIS 19 HD2 HIS 19 -3.513 9.524 -1.852
157 HE1 HIS 19 HE1 HIS 19 0.357 9.836 -3.552
158 HE2 HIS 19 HE2 HIS 19 -1.560 11.084 -2.504
159 H LEU 20 H LEU 20 -3.008 4.001 -1.290
160 HA LEU 20 HA LEU 20 -5.354 2.768 -2.210
161 HB2 LEU 20 HB3 LEU 20 -2.836 1.962 -1.034
162 HB3 LEU 20 HB2 LEU 20 -4.153 0.994 -0.403
163 HG LEU 20 HG LEU 20 -3.056 -0.049 -2.348
164 HD11 LEU 20 HD11 LEU 20 -5.080 -0.569 -3.594
165 HD12 LEU 20 HD12 LEU 20 -5.893 0.816 -2.869
166 HD13 LEU 20 HD13 LEU 20 -5.395 -0.540 -1.860
167 HD21 LEU 20 HD21 LEU 20 -2.417 1.967 -3.559
168 HD22 LEU 20 HD22 LEU 20 -4.116 2.331 -3.866
169 HD23 LEU 20 HD23 LEU 20 -3.381 0.896 -4.579
170 H GLU 21 H GLU 21 -4.249 3.545 1.070
171 HA GLU 21 HA GLU 21 -6.443 2.396 2.424
172 HB2 GLU 21 HB3 GLU 21 -4.210 3.130 3.402
173 HB3 GLU 21 HB2 GLU 21 -4.841 4.770 3.379
174 HG2 GLU 21 HG3 GLU 21 -6.407 2.635 4.729
175 HG3 GLU 21 HG2 GLU 21 -4.987 3.293 5.534
176 H ASN 22 H ASN 22 -5.895 5.581 1.045
177 HA ASN 22 HA ASN 22 -8.217 6.853 1.973
178 HB2 ASN 22 HB3 ASN 22 -6.474 7.272 -0.432
179 HB3 ASN 22 HB2 ASN 22 -7.970 8.180 -0.263
180 HD21 ASN 22 HD21 ASN 22 -5.989 7.230 2.461
181 HD22 ASN 22 HD22 ASN 22 -5.447 8.819 2.863
182 H GLU 23 H GLU 23 -7.735 4.501 -0.534
183 HA GLU 23 HA GLU 23 -10.309 4.885 -1.757
184 HB2 GLU 23 HB3 GLU 23 -8.338 2.592 -1.952
185 HB3 GLU 23 HB2 GLU 23 -9.805 2.760 -2.940
186 HG2 GLU 23 HG3 GLU 23 -8.916 4.818 -3.899
187 HG3 GLU 23 HG2 GLU 23 -7.464 4.662 -2.910
188 H VAL 24 H VAL 24 -8.885 2.692 0.614
189 HA VAL 24 HA VAL 24 -11.151 1.026 0.866
190 HB VAL 24 HB VAL 24 -9.020 1.494 2.963
191 HG11 VAL 24 HG11 VAL 24 -11.010 0.319 3.782
192 HG12 VAL 24 HG12 VAL 24 -9.603 -0.741 3.741
193 HG13 VAL 24 HG13 VAL 24 -10.841 -0.871 2.490
194 HG21 VAL 24 HG21 VAL 24 -7.876 -0.437 2.000
195 HG22 VAL 24 HG22 VAL 24 -7.999 0.885 0.840
196 HG23 VAL 24 HG23 VAL 24 -9.074 -0.508 0.711
197 H ALA 25 H ALA 25 -10.157 3.997 2.417
198 HA ALA 25 HA ALA 25 -12.123 3.910 4.484
199 HB1 ALA 25 HB1 ALA 25 -11.467 6.168 4.979
200 HB2 ALA 25 HB2 ALA 25 -10.662 6.317 3.420
201 HB3 ALA 25 HB3 ALA 25 -10.024 5.212 4.638
202 H ARG 26 H ARG 26 -12.017 5.283 1.240
203 HA ARG 26 HA ARG 26 -14.320 6.910 1.543
204 HB2 ARG 26 HB3 ARG 26 -14.085 7.439 -0.728
205 HB3 ARG 26 HB2 ARG 26 -12.456 7.091 -0.189
206 HG2 ARG 26 HG3 ARG 26 -12.597 4.853 -1.188
207 HG3 ARG 26 HG2 ARG 26 -14.217 5.250 -1.776
208 HD2 ARG 26 HD2 ARG 26 -12.482 5.538 -3.499
209 HD3 ARG 26 HD1 ARG 26 -13.334 7.034 -3.130
210 HE ARG 26 HE ARG 26 -11.194 7.219 -1.530
211 HH11 ARG 26 HH11 ARG 26 -11.465 6.379 -4.916
212 HH12 ARG 26 HH12 ARG 26 -9.946 7.092 -5.348
213 HH21 ARG 26 HH21 ARG 26 -9.198 8.167 -2.094
214 HH22 ARG 26 HH22 ARG 26 -8.647 8.102 -3.739
215 H LEU 27 H LEU 27 -13.777 3.705 0.246
216 HA LEU 27 HA LEU 27 -16.417 3.209 -0.632
217 HB2 LEU 27 HB3 LEU 27 -14.147 1.414 0.143
218 HB3 LEU 27 HB2 LEU 27 -15.698 0.777 -0.347
219 HG LEU 27 HG LEU 27 -14.195 2.676 -2.085
220 HD11 LEU 27 HD11 LEU 27 -12.753 0.791 -1.484
221 HD12 LEU 27 HD12 LEU 27 -13.158 0.848 -3.202
222 HD13 LEU 27 HD13 LEU 27 -13.971 -0.302 -2.141
223 HD21 LEU 27 HD21 LEU 27 -15.481 1.578 -3.857
224 HD22 LEU 27 HD22 LEU 27 -16.530 2.300 -2.637
225 HD23 LEU 27 HD23 LEU 27 -16.254 0.557 -2.644
226 H LYS 28 H LYS 28 -14.772 2.512 2.403
227 HA LYS 28 HA LYS 28 -16.674 1.115 3.781
228 HB2 LYS 28 HB3 LYS 28 -14.482 1.679 4.702
229 HB3 LYS 28 HB2 LYS 28 -14.951 3.368 4.831
230 HG2 LYS 28 HG3 LYS 28 -15.033 2.247 6.987
231 HG3 LYS 28 HG2 LYS 28 -16.631 2.796 6.487
232 HD2 LYS 28 HD3 LYS 28 -17.157 0.520 5.720
233 HD3 LYS 28 HD2 LYS 28 -15.568 -0.021 6.269
234 HE2 LYS 28 HE3 LYS 28 -16.124 0.546 8.552
235 HE3 LYS 28 HE2 LYS 28 -17.665 1.230 8.038
236 HZ1 LYS 28 HZ1 LYS 28 -16.868 -1.621 7.822
237 HZ2 LYS 28 HZ2 LYS 28 -18.340 -0.976 7.299
238 HZ3 LYS 28 HZ3 LYS 28 -17.955 -0.977 8.943
239 H LYS 29 H LYS 29 -16.620 4.617 3.230
240 HA LYS 29 HA LYS 29 -18.940 5.181 4.760
241 HB2 LYS 29 HB3 LYS 29 -17.343 6.670 2.717
242 HB3 LYS 29 HB2 LYS 29 -18.926 7.274 3.166
243 HG2 LYS 29 HG3 LYS 29 -17.177 8.375 4.432
244 HG3 LYS 29 HG2 LYS 29 -18.222 7.435 5.494
245 HD2 LYS 29 HD3 LYS 29 -16.563 5.647 5.553
246 HD3 LYS 29 HD2 LYS 29 -15.527 6.562 4.457
247 HE2 LYS 29 HE3 LYS 29 -15.334 8.341 6.118
248 HE3 LYS 29 HE2 LYS 29 -16.383 7.440 7.212
249 HZ1 LYS 29 HZ1 LYS 29 -13.739 6.524 6.221
250 HZ2 LYS 29 HZ2 LYS 29 -14.742 5.677 7.286
251 HZ3 LYS 29 HZ3 LYS 29 -14.048 7.143 7.762
252 H LEU 30 H LEU 30 -18.364 4.488 1.359
253 HA LEU 30 HA LEU 30 -20.948 5.019 0.392
254 HB2 LEU 30 HB3 LEU 30 -18.586 3.504 -0.560
255 HB3 LEU 30 HB2 LEU 30 -20.116 3.143 -1.329
256 HG LEU 30 HG LEU 30 -18.743 4.790 -2.572
257 HD11 LEU 30 HD11 LEU 30 -21.305 5.983 -1.529
258 HD12 LEU 30 HD12 LEU 30 -21.213 4.721 -2.755
259 HD13 LEU 30 HD13 LEU 30 -20.521 6.310 -3.074
260 HD21 LEU 30 HD21 LEU 30 -18.542 7.074 -1.720
261 HD22 LEU 30 HD22 LEU 30 -17.693 5.920 -0.691
262 HD23 LEU 30 HD23 LEU 30 -19.256 6.564 -0.190
263 H VAL 31 H VAL 31 -19.539 2.146 1.848
264 HA VAL 31 HA VAL 31 -21.700 0.407 1.220
265 HB VAL 31 HB VAL 31 -19.653 0.141 3.437
266 HG11 VAL 31 HG11 VAL 31 -21.455 -1.920 2.172
267 HG12 VAL 31 HG12 VAL 31 -21.579 -1.295 3.816
268 HG13 VAL 31 HG13 VAL 31 -20.177 -2.255 3.342
269 HG21 VAL 31 HG21 VAL 31 -18.599 0.324 1.261
270 HG22 VAL 31 HG22 VAL 31 -19.656 -0.936 0.624
271 HG23 VAL 31 HG23 VAL 31 -18.469 -1.326 1.870
272 H GLY 32 H GLY 32 -21.111 2.710 3.774
273 HA2 GLY 32 HA3 GLY 32 -23.549 3.301 4.572
274 HA3 GLY 32 HA2 GLY 32 -23.395 1.711 5.301
275 H GLU 33 H GLU 33 -20.991 4.292 4.964
276 HA GLU 33 HA GLU 33 -19.761 5.461 6.470
277 HB2 GLU 33 HB3 GLU 33 -22.157 6.085 7.177
278 HB3 GLU 33 HB2 GLU 33 -21.921 4.969 8.511
279 HG2 GLU 33 HG3 GLU 33 -20.111 7.310 7.968
280 HG3 GLU 33 HG2 GLU 33 -21.518 7.388 9.021
281 H1 GLY 1 H1 GLY 1 26.459 -1.718 2.358
282 H2 GLY 1 H2 GLY 1 25.905 -3.107 1.572
283 H3 GLY 1 H3 GLY 1 27.170 -3.216 2.689
284 HA2 GLY 1 HA2 GLY 1 25.111 -4.015 3.652
285 HA3 GLY 1 HA3 GLY 1 25.708 -2.587 4.482
286 H SER 2 H SER 2 23.001 -3.670 4.301
287 HA SER 2 HA SER 2 20.921 -2.713 4.479
288 HB2 SER 2 HB3 SER 2 22.237 -0.185 3.450
289 HB3 SER 2 HB2 SER 2 20.607 -0.301 4.113
290 HG SER 2 HG SER 2 21.404 -0.579 6.094
291 H MET 3 H MET 3 22.400 -3.679 1.938
292 HA MET 3 HA MET 3 20.787 -2.626 -0.196
293 HB2 MET 3 HB3 MET 3 23.070 -3.392 -0.607
294 HB3 MET 3 HB2 MET 3 22.648 -5.005 -0.048
295 HG2 MET 3 HG3 MET 3 22.734 -4.993 -2.445
296 HG3 MET 3 HG2 MET 3 21.057 -5.192 -1.938
297 HE1 MET 3 HE1 MET 3 20.139 -4.553 -4.330
298 HE2 MET 3 HE2 MET 3 21.804 -4.425 -4.896
299 HE3 MET 3 HE3 MET 3 20.657 -3.125 -5.226
300 H LYS 4 H LYS 4 21.070 -5.747 1.464
301 HA LYS 4 HA LYS 4 18.862 -6.959 0.189
302 HB2 LYS 4 HB3 LYS 4 20.651 -8.246 1.262
303 HB3 LYS 4 HB2 LYS 4 20.187 -7.605 2.830
304 HG2 LYS 4 HG3 LYS 4 18.034 -8.734 2.671
305 HG3 LYS 4 HG2 LYS 4 18.474 -9.361 1.082
306 HD2 LYS 4 HD3 LYS 4 20.198 -9.904 3.474
307 HD3 LYS 4 HD2 LYS 4 18.759 -10.873 3.169
308 HE2 LYS 4 HE3 LYS 4 20.688 -11.982 2.241
309 HE3 LYS 4 HE2 LYS 4 19.642 -11.435 0.935
310 HZ1 LYS 4 HZ1 LYS 4 22.038 -9.947 1.852
311 HZ2 LYS 4 HZ2 LYS 4 21.117 -9.651 0.464
312 HZ3 LYS 4 HZ3 LYS 4 22.054 -11.051 0.576
313 H GLN 5 H GLN 5 19.227 -5.369 3.334
314 HA GLN 5 HA GLN 5 16.673 -5.881 4.323
315 HB2 GLN 5 HB3 GLN 5 18.576 -3.614 4.880
316 HB3 GLN 5 HB2 GLN 5 17.052 -3.801 5.732
317 HG2 GLN 5 HG3 GLN 5 18.715 -4.719 7.120
318 HG3 GLN 5 HG2 GLN 5 17.839 -6.081 6.429
319 HE21 GLN 5 HE21 GLN 5 20.811 -4.297 6.446
320 HE22 GLN 5 HE22 GLN 5 21.769 -5.491 5.643
321 H LEU 6 H LEU 6 17.852 -3.105 2.448
322 HA LEU 6 HA LEU 6 15.365 -1.744 2.482
323 HB2 LEU 6 HB3 LEU 6 17.935 -1.453 1.040
324 HB3 LEU 6 HB2 LEU 6 16.530 -0.697 0.324
325 HG LEU 6 HG LEU 6 16.177 0.654 2.306
326 HD11 LEU 6 HD11 LEU 6 18.573 -0.772 3.452
327 HD12 LEU 6 HD12 LEU 6 16.905 -0.914 4.011
328 HD13 LEU 6 HD13 LEU 6 17.763 0.620 4.172
329 HD21 LEU 6 HD21 LEU 6 17.689 1.523 0.620
330 HD22 LEU 6 HD22 LEU 6 19.047 0.702 1.388
331 HD23 LEU 6 HD23 LEU 6 18.216 2.010 2.230
332 H GLU 7 H GLU 7 16.803 -4.093 0.288
333 HA GLU 7 HA GLU 7 14.823 -3.959 -1.721
334 HB2 GLU 7 HB3 GLU 7 16.754 -6.089 -0.853
335 HB3 GLU 7 HB2 GLU 7 15.540 -6.432 -2.077
336 HG2 GLU 7 HG3 GLU 7 17.582 -4.229 -2.243
337 HG3 GLU 7 HG2 GLU 7 17.715 -5.803 -3.027
338 H ASP 8 H ASP 8 15.053 -5.752 1.303
339 HA ASP 8 HA ASP 8 12.654 -7.227 0.932
340 HB2 ASP 8 HB3 ASP 8 14.325 -6.570 3.340
341 HB3 ASP 8 HB2 ASP 8 12.765 -7.367 3.523
342 H LYS 9 H LYS 9 13.388 -4.081 2.319
343 HA LYS 9 HA LYS 9 10.927 -3.563 3.533
344 HB2 LYS 9 HB3 LYS 9 12.966 -1.709 2.316
345 HB3 LYS 9 HB2 LYS 9 11.528 -1.125 3.142
346 HG2 LYS 9 HG3 LYS 9 12.244 -2.293 5.180
347 HG3 LYS 9 HG2 LYS 9 13.704 -2.824 4.343
348 HD2 LYS 9 HD3 LYS 9 14.417 -0.530 4.056
349 HD3 LYS 9 HD2 LYS 9 12.912 0.056 4.766
350 HE2 LYS 9 HE3 LYS 9 14.956 -1.643 6.188
351 HE3 LYS 9 HE2 LYS 9 14.808 0.106 6.348
352 HZ1 LYS 9 HZ1 LYS 9 12.585 -0.194 7.231
353 HZ2 LYS 9 HZ2 LYS 9 13.706 -1.057 8.155
354 HZ3 LYS 9 HZ3 LYS 9 12.710 -1.874 7.058
355 H VAL 10 H VAL 10 12.008 -2.373 0.329
356 HA VAL 10 HA VAL 10 9.534 -1.323 -0.432
357 HB VAL 10 HB VAL 10 11.538 -0.739 -1.655
358 HG11 VAL 10 HG11 VAL 10 12.735 -2.855 -1.534
359 HG12 VAL 10 HG12 VAL 10 12.630 -2.288 -3.201
360 HG13 VAL 10 HG13 VAL 10 11.577 -3.587 -2.643
361 HG21 VAL 10 HG21 VAL 10 9.539 -2.177 -3.392
362 HG22 VAL 10 HG22 VAL 10 10.715 -0.994 -3.963
363 HG23 VAL 10 HG23 VAL 10 9.445 -0.504 -2.841
364 H GLU 11 H GLU 11 10.839 -4.581 -0.823
365 HA GLU 11 HA GLU 11 8.776 -5.648 -2.408
366 HB2 GLU 11 HB3 GLU 11 10.934 -6.764 -2.080
367 HB3 GLU 11 HB2 GLU 11 10.559 -7.012 -0.381
368 HG2 GLU 11 HG3 GLU 11 8.671 -8.439 -1.025
369 HG3 GLU 11 HG2 GLU 11 9.102 -8.217 -2.720
370 H GLU 12 H GLU 12 9.269 -5.734 1.118
371 HA GLU 12 HA GLU 12 6.878 -7.054 1.752
372 HB2 GLU 12 HB3 GLU 12 8.574 -5.155 3.362
373 HB3 GLU 12 HB2 GLU 12 7.178 -5.991 4.028
374 HG2 GLU 12 HG3 GLU 12 8.212 -8.136 3.561
375 HG3 GLU 12 HG2 GLU 12 9.598 -7.322 2.835
376 H LEU 13 H LEU 13 7.529 -3.518 1.620
377 HA LEU 13 HA LEU 13 4.870 -2.960 2.432
378 HB2 LEU 13 HB3 LEU 13 7.125 -1.280 1.466
379 HB3 LEU 13 HB2 LEU 13 5.515 -0.589 1.608
380 HG LEU 13 HG LEU 13 5.571 -1.632 3.995
381 HD11 LEU 13 HD11 LEU 13 8.514 -1.375 3.390
382 HD12 LEU 13 HD12 LEU 13 7.638 -2.863 3.750
383 HD13 LEU 13 HD13 LEU 13 7.815 -1.623 4.991
384 HD21 LEU 13 HD21 LEU 13 7.109 0.842 3.212
385 HD22 LEU 13 HD22 LEU 13 6.620 0.450 4.860
386 HD23 LEU 13 HD23 LEU 13 5.397 0.731 3.623
387 H LEU 14 H LEU 14 6.116 -3.703 -0.720
388 HA LEU 14 HA LEU 14 3.687 -2.624 -1.890
389 HB2 LEU 14 HB3 LEU 14 4.432 -3.544 -4.014
390 HB3 LEU 14 HB2 LEU 14 5.640 -2.520 -3.281
391 HG LEU 14 HG LEU 14 6.695 -4.758 -2.475
392 HD11 LEU 14 HD11 LEU 14 4.835 -6.204 -3.155
393 HD12 LEU 14 HD12 LEU 14 6.322 -6.616 -4.005
394 HD13 LEU 14 HD13 LEU 14 5.061 -5.702 -4.830
395 HD21 LEU 14 HD21 LEU 14 7.698 -3.189 -4.033
396 HD22 LEU 14 HD22 LEU 14 6.732 -3.855 -5.349
397 HD23 LEU 14 HD23 LEU 14 7.966 -4.850 -4.569
398 H SER 15 H SER 15 4.765 -5.477 -0.407
399 HA SER 15 HA SER 15 2.771 -7.237 -1.335
400 HB2 SER 15 HB3 SER 15 4.712 -8.103 -0.169
401 HB3 SER 15 HB2 SER 15 4.317 -7.162 1.267
402 HG SER 15 HG SER 15 3.113 -9.487 0.254
403 H LYS 16 H LYS 16 2.954 -5.056 1.543
404 HA LYS 16 HA LYS 16 0.292 -5.628 2.319
405 HB2 LYS 16 HB3 LYS 16 0.430 -3.743 3.809
406 HB3 LYS 16 HB2 LYS 16 1.984 -4.560 3.821
407 HG2 LYS 16 HG3 LYS 16 2.897 -2.833 2.349
408 HG3 LYS 16 HG2 LYS 16 1.335 -2.008 2.362
409 HD2 LYS 16 HD3 LYS 16 1.512 -1.894 4.859
410 HD3 LYS 16 HD2 LYS 16 3.156 -2.511 4.715
411 HE2 LYS 16 HE3 LYS 16 3.849 -0.560 3.491
412 HE3 LYS 16 HE2 LYS 16 2.180 0.007 3.376
413 HZ1 LYS 16 HZ1 LYS 16 3.359 1.190 5.093
414 HZ2 LYS 16 HZ2 LYS 16 3.768 -0.256 5.868
415 HZ3 LYS 16 HZ3 LYS 16 2.153 0.232 5.791
416 H ASN 17 H ASN 17 1.478 -3.643 -0.259
417 HA ASN 17 HA ASN 17 -0.784 -2.003 -0.634
418 HB2 ASN 17 HB3 ASN 17 1.480 -2.881 -2.344
419 HB3 ASN 17 HB2 ASN 17 0.028 -2.347 -3.178
420 HD21 ASN 17 HD21 ASN 17 2.758 -1.411 -1.330
421 HD22 ASN 17 HD22 ASN 17 2.492 0.295 -1.404
422 H TYR 18 H TYR 18 -0.018 -5.282 -1.675
423 HA TYR 18 HA TYR 18 -2.253 -5.607 -3.375
424 HB2 TYR 18 HB3 TYR 18 -0.673 -7.698 -1.861
425 HB3 TYR 18 HB2 TYR 18 -1.824 -8.035 -3.148
426 HD1 TYR 18 HD1 TYR 18 1.487 -8.051 -2.554
427 HD2 TYR 18 HD2 TYR 18 -1.249 -6.262 -5.267
428 HE1 TYR 18 HE1 TYR 18 3.291 -7.817 -4.207
429 HE2 TYR 18 HE2 TYR 18 0.544 -6.024 -6.930
430 HH TYR 18 HH TYR 18 3.557 -7.588 -6.622
431 H HIS 19 H HIS 19 -1.691 -6.300 0.039
432 HA HIS 19 HA HIS 19 -4.227 -7.445 0.546
433 HB2 HIS 19 HB3 HIS 19 -2.258 -6.085 2.392
434 HB3 HIS 19 HB2 HIS 19 -3.721 -6.890 2.950
435 HD1 HIS 19 HD1 HIS 19 -0.441 -7.612 3.173
436 HD2 HIS 19 HD2 HIS 19 -3.529 -9.664 1.291
437 HE1 HIS 19 HE1 HIS 19 0.351 -9.987 2.964
438 HE2 HIS 19 HE2 HIS 19 -1.563 -11.228 1.899
439 H LEU 20 H LEU 20 -3.001 -4.140 0.710
440 HA LEU 20 HA LEU 20 -5.340 -2.900 1.636
441 HB2 LEU 20 HB3 LEU 20 -2.827 -2.102 0.451
442 HB3 LEU 20 HB2 LEU 20 -4.142 -1.133 -0.181
443 HG LEU 20 HG LEU 20 -3.038 -0.088 1.759
444 HD11 LEU 20 HD11 LEU 20 -5.055 0.439 3.014
445 HD12 LEU 20 HD12 LEU 20 -5.875 -0.945 2.295
446 HD13 LEU 20 HD13 LEU 20 -5.378 0.409 1.280
447 HD21 LEU 20 HD21 LEU 20 -2.398 -2.101 2.970
448 HD22 LEU 20 HD22 LEU 20 -4.097 -2.464 3.281
449 HD23 LEU 20 HD23 LEU 20 -3.359 -1.029 3.991
450 H GLU 21 H GLU 21 -4.255 -3.694 -1.645
451 HA GLU 21 HA GLU 21 -6.450 -2.535 -2.992
452 HB2 GLU 21 HB3 GLU 21 -4.225 -3.279 -3.979
453 HB3 GLU 21 HB2 GLU 21 -4.861 -4.916 -3.951
454 HG2 GLU 21 HG3 GLU 21 -6.420 -2.774 -5.299
455 HG3 GLU 21 HG2 GLU 21 -5.008 -3.444 -6.107
456 H ASN 22 H ASN 22 -5.907 -5.717 -1.606
457 HA ASN 22 HA ASN 22 -8.236 -6.987 -2.527
458 HB2 ASN 22 HB3 ASN 22 -6.479 -7.401 -0.131
459 HB3 ASN 22 HB2 ASN 22 -7.975 -8.311 -0.290
460 HD21 ASN 22 HD21 ASN 22 -5.999 -7.364 -3.021
461 HD22 ASN 22 HD22 ASN 22 -5.472 -8.955 -3.432
462 H GLU 23 H GLU 23 -7.734 -4.639 -0.020
463 HA GLU 23 HA GLU 23 -10.305 -5.006 1.208
464 HB2 GLU 23 HB3 GLU 23 -8.328 -2.718 1.389
465 HB3 GLU 23 HB2 GLU 23 -9.790 -2.879 2.384
466 HG2 GLU 23 HG3 GLU 23 -8.900 -4.937 3.348
467 HG3 GLU 23 HG2 GLU 23 -7.453 -4.786 2.353
468 H VAL 24 H VAL 24 -8.884 -2.818 -1.173
469 HA VAL 24 HA VAL 24 -11.150 -1.149 -1.421
470 HB VAL 24 HB VAL 24 -9.028 -1.623 -3.526
471 HG11 VAL 24 HG11 VAL 24 -11.022 -0.445 -4.337
472 HG12 VAL 24 HG12 VAL 24 -9.613 0.613 -4.301
473 HG13 VAL 24 HG13 VAL 24 -10.845 0.743 -3.044
474 HG21 VAL 24 HG21 VAL 24 -7.875 0.303 -2.567
475 HG22 VAL 24 HG22 VAL 24 -8.000 -1.018 -1.407
476 HG23 VAL 24 HG23 VAL 24 -9.069 0.379 -1.274
477 H ALA 25 H ALA 25 -10.166 -4.125 -2.970
478 HA ALA 25 HA ALA 25 -12.142 -4.043 -5.026
479 HB1 ALA 25 HB1 ALA 25 -11.490 -6.295 -5.528
480 HB2 ALA 25 HB2 ALA 25 -10.688 -6.455 -3.967
481 HB3 ALA 25 HB3 ALA 25 -10.044 -5.349 -5.181
482 H ARG 26 H ARG 26 -12.025 -5.410 -1.781
483 HA ARG 26 HA ARG 26 -14.335 -7.032 -2.071
484 HB2 ARG 26 HB3 ARG 26 -14.088 -7.554 0.195
485 HB3 ARG 26 HB2 ARG 26 -12.462 -7.210 -0.348
486 HG2 ARG 26 HG3 ARG 26 -12.596 -4.972 0.650
487 HG3 ARG 26 HG2 ARG 26 -14.214 -5.364 1.244
488 HD2 ARG 26 HD2 ARG 26 -12.476 -5.655 2.961
489 HD3 ARG 26 HD1 ARG 26 -13.331 -7.153 2.598
490 HE ARG 26 HE ARG 26 -11.195 -7.342 0.991
491 HH11 ARG 26 HH11 ARG 26 -11.455 -6.492 4.376
492 HH12 ARG 26 HH12 ARG 26 -9.930 -7.201 4.802
493 HH21 ARG 26 HH21 ARG 26 -9.188 -8.280 1.553
494 HH22 ARG 26 HH22 ARG 26 -8.640 -8.217 3.197
495 H LEU 27 H LEU 27 -13.777 -3.825 -0.781
496 HA LEU 27 HA LEU 27 -16.412 -3.321 0.103
497 HB2 LEU 27 HB3 LEU 27 -14.142 -1.531 -0.681
498 HB3 LEU 27 HB2 LEU 27 -15.691 -0.893 -0.184
499 HG LEU 27 HG LEU 27 -14.185 -2.792 1.549
500 HD11 LEU 27 HD11 LEU 27 -12.741 -0.911 0.938
501 HD12 LEU 27 HD12 LEU 27 -13.139 -0.965 2.658
502 HD13 LEU 27 HD13 LEU 27 -13.953 0.186 1.598
503 HD21 LEU 27 HD21 LEU 27 -15.460 -1.685 3.323
504 HD22 LEU 27 HD22 LEU 27 -16.518 -2.407 2.111
505 HD23 LEU 27 HD23 LEU 27 -16.236 -0.665 2.111
506 H LYS 28 H LYS 28 -14.779 -2.634 -2.939
507 HA LYS 28 HA LYS 28 -16.681 -1.230 -4.309
508 HB2 LYS 28 HB3 LYS 28 -14.498 -1.801 -5.241
509 HB3 LYS 28 HB2 LYS 28 -14.970 -3.490 -5.362
510 HG2 LYS 28 HG3 LYS 28 -15.059 -2.374 -7.521
511 HG3 LYS 28 HG2 LYS 28 -16.658 -2.919 -7.011
512 HD2 LYS 28 HD3 LYS 28 -17.173 -0.639 -6.248
513 HD3 LYS 28 HD2 LYS 28 -15.584 -0.105 -6.803
514 HE2 LYS 28 HE3 LYS 28 -16.149 -0.673 -9.082
515 HE3 LYS 28 HE2 LYS 28 -17.692 -1.350 -8.565
516 HZ1 LYS 28 HZ1 LYS 28 -16.886 1.497 -8.342
517 HZ2 LYS 28 HZ2 LYS 28 -18.359 0.852 -7.823
518 HZ3 LYS 28 HZ3 LYS 28 -17.973 0.858 -9.468
519 H LYS 29 H LYS 29 -16.640 -4.731 -3.747
520 HA LYS 29 HA LYS 29 -18.972 -5.276 -5.268
521 HB2 LYS 29 HB3 LYS 29 -17.374 -6.784 -3.233
522 HB3 LYS 29 HB2 LYS 29 -18.958 -7.381 -3.683
523 HG2 LYS 29 HG3 LYS 29 -17.190 -8.488 -4.932
524 HG3 LYS 29 HG2 LYS 29 -18.245 -7.579 -6.010
525 HD2 LYS 29 HD3 LYS 29 -16.601 -5.764 -6.076
526 HD3 LYS 29 HD2 LYS 29 -15.553 -6.676 -4.987
527 HE2 LYS 29 HE3 LYS 29 -15.385 -8.459 -6.651
528 HE3 LYS 29 HE2 LYS 29 -16.427 -7.545 -7.740
529 HZ1 LYS 29 HZ1 LYS 29 -13.772 -6.662 -6.748
530 HZ2 LYS 29 HZ2 LYS 29 -14.767 -5.800 -7.811
531 HZ3 LYS 29 HZ3 LYS 29 -14.092 -7.272 -8.292
532 H LEU 30 H LEU 30 -18.371 -4.599 -1.871
533 HA LEU 30 HA LEU 30 -20.951 -5.121 -0.895
534 HB2 LEU 30 HB3 LEU 30 -18.585 -3.603 0.044
535 HB3 LEU 30 HB2 LEU 30 -20.110 -3.244 0.821
536 HG LEU 30 HG LEU 30 -18.724 -4.889 2.056
537 HD11 LEU 30 HD11 LEU 30 -21.293 -6.082 1.033
538 HD12 LEU 30 HD12 LEU 30 -21.193 -4.815 2.253
539 HD13 LEU 30 HD13 LEU 30 -20.501 -6.403 2.574
540 HD21 LEU 30 HD21 LEU 30 -18.538 -7.176 1.208
541 HD22 LEU 30 HD22 LEU 30 -17.690 -6.026 0.173
542 HD23 LEU 30 HD23 LEU 30 -19.258 -6.668 -0.320
543 H VAL 31 H VAL 31 -19.543 -2.253 -2.362
544 HA VAL 31 HA VAL 31 -21.698 -0.505 -1.727
545 HB VAL 31 HB VAL 31 -19.657 -0.248 -3.951
546 HG11 VAL 31 HG11 VAL 31 -21.447 1.820 -2.684
547 HG12 VAL 31 HG12 VAL 31 -21.579 1.190 -4.325
548 HG13 VAL 31 HG13 VAL 31 -20.173 2.148 -3.859
549 HG21 VAL 31 HG21 VAL 31 -18.592 -0.431 -1.778
550 HG22 VAL 31 HG22 VAL 31 -19.642 0.832 -1.138
551 HG23 VAL 31 HG23 VAL 31 -18.463 1.217 -2.390
552 H GLY 32 H GLY 32 -21.124 -2.813 -4.280
553 HA2 GLY 32 HA3 GLY 32 -23.567 -3.393 -5.069
554 HA3 GLY 32 HA2 GLY 32 -23.411 -1.805 -5.801
555 H GLU 33 H GLU 33 -21.014 -4.392 -5.468
556 HA GLU 33 HA GLU 33 -19.795 -5.571 -6.975
557 HB2 GLU 33 HB3 GLU 33 -22.198 -6.194 -7.671
558 HB3 GLU 33 HB2 GLU 33 -21.965 -5.081 -9.008
559 HG2 GLU 33 HG3 GLU 33 -20.160 -7.424 -8.469
560 HG3 GLU 33 HG2 GLU 33 -21.571 -7.503 -9.517
Start of MODEL 19
1 H1 GLY 1 H1 GLY 1 24.436 2.771 -4.465
2 H2 GLY 1 H2 GLY 1 25.380 1.986 -3.306
3 H3 GLY 1 H3 GLY 1 25.802 3.536 -3.834
4 HA2 GLY 1 HA2 GLY 1 24.784 3.629 -1.652
5 HA3 GLY 1 HA3 GLY 1 23.821 4.468 -2.859
6 H SER 2 H SER 2 22.759 3.562 -0.442
7 HA SER 2 HA SER 2 21.098 1.306 -1.331
8 HB2 SER 2 HB3 SER 2 20.725 1.017 1.208
9 HB3 SER 2 HB2 SER 2 22.283 0.532 0.544
10 HG SER 2 HG SER 2 21.684 2.489 2.347
11 H MET 3 H MET 3 20.952 4.129 0.858
12 HA MET 3 HA MET 3 18.108 4.069 0.938
13 HB2 MET 3 HB3 MET 3 20.152 6.049 1.906
14 HB3 MET 3 HB2 MET 3 18.430 6.374 2.024
15 HG2 MET 3 HG3 MET 3 19.204 5.518 4.115
16 HG3 MET 3 HG2 MET 3 18.169 4.312 3.357
17 HE1 MET 3 HE1 MET 3 20.770 2.128 5.305
18 HE2 MET 3 HE2 MET 3 19.058 2.454 5.032
19 HE3 MET 3 HE3 MET 3 20.073 3.667 5.811
20 H LYS 4 H LYS 4 20.390 5.606 -1.156
21 HA LYS 4 HA LYS 4 18.935 7.863 -1.912
22 HB2 LYS 4 HB3 LYS 4 21.318 7.509 -2.448
23 HB3 LYS 4 HB2 LYS 4 20.860 6.273 -3.612
24 HG2 LYS 4 HG3 LYS 4 19.685 7.922 -4.946
25 HG3 LYS 4 HG2 LYS 4 20.051 9.171 -3.755
26 HD2 LYS 4 HD3 LYS 4 21.576 9.341 -5.624
27 HD3 LYS 4 HD2 LYS 4 22.454 8.838 -4.180
28 HE2 LYS 4 HE3 LYS 4 22.397 6.523 -4.949
29 HE3 LYS 4 HE2 LYS 4 21.495 7.013 -6.382
30 HZ1 LYS 4 HZ1 LYS 4 23.374 8.341 -7.079
31 HZ2 LYS 4 HZ2 LYS 4 23.852 6.737 -6.840
32 HZ3 LYS 4 HZ3 LYS 4 24.237 7.915 -5.688
33 H GLN 5 H GLN 5 19.069 4.686 -3.548
34 HA GLN 5 HA GLN 5 16.795 5.538 -5.179
35 HB2 GLN 5 HB3 GLN 5 18.595 3.127 -5.426
36 HB3 GLN 5 HB2 GLN 5 17.271 3.509 -6.518
37 HG2 GLN 5 HG3 GLN 5 18.375 5.578 -7.161
38 HG3 GLN 5 HG2 GLN 5 19.692 5.232 -6.041
39 HE21 GLN 5 HE21 GLN 5 19.741 5.619 -8.935
40 HE22 GLN 5 HE22 GLN 5 20.448 4.186 -9.593
41 H LEU 6 H LEU 6 17.712 2.951 -2.926
42 HA LEU 6 HA LEU 6 15.349 1.447 -3.355
43 HB2 LEU 6 HB3 LEU 6 17.451 1.360 -1.212
44 HB3 LEU 6 HB2 LEU 6 16.040 0.328 -1.160
45 HG LEU 6 HG LEU 6 17.873 -0.931 -2.044
46 HD11 LEU 6 HD11 LEU 6 15.672 -1.341 -3.030
47 HD12 LEU 6 HD12 LEU 6 16.980 -1.655 -4.170
48 HD13 LEU 6 HD13 LEU 6 16.031 -0.176 -4.302
49 HD21 LEU 6 HD21 LEU 6 19.280 0.900 -2.812
50 HD22 LEU 6 HD22 LEU 6 18.160 1.219 -4.136
51 HD23 LEU 6 HD23 LEU 6 19.055 -0.300 -4.086
52 H GLU 7 H GLU 7 16.275 3.731 -0.754
53 HA GLU 7 HA GLU 7 13.952 3.282 0.774
54 HB2 GLU 7 HB3 GLU 7 16.109 4.371 1.547
55 HB3 GLU 7 HB2 GLU 7 15.553 5.836 0.745
56 HG2 GLU 7 HG3 GLU 7 13.546 5.821 2.149
57 HG3 GLU 7 HG2 GLU 7 14.156 4.379 2.954
58 H ASP 8 H ASP 8 14.624 5.332 -1.965
59 HA ASP 8 HA ASP 8 12.281 6.939 -1.729
60 HB2 ASP 8 HB3 ASP 8 14.278 6.434 -3.892
61 HB3 ASP 8 HB2 ASP 8 12.741 7.179 -4.322
62 H LYS 9 H LYS 9 13.019 3.851 -3.198
63 HA LYS 9 HA LYS 9 10.551 3.536 -4.574
64 HB2 LYS 9 HB3 LYS 9 12.721 2.213 -4.902
65 HB3 LYS 9 HB2 LYS 9 12.256 1.301 -3.475
66 HG2 LYS 9 HG3 LYS 9 10.248 0.529 -4.576
67 HG3 LYS 9 HG2 LYS 9 10.615 1.521 -5.990
68 HD2 LYS 9 HD3 LYS 9 12.774 0.235 -6.189
69 HD3 LYS 9 HD2 LYS 9 12.151 -0.855 -4.952
70 HE2 LYS 9 HE3 LYS 9 10.806 -0.275 -7.588
71 HE3 LYS 9 HE2 LYS 9 11.802 -1.689 -7.254
72 HZ1 LYS 9 HZ1 LYS 9 9.445 -2.175 -7.043
73 HZ2 LYS 9 HZ2 LYS 9 9.280 -0.992 -5.850
74 HZ3 LYS 9 HZ3 LYS 9 10.230 -2.360 -5.559
75 H VAL 10 H VAL 10 11.728 2.707 -1.359
76 HA VAL 10 HA VAL 10 9.413 1.453 -0.355
77 HB VAL 10 HB VAL 10 11.356 3.188 1.189
78 HG11 VAL 10 HG11 VAL 10 9.341 2.700 2.434
79 HG12 VAL 10 HG12 VAL 10 10.697 1.791 3.100
80 HG13 VAL 10 HG13 VAL 10 9.509 0.981 2.080
81 HG21 VAL 10 HG21 VAL 10 11.493 0.225 0.668
82 HG22 VAL 10 HG22 VAL 10 12.605 1.165 1.663
83 HG23 VAL 10 HG23 VAL 10 12.523 1.445 -0.078
84 H GLU 11 H GLU 11 10.501 4.825 -0.228
85 HA GLU 11 HA GLU 11 8.336 5.939 1.125
86 HB2 GLU 11 HB3 GLU 11 10.441 7.125 0.708
87 HB3 GLU 11 HB2 GLU 11 10.094 7.166 -1.014
88 HG2 GLU 11 HG3 GLU 11 8.198 8.611 -0.633
89 HG3 GLU 11 HG2 GLU 11 8.443 8.510 1.109
90 H GLU 12 H GLU 12 8.804 5.388 -2.345
91 HA GLU 12 HA GLU 12 6.410 6.539 -3.239
92 HB2 GLU 12 HB3 GLU 12 8.046 4.266 -4.357
93 HB3 GLU 12 HB2 GLU 12 6.649 4.939 -5.187
94 HG2 GLU 12 HG3 GLU 12 7.727 7.116 -5.267
95 HG3 GLU 12 HG2 GLU 12 9.118 6.470 -4.400
96 H LEU 13 H LEU 13 7.034 3.101 -2.411
97 HA LEU 13 HA LEU 13 4.316 2.376 -2.700
98 HB2 LEU 13 HB3 LEU 13 6.749 1.080 -1.623
99 HB3 LEU 13 HB2 LEU 13 5.189 0.381 -1.215
100 HG LEU 13 HG LEU 13 5.618 1.065 -4.050
101 HD11 LEU 13 HD11 LEU 13 6.978 -1.285 -2.715
102 HD12 LEU 13 HD12 LEU 13 7.778 0.077 -3.500
103 HD13 LEU 13 HD13 LEU 13 6.823 -1.057 -4.455
104 HD21 LEU 13 HD21 LEU 13 4.407 -1.060 -4.343
105 HD22 LEU 13 HD22 LEU 13 3.540 0.083 -3.319
106 HD23 LEU 13 HD23 LEU 13 4.399 -1.275 -2.594
107 H LEU 14 H LEU 14 6.141 3.531 0.075
108 HA LEU 14 HA LEU 14 4.121 3.103 1.984
109 HB2 LEU 14 HB3 LEU 14 6.435 3.680 2.552
110 HB3 LEU 14 HB2 LEU 14 6.251 5.251 1.816
111 HG LEU 14 HG LEU 14 6.216 5.154 4.333
112 HD11 LEU 14 HD11 LEU 14 4.513 6.861 4.554
113 HD12 LEU 14 HD12 LEU 14 3.847 6.412 2.985
114 HD13 LEU 14 HD13 LEU 14 5.468 7.098 3.091
115 HD21 LEU 14 HD21 LEU 14 4.164 4.540 5.443
116 HD22 LEU 14 HD22 LEU 14 4.785 3.159 4.539
117 HD23 LEU 14 HD23 LEU 14 3.432 4.094 3.904
118 H SER 15 H SER 15 4.793 5.737 -0.256
119 HA SER 15 HA SER 15 2.628 7.388 0.396
120 HB2 SER 15 HB3 SER 15 4.518 8.088 -1.049
121 HB3 SER 15 HB2 SER 15 3.931 7.011 -2.314
122 HG SER 15 HG SER 15 2.967 9.473 -1.473
123 H LYS 16 H LYS 16 2.896 4.753 -2.056
124 HA LYS 16 HA LYS 16 0.210 4.891 -2.875
125 HB2 LYS 16 HB3 LYS 16 2.280 2.740 -2.931
126 HB3 LYS 16 HB2 LYS 16 0.615 2.331 -3.321
127 HG2 LYS 16 HG3 LYS 16 0.624 4.074 -5.065
128 HG3 LYS 16 HG2 LYS 16 2.319 4.397 -4.702
129 HD2 LYS 16 HD3 LYS 16 1.368 1.649 -5.448
130 HD3 LYS 16 HD2 LYS 16 1.779 2.846 -6.677
131 HE2 LYS 16 HE3 LYS 16 3.627 1.949 -4.472
132 HE3 LYS 16 HE2 LYS 16 3.643 1.301 -6.108
133 HZ1 LYS 16 HZ1 LYS 16 4.150 4.129 -5.350
134 HZ2 LYS 16 HZ2 LYS 16 4.127 3.535 -6.930
135 HZ3 LYS 16 HZ3 LYS 16 5.314 3.010 -5.850
136 H ASN 17 H ASN 17 1.689 2.884 -0.336
137 HA ASN 17 HA ASN 17 -0.504 1.522 0.610
138 HB2 ASN 17 HB3 ASN 17 1.782 1.158 1.406
139 HB3 ASN 17 HB2 ASN 17 1.783 2.736 2.179
140 HD21 ASN 17 HD21 ASN 17 2.138 2.008 4.213
141 HD22 ASN 17 HD22 ASN 17 0.991 1.082 5.114
142 H TYR 18 H TYR 18 0.450 4.844 1.281
143 HA TYR 18 HA TYR 18 -1.467 5.306 3.322
144 HB2 TYR 18 HB3 TYR 18 0.599 6.661 3.013
145 HB3 TYR 18 HB2 TYR 18 -0.090 7.325 1.536
146 HD1 TYR 18 HD1 TYR 18 -1.588 9.157 1.616
147 HD2 TYR 18 HD2 TYR 18 -0.542 7.124 5.202
148 HE1 TYR 18 HE1 TYR 18 -2.675 10.927 2.933
149 HE2 TYR 18 HE2 TYR 18 -1.627 8.885 6.523
150 HH TYR 18 HH TYR 18 -3.708 11.163 5.218
151 H HIS 19 H HIS 19 -1.331 6.365 -0.076
152 HA HIS 19 HA HIS 19 -3.890 7.567 -0.066
153 HB2 HIS 19 HB3 HIS 19 -2.184 6.576 -2.353
154 HB3 HIS 19 HB2 HIS 19 -3.669 7.493 -2.565
155 HD1 HIS 19 HD1 HIS 19 -0.117 7.929 -2.294
156 HD2 HIS 19 HD2 HIS 19 -3.461 10.148 -1.205
157 HE1 HIS 19 HE1 HIS 19 0.707 10.280 -1.969
158 HE2 HIS 19 HE2 HIS 19 -1.295 11.559 -1.140
159 H LEU 20 H LEU 20 -2.797 4.319 -0.764
160 HA LEU 20 HA LEU 20 -5.223 3.452 -1.971
161 HB2 LEU 20 HB3 LEU 20 -3.042 2.432 -2.423
162 HB3 LEU 20 HB2 LEU 20 -2.935 1.909 -0.756
163 HG LEU 20 HG LEU 20 -4.909 0.477 -1.117
164 HD11 LEU 20 HD11 LEU 20 -5.643 0.018 -3.405
165 HD12 LEU 20 HD12 LEU 20 -4.572 1.285 -4.000
166 HD13 LEU 20 HD13 LEU 20 -5.936 1.698 -2.960
167 HD21 LEU 20 HD21 LEU 20 -2.647 -0.015 -3.040
168 HD22 LEU 20 HD22 LEU 20 -3.728 -1.228 -2.357
169 HD23 LEU 20 HD23 LEU 20 -2.604 -0.362 -1.313
170 H GLU 21 H GLU 21 -3.875 3.389 1.299
171 HA GLU 21 HA GLU 21 -5.946 1.809 2.440
172 HB2 GLU 21 HB3 GLU 21 -3.726 2.292 3.518
173 HB3 GLU 21 HB2 GLU 21 -4.290 3.929 3.824
174 HG2 GLU 21 HG3 GLU 21 -6.081 3.070 5.216
175 HG3 GLU 21 HG2 GLU 21 -5.569 1.418 4.880
176 H ASN 22 H ASN 22 -5.551 5.217 1.782
177 HA ASN 22 HA ASN 22 -7.874 6.126 3.110
178 HB2 ASN 22 HB3 ASN 22 -6.220 7.248 0.861
179 HB3 ASN 22 HB2 ASN 22 -7.694 8.047 1.388
180 HD21 ASN 22 HD21 ASN 22 -5.608 6.355 3.609
181 HD22 ASN 22 HD22 ASN 22 -5.016 7.757 4.426
182 H GLU 23 H GLU 23 -7.330 4.502 0.111
183 HA GLU 23 HA GLU 23 -9.763 5.205 -1.172
184 HB2 GLU 23 HB3 GLU 23 -7.810 2.957 -1.623
185 HB3 GLU 23 HB2 GLU 23 -9.273 3.180 -2.610
186 HG2 GLU 23 HG3 GLU 23 -8.476 5.403 -3.256
187 HG3 GLU 23 HG2 GLU 23 -7.019 5.158 -2.292
188 H VAL 24 H VAL 24 -8.754 2.464 0.825
189 HA VAL 24 HA VAL 24 -11.138 0.965 0.551
190 HB VAL 24 HB VAL 24 -9.470 0.920 3.070
191 HG11 VAL 24 HG11 VAL 24 -10.935 -1.290 1.610
192 HG12 VAL 24 HG12 VAL 24 -11.571 -0.394 2.994
193 HG13 VAL 24 HG13 VAL 24 -10.139 -1.406 3.180
194 HG21 VAL 24 HG21 VAL 24 -8.000 -0.726 2.065
195 HG22 VAL 24 HG22 VAL 24 -7.907 0.791 1.177
196 HG23 VAL 24 HG23 VAL 24 -8.832 -0.560 0.523
197 H ALA 25 H ALA 25 -10.196 3.658 2.552
198 HA ALA 25 HA ALA 25 -12.399 3.465 4.368
199 HB1 ALA 25 HB1 ALA 25 -10.685 5.878 3.838
200 HB2 ALA 25 HB2 ALA 25 -10.228 4.556 4.911
201 HB3 ALA 25 HB3 ALA 25 -11.646 5.538 5.276
202 H ARG 26 H ARG 26 -11.936 4.915 1.239
203 HA ARG 26 HA ARG 26 -14.004 6.842 1.307
204 HB2 ARG 26 HB3 ARG 26 -13.292 5.216 -1.136
205 HB3 ARG 26 HB2 ARG 26 -13.995 6.821 -1.088
206 HG2 ARG 26 HG3 ARG 26 -11.821 7.596 -0.061
207 HG3 ARG 26 HG2 ARG 26 -11.183 6.002 -0.486
208 HD2 ARG 26 HD2 ARG 26 -11.759 6.376 -2.821
209 HD3 ARG 26 HD1 ARG 26 -12.415 7.961 -2.417
210 HE ARG 26 HE ARG 26 -9.764 7.884 -1.543
211 HH11 ARG 26 HH11 ARG 26 -11.560 7.794 -4.545
212 HH12 ARG 26 HH12 ARG 26 -10.303 8.548 -5.473
213 HH21 ARG 26 HH21 ARG 26 -8.086 8.854 -2.766
214 HH22 ARG 26 HH22 ARG 26 -8.323 9.146 -4.461
215 H LEU 27 H LEU 27 -13.915 3.501 0.199
216 HA LEU 27 HA LEU 27 -16.649 3.400 -0.498
217 HB2 LEU 27 HB3 LEU 27 -14.559 1.288 -0.087
218 HB3 LEU 27 HB2 LEU 27 -16.223 0.871 -0.436
219 HG LEU 27 HG LEU 27 -16.087 2.111 -2.563
220 HD11 LEU 27 HD11 LEU 27 -13.182 2.466 -1.849
221 HD12 LEU 27 HD12 LEU 27 -14.386 3.744 -2.010
222 HD13 LEU 27 HD13 LEU 27 -13.900 2.808 -3.423
223 HD21 LEU 27 HD21 LEU 27 -15.653 -0.269 -2.526
224 HD22 LEU 27 HD22 LEU 27 -13.951 0.031 -2.174
225 HD23 LEU 27 HD23 LEU 27 -14.633 0.531 -3.722
226 H LYS 28 H LYS 28 -14.978 2.817 2.524
227 HA LYS 28 HA LYS 28 -16.902 1.420 3.948
228 HB2 LYS 28 HB3 LYS 28 -15.089 3.667 4.835
229 HB3 LYS 28 HB2 LYS 28 -16.091 2.753 5.949
230 HG2 LYS 28 HG3 LYS 28 -13.986 1.544 4.171
231 HG3 LYS 28 HG2 LYS 28 -13.737 1.998 5.857
232 HD2 LYS 28 HD3 LYS 28 -15.783 0.005 4.883
233 HD3 LYS 28 HD2 LYS 28 -14.211 -0.410 5.566
234 HE2 LYS 28 HE3 LYS 28 -14.849 0.717 7.660
235 HE3 LYS 28 HE2 LYS 28 -16.433 1.068 6.973
236 HZ1 LYS 28 HZ1 LYS 28 -15.314 -1.637 7.451
237 HZ2 LYS 28 HZ2 LYS 28 -16.828 -1.309 6.776
238 HZ3 LYS 28 HZ3 LYS 28 -16.507 -0.882 8.377
239 H LYS 29 H LYS 29 -16.718 4.873 3.263
240 HA LYS 29 HA LYS 29 -19.052 5.598 4.692
241 HB2 LYS 29 HB3 LYS 29 -17.585 6.979 2.441
242 HB3 LYS 29 HB2 LYS 29 -18.823 7.719 3.441
243 HG2 LYS 29 HG3 LYS 29 -17.463 7.627 5.368
244 HG3 LYS 29 HG2 LYS 29 -16.303 6.559 4.582
245 HD2 LYS 29 HD3 LYS 29 -15.381 8.781 4.700
246 HD3 LYS 29 HD2 LYS 29 -15.733 8.393 3.018
247 HE2 LYS 29 HE3 LYS 29 -17.705 9.892 4.703
248 HE3 LYS 29 HE2 LYS 29 -16.361 10.728 3.932
249 HZ1 LYS 29 HZ1 LYS 29 -18.308 10.833 2.552
250 HZ2 LYS 29 HZ2 LYS 29 -18.471 9.155 2.561
251 HZ3 LYS 29 HZ3 LYS 29 -17.148 9.866 1.791
252 H LEU 30 H LEU 30 -18.413 4.520 1.437
253 HA LEU 30 HA LEU 30 -20.954 5.210 0.351
254 HB2 LEU 30 HB3 LEU 30 -18.873 3.232 -0.512
255 HB3 LEU 30 HB2 LEU 30 -20.285 3.634 -1.469
256 HG LEU 30 HG LEU 30 -18.052 5.522 -0.705
257 HD11 LEU 30 HD11 LEU 30 -17.399 3.900 -2.404
258 HD12 LEU 30 HD12 LEU 30 -17.551 5.514 -3.096
259 HD13 LEU 30 HD13 LEU 30 -18.819 4.320 -3.361
260 HD21 LEU 30 HD21 LEU 30 -19.179 7.110 -2.204
261 HD22 LEU 30 HD22 LEU 30 -20.173 6.699 -0.807
262 HD23 LEU 30 HD23 LEU 30 -20.519 5.978 -2.379
263 H VAL 31 H VAL 31 -19.662 2.394 1.999
264 HA VAL 31 HA VAL 31 -21.943 0.736 1.392
265 HB VAL 31 HB VAL 31 -19.790 0.258 3.474
266 HG11 VAL 31 HG11 VAL 31 -21.707 -1.649 2.139
267 HG12 VAL 31 HG12 VAL 31 -21.794 -1.093 3.812
268 HG13 VAL 31 HG13 VAL 31 -20.438 -2.088 3.282
269 HG21 VAL 31 HG21 VAL 31 -19.923 -0.707 0.622
270 HG22 VAL 31 HG22 VAL 31 -18.695 -1.139 1.812
271 HG23 VAL 31 HG23 VAL 31 -18.824 0.525 1.241
272 H GLY 32 H GLY 32 -20.987 2.957 3.885
273 HA2 GLY 32 HA3 GLY 32 -23.503 3.346 4.916
274 HA3 GLY 32 HA2 GLY 32 -22.825 2.029 5.858
275 H GLU 33 H GLU 33 -21.748 5.198 4.608
276 HA GLU 33 HA GLU 33 -20.056 5.983 6.582
277 HB2 GLU 33 HB3 GLU 33 -21.205 8.343 6.275
278 HB3 GLU 33 HB2 GLU 33 -20.232 7.621 5.009
279 HG2 GLU 33 HG3 GLU 33 -22.165 8.542 3.998
280 HG3 GLU 33 HG2 GLU 33 -22.331 6.793 3.955
281 H1 GLY 1 H1 GLY 1 24.456 -2.982 3.766
282 H2 GLY 1 H2 GLY 1 25.397 -2.194 2.606
283 H3 GLY 1 H3 GLY 1 25.819 -3.746 3.125
284 HA2 GLY 1 HA2 GLY 1 24.794 -3.830 0.949
285 HA3 GLY 1 HA3 GLY 1 23.826 -4.663 2.158
286 H SER 2 H SER 2 22.752 -3.762 -0.238
287 HA SER 2 HA SER 2 21.105 -1.498 0.654
288 HB2 SER 2 HB3 SER 2 20.724 -1.206 -1.887
289 HB3 SER 2 HB2 SER 2 22.277 -0.709 -1.216
290 HG SER 2 HG SER 2 21.692 -2.704 -3.008
291 H MET 3 H MET 3 20.946 -4.321 -1.537
292 HA MET 3 HA MET 3 18.101 -4.247 -1.609
293 HB2 MET 3 HB3 MET 3 20.132 -6.233 -2.591
294 HB3 MET 3 HB2 MET 3 18.409 -6.551 -2.704
295 HG2 MET 3 HG3 MET 3 19.182 -5.692 -4.794
296 HG3 MET 3 HG2 MET 3 18.149 -4.487 -4.030
297 HE1 MET 3 HE1 MET 3 20.753 -2.307 -5.980
298 HE2 MET 3 HE2 MET 3 19.040 -2.628 -5.704
299 HE3 MET 3 HE3 MET 3 20.050 -3.844 -6.484
300 H LYS 4 H LYS 4 20.390 -5.799 0.471
301 HA LYS 4 HA LYS 4 18.930 -8.057 1.224
302 HB2 LYS 4 HB3 LYS 4 21.316 -7.711 1.751
303 HB3 LYS 4 HB2 LYS 4 20.866 -6.474 2.918
304 HG2 LYS 4 HG3 LYS 4 19.692 -8.122 4.255
305 HG3 LYS 4 HG2 LYS 4 20.052 -9.371 3.063
306 HD2 LYS 4 HD3 LYS 4 21.585 -9.547 4.930
307 HD3 LYS 4 HD2 LYS 4 22.456 -9.047 3.483
308 HE2 LYS 4 HE3 LYS 4 22.414 -6.730 4.250
309 HE3 LYS 4 HE2 LYS 4 21.518 -7.216 5.688
310 HZ1 LYS 4 HZ1 LYS 4 23.398 -8.557 6.369
311 HZ2 LYS 4 HZ2 LYS 4 23.878 -6.953 6.141
312 HZ3 LYS 4 HZ3 LYS 4 24.255 -8.123 4.978
313 H GLN 5 H GLN 5 19.077 -4.883 2.864
314 HA GLN 5 HA GLN 5 16.811 -5.729 4.511
315 HB2 GLN 5 HB3 GLN 5 18.616 -3.322 4.751
316 HB3 GLN 5 HB2 GLN 5 17.298 -3.704 5.851
317 HG2 GLN 5 HG3 GLN 5 18.406 -5.777 6.480
318 HG3 GLN 5 HG2 GLN 5 19.719 -5.423 5.360
319 HE21 GLN 5 HE21 GLN 5 19.780 -5.833 8.241
320 HE22 GLN 5 HE22 GLN 5 20.479 -4.402 8.917
321 H LEU 6 H LEU 6 17.724 -3.135 2.266
322 HA LEU 6 HA LEU 6 15.363 -1.632 2.698
323 HB2 LEU 6 HB3 LEU 6 17.457 -1.544 0.547
324 HB3 LEU 6 HB2 LEU 6 16.047 -0.509 0.508
325 HG LEU 6 HG LEU 6 17.889 0.742 1.387
326 HD11 LEU 6 HD11 LEU 6 15.692 1.154 2.380
327 HD12 LEU 6 HD12 LEU 6 17.003 1.463 3.517
328 HD13 LEU 6 HD13 LEU 6 16.053 -0.015 3.651
329 HD21 LEU 6 HD21 LEU 6 19.297 -1.091 2.146
330 HD22 LEU 6 HD22 LEU 6 18.181 -1.413 3.475
331 HD23 LEU 6 HD23 LEU 6 19.077 0.105 3.422
332 H GLU 7 H GLU 7 16.280 -3.909 0.086
333 HA GLU 7 HA GLU 7 13.949 -3.455 -1.428
334 HB2 GLU 7 HB3 GLU 7 16.100 -4.546 -2.214
335 HB3 GLU 7 HB2 GLU 7 15.545 -6.011 -1.413
336 HG2 GLU 7 HG3 GLU 7 13.530 -5.986 -2.807
337 HG3 GLU 7 HG2 GLU 7 14.141 -4.545 -3.613
338 H ASP 8 H ASP 8 14.631 -5.510 1.305
339 HA ASP 8 HA ASP 8 12.286 -7.115 1.071
340 HB2 ASP 8 HB3 ASP 8 14.291 -6.624 3.229
341 HB3 ASP 8 HB2 ASP 8 12.750 -7.359 3.665
342 H LYS 9 H LYS 9 13.031 -4.033 2.544
343 HA LYS 9 HA LYS 9 10.570 -3.720 3.935
344 HB2 LYS 9 HB3 LYS 9 12.743 -2.400 4.258
345 HB3 LYS 9 HB2 LYS 9 12.276 -1.485 2.833
346 HG2 LYS 9 HG3 LYS 9 10.273 -0.710 3.940
347 HG3 LYS 9 HG2 LYS 9 10.640 -1.704 5.353
348 HD2 LYS 9 HD3 LYS 9 12.804 -0.425 5.548
349 HD3 LYS 9 HD2 LYS 9 12.178 0.670 4.315
350 HE2 LYS 9 HE3 LYS 9 10.845 0.085 6.953
351 HE3 LYS 9 HE2 LYS 9 11.836 1.500 6.618
352 HZ1 LYS 9 HZ1 LYS 9 9.476 1.978 6.421
353 HZ2 LYS 9 HZ2 LYS 9 9.313 0.800 5.224
354 HZ3 LYS 9 HZ3 LYS 9 10.254 2.173 4.934
355 H VAL 10 H VAL 10 11.733 -2.879 0.719
356 HA VAL 10 HA VAL 10 9.416 -1.621 -0.274
357 HB VAL 10 HB VAL 10 11.349 -3.356 -1.830
358 HG11 VAL 10 HG11 VAL 10 9.330 -2.859 -3.066
359 HG12 VAL 10 HG12 VAL 10 10.686 -1.951 -3.735
360 HG13 VAL 10 HG13 VAL 10 9.505 -1.141 -2.708
361 HG21 VAL 10 HG21 VAL 10 11.493 -0.394 -1.303
362 HG22 VAL 10 HG22 VAL 10 12.600 -1.335 -2.303
363 HG23 VAL 10 HG23 VAL 10 12.525 -1.619 -0.564
364 H GLU 11 H GLU 11 10.496 -4.993 -0.412
365 HA GLU 11 HA GLU 11 8.323 -6.098 -1.760
366 HB2 GLU 11 HB3 GLU 11 10.424 -7.288 -1.351
367 HB3 GLU 11 HB2 GLU 11 10.082 -7.336 0.369
368 HG2 GLU 11 HG3 GLU 11 8.187 -8.781 -0.008
369 HG3 GLU 11 HG2 GLU 11 8.417 -8.668 -1.753
370 H GLU 12 H GLU 12 8.809 -5.560 1.713
371 HA GLU 12 HA GLU 12 6.416 -6.706 2.611
372 HB2 GLU 12 HB3 GLU 12 8.064 -4.444 3.728
373 HB3 GLU 12 HB2 GLU 12 6.668 -5.113 4.564
374 HG2 GLU 12 HG3 GLU 12 7.738 -7.297 4.631
375 HG3 GLU 12 HG2 GLU 12 9.126 -6.653 3.757
376 H LEU 13 H LEU 13 7.044 -3.269 1.795
377 HA LEU 13 HA LEU 13 4.329 -2.539 2.093
378 HB2 LEU 13 HB3 LEU 13 6.758 -1.243 1.008
379 HB3 LEU 13 HB2 LEU 13 5.197 -0.542 0.610
380 HG LEU 13 HG LEU 13 5.637 -1.237 3.440
381 HD11 LEU 13 HD11 LEU 13 6.999 1.116 2.111
382 HD12 LEU 13 HD12 LEU 13 7.798 -0.253 2.883
383 HD13 LEU 13 HD13 LEU 13 6.852 0.877 3.852
384 HD21 LEU 13 HD21 LEU 13 4.430 0.889 3.747
385 HD22 LEU 13 HD22 LEU 13 3.557 -0.249 2.722
386 HD23 LEU 13 HD23 LEU 13 4.414 1.110 1.999
387 H LEU 14 H LEU 14 6.139 -3.694 -0.692
388 HA LEU 14 HA LEU 14 4.112 -3.257 -2.592
389 HB2 LEU 14 HB3 LEU 14 6.423 -3.834 -3.173
390 HB3 LEU 14 HB2 LEU 14 6.242 -5.407 -2.439
391 HG LEU 14 HG LEU 14 6.198 -5.307 -4.955
392 HD11 LEU 14 HD11 LEU 14 4.491 -7.011 -5.172
393 HD12 LEU 14 HD12 LEU 14 3.833 -6.565 -3.597
394 HD13 LEU 14 HD13 LEU 14 5.454 -7.253 -3.714
395 HD21 LEU 14 HD21 LEU 14 4.142 -4.687 -6.060
396 HD22 LEU 14 HD22 LEU 14 4.767 -3.309 -5.156
397 HD23 LEU 14 HD23 LEU 14 3.414 -4.243 -4.517
398 H SER 15 H SER 15 4.789 -5.902 -0.363
399 HA SER 15 HA SER 15 2.617 -7.544 -1.013
400 HB2 SER 15 HB3 SER 15 4.523 -8.238 0.422
401 HB3 SER 15 HB2 SER 15 3.926 -7.177 1.696
402 HG SER 15 HG SER 15 2.972 -9.634 0.816
403 H LYS 16 H LYS 16 2.903 -4.918 1.446
404 HA LYS 16 HA LYS 16 0.221 -5.047 2.276
405 HB2 LYS 16 HB3 LYS 16 2.295 -2.900 2.328
406 HB3 LYS 16 HB2 LYS 16 0.632 -2.489 2.727
407 HG2 LYS 16 HG3 LYS 16 0.644 -4.234 4.467
408 HG3 LYS 16 HG2 LYS 16 2.337 -4.561 4.096
409 HD2 LYS 16 HD3 LYS 16 1.393 -1.813 4.853
410 HD3 LYS 16 HD2 LYS 16 1.809 -3.013 6.075
411 HE2 LYS 16 HE3 LYS 16 3.647 -2.114 3.865
412 HE3 LYS 16 HE2 LYS 16 3.670 -1.467 5.503
413 HZ1 LYS 16 HZ1 LYS 16 4.170 -4.295 4.739
414 HZ2 LYS 16 HZ2 LYS 16 4.155 -3.703 6.322
415 HZ3 LYS 16 HZ3 LYS 16 5.338 -3.180 5.236
416 H ASN 17 H ASN 17 1.690 -3.040 -0.267
417 HA ASN 17 HA ASN 17 -0.505 -1.669 -1.196
418 HB2 ASN 17 HB3 ASN 17 1.773 -1.305 -2.004
419 HB3 ASN 17 HB2 ASN 17 1.775 -2.885 -2.774
420 HD21 ASN 17 HD21 ASN 17 2.124 -2.164 -4.811
421 HD22 ASN 17 HD22 ASN 17 0.976 -1.239 -5.714
422 H TYR 18 H TYR 18 0.448 -4.989 -1.893
423 HA TYR 18 HA TYR 18 -1.488 -5.444 -3.915
424 HB2 TYR 18 HB3 TYR 18 0.579 -6.804 -3.621
425 HB3 TYR 18 HB2 TYR 18 -0.107 -7.472 -2.144
426 HD1 TYR 18 HD1 TYR 18 -1.607 -9.299 -2.222
427 HD2 TYR 18 HD2 TYR 18 -0.580 -7.254 -5.805
428 HE1 TYR 18 HE1 TYR 18 -2.708 -11.063 -3.537
429 HE2 TYR 18 HE2 TYR 18 -1.675 -9.007 -7.129
430 HH TYR 18 HH TYR 18 -3.739 -11.308 -5.797
431 H HIS 19 H HIS 19 -1.334 -6.513 -0.518
432 HA HIS 19 HA HIS 19 -3.895 -7.710 -0.522
433 HB2 HIS 19 HB3 HIS 19 -2.180 -6.727 1.764
434 HB3 HIS 19 HB2 HIS 19 -3.667 -7.642 1.980
435 HD1 HIS 19 HD1 HIS 19 -0.120 -8.084 1.704
436 HD2 HIS 19 HD2 HIS 19 -3.469 -10.290 0.613
437 HE1 HIS 19 HE1 HIS 19 0.702 -10.436 1.353
438 HE2 HIS 19 HE2 HIS 19 -1.313 -11.712 0.536
439 H LEU 20 H LEU 20 -2.793 -4.467 0.184
440 HA LEU 20 HA LEU 20 -5.213 -3.596 1.398
441 HB2 LEU 20 HB3 LEU 20 -3.027 -2.580 1.842
442 HB3 LEU 20 HB2 LEU 20 -2.932 -2.052 0.176
443 HG LEU 20 HG LEU 20 -4.901 -0.621 0.552
444 HD11 LEU 20 HD11 LEU 20 -5.623 -0.165 2.845
445 HD12 LEU 20 HD12 LEU 20 -4.554 -1.438 3.431
446 HD13 LEU 20 HD13 LEU 20 -5.921 -1.844 2.396
447 HD21 LEU 20 HD21 LEU 20 -2.630 -0.139 2.467
448 HD22 LEU 20 HD22 LEU 20 -3.712 1.078 1.792
449 HD23 LEU 20 HD23 LEU 20 -2.595 0.214 0.741
450 H GLU 21 H GLU 21 -3.883 -3.530 -1.880
451 HA GLU 21 HA GLU 21 -5.957 -1.942 -3.004
452 HB2 GLU 21 HB3 GLU 21 -3.746 -2.423 -4.094
453 HB3 GLU 21 HB2 GLU 21 -4.310 -4.059 -4.399
454 HG2 GLU 21 HG3 GLU 21 -6.104 -3.204 -5.788
455 HG3 GLU 21 HG2 GLU 21 -5.599 -1.551 -5.447
456 H ASN 22 H ASN 22 -5.562 -5.352 -2.360
457 HA ASN 22 HA ASN 22 -7.895 -6.247 -3.681
458 HB2 ASN 22 HB3 ASN 22 -6.227 -7.382 -1.451
459 HB3 ASN 22 HB2 ASN 22 -7.710 -8.176 -1.966
460 HD21 ASN 22 HD21 ASN 22 -5.624 -6.480 -4.199
461 HD22 ASN 22 HD22 ASN 22 -5.051 -7.885 -5.022
462 H GLU 23 H GLU 23 -7.336 -4.635 -0.678
463 HA GLU 23 HA GLU 23 -9.763 -5.342 0.614
464 HB2 GLU 23 HB3 GLU 23 -7.802 -3.098 1.066
465 HB3 GLU 23 HB2 GLU 23 -9.260 -3.323 2.058
466 HG2 GLU 23 HG3 GLU 23 -8.466 -5.553 2.685
467 HG3 GLU 23 HG2 GLU 23 -7.009 -5.301 1.725
468 H VAL 24 H VAL 24 -8.759 -2.594 -1.376
469 HA VAL 24 HA VAL 24 -11.138 -1.095 -1.089
470 HB VAL 24 HB VAL 24 -9.482 -1.044 -3.616
471 HG11 VAL 24 HG11 VAL 24 -10.939 1.164 -2.146
472 HG12 VAL 24 HG12 VAL 24 -11.578 0.272 -3.530
473 HG13 VAL 24 HG13 VAL 24 -10.145 1.281 -3.718
474 HG21 VAL 24 HG21 VAL 24 -8.003 0.598 -2.612
475 HG22 VAL 24 HG22 VAL 24 -7.907 -0.923 -1.730
476 HG23 VAL 24 HG23 VAL 24 -8.828 0.426 -1.066
477 H ALA 25 H ALA 25 -10.210 -3.781 -3.104
478 HA ALA 25 HA ALA 25 -12.421 -3.581 -4.909
479 HB1 ALA 25 HB1 ALA 25 -10.709 -5.998 -4.391
480 HB2 ALA 25 HB2 ALA 25 -10.256 -4.676 -5.465
481 HB3 ALA 25 HB3 ALA 25 -11.679 -5.656 -5.822
482 H ARG 26 H ARG 26 -11.947 -5.038 -1.785
483 HA ARG 26 HA ARG 26 -14.019 -6.960 -1.853
484 HB2 ARG 26 HB3 ARG 26 -13.293 -5.344 0.593
485 HB3 ARG 26 HB2 ARG 26 -14.000 -6.947 0.543
486 HG2 ARG 26 HG3 ARG 26 -11.832 -7.726 -0.494
487 HG3 ARG 26 HG2 ARG 26 -11.188 -6.130 -0.070
488 HD2 ARG 26 HD2 ARG 26 -11.750 -6.513 2.270
489 HD3 ARG 26 HD1 ARG 26 -12.412 -8.094 1.865
490 HE ARG 26 HE ARG 26 -9.757 -8.016 0.983
491 HH11 ARG 26 HH11 ARG 26 -11.544 -7.935 3.986
492 HH12 ARG 26 HH12 ARG 26 -10.290 -8.696 4.906
493 HH21 ARG 26 HH21 ARG 26 -8.091 -9.006 2.200
494 HH22 ARG 26 HH22 ARG 26 -8.323 -9.305 3.892
495 H LEU 27 H LEU 27 -13.921 -3.625 -0.729
496 HA LEU 27 HA LEU 27 -16.652 -3.520 -0.021
497 HB2 LEU 27 HB3 LEU 27 -14.560 -1.411 -0.440
498 HB3 LEU 27 HB2 LEU 27 -16.220 -0.993 -0.079
499 HG LEU 27 HG LEU 27 -16.075 -2.239 2.044
500 HD11 LEU 27 HD11 LEU 27 -13.174 -2.601 1.316
501 HD12 LEU 27 HD12 LEU 27 -14.381 -3.876 1.479
502 HD13 LEU 27 HD13 LEU 27 -13.886 -2.944 2.892
503 HD21 LEU 27 HD21 LEU 27 -15.637 0.139 2.009
504 HD22 LEU 27 HD22 LEU 27 -13.937 -0.162 1.648
505 HD23 LEU 27 HD23 LEU 27 -14.613 -0.663 3.198
506 H LYS 28 H LYS 28 -14.989 -2.927 -3.049
507 HA LYS 28 HA LYS 28 -16.917 -1.529 -4.464
508 HB2 LYS 28 HB3 LYS 28 -15.110 -3.776 -5.363
509 HB3 LYS 28 HB2 LYS 28 -16.116 -2.858 -6.471
510 HG2 LYS 28 HG3 LYS 28 -14.002 -1.657 -4.699
511 HG3 LYS 28 HG2 LYS 28 -13.763 -2.106 -6.387
512 HD2 LYS 28 HD3 LYS 28 -15.800 -0.109 -5.397
513 HD3 LYS 28 HD2 LYS 28 -14.229 0.303 -6.086
514 HE2 LYS 28 HE3 LYS 28 -14.881 -0.820 -8.179
515 HE3 LYS 28 HE2 LYS 28 -16.463 -1.163 -7.484
516 HZ1 LYS 28 HZ1 LYS 28 -15.337 1.542 -7.953
517 HZ2 LYS 28 HZ2 LYS 28 -16.854 1.211 -7.287
518 HZ3 LYS 28 HZ3 LYS 28 -16.527 0.791 -8.891
519 H LYS 29 H LYS 29 -16.739 -4.982 -3.771
520 HA LYS 29 HA LYS 29 -19.077 -5.698 -5.208
521 HB2 LYS 29 HB3 LYS 29 -17.601 -7.094 -2.968
522 HB3 LYS 29 HB2 LYS 29 -18.845 -7.826 -3.968
523 HG2 LYS 29 HG3 LYS 29 -17.497 -7.731 -5.900
524 HG3 LYS 29 HG2 LYS 29 -16.331 -6.666 -5.116
525 HD2 LYS 29 HD3 LYS 29 -15.411 -8.888 -5.246
526 HD3 LYS 29 HD2 LYS 29 -15.755 -8.502 -3.562
527 HE2 LYS 29 HE3 LYS 29 -17.732 -10.002 -5.239
528 HE3 LYS 29 HE2 LYS 29 -16.385 -10.836 -4.471
529 HZ1 LYS 29 HZ1 LYS 29 -18.335 -10.937 -3.090
530 HZ2 LYS 29 HZ2 LYS 29 -18.485 -9.257 -3.088
531 HZ3 LYS 29 HZ3 LYS 29 -17.163 -9.986 -2.328
532 H LEU 30 H LEU 30 -18.422 -4.631 -1.953
533 HA LEU 30 HA LEU 30 -20.961 -5.314 -0.857
534 HB2 LEU 30 HB3 LEU 30 -18.871 -3.343 0.000
535 HB3 LEU 30 HB2 LEU 30 -20.279 -3.747 0.964
536 HG LEU 30 HG LEU 30 -18.051 -5.635 0.183
537 HD11 LEU 30 HD11 LEU 30 -17.393 -4.021 1.883
538 HD12 LEU 30 HD12 LEU 30 -17.540 -5.638 2.571
539 HD13 LEU 30 HD13 LEU 30 -18.808 -4.443 2.847
540 HD21 LEU 30 HD21 LEU 30 -19.171 -7.231 1.677
541 HD22 LEU 30 HD22 LEU 30 -20.174 -6.810 0.292
542 HD23 LEU 30 HD23 LEU 30 -20.508 -6.099 1.870
543 H VAL 31 H VAL 31 -19.668 -2.501 -2.505
544 HA VAL 31 HA VAL 31 -21.944 -0.842 -1.885
545 HB VAL 31 HB VAL 31 -19.800 -0.361 -3.972
546 HG11 VAL 31 HG11 VAL 31 -21.711 1.546 -2.628
547 HG12 VAL 31 HG12 VAL 31 -21.801 0.994 -4.301
548 HG13 VAL 31 HG13 VAL 31 -20.443 1.986 -3.772
549 HG21 VAL 31 HG21 VAL 31 -19.921 0.596 -1.117
550 HG22 VAL 31 HG22 VAL 31 -18.696 1.031 -2.312
551 HG23 VAL 31 HG23 VAL 31 -18.824 -0.635 -1.746
552 H GLY 32 H GLY 32 -21.009 -3.058 -4.388
553 HA2 GLY 32 HA3 GLY 32 -23.531 -3.440 -5.409
554 HA3 GLY 32 HA2 GLY 32 -22.853 -2.121 -6.352
555 H GLU 33 H GLU 33 -21.778 -5.298 -5.115
556 HA GLU 33 HA GLU 33 -20.090 -6.076 -7.093
557 HB2 GLU 33 HB3 GLU 33 -21.245 -8.434 -6.793
558 HB3 GLU 33 HB2 GLU 33 -20.267 -7.718 -5.528
559 HG2 GLU 33 HG3 GLU 33 -22.199 -8.635 -4.513
560 HG3 GLU 33 HG2 GLU 33 -22.363 -6.886 -4.470
Start of MODEL 20
1 H1 GLY 1 H1 GLY 1 24.739 6.647 -7.150
2 H2 GLY 1 H2 GLY 1 25.795 7.316 -6.014
3 H3 GLY 1 H3 GLY 1 24.151 7.706 -5.972
4 HA2 GLY 1 HA2 GLY 1 25.310 5.026 -5.461
5 HA3 GLY 1 HA3 GLY 1 24.699 6.128 -4.235
6 H SER 2 H SER 2 23.790 3.440 -4.803
7 HA SER 2 HA SER 2 21.319 3.643 -6.261
8 HB2 SER 2 HB3 SER 2 22.354 1.418 -4.487
9 HB3 SER 2 HB2 SER 2 20.992 1.302 -5.602
10 HG SER 2 HG SER 2 23.509 2.133 -6.554
11 H MET 3 H MET 3 22.327 3.831 -2.931
12 HA MET 3 HA MET 3 19.923 3.265 -1.637
13 HB2 MET 3 HB3 MET 3 22.319 4.902 -0.893
14 HB3 MET 3 HB2 MET 3 20.909 4.874 0.157
15 HG2 MET 3 HG3 MET 3 22.488 2.468 -0.723
16 HG3 MET 3 HG2 MET 3 22.600 3.260 0.848
17 HE1 MET 3 HE1 MET 3 22.106 1.027 2.181
18 HE2 MET 3 HE2 MET 3 22.087 0.159 0.647
19 HE3 MET 3 HE3 MET 3 20.771 -0.059 1.802
20 H LYS 4 H LYS 4 21.075 6.253 -3.074
21 HA LYS 4 HA LYS 4 19.293 8.087 -2.049
22 HB2 LYS 4 HB3 LYS 4 21.181 8.638 -3.538
23 HB3 LYS 4 HB2 LYS 4 20.317 7.925 -4.891
24 HG2 LYS 4 HG3 LYS 4 20.127 10.311 -4.991
25 HG3 LYS 4 HG2 LYS 4 18.549 9.622 -4.611
26 HD2 LYS 4 HD3 LYS 4 18.844 10.169 -2.268
27 HD3 LYS 4 HD2 LYS 4 20.470 10.775 -2.593
28 HE2 LYS 4 HE3 LYS 4 18.915 12.619 -2.397
29 HE3 LYS 4 HE2 LYS 4 19.515 12.506 -4.050
30 HZ1 LYS 4 HZ1 LYS 4 16.879 11.555 -3.069
31 HZ2 LYS 4 HZ2 LYS 4 17.449 11.353 -4.645
32 HZ3 LYS 4 HZ3 LYS 4 17.153 12.903 -4.048
33 H GLN 5 H GLN 5 18.860 6.228 -5.066
34 HA GLN 5 HA GLN 5 16.163 7.125 -5.386
35 HB2 GLN 5 HB3 GLN 5 17.623 4.874 -6.783
36 HB3 GLN 5 HB2 GLN 5 16.064 5.522 -7.261
37 HG2 GLN 5 HG3 GLN 5 17.592 6.503 -8.717
38 HG3 GLN 5 HG2 GLN 5 17.243 7.754 -7.529
39 HE21 GLN 5 HE21 GLN 5 19.313 4.991 -6.951
40 HE22 GLN 5 HE22 GLN 5 20.789 5.891 -6.815
41 H LEU 6 H LEU 6 17.712 4.330 -3.985
42 HA LEU 6 HA LEU 6 15.443 2.641 -3.971
43 HB2 LEU 6 HB3 LEU 6 17.822 1.912 -3.725
44 HB3 LEU 6 HB2 LEU 6 17.802 2.559 -2.097
45 HG LEU 6 HG LEU 6 16.130 0.936 -1.422
46 HD11 LEU 6 HD11 LEU 6 14.871 0.763 -3.494
47 HD12 LEU 6 HD12 LEU 6 15.408 -0.833 -2.970
48 HD13 LEU 6 HD13 LEU 6 16.246 -0.008 -4.284
49 HD21 LEU 6 HD21 LEU 6 18.371 -0.363 -2.963
50 HD22 LEU 6 HD22 LEU 6 17.457 -1.085 -1.638
51 HD23 LEU 6 HD23 LEU 6 18.498 0.307 -1.336
52 H GLU 7 H GLU 7 16.723 4.965 -1.621
53 HA GLU 7 HA GLU 7 14.811 4.388 0.399
54 HB2 GLU 7 HB3 GLU 7 16.758 6.559 -0.118
55 HB3 GLU 7 HB2 GLU 7 15.388 6.976 0.901
56 HG2 GLU 7 HG3 GLU 7 17.175 6.304 2.309
57 HG3 GLU 7 HG2 GLU 7 15.951 5.040 2.351
58 H ASP 8 H ASP 8 14.830 6.514 -2.395
59 HA ASP 8 HA ASP 8 12.362 7.799 -1.777
60 HB2 ASP 8 HB3 ASP 8 13.973 7.537 -4.304
61 HB3 ASP 8 HB2 ASP 8 12.378 8.283 -4.315
62 H LYS 9 H LYS 9 13.265 4.849 -3.402
63 HA LYS 9 HA LYS 9 10.850 4.277 -4.703
64 HB2 LYS 9 HB3 LYS 9 12.966 3.066 -5.106
65 HB3 LYS 9 HB2 LYS 9 12.835 2.327 -3.516
66 HG2 LYS 9 HG3 LYS 9 10.791 1.197 -4.187
67 HG3 LYS 9 HG2 LYS 9 10.873 1.969 -5.772
68 HD2 LYS 9 HD3 LYS 9 13.025 0.844 -6.183
69 HD3 LYS 9 HD2 LYS 9 12.889 0.040 -4.618
70 HE2 LYS 9 HE3 LYS 9 10.836 -1.054 -5.347
71 HE3 LYS 9 HE2 LYS 9 10.937 -0.225 -6.899
72 HZ1 LYS 9 HZ1 LYS 9 11.758 -2.492 -7.033
73 HZ2 LYS 9 HZ2 LYS 9 12.926 -2.161 -5.855
74 HZ3 LYS 9 HZ3 LYS 9 12.996 -1.384 -7.354
75 H VAL 10 H VAL 10 11.981 3.373 -1.456
76 HA VAL 10 HA VAL 10 9.677 1.959 -0.673
77 HB VAL 10 HB VAL 10 11.584 3.529 1.079
78 HG11 VAL 10 HG11 VAL 10 10.859 2.020 2.865
79 HG12 VAL 10 HG12 VAL 10 9.694 1.281 1.767
80 HG13 VAL 10 HG13 VAL 10 9.514 2.971 2.237
81 HG21 VAL 10 HG21 VAL 10 12.716 1.870 -0.332
82 HG22 VAL 10 HG22 VAL 10 11.642 0.620 0.294
83 HG23 VAL 10 HG23 VAL 10 12.771 1.434 1.375
84 H GLU 11 H GLU 11 10.539 5.380 -0.432
85 HA GLU 11 HA GLU 11 8.243 6.223 0.971
86 HB2 GLU 11 HB3 GLU 11 10.017 7.750 -0.938
87 HB3 GLU 11 HB2 GLU 11 8.811 8.482 0.111
88 HG2 GLU 11 HG3 GLU 11 10.007 7.701 2.069
89 HG3 GLU 11 HG2 GLU 11 11.193 6.898 1.043
90 H GLU 12 H GLU 12 8.934 5.810 -2.462
91 HA GLU 12 HA GLU 12 6.563 6.801 -3.528
92 HB2 GLU 12 HB3 GLU 12 8.306 4.506 -4.412
93 HB3 GLU 12 HB2 GLU 12 6.918 5.053 -5.340
94 HG2 GLU 12 HG3 GLU 12 9.265 6.778 -4.595
95 HG3 GLU 12 HG2 GLU 12 9.064 5.958 -6.143
96 H LEU 13 H LEU 13 7.220 3.476 -2.355
97 HA LEU 13 HA LEU 13 4.570 2.623 -2.802
98 HB2 LEU 13 HB3 LEU 13 6.778 1.474 -1.134
99 HB3 LEU 13 HB2 LEU 13 5.152 0.826 -1.040
100 HG LEU 13 HG LEU 13 5.258 0.630 -3.581
101 HD11 LEU 13 HD11 LEU 13 8.209 0.850 -3.000
102 HD12 LEU 13 HD12 LEU 13 7.244 1.994 -3.932
103 HD13 LEU 13 HD13 LEU 13 7.488 0.353 -4.530
104 HD21 LEU 13 HD21 LEU 13 5.252 -1.290 -2.131
105 HD22 LEU 13 HD22 LEU 13 6.975 -1.091 -1.798
106 HD23 LEU 13 HD23 LEU 13 6.435 -1.538 -3.416
107 H LEU 14 H LEU 14 5.936 4.438 -0.161
108 HA LEU 14 HA LEU 14 3.860 4.074 1.686
109 HB2 LEU 14 HB3 LEU 14 5.580 6.460 1.079
110 HB3 LEU 14 HB2 LEU 14 4.371 6.492 2.350
111 HG LEU 14 HG LEU 14 7.041 5.197 2.309
112 HD11 LEU 14 HD11 LEU 14 6.875 5.763 4.743
113 HD12 LEU 14 HD12 LEU 14 5.301 6.488 4.405
114 HD13 LEU 14 HD13 LEU 14 6.762 7.150 3.663
115 HD21 LEU 14 HD21 LEU 14 5.678 3.208 2.513
116 HD22 LEU 14 HD22 LEU 14 4.720 3.962 3.791
117 HD23 LEU 14 HD23 LEU 14 6.419 3.591 4.063
118 H SER 15 H SER 15 4.127 6.269 -1.097
119 HA SER 15 HA SER 15 1.626 7.499 -0.628
120 HB2 SER 15 HB3 SER 15 1.773 8.397 -2.870
121 HB3 SER 15 HB2 SER 15 3.366 8.477 -2.124
122 HG SER 15 HG SER 15 3.798 6.451 -3.262
123 H LYS 16 H LYS 16 2.594 4.615 -2.491
124 HA LYS 16 HA LYS 16 0.068 3.935 -3.474
125 HB2 LYS 16 HB3 LYS 16 2.471 2.347 -2.668
126 HB3 LYS 16 HB2 LYS 16 0.977 1.500 -3.038
127 HG2 LYS 16 HG3 LYS 16 0.955 2.512 -5.262
128 HG3 LYS 16 HG2 LYS 16 2.463 3.353 -4.889
129 HD2 LYS 16 HD3 LYS 16 3.688 1.354 -4.809
130 HD3 LYS 16 HD2 LYS 16 2.234 0.367 -4.670
131 HE2 LYS 16 HE3 LYS 16 3.211 0.161 -6.886
132 HE3 LYS 16 HE2 LYS 16 1.629 0.931 -6.970
133 HZ1 LYS 16 HZ1 LYS 16 2.773 3.089 -7.102
134 HZ2 LYS 16 HZ2 LYS 16 3.158 2.073 -8.395
135 HZ3 LYS 16 HZ3 LYS 16 4.261 2.287 -7.135
136 H ASN 17 H ASN 17 1.559 3.102 -0.342
137 HA ASN 17 HA ASN 17 -0.563 1.654 0.740
138 HB2 ASN 17 HB3 ASN 17 1.449 3.412 2.162
139 HB3 ASN 17 HB2 ASN 17 0.379 2.270 2.962
140 HD21 ASN 17 HD21 ASN 17 0.648 0.304 0.800
141 HD22 ASN 17 HD22 ASN 17 2.212 -0.395 0.997
142 H TYR 18 H TYR 18 0.216 5.102 1.228
143 HA TYR 18 HA TYR 18 -2.052 5.626 2.803
144 HB2 TYR 18 HB3 TYR 18 -0.324 7.512 1.201
145 HB3 TYR 18 HB2 TYR 18 -1.541 8.024 2.365
146 HD1 TYR 18 HD1 TYR 18 -1.169 6.168 4.575
147 HD2 TYR 18 HD2 TYR 18 1.743 8.065 2.121
148 HE1 TYR 18 HE1 TYR 18 0.475 5.972 6.389
149 HE2 TYR 18 HE2 TYR 18 3.398 7.873 3.930
150 HH TYR 18 HH TYR 18 3.390 7.660 6.410
151 H HIS 19 H HIS 19 -1.572 5.953 -0.709
152 HA HIS 19 HA HIS 19 -4.040 7.238 -1.211
153 HB2 HIS 19 HB3 HIS 19 -2.255 5.549 -2.952
154 HB3 HIS 19 HB2 HIS 19 -3.785 6.181 -3.543
155 HD1 HIS 19 HD1 HIS 19 -0.801 6.959 -4.500
156 HD2 HIS 19 HD2 HIS 19 -3.362 9.213 -2.123
157 HE1 HIS 19 HE1 HIS 19 -0.049 9.344 -4.767
158 HE2 HIS 19 HE2 HIS 19 -1.660 10.696 -3.382
159 H LEU 20 H LEU 20 -3.125 3.814 -1.216
160 HA LEU 20 HA LEU 20 -5.717 2.850 -1.833
161 HB2 LEU 20 HB3 LEU 20 -3.155 1.710 -0.924
162 HB3 LEU 20 HB2 LEU 20 -4.580 0.795 -0.492
163 HG LEU 20 HG LEU 20 -3.499 0.030 -2.596
164 HD11 LEU 20 HD11 LEU 20 -6.278 1.140 -2.926
165 HD12 LEU 20 HD12 LEU 20 -5.860 -0.403 -2.181
166 HD13 LEU 20 HD13 LEU 20 -5.548 -0.138 -3.897
167 HD21 LEU 20 HD21 LEU 20 -2.747 2.196 -3.433
168 HD22 LEU 20 HD22 LEU 20 -4.425 2.690 -3.667
169 HD23 LEU 20 HD23 LEU 20 -3.758 1.364 -4.618
170 H GLU 21 H GLU 21 -4.053 3.582 1.178
171 HA GLU 21 HA GLU 21 -5.906 2.479 2.974
172 HB2 GLU 21 HB3 GLU 21 -3.638 3.348 3.560
173 HB3 GLU 21 HB2 GLU 21 -4.250 4.983 3.356
174 HG2 GLU 21 HG3 GLU 21 -5.848 4.603 5.169
175 HG3 GLU 21 HG2 GLU 21 -5.208 2.973 5.380
176 H ASN 22 H ASN 22 -5.733 5.686 1.487
177 HA ASN 22 HA ASN 22 -8.100 6.678 2.709
178 HB2 ASN 22 HB3 ASN 22 -6.496 7.573 0.323
179 HB3 ASN 22 HB2 ASN 22 -7.968 8.399 0.822
180 HD21 ASN 22 HD21 ASN 22 -6.840 10.288 1.264
181 HD22 ASN 22 HD22 ASN 22 -5.833 10.452 2.659
182 H GLU 23 H GLU 23 -7.454 4.662 0.025
183 HA GLU 23 HA GLU 23 -9.845 5.190 -1.452
184 HB2 GLU 23 HB3 GLU 23 -7.704 4.347 -2.443
185 HB3 GLU 23 HB2 GLU 23 -7.997 2.798 -1.628
186 HG2 GLU 23 HG3 GLU 23 -8.660 2.601 -3.907
187 HG3 GLU 23 HG2 GLU 23 -10.109 2.597 -2.906
188 H VAL 24 H VAL 24 -8.812 2.685 0.854
189 HA VAL 24 HA VAL 24 -11.236 1.195 0.669
190 HB VAL 24 HB VAL 24 -9.305 1.254 3.005
191 HG11 VAL 24 HG11 VAL 24 -10.211 -0.921 3.560
192 HG12 VAL 24 HG12 VAL 24 -11.267 -0.883 2.148
193 HG13 VAL 24 HG13 VAL 24 -11.523 0.253 3.475
194 HG21 VAL 24 HG21 VAL 24 -8.261 -0.691 1.990
195 HG22 VAL 24 HG22 VAL 24 -8.159 0.706 0.919
196 HG23 VAL 24 HG23 VAL 24 -9.341 -0.565 0.604
197 H ALA 25 H ALA 25 -10.133 3.861 2.676
198 HA ALA 25 HA ALA 25 -12.144 3.735 4.635
199 HB1 ALA 25 HB1 ALA 25 -10.749 6.233 3.720
200 HB2 ALA 25 HB2 ALA 25 -10.030 5.042 4.806
201 HB3 ALA 25 HB3 ALA 25 -11.478 5.922 5.291
202 H ARG 26 H ARG 26 -12.047 5.460 1.532
203 HA ARG 26 HA ARG 26 -14.464 6.844 1.953
204 HB2 ARG 26 HB3 ARG 26 -14.440 7.064 -0.579
205 HB3 ARG 26 HB2 ARG 26 -13.108 7.778 0.304
206 HG2 ARG 26 HG3 ARG 26 -11.733 5.820 -0.267
207 HG3 ARG 26 HG2 ARG 26 -13.071 5.175 -1.225
208 HD2 ARG 26 HD2 ARG 26 -11.636 7.789 -1.676
209 HD3 ARG 26 HD1 ARG 26 -11.473 6.327 -2.645
210 HE ARG 26 HE ARG 26 -14.179 7.231 -2.513
211 HH11 ARG 26 HH11 ARG 26 -11.110 7.813 -4.083
212 HH12 ARG 26 HH12 ARG 26 -11.822 8.470 -5.521
213 HH21 ARG 26 HH21 ARG 26 -15.124 8.128 -4.390
214 HH22 ARG 26 HH22 ARG 26 -14.104 8.645 -5.699
215 H LEU 27 H LEU 27 -13.757 3.778 0.284
216 HA LEU 27 HA LEU 27 -16.436 3.286 -0.460
217 HB2 LEU 27 HB3 LEU 27 -14.060 1.488 -0.123
218 HB3 LEU 27 HB2 LEU 27 -15.651 0.820 -0.378
219 HG LEU 27 HG LEU 27 -15.852 1.968 -2.504
220 HD11 LEU 27 HD11 LEU 27 -14.514 3.940 -2.072
221 HD12 LEU 27 HD12 LEU 27 -13.928 3.103 -3.510
222 HD13 LEU 27 HD13 LEU 27 -13.056 2.952 -1.984
223 HD21 LEU 27 HD21 LEU 27 -14.105 0.731 -3.731
224 HD22 LEU 27 HD22 LEU 27 -14.976 -0.244 -2.548
225 HD23 LEU 27 HD23 LEU 27 -13.351 0.341 -2.184
226 H LYS 28 H LYS 28 -14.627 2.594 2.476
227 HA LYS 28 HA LYS 28 -16.427 0.938 3.775
228 HB2 LYS 28 HB3 LYS 28 -14.149 1.604 4.592
229 HB3 LYS 28 HB2 LYS 28 -14.825 3.156 5.064
230 HG2 LYS 28 HG3 LYS 28 -14.664 1.723 6.985
231 HG3 LYS 28 HG2 LYS 28 -16.364 1.992 6.596
232 HD2 LYS 28 HD3 LYS 28 -16.446 -0.180 5.466
233 HD3 LYS 28 HD2 LYS 28 -14.746 -0.448 5.854
234 HE2 LYS 28 HE3 LYS 28 -15.279 -0.368 8.239
235 HE3 LYS 28 HE2 LYS 28 -16.976 -0.089 7.853
236 HZ1 LYS 28 HZ1 LYS 28 -15.406 -2.515 7.181
237 HZ2 LYS 28 HZ2 LYS 28 -17.011 -2.247 6.733
238 HZ3 LYS 28 HZ3 LYS 28 -16.604 -2.396 8.366
239 H LYS 29 H LYS 29 -16.441 4.461 3.457
240 HA LYS 29 HA LYS 29 -18.788 4.783 5.067
241 HB2 LYS 29 HB3 LYS 29 -17.406 6.702 3.190
242 HB3 LYS 29 HB2 LYS 29 -18.685 7.115 4.316
243 HG2 LYS 29 HG3 LYS 29 -15.964 6.074 5.063
244 HG3 LYS 29 HG2 LYS 29 -16.496 7.750 5.177
245 HD2 LYS 29 HD3 LYS 29 -18.213 7.095 6.793
246 HD3 LYS 29 HD2 LYS 29 -17.695 5.416 6.665
247 HE2 LYS 29 HE3 LYS 29 -16.766 6.443 8.658
248 HE3 LYS 29 HE2 LYS 29 -15.486 6.035 7.518
249 HZ1 LYS 29 HZ1 LYS 29 -15.460 8.353 6.802
250 HZ2 LYS 29 HZ2 LYS 29 -15.132 8.215 8.454
251 HZ3 LYS 29 HZ3 LYS 29 -16.655 8.731 7.939
252 H LEU 30 H LEU 30 -18.102 4.225 1.709
253 HA LEU 30 HA LEU 30 -20.658 5.039 0.729
254 HB2 LEU 30 HB3 LEU 30 -18.628 3.149 -0.463
255 HB3 LEU 30 HB2 LEU 30 -20.045 3.752 -1.297
256 HG LEU 30 HG LEU 30 -17.716 5.416 -0.336
257 HD11 LEU 30 HD11 LEU 30 -18.603 4.657 -3.116
258 HD12 LEU 30 HD12 LEU 30 -17.184 4.034 -2.275
259 HD13 LEU 30 HD13 LEU 30 -17.273 5.740 -2.713
260 HD21 LEU 30 HD21 LEU 30 -19.785 6.675 -0.195
261 HD22 LEU 30 HD22 LEU 30 -20.206 6.210 -1.843
262 HD23 LEU 30 HD23 LEU 30 -18.812 7.249 -1.548
263 H VAL 31 H VAL 31 -19.281 2.055 1.947
264 HA VAL 31 HA VAL 31 -21.591 0.458 1.389
265 HB VAL 31 HB VAL 31 -19.331 -0.051 3.351
266 HG11 VAL 31 HG11 VAL 31 -21.296 -1.390 3.877
267 HG12 VAL 31 HG12 VAL 31 -20.013 -2.402 3.213
268 HG13 VAL 31 HG13 VAL 31 -21.385 -1.943 2.204
269 HG21 VAL 31 HG21 VAL 31 -18.415 -1.499 1.605
270 HG22 VAL 31 HG22 VAL 31 -18.520 0.180 1.071
271 HG23 VAL 31 HG23 VAL 31 -19.708 -1.000 0.515
272 H GLY 32 H GLY 32 -20.590 2.586 3.938
273 HA2 GLY 32 HA3 GLY 32 -22.546 1.575 5.829
274 HA3 GLY 32 HA2 GLY 32 -21.431 2.908 6.090
275 H GLU 33 H GLU 33 -22.024 4.515 3.922
276 HA GLU 33 HA GLU 33 -23.410 6.157 3.221
277 HB2 GLU 33 HB3 GLU 33 -25.589 4.186 3.935
278 HB3 GLU 33 HB2 GLU 33 -25.851 5.693 3.068
279 HG2 GLU 33 HG3 GLU 33 -24.430 4.907 1.252
280 HG3 GLU 33 HG2 GLU 33 -24.136 3.405 2.125
281 H1 GLY 1 H1 GLY 1 24.748 -6.820 6.457
282 H2 GLY 1 H2 GLY 1 25.796 -7.499 5.317
283 H3 GLY 1 H3 GLY 1 24.151 -7.890 5.292
284 HA2 GLY 1 HA2 GLY 1 25.302 -5.215 4.751
285 HA3 GLY 1 HA3 GLY 1 24.687 -6.327 3.536
286 H SER 2 H SER 2 23.788 -3.626 4.106
287 HA SER 2 HA SER 2 21.321 -3.817 5.571
288 HB2 SER 2 HB3 SER 2 22.355 -1.603 3.784
289 HB3 SER 2 HB2 SER 2 20.998 -1.478 4.903
290 HG SER 2 HG SER 2 23.526 -2.297 5.833
291 H MET 3 H MET 3 22.315 -4.021 2.239
292 HA MET 3 HA MET 3 19.907 -3.458 0.948
293 HB2 MET 3 HB3 MET 3 22.298 -5.101 0.207
294 HB3 MET 3 HB2 MET 3 20.886 -5.079 -0.840
295 HG2 MET 3 HG3 MET 3 22.470 -2.667 0.018
296 HG3 MET 3 HG2 MET 3 22.582 -3.472 -1.546
297 HE1 MET 3 HE1 MET 3 22.087 -1.247 -2.894
298 HE2 MET 3 HE2 MET 3 22.071 -0.373 -1.362
299 HE3 MET 3 HE3 MET 3 20.754 -0.157 -2.516
300 H LYS 4 H LYS 4 21.058 -6.437 2.403
301 HA LYS 4 HA LYS 4 19.272 -8.276 1.388
302 HB2 LYS 4 HB3 LYS 4 21.166 -8.824 2.872
303 HB3 LYS 4 HB2 LYS 4 20.307 -8.104 4.226
304 HG2 LYS 4 HG3 LYS 4 20.114 -10.493 4.335
305 HG3 LYS 4 HG2 LYS 4 18.534 -9.801 3.959
306 HD2 LYS 4 HD3 LYS 4 18.821 -10.353 1.617
307 HD3 LYS 4 HD2 LYS 4 20.443 -10.966 1.935
308 HE2 LYS 4 HE3 LYS 4 18.885 -12.808 1.751
309 HE3 LYS 4 HE2 LYS 4 19.484 -12.687 3.404
310 HZ1 LYS 4 HZ1 LYS 4 16.850 -11.736 2.417
311 HZ2 LYS 4 HZ2 LYS 4 17.427 -11.525 3.990
312 HZ3 LYS 4 HZ3 LYS 4 17.127 -13.081 3.405
313 H GLN 5 H GLN 5 18.854 -6.396 4.393
314 HA GLN 5 HA GLN 5 16.157 -7.295 4.730
315 HB2 GLN 5 HB3 GLN 5 17.624 -5.041 6.111
316 HB3 GLN 5 HB2 GLN 5 16.066 -5.685 6.598
317 HG2 GLN 5 HG3 GLN 5 17.600 -6.661 8.055
318 HG3 GLN 5 HG2 GLN 5 17.248 -7.918 6.872
319 HE21 GLN 5 HE21 GLN 5 19.316 -5.152 6.269
320 HE22 GLN 5 HE22 GLN 5 20.790 -6.054 6.127
321 H LEU 6 H LEU 6 17.705 -4.505 3.313
322 HA LEU 6 HA LEU 6 15.440 -2.812 3.298
323 HB2 LEU 6 HB3 LEU 6 17.823 -2.095 3.037
324 HB3 LEU 6 HB2 LEU 6 17.792 -2.747 1.412
325 HG LEU 6 HG LEU 6 16.121 -1.117 0.740
326 HD11 LEU 6 HD11 LEU 6 14.876 -0.933 2.821
327 HD12 LEU 6 HD12 LEU 6 15.414 0.659 2.283
328 HD13 LEU 6 HD13 LEU 6 16.259 -0.161 3.597
329 HD21 LEU 6 HD21 LEU 6 18.376 0.177 2.262
330 HD22 LEU 6 HD22 LEU 6 17.457 0.898 0.940
331 HD23 LEU 6 HD23 LEU 6 18.491 -0.500 0.638
332 H GLU 7 H GLU 7 16.703 -5.154 0.959
333 HA GLU 7 HA GLU 7 14.786 -4.577 -1.056
334 HB2 GLU 7 HB3 GLU 7 16.733 -6.747 -0.543
335 HB3 GLU 7 HB2 GLU 7 15.358 -7.168 -1.552
336 HG2 GLU 7 HG3 GLU 7 17.144 -6.503 -2.971
337 HG3 GLU 7 HG2 GLU 7 15.915 -5.243 -3.015
338 H ASP 8 H ASP 8 14.809 -6.683 1.750
339 HA ASP 8 HA ASP 8 12.341 -7.975 1.139
340 HB2 ASP 8 HB3 ASP 8 13.962 -7.706 3.659
341 HB3 ASP 8 HB2 ASP 8 12.363 -8.441 3.683
342 H LYS 9 H LYS 9 13.255 -5.018 2.746
343 HA LYS 9 HA LYS 9 10.847 -4.434 4.056
344 HB2 LYS 9 HB3 LYS 9 12.968 -3.226 4.451
345 HB3 LYS 9 HB2 LYS 9 12.836 -2.493 2.858
346 HG2 LYS 9 HG3 LYS 9 10.793 -1.358 3.531
347 HG3 LYS 9 HG2 LYS 9 10.881 -2.121 5.118
348 HD2 LYS 9 HD3 LYS 9 13.038 -1.000 5.513
349 HD3 LYS 9 HD2 LYS 9 12.898 -0.208 3.943
350 HE2 LYS 9 HE3 LYS 9 10.852 0.901 4.676
351 HE3 LYS 9 HE2 LYS 9 10.954 0.084 6.232
352 HZ1 LYS 9 HZ1 LYS 9 11.787 2.346 6.354
353 HZ2 LYS 9 HZ2 LYS 9 12.943 2.013 5.167
354 HZ3 LYS 9 HZ3 LYS 9 13.027 1.240 6.667
355 H VAL 10 H VAL 10 11.972 -3.541 0.805
356 HA VAL 10 HA VAL 10 9.668 -2.132 0.020
357 HB VAL 10 HB VAL 10 11.560 -3.714 -1.732
358 HG11 VAL 10 HG11 VAL 10 10.828 -2.213 -3.524
359 HG12 VAL 10 HG12 VAL 10 9.671 -1.466 -2.422
360 HG13 VAL 10 HG13 VAL 10 9.482 -3.158 -2.883
361 HG21 VAL 10 HG21 VAL 10 12.701 -2.053 -0.336
362 HG22 VAL 10 HG22 VAL 10 11.626 -0.803 -0.964
363 HG23 VAL 10 HG23 VAL 10 12.750 -1.624 -2.045
364 H GLU 11 H GLU 11 10.519 -5.556 -0.203
365 HA GLU 11 HA GLU 11 8.210 -6.398 -1.590
366 HB2 GLU 11 HB3 GLU 11 9.989 -7.922 0.320
367 HB3 GLU 11 HB2 GLU 11 8.773 -8.653 -0.720
368 HG2 GLU 11 HG3 GLU 11 9.962 -7.888 -2.689
369 HG3 GLU 11 HG2 GLU 11 11.158 -7.086 -1.670
370 H GLU 12 H GLU 12 8.922 -5.967 1.837
371 HA GLU 12 HA GLU 12 6.554 -6.946 2.919
372 HB2 GLU 12 HB3 GLU 12 8.301 -4.646 3.782
373 HB3 GLU 12 HB2 GLU 12 6.918 -5.191 4.719
374 HG2 GLU 12 HG3 GLU 12 9.264 -6.914 3.970
375 HG3 GLU 12 HG2 GLU 12 9.064 -6.094 5.517
376 H LEU 13 H LEU 13 7.210 -3.633 1.717
377 HA LEU 13 HA LEU 13 4.564 -2.773 2.180
378 HB2 LEU 13 HB3 LEU 13 6.766 -1.635 0.495
379 HB3 LEU 13 HB2 LEU 13 5.140 -0.985 0.405
380 HG LEU 13 HG LEU 13 5.257 -0.776 2.944
381 HD11 LEU 13 HD11 LEU 13 8.206 -1.009 2.354
382 HD12 LEU 13 HD12 LEU 13 7.244 -2.149 3.293
383 HD13 LEU 13 HD13 LEU 13 7.491 -0.508 3.886
384 HD21 LEU 13 HD21 LEU 13 5.255 1.139 1.488
385 HD22 LEU 13 HD22 LEU 13 6.974 0.931 1.146
386 HD23 LEU 13 HD23 LEU 13 6.445 1.387 2.767
387 H LEU 14 H LEU 14 5.913 -4.601 -0.460
388 HA LEU 14 HA LEU 14 3.829 -4.242 -2.299
389 HB2 LEU 14 HB3 LEU 14 5.542 -6.633 -1.685
390 HB3 LEU 14 HB2 LEU 14 4.331 -6.664 -2.954
391 HG LEU 14 HG LEU 14 7.007 -5.380 -2.926
392 HD11 LEU 14 HD11 LEU 14 6.827 -5.953 -5.358
393 HD12 LEU 14 HD12 LEU 14 5.254 -6.674 -5.010
394 HD13 LEU 14 HD13 LEU 14 6.716 -7.336 -4.270
395 HD21 LEU 14 HD21 LEU 14 5.651 -3.386 -3.134
396 HD22 LEU 14 HD22 LEU 14 4.683 -4.143 -4.401
397 HD23 LEU 14 HD23 LEU 14 6.382 -3.781 -4.687
398 H SER 15 H SER 15 4.104 -6.423 0.489
399 HA SER 15 HA SER 15 1.600 -7.653 0.041
400 HB2 SER 15 HB3 SER 15 1.756 -8.533 2.286
401 HB3 SER 15 HB2 SER 15 3.350 -8.611 1.543
402 HG SER 15 HG SER 15 3.800 -6.596 2.668
403 H LYS 16 H LYS 16 2.583 -4.759 1.884
404 HA LYS 16 HA LYS 16 0.063 -4.068 2.874
405 HB2 LYS 16 HB3 LYS 16 2.465 -2.488 2.052
406 HB3 LYS 16 HB2 LYS 16 0.974 -1.640 2.425
407 HG2 LYS 16 HG3 LYS 16 0.961 -2.641 4.655
408 HG3 LYS 16 HG2 LYS 16 2.463 -3.489 4.279
409 HD2 LYS 16 HD3 LYS 16 3.695 -1.495 4.186
410 HD3 LYS 16 HD2 LYS 16 2.243 -0.503 4.048
411 HE2 LYS 16 HE3 LYS 16 3.228 -0.297 6.261
412 HE3 LYS 16 HE2 LYS 16 1.643 -1.061 6.349
413 HZ1 LYS 16 HZ1 LYS 16 2.781 -3.224 6.481
414 HZ2 LYS 16 HZ2 LYS 16 3.171 -2.206 7.773
415 HZ3 LYS 16 HZ3 LYS 16 4.271 -2.425 6.514
416 H ASN 17 H ASN 17 1.544 -3.256 -0.268
417 HA ASN 17 HA ASN 17 -0.581 -1.808 -1.345
418 HB2 ASN 17 HB3 ASN 17 1.420 -3.575 -2.770
419 HB3 ASN 17 HB2 ASN 17 0.348 -2.437 -3.571
420 HD21 ASN 17 HD21 ASN 17 0.639 -0.460 -1.415
421 HD22 ASN 17 HD22 ASN 17 2.205 0.233 -1.625
422 H TYR 18 H TYR 18 0.184 -5.262 -1.825
423 HA TYR 18 HA TYR 18 -2.093 -5.787 -3.382
424 HB2 TYR 18 HB3 TYR 18 -0.363 -7.672 -1.778
425 HB3 TYR 18 HB2 TYR 18 -1.589 -8.190 -2.931
426 HD1 TYR 18 HD1 TYR 18 -1.226 -6.341 -5.156
427 HD2 TYR 18 HD2 TYR 18 1.697 -8.232 -2.709
428 HE1 TYR 18 HE1 TYR 18 0.408 -6.156 -6.979
429 HE2 TYR 18 HE2 TYR 18 3.340 -8.052 -4.530
430 HH TYR 18 HH TYR 18 3.353 -7.824 -6.986
431 H HIS 19 H HIS 19 -1.597 -6.094 0.128
432 HA HIS 19 HA HIS 19 -4.067 -7.370 0.650
433 HB2 HIS 19 HB3 HIS 19 -2.266 -5.680 2.373
434 HB3 HIS 19 HB2 HIS 19 -3.797 -6.304 2.976
435 HD1 HIS 19 HD1 HIS 19 -0.813 -7.091 3.924
436 HD2 HIS 19 HD2 HIS 19 -3.394 -9.339 1.562
437 HE1 HIS 19 HE1 HIS 19 -0.075 -9.476 4.195
438 HE2 HIS 19 HE2 HIS 19 -1.664 -10.825 2.781
439 H LEU 20 H LEU 20 -3.142 -3.951 0.631
440 HA LEU 20 HA LEU 20 -5.727 -2.974 1.257
441 HB2 LEU 20 HB3 LEU 20 -3.164 -1.849 0.328
442 HB3 LEU 20 HB2 LEU 20 -4.589 -0.931 -0.100
443 HG LEU 20 HG LEU 20 -3.497 -0.159 1.995
444 HD11 LEU 20 HD11 LEU 20 -6.278 -1.263 2.344
445 HD12 LEU 20 HD12 LEU 20 -5.862 0.276 1.589
446 HD13 LEU 20 HD13 LEU 20 -5.541 0.019 3.304
447 HD21 LEU 20 HD21 LEU 20 -2.747 -2.325 2.837
448 HD22 LEU 20 HD22 LEU 20 -4.424 -2.813 3.084
449 HD23 LEU 20 HD23 LEU 20 -3.745 -1.485 4.023
450 H GLU 21 H GLU 21 -4.081 -3.725 -1.759
451 HA GLU 21 HA GLU 21 -5.941 -2.630 -3.553
452 HB2 GLU 21 HB3 GLU 21 -3.674 -3.503 -4.143
453 HB3 GLU 21 HB2 GLU 21 -4.288 -5.135 -3.931
454 HG2 GLU 21 HG3 GLU 21 -5.895 -4.760 -5.738
455 HG3 GLU 21 HG2 GLU 21 -5.250 -3.133 -5.960
456 H ASN 22 H ASN 22 -5.764 -5.831 -2.044
457 HA ASN 22 HA ASN 22 -8.140 -6.821 -3.256
458 HB2 ASN 22 HB3 ASN 22 -6.526 -7.713 -0.876
459 HB3 ASN 22 HB2 ASN 22 -8.003 -8.536 -1.364
460 HD21 ASN 22 HD21 ASN 22 -6.870 -10.428 -1.802
461 HD22 ASN 22 HD22 ASN 22 -5.869 -10.592 -3.202
462 H GLU 23 H GLU 23 -7.477 -4.799 -0.581
463 HA GLU 23 HA GLU 23 -9.865 -5.309 0.904
464 HB2 GLU 23 HB3 GLU 23 -7.717 -4.469 1.882
465 HB3 GLU 23 HB2 GLU 23 -8.008 -2.922 1.062
466 HG2 GLU 23 HG3 GLU 23 -8.663 -2.712 3.339
467 HG3 GLU 23 HG2 GLU 23 -10.116 -2.712 2.344
468 H VAL 24 H VAL 24 -8.831 -2.819 -1.421
469 HA VAL 24 HA VAL 24 -11.250 -1.319 -1.228
470 HB VAL 24 HB VAL 24 -9.330 -1.390 -3.573
471 HG11 VAL 24 HG11 VAL 24 -10.236 0.784 -4.133
472 HG12 VAL 24 HG12 VAL 24 -11.286 0.755 -2.716
473 HG13 VAL 24 HG13 VAL 24 -11.551 -0.387 -4.037
474 HG21 VAL 24 HG21 VAL 24 -8.277 0.555 -2.570
475 HG22 VAL 24 HG22 VAL 24 -8.175 -0.838 -1.493
476 HG23 VAL 24 HG23 VAL 24 -9.353 0.437 -1.179
477 H ALA 25 H ALA 25 -10.165 -3.997 -3.231
478 HA ALA 25 HA ALA 25 -12.184 -3.870 -5.181
479 HB1 ALA 25 HB1 ALA 25 -10.790 -6.368 -4.264
480 HB2 ALA 25 HB2 ALA 25 -10.073 -5.182 -5.353
481 HB3 ALA 25 HB3 ALA 25 -11.522 -6.060 -5.835
482 H ARG 26 H ARG 26 -12.079 -5.579 -2.067
483 HA ARG 26 HA ARG 26 -14.501 -6.963 -2.476
484 HB2 ARG 26 HB3 ARG 26 -14.467 -7.174 0.056
485 HB3 ARG 26 HB2 ARG 26 -13.140 -7.895 -0.829
486 HG2 ARG 26 HG3 ARG 26 -11.758 -5.936 -0.266
487 HG3 ARG 26 HG2 ARG 26 -13.091 -5.288 0.694
488 HD2 ARG 26 HD2 ARG 26 -11.658 -7.905 1.146
489 HD3 ARG 26 HD1 ARG 26 -11.484 -6.440 2.109
490 HE ARG 26 HE ARG 26 -14.194 -7.341 1.996
491 HH11 ARG 26 HH11 ARG 26 -11.112 -7.915 3.558
492 HH12 ARG 26 HH12 ARG 26 -11.823 -8.558 5.004
493 HH21 ARG 26 HH21 ARG 26 -15.130 -8.213 3.877
494 HH22 ARG 26 HH22 ARG 26 -14.115 -8.732 5.185
495 H LEU 27 H LEU 27 -13.778 -3.893 -0.818
496 HA LEU 27 HA LEU 27 -16.453 -3.393 -0.066
497 HB2 LEU 27 HB3 LEU 27 -14.078 -1.601 -0.421
498 HB3 LEU 27 HB2 LEU 27 -15.666 -0.929 -0.161
499 HG LEU 27 HG LEU 27 -15.857 -2.067 1.971
500 HD11 LEU 27 HD11 LEU 27 -14.526 -4.043 1.535
501 HD12 LEU 27 HD12 LEU 27 -13.931 -3.205 2.969
502 HD13 LEU 27 HD13 LEU 27 -13.066 -3.059 1.438
503 HD21 LEU 27 HD21 LEU 27 -14.099 -0.827 3.181
504 HD22 LEU 27 HD22 LEU 27 -14.974 0.145 1.998
505 HD23 LEU 27 HD23 LEU 27 -13.352 -0.450 1.628
506 H LYS 28 H LYS 28 -14.656 -2.717 -3.013
507 HA LYS 28 HA LYS 28 -16.461 -1.067 -4.314
508 HB2 LYS 28 HB3 LYS 28 -14.188 -1.739 -5.134
509 HB3 LYS 28 HB2 LYS 28 -14.866 -3.292 -5.600
510 HG2 LYS 28 HG3 LYS 28 -14.711 -1.864 -7.526
511 HG3 LYS 28 HG2 LYS 28 -16.410 -2.129 -7.128
512 HD2 LYS 28 HD3 LYS 28 -16.483 0.046 -6.004
513 HD3 LYS 28 HD2 LYS 28 -14.783 0.307 -6.400
514 HE2 LYS 28 HE3 LYS 28 -15.327 0.220 -8.780
515 HE3 LYS 28 HE2 LYS 28 -17.024 -0.049 -8.387
516 HZ1 LYS 28 HZ1 LYS 28 -15.438 2.371 -7.731
517 HZ2 LYS 28 HZ2 LYS 28 -17.044 2.112 -7.277
518 HZ3 LYS 28 HZ3 LYS 28 -16.643 2.252 -8.912
519 H LYS 29 H LYS 29 -16.484 -4.587 -3.969
520 HA LYS 29 HA LYS 29 -18.831 -4.909 -5.579
521 HB2 LYS 29 HB3 LYS 29 -17.447 -6.822 -3.698
522 HB3 LYS 29 HB2 LYS 29 -18.735 -7.240 -4.815
523 HG2 LYS 29 HG3 LYS 29 -16.011 -6.210 -5.577
524 HG3 LYS 29 HG2 LYS 29 -16.556 -7.885 -5.688
525 HD2 LYS 29 HD3 LYS 29 -18.272 -7.228 -7.297
526 HD3 LYS 29 HD2 LYS 29 -17.752 -5.547 -7.174
527 HE2 LYS 29 HE3 LYS 29 -16.831 -6.584 -9.167
528 HE3 LYS 29 HE2 LYS 29 -15.548 -6.168 -8.033
529 HZ1 LYS 29 HZ1 LYS 29 -15.520 -8.483 -7.304
530 HZ2 LYS 29 HZ2 LYS 29 -15.195 -8.352 -8.954
531 HZ3 LYS 29 HZ3 LYS 29 -16.717 -8.867 -8.436
532 H LEU 30 H LEU 30 -18.133 -4.353 -2.219
533 HA LEU 30 HA LEU 30 -20.691 -5.143 -1.229
534 HB2 LEU 30 HB3 LEU 30 -18.649 -3.253 -0.054
535 HB3 LEU 30 HB2 LEU 30 -20.064 -3.850 0.790
536 HG LEU 30 HG LEU 30 -17.740 -5.523 -0.173
537 HD11 LEU 30 HD11 LEU 30 -18.614 -4.743 2.604
538 HD12 LEU 30 HD12 LEU 30 -17.197 -4.130 1.754
539 HD13 LEU 30 HD13 LEU 30 -17.286 -5.832 2.205
540 HD21 LEU 30 HD21 LEU 30 -19.812 -6.779 -0.298
541 HD22 LEU 30 HD22 LEU 30 -20.223 -6.304 1.349
542 HD23 LEU 30 HD23 LEU 30 -18.834 -7.350 1.054
543 H VAL 31 H VAL 31 -19.308 -2.165 -2.465
544 HA VAL 31 HA VAL 31 -21.616 -0.559 -1.911
545 HB VAL 31 HB VAL 31 -19.357 -0.062 -3.879
546 HG11 VAL 31 HG11 VAL 31 -21.326 1.279 -4.400
547 HG12 VAL 31 HG12 VAL 31 -20.038 2.291 -3.746
548 HG13 VAL 31 HG13 VAL 31 -21.404 1.837 -2.729
549 HG21 VAL 31 HG21 VAL 31 -18.432 1.388 -2.139
550 HG22 VAL 31 HG22 VAL 31 -18.539 -0.289 -1.602
551 HG23 VAL 31 HG23 VAL 31 -19.723 0.894 -1.042
552 H GLY 32 H GLY 32 -20.627 -2.704 -4.452
553 HA2 GLY 32 HA3 GLY 32 -22.586 -1.701 -6.344
554 HA3 GLY 32 HA2 GLY 32 -21.480 -3.042 -6.597
555 H GLU 33 H GLU 33 -22.069 -4.637 -4.432
556 HA GLU 33 HA GLU 33 -23.458 -6.262 -3.705
557 HB2 GLU 33 HB3 GLU 33 -25.634 -4.286 -4.412
558 HB3 GLU 33 HB2 GLU 33 -25.896 -5.789 -3.537
559 HG2 GLU 33 HG3 GLU 33 -24.458 -5.005 -1.736
560 HG3 GLU 33 HG2 GLU 33 -24.160 -3.507 -2.617