Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
611488 | 2n9l RC | 25910 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 MET 1 H MET 1 -17.584 2.472 3.795
2 HA MET 1 HA MET 1 -16.020 2.535 1.287
3 HB2 MET 1 HB2 MET 1 -15.065 3.615 3.976
4 HB3 MET 1 HB3 MET 1 -14.233 3.686 2.428
5 HG2 MET 1 HG2 MET 1 -16.740 5.158 3.245
6 HG3 MET 1 HG3 MET 1 -15.182 5.835 2.799
7 HE1 MET 1 HE1 MET 1 -16.719 7.535 1.195
8 HE2 MET 1 HE2 MET 1 -17.841 6.897 -0.027
9 HE3 MET 1 HE3 MET 1 -18.158 6.631 1.704
10 H GLY 2 H GLY 2 -13.551 1.661 2.147
11 HA2 GLY 2 HA2 GLY 2 -13.917 -0.777 3.770
12 HA3 GLY 2 HA3 GLY 2 -13.354 -0.936 2.093
13 H THR 3 H THR 3 -11.902 -1.355 4.766
14 HA THR 3 HA THR 3 -9.878 0.772 4.734
15 HB THR 3 HB THR 3 -10.187 -1.617 6.576
16 HG1 THR 3 HG1 THR 3 -11.229 -0.139 7.928
17 HG21 THR 3 HG21 THR 3 -8.853 -0.224 8.135
18 HG22 THR 3 HG22 THR 3 -7.944 -0.544 6.655
19 HG23 THR 3 HG23 THR 3 -8.708 1.043 6.896
20 H TYR 4 H TYR 4 -8.117 0.579 3.452
21 HA TYR 4 HA TYR 4 -7.286 -2.107 2.546
22 HB2 TYR 4 HB2 TYR 4 -6.939 0.691 1.503
23 HB3 TYR 4 HB3 TYR 4 -5.638 -0.452 1.227
24 HD1 TYR 4 HD1 TYR 4 -6.198 -2.777 0.233
25 HD2 TYR 4 HD2 TYR 4 -8.847 0.631 -0.008
26 HE1 TYR 4 HE1 TYR 4 -7.353 -3.829 -1.658
27 HE2 TYR 4 HE2 TYR 4 -10.035 -0.437 -1.900
28 HH TYR 4 HH TYR 4 -8.923 -3.426 -3.437
29 H LYS 5 H LYS 5 -5.599 -3.035 3.330
30 HA LYS 5 HA LYS 5 -3.950 -1.792 5.456
31 HB2 LYS 5 HB2 LYS 5 -4.284 -4.672 4.469
32 HB3 LYS 5 HB3 LYS 5 -3.274 -4.171 5.814
33 HG2 LYS 5 HG2 LYS 5 -5.657 -2.962 6.500
34 HG3 LYS 5 HG3 LYS 5 -6.258 -4.337 5.579
35 HD2 LYS 5 HD2 LYS 5 -5.112 -5.890 7.089
36 HD3 LYS 5 HD3 LYS 5 -4.307 -4.527 7.916
37 HE2 LYS 5 HE2 LYS 5 -6.571 -3.589 8.488
38 HE3 LYS 5 HE3 LYS 5 -7.313 -5.037 7.799
39 HZ1 LYS 5 HZ1 LYS 5 -6.014 -6.327 9.412
40 HZ2 LYS 5 HZ2 LYS 5 -5.479 -4.931 10.083
41 HZ3 LYS 5 HZ3 LYS 5 -7.100 -5.268 10.118
42 H LEU 6 H LEU 6 -2.096 -0.845 4.826
43 HA LEU 6 HA LEU 6 -0.956 -1.507 2.192
44 HB2 LEU 6 HB2 LEU 6 -1.503 0.876 3.166
45 HB3 LEU 6 HB3 LEU 6 -0.027 0.678 4.075
46 HG LEU 6 HG LEU 6 0.469 1.936 2.134
47 HD11 LEU 6 HD11 LEU 6 2.172 0.125 2.584
48 HD12 LEU 6 HD12 LEU 6 1.435 -0.802 1.258
49 HD13 LEU 6 HD13 LEU 6 2.144 0.782 0.941
50 HD21 LEU 6 HD21 LEU 6 -1.568 1.244 0.834
51 HD22 LEU 6 HD22 LEU 6 -0.090 1.268 -0.130
52 HD23 LEU 6 HD23 LEU 6 -0.769 -0.264 0.441
53 H ILE 7 H ILE 7 0.761 -2.879 2.087
54 HA ILE 7 HA ILE 7 2.509 -3.134 4.482
55 HB ILE 7 HB ILE 7 1.865 -5.401 2.566
56 HG12 ILE 7 HG12 ILE 7 0.840 -6.284 4.891
57 HG13 ILE 7 HG13 ILE 7 0.563 -4.569 5.168
58 HG21 ILE 7 HG21 ILE 7 3.356 -5.240 5.233
59 HG22 ILE 7 HG22 ILE 7 3.008 -6.733 4.340
60 HG23 ILE 7 HG23 ILE 7 4.083 -5.524 3.637
61 HD11 ILE 7 HD11 ILE 7 -0.665 -4.584 2.879
62 HD12 ILE 7 HD12 ILE 7 -0.518 -6.338 2.933
63 HD13 ILE 7 HD13 ILE 7 -1.424 -5.487 4.201
64 H LEU 8 H LEU 8 4.383 -2.284 4.098
65 HA LEU 8 HA LEU 8 5.398 -1.800 1.349
66 HB2 LEU 8 HB2 LEU 8 5.790 -0.657 4.054
67 HB3 LEU 8 HB3 LEU 8 7.325 -1.123 3.329
68 HG LEU 8 HG LEU 8 6.845 0.247 1.364
69 HD11 LEU 8 HD11 LEU 8 4.456 0.245 1.222
70 HD12 LEU 8 HD12 LEU 8 4.310 0.955 2.845
71 HD13 LEU 8 HD13 LEU 8 4.956 1.916 1.496
72 HD21 LEU 8 HD21 LEU 8 8.028 1.159 3.411
73 HD22 LEU 8 HD22 LEU 8 7.217 2.397 2.448
74 HD23 LEU 8 HD23 LEU 8 6.474 1.814 3.955
75 H ASN 9 H ASN 9 6.412 -3.587 0.439
76 HA ASN 9 HA ASN 9 7.859 -5.474 2.239
77 HB2 ASN 9 HB2 ASN 9 5.829 -6.493 1.350
78 HB3 ASN 9 HB3 ASN 9 6.246 -5.971 -0.292
79 HD21 ASN 9 HD22 ASN 9 6.759 -7.890 -1.403
80 HD22 ASN 9 HD21 ASN 9 8.009 -8.975 -0.827
81 H GLY 10 H GLY 10 9.703 -3.958 1.986
82 HA2 GLY 10 HA2 GLY 10 10.740 -3.703 -0.764
83 HA3 GLY 10 HA3 GLY 10 11.245 -2.806 0.665
84 H LYS 11 H LYS 11 13.057 -3.742 -0.942
85 HA LYS 11 HA LYS 11 14.171 -6.300 -0.075
86 HB2 LYS 11 HB2 LYS 11 15.734 -6.023 -1.791
87 HB3 LYS 11 HB3 LYS 11 14.250 -5.366 -2.445
88 HG2 LYS 11 HG2 LYS 11 16.686 -3.815 -1.473
89 HG3 LYS 11 HG3 LYS 11 16.126 -4.021 -3.114
90 HD2 LYS 11 HD2 LYS 11 13.988 -2.743 -2.410
91 HD3 LYS 11 HD3 LYS 11 14.877 -2.349 -0.929
92 HE2 LYS 11 HE2 LYS 11 15.299 -0.504 -2.291
93 HE3 LYS 11 HE3 LYS 11 16.758 -1.495 -2.455
94 HZ1 LYS 11 HZ1 LYS 11 16.096 -0.810 -4.623
95 HZ2 LYS 11 HZ2 LYS 11 15.583 -2.393 -4.555
96 HZ3 LYS 11 HZ3 LYS 11 14.551 -1.131 -4.368
97 H THR 12 H THR 12 14.056 -3.461 1.518
98 HA THR 12 HA THR 12 16.623 -3.955 2.899
99 HB THR 12 HB THR 12 15.764 -1.175 2.012
100 HG1 THR 12 HG1 THR 12 17.671 -2.899 0.804
101 HG21 THR 12 HG21 THR 12 17.292 -1.286 3.982
102 HG22 THR 12 HG22 THR 12 18.452 -2.202 2.992
103 HG23 THR 12 HG23 THR 12 18.031 -0.525 2.587
104 H LEU 13 H LEU 13 13.354 -2.433 2.914
105 HA LEU 13 HA LEU 13 13.237 -2.799 5.760
106 HB2 LEU 13 HB2 LEU 13 12.704 -0.590 6.381
107 HB3 LEU 13 HB3 LEU 13 14.223 -0.536 5.537
108 HG LEU 13 HG LEU 13 13.076 1.376 4.947
109 HD11 LEU 13 HD11 LEU 13 12.632 -0.408 2.543
110 HD12 LEU 13 HD12 LEU 13 12.803 1.354 2.561
111 HD13 LEU 13 HD13 LEU 13 14.175 0.345 3.023
112 HD21 LEU 13 HD21 LEU 13 10.864 1.655 4.174
113 HD22 LEU 13 HD22 LEU 13 10.585 -0.086 4.039
114 HD23 LEU 13 HD23 LEU 13 10.784 0.670 5.638
115 H LYS 14 H LYS 14 10.995 -2.303 6.524
116 HA LYS 14 HA LYS 14 8.909 -2.654 4.454
117 HB2 LYS 14 HB2 LYS 14 9.314 -4.410 6.918
118 HB3 LYS 14 HB3 LYS 14 7.864 -4.382 5.914
119 HG2 LYS 14 HG2 LYS 14 9.299 -4.968 3.912
120 HG3 LYS 14 HG3 LYS 14 10.636 -5.258 5.039
121 HD2 LYS 14 HD2 LYS 14 9.268 -6.916 6.254
122 HD3 LYS 14 HD3 LYS 14 7.902 -6.577 5.162
123 HE2 LYS 14 HE2 LYS 14 9.590 -7.179 3.263
124 HE3 LYS 14 HE3 LYS 14 10.543 -7.940 4.540
125 HZ1 LYS 14 HZ1 LYS 14 8.537 -9.314 5.029
126 HZ2 LYS 14 HZ2 LYS 14 7.720 -8.523 3.866
127 HZ3 LYS 14 HZ3 LYS 14 9.002 -9.456 3.437
128 H GLY 15 H GLY 15 6.666 -2.415 5.488
129 HA2 GLY 15 HA2 GLY 15 6.508 -0.872 7.950
130 HA3 GLY 15 HA3 GLY 15 6.178 0.064 6.478
131 H GLU 16 H GLU 16 4.220 -0.530 8.512
132 HA GLU 16 HA GLU 16 2.247 -1.976 6.836
133 HB2 GLU 16 HB2 GLU 16 3.281 -3.615 8.474
134 HB3 GLU 16 HB3 GLU 16 2.651 -2.610 9.787
135 HG2 GLU 16 HG2 GLU 16 0.357 -2.873 8.669
136 HG3 GLU 16 HG3 GLU 16 1.088 -4.084 7.616
137 H THR 17 H THR 17 0.583 -0.484 6.608
138 HA THR 17 HA THR 17 -0.273 1.137 8.937
139 HB THR 17 HB THR 17 -0.456 3.084 7.249
140 HG1 THR 17 HG1 THR 17 1.139 3.052 5.659
141 HG21 THR 17 HG21 THR 17 1.173 3.036 9.150
142 HG22 THR 17 HG22 THR 17 2.359 2.258 8.082
143 HG23 THR 17 HG23 THR 17 1.781 3.897 7.730
144 H THR 18 H THR 18 -2.491 2.246 8.341
145 HA THR 18 HA THR 18 -4.058 0.552 6.436
146 HB THR 18 HB THR 18 -5.821 0.491 8.306
147 HG1 THR 18 HG1 THR 18 -4.803 2.009 9.724
148 HG21 THR 18 HG21 THR 18 -4.408 -1.504 7.709
149 HG22 THR 18 HG22 THR 18 -3.298 -1.046 9.017
150 HG23 THR 18 HG23 THR 18 -4.976 -1.475 9.388
151 H THR 19 H THR 19 -5.641 1.749 5.337
152 HA THR 19 HA THR 19 -6.664 4.198 6.459
153 HB THR 19 HB THR 19 -4.974 4.376 3.944
154 HG1 THR 19 HG1 THR 19 -4.373 4.623 6.432
155 HG21 THR 19 HG21 THR 19 -6.698 6.501 5.274
156 HG22 THR 19 HG22 THR 19 -5.569 6.766 3.931
157 HG23 THR 19 HG23 THR 19 -7.019 5.778 3.690
158 H GLU 20 H GLU 20 -8.780 4.554 5.712
159 HA GLU 20 HA GLU 20 -9.767 2.562 3.758
160 HB2 GLU 20 HB2 GLU 20 -11.928 2.831 4.792
161 HB3 GLU 20 HB3 GLU 20 -10.708 2.534 6.033
162 HG2 GLU 20 HG2 GLU 20 -10.657 5.186 6.209
163 HG3 GLU 20 HG3 GLU 20 -12.239 5.062 5.430
164 H ALA 21 H ALA 21 -11.067 3.156 2.032
165 HA ALA 21 HA ALA 21 -11.615 5.934 1.380
166 HB1 ALA 21 HB1 ALA 21 -9.204 5.675 0.692
167 HB2 ALA 21 HB2 ALA 21 -9.676 4.302 -0.341
168 HB3 ALA 21 HB3 ALA 21 -10.300 5.937 -0.671
169 H VAL 22 H VAL 22 -12.663 5.949 -0.913
170 HA VAL 22 HA VAL 22 -14.676 3.898 -0.934
171 HB VAL 22 HB VAL 22 -14.976 6.305 -1.597
172 HG11 VAL 22 HG11 VAL 22 -14.479 7.071 -3.820
173 HG12 VAL 22 HG12 VAL 22 -12.963 6.480 -3.123
174 HG13 VAL 22 HG13 VAL 22 -13.841 5.495 -4.303
175 HG21 VAL 22 HG21 VAL 22 -15.937 4.282 -3.655
176 HG22 VAL 22 HG22 VAL 22 -16.687 4.591 -2.076
177 HG23 VAL 22 HG23 VAL 22 -16.654 5.862 -3.304
178 H ASP 23 H ASP 23 -11.527 4.239 -2.655
179 HA ASP 23 HA ASP 23 -11.969 1.540 -3.596
180 HB2 ASP 23 HB2 ASP 23 -12.870 3.387 -5.322
181 HB3 ASP 23 HB3 ASP 23 -11.168 3.473 -5.763
182 H ALA 24 H ALA 24 -10.139 0.692 -4.821
183 HA ALA 24 HA ALA 24 -7.761 0.712 -3.366
184 HB1 ALA 24 HB1 ALA 24 -8.501 -1.142 -4.791
185 HB2 ALA 24 HB2 ALA 24 -8.311 -0.152 -6.239
186 HB3 ALA 24 HB3 ALA 24 -6.890 -0.621 -5.305
187 H ALA 25 H ALA 25 -8.441 2.419 -6.484
188 HA ALA 25 HA ALA 25 -5.870 3.437 -6.901
189 HB1 ALA 25 HB1 ALA 25 -7.668 3.596 -8.566
190 HB2 ALA 25 HB2 ALA 25 -8.557 4.743 -7.537
191 HB3 ALA 25 HB3 ALA 25 -6.990 5.201 -8.246
192 H THR 26 H THR 26 -8.319 4.633 -4.544
193 HA THR 26 HA THR 26 -6.863 7.137 -4.121
194 HB THR 26 HB THR 26 -9.098 5.840 -2.527
195 HG1 THR 26 HG1 THR 26 -10.278 7.531 -3.754
196 HG21 THR 26 HG21 THR 26 -7.857 7.601 -1.248
197 HG22 THR 26 HG22 THR 26 -8.095 8.733 -2.592
198 HG23 THR 26 HG23 THR 26 -9.482 8.131 -1.659
199 H ALA 27 H ALA 27 -7.039 3.887 -2.616
200 HA ALA 27 HA ALA 27 -5.494 4.513 -0.320
201 HB1 ALA 27 HB1 ALA 27 -5.632 1.866 -1.853
202 HB2 ALA 27 HB2 ALA 27 -5.063 2.084 -0.195
203 HB3 ALA 27 HB3 ALA 27 -6.772 2.381 -0.595
204 H GLU 28 H GLU 28 -4.528 3.183 -3.469
205 HA GLU 28 HA GLU 28 -1.744 3.154 -3.095
206 HB2 GLU 28 HB2 GLU 28 -3.015 1.999 -4.874
207 HB3 GLU 28 HB3 GLU 28 -3.470 3.553 -5.567
208 HG2 GLU 28 HG2 GLU 28 -0.638 3.640 -5.487
209 HG3 GLU 28 HG3 GLU 28 -1.008 1.972 -5.906
210 H LYS 29 H LYS 29 -3.718 5.702 -4.766
211 HA LYS 29 HA LYS 29 -1.596 7.418 -5.352
212 HB2 LYS 29 HB2 LYS 29 -3.800 7.718 -6.292
213 HB3 LYS 29 HB3 LYS 29 -4.506 8.059 -4.699
214 HG2 LYS 29 HG2 LYS 29 -3.352 10.165 -4.526
215 HG3 LYS 29 HG3 LYS 29 -2.274 9.746 -5.866
216 HD2 LYS 29 HD2 LYS 29 -3.851 11.383 -6.613
217 HD3 LYS 29 HD3 LYS 29 -4.146 9.843 -7.433
218 HE2 LYS 29 HE2 LYS 29 -6.051 9.378 -5.943
219 HE3 LYS 29 HE3 LYS 29 -5.722 10.861 -5.023
220 HZ1 LYS 29 HZ1 LYS 29 -6.403 10.819 -7.892
221 HZ2 LYS 29 HZ2 LYS 29 -7.495 11.091 -6.666
222 HZ3 LYS 29 HZ3 LYS 29 -6.270 12.154 -6.941
223 H VAL 30 H VAL 30 -3.501 7.289 -2.299
224 HA VAL 30 HA VAL 30 -2.140 9.584 -1.173
225 HB VAL 30 HB VAL 30 -3.941 7.390 -0.067
226 HG11 VAL 30 HG11 VAL 30 -2.582 8.107 1.812
227 HG12 VAL 30 HG12 VAL 30 -2.803 9.807 1.374
228 HG13 VAL 30 HG13 VAL 30 -4.174 8.838 1.960
229 HG21 VAL 30 HG21 VAL 30 -4.415 10.375 -0.555
230 HG22 VAL 30 HG22 VAL 30 -4.975 9.082 -1.630
231 HG23 VAL 30 HG23 VAL 30 -5.610 9.193 0.010
232 H PHE 31 H PHE 31 -1.897 6.003 -0.421
233 HA PHE 31 HA PHE 31 0.277 6.391 1.299
234 HB2 PHE 31 HB2 PHE 31 -0.772 3.983 -0.188
235 HB3 PHE 31 HB3 PHE 31 0.698 3.883 0.761
236 HD1 PHE 31 HD2 PHE 31 0.464 5.188 3.202
237 HD2 PHE 31 HD1 PHE 31 -2.671 3.198 1.005
238 HE1 PHE 31 HE2 PHE 31 -0.658 4.636 5.319
239 HE2 PHE 31 HE1 PHE 31 -3.740 2.541 3.156
240 HZ PHE 31 HZ PHE 31 -2.703 3.241 5.314
241 H LYS 32 H LYS 32 0.462 6.375 -2.217
242 HA LYS 32 HA LYS 32 3.149 5.505 -2.457
243 HB2 LYS 32 HB2 LYS 32 1.590 5.831 -4.337
244 HB3 LYS 32 HB3 LYS 32 1.693 7.580 -4.125
245 HG2 LYS 32 HG2 LYS 32 4.188 7.410 -4.568
246 HG3 LYS 32 HG3 LYS 32 3.958 5.676 -4.868
247 HD2 LYS 32 HD2 LYS 32 2.334 6.290 -6.704
248 HD3 LYS 32 HD3 LYS 32 2.712 7.999 -6.397
249 HE2 LYS 32 HE2 LYS 32 5.151 7.447 -6.802
250 HE3 LYS 32 HE3 LYS 32 4.657 5.818 -7.270
251 HZ1 LYS 32 HZ1 LYS 32 3.826 8.312 -8.604
252 HZ2 LYS 32 HZ2 LYS 32 4.907 7.232 -9.176
253 HZ3 LYS 32 HZ3 LYS 32 3.299 6.813 -9.021
254 H GLN 33 H GLN 33 1.915 8.608 -1.276
255 HA GLN 33 HA GLN 33 4.261 10.172 -1.473
256 HB2 GLN 33 HB2 GLN 33 2.164 10.073 0.760
257 HB3 GLN 33 HB3 GLN 33 3.363 11.343 0.545
258 HG2 GLN 33 HG2 GLN 33 2.285 11.914 -1.648
259 HG3 GLN 33 HG3 GLN 33 1.037 10.701 -1.302
260 HE21 GLN 33 HE22 GLN 33 2.504 13.757 -0.113
261 HE22 GLN 33 HE21 GLN 33 1.089 14.270 0.777
262 H TYR 34 H TYR 34 3.064 8.260 1.252
263 HA TYR 34 HA TYR 34 5.336 8.355 2.914
264 HB2 TYR 34 HB2 TYR 34 3.466 7.894 4.091
265 HB3 TYR 34 HB3 TYR 34 2.686 7.043 2.803
266 HD1 TYR 34 HD2 TYR 34 5.231 6.609 5.511
267 HD2 TYR 34 HD1 TYR 34 2.653 4.680 2.644
268 HE1 TYR 34 HE2 TYR 34 5.638 4.423 6.609
269 HE2 TYR 34 HE1 TYR 34 3.014 2.523 3.751
270 HH TYR 34 HH TYR 34 3.983 1.415 5.562
271 H ALA 35 H ALA 35 4.280 5.845 0.544
272 HA ALA 35 HA ALA 35 6.189 3.924 1.249
273 HB1 ALA 35 HB1 ALA 35 5.862 3.011 -1.015
274 HB2 ALA 35 HB2 ALA 35 4.311 3.490 -0.294
275 HB3 ALA 35 HB3 ALA 35 5.085 4.522 -1.526
276 H ASN 36 H ASN 36 6.495 6.389 -1.372
277 HA ASN 36 HA ASN 36 9.243 5.733 -1.797
278 HB2 ASN 36 HB2 ASN 36 7.724 6.845 -3.468
279 HB3 ASN 36 HB3 ASN 36 7.880 8.344 -2.533
280 HD21 ASN 36 HD22 ASN 36 9.297 9.629 -3.788
281 HD22 ASN 36 HD21 ASN 36 10.801 9.019 -4.482
282 H ASP 37 H ASP 37 7.676 7.976 0.457
283 HA ASP 37 HA ASP 37 10.037 9.544 1.060
284 HB2 ASP 37 HB2 ASP 37 7.732 10.258 1.685
285 HB3 ASP 37 HB3 ASP 37 7.642 8.926 2.837
286 H ASN 38 H ASN 38 8.660 6.473 2.247
287 HA ASN 38 HA ASN 38 10.573 6.206 4.400
288 HB2 ASN 38 HB2 ASN 38 8.154 5.273 4.262
289 HB3 ASN 38 HB3 ASN 38 8.867 3.962 3.307
290 HD21 ASN 38 HD22 ASN 38 7.880 2.785 5.346
291 HD22 ASN 38 HD21 ASN 38 8.941 2.682 6.746
292 H GLY 39 H GLY 39 10.593 5.373 1.020
293 HA2 GLY 39 HA2 GLY 39 12.733 4.935 -0.017
294 HA3 GLY 39 HA3 GLY 39 13.234 4.010 1.400
295 H VAL 40 H VAL 40 9.968 3.577 -0.099
296 HA VAL 40 HA VAL 40 10.930 1.020 -1.241
297 HB VAL 40 HB VAL 40 8.306 1.411 0.212
298 HG11 VAL 40 HG11 VAL 40 8.163 -1.101 -0.035
299 HG12 VAL 40 HG12 VAL 40 8.159 -0.270 -1.592
300 HG13 VAL 40 HG13 VAL 40 9.638 -1.058 -1.016
301 HG21 VAL 40 HG21 VAL 40 10.831 -0.059 1.081
302 HG22 VAL 40 HG22 VAL 40 10.096 1.350 1.875
303 HG23 VAL 40 HG23 VAL 40 9.268 -0.215 1.883
304 H ASP 41 H ASP 41 10.489 0.828 -3.305
305 HA ASP 41 HA ASP 41 8.167 2.178 -4.508
306 HB2 ASP 41 HB2 ASP 41 10.134 3.780 -4.617
307 HB3 ASP 41 HB3 ASP 41 10.975 2.593 -5.628
308 H GLY 42 H GLY 42 7.202 0.267 -5.028
309 HA2 GLY 42 HA2 GLY 42 8.640 -1.510 -6.902
310 HA3 GLY 42 HA3 GLY 42 8.016 -2.183 -5.404
311 H GLU 43 H GLU 43 6.782 -3.562 -6.660
312 HA GLU 43 HA GLU 43 4.709 -2.664 -8.481
313 HB2 GLU 43 HB2 GLU 43 6.207 -4.641 -8.754
314 HB3 GLU 43 HB3 GLU 43 5.401 -5.422 -7.391
315 HG2 GLU 43 HG2 GLU 43 3.275 -5.436 -8.615
316 HG3 GLU 43 HG3 GLU 43 3.988 -4.450 -9.916
317 H TRP 44 H TRP 44 2.987 -1.748 -7.629
318 HA TRP 44 HA TRP 44 1.839 -2.275 -5.034
319 HB2 TRP 44 HB2 TRP 44 0.926 -0.651 -7.464
320 HB3 TRP 44 HB3 TRP 44 0.124 -0.641 -5.894
321 HD1 TRP 44 HD1 TRP 44 3.567 0.322 -7.408
322 HE1 TRP 44 HE1 TRP 44 4.594 2.194 -6.028
323 HE3 TRP 44 HE3 TRP 44 -0.099 0.814 -3.886
324 HZ2 TRP 44 HZ2 TRP 44 4.095 3.467 -3.481
325 HZ3 TRP 44 HZ3 TRP 44 0.193 2.398 -1.993
326 HH2 TRP 44 HH2 TRP 44 2.312 3.639 -1.719
327 H THR 45 H THR 45 0.728 -4.216 -4.719
328 HA THR 45 HA THR 45 -1.181 -5.120 -6.853
329 HB THR 45 HB THR 45 0.572 -6.828 -5.078
330 HG1 THR 45 HG1 THR 45 1.628 -5.539 -6.766
331 HG21 THR 45 HG21 THR 45 -1.084 -7.535 -7.527
332 HG22 THR 45 HG22 THR 45 -0.006 -8.627 -6.651
333 HG23 THR 45 HG23 THR 45 -1.464 -8.003 -5.853
334 H TYR 46 H TYR 46 -3.257 -5.362 -6.100
335 HA TYR 46 HA TYR 46 -3.695 -5.338 -3.177
336 HB2 TYR 46 HB2 TYR 46 -5.732 -4.194 -3.538
337 HB3 TYR 46 HB3 TYR 46 -4.453 -3.325 -4.337
338 HD1 TYR 46 HD2 TYR 46 -7.357 -5.587 -4.908
339 HD2 TYR 46 HD1 TYR 46 -4.518 -2.882 -6.726
340 HE1 TYR 46 HE2 TYR 46 -8.598 -5.678 -7.027
341 HE2 TYR 46 HE1 TYR 46 -5.808 -2.964 -8.847
342 HH TYR 46 HH TYR 46 -8.391 -5.318 -9.324
343 H ASP 47 H ASP 47 -5.364 -6.472 -2.250
344 HA ASP 47 HA ASP 47 -6.578 -8.723 -3.756
345 HB2 ASP 47 HB2 ASP 47 -4.588 -9.575 -2.599
346 HB3 ASP 47 HB3 ASP 47 -5.148 -8.887 -1.069
347 H ASP 48 H ASP 48 -8.729 -8.123 -3.603
348 HA ASP 48 HA ASP 48 -9.621 -6.369 -1.457
349 HB2 ASP 48 HB2 ASP 48 -11.627 -6.137 -2.501
350 HB3 ASP 48 HB3 ASP 48 -10.544 -6.358 -3.833
351 H ALA 49 H ALA 49 -9.570 -9.858 -1.947
352 HA ALA 49 HA ALA 49 -11.662 -10.537 -0.145
353 HB1 ALA 49 HB1 ALA 49 -9.141 -12.093 -0.828
354 HB2 ALA 49 HB2 ALA 49 -10.611 -12.755 -0.076
355 HB3 ALA 49 HB3 ALA 49 -10.668 -12.132 -1.738
356 H THR 50 H THR 50 -8.173 -10.004 0.390
357 HA THR 50 HA THR 50 -8.518 -10.223 3.324
358 HB THR 50 HB THR 50 -5.909 -9.807 1.863
359 HG1 THR 50 HG1 THR 50 -6.663 -11.415 0.760
360 HG21 THR 50 HG21 THR 50 -6.659 -11.357 4.381
361 HG22 THR 50 HG22 THR 50 -5.027 -11.266 3.672
362 HG23 THR 50 HG23 THR 50 -5.790 -9.811 4.323
363 H LYS 51 H LYS 51 -8.495 -7.847 0.865
364 HA LYS 51 HA LYS 51 -8.453 -5.634 0.772
365 HB2 LYS 51 HB2 LYS 51 -8.959 -5.708 3.771
366 HB3 LYS 51 HB3 LYS 51 -9.034 -4.281 2.731
367 HG2 LYS 51 HG2 LYS 51 -10.816 -5.214 1.406
368 HG3 LYS 51 HG3 LYS 51 -10.779 -6.731 2.339
369 HD2 LYS 51 HD2 LYS 51 -11.505 -5.630 4.345
370 HD3 LYS 51 HD3 LYS 51 -11.263 -4.029 3.638
371 HE2 LYS 51 HE2 LYS 51 -13.639 -4.652 3.781
372 HE3 LYS 51 HE3 LYS 51 -13.112 -4.260 2.147
373 HZ1 LYS 51 HZ1 LYS 51 -13.217 -6.455 1.518
374 HZ2 LYS 51 HZ2 LYS 51 -13.288 -7.070 3.047
375 HZ3 LYS 51 HZ3 LYS 51 -14.565 -6.257 2.420
376 H THR 52 H THR 52 -5.952 -7.107 0.986
377 HA THR 52 HA THR 52 -4.177 -5.199 2.369
378 HB THR 52 HB THR 52 -2.504 -7.071 1.695
379 HG1 THR 52 HG1 THR 52 -3.421 -9.037 1.222
380 HG21 THR 52 HG21 THR 52 -4.766 -7.696 3.659
381 HG22 THR 52 HG22 THR 52 -3.190 -8.509 3.607
382 HG23 THR 52 HG23 THR 52 -3.288 -6.793 4.026
383 H PHE 53 H PHE 53 -2.414 -4.296 1.215
384 HA PHE 53 HA PHE 53 -2.464 -4.355 -1.706
385 HB2 PHE 53 HB2 PHE 53 -3.940 -2.449 -0.526
386 HB3 PHE 53 HB3 PHE 53 -2.399 -1.653 -0.374
387 HD1 PHE 53 HD2 PHE 53 -1.340 -2.824 -3.211
388 HD2 PHE 53 HD1 PHE 53 -4.921 -0.788 -1.893
389 HE1 PHE 53 HE2 PHE 53 -1.669 -1.897 -5.479
390 HE2 PHE 53 HE1 PHE 53 -5.161 0.195 -4.144
391 HZ PHE 53 HZ PHE 53 -3.545 -0.349 -5.943
392 H THR 54 H THR 54 -0.468 -5.263 -1.804
393 HA THR 54 HA THR 54 1.649 -4.357 0.027
394 HB THR 54 HB THR 54 1.587 -6.768 -1.780
395 HG1 THR 54 HG1 THR 54 0.607 -7.837 -0.278
396 HG21 THR 54 HG21 THR 54 3.240 -6.131 0.707
397 HG22 THR 54 HG22 THR 54 3.257 -7.668 -0.180
398 HG23 THR 54 HG23 THR 54 3.841 -6.198 -0.963
399 H VAL 55 H VAL 55 3.543 -3.458 -0.661
400 HA VAL 55 HA VAL 55 3.841 -2.808 -3.568
401 HB VAL 55 HB VAL 55 5.036 -1.313 -1.177
402 HG11 VAL 55 HG11 VAL 55 6.314 -1.135 -3.291
403 HG12 VAL 55 HG12 VAL 55 4.843 -0.616 -4.149
404 HG13 VAL 55 HG13 VAL 55 5.552 0.409 -2.877
405 HG21 VAL 55 HG21 VAL 55 2.596 -0.631 -2.835
406 HG22 VAL 55 HG22 VAL 55 2.660 -0.946 -1.072
407 HG23 VAL 55 HG23 VAL 55 3.424 0.500 -1.738
408 H THR 56 H THR 56 5.090 -4.563 -4.245
409 HA THR 56 HA THR 56 7.204 -5.581 -2.437
410 HB THR 56 HB THR 56 5.877 -6.776 -4.873
411 HG1 THR 56 HG1 THR 56 4.563 -7.121 -3.306
412 HG21 THR 56 HG21 THR 56 8.127 -7.865 -3.139
413 HG22 THR 56 HG22 THR 56 7.091 -8.868 -4.176
414 HG23 THR 56 HG23 THR 56 8.128 -7.623 -4.892
415 H GLU 57 H GLU 57 9.262 -4.945 -2.751
416 HA GLU 57 HA GLU 57 10.113 -4.063 -5.463
417 HB2 GLU 57 HB2 GLU 57 9.782 -2.123 -3.939
418 HB3 GLU 57 HB3 GLU 57 10.874 -2.872 -2.767
419 HG2 GLU 57 HG2 GLU 57 12.712 -2.797 -4.422
420 HG3 GLU 57 HG3 GLU 57 11.637 -2.084 -5.622
Start of MODEL 2
1 H1 MET 1 H MET 1 -16.407 4.012 4.166
2 HA MET 1 HA MET 1 -16.682 1.645 4.005
3 HB2 MET 1 HB2 MET 1 -15.066 2.558 1.611
4 HB3 MET 1 HB3 MET 1 -16.154 1.175 1.655
5 HG2 MET 1 HG2 MET 1 -18.079 2.448 1.665
6 HG3 MET 1 HG3 MET 1 -17.267 3.883 2.285
7 HE1 MET 1 HE1 MET 1 -18.625 3.760 -1.765
8 HE2 MET 1 HE2 MET 1 -18.757 2.318 -0.741
9 HE3 MET 1 HE3 MET 1 -19.360 3.885 -0.148
10 H GLY 2 H GLY 2 -14.910 -0.073 2.379
11 HA2 GLY 2 HA2 GLY 2 -13.571 -1.461 4.344
12 HA3 GLY 2 HA3 GLY 2 -13.216 -1.532 2.609
13 H THR 3 H THR 3 -11.485 -1.610 5.094
14 HA THR 3 HA THR 3 -9.763 0.735 4.760
15 HB THR 3 HB THR 3 -9.201 -1.520 6.652
16 HG1 THR 3 HG1 THR 3 -11.203 0.386 7.329
17 HG21 THR 3 HG21 THR 3 -7.741 0.467 6.565
18 HG22 THR 3 HG22 THR 3 -9.117 1.498 7.024
19 HG23 THR 3 HG23 THR 3 -8.513 0.259 8.146
20 H TYR 4 H TYR 4 -7.998 0.547 3.379
21 HA TYR 4 HA TYR 4 -7.325 -2.172 2.354
22 HB2 TYR 4 HB2 TYR 4 -6.546 0.622 1.449
23 HB3 TYR 4 HB3 TYR 4 -5.842 -0.853 0.813
24 HD1 TYR 4 HD1 TYR 4 -7.262 -2.499 -0.467
25 HD2 TYR 4 HD2 TYR 4 -8.652 1.450 0.589
26 HE1 TYR 4 HE1 TYR 4 -9.008 -2.666 -2.194
27 HE2 TYR 4 HE2 TYR 4 -10.425 1.279 -1.158
28 HH TYR 4 HH TYR 4 -11.005 -1.723 -2.980
29 H LYS 5 H LYS 5 -5.816 -3.194 3.528
30 HA LYS 5 HA LYS 5 -4.131 -1.756 5.445
31 HB2 LYS 5 HB2 LYS 5 -4.062 -4.685 4.561
32 HB3 LYS 5 HB3 LYS 5 -3.219 -3.982 5.943
33 HG2 LYS 5 HG2 LYS 5 -5.432 -3.448 6.997
34 HG3 LYS 5 HG3 LYS 5 -6.253 -4.129 5.598
35 HD2 LYS 5 HD2 LYS 5 -6.268 -5.700 7.434
36 HD3 LYS 5 HD3 LYS 5 -5.318 -6.349 6.088
37 HE2 LYS 5 HE2 LYS 5 -3.231 -5.643 7.238
38 HE3 LYS 5 HE3 LYS 5 -4.179 -4.965 8.571
39 HZ1 LYS 5 HZ1 LYS 5 -3.290 -7.193 8.981
40 HZ2 LYS 5 HZ2 LYS 5 -4.954 -7.199 9.062
41 HZ3 LYS 5 HZ3 LYS 5 -4.164 -7.809 7.755
42 H LEU 6 H LEU 6 -2.121 -0.940 4.978
43 HA LEU 6 HA LEU 6 -1.035 -1.470 2.282
44 HB2 LEU 6 HB2 LEU 6 -1.572 0.891 3.216
45 HB3 LEU 6 HB3 LEU 6 -0.189 0.673 4.264
46 HG LEU 6 HG LEU 6 0.539 1.951 2.412
47 HD11 LEU 6 HD11 LEU 6 2.260 0.767 1.325
48 HD12 LEU 6 HD12 LEU 6 2.135 0.046 2.943
49 HD13 LEU 6 HD13 LEU 6 1.472 -0.792 1.516
50 HD21 LEU 6 HD21 LEU 6 -0.751 -0.122 0.606
51 HD22 LEU 6 HD22 LEU 6 -1.313 1.518 0.885
52 HD23 LEU 6 HD23 LEU 6 0.218 1.261 0.046
53 H ILE 7 H ILE 7 0.612 -2.883 2.187
54 HA ILE 7 HA ILE 7 2.336 -3.270 4.586
55 HB ILE 7 HB ILE 7 1.552 -5.394 2.554
56 HG12 ILE 7 HG12 ILE 7 0.673 -6.532 4.720
57 HG13 ILE 7 HG13 ILE 7 0.600 -4.911 5.401
58 HG21 ILE 7 HG21 ILE 7 3.873 -5.611 3.423
59 HG22 ILE 7 HG22 ILE 7 3.258 -5.528 5.088
60 HG23 ILE 7 HG23 ILE 7 2.841 -6.899 4.035
61 HD11 ILE 7 HD11 ILE 7 -1.564 -5.787 4.375
62 HD12 ILE 7 HD12 ILE 7 -1.042 -4.253 3.731
63 HD13 ILE 7 HD13 ILE 7 -0.776 -5.735 2.790
64 H LEU 8 H LEU 8 4.239 -2.477 4.204
65 HA LEU 8 HA LEU 8 5.168 -1.918 1.437
66 HB2 LEU 8 HB2 LEU 8 5.157 -0.388 3.839
67 HB3 LEU 8 HB3 LEU 8 6.805 -1.004 3.696
68 HG LEU 8 HG LEU 8 7.008 -0.035 1.470
69 HD11 LEU 8 HD11 LEU 8 4.363 1.355 2.007
70 HD12 LEU 8 HD12 LEU 8 5.435 1.594 0.615
71 HD13 LEU 8 HD13 LEU 8 4.589 0.062 0.810
72 HD21 LEU 8 HD21 LEU 8 7.719 1.162 3.535
73 HD22 LEU 8 HD22 LEU 8 7.224 2.282 2.259
74 HD23 LEU 8 HD23 LEU 8 6.124 1.950 3.616
75 H ASN 9 H ASN 9 6.475 -3.522 0.596
76 HA ASN 9 HA ASN 9 8.098 -5.167 2.452
77 HB2 ASN 9 HB2 ASN 9 6.192 -6.529 1.839
78 HB3 ASN 9 HB3 ASN 9 6.329 -6.045 0.141
79 HD21 ASN 9 HD22 ASN 9 7.175 -7.710 -1.057
80 HD22 ASN 9 HD21 ASN 9 8.683 -8.470 -0.657
81 H GLY 10 H GLY 10 10.275 -4.750 1.906
82 HA2 GLY 10 HA2 GLY 10 10.919 -4.614 -0.949
83 HA3 GLY 10 HA3 GLY 10 11.261 -3.165 0.007
84 H LYS 11 H LYS 11 13.351 -3.759 -0.996
85 HA LYS 11 HA LYS 11 14.809 -5.999 0.125
86 HB2 LYS 11 HB2 LYS 11 16.414 -5.642 -1.429
87 HB3 LYS 11 HB3 LYS 11 14.996 -5.058 -2.267
88 HG2 LYS 11 HG2 LYS 11 17.146 -3.318 -0.948
89 HG3 LYS 11 HG3 LYS 11 17.031 -3.740 -2.636
90 HD2 LYS 11 HD2 LYS 11 14.776 -2.574 -2.707
91 HD3 LYS 11 HD3 LYS 11 15.179 -1.905 -1.104
92 HE2 LYS 11 HE2 LYS 11 17.278 -0.940 -2.043
93 HE3 LYS 11 HE3 LYS 11 16.925 -1.705 -3.597
94 HZ1 LYS 11 HZ1 LYS 11 16.197 0.442 -3.897
95 HZ2 LYS 11 HZ2 LYS 11 14.820 -0.329 -3.555
96 HZ3 LYS 11 HZ3 LYS 11 15.501 0.559 -2.385
97 H THR 12 H THR 12 14.373 -2.838 1.398
98 HA THR 12 HA THR 12 16.857 -3.296 3.022
99 HB THR 12 HB THR 12 15.787 -0.573 2.213
100 HG1 THR 12 HG1 THR 12 17.262 -0.459 0.713
101 HG21 THR 12 HG21 THR 12 18.316 -1.512 3.634
102 HG22 THR 12 HG22 THR 12 18.165 0.100 2.919
103 HG23 THR 12 HG23 THR 12 17.080 -0.378 4.223
104 H LEU 13 H LEU 13 13.474 -2.162 3.019
105 HA LEU 13 HA LEU 13 13.357 -2.589 5.871
106 HB2 LEU 13 HB2 LEU 13 12.535 -0.426 6.458
107 HB3 LEU 13 HB3 LEU 13 14.079 -0.229 5.684
108 HG LEU 13 HG LEU 13 12.784 1.550 4.989
109 HD11 LEU 13 HD11 LEU 13 12.575 -0.296 2.608
110 HD12 LEU 13 HD12 LEU 13 12.623 1.477 2.613
111 HD13 LEU 13 HD13 LEU 13 14.046 0.574 3.132
112 HD21 LEU 13 HD21 LEU 13 10.600 1.594 4.102
113 HD22 LEU 13 HD22 LEU 13 10.477 -0.162 4.026
114 HD23 LEU 13 HD23 LEU 13 10.546 0.670 5.603
115 H LYS 14 H LYS 14 11.049 -2.244 6.594
116 HA LYS 14 HA LYS 14 9.029 -2.889 4.509
117 HB2 LYS 14 HB2 LYS 14 9.550 -4.365 7.117
118 HB3 LYS 14 HB3 LYS 14 8.044 -4.486 6.196
119 HG2 LYS 14 HG2 LYS 14 9.204 -5.362 4.248
120 HG3 LYS 14 HG3 LYS 14 10.777 -5.187 5.039
121 HD2 LYS 14 HD2 LYS 14 10.159 -6.787 6.754
122 HD3 LYS 14 HD3 LYS 14 8.508 -6.873 6.145
123 HE2 LYS 14 HE2 LYS 14 10.551 -7.460 4.089
124 HE3 LYS 14 HE3 LYS 14 10.606 -8.582 5.451
125 HZ1 LYS 14 HZ1 LYS 14 9.078 -9.249 3.651
126 HZ2 LYS 14 HZ2 LYS 14 8.296 -9.111 5.097
127 HZ3 LYS 14 HZ3 LYS 14 8.129 -7.944 3.977
128 H GLY 15 H GLY 15 6.780 -2.524 5.407
129 HA2 GLY 15 HA2 GLY 15 6.582 -0.626 7.651
130 HA3 GLY 15 HA3 GLY 15 6.183 -0.013 6.043
131 H GLU 16 H GLU 16 4.292 -0.236 8.175
132 HA GLU 16 HA GLU 16 2.273 -1.869 6.839
133 HB2 GLU 16 HB2 GLU 16 3.465 -3.458 8.414
134 HB3 GLU 16 HB3 GLU 16 2.992 -2.407 9.752
135 HG2 GLU 16 HG2 GLU 16 0.578 -2.726 9.001
136 HG3 GLU 16 HG3 GLU 16 1.165 -3.901 7.830
137 H THR 17 H THR 17 0.500 -0.517 6.781
138 HA THR 17 HA THR 17 -0.244 1.120 9.099
139 HB THR 17 HB THR 17 -0.562 3.048 7.327
140 HG1 THR 17 HG1 THR 17 1.794 1.983 6.251
141 HG21 THR 17 HG21 THR 17 2.253 2.505 8.346
142 HG22 THR 17 HG22 THR 17 1.567 4.058 7.837
143 HG23 THR 17 HG23 THR 17 0.942 3.246 9.281
144 H THR 18 H THR 18 -2.512 2.164 8.588
145 HA THR 18 HA THR 18 -3.998 0.564 6.544
146 HB THR 18 HB THR 18 -5.816 0.428 8.408
147 HG1 THR 18 HG1 THR 18 -4.565 1.716 9.953
148 HG21 THR 18 HG21 THR 18 -3.347 -1.316 8.762
149 HG22 THR 18 HG22 THR 18 -5.037 -1.717 9.164
150 HG23 THR 18 HG23 THR 18 -4.555 -1.503 7.482
151 H THR 19 H THR 19 -5.574 1.752 5.460
152 HA THR 19 HA THR 19 -6.638 4.168 6.610
153 HB THR 19 HB THR 19 -4.925 4.365 4.109
154 HG1 THR 19 HG1 THR 19 -4.263 4.512 6.598
155 HG21 THR 19 HG21 THR 19 -6.618 6.473 5.514
156 HG22 THR 19 HG22 THR 19 -5.427 6.798 4.233
157 HG23 THR 19 HG23 THR 19 -6.864 5.842 3.869
158 H GLU 20 H GLU 20 -8.725 4.656 5.697
159 HA GLU 20 HA GLU 20 -9.662 2.575 3.781
160 HB2 GLU 20 HB2 GLU 20 -11.889 3.092 4.441
161 HB3 GLU 20 HB3 GLU 20 -10.951 2.631 5.860
162 HG2 GLU 20 HG2 GLU 20 -10.843 4.964 6.592
163 HG3 GLU 20 HG3 GLU 20 -11.607 5.513 5.088
164 H ALA 21 H ALA 21 -10.853 3.270 1.963
165 HA ALA 21 HA ALA 21 -10.775 6.105 1.207
166 HB1 ALA 21 HB1 ALA 21 -9.597 5.635 -0.906
167 HB2 ALA 21 HB2 ALA 21 -8.573 5.148 0.451
168 HB3 ALA 21 HB3 ALA 21 -9.456 3.916 -0.482
169 H VAL 22 H VAL 22 -11.807 6.071 -1.233
170 HA VAL 22 HA VAL 22 -14.268 4.411 -0.997
171 HB VAL 22 HB VAL 22 -14.685 6.746 -0.978
172 HG11 VAL 22 HG11 VAL 22 -14.134 8.225 -2.888
173 HG12 VAL 22 HG12 VAL 22 -12.703 7.701 -2.006
174 HG13 VAL 22 HG13 VAL 22 -13.114 6.955 -3.576
175 HG21 VAL 22 HG21 VAL 22 -15.418 5.807 -3.776
176 HG22 VAL 22 HG22 VAL 22 -16.263 5.303 -2.302
177 HG23 VAL 22 HG23 VAL 22 -16.253 7.006 -2.772
178 H ASP 23 H ASP 23 -11.293 4.677 -2.853
179 HA ASP 23 HA ASP 23 -12.126 2.408 -4.456
180 HB2 ASP 23 HB2 ASP 23 -11.838 5.179 -5.550
181 HB3 ASP 23 HB3 ASP 23 -10.834 3.983 -6.359
182 H ALA 24 H ALA 24 -10.278 1.259 -5.213
183 HA ALA 24 HA ALA 24 -8.033 1.350 -3.485
184 HB1 ALA 24 HB1 ALA 24 -8.529 -0.010 -6.152
185 HB2 ALA 24 HB2 ALA 24 -7.058 -0.262 -5.201
186 HB3 ALA 24 HB3 ALA 24 -8.639 -0.716 -4.536
187 H ALA 25 H ALA 25 -8.523 2.694 -6.765
188 HA ALA 25 HA ALA 25 -5.890 3.578 -7.260
189 HB1 ALA 25 HB1 ALA 25 -7.608 3.529 -8.987
190 HB2 ALA 25 HB2 ALA 25 -8.573 4.740 -8.112
191 HB3 ALA 25 HB3 ALA 25 -7.009 5.194 -8.818
192 H THR 26 H THR 26 -8.440 5.029 -5.214
193 HA THR 26 HA THR 26 -7.127 7.606 -4.976
194 HB THR 26 HB THR 26 -9.296 6.237 -3.315
195 HG1 THR 26 HG1 THR 26 -10.661 7.504 -4.601
196 HG21 THR 26 HG21 THR 26 -8.330 7.991 -1.959
197 HG22 THR 26 HG22 THR 26 -8.325 9.118 -3.323
198 HG23 THR 26 HG23 THR 26 -9.867 8.583 -2.609
199 H ALA 27 H ALA 27 -7.250 4.556 -3.072
200 HA ALA 27 HA ALA 27 -5.615 5.449 -0.919
201 HB1 ALA 27 HB1 ALA 27 -6.030 2.636 -2.041
202 HB2 ALA 27 HB2 ALA 27 -5.307 3.058 -0.486
203 HB3 ALA 27 HB3 ALA 27 -7.013 3.428 -0.783
204 H GLU 28 H GLU 28 -4.845 3.804 -3.965
205 HA GLU 28 HA GLU 28 -2.139 3.268 -3.797
206 HB2 GLU 28 HB2 GLU 28 -3.444 2.479 -5.628
207 HB3 GLU 28 HB3 GLU 28 -4.067 4.073 -5.962
208 HG2 GLU 28 HG2 GLU 28 -1.554 4.614 -6.674
209 HG3 GLU 28 HG3 GLU 28 -1.507 2.864 -6.887
210 H LYS 29 H LYS 29 -3.649 6.321 -5.005
211 HA LYS 29 HA LYS 29 -1.089 7.598 -5.339
212 HB2 LYS 29 HB2 LYS 29 -3.186 8.115 -6.610
213 HB3 LYS 29 HB3 LYS 29 -3.825 8.906 -5.157
214 HG2 LYS 29 HG2 LYS 29 -2.051 10.583 -5.226
215 HG3 LYS 29 HG3 LYS 29 -1.156 9.656 -6.437
216 HD2 LYS 29 HD2 LYS 29 -2.252 11.610 -7.443
217 HD3 LYS 29 HD3 LYS 29 -2.845 10.086 -8.117
218 HE2 LYS 29 HE2 LYS 29 -4.762 10.236 -6.407
219 HE3 LYS 29 HE3 LYS 29 -4.221 11.887 -6.069
220 HZ1 LYS 29 HZ1 LYS 29 -5.011 10.875 -8.723
221 HZ2 LYS 29 HZ2 LYS 29 -6.040 11.616 -7.683
222 HZ3 LYS 29 HZ3 LYS 29 -4.780 12.482 -8.286
223 H VAL 30 H VAL 30 -3.450 7.613 -2.615
224 HA VAL 30 HA VAL 30 -2.149 9.792 -1.248
225 HB VAL 30 HB VAL 30 -4.050 7.596 -0.355
226 HG11 VAL 30 HG11 VAL 30 -2.982 9.920 1.312
227 HG12 VAL 30 HG12 VAL 30 -4.353 8.877 1.755
228 HG13 VAL 30 HG13 VAL 30 -2.740 8.192 1.639
229 HG21 VAL 30 HG21 VAL 30 -4.400 10.615 -0.660
230 HG22 VAL 30 HG22 VAL 30 -4.958 9.413 -1.838
231 HG23 VAL 30 HG23 VAL 30 -5.662 9.462 -0.216
232 H PHE 31 H PHE 31 -1.981 6.197 -0.673
233 HA PHE 31 HA PHE 31 0.145 6.491 1.186
234 HB2 PHE 31 HB2 PHE 31 -1.144 4.188 -0.241
235 HB3 PHE 31 HB3 PHE 31 0.441 3.919 0.446
236 HD1 PHE 31 HD2 PHE 31 0.689 5.172 2.940
237 HD2 PHE 31 HD1 PHE 31 -2.822 3.348 1.221
238 HE1 PHE 31 HE2 PHE 31 -0.101 4.608 5.190
239 HE2 PHE 31 HE1 PHE 31 -3.558 2.694 3.509
240 HZ PHE 31 HZ PHE 31 -2.215 3.342 5.490
241 H LYS 32 H LYS 32 0.357 6.841 -2.219
242 HA LYS 32 HA LYS 32 2.915 5.719 -2.721
243 HB2 LYS 32 HB2 LYS 32 1.427 6.621 -4.484
244 HB3 LYS 32 HB3 LYS 32 1.660 8.262 -3.844
245 HG2 LYS 32 HG2 LYS 32 4.064 8.148 -4.334
246 HG3 LYS 32 HG3 LYS 32 3.881 6.474 -4.916
247 HD2 LYS 32 HD2 LYS 32 2.514 7.192 -6.745
248 HD3 LYS 32 HD3 LYS 32 2.372 8.843 -6.101
249 HE2 LYS 32 HE2 LYS 32 4.934 8.973 -6.221
250 HE3 LYS 32 HE3 LYS 32 4.873 7.449 -7.113
251 HZ1 LYS 32 HZ1 LYS 32 3.852 10.080 -7.958
252 HZ2 LYS 32 HZ2 LYS 32 4.907 9.093 -8.719
253 HZ3 LYS 32 HZ3 LYS 32 3.333 8.671 -8.666
254 H GLN 33 H GLN 33 1.943 8.784 -1.220
255 HA GLN 33 HA GLN 33 4.407 10.121 -1.090
256 HB2 GLN 33 HB2 GLN 33 2.175 10.030 1.000
257 HB3 GLN 33 HB3 GLN 33 3.467 11.235 0.900
258 HG2 GLN 33 HG2 GLN 33 2.589 11.946 -1.325
259 HG3 GLN 33 HG3 GLN 33 1.271 10.778 -1.166
260 HE21 GLN 33 HE22 GLN 33 -0.198 12.619 -1.344
261 HE22 GLN 33 HE21 GLN 33 -0.205 13.909 -0.144
262 H TYR 34 H TYR 34 2.926 7.984 1.360
263 HA TYR 34 HA TYR 34 5.080 7.811 3.147
264 HB2 TYR 34 HB2 TYR 34 2.981 7.213 3.920
265 HB3 TYR 34 HB3 TYR 34 2.599 6.248 2.518
266 HD1 TYR 34 HD2 TYR 34 4.682 6.235 5.643
267 HD2 TYR 34 HD1 TYR 34 2.795 3.916 2.527
268 HE1 TYR 34 HE2 TYR 34 4.962 4.190 7.005
269 HE2 TYR 34 HE1 TYR 34 3.034 1.881 3.906
270 HH TYR 34 HH TYR 34 4.427 1.878 7.194
271 H ALA 35 H ALA 35 4.277 5.668 0.346
272 HA ALA 35 HA ALA 35 6.335 3.785 0.843
273 HB1 ALA 35 HB1 ALA 35 6.098 3.175 -1.533
274 HB2 ALA 35 HB2 ALA 35 4.503 3.414 -0.787
275 HB3 ALA 35 HB3 ALA 35 5.190 4.664 -1.849
276 H ASN 36 H ASN 36 6.373 6.630 -1.336
277 HA ASN 36 HA ASN 36 9.094 6.449 -2.090
278 HB2 ASN 36 HB2 ASN 36 7.522 7.824 -3.328
279 HB3 ASN 36 HB3 ASN 36 7.171 8.800 -1.904
280 HD21 ASN 36 HD22 ASN 36 10.535 7.860 -2.945
281 HD22 ASN 36 HD21 ASN 36 10.978 9.488 -3.377
282 H ASP 37 H ASP 37 7.580 8.462 0.500
283 HA ASP 37 HA ASP 37 9.965 9.638 1.426
284 HB2 ASP 37 HB2 ASP 37 7.738 10.484 1.983
285 HB3 ASP 37 HB3 ASP 37 7.377 9.006 2.888
286 H ASN 38 H ASN 38 8.563 6.472 2.220
287 HA ASN 38 HA ASN 38 10.421 6.122 4.434
288 HB2 ASN 38 HB2 ASN 38 8.038 5.235 4.293
289 HB3 ASN 38 HB3 ASN 38 8.675 3.989 3.200
290 HD21 ASN 38 HD22 ASN 38 7.677 2.713 5.107
291 HD22 ASN 38 HD21 ASN 38 8.736 2.392 6.478
292 H GLY 39 H GLY 39 10.827 5.927 1.087
293 HA2 GLY 39 HA2 GLY 39 12.835 5.345 0.038
294 HA3 GLY 39 HA3 GLY 39 13.340 4.428 1.449
295 H VAL 40 H VAL 40 10.161 3.953 -0.284
296 HA VAL 40 HA VAL 40 11.222 1.347 -1.246
297 HB VAL 40 HB VAL 40 8.449 1.830 -0.089
298 HG11 VAL 40 HG11 VAL 40 9.918 -0.756 -0.807
299 HG12 VAL 40 HG12 VAL 40 8.323 -0.669 -0.065
300 HG13 VAL 40 HG13 VAL 40 8.544 -0.066 -1.690
301 HG21 VAL 40 HG21 VAL 40 10.077 2.039 1.745
302 HG22 VAL 40 HG22 VAL 40 9.220 0.524 1.874
303 HG23 VAL 40 HG23 VAL 40 10.864 0.528 1.223
304 H ASP 41 H ASP 41 10.383 0.589 -3.176
305 HA ASP 41 HA ASP 41 8.336 2.011 -4.616
306 HB2 ASP 41 HB2 ASP 41 10.600 3.315 -5.003
307 HB3 ASP 41 HB3 ASP 41 11.029 1.956 -6.034
308 H GLY 42 H GLY 42 7.188 0.130 -5.035
309 HA2 GLY 42 HA2 GLY 42 8.571 -2.018 -6.494
310 HA3 GLY 42 HA3 GLY 42 7.804 -2.418 -4.950
311 H GLU 43 H GLU 43 6.765 -3.847 -6.593
312 HA GLU 43 HA GLU 43 4.710 -2.859 -8.362
313 HB2 GLU 43 HB2 GLU 43 6.208 -4.815 -8.695
314 HB3 GLU 43 HB3 GLU 43 5.444 -5.636 -7.332
315 HG2 GLU 43 HG2 GLU 43 3.308 -5.697 -8.539
316 HG3 GLU 43 HG3 GLU 43 4.006 -4.738 -9.867
317 H TRP 44 H TRP 44 2.820 -2.103 -7.568
318 HA TRP 44 HA TRP 44 1.776 -2.813 -4.935
319 HB2 TRP 44 HB2 TRP 44 0.730 -0.974 -7.135
320 HB3 TRP 44 HB3 TRP 44 0.046 -1.129 -5.531
321 HD1 TRP 44 HD1 TRP 44 3.542 -0.188 -6.924
322 HE1 TRP 44 HE1 TRP 44 4.472 1.788 -5.625
323 HE3 TRP 44 HE3 TRP 44 -0.418 0.604 -3.804
324 HZ2 TRP 44 HZ2 TRP 44 3.649 3.451 -3.432
325 HZ3 TRP 44 HZ3 TRP 44 -0.331 2.428 -2.118
326 HH2 TRP 44 HH2 TRP 44 1.715 3.813 -1.885
327 H THR 45 H THR 45 0.546 -4.702 -4.706
328 HA THR 45 HA THR 45 -1.428 -5.318 -6.882
329 HB THR 45 HB THR 45 0.150 -7.317 -5.243
330 HG1 THR 45 HG1 THR 45 1.312 -6.364 -6.950
331 HG21 THR 45 HG21 THR 45 -1.879 -7.786 -7.462
332 HG22 THR 45 HG22 THR 45 -0.900 -9.023 -6.679
333 HG23 THR 45 HG23 THR 45 -2.124 -8.163 -5.743
334 H TYR 46 H TYR 46 -3.453 -5.164 -6.174
335 HA TYR 46 HA TYR 46 -3.982 -5.052 -3.273
336 HB2 TYR 46 HB2 TYR 46 -6.052 -4.094 -3.791
337 HB3 TYR 46 HB3 TYR 46 -4.924 -3.323 -4.888
338 HD1 TYR 46 HD1 TYR 46 -4.807 -4.141 -7.323
339 HD2 TYR 46 HD2 TYR 46 -7.952 -5.300 -4.603
340 HE1 TYR 46 HE1 TYR 46 -6.162 -4.940 -9.234
341 HE2 TYR 46 HE2 TYR 46 -9.314 -6.088 -6.504
342 HH TYR 46 HH TYR 46 -9.472 -6.246 -8.826
343 H ASP 47 H ASP 47 -5.457 -6.460 -2.278
344 HA ASP 47 HA ASP 47 -6.478 -8.811 -3.744
345 HB2 ASP 47 HB2 ASP 47 -4.312 -9.530 -2.869
346 HB3 ASP 47 HB3 ASP 47 -4.687 -8.870 -1.276
347 H ASP 48 H ASP 48 -8.408 -7.576 -3.553
348 HA ASP 48 HA ASP 48 -9.283 -6.440 -1.072
349 HB2 ASP 48 HB2 ASP 48 -11.097 -5.671 -2.147
350 HB3 ASP 48 HB3 ASP 48 -10.009 -5.848 -3.513
351 H ALA 49 H ALA 49 -9.473 -9.693 -2.329
352 HA ALA 49 HA ALA 49 -11.710 -10.565 -0.724
353 HB1 ALA 49 HB1 ALA 49 -9.403 -12.208 -1.853
354 HB2 ALA 49 HB2 ALA 49 -10.948 -12.828 -1.246
355 HB3 ALA 49 HB3 ALA 49 -10.919 -11.832 -2.714
356 H THR 50 H THR 50 -8.084 -10.789 -0.352
357 HA THR 50 HA THR 50 -8.359 -11.684 2.382
358 HB THR 50 HB THR 50 -5.897 -10.589 0.983
359 HG1 THR 50 HG1 THR 50 -5.860 -12.304 -0.094
360 HG21 THR 50 HG21 THR 50 -5.513 -10.940 3.406
361 HG22 THR 50 HG22 THR 50 -6.143 -12.602 3.268
362 HG23 THR 50 HG23 THR 50 -4.643 -12.135 2.443
363 H LYS 51 H LYS 51 -8.415 -8.645 0.818
364 HA LYS 51 HA LYS 51 -8.814 -6.555 1.445
365 HB2 LYS 51 HB2 LYS 51 -10.105 -7.910 3.334
366 HB3 LYS 51 HB3 LYS 51 -8.892 -7.176 4.384
367 HG2 LYS 51 HG2 LYS 51 -9.562 -4.933 3.515
368 HG3 LYS 51 HG3 LYS 51 -10.782 -5.705 2.484
369 HD2 LYS 51 HD2 LYS 51 -10.692 -5.805 5.523
370 HD3 LYS 51 HD3 LYS 51 -11.734 -4.768 4.536
371 HE2 LYS 51 HE2 LYS 51 -12.887 -6.720 3.626
372 HE3 LYS 51 HE3 LYS 51 -11.808 -7.817 4.501
373 HZ1 LYS 51 HZ1 LYS 51 -14.030 -7.281 5.566
374 HZ2 LYS 51 HZ2 LYS 51 -12.714 -7.166 6.538
375 HZ3 LYS 51 HZ3 LYS 51 -13.432 -5.813 5.920
376 H THR 52 H THR 52 -6.266 -7.373 0.887
377 HA THR 52 HA THR 52 -4.592 -5.581 2.586
378 HB THR 52 HB THR 52 -2.764 -7.310 2.145
379 HG1 THR 52 HG1 THR 52 -4.043 -8.402 0.470
380 HG21 THR 52 HG21 THR 52 -3.893 -7.180 4.344
381 HG22 THR 52 HG22 THR 52 -5.163 -8.285 3.779
382 HG23 THR 52 HG23 THR 52 -3.499 -8.856 3.923
383 H PHE 53 H PHE 53 -2.803 -4.519 1.457
384 HA PHE 53 HA PHE 53 -2.743 -4.782 -1.478
385 HB2 PHE 53 HB2 PHE 53 -4.360 -2.946 -0.481
386 HB3 PHE 53 HB3 PHE 53 -2.897 -2.061 -0.135
387 HD1 PHE 53 HD2 PHE 53 -1.678 -3.251 -3.036
388 HD2 PHE 53 HD1 PHE 53 -5.143 -1.029 -1.723
389 HE1 PHE 53 HE2 PHE 53 -1.863 -2.187 -5.258
390 HE2 PHE 53 HE1 PHE 53 -5.220 0.126 -3.913
391 HZ PHE 53 HZ PHE 53 -3.580 -0.457 -5.693
392 H THR 54 H THR 54 -0.676 -5.638 -1.495
393 HA THR 54 HA THR 54 1.389 -4.431 0.215
394 HB THR 54 HB THR 54 1.632 -6.974 -1.366
395 HG1 THR 54 HG1 THR 54 -0.053 -7.371 -0.182
396 HG21 THR 54 HG21 THR 54 3.226 -7.597 0.458
397 HG22 THR 54 HG22 THR 54 3.753 -6.236 -0.536
398 HG23 THR 54 HG23 THR 54 3.102 -5.941 1.081
399 H VAL 55 H VAL 55 3.242 -3.572 -0.538
400 HA VAL 55 HA VAL 55 3.523 -3.067 -3.464
401 HB VAL 55 HB VAL 55 4.792 -1.596 -1.088
402 HG11 VAL 55 HG11 VAL 55 6.106 -1.475 -3.160
403 HG12 VAL 55 HG12 VAL 55 4.672 -0.945 -4.066
404 HG13 VAL 55 HG13 VAL 55 5.375 0.097 -2.807
405 HG21 VAL 55 HG21 VAL 55 2.355 -0.863 -2.734
406 HG22 VAL 55 HG22 VAL 55 2.454 -1.100 -0.964
407 HG23 VAL 55 HG23 VAL 55 3.243 0.290 -1.713
408 H THR 56 H THR 56 4.914 -4.681 -4.229
409 HA THR 56 HA THR 56 6.892 -5.887 -2.362
410 HB THR 56 HB THR 56 5.720 -6.879 -4.994
411 HG1 THR 56 HG1 THR 56 4.599 -8.259 -3.828
412 HG21 THR 56 HG21 THR 56 7.536 -8.340 -3.018
413 HG22 THR 56 HG22 THR 56 6.777 -9.028 -4.464
414 HG23 THR 56 HG23 THR 56 8.008 -7.772 -4.630
415 H GLU 57 H GLU 57 8.830 -4.852 -2.521
416 HA GLU 57 HA GLU 57 9.792 -3.963 -5.198
417 HB2 GLU 57 HB2 GLU 57 9.722 -2.136 -3.644
418 HB3 GLU 57 HB3 GLU 57 10.456 -3.084 -2.361
419 HG2 GLU 57 HG2 GLU 57 12.555 -3.244 -3.535
420 HG3 GLU 57 HG3 GLU 57 11.871 -2.531 -5.000
Start of MODEL 3
1 H1 MET 1 H MET 1 -16.057 2.347 -1.080
2 HA MET 1 HA MET 1 -14.274 2.746 0.381
3 HB2 MET 1 HB2 MET 1 -16.248 4.259 0.766
4 HB3 MET 1 HB3 MET 1 -16.760 3.180 2.069
5 HG2 MET 1 HG2 MET 1 -14.442 3.603 3.124
6 HG3 MET 1 HG3 MET 1 -14.267 4.895 1.940
7 HE1 MET 1 HE1 MET 1 -17.324 7.225 3.030
8 HE2 MET 1 HE2 MET 1 -16.131 6.907 1.750
9 HE3 MET 1 HE3 MET 1 -17.521 5.812 1.989
10 H GLY 2 H GLY 2 -12.845 1.776 1.746
11 HA2 GLY 2 HA2 GLY 2 -13.739 0.178 3.977
12 HA3 GLY 2 HA3 GLY 2 -13.026 -0.789 2.663
13 H THR 3 H THR 3 -11.749 -0.953 4.965
14 HA THR 3 HA THR 3 -9.596 1.054 5.118
15 HB THR 3 HB THR 3 -10.006 -1.409 6.837
16 HG1 THR 3 HG1 THR 3 -10.996 1.002 7.766
17 HG21 THR 3 HG21 THR 3 -7.864 -0.181 7.071
18 HG22 THR 3 HG22 THR 3 -8.754 1.317 7.420
19 HG23 THR 3 HG23 THR 3 -8.850 -0.068 8.538
20 H TYR 4 H TYR 4 -7.839 0.705 3.843
21 HA TYR 4 HA TYR 4 -7.316 -2.010 2.783
22 HB2 TYR 4 HB2 TYR 4 -6.242 0.753 2.105
23 HB3 TYR 4 HB3 TYR 4 -5.698 -0.743 1.350
24 HD1 TYR 4 HD2 TYR 4 -8.585 1.589 1.734
25 HD2 TYR 4 HD1 TYR 4 -7.056 -1.904 -0.306
26 HE1 TYR 4 HE2 TYR 4 -10.468 1.700 0.141
27 HE2 TYR 4 HE1 TYR 4 -8.915 -1.774 -1.921
28 HH TYR 4 HH TYR 4 -11.618 0.472 -1.474
29 H LYS 5 H LYS 5 -5.565 -3.139 3.330
30 HA LYS 5 HA LYS 5 -3.869 -2.215 5.586
31 HB2 LYS 5 HB2 LYS 5 -4.248 -4.948 4.309
32 HB3 LYS 5 HB3 LYS 5 -3.263 -4.620 5.736
33 HG2 LYS 5 HG2 LYS 5 -5.201 -4.123 7.075
34 HG3 LYS 5 HG3 LYS 5 -6.262 -4.042 5.655
35 HD2 LYS 5 HD2 LYS 5 -5.860 -6.419 5.175
36 HD3 LYS 5 HD3 LYS 5 -4.835 -6.544 6.621
37 HE2 LYS 5 HE2 LYS 5 -6.718 -5.976 8.062
38 HE3 LYS 5 HE3 LYS 5 -7.753 -5.646 6.658
39 HZ1 LYS 5 HZ1 LYS 5 -8.067 -7.854 7.701
40 HZ2 LYS 5 HZ2 LYS 5 -7.742 -7.921 6.094
41 HZ3 LYS 5 HZ3 LYS 5 -6.557 -8.277 7.181
42 H LEU 6 H LEU 6 -2.121 -1.095 4.908
43 HA LEU 6 HA LEU 6 -0.951 -1.675 2.284
44 HB2 LEU 6 HB2 LEU 6 -1.488 0.662 3.457
45 HB3 LEU 6 HB3 LEU 6 0.023 0.376 4.277
46 HG LEU 6 HG LEU 6 -0.574 1.179 1.500
47 HD11 LEU 6 HD11 LEU 6 1.529 2.447 1.790
48 HD12 LEU 6 HD12 LEU 6 0.463 2.642 3.198
49 HD13 LEU 6 HD13 LEU 6 1.850 1.553 3.294
50 HD21 LEU 6 HD21 LEU 6 1.572 0.415 0.523
51 HD22 LEU 6 HD22 LEU 6 1.699 -0.751 1.850
52 HD23 LEU 6 HD23 LEU 6 0.349 -0.826 0.706
53 H ILE 7 H ILE 7 0.835 -3.047 2.169
54 HA ILE 7 HA ILE 7 2.540 -3.395 4.594
55 HB ILE 7 HB ILE 7 1.649 -5.549 2.636
56 HG12 ILE 7 HG12 ILE 7 1.114 -6.768 4.838
57 HG13 ILE 7 HG13 ILE 7 1.258 -5.222 5.643
58 HG21 ILE 7 HG21 ILE 7 4.072 -5.784 3.131
59 HG22 ILE 7 HG22 ILE 7 3.731 -5.695 4.871
60 HG23 ILE 7 HG23 ILE 7 3.154 -7.068 3.896
61 HD11 ILE 7 HD11 ILE 7 -0.718 -4.403 4.582
62 HD12 ILE 7 HD12 ILE 7 -0.687 -5.680 3.339
63 HD13 ILE 7 HD13 ILE 7 -1.087 -6.061 5.031
64 H LEU 8 H LEU 8 4.524 -2.710 4.213
65 HA LEU 8 HA LEU 8 5.457 -2.205 1.412
66 HB2 LEU 8 HB2 LEU 8 5.924 -0.926 4.103
67 HB3 LEU 8 HB3 LEU 8 7.260 -0.952 2.976
68 HG LEU 8 HG LEU 8 6.107 0.390 1.364
69 HD11 LEU 8 HD11 LEU 8 3.635 0.069 3.084
70 HD12 LEU 8 HD12 LEU 8 3.794 1.209 1.716
71 HD13 LEU 8 HD13 LEU 8 3.893 -0.521 1.420
72 HD21 LEU 8 HD21 LEU 8 7.045 1.770 3.058
73 HD22 LEU 8 HD22 LEU 8 5.403 2.399 2.845
74 HD23 LEU 8 HD23 LEU 8 5.770 1.369 4.225
75 H ASN 9 H ASN 9 6.665 -3.870 0.690
76 HA ASN 9 HA ASN 9 8.462 -5.325 2.579
77 HB2 ASN 9 HB2 ASN 9 6.490 -6.647 1.780
78 HB3 ASN 9 HB3 ASN 9 6.986 -6.364 0.114
79 HD21 ASN 9 HD22 ASN 9 9.469 -7.086 -0.323
80 HD22 ASN 9 HD21 ASN 9 9.765 -8.679 0.277
81 H GLY 10 H GLY 10 9.907 -3.533 2.153
82 HA2 GLY 10 HA2 GLY 10 10.722 -2.872 -0.546
83 HA3 GLY 10 HA3 GLY 10 11.345 -2.239 0.984
84 H LYS 11 H LYS 11 13.248 -2.567 -0.675
85 HA LYS 11 HA LYS 11 14.353 -5.304 -0.552
86 HB2 LYS 11 HB2 LYS 11 16.037 -4.643 -2.044
87 HB3 LYS 11 HB3 LYS 11 14.506 -4.057 -2.675
88 HG2 LYS 11 HG2 LYS 11 16.230 -2.158 -1.041
89 HG3 LYS 11 HG3 LYS 11 16.754 -2.577 -2.678
90 HD2 LYS 11 HD2 LYS 11 14.875 -1.612 -3.697
91 HD3 LYS 11 HD3 LYS 11 13.938 -1.638 -2.207
92 HE2 LYS 11 HE2 LYS 11 15.595 0.055 -1.243
93 HE3 LYS 11 HE3 LYS 11 16.293 0.171 -2.858
94 HZ1 LYS 11 HZ1 LYS 11 13.531 0.885 -2.085
95 HZ2 LYS 11 HZ2 LYS 11 14.697 1.920 -2.642
96 HZ3 LYS 11 HZ3 LYS 11 14.002 0.783 -3.611
97 H THR 12 H THR 12 14.433 -2.693 1.511
98 HA THR 12 HA THR 12 16.809 -3.808 2.889
99 HB THR 12 HB THR 12 16.481 -0.796 2.546
100 HG1 THR 12 HG1 THR 12 18.258 -0.998 1.069
101 HG21 THR 12 HG21 THR 12 18.914 -0.781 3.129
102 HG22 THR 12 HG22 THR 12 17.920 -1.428 4.422
103 HG23 THR 12 HG23 THR 12 18.843 -2.533 3.381
104 H LEU 13 H LEU 13 13.628 -2.228 3.087
105 HA LEU 13 HA LEU 13 13.586 -2.691 5.957
106 HB2 LEU 13 HB2 LEU 13 12.943 -0.477 6.540
107 HB3 LEU 13 HB3 LEU 13 14.442 -0.380 5.671
108 HG LEU 13 HG LEU 13 13.200 1.463 5.028
109 HD11 LEU 13 HD11 LEU 13 12.720 -0.391 2.676
110 HD12 LEU 13 HD12 LEU 13 12.866 1.372 2.660
111 HD13 LEU 13 HD13 LEU 13 14.276 0.393 3.080
112 HD21 LEU 13 HD21 LEU 13 10.984 1.630 4.337
113 HD22 LEU 13 HD22 LEU 13 10.773 -0.128 4.208
114 HD23 LEU 13 HD23 LEU 13 10.983 0.641 5.808
115 H LYS 14 H LYS 14 11.298 -2.253 6.796
116 HA LYS 14 HA LYS 14 9.211 -2.787 4.745
117 HB2 LYS 14 HB2 LYS 14 9.695 -4.278 7.365
118 HB3 LYS 14 HB3 LYS 14 8.211 -4.379 6.411
119 HG2 LYS 14 HG2 LYS 14 9.586 -5.136 4.441
120 HG3 LYS 14 HG3 LYS 14 10.988 -5.278 5.527
121 HD2 LYS 14 HD2 LYS 14 9.873 -6.936 6.879
122 HD3 LYS 14 HD3 LYS 14 8.307 -6.585 6.127
123 HE2 LYS 14 HE2 LYS 14 9.287 -7.335 3.912
124 HE3 LYS 14 HE3 LYS 14 10.693 -7.928 4.812
125 HZ1 LYS 14 HZ1 LYS 14 9.076 -9.635 4.454
126 HZ2 LYS 14 HZ2 LYS 14 9.158 -9.320 6.073
127 HZ3 LYS 14 HZ3 LYS 14 7.881 -8.773 5.190
128 H GLY 15 H GLY 15 6.953 -2.510 5.612
129 HA2 GLY 15 HA2 GLY 15 6.611 -0.818 7.977
130 HA3 GLY 15 HA3 GLY 15 6.286 -0.050 6.424
131 H GLU 16 H GLU 16 4.266 -0.519 8.426
132 HA GLU 16 HA GLU 16 2.356 -2.036 6.784
133 HB2 GLU 16 HB2 GLU 16 3.386 -3.730 8.368
134 HB3 GLU 16 HB3 GLU 16 2.832 -2.731 9.721
135 HG2 GLU 16 HG2 GLU 16 0.459 -2.952 8.600
136 HG3 GLU 16 HG3 GLU 16 1.188 -4.209 7.631
137 H THR 17 H THR 17 0.649 -0.546 6.631
138 HA THR 17 HA THR 17 -0.247 0.859 9.080
139 HB THR 17 HB THR 17 -0.466 2.936 7.554
140 HG1 THR 17 HG1 THR 17 1.379 2.960 6.056
141 HG21 THR 17 HG21 THR 17 1.186 2.745 9.422
142 HG22 THR 17 HG22 THR 17 2.370 2.100 8.267
143 HG23 THR 17 HG23 THR 17 1.747 3.747 8.073
144 H THR 18 H THR 18 -2.463 1.944 8.691
145 HA THR 18 HA THR 18 -3.978 0.547 6.564
146 HB THR 18 HB THR 18 -5.818 0.149 8.196
147 HG1 THR 18 HG1 THR 18 -5.371 1.330 9.898
148 HG21 THR 18 HG21 THR 18 -3.280 -1.367 8.914
149 HG22 THR 18 HG22 THR 18 -4.970 -1.905 9.105
150 HG23 THR 18 HG23 THR 18 -4.300 -1.677 7.498
151 H THR 19 H THR 19 -5.459 1.807 5.571
152 HA THR 19 HA THR 19 -6.247 4.408 6.714
153 HB THR 19 HB THR 19 -4.961 4.046 3.972
154 HG1 THR 19 HG1 THR 19 -3.938 5.160 6.381
155 HG21 THR 19 HG21 THR 19 -5.752 6.605 5.385
156 HG22 THR 19 HG22 THR 19 -4.913 6.490 3.834
157 HG23 THR 19 HG23 THR 19 -6.576 5.905 3.980
158 H GLU 20 H GLU 20 -8.367 4.953 6.014
159 HA GLU 20 HA GLU 20 -9.633 2.914 4.284
160 HB2 GLU 20 HB2 GLU 20 -11.744 3.537 5.213
161 HB3 GLU 20 HB3 GLU 20 -10.619 3.129 6.495
162 HG2 GLU 20 HG2 GLU 20 -10.232 5.650 6.791
163 HG3 GLU 20 HG3 GLU 20 -11.572 5.897 5.673
164 H ALA 21 H ALA 21 -10.721 3.483 2.414
165 HA ALA 21 HA ALA 21 -10.658 6.304 1.596
166 HB1 ALA 21 HB1 ALA 21 -8.453 5.336 0.869
167 HB2 ALA 21 HB2 ALA 21 -9.343 4.090 -0.040
168 HB3 ALA 21 HB3 ALA 21 -9.481 5.796 -0.499
169 H VAL 22 H VAL 22 -11.890 6.653 -0.401
170 HA VAL 22 HA VAL 22 -14.378 5.273 -0.304
171 HB VAL 22 HB VAL 22 -14.250 7.577 -0.912
172 HG11 VAL 22 HG11 VAL 22 -13.413 8.443 -3.022
173 HG12 VAL 22 HG12 VAL 22 -12.092 7.674 -2.145
174 HG13 VAL 22 HG13 VAL 22 -12.858 6.844 -3.518
175 HG21 VAL 22 HG21 VAL 22 -15.279 5.925 -3.256
176 HG22 VAL 22 HG22 VAL 22 -16.160 6.290 -1.757
177 HG23 VAL 22 HG23 VAL 22 -15.731 7.588 -2.891
178 H ASP 23 H ASP 23 -11.639 5.017 -2.683
179 HA ASP 23 HA ASP 23 -12.519 2.294 -3.377
180 HB2 ASP 23 HB2 ASP 23 -12.208 4.612 -5.315
181 HB3 ASP 23 HB3 ASP 23 -12.022 2.934 -5.810
182 H ALA 24 H ALA 24 -10.767 1.235 -4.621
183 HA ALA 24 HA ALA 24 -8.324 1.375 -3.245
184 HB1 ALA 24 HB1 ALA 24 -7.458 -0.052 -5.198
185 HB2 ALA 24 HB2 ALA 24 -8.826 -0.679 -4.285
186 HB3 ALA 24 HB3 ALA 24 -9.083 0.093 -5.880
187 H ALA 25 H ALA 25 -9.200 3.098 -6.285
188 HA ALA 25 HA ALA 25 -6.535 3.746 -7.004
189 HB1 ALA 25 HB1 ALA 25 -8.440 4.090 -8.507
190 HB2 ALA 25 HB2 ALA 25 -9.089 5.364 -7.442
191 HB3 ALA 25 HB3 ALA 25 -7.531 5.593 -8.288
192 H THR 26 H THR 26 -8.862 5.578 -4.882
193 HA THR 26 HA THR 26 -7.074 7.682 -4.283
194 HB THR 26 HB THR 26 -9.303 6.529 -2.563
195 HG1 THR 26 HG1 THR 26 -9.673 8.534 -4.507
196 HG21 THR 26 HG21 THR 26 -8.086 8.292 -1.409
197 HG22 THR 26 HG22 THR 26 -8.146 9.336 -2.835
198 HG23 THR 26 HG23 THR 26 -9.642 8.949 -1.955
199 H ALA 27 H ALA 27 -7.560 4.437 -2.874
200 HA ALA 27 HA ALA 27 -5.994 4.831 -0.530
201 HB1 ALA 27 HB1 ALA 27 -6.395 2.200 -2.016
202 HB2 ALA 27 HB2 ALA 27 -5.994 2.441 -0.311
203 HB3 ALA 27 HB3 ALA 27 -7.584 2.919 -0.917
204 H GLU 28 H GLU 28 -5.189 3.219 -3.609
205 HA GLU 28 HA GLU 28 -2.507 2.704 -3.334
206 HB2 GLU 28 HB2 GLU 28 -4.154 1.940 -5.076
207 HB3 GLU 28 HB3 GLU 28 -3.998 3.498 -5.868
208 HG2 GLU 28 HG2 GLU 28 -1.607 3.094 -6.244
209 HG3 GLU 28 HG3 GLU 28 -1.696 1.551 -5.373
210 H LYS 29 H LYS 29 -3.922 5.624 -4.928
211 HA LYS 29 HA LYS 29 -1.461 6.821 -5.591
212 HB2 LYS 29 HB2 LYS 29 -4.146 8.125 -4.952
213 HB3 LYS 29 HB3 LYS 29 -2.709 8.984 -5.534
214 HG2 LYS 29 HG2 LYS 29 -2.678 7.428 -7.533
215 HG3 LYS 29 HG3 LYS 29 -4.252 6.833 -7.027
216 HD2 LYS 29 HD2 LYS 29 -4.814 8.529 -8.566
217 HD3 LYS 29 HD3 LYS 29 -5.002 9.321 -7.006
218 HE2 LYS 29 HE2 LYS 29 -3.794 10.874 -8.355
219 HE3 LYS 29 HE3 LYS 29 -2.606 10.174 -7.270
220 HZ1 LYS 29 HZ1 LYS 29 -2.039 8.623 -9.133
221 HZ2 LYS 29 HZ2 LYS 29 -2.997 9.502 -10.114
222 HZ3 LYS 29 HZ3 LYS 29 -1.674 10.194 -9.424
223 H VAL 30 H VAL 30 -3.497 7.594 -2.713
224 HA VAL 30 HA VAL 30 -1.641 9.355 -1.522
225 HB VAL 30 HB VAL 30 -3.864 7.637 -0.376
226 HG11 VAL 30 HG11 VAL 30 -3.863 9.203 1.566
227 HG12 VAL 30 HG12 VAL 30 -2.401 8.223 1.492
228 HG13 VAL 30 HG13 VAL 30 -2.348 9.916 0.959
229 HG21 VAL 30 HG21 VAL 30 -5.151 9.754 -0.410
230 HG22 VAL 30 HG22 VAL 30 -3.757 10.607 -1.099
231 HG23 VAL 30 HG23 VAL 30 -4.596 9.355 -2.034
232 H PHE 31 H PHE 31 -2.020 5.756 -1.115
233 HA PHE 31 HA PHE 31 -0.091 5.507 0.909
234 HB2 PHE 31 HB2 PHE 31 -0.900 3.617 -1.328
235 HB3 PHE 31 HB3 PHE 31 0.229 3.174 -0.061
236 HD1 PHE 31 HD2 PHE 31 -1.083 4.359 2.398
237 HD2 PHE 31 HD1 PHE 31 -2.606 2.024 -0.904
238 HE1 PHE 31 HE2 PHE 31 -2.692 3.276 3.891
239 HE2 PHE 31 HE1 PHE 31 -4.266 1.001 0.594
240 HZ PHE 31 HZ PHE 31 -4.320 1.628 3.018
241 H LYS 32 H LYS 32 0.480 5.986 -2.592
242 HA LYS 32 HA LYS 32 3.187 5.094 -2.528
243 HB2 LYS 32 HB2 LYS 32 1.632 5.902 -4.585
244 HB3 LYS 32 HB3 LYS 32 2.490 7.420 -4.305
245 HG2 LYS 32 HG2 LYS 32 4.666 6.080 -4.340
246 HG3 LYS 32 HG3 LYS 32 3.714 4.669 -4.839
247 HD2 LYS 32 HD2 LYS 32 3.016 5.900 -6.880
248 HD3 LYS 32 HD3 LYS 32 3.984 7.291 -6.337
249 HE2 LYS 32 HE2 LYS 32 5.948 5.542 -6.185
250 HE3 LYS 32 HE3 LYS 32 4.928 4.539 -7.207
251 HZ1 LYS 32 HZ1 LYS 32 6.080 7.181 -7.851
252 HZ2 LYS 32 HZ2 LYS 32 6.335 5.765 -8.614
253 HZ3 LYS 32 HZ3 LYS 32 4.900 6.495 -8.790
254 H GLN 33 H GLN 33 1.712 8.123 -1.450
255 HA GLN 33 HA GLN 33 4.029 9.739 -1.370
256 HB2 GLN 33 HB2 GLN 33 1.687 9.718 0.600
257 HB3 GLN 33 HB3 GLN 33 2.896 10.979 0.420
258 HG2 GLN 33 HG2 GLN 33 2.140 11.397 -1.910
259 HG3 GLN 33 HG3 GLN 33 0.916 10.133 -1.741
260 HE21 GLN 33 HE22 GLN 33 1.980 12.880 0.426
261 HE22 GLN 33 HE21 GLN 33 0.431 13.651 0.466
262 H TYR 34 H TYR 34 2.608 7.626 1.150
263 HA TYR 34 HA TYR 34 4.720 7.936 3.035
264 HB2 TYR 34 HB2 TYR 34 2.542 7.190 3.776
265 HB3 TYR 34 HB3 TYR 34 2.566 5.824 2.664
266 HD1 TYR 34 HD2 TYR 34 5.116 7.115 5.141
267 HD2 TYR 34 HD1 TYR 34 2.641 3.811 3.885
268 HE1 TYR 34 HE2 TYR 34 6.216 5.675 6.788
269 HE2 TYR 34 HE1 TYR 34 3.733 2.349 5.567
270 HH TYR 34 HH TYR 34 5.207 2.433 7.617
271 H ALA 35 H ALA 35 4.036 5.282 0.693
272 HA ALA 35 HA ALA 35 6.221 3.672 1.407
273 HB1 ALA 35 HB1 ALA 35 5.896 2.605 -0.767
274 HB2 ALA 35 HB2 ALA 35 4.326 2.975 -0.041
275 HB3 ALA 35 HB3 ALA 35 4.972 4.012 -1.336
276 H ASN 36 H ASN 36 6.165 6.110 -1.286
277 HA ASN 36 HA ASN 36 8.947 5.739 -1.715
278 HB2 ASN 36 HB2 ASN 36 7.175 6.776 -3.308
279 HB3 ASN 36 HB3 ASN 36 7.581 8.309 -2.516
280 HD21 ASN 36 HD22 ASN 36 9.450 9.363 -3.460
281 HD22 ASN 36 HD21 ASN 36 10.687 8.475 -4.342
282 H ASP 37 H ASP 37 7.254 7.786 0.627
283 HA ASP 37 HA ASP 37 9.527 9.524 1.189
284 HB2 ASP 37 HB2 ASP 37 7.219 10.188 1.739
285 HB3 ASP 37 HB3 ASP 37 7.116 8.865 2.921
286 H ASN 38 H ASN 38 8.596 6.286 2.042
287 HA ASN 38 HA ASN 38 10.591 6.158 4.221
288 HB2 ASN 38 HB2 ASN 38 8.092 5.353 4.340
289 HB3 ASN 38 HB3 ASN 38 8.699 3.925 3.491
290 HD21 ASN 38 HD22 ASN 38 7.562 3.591 6.029
291 HD22 ASN 38 HD21 ASN 38 8.849 3.151 7.131
292 H GLY 39 H GLY 39 10.720 5.836 0.939
293 HA2 GLY 39 HA2 GLY 39 12.474 5.040 -0.333
294 HA3 GLY 39 HA3 GLY 39 13.142 4.218 1.077
295 H VAL 40 H VAL 40 9.771 3.616 0.005
296 HA VAL 40 HA VAL 40 10.615 0.964 -1.036
297 HB VAL 40 HB VAL 40 8.104 1.568 0.568
298 HG11 VAL 40 HG11 VAL 40 7.757 -0.246 -1.034
299 HG12 VAL 40 HG12 VAL 40 9.287 -1.010 -0.578
300 HG13 VAL 40 HG13 VAL 40 7.936 -0.963 0.568
301 HG21 VAL 40 HG21 VAL 40 9.133 0.150 2.331
302 HG22 VAL 40 HG22 VAL 40 10.644 0.100 1.403
303 HG23 VAL 40 HG23 VAL 40 10.044 1.635 2.069
304 H ASP 41 H ASP 41 10.137 0.735 -3.133
305 HA ASP 41 HA ASP 41 7.637 1.791 -4.203
306 HB2 ASP 41 HB2 ASP 41 9.131 3.781 -4.319
307 HB3 ASP 41 HB3 ASP 41 10.286 2.844 -5.265
308 H GLY 42 H GLY 42 7.085 -0.226 -4.766
309 HA2 GLY 42 HA2 GLY 42 8.754 -1.702 -6.734
310 HA3 GLY 42 HA3 GLY 42 8.006 -2.497 -5.340
311 H GLU 43 H GLU 43 6.810 -3.828 -6.749
312 HA GLU 43 HA GLU 43 4.922 -2.644 -8.646
313 HB2 GLU 43 HB2 GLU 43 6.209 -4.855 -8.955
314 HB3 GLU 43 HB3 GLU 43 5.147 -5.554 -7.729
315 HG2 GLU 43 HG2 GLU 43 4.372 -6.056 -10.021
316 HG3 GLU 43 HG3 GLU 43 3.184 -5.084 -9.140
317 H TRP 44 H TRP 44 2.878 -2.094 -8.110
318 HA TRP 44 HA TRP 44 1.918 -2.534 -5.337
319 HB2 TRP 44 HB2 TRP 44 1.073 -0.655 -7.582
320 HB3 TRP 44 HB3 TRP 44 0.179 -0.834 -6.083
321 HD1 TRP 44 HD1 TRP 44 3.662 0.290 -7.277
322 HE1 TRP 44 HE1 TRP 44 4.605 1.982 -5.641
323 HE3 TRP 44 HE3 TRP 44 -0.069 0.146 -3.783
324 HZ2 TRP 44 HZ2 TRP 44 3.936 2.993 -3.019
325 HZ3 TRP 44 HZ3 TRP 44 0.132 1.439 -1.686
326 HH2 TRP 44 HH2 TRP 44 2.153 2.868 -1.282
327 H THR 45 H THR 45 0.668 -4.358 -5.071
328 HA THR 45 HA THR 45 -1.483 -4.800 -7.088
329 HB THR 45 HB THR 45 0.067 -7.076 -5.834
330 HG1 THR 45 HG1 THR 45 1.236 -7.168 -7.735
331 HG21 THR 45 HG21 THR 45 -1.710 -6.940 -8.285
332 HG22 THR 45 HG22 THR 45 -0.851 -8.372 -7.682
333 HG23 THR 45 HG23 THR 45 -2.150 -7.656 -6.719
334 H TYR 46 H TYR 46 -3.477 -5.382 -6.192
335 HA TYR 46 HA TYR 46 -3.716 -5.360 -3.253
336 HB2 TYR 46 HB2 TYR 46 -5.785 -4.107 -3.528
337 HB3 TYR 46 HB3 TYR 46 -4.448 -3.233 -4.242
338 HD1 TYR 46 HD1 TYR 46 -4.278 -2.933 -6.714
339 HD2 TYR 46 HD2 TYR 46 -7.556 -5.131 -4.936
340 HE1 TYR 46 HE1 TYR 46 -5.340 -3.159 -8.932
341 HE2 TYR 46 HE2 TYR 46 -8.618 -5.336 -7.153
342 HH TYR 46 HH TYR 46 -7.088 -5.227 -9.823
343 H ASP 47 H ASP 47 -5.418 -6.575 -2.369
344 HA ASP 47 HA ASP 47 -6.787 -8.547 -4.162
345 HB2 ASP 47 HB2 ASP 47 -5.179 -9.095 -1.640
346 HB3 ASP 47 HB3 ASP 47 -6.437 -10.190 -2.229
347 H ASP 48 H ASP 48 -9.004 -8.414 -3.716
348 HA ASP 48 HA ASP 48 -9.853 -6.707 -1.530
349 HB2 ASP 48 HB2 ASP 48 -11.872 -6.583 -2.453
350 HB3 ASP 48 HB3 ASP 48 -10.983 -7.084 -3.883
351 H ALA 49 H ALA 49 -9.743 -10.266 -1.958
352 HA ALA 49 HA ALA 49 -11.469 -11.001 0.127
353 HB1 ALA 49 HB1 ALA 49 -8.861 -12.357 -0.703
354 HB2 ALA 49 HB2 ALA 49 -10.165 -13.095 0.243
355 HB3 ALA 49 HB3 ALA 49 -10.458 -12.631 -1.432
356 H THR 50 H THR 50 -7.963 -10.205 0.293
357 HA THR 50 HA THR 50 -7.967 -10.371 3.224
358 HB THR 50 HB THR 50 -5.466 -9.908 2.681
359 HG1 THR 50 HG1 THR 50 -5.054 -9.589 0.653
360 HG21 THR 50 HG21 THR 50 -6.799 -12.432 1.582
361 HG22 THR 50 HG22 THR 50 -5.085 -12.238 1.989
362 HG23 THR 50 HG23 THR 50 -6.306 -12.155 3.272
363 H LYS 51 H LYS 51 -8.305 -7.964 0.705
364 HA LYS 51 HA LYS 51 -8.494 -5.747 0.680
365 HB2 LYS 51 HB2 LYS 51 -8.764 -5.814 3.688
366 HB3 LYS 51 HB3 LYS 51 -9.092 -4.438 2.633
367 HG2 LYS 51 HG2 LYS 51 -10.842 -5.732 1.433
368 HG3 LYS 51 HG3 LYS 51 -10.600 -7.089 2.553
369 HD2 LYS 51 HD2 LYS 51 -11.446 -4.274 3.363
370 HD3 LYS 51 HD3 LYS 51 -12.538 -5.659 3.160
371 HE2 LYS 51 HE2 LYS 51 -11.267 -6.916 4.910
372 HE3 LYS 51 HE3 LYS 51 -10.184 -5.530 5.100
373 HZ1 LYS 51 HZ1 LYS 51 -13.026 -5.670 5.778
374 HZ2 LYS 51 HZ2 LYS 51 -11.729 -5.419 6.773
375 HZ3 LYS 51 HZ3 LYS 51 -12.199 -4.238 5.703
376 H THR 52 H THR 52 -5.932 -7.129 0.804
377 HA THR 52 HA THR 52 -4.138 -5.258 2.160
378 HB THR 52 HB THR 52 -2.433 -6.988 1.290
379 HG1 THR 52 HG1 THR 52 -3.425 -8.181 -0.157
380 HG21 THR 52 HG21 THR 52 -3.105 -6.958 3.628
381 HG22 THR 52 HG22 THR 52 -4.607 -7.832 3.264
382 HG23 THR 52 HG23 THR 52 -3.034 -8.633 3.066
383 H PHE 53 H PHE 53 -2.409 -4.357 1.074
384 HA PHE 53 HA PHE 53 -2.435 -4.002 -1.808
385 HB2 PHE 53 HB2 PHE 53 -3.524 -2.011 -0.062
386 HB3 PHE 53 HB3 PHE 53 -1.882 -1.483 -0.369
387 HD1 PHE 53 HD2 PHE 53 -1.310 -2.191 -3.139
388 HD2 PHE 53 HD1 PHE 53 -4.981 -0.738 -1.383
389 HE1 PHE 53 HE2 PHE 53 -2.065 -1.370 -5.360
390 HE2 PHE 53 HE1 PHE 53 -5.706 0.085 -3.603
391 HZ PHE 53 HZ PHE 53 -4.277 -0.300 -5.597
392 H THR 54 H THR 54 -0.453 -5.075 -1.965
393 HA THR 54 HA THR 54 1.578 -4.398 0.101
394 HB THR 54 HB THR 54 1.329 -7.046 -1.328
395 HG1 THR 54 HG1 THR 54 0.555 -7.789 0.572
396 HG21 THR 54 HG21 THR 54 3.134 -6.093 0.921
397 HG22 THR 54 HG22 THR 54 2.955 -7.773 0.382
398 HG23 THR 54 HG23 THR 54 3.632 -6.568 -0.711
399 H VAL 55 H VAL 55 3.464 -3.702 -0.515
400 HA VAL 55 HA VAL 55 3.978 -3.245 -3.404
401 HB VAL 55 HB VAL 55 5.107 -1.681 -1.038
402 HG11 VAL 55 HG11 VAL 55 6.356 -1.529 -3.160
403 HG12 VAL 55 HG12 VAL 55 4.867 -1.041 -4.014
404 HG13 VAL 55 HG13 VAL 55 5.575 0.017 -2.767
405 HG21 VAL 55 HG21 VAL 55 2.625 -1.043 -2.650
406 HG22 VAL 55 HG22 VAL 55 2.712 -1.344 -0.904
407 HG23 VAL 55 HG23 VAL 55 3.476 0.093 -1.572
408 H THR 56 H THR 56 5.317 -4.895 -4.014
409 HA THR 56 HA THR 56 7.441 -5.776 -2.116
410 HB THR 56 HB THR 56 6.249 -7.304 -4.452
411 HG1 THR 56 HG1 THR 56 4.848 -8.035 -3.160
412 HG21 THR 56 HG21 THR 56 8.528 -8.030 -3.885
413 HG22 THR 56 HG22 THR 56 8.104 -8.119 -2.164
414 HG23 THR 56 HG23 THR 56 7.360 -9.236 -3.314
415 H GLU 57 H GLU 57 9.389 -4.962 -2.590
416 HA GLU 57 HA GLU 57 10.048 -4.141 -5.376
417 HB2 GLU 57 HB2 GLU 57 9.694 -2.246 -3.764
418 HB3 GLU 57 HB3 GLU 57 10.923 -2.953 -2.709
419 HG2 GLU 57 HG2 GLU 57 12.622 -2.691 -4.489
420 HG3 GLU 57 HG3 GLU 57 11.397 -2.019 -5.568
Start of MODEL 4
1 H1 MET 1 H MET 1 -17.719 3.393 2.971
2 HA MET 1 HA MET 1 -16.623 2.027 1.199
3 HB2 MET 1 HB2 MET 1 -14.960 4.001 2.783
4 HB3 MET 1 HB3 MET 1 -14.426 3.308 1.252
5 HG2 MET 1 HG2 MET 1 -16.280 4.155 0.044
6 HG3 MET 1 HG3 MET 1 -17.121 4.614 1.510
7 HE1 MET 1 HE1 MET 1 -17.822 6.676 0.509
8 HE2 MET 1 HE2 MET 1 -16.806 8.034 0.031
9 HE3 MET 1 HE3 MET 1 -16.888 6.578 -0.995
10 H GLY 2 H GLY 2 -13.785 1.443 1.236
11 HA2 GLY 2 HA2 GLY 2 -13.824 -1.085 2.795
12 HA3 GLY 2 HA3 GLY 2 -12.956 -0.777 1.289
13 H THR 3 H THR 3 -11.718 -1.754 3.715
14 HA THR 3 HA THR 3 -9.930 0.537 4.371
15 HB THR 3 HB THR 3 -10.624 -1.825 6.127
16 HG1 THR 3 HG1 THR 3 -12.398 -0.483 5.906
17 HG21 THR 3 HG21 THR 3 -9.506 -0.492 7.873
18 HG22 THR 3 HG22 THR 3 -8.386 -0.789 6.535
19 HG23 THR 3 HG23 THR 3 -9.162 0.798 6.696
20 H TYR 4 H TYR 4 -8.237 0.308 2.973
21 HA TYR 4 HA TYR 4 -7.241 -2.408 2.374
22 HB2 TYR 4 HB2 TYR 4 -6.533 0.330 1.257
23 HB3 TYR 4 HB3 TYR 4 -5.777 -1.181 0.775
24 HD1 TYR 4 HD2 TYR 4 -8.860 0.862 0.583
25 HD2 TYR 4 HD1 TYR 4 -6.941 -2.801 -0.663
26 HE1 TYR 4 HE2 TYR 4 -10.544 0.590 -1.204
27 HE2 TYR 4 HE1 TYR 4 -8.610 -3.071 -2.456
28 HH TYR 4 HH TYR 4 -10.506 -2.101 -3.554
29 H LYS 5 H LYS 5 -5.873 -3.223 3.820
30 HA LYS 5 HA LYS 5 -4.305 -1.546 5.613
31 HB2 LYS 5 HB2 LYS 5 -5.243 -3.759 6.283
32 HB3 LYS 5 HB3 LYS 5 -4.235 -4.549 5.056
33 HG2 LYS 5 HG2 LYS 5 -2.196 -3.660 6.177
34 HG3 LYS 5 HG3 LYS 5 -3.228 -2.903 7.404
35 HD2 LYS 5 HD2 LYS 5 -3.905 -4.977 8.296
36 HD3 LYS 5 HD3 LYS 5 -3.370 -5.888 6.856
37 HE2 LYS 5 HE2 LYS 5 -1.014 -5.210 7.340
38 HE3 LYS 5 HE3 LYS 5 -1.568 -4.393 8.804
39 HZ1 LYS 5 HZ1 LYS 5 -0.664 -6.540 9.205
40 HZ2 LYS 5 HZ2 LYS 5 -2.197 -6.450 9.726
41 HZ3 LYS 5 HZ3 LYS 5 -1.861 -7.307 8.333
42 H LEU 6 H LEU 6 -2.438 -0.591 4.951
43 HA LEU 6 HA LEU 6 -1.178 -1.296 2.431
44 HB2 LEU 6 HB2 LEU 6 -1.665 1.040 3.396
45 HB3 LEU 6 HB3 LEU 6 -0.396 0.742 4.550
46 HG LEU 6 HG LEU 6 0.495 2.130 2.867
47 HD11 LEU 6 HD11 LEU 6 2.348 1.061 1.919
48 HD12 LEU 6 HD12 LEU 6 2.045 0.177 3.430
49 HD13 LEU 6 HD13 LEU 6 1.564 -0.506 1.848
50 HD21 LEU 6 HD21 LEU 6 -1.166 1.814 1.139
51 HD22 LEU 6 HD22 LEU 6 0.422 1.519 0.427
52 HD23 LEU 6 HD23 LEU 6 -0.650 0.162 0.868
53 H ILE 7 H ILE 7 0.608 -2.607 2.250
54 HA ILE 7 HA ILE 7 2.346 -3.019 4.626
55 HB ILE 7 HB ILE 7 1.435 -5.150 2.654
56 HG12 ILE 7 HG12 ILE 7 1.154 -6.359 5.014
57 HG13 ILE 7 HG13 ILE 7 1.074 -4.726 5.651
58 HG21 ILE 7 HG21 ILE 7 3.043 -6.628 3.780
59 HG22 ILE 7 HG22 ILE 7 3.899 -5.298 3.035
60 HG23 ILE 7 HG23 ILE 7 3.625 -5.272 4.779
61 HD11 ILE 7 HD11 ILE 7 -1.145 -5.807 5.169
62 HD12 ILE 7 HD12 ILE 7 -0.907 -4.271 4.328
63 HD13 ILE 7 HD13 ILE 7 -0.744 -5.797 3.436
64 H LEU 8 H LEU 8 4.371 -2.537 4.207
65 HA LEU 8 HA LEU 8 5.150 -1.839 1.417
66 HB2 LEU 8 HB2 LEU 8 5.132 -0.203 3.669
67 HB3 LEU 8 HB3 LEU 8 6.750 -0.894 3.750
68 HG LEU 8 HG LEU 8 7.042 -0.223 1.319
69 HD11 LEU 8 HD11 LEU 8 5.626 1.450 0.363
70 HD12 LEU 8 HD12 LEU 8 4.555 0.143 0.853
71 HD13 LEU 8 HD13 LEU 8 4.663 1.603 1.850
72 HD21 LEU 8 HD21 LEU 8 8.050 1.018 3.194
73 HD22 LEU 8 HD22 LEU 8 7.545 2.131 1.922
74 HD23 LEU 8 HD23 LEU 8 6.551 1.975 3.389
75 H ASN 9 H ASN 9 6.503 -3.376 0.518
76 HA ASN 9 HA ASN 9 8.189 -5.006 2.341
77 HB2 ASN 9 HB2 ASN 9 6.103 -6.172 1.598
78 HB3 ASN 9 HB3 ASN 9 6.604 -5.957 -0.078
79 HD21 ASN 9 HD22 ASN 9 8.884 -6.941 -0.673
80 HD22 ASN 9 HD21 ASN 9 9.277 -8.381 0.164
81 H GLY 10 H GLY 10 9.896 -3.472 1.903
82 HA2 GLY 10 HA2 GLY 10 10.674 -2.972 -0.866
83 HA3 GLY 10 HA3 GLY 10 11.349 -2.279 0.605
84 H LYS 11 H LYS 11 13.182 -2.816 -1.022
85 HA LYS 11 HA LYS 11 14.178 -5.563 -0.805
86 HB2 LYS 11 HB2 LYS 11 15.927 -4.955 -2.247
87 HB3 LYS 11 HB3 LYS 11 14.453 -4.261 -2.896
88 HG2 LYS 11 HG2 LYS 11 15.894 -2.312 -1.215
89 HG3 LYS 11 HG3 LYS 11 16.954 -3.000 -2.431
90 HD2 LYS 11 HD2 LYS 11 15.163 -2.399 -4.155
91 HD3 LYS 11 HD3 LYS 11 14.334 -1.557 -2.827
92 HE2 LYS 11 HE2 LYS 11 16.546 -0.239 -2.534
93 HE3 LYS 11 HE3 LYS 11 17.022 -0.904 -4.080
94 HZ1 LYS 11 HZ1 LYS 11 14.725 0.031 -4.839
95 HZ2 LYS 11 HZ2 LYS 11 14.853 0.966 -3.510
96 HZ3 LYS 11 HZ3 LYS 11 15.998 1.093 -4.648
97 H THR 12 H THR 12 14.395 -2.788 1.167
98 HA THR 12 HA THR 12 16.623 -4.059 2.695
99 HB THR 12 HB THR 12 16.428 -1.065 2.604
100 HG1 THR 12 HG1 THR 12 17.574 -0.847 0.824
101 HG21 THR 12 HG21 THR 12 18.848 -1.165 2.868
102 HG22 THR 12 HG22 THR 12 18.098 -2.236 4.066
103 HG23 THR 12 HG23 THR 12 18.837 -2.920 2.611
104 H LEU 13 H LEU 13 13.442 -2.585 2.785
105 HA LEU 13 HA LEU 13 13.373 -2.923 5.635
106 HB2 LEU 13 HB2 LEU 13 12.664 -0.729 6.221
107 HB3 LEU 13 HB3 LEU 13 14.183 -0.588 5.379
108 HG LEU 13 HG LEU 13 12.853 1.228 4.771
109 HD11 LEU 13 HD11 LEU 13 12.650 -0.611 2.358
110 HD12 LEU 13 HD12 LEU 13 12.700 1.156 2.370
111 HD13 LEU 13 HD13 LEU 13 14.126 0.251 2.882
112 HD21 LEU 13 HD21 LEU 13 10.670 1.278 3.910
113 HD22 LEU 13 HD22 LEU 13 10.569 -0.469 3.731
114 HD23 LEU 13 HD23 LEU 13 10.624 0.264 5.357
115 H LYS 14 H LYS 14 11.098 -2.536 6.447
116 HA LYS 14 HA LYS 14 9.029 -2.976 4.398
117 HB2 LYS 14 HB2 LYS 14 9.331 -4.711 6.895
118 HB3 LYS 14 HB3 LYS 14 7.983 -4.745 5.750
119 HG2 LYS 14 HG2 LYS 14 9.783 -5.205 3.919
120 HG3 LYS 14 HG3 LYS 14 10.853 -5.588 5.266
121 HD2 LYS 14 HD2 LYS 14 9.139 -7.319 6.022
122 HD3 LYS 14 HD3 LYS 14 8.234 -6.949 4.529
123 HE2 LYS 14 HE2 LYS 14 10.497 -7.352 3.307
124 HE3 LYS 14 HE3 LYS 14 11.051 -8.085 4.811
125 HZ1 LYS 14 HZ1 LYS 14 8.848 -8.953 3.073
126 HZ2 LYS 14 HZ2 LYS 14 10.255 -9.752 3.362
127 HZ3 LYS 14 HZ3 LYS 14 9.095 -9.614 4.561
128 H GLY 15 H GLY 15 6.767 -2.672 5.468
129 HA2 GLY 15 HA2 GLY 15 6.729 -0.996 7.856
130 HA3 GLY 15 HA3 GLY 15 6.395 -0.132 6.345
131 H GLU 16 H GLU 16 4.441 -0.399 8.386
132 HA GLU 16 HA GLU 16 2.348 -1.862 6.901
133 HB2 GLU 16 HB2 GLU 16 3.351 -3.493 8.566
134 HB3 GLU 16 HB3 GLU 16 2.900 -2.376 9.857
135 HG2 GLU 16 HG2 GLU 16 0.489 -2.549 8.823
136 HG3 GLU 16 HG3 GLU 16 1.108 -3.956 7.981
137 H THR 17 H THR 17 0.728 -0.369 6.692
138 HA THR 17 HA THR 17 -0.016 1.392 8.942
139 HB THR 17 HB THR 17 -0.192 3.236 7.119
140 HG1 THR 17 HG1 THR 17 1.359 3.094 5.525
141 HG21 THR 17 HG21 THR 17 2.596 2.451 8.063
142 HG22 THR 17 HG22 THR 17 2.049 4.062 7.564
143 HG23 THR 17 HG23 THR 17 1.396 3.323 9.035
144 H THR 18 H THR 18 -2.250 2.594 8.079
145 HA THR 18 HA THR 18 -3.724 0.970 6.193
146 HB THR 18 HB THR 18 -3.810 -0.599 7.987
147 HG1 THR 18 HG1 THR 18 -6.267 0.732 8.092
148 HG21 THR 18 HG21 THR 18 -4.727 1.641 9.822
149 HG22 THR 18 HG22 THR 18 -4.889 -0.089 10.195
150 HG23 THR 18 HG23 THR 18 -3.284 0.634 9.970
151 H THR 19 H THR 19 -5.482 2.055 5.400
152 HA THR 19 HA THR 19 -6.671 4.318 6.678
153 HB THR 19 HB THR 19 -4.995 4.761 4.193
154 HG1 THR 19 HG1 THR 19 -4.448 4.954 6.718
155 HG21 THR 19 HG21 THR 19 -6.905 6.653 5.633
156 HG22 THR 19 HG22 THR 19 -5.765 7.127 4.348
157 HG23 THR 19 HG23 THR 19 -7.106 6.030 3.990
158 H GLU 20 H GLU 20 -8.840 4.642 5.816
159 HA GLU 20 HA GLU 20 -9.670 2.452 4.037
160 HB2 GLU 20 HB2 GLU 20 -11.973 3.125 4.664
161 HB3 GLU 20 HB3 GLU 20 -10.942 2.643 6.011
162 HG2 GLU 20 HG2 GLU 20 -10.581 5.216 6.372
163 HG3 GLU 20 HG3 GLU 20 -11.976 5.403 5.312
164 H ALA 21 H ALA 21 -10.907 2.773 2.122
165 HA ALA 21 HA ALA 21 -10.960 5.411 0.894
166 HB1 ALA 21 HB1 ALA 21 -8.616 4.542 0.491
167 HB2 ALA 21 HB2 ALA 21 -9.347 3.140 -0.337
168 HB3 ALA 21 HB3 ALA 21 -9.573 4.771 -0.978
169 H VAL 22 H VAL 22 -12.130 5.351 -1.168
170 HA VAL 22 HA VAL 22 -14.294 3.474 -1.129
171 HB VAL 22 HB VAL 22 -14.520 5.828 -1.793
172 HG11 VAL 22 HG11 VAL 22 -13.988 6.637 -4.001
173 HG12 VAL 22 HG12 VAL 22 -12.498 6.104 -3.208
174 HG13 VAL 22 HG13 VAL 22 -13.263 5.095 -4.459
175 HG21 VAL 22 HG21 VAL 22 -15.449 3.883 -3.935
176 HG22 VAL 22 HG22 VAL 22 -16.249 4.169 -2.373
177 HG23 VAL 22 HG23 VAL 22 -16.150 5.475 -3.565
178 H ASP 23 H ASP 23 -11.409 3.861 -3.270
179 HA ASP 23 HA ASP 23 -11.702 1.048 -4.153
180 HB2 ASP 23 HB2 ASP 23 -11.823 3.548 -5.790
181 HB3 ASP 23 HB3 ASP 23 -10.672 2.354 -6.365
182 H ALA 24 H ALA 24 -9.669 0.283 -5.125
183 HA ALA 24 HA ALA 24 -7.500 0.680 -3.372
184 HB1 ALA 24 HB1 ALA 24 -7.835 -1.388 -4.647
185 HB2 ALA 24 HB2 ALA 24 -7.521 -0.525 -6.162
186 HB3 ALA 24 HB3 ALA 24 -6.229 -0.718 -4.988
187 H ALA 25 H ALA 25 -8.013 2.065 -6.695
188 HA ALA 25 HA ALA 25 -5.572 3.386 -6.912
189 HB1 ALA 25 HB1 ALA 25 -7.116 3.204 -8.777
190 HB2 ALA 25 HB2 ALA 25 -8.301 4.236 -7.953
191 HB3 ALA 25 HB3 ALA 25 -6.743 4.911 -8.489
192 H THR 26 H THR 26 -8.391 4.379 -4.947
193 HA THR 26 HA THR 26 -7.502 7.100 -4.532
194 HB THR 26 HB THR 26 -9.322 5.262 -2.943
195 HG1 THR 26 HG1 THR 26 -10.108 7.344 -4.662
196 HG21 THR 26 HG21 THR 26 -10.338 7.278 -1.983
197 HG22 THR 26 HG22 THR 26 -8.634 7.149 -1.523
198 HG23 THR 26 HG23 THR 26 -9.121 8.291 -2.791
199 H ALA 27 H ALA 27 -7.262 4.028 -2.689
200 HA ALA 27 HA ALA 27 -5.782 5.070 -0.526
201 HB1 ALA 27 HB1 ALA 27 -5.951 2.225 -1.647
202 HB2 ALA 27 HB2 ALA 27 -5.250 2.656 -0.084
203 HB3 ALA 27 HB3 ALA 27 -6.974 2.923 -0.374
204 H GLU 28 H GLU 28 -4.758 3.475 -3.485
205 HA GLU 28 HA GLU 28 -2.020 3.127 -3.149
206 HB2 GLU 28 HB2 GLU 28 -3.459 2.254 -4.977
207 HB3 GLU 28 HB3 GLU 28 -3.706 3.887 -5.565
208 HG2 GLU 28 HG2 GLU 28 -1.092 3.906 -5.862
209 HG3 GLU 28 HG3 GLU 28 -1.255 2.144 -5.796
210 H LYS 29 H LYS 29 -3.710 5.921 -4.673
211 HA LYS 29 HA LYS 29 -1.425 7.474 -5.152
212 HB2 LYS 29 HB2 LYS 29 -3.620 7.861 -6.165
213 HB3 LYS 29 HB3 LYS 29 -4.301 8.329 -4.607
214 HG2 LYS 29 HG2 LYS 29 -3.006 10.358 -4.533
215 HG3 LYS 29 HG3 LYS 29 -1.938 9.807 -5.833
216 HD2 LYS 29 HD2 LYS 29 -3.437 11.462 -6.727
217 HD3 LYS 29 HD3 LYS 29 -3.822 9.888 -7.436
218 HE2 LYS 29 HE2 LYS 29 -5.688 9.639 -5.775
219 HE3 LYS 29 HE3 LYS 29 -5.301 11.243 -5.131
220 HZ1 LYS 29 HZ1 LYS 29 -7.077 11.411 -6.678
221 HZ2 LYS 29 HZ2 LYS 29 -5.756 12.121 -7.351
222 HZ3 LYS 29 HZ3 LYS 29 -6.214 10.629 -7.871
223 H VAL 30 H VAL 30 -3.610 7.559 -2.346
224 HA VAL 30 HA VAL 30 -2.334 9.650 -0.944
225 HB VAL 30 HB VAL 30 -4.129 7.307 -0.196
226 HG11 VAL 30 HG11 VAL 30 -2.959 7.824 1.877
227 HG12 VAL 30 HG12 VAL 30 -3.247 9.554 1.626
228 HG13 VAL 30 HG13 VAL 30 -4.604 8.454 1.952
229 HG21 VAL 30 HG21 VAL 30 -5.854 9.023 -0.115
230 HG22 VAL 30 HG22 VAL 30 -4.653 10.309 -0.382
231 HG23 VAL 30 HG23 VAL 30 -5.021 9.151 -1.660
232 H PHE 31 H PHE 31 -1.958 6.049 -0.368
233 HA PHE 31 HA PHE 31 0.198 6.614 1.420
234 HB2 PHE 31 HB2 PHE 31 -1.038 4.124 0.330
235 HB3 PHE 31 HB3 PHE 31 0.578 4.001 1.000
236 HD1 PHE 31 HD2 PHE 31 0.787 5.644 3.309
237 HD2 PHE 31 HD1 PHE 31 -2.633 3.394 1.946
238 HE1 PHE 31 HE2 PHE 31 -0.001 5.457 5.628
239 HE2 PHE 31 HE1 PHE 31 -3.370 3.142 4.282
240 HZ PHE 31 HZ PHE 31 -2.084 4.204 6.140
241 H LYS 32 H LYS 32 0.346 6.643 -2.001
242 HA LYS 32 HA LYS 32 2.929 5.578 -2.434
243 HB2 LYS 32 HB2 LYS 32 1.306 6.369 -4.189
244 HB3 LYS 32 HB3 LYS 32 1.737 8.038 -3.780
245 HG2 LYS 32 HG2 LYS 32 4.080 7.592 -4.415
246 HG3 LYS 32 HG3 LYS 32 3.679 5.892 -4.749
247 HD2 LYS 32 HD2 LYS 32 2.155 6.592 -6.558
248 HD3 LYS 32 HD3 LYS 32 2.467 8.296 -6.178
249 HE2 LYS 32 HE2 LYS 32 4.929 7.840 -6.620
250 HE3 LYS 32 HE3 LYS 32 4.471 6.235 -7.194
251 HZ1 LYS 32 HZ1 LYS 32 3.027 7.411 -8.850
252 HZ2 LYS 32 HZ2 LYS 32 3.694 8.828 -8.378
253 HZ3 LYS 32 HZ3 LYS 32 4.631 7.644 -9.050
254 H GLN 33 H GLN 33 1.926 8.639 -1.029
255 HA GLN 33 HA GLN 33 4.321 10.100 -1.006
256 HB2 GLN 33 HB2 GLN 33 2.016 9.908 0.994
257 HB3 GLN 33 HB3 GLN 33 3.262 11.160 1.051
258 HG2 GLN 33 HG2 GLN 33 2.589 11.987 -1.138
259 HG3 GLN 33 HG3 GLN 33 1.415 10.685 -1.337
260 HE21 GLN 33 HE22 GLN 33 2.155 13.070 1.354
261 HE22 GLN 33 HE21 GLN 33 0.588 13.815 1.199
262 H TYR 34 H TYR 34 3.005 7.998 1.584
263 HA TYR 34 HA TYR 34 5.344 8.041 3.223
264 HB2 TYR 34 HB2 TYR 34 3.547 7.501 4.476
265 HB3 TYR 34 HB3 TYR 34 2.694 6.727 3.158
266 HD1 TYR 34 HD2 TYR 34 5.309 6.165 5.769
267 HD2 TYR 34 HD1 TYR 34 2.713 4.364 2.829
268 HE1 TYR 34 HE2 TYR 34 5.741 3.935 6.755
269 HE2 TYR 34 HE1 TYR 34 3.123 2.148 3.840
270 HH TYR 34 HH TYR 34 3.797 1.272 6.178
271 H ALA 35 H ALA 35 4.225 5.762 0.672
272 HA ALA 35 HA ALA 35 6.117 3.731 1.134
273 HB1 ALA 35 HB1 ALA 35 5.760 3.148 -1.261
274 HB2 ALA 35 HB2 ALA 35 4.228 3.473 -0.420
275 HB3 ALA 35 HB3 ALA 35 4.934 4.690 -1.511
276 H ASN 36 H ASN 36 6.344 6.548 -1.082
277 HA ASN 36 HA ASN 36 9.026 6.070 -1.883
278 HB2 ASN 36 HB2 ASN 36 7.425 7.605 -3.063
279 HB3 ASN 36 HB3 ASN 36 7.540 8.738 -1.716
280 HD21 ASN 36 HD22 ASN 36 9.531 6.957 -4.093
281 HD22 ASN 36 HD21 ASN 36 10.769 8.175 -4.291
282 H ASP 37 H ASP 37 7.687 8.134 0.721
283 HA ASP 37 HA ASP 37 10.127 9.278 1.598
284 HB2 ASP 37 HB2 ASP 37 7.978 10.151 2.218
285 HB3 ASP 37 HB3 ASP 37 7.589 8.679 3.143
286 H ASN 38 H ASN 38 8.616 6.183 2.447
287 HA ASN 38 HA ASN 38 10.619 5.624 4.495
288 HB2 ASN 38 HB2 ASN 38 8.125 4.934 4.473
289 HB3 ASN 38 HB3 ASN 38 8.627 3.672 3.356
290 HD21 ASN 38 HD22 ASN 38 7.975 2.054 5.013
291 HD22 ASN 38 HD21 ASN 38 9.060 1.761 6.358
292 H GLY 39 H GLY 39 10.772 5.550 1.132
293 HA2 GLY 39 HA2 GLY 39 12.635 4.919 -0.066
294 HA3 GLY 39 HA3 GLY 39 13.195 3.917 1.249
295 H VAL 40 H VAL 40 9.910 3.549 -0.334
296 HA VAL 40 HA VAL 40 10.987 1.031 -1.531
297 HB VAL 40 HB VAL 40 8.315 1.315 -0.128
298 HG11 VAL 40 HG11 VAL 40 9.665 -1.054 -1.492
299 HG12 VAL 40 HG12 VAL 40 8.270 -1.213 -0.410
300 HG13 VAL 40 HG13 VAL 40 8.111 -0.312 -1.913
301 HG21 VAL 40 HG21 VAL 40 10.066 1.247 1.559
302 HG22 VAL 40 HG22 VAL 40 9.342 -0.364 1.490
303 HG23 VAL 40 HG23 VAL 40 10.899 -0.067 0.714
304 H ASP 41 H ASP 41 10.165 0.373 -3.470
305 HA ASP 41 HA ASP 41 8.072 1.831 -4.831
306 HB2 ASP 41 HB2 ASP 41 10.358 3.142 -5.114
307 HB3 ASP 41 HB3 ASP 41 10.800 1.831 -6.202
308 H GLY 42 H GLY 42 6.976 -0.151 -5.183
309 HA2 GLY 42 HA2 GLY 42 8.396 -2.173 -6.806
310 HA3 GLY 42 HA3 GLY 42 7.685 -2.651 -5.256
311 H GLU 43 H GLU 43 6.607 -4.046 -7.086
312 HA GLU 43 HA GLU 43 4.558 -2.780 -8.629
313 HB2 GLU 43 HB2 GLU 43 5.753 -4.987 -9.101
314 HB3 GLU 43 HB3 GLU 43 4.703 -5.725 -7.892
315 HG2 GLU 43 HG2 GLU 43 3.750 -6.094 -10.093
316 HG3 GLU 43 HG3 GLU 43 2.709 -4.947 -9.217
317 H TRP 44 H TRP 44 2.953 -1.739 -7.680
318 HA TRP 44 HA TRP 44 1.872 -2.302 -5.069
319 HB2 TRP 44 HB2 TRP 44 0.929 -0.574 -7.389
320 HB3 TRP 44 HB3 TRP 44 0.112 -0.632 -5.853
321 HD1 TRP 44 HD1 TRP 44 3.631 0.310 -7.156
322 HE1 TRP 44 HE1 TRP 44 4.622 2.122 -5.629
323 HE3 TRP 44 HE3 TRP 44 -0.222 0.771 -3.789
324 HZ2 TRP 44 HZ2 TRP 44 3.924 3.480 -3.248
325 HZ3 TRP 44 HZ3 TRP 44 -0.015 2.379 -1.900
326 HH2 TRP 44 HH2 TRP 44 2.049 3.684 -1.575
327 H THR 45 H THR 45 0.879 -4.300 -4.788
328 HA THR 45 HA THR 45 -1.249 -5.013 -6.785
329 HB THR 45 HB THR 45 0.521 -6.881 -5.181
330 HG1 THR 45 HG1 THR 45 1.525 -5.628 -6.886
331 HG21 THR 45 HG21 THR 45 -0.383 -8.597 -6.715
332 HG22 THR 45 HG22 THR 45 -1.687 -7.853 -5.765
333 HG23 THR 45 HG23 THR 45 -1.441 -7.390 -7.465
334 H TYR 46 H TYR 46 -3.205 -4.836 -5.987
335 HA TYR 46 HA TYR 46 -3.639 -4.681 -3.093
336 HB2 TYR 46 HB2 TYR 46 -5.676 -3.600 -3.533
337 HB3 TYR 46 HB3 TYR 46 -4.481 -2.847 -4.575
338 HD1 TYR 46 HD2 TYR 46 -7.465 -5.019 -4.462
339 HD2 TYR 46 HD1 TYR 46 -4.590 -3.062 -7.011
340 HE1 TYR 46 HE2 TYR 46 -8.800 -5.637 -6.427
341 HE2 TYR 46 HE1 TYR 46 -5.913 -3.671 -8.982
342 HH TYR 46 HH TYR 46 -8.626 -5.934 -8.795
343 H ASP 47 H ASP 47 -5.289 -5.821 -2.064
344 HA ASP 47 HA ASP 47 -6.432 -8.147 -3.435
345 HB2 ASP 47 HB2 ASP 47 -4.274 -8.788 -2.215
346 HB3 ASP 47 HB3 ASP 47 -5.102 -8.410 -0.708
347 H ASP 48 H ASP 48 -8.338 -6.855 -3.423
348 HA ASP 48 HA ASP 48 -9.237 -5.591 -0.997
349 HB2 ASP 48 HB2 ASP 48 -11.139 -4.947 -2.096
350 HB3 ASP 48 HB3 ASP 48 -9.951 -4.982 -3.380
351 H ALA 49 H ALA 49 -9.345 -8.917 -2.114
352 HA ALA 49 HA ALA 49 -11.617 -9.789 -0.623
353 HB1 ALA 49 HB1 ALA 49 -10.592 -12.011 -0.818
354 HB2 ALA 49 HB2 ALA 49 -10.613 -11.162 -2.367
355 HB3 ALA 49 HB3 ALA 49 -9.089 -11.308 -1.438
356 H THR 50 H THR 50 -8.068 -10.114 0.171
357 HA THR 50 HA THR 50 -8.725 -10.604 2.957
358 HB THR 50 HB THR 50 -5.927 -10.241 1.909
359 HG1 THR 50 HG1 THR 50 -6.755 -11.546 0.408
360 HG21 THR 50 HG21 THR 50 -7.238 -12.155 3.905
361 HG22 THR 50 HG22 THR 50 -5.512 -12.106 3.511
362 HG23 THR 50 HG23 THR 50 -6.252 -10.735 4.333
363 H LYS 51 H LYS 51 -8.706 -7.826 1.241
364 HA LYS 51 HA LYS 51 -8.573 -5.623 1.686
365 HB2 LYS 51 HB2 LYS 51 -9.061 -6.608 4.531
366 HB3 LYS 51 HB3 LYS 51 -9.074 -4.922 4.043
367 HG2 LYS 51 HG2 LYS 51 -10.841 -5.347 2.405
368 HG3 LYS 51 HG3 LYS 51 -10.906 -7.057 2.907
369 HD2 LYS 51 HD2 LYS 51 -11.543 -6.369 5.197
370 HD3 LYS 51 HD3 LYS 51 -11.374 -4.673 4.737
371 HE2 LYS 51 HE2 LYS 51 -13.724 -5.319 4.800
372 HE3 LYS 51 HE3 LYS 51 -13.233 -4.812 3.183
373 HZ1 LYS 51 HZ1 LYS 51 -13.201 -7.056 2.460
374 HZ2 LYS 51 HZ2 LYS 51 -13.410 -7.647 3.981
375 HZ3 LYS 51 HZ3 LYS 51 -14.613 -6.834 3.217
376 H THR 52 H THR 52 -6.207 -6.630 1.067
377 HA THR 52 HA THR 52 -4.299 -5.135 2.768
378 HB THR 52 HB THR 52 -2.702 -7.092 1.996
379 HG1 THR 52 HG1 THR 52 -3.832 -9.101 1.907
380 HG21 THR 52 HG21 THR 52 -3.293 -8.407 4.008
381 HG22 THR 52 HG22 THR 52 -3.240 -6.658 4.351
382 HG23 THR 52 HG23 THR 52 -4.801 -7.495 4.178
383 H PHE 53 H PHE 53 -2.440 -4.324 1.556
384 HA PHE 53 HA PHE 53 -2.592 -4.410 -1.351
385 HB2 PHE 53 HB2 PHE 53 -4.118 -2.527 -0.379
386 HB3 PHE 53 HB3 PHE 53 -2.630 -1.706 0.032
387 HD1 PHE 53 HD2 PHE 53 -1.355 -2.939 -2.830
388 HD2 PHE 53 HD1 PHE 53 -4.772 -0.566 -1.646
389 HE1 PHE 53 HE2 PHE 53 -1.427 -1.912 -5.054
390 HE2 PHE 53 HE1 PHE 53 -4.711 0.558 -3.842
391 HZ PHE 53 HZ PHE 53 -3.052 -0.103 -5.565
392 H THR 54 H THR 54 -0.590 -5.298 -1.501
393 HA THR 54 HA THR 54 1.556 -4.191 0.186
394 HB THR 54 HB THR 54 1.457 -6.841 -1.243
395 HG1 THR 54 HG1 THR 54 0.603 -7.647 0.568
396 HG21 THR 54 HG21 THR 54 3.739 -6.190 -0.678
397 HG22 THR 54 HG22 THR 54 3.247 -5.726 0.953
398 HG23 THR 54 HG23 THR 54 3.211 -7.434 0.461
399 H VAL 55 H VAL 55 3.381 -3.382 -0.573
400 HA VAL 55 HA VAL 55 3.719 -2.999 -3.510
401 HB VAL 55 HB VAL 55 4.937 -1.363 -1.226
402 HG11 VAL 55 HG11 VAL 55 6.144 -1.281 -3.371
403 HG12 VAL 55 HG12 VAL 55 4.646 -0.819 -4.212
404 HG13 VAL 55 HG13 VAL 55 5.377 0.278 -3.018
405 HG21 VAL 55 HG21 VAL 55 2.400 -0.817 -2.782
406 HG22 VAL 55 HG22 VAL 55 2.595 -0.988 -1.011
407 HG23 VAL 55 HG23 VAL 55 3.281 0.409 -1.838
408 H THR 56 H THR 56 4.980 -4.773 -4.072
409 HA THR 56 HA THR 56 7.169 -5.624 -2.254
410 HB THR 56 HB THR 56 5.757 -7.101 -4.478
411 HG1 THR 56 HG1 THR 56 4.523 -7.928 -3.034
412 HG21 THR 56 HG21 THR 56 7.625 -8.138 -2.312
413 HG22 THR 56 HG22 THR 56 6.762 -9.112 -3.508
414 HG23 THR 56 HG23 THR 56 8.034 -7.989 -4.036
415 H GLU 57 H GLU 57 9.054 -4.698 -2.776
416 HA GLU 57 HA GLU 57 9.646 -3.864 -5.560
417 HB2 GLU 57 HB2 GLU 57 9.916 -2.221 -3.785
418 HB3 GLU 57 HB3 GLU 57 11.013 -3.300 -2.903
419 HG2 GLU 57 HG2 GLU 57 12.730 -3.105 -4.495
420 HG3 GLU 57 HG3 GLU 57 11.654 -2.499 -5.737
Start of MODEL 5
1 H1 MET 1 H MET 1 -17.803 3.402 1.862
2 HA MET 1 HA MET 1 -15.690 2.697 0.816
3 HB2 MET 1 HB2 MET 1 -15.620 3.440 3.773
4 HB3 MET 1 HB3 MET 1 -14.159 3.227 2.828
5 HG2 MET 1 HG2 MET 1 -14.618 5.528 2.765
6 HG3 MET 1 HG3 MET 1 -14.971 4.880 1.170
7 HE1 MET 1 HE1 MET 1 -15.674 7.528 1.405
8 HE2 MET 1 HE2 MET 1 -16.646 6.747 0.137
9 HE3 MET 1 HE3 MET 1 -17.426 7.819 1.317
10 H GLY 2 H GLY 2 -13.567 1.586 1.449
11 HA2 GLY 2 HA2 GLY 2 -13.980 -1.172 2.439
12 HA3 GLY 2 HA3 GLY 2 -13.117 -0.763 0.941
13 H THR 3 H THR 3 -11.815 -2.093 2.955
14 HA THR 3 HA THR 3 -9.976 -0.070 4.140
15 HB THR 3 HB THR 3 -10.902 -2.842 4.987
16 HG1 THR 3 HG1 THR 3 -12.367 -1.235 5.489
17 HG21 THR 3 HG21 THR 3 -9.642 -2.610 7.024
18 HG22 THR 3 HG22 THR 3 -8.503 -2.480 5.665
19 HG23 THR 3 HG23 THR 3 -9.048 -1.015 6.534
20 H TYR 4 H TYR 4 -7.736 -0.294 3.684
21 HA TYR 4 HA TYR 4 -6.831 -2.566 2.058
22 HB2 TYR 4 HB2 TYR 4 -6.707 0.343 1.140
23 HB3 TYR 4 HB3 TYR 4 -5.657 -0.919 0.531
24 HD1 TYR 4 HD1 TYR 4 -6.628 -2.927 -0.710
25 HD2 TYR 4 HD2 TYR 4 -8.954 0.581 0.275
26 HE1 TYR 4 HE1 TYR 4 -8.314 -3.584 -2.384
27 HE2 TYR 4 HE2 TYR 4 -10.644 -0.069 -1.419
28 HH TYR 4 HH TYR 4 -10.302 -2.791 -3.631
29 H LYS 5 H LYS 5 -5.604 -3.186 3.767
30 HA LYS 5 HA LYS 5 -4.033 -1.392 5.384
31 HB2 LYS 5 HB2 LYS 5 -5.043 -3.594 6.068
32 HB3 LYS 5 HB3 LYS 5 -3.919 -4.416 4.976
33 HG2 LYS 5 HG2 LYS 5 -2.008 -3.477 6.305
34 HG3 LYS 5 HG3 LYS 5 -3.192 -2.746 7.427
35 HD2 LYS 5 HD2 LYS 5 -4.136 -4.966 7.918
36 HD3 LYS 5 HD3 LYS 5 -3.016 -5.704 6.737
37 HE2 LYS 5 HE2 LYS 5 -1.108 -4.760 8.068
38 HE3 LYS 5 HE3 LYS 5 -2.275 -4.271 9.317
39 HZ1 LYS 5 HZ1 LYS 5 -1.265 -6.373 9.784
40 HZ2 LYS 5 HZ2 LYS 5 -2.893 -6.647 9.458
41 HZ3 LYS 5 HZ3 LYS 5 -1.691 -6.988 8.351
42 H LEU 6 H LEU 6 -1.941 -0.713 5.045
43 HA LEU 6 HA LEU 6 -0.695 -1.380 2.481
44 HB2 LEU 6 HB2 LEU 6 -0.884 0.947 3.922
45 HB3 LEU 6 HB3 LEU 6 0.650 0.358 4.521
46 HG LEU 6 HG LEU 6 -0.151 1.067 1.683
47 HD11 LEU 6 HD11 LEU 6 1.739 2.674 1.960
48 HD12 LEU 6 HD12 LEU 6 0.462 2.913 3.175
49 HD13 LEU 6 HD13 LEU 6 1.973 2.078 3.610
50 HD21 LEU 6 HD21 LEU 6 2.198 0.570 0.994
51 HD22 LEU 6 HD22 LEU 6 2.390 -0.346 2.519
52 HD23 LEU 6 HD23 LEU 6 1.211 -0.845 1.284
53 H ILE 7 H ILE 7 1.108 -2.670 2.269
54 HA ILE 7 HA ILE 7 2.682 -3.420 4.653
55 HB ILE 7 HB ILE 7 1.665 -5.417 2.596
56 HG12 ILE 7 HG12 ILE 7 1.132 -6.528 5.029
57 HG13 ILE 7 HG13 ILE 7 0.996 -4.840 5.485
58 HG21 ILE 7 HG21 ILE 7 4.043 -5.822 3.135
59 HG22 ILE 7 HG22 ILE 7 3.684 -5.725 4.872
60 HG23 ILE 7 HG23 ILE 7 3.038 -7.049 3.874
61 HD11 ILE 7 HD11 ILE 7 -0.559 -6.281 3.284
62 HD12 ILE 7 HD12 ILE 7 -1.181 -5.755 4.869
63 HD13 ILE 7 HD13 ILE 7 -0.708 -4.560 3.648
64 H LEU 8 H LEU 8 4.458 -2.390 4.259
65 HA LEU 8 HA LEU 8 5.488 -1.850 1.529
66 HB2 LEU 8 HB2 LEU 8 5.791 -0.709 4.252
67 HB3 LEU 8 HB3 LEU 8 7.351 -1.078 3.540
68 HG LEU 8 HG LEU 8 6.874 0.335 1.606
69 HD11 LEU 8 HD11 LEU 8 4.494 0.198 1.371
70 HD12 LEU 8 HD12 LEU 8 4.239 0.883 2.994
71 HD13 LEU 8 HD13 LEU 8 4.905 1.885 1.682
72 HD21 LEU 8 HD21 LEU 8 7.985 1.280 3.571
73 HD22 LEU 8 HD22 LEU 8 6.925 2.493 2.845
74 HD23 LEU 8 HD23 LEU 8 6.417 1.635 4.318
75 H ASN 9 H ASN 9 6.770 -3.505 0.624
76 HA ASN 9 HA ASN 9 8.456 -5.113 2.477
77 HB2 ASN 9 HB2 ASN 9 6.399 -6.362 1.822
78 HB3 ASN 9 HB3 ASN 9 6.809 -6.144 0.127
79 HD21 ASN 9 HD22 ASN 9 9.232 -6.900 -0.377
80 HD22 ASN 9 HD21 ASN 9 9.563 -8.514 0.198
81 H GLY 10 H GLY 10 9.976 -3.397 1.930
82 HA2 GLY 10 HA2 GLY 10 10.741 -2.986 -0.842
83 HA3 GLY 10 HA3 GLY 10 11.378 -2.206 0.603
84 H LYS 11 H LYS 11 13.260 -2.743 -1.034
85 HA LYS 11 HA LYS 11 14.363 -5.445 -0.602
86 HB2 LYS 11 HB2 LYS 11 16.096 -4.881 -2.118
87 HB3 LYS 11 HB3 LYS 11 14.554 -4.500 -2.837
88 HG2 LYS 11 HG2 LYS 11 16.035 -2.230 -1.483
89 HG3 LYS 11 HG3 LYS 11 16.725 -2.889 -2.974
90 HD2 LYS 11 HD2 LYS 11 14.649 -2.512 -4.183
91 HD3 LYS 11 HD3 LYS 11 13.873 -1.939 -2.704
92 HE2 LYS 11 HE2 LYS 11 15.281 0.026 -2.623
93 HE3 LYS 11 HE3 LYS 11 16.269 -0.557 -3.977
94 HZ1 LYS 11 HZ1 LYS 11 13.378 -0.175 -4.335
95 HZ2 LYS 11 HZ2 LYS 11 14.426 1.119 -4.505
96 HZ3 LYS 11 HZ3 LYS 11 14.511 -0.212 -5.464
97 H THR 12 H THR 12 14.336 -2.765 1.296
98 HA THR 12 HA THR 12 16.812 -3.644 2.661
99 HB THR 12 HB THR 12 16.237 -0.696 2.171
100 HG1 THR 12 HG1 THR 12 17.928 -0.798 0.674
101 HG21 THR 12 HG21 THR 12 17.688 -1.096 4.102
102 HG22 THR 12 HG22 THR 12 18.706 -2.198 3.143
103 HG23 THR 12 HG23 THR 12 18.660 -0.464 2.774
104 H LEU 13 H LEU 13 13.535 -2.232 2.881
105 HA LEU 13 HA LEU 13 13.514 -2.768 5.731
106 HB2 LEU 13 HB2 LEU 13 12.784 -0.620 6.410
107 HB3 LEU 13 HB3 LEU 13 14.283 -0.412 5.552
108 HG LEU 13 HG LEU 13 12.905 1.398 5.053
109 HD11 LEU 13 HD11 LEU 13 14.181 0.550 3.117
110 HD12 LEU 13 HD12 LEU 13 12.723 -0.312 2.552
111 HD13 LEU 13 HD13 LEU 13 12.740 1.458 2.662
112 HD21 LEU 13 HD21 LEU 13 10.713 1.473 4.245
113 HD22 LEU 13 HD22 LEU 13 10.636 -0.264 3.940
114 HD23 LEU 13 HD23 LEU 13 10.688 0.351 5.608
115 H LYS 14 H LYS 14 11.240 -2.447 6.595
116 HA LYS 14 HA LYS 14 9.132 -2.844 4.563
117 HB2 LYS 14 HB2 LYS 14 9.550 -4.663 6.976
118 HB3 LYS 14 HB3 LYS 14 8.190 -4.724 5.848
119 HG2 LYS 14 HG2 LYS 14 10.028 -5.019 4.001
120 HG3 LYS 14 HG3 LYS 14 11.100 -5.406 5.346
121 HD2 LYS 14 HD2 LYS 14 9.435 -7.194 6.028
122 HD3 LYS 14 HD3 LYS 14 8.549 -6.842 4.529
123 HE2 LYS 14 HE2 LYS 14 10.774 -7.250 3.289
124 HE3 LYS 14 HE3 LYS 14 11.412 -7.852 4.824
125 HZ1 LYS 14 HZ1 LYS 14 9.122 -8.929 3.313
126 HZ2 LYS 14 HZ2 LYS 14 10.582 -9.628 3.457
127 HZ3 LYS 14 HZ3 LYS 14 9.577 -9.506 4.790
128 H GLY 15 H GLY 15 6.860 -2.736 5.643
129 HA2 GLY 15 HA2 GLY 15 6.698 -1.275 8.147
130 HA3 GLY 15 HA3 GLY 15 6.346 -0.284 6.729
131 H GLU 16 H GLU 16 4.406 -0.972 8.805
132 HA GLU 16 HA GLU 16 2.358 -2.230 7.089
133 HB2 GLU 16 HB2 GLU 16 3.238 -4.066 8.514
134 HB3 GLU 16 HB3 GLU 16 2.960 -3.081 9.950
135 HG2 GLU 16 HG2 GLU 16 0.452 -2.998 9.106
136 HG3 GLU 16 HG3 GLU 16 0.928 -4.328 8.067
137 H THR 17 H THR 17 0.747 -0.698 6.995
138 HA THR 17 HA THR 17 -0.124 0.688 9.456
139 HB THR 17 HB THR 17 -0.415 2.761 7.914
140 HG1 THR 17 HG1 THR 17 1.017 2.975 6.302
141 HG21 THR 17 HG21 THR 17 1.125 2.687 9.827
142 HG22 THR 17 HG22 THR 17 2.365 1.936 8.830
143 HG23 THR 17 HG23 THR 17 1.837 3.587 8.478
144 H THR 18 H THR 18 -2.447 1.856 8.829
145 HA THR 18 HA THR 18 -3.817 0.165 6.832
146 HB THR 18 HB THR 18 -3.620 -0.945 9.071
147 HG1 THR 18 HG1 THR 18 -6.307 -0.542 8.500
148 HG21 THR 18 HG21 THR 18 -3.930 0.938 10.590
149 HG22 THR 18 HG22 THR 18 -5.610 1.122 10.058
150 HG23 THR 18 HG23 THR 18 -5.102 -0.353 10.898
151 H THR 19 H THR 19 -5.442 1.309 5.769
152 HA THR 19 HA THR 19 -6.658 3.653 6.926
153 HB THR 19 HB THR 19 -5.273 4.034 4.282
154 HG1 THR 19 HG1 THR 19 -4.188 4.132 6.824
155 HG21 THR 19 HG21 THR 19 -6.284 5.967 6.390
156 HG22 THR 19 HG22 THR 19 -5.440 6.430 4.888
157 HG23 THR 19 HG23 THR 19 -7.021 5.646 4.812
158 H GLU 20 H GLU 20 -8.749 3.961 6.069
159 HA GLU 20 HA GLU 20 -9.646 2.001 4.058
160 HB2 GLU 20 HB2 GLU 20 -11.899 2.597 4.849
161 HB3 GLU 20 HB3 GLU 20 -10.837 2.062 6.140
162 HG2 GLU 20 HG2 GLU 20 -10.452 4.676 6.512
163 HG3 GLU 20 HG3 GLU 20 -11.939 4.825 5.564
164 H ALA 21 H ALA 21 -11.087 2.732 2.297
165 HA ALA 21 HA ALA 21 -11.119 5.515 1.509
166 HB1 ALA 21 HB1 ALA 21 -9.893 5.156 -0.605
167 HB2 ALA 21 HB2 ALA 21 -8.820 4.916 0.776
168 HB3 ALA 21 HB3 ALA 21 -9.463 3.505 -0.112
169 H VAL 22 H VAL 22 -12.318 5.659 -0.683
170 HA VAL 22 HA VAL 22 -14.495 3.707 -0.659
171 HB VAL 22 HB VAL 22 -14.661 6.227 -1.019
172 HG11 VAL 22 HG11 VAL 22 -14.410 7.167 -3.212
173 HG12 VAL 22 HG12 VAL 22 -12.880 6.346 -2.846
174 HG13 VAL 22 HG13 VAL 22 -14.054 5.595 -3.939
175 HG21 VAL 22 HG21 VAL 22 -16.618 6.066 -2.409
176 HG22 VAL 22 HG22 VAL 22 -16.073 4.534 -3.106
177 HG23 VAL 22 HG23 VAL 22 -16.524 4.619 -1.390
178 H ASP 23 H ASP 23 -11.553 4.221 -2.581
179 HA ASP 23 HA ASP 23 -12.118 1.762 -4.105
180 HB2 ASP 23 HB2 ASP 23 -12.270 4.499 -5.140
181 HB3 ASP 23 HB3 ASP 23 -10.896 3.682 -5.855
182 H ALA 24 H ALA 24 -10.228 0.816 -4.959
183 HA ALA 24 HA ALA 24 -7.932 0.981 -3.307
184 HB1 ALA 24 HB1 ALA 24 -8.234 -0.199 -6.109
185 HB2 ALA 24 HB2 ALA 24 -6.908 -0.527 -4.971
186 HB3 ALA 24 HB3 ALA 24 -8.553 -1.044 -4.581
187 H ALA 25 H ALA 25 -8.763 2.600 -6.373
188 HA ALA 25 HA ALA 25 -6.219 3.628 -7.035
189 HB1 ALA 25 HB1 ALA 25 -8.207 3.722 -8.494
190 HB2 ALA 25 HB2 ALA 25 -8.951 4.932 -7.429
191 HB3 ALA 25 HB3 ALA 25 -7.443 5.316 -8.307
192 H THR 26 H THR 26 -8.590 4.823 -4.585
193 HA THR 26 HA THR 26 -7.201 7.360 -4.231
194 HB THR 26 HB THR 26 -9.147 5.885 -2.425
195 HG1 THR 26 HG1 THR 26 -9.490 7.833 -4.459
196 HG21 THR 26 HG21 THR 26 -7.934 7.617 -1.177
197 HG22 THR 26 HG22 THR 26 -8.234 8.799 -2.461
198 HG23 THR 26 HG23 THR 26 -9.579 8.172 -1.488
199 H ALA 27 H ALA 27 -7.227 4.120 -2.668
200 HA ALA 27 HA ALA 27 -5.376 4.691 -0.616
201 HB1 ALA 27 HB1 ALA 27 -5.871 2.063 -2.100
202 HB2 ALA 27 HB2 ALA 27 -5.024 2.241 -0.573
203 HB3 ALA 27 HB3 ALA 27 -6.747 2.648 -0.674
204 H GLU 28 H GLU 28 -4.818 3.540 -3.983
205 HA GLU 28 HA GLU 28 -2.013 3.396 -3.911
206 HB2 GLU 28 HB2 GLU 28 -3.669 2.645 -5.751
207 HB3 GLU 28 HB3 GLU 28 -3.665 4.343 -6.308
208 HG2 GLU 28 HG2 GLU 28 -1.100 4.085 -6.365
209 HG3 GLU 28 HG3 GLU 28 -1.356 2.371 -6.299
210 H LYS 29 H LYS 29 -4.079 6.211 -4.664
211 HA LYS 29 HA LYS 29 -1.936 7.998 -5.279
212 HB2 LYS 29 HB2 LYS 29 -4.265 8.397 -5.898
213 HB3 LYS 29 HB3 LYS 29 -4.737 8.547 -4.200
214 HG2 LYS 29 HG2 LYS 29 -3.394 10.568 -3.941
215 HG3 LYS 29 HG3 LYS 29 -2.697 10.358 -5.560
216 HD2 LYS 29 HD2 LYS 29 -4.392 12.057 -5.622
217 HD3 LYS 29 HD3 LYS 29 -4.920 10.663 -6.565
218 HE2 LYS 29 HE2 LYS 29 -6.415 9.958 -4.727
219 HE3 LYS 29 HE3 LYS 29 -5.761 11.237 -3.685
220 HZ1 LYS 29 HZ1 LYS 29 -7.835 11.927 -4.580
221 HZ2 LYS 29 HZ2 LYS 29 -6.638 12.849 -5.266
222 HZ3 LYS 29 HZ3 LYS 29 -7.348 11.646 -6.138
223 H VAL 30 H VAL 30 -3.618 7.340 -2.177
224 HA VAL 30 HA VAL 30 -2.128 9.293 -0.674
225 HB VAL 30 HB VAL 30 -3.848 6.869 0.034
226 HG11 VAL 30 HG11 VAL 30 -2.372 7.293 1.979
227 HG12 VAL 30 HG12 VAL 30 -2.831 8.992 1.943
228 HG13 VAL 30 HG13 VAL 30 -4.049 7.760 2.323
229 HG21 VAL 30 HG21 VAL 30 -4.389 9.855 0.203
230 HG22 VAL 30 HG22 VAL 30 -5.015 8.802 -1.073
231 HG23 VAL 30 HG23 VAL 30 -5.541 8.562 0.600
232 H PHE 31 H PHE 31 -1.904 5.662 -0.673
233 HA PHE 31 HA PHE 31 0.328 5.537 1.013
234 HB2 PHE 31 HB2 PHE 31 -0.630 3.588 -1.098
235 HB3 PHE 31 HB3 PHE 31 0.473 3.197 0.201
236 HD1 PHE 31 HD2 PHE 31 -1.512 5.213 2.101
237 HD2 PHE 31 HD1 PHE 31 -1.859 1.547 -0.148
238 HE1 PHE 31 HE2 PHE 31 -3.530 4.683 3.305
239 HE2 PHE 31 HE1 PHE 31 -3.864 0.954 1.146
240 HZ PHE 31 HZ PHE 31 -4.792 2.529 2.810
241 H LYS 32 H LYS 32 0.348 6.039 -2.521
242 HA LYS 32 HA LYS 32 3.052 5.242 -2.840
243 HB2 LYS 32 HB2 LYS 32 1.331 5.588 -4.602
244 HB3 LYS 32 HB3 LYS 32 1.596 7.343 -4.476
245 HG2 LYS 32 HG2 LYS 32 3.922 7.034 -5.140
246 HG3 LYS 32 HG3 LYS 32 3.765 5.271 -5.086
247 HD2 LYS 32 HD2 LYS 32 2.109 7.026 -6.925
248 HD3 LYS 32 HD3 LYS 32 3.652 6.316 -7.409
249 HE2 LYS 32 HE2 LYS 32 2.850 4.082 -7.188
250 HE3 LYS 32 HE3 LYS 32 1.375 4.601 -6.365
251 HZ1 LYS 32 HZ1 LYS 32 0.670 5.677 -8.399
252 HZ2 LYS 32 HZ2 LYS 32 2.022 5.109 -9.203
253 HZ3 LYS 32 HZ3 LYS 32 0.875 4.091 -8.602
254 H GLN 33 H GLN 33 1.764 8.251 -1.482
255 HA GLN 33 HA GLN 33 4.186 9.807 -1.748
256 HB2 GLN 33 HB2 GLN 33 1.962 9.820 0.363
257 HB3 GLN 33 HB3 GLN 33 3.299 10.958 0.329
258 HG2 GLN 33 HG2 GLN 33 2.518 11.899 -1.788
259 HG3 GLN 33 HG3 GLN 33 1.231 10.676 -1.861
260 HE21 GLN 33 HE22 GLN 33 -0.517 12.192 -1.740
261 HE22 GLN 33 HE21 GLN 33 -0.855 13.076 -0.250
262 H TYR 34 H TYR 34 2.779 8.004 0.944
263 HA TYR 34 HA TYR 34 4.872 8.085 2.765
264 HB2 TYR 34 HB2 TYR 34 2.650 7.525 3.427
265 HB3 TYR 34 HB3 TYR 34 2.562 6.173 2.300
266 HD1 TYR 34 HD2 TYR 34 4.328 7.374 5.376
267 HD2 TYR 34 HD1 TYR 34 3.316 4.018 2.880
268 HE1 TYR 34 HE2 TYR 34 5.407 5.843 6.995
269 HE2 TYR 34 HE1 TYR 34 4.236 2.472 4.578
270 HH TYR 34 HH TYR 34 4.993 2.343 6.787
271 H ALA 35 H ALA 35 4.237 5.496 0.311
272 HA ALA 35 HA ALA 35 6.351 3.804 1.140
273 HB1 ALA 35 HB1 ALA 35 6.253 2.897 -1.174
274 HB2 ALA 35 HB2 ALA 35 4.633 3.078 -0.453
275 HB3 ALA 35 HB3 ALA 35 5.229 4.252 -1.656
276 H ASN 36 H ASN 36 6.378 6.326 -1.444
277 HA ASN 36 HA ASN 36 9.123 6.081 -1.985
278 HB2 ASN 36 HB2 ASN 36 7.510 7.287 -3.442
279 HB3 ASN 36 HB3 ASN 36 7.426 8.603 -2.258
280 HD21 ASN 36 HD22 ASN 36 9.010 10.293 -2.571
281 HD22 ASN 36 HD21 ASN 36 10.461 10.013 -3.506
282 H ASP 37 H ASP 37 7.474 8.211 0.379
283 HA ASP 37 HA ASP 37 9.837 9.619 1.176
284 HB2 ASP 37 HB2 ASP 37 7.548 10.448 1.532
285 HB3 ASP 37 HB3 ASP 37 7.243 9.139 2.673
286 H ASN 38 H ASN 38 8.796 6.395 1.873
287 HA ASN 38 HA ASN 38 10.502 6.152 4.290
288 HB2 ASN 38 HB2 ASN 38 8.066 5.339 4.104
289 HB3 ASN 38 HB3 ASN 38 8.684 4.055 3.065
290 HD21 ASN 38 HD22 ASN 38 7.315 3.362 5.397
291 HD22 ASN 38 HD21 ASN 38 8.459 2.705 6.533
292 H GLY 39 H GLY 39 10.891 5.856 0.934
293 HA2 GLY 39 HA2 GLY 39 12.841 5.154 -0.139
294 HA3 GLY 39 HA3 GLY 39 13.347 4.280 1.292
295 H VAL 40 H VAL 40 10.101 3.805 -0.154
296 HA VAL 40 HA VAL 40 10.992 1.198 -1.274
297 HB VAL 40 HB VAL 40 8.444 1.760 0.308
298 HG11 VAL 40 HG11 VAL 40 9.479 -0.841 -0.915
299 HG12 VAL 40 HG12 VAL 40 8.089 -0.727 0.156
300 HG13 VAL 40 HG13 VAL 40 8.031 0.057 -1.420
301 HG21 VAL 40 HG21 VAL 40 10.906 0.132 1.049
302 HG22 VAL 40 HG22 VAL 40 10.321 1.607 1.853
303 HG23 VAL 40 HG23 VAL 40 9.381 0.115 1.948
304 H ASP 41 H ASP 41 9.963 0.606 -3.164
305 HA ASP 41 HA ASP 41 7.744 1.931 -4.306
306 HB2 ASP 41 HB2 ASP 41 9.287 3.775 -4.839
307 HB3 ASP 41 HB3 ASP 41 10.402 2.643 -5.626
308 H GLY 42 H GLY 42 6.982 -0.085 -4.718
309 HA2 GLY 42 HA2 GLY 42 8.631 -1.901 -6.417
310 HA3 GLY 42 HA3 GLY 42 7.815 -2.480 -4.952
311 H GLU 43 H GLU 43 6.819 -3.948 -6.387
312 HA GLU 43 HA GLU 43 4.962 -3.017 -8.412
313 HB2 GLU 43 HB2 GLU 43 6.366 -5.063 -8.520
314 HB3 GLU 43 HB3 GLU 43 5.408 -5.783 -7.220
315 HG2 GLU 43 HG2 GLU 43 3.413 -5.757 -8.594
316 HG3 GLU 43 HG3 GLU 43 4.197 -4.718 -9.812
317 H TRP 44 H TRP 44 3.287 -1.979 -7.710
318 HA TRP 44 HA TRP 44 1.967 -2.254 -5.175
319 HB2 TRP 44 HB2 TRP 44 1.367 -0.737 -7.758
320 HB3 TRP 44 HB3 TRP 44 0.385 -0.603 -6.320
321 HD1 TRP 44 HD1 TRP 44 3.850 0.363 -7.626
322 HE1 TRP 44 HE1 TRP 44 4.878 2.148 -6.127
323 HE3 TRP 44 HE3 TRP 44 0.457 0.205 -3.830
324 HZ2 TRP 44 HZ2 TRP 44 4.308 3.331 -3.549
325 HZ3 TRP 44 HZ3 TRP 44 0.768 1.625 -1.802
326 HH2 TRP 44 HH2 TRP 44 2.675 3.185 -1.664
327 H THR 45 H THR 45 0.790 -4.113 -4.759
328 HA THR 45 HA THR 45 -1.228 -4.960 -6.797
329 HB THR 45 HB THR 45 0.339 -6.716 -4.896
330 HG1 THR 45 HG1 THR 45 1.659 -5.849 -6.521
331 HG21 THR 45 HG21 THR 45 -0.496 -8.580 -6.253
332 HG22 THR 45 HG22 THR 45 -1.884 -7.635 -5.659
333 HG23 THR 45 HG23 THR 45 -1.332 -7.457 -7.337
334 H TYR 46 H TYR 46 -3.338 -5.278 -5.924
335 HA TYR 46 HA TYR 46 -3.686 -4.837 -3.019
336 HB2 TYR 46 HB2 TYR 46 -5.496 -3.327 -3.466
337 HB3 TYR 46 HB3 TYR 46 -4.094 -2.757 -4.353
338 HD1 TYR 46 HD1 TYR 46 -3.953 -3.050 -6.868
339 HD2 TYR 46 HD2 TYR 46 -7.483 -4.139 -4.618
340 HE1 TYR 46 HE1 TYR 46 -5.178 -3.452 -8.972
341 HE2 TYR 46 HE2 TYR 46 -8.704 -4.539 -6.719
342 HH TYR 46 HH TYR 46 -7.121 -4.399 -9.906
343 H ASP 47 H ASP 47 -5.540 -5.803 -2.117
344 HA ASP 47 HA ASP 47 -7.170 -7.590 -3.829
345 HB2 ASP 47 HB2 ASP 47 -5.395 -9.081 -3.099
346 HB3 ASP 47 HB3 ASP 47 -5.629 -8.568 -1.406
347 H ASP 48 H ASP 48 -9.158 -6.803 -3.410
348 HA ASP 48 HA ASP 48 -9.763 -5.360 -0.995
349 HB2 ASP 48 HB2 ASP 48 -11.792 -4.846 -1.941
350 HB3 ASP 48 HB3 ASP 48 -10.795 -5.077 -3.372
351 H ALA 49 H ALA 49 -9.899 -8.790 -1.769
352 HA ALA 49 HA ALA 49 -12.021 -9.423 0.081
353 HB1 ALA 49 HB1 ALA 49 -9.810 -11.172 -1.081
354 HB2 ALA 49 HB2 ALA 49 -11.225 -11.749 -0.178
355 HB3 ALA 49 HB3 ALA 49 -11.440 -10.940 -1.746
356 H THR 50 H THR 50 -8.449 -9.742 0.243
357 HA THR 50 HA THR 50 -8.355 -10.274 3.091
358 HB THR 50 HB THR 50 -6.120 -9.588 1.153
359 HG1 THR 50 HG1 THR 50 -7.027 -11.152 0.170
360 HG21 THR 50 HG21 THR 50 -5.336 -9.754 3.483
361 HG22 THR 50 HG22 THR 50 -6.136 -11.330 3.660
362 HG23 THR 50 HG23 THR 50 -4.770 -11.129 2.540
363 H LYS 51 H LYS 51 -8.527 -7.413 1.168
364 HA LYS 51 HA LYS 51 -8.465 -5.198 1.614
365 HB2 LYS 51 HB2 LYS 51 -8.765 -6.111 4.504
366 HB3 LYS 51 HB3 LYS 51 -8.795 -4.426 4.015
367 HG2 LYS 51 HG2 LYS 51 -10.881 -4.570 3.049
368 HG3 LYS 51 HG3 LYS 51 -10.564 -6.176 2.432
369 HD2 LYS 51 HD2 LYS 51 -10.873 -7.092 4.770
370 HD3 LYS 51 HD3 LYS 51 -11.391 -5.474 5.264
371 HE2 LYS 51 HE2 LYS 51 -13.316 -6.928 4.741
372 HE3 LYS 51 HE3 LYS 51 -13.245 -5.542 3.642
373 HZ1 LYS 51 HZ1 LYS 51 -12.164 -8.208 2.908
374 HZ2 LYS 51 HZ2 LYS 51 -13.700 -7.716 2.563
375 HZ3 LYS 51 HZ3 LYS 51 -12.413 -6.925 1.927
376 H THR 52 H THR 52 -6.191 -6.172 0.783
377 HA THR 52 HA THR 52 -4.155 -4.807 2.448
378 HB THR 52 HB THR 52 -2.599 -6.682 1.544
379 HG1 THR 52 HG1 THR 52 -3.726 -7.958 0.260
380 HG21 THR 52 HG21 THR 52 -3.253 -6.438 3.928
381 HG22 THR 52 HG22 THR 52 -4.704 -7.407 3.619
382 HG23 THR 52 HG23 THR 52 -3.096 -8.137 3.437
383 H PHE 53 H PHE 53 -2.393 -3.974 1.322
384 HA PHE 53 HA PHE 53 -2.445 -3.793 -1.578
385 HB2 PHE 53 HB2 PHE 53 -3.645 -1.774 -0.202
386 HB3 PHE 53 HB3 PHE 53 -1.990 -1.209 -0.121
387 HD1 PHE 53 HD2 PHE 53 -0.956 -2.158 -2.840
388 HD2 PHE 53 HD1 PHE 53 -4.701 -0.318 -1.706
389 HE1 PHE 53 HE2 PHE 53 -1.264 -1.330 -5.144
390 HE2 PHE 53 HE1 PHE 53 -4.947 0.557 -4.003
391 HZ PHE 53 HZ PHE 53 -3.233 0.079 -5.730
392 H THR 54 H THR 54 -0.523 -4.862 -1.783
393 HA THR 54 HA THR 54 1.636 -4.278 0.143
394 HB THR 54 HB THR 54 1.280 -6.713 -1.601
395 HG1 THR 54 HG1 THR 54 0.635 -7.678 0.384
396 HG21 THR 54 HG21 THR 54 3.626 -6.277 -0.825
397 HG22 THR 54 HG22 THR 54 3.051 -6.231 0.845
398 HG23 THR 54 HG23 THR 54 2.946 -7.733 -0.106
399 H VAL 55 H VAL 55 3.558 -3.609 -0.507
400 HA VAL 55 HA VAL 55 4.004 -2.933 -3.376
401 HB VAL 55 HB VAL 55 5.214 -1.563 -0.912
402 HG11 VAL 55 HG11 VAL 55 6.470 -1.334 -3.003
403 HG12 VAL 55 HG12 VAL 55 5.008 -0.755 -3.851
404 HG13 VAL 55 HG13 VAL 55 5.740 0.217 -2.552
405 HG21 VAL 55 HG21 VAL 55 2.748 -0.777 -2.480
406 HG22 VAL 55 HG22 VAL 55 2.852 -1.121 -0.742
407 HG23 VAL 55 HG23 VAL 55 3.641 0.317 -1.387
408 H THR 56 H THR 56 5.051 -4.875 -3.943
409 HA THR 56 HA THR 56 7.104 -5.931 -2.081
410 HB THR 56 HB THR 56 5.914 -7.297 -4.514
411 HG1 THR 56 HG1 THR 56 4.198 -7.148 -3.323
412 HG21 THR 56 HG21 THR 56 7.299 -8.386 -2.006
413 HG22 THR 56 HG22 THR 56 6.606 -9.352 -3.332
414 HG23 THR 56 HG23 THR 56 7.984 -8.311 -3.647
415 H GLU 57 H GLU 57 9.238 -5.927 -2.568
416 HA GLU 57 HA GLU 57 10.189 -5.160 -5.259
417 HB2 GLU 57 HB2 GLU 57 11.243 -4.372 -2.500
418 HB3 GLU 57 HB3 GLU 57 12.093 -4.111 -4.024
419 HG2 GLU 57 HG2 GLU 57 9.997 -2.810 -4.771
420 HG3 GLU 57 HG3 GLU 57 9.538 -2.760 -3.057
Start of MODEL 6
1 H1 MET 1 H MET 1 -18.387 2.877 2.649
2 HA MET 1 HA MET 1 -16.018 2.885 2.195
3 HB2 MET 1 HB2 MET 1 -16.993 3.877 4.429
4 HB3 MET 1 HB3 MET 1 -16.252 2.479 5.201
5 HG2 MET 1 HG2 MET 1 -14.803 4.467 5.212
6 HG3 MET 1 HG3 MET 1 -14.058 3.139 4.322
7 HE1 MET 1 HE1 MET 1 -13.352 6.296 4.415
8 HE2 MET 1 HE2 MET 1 -12.338 5.191 3.479
9 HE3 MET 1 HE3 MET 1 -12.950 6.678 2.734
10 H GLY 2 H GLY 2 -14.131 1.679 1.927
11 HA2 GLY 2 HA2 GLY 2 -14.000 -1.022 3.158
12 HA3 GLY 2 HA3 GLY 2 -13.493 -0.646 1.507
13 H THR 3 H THR 3 -12.010 -1.609 3.964
14 HA THR 3 HA THR 3 -10.105 0.605 4.422
15 HB THR 3 HB THR 3 -10.239 -2.105 5.780
16 HG1 THR 3 HG1 THR 3 -12.103 -1.271 6.318
17 HG21 THR 3 HG21 THR 3 -9.104 -0.877 7.626
18 HG22 THR 3 HG22 THR 3 -8.133 -0.884 6.145
19 HG23 THR 3 HG23 THR 3 -9.032 0.581 6.612
20 H TYR 4 H TYR 4 -7.836 0.361 3.864
21 HA TYR 4 HA TYR 4 -7.139 -2.043 2.266
22 HB2 TYR 4 HB2 TYR 4 -6.684 0.881 1.590
23 HB3 TYR 4 HB3 TYR 4 -5.674 -0.410 0.962
24 HD1 TYR 4 HD1 TYR 4 -6.522 -2.091 -0.640
25 HD2 TYR 4 HD2 TYR 4 -8.987 1.188 0.729
26 HE1 TYR 4 HE1 TYR 4 -8.028 -2.430 -2.562
27 HE2 TYR 4 HE2 TYR 4 -10.506 0.844 -1.192
28 HH TYR 4 HH TYR 4 -9.970 -1.682 -3.687
29 H LYS 5 H LYS 5 -5.891 -3.069 3.739
30 HA LYS 5 HA LYS 5 -4.172 -1.598 5.593
31 HB2 LYS 5 HB2 LYS 5 -5.291 -3.803 6.100
32 HB3 LYS 5 HB3 LYS 5 -4.263 -4.570 4.877
33 HG2 LYS 5 HG2 LYS 5 -2.235 -3.861 6.154
34 HG3 LYS 5 HG3 LYS 5 -3.295 -3.065 7.338
35 HD2 LYS 5 HD2 LYS 5 -4.416 -5.306 7.692
36 HD3 LYS 5 HD3 LYS 5 -3.116 -6.042 6.711
37 HE2 LYS 5 HE2 LYS 5 -1.456 -4.984 8.290
38 HE3 LYS 5 HE3 LYS 5 -2.814 -4.397 9.270
39 HZ1 LYS 5 HZ1 LYS 5 -3.464 -6.786 9.442
40 HZ2 LYS 5 HZ2 LYS 5 -1.974 -7.168 8.806
41 HZ3 LYS 5 HZ3 LYS 5 -2.065 -6.342 10.221
42 H LEU 6 H LEU 6 -1.957 -1.150 5.146
43 HA LEU 6 HA LEU 6 -1.013 -1.919 2.428
44 HB2 LEU 6 HB2 LEU 6 -1.411 0.535 3.261
45 HB3 LEU 6 HB3 LEU 6 0.056 0.297 4.175
46 HG LEU 6 HG LEU 6 -0.419 0.661 1.251
47 HD11 LEU 6 HD11 LEU 6 0.553 2.377 2.804
48 HD12 LEU 6 HD12 LEU 6 1.953 1.332 3.048
49 HD13 LEU 6 HD13 LEU 6 1.608 1.961 1.441
50 HD21 LEU 6 HD21 LEU 6 1.734 -0.158 0.525
51 HD22 LEU 6 HD22 LEU 6 2.050 -0.909 2.092
52 HD23 LEU 6 HD23 LEU 6 0.734 -1.507 1.036
53 H ILE 7 H ILE 7 0.672 -3.312 2.324
54 HA ILE 7 HA ILE 7 2.444 -3.697 4.682
55 HB ILE 7 HB ILE 7 1.529 -5.719 2.587
56 HG12 ILE 7 HG12 ILE 7 0.985 -7.000 4.814
57 HG13 ILE 7 HG13 ILE 7 0.997 -5.413 5.573
58 HG21 ILE 7 HG21 ILE 7 3.913 -6.024 3.041
59 HG22 ILE 7 HG22 ILE 7 3.630 -5.914 4.792
60 HG23 ILE 7 HG23 ILE 7 3.006 -7.286 3.856
61 HD11 ILE 7 HD11 ILE 7 -0.771 -6.261 3.226
62 HD12 ILE 7 HD12 ILE 7 -1.263 -6.247 4.930
63 HD13 ILE 7 HD13 ILE 7 -0.897 -4.726 4.113
64 H LEU 8 H LEU 8 4.198 -2.588 4.283
65 HA LEU 8 HA LEU 8 5.147 -2.000 1.551
66 HB2 LEU 8 HB2 LEU 8 5.120 -0.582 4.023
67 HB3 LEU 8 HB3 LEU 8 6.775 -1.144 3.876
68 HG LEU 8 HG LEU 8 6.888 -0.108 1.613
69 HD11 LEU 8 HD11 LEU 8 5.221 1.599 1.011
70 HD12 LEU 8 HD12 LEU 8 4.452 0.013 1.113
71 HD13 LEU 8 HD13 LEU 8 4.251 1.165 2.439
72 HD21 LEU 8 HD21 LEU 8 7.791 1.003 3.637
73 HD22 LEU 8 HD22 LEU 8 7.168 2.182 2.477
74 HD23 LEU 8 HD23 LEU 8 6.210 1.770 3.916
75 H ASN 9 H ASN 9 6.445 -3.661 0.638
76 HA ASN 9 HA ASN 9 8.271 -5.120 2.490
77 HB2 ASN 9 HB2 ASN 9 6.321 -6.516 1.833
78 HB3 ASN 9 HB3 ASN 9 6.746 -6.293 0.134
79 HD21 ASN 9 HD22 ASN 9 9.138 -6.917 -0.408
80 HD22 ASN 9 HD21 ASN 9 9.624 -8.455 0.288
81 H GLY 10 H GLY 10 9.752 -3.376 1.988
82 HA2 GLY 10 HA2 GLY 10 10.502 -3.037 -0.787
83 HA3 GLY 10 HA3 GLY 10 11.101 -2.148 0.620
84 H LYS 11 H LYS 11 12.922 -2.721 -1.135
85 HA LYS 11 HA LYS 11 14.203 -5.294 -0.634
86 HB2 LYS 11 HB2 LYS 11 15.824 -4.807 -2.192
87 HB3 LYS 11 HB3 LYS 11 14.293 -4.303 -2.858
88 HG2 LYS 11 HG2 LYS 11 16.284 -2.299 -1.683
89 HG3 LYS 11 HG3 LYS 11 16.415 -2.909 -3.325
90 HD2 LYS 11 HD2 LYS 11 14.052 -2.146 -3.743
91 HD3 LYS 11 HD3 LYS 11 14.136 -1.347 -2.154
92 HE2 LYS 11 HE2 LYS 11 15.804 0.171 -2.895
93 HE3 LYS 11 HE3 LYS 11 16.027 -0.686 -4.424
94 HZ1 LYS 11 HZ1 LYS 11 13.401 0.477 -3.691
95 HZ2 LYS 11 HZ2 LYS 11 14.553 1.368 -4.513
96 HZ3 LYS 11 HZ3 LYS 11 13.875 0.010 -5.127
97 H THR 12 H THR 12 14.251 -2.402 1.123
98 HA THR 12 HA THR 12 16.643 -3.429 2.581
99 HB THR 12 HB THR 12 16.134 -0.467 2.173
100 HG1 THR 12 HG1 THR 12 17.416 -0.440 0.498
101 HG21 THR 12 HG21 THR 12 17.659 -0.979 4.009
102 HG22 THR 12 HG22 THR 12 18.583 -2.108 2.989
103 HG23 THR 12 HG23 THR 12 18.613 -0.368 2.659
104 H LEU 13 H LEU 13 13.384 -1.989 2.785
105 HA LEU 13 HA LEU 13 13.375 -2.562 5.639
106 HB2 LEU 13 HB2 LEU 13 12.653 -0.440 6.378
107 HB3 LEU 13 HB3 LEU 13 14.131 -0.201 5.489
108 HG LEU 13 HG LEU 13 12.757 1.620 5.040
109 HD11 LEU 13 HD11 LEU 13 13.935 0.743 3.045
110 HD12 LEU 13 HD12 LEU 13 12.431 -0.077 2.568
111 HD13 LEU 13 HD13 LEU 13 12.493 1.690 2.660
112 HD21 LEU 13 HD21 LEU 13 10.533 1.690 4.252
113 HD22 LEU 13 HD22 LEU 13 10.432 -0.055 4.056
114 HD23 LEU 13 HD23 LEU 13 10.554 0.652 5.687
115 H LYS 14 H LYS 14 11.144 -2.364 6.538
116 HA LYS 14 HA LYS 14 9.012 -2.775 4.527
117 HB2 LYS 14 HB2 LYS 14 9.473 -4.516 6.991
118 HB3 LYS 14 HB3 LYS 14 8.154 -4.665 5.822
119 HG2 LYS 14 HG2 LYS 14 10.081 -4.909 4.041
120 HG3 LYS 14 HG3 LYS 14 11.092 -5.265 5.466
121 HD2 LYS 14 HD2 LYS 14 9.418 -7.045 6.083
122 HD3 LYS 14 HD3 LYS 14 8.592 -6.724 4.534
123 HE2 LYS 14 HE2 LYS 14 10.877 -7.117 3.418
124 HE3 LYS 14 HE3 LYS 14 11.446 -7.701 4.988
125 HZ1 LYS 14 HZ1 LYS 14 9.289 -8.839 3.333
126 HZ2 LYS 14 HZ2 LYS 14 10.756 -9.514 3.685
127 HZ3 LYS 14 HZ3 LYS 14 9.572 -9.328 4.860
128 H GLY 15 H GLY 15 6.775 -2.752 5.594
129 HA2 GLY 15 HA2 GLY 15 6.542 -1.325 8.100
130 HA3 GLY 15 HA3 GLY 15 6.163 -0.328 6.679
131 H GLU 16 H GLU 16 4.194 -0.914 8.601
132 HA GLU 16 HA GLU 16 2.234 -2.331 6.964
133 HB2 GLU 16 HB2 GLU 16 3.117 -4.082 8.528
134 HB3 GLU 16 HB3 GLU 16 2.638 -3.048 9.891
135 HG2 GLU 16 HG2 GLU 16 0.256 -3.057 8.855
136 HG3 GLU 16 HG3 GLU 16 0.842 -4.306 7.759
137 H THR 17 H THR 17 0.610 -0.840 6.801
138 HA THR 17 HA THR 17 -0.250 0.763 9.128
139 HB THR 17 HB THR 17 -0.369 2.757 7.509
140 HG1 THR 17 HG1 THR 17 1.374 2.714 5.987
141 HG21 THR 17 HG21 THR 17 1.234 2.623 9.416
142 HG22 THR 17 HG22 THR 17 2.425 1.863 8.332
143 HG23 THR 17 HG23 THR 17 1.872 3.527 8.034
144 H THR 18 H THR 18 -2.426 2.082 8.088
145 HA THR 18 HA THR 18 -3.805 0.514 6.135
146 HB THR 18 HB THR 18 -4.113 -1.033 7.946
147 HG1 THR 18 HG1 THR 18 -6.546 0.307 7.969
148 HG21 THR 18 HG21 THR 18 -3.729 0.382 9.928
149 HG22 THR 18 HG22 THR 18 -5.273 1.209 9.644
150 HG23 THR 18 HG23 THR 18 -5.240 -0.524 10.029
151 H THR 19 H THR 19 -5.498 1.709 5.269
152 HA THR 19 HA THR 19 -6.508 4.051 6.580
153 HB THR 19 HB THR 19 -4.926 4.394 4.004
154 HG1 THR 19 HG1 THR 19 -4.273 4.469 6.616
155 HG21 THR 19 HG21 THR 19 -5.311 6.826 4.405
156 HG22 THR 19 HG22 THR 19 -6.816 5.951 4.070
157 HG23 THR 19 HG23 THR 19 -6.414 6.410 5.740
158 H GLU 20 H GLU 20 -8.590 4.528 5.735
159 HA GLU 20 HA GLU 20 -9.601 2.464 3.872
160 HB2 GLU 20 HB2 GLU 20 -11.834 3.240 4.658
161 HB3 GLU 20 HB3 GLU 20 -10.805 2.520 5.908
162 HG2 GLU 20 HG2 GLU 20 -10.232 4.769 6.774
163 HG3 GLU 20 HG3 GLU 20 -11.195 5.526 5.488
164 H ALA 21 H ALA 21 -10.726 2.970 1.995
165 HA ALA 21 HA ALA 21 -10.980 5.712 1.116
166 HB1 ALA 21 HB1 ALA 21 -9.098 3.806 -0.355
167 HB2 ALA 21 HB2 ALA 21 -9.567 5.431 -0.891
168 HB3 ALA 21 HB3 ALA 21 -8.566 5.240 0.564
169 H VAL 22 H VAL 22 -12.383 5.856 -0.649
170 HA VAL 22 HA VAL 22 -14.286 3.811 -0.929
171 HB VAL 22 HB VAL 22 -14.684 6.223 -1.174
172 HG11 VAL 22 HG11 VAL 22 -14.197 7.433 -3.227
173 HG12 VAL 22 HG12 VAL 22 -12.682 6.857 -2.520
174 HG13 VAL 22 HG13 VAL 22 -13.387 6.026 -3.920
175 HG21 VAL 22 HG21 VAL 22 -16.346 6.130 -2.912
176 HG22 VAL 22 HG22 VAL 22 -15.556 4.728 -3.672
177 HG23 VAL 22 HG23 VAL 22 -16.306 4.569 -2.066
178 H ASP 23 H ASP 23 -11.230 4.303 -2.731
179 HA ASP 23 HA ASP 23 -11.849 1.837 -4.169
180 HB2 ASP 23 HB2 ASP 23 -12.430 4.289 -5.414
181 HB3 ASP 23 HB3 ASP 23 -10.765 3.979 -5.965
182 H ALA 24 H ALA 24 -10.009 0.926 -5.212
183 HA ALA 24 HA ALA 24 -7.655 1.081 -3.646
184 HB1 ALA 24 HB1 ALA 24 -8.107 -0.155 -6.379
185 HB2 ALA 24 HB2 ALA 24 -6.647 -0.386 -5.407
186 HB3 ALA 24 HB3 ALA 24 -8.203 -0.974 -4.815
187 H ALA 25 H ALA 25 -8.428 2.673 -6.769
188 HA ALA 25 HA ALA 25 -5.848 3.577 -7.418
189 HB1 ALA 25 HB1 ALA 25 -7.774 3.733 -8.944
190 HB2 ALA 25 HB2 ALA 25 -8.533 4.952 -7.893
191 HB3 ALA 25 HB3 ALA 25 -7.011 5.321 -8.732
192 H THR 26 H THR 26 -8.318 5.070 -5.281
193 HA THR 26 HA THR 26 -6.758 7.415 -4.694
194 HB THR 26 HB THR 26 -9.093 6.125 -3.203
195 HG1 THR 26 HG1 THR 26 -9.950 8.126 -4.562
196 HG21 THR 26 HG21 THR 26 -7.942 7.834 -1.828
197 HG22 THR 26 HG22 THR 26 -8.055 8.996 -3.157
198 HG23 THR 26 HG23 THR 26 -9.522 8.402 -2.358
199 H ALA 27 H ALA 27 -7.319 4.268 -3.001
200 HA ALA 27 HA ALA 27 -5.774 4.821 -0.736
201 HB1 ALA 27 HB1 ALA 27 -6.022 2.139 -2.184
202 HB2 ALA 27 HB2 ALA 27 -5.512 2.384 -0.506
203 HB3 ALA 27 HB3 ALA 27 -7.169 2.776 -0.991
204 H GLU 28 H GLU 28 -4.773 3.486 -3.890
205 HA GLU 28 HA GLU 28 -2.045 3.085 -3.449
206 HB2 GLU 28 HB2 GLU 28 -3.368 2.246 -5.376
207 HB3 GLU 28 HB3 GLU 28 -3.551 3.883 -5.976
208 HG2 GLU 28 HG2 GLU 28 -1.011 3.986 -6.153
209 HG3 GLU 28 HG3 GLU 28 -1.010 2.244 -5.853
210 H LYS 29 H LYS 29 -3.589 6.037 -4.966
211 HA LYS 29 HA LYS 29 -1.060 7.366 -5.049
212 HB2 LYS 29 HB2 LYS 29 -3.079 8.004 -6.406
213 HB3 LYS 29 HB3 LYS 29 -3.751 8.789 -4.961
214 HG2 LYS 29 HG2 LYS 29 -1.927 10.375 -4.877
215 HG3 LYS 29 HG3 LYS 29 -0.938 9.408 -5.976
216 HD2 LYS 29 HD2 LYS 29 -1.707 11.352 -7.137
217 HD3 LYS 29 HD3 LYS 29 -2.458 9.904 -7.835
218 HE2 LYS 29 HE2 LYS 29 -4.530 10.356 -6.554
219 HE3 LYS 29 HE3 LYS 29 -3.791 11.802 -5.836
220 HZ1 LYS 29 HZ1 LYS 29 -5.230 12.175 -7.823
221 HZ2 LYS 29 HZ2 LYS 29 -3.706 12.799 -8.003
222 HZ3 LYS 29 HZ3 LYS 29 -4.122 11.390 -8.732
223 H VAL 30 H VAL 30 -3.475 7.295 -2.420
224 HA VAL 30 HA VAL 30 -2.237 9.378 -0.873
225 HB VAL 30 HB VAL 30 -4.063 7.035 -0.232
226 HG11 VAL 30 HG11 VAL 30 -2.758 7.576 1.835
227 HG12 VAL 30 HG12 VAL 30 -3.291 9.264 1.686
228 HG13 VAL 30 HG13 VAL 30 -4.464 7.959 1.977
229 HG21 VAL 30 HG21 VAL 30 -5.778 8.769 -0.009
230 HG22 VAL 30 HG22 VAL 30 -4.573 10.049 -0.272
231 HG23 VAL 30 HG23 VAL 30 -5.002 8.945 -1.584
232 H PHE 31 H PHE 31 -2.007 5.765 -0.632
233 HA PHE 31 HA PHE 31 0.083 5.747 1.241
234 HB2 PHE 31 HB2 PHE 31 -0.830 3.746 -0.858
235 HB3 PHE 31 HB3 PHE 31 0.408 3.384 0.320
236 HD1 PHE 31 HD2 PHE 31 -0.662 4.611 2.848
237 HD2 PHE 31 HD1 PHE 31 -2.617 2.318 -0.247
238 HE1 PHE 31 HE2 PHE 31 -2.241 3.712 4.503
239 HE2 PHE 31 HE1 PHE 31 -4.191 1.414 1.434
240 HZ PHE 31 HZ PHE 31 -3.995 2.105 3.798
241 H LYS 32 H LYS 32 0.300 6.304 -2.206
242 HA LYS 32 HA LYS 32 2.941 5.468 -2.671
243 HB2 LYS 32 HB2 LYS 32 1.160 6.364 -4.293
244 HB3 LYS 32 HB3 LYS 32 1.700 7.981 -3.851
245 HG2 LYS 32 HG2 LYS 32 3.845 7.628 -4.758
246 HG3 LYS 32 HG3 LYS 32 3.679 5.871 -4.788
247 HD2 LYS 32 HD2 LYS 32 1.877 7.650 -6.473
248 HD3 LYS 32 HD3 LYS 32 3.470 7.095 -7.051
249 HE2 LYS 32 HE2 LYS 32 2.821 4.762 -6.718
250 HE3 LYS 32 HE3 LYS 32 1.253 5.254 -6.074
251 HZ1 LYS 32 HZ1 LYS 32 0.593 6.016 -8.155
252 HZ2 LYS 32 HZ2 LYS 32 2.101 5.868 -8.827
253 HZ3 LYS 32 HZ3 LYS 32 1.261 4.523 -8.370
254 H GLN 33 H GLN 33 1.757 8.289 -0.896
255 HA GLN 33 HA GLN 33 4.159 9.833 -0.910
256 HB2 GLN 33 HB2 GLN 33 1.926 9.639 1.176
257 HB3 GLN 33 HB3 GLN 33 3.200 10.859 1.136
258 HG2 GLN 33 HG2 GLN 33 2.391 11.556 -1.146
259 HG3 GLN 33 HG3 GLN 33 1.077 10.391 -1.004
260 HE21 GLN 33 HE22 GLN 33 2.541 12.932 1.190
261 HE22 GLN 33 HE21 GLN 33 1.035 13.802 1.362
262 H TYR 34 H TYR 34 2.870 7.684 1.715
263 HA TYR 34 HA TYR 34 5.191 7.732 3.270
264 HB2 TYR 34 HB2 TYR 34 3.130 7.017 4.205
265 HB3 TYR 34 HB3 TYR 34 2.923 5.738 3.044
266 HD1 TYR 34 HD2 TYR 34 5.873 6.659 5.246
267 HD2 TYR 34 HD1 TYR 34 2.889 3.694 4.261
268 HE1 TYR 34 HE2 TYR 34 6.904 5.097 6.817
269 HE2 TYR 34 HE1 TYR 34 3.883 2.148 5.924
270 HH TYR 34 HH TYR 34 5.455 2.034 7.847
271 H ALA 35 H ALA 35 4.492 5.673 0.450
272 HA ALA 35 HA ALA 35 6.617 3.804 0.979
273 HB1 ALA 35 HB1 ALA 35 6.325 3.164 -1.388
274 HB2 ALA 35 HB2 ALA 35 4.783 3.288 -0.553
275 HB3 ALA 35 HB3 ALA 35 5.300 4.593 -1.657
276 H ASN 36 H ASN 36 6.490 6.622 -1.334
277 HA ASN 36 HA ASN 36 9.290 6.375 -1.808
278 HB2 ASN 36 HB2 ASN 36 7.675 7.590 -3.336
279 HB3 ASN 36 HB3 ASN 36 7.696 8.939 -2.183
280 HD21 ASN 36 HD22 ASN 36 9.061 10.554 -3.265
281 HD22 ASN 36 HD21 ASN 36 10.610 10.103 -3.923
282 H ASP 37 H ASP 37 7.485 8.078 0.663
283 HA ASP 37 HA ASP 37 9.595 9.756 1.590
284 HB2 ASP 37 HB2 ASP 37 7.151 10.035 2.079
285 HB3 ASP 37 HB3 ASP 37 7.258 8.681 3.205
286 H ASN 38 H ASN 38 8.854 6.346 2.151
287 HA ASN 38 HA ASN 38 10.811 6.249 4.374
288 HB2 ASN 38 HB2 ASN 38 8.408 5.322 4.510
289 HB3 ASN 38 HB3 ASN 38 9.012 3.981 3.531
290 HD21 ASN 38 HD22 ASN 38 8.142 2.995 5.769
291 HD22 ASN 38 HD21 ASN 38 9.358 2.841 7.014
292 H GLY 39 H GLY 39 10.662 5.542 1.008
293 HA2 GLY 39 HA2 GLY 39 12.718 5.096 -0.150
294 HA3 GLY 39 HA3 GLY 39 13.302 4.150 1.202
295 H VAL 40 H VAL 40 10.020 3.767 -0.261
296 HA VAL 40 HA VAL 40 10.908 1.192 -1.427
297 HB VAL 40 HB VAL 40 8.342 1.707 0.126
298 HG11 VAL 40 HG11 VAL 40 9.403 -0.855 -1.129
299 HG12 VAL 40 HG12 VAL 40 7.987 -0.764 -0.102
300 HG13 VAL 40 HG13 VAL 40 7.975 0.055 -1.659
301 HG21 VAL 40 HG21 VAL 40 10.823 0.126 0.875
302 HG22 VAL 40 HG22 VAL 40 10.156 1.539 1.720
303 HG23 VAL 40 HG23 VAL 40 9.282 0.006 1.742
304 H ASP 41 H ASP 41 10.083 0.727 -3.411
305 HA ASP 41 HA ASP 41 7.724 1.806 -4.535
306 HB2 ASP 41 HB2 ASP 41 8.981 3.855 -4.911
307 HB3 ASP 41 HB3 ASP 41 10.283 2.938 -5.695
308 H GLY 42 H GLY 42 7.219 -0.234 -5.014
309 HA2 GLY 42 HA2 GLY 42 8.870 -1.797 -6.901
310 HA3 GLY 42 HA3 GLY 42 8.283 -2.538 -5.404
311 H GLU 43 H GLU 43 7.101 -3.981 -7.022
312 HA GLU 43 HA GLU 43 5.020 -2.792 -8.624
313 HB2 GLU 43 HB2 GLU 43 6.193 -4.972 -9.084
314 HB3 GLU 43 HB3 GLU 43 5.252 -5.696 -7.777
315 HG2 GLU 43 HG2 GLU 43 3.159 -5.195 -8.940
316 HG3 GLU 43 HG3 GLU 43 4.022 -4.231 -10.162
317 H TRP 44 H TRP 44 3.023 -2.169 -7.970
318 HA TRP 44 HA TRP 44 2.164 -2.634 -5.175
319 HB2 TRP 44 HB2 TRP 44 1.265 -0.704 -7.378
320 HB3 TRP 44 HB3 TRP 44 0.531 -0.812 -5.796
321 HD1 TRP 44 HD1 TRP 44 3.875 0.229 -7.396
322 HE1 TRP 44 HE1 TRP 44 4.967 2.030 -5.954
323 HE3 TRP 44 HE3 TRP 44 0.568 0.209 -3.533
324 HZ2 TRP 44 HZ2 TRP 44 4.477 3.281 -3.402
325 HZ3 TRP 44 HZ3 TRP 44 0.892 1.736 -1.564
326 HH2 TRP 44 HH2 TRP 44 2.817 3.265 -1.497
327 H THR 45 H THR 45 0.577 -4.217 -4.816
328 HA THR 45 HA THR 45 -1.540 -4.555 -6.874
329 HB THR 45 HB THR 45 -0.398 -6.983 -5.481
330 HG1 THR 45 HG1 THR 45 1.337 -6.244 -6.523
331 HG21 THR 45 HG21 THR 45 -2.564 -7.239 -6.663
332 HG22 THR 45 HG22 THR 45 -1.866 -6.538 -8.125
333 HG23 THR 45 HG23 THR 45 -1.291 -8.103 -7.543
334 H TYR 46 H TYR 46 -3.614 -5.156 -5.985
335 HA TYR 46 HA TYR 46 -3.772 -5.059 -3.027
336 HB2 TYR 46 HB2 TYR 46 -5.611 -3.692 -3.011
337 HB3 TYR 46 HB3 TYR 46 -4.528 -2.941 -4.163
338 HD1 TYR 46 HD2 TYR 46 -7.721 -4.807 -3.743
339 HD2 TYR 46 HD1 TYR 46 -5.113 -2.776 -6.534
340 HE1 TYR 46 HE2 TYR 46 -9.497 -4.893 -5.474
341 HE2 TYR 46 HE1 TYR 46 -6.873 -2.904 -8.264
342 HH TYR 46 HH TYR 46 -8.965 -4.464 -8.711
343 H ASP 47 H ASP 47 -5.448 -6.127 -2.037
344 HA ASP 47 HA ASP 47 -6.821 -8.305 -3.478
345 HB2 ASP 47 HB2 ASP 47 -4.794 -9.298 -2.524
346 HB3 ASP 47 HB3 ASP 47 -5.133 -8.570 -0.955
347 H ASP 48 H ASP 48 -8.799 -7.240 -3.248
348 HA ASP 48 HA ASP 48 -9.517 -5.811 -0.831
349 HB2 ASP 48 HB2 ASP 48 -11.135 -4.982 -2.077
350 HB3 ASP 48 HB3 ASP 48 -10.564 -5.943 -3.437
351 H ALA 49 H ALA 49 -9.618 -9.205 -1.723
352 HA ALA 49 HA ALA 49 -11.725 -10.069 -0.044
353 HB1 ALA 49 HB1 ALA 49 -9.183 -11.548 -0.814
354 HB2 ALA 49 HB2 ALA 49 -10.687 -12.260 -0.181
355 HB3 ALA 49 HB3 ALA 49 -10.680 -11.456 -1.762
356 H THR 50 H THR 50 -8.168 -10.066 0.660
357 HA THR 50 HA THR 50 -8.668 -10.361 3.536
358 HB THR 50 HB THR 50 -5.973 -9.903 2.205
359 HG1 THR 50 HG1 THR 50 -6.681 -11.423 0.987
360 HG21 THR 50 HG21 THR 50 -5.913 -10.060 4.647
361 HG22 THR 50 HG22 THR 50 -6.875 -11.552 4.615
362 HG23 THR 50 HG23 THR 50 -5.223 -11.526 3.951
363 H LYS 51 H LYS 51 -8.640 -7.788 1.360
364 HA LYS 51 HA LYS 51 -8.630 -5.551 1.509
365 HB2 LYS 51 HB2 LYS 51 -8.995 -6.059 4.492
366 HB3 LYS 51 HB3 LYS 51 -9.090 -4.469 3.742
367 HG2 LYS 51 HG2 LYS 51 -10.961 -5.121 2.361
368 HG3 LYS 51 HG3 LYS 51 -10.768 -6.820 2.838
369 HD2 LYS 51 HD2 LYS 51 -11.411 -6.354 5.118
370 HD3 LYS 51 HD3 LYS 51 -11.529 -4.616 4.780
371 HE2 LYS 51 HE2 LYS 51 -13.709 -6.022 4.826
372 HE3 LYS 51 HE3 LYS 51 -13.497 -4.857 3.509
373 HZ1 LYS 51 HZ1 LYS 51 -14.279 -7.190 2.904
374 HZ2 LYS 51 HZ2 LYS 51 -13.126 -6.482 2.006
375 HZ3 LYS 51 HZ3 LYS 51 -12.707 -7.651 3.079
376 H THR 52 H THR 52 -6.249 -6.800 1.098
377 HA THR 52 HA THR 52 -4.305 -5.111 2.594
378 HB THR 52 HB THR 52 -2.666 -6.963 1.964
379 HG1 THR 52 HG1 THR 52 -4.131 -8.059 0.497
380 HG21 THR 52 HG21 THR 52 -4.926 -7.674 3.891
381 HG22 THR 52 HG22 THR 52 -3.299 -8.383 3.869
382 HG23 THR 52 HG23 THR 52 -3.509 -6.673 4.268
383 H PHE 53 H PHE 53 -2.525 -4.296 1.436
384 HA PHE 53 HA PHE 53 -2.605 -4.214 -1.489
385 HB2 PHE 53 HB2 PHE 53 -3.601 -2.124 0.011
386 HB3 PHE 53 HB3 PHE 53 -1.903 -1.699 -0.024
387 HD1 PHE 53 HD2 PHE 53 -1.069 -2.492 -2.798
388 HD2 PHE 53 HD1 PHE 53 -4.704 -0.616 -1.393
389 HE1 PHE 53 HE2 PHE 53 -1.458 -1.527 -5.043
390 HE2 PHE 53 HE1 PHE 53 -5.033 0.392 -3.627
391 HZ PHE 53 HZ PHE 53 -3.422 -0.077 -5.466
392 H THR 54 H THR 54 -0.485 -4.745 -2.129
393 HA THR 54 HA THR 54 1.613 -4.546 -0.057
394 HB THR 54 HB THR 54 1.475 -6.818 -2.036
395 HG1 THR 54 HG1 THR 54 0.626 -7.976 -0.132
396 HG21 THR 54 HG21 THR 54 2.773 -6.407 0.703
397 HG22 THR 54 HG22 THR 54 2.785 -7.931 -0.193
398 HG23 THR 54 HG23 THR 54 3.602 -6.512 -0.863
399 H VAL 55 H VAL 55 3.601 -3.904 -0.669
400 HA VAL 55 HA VAL 55 4.010 -3.060 -3.496
401 HB VAL 55 HB VAL 55 5.405 -1.781 -1.100
402 HG11 VAL 55 HG11 VAL 55 6.440 -1.490 -3.313
403 HG12 VAL 55 HG12 VAL 55 4.897 -0.900 -3.985
404 HG13 VAL 55 HG13 VAL 55 5.757 0.050 -2.749
405 HG21 VAL 55 HG21 VAL 55 2.775 -0.979 -2.347
406 HG22 VAL 55 HG22 VAL 55 3.118 -1.349 -0.649
407 HG23 VAL 55 HG23 VAL 55 3.786 0.122 -1.368
408 H THR 56 H THR 56 5.349 -4.615 -4.322
409 HA THR 56 HA THR 56 7.273 -5.955 -2.474
410 HB THR 56 HB THR 56 5.996 -7.040 -5.001
411 HG1 THR 56 HG1 THR 56 4.523 -7.895 -3.862
412 HG21 THR 56 HG21 THR 56 7.560 -8.410 -2.763
413 HG22 THR 56 HG22 THR 56 6.746 -9.232 -4.112
414 HG23 THR 56 HG23 THR 56 8.112 -8.165 -4.442
415 H GLU 57 H GLU 57 9.244 -5.094 -2.735
416 HA GLU 57 HA GLU 57 10.180 -4.183 -5.412
417 HB2 GLU 57 HB2 GLU 57 11.385 -3.997 -2.622
418 HB3 GLU 57 HB3 GLU 57 12.212 -3.472 -4.101
419 HG2 GLU 57 HG2 GLU 57 10.383 -1.912 -4.585
420 HG3 GLU 57 HG3 GLU 57 9.609 -2.298 -3.045
Start of MODEL 7
1 H1 MET 1 H MET 1 -15.294 0.330 -1.485
2 HA MET 1 HA MET 1 -14.241 2.231 -0.368
3 HB2 MET 1 HB2 MET 1 -16.230 3.642 -0.277
4 HB3 MET 1 HB3 MET 1 -17.006 2.554 0.883
5 HG2 MET 1 HG2 MET 1 -15.553 3.156 2.628
6 HG3 MET 1 HG3 MET 1 -14.298 3.716 1.534
7 HE1 MET 1 HE1 MET 1 -13.800 5.751 3.027
8 HE2 MET 1 HE2 MET 1 -15.008 6.968 3.498
9 HE3 MET 1 HE3 MET 1 -15.104 5.332 4.165
10 H GLY 2 H GLY 2 -12.880 1.461 1.202
11 HA2 GLY 2 HA2 GLY 2 -13.876 -0.181 3.363
12 HA3 GLY 2 HA3 GLY 2 -12.916 -1.072 2.174
13 H THR 3 H THR 3 -12.001 -0.971 4.685
14 HA THR 3 HA THR 3 -9.965 1.116 4.956
15 HB THR 3 HB THR 3 -10.916 -1.057 6.862
16 HG1 THR 3 HG1 THR 3 -12.124 0.714 7.779
17 HG21 THR 3 HG21 THR 3 -9.894 0.310 8.603
18 HG22 THR 3 HG22 THR 3 -8.671 -0.031 7.366
19 HG23 THR 3 HG23 THR 3 -9.441 1.555 7.422
20 H TYR 4 H TYR 4 -8.051 0.664 3.890
21 HA TYR 4 HA TYR 4 -7.447 -2.149 3.272
22 HB2 TYR 4 HB2 TYR 4 -6.256 0.507 2.375
23 HB3 TYR 4 HB3 TYR 4 -5.630 -1.052 1.892
24 HD1 TYR 4 HD1 TYR 4 -6.823 -2.547 0.368
25 HD2 TYR 4 HD2 TYR 4 -8.412 1.333 1.395
26 HE1 TYR 4 HE1 TYR 4 -8.336 -2.680 -1.550
27 HE2 TYR 4 HE2 TYR 4 -9.963 1.203 -0.541
28 HH TYR 4 HH TYR 4 -10.121 -1.702 -2.638
29 H LYS 5 H LYS 5 -5.212 -2.826 3.374
30 HA LYS 5 HA LYS 5 -3.657 -1.940 5.772
31 HB2 LYS 5 HB2 LYS 5 -4.144 -4.748 4.697
32 HB3 LYS 5 HB3 LYS 5 -2.911 -4.349 5.895
33 HG2 LYS 5 HG2 LYS 5 -4.617 -3.719 7.519
34 HG3 LYS 5 HG3 LYS 5 -5.896 -3.956 6.299
35 HD2 LYS 5 HD2 LYS 5 -5.306 -6.317 6.091
36 HD3 LYS 5 HD3 LYS 5 -4.002 -6.143 7.282
37 HE2 LYS 5 HE2 LYS 5 -5.466 -5.934 9.076
38 HE3 LYS 5 HE3 LYS 5 -6.755 -5.234 8.074
39 HZ1 LYS 5 HZ1 LYS 5 -7.304 -7.461 8.739
40 HZ2 LYS 5 HZ2 LYS 5 -7.209 -7.308 7.139
41 HZ3 LYS 5 HZ3 LYS 5 -5.971 -8.076 7.919
42 H LEU 6 H LEU 6 -1.940 -0.894 4.934
43 HA LEU 6 HA LEU 6 -0.892 -1.554 2.284
44 HB2 LEU 6 HB2 LEU 6 -1.214 0.784 3.218
45 HB3 LEU 6 HB3 LEU 6 0.020 0.451 4.409
46 HG LEU 6 HG LEU 6 0.941 1.795 2.670
47 HD11 LEU 6 HD11 LEU 6 2.859 0.661 1.983
48 HD12 LEU 6 HD12 LEU 6 2.408 -0.128 3.510
49 HD13 LEU 6 HD13 LEU 6 2.074 -0.909 1.941
50 HD21 LEU 6 HD21 LEU 6 -0.638 1.274 0.868
51 HD22 LEU 6 HD22 LEU 6 1.026 1.077 0.305
52 HD23 LEU 6 HD23 LEU 6 0.051 -0.346 0.725
53 H ILE 7 H ILE 7 0.645 -3.176 2.116
54 HA ILE 7 HA ILE 7 2.401 -3.735 4.483
55 HB ILE 7 HB ILE 7 1.427 -5.652 2.319
56 HG12 ILE 7 HG12 ILE 7 0.877 -7.082 4.332
57 HG13 ILE 7 HG13 ILE 7 1.242 -5.714 5.377
58 HG21 ILE 7 HG21 ILE 7 3.597 -6.047 4.446
59 HG22 ILE 7 HG22 ILE 7 2.948 -7.315 3.385
60 HG23 ILE 7 HG23 ILE 7 3.861 -5.987 2.693
61 HD11 ILE 7 HD11 ILE 7 -0.678 -4.513 4.569
62 HD12 ILE 7 HD12 ILE 7 -0.925 -5.674 3.233
63 HD13 ILE 7 HD13 ILE 7 -1.196 -6.155 4.923
64 H LEU 8 H LEU 8 4.047 -2.383 4.096
65 HA LEU 8 HA LEU 8 4.954 -1.821 1.347
66 HB2 LEU 8 HB2 LEU 8 4.777 -0.138 3.403
67 HB3 LEU 8 HB3 LEU 8 6.246 -0.918 3.945
68 HG LEU 8 HG LEU 8 7.211 -0.371 1.629
69 HD11 LEU 8 HD11 LEU 8 4.906 1.634 1.599
70 HD12 LEU 8 HD12 LEU 8 6.190 1.469 0.393
71 HD13 LEU 8 HD13 LEU 8 4.986 0.201 0.551
72 HD21 LEU 8 HD21 LEU 8 7.896 0.804 3.651
73 HD22 LEU 8 HD22 LEU 8 7.732 1.975 2.334
74 HD23 LEU 8 HD23 LEU 8 6.460 1.864 3.567
75 H ASN 9 H ASN 9 6.232 -3.431 0.436
76 HA ASN 9 HA ASN 9 8.037 -5.008 2.197
77 HB2 ASN 9 HB2 ASN 9 6.162 -6.340 1.497
78 HB3 ASN 9 HB3 ASN 9 6.337 -5.813 -0.183
79 HD21 ASN 9 HD22 ASN 9 6.823 -7.777 -1.195
80 HD22 ASN 9 HD21 ASN 9 8.249 -8.701 -0.788
81 H GLY 10 H GLY 10 9.664 -3.368 1.853
82 HA2 GLY 10 HA2 GLY 10 10.541 -2.785 -0.862
83 HA3 GLY 10 HA3 GLY 10 11.195 -2.163 0.656
84 H LYS 11 H LYS 11 12.984 -2.708 -1.051
85 HA LYS 11 HA LYS 11 13.987 -5.464 -0.904
86 HB2 LYS 11 HB2 LYS 11 15.633 -4.748 -2.482
87 HB3 LYS 11 HB3 LYS 11 14.097 -4.031 -2.958
88 HG2 LYS 11 HG2 LYS 11 15.063 -1.973 -1.466
89 HG3 LYS 11 HG3 LYS 11 16.603 -2.727 -1.893
90 HD2 LYS 11 HD2 LYS 11 16.014 -2.532 -4.294
91 HD3 LYS 11 HD3 LYS 11 14.439 -1.893 -3.844
92 HE2 LYS 11 HE2 LYS 11 15.639 -0.021 -2.622
93 HE3 LYS 11 HE3 LYS 11 17.135 -0.563 -3.412
94 HZ1 LYS 11 HZ1 LYS 11 16.008 -0.166 -5.550
95 HZ2 LYS 11 HZ2 LYS 11 14.655 0.305 -4.771
96 HZ3 LYS 11 HZ3 LYS 11 16.003 1.223 -4.633
97 H THR 12 H THR 12 14.232 -2.748 1.089
98 HA THR 12 HA THR 12 16.619 -3.907 2.442
99 HB THR 12 HB THR 12 16.315 -0.917 2.365
100 HG1 THR 12 HG1 THR 12 17.101 -0.633 0.473
101 HG21 THR 12 HG21 THR 12 18.758 -2.737 2.274
102 HG22 THR 12 HG22 THR 12 18.781 -0.965 2.419
103 HG23 THR 12 HG23 THR 12 18.104 -1.947 3.728
104 H LEU 13 H LEU 13 13.454 -2.373 2.715
105 HA LEU 13 HA LEU 13 13.444 -2.818 5.563
106 HB2 LEU 13 HB2 LEU 13 12.829 -0.619 6.217
107 HB3 LEU 13 HB3 LEU 13 14.324 -0.497 5.335
108 HG LEU 13 HG LEU 13 13.044 1.360 4.785
109 HD11 LEU 13 HD11 LEU 13 12.685 -0.418 2.359
110 HD12 LEU 13 HD12 LEU 13 12.779 1.346 2.400
111 HD13 LEU 13 HD13 LEU 13 14.199 0.393 2.839
112 HD21 LEU 13 HD21 LEU 13 10.818 1.506 4.042
113 HD22 LEU 13 HD22 LEU 13 10.645 -0.228 3.841
114 HD23 LEU 13 HD23 LEU 13 10.807 0.472 5.472
115 H LYS 14 H LYS 14 11.165 -2.347 6.400
116 HA LYS 14 HA LYS 14 9.048 -2.651 4.363
117 HB2 LYS 14 HB2 LYS 14 9.411 -4.513 6.756
118 HB3 LYS 14 HB3 LYS 14 8.021 -4.470 5.669
119 HG2 LYS 14 HG2 LYS 14 9.629 -4.931 3.740
120 HG3 LYS 14 HG3 LYS 14 10.869 -5.261 4.956
121 HD2 LYS 14 HD2 LYS 14 9.335 -6.985 5.966
122 HD3 LYS 14 HD3 LYS 14 8.197 -6.670 4.630
123 HE2 LYS 14 HE2 LYS 14 10.255 -7.094 3.091
124 HE3 LYS 14 HE3 LYS 14 11.011 -7.835 4.509
125 HZ1 LYS 14 HZ1 LYS 14 9.083 -9.360 4.582
126 HZ2 LYS 14 HZ2 LYS 14 8.423 -8.587 3.303
127 HZ3 LYS 14 HZ3 LYS 14 9.829 -9.402 3.079
128 H GLY 15 H GLY 15 6.838 -2.458 5.464
129 HA2 GLY 15 HA2 GLY 15 6.719 -1.077 8.001
130 HA3 GLY 15 HA3 GLY 15 6.463 -0.008 6.615
131 H GLU 16 H GLU 16 4.398 -0.563 8.507
132 HA GLU 16 HA GLU 16 2.407 -1.766 6.701
133 HB2 GLU 16 HB2 GLU 16 3.246 -3.673 8.094
134 HB3 GLU 16 HB3 GLU 16 2.743 -2.788 9.536
135 HG2 GLU 16 HG2 GLU 16 0.373 -2.745 8.501
136 HG3 GLU 16 HG3 GLU 16 0.986 -3.876 7.294
137 H THR 17 H THR 17 0.762 -0.280 6.613
138 HA THR 17 HA THR 17 -0.074 1.139 9.073
139 HB THR 17 HB THR 17 -0.220 3.205 7.511
140 HG1 THR 17 HG1 THR 17 1.546 3.161 5.968
141 HG21 THR 17 HG21 THR 17 2.035 3.930 8.057
142 HG22 THR 17 HG22 THR 17 1.398 2.977 9.408
143 HG23 THR 17 HG23 THR 17 2.576 2.259 8.297
144 H THR 18 H THR 18 -2.330 2.148 8.742
145 HA THR 18 HA THR 18 -3.846 0.673 6.620
146 HB THR 18 HB THR 18 -5.635 0.420 8.382
147 HG1 THR 18 HG1 THR 18 -4.054 0.346 10.500
148 HG21 THR 18 HG21 THR 18 -3.019 -1.010 9.052
149 HG22 THR 18 HG22 THR 18 -4.659 -1.542 9.469
150 HG23 THR 18 HG23 THR 18 -4.153 -1.477 7.776
151 H THR 19 H THR 19 -5.418 1.880 5.577
152 HA THR 19 HA THR 19 -6.352 4.375 6.604
153 HB THR 19 HB THR 19 -4.745 4.488 4.024
154 HG1 THR 19 HG1 THR 19 -3.944 4.632 6.543
155 HG21 THR 19 HG21 THR 19 -5.100 6.887 4.133
156 HG22 THR 19 HG22 THR 19 -6.691 6.103 4.219
157 HG23 THR 19 HG23 THR 19 -5.940 6.739 5.685
158 H GLU 20 H GLU 20 -8.441 4.779 5.711
159 HA GLU 20 HA GLU 20 -9.392 2.693 3.830
160 HB2 GLU 20 HB2 GLU 20 -11.603 3.176 4.662
161 HB3 GLU 20 HB3 GLU 20 -10.500 2.934 6.012
162 HG2 GLU 20 HG2 GLU 20 -10.311 5.559 6.012
163 HG3 GLU 20 HG3 GLU 20 -11.818 5.463 5.082
164 H ALA 21 H ALA 21 -10.853 3.286 2.077
165 HA ALA 21 HA ALA 21 -10.934 6.035 1.187
166 HB1 ALA 21 HB1 ALA 21 -9.679 5.667 -0.909
167 HB2 ALA 21 HB2 ALA 21 -8.608 5.355 0.459
168 HB3 ALA 21 HB3 ALA 21 -9.315 3.995 -0.431
169 H VAL 22 H VAL 22 -12.066 6.198 -0.942
170 HA VAL 22 HA VAL 22 -14.348 4.540 -0.997
171 HB VAL 22 HB VAL 22 -14.323 6.850 -1.814
172 HG11 VAL 22 HG11 VAL 22 -13.490 7.446 -4.025
173 HG12 VAL 22 HG12 VAL 22 -12.142 6.864 -3.031
174 HG13 VAL 22 HG13 VAL 22 -12.860 5.832 -4.293
175 HG21 VAL 22 HG21 VAL 22 -15.763 6.513 -3.782
176 HG22 VAL 22 HG22 VAL 22 -15.202 4.843 -3.937
177 HG23 VAL 22 HG23 VAL 22 -16.136 5.344 -2.507
178 H ASP 23 H ASP 23 -11.278 4.447 -2.939
179 HA ASP 23 HA ASP 23 -11.792 1.646 -3.545
180 HB2 ASP 23 HB2 ASP 23 -12.111 3.857 -5.517
181 HB3 ASP 23 HB3 ASP 23 -10.974 2.614 -6.032
182 H ALA 24 H ALA 24 -10.016 0.682 -4.652
183 HA ALA 24 HA ALA 24 -7.642 0.807 -3.270
184 HB1 ALA 24 HB1 ALA 24 -8.327 -0.291 -6.025
185 HB2 ALA 24 HB2 ALA 24 -6.774 -0.590 -5.229
186 HB3 ALA 24 HB3 ALA 24 -8.274 -1.162 -4.481
187 H ALA 25 H ALA 25 -8.281 2.313 -6.499
188 HA ALA 25 HA ALA 25 -5.736 3.286 -7.017
189 HB1 ALA 25 HB1 ALA 25 -7.580 3.397 -8.623
190 HB2 ALA 25 HB2 ALA 25 -8.437 4.565 -7.583
191 HB3 ALA 25 HB3 ALA 25 -6.914 5.027 -8.369
192 H THR 26 H THR 26 -8.245 4.797 -4.894
193 HA THR 26 HA THR 26 -6.664 7.183 -4.497
194 HB THR 26 HB THR 26 -9.037 6.058 -2.958
195 HG1 THR 26 HG1 THR 26 -10.066 7.770 -4.291
196 HG21 THR 26 HG21 THR 26 -7.822 8.862 -2.998
197 HG22 THR 26 HG22 THR 26 -9.365 8.422 -2.234
198 HG23 THR 26 HG23 THR 26 -7.847 7.757 -1.611
199 H ALA 27 H ALA 27 -7.084 4.088 -2.675
200 HA ALA 27 HA ALA 27 -5.499 4.851 -0.442
201 HB1 ALA 27 HB1 ALA 27 -5.855 2.069 -1.659
202 HB2 ALA 27 HB2 ALA 27 -5.263 2.432 -0.029
203 HB3 ALA 27 HB3 ALA 27 -6.936 2.829 -0.471
204 H GLU 28 H GLU 28 -4.594 3.165 -3.451
205 HA GLU 28 HA GLU 28 -1.858 2.769 -3.158
206 HB2 GLU 28 HB2 GLU 28 -3.281 1.891 -4.958
207 HB3 GLU 28 HB3 GLU 28 -3.612 3.507 -5.534
208 HG2 GLU 28 HG2 GLU 28 -1.115 3.693 -6.089
209 HG3 GLU 28 HG3 GLU 28 -1.045 1.941 -5.830
210 H LYS 29 H LYS 29 -3.549 5.631 -4.376
211 HA LYS 29 HA LYS 29 -1.235 7.185 -5.029
212 HB2 LYS 29 HB2 LYS 29 -3.560 7.222 -5.918
213 HB3 LYS 29 HB3 LYS 29 -4.107 8.039 -4.454
214 HG2 LYS 29 HG2 LYS 29 -2.647 9.960 -4.993
215 HG3 LYS 29 HG3 LYS 29 -2.047 9.114 -6.438
216 HD2 LYS 29 HD2 LYS 29 -4.966 9.832 -5.895
217 HD3 LYS 29 HD3 LYS 29 -3.868 10.745 -6.944
218 HE2 LYS 29 HE2 LYS 29 -3.639 8.846 -8.465
219 HE3 LYS 29 HE3 LYS 29 -4.561 7.795 -7.394
220 HZ1 LYS 29 HZ1 LYS 29 -5.679 10.167 -8.687
221 HZ2 LYS 29 HZ2 LYS 29 -5.847 8.605 -9.210
222 HZ3 LYS 29 HZ3 LYS 29 -6.503 9.048 -7.766
223 H VAL 30 H VAL 30 -3.483 7.268 -2.203
224 HA VAL 30 HA VAL 30 -2.196 9.458 -0.894
225 HB VAL 30 HB VAL 30 -4.007 7.193 0.049
226 HG11 VAL 30 HG11 VAL 30 -4.382 8.514 2.129
227 HG12 VAL 30 HG12 VAL 30 -2.737 7.886 2.027
228 HG13 VAL 30 HG13 VAL 30 -3.050 9.593 1.662
229 HG21 VAL 30 HG21 VAL 30 -4.970 8.981 -1.481
230 HG22 VAL 30 HG22 VAL 30 -5.726 8.917 0.116
231 HG23 VAL 30 HG23 VAL 30 -4.544 10.186 -0.256
232 H PHE 31 H PHE 31 -1.882 5.865 -0.400
233 HA PHE 31 HA PHE 31 0.233 6.116 1.461
234 HB2 PHE 31 HB2 PHE 31 -0.761 3.866 -0.296
235 HB3 PHE 31 HB3 PHE 31 0.678 3.670 0.689
236 HD1 PHE 31 HD2 PHE 31 0.410 4.606 3.226
237 HD2 PHE 31 HD1 PHE 31 -2.750 3.059 0.724
238 HE1 PHE 31 HE2 PHE 31 -0.819 3.865 5.230
239 HE2 PHE 31 HE1 PHE 31 -3.975 2.306 2.756
240 HZ PHE 31 HZ PHE 31 -2.931 2.626 5.001
241 H LYS 32 H LYS 32 0.409 6.559 -2.007
242 HA LYS 32 HA LYS 32 3.064 5.680 -2.463
243 HB2 LYS 32 HB2 LYS 32 1.321 6.515 -4.149
244 HB3 LYS 32 HB3 LYS 32 1.778 8.144 -3.682
245 HG2 LYS 32 HG2 LYS 32 4.096 7.741 -4.434
246 HG3 LYS 32 HG3 LYS 32 3.683 6.058 -4.830
247 HD2 LYS 32 HD2 LYS 32 2.006 6.861 -6.478
248 HD3 LYS 32 HD3 LYS 32 2.401 8.537 -6.060
249 HE2 LYS 32 HE2 LYS 32 4.772 8.107 -6.796
250 HE3 LYS 32 HE3 LYS 32 4.282 6.482 -7.300
251 HZ1 LYS 32 HZ1 LYS 32 3.337 9.049 -8.420
252 HZ2 LYS 32 HZ2 LYS 32 4.197 7.923 -9.190
253 HZ3 LYS 32 HZ3 LYS 32 2.639 7.597 -8.785
254 H GLN 33 H GLN 33 1.791 8.551 -0.857
255 HA GLN 33 HA GLN 33 4.086 10.211 -0.801
256 HB2 GLN 33 HB2 GLN 33 1.889 9.793 1.309
257 HB3 GLN 33 HB3 GLN 33 3.011 11.151 1.267
258 HG2 GLN 33 HG2 GLN 33 2.108 11.817 -0.916
259 HG3 GLN 33 HG3 GLN 33 0.923 10.514 -0.867
260 HE21 GLN 33 HE22 GLN 33 -0.124 12.916 -1.275
261 HE22 GLN 33 HE21 GLN 33 -0.630 13.770 0.179
262 H TYR 34 H TYR 34 2.871 7.963 1.683
263 HA TYR 34 HA TYR 34 5.152 7.924 3.326
264 HB2 TYR 34 HB2 TYR 34 3.245 7.287 4.367
265 HB3 TYR 34 HB3 TYR 34 2.606 6.397 3.000
266 HD1 TYR 34 HD2 TYR 34 5.143 6.178 5.765
267 HD2 TYR 34 HD1 TYR 34 2.748 4.059 2.864
268 HE1 TYR 34 HE2 TYR 34 5.641 4.042 6.918
269 HE2 TYR 34 HE1 TYR 34 3.212 1.936 4.036
270 HH TYR 34 HH TYR 34 3.937 1.065 6.151
271 H ALA 35 H ALA 35 4.299 5.777 0.567
272 HA ALA 35 HA ALA 35 6.290 3.835 1.092
273 HB1 ALA 35 HB1 ALA 35 6.043 3.247 -1.308
274 HB2 ALA 35 HB2 ALA 35 4.476 3.472 -0.509
275 HB3 ALA 35 HB3 ALA 35 5.128 4.744 -1.576
276 H ASN 36 H ASN 36 6.525 6.669 -1.197
277 HA ASN 36 HA ASN 36 9.324 6.139 -1.615
278 HB2 ASN 36 HB2 ASN 36 7.957 7.464 -3.227
279 HB3 ASN 36 HB3 ASN 36 7.890 8.785 -2.045
280 HD21 ASN 36 HD22 ASN 36 9.201 10.297 -3.135
281 HD22 ASN 36 HD21 ASN 36 10.908 10.050 -3.474
282 H ASP 37 H ASP 37 7.572 8.172 0.700
283 HA ASP 37 HA ASP 37 9.840 9.572 1.751
284 HB2 ASP 37 HB2 ASP 37 7.490 10.294 1.899
285 HB3 ASP 37 HB3 ASP 37 7.163 8.960 3.017
286 H ASN 38 H ASN 38 9.041 6.299 1.940
287 HA ASN 38 HA ASN 38 10.627 5.928 4.409
288 HB2 ASN 38 HB2 ASN 38 8.166 5.250 4.523
289 HB3 ASN 38 HB3 ASN 38 8.579 3.964 3.381
290 HD21 ASN 38 HD22 ASN 38 8.016 2.388 5.057
291 HD22 ASN 38 HD21 ASN 38 9.160 2.048 6.346
292 H GLY 39 H GLY 39 10.875 5.785 1.105
293 HA2 GLY 39 HA2 GLY 39 12.728 5.081 -0.072
294 HA3 GLY 39 HA3 GLY 39 13.239 4.075 1.265
295 H VAL 40 H VAL 40 9.931 3.708 -0.151
296 HA VAL 40 HA VAL 40 10.919 1.235 -1.475
297 HB VAL 40 HB VAL 40 8.376 1.498 0.130
298 HG11 VAL 40 HG11 VAL 40 8.319 -1.045 -0.210
299 HG12 VAL 40 HG12 VAL 40 8.009 -0.089 -1.656
300 HG13 VAL 40 HG13 VAL 40 9.600 -0.826 -1.411
301 HG21 VAL 40 HG21 VAL 40 10.995 0.108 0.770
302 HG22 VAL 40 HG22 VAL 40 10.216 1.405 1.688
303 HG23 VAL 40 HG23 VAL 40 9.495 -0.208 1.643
304 H ASP 41 H ASP 41 10.064 0.692 -3.387
305 HA ASP 41 HA ASP 41 7.771 2.073 -4.547
306 HB2 ASP 41 HB2 ASP 41 9.868 3.546 -4.887
307 HB3 ASP 41 HB3 ASP 41 10.478 2.297 -5.950
308 H GLY 42 H GLY 42 6.814 0.041 -4.852
309 HA2 GLY 42 HA2 GLY 42 8.248 -1.877 -6.601
310 HA3 GLY 42 HA3 GLY 42 7.547 -2.405 -5.061
311 H GLU 43 H GLU 43 6.453 -3.831 -6.735
312 HA GLU 43 HA GLU 43 4.399 -2.636 -8.367
313 HB2 GLU 43 HB2 GLU 43 5.715 -4.737 -8.832
314 HB3 GLU 43 HB3 GLU 43 4.729 -5.570 -7.609
315 HG2 GLU 43 HG2 GLU 43 2.693 -5.109 -8.892
316 HG3 GLU 43 HG3 GLU 43 3.578 -4.031 -10.000
317 H TRP 44 H TRP 44 2.648 -1.785 -7.554
318 HA TRP 44 HA TRP 44 1.552 -2.366 -4.928
319 HB2 TRP 44 HB2 TRP 44 0.645 -0.547 -7.213
320 HB3 TRP 44 HB3 TRP 44 -0.087 -0.602 -5.620
321 HD1 TRP 44 HD1 TRP 44 3.327 0.306 -7.219
322 HE1 TRP 44 HE1 TRP 44 4.467 2.082 -5.827
323 HE3 TRP 44 HE3 TRP 44 -0.198 0.788 -3.559
324 HZ2 TRP 44 HZ2 TRP 44 4.027 3.409 -3.301
325 HZ3 TRP 44 HZ3 TRP 44 0.186 2.323 -1.655
326 HH2 TRP 44 HH2 TRP 44 2.311 3.610 -1.485
327 H THR 45 H THR 45 0.611 -4.435 -4.887
328 HA THR 45 HA THR 45 -1.636 -4.927 -6.804
329 HB THR 45 HB THR 45 0.418 -6.869 -5.684
330 HG1 THR 45 HG1 THR 45 1.220 -6.801 -7.639
331 HG21 THR 45 HG21 THR 45 -0.738 -8.554 -7.088
332 HG22 THR 45 HG22 THR 45 -1.819 -7.942 -5.817
333 HG23 THR 45 HG23 THR 45 -2.007 -7.377 -7.477
334 H TYR 46 H TYR 46 -3.593 -5.473 -5.915
335 HA TYR 46 HA TYR 46 -3.719 -5.760 -2.975
336 HB2 TYR 46 HB2 TYR 46 -5.682 -4.468 -2.916
337 HB3 TYR 46 HB3 TYR 46 -4.440 -3.582 -3.741
338 HD1 TYR 46 HD1 TYR 46 -4.544 -3.196 -6.230
339 HD2 TYR 46 HD2 TYR 46 -7.772 -4.985 -3.985
340 HE1 TYR 46 HE1 TYR 46 -6.107 -2.611 -8.037
341 HE2 TYR 46 HE2 TYR 46 -9.349 -4.383 -5.775
342 HH TYR 46 HH TYR 46 -8.322 -2.879 -8.863
343 H ASP 47 H ASP 47 -5.334 -6.861 -2.002
344 HA ASP 47 HA ASP 47 -6.675 -9.052 -3.528
345 HB2 ASP 47 HB2 ASP 47 -4.715 -9.877 -2.277
346 HB3 ASP 47 HB3 ASP 47 -5.327 -9.145 -0.800
347 H ASP 48 H ASP 48 -8.808 -8.224 -3.521
348 HA ASP 48 HA ASP 48 -9.740 -6.435 -1.463
349 HB2 ASP 48 HB2 ASP 48 -11.783 -6.380 -2.563
350 HB3 ASP 48 HB3 ASP 48 -10.635 -6.643 -3.879
351 H ALA 49 H ALA 49 -9.771 -9.967 -1.764
352 HA ALA 49 HA ALA 49 -11.925 -10.447 0.034
353 HB1 ALA 49 HB1 ALA 49 -9.499 -12.180 -0.613
354 HB2 ALA 49 HB2 ALA 49 -10.993 -12.734 0.174
355 HB3 ALA 49 HB3 ALA 49 -11.034 -12.154 -1.500
356 H THR 50 H THR 50 -8.482 -9.869 0.546
357 HA THR 50 HA THR 50 -8.785 -10.078 3.490
358 HB THR 50 HB THR 50 -6.218 -9.885 1.898
359 HG1 THR 50 HG1 THR 50 -7.125 -11.499 0.954
360 HG21 THR 50 HG21 THR 50 -5.898 -9.720 4.311
361 HG22 THR 50 HG22 THR 50 -6.921 -11.138 4.587
362 HG23 THR 50 HG23 THR 50 -5.342 -11.305 3.771
363 H LYS 51 H LYS 51 -8.846 -7.705 1.069
364 HA LYS 51 HA LYS 51 -8.574 -5.490 0.976
365 HB2 LYS 51 HB2 LYS 51 -9.422 -5.782 3.832
366 HB3 LYS 51 HB3 LYS 51 -8.996 -4.196 3.168
367 HG2 LYS 51 HG2 LYS 51 -10.624 -4.532 1.321
368 HG3 LYS 51 HG3 LYS 51 -11.150 -6.046 2.069
369 HD2 LYS 51 HD2 LYS 51 -11.133 -3.384 3.553
370 HD3 LYS 51 HD3 LYS 51 -12.517 -3.902 2.608
371 HE2 LYS 51 HE2 LYS 51 -11.337 -5.760 4.699
372 HE3 LYS 51 HE3 LYS 51 -12.326 -4.399 5.211
373 HZ1 LYS 51 HZ1 LYS 51 -13.699 -6.278 4.929
374 HZ2 LYS 51 HZ2 LYS 51 -14.077 -5.215 3.740
375 HZ3 LYS 51 HZ3 LYS 51 -13.136 -6.581 3.428
376 H THR 52 H THR 52 -6.144 -7.077 1.200
377 HA THR 52 HA THR 52 -4.287 -5.247 2.588
378 HB THR 52 HB THR 52 -2.701 -7.205 1.836
379 HG1 THR 52 HG1 THR 52 -3.720 -9.113 1.439
380 HG21 THR 52 HG21 THR 52 -3.282 -6.842 4.190
381 HG22 THR 52 HG22 THR 52 -4.860 -7.617 3.958
382 HG23 THR 52 HG23 THR 52 -3.366 -8.570 3.822
383 H PHE 53 H PHE 53 -2.498 -4.391 1.418
384 HA PHE 53 HA PHE 53 -2.625 -4.441 -1.523
385 HB2 PHE 53 HB2 PHE 53 -3.920 -2.473 -0.195
386 HB3 PHE 53 HB3 PHE 53 -2.317 -1.788 -0.134
387 HD1 PHE 53 HD2 PHE 53 -1.488 -2.913 -3.047
388 HD2 PHE 53 HD1 PHE 53 -4.907 -0.784 -1.463
389 HE1 PHE 53 HE2 PHE 53 -1.945 -1.956 -5.279
390 HE2 PHE 53 HE1 PHE 53 -5.286 0.209 -3.678
391 HZ PHE 53 HZ PHE 53 -3.824 -0.375 -5.604
392 H THR 54 H THR 54 -0.683 -5.447 -1.730
393 HA THR 54 HA THR 54 1.558 -4.710 0.000
394 HB THR 54 HB THR 54 1.287 -7.024 -1.938
395 HG1 THR 54 HG1 THR 54 0.485 -8.158 -0.264
396 HG21 THR 54 HG21 THR 54 3.078 -6.588 0.510
397 HG22 THR 54 HG22 THR 54 3.019 -8.055 -0.492
398 HG23 THR 54 HG23 THR 54 3.612 -6.535 -1.177
399 H VAL 55 H VAL 55 3.453 -3.878 -0.719
400 HA VAL 55 HA VAL 55 3.671 -3.016 -3.572
401 HB VAL 55 HB VAL 55 4.755 -1.556 -1.108
402 HG11 VAL 55 HG11 VAL 55 6.076 -1.224 -3.156
403 HG12 VAL 55 HG12 VAL 55 4.607 -0.757 -4.048
404 HG13 VAL 55 HG13 VAL 55 5.216 0.260 -2.721
405 HG21 VAL 55 HG21 VAL 55 2.313 -0.957 -2.777
406 HG22 VAL 55 HG22 VAL 55 2.393 -1.291 -1.015
407 HG23 VAL 55 HG23 VAL 55 3.073 0.206 -1.660
408 H THR 56 H THR 56 4.958 -4.782 -4.233
409 HA THR 56 HA THR 56 7.224 -5.606 -2.490
410 HB THR 56 HB THR 56 5.872 -7.037 -4.800
411 HG1 THR 56 HG1 THR 56 4.551 -7.068 -3.178
412 HG21 THR 56 HG21 THR 56 8.218 -7.796 -3.029
413 HG22 THR 56 HG22 THR 56 7.149 -9.023 -3.746
414 HG23 THR 56 HG23 THR 56 8.059 -7.906 -4.777
415 H GLU 57 H GLU 57 9.060 -4.572 -2.926
416 HA GLU 57 HA GLU 57 9.613 -3.566 -5.645
417 HB2 GLU 57 HB2 GLU 57 9.824 -2.052 -3.723
418 HB3 GLU 57 HB3 GLU 57 11.038 -3.115 -2.993
419 HG2 GLU 57 HG2 GLU 57 12.600 -2.706 -4.766
420 HG3 GLU 57 HG3 GLU 57 11.399 -1.924 -5.763
Start of MODEL 8
1 H1 MET 1 H MET 1 -16.645 0.941 -1.093
2 HA MET 1 HA MET 1 -14.746 1.678 0.228
3 HB2 MET 1 HB2 MET 1 -17.018 2.770 0.622
4 HB3 MET 1 HB3 MET 1 -17.245 1.646 1.969
5 HG2 MET 1 HG2 MET 1 -14.860 2.634 2.715
6 HG3 MET 1 HG3 MET 1 -15.358 3.981 1.700
7 HE1 MET 1 HE1 MET 1 -18.735 5.017 3.598
8 HE2 MET 1 HE2 MET 1 -17.706 5.347 2.184
9 HE3 MET 1 HE3 MET 1 -18.631 3.828 2.289
10 H GLY 2 H GLY 2 -13.156 0.997 1.719
11 HA2 GLY 2 HA2 GLY 2 -13.882 -0.826 3.846
12 HA3 GLY 2 HA3 GLY 2 -12.935 -1.593 2.553
13 H THR 3 H THR 3 -11.848 -1.609 4.920
14 HA THR 3 HA THR 3 -9.981 0.661 5.296
15 HB THR 3 HB THR 3 -10.700 -1.862 6.852
16 HG1 THR 3 HG1 THR 3 -12.079 -0.007 6.964
17 HG21 THR 3 HG21 THR 3 -8.358 -1.634 7.280
18 HG22 THR 3 HG22 THR 3 -8.469 0.119 7.428
19 HG23 THR 3 HG23 THR 3 -9.191 -0.934 8.671
20 H TYR 4 H TYR 4 -8.196 0.603 4.036
21 HA TYR 4 HA TYR 4 -7.223 -1.965 2.966
22 HB2 TYR 4 HB2 TYR 4 -6.478 0.951 2.405
23 HB3 TYR 4 HB3 TYR 4 -5.717 -0.437 1.650
24 HD1 TYR 4 HD2 TYR 4 -8.841 1.570 1.803
25 HD2 TYR 4 HD1 TYR 4 -6.807 -1.738 -0.065
26 HE1 TYR 4 HE2 TYR 4 -10.543 1.554 0.004
27 HE2 TYR 4 HE1 TYR 4 -8.473 -1.744 -1.890
28 HH TYR 4 HH TYR 4 -11.346 0.373 -1.981
29 H LYS 5 H LYS 5 -5.051 -2.590 3.318
30 HA LYS 5 HA LYS 5 -3.585 -1.253 5.552
31 HB2 LYS 5 HB2 LYS 5 -3.814 -4.259 5.053
32 HB3 LYS 5 HB3 LYS 5 -2.923 -3.442 6.352
33 HG2 LYS 5 HG2 LYS 5 -5.141 -2.465 7.139
34 HG3 LYS 5 HG3 LYS 5 -5.948 -3.470 5.933
35 HD2 LYS 5 HD2 LYS 5 -5.094 -5.496 6.949
36 HD3 LYS 5 HD3 LYS 5 -4.168 -4.566 8.149
37 HE2 LYS 5 HE2 LYS 5 -6.053 -3.846 9.301
38 HE3 LYS 5 HE3 LYS 5 -7.099 -3.950 7.870
39 HZ1 LYS 5 HZ1 LYS 5 -7.559 -5.688 9.490
40 HZ2 LYS 5 HZ2 LYS 5 -7.111 -6.282 8.019
41 HZ3 LYS 5 HZ3 LYS 5 -6.033 -6.305 9.257
42 H LEU 6 H LEU 6 -1.942 -0.302 4.488
43 HA LEU 6 HA LEU 6 -0.831 -1.621 2.101
44 HB2 LEU 6 HB2 LEU 6 -1.704 0.665 1.905
45 HB3 LEU 6 HB3 LEU 6 -0.467 1.240 3.017
46 HG LEU 6 HG LEU 6 -0.084 1.605 0.554
47 HD11 LEU 6 HD11 LEU 6 2.268 1.201 0.553
48 HD12 LEU 6 HD12 LEU 6 1.787 1.648 2.196
49 HD13 LEU 6 HD13 LEU 6 2.124 -0.050 1.795
50 HD21 LEU 6 HD21 LEU 6 0.586 -0.099 -0.933
51 HD22 LEU 6 HD22 LEU 6 0.598 -1.336 0.340
52 HD23 LEU 6 HD23 LEU 6 -0.942 -0.610 -0.193
53 H ILE 7 H ILE 7 0.810 -2.877 2.462
54 HA ILE 7 HA ILE 7 2.664 -2.362 4.724
55 HB ILE 7 HB ILE 7 1.910 -4.902 3.226
56 HG12 ILE 7 HG12 ILE 7 1.448 -5.809 5.494
57 HG13 ILE 7 HG13 ILE 7 1.808 -4.244 6.201
58 HG21 ILE 7 HG21 ILE 7 4.381 -4.937 3.632
59 HG22 ILE 7 HG22 ILE 7 4.092 -4.611 5.350
60 HG23 ILE 7 HG23 ILE 7 3.536 -6.128 4.611
61 HD11 ILE 7 HD11 ILE 7 -0.467 -4.735 4.230
62 HD12 ILE 7 HD12 ILE 7 -0.636 -4.862 5.994
63 HD13 ILE 7 HD13 ILE 7 -0.225 -3.306 5.280
64 H LEU 8 H LEU 8 4.790 -2.203 4.292
65 HA LEU 8 HA LEU 8 5.690 -1.678 1.480
66 HB2 LEU 8 HB2 LEU 8 6.372 -0.645 4.230
67 HB3 LEU 8 HB3 LEU 8 7.697 -0.817 3.110
68 HG LEU 8 HG LEU 8 6.723 0.801 1.586
69 HD11 LEU 8 HD11 LEU 8 4.345 0.774 3.468
70 HD12 LEU 8 HD12 LEU 8 4.625 2.020 2.220
71 HD13 LEU 8 HD13 LEU 8 4.389 0.331 1.746
72 HD21 LEU 8 HD21 LEU 8 8.067 1.659 3.444
73 HD22 LEU 8 HD22 LEU 8 6.740 2.787 3.118
74 HD23 LEU 8 HD23 LEU 8 6.638 1.687 4.501
75 H ASN 9 H ASN 9 6.988 -3.352 0.627
76 HA ASN 9 HA ASN 9 8.469 -5.066 2.565
77 HB2 ASN 9 HB2 ASN 9 6.531 -6.269 1.658
78 HB3 ASN 9 HB3 ASN 9 7.071 -5.942 0.012
79 HD21 ASN 9 HD22 ASN 9 9.314 -6.755 -0.557
80 HD22 ASN 9 HD21 ASN 9 9.701 -8.362 0.025
81 H GLY 10 H GLY 10 10.375 -3.742 2.372
82 HA2 GLY 10 HA2 GLY 10 11.516 -3.606 -0.359
83 HA3 GLY 10 HA3 GLY 10 11.748 -2.390 0.889
84 H LYS 11 H LYS 11 13.700 -3.996 -0.566
85 HA LYS 11 HA LYS 11 14.959 -6.000 0.917
86 HB2 LYS 11 HB2 LYS 11 16.873 -5.669 -0.485
87 HB3 LYS 11 HB3 LYS 11 15.444 -5.466 -1.468
88 HG2 LYS 11 HG2 LYS 11 16.884 -3.024 -0.313
89 HG3 LYS 11 HG3 LYS 11 17.483 -3.845 -1.737
90 HD2 LYS 11 HD2 LYS 11 15.317 -3.546 -2.849
91 HD3 LYS 11 HD3 LYS 11 14.721 -2.667 -1.430
92 HE2 LYS 11 HE2 LYS 11 16.361 -0.880 -1.825
93 HE3 LYS 11 HE3 LYS 11 16.997 -1.786 -3.220
94 HZ1 LYS 11 HZ1 LYS 11 14.656 -1.688 -4.114
95 HZ2 LYS 11 HZ2 LYS 11 14.294 -0.602 -2.951
96 HZ3 LYS 11 HZ3 LYS 11 15.419 -0.244 -4.086
97 H THR 12 H THR 12 14.535 -3.150 2.304
98 HA THR 12 HA THR 12 16.997 -3.343 3.938
99 HB THR 12 HB THR 12 15.940 -0.762 2.692
100 HG1 THR 12 HG1 THR 12 17.493 -0.868 1.314
101 HG21 THR 12 HG21 THR 12 18.079 0.216 3.550
102 HG22 THR 12 HG22 THR 12 16.984 -0.279 4.845
103 HG23 THR 12 HG23 THR 12 18.380 -1.308 4.423
104 H LEU 13 H LEU 13 13.603 -2.106 3.546
105 HA LEU 13 HA LEU 13 13.265 -2.320 6.427
106 HB2 LEU 13 HB2 LEU 13 12.479 -0.097 6.719
107 HB3 LEU 13 HB3 LEU 13 14.041 0.015 5.966
108 HG LEU 13 HG LEU 13 12.782 1.686 5.011
109 HD11 LEU 13 HD11 LEU 13 12.538 -0.450 2.871
110 HD12 LEU 13 HD12 LEU 13 12.622 1.299 2.656
111 HD13 LEU 13 HD13 LEU 13 14.027 0.451 3.289
112 HD21 LEU 13 HD21 LEU 13 10.603 1.680 4.165
113 HD22 LEU 13 HD22 LEU 13 10.439 -0.071 4.244
114 HD23 LEU 13 HD23 LEU 13 10.530 0.892 5.743
115 H LYS 14 H LYS 14 11.013 -2.064 7.034
116 HA LYS 14 HA LYS 14 9.043 -2.542 4.895
117 HB2 LYS 14 HB2 LYS 14 9.357 -4.309 7.359
118 HB3 LYS 14 HB3 LYS 14 7.973 -4.327 6.251
119 HG2 LYS 14 HG2 LYS 14 9.633 -4.715 4.348
120 HG3 LYS 14 HG3 LYS 14 10.855 -4.988 5.568
121 HD2 LYS 14 HD2 LYS 14 9.362 -6.837 6.499
122 HD3 LYS 14 HD3 LYS 14 8.337 -6.604 5.057
123 HE2 LYS 14 HE2 LYS 14 10.646 -6.793 3.761
124 HE3 LYS 14 HE3 LYS 14 11.235 -7.523 5.260
125 HZ1 LYS 14 HZ1 LYS 14 10.515 -9.182 3.765
126 HZ2 LYS 14 HZ2 LYS 14 9.376 -9.179 4.977
127 HZ3 LYS 14 HZ3 LYS 14 9.059 -8.506 3.513
128 H GLY 15 H GLY 15 6.723 -2.308 5.852
129 HA2 GLY 15 HA2 GLY 15 6.485 -0.569 8.163
130 HA3 GLY 15 HA3 GLY 15 6.286 0.252 6.613
131 H GLU 16 H GLU 16 4.113 0.000 8.445
132 HA GLU 16 HA GLU 16 2.196 -1.495 6.783
133 HB2 GLU 16 HB2 GLU 16 3.026 -3.156 8.426
134 HB3 GLU 16 HB3 GLU 16 2.674 -2.040 9.738
135 HG2 GLU 16 HG2 GLU 16 0.244 -2.120 9.053
136 HG3 GLU 16 HG3 GLU 16 0.650 -3.310 7.858
137 H THR 17 H THR 17 0.582 0.006 6.441
138 HA THR 17 HA THR 17 -0.260 1.776 8.694
139 HB THR 17 HB THR 17 -0.560 3.560 6.912
140 HG1 THR 17 HG1 THR 17 0.964 1.670 5.464
141 HG21 THR 17 HG21 THR 17 1.778 4.295 6.923
142 HG22 THR 17 HG22 THR 17 1.308 3.671 8.513
143 HG23 THR 17 HG23 THR 17 2.311 2.682 7.439
144 H THR 18 H THR 18 -2.546 2.594 8.404
145 HA THR 18 HA THR 18 -4.096 0.884 6.516
146 HB THR 18 HB THR 18 -5.761 0.480 8.254
147 HG1 THR 18 HG1 THR 18 -5.758 1.625 9.938
148 HG21 THR 18 HG21 THR 18 -3.093 -0.311 9.453
149 HG22 THR 18 HG22 THR 18 -4.633 -1.189 9.510
150 HG23 THR 18 HG23 THR 18 -3.715 -1.068 7.989
151 H THR 19 H THR 19 -5.806 1.915 5.481
152 HA THR 19 HA THR 19 -6.782 4.460 6.460
153 HB THR 19 HB THR 19 -5.490 4.393 3.712
154 HG1 THR 19 HG1 THR 19 -4.473 4.799 6.199
155 HG21 THR 19 HG21 THR 19 -5.737 6.877 3.895
156 HG22 THR 19 HG22 THR 19 -7.305 6.056 3.896
157 HG23 THR 19 HG23 THR 19 -6.616 6.664 5.421
158 H GLU 20 H GLU 20 -8.943 4.811 5.773
159 HA GLU 20 HA GLU 20 -10.059 2.606 4.147
160 HB2 GLU 20 HB2 GLU 20 -12.222 3.240 5.202
161 HB3 GLU 20 HB3 GLU 20 -11.006 2.609 6.321
162 HG2 GLU 20 HG2 GLU 20 -10.482 4.897 7.101
163 HG3 GLU 20 HG3 GLU 20 -11.625 5.578 5.924
164 H ALA 21 H ALA 21 -11.302 3.023 2.341
165 HA ALA 21 HA ALA 21 -11.997 5.750 1.607
166 HB1 ALA 21 HB1 ALA 21 -9.972 4.179 -0.073
167 HB2 ALA 21 HB2 ALA 21 -10.686 5.744 -0.499
168 HB3 ALA 21 HB3 ALA 21 -9.600 5.627 0.890
169 H VAL 22 H VAL 22 -13.148 5.809 -0.454
170 HA VAL 22 HA VAL 22 -15.012 3.606 -0.738
171 HB VAL 22 HB VAL 22 -15.603 6.037 -0.818
172 HG11 VAL 22 HG11 VAL 22 -15.222 7.373 -2.787
173 HG12 VAL 22 HG12 VAL 22 -13.643 6.752 -2.278
174 HG13 VAL 22 HG13 VAL 22 -14.481 6.027 -3.655
175 HG21 VAL 22 HG21 VAL 22 -16.425 4.605 -3.372
176 HG22 VAL 22 HG22 VAL 22 -17.103 4.266 -1.770
177 HG23 VAL 22 HG23 VAL 22 -17.303 5.871 -2.499
178 H ASP 23 H ASP 23 -12.002 4.538 -2.361
179 HA ASP 23 HA ASP 23 -12.367 2.309 -4.225
180 HB2 ASP 23 HB2 ASP 23 -12.689 5.087 -5.010
181 HB3 ASP 23 HB3 ASP 23 -11.142 4.535 -5.646
182 H ALA 24 H ALA 24 -10.431 1.339 -4.702
183 HA ALA 24 HA ALA 24 -8.263 1.593 -2.925
184 HB1 ALA 24 HB1 ALA 24 -7.128 0.019 -4.470
185 HB2 ALA 24 HB2 ALA 24 -8.801 -0.484 -4.149
186 HB3 ALA 24 HB3 ALA 24 -8.386 0.310 -5.683
187 H ALA 25 H ALA 25 -8.822 3.115 -6.075
188 HA ALA 25 HA ALA 25 -6.191 3.981 -6.664
189 HB1 ALA 25 HB1 ALA 25 -8.103 4.153 -8.232
190 HB2 ALA 25 HB2 ALA 25 -8.862 5.372 -7.195
191 HB3 ALA 25 HB3 ALA 25 -7.317 5.725 -8.016
192 H THR 26 H THR 26 -8.759 5.575 -4.684
193 HA THR 26 HA THR 26 -7.243 7.889 -4.043
194 HB THR 26 HB THR 26 -9.614 6.600 -2.616
195 HG1 THR 26 HG1 THR 26 -10.842 7.686 -4.162
196 HG21 THR 26 HG21 THR 26 -8.651 8.477 -1.327
197 HG22 THR 26 HG22 THR 26 -8.674 9.510 -2.773
198 HG23 THR 26 HG23 THR 26 -10.194 8.956 -2.040
199 H ALA 27 H ALA 27 -7.420 4.629 -2.644
200 HA ALA 27 HA ALA 27 -6.138 5.297 -0.154
201 HB1 ALA 27 HB1 ALA 27 -6.222 2.588 -1.548
202 HB2 ALA 27 HB2 ALA 27 -5.902 2.923 0.159
203 HB3 ALA 27 HB3 ALA 27 -7.510 3.241 -0.508
204 H GLU 28 H GLU 28 -5.018 3.791 -3.192
205 HA GLU 28 HA GLU 28 -2.293 3.589 -2.710
206 HB2 GLU 28 HB2 GLU 28 -3.642 2.592 -4.598
207 HB3 GLU 28 HB3 GLU 28 -3.686 4.186 -5.350
208 HG2 GLU 28 HG2 GLU 28 -0.964 3.895 -4.949
209 HG3 GLU 28 HG3 GLU 28 -1.461 2.211 -5.102
210 H LYS 29 H LYS 29 -3.970 6.343 -4.373
211 HA LYS 29 HA LYS 29 -1.689 7.862 -4.903
212 HB2 LYS 29 HB2 LYS 29 -4.553 8.662 -4.284
213 HB3 LYS 29 HB3 LYS 29 -3.304 9.883 -4.555
214 HG2 LYS 29 HG2 LYS 29 -2.773 8.885 -6.757
215 HG3 LYS 29 HG3 LYS 29 -4.042 7.679 -6.527
216 HD2 LYS 29 HD2 LYS 29 -4.816 9.461 -7.980
217 HD3 LYS 29 HD3 LYS 29 -5.733 9.498 -6.467
218 HE2 LYS 29 HE2 LYS 29 -4.387 11.372 -5.639
219 HE3 LYS 29 HE3 LYS 29 -3.296 11.259 -7.039
220 HZ1 LYS 29 HZ1 LYS 29 -5.022 11.986 -8.446
221 HZ2 LYS 29 HZ2 LYS 29 -6.167 11.889 -7.254
222 HZ3 LYS 29 HZ3 LYS 29 -5.001 13.027 -7.151
223 H VAL 30 H VAL 30 -3.404 7.687 -1.751
224 HA VAL 30 HA VAL 30 -1.783 9.841 -0.647
225 HB VAL 30 HB VAL 30 -3.650 7.813 0.586
226 HG11 VAL 30 HG11 VAL 30 -3.600 9.217 2.632
227 HG12 VAL 30 HG12 VAL 30 -2.028 8.482 2.320
228 HG13 VAL 30 HG13 VAL 30 -2.289 10.192 1.927
229 HG21 VAL 30 HG21 VAL 30 -5.140 9.780 0.808
230 HG22 VAL 30 HG22 VAL 30 -3.931 10.797 0.014
231 HG23 VAL 30 HG23 VAL 30 -4.736 9.490 -0.877
232 H PHE 31 H PHE 31 -1.799 6.232 -0.228
233 HA PHE 31 HA PHE 31 0.502 6.114 1.368
234 HB2 PHE 31 HB2 PHE 31 -0.545 4.093 -0.637
235 HB3 PHE 31 HB3 PHE 31 0.668 3.767 0.583
236 HD1 PHE 31 HD2 PHE 31 -0.182 4.638 3.114
237 HD2 PHE 31 HD1 PHE 31 -2.571 3.060 -0.114
238 HE1 PHE 31 HE2 PHE 31 -1.829 3.770 4.740
239 HE2 PHE 31 HE1 PHE 31 -4.206 2.188 1.527
240 HZ PHE 31 HZ PHE 31 -3.829 2.526 3.958
241 H LYS 32 H LYS 32 0.395 6.614 -2.123
242 HA LYS 32 HA LYS 32 2.856 5.575 -2.878
243 HB2 LYS 32 HB2 LYS 32 1.122 6.526 -4.389
244 HB3 LYS 32 HB3 LYS 32 1.626 8.161 -3.924
245 HG2 LYS 32 HG2 LYS 32 3.896 7.727 -4.785
246 HG3 LYS 32 HG3 LYS 32 3.453 6.048 -5.114
247 HD2 LYS 32 HD2 LYS 32 1.766 6.845 -6.782
248 HD3 LYS 32 HD3 LYS 32 2.345 8.506 -6.488
249 HE2 LYS 32 HE2 LYS 32 4.701 7.607 -6.994
250 HE3 LYS 32 HE3 LYS 32 3.926 6.130 -7.573
251 HZ1 LYS 32 HZ1 LYS 32 3.509 8.848 -8.651
252 HZ2 LYS 32 HZ2 LYS 32 4.398 7.687 -9.351
253 HZ3 LYS 32 HZ3 LYS 32 2.748 7.520 -9.205
254 H GLN 33 H GLN 33 2.295 8.782 -1.376
255 HA GLN 33 HA GLN 33 4.942 9.791 -1.533
256 HB2 GLN 33 HB2 GLN 33 2.515 10.292 0.160
257 HB3 GLN 33 HB3 GLN 33 4.040 10.830 0.830
258 HG2 GLN 33 HG2 GLN 33 4.409 12.457 -0.742
259 HG3 GLN 33 HG3 GLN 33 3.423 11.695 -1.971
260 HE21 GLN 33 HE22 GLN 33 3.438 14.111 0.495
261 HE22 GLN 33 HE21 GLN 33 1.713 14.392 0.555
262 H TYR 34 H TYR 34 3.321 8.158 1.215
263 HA TYR 34 HA TYR 34 5.481 7.919 2.934
264 HB2 TYR 34 HB2 TYR 34 3.352 7.489 3.786
265 HB3 TYR 34 HB3 TYR 34 2.926 6.385 2.486
266 HD1 TYR 34 HD2 TYR 34 5.685 6.469 5.112
267 HD2 TYR 34 HD1 TYR 34 2.536 4.231 3.145
268 HE1 TYR 34 HE2 TYR 34 6.137 4.532 6.583
269 HE2 TYR 34 HE1 TYR 34 3.006 2.305 4.612
270 HH TYR 34 HH TYR 34 4.836 2.355 7.439
271 H ALA 35 H ALA 35 4.429 5.428 0.508
272 HA ALA 35 HA ALA 35 6.498 3.604 1.103
273 HB1 ALA 35 HB1 ALA 35 6.061 2.675 -1.156
274 HB2 ALA 35 HB2 ALA 35 4.565 2.984 -0.251
275 HB3 ALA 35 HB3 ALA 35 5.071 4.098 -1.541
276 H ASN 36 H ASN 36 6.456 6.072 -1.500
277 HA ASN 36 HA ASN 36 9.051 5.623 -2.470
278 HB2 ASN 36 HB2 ASN 36 7.176 7.022 -3.470
279 HB3 ASN 36 HB3 ASN 36 7.598 8.317 -2.363
280 HD21 ASN 36 HD22 ASN 36 10.666 7.666 -2.759
281 HD22 ASN 36 HD21 ASN 36 10.957 8.332 -4.348
282 H ASP 37 H ASP 37 7.944 8.001 -0.053
283 HA ASP 37 HA ASP 37 10.417 9.279 0.409
284 HB2 ASP 37 HB2 ASP 37 8.173 10.146 1.040
285 HB3 ASP 37 HB3 ASP 37 8.076 8.924 2.307
286 H ASN 38 H ASN 38 8.921 6.433 1.950
287 HA ASN 38 HA ASN 38 10.981 6.202 3.955
288 HB2 ASN 38 HB2 ASN 38 8.500 5.498 4.061
289 HB3 ASN 38 HB3 ASN 38 9.005 4.051 3.184
290 HD21 ASN 38 HD22 ASN 38 8.056 3.113 5.270
291 HD22 ASN 38 HD21 ASN 38 9.112 2.963 6.658
292 H GLY 39 H GLY 39 11.254 5.646 0.700
293 HA2 GLY 39 HA2 GLY 39 13.116 4.734 -0.369
294 HA3 GLY 39 HA3 GLY 39 13.572 3.885 1.096
295 H VAL 40 H VAL 40 10.278 3.559 -0.343
296 HA VAL 40 HA VAL 40 11.023 0.813 -1.205
297 HB VAL 40 HB VAL 40 8.469 1.731 0.176
298 HG11 VAL 40 HG11 VAL 40 7.986 -0.151 -1.363
299 HG12 VAL 40 HG12 VAL 40 9.320 -1.080 -0.645
300 HG13 VAL 40 HG13 VAL 40 7.899 -0.677 0.310
301 HG21 VAL 40 HG21 VAL 40 9.312 0.172 1.998
302 HG22 VAL 40 HG22 VAL 40 10.848 0.070 1.128
303 HG23 VAL 40 HG23 VAL 40 10.287 1.622 1.787
304 H ASP 41 H ASP 41 9.834 -0.049 -2.936
305 HA ASP 41 HA ASP 41 8.103 1.478 -4.590
306 HB2 ASP 41 HB2 ASP 41 10.676 2.208 -5.074
307 HB3 ASP 41 HB3 ASP 41 10.640 0.739 -6.039
308 H GLY 42 H GLY 42 7.667 -0.032 -6.642
309 HA2 GLY 42 HA2 GLY 42 8.459 -2.538 -7.113
310 HA3 GLY 42 HA3 GLY 42 7.525 -2.788 -5.622
311 H GLU 43 H GLU 43 6.205 -4.148 -7.074
312 HA GLU 43 HA GLU 43 4.537 -2.717 -9.024
313 HB2 GLU 43 HB2 GLU 43 5.516 -5.123 -9.270
314 HB3 GLU 43 HB3 GLU 43 4.258 -5.625 -8.138
315 HG2 GLU 43 HG2 GLU 43 3.590 -5.966 -10.498
316 HG3 GLU 43 HG3 GLU 43 2.525 -4.794 -9.700
317 H TRP 44 H TRP 44 2.364 -2.210 -8.674
318 HA TRP 44 HA TRP 44 1.472 -2.449 -5.845
319 HB2 TRP 44 HB2 TRP 44 0.736 -0.462 -7.985
320 HB3 TRP 44 HB3 TRP 44 -0.070 -0.593 -6.426
321 HD1 TRP 44 HD1 TRP 44 3.580 -0.136 -7.698
322 HE1 TRP 44 HE1 TRP 44 4.871 1.310 -6.108
323 HE3 TRP 44 HE3 TRP 44 -0.097 0.696 -4.220
324 HZ2 TRP 44 HZ2 TRP 44 4.390 2.737 -3.613
325 HZ3 TRP 44 HZ3 TRP 44 0.325 2.199 -2.295
326 HH2 TRP 44 HH2 TRP 44 2.573 3.220 -1.974
327 H THR 45 H THR 45 0.594 -4.304 -5.720
328 HA THR 45 HA THR 45 -1.728 -5.077 -7.412
329 HB THR 45 HB THR 45 0.030 -6.920 -5.749
330 HG1 THR 45 HG1 THR 45 1.285 -7.236 -7.513
331 HG21 THR 45 HG21 THR 45 -1.713 -7.413 -8.208
332 HG22 THR 45 HG22 THR 45 -0.802 -8.637 -7.309
333 HG23 THR 45 HG23 THR 45 -2.169 -7.812 -6.538
334 H TYR 46 H TYR 46 -3.633 -5.213 -6.363
335 HA TYR 46 HA TYR 46 -3.694 -4.976 -3.399
336 HB2 TYR 46 HB2 TYR 46 -5.580 -3.591 -3.570
337 HB3 TYR 46 HB3 TYR 46 -4.466 -2.978 -4.796
338 HD1 TYR 46 HD1 TYR 46 -4.823 -3.610 -7.236
339 HD2 TYR 46 HD2 TYR 46 -7.769 -4.394 -4.180
340 HE1 TYR 46 HE1 TYR 46 -6.485 -4.109 -8.981
341 HE2 TYR 46 HE2 TYR 46 -9.460 -4.865 -5.942
342 HH TYR 46 HH TYR 46 -8.952 -5.697 -8.862
343 H ASP 47 H ASP 47 -5.273 -6.190 -2.298
344 HA ASP 47 HA ASP 47 -6.844 -8.141 -3.891
345 HB2 ASP 47 HB2 ASP 47 -4.900 -8.723 -1.663
346 HB3 ASP 47 HB3 ASP 47 -6.373 -9.679 -1.801
347 H ASP 48 H ASP 48 -8.765 -7.143 -3.575
348 HA ASP 48 HA ASP 48 -9.412 -5.974 -0.969
349 HB2 ASP 48 HB2 ASP 48 -11.057 -4.900 -1.960
350 HB3 ASP 48 HB3 ASP 48 -10.194 -5.281 -3.442
351 H ALA 49 H ALA 49 -9.786 -9.100 -2.508
352 HA ALA 49 HA ALA 49 -11.955 -10.083 -0.908
353 HB1 ALA 49 HB1 ALA 49 -9.736 -11.606 -2.359
354 HB2 ALA 49 HB2 ALA 49 -11.235 -12.300 -1.713
355 HB3 ALA 49 HB3 ALA 49 -11.311 -11.131 -3.050
356 H THR 50 H THR 50 -8.407 -10.783 -0.762
357 HA THR 50 HA THR 50 -8.626 -11.829 1.907
358 HB THR 50 HB THR 50 -6.171 -11.044 0.275
359 HG1 THR 50 HG1 THR 50 -6.285 -13.325 -0.239
360 HG21 THR 50 HG21 THR 50 -5.009 -12.791 1.575
361 HG22 THR 50 HG22 THR 50 -5.572 -11.507 2.638
362 HG23 THR 50 HG23 THR 50 -6.463 -13.050 2.572
363 H LYS 51 H LYS 51 -8.413 -8.673 0.614
364 HA LYS 51 HA LYS 51 -8.344 -6.627 1.442
365 HB2 LYS 51 HB2 LYS 51 -9.869 -8.086 3.142
366 HB3 LYS 51 HB3 LYS 51 -8.749 -7.417 4.281
367 HG2 LYS 51 HG2 LYS 51 -9.316 -5.149 3.590
368 HG3 LYS 51 HG3 LYS 51 -10.287 -5.761 2.247
369 HD2 LYS 51 HD2 LYS 51 -10.876 -6.056 5.211
370 HD3 LYS 51 HD3 LYS 51 -11.738 -5.046 4.052
371 HE2 LYS 51 HE2 LYS 51 -11.711 -8.085 4.233
372 HE3 LYS 51 HE3 LYS 51 -13.070 -6.999 4.508
373 HZ1 LYS 51 HZ1 LYS 51 -11.789 -7.515 1.876
374 HZ2 LYS 51 HZ2 LYS 51 -13.286 -7.990 2.375
375 HZ3 LYS 51 HZ3 LYS 51 -12.993 -6.420 2.137
376 H THR 52 H THR 52 -5.998 -7.450 0.746
377 HA THR 52 HA THR 52 -4.119 -6.315 2.733
378 HB THR 52 HB THR 52 -2.470 -8.058 1.820
379 HG1 THR 52 HG1 THR 52 -3.456 -8.972 0.109
380 HG21 THR 52 HG21 THR 52 -3.493 -8.235 4.083
381 HG22 THR 52 HG22 THR 52 -4.837 -9.165 3.396
382 HG23 THR 52 HG23 THR 52 -3.190 -9.820 3.347
383 H PHE 53 H PHE 53 -2.279 -5.189 1.728
384 HA PHE 53 HA PHE 53 -2.255 -4.866 -1.167
385 HB2 PHE 53 HB2 PHE 53 -3.891 -3.171 0.080
386 HB3 PHE 53 HB3 PHE 53 -2.420 -2.368 0.554
387 HD1 PHE 53 HD2 PHE 53 -0.795 -2.626 -2.005
388 HD2 PHE 53 HD1 PHE 53 -4.938 -1.651 -1.351
389 HE1 PHE 53 HE2 PHE 53 -0.870 -1.483 -4.186
390 HE2 PHE 53 HE1 PHE 53 -4.986 -0.426 -3.503
391 HZ PHE 53 HZ PHE 53 -2.961 -0.364 -4.953
392 H THR 54 H THR 54 -0.036 -5.513 -1.373
393 HA THR 54 HA THR 54 1.848 -4.244 0.562
394 HB THR 54 HB THR 54 1.998 -7.088 -0.446
395 HG1 THR 54 HG1 THR 54 1.403 -7.624 1.664
396 HG21 THR 54 HG21 THR 54 3.650 -5.517 1.572
397 HG22 THR 54 HG22 THR 54 3.738 -7.281 1.373
398 HG23 THR 54 HG23 THR 54 4.211 -6.215 0.047
399 H VAL 55 H VAL 55 3.416 -3.122 -0.364
400 HA VAL 55 HA VAL 55 3.737 -3.151 -3.291
401 HB VAL 55 HB VAL 55 5.216 -1.515 -1.164
402 HG11 VAL 55 HG11 VAL 55 6.324 -1.565 -3.373
403 HG12 VAL 55 HG12 VAL 55 4.807 -1.089 -4.164
404 HG13 VAL 55 HG13 VAL 55 5.632 0.034 -3.061
405 HG21 VAL 55 HG21 VAL 55 2.664 -0.818 -2.671
406 HG22 VAL 55 HG22 VAL 55 2.845 -1.035 -0.913
407 HG23 VAL 55 HG23 VAL 55 3.642 0.318 -1.711
408 H THR 56 H THR 56 5.004 -4.799 -4.075
409 HA THR 56 HA THR 56 7.389 -5.640 -2.528
410 HB THR 56 HB THR 56 5.647 -7.399 -4.290
411 HG1 THR 56 HG1 THR 56 4.408 -7.738 -2.734
412 HG21 THR 56 HG21 THR 56 7.743 -8.087 -2.182
413 HG22 THR 56 HG22 THR 56 6.767 -9.253 -3.100
414 HG23 THR 56 HG23 THR 56 7.941 -8.232 -3.946
415 H GLU 57 H GLU 57 9.222 -5.505 -3.626
416 HA GLU 57 HA GLU 57 9.347 -4.441 -6.338
417 HB2 GLU 57 HB2 GLU 57 10.831 -3.664 -4.532
418 HB3 GLU 57 HB3 GLU 57 11.373 -5.317 -4.248
419 HG2 GLU 57 HG2 GLU 57 12.407 -5.319 -6.551
420 HG3 GLU 57 HG3 GLU 57 11.943 -3.615 -6.708
Start of MODEL 9
1 H1 MET 1 H MET 1 -16.451 3.840 5.787
2 HA MET 1 HA MET 1 -16.186 2.435 3.860
3 HB2 MET 1 HB2 MET 1 -15.232 4.912 4.019
4 HB3 MET 1 HB3 MET 1 -13.681 4.110 3.838
5 HG2 MET 1 HG2 MET 1 -14.410 4.745 1.671
6 HG3 MET 1 HG3 MET 1 -14.640 2.999 1.740
7 HE1 MET 1 HE1 MET 1 -16.145 3.575 -0.542
8 HE2 MET 1 HE2 MET 1 -17.659 4.510 -0.486
9 HE3 MET 1 HE3 MET 1 -16.110 5.344 -0.299
10 H GLY 2 H GLY 2 -14.664 1.082 2.526
11 HA2 GLY 2 HA2 GLY 2 -13.499 -1.000 3.995
12 HA3 GLY 2 HA3 GLY 2 -13.215 -0.649 2.279
13 H THR 3 H THR 3 -11.554 -1.193 5.012
14 HA THR 3 HA THR 3 -9.493 0.923 4.711
15 HB THR 3 HB THR 3 -9.962 -1.295 6.748
16 HG1 THR 3 HG1 THR 3 -11.282 0.668 6.805
17 HG21 THR 3 HG21 THR 3 -7.545 -0.959 6.601
18 HG22 THR 3 HG22 THR 3 -7.752 0.800 6.639
19 HG23 THR 3 HG23 THR 3 -8.148 -0.181 8.071
20 H TYR 4 H TYR 4 -7.898 0.509 3.235
21 HA TYR 4 HA TYR 4 -7.328 -2.307 2.484
22 HB2 TYR 4 HB2 TYR 4 -6.574 0.394 1.317
23 HB3 TYR 4 HB3 TYR 4 -5.684 -1.063 0.905
24 HD1 TYR 4 HD1 TYR 4 -6.859 -3.031 -0.183
25 HD2 TYR 4 HD2 TYR 4 -8.668 0.877 0.180
26 HE1 TYR 4 HE1 TYR 4 -8.481 -3.618 -1.945
27 HE2 TYR 4 HE2 TYR 4 -10.287 0.288 -1.580
28 HH TYR 4 HH TYR 4 -11.201 -1.482 -2.915
29 H LYS 5 H LYS 5 -5.740 -3.343 3.489
30 HA LYS 5 HA LYS 5 -4.014 -2.028 5.469
31 HB2 LYS 5 HB2 LYS 5 -4.155 -4.881 4.377
32 HB3 LYS 5 HB3 LYS 5 -3.015 -4.359 5.611
33 HG2 LYS 5 HG2 LYS 5 -4.869 -3.779 7.130
34 HG3 LYS 5 HG3 LYS 5 -6.042 -4.242 5.875
35 HD2 LYS 5 HD2 LYS 5 -5.150 -6.542 5.880
36 HD3 LYS 5 HD3 LYS 5 -3.995 -6.104 7.164
37 HE2 LYS 5 HE2 LYS 5 -5.656 -5.871 8.786
38 HE3 LYS 5 HE3 LYS 5 -6.916 -5.522 7.585
39 HZ1 LYS 5 HZ1 LYS 5 -7.300 -7.632 8.423
40 HZ2 LYS 5 HZ2 LYS 5 -6.823 -7.831 6.887
41 HZ3 LYS 5 HZ3 LYS 5 -5.754 -8.170 8.107
42 H LEU 6 H LEU 6 -2.085 -1.158 4.974
43 HA LEU 6 HA LEU 6 -0.936 -1.561 2.284
44 HB2 LEU 6 HB2 LEU 6 -1.459 0.704 3.153
45 HB3 LEU 6 HB3 LEU 6 -0.418 0.431 4.530
46 HG LEU 6 HG LEU 6 0.622 1.907 2.939
47 HD11 LEU 6 HD11 LEU 6 2.759 0.965 2.610
48 HD12 LEU 6 HD12 LEU 6 2.139 0.287 4.134
49 HD13 LEU 6 HD13 LEU 6 2.167 -0.683 2.637
50 HD21 LEU 6 HD21 LEU 6 -0.535 1.081 0.892
51 HD22 LEU 6 HD22 LEU 6 1.210 1.284 0.667
52 HD23 LEU 6 HD23 LEU 6 0.535 -0.337 0.909
53 H ILE 7 H ILE 7 0.678 -3.059 2.177
54 HA ILE 7 HA ILE 7 2.351 -3.593 4.589
55 HB ILE 7 HB ILE 7 1.561 -5.635 2.465
56 HG12 ILE 7 HG12 ILE 7 0.692 -6.840 4.651
57 HG13 ILE 7 HG13 ILE 7 0.553 -5.206 5.295
58 HG21 ILE 7 HG21 ILE 7 3.868 -5.907 3.330
59 HG22 ILE 7 HG22 ILE 7 3.263 -5.845 4.997
60 HG23 ILE 7 HG23 ILE 7 2.830 -7.193 3.931
61 HD11 ILE 7 HD11 ILE 7 -0.998 -4.641 3.445
62 HD12 ILE 7 HD12 ILE 7 -0.755 -6.243 2.725
63 HD13 ILE 7 HD13 ILE 7 -1.562 -6.074 4.296
64 H LEU 8 H LEU 8 4.169 -2.559 4.196
65 HA LEU 8 HA LEU 8 5.055 -1.991 1.434
66 HB2 LEU 8 HB2 LEU 8 4.692 -0.234 3.390
67 HB3 LEU 8 HB3 LEU 8 6.178 -0.890 4.026
68 HG LEU 8 HG LEU 8 7.219 -0.385 1.743
69 HD11 LEU 8 HD11 LEU 8 6.144 1.278 0.361
70 HD12 LEU 8 HD12 LEU 8 4.962 0.001 0.593
71 HD13 LEU 8 HD13 LEU 8 4.821 1.496 1.527
72 HD21 LEU 8 HD21 LEU 8 7.724 0.930 3.746
73 HD22 LEU 8 HD22 LEU 8 7.563 2.015 2.360
74 HD23 LEU 8 HD23 LEU 8 6.237 1.883 3.535
75 H ASN 9 H ASN 9 6.449 -3.527 0.627
76 HA ASN 9 HA ASN 9 8.361 -4.877 2.469
77 HB2 ASN 9 HB2 ASN 9 6.520 -6.295 1.633
78 HB3 ASN 9 HB3 ASN 9 6.966 -5.930 -0.028
79 HD21 ASN 9 HD22 ASN 9 9.661 -6.352 -0.295
80 HD22 ASN 9 HD21 ASN 9 10.026 -7.988 0.226
81 H GLY 10 H GLY 10 9.949 -3.219 2.150
82 HA2 GLY 10 HA2 GLY 10 10.842 -2.561 -0.561
83 HA3 GLY 10 HA3 GLY 10 11.410 -1.902 0.983
84 H LYS 11 H LYS 11 13.477 -2.229 -0.272
85 HA LYS 11 HA LYS 11 14.512 -5.038 -0.126
86 HB2 LYS 11 HB2 LYS 11 16.333 -4.362 -1.509
87 HB3 LYS 11 HB3 LYS 11 14.838 -3.906 -2.285
88 HG2 LYS 11 HG2 LYS 11 16.116 -1.774 -0.597
89 HG3 LYS 11 HG3 LYS 11 17.048 -2.279 -2.003
90 HD2 LYS 11 HD2 LYS 11 15.414 -1.573 -3.533
91 HD3 LYS 11 HD3 LYS 11 14.129 -1.630 -2.332
92 HE2 LYS 11 HE2 LYS 11 15.161 0.289 -1.125
93 HE3 LYS 11 HE3 LYS 11 16.417 0.397 -2.378
94 HZ1 LYS 11 HZ1 LYS 11 14.390 1.915 -2.655
95 HZ2 LYS 11 HZ2 LYS 11 14.803 1.007 -3.958
96 HZ3 LYS 11 HZ3 LYS 11 13.538 0.584 -3.044
97 H THR 12 H THR 12 14.451 -2.396 1.892
98 HA THR 12 HA THR 12 16.759 -3.474 3.407
99 HB THR 12 HB THR 12 16.503 -0.592 2.470
100 HG1 THR 12 HG1 THR 12 17.608 -2.695 1.407
101 HG21 THR 12 HG21 THR 12 18.729 -0.218 3.528
102 HG22 THR 12 HG22 THR 12 17.440 -0.458 4.706
103 HG23 THR 12 HG23 THR 12 18.576 -1.783 4.353
104 H LEU 13 H LEU 13 13.596 -2.002 3.341
105 HA LEU 13 HA LEU 13 13.376 -2.257 6.211
106 HB2 LEU 13 HB2 LEU 13 12.552 -0.052 6.546
107 HB3 LEU 13 HB3 LEU 13 14.115 0.085 5.785
108 HG LEU 13 HG LEU 13 12.810 1.767 4.873
109 HD11 LEU 13 HD11 LEU 13 12.643 -0.304 2.678
110 HD12 LEU 13 HD12 LEU 13 12.715 1.455 2.525
111 HD13 LEU 13 HD13 LEU 13 14.118 0.589 3.150
112 HD21 LEU 13 HD21 LEU 13 10.634 1.697 4.009
113 HD22 LEU 13 HD22 LEU 13 10.539 -0.058 4.050
114 HD23 LEU 13 HD23 LEU 13 10.577 0.876 5.568
115 H LYS 14 H LYS 14 11.047 -2.030 6.806
116 HA LYS 14 HA LYS 14 9.129 -2.562 4.626
117 HB2 LYS 14 HB2 LYS 14 9.415 -4.341 7.087
118 HB3 LYS 14 HB3 LYS 14 8.077 -4.370 5.937
119 HG2 LYS 14 HG2 LYS 14 9.986 -4.689 4.126
120 HG3 LYS 14 HG3 LYS 14 10.936 -5.224 5.522
121 HD2 LYS 14 HD2 LYS 14 9.069 -6.886 6.010
122 HD3 LYS 14 HD3 LYS 14 8.304 -6.381 4.486
123 HE2 LYS 14 HE2 LYS 14 10.518 -6.941 3.327
124 HE3 LYS 14 HE3 LYS 14 11.077 -7.605 4.864
125 HZ1 LYS 14 HZ1 LYS 14 10.281 -9.327 3.549
126 HZ2 LYS 14 HZ2 LYS 14 9.121 -9.141 4.724
127 HZ3 LYS 14 HZ3 LYS 14 8.852 -8.593 3.198
128 H GLY 15 H GLY 15 6.805 -2.421 5.533
129 HA2 GLY 15 HA2 GLY 15 6.520 -0.711 7.898
130 HA3 GLY 15 HA3 GLY 15 6.174 0.050 6.341
131 H GLU 16 H GLU 16 4.236 -0.488 8.463
132 HA GLU 16 HA GLU 16 2.294 -2.009 6.838
133 HB2 GLU 16 HB2 GLU 16 3.367 -3.662 8.391
134 HB3 GLU 16 HB3 GLU 16 2.911 -2.635 9.767
135 HG2 GLU 16 HG2 GLU 16 0.478 -2.906 8.999
136 HG3 GLU 16 HG3 GLU 16 1.052 -4.087 7.830
137 H THR 17 H THR 17 0.644 -0.532 6.638
138 HA THR 17 HA THR 17 -0.261 1.008 9.003
139 HB THR 17 HB THR 17 -0.447 2.998 7.424
140 HG1 THR 17 HG1 THR 17 1.046 2.974 5.699
141 HG21 THR 17 HG21 THR 17 1.327 2.814 9.188
142 HG22 THR 17 HG22 THR 17 2.411 2.112 7.975
143 HG23 THR 17 HG23 THR 17 1.814 3.764 7.774
144 H THR 18 H THR 18 -2.426 2.228 8.287
145 HA THR 18 HA THR 18 -4.023 0.587 6.401
146 HB THR 18 HB THR 18 -5.827 0.686 8.304
147 HG1 THR 18 HG1 THR 18 -4.465 1.913 9.747
148 HG21 THR 18 HG21 THR 18 -3.555 -1.272 8.708
149 HG22 THR 18 HG22 THR 18 -5.250 -1.471 9.185
150 HG23 THR 18 HG23 THR 18 -4.825 -1.429 7.464
151 H THR 19 H THR 19 -5.532 1.865 5.338
152 HA THR 19 HA THR 19 -6.490 4.331 6.438
153 HB THR 19 HB THR 19 -4.632 4.387 4.060
154 HG1 THR 19 HG1 THR 19 -4.229 4.743 6.526
155 HG21 THR 19 HG21 THR 19 -5.196 6.804 3.859
156 HG22 THR 19 HG22 THR 19 -6.599 5.790 3.486
157 HG23 THR 19 HG23 THR 19 -6.484 6.595 5.065
158 H GLU 20 H GLU 20 -8.554 4.819 5.551
159 HA GLU 20 HA GLU 20 -9.535 2.776 3.623
160 HB2 GLU 20 HB2 GLU 20 -11.770 3.276 4.476
161 HB3 GLU 20 HB3 GLU 20 -10.706 2.585 5.690
162 HG2 GLU 20 HG2 GLU 20 -10.394 4.802 6.720
163 HG3 GLU 20 HG3 GLU 20 -11.427 5.513 5.478
164 H ALA 21 H ALA 21 -10.787 3.486 1.864
165 HA ALA 21 HA ALA 21 -11.066 6.295 1.227
166 HB1 ALA 21 HB1 ALA 21 -9.258 4.495 -0.468
167 HB2 ALA 21 HB2 ALA 21 -9.708 6.188 -0.784
168 HB3 ALA 21 HB3 ALA 21 -8.669 5.804 0.594
169 H VAL 22 H VAL 22 -11.932 6.279 -1.297
170 HA VAL 22 HA VAL 22 -14.242 4.607 -1.145
171 HB VAL 22 HB VAL 22 -14.233 6.825 -2.190
172 HG11 VAL 22 HG11 VAL 22 -13.446 7.214 -4.448
173 HG12 VAL 22 HG12 VAL 22 -12.074 6.693 -3.459
174 HG13 VAL 22 HG13 VAL 22 -12.861 5.558 -4.589
175 HG21 VAL 22 HG21 VAL 22 -15.152 4.626 -4.090
176 HG22 VAL 22 HG22 VAL 22 -16.060 5.246 -2.698
177 HG23 VAL 22 HG23 VAL 22 -15.720 6.304 -4.070
178 H ASP 23 H ASP 23 -11.240 4.265 -3.181
179 HA ASP 23 HA ASP 23 -11.784 1.397 -3.324
180 HB2 ASP 23 HB2 ASP 23 -11.615 3.162 -5.800
181 HB3 ASP 23 HB3 ASP 23 -11.409 1.420 -5.821
182 H ALA 24 H ALA 24 -9.921 0.413 -4.750
183 HA ALA 24 HA ALA 24 -7.561 0.625 -3.348
184 HB1 ALA 24 HB1 ALA 24 -8.250 -1.307 -4.746
185 HB2 ALA 24 HB2 ALA 24 -7.914 -0.352 -6.210
186 HB3 ALA 24 HB3 ALA 24 -6.600 -0.775 -5.113
187 H ALA 25 H ALA 25 -8.297 2.257 -6.489
188 HA ALA 25 HA ALA 25 -5.754 3.295 -6.998
189 HB1 ALA 25 HB1 ALA 25 -7.599 3.512 -8.588
190 HB2 ALA 25 HB2 ALA 25 -8.440 4.633 -7.491
191 HB3 ALA 25 HB3 ALA 25 -6.902 5.101 -8.245
192 H THR 26 H THR 26 -8.318 4.800 -4.937
193 HA THR 26 HA THR 26 -6.686 7.109 -4.389
194 HB THR 26 HB THR 26 -9.057 5.965 -2.873
195 HG1 THR 26 HG1 THR 26 -9.737 6.526 -4.891
196 HG21 THR 26 HG21 THR 26 -7.775 7.613 -1.490
197 HG22 THR 26 HG22 THR 26 -7.819 8.770 -2.836
198 HG23 THR 26 HG23 THR 26 -9.315 8.275 -2.020
199 H ALA 27 H ALA 27 -6.944 3.895 -2.822
200 HA ALA 27 HA ALA 27 -5.409 4.648 -0.522
201 HB1 ALA 27 HB1 ALA 27 -5.802 1.904 -1.809
202 HB2 ALA 27 HB2 ALA 27 -5.107 2.207 -0.214
203 HB3 ALA 27 HB3 ALA 27 -6.805 2.626 -0.528
204 H GLU 28 H GLU 28 -4.603 3.035 -3.554
205 HA GLU 28 HA GLU 28 -1.874 2.618 -3.397
206 HB2 GLU 28 HB2 GLU 28 -3.418 1.748 -5.115
207 HB3 GLU 28 HB3 GLU 28 -3.700 3.360 -5.725
208 HG2 GLU 28 HG2 GLU 28 -1.286 3.495 -6.411
209 HG3 GLU 28 HG3 GLU 28 -1.123 1.780 -5.958
210 H LYS 29 H LYS 29 -3.549 5.459 -4.849
211 HA LYS 29 HA LYS 29 -1.120 6.830 -5.429
212 HB2 LYS 29 HB2 LYS 29 -3.978 7.857 -5.157
213 HB3 LYS 29 HB3 LYS 29 -2.598 8.836 -5.652
214 HG2 LYS 29 HG2 LYS 29 -2.169 7.026 -7.465
215 HG3 LYS 29 HG3 LYS 29 -3.780 6.439 -7.108
216 HD2 LYS 29 HD2 LYS 29 -4.034 7.906 -8.936
217 HD3 LYS 29 HD3 LYS 29 -4.619 8.826 -7.532
218 HE2 LYS 29 HE2 LYS 29 -2.364 9.922 -7.365
219 HE3 LYS 29 HE3 LYS 29 -1.810 8.966 -8.745
220 HZ1 LYS 29 HZ1 LYS 29 -3.529 10.068 -10.062
221 HZ2 LYS 29 HZ2 LYS 29 -3.882 11.057 -8.778
222 HZ3 LYS 29 HZ3 LYS 29 -2.373 11.068 -9.491
223 H VAL 30 H VAL 30 -3.454 7.398 -2.716
224 HA VAL 30 HA VAL 30 -1.978 9.496 -1.571
225 HB VAL 30 HB VAL 30 -3.930 7.490 -0.424
226 HG11 VAL 30 HG11 VAL 30 -4.192 9.036 1.517
227 HG12 VAL 30 HG12 VAL 30 -2.649 8.197 1.485
228 HG13 VAL 30 HG13 VAL 30 -2.727 9.895 0.982
229 HG21 VAL 30 HG21 VAL 30 -4.179 10.463 -1.120
230 HG22 VAL 30 HG22 VAL 30 -4.812 9.135 -2.103
231 HG23 VAL 30 HG23 VAL 30 -5.481 9.430 -0.495
232 H PHE 31 H PHE 31 -1.813 5.933 -0.685
233 HA PHE 31 HA PHE 31 0.318 6.530 1.126
234 HB2 PHE 31 HB2 PHE 31 -0.869 3.981 0.068
235 HB3 PHE 31 HB3 PHE 31 0.720 3.906 0.786
236 HD1 PHE 31 HD2 PHE 31 0.558 5.867 3.084
237 HD2 PHE 31 HD1 PHE 31 -2.156 2.810 1.684
238 HE1 PHE 31 HE2 PHE 31 -0.252 5.560 5.362
239 HE2 PHE 31 HE1 PHE 31 -2.932 2.477 4.018
240 HZ PHE 31 HZ PHE 31 -1.989 3.852 5.858
241 H LYS 32 H LYS 32 0.494 6.447 -2.329
242 HA LYS 32 HA LYS 32 3.094 5.346 -2.600
243 HB2 LYS 32 HB2 LYS 32 1.508 6.015 -4.479
244 HB3 LYS 32 HB3 LYS 32 2.021 7.685 -4.227
245 HG2 LYS 32 HG2 LYS 32 4.274 7.193 -4.813
246 HG3 LYS 32 HG3 LYS 32 4.021 5.447 -4.720
247 HD2 LYS 32 HD2 LYS 32 2.759 5.381 -6.724
248 HD3 LYS 32 HD3 LYS 32 2.521 7.126 -6.746
249 HE2 LYS 32 HE2 LYS 32 4.159 6.201 -8.443
250 HE3 LYS 32 HE3 LYS 32 4.707 7.573 -7.472
251 HZ1 LYS 32 HZ1 LYS 32 5.433 4.794 -6.779
252 HZ2 LYS 32 HZ2 LYS 32 6.312 5.733 -7.780
253 HZ3 LYS 32 HZ3 LYS 32 6.088 6.226 -6.233
254 H GLN 33 H GLN 33 1.988 8.479 -1.449
255 HA GLN 33 HA GLN 33 4.423 9.927 -1.482
256 HB2 GLN 33 HB2 GLN 33 2.105 9.971 0.515
257 HB3 GLN 33 HB3 GLN 33 3.388 11.172 0.426
258 HG2 GLN 33 HG2 GLN 33 2.652 11.952 -1.724
259 HG3 GLN 33 HG3 GLN 33 1.505 10.615 -1.899
260 HE21 GLN 33 HE22 GLN 33 -0.176 10.454 -0.084
261 HE22 GLN 33 HE21 GLN 33 -0.917 11.972 0.428
262 H TYR 34 H TYR 34 2.928 8.103 1.246
263 HA TYR 34 HA TYR 34 5.143 8.192 2.995
264 HB2 TYR 34 HB2 TYR 34 3.169 7.651 4.034
265 HB3 TYR 34 HB3 TYR 34 2.625 6.596 2.740
266 HD1 TYR 34 HD2 TYR 34 5.110 6.754 5.567
267 HD2 TYR 34 HD1 TYR 34 2.764 4.265 2.942
268 HE1 TYR 34 HE2 TYR 34 5.764 4.762 6.884
269 HE2 TYR 34 HE1 TYR 34 3.422 2.276 4.270
270 HH TYR 34 HH TYR 34 5.008 2.299 7.292
271 H ALA 35 H ALA 35 4.205 5.645 0.641
272 HA ALA 35 HA ALA 35 6.217 3.795 1.292
273 HB1 ALA 35 HB1 ALA 35 5.852 3.004 -1.063
274 HB2 ALA 35 HB2 ALA 35 4.327 3.302 -0.197
275 HB3 ALA 35 HB3 ALA 35 4.937 4.482 -1.384
276 H ASN 36 H ASN 36 6.331 6.315 -1.331
277 HA ASN 36 HA ASN 36 9.076 5.761 -1.850
278 HB2 ASN 36 HB2 ASN 36 7.451 6.795 -3.459
279 HB3 ASN 36 HB3 ASN 36 7.618 8.321 -2.572
280 HD21 ASN 36 HD22 ASN 36 9.030 9.622 -3.822
281 HD22 ASN 36 HD21 ASN 36 10.524 9.040 -4.529
282 H ASP 37 H ASP 37 7.536 7.919 0.491
283 HA ASP 37 HA ASP 37 9.915 9.515 1.049
284 HB2 ASP 37 HB2 ASP 37 7.629 10.340 1.500
285 HB3 ASP 37 HB3 ASP 37 7.407 9.052 2.705
286 H ASN 38 H ASN 38 8.759 6.380 1.903
287 HA ASN 38 HA ASN 38 10.602 6.060 4.183
288 HB2 ASN 38 HB2 ASN 38 8.135 5.315 4.139
289 HB3 ASN 38 HB3 ASN 38 8.657 4.024 3.045
290 HD21 ASN 38 HD22 ASN 38 7.503 3.003 5.175
291 HD22 ASN 38 HD21 ASN 38 8.630 2.577 6.448
292 H GLY 39 H GLY 39 10.831 5.929 0.847
293 HA2 GLY 39 HA2 GLY 39 12.612 5.238 -0.437
294 HA3 GLY 39 HA3 GLY 39 13.274 4.345 0.926
295 H VAL 40 H VAL 40 9.925 3.774 -0.254
296 HA VAL 40 HA VAL 40 10.878 1.235 -1.445
297 HB VAL 40 HB VAL 40 8.347 1.563 0.176
298 HG11 VAL 40 HG11 VAL 40 9.709 -0.794 -1.185
299 HG12 VAL 40 HG12 VAL 40 8.453 -1.016 0.039
300 HG13 VAL 40 HG13 VAL 40 8.078 -0.176 -1.465
301 HG21 VAL 40 HG21 VAL 40 9.476 0.095 1.870
302 HG22 VAL 40 HG22 VAL 40 10.994 0.341 1.002
303 HG23 VAL 40 HG23 VAL 40 10.167 1.717 1.745
304 H ASP 41 H ASP 41 10.265 0.915 -3.459
305 HA ASP 41 HA ASP 41 7.708 1.934 -4.428
306 HB2 ASP 41 HB2 ASP 41 9.389 3.827 -4.738
307 HB3 ASP 41 HB3 ASP 41 10.293 2.757 -5.812
308 H GLY 42 H GLY 42 7.058 -0.109 -4.754
309 HA2 GLY 42 HA2 GLY 42 8.597 -1.810 -6.659
310 HA3 GLY 42 HA3 GLY 42 7.903 -2.441 -5.154
311 H GLU 43 H GLU 43 6.691 -3.909 -6.439
312 HA GLU 43 HA GLU 43 4.662 -2.923 -8.298
313 HB2 GLU 43 HB2 GLU 43 5.940 -4.962 -8.713
314 HB3 GLU 43 HB3 GLU 43 5.358 -5.666 -7.190
315 HG2 GLU 43 HG2 GLU 43 3.046 -5.643 -8.032
316 HG3 GLU 43 HG3 GLU 43 3.567 -4.806 -9.509
317 H TRP 44 H TRP 44 2.854 -2.068 -7.525
318 HA TRP 44 HA TRP 44 1.769 -2.650 -4.859
319 HB2 TRP 44 HB2 TRP 44 1.048 -0.686 -7.094
320 HB3 TRP 44 HB3 TRP 44 0.148 -0.830 -5.597
321 HD1 TRP 44 HD1 TRP 44 3.743 -0.014 -6.665
322 HE1 TRP 44 HE1 TRP 44 4.738 1.732 -4.988
323 HE3 TRP 44 HE3 TRP 44 -0.269 0.531 -3.555
324 HZ2 TRP 44 HZ2 TRP 44 3.864 3.170 -2.772
325 HZ3 TRP 44 HZ3 TRP 44 -0.164 2.141 -1.659
326 HH2 TRP 44 HH2 TRP 44 1.910 3.422 -1.227
327 H THR 45 H THR 45 0.655 -4.620 -4.849
328 HA THR 45 HA THR 45 -1.487 -4.925 -6.911
329 HB THR 45 HB THR 45 0.219 -7.104 -5.690
330 HG1 THR 45 HG1 THR 45 1.228 -7.065 -7.546
331 HG21 THR 45 HG21 THR 45 -2.134 -7.206 -7.640
332 HG22 THR 45 HG22 THR 45 -1.003 -8.540 -7.402
333 HG23 THR 45 HG23 THR 45 -2.026 -8.004 -6.058
334 H TYR 46 H TYR 46 -3.431 -4.834 -6.151
335 HA TYR 46 HA TYR 46 -3.985 -5.041 -3.285
336 HB2 TYR 46 HB2 TYR 46 -6.029 -3.914 -3.767
337 HB3 TYR 46 HB3 TYR 46 -4.734 -3.048 -4.561
338 HD1 TYR 46 HD1 TYR 46 -4.530 -2.988 -7.036
339 HD2 TYR 46 HD2 TYR 46 -7.731 -5.110 -5.049
340 HE1 TYR 46 HE1 TYR 46 -5.708 -3.252 -9.201
341 HE2 TYR 46 HE2 TYR 46 -8.889 -5.390 -7.201
342 HH TYR 46 HH TYR 46 -8.286 -5.453 -9.651
343 H ASP 47 H ASP 47 -5.680 -6.254 -2.470
344 HA ASP 47 HA ASP 47 -6.865 -8.397 -4.120
345 HB2 ASP 47 HB2 ASP 47 -4.875 -9.379 -3.014
346 HB3 ASP 47 HB3 ASP 47 -5.468 -8.844 -1.439
347 H ASP 48 H ASP 48 -8.825 -7.337 -4.042
348 HA ASP 48 HA ASP 48 -9.774 -5.929 -1.702
349 HB2 ASP 48 HB2 ASP 48 -11.171 -5.024 -3.141
350 HB3 ASP 48 HB3 ASP 48 -10.545 -6.028 -4.416
351 H ALA 49 H ALA 49 -10.204 -9.233 -2.918
352 HA ALA 49 HA ALA 49 -12.332 -10.017 -1.221
353 HB1 ALA 49 HB1 ALA 49 -10.082 -11.687 -2.423
354 HB2 ALA 49 HB2 ALA 49 -11.566 -12.328 -1.728
355 HB3 ALA 49 HB3 ALA 49 -11.642 -11.328 -3.192
356 H THR 50 H THR 50 -8.777 -10.356 -0.832
357 HA THR 50 HA THR 50 -9.044 -11.317 1.917
358 HB THR 50 HB THR 50 -6.558 -10.427 0.393
359 HG1 THR 50 HG1 THR 50 -6.805 -12.088 -0.776
360 HG21 THR 50 HG21 THR 50 -6.174 -10.892 2.830
361 HG22 THR 50 HG22 THR 50 -6.848 -12.527 2.591
362 HG23 THR 50 HG23 THR 50 -5.364 -12.032 1.770
363 H LYS 51 H LYS 51 -8.907 -8.269 0.348
364 HA LYS 51 HA LYS 51 -8.840 -6.162 0.888
365 HB2 LYS 51 HB2 LYS 51 -10.739 -6.785 2.212
366 HB3 LYS 51 HB3 LYS 51 -9.739 -7.091 3.627
367 HG2 LYS 51 HG2 LYS 51 -9.230 -4.779 3.899
368 HG3 LYS 51 HG3 LYS 51 -9.742 -4.363 2.267
369 HD2 LYS 51 HD2 LYS 51 -11.726 -5.584 4.202
370 HD3 LYS 51 HD3 LYS 51 -11.309 -3.867 4.352
371 HE2 LYS 51 HE2 LYS 51 -12.197 -3.271 2.320
372 HE3 LYS 51 HE3 LYS 51 -11.941 -4.857 1.591
373 HZ1 LYS 51 HZ1 LYS 51 -14.263 -4.067 2.181
374 HZ2 LYS 51 HZ2 LYS 51 -13.845 -5.640 2.403
375 HZ3 LYS 51 HZ3 LYS 51 -13.932 -4.583 3.714
376 H THR 52 H THR 52 -6.488 -7.085 0.482
377 HA THR 52 HA THR 52 -4.715 -5.697 2.396
378 HB THR 52 HB THR 52 -3.061 -7.620 1.682
379 HG1 THR 52 HG1 THR 52 -3.975 -9.505 1.183
380 HG21 THR 52 HG21 THR 52 -5.305 -8.161 3.680
381 HG22 THR 52 HG22 THR 52 -3.724 -8.970 3.631
382 HG23 THR 52 HG23 THR 52 -3.814 -7.244 3.999
383 H PHE 53 H PHE 53 -2.755 -4.815 1.365
384 HA PHE 53 HA PHE 53 -2.717 -4.817 -1.557
385 HB2 PHE 53 HB2 PHE 53 -4.268 -2.963 -0.516
386 HB3 PHE 53 HB3 PHE 53 -2.781 -2.167 -0.064
387 HD1 PHE 53 HD2 PHE 53 -1.484 -3.291 -2.957
388 HD2 PHE 53 HD1 PHE 53 -4.909 -0.965 -1.705
389 HE1 PHE 53 HE2 PHE 53 -1.562 -2.180 -5.154
390 HE2 PHE 53 HE1 PHE 53 -4.886 0.199 -3.884
391 HZ PHE 53 HZ PHE 53 -3.219 -0.422 -5.629
392 H THR 54 H THR 54 -0.700 -5.760 -1.593
393 HA THR 54 HA THR 54 1.392 -4.714 0.177
394 HB THR 54 HB THR 54 1.522 -7.167 -1.562
395 HG1 THR 54 HG1 THR 54 0.720 -8.307 0.043
396 HG21 THR 54 HG21 THR 54 3.690 -6.472 -0.689
397 HG22 THR 54 HG22 THR 54 3.038 -6.278 0.937
398 HG23 THR 54 HG23 THR 54 3.154 -7.886 0.221
399 H VAL 55 H VAL 55 3.252 -3.847 -0.473
400 HA VAL 55 HA VAL 55 3.647 -3.152 -3.339
401 HB VAL 55 HB VAL 55 4.682 -1.707 -0.853
402 HG11 VAL 55 HG11 VAL 55 6.094 -1.391 -2.810
403 HG12 VAL 55 HG12 VAL 55 4.683 -0.990 -3.808
404 HG13 VAL 55 HG13 VAL 55 5.195 0.101 -2.493
405 HG21 VAL 55 HG21 VAL 55 2.248 -1.107 -2.533
406 HG22 VAL 55 HG22 VAL 55 2.341 -1.386 -0.771
407 HG23 VAL 55 HG23 VAL 55 3.029 0.085 -1.456
408 H THR 56 H THR 56 5.056 -4.820 -4.000
409 HA THR 56 HA THR 56 7.282 -5.529 -2.135
410 HB THR 56 HB THR 56 5.938 -7.239 -4.230
411 HG1 THR 56 HG1 THR 56 4.970 -8.169 -2.655
412 HG21 THR 56 HG21 THR 56 8.156 -7.920 -2.247
413 HG22 THR 56 HG22 THR 56 7.308 -9.082 -3.289
414 HG23 THR 56 HG23 THR 56 8.330 -7.834 -4.018
415 H GLU 57 H GLU 57 9.044 -4.532 -2.649
416 HA GLU 57 HA GLU 57 9.708 -3.819 -5.455
417 HB2 GLU 57 HB2 GLU 57 9.672 -2.019 -3.694
418 HB3 GLU 57 HB3 GLU 57 10.854 -2.941 -2.758
419 HG2 GLU 57 HG2 GLU 57 12.534 -2.672 -4.491
420 HG3 GLU 57 HG3 GLU 57 11.361 -1.960 -5.600
Start of MODEL 10
1 H1 MET 1 H MET 1 -17.575 1.897 -0.107
2 HA MET 1 HA MET 1 -15.001 1.947 -0.120
3 HB2 MET 1 HB2 MET 1 -16.390 2.220 2.575
4 HB3 MET 1 HB3 MET 1 -14.839 2.885 2.138
5 HG2 MET 1 HG2 MET 1 -16.143 4.221 0.326
6 HG3 MET 1 HG3 MET 1 -17.586 3.689 1.174
7 HE1 MET 1 HE1 MET 1 -14.409 6.604 2.929
8 HE2 MET 1 HE2 MET 1 -13.999 4.911 2.621
9 HE3 MET 1 HE3 MET 1 -14.398 6.002 1.265
10 H GLY 2 H GLY 2 -13.168 1.245 1.446
11 HA2 GLY 2 HA2 GLY 2 -13.580 -1.274 2.860
12 HA3 GLY 2 HA3 GLY 2 -12.589 -1.362 1.392
13 H THR 3 H THR 3 -11.526 -1.961 3.898
14 HA THR 3 HA THR 3 -9.949 0.389 4.778
15 HB THR 3 HB THR 3 -10.180 -2.408 5.957
16 HG1 THR 3 HG1 THR 3 -12.092 -1.493 6.174
17 HG21 THR 3 HG21 THR 3 -9.265 -1.310 7.995
18 HG22 THR 3 HG22 THR 3 -8.124 -1.259 6.650
19 HG23 THR 3 HG23 THR 3 -9.048 0.200 7.075
20 H TYR 4 H TYR 4 -8.281 0.698 3.317
21 HA TYR 4 HA TYR 4 -6.954 -1.675 2.156
22 HB2 TYR 4 HB2 TYR 4 -6.868 1.285 1.574
23 HB3 TYR 4 HB3 TYR 4 -5.745 0.131 0.850
24 HD1 TYR 4 HD1 TYR 4 -6.513 -1.576 -0.761
25 HD2 TYR 4 HD2 TYR 4 -9.264 1.298 0.932
26 HE1 TYR 4 HE1 TYR 4 -8.133 -2.114 -2.514
27 HE2 TYR 4 HE2 TYR 4 -10.922 0.729 -0.814
28 HH TYR 4 HH TYR 4 -10.191 -1.316 -3.584
29 H LYS 5 H LYS 5 -5.766 -2.528 3.654
30 HA LYS 5 HA LYS 5 -3.971 -1.085 5.442
31 HB2 LYS 5 HB2 LYS 5 -5.229 -3.135 6.070
32 HB3 LYS 5 HB3 LYS 5 -4.347 -4.052 4.839
33 HG2 LYS 5 HG2 LYS 5 -2.206 -3.560 6.051
34 HG3 LYS 5 HG3 LYS 5 -3.136 -2.664 7.267
35 HD2 LYS 5 HD2 LYS 5 -4.506 -4.736 7.673
36 HD3 LYS 5 HD3 LYS 5 -3.414 -5.626 6.582
37 HE2 LYS 5 HE2 LYS 5 -1.498 -4.980 8.040
38 HE3 LYS 5 HE3 LYS 5 -2.622 -4.118 9.105
39 HZ1 LYS 5 HZ1 LYS 5 -2.487 -6.114 10.132
40 HZ2 LYS 5 HZ2 LYS 5 -3.764 -6.443 9.138
41 HZ3 LYS 5 HZ3 LYS 5 -2.253 -6.980 8.746
42 H LEU 6 H LEU 6 -2.132 -0.252 4.551
43 HA LEU 6 HA LEU 6 -1.073 -1.324 2.044
44 HB2 LEU 6 HB2 LEU 6 -1.296 1.275 3.147
45 HB3 LEU 6 HB3 LEU 6 0.403 0.900 3.307
46 HG LEU 6 HG LEU 6 0.121 2.005 1.246
47 HD11 LEU 6 HD11 LEU 6 1.035 0.543 -0.366
48 HD12 LEU 6 HD12 LEU 6 1.656 0.031 1.203
49 HD13 LEU 6 HD13 LEU 6 0.366 -0.893 0.404
50 HD21 LEU 6 HD21 LEU 6 -2.337 0.337 0.971
51 HD22 LEU 6 HD22 LEU 6 -2.036 2.014 0.522
52 HD23 LEU 6 HD23 LEU 6 -1.468 0.713 -0.524
53 H ILE 7 H ILE 7 0.708 -2.601 1.919
54 HA ILE 7 HA ILE 7 2.480 -2.911 4.278
55 HB ILE 7 HB ILE 7 1.462 -4.993 2.298
56 HG12 ILE 7 HG12 ILE 7 1.229 -6.243 4.609
57 HG13 ILE 7 HG13 ILE 7 1.341 -4.653 5.332
58 HG21 ILE 7 HG21 ILE 7 3.892 -5.309 2.467
59 HG22 ILE 7 HG22 ILE 7 3.810 -5.200 4.233
60 HG23 ILE 7 HG23 ILE 7 3.075 -6.569 3.365
61 HD11 ILE 7 HD11 ILE 7 -0.716 -3.990 4.174
62 HD12 ILE 7 HD12 ILE 7 -0.730 -5.497 3.231
63 HD13 ILE 7 HD13 ILE 7 -0.987 -5.518 5.001
64 H LEU 8 H LEU 8 4.457 -2.339 3.912
65 HA LEU 8 HA LEU 8 5.443 -1.718 1.147
66 HB2 LEU 8 HB2 LEU 8 6.009 -0.730 3.942
67 HB3 LEU 8 HB3 LEU 8 7.391 -0.891 2.871
68 HG LEU 8 HG LEU 8 6.517 0.679 1.287
69 HD11 LEU 8 HD11 LEU 8 3.972 0.623 2.937
70 HD12 LEU 8 HD12 LEU 8 4.348 1.890 1.732
71 HD13 LEU 8 HD13 LEU 8 4.164 0.212 1.224
72 HD21 LEU 8 HD21 LEU 8 7.698 1.595 3.188
73 HD22 LEU 8 HD22 LEU 8 6.351 2.690 2.828
74 HD23 LEU 8 HD23 LEU 8 6.227 1.573 4.190
75 H ASN 9 H ASN 9 6.499 -3.503 0.281
76 HA ASN 9 HA ASN 9 8.044 -5.234 2.143
77 HB2 ASN 9 HB2 ASN 9 5.942 -6.270 1.246
78 HB3 ASN 9 HB3 ASN 9 6.573 -6.067 -0.388
79 HD21 ASN 9 HD22 ASN 9 8.800 -7.155 -0.862
80 HD22 ASN 9 HD21 ASN 9 9.105 -8.603 0.002
81 H GLY 10 H GLY 10 9.730 -3.676 1.854
82 HA2 GLY 10 HA2 GLY 10 10.726 -3.098 -0.824
83 HA3 GLY 10 HA3 GLY 10 11.280 -2.456 0.726
84 H LYS 11 H LYS 11 13.227 -2.886 -0.686
85 HA LYS 11 HA LYS 11 14.307 -5.643 -0.453
86 HB2 LYS 11 HB2 LYS 11 16.020 -4.992 -1.934
87 HB3 LYS 11 HB3 LYS 11 14.523 -4.390 -2.612
88 HG2 LYS 11 HG2 LYS 11 16.184 -2.485 -0.936
89 HG3 LYS 11 HG3 LYS 11 16.814 -2.945 -2.497
90 HD2 LYS 11 HD2 LYS 11 15.174 -1.862 -3.691
91 HD3 LYS 11 HD3 LYS 11 13.977 -2.046 -2.403
92 HE2 LYS 11 HE2 LYS 11 15.111 -0.362 -1.027
93 HE3 LYS 11 HE3 LYS 11 16.381 -0.165 -2.244
94 HZ1 LYS 11 HZ1 LYS 11 13.587 0.258 -3.047
95 HZ2 LYS 11 HZ2 LYS 11 14.314 1.437 -2.180
96 HZ3 LYS 11 HZ3 LYS 11 14.922 0.918 -3.650
97 H THR 12 H THR 12 14.194 -3.063 1.577
98 HA THR 12 HA THR 12 16.656 -3.888 2.994
99 HB THR 12 HB THR 12 16.064 -1.103 1.921
100 HG1 THR 12 HG1 THR 12 17.413 -2.996 0.965
101 HG21 THR 12 HG21 THR 12 18.076 -0.275 3.083
102 HG22 THR 12 HG22 THR 12 16.793 -0.690 4.207
103 HG23 THR 12 HG23 THR 12 18.172 -1.801 4.004
104 H LEU 13 H LEU 13 13.412 -2.450 3.034
105 HA LEU 13 HA LEU 13 13.244 -2.918 5.872
106 HB2 LEU 13 HB2 LEU 13 12.508 -0.714 6.434
107 HB3 LEU 13 HB3 LEU 13 14.068 -0.584 5.678
108 HG LEU 13 HG LEU 13 12.822 1.241 4.961
109 HD11 LEU 13 HD11 LEU 13 12.613 -0.639 2.574
110 HD12 LEU 13 HD12 LEU 13 12.719 1.114 2.546
111 HD13 LEU 13 HD13 LEU 13 14.105 0.187 3.114
112 HD21 LEU 13 HD21 LEU 13 10.665 1.327 4.050
113 HD22 LEU 13 HD22 LEU 13 10.519 -0.418 3.900
114 HD23 LEU 13 HD23 LEU 13 10.551 0.336 5.513
115 H LYS 14 H LYS 14 10.916 -2.541 6.556
116 HA LYS 14 HA LYS 14 8.940 -2.846 4.415
117 HB2 LYS 14 HB2 LYS 14 9.191 -4.770 6.781
118 HB3 LYS 14 HB3 LYS 14 7.849 -4.714 5.634
119 HG2 LYS 14 HG2 LYS 14 9.691 -5.049 3.790
120 HG3 LYS 14 HG3 LYS 14 10.707 -5.570 5.143
121 HD2 LYS 14 HD2 LYS 14 8.838 -7.253 5.695
122 HD3 LYS 14 HD3 LYS 14 8.107 -6.791 4.146
123 HE2 LYS 14 HE2 LYS 14 10.383 -7.310 3.087
124 HE3 LYS 14 HE3 LYS 14 10.875 -7.994 4.640
125 HZ1 LYS 14 HZ1 LYS 14 8.676 -8.901 2.898
126 HZ2 LYS 14 HZ2 LYS 14 10.070 -9.712 3.210
127 HZ3 LYS 14 HZ3 LYS 14 8.913 -9.503 4.402
128 H GLY 15 H GLY 15 6.647 -2.626 5.422
129 HA2 GLY 15 HA2 GLY 15 6.460 -1.243 7.966
130 HA3 GLY 15 HA3 GLY 15 6.268 -0.166 6.568
131 H GLU 16 H GLU 16 4.133 -0.673 8.417
132 HA GLU 16 HA GLU 16 2.154 -1.845 6.571
133 HB2 GLU 16 HB2 GLU 16 2.934 -3.700 8.035
134 HB3 GLU 16 HB3 GLU 16 2.526 -2.736 9.458
135 HG2 GLU 16 HG2 GLU 16 0.114 -2.689 8.590
136 HG3 GLU 16 HG3 GLU 16 0.611 -3.840 7.356
137 H THR 17 H THR 17 0.610 -0.241 6.387
138 HA THR 17 HA THR 17 -0.250 1.307 8.775
139 HB THR 17 HB THR 17 -0.450 3.230 7.092
140 HG1 THR 17 HG1 THR 17 0.845 3.145 5.328
141 HG21 THR 17 HG21 THR 17 1.878 3.960 7.381
142 HG22 THR 17 HG22 THR 17 1.249 3.233 8.873
143 HG23 THR 17 HG23 THR 17 2.355 2.311 7.838
144 H THR 18 H THR 18 -2.495 2.446 8.159
145 HA THR 18 HA THR 18 -3.955 1.015 6.083
146 HB THR 18 HB THR 18 -3.962 -0.682 7.799
147 HG1 THR 18 HG1 THR 18 -6.522 0.471 7.912
148 HG21 THR 18 HG21 THR 18 -3.572 0.476 9.856
149 HG22 THR 18 HG22 THR 18 -5.094 1.370 9.724
150 HG23 THR 18 HG23 THR 18 -5.118 -0.382 9.978
151 H THR 19 H THR 19 -5.744 2.074 5.418
152 HA THR 19 HA THR 19 -6.998 4.183 6.933
153 HB THR 19 HB THR 19 -5.338 4.800 4.460
154 HG1 THR 19 HG1 THR 19 -4.774 4.995 6.906
155 HG21 THR 19 HG21 THR 19 -6.326 7.074 4.578
156 HG22 THR 19 HG22 THR 19 -7.484 5.846 4.044
157 HG23 THR 19 HG23 THR 19 -7.561 6.441 5.707
158 H GLU 20 H GLU 20 -9.187 4.354 6.249
159 HA GLU 20 HA GLU 20 -9.945 2.356 4.201
160 HB2 GLU 20 HB2 GLU 20 -12.146 2.451 5.044
161 HB3 GLU 20 HB3 GLU 20 -11.049 2.342 6.417
162 HG2 GLU 20 HG2 GLU 20 -11.293 4.940 6.565
163 HG3 GLU 20 HG3 GLU 20 -12.659 4.736 5.459
164 H ALA 21 H ALA 21 -10.892 2.856 2.257
165 HA ALA 21 HA ALA 21 -11.384 5.708 1.625
166 HB1 ALA 21 HB1 ALA 21 -9.990 5.624 -0.334
167 HB2 ALA 21 HB2 ALA 21 -8.992 5.211 1.060
168 HB3 ALA 21 HB3 ALA 21 -9.552 3.930 -0.045
169 H VAL 22 H VAL 22 -12.218 5.850 -0.715
170 HA VAL 22 HA VAL 22 -14.515 4.101 -0.843
171 HB VAL 22 HB VAL 22 -14.780 6.443 -1.218
172 HG11 VAL 22 HG11 VAL 22 -13.996 7.645 -3.186
173 HG12 VAL 22 HG12 VAL 22 -12.610 7.059 -2.263
174 HG13 VAL 22 HG13 VAL 22 -13.110 6.228 -3.753
175 HG21 VAL 22 HG21 VAL 22 -16.142 6.378 -3.247
176 HG22 VAL 22 HG22 VAL 22 -15.329 4.906 -3.782
177 HG23 VAL 22 HG23 VAL 22 -16.338 4.880 -2.318
178 H ASP 23 H ASP 23 -11.561 4.564 -2.879
179 HA ASP 23 HA ASP 23 -12.077 1.877 -4.005
180 HB2 ASP 23 HB2 ASP 23 -11.969 4.529 -5.408
181 HB3 ASP 23 HB3 ASP 23 -10.987 3.263 -6.119
182 H ALA 24 H ALA 24 -10.163 0.974 -4.989
183 HA ALA 24 HA ALA 24 -7.932 1.014 -3.266
184 HB1 ALA 24 HB1 ALA 24 -6.859 -0.410 -4.958
185 HB2 ALA 24 HB2 ALA 24 -8.554 -0.894 -4.777
186 HB3 ALA 24 HB3 ALA 24 -8.047 0.082 -6.169
187 H ALA 25 H ALA 25 -8.470 2.701 -6.390
188 HA ALA 25 HA ALA 25 -5.857 3.711 -6.698
189 HB1 ALA 25 HB1 ALA 25 -7.435 3.888 -8.482
190 HB2 ALA 25 HB2 ALA 25 -8.511 4.935 -7.516
191 HB3 ALA 25 HB3 ALA 25 -6.907 5.502 -8.061
192 H THR 26 H THR 26 -8.372 4.814 -4.393
193 HA THR 26 HA THR 26 -7.134 7.410 -3.967
194 HB THR 26 HB THR 26 -8.967 5.774 -2.181
195 HG1 THR 26 HG1 THR 26 -9.631 7.613 -4.240
196 HG21 THR 26 HG21 THR 26 -8.021 7.672 -0.986
197 HG22 THR 26 HG22 THR 26 -8.406 8.765 -2.323
198 HG23 THR 26 HG23 THR 26 -9.711 8.031 -1.364
199 H ALA 27 H ALA 27 -7.169 4.214 -2.283
200 HA ALA 27 HA ALA 27 -5.344 4.842 -0.245
201 HB1 ALA 27 HB1 ALA 27 -5.843 2.167 -1.633
202 HB2 ALA 27 HB2 ALA 27 -5.040 2.395 -0.071
203 HB3 ALA 27 HB3 ALA 27 -6.756 2.830 -0.261
204 H GLU 28 H GLU 28 -4.775 3.421 -3.428
205 HA GLU 28 HA GLU 28 -2.033 2.947 -3.409
206 HB2 GLU 28 HB2 GLU 28 -3.741 2.246 -5.115
207 HB3 GLU 28 HB3 GLU 28 -3.870 3.917 -5.627
208 HG2 GLU 28 HG2 GLU 28 -1.243 3.614 -6.074
209 HG3 GLU 28 HG3 GLU 28 -1.698 1.913 -6.171
210 H LYS 29 H LYS 29 -3.737 5.852 -4.685
211 HA LYS 29 HA LYS 29 -1.312 7.263 -5.151
212 HB2 LYS 29 HB2 LYS 29 -3.558 7.436 -6.303
213 HB3 LYS 29 HB3 LYS 29 -4.124 8.422 -4.944
214 HG2 LYS 29 HG2 LYS 29 -2.684 10.211 -5.528
215 HG3 LYS 29 HG3 LYS 29 -1.570 9.139 -6.403
216 HD2 LYS 29 HD2 LYS 29 -2.791 10.511 -7.995
217 HD3 LYS 29 HD3 LYS 29 -3.196 8.800 -8.187
218 HE2 LYS 29 HE2 LYS 29 -5.214 9.371 -6.579
219 HE3 LYS 29 HE3 LYS 29 -4.864 11.049 -7.015
220 HZ1 LYS 29 HZ1 LYS 29 -6.511 10.098 -8.466
221 HZ2 LYS 29 HZ2 LYS 29 -5.143 10.372 -9.349
222 HZ3 LYS 29 HZ3 LYS 29 -5.547 8.845 -8.875
223 H VAL 30 H VAL 30 -3.522 7.316 -2.326
224 HA VAL 30 HA VAL 30 -2.297 9.673 -1.197
225 HB VAL 30 HB VAL 30 -4.128 7.500 -0.134
226 HG11 VAL 30 HG11 VAL 30 -3.003 9.832 1.455
227 HG12 VAL 30 HG12 VAL 30 -4.447 8.894 1.916
228 HG13 VAL 30 HG13 VAL 30 -2.870 8.110 1.834
229 HG21 VAL 30 HG21 VAL 30 -5.762 9.334 -0.075
230 HG22 VAL 30 HG22 VAL 30 -4.511 10.511 -0.547
231 HG23 VAL 30 HG23 VAL 30 -5.044 9.271 -1.687
232 H PHE 31 H PHE 31 -1.947 6.134 -0.311
233 HA PHE 31 HA PHE 31 0.206 6.792 1.441
234 HB2 PHE 31 HB2 PHE 31 -0.952 4.216 0.420
235 HB3 PHE 31 HB3 PHE 31 0.613 4.197 1.198
236 HD1 PHE 31 HD2 PHE 31 0.681 5.830 3.451
237 HD2 PHE 31 HD1 PHE 31 -2.705 3.620 1.941
238 HE1 PHE 31 HE2 PHE 31 -0.249 5.707 5.730
239 HE2 PHE 31 HE1 PHE 31 -3.588 3.438 4.243
240 HZ PHE 31 HZ PHE 31 -2.386 4.506 6.146
241 H LYS 32 H LYS 32 0.323 6.719 -1.969
242 HA LYS 32 HA LYS 32 2.839 5.594 -2.492
243 HB2 LYS 32 HB2 LYS 32 1.283 6.420 -4.225
244 HB3 LYS 32 HB3 LYS 32 1.575 8.089 -3.703
245 HG2 LYS 32 HG2 LYS 32 3.957 7.874 -4.344
246 HG3 LYS 32 HG3 LYS 32 3.680 6.180 -4.810
247 HD2 LYS 32 HD2 LYS 32 2.127 6.888 -6.564
248 HD3 LYS 32 HD3 LYS 32 2.274 8.583 -6.059
249 HE2 LYS 32 HE2 LYS 32 4.733 8.496 -6.534
250 HE3 LYS 32 HE3 LYS 32 4.538 6.827 -7.079
251 HZ1 LYS 32 HZ1 LYS 32 3.638 9.274 -8.399
252 HZ2 LYS 32 HZ2 LYS 32 4.407 7.962 -9.013
253 HZ3 LYS 32 HZ3 LYS 32 2.808 7.872 -8.667
254 H GLN 33 H GLN 33 1.985 8.714 -1.143
255 HA GLN 33 HA GLN 33 4.367 10.137 -1.079
256 HB2 GLN 33 HB2 GLN 33 2.186 9.812 1.047
257 HB3 GLN 33 HB3 GLN 33 3.381 11.099 1.050
258 HG2 GLN 33 HG2 GLN 33 2.448 12.067 -0.958
259 HG3 GLN 33 HG3 GLN 33 1.265 10.754 -1.105
260 HE21 GLN 33 HE22 GLN 33 -0.120 10.430 1.013
261 HE22 GLN 33 HE21 GLN 33 -0.407 11.854 2.001
262 H TYR 34 H TYR 34 3.111 7.947 1.454
263 HA TYR 34 HA TYR 34 5.441 7.959 3.057
264 HB2 TYR 34 HB2 TYR 34 3.798 7.439 4.401
265 HB3 TYR 34 HB3 TYR 34 2.758 6.870 3.119
266 HD1 TYR 34 HD2 TYR 34 5.265 5.838 5.658
267 HD2 TYR 34 HD1 TYR 34 2.535 4.526 2.585
268 HE1 TYR 34 HE2 TYR 34 5.293 3.547 6.609
269 HE2 TYR 34 HE1 TYR 34 2.497 2.271 3.568
270 HH TYR 34 HH TYR 34 3.067 1.029 5.472
271 H ALA 35 H ALA 35 4.551 5.824 0.365
272 HA ALA 35 HA ALA 35 6.423 3.756 1.002
273 HB1 ALA 35 HB1 ALA 35 6.209 3.097 -1.354
274 HB2 ALA 35 HB2 ALA 35 4.620 3.434 -0.641
275 HB3 ALA 35 HB3 ALA 35 5.385 4.619 -1.733
276 H ASN 36 H ASN 36 6.732 6.550 -1.282
277 HA ASN 36 HA ASN 36 9.510 6.032 -1.719
278 HB2 ASN 36 HB2 ASN 36 8.068 7.519 -3.196
279 HB3 ASN 36 HB3 ASN 36 8.185 8.763 -1.947
280 HD21 ASN 36 HD22 ASN 36 9.337 10.093 -3.563
281 HD22 ASN 36 HD21 ASN 36 11.059 9.821 -3.835
282 H ASP 37 H ASP 37 7.808 8.002 0.692
283 HA ASP 37 HA ASP 37 10.105 9.338 1.728
284 HB2 ASP 37 HB2 ASP 37 7.772 10.066 2.073
285 HB3 ASP 37 HB3 ASP 37 7.483 8.626 3.067
286 H ASN 38 H ASN 38 9.223 6.027 1.945
287 HA ASN 38 HA ASN 38 10.972 5.644 4.314
288 HB2 ASN 38 HB2 ASN 38 8.441 4.906 4.254
289 HB3 ASN 38 HB3 ASN 38 9.070 3.561 3.300
290 HD21 ASN 38 HD22 ASN 38 8.180 2.309 5.195
291 HD22 ASN 38 HD21 ASN 38 9.237 2.108 6.587
292 H GLY 39 H GLY 39 11.259 5.635 1.045
293 HA2 GLY 39 HA2 GLY 39 13.062 4.900 -0.197
294 HA3 GLY 39 HA3 GLY 39 13.586 3.877 1.144
295 H VAL 40 H VAL 40 10.241 3.607 -0.154
296 HA VAL 40 HA VAL 40 11.019 1.006 -1.375
297 HB VAL 40 HB VAL 40 8.416 1.684 0.036
298 HG11 VAL 40 HG11 VAL 40 8.080 -0.808 -0.031
299 HG12 VAL 40 HG12 VAL 40 8.115 -0.083 -1.636
300 HG13 VAL 40 HG13 VAL 40 9.538 -0.947 -1.032
301 HG21 VAL 40 HG21 VAL 40 9.195 0.138 1.826
302 HG22 VAL 40 HG22 VAL 40 10.781 0.061 1.055
303 HG23 VAL 40 HG23 VAL 40 10.183 1.591 1.726
304 H ASP 41 H ASP 41 10.235 0.493 -3.350
305 HA ASP 41 HA ASP 41 8.067 1.951 -4.578
306 HB2 ASP 41 HB2 ASP 41 10.252 3.363 -4.992
307 HB3 ASP 41 HB3 ASP 41 10.713 2.087 -6.095
308 H GLY 42 H GLY 42 7.021 -0.041 -4.896
309 HA2 GLY 42 HA2 GLY 42 8.429 -1.992 -6.643
310 HA3 GLY 42 HA3 GLY 42 7.698 -2.506 -5.126
311 H GLU 43 H GLU 43 6.613 -3.927 -6.729
312 HA GLU 43 HA GLU 43 4.622 -2.762 -8.450
313 HB2 GLU 43 HB2 GLU 43 5.966 -4.836 -8.837
314 HB3 GLU 43 HB3 GLU 43 4.884 -5.679 -7.716
315 HG2 GLU 43 HG2 GLU 43 2.986 -5.268 -9.103
316 HG3 GLU 43 HG3 GLU 43 3.804 -3.996 -10.021
317 H TRP 44 H TRP 44 2.960 -1.741 -7.523
318 HA TRP 44 HA TRP 44 1.799 -2.387 -4.946
319 HB2 TRP 44 HB2 TRP 44 0.981 -0.528 -7.229
320 HB3 TRP 44 HB3 TRP 44 0.051 -0.704 -5.765
321 HD1 TRP 44 HD1 TRP 44 3.644 0.408 -6.691
322 HE1 TRP 44 HE1 TRP 44 4.373 2.284 -5.098
323 HE3 TRP 44 HE3 TRP 44 -0.530 0.644 -3.709
324 HZ2 TRP 44 HZ2 TRP 44 3.411 3.537 -2.778
325 HZ3 TRP 44 HZ3 TRP 44 -0.581 2.262 -1.818
326 HH2 TRP 44 HH2 TRP 44 1.386 3.656 -1.303
327 H THR 45 H THR 45 0.431 -4.141 -4.654
328 HA THR 45 HA THR 45 -1.515 -4.807 -6.803
329 HB THR 45 HB THR 45 0.140 -6.830 -5.266
330 HG1 THR 45 HG1 THR 45 1.277 -5.472 -6.796
331 HG21 THR 45 HG21 THR 45 -1.674 -7.090 -7.707
332 HG22 THR 45 HG22 THR 45 -0.650 -8.378 -7.051
333 HG23 THR 45 HG23 THR 45 -2.002 -7.749 -6.085
334 H TYR 46 H TYR 46 -3.563 -5.340 -5.999
335 HA TYR 46 HA TYR 46 -3.963 -4.999 -3.098
336 HB2 TYR 46 HB2 TYR 46 -6.130 -4.136 -3.635
337 HB3 TYR 46 HB3 TYR 46 -4.913 -3.247 -4.530
338 HD1 TYR 46 HD1 TYR 46 -4.692 -3.520 -7.013
339 HD2 TYR 46 HD2 TYR 46 -7.744 -5.610 -4.767
340 HE1 TYR 46 HE1 TYR 46 -5.838 -4.128 -9.118
341 HE2 TYR 46 HE2 TYR 46 -8.886 -6.212 -6.867
342 HH TYR 46 HH TYR 46 -8.518 -6.370 -9.271
343 H ASP 47 H ASP 47 -5.461 -6.206 -2.011
344 HA ASP 47 HA ASP 47 -6.425 -8.776 -3.146
345 HB2 ASP 47 HB2 ASP 47 -4.365 -9.182 -1.931
346 HB3 ASP 47 HB3 ASP 47 -4.916 -8.197 -0.578
347 H ASP 48 H ASP 48 -8.627 -8.247 -3.207
348 HA ASP 48 HA ASP 48 -9.804 -6.393 -1.305
349 HB2 ASP 48 HB2 ASP 48 -11.666 -6.388 -2.581
350 HB3 ASP 48 HB3 ASP 48 -10.493 -6.853 -3.806
351 H ALA 49 H ALA 49 -9.455 -9.883 -1.410
352 HA ALA 49 HA ALA 49 -11.676 -10.443 0.367
353 HB1 ALA 49 HB1 ALA 49 -10.864 -12.130 -1.222
354 HB2 ALA 49 HB2 ALA 49 -9.273 -12.145 -0.424
355 HB3 ALA 49 HB3 ALA 49 -10.712 -12.715 0.447
356 H THR 50 H THR 50 -8.089 -10.517 0.780
357 HA THR 50 HA THR 50 -8.320 -10.649 3.667
358 HB THR 50 HB THR 50 -5.812 -10.027 2.115
359 HG1 THR 50 HG1 THR 50 -6.004 -11.724 1.065
360 HG21 THR 50 HG21 THR 50 -6.332 -11.786 4.556
361 HG22 THR 50 HG22 THR 50 -4.755 -11.490 3.790
362 HG23 THR 50 HG23 THR 50 -5.605 -10.160 4.574
363 H LYS 51 H LYS 51 -8.416 -8.109 1.363
364 HA LYS 51 HA LYS 51 -8.516 -5.886 1.451
365 HB2 LYS 51 HB2 LYS 51 -9.096 -6.296 4.390
366 HB3 LYS 51 HB3 LYS 51 -9.272 -4.768 3.528
367 HG2 LYS 51 HG2 LYS 51 -11.040 -5.485 2.217
368 HG3 LYS 51 HG3 LYS 51 -10.671 -7.196 2.409
369 HD2 LYS 51 HD2 LYS 51 -11.706 -5.486 4.690
370 HD3 LYS 51 HD3 LYS 51 -12.706 -6.466 3.596
371 HE2 LYS 51 HE2 LYS 51 -11.211 -8.464 4.173
372 HE3 LYS 51 HE3 LYS 51 -10.543 -7.470 5.481
373 HZ1 LYS 51 HZ1 LYS 51 -12.302 -8.781 6.322
374 HZ2 LYS 51 HZ2 LYS 51 -12.815 -7.267 6.353
375 HZ3 LYS 51 HZ3 LYS 51 -13.368 -8.254 5.144
376 H THR 52 H THR 52 -6.162 -6.602 0.965
377 HA THR 52 HA THR 52 -4.371 -4.907 2.584
378 HB THR 52 HB THR 52 -2.660 -6.856 1.896
379 HG1 THR 52 HG1 THR 52 -3.627 -8.864 1.881
380 HG21 THR 52 HG21 THR 52 -4.600 -7.123 4.248
381 HG22 THR 52 HG22 THR 52 -2.983 -7.852 4.119
382 HG23 THR 52 HG23 THR 52 -3.153 -6.092 4.211
383 H PHE 53 H PHE 53 -2.556 -4.098 1.417
384 HA PHE 53 HA PHE 53 -2.686 -4.173 -1.516
385 HB2 PHE 53 HB2 PHE 53 -3.778 -2.058 -0.175
386 HB3 PHE 53 HB3 PHE 53 -2.098 -1.573 -0.155
387 HD1 PHE 53 HD2 PHE 53 -1.343 -2.678 -2.994
388 HD2 PHE 53 HD1 PHE 53 -4.643 -0.319 -1.516
389 HE1 PHE 53 HE2 PHE 53 -1.807 -1.860 -5.284
390 HE2 PHE 53 HE1 PHE 53 -5.023 0.546 -3.786
391 HZ PHE 53 HZ PHE 53 -3.629 -0.227 -5.690
392 H THR 54 H THR 54 -0.599 -4.935 -2.002
393 HA THR 54 HA THR 54 1.567 -4.331 -0.052
394 HB THR 54 HB THR 54 1.074 -6.841 -1.654
395 HG1 THR 54 HG1 THR 54 0.542 -7.699 0.343
396 HG21 THR 54 HG21 THR 54 3.172 -6.218 0.476
397 HG22 THR 54 HG22 THR 54 2.866 -7.814 -0.246
398 HG23 THR 54 HG23 THR 54 3.488 -6.502 -1.245
399 H VAL 55 H VAL 55 3.427 -3.574 -0.775
400 HA VAL 55 HA VAL 55 3.774 -3.024 -3.691
401 HB VAL 55 HB VAL 55 4.913 -1.552 -1.247
402 HG11 VAL 55 HG11 VAL 55 6.289 -1.333 -3.260
403 HG12 VAL 55 HG12 VAL 55 4.866 -0.831 -4.210
404 HG13 VAL 55 HG13 VAL 55 5.481 0.199 -2.897
405 HG21 VAL 55 HG21 VAL 55 2.511 -0.884 -2.979
406 HG22 VAL 55 HG22 VAL 55 2.535 -1.175 -1.234
407 HG23 VAL 55 HG23 VAL 55 3.307 0.268 -1.878
408 H THR 56 H THR 56 4.966 -4.810 -4.339
409 HA THR 56 HA THR 56 7.152 -5.842 -2.621
410 HB THR 56 HB THR 56 5.838 -7.044 -5.085
411 HG1 THR 56 HG1 THR 56 4.262 -7.265 -3.753
412 HG21 THR 56 HG21 THR 56 7.496 -8.339 -2.870
413 HG22 THR 56 HG22 THR 56 6.720 -9.162 -4.243
414 HG23 THR 56 HG23 THR 56 8.053 -8.033 -4.533
415 H GLU 57 H GLU 57 9.096 -4.911 -2.980
416 HA GLU 57 HA GLU 57 9.846 -3.989 -5.717
417 HB2 GLU 57 HB2 GLU 57 9.772 -2.296 -3.944
418 HB3 GLU 57 HB3 GLU 57 10.860 -3.261 -2.948
419 HG2 GLU 57 HG2 GLU 57 12.677 -2.968 -4.485
420 HG3 GLU 57 HG3 GLU 57 11.636 -2.255 -5.715
Start of MODEL 11
1 H1 MET 1 H MET 1 -15.421 1.840 -2.416
2 HA MET 1 HA MET 1 -13.984 2.449 -0.505
3 HB2 MET 1 HB2 MET 1 -16.075 3.655 -0.693
4 HB3 MET 1 HB3 MET 1 -16.968 2.333 0.086
5 HG2 MET 1 HG2 MET 1 -15.584 2.715 2.149
6 HG3 MET 1 HG3 MET 1 -14.793 4.066 1.333
7 HE1 MET 1 HE1 MET 1 -16.186 4.086 4.202
8 HE2 MET 1 HE2 MET 1 -15.319 5.454 3.475
9 HE3 MET 1 HE3 MET 1 -16.952 5.682 4.146
10 H GLY 2 H GLY 2 -12.716 1.307 0.836
11 HA2 GLY 2 HA2 GLY 2 -13.830 -0.291 2.959
12 HA3 GLY 2 HA3 GLY 2 -12.924 -1.225 1.759
13 H THR 3 H THR 3 -11.803 -1.298 4.168
14 HA THR 3 HA THR 3 -9.823 0.888 4.446
15 HB THR 3 HB THR 3 -10.449 -1.437 6.308
16 HG1 THR 3 HG1 THR 3 -12.239 -0.289 6.273
17 HG21 THR 3 HG21 THR 3 -9.349 -0.005 7.987
18 HG22 THR 3 HG22 THR 3 -8.251 -0.375 6.650
19 HG23 THR 3 HG23 THR 3 -9.021 1.226 6.740
20 H TYR 4 H TYR 4 -8.208 0.510 2.962
21 HA TYR 4 HA TYR 4 -7.347 -2.284 2.486
22 HB2 TYR 4 HB2 TYR 4 -6.656 0.363 1.174
23 HB3 TYR 4 HB3 TYR 4 -5.798 -1.128 0.840
24 HD1 TYR 4 HD1 TYR 4 -7.427 -3.245 0.238
25 HD2 TYR 4 HD2 TYR 4 -8.321 0.937 -0.380
26 HE1 TYR 4 HE1 TYR 4 -8.881 -3.838 -1.658
27 HE2 TYR 4 HE2 TYR 4 -9.804 0.341 -2.243
28 HH TYR 4 HH TYR 4 -10.723 -1.372 -3.533
29 H LYS 5 H LYS 5 -5.875 -3.114 3.739
30 HA LYS 5 HA LYS 5 -4.212 -1.525 5.536
31 HB2 LYS 5 HB2 LYS 5 -5.117 -3.749 6.175
32 HB3 LYS 5 HB3 LYS 5 -4.263 -4.499 4.819
33 HG2 LYS 5 HG2 LYS 5 -2.088 -3.790 5.785
34 HG3 LYS 5 HG3 LYS 5 -2.951 -2.985 7.104
35 HD2 LYS 5 HD2 LYS 5 -3.821 -5.131 7.896
36 HD3 LYS 5 HD3 LYS 5 -3.074 -5.977 6.515
37 HE2 LYS 5 HE2 LYS 5 -0.839 -5.136 7.239
38 HE3 LYS 5 HE3 LYS 5 -1.600 -4.365 8.639
39 HZ1 LYS 5 HZ1 LYS 5 -1.542 -7.270 8.097
40 HZ2 LYS 5 HZ2 LYS 5 -0.622 -6.432 9.173
41 HZ3 LYS 5 HZ3 LYS 5 -2.243 -6.513 9.430
42 H LEU 6 H LEU 6 -2.183 -0.744 4.961
43 HA LEU 6 HA LEU 6 -1.111 -1.484 2.313
44 HB2 LEU 6 HB2 LEU 6 -1.605 0.906 3.118
45 HB3 LEU 6 HB3 LEU 6 -0.237 0.722 4.196
46 HG LEU 6 HG LEU 6 0.499 1.950 2.339
47 HD11 LEU 6 HD11 LEU 6 2.273 0.808 1.353
48 HD12 LEU 6 HD12 LEU 6 2.095 0.069 2.953
49 HD13 LEU 6 HD13 LEU 6 1.505 -0.769 1.492
50 HD21 LEU 6 HD21 LEU 6 0.285 1.203 -0.015
51 HD22 LEU 6 HD22 LEU 6 -0.729 -0.155 0.521
52 HD23 LEU 6 HD23 LEU 6 -1.279 1.506 0.748
53 H ILE 7 H ILE 7 0.700 -2.753 2.197
54 HA ILE 7 HA ILE 7 2.394 -3.097 4.618
55 HB ILE 7 HB ILE 7 1.691 -5.305 2.641
56 HG12 ILE 7 HG12 ILE 7 0.861 -6.325 4.982
57 HG13 ILE 7 HG13 ILE 7 0.588 -4.629 5.378
58 HG21 ILE 7 HG21 ILE 7 3.989 -5.476 3.523
59 HG22 ILE 7 HG22 ILE 7 3.388 -5.279 5.184
60 HG23 ILE 7 HG23 ILE 7 2.977 -6.725 4.241
61 HD11 ILE 7 HD11 ILE 7 -0.535 -6.184 3.005
62 HD12 ILE 7 HD12 ILE 7 -1.411 -5.730 4.479
63 HD13 ILE 7 HD13 ILE 7 -0.892 -4.480 3.337
64 H LEU 8 H LEU 8 4.415 -2.538 4.231
65 HA LEU 8 HA LEU 8 5.271 -1.957 1.434
66 HB2 LEU 8 HB2 LEU 8 5.447 -0.483 3.903
67 HB3 LEU 8 HB3 LEU 8 7.066 -1.089 3.569
68 HG LEU 8 HG LEU 8 6.956 -0.105 1.295
69 HD11 LEU 8 HD11 LEU 8 5.262 1.585 0.773
70 HD12 LEU 8 HD12 LEU 8 4.486 0.022 1.013
71 HD13 LEU 8 HD13 LEU 8 4.419 1.245 2.300
72 HD21 LEU 8 HD21 LEU 8 7.989 1.059 3.258
73 HD22 LEU 8 HD22 LEU 8 7.337 2.184 2.063
74 HD23 LEU 8 HD23 LEU 8 6.429 1.875 3.559
75 H ASN 9 H ASN 9 6.367 -3.678 0.555
76 HA ASN 9 HA ASN 9 8.079 -5.332 2.345
77 HB2 ASN 9 HB2 ASN 9 6.090 -6.577 1.570
78 HB3 ASN 9 HB3 ASN 9 6.510 -6.217 -0.106
79 HD21 ASN 9 HD22 ASN 9 8.630 -7.201 -0.985
80 HD22 ASN 9 HD21 ASN 9 9.113 -8.681 -0.286
81 H GLY 10 H GLY 10 9.706 -3.725 1.988
82 HA2 GLY 10 HA2 GLY 10 10.542 -3.147 -0.759
83 HA3 GLY 10 HA3 GLY 10 11.184 -2.472 0.749
84 H LYS 11 H LYS 11 12.982 -3.227 -1.040
85 HA LYS 11 HA LYS 11 13.850 -5.987 -0.453
86 HB2 LYS 11 HB2 LYS 11 15.352 -5.844 -2.179
87 HB3 LYS 11 HB3 LYS 11 13.940 -4.983 -2.771
88 HG2 LYS 11 HG2 LYS 11 16.575 -3.755 -1.835
89 HG3 LYS 11 HG3 LYS 11 15.990 -3.942 -3.487
90 HD2 LYS 11 HD2 LYS 11 13.987 -2.480 -2.750
91 HD3 LYS 11 HD3 LYS 11 15.022 -2.027 -1.372
92 HE2 LYS 11 HE2 LYS 11 16.775 -1.271 -2.917
93 HE3 LYS 11 HE3 LYS 11 15.831 -1.835 -4.306
94 HZ1 LYS 11 HZ1 LYS 11 14.141 -0.200 -3.752
95 HZ2 LYS 11 HZ2 LYS 11 15.057 0.378 -2.506
96 HZ3 LYS 11 HZ3 LYS 11 15.577 0.485 -4.079
97 H THR 12 H THR 12 14.169 -3.144 1.161
98 HA THR 12 HA THR 12 16.637 -4.085 2.529
99 HB THR 12 HB THR 12 16.112 -1.197 1.712
100 HG1 THR 12 HG1 THR 12 18.075 -2.900 0.584
101 HG21 THR 12 HG21 THR 12 18.622 -2.518 2.822
102 HG22 THR 12 HG22 THR 12 18.517 -0.848 2.214
103 HG23 THR 12 HG23 THR 12 17.603 -1.315 3.652
104 H LEU 13 H LEU 13 13.432 -2.545 2.751
105 HA LEU 13 HA LEU 13 13.483 -2.858 5.613
106 HB2 LEU 13 HB2 LEU 13 12.887 -0.648 6.206
107 HB3 LEU 13 HB3 LEU 13 14.365 -0.560 5.295
108 HG LEU 13 HG LEU 13 13.081 1.289 4.729
109 HD11 LEU 13 HD11 LEU 13 12.704 -0.542 2.351
110 HD12 LEU 13 HD12 LEU 13 12.803 1.226 2.360
111 HD13 LEU 13 HD13 LEU 13 14.223 0.273 2.807
112 HD21 LEU 13 HD21 LEU 13 10.844 1.424 3.998
113 HD22 LEU 13 HD22 LEU 13 10.672 -0.322 3.840
114 HD23 LEU 13 HD23 LEU 13 10.839 0.425 5.450
115 H LYS 14 H LYS 14 11.198 -2.322 6.480
116 HA LYS 14 HA LYS 14 9.080 -2.811 4.472
117 HB2 LYS 14 HB2 LYS 14 9.512 -4.436 7.019
118 HB3 LYS 14 HB3 LYS 14 8.045 -4.455 6.042
119 HG2 LYS 14 HG2 LYS 14 9.471 -5.143 4.045
120 HG3 LYS 14 HG3 LYS 14 10.806 -5.406 5.179
121 HD2 LYS 14 HD2 LYS 14 9.363 -6.964 6.482
122 HD3 LYS 14 HD3 LYS 14 8.039 -6.671 5.330
123 HE2 LYS 14 HE2 LYS 14 9.769 -7.428 3.525
124 HE3 LYS 14 HE3 LYS 14 10.666 -8.128 4.879
125 HZ1 LYS 14 HZ1 LYS 14 7.866 -8.691 4.106
126 HZ2 LYS 14 HZ2 LYS 14 9.123 -9.699 3.867
127 HZ3 LYS 14 HZ3 LYS 14 8.575 -9.393 5.400
128 H GLY 15 H GLY 15 6.846 -2.531 5.497
129 HA2 GLY 15 HA2 GLY 15 6.702 -0.833 7.863
130 HA3 GLY 15 HA3 GLY 15 6.352 -0.020 6.334
131 H GLU 16 H GLU 16 4.365 -0.371 8.383
132 HA GLU 16 HA GLU 16 2.339 -1.885 6.873
133 HB2 GLU 16 HB2 GLU 16 3.346 -3.561 8.393
134 HB3 GLU 16 HB3 GLU 16 3.078 -2.496 9.773
135 HG2 GLU 16 HG2 GLU 16 0.613 -2.644 9.376
136 HG3 GLU 16 HG3 GLU 16 0.914 -3.708 8.002
137 H THR 17 H THR 17 0.677 -0.418 6.694
138 HA THR 17 HA THR 17 -0.199 1.151 9.045
139 HB THR 17 HB THR 17 -0.439 3.135 7.509
140 HG1 THR 17 HG1 THR 17 1.084 3.066 5.732
141 HG21 THR 17 HG21 THR 17 2.444 2.244 7.906
142 HG22 THR 17 HG22 THR 17 1.861 3.901 7.680
143 HG23 THR 17 HG23 THR 17 1.429 3.006 9.146
144 H THR 18 H THR 18 -2.443 2.388 8.084
145 HA THR 18 HA THR 18 -3.871 0.758 6.195
146 HB THR 18 HB THR 18 -4.035 -0.787 8.002
147 HG1 THR 18 HG1 THR 18 -6.462 0.624 8.108
148 HG21 THR 18 HG21 THR 18 -5.054 -0.277 10.198
149 HG22 THR 18 HG22 THR 18 -3.481 0.492 9.976
150 HG23 THR 18 HG23 THR 18 -4.961 1.461 9.832
151 H THR 19 H THR 19 -5.576 1.973 5.351
152 HA THR 19 HA THR 19 -6.626 4.275 6.734
153 HB THR 19 HB THR 19 -4.847 4.593 4.316
154 HG1 THR 19 HG1 THR 19 -4.383 4.846 6.809
155 HG21 THR 19 HG21 THR 19 -5.507 7.000 4.289
156 HG22 THR 19 HG22 THR 19 -6.836 5.939 3.810
157 HG23 THR 19 HG23 THR 19 -6.807 6.631 5.443
158 H GLU 20 H GLU 20 -8.708 4.802 5.977
159 HA GLU 20 HA GLU 20 -9.819 2.897 3.980
160 HB2 GLU 20 HB2 GLU 20 -11.976 3.428 4.892
161 HB3 GLU 20 HB3 GLU 20 -10.881 2.995 6.205
162 HG2 GLU 20 HG2 GLU 20 -10.522 5.538 6.549
163 HG3 GLU 20 HG3 GLU 20 -11.869 5.777 5.423
164 H ALA 21 H ALA 21 -10.787 3.677 2.085
165 HA ALA 21 HA ALA 21 -10.877 6.598 1.652
166 HB1 ALA 21 HB1 ALA 21 -9.519 6.535 -0.306
167 HB2 ALA 21 HB2 ALA 21 -8.577 5.789 0.986
168 HB3 ALA 21 HB3 ALA 21 -9.359 4.763 -0.242
169 H VAL 22 H VAL 22 -11.922 7.113 -0.463
170 HA VAL 22 HA VAL 22 -14.370 5.726 -0.726
171 HB VAL 22 HB VAL 22 -14.174 8.061 -1.239
172 HG11 VAL 22 HG11 VAL 22 -13.093 8.969 -3.232
173 HG12 VAL 22 HG12 VAL 22 -11.905 8.231 -2.159
174 HG13 VAL 22 HG13 VAL 22 -12.427 7.375 -3.631
175 HG21 VAL 22 HG21 VAL 22 -15.453 8.204 -3.265
176 HG22 VAL 22 HG22 VAL 22 -14.847 6.637 -3.837
177 HG23 VAL 22 HG23 VAL 22 -15.914 6.717 -2.420
178 H ASP 23 H ASP 23 -11.294 5.376 -2.645
179 HA ASP 23 HA ASP 23 -12.279 2.803 -3.560
180 HB2 ASP 23 HB2 ASP 23 -12.869 4.896 -5.201
181 HB3 ASP 23 HB3 ASP 23 -11.236 4.532 -5.768
182 H ALA 24 H ALA 24 -10.476 1.678 -4.784
183 HA ALA 24 HA ALA 24 -8.123 1.565 -3.249
184 HB1 ALA 24 HB1 ALA 24 -7.254 0.112 -5.035
185 HB2 ALA 24 HB2 ALA 24 -8.930 -0.308 -4.641
186 HB3 ALA 24 HB3 ALA 24 -8.551 0.600 -6.115
187 H ALA 25 H ALA 25 -8.714 3.268 -6.323
188 HA ALA 25 HA ALA 25 -6.074 4.058 -6.914
189 HB1 ALA 25 HB1 ALA 25 -7.954 4.364 -8.452
190 HB2 ALA 25 HB2 ALA 25 -8.718 5.536 -7.352
191 HB3 ALA 25 HB3 ALA 25 -7.178 5.935 -8.133
192 H THR 26 H THR 26 -8.502 5.638 -4.744
193 HA THR 26 HA THR 26 -6.929 7.928 -4.135
194 HB THR 26 HB THR 26 -9.015 6.544 -2.406
195 HG1 THR 26 HG1 THR 26 -9.670 8.456 -4.349
196 HG21 THR 26 HG21 THR 26 -7.908 8.466 -1.335
197 HG22 THR 26 HG22 THR 26 -8.291 9.488 -2.732
198 HG23 THR 26 HG23 THR 26 -9.594 8.843 -1.704
199 H ALA 27 H ALA 27 -7.462 4.778 -2.476
200 HA ALA 27 HA ALA 27 -5.833 5.235 -0.247
201 HB1 ALA 27 HB1 ALA 27 -6.527 2.655 -1.696
202 HB2 ALA 27 HB2 ALA 27 -5.736 2.739 -0.118
203 HB3 ALA 27 HB3 ALA 27 -7.374 3.384 -0.314
204 H GLU 28 H GLU 28 -4.997 3.780 -3.367
205 HA GLU 28 HA GLU 28 -2.271 3.223 -2.914
206 HB2 GLU 28 HB2 GLU 28 -3.690 2.277 -4.701
207 HB3 GLU 28 HB3 GLU 28 -3.903 3.875 -5.388
208 HG2 GLU 28 HG2 GLU 28 -1.106 3.502 -5.393
209 HG3 GLU 28 HG3 GLU 28 -1.747 1.917 -5.781
210 H LYS 29 H LYS 29 -3.777 6.032 -4.636
211 HA LYS 29 HA LYS 29 -1.348 7.412 -5.082
212 HB2 LYS 29 HB2 LYS 29 -3.585 7.799 -6.177
213 HB3 LYS 29 HB3 LYS 29 -4.116 8.630 -4.709
214 HG2 LYS 29 HG2 LYS 29 -2.458 10.386 -5.043
215 HG3 LYS 29 HG3 LYS 29 -1.648 9.449 -6.312
216 HD2 LYS 29 HD2 LYS 29 -2.957 11.201 -7.346
217 HD3 LYS 29 HD3 LYS 29 -3.667 9.629 -7.743
218 HE2 LYS 29 HE2 LYS 29 -5.307 9.987 -5.823
219 HE3 LYS 29 HE3 LYS 29 -4.646 11.622 -5.642
220 HZ1 LYS 29 HZ1 LYS 29 -6.600 11.646 -6.979
221 HZ2 LYS 29 HZ2 LYS 29 -5.318 12.023 -7.957
222 HZ3 LYS 29 HZ3 LYS 29 -6.005 10.533 -8.031
223 H VAL 30 H VAL 30 -3.537 7.618 -2.223
224 HA VAL 30 HA VAL 30 -2.039 9.784 -1.053
225 HB VAL 30 HB VAL 30 -4.023 7.795 0.068
226 HG11 VAL 30 HG11 VAL 30 -2.587 8.518 1.950
227 HG12 VAL 30 HG12 VAL 30 -2.826 10.217 1.490
228 HG13 VAL 30 HG13 VAL 30 -4.189 9.237 2.072
229 HG21 VAL 30 HG21 VAL 30 -4.892 9.531 -1.554
230 HG22 VAL 30 HG22 VAL 30 -5.547 9.736 0.074
231 HG23 VAL 30 HG23 VAL 30 -4.248 10.794 -0.500
232 H PHE 31 H PHE 31 -2.076 6.185 -0.284
233 HA PHE 31 HA PHE 31 0.151 6.537 1.431
234 HB2 PHE 31 HB2 PHE 31 -1.185 4.130 0.238
235 HB3 PHE 31 HB3 PHE 31 0.416 3.933 0.912
236 HD1 PHE 31 HD2 PHE 31 0.465 5.701 3.318
237 HD2 PHE 31 HD1 PHE 31 -2.587 3.029 1.819
238 HE1 PHE 31 HE2 PHE 31 -0.364 5.384 5.590
239 HE2 PHE 31 HE1 PHE 31 -3.352 2.654 4.138
240 HZ PHE 31 HZ PHE 31 -2.257 3.861 6.033
241 H LYS 32 H LYS 32 0.219 6.637 -2.020
242 HA LYS 32 HA LYS 32 2.829 5.530 -2.284
243 HB2 LYS 32 HB2 LYS 32 1.161 6.085 -4.154
244 HB3 LYS 32 HB3 LYS 32 1.781 7.747 -4.088
245 HG2 LYS 32 HG2 LYS 32 4.019 6.966 -4.629
246 HG3 LYS 32 HG3 LYS 32 3.565 5.295 -4.305
247 HD2 LYS 32 HD2 LYS 32 1.917 5.522 -6.279
248 HD3 LYS 32 HD3 LYS 32 2.880 6.949 -6.727
249 HE2 LYS 32 HE2 LYS 32 4.923 5.574 -6.814
250 HE3 LYS 32 HE3 LYS 32 4.052 4.184 -6.172
251 HZ1 LYS 32 HZ1 LYS 32 3.734 5.402 -8.838
252 HZ2 LYS 32 HZ2 LYS 32 4.222 3.886 -8.474
253 HZ3 LYS 32 HZ3 LYS 32 2.669 4.287 -8.218
254 H GLN 33 H GLN 33 1.735 8.493 -0.823
255 HA GLN 33 HA GLN 33 4.147 10.055 -1.045
256 HB2 GLN 33 HB2 GLN 33 1.976 9.896 1.119
257 HB3 GLN 33 HB3 GLN 33 3.300 11.052 1.152
258 HG2 GLN 33 HG2 GLN 33 2.518 12.090 -0.911
259 HG3 GLN 33 HG3 GLN 33 1.198 10.912 -1.045
260 HE21 GLN 33 HE22 GLN 33 2.396 13.799 0.682
261 HE22 GLN 33 HE21 GLN 33 1.005 14.019 1.690
262 H TYR 34 H TYR 34 2.855 7.975 1.561
263 HA TYR 34 HA TYR 34 5.080 7.761 3.215
264 HB2 TYR 34 HB2 TYR 34 3.076 7.100 4.121
265 HB3 TYR 34 HB3 TYR 34 2.571 6.218 2.704
266 HD1 TYR 34 HD2 TYR 34 5.297 5.978 5.318
267 HD2 TYR 34 HD1 TYR 34 2.322 3.937 2.941
268 HE1 TYR 34 HE2 TYR 34 5.725 3.899 6.580
269 HE2 TYR 34 HE1 TYR 34 2.744 1.854 4.217
270 HH TYR 34 HH TYR 34 4.677 1.695 7.080
271 H ALA 35 H ALA 35 4.181 5.592 0.457
272 HA ALA 35 HA ALA 35 6.255 3.718 0.886
273 HB1 ALA 35 HB1 ALA 35 5.954 3.114 -1.486
274 HB2 ALA 35 HB2 ALA 35 4.380 3.368 -0.700
275 HB3 ALA 35 HB3 ALA 35 5.059 4.614 -1.774
276 H ASN 36 H ASN 36 6.243 6.543 -1.317
277 HA ASN 36 HA ASN 36 8.948 6.376 -2.092
278 HB2 ASN 36 HB2 ASN 36 7.112 7.728 -3.192
279 HB3 ASN 36 HB3 ASN 36 7.214 8.888 -1.863
280 HD21 ASN 36 HD22 ASN 36 9.225 7.224 -4.303
281 HD22 ASN 36 HD21 ASN 36 10.380 8.520 -4.547
282 H ASP 37 H ASP 37 7.423 8.064 0.620
283 HA ASP 37 HA ASP 37 9.742 9.448 1.601
284 HB2 ASP 37 HB2 ASP 37 7.380 10.159 1.793
285 HB3 ASP 37 HB3 ASP 37 7.088 8.797 2.893
286 H ASN 38 H ASN 38 8.891 6.147 1.800
287 HA ASN 38 HA ASN 38 10.475 5.841 4.307
288 HB2 ASN 38 HB2 ASN 38 8.032 5.080 4.260
289 HB3 ASN 38 HB3 ASN 38 8.583 3.783 3.193
290 HD21 ASN 38 HD22 ASN 38 7.798 2.347 4.961
291 HD22 ASN 38 HD21 ASN 38 8.769 2.133 6.409
292 H GLY 39 H GLY 39 10.800 5.581 0.996
293 HA2 GLY 39 HA2 GLY 39 12.760 4.919 -0.095
294 HA3 GLY 39 HA3 GLY 39 13.254 3.986 1.313
295 H VAL 40 H VAL 40 10.029 3.570 -0.310
296 HA VAL 40 HA VAL 40 11.039 1.011 -1.422
297 HB VAL 40 HB VAL 40 8.368 1.368 -0.015
298 HG11 VAL 40 HG11 VAL 40 8.206 -0.337 -1.739
299 HG12 VAL 40 HG12 VAL 40 9.746 -1.059 -1.249
300 HG13 VAL 40 HG13 VAL 40 8.327 -1.175 -0.197
301 HG21 VAL 40 HG21 VAL 40 10.108 1.361 1.694
302 HG22 VAL 40 HG22 VAL 40 9.324 -0.224 1.694
303 HG23 VAL 40 HG23 VAL 40 10.903 -0.031 0.931
304 H ASP 41 H ASP 41 10.089 0.366 -3.342
305 HA ASP 41 HA ASP 41 7.989 1.913 -4.613
306 HB2 ASP 41 HB2 ASP 41 10.345 3.127 -4.928
307 HB3 ASP 41 HB3 ASP 41 10.669 1.842 -6.066
308 H GLY 42 H GLY 42 6.864 -0.067 -4.912
309 HA2 GLY 42 HA2 GLY 42 8.237 -2.118 -6.564
310 HA3 GLY 42 HA3 GLY 42 7.492 -2.572 -5.023
311 H GLU 43 H GLU 43 6.541 -3.952 -6.945
312 HA GLU 43 HA GLU 43 4.516 -2.719 -8.504
313 HB2 GLU 43 HB2 GLU 43 5.871 -4.905 -8.865
314 HB3 GLU 43 HB3 GLU 43 4.672 -5.690 -7.848
315 HG2 GLU 43 HG2 GLU 43 4.129 -5.952 -10.225
316 HG3 GLU 43 HG3 GLU 43 2.903 -4.948 -9.439
317 H TRP 44 H TRP 44 2.869 -1.730 -7.600
318 HA TRP 44 HA TRP 44 1.645 -2.348 -5.084
319 HB2 TRP 44 HB2 TRP 44 0.740 -0.629 -7.438
320 HB3 TRP 44 HB3 TRP 44 -0.133 -0.751 -5.918
321 HD1 TRP 44 HD1 TRP 44 3.413 0.280 -7.100
322 HE1 TRP 44 HE1 TRP 44 4.381 1.986 -5.556
323 HE3 TRP 44 HE3 TRP 44 -0.529 0.635 -3.845
324 HZ2 TRP 44 HZ2 TRP 44 3.558 3.378 -3.129
325 HZ3 TRP 44 HZ3 TRP 44 -0.424 2.211 -1.940
326 HH2 TRP 44 HH2 TRP 44 1.631 3.552 -1.534
327 H THR 45 H THR 45 0.593 -4.257 -4.797
328 HA THR 45 HA THR 45 -1.364 -5.137 -6.871
329 HB THR 45 HB THR 45 0.262 -6.994 -5.139
330 HG1 THR 45 HG1 THR 45 1.472 -5.567 -6.734
331 HG21 THR 45 HG21 THR 45 -1.118 -7.458 -7.805
332 HG22 THR 45 HG22 THR 45 -0.218 -8.653 -6.876
333 HG23 THR 45 HG23 THR 45 -1.729 -7.999 -6.219
334 H TYR 46 H TYR 46 -3.262 -6.200 -5.915
335 HA TYR 46 HA TYR 46 -3.668 -5.642 -3.033
336 HB2 TYR 46 HB2 TYR 46 -5.711 -4.625 -3.434
337 HB3 TYR 46 HB3 TYR 46 -4.680 -3.952 -4.693
338 HD1 TYR 46 HD1 TYR 46 -4.874 -4.841 -7.076
339 HD2 TYR 46 HD2 TYR 46 -7.609 -5.996 -3.943
340 HE1 TYR 46 HE1 TYR 46 -6.328 -5.902 -8.759
341 HE2 TYR 46 HE2 TYR 46 -9.094 -7.032 -5.630
342 HH TYR 46 HH TYR 46 -8.205 -7.278 -9.081
343 H ASP 47 H ASP 47 -5.118 -6.972 -1.962
344 HA ASP 47 HA ASP 47 -6.066 -9.466 -3.301
345 HB2 ASP 47 HB2 ASP 47 -4.020 -10.029 -2.161
346 HB3 ASP 47 HB3 ASP 47 -4.519 -9.170 -0.714
347 H ASP 48 H ASP 48 -8.196 -9.073 -3.257
348 HA ASP 48 HA ASP 48 -9.500 -7.415 -1.287
349 HB2 ASP 48 HB2 ASP 48 -11.504 -7.802 -2.486
350 HB3 ASP 48 HB3 ASP 48 -10.221 -7.636 -3.679
351 H ALA 49 H ALA 49 -8.723 -10.824 -1.265
352 HA ALA 49 HA ALA 49 -10.936 -11.593 0.503
353 HB1 ALA 49 HB1 ALA 49 -10.074 -13.277 -1.034
354 HB2 ALA 49 HB2 ALA 49 -8.425 -13.089 -0.389
355 HB3 ALA 49 HB3 ALA 49 -9.721 -13.753 0.619
356 H THR 50 H THR 50 -7.376 -11.215 0.719
357 HA THR 50 HA THR 50 -7.415 -11.374 3.642
358 HB THR 50 HB THR 50 -5.175 -10.540 1.762
359 HG1 THR 50 HG1 THR 50 -5.315 -12.478 1.119
360 HG21 THR 50 HG21 THR 50 -5.106 -11.732 4.566
361 HG22 THR 50 HG22 THR 50 -3.693 -11.478 3.508
362 HG23 THR 50 HG23 THR 50 -4.607 -10.098 4.114
363 H LYS 51 H LYS 51 -7.907 -8.885 1.306
364 HA LYS 51 HA LYS 51 -8.362 -6.705 1.397
365 HB2 LYS 51 HB2 LYS 51 -8.785 -7.095 4.386
366 HB3 LYS 51 HB3 LYS 51 -9.402 -5.762 3.411
367 HG2 LYS 51 HG2 LYS 51 -10.785 -7.276 2.099
368 HG3 LYS 51 HG3 LYS 51 -10.043 -8.685 2.827
369 HD2 LYS 51 HD2 LYS 51 -11.036 -7.814 5.067
370 HD3 LYS 51 HD3 LYS 51 -12.145 -6.938 3.995
371 HE2 LYS 51 HE2 LYS 51 -11.585 -9.932 4.159
372 HE3 LYS 51 HE3 LYS 51 -13.117 -9.116 4.495
373 HZ1 LYS 51 HZ1 LYS 51 -13.095 -10.241 2.328
374 HZ2 LYS 51 HZ2 LYS 51 -13.271 -8.616 2.126
375 HZ3 LYS 51 HZ3 LYS 51 -11.830 -9.343 1.826
376 H THR 52 H THR 52 -5.939 -7.143 0.933
377 HA THR 52 HA THR 52 -4.366 -5.169 2.506
378 HB THR 52 HB THR 52 -2.414 -6.772 2.055
379 HG1 THR 52 HG1 THR 52 -3.530 -8.102 0.567
380 HG21 THR 52 HG21 THR 52 -4.623 -7.805 3.895
381 HG22 THR 52 HG22 THR 52 -2.895 -8.169 4.009
382 HG23 THR 52 HG23 THR 52 -3.481 -6.527 4.300
383 H PHE 53 H PHE 53 -2.719 -4.086 1.361
384 HA PHE 53 HA PHE 53 -2.647 -4.254 -1.583
385 HB2 PHE 53 HB2 PHE 53 -3.783 -2.112 -0.030
386 HB3 PHE 53 HB3 PHE 53 -2.240 -1.552 -0.606
387 HD1 PHE 53 HD2 PHE 53 -1.726 -1.714 -3.156
388 HD2 PHE 53 HD1 PHE 53 -5.656 -2.210 -1.489
389 HE1 PHE 53 HE2 PHE 53 -2.728 -1.084 -5.335
390 HE2 PHE 53 HE1 PHE 53 -6.662 -1.613 -3.662
391 HZ PHE 53 HZ PHE 53 -5.193 -1.019 -5.600
392 H THR 54 H THR 54 -0.580 -5.011 -1.859
393 HA THR 54 HA THR 54 1.475 -4.140 0.107
394 HB THR 54 HB THR 54 1.456 -6.684 -1.515
395 HG1 THR 54 HG1 THR 54 0.722 -7.675 0.252
396 HG21 THR 54 HG21 THR 54 3.111 -5.823 0.909
397 HG22 THR 54 HG22 THR 54 3.162 -7.418 0.134
398 HG23 THR 54 HG23 THR 54 3.714 -5.996 -0.744
399 H VAL 55 H VAL 55 3.322 -3.265 -0.533
400 HA VAL 55 HA VAL 55 3.758 -2.698 -3.433
401 HB VAL 55 HB VAL 55 5.054 -1.410 -0.968
402 HG11 VAL 55 HG11 VAL 55 6.369 -1.278 -3.047
403 HG12 VAL 55 HG12 VAL 55 4.973 -0.568 -3.898
404 HG13 VAL 55 HG13 VAL 55 5.767 0.320 -2.576
405 HG21 VAL 55 HG21 VAL 55 2.718 -0.413 -2.622
406 HG22 VAL 55 HG22 VAL 55 2.727 -0.796 -0.874
407 HG23 VAL 55 HG23 VAL 55 3.642 0.585 -1.483
408 H THR 56 H THR 56 4.810 -4.610 -4.108
409 HA THR 56 HA THR 56 6.873 -5.835 -2.343
410 HB THR 56 HB THR 56 5.388 -6.973 -4.744
411 HG1 THR 56 HG1 THR 56 3.865 -6.991 -3.341
412 HG21 THR 56 HG21 THR 56 7.017 -8.410 -2.610
413 HG22 THR 56 HG22 THR 56 6.115 -9.162 -3.939
414 HG23 THR 56 HG23 THR 56 7.517 -8.152 -4.299
415 H GLU 57 H GLU 57 8.758 -4.738 -2.766
416 HA GLU 57 HA GLU 57 9.414 -3.873 -5.527
417 HB2 GLU 57 HB2 GLU 57 9.674 -2.252 -3.697
418 HB3 GLU 57 HB3 GLU 57 10.768 -3.356 -2.852
419 HG2 GLU 57 HG2 GLU 57 12.468 -3.146 -4.513
420 HG3 GLU 57 HG3 GLU 57 11.370 -2.388 -5.654
Start of MODEL 12
1 H1 MET 1 H MET 1 -18.156 2.935 2.820
2 HA MET 1 HA MET 1 -15.827 2.930 1.932
3 HB2 MET 1 HB2 MET 1 -16.645 4.277 3.990
4 HB3 MET 1 HB3 MET 1 -15.806 3.074 4.968
5 HG2 MET 1 HG2 MET 1 -13.678 3.714 3.920
6 HG3 MET 1 HG3 MET 1 -14.539 4.814 2.819
7 HE1 MET 1 HE1 MET 1 -12.929 7.475 5.245
8 HE2 MET 1 HE2 MET 1 -12.254 6.120 4.329
9 HE3 MET 1 HE3 MET 1 -13.409 7.216 3.557
10 H GLY 2 H GLY 2 -13.682 1.949 2.084
11 HA2 GLY 2 HA2 GLY 2 -13.676 -0.800 3.249
12 HA3 GLY 2 HA3 GLY 2 -12.851 -0.297 1.767
13 H THR 3 H THR 3 -11.218 -1.425 3.518
14 HA THR 3 HA THR 3 -9.539 0.764 4.533
15 HB THR 3 HB THR 3 -10.524 -1.547 6.257
16 HG1 THR 3 HG1 THR 3 -11.543 0.729 5.881
17 HG21 THR 3 HG21 THR 3 -8.114 -1.213 6.667
18 HG22 THR 3 HG22 THR 3 -8.359 0.535 6.819
19 HG23 THR 3 HG23 THR 3 -9.045 -0.583 8.025
20 H TYR 4 H TYR 4 -7.943 0.409 3.089
21 HA TYR 4 HA TYR 4 -7.169 -2.377 2.489
22 HB2 TYR 4 HB2 TYR 4 -6.462 0.273 1.204
23 HB3 TYR 4 HB3 TYR 4 -5.660 -1.245 0.814
24 HD1 TYR 4 HD1 TYR 4 -6.914 -3.141 -0.202
25 HD2 TYR 4 HD2 TYR 4 -8.681 0.763 0.322
26 HE1 TYR 4 HE1 TYR 4 -8.695 -3.734 -1.816
27 HE2 TYR 4 HE2 TYR 4 -10.487 0.163 -1.271
28 HH TYR 4 HH TYR 4 -11.424 -1.537 -2.602
29 H LYS 5 H LYS 5 -5.449 -3.259 3.279
30 HA LYS 5 HA LYS 5 -3.862 -1.941 5.407
31 HB2 LYS 5 HB2 LYS 5 -4.098 -4.804 4.358
32 HB3 LYS 5 HB3 LYS 5 -3.032 -4.308 5.671
33 HG2 LYS 5 HG2 LYS 5 -4.920 -3.716 7.087
34 HG3 LYS 5 HG3 LYS 5 -6.056 -3.894 5.741
35 HD2 LYS 5 HD2 LYS 5 -6.188 -5.845 7.191
36 HD3 LYS 5 HD3 LYS 5 -5.562 -6.301 5.589
37 HE2 LYS 5 HE2 LYS 5 -3.231 -6.155 6.545
38 HE3 LYS 5 HE3 LYS 5 -3.947 -5.852 8.132
39 HZ1 LYS 5 HZ1 LYS 5 -3.355 -8.144 7.773
40 HZ2 LYS 5 HZ2 LYS 5 -4.968 -8.017 8.031
41 HZ3 LYS 5 HZ3 LYS 5 -4.376 -8.292 6.509
42 H LEU 6 H LEU 6 -2.239 -0.696 4.480
43 HA LEU 6 HA LEU 6 -0.923 -1.639 2.033
44 HB2 LEU 6 HB2 LEU 6 -1.631 0.798 2.598
45 HB3 LEU 6 HB3 LEU 6 -0.205 0.842 3.608
46 HG LEU 6 HG LEU 6 0.482 1.792 1.602
47 HD11 LEU 6 HD11 LEU 6 2.020 -0.096 2.264
48 HD12 LEU 6 HD12 LEU 6 1.272 -1.070 0.977
49 HD13 LEU 6 HD13 LEU 6 2.104 0.432 0.571
50 HD21 LEU 6 HD21 LEU 6 -1.402 1.315 0.174
51 HD22 LEU 6 HD22 LEU 6 0.081 0.842 -0.655
52 HD23 LEU 6 HD23 LEU 6 -0.948 -0.398 0.060
53 H ILE 7 H ILE 7 0.768 -2.999 2.218
54 HA ILE 7 HA ILE 7 2.520 -2.851 4.620
55 HB ILE 7 HB ILE 7 1.533 -5.271 3.087
56 HG12 ILE 7 HG12 ILE 7 1.273 -6.190 5.400
57 HG13 ILE 7 HG13 ILE 7 1.803 -4.659 6.082
58 HG21 ILE 7 HG21 ILE 7 3.984 -5.512 3.175
59 HG22 ILE 7 HG22 ILE 7 3.990 -5.097 4.901
60 HG23 ILE 7 HG23 ILE 7 3.237 -6.604 4.333
61 HD11 ILE 7 HD11 ILE 7 -0.253 -3.590 5.394
62 HD12 ILE 7 HD12 ILE 7 -0.700 -4.984 4.373
63 HD13 ILE 7 HD13 ILE 7 -0.667 -5.115 6.150
64 H LEU 8 H LEU 8 4.388 -2.050 4.153
65 HA LEU 8 HA LEU 8 5.334 -1.664 1.357
66 HB2 LEU 8 HB2 LEU 8 5.902 -0.514 4.081
67 HB3 LEU 8 HB3 LEU 8 7.310 -0.730 3.067
68 HG LEU 8 HG LEU 8 6.528 0.780 1.396
69 HD11 LEU 8 HD11 LEU 8 4.228 0.269 1.221
70 HD12 LEU 8 HD12 LEU 8 3.928 0.783 2.903
71 HD13 LEU 8 HD13 LEU 8 4.339 1.980 1.647
72 HD21 LEU 8 HD21 LEU 8 7.558 1.951 3.186
73 HD22 LEU 8 HD22 LEU 8 6.073 2.869 2.907
74 HD23 LEU 8 HD23 LEU 8 6.149 1.751 4.252
75 H ASN 9 H ASN 9 6.463 -3.458 0.518
76 HA ASN 9 HA ASN 9 8.132 -5.008 2.440
77 HB2 ASN 9 HB2 ASN 9 6.293 -6.387 1.656
78 HB3 ASN 9 HB3 ASN 9 6.669 -6.005 -0.022
79 HD21 ASN 9 HD22 ASN 9 9.122 -6.476 -0.602
80 HD22 ASN 9 HD21 ASN 9 9.650 -8.068 -0.174
81 H GLY 10 H GLY 10 9.746 -3.321 2.140
82 HA2 GLY 10 HA2 GLY 10 10.665 -2.801 -0.588
83 HA3 GLY 10 HA3 GLY 10 11.212 -2.024 0.894
84 H LYS 11 H LYS 11 12.969 -3.092 -1.110
85 HA LYS 11 HA LYS 11 13.958 -5.649 -0.143
86 HB2 LYS 11 HB2 LYS 11 15.608 -5.643 -1.710
87 HB3 LYS 11 HB3 LYS 11 14.273 -4.849 -2.509
88 HG2 LYS 11 HG2 LYS 11 16.694 -3.366 -1.321
89 HG3 LYS 11 HG3 LYS 11 16.586 -3.980 -2.966
90 HD2 LYS 11 HD2 LYS 11 14.435 -2.652 -3.181
91 HD3 LYS 11 HD3 LYS 11 14.951 -1.768 -1.729
92 HE2 LYS 11 HE2 LYS 11 17.034 -1.111 -2.976
93 HE3 LYS 11 HE3 LYS 11 16.463 -2.054 -4.365
94 HZ1 LYS 11 HZ1 LYS 11 14.436 -0.562 -4.301
95 HZ2 LYS 11 HZ2 LYS 11 15.218 0.385 -3.264
96 HZ3 LYS 11 HZ3 LYS 11 15.842 0.180 -4.775
97 H THR 12 H THR 12 14.210 -2.685 1.322
98 HA THR 12 HA THR 12 16.674 -3.541 2.792
99 HB THR 12 HB THR 12 15.801 -0.708 2.096
100 HG1 THR 12 HG1 THR 12 17.205 -0.674 0.579
101 HG21 THR 12 HG21 THR 12 18.151 -0.144 2.843
102 HG22 THR 12 HG22 THR 12 17.073 -0.651 4.137
103 HG23 THR 12 HG23 THR 12 18.281 -1.791 3.495
104 H LEU 13 H LEU 13 13.407 -2.032 2.995
105 HA LEU 13 HA LEU 13 13.348 -2.594 5.839
106 HB2 LEU 13 HB2 LEU 13 12.771 -0.367 6.496
107 HB3 LEU 13 HB3 LEU 13 14.303 -0.319 5.673
108 HG LEU 13 HG LEU 13 13.183 1.603 5.047
109 HD11 LEU 13 HD11 LEU 13 12.691 -0.166 2.644
110 HD12 LEU 13 HD12 LEU 13 12.862 1.590 2.663
111 HD13 LEU 13 HD13 LEU 13 14.247 0.586 3.096
112 HD21 LEU 13 HD21 LEU 13 10.976 1.880 4.275
113 HD22 LEU 13 HD22 LEU 13 10.698 0.134 4.153
114 HD23 LEU 13 HD23 LEU 13 10.916 0.899 5.754
115 H LYS 14 H LYS 14 11.079 -2.266 6.664
116 HA LYS 14 HA LYS 14 9.005 -2.436 4.556
117 HB2 LYS 14 HB2 LYS 14 9.404 -4.458 6.803
118 HB3 LYS 14 HB3 LYS 14 8.012 -4.399 5.715
119 HG2 LYS 14 HG2 LYS 14 9.743 -4.631 3.778
120 HG3 LYS 14 HG3 LYS 14 10.890 -5.068 5.056
121 HD2 LYS 14 HD2 LYS 14 9.240 -6.778 5.838
122 HD3 LYS 14 HD3 LYS 14 8.260 -6.458 4.394
123 HE2 LYS 14 HE2 LYS 14 10.240 -7.082 2.978
124 HE3 LYS 14 HE3 LYS 14 11.152 -7.444 4.455
125 HZ1 LYS 14 HZ1 LYS 14 8.679 -8.781 3.552
126 HZ2 LYS 14 HZ2 LYS 14 10.148 -9.419 3.470
127 HZ3 LYS 14 HZ3 LYS 14 9.460 -9.123 4.971
128 H GLY 15 H GLY 15 6.749 -2.375 5.483
129 HA2 GLY 15 HA2 GLY 15 6.453 -1.109 8.120
130 HA3 GLY 15 HA3 GLY 15 6.126 -0.084 6.722
131 H GLU 16 H GLU 16 4.153 -0.678 8.561
132 HA GLU 16 HA GLU 16 2.160 -2.045 6.859
133 HB2 GLU 16 HB2 GLU 16 2.908 -3.874 8.268
134 HB3 GLU 16 HB3 GLU 16 2.840 -2.868 9.727
135 HG2 GLU 16 HG2 GLU 16 0.389 -2.686 9.535
136 HG3 GLU 16 HG3 GLU 16 0.436 -3.526 7.988
137 H THR 17 H THR 17 0.536 -0.525 6.676
138 HA THR 17 HA THR 17 -0.221 1.037 9.084
139 HB THR 17 HB THR 17 -0.500 3.000 7.492
140 HG1 THR 17 HG1 THR 17 0.746 2.941 5.625
141 HG21 THR 17 HG21 THR 17 1.395 2.888 9.082
142 HG22 THR 17 HG22 THR 17 2.373 2.044 7.884
143 HG23 THR 17 HG23 THR 17 1.838 3.712 7.582
144 H THR 18 H THR 18 -2.433 2.195 8.575
145 HA THR 18 HA THR 18 -4.172 0.569 6.814
146 HB THR 18 HB THR 18 -5.867 0.667 8.766
147 HG1 THR 18 HG1 THR 18 -4.757 1.985 10.214
148 HG21 THR 18 HG21 THR 18 -3.471 -1.152 9.214
149 HG22 THR 18 HG22 THR 18 -5.138 -1.421 9.741
150 HG23 THR 18 HG23 THR 18 -4.749 -1.444 8.010
151 H THR 19 H THR 19 -5.803 1.831 5.876
152 HA THR 19 HA THR 19 -6.483 4.403 6.906
153 HB THR 19 HB THR 19 -4.817 4.234 4.388
154 HG1 THR 19 HG1 THR 19 -4.209 4.732 6.775
155 HG21 THR 19 HG21 THR 19 -5.320 6.659 4.087
156 HG22 THR 19 HG22 THR 19 -6.755 5.648 3.811
157 HG23 THR 19 HG23 THR 19 -6.568 6.522 5.345
158 H GLU 20 H GLU 20 -8.599 4.938 6.253
159 HA GLU 20 HA GLU 20 -9.931 2.836 4.688
160 HB2 GLU 20 HB2 GLU 20 -12.024 3.780 5.648
161 HB3 GLU 20 HB3 GLU 20 -10.905 3.044 6.779
162 HG2 GLU 20 HG2 GLU 20 -10.126 5.334 7.465
163 HG3 GLU 20 HG3 GLU 20 -11.404 6.020 6.470
164 H ALA 21 H ALA 21 -11.150 3.293 2.818
165 HA ALA 21 HA ALA 21 -11.397 5.989 1.775
166 HB1 ALA 21 HB1 ALA 21 -8.998 5.502 1.219
167 HB2 ALA 21 HB2 ALA 21 -9.511 4.023 0.373
168 HB3 ALA 21 HB3 ALA 21 -9.999 5.619 -0.233
169 H VAL 22 H VAL 22 -12.381 5.921 -0.482
170 HA VAL 22 HA VAL 22 -14.445 3.850 -0.532
171 HB VAL 22 HB VAL 22 -14.881 6.292 -0.904
172 HG11 VAL 22 HG11 VAL 22 -14.502 7.320 -3.056
173 HG12 VAL 22 HG12 VAL 22 -12.934 6.778 -2.435
174 HG13 VAL 22 HG13 VAL 22 -13.757 5.853 -3.703
175 HG21 VAL 22 HG21 VAL 22 -15.824 4.552 -3.202
176 HG22 VAL 22 HG22 VAL 22 -16.494 4.523 -1.559
177 HG23 VAL 22 HG23 VAL 22 -16.609 5.995 -2.537
178 H ASP 23 H ASP 23 -11.327 4.332 -2.201
179 HA ASP 23 HA ASP 23 -11.974 1.933 -3.795
180 HB2 ASP 23 HB2 ASP 23 -11.841 4.651 -4.852
181 HB3 ASP 23 HB3 ASP 23 -10.484 3.732 -5.477
182 H ALA 24 H ALA 24 -10.198 0.783 -4.556
183 HA ALA 24 HA ALA 24 -7.920 0.696 -2.862
184 HB1 ALA 24 HB1 ALA 24 -8.839 -1.224 -4.236
185 HB2 ALA 24 HB2 ALA 24 -8.215 -0.426 -5.692
186 HB3 ALA 24 HB3 ALA 24 -7.098 -0.987 -4.436
187 H ALA 25 H ALA 25 -8.478 2.102 -6.082
188 HA ALA 25 HA ALA 25 -5.830 2.926 -6.671
189 HB1 ALA 25 HB1 ALA 25 -7.601 2.821 -8.359
190 HB2 ALA 25 HB2 ALA 25 -8.506 4.096 -7.516
191 HB3 ALA 25 HB3 ALA 25 -6.936 4.466 -8.274
192 H THR 26 H THR 26 -8.527 4.715 -4.965
193 HA THR 26 HA THR 26 -7.069 7.129 -4.628
194 HB THR 26 HB THR 26 -9.333 5.796 -3.098
195 HG1 THR 26 HG1 THR 26 -9.892 8.138 -4.216
196 HG21 THR 26 HG21 THR 26 -8.258 7.232 -1.443
197 HG22 THR 26 HG22 THR 26 -8.193 8.576 -2.603
198 HG23 THR 26 HG23 THR 26 -9.756 7.967 -2.000
199 H ALA 27 H ALA 27 -7.377 4.231 -2.503
200 HA ALA 27 HA ALA 27 -5.729 5.153 -0.429
201 HB1 ALA 27 HB1 ALA 27 -6.215 2.310 -1.433
202 HB2 ALA 27 HB2 ALA 27 -5.469 2.735 0.114
203 HB3 ALA 27 HB3 ALA 27 -7.152 3.187 -0.204
204 H GLU 28 H GLU 28 -4.864 3.317 -3.359
205 HA GLU 28 HA GLU 28 -2.094 2.967 -2.914
206 HB2 GLU 28 HB2 GLU 28 -3.453 1.782 -4.582
207 HB3 GLU 28 HB3 GLU 28 -3.764 3.265 -5.439
208 HG2 GLU 28 HG2 GLU 28 -0.935 3.075 -5.380
209 HG3 GLU 28 HG3 GLU 28 -1.513 1.442 -5.669
210 H LYS 29 H LYS 29 -3.753 5.498 -4.856
211 HA LYS 29 HA LYS 29 -1.452 6.924 -5.608
212 HB2 LYS 29 HB2 LYS 29 -4.314 7.845 -5.149
213 HB3 LYS 29 HB3 LYS 29 -3.061 8.855 -5.890
214 HG2 LYS 29 HG2 LYS 29 -2.809 7.324 -7.760
215 HG3 LYS 29 HG3 LYS 29 -3.817 6.114 -7.004
216 HD2 LYS 29 HD2 LYS 29 -5.160 7.168 -8.648
217 HD3 LYS 29 HD3 LYS 29 -5.756 7.768 -7.093
218 HE2 LYS 29 HE2 LYS 29 -4.409 9.823 -7.363
219 HE3 LYS 29 HE3 LYS 29 -3.690 9.187 -8.843
220 HZ1 LYS 29 HZ1 LYS 29 -5.910 9.264 -9.859
221 HZ2 LYS 29 HZ2 LYS 29 -6.534 9.929 -8.488
222 HZ3 LYS 29 HZ3 LYS 29 -5.372 10.728 -9.339
223 H VAL 30 H VAL 30 -3.565 7.442 -2.723
224 HA VAL 30 HA VAL 30 -2.037 9.655 -1.750
225 HB VAL 30 HB VAL 30 -3.983 7.746 -0.400
226 HG11 VAL 30 HG11 VAL 30 -4.171 9.469 1.396
227 HG12 VAL 30 HG12 VAL 30 -2.586 8.701 1.373
228 HG13 VAL 30 HG13 VAL 30 -2.779 10.329 0.694
229 HG21 VAL 30 HG21 VAL 30 -4.291 10.635 -1.359
230 HG22 VAL 30 HG22 VAL 30 -4.947 9.214 -2.186
231 HG23 VAL 30 HG23 VAL 30 -5.548 9.650 -0.583
232 H PHE 31 H PHE 31 -2.004 6.147 -0.686
233 HA PHE 31 HA PHE 31 0.171 6.611 1.048
234 HB2 PHE 31 HB2 PHE 31 -1.094 4.139 -0.108
235 HB3 PHE 31 HB3 PHE 31 0.471 3.986 0.631
236 HD1 PHE 31 HD2 PHE 31 0.256 5.929 3.010
237 HD2 PHE 31 HD1 PHE 31 -2.401 2.908 1.435
238 HE1 PHE 31 HE2 PHE 31 -0.538 5.466 5.264
239 HE2 PHE 31 HE1 PHE 31 -3.149 2.403 3.748
240 HZ PHE 31 HZ PHE 31 -2.210 3.675 5.669
241 H LYS 32 H LYS 32 0.392 6.558 -2.409
242 HA LYS 32 HA LYS 32 2.973 5.373 -2.590
243 HB2 LYS 32 HB2 LYS 32 1.361 6.256 -4.525
244 HB3 LYS 32 HB3 LYS 32 2.321 7.741 -4.340
245 HG2 LYS 32 HG2 LYS 32 4.391 6.136 -4.438
246 HG3 LYS 32 HG3 LYS 32 3.245 4.923 -5.007
247 HD2 LYS 32 HD2 LYS 32 2.672 6.480 -6.916
248 HD3 LYS 32 HD3 LYS 32 4.004 7.529 -6.378
249 HE2 LYS 32 HE2 LYS 32 4.215 4.588 -7.171
250 HE3 LYS 32 HE3 LYS 32 4.720 5.952 -8.171
251 HZ1 LYS 32 HZ1 LYS 32 6.404 6.474 -6.536
252 HZ2 LYS 32 HZ2 LYS 32 5.938 5.216 -5.565
253 HZ3 LYS 32 HZ3 LYS 32 6.564 4.913 -7.031
254 H GLN 33 H GLN 33 1.942 8.488 -1.354
255 HA GLN 33 HA GLN 33 4.429 9.886 -1.422
256 HB2 GLN 33 HB2 GLN 33 2.143 9.915 0.610
257 HB3 GLN 33 HB3 GLN 33 3.479 11.062 0.581
258 HG2 GLN 33 HG2 GLN 33 2.722 11.962 -1.560
259 HG3 GLN 33 HG3 GLN 33 1.452 10.723 -1.671
260 HE21 GLN 33 HE22 GLN 33 -0.514 11.871 -1.319
261 HE22 GLN 33 HE21 GLN 33 -0.707 12.996 0.022
262 H TYR 34 H TYR 34 2.902 8.062 1.279
263 HA TYR 34 HA TYR 34 5.087 7.963 3.008
264 HB2 TYR 34 HB2 TYR 34 3.253 7.394 4.129
265 HB3 TYR 34 HB3 TYR 34 2.432 6.763 2.734
266 HD1 TYR 34 HD2 TYR 34 4.946 5.810 5.367
267 HD2 TYR 34 HD1 TYR 34 2.087 4.466 2.433
268 HE1 TYR 34 HE2 TYR 34 4.975 3.538 6.373
269 HE2 TYR 34 HE1 TYR 34 2.060 2.228 3.469
270 HH TYR 34 HH TYR 34 2.610 1.119 5.581
271 H ALA 35 H ALA 35 4.175 5.627 0.436
272 HA ALA 35 HA ALA 35 6.134 3.681 1.048
273 HB1 ALA 35 HB1 ALA 35 5.814 2.910 -1.245
274 HB2 ALA 35 HB2 ALA 35 4.254 3.321 -0.510
275 HB3 ALA 35 HB3 ALA 35 5.016 4.439 -1.669
276 H ASN 36 H ASN 36 6.383 6.350 -1.391
277 HA ASN 36 HA ASN 36 9.176 5.781 -1.755
278 HB2 ASN 36 HB2 ASN 36 7.686 6.835 -3.470
279 HB3 ASN 36 HB3 ASN 36 7.719 8.326 -2.512
280 HD21 ASN 36 HD22 ASN 36 9.161 9.725 -3.632
281 HD22 ASN 36 HD21 ASN 36 10.726 9.201 -4.250
282 H ASP 37 H ASP 37 7.462 7.954 0.461
283 HA ASP 37 HA ASP 37 9.644 9.645 1.202
284 HB2 ASP 37 HB2 ASP 37 7.301 10.170 1.716
285 HB3 ASP 37 HB3 ASP 37 7.204 8.763 2.784
286 H ASN 38 H ASN 38 8.707 6.370 2.080
287 HA ASN 38 HA ASN 38 10.745 6.203 4.202
288 HB2 ASN 38 HB2 ASN 38 8.271 5.324 4.236
289 HB3 ASN 38 HB3 ASN 38 8.934 3.954 3.332
290 HD21 ASN 38 HD22 ASN 38 7.771 3.482 5.762
291 HD22 ASN 38 HD21 ASN 38 8.976 3.148 6.991
292 H GLY 39 H GLY 39 10.795 5.898 0.880
293 HA2 GLY 39 HA2 GLY 39 12.575 5.228 -0.435
294 HA3 GLY 39 HA3 GLY 39 13.304 4.402 0.943
295 H VAL 40 H VAL 40 9.927 3.723 -0.184
296 HA VAL 40 HA VAL 40 10.874 1.078 -1.182
297 HB VAL 40 HB VAL 40 8.337 1.729 0.366
298 HG11 VAL 40 HG11 VAL 40 9.411 -0.883 -0.795
299 HG12 VAL 40 HG12 VAL 40 8.084 -0.796 0.381
300 HG13 VAL 40 HG13 VAL 40 7.894 -0.065 -1.213
301 HG21 VAL 40 HG21 VAL 40 9.314 0.242 2.118
302 HG22 VAL 40 HG22 VAL 40 10.835 0.206 1.204
303 HG23 VAL 40 HG23 VAL 40 10.234 1.730 1.894
304 H ASP 41 H ASP 41 10.507 0.847 -3.324
305 HA ASP 41 HA ASP 41 7.963 1.788 -4.417
306 HB2 ASP 41 HB2 ASP 41 9.673 3.693 -4.652
307 HB3 ASP 41 HB3 ASP 41 10.573 2.656 -5.751
308 H GLY 42 H GLY 42 7.375 -0.299 -4.742
309 HA2 GLY 42 HA2 GLY 42 9.091 -2.021 -6.473
310 HA3 GLY 42 HA3 GLY 42 8.224 -2.634 -5.049
311 H GLU 43 H GLU 43 7.196 -4.092 -6.674
312 HA GLU 43 HA GLU 43 5.366 -2.907 -8.625
313 HB2 GLU 43 HB2 GLU 43 6.729 -4.952 -9.043
314 HB3 GLU 43 HB3 GLU 43 5.870 -5.777 -7.738
315 HG2 GLU 43 HG2 GLU 43 4.984 -6.417 -9.895
316 HG3 GLU 43 HG3 GLU 43 3.758 -5.539 -8.962
317 H TRP 44 H TRP 44 3.403 -2.193 -8.004
318 HA TRP 44 HA TRP 44 2.323 -2.737 -5.326
319 HB2 TRP 44 HB2 TRP 44 1.483 -0.954 -7.658
320 HB3 TRP 44 HB3 TRP 44 0.581 -1.075 -6.168
321 HD1 TRP 44 HD1 TRP 44 4.151 -0.062 -7.263
322 HE1 TRP 44 HE1 TRP 44 4.962 1.859 -5.836
323 HE3 TRP 44 HE3 TRP 44 0.057 0.459 -4.241
324 HZ2 TRP 44 HZ2 TRP 44 4.081 3.255 -3.440
325 HZ3 TRP 44 HZ3 TRP 44 0.040 2.158 -2.439
326 HH2 TRP 44 HH2 TRP 44 2.062 3.492 -1.963
327 H THR 45 H THR 45 0.604 -4.149 -4.903
328 HA THR 45 HA THR 45 -1.204 -4.928 -7.105
329 HB THR 45 HB THR 45 0.158 -6.934 -5.287
330 HG1 THR 45 HG1 THR 45 0.903 -5.955 -7.769
331 HG21 THR 45 HG21 THR 45 -1.523 -7.379 -7.780
332 HG22 THR 45 HG22 THR 45 -0.768 -8.641 -6.812
333 HG23 THR 45 HG23 THR 45 -2.060 -7.674 -6.109
334 H TYR 46 H TYR 46 -3.285 -5.359 -6.355
335 HA TYR 46 HA TYR 46 -3.870 -4.915 -3.480
336 HB2 TYR 46 HB2 TYR 46 -6.088 -4.058 -4.437
337 HB3 TYR 46 HB3 TYR 46 -4.670 -3.053 -4.612
338 HD1 TYR 46 HD2 TYR 46 -6.725 -5.559 -6.579
339 HD2 TYR 46 HD1 TYR 46 -4.013 -2.192 -6.694
340 HE1 TYR 46 HE2 TYR 46 -6.918 -5.486 -9.032
341 HE2 TYR 46 HE1 TYR 46 -4.274 -2.075 -9.144
342 HH TYR 46 HH TYR 46 -6.249 -4.388 -11.030
343 H ASP 47 H ASP 47 -5.527 -6.122 -2.545
344 HA ASP 47 HA ASP 47 -6.788 -8.300 -4.127
345 HB2 ASP 47 HB2 ASP 47 -4.954 -8.569 -1.764
346 HB3 ASP 47 HB3 ASP 47 -6.358 -9.632 -1.837
347 H ASP 48 H ASP 48 -8.810 -7.192 -3.940
348 HA ASP 48 HA ASP 48 -9.659 -5.944 -1.511
349 HB2 ASP 48 HB2 ASP 48 -11.588 -5.416 -2.568
350 HB3 ASP 48 HB3 ASP 48 -10.628 -5.782 -3.999
351 H ALA 49 H ALA 49 -9.687 -9.299 -2.532
352 HA ALA 49 HA ALA 49 -11.734 -10.367 -1.011
353 HB1 ALA 49 HB1 ALA 49 -9.004 -11.585 -1.608
354 HB2 ALA 49 HB2 ALA 49 -10.475 -12.485 -1.164
355 HB3 ALA 49 HB3 ALA 49 -10.399 -11.590 -2.697
356 H THR 50 H THR 50 -8.454 -9.579 0.030
357 HA THR 50 HA THR 50 -9.145 -10.042 2.897
358 HB THR 50 HB THR 50 -6.500 -10.269 2.967
359 HG1 THR 50 HG1 THR 50 -5.789 -10.061 0.955
360 HG21 THR 50 HG21 THR 50 -8.027 -12.056 3.603
361 HG22 THR 50 HG22 THR 50 -8.305 -12.471 1.899
362 HG23 THR 50 HG23 THR 50 -6.700 -12.704 2.624
363 H LYS 51 H LYS 51 -8.844 -7.688 0.637
364 HA LYS 51 HA LYS 51 -8.426 -5.519 0.551
365 HB2 LYS 51 HB2 LYS 51 -8.729 -5.441 3.558
366 HB3 LYS 51 HB3 LYS 51 -8.955 -4.119 2.398
367 HG2 LYS 51 HG2 LYS 51 -10.871 -5.344 1.387
368 HG3 LYS 51 HG3 LYS 51 -10.670 -6.629 2.596
369 HD2 LYS 51 HD2 LYS 51 -10.856 -4.707 4.332
370 HD3 LYS 51 HD3 LYS 51 -11.588 -3.772 3.038
371 HE2 LYS 51 HE2 LYS 51 -13.415 -5.283 2.809
372 HE3 LYS 51 HE3 LYS 51 -12.559 -6.569 3.673
373 HZ1 LYS 51 HZ1 LYS 51 -13.537 -4.069 4.904
374 HZ2 LYS 51 HZ2 LYS 51 -14.196 -5.560 5.091
375 HZ3 LYS 51 HZ3 LYS 51 -12.699 -5.259 5.688
376 H THR 52 H THR 52 -6.173 -7.412 0.884
377 HA THR 52 HA THR 52 -4.118 -5.922 2.338
378 HB THR 52 HB THR 52 -2.702 -7.819 1.283
379 HG1 THR 52 HG1 THR 52 -4.065 -8.513 -0.290
380 HG21 THR 52 HG21 THR 52 -3.478 -7.838 3.630
381 HG22 THR 52 HG22 THR 52 -5.014 -8.557 3.140
382 HG23 THR 52 HG23 THR 52 -3.504 -9.468 2.934
383 H PHE 53 H PHE 53 -2.343 -4.889 1.300
384 HA PHE 53 HA PHE 53 -2.401 -4.570 -1.590
385 HB2 PHE 53 HB2 PHE 53 -3.892 -2.799 -0.260
386 HB3 PHE 53 HB3 PHE 53 -2.352 -2.082 0.133
387 HD1 PHE 53 HD2 PHE 53 -0.827 -2.496 -2.470
388 HD2 PHE 53 HD1 PHE 53 -4.950 -1.393 -1.768
389 HE1 PHE 53 HE2 PHE 53 -0.958 -1.525 -4.713
390 HE2 PHE 53 HE1 PHE 53 -5.000 -0.272 -3.983
391 HZ PHE 53 HZ PHE 53 -3.015 -0.373 -5.479
392 H THR 54 H THR 54 -0.308 -5.270 -1.932
393 HA THR 54 HA THR 54 1.740 -4.426 0.074
394 HB THR 54 HB THR 54 1.754 -7.047 -1.424
395 HG1 THR 54 HG1 THR 54 0.085 -6.976 0.068
396 HG21 THR 54 HG21 THR 54 3.393 -6.067 0.951
397 HG22 THR 54 HG22 THR 54 3.501 -7.677 0.194
398 HG23 THR 54 HG23 THR 54 3.995 -6.253 -0.709
399 H VAL 55 H VAL 55 3.552 -3.574 -0.650
400 HA VAL 55 HA VAL 55 3.873 -3.088 -3.584
401 HB VAL 55 HB VAL 55 5.037 -1.568 -1.187
402 HG11 VAL 55 HG11 VAL 55 6.429 -1.454 -3.206
403 HG12 VAL 55 HG12 VAL 55 5.021 -0.961 -4.179
404 HG13 VAL 55 HG13 VAL 55 5.654 0.113 -2.908
405 HG21 VAL 55 HG21 VAL 55 2.666 -0.896 -2.962
406 HG22 VAL 55 HG22 VAL 55 2.649 -1.162 -1.212
407 HG23 VAL 55 HG23 VAL 55 3.463 0.261 -1.868
408 H THR 56 H THR 56 4.946 -4.994 -4.123
409 HA THR 56 HA THR 56 6.974 -6.046 -2.250
410 HB THR 56 HB THR 56 6.006 -7.407 -4.769
411 HG1 THR 56 HG1 THR 56 4.211 -7.200 -3.712
412 HG21 THR 56 HG21 THR 56 7.153 -8.463 -2.141
413 HG22 THR 56 HG22 THR 56 6.671 -9.439 -3.549
414 HG23 THR 56 HG23 THR 56 8.046 -8.332 -3.671
415 H GLU 57 H GLU 57 8.920 -5.228 -2.441
416 HA GLU 57 HA GLU 57 10.066 -4.538 -5.083
417 HB2 GLU 57 HB2 GLU 57 9.804 -2.875 -3.044
418 HB3 GLU 57 HB3 GLU 57 11.077 -3.865 -2.308
419 HG2 GLU 57 HG2 GLU 57 12.567 -3.322 -4.200
420 HG3 GLU 57 HG3 GLU 57 11.292 -2.350 -4.929
Start of MODEL 13
1 H1 MET 1 H MET 1 -15.397 1.846 -1.950
2 HA MET 1 HA MET 1 -14.112 2.472 -0.053
3 HB2 MET 1 HB2 MET 1 -16.225 3.683 -0.216
4 HB3 MET 1 HB3 MET 1 -17.069 2.393 0.661
5 HG2 MET 1 HG2 MET 1 -15.671 2.790 2.646
6 HG3 MET 1 HG3 MET 1 -14.771 4.045 1.793
7 HE1 MET 1 HE1 MET 1 -16.971 5.597 4.743
8 HE2 MET 1 HE2 MET 1 -16.364 3.939 4.658
9 HE3 MET 1 HE3 MET 1 -15.303 5.285 4.191
10 H GLY 2 H GLY 2 -12.768 1.300 1.128
11 HA2 GLY 2 HA2 GLY 2 -13.663 -0.143 3.444
12 HA3 GLY 2 HA3 GLY 2 -12.963 -1.174 2.189
13 H THR 3 H THR 3 -11.548 -1.173 4.450
14 HA THR 3 HA THR 3 -9.455 0.905 4.445
15 HB THR 3 HB THR 3 -9.970 -1.442 6.308
16 HG1 THR 3 HG1 THR 3 -11.597 -0.159 6.587
17 HG21 THR 3 HG21 THR 3 -7.616 -0.649 6.376
18 HG22 THR 3 HG22 THR 3 -8.192 1.002 6.692
19 HG23 THR 3 HG23 THR 3 -8.492 -0.302 7.867
20 H TYR 4 H TYR 4 -7.776 0.539 3.079
21 HA TYR 4 HA TYR 4 -7.040 -2.269 2.426
22 HB2 TYR 4 HB2 TYR 4 -6.339 0.417 1.225
23 HB3 TYR 4 HB3 TYR 4 -5.292 -0.977 0.993
24 HD1 TYR 4 HD1 TYR 4 -6.069 -3.046 -0.148
25 HD2 TYR 4 HD2 TYR 4 -8.460 0.554 0.017
26 HE1 TYR 4 HE1 TYR 4 -7.476 -3.907 -1.978
27 HE2 TYR 4 HE2 TYR 4 -9.889 -0.312 -1.782
28 HH TYR 4 HH TYR 4 -10.313 -2.100 -3.203
29 H LYS 5 H LYS 5 -5.543 -3.226 3.519
30 HA LYS 5 HA LYS 5 -3.922 -1.920 5.590
31 HB2 LYS 5 HB2 LYS 5 -3.979 -4.758 4.491
32 HB3 LYS 5 HB3 LYS 5 -3.100 -4.274 5.921
33 HG2 LYS 5 HG2 LYS 5 -5.106 -3.969 7.190
34 HG3 LYS 5 HG3 LYS 5 -6.118 -3.937 5.735
35 HD2 LYS 5 HD2 LYS 5 -5.477 -6.298 5.249
36 HD3 LYS 5 HD3 LYS 5 -4.609 -6.350 6.800
37 HE2 LYS 5 HE2 LYS 5 -6.720 -5.924 7.992
38 HE3 LYS 5 HE3 LYS 5 -7.565 -5.728 6.442
39 HZ1 LYS 5 HZ1 LYS 5 -7.911 -7.912 7.304
40 HZ2 LYS 5 HZ2 LYS 5 -7.060 -7.998 5.915
41 HZ3 LYS 5 HZ3 LYS 5 -6.273 -8.218 7.334
42 H LEU 6 H LEU 6 -2.268 -0.698 4.789
43 HA LEU 6 HA LEU 6 -1.040 -1.313 2.209
44 HB2 LEU 6 HB2 LEU 6 -1.634 0.993 3.101
45 HB3 LEU 6 HB3 LEU 6 -0.369 0.796 4.294
46 HG LEU 6 HG LEU 6 0.531 2.143 2.598
47 HD11 LEU 6 HD11 LEU 6 2.126 0.282 3.200
48 HD12 LEU 6 HD12 LEU 6 1.622 -0.532 1.691
49 HD13 LEU 6 HD13 LEU 6 2.361 1.060 1.619
50 HD21 LEU 6 HD21 LEU 6 0.521 1.489 0.163
51 HD22 LEU 6 HD22 LEU 6 -0.573 0.158 0.604
52 HD23 LEU 6 HD23 LEU 6 -1.073 1.829 0.833
53 H ILE 7 H ILE 7 0.554 -2.798 2.130
54 HA ILE 7 HA ILE 7 2.313 -3.214 4.505
55 HB ILE 7 HB ILE 7 1.066 -5.184 2.567
56 HG12 ILE 7 HG12 ILE 7 0.981 -6.572 4.692
57 HG13 ILE 7 HG13 ILE 7 1.627 -5.195 5.581
58 HG21 ILE 7 HG21 ILE 7 3.497 -5.578 2.330
59 HG22 ILE 7 HG22 ILE 7 3.676 -5.611 4.086
60 HG23 ILE 7 HG23 ILE 7 2.741 -6.871 3.250
61 HD11 ILE 7 HD11 ILE 7 -0.436 -3.917 5.068
62 HD12 ILE 7 HD12 ILE 7 -1.039 -5.292 4.106
63 HD13 ILE 7 HD13 ILE 7 -0.785 -5.430 5.862
64 H LEU 8 H LEU 8 4.299 -2.617 4.179
65 HA LEU 8 HA LEU 8 5.278 -1.974 1.435
66 HB2 LEU 8 HB2 LEU 8 5.410 -0.605 3.994
67 HB3 LEU 8 HB3 LEU 8 7.031 -1.202 3.612
68 HG LEU 8 HG LEU 8 6.917 -0.130 1.421
69 HD11 LEU 8 HD11 LEU 8 4.423 0.016 1.205
70 HD12 LEU 8 HD12 LEU 8 4.444 1.279 2.468
71 HD13 LEU 8 HD13 LEU 8 5.260 1.529 0.906
72 HD21 LEU 8 HD21 LEU 8 7.978 0.961 3.412
73 HD22 LEU 8 HD22 LEU 8 7.302 2.147 2.285
74 HD23 LEU 8 HD23 LEU 8 6.427 1.755 3.783
75 H ASN 9 H ASN 9 6.370 -3.708 0.584
76 HA ASN 9 HA ASN 9 7.942 -5.479 2.400
77 HB2 ASN 9 HB2 ASN 9 5.919 -6.594 1.619
78 HB3 ASN 9 HB3 ASN 9 6.235 -6.086 -0.047
79 HD21 ASN 9 HD22 ASN 9 6.780 -7.925 -1.195
80 HD22 ASN 9 HD21 ASN 9 7.994 -9.061 -0.661
81 H GLY 10 H GLY 10 9.648 -3.823 2.036
82 HA2 GLY 10 HA2 GLY 10 10.524 -3.421 -0.726
83 HA3 GLY 10 HA3 GLY 10 11.109 -2.629 0.736
84 H LYS 11 H LYS 11 12.874 -3.196 -0.945
85 HA LYS 11 HA LYS 11 14.121 -5.803 -0.649
86 HB2 LYS 11 HB2 LYS 11 15.817 -4.963 -2.097
87 HB3 LYS 11 HB3 LYS 11 14.273 -4.433 -2.741
88 HG2 LYS 11 HG2 LYS 11 15.632 -2.486 -0.930
89 HG3 LYS 11 HG3 LYS 11 16.529 -2.854 -2.376
90 HD2 LYS 11 HD2 LYS 11 14.886 -1.878 -3.772
91 HD3 LYS 11 HD3 LYS 11 13.634 -2.034 -2.546
92 HE2 LYS 11 HE2 LYS 11 14.835 -0.419 -1.084
93 HE3 LYS 11 HE3 LYS 11 16.106 -0.239 -2.315
94 HZ1 LYS 11 HZ1 LYS 11 14.704 0.995 -3.633
95 HZ2 LYS 11 HZ2 LYS 11 13.353 0.347 -3.095
96 HZ3 LYS 11 HZ3 LYS 11 14.095 1.446 -2.138
97 H THR 12 H THR 12 14.198 -2.926 1.234
98 HA THR 12 HA THR 12 16.587 -3.921 2.740
99 HB THR 12 HB THR 12 15.917 -1.028 2.049
100 HG1 THR 12 HG1 THR 12 17.450 -1.085 0.558
101 HG21 THR 12 HG21 THR 12 18.276 -0.549 2.721
102 HG22 THR 12 HG22 THR 12 17.259 -1.067 4.060
103 HG23 THR 12 HG23 THR 12 18.409 -2.216 3.325
104 H LEU 13 H LEU 13 13.345 -2.439 2.872
105 HA LEU 13 HA LEU 13 13.293 -2.801 5.730
106 HB2 LEU 13 HB2 LEU 13 12.663 -0.573 6.291
107 HB3 LEU 13 HB3 LEU 13 14.189 -0.509 5.461
108 HG LEU 13 HG LEU 13 12.971 1.348 4.797
109 HD11 LEU 13 HD11 LEU 13 12.642 -0.497 2.419
110 HD12 LEU 13 HD12 LEU 13 12.758 1.269 2.412
111 HD13 LEU 13 HD13 LEU 13 14.155 0.314 2.915
112 HD21 LEU 13 HD21 LEU 13 10.781 1.508 3.970
113 HD22 LEU 13 HD22 LEU 13 10.578 -0.244 3.856
114 HD23 LEU 13 HD23 LEU 13 10.707 0.537 5.448
115 H LYS 14 H LYS 14 11.027 -2.304 6.535
116 HA LYS 14 HA LYS 14 8.936 -2.779 4.492
117 HB2 LYS 14 HB2 LYS 14 9.401 -4.434 7.012
118 HB3 LYS 14 HB3 LYS 14 7.923 -4.473 6.036
119 HG2 LYS 14 HG2 LYS 14 9.341 -5.034 4.016
120 HG3 LYS 14 HG3 LYS 14 10.727 -5.223 5.096
121 HD2 LYS 14 HD2 LYS 14 9.578 -6.995 6.321
122 HD3 LYS 14 HD3 LYS 14 8.117 -6.780 5.317
123 HE2 LYS 14 HE2 LYS 14 9.475 -7.309 3.298
124 HE3 LYS 14 HE3 LYS 14 10.885 -7.600 4.321
125 HZ1 LYS 14 HZ1 LYS 14 8.337 -9.108 4.525
126 HZ2 LYS 14 HZ2 LYS 14 9.643 -9.616 3.694
127 HZ3 LYS 14 HZ3 LYS 14 9.729 -9.442 5.327
128 H GLY 15 H GLY 15 6.674 -2.525 5.532
129 HA2 GLY 15 HA2 GLY 15 6.518 -0.694 7.792
130 HA3 GLY 15 HA3 GLY 15 6.152 0.046 6.227
131 H GLU 16 H GLU 16 4.196 -0.306 8.326
132 HA GLU 16 HA GLU 16 2.216 -1.893 6.829
133 HB2 GLU 16 HB2 GLU 16 3.357 -3.498 8.387
134 HB3 GLU 16 HB3 GLU 16 2.921 -2.460 9.745
135 HG2 GLU 16 HG2 GLU 16 0.488 -2.799 9.101
136 HG3 GLU 16 HG3 GLU 16 1.025 -3.957 7.889
137 H THR 17 H THR 17 0.547 -0.426 6.645
138 HA THR 17 HA THR 17 -0.308 1.128 9.022
139 HB THR 17 HB THR 17 -0.567 3.080 7.357
140 HG1 THR 17 HG1 THR 17 0.820 3.109 5.661
141 HG21 THR 17 HG21 THR 17 1.104 3.060 9.211
142 HG22 THR 17 HG22 THR 17 2.283 2.320 8.114
143 HG23 THR 17 HG23 THR 17 1.657 3.944 7.781
144 H THR 18 H THR 18 -2.564 2.216 8.473
145 HA THR 18 HA THR 18 -4.139 0.582 6.556
146 HB THR 18 HB THR 18 -5.894 0.383 8.414
147 HG1 THR 18 HG1 THR 18 -4.275 0.159 10.473
148 HG21 THR 18 HG21 THR 18 -3.378 -1.224 8.955
149 HG22 THR 18 HG22 THR 18 -5.046 -1.659 9.367
150 HG23 THR 18 HG23 THR 18 -4.559 -1.581 7.668
151 H THR 19 H THR 19 -5.784 1.832 5.603
152 HA THR 19 HA THR 19 -6.734 4.242 6.840
153 HB THR 19 HB THR 19 -4.938 4.401 4.415
154 HG1 THR 19 HG1 THR 19 -4.522 4.759 6.885
155 HG21 THR 19 HG21 THR 19 -5.583 6.809 4.254
156 HG22 THR 19 HG22 THR 19 -6.905 5.722 3.799
157 HG23 THR 19 HG23 THR 19 -6.910 6.494 5.393
158 H GLU 20 H GLU 20 -8.848 4.754 6.095
159 HA GLU 20 HA GLU 20 -9.986 2.817 4.164
160 HB2 GLU 20 HB2 GLU 20 -12.147 3.657 4.880
161 HB3 GLU 20 HB3 GLU 20 -11.281 2.919 6.210
162 HG2 GLU 20 HG2 GLU 20 -10.707 5.131 7.125
163 HG3 GLU 20 HG3 GLU 20 -11.438 5.932 5.732
164 H ALA 21 H ALA 21 -10.997 3.569 2.286
165 HA ALA 21 HA ALA 21 -10.974 6.462 1.713
166 HB1 ALA 21 HB1 ALA 21 -8.701 5.529 1.075
167 HB2 ALA 21 HB2 ALA 21 -9.527 4.485 -0.105
168 HB3 ALA 21 HB3 ALA 21 -9.634 6.259 -0.231
169 H VAL 22 H VAL 22 -12.063 6.856 -0.448
170 HA VAL 22 HA VAL 22 -14.506 5.443 -0.540
171 HB VAL 22 HB VAL 22 -14.308 7.732 -1.235
172 HG11 VAL 22 HG11 VAL 22 -13.367 8.464 -3.357
173 HG12 VAL 22 HG12 VAL 22 -12.113 7.774 -2.330
174 HG13 VAL 22 HG13 VAL 22 -12.763 6.836 -3.696
175 HG21 VAL 22 HG21 VAL 22 -15.238 5.973 -3.541
176 HG22 VAL 22 HG22 VAL 22 -16.188 6.426 -2.109
177 HG23 VAL 22 HG23 VAL 22 -15.678 7.663 -3.270
178 H ASP 23 H ASP 23 -11.500 4.995 -2.561
179 HA ASP 23 HA ASP 23 -12.342 2.294 -2.990
180 HB2 ASP 23 HB2 ASP 23 -13.352 3.951 -4.906
181 HB3 ASP 23 HB3 ASP 23 -11.791 3.536 -5.629
182 H ALA 24 H ALA 24 -10.623 1.171 -4.427
183 HA ALA 24 HA ALA 24 -8.172 1.272 -3.099
184 HB1 ALA 24 HB1 ALA 24 -7.380 -0.327 -4.686
185 HB2 ALA 24 HB2 ALA 24 -9.113 -0.639 -4.490
186 HB3 ALA 24 HB3 ALA 24 -8.519 0.208 -5.928
187 H ALA 25 H ALA 25 -9.062 2.858 -6.146
188 HA ALA 25 HA ALA 25 -6.588 3.810 -7.005
189 HB1 ALA 25 HB1 ALA 25 -8.692 4.032 -8.304
190 HB2 ALA 25 HB2 ALA 25 -9.322 5.178 -7.119
191 HB3 ALA 25 HB3 ALA 25 -7.912 5.608 -8.110
192 H THR 26 H THR 26 -8.666 5.104 -4.382
193 HA THR 26 HA THR 26 -7.095 7.552 -4.103
194 HB THR 26 HB THR 26 -9.101 6.213 -2.258
195 HG1 THR 26 HG1 THR 26 -9.800 8.455 -3.741
196 HG21 THR 26 HG21 THR 26 -7.701 7.903 -1.098
197 HG22 THR 26 HG22 THR 26 -8.112 9.106 -2.339
198 HG23 THR 26 HG23 THR 26 -9.360 8.442 -1.257
199 H ALA 27 H ALA 27 -7.500 4.430 -2.323
200 HA ALA 27 HA ALA 27 -5.691 4.884 -0.260
201 HB1 ALA 27 HB1 ALA 27 -6.280 2.249 -1.679
202 HB2 ALA 27 HB2 ALA 27 -5.576 2.438 -0.067
203 HB3 ALA 27 HB3 ALA 27 -7.239 2.968 -0.366
204 H GLU 28 H GLU 28 -5.050 3.426 -3.424
205 HA GLU 28 HA GLU 28 -2.340 2.856 -3.282
206 HB2 GLU 28 HB2 GLU 28 -3.909 2.151 -5.039
207 HB3 GLU 28 HB3 GLU 28 -4.142 3.823 -5.538
208 HG2 GLU 28 HG2 GLU 28 -1.679 3.870 -6.193
209 HG3 GLU 28 HG3 GLU 28 -1.654 2.120 -5.908
210 H LYS 29 H LYS 29 -3.815 5.883 -4.621
211 HA LYS 29 HA LYS 29 -1.202 7.095 -4.885
212 HB2 LYS 29 HB2 LYS 29 -3.997 8.205 -5.247
213 HB3 LYS 29 HB3 LYS 29 -2.512 9.145 -5.494
214 HG2 LYS 29 HG2 LYS 29 -1.701 7.435 -7.140
215 HG3 LYS 29 HG3 LYS 29 -3.204 6.531 -6.924
216 HD2 LYS 29 HD2 LYS 29 -3.387 7.786 -8.941
217 HD3 LYS 29 HD3 LYS 29 -4.482 8.491 -7.746
218 HE2 LYS 29 HE2 LYS 29 -2.691 10.243 -7.274
219 HE3 LYS 29 HE3 LYS 29 -1.740 9.538 -8.587
220 HZ1 LYS 29 HZ1 LYS 29 -3.619 10.023 -10.069
221 HZ2 LYS 29 HZ2 LYS 29 -4.422 10.758 -8.837
222 HZ3 LYS 29 HZ3 LYS 29 -2.983 11.372 -9.422
223 H VAL 30 H VAL 30 -3.601 7.207 -2.249
224 HA VAL 30 HA VAL 30 -2.449 9.570 -1.049
225 HB VAL 30 HB VAL 30 -4.258 7.344 -0.071
226 HG11 VAL 30 HG11 VAL 30 -4.576 8.699 2.030
227 HG12 VAL 30 HG12 VAL 30 -3.008 7.910 1.923
228 HG13 VAL 30 HG13 VAL 30 -3.145 9.645 1.567
229 HG21 VAL 30 HG21 VAL 30 -4.653 10.360 -0.374
230 HG22 VAL 30 HG22 VAL 30 -5.200 9.154 -1.553
231 HG23 VAL 30 HG23 VAL 30 -5.902 9.192 0.072
232 H PHE 31 H PHE 31 -2.072 6.017 -0.239
233 HA PHE 31 HA PHE 31 0.113 6.672 1.493
234 HB2 PHE 31 HB2 PHE 31 -1.075 4.125 0.462
235 HB3 PHE 31 HB3 PHE 31 0.535 4.061 1.149
236 HD1 PHE 31 HD2 PHE 31 0.481 5.943 3.454
237 HD2 PHE 31 HD1 PHE 31 -2.463 3.089 2.085
238 HE1 PHE 31 HE2 PHE 31 -0.341 5.698 5.745
239 HE2 PHE 31 HE1 PHE 31 -3.230 2.796 4.413
240 HZ PHE 31 HZ PHE 31 -2.200 4.125 6.251
241 H LYS 32 H LYS 32 0.116 6.576 -1.911
242 HA LYS 32 HA LYS 32 2.622 5.564 -2.629
243 HB2 LYS 32 HB2 LYS 32 0.800 6.573 -4.103
244 HB3 LYS 32 HB3 LYS 32 1.381 8.166 -3.615
245 HG2 LYS 32 HG2 LYS 32 3.615 7.565 -4.557
246 HG3 LYS 32 HG3 LYS 32 2.922 6.046 -5.157
247 HD2 LYS 32 HD2 LYS 32 1.260 7.344 -6.491
248 HD3 LYS 32 HD3 LYS 32 1.954 8.856 -5.866
249 HE2 LYS 32 HE2 LYS 32 4.192 8.096 -6.834
250 HE3 LYS 32 HE3 LYS 32 3.319 6.788 -7.633
251 HZ1 LYS 32 HZ1 LYS 32 1.968 8.517 -8.727
252 HZ2 LYS 32 HZ2 LYS 32 2.899 9.695 -8.052
253 HZ3 LYS 32 HZ3 LYS 32 3.569 8.630 -9.098
254 H GLN 33 H GLN 33 1.779 8.687 -1.213
255 HA GLN 33 HA GLN 33 4.220 10.047 -1.310
256 HB2 GLN 33 HB2 GLN 33 2.125 10.083 0.928
257 HB3 GLN 33 HB3 GLN 33 3.337 11.323 0.603
258 HG2 GLN 33 HG2 GLN 33 2.294 11.651 -1.650
259 HG3 GLN 33 HG3 GLN 33 0.961 10.596 -1.157
260 HE21 GLN 33 HE22 GLN 33 0.984 11.710 1.741
261 HE22 GLN 33 HE21 GLN 33 0.507 13.383 1.544
262 H TYR 34 H TYR 34 2.939 8.132 1.420
263 HA TYR 34 HA TYR 34 5.304 8.178 2.989
264 HB2 TYR 34 HB2 TYR 34 3.569 7.776 4.338
265 HB3 TYR 34 HB3 TYR 34 2.585 7.060 3.085
266 HD1 TYR 34 HD2 TYR 34 5.199 6.296 5.643
267 HD2 TYR 34 HD1 TYR 34 2.406 4.686 2.775
268 HE1 TYR 34 HE2 TYR 34 5.419 4.053 6.682
269 HE2 TYR 34 HE1 TYR 34 2.588 2.471 3.835
270 HH TYR 34 HH TYR 34 3.276 1.377 5.830
271 H ALA 35 H ALA 35 4.058 5.734 0.659
272 HA ALA 35 HA ALA 35 5.859 3.682 1.319
273 HB1 ALA 35 HB1 ALA 35 5.387 2.884 -1.016
274 HB2 ALA 35 HB2 ALA 35 3.908 3.360 -0.145
275 HB3 ALA 35 HB3 ALA 35 4.618 4.438 -1.364
276 H ASN 36 H ASN 36 6.180 6.063 -1.377
277 HA ASN 36 HA ASN 36 8.870 5.271 -1.885
278 HB2 ASN 36 HB2 ASN 36 7.439 6.395 -3.540
279 HB3 ASN 36 HB3 ASN 36 7.548 7.913 -2.626
280 HD21 ASN 36 HD22 ASN 36 8.960 9.229 -3.906
281 HD22 ASN 36 HD21 ASN 36 10.505 8.633 -4.511
282 H ASP 37 H ASP 37 7.498 7.674 0.337
283 HA ASP 37 HA ASP 37 9.921 9.114 0.839
284 HB2 ASP 37 HB2 ASP 37 7.733 9.977 1.509
285 HB3 ASP 37 HB3 ASP 37 7.528 8.643 2.650
286 H ASN 38 H ASN 38 8.521 6.147 2.211
287 HA ASN 38 HA ASN 38 10.552 5.925 4.256
288 HB2 ASN 38 HB2 ASN 38 8.140 5.028 4.311
289 HB3 ASN 38 HB3 ASN 38 8.744 3.709 3.298
290 HD21 ASN 38 HD22 ASN 38 8.150 2.279 5.119
291 HD22 ASN 38 HD21 ASN 38 9.256 2.120 6.465
292 H GLY 39 H GLY 39 10.540 5.272 0.894
293 HA2 GLY 39 HA2 GLY 39 12.581 4.806 -0.231
294 HA3 GLY 39 HA3 GLY 39 13.124 3.812 1.118
295 H VAL 40 H VAL 40 9.764 3.406 -0.119
296 HA VAL 40 HA VAL 40 10.659 0.946 -1.496
297 HB VAL 40 HB VAL 40 8.138 1.156 0.136
298 HG11 VAL 40 HG11 VAL 40 9.650 -1.200 -1.090
299 HG12 VAL 40 HG12 VAL 40 8.215 -1.357 -0.062
300 HG13 VAL 40 HG13 VAL 40 8.095 -0.553 -1.628
301 HG21 VAL 40 HG21 VAL 40 9.270 -0.335 1.811
302 HG22 VAL 40 HG22 VAL 40 10.806 -0.007 1.014
303 HG23 VAL 40 HG23 VAL 40 9.903 1.317 1.773
304 H ASP 41 H ASP 41 10.171 1.013 -3.572
305 HA ASP 41 HA ASP 41 7.522 1.923 -4.431
306 HB2 ASP 41 HB2 ASP 41 8.881 4.003 -4.598
307 HB3 ASP 41 HB3 ASP 41 10.035 3.158 -5.644
308 H GLY 42 H GLY 42 7.079 -0.132 -4.987
309 HA2 GLY 42 HA2 GLY 42 8.772 -1.507 -7.006
310 HA3 GLY 42 HA3 GLY 42 8.195 -2.351 -5.555
311 H GLU 43 H GLU 43 7.016 -3.814 -6.905
312 HA GLU 43 HA GLU 43 4.905 -2.747 -8.623
313 HB2 GLU 43 HB2 GLU 43 6.324 -4.770 -9.184
314 HB3 GLU 43 HB3 GLU 43 5.494 -5.645 -7.899
315 HG2 GLU 43 HG2 GLU 43 4.501 -6.125 -10.088
316 HG3 GLU 43 HG3 GLU 43 3.331 -5.302 -9.052
317 H TRP 44 H TRP 44 3.065 -2.049 -7.732
318 HA TRP 44 HA TRP 44 2.271 -2.789 -5.017
319 HB2 TRP 44 HB2 TRP 44 0.993 -1.046 -7.146
320 HB3 TRP 44 HB3 TRP 44 0.369 -1.253 -5.521
321 HD1 TRP 44 HD1 TRP 44 3.785 -0.137 -6.936
322 HE1 TRP 44 HE1 TRP 44 4.665 1.842 -5.581
323 HE3 TRP 44 HE3 TRP 44 -0.251 0.576 -3.918
324 HZ2 TRP 44 HZ2 TRP 44 3.824 3.356 -3.274
325 HZ3 TRP 44 HZ3 TRP 44 -0.196 2.327 -2.139
326 HH2 TRP 44 HH2 TRP 44 1.851 3.652 -1.758
327 H THR 45 H THR 45 0.648 -4.322 -4.561
328 HA THR 45 HA THR 45 -1.063 -5.353 -6.745
329 HB THR 45 HB THR 45 0.761 -7.077 -5.007
330 HG1 THR 45 HG1 THR 45 0.981 -6.000 -7.557
331 HG21 THR 45 HG21 THR 45 -1.100 -7.875 -7.277
332 HG22 THR 45 HG22 THR 45 0.044 -8.942 -6.449
333 HG23 THR 45 HG23 THR 45 -1.327 -8.260 -5.557
334 H TYR 46 H TYR 46 -3.114 -5.469 -5.975
335 HA TYR 46 HA TYR 46 -3.518 -5.401 -3.035
336 HB2 TYR 46 HB2 TYR 46 -5.573 -4.335 -3.355
337 HB3 TYR 46 HB3 TYR 46 -4.415 -3.471 -4.331
338 HD1 TYR 46 HD2 TYR 46 -7.326 -5.757 -4.400
339 HD2 TYR 46 HD1 TYR 46 -4.587 -3.402 -6.772
340 HE1 TYR 46 HE2 TYR 46 -8.719 -6.163 -6.398
341 HE2 TYR 46 HE1 TYR 46 -6.001 -3.763 -8.767
342 HH TYR 46 HH TYR 46 -8.928 -5.855 -8.690
343 H ASP 47 H ASP 47 -5.028 -6.674 -2.067
344 HA ASP 47 HA ASP 47 -6.140 -9.012 -3.544
345 HB2 ASP 47 HB2 ASP 47 -4.043 -9.657 -2.371
346 HB3 ASP 47 HB3 ASP 47 -4.730 -9.102 -0.856
347 H ASP 48 H ASP 48 -8.129 -8.055 -3.558
348 HA ASP 48 HA ASP 48 -9.213 -6.518 -1.433
349 HB2 ASP 48 HB2 ASP 48 -10.679 -5.963 -2.971
350 HB3 ASP 48 HB3 ASP 48 -9.912 -7.069 -4.094
351 H ALA 49 H ALA 49 -8.953 -9.977 -1.694
352 HA ALA 49 HA ALA 49 -11.227 -10.607 -0.028
353 HB1 ALA 49 HB1 ALA 49 -8.703 -12.203 -0.602
354 HB2 ALA 49 HB2 ALA 49 -10.189 -12.824 0.142
355 HB3 ALA 49 HB3 ALA 49 -10.206 -12.247 -1.538
356 H THR 50 H THR 50 -7.656 -10.483 0.619
357 HA THR 50 HA THR 50 -8.096 -10.548 3.522
358 HB THR 50 HB THR 50 -5.627 -10.184 3.597
359 HG1 THR 50 HG1 THR 50 -5.775 -10.474 0.771
360 HG21 THR 50 HG21 THR 50 -6.519 -12.457 3.600
361 HG22 THR 50 HG22 THR 50 -6.551 -12.480 1.827
362 HG23 THR 50 HG23 THR 50 -5.002 -12.372 2.687
363 H LYS 51 H LYS 51 -8.169 -8.124 1.128
364 HA LYS 51 HA LYS 51 -8.395 -5.924 1.125
365 HB2 LYS 51 HB2 LYS 51 -8.797 -5.993 4.144
366 HB3 LYS 51 HB3 LYS 51 -9.186 -4.671 3.041
367 HG2 LYS 51 HG2 LYS 51 -10.826 -6.125 1.865
368 HG3 LYS 51 HG3 LYS 51 -10.483 -7.432 3.008
369 HD2 LYS 51 HD2 LYS 51 -11.271 -6.039 4.878
370 HD3 LYS 51 HD3 LYS 51 -11.585 -4.690 3.757
371 HE2 LYS 51 HE2 LYS 51 -13.208 -6.045 2.519
372 HE3 LYS 51 HE3 LYS 51 -12.863 -7.459 3.528
373 HZ1 LYS 51 HZ1 LYS 51 -14.039 -4.915 4.496
374 HZ2 LYS 51 HZ2 LYS 51 -14.877 -6.277 4.213
375 HZ3 LYS 51 HZ3 LYS 51 -13.756 -6.223 5.430
376 H THR 52 H THR 52 -5.924 -6.988 0.919
377 HA THR 52 HA THR 52 -4.188 -5.080 2.416
378 HB THR 52 HB THR 52 -2.374 -6.697 2.052
379 HG1 THR 52 HG1 THR 52 -4.224 -8.697 1.359
380 HG21 THR 52 HG21 THR 52 -3.460 -6.907 4.183
381 HG22 THR 52 HG22 THR 52 -4.768 -7.896 3.504
382 HG23 THR 52 HG23 THR 52 -3.120 -8.527 3.578
383 H PHE 53 H PHE 53 -2.425 -4.151 1.273
384 HA PHE 53 HA PHE 53 -2.478 -4.301 -1.654
385 HB2 PHE 53 HB2 PHE 53 -3.915 -2.335 -0.513
386 HB3 PHE 53 HB3 PHE 53 -2.357 -1.572 -0.398
387 HD1 PHE 53 HD2 PHE 53 -1.341 -2.836 -3.210
388 HD2 PHE 53 HD1 PHE 53 -4.902 -0.728 -1.945
389 HE1 PHE 53 HE2 PHE 53 -1.684 -1.989 -5.512
390 HE2 PHE 53 HE1 PHE 53 -5.151 0.194 -4.230
391 HZ PHE 53 HZ PHE 53 -3.518 -0.434 -6.015
392 H THR 54 H THR 54 -0.568 -5.263 -1.742
393 HA THR 54 HA THR 54 1.623 -4.635 0.084
394 HB THR 54 HB THR 54 1.393 -6.768 -2.077
395 HG1 THR 54 HG1 THR 54 0.775 -8.116 -0.336
396 HG21 THR 54 HG21 THR 54 2.992 -6.709 0.521
397 HG22 THR 54 HG22 THR 54 3.007 -7.988 -0.699
398 HG23 THR 54 HG23 THR 54 3.669 -6.397 -1.088
399 H VAL 55 H VAL 55 3.576 -3.753 -0.594
400 HA VAL 55 HA VAL 55 3.862 -2.961 -3.459
401 HB VAL 55 HB VAL 55 4.994 -1.487 -1.024
402 HG11 VAL 55 HG11 VAL 55 6.310 -1.268 -3.102
403 HG12 VAL 55 HG12 VAL 55 4.855 -0.786 -3.993
404 HG13 VAL 55 HG13 VAL 55 5.508 0.261 -2.712
405 HG21 VAL 55 HG21 VAL 55 2.542 -0.863 -2.693
406 HG22 VAL 55 HG22 VAL 55 2.623 -1.139 -0.931
407 HG23 VAL 55 HG23 VAL 55 3.346 0.315 -1.627
408 H THR 56 H THR 56 5.131 -4.684 -4.163
409 HA THR 56 HA THR 56 7.284 -5.658 -2.370
410 HB THR 56 HB THR 56 5.959 -7.043 -4.706
411 HG1 THR 56 HG1 THR 56 4.592 -7.063 -3.115
412 HG21 THR 56 HG21 THR 56 7.174 -9.044 -3.625
413 HG22 THR 56 HG22 THR 56 8.149 -7.931 -4.603
414 HG23 THR 56 HG23 THR 56 8.227 -7.839 -2.847
415 H GLU 57 H GLU 57 9.219 -4.786 -2.759
416 HA GLU 57 HA GLU 57 9.951 -4.056 -5.554
417 HB2 GLU 57 HB2 GLU 57 9.623 -2.167 -3.846
418 HB3 GLU 57 HB3 GLU 57 11.002 -2.850 -2.973
419 HG2 GLU 57 HG2 GLU 57 12.380 -2.618 -5.077
420 HG3 GLU 57 HG3 GLU 57 11.001 -1.855 -5.868
Start of MODEL 14
1 H1 MET 1 H MET 1 -17.755 3.094 3.325
2 HA MET 1 HA MET 1 -15.718 2.849 2.023
3 HB2 MET 1 HB2 MET 1 -15.930 4.691 3.718
4 HB3 MET 1 HB3 MET 1 -14.977 3.697 4.839
5 HG2 MET 1 HG2 MET 1 -13.102 3.669 3.351
6 HG3 MET 1 HG3 MET 1 -14.064 4.314 2.017
7 HE1 MET 1 HE1 MET 1 -14.290 8.015 2.528
8 HE2 MET 1 HE2 MET 1 -14.319 6.663 1.376
9 HE3 MET 1 HE3 MET 1 -15.527 6.752 2.684
10 H GLY 2 H GLY 2 -13.727 1.799 1.640
11 HA2 GLY 2 HA2 GLY 2 -13.444 -0.814 2.905
12 HA3 GLY 2 HA3 GLY 2 -12.662 -0.156 1.464
13 H THR 3 H THR 3 -11.936 -1.111 4.553
14 HA THR 3 HA THR 3 -9.890 0.992 4.994
15 HB THR 3 HB THR 3 -10.779 -1.373 6.681
16 HG1 THR 3 HG1 THR 3 -11.730 0.333 7.863
17 HG21 THR 3 HG21 THR 3 -8.382 -0.749 7.097
18 HG22 THR 3 HG22 THR 3 -8.883 0.941 7.342
19 HG23 THR 3 HG23 THR 3 -9.419 -0.333 8.463
20 H TYR 4 H TYR 4 -8.202 0.729 3.644
21 HA TYR 4 HA TYR 4 -7.410 -1.965 2.787
22 HB2 TYR 4 HB2 TYR 4 -6.626 0.851 1.960
23 HB3 TYR 4 HB3 TYR 4 -5.746 -0.570 1.428
24 HD1 TYR 4 HD2 TYR 4 -9.029 1.187 1.192
25 HD2 TYR 4 HD1 TYR 4 -6.606 -2.114 -0.195
26 HE1 TYR 4 HE2 TYR 4 -10.623 0.799 -0.657
27 HE2 TYR 4 HE1 TYR 4 -8.171 -2.473 -2.072
28 HH TYR 4 HH TYR 4 -11.305 -0.868 -2.291
29 H LYS 5 H LYS 5 -5.786 -2.973 3.503
30 HA LYS 5 HA LYS 5 -4.137 -1.937 5.720
31 HB2 LYS 5 HB2 LYS 5 -5.475 -4.108 5.805
32 HB3 LYS 5 HB3 LYS 5 -4.401 -4.754 4.551
33 HG2 LYS 5 HG2 LYS 5 -2.458 -4.271 6.066
34 HG3 LYS 5 HG3 LYS 5 -3.619 -3.687 7.278
35 HD2 LYS 5 HD2 LYS 5 -4.552 -5.852 7.624
36 HD3 LYS 5 HD3 LYS 5 -3.791 -6.500 6.163
37 HE2 LYS 5 HE2 LYS 5 -2.531 -7.256 8.080
38 HE3 LYS 5 HE3 LYS 5 -1.558 -6.163 7.112
39 HZ1 LYS 5 HZ1 LYS 5 -1.312 -5.668 9.423
40 HZ2 LYS 5 HZ2 LYS 5 -2.050 -4.396 8.692
41 HZ3 LYS 5 HZ3 LYS 5 -2.924 -5.406 9.633
42 H LEU 6 H LEU 6 -2.256 -0.964 5.085
43 HA LEU 6 HA LEU 6 -1.105 -1.517 2.430
44 HB2 LEU 6 HB2 LEU 6 -1.512 0.800 3.700
45 HB3 LEU 6 HB3 LEU 6 -0.031 0.379 4.527
46 HG LEU 6 HG LEU 6 -0.488 1.012 1.608
47 HD11 LEU 6 HD11 LEU 6 1.216 2.718 2.038
48 HD12 LEU 6 HD12 LEU 6 0.021 2.795 3.355
49 HD13 LEU 6 HD13 LEU 6 1.565 1.981 3.616
50 HD21 LEU 6 HD21 LEU 6 1.905 0.592 1.141
51 HD22 LEU 6 HD22 LEU 6 2.027 -0.270 2.698
52 HD23 LEU 6 HD23 LEU 6 0.988 -0.872 1.388
53 H ILE 7 H ILE 7 0.845 -2.683 2.218
54 HA ILE 7 HA ILE 7 2.484 -3.191 4.614
55 HB ILE 7 HB ILE 7 1.676 -5.378 2.663
56 HG12 ILE 7 HG12 ILE 7 1.058 -6.430 5.068
57 HG13 ILE 7 HG13 ILE 7 0.776 -4.744 5.470
58 HG21 ILE 7 HG21 ILE 7 3.082 -6.799 4.169
59 HG22 ILE 7 HG22 ILE 7 4.033 -5.556 3.357
60 HG23 ILE 7 HG23 ILE 7 3.573 -5.345 5.062
61 HD11 ILE 7 HD11 ILE 7 -0.846 -4.628 3.544
62 HD12 ILE 7 HD12 ILE 7 -0.510 -6.333 3.199
63 HD13 ILE 7 HD13 ILE 7 -1.273 -5.876 4.731
64 H LEU 8 H LEU 8 4.475 -2.610 4.206
65 HA LEU 8 HA LEU 8 5.375 -1.808 1.470
66 HB2 LEU 8 HB2 LEU 8 5.855 -0.901 4.293
67 HB3 LEU 8 HB3 LEU 8 7.298 -1.034 3.323
68 HG LEU 8 HG LEU 8 6.477 0.596 1.724
69 HD11 LEU 8 HD11 LEU 8 4.110 0.195 1.774
70 HD12 LEU 8 HD12 LEU 8 4.001 0.727 3.475
71 HD13 LEU 8 HD13 LEU 8 4.415 1.885 2.183
72 HD21 LEU 8 HD21 LEU 8 7.733 1.377 3.686
73 HD22 LEU 8 HD22 LEU 8 6.470 2.559 3.322
74 HD23 LEU 8 HD23 LEU 8 6.261 1.422 4.660
75 H ASN 9 H ASN 9 6.679 -3.423 0.499
76 HA ASN 9 HA ASN 9 8.401 -5.043 2.305
77 HB2 ASN 9 HB2 ASN 9 6.427 -6.340 1.507
78 HB3 ASN 9 HB3 ASN 9 6.948 -6.070 -0.157
79 HD21 ASN 9 HD22 ASN 9 9.571 -6.610 -0.339
80 HD22 ASN 9 HD21 ASN 9 9.902 -8.207 0.264
81 H GLY 10 H GLY 10 9.948 -3.346 1.942
82 HA2 GLY 10 HA2 GLY 10 10.849 -2.773 -0.779
83 HA3 GLY 10 HA3 GLY 10 11.400 -2.037 0.733
84 H LYS 11 H LYS 11 13.486 -2.360 -0.347
85 HA LYS 11 HA LYS 11 14.577 -5.139 -0.222
86 HB2 LYS 11 HB2 LYS 11 16.471 -4.293 -1.501
87 HB3 LYS 11 HB3 LYS 11 14.977 -4.048 -2.375
88 HG2 LYS 11 HG2 LYS 11 15.876 -1.710 -0.692
89 HG3 LYS 11 HG3 LYS 11 16.943 -2.150 -2.027
90 HD2 LYS 11 HD2 LYS 11 15.184 -1.918 -3.642
91 HD3 LYS 11 HD3 LYS 11 13.953 -1.716 -2.376
92 HE2 LYS 11 HE2 LYS 11 14.855 0.413 -1.701
93 HE3 LYS 11 HE3 LYS 11 16.293 0.205 -2.729
94 HZ1 LYS 11 HZ1 LYS 11 13.818 0.021 -4.160
95 HZ2 LYS 11 HZ2 LYS 11 14.090 1.513 -3.510
96 HZ3 LYS 11 HZ3 LYS 11 15.185 0.853 -4.520
97 H THR 12 H THR 12 14.610 -2.137 1.439
98 HA THR 12 HA THR 12 17.037 -2.968 2.987
99 HB THR 12 HB THR 12 15.827 -0.252 2.341
100 HG1 THR 12 HG1 THR 12 17.442 -0.086 0.975
101 HG21 THR 12 HG21 THR 12 18.247 -0.904 4.060
102 HG22 THR 12 HG22 THR 12 17.886 0.706 3.386
103 HG23 THR 12 HG23 THR 12 16.779 -0.023 4.549
104 H LEU 13 H LEU 13 13.626 -1.946 3.194
105 HA LEU 13 HA LEU 13 13.477 -2.857 5.924
106 HB2 LEU 13 HB2 LEU 13 12.578 -0.844 6.838
107 HB3 LEU 13 HB3 LEU 13 14.113 -0.464 6.116
108 HG LEU 13 HG LEU 13 12.748 1.357 5.686
109 HD11 LEU 13 HD11 LEU 13 12.585 -0.191 3.078
110 HD12 LEU 13 HD12 LEU 13 12.532 1.554 3.277
111 HD13 LEU 13 HD13 LEU 13 14.021 0.691 3.682
112 HD21 LEU 13 HD21 LEU 13 10.547 1.448 4.866
113 HD22 LEU 13 HD22 LEU 13 10.515 -0.265 4.433
114 HD23 LEU 13 HD23 LEU 13 10.543 0.215 6.134
115 H LYS 14 H LYS 14 11.152 -2.789 6.645
116 HA LYS 14 HA LYS 14 9.185 -3.006 4.456
117 HB2 LYS 14 HB2 LYS 14 9.536 -5.022 6.722
118 HB3 LYS 14 HB3 LYS 14 8.220 -5.001 5.544
119 HG2 LYS 14 HG2 LYS 14 10.110 -5.114 3.736
120 HG3 LYS 14 HG3 LYS 14 11.159 -5.594 5.071
121 HD2 LYS 14 HD2 LYS 14 9.575 -7.503 5.549
122 HD3 LYS 14 HD3 LYS 14 8.643 -7.014 4.111
123 HE2 LYS 14 HE2 LYS 14 10.801 -7.225 2.772
124 HE3 LYS 14 HE3 LYS 14 11.558 -7.908 4.211
125 HZ1 LYS 14 HZ1 LYS 14 10.799 -9.620 2.722
126 HZ2 LYS 14 HZ2 LYS 14 9.901 -9.717 4.100
127 HZ3 LYS 14 HZ3 LYS 14 9.254 -9.041 2.752
128 H GLY 15 H GLY 15 6.902 -2.845 5.393
129 HA2 GLY 15 HA2 GLY 15 6.676 -1.547 8.011
130 HA3 GLY 15 HA3 GLY 15 6.387 -0.500 6.619
131 H GLU 16 H GLU 16 4.313 -0.861 8.367
132 HA GLU 16 HA GLU 16 2.307 -2.188 6.694
133 HB2 GLU 16 HB2 GLU 16 3.156 -4.043 8.066
134 HB3 GLU 16 HB3 GLU 16 2.976 -3.082 9.530
135 HG2 GLU 16 HG2 GLU 16 0.528 -2.953 9.059
136 HG3 GLU 16 HG3 GLU 16 0.745 -4.082 7.723
137 H THR 17 H THR 17 0.687 -0.612 6.595
138 HA THR 17 HA THR 17 -0.069 0.907 9.029
139 HB THR 17 HB THR 17 -0.209 2.934 7.362
140 HG1 THR 17 HG1 THR 17 1.712 2.834 6.017
141 HG21 THR 17 HG21 THR 17 1.265 2.790 9.381
142 HG22 THR 17 HG22 THR 17 2.511 2.023 8.382
143 HG23 THR 17 HG23 THR 17 1.993 3.689 8.045
144 H THR 18 H THR 18 -2.203 2.348 8.308
145 HA THR 18 HA THR 18 -3.951 0.653 6.593
146 HB THR 18 HB THR 18 -5.724 1.104 8.446
147 HG1 THR 18 HG1 THR 18 -4.451 2.448 9.795
148 HG21 THR 18 HG21 THR 18 -3.564 -0.878 9.197
149 HG22 THR 18 HG22 THR 18 -5.288 -0.943 9.602
150 HG23 THR 18 HG23 THR 18 -4.774 -1.168 7.914
151 H THR 19 H THR 19 -5.469 1.872 5.396
152 HA THR 19 HA THR 19 -6.133 4.551 6.275
153 HB THR 19 HB THR 19 -4.834 4.299 3.547
154 HG1 THR 19 HG1 THR 19 -3.793 4.693 6.054
155 HG21 THR 19 HG21 THR 19 -6.504 6.123 3.794
156 HG22 THR 19 HG22 THR 19 -5.603 6.733 5.201
157 HG23 THR 19 HG23 THR 19 -4.854 6.736 3.596
158 H GLU 20 H GLU 20 -8.268 5.067 5.579
159 HA GLU 20 HA GLU 20 -9.600 2.895 4.123
160 HB2 GLU 20 HB2 GLU 20 -11.660 3.816 5.094
161 HB3 GLU 20 HB3 GLU 20 -10.470 3.284 6.271
162 HG2 GLU 20 HG2 GLU 20 -9.768 5.693 6.595
163 HG3 GLU 20 HG3 GLU 20 -11.093 6.165 5.530
164 H ALA 21 H ALA 21 -10.833 3.160 2.299
165 HA ALA 21 HA ALA 21 -11.157 5.746 1.023
166 HB1 ALA 21 HB1 ALA 21 -8.861 5.208 0.306
167 HB2 ALA 21 HB2 ALA 21 -9.361 3.557 -0.143
168 HB3 ALA 21 HB3 ALA 21 -9.978 4.942 -1.049
169 H VAL 22 H VAL 22 -12.448 5.544 -0.978
170 HA VAL 22 HA VAL 22 -14.517 3.545 -0.649
171 HB VAL 22 HB VAL 22 -15.047 5.794 -1.370
172 HG11 VAL 22 HG11 VAL 22 -14.524 6.668 -3.594
173 HG12 VAL 22 HG12 VAL 22 -13.016 6.301 -2.747
174 HG13 VAL 22 HG13 VAL 22 -13.625 5.212 -4.005
175 HG21 VAL 22 HG21 VAL 22 -15.693 3.829 -3.606
176 HG22 VAL 22 HG22 VAL 22 -16.544 3.930 -2.053
177 HG23 VAL 22 HG23 VAL 22 -16.591 5.295 -3.181
178 H ASP 23 H ASP 23 -11.735 3.977 -2.933
179 HA ASP 23 HA ASP 23 -12.042 1.157 -3.763
180 HB2 ASP 23 HB2 ASP 23 -11.858 3.609 -5.566
181 HB3 ASP 23 HB3 ASP 23 -11.460 1.983 -6.114
182 H ALA 24 H ALA 24 -10.116 0.354 -4.743
183 HA ALA 24 HA ALA 24 -7.774 0.915 -3.320
184 HB1 ALA 24 HB1 ALA 24 -6.689 -0.580 -4.995
185 HB2 ALA 24 HB2 ALA 24 -8.225 -1.240 -4.400
186 HB3 ALA 24 HB3 ALA 24 -8.150 -0.467 -5.994
187 H ALA 25 H ALA 25 -8.923 2.383 -6.347
188 HA ALA 25 HA ALA 25 -6.473 3.400 -7.266
189 HB1 ALA 25 HB1 ALA 25 -8.534 3.447 -8.586
190 HB2 ALA 25 HB2 ALA 25 -9.245 4.645 -7.482
191 HB3 ALA 25 HB3 ALA 25 -7.827 5.071 -8.478
192 H THR 26 H THR 26 -8.729 4.843 -4.827
193 HA THR 26 HA THR 26 -7.149 7.254 -4.526
194 HB THR 26 HB THR 26 -9.133 5.933 -2.647
195 HG1 THR 26 HG1 THR 26 -9.582 7.871 -4.667
196 HG21 THR 26 HG21 THR 26 -7.820 7.738 -1.552
197 HG22 THR 26 HG22 THR 26 -8.311 8.862 -2.833
198 HG23 THR 26 HG23 THR 26 -9.513 8.173 -1.718
199 H ALA 27 H ALA 27 -7.323 4.043 -2.965
200 HA ALA 27 HA ALA 27 -5.628 4.534 -0.765
201 HB1 ALA 27 HB1 ALA 27 -5.918 1.899 -2.273
202 HB2 ALA 27 HB2 ALA 27 -5.460 2.140 -0.590
203 HB3 ALA 27 HB3 ALA 27 -7.107 2.517 -1.101
204 H GLU 28 H GLU 28 -4.842 3.190 -3.990
205 HA GLU 28 HA GLU 28 -2.115 2.866 -3.832
206 HB2 GLU 28 HB2 GLU 28 -3.637 2.203 -5.706
207 HB3 GLU 28 HB3 GLU 28 -3.759 3.877 -6.201
208 HG2 GLU 28 HG2 GLU 28 -1.332 3.938 -6.665
209 HG3 GLU 28 HG3 GLU 28 -1.185 2.252 -6.125
210 H LYS 29 H LYS 29 -3.825 5.799 -4.975
211 HA LYS 29 HA LYS 29 -1.625 7.467 -5.433
212 HB2 LYS 29 HB2 LYS 29 -3.951 7.900 -6.158
213 HB3 LYS 29 HB3 LYS 29 -4.435 8.156 -4.478
214 HG2 LYS 29 HG2 LYS 29 -2.767 10.099 -4.398
215 HG3 LYS 29 HG3 LYS 29 -2.527 9.856 -6.134
216 HD2 LYS 29 HD2 LYS 29 -4.092 11.608 -5.907
217 HD3 LYS 29 HD3 LYS 29 -5.034 10.186 -6.383
218 HE2 LYS 29 HE2 LYS 29 -5.739 9.845 -4.038
219 HE3 LYS 29 HE3 LYS 29 -4.706 11.190 -3.521
220 HZ1 LYS 29 HZ1 LYS 29 -6.050 12.659 -4.874
221 HZ2 LYS 29 HZ2 LYS 29 -7.054 11.448 -5.308
222 HZ3 LYS 29 HZ3 LYS 29 -6.946 11.941 -3.724
223 H VAL 30 H VAL 30 -3.584 7.217 -2.408
224 HA VAL 30 HA VAL 30 -2.033 9.166 -0.978
225 HB VAL 30 HB VAL 30 -3.977 6.979 -0.150
226 HG11 VAL 30 HG11 VAL 30 -4.086 8.258 2.057
227 HG12 VAL 30 HG12 VAL 30 -2.637 7.268 1.815
228 HG13 VAL 30 HG13 VAL 30 -2.553 9.022 1.583
229 HG21 VAL 30 HG21 VAL 30 -4.208 10.025 -0.254
230 HG22 VAL 30 HG22 VAL 30 -4.899 8.908 -1.448
231 HG23 VAL 30 HG23 VAL 30 -5.491 8.895 0.212
232 H PHE 31 H PHE 31 -1.998 5.550 -0.832
233 HA PHE 31 HA PHE 31 0.104 5.244 0.957
234 HB2 PHE 31 HB2 PHE 31 -0.724 3.575 -1.438
235 HB3 PHE 31 HB3 PHE 31 0.369 3.024 -0.171
236 HD1 PHE 31 HD2 PHE 31 -1.435 4.363 2.165
237 HD2 PHE 31 HD1 PHE 31 -2.114 1.604 -1.094
238 HE1 PHE 31 HE2 PHE 31 -3.030 3.111 3.534
239 HE2 PHE 31 HE1 PHE 31 -3.816 0.443 0.260
240 HZ PHE 31 HZ PHE 31 -4.266 1.176 2.605
241 H LYS 32 H LYS 32 0.301 6.037 -2.482
242 HA LYS 32 HA LYS 32 2.934 5.388 -3.078
243 HB2 LYS 32 HB2 LYS 32 0.964 6.495 -4.458
244 HB3 LYS 32 HB3 LYS 32 1.726 8.013 -4.009
245 HG2 LYS 32 HG2 LYS 32 3.764 7.398 -5.133
246 HG3 LYS 32 HG3 LYS 32 3.230 5.711 -5.326
247 HD2 LYS 32 HD2 LYS 32 1.268 6.643 -6.706
248 HD3 LYS 32 HD3 LYS 32 2.140 8.178 -6.732
249 HE2 LYS 32 HE2 LYS 32 3.054 5.479 -7.786
250 HE3 LYS 32 HE3 LYS 32 2.549 6.857 -8.765
251 HZ1 LYS 32 HZ1 LYS 32 4.961 6.715 -7.067
252 HZ2 LYS 32 HZ2 LYS 32 4.947 6.658 -8.688
253 HZ3 LYS 32 HZ3 LYS 32 4.501 8.054 -7.913
254 H GLN 33 H GLN 33 1.744 8.097 -1.148
255 HA GLN 33 HA GLN 33 4.219 9.587 -1.106
256 HB2 GLN 33 HB2 GLN 33 1.863 9.662 0.843
257 HB3 GLN 33 HB3 GLN 33 3.152 10.858 0.689
258 HG2 GLN 33 HG2 GLN 33 2.416 11.231 -1.711
259 HG3 GLN 33 HG3 GLN 33 1.021 10.192 -1.389
260 HE21 GLN 33 HE22 GLN 33 0.004 11.046 1.113
261 HE22 GLN 33 HE21 GLN 33 -0.289 12.763 1.001
262 H TYR 34 H TYR 34 2.588 7.458 1.316
263 HA TYR 34 HA TYR 34 4.665 7.520 3.223
264 HB2 TYR 34 HB2 TYR 34 2.380 6.694 3.701
265 HB3 TYR 34 HB3 TYR 34 2.658 5.305 2.666
266 HD1 TYR 34 HD2 TYR 34 4.444 7.023 5.549
267 HD2 TYR 34 HD1 TYR 34 3.230 3.305 3.756
268 HE1 TYR 34 HE2 TYR 34 5.381 5.807 7.459
269 HE2 TYR 34 HE1 TYR 34 4.101 2.060 5.720
270 HH TYR 34 HH TYR 34 5.073 2.263 7.932
271 H ALA 35 H ALA 35 4.126 5.104 0.594
272 HA ALA 35 HA ALA 35 6.296 3.461 1.403
273 HB1 ALA 35 HB1 ALA 35 6.105 2.451 -0.805
274 HB2 ALA 35 HB2 ALA 35 4.492 2.757 -0.143
275 HB3 ALA 35 HB3 ALA 35 5.165 3.837 -1.392
276 H ASN 36 H ASN 36 6.300 5.893 -1.292
277 HA ASN 36 HA ASN 36 9.055 5.544 -1.735
278 HB2 ASN 36 HB2 ASN 36 7.336 6.688 -3.249
279 HB3 ASN 36 HB3 ASN 36 7.674 8.173 -2.340
280 HD21 ASN 36 HD22 ASN 36 9.100 5.597 -4.382
281 HD22 ASN 36 HD21 ASN 36 10.527 6.462 -4.838
282 H ASP 37 H ASP 37 7.444 7.863 0.470
283 HA ASP 37 HA ASP 37 9.826 9.353 1.057
284 HB2 ASP 37 HB2 ASP 37 7.519 10.179 1.375
285 HB3 ASP 37 HB3 ASP 37 7.290 9.004 2.676
286 H ASN 38 H ASN 38 8.797 6.193 2.038
287 HA ASN 38 HA ASN 38 10.618 6.177 4.385
288 HB2 ASN 38 HB2 ASN 38 8.126 5.289 4.268
289 HB3 ASN 38 HB3 ASN 38 8.889 3.847 3.603
290 HD21 ASN 38 HD22 ASN 38 7.402 4.418 6.138
291 HD22 ASN 38 HD21 ASN 38 8.468 3.977 7.460
292 H GLY 39 H GLY 39 10.910 5.734 1.099
293 HA2 GLY 39 HA2 GLY 39 12.782 4.936 -0.024
294 HA3 GLY 39 HA3 GLY 39 13.319 4.091 1.416
295 H VAL 40 H VAL 40 9.982 3.569 0.240
296 HA VAL 40 HA VAL 40 10.809 0.917 -0.837
297 HB VAL 40 HB VAL 40 8.314 1.611 0.766
298 HG11 VAL 40 HG11 VAL 40 7.972 -0.907 0.691
299 HG12 VAL 40 HG12 VAL 40 7.784 -0.107 -0.871
300 HG13 VAL 40 HG13 VAL 40 9.273 -0.991 -0.508
301 HG21 VAL 40 HG21 VAL 40 9.288 -0.012 2.427
302 HG22 VAL 40 HG22 VAL 40 10.793 0.002 1.494
303 HG23 VAL 40 HG23 VAL 40 10.209 1.485 2.273
304 H ASP 41 H ASP 41 10.219 0.582 -2.897
305 HA ASP 41 HA ASP 41 7.837 1.781 -4.046
306 HB2 ASP 41 HB2 ASP 41 9.495 3.630 -4.272
307 HB3 ASP 41 HB3 ASP 41 10.594 2.537 -5.119
308 H GLY 42 H GLY 42 7.070 -0.137 -4.850
309 HA2 GLY 42 HA2 GLY 42 8.774 -1.823 -6.531
310 HA3 GLY 42 HA3 GLY 42 8.080 -2.564 -5.067
311 H GLU 43 H GLU 43 6.980 -3.958 -6.743
312 HA GLU 43 HA GLU 43 5.057 -2.786 -8.461
313 HB2 GLU 43 HB2 GLU 43 6.251 -4.980 -8.755
314 HB3 GLU 43 HB3 GLU 43 5.282 -5.656 -7.446
315 HG2 GLU 43 HG2 GLU 43 4.449 -6.197 -9.763
316 HG3 GLU 43 HG3 GLU 43 3.259 -5.406 -8.709
317 H TRP 44 H TRP 44 3.203 -1.969 -7.984
318 HA TRP 44 HA TRP 44 1.964 -2.127 -5.348
319 HB2 TRP 44 HB2 TRP 44 1.424 -0.538 -7.895
320 HB3 TRP 44 HB3 TRP 44 0.452 -0.392 -6.453
321 HD1 TRP 44 HD1 TRP 44 4.015 0.341 -7.699
322 HE1 TRP 44 HE1 TRP 44 5.160 1.969 -6.134
323 HE3 TRP 44 HE3 TRP 44 0.355 0.654 -4.160
324 HZ2 TRP 44 HZ2 TRP 44 4.556 3.274 -3.604
325 HZ3 TRP 44 HZ3 TRP 44 0.685 2.014 -2.144
326 HH2 TRP 44 HH2 TRP 44 2.784 3.333 -1.829
327 H THR 45 H THR 45 0.951 -4.130 -5.112
328 HA THR 45 HA THR 45 -1.220 -4.739 -7.071
329 HB THR 45 HB THR 45 0.312 -6.708 -5.380
330 HG1 THR 45 HG1 THR 45 0.883 -5.825 -8.031
331 HG21 THR 45 HG21 THR 45 -1.325 -7.111 -7.912
332 HG22 THR 45 HG22 THR 45 -0.484 -8.367 -6.984
333 HG23 THR 45 HG23 THR 45 -1.852 -7.511 -6.263
334 H TYR 46 H TYR 46 -3.234 -4.983 -6.287
335 HA TYR 46 HA TYR 46 -3.764 -4.695 -3.389
336 HB2 TYR 46 HB2 TYR 46 -5.792 -3.550 -4.083
337 HB3 TYR 46 HB3 TYR 46 -4.408 -2.777 -4.837
338 HD1 TYR 46 HD1 TYR 46 -3.959 -3.080 -7.312
339 HD2 TYR 46 HD2 TYR 46 -7.464 -4.773 -5.410
340 HE1 TYR 46 HE1 TYR 46 -4.828 -3.768 -9.515
341 HE2 TYR 46 HE2 TYR 46 -8.324 -5.433 -7.606
342 HH TYR 46 HH TYR 46 -7.694 -5.884 -9.794
343 H ASP 47 H ASP 47 -5.477 -5.916 -2.486
344 HA ASP 47 HA ASP 47 -6.747 -8.072 -4.067
345 HB2 ASP 47 HB2 ASP 47 -4.974 -9.326 -3.118
346 HB3 ASP 47 HB3 ASP 47 -4.992 -8.381 -1.610
347 H ASP 48 H ASP 48 -8.937 -7.617 -3.740
348 HA ASP 48 HA ASP 48 -9.718 -5.999 -1.456
349 HB2 ASP 48 HB2 ASP 48 -11.817 -5.798 -2.291
350 HB3 ASP 48 HB3 ASP 48 -10.872 -5.908 -3.733
351 H ALA 49 H ALA 49 -9.609 -9.474 -2.052
352 HA ALA 49 HA ALA 49 -11.595 -10.288 -0.224
353 HB1 ALA 49 HB1 ALA 49 -9.031 -11.728 -0.957
354 HB2 ALA 49 HB2 ALA 49 -10.470 -12.444 -0.201
355 HB3 ALA 49 HB3 ALA 49 -10.583 -11.780 -1.838
356 H THR 50 H THR 50 -8.099 -9.647 0.378
357 HA THR 50 HA THR 50 -8.641 -9.779 3.310
358 HB THR 50 HB THR 50 -5.864 -9.474 2.268
359 HG1 THR 50 HG1 THR 50 -6.466 -10.904 0.812
360 HG21 THR 50 HG21 THR 50 -7.125 -11.319 4.326
361 HG22 THR 50 HG22 THR 50 -5.383 -11.143 4.014
362 HG23 THR 50 HG23 THR 50 -6.307 -9.784 4.672
363 H LYS 51 H LYS 51 -8.608 -7.546 0.820
364 HA LYS 51 HA LYS 51 -8.429 -5.329 0.614
365 HB2 LYS 51 HB2 LYS 51 -8.764 -5.293 3.625
366 HB3 LYS 51 HB3 LYS 51 -8.853 -3.881 2.569
367 HG2 LYS 51 HG2 LYS 51 -10.755 -4.844 1.374
368 HG3 LYS 51 HG3 LYS 51 -10.716 -6.278 2.422
369 HD2 LYS 51 HD2 LYS 51 -11.201 -4.924 4.393
370 HD3 LYS 51 HD3 LYS 51 -11.041 -3.436 3.470
371 HE2 LYS 51 HE2 LYS 51 -13.374 -4.056 3.981
372 HE3 LYS 51 HE3 LYS 51 -13.059 -3.820 2.258
373 HZ1 LYS 51 HZ1 LYS 51 -13.058 -6.490 3.497
374 HZ2 LYS 51 HZ2 LYS 51 -14.430 -5.776 2.909
375 HZ3 LYS 51 HZ3 LYS 51 -13.181 -6.075 1.885
376 H THR 52 H THR 52 -5.969 -7.049 1.142
377 HA THR 52 HA THR 52 -4.090 -5.167 2.336
378 HB THR 52 HB THR 52 -2.466 -7.031 1.610
379 HG1 THR 52 HG1 THR 52 -4.118 -7.963 0.135
380 HG21 THR 52 HG21 THR 52 -4.724 -7.699 3.558
381 HG22 THR 52 HG22 THR 52 -3.129 -8.469 3.513
382 HG23 THR 52 HG23 THR 52 -3.265 -6.759 3.917
383 H PHE 53 H PHE 53 -2.688 -3.888 1.244
384 HA PHE 53 HA PHE 53 -2.559 -4.063 -1.716
385 HB2 PHE 53 HB2 PHE 53 -4.051 -2.173 -0.691
386 HB3 PHE 53 HB3 PHE 53 -2.533 -1.428 -0.217
387 HD1 PHE 53 HD2 PHE 53 -1.027 -2.454 -2.913
388 HD2 PHE 53 HD1 PHE 53 -4.741 -0.377 -2.114
389 HE1 PHE 53 HE2 PHE 53 -1.000 -1.522 -5.171
390 HE2 PHE 53 HE1 PHE 53 -4.660 0.573 -4.397
391 HZ PHE 53 HZ PHE 53 -2.796 0.005 -5.930
392 H THR 54 H THR 54 -0.592 -5.017 -1.810
393 HA THR 54 HA THR 54 1.495 -4.145 0.087
394 HB THR 54 HB THR 54 1.515 -6.625 -1.632
395 HG1 THR 54 HG1 THR 54 0.306 -7.597 -0.288
396 HG21 THR 54 HG21 THR 54 3.669 -6.052 -0.607
397 HG22 THR 54 HG22 THR 54 2.919 -5.832 0.967
398 HG23 THR 54 HG23 THR 54 2.960 -7.442 0.234
399 H VAL 55 H VAL 55 3.395 -3.321 -0.542
400 HA VAL 55 HA VAL 55 3.842 -2.680 -3.425
401 HB VAL 55 HB VAL 55 5.109 -1.414 -0.932
402 HG11 VAL 55 HG11 VAL 55 6.398 -1.175 -3.005
403 HG12 VAL 55 HG12 VAL 55 4.972 -0.530 -3.853
404 HG13 VAL 55 HG13 VAL 55 5.718 0.389 -2.524
405 HG21 VAL 55 HG21 VAL 55 2.699 -0.469 -2.502
406 HG22 VAL 55 HG22 VAL 55 2.758 -0.899 -0.775
407 HG23 VAL 55 HG23 VAL 55 3.614 0.530 -1.349
408 H THR 56 H THR 56 5.068 -4.461 -4.184
409 HA THR 56 HA THR 56 7.176 -5.520 -2.342
410 HB THR 56 HB THR 56 5.687 -7.128 -4.434
411 HG1 THR 56 HG1 THR 56 4.130 -6.809 -3.127
412 HG21 THR 56 HG21 THR 56 7.363 -7.932 -2.009
413 HG22 THR 56 HG22 THR 56 6.473 -9.050 -3.064
414 HG23 THR 56 HG23 THR 56 7.815 -8.109 -3.718
415 H GLU 57 H GLU 57 9.121 -4.840 -3.039
416 HA GLU 57 HA GLU 57 9.560 -4.566 -5.980
417 HB2 GLU 57 HB2 GLU 57 10.253 -2.688 -4.324
418 HB3 GLU 57 HB3 GLU 57 11.524 -3.796 -3.784
419 HG2 GLU 57 HG2 GLU 57 12.102 -4.048 -6.314
420 HG3 GLU 57 HG3 GLU 57 11.061 -2.658 -6.578
Start of MODEL 15
1 H1 MET 1 H MET 1 -16.637 3.779 4.868
2 HA MET 1 HA MET 1 -16.263 2.036 3.252
3 HB2 MET 1 HB2 MET 1 -14.138 4.216 3.224
4 HB3 MET 1 HB3 MET 1 -14.353 3.047 1.917
5 HG2 MET 1 HG2 MET 1 -16.726 3.672 1.726
6 HG3 MET 1 HG3 MET 1 -16.501 4.927 2.944
7 HE1 MET 1 HE1 MET 1 -17.852 6.279 1.095
8 HE2 MET 1 HE2 MET 1 -17.166 6.780 -0.466
9 HE3 MET 1 HE3 MET 1 -17.696 5.103 -0.224
10 H GLY 2 H GLY 2 -14.228 0.842 2.078
11 HA2 GLY 2 HA2 GLY 2 -13.399 -1.137 3.964
12 HA3 GLY 2 HA3 GLY 2 -12.937 -0.982 2.271
13 H THR 3 H THR 3 -11.300 -1.525 4.783
14 HA THR 3 HA THR 3 -9.404 0.773 4.660
15 HB THR 3 HB THR 3 -9.760 -1.460 6.697
16 HG1 THR 3 HG1 THR 3 -10.885 -0.096 7.691
17 HG21 THR 3 HG21 THR 3 -7.741 0.826 6.623
18 HG22 THR 3 HG22 THR 3 -8.073 -0.208 8.035
19 HG23 THR 3 HG23 THR 3 -7.377 -0.912 6.571
20 H TYR 4 H TYR 4 -7.742 0.473 3.287
21 HA TYR 4 HA TYR 4 -7.036 -2.269 2.397
22 HB2 TYR 4 HB2 TYR 4 -6.246 0.533 1.463
23 HB3 TYR 4 HB3 TYR 4 -5.440 -0.921 0.916
24 HD1 TYR 4 HD1 TYR 4 -6.858 -2.778 -0.255
25 HD2 TYR 4 HD2 TYR 4 -8.170 1.304 0.292
26 HE1 TYR 4 HE1 TYR 4 -8.482 -3.055 -2.086
27 HE2 TYR 4 HE2 TYR 4 -9.749 1.038 -1.582
28 HH TYR 4 HH TYR 4 -10.435 -2.069 -3.112
29 H LYS 5 H LYS 5 -5.541 -3.244 3.643
30 HA LYS 5 HA LYS 5 -3.858 -1.658 5.471
31 HB2 LYS 5 HB2 LYS 5 -3.821 -4.659 4.927
32 HB3 LYS 5 HB3 LYS 5 -3.039 -3.787 6.264
33 HG2 LYS 5 HG2 LYS 5 -5.443 -2.971 6.880
34 HG3 LYS 5 HG3 LYS 5 -6.016 -4.175 5.746
35 HD2 LYS 5 HD2 LYS 5 -4.767 -5.927 7.030
36 HD3 LYS 5 HD3 LYS 5 -4.260 -4.686 8.184
37 HE2 LYS 5 HE2 LYS 5 -6.234 -4.771 9.271
38 HE3 LYS 5 HE3 LYS 5 -7.120 -4.457 7.773
39 HZ1 LYS 5 HZ1 LYS 5 -7.004 -6.755 7.241
40 HZ2 LYS 5 HZ2 LYS 5 -6.179 -7.113 8.612
41 HZ3 LYS 5 HZ3 LYS 5 -7.750 -6.606 8.693
42 H LEU 6 H LEU 6 -2.020 -0.780 4.784
43 HA LEU 6 HA LEU 6 -0.915 -1.543 2.176
44 HB2 LEU 6 HB2 LEU 6 -1.361 0.878 3.214
45 HB3 LEU 6 HB3 LEU 6 0.179 0.620 3.992
46 HG LEU 6 HG LEU 6 0.511 1.895 2.006
47 HD11 LEU 6 HD11 LEU 6 2.239 0.106 2.363
48 HD12 LEU 6 HD12 LEU 6 1.393 -0.895 1.170
49 HD13 LEU 6 HD13 LEU 6 2.080 0.669 0.696
50 HD21 LEU 6 HD21 LEU 6 -1.631 1.131 0.886
51 HD22 LEU 6 HD22 LEU 6 -0.232 1.263 -0.185
52 HD23 LEU 6 HD23 LEU 6 -0.789 -0.319 0.391
53 H ILE 7 H ILE 7 0.837 -2.931 2.094
54 HA ILE 7 HA ILE 7 2.535 -3.166 4.532
55 HB ILE 7 HB ILE 7 1.698 -5.497 2.759
56 HG12 ILE 7 HG12 ILE 7 1.072 -6.501 5.039
57 HG13 ILE 7 HG13 ILE 7 1.148 -4.874 5.696
58 HG21 ILE 7 HG21 ILE 7 3.715 -5.240 5.050
59 HG22 ILE 7 HG22 ILE 7 3.155 -6.783 4.388
60 HG23 ILE 7 HG23 ILE 7 4.063 -5.678 3.363
61 HD11 ILE 7 HD11 ILE 7 -0.759 -4.216 4.384
62 HD12 ILE 7 HD12 ILE 7 -0.679 -5.699 3.394
63 HD13 ILE 7 HD13 ILE 7 -1.143 -5.771 5.111
64 H LEU 8 H LEU 8 4.320 -2.205 4.057
65 HA LEU 8 HA LEU 8 5.361 -1.944 1.290
66 HB2 LEU 8 HB2 LEU 8 5.663 -0.560 3.885
67 HB3 LEU 8 HB3 LEU 8 7.231 -1.083 3.295
68 HG LEU 8 HG LEU 8 6.919 0.128 1.207
69 HD11 LEU 8 HD11 LEU 8 5.088 1.764 0.952
70 HD12 LEU 8 HD12 LEU 8 4.476 0.105 0.969
71 HD13 LEU 8 HD13 LEU 8 4.321 1.118 2.416
72 HD21 LEU 8 HD21 LEU 8 7.151 2.372 2.206
73 HD22 LEU 8 HD22 LEU 8 6.372 1.809 3.697
74 HD23 LEU 8 HD23 LEU 8 7.968 1.174 3.215
75 H ASN 9 H ASN 9 6.405 -3.822 0.561
76 HA ASN 9 HA ASN 9 7.975 -5.418 2.547
77 HB2 ASN 9 HB2 ASN 9 5.979 -6.632 1.872
78 HB3 ASN 9 HB3 ASN 9 6.303 -6.279 0.168
79 HD21 ASN 9 HD22 ASN 9 7.067 -8.054 -0.843
80 HD22 ASN 9 HD21 ASN 9 8.298 -9.141 -0.223
81 H GLY 10 H GLY 10 9.636 -3.842 2.087
82 HA2 GLY 10 HA2 GLY 10 10.654 -3.621 -0.640
83 HA3 GLY 10 HA3 GLY 10 11.228 -2.810 0.825
84 H LYS 11 H LYS 11 13.113 -3.520 -0.636
85 HA LYS 11 HA LYS 11 14.163 -6.239 -0.062
86 HB2 LYS 11 HB2 LYS 11 16.006 -5.561 -1.575
87 HB3 LYS 11 HB3 LYS 11 14.440 -5.444 -2.326
88 HG2 LYS 11 HG2 LYS 11 15.138 -2.862 -1.090
89 HG3 LYS 11 HG3 LYS 11 16.444 -3.418 -2.132
90 HD2 LYS 11 HD2 LYS 11 14.962 -3.662 -4.003
91 HD3 LYS 11 HD3 LYS 11 13.525 -3.397 -3.007
92 HE2 LYS 11 HE2 LYS 11 13.920 -1.433 -4.291
93 HE3 LYS 11 HE3 LYS 11 14.251 -1.055 -2.592
94 HZ1 LYS 11 HZ1 LYS 11 16.256 -1.702 -4.643
95 HZ2 LYS 11 HZ2 LYS 11 15.861 -0.193 -4.186
96 HZ3 LYS 11 HZ3 LYS 11 16.593 -1.210 -3.089
97 H THR 12 H THR 12 14.246 -3.204 1.455
98 HA THR 12 HA THR 12 16.697 -4.015 2.930
99 HB THR 12 HB THR 12 16.156 -1.159 2.052
100 HG1 THR 12 HG1 THR 12 17.948 -3.020 0.839
101 HG21 THR 12 HG21 THR 12 18.560 -0.824 2.534
102 HG22 THR 12 HG22 THR 12 17.681 -1.341 3.976
103 HG23 THR 12 HG23 THR 12 18.693 -2.508 3.087
104 H LEU 13 H LEU 13 13.510 -2.359 2.994
105 HA LEU 13 HA LEU 13 13.404 -2.789 5.825
106 HB2 LEU 13 HB2 LEU 13 12.927 -0.618 6.558
107 HB3 LEU 13 HB3 LEU 13 14.440 -0.550 5.714
108 HG LEU 13 HG LEU 13 13.283 1.424 5.281
109 HD11 LEU 13 HD11 LEU 13 14.469 0.495 3.324
110 HD12 LEU 13 HD12 LEU 13 12.941 -0.209 2.742
111 HD13 LEU 13 HD13 LEU 13 13.123 1.552 2.877
112 HD21 LEU 13 HD21 LEU 13 11.111 1.728 4.420
113 HD22 LEU 13 HD22 LEU 13 10.841 -0.003 4.211
114 HD23 LEU 13 HD23 LEU 13 11.000 0.683 5.845
115 H LYS 14 H LYS 14 11.091 -2.188 6.597
116 HA LYS 14 HA LYS 14 9.079 -2.555 4.452
117 HB2 LYS 14 HB2 LYS 14 9.423 -4.326 6.909
118 HB3 LYS 14 HB3 LYS 14 8.021 -4.339 5.839
119 HG2 LYS 14 HG2 LYS 14 9.669 -4.806 3.900
120 HG3 LYS 14 HG3 LYS 14 10.873 -5.137 5.165
121 HD2 LYS 14 HD2 LYS 14 9.144 -6.698 6.193
122 HD3 LYS 14 HD3 LYS 14 8.199 -6.520 4.693
123 HE2 LYS 14 HE2 LYS 14 10.315 -7.271 3.449
124 HE3 LYS 14 HE3 LYS 14 11.011 -7.643 5.039
125 HZ1 LYS 14 HZ1 LYS 14 10.035 -9.605 4.225
126 HZ2 LYS 14 HZ2 LYS 14 8.949 -9.054 5.353
127 HZ3 LYS 14 HZ3 LYS 14 8.668 -8.835 3.739
128 H GLY 15 H GLY 15 6.776 -2.462 5.410
129 HA2 GLY 15 HA2 GLY 15 6.503 -0.783 7.792
130 HA3 GLY 15 HA3 GLY 15 6.074 -0.025 6.259
131 H GLU 16 H GLU 16 4.141 -0.518 8.293
132 HA GLU 16 HA GLU 16 2.219 -2.114 6.768
133 HB2 GLU 16 HB2 GLU 16 3.238 -3.820 8.246
134 HB3 GLU 16 HB3 GLU 16 2.869 -2.819 9.663
135 HG2 GLU 16 HG2 GLU 16 0.447 -2.948 9.087
136 HG3 GLU 16 HG3 GLU 16 0.818 -3.928 7.687
137 H THR 17 H THR 17 0.517 -0.586 6.620
138 HA THR 17 HA THR 17 -0.299 0.921 9.041
139 HB THR 17 HB THR 17 -0.452 2.950 7.447
140 HG1 THR 17 HG1 THR 17 1.368 2.784 5.889
141 HG21 THR 17 HG21 THR 17 2.340 2.006 8.209
142 HG22 THR 17 HG22 THR 17 1.838 3.661 7.841
143 HG23 THR 17 HG23 THR 17 1.202 2.841 9.277
144 H THR 18 H THR 18 -2.439 2.157 8.519
145 HA THR 18 HA THR 18 -4.076 0.678 6.493
146 HB THR 18 HB THR 18 -5.846 0.612 8.341
147 HG1 THR 18 HG1 THR 18 -4.661 2.083 9.794
148 HG21 THR 18 HG21 THR 18 -3.392 -1.000 9.123
149 HG22 THR 18 HG22 THR 18 -5.102 -1.449 9.281
150 HG23 THR 18 HG23 THR 18 -4.332 -1.356 7.679
151 H THR 19 H THR 19 -5.499 2.032 5.389
152 HA THR 19 HA THR 19 -6.462 4.487 6.567
153 HB THR 19 HB THR 19 -4.765 4.602 4.039
154 HG1 THR 19 HG1 THR 19 -4.099 4.765 6.591
155 HG21 THR 19 HG21 THR 19 -6.673 6.201 3.984
156 HG22 THR 19 HG22 THR 19 -6.151 6.849 5.551
157 HG23 THR 19 HG23 THR 19 -5.111 7.020 4.125
158 H GLU 20 H GLU 20 -8.596 4.892 5.679
159 HA GLU 20 HA GLU 20 -9.482 2.823 3.741
160 HB2 GLU 20 HB2 GLU 20 -11.741 3.418 4.363
161 HB3 GLU 20 HB3 GLU 20 -10.806 2.909 5.765
162 HG2 GLU 20 HG2 GLU 20 -10.585 5.239 6.508
163 HG3 GLU 20 HG3 GLU 20 -11.407 5.814 5.042
164 H ALA 21 H ALA 21 -10.539 3.423 1.812
165 HA ALA 21 HA ALA 21 -10.552 6.250 0.966
166 HB1 ALA 21 HB1 ALA 21 -8.322 5.315 0.313
167 HB2 ALA 21 HB2 ALA 21 -9.148 4.002 -0.561
168 HB3 ALA 21 HB3 ALA 21 -9.335 5.689 -1.084
169 H VAL 22 H VAL 22 -11.652 6.265 -1.369
170 HA VAL 22 HA VAL 22 -14.073 4.658 -1.122
171 HB VAL 22 HB VAL 22 -14.164 7.020 -1.747
172 HG11 VAL 22 HG11 VAL 22 -13.503 7.801 -3.997
173 HG12 VAL 22 HG12 VAL 22 -12.094 7.263 -3.078
174 HG13 VAL 22 HG13 VAL 22 -12.782 6.227 -4.351
175 HG21 VAL 22 HG21 VAL 22 -15.178 5.322 -4.044
176 HG22 VAL 22 HG22 VAL 22 -15.975 5.492 -2.464
177 HG23 VAL 22 HG23 VAL 22 -15.780 6.906 -3.513
178 H ASP 23 H ASP 23 -11.028 4.386 -2.943
179 HA ASP 23 HA ASP 23 -11.931 1.804 -3.949
180 HB2 ASP 23 HB2 ASP 23 -12.619 3.843 -5.517
181 HB3 ASP 23 HB3 ASP 23 -10.915 3.858 -5.951
182 H ALA 24 H ALA 24 -10.093 0.780 -5.175
183 HA ALA 24 HA ALA 24 -7.684 0.837 -3.691
184 HB1 ALA 24 HB1 ALA 24 -8.483 -1.123 -5.025
185 HB2 ALA 24 HB2 ALA 24 -8.137 -0.218 -6.515
186 HB3 ALA 24 HB3 ALA 24 -6.819 -0.672 -5.433
187 H ALA 25 H ALA 25 -8.539 2.322 -6.815
188 HA ALA 25 HA ALA 25 -6.030 3.285 -7.596
189 HB1 ALA 25 HB1 ALA 25 -7.290 4.985 -8.879
190 HB2 ALA 25 HB2 ALA 25 -8.033 3.382 -9.033
191 HB3 ALA 25 HB3 ALA 25 -8.758 4.603 -7.961
192 H THR 26 H THR 26 -8.425 4.837 -5.377
193 HA THR 26 HA THR 26 -6.886 7.218 -4.975
194 HB THR 26 HB THR 26 -9.041 5.876 -3.281
195 HG1 THR 26 HG1 THR 26 -9.994 7.957 -4.488
196 HG21 THR 26 HG21 THR 26 -7.803 7.552 -1.945
197 HG22 THR 26 HG22 THR 26 -8.024 8.756 -3.226
198 HG23 THR 26 HG23 THR 26 -9.426 8.127 -2.322
199 H ALA 27 H ALA 27 -7.240 4.149 -3.084
200 HA ALA 27 HA ALA 27 -5.586 4.833 -0.934
201 HB1 ALA 27 HB1 ALA 27 -5.942 2.096 -2.236
202 HB2 ALA 27 HB2 ALA 27 -5.313 2.407 -0.607
203 HB3 ALA 27 HB3 ALA 27 -6.994 2.824 -1.002
204 H GLU 28 H GLU 28 -4.660 3.195 -3.977
205 HA GLU 28 HA GLU 28 -1.919 2.893 -3.603
206 HB2 GLU 28 HB2 GLU 28 -3.273 1.959 -5.466
207 HB3 GLU 28 HB3 GLU 28 -3.511 3.568 -6.109
208 HG2 GLU 28 HG2 GLU 28 -0.907 3.664 -6.315
209 HG3 GLU 28 HG3 GLU 28 -0.979 1.908 -6.104
210 H LYS 29 H LYS 29 -3.575 5.668 -5.196
211 HA LYS 29 HA LYS 29 -1.133 7.079 -5.573
212 HB2 LYS 29 HB2 LYS 29 -4.006 8.087 -5.559
213 HB3 LYS 29 HB3 LYS 29 -2.594 9.061 -5.992
214 HG2 LYS 29 HG2 LYS 29 -2.019 7.155 -7.688
215 HG3 LYS 29 HG3 LYS 29 -3.653 6.589 -7.407
216 HD2 LYS 29 HD2 LYS 29 -3.787 7.946 -9.334
217 HD3 LYS 29 HD3 LYS 29 -4.446 8.956 -8.024
218 HE2 LYS 29 HE2 LYS 29 -2.098 9.939 -7.750
219 HE3 LYS 29 HE3 LYS 29 -1.608 9.006 -9.166
220 HZ1 LYS 29 HZ1 LYS 29 -3.287 10.233 -10.430
221 HZ2 LYS 29 HZ2 LYS 29 -3.658 11.121 -9.089
222 HZ3 LYS 29 HZ3 LYS 29 -2.157 11.231 -9.747
223 H VAL 30 H VAL 30 -3.565 7.404 -2.939
224 HA VAL 30 HA VAL 30 -2.253 9.614 -1.703
225 HB VAL 30 HB VAL 30 -4.227 7.554 -0.666
226 HG11 VAL 30 HG11 VAL 30 -4.662 9.203 1.184
227 HG12 VAL 30 HG12 VAL 30 -3.082 8.426 1.287
228 HG13 VAL 30 HG13 VAL 30 -3.206 10.090 0.682
229 HG21 VAL 30 HG21 VAL 30 -5.850 9.394 -0.908
230 HG22 VAL 30 HG22 VAL 30 -4.567 10.487 -1.466
231 HG23 VAL 30 HG23 VAL 30 -5.061 9.111 -2.460
232 H PHE 31 H PHE 31 -2.098 6.061 -0.896
233 HA PHE 31 HA PHE 31 -0.171 6.403 1.136
234 HB2 PHE 31 HB2 PHE 31 -1.043 4.072 -0.574
235 HB3 PHE 31 HB3 PHE 31 0.374 3.913 0.427
236 HD1 PHE 31 HD2 PHE 31 0.094 4.868 2.942
237 HD2 PHE 31 HD1 PHE 31 -3.004 3.204 0.446
238 HE1 PHE 31 HE2 PHE 31 -1.043 3.988 4.950
239 HE2 PHE 31 HE1 PHE 31 -4.113 2.262 2.474
240 HZ PHE 31 HZ PHE 31 -3.094 2.629 4.713
241 H LYS 32 H LYS 32 0.343 6.808 -2.255
242 HA LYS 32 HA LYS 32 3.003 5.860 -2.469
243 HB2 LYS 32 HB2 LYS 32 1.307 6.794 -4.241
244 HB3 LYS 32 HB3 LYS 32 2.085 8.350 -3.918
245 HG2 LYS 32 HG2 LYS 32 4.255 7.471 -4.619
246 HG3 LYS 32 HG3 LYS 32 3.630 5.806 -4.586
247 HD2 LYS 32 HD2 LYS 32 1.960 6.474 -6.361
248 HD3 LYS 32 HD3 LYS 32 2.860 7.988 -6.550
249 HE2 LYS 32 HE2 LYS 32 4.794 6.861 -7.341
250 HE3 LYS 32 HE3 LYS 32 4.252 5.297 -6.707
251 HZ1 LYS 32 HZ1 LYS 32 2.730 6.679 -8.801
252 HZ2 LYS 32 HZ2 LYS 32 3.992 5.684 -9.153
253 HZ3 LYS 32 HZ3 LYS 32 2.689 5.074 -8.365
254 H GLN 33 H GLN 33 1.690 8.749 -0.954
255 HA GLN 33 HA GLN 33 4.008 10.359 -0.727
256 HB2 GLN 33 HB2 GLN 33 1.662 9.870 1.182
257 HB3 GLN 33 HB3 GLN 33 2.867 11.133 1.423
258 HG2 GLN 33 HG2 GLN 33 2.165 12.304 -0.550
259 HG3 GLN 33 HG3 GLN 33 1.124 10.963 -1.058
260 HE21 GLN 33 HE22 GLN 33 -0.949 11.798 -0.898
261 HE22 GLN 33 HE21 GLN 33 -1.601 12.555 0.569
262 H TYR 34 H TYR 34 2.641 8.052 1.616
263 HA TYR 34 HA TYR 34 4.736 7.909 3.440
264 HB2 TYR 34 HB2 TYR 34 2.642 7.169 4.134
265 HB3 TYR 34 HB3 TYR 34 2.351 6.253 2.686
266 HD1 TYR 34 HD2 TYR 34 4.753 6.188 5.636
267 HD2 TYR 34 HD1 TYR 34 2.353 3.980 2.797
268 HE1 TYR 34 HE2 TYR 34 5.179 4.109 6.897
269 HE2 TYR 34 HE1 TYR 34 2.768 1.929 4.025
270 HH TYR 34 HH TYR 34 4.554 1.823 7.158
271 H ALA 35 H ALA 35 4.166 5.854 0.526
272 HA ALA 35 HA ALA 35 6.280 4.019 1.114
273 HB1 ALA 35 HB1 ALA 35 6.174 3.446 -1.288
274 HB2 ALA 35 HB2 ALA 35 4.564 3.532 -0.550
275 HB3 ALA 35 HB3 ALA 35 5.148 4.869 -1.582
276 H ASN 36 H ASN 36 6.234 6.884 -1.059
277 HA ASN 36 HA ASN 36 8.990 6.922 -1.714
278 HB2 ASN 36 HB2 ASN 36 7.619 8.350 -3.007
279 HB3 ASN 36 HB3 ASN 36 6.793 9.014 -1.591
280 HD21 ASN 36 HD22 ASN 36 7.596 10.873 -0.565
281 HD22 ASN 36 HD21 ASN 36 9.138 11.585 -0.927
282 H ASP 37 H ASP 37 7.213 8.474 0.960
283 HA ASP 37 HA ASP 37 9.372 9.860 2.085
284 HB2 ASP 37 HB2 ASP 37 7.001 10.305 2.581
285 HB3 ASP 37 HB3 ASP 37 6.888 8.758 3.455
286 H ASN 38 H ASN 38 8.298 6.506 2.571
287 HA ASN 38 HA ASN 38 10.249 6.124 4.725
288 HB2 ASN 38 HB2 ASN 38 7.907 5.135 4.692
289 HB3 ASN 38 HB3 ASN 38 8.503 4.014 3.453
290 HD21 ASN 38 HD22 ASN 38 7.923 2.338 5.109
291 HD22 ASN 38 HD21 ASN 38 9.075 1.981 6.374
292 H GLY 39 H GLY 39 10.456 6.150 1.351
293 HA2 GLY 39 HA2 GLY 39 12.323 5.766 0.085
294 HA3 GLY 39 HA3 GLY 39 13.101 4.924 1.417
295 H VAL 40 H VAL 40 9.893 3.994 0.101
296 HA VAL 40 HA VAL 40 11.162 1.606 -1.147
297 HB VAL 40 HB VAL 40 8.670 1.600 0.594
298 HG11 VAL 40 HG11 VAL 40 10.108 -0.700 -0.805
299 HG12 VAL 40 HG12 VAL 40 8.884 -0.921 0.446
300 HG13 VAL 40 HG13 VAL 40 8.435 -0.160 -1.076
301 HG21 VAL 40 HG21 VAL 40 10.013 0.151 2.123
302 HG22 VAL 40 HG22 VAL 40 11.445 0.487 1.129
303 HG23 VAL 40 HG23 VAL 40 10.645 1.799 2.021
304 H ASP 41 H ASP 41 9.853 0.634 -2.745
305 HA ASP 41 HA ASP 41 7.542 1.754 -3.880
306 HB2 ASP 41 HB2 ASP 41 9.488 3.296 -4.775
307 HB3 ASP 41 HB3 ASP 41 9.924 1.894 -5.751
308 H GLY 42 H GLY 42 7.143 0.318 -6.014
309 HA2 GLY 42 HA2 GLY 42 8.549 -1.988 -6.623
310 HA3 GLY 42 HA3 GLY 42 7.577 -2.419 -5.192
311 H GLU 43 H GLU 43 6.232 -3.816 -6.497
312 HA GLU 43 HA GLU 43 4.507 -2.503 -8.519
313 HB2 GLU 43 HB2 GLU 43 5.799 -4.518 -9.179
314 HB3 GLU 43 HB3 GLU 43 4.910 -5.469 -7.980
315 HG2 GLU 43 HG2 GLU 43 2.799 -5.015 -9.098
316 HG3 GLU 43 HG3 GLU 43 3.525 -3.748 -10.101
317 H TRP 44 H TRP 44 2.846 -1.641 -7.564
318 HA TRP 44 HA TRP 44 1.791 -2.421 -4.977
319 HB2 TRP 44 HB2 TRP 44 0.978 -0.346 -7.071
320 HB3 TRP 44 HB3 TRP 44 0.285 -0.488 -5.467
321 HD1 TRP 44 HD1 TRP 44 3.902 0.038 -6.859
322 HE1 TRP 44 HE1 TRP 44 5.074 1.814 -5.474
323 HE3 TRP 44 HE3 TRP 44 0.098 1.075 -3.654
324 HZ2 TRP 44 HZ2 TRP 44 4.429 3.458 -3.206
325 HZ3 TRP 44 HZ3 TRP 44 0.377 2.750 -1.860
326 HH2 TRP 44 HH2 TRP 44 2.555 3.913 -1.572
327 H THR 45 H THR 45 0.623 -4.389 -5.035
328 HA THR 45 HA THR 45 -1.683 -4.435 -6.931
329 HB THR 45 HB THR 45 -0.224 -6.928 -6.014
330 HG1 THR 45 HG1 THR 45 1.202 -5.927 -7.313
331 HG21 THR 45 HG21 THR 45 -2.228 -6.332 -8.243
332 HG22 THR 45 HG22 THR 45 -1.463 -7.892 -7.969
333 HG23 THR 45 HG23 THR 45 -2.574 -7.249 -6.758
334 H TYR 46 H TYR 46 -3.664 -4.983 -6.073
335 HA TYR 46 HA TYR 46 -3.786 -5.252 -3.137
336 HB2 TYR 46 HB2 TYR 46 -5.908 -4.183 -3.182
337 HB3 TYR 46 HB3 TYR 46 -4.721 -3.177 -3.971
338 HD1 TYR 46 HD2 TYR 46 -7.692 -5.298 -4.484
339 HD2 TYR 46 HD1 TYR 46 -4.843 -2.641 -6.357
340 HE1 TYR 46 HE2 TYR 46 -9.129 -5.158 -6.465
341 HE2 TYR 46 HE1 TYR 46 -6.303 -2.483 -8.352
342 HH TYR 46 HH TYR 46 -9.082 -4.572 -8.783
343 H ASP 47 H ASP 47 -5.294 -6.526 -2.196
344 HA ASP 47 HA ASP 47 -6.421 -8.809 -3.737
345 HB2 ASP 47 HB2 ASP 47 -4.440 -9.631 -2.734
346 HB3 ASP 47 HB3 ASP 47 -4.691 -8.727 -1.248
347 H ASP 48 H ASP 48 -8.532 -8.160 -3.650
348 HA ASP 48 HA ASP 48 -9.615 -6.552 -1.519
349 HB2 ASP 48 HB2 ASP 48 -11.280 -6.176 -2.902
350 HB3 ASP 48 HB3 ASP 48 -10.448 -7.141 -4.102
351 H ALA 49 H ALA 49 -9.603 -10.085 -2.115
352 HA ALA 49 HA ALA 49 -11.557 -10.765 -0.164
353 HB1 ALA 49 HB1 ALA 49 -10.356 -12.962 0.016
354 HB2 ALA 49 HB2 ALA 49 -10.767 -12.510 -1.635
355 HB3 ALA 49 HB3 ALA 49 -9.095 -12.331 -1.058
356 H THR 50 H THR 50 -7.958 -10.670 0.194
357 HA THR 50 HA THR 50 -8.196 -10.853 3.093
358 HB THR 50 HB THR 50 -5.796 -10.170 1.397
359 HG1 THR 50 HG1 THR 50 -6.036 -12.047 0.676
360 HG21 THR 50 HG21 THR 50 -5.325 -9.796 3.758
361 HG22 THR 50 HG22 THR 50 -6.040 -11.352 4.195
362 HG23 THR 50 HG23 THR 50 -4.535 -11.291 3.246
363 H LYS 51 H LYS 51 -8.270 -8.200 0.813
364 HA LYS 51 HA LYS 51 -8.495 -6.005 0.981
365 HB2 LYS 51 HB2 LYS 51 -8.981 -6.304 3.963
366 HB3 LYS 51 HB3 LYS 51 -9.300 -4.890 2.964
367 HG2 LYS 51 HG2 LYS 51 -11.007 -6.146 1.698
368 HG3 LYS 51 HG3 LYS 51 -10.680 -7.600 2.691
369 HD2 LYS 51 HD2 LYS 51 -11.237 -6.272 4.736
370 HD3 LYS 51 HD3 LYS 51 -11.631 -4.899 3.679
371 HE2 LYS 51 HE2 LYS 51 -13.377 -6.296 2.573
372 HE3 LYS 51 HE3 LYS 51 -13.021 -7.613 3.711
373 HZ1 LYS 51 HZ1 LYS 51 -14.890 -6.199 4.437
374 HZ2 LYS 51 HZ2 LYS 51 -13.648 -6.157 5.510
375 HZ3 LYS 51 HZ3 LYS 51 -13.855 -4.893 4.515
376 H THR 52 H THR 52 -6.027 -6.972 0.720
377 HA THR 52 HA THR 52 -4.298 -5.223 2.396
378 HB THR 52 HB THR 52 -2.561 -7.083 1.698
379 HG1 THR 52 HG1 THR 52 -3.477 -9.102 1.390
380 HG21 THR 52 HG21 THR 52 -4.702 -7.520 3.834
381 HG22 THR 52 HG22 THR 52 -3.170 -8.412 3.736
382 HG23 THR 52 HG23 THR 52 -3.157 -6.667 4.022
383 H PHE 53 H PHE 53 -2.504 -4.297 1.278
384 HA PHE 53 HA PHE 53 -2.557 -4.339 -1.664
385 HB2 PHE 53 HB2 PHE 53 -3.971 -2.438 -0.359
386 HB3 PHE 53 HB3 PHE 53 -2.411 -1.682 -0.235
387 HD1 PHE 53 HD2 PHE 53 -1.473 -2.737 -3.150
388 HD2 PHE 53 HD1 PHE 53 -4.983 -0.727 -1.610
389 HE1 PHE 53 HE2 PHE 53 -1.892 -1.729 -5.366
390 HE2 PHE 53 HE1 PHE 53 -5.359 0.275 -3.818
391 HZ PHE 53 HZ PHE 53 -3.831 -0.230 -5.718
392 H THR 54 H THR 54 -0.567 -5.342 -1.762
393 HA THR 54 HA THR 54 1.543 -4.429 0.087
394 HB THR 54 HB THR 54 1.451 -6.967 -1.539
395 HG1 THR 54 HG1 THR 54 0.775 -7.907 0.403
396 HG21 THR 54 HG21 THR 54 3.086 -7.772 0.103
397 HG22 THR 54 HG22 THR 54 3.697 -6.304 -0.661
398 HG23 THR 54 HG23 THR 54 3.023 -6.229 0.975
399 H VAL 55 H VAL 55 3.440 -3.670 -0.559
400 HA VAL 55 HA VAL 55 3.856 -3.083 -3.453
401 HB VAL 55 HB VAL 55 4.965 -1.582 -1.027
402 HG11 VAL 55 HG11 VAL 55 6.394 -1.435 -3.022
403 HG12 VAL 55 HG12 VAL 55 4.997 -0.955 -4.010
404 HG13 VAL 55 HG13 VAL 55 5.598 0.116 -2.724
405 HG21 VAL 55 HG21 VAL 55 2.634 -0.907 -2.826
406 HG22 VAL 55 HG22 VAL 55 2.613 -1.161 -1.056
407 HG23 VAL 55 HG23 VAL 55 3.422 0.257 -1.728
408 H THR 56 H THR 56 5.013 -4.894 -4.036
409 HA THR 56 HA THR 56 7.366 -5.662 -2.383
410 HB THR 56 HB THR 56 5.449 -7.327 -4.050
411 HG1 THR 56 HG1 THR 56 4.756 -7.939 -2.181
412 HG21 THR 56 HG21 THR 56 8.105 -8.183 -2.819
413 HG22 THR 56 HG22 THR 56 6.841 -9.305 -3.376
414 HG23 THR 56 HG23 THR 56 7.651 -8.245 -4.531
415 H GLU 57 H GLU 57 9.316 -5.990 -3.554
416 HA GLU 57 HA GLU 57 9.322 -5.027 -6.363
417 HB2 GLU 57 HB2 GLU 57 10.271 -3.391 -4.719
418 HB3 GLU 57 HB3 GLU 57 11.433 -4.600 -4.185
419 HG2 GLU 57 HG2 GLU 57 11.421 -4.200 -7.141
420 HG3 GLU 57 HG3 GLU 57 11.707 -2.721 -6.250
Start of MODEL 16
1 H1 MET 1 H MET 1 -16.416 4.265 5.439
2 HA MET 1 HA MET 1 -16.270 2.617 3.665
3 HB2 MET 1 HB2 MET 1 -14.108 4.739 3.764
4 HB3 MET 1 HB3 MET 1 -14.254 3.633 2.389
5 HG2 MET 1 HG2 MET 1 -16.633 4.236 2.127
6 HG3 MET 1 HG3 MET 1 -16.456 5.450 3.404
7 HE1 MET 1 HE1 MET 1 -17.671 6.911 1.480
8 HE2 MET 1 HE2 MET 1 -16.916 7.312 -0.075
9 HE3 MET 1 HE3 MET 1 -17.462 5.659 0.236
10 H GLY 2 H GLY 2 -14.622 1.362 2.312
11 HA2 GLY 2 HA2 GLY 2 -13.648 -0.787 3.861
12 HA3 GLY 2 HA3 GLY 2 -13.374 -0.488 2.140
13 H THR 3 H THR 3 -11.516 -1.595 4.073
14 HA THR 3 HA THR 3 -9.330 0.422 3.930
15 HB THR 3 HB THR 3 -9.878 -1.432 6.286
16 HG1 THR 3 HG1 THR 3 -11.449 0.285 6.031
17 HG21 THR 3 HG21 THR 3 -8.023 0.976 6.018
18 HG22 THR 3 HG22 THR 3 -8.261 -0.013 7.476
19 HG23 THR 3 HG23 THR 3 -7.504 -0.725 6.041
20 H TYR 4 H TYR 4 -7.759 -0.436 2.642
21 HA TYR 4 HA TYR 4 -7.460 -3.393 2.483
22 HB2 TYR 4 HB2 TYR 4 -6.108 -1.260 0.802
23 HB3 TYR 4 HB3 TYR 4 -6.092 -2.986 0.533
24 HD1 TYR 4 HD2 TYR 4 -8.093 0.124 0.352
25 HD2 TYR 4 HD1 TYR 4 -7.924 -4.058 -0.728
26 HE1 TYR 4 HE2 TYR 4 -9.960 0.455 -1.215
27 HE2 TYR 4 HE1 TYR 4 -9.803 -3.716 -2.321
28 HH TYR 4 HH TYR 4 -11.438 -2.221 -3.052
29 H LYS 5 H LYS 5 -5.498 -4.228 3.278
30 HA LYS 5 HA LYS 5 -4.081 -2.523 5.196
31 HB2 LYS 5 HB2 LYS 5 -3.996 -5.490 4.547
32 HB3 LYS 5 HB3 LYS 5 -2.932 -4.721 5.728
33 HG2 LYS 5 HG2 LYS 5 -5.037 -3.728 6.814
34 HG3 LYS 5 HG3 LYS 5 -5.970 -4.823 5.782
35 HD2 LYS 5 HD2 LYS 5 -4.657 -6.743 6.798
36 HD3 LYS 5 HD3 LYS 5 -3.889 -5.565 7.878
37 HE2 LYS 5 HE2 LYS 5 -5.654 -5.790 9.270
38 HE3 LYS 5 HE3 LYS 5 -6.610 -4.918 8.068
39 HZ1 LYS 5 HZ1 LYS 5 -7.069 -7.090 7.044
40 HZ2 LYS 5 HZ2 LYS 5 -6.299 -7.844 8.261
41 HZ3 LYS 5 HZ3 LYS 5 -7.692 -6.971 8.554
42 H LEU 6 H LEU 6 -2.589 -1.227 4.529
43 HA LEU 6 HA LEU 6 -1.017 -1.596 2.111
44 HB2 LEU 6 HB2 LEU 6 -2.169 0.549 3.038
45 HB3 LEU 6 HB3 LEU 6 -0.869 0.624 4.197
46 HG LEU 6 HG LEU 6 -0.298 2.115 2.506
47 HD11 LEU 6 HD11 LEU 6 1.621 0.666 3.052
48 HD12 LEU 6 HD12 LEU 6 1.254 -0.343 1.637
49 HD13 LEU 6 HD13 LEU 6 1.699 1.357 1.425
50 HD21 LEU 6 HD21 LEU 6 -1.919 1.427 0.829
51 HD22 LEU 6 HD22 LEU 6 -0.336 1.673 0.102
52 HD23 LEU 6 HD23 LEU 6 -0.939 0.024 0.395
53 H ILE 7 H ILE 7 0.570 -3.175 2.398
54 HA ILE 7 HA ILE 7 2.423 -2.936 4.733
55 HB ILE 7 HB ILE 7 1.612 -5.366 3.078
56 HG12 ILE 7 HG12 ILE 7 1.400 -6.372 5.427
57 HG13 ILE 7 HG13 ILE 7 1.566 -4.750 6.069
58 HG21 ILE 7 HG21 ILE 7 3.957 -5.123 5.028
59 HG22 ILE 7 HG22 ILE 7 3.329 -6.646 4.363
60 HG23 ILE 7 HG23 ILE 7 4.062 -5.469 3.289
61 HD11 ILE 7 HD11 ILE 7 -0.771 -5.638 5.922
62 HD12 ILE 7 HD12 ILE 7 -0.555 -4.107 5.065
63 HD13 ILE 7 HD13 ILE 7 -0.632 -5.638 4.153
64 H LEU 8 H LEU 8 4.414 -2.364 4.312
65 HA LEU 8 HA LEU 8 5.408 -1.976 1.538
66 HB2 LEU 8 HB2 LEU 8 5.839 -0.691 4.231
67 HB3 LEU 8 HB3 LEU 8 7.265 -0.894 3.237
68 HG LEU 8 HG LEU 8 6.225 0.347 1.388
69 HD11 LEU 8 HD11 LEU 8 4.157 1.643 1.780
70 HD12 LEU 8 HD12 LEU 8 3.859 -0.100 1.782
71 HD13 LEU 8 HD13 LEU 8 3.929 0.780 3.323
72 HD21 LEU 8 HD21 LEU 8 7.556 1.482 3.230
73 HD22 LEU 8 HD22 LEU 8 6.413 2.536 2.404
74 HD23 LEU 8 HD23 LEU 8 6.021 1.888 4.014
75 H ASN 9 H ASN 9 6.663 -3.688 0.797
76 HA ASN 9 HA ASN 9 8.333 -5.193 2.748
77 HB2 ASN 9 HB2 ASN 9 6.605 -6.657 2.175
78 HB3 ASN 9 HB3 ASN 9 6.540 -6.148 0.513
79 HD21 ASN 9 HD22 ASN 9 8.204 -6.897 -0.971
80 HD22 ASN 9 HD21 ASN 9 8.860 -8.501 -0.694
81 H GLY 10 H GLY 10 10.003 -3.585 2.404
82 HA2 GLY 10 HA2 GLY 10 11.114 -3.419 -0.347
83 HA3 GLY 10 HA3 GLY 10 11.336 -2.258 0.958
84 H LYS 11 H LYS 11 13.369 -3.489 -0.552
85 HA LYS 11 HA LYS 11 14.716 -5.577 0.760
86 HB2 LYS 11 HB2 LYS 11 16.594 -5.087 -0.656
87 HB3 LYS 11 HB3 LYS 11 15.110 -5.087 -1.540
88 HG2 LYS 11 HG2 LYS 11 16.660 -2.582 -0.728
89 HG3 LYS 11 HG3 LYS 11 16.721 -3.395 -2.289
90 HD2 LYS 11 HD2 LYS 11 14.092 -2.981 -2.275
91 HD3 LYS 11 HD3 LYS 11 14.508 -1.730 -1.110
92 HE2 LYS 11 HE2 LYS 11 14.418 -0.640 -3.170
93 HE3 LYS 11 HE3 LYS 11 16.151 -0.816 -2.861
94 HZ1 LYS 11 HZ1 LYS 11 14.490 -2.549 -4.614
95 HZ2 LYS 11 HZ2 LYS 11 15.497 -1.394 -5.163
96 HZ3 LYS 11 HZ3 LYS 11 16.120 -2.708 -4.418
97 H THR 12 H THR 12 14.319 -2.684 2.294
98 HA THR 12 HA THR 12 16.768 -3.211 3.891
99 HB THR 12 HB THR 12 16.106 -0.348 3.162
100 HG1 THR 12 HG1 THR 12 17.186 -0.405 1.397
101 HG21 THR 12 HG21 THR 12 18.588 -0.133 3.545
102 HG22 THR 12 HG22 THR 12 17.695 -0.644 4.985
103 HG23 THR 12 HG23 THR 12 18.623 -1.831 4.041
104 H LEU 13 H LEU 13 13.505 -1.836 3.709
105 HA LEU 13 HA LEU 13 13.242 -2.050 6.567
106 HB2 LEU 13 HB2 LEU 13 12.571 0.172 6.974
107 HB3 LEU 13 HB3 LEU 13 14.100 0.271 6.151
108 HG LEU 13 HG LEU 13 12.881 2.023 5.317
109 HD11 LEU 13 HD11 LEU 13 13.948 0.741 3.476
110 HD12 LEU 13 HD12 LEU 13 12.404 -0.060 3.165
111 HD13 LEU 13 HD13 LEU 13 12.560 1.693 2.958
112 HD21 LEU 13 HD21 LEU 13 10.620 2.087 4.618
113 HD22 LEU 13 HD22 LEU 13 10.422 0.341 4.770
114 HD23 LEU 13 HD23 LEU 13 10.687 1.349 6.209
115 H LYS 14 H LYS 14 10.916 -1.789 7.131
116 HA LYS 14 HA LYS 14 9.020 -2.270 4.930
117 HB2 LYS 14 HB2 LYS 14 9.435 -4.165 7.294
118 HB3 LYS 14 HB3 LYS 14 8.070 -4.202 6.176
119 HG2 LYS 14 HG2 LYS 14 9.822 -4.441 4.283
120 HG3 LYS 14 HG3 LYS 14 10.980 -4.816 5.573
121 HD2 LYS 14 HD2 LYS 14 9.465 -6.651 6.336
122 HD3 LYS 14 HD3 LYS 14 8.372 -6.284 4.981
123 HE2 LYS 14 HE2 LYS 14 10.350 -6.701 3.412
124 HE3 LYS 14 HE3 LYS 14 11.267 -7.236 4.828
125 HZ1 LYS 14 HZ1 LYS 14 10.343 -9.133 3.822
126 HZ2 LYS 14 HZ2 LYS 14 9.403 -8.880 5.167
127 HZ3 LYS 14 HZ3 LYS 14 8.867 -8.507 3.664
128 H GLY 15 H GLY 15 6.735 -2.233 5.822
129 HA2 GLY 15 HA2 GLY 15 6.306 -0.909 8.363
130 HA3 GLY 15 HA3 GLY 15 6.058 0.140 6.956
131 H GLU 16 H GLU 16 4.001 -0.555 8.681
132 HA GLU 16 HA GLU 16 2.074 -1.728 6.826
133 HB2 GLU 16 HB2 GLU 16 2.873 -3.778 7.841
134 HB3 GLU 16 HB3 GLU 16 2.853 -3.052 9.451
135 HG2 GLU 16 HG2 GLU 16 0.350 -2.792 9.255
136 HG3 GLU 16 HG3 GLU 16 0.423 -3.595 7.695
137 H THR 17 H THR 17 0.462 -0.210 6.973
138 HA THR 17 HA THR 17 -0.380 0.817 9.610
139 HB THR 17 HB THR 17 -0.394 3.121 8.637
140 HG1 THR 17 HG1 THR 17 0.798 3.476 6.755
141 HG21 THR 17 HG21 THR 17 2.419 1.935 8.414
142 HG22 THR 17 HG22 THR 17 1.983 3.612 8.734
143 HG23 THR 17 HG23 THR 17 1.628 2.365 9.941
144 H THR 18 H THR 18 -2.644 2.077 9.224
145 HA THR 18 HA THR 18 -4.029 0.880 6.843
146 HB THR 18 HB THR 18 -5.985 0.477 8.458
147 HG1 THR 18 HG1 THR 18 -5.283 1.497 10.309
148 HG21 THR 18 HG21 THR 18 -3.532 -1.264 8.930
149 HG22 THR 18 HG22 THR 18 -5.229 -1.721 9.153
150 HG23 THR 18 HG23 THR 18 -4.613 -1.380 7.522
151 H THR 19 H THR 19 -5.325 2.278 5.795
152 HA THR 19 HA THR 19 -6.596 4.520 7.129
153 HB THR 19 HB THR 19 -4.985 5.010 4.611
154 HG1 THR 19 HG1 THR 19 -4.166 5.436 7.319
155 HG21 THR 19 HG21 THR 19 -6.805 6.601 5.143
156 HG22 THR 19 HG22 THR 19 -6.124 6.827 6.764
157 HG23 THR 19 HG23 THR 19 -5.228 7.376 5.333
158 H GLU 20 H GLU 20 -8.620 5.025 6.053
159 HA GLU 20 HA GLU 20 -9.343 3.123 3.892
160 HB2 GLU 20 HB2 GLU 20 -11.688 3.762 4.486
161 HB3 GLU 20 HB3 GLU 20 -10.793 2.827 5.667
162 HG2 GLU 20 HG2 GLU 20 -10.414 4.889 7.020
163 HG3 GLU 20 HG3 GLU 20 -11.364 5.796 5.829
164 H ALA 21 H ALA 21 -10.648 3.889 2.170
165 HA ALA 21 HA ALA 21 -10.762 6.684 1.447
166 HB1 ALA 21 HB1 ALA 21 -8.450 6.087 0.721
167 HB2 ALA 21 HB2 ALA 21 -9.082 4.659 -0.141
168 HB3 ALA 21 HB3 ALA 21 -9.510 6.291 -0.682
169 H VAL 22 H VAL 22 -11.843 6.642 -1.015
170 HA VAL 22 HA VAL 22 -14.146 4.906 -0.707
171 HB VAL 22 HB VAL 22 -14.154 7.218 -1.719
172 HG11 VAL 22 HG11 VAL 22 -13.695 7.548 -4.066
173 HG12 VAL 22 HG12 VAL 22 -12.232 6.839 -3.359
174 HG13 VAL 22 HG13 VAL 22 -13.334 5.833 -4.312
175 HG21 VAL 22 HG21 VAL 22 -15.508 5.103 -3.419
176 HG22 VAL 22 HG22 VAL 22 -16.088 5.674 -1.847
177 HG23 VAL 22 HG23 VAL 22 -15.990 6.799 -3.211
178 H ASP 23 H ASP 23 -11.076 4.542 -2.450
179 HA ASP 23 HA ASP 23 -11.778 1.808 -3.082
180 HB2 ASP 23 HB2 ASP 23 -11.756 3.985 -5.173
181 HB3 ASP 23 HB3 ASP 23 -10.916 2.498 -5.585
182 H ALA 24 H ALA 24 -9.989 0.668 -4.022
183 HA ALA 24 HA ALA 24 -7.547 1.044 -2.705
184 HB1 ALA 24 HB1 ALA 24 -8.462 -0.627 -5.064
185 HB2 ALA 24 HB2 ALA 24 -6.749 -0.592 -4.620
186 HB3 ALA 24 HB3 ALA 24 -7.939 -1.142 -3.451
187 H ALA 25 H ALA 25 -8.542 2.143 -5.942
188 HA ALA 25 HA ALA 25 -6.014 3.001 -6.882
189 HB1 ALA 25 HB1 ALA 25 -7.320 4.362 -8.467
190 HB2 ALA 25 HB2 ALA 25 -8.038 2.744 -8.293
191 HB3 ALA 25 HB3 ALA 25 -8.782 4.132 -7.474
192 H THR 26 H THR 26 -8.447 4.702 -4.825
193 HA THR 26 HA THR 26 -7.005 7.203 -4.927
194 HB THR 26 HB THR 26 -9.175 6.096 -3.107
195 HG1 THR 26 HG1 THR 26 -10.081 8.124 -4.193
196 HG21 THR 26 HG21 THR 26 -7.802 7.629 -1.719
197 HG22 THR 26 HG22 THR 26 -7.930 8.875 -2.966
198 HG23 THR 26 HG23 THR 26 -9.373 8.315 -2.088
199 H ALA 27 H ALA 27 -7.187 4.463 -2.574
200 HA ALA 27 HA ALA 27 -5.354 5.473 -0.709
201 HB1 ALA 27 HB1 ALA 27 -5.853 2.567 -1.492
202 HB2 ALA 27 HB2 ALA 27 -5.074 3.134 -0.000
203 HB3 ALA 27 HB3 ALA 27 -6.777 3.509 -0.303
204 H GLU 28 H GLU 28 -4.691 3.467 -3.600
205 HA GLU 28 HA GLU 28 -1.934 3.081 -3.443
206 HB2 GLU 28 HB2 GLU 28 -3.471 2.047 -5.063
207 HB3 GLU 28 HB3 GLU 28 -3.802 3.607 -5.788
208 HG2 GLU 28 HG2 GLU 28 -1.347 3.702 -6.484
209 HG3 GLU 28 HG3 GLU 28 -1.245 2.004 -5.984
210 H LYS 29 H LYS 29 -3.659 5.825 -5.002
211 HA LYS 29 HA LYS 29 -1.178 7.197 -5.624
212 HB2 LYS 29 HB2 LYS 29 -4.097 8.027 -5.711
213 HB3 LYS 29 HB3 LYS 29 -2.751 9.024 -6.297
214 HG2 LYS 29 HG2 LYS 29 -2.135 7.328 -7.953
215 HG3 LYS 29 HG3 LYS 29 -3.310 6.184 -7.307
216 HD2 LYS 29 HD2 LYS 29 -4.190 7.145 -9.329
217 HD3 LYS 29 HD3 LYS 29 -5.162 7.679 -7.943
218 HE2 LYS 29 HE2 LYS 29 -3.802 9.806 -7.888
219 HE3 LYS 29 HE3 LYS 29 -2.948 9.263 -9.339
220 HZ1 LYS 29 HZ1 LYS 29 -5.095 9.320 -10.497
221 HZ2 LYS 29 HZ2 LYS 29 -5.838 9.810 -9.107
222 HZ3 LYS 29 HZ3 LYS 29 -4.725 10.773 -9.830
223 H VAL 30 H VAL 30 -3.520 7.466 -2.930
224 HA VAL 30 HA VAL 30 -2.460 9.928 -1.900
225 HB VAL 30 HB VAL 30 -4.166 7.706 -0.728
226 HG11 VAL 30 HG11 VAL 30 -4.653 9.119 1.192
227 HG12 VAL 30 HG12 VAL 30 -2.933 8.747 1.173
228 HG13 VAL 30 HG13 VAL 30 -3.502 10.346 0.643
229 HG21 VAL 30 HG21 VAL 30 -5.962 9.347 -0.872
230 HG22 VAL 30 HG22 VAL 30 -4.832 10.626 -1.350
231 HG23 VAL 30 HG23 VAL 30 -5.169 9.289 -2.451
232 H PHE 31 H PHE 31 -1.956 6.474 -0.902
233 HA PHE 31 HA PHE 31 0.058 7.085 1.000
234 HB2 PHE 31 HB2 PHE 31 -0.716 4.558 -0.500
235 HB3 PHE 31 HB3 PHE 31 0.637 4.590 0.599
236 HD1 PHE 31 HD2 PHE 31 0.121 5.714 3.016
237 HD2 PHE 31 HD1 PHE 31 -2.704 3.708 0.450
238 HE1 PHE 31 HE2 PHE 31 -1.136 4.939 4.999
239 HE2 PHE 31 HE1 PHE 31 -3.966 2.946 2.436
240 HZ PHE 31 HZ PHE 31 -3.131 3.496 4.719
241 H LYS 32 H LYS 32 0.325 7.046 -2.500
242 HA LYS 32 HA LYS 32 2.893 6.092 -2.815
243 HB2 LYS 32 HB2 LYS 32 1.419 6.757 -4.689
244 HB3 LYS 32 HB3 LYS 32 1.751 8.467 -4.345
245 HG2 LYS 32 HG2 LYS 32 4.088 8.203 -4.824
246 HG3 LYS 32 HG3 LYS 32 3.989 6.457 -4.796
247 HD2 LYS 32 HD2 LYS 32 2.628 6.481 -6.866
248 HD3 LYS 32 HD3 LYS 32 2.824 8.255 -6.946
249 HE2 LYS 32 HE2 LYS 32 5.260 8.030 -6.984
250 HE3 LYS 32 HE3 LYS 32 5.141 6.285 -6.722
251 HZ1 LYS 32 HZ1 LYS 32 4.290 7.712 -9.156
252 HZ2 LYS 32 HZ2 LYS 32 5.575 6.725 -8.990
253 HZ3 LYS 32 HZ3 LYS 32 4.057 6.101 -8.867
254 H GLN 33 H GLN 33 2.061 9.348 -1.675
255 HA GLN 33 HA GLN 33 4.706 10.400 -1.748
256 HB2 GLN 33 HB2 GLN 33 2.473 11.026 0.248
257 HB3 GLN 33 HB3 GLN 33 3.953 11.960 -0.010
258 HG2 GLN 33 HG2 GLN 33 3.207 12.219 -2.449
259 HG3 GLN 33 HG3 GLN 33 1.643 11.570 -1.948
260 HE21 GLN 33 HE22 GLN 33 0.135 13.151 -1.288
261 HE22 GLN 33 HE21 GLN 33 0.612 14.766 -0.785
262 H TYR 34 H TYR 34 2.929 8.901 0.958
263 HA TYR 34 HA TYR 34 5.015 8.754 2.832
264 HB2 TYR 34 HB2 TYR 34 2.916 8.468 3.726
265 HB3 TYR 34 HB3 TYR 34 2.342 7.462 2.416
266 HD1 TYR 34 HD2 TYR 34 4.570 7.384 5.452
267 HD2 TYR 34 HD1 TYR 34 2.369 5.084 2.521
268 HE1 TYR 34 HE2 TYR 34 4.926 5.335 6.778
269 HE2 TYR 34 HE1 TYR 34 2.749 3.035 3.838
270 HH TYR 34 HH TYR 34 3.583 2.140 5.846
271 H ALA 35 H ALA 35 3.891 6.160 0.586
272 HA ALA 35 HA ALA 35 5.705 4.223 1.432
273 HB1 ALA 35 HB1 ALA 35 5.270 3.136 -0.739
274 HB2 ALA 35 HB2 ALA 35 3.770 3.754 -0.007
275 HB3 ALA 35 HB3 ALA 35 4.531 4.633 -1.351
276 H ASN 36 H ASN 36 6.062 6.454 -1.360
277 HA ASN 36 HA ASN 36 8.705 5.601 -1.995
278 HB2 ASN 36 HB2 ASN 36 7.181 6.831 -3.543
279 HB3 ASN 36 HB3 ASN 36 7.413 8.295 -2.564
280 HD21 ASN 36 HD22 ASN 36 9.069 9.629 -3.357
281 HD22 ASN 36 HD21 ASN 36 10.486 9.025 -4.206
282 H ASP 37 H ASP 37 7.486 8.128 0.236
283 HA ASP 37 HA ASP 37 10.037 9.343 0.747
284 HB2 ASP 37 HB2 ASP 37 7.879 10.441 1.346
285 HB3 ASP 37 HB3 ASP 37 7.571 9.179 2.543
286 H ASN 38 H ASN 38 8.342 6.572 2.103
287 HA ASN 38 HA ASN 38 10.167 6.159 4.294
288 HB2 ASN 38 HB2 ASN 38 7.669 5.128 3.561
289 HB3 ASN 38 HB3 ASN 38 8.736 3.766 3.254
290 HD21 ASN 38 HD22 ASN 38 6.604 4.239 5.382
291 HD22 ASN 38 HD21 ASN 38 7.458 4.116 6.897
292 H GLY 39 H GLY 39 10.520 5.725 0.911
293 HA2 GLY 39 HA2 GLY 39 12.404 5.030 -0.210
294 HA3 GLY 39 HA3 GLY 39 13.044 4.291 1.257
295 H VAL 40 H VAL 40 9.713 3.443 0.302
296 HA VAL 40 HA VAL 40 10.759 0.825 -0.673
297 HB VAL 40 HB VAL 40 8.225 1.349 0.899
298 HG11 VAL 40 HG11 VAL 40 8.131 -1.198 0.952
299 HG12 VAL 40 HG12 VAL 40 7.859 -0.503 -0.647
300 HG13 VAL 40 HG13 VAL 40 9.430 -1.216 -0.253
301 HG21 VAL 40 HG21 VAL 40 9.363 -0.079 2.635
302 HG22 VAL 40 HG22 VAL 40 10.824 -0.047 1.630
303 HG23 VAL 40 HG23 VAL 40 10.194 1.452 2.349
304 H ASP 41 H ASP 41 10.007 0.069 -2.543
305 HA ASP 41 HA ASP 41 7.723 1.264 -3.867
306 HB2 ASP 41 HB2 ASP 41 9.643 2.804 -4.357
307 HB3 ASP 41 HB3 ASP 41 10.552 1.430 -4.994
308 H GLY 42 H GLY 42 7.394 -0.018 -6.040
309 HA2 GLY 42 HA2 GLY 42 8.634 -2.330 -6.742
310 HA3 GLY 42 HA3 GLY 42 7.602 -2.822 -5.377
311 H GLU 43 H GLU 43 6.314 -4.103 -6.825
312 HA GLU 43 HA GLU 43 4.843 -2.875 -9.026
313 HB2 GLU 43 HB2 GLU 43 5.942 -5.335 -8.599
314 HB3 GLU 43 HB3 GLU 43 4.352 -5.651 -7.943
315 HG2 GLU 43 HG2 GLU 43 3.587 -5.988 -10.032
316 HG3 GLU 43 HG3 GLU 43 3.944 -4.316 -10.456
317 H TRP 44 H TRP 44 2.835 -1.945 -8.641
318 HA TRP 44 HA TRP 44 1.625 -2.291 -5.964
319 HB2 TRP 44 HB2 TRP 44 1.393 -0.119 -8.047
320 HB3 TRP 44 HB3 TRP 44 0.394 -0.205 -6.599
321 HD1 TRP 44 HD1 TRP 44 4.068 0.247 -7.617
322 HE1 TRP 44 HE1 TRP 44 5.413 1.219 -5.714
323 HE3 TRP 44 HE3 TRP 44 0.386 0.304 -4.084
324 HZ2 TRP 44 HZ2 TRP 44 4.990 1.722 -2.840
325 HZ3 TRP 44 HZ3 TRP 44 0.873 1.016 -1.770
326 HH2 TRP 44 HH2 TRP 44 3.152 1.752 -1.142
327 H THR 45 H THR 45 0.381 -4.027 -6.013
328 HA THR 45 HA THR 45 -2.043 -4.014 -7.725
329 HB THR 45 HB THR 45 -0.453 -6.514 -7.000
330 HG1 THR 45 HG1 THR 45 0.806 -6.042 -8.569
331 HG21 THR 45 HG21 THR 45 -2.615 -5.990 -9.090
332 HG22 THR 45 HG22 THR 45 -1.719 -7.496 -8.889
333 HG23 THR 45 HG23 THR 45 -2.810 -6.948 -7.602
334 H TYR 46 H TYR 46 -3.913 -4.911 -6.627
335 HA TYR 46 HA TYR 46 -3.629 -5.242 -3.687
336 HB2 TYR 46 HB2 TYR 46 -5.643 -4.048 -3.331
337 HB3 TYR 46 HB3 TYR 46 -4.554 -3.067 -4.294
338 HD1 TYR 46 HD1 TYR 46 -5.023 -2.544 -6.657
339 HD2 TYR 46 HD2 TYR 46 -7.743 -4.926 -4.290
340 HE1 TYR 46 HE1 TYR 46 -6.712 -2.413 -8.465
341 HE2 TYR 46 HE2 TYR 46 -9.461 -4.727 -6.048
342 HH TYR 46 HH TYR 46 -9.798 -4.150 -8.304
343 H ASP 47 H ASP 47 -5.063 -6.564 -2.633
344 HA ASP 47 HA ASP 47 -6.380 -8.752 -4.177
345 HB2 ASP 47 HB2 ASP 47 -4.385 -9.585 -3.266
346 HB3 ASP 47 HB3 ASP 47 -4.570 -8.701 -1.755
347 H ASP 48 H ASP 48 -8.487 -8.091 -4.069
348 HA ASP 48 HA ASP 48 -9.550 -6.552 -1.893
349 HB2 ASP 48 HB2 ASP 48 -11.380 -6.274 -3.143
350 HB3 ASP 48 HB3 ASP 48 -10.409 -6.934 -4.454
351 H ALA 49 H ALA 49 -9.620 -10.053 -2.634
352 HA ALA 49 HA ALA 49 -11.596 -10.771 -0.741
353 HB1 ALA 49 HB1 ALA 49 -10.632 -13.054 -0.978
354 HB2 ALA 49 HB2 ALA 49 -10.912 -12.247 -2.533
355 HB3 ALA 49 HB3 ALA 49 -9.262 -12.339 -1.874
356 H THR 50 H THR 50 -7.991 -10.856 -0.411
357 HA THR 50 HA THR 50 -8.231 -11.437 2.442
358 HB THR 50 HB THR 50 -5.788 -10.554 0.913
359 HG1 THR 50 HG1 THR 50 -5.898 -12.214 -0.171
360 HG21 THR 50 HG21 THR 50 -5.373 -10.691 3.294
361 HG22 THR 50 HG22 THR 50 -6.160 -12.270 3.397
362 HG23 THR 50 HG23 THR 50 -4.619 -12.091 2.528
363 H LYS 51 H LYS 51 -8.262 -8.595 0.453
364 HA LYS 51 HA LYS 51 -8.456 -6.410 0.812
365 HB2 LYS 51 HB2 LYS 51 -8.947 -7.020 3.755
366 HB3 LYS 51 HB3 LYS 51 -9.367 -5.537 2.904
367 HG2 LYS 51 HG2 LYS 51 -11.081 -6.647 1.642
368 HG3 LYS 51 HG3 LYS 51 -10.468 -8.243 2.076
369 HD2 LYS 51 HD2 LYS 51 -11.105 -7.819 4.454
370 HD3 LYS 51 HD3 LYS 51 -11.991 -6.377 3.875
371 HE2 LYS 51 HE2 LYS 51 -13.198 -7.818 2.228
372 HE3 LYS 51 HE3 LYS 51 -12.281 -9.227 2.781
373 HZ1 LYS 51 HZ1 LYS 51 -14.424 -9.203 3.790
374 HZ2 LYS 51 HZ2 LYS 51 -13.302 -8.903 4.967
375 HZ3 LYS 51 HZ3 LYS 51 -14.220 -7.679 4.375
376 H THR 52 H THR 52 -6.022 -7.234 0.356
377 HA THR 52 HA THR 52 -4.231 -5.733 2.186
378 HB THR 52 HB THR 52 -2.579 -7.623 1.441
379 HG1 THR 52 HG1 THR 52 -3.582 -9.548 0.909
380 HG21 THR 52 HG21 THR 52 -4.832 -8.160 3.438
381 HG22 THR 52 HG22 THR 52 -3.363 -9.136 3.286
382 HG23 THR 52 HG23 THR 52 -3.234 -7.444 3.769
383 H PHE 53 H PHE 53 -2.346 -4.891 1.225
384 HA PHE 53 HA PHE 53 -2.159 -4.676 -1.698
385 HB2 PHE 53 HB2 PHE 53 -3.561 -2.791 -0.257
386 HB3 PHE 53 HB3 PHE 53 -1.959 -2.162 -0.016
387 HD1 PHE 53 HD2 PHE 53 -0.695 -2.611 -2.658
388 HD2 PHE 53 HD1 PHE 53 -4.648 -1.270 -1.652
389 HE1 PHE 53 HE2 PHE 53 -0.870 -1.522 -4.871
390 HE2 PHE 53 HE1 PHE 53 -4.772 -0.052 -3.817
391 HZ PHE 53 HZ PHE 53 -2.912 -0.222 -5.460
392 H THR 54 H THR 54 -0.069 -5.799 -1.666
393 HA THR 54 HA THR 54 1.857 -4.925 0.444
394 HB THR 54 HB THR 54 1.782 -7.518 -1.132
395 HG1 THR 54 HG1 THR 54 0.376 -7.914 0.404
396 HG21 THR 54 HG21 THR 54 3.607 -8.234 0.315
397 HG22 THR 54 HG22 THR 54 4.109 -6.755 -0.475
398 HG23 THR 54 HG23 THR 54 3.572 -6.685 1.207
399 H VAL 55 H VAL 55 3.534 -3.689 -0.221
400 HA VAL 55 HA VAL 55 3.985 -3.246 -3.079
401 HB VAL 55 HB VAL 55 5.770 -2.341 -0.748
402 HG11 VAL 55 HG11 VAL 55 6.727 -2.061 -2.988
403 HG12 VAL 55 HG12 VAL 55 5.246 -1.266 -3.561
404 HG13 VAL 55 HG13 VAL 55 6.273 -0.477 -2.343
405 HG21 VAL 55 HG21 VAL 55 3.274 -1.046 -1.822
406 HG22 VAL 55 HG22 VAL 55 3.546 -1.585 -0.162
407 HG23 VAL 55 HG23 VAL 55 4.481 -0.233 -0.775
408 H THR 56 H THR 56 4.760 -5.018 -4.061
409 HA THR 56 HA THR 56 7.028 -6.518 -2.847
410 HB THR 56 HB THR 56 5.020 -7.569 -4.863
411 HG1 THR 56 HG1 THR 56 3.959 -6.835 -2.983
412 HG21 THR 56 HG21 THR 56 6.755 -8.953 -2.768
413 HG22 THR 56 HG22 THR 56 5.701 -9.752 -3.947
414 HG23 THR 56 HG23 THR 56 7.130 -8.862 -4.504
415 H GLU 57 H GLU 57 8.854 -5.944 -3.874
416 HA GLU 57 HA GLU 57 8.812 -4.499 -6.375
417 HB2 GLU 57 HB2 GLU 57 10.425 -4.291 -4.341
418 HB3 GLU 57 HB3 GLU 57 11.208 -5.741 -5.002
419 HG2 GLU 57 HG2 GLU 57 11.514 -4.550 -7.167
420 HG3 GLU 57 HG3 GLU 57 10.772 -3.097 -6.468
Start of MODEL 17
1 H1 MET 1 H MET 1 -16.846 4.124 4.585
2 HA MET 1 HA MET 1 -16.107 2.444 3.001
3 HB2 MET 1 HB2 MET 1 -13.927 4.363 3.907
4 HB3 MET 1 HB3 MET 1 -13.835 3.398 2.436
5 HG2 MET 1 HG2 MET 1 -15.808 4.457 1.521
6 HG3 MET 1 HG3 MET 1 -16.113 5.310 3.038
7 HE1 MET 1 HE1 MET 1 -13.372 6.632 3.976
8 HE2 MET 1 HE2 MET 1 -13.604 8.187 3.158
9 HE3 MET 1 HE3 MET 1 -14.994 7.372 3.909
10 H GLY 2 H GLY 2 -14.425 0.819 2.411
11 HA2 GLY 2 HA2 GLY 2 -13.800 -0.806 4.739
12 HA3 GLY 2 HA3 GLY 2 -13.465 -1.187 3.037
13 H THR 3 H THR 3 -11.705 -1.299 5.466
14 HA THR 3 HA THR 3 -9.638 0.741 4.902
15 HB THR 3 HB THR 3 -10.037 -1.330 7.087
16 HG1 THR 3 HG1 THR 3 -9.773 1.474 7.329
17 HG21 THR 3 HG21 THR 3 -7.621 -1.140 6.792
18 HG22 THR 3 HG22 THR 3 -7.735 0.636 6.743
19 HG23 THR 3 HG23 THR 3 -8.109 -0.257 8.240
20 H TYR 4 H TYR 4 -8.026 0.332 3.564
21 HA TYR 4 HA TYR 4 -7.398 -2.459 2.742
22 HB2 TYR 4 HB2 TYR 4 -6.556 0.254 1.630
23 HB3 TYR 4 HB3 TYR 4 -6.005 -1.296 1.027
24 HD1 TYR 4 HD1 TYR 4 -7.493 -2.777 -0.279
25 HD2 TYR 4 HD2 TYR 4 -8.749 1.148 1.031
26 HE1 TYR 4 HE1 TYR 4 -9.242 -2.759 -2.019
27 HE2 TYR 4 HE2 TYR 4 -10.505 1.165 -0.721
28 HH TYR 4 HH TYR 4 -11.067 -1.664 -2.843
29 H LYS 5 H LYS 5 -5.539 -3.374 3.566
30 HA LYS 5 HA LYS 5 -3.868 -1.829 5.464
31 HB2 LYS 5 HB2 LYS 5 -3.900 -4.759 4.608
32 HB3 LYS 5 HB3 LYS 5 -2.737 -4.065 5.752
33 HG2 LYS 5 HG2 LYS 5 -4.418 -3.560 7.361
34 HG3 LYS 5 HG3 LYS 5 -5.718 -3.935 6.210
35 HD2 LYS 5 HD2 LYS 5 -4.896 -6.288 6.111
36 HD3 LYS 5 HD3 LYS 5 -3.691 -5.910 7.357
37 HE2 LYS 5 HE2 LYS 5 -5.315 -5.576 9.026
38 HE3 LYS 5 HE3 LYS 5 -6.597 -5.236 7.850
39 HZ1 LYS 5 HZ1 LYS 5 -6.617 -7.495 7.203
40 HZ2 LYS 5 HZ2 LYS 5 -5.380 -7.895 8.212
41 HZ3 LYS 5 HZ3 LYS 5 -6.860 -7.427 8.820
42 H LEU 6 H LEU 6 -2.159 -0.740 4.716
43 HA LEU 6 HA LEU 6 -1.043 -1.417 2.080
44 HB2 LEU 6 HB2 LEU 6 -1.702 0.970 2.871
45 HB3 LEU 6 HB3 LEU 6 -0.268 0.906 3.866
46 HG LEU 6 HG LEU 6 0.294 2.082 1.894
47 HD11 LEU 6 HD11 LEU 6 2.086 0.944 0.873
48 HD12 LEU 6 HD12 LEU 6 2.035 0.396 2.552
49 HD13 LEU 6 HD13 LEU 6 1.420 -0.649 1.243
50 HD21 LEU 6 HD21 LEU 6 0.012 1.112 -0.392
51 HD22 LEU 6 HD22 LEU 6 -0.939 -0.192 0.293
52 HD23 LEU 6 HD23 LEU 6 -1.511 1.490 0.414
53 H ILE 7 H ILE 7 0.666 -2.866 2.100
54 HA ILE 7 HA ILE 7 2.452 -2.879 4.506
55 HB ILE 7 HB ILE 7 1.669 -5.212 2.725
56 HG12 ILE 7 HG12 ILE 7 1.221 -6.304 4.984
57 HG13 ILE 7 HG13 ILE 7 1.379 -4.719 5.729
58 HG21 ILE 7 HG21 ILE 7 3.823 -5.084 4.892
59 HG22 ILE 7 HG22 ILE 7 3.275 -6.557 4.067
60 HG23 ILE 7 HG23 ILE 7 4.110 -5.313 3.159
61 HD11 ILE 7 HD11 ILE 7 -0.631 -3.957 4.690
62 HD12 ILE 7 HD12 ILE 7 -0.649 -5.307 3.528
63 HD13 ILE 7 HD13 ILE 7 -0.973 -5.594 5.253
64 H LEU 8 H LEU 8 4.544 -2.598 4.127
65 HA LEU 8 HA LEU 8 5.463 -1.937 1.359
66 HB2 LEU 8 HB2 LEU 8 5.649 -0.535 3.923
67 HB3 LEU 8 HB3 LEU 8 7.259 -1.052 3.433
68 HG LEU 8 HG LEU 8 6.883 0.004 1.209
69 HD11 LEU 8 HD11 LEU 8 4.442 0.058 1.127
70 HD12 LEU 8 HD12 LEU 8 4.393 1.105 2.556
71 HD13 LEU 8 HD13 LEU 8 5.070 1.705 1.026
72 HD21 LEU 8 HD21 LEU 8 8.100 1.113 3.123
73 HD22 LEU 8 HD22 LEU 8 7.336 2.266 2.033
74 HD23 LEU 8 HD23 LEU 8 6.573 1.890 3.592
75 H ASN 9 H ASN 9 6.810 -3.549 0.527
76 HA ASN 9 HA ASN 9 8.326 -5.192 2.505
77 HB2 ASN 9 HB2 ASN 9 6.281 -6.320 1.561
78 HB3 ASN 9 HB3 ASN 9 7.007 -6.206 -0.041
79 HD21 ASN 9 HD22 ASN 9 9.400 -7.130 -0.112
80 HD22 ASN 9 HD21 ASN 9 9.589 -8.668 0.692
81 H GLY 10 H GLY 10 10.091 -3.619 2.161
82 HA2 GLY 10 HA2 GLY 10 11.264 -3.649 -0.546
83 HA3 GLY 10 HA3 GLY 10 11.596 -2.497 0.743
84 H LYS 11 H LYS 11 13.546 -3.951 -0.717
85 HA LYS 11 HA LYS 11 14.642 -6.164 0.584
86 HB2 LYS 11 HB2 LYS 11 16.729 -5.701 -0.560
87 HB3 LYS 11 HB3 LYS 11 15.403 -5.518 -1.654
88 HG2 LYS 11 HG2 LYS 11 16.667 -3.083 -0.347
89 HG3 LYS 11 HG3 LYS 11 17.369 -3.869 -1.755
90 HD2 LYS 11 HD2 LYS 11 15.162 -3.581 -2.952
91 HD3 LYS 11 HD3 LYS 11 14.648 -2.576 -1.579
92 HE2 LYS 11 HE2 LYS 11 16.712 -1.141 -2.042
93 HE3 LYS 11 HE3 LYS 11 16.914 -2.084 -3.538
94 HZ1 LYS 11 HZ1 LYS 11 14.633 -0.338 -2.832
95 HZ2 LYS 11 HZ2 LYS 11 15.702 -0.163 -4.087
96 HZ3 LYS 11 HZ3 LYS 11 14.590 -1.348 -4.105
97 H THR 12 H THR 12 14.522 -3.087 2.020
98 HA THR 12 HA THR 12 16.630 -3.935 3.943
99 HB THR 12 HB THR 12 17.235 -1.387 3.970
100 HG1 THR 12 HG1 THR 12 16.994 -0.441 1.908
101 HG21 THR 12 HG21 THR 12 18.963 -1.701 2.288
102 HG22 THR 12 HG22 THR 12 18.752 -3.214 3.186
103 HG23 THR 12 HG23 THR 12 18.074 -3.050 1.552
104 H LEU 13 H LEU 13 13.499 -2.349 3.433
105 HA LEU 13 HA LEU 13 13.123 -2.379 6.300
106 HB2 LEU 13 HB2 LEU 13 12.511 -0.138 6.589
107 HB3 LEU 13 HB3 LEU 13 14.072 -0.120 5.824
108 HG LEU 13 HG LEU 13 12.871 1.653 4.938
109 HD11 LEU 13 HD11 LEU 13 14.137 0.410 3.234
110 HD12 LEU 13 HD12 LEU 13 12.642 -0.432 2.753
111 HD13 LEU 13 HD13 LEU 13 12.781 1.326 2.570
112 HD21 LEU 13 HD21 LEU 13 10.706 1.730 4.054
113 HD22 LEU 13 HD22 LEU 13 10.498 -0.022 4.091
114 HD23 LEU 13 HD23 LEU 13 10.591 0.904 5.610
115 H LYS 14 H LYS 14 10.881 -2.153 6.858
116 HA LYS 14 HA LYS 14 8.958 -2.609 4.645
117 HB2 LYS 14 HB2 LYS 14 9.229 -4.345 7.144
118 HB3 LYS 14 HB3 LYS 14 7.901 -4.420 5.977
119 HG2 LYS 14 HG2 LYS 14 9.781 -4.729 4.177
120 HG3 LYS 14 HG3 LYS 14 10.821 -5.124 5.556
121 HD2 LYS 14 HD2 LYS 14 9.213 -6.927 6.184
122 HD3 LYS 14 HD3 LYS 14 8.238 -6.533 4.745
123 HE2 LYS 14 HE2 LYS 14 10.329 -6.890 3.347
124 HE3 LYS 14 HE3 LYS 14 11.162 -7.422 4.807
125 HZ1 LYS 14 HZ1 LYS 14 8.810 -8.735 3.586
126 HZ2 LYS 14 HZ2 LYS 14 10.384 -9.224 3.532
127 HZ3 LYS 14 HZ3 LYS 14 9.598 -9.242 4.974
128 H GLY 15 H GLY 15 6.625 -2.428 5.492
129 HA2 GLY 15 HA2 GLY 15 6.332 -0.676 7.832
130 HA3 GLY 15 HA3 GLY 15 5.995 0.058 6.266
131 H GLU 16 H GLU 16 4.061 -0.311 8.310
132 HA GLU 16 HA GLU 16 2.060 -1.909 6.839
133 HB2 GLU 16 HB2 GLU 16 3.084 -3.474 8.499
134 HB3 GLU 16 HB3 GLU 16 2.722 -2.320 9.790
135 HG2 GLU 16 HG2 GLU 16 0.258 -2.519 9.124
136 HG3 GLU 16 HG3 GLU 16 0.734 -3.806 8.014
137 H THR 17 H THR 17 0.379 -0.412 6.582
138 HA THR 17 HA THR 17 -0.437 1.239 8.880
139 HB THR 17 HB THR 17 -0.599 3.222 7.291
140 HG1 THR 17 HG1 THR 17 0.711 3.228 5.520
141 HG21 THR 17 HG21 THR 17 1.668 3.987 7.616
142 HG22 THR 17 HG22 THR 17 1.171 3.074 9.049
143 HG23 THR 17 HG23 THR 17 2.263 2.338 7.856
144 H THR 18 H THR 18 -2.666 2.361 8.238
145 HA THR 18 HA THR 18 -4.169 0.712 6.279
146 HB THR 18 HB THR 18 -5.971 0.780 8.239
147 HG1 THR 18 HG1 THR 18 -4.562 1.822 9.746
148 HG21 THR 18 HG21 THR 18 -3.761 -1.294 8.241
149 HG22 THR 18 HG22 THR 18 -5.423 -1.480 8.857
150 HG23 THR 18 HG23 THR 18 -5.158 -1.246 7.133
151 H THR 19 H THR 19 -5.802 1.838 5.253
152 HA THR 19 HA THR 19 -6.856 4.276 6.357
153 HB THR 19 HB THR 19 -5.091 4.357 3.925
154 HG1 THR 19 HG1 THR 19 -4.676 4.772 6.391
155 HG21 THR 19 HG21 THR 19 -5.771 6.766 3.729
156 HG22 THR 19 HG22 THR 19 -7.084 5.651 3.322
157 HG23 THR 19 HG23 THR 19 -7.072 6.455 4.900
158 H GLU 20 H GLU 20 -8.978 4.673 5.560
159 HA GLU 20 HA GLU 20 -9.976 2.491 3.861
160 HB2 GLU 20 HB2 GLU 20 -12.187 2.986 4.698
161 HB3 GLU 20 HB3 GLU 20 -11.089 2.595 5.996
162 HG2 GLU 20 HG2 GLU 20 -10.943 4.978 6.622
163 HG3 GLU 20 HG3 GLU 20 -12.028 5.395 5.291
164 H ALA 21 H ALA 21 -11.197 2.804 2.022
165 HA ALA 21 HA ALA 21 -11.688 5.521 1.089
166 HB1 ALA 21 HB1 ALA 21 -9.323 5.217 0.439
167 HB2 ALA 21 HB2 ALA 21 -9.728 3.666 -0.347
168 HB3 ALA 21 HB3 ALA 21 -10.387 5.183 -0.980
169 H VAL 22 H VAL 22 -12.700 5.508 -1.044
170 HA VAL 22 HA VAL 22 -14.861 3.613 -1.151
171 HB VAL 22 HB VAL 22 -14.999 6.020 -1.773
172 HG11 VAL 22 HG11 VAL 22 -14.276 6.810 -3.985
173 HG12 VAL 22 HG12 VAL 22 -12.868 6.259 -3.063
174 HG13 VAL 22 HG13 VAL 22 -13.555 5.255 -4.355
175 HG21 VAL 22 HG21 VAL 22 -15.830 4.164 -4.039
176 HG22 VAL 22 HG22 VAL 22 -16.707 4.392 -2.511
177 HG23 VAL 22 HG23 VAL 22 -16.529 5.745 -3.634
178 H ASP 23 H ASP 23 -11.703 3.901 -2.866
179 HA ASP 23 HA ASP 23 -12.063 1.209 -3.947
180 HB2 ASP 23 HB2 ASP 23 -13.022 3.102 -5.523
181 HB3 ASP 23 HB3 ASP 23 -11.326 3.495 -5.816
182 H ALA 24 H ALA 24 -9.967 0.549 -4.973
183 HA ALA 24 HA ALA 24 -7.775 1.113 -3.239
184 HB1 ALA 24 HB1 ALA 24 -8.051 -1.028 -4.460
185 HB2 ALA 24 HB2 ALA 24 -7.729 -0.177 -5.988
186 HB3 ALA 24 HB3 ALA 24 -6.460 -0.299 -4.762
187 H ALA 25 H ALA 25 -8.783 2.620 -6.258
188 HA ALA 25 HA ALA 25 -6.457 3.846 -7.168
189 HB1 ALA 25 HB1 ALA 25 -8.031 5.646 -8.002
190 HB2 ALA 25 HB2 ALA 25 -8.527 3.994 -8.401
191 HB3 ALA 25 HB3 ALA 25 -9.336 4.878 -7.085
192 H THR 26 H THR 26 -8.591 4.949 -4.468
193 HA THR 26 HA THR 26 -7.170 7.453 -4.143
194 HB THR 26 HB THR 26 -8.897 5.933 -2.183
195 HG1 THR 26 HG1 THR 26 -9.607 7.747 -4.252
196 HG21 THR 26 HG21 THR 26 -9.452 8.145 -1.254
197 HG22 THR 26 HG22 THR 26 -7.714 7.866 -1.183
198 HG23 THR 26 HG23 THR 26 -8.376 8.928 -2.436
199 H ALA 27 H ALA 27 -7.113 4.225 -2.501
200 HA ALA 27 HA ALA 27 -5.172 4.881 -0.592
201 HB1 ALA 27 HB1 ALA 27 -6.551 2.869 -0.424
202 HB2 ALA 27 HB2 ALA 27 -5.769 2.182 -1.866
203 HB3 ALA 27 HB3 ALA 27 -4.829 2.440 -0.383
204 H GLU 28 H GLU 28 -4.735 3.513 -3.816
205 HA GLU 28 HA GLU 28 -2.007 3.006 -3.937
206 HB2 GLU 28 HB2 GLU 28 -3.674 2.421 -5.660
207 HB3 GLU 28 HB3 GLU 28 -4.050 4.107 -5.904
208 HG2 GLU 28 HG2 GLU 28 -1.486 4.246 -6.690
209 HG3 GLU 28 HG3 GLU 28 -1.744 2.528 -6.980
210 H LYS 29 H LYS 29 -3.691 6.021 -4.966
211 HA LYS 29 HA LYS 29 -1.144 7.364 -5.272
212 HB2 LYS 29 HB2 LYS 29 -3.978 8.421 -5.501
213 HB3 LYS 29 HB3 LYS 29 -2.504 9.365 -5.812
214 HG2 LYS 29 HG2 LYS 29 -1.768 7.539 -7.436
215 HG3 LYS 29 HG3 LYS 29 -3.385 6.829 -7.258
216 HD2 LYS 29 HD2 LYS 29 -4.383 8.924 -8.055
217 HD3 LYS 29 HD3 LYS 29 -2.776 9.648 -8.246
218 HE2 LYS 29 HE2 LYS 29 -2.165 7.997 -9.911
219 HE3 LYS 29 HE3 LYS 29 -3.631 7.057 -9.612
220 HZ1 LYS 29 HZ1 LYS 29 -4.928 8.855 -10.504
221 HZ2 LYS 29 HZ2 LYS 29 -3.590 9.812 -10.685
222 HZ3 LYS 29 HZ3 LYS 29 -3.781 8.422 -11.582
223 H VAL 30 H VAL 30 -3.540 7.414 -2.595
224 HA VAL 30 HA VAL 30 -2.370 9.727 -1.367
225 HB VAL 30 HB VAL 30 -4.103 7.462 -0.357
226 HG11 VAL 30 HG11 VAL 30 -4.504 8.734 1.716
227 HG12 VAL 30 HG12 VAL 30 -2.829 8.192 1.623
228 HG13 VAL 30 HG13 VAL 30 -3.233 9.883 1.260
229 HG21 VAL 30 HG21 VAL 30 -5.800 9.278 -0.250
230 HG22 VAL 30 HG22 VAL 30 -4.592 10.463 -0.763
231 HG23 VAL 30 HG23 VAL 30 -5.130 9.192 -1.878
232 H PHE 31 H PHE 31 -1.783 6.186 -0.601
233 HA PHE 31 HA PHE 31 0.358 6.963 1.156
234 HB2 PHE 31 HB2 PHE 31 -0.679 4.346 0.079
235 HB3 PHE 31 HB3 PHE 31 0.889 4.373 0.846
236 HD1 PHE 31 HD2 PHE 31 0.741 6.126 3.142
237 HD2 PHE 31 HD1 PHE 31 -2.183 3.344 1.607
238 HE1 PHE 31 HE2 PHE 31 -0.164 5.846 5.396
239 HE2 PHE 31 HE1 PHE 31 -3.067 3.034 3.910
240 HZ PHE 31 HZ PHE 31 -2.081 4.307 5.804
241 H LYS 32 H LYS 32 0.443 6.942 -2.267
242 HA LYS 32 HA LYS 32 2.918 5.819 -2.809
243 HB2 LYS 32 HB2 LYS 32 1.310 6.606 -4.490
244 HB3 LYS 32 HB3 LYS 32 1.748 8.288 -4.144
245 HG2 LYS 32 HG2 LYS 32 3.984 7.956 -4.947
246 HG3 LYS 32 HG3 LYS 32 3.797 6.191 -4.945
247 HD2 LYS 32 HD2 LYS 32 2.261 6.252 -6.799
248 HD3 LYS 32 HD3 LYS 32 2.204 8.032 -6.774
249 HE2 LYS 32 HE2 LYS 32 4.558 8.187 -7.357
250 HE3 LYS 32 HE3 LYS 32 4.778 6.445 -7.156
251 HZ1 LYS 32 HZ1 LYS 32 3.067 7.636 -9.255
252 HZ2 LYS 32 HZ2 LYS 32 4.613 7.061 -9.458
253 HZ3 LYS 32 HZ3 LYS 32 3.415 6.052 -9.040
254 H GLN 33 H GLN 33 2.355 9.091 -1.563
255 HA GLN 33 HA GLN 33 4.965 10.157 -1.648
256 HB2 GLN 33 HB2 GLN 33 2.593 10.411 0.243
257 HB3 GLN 33 HB3 GLN 33 4.090 11.211 0.648
258 HG2 GLN 33 HG2 GLN 33 3.922 12.775 -1.079
259 HG3 GLN 33 HG3 GLN 33 2.842 11.784 -2.032
260 HE21 GLN 33 HE22 GLN 33 0.642 12.228 -1.833
261 HE22 GLN 33 HE21 GLN 33 -0.128 12.992 -0.467
262 H TYR 34 H TYR 34 3.354 8.560 1.132
263 HA TYR 34 HA TYR 34 5.547 8.318 2.803
264 HB2 TYR 34 HB2 TYR 34 3.630 7.926 3.918
265 HB3 TYR 34 HB3 TYR 34 2.844 7.109 2.582
266 HD1 TYR 34 HD2 TYR 34 5.484 6.605 5.228
267 HD2 TYR 34 HD1 TYR 34 2.644 4.767 2.544
268 HE1 TYR 34 HE2 TYR 34 5.908 4.405 6.283
269 HE2 TYR 34 HE1 TYR 34 3.032 2.592 3.607
270 HH TYR 34 HH TYR 34 4.028 1.501 5.425
271 H ALA 35 H ALA 35 4.392 5.883 0.396
272 HA ALA 35 HA ALA 35 6.177 3.871 1.165
273 HB1 ALA 35 HB1 ALA 35 5.845 2.949 -1.090
274 HB2 ALA 35 HB2 ALA 35 4.310 3.568 -0.442
275 HB3 ALA 35 HB3 ALA 35 5.220 4.511 -1.651
276 H ASN 36 H ASN 36 6.718 6.261 -1.509
277 HA ASN 36 HA ASN 36 9.452 5.393 -1.749
278 HB2 ASN 36 HB2 ASN 36 8.180 6.440 -3.598
279 HB3 ASN 36 HB3 ASN 36 8.335 8.019 -2.782
280 HD21 ASN 36 HD22 ASN 36 10.087 9.183 -3.723
281 HD22 ASN 36 HD21 ASN 36 11.546 8.394 -4.306
282 H ASP 37 H ASP 37 7.906 7.901 0.220
283 HA ASP 37 HA ASP 37 10.264 9.371 0.863
284 HB2 ASP 37 HB2 ASP 37 7.995 10.233 1.267
285 HB3 ASP 37 HB3 ASP 37 7.722 8.977 2.497
286 H ASN 38 H ASN 38 8.855 6.364 2.024
287 HA ASN 38 HA ASN 38 10.655 6.134 4.319
288 HB2 ASN 38 HB2 ASN 38 8.203 5.383 4.228
289 HB3 ASN 38 HB3 ASN 38 8.763 4.033 3.228
290 HD21 ASN 38 HD22 ASN 38 7.737 2.853 5.157
291 HD22 ASN 38 HD21 ASN 38 8.761 2.578 6.557
292 H GLY 39 H GLY 39 10.819 5.445 0.954
293 HA2 GLY 39 HA2 GLY 39 12.885 4.812 -0.026
294 HA3 GLY 39 HA3 GLY 39 13.275 3.814 1.362
295 H VAL 40 H VAL 40 9.980 3.428 0.005
296 HA VAL 40 HA VAL 40 10.963 1.012 -1.415
297 HB VAL 40 HB VAL 40 8.470 1.145 0.268
298 HG11 VAL 40 HG11 VAL 40 9.851 -1.191 -1.144
299 HG12 VAL 40 HG12 VAL 40 8.445 -1.341 -0.074
300 HG13 VAL 40 HG13 VAL 40 8.297 -0.466 -1.597
301 HG21 VAL 40 HG21 VAL 40 10.367 1.132 1.791
302 HG22 VAL 40 HG22 VAL 40 9.649 -0.483 1.786
303 HG23 VAL 40 HG23 VAL 40 11.145 -0.174 0.877
304 H ASP 41 H ASP 41 10.312 0.815 -3.389
305 HA ASP 41 HA ASP 41 7.870 2.045 -4.413
306 HB2 ASP 41 HB2 ASP 41 9.616 3.725 -4.895
307 HB3 ASP 41 HB3 ASP 41 10.665 2.465 -5.574
308 H GLY 42 H GLY 42 6.922 0.389 -5.629
309 HA2 GLY 42 HA2 GLY 42 8.464 -1.626 -6.976
310 HA3 GLY 42 HA3 GLY 42 7.765 -2.212 -5.444
311 H GLU 43 H GLU 43 6.537 -3.691 -6.645
312 HA GLU 43 HA GLU 43 4.453 -2.796 -8.483
313 HB2 GLU 43 HB2 GLU 43 5.845 -4.814 -8.799
314 HB3 GLU 43 HB3 GLU 43 5.224 -5.489 -7.285
315 HG2 GLU 43 HG2 GLU 43 2.964 -5.566 -8.227
316 HG3 GLU 43 HG3 GLU 43 3.530 -4.775 -9.709
317 H TRP 44 H TRP 44 2.722 -1.771 -7.528
318 HA TRP 44 HA TRP 44 1.805 -2.412 -4.816
319 HB2 TRP 44 HB2 TRP 44 0.817 -0.463 -6.958
320 HB3 TRP 44 HB3 TRP 44 0.112 -0.653 -5.376
321 HD1 TRP 44 HD1 TRP 44 3.669 0.218 -6.632
322 HE1 TRP 44 HE1 TRP 44 4.556 2.175 -5.184
323 HE3 TRP 44 HE3 TRP 44 -0.403 0.917 -3.613
324 HZ2 TRP 44 HZ2 TRP 44 3.668 3.712 -3.006
325 HZ3 TRP 44 HZ3 TRP 44 -0.391 2.731 -1.920
326 HH2 TRP 44 HH2 TRP 44 1.678 4.042 -1.522
327 H THR 45 H THR 45 0.762 -4.462 -4.844
328 HA THR 45 HA THR 45 -1.421 -4.752 -6.883
329 HB THR 45 HB THR 45 0.162 -6.941 -5.530
330 HG1 THR 45 HG1 THR 45 1.293 -6.978 -7.343
331 HG21 THR 45 HG21 THR 45 -1.882 -6.993 -7.808
332 HG22 THR 45 HG22 THR 45 -0.916 -8.370 -7.257
333 HG23 THR 45 HG23 THR 45 -2.135 -7.662 -6.181
334 H TYR 46 H TYR 46 -3.414 -4.589 -6.170
335 HA TYR 46 HA TYR 46 -4.001 -4.749 -3.281
336 HB2 TYR 46 HB2 TYR 46 -6.125 -3.657 -3.965
337 HB3 TYR 46 HB3 TYR 46 -4.719 -2.693 -4.330
338 HD1 TYR 46 HD2 TYR 46 -7.456 -4.724 -5.789
339 HD2 TYR 46 HD1 TYR 46 -4.070 -2.182 -6.666
340 HE1 TYR 46 HE2 TYR 46 -8.143 -4.626 -8.132
341 HE2 TYR 46 HE1 TYR 46 -4.762 -2.087 -9.041
342 HH TYR 46 HH TYR 46 -7.628 -3.925 -10.232
343 H ASP 47 H ASP 47 -5.596 -6.127 -2.512
344 HA ASP 47 HA ASP 47 -6.980 -7.983 -4.336
345 HB2 ASP 47 HB2 ASP 47 -4.883 -9.146 -3.648
346 HB3 ASP 47 HB3 ASP 47 -5.325 -8.926 -1.950
347 H ASP 48 H ASP 48 -9.107 -7.443 -3.769
348 HA ASP 48 HA ASP 48 -9.584 -6.257 -1.175
349 HB2 ASP 48 HB2 ASP 48 -11.529 -5.512 -1.912
350 HB3 ASP 48 HB3 ASP 48 -10.785 -5.784 -3.473
351 H ALA 49 H ALA 49 -10.015 -9.585 -2.399
352 HA ALA 49 HA ALA 49 -11.785 -10.409 -0.284
353 HB1 ALA 49 HB1 ALA 49 -11.183 -12.690 -0.956
354 HB2 ALA 49 HB2 ALA 49 -11.511 -11.695 -2.388
355 HB3 ALA 49 HB3 ALA 49 -9.834 -12.078 -1.925
356 H THR 50 H THR 50 -8.220 -10.536 -0.726
357 HA THR 50 HA THR 50 -7.742 -11.575 1.972
358 HB THR 50 HB THR 50 -5.786 -10.301 -0.004
359 HG1 THR 50 HG1 THR 50 -5.678 -12.184 -0.996
360 HG21 THR 50 HG21 THR 50 -5.415 -12.431 2.155
361 HG22 THR 50 HG22 THR 50 -4.149 -11.850 1.055
362 HG23 THR 50 HG23 THR 50 -4.829 -10.755 2.261
363 H LYS 51 H LYS 51 -8.343 -8.563 0.475
364 HA LYS 51 HA LYS 51 -8.433 -6.443 1.033
365 HB2 LYS 51 HB2 LYS 51 -10.018 -7.540 2.570
366 HB3 LYS 51 HB3 LYS 51 -8.806 -7.563 3.828
367 HG2 LYS 51 HG2 LYS 51 -8.754 -5.032 3.750
368 HG3 LYS 51 HG3 LYS 51 -9.900 -5.096 2.413
369 HD2 LYS 51 HD2 LYS 51 -11.164 -6.678 4.367
370 HD3 LYS 51 HD3 LYS 51 -10.329 -5.469 5.338
371 HE2 LYS 51 HE2 LYS 51 -12.484 -4.610 4.826
372 HE3 LYS 51 HE3 LYS 51 -11.335 -3.680 3.846
373 HZ1 LYS 51 HZ1 LYS 51 -12.941 -5.990 2.898
374 HZ2 LYS 51 HZ2 LYS 51 -13.346 -4.424 2.723
375 HZ3 LYS 51 HZ3 LYS 51 -12.004 -4.993 1.941
376 H THR 52 H THR 52 -5.983 -7.104 0.426
377 HA THR 52 HA THR 52 -4.269 -5.519 2.252
378 HB THR 52 HB THR 52 -2.457 -7.239 1.440
379 HG1 THR 52 HG1 THR 52 -3.310 -8.754 0.251
380 HG21 THR 52 HG21 THR 52 -4.570 -8.040 3.494
381 HG22 THR 52 HG22 THR 52 -2.943 -8.721 3.358
382 HG23 THR 52 HG23 THR 52 -3.151 -7.013 3.792
383 H PHE 53 H PHE 53 -2.519 -4.432 1.192
384 HA PHE 53 HA PHE 53 -2.548 -4.305 -1.727
385 HB2 PHE 53 HB2 PHE 53 -4.136 -2.558 -0.598
386 HB3 PHE 53 HB3 PHE 53 -2.673 -1.779 -0.039
387 HD1 PHE 53 HD2 PHE 53 -1.578 -2.887 -3.162
388 HD2 PHE 53 HD1 PHE 53 -4.526 -0.212 -1.473
389 HE1 PHE 53 HE2 PHE 53 -1.792 -1.732 -5.318
390 HE2 PHE 53 HE1 PHE 53 -4.608 1.016 -3.619
391 HZ PHE 53 HZ PHE 53 -3.264 0.234 -5.560
392 H THR 54 H THR 54 -0.431 -5.140 -1.853
393 HA THR 54 HA THR 54 1.539 -4.012 0.068
394 HB THR 54 HB THR 54 1.552 -6.720 -1.237
395 HG1 THR 54 HG1 THR 54 0.606 -7.441 0.500
396 HG21 THR 54 HG21 THR 54 3.237 -7.242 0.529
397 HG22 THR 54 HG22 THR 54 3.812 -6.023 -0.608
398 HG23 THR 54 HG23 THR 54 3.250 -5.527 0.993
399 H VAL 55 H VAL 55 3.396 -3.202 -0.569
400 HA VAL 55 HA VAL 55 3.854 -2.733 -3.471
401 HB VAL 55 HB VAL 55 5.218 -1.416 -1.055
402 HG11 VAL 55 HG11 VAL 55 6.482 -1.336 -3.183
403 HG12 VAL 55 HG12 VAL 55 5.069 -0.639 -4.005
404 HG13 VAL 55 HG13 VAL 55 5.905 0.273 -2.724
405 HG21 VAL 55 HG21 VAL 55 2.839 -0.425 -2.649
406 HG22 VAL 55 HG22 VAL 55 2.905 -0.774 -0.896
407 HG23 VAL 55 HG23 VAL 55 3.813 0.584 -1.559
408 H THR 56 H THR 56 4.936 -4.582 -4.165
409 HA THR 56 HA THR 56 7.078 -5.673 -2.397
410 HB THR 56 HB THR 56 5.671 -7.190 -4.603
411 HG1 THR 56 HG1 THR 56 4.012 -6.987 -3.406
412 HG21 THR 56 HG21 THR 56 7.136 -8.095 -2.076
413 HG22 THR 56 HG22 THR 56 6.419 -9.144 -3.320
414 HG23 THR 56 HG23 THR 56 7.806 -8.127 -3.728
415 H GLU 57 H GLU 57 9.133 -5.526 -3.117
416 HA GLU 57 HA GLU 57 9.764 -5.223 -5.975
417 HB2 GLU 57 HB2 GLU 57 9.592 -2.939 -4.946
418 HB3 GLU 57 HB3 GLU 57 10.635 -3.444 -3.661
419 HG2 GLU 57 HG2 GLU 57 12.233 -3.988 -5.853
420 HG3 GLU 57 HG3 GLU 57 11.242 -2.708 -6.516
Start of MODEL 18
1 H1 MET 1 H MET 1 -16.519 2.993 6.293
2 HA MET 1 HA MET 1 -16.224 1.848 4.286
3 HB2 MET 1 HB2 MET 1 -14.055 3.988 4.434
4 HB3 MET 1 HB3 MET 1 -14.629 3.239 2.960
5 HG2 MET 1 HG2 MET 1 -16.928 4.018 3.456
6 HG3 MET 1 HG3 MET 1 -16.327 4.831 4.911
7 HE1 MET 1 HE1 MET 1 -15.790 6.031 0.521
8 HE2 MET 1 HE2 MET 1 -14.863 4.651 1.141
9 HE3 MET 1 HE3 MET 1 -16.638 4.608 1.158
10 H GLY 2 H GLY 2 -14.623 0.969 2.645
11 HA2 GLY 2 HA2 GLY 2 -13.431 -1.380 3.508
12 HA3 GLY 2 HA3 GLY 2 -13.108 -0.524 1.988
13 H THR 3 H THR 3 -11.705 -1.570 4.870
14 HA THR 3 HA THR 3 -9.572 0.493 4.888
15 HB THR 3 HB THR 3 -10.334 -1.814 6.736
16 HG1 THR 3 HG1 THR 3 -11.491 0.198 6.815
17 HG21 THR 3 HG21 THR 3 -7.925 -1.746 6.852
18 HG22 THR 3 HG22 THR 3 -7.905 0.032 6.874
19 HG23 THR 3 HG23 THR 3 -8.535 -0.893 8.264
20 H TYR 4 H TYR 4 -8.071 0.211 3.395
21 HA TYR 4 HA TYR 4 -7.267 -2.495 2.503
22 HB2 TYR 4 HB2 TYR 4 -6.577 0.272 1.442
23 HB3 TYR 4 HB3 TYR 4 -5.992 -1.244 0.779
24 HD1 TYR 4 HD2 TYR 4 -8.963 0.971 1.167
25 HD2 TYR 4 HD1 TYR 4 -7.367 -2.589 -0.709
26 HE1 TYR 4 HE2 TYR 4 -10.838 0.982 -0.451
27 HE2 TYR 4 HE1 TYR 4 -9.235 -2.576 -2.320
28 HH TYR 4 HH TYR 4 -11.319 -1.654 -2.811
29 H LYS 5 H LYS 5 -5.629 -3.366 3.615
30 HA LYS 5 HA LYS 5 -3.915 -1.812 5.451
31 HB2 LYS 5 HB2 LYS 5 -3.934 -4.730 4.620
32 HB3 LYS 5 HB3 LYS 5 -2.957 -4.067 5.923
33 HG2 LYS 5 HG2 LYS 5 -4.807 -3.774 7.347
34 HG3 LYS 5 HG3 LYS 5 -5.986 -3.836 6.019
35 HD2 LYS 5 HD2 LYS 5 -5.513 -6.197 5.633
36 HD3 LYS 5 HD3 LYS 5 -4.249 -6.184 6.892
37 HE2 LYS 5 HE2 LYS 5 -5.898 -5.692 8.611
38 HE3 LYS 5 HE3 LYS 5 -7.186 -5.540 7.388
39 HZ1 LYS 5 HZ1 LYS 5 -6.960 -7.832 6.882
40 HZ2 LYS 5 HZ2 LYS 5 -5.630 -8.004 7.844
41 HZ3 LYS 5 HZ3 LYS 5 -7.131 -7.714 8.494
42 H LEU 6 H LEU 6 -2.217 -0.684 4.557
43 HA LEU 6 HA LEU 6 -1.056 -1.571 1.999
44 HB2 LEU 6 HB2 LEU 6 -1.704 0.820 2.556
45 HB3 LEU 6 HB3 LEU 6 -0.349 0.856 3.668
46 HG LEU 6 HG LEU 6 0.353 1.910 1.702
47 HD11 LEU 6 HD11 LEU 6 2.219 0.775 0.883
48 HD12 LEU 6 HD12 LEU 6 2.028 0.228 2.564
49 HD13 LEU 6 HD13 LEU 6 1.543 -0.823 1.207
50 HD21 LEU 6 HD21 LEU 6 -1.364 1.152 0.130
51 HD22 LEU 6 HD22 LEU 6 0.253 0.997 -0.564
52 HD23 LEU 6 HD23 LEU 6 -0.580 -0.441 0.025
53 H ILE 7 H ILE 7 0.659 -2.959 2.071
54 HA ILE 7 HA ILE 7 2.468 -2.936 4.451
55 HB ILE 7 HB ILE 7 1.392 -5.260 2.834
56 HG12 ILE 7 HG12 ILE 7 1.238 -6.292 5.138
57 HG13 ILE 7 HG13 ILE 7 1.718 -4.752 5.827
58 HG21 ILE 7 HG21 ILE 7 3.914 -5.268 4.561
59 HG22 ILE 7 HG22 ILE 7 3.101 -6.716 3.929
60 HG23 ILE 7 HG23 ILE 7 3.831 -5.578 2.815
61 HD11 ILE 7 HD11 ILE 7 -0.761 -5.328 5.864
62 HD12 ILE 7 HD12 ILE 7 -0.382 -3.746 5.183
63 HD13 ILE 7 HD13 ILE 7 -0.776 -5.109 4.101
64 H LEU 8 H LEU 8 4.356 -2.212 4.011
65 HA LEU 8 HA LEU 8 5.409 -1.810 1.260
66 HB2 LEU 8 HB2 LEU 8 5.642 -0.521 3.915
67 HB3 LEU 8 HB3 LEU 8 7.225 -0.952 3.286
68 HG LEU 8 HG LEU 8 6.820 0.372 1.279
69 HD11 LEU 8 HD11 LEU 8 4.886 1.947 1.212
70 HD12 LEU 8 HD12 LEU 8 4.431 0.247 1.023
71 HD13 LEU 8 HD13 LEU 8 4.187 1.064 2.586
72 HD21 LEU 8 HD21 LEU 8 7.845 1.345 3.354
73 HD22 LEU 8 HD22 LEU 8 6.983 2.559 2.405
74 HD23 LEU 8 HD23 LEU 8 6.225 1.886 3.864
75 H ASN 9 H ASN 9 6.703 -3.510 0.499
76 HA ASN 9 HA ASN 9 8.275 -5.105 2.466
77 HB2 ASN 9 HB2 ASN 9 6.256 -6.332 2.023
78 HB3 ASN 9 HB3 ASN 9 6.401 -6.052 0.289
79 HD21 ASN 9 HD22 ASN 9 6.817 -8.031 -0.628
80 HD22 ASN 9 HD21 ASN 9 8.086 -9.123 -0.083
81 H GLY 10 H GLY 10 10.116 -3.748 1.801
82 HA2 GLY 10 HA2 GLY 10 11.165 -4.463 -0.908
83 HA3 GLY 10 HA3 GLY 10 11.353 -2.874 -0.168
84 H LYS 11 H LYS 11 13.415 -4.546 -1.036
85 HA LYS 11 HA LYS 11 14.850 -6.150 0.569
86 HB2 LYS 11 HB2 LYS 11 16.771 -5.555 -0.760
87 HB3 LYS 11 HB3 LYS 11 15.358 -5.547 -1.788
88 HG2 LYS 11 HG2 LYS 11 16.043 -2.877 -0.573
89 HG3 LYS 11 HG3 LYS 11 17.268 -3.551 -1.636
90 HD2 LYS 11 HD2 LYS 11 15.731 -3.650 -3.498
91 HD3 LYS 11 HD3 LYS 11 14.365 -3.227 -2.455
92 HE2 LYS 11 HE2 LYS 11 15.190 -1.052 -2.029
93 HE3 LYS 11 HE3 LYS 11 16.771 -1.385 -2.769
94 HZ1 LYS 11 HZ1 LYS 11 15.806 -1.282 -4.893
95 HZ2 LYS 11 HZ2 LYS 11 14.282 -1.523 -4.334
96 HZ3 LYS 11 HZ3 LYS 11 15.045 -0.082 -4.097
97 H THR 12 H THR 12 14.216 -3.206 2.035
98 HA THR 12 HA THR 12 16.642 -3.576 3.689
99 HB THR 12 HB THR 12 16.073 -0.921 2.326
100 HG1 THR 12 HG1 THR 12 17.440 -3.037 1.575
101 HG21 THR 12 HG21 THR 12 18.232 -0.177 3.331
102 HG22 THR 12 HG22 THR 12 17.003 -0.475 4.561
103 HG23 THR 12 HG23 THR 12 18.296 -1.670 4.276
104 H LEU 13 H LEU 13 13.415 -1.982 3.354
105 HA LEU 13 HA LEU 13 13.133 -2.264 6.206
106 HB2 LEU 13 HB2 LEU 13 12.619 -0.032 6.737
107 HB3 LEU 13 HB3 LEU 13 14.186 -0.044 5.987
108 HG LEU 13 HG LEU 13 13.089 1.896 5.309
109 HD11 LEU 13 HD11 LEU 13 14.363 0.792 3.496
110 HD12 LEU 13 HD12 LEU 13 12.844 0.069 2.889
111 HD13 LEU 13 HD13 LEU 13 13.055 1.825 2.903
112 HD21 LEU 13 HD21 LEU 13 10.949 2.097 4.300
113 HD22 LEU 13 HD22 LEU 13 10.697 0.362 4.238
114 HD23 LEU 13 HD23 LEU 13 10.768 1.200 5.814
115 H LYS 14 H LYS 14 10.836 -1.634 6.816
116 HA LYS 14 HA LYS 14 8.884 -2.086 4.632
117 HB2 LYS 14 HB2 LYS 14 9.125 -3.727 7.188
118 HB3 LYS 14 HB3 LYS 14 7.741 -3.743 6.089
119 HG2 LYS 14 HG2 LYS 14 9.431 -4.365 4.219
120 HG3 LYS 14 HG3 LYS 14 10.552 -4.736 5.543
121 HD2 LYS 14 HD2 LYS 14 8.730 -6.182 6.550
122 HD3 LYS 14 HD3 LYS 14 7.774 -5.895 5.076
123 HE2 LYS 14 HE2 LYS 14 9.692 -6.836 3.739
124 HE3 LYS 14 HE3 LYS 14 10.518 -7.217 5.255
125 HZ1 LYS 14 HZ1 LYS 14 7.891 -8.267 4.395
126 HZ2 LYS 14 HZ2 LYS 14 9.316 -9.093 4.400
127 HZ3 LYS 14 HZ3 LYS 14 8.606 -8.610 5.834
128 H GLY 15 H GLY 15 6.603 -1.872 5.479
129 HA2 GLY 15 HA2 GLY 15 6.206 -0.115 7.779
130 HA3 GLY 15 HA3 GLY 15 5.839 0.571 6.189
131 H GLU 16 H GLU 16 3.939 -0.145 8.337
132 HA GLU 16 HA GLU 16 2.113 -1.836 6.719
133 HB2 GLU 16 HB2 GLU 16 3.258 -3.390 8.332
134 HB3 GLU 16 HB3 GLU 16 2.762 -2.343 9.666
135 HG2 GLU 16 HG2 GLU 16 0.348 -2.725 8.860
136 HG3 GLU 16 HG3 GLU 16 0.982 -3.980 7.817
137 H THR 17 H THR 17 0.407 -0.372 6.462
138 HA THR 17 HA THR 17 -0.501 1.140 8.851
139 HB THR 17 HB THR 17 -0.717 3.123 7.232
140 HG1 THR 17 HG1 THR 17 0.704 3.151 5.515
141 HG21 THR 17 HG21 THR 17 1.520 3.956 7.636
142 HG22 THR 17 HG22 THR 17 0.962 3.070 9.066
143 HG23 THR 17 HG23 THR 17 2.133 2.321 7.953
144 H THR 18 H THR 18 -2.692 2.092 8.514
145 HA THR 18 HA THR 18 -4.279 0.650 6.436
146 HB THR 18 HB THR 18 -6.049 0.641 8.413
147 HG1 THR 18 HG1 THR 18 -4.476 1.567 9.969
148 HG21 THR 18 HG21 THR 18 -3.823 -1.418 8.217
149 HG22 THR 18 HG22 THR 18 -5.428 -1.664 8.944
150 HG23 THR 18 HG23 THR 18 -5.292 -1.338 7.210
151 H THR 19 H THR 19 -5.834 1.864 5.481
152 HA THR 19 HA THR 19 -6.796 4.346 6.541
153 HB THR 19 HB THR 19 -4.964 4.313 4.126
154 HG1 THR 19 HG1 THR 19 -4.471 4.725 6.521
155 HG21 THR 19 HG21 THR 19 -5.577 6.727 3.843
156 HG22 THR 19 HG22 THR 19 -6.922 5.646 3.464
157 HG23 THR 19 HG23 THR 19 -6.895 6.514 5.014
158 H GLU 20 H GLU 20 -8.930 4.661 5.676
159 HA GLU 20 HA GLU 20 -9.784 2.485 3.885
160 HB2 GLU 20 HB2 GLU 20 -12.053 2.931 4.735
161 HB3 GLU 20 HB3 GLU 20 -10.927 2.334 5.937
162 HG2 GLU 20 HG2 GLU 20 -10.661 4.603 6.882
163 HG3 GLU 20 HG3 GLU 20 -11.764 5.240 5.653
164 H ALA 21 H ALA 21 -10.859 2.888 1.990
165 HA ALA 21 HA ALA 21 -11.389 5.672 1.210
166 HB1 ALA 21 HB1 ALA 21 -9.029 5.218 0.549
167 HB2 ALA 21 HB2 ALA 21 -9.578 3.786 -0.367
168 HB3 ALA 21 HB3 ALA 21 -10.085 5.417 -0.865
169 H VAL 22 H VAL 22 -12.392 5.649 -1.072
170 HA VAL 22 HA VAL 22 -14.559 3.694 -1.062
171 HB VAL 22 HB VAL 22 -14.821 6.181 -1.402
172 HG11 VAL 22 HG11 VAL 22 -14.493 7.185 -3.560
173 HG12 VAL 22 HG12 VAL 22 -12.941 6.539 -3.010
174 HG13 VAL 22 HG13 VAL 22 -13.881 5.675 -4.244
175 HG21 VAL 22 HG21 VAL 22 -16.011 4.444 -3.595
176 HG22 VAL 22 HG22 VAL 22 -16.604 4.545 -1.922
177 HG23 VAL 22 HG23 VAL 22 -16.656 5.973 -2.969
178 H ASP 23 H ASP 23 -11.436 4.033 -2.711
179 HA ASP 23 HA ASP 23 -12.024 1.616 -4.231
180 HB2 ASP 23 HB2 ASP 23 -12.288 4.226 -5.443
181 HB3 ASP 23 HB3 ASP 23 -10.750 3.600 -5.993
182 H ALA 24 H ALA 24 -10.037 0.836 -5.272
183 HA ALA 24 HA ALA 24 -7.834 0.873 -3.482
184 HB1 ALA 24 HB1 ALA 24 -6.704 -0.516 -5.165
185 HB2 ALA 24 HB2 ALA 24 -8.378 -1.046 -4.944
186 HB3 ALA 24 HB3 ALA 24 -7.926 -0.080 -6.373
187 H ALA 25 H ALA 25 -8.338 2.564 -6.607
188 HA ALA 25 HA ALA 25 -5.766 3.607 -6.985
189 HB1 ALA 25 HB1 ALA 25 -6.882 5.384 -8.303
190 HB2 ALA 25 HB2 ALA 25 -7.540 3.781 -8.662
191 HB3 ALA 25 HB3 ALA 25 -8.450 4.903 -7.620
192 H THR 26 H THR 26 -8.451 5.045 -5.008
193 HA THR 26 HA THR 26 -6.932 7.366 -4.328
194 HB THR 26 HB THR 26 -9.323 6.075 -2.961
195 HG1 THR 26 HG1 THR 26 -10.359 7.788 -4.250
196 HG21 THR 26 HG21 THR 26 -9.778 8.380 -2.131
197 HG22 THR 26 HG22 THR 26 -8.280 7.731 -1.457
198 HG23 THR 26 HG23 THR 26 -8.210 8.919 -2.774
199 H ALA 27 H ALA 27 -6.974 4.059 -2.995
200 HA ALA 27 HA ALA 27 -5.579 4.817 -0.579
201 HB1 ALA 27 HB1 ALA 27 -6.990 2.763 -0.778
202 HB2 ALA 27 HB2 ALA 27 -5.782 2.072 -1.878
203 HB3 ALA 27 HB3 ALA 27 -5.349 2.450 -0.206
204 H GLU 28 H GLU 28 -4.693 3.464 -3.716
205 HA GLU 28 HA GLU 28 -1.939 3.033 -3.490
206 HB2 GLU 28 HB2 GLU 28 -3.156 2.157 -5.316
207 HB3 GLU 28 HB3 GLU 28 -3.873 3.681 -5.718
208 HG2 GLU 28 HG2 GLU 28 -0.977 3.825 -6.100
209 HG3 GLU 28 HG3 GLU 28 -1.645 2.436 -6.934
210 H LYS 29 H LYS 29 -3.595 5.896 -4.819
211 HA LYS 29 HA LYS 29 -1.260 7.436 -5.264
212 HB2 LYS 29 HB2 LYS 29 -4.155 8.275 -4.854
213 HB3 LYS 29 HB3 LYS 29 -2.895 9.312 -5.543
214 HG2 LYS 29 HG2 LYS 29 -2.656 7.991 -7.479
215 HG3 LYS 29 HG3 LYS 29 -3.438 6.593 -6.777
216 HD2 LYS 29 HD2 LYS 29 -5.013 7.336 -8.235
217 HD3 LYS 29 HD3 LYS 29 -5.593 7.966 -6.683
218 HE2 LYS 29 HE2 LYS 29 -4.618 10.171 -7.196
219 HE3 LYS 29 HE3 LYS 29 -3.877 9.518 -8.670
220 HZ1 LYS 29 HZ1 LYS 29 -6.037 9.086 -9.534
221 HZ2 LYS 29 HZ2 LYS 29 -6.772 9.645 -8.160
222 HZ3 LYS 29 HZ3 LYS 29 -5.901 10.690 -9.114
223 H VAL 30 H VAL 30 -3.477 7.464 -2.432
224 HA VAL 30 HA VAL 30 -2.150 9.678 -1.203
225 HB VAL 30 HB VAL 30 -4.018 7.501 -0.217
226 HG11 VAL 30 HG11 VAL 30 -4.309 8.910 1.845
227 HG12 VAL 30 HG12 VAL 30 -2.748 8.109 1.751
228 HG13 VAL 30 HG13 VAL 30 -2.868 9.832 1.350
229 HG21 VAL 30 HG21 VAL 30 -5.638 9.370 -0.174
230 HG22 VAL 30 HG22 VAL 30 -4.366 10.519 -0.632
231 HG23 VAL 30 HG23 VAL 30 -4.908 9.282 -1.775
232 H PHE 31 H PHE 31 -1.888 6.091 -0.469
233 HA PHE 31 HA PHE 31 0.302 6.625 1.273
234 HB2 PHE 31 HB2 PHE 31 -0.853 4.116 0.080
235 HB3 PHE 31 HB3 PHE 31 0.705 4.046 0.870
236 HD1 PHE 31 HD2 PHE 31 0.443 5.895 3.224
237 HD2 PHE 31 HD1 PHE 31 -2.292 2.972 1.582
238 HE1 PHE 31 HE2 PHE 31 -0.521 5.562 5.443
239 HE2 PHE 31 HE1 PHE 31 -3.185 2.582 3.866
240 HZ PHE 31 HZ PHE 31 -2.331 3.894 5.785
241 H LYS 32 H LYS 32 0.374 6.709 -2.143
242 HA LYS 32 HA LYS 32 2.966 5.707 -2.671
243 HB2 LYS 32 HB2 LYS 32 1.203 6.519 -4.320
244 HB3 LYS 32 HB3 LYS 32 1.694 8.176 -3.912
245 HG2 LYS 32 HG2 LYS 32 3.987 7.675 -4.673
246 HG3 LYS 32 HG3 LYS 32 3.509 5.993 -5.025
247 HD2 LYS 32 HD2 LYS 32 1.851 6.808 -6.678
248 HD3 LYS 32 HD3 LYS 32 2.298 8.477 -6.286
249 HE2 LYS 32 HE2 LYS 32 4.686 7.881 -6.918
250 HE3 LYS 32 HE3 LYS 32 4.079 6.322 -7.498
251 HZ1 LYS 32 HZ1 LYS 32 3.377 8.995 -8.486
252 HZ2 LYS 32 HZ2 LYS 32 4.244 7.829 -9.286
253 HZ3 LYS 32 HZ3 LYS 32 2.629 7.609 -9.010
254 H GLN 33 H GLN 33 1.932 8.771 -1.230
255 HA GLN 33 HA GLN 33 4.364 10.201 -1.353
256 HB2 GLN 33 HB2 GLN 33 2.244 10.205 0.860
257 HB3 GLN 33 HB3 GLN 33 3.499 11.422 0.624
258 HG2 GLN 33 HG2 GLN 33 2.510 11.959 -1.620
259 HG3 GLN 33 HG3 GLN 33 1.207 10.808 -1.278
260 HE21 GLN 33 HE22 GLN 33 2.762 13.863 -0.008
261 HE22 GLN 33 HE21 GLN 33 1.285 14.419 0.728
262 H TYR 34 H TYR 34 3.078 8.162 1.268
263 HA TYR 34 HA TYR 34 5.361 8.153 2.931
264 HB2 TYR 34 HB2 TYR 34 3.647 7.540 4.192
265 HB3 TYR 34 HB3 TYR 34 2.680 7.020 2.850
266 HD1 TYR 34 HD2 TYR 34 5.223 5.852 5.347
267 HD2 TYR 34 HD1 TYR 34 2.341 4.732 2.347
268 HE1 TYR 34 HE2 TYR 34 5.112 3.575 6.307
269 HE2 TYR 34 HE1 TYR 34 2.183 2.471 3.327
270 HH TYR 34 HH TYR 34 2.584 1.347 5.495
271 H ALA 35 H ALA 35 4.371 5.869 0.313
272 HA ALA 35 HA ALA 35 6.328 3.924 0.873
273 HB1 ALA 35 HB1 ALA 35 6.057 3.230 -1.475
274 HB2 ALA 35 HB2 ALA 35 4.487 3.566 -0.718
275 HB3 ALA 35 HB3 ALA 35 5.211 4.747 -1.836
276 H ASN 36 H ASN 36 6.603 6.649 -1.505
277 HA ASN 36 HA ASN 36 9.392 6.103 -1.959
278 HB2 ASN 36 HB2 ASN 36 8.007 7.389 -3.544
279 HB3 ASN 36 HB3 ASN 36 7.928 8.743 -2.400
280 HD21 ASN 36 HD22 ASN 36 9.635 10.359 -2.773
281 HD22 ASN 36 HD21 ASN 36 11.160 9.863 -3.483
282 H ASP 37 H ASP 37 7.727 8.250 0.367
283 HA ASP 37 HA ASP 37 10.104 9.641 1.199
284 HB2 ASP 37 HB2 ASP 37 7.814 10.504 1.465
285 HB3 ASP 37 HB3 ASP 37 7.482 9.227 2.653
286 H ASN 38 H ASN 38 8.869 6.476 1.941
287 HA ASN 38 HA ASN 38 10.561 6.252 4.359
288 HB2 ASN 38 HB2 ASN 38 8.136 5.493 4.289
289 HB3 ASN 38 HB3 ASN 38 8.666 4.188 3.219
290 HD21 ASN 38 HD22 ASN 38 7.765 2.811 5.021
291 HD22 ASN 38 HD21 ASN 38 8.831 2.485 6.383
292 H GLY 39 H GLY 39 10.798 5.682 0.974
293 HA2 GLY 39 HA2 GLY 39 12.790 5.018 -0.079
294 HA3 GLY 39 HA3 GLY 39 13.339 4.216 1.392
295 H VAL 40 H VAL 40 10.112 3.648 -0.132
296 HA VAL 40 HA VAL 40 11.120 0.994 -1.012
297 HB VAL 40 HB VAL 40 8.478 1.500 0.387
298 HG11 VAL 40 HG11 VAL 40 8.378 -1.050 0.396
299 HG12 VAL 40 HG12 VAL 40 8.266 -0.345 -1.214
300 HG13 VAL 40 HG13 VAL 40 9.789 -1.061 -0.664
301 HG21 VAL 40 HG21 VAL 40 10.996 0.092 1.384
302 HG22 VAL 40 HG22 VAL 40 10.271 1.571 2.041
303 HG23 VAL 40 HG23 VAL 40 9.424 0.028 2.194
304 H ASP 41 H ASP 41 10.219 0.197 -2.835
305 HA ASP 41 HA ASP 41 8.240 1.666 -4.334
306 HB2 ASP 41 HB2 ASP 41 10.691 2.571 -4.828
307 HB3 ASP 41 HB3 ASP 41 10.885 1.054 -5.703
308 H GLY 42 H GLY 42 7.730 0.127 -6.394
309 HA2 GLY 42 HA2 GLY 42 8.691 -2.380 -6.760
310 HA3 GLY 42 HA3 GLY 42 7.708 -2.568 -5.294
311 H GLU 43 H GLU 43 6.424 -4.009 -6.474
312 HA GLU 43 HA GLU 43 4.687 -2.947 -8.594
313 HB2 GLU 43 HB2 GLU 43 5.944 -5.045 -8.959
314 HB3 GLU 43 HB3 GLU 43 5.125 -5.782 -7.561
315 HG2 GLU 43 HG2 GLU 43 2.936 -5.448 -8.665
316 HG3 GLU 43 HG3 GLU 43 3.731 -4.569 -9.983
317 H TRP 44 H TRP 44 3.017 -1.894 -7.781
318 HA TRP 44 HA TRP 44 1.816 -2.452 -5.186
319 HB2 TRP 44 HB2 TRP 44 1.076 -0.626 -7.519
320 HB3 TRP 44 HB3 TRP 44 0.234 -0.651 -5.992
321 HD1 TRP 44 HD1 TRP 44 3.895 0.036 -7.149
322 HE1 TRP 44 HE1 TRP 44 4.800 1.982 -5.797
323 HE3 TRP 44 HE3 TRP 44 -0.141 0.842 -4.078
324 HZ2 TRP 44 HZ2 TRP 44 4.022 3.510 -3.483
325 HZ3 TRP 44 HZ3 TRP 44 -0.008 2.562 -2.287
326 HH2 TRP 44 HH2 TRP 44 2.076 3.839 -1.931
327 H THR 45 H THR 45 0.452 -4.238 -4.988
328 HA THR 45 HA THR 45 -1.565 -4.637 -7.148
329 HB THR 45 HB THR 45 -0.142 -6.979 -5.863
330 HG1 THR 45 HG1 THR 45 1.365 -5.892 -7.086
331 HG21 THR 45 HG21 THR 45 -1.842 -6.744 -8.372
332 HG22 THR 45 HG22 THR 45 -1.087 -8.222 -7.751
333 HG23 THR 45 HG23 THR 45 -2.379 -7.437 -6.824
334 H TYR 46 H TYR 46 -3.568 -4.573 -6.278
335 HA TYR 46 HA TYR 46 -3.840 -4.750 -3.340
336 HB2 TYR 46 HB2 TYR 46 -5.901 -3.598 -3.562
337 HB3 TYR 46 HB3 TYR 46 -4.683 -2.702 -4.439
338 HD1 TYR 46 HD2 TYR 46 -7.682 -4.859 -4.746
339 HD2 TYR 46 HD1 TYR 46 -4.823 -2.410 -6.884
340 HE1 TYR 46 HE2 TYR 46 -9.018 -5.087 -6.796
341 HE2 TYR 46 HE1 TYR 46 -6.160 -2.655 -8.946
342 HH TYR 46 HH TYR 46 -8.744 -5.041 -9.118
343 H ASP 47 H ASP 47 -5.423 -6.092 -2.418
344 HA ASP 47 HA ASP 47 -6.442 -8.361 -4.073
345 HB2 ASP 47 HB2 ASP 47 -4.491 -9.035 -2.753
346 HB3 ASP 47 HB3 ASP 47 -5.196 -8.329 -1.290
347 H ASP 48 H ASP 48 -8.583 -7.872 -4.196
348 HA ASP 48 HA ASP 48 -9.938 -6.248 -2.286
349 HB2 ASP 48 HB2 ASP 48 -11.788 -6.380 -3.644
350 HB3 ASP 48 HB3 ASP 48 -10.494 -6.624 -4.790
351 H ALA 49 H ALA 49 -9.298 -9.684 -2.158
352 HA ALA 49 HA ALA 49 -11.664 -10.246 -0.470
353 HB1 ALA 49 HB1 ALA 49 -10.856 -12.570 -0.591
354 HB2 ALA 49 HB2 ALA 49 -11.023 -11.873 -2.210
355 HB3 ALA 49 HB3 ALA 49 -9.419 -12.038 -1.482
356 H THR 50 H THR 50 -8.090 -10.441 -0.298
357 HA THR 50 HA THR 50 -8.111 -10.839 2.578
358 HB THR 50 HB THR 50 -5.736 -10.085 0.869
359 HG1 THR 50 HG1 THR 50 -6.069 -11.798 -0.188
360 HG21 THR 50 HG21 THR 50 -5.325 -10.253 3.318
361 HG22 THR 50 HG22 THR 50 -5.991 -11.903 3.307
362 HG23 THR 50 HG23 THR 50 -4.497 -11.529 2.421
363 H LYS 51 H LYS 51 -8.350 -8.133 0.459
364 HA LYS 51 HA LYS 51 -8.406 -5.925 0.668
365 HB2 LYS 51 HB2 LYS 51 -9.302 -6.559 3.493
366 HB3 LYS 51 HB3 LYS 51 -9.493 -4.996 2.666
367 HG2 LYS 51 HG2 LYS 51 -10.811 -6.094 0.880
368 HG3 LYS 51 HG3 LYS 51 -10.620 -7.663 1.671
369 HD2 LYS 51 HD2 LYS 51 -11.830 -6.819 3.657
370 HD3 LYS 51 HD3 LYS 51 -12.106 -5.286 2.791
371 HE2 LYS 51 HE2 LYS 51 -13.171 -6.623 0.924
372 HE3 LYS 51 HE3 LYS 51 -12.992 -8.085 1.914
373 HZ1 LYS 51 HZ1 LYS 51 -14.551 -5.674 2.584
374 HZ2 LYS 51 HZ2 LYS 51 -15.202 -7.139 2.185
375 HZ3 LYS 51 HZ3 LYS 51 -14.357 -6.899 3.610
376 H THR 52 H THR 52 -5.945 -6.989 0.685
377 HA THR 52 HA THR 52 -4.369 -5.142 2.385
378 HB THR 52 HB THR 52 -2.547 -6.856 1.935
379 HG1 THR 52 HG1 THR 52 -2.997 -8.644 1.008
380 HG21 THR 52 HG21 THR 52 -3.374 -8.518 3.644
381 HG22 THR 52 HG22 THR 52 -3.431 -6.833 4.153
382 HG23 THR 52 HG23 THR 52 -4.922 -7.662 3.657
383 H PHE 53 H PHE 53 -2.560 -4.206 1.284
384 HA PHE 53 HA PHE 53 -2.614 -4.280 -1.658
385 HB2 PHE 53 HB2 PHE 53 -3.980 -2.346 -0.556
386 HB3 PHE 53 HB3 PHE 53 -2.429 -1.673 -0.111
387 HD1 PHE 53 HD2 PHE 53 -1.233 -2.845 -3.011
388 HD2 PHE 53 HD1 PHE 53 -4.536 -0.342 -1.771
389 HE1 PHE 53 HE2 PHE 53 -1.390 -1.889 -5.275
390 HE2 PHE 53 HE1 PHE 53 -4.596 0.664 -4.025
391 HZ PHE 53 HZ PHE 53 -3.036 -0.120 -5.794
392 H THR 54 H THR 54 -0.687 -5.335 -1.826
393 HA THR 54 HA THR 54 1.479 -4.603 0.037
394 HB THR 54 HB THR 54 2.039 -6.786 -1.840
395 HG1 THR 54 HG1 THR 54 0.148 -7.548 -1.720
396 HG21 THR 54 HG21 THR 54 1.969 -6.735 1.200
397 HG22 THR 54 HG22 THR 54 2.776 -7.925 0.163
398 HG23 THR 54 HG23 THR 54 3.367 -6.257 0.206
399 H VAL 55 H VAL 55 3.329 -3.704 -0.613
400 HA VAL 55 HA VAL 55 3.679 -3.007 -3.502
401 HB VAL 55 HB VAL 55 4.568 -1.415 -1.028
402 HG11 VAL 55 HG11 VAL 55 6.096 -1.222 -2.965
403 HG12 VAL 55 HG12 VAL 55 4.725 -0.799 -4.019
404 HG13 VAL 55 HG13 VAL 55 5.217 0.295 -2.704
405 HG21 VAL 55 HG21 VAL 55 2.304 -0.883 -2.990
406 HG22 VAL 55 HG22 VAL 55 2.161 -1.164 -1.247
407 HG23 VAL 55 HG23 VAL 55 2.936 0.308 -1.837
408 H THR 56 H THR 56 4.788 -4.883 -3.897
409 HA THR 56 HA THR 56 7.001 -5.684 -2.078
410 HB THR 56 HB THR 56 5.023 -7.233 -3.778
411 HG1 THR 56 HG1 THR 56 4.478 -8.111 -1.897
412 HG21 THR 56 HG21 THR 56 7.631 -8.297 -2.621
413 HG22 THR 56 HG22 THR 56 6.269 -9.316 -3.124
414 HG23 THR 56 HG23 THR 56 7.101 -8.319 -4.308
415 H GLU 57 H GLU 57 8.989 -6.146 -3.032
416 HA GLU 57 HA GLU 57 9.289 -5.745 -5.931
417 HB2 GLU 57 HB2 GLU 57 9.628 -3.570 -4.849
418 HB3 GLU 57 HB3 GLU 57 10.814 -4.253 -3.746
419 HG2 GLU 57 HG2 GLU 57 11.555 -4.863 -6.521
420 HG3 GLU 57 HG3 GLU 57 11.214 -3.133 -6.356
Start of MODEL 19
1 H1 MET 1 H MET 1 -16.398 2.715 6.314
2 HA MET 1 HA MET 1 -16.491 2.178 3.880
3 HB2 MET 1 HB2 MET 1 -14.187 4.179 3.903
4 HB3 MET 1 HB3 MET 1 -14.440 3.008 2.602
5 HG2 MET 1 HG2 MET 1 -16.702 3.903 2.210
6 HG3 MET 1 HG3 MET 1 -16.426 5.141 3.446
7 HE1 MET 1 HE1 MET 1 -17.365 5.477 0.367
8 HE2 MET 1 HE2 MET 1 -17.306 6.797 1.555
9 HE3 MET 1 HE3 MET 1 -16.531 6.990 -0.035
10 H GLY 2 H GLY 2 -14.954 0.542 2.934
11 HA2 GLY 2 HA2 GLY 2 -13.792 -1.054 5.021
12 HA3 GLY 2 HA3 GLY 2 -13.658 -1.320 3.263
13 H THR 3 H THR 3 -11.398 -1.778 4.835
14 HA THR 3 HA THR 3 -9.616 0.522 4.132
15 HB THR 3 HB THR 3 -9.687 -1.286 6.570
16 HG1 THR 3 HG1 THR 3 -9.360 1.339 7.038
17 HG21 THR 3 HG21 THR 3 -7.318 -1.056 5.944
18 HG22 THR 3 HG22 THR 3 -7.505 0.710 5.864
19 HG23 THR 3 HG23 THR 3 -7.696 -0.160 7.410
20 H TYR 4 H TYR 4 -7.970 -0.015 2.780
21 HA TYR 4 HA TYR 4 -7.375 -2.895 2.271
22 HB2 TYR 4 HB2 TYR 4 -6.403 -0.322 0.955
23 HB3 TYR 4 HB3 TYR 4 -5.795 -1.917 0.561
24 HD1 TYR 4 HD1 TYR 4 -7.124 -3.465 -0.874
25 HD2 TYR 4 HD2 TYR 4 -8.467 0.507 0.119
26 HE1 TYR 4 HE1 TYR 4 -8.806 -3.577 -2.695
27 HE2 TYR 4 HE2 TYR 4 -10.192 0.383 -1.640
28 HH TYR 4 HH TYR 4 -10.417 -2.280 -3.984
29 H LYS 5 H LYS 5 -5.691 -3.729 3.499
30 HA LYS 5 HA LYS 5 -4.151 -2.018 5.341
31 HB2 LYS 5 HB2 LYS 5 -4.028 -4.987 4.668
32 HB3 LYS 5 HB3 LYS 5 -3.096 -4.223 5.951
33 HG2 LYS 5 HG2 LYS 5 -4.964 -3.908 7.325
34 HG3 LYS 5 HG3 LYS 5 -6.114 -3.960 5.980
35 HD2 LYS 5 HD2 LYS 5 -5.755 -6.353 5.667
36 HD3 LYS 5 HD3 LYS 5 -4.524 -6.366 6.950
37 HE2 LYS 5 HE2 LYS 5 -6.187 -5.713 8.612
38 HE3 LYS 5 HE3 LYS 5 -7.433 -5.531 7.364
39 HZ1 LYS 5 HZ1 LYS 5 -7.566 -7.633 8.575
40 HZ2 LYS 5 HZ2 LYS 5 -7.391 -7.859 6.971
41 HZ3 LYS 5 HZ3 LYS 5 -6.094 -8.075 7.970
42 H LEU 6 H LEU 6 -2.621 -0.765 4.358
43 HA LEU 6 HA LEU 6 -1.319 -1.724 1.928
44 HB2 LEU 6 HB2 LEU 6 -2.292 0.580 2.185
45 HB3 LEU 6 HB3 LEU 6 -1.053 0.962 3.341
46 HG LEU 6 HG LEU 6 -0.797 1.698 0.883
47 HD11 LEU 6 HD11 LEU 6 1.001 1.892 2.542
48 HD12 LEU 6 HD12 LEU 6 1.540 0.248 2.135
49 HD13 LEU 6 HD13 LEU 6 1.615 1.537 0.916
50 HD21 LEU 6 HD21 LEU 6 0.258 -1.107 0.421
51 HD22 LEU 6 HD22 LEU 6 -1.283 -0.458 -0.192
52 HD23 LEU 6 HD23 LEU 6 0.238 0.260 -0.711
53 H ILE 7 H ILE 7 0.392 -3.010 2.172
54 HA ILE 7 HA ILE 7 2.277 -2.591 4.441
55 HB ILE 7 HB ILE 7 1.394 -5.052 2.900
56 HG12 ILE 7 HG12 ILE 7 1.327 -6.052 5.209
57 HG13 ILE 7 HG13 ILE 7 1.728 -4.478 5.885
58 HG21 ILE 7 HG21 ILE 7 3.884 -5.130 2.881
59 HG22 ILE 7 HG22 ILE 7 3.900 -4.900 4.641
60 HG23 ILE 7 HG23 ILE 7 3.187 -6.356 3.914
61 HD11 ILE 7 HD11 ILE 7 -0.437 -3.599 5.202
62 HD12 ILE 7 HD12 ILE 7 -0.767 -5.064 4.233
63 HD13 ILE 7 HD13 ILE 7 -0.694 -5.150 6.004
64 H LEU 8 H LEU 8 4.388 -2.412 3.997
65 HA LEU 8 HA LEU 8 5.295 -1.853 1.194
66 HB2 LEU 8 HB2 LEU 8 5.834 -0.623 3.899
67 HB3 LEU 8 HB3 LEU 8 7.184 -0.748 2.797
68 HG LEU 8 HG LEU 8 6.154 0.698 1.172
69 HD11 LEU 8 HD11 LEU 8 3.831 0.069 1.285
70 HD12 LEU 8 HD12 LEU 8 3.713 0.619 2.972
71 HD13 LEU 8 HD13 LEU 8 3.953 1.792 1.655
72 HD21 LEU 8 HD21 LEU 8 7.322 1.914 2.855
73 HD22 LEU 8 HD22 LEU 8 5.751 2.739 2.771
74 HD23 LEU 8 HD23 LEU 8 6.068 1.618 4.071
75 H ASN 9 H ASN 9 6.856 -3.304 0.509
76 HA ASN 9 HA ASN 9 8.408 -4.785 2.565
77 HB2 ASN 9 HB2 ASN 9 6.447 -6.137 1.759
78 HB3 ASN 9 HB3 ASN 9 7.119 -6.086 0.134
79 HD21 ASN 9 HD22 ASN 9 9.824 -6.601 0.395
80 HD22 ASN 9 HD21 ASN 9 10.004 -8.138 1.150
81 H GLY 10 H GLY 10 9.960 -3.147 2.114
82 HA2 GLY 10 HA2 GLY 10 10.971 -2.701 -0.562
83 HA3 GLY 10 HA3 GLY 10 11.530 -2.032 0.972
84 H LYS 11 H LYS 11 13.412 -2.783 -0.782
85 HA LYS 11 HA LYS 11 14.283 -5.519 -0.288
86 HB2 LYS 11 HB2 LYS 11 16.230 -5.052 -1.567
87 HB3 LYS 11 HB3 LYS 11 14.840 -4.421 -2.418
88 HG2 LYS 11 HG2 LYS 11 16.476 -2.541 -0.683
89 HG3 LYS 11 HG3 LYS 11 17.141 -3.075 -2.211
90 HD2 LYS 11 HD2 LYS 11 15.123 -2.250 -3.386
91 HD3 LYS 11 HD3 LYS 11 14.504 -1.654 -1.843
92 HE2 LYS 11 HE2 LYS 11 16.703 -0.300 -1.669
93 HE3 LYS 11 HE3 LYS 11 16.961 -0.731 -3.369
94 HZ1 LYS 11 HZ1 LYS 11 15.848 1.285 -3.490
95 HZ2 LYS 11 HZ2 LYS 11 14.590 0.234 -3.634
96 HZ3 LYS 11 HZ3 LYS 11 14.882 0.955 -2.193
97 H THR 12 H THR 12 14.429 -2.808 1.688
98 HA THR 12 HA THR 12 16.592 -4.071 3.308
99 HB THR 12 HB THR 12 16.383 -1.074 3.218
100 HG1 THR 12 HG1 THR 12 17.352 -0.792 1.439
101 HG21 THR 12 HG21 THR 12 18.770 -1.147 3.632
102 HG22 THR 12 HG22 THR 12 17.971 -2.237 4.766
103 HG23 THR 12 HG23 THR 12 18.809 -2.905 3.353
104 H LEU 13 H LEU 13 13.441 -2.492 3.235
105 HA LEU 13 HA LEU 13 13.182 -2.845 6.089
106 HB2 LEU 13 HB2 LEU 13 12.564 -0.591 6.584
107 HB3 LEU 13 HB3 LEU 13 14.153 -0.604 5.882
108 HG LEU 13 HG LEU 13 13.190 1.283 5.049
109 HD11 LEU 13 HD11 LEU 13 12.659 -0.565 2.716
110 HD12 LEU 13 HD12 LEU 13 12.958 1.176 2.678
111 HD13 LEU 13 HD13 LEU 13 14.251 0.092 3.193
112 HD21 LEU 13 HD21 LEU 13 11.007 1.617 4.184
113 HD22 LEU 13 HD22 LEU 13 10.652 -0.124 4.189
114 HD23 LEU 13 HD23 LEU 13 10.876 0.765 5.731
115 H LYS 14 H LYS 14 10.926 -2.655 6.771
116 HA LYS 14 HA LYS 14 8.955 -2.977 4.555
117 HB2 LYS 14 HB2 LYS 14 9.030 -4.603 7.128
118 HB3 LYS 14 HB3 LYS 14 7.817 -4.689 5.841
119 HG2 LYS 14 HG2 LYS 14 9.872 -5.203 4.268
120 HG3 LYS 14 HG3 LYS 14 10.704 -5.597 5.781
121 HD2 LYS 14 HD2 LYS 14 8.820 -7.210 6.296
122 HD3 LYS 14 HD3 LYS 14 8.131 -6.838 4.705
123 HE2 LYS 14 HE2 LYS 14 10.403 -7.510 3.718
124 HE3 LYS 14 HE3 LYS 14 10.840 -8.095 5.330
125 HZ1 LYS 14 HZ1 LYS 14 8.832 -9.543 5.166
126 HZ2 LYS 14 HZ2 LYS 14 8.655 -9.046 3.607
127 HZ3 LYS 14 HZ3 LYS 14 10.006 -9.890 4.028
128 H GLY 15 H GLY 15 6.603 -2.720 5.454
129 HA2 GLY 15 HA2 GLY 15 6.347 -0.873 7.691
130 HA3 GLY 15 HA3 GLY 15 6.042 -0.146 6.104
131 H GLU 16 H GLU 16 4.044 -0.406 8.089
132 HA GLU 16 HA GLU 16 2.032 -2.010 6.657
133 HB2 GLU 16 HB2 GLU 16 3.001 -3.502 8.443
134 HB3 GLU 16 HB3 GLU 16 2.598 -2.279 9.651
135 HG2 GLU 16 HG2 GLU 16 0.158 -2.511 8.884
136 HG3 GLU 16 HG3 GLU 16 0.673 -3.881 7.912
137 H THR 17 H THR 17 0.355 -0.566 6.354
138 HA THR 17 HA THR 17 -0.307 1.438 8.424
139 HB THR 17 HB THR 17 -0.527 3.054 6.421
140 HG1 THR 17 HG1 THR 17 0.605 0.939 5.183
141 HG21 THR 17 HG21 THR 17 1.114 3.355 8.240
142 HG22 THR 17 HG22 THR 17 2.273 2.339 7.355
143 HG23 THR 17 HG23 THR 17 1.730 3.882 6.668
144 H THR 18 H THR 18 -2.453 2.510 7.885
145 HA THR 18 HA THR 18 -4.206 0.910 6.091
146 HB THR 18 HB THR 18 -5.866 0.905 8.127
147 HG1 THR 18 HG1 THR 18 -3.969 2.015 9.357
148 HG21 THR 18 HG21 THR 18 -3.571 -1.087 8.225
149 HG22 THR 18 HG22 THR 18 -5.199 -1.292 8.896
150 HG23 THR 18 HG23 THR 18 -4.984 -1.179 7.146
151 H THR 19 H THR 19 -5.792 2.221 5.182
152 HA THR 19 HA THR 19 -6.762 4.611 6.482
153 HB THR 19 HB THR 19 -5.184 4.741 3.883
154 HG1 THR 19 HG1 THR 19 -4.298 4.942 6.135
155 HG21 THR 19 HG21 THR 19 -5.801 7.152 3.840
156 HG22 THR 19 HG22 THR 19 -7.206 6.102 3.578
157 HG23 THR 19 HG23 THR 19 -6.957 6.866 5.159
158 H GLU 20 H GLU 20 -8.931 4.958 5.816
159 HA GLU 20 HA GLU 20 -9.974 2.794 4.064
160 HB2 GLU 20 HB2 GLU 20 -12.113 3.165 4.946
161 HB3 GLU 20 HB3 GLU 20 -10.972 2.991 6.272
162 HG2 GLU 20 HG2 GLU 20 -11.075 5.505 6.553
163 HG3 GLU 20 HG3 GLU 20 -12.379 5.509 5.342
164 H ALA 21 H ALA 21 -10.407 3.232 2.005
165 HA ALA 21 HA ALA 21 -10.909 6.035 1.154
166 HB1 ALA 21 HB1 ALA 21 -8.601 5.311 0.571
167 HB2 ALA 21 HB2 ALA 21 -9.268 3.864 -0.234
168 HB3 ALA 21 HB3 ALA 21 -9.633 5.479 -0.862
169 H VAL 22 H VAL 22 -11.950 5.915 -1.174
170 HA VAL 22 HA VAL 22 -14.293 4.193 -0.896
171 HB VAL 22 HB VAL 22 -14.614 6.432 -1.630
172 HG11 VAL 22 HG11 VAL 22 -13.878 7.334 -3.786
173 HG12 VAL 22 HG12 VAL 22 -12.489 6.961 -2.766
174 HG13 VAL 22 HG13 VAL 22 -12.935 5.878 -4.107
175 HG21 VAL 22 HG21 VAL 22 -15.194 4.579 -3.960
176 HG22 VAL 22 HG22 VAL 22 -16.159 4.714 -2.471
177 HG23 VAL 22 HG23 VAL 22 -16.021 6.096 -3.570
178 H ASP 23 H ASP 23 -11.340 4.293 -2.996
179 HA ASP 23 HA ASP 23 -11.901 1.501 -3.744
180 HB2 ASP 23 HB2 ASP 23 -12.658 3.539 -5.424
181 HB3 ASP 23 HB3 ASP 23 -10.985 3.339 -5.930
182 H ALA 24 H ALA 24 -9.986 0.581 -4.843
183 HA ALA 24 HA ALA 24 -7.652 0.778 -3.311
184 HB1 ALA 24 HB1 ALA 24 -6.636 -0.594 -5.151
185 HB2 ALA 24 HB2 ALA 24 -8.206 -1.217 -4.618
186 HB3 ALA 24 HB3 ALA 24 -8.084 -0.281 -6.116
187 H ALA 25 H ALA 25 -8.336 2.250 -6.523
188 HA ALA 25 HA ALA 25 -5.793 3.311 -7.010
189 HB1 ALA 25 HB1 ALA 25 -7.581 3.311 -8.680
190 HB2 ALA 25 HB2 ALA 25 -8.501 4.507 -7.733
191 HB3 ALA 25 HB3 ALA 25 -6.940 4.949 -8.466
192 H THR 26 H THR 26 -8.384 4.676 -4.894
193 HA THR 26 HA THR 26 -7.035 7.201 -4.539
194 HB THR 26 HB THR 26 -9.072 5.714 -2.837
195 HG1 THR 26 HG1 THR 26 -10.116 7.875 -3.770
196 HG21 THR 26 HG21 THR 26 -9.494 7.851 -1.663
197 HG22 THR 26 HG22 THR 26 -7.842 7.317 -1.382
198 HG23 THR 26 HG23 THR 26 -8.156 8.618 -2.544
199 H ALA 27 H ALA 27 -7.134 4.109 -2.661
200 HA ALA 27 HA ALA 27 -5.375 4.927 -0.611
201 HB1 ALA 27 HB1 ALA 27 -5.793 2.126 -1.744
202 HB2 ALA 27 HB2 ALA 27 -5.070 2.551 -0.183
203 HB3 ALA 27 HB3 ALA 27 -6.780 2.902 -0.482
204 H GLU 28 H GLU 28 -4.665 3.327 -3.738
205 HA GLU 28 HA GLU 28 -1.857 3.022 -3.475
206 HB2 GLU 28 HB2 GLU 28 -3.300 1.954 -5.178
207 HB3 GLU 28 HB3 GLU 28 -3.653 3.525 -5.889
208 HG2 GLU 28 HG2 GLU 28 -1.099 3.697 -6.337
209 HG3 GLU 28 HG3 GLU 28 -1.054 1.968 -5.978
210 H LYS 29 H LYS 29 -3.726 5.671 -5.085
211 HA LYS 29 HA LYS 29 -1.415 7.244 -5.609
212 HB2 LYS 29 HB2 LYS 29 -3.690 7.394 -6.699
213 HB3 LYS 29 HB3 LYS 29 -4.273 8.246 -5.260
214 HG2 LYS 29 HG2 LYS 29 -2.741 10.082 -5.664
215 HG3 LYS 29 HG3 LYS 29 -1.844 9.144 -6.873
216 HD2 LYS 29 HD2 LYS 29 -3.171 10.758 -8.022
217 HD3 LYS 29 HD3 LYS 29 -3.857 9.155 -8.344
218 HE2 LYS 29 HE2 LYS 29 -5.512 9.607 -6.458
219 HE3 LYS 29 HE3 LYS 29 -4.889 11.268 -6.387
220 HZ1 LYS 29 HZ1 LYS 29 -5.534 11.468 -8.735
221 HZ2 LYS 29 HZ2 LYS 29 -6.223 9.968 -8.670
222 HZ3 LYS 29 HZ3 LYS 29 -6.823 11.183 -7.735
223 H VAL 30 H VAL 30 -3.467 7.087 -2.675
224 HA VAL 30 HA VAL 30 -2.256 9.440 -1.501
225 HB VAL 30 HB VAL 30 -4.078 7.226 -0.538
226 HG11 VAL 30 HG11 VAL 30 -4.333 8.558 1.597
227 HG12 VAL 30 HG12 VAL 30 -2.828 7.644 1.454
228 HG13 VAL 30 HG13 VAL 30 -2.819 9.391 1.156
229 HG21 VAL 30 HG21 VAL 30 -4.429 10.255 -0.725
230 HG22 VAL 30 HG22 VAL 30 -4.958 9.121 -1.973
231 HG23 VAL 30 HG23 VAL 30 -5.689 9.054 -0.366
232 H PHE 31 H PHE 31 -1.874 5.895 -0.720
233 HA PHE 31 HA PHE 31 0.249 6.424 1.049
234 HB2 PHE 31 HB2 PHE 31 -0.853 3.934 -0.225
235 HB3 PHE 31 HB3 PHE 31 0.664 3.857 0.647
236 HD1 PHE 31 HD2 PHE 31 0.654 5.273 2.985
237 HD2 PHE 31 HD1 PHE 31 -2.732 3.333 1.141
238 HE1 PHE 31 HE2 PHE 31 -0.398 5.068 5.183
239 HE2 PHE 31 HE1 PHE 31 -3.750 3.045 3.381
240 HZ PHE 31 HZ PHE 31 -2.578 3.913 5.414
241 H LYS 32 H LYS 32 0.533 6.436 -2.400
242 HA LYS 32 HA LYS 32 3.146 5.379 -2.599
243 HB2 LYS 32 HB2 LYS 32 1.534 6.100 -4.437
244 HB3 LYS 32 HB3 LYS 32 2.170 7.741 -4.241
245 HG2 LYS 32 HG2 LYS 32 4.410 7.001 -4.856
246 HG3 LYS 32 HG3 LYS 32 3.932 5.294 -4.728
247 HD2 LYS 32 HD2 LYS 32 2.240 5.682 -6.544
248 HD3 LYS 32 HD3 LYS 32 2.925 7.307 -6.779
249 HE2 LYS 32 HE2 LYS 32 5.082 6.340 -7.398
250 HE3 LYS 32 HE3 LYS 32 4.543 4.721 -6.914
251 HZ1 LYS 32 HZ1 LYS 32 3.391 6.296 -9.124
252 HZ2 LYS 32 HZ2 LYS 32 4.396 5.028 -9.292
253 HZ3 LYS 32 HZ3 LYS 32 2.906 4.779 -8.647
254 H GLN 33 H GLN 33 2.059 8.473 -1.376
255 HA GLN 33 HA GLN 33 4.515 9.871 -1.254
256 HB2 GLN 33 HB2 GLN 33 1.803 10.001 0.008
257 HB3 GLN 33 HB3 GLN 33 3.056 10.705 0.991
258 HG2 GLN 33 HG2 GLN 33 3.590 12.364 -0.536
259 HG3 GLN 33 HG3 GLN 33 2.988 11.446 -1.915
260 HE21 GLN 33 HE22 GLN 33 2.275 14.128 -0.103
261 HE22 GLN 33 HE21 GLN 33 0.536 14.160 -0.292
262 H TYR 34 H TYR 34 2.888 7.860 1.267
263 HA TYR 34 HA TYR 34 5.006 7.946 3.155
264 HB2 TYR 34 HB2 TYR 34 2.879 7.289 3.926
265 HB3 TYR 34 HB3 TYR 34 2.664 6.134 2.623
266 HD1 TYR 34 HD2 TYR 34 5.082 6.634 5.517
267 HD2 TYR 34 HD1 TYR 34 2.672 3.894 3.190
268 HE1 TYR 34 HE2 TYR 34 5.776 4.768 6.979
269 HE2 TYR 34 HE1 TYR 34 3.351 2.052 4.669
270 HH TYR 34 HH TYR 34 5.089 2.422 7.630
271 H ALA 35 H ALA 35 4.289 5.567 0.545
272 HA ALA 35 HA ALA 35 6.380 3.772 1.144
273 HB1 ALA 35 HB1 ALA 35 5.129 4.402 -1.549
274 HB2 ALA 35 HB2 ALA 35 6.067 2.949 -1.146
275 HB3 ALA 35 HB3 ALA 35 4.505 3.237 -0.357
276 H ASN 36 H ASN 36 6.503 6.412 -1.385
277 HA ASN 36 HA ASN 36 9.302 5.831 -1.736
278 HB2 ASN 36 HB2 ASN 36 7.897 7.018 -3.472
279 HB3 ASN 36 HB3 ASN 36 7.987 8.472 -2.466
280 HD21 ASN 36 HD22 ASN 36 9.273 9.587 -4.147
281 HD22 ASN 36 HD21 ASN 36 10.985 9.185 -4.320
282 H ASP 37 H ASP 37 7.535 8.036 0.433
283 HA ASP 37 HA ASP 37 9.762 9.604 1.184
284 HB2 ASP 37 HB2 ASP 37 7.557 10.317 1.692
285 HB3 ASP 37 HB3 ASP 37 7.282 8.935 2.779
286 H ASN 38 H ASN 38 8.691 6.398 2.210
287 HA ASN 38 HA ASN 38 10.744 6.335 4.301
288 HB2 ASN 38 HB2 ASN 38 8.297 5.390 4.535
289 HB3 ASN 38 HB3 ASN 38 8.964 3.982 3.705
290 HD21 ASN 38 HD22 ASN 38 8.521 2.791 5.828
291 HD22 ASN 38 HD21 ASN 38 9.703 2.976 7.106
292 H GLY 39 H GLY 39 10.884 5.863 1.035
293 HA2 GLY 39 HA2 GLY 39 12.739 5.099 -0.121
294 HA3 GLY 39 HA3 GLY 39 13.315 4.247 1.304
295 H VAL 40 H VAL 40 10.035 3.728 -0.200
296 HA VAL 40 HA VAL 40 10.976 1.032 -1.053
297 HB VAL 40 HB VAL 40 8.295 1.752 0.184
298 HG11 VAL 40 HG11 VAL 40 9.432 -0.917 -0.769
299 HG12 VAL 40 HG12 VAL 40 7.947 -0.736 0.186
300 HG13 VAL 40 HG13 VAL 40 8.036 -0.060 -1.442
301 HG21 VAL 40 HG21 VAL 40 9.067 0.254 2.048
302 HG22 VAL 40 HG22 VAL 40 10.672 0.195 1.297
303 HG23 VAL 40 HG23 VAL 40 10.021 1.730 1.913
304 H ASP 41 H ASP 41 10.554 0.463 -3.122
305 HA ASP 41 HA ASP 41 8.492 1.892 -4.676
306 HB2 ASP 41 HB2 ASP 41 10.687 3.187 -4.843
307 HB3 ASP 41 HB3 ASP 41 11.398 1.782 -5.622
308 H GLY 42 H GLY 42 7.321 -0.020 -5.044
309 HA2 GLY 42 HA2 GLY 42 8.609 -2.039 -6.746
310 HA3 GLY 42 HA3 GLY 42 7.944 -2.556 -5.189
311 H GLU 43 H GLU 43 6.719 -3.880 -6.901
312 HA GLU 43 HA GLU 43 4.691 -2.624 -8.473
313 HB2 GLU 43 HB2 GLU 43 5.826 -4.954 -8.741
314 HB3 GLU 43 HB3 GLU 43 4.677 -5.522 -7.530
315 HG2 GLU 43 HG2 GLU 43 3.837 -5.993 -9.770
316 HG3 GLU 43 HG3 GLU 43 2.799 -4.779 -9.007
317 H TRP 44 H TRP 44 2.746 -1.916 -7.935
318 HA TRP 44 HA TRP 44 1.723 -2.178 -5.199
319 HB2 TRP 44 HB2 TRP 44 1.012 -0.490 -7.638
320 HB3 TRP 44 HB3 TRP 44 0.028 -0.477 -6.195
321 HD1 TRP 44 HD1 TRP 44 3.672 0.218 -7.232
322 HE1 TRP 44 HE1 TRP 44 4.729 1.922 -5.712
323 HE3 TRP 44 HE3 TRP 44 -0.264 0.963 -4.008
324 HZ2 TRP 44 HZ2 TRP 44 4.075 3.252 -3.239
325 HZ3 TRP 44 HZ3 TRP 44 0.024 2.395 -2.018
326 HH2 TRP 44 HH2 TRP 44 2.210 3.497 -1.582
327 H THR 45 H THR 45 0.810 -4.246 -4.985
328 HA THR 45 HA THR 45 -1.357 -4.937 -6.930
329 HB THR 45 HB THR 45 0.453 -6.815 -5.387
330 HG1 THR 45 HG1 THR 45 1.515 -7.046 -7.284
331 HG21 THR 45 HG21 THR 45 -1.475 -7.326 -7.702
332 HG22 THR 45 HG22 THR 45 -0.433 -8.525 -6.928
333 HG23 THR 45 HG23 THR 45 -1.768 -7.806 -6.011
334 H TYR 46 H TYR 46 -3.314 -4.942 -6.181
335 HA TYR 46 HA TYR 46 -3.865 -4.803 -3.285
336 HB2 TYR 46 HB2 TYR 46 -5.881 -3.725 -3.880
337 HB3 TYR 46 HB3 TYR 46 -4.647 -3.027 -4.922
338 HD1 TYR 46 HD2 TYR 46 -7.613 -5.242 -4.804
339 HD2 TYR 46 HD1 TYR 46 -4.671 -3.371 -7.361
340 HE1 TYR 46 HE2 TYR 46 -8.833 -6.051 -6.779
341 HE2 TYR 46 HE1 TYR 46 -5.900 -4.172 -9.352
342 HH TYR 46 HH TYR 46 -8.341 -6.585 -9.201
343 H ASP 47 H ASP 47 -5.490 -6.122 -2.303
344 HA ASP 47 HA ASP 47 -6.637 -8.364 -3.853
345 HB2 ASP 47 HB2 ASP 47 -4.622 -9.260 -2.765
346 HB3 ASP 47 HB3 ASP 47 -5.198 -8.693 -1.194
347 H ASP 48 H ASP 48 -8.595 -7.335 -3.816
348 HA ASP 48 HA ASP 48 -9.689 -5.890 -1.606
349 HB2 ASP 48 HB2 ASP 48 -11.648 -5.728 -2.971
350 HB3 ASP 48 HB3 ASP 48 -10.256 -5.578 -4.044
351 H ALA 49 H ALA 49 -9.544 -9.324 -2.269
352 HA ALA 49 HA ALA 49 -11.954 -9.992 -0.720
353 HB1 ALA 49 HB1 ALA 49 -9.730 -11.805 -1.724
354 HB2 ALA 49 HB2 ALA 49 -11.293 -12.304 -1.065
355 HB3 ALA 49 HB3 ALA 49 -11.233 -11.432 -2.605
356 H THR 50 H THR 50 -8.409 -10.334 -0.404
357 HA THR 50 HA THR 50 -8.486 -11.125 2.370
358 HB THR 50 HB THR 50 -6.187 -10.171 0.640
359 HG1 THR 50 HG1 THR 50 -6.392 -11.953 -0.391
360 HG21 THR 50 HG21 THR 50 -4.784 -11.578 1.973
361 HG22 THR 50 HG22 THR 50 -5.578 -10.443 3.053
362 HG23 THR 50 HG23 THR 50 -6.151 -12.132 2.971
363 H LYS 51 H LYS 51 -8.522 -8.094 0.718
364 HA LYS 51 HA LYS 51 -8.599 -5.969 1.281
365 HB2 LYS 51 HB2 LYS 51 -8.854 -6.642 4.219
366 HB3 LYS 51 HB3 LYS 51 -9.338 -5.180 3.362
367 HG2 LYS 51 HG2 LYS 51 -10.978 -6.573 2.024
368 HG3 LYS 51 HG3 LYS 51 -10.597 -7.943 3.094
369 HD2 LYS 51 HD2 LYS 51 -11.291 -6.570 5.061
370 HD3 LYS 51 HD3 LYS 51 -11.714 -5.245 3.939
371 HE2 LYS 51 HE2 LYS 51 -13.182 -6.966 2.727
372 HE3 LYS 51 HE3 LYS 51 -12.949 -8.033 4.114
373 HZ1 LYS 51 HZ1 LYS 51 -13.936 -6.252 5.490
374 HZ2 LYS 51 HZ2 LYS 51 -14.093 -5.318 4.156
375 HZ3 LYS 51 HZ3 LYS 51 -14.953 -6.722 4.247
376 H THR 52 H THR 52 -6.109 -7.298 0.930
377 HA THR 52 HA THR 52 -4.320 -5.582 2.556
378 HB THR 52 HB THR 52 -2.595 -7.365 2.164
379 HG1 THR 52 HG1 THR 52 -3.322 -8.654 0.666
380 HG21 THR 52 HG21 THR 52 -3.421 -8.883 3.950
381 HG22 THR 52 HG22 THR 52 -3.640 -7.185 4.352
382 HG23 THR 52 HG23 THR 52 -5.034 -8.157 3.820
383 H PHE 53 H PHE 53 -2.476 -4.759 1.379
384 HA PHE 53 HA PHE 53 -2.591 -4.819 -1.531
385 HB2 PHE 53 HB2 PHE 53 -4.095 -2.956 -0.608
386 HB3 PHE 53 HB3 PHE 53 -2.665 -2.231 0.087
387 HD1 PHE 53 HD2 PHE 53 -0.643 -2.446 -2.117
388 HD2 PHE 53 HD1 PHE 53 -4.867 -1.527 -2.274
389 HE1 PHE 53 HE2 PHE 53 -0.325 -1.379 -4.252
390 HE2 PHE 53 HE1 PHE 53 -4.498 -0.356 -4.443
391 HZ PHE 53 HZ PHE 53 -2.258 -0.327 -5.476
392 H THR 54 H THR 54 -0.414 -5.221 -2.029
393 HA THR 54 HA THR 54 1.563 -4.428 0.054
394 HB THR 54 HB THR 54 2.061 -6.797 -1.702
395 HG1 THR 54 HG1 THR 54 1.119 -8.151 -0.235
396 HG21 THR 54 HG21 THR 54 2.649 -6.206 1.227
397 HG22 THR 54 HG22 THR 54 3.338 -7.516 0.266
398 HG23 THR 54 HG23 THR 54 3.768 -5.852 -0.110
399 H VAL 55 H VAL 55 3.322 -3.386 -0.565
400 HA VAL 55 HA VAL 55 3.811 -2.860 -3.457
401 HB VAL 55 HB VAL 55 4.685 -1.235 -1.020
402 HG11 VAL 55 HG11 VAL 55 6.139 -1.003 -3.005
403 HG12 VAL 55 HG12 VAL 55 4.722 -0.632 -4.012
404 HG13 VAL 55 HG13 VAL 55 5.219 0.485 -2.720
405 HG21 VAL 55 HG21 VAL 55 2.350 -0.755 -2.905
406 HG22 VAL 55 HG22 VAL 55 2.264 -1.080 -1.158
407 HG23 VAL 55 HG23 VAL 55 2.986 0.420 -1.728
408 H THR 56 H THR 56 5.063 -4.697 -3.867
409 HA THR 56 HA THR 56 7.222 -5.373 -1.939
410 HB THR 56 HB THR 56 6.115 -7.144 -4.129
411 HG1 THR 56 HG1 THR 56 4.419 -6.876 -2.932
412 HG21 THR 56 HG21 THR 56 7.628 -7.730 -1.547
413 HG22 THR 56 HG22 THR 56 6.966 -8.948 -2.655
414 HG23 THR 56 HG23 THR 56 8.258 -7.871 -3.207
415 H GLU 57 H GLU 57 9.243 -4.916 -2.460
416 HA GLU 57 HA GLU 57 9.959 -4.221 -5.260
417 HB2 GLU 57 HB2 GLU 57 9.912 -2.304 -3.773
418 HB3 GLU 57 HB3 GLU 57 10.795 -3.197 -2.530
419 HG2 GLU 57 HG2 GLU 57 12.809 -3.234 -3.823
420 HG3 GLU 57 HG3 GLU 57 11.989 -2.587 -5.241
Start of MODEL 20
1 H1 MET 1 H MET 1 -18.647 1.122 3.070
2 HA MET 1 HA MET 1 -16.796 2.561 2.620
3 HB2 MET 1 HB2 MET 1 -17.361 3.920 4.768
4 HB3 MET 1 HB3 MET 1 -16.326 2.768 5.618
5 HG2 MET 1 HG2 MET 1 -15.134 4.805 5.002
6 HG3 MET 1 HG3 MET 1 -14.420 3.410 4.215
7 HE1 MET 1 HE1 MET 1 -14.115 6.627 3.626
8 HE2 MET 1 HE2 MET 1 -13.130 5.324 2.946
9 HE3 MET 1 HE3 MET 1 -13.878 6.525 1.865
10 H GLY 2 H GLY 2 -14.416 1.830 2.866
11 HA2 GLY 2 HA2 GLY 2 -14.158 -0.907 3.966
12 HA3 GLY 2 HA3 GLY 2 -13.700 -0.514 2.316
13 H THR 3 H THR 3 -11.661 -1.475 3.775
14 HA THR 3 HA THR 3 -9.927 0.836 4.265
15 HB THR 3 HB THR 3 -10.423 -1.406 6.275
16 HG1 THR 3 HG1 THR 3 -11.687 0.753 5.936
17 HG21 THR 3 HG21 THR 3 -8.020 -0.800 6.303
18 HG22 THR 3 HG22 THR 3 -8.449 0.920 6.463
19 HG23 THR 3 HG23 THR 3 -8.837 -0.232 7.761
20 H TYR 4 H TYR 4 -7.735 0.352 3.786
21 HA TYR 4 HA TYR 4 -7.188 -2.368 2.667
22 HB2 TYR 4 HB2 TYR 4 -6.287 0.333 1.593
23 HB3 TYR 4 HB3 TYR 4 -5.580 -1.202 1.125
24 HD1 TYR 4 HD1 TYR 4 -6.955 -2.934 -0.140
25 HD2 TYR 4 HD2 TYR 4 -8.327 1.093 0.606
26 HE1 TYR 4 HE1 TYR 4 -8.698 -3.206 -1.879
27 HE2 TYR 4 HE2 TYR 4 -10.043 0.842 -1.143
28 HH TYR 4 HH TYR 4 -10.852 -2.259 -2.580
29 H LYS 5 H LYS 5 -5.545 -3.330 3.633
30 HA LYS 5 HA LYS 5 -3.881 -1.875 5.611
31 HB2 LYS 5 HB2 LYS 5 -4.206 -4.800 4.834
32 HB3 LYS 5 HB3 LYS 5 -3.017 -4.230 6.020
33 HG2 LYS 5 HG2 LYS 5 -4.802 -3.346 7.452
34 HG3 LYS 5 HG3 LYS 5 -6.022 -3.742 6.227
35 HD2 LYS 5 HD2 LYS 5 -5.385 -6.150 6.422
36 HD3 LYS 5 HD3 LYS 5 -4.312 -5.744 7.766
37 HE2 LYS 5 HE2 LYS 5 -6.069 -5.163 9.195
38 HE3 LYS 5 HE3 LYS 5 -7.152 -4.724 7.859
39 HZ1 LYS 5 HZ1 LYS 5 -7.792 -6.774 8.939
40 HZ2 LYS 5 HZ2 LYS 5 -7.471 -6.970 7.335
41 HZ3 LYS 5 HZ3 LYS 5 -6.367 -7.489 8.448
42 H LEU 6 H LEU 6 -2.150 -0.869 4.792
43 HA LEU 6 HA LEU 6 -1.067 -1.596 2.169
44 HB2 LEU 6 HB2 LEU 6 -1.604 0.778 3.043
45 HB3 LEU 6 HB3 LEU 6 -0.189 0.618 4.046
46 HG LEU 6 HG LEU 6 0.467 1.857 2.156
47 HD11 LEU 6 HD11 LEU 6 2.141 0.636 0.952
48 HD12 LEU 6 HD12 LEU 6 2.157 0.058 2.616
49 HD13 LEU 6 HD13 LEU 6 1.402 -0.921 1.335
50 HD21 LEU 6 HD21 LEU 6 0.019 1.158 -0.156
51 HD22 LEU 6 HD22 LEU 6 -0.862 -0.263 0.431
52 HD23 LEU 6 HD23 LEU 6 -1.482 1.353 0.740
53 H ILE 7 H ILE 7 0.408 -3.285 2.220
54 HA ILE 7 HA ILE 7 2.299 -3.443 4.543
55 HB ILE 7 HB ILE 7 1.419 -5.586 2.567
56 HG12 ILE 7 HG12 ILE 7 0.949 -6.884 4.669
57 HG13 ILE 7 HG13 ILE 7 1.284 -5.445 5.625
58 HG21 ILE 7 HG21 ILE 7 3.887 -5.737 2.947
59 HG22 ILE 7 HG22 ILE 7 3.616 -5.714 4.699
60 HG23 ILE 7 HG23 ILE 7 3.042 -7.077 3.705
61 HD11 ILE 7 HD11 ILE 7 -0.702 -4.361 4.793
62 HD12 ILE 7 HD12 ILE 7 -0.931 -5.613 3.538
63 HD13 ILE 7 HD13 ILE 7 -1.145 -6.003 5.260
64 H LEU 8 H LEU 8 4.281 -2.700 4.129
65 HA LEU 8 HA LEU 8 5.058 -2.100 1.324
66 HB2 LEU 8 HB2 LEU 8 4.695 -0.278 3.236
67 HB3 LEU 8 HB3 LEU 8 6.230 -0.882 3.841
68 HG LEU 8 HG LEU 8 7.116 -0.478 1.443
69 HD11 LEU 8 HD11 LEU 8 5.943 1.134 0.087
70 HD12 LEU 8 HD12 LEU 8 4.786 -0.140 0.457
71 HD13 LEU 8 HD13 LEU 8 4.701 1.386 1.342
72 HD21 LEU 8 HD21 LEU 8 7.766 0.920 3.360
73 HD22 LEU 8 HD22 LEU 8 7.518 1.937 1.932
74 HD23 LEU 8 HD23 LEU 8 6.275 1.876 3.197
75 H ASN 9 H ASN 9 6.626 -3.513 0.531
76 HA ASN 9 HA ASN 9 8.493 -4.793 2.467
77 HB2 ASN 9 HB2 ASN 9 6.865 -6.448 1.865
78 HB3 ASN 9 HB3 ASN 9 6.916 -5.993 0.168
79 HD21 ASN 9 HD22 ASN 9 9.165 -6.257 -0.932
80 HD22 ASN 9 HD21 ASN 9 9.873 -7.815 -0.648
81 H GLY 10 H GLY 10 10.405 -3.683 2.064
82 HA2 GLY 10 HA2 GLY 10 11.145 -3.125 -0.766
83 HA3 GLY 10 HA3 GLY 10 11.592 -2.177 0.652
84 H LYS 11 H LYS 11 13.610 -2.782 -0.868
85 HA LYS 11 HA LYS 11 14.909 -5.313 -0.197
86 HB2 LYS 11 HB2 LYS 11 16.866 -4.432 -1.369
87 HB3 LYS 11 HB3 LYS 11 15.458 -4.305 -2.366
88 HG2 LYS 11 HG2 LYS 11 16.190 -1.876 -0.730
89 HG3 LYS 11 HG3 LYS 11 17.264 -2.320 -2.055
90 HD2 LYS 11 HD2 LYS 11 15.528 -2.121 -3.679
91 HD3 LYS 11 HD3 LYS 11 14.290 -1.981 -2.439
92 HE2 LYS 11 HE2 LYS 11 15.466 0.160 -1.647
93 HE3 LYS 11 HE3 LYS 11 16.496 0.018 -3.093
94 HZ1 LYS 11 HZ1 LYS 11 13.617 0.608 -2.966
95 HZ2 LYS 11 HZ2 LYS 11 14.807 1.335 -3.912
96 HZ3 LYS 11 HZ3 LYS 11 14.190 -0.136 -4.240
97 H THR 12 H THR 12 14.523 -2.488 1.603
98 HA THR 12 HA THR 12 16.904 -3.200 3.274
99 HB THR 12 HB THR 12 16.006 -0.393 2.511
100 HG1 THR 12 HG1 THR 12 17.635 -0.286 1.147
101 HG21 THR 12 HG21 THR 12 18.506 -1.372 3.932
102 HG22 THR 12 HG22 THR 12 18.271 0.279 3.335
103 HG23 THR 12 HG23 THR 12 17.213 -0.338 4.603
104 H LEU 13 H LEU 13 13.547 -1.948 3.138
105 HA LEU 13 HA LEU 13 13.302 -2.345 6.010
106 HB2 LEU 13 HB2 LEU 13 12.475 -0.151 6.424
107 HB3 LEU 13 HB3 LEU 13 14.038 0.006 5.690
108 HG LEU 13 HG LEU 13 12.683 1.743 4.916
109 HD11 LEU 13 HD11 LEU 13 12.737 -0.182 2.564
110 HD12 LEU 13 HD12 LEU 13 12.703 1.579 2.513
111 HD13 LEU 13 HD13 LEU 13 14.128 0.773 3.166
112 HD21 LEU 13 HD21 LEU 13 10.578 1.646 3.854
113 HD22 LEU 13 HD22 LEU 13 10.550 -0.107 3.805
114 HD23 LEU 13 HD23 LEU 13 10.445 0.740 5.369
115 H LYS 14 H LYS 14 10.961 -1.997 6.654
116 HA LYS 14 HA LYS 14 8.993 -2.546 4.536
117 HB2 LYS 14 HB2 LYS 14 9.245 -4.256 7.049
118 HB3 LYS 14 HB3 LYS 14 7.966 -4.327 5.851
119 HG2 LYS 14 HG2 LYS 14 9.858 -4.838 4.125
120 HG3 LYS 14 HG3 LYS 14 10.836 -5.196 5.559
121 HD2 LYS 14 HD2 LYS 14 9.065 -6.765 6.339
122 HD3 LYS 14 HD3 LYS 14 8.146 -6.412 4.860
123 HE2 LYS 14 HE2 LYS 14 10.055 -7.250 3.496
124 HE3 LYS 14 HE3 LYS 14 10.917 -7.678 4.980
125 HZ1 LYS 14 HZ1 LYS 14 9.694 -9.525 3.951
126 HZ2 LYS 14 HZ2 LYS 14 9.169 -9.218 5.506
127 HZ3 LYS 14 HZ3 LYS 14 8.265 -8.742 4.219
128 H GLY 15 H GLY 15 6.710 -2.423 5.510
129 HA2 GLY 15 HA2 GLY 15 6.398 -0.897 7.977
130 HA3 GLY 15 HA3 GLY 15 6.104 0.021 6.505
131 H GLU 16 H GLU 16 4.074 -0.552 8.408
132 HA GLU 16 HA GLU 16 2.171 -1.954 6.680
133 HB2 GLU 16 HB2 GLU 16 2.998 -3.752 8.132
134 HB3 GLU 16 HB3 GLU 16 2.564 -2.814 9.577
135 HG2 GLU 16 HG2 GLU 16 0.208 -2.859 8.954
136 HG3 GLU 16 HG3 GLU 16 0.582 -3.510 7.362
137 H THR 17 H THR 17 0.535 -0.464 6.457
138 HA THR 17 HA THR 17 -0.315 1.136 8.806
139 HB THR 17 HB THR 17 -0.388 3.120 7.274
140 HG1 THR 17 HG1 THR 17 0.737 3.091 5.425
141 HG21 THR 17 HG21 THR 17 2.445 2.040 7.625
142 HG22 THR 17 HG22 THR 17 1.931 3.731 7.514
143 HG23 THR 17 HG23 THR 17 1.483 2.752 8.924
144 H THR 18 H THR 18 -2.482 2.404 8.113
145 HA THR 18 HA THR 18 -4.189 0.621 6.444
146 HB THR 18 HB THR 18 -5.926 1.008 8.250
147 HG1 THR 18 HG1 THR 18 -5.108 1.705 10.299
148 HG21 THR 18 HG21 THR 18 -3.441 -0.431 9.289
149 HG22 THR 18 HG22 THR 18 -5.119 -0.679 9.807
150 HG23 THR 18 HG23 THR 18 -4.625 -1.125 8.162
151 H THR 19 H THR 19 -5.848 1.732 5.262
152 HA THR 19 HA THR 19 -6.311 4.555 5.804
153 HB THR 19 HB THR 19 -4.341 4.453 4.311
154 HG1 THR 19 HG1 THR 19 -4.844 6.143 3.360
155 HG21 THR 19 HG21 THR 19 -4.578 3.952 1.944
156 HG22 THR 19 HG22 THR 19 -5.012 2.505 2.875
157 HG23 THR 19 HG23 THR 19 -6.286 3.519 2.164
158 H GLU 20 H GLU 20 -8.443 5.149 5.172
159 HA GLU 20 HA GLU 20 -10.069 2.960 3.988
160 HB2 GLU 20 HB2 GLU 20 -11.974 3.860 5.317
161 HB3 GLU 20 HB3 GLU 20 -10.755 2.936 6.182
162 HG2 GLU 20 HG2 GLU 20 -9.884 4.886 7.272
163 HG3 GLU 20 HG3 GLU 20 -10.867 5.951 6.251
164 H ALA 21 H ALA 21 -10.512 3.475 2.022
165 HA ALA 21 HA ALA 21 -11.496 6.198 1.356
166 HB1 ALA 21 HB1 ALA 21 -9.096 6.107 0.731
167 HB2 ALA 21 HB2 ALA 21 -9.407 4.645 -0.241
168 HB3 ALA 21 HB3 ALA 21 -10.158 6.195 -0.685
169 H VAL 22 H VAL 22 -12.663 6.156 -0.791
170 HA VAL 22 HA VAL 22 -14.553 4.039 -0.877
171 HB VAL 22 HB VAL 22 -14.965 6.396 -1.454
172 HG11 VAL 22 HG11 VAL 22 -14.321 7.351 -3.604
173 HG12 VAL 22 HG12 VAL 22 -12.861 6.884 -2.733
174 HG13 VAL 22 HG13 VAL 22 -13.465 5.874 -4.057
175 HG21 VAL 22 HG21 VAL 22 -15.637 4.564 -3.781
176 HG22 VAL 22 HG22 VAL 22 -16.520 4.648 -2.239
177 HG23 VAL 22 HG23 VAL 22 -16.470 6.056 -3.315
178 H ASP 23 H ASP 23 -11.443 4.455 -2.605
179 HA ASP 23 HA ASP 23 -11.899 1.834 -3.907
180 HB2 ASP 23 HB2 ASP 23 -11.526 4.522 -5.226
181 HB3 ASP 23 HB3 ASP 23 -10.608 3.178 -5.887
182 H ALA 24 H ALA 24 -10.013 0.826 -4.629
183 HA ALA 24 HA ALA 24 -7.789 0.891 -2.904
184 HB1 ALA 24 HB1 ALA 24 -8.603 -1.055 -4.313
185 HB2 ALA 24 HB2 ALA 24 -7.990 -0.222 -5.749
186 HB3 ALA 24 HB3 ALA 24 -6.878 -0.760 -4.475
187 H ALA 25 H ALA 25 -8.369 2.391 -6.071
188 HA ALA 25 HA ALA 25 -5.770 3.247 -6.703
189 HB1 ALA 25 HB1 ALA 25 -7.668 3.391 -8.266
190 HB2 ALA 25 HB2 ALA 25 -8.436 4.621 -7.231
191 HB3 ALA 25 HB3 ALA 25 -6.911 4.984 -8.070
192 H THR 26 H THR 26 -8.228 4.863 -4.562
193 HA THR 26 HA THR 26 -6.632 7.207 -4.163
194 HB THR 26 HB THR 26 -8.825 5.955 -2.464
195 HG1 THR 26 HG1 THR 26 -9.724 8.014 -3.769
196 HG21 THR 26 HG21 THR 26 -9.181 8.256 -1.607
197 HG22 THR 26 HG22 THR 26 -7.581 7.654 -1.171
198 HG23 THR 26 HG23 THR 26 -7.749 8.816 -2.503
199 H ALA 27 H ALA 27 -6.965 4.123 -2.328
200 HA ALA 27 HA ALA 27 -5.272 4.807 -0.182
201 HB1 ALA 27 HB1 ALA 27 -5.685 2.079 -1.512
202 HB2 ALA 27 HB2 ALA 27 -4.965 2.349 0.074
203 HB3 ALA 27 HB3 ALA 27 -6.671 2.772 -0.206
204 H GLU 28 H GLU 28 -4.488 3.236 -3.285
205 HA GLU 28 HA GLU 28 -1.702 2.965 -2.990
206 HB2 GLU 28 HB2 GLU 28 -3.205 1.885 -4.667
207 HB3 GLU 28 HB3 GLU 28 -3.472 3.430 -5.427
208 HG2 GLU 28 HG2 GLU 28 -0.818 3.367 -5.749
209 HG3 GLU 28 HG3 GLU 28 -1.071 1.627 -5.555
210 H LYS 29 H LYS 29 -3.479 5.532 -4.787
211 HA LYS 29 HA LYS 29 -1.213 7.044 -5.442
212 HB2 LYS 29 HB2 LYS 29 -4.133 7.804 -5.112
213 HB3 LYS 29 HB3 LYS 29 -2.912 8.950 -5.686
214 HG2 LYS 29 HG2 LYS 29 -2.473 7.760 -7.668
215 HG3 LYS 29 HG3 LYS 29 -3.161 6.258 -7.052
216 HD2 LYS 29 HD2 LYS 29 -4.609 7.241 -8.755
217 HD3 LYS 29 HD3 LYS 29 -5.415 7.125 -7.189
218 HE2 LYS 29 HE2 LYS 29 -4.804 9.553 -6.783
219 HE3 LYS 29 HE3 LYS 29 -4.263 9.633 -8.469
220 HZ1 LYS 29 HZ1 LYS 29 -6.984 8.828 -7.622
221 HZ2 LYS 29 HZ2 LYS 29 -6.600 10.347 -8.069
222 HZ3 LYS 29 HZ3 LYS 29 -6.525 9.145 -9.169
223 H VAL 30 H VAL 30 -3.372 7.475 -2.574
224 HA VAL 30 HA VAL 30 -1.877 9.711 -1.612
225 HB VAL 30 HB VAL 30 -3.847 7.865 -0.209
226 HG11 VAL 30 HG11 VAL 30 -2.485 9.001 1.480
227 HG12 VAL 30 HG12 VAL 30 -2.690 10.554 0.642
228 HG13 VAL 30 HG13 VAL 30 -4.084 9.741 1.417
229 HG21 VAL 30 HG21 VAL 30 -4.182 10.672 -1.398
230 HG22 VAL 30 HG22 VAL 30 -4.804 9.190 -2.131
231 HG23 VAL 30 HG23 VAL 30 -5.440 9.723 -0.574
232 H PHE 31 H PHE 31 -1.785 6.185 -0.552
233 HA PHE 31 HA PHE 31 0.301 6.786 1.306
234 HB2 PHE 31 HB2 PHE 31 -0.821 4.222 0.203
235 HB3 PHE 31 HB3 PHE 31 0.759 4.164 0.917
236 HD1 PHE 31 HD2 PHE 31 0.660 5.988 3.265
237 HD2 PHE 31 HD1 PHE 31 -2.200 3.119 1.767
238 HE1 PHE 31 HE2 PHE 31 -0.182 5.638 5.542
239 HE2 PHE 31 HE1 PHE 31 -2.912 2.652 4.096
240 HZ PHE 31 HZ PHE 31 -1.977 3.988 5.975
241 H LYS 32 H LYS 32 0.519 6.534 -2.157
242 HA LYS 32 HA LYS 32 3.102 5.486 -2.439
243 HB2 LYS 32 HB2 LYS 32 1.550 6.037 -4.272
244 HB3 LYS 32 HB3 LYS 32 1.870 7.765 -4.009
245 HG2 LYS 32 HG2 LYS 32 4.210 7.476 -4.619
246 HG3 LYS 32 HG3 LYS 32 4.032 5.707 -4.655
247 HD2 LYS 32 HD2 LYS 32 2.492 5.812 -6.496
248 HD3 LYS 32 HD3 LYS 32 2.398 7.584 -6.391
249 HE2 LYS 32 HE2 LYS 32 4.605 7.890 -7.167
250 HE3 LYS 32 HE3 LYS 32 5.018 6.177 -6.957
251 HZ1 LYS 32 HZ1 LYS 32 2.936 7.088 -8.834
252 HZ2 LYS 32 HZ2 LYS 32 4.528 6.829 -9.261
253 HZ3 LYS 32 HZ3 LYS 32 3.624 5.586 -8.707
254 H GLN 33 H GLN 33 2.119 8.676 -1.297
255 HA GLN 33 HA GLN 33 4.600 10.051 -1.444
256 HB2 GLN 33 HB2 GLN 33 2.363 10.127 0.646
257 HB3 GLN 33 HB3 GLN 33 3.666 11.301 0.556
258 HG2 GLN 33 HG2 GLN 33 2.874 12.125 -1.581
259 HG3 GLN 33 HG3 GLN 33 1.655 10.840 -1.690
260 HE21 GLN 33 HE22 GLN 33 0.011 10.744 0.091
261 HE22 GLN 33 HE21 GLN 33 -0.446 12.259 0.896
262 H TYR 34 H TYR 34 3.139 8.352 1.350
263 HA TYR 34 HA TYR 34 5.386 8.296 3.015
264 HB2 TYR 34 HB2 TYR 34 3.525 7.868 4.224
265 HB3 TYR 34 HB3 TYR 34 2.691 7.072 2.906
266 HD1 TYR 34 HD2 TYR 34 5.164 6.534 5.652
267 HD2 TYR 34 HD1 TYR 34 2.713 4.689 2.610
268 HE1 TYR 34 HE2 TYR 34 5.713 4.292 6.562
269 HE2 TYR 34 HE1 TYR 34 3.255 2.461 3.514
270 HH TYR 34 HH TYR 34 4.153 1.345 5.402
271 H ALA 35 H ALA 35 4.247 5.827 0.664
272 HA ALA 35 HA ALA 35 6.106 3.807 1.305
273 HB1 ALA 35 HB1 ALA 35 4.812 4.546 -1.358
274 HB2 ALA 35 HB2 ALA 35 5.685 3.042 -1.063
275 HB3 ALA 35 HB3 ALA 35 4.197 3.392 -0.153
276 H ASN 36 H ASN 36 6.333 6.361 -1.207
277 HA ASN 36 HA ASN 36 8.981 5.679 -2.054
278 HB2 ASN 36 HB2 ASN 36 7.247 7.129 -3.292
279 HB3 ASN 36 HB3 ASN 36 7.694 8.436 -2.196
280 HD21 ASN 36 HD22 ASN 36 8.720 6.457 -4.968
281 HD22 ASN 36 HD21 ASN 36 10.097 7.453 -5.330
282 H ASP 37 H ASP 37 7.727 8.022 0.343
283 HA ASP 37 HA ASP 37 10.169 9.231 1.087
284 HB2 ASP 37 HB2 ASP 37 7.942 10.139 1.543
285 HB3 ASP 37 HB3 ASP 37 7.598 8.790 2.641
286 H ASN 38 H ASN 38 8.648 6.214 2.127
287 HA ASN 38 HA ASN 38 10.475 5.777 4.357
288 HB2 ASN 38 HB2 ASN 38 8.025 4.911 4.020
289 HB3 ASN 38 HB3 ASN 38 8.766 3.650 3.032
290 HD21 ASN 38 HD22 ASN 38 7.292 2.781 5.146
291 HD22 ASN 38 HD21 ASN 38 8.314 2.372 6.503
292 H GLY 39 H GLY 39 10.584 5.282 0.914
293 HA2 GLY 39 HA2 GLY 39 12.655 4.853 -0.168
294 HA3 GLY 39 HA3 GLY 39 13.172 3.838 1.163
295 H VAL 40 H VAL 40 9.881 3.328 -0.166
296 HA VAL 40 HA VAL 40 10.927 0.899 -1.542
297 HB VAL 40 HB VAL 40 8.294 1.113 -0.083
298 HG11 VAL 40 HG11 VAL 40 9.790 -1.251 -1.295
299 HG12 VAL 40 HG12 VAL 40 8.296 -1.376 -0.350
300 HG13 VAL 40 HG13 VAL 40 8.284 -0.541 -1.901
301 HG21 VAL 40 HG21 VAL 40 10.948 -0.060 0.834
302 HG22 VAL 40 HG22 VAL 40 9.975 1.183 1.635
303 HG23 VAL 40 HG23 VAL 40 9.400 -0.487 1.579
304 H ASP 41 H ASP 41 10.358 0.623 -3.597
305 HA ASP 41 HA ASP 41 8.010 1.957 -4.733
306 HB2 ASP 41 HB2 ASP 41 9.899 3.659 -4.783
307 HB3 ASP 41 HB3 ASP 41 10.796 2.565 -5.832
308 H GLY 42 H GLY 42 7.193 -0.045 -5.300
309 HA2 GLY 42 HA2 GLY 42 8.665 -1.620 -7.277
310 HA3 GLY 42 HA3 GLY 42 8.269 -2.414 -5.740
311 H GLU 43 H GLU 43 7.021 -3.901 -6.961
312 HA GLU 43 HA GLU 43 4.826 -3.167 -8.593
313 HB2 GLU 43 HB2 GLU 43 6.272 -5.190 -8.711
314 HB3 GLU 43 HB3 GLU 43 5.515 -5.810 -7.239
315 HG2 GLU 43 HG2 GLU 43 3.378 -5.976 -8.335
316 HG3 GLU 43 HG3 GLU 43 3.946 -5.032 -9.722
317 H TRP 44 H TRP 44 3.106 -2.096 -7.774
318 HA TRP 44 HA TRP 44 2.054 -2.519 -5.068
319 HB2 TRP 44 HB2 TRP 44 1.213 -0.749 -7.418
320 HB3 TRP 44 HB3 TRP 44 0.403 -0.775 -5.873
321 HD1 TRP 44 HD1 TRP 44 3.805 0.251 -7.370
322 HE1 TRP 44 HE1 TRP 44 4.798 2.127 -5.957
323 HE3 TRP 44 HE3 TRP 44 0.158 0.577 -3.822
324 HZ2 TRP 44 HZ2 TRP 44 4.179 3.482 -3.481
325 HZ3 TRP 44 HZ3 TRP 44 0.324 2.251 -2.003
326 HH2 TRP 44 HH2 TRP 44 2.342 3.627 -1.751
327 H THR 45 H THR 45 0.889 -4.549 -4.904
328 HA THR 45 HA THR 45 -1.223 -4.965 -6.990
329 HB THR 45 HB THR 45 -0.088 -7.195 -5.333
330 HG1 THR 45 HG1 THR 45 0.966 -6.150 -7.742
331 HG21 THR 45 HG21 THR 45 -2.172 -7.607 -6.612
332 HG22 THR 45 HG22 THR 45 -1.345 -7.116 -8.108
333 HG23 THR 45 HG23 THR 45 -0.832 -8.570 -7.240
334 H TYR 46 H TYR 46 -3.273 -4.882 -6.295
335 HA TYR 46 HA TYR 46 -3.848 -4.752 -3.418
336 HB2 TYR 46 HB2 TYR 46 -5.972 -3.868 -4.084
337 HB3 TYR 46 HB3 TYR 46 -4.702 -3.000 -4.908
338 HD1 TYR 46 HD1 TYR 46 -4.314 -3.299 -7.398
339 HD2 TYR 46 HD2 TYR 46 -7.599 -5.191 -5.305
340 HE1 TYR 46 HE1 TYR 46 -5.468 -3.685 -9.547
341 HE2 TYR 46 HE2 TYR 46 -8.756 -5.537 -7.434
342 HH TYR 46 HH TYR 46 -7.421 -4.857 -10.616
343 H ASP 47 H ASP 47 -5.369 -6.087 -2.416
344 HA ASP 47 HA ASP 47 -6.346 -8.514 -3.820
345 HB2 ASP 47 HB2 ASP 47 -4.353 -9.215 -2.687
346 HB3 ASP 47 HB3 ASP 47 -4.778 -8.332 -1.227
347 H ASP 48 H ASP 48 -8.395 -7.638 -3.902
348 HA ASP 48 HA ASP 48 -9.623 -6.256 -1.686
349 HB2 ASP 48 HB2 ASP 48 -11.538 -6.063 -2.952
350 HB3 ASP 48 HB3 ASP 48 -10.288 -6.082 -4.175
351 H ALA 49 H ALA 49 -9.177 -9.668 -2.353
352 HA ALA 49 HA ALA 49 -11.487 -10.570 -0.874
353 HB1 ALA 49 HB1 ALA 49 -8.923 -12.073 -1.551
354 HB2 ALA 49 HB2 ALA 49 -10.459 -12.777 -1.011
355 HB3 ALA 49 HB3 ALA 49 -10.356 -11.967 -2.583
356 H THR 50 H THR 50 -7.982 -10.221 -0.101
357 HA THR 50 HA THR 50 -8.572 -10.782 2.755
358 HB THR 50 HB THR 50 -5.928 -10.047 1.515
359 HG1 THR 50 HG1 THR 50 -5.989 -11.708 0.472
360 HG21 THR 50 HG21 THR 50 -4.999 -11.460 3.328
361 HG22 THR 50 HG22 THR 50 -5.867 -10.058 3.944
362 HG23 THR 50 HG23 THR 50 -6.640 -11.655 3.995
363 H LYS 51 H LYS 51 -8.433 -8.064 0.677
364 HA LYS 51 HA LYS 51 -8.576 -5.856 0.911
365 HB2 LYS 51 HB2 LYS 51 -9.517 -6.515 3.723
366 HB3 LYS 51 HB3 LYS 51 -9.386 -4.873 3.084
367 HG2 LYS 51 HG2 LYS 51 -10.889 -5.535 1.207
368 HG3 LYS 51 HG3 LYS 51 -11.112 -7.127 1.978
369 HD2 LYS 51 HD2 LYS 51 -12.006 -6.052 3.999
370 HD3 LYS 51 HD3 LYS 51 -11.613 -4.459 3.349
371 HE2 LYS 51 HE2 LYS 51 -13.950 -4.782 3.151
372 HE3 LYS 51 HE3 LYS 51 -13.245 -4.738 1.530
373 HZ1 LYS 51 HZ1 LYS 51 -13.506 -7.099 1.372
374 HZ2 LYS 51 HZ2 LYS 51 -13.966 -7.229 2.960
375 HZ3 LYS 51 HZ3 LYS 51 -14.927 -6.471 1.881
376 H THR 52 H THR 52 -6.228 -6.697 0.636
377 HA THR 52 HA THR 52 -4.480 -5.078 2.388
378 HB THR 52 HB THR 52 -2.796 -7.017 1.690
379 HG1 THR 52 HG1 THR 52 -3.712 -8.810 1.018
380 HG21 THR 52 HG21 THR 52 -3.283 -6.641 4.025
381 HG22 THR 52 HG22 THR 52 -4.924 -7.323 3.864
382 HG23 THR 52 HG23 THR 52 -3.502 -8.367 3.711
383 H PHE 53 H PHE 53 -2.605 -4.259 1.220
384 HA PHE 53 HA PHE 53 -2.676 -4.423 -1.696
385 HB2 PHE 53 HB2 PHE 53 -4.163 -2.455 -0.724
386 HB3 PHE 53 HB3 PHE 53 -2.627 -1.665 -0.439
387 HD1 PHE 53 HD2 PHE 53 -1.342 -2.948 -3.150
388 HD2 PHE 53 HD1 PHE 53 -4.935 -0.729 -2.199
389 HE1 PHE 53 HE2 PHE 53 -1.405 -2.043 -5.431
390 HE2 PHE 53 HE1 PHE 53 -4.907 0.215 -4.498
391 HZ PHE 53 HZ PHE 53 -3.160 -0.425 -6.102
392 H THR 54 H THR 54 -0.694 -5.356 -1.780
393 HA THR 54 HA THR 54 1.390 -4.382 0.051
394 HB THR 54 HB THR 54 1.271 -6.958 -1.506
395 HG1 THR 54 HG1 THR 54 0.465 -7.860 0.278
396 HG21 THR 54 HG21 THR 54 3.552 -6.403 -0.783
397 HG22 THR 54 HG22 THR 54 2.981 -6.057 0.852
398 HG23 THR 54 HG23 THR 54 2.923 -7.714 0.219
399 H VAL 55 H VAL 55 3.300 -3.607 -0.610
400 HA VAL 55 HA VAL 55 3.756 -3.205 -3.534
401 HB VAL 55 HB VAL 55 5.075 -1.685 -1.240
402 HG11 VAL 55 HG11 VAL 55 6.296 -1.717 -3.401
403 HG12 VAL 55 HG12 VAL 55 4.849 -1.106 -4.232
404 HG13 VAL 55 HG13 VAL 55 5.682 -0.098 -3.029
405 HG21 VAL 55 HG21 VAL 55 2.626 -0.929 -2.854
406 HG22 VAL 55 HG22 VAL 55 2.756 -1.107 -1.074
407 HG23 VAL 55 HG23 VAL 55 3.578 0.225 -1.892
408 H THR 56 H THR 56 4.782 -5.152 -4.009
409 HA THR 56 HA THR 56 6.814 -6.189 -2.092
410 HB THR 56 HB THR 56 5.758 -7.676 -4.507
411 HG1 THR 56 HG1 THR 56 4.017 -7.263 -3.444
412 HG21 THR 56 HG21 THR 56 6.939 -8.587 -1.843
413 HG22 THR 56 HG22 THR 56 6.368 -9.648 -3.155
414 HG23 THR 56 HG23 THR 56 7.771 -8.603 -3.416
415 H GLU 57 H GLU 57 8.486 -4.713 -2.532
416 HA GLU 57 HA GLU 57 9.248 -4.277 -5.306
417 HB2 GLU 57 HB2 GLU 57 9.421 -2.539 -3.437
418 HB3 GLU 57 HB3 GLU 57 10.764 -3.512 -2.784
419 HG2 GLU 57 HG2 GLU 57 11.813 -3.386 -5.096
420 HG3 GLU 57 HG3 GLU 57 10.553 -2.270 -5.552