Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
595722 | 2n7j RC | 25807 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 MET 1 H1 MET 1 -1.060 -13.068 -5.568
2 H2 MET 1 H2 MET 1 -2.124 -14.314 -5.180
3 H3 MET 1 H3 MET 1 -0.502 -14.654 -5.475
4 HA MET 1 HA MET 1 -1.181 -14.666 -3.114
5 HB2 MET 1 HB2 MET 1 0.946 -12.669 -3.955
6 HB3 MET 1 HB3 MET 1 0.868 -13.559 -2.422
7 HG2 MET 1 HG2 MET 1 1.172 -15.669 -3.629
8 HG3 MET 1 HG3 MET 1 1.246 -14.780 -5.167
9 HE1 MET 1 HE1 MET 1 4.724 -15.694 -5.300
10 HE2 MET 1 HE2 MET 1 3.102 -16.386 -5.322
11 HE3 MET 1 HE3 MET 1 4.170 -16.687 -3.952
12 H GLN 2 H GLN 2 -1.591 -13.411 -1.235
13 HA GLN 2 HA GLN 2 -3.069 -10.911 -1.810
14 HB2 GLN 2 HB2 GLN 2 -4.142 -12.578 -0.336
15 HB3 GLN 2 HB3 GLN 2 -2.720 -12.570 0.726
16 HG2 GLN 2 HG2 GLN 2 -3.208 -10.467 1.581
17 HG3 GLN 2 HG3 GLN 2 -4.250 -10.037 0.204
18 HE21 GLN 2 HE21 GLN 2 -4.938 -9.734 2.926
19 HE22 GLN 2 HE22 GLN 2 -6.322 -10.832 3.258
20 H TYR 3 H TYR 3 -2.359 -8.945 -1.287
21 HA TYR 3 HA TYR 3 0.143 -8.588 0.255
22 HB2 TYR 3 HB2 TYR 3 -0.824 -6.904 -2.052
23 HB3 TYR 3 HB3 TYR 3 0.578 -6.527 -1.025
24 HD1 TYR 3 HD1 TYR 3 -0.770 -9.202 -3.266
25 HD2 TYR 3 HD2 TYR 3 2.681 -7.327 -1.623
26 HE1 TYR 3 HE1 TYR 3 0.662 -10.561 -4.731
27 HE2 TYR 3 HE2 TYR 3 4.120 -8.681 -3.088
28 HH TYR 3 HH TYR 3 3.958 -9.912 -5.205
29 H LYS 4 H LYS 4 0.202 -6.809 1.731
30 HA LYS 4 HA LYS 4 -2.416 -5.612 2.301
31 HB2 LYS 4 HB2 LYS 4 -1.649 -7.202 4.021
32 HB3 LYS 4 HB3 LYS 4 -0.157 -6.259 4.207
33 HG2 LYS 4 HG2 LYS 4 -1.562 -4.302 4.886
34 HG3 LYS 4 HG3 LYS 4 -2.979 -5.381 4.864
35 HD2 LYS 4 HD2 LYS 4 -0.488 -5.888 6.516
36 HD3 LYS 4 HD3 LYS 4 -1.935 -5.050 7.130
37 HE2 LYS 4 HE2 LYS 4 -3.292 -6.998 6.795
38 HE3 LYS 4 HE3 LYS 4 -1.981 -7.828 5.924
39 HZ1 LYS 4 HZ1 LYS 4 -0.891 -8.274 7.854
40 HZ2 LYS 4 HZ2 LYS 4 -2.440 -8.280 8.444
41 HZ3 LYS 4 HZ3 LYS 4 -1.478 -6.948 8.663
42 H LEU 5 H LEU 5 -2.561 -3.456 2.830
43 HA LEU 5 HA LEU 5 0.035 -1.872 2.532
44 HB2 LEU 5 HB2 LEU 5 -1.417 -1.402 0.634
45 HB3 LEU 5 HB3 LEU 5 -2.816 -1.153 1.688
46 HG LEU 5 HG LEU 5 -1.558 0.812 2.704
47 HD11 LEU 5 HD11 LEU 5 0.684 0.321 2.052
48 HD12 LEU 5 HD12 LEU 5 0.195 1.786 1.202
49 HD13 LEU 5 HD13 LEU 5 0.240 0.244 0.347
50 HD21 LEU 5 HD21 LEU 5 -2.264 2.307 0.995
51 HD22 LEU 5 HD22 LEU 5 -3.377 0.939 0.966
52 HD23 LEU 5 HD23 LEU 5 -2.110 1.070 -0.252
53 H VAL 6 H VAL 6 0.425 -0.833 4.424
54 HA VAL 6 HA VAL 6 -1.689 -0.321 6.374
55 HB VAL 6 HB VAL 6 1.310 -0.390 6.830
56 HG11 VAL 6 HG11 VAL 6 0.912 0.131 9.082
57 HG12 VAL 6 HG12 VAL 6 -0.818 -0.186 8.950
58 HG13 VAL 6 HG13 VAL 6 -0.123 1.246 8.190
59 HG21 VAL 6 HG21 VAL 6 -0.880 -2.366 7.364
60 HG22 VAL 6 HG22 VAL 6 0.539 -2.307 8.412
61 HG23 VAL 6 HG23 VAL 6 0.728 -2.624 6.687
62 H ILE 7 H ILE 7 -2.336 1.728 6.609
63 HA ILE 7 HA ILE 7 -0.551 3.864 5.261
64 HB ILE 7 HB ILE 7 -3.537 3.982 5.930
65 HG12 ILE 7 HG12 ILE 7 -2.131 3.930 3.232
66 HG13 ILE 7 HG13 ILE 7 -2.913 2.521 3.981
67 HG21 ILE 7 HG21 ILE 7 -3.201 6.096 4.425
68 HG22 ILE 7 HG22 ILE 7 -1.529 5.985 4.975
69 HG23 ILE 7 HG23 ILE 7 -2.834 6.166 6.147
70 HD11 ILE 7 HD11 ILE 7 -4.341 3.569 2.310
71 HD12 ILE 7 HD12 ILE 7 -4.283 5.093 3.197
72 HD13 ILE 7 HD13 ILE 7 -5.057 3.681 3.918
73 H ASN 8 H ASN 8 0.635 4.871 6.749
74 HA ASN 8 HA ASN 8 -0.544 5.355 9.493
75 HB2 ASN 8 HB2 ASN 8 1.548 3.939 9.332
76 HB3 ASN 8 HB3 ASN 8 2.396 5.348 8.658
77 HD21 ASN 8 HD21 ASN 8 3.848 5.558 10.307
78 HD22 ASN 8 HD22 ASN 8 3.361 6.072 11.960
79 H GLY 9 H GLY 9 -1.756 7.135 8.423
80 HA2 GLY 9 HA2 GLY 9 -0.280 9.409 7.274
81 HA3 GLY 9 HA3 GLY 9 -1.974 9.129 7.249
82 H LYS 10 H LYS 10 -1.157 11.638 7.920
83 HA LYS 10 HA LYS 10 -0.897 12.035 10.799
84 HB2 LYS 10 HB2 LYS 10 -1.710 13.836 8.502
85 HB3 LYS 10 HB3 LYS 10 -1.447 14.382 10.170
86 HG2 LYS 10 HG2 LYS 10 0.823 14.155 10.040
87 HG3 LYS 10 HG3 LYS 10 0.735 12.836 8.848
88 HD2 LYS 10 HD2 LYS 10 1.598 14.680 7.657
89 HD3 LYS 10 HD3 LYS 10 -0.123 14.601 7.205
90 HE2 LYS 10 HE2 LYS 10 -0.675 16.408 8.660
91 HE3 LYS 10 HE3 LYS 10 0.929 16.365 9.430
92 HZ1 LYS 10 HZ1 LYS 10 0.233 17.300 6.722
93 HZ2 LYS 10 HZ2 LYS 10 1.794 16.918 7.133
94 HZ3 LYS 10 HZ3 LYS 10 1.001 18.133 7.937
95 H THR 11 H THR 11 -3.445 12.020 8.538
96 HA THR 11 HA THR 11 -5.551 12.266 10.621
97 HB THR 11 HB THR 11 -7.030 13.200 8.942
98 HG1 THR 11 HG1 THR 11 -6.365 13.485 6.976
99 HG21 THR 11 HG21 THR 11 -4.532 14.723 9.645
100 HG22 THR 11 HG22 THR 11 -6.109 14.775 10.435
101 HG23 THR 11 HG23 THR 11 -5.910 15.452 8.819
102 H LEU 12 H LEU 12 -4.514 10.208 8.010
103 HA LEU 12 HA LEU 12 -6.880 8.555 8.637
104 HB2 LEU 12 HB2 LEU 12 -6.905 9.384 6.325
105 HB3 LEU 12 HB3 LEU 12 -5.285 8.719 6.071
106 HG LEU 12 HG LEU 12 -6.176 6.436 6.415
107 HD11 LEU 12 HD11 LEU 12 -8.047 7.040 7.895
108 HD12 LEU 12 HD12 LEU 12 -8.568 6.056 6.526
109 HD13 LEU 12 HD13 LEU 12 -8.875 7.792 6.530
110 HD21 LEU 12 HD21 LEU 12 -7.710 8.005 4.335
111 HD22 LEU 12 HD22 LEU 12 -7.360 6.276 4.310
112 HD23 LEU 12 HD23 LEU 12 -6.047 7.444 4.164
113 H LYS 13 H LYS 13 -6.505 6.674 9.641
114 HA LYS 13 HA LYS 13 -3.873 5.402 9.184
115 HB2 LYS 13 HB2 LYS 13 -5.415 5.480 11.773
116 HB3 LYS 13 HB3 LYS 13 -3.899 4.601 11.500
117 HG2 LYS 13 HG2 LYS 13 -2.744 6.722 11.072
118 HG3 LYS 13 HG3 LYS 13 -4.266 7.603 11.347
119 HD2 LYS 13 HD2 LYS 13 -4.351 6.737 13.646
120 HD3 LYS 13 HD3 LYS 13 -2.829 5.854 13.370
121 HE2 LYS 13 HE2 LYS 13 -1.748 7.769 12.880
122 HE3 LYS 13 HE3 LYS 13 -3.172 8.816 13.077
123 HZ1 LYS 13 HZ1 LYS 13 -2.948 8.642 15.438
124 HZ2 LYS 13 HZ2 LYS 13 -1.488 9.119 14.816
125 HZ3 LYS 13 HZ3 LYS 13 -1.701 7.552 15.314
126 H GLY 14 H GLY 14 -4.019 3.134 8.536
127 HA2 GLY 14 HA2 GLY 14 -5.861 1.373 9.547
128 HA3 GLY 14 HA3 GLY 14 -6.718 1.951 8.139
129 H GLU 15 H GLU 15 -6.667 -0.183 7.502
130 HA GLU 15 HA GLU 15 -4.187 -0.875 6.044
131 HB2 GLU 15 HB2 GLU 15 -5.705 -2.557 8.024
132 HB3 GLU 15 HB3 GLU 15 -4.673 -3.291 6.781
133 HG2 GLU 15 HG2 GLU 15 -2.777 -1.898 7.664
134 HG3 GLU 15 HG3 GLU 15 -3.842 -1.423 9.007
135 H THR 16 H THR 16 -4.486 -2.154 4.107
136 HA THR 16 HA THR 16 -7.202 -3.121 3.619
137 HB THR 16 HB THR 16 -7.281 -0.837 2.610
138 HG1 THR 16 HG1 THR 16 -8.570 -2.134 1.498
139 HG21 THR 16 HG21 THR 16 -4.802 -0.841 1.986
140 HG22 THR 16 HG22 THR 16 -5.944 -0.171 0.822
141 HG23 THR 16 HG23 THR 16 -5.285 -1.789 0.581
142 H THR 17 H THR 17 -7.150 -4.376 1.434
143 HA THR 17 HA THR 17 -4.519 -5.628 1.113
144 HB THR 17 HB THR 17 -5.467 -7.856 1.229
145 HG1 THR 17 HG1 THR 17 -7.877 -6.501 1.896
146 HG21 THR 17 HG21 THR 17 -5.537 -8.087 3.490
147 HG22 THR 17 HG22 THR 17 -6.539 -6.655 3.726
148 HG23 THR 17 HG23 THR 17 -4.818 -6.481 3.385
149 H THR 18 H THR 18 -4.323 -6.844 -0.842
150 HA THR 18 HA THR 18 -6.553 -6.629 -2.738
151 HB THR 18 HB THR 18 -5.092 -4.536 -3.123
152 HG1 THR 18 HG1 THR 18 -6.412 -5.116 -4.771
153 HG21 THR 18 HG21 THR 18 -3.250 -6.150 -4.756
154 HG22 THR 18 HG22 THR 18 -2.961 -6.183 -3.016
155 HG23 THR 18 HG23 THR 18 -2.982 -4.645 -3.879
156 H LYS 19 H LYS 19 -6.177 -8.032 -4.633
157 HA LYS 19 HA LYS 19 -4.243 -10.199 -3.998
158 HB2 LYS 19 HB2 LYS 19 -6.723 -10.224 -5.756
159 HB3 LYS 19 HB3 LYS 19 -5.650 -11.604 -5.460
160 HG2 LYS 19 HG2 LYS 19 -6.685 -10.376 -3.003
161 HG3 LYS 19 HG3 LYS 19 -7.956 -11.014 -4.075
162 HD2 LYS 19 HD2 LYS 19 -5.515 -12.594 -3.216
163 HD3 LYS 19 HD3 LYS 19 -7.080 -12.644 -2.366
164 HE2 LYS 19 HE2 LYS 19 -6.980 -13.147 -5.326
165 HE3 LYS 19 HE3 LYS 19 -6.490 -14.435 -4.201
166 HZ1 LYS 19 HZ1 LYS 19 -8.743 -13.809 -3.088
167 HZ2 LYS 19 HZ2 LYS 19 -8.712 -14.826 -4.398
168 HZ3 LYS 19 HZ3 LYS 19 -9.124 -13.232 -4.597
169 H ALA 20 H ALA 20 -2.533 -10.480 -5.444
170 HA ALA 20 HA ALA 20 -2.805 -9.487 -8.110
171 HB1 ALA 20 HB1 ALA 20 -0.589 -8.213 -7.925
172 HB2 ALA 20 HB2 ALA 20 -0.820 -8.285 -6.178
173 HB3 ALA 20 HB3 ALA 20 -1.993 -7.440 -7.190
174 H VAL 21 H VAL 21 -1.191 -10.238 -9.607
175 HA VAL 21 HA VAL 21 -0.023 -12.646 -8.835
176 HB VAL 21 HB VAL 21 0.970 -12.793 -11.039
177 HG11 VAL 21 HG11 VAL 21 -1.470 -13.263 -10.589
178 HG12 VAL 21 HG12 VAL 21 -1.065 -12.866 -12.259
179 HG13 VAL 21 HG13 VAL 21 -1.817 -11.654 -11.222
180 HG21 VAL 21 HG21 VAL 21 -0.153 -10.033 -11.528
181 HG22 VAL 21 HG22 VAL 21 0.870 -10.998 -12.592
182 HG23 VAL 21 HG23 VAL 21 1.533 -10.323 -11.104
183 H ASP 22 H ASP 22 1.399 -9.438 -8.755
184 HA ASP 22 HA ASP 22 3.754 -10.623 -7.563
185 HB2 ASP 22 HB2 ASP 22 5.356 -9.604 -9.159
186 HB3 ASP 22 HB3 ASP 22 4.325 -10.821 -9.944
187 H ALA 23 H ALA 23 5.351 -8.898 -6.822
188 HA ALA 23 HA ALA 23 3.801 -7.127 -5.231
189 HB1 ALA 23 HB1 ALA 23 5.810 -7.839 -4.286
190 HB2 ALA 23 HB2 ALA 23 6.085 -6.139 -4.666
191 HB3 ALA 23 HB3 ALA 23 6.746 -7.393 -5.714
192 H GLU 24 H GLU 24 5.646 -6.594 -8.252
193 HA GLU 24 HA GLU 24 5.528 -3.685 -8.041
194 HB2 GLU 24 HB2 GLU 24 5.724 -5.695 -10.347
195 HB3 GLU 24 HB3 GLU 24 5.697 -3.946 -10.650
196 HG2 GLU 24 HG2 GLU 24 7.651 -3.790 -9.016
197 HG3 GLU 24 HG3 GLU 24 7.755 -5.562 -9.150
198 H THR 25 H THR 25 3.214 -6.011 -9.536
199 HA THR 25 HA THR 25 1.529 -3.848 -10.628
200 HB THR 25 HB THR 25 0.799 -6.738 -9.909
201 HG1 THR 25 HG1 THR 25 1.901 -7.105 -11.650
202 HG21 THR 25 HG21 THR 25 -0.734 -4.607 -11.361
203 HG22 THR 25 HG22 THR 25 -1.272 -5.686 -10.074
204 HG23 THR 25 HG23 THR 25 -0.986 -6.321 -11.695
205 H ALA 26 H ALA 26 1.606 -5.640 -7.447
206 HA ALA 26 HA ALA 26 -0.792 -4.366 -6.369
207 HB1 ALA 26 HB1 ALA 26 0.505 -6.298 -5.330
208 HB2 ALA 26 HB2 ALA 26 -0.020 -5.037 -4.216
209 HB3 ALA 26 HB3 ALA 26 1.659 -5.095 -4.753
210 H GLU 27 H GLU 27 2.605 -3.229 -6.776
211 HA GLU 27 HA GLU 27 2.253 -0.945 -5.203
212 HB2 GLU 27 HB2 GLU 27 4.444 -1.775 -5.973
213 HB3 GLU 27 HB3 GLU 27 4.065 -1.205 -7.610
214 HG2 GLU 27 HG2 GLU 27 3.762 1.104 -6.568
215 HG3 GLU 27 HG3 GLU 27 4.528 0.425 -5.114
216 H LYS 28 H LYS 28 1.728 -1.284 -8.715
217 HA LYS 28 HA LYS 28 1.012 1.475 -9.141
218 HB2 LYS 28 HB2 LYS 28 -0.042 -0.940 -10.629
219 HB3 LYS 28 HB3 LYS 28 -0.026 0.742 -11.195
220 HG2 LYS 28 HG2 LYS 28 2.387 0.741 -11.283
221 HG3 LYS 28 HG3 LYS 28 2.447 -0.890 -10.569
222 HD2 LYS 28 HD2 LYS 28 1.656 -1.906 -12.502
223 HD3 LYS 28 HD3 LYS 28 0.899 -0.410 -13.102
224 HE2 LYS 28 HE2 LYS 28 3.011 0.519 -13.701
225 HE3 LYS 28 HE3 LYS 28 3.893 -0.752 -12.824
226 HZ1 LYS 28 HZ1 LYS 28 3.024 -2.352 -14.429
227 HZ2 LYS 28 HZ2 LYS 28 3.916 -1.172 -15.180
228 HZ3 LYS 28 HZ3 LYS 28 2.260 -1.135 -15.264
229 H ALA 29 H ALA 29 -1.021 -1.354 -8.136
230 HA ALA 29 HA ALA 29 -3.498 0.222 -8.307
231 HB1 ALA 29 HB1 ALA 29 -4.516 -1.588 -7.054
232 HB2 ALA 29 HB2 ALA 29 -2.944 -2.197 -6.536
233 HB3 ALA 29 HB3 ALA 29 -3.412 -2.297 -8.234
234 H PHE 30 H PHE 30 -1.237 -0.556 -5.532
235 HA PHE 30 HA PHE 30 -2.862 0.855 -3.615
236 HB2 PHE 30 HB2 PHE 30 0.061 0.017 -3.682
237 HB3 PHE 30 HB3 PHE 30 -0.682 0.818 -2.281
238 HD1 PHE 30 HD1 PHE 30 -3.263 -0.437 -2.032
239 HD2 PHE 30 HD2 PHE 30 0.466 -2.173 -3.128
240 HE1 PHE 30 HE1 PHE 30 -4.039 -2.618 -1.198
241 HE2 PHE 30 HE2 PHE 30 -0.304 -4.356 -2.297
242 HZ PHE 30 HZ PHE 30 -2.558 -4.581 -1.328
243 H LYS 31 H LYS 31 -0.189 1.987 -5.774
244 HA LYS 31 HA LYS 31 -0.121 4.615 -4.462
245 HB2 LYS 31 HB2 LYS 31 0.593 3.713 -7.270
246 HB3 LYS 31 HB3 LYS 31 0.738 5.399 -6.735
247 HG2 LYS 31 HG2 LYS 31 2.106 4.263 -4.755
248 HG3 LYS 31 HG3 LYS 31 2.352 3.004 -5.990
249 HD2 LYS 31 HD2 LYS 31 3.123 4.814 -7.556
250 HD3 LYS 31 HD3 LYS 31 3.053 5.948 -6.184
251 HE2 LYS 31 HE2 LYS 31 4.852 4.986 -5.120
252 HE3 LYS 31 HE3 LYS 31 4.575 3.391 -5.859
253 HZ1 LYS 31 HZ1 LYS 31 5.563 5.751 -7.346
254 HZ2 LYS 31 HZ2 LYS 31 5.464 4.191 -7.901
255 HZ3 LYS 31 HZ3 LYS 31 6.550 4.578 -6.708
256 H GLN 32 H GLN 32 -2.270 3.259 -6.939
257 HA GLN 32 HA GLN 32 -3.568 5.802 -7.441
258 HB2 GLN 32 HB2 GLN 32 -3.785 4.000 -9.056
259 HB3 GLN 32 HB3 GLN 32 -4.505 2.933 -7.835
260 HG2 GLN 32 HG2 GLN 32 -6.500 3.609 -8.526
261 HG3 GLN 32 HG3 GLN 32 -6.126 5.217 -7.865
262 HE21 GLN 32 HE21 GLN 32 -7.862 5.108 -9.892
263 HE22 GLN 32 HE22 GLN 32 -7.097 5.698 -11.409
264 H TYR 33 H TYR 33 -4.356 3.117 -5.231
265 HA TYR 33 HA TYR 33 -6.773 4.279 -4.187
266 HB2 TYR 33 HB2 TYR 33 -6.027 1.920 -3.773
267 HB3 TYR 33 HB3 TYR 33 -4.652 2.535 -2.831
268 HD1 TYR 33 HD2 TYR 33 -5.153 3.826 -0.696
269 HD2 TYR 33 HD1 TYR 33 -8.107 1.559 -2.753
270 HE1 TYR 33 HE2 TYR 33 -6.530 3.780 1.342
271 HE2 TYR 33 HE1 TYR 33 -9.492 1.508 -0.721
272 HH TYR 33 HH TYR 33 -8.644 1.843 2.095
273 H ALA 34 H ALA 34 -3.406 4.637 -3.017
274 HA ALA 34 HA ALA 34 -3.970 6.403 -0.879
275 HB1 ALA 34 HB1 ALA 34 -1.740 5.236 -1.562
276 HB2 ALA 34 HB2 ALA 34 -1.695 6.806 -0.760
277 HB3 ALA 34 HB3 ALA 34 -1.485 6.702 -2.508
278 H ASN 35 H ASN 35 -3.265 7.144 -4.297
279 HA ASN 35 HA ASN 35 -3.401 10.030 -3.844
280 HB2 ASN 35 HB2 ASN 35 -2.432 8.932 -5.894
281 HB3 ASN 35 HB3 ASN 35 -4.067 8.439 -6.386
282 HD21 ASN 35 HD21 ASN 35 -2.672 9.830 -8.158
283 HD22 ASN 35 HD22 ASN 35 -3.271 11.521 -8.264
284 H ASP 36 H ASP 36 -6.000 7.657 -4.776
285 HA ASP 36 HA ASP 36 -8.005 9.696 -5.125
286 HB2 ASP 36 HB2 ASP 36 -8.266 6.765 -4.433
287 HB3 ASP 36 HB3 ASP 36 -9.660 7.835 -4.700
288 H ASN 37 H ASN 37 -6.635 8.362 -2.204
289 HA ASN 37 HA ASN 37 -8.823 9.711 -0.652
290 HB2 ASN 37 HB2 ASN 37 -6.854 7.527 0.040
291 HB3 ASN 37 HB3 ASN 37 -7.756 8.412 1.290
292 HD21 ASN 37 HD21 ASN 37 -7.936 6.183 -1.400
293 HD22 ASN 37 HD22 ASN 37 -9.605 5.610 -1.059
294 H GLY 38 H GLY 38 -5.943 10.734 -1.796
295 HA2 GLY 38 HA2 GLY 38 -4.949 12.745 -1.207
296 HA3 GLY 38 HA3 GLY 38 -5.929 12.807 0.242
297 H VAL 39 H VAL 39 -3.843 10.067 -0.241
298 HA VAL 39 HA VAL 39 -2.151 11.057 2.045
299 HB VAL 39 HB VAL 39 -2.631 8.236 1.096
300 HG11 VAL 39 HG11 VAL 39 -1.342 8.887 3.694
301 HG12 VAL 39 HG12 VAL 39 -0.368 9.080 2.237
302 HG13 VAL 39 HG13 VAL 39 -1.091 7.516 2.614
303 HG21 VAL 39 HG21 VAL 39 -3.981 7.945 3.011
304 HG22 VAL 39 HG22 VAL 39 -4.523 9.463 2.295
305 HG23 VAL 39 HG23 VAL 39 -3.472 9.481 3.709
306 H ASP 40 H ASP 40 -0.164 11.454 1.839
307 HA ASP 40 HA ASP 40 1.275 10.370 -0.526
308 HB2 ASP 40 HB2 ASP 40 0.400 12.551 -1.146
309 HB3 ASP 40 HB3 ASP 40 1.084 13.278 0.324
310 H GLY 41 H GLY 41 3.057 9.723 -0.289
311 HA2 GLY 41 HA2 GLY 41 4.987 10.772 1.716
312 HA3 GLY 41 HA3 GLY 41 4.131 9.336 2.225
313 H VAL 42 H VAL 42 6.056 8.530 2.724
314 HA VAL 42 HA VAL 42 7.766 7.796 0.462
315 HB VAL 42 HB VAL 42 8.224 7.700 3.441
316 HG11 VAL 42 HG11 VAL 42 9.236 5.747 2.247
317 HG12 VAL 42 HG12 VAL 42 10.398 6.800 3.055
318 HG13 VAL 42 HG13 VAL 42 10.196 6.889 1.306
319 HG21 VAL 42 HG21 VAL 42 10.227 9.173 2.565
320 HG22 VAL 42 HG22 VAL 42 8.637 9.873 2.867
321 HG23 VAL 42 HG23 VAL 42 9.127 9.473 1.223
322 H TRP 43 H TRP 43 8.042 5.696 -0.237
323 HA TRP 43 HA TRP 43 6.150 3.655 1.044
324 HB2 TRP 43 HB2 TRP 43 7.436 3.982 -1.703
325 HB3 TRP 43 HB3 TRP 43 6.576 2.507 -1.208
326 HD1 TRP 43 HD1 TRP 43 5.936 6.244 -1.917
327 HE1 TRP 43 HE1 TRP 43 3.419 6.588 -2.448
328 HE3 TRP 43 HE3 TRP 43 4.306 1.511 -0.886
329 HZ2 TRP 43 HZ2 TRP 43 1.079 4.995 -2.409
330 HZ3 TRP 43 HZ3 TRP 43 1.916 1.000 -1.159
331 HH2 TRP 43 HH2 TRP 43 0.336 2.707 -1.903
332 H THR 44 H THR 44 6.801 1.769 1.857
333 HA THR 44 HA THR 44 9.551 0.866 1.185
334 HB THR 44 HB THR 44 9.667 -0.140 3.544
335 HG1 THR 44 HG1 THR 44 7.536 1.699 3.896
336 HG21 THR 44 HG21 THR 44 10.943 1.891 2.838
337 HG22 THR 44 HG22 THR 44 10.577 1.795 4.561
338 HG23 THR 44 HG23 THR 44 9.642 2.869 3.520
339 H TYR 45 H TYR 45 9.764 -1.455 1.257
340 HA TYR 45 HA TYR 45 7.308 -2.987 1.392
341 HB2 TYR 45 HB2 TYR 45 7.673 -2.549 -0.962
342 HB3 TYR 45 HB3 TYR 45 9.346 -3.129 -0.815
343 HD1 TYR 45 HD1 TYR 45 6.137 -4.590 0.443
344 HD2 TYR 45 HD2 TYR 45 9.499 -5.034 -2.126
345 HE1 TYR 45 HE1 TYR 45 5.394 -6.863 -0.129
346 HE2 TYR 45 HE2 TYR 45 8.766 -7.309 -2.705
347 HH TYR 45 HH TYR 45 7.347 -9.111 -1.639
348 H ASP 46 H ASP 46 7.375 -4.866 2.454
349 HA ASP 46 HA ASP 46 10.059 -5.946 3.064
350 HB2 ASP 46 HB2 ASP 46 8.864 -5.219 5.111
351 HB3 ASP 46 HB3 ASP 46 7.471 -6.222 4.651
352 H ASP 47 H ASP 47 10.445 -7.548 1.671
353 HA ASP 47 HA ASP 47 8.335 -8.921 0.258
354 HB2 ASP 47 HB2 ASP 47 10.702 -8.633 -0.547
355 HB3 ASP 47 HB3 ASP 47 11.207 -9.846 0.650
356 H ALA 48 H ALA 48 9.933 -9.702 3.381
357 HA ALA 48 HA ALA 48 9.159 -12.540 3.273
358 HB1 ALA 48 HB1 ALA 48 9.708 -10.638 5.607
359 HB2 ALA 48 HB2 ALA 48 10.874 -11.704 4.822
360 HB3 ALA 48 HB3 ALA 48 9.545 -12.386 5.760
361 H THR 49 H THR 49 7.451 -9.629 4.375
362 HA THR 49 HA THR 49 5.113 -11.461 5.157
363 HB THR 49 HB THR 49 4.168 -9.513 6.394
364 HG1 THR 49 HG1 THR 49 6.498 -8.118 5.544
365 HG21 THR 49 HG21 THR 49 5.377 -9.972 8.185
366 HG22 THR 49 HG22 THR 49 6.771 -9.117 7.526
367 HG23 THR 49 HG23 THR 49 6.527 -10.823 7.152
368 H LYS 50 H LYS 50 6.116 -9.766 2.475
369 HA LYS 50 HA LYS 50 5.010 -8.784 0.675
370 HB2 LYS 50 HB2 LYS 50 2.678 -10.525 1.637
371 HB3 LYS 50 HB3 LYS 50 2.795 -9.749 0.045
372 HG2 LYS 50 HG2 LYS 50 4.884 -11.693 1.019
373 HG3 LYS 50 HG3 LYS 50 3.390 -12.235 0.216
374 HD2 LYS 50 HD2 LYS 50 4.000 -10.612 -1.661
375 HD3 LYS 50 HD3 LYS 50 5.603 -10.495 -0.893
376 HE2 LYS 50 HE2 LYS 50 6.188 -12.624 -1.474
377 HE3 LYS 50 HE3 LYS 50 4.516 -13.228 -1.384
378 HZ1 LYS 50 HZ1 LYS 50 4.054 -12.216 -3.481
379 HZ2 LYS 50 HZ2 LYS 50 5.424 -13.135 -3.657
380 HZ3 LYS 50 HZ3 LYS 50 5.544 -11.485 -3.545
381 H THR 51 H THR 51 5.050 -7.196 2.884
382 HA THR 51 HA THR 51 2.480 -5.805 2.746
383 HB THR 51 HB THR 51 4.489 -5.928 4.985
384 HG1 THR 51 HG1 THR 51 1.825 -6.888 4.749
385 HG21 THR 51 HG21 THR 51 3.346 -3.704 4.780
386 HG22 THR 51 HG22 THR 51 3.059 -4.563 6.293
387 HG23 THR 51 HG23 THR 51 1.816 -4.542 5.041
388 H PHE 52 H PHE 52 2.328 -3.797 2.095
389 HA PHE 52 HA PHE 52 4.995 -2.288 1.539
390 HB2 PHE 52 HB2 PHE 52 2.107 -2.043 0.448
391 HB3 PHE 52 HB3 PHE 52 3.372 -0.821 0.192
392 HD1 PHE 52 HD2 PHE 52 5.332 -1.344 -1.183
393 HD2 PHE 52 HD1 PHE 52 2.125 -4.110 -0.745
394 HE1 PHE 52 HE2 PHE 52 6.143 -2.590 -3.145
395 HE2 PHE 52 HE1 PHE 52 2.930 -5.360 -2.706
396 HZ PHE 52 HZ PHE 52 4.942 -4.599 -3.909
397 H THR 53 H THR 53 5.108 -0.339 2.795
398 HA THR 53 HA THR 53 2.824 0.447 4.505
399 HB THR 53 HB THR 53 5.782 0.606 5.228
400 HG1 THR 53 HG1 THR 53 5.333 -1.374 5.811
401 HG21 THR 53 HG21 THR 53 5.305 1.874 7.000
402 HG22 THR 53 HG22 THR 53 3.795 1.023 7.332
403 HG23 THR 53 HG23 THR 53 3.839 2.300 6.116
404 H VAL 54 H VAL 54 2.306 2.600 4.429
405 HA VAL 54 HA VAL 54 4.333 4.345 2.938
406 HB VAL 54 HB VAL 54 2.367 4.028 1.471
407 HG11 VAL 54 HG11 VAL 54 0.142 4.605 2.080
408 HG12 VAL 54 HG12 VAL 54 0.662 5.272 3.628
409 HG13 VAL 54 HG13 VAL 54 0.753 3.535 3.342
410 HG21 VAL 54 HG21 VAL 54 1.639 6.490 1.408
411 HG22 VAL 54 HG22 VAL 54 3.358 6.137 1.232
412 HG23 VAL 54 HG23 VAL 54 2.729 6.716 2.775
413 H THR 55 H THR 55 5.065 5.834 4.333
414 HA THR 55 HA THR 55 3.455 6.495 6.770
415 HB THR 55 HB THR 55 6.468 6.488 6.408
416 HG1 THR 55 HG1 THR 55 4.823 4.763 7.957
417 HG21 THR 55 HG21 THR 55 4.968 6.785 8.990
418 HG22 THR 55 HG22 THR 55 5.623 8.147 8.079
419 HG23 THR 55 HG23 THR 55 6.704 6.905 8.709
420 H GLU 56 H GLU 56 2.802 8.546 6.891
421 HA GLU 56 HA GLU 56 3.886 10.613 4.982
422 HB2 GLU 56 HB2 GLU 56 1.454 10.416 6.791
423 HB3 GLU 56 HB3 GLU 56 1.928 11.916 5.971
424 HG2 GLU 56 HG2 GLU 56 1.889 10.465 3.822
425 HG3 GLU 56 HG3 GLU 56 0.923 9.342 4.807
Start of MODEL 2
1 H1 MET 1 H1 MET 1 -1.060 -13.068 -5.568
2 H2 MET 1 H2 MET 1 -2.124 -14.314 -5.180
3 H3 MET 1 H3 MET 1 -0.502 -14.654 -5.475
4 HA MET 1 HA MET 1 -1.181 -14.666 -3.114
5 HB2 MET 1 HB2 MET 1 0.946 -12.670 -3.956
6 HB3 MET 1 HB3 MET 1 0.868 -13.557 -2.422
7 HG2 MET 1 HG2 MET 1 0.886 -15.654 -4.039
8 HG3 MET 1 HG3 MET 1 1.659 -14.494 -5.144
9 HE1 MET 1 HE1 MET 1 3.247 -16.827 -1.767
10 HE2 MET 1 HE2 MET 1 1.558 -16.455 -2.112
11 HE3 MET 1 HE3 MET 1 2.472 -15.447 -0.991
12 H GLN 2 H GLN 2 -1.591 -13.411 -1.235
13 HA GLN 2 HA GLN 2 -3.069 -10.911 -1.810
14 HB2 GLN 2 HB2 GLN 2 -2.952 -12.923 0.405
15 HB3 GLN 2 HB3 GLN 2 -3.272 -11.243 0.878
16 HG2 GLN 2 HG2 GLN 2 -5.290 -11.168 -0.268
17 HG3 GLN 2 HG3 GLN 2 -4.864 -12.542 -1.315
18 HE21 GLN 2 HE21 GLN 2 -7.292 -12.261 0.100
19 HE22 GLN 2 HE22 GLN 2 -7.363 -13.584 1.316
20 H TYR 3 H TYR 3 -2.359 -8.945 -1.287
21 HA TYR 3 HA TYR 3 0.143 -8.588 0.255
22 HB2 TYR 3 HB2 TYR 3 -0.824 -6.906 -2.053
23 HB3 TYR 3 HB3 TYR 3 0.577 -6.526 -1.025
24 HD1 TYR 3 HD1 TYR 3 -0.766 -9.205 -3.265
25 HD2 TYR 3 HD2 TYR 3 2.681 -7.324 -1.621
26 HE1 TYR 3 HE1 TYR 3 0.670 -10.562 -4.728
27 HE2 TYR 3 HE2 TYR 3 4.123 -8.677 -3.083
28 HH TYR 3 HH TYR 3 3.966 -9.910 -5.200
29 H LYS 4 H LYS 4 0.202 -6.809 1.731
30 HA LYS 4 HA LYS 4 -2.416 -5.612 2.301
31 HB2 LYS 4 HB2 LYS 4 -0.165 -6.405 4.155
32 HB3 LYS 4 HB3 LYS 4 -1.565 -5.436 4.661
33 HG2 LYS 4 HG2 LYS 4 -3.042 -7.320 3.933
34 HG3 LYS 4 HG3 LYS 4 -1.575 -8.288 3.643
35 HD2 LYS 4 HD2 LYS 4 -2.254 -6.993 6.299
36 HD3 LYS 4 HD3 LYS 4 -2.672 -8.672 5.875
37 HE2 LYS 4 HE2 LYS 4 -0.361 -9.264 5.646
38 HE3 LYS 4 HE3 LYS 4 0.147 -7.565 5.793
39 HZ1 LYS 4 HZ1 LYS 4 -0.183 -7.590 8.030
40 HZ2 LYS 4 HZ2 LYS 4 0.217 -9.186 7.826
41 HZ3 LYS 4 HZ3 LYS 4 -1.373 -8.747 7.989
42 H LEU 5 H LEU 5 -2.561 -3.456 2.830
43 HA LEU 5 HA LEU 5 0.035 -1.872 2.532
44 HB2 LEU 5 HB2 LEU 5 -1.418 -1.403 0.634
45 HB3 LEU 5 HB3 LEU 5 -2.816 -1.152 1.689
46 HG LEU 5 HG LEU 5 -1.556 0.813 2.703
47 HD11 LEU 5 HD11 LEU 5 0.685 0.319 2.050
48 HD12 LEU 5 HD12 LEU 5 0.197 1.784 1.199
49 HD13 LEU 5 HD13 LEU 5 0.240 0.241 0.345
50 HD21 LEU 5 HD21 LEU 5 -2.262 2.307 0.994
51 HD22 LEU 5 HD22 LEU 5 -3.376 0.940 0.966
52 HD23 LEU 5 HD23 LEU 5 -2.109 1.069 -0.253
53 H VAL 6 H VAL 6 0.425 -0.833 4.424
54 HA VAL 6 HA VAL 6 -1.689 -0.321 6.374
55 HB VAL 6 HB VAL 6 1.310 -0.393 6.829
56 HG11 VAL 6 HG11 VAL 6 0.915 0.133 9.080
57 HG12 VAL 6 HG12 VAL 6 -0.815 -0.180 8.951
58 HG13 VAL 6 HG13 VAL 6 -0.118 1.249 8.187
59 HG21 VAL 6 HG21 VAL 6 -0.884 -2.363 7.369
60 HG22 VAL 6 HG22 VAL 6 0.536 -2.305 8.415
61 HG23 VAL 6 HG23 VAL 6 0.723 -2.626 6.690
62 H ILE 7 H ILE 7 -2.336 1.728 6.609
63 HA ILE 7 HA ILE 7 -0.551 3.864 5.261
64 HB ILE 7 HB ILE 7 -3.537 3.984 5.931
65 HG12 ILE 7 HG12 ILE 7 -2.133 3.926 3.232
66 HG13 ILE 7 HG13 ILE 7 -2.915 2.519 3.984
67 HG21 ILE 7 HG21 ILE 7 -3.200 6.095 4.422
68 HG22 ILE 7 HG22 ILE 7 -1.528 5.984 4.972
69 HG23 ILE 7 HG23 ILE 7 -2.832 6.167 6.144
70 HD11 ILE 7 HD11 ILE 7 -4.344 3.565 2.312
71 HD12 ILE 7 HD12 ILE 7 -4.284 5.091 3.197
72 HD13 ILE 7 HD13 ILE 7 -5.058 3.681 3.921
73 H ASN 8 H ASN 8 0.635 4.871 6.749
74 HA ASN 8 HA ASN 8 -0.544 5.355 9.493
75 HB2 ASN 8 HB2 ASN 8 2.359 5.135 8.551
76 HB3 ASN 8 HB3 ASN 8 1.861 5.610 10.190
77 HD21 ASN 8 HD21 ASN 8 2.497 3.968 11.417
78 HD22 ASN 8 HD22 ASN 8 2.010 2.257 11.155
79 H GLY 9 H GLY 9 -1.756 7.135 8.423
80 HA2 GLY 9 HA2 GLY 9 -0.280 9.409 7.274
81 HA3 GLY 9 HA3 GLY 9 -1.974 9.129 7.249
82 H LYS 10 H LYS 10 -1.157 11.638 7.920
83 HA LYS 10 HA LYS 10 -0.897 12.035 10.799
84 HB2 LYS 10 HB2 LYS 10 -0.155 13.601 8.999
85 HB3 LYS 10 HB3 LYS 10 -1.863 13.925 8.638
86 HG2 LYS 10 HG2 LYS 10 -2.183 15.151 10.540
87 HG3 LYS 10 HG3 LYS 10 -0.946 14.258 11.457
88 HD2 LYS 10 HD2 LYS 10 -0.027 16.404 11.120
89 HD3 LYS 10 HD3 LYS 10 0.764 15.365 9.908
90 HE2 LYS 10 HE2 LYS 10 -0.621 16.208 8.159
91 HE3 LYS 10 HE3 LYS 10 -1.695 17.029 9.316
92 HZ1 LYS 10 HZ1 LYS 10 1.058 17.758 8.552
93 HZ2 LYS 10 HZ2 LYS 10 0.357 18.346 9.936
94 HZ3 LYS 10 HZ3 LYS 10 -0.319 18.682 8.459
95 H THR 11 H THR 11 -3.445 12.020 8.538
96 HA THR 11 HA THR 11 -5.551 12.266 10.621
97 HB THR 11 HB THR 11 -5.826 14.217 9.493
98 HG1 THR 11 HG1 THR 11 -7.827 13.868 8.981
99 HG21 THR 11 HG21 THR 11 -5.270 12.683 6.964
100 HG22 THR 11 HG22 THR 11 -4.387 14.057 7.632
101 HG23 THR 11 HG23 THR 11 -6.010 14.283 6.982
102 H LEU 12 H LEU 12 -4.514 10.208 8.010
103 HA LEU 12 HA LEU 12 -6.880 8.555 8.637
104 HB2 LEU 12 HB2 LEU 12 -6.906 9.383 6.326
105 HB3 LEU 12 HB3 LEU 12 -5.285 8.720 6.071
106 HG LEU 12 HG LEU 12 -6.173 6.436 6.415
107 HD11 LEU 12 HD11 LEU 12 -8.045 7.037 7.894
108 HD12 LEU 12 HD12 LEU 12 -8.564 6.052 6.526
109 HD13 LEU 12 HD13 LEU 12 -8.874 7.788 6.530
110 HD21 LEU 12 HD21 LEU 12 -7.709 8.003 4.335
111 HD22 LEU 12 HD22 LEU 12 -7.357 6.275 4.309
112 HD23 LEU 12 HD23 LEU 12 -6.045 7.445 4.163
113 H LYS 13 H LYS 13 -6.505 6.674 9.641
114 HA LYS 13 HA LYS 13 -3.873 5.402 9.184
115 HB2 LYS 13 HB2 LYS 13 -5.415 5.481 11.772
116 HB3 LYS 13 HB3 LYS 13 -3.900 4.600 11.500
117 HG2 LYS 13 HG2 LYS 13 -2.958 6.934 10.834
118 HG3 LYS 13 HG3 LYS 13 -4.375 7.557 11.714
119 HD2 LYS 13 HD2 LYS 13 -3.692 6.434 13.733
120 HD3 LYS 13 HD3 LYS 13 -2.379 5.590 12.875
121 HE2 LYS 13 HE2 LYS 13 -2.553 8.606 13.064
122 HE3 LYS 13 HE3 LYS 13 -1.714 7.610 14.276
123 HZ1 LYS 13 HZ1 LYS 13 -0.247 6.817 12.581
124 HZ2 LYS 13 HZ2 LYS 13 -0.242 8.474 12.533
125 HZ3 LYS 13 HZ3 LYS 13 -1.077 7.617 11.386
126 H GLY 14 H GLY 14 -4.019 3.134 8.536
127 HA2 GLY 14 HA2 GLY 14 -5.861 1.373 9.547
128 HA3 GLY 14 HA3 GLY 14 -6.718 1.951 8.139
129 H GLU 15 H GLU 15 -6.667 -0.183 7.502
130 HA GLU 15 HA GLU 15 -4.187 -0.875 6.044
131 HB2 GLU 15 HB2 GLU 15 -5.705 -2.556 8.025
132 HB3 GLU 15 HB3 GLU 15 -4.674 -3.292 6.781
133 HG2 GLU 15 HG2 GLU 15 -2.863 -1.651 7.726
134 HG3 GLU 15 HG3 GLU 15 -3.919 -1.633 9.158
135 H THR 16 H THR 16 -4.486 -2.154 4.107
136 HA THR 16 HA THR 16 -7.202 -3.121 3.619
137 HB THR 16 HB THR 16 -7.277 -0.835 2.610
138 HG1 THR 16 HG1 THR 16 -8.573 -2.130 1.503
139 HG21 THR 16 HG21 THR 16 -4.801 -0.846 1.981
140 HG22 THR 16 HG22 THR 16 -5.943 -0.174 0.818
141 HG23 THR 16 HG23 THR 16 -5.290 -1.794 0.577
142 H THR 17 H THR 17 -7.150 -4.376 1.434
143 HA THR 17 HA THR 17 -4.519 -5.628 1.113
144 HB THR 17 HB THR 17 -5.465 -7.856 1.231
145 HG1 THR 17 HG1 THR 17 -7.878 -6.502 1.893
146 HG21 THR 17 HG21 THR 17 -5.539 -8.086 3.492
147 HG22 THR 17 HG22 THR 17 -6.542 -6.654 3.725
148 HG23 THR 17 HG23 THR 17 -4.821 -6.479 3.387
149 H THR 18 H THR 18 -4.323 -6.844 -0.842
150 HA THR 18 HA THR 18 -6.553 -6.629 -2.738
151 HB THR 18 HB THR 18 -5.096 -4.535 -3.125
152 HG1 THR 18 HG1 THR 18 -6.409 -5.122 -4.776
153 HG21 THR 18 HG21 THR 18 -3.245 -6.148 -4.750
154 HG22 THR 18 HG22 THR 18 -2.961 -6.177 -3.009
155 HG23 THR 18 HG23 THR 18 -2.983 -4.640 -3.874
156 H LYS 19 H LYS 19 -6.177 -8.032 -4.633
157 HA LYS 19 HA LYS 19 -4.243 -10.199 -3.998
158 HB2 LYS 19 HB2 LYS 19 -6.725 -10.223 -5.753
159 HB3 LYS 19 HB3 LYS 19 -5.651 -11.603 -5.462
160 HG2 LYS 19 HG2 LYS 19 -6.682 -10.381 -3.001
161 HG3 LYS 19 HG3 LYS 19 -7.954 -11.017 -4.072
162 HD2 LYS 19 HD2 LYS 19 -5.511 -12.598 -3.221
163 HD3 LYS 19 HD3 LYS 19 -7.075 -12.650 -2.369
164 HE2 LYS 19 HE2 LYS 19 -6.979 -13.146 -5.329
165 HE3 LYS 19 HE3 LYS 19 -6.487 -14.437 -4.208
166 HZ1 LYS 19 HZ1 LYS 19 -8.737 -13.814 -3.089
167 HZ2 LYS 19 HZ2 LYS 19 -8.709 -14.829 -4.402
168 HZ3 LYS 19 HZ3 LYS 19 -9.122 -13.234 -4.597
169 H ALA 20 H ALA 20 -2.533 -10.480 -5.444
170 HA ALA 20 HA ALA 20 -2.805 -9.487 -8.110
171 HB1 ALA 20 HB1 ALA 20 -0.589 -8.213 -7.925
172 HB2 ALA 20 HB2 ALA 20 -0.820 -8.285 -6.178
173 HB3 ALA 20 HB3 ALA 20 -1.993 -7.440 -7.190
174 H VAL 21 H VAL 21 -1.191 -10.238 -9.607
175 HA VAL 21 HA VAL 21 -0.023 -12.646 -8.835
176 HB VAL 21 HB VAL 21 0.972 -12.791 -11.040
177 HG11 VAL 21 HG11 VAL 21 -1.467 -13.267 -10.588
178 HG12 VAL 21 HG12 VAL 21 -1.064 -12.869 -12.259
179 HG13 VAL 21 HG13 VAL 21 -1.818 -11.659 -11.222
180 HG21 VAL 21 HG21 VAL 21 -0.158 -10.034 -11.528
181 HG22 VAL 21 HG22 VAL 21 0.867 -10.996 -12.593
182 HG23 VAL 21 HG23 VAL 21 1.530 -10.320 -11.104
183 H ASP 22 H ASP 22 1.399 -9.438 -8.755
184 HA ASP 22 HA ASP 22 3.754 -10.623 -7.563
185 HB2 ASP 22 HB2 ASP 22 5.357 -9.608 -9.158
186 HB3 ASP 22 HB3 ASP 22 4.322 -10.820 -9.946
187 H ALA 23 H ALA 23 5.351 -8.898 -6.822
188 HA ALA 23 HA ALA 23 3.801 -7.127 -5.231
189 HB1 ALA 23 HB1 ALA 23 5.810 -7.839 -4.286
190 HB2 ALA 23 HB2 ALA 23 6.085 -6.139 -4.666
191 HB3 ALA 23 HB3 ALA 23 6.746 -7.393 -5.714
192 H GLU 24 H GLU 24 5.646 -6.594 -8.252
193 HA GLU 24 HA GLU 24 5.528 -3.685 -8.041
194 HB2 GLU 24 HB2 GLU 24 5.725 -5.695 -10.347
195 HB3 GLU 24 HB3 GLU 24 5.696 -3.947 -10.650
196 HG2 GLU 24 HG2 GLU 24 7.650 -3.789 -9.016
197 HG3 GLU 24 HG3 GLU 24 7.755 -5.561 -9.150
198 H THR 25 H THR 25 3.214 -6.011 -9.536
199 HA THR 25 HA THR 25 1.529 -3.848 -10.628
200 HB THR 25 HB THR 25 0.800 -6.738 -9.910
201 HG1 THR 25 HG1 THR 25 1.901 -7.104 -11.651
202 HG21 THR 25 HG21 THR 25 -0.735 -4.608 -11.360
203 HG22 THR 25 HG22 THR 25 -1.272 -5.687 -10.073
204 HG23 THR 25 HG23 THR 25 -0.986 -6.321 -11.694
205 H ALA 26 H ALA 26 1.606 -5.640 -7.447
206 HA ALA 26 HA ALA 26 -0.792 -4.366 -6.369
207 HB1 ALA 26 HB1 ALA 26 0.505 -6.298 -5.330
208 HB2 ALA 26 HB2 ALA 26 -0.020 -5.037 -4.216
209 HB3 ALA 26 HB3 ALA 26 1.659 -5.095 -4.753
210 H GLU 27 H GLU 27 2.605 -3.229 -6.776
211 HA GLU 27 HA GLU 27 2.253 -0.945 -5.203
212 HB2 GLU 27 HB2 GLU 27 4.444 -1.776 -5.974
213 HB3 GLU 27 HB3 GLU 27 4.065 -1.203 -7.610
214 HG2 GLU 27 HG2 GLU 27 3.763 1.104 -6.564
215 HG3 GLU 27 HG3 GLU 27 4.529 0.422 -5.111
216 H LYS 28 H LYS 28 1.728 -1.284 -8.715
217 HA LYS 28 HA LYS 28 1.012 1.475 -9.141
218 HB2 LYS 28 HB2 LYS 28 -0.042 -0.940 -10.628
219 HB3 LYS 28 HB3 LYS 28 -0.026 0.742 -11.195
220 HG2 LYS 28 HG2 LYS 28 2.387 0.742 -11.284
221 HG3 LYS 28 HG3 LYS 28 2.448 -0.889 -10.569
222 HD2 LYS 28 HD2 LYS 28 1.656 -1.906 -12.502
223 HD3 LYS 28 HD3 LYS 28 0.899 -0.410 -13.102
224 HE2 LYS 28 HE2 LYS 28 3.010 0.520 -13.702
225 HE3 LYS 28 HE3 LYS 28 3.893 -0.751 -12.825
226 HZ1 LYS 28 HZ1 LYS 28 3.024 -2.350 -14.430
227 HZ2 LYS 28 HZ2 LYS 28 3.916 -1.170 -15.181
228 HZ3 LYS 28 HZ3 LYS 28 2.260 -1.134 -15.264
229 H ALA 29 H ALA 29 -1.021 -1.354 -8.136
230 HA ALA 29 HA ALA 29 -3.498 0.222 -8.307
231 HB1 ALA 29 HB1 ALA 29 -4.516 -1.588 -7.054
232 HB2 ALA 29 HB2 ALA 29 -2.944 -2.197 -6.536
233 HB3 ALA 29 HB3 ALA 29 -3.412 -2.297 -8.234
234 H PHE 30 H PHE 30 -1.237 -0.556 -5.532
235 HA PHE 30 HA PHE 30 -2.862 0.855 -3.615
236 HB2 PHE 30 HB2 PHE 30 0.061 0.018 -3.682
237 HB3 PHE 30 HB3 PHE 30 -0.683 0.818 -2.281
238 HD1 PHE 30 HD1 PHE 30 -3.263 -0.438 -2.033
239 HD2 PHE 30 HD2 PHE 30 0.466 -2.173 -3.128
240 HE1 PHE 30 HE1 PHE 30 -4.038 -2.620 -1.199
241 HE2 PHE 30 HE2 PHE 30 -0.302 -4.356 -2.299
242 HZ PHE 30 HZ PHE 30 -2.557 -4.582 -1.330
243 H LYS 31 H LYS 31 -0.189 1.987 -5.774
244 HA LYS 31 HA LYS 31 -0.121 4.615 -4.462
245 HB2 LYS 31 HB2 LYS 31 1.640 3.853 -6.033
246 HB3 LYS 31 HB3 LYS 31 0.471 3.922 -7.366
247 HG2 LYS 31 HG2 LYS 31 0.186 6.421 -6.495
248 HG3 LYS 31 HG3 LYS 31 1.838 6.129 -5.898
249 HD2 LYS 31 HD2 LYS 31 2.447 5.365 -8.214
250 HD3 LYS 31 HD3 LYS 31 0.835 5.901 -8.750
251 HE2 LYS 31 HE2 LYS 31 1.337 8.131 -8.482
252 HE3 LYS 31 HE3 LYS 31 2.553 7.817 -7.221
253 HZ1 LYS 31 HZ1 LYS 31 2.927 7.146 -10.078
254 HZ2 LYS 31 HZ2 LYS 31 4.069 7.073 -8.878
255 HZ3 LYS 31 HZ3 LYS 31 3.483 8.543 -9.374
256 H GLN 32 H GLN 32 -2.270 3.259 -6.939
257 HA GLN 32 HA GLN 32 -3.568 5.802 -7.441
258 HB2 GLN 32 HB2 GLN 32 -3.786 4.001 -9.057
259 HB3 GLN 32 HB3 GLN 32 -4.504 2.933 -7.836
260 HG2 GLN 32 HG2 GLN 32 -6.425 4.517 -7.672
261 HG3 GLN 32 HG3 GLN 32 -5.720 5.436 -9.022
262 HE21 GLN 32 HE21 GLN 32 -8.276 3.903 -8.689
263 HE22 GLN 32 HE22 GLN 32 -8.290 2.766 -10.083
264 H TYR 33 H TYR 33 -4.356 3.117 -5.231
265 HA TYR 33 HA TYR 33 -6.773 4.279 -4.187
266 HB2 TYR 33 HB2 TYR 33 -6.029 1.920 -3.772
267 HB3 TYR 33 HB3 TYR 33 -4.652 2.534 -2.833
268 HD1 TYR 33 HD2 TYR 33 -5.147 3.825 -0.697
269 HD2 TYR 33 HD1 TYR 33 -8.108 1.561 -2.749
270 HE1 TYR 33 HE2 TYR 33 -6.521 3.782 1.344
271 HE2 TYR 33 HE1 TYR 33 -9.489 1.512 -0.715
272 HH TYR 33 HH TYR 33 -8.636 1.847 2.100
273 H ALA 34 H ALA 34 -3.406 4.637 -3.017
274 HA ALA 34 HA ALA 34 -3.970 6.403 -0.879
275 HB1 ALA 34 HB1 ALA 34 -1.740 5.236 -1.562
276 HB2 ALA 34 HB2 ALA 34 -1.695 6.806 -0.760
277 HB3 ALA 34 HB3 ALA 34 -1.485 6.702 -2.508
278 H ASN 35 H ASN 35 -3.265 7.144 -4.297
279 HA ASN 35 HA ASN 35 -3.401 10.030 -3.844
280 HB2 ASN 35 HB2 ASN 35 -3.858 8.281 -6.318
281 HB3 ASN 35 HB3 ASN 35 -3.905 10.056 -6.373
282 HD21 ASN 35 HD21 ASN 35 -2.161 8.872 -7.978
283 HD22 ASN 35 HD22 ASN 35 -0.486 9.048 -7.349
284 H ASP 36 H ASP 36 -6.000 7.657 -4.776
285 HA ASP 36 HA ASP 36 -8.005 9.696 -5.125
286 HB2 ASP 36 HB2 ASP 36 -8.266 6.765 -4.432
287 HB3 ASP 36 HB3 ASP 36 -9.660 7.835 -4.700
288 H ASN 37 H ASN 37 -6.635 8.362 -2.204
289 HA ASN 37 HA ASN 37 -8.823 9.711 -0.652
290 HB2 ASN 37 HB2 ASN 37 -6.852 7.529 0.043
291 HB3 ASN 37 HB3 ASN 37 -7.759 8.411 1.290
292 HD21 ASN 37 HD21 ASN 37 -7.927 6.183 -1.401
293 HD22 ASN 37 HD22 ASN 37 -9.596 5.606 -1.065
294 H GLY 38 H GLY 38 -5.943 10.734 -1.796
295 HA2 GLY 38 HA2 GLY 38 -4.949 12.745 -1.207
296 HA3 GLY 38 HA3 GLY 38 -5.929 12.807 0.242
297 H VAL 39 H VAL 39 -3.843 10.067 -0.241
298 HA VAL 39 HA VAL 39 -2.151 11.057 2.045
299 HB VAL 39 HB VAL 39 -2.629 8.236 1.096
300 HG11 VAL 39 HG11 VAL 39 -1.345 8.889 3.696
301 HG12 VAL 39 HG12 VAL 39 -0.369 9.082 2.241
302 HG13 VAL 39 HG13 VAL 39 -1.091 7.517 2.617
303 HG21 VAL 39 HG21 VAL 39 -3.983 7.943 3.008
304 HG22 VAL 39 HG22 VAL 39 -4.524 9.461 2.291
305 HG23 VAL 39 HG23 VAL 39 -3.476 9.480 3.707
306 H ASP 40 H ASP 40 -0.164 11.454 1.839
307 HA ASP 40 HA ASP 40 1.275 10.370 -0.526
308 HB2 ASP 40 HB2 ASP 40 0.399 12.551 -1.144
309 HB3 ASP 40 HB3 ASP 40 1.086 13.278 0.324
310 H GLY 41 H GLY 41 3.057 9.723 -0.289
311 HA2 GLY 41 HA2 GLY 41 4.987 10.772 1.716
312 HA3 GLY 41 HA3 GLY 41 4.131 9.336 2.225
313 H VAL 42 H VAL 42 6.056 8.530 2.724
314 HA VAL 42 HA VAL 42 7.766 7.796 0.462
315 HB VAL 42 HB VAL 42 8.224 7.701 3.441
316 HG11 VAL 42 HG11 VAL 42 9.234 5.747 2.248
317 HG12 VAL 42 HG12 VAL 42 10.397 6.799 3.056
318 HG13 VAL 42 HG13 VAL 42 10.195 6.888 1.307
319 HG21 VAL 42 HG21 VAL 42 10.228 9.172 2.565
320 HG22 VAL 42 HG22 VAL 42 8.639 9.874 2.866
321 HG23 VAL 42 HG23 VAL 42 9.128 9.472 1.222
322 H TRP 43 H TRP 43 8.042 5.696 -0.237
323 HA TRP 43 HA TRP 43 6.150 3.655 1.044
324 HB2 TRP 43 HB2 TRP 43 7.437 3.980 -1.703
325 HB3 TRP 43 HB3 TRP 43 6.573 2.507 -1.207
326 HD1 TRP 43 HD1 TRP 43 5.944 6.245 -1.919
327 HE1 TRP 43 HE1 TRP 43 3.428 6.596 -2.452
328 HE3 TRP 43 HE3 TRP 43 4.300 1.517 -0.886
329 HZ2 TRP 43 HZ2 TRP 43 1.084 5.010 -2.413
330 HZ3 TRP 43 HZ3 TRP 43 1.909 1.013 -1.159
331 HH2 TRP 43 HH2 TRP 43 0.334 2.724 -1.905
332 H THR 44 H THR 44 6.801 1.769 1.857
333 HA THR 44 HA THR 44 9.551 0.866 1.185
334 HB THR 44 HB THR 44 9.668 -0.140 3.543
335 HG1 THR 44 HG1 THR 44 7.536 1.699 3.896
336 HG21 THR 44 HG21 THR 44 10.943 1.891 2.838
337 HG22 THR 44 HG22 THR 44 10.577 1.795 4.561
338 HG23 THR 44 HG23 THR 44 9.641 2.869 3.520
339 H TYR 45 H TYR 45 9.764 -1.455 1.257
340 HA TYR 45 HA TYR 45 7.308 -2.987 1.392
341 HB2 TYR 45 HB2 TYR 45 7.675 -2.547 -0.962
342 HB3 TYR 45 HB3 TYR 45 9.347 -3.131 -0.814
343 HD1 TYR 45 HD1 TYR 45 6.133 -4.584 0.442
344 HD2 TYR 45 HD2 TYR 45 9.495 -5.037 -2.125
345 HE1 TYR 45 HE1 TYR 45 5.384 -6.855 -0.131
346 HE2 TYR 45 HE2 TYR 45 8.757 -7.310 -2.705
347 HH TYR 45 HH TYR 45 7.332 -9.108 -1.640
348 H ASP 46 H ASP 46 7.375 -4.866 2.454
349 HA ASP 46 HA ASP 46 10.059 -5.946 3.064
350 HB2 ASP 46 HB2 ASP 46 8.865 -5.219 5.112
351 HB3 ASP 46 HB3 ASP 46 7.471 -6.220 4.651
352 H ASP 47 H ASP 47 10.445 -7.548 1.671
353 HA ASP 47 HA ASP 47 8.335 -8.921 0.258
354 HB2 ASP 47 HB2 ASP 47 10.702 -8.633 -0.547
355 HB3 ASP 47 HB3 ASP 47 11.206 -9.847 0.650
356 H ALA 48 H ALA 48 9.933 -9.702 3.381
357 HA ALA 48 HA ALA 48 9.159 -12.540 3.273
358 HB1 ALA 48 HB1 ALA 48 9.708 -10.638 5.607
359 HB2 ALA 48 HB2 ALA 48 10.874 -11.704 4.822
360 HB3 ALA 48 HB3 ALA 48 9.545 -12.386 5.760
361 H THR 49 H THR 49 7.451 -9.629 4.375
362 HA THR 49 HA THR 49 5.113 -11.461 5.157
363 HB THR 49 HB THR 49 4.167 -9.511 6.393
364 HG1 THR 49 HG1 THR 49 6.502 -8.120 5.546
365 HG21 THR 49 HG21 THR 49 5.373 -9.973 8.185
366 HG22 THR 49 HG22 THR 49 6.770 -9.121 7.529
367 HG23 THR 49 HG23 THR 49 6.523 -10.826 7.154
368 H LYS 50 H LYS 50 6.116 -9.766 2.475
369 HA LYS 50 HA LYS 50 5.010 -8.784 0.675
370 HB2 LYS 50 HB2 LYS 50 2.678 -10.525 1.636
371 HB3 LYS 50 HB3 LYS 50 2.795 -9.750 0.045
372 HG2 LYS 50 HG2 LYS 50 4.884 -11.693 1.021
373 HG3 LYS 50 HG3 LYS 50 3.390 -12.235 0.217
374 HD2 LYS 50 HD2 LYS 50 4.001 -10.613 -1.661
375 HD3 LYS 50 HD3 LYS 50 5.603 -10.496 -0.892
376 HE2 LYS 50 HE2 LYS 50 6.188 -12.625 -1.472
377 HE3 LYS 50 HE3 LYS 50 4.517 -13.229 -1.382
378 HZ1 LYS 50 HZ1 LYS 50 4.055 -12.217 -3.480
379 HZ2 LYS 50 HZ2 LYS 50 5.425 -13.137 -3.655
380 HZ3 LYS 50 HZ3 LYS 50 5.545 -11.487 -3.543
381 H THR 51 H THR 51 5.050 -7.196 2.884
382 HA THR 51 HA THR 51 2.480 -5.805 2.746
383 HB THR 51 HB THR 51 4.489 -5.929 4.985
384 HG1 THR 51 HG1 THR 51 1.823 -6.885 4.749
385 HG21 THR 51 HG21 THR 51 3.350 -3.704 4.780
386 HG22 THR 51 HG22 THR 51 3.061 -4.563 6.293
387 HG23 THR 51 HG23 THR 51 1.819 -4.539 5.042
388 H PHE 52 H PHE 52 2.328 -3.797 2.095
389 HA PHE 52 HA PHE 52 4.995 -2.288 1.539
390 HB2 PHE 52 HB2 PHE 52 2.107 -2.043 0.448
391 HB3 PHE 52 HB3 PHE 52 3.372 -0.821 0.192
392 HD1 PHE 52 HD2 PHE 52 5.332 -1.344 -1.183
393 HD2 PHE 52 HD1 PHE 52 2.125 -4.110 -0.745
394 HE1 PHE 52 HE2 PHE 52 6.143 -2.590 -3.145
395 HE2 PHE 52 HE1 PHE 52 2.930 -5.360 -2.706
396 HZ PHE 52 HZ PHE 52 4.942 -4.599 -3.909
397 H THR 53 H THR 53 5.108 -0.339 2.795
398 HA THR 53 HA THR 53 2.824 0.447 4.505
399 HB THR 53 HB THR 53 5.782 0.609 5.228
400 HG1 THR 53 HG1 THR 53 5.337 -1.373 5.809
401 HG21 THR 53 HG21 THR 53 5.301 1.873 7.002
402 HG22 THR 53 HG22 THR 53 3.794 1.019 7.333
403 HG23 THR 53 HG23 THR 53 3.835 2.297 6.119
404 H VAL 54 H VAL 54 2.306 2.600 4.429
405 HA VAL 54 HA VAL 54 4.333 4.345 2.938
406 HB VAL 54 HB VAL 54 2.367 4.027 1.471
407 HG11 VAL 54 HG11 VAL 54 0.142 4.606 2.081
408 HG12 VAL 54 HG12 VAL 54 0.663 5.274 3.628
409 HG13 VAL 54 HG13 VAL 54 0.753 3.536 3.343
410 HG21 VAL 54 HG21 VAL 54 1.640 6.490 1.407
411 HG22 VAL 54 HG22 VAL 54 3.358 6.136 1.231
412 HG23 VAL 54 HG23 VAL 54 2.730 6.716 2.774
413 H THR 55 H THR 55 5.065 5.834 4.333
414 HA THR 55 HA THR 55 3.455 6.495 6.770
415 HB THR 55 HB THR 55 6.468 6.489 6.409
416 HG1 THR 55 HG1 THR 55 4.824 4.762 7.955
417 HG21 THR 55 HG21 THR 55 4.968 6.783 8.990
418 HG22 THR 55 HG22 THR 55 5.622 8.146 8.081
419 HG23 THR 55 HG23 THR 55 6.703 6.905 8.710
420 H GLU 56 H GLU 56 2.802 8.546 6.891
421 HA GLU 56 HA GLU 56 3.886 10.613 4.982
422 HB2 GLU 56 HB2 GLU 56 1.432 10.214 5.203
423 HB3 GLU 56 HB3 GLU 56 1.534 10.677 6.912
424 HG2 GLU 56 HG2 GLU 56 2.636 12.856 5.878
425 HG3 GLU 56 HG3 GLU 56 1.695 12.351 4.455
Start of MODEL 3
1 H1 MET 1 H1 MET 1 -1.060 -13.068 -5.568
2 H2 MET 1 H2 MET 1 -2.124 -14.314 -5.180
3 H3 MET 1 H3 MET 1 -0.502 -14.654 -5.475
4 HA MET 1 HA MET 1 -1.181 -14.666 -3.114
5 HB2 MET 1 HB2 MET 1 0.946 -12.670 -3.956
6 HB3 MET 1 HB3 MET 1 0.868 -13.557 -2.422
7 HG2 MET 1 HG2 MET 1 0.886 -15.654 -4.038
8 HG3 MET 1 HG3 MET 1 1.659 -14.495 -5.144
9 HE1 MET 1 HE1 MET 1 3.247 -16.827 -1.766
10 HE2 MET 1 HE2 MET 1 1.558 -16.455 -2.111
11 HE3 MET 1 HE3 MET 1 2.472 -15.446 -0.990
12 H GLN 2 H GLN 2 -1.591 -13.411 -1.235
13 HA GLN 2 HA GLN 2 -3.069 -10.911 -1.810
14 HB2 GLN 2 HB2 GLN 2 -4.141 -12.579 -0.336
15 HB3 GLN 2 HB3 GLN 2 -2.720 -12.570 0.727
16 HG2 GLN 2 HG2 GLN 2 -3.209 -10.467 1.580
17 HG3 GLN 2 HG3 GLN 2 -4.251 -10.038 0.203
18 HE21 GLN 2 HE21 GLN 2 -4.939 -9.734 2.925
19 HE22 GLN 2 HE22 GLN 2 -6.323 -10.832 3.257
20 H TYR 3 H TYR 3 -2.359 -8.945 -1.287
21 HA TYR 3 HA TYR 3 0.143 -8.588 0.255
22 HB2 TYR 3 HB2 TYR 3 -0.824 -6.903 -2.051
23 HB3 TYR 3 HB3 TYR 3 0.579 -6.528 -1.025
24 HD1 TYR 3 HD1 TYR 3 -0.773 -9.201 -3.266
25 HD2 TYR 3 HD2 TYR 3 2.681 -7.330 -1.625
26 HE1 TYR 3 HE1 TYR 3 0.657 -10.560 -4.733
27 HE2 TYR 3 HE2 TYR 3 4.118 -8.685 -3.091
28 HH TYR 3 HH TYR 3 3.953 -9.914 -5.209
29 H LYS 4 H LYS 4 0.202 -6.809 1.731
30 HA LYS 4 HA LYS 4 -2.416 -5.612 2.301
31 HB2 LYS 4 HB2 LYS 4 -1.652 -7.201 4.021
32 HB3 LYS 4 HB3 LYS 4 -0.157 -6.261 4.206
33 HG2 LYS 4 HG2 LYS 4 -1.556 -4.301 4.885
34 HG3 LYS 4 HG3 LYS 4 -2.976 -5.375 4.865
35 HD2 LYS 4 HD2 LYS 4 -0.485 -5.889 6.515
36 HD3 LYS 4 HD3 LYS 4 -1.929 -5.047 7.131
37 HE2 LYS 4 HE2 LYS 4 -3.291 -6.991 6.798
38 HE3 LYS 4 HE3 LYS 4 -1.984 -7.826 5.925
39 HZ1 LYS 4 HZ1 LYS 4 -0.893 -8.274 7.854
40 HZ2 LYS 4 HZ2 LYS 4 -2.441 -8.276 8.446
41 HZ3 LYS 4 HZ3 LYS 4 -1.475 -6.946 8.663
42 H LEU 5 H LEU 5 -2.561 -3.456 2.830
43 HA LEU 5 HA LEU 5 0.035 -1.872 2.532
44 HB2 LEU 5 HB2 LEU 5 -1.420 -1.404 0.634
45 HB3 LEU 5 HB3 LEU 5 -2.816 -1.150 1.691
46 HG LEU 5 HG LEU 5 -1.551 0.814 2.701
47 HD11 LEU 5 HD11 LEU 5 0.688 0.316 2.045
48 HD12 LEU 5 HD12 LEU 5 0.201 1.780 1.194
49 HD13 LEU 5 HD13 LEU 5 0.241 0.237 0.342
50 HD21 LEU 5 HD21 LEU 5 -2.258 2.307 0.991
51 HD22 LEU 5 HD22 LEU 5 -3.374 0.942 0.966
52 HD23 LEU 5 HD23 LEU 5 -2.108 1.068 -0.254
53 H VAL 6 H VAL 6 0.425 -0.833 4.424
54 HA VAL 6 HA VAL 6 -1.689 -0.321 6.374
55 HB VAL 6 HB VAL 6 1.310 -0.389 6.830
56 HG11 VAL 6 HG11 VAL 6 0.912 0.131 9.082
57 HG12 VAL 6 HG12 VAL 6 -0.818 -0.187 8.950
58 HG13 VAL 6 HG13 VAL 6 -0.124 1.245 8.190
59 HG21 VAL 6 HG21 VAL 6 -0.879 -2.367 7.364
60 HG22 VAL 6 HG22 VAL 6 0.539 -2.307 8.411
61 HG23 VAL 6 HG23 VAL 6 0.729 -2.624 6.686
62 H ILE 7 H ILE 7 -2.336 1.728 6.609
63 HA ILE 7 HA ILE 7 -0.551 3.864 5.261
64 HB ILE 7 HB ILE 7 -3.537 3.982 5.930
65 HG12 ILE 7 HG12 ILE 7 -2.131 3.930 3.232
66 HG13 ILE 7 HG13 ILE 7 -2.913 2.521 3.981
67 HG21 ILE 7 HG21 ILE 7 -3.201 6.096 4.425
68 HG22 ILE 7 HG22 ILE 7 -1.529 5.985 4.975
69 HG23 ILE 7 HG23 ILE 7 -2.834 6.166 6.147
70 HD11 ILE 7 HD11 ILE 7 -4.341 3.569 2.310
71 HD12 ILE 7 HD12 ILE 7 -4.283 5.093 3.197
72 HD13 ILE 7 HD13 ILE 7 -5.057 3.681 3.918
73 H ASN 8 H ASN 8 0.635 4.871 6.749
74 HA ASN 8 HA ASN 8 -0.544 5.355 9.493
75 HB2 ASN 8 HB2 ASN 8 1.547 3.939 9.334
76 HB3 ASN 8 HB3 ASN 8 2.396 5.347 8.657
77 HD21 ASN 8 HD21 ASN 8 1.545 3.675 11.448
78 HD22 ASN 8 HD22 ASN 8 1.976 4.948 12.643
79 H GLY 9 H GLY 9 -1.756 7.135 8.423
80 HA2 GLY 9 HA2 GLY 9 -0.280 9.409 7.274
81 HA3 GLY 9 HA3 GLY 9 -1.974 9.129 7.249
82 H LYS 10 H LYS 10 -1.157 11.638 7.920
83 HA LYS 10 HA LYS 10 -0.897 12.035 10.799
84 HB2 LYS 10 HB2 LYS 10 -0.155 13.602 9.000
85 HB3 LYS 10 HB3 LYS 10 -1.862 13.924 8.637
86 HG2 LYS 10 HG2 LYS 10 -2.184 15.151 10.539
87 HG3 LYS 10 HG3 LYS 10 -0.948 14.259 11.457
88 HD2 LYS 10 HD2 LYS 10 -0.029 16.405 11.120
89 HD3 LYS 10 HD3 LYS 10 0.763 15.366 9.909
90 HE2 LYS 10 HE2 LYS 10 -0.620 16.208 8.159
91 HE3 LYS 10 HE3 LYS 10 -1.696 17.029 9.314
92 HZ1 LYS 10 HZ1 LYS 10 1.057 17.758 8.553
93 HZ2 LYS 10 HZ2 LYS 10 0.355 18.346 9.936
94 HZ3 LYS 10 HZ3 LYS 10 -0.320 18.682 8.459
95 H THR 11 H THR 11 -3.445 12.020 8.538
96 HA THR 11 HA THR 11 -5.551 12.266 10.621
97 HB THR 11 HB THR 11 -5.473 13.461 7.912
98 HG1 THR 11 HG1 THR 11 -5.508 15.223 9.045
99 HG21 THR 11 HG21 THR 11 -7.894 12.763 9.558
100 HG22 THR 11 HG22 THR 11 -7.572 12.389 7.864
101 HG23 THR 11 HG23 THR 11 -7.880 14.054 8.357
102 H LEU 12 H LEU 12 -4.514 10.208 8.010
103 HA LEU 12 HA LEU 12 -6.880 8.555 8.637
104 HB2 LEU 12 HB2 LEU 12 -6.903 9.385 6.325
105 HB3 LEU 12 HB3 LEU 12 -5.284 8.716 6.071
106 HG LEU 12 HG LEU 12 -6.182 6.435 6.416
107 HD11 LEU 12 HD11 LEU 12 -8.051 7.045 7.895
108 HD12 LEU 12 HD12 LEU 12 -8.574 6.061 6.527
109 HD13 LEU 12 HD13 LEU 12 -8.877 7.798 6.530
110 HD21 LEU 12 HD21 LEU 12 -7.711 8.007 4.335
111 HD22 LEU 12 HD22 LEU 12 -7.365 6.278 4.310
112 HD23 LEU 12 HD23 LEU 12 -6.049 7.442 4.164
113 H LYS 13 H LYS 13 -6.505 6.674 9.641
114 HA LYS 13 HA LYS 13 -3.873 5.402 9.184
115 HB2 LYS 13 HB2 LYS 13 -5.415 5.481 11.772
116 HB3 LYS 13 HB3 LYS 13 -3.899 4.600 11.500
117 HG2 LYS 13 HG2 LYS 13 -2.959 6.935 10.834
118 HG3 LYS 13 HG3 LYS 13 -4.376 7.557 11.714
119 HD2 LYS 13 HD2 LYS 13 -3.693 6.434 13.733
120 HD3 LYS 13 HD3 LYS 13 -2.379 5.591 12.875
121 HE2 LYS 13 HE2 LYS 13 -2.554 8.606 13.064
122 HE3 LYS 13 HE3 LYS 13 -1.715 7.611 14.276
123 HZ1 LYS 13 HZ1 LYS 13 -0.248 6.819 12.581
124 HZ2 LYS 13 HZ2 LYS 13 -0.244 8.476 12.534
125 HZ3 LYS 13 HZ3 LYS 13 -1.078 7.619 11.386
126 H GLY 14 H GLY 14 -4.019 3.134 8.536
127 HA2 GLY 14 HA2 GLY 14 -5.861 1.373 9.547
128 HA3 GLY 14 HA3 GLY 14 -6.718 1.951 8.139
129 H GLU 15 H GLU 15 -6.667 -0.183 7.502
130 HA GLU 15 HA GLU 15 -4.187 -0.875 6.044
131 HB2 GLU 15 HB2 GLU 15 -5.704 -2.555 8.026
132 HB3 GLU 15 HB3 GLU 15 -4.675 -3.292 6.781
133 HG2 GLU 15 HG2 GLU 15 -2.795 -1.834 7.671
134 HG3 GLU 15 HG3 GLU 15 -3.862 -1.473 9.048
135 H THR 16 H THR 16 -4.486 -2.154 4.107
136 HA THR 16 HA THR 16 -7.202 -3.121 3.619
137 HB THR 16 HB THR 16 -6.984 -2.183 1.174
138 HG1 THR 16 HG1 THR 16 -5.179 -1.033 1.152
139 HG21 THR 16 HG21 THR 16 -8.738 -1.566 2.927
140 HG22 THR 16 HG22 THR 16 -8.435 -0.417 1.625
141 HG23 THR 16 HG23 THR 16 -7.755 -0.133 3.227
142 H THR 17 H THR 17 -7.150 -4.376 1.434
143 HA THR 17 HA THR 17 -4.519 -5.628 1.113
144 HB THR 17 HB THR 17 -5.921 -6.913 2.779
145 HG1 THR 17 HG1 THR 17 -5.175 -8.180 0.344
146 HG21 THR 17 HG21 THR 17 -7.833 -7.998 2.198
147 HG22 THR 17 HG22 THR 17 -7.438 -8.024 0.479
148 HG23 THR 17 HG23 THR 17 -8.021 -6.538 1.227
149 H THR 18 H THR 18 -4.323 -6.844 -0.842
150 HA THR 18 HA THR 18 -6.553 -6.629 -2.738
151 HB THR 18 HB THR 18 -5.096 -4.535 -3.126
152 HG1 THR 18 HG1 THR 18 -6.409 -5.123 -4.777
153 HG21 THR 18 HG21 THR 18 -3.244 -6.147 -4.749
154 HG22 THR 18 HG22 THR 18 -2.961 -6.176 -3.008
155 HG23 THR 18 HG23 THR 18 -2.983 -4.640 -3.874
156 H LYS 19 H LYS 19 -6.177 -8.032 -4.633
157 HA LYS 19 HA LYS 19 -4.243 -10.199 -3.998
158 HB2 LYS 19 HB2 LYS 19 -6.726 -10.223 -5.752
159 HB3 LYS 19 HB3 LYS 19 -5.651 -11.602 -5.464
160 HG2 LYS 19 HG2 LYS 19 -6.680 -10.384 -3.000
161 HG3 LYS 19 HG3 LYS 19 -7.953 -11.019 -4.071
162 HD2 LYS 19 HD2 LYS 19 -5.508 -12.600 -3.224
163 HD3 LYS 19 HD3 LYS 19 -7.071 -12.654 -2.370
164 HE2 LYS 19 HE2 LYS 19 -6.979 -13.146 -5.332
165 HE3 LYS 19 HE3 LYS 19 -6.484 -14.438 -4.212
166 HZ1 LYS 19 HZ1 LYS 19 -8.734 -13.818 -3.091
167 HZ2 LYS 19 HZ2 LYS 19 -8.707 -14.831 -4.404
168 HZ3 LYS 19 HZ3 LYS 19 -9.120 -13.236 -4.597
169 H ALA 20 H ALA 20 -2.533 -10.480 -5.444
170 HA ALA 20 HA ALA 20 -2.805 -9.487 -8.110
171 HB1 ALA 20 HB1 ALA 20 -0.589 -8.213 -7.925
172 HB2 ALA 20 HB2 ALA 20 -0.820 -8.285 -6.178
173 HB3 ALA 20 HB3 ALA 20 -1.993 -7.440 -7.190
174 H VAL 21 H VAL 21 -1.191 -10.238 -9.607
175 HA VAL 21 HA VAL 21 -0.023 -12.646 -8.835
176 HB VAL 21 HB VAL 21 -0.780 -12.215 -11.110
177 HG11 VAL 21 HG11 VAL 21 0.227 -9.899 -11.166
178 HG12 VAL 21 HG12 VAL 21 0.491 -10.880 -12.607
179 HG13 VAL 21 HG13 VAL 21 1.790 -10.669 -11.434
180 HG21 VAL 21 HG21 VAL 21 2.146 -12.958 -11.079
181 HG22 VAL 21 HG22 VAL 21 0.888 -13.527 -12.177
182 HG23 VAL 21 HG23 VAL 21 0.876 -14.028 -10.485
183 H ASP 22 H ASP 22 1.399 -9.438 -8.755
184 HA ASP 22 HA ASP 22 3.754 -10.623 -7.563
185 HB2 ASP 22 HB2 ASP 22 5.356 -9.605 -9.159
186 HB3 ASP 22 HB3 ASP 22 4.325 -10.820 -9.945
187 H ALA 23 H ALA 23 5.351 -8.898 -6.822
188 HA ALA 23 HA ALA 23 3.801 -7.127 -5.231
189 HB1 ALA 23 HB1 ALA 23 5.810 -7.839 -4.286
190 HB2 ALA 23 HB2 ALA 23 6.085 -6.139 -4.666
191 HB3 ALA 23 HB3 ALA 23 6.746 -7.393 -5.714
192 H GLU 24 H GLU 24 5.646 -6.594 -8.252
193 HA GLU 24 HA GLU 24 5.528 -3.685 -8.041
194 HB2 GLU 24 HB2 GLU 24 5.727 -5.696 -10.346
195 HB3 GLU 24 HB3 GLU 24 5.694 -3.948 -10.650
196 HG2 GLU 24 HG2 GLU 24 7.649 -3.785 -9.018
197 HG3 GLU 24 HG3 GLU 24 7.756 -5.556 -9.149
198 H THR 25 H THR 25 3.214 -6.011 -9.536
199 HA THR 25 HA THR 25 1.529 -3.848 -10.628
200 HB THR 25 HB THR 25 0.797 -6.737 -9.909
201 HG1 THR 25 HG1 THR 25 1.902 -7.107 -11.646
202 HG21 THR 25 HG21 THR 25 -0.731 -4.607 -11.365
203 HG22 THR 25 HG22 THR 25 -1.273 -5.683 -10.078
204 HG23 THR 25 HG23 THR 25 -0.984 -6.320 -11.697
205 H ALA 26 H ALA 26 1.606 -5.640 -7.447
206 HA ALA 26 HA ALA 26 -0.792 -4.366 -6.369
207 HB1 ALA 26 HB1 ALA 26 0.505 -6.298 -5.330
208 HB2 ALA 26 HB2 ALA 26 -0.020 -5.037 -4.216
209 HB3 ALA 26 HB3 ALA 26 1.659 -5.095 -4.753
210 H GLU 27 H GLU 27 2.605 -3.229 -6.776
211 HA GLU 27 HA GLU 27 2.253 -0.945 -5.203
212 HB2 GLU 27 HB2 GLU 27 4.444 -1.773 -5.971
213 HB3 GLU 27 HB3 GLU 27 4.065 -1.207 -7.609
214 HG2 GLU 27 HG2 GLU 27 3.761 1.104 -6.574
215 HG3 GLU 27 HG3 GLU 27 4.527 0.429 -5.118
216 H LYS 28 H LYS 28 1.728 -1.284 -8.715
217 HA LYS 28 HA LYS 28 1.012 1.475 -9.141
218 HB2 LYS 28 HB2 LYS 28 -0.040 -0.941 -10.628
219 HB3 LYS 28 HB3 LYS 28 -0.028 0.741 -11.194
220 HG2 LYS 28 HG2 LYS 28 2.385 0.745 -11.285
221 HG3 LYS 28 HG3 LYS 28 2.449 -0.886 -10.570
222 HD2 LYS 28 HD2 LYS 28 1.658 -1.904 -12.503
223 HD3 LYS 28 HD3 LYS 28 0.898 -0.409 -13.103
224 HE2 LYS 28 HE2 LYS 28 3.007 0.525 -13.703
225 HE3 LYS 28 HE3 LYS 28 3.893 -0.745 -12.827
226 HZ1 LYS 28 HZ1 LYS 28 3.026 -2.346 -14.431
227 HZ2 LYS 28 HZ2 LYS 28 3.915 -1.164 -15.183
228 HZ3 LYS 28 HZ3 LYS 28 2.259 -1.131 -15.265
229 H ALA 29 H ALA 29 -1.021 -1.354 -8.136
230 HA ALA 29 HA ALA 29 -3.498 0.222 -8.307
231 HB1 ALA 29 HB1 ALA 29 -4.516 -1.588 -7.054
232 HB2 ALA 29 HB2 ALA 29 -2.944 -2.197 -6.536
233 HB3 ALA 29 HB3 ALA 29 -3.412 -2.297 -8.234
234 H PHE 30 H PHE 30 -1.237 -0.556 -5.532
235 HA PHE 30 HA PHE 30 -2.862 0.855 -3.615
236 HB2 PHE 30 HB2 PHE 30 0.061 0.016 -3.683
237 HB3 PHE 30 HB3 PHE 30 -0.681 0.818 -2.282
238 HD1 PHE 30 HD1 PHE 30 -3.263 -0.434 -2.030
239 HD2 PHE 30 HD2 PHE 30 0.464 -2.174 -3.127
240 HE1 PHE 30 HE1 PHE 30 -4.040 -2.615 -1.194
241 HE2 PHE 30 HE2 PHE 30 -0.306 -4.356 -2.294
242 HZ PHE 30 HZ PHE 30 -2.560 -4.578 -1.324
243 H LYS 31 H LYS 31 -0.189 1.987 -5.774
244 HA LYS 31 HA LYS 31 -0.121 4.615 -4.462
245 HB2 LYS 31 HB2 LYS 31 0.594 3.711 -7.269
246 HB3 LYS 31 HB3 LYS 31 0.736 5.398 -6.737
247 HG2 LYS 31 HG2 LYS 31 2.105 4.267 -4.755
248 HG3 LYS 31 HG3 LYS 31 2.354 3.007 -5.988
249 HD2 LYS 31 HD2 LYS 31 3.123 4.815 -7.556
250 HD3 LYS 31 HD3 LYS 31 3.051 5.951 -6.186
251 HE2 LYS 31 HE2 LYS 31 4.851 4.993 -5.119
252 HE3 LYS 31 HE3 LYS 31 4.576 3.397 -5.857
253 HZ1 LYS 31 HZ1 LYS 31 5.562 5.756 -7.347
254 HZ2 LYS 31 HZ2 LYS 31 5.465 4.195 -7.899
255 HZ3 LYS 31 HZ3 LYS 31 6.550 4.585 -6.707
256 H GLN 32 H GLN 32 -2.270 3.259 -6.939
257 HA GLN 32 HA GLN 32 -3.568 5.802 -7.441
258 HB2 GLN 32 HB2 GLN 32 -3.783 3.998 -9.056
259 HB3 GLN 32 HB3 GLN 32 -4.508 2.933 -7.834
260 HG2 GLN 32 HG2 GLN 32 -6.301 3.669 -9.147
261 HG3 GLN 32 HG3 GLN 32 -6.380 4.654 -7.669
262 HE21 GLN 32 HE21 GLN 32 -7.344 6.453 -8.395
263 HE22 GLN 32 HE22 GLN 32 -6.666 7.501 -9.689
264 H TYR 33 H TYR 33 -4.356 3.117 -5.231
265 HA TYR 33 HA TYR 33 -6.773 4.279 -4.187
266 HB2 TYR 33 HB2 TYR 33 -6.024 1.919 -3.773
267 HB3 TYR 33 HB3 TYR 33 -4.652 2.537 -2.829
268 HD1 TYR 33 HD2 TYR 33 -5.160 3.826 -0.694
269 HD2 TYR 33 HD1 TYR 33 -8.106 1.555 -2.759
270 HE1 TYR 33 HE2 TYR 33 -6.542 3.778 1.340
271 HE2 TYR 33 HE1 TYR 33 -9.496 1.503 -0.731
272 HH TYR 33 HH TYR 33 -8.656 1.838 2.087
273 H ALA 34 H ALA 34 -3.406 4.637 -3.017
274 HA ALA 34 HA ALA 34 -3.970 6.403 -0.879
275 HB1 ALA 34 HB1 ALA 34 -1.740 5.236 -1.562
276 HB2 ALA 34 HB2 ALA 34 -1.695 6.806 -0.760
277 HB3 ALA 34 HB3 ALA 34 -1.485 6.702 -2.508
278 H ASN 35 H ASN 35 -3.265 7.144 -4.297
279 HA ASN 35 HA ASN 35 -3.401 10.030 -3.844
280 HB2 ASN 35 HB2 ASN 35 -2.432 8.932 -5.894
281 HB3 ASN 35 HB3 ASN 35 -4.068 8.440 -6.386
282 HD21 ASN 35 HD21 ASN 35 -4.396 9.574 -8.180
283 HD22 ASN 35 HD22 ASN 35 -4.313 11.366 -8.277
284 H ASP 36 H ASP 36 -6.000 7.657 -4.776
285 HA ASP 36 HA ASP 36 -8.005 9.696 -5.125
286 HB2 ASP 36 HB2 ASP 36 -8.266 6.765 -4.433
287 HB3 ASP 36 HB3 ASP 36 -9.660 7.835 -4.700
288 H ASN 37 H ASN 37 -6.635 8.362 -2.204
289 HA ASN 37 HA ASN 37 -8.823 9.711 -0.652
290 HB2 ASN 37 HB2 ASN 37 -6.852 7.529 0.043
291 HB3 ASN 37 HB3 ASN 37 -7.760 8.411 1.290
292 HD21 ASN 37 HD21 ASN 37 -7.926 6.183 -1.401
293 HD22 ASN 37 HD22 ASN 37 -9.596 5.606 -1.065
294 H GLY 38 H GLY 38 -5.943 10.734 -1.796
295 HA2 GLY 38 HA2 GLY 38 -4.949 12.745 -1.207
296 HA3 GLY 38 HA3 GLY 38 -5.929 12.807 0.242
297 H VAL 39 H VAL 39 -3.843 10.067 -0.241
298 HA VAL 39 HA VAL 39 -2.151 11.057 2.045
299 HB VAL 39 HB VAL 39 -2.630 8.236 1.096
300 HG11 VAL 39 HG11 VAL 39 -1.343 8.888 3.695
301 HG12 VAL 39 HG12 VAL 39 -0.369 9.081 2.239
302 HG13 VAL 39 HG13 VAL 39 -1.091 7.516 2.615
303 HG21 VAL 39 HG21 VAL 39 -3.982 7.944 3.010
304 HG22 VAL 39 HG22 VAL 39 -4.524 9.462 2.293
305 HG23 VAL 39 HG23 VAL 39 -3.473 9.481 3.708
306 H ASP 40 H ASP 40 -0.164 11.454 1.839
307 HA ASP 40 HA ASP 40 1.275 10.370 -0.526
308 HB2 ASP 40 HB2 ASP 40 0.399 12.551 -1.144
309 HB3 ASP 40 HB3 ASP 40 1.086 13.278 0.324
310 H GLY 41 H GLY 41 3.057 9.723 -0.289
311 HA2 GLY 41 HA2 GLY 41 4.987 10.772 1.716
312 HA3 GLY 41 HA3 GLY 41 4.131 9.336 2.225
313 H VAL 42 H VAL 42 6.056 8.530 2.724
314 HA VAL 42 HA VAL 42 7.766 7.796 0.462
315 HB VAL 42 HB VAL 42 8.225 7.699 3.441
316 HG11 VAL 42 HG11 VAL 42 9.237 5.748 2.245
317 HG12 VAL 42 HG12 VAL 42 10.399 6.800 3.054
318 HG13 VAL 42 HG13 VAL 42 10.196 6.891 1.305
319 HG21 VAL 42 HG21 VAL 42 10.226 9.174 2.566
320 HG22 VAL 42 HG22 VAL 42 8.636 9.873 2.869
321 HG23 VAL 42 HG23 VAL 42 9.126 9.474 1.224
322 H TRP 43 H TRP 43 8.042 5.696 -0.237
323 HA TRP 43 HA TRP 43 6.150 3.655 1.044
324 HB2 TRP 43 HB2 TRP 43 7.435 3.983 -1.703
325 HB3 TRP 43 HB3 TRP 43 6.577 2.507 -1.208
326 HD1 TRP 43 HD1 TRP 43 5.933 6.243 -1.916
327 HE1 TRP 43 HE1 TRP 43 3.416 6.586 -2.447
328 HE3 TRP 43 HE3 TRP 43 4.308 1.509 -0.887
329 HZ2 TRP 43 HZ2 TRP 43 1.078 4.991 -2.408
330 HZ3 TRP 43 HZ3 TRP 43 1.918 0.996 -1.158
331 HH2 TRP 43 HH2 TRP 43 0.337 2.702 -1.902
332 H THR 44 H THR 44 6.801 1.769 1.857
333 HA THR 44 HA THR 44 9.551 0.866 1.185
334 HB THR 44 HB THR 44 9.669 -0.140 3.543
335 HG1 THR 44 HG1 THR 44 7.535 1.697 3.896
336 HG21 THR 44 HG21 THR 44 10.941 1.894 2.839
337 HG22 THR 44 HG22 THR 44 10.576 1.796 4.562
338 HG23 THR 44 HG23 THR 44 9.639 2.870 3.521
339 H TYR 45 H TYR 45 9.764 -1.455 1.257
340 HA TYR 45 HA TYR 45 7.308 -2.987 1.392
341 HB2 TYR 45 HB2 TYR 45 7.674 -2.549 -0.962
342 HB3 TYR 45 HB3 TYR 45 9.346 -3.130 -0.814
343 HD1 TYR 45 HD1 TYR 45 6.135 -4.588 0.443
344 HD2 TYR 45 HD2 TYR 45 9.498 -5.035 -2.126
345 HE1 TYR 45 HE1 TYR 45 5.391 -6.860 -0.129
346 HE2 TYR 45 HE2 TYR 45 8.763 -7.310 -2.705
347 HH TYR 45 HH TYR 45 7.343 -9.110 -1.640
348 H ASP 46 H ASP 46 7.375 -4.866 2.454
349 HA ASP 46 HA ASP 46 10.059 -5.946 3.064
350 HB2 ASP 46 HB2 ASP 46 8.865 -5.219 5.112
351 HB3 ASP 46 HB3 ASP 46 7.471 -6.221 4.651
352 H ASP 47 H ASP 47 10.445 -7.548 1.671
353 HA ASP 47 HA ASP 47 8.335 -8.921 0.258
354 HB2 ASP 47 HB2 ASP 47 10.704 -8.632 -0.544
355 HB3 ASP 47 HB3 ASP 47 11.205 -9.850 0.650
356 H ALA 48 H ALA 48 9.933 -9.702 3.381
357 HA ALA 48 HA ALA 48 9.159 -12.540 3.273
358 HB1 ALA 48 HB1 ALA 48 9.708 -10.638 5.607
359 HB2 ALA 48 HB2 ALA 48 10.874 -11.704 4.822
360 HB3 ALA 48 HB3 ALA 48 9.545 -12.386 5.760
361 H THR 49 H THR 49 7.451 -9.629 4.375
362 HA THR 49 HA THR 49 5.113 -11.461 5.157
363 HB THR 49 HB THR 49 4.168 -9.514 6.396
364 HG1 THR 49 HG1 THR 49 6.495 -8.116 5.541
365 HG21 THR 49 HG21 THR 49 5.381 -9.971 8.185
366 HG22 THR 49 HG22 THR 49 6.772 -9.114 7.524
367 HG23 THR 49 HG23 THR 49 6.531 -10.820 7.151
368 H LYS 50 H LYS 50 6.116 -9.766 2.475
369 HA LYS 50 HA LYS 50 5.010 -8.784 0.675
370 HB2 LYS 50 HB2 LYS 50 2.678 -10.525 1.636
371 HB3 LYS 50 HB3 LYS 50 2.795 -9.750 0.045
372 HG2 LYS 50 HG2 LYS 50 4.884 -11.693 1.020
373 HG3 LYS 50 HG3 LYS 50 3.390 -12.235 0.216
374 HD2 LYS 50 HD2 LYS 50 4.000 -10.613 -1.661
375 HD3 LYS 50 HD3 LYS 50 5.603 -10.495 -0.893
376 HE2 LYS 50 HE2 LYS 50 6.188 -12.625 -1.473
377 HE3 LYS 50 HE3 LYS 50 4.517 -13.229 -1.383
378 HZ1 LYS 50 HZ1 LYS 50 4.055 -12.217 -3.480
379 HZ2 LYS 50 HZ2 LYS 50 5.424 -13.136 -3.656
380 HZ3 LYS 50 HZ3 LYS 50 5.545 -11.486 -3.544
381 H THR 51 H THR 51 5.050 -7.196 2.884
382 HA THR 51 HA THR 51 2.480 -5.805 2.746
383 HB THR 51 HB THR 51 4.489 -5.927 4.985
384 HG1 THR 51 HG1 THR 51 1.826 -6.889 4.749
385 HG21 THR 51 HG21 THR 51 3.344 -3.704 4.780
386 HG22 THR 51 HG22 THR 51 3.058 -4.564 6.293
387 HG23 THR 51 HG23 THR 51 1.815 -4.543 5.041
388 H PHE 52 H PHE 52 2.328 -3.797 2.095
389 HA PHE 52 HA PHE 52 4.995 -2.288 1.539
390 HB2 PHE 52 HB2 PHE 52 2.107 -2.041 0.449
391 HB3 PHE 52 HB3 PHE 52 3.373 -0.821 0.191
392 HD1 PHE 52 HD2 PHE 52 5.332 -1.350 -1.184
393 HD2 PHE 52 HD1 PHE 52 2.120 -4.109 -0.743
394 HE1 PHE 52 HE2 PHE 52 6.140 -2.598 -3.146
395 HE2 PHE 52 HE1 PHE 52 2.922 -5.362 -2.703
396 HZ PHE 52 HZ PHE 52 4.934 -4.606 -3.907
397 H THR 53 H THR 53 5.108 -0.339 2.795
398 HA THR 53 HA THR 53 2.824 0.447 4.505
399 HB THR 53 HB THR 53 5.782 0.609 5.228
400 HG1 THR 53 HG1 THR 53 5.337 -1.373 5.808
401 HG21 THR 53 HG21 THR 53 5.301 1.873 7.002
402 HG22 THR 53 HG22 THR 53 3.793 1.018 7.333
403 HG23 THR 53 HG23 THR 53 3.834 2.297 6.119
404 H VAL 54 H VAL 54 2.306 2.600 4.429
405 HA VAL 54 HA VAL 54 4.333 4.345 2.938
406 HB VAL 54 HB VAL 54 2.368 4.028 1.471
407 HG11 VAL 54 HG11 VAL 54 0.142 4.604 2.080
408 HG12 VAL 54 HG12 VAL 54 0.662 5.271 3.628
409 HG13 VAL 54 HG13 VAL 54 0.754 3.534 3.342
410 HG21 VAL 54 HG21 VAL 54 1.639 6.490 1.408
411 HG22 VAL 54 HG22 VAL 54 3.357 6.138 1.233
412 HG23 VAL 54 HG23 VAL 54 2.728 6.716 2.776
413 H THR 55 H THR 55 5.065 5.834 4.333
414 HA THR 55 HA THR 55 3.455 6.495 6.770
415 HB THR 55 HB THR 55 6.468 6.486 6.408
416 HG1 THR 55 HG1 THR 55 4.821 4.766 7.960
417 HG21 THR 55 HG21 THR 55 4.970 6.790 8.989
418 HG22 THR 55 HG22 THR 55 5.626 8.148 8.076
419 HG23 THR 55 HG23 THR 55 6.706 6.907 8.707
420 H GLU 56 H GLU 56 2.802 8.546 6.891
421 HA GLU 56 HA GLU 56 3.886 10.613 4.982
422 HB2 GLU 56 HB2 GLU 56 1.431 10.213 5.203
423 HB3 GLU 56 HB3 GLU 56 1.534 10.678 6.912
424 HG2 GLU 56 HG2 GLU 56 2.636 12.856 5.877
425 HG3 GLU 56 HG3 GLU 56 1.694 12.351 4.454
Start of MODEL 4
1 H1 MET 1 H1 MET 1 -1.060 -13.068 -5.568
2 H2 MET 1 H2 MET 1 -2.124 -14.314 -5.180
3 H3 MET 1 H3 MET 1 -0.502 -14.654 -5.475
4 HA MET 1 HA MET 1 -1.181 -14.666 -3.114
5 HB2 MET 1 HB2 MET 1 0.946 -12.669 -3.956
6 HB3 MET 1 HB3 MET 1 0.868 -13.558 -2.422
7 HG2 MET 1 HG2 MET 1 0.886 -15.654 -4.040
8 HG3 MET 1 HG3 MET 1 1.659 -14.494 -5.144
9 HE1 MET 1 HE1 MET 1 3.247 -16.828 -1.768
10 HE2 MET 1 HE2 MET 1 1.558 -16.456 -2.114
11 HE3 MET 1 HE3 MET 1 2.472 -15.448 -0.992
12 H GLN 2 H GLN 2 -1.591 -13.411 -1.235
13 HA GLN 2 HA GLN 2 -3.069 -10.911 -1.810
14 HB2 GLN 2 HB2 GLN 2 -4.142 -12.578 -0.336
15 HB3 GLN 2 HB3 GLN 2 -2.720 -12.570 0.726
16 HG2 GLN 2 HG2 GLN 2 -3.210 -10.057 1.017
17 HG3 GLN 2 HG3 GLN 2 -4.807 -10.438 0.333
18 HE21 GLN 2 HE21 GLN 2 -2.739 -10.568 3.079
19 HE22 GLN 2 HE22 GLN 2 -3.906 -11.356 4.197
20 H TYR 3 H TYR 3 -2.359 -8.945 -1.287
21 HA TYR 3 HA TYR 3 0.143 -8.588 0.255
22 HB2 TYR 3 HB2 TYR 3 -0.824 -6.905 -2.052
23 HB3 TYR 3 HB3 TYR 3 0.578 -6.527 -1.025
24 HD1 TYR 3 HD1 TYR 3 -0.770 -9.203 -3.266
25 HD2 TYR 3 HD2 TYR 3 2.681 -7.327 -1.623
26 HE1 TYR 3 HE1 TYR 3 0.663 -10.561 -4.731
27 HE2 TYR 3 HE2 TYR 3 4.120 -8.681 -3.087
28 HH TYR 3 HH TYR 3 3.959 -9.912 -5.205
29 H LYS 4 H LYS 4 0.202 -6.809 1.731
30 HA LYS 4 HA LYS 4 -2.416 -5.612 2.301
31 HB2 LYS 4 HB2 LYS 4 -1.652 -7.201 4.021
32 HB3 LYS 4 HB3 LYS 4 -0.157 -6.261 4.206
33 HG2 LYS 4 HG2 LYS 4 -1.556 -4.301 4.885
34 HG3 LYS 4 HG3 LYS 4 -2.976 -5.376 4.865
35 HD2 LYS 4 HD2 LYS 4 -0.485 -5.889 6.516
36 HD3 LYS 4 HD3 LYS 4 -1.929 -5.048 7.131
37 HE2 LYS 4 HE2 LYS 4 -3.291 -6.992 6.797
38 HE3 LYS 4 HE3 LYS 4 -1.983 -7.826 5.925
39 HZ1 LYS 4 HZ1 LYS 4 -0.893 -8.274 7.854
40 HZ2 LYS 4 HZ2 LYS 4 -2.441 -8.276 8.446
41 HZ3 LYS 4 HZ3 LYS 4 -1.475 -6.946 8.663
42 H LEU 5 H LEU 5 -2.561 -3.456 2.830
43 HA LEU 5 HA LEU 5 0.035 -1.872 2.532
44 HB2 LEU 5 HB2 LEU 5 -1.418 -1.402 0.634
45 HB3 LEU 5 HB3 LEU 5 -2.816 -1.152 1.689
46 HG LEU 5 HG LEU 5 -1.170 0.730 2.707
47 HD11 LEU 5 HD11 LEU 5 0.674 0.360 1.240
48 HD12 LEU 5 HD12 LEU 5 -0.097 1.868 0.750
49 HD13 LEU 5 HD13 LEU 5 -0.368 0.397 -0.183
50 HD21 LEU 5 HD21 LEU 5 -2.460 2.325 1.506
51 HD22 LEU 5 HD22 LEU 5 -3.503 0.928 1.777
52 HD23 LEU 5 HD23 LEU 5 -2.774 1.190 0.194
53 H VAL 6 H VAL 6 0.425 -0.833 4.424
54 HA VAL 6 HA VAL 6 -1.689 -0.321 6.374
55 HB VAL 6 HB VAL 6 1.310 -0.393 6.828
56 HG11 VAL 6 HG11 VAL 6 0.916 0.134 9.080
57 HG12 VAL 6 HG12 VAL 6 -0.815 -0.178 8.951
58 HG13 VAL 6 HG13 VAL 6 -0.117 1.250 8.186
59 HG21 VAL 6 HG21 VAL 6 -0.885 -2.362 7.370
60 HG22 VAL 6 HG22 VAL 6 0.535 -2.304 8.416
61 HG23 VAL 6 HG23 VAL 6 0.722 -2.627 6.691
62 H ILE 7 H ILE 7 -2.336 1.728 6.609
63 HA ILE 7 HA ILE 7 -0.551 3.864 5.261
64 HB ILE 7 HB ILE 7 -3.537 3.982 5.930
65 HG12 ILE 7 HG12 ILE 7 -2.131 3.930 3.232
66 HG13 ILE 7 HG13 ILE 7 -2.913 2.521 3.981
67 HG21 ILE 7 HG21 ILE 7 -3.201 6.096 4.425
68 HG22 ILE 7 HG22 ILE 7 -1.529 5.985 4.976
69 HG23 ILE 7 HG23 ILE 7 -2.834 6.166 6.148
70 HD11 ILE 7 HD11 ILE 7 -4.341 3.569 2.310
71 HD12 ILE 7 HD12 ILE 7 -4.283 5.093 3.197
72 HD13 ILE 7 HD13 ILE 7 -5.057 3.681 3.918
73 H ASN 8 H ASN 8 0.635 4.871 6.749
74 HA ASN 8 HA ASN 8 -0.544 5.355 9.493
75 HB2 ASN 8 HB2 ASN 8 2.359 5.135 8.551
76 HB3 ASN 8 HB3 ASN 8 1.860 5.609 10.190
77 HD21 ASN 8 HD21 ASN 8 2.497 3.966 11.417
78 HD22 ASN 8 HD22 ASN 8 2.010 2.256 11.153
79 H GLY 9 H GLY 9 -1.756 7.135 8.423
80 HA2 GLY 9 HA2 GLY 9 -0.280 9.409 7.274
81 HA3 GLY 9 HA3 GLY 9 -1.974 9.129 7.249
82 H LYS 10 H LYS 10 -1.157 11.638 7.920
83 HA LYS 10 HA LYS 10 -0.897 12.035 10.799
84 HB2 LYS 10 HB2 LYS 10 -1.706 13.834 8.499
85 HB3 LYS 10 HB3 LYS 10 -1.452 14.383 10.168
86 HG2 LYS 10 HG2 LYS 10 0.727 12.860 8.783
87 HG3 LYS 10 HG3 LYS 10 0.458 14.574 8.382
88 HD2 LYS 10 HD2 LYS 10 0.552 15.028 10.887
89 HD3 LYS 10 HD3 LYS 10 1.149 13.360 11.066
90 HE2 LYS 10 HE2 LYS 10 2.985 13.860 9.524
91 HE3 LYS 10 HE3 LYS 10 2.391 15.516 9.347
92 HZ1 LYS 10 HZ1 LYS 10 2.952 15.315 11.983
93 HZ2 LYS 10 HZ2 LYS 10 3.909 16.000 10.814
94 HZ3 LYS 10 HZ3 LYS 10 4.159 14.425 11.268
95 H THR 11 H THR 11 -3.445 12.020 8.538
96 HA THR 11 HA THR 11 -5.551 12.266 10.621
97 HB THR 11 HB THR 11 -7.031 13.200 8.941
98 HG1 THR 11 HG1 THR 11 -6.363 13.486 6.976
99 HG21 THR 11 HG21 THR 11 -4.534 14.723 9.647
100 HG22 THR 11 HG22 THR 11 -6.111 14.774 10.435
101 HG23 THR 11 HG23 THR 11 -5.910 15.452 8.820
102 H LEU 12 H LEU 12 -4.514 10.208 8.010
103 HA LEU 12 HA LEU 12 -6.880 8.555 8.637
104 HB2 LEU 12 HB2 LEU 12 -6.906 9.383 6.326
105 HB3 LEU 12 HB3 LEU 12 -5.285 8.720 6.071
106 HG LEU 12 HG LEU 12 -6.174 6.436 6.415
107 HD11 LEU 12 HD11 LEU 12 -8.045 7.038 7.894
108 HD12 LEU 12 HD12 LEU 12 -8.565 6.053 6.526
109 HD13 LEU 12 HD13 LEU 12 -8.874 7.789 6.530
110 HD21 LEU 12 HD21 LEU 12 -7.709 8.003 4.335
111 HD22 LEU 12 HD22 LEU 12 -7.357 6.275 4.309
112 HD23 LEU 12 HD23 LEU 12 -6.045 7.445 4.163
113 H LYS 13 H LYS 13 -6.505 6.674 9.641
114 HA LYS 13 HA LYS 13 -3.873 5.402 9.184
115 HB2 LYS 13 HB2 LYS 13 -5.415 5.480 11.772
116 HB3 LYS 13 HB3 LYS 13 -3.898 4.601 11.500
117 HG2 LYS 13 HG2 LYS 13 -2.960 6.936 10.835
118 HG3 LYS 13 HG3 LYS 13 -4.378 7.557 11.715
119 HD2 LYS 13 HD2 LYS 13 -3.694 6.435 13.733
120 HD3 LYS 13 HD3 LYS 13 -2.379 5.593 12.874
121 HE2 LYS 13 HE2 LYS 13 -2.557 8.608 13.065
122 HE3 LYS 13 HE3 LYS 13 -1.717 7.613 14.277
123 HZ1 LYS 13 HZ1 LYS 13 -0.249 6.822 12.581
124 HZ2 LYS 13 HZ2 LYS 13 -0.246 8.480 12.534
125 HZ3 LYS 13 HZ3 LYS 13 -1.080 7.622 11.386
126 H GLY 14 H GLY 14 -4.019 3.134 8.536
127 HA2 GLY 14 HA2 GLY 14 -5.861 1.373 9.547
128 HA3 GLY 14 HA3 GLY 14 -6.718 1.951 8.139
129 H GLU 15 H GLU 15 -6.667 -0.183 7.502
130 HA GLU 15 HA GLU 15 -4.187 -0.875 6.044
131 HB2 GLU 15 HB2 GLU 15 -3.940 -2.190 7.972
132 HB3 GLU 15 HB3 GLU 15 -5.682 -2.518 8.063
133 HG2 GLU 15 HG2 GLU 15 -5.446 -3.858 5.950
134 HG3 GLU 15 HG3 GLU 15 -3.685 -3.663 6.105
135 H THR 16 H THR 16 -4.486 -2.154 4.107
136 HA THR 16 HA THR 16 -7.202 -3.121 3.619
137 HB THR 16 HB THR 16 -7.279 -0.836 2.610
138 HG1 THR 16 HG1 THR 16 -8.572 -2.132 1.501
139 HG21 THR 16 HG21 THR 16 -4.801 -0.844 1.983
140 HG22 THR 16 HG22 THR 16 -5.944 -0.173 0.820
141 HG23 THR 16 HG23 THR 16 -5.288 -1.792 0.579
142 H THR 17 H THR 17 -7.150 -4.376 1.434
143 HA THR 17 HA THR 17 -4.519 -5.628 1.113
144 HB THR 17 HB THR 17 -5.468 -7.856 1.228
145 HG1 THR 17 HG1 THR 17 -7.876 -6.499 1.900
146 HG21 THR 17 HG21 THR 17 -5.535 -8.089 3.489
147 HG22 THR 17 HG22 THR 17 -6.535 -6.655 3.727
148 HG23 THR 17 HG23 THR 17 -4.814 -6.483 3.383
149 H THR 18 H THR 18 -4.323 -6.844 -0.842
150 HA THR 18 HA THR 18 -6.553 -6.629 -2.738
151 HB THR 18 HB THR 18 -5.090 -4.536 -3.123
152 HG1 THR 18 HG1 THR 18 -6.413 -5.114 -4.769
153 HG21 THR 18 HG21 THR 18 -3.252 -6.151 -4.758
154 HG22 THR 18 HG22 THR 18 -2.961 -6.185 -3.019
155 HG23 THR 18 HG23 THR 18 -2.981 -4.647 -3.881
156 H LYS 19 H LYS 19 -6.177 -8.032 -4.633
157 HA LYS 19 HA LYS 19 -4.243 -10.199 -3.998
158 HB2 LYS 19 HB2 LYS 19 -6.724 -10.224 -5.755
159 HB3 LYS 19 HB3 LYS 19 -5.650 -11.604 -5.461
160 HG2 LYS 19 HG2 LYS 19 -6.683 -10.379 -3.002
161 HG3 LYS 19 HG3 LYS 19 -7.955 -11.015 -4.074
162 HD2 LYS 19 HD2 LYS 19 -5.513 -12.596 -3.218
163 HD3 LYS 19 HD3 LYS 19 -7.077 -12.647 -2.368
164 HE2 LYS 19 HE2 LYS 19 -6.980 -13.146 -5.328
165 HE3 LYS 19 HE3 LYS 19 -6.488 -14.436 -4.204
166 HZ1 LYS 19 HZ1 LYS 19 -8.740 -13.812 -3.089
167 HZ2 LYS 19 HZ2 LYS 19 -8.710 -14.828 -4.400
168 HZ3 LYS 19 HZ3 LYS 19 -9.123 -13.233 -4.597
169 H ALA 20 H ALA 20 -2.533 -10.480 -5.444
170 HA ALA 20 HA ALA 20 -2.805 -9.487 -8.110
171 HB1 ALA 20 HB1 ALA 20 -0.589 -8.213 -7.925
172 HB2 ALA 20 HB2 ALA 20 -0.820 -8.285 -6.178
173 HB3 ALA 20 HB3 ALA 20 -1.993 -7.440 -7.190
174 H VAL 21 H VAL 21 -1.191 -10.238 -9.607
175 HA VAL 21 HA VAL 21 -0.023 -12.646 -8.835
176 HB VAL 21 HB VAL 21 0.970 -12.793 -11.039
177 HG11 VAL 21 HG11 VAL 21 -1.470 -13.263 -10.589
178 HG12 VAL 21 HG12 VAL 21 -1.066 -12.865 -12.259
179 HG13 VAL 21 HG13 VAL 21 -1.817 -11.653 -11.222
180 HG21 VAL 21 HG21 VAL 21 -0.153 -10.033 -11.528
181 HG22 VAL 21 HG22 VAL 21 0.871 -10.998 -12.593
182 HG23 VAL 21 HG23 VAL 21 1.534 -10.323 -11.104
183 H ASP 22 H ASP 22 1.399 -9.438 -8.755
184 HA ASP 22 HA ASP 22 3.754 -10.623 -7.563
185 HB2 ASP 22 HB2 ASP 22 5.356 -9.604 -9.159
186 HB3 ASP 22 HB3 ASP 22 4.325 -10.821 -9.944
187 H ALA 23 H ALA 23 5.351 -8.898 -6.822
188 HA ALA 23 HA ALA 23 3.801 -7.127 -5.231
189 HB1 ALA 23 HB1 ALA 23 5.810 -7.839 -4.286
190 HB2 ALA 23 HB2 ALA 23 6.085 -6.139 -4.666
191 HB3 ALA 23 HB3 ALA 23 6.746 -7.393 -5.714
192 H GLU 24 H GLU 24 5.646 -6.594 -8.252
193 HA GLU 24 HA GLU 24 5.528 -3.685 -8.041
194 HB2 GLU 24 HB2 GLU 24 5.726 -5.695 -10.347
195 HB3 GLU 24 HB3 GLU 24 5.696 -3.947 -10.650
196 HG2 GLU 24 HG2 GLU 24 7.650 -3.788 -9.016
197 HG3 GLU 24 HG3 GLU 24 7.755 -5.559 -9.150
198 H THR 25 H THR 25 3.214 -6.011 -9.536
199 HA THR 25 HA THR 25 1.529 -3.848 -10.628
200 HB THR 25 HB THR 25 0.801 -6.739 -9.911
201 HG1 THR 25 HG1 THR 25 1.900 -7.102 -11.654
202 HG21 THR 25 HG21 THR 25 -0.738 -4.608 -11.356
203 HG22 THR 25 HG22 THR 25 -1.271 -5.689 -10.069
204 HG23 THR 25 HG23 THR 25 -0.988 -6.322 -11.691
205 H ALA 26 H ALA 26 1.606 -5.640 -7.447
206 HA ALA 26 HA ALA 26 -0.792 -4.366 -6.369
207 HB1 ALA 26 HB1 ALA 26 0.505 -6.298 -5.330
208 HB2 ALA 26 HB2 ALA 26 -0.020 -5.037 -4.216
209 HB3 ALA 26 HB3 ALA 26 1.659 -5.095 -4.753
210 H GLU 27 H GLU 27 2.605 -3.229 -6.776
211 HA GLU 27 HA GLU 27 2.253 -0.945 -5.203
212 HB2 GLU 27 HB2 GLU 27 4.444 -1.775 -5.973
213 HB3 GLU 27 HB3 GLU 27 4.065 -1.205 -7.610
214 HG2 GLU 27 HG2 GLU 27 3.762 1.104 -6.569
215 HG3 GLU 27 HG3 GLU 27 4.528 0.426 -5.114
216 H LYS 28 H LYS 28 1.728 -1.284 -8.715
217 HA LYS 28 HA LYS 28 1.012 1.475 -9.141
218 HB2 LYS 28 HB2 LYS 28 -0.042 -0.940 -10.628
219 HB3 LYS 28 HB3 LYS 28 -0.026 0.742 -11.195
220 HG2 LYS 28 HG2 LYS 28 2.387 0.742 -11.284
221 HG3 LYS 28 HG3 LYS 28 2.448 -0.889 -10.569
222 HD2 LYS 28 HD2 LYS 28 1.656 -1.906 -12.502
223 HD3 LYS 28 HD3 LYS 28 0.899 -0.410 -13.102
224 HE2 LYS 28 HE2 LYS 28 3.010 0.520 -13.702
225 HE3 LYS 28 HE3 LYS 28 3.893 -0.751 -12.825
226 HZ1 LYS 28 HZ1 LYS 28 3.024 -2.350 -14.430
227 HZ2 LYS 28 HZ2 LYS 28 3.916 -1.170 -15.181
228 HZ3 LYS 28 HZ3 LYS 28 2.260 -1.134 -15.264
229 H ALA 29 H ALA 29 -1.021 -1.354 -8.136
230 HA ALA 29 HA ALA 29 -3.498 0.222 -8.307
231 HB1 ALA 29 HB1 ALA 29 -4.516 -1.588 -7.054
232 HB2 ALA 29 HB2 ALA 29 -2.944 -2.197 -6.536
233 HB3 ALA 29 HB3 ALA 29 -3.412 -2.297 -8.234
234 H PHE 30 H PHE 30 -1.237 -0.556 -5.532
235 HA PHE 30 HA PHE 30 -2.862 0.855 -3.615
236 HB2 PHE 30 HB2 PHE 30 0.061 0.017 -3.682
237 HB3 PHE 30 HB3 PHE 30 -0.683 0.818 -2.281
238 HD1 PHE 30 HD1 PHE 30 -3.263 -0.438 -2.033
239 HD2 PHE 30 HD2 PHE 30 0.466 -2.173 -3.128
240 HE1 PHE 30 HE1 PHE 30 -4.038 -2.620 -1.199
241 HE2 PHE 30 HE2 PHE 30 -0.303 -4.356 -2.299
242 HZ PHE 30 HZ PHE 30 -2.557 -4.582 -1.330
243 H LYS 31 H LYS 31 -0.189 1.987 -5.774
244 HA LYS 31 HA LYS 31 -0.121 4.615 -4.462
245 HB2 LYS 31 HB2 LYS 31 0.595 3.709 -7.268
246 HB3 LYS 31 HB3 LYS 31 0.734 5.397 -6.739
247 HG2 LYS 31 HG2 LYS 31 2.105 4.274 -4.754
248 HG3 LYS 31 HG3 LYS 31 2.356 3.011 -5.984
249 HD2 LYS 31 HD2 LYS 31 3.122 4.817 -7.556
250 HD3 LYS 31 HD3 LYS 31 3.048 5.956 -6.189
251 HE2 LYS 31 HE2 LYS 31 4.849 5.004 -5.119
252 HE3 LYS 31 HE3 LYS 31 4.578 3.406 -5.853
253 HZ1 LYS 31 HZ1 LYS 31 5.559 5.763 -7.348
254 HZ2 LYS 31 HZ2 LYS 31 5.466 4.201 -7.897
255 HZ3 LYS 31 HZ3 LYS 31 6.549 4.596 -6.705
256 H GLN 32 H GLN 32 -2.270 3.259 -6.939
257 HA GLN 32 HA GLN 32 -3.568 5.802 -7.441
258 HB2 GLN 32 HB2 GLN 32 -3.785 4.000 -9.057
259 HB3 GLN 32 HB3 GLN 32 -4.505 2.933 -7.835
260 HG2 GLN 32 HG2 GLN 32 -6.450 4.436 -7.689
261 HG3 GLN 32 HG3 GLN 32 -5.729 5.470 -8.944
262 HE21 GLN 32 HE21 GLN 32 -8.279 4.174 -9.038
263 HE22 GLN 32 HE22 GLN 32 -8.222 3.026 -10.421
264 H TYR 33 H TYR 33 -4.356 3.117 -5.231
265 HA TYR 33 HA TYR 33 -6.773 4.279 -4.187
266 HB2 TYR 33 HB2 TYR 33 -6.028 1.920 -3.772
267 HB3 TYR 33 HB3 TYR 33 -4.652 2.535 -2.832
268 HD1 TYR 33 HD2 TYR 33 -5.150 3.825 -0.696
269 HD2 TYR 33 HD1 TYR 33 -8.107 1.560 -2.751
270 HE1 TYR 33 HE2 TYR 33 -6.526 3.781 1.343
271 HE2 TYR 33 HE1 TYR 33 -9.490 1.510 -0.718
272 HH TYR 33 HH TYR 33 -8.640 1.845 2.097
273 H ALA 34 H ALA 34 -3.406 4.637 -3.017
274 HA ALA 34 HA ALA 34 -3.970 6.403 -0.879
275 HB1 ALA 34 HB1 ALA 34 -1.740 5.236 -1.562
276 HB2 ALA 34 HB2 ALA 34 -1.695 6.806 -0.760
277 HB3 ALA 34 HB3 ALA 34 -1.485 6.702 -2.508
278 H ASN 35 H ASN 35 -3.265 7.144 -4.297
279 HA ASN 35 HA ASN 35 -3.401 10.030 -3.844
280 HB2 ASN 35 HB2 ASN 35 -3.855 8.279 -6.317
281 HB3 ASN 35 HB3 ASN 35 -3.908 10.054 -6.374
282 HD21 ASN 35 HD21 ASN 35 -2.160 8.875 -7.978
283 HD22 ASN 35 HD22 ASN 35 -0.486 9.056 -7.349
284 H ASP 36 H ASP 36 -6.000 7.657 -4.776
285 HA ASP 36 HA ASP 36 -8.005 9.696 -5.125
286 HB2 ASP 36 HB2 ASP 36 -8.268 6.766 -4.430
287 HB3 ASP 36 HB3 ASP 36 -9.660 7.837 -4.703
288 H ASN 37 H ASN 37 -6.635 8.362 -2.204
289 HA ASN 37 HA ASN 37 -8.823 9.711 -0.652
290 HB2 ASN 37 HB2 ASN 37 -6.853 7.528 0.042
291 HB3 ASN 37 HB3 ASN 37 -7.758 8.412 1.290
292 HD21 ASN 37 HD21 ASN 37 -7.931 6.183 -1.401
293 HD22 ASN 37 HD22 ASN 37 -9.600 5.608 -1.062
294 H GLY 38 H GLY 38 -5.943 10.734 -1.796
295 HA2 GLY 38 HA2 GLY 38 -4.949 12.745 -1.207
296 HA3 GLY 38 HA3 GLY 38 -5.929 12.807 0.242
297 H VAL 39 H VAL 39 -3.843 10.067 -0.241
298 HA VAL 39 HA VAL 39 -2.151 11.057 2.045
299 HB VAL 39 HB VAL 39 -2.632 8.237 1.096
300 HG11 VAL 39 HG11 VAL 39 -1.340 8.886 3.693
301 HG12 VAL 39 HG12 VAL 39 -0.368 9.079 2.236
302 HG13 VAL 39 HG13 VAL 39 -1.091 7.515 2.613
303 HG21 VAL 39 HG21 VAL 39 -3.981 7.945 3.012
304 HG22 VAL 39 HG22 VAL 39 -4.523 9.464 2.296
305 HG23 VAL 39 HG23 VAL 39 -3.470 9.481 3.710
306 H ASP 40 H ASP 40 -0.164 11.454 1.839
307 HA ASP 40 HA ASP 40 1.275 10.370 -0.526
308 HB2 ASP 40 HB2 ASP 40 0.399 12.551 -1.145
309 HB3 ASP 40 HB3 ASP 40 1.085 13.278 0.324
310 H GLY 41 H GLY 41 3.057 9.723 -0.289
311 HA2 GLY 41 HA2 GLY 41 4.987 10.772 1.716
312 HA3 GLY 41 HA3 GLY 41 4.131 9.336 2.225
313 H VAL 42 H VAL 42 6.056 8.530 2.724
314 HA VAL 42 HA VAL 42 7.766 7.796 0.462
315 HB VAL 42 HB VAL 42 8.225 7.699 3.441
316 HG11 VAL 42 HG11 VAL 42 9.237 5.748 2.245
317 HG12 VAL 42 HG12 VAL 42 10.399 6.800 3.054
318 HG13 VAL 42 HG13 VAL 42 10.196 6.891 1.305
319 HG21 VAL 42 HG21 VAL 42 10.227 9.174 2.566
320 HG22 VAL 42 HG22 VAL 42 8.636 9.873 2.869
321 HG23 VAL 42 HG23 VAL 42 9.126 9.474 1.224
322 H TRP 43 H TRP 43 8.042 5.696 -0.237
323 HA TRP 43 HA TRP 43 6.150 3.655 1.044
324 HB2 TRP 43 HB2 TRP 43 7.436 3.983 -1.703
325 HB3 TRP 43 HB3 TRP 43 6.577 2.507 -1.208
326 HD1 TRP 43 HD1 TRP 43 5.934 6.244 -1.916
327 HE1 TRP 43 HE1 TRP 43 3.417 6.586 -2.447
328 HE3 TRP 43 HE3 TRP 43 4.307 1.509 -0.887
329 HZ2 TRP 43 HZ2 TRP 43 1.078 4.992 -2.408
330 HZ3 TRP 43 HZ3 TRP 43 1.918 0.997 -1.159
331 HH2 TRP 43 HH2 TRP 43 0.337 2.703 -1.902
332 H THR 44 H THR 44 6.801 1.769 1.857
333 HA THR 44 HA THR 44 9.551 0.866 1.185
334 HB THR 44 HB THR 44 9.666 -0.141 3.544
335 HG1 THR 44 HG1 THR 44 7.537 1.701 3.896
336 HG21 THR 44 HG21 THR 44 10.944 1.889 2.838
337 HG22 THR 44 HG22 THR 44 10.578 1.794 4.561
338 HG23 THR 44 HG23 THR 44 9.644 2.869 3.519
339 H TYR 45 H TYR 45 9.764 -1.455 1.257
340 HA TYR 45 HA TYR 45 7.308 -2.987 1.392
341 HB2 TYR 45 HB2 TYR 45 7.673 -2.549 -0.962
342 HB3 TYR 45 HB3 TYR 45 9.346 -3.129 -0.815
343 HD1 TYR 45 HD1 TYR 45 6.136 -4.589 0.443
344 HD2 TYR 45 HD2 TYR 45 9.499 -5.034 -2.126
345 HE1 TYR 45 HE1 TYR 45 5.393 -6.862 -0.129
346 HE2 TYR 45 HE2 TYR 45 8.765 -7.309 -2.705
347 HH TYR 45 HH TYR 45 7.345 -9.110 -1.639
348 H ASP 46 H ASP 46 7.375 -4.866 2.454
349 HA ASP 46 HA ASP 46 10.059 -5.946 3.064
350 HB2 ASP 46 HB2 ASP 46 8.867 -5.220 5.112
351 HB3 ASP 46 HB3 ASP 46 7.470 -6.218 4.651
352 H ASP 47 H ASP 47 10.445 -7.548 1.671
353 HA ASP 47 HA ASP 47 8.335 -8.921 0.258
354 HB2 ASP 47 HB2 ASP 47 10.012 -9.868 -0.943
355 HB3 ASP 47 HB3 ASP 47 11.002 -8.626 -0.144
356 H ALA 48 H ALA 48 9.933 -9.702 3.381
357 HA ALA 48 HA ALA 48 9.159 -12.540 3.273
358 HB1 ALA 48 HB1 ALA 48 9.708 -10.638 5.607
359 HB2 ALA 48 HB2 ALA 48 10.874 -11.704 4.822
360 HB3 ALA 48 HB3 ALA 48 9.545 -12.386 5.760
361 H THR 49 H THR 49 7.451 -9.629 4.375
362 HA THR 49 HA THR 49 5.113 -11.461 5.157
363 HB THR 49 HB THR 49 4.168 -9.514 6.396
364 HG1 THR 49 HG1 THR 49 6.496 -8.116 5.542
365 HG21 THR 49 HG21 THR 49 5.381 -9.971 8.185
366 HG22 THR 49 HG22 THR 49 6.772 -9.114 7.524
367 HG23 THR 49 HG23 THR 49 6.531 -10.821 7.151
368 H LYS 50 H LYS 50 6.116 -9.766 2.475
369 HA LYS 50 HA LYS 50 5.010 -8.784 0.675
370 HB2 LYS 50 HB2 LYS 50 2.679 -10.526 1.637
371 HB3 LYS 50 HB3 LYS 50 2.794 -9.749 0.046
372 HG2 LYS 50 HG2 LYS 50 4.885 -11.692 1.018
373 HG3 LYS 50 HG3 LYS 50 3.390 -12.234 0.215
374 HD2 LYS 50 HD2 LYS 50 3.998 -10.611 -1.662
375 HD3 LYS 50 HD3 LYS 50 5.602 -10.493 -0.895
376 HE2 LYS 50 HE2 LYS 50 6.188 -12.622 -1.477
377 HE3 LYS 50 HE3 LYS 50 4.516 -13.227 -1.386
378 HZ1 LYS 50 HZ1 LYS 50 4.052 -12.213 -3.482
379 HZ2 LYS 50 HZ2 LYS 50 5.422 -13.133 -3.659
380 HZ3 LYS 50 HZ3 LYS 50 5.542 -11.482 -3.546
381 H THR 51 H THR 51 5.050 -7.196 2.884
382 HA THR 51 HA THR 51 2.480 -5.805 2.746
383 HB THR 51 HB THR 51 4.489 -5.928 4.985
384 HG1 THR 51 HG1 THR 51 1.824 -6.887 4.749
385 HG21 THR 51 HG21 THR 51 3.348 -3.704 4.780
386 HG22 THR 51 HG22 THR 51 3.060 -4.563 6.293
387 HG23 THR 51 HG23 THR 51 1.817 -4.541 5.041
388 H PHE 52 H PHE 52 2.328 -3.797 2.095
389 HA PHE 52 HA PHE 52 4.995 -2.288 1.539
390 HB2 PHE 52 HB2 PHE 52 2.107 -2.041 0.449
391 HB3 PHE 52 HB3 PHE 52 3.374 -0.821 0.191
392 HD1 PHE 52 HD2 PHE 52 5.332 -1.350 -1.185
393 HD2 PHE 52 HD1 PHE 52 2.120 -4.109 -0.742
394 HE1 PHE 52 HE2 PHE 52 6.139 -2.599 -3.146
395 HE2 PHE 52 HE1 PHE 52 2.921 -5.362 -2.702
396 HZ PHE 52 HZ PHE 52 4.933 -4.607 -3.907
397 H THR 53 H THR 53 5.108 -0.339 2.795
398 HA THR 53 HA THR 53 2.824 0.447 4.505
399 HB THR 53 HB THR 53 5.781 0.611 5.229
400 HG1 THR 53 HG1 THR 53 5.340 -1.373 5.806
401 HG21 THR 53 HG21 THR 53 5.298 1.872 7.004
402 HG22 THR 53 HG22 THR 53 3.792 1.014 7.333
403 HG23 THR 53 HG23 THR 53 3.831 2.294 6.121
404 H VAL 54 H VAL 54 2.306 2.600 4.429
405 HA VAL 54 HA VAL 54 4.333 4.345 2.938
406 HB VAL 54 HB VAL 54 1.387 5.050 2.871
407 HG11 VAL 54 HG11 VAL 54 2.012 6.236 0.906
408 HG12 VAL 54 HG12 VAL 54 3.560 5.397 0.804
409 HG13 VAL 54 HG13 VAL 54 3.265 6.547 2.108
410 HG21 VAL 54 HG21 VAL 54 1.340 3.848 0.601
411 HG22 VAL 54 HG22 VAL 54 1.154 2.867 2.054
412 HG23 VAL 54 HG23 VAL 54 2.703 2.911 1.212
413 H THR 55 H THR 55 5.065 5.834 4.333
414 HA THR 55 HA THR 55 3.455 6.495 6.770
415 HB THR 55 HB THR 55 6.469 6.491 6.410
416 HG1 THR 55 HG1 THR 55 4.825 4.760 7.952
417 HG21 THR 55 HG21 THR 55 4.966 6.779 8.990
418 HG22 THR 55 HG22 THR 55 5.619 8.144 8.084
419 HG23 THR 55 HG23 THR 55 6.702 6.903 8.712
420 H GLU 56 H GLU 56 2.802 8.546 6.891
421 HA GLU 56 HA GLU 56 3.886 10.613 4.982
422 HB2 GLU 56 HB2 GLU 56 1.431 10.213 5.204
423 HB3 GLU 56 HB3 GLU 56 1.534 10.679 6.912
424 HG2 GLU 56 HG2 GLU 56 2.443 12.900 6.135
425 HG3 GLU 56 HG3 GLU 56 2.016 12.400 4.482
Start of MODEL 5
1 H1 MET 1 H1 MET 1 -1.060 -13.068 -5.568
2 H2 MET 1 H2 MET 1 -2.124 -14.314 -5.180
3 H3 MET 1 H3 MET 1 -0.502 -14.654 -5.475
4 HA MET 1 HA MET 1 -1.181 -14.666 -3.114
5 HB2 MET 1 HB2 MET 1 0.946 -12.670 -3.957
6 HB3 MET 1 HB3 MET 1 0.868 -13.556 -2.422
7 HG2 MET 1 HG2 MET 1 0.886 -15.655 -4.037
8 HG3 MET 1 HG3 MET 1 1.659 -14.496 -5.143
9 HE1 MET 1 HE1 MET 1 3.246 -16.826 -1.763
10 HE2 MET 1 HE2 MET 1 1.557 -16.454 -2.109
11 HE3 MET 1 HE3 MET 1 2.471 -15.444 -0.989
12 H GLN 2 H GLN 2 -1.591 -13.411 -1.235
13 HA GLN 2 HA GLN 2 -3.069 -10.911 -1.810
14 HB2 GLN 2 HB2 GLN 2 -2.951 -12.923 0.406
15 HB3 GLN 2 HB3 GLN 2 -3.273 -11.242 0.877
16 HG2 GLN 2 HG2 GLN 2 -5.291 -11.170 -0.269
17 HG3 GLN 2 HG3 GLN 2 -4.863 -12.544 -1.315
18 HE21 GLN 2 HE21 GLN 2 -7.292 -12.266 0.098
19 HE22 GLN 2 HE22 GLN 2 -7.362 -13.587 1.315
20 H TYR 3 H TYR 3 -2.359 -8.945 -1.287
21 HA TYR 3 HA TYR 3 0.143 -8.588 0.255
22 HB2 TYR 3 HB2 TYR 3 -0.824 -6.904 -2.051
23 HB3 TYR 3 HB3 TYR 3 0.579 -6.528 -1.025
24 HD1 TYR 3 HD1 TYR 3 -0.772 -9.201 -3.266
25 HD2 TYR 3 HD2 TYR 3 2.681 -7.329 -1.625
26 HE1 TYR 3 HE1 TYR 3 0.659 -10.560 -4.733
27 HE2 TYR 3 HE2 TYR 3 4.118 -8.683 -3.090
28 HH TYR 3 HH TYR 3 3.955 -9.914 -5.208
29 H LYS 4 H LYS 4 0.202 -6.809 1.731
30 HA LYS 4 HA LYS 4 -2.416 -5.612 2.301
31 HB2 LYS 4 HB2 LYS 4 -0.166 -6.410 4.153
32 HB3 LYS 4 HB3 LYS 4 -1.560 -5.434 4.661
33 HG2 LYS 4 HG2 LYS 4 -3.047 -7.311 3.937
34 HG3 LYS 4 HG3 LYS 4 -1.586 -8.286 3.644
35 HD2 LYS 4 HD2 LYS 4 -2.253 -6.986 6.301
36 HD3 LYS 4 HD3 LYS 4 -2.680 -8.663 5.879
37 HE2 LYS 4 HE2 LYS 4 -0.373 -9.267 5.647
38 HE3 LYS 4 HE3 LYS 4 0.143 -7.570 5.791
39 HZ1 LYS 4 HZ1 LYS 4 -0.182 -7.593 8.029
40 HZ2 LYS 4 HZ2 LYS 4 0.209 -9.191 7.825
41 HZ3 LYS 4 HZ3 LYS 4 -1.378 -8.744 7.991
42 H LEU 5 H LEU 5 -2.561 -3.456 2.830
43 HA LEU 5 HA LEU 5 0.035 -1.872 2.532
44 HB2 LEU 5 HB2 LEU 5 -1.417 -1.402 0.634
45 HB3 LEU 5 HB3 LEU 5 -2.816 -1.153 1.688
46 HG LEU 5 HG LEU 5 -1.558 0.812 2.704
47 HD11 LEU 5 HD11 LEU 5 0.683 0.321 2.053
48 HD12 LEU 5 HD12 LEU 5 0.195 1.786 1.202
49 HD13 LEU 5 HD13 LEU 5 0.240 0.244 0.348
50 HD21 LEU 5 HD21 LEU 5 -2.265 2.307 0.996
51 HD22 LEU 5 HD22 LEU 5 -3.378 0.939 0.966
52 HD23 LEU 5 HD23 LEU 5 -2.110 1.070 -0.251
53 H VAL 6 H VAL 6 0.425 -0.833 4.424
54 HA VAL 6 HA VAL 6 -1.689 -0.321 6.374
55 HB VAL 6 HB VAL 6 1.310 -0.388 6.831
56 HG11 VAL 6 HG11 VAL 6 0.911 0.130 9.083
57 HG12 VAL 6 HG12 VAL 6 -0.819 -0.189 8.950
58 HG13 VAL 6 HG13 VAL 6 -0.126 1.244 8.192
59 HG21 VAL 6 HG21 VAL 6 -0.878 -2.368 7.362
60 HG22 VAL 6 HG22 VAL 6 0.540 -2.308 8.410
61 HG23 VAL 6 HG23 VAL 6 0.731 -2.623 6.685
62 H ILE 7 H ILE 7 -2.336 1.728 6.609
63 HA ILE 7 HA ILE 7 -0.551 3.864 5.261
64 HB ILE 7 HB ILE 7 -3.537 3.983 5.930
65 HG12 ILE 7 HG12 ILE 7 -2.132 3.927 3.232
66 HG13 ILE 7 HG13 ILE 7 -2.915 2.520 3.982
67 HG21 ILE 7 HG21 ILE 7 -3.200 6.096 4.423
68 HG22 ILE 7 HG22 ILE 7 -1.528 5.984 4.973
69 HG23 ILE 7 HG23 ILE 7 -2.833 6.167 6.145
70 HD11 ILE 7 HD11 ILE 7 -4.343 3.567 2.312
71 HD12 ILE 7 HD12 ILE 7 -4.284 5.091 3.197
72 HD13 ILE 7 HD13 ILE 7 -5.058 3.681 3.920
73 H ASN 8 H ASN 8 0.635 4.871 6.749
74 HA ASN 8 HA ASN 8 -0.544 5.355 9.493
75 HB2 ASN 8 HB2 ASN 8 1.548 3.939 9.332
76 HB3 ASN 8 HB3 ASN 8 2.396 5.348 8.658
77 HD21 ASN 8 HD21 ASN 8 3.384 4.201 10.883
78 HD22 ASN 8 HD22 ASN 8 3.080 5.259 12.306
79 H GLY 9 H GLY 9 -1.756 7.135 8.423
80 HA2 GLY 9 HA2 GLY 9 -0.280 9.409 7.274
81 HA3 GLY 9 HA3 GLY 9 -1.974 9.129 7.249
82 H LYS 10 H LYS 10 -1.157 11.638 7.920
83 HA LYS 10 HA LYS 10 -0.897 12.035 10.799
84 HB2 LYS 10 HB2 LYS 10 -0.156 13.601 8.997
85 HB3 LYS 10 HB3 LYS 10 -1.864 13.926 8.639
86 HG2 LYS 10 HG2 LYS 10 -2.180 15.151 10.543
87 HG3 LYS 10 HG3 LYS 10 -0.942 14.257 11.457
88 HD2 LYS 10 HD2 LYS 10 -0.022 16.402 11.119
89 HD3 LYS 10 HD3 LYS 10 0.766 15.364 9.906
90 HE2 LYS 10 HE2 LYS 10 -0.621 16.208 8.159
91 HE3 LYS 10 HE3 LYS 10 -1.693 17.030 9.318
92 HZ1 LYS 10 HZ1 LYS 10 1.059 17.757 8.550
93 HZ2 LYS 10 HZ2 LYS 10 0.361 18.345 9.935
94 HZ3 LYS 10 HZ3 LYS 10 -0.318 18.682 8.460
95 H THR 11 H THR 11 -3.445 12.020 8.538
96 HA THR 11 HA THR 11 -5.551 12.266 10.621
97 HB THR 11 HB THR 11 -7.031 13.201 8.943
98 HG1 THR 11 HG1 THR 11 -6.366 13.485 6.977
99 HG21 THR 11 HG21 THR 11 -4.531 14.723 9.643
100 HG22 THR 11 HG22 THR 11 -6.107 14.776 10.434
101 HG23 THR 11 HG23 THR 11 -5.908 15.452 8.818
102 H LEU 12 H LEU 12 -4.514 10.208 8.010
103 HA LEU 12 HA LEU 12 -6.880 8.555 8.637
104 HB2 LEU 12 HB2 LEU 12 -6.906 9.383 6.325
105 HB3 LEU 12 HB3 LEU 12 -5.285 8.720 6.071
106 HG LEU 12 HG LEU 12 -6.174 6.436 6.415
107 HD11 LEU 12 HD11 LEU 12 -8.045 7.038 7.894
108 HD12 LEU 12 HD12 LEU 12 -8.565 6.053 6.526
109 HD13 LEU 12 HD13 LEU 12 -8.874 7.789 6.530
110 HD21 LEU 12 HD21 LEU 12 -7.709 8.003 4.335
111 HD22 LEU 12 HD22 LEU 12 -7.358 6.275 4.309
112 HD23 LEU 12 HD23 LEU 12 -6.045 7.445 4.163
113 H LYS 13 H LYS 13 -6.505 6.674 9.641
114 HA LYS 13 HA LYS 13 -3.873 5.402 9.184
115 HB2 LYS 13 HB2 LYS 13 -5.415 5.478 11.772
116 HB3 LYS 13 HB3 LYS 13 -3.897 4.602 11.499
117 HG2 LYS 13 HG2 LYS 13 -2.962 6.938 10.835
118 HG3 LYS 13 HG3 LYS 13 -4.382 7.557 11.715
119 HD2 LYS 13 HD2 LYS 13 -3.695 6.435 13.734
120 HD3 LYS 13 HD3 LYS 13 -2.379 5.596 12.874
121 HE2 LYS 13 HE2 LYS 13 -2.562 8.610 13.066
122 HE3 LYS 13 HE3 LYS 13 -1.720 7.616 14.277
123 HZ1 LYS 13 HZ1 LYS 13 -0.251 6.829 12.581
124 HZ2 LYS 13 HZ2 LYS 13 -0.251 8.486 12.535
125 HZ3 LYS 13 HZ3 LYS 13 -1.084 7.627 11.386
126 H GLY 14 H GLY 14 -4.019 3.134 8.536
127 HA2 GLY 14 HA2 GLY 14 -5.861 1.373 9.547
128 HA3 GLY 14 HA3 GLY 14 -6.718 1.951 8.139
129 H GLU 15 H GLU 15 -6.667 -0.183 7.502
130 HA GLU 15 HA GLU 15 -4.187 -0.875 6.044
131 HB2 GLU 15 HB2 GLU 15 -4.736 -3.304 6.787
132 HB3 GLU 15 HB3 GLU 15 -3.899 -2.221 7.917
133 HG2 GLU 15 HG2 GLU 15 -6.141 -1.687 8.920
134 HG3 GLU 15 HG3 GLU 15 -6.826 -2.976 7.903
135 H THR 16 H THR 16 -4.486 -2.154 4.107
136 HA THR 16 HA THR 16 -7.202 -3.121 3.619
137 HB THR 16 HB THR 16 -6.985 -2.183 1.175
138 HG1 THR 16 HG1 THR 16 -5.179 -1.035 1.150
139 HG21 THR 16 HG21 THR 16 -8.738 -1.564 2.929
140 HG22 THR 16 HG22 THR 16 -8.435 -0.415 1.626
141 HG23 THR 16 HG23 THR 16 -7.753 -0.132 3.227
142 H THR 17 H THR 17 -7.150 -4.376 1.434
143 HA THR 17 HA THR 17 -4.519 -5.628 1.113
144 HB THR 17 HB THR 17 -5.923 -6.913 2.780
145 HG1 THR 17 HG1 THR 17 -5.172 -8.180 0.346
146 HG21 THR 17 HG21 THR 17 -7.833 -7.999 2.196
147 HG22 THR 17 HG22 THR 17 -7.436 -8.025 0.477
148 HG23 THR 17 HG23 THR 17 -8.021 -6.540 1.224
149 H THR 18 H THR 18 -4.323 -6.844 -0.842
150 HA THR 18 HA THR 18 -6.553 -6.629 -2.738
151 HB THR 18 HB THR 18 -5.097 -4.535 -3.126
152 HG1 THR 18 HG1 THR 18 -6.409 -5.123 -4.777
153 HG21 THR 18 HG21 THR 18 -3.244 -6.147 -4.749
154 HG22 THR 18 HG22 THR 18 -2.961 -6.176 -3.007
155 HG23 THR 18 HG23 THR 18 -2.983 -4.639 -3.874
156 H LYS 19 H LYS 19 -6.177 -8.032 -4.633
157 HA LYS 19 HA LYS 19 -4.243 -10.199 -3.998
158 HB2 LYS 19 HB2 LYS 19 -6.724 -10.224 -5.755
159 HB3 LYS 19 HB3 LYS 19 -5.650 -11.604 -5.461
160 HG2 LYS 19 HG2 LYS 19 -6.684 -10.378 -3.002
161 HG3 LYS 19 HG3 LYS 19 -7.955 -11.015 -4.074
162 HD2 LYS 19 HD2 LYS 19 -5.514 -12.596 -3.218
163 HD3 LYS 19 HD3 LYS 19 -7.078 -12.647 -2.367
164 HE2 LYS 19 HE2 LYS 19 -6.980 -13.147 -5.327
165 HE3 LYS 19 HE3 LYS 19 -6.489 -14.436 -4.203
166 HZ1 LYS 19 HZ1 LYS 19 -8.741 -13.811 -3.088
167 HZ2 LYS 19 HZ2 LYS 19 -8.711 -14.827 -4.399
168 HZ3 LYS 19 HZ3 LYS 19 -9.123 -13.233 -4.597
169 H ALA 20 H ALA 20 -2.533 -10.480 -5.444
170 HA ALA 20 HA ALA 20 -2.805 -9.487 -8.110
171 HB1 ALA 20 HB1 ALA 20 -0.589 -8.213 -7.925
172 HB2 ALA 20 HB2 ALA 20 -0.820 -8.285 -6.178
173 HB3 ALA 20 HB3 ALA 20 -1.993 -7.440 -7.190
174 H VAL 21 H VAL 21 -1.191 -10.238 -9.607
175 HA VAL 21 HA VAL 21 -0.023 -12.646 -8.835
176 HB VAL 21 HB VAL 21 0.971 -12.792 -11.039
177 HG11 VAL 21 HG11 VAL 21 -1.469 -13.264 -10.589
178 HG12 VAL 21 HG12 VAL 21 -1.065 -12.867 -12.259
179 HG13 VAL 21 HG13 VAL 21 -1.818 -11.655 -11.222
180 HG21 VAL 21 HG21 VAL 21 -0.155 -10.033 -11.528
181 HG22 VAL 21 HG22 VAL 21 0.869 -10.997 -12.593
182 HG23 VAL 21 HG23 VAL 21 1.533 -10.322 -11.104
183 H ASP 22 H ASP 22 1.399 -9.438 -8.755
184 HA ASP 22 HA ASP 22 3.754 -10.623 -7.563
185 HB2 ASP 22 HB2 ASP 22 5.356 -9.602 -9.159
186 HB3 ASP 22 HB3 ASP 22 4.327 -10.821 -9.943
187 H ALA 23 H ALA 23 5.351 -8.898 -6.822
188 HA ALA 23 HA ALA 23 3.801 -7.127 -5.231
189 HB1 ALA 23 HB1 ALA 23 5.810 -7.839 -4.286
190 HB2 ALA 23 HB2 ALA 23 6.085 -6.139 -4.666
191 HB3 ALA 23 HB3 ALA 23 6.746 -7.393 -5.714
192 H GLU 24 H GLU 24 5.646 -6.594 -8.252
193 HA GLU 24 HA GLU 24 5.528 -3.685 -8.041
194 HB2 GLU 24 HB2 GLU 24 5.725 -5.694 -10.347
195 HB3 GLU 24 HB3 GLU 24 5.697 -3.946 -10.649
196 HG2 GLU 24 HG2 GLU 24 7.651 -3.791 -9.015
197 HG3 GLU 24 HG3 GLU 24 7.754 -5.562 -9.150
198 H THR 25 H THR 25 3.214 -6.011 -9.536
199 HA THR 25 HA THR 25 1.529 -3.848 -10.628
200 HB THR 25 HB THR 25 0.799 -6.738 -9.910
201 HG1 THR 25 HG1 THR 25 1.901 -7.104 -11.650
202 HG21 THR 25 HG21 THR 25 -0.734 -4.607 -11.361
203 HG22 THR 25 HG22 THR 25 -1.272 -5.686 -10.074
204 HG23 THR 25 HG23 THR 25 -0.986 -6.321 -11.694
205 H ALA 26 H ALA 26 1.606 -5.640 -7.447
206 HA ALA 26 HA ALA 26 -0.792 -4.366 -6.369
207 HB1 ALA 26 HB1 ALA 26 0.505 -6.298 -5.330
208 HB2 ALA 26 HB2 ALA 26 -0.020 -5.037 -4.216
209 HB3 ALA 26 HB3 ALA 26 1.659 -5.095 -4.753
210 H GLU 27 H GLU 27 2.605 -3.229 -6.776
211 HA GLU 27 HA GLU 27 2.253 -0.945 -5.203
212 HB2 GLU 27 HB2 GLU 27 4.444 -1.774 -5.971
213 HB3 GLU 27 HB3 GLU 27 4.065 -1.206 -7.609
214 HG2 GLU 27 HG2 GLU 27 3.761 1.104 -6.571
215 HG3 GLU 27 HG3 GLU 27 4.528 0.428 -5.116
216 H LYS 28 H LYS 28 1.728 -1.284 -8.715
217 HA LYS 28 HA LYS 28 1.012 1.475 -9.141
218 HB2 LYS 28 HB2 LYS 28 -0.041 -0.941 -10.628
219 HB3 LYS 28 HB3 LYS 28 -0.028 0.741 -11.194
220 HG2 LYS 28 HG2 LYS 28 2.385 0.744 -11.285
221 HG3 LYS 28 HG3 LYS 28 2.449 -0.886 -10.570
222 HD2 LYS 28 HD2 LYS 28 1.658 -1.904 -12.503
223 HD3 LYS 28 HD3 LYS 28 0.898 -0.409 -13.103
224 HE2 LYS 28 HE2 LYS 28 3.008 0.524 -13.703
225 HE3 LYS 28 HE3 LYS 28 3.893 -0.745 -12.826
226 HZ1 LYS 28 HZ1 LYS 28 3.026 -2.346 -14.431
227 HZ2 LYS 28 HZ2 LYS 28 3.916 -1.165 -15.183
228 HZ3 LYS 28 HZ3 LYS 28 2.260 -1.131 -15.265
229 H ALA 29 H ALA 29 -1.021 -1.354 -8.136
230 HA ALA 29 HA ALA 29 -3.498 0.222 -8.307
231 HB1 ALA 29 HB1 ALA 29 -4.516 -1.588 -7.054
232 HB2 ALA 29 HB2 ALA 29 -2.944 -2.197 -6.536
233 HB3 ALA 29 HB3 ALA 29 -3.412 -2.297 -8.234
234 H PHE 30 H PHE 30 -1.237 -0.556 -5.532
235 HA PHE 30 HA PHE 30 -2.862 0.855 -3.615
236 HB2 PHE 30 HB2 PHE 30 0.062 0.018 -3.682
237 HB3 PHE 30 HB3 PHE 30 -0.683 0.817 -2.281
238 HD1 PHE 30 HD1 PHE 30 -3.263 -0.440 -2.034
239 HD2 PHE 30 HD2 PHE 30 0.468 -2.172 -3.129
240 HE1 PHE 30 HE1 PHE 30 -4.038 -2.623 -1.202
241 HE2 PHE 30 HE2 PHE 30 -0.300 -4.356 -2.301
242 HZ PHE 30 HZ PHE 30 -2.555 -4.584 -1.334
243 H LYS 31 H LYS 31 -0.189 1.987 -5.774
244 HA LYS 31 HA LYS 31 -0.121 4.615 -4.462
245 HB2 LYS 31 HB2 LYS 31 0.594 3.711 -7.270
246 HB3 LYS 31 HB3 LYS 31 0.736 5.398 -6.737
247 HG2 LYS 31 HG2 LYS 31 2.105 4.267 -4.755
248 HG3 LYS 31 HG3 LYS 31 2.354 3.007 -5.988
249 HD2 LYS 31 HD2 LYS 31 3.123 4.815 -7.556
250 HD3 LYS 31 HD3 LYS 31 3.051 5.951 -6.186
251 HE2 LYS 31 HE2 LYS 31 4.851 4.993 -5.119
252 HE3 LYS 31 HE3 LYS 31 4.576 3.397 -5.857
253 HZ1 LYS 31 HZ1 LYS 31 5.562 5.756 -7.347
254 HZ2 LYS 31 HZ2 LYS 31 5.465 4.195 -7.899
255 HZ3 LYS 31 HZ3 LYS 31 6.550 4.585 -6.707
256 H GLN 32 H GLN 32 -2.270 3.259 -6.939
257 HA GLN 32 HA GLN 32 -3.568 5.802 -7.441
258 HB2 GLN 32 HB2 GLN 32 -3.785 4.000 -9.056
259 HB3 GLN 32 HB3 GLN 32 -4.506 2.933 -7.835
260 HG2 GLN 32 HG2 GLN 32 -6.501 4.235 -7.757
261 HG3 GLN 32 HG3 GLN 32 -5.768 5.526 -8.737
262 HE21 GLN 32 HE21 GLN 32 -6.129 5.526 -10.837
263 HE22 GLN 32 HE22 GLN 32 -6.745 4.123 -11.779
264 H TYR 33 H TYR 33 -4.356 3.117 -5.231
265 HA TYR 33 HA TYR 33 -6.773 4.279 -4.187
266 HB2 TYR 33 HB2 TYR 33 -6.024 1.919 -3.773
267 HB3 TYR 33 HB3 TYR 33 -4.652 2.537 -2.829
268 HD1 TYR 33 HD2 TYR 33 -5.160 3.826 -0.694
269 HD2 TYR 33 HD1 TYR 33 -8.106 1.555 -2.759
270 HE1 TYR 33 HE2 TYR 33 -6.542 3.778 1.340
271 HE2 TYR 33 HE1 TYR 33 -9.496 1.503 -0.731
272 HH TYR 33 HH TYR 33 -8.656 1.838 2.087
273 H ALA 34 H ALA 34 -3.406 4.637 -3.017
274 HA ALA 34 HA ALA 34 -3.970 6.403 -0.879
275 HB1 ALA 34 HB1 ALA 34 -1.740 5.236 -1.562
276 HB2 ALA 34 HB2 ALA 34 -1.695 6.806 -0.760
277 HB3 ALA 34 HB3 ALA 34 -1.485 6.702 -2.508
278 H ASN 35 H ASN 35 -3.265 7.144 -4.297
279 HA ASN 35 HA ASN 35 -3.401 10.030 -3.844
280 HB2 ASN 35 HB2 ASN 35 -2.432 8.931 -5.894
281 HB3 ASN 35 HB3 ASN 35 -4.068 8.441 -6.386
282 HD21 ASN 35 HD21 ASN 35 -2.938 9.740 -8.257
283 HD22 ASN 35 HD22 ASN 35 -3.429 11.468 -8.323
284 H ASP 36 H ASP 36 -6.000 7.657 -4.776
285 HA ASP 36 HA ASP 36 -8.005 9.696 -5.125
286 HB2 ASP 36 HB2 ASP 36 -8.266 6.765 -4.433
287 HB3 ASP 36 HB3 ASP 36 -9.660 7.835 -4.700
288 H ASN 37 H ASN 37 -6.635 8.362 -2.204
289 HA ASN 37 HA ASN 37 -8.823 9.711 -0.652
290 HB2 ASN 37 HB2 ASN 37 -6.851 7.530 0.044
291 HB3 ASN 37 HB3 ASN 37 -7.761 8.411 1.290
292 HD21 ASN 37 HD21 ASN 37 -7.923 6.183 -1.402
293 HD22 ASN 37 HD22 ASN 37 -9.592 5.604 -1.067
294 H GLY 38 H GLY 38 -5.943 10.734 -1.796
295 HA2 GLY 38 HA2 GLY 38 -4.949 12.745 -1.207
296 HA3 GLY 38 HA3 GLY 38 -5.929 12.807 0.242
297 H VAL 39 H VAL 39 -3.843 10.067 -0.241
298 HA VAL 39 HA VAL 39 -2.151 11.057 2.045
299 HB VAL 39 HB VAL 39 -2.628 8.236 1.096
300 HG11 VAL 39 HG11 VAL 39 -1.346 8.889 3.697
301 HG12 VAL 39 HG12 VAL 39 -0.369 9.083 2.243
302 HG13 VAL 39 HG13 VAL 39 -1.091 7.518 2.618
303 HG21 VAL 39 HG21 VAL 39 -3.983 7.943 3.008
304 HG22 VAL 39 HG22 VAL 39 -4.525 9.461 2.289
305 HG23 VAL 39 HG23 VAL 39 -3.477 9.480 3.706
306 H ASP 40 H ASP 40 -0.164 11.454 1.839
307 HA ASP 40 HA ASP 40 1.275 10.370 -0.526
308 HB2 ASP 40 HB2 ASP 40 0.264 12.993 -0.256
309 HB3 ASP 40 HB3 ASP 40 2.019 13.115 -0.004
310 H GLY 41 H GLY 41 3.057 9.723 -0.289
311 HA2 GLY 41 HA2 GLY 41 4.987 10.772 1.716
312 HA3 GLY 41 HA3 GLY 41 4.131 9.336 2.225
313 H VAL 42 H VAL 42 6.056 8.530 2.724
314 HA VAL 42 HA VAL 42 7.766 7.796 0.462
315 HB VAL 42 HB VAL 42 8.224 7.701 3.441
316 HG11 VAL 42 HG11 VAL 42 9.234 5.747 2.248
317 HG12 VAL 42 HG12 VAL 42 10.397 6.799 3.056
318 HG13 VAL 42 HG13 VAL 42 10.195 6.887 1.307
319 HG21 VAL 42 HG21 VAL 42 10.228 9.172 2.564
320 HG22 VAL 42 HG22 VAL 42 8.639 9.874 2.865
321 HG23 VAL 42 HG23 VAL 42 9.129 9.471 1.222
322 H TRP 43 H TRP 43 8.042 5.696 -0.237
323 HA TRP 43 HA TRP 43 6.150 3.655 1.044
324 HB2 TRP 43 HB2 TRP 43 7.436 3.982 -1.703
325 HB3 TRP 43 HB3 TRP 43 6.576 2.507 -1.208
326 HD1 TRP 43 HD1 TRP 43 5.937 6.244 -1.917
327 HE1 TRP 43 HE1 TRP 43 3.420 6.589 -2.449
328 HE3 TRP 43 HE3 TRP 43 4.305 1.512 -0.886
329 HZ2 TRP 43 HZ2 TRP 43 1.080 4.997 -2.410
330 HZ3 TRP 43 HZ3 TRP 43 1.915 1.002 -1.159
331 HH2 TRP 43 HH2 TRP 43 0.336 2.710 -1.903
332 H THR 44 H THR 44 6.801 1.769 1.857
333 HA THR 44 HA THR 44 9.551 0.866 1.185
334 HB THR 44 HB THR 44 9.667 -0.141 3.544
335 HG1 THR 44 HG1 THR 44 7.536 1.700 3.896
336 HG21 THR 44 HG21 THR 44 10.943 1.890 2.838
337 HG22 THR 44 HG22 THR 44 10.577 1.794 4.561
338 HG23 THR 44 HG23 THR 44 9.643 2.869 3.520
339 H TYR 45 H TYR 45 9.764 -1.455 1.257
340 HA TYR 45 HA TYR 45 7.308 -2.987 1.392
341 HB2 TYR 45 HB2 TYR 45 7.672 -2.550 -0.961
342 HB3 TYR 45 HB3 TYR 45 9.346 -3.127 -0.815
343 HD1 TYR 45 HD1 TYR 45 6.139 -4.593 0.444
344 HD2 TYR 45 HD2 TYR 45 9.501 -5.032 -2.126
345 HE1 TYR 45 HE1 TYR 45 5.400 -6.867 -0.128
346 HE2 TYR 45 HE2 TYR 45 8.772 -7.309 -2.705
347 HH TYR 45 HH TYR 45 7.356 -9.112 -1.639
348 H ASP 46 H ASP 46 7.375 -4.866 2.454
349 HA ASP 46 HA ASP 46 10.059 -5.946 3.064
350 HB2 ASP 46 HB2 ASP 46 8.864 -5.219 5.111
351 HB3 ASP 46 HB3 ASP 46 7.471 -6.221 4.651
352 H ASP 47 H ASP 47 10.445 -7.548 1.671
353 HA ASP 47 HA ASP 47 8.335 -8.921 0.258
354 HB2 ASP 47 HB2 ASP 47 10.704 -8.632 -0.545
355 HB3 ASP 47 HB3 ASP 47 11.205 -9.849 0.650
356 H ALA 48 H ALA 48 9.933 -9.702 3.381
357 HA ALA 48 HA ALA 48 9.159 -12.540 3.273
358 HB1 ALA 48 HB1 ALA 48 9.708 -10.638 5.607
359 HB2 ALA 48 HB2 ALA 48 10.874 -11.704 4.822
360 HB3 ALA 48 HB3 ALA 48 9.545 -12.386 5.760
361 H THR 49 H THR 49 7.451 -9.629 4.375
362 HA THR 49 HA THR 49 5.113 -11.461 5.157
363 HB THR 49 HB THR 49 4.168 -9.513 6.394
364 HG1 THR 49 HG1 THR 49 6.498 -8.118 5.544
365 HG21 THR 49 HG21 THR 49 5.377 -9.972 8.185
366 HG22 THR 49 HG22 THR 49 6.771 -9.117 7.526
367 HG23 THR 49 HG23 THR 49 6.527 -10.823 7.152
368 H LYS 50 H LYS 50 6.116 -9.766 2.475
369 HA LYS 50 HA LYS 50 5.010 -8.784 0.675
370 HB2 LYS 50 HB2 LYS 50 2.679 -10.526 1.637
371 HB3 LYS 50 HB3 LYS 50 2.794 -9.749 0.046
372 HG2 LYS 50 HG2 LYS 50 4.885 -11.692 1.017
373 HG3 LYS 50 HG3 LYS 50 3.391 -12.234 0.214
374 HD2 LYS 50 HD2 LYS 50 3.998 -10.610 -1.662
375 HD3 LYS 50 HD3 LYS 50 5.601 -10.492 -0.895
376 HE2 LYS 50 HE2 LYS 50 6.187 -12.621 -1.478
377 HE3 LYS 50 HE3 LYS 50 4.516 -13.226 -1.387
378 HZ1 LYS 50 HZ1 LYS 50 4.051 -12.212 -3.483
379 HZ2 LYS 50 HZ2 LYS 50 5.421 -13.131 -3.661
380 HZ3 LYS 50 HZ3 LYS 50 5.541 -11.481 -3.547
381 H THR 51 H THR 51 5.050 -7.196 2.884
382 HA THR 51 HA THR 51 2.480 -5.805 2.746
383 HB THR 51 HB THR 51 4.489 -5.929 4.985
384 HG1 THR 51 HG1 THR 51 1.823 -6.885 4.749
385 HG21 THR 51 HG21 THR 51 3.350 -3.704 4.780
386 HG22 THR 51 HG22 THR 51 3.061 -4.563 6.293
387 HG23 THR 51 HG23 THR 51 1.819 -4.539 5.042
388 H PHE 52 H PHE 52 2.328 -3.797 2.095
389 HA PHE 52 HA PHE 52 4.995 -2.288 1.539
390 HB2 PHE 52 HB2 PHE 52 2.107 -2.045 0.448
391 HB3 PHE 52 HB3 PHE 52 3.370 -0.820 0.193
392 HD1 PHE 52 HD2 PHE 52 5.331 -1.339 -1.181
393 HD2 PHE 52 HD1 PHE 52 2.130 -4.111 -0.748
394 HE1 PHE 52 HE2 PHE 52 6.146 -2.581 -3.144
395 HE2 PHE 52 HE1 PHE 52 2.938 -5.357 -2.710
396 HZ PHE 52 HZ PHE 52 4.949 -4.592 -3.910
397 H THR 53 H THR 53 5.108 -0.339 2.795
398 HA THR 53 HA THR 53 2.824 0.447 4.505
399 HB THR 53 HB THR 53 5.782 0.609 5.228
400 HG1 THR 53 HG1 THR 53 5.337 -1.373 5.809
401 HG21 THR 53 HG21 THR 53 5.301 1.873 7.002
402 HG22 THR 53 HG22 THR 53 3.793 1.019 7.333
403 HG23 THR 53 HG23 THR 53 3.835 2.297 6.119
404 H VAL 54 H VAL 54 2.306 2.600 4.429
405 HA VAL 54 HA VAL 54 4.333 4.345 2.938
406 HB VAL 54 HB VAL 54 2.367 4.027 1.471
407 HG11 VAL 54 HG11 VAL 54 0.142 4.605 2.081
408 HG12 VAL 54 HG12 VAL 54 0.662 5.273 3.628
409 HG13 VAL 54 HG13 VAL 54 0.753 3.536 3.343
410 HG21 VAL 54 HG21 VAL 54 1.640 6.490 1.407
411 HG22 VAL 54 HG22 VAL 54 3.358 6.137 1.232
412 HG23 VAL 54 HG23 VAL 54 2.730 6.716 2.774
413 H THR 55 H THR 55 5.065 5.834 4.333
414 HA THR 55 HA THR 55 3.455 6.495 6.770
415 HB THR 55 HB THR 55 6.468 6.490 6.409
416 HG1 THR 55 HG1 THR 55 4.824 4.760 7.953
417 HG21 THR 55 HG21 THR 55 4.966 6.780 8.990
418 HG22 THR 55 HG22 THR 55 5.620 8.144 8.083
419 HG23 THR 55 HG23 THR 55 6.702 6.903 8.711
420 H GLU 56 H GLU 56 2.802 8.546 6.891
421 HA GLU 56 HA GLU 56 3.886 10.613 4.982
422 HB2 GLU 56 HB2 GLU 56 1.432 10.215 5.201
423 HB3 GLU 56 HB3 GLU 56 1.533 10.675 6.911
424 HG2 GLU 56 HG2 GLU 56 2.636 12.856 5.883
425 HG3 GLU 56 HG3 GLU 56 1.696 12.355 4.459
Start of MODEL 6
1 H1 MET 1 H1 MET 1 -1.060 -13.068 -5.568
2 H2 MET 1 H2 MET 1 -2.124 -14.314 -5.180
3 H3 MET 1 H3 MET 1 -0.502 -14.654 -5.475
4 HA MET 1 HA MET 1 -1.181 -14.666 -3.114
5 HB2 MET 1 HB2 MET 1 0.946 -12.669 -3.955
6 HB3 MET 1 HB3 MET 1 0.868 -13.559 -2.422
7 HG2 MET 1 HG2 MET 1 0.985 -15.680 -3.861
8 HG3 MET 1 HG3 MET 1 1.484 -14.599 -5.182
9 HE1 MET 1 HE1 MET 1 3.840 -16.615 -2.148
10 HE2 MET 1 HE2 MET 1 2.083 -16.493 -2.247
11 HE3 MET 1 HE3 MET 1 2.986 -15.399 -1.199
12 H GLN 2 H GLN 2 -1.591 -13.411 -1.235
13 HA GLN 2 HA GLN 2 -3.069 -10.911 -1.810
14 HB2 GLN 2 HB2 GLN 2 -4.142 -12.577 -0.336
15 HB3 GLN 2 HB3 GLN 2 -2.720 -12.571 0.726
16 HG2 GLN 2 HG2 GLN 2 -3.206 -10.060 1.022
17 HG3 GLN 2 HG3 GLN 2 -4.804 -10.435 0.333
18 HE21 GLN 2 HE21 GLN 2 -4.065 -9.469 3.000
19 HE22 GLN 2 HE22 GLN 2 -4.712 -10.693 4.147
20 H TYR 3 H TYR 3 -2.359 -8.945 -1.287
21 HA TYR 3 HA TYR 3 0.143 -8.588 0.255
22 HB2 TYR 3 HB2 TYR 3 -0.824 -6.905 -2.052
23 HB3 TYR 3 HB3 TYR 3 0.578 -6.527 -1.025
24 HD1 TYR 3 HD1 TYR 3 -0.769 -9.203 -3.266
25 HD2 TYR 3 HD2 TYR 3 2.681 -7.326 -1.622
26 HE1 TYR 3 HE1 TYR 3 0.665 -10.561 -4.730
27 HE2 TYR 3 HE2 TYR 3 4.121 -8.680 -3.086
28 HH TYR 3 HH TYR 3 3.961 -9.912 -5.203
29 H LYS 4 H LYS 4 0.202 -6.809 1.731
30 HA LYS 4 HA LYS 4 -2.416 -5.612 2.301
31 HB2 LYS 4 HB2 LYS 4 -1.652 -7.201 4.021
32 HB3 LYS 4 HB3 LYS 4 -0.157 -6.261 4.206
33 HG2 LYS 4 HG2 LYS 4 -1.556 -4.301 4.885
34 HG3 LYS 4 HG3 LYS 4 -2.976 -5.376 4.865
35 HD2 LYS 4 HD2 LYS 4 -0.485 -5.889 6.516
36 HD3 LYS 4 HD3 LYS 4 -1.929 -5.047 7.131
37 HE2 LYS 4 HE2 LYS 4 -3.291 -6.992 6.797
38 HE3 LYS 4 HE3 LYS 4 -1.983 -7.826 5.925
39 HZ1 LYS 4 HZ1 LYS 4 -0.893 -8.274 7.854
40 HZ2 LYS 4 HZ2 LYS 4 -2.441 -8.276 8.446
41 HZ3 LYS 4 HZ3 LYS 4 -1.475 -6.946 8.663
42 H LEU 5 H LEU 5 -2.561 -3.456 2.830
43 HA LEU 5 HA LEU 5 0.035 -1.872 2.532
44 HB2 LEU 5 HB2 LEU 5 -1.419 -1.403 0.634
45 HB3 LEU 5 HB3 LEU 5 -2.816 -1.151 1.690
46 HG LEU 5 HG LEU 5 -1.554 0.813 2.702
47 HD11 LEU 5 HD11 LEU 5 0.686 0.318 2.048
48 HD12 LEU 5 HD12 LEU 5 0.199 1.782 1.197
49 HD13 LEU 5 HD13 LEU 5 0.240 0.240 0.344
50 HD21 LEU 5 HD21 LEU 5 -2.260 2.307 0.993
51 HD22 LEU 5 HD22 LEU 5 -3.375 0.941 0.966
52 HD23 LEU 5 HD23 LEU 5 -2.109 1.068 -0.253
53 H VAL 6 H VAL 6 0.425 -0.833 4.424
54 HA VAL 6 HA VAL 6 -1.689 -0.321 6.374
55 HB VAL 6 HB VAL 6 1.310 -0.388 6.831
56 HG11 VAL 6 HG11 VAL 6 0.910 0.129 9.084
57 HG12 VAL 6 HG12 VAL 6 -0.820 -0.190 8.950
58 HG13 VAL 6 HG13 VAL 6 -0.127 1.244 8.192
59 HG21 VAL 6 HG21 VAL 6 -0.877 -2.368 7.361
60 HG22 VAL 6 HG22 VAL 6 0.541 -2.308 8.409
61 HG23 VAL 6 HG23 VAL 6 0.732 -2.623 6.684
62 H ILE 7 H ILE 7 -2.336 1.728 6.609
63 HA ILE 7 HA ILE 7 -0.551 3.864 5.261
64 HB ILE 7 HB ILE 7 -3.537 3.985 5.931
65 HG12 ILE 7 HG12 ILE 7 -2.134 3.924 3.232
66 HG13 ILE 7 HG13 ILE 7 -2.917 2.518 3.985
67 HG21 ILE 7 HG21 ILE 7 -3.199 6.095 4.421
68 HG22 ILE 7 HG22 ILE 7 -1.527 5.983 4.970
69 HG23 ILE 7 HG23 ILE 7 -2.831 6.168 6.143
70 HD11 ILE 7 HD11 ILE 7 -4.345 3.564 2.313
71 HD12 ILE 7 HD12 ILE 7 -4.285 5.090 3.197
72 HD13 ILE 7 HD13 ILE 7 -5.059 3.681 3.922
73 H ASN 8 H ASN 8 0.635 4.871 6.749
74 HA ASN 8 HA ASN 8 -0.544 5.355 9.493
75 HB2 ASN 8 HB2 ASN 8 2.360 5.138 8.552
76 HB3 ASN 8 HB3 ASN 8 1.859 5.608 10.192
77 HD21 ASN 8 HD21 ASN 8 2.496 3.963 11.415
78 HD22 ASN 8 HD22 ASN 8 2.011 2.252 11.147
79 H GLY 9 H GLY 9 -1.756 7.135 8.423
80 HA2 GLY 9 HA2 GLY 9 -0.280 9.409 7.274
81 HA3 GLY 9 HA3 GLY 9 -1.974 9.129 7.249
82 H LYS 10 H LYS 10 -1.157 11.638 7.920
83 HA LYS 10 HA LYS 10 -0.897 12.035 10.799
84 HB2 LYS 10 HB2 LYS 10 -1.706 13.833 8.499
85 HB3 LYS 10 HB3 LYS 10 -1.453 14.383 10.168
86 HG2 LYS 10 HG2 LYS 10 0.727 12.860 8.786
87 HG3 LYS 10 HG3 LYS 10 0.458 14.572 8.381
88 HD2 LYS 10 HD2 LYS 10 1.073 13.396 11.108
89 HD3 LYS 10 HD3 LYS 10 2.118 14.446 10.119
90 HE2 LYS 10 HE2 LYS 10 0.412 16.224 10.269
91 HE3 LYS 10 HE3 LYS 10 -0.566 15.178 11.307
92 HZ1 LYS 10 HZ1 LYS 10 1.575 15.390 12.797
93 HZ2 LYS 10 HZ2 LYS 10 0.333 16.489 12.831
94 HZ3 LYS 10 HZ3 LYS 10 1.710 16.824 11.970
95 H THR 11 H THR 11 -3.445 12.020 8.538
96 HA THR 11 HA THR 11 -5.551 12.266 10.621
97 HB THR 11 HB THR 11 -5.471 13.463 7.913
98 HG1 THR 11 HG1 THR 11 -5.511 15.223 9.048
99 HG21 THR 11 HG21 THR 11 -7.895 12.759 9.552
100 HG22 THR 11 HG22 THR 11 -7.569 12.388 7.859
101 HG23 THR 11 HG23 THR 11 -7.880 14.052 8.354
102 H LEU 12 H LEU 12 -4.514 10.208 8.010
103 HA LEU 12 HA LEU 12 -6.880 8.555 8.637
104 HB2 LEU 12 HB2 LEU 12 -6.907 9.383 6.326
105 HB3 LEU 12 HB3 LEU 12 -5.285 8.721 6.071
106 HG LEU 12 HG LEU 12 -6.172 6.436 6.415
107 HD11 LEU 12 HD11 LEU 12 -8.044 7.036 7.894
108 HD12 LEU 12 HD12 LEU 12 -8.563 6.051 6.526
109 HD13 LEU 12 HD13 LEU 12 -8.873 7.787 6.530
110 HD21 LEU 12 HD21 LEU 12 -7.709 8.003 4.335
111 HD22 LEU 12 HD22 LEU 12 -7.356 6.275 4.309
112 HD23 LEU 12 HD23 LEU 12 -6.045 7.445 4.163
113 H LYS 13 H LYS 13 -6.505 6.674 9.641
114 HA LYS 13 HA LYS 13 -3.873 5.402 9.184
115 HB2 LYS 13 HB2 LYS 13 -3.873 4.613 11.492
116 HB3 LYS 13 HB3 LYS 13 -3.905 6.385 11.412
117 HG2 LYS 13 HG2 LYS 13 -6.484 6.096 11.617
118 HG3 LYS 13 HG3 LYS 13 -6.072 4.473 12.225
119 HD2 LYS 13 HD2 LYS 13 -4.748 5.410 14.006
120 HD3 LYS 13 HD3 LYS 13 -4.924 7.051 13.336
121 HE2 LYS 13 HE2 LYS 13 -7.281 5.372 14.219
122 HE3 LYS 13 HE3 LYS 13 -6.408 6.464 15.320
123 HZ1 LYS 13 HZ1 LYS 13 -6.982 8.299 13.921
124 HZ2 LYS 13 HZ2 LYS 13 -8.374 7.478 14.291
125 HZ3 LYS 13 HZ3 LYS 13 -7.690 7.311 12.790
126 H GLY 14 H GLY 14 -4.019 3.134 8.536
127 HA2 GLY 14 HA2 GLY 14 -5.861 1.373 9.547
128 HA3 GLY 14 HA3 GLY 14 -6.718 1.951 8.139
129 H GLU 15 H GLU 15 -6.667 -0.183 7.502
130 HA GLU 15 HA GLU 15 -4.187 -0.875 6.044
131 HB2 GLU 15 HB2 GLU 15 -5.705 -2.556 8.024
132 HB3 GLU 15 HB3 GLU 15 -4.674 -3.292 6.781
133 HG2 GLU 15 HG2 GLU 15 -2.855 -1.670 7.719
134 HG3 GLU 15 HG3 GLU 15 -3.915 -1.613 9.147
135 H THR 16 H THR 16 -4.486 -2.154 4.107
136 HA THR 16 HA THR 16 -7.202 -3.121 3.619
137 HB THR 16 HB THR 16 -7.279 -0.836 2.610
138 HG1 THR 16 HG1 THR 16 -8.572 -2.132 1.501
139 HG21 THR 16 HG21 THR 16 -4.801 -0.844 1.983
140 HG22 THR 16 HG22 THR 16 -5.944 -0.173 0.820
141 HG23 THR 16 HG23 THR 16 -5.288 -1.792 0.579
142 H THR 17 H THR 17 -7.150 -4.376 1.434
143 HA THR 17 HA THR 17 -4.519 -5.628 1.113
144 HB THR 17 HB THR 17 -5.465 -7.856 1.231
145 HG1 THR 17 HG1 THR 17 -7.878 -6.502 1.892
146 HG21 THR 17 HG21 THR 17 -5.539 -8.086 3.492
147 HG22 THR 17 HG22 THR 17 -6.543 -6.654 3.725
148 HG23 THR 17 HG23 THR 17 -4.821 -6.479 3.387
149 H THR 18 H THR 18 -4.323 -6.844 -0.842
150 HA THR 18 HA THR 18 -6.553 -6.629 -2.738
151 HB THR 18 HB THR 18 -5.095 -4.536 -3.125
152 HG1 THR 18 HG1 THR 18 -6.410 -5.120 -4.775
153 HG21 THR 18 HG21 THR 18 -3.246 -6.148 -4.751
154 HG22 THR 18 HG22 THR 18 -2.961 -6.178 -3.010
155 HG23 THR 18 HG23 THR 18 -2.983 -4.641 -3.876
156 H LYS 19 H LYS 19 -6.177 -8.032 -4.633
157 HA LYS 19 HA LYS 19 -4.243 -10.199 -3.998
158 HB2 LYS 19 HB2 LYS 19 -6.724 -10.224 -5.755
159 HB3 LYS 19 HB3 LYS 19 -5.650 -11.604 -5.460
160 HG2 LYS 19 HG2 LYS 19 -6.685 -10.376 -3.003
161 HG3 LYS 19 HG3 LYS 19 -7.956 -11.014 -4.075
162 HD2 LYS 19 HD2 LYS 19 -5.515 -12.595 -3.216
163 HD3 LYS 19 HD3 LYS 19 -7.080 -12.645 -2.367
164 HE2 LYS 19 HE2 LYS 19 -6.980 -13.147 -5.326
165 HE3 LYS 19 HE3 LYS 19 -6.490 -14.435 -4.201
166 HZ1 LYS 19 HZ1 LYS 19 -8.742 -13.809 -3.088
167 HZ2 LYS 19 HZ2 LYS 19 -8.712 -14.826 -4.398
168 HZ3 LYS 19 HZ3 LYS 19 -9.124 -13.232 -4.597
169 H ALA 20 H ALA 20 -2.533 -10.480 -5.444
170 HA ALA 20 HA ALA 20 -2.805 -9.487 -8.110
171 HB1 ALA 20 HB1 ALA 20 -0.589 -8.213 -7.925
172 HB2 ALA 20 HB2 ALA 20 -0.820 -8.285 -6.178
173 HB3 ALA 20 HB3 ALA 20 -1.993 -7.440 -7.190
174 H VAL 21 H VAL 21 -1.191 -10.238 -9.607
175 HA VAL 21 HA VAL 21 -0.023 -12.646 -8.835
176 HB VAL 21 HB VAL 21 -0.780 -12.215 -11.110
177 HG11 VAL 21 HG11 VAL 21 0.226 -9.899 -11.166
178 HG12 VAL 21 HG12 VAL 21 0.491 -10.880 -12.607
179 HG13 VAL 21 HG13 VAL 21 1.790 -10.669 -11.434
180 HG21 VAL 21 HG21 VAL 21 2.147 -12.958 -11.079
181 HG22 VAL 21 HG22 VAL 21 0.889 -13.527 -12.177
182 HG23 VAL 21 HG23 VAL 21 0.877 -14.028 -10.485
183 H ASP 22 H ASP 22 1.399 -9.438 -8.755
184 HA ASP 22 HA ASP 22 3.754 -10.623 -7.563
185 HB2 ASP 22 HB2 ASP 22 5.357 -9.607 -9.158
186 HB3 ASP 22 HB3 ASP 22 4.323 -10.820 -9.946
187 H ALA 23 H ALA 23 5.351 -8.898 -6.822
188 HA ALA 23 HA ALA 23 3.801 -7.127 -5.231
189 HB1 ALA 23 HB1 ALA 23 5.810 -7.839 -4.286
190 HB2 ALA 23 HB2 ALA 23 6.085 -6.139 -4.666
191 HB3 ALA 23 HB3 ALA 23 6.746 -7.393 -5.714
192 H GLU 24 H GLU 24 5.646 -6.594 -8.252
193 HA GLU 24 HA GLU 24 5.528 -3.685 -8.041
194 HB2 GLU 24 HB2 GLU 24 5.725 -5.695 -10.347
195 HB3 GLU 24 HB3 GLU 24 5.696 -3.947 -10.650
196 HG2 GLU 24 HG2 GLU 24 7.650 -3.788 -9.016
197 HG3 GLU 24 HG3 GLU 24 7.755 -5.560 -9.150
198 H THR 25 H THR 25 3.214 -6.011 -9.536
199 HA THR 25 HA THR 25 1.529 -3.848 -10.628
200 HB THR 25 HB THR 25 0.797 -6.737 -9.909
201 HG1 THR 25 HG1 THR 25 1.902 -7.107 -11.646
202 HG21 THR 25 HG21 THR 25 -0.731 -4.607 -11.365
203 HG22 THR 25 HG22 THR 25 -1.273 -5.683 -10.078
204 HG23 THR 25 HG23 THR 25 -0.984 -6.320 -11.697
205 H ALA 26 H ALA 26 1.606 -5.640 -7.447
206 HA ALA 26 HA ALA 26 -0.792 -4.366 -6.369
207 HB1 ALA 26 HB1 ALA 26 0.505 -6.298 -5.330
208 HB2 ALA 26 HB2 ALA 26 -0.020 -5.037 -4.216
209 HB3 ALA 26 HB3 ALA 26 1.659 -5.095 -4.753
210 H GLU 27 H GLU 27 2.605 -3.229 -6.776
211 HA GLU 27 HA GLU 27 2.253 -0.945 -5.203
212 HB2 GLU 27 HB2 GLU 27 4.444 -1.774 -5.972
213 HB3 GLU 27 HB3 GLU 27 4.065 -1.205 -7.610
214 HG2 GLU 27 HG2 GLU 27 3.762 1.104 -6.570
215 HG3 GLU 27 HG3 GLU 27 4.528 0.426 -5.115
216 H LYS 28 H LYS 28 1.728 -1.284 -8.715
217 HA LYS 28 HA LYS 28 1.012 1.475 -9.141
218 HB2 LYS 28 HB2 LYS 28 -0.042 -0.940 -10.628
219 HB3 LYS 28 HB3 LYS 28 -0.026 0.742 -11.195
220 HG2 LYS 28 HG2 LYS 28 2.387 0.742 -11.284
221 HG3 LYS 28 HG3 LYS 28 2.448 -0.889 -10.569
222 HD2 LYS 28 HD2 LYS 28 1.656 -1.906 -12.502
223 HD3 LYS 28 HD3 LYS 28 0.899 -0.410 -13.102
224 HE2 LYS 28 HE2 LYS 28 3.010 0.520 -13.702
225 HE3 LYS 28 HE3 LYS 28 3.893 -0.751 -12.825
226 HZ1 LYS 28 HZ1 LYS 28 3.024 -2.350 -14.430
227 HZ2 LYS 28 HZ2 LYS 28 3.916 -1.170 -15.181
228 HZ3 LYS 28 HZ3 LYS 28 2.260 -1.134 -15.264
229 H ALA 29 H ALA 29 -1.021 -1.354 -8.136
230 HA ALA 29 HA ALA 29 -3.498 0.222 -8.307
231 HB1 ALA 29 HB1 ALA 29 -4.516 -1.588 -7.054
232 HB2 ALA 29 HB2 ALA 29 -2.944 -2.197 -6.536
233 HB3 ALA 29 HB3 ALA 29 -3.412 -2.297 -8.234
234 H PHE 30 H PHE 30 -1.237 -0.556 -5.532
235 HA PHE 30 HA PHE 30 -2.862 0.855 -3.615
236 HB2 PHE 30 HB2 PHE 30 0.062 0.019 -3.682
237 HB3 PHE 30 HB3 PHE 30 -0.684 0.817 -2.280
238 HD1 PHE 30 HD1 PHE 30 -3.263 -0.441 -2.035
239 HD2 PHE 30 HD2 PHE 30 0.468 -2.171 -3.129
240 HE1 PHE 30 HE1 PHE 30 -4.037 -2.625 -1.204
241 HE2 PHE 30 HE2 PHE 30 -0.299 -4.356 -2.303
242 HZ PHE 30 HZ PHE 30 -2.554 -4.585 -1.336
243 H LYS 31 H LYS 31 -0.189 1.987 -5.774
244 HA LYS 31 HA LYS 31 -0.121 4.615 -4.462
245 HB2 LYS 31 HB2 LYS 31 0.595 3.710 -7.269
246 HB3 LYS 31 HB3 LYS 31 0.735 5.398 -6.738
247 HG2 LYS 31 HG2 LYS 31 2.105 4.271 -4.754
248 HG3 LYS 31 HG3 LYS 31 2.355 3.009 -5.986
249 HD2 LYS 31 HD2 LYS 31 3.122 4.816 -7.556
250 HD3 LYS 31 HD3 LYS 31 3.049 5.954 -6.187
251 HE2 LYS 31 HE2 LYS 31 4.850 4.999 -5.119
252 HE3 LYS 31 HE3 LYS 31 4.577 3.402 -5.855
253 HZ1 LYS 31 HZ1 LYS 31 5.560 5.760 -7.347
254 HZ2 LYS 31 HZ2 LYS 31 5.465 4.198 -7.898
255 HZ3 LYS 31 HZ3 LYS 31 6.550 4.590 -6.706
256 H GLN 32 H GLN 32 -2.270 3.259 -6.939
257 HA GLN 32 HA GLN 32 -3.568 5.802 -7.441
258 HB2 GLN 32 HB2 GLN 32 -4.572 2.951 -7.806
259 HB3 GLN 32 HB3 GLN 32 -5.392 4.399 -8.423
260 HG2 GLN 32 HG2 GLN 32 -2.678 3.337 -9.234
261 HG3 GLN 32 HG3 GLN 32 -4.166 3.369 -10.208
262 HE21 GLN 32 HE21 GLN 32 -5.170 5.693 -10.261
263 HE22 GLN 32 HE22 GLN 32 -3.995 6.979 -10.707
264 H TYR 33 H TYR 33 -4.356 3.117 -5.231
265 HA TYR 33 HA TYR 33 -6.773 4.279 -4.187
266 HB2 TYR 33 HB2 TYR 33 -6.026 1.920 -3.773
267 HB3 TYR 33 HB3 TYR 33 -4.652 2.536 -2.830
268 HD1 TYR 33 HD2 TYR 33 -5.157 3.826 -0.695
269 HD2 TYR 33 HD1 TYR 33 -8.107 1.557 -2.756
270 HE1 TYR 33 HE2 TYR 33 -6.536 3.779 1.341
271 HE2 TYR 33 HE1 TYR 33 -9.494 1.505 -0.726
272 HH TYR 33 HH TYR 33 -8.650 1.841 2.091
273 H ALA 34 H ALA 34 -3.406 4.637 -3.017
274 HA ALA 34 HA ALA 34 -3.970 6.403 -0.879
275 HB1 ALA 34 HB1 ALA 34 -1.740 5.236 -1.562
276 HB2 ALA 34 HB2 ALA 34 -1.695 6.806 -0.760
277 HB3 ALA 34 HB3 ALA 34 -1.485 6.702 -2.508
278 H ASN 35 H ASN 35 -3.265 7.144 -4.297
279 HA ASN 35 HA ASN 35 -3.401 10.030 -3.844
280 HB2 ASN 35 HB2 ASN 35 -3.857 8.280 -6.317
281 HB3 ASN 35 HB3 ASN 35 -3.906 10.055 -6.374
282 HD21 ASN 35 HD21 ASN 35 -2.160 8.874 -7.978
283 HD22 ASN 35 HD22 ASN 35 -0.486 9.052 -7.349
284 H ASP 36 H ASP 36 -6.000 7.657 -4.776
285 HA ASP 36 HA ASP 36 -8.005 9.696 -5.125
286 HB2 ASP 36 HB2 ASP 36 -8.265 6.765 -4.433
287 HB3 ASP 36 HB3 ASP 36 -9.660 7.835 -4.699
288 H ASN 37 H ASN 37 -6.635 8.362 -2.204
289 HA ASN 37 HA ASN 37 -8.823 9.711 -0.652
290 HB2 ASN 37 HB2 ASN 37 -6.855 7.526 0.039
291 HB3 ASN 37 HB3 ASN 37 -7.754 8.412 1.290
292 HD21 ASN 37 HD21 ASN 37 -7.940 6.183 -1.400
293 HD22 ASN 37 HD22 ASN 37 -9.609 5.612 -1.056
294 H GLY 38 H GLY 38 -5.943 10.734 -1.796
295 HA2 GLY 38 HA2 GLY 38 -4.949 12.745 -1.207
296 HA3 GLY 38 HA3 GLY 38 -5.929 12.807 0.242
297 H VAL 39 H VAL 39 -3.843 10.067 -0.241
298 HA VAL 39 HA VAL 39 -2.151 11.057 2.045
299 HB VAL 39 HB VAL 39 -2.628 8.236 1.096
300 HG11 VAL 39 HG11 VAL 39 -1.345 8.889 3.697
301 HG12 VAL 39 HG12 VAL 39 -0.369 9.082 2.242
302 HG13 VAL 39 HG13 VAL 39 -1.091 7.517 2.617
303 HG21 VAL 39 HG21 VAL 39 -3.983 7.943 3.008
304 HG22 VAL 39 HG22 VAL 39 -4.524 9.461 2.290
305 HG23 VAL 39 HG23 VAL 39 -3.476 9.480 3.706
306 H ASP 40 H ASP 40 -0.164 11.454 1.839
307 HA ASP 40 HA ASP 40 1.275 10.370 -0.526
308 HB2 ASP 40 HB2 ASP 40 0.399 12.551 -1.145
309 HB3 ASP 40 HB3 ASP 40 1.086 13.278 0.324
310 H GLY 41 H GLY 41 3.057 9.723 -0.289
311 HA2 GLY 41 HA2 GLY 41 4.987 10.772 1.716
312 HA3 GLY 41 HA3 GLY 41 4.131 9.336 2.225
313 H VAL 42 H VAL 42 6.056 8.530 2.724
314 HA VAL 42 HA VAL 42 7.766 7.796 0.462
315 HB VAL 42 HB VAL 42 8.224 7.703 3.441
316 HG11 VAL 42 HG11 VAL 42 9.232 5.746 2.252
317 HG12 VAL 42 HG12 VAL 42 10.396 6.798 3.058
318 HG13 VAL 42 HG13 VAL 42 10.195 6.884 1.309
319 HG21 VAL 42 HG21 VAL 42 10.230 9.170 2.563
320 HG22 VAL 42 HG22 VAL 42 8.641 9.874 2.862
321 HG23 VAL 42 HG23 VAL 42 9.131 9.469 1.219
322 H TRP 43 H TRP 43 8.042 5.696 -0.237
323 HA TRP 43 HA TRP 43 6.150 3.655 1.044
324 HB2 TRP 43 HB2 TRP 43 7.435 3.985 -1.703
325 HB3 TRP 43 HB3 TRP 43 6.579 2.507 -1.209
326 HD1 TRP 43 HD1 TRP 43 5.929 6.243 -1.915
327 HE1 TRP 43 HE1 TRP 43 3.411 6.581 -2.445
328 HE3 TRP 43 HE3 TRP 43 4.311 1.505 -0.887
329 HZ2 TRP 43 HZ2 TRP 43 1.075 4.982 -2.406
330 HZ3 TRP 43 HZ3 TRP 43 1.922 0.988 -1.158
331 HH2 TRP 43 HH2 TRP 43 0.338 2.692 -1.900
332 H THR 44 H THR 44 6.801 1.769 1.857
333 HA THR 44 HA THR 44 9.551 0.866 1.185
334 HB THR 44 HB THR 44 9.667 -0.141 3.544
335 HG1 THR 44 HG1 THR 44 7.537 1.701 3.896
336 HG21 THR 44 HG21 THR 44 10.944 1.889 2.838
337 HG22 THR 44 HG22 THR 44 10.578 1.794 4.561
338 HG23 THR 44 HG23 THR 44 9.644 2.869 3.520
339 H TYR 45 H TYR 45 9.764 -1.455 1.257
340 HA TYR 45 HA TYR 45 7.308 -2.987 1.392
341 HB2 TYR 45 HB2 TYR 45 7.673 -2.549 -0.962
342 HB3 TYR 45 HB3 TYR 45 9.346 -3.129 -0.815
343 HD1 TYR 45 HD1 TYR 45 6.136 -4.589 0.443
344 HD2 TYR 45 HD2 TYR 45 9.499 -5.034 -2.126
345 HE1 TYR 45 HE1 TYR 45 5.393 -6.861 -0.129
346 HE2 TYR 45 HE2 TYR 45 8.765 -7.309 -2.705
347 HH TYR 45 HH TYR 45 7.345 -9.110 -1.639
348 H ASP 46 H ASP 46 7.375 -4.866 2.454
349 HA ASP 46 HA ASP 46 10.059 -5.946 3.064
350 HB2 ASP 46 HB2 ASP 46 8.869 -5.221 5.113
351 HB3 ASP 46 HB3 ASP 46 7.470 -6.216 4.651
352 H ASP 47 H ASP 47 10.445 -7.548 1.671
353 HA ASP 47 HA ASP 47 8.335 -8.921 0.258
354 HB2 ASP 47 HB2 ASP 47 10.705 -8.632 -0.544
355 HB3 ASP 47 HB3 ASP 47 11.205 -9.851 0.649
356 H ALA 48 H ALA 48 9.933 -9.702 3.381
357 HA ALA 48 HA ALA 48 9.159 -12.540 3.273
358 HB1 ALA 48 HB1 ALA 48 9.708 -10.638 5.607
359 HB2 ALA 48 HB2 ALA 48 10.874 -11.704 4.822
360 HB3 ALA 48 HB3 ALA 48 9.545 -12.386 5.760
361 H THR 49 H THR 49 7.451 -9.629 4.375
362 HA THR 49 HA THR 49 5.113 -11.461 5.157
363 HB THR 49 HB THR 49 4.168 -9.513 6.395
364 HG1 THR 49 HG1 THR 49 6.498 -8.117 5.543
365 HG21 THR 49 HG21 THR 49 5.378 -9.972 8.185
366 HG22 THR 49 HG22 THR 49 6.771 -9.116 7.526
367 HG23 THR 49 HG23 THR 49 6.528 -10.822 7.152
368 H LYS 50 H LYS 50 6.116 -9.766 2.475
369 HA LYS 50 HA LYS 50 5.010 -8.784 0.675
370 HB2 LYS 50 HB2 LYS 50 2.676 -10.523 1.636
371 HB3 LYS 50 HB3 LYS 50 2.797 -9.750 0.043
372 HG2 LYS 50 HG2 LYS 50 4.883 -11.694 1.025
373 HG3 LYS 50 HG3 LYS 50 3.389 -12.236 0.219
374 HD2 LYS 50 HD2 LYS 50 4.004 -10.617 -1.659
375 HD3 LYS 50 HD3 LYS 50 5.606 -10.500 -0.888
376 HE2 LYS 50 HE2 LYS 50 6.190 -12.631 -1.465
377 HE3 LYS 50 HE3 LYS 50 4.518 -13.233 -1.377
378 HZ1 LYS 50 HZ1 LYS 50 4.060 -12.224 -3.476
379 HZ2 LYS 50 HZ2 LYS 50 5.429 -13.145 -3.648
380 HZ3 LYS 50 HZ3 LYS 50 5.551 -11.494 -3.538
381 H THR 51 H THR 51 5.050 -7.196 2.884
382 HA THR 51 HA THR 51 2.480 -5.805 2.746
383 HB THR 51 HB THR 51 4.489 -5.926 4.985
384 HG1 THR 51 HG1 THR 51 1.827 -6.890 4.749
385 HG21 THR 51 HG21 THR 51 3.343 -3.704 4.780
386 HG22 THR 51 HG22 THR 51 3.057 -4.564 6.293
387 HG23 THR 51 HG23 THR 51 1.815 -4.544 5.041
388 H PHE 52 H PHE 52 2.328 -3.797 2.095
389 HA PHE 52 HA PHE 52 4.995 -2.288 1.539
390 HB2 PHE 52 HB2 PHE 52 2.107 -2.044 0.448
391 HB3 PHE 52 HB3 PHE 52 3.371 -0.821 0.192
392 HD1 PHE 52 HD2 PHE 52 5.332 -1.343 -1.182
393 HD2 PHE 52 HD1 PHE 52 2.126 -4.110 -0.746
394 HE1 PHE 52 HE2 PHE 52 6.144 -2.587 -3.145
395 HE2 PHE 52 HE1 PHE 52 2.932 -5.359 -2.707
396 HZ PHE 52 HZ PHE 52 4.944 -4.597 -3.909
397 H THR 53 H THR 53 5.108 -0.339 2.795
398 HA THR 53 HA THR 53 2.824 0.447 4.505
399 HB THR 53 HB THR 53 5.782 0.607 5.228
400 HG1 THR 53 HG1 THR 53 5.335 -1.374 5.810
401 HG21 THR 53 HG21 THR 53 5.303 1.873 7.001
402 HG22 THR 53 HG22 THR 53 3.794 1.021 7.332
403 HG23 THR 53 HG23 THR 53 3.837 2.299 6.118
404 H VAL 54 H VAL 54 2.306 2.600 4.429
405 HA VAL 54 HA VAL 54 4.333 4.345 2.938
406 HB VAL 54 HB VAL 54 2.368 4.028 1.471
407 HG11 VAL 54 HG11 VAL 54 0.143 4.603 2.080
408 HG12 VAL 54 HG12 VAL 54 0.661 5.270 3.628
409 HG13 VAL 54 HG13 VAL 54 0.754 3.533 3.341
410 HG21 VAL 54 HG21 VAL 54 1.638 6.490 1.409
411 HG22 VAL 54 HG22 VAL 54 3.357 6.139 1.234
412 HG23 VAL 54 HG23 VAL 54 2.727 6.716 2.777
413 H THR 55 H THR 55 5.065 5.834 4.333
414 HA THR 55 HA THR 55 3.455 6.495 6.770
415 HB THR 55 HB THR 55 6.468 6.489 6.409
416 HG1 THR 55 HG1 THR 55 4.824 4.761 7.954
417 HG21 THR 55 HG21 THR 55 4.967 6.782 8.990
418 HG22 THR 55 HG22 THR 55 5.621 8.145 8.082
419 HG23 THR 55 HG23 THR 55 6.703 6.904 8.710
420 H GLU 56 H GLU 56 2.802 8.546 6.891
421 HA GLU 56 HA GLU 56 3.886 10.613 4.982
422 HB2 GLU 56 HB2 GLU 56 1.432 10.214 5.203
423 HB3 GLU 56 HB3 GLU 56 1.534 10.677 6.912
424 HG2 GLU 56 HG2 GLU 56 2.312 12.911 6.249
425 HG3 GLU 56 HG3 GLU 56 2.176 12.438 4.539
Start of MODEL 7
1 H1 MET 1 H1 MET 1 -1.060 -13.068 -5.568
2 H2 MET 1 H2 MET 1 -2.124 -14.314 -5.180
3 H3 MET 1 H3 MET 1 -0.502 -14.654 -5.475
4 HA MET 1 HA MET 1 -1.181 -14.666 -3.114
5 HB2 MET 1 HB2 MET 1 1.156 -14.252 -4.200
6 HB3 MET 1 HB3 MET 1 0.904 -12.569 -3.698
7 HG2 MET 1 HG2 MET 1 2.194 -13.687 -2.021
8 HG3 MET 1 HG3 MET 1 0.573 -13.364 -1.365
9 HE1 MET 1 HE1 MET 1 1.362 -16.409 0.537
10 HE2 MET 1 HE2 MET 1 2.044 -14.813 0.223
11 HE3 MET 1 HE3 MET 1 2.857 -16.255 -0.385
12 H GLN 2 H GLN 2 -1.591 -13.411 -1.235
13 HA GLN 2 HA GLN 2 -3.069 -10.911 -1.810
14 HB2 GLN 2 HB2 GLN 2 -4.141 -12.579 -0.336
15 HB3 GLN 2 HB3 GLN 2 -2.720 -12.569 0.727
16 HG2 GLN 2 HG2 GLN 2 -3.303 -10.622 1.723
17 HG3 GLN 2 HG3 GLN 2 -4.041 -9.955 0.248
18 HE21 GLN 2 HE21 GLN 2 -6.178 -10.318 -0.204
19 HE22 GLN 2 HE22 GLN 2 -7.304 -11.041 0.997
20 H TYR 3 H TYR 3 -2.359 -8.945 -1.287
21 HA TYR 3 HA TYR 3 0.143 -8.588 0.255
22 HB2 TYR 3 HB2 TYR 3 -0.824 -6.905 -2.052
23 HB3 TYR 3 HB3 TYR 3 0.577 -6.527 -1.025
24 HD1 TYR 3 HD1 TYR 3 -0.767 -9.204 -3.265
25 HD2 TYR 3 HD2 TYR 3 2.681 -7.325 -1.622
26 HE1 TYR 3 HE1 TYR 3 0.667 -10.562 -4.729
27 HE2 TYR 3 HE2 TYR 3 4.122 -8.679 -3.085
28 HH TYR 3 HH TYR 3 3.963 -9.911 -5.202
29 H LYS 4 H LYS 4 0.202 -6.809 1.731
30 HA LYS 4 HA LYS 4 -2.416 -5.612 2.301
31 HB2 LYS 4 HB2 LYS 4 -0.166 -6.410 4.153
32 HB3 LYS 4 HB3 LYS 4 -1.560 -5.434 4.661
33 HG2 LYS 4 HG2 LYS 4 -3.048 -7.311 3.937
34 HG3 LYS 4 HG3 LYS 4 -1.586 -8.286 3.644
35 HD2 LYS 4 HD2 LYS 4 -2.253 -6.986 6.301
36 HD3 LYS 4 HD3 LYS 4 -2.681 -8.663 5.879
37 HE2 LYS 4 HE2 LYS 4 -0.373 -9.267 5.647
38 HE3 LYS 4 HE3 LYS 4 0.143 -7.570 5.791
39 HZ1 LYS 4 HZ1 LYS 4 -0.182 -7.593 8.029
40 HZ2 LYS 4 HZ2 LYS 4 0.209 -9.192 7.825
41 HZ3 LYS 4 HZ3 LYS 4 -1.379 -8.744 7.991
42 H LEU 5 H LEU 5 -2.561 -3.456 2.830
43 HA LEU 5 HA LEU 5 0.035 -1.872 2.532
44 HB2 LEU 5 HB2 LEU 5 -1.415 -1.401 0.635
45 HB3 LEU 5 HB3 LEU 5 -2.816 -1.154 1.687
46 HG LEU 5 HG LEU 5 -1.562 0.812 2.706
47 HD11 LEU 5 HD11 LEU 5 0.681 0.324 2.056
48 HD12 LEU 5 HD12 LEU 5 0.192 1.789 1.207
49 HD13 LEU 5 HD13 LEU 5 0.239 0.248 0.351
50 HD21 LEU 5 HD21 LEU 5 -2.269 2.307 0.998
51 HD22 LEU 5 HD22 LEU 5 -3.380 0.937 0.966
52 HD23 LEU 5 HD23 LEU 5 -2.111 1.071 -0.250
53 H VAL 6 H VAL 6 0.425 -0.833 4.424
54 HA VAL 6 HA VAL 6 -1.689 -0.321 6.374
55 HB VAL 6 HB VAL 6 1.310 -0.388 6.831
56 HG11 VAL 6 HG11 VAL 6 0.910 0.129 9.083
57 HG12 VAL 6 HG12 VAL 6 -0.819 -0.189 8.950
58 HG13 VAL 6 HG13 VAL 6 -0.126 1.244 8.192
59 HG21 VAL 6 HG21 VAL 6 -0.877 -2.368 7.361
60 HG22 VAL 6 HG22 VAL 6 0.540 -2.308 8.410
61 HG23 VAL 6 HG23 VAL 6 0.731 -2.623 6.684
62 H ILE 7 H ILE 7 -2.336 1.728 6.609
63 HA ILE 7 HA ILE 7 -0.551 3.864 5.261
64 HB ILE 7 HB ILE 7 -3.537 3.980 5.928
65 HG12 ILE 7 HG12 ILE 7 -2.129 3.935 3.232
66 HG13 ILE 7 HG13 ILE 7 -2.910 2.524 3.977
67 HG21 ILE 7 HG21 ILE 7 -3.202 6.098 4.428
68 HG22 ILE 7 HG22 ILE 7 -1.531 5.987 4.981
69 HG23 ILE 7 HG23 ILE 7 -2.837 6.164 6.151
70 HD11 ILE 7 HD11 ILE 7 -4.337 3.573 2.307
71 HD12 ILE 7 HD12 ILE 7 -4.282 5.095 3.198
72 HD13 ILE 7 HD13 ILE 7 -5.055 3.682 3.914
73 H ASN 8 H ASN 8 0.635 4.871 6.749
74 HA ASN 8 HA ASN 8 -0.544 5.355 9.493
75 HB2 ASN 8 HB2 ASN 8 2.360 5.138 8.552
76 HB3 ASN 8 HB3 ASN 8 1.859 5.607 10.192
77 HD21 ASN 8 HD21 ASN 8 2.496 3.962 11.415
78 HD22 ASN 8 HD22 ASN 8 2.011 2.251 11.146
79 H GLY 9 H GLY 9 -1.756 7.135 8.423
80 HA2 GLY 9 HA2 GLY 9 -0.280 9.409 7.274
81 HA3 GLY 9 HA3 GLY 9 -1.974 9.129 7.249
82 H LYS 10 H LYS 10 -1.157 11.638 7.920
83 HA LYS 10 HA LYS 10 -0.897 12.035 10.799
84 HB2 LYS 10 HB2 LYS 10 -0.154 13.602 9.001
85 HB3 LYS 10 HB3 LYS 10 -1.862 13.924 8.636
86 HG2 LYS 10 HG2 LYS 10 -2.186 15.151 10.538
87 HG3 LYS 10 HG3 LYS 10 -0.950 14.259 11.457
88 HD2 LYS 10 HD2 LYS 10 -0.032 16.405 11.121
89 HD3 LYS 10 HD3 LYS 10 0.762 15.367 9.911
90 HE2 LYS 10 HE2 LYS 10 -0.620 16.208 8.159
91 HE3 LYS 10 HE3 LYS 10 -1.697 17.029 9.313
92 HZ1 LYS 10 HZ1 LYS 10 1.056 17.759 8.554
93 HZ2 LYS 10 HZ2 LYS 10 0.353 18.347 9.936
94 HZ3 LYS 10 HZ3 LYS 10 -0.321 18.682 8.458
95 H THR 11 H THR 11 -3.445 12.020 8.538
96 HA THR 11 HA THR 11 -5.551 12.266 10.621
97 HB THR 11 HB THR 11 -5.825 14.217 9.492
98 HG1 THR 11 HG1 THR 11 -7.826 13.869 8.982
99 HG21 THR 11 HG21 THR 11 -5.271 12.682 6.964
100 HG22 THR 11 HG22 THR 11 -4.388 14.056 7.631
101 HG23 THR 11 HG23 THR 11 -6.011 14.282 6.981
102 H LEU 12 H LEU 12 -4.514 10.208 8.010
103 HA LEU 12 HA LEU 12 -6.880 8.555 8.637
104 HB2 LEU 12 HB2 LEU 12 -6.905 9.383 6.325
105 HB3 LEU 12 HB3 LEU 12 -5.285 8.719 6.071
106 HG LEU 12 HG LEU 12 -6.175 6.436 6.415
107 HD11 LEU 12 HD11 LEU 12 -8.046 7.039 7.895
108 HD12 LEU 12 HD12 LEU 12 -8.567 6.054 6.526
109 HD13 LEU 12 HD13 LEU 12 -8.875 7.791 6.530
110 HD21 LEU 12 HD21 LEU 12 -7.710 8.004 4.335
111 HD22 LEU 12 HD22 LEU 12 -7.359 6.276 4.309
112 HD23 LEU 12 HD23 LEU 12 -6.046 7.444 4.163
113 H LYS 13 H LYS 13 -6.505 6.674 9.641
114 HA LYS 13 HA LYS 13 -3.873 5.402 9.184
115 HB2 LYS 13 HB2 LYS 13 -3.879 4.610 11.493
116 HB3 LYS 13 HB3 LYS 13 -3.900 6.382 11.411
117 HG2 LYS 13 HG2 LYS 13 -6.481 6.108 11.616
118 HG3 LYS 13 HG3 LYS 13 -6.079 4.484 12.226
119 HD2 LYS 13 HD2 LYS 13 -4.749 5.415 14.006
120 HD3 LYS 13 HD3 LYS 13 -4.915 7.057 13.334
121 HE2 LYS 13 HE2 LYS 13 -7.282 5.393 14.219
122 HE3 LYS 13 HE3 LYS 13 -6.403 6.480 15.318
123 HZ1 LYS 13 HZ1 LYS 13 -6.966 8.318 13.917
124 HZ2 LYS 13 HZ2 LYS 13 -8.363 7.506 14.288
125 HZ3 LYS 13 HZ3 LYS 13 -7.680 7.332 12.787
126 H GLY 14 H GLY 14 -4.019 3.134 8.536
127 HA2 GLY 14 HA2 GLY 14 -5.861 1.373 9.547
128 HA3 GLY 14 HA3 GLY 14 -6.718 1.951 8.139
129 H GLU 15 H GLU 15 -6.667 -0.183 7.502
130 HA GLU 15 HA GLU 15 -4.187 -0.875 6.044
131 HB2 GLU 15 HB2 GLU 15 -3.940 -2.191 7.972
132 HB3 GLU 15 HB3 GLU 15 -5.682 -2.518 8.064
133 HG2 GLU 15 HG2 GLU 15 -5.447 -3.858 5.950
134 HG3 GLU 15 HG3 GLU 15 -3.686 -3.663 6.104
135 H THR 16 H THR 16 -4.486 -2.154 4.107
136 HA THR 16 HA THR 16 -7.202 -3.121 3.619
137 HB THR 16 HB THR 16 -7.277 -0.835 2.610
138 HG1 THR 16 HG1 THR 16 -8.573 -2.130 1.504
139 HG21 THR 16 HG21 THR 16 -4.800 -0.846 1.980
140 HG22 THR 16 HG22 THR 16 -5.943 -0.175 0.818
141 HG23 THR 16 HG23 THR 16 -5.290 -1.795 0.577
142 H THR 17 H THR 17 -7.150 -4.376 1.434
143 HA THR 17 HA THR 17 -4.519 -5.628 1.113
144 HB THR 17 HB THR 17 -5.467 -7.856 1.228
145 HG1 THR 17 HG1 THR 17 -7.876 -6.500 1.898
146 HG21 THR 17 HG21 THR 17 -5.536 -8.089 3.489
147 HG22 THR 17 HG22 THR 17 -6.536 -6.655 3.727
148 HG23 THR 17 HG23 THR 17 -4.816 -6.482 3.384
149 H THR 18 H THR 18 -4.323 -6.844 -0.842
150 HA THR 18 HA THR 18 -6.553 -6.629 -2.738
151 HB THR 18 HB THR 18 -5.094 -4.536 -3.125
152 HG1 THR 18 HG1 THR 18 -6.410 -5.120 -4.774
153 HG21 THR 18 HG21 THR 18 -3.247 -6.149 -4.752
154 HG22 THR 18 HG22 THR 18 -2.961 -6.179 -3.011
155 HG23 THR 18 HG23 THR 18 -2.983 -4.642 -3.876
156 H LYS 19 H LYS 19 -6.177 -8.032 -4.633
157 HA LYS 19 HA LYS 19 -4.243 -10.199 -3.998
158 HB2 LYS 19 HB2 LYS 19 -6.724 -10.224 -5.755
159 HB3 LYS 19 HB3 LYS 19 -5.650 -11.604 -5.460
160 HG2 LYS 19 HG2 LYS 19 -6.685 -10.377 -3.003
161 HG3 LYS 19 HG3 LYS 19 -7.956 -11.014 -4.075
162 HD2 LYS 19 HD2 LYS 19 -5.515 -12.595 -3.216
163 HD3 LYS 19 HD3 LYS 19 -7.080 -12.645 -2.367
164 HE2 LYS 19 HE2 LYS 19 -6.980 -13.147 -5.326
165 HE3 LYS 19 HE3 LYS 19 -6.490 -14.435 -4.202
166 HZ1 LYS 19 HZ1 LYS 19 -8.742 -13.809 -3.088
167 HZ2 LYS 19 HZ2 LYS 19 -8.712 -14.826 -4.398
168 HZ3 LYS 19 HZ3 LYS 19 -9.124 -13.232 -4.597
169 H ALA 20 H ALA 20 -2.533 -10.480 -5.444
170 HA ALA 20 HA ALA 20 -2.805 -9.487 -8.110
171 HB1 ALA 20 HB1 ALA 20 -0.589 -8.213 -7.925
172 HB2 ALA 20 HB2 ALA 20 -0.820 -8.285 -6.178
173 HB3 ALA 20 HB3 ALA 20 -1.993 -7.440 -7.190
174 H VAL 21 H VAL 21 -1.191 -10.238 -9.607
175 HA VAL 21 HA VAL 21 -0.023 -12.646 -8.835
176 HB VAL 21 HB VAL 21 -0.780 -12.215 -11.110
177 HG11 VAL 21 HG11 VAL 21 0.227 -9.899 -11.166
178 HG12 VAL 21 HG12 VAL 21 0.491 -10.880 -12.607
179 HG13 VAL 21 HG13 VAL 21 1.791 -10.669 -11.434
180 HG21 VAL 21 HG21 VAL 21 2.146 -12.958 -11.079
181 HG22 VAL 21 HG22 VAL 21 0.888 -13.527 -12.177
182 HG23 VAL 21 HG23 VAL 21 0.876 -14.028 -10.485
183 H ASP 22 H ASP 22 1.399 -9.438 -8.755
184 HA ASP 22 HA ASP 22 3.754 -10.623 -7.563
185 HB2 ASP 22 HB2 ASP 22 5.356 -9.602 -9.159
186 HB3 ASP 22 HB3 ASP 22 4.327 -10.821 -9.943
187 H ALA 23 H ALA 23 5.351 -8.898 -6.822
188 HA ALA 23 HA ALA 23 3.801 -7.127 -5.231
189 HB1 ALA 23 HB1 ALA 23 5.810 -7.839 -4.286
190 HB2 ALA 23 HB2 ALA 23 6.085 -6.139 -4.666
191 HB3 ALA 23 HB3 ALA 23 6.746 -7.393 -5.714
192 H GLU 24 H GLU 24 5.646 -6.594 -8.252
193 HA GLU 24 HA GLU 24 5.528 -3.685 -8.041
194 HB2 GLU 24 HB2 GLU 24 6.963 -4.988 -9.617
195 HB3 GLU 24 HB3 GLU 24 5.528 -5.533 -10.507
196 HG2 GLU 24 HG2 GLU 24 5.035 -3.063 -10.917
197 HG3 GLU 24 HG3 GLU 24 6.687 -2.755 -10.333
198 H THR 25 H THR 25 3.214 -6.011 -9.536
199 HA THR 25 HA THR 25 1.529 -3.848 -10.628
200 HB THR 25 HB THR 25 0.800 -6.738 -9.910
201 HG1 THR 25 HG1 THR 25 1.901 -7.103 -11.651
202 HG21 THR 25 HG21 THR 25 -0.735 -4.608 -11.359
203 HG22 THR 25 HG22 THR 25 -1.272 -5.687 -10.072
204 HG23 THR 25 HG23 THR 25 -0.987 -6.321 -11.693
205 H ALA 26 H ALA 26 1.606 -5.640 -7.447
206 HA ALA 26 HA ALA 26 -0.792 -4.366 -6.369
207 HB1 ALA 26 HB1 ALA 26 0.505 -6.298 -5.330
208 HB2 ALA 26 HB2 ALA 26 -0.020 -5.037 -4.216
209 HB3 ALA 26 HB3 ALA 26 1.659 -5.095 -4.753
210 H GLU 27 H GLU 27 2.605 -3.229 -6.776
211 HA GLU 27 HA GLU 27 2.253 -0.945 -5.203
212 HB2 GLU 27 HB2 GLU 27 4.444 -1.773 -5.971
213 HB3 GLU 27 HB3 GLU 27 4.065 -1.207 -7.609
214 HG2 GLU 27 HG2 GLU 27 3.761 1.104 -6.573
215 HG3 GLU 27 HG3 GLU 27 4.528 0.428 -5.117
216 H LYS 28 H LYS 28 1.728 -1.284 -8.715
217 HA LYS 28 HA LYS 28 1.012 1.475 -9.141
218 HB2 LYS 28 HB2 LYS 28 -0.042 -0.940 -10.628
219 HB3 LYS 28 HB3 LYS 28 -0.026 0.742 -11.195
220 HG2 LYS 28 HG2 LYS 28 2.387 0.741 -11.283
221 HG3 LYS 28 HG3 LYS 28 2.447 -0.890 -10.569
222 HD2 LYS 28 HD2 LYS 28 1.656 -1.906 -12.502
223 HD3 LYS 28 HD3 LYS 28 0.899 -0.410 -13.102
224 HE2 LYS 28 HE2 LYS 28 3.011 0.520 -13.701
225 HE3 LYS 28 HE3 LYS 28 3.893 -0.752 -12.824
226 HZ1 LYS 28 HZ1 LYS 28 3.024 -2.351 -14.429
227 HZ2 LYS 28 HZ2 LYS 28 3.916 -1.172 -15.180
228 HZ3 LYS 28 HZ3 LYS 28 2.260 -1.135 -15.264
229 H ALA 29 H ALA 29 -1.021 -1.354 -8.136
230 HA ALA 29 HA ALA 29 -3.498 0.222 -8.307
231 HB1 ALA 29 HB1 ALA 29 -4.516 -1.588 -7.054
232 HB2 ALA 29 HB2 ALA 29 -2.944 -2.197 -6.536
233 HB3 ALA 29 HB3 ALA 29 -3.412 -2.297 -8.234
234 H PHE 30 H PHE 30 -1.237 -0.556 -5.532
235 HA PHE 30 HA PHE 30 -2.862 0.855 -3.615
236 HB2 PHE 30 HB2 PHE 30 0.062 0.020 -3.681
237 HB3 PHE 30 HB3 PHE 30 -0.685 0.817 -2.280
238 HD1 PHE 30 HD1 PHE 30 -3.263 -0.443 -2.036
239 HD2 PHE 30 HD2 PHE 30 0.470 -2.171 -3.130
240 HE1 PHE 30 HE1 PHE 30 -4.036 -2.628 -1.207
241 HE2 PHE 30 HE2 PHE 30 -0.297 -4.357 -2.305
242 HZ PHE 30 HZ PHE 30 -2.552 -4.587 -1.339
243 H LYS 31 H LYS 31 -0.189 1.987 -5.774
244 HA LYS 31 HA LYS 31 -0.121 4.615 -4.462
245 HB2 LYS 31 HB2 LYS 31 0.592 3.714 -7.271
246 HB3 LYS 31 HB3 LYS 31 0.739 5.399 -6.734
247 HG2 LYS 31 HG2 LYS 31 2.106 4.259 -4.756
248 HG3 LYS 31 HG3 LYS 31 2.351 3.002 -5.993
249 HD2 LYS 31 HD2 LYS 31 3.123 4.812 -7.556
250 HD3 LYS 31 HD3 LYS 31 3.055 5.945 -6.183
251 HE2 LYS 31 HE2 LYS 31 4.853 4.979 -5.120
252 HE3 LYS 31 HE3 LYS 31 4.574 3.386 -5.862
253 HZ1 LYS 31 HZ1 LYS 31 5.565 5.747 -7.345
254 HZ2 LYS 31 HZ2 LYS 31 5.464 4.188 -7.902
255 HZ3 LYS 31 HZ3 LYS 31 6.550 4.571 -6.709
256 H GLN 32 H GLN 32 -2.270 3.259 -6.939
257 HA GLN 32 HA GLN 32 -3.568 5.802 -7.441
258 HB2 GLN 32 HB2 GLN 32 -3.784 3.998 -9.056
259 HB3 GLN 32 HB3 GLN 32 -4.507 2.933 -7.835
260 HG2 GLN 32 HG2 GLN 32 -6.428 4.513 -7.678
261 HG3 GLN 32 HG3 GLN 32 -5.715 5.442 -9.017
262 HE21 GLN 32 HE21 GLN 32 -8.263 4.403 -9.175
263 HE22 GLN 32 HE22 GLN 32 -8.273 3.080 -10.392
264 H TYR 33 H TYR 33 -4.356 3.117 -5.231
265 HA TYR 33 HA TYR 33 -6.773 4.279 -4.187
266 HB2 TYR 33 HB2 TYR 33 -6.024 1.919 -3.774
267 HB3 TYR 33 HB3 TYR 33 -4.652 2.537 -2.828
268 HD1 TYR 33 HD2 TYR 33 -5.163 3.826 -0.694
269 HD2 TYR 33 HD1 TYR 33 -8.106 1.554 -2.761
270 HE1 TYR 33 HE2 TYR 33 -6.546 3.778 1.340
271 HE2 TYR 33 HE1 TYR 33 -9.497 1.501 -0.734
272 HH TYR 33 HH TYR 33 -8.659 1.837 2.085
273 H ALA 34 H ALA 34 -3.406 4.637 -3.017
274 HA ALA 34 HA ALA 34 -3.970 6.403 -0.879
275 HB1 ALA 34 HB1 ALA 34 -1.740 5.236 -1.562
276 HB2 ALA 34 HB2 ALA 34 -1.695 6.806 -0.760
277 HB3 ALA 34 HB3 ALA 34 -1.485 6.702 -2.508
278 H ASN 35 H ASN 35 -3.265 7.144 -4.297
279 HA ASN 35 HA ASN 35 -3.401 10.030 -3.844
280 HB2 ASN 35 HB2 ASN 35 -2.432 8.933 -5.894
281 HB3 ASN 35 HB3 ASN 35 -4.067 8.439 -6.385
282 HD21 ASN 35 HD21 ASN 35 -1.697 10.612 -6.931
283 HD22 ASN 35 HD22 ASN 35 -2.682 11.994 -7.522
284 H ASP 36 H ASP 36 -6.000 7.657 -4.776
285 HA ASP 36 HA ASP 36 -8.005 9.696 -5.125
286 HB2 ASP 36 HB2 ASP 36 -8.266 6.765 -4.432
287 HB3 ASP 36 HB3 ASP 36 -9.660 7.835 -4.701
288 H ASN 37 H ASN 37 -6.635 8.362 -2.204
289 HA ASN 37 HA ASN 37 -8.823 9.711 -0.652
290 HB2 ASN 37 HB2 ASN 37 -6.853 7.528 0.042
291 HB3 ASN 37 HB3 ASN 37 -7.758 8.412 1.290
292 HD21 ASN 37 HD21 ASN 37 -7.931 6.183 -1.401
293 HD22 ASN 37 HD22 ASN 37 -9.600 5.608 -1.062
294 H GLY 38 H GLY 38 -5.943 10.734 -1.796
295 HA2 GLY 38 HA2 GLY 38 -4.949 12.745 -1.207
296 HA3 GLY 38 HA3 GLY 38 -5.929 12.807 0.242
297 H VAL 39 H VAL 39 -3.843 10.067 -0.241
298 HA VAL 39 HA VAL 39 -2.151 11.057 2.045
299 HB VAL 39 HB VAL 39 -2.631 8.236 1.096
300 HG11 VAL 39 HG11 VAL 39 -1.342 8.887 3.694
301 HG12 VAL 39 HG12 VAL 39 -0.368 9.080 2.238
302 HG13 VAL 39 HG13 VAL 39 -1.091 7.516 2.614
303 HG21 VAL 39 HG21 VAL 39 -3.981 7.944 3.011
304 HG22 VAL 39 HG22 VAL 39 -4.523 9.463 2.294
305 HG23 VAL 39 HG23 VAL 39 -3.472 9.481 3.709
306 H ASP 40 H ASP 40 -0.164 11.454 1.839
307 HA ASP 40 HA ASP 40 1.275 10.370 -0.526
308 HB2 ASP 40 HB2 ASP 40 0.263 12.991 -0.259
309 HB3 ASP 40 HB3 ASP 40 2.016 13.116 -0.001
310 H GLY 41 H GLY 41 3.057 9.723 -0.289
311 HA2 GLY 41 HA2 GLY 41 4.987 10.772 1.716
312 HA3 GLY 41 HA3 GLY 41 4.131 9.336 2.225
313 H VAL 42 H VAL 42 6.056 8.530 2.724
314 HA VAL 42 HA VAL 42 7.766 7.796 0.462
315 HB VAL 42 HB VAL 42 8.224 7.701 3.441
316 HG11 VAL 42 HG11 VAL 42 9.234 5.747 2.249
317 HG12 VAL 42 HG12 VAL 42 10.397 6.799 3.056
318 HG13 VAL 42 HG13 VAL 42 10.195 6.887 1.307
319 HG21 VAL 42 HG21 VAL 42 10.228 9.172 2.564
320 HG22 VAL 42 HG22 VAL 42 8.639 9.874 2.865
321 HG23 VAL 42 HG23 VAL 42 9.129 9.471 1.221
322 H TRP 43 H TRP 43 8.042 5.696 -0.237
323 HA TRP 43 HA TRP 43 6.150 3.655 1.044
324 HB2 TRP 43 HB2 TRP 43 7.435 3.985 -1.703
325 HB3 TRP 43 HB3 TRP 43 6.579 2.507 -1.209
326 HD1 TRP 43 HD1 TRP 43 5.928 6.243 -1.915
327 HE1 TRP 43 HE1 TRP 43 3.410 6.581 -2.445
328 HE3 TRP 43 HE3 TRP 43 4.312 1.505 -0.887
329 HZ2 TRP 43 HZ2 TRP 43 1.075 4.982 -2.406
330 HZ3 TRP 43 HZ3 TRP 43 1.923 0.988 -1.158
331 HH2 TRP 43 HH2 TRP 43 0.338 2.692 -1.900
332 H THR 44 H THR 44 6.801 1.769 1.857
333 HA THR 44 HA THR 44 9.551 0.866 1.185
334 HB THR 44 HB THR 44 9.670 -0.139 3.543
335 HG1 THR 44 HG1 THR 44 7.534 1.695 3.897
336 HG21 THR 44 HG21 THR 44 10.940 1.896 2.839
337 HG22 THR 44 HG22 THR 44 10.575 1.797 4.562
338 HG23 THR 44 HG23 THR 44 9.637 2.870 3.522
339 H TYR 45 H TYR 45 9.764 -1.455 1.257
340 HA TYR 45 HA TYR 45 7.308 -2.987 1.392
341 HB2 TYR 45 HB2 TYR 45 7.673 -2.549 -0.962
342 HB3 TYR 45 HB3 TYR 45 9.346 -3.129 -0.815
343 HD1 TYR 45 HD1 TYR 45 6.137 -4.590 0.443
344 HD2 TYR 45 HD2 TYR 45 9.499 -5.034 -2.126
345 HE1 TYR 45 HE1 TYR 45 5.395 -6.863 -0.129
346 HE2 TYR 45 HE2 TYR 45 8.766 -7.309 -2.705
347 HH TYR 45 HH TYR 45 7.347 -9.111 -1.639
348 H ASP 46 H ASP 46 7.375 -4.866 2.454
349 HA ASP 46 HA ASP 46 10.059 -5.946 3.064
350 HB2 ASP 46 HB2 ASP 46 8.868 -5.220 5.112
351 HB3 ASP 46 HB3 ASP 46 7.470 -6.217 4.651
352 H ASP 47 H ASP 47 10.445 -7.548 1.671
353 HA ASP 47 HA ASP 47 8.335 -8.921 0.258
354 HB2 ASP 47 HB2 ASP 47 10.703 -8.632 -0.546
355 HB3 ASP 47 HB3 ASP 47 11.206 -9.848 0.650
356 H ALA 48 H ALA 48 9.933 -9.702 3.381
357 HA ALA 48 HA ALA 48 9.159 -12.540 3.273
358 HB1 ALA 48 HB1 ALA 48 9.708 -10.638 5.607
359 HB2 ALA 48 HB2 ALA 48 10.874 -11.704 4.822
360 HB3 ALA 48 HB3 ALA 48 9.545 -12.386 5.760
361 H THR 49 H THR 49 7.451 -9.629 4.375
362 HA THR 49 HA THR 49 5.113 -11.461 5.157
363 HB THR 49 HB THR 49 4.169 -9.516 6.397
364 HG1 THR 49 HG1 THR 49 6.493 -8.114 5.540
365 HG21 THR 49 HG21 THR 49 5.384 -9.970 8.185
366 HG22 THR 49 HG22 THR 49 6.773 -9.112 7.522
367 HG23 THR 49 HG23 THR 49 6.534 -10.818 7.150
368 H LYS 50 H LYS 50 6.116 -9.766 2.475
369 HA LYS 50 HA LYS 50 5.010 -8.784 0.675
370 HB2 LYS 50 HB2 LYS 50 2.680 -10.527 1.637
371 HB3 LYS 50 HB3 LYS 50 2.793 -9.749 0.047
372 HG2 LYS 50 HG2 LYS 50 4.886 -11.692 1.016
373 HG3 LYS 50 HG3 LYS 50 3.391 -12.234 0.213
374 HD2 LYS 50 HD2 LYS 50 3.997 -10.609 -1.662
375 HD3 LYS 50 HD3 LYS 50 5.601 -10.491 -0.897
376 HE2 LYS 50 HE2 LYS 50 6.187 -12.619 -1.481
377 HE3 LYS 50 HE3 LYS 50 4.516 -13.225 -1.389
378 HZ1 LYS 50 HZ1 LYS 50 4.050 -12.210 -3.484
379 HZ2 LYS 50 HZ2 LYS 50 5.420 -13.129 -3.663
380 HZ3 LYS 50 HZ3 LYS 50 5.539 -11.478 -3.549
381 H THR 51 H THR 51 5.050 -7.196 2.884
382 HA THR 51 HA THR 51 2.480 -5.805 2.746
383 HB THR 51 HB THR 51 4.489 -5.924 4.985
384 HG1 THR 51 HG1 THR 51 1.829 -6.894 4.749
385 HG21 THR 51 HG21 THR 51 3.338 -3.704 4.780
386 HG22 THR 51 HG22 THR 51 3.054 -4.565 6.293
387 HG23 THR 51 HG23 THR 51 1.811 -4.548 5.041
388 H PHE 52 H PHE 52 2.328 -3.797 2.095
389 HA PHE 52 HA PHE 52 4.995 -2.288 1.539
390 HB2 PHE 52 HB2 PHE 52 2.107 -2.041 0.449
391 HB3 PHE 52 HB3 PHE 52 3.373 -0.821 0.191
392 HD1 PHE 52 HD2 PHE 52 5.332 -1.349 -1.184
393 HD2 PHE 52 HD1 PHE 52 2.121 -4.109 -0.743
394 HE1 PHE 52 HE2 PHE 52 6.140 -2.597 -3.146
395 HE2 PHE 52 HE1 PHE 52 2.923 -5.362 -2.703
396 HZ PHE 52 HZ PHE 52 4.936 -4.605 -3.908
397 H THR 53 H THR 53 5.108 -0.339 2.795
398 HA THR 53 HA THR 53 2.824 0.447 4.505
399 HB THR 53 HB THR 53 5.782 0.606 5.228
400 HG1 THR 53 HG1 THR 53 5.332 -1.374 5.812
401 HG21 THR 53 HG21 THR 53 5.305 1.874 7.000
402 HG22 THR 53 HG22 THR 53 3.795 1.024 7.332
403 HG23 THR 53 HG23 THR 53 3.839 2.300 6.116
404 H VAL 54 H VAL 54 2.306 2.600 4.429
405 HA VAL 54 HA VAL 54 4.333 4.345 2.938
406 HB VAL 54 HB VAL 54 2.368 4.028 1.471
407 HG11 VAL 54 HG11 VAL 54 0.142 4.604 2.080
408 HG12 VAL 54 HG12 VAL 54 0.662 5.272 3.628
409 HG13 VAL 54 HG13 VAL 54 0.754 3.534 3.342
410 HG21 VAL 54 HG21 VAL 54 1.639 6.490 1.408
411 HG22 VAL 54 HG22 VAL 54 3.357 6.138 1.233
412 HG23 VAL 54 HG23 VAL 54 2.729 6.716 2.776
413 H THR 55 H THR 55 5.065 5.834 4.333
414 HA THR 55 HA THR 55 3.455 6.495 6.770
415 HB THR 55 HB THR 55 6.468 6.487 6.408
416 HG1 THR 55 HG1 THR 55 4.823 4.764 7.957
417 HG21 THR 55 HG21 THR 55 4.969 6.786 8.990
418 HG22 THR 55 HG22 THR 55 5.623 8.147 8.079
419 HG23 THR 55 HG23 THR 55 6.704 6.906 8.709
420 H GLU 56 H GLU 56 2.802 8.546 6.891
421 HA GLU 56 HA GLU 56 3.886 10.613 4.982
422 HB2 GLU 56 HB2 GLU 56 1.432 10.214 5.202
423 HB3 GLU 56 HB3 GLU 56 1.534 10.677 6.911
424 HG2 GLU 56 HG2 GLU 56 2.636 12.856 5.879
425 HG3 GLU 56 HG3 GLU 56 1.695 12.352 4.455
Start of MODEL 8
1 H1 MET 1 H1 MET 1 -1.060 -13.068 -5.568
2 H2 MET 1 H2 MET 1 -2.124 -14.314 -5.180
3 H3 MET 1 H3 MET 1 -0.502 -14.654 -5.475
4 HA MET 1 HA MET 1 -1.181 -14.666 -3.114
5 HB2 MET 1 HB2 MET 1 0.946 -12.669 -3.954
6 HB3 MET 1 HB3 MET 1 0.868 -13.559 -2.422
7 HG2 MET 1 HG2 MET 1 0.886 -15.653 -4.042
8 HG3 MET 1 HG3 MET 1 1.658 -14.491 -5.146
9 HE1 MET 1 HE1 MET 1 3.248 -16.830 -1.773
10 HE2 MET 1 HE2 MET 1 1.559 -16.457 -2.117
11 HE3 MET 1 HE3 MET 1 2.473 -15.450 -0.994
12 H GLN 2 H GLN 2 -1.591 -13.411 -1.235
13 HA GLN 2 HA GLN 2 -3.069 -10.911 -1.810
14 HB2 GLN 2 HB2 GLN 2 -4.143 -12.577 -0.336
15 HB3 GLN 2 HB3 GLN 2 -2.720 -12.572 0.725
16 HG2 GLN 2 HG2 GLN 2 -3.198 -10.071 1.042
17 HG3 GLN 2 HG3 GLN 2 -4.788 -10.418 0.323
18 HE21 GLN 2 HE21 GLN 2 -3.627 -9.695 3.110
19 HE22 GLN 2 HE22 GLN 2 -4.489 -10.840 4.195
20 H TYR 3 H TYR 3 -2.359 -8.945 -1.287
21 HA TYR 3 HA TYR 3 0.143 -8.588 0.255
22 HB2 TYR 3 HB2 TYR 3 -0.824 -6.904 -2.051
23 HB3 TYR 3 HB3 TYR 3 0.579 -6.528 -1.025
24 HD1 TYR 3 HD1 TYR 3 -0.771 -9.202 -3.266
25 HD2 TYR 3 HD2 TYR 3 2.681 -7.328 -1.624
26 HE1 TYR 3 HE1 TYR 3 0.660 -10.560 -4.732
27 HE2 TYR 3 HE2 TYR 3 4.119 -8.683 -3.089
28 HH TYR 3 HH TYR 3 3.956 -9.913 -5.207
29 H LYS 4 H LYS 4 0.202 -6.809 1.731
30 HA LYS 4 HA LYS 4 -2.416 -5.612 2.301
31 HB2 LYS 4 HB2 LYS 4 -0.165 -6.405 4.155
32 HB3 LYS 4 HB3 LYS 4 -1.565 -5.436 4.661
33 HG2 LYS 4 HG2 LYS 4 -3.042 -7.320 3.933
34 HG3 LYS 4 HG3 LYS 4 -1.576 -8.288 3.643
35 HD2 LYS 4 HD2 LYS 4 -2.254 -6.992 6.299
36 HD3 LYS 4 HD3 LYS 4 -2.672 -8.671 5.876
37 HE2 LYS 4 HE2 LYS 4 -0.361 -9.264 5.646
38 HE3 LYS 4 HE3 LYS 4 0.146 -7.565 5.793
39 HZ1 LYS 4 HZ1 LYS 4 -0.183 -7.590 8.030
40 HZ2 LYS 4 HZ2 LYS 4 0.217 -9.187 7.826
41 HZ3 LYS 4 HZ3 LYS 4 -1.373 -8.747 7.989
42 H LEU 5 H LEU 5 -2.561 -3.456 2.830
43 HA LEU 5 HA LEU 5 0.035 -1.872 2.532
44 HB2 LEU 5 HB2 LEU 5 -1.420 -1.404 0.634
45 HB3 LEU 5 HB3 LEU 5 -2.816 -1.150 1.691
46 HG LEU 5 HG LEU 5 -1.551 0.814 2.701
47 HD11 LEU 5 HD11 LEU 5 0.688 0.316 2.046
48 HD12 LEU 5 HD12 LEU 5 0.201 1.780 1.194
49 HD13 LEU 5 HD13 LEU 5 0.241 0.237 0.342
50 HD21 LEU 5 HD21 LEU 5 -2.258 2.307 0.991
51 HD22 LEU 5 HD22 LEU 5 -3.374 0.942 0.966
52 HD23 LEU 5 HD23 LEU 5 -2.108 1.068 -0.254
53 H VAL 6 H VAL 6 0.425 -0.833 4.424
54 HA VAL 6 HA VAL 6 -1.689 -0.321 6.374
55 HB VAL 6 HB VAL 6 1.310 -0.392 6.829
56 HG11 VAL 6 HG11 VAL 6 0.915 0.133 9.081
57 HG12 VAL 6 HG12 VAL 6 -0.816 -0.181 8.951
58 HG13 VAL 6 HG13 VAL 6 -0.119 1.248 8.188
59 HG21 VAL 6 HG21 VAL 6 -0.883 -2.364 7.368
60 HG22 VAL 6 HG22 VAL 6 0.537 -2.305 8.414
61 HG23 VAL 6 HG23 VAL 6 0.725 -2.626 6.689
62 H ILE 7 H ILE 7 -2.336 1.728 6.609
63 HA ILE 7 HA ILE 7 -0.551 3.864 5.261
64 HB ILE 7 HB ILE 7 -3.537 3.984 5.930
65 HG12 ILE 7 HG12 ILE 7 -2.133 3.927 3.232
66 HG13 ILE 7 HG13 ILE 7 -2.915 2.520 3.983
67 HG21 ILE 7 HG21 ILE 7 -3.200 6.096 4.423
68 HG22 ILE 7 HG22 ILE 7 -1.528 5.984 4.973
69 HG23 ILE 7 HG23 ILE 7 -2.833 6.167 6.145
70 HD11 ILE 7 HD11 ILE 7 -4.343 3.566 2.312
71 HD12 ILE 7 HD12 ILE 7 -4.284 5.091 3.197
72 HD13 ILE 7 HD13 ILE 7 -5.058 3.681 3.920
73 H ASN 8 H ASN 8 0.635 4.871 6.749
74 HA ASN 8 HA ASN 8 -0.544 5.355 9.493
75 HB2 ASN 8 HB2 ASN 8 2.360 5.137 8.552
76 HB3 ASN 8 HB3 ASN 8 1.859 5.608 10.191
77 HD21 ASN 8 HD21 ASN 8 2.497 3.964 11.416
78 HD22 ASN 8 HD22 ASN 8 2.010 2.253 11.149
79 H GLY 9 H GLY 9 -1.756 7.135 8.423
80 HA2 GLY 9 HA2 GLY 9 -0.280 9.409 7.274
81 HA3 GLY 9 HA3 GLY 9 -1.974 9.129 7.249
82 H LYS 10 H LYS 10 -1.157 11.638 7.920
83 HA LYS 10 HA LYS 10 -0.897 12.035 10.799
84 HB2 LYS 10 HB2 LYS 10 -1.709 13.835 8.501
85 HB3 LYS 10 HB3 LYS 10 -1.449 14.382 10.170
86 HG2 LYS 10 HG2 LYS 10 0.723 12.859 8.776
87 HG3 LYS 10 HG3 LYS 10 0.456 14.573 8.377
88 HD2 LYS 10 HD2 LYS 10 0.919 15.272 10.581
89 HD3 LYS 10 HD3 LYS 10 0.730 13.624 11.231
90 HE2 LYS 10 HE2 LYS 10 3.328 13.336 9.756
91 HE3 LYS 10 HE3 LYS 10 2.288 14.762 9.526
92 HZ1 LYS 10 HZ1 LYS 10 3.707 13.916 11.967
93 HZ2 LYS 10 HZ2 LYS 10 2.452 14.999 12.025
94 HZ3 LYS 10 HZ3 LYS 10 3.818 15.362 11.156
95 H THR 11 H THR 11 -3.445 12.020 8.538
96 HA THR 11 HA THR 11 -5.551 12.266 10.621
97 HB THR 11 HB THR 11 -7.031 13.201 8.944
98 HG1 THR 11 HG1 THR 11 -6.368 13.484 6.977
99 HG21 THR 11 HG21 THR 11 -4.530 14.722 9.641
100 HG22 THR 11 HG22 THR 11 -6.105 14.777 10.434
101 HG23 THR 11 HG23 THR 11 -5.907 15.452 8.817
102 H LEU 12 H LEU 12 -4.514 10.208 8.010
103 HA LEU 12 HA LEU 12 -6.880 8.555 8.637
104 HB2 LEU 12 HB2 LEU 12 -6.903 9.385 6.325
105 HB3 LEU 12 HB3 LEU 12 -5.284 8.717 6.071
106 HG LEU 12 HG LEU 12 -6.181 6.435 6.416
107 HD11 LEU 12 HD11 LEU 12 -8.050 7.044 7.895
108 HD12 LEU 12 HD12 LEU 12 -8.573 6.060 6.527
109 HD13 LEU 12 HD13 LEU 12 -8.876 7.797 6.530
110 HD21 LEU 12 HD21 LEU 12 -7.711 8.007 4.335
111 HD22 LEU 12 HD22 LEU 12 -7.364 6.278 4.310
112 HD23 LEU 12 HD23 LEU 12 -6.048 7.443 4.164
113 H LYS 13 H LYS 13 -6.505 6.674 9.641
114 HA LYS 13 HA LYS 13 -3.873 5.402 9.184
115 HB2 LYS 13 HB2 LYS 13 -5.415 5.482 11.772
116 HB3 LYS 13 HB3 LYS 13 -3.900 4.600 11.500
117 HG2 LYS 13 HG2 LYS 13 -2.957 6.933 10.834
118 HG3 LYS 13 HG3 LYS 13 -4.374 7.557 11.714
119 HD2 LYS 13 HD2 LYS 13 -3.692 6.434 13.733
120 HD3 LYS 13 HD3 LYS 13 -2.379 5.589 12.875
121 HE2 LYS 13 HE2 LYS 13 -2.551 8.605 13.064
122 HE3 LYS 13 HE3 LYS 13 -1.713 7.608 14.276
123 HZ1 LYS 13 HZ1 LYS 13 -0.246 6.814 12.581
124 HZ2 LYS 13 HZ2 LYS 13 -0.240 8.472 12.533
125 HZ3 LYS 13 HZ3 LYS 13 -1.076 7.615 11.385
126 H GLY 14 H GLY 14 -4.019 3.134 8.536
127 HA2 GLY 14 HA2 GLY 14 -5.861 1.373 9.547
128 HA3 GLY 14 HA3 GLY 14 -6.718 1.951 8.139
129 H GLU 15 H GLU 15 -6.667 -0.183 7.502
130 HA GLU 15 HA GLU 15 -4.187 -0.875 6.044
131 HB2 GLU 15 HB2 GLU 15 -5.706 -2.557 8.023
132 HB3 GLU 15 HB3 GLU 15 -4.672 -3.292 6.781
133 HG2 GLU 15 HG2 GLU 15 -2.821 -1.756 7.694
134 HG3 GLU 15 HG3 GLU 15 -3.892 -1.534 9.097
135 H THR 16 H THR 16 -4.486 -2.154 4.107
136 HA THR 16 HA THR 16 -7.202 -3.121 3.619
137 HB THR 16 HB THR 16 -7.277 -0.835 2.610
138 HG1 THR 16 HG1 THR 16 -8.573 -2.130 1.503
139 HG21 THR 16 HG21 THR 16 -4.801 -0.846 1.981
140 HG22 THR 16 HG22 THR 16 -5.944 -0.174 0.818
141 HG23 THR 16 HG23 THR 16 -5.289 -1.794 0.577
142 H THR 17 H THR 17 -7.150 -4.376 1.434
143 HA THR 17 HA THR 17 -4.519 -5.628 1.113
144 HB THR 17 HB THR 17 -5.465 -7.856 1.230
145 HG1 THR 17 HG1 THR 17 -7.877 -6.501 1.894
146 HG21 THR 17 HG21 THR 17 -5.538 -8.087 3.491
147 HG22 THR 17 HG22 THR 17 -6.541 -6.654 3.725
148 HG23 THR 17 HG23 THR 17 -4.820 -6.479 3.386
149 H THR 18 H THR 18 -4.323 -6.844 -0.842
150 HA THR 18 HA THR 18 -6.553 -6.629 -2.738
151 HB THR 18 HB THR 18 -5.094 -4.536 -3.125
152 HG1 THR 18 HG1 THR 18 -6.411 -5.119 -4.774
153 HG21 THR 18 HG21 THR 18 -3.247 -6.149 -4.753
154 HG22 THR 18 HG22 THR 18 -2.961 -6.179 -3.012
155 HG23 THR 18 HG23 THR 18 -2.983 -4.642 -3.877
156 H LYS 19 H LYS 19 -6.177 -8.032 -4.633
157 HA LYS 19 HA LYS 19 -4.243 -10.199 -3.998
158 HB2 LYS 19 HB2 LYS 19 -6.724 -10.224 -5.754
159 HB3 LYS 19 HB3 LYS 19 -5.650 -11.604 -5.461
160 HG2 LYS 19 HG2 LYS 19 -6.683 -10.379 -3.002
161 HG3 LYS 19 HG3 LYS 19 -7.955 -11.015 -4.073
162 HD2 LYS 19 HD2 LYS 19 -5.513 -12.596 -3.219
163 HD3 LYS 19 HD3 LYS 19 -7.077 -12.648 -2.368
164 HE2 LYS 19 HE2 LYS 19 -6.980 -13.146 -5.328
165 HE3 LYS 19 HE3 LYS 19 -6.488 -14.436 -4.205
166 HZ1 LYS 19 HZ1 LYS 19 -8.740 -13.812 -3.089
167 HZ2 LYS 19 HZ2 LYS 19 -8.710 -14.828 -4.400
168 HZ3 LYS 19 HZ3 LYS 19 -9.123 -13.233 -4.597
169 H ALA 20 H ALA 20 -2.533 -10.480 -5.444
170 HA ALA 20 HA ALA 20 -2.805 -9.487 -8.110
171 HB1 ALA 20 HB1 ALA 20 -0.589 -8.213 -7.925
172 HB2 ALA 20 HB2 ALA 20 -0.820 -8.285 -6.178
173 HB3 ALA 20 HB3 ALA 20 -1.993 -7.440 -7.190
174 H VAL 21 H VAL 21 -1.191 -10.238 -9.607
175 HA VAL 21 HA VAL 21 -0.023 -12.646 -8.835
176 HB VAL 21 HB VAL 21 0.973 -12.790 -11.040
177 HG11 VAL 21 HG11 VAL 21 -1.466 -13.269 -10.588
178 HG12 VAL 21 HG12 VAL 21 -1.064 -12.870 -12.258
179 HG13 VAL 21 HG13 VAL 21 -1.819 -11.661 -11.221
180 HG21 VAL 21 HG21 VAL 21 -0.160 -10.034 -11.528
181 HG22 VAL 21 HG22 VAL 21 0.866 -10.996 -12.593
182 HG23 VAL 21 HG23 VAL 21 1.528 -10.318 -11.105
183 H ASP 22 H ASP 22 1.399 -9.438 -8.755
184 HA ASP 22 HA ASP 22 3.754 -10.623 -7.563
185 HB2 ASP 22 HB2 ASP 22 5.357 -9.606 -9.159
186 HB3 ASP 22 HB3 ASP 22 4.324 -10.820 -9.945
187 H ALA 23 H ALA 23 5.351 -8.898 -6.822
188 HA ALA 23 HA ALA 23 3.801 -7.127 -5.231
189 HB1 ALA 23 HB1 ALA 23 5.810 -7.839 -4.286
190 HB2 ALA 23 HB2 ALA 23 6.085 -6.139 -4.666
191 HB3 ALA 23 HB3 ALA 23 6.746 -7.393 -5.714
192 H GLU 24 H GLU 24 5.646 -6.594 -8.252
193 HA GLU 24 HA GLU 24 5.528 -3.685 -8.041
194 HB2 GLU 24 HB2 GLU 24 5.727 -5.696 -10.346
195 HB3 GLU 24 HB3 GLU 24 5.695 -3.948 -10.650
196 HG2 GLU 24 HG2 GLU 24 7.649 -3.786 -9.017
197 HG3 GLU 24 HG3 GLU 24 7.756 -5.557 -9.149
198 H THR 25 H THR 25 3.214 -6.011 -9.536
199 HA THR 25 HA THR 25 1.529 -3.848 -10.628
200 HB THR 25 HB THR 25 0.797 -6.737 -9.909
201 HG1 THR 25 HG1 THR 25 1.901 -7.106 -11.647
202 HG21 THR 25 HG21 THR 25 -0.732 -4.607 -11.364
203 HG22 THR 25 HG22 THR 25 -1.272 -5.684 -10.077
204 HG23 THR 25 HG23 THR 25 -0.985 -6.321 -11.696
205 H ALA 26 H ALA 26 1.606 -5.640 -7.447
206 HA ALA 26 HA ALA 26 -0.792 -4.366 -6.369
207 HB1 ALA 26 HB1 ALA 26 0.505 -6.298 -5.330
208 HB2 ALA 26 HB2 ALA 26 -0.020 -5.037 -4.216
209 HB3 ALA 26 HB3 ALA 26 1.659 -5.095 -4.753
210 H GLU 27 H GLU 27 2.605 -3.229 -6.776
211 HA GLU 27 HA GLU 27 2.253 -0.945 -5.203
212 HB2 GLU 27 HB2 GLU 27 4.444 -1.775 -5.973
213 HB3 GLU 27 HB3 GLU 27 4.065 -1.205 -7.610
214 HG2 GLU 27 HG2 GLU 27 3.762 1.104 -6.568
215 HG3 GLU 27 HG3 GLU 27 4.528 0.425 -5.114
216 H LYS 28 H LYS 28 1.728 -1.284 -8.715
217 HA LYS 28 HA LYS 28 1.012 1.475 -9.141
218 HB2 LYS 28 HB2 LYS 28 -0.044 -0.939 -10.629
219 HB3 LYS 28 HB3 LYS 28 -0.024 0.743 -11.195
220 HG2 LYS 28 HG2 LYS 28 2.389 0.738 -11.282
221 HG3 LYS 28 HG3 LYS 28 2.446 -0.893 -10.568
222 HD2 LYS 28 HD2 LYS 28 1.654 -1.908 -12.502
223 HD3 LYS 28 HD3 LYS 28 0.900 -0.411 -13.102
224 HE2 LYS 28 HE2 LYS 28 3.013 0.515 -13.700
225 HE3 LYS 28 HE3 LYS 28 3.893 -0.758 -12.822
226 HZ1 LYS 28 HZ1 LYS 28 3.022 -2.356 -14.428
227 HZ2 LYS 28 HZ2 LYS 28 3.917 -1.177 -15.178
228 HZ3 LYS 28 HZ3 LYS 28 2.261 -1.138 -15.263
229 H ALA 29 H ALA 29 -1.021 -1.354 -8.136
230 HA ALA 29 HA ALA 29 -3.498 0.222 -8.307
231 HB1 ALA 29 HB1 ALA 29 -4.516 -1.588 -7.054
232 HB2 ALA 29 HB2 ALA 29 -2.944 -2.197 -6.536
233 HB3 ALA 29 HB3 ALA 29 -3.412 -2.297 -8.234
234 H PHE 30 H PHE 30 -1.237 -0.556 -5.532
235 HA PHE 30 HA PHE 30 -2.862 0.855 -3.615
236 HB2 PHE 30 HB2 PHE 30 0.061 0.016 -3.683
237 HB3 PHE 30 HB3 PHE 30 -0.681 0.819 -2.282
238 HD1 PHE 30 HD1 PHE 30 -3.263 -0.434 -2.030
239 HD2 PHE 30 HD2 PHE 30 0.464 -2.174 -3.127
240 HE1 PHE 30 HE1 PHE 30 -4.040 -2.615 -1.194
241 HE2 PHE 30 HE2 PHE 30 -0.307 -4.356 -2.294
242 HZ PHE 30 HZ PHE 30 -2.560 -4.578 -1.324
243 H LYS 31 H LYS 31 -0.189 1.987 -5.774
244 HA LYS 31 HA LYS 31 -0.121 4.615 -4.462
245 HB2 LYS 31 HB2 LYS 31 0.594 3.711 -7.269
246 HB3 LYS 31 HB3 LYS 31 0.736 5.398 -6.737
247 HG2 LYS 31 HG2 LYS 31 2.105 4.269 -4.754
248 HG3 LYS 31 HG3 LYS 31 2.355 3.008 -5.987
249 HD2 LYS 31 HD2 LYS 31 3.122 4.815 -7.556
250 HD3 LYS 31 HD3 LYS 31 3.050 5.952 -6.187
251 HE2 LYS 31 HE2 LYS 31 4.850 4.996 -5.119
252 HE3 LYS 31 HE3 LYS 31 4.577 3.399 -5.856
253 HZ1 LYS 31 HZ1 LYS 31 5.561 5.758 -7.347
254 HZ2 LYS 31 HZ2 LYS 31 5.465 4.197 -7.899
255 HZ3 LYS 31 HZ3 LYS 31 6.550 4.588 -6.706
256 H GLN 32 H GLN 32 -2.270 3.259 -6.939
257 HA GLN 32 HA GLN 32 -3.568 5.802 -7.441
258 HB2 GLN 32 HB2 GLN 32 -4.574 2.952 -7.805
259 HB3 GLN 32 HB3 GLN 32 -5.391 4.400 -8.425
260 HG2 GLN 32 HG2 GLN 32 -2.542 3.769 -9.168
261 HG3 GLN 32 HG3 GLN 32 -3.914 3.026 -10.023
262 HE21 GLN 32 HE21 GLN 32 -3.082 4.091 -11.913
263 HE22 GLN 32 HE22 GLN 32 -3.483 5.821 -12.188
264 H TYR 33 H TYR 33 -4.356 3.117 -5.231
265 HA TYR 33 HA TYR 33 -6.773 4.279 -4.187
266 HB2 TYR 33 HB2 TYR 33 -6.028 1.920 -3.772
267 HB3 TYR 33 HB3 TYR 33 -4.652 2.535 -2.831
268 HD1 TYR 33 HD2 TYR 33 -5.152 3.826 -0.696
269 HD2 TYR 33 HD1 TYR 33 -8.107 1.559 -2.752
270 HE1 TYR 33 HE2 TYR 33 -6.528 3.781 1.342
271 HE2 TYR 33 HE1 TYR 33 -9.491 1.509 -0.720
272 HH TYR 33 HH TYR 33 -8.642 1.844 2.096
273 H ALA 34 H ALA 34 -3.406 4.637 -3.017
274 HA ALA 34 HA ALA 34 -3.970 6.403 -0.879
275 HB1 ALA 34 HB1 ALA 34 -1.740 5.236 -1.562
276 HB2 ALA 34 HB2 ALA 34 -1.695 6.806 -0.760
277 HB3 ALA 34 HB3 ALA 34 -1.485 6.702 -2.508
278 H ASN 35 H ASN 35 -3.265 7.144 -4.297
279 HA ASN 35 HA ASN 35 -3.401 10.030 -3.844
280 HB2 ASN 35 HB2 ASN 35 -3.856 8.280 -6.317
281 HB3 ASN 35 HB3 ASN 35 -3.907 10.055 -6.374
282 HD21 ASN 35 HD21 ASN 35 -2.160 8.874 -7.978
283 HD22 ASN 35 HD22 ASN 35 -0.486 9.053 -7.349
284 H ASP 36 H ASP 36 -6.000 7.657 -4.776
285 HA ASP 36 HA ASP 36 -8.005 9.696 -5.125
286 HB2 ASP 36 HB2 ASP 36 -8.266 6.765 -4.432
287 HB3 ASP 36 HB3 ASP 36 -9.660 7.835 -4.700
288 H ASN 37 H ASN 37 -6.635 8.362 -2.204
289 HA ASN 37 HA ASN 37 -8.823 9.711 -0.652
290 HB2 ASN 37 HB2 ASN 37 -6.853 7.528 0.042
291 HB3 ASN 37 HB3 ASN 37 -7.758 8.412 1.290
292 HD21 ASN 37 HD21 ASN 37 -7.930 6.183 -1.401
293 HD22 ASN 37 HD22 ASN 37 -9.600 5.607 -1.063
294 H GLY 38 H GLY 38 -5.943 10.734 -1.796
295 HA2 GLY 38 HA2 GLY 38 -4.949 12.745 -1.207
296 HA3 GLY 38 HA3 GLY 38 -5.929 12.807 0.242
297 H VAL 39 H VAL 39 -3.843 10.067 -0.241
298 HA VAL 39 HA VAL 39 -2.151 11.057 2.045
299 HB VAL 39 HB VAL 39 -2.629 8.236 1.096
300 HG11 VAL 39 HG11 VAL 39 -1.344 8.888 3.695
301 HG12 VAL 39 HG12 VAL 39 -0.369 9.081 2.240
302 HG13 VAL 39 HG13 VAL 39 -1.091 7.517 2.616
303 HG21 VAL 39 HG21 VAL 39 -3.982 7.944 3.009
304 HG22 VAL 39 HG22 VAL 39 -4.524 9.462 2.292
305 HG23 VAL 39 HG23 VAL 39 -3.474 9.481 3.708
306 H ASP 40 H ASP 40 -0.164 11.454 1.839
307 HA ASP 40 HA ASP 40 1.275 10.370 -0.526
308 HB2 ASP 40 HB2 ASP 40 0.399 12.551 -1.144
309 HB3 ASP 40 HB3 ASP 40 1.086 13.278 0.324
310 H GLY 41 H GLY 41 3.057 9.723 -0.289
311 HA2 GLY 41 HA2 GLY 41 4.987 10.772 1.716
312 HA3 GLY 41 HA3 GLY 41 4.131 9.336 2.225
313 H VAL 42 H VAL 42 6.056 8.530 2.724
314 HA VAL 42 HA VAL 42 7.766 7.796 0.462
315 HB VAL 42 HB VAL 42 8.225 7.699 3.441
316 HG11 VAL 42 HG11 VAL 42 9.237 5.748 2.244
317 HG12 VAL 42 HG12 VAL 42 10.399 6.801 3.053
318 HG13 VAL 42 HG13 VAL 42 10.196 6.892 1.305
319 HG21 VAL 42 HG21 VAL 42 10.226 9.174 2.566
320 HG22 VAL 42 HG22 VAL 42 8.636 9.873 2.869
321 HG23 VAL 42 HG23 VAL 42 9.126 9.474 1.225
322 H TRP 43 H TRP 43 8.042 5.696 -0.237
323 HA TRP 43 HA TRP 43 6.150 3.655 1.044
324 HB2 TRP 43 HB2 TRP 43 7.435 3.984 -1.703
325 HB3 TRP 43 HB3 TRP 43 6.578 2.507 -1.209
326 HD1 TRP 43 HD1 TRP 43 5.930 6.243 -1.915
327 HE1 TRP 43 HE1 TRP 43 3.412 6.583 -2.445
328 HE3 TRP 43 HE3 TRP 43 4.310 1.506 -0.887
329 HZ2 TRP 43 HZ2 TRP 43 1.076 4.985 -2.407
330 HZ3 TRP 43 HZ3 TRP 43 1.921 0.991 -1.158
331 HH2 TRP 43 HH2 TRP 43 0.338 2.695 -1.901
332 H THR 44 H THR 44 6.801 1.769 1.857
333 HA THR 44 HA THR 44 9.551 0.866 1.185
334 HB THR 44 HB THR 44 9.667 -0.141 3.544
335 HG1 THR 44 HG1 THR 44 7.536 1.700 3.896
336 HG21 THR 44 HG21 THR 44 10.943 1.891 2.838
337 HG22 THR 44 HG22 THR 44 10.577 1.794 4.561
338 HG23 THR 44 HG23 THR 44 9.642 2.869 3.520
339 H TYR 45 H TYR 45 9.764 -1.455 1.257
340 HA TYR 45 HA TYR 45 7.308 -2.987 1.392
341 HB2 TYR 45 HB2 TYR 45 7.675 -2.547 -0.962
342 HB3 TYR 45 HB3 TYR 45 9.347 -3.131 -0.814
343 HD1 TYR 45 HD1 TYR 45 6.133 -4.584 0.442
344 HD2 TYR 45 HD2 TYR 45 9.496 -5.037 -2.125
345 HE1 TYR 45 HE1 TYR 45 5.385 -6.855 -0.130
346 HE2 TYR 45 HE2 TYR 45 8.757 -7.310 -2.705
347 HH TYR 45 HH TYR 45 7.333 -9.108 -1.640
348 H ASP 46 H ASP 46 7.375 -4.866 2.454
349 HA ASP 46 HA ASP 46 10.059 -5.946 3.064
350 HB2 ASP 46 HB2 ASP 46 8.866 -5.219 5.112
351 HB3 ASP 46 HB3 ASP 46 7.471 -6.220 4.651
352 H ASP 47 H ASP 47 10.445 -7.548 1.671
353 HA ASP 47 HA ASP 47 8.335 -8.921 0.258
354 HB2 ASP 47 HB2 ASP 47 10.704 -8.632 -0.544
355 HB3 ASP 47 HB3 ASP 47 11.205 -9.850 0.649
356 H ALA 48 H ALA 48 9.933 -9.702 3.381
357 HA ALA 48 HA ALA 48 9.159 -12.540 3.273
358 HB1 ALA 48 HB1 ALA 48 9.708 -10.638 5.607
359 HB2 ALA 48 HB2 ALA 48 10.874 -11.704 4.822
360 HB3 ALA 48 HB3 ALA 48 9.545 -12.386 5.760
361 H THR 49 H THR 49 7.451 -9.629 4.375
362 HA THR 49 HA THR 49 5.113 -11.461 5.157
363 HB THR 49 HB THR 49 4.168 -9.513 6.394
364 HG1 THR 49 HG1 THR 49 6.498 -8.118 5.544
365 HG21 THR 49 HG21 THR 49 5.377 -9.972 8.185
366 HG22 THR 49 HG22 THR 49 6.771 -9.117 7.526
367 HG23 THR 49 HG23 THR 49 6.527 -10.823 7.152
368 H LYS 50 H LYS 50 6.116 -9.766 2.475
369 HA LYS 50 HA LYS 50 5.010 -8.784 0.675
370 HB2 LYS 50 HB2 LYS 50 2.677 -10.524 1.636
371 HB3 LYS 50 HB3 LYS 50 2.796 -9.750 0.044
372 HG2 LYS 50 HG2 LYS 50 4.883 -11.694 1.024
373 HG3 LYS 50 HG3 LYS 50 3.389 -12.236 0.219
374 HD2 LYS 50 HD2 LYS 50 4.004 -10.617 -1.659
375 HD3 LYS 50 HD3 LYS 50 5.605 -10.499 -0.889
376 HE2 LYS 50 HE2 LYS 50 6.190 -12.630 -1.466
377 HE3 LYS 50 HE3 LYS 50 4.517 -13.232 -1.378
378 HZ1 LYS 50 HZ1 LYS 50 4.060 -12.223 -3.477
379 HZ2 LYS 50 HZ2 LYS 50 5.428 -13.144 -3.649
380 HZ3 LYS 50 HZ3 LYS 50 5.550 -11.493 -3.539
381 H THR 51 H THR 51 5.050 -7.196 2.884
382 HA THR 51 HA THR 51 2.480 -5.805 2.746
383 HB THR 51 HB THR 51 4.489 -5.925 4.985
384 HG1 THR 51 HG1 THR 51 1.828 -6.892 4.749
385 HG21 THR 51 HG21 THR 51 3.341 -3.704 4.780
386 HG22 THR 51 HG22 THR 51 3.056 -4.564 6.293
387 HG23 THR 51 HG23 THR 51 1.813 -4.546 5.041
388 H PHE 52 H PHE 52 2.328 -3.797 2.095
389 HA PHE 52 HA PHE 52 4.995 -2.288 1.539
390 HB2 PHE 52 HB2 PHE 52 2.107 -2.041 0.449
391 HB3 PHE 52 HB3 PHE 52 3.373 -0.821 0.191
392 HD1 PHE 52 HD2 PHE 52 5.332 -1.349 -1.184
393 HD2 PHE 52 HD1 PHE 52 2.120 -4.109 -0.743
394 HE1 PHE 52 HE2 PHE 52 6.140 -2.598 -3.146
395 HE2 PHE 52 HE1 PHE 52 2.922 -5.362 -2.703
396 HZ PHE 52 HZ PHE 52 4.934 -4.606 -3.907
397 H THR 53 H THR 53 5.108 -0.339 2.795
398 HA THR 53 HA THR 53 2.824 0.447 4.505
399 HB THR 53 HB THR 53 5.782 0.608 5.228
400 HG1 THR 53 HG1 THR 53 5.335 -1.374 5.810
401 HG21 THR 53 HG21 THR 53 5.302 1.873 7.001
402 HG22 THR 53 HG22 THR 53 3.794 1.020 7.332
403 HG23 THR 53 HG23 THR 53 3.836 2.298 6.118
404 H VAL 54 H VAL 54 2.306 2.600 4.429
405 HA VAL 54 HA VAL 54 4.333 4.345 2.938
406 HB VAL 54 HB VAL 54 2.369 4.029 1.470
407 HG11 VAL 54 HG11 VAL 54 0.143 4.602 2.079
408 HG12 VAL 54 HG12 VAL 54 0.660 5.268 3.628
409 HG13 VAL 54 HG13 VAL 54 0.754 3.531 3.340
410 HG21 VAL 54 HG21 VAL 54 1.637 6.490 1.410
411 HG22 VAL 54 HG22 VAL 54 3.356 6.140 1.235
412 HG23 VAL 54 HG23 VAL 54 2.726 6.716 2.778
413 H THR 55 H THR 55 5.065 5.834 4.333
414 HA THR 55 HA THR 55 3.455 6.495 6.770
415 HB THR 55 HB THR 55 6.468 6.488 6.408
416 HG1 THR 55 HG1 THR 55 4.823 4.764 7.957
417 HG21 THR 55 HG21 THR 55 4.968 6.785 8.990
418 HG22 THR 55 HG22 THR 55 5.623 8.147 8.079
419 HG23 THR 55 HG23 THR 55 6.704 6.905 8.709
420 H GLU 56 H GLU 56 2.802 8.546 6.891
421 HA GLU 56 HA GLU 56 3.886 10.613 4.982
422 HB2 GLU 56 HB2 GLU 56 1.431 10.213 5.204
423 HB3 GLU 56 HB3 GLU 56 1.534 10.679 6.912
424 HG2 GLU 56 HG2 GLU 56 2.023 12.911 6.392
425 HG3 GLU 56 HG3 GLU 56 2.438 12.517 4.707
Start of MODEL 9
1 H1 MET 1 H1 MET 1 -1.060 -13.068 -5.568
2 H2 MET 1 H2 MET 1 -2.124 -14.314 -5.180
3 H3 MET 1 H3 MET 1 -0.502 -14.654 -5.475
4 HA MET 1 HA MET 1 -1.181 -14.666 -3.114
5 HB2 MET 1 HB2 MET 1 0.946 -12.669 -3.955
6 HB3 MET 1 HB3 MET 1 0.868 -13.559 -2.422
7 HG2 MET 1 HG2 MET 1 0.934 -15.671 -3.945
8 HG3 MET 1 HG3 MET 1 1.566 -14.546 -5.169
9 HE1 MET 1 HE1 MET 1 3.523 -16.633 -1.831
10 HE2 MET 1 HE2 MET 1 1.795 -16.357 -2.059
11 HE3 MET 1 HE3 MET 1 2.740 -15.258 -1.054
12 H GLN 2 H GLN 2 -1.591 -13.411 -1.235
13 HA GLN 2 HA GLN 2 -3.069 -10.911 -1.810
14 HB2 GLN 2 HB2 GLN 2 -2.950 -12.922 0.407
15 HB3 GLN 2 HB3 GLN 2 -3.274 -11.241 0.877
16 HG2 GLN 2 HG2 GLN 2 -5.291 -11.173 -0.271
17 HG3 GLN 2 HG3 GLN 2 -4.861 -12.547 -1.316
18 HE21 GLN 2 HE21 GLN 2 -7.291 -12.270 0.097
19 HE22 GLN 2 HE22 GLN 2 -7.360 -13.590 1.315
20 H TYR 3 H TYR 3 -2.359 -8.945 -1.287
21 HA TYR 3 HA TYR 3 0.143 -8.588 0.255
22 HB2 TYR 3 HB2 TYR 3 -0.824 -6.907 -2.053
23 HB3 TYR 3 HB3 TYR 3 0.576 -6.526 -1.025
24 HD1 TYR 3 HD1 TYR 3 -0.764 -9.206 -3.265
25 HD2 TYR 3 HD2 TYR 3 2.681 -7.322 -1.620
26 HE1 TYR 3 HE1 TYR 3 0.673 -10.563 -4.727
27 HE2 TYR 3 HE2 TYR 3 4.125 -8.675 -3.081
28 HH TYR 3 HH TYR 3 3.968 -9.909 -5.197
29 H LYS 4 H LYS 4 0.202 -6.809 1.731
30 HA LYS 4 HA LYS 4 -2.416 -5.612 2.301
31 HB2 LYS 4 HB2 LYS 4 -1.651 -7.201 4.021
32 HB3 LYS 4 HB3 LYS 4 -0.157 -6.261 4.207
33 HG2 LYS 4 HG2 LYS 4 -1.557 -4.301 4.886
34 HG3 LYS 4 HG3 LYS 4 -2.977 -5.377 4.865
35 HD2 LYS 4 HD2 LYS 4 -0.486 -5.889 6.516
36 HD3 LYS 4 HD3 LYS 4 -1.931 -5.048 7.131
37 HE2 LYS 4 HE2 LYS 4 -3.291 -6.993 6.797
38 HE3 LYS 4 HE3 LYS 4 -1.983 -7.826 5.925
39 HZ1 LYS 4 HZ1 LYS 4 -0.892 -8.274 7.854
40 HZ2 LYS 4 HZ2 LYS 4 -2.441 -8.277 8.446
41 HZ3 LYS 4 HZ3 LYS 4 -1.476 -6.947 8.663
42 H LEU 5 H LEU 5 -2.561 -3.456 2.830
43 HA LEU 5 HA LEU 5 0.035 -1.872 2.532
44 HB2 LEU 5 HB2 LEU 5 -1.416 -1.401 0.635
45 HB3 LEU 5 HB3 LEU 5 -2.816 -1.153 1.688
46 HG LEU 5 HG LEU 5 -1.559 0.812 2.704
47 HD11 LEU 5 HD11 LEU 5 0.683 0.322 2.054
48 HD12 LEU 5 HD12 LEU 5 0.194 1.787 1.204
49 HD13 LEU 5 HD13 LEU 5 0.240 0.245 0.349
50 HD21 LEU 5 HD21 LEU 5 -2.266 2.307 0.996
51 HD22 LEU 5 HD22 LEU 5 -3.378 0.938 0.966
52 HD23 LEU 5 HD23 LEU 5 -2.110 1.070 -0.251
53 H VAL 6 H VAL 6 0.425 -0.833 4.424
54 HA VAL 6 HA VAL 6 -1.689 -0.321 6.374
55 HB VAL 6 HB VAL 6 1.310 -0.391 6.830
56 HG11 VAL 6 HG11 VAL 6 0.914 0.132 9.081
57 HG12 VAL 6 HG12 VAL 6 -0.817 -0.183 8.951
58 HG13 VAL 6 HG13 VAL 6 -0.121 1.247 8.189
59 HG21 VAL 6 HG21 VAL 6 -0.881 -2.365 7.366
60 HG22 VAL 6 HG22 VAL 6 0.538 -2.306 8.413
61 HG23 VAL 6 HG23 VAL 6 0.726 -2.625 6.688
62 H ILE 7 H ILE 7 -2.336 1.728 6.609
63 HA ILE 7 HA ILE 7 -0.551 3.864 5.261
64 HB ILE 7 HB ILE 7 -3.537 3.985 5.931
65 HG12 ILE 7 HG12 ILE 7 -2.134 3.925 3.232
66 HG13 ILE 7 HG13 ILE 7 -2.916 2.518 3.985
67 HG21 ILE 7 HG21 ILE 7 -3.200 6.095 4.421
68 HG22 ILE 7 HG22 ILE 7 -1.527 5.983 4.970
69 HG23 ILE 7 HG23 ILE 7 -2.831 6.168 6.143
70 HD11 ILE 7 HD11 ILE 7 -4.345 3.564 2.313
71 HD12 ILE 7 HD12 ILE 7 -4.284 5.090 3.197
72 HD13 ILE 7 HD13 ILE 7 -5.059 3.681 3.922
73 H ASN 8 H ASN 8 0.635 4.871 6.749
74 HA ASN 8 HA ASN 8 -0.544 5.355 9.493
75 HB2 ASN 8 HB2 ASN 8 1.548 3.939 9.333
76 HB3 ASN 8 HB3 ASN 8 2.396 5.348 8.658
77 HD21 ASN 8 HD21 ASN 8 3.310 4.127 10.924
78 HD22 ASN 8 HD22 ASN 8 3.036 5.214 12.331
79 H GLY 9 H GLY 9 -1.756 7.135 8.423
80 HA2 GLY 9 HA2 GLY 9 -0.280 9.409 7.274
81 HA3 GLY 9 HA3 GLY 9 -1.974 9.129 7.249
82 H LYS 10 H LYS 10 -1.157 11.638 7.920
83 HA LYS 10 HA LYS 10 -0.897 12.035 10.799
84 HB2 LYS 10 HB2 LYS 10 -1.709 13.835 8.501
85 HB3 LYS 10 HB3 LYS 10 -1.448 14.382 10.170
86 HG2 LYS 10 HG2 LYS 10 0.723 12.858 8.775
87 HG3 LYS 10 HG3 LYS 10 0.456 14.572 8.376
88 HD2 LYS 10 HD2 LYS 10 0.748 15.196 10.710
89 HD3 LYS 10 HD3 LYS 10 0.900 13.483 11.173
90 HE2 LYS 10 HE2 LYS 10 3.381 13.763 9.582
91 HE3 LYS 10 HE3 LYS 10 2.170 15.065 9.497
92 HZ1 LYS 10 HZ1 LYS 10 3.785 14.227 11.817
93 HZ2 LYS 10 HZ2 LYS 10 2.415 15.143 12.000
94 HZ3 LYS 10 HZ3 LYS 10 3.689 15.728 11.113
95 H THR 11 H THR 11 -3.445 12.020 8.538
96 HA THR 11 HA THR 11 -5.551 12.266 10.621
97 HB THR 11 HB THR 11 -5.472 13.462 7.913
98 HG1 THR 11 HG1 THR 11 -5.510 15.223 9.047
99 HG21 THR 11 HG21 THR 11 -7.894 12.760 9.554
100 HG22 THR 11 HG22 THR 11 -7.570 12.388 7.860
101 HG23 THR 11 HG23 THR 11 -7.880 14.052 8.355
102 H LEU 12 H LEU 12 -4.514 10.208 8.010
103 HA LEU 12 HA LEU 12 -6.880 8.555 8.637
104 HB2 LEU 12 HB2 LEU 12 -6.906 9.383 6.325
105 HB3 LEU 12 HB3 LEU 12 -5.285 8.720 6.071
106 HG LEU 12 HG LEU 12 -6.175 6.436 6.415
107 HD11 LEU 12 HD11 LEU 12 -8.046 7.039 7.894
108 HD12 LEU 12 HD12 LEU 12 -8.566 6.054 6.526
109 HD13 LEU 12 HD13 LEU 12 -8.874 7.790 6.530
110 HD21 LEU 12 HD21 LEU 12 -7.710 8.004 4.335
111 HD22 LEU 12 HD22 LEU 12 -7.359 6.276 4.309
112 HD23 LEU 12 HD23 LEU 12 -6.046 7.444 4.163
113 H LYS 13 H LYS 13 -6.505 6.674 9.641
114 HA LYS 13 HA LYS 13 -3.873 5.402 9.184
115 HB2 LYS 13 HB2 LYS 13 -5.415 5.479 11.772
116 HB3 LYS 13 HB3 LYS 13 -3.898 4.601 11.500
117 HG2 LYS 13 HG2 LYS 13 -2.961 6.937 10.835
118 HG3 LYS 13 HG3 LYS 13 -4.380 7.557 11.715
119 HD2 LYS 13 HD2 LYS 13 -3.694 6.435 13.733
120 HD3 LYS 13 HD3 LYS 13 -2.379 5.594 12.874
121 HE2 LYS 13 HE2 LYS 13 -2.559 8.609 13.065
122 HE3 LYS 13 HE3 LYS 13 -1.718 7.614 14.277
123 HZ1 LYS 13 HZ1 LYS 13 -0.250 6.825 12.581
124 HZ2 LYS 13 HZ2 LYS 13 -0.248 8.482 12.534
125 HZ3 LYS 13 HZ3 LYS 13 -1.082 7.624 11.386
126 H GLY 14 H GLY 14 -4.019 3.134 8.536
127 HA2 GLY 14 HA2 GLY 14 -5.861 1.373 9.547
128 HA3 GLY 14 HA3 GLY 14 -6.718 1.951 8.139
129 H GLU 15 H GLU 15 -6.667 -0.183 7.502
130 HA GLU 15 HA GLU 15 -4.187 -0.875 6.044
131 HB2 GLU 15 HB2 GLU 15 -3.939 -2.191 7.972
132 HB3 GLU 15 HB3 GLU 15 -5.682 -2.518 8.064
133 HG2 GLU 15 HG2 GLU 15 -5.448 -3.858 5.951
134 HG3 GLU 15 HG3 GLU 15 -3.686 -3.664 6.104
135 H THR 16 H THR 16 -4.486 -2.154 4.107
136 HA THR 16 HA THR 16 -7.202 -3.121 3.619
137 HB THR 16 HB THR 16 -7.278 -0.836 2.610
138 HG1 THR 16 HG1 THR 16 -8.572 -2.131 1.501
139 HG21 THR 16 HG21 THR 16 -4.801 -0.844 1.983
140 HG22 THR 16 HG22 THR 16 -5.944 -0.173 0.819
141 HG23 THR 16 HG23 THR 16 -5.288 -1.792 0.578
142 H THR 17 H THR 17 -7.150 -4.376 1.434
143 HA THR 17 HA THR 17 -4.519 -5.628 1.113
144 HB THR 17 HB THR 17 -5.466 -7.856 1.229
145 HG1 THR 17 HG1 THR 17 -7.877 -6.501 1.895
146 HG21 THR 17 HG21 THR 17 -5.537 -8.088 3.490
147 HG22 THR 17 HG22 THR 17 -6.539 -6.654 3.726
148 HG23 THR 17 HG23 THR 17 -4.819 -6.480 3.386
149 H THR 18 H THR 18 -4.323 -6.844 -0.842
150 HA THR 18 HA THR 18 -6.553 -6.629 -2.738
151 HB THR 18 HB THR 18 -5.092 -4.536 -3.123
152 HG1 THR 18 HG1 THR 18 -6.412 -5.116 -4.770
153 HG21 THR 18 HG21 THR 18 -3.250 -6.150 -4.756
154 HG22 THR 18 HG22 THR 18 -2.961 -6.183 -3.016
155 HG23 THR 18 HG23 THR 18 -2.982 -4.645 -3.879
156 H LYS 19 H LYS 19 -6.177 -8.032 -4.633
157 HA LYS 19 HA LYS 19 -4.243 -10.199 -3.998
158 HB2 LYS 19 HB2 LYS 19 -6.723 -10.225 -5.757
159 HB3 LYS 19 HB3 LYS 19 -5.650 -11.605 -5.459
160 HG2 LYS 19 HG2 LYS 19 -6.687 -10.374 -3.004
161 HG3 LYS 19 HG3 LYS 19 -7.957 -11.012 -4.076
162 HD2 LYS 19 HD2 LYS 19 -5.517 -12.593 -3.214
163 HD3 LYS 19 HD3 LYS 19 -7.083 -12.642 -2.365
164 HE2 LYS 19 HE2 LYS 19 -6.981 -13.147 -5.324
165 HE3 LYS 19 HE3 LYS 19 -6.492 -14.434 -4.198
166 HZ1 LYS 19 HZ1 LYS 19 -8.745 -13.806 -3.087
167 HZ2 LYS 19 HZ2 LYS 19 -8.714 -14.825 -4.396
168 HZ3 LYS 19 HZ3 LYS 19 -9.125 -13.230 -4.597
169 H ALA 20 H ALA 20 -2.533 -10.480 -5.444
170 HA ALA 20 HA ALA 20 -2.805 -9.487 -8.110
171 HB1 ALA 20 HB1 ALA 20 -0.589 -8.213 -7.925
172 HB2 ALA 20 HB2 ALA 20 -0.820 -8.285 -6.178
173 HB3 ALA 20 HB3 ALA 20 -1.993 -7.440 -7.190
174 H VAL 21 H VAL 21 -1.191 -10.238 -9.607
175 HA VAL 21 HA VAL 21 -0.023 -12.646 -8.835
176 HB VAL 21 HB VAL 21 -0.780 -12.214 -11.110
177 HG11 VAL 21 HG11 VAL 21 0.227 -9.899 -11.166
178 HG12 VAL 21 HG12 VAL 21 0.492 -10.880 -12.607
179 HG13 VAL 21 HG13 VAL 21 1.791 -10.670 -11.434
180 HG21 VAL 21 HG21 VAL 21 2.146 -12.959 -11.079
181 HG22 VAL 21 HG22 VAL 21 0.888 -13.527 -12.177
182 HG23 VAL 21 HG23 VAL 21 0.875 -14.028 -10.485
183 H ASP 22 H ASP 22 1.399 -9.438 -8.755
184 HA ASP 22 HA ASP 22 3.754 -10.623 -7.563
185 HB2 ASP 22 HB2 ASP 22 5.356 -9.604 -9.159
186 HB3 ASP 22 HB3 ASP 22 4.325 -10.821 -9.944
187 H ALA 23 H ALA 23 5.351 -8.898 -6.822
188 HA ALA 23 HA ALA 23 3.801 -7.127 -5.231
189 HB1 ALA 23 HB1 ALA 23 5.810 -7.839 -4.286
190 HB2 ALA 23 HB2 ALA 23 6.085 -6.139 -4.666
191 HB3 ALA 23 HB3 ALA 23 6.746 -7.393 -5.714
192 H GLU 24 H GLU 24 5.646 -6.594 -8.252
193 HA GLU 24 HA GLU 24 5.528 -3.685 -8.041
194 HB2 GLU 24 HB2 GLU 24 5.725 -5.695 -10.347
195 HB3 GLU 24 HB3 GLU 24 5.696 -3.946 -10.649
196 HG2 GLU 24 HG2 GLU 24 7.651 -3.790 -9.016
197 HG3 GLU 24 HG3 GLU 24 7.754 -5.561 -9.150
198 H THR 25 H THR 25 3.214 -6.011 -9.536
199 HA THR 25 HA THR 25 1.529 -3.848 -10.628
200 HB THR 25 HB THR 25 0.798 -6.737 -9.909
201 HG1 THR 25 HG1 THR 25 1.901 -7.106 -11.648
202 HG21 THR 25 HG21 THR 25 -0.733 -4.607 -11.363
203 HG22 THR 25 HG22 THR 25 -1.272 -5.685 -10.076
204 HG23 THR 25 HG23 THR 25 -0.985 -6.321 -11.696
205 H ALA 26 H ALA 26 1.606 -5.640 -7.447
206 HA ALA 26 HA ALA 26 -0.792 -4.366 -6.369
207 HB1 ALA 26 HB1 ALA 26 0.505 -6.298 -5.330
208 HB2 ALA 26 HB2 ALA 26 -0.020 -5.037 -4.216
209 HB3 ALA 26 HB3 ALA 26 1.659 -5.095 -4.753
210 H GLU 27 H GLU 27 2.605 -3.229 -6.776
211 HA GLU 27 HA GLU 27 2.253 -0.945 -5.203
212 HB2 GLU 27 HB2 GLU 27 4.444 -1.775 -5.973
213 HB3 GLU 27 HB3 GLU 27 4.065 -1.204 -7.610
214 HG2 GLU 27 HG2 GLU 27 3.762 1.104 -6.568
215 HG3 GLU 27 HG3 GLU 27 4.529 0.425 -5.114
216 H LYS 28 H LYS 28 1.728 -1.284 -8.715
217 HA LYS 28 HA LYS 28 1.012 1.475 -9.141
218 HB2 LYS 28 HB2 LYS 28 -0.041 -0.940 -10.628
219 HB3 LYS 28 HB3 LYS 28 -0.027 0.741 -11.194
220 HG2 LYS 28 HG2 LYS 28 2.386 0.743 -11.284
221 HG3 LYS 28 HG3 LYS 28 2.449 -0.888 -10.570
222 HD2 LYS 28 HD2 LYS 28 1.657 -1.905 -12.503
223 HD3 LYS 28 HD3 LYS 28 0.898 -0.409 -13.103
224 HE2 LYS 28 HE2 LYS 28 3.009 0.523 -13.702
225 HE3 LYS 28 HE3 LYS 28 3.893 -0.748 -12.826
226 HZ1 LYS 28 HZ1 LYS 28 3.025 -2.348 -14.430
227 HZ2 LYS 28 HZ2 LYS 28 3.916 -1.167 -15.182
228 HZ3 LYS 28 HZ3 LYS 28 2.260 -1.132 -15.265
229 H ALA 29 H ALA 29 -1.021 -1.354 -8.136
230 HA ALA 29 HA ALA 29 -3.498 0.222 -8.307
231 HB1 ALA 29 HB1 ALA 29 -4.516 -1.588 -7.054
232 HB2 ALA 29 HB2 ALA 29 -2.944 -2.197 -6.536
233 HB3 ALA 29 HB3 ALA 29 -3.412 -2.297 -8.234
234 H PHE 30 H PHE 30 -1.237 -0.556 -5.532
235 HA PHE 30 HA PHE 30 -2.862 0.855 -3.615
236 HB2 PHE 30 HB2 PHE 30 0.061 0.017 -3.682
237 HB3 PHE 30 HB3 PHE 30 -0.682 0.818 -2.282
238 HD1 PHE 30 HD1 PHE 30 -3.263 -0.436 -2.031
239 HD2 PHE 30 HD2 PHE 30 0.465 -2.173 -3.127
240 HE1 PHE 30 HE1 PHE 30 -4.039 -2.617 -1.196
241 HE2 PHE 30 HE2 PHE 30 -0.305 -4.356 -2.296
242 HZ PHE 30 HZ PHE 30 -2.559 -4.580 -1.326
243 H LYS 31 H LYS 31 -0.189 1.987 -5.774
244 HA LYS 31 HA LYS 31 -0.121 4.615 -4.462
245 HB2 LYS 31 HB2 LYS 31 0.595 3.710 -7.269
246 HB3 LYS 31 HB3 LYS 31 0.736 5.398 -6.738
247 HG2 LYS 31 HG2 LYS 31 2.105 4.270 -4.754
248 HG3 LYS 31 HG3 LYS 31 2.355 3.009 -5.986
249 HD2 LYS 31 HD2 LYS 31 3.122 4.816 -7.556
250 HD3 LYS 31 HD3 LYS 31 3.050 5.953 -6.187
251 HE2 LYS 31 HE2 LYS 31 4.850 4.998 -5.119
252 HE3 LYS 31 HE3 LYS 31 4.577 3.401 -5.855
253 HZ1 LYS 31 HZ1 LYS 31 5.561 5.759 -7.347
254 HZ2 LYS 31 HZ2 LYS 31 5.465 4.198 -7.898
255 HZ3 LYS 31 HZ3 LYS 31 6.550 4.590 -6.706
256 H GLN 32 H GLN 32 -2.270 3.259 -6.939
257 HA GLN 32 HA GLN 32 -3.568 5.802 -7.441
258 HB2 GLN 32 HB2 GLN 32 -3.785 4.001 -9.057
259 HB3 GLN 32 HB3 GLN 32 -4.505 2.933 -7.836
260 HG2 GLN 32 HG2 GLN 32 -6.269 3.702 -9.217
261 HG3 GLN 32 HG3 GLN 32 -6.409 4.566 -7.668
262 HE21 GLN 32 HE21 GLN 32 -5.402 6.736 -7.568
263 HE22 GLN 32 HE22 GLN 32 -5.511 7.761 -9.041
264 H TYR 33 H TYR 33 -4.356 3.117 -5.231
265 HA TYR 33 HA TYR 33 -6.773 4.279 -4.187
266 HB2 TYR 33 HB2 TYR 33 -6.029 1.920 -3.772
267 HB3 TYR 33 HB3 TYR 33 -4.652 2.534 -2.832
268 HD1 TYR 33 HD2 TYR 33 -5.149 3.825 -0.696
269 HD2 TYR 33 HD1 TYR 33 -8.107 1.561 -2.750
270 HE1 TYR 33 HE2 TYR 33 -6.523 3.781 1.343
271 HE2 TYR 33 HE1 TYR 33 -9.489 1.511 -0.716
272 HH TYR 33 HH TYR 33 -8.638 1.846 2.099
273 H ALA 34 H ALA 34 -3.406 4.637 -3.017
274 HA ALA 34 HA ALA 34 -3.970 6.403 -0.879
275 HB1 ALA 34 HB1 ALA 34 -1.740 5.236 -1.562
276 HB2 ALA 34 HB2 ALA 34 -1.695 6.806 -0.760
277 HB3 ALA 34 HB3 ALA 34 -1.485 6.702 -2.508
278 H ASN 35 H ASN 35 -3.265 7.144 -4.297
279 HA ASN 35 HA ASN 35 -3.401 10.030 -3.844
280 HB2 ASN 35 HB2 ASN 35 -2.432 8.933 -5.894
281 HB3 ASN 35 HB3 ASN 35 -4.067 8.439 -6.385
282 HD21 ASN 35 HD21 ASN 35 -4.429 9.574 -8.167
283 HD22 ASN 35 HD22 ASN 35 -4.336 11.366 -8.270
284 H ASP 36 H ASP 36 -6.000 7.657 -4.776
285 HA ASP 36 HA ASP 36 -8.005 9.696 -5.125
286 HB2 ASP 36 HB2 ASP 36 -8.265 6.765 -4.434
287 HB3 ASP 36 HB3 ASP 36 -9.659 7.834 -4.699
288 H ASN 37 H ASN 37 -6.635 8.362 -2.204
289 HA ASN 37 HA ASN 37 -8.823 9.711 -0.652
290 HB2 ASN 37 HB2 ASN 37 -6.854 7.527 0.041
291 HB3 ASN 37 HB3 ASN 37 -7.756 8.412 1.290
292 HD21 ASN 37 HD21 ASN 37 -7.935 6.183 -1.401
293 HD22 ASN 37 HD22 ASN 37 -9.604 5.609 -1.060
294 H GLY 38 H GLY 38 -5.943 10.734 -1.796
295 HA2 GLY 38 HA2 GLY 38 -4.949 12.745 -1.207
296 HA3 GLY 38 HA3 GLY 38 -5.929 12.807 0.242
297 H VAL 39 H VAL 39 -3.843 10.067 -0.241
298 HA VAL 39 HA VAL 39 -2.151 11.057 2.045
299 HB VAL 39 HB VAL 39 -2.632 8.237 1.096
300 HG11 VAL 39 HG11 VAL 39 -1.340 8.886 3.693
301 HG12 VAL 39 HG12 VAL 39 -0.368 9.079 2.236
302 HG13 VAL 39 HG13 VAL 39 -1.091 7.515 2.613
303 HG21 VAL 39 HG21 VAL 39 -3.981 7.945 3.012
304 HG22 VAL 39 HG22 VAL 39 -4.523 9.464 2.296
305 HG23 VAL 39 HG23 VAL 39 -3.470 9.481 3.710
306 H ASP 40 H ASP 40 -0.164 11.454 1.839
307 HA ASP 40 HA ASP 40 1.275 10.370 -0.526
308 HB2 ASP 40 HB2 ASP 40 0.264 12.993 -0.256
309 HB3 ASP 40 HB3 ASP 40 2.019 13.115 -0.004
310 H GLY 41 H GLY 41 3.057 9.723 -0.289
311 HA2 GLY 41 HA2 GLY 41 4.987 10.772 1.716
312 HA3 GLY 41 HA3 GLY 41 4.131 9.336 2.225
313 H VAL 42 H VAL 42 6.056 8.530 2.724
314 HA VAL 42 HA VAL 42 7.766 7.796 0.462
315 HB VAL 42 HB VAL 42 8.224 7.700 3.441
316 HG11 VAL 42 HG11 VAL 42 9.235 5.747 2.247
317 HG12 VAL 42 HG12 VAL 42 10.398 6.800 3.055
318 HG13 VAL 42 HG13 VAL 42 10.196 6.889 1.306
319 HG21 VAL 42 HG21 VAL 42 10.227 9.173 2.565
320 HG22 VAL 42 HG22 VAL 42 8.638 9.873 2.867
321 HG23 VAL 42 HG23 VAL 42 9.128 9.473 1.223
322 H TRP 43 H TRP 43 8.042 5.696 -0.237
323 HA TRP 43 HA TRP 43 6.150 3.655 1.044
324 HB2 TRP 43 HB2 TRP 43 7.436 3.983 -1.703
325 HB3 TRP 43 HB3 TRP 43 6.576 2.507 -1.208
326 HD1 TRP 43 HD1 TRP 43 5.935 6.244 -1.916
327 HE1 TRP 43 HE1 TRP 43 3.418 6.587 -2.448
328 HE3 TRP 43 HE3 TRP 43 4.307 1.510 -0.887
329 HZ2 TRP 43 HZ2 TRP 43 1.079 4.993 -2.409
330 HZ3 TRP 43 HZ3 TRP 43 1.917 0.998 -1.159
331 HH2 TRP 43 HH2 TRP 43 0.337 2.705 -1.902
332 H THR 44 H THR 44 6.801 1.769 1.857
333 HA THR 44 HA THR 44 9.551 0.866 1.185
334 HB THR 44 HB THR 44 9.667 -0.141 3.544
335 HG1 THR 44 HG1 THR 44 7.537 1.700 3.896
336 HG21 THR 44 HG21 THR 44 10.944 1.890 2.838
337 HG22 THR 44 HG22 THR 44 10.578 1.794 4.561
338 HG23 THR 44 HG23 THR 44 9.643 2.869 3.520
339 H TYR 45 H TYR 45 9.764 -1.455 1.257
340 HA TYR 45 HA TYR 45 7.308 -2.987 1.392
341 HB2 TYR 45 HB2 TYR 45 7.672 -2.550 -0.961
342 HB3 TYR 45 HB3 TYR 45 9.346 -3.127 -0.815
343 HD1 TYR 45 HD1 TYR 45 6.139 -4.594 0.444
344 HD2 TYR 45 HD2 TYR 45 9.502 -5.032 -2.126
345 HE1 TYR 45 HE1 TYR 45 5.401 -6.868 -0.128
346 HE2 TYR 45 HE2 TYR 45 8.773 -7.309 -2.705
347 HH TYR 45 HH TYR 45 7.357 -9.113 -1.639
348 H ASP 46 H ASP 46 7.375 -4.866 2.454
349 HA ASP 46 HA ASP 46 10.059 -5.946 3.064
350 HB2 ASP 46 HB2 ASP 46 8.866 -5.220 5.112
351 HB3 ASP 46 HB3 ASP 46 7.471 -6.219 4.651
352 H ASP 47 H ASP 47 10.445 -7.548 1.671
353 HA ASP 47 HA ASP 47 8.335 -8.921 0.258
354 HB2 ASP 47 HB2 ASP 47 10.703 -8.632 -0.545
355 HB3 ASP 47 HB3 ASP 47 11.206 -9.849 0.650
356 H ALA 48 H ALA 48 9.933 -9.702 3.381
357 HA ALA 48 HA ALA 48 9.159 -12.540 3.273
358 HB1 ALA 48 HB1 ALA 48 9.708 -10.638 5.607
359 HB2 ALA 48 HB2 ALA 48 10.874 -11.704 4.822
360 HB3 ALA 48 HB3 ALA 48 9.545 -12.386 5.760
361 H THR 49 H THR 49 7.451 -9.629 4.375
362 HA THR 49 HA THR 49 5.113 -11.461 5.157
363 HB THR 49 HB THR 49 4.169 -9.517 6.398
364 HG1 THR 49 HG1 THR 49 6.491 -8.113 5.539
365 HG21 THR 49 HG21 THR 49 5.386 -9.970 8.185
366 HG22 THR 49 HG22 THR 49 6.774 -9.110 7.521
367 HG23 THR 49 HG23 THR 49 6.536 -10.817 7.149
368 H LYS 50 H LYS 50 6.116 -9.766 2.475
369 HA LYS 50 HA LYS 50 5.010 -8.784 0.675
370 HB2 LYS 50 HB2 LYS 50 2.678 -10.525 1.636
371 HB3 LYS 50 HB3 LYS 50 2.795 -9.750 0.045
372 HG2 LYS 50 HG2 LYS 50 4.884 -11.693 1.020
373 HG3 LYS 50 HG3 LYS 50 3.390 -12.235 0.217
374 HD2 LYS 50 HD2 LYS 50 4.001 -10.613 -1.661
375 HD3 LYS 50 HD3 LYS 50 5.603 -10.496 -0.892
376 HE2 LYS 50 HE2 LYS 50 6.188 -12.625 -1.472
377 HE3 LYS 50 HE3 LYS 50 4.517 -13.229 -1.383
378 HZ1 LYS 50 HZ1 LYS 50 4.055 -12.217 -3.480
379 HZ2 LYS 50 HZ2 LYS 50 5.425 -13.137 -3.655
380 HZ3 LYS 50 HZ3 LYS 50 5.545 -11.487 -3.543
381 H THR 51 H THR 51 5.050 -7.196 2.884
382 HA THR 51 HA THR 51 2.480 -5.805 2.746
383 HB THR 51 HB THR 51 4.489 -5.928 4.985
384 HG1 THR 51 HG1 THR 51 1.825 -6.887 4.749
385 HG21 THR 51 HG21 THR 51 3.347 -3.704 4.780
386 HG22 THR 51 HG22 THR 51 3.059 -4.563 6.293
387 HG23 THR 51 HG23 THR 51 1.817 -4.541 5.041
388 H PHE 52 H PHE 52 2.328 -3.797 2.095
389 HA PHE 52 HA PHE 52 4.995 -2.288 1.539
390 HB2 PHE 52 HB2 PHE 52 2.107 -2.043 0.448
391 HB3 PHE 52 HB3 PHE 52 3.371 -0.821 0.192
392 HD1 PHE 52 HD2 PHE 52 5.332 -1.343 -1.182
393 HD2 PHE 52 HD1 PHE 52 2.126 -4.110 -0.746
394 HE1 PHE 52 HE2 PHE 52 6.144 -2.588 -3.145
395 HE2 PHE 52 HE1 PHE 52 2.931 -5.359 -2.707
396 HZ PHE 52 HZ PHE 52 4.943 -4.598 -3.909
397 H THR 53 H THR 53 5.108 -0.339 2.795
398 HA THR 53 HA THR 53 2.824 0.447 4.505
399 HB THR 53 HB THR 53 5.782 0.609 5.228
400 HG1 THR 53 HG1 THR 53 5.337 -1.373 5.809
401 HG21 THR 53 HG21 THR 53 5.301 1.873 7.002
402 HG22 THR 53 HG22 THR 53 3.794 1.019 7.333
403 HG23 THR 53 HG23 THR 53 3.835 2.297 6.119
404 H VAL 54 H VAL 54 2.306 2.600 4.429
405 HA VAL 54 HA VAL 54 4.333 4.345 2.938
406 HB VAL 54 HB VAL 54 2.368 4.028 1.471
407 HG11 VAL 54 HG11 VAL 54 0.142 4.604 2.080
408 HG12 VAL 54 HG12 VAL 54 0.662 5.272 3.628
409 HG13 VAL 54 HG13 VAL 54 0.754 3.534 3.342
410 HG21 VAL 54 HG21 VAL 54 1.639 6.490 1.408
411 HG22 VAL 54 HG22 VAL 54 3.357 6.138 1.233
412 HG23 VAL 54 HG23 VAL 54 2.728 6.716 2.776
413 H THR 55 H THR 55 5.065 5.834 4.333
414 HA THR 55 HA THR 55 3.455 6.495 6.770
415 HB THR 55 HB THR 55 6.468 6.488 6.408
416 HG1 THR 55 HG1 THR 55 4.823 4.763 7.957
417 HG21 THR 55 HG21 THR 55 4.968 6.785 8.990
418 HG22 THR 55 HG22 THR 55 5.623 8.147 8.079
419 HG23 THR 55 HG23 THR 55 6.704 6.905 8.709
420 H GLU 56 H GLU 56 2.802 8.546 6.891
421 HA GLU 56 HA GLU 56 3.886 10.613 4.982
422 HB2 GLU 56 HB2 GLU 56 1.431 10.213 5.203
423 HB3 GLU 56 HB3 GLU 56 1.534 10.678 6.912
424 HG2 GLU 56 HG2 GLU 56 2.265 12.913 6.279
425 HG3 GLU 56 HG3 GLU 56 2.225 12.450 4.561
Start of MODEL 10
1 H1 MET 1 H1 MET 1 -1.060 -13.068 -5.568
2 H2 MET 1 H2 MET 1 -2.124 -14.314 -5.180
3 H3 MET 1 H3 MET 1 -0.502 -14.654 -5.475
4 HA MET 1 HA MET 1 -1.181 -14.666 -3.114
5 HB2 MET 1 HB2 MET 1 0.946 -12.669 -3.955
6 HB3 MET 1 HB3 MET 1 0.868 -13.558 -2.422
7 HG2 MET 1 HG2 MET 1 0.938 -15.672 -3.938
8 HG3 MET 1 HG3 MET 1 1.560 -14.550 -5.170
9 HE1 MET 1 HE1 MET 1 3.514 -16.561 -1.764
10 HE2 MET 1 HE2 MET 1 1.789 -16.269 -1.989
11 HE3 MET 1 HE3 MET 1 2.758 -15.140 -1.043
12 H GLN 2 H GLN 2 -1.591 -13.411 -1.235
13 HA GLN 2 HA GLN 2 -3.069 -10.911 -1.810
14 HB2 GLN 2 HB2 GLN 2 -4.142 -12.578 -0.336
15 HB3 GLN 2 HB3 GLN 2 -2.720 -12.570 0.726
16 HG2 GLN 2 HG2 GLN 2 -3.316 -10.641 1.739
17 HG3 GLN 2 HG3 GLN 2 -4.014 -9.946 0.257
18 HE21 GLN 2 HE21 GLN 2 -4.574 -11.714 3.168
19 HE22 GLN 2 HE22 GLN 2 -6.356 -11.867 2.988
20 H TYR 3 H TYR 3 -2.359 -8.945 -1.287
21 HA TYR 3 HA TYR 3 0.143 -8.588 0.255
22 HB2 TYR 3 HB2 TYR 3 -0.824 -6.903 -2.051
23 HB3 TYR 3 HB3 TYR 3 0.580 -6.529 -1.025
24 HD1 TYR 3 HD1 TYR 3 -0.774 -9.200 -3.266
25 HD2 TYR 3 HD2 TYR 3 2.681 -7.330 -1.626
26 HE1 TYR 3 HE1 TYR 3 0.655 -10.559 -4.734
27 HE2 TYR 3 HE2 TYR 3 4.117 -8.686 -3.092
28 HH TYR 3 HH TYR 3 3.952 -9.915 -5.211
29 H LYS 4 H LYS 4 0.202 -6.809 1.731
30 HA LYS 4 HA LYS 4 -2.416 -5.612 2.301
31 HB2 LYS 4 HB2 LYS 4 -1.649 -7.202 4.020
32 HB3 LYS 4 HB3 LYS 4 -0.157 -6.258 4.207
33 HG2 LYS 4 HG2 LYS 4 -1.562 -4.302 4.886
34 HG3 LYS 4 HG3 LYS 4 -2.979 -5.381 4.864
35 HD2 LYS 4 HD2 LYS 4 -0.489 -5.888 6.516
36 HD3 LYS 4 HD3 LYS 4 -1.936 -5.051 7.130
37 HE2 LYS 4 HE2 LYS 4 -3.292 -6.998 6.795
38 HE3 LYS 4 HE3 LYS 4 -1.981 -7.829 5.924
39 HZ1 LYS 4 HZ1 LYS 4 -0.891 -8.274 7.854
40 HZ2 LYS 4 HZ2 LYS 4 -2.440 -8.281 8.444
41 HZ3 LYS 4 HZ3 LYS 4 -1.478 -6.948 8.663
42 H LEU 5 H LEU 5 -2.561 -3.456 2.830
43 HA LEU 5 HA LEU 5 0.035 -1.872 2.532
44 HB2 LEU 5 HB2 LEU 5 -1.416 -1.401 0.635
45 HB3 LEU 5 HB3 LEU 5 -2.816 -1.154 1.688
46 HG LEU 5 HG LEU 5 -1.560 0.812 2.705
47 HD11 LEU 5 HD11 LEU 5 0.682 0.323 2.055
48 HD12 LEU 5 HD12 LEU 5 0.193 1.788 1.205
49 HD13 LEU 5 HD13 LEU 5 0.240 0.246 0.350
50 HD21 LEU 5 HD21 LEU 5 -2.267 2.307 0.997
51 HD22 LEU 5 HD22 LEU 5 -3.379 0.938 0.966
52 HD23 LEU 5 HD23 LEU 5 -2.111 1.070 -0.251
53 H VAL 6 H VAL 6 0.425 -0.833 4.424
54 HA VAL 6 HA VAL 6 -1.689 -0.321 6.374
55 HB VAL 6 HB VAL 6 1.310 -0.389 6.830
56 HG11 VAL 6 HG11 VAL 6 0.911 0.130 9.083
57 HG12 VAL 6 HG12 VAL 6 -0.819 -0.187 8.950
58 HG13 VAL 6 HG13 VAL 6 -0.124 1.245 8.191
59 HG21 VAL 6 HG21 VAL 6 -0.879 -2.367 7.363
60 HG22 VAL 6 HG22 VAL 6 0.539 -2.307 8.411
61 HG23 VAL 6 HG23 VAL 6 0.730 -2.624 6.686
62 H ILE 7 H ILE 7 -2.336 1.728 6.609
63 HA ILE 7 HA ILE 7 -0.551 3.864 5.261
64 HB ILE 7 HB ILE 7 -3.537 3.984 5.931
65 HG12 ILE 7 HG12 ILE 7 -2.133 3.926 3.232
66 HG13 ILE 7 HG13 ILE 7 -2.916 2.519 3.984
67 HG21 ILE 7 HG21 ILE 7 -3.200 6.095 4.422
68 HG22 ILE 7 HG22 ILE 7 -1.528 5.983 4.971
69 HG23 ILE 7 HG23 ILE 7 -2.832 6.167 6.144
70 HD11 ILE 7 HD11 ILE 7 -4.344 3.565 2.313
71 HD12 ILE 7 HD12 ILE 7 -4.284 5.090 3.197
72 HD13 ILE 7 HD13 ILE 7 -5.058 3.681 3.921
73 H ASN 8 H ASN 8 0.635 4.871 6.749
74 HA ASN 8 HA ASN 8 -0.544 5.355 9.493
75 HB2 ASN 8 HB2 ASN 8 1.547 3.939 9.334
76 HB3 ASN 8 HB3 ASN 8 2.396 5.346 8.657
77 HD21 ASN 8 HD21 ASN 8 3.230 4.057 10.967
78 HD22 ASN 8 HD22 ASN 8 2.989 5.175 12.355
79 H GLY 9 H GLY 9 -1.756 7.135 8.423
80 HA2 GLY 9 HA2 GLY 9 -0.280 9.409 7.274
81 HA3 GLY 9 HA3 GLY 9 -1.974 9.129 7.249
82 H LYS 10 H LYS 10 -1.157 11.638 7.920
83 HA LYS 10 HA LYS 10 -0.897 12.035 10.799
84 HB2 LYS 10 HB2 LYS 10 -0.156 13.601 8.998
85 HB3 LYS 10 HB3 LYS 10 -1.864 13.925 8.638
86 HG2 LYS 10 HG2 LYS 10 -2.181 15.151 10.542
87 HG3 LYS 10 HG3 LYS 10 -0.943 14.257 11.457
88 HD2 LYS 10 HD2 LYS 10 -0.024 16.403 11.120
89 HD3 LYS 10 HD3 LYS 10 0.766 15.365 9.906
90 HE2 LYS 10 HE2 LYS 10 -0.621 16.208 8.159
91 HE3 LYS 10 HE3 LYS 10 -1.694 17.030 9.317
92 HZ1 LYS 10 HZ1 LYS 10 1.058 17.757 8.551
93 HZ2 LYS 10 HZ2 LYS 10 0.359 18.345 9.936
94 HZ3 LYS 10 HZ3 LYS 10 -0.318 18.682 8.460
95 H THR 11 H THR 11 -3.445 12.020 8.538
96 HA THR 11 HA THR 11 -5.551 12.266 10.621
97 HB THR 11 HB THR 11 -5.473 13.461 7.912
98 HG1 THR 11 HG1 THR 11 -5.509 15.223 9.046
99 HG21 THR 11 HG21 THR 11 -7.894 12.762 9.556
100 HG22 THR 11 HG22 THR 11 -7.571 12.389 7.862
101 HG23 THR 11 HG23 THR 11 -7.880 14.053 8.356
102 H LEU 12 H LEU 12 -4.514 10.208 8.010
103 HA LEU 12 HA LEU 12 -6.880 8.555 8.637
104 HB2 LEU 12 HB2 LEU 12 -6.904 9.384 6.325
105 HB3 LEU 12 HB3 LEU 12 -5.284 8.718 6.071
106 HG LEU 12 HG LEU 12 -6.178 6.436 6.416
107 HD11 LEU 12 HD11 LEU 12 -8.049 7.042 7.895
108 HD12 LEU 12 HD12 LEU 12 -8.570 6.058 6.527
109 HD13 LEU 12 HD13 LEU 12 -8.876 7.795 6.530
110 HD21 LEU 12 HD21 LEU 12 -7.710 8.006 4.335
111 HD22 LEU 12 HD22 LEU 12 -7.362 6.277 4.310
112 HD23 LEU 12 HD23 LEU 12 -6.048 7.443 4.164
113 H LYS 13 H LYS 13 -6.505 6.674 9.641
114 HA LYS 13 HA LYS 13 -3.873 5.402 9.184
115 HB2 LYS 13 HB2 LYS 13 -3.624 6.143 11.363
116 HB3 LYS 13 HB3 LYS 13 -5.340 5.891 11.738
117 HG2 LYS 13 HG2 LYS 13 -3.707 3.490 11.074
118 HG3 LYS 13 HG3 LYS 13 -3.423 4.284 12.642
119 HD2 LYS 13 HD2 LYS 13 -5.911 4.166 13.041
120 HD3 LYS 13 HD3 LYS 13 -6.028 3.156 11.578
121 HE2 LYS 13 HE3 LYS 13 -5.985 1.749 13.389
122 HE3 LYS 13 HE2 LYS 13 -5.144 3.060 12.530
123 HZ1 LYS 13 HZ1 LYS 13 -4.482 2.009 15.214
124 HZ2 LYS 13 HZ2 LYS 13 -5.130 3.494 14.864
125 HZ3 LYS 13 HZ3 LYS 13 -3.577 3.141 14.403
126 H GLY 14 H GLY 14 -4.019 3.134 8.536
127 HA2 GLY 14 HA2 GLY 14 -5.861 1.373 9.547
128 HA3 GLY 14 HA3 GLY 14 -6.718 1.951 8.139
129 H GLU 15 H GLU 15 -6.667 -0.183 7.502
130 HA GLU 15 HA GLU 15 -4.187 -0.875 6.044
131 HB2 GLU 15 HB2 GLU 15 -4.738 -3.304 6.787
132 HB3 GLU 15 HB3 GLU 15 -3.898 -2.222 7.916
133 HG2 GLU 15 HG2 GLU 15 -6.138 -1.686 8.922
134 HG3 GLU 15 HG3 GLU 15 -6.826 -2.974 7.906
135 H THR 16 H THR 16 -4.486 -2.154 4.107
136 HA THR 16 HA THR 16 -7.202 -3.121 3.619
137 HB THR 16 HB THR 16 -6.987 -2.183 1.175
138 HG1 THR 16 HG1 THR 16 -5.179 -1.037 1.148
139 HG21 THR 16 HG21 THR 16 -8.736 -1.561 2.931
140 HG22 THR 16 HG22 THR 16 -8.434 -0.414 1.627
141 HG23 THR 16 HG23 THR 16 -7.749 -0.130 3.227
142 H THR 17 H THR 17 -7.150 -4.376 1.434
143 HA THR 17 HA THR 17 -4.519 -5.628 1.113
144 HB THR 17 HB THR 17 -5.468 -7.856 1.228
145 HG1 THR 17 HG1 THR 17 -7.876 -6.499 1.899
146 HG21 THR 17 HG21 THR 17 -5.535 -8.089 3.489
147 HG22 THR 17 HG22 THR 17 -6.535 -6.655 3.727
148 HG23 THR 17 HG23 THR 17 -4.815 -6.483 3.384
149 H THR 18 H THR 18 -4.323 -6.844 -0.842
150 HA THR 18 HA THR 18 -6.553 -6.629 -2.738
151 HB THR 18 HB THR 18 -5.092 -4.536 -3.124
152 HG1 THR 18 HG1 THR 18 -6.412 -5.117 -4.771
153 HG21 THR 18 HG21 THR 18 -3.249 -6.150 -4.755
154 HG22 THR 18 HG22 THR 18 -2.961 -6.182 -3.015
155 HG23 THR 18 HG23 THR 18 -2.982 -4.644 -3.879
156 H LYS 19 H LYS 19 -6.177 -8.032 -4.633
157 HA LYS 19 HA LYS 19 -4.243 -10.199 -3.998
158 HB2 LYS 19 HB2 LYS 19 -6.725 -10.223 -5.753
159 HB3 LYS 19 HB3 LYS 19 -5.651 -11.603 -5.463
160 HG2 LYS 19 HG2 LYS 19 -6.681 -10.381 -3.001
161 HG3 LYS 19 HG3 LYS 19 -7.954 -11.017 -4.072
162 HD2 LYS 19 HD2 LYS 19 -5.510 -12.598 -3.222
163 HD3 LYS 19 HD3 LYS 19 -7.074 -12.651 -2.369
164 HE2 LYS 19 HE2 LYS 19 -6.979 -13.146 -5.330
165 HE3 LYS 19 HE3 LYS 19 -6.486 -14.437 -4.209
166 HZ1 LYS 19 HZ1 LYS 19 -8.737 -13.815 -3.090
167 HZ2 LYS 19 HZ2 LYS 19 -8.708 -14.829 -4.403
168 HZ3 LYS 19 HZ3 LYS 19 -9.121 -13.235 -4.597
169 H ALA 20 H ALA 20 -2.533 -10.480 -5.444
170 HA ALA 20 HA ALA 20 -2.805 -9.487 -8.110
171 HB1 ALA 20 HB1 ALA 20 -0.589 -8.213 -7.925
172 HB2 ALA 20 HB2 ALA 20 -0.820 -8.285 -6.178
173 HB3 ALA 20 HB3 ALA 20 -1.993 -7.440 -7.190
174 H VAL 21 H VAL 21 -1.191 -10.238 -9.607
175 HA VAL 21 HA VAL 21 -0.023 -12.646 -8.835
176 HB VAL 21 HB VAL 21 0.970 -12.793 -11.039
177 HG11 VAL 21 HG11 VAL 21 -1.471 -13.262 -10.589
178 HG12 VAL 21 HG12 VAL 21 -1.066 -12.865 -12.259
179 HG13 VAL 21 HG13 VAL 21 -1.817 -11.653 -11.223
180 HG21 VAL 21 HG21 VAL 21 -0.152 -10.032 -11.528
181 HG22 VAL 21 HG22 VAL 21 0.871 -10.998 -12.593
182 HG23 VAL 21 HG23 VAL 21 1.535 -10.323 -11.104
183 H ASP 22 H ASP 22 1.399 -9.438 -8.755
184 HA ASP 22 HA ASP 22 3.754 -10.623 -7.563
185 HB2 ASP 22 HB2 ASP 22 5.356 -9.604 -9.159
186 HB3 ASP 22 HB3 ASP 22 4.326 -10.821 -9.944
187 H ALA 23 H ALA 23 5.351 -8.898 -6.822
188 HA ALA 23 HA ALA 23 3.801 -7.127 -5.231
189 HB1 ALA 23 HB1 ALA 23 5.810 -7.839 -4.286
190 HB2 ALA 23 HB2 ALA 23 6.085 -6.139 -4.666
191 HB3 ALA 23 HB3 ALA 23 6.746 -7.393 -5.714
192 H GLU 24 H GLU 24 5.646 -6.594 -8.252
193 HA GLU 24 HA GLU 24 5.528 -3.685 -8.041
194 HB2 GLU 24 HB2 GLU 24 5.726 -5.695 -10.347
195 HB3 GLU 24 HB3 GLU 24 5.695 -3.947 -10.650
196 HG2 GLU 24 HG2 GLU 24 7.650 -3.788 -9.017
197 HG3 GLU 24 HG3 GLU 24 7.755 -5.559 -9.150
198 H THR 25 H THR 25 3.214 -6.011 -9.536
199 HA THR 25 HA THR 25 1.529 -3.848 -10.628
200 HB THR 25 HB THR 25 0.800 -6.738 -9.910
201 HG1 THR 25 HG1 THR 25 1.901 -7.104 -11.651
202 HG21 THR 25 HG21 THR 25 -0.735 -4.608 -11.359
203 HG22 THR 25 HG22 THR 25 -1.272 -5.687 -10.072
204 HG23 THR 25 HG23 THR 25 -0.987 -6.321 -11.693
205 H ALA 26 H ALA 26 1.606 -5.640 -7.447
206 HA ALA 26 HA ALA 26 -0.792 -4.366 -6.369
207 HB1 ALA 26 HB1 ALA 26 0.505 -6.298 -5.330
208 HB2 ALA 26 HB2 ALA 26 -0.020 -5.037 -4.216
209 HB3 ALA 26 HB3 ALA 26 1.659 -5.095 -4.753
210 H GLU 27 H GLU 27 2.605 -3.229 -6.776
211 HA GLU 27 HA GLU 27 2.253 -0.945 -5.203
212 HB2 GLU 27 HB2 GLU 27 4.444 -1.774 -5.972
213 HB3 GLU 27 HB3 GLU 27 4.065 -1.205 -7.610
214 HG2 GLU 27 HG2 GLU 27 3.762 1.104 -6.570
215 HG3 GLU 27 HG3 GLU 27 4.528 0.426 -5.115
216 H LYS 28 H LYS 28 1.728 -1.284 -8.715
217 HA LYS 28 HA LYS 28 1.012 1.475 -9.141
218 HB2 LYS 28 HB2 LYS 28 -0.043 -0.939 -10.629
219 HB3 LYS 28 HB3 LYS 28 -0.025 0.742 -11.195
220 HG2 LYS 28 HG2 LYS 28 2.388 0.740 -11.283
221 HG3 LYS 28 HG3 LYS 28 2.447 -0.891 -10.569
222 HD2 LYS 28 HD2 LYS 28 1.655 -1.907 -12.502
223 HD3 LYS 28 HD3 LYS 28 0.899 -0.410 -13.102
224 HE2 LYS 28 HE2 LYS 28 3.011 0.518 -13.701
225 HE3 LYS 28 HE3 LYS 28 3.893 -0.754 -12.824
226 HZ1 LYS 28 HZ1 LYS 28 3.023 -2.353 -14.429
227 HZ2 LYS 28 HZ2 LYS 28 3.916 -1.174 -15.180
228 HZ3 LYS 28 HZ3 LYS 28 2.261 -1.136 -15.263
229 H ALA 29 H ALA 29 -1.021 -1.354 -8.136
230 HA ALA 29 HA ALA 29 -3.498 0.222 -8.307
231 HB1 ALA 29 HB1 ALA 29 -4.516 -1.588 -7.054
232 HB2 ALA 29 HB2 ALA 29 -2.944 -2.197 -6.536
233 HB3 ALA 29 HB3 ALA 29 -3.412 -2.297 -8.234
234 H PHE 30 H PHE 30 -1.237 -0.556 -5.532
235 HA PHE 30 HA PHE 30 -2.862 0.855 -3.615
236 HB2 PHE 30 HB2 PHE 30 0.061 0.018 -3.682
237 HB3 PHE 30 HB3 PHE 30 -0.683 0.818 -2.281
238 HD1 PHE 30 HD1 PHE 30 -3.263 -0.439 -2.033
239 HD2 PHE 30 HD2 PHE 30 0.467 -2.172 -3.129
240 HE1 PHE 30 HE1 PHE 30 -4.038 -2.621 -1.201
241 HE2 PHE 30 HE2 PHE 30 -0.302 -4.356 -2.300
242 HZ PHE 30 HZ PHE 30 -2.556 -4.583 -1.332
243 H LYS 31 H LYS 31 -0.189 1.987 -5.774
244 HA LYS 31 HA LYS 31 -0.121 4.615 -4.462
245 HB2 LYS 31 HB2 LYS 31 0.592 3.714 -7.271
246 HB3 LYS 31 HB3 LYS 31 0.738 5.399 -6.734
247 HG2 LYS 31 HG2 LYS 31 2.106 4.261 -4.755
248 HG3 LYS 31 HG3 LYS 31 2.351 3.003 -5.992
249 HD2 LYS 31 HD2 LYS 31 3.123 4.813 -7.556
250 HD3 LYS 31 HD3 LYS 31 3.054 5.946 -6.184
251 HE2 LYS 31 HE2 LYS 31 4.853 4.982 -5.120
252 HE3 LYS 31 HE3 LYS 31 4.574 3.388 -5.861
253 HZ1 LYS 31 HZ1 LYS 31 5.564 5.749 -7.346
254 HZ2 LYS 31 HZ2 LYS 31 5.464 4.189 -7.902
255 HZ3 LYS 31 HZ3 LYS 31 6.550 4.574 -6.709
256 H GLN 32 H GLN 32 -2.270 3.259 -6.939
257 HA GLN 32 HA GLN 32 -3.568 5.802 -7.441
258 HB2 GLN 32 HB2 GLN 32 -3.785 4.001 -9.057
259 HB3 GLN 32 HB3 GLN 32 -4.504 2.933 -7.836
260 HG2 GLN 32 HG2 GLN 32 -6.292 3.677 -9.168
261 HG3 GLN 32 HG3 GLN 32 -6.390 4.621 -7.664
262 HE21 GLN 32 HE21 GLN 32 -7.758 5.974 -9.093
263 HE22 GLN 32 HE22 GLN 32 -6.927 7.244 -10.058
264 H TYR 33 H TYR 33 -4.356 3.117 -5.231
265 HA TYR 33 HA TYR 33 -6.773 4.279 -4.187
266 HB2 TYR 33 HB2 TYR 33 -6.027 1.920 -3.773
267 HB3 TYR 33 HB3 TYR 33 -4.652 2.535 -2.831
268 HD1 TYR 33 HD2 TYR 33 -5.153 3.826 -0.696
269 HD2 TYR 33 HD1 TYR 33 -8.107 1.559 -2.753
270 HE1 TYR 33 HE2 TYR 33 -6.530 3.780 1.342
271 HE2 TYR 33 HE1 TYR 33 -9.492 1.508 -0.722
272 HH TYR 33 HH TYR 33 -8.644 1.843 2.095
273 H ALA 34 H ALA 34 -3.406 4.637 -3.017
274 HA ALA 34 HA ALA 34 -3.970 6.403 -0.879
275 HB1 ALA 34 HB1 ALA 34 -1.740 5.236 -1.562
276 HB2 ALA 34 HB2 ALA 34 -1.695 6.806 -0.760
277 HB3 ALA 34 HB3 ALA 34 -1.485 6.702 -2.508
278 H ASN 35 H ASN 35 -3.265 7.144 -4.297
279 HA ASN 35 HA ASN 35 -3.401 10.030 -3.844
280 HB2 ASN 35 HB2 ASN 35 -2.432 8.932 -5.894
281 HB3 ASN 35 HB3 ASN 35 -4.067 8.439 -6.386
282 HD21 ASN 35 HD21 ASN 35 -1.792 11.056 -6.055
283 HD22 ASN 35 HD22 ASN 35 -2.739 12.263 -6.992
284 H ASP 36 H ASP 36 -6.000 7.657 -4.776
285 HA ASP 36 HA ASP 36 -8.005 9.696 -5.125
286 HB2 ASP 36 HB2 ASP 36 -8.267 6.766 -4.432
287 HB3 ASP 36 HB3 ASP 36 -9.660 7.836 -4.701
288 H ASN 37 H ASN 37 -6.635 8.362 -2.204
289 HA ASN 37 HA ASN 37 -8.823 9.711 -0.652
290 HB2 ASN 37 HB2 ASN 37 -6.854 7.527 0.040
291 HB3 ASN 37 HB3 ASN 37 -7.756 8.412 1.290
292 HD21 ASN 37 HD21 ASN 37 -7.936 6.183 -1.401
293 HD22 ASN 37 HD22 ASN 37 -9.605 5.610 -1.059
294 H GLY 38 H GLY 38 -5.943 10.734 -1.796
295 HA2 GLY 38 HA2 GLY 38 -4.949 12.745 -1.207
296 HA3 GLY 38 HA3 GLY 38 -5.929 12.807 0.242
297 H VAL 39 H VAL 39 -3.843 10.067 -0.241
298 HA VAL 39 HA VAL 39 -2.151 11.057 2.045
299 HB VAL 39 HB VAL 39 -2.630 8.236 1.096
300 HG11 VAL 39 HG11 VAL 39 -1.343 8.888 3.695
301 HG12 VAL 39 HG12 VAL 39 -0.369 9.081 2.239
302 HG13 VAL 39 HG13 VAL 39 -1.091 7.516 2.615
303 HG21 VAL 39 HG21 VAL 39 -3.982 7.944 3.010
304 HG22 VAL 39 HG22 VAL 39 -4.524 9.462 2.293
305 HG23 VAL 39 HG23 VAL 39 -3.474 9.481 3.708
306 H ASP 40 H ASP 40 -0.164 11.454 1.839
307 HA ASP 40 HA ASP 40 1.275 10.370 -0.526
308 HB2 ASP 40 HB2 ASP 40 0.398 12.552 -1.144
309 HB3 ASP 40 HB3 ASP 40 1.087 13.278 0.324
310 H GLY 41 H GLY 41 3.057 9.723 -0.289
311 HA2 GLY 41 HA2 GLY 41 4.987 10.772 1.716
312 HA3 GLY 41 HA3 GLY 41 4.131 9.336 2.225
313 H VAL 42 H VAL 42 6.056 8.530 2.724
314 HA VAL 42 HA VAL 42 7.766 7.796 0.462
315 HB VAL 42 HB VAL 42 8.224 7.702 3.441
316 HG11 VAL 42 HG11 VAL 42 9.233 5.746 2.250
317 HG12 VAL 42 HG12 VAL 42 10.396 6.798 3.057
318 HG13 VAL 42 HG13 VAL 42 10.195 6.885 1.308
319 HG21 VAL 42 HG21 VAL 42 10.229 9.171 2.564
320 HG22 VAL 42 HG22 VAL 42 8.640 9.874 2.864
321 HG23 VAL 42 HG23 VAL 42 9.130 9.470 1.220
322 H TRP 43 H TRP 43 8.042 5.696 -0.237
323 HA TRP 43 HA TRP 43 6.150 3.655 1.044
324 HB2 TRP 43 HB2 TRP 43 7.436 3.983 -1.703
325 HB3 TRP 43 HB3 TRP 43 6.576 2.507 -1.208
326 HD1 TRP 43 HD1 TRP 43 5.935 6.244 -1.916
327 HE1 TRP 43 HE1 TRP 43 3.418 6.587 -2.448
328 HE3 TRP 43 HE3 TRP 43 4.307 1.510 -0.887
329 HZ2 TRP 43 HZ2 TRP 43 1.078 4.993 -2.409
330 HZ3 TRP 43 HZ3 TRP 43 1.917 0.998 -1.159
331 HH2 TRP 43 HH2 TRP 43 0.337 2.705 -1.902
332 H THR 44 H THR 44 6.801 1.769 1.857
333 HA THR 44 HA THR 44 9.551 0.866 1.185
334 HB THR 44 HB THR 44 9.668 -0.140 3.543
335 HG1 THR 44 HG1 THR 44 7.536 1.698 3.896
336 HG21 THR 44 HG21 THR 44 10.942 1.892 2.838
337 HG22 THR 44 HG22 THR 44 10.577 1.795 4.561
338 HG23 THR 44 HG23 THR 44 9.641 2.869 3.520
339 H TYR 45 H TYR 45 9.764 -1.455 1.257
340 HA TYR 45 HA TYR 45 7.308 -2.987 1.392
341 HB2 TYR 45 HB2 TYR 45 7.670 -2.552 -0.961
342 HB3 TYR 45 HB3 TYR 45 9.345 -3.125 -0.815
343 HD1 TYR 45 HD1 TYR 45 6.143 -4.598 0.445
344 HD2 TYR 45 HD2 TYR 45 9.505 -5.029 -2.127
345 HE1 TYR 45 HE1 TYR 45 5.409 -6.874 -0.126
346 HE2 TYR 45 HE2 TYR 45 8.780 -7.308 -2.705
347 HH TYR 45 HH TYR 45 7.369 -9.115 -1.638
348 H ASP 46 H ASP 46 7.375 -4.866 2.454
349 HA ASP 46 HA ASP 46 10.059 -5.946 3.064
350 HB2 ASP 46 HB2 ASP 46 8.864 -5.218 5.111
351 HB3 ASP 46 HB3 ASP 46 7.471 -6.222 4.651
352 H ASP 47 H ASP 47 10.445 -7.548 1.671
353 HA ASP 47 HA ASP 47 8.335 -8.921 0.258
354 HB2 ASP 47 HB2 ASP 47 10.703 -8.632 -0.546
355 HB3 ASP 47 HB3 ASP 47 11.206 -9.848 0.650
356 H ALA 48 H ALA 48 9.933 -9.702 3.381
357 HA ALA 48 HA ALA 48 9.159 -12.540 3.273
358 HB1 ALA 48 HB1 ALA 48 9.708 -10.638 5.607
359 HB2 ALA 48 HB2 ALA 48 10.874 -11.704 4.822
360 HB3 ALA 48 HB3 ALA 48 9.545 -12.386 5.760
361 H THR 49 H THR 49 7.451 -9.629 4.375
362 HA THR 49 HA THR 49 5.113 -11.461 5.157
363 HB THR 49 HB THR 49 4.167 -9.511 6.393
364 HG1 THR 49 HG1 THR 49 6.502 -8.120 5.546
365 HG21 THR 49 HG21 THR 49 5.373 -9.973 8.185
366 HG22 THR 49 HG22 THR 49 6.770 -9.121 7.529
367 HG23 THR 49 HG23 THR 49 6.523 -10.826 7.154
368 H LYS 50 H LYS 50 6.116 -9.766 2.475
369 HA LYS 50 HA LYS 50 5.010 -8.784 0.675
370 HB2 LYS 50 HB2 LYS 50 2.678 -10.526 1.637
371 HB3 LYS 50 HB3 LYS 50 2.794 -9.749 0.046
372 HG2 LYS 50 HG2 LYS 50 4.885 -11.693 1.019
373 HG3 LYS 50 HG3 LYS 50 3.390 -12.235 0.216
374 HD2 LYS 50 HD2 LYS 50 3.999 -10.612 -1.661
375 HD3 LYS 50 HD3 LYS 50 5.602 -10.494 -0.894
376 HE2 LYS 50 HE2 LYS 50 6.188 -12.623 -1.475
377 HE3 LYS 50 HE3 LYS 50 4.516 -13.227 -1.385
378 HZ1 LYS 50 HZ1 LYS 50 4.053 -12.215 -3.482
379 HZ2 LYS 50 HZ2 LYS 50 5.423 -13.134 -3.658
380 HZ3 LYS 50 HZ3 LYS 50 5.543 -11.484 -3.545
381 H THR 51 H THR 51 5.050 -7.196 2.884
382 HA THR 51 HA THR 51 2.480 -5.805 2.746
383 HB THR 51 HB THR 51 4.489 -5.929 4.985
384 HG1 THR 51 HG1 THR 51 1.824 -6.886 4.749
385 HG21 THR 51 HG21 THR 51 3.348 -3.704 4.780
386 HG22 THR 51 HG22 THR 51 3.060 -4.563 6.293
387 HG23 THR 51 HG23 THR 51 1.818 -4.540 5.042
388 H PHE 52 H PHE 52 2.328 -3.797 2.095
389 HA PHE 52 HA PHE 52 4.995 -2.288 1.539
390 HB2 PHE 52 HB2 PHE 52 2.107 -2.041 0.449
391 HB3 PHE 52 HB3 PHE 52 3.374 -0.821 0.191
392 HD1 PHE 52 HD2 PHE 52 5.332 -1.350 -1.185
393 HD2 PHE 52 HD1 PHE 52 2.120 -4.109 -0.742
394 HE1 PHE 52 HE2 PHE 52 6.139 -2.599 -3.146
395 HE2 PHE 52 HE1 PHE 52 2.921 -5.362 -2.702
396 HZ PHE 52 HZ PHE 52 4.933 -4.607 -3.907
397 H THR 53 H THR 53 5.108 -0.339 2.795
398 HA THR 53 HA THR 53 2.824 0.447 4.505
399 HB THR 53 HB THR 53 5.782 0.607 5.228
400 HG1 THR 53 HG1 THR 53 5.334 -1.374 5.810
401 HG21 THR 53 HG21 THR 53 5.303 1.873 7.001
402 HG22 THR 53 HG22 THR 53 3.795 1.022 7.332
403 HG23 THR 53 HG23 THR 53 3.837 2.299 6.117
404 H VAL 54 H VAL 54 2.306 2.600 4.429
405 HA VAL 54 HA VAL 54 4.333 4.345 2.938
406 HB VAL 54 HB VAL 54 2.366 4.026 1.472
407 HG11 VAL 54 HG11 VAL 54 0.142 4.607 2.082
408 HG12 VAL 54 HG12 VAL 54 0.664 5.276 3.628
409 HG13 VAL 54 HG13 VAL 54 0.752 3.538 3.345
410 HG21 VAL 54 HG21 VAL 54 1.641 6.490 1.405
411 HG22 VAL 54 HG22 VAL 54 3.359 6.134 1.230
412 HG23 VAL 54 HG23 VAL 54 2.732 6.716 2.772
413 H THR 55 H THR 55 5.065 5.834 4.333
414 HA THR 55 HA THR 55 3.455 6.495 6.770
415 HB THR 55 HB THR 55 6.468 6.491 6.410
416 HG1 THR 55 HG1 THR 55 4.825 4.760 7.952
417 HG21 THR 55 HG21 THR 55 4.966 6.779 8.990
418 HG22 THR 55 HG22 THR 55 5.619 8.144 8.084
419 HG23 THR 55 HG23 THR 55 6.702 6.903 8.711
420 H GLU 56 H GLU 56 2.802 8.546 6.891
421 HA GLU 56 HA GLU 56 3.886 10.613 4.982
422 HB2 GLU 56 HB2 GLU 56 1.454 10.415 6.791
423 HB3 GLU 56 HB3 GLU 56 1.928 11.916 5.973
424 HG2 GLU 56 HG2 GLU 56 1.793 10.687 3.801
425 HG3 GLU 56 HG3 GLU 56 1.133 9.298 4.695
Start of MODEL 11
1 H1 MET 1 H1 MET 1 -1.060 -13.068 -5.568
2 H2 MET 1 H2 MET 1 -2.124 -14.314 -5.180
3 H3 MET 1 H3 MET 1 -0.502 -14.654 -5.475
4 HA MET 1 HA MET 1 -1.181 -14.666 -3.114
5 HB2 MET 1 HB2 MET 1 1.156 -14.253 -4.199
6 HB3 MET 1 HB3 MET 1 0.904 -12.570 -3.699
7 HG2 MET 1 HG2 MET 1 2.133 -13.523 -1.960
8 HG3 MET 1 HG3 MET 1 0.459 -13.505 -1.360
9 HE1 MET 1 HE1 MET 1 0.898 -16.528 0.418
10 HE2 MET 1 HE2 MET 1 1.257 -14.801 0.395
11 HE3 MET 1 HE3 MET 1 2.553 -15.975 0.161
12 H GLN 2 H GLN 2 -1.591 -13.411 -1.235
13 HA GLN 2 HA GLN 2 -3.069 -10.911 -1.810
14 HB2 GLN 2 HB2 GLN 2 -4.142 -12.578 -0.336
15 HB3 GLN 2 HB3 GLN 2 -2.720 -12.571 0.726
16 HG2 GLN 2 HG2 GLN 2 -3.207 -10.468 1.581
17 HG3 GLN 2 HG3 GLN 2 -4.249 -10.037 0.205
18 HE21 GLN 2 HE21 GLN 2 -4.936 -9.734 2.928
19 HE22 GLN 2 HE22 GLN 2 -6.321 -10.832 3.259
20 H TYR 3 H TYR 3 -2.359 -8.945 -1.287
21 HA TYR 3 HA TYR 3 0.143 -8.588 0.255
22 HB2 TYR 3 HB2 TYR 3 -0.824 -6.906 -2.052
23 HB3 TYR 3 HB3 TYR 3 0.577 -6.527 -1.025
24 HD1 TYR 3 HD1 TYR 3 -0.767 -9.204 -3.265
25 HD2 TYR 3 HD2 TYR 3 2.681 -7.324 -1.621
26 HE1 TYR 3 HE1 TYR 3 0.668 -10.562 -4.729
27 HE2 TYR 3 HE2 TYR 3 4.122 -8.678 -3.084
28 HH TYR 3 HH TYR 3 3.964 -9.910 -5.201
29 H LYS 4 H LYS 4 0.202 -6.809 1.731
30 HA LYS 4 HA LYS 4 -2.416 -5.612 2.301
31 HB2 LYS 4 HB2 LYS 4 -1.652 -7.201 4.021
32 HB3 LYS 4 HB3 LYS 4 -0.157 -6.261 4.206
33 HG2 LYS 4 HG2 LYS 4 -1.556 -4.301 4.885
34 HG3 LYS 4 HG3 LYS 4 -2.976 -5.375 4.865
35 HD2 LYS 4 HD2 LYS 4 -0.485 -5.889 6.515
36 HD3 LYS 4 HD3 LYS 4 -1.929 -5.047 7.131
37 HE2 LYS 4 HE2 LYS 4 -3.291 -6.991 6.798
38 HE3 LYS 4 HE3 LYS 4 -1.984 -7.826 5.925
39 HZ1 LYS 4 HZ1 LYS 4 -0.893 -8.274 7.854
40 HZ2 LYS 4 HZ2 LYS 4 -2.441 -8.276 8.446
41 HZ3 LYS 4 HZ3 LYS 4 -1.475 -6.946 8.663
42 H LEU 5 H LEU 5 -2.561 -3.456 2.830
43 HA LEU 5 HA LEU 5 0.035 -1.872 2.532
44 HB2 LEU 5 HB2 LEU 5 -1.419 -1.403 0.634
45 HB3 LEU 5 HB3 LEU 5 -2.816 -1.151 1.690
46 HG LEU 5 HG LEU 5 -1.554 0.813 2.702
47 HD11 LEU 5 HD11 LEU 5 0.686 0.318 2.048
48 HD12 LEU 5 HD12 LEU 5 0.199 1.783 1.197
49 HD13 LEU 5 HD13 LEU 5 0.240 0.240 0.344
50 HD21 LEU 5 HD21 LEU 5 -2.260 2.307 0.993
51 HD22 LEU 5 HD22 LEU 5 -3.375 0.941 0.966
52 HD23 LEU 5 HD23 LEU 5 -2.109 1.068 -0.253
53 H VAL 6 H VAL 6 0.425 -0.833 4.424
54 HA VAL 6 HA VAL 6 -1.689 -0.321 6.374
55 HB VAL 6 HB VAL 6 1.310 -0.389 6.830
56 HG11 VAL 6 HG11 VAL 6 0.912 0.131 9.082
57 HG12 VAL 6 HG12 VAL 6 -0.818 -0.187 8.950
58 HG13 VAL 6 HG13 VAL 6 -0.124 1.245 8.191
59 HG21 VAL 6 HG21 VAL 6 -0.879 -2.367 7.363
60 HG22 VAL 6 HG22 VAL 6 0.539 -2.307 8.411
61 HG23 VAL 6 HG23 VAL 6 0.729 -2.624 6.686
62 H ILE 7 H ILE 7 -2.336 1.728 6.609
63 HA ILE 7 HA ILE 7 -0.551 3.864 5.261
64 HB ILE 7 HB ILE 7 -3.537 3.983 5.930
65 HG12 ILE 7 HG12 ILE 7 -2.132 3.928 3.232
66 HG13 ILE 7 HG13 ILE 7 -2.914 2.520 3.982
67 HG21 ILE 7 HG21 ILE 7 -3.200 6.096 4.424
68 HG22 ILE 7 HG22 ILE 7 -1.528 5.984 4.974
69 HG23 ILE 7 HG23 ILE 7 -2.833 6.166 6.146
70 HD11 ILE 7 HD11 ILE 7 -4.342 3.567 2.311
71 HD12 ILE 7 HD12 ILE 7 -4.284 5.092 3.197
72 HD13 ILE 7 HD13 ILE 7 -5.058 3.681 3.919
73 H ASN 8 H ASN 8 0.635 4.871 6.749
74 HA ASN 8 HA ASN 8 -0.544 5.355 9.493
75 HB2 ASN 8 HB2 ASN 8 2.360 5.138 8.552
76 HB3 ASN 8 HB3 ASN 8 1.859 5.608 10.191
77 HD21 ASN 8 HD21 ASN 8 2.496 3.963 11.415
78 HD22 ASN 8 HD22 ASN 8 2.011 2.252 11.147
79 H GLY 9 H GLY 9 -1.756 7.135 8.423
80 HA2 GLY 9 HA2 GLY 9 -0.280 9.409 7.274
81 HA3 GLY 9 HA3 GLY 9 -1.974 9.129 7.249
82 H LYS 10 H LYS 10 -1.157 11.638 7.920
83 HA LYS 10 HA LYS 10 -0.897 12.035 10.799
84 HB2 LYS 10 HB2 LYS 10 -0.156 13.601 8.998
85 HB3 LYS 10 HB3 LYS 10 -1.864 13.925 8.638
86 HG2 LYS 10 HG2 LYS 10 -2.181 15.151 10.541
87 HG3 LYS 10 HG3 LYS 10 -0.944 14.257 11.457
88 HD2 LYS 10 HD2 LYS 10 -0.024 16.403 11.120
89 HD3 LYS 10 HD3 LYS 10 0.765 15.365 9.907
90 HE2 LYS 10 HE2 LYS 10 -0.621 16.208 8.159
91 HE3 LYS 10 HE3 LYS 10 -1.694 17.030 9.317
92 HZ1 LYS 10 HZ1 LYS 10 1.058 17.757 8.551
93 HZ2 LYS 10 HZ2 LYS 10 0.359 18.345 9.936
94 HZ3 LYS 10 HZ3 LYS 10 -0.318 18.682 8.460
95 H THR 11 H THR 11 -3.445 12.020 8.538
96 HA THR 11 HA THR 11 -5.551 12.266 10.621
97 HB THR 11 HB THR 11 -7.031 13.201 8.943
98 HG1 THR 11 HG1 THR 11 -6.366 13.485 6.977
99 HG21 THR 11 HG21 THR 11 -4.531 14.723 9.643
100 HG22 THR 11 HG22 THR 11 -6.107 14.776 10.434
101 HG23 THR 11 HG23 THR 11 -5.908 15.452 8.818
102 H LEU 12 H LEU 12 -4.514 10.208 8.010
103 HA LEU 12 HA LEU 12 -6.880 8.555 8.637
104 HB2 LEU 12 HB2 LEU 12 -6.903 9.385 6.325
105 HB3 LEU 12 HB3 LEU 12 -5.284 8.717 6.071
106 HG LEU 12 HG LEU 12 -6.181 6.435 6.416
107 HD11 LEU 12 HD11 LEU 12 -8.050 7.044 7.895
108 HD12 LEU 12 HD12 LEU 12 -8.573 6.060 6.527
109 HD13 LEU 12 HD13 LEU 12 -8.876 7.797 6.530
110 HD21 LEU 12 HD21 LEU 12 -7.711 8.007 4.335
111 HD22 LEU 12 HD22 LEU 12 -7.365 6.278 4.310
112 HD23 LEU 12 HD23 LEU 12 -6.049 7.443 4.164
113 H LYS 13 H LYS 13 -6.505 6.674 9.641
114 HA LYS 13 HA LYS 13 -3.873 5.402 9.184
115 HB2 LYS 13 HB2 LYS 13 -5.415 5.480 11.772
116 HB3 LYS 13 HB3 LYS 13 -3.899 4.600 11.500
117 HG2 LYS 13 HG2 LYS 13 -2.959 6.935 10.834
118 HG3 LYS 13 HG3 LYS 13 -4.377 7.557 11.714
119 HD2 LYS 13 HD2 LYS 13 -3.693 6.434 13.733
120 HD3 LYS 13 HD3 LYS 13 -2.379 5.592 12.874
121 HE2 LYS 13 HE2 LYS 13 -2.555 8.607 13.064
122 HE3 LYS 13 HE3 LYS 13 -1.716 7.611 14.276
123 HZ1 LYS 13 HZ1 LYS 13 -0.248 6.820 12.581
124 HZ2 LYS 13 HZ2 LYS 13 -0.244 8.477 12.534
125 HZ3 LYS 13 HZ3 LYS 13 -1.079 7.620 11.386
126 H GLY 14 H GLY 14 -4.019 3.134 8.536
127 HA2 GLY 14 HA2 GLY 14 -5.861 1.373 9.547
128 HA3 GLY 14 HA3 GLY 14 -6.718 1.951 8.139
129 H GLU 15 H GLU 15 -6.667 -0.183 7.502
130 HA GLU 15 HA GLU 15 -4.187 -0.875 6.044
131 HB2 GLU 15 HB2 GLU 15 -5.705 -2.556 8.025
132 HB3 GLU 15 HB3 GLU 15 -4.674 -3.292 6.781
133 HG2 GLU 15 HG2 GLU 15 -3.182 -3.181 8.493
134 HG3 GLU 15 HG3 GLU 15 -2.892 -1.591 7.749
135 H THR 16 H THR 16 -4.486 -2.154 4.107
136 HA THR 16 HA THR 16 -7.202 -3.121 3.619
137 HB THR 16 HB THR 16 -6.983 -2.183 1.174
138 HG1 THR 16 HG1 THR 16 -5.179 -1.031 1.153
139 HG21 THR 16 HG21 THR 16 -8.739 -1.568 2.926
140 HG22 THR 16 HG22 THR 16 -8.436 -0.418 1.624
141 HG23 THR 16 HG23 THR 16 -7.757 -0.135 3.226
142 H THR 17 H THR 17 -7.150 -4.376 1.434
143 HA THR 17 HA THR 17 -4.519 -5.628 1.113
144 HB THR 17 HB THR 17 -5.922 -6.913 2.780
145 HG1 THR 17 HG1 THR 17 -5.174 -8.180 0.345
146 HG21 THR 17 HG21 THR 17 -7.833 -7.999 2.197
147 HG22 THR 17 HG22 THR 17 -7.437 -8.024 0.478
148 HG23 THR 17 HG23 THR 17 -8.021 -6.539 1.226
149 H THR 18 H THR 18 -4.323 -6.844 -0.842
150 HA THR 18 HA THR 18 -6.553 -6.629 -2.738
151 HB THR 18 HB THR 18 -5.091 -4.536 -3.123
152 HG1 THR 18 HG1 THR 18 -6.413 -5.115 -4.769
153 HG21 THR 18 HG21 THR 18 -3.251 -6.151 -4.757
154 HG22 THR 18 HG22 THR 18 -2.961 -6.184 -3.017
155 HG23 THR 18 HG23 THR 18 -2.982 -4.646 -3.880
156 H LYS 19 H LYS 19 -6.177 -8.032 -4.633
157 HA LYS 19 HA LYS 19 -4.243 -10.199 -3.998
158 HB2 LYS 19 HB2 LYS 19 -6.725 -10.223 -5.754
159 HB3 LYS 19 HB3 LYS 19 -5.651 -11.603 -5.462
160 HG2 LYS 19 HG2 LYS 19 -6.682 -10.381 -3.001
161 HG3 LYS 19 HG3 LYS 19 -7.954 -11.017 -4.072
162 HD2 LYS 19 HD2 LYS 19 -5.511 -12.598 -3.221
163 HD3 LYS 19 HD3 LYS 19 -7.075 -12.650 -2.369
164 HE2 LYS 19 HE2 LYS 19 -6.979 -13.146 -5.329
165 HE3 LYS 19 HE3 LYS 19 -6.487 -14.437 -4.208
166 HZ1 LYS 19 HZ1 LYS 19 -8.737 -13.814 -3.089
167 HZ2 LYS 19 HZ2 LYS 19 -8.709 -14.829 -4.402
168 HZ3 LYS 19 HZ3 LYS 19 -9.122 -13.234 -4.597
169 H ALA 20 H ALA 20 -2.533 -10.480 -5.444
170 HA ALA 20 HA ALA 20 -2.805 -9.487 -8.110
171 HB1 ALA 20 HB1 ALA 20 -0.589 -8.213 -7.925
172 HB2 ALA 20 HB2 ALA 20 -0.820 -8.285 -6.178
173 HB3 ALA 20 HB3 ALA 20 -1.993 -7.440 -7.190
174 H VAL 21 H VAL 21 -1.191 -10.238 -9.607
175 HA VAL 21 HA VAL 21 -0.023 -12.646 -8.835
176 HB VAL 21 HB VAL 21 -0.780 -12.215 -11.110
177 HG11 VAL 21 HG11 VAL 21 0.226 -9.899 -11.166
178 HG12 VAL 21 HG12 VAL 21 0.491 -10.880 -12.607
179 HG13 VAL 21 HG13 VAL 21 1.790 -10.669 -11.434
180 HG21 VAL 21 HG21 VAL 21 2.147 -12.957 -11.079
181 HG22 VAL 21 HG22 VAL 21 0.889 -13.527 -12.177
182 HG23 VAL 21 HG23 VAL 21 0.877 -14.028 -10.485
183 H ASP 22 H ASP 22 1.399 -9.438 -8.755
184 HA ASP 22 HA ASP 22 3.754 -10.623 -7.563
185 HB2 ASP 22 HB2 ASP 22 5.356 -9.603 -9.159
186 HB3 ASP 22 HB3 ASP 22 4.326 -10.821 -9.943
187 H ALA 23 H ALA 23 5.351 -8.898 -6.822
188 HA ALA 23 HA ALA 23 3.801 -7.127 -5.231
189 HB1 ALA 23 HB1 ALA 23 5.810 -7.839 -4.286
190 HB2 ALA 23 HB2 ALA 23 6.085 -6.139 -4.666
191 HB3 ALA 23 HB3 ALA 23 6.746 -7.393 -5.714
192 H GLU 24 H GLU 24 5.646 -6.594 -8.252
193 HA GLU 24 HA GLU 24 5.528 -3.685 -8.041
194 HB2 GLU 24 HB2 GLU 24 5.725 -5.695 -10.347
195 HB3 GLU 24 HB3 GLU 24 5.696 -3.947 -10.650
196 HG2 GLU 24 HG2 GLU 24 7.650 -3.789 -9.016
197 HG3 GLU 24 HG3 GLU 24 7.755 -5.561 -9.150
198 H THR 25 H THR 25 3.214 -6.011 -9.536
199 HA THR 25 HA THR 25 1.529 -3.848 -10.628
200 HB THR 25 HB THR 25 0.797 -6.737 -9.909
201 HG1 THR 25 HG1 THR 25 1.902 -7.106 -11.647
202 HG21 THR 25 HG21 THR 25 -0.732 -4.607 -11.364
203 HG22 THR 25 HG22 THR 25 -1.272 -5.684 -10.077
204 HG23 THR 25 HG23 THR 25 -0.985 -6.320 -11.697
205 H ALA 26 H ALA 26 1.606 -5.640 -7.447
206 HA ALA 26 HA ALA 26 -0.792 -4.366 -6.369
207 HB1 ALA 26 HB1 ALA 26 0.505 -6.298 -5.330
208 HB2 ALA 26 HB2 ALA 26 -0.020 -5.037 -4.216
209 HB3 ALA 26 HB3 ALA 26 1.659 -5.095 -4.753
210 H GLU 27 H GLU 27 2.605 -3.229 -6.776
211 HA GLU 27 HA GLU 27 2.253 -0.945 -5.203
212 HB2 GLU 27 HB2 GLU 27 4.444 -1.774 -5.972
213 HB3 GLU 27 HB3 GLU 27 4.065 -1.205 -7.610
214 HG2 GLU 27 HG2 GLU 27 3.762 1.104 -6.570
215 HG3 GLU 27 HG3 GLU 27 4.528 0.427 -5.115
216 H LYS 28 H LYS 28 1.728 -1.284 -8.715
217 HA LYS 28 HA LYS 28 1.012 1.475 -9.141
218 HB2 LYS 28 HB2 LYS 28 -0.044 -0.939 -10.629
219 HB3 LYS 28 HB3 LYS 28 -0.024 0.743 -11.195
220 HG2 LYS 28 HG2 LYS 28 2.389 0.738 -11.282
221 HG3 LYS 28 HG3 LYS 28 2.446 -0.893 -10.568
222 HD2 LYS 28 HD2 LYS 28 1.654 -1.908 -12.502
223 HD3 LYS 28 HD3 LYS 28 0.900 -0.411 -13.102
224 HE2 LYS 28 HE2 LYS 28 3.013 0.515 -13.700
225 HE3 LYS 28 HE3 LYS 28 3.893 -0.758 -12.822
226 HZ1 LYS 28 HZ1 LYS 28 3.022 -2.356 -14.428
227 HZ2 LYS 28 HZ2 LYS 28 3.917 -1.178 -15.178
228 HZ3 LYS 28 HZ3 LYS 28 2.261 -1.138 -15.263
229 H ALA 29 H ALA 29 -1.021 -1.354 -8.136
230 HA ALA 29 HA ALA 29 -3.498 0.222 -8.307
231 HB1 ALA 29 HB1 ALA 29 -4.516 -1.588 -7.054
232 HB2 ALA 29 HB2 ALA 29 -2.944 -2.197 -6.536
233 HB3 ALA 29 HB3 ALA 29 -3.412 -2.297 -8.234
234 H PHE 30 H PHE 30 -1.237 -0.556 -5.532
235 HA PHE 30 HA PHE 30 -2.862 0.855 -3.615
236 HB2 PHE 30 HB2 PHE 30 0.061 0.016 -3.683
237 HB3 PHE 30 HB3 PHE 30 -0.681 0.819 -2.282
238 HD1 PHE 30 HD1 PHE 30 -3.263 -0.433 -2.030
239 HD2 PHE 30 HD2 PHE 30 0.464 -2.174 -3.126
240 HE1 PHE 30 HE1 PHE 30 -4.040 -2.614 -1.193
241 HE2 PHE 30 HE2 PHE 30 -0.307 -4.356 -2.293
242 HZ PHE 30 HZ PHE 30 -2.561 -4.578 -1.322
243 H LYS 31 H LYS 31 -0.189 1.987 -5.774
244 HA LYS 31 HA LYS 31 -0.121 4.615 -4.462
245 HB2 LYS 31 HB2 LYS 31 0.594 3.711 -7.269
246 HB3 LYS 31 HB3 LYS 31 0.736 5.398 -6.738
247 HG2 LYS 31 HG2 LYS 31 2.105 4.270 -4.754
248 HG3 LYS 31 HG3 LYS 31 2.355 3.009 -5.987
249 HD2 LYS 31 HD2 LYS 31 3.122 4.816 -7.556
250 HD3 LYS 31 HD3 LYS 31 3.050 5.953 -6.187
251 HE2 LYS 31 HE2 LYS 31 4.850 4.997 -5.119
252 HE3 LYS 31 HE3 LYS 31 4.577 3.400 -5.855
253 HZ1 LYS 31 HZ1 LYS 31 5.561 5.759 -7.347
254 HZ2 LYS 31 HZ2 LYS 31 5.465 4.197 -7.899
255 HZ3 LYS 31 HZ3 LYS 31 6.550 4.589 -6.706
256 H GLN 32 H GLN 32 -2.270 3.259 -6.939
257 HA GLN 32 HA GLN 32 -3.568 5.802 -7.441
258 HB2 GLN 32 HB2 GLN 32 -3.784 3.999 -9.056
259 HB3 GLN 32 HB3 GLN 32 -4.506 2.933 -7.835
260 HG2 GLN 32 HG2 GLN 32 -6.368 4.691 -7.668
261 HG3 GLN 32 HG3 GLN 32 -5.702 5.348 -9.181
262 HE21 GLN 32 HE21 GLN 32 -7.817 4.859 -10.052
263 HE22 GLN 32 HE22 GLN 32 -8.149 3.185 -10.619
264 H TYR 33 H TYR 33 -4.356 3.117 -5.231
265 HA TYR 33 HA TYR 33 -6.773 4.279 -4.187
266 HB2 TYR 33 HB2 TYR 33 -6.027 1.920 -3.773
267 HB3 TYR 33 HB3 TYR 33 -4.652 2.535 -2.831
268 HD1 TYR 33 HD2 TYR 33 -5.154 3.826 -0.695
269 HD2 TYR 33 HD1 TYR 33 -8.107 1.558 -2.754
270 HE1 TYR 33 HE2 TYR 33 -6.531 3.780 1.342
271 HE2 TYR 33 HE1 TYR 33 -9.492 1.507 -0.723
272 HH TYR 33 HH TYR 33 -8.646 1.842 2.094
273 H ALA 34 H ALA 34 -3.406 4.637 -3.017
274 HA ALA 34 HA ALA 34 -3.970 6.403 -0.879
275 HB1 ALA 34 HB1 ALA 34 -1.740 5.236 -1.562
276 HB2 ALA 34 HB2 ALA 34 -1.695 6.806 -0.760
277 HB3 ALA 34 HB3 ALA 34 -1.485 6.702 -2.508
278 H ASN 35 H ASN 35 -3.265 7.144 -4.297
279 HA ASN 35 HA ASN 35 -3.401 10.030 -3.844
280 HB2 ASN 35 HB2 ASN 35 -2.432 8.931 -5.894
281 HB3 ASN 35 HB3 ASN 35 -4.068 8.441 -6.386
282 HD21 ASN 35 HD21 ASN 35 -1.685 10.638 -6.876
283 HD22 ASN 35 HD22 ASN 35 -2.671 12.011 -7.488
284 H ASP 36 H ASP 36 -6.000 7.657 -4.776
285 HA ASP 36 HA ASP 36 -8.005 9.696 -5.125
286 HB2 ASP 36 HB2 ASP 36 -8.266 6.765 -4.433
287 HB3 ASP 36 HB3 ASP 36 -9.660 7.835 -4.700
288 H ASN 37 H ASN 37 -6.635 8.362 -2.204
289 HA ASN 37 HA ASN 37 -8.823 9.711 -0.652
290 HB2 ASN 37 HB2 ASN 37 -6.852 7.529 0.043
291 HB3 ASN 37 HB3 ASN 37 -7.760 8.411 1.290
292 HD21 ASN 37 HD21 ASN 37 -7.926 6.183 -1.401
293 HD22 ASN 37 HD22 ASN 37 -9.595 5.605 -1.066
294 H GLY 38 H GLY 38 -5.943 10.734 -1.796
295 HA2 GLY 38 HA2 GLY 38 -4.949 12.745 -1.207
296 HA3 GLY 38 HA3 GLY 38 -5.929 12.807 0.242
297 H VAL 39 H VAL 39 -3.843 10.067 -0.241
298 HA VAL 39 HA VAL 39 -2.151 11.057 2.045
299 HB VAL 39 HB VAL 39 -2.628 8.236 1.096
300 HG11 VAL 39 HG11 VAL 39 -1.346 8.889 3.697
301 HG12 VAL 39 HG12 VAL 39 -0.369 9.083 2.242
302 HG13 VAL 39 HG13 VAL 39 -1.091 7.517 2.618
303 HG21 VAL 39 HG21 VAL 39 -3.983 7.943 3.008
304 HG22 VAL 39 HG22 VAL 39 -4.525 9.461 2.290
305 HG23 VAL 39 HG23 VAL 39 -3.477 9.480 3.706
306 H ASP 40 H ASP 40 -0.164 11.454 1.839
307 HA ASP 40 HA ASP 40 1.275 10.370 -0.526
308 HB2 ASP 40 HB2 ASP 40 0.263 12.991 -0.259
309 HB3 ASP 40 HB3 ASP 40 2.016 13.116 -0.001
310 H GLY 41 H GLY 41 3.057 9.723 -0.289
311 HA2 GLY 41 HA2 GLY 41 4.987 10.772 1.716
312 HA3 GLY 41 HA3 GLY 41 4.131 9.336 2.225
313 H VAL 42 H VAL 42 6.056 8.530 2.724
314 HA VAL 42 HA VAL 42 7.766 7.796 0.462
315 HB VAL 42 HB VAL 42 8.224 7.702 3.441
316 HG11 VAL 42 HG11 VAL 42 9.233 5.746 2.250
317 HG12 VAL 42 HG12 VAL 42 10.397 6.798 3.057
318 HG13 VAL 42 HG13 VAL 42 10.195 6.886 1.308
319 HG21 VAL 42 HG21 VAL 42 10.229 9.171 2.564
320 HG22 VAL 42 HG22 VAL 42 8.640 9.874 2.864
321 HG23 VAL 42 HG23 VAL 42 9.130 9.470 1.221
322 H TRP 43 H TRP 43 8.042 5.696 -0.237
323 HA TRP 43 HA TRP 43 6.150 3.655 1.044
324 HB2 TRP 43 HB2 TRP 43 7.437 3.981 -1.703
325 HB3 TRP 43 HB3 TRP 43 6.574 2.507 -1.208
326 HD1 TRP 43 HD1 TRP 43 5.940 6.245 -1.918
327 HE1 TRP 43 HE1 TRP 43 3.424 6.593 -2.450
328 HE3 TRP 43 HE3 TRP 43 4.303 1.515 -0.886
329 HZ2 TRP 43 HZ2 TRP 43 1.082 5.004 -2.412
330 HZ3 TRP 43 HZ3 TRP 43 1.912 1.008 -1.159
331 HH2 TRP 43 HH2 TRP 43 0.335 2.717 -1.904
332 H THR 44 H THR 44 6.801 1.769 1.857
333 HA THR 44 HA THR 44 9.551 0.866 1.185
334 HB THR 44 HB THR 44 9.668 -0.140 3.543
335 HG1 THR 44 HG1 THR 44 7.535 1.698 3.896
336 HG21 THR 44 HG21 THR 44 10.942 1.892 2.838
337 HG22 THR 44 HG22 THR 44 10.576 1.795 4.561
338 HG23 THR 44 HG23 THR 44 9.640 2.869 3.521
339 H TYR 45 H TYR 45 9.764 -1.455 1.257
340 HA TYR 45 HA TYR 45 7.308 -2.987 1.392
341 HB2 TYR 45 HB2 TYR 45 7.673 -2.549 -0.962
342 HB3 TYR 45 HB3 TYR 45 9.346 -3.128 -0.815
343 HD1 TYR 45 HD1 TYR 45 6.137 -4.590 0.443
344 HD2 TYR 45 HD2 TYR 45 9.500 -5.034 -2.126
345 HE1 TYR 45 HE1 TYR 45 5.395 -6.863 -0.129
346 HE2 TYR 45 HE2 TYR 45 8.767 -7.309 -2.705
347 HH TYR 45 HH TYR 45 7.349 -9.111 -1.639
348 H ASP 46 H ASP 46 7.375 -4.866 2.454
349 HA ASP 46 HA ASP 46 10.059 -5.946 3.064
350 HB2 ASP 46 HB2 ASP 46 8.868 -5.221 5.112
351 HB3 ASP 46 HB3 ASP 46 7.470 -6.217 4.651
352 H ASP 47 H ASP 47 10.445 -7.548 1.671
353 HA ASP 47 HA ASP 47 8.335 -8.921 0.258
354 HB2 ASP 47 HB2 ASP 47 10.012 -9.865 -0.944
355 HB3 ASP 47 HB3 ASP 47 11.003 -8.627 -0.141
356 H ALA 48 H ALA 48 9.933 -9.702 3.381
357 HA ALA 48 HA ALA 48 9.159 -12.540 3.273
358 HB1 ALA 48 HB1 ALA 48 9.708 -10.638 5.607
359 HB2 ALA 48 HB2 ALA 48 10.874 -11.704 4.822
360 HB3 ALA 48 HB3 ALA 48 9.545 -12.386 5.760
361 H THR 49 H THR 49 7.451 -9.629 4.375
362 HA THR 49 HA THR 49 5.113 -11.461 5.157
363 HB THR 49 HB THR 49 4.168 -9.513 6.394
364 HG1 THR 49 HG1 THR 49 6.498 -8.118 5.544
365 HG21 THR 49 HG21 THR 49 5.377 -9.972 8.185
366 HG22 THR 49 HG22 THR 49 6.771 -9.117 7.526
367 HG23 THR 49 HG23 THR 49 6.527 -10.823 7.152
368 H LYS 50 H LYS 50 6.116 -9.766 2.475
369 HA LYS 50 HA LYS 50 5.010 -8.784 0.675
370 HB2 LYS 50 HB2 LYS 50 2.677 -10.524 1.636
371 HB3 LYS 50 HB3 LYS 50 2.796 -9.750 0.044
372 HG2 LYS 50 HG2 LYS 50 4.883 -11.694 1.023
373 HG3 LYS 50 HG3 LYS 50 3.389 -12.236 0.218
374 HD2 LYS 50 HD2 LYS 50 4.003 -10.616 -1.660
375 HD3 LYS 50 HD3 LYS 50 5.605 -10.499 -0.890
376 HE2 LYS 50 HE2 LYS 50 6.189 -12.629 -1.467
377 HE3 LYS 50 HE3 LYS 50 4.517 -13.232 -1.379
378 HZ1 LYS 50 HZ1 LYS 50 4.059 -12.221 -3.478
379 HZ2 LYS 50 HZ2 LYS 50 5.428 -13.143 -3.650
380 HZ3 LYS 50 HZ3 LYS 50 5.549 -11.492 -3.540
381 H THR 51 H THR 51 5.050 -7.196 2.884
382 HA THR 51 HA THR 51 2.480 -5.805 2.746
383 HB THR 51 HB THR 51 4.488 -5.930 4.985
384 HG1 THR 51 HG1 THR 51 1.823 -6.884 4.749
385 HG21 THR 51 HG21 THR 51 3.352 -3.703 4.780
386 HG22 THR 51 HG22 THR 51 3.062 -4.562 6.293
387 HG23 THR 51 HG23 THR 51 1.820 -4.538 5.042
388 H PHE 52 H PHE 52 2.328 -3.797 2.095
389 HA PHE 52 HA PHE 52 4.995 -2.288 1.539
390 HB2 PHE 52 HB2 PHE 52 2.107 -2.042 0.449
391 HB3 PHE 52 HB3 PHE 52 3.373 -0.821 0.191
392 HD1 PHE 52 HD2 PHE 52 5.332 -1.348 -1.184
393 HD2 PHE 52 HD1 PHE 52 2.122 -4.109 -0.743
394 HE1 PHE 52 HE2 PHE 52 6.141 -2.596 -3.146
395 HE2 PHE 52 HE1 PHE 52 2.924 -5.361 -2.704
396 HZ PHE 52 HZ PHE 52 4.936 -4.604 -3.908
397 H THR 53 H THR 53 5.108 -0.339 2.795
398 HA THR 53 HA THR 53 2.824 0.447 4.505
399 HB THR 53 HB THR 53 5.782 0.609 5.228
400 HG1 THR 53 HG1 THR 53 5.337 -1.373 5.808
401 HG21 THR 53 HG21 THR 53 5.301 1.873 7.002
402 HG22 THR 53 HG22 THR 53 3.793 1.018 7.333
403 HG23 THR 53 HG23 THR 53 3.834 2.297 6.119
404 H VAL 54 H VAL 54 2.306 2.600 4.429
405 HA VAL 54 HA VAL 54 4.333 4.345 2.938
406 HB VAL 54 HB VAL 54 2.367 4.027 1.471
407 HG11 VAL 54 HG11 VAL 54 0.142 4.605 2.081
408 HG12 VAL 54 HG12 VAL 54 0.662 5.273 3.628
409 HG13 VAL 54 HG13 VAL 54 0.753 3.535 3.342
410 HG21 VAL 54 HG21 VAL 54 1.639 6.490 1.407
411 HG22 VAL 54 HG22 VAL 54 3.358 6.137 1.232
412 HG23 VAL 54 HG23 VAL 54 2.729 6.716 2.775
413 H THR 55 H THR 55 5.065 5.834 4.333
414 HA THR 55 HA THR 55 3.455 6.495 6.770
415 HB THR 55 HB THR 55 6.468 6.487 6.408
416 HG1 THR 55 HG1 THR 55 4.822 4.764 7.958
417 HG21 THR 55 HG21 THR 55 4.969 6.787 8.989
418 HG22 THR 55 HG22 THR 55 5.624 8.147 8.078
419 HG23 THR 55 HG23 THR 55 6.705 6.906 8.708
420 H GLU 56 H GLU 56 2.802 8.546 6.891
421 HA GLU 56 HA GLU 56 3.886 10.613 4.982
422 HB2 GLU 56 HB2 GLU 56 1.432 10.214 5.202
423 HB3 GLU 56 HB3 GLU 56 1.534 10.676 6.911
424 HG2 GLU 56 HG2 GLU 56 2.636 12.856 5.880
425 HG3 GLU 56 HG3 GLU 56 1.695 12.353 4.456
Start of MODEL 12
1 H1 MET 1 H1 MET 1 -1.060 -13.068 -5.568
2 H2 MET 1 H2 MET 1 -2.124 -14.314 -5.180
3 H3 MET 1 H3 MET 1 -0.502 -14.654 -5.475
4 HA MET 1 HA MET 1 -1.181 -14.666 -3.114
5 HB2 MET 1 HB2 MET 1 0.946 -12.668 -3.953
6 HB3 MET 1 HB3 MET 1 0.868 -13.560 -2.422
7 HG2 MET 1 HG2 MET 1 0.978 -15.679 -3.875
8 HG3 MET 1 HG3 MET 1 1.494 -14.589 -5.183
9 HE1 MET 1 HE1 MET 1 3.667 -16.311 -1.725
10 HE2 MET 1 HE2 MET 1 1.929 -16.050 -1.874
11 HE3 MET 1 HE3 MET 1 2.942 -14.829 -1.104
12 H GLN 2 H GLN 2 -1.591 -13.411 -1.235
13 HA GLN 2 HA GLN 2 -3.069 -10.911 -1.810
14 HB2 GLN 2 HB2 GLN 2 -2.950 -12.922 0.406
15 HB3 GLN 2 HB3 GLN 2 -3.274 -11.242 0.877
16 HG2 GLN 2 HG2 GLN 2 -5.291 -11.172 -0.270
17 HG3 GLN 2 HG3 GLN 2 -4.862 -12.546 -1.316
18 HE21 GLN 2 HE21 GLN 2 -7.292 -12.268 0.097
19 HE22 GLN 2 HE22 GLN 2 -7.361 -13.589 1.315
20 H TYR 3 H TYR 3 -2.359 -8.945 -1.287
21 HA TYR 3 HA TYR 3 0.143 -8.588 0.255
22 HB2 TYR 3 HB2 TYR 3 -0.824 -6.903 -2.051
23 HB3 TYR 3 HB3 TYR 3 0.580 -6.529 -1.025
24 HD1 TYR 3 HD1 TYR 3 -0.774 -9.200 -3.267
25 HD2 TYR 3 HD2 TYR 3 2.681 -7.331 -1.626
26 HE1 TYR 3 HE1 TYR 3 0.655 -10.559 -4.734
27 HE2 TYR 3 HE2 TYR 3 4.117 -8.686 -3.092
28 HH TYR 3 HH TYR 3 3.952 -9.915 -5.211
29 H LYS 4 H LYS 4 0.202 -6.809 1.731
30 HA LYS 4 HA LYS 4 -2.416 -5.612 2.301
31 HB2 LYS 4 HB2 LYS 4 -0.166 -6.409 4.154
32 HB3 LYS 4 HB3 LYS 4 -1.560 -5.435 4.661
33 HG2 LYS 4 HG2 LYS 4 -3.047 -7.313 3.936
34 HG3 LYS 4 HG3 LYS 4 -1.584 -8.286 3.644
35 HD2 LYS 4 HD2 LYS 4 -2.253 -6.987 6.301
36 HD3 LYS 4 HD3 LYS 4 -2.679 -8.665 5.879
37 HE2 LYS 4 HE2 LYS 4 -0.371 -9.267 5.647
38 HE3 LYS 4 HE3 LYS 4 0.144 -7.569 5.792
39 HZ1 LYS 4 HZ1 LYS 4 -0.182 -7.593 8.029
40 HZ2 LYS 4 HZ2 LYS 4 0.210 -9.191 7.825
41 HZ3 LYS 4 HZ3 LYS 4 -1.378 -8.745 7.990
42 H LEU 5 H LEU 5 -2.561 -3.456 2.830
43 HA LEU 5 HA LEU 5 0.035 -1.872 2.532
44 HB2 LEU 5 HB2 LEU 5 -1.416 -1.401 0.635
45 HB3 LEU 5 HB3 LEU 5 -2.816 -1.153 1.688
46 HG LEU 5 HG LEU 5 -1.559 0.812 2.704
47 HD11 LEU 5 HD11 LEU 5 0.683 0.322 2.054
48 HD12 LEU 5 HD12 LEU 5 0.194 1.787 1.204
49 HD13 LEU 5 HD13 LEU 5 0.240 0.245 0.349
50 HD21 LEU 5 HD21 LEU 5 -2.266 2.307 0.996
51 HD22 LEU 5 HD22 LEU 5 -3.378 0.938 0.966
52 HD23 LEU 5 HD23 LEU 5 -2.110 1.070 -0.251
53 H VAL 6 H VAL 6 0.425 -0.833 4.424
54 HA VAL 6 HA VAL 6 -1.689 -0.321 6.374
55 HB VAL 6 HB VAL 6 1.310 -0.391 6.829
56 HG11 VAL 6 HG11 VAL 6 0.914 0.132 9.081
57 HG12 VAL 6 HG12 VAL 6 -0.817 -0.182 8.951
58 HG13 VAL 6 HG13 VAL 6 -0.120 1.248 8.188
59 HG21 VAL 6 HG21 VAL 6 -0.882 -2.364 7.367
60 HG22 VAL 6 HG22 VAL 6 0.537 -2.306 8.413
61 HG23 VAL 6 HG23 VAL 6 0.725 -2.625 6.689
62 H ILE 7 H ILE 7 -2.336 1.728 6.609
63 HA ILE 7 HA ILE 7 -0.551 3.864 5.261
64 HB ILE 7 HB ILE 7 -3.537 3.982 5.930
65 HG12 ILE 7 HG12 ILE 7 -2.131 3.930 3.232
66 HG13 ILE 7 HG13 ILE 7 -2.913 2.521 3.981
67 HG21 ILE 7 HG21 ILE 7 -3.201 6.096 4.425
68 HG22 ILE 7 HG22 ILE 7 -1.529 5.985 4.976
69 HG23 ILE 7 HG23 ILE 7 -2.834 6.166 6.147
70 HD11 ILE 7 HD11 ILE 7 -4.341 3.569 2.310
71 HD12 ILE 7 HD12 ILE 7 -4.283 5.093 3.197
72 HD13 ILE 7 HD13 ILE 7 -5.057 3.681 3.918
73 H ASN 8 H ASN 8 0.635 4.871 6.749
74 HA ASN 8 HA ASN 8 -0.544 5.355 9.493
75 HB2 ASN 8 HB2 ASN 8 1.547 3.939 9.335
76 HB3 ASN 8 HB3 ASN 8 2.396 5.346 8.657
77 HD21 ASN 8 HD21 ASN 8 3.102 3.960 11.028
78 HD22 ASN 8 HD22 ASN 8 2.913 5.118 12.391
79 H GLY 9 H GLY 9 -1.756 7.135 8.423
80 HA2 GLY 9 HA2 GLY 9 -0.280 9.409 7.274
81 HA3 GLY 9 HA3 GLY 9 -1.974 9.129 7.249
82 H LYS 10 H LYS 10 -1.157 11.638 7.920
83 HA LYS 10 HA LYS 10 -0.897 12.035 10.799
84 HB2 LYS 10 HB2 LYS 10 -0.156 13.601 8.998
85 HB3 LYS 10 HB3 LYS 10 -1.864 13.925 8.638
86 HG2 LYS 10 HG2 LYS 10 -2.182 15.151 10.541
87 HG3 LYS 10 HG3 LYS 10 -0.944 14.258 11.457
88 HD2 LYS 10 HD2 LYS 10 -0.025 16.403 11.120
89 HD3 LYS 10 HD3 LYS 10 0.765 15.365 9.907
90 HE2 LYS 10 HE2 LYS 10 -0.621 16.208 8.159
91 HE3 LYS 10 HE3 LYS 10 -1.695 17.030 9.317
92 HZ1 LYS 10 HZ1 LYS 10 1.058 17.757 8.551
93 HZ2 LYS 10 HZ2 LYS 10 0.359 18.345 9.936
94 HZ3 LYS 10 HZ3 LYS 10 -0.318 18.682 8.460
95 H THR 11 H THR 11 -3.445 12.020 8.538
96 HA THR 11 HA THR 11 -5.551 12.266 10.621
97 HB THR 11 HB THR 11 -7.031 13.200 8.942
98 HG1 THR 11 HG1 THR 11 -6.364 13.486 6.977
99 HG21 THR 11 HG21 THR 11 -4.533 14.723 9.645
100 HG22 THR 11 HG22 THR 11 -6.109 14.775 10.435
101 HG23 THR 11 HG23 THR 11 -5.909 15.452 8.819
102 H LEU 12 H LEU 12 -4.514 10.208 8.010
103 HA LEU 12 HA LEU 12 -6.880 8.555 8.637
104 HB2 LEU 12 HB2 LEU 12 -6.904 9.385 6.325
105 HB3 LEU 12 HB3 LEU 12 -5.284 8.717 6.071
106 HG LEU 12 HG LEU 12 -6.179 6.435 6.416
107 HD11 LEU 12 HD11 LEU 12 -8.050 7.043 7.895
108 HD12 LEU 12 HD12 LEU 12 -8.572 6.059 6.527
109 HD13 LEU 12 HD13 LEU 12 -8.876 7.796 6.530
110 HD21 LEU 12 HD21 LEU 12 -7.710 8.006 4.335
111 HD22 LEU 12 HD22 LEU 12 -7.363 6.277 4.310
112 HD23 LEU 12 HD23 LEU 12 -6.048 7.443 4.164
113 H LYS 13 H LYS 13 -6.505 6.674 9.641
114 HA LYS 13 HA LYS 13 -3.873 5.402 9.184
115 HB2 LYS 13 HB2 LYS 13 -5.415 5.480 11.772
116 HB3 LYS 13 HB3 LYS 13 -3.899 4.601 11.500
117 HG2 LYS 13 HG2 LYS 13 -2.960 6.936 10.835
118 HG3 LYS 13 HG3 LYS 13 -4.378 7.557 11.715
119 HD2 LYS 13 HD2 LYS 13 -3.694 6.435 13.733
120 HD3 LYS 13 HD3 LYS 13 -2.379 5.593 12.874
121 HE2 LYS 13 HE2 LYS 13 -2.557 8.608 13.065
122 HE3 LYS 13 HE3 LYS 13 -1.717 7.612 14.277
123 HZ1 LYS 13 HZ1 LYS 13 -0.249 6.822 12.581
124 HZ2 LYS 13 HZ2 LYS 13 -0.246 8.479 12.534
125 HZ3 LYS 13 HZ3 LYS 13 -1.080 7.622 11.386
126 H GLY 14 H GLY 14 -4.019 3.134 8.536
127 HA2 GLY 14 HA2 GLY 14 -5.861 1.373 9.547
128 HA3 GLY 14 HA3 GLY 14 -6.718 1.951 8.139
129 H GLU 15 H GLU 15 -6.667 -0.183 7.502
130 HA GLU 15 HA GLU 15 -4.187 -0.875 6.044
131 HB2 GLU 15 HB2 GLU 15 -4.738 -3.304 6.787
132 HB3 GLU 15 HB3 GLU 15 -3.898 -2.222 7.916
133 HG2 GLU 15 HG2 GLU 15 -6.139 -1.686 8.921
134 HG3 GLU 15 HG3 GLU 15 -6.826 -2.974 7.906
135 H THR 16 H THR 16 -4.486 -2.154 4.107
136 HA THR 16 HA THR 16 -7.202 -3.121 3.619
137 HB THR 16 HB THR 16 -7.278 -0.835 2.610
138 HG1 THR 16 HG1 THR 16 -8.572 -2.131 1.502
139 HG21 THR 16 HG21 THR 16 -4.801 -0.845 1.982
140 HG22 THR 16 HG22 THR 16 -5.944 -0.174 0.819
141 HG23 THR 16 HG23 THR 16 -5.289 -1.793 0.578
142 H THR 17 H THR 17 -7.150 -4.376 1.434
143 HA THR 17 HA THR 17 -4.519 -5.628 1.113
144 HB THR 17 HB THR 17 -5.466 -7.856 1.229
145 HG1 THR 17 HG1 THR 17 -7.877 -6.501 1.896
146 HG21 THR 17 HG21 THR 17 -5.537 -8.088 3.490
147 HG22 THR 17 HG22 THR 17 -6.539 -6.655 3.726
148 HG23 THR 17 HG23 THR 17 -4.818 -6.481 3.385
149 H THR 18 H THR 18 -4.323 -6.844 -0.842
150 HA THR 18 HA THR 18 -6.553 -6.629 -2.738
151 HB THR 18 HB THR 18 -5.093 -4.536 -3.124
152 HG1 THR 18 HG1 THR 18 -6.412 -5.117 -4.772
153 HG21 THR 18 HG21 THR 18 -3.249 -6.150 -4.755
154 HG22 THR 18 HG22 THR 18 -2.961 -6.182 -3.014
155 HG23 THR 18 HG23 THR 18 -2.982 -4.644 -3.878
156 H LYS 19 H LYS 19 -6.177 -8.032 -4.633
157 HA LYS 19 HA LYS 19 -4.243 -10.199 -3.998
158 HB2 LYS 19 HB2 LYS 19 -6.725 -10.223 -5.753
159 HB3 LYS 19 HB3 LYS 19 -5.651 -11.603 -5.463
160 HG2 LYS 19 HG2 LYS 19 -6.681 -10.382 -3.001
161 HG3 LYS 19 HG3 LYS 19 -7.954 -11.017 -4.072
162 HD2 LYS 19 HD2 LYS 19 -5.510 -12.599 -3.222
163 HD3 LYS 19 HD3 LYS 19 -7.073 -12.652 -2.369
164 HE2 LYS 19 HE2 LYS 19 -6.979 -13.146 -5.330
165 HE3 LYS 19 HE3 LYS 19 -6.486 -14.438 -4.210
166 HZ1 LYS 19 HZ1 LYS 19 -8.736 -13.816 -3.090
167 HZ2 LYS 19 HZ2 LYS 19 -8.708 -14.830 -4.403
168 HZ3 LYS 19 HZ3 LYS 19 -9.121 -13.235 -4.597
169 H ALA 20 H ALA 20 -2.533 -10.480 -5.444
170 HA ALA 20 HA ALA 20 -2.805 -9.487 -8.110
171 HB1 ALA 20 HB1 ALA 20 -0.589 -8.213 -7.925
172 HB2 ALA 20 HB2 ALA 20 -0.820 -8.285 -6.178
173 HB3 ALA 20 HB3 ALA 20 -1.993 -7.440 -7.190
174 H VAL 21 H VAL 21 -1.191 -10.238 -9.607
175 HA VAL 21 HA VAL 21 -0.023 -12.646 -8.835
176 HB VAL 21 HB VAL 21 0.970 -12.793 -11.039
177 HG11 VAL 21 HG11 VAL 21 -1.471 -13.262 -10.589
178 HG12 VAL 21 HG12 VAL 21 -1.066 -12.865 -12.259
179 HG13 VAL 21 HG13 VAL 21 -1.817 -11.652 -11.223
180 HG21 VAL 21 HG21 VAL 21 -0.152 -10.032 -11.528
181 HG22 VAL 21 HG22 VAL 21 0.871 -10.998 -12.593
182 HG23 VAL 21 HG23 VAL 21 1.535 -10.324 -11.104
183 H ASP 22 H ASP 22 1.399 -9.438 -8.755
184 HA ASP 22 HA ASP 22 3.754 -10.623 -7.563
185 HB2 ASP 22 HB2 ASP 22 5.357 -9.606 -9.159
186 HB3 ASP 22 HB3 ASP 22 4.324 -10.820 -9.945
187 H ALA 23 H ALA 23 5.351 -8.898 -6.822
188 HA ALA 23 HA ALA 23 3.801 -7.127 -5.231
189 HB1 ALA 23 HB1 ALA 23 5.810 -7.839 -4.286
190 HB2 ALA 23 HB2 ALA 23 6.085 -6.139 -4.666
191 HB3 ALA 23 HB3 ALA 23 6.746 -7.393 -5.714
192 H GLU 24 H GLU 24 5.646 -6.594 -8.252
193 HA GLU 24 HA GLU 24 5.528 -3.685 -8.041
194 HB2 GLU 24 HB2 GLU 24 5.724 -5.694 -10.348
195 HB3 GLU 24 HB3 GLU 24 5.697 -3.946 -10.649
196 HG2 GLU 24 HG2 GLU 24 7.651 -3.793 -9.015
197 HG3 GLU 24 HG3 GLU 24 7.753 -5.564 -9.150
198 H THR 25 H THR 25 3.214 -6.011 -9.536
199 HA THR 25 HA THR 25 1.529 -3.848 -10.628
200 HB THR 25 HB THR 25 0.799 -6.738 -9.910
201 HG1 THR 25 HG1 THR 25 1.901 -7.104 -11.650
202 HG21 THR 25 HG21 THR 25 -0.735 -4.607 -11.361
203 HG22 THR 25 HG22 THR 25 -1.272 -5.686 -10.073
204 HG23 THR 25 HG23 THR 25 -0.986 -6.321 -11.694
205 H ALA 26 H ALA 26 1.606 -5.640 -7.447
206 HA ALA 26 HA ALA 26 -0.792 -4.366 -6.369
207 HB1 ALA 26 HB1 ALA 26 0.505 -6.298 -5.330
208 HB2 ALA 26 HB2 ALA 26 -0.020 -5.037 -4.216
209 HB3 ALA 26 HB3 ALA 26 1.659 -5.095 -4.753
210 H GLU 27 H GLU 27 2.605 -3.229 -6.776
211 HA GLU 27 HA GLU 27 2.253 -0.945 -5.203
212 HB2 GLU 27 HB2 GLU 27 4.444 -1.775 -5.973
213 HB3 GLU 27 HB3 GLU 27 4.065 -1.204 -7.610
214 HG2 GLU 27 HG2 GLU 27 3.762 1.104 -6.567
215 HG3 GLU 27 HG3 GLU 27 4.529 0.424 -5.113
216 H LYS 28 H LYS 28 1.728 -1.284 -8.715
217 HA LYS 28 HA LYS 28 1.012 1.475 -9.141
218 HB2 LYS 28 HB2 LYS 28 -0.041 -0.940 -10.628
219 HB3 LYS 28 HB3 LYS 28 -0.027 0.741 -11.194
220 HG2 LYS 28 HG2 LYS 28 2.386 0.744 -11.284
221 HG3 LYS 28 HG3 LYS 28 2.449 -0.887 -10.570
222 HD2 LYS 28 HD2 LYS 28 1.658 -1.905 -12.503
223 HD3 LYS 28 HD3 LYS 28 0.898 -0.409 -13.103
224 HE2 LYS 28 HE2 LYS 28 3.008 0.523 -13.703
225 HE3 LYS 28 HE3 LYS 28 3.893 -0.747 -12.826
226 HZ1 LYS 28 HZ1 LYS 28 3.026 -2.347 -14.431
227 HZ2 LYS 28 HZ2 LYS 28 3.916 -1.166 -15.182
228 HZ3 LYS 28 HZ3 LYS 28 2.260 -1.132 -15.265
229 H ALA 29 H ALA 29 -1.021 -1.354 -8.136
230 HA ALA 29 HA ALA 29 -3.498 0.222 -8.307
231 HB1 ALA 29 HB1 ALA 29 -4.516 -1.588 -7.054
232 HB2 ALA 29 HB2 ALA 29 -2.944 -2.197 -6.536
233 HB3 ALA 29 HB3 ALA 29 -3.412 -2.297 -8.234
234 H PHE 30 H PHE 30 -1.237 -0.556 -5.532
235 HA PHE 30 HA PHE 30 -2.862 0.855 -3.615
236 HB2 PHE 30 HB2 PHE 30 0.062 0.019 -3.681
237 HB3 PHE 30 HB3 PHE 30 -0.684 0.817 -2.280
238 HD1 PHE 30 HD1 PHE 30 -3.263 -0.442 -2.036
239 HD2 PHE 30 HD2 PHE 30 0.469 -2.171 -3.130
240 HE1 PHE 30 HE1 PHE 30 -4.037 -2.627 -1.206
241 HE2 PHE 30 HE2 PHE 30 -0.297 -4.357 -2.305
242 HZ PHE 30 HZ PHE 30 -2.553 -4.587 -1.338
243 H LYS 31 H LYS 31 -0.189 1.987 -5.774
244 HA LYS 31 HA LYS 31 -0.121 4.615 -4.462
245 HB2 LYS 31 HB2 LYS 31 0.594 3.712 -7.270
246 HB3 LYS 31 HB3 LYS 31 0.736 5.398 -6.737
247 HG2 LYS 31 HG2 LYS 31 2.105 4.267 -4.755
248 HG3 LYS 31 HG3 LYS 31 2.354 3.007 -5.988
249 HD2 LYS 31 HD2 LYS 31 3.123 4.815 -7.556
250 HD3 LYS 31 HD3 LYS 31 3.051 5.951 -6.186
251 HE2 LYS 31 HE2 LYS 31 4.851 4.992 -5.119
252 HE3 LYS 31 HE3 LYS 31 4.576 3.397 -5.857
253 HZ1 LYS 31 HZ1 LYS 31 5.562 5.756 -7.347
254 HZ2 LYS 31 HZ2 LYS 31 5.465 4.195 -7.900
255 HZ3 LYS 31 HZ3 LYS 31 6.550 4.584 -6.707
256 H GLN 32 H GLN 32 -2.270 3.259 -6.939
257 HA GLN 32 HA GLN 32 -3.568 5.802 -7.441
258 HB2 GLN 32 HB2 GLN 32 -3.784 3.998 -9.056
259 HB3 GLN 32 HB3 GLN 32 -4.508 2.933 -7.834
260 HG2 GLN 32 HG2 GLN 32 -6.451 4.437 -7.693
261 HG3 GLN 32 HG3 GLN 32 -5.725 5.474 -8.944
262 HE21 GLN 32 HE21 GLN 32 -8.240 4.422 -9.262
263 HE22 GLN 32 HE22 GLN 32 -8.194 3.181 -10.563
264 H TYR 33 H TYR 33 -4.356 3.117 -5.231
265 HA TYR 33 HA TYR 33 -6.773 4.279 -4.187
266 HB2 TYR 33 HB2 TYR 33 -6.027 1.920 -3.773
267 HB3 TYR 33 HB3 TYR 33 -4.652 2.536 -2.831
268 HD1 TYR 33 HD2 TYR 33 -5.154 3.826 -0.695
269 HD2 TYR 33 HD1 TYR 33 -8.107 1.558 -2.754
270 HE1 TYR 33 HE2 TYR 33 -6.532 3.780 1.342
271 HE2 TYR 33 HE1 TYR 33 -9.493 1.507 -0.723
272 HH TYR 33 HH TYR 33 -8.646 1.842 2.093
273 H ALA 34 H ALA 34 -3.406 4.637 -3.017
274 HA ALA 34 HA ALA 34 -3.970 6.403 -0.879
275 HB1 ALA 34 HB1 ALA 34 -1.740 5.236 -1.562
276 HB2 ALA 34 HB2 ALA 34 -1.695 6.806 -0.760
277 HB3 ALA 34 HB3 ALA 34 -1.485 6.702 -2.508
278 H ASN 35 H ASN 35 -3.265 7.144 -4.297
279 HA ASN 35 HA ASN 35 -3.401 10.030 -3.844
280 HB2 ASN 35 HB2 ASN 35 -3.858 8.281 -6.318
281 HB3 ASN 35 HB3 ASN 35 -3.905 10.056 -6.373
282 HD21 ASN 35 HD21 ASN 35 -2.161 8.873 -7.978
283 HD22 ASN 35 HD22 ASN 35 -0.486 9.048 -7.349
284 H ASP 36 H ASP 36 -6.000 7.657 -4.776
285 HA ASP 36 HA ASP 36 -8.005 9.696 -5.125
286 HB2 ASP 36 HB2 ASP 36 -8.267 6.766 -4.431
287 HB3 ASP 36 HB3 ASP 36 -9.660 7.836 -4.702
288 H ASN 37 H ASN 37 -6.635 8.362 -2.204
289 HA ASN 37 HA ASN 37 -8.823 9.711 -0.652
290 HB2 ASN 37 HB2 ASN 37 -6.851 7.530 0.045
291 HB3 ASN 37 HB3 ASN 37 -7.762 8.411 1.290
292 HD21 ASN 37 HD21 ASN 37 -7.921 6.183 -1.402
293 HD22 ASN 37 HD22 ASN 37 -9.590 5.604 -1.068
294 H GLY 38 H GLY 38 -5.943 10.734 -1.796
295 HA2 GLY 38 HA2 GLY 38 -4.949 12.745 -1.207
296 HA3 GLY 38 HA3 GLY 38 -5.929 12.807 0.242
297 H VAL 39 H VAL 39 -3.843 10.067 -0.241
298 HA VAL 39 HA VAL 39 -2.151 11.057 2.045
299 HB VAL 39 HB VAL 39 -2.631 8.236 1.096
300 HG11 VAL 39 HG11 VAL 39 -1.341 8.887 3.694
301 HG12 VAL 39 HG12 VAL 39 -0.368 9.080 2.236
302 HG13 VAL 39 HG13 VAL 39 -1.091 7.515 2.613
303 HG21 VAL 39 HG21 VAL 39 -3.981 7.945 3.012
304 HG22 VAL 39 HG22 VAL 39 -4.523 9.463 2.296
305 HG23 VAL 39 HG23 VAL 39 -3.471 9.481 3.709
306 H ASP 40 H ASP 40 -0.164 11.454 1.839
307 HA ASP 40 HA ASP 40 1.275 10.370 -0.526
308 HB2 ASP 40 HB2 ASP 40 0.263 12.992 -0.258
309 HB3 ASP 40 HB3 ASP 40 2.017 13.116 -0.002
310 H GLY 41 H GLY 41 3.057 9.723 -0.289
311 HA2 GLY 41 HA2 GLY 41 4.987 10.772 1.716
312 HA3 GLY 41 HA3 GLY 41 4.131 9.336 2.225
313 H VAL 42 H VAL 42 6.056 8.530 2.724
314 HA VAL 42 HA VAL 42 7.766 7.796 0.462
315 HB VAL 42 HB VAL 42 8.225 7.700 3.441
316 HG11 VAL 42 HG11 VAL 42 9.236 5.748 2.246
317 HG12 VAL 42 HG12 VAL 42 10.398 6.800 3.054
318 HG13 VAL 42 HG13 VAL 42 10.196 6.890 1.306
319 HG21 VAL 42 HG21 VAL 42 10.227 9.173 2.566
320 HG22 VAL 42 HG22 VAL 42 8.637 9.873 2.868
321 HG23 VAL 42 HG23 VAL 42 9.127 9.473 1.223
322 H TRP 43 H TRP 43 8.042 5.696 -0.237
323 HA TRP 43 HA TRP 43 6.150 3.655 1.044
324 HB2 TRP 43 HB2 TRP 43 7.436 3.983 -1.703
325 HB3 TRP 43 HB3 TRP 43 6.577 2.507 -1.208
326 HD1 TRP 43 HD1 TRP 43 5.934 6.244 -1.916
327 HE1 TRP 43 HE1 TRP 43 3.417 6.586 -2.447
328 HE3 TRP 43 HE3 TRP 43 4.307 1.509 -0.887
329 HZ2 TRP 43 HZ2 TRP 43 1.078 4.992 -2.408
330 HZ3 TRP 43 HZ3 TRP 43 1.918 0.997 -1.159
331 HH2 TRP 43 HH2 TRP 43 0.337 2.703 -1.902
332 H THR 44 H THR 44 6.801 1.769 1.857
333 HA THR 44 HA THR 44 9.551 0.866 1.185
334 HB THR 44 HB THR 44 9.667 -0.141 3.544
335 HG1 THR 44 HG1 THR 44 7.537 1.701 3.896
336 HG21 THR 44 HG21 THR 44 10.944 1.889 2.838
337 HG22 THR 44 HG22 THR 44 10.578 1.794 4.561
338 HG23 THR 44 HG23 THR 44 9.644 2.869 3.520
339 H TYR 45 H TYR 45 9.764 -1.455 1.257
340 HA TYR 45 HA TYR 45 7.308 -2.987 1.392
341 HB2 TYR 45 HB2 TYR 45 7.673 -2.549 -0.962
342 HB3 TYR 45 HB3 TYR 45 9.346 -3.129 -0.815
343 HD1 TYR 45 HD1 TYR 45 6.136 -4.589 0.443
344 HD2 TYR 45 HD2 TYR 45 9.499 -5.034 -2.126
345 HE1 TYR 45 HE1 TYR 45 5.393 -6.861 -0.129
346 HE2 TYR 45 HE2 TYR 45 8.765 -7.309 -2.705
347 HH TYR 45 HH TYR 45 7.345 -9.110 -1.640
348 H ASP 46 H ASP 46 7.375 -4.866 2.454
349 HA ASP 46 HA ASP 46 10.059 -5.946 3.064
350 HB2 ASP 46 HB2 ASP 46 8.867 -5.220 5.112
351 HB3 ASP 46 HB3 ASP 46 7.470 -6.218 4.651
352 H ASP 47 H ASP 47 10.445 -7.548 1.671
353 HA ASP 47 HA ASP 47 8.335 -8.921 0.258
354 HB2 ASP 47 HB2 ASP 47 10.705 -8.632 -0.544
355 HB3 ASP 47 HB3 ASP 47 11.205 -9.851 0.649
356 H ALA 48 H ALA 48 9.933 -9.702 3.381
357 HA ALA 48 HA ALA 48 9.159 -12.540 3.273
358 HB1 ALA 48 HB1 ALA 48 9.708 -10.638 5.607
359 HB2 ALA 48 HB2 ALA 48 10.874 -11.704 4.822
360 HB3 ALA 48 HB3 ALA 48 9.545 -12.386 5.760
361 H THR 49 H THR 49 7.451 -9.629 4.375
362 HA THR 49 HA THR 49 5.113 -11.461 5.157
363 HB THR 49 HB THR 49 4.168 -9.514 6.395
364 HG1 THR 49 HG1 THR 49 6.497 -8.117 5.543
365 HG21 THR 49 HG21 THR 49 5.379 -9.972 8.185
366 HG22 THR 49 HG22 THR 49 6.772 -9.115 7.525
367 HG23 THR 49 HG23 THR 49 6.529 -10.822 7.152
368 H LYS 50 H LYS 50 6.116 -9.766 2.475
369 HA LYS 50 HA LYS 50 5.010 -8.784 0.675
370 HB2 LYS 50 HB2 LYS 50 2.678 -10.525 1.637
371 HB3 LYS 50 HB3 LYS 50 2.795 -9.749 0.045
372 HG2 LYS 50 HG2 LYS 50 4.884 -11.693 1.020
373 HG3 LYS 50 HG3 LYS 50 3.390 -12.235 0.216
374 HD2 LYS 50 HD2 LYS 50 4.000 -10.612 -1.661
375 HD3 LYS 50 HD3 LYS 50 5.603 -10.495 -0.893
376 HE2 LYS 50 HE2 LYS 50 6.188 -12.624 -1.474
377 HE3 LYS 50 HE3 LYS 50 4.517 -13.228 -1.384
378 HZ1 LYS 50 HZ1 LYS 50 4.054 -12.216 -3.481
379 HZ2 LYS 50 HZ2 LYS 50 5.424 -13.136 -3.657
380 HZ3 LYS 50 HZ3 LYS 50 5.544 -11.485 -3.545
381 H THR 51 H THR 51 5.050 -7.196 2.884
382 HA THR 51 HA THR 51 2.480 -5.805 2.746
383 HB THR 51 HB THR 51 4.489 -5.929 4.985
384 HG1 THR 51 HG1 THR 51 1.824 -6.885 4.749
385 HG21 THR 51 HG21 THR 51 3.349 -3.704 4.780
386 HG22 THR 51 HG22 THR 51 3.061 -4.563 6.293
387 HG23 THR 51 HG23 THR 51 1.818 -4.539 5.042
388 H PHE 52 H PHE 52 2.328 -3.797 2.095
389 HA PHE 52 HA PHE 52 4.995 -2.288 1.539
390 HB2 PHE 52 HB2 PHE 52 2.107 -2.043 0.448
391 HB3 PHE 52 HB3 PHE 52 3.371 -0.821 0.192
392 HD1 PHE 52 HD2 PHE 52 5.332 -1.344 -1.182
393 HD2 PHE 52 HD1 PHE 52 2.125 -4.110 -0.745
394 HE1 PHE 52 HE2 PHE 52 6.143 -2.589 -3.145
395 HE2 PHE 52 HE1 PHE 52 2.931 -5.359 -2.706
396 HZ PHE 52 HZ PHE 52 4.942 -4.599 -3.909
397 H THR 53 H THR 53 5.108 -0.339 2.795
398 HA THR 53 HA THR 53 2.824 0.447 4.505
399 HB THR 53 HB THR 53 5.782 0.608 5.228
400 HG1 THR 53 HG1 THR 53 5.336 -1.374 5.809
401 HG21 THR 53 HG21 THR 53 5.302 1.873 7.002
402 HG22 THR 53 HG22 THR 53 3.794 1.019 7.332
403 HG23 THR 53 HG23 THR 53 3.835 2.297 6.119
404 H VAL 54 H VAL 54 2.306 2.600 4.429
405 HA VAL 54 HA VAL 54 4.333 4.345 2.938
406 HB VAL 54 HB VAL 54 2.367 4.027 1.471
407 HG11 VAL 54 HG11 VAL 54 0.142 4.605 2.080
408 HG12 VAL 54 HG12 VAL 54 0.662 5.272 3.628
409 HG13 VAL 54 HG13 VAL 54 0.753 3.535 3.342
410 HG21 VAL 54 HG21 VAL 54 1.639 6.490 1.407
411 HG22 VAL 54 HG22 VAL 54 3.358 6.137 1.232
412 HG23 VAL 54 HG23 VAL 54 2.729 6.716 2.775
413 H THR 55 H THR 55 5.065 5.834 4.333
414 HA THR 55 HA THR 55 3.455 6.495 6.770
415 HB THR 55 HB THR 55 6.468 6.489 6.409
416 HG1 THR 55 HG1 THR 55 4.824 4.762 7.955
417 HG21 THR 55 HG21 THR 55 4.967 6.783 8.990
418 HG22 THR 55 HG22 THR 55 5.621 8.145 8.081
419 HG23 THR 55 HG23 THR 55 6.703 6.904 8.710
420 H GLU 56 H GLU 56 2.802 8.546 6.891
421 HA GLU 56 HA GLU 56 3.886 10.613 4.982
422 HB2 GLU 56 HB2 GLU 56 1.454 10.416 6.791
423 HB3 GLU 56 HB3 GLU 56 1.928 11.916 5.972
424 HG2 GLU 56 HG2 GLU 56 1.782 10.704 3.801
425 HG3 GLU 56 HG3 GLU 56 1.151 9.296 4.686
Start of MODEL 13
1 H1 MET 1 H1 MET 1 -1.060 -13.068 -5.568
2 H2 MET 1 H2 MET 1 -2.124 -14.314 -5.180
3 H3 MET 1 H3 MET 1 -0.502 -14.654 -5.475
4 HA MET 1 HA MET 1 -1.181 -14.666 -3.114
5 HB2 MET 1 HB2 MET 1 1.156 -14.252 -4.200
6 HB3 MET 1 HB3 MET 1 0.904 -12.569 -3.698
7 HG2 MET 1 HG2 MET 1 2.165 -13.597 -1.989
8 HG3 MET 1 HG3 MET 1 0.508 -13.440 -1.361
9 HE1 MET 1 HE1 MET 1 2.988 -17.033 -2.370
10 HE2 MET 1 HE2 MET 1 2.985 -15.469 -3.186
11 HE3 MET 1 HE3 MET 1 1.911 -16.754 -3.738
12 H GLN 2 H GLN 2 -1.591 -13.411 -1.235
13 HA GLN 2 HA GLN 2 -3.069 -10.911 -1.810
14 HB2 GLN 2 HB2 GLN 2 -2.951 -12.923 0.406
15 HB3 GLN 2 HB3 GLN 2 -3.273 -11.242 0.877
16 HG2 GLN 2 HG2 GLN 2 -5.291 -11.171 -0.270
17 HG3 GLN 2 HG3 GLN 2 -4.862 -12.545 -1.316
18 HE21 GLN 2 HE21 GLN 2 -7.292 -12.266 0.098
19 HE22 GLN 2 HE22 GLN 2 -7.361 -13.587 1.315
20 H TYR 3 H TYR 3 -2.359 -8.945 -1.287
21 HA TYR 3 HA TYR 3 0.143 -8.588 0.255
22 HB2 TYR 3 HB2 TYR 3 -0.824 -6.904 -2.051
23 HB3 TYR 3 HB3 TYR 3 0.579 -6.528 -1.025
24 HD1 TYR 3 HD1 TYR 3 -0.772 -9.201 -3.266
25 HD2 TYR 3 HD2 TYR 3 2.681 -7.329 -1.625
26 HE1 TYR 3 HE1 TYR 3 0.658 -10.560 -4.733
27 HE2 TYR 3 HE2 TYR 3 4.118 -8.684 -3.090
28 HH TYR 3 HH TYR 3 3.955 -9.914 -5.209
29 H LYS 4 H LYS 4 0.202 -6.809 1.731
30 HA LYS 4 HA LYS 4 -2.416 -5.612 2.301
31 HB2 LYS 4 HB2 LYS 4 -1.651 -7.201 4.021
32 HB3 LYS 4 HB3 LYS 4 -0.157 -6.260 4.207
33 HG2 LYS 4 HG2 LYS 4 -1.559 -4.302 4.886
34 HG3 LYS 4 HG3 LYS 4 -2.978 -5.378 4.865
35 HD2 LYS 4 HD2 LYS 4 -0.487 -5.889 6.516
36 HD3 LYS 4 HD3 LYS 4 -1.932 -5.049 7.131
37 HE2 LYS 4 HE2 LYS 4 -3.291 -6.995 6.796
38 HE3 LYS 4 HE3 LYS 4 -1.982 -7.827 5.924
39 HZ1 LYS 4 HZ1 LYS 4 -0.892 -8.274 7.854
40 HZ2 LYS 4 HZ2 LYS 4 -2.441 -8.278 8.445
41 HZ3 LYS 4 HZ3 LYS 4 -1.477 -6.947 8.663
42 H LEU 5 H LEU 5 -2.561 -3.456 2.830
43 HA LEU 5 HA LEU 5 0.035 -1.872 2.532
44 HB2 LEU 5 HB2 LEU 5 -1.418 -1.403 0.634
45 HB3 LEU 5 HB3 LEU 5 -2.816 -1.152 1.689
46 HG LEU 5 HG LEU 5 -1.556 0.813 2.703
47 HD11 LEU 5 HD11 LEU 5 0.685 0.319 2.050
48 HD12 LEU 5 HD12 LEU 5 0.197 1.784 1.199
49 HD13 LEU 5 HD13 LEU 5 0.240 0.242 0.346
50 HD21 LEU 5 HD21 LEU 5 -2.262 2.307 0.994
51 HD22 LEU 5 HD22 LEU 5 -3.376 0.940 0.966
52 HD23 LEU 5 HD23 LEU 5 -2.109 1.069 -0.252
53 H VAL 6 H VAL 6 0.425 -0.833 4.424
54 HA VAL 6 HA VAL 6 -1.689 -0.321 6.374
55 HB VAL 6 HB VAL 6 1.310 -0.389 6.830
56 HG11 VAL 6 HG11 VAL 6 0.912 0.131 9.082
57 HG12 VAL 6 HG12 VAL 6 -0.818 -0.187 8.950
58 HG13 VAL 6 HG13 VAL 6 -0.124 1.245 8.191
59 HG21 VAL 6 HG21 VAL 6 -0.879 -2.367 7.363
60 HG22 VAL 6 HG22 VAL 6 0.539 -2.307 8.411
61 HG23 VAL 6 HG23 VAL 6 0.729 -2.624 6.686
62 H ILE 7 H ILE 7 -2.336 1.728 6.609
63 HA ILE 7 HA ILE 7 -0.551 3.864 5.261
64 HB ILE 7 HB ILE 7 -3.537 3.983 5.930
65 HG12 ILE 7 HG12 ILE 7 -2.132 3.928 3.232
66 HG13 ILE 7 HG13 ILE 7 -2.914 2.520 3.982
67 HG21 ILE 7 HG21 ILE 7 -3.200 6.096 4.424
68 HG22 ILE 7 HG22 ILE 7 -1.528 5.984 4.974
69 HG23 ILE 7 HG23 ILE 7 -2.833 6.166 6.146
70 HD11 ILE 7 HD11 ILE 7 -4.342 3.567 2.311
71 HD12 ILE 7 HD12 ILE 7 -4.284 5.092 3.197
72 HD13 ILE 7 HD13 ILE 7 -5.057 3.681 3.919
73 H ASN 8 H ASN 8 0.635 4.871 6.749
74 HA ASN 8 HA ASN 8 -0.544 5.355 9.493
75 HB2 ASN 8 HB2 ASN 8 1.547 3.939 9.334
76 HB3 ASN 8 HB3 ASN 8 2.396 5.347 8.657
77 HD21 ASN 8 HD21 ASN 8 1.697 3.647 11.427
78 HD22 ASN 8 HD22 ASN 8 2.067 4.930 12.631
79 H GLY 9 H GLY 9 -1.756 7.135 8.423
80 HA2 GLY 9 HA2 GLY 9 -0.280 9.409 7.274
81 HA3 GLY 9 HA3 GLY 9 -1.974 9.129 7.249
82 H LYS 10 H LYS 10 -1.157 11.638 7.920
83 HA LYS 10 HA LYS 10 -0.897 12.035 10.799
84 HB2 LYS 10 HB2 LYS 10 -1.711 13.836 8.502
85 HB3 LYS 10 HB3 LYS 10 -1.446 14.382 10.171
86 HG2 LYS 10 HG2 LYS 10 0.722 12.856 8.774
87 HG3 LYS 10 HG3 LYS 10 0.454 14.569 8.371
88 HD2 LYS 10 HD2 LYS 10 0.828 13.548 11.201
89 HD3 LYS 10 HD3 LYS 10 2.163 14.133 10.177
90 HE2 LYS 10 HE2 LYS 10 1.420 16.078 10.020
91 HE3 LYS 10 HE3 LYS 10 -0.240 16.023 10.660
92 HZ1 LYS 10 HZ1 LYS 10 2.296 15.948 12.162
93 HZ2 LYS 10 HZ2 LYS 10 0.868 15.458 12.847
94 HZ3 LYS 10 HZ3 LYS 10 1.036 17.019 12.315
95 H THR 11 H THR 11 -3.445 12.020 8.538
96 HA THR 11 HA THR 11 -5.551 12.266 10.621
97 HB THR 11 HB THR 11 -7.031 13.201 8.944
98 HG1 THR 11 HG1 THR 11 -6.367 13.485 6.977
99 HG21 THR 11 HG21 THR 11 -4.530 14.723 9.642
100 HG22 THR 11 HG22 THR 11 -6.106 14.776 10.434
101 HG23 THR 11 HG23 THR 11 -5.907 15.452 8.817
102 H LEU 12 H LEU 12 -4.514 10.208 8.010
103 HA LEU 12 HA LEU 12 -6.880 8.555 8.637
104 HB2 LEU 12 HB2 LEU 12 -6.904 9.385 6.325
105 HB3 LEU 12 HB3 LEU 12 -5.284 8.717 6.071
106 HG LEU 12 HG LEU 12 -6.179 6.435 6.416
107 HD11 LEU 12 HD11 LEU 12 -8.049 7.043 7.895
108 HD12 LEU 12 HD12 LEU 12 -8.571 6.059 6.527
109 HD13 LEU 12 HD13 LEU 12 -8.876 7.796 6.530
110 HD21 LEU 12 HD21 LEU 12 -7.710 8.006 4.335
111 HD22 LEU 12 HD22 LEU 12 -7.363 6.277 4.310
112 HD23 LEU 12 HD23 LEU 12 -6.048 7.443 4.164
113 H LYS 13 H LYS 13 -6.505 6.674 9.641
114 HA LYS 13 HA LYS 13 -3.873 5.402 9.184
115 HB2 LYS 13 HB2 LYS 13 -5.415 5.483 11.772
116 HB3 LYS 13 HB3 LYS 13 -3.902 4.599 11.500
117 HG2 LYS 13 HG2 LYS 13 -2.955 6.930 10.834
118 HG3 LYS 13 HG3 LYS 13 -4.371 7.557 11.713
119 HD2 LYS 13 HD2 LYS 13 -3.691 6.434 13.733
120 HD3 LYS 13 HD3 LYS 13 -2.379 5.587 12.875
121 HE2 LYS 13 HE2 LYS 13 -2.546 8.602 13.063
122 HE3 LYS 13 HE3 LYS 13 -1.710 7.605 14.276
123 HZ1 LYS 13 HZ1 LYS 13 -0.244 6.809 12.581
124 HZ2 LYS 13 HZ2 LYS 13 -0.236 8.466 12.533
125 HZ3 LYS 13 HZ3 LYS 13 -1.073 7.610 11.385
126 H GLY 14 H GLY 14 -4.019 3.134 8.536
127 HA2 GLY 14 HA2 GLY 14 -5.861 1.373 9.547
128 HA3 GLY 14 HA3 GLY 14 -6.718 1.951 8.139
129 H GLU 15 H GLU 15 -6.667 -0.183 7.502
130 HA GLU 15 HA GLU 15 -4.187 -0.875 6.044
131 HB2 GLU 15 HB2 GLU 15 -5.706 -2.558 8.023
132 HB3 GLU 15 HB3 GLU 15 -4.672 -3.291 6.781
133 HG2 GLU 15 HG2 GLU 15 -3.144 -3.171 8.441
134 HG3 GLU 15 HG3 GLU 15 -2.923 -1.534 7.782
135 H THR 16 H THR 16 -4.486 -2.154 4.107
136 HA THR 16 HA THR 16 -7.202 -3.121 3.619
137 HB THR 16 HB THR 16 -6.984 -2.183 1.175
138 HG1 THR 16 HG1 THR 16 -5.179 -1.033 1.151
139 HG21 THR 16 HG21 THR 16 -8.738 -1.565 2.928
140 HG22 THR 16 HG22 THR 16 -8.435 -0.416 1.625
141 HG23 THR 16 HG23 THR 16 -7.754 -0.133 3.227
142 H THR 17 H THR 17 -7.150 -4.376 1.434
143 HA THR 17 HA THR 17 -4.519 -5.628 1.113
144 HB THR 17 HB THR 17 -5.466 -7.856 1.229
145 HG1 THR 17 HG1 THR 17 -7.877 -6.501 1.896
146 HG21 THR 17 HG21 THR 17 -5.537 -8.088 3.490
147 HG22 THR 17 HG22 THR 17 -6.539 -6.655 3.726
148 HG23 THR 17 HG23 THR 17 -4.818 -6.481 3.385
149 H THR 18 H THR 18 -4.323 -6.844 -0.842
150 HA THR 18 HA THR 18 -6.553 -6.629 -2.738
151 HB THR 18 HB THR 18 -5.094 -4.536 -3.124
152 HG1 THR 18 HG1 THR 18 -6.411 -5.119 -4.773
153 HG21 THR 18 HG21 THR 18 -3.248 -6.149 -4.753
154 HG22 THR 18 HG22 THR 18 -2.961 -6.180 -3.013
155 HG23 THR 18 HG23 THR 18 -2.982 -4.643 -3.877
156 H LYS 19 H LYS 19 -6.177 -8.032 -4.633
157 HA LYS 19 HA LYS 19 -4.243 -10.199 -3.998
158 HB2 LYS 19 HB2 LYS 19 -6.725 -10.223 -5.754
159 HB3 LYS 19 HB3 LYS 19 -5.650 -11.603 -5.462
160 HG2 LYS 19 HG2 LYS 19 -6.682 -10.380 -3.001
161 HG3 LYS 19 HG3 LYS 19 -7.954 -11.016 -4.073
162 HD2 LYS 19 HD2 LYS 19 -5.512 -12.597 -3.220
163 HD3 LYS 19 HD3 LYS 19 -7.076 -12.649 -2.368
164 HE2 LYS 19 HE2 LYS 19 -6.980 -13.146 -5.329
165 HE3 LYS 19 HE3 LYS 19 -6.487 -14.437 -4.206
166 HZ1 LYS 19 HZ1 LYS 19 -8.738 -13.813 -3.089
167 HZ2 LYS 19 HZ2 LYS 19 -8.709 -14.828 -4.401
168 HZ3 LYS 19 HZ3 LYS 19 -9.122 -13.234 -4.597
169 H ALA 20 H ALA 20 -2.533 -10.480 -5.444
170 HA ALA 20 HA ALA 20 -2.805 -9.487 -8.110
171 HB1 ALA 20 HB1 ALA 20 -0.589 -8.213 -7.925
172 HB2 ALA 20 HB2 ALA 20 -0.820 -8.285 -6.178
173 HB3 ALA 20 HB3 ALA 20 -1.993 -7.440 -7.190
174 H VAL 21 H VAL 21 -1.191 -10.238 -9.607
175 HA VAL 21 HA VAL 21 -0.023 -12.646 -8.835
176 HB VAL 21 HB VAL 21 0.973 -12.790 -11.040
177 HG11 VAL 21 HG11 VAL 21 -1.466 -13.268 -10.588
178 HG12 VAL 21 HG12 VAL 21 -1.064 -12.870 -12.259
179 HG13 VAL 21 HG13 VAL 21 -1.819 -11.660 -11.221
180 HG21 VAL 21 HG21 VAL 21 -0.159 -10.034 -11.528
181 HG22 VAL 21 HG22 VAL 21 0.866 -10.996 -12.593
182 HG23 VAL 21 HG23 VAL 21 1.529 -10.319 -11.104
183 H ASP 22 H ASP 22 1.399 -9.438 -8.755
184 HA ASP 22 HA ASP 22 3.754 -10.623 -7.563
185 HB2 ASP 22 HB2 ASP 22 5.356 -9.602 -9.159
186 HB3 ASP 22 HB3 ASP 22 4.327 -10.821 -9.943
187 H ALA 23 H ALA 23 5.351 -8.898 -6.822
188 HA ALA 23 HA ALA 23 3.801 -7.127 -5.231
189 HB1 ALA 23 HB1 ALA 23 5.810 -7.839 -4.286
190 HB2 ALA 23 HB2 ALA 23 6.085 -6.139 -4.666
191 HB3 ALA 23 HB3 ALA 23 6.746 -7.393 -5.714
192 H GLU 24 H GLU 24 5.646 -6.594 -8.252
193 HA GLU 24 HA GLU 24 5.528 -3.685 -8.041
194 HB2 GLU 24 HB2 GLU 24 6.964 -4.982 -9.617
195 HB3 GLU 24 HB3 GLU 24 5.531 -5.537 -10.504
196 HG2 GLU 24 HG2 GLU 24 5.027 -3.071 -10.922
197 HG3 GLU 24 HG3 GLU 24 6.678 -2.753 -10.339
198 H THR 25 H THR 25 3.214 -6.011 -9.536
199 HA THR 25 HA THR 25 1.529 -3.848 -10.628
200 HB THR 25 HB THR 25 0.798 -6.737 -9.909
201 HG1 THR 25 HG1 THR 25 1.901 -7.106 -11.648
202 HG21 THR 25 HG21 THR 25 -0.733 -4.607 -11.363
203 HG22 THR 25 HG22 THR 25 -1.272 -5.684 -10.076
204 HG23 THR 25 HG23 THR 25 -0.985 -6.321 -11.696
205 H ALA 26 H ALA 26 1.606 -5.640 -7.447
206 HA ALA 26 HA ALA 26 -0.792 -4.366 -6.369
207 HB1 ALA 26 HB1 ALA 26 0.505 -6.298 -5.330
208 HB2 ALA 26 HB2 ALA 26 -0.020 -5.037 -4.216
209 HB3 ALA 26 HB3 ALA 26 1.659 -5.095 -4.753
210 H GLU 27 H GLU 27 2.605 -3.229 -6.776
211 HA GLU 27 HA GLU 27 2.253 -0.945 -5.203
212 HB2 GLU 27 HB2 GLU 27 4.444 -1.775 -5.973
213 HB3 GLU 27 HB3 GLU 27 4.065 -1.204 -7.610
214 HG2 GLU 27 HG2 GLU 27 3.762 1.104 -6.567
215 HG3 GLU 27 HG3 GLU 27 4.529 0.425 -5.114
216 H LYS 28 H LYS 28 1.728 -1.284 -8.715
217 HA LYS 28 HA LYS 28 1.012 1.475 -9.141
218 HB2 LYS 28 HB2 LYS 28 -0.041 -0.940 -10.628
219 HB3 LYS 28 HB3 LYS 28 -0.027 0.741 -11.194
220 HG2 LYS 28 HG2 LYS 28 2.386 0.744 -11.284
221 HG3 LYS 28 HG3 LYS 28 2.449 -0.887 -10.570
222 HD2 LYS 28 HD2 LYS 28 1.658 -1.905 -12.503
223 HD3 LYS 28 HD3 LYS 28 0.898 -0.409 -13.103
224 HE2 LYS 28 HE2 LYS 28 3.008 0.523 -13.703
225 HE3 LYS 28 HE3 LYS 28 3.893 -0.747 -12.826
226 HZ1 LYS 28 HZ1 LYS 28 3.025 -2.348 -14.431
227 HZ2 LYS 28 HZ2 LYS 28 3.916 -1.167 -15.182
228 HZ3 LYS 28 HZ3 LYS 28 2.260 -1.132 -15.265
229 H ALA 29 H ALA 29 -1.021 -1.354 -8.136
230 HA ALA 29 HA ALA 29 -3.498 0.222 -8.307
231 HB1 ALA 29 HB1 ALA 29 -4.516 -1.588 -7.054
232 HB2 ALA 29 HB2 ALA 29 -2.944 -2.197 -6.536
233 HB3 ALA 29 HB3 ALA 29 -3.412 -2.297 -8.234
234 H PHE 30 H PHE 30 -1.237 -0.556 -5.532
235 HA PHE 30 HA PHE 30 -2.862 0.855 -3.615
236 HB2 PHE 30 HB2 PHE 30 0.060 0.015 -3.683
237 HB3 PHE 30 HB3 PHE 30 -0.680 0.819 -2.283
238 HD1 PHE 30 HD1 PHE 30 -3.263 -0.431 -2.028
239 HD2 PHE 30 HD2 PHE 30 0.462 -2.175 -3.125
240 HE1 PHE 30 HE1 PHE 30 -4.041 -2.610 -1.189
241 HE2 PHE 30 HE2 PHE 30 -0.310 -4.355 -2.290
242 HZ PHE 30 HZ PHE 30 -2.563 -4.575 -1.318
243 H LYS 31 H LYS 31 -0.189 1.987 -5.774
244 HA LYS 31 HA LYS 31 -0.121 4.615 -4.462
245 HB2 LYS 31 HB2 LYS 31 0.594 3.711 -7.269
246 HB3 LYS 31 HB3 LYS 31 0.736 5.398 -6.737
247 HG2 LYS 31 HG2 LYS 31 2.105 4.269 -4.754
248 HG3 LYS 31 HG3 LYS 31 2.355 3.008 -5.987
249 HD2 LYS 31 HD2 LYS 31 3.122 4.816 -7.556
250 HD3 LYS 31 HD3 LYS 31 3.050 5.953 -6.187
251 HE2 LYS 31 HE2 LYS 31 4.850 4.996 -5.119
252 HE3 LYS 31 HE3 LYS 31 4.577 3.400 -5.856
253 HZ1 LYS 31 HZ1 LYS 31 5.561 5.758 -7.347
254 HZ2 LYS 31 HZ2 LYS 31 5.465 4.197 -7.899
255 HZ3 LYS 31 HZ3 LYS 31 6.550 4.588 -6.706
256 H GLN 32 H GLN 32 -2.270 3.259 -6.939
257 HA GLN 32 HA GLN 32 -3.568 5.802 -7.441
258 HB2 GLN 32 HB2 GLN 32 -3.784 3.999 -9.056
259 HB3 GLN 32 HB3 GLN 32 -4.506 2.933 -7.835
260 HG2 GLN 32 HG2 GLN 32 -6.501 4.237 -7.758
261 HG3 GLN 32 HG3 GLN 32 -5.766 5.527 -8.738
262 HE21 GLN 32 HE21 GLN 32 -6.135 5.528 -10.837
263 HE22 GLN 32 HE22 GLN 32 -6.748 4.125 -11.779
264 H TYR 33 H TYR 33 -4.356 3.117 -5.231
265 HA TYR 33 HA TYR 33 -6.773 4.279 -4.187
266 HB2 TYR 33 HB2 TYR 33 -6.026 1.920 -3.773
267 HB3 TYR 33 HB3 TYR 33 -4.652 2.536 -2.830
268 HD1 TYR 33 HD2 TYR 33 -5.156 3.826 -0.695
269 HD2 TYR 33 HD1 TYR 33 -8.107 1.557 -2.756
270 HE1 TYR 33 HE2 TYR 33 -6.535 3.779 1.341
271 HE2 TYR 33 HE1 TYR 33 -9.494 1.506 -0.726
272 HH TYR 33 HH TYR 33 -8.649 1.841 2.091
273 H ALA 34 H ALA 34 -3.406 4.637 -3.017
274 HA ALA 34 HA ALA 34 -3.970 6.403 -0.879
275 HB1 ALA 34 HB1 ALA 34 -1.740 5.236 -1.562
276 HB2 ALA 34 HB2 ALA 34 -1.695 6.806 -0.760
277 HB3 ALA 34 HB3 ALA 34 -1.485 6.702 -2.508
278 H ASN 35 H ASN 35 -3.265 7.144 -4.297
279 HA ASN 35 HA ASN 35 -3.401 10.030 -3.844
280 HB2 ASN 35 HB2 ASN 35 -2.433 8.928 -5.894
281 HB3 ASN 35 HB3 ASN 35 -4.070 8.442 -6.387
282 HD21 ASN 35 HD21 ASN 35 -3.487 9.619 -8.343
283 HD22 ASN 35 HD22 ASN 35 -3.756 11.396 -8.374
284 H ASP 36 H ASP 36 -6.000 7.657 -4.776
285 HA ASP 36 HA ASP 36 -8.005 9.696 -5.125
286 HB2 ASP 36 HB2 ASP 36 -8.265 6.765 -4.434
287 HB3 ASP 36 HB3 ASP 36 -9.659 7.834 -4.698
288 H ASN 37 H ASN 37 -6.635 8.362 -2.204
289 HA ASN 37 HA ASN 37 -8.823 9.711 -0.652
290 HB2 ASN 37 HB2 ASN 37 -6.853 7.528 0.042
291 HB3 ASN 37 HB3 ASN 37 -7.758 8.412 1.290
292 HD21 ASN 37 HD21 ASN 37 -7.930 6.183 -1.401
293 HD22 ASN 37 HD22 ASN 37 -9.600 5.608 -1.063
294 H GLY 38 H GLY 38 -5.943 10.734 -1.796
295 HA2 GLY 38 HA2 GLY 38 -4.949 12.745 -1.207
296 HA3 GLY 38 HA3 GLY 38 -5.929 12.807 0.242
297 H VAL 39 H VAL 39 -3.843 10.067 -0.241
298 HA VAL 39 HA VAL 39 -2.151 11.057 2.045
299 HB VAL 39 HB VAL 39 -2.631 8.236 1.096
300 HG11 VAL 39 HG11 VAL 39 -1.342 8.887 3.694
301 HG12 VAL 39 HG12 VAL 39 -0.368 9.080 2.238
302 HG13 VAL 39 HG13 VAL 39 -1.091 7.516 2.614
303 HG21 VAL 39 HG21 VAL 39 -3.981 7.944 3.011
304 HG22 VAL 39 HG22 VAL 39 -4.523 9.463 2.294
305 HG23 VAL 39 HG23 VAL 39 -3.472 9.481 3.709
306 H ASP 40 H ASP 40 -0.164 11.454 1.839
307 HA ASP 40 HA ASP 40 1.275 10.370 -0.526
308 HB2 ASP 40 HB2 ASP 40 0.398 12.552 -1.144
309 HB3 ASP 40 HB3 ASP 40 1.087 13.278 0.324
310 H GLY 41 H GLY 41 3.057 9.723 -0.289
311 HA2 GLY 41 HA2 GLY 41 4.987 10.772 1.716
312 HA3 GLY 41 HA3 GLY 41 4.131 9.336 2.225
313 H VAL 42 H VAL 42 6.056 8.530 2.724
314 HA VAL 42 HA VAL 42 7.766 7.796 0.462
315 HB VAL 42 HB VAL 42 8.224 7.702 3.441
316 HG11 VAL 42 HG11 VAL 42 9.234 5.746 2.249
317 HG12 VAL 42 HG12 VAL 42 10.397 6.799 3.057
318 HG13 VAL 42 HG13 VAL 42 10.195 6.886 1.308
319 HG21 VAL 42 HG21 VAL 42 10.229 9.172 2.564
320 HG22 VAL 42 HG22 VAL 42 8.639 9.874 2.865
321 HG23 VAL 42 HG23 VAL 42 9.129 9.471 1.221
322 H TRP 43 H TRP 43 8.042 5.696 -0.237
323 HA TRP 43 HA TRP 43 6.150 3.655 1.044
324 HB2 TRP 43 HB2 TRP 43 7.436 3.983 -1.703
325 HB3 TRP 43 HB3 TRP 43 6.577 2.507 -1.208
326 HD1 TRP 43 HD1 TRP 43 5.934 6.244 -1.916
327 HE1 TRP 43 HE1 TRP 43 3.417 6.587 -2.447
328 HE3 TRP 43 HE3 TRP 43 4.307 1.509 -0.887
329 HZ2 TRP 43 HZ2 TRP 43 1.078 4.992 -2.409
330 HZ3 TRP 43 HZ3 TRP 43 1.918 0.997 -1.159
331 HH2 TRP 43 HH2 TRP 43 0.337 2.704 -1.902
332 H THR 44 H THR 44 6.801 1.769 1.857
333 HA THR 44 HA THR 44 9.551 0.866 1.185
334 HB THR 44 HB THR 44 9.664 -0.142 3.545
335 HG1 THR 44 HG1 THR 44 7.539 1.705 3.895
336 HG21 THR 44 HG21 THR 44 10.946 1.885 2.837
337 HG22 THR 44 HG22 THR 44 10.580 1.792 4.560
338 HG23 THR 44 HG23 THR 44 9.648 2.868 3.518
339 H TYR 45 H TYR 45 9.764 -1.455 1.257
340 HA TYR 45 HA TYR 45 7.308 -2.987 1.392
341 HB2 TYR 45 HB2 TYR 45 7.673 -2.550 -0.962
342 HB3 TYR 45 HB3 TYR 45 9.346 -3.128 -0.815
343 HD1 TYR 45 HD1 TYR 45 6.138 -4.591 0.443
344 HD2 TYR 45 HD2 TYR 45 9.500 -5.033 -2.126
345 HE1 TYR 45 HE1 TYR 45 5.397 -6.865 -0.128
346 HE2 TYR 45 HE2 TYR 45 8.769 -7.309 -2.705
347 HH TYR 45 HH TYR 45 7.351 -9.112 -1.639
348 H ASP 46 H ASP 46 7.375 -4.866 2.454
349 HA ASP 46 HA ASP 46 10.059 -5.946 3.064
350 HB2 ASP 46 HB2 ASP 46 8.866 -5.220 5.112
351 HB3 ASP 46 HB3 ASP 46 7.471 -6.219 4.651
352 H ASP 47 H ASP 47 10.445 -7.548 1.671
353 HA ASP 47 HA ASP 47 8.335 -8.921 0.258
354 HB2 ASP 47 HB2 ASP 47 10.704 -8.632 -0.545
355 HB3 ASP 47 HB3 ASP 47 11.205 -9.849 0.650
356 H ALA 48 H ALA 48 9.933 -9.702 3.381
357 HA ALA 48 HA ALA 48 9.159 -12.540 3.273
358 HB1 ALA 48 HB1 ALA 48 9.708 -10.638 5.607
359 HB2 ALA 48 HB2 ALA 48 10.874 -11.704 4.822
360 HB3 ALA 48 HB3 ALA 48 9.545 -12.386 5.760
361 H THR 49 H THR 49 7.451 -9.629 4.375
362 HA THR 49 HA THR 49 5.113 -11.461 5.157
363 HB THR 49 HB THR 49 4.169 -9.516 6.397
364 HG1 THR 49 HG1 THR 49 6.492 -8.114 5.539
365 HG21 THR 49 HG21 THR 49 5.385 -9.970 8.185
366 HG22 THR 49 HG22 THR 49 6.774 -9.111 7.522
367 HG23 THR 49 HG23 THR 49 6.535 -10.818 7.150
368 H LYS 50 H LYS 50 6.116 -9.766 2.475
369 HA LYS 50 HA LYS 50 5.010 -8.784 0.675
370 HB2 LYS 50 HB2 LYS 50 2.677 -10.524 1.636
371 HB3 LYS 50 HB3 LYS 50 2.796 -9.750 0.044
372 HG2 LYS 50 HG2 LYS 50 4.883 -11.694 1.023
373 HG3 LYS 50 HG3 LYS 50 3.390 -12.235 0.218
374 HD2 LYS 50 HD2 LYS 50 4.002 -10.615 -1.660
375 HD3 LYS 50 HD3 LYS 50 5.605 -10.498 -0.890
376 HE2 LYS 50 HE2 LYS 50 6.189 -12.628 -1.468
377 HE3 LYS 50 HE3 LYS 50 4.517 -13.231 -1.380
378 HZ1 LYS 50 HZ1 LYS 50 4.058 -12.220 -3.478
379 HZ2 LYS 50 HZ2 LYS 50 5.427 -13.141 -3.651
380 HZ3 LYS 50 HZ3 LYS 50 5.548 -11.490 -3.541
381 H THR 51 H THR 51 5.050 -7.196 2.884
382 HA THR 51 HA THR 51 2.480 -5.805 2.746
383 HB THR 51 HB THR 51 4.489 -5.928 4.985
384 HG1 THR 51 HG1 THR 51 1.825 -6.887 4.749
385 HG21 THR 51 HG21 THR 51 3.347 -3.704 4.780
386 HG22 THR 51 HG22 THR 51 3.059 -4.563 6.293
387 HG23 THR 51 HG23 THR 51 1.817 -4.541 5.041
388 H PHE 52 H PHE 52 2.328 -3.797 2.095
389 HA PHE 52 HA PHE 52 4.995 -2.288 1.539
390 HB2 PHE 52 HB2 PHE 52 2.107 -2.042 0.449
391 HB3 PHE 52 HB3 PHE 52 3.373 -0.821 0.191
392 HD1 PHE 52 HD2 PHE 52 5.332 -1.348 -1.184
393 HD2 PHE 52 HD1 PHE 52 2.122 -4.109 -0.744
394 HE1 PHE 52 HE2 PHE 52 6.141 -2.595 -3.145
395 HE2 PHE 52 HE1 PHE 52 2.925 -5.361 -2.704
396 HZ PHE 52 HZ PHE 52 4.937 -4.604 -3.908
397 H THR 53 H THR 53 5.108 -0.339 2.795
398 HA THR 53 HA THR 53 2.824 0.447 4.505
399 HB THR 53 HB THR 53 5.782 0.607 5.228
400 HG1 THR 53 HG1 THR 53 5.334 -1.374 5.811
401 HG21 THR 53 HG21 THR 53 5.304 1.873 7.001
402 HG22 THR 53 HG22 THR 53 3.795 1.022 7.332
403 HG23 THR 53 HG23 THR 53 3.838 2.299 6.117
404 H VAL 54 H VAL 54 2.306 2.600 4.429
405 HA VAL 54 HA VAL 54 4.333 4.345 2.938
406 HB VAL 54 HB VAL 54 2.365 4.026 1.472
407 HG11 VAL 54 HG11 VAL 54 0.142 4.608 2.082
408 HG12 VAL 54 HG12 VAL 54 0.664 5.278 3.628
409 HG13 VAL 54 HG13 VAL 54 0.752 3.540 3.346
410 HG21 VAL 54 HG21 VAL 54 1.642 6.489 1.404
411 HG22 VAL 54 HG22 VAL 54 3.360 6.133 1.228
412 HG23 VAL 54 HG23 VAL 54 2.733 6.716 2.771
413 H THR 55 H THR 55 5.065 5.834 4.333
414 HA THR 55 HA THR 55 3.455 6.495 6.770
415 HB THR 55 HB THR 55 6.468 6.486 6.408
416 HG1 THR 55 HG1 THR 55 4.822 4.766 7.960
417 HG21 THR 55 HG21 THR 55 4.970 6.789 8.989
418 HG22 THR 55 HG22 THR 55 5.626 8.148 8.076
419 HG23 THR 55 HG23 THR 55 6.706 6.907 8.708
420 H GLU 56 H GLU 56 2.802 8.546 6.891
421 HA GLU 56 HA GLU 56 3.886 10.613 4.982
422 HB2 GLU 56 HB2 GLU 56 1.432 10.214 5.202
423 HB3 GLU 56 HB3 GLU 56 1.534 10.677 6.911
424 HG2 GLU 56 HG2 GLU 56 2.579 12.874 5.976
425 HG3 GLU 56 HG3 GLU 56 1.808 12.367 4.455
Start of MODEL 14
1 H1 MET 1 H1 MET 1 -1.060 -13.068 -5.568
2 H2 MET 1 H2 MET 1 -2.124 -14.314 -5.180
3 H3 MET 1 H3 MET 1 -0.502 -14.654 -5.475
4 HA MET 1 HA MET 1 -1.181 -14.666 -3.114
5 HB2 MET 1 HB2 MET 1 0.946 -12.668 -3.954
6 HB3 MET 1 HB3 MET 1 0.868 -13.560 -2.422
7 HG2 MET 1 HG2 MET 1 0.886 -15.653 -4.044
8 HG3 MET 1 HG3 MET 1 1.658 -14.490 -5.146
9 HE1 MET 1 HE1 MET 1 3.248 -16.831 -1.775
10 HE2 MET 1 HE2 MET 1 1.559 -16.458 -2.119
11 HE3 MET 1 HE3 MET 1 2.473 -15.452 -0.996
12 H GLN 2 H GLN 2 -1.591 -13.411 -1.235
13 HA GLN 2 HA GLN 2 -3.069 -10.911 -1.810
14 HB2 GLN 2 HB2 GLN 2 -2.950 -12.922 0.407
15 HB3 GLN 2 HB3 GLN 2 -3.274 -11.241 0.877
16 HG2 GLN 2 HG2 GLN 2 -5.291 -11.172 -0.271
17 HG3 GLN 2 HG3 GLN 2 -4.861 -12.547 -1.316
18 HE21 GLN 2 HE21 GLN 2 -7.291 -12.270 0.097
19 HE22 GLN 2 HE22 GLN 2 -7.360 -13.590 1.315
20 H TYR 3 H TYR 3 -2.359 -8.945 -1.287
21 HA TYR 3 HA TYR 3 0.143 -8.588 0.255
22 HB2 TYR 3 HB2 TYR 3 -0.824 -6.902 -2.050
23 HB3 TYR 3 HB3 TYR 3 0.581 -6.529 -1.025
24 HD1 TYR 3 HD1 TYR 3 -0.778 -9.198 -3.267
25 HD2 TYR 3 HD2 TYR 3 2.680 -7.333 -1.628
26 HE1 TYR 3 HE1 TYR 3 0.649 -10.558 -4.736
27 HE2 TYR 3 HE2 TYR 3 4.114 -8.689 -3.096
28 HH TYR 3 HH TYR 3 3.946 -9.917 -5.215
29 H LYS 4 H LYS 4 0.202 -6.809 1.731
30 HA LYS 4 HA LYS 4 -2.416 -5.612 2.301
31 HB2 LYS 4 HB2 LYS 4 -1.650 -7.201 4.021
32 HB3 LYS 4 HB3 LYS 4 -0.157 -6.259 4.207
33 HG2 LYS 4 HG2 LYS 4 -1.560 -4.302 4.886
34 HG3 LYS 4 HG3 LYS 4 -2.978 -5.379 4.864
35 HD2 LYS 4 HD2 LYS 4 -0.487 -5.889 6.516
36 HD3 LYS 4 HD3 LYS 4 -1.933 -5.049 7.131
37 HE2 LYS 4 HE2 LYS 4 -3.291 -6.996 6.796
38 HE3 LYS 4 HE3 LYS 4 -1.982 -7.827 5.924
39 HZ1 LYS 4 HZ1 LYS 4 -0.891 -8.274 7.854
40 HZ2 LYS 4 HZ2 LYS 4 -2.441 -8.279 8.445
41 HZ3 LYS 4 HZ3 LYS 4 -1.477 -6.947 8.663
42 H LEU 5 H LEU 5 -2.561 -3.456 2.830
43 HA LEU 5 HA LEU 5 0.035 -1.872 2.532
44 HB2 LEU 5 HB2 LEU 5 -1.419 -1.404 0.634
45 HB3 LEU 5 HB3 LEU 5 -2.816 -1.151 1.690
46 HG LEU 5 HG LEU 5 -1.553 0.813 2.701
47 HD11 LEU 5 HD11 LEU 5 0.687 0.317 2.047
48 HD12 LEU 5 HD12 LEU 5 0.200 1.782 1.195
49 HD13 LEU 5 HD13 LEU 5 0.240 0.239 0.343
50 HD21 LEU 5 HD21 LEU 5 -2.259 2.307 0.992
51 HD22 LEU 5 HD22 LEU 5 -3.375 0.942 0.966
52 HD23 LEU 5 HD23 LEU 5 -2.109 1.068 -0.254
53 H VAL 6 H VAL 6 0.425 -0.833 4.424
54 HA VAL 6 HA VAL 6 -1.689 -0.321 6.374
55 HB VAL 6 HB VAL 6 1.310 -0.389 6.830
56 HG11 VAL 6 HG11 VAL 6 0.912 0.131 9.082
57 HG12 VAL 6 HG12 VAL 6 -0.818 -0.186 8.950
58 HG13 VAL 6 HG13 VAL 6 -0.124 1.246 8.190
59 HG21 VAL 6 HG21 VAL 6 -0.879 -2.366 7.364
60 HG22 VAL 6 HG22 VAL 6 0.539 -2.307 8.411
61 HG23 VAL 6 HG23 VAL 6 0.729 -2.624 6.686
62 H ILE 7 H ILE 7 -2.336 1.728 6.609
63 HA ILE 7 HA ILE 7 -0.551 3.864 5.261
64 HB ILE 7 HB ILE 7 -3.537 3.982 5.929
65 HG12 ILE 7 HG12 ILE 7 -2.131 3.930 3.232
66 HG13 ILE 7 HG13 ILE 7 -2.913 2.521 3.980
67 HG21 ILE 7 HG21 ILE 7 -3.201 6.096 4.425
68 HG22 ILE 7 HG22 ILE 7 -1.529 5.985 4.976
69 HG23 ILE 7 HG23 ILE 7 -2.835 6.165 6.148
70 HD11 ILE 7 HD11 ILE 7 -4.341 3.569 2.310
71 HD12 ILE 7 HD12 ILE 7 -4.283 5.093 3.197
72 HD13 ILE 7 HD13 ILE 7 -5.057 3.681 3.918
73 H ASN 8 H ASN 8 0.635 4.871 6.749
74 HA ASN 8 HA ASN 8 -0.544 5.355 9.493
75 HB2 ASN 8 HB2 ASN 8 1.546 3.939 9.336
76 HB3 ASN 8 HB3 ASN 8 2.396 5.345 8.656
77 HD21 ASN 8 HD21 ASN 8 2.595 3.715 11.221
78 HD22 ASN 8 HD22 ASN 8 2.609 4.974 12.506
79 H GLY 9 H GLY 9 -1.756 7.135 8.423
80 HA2 GLY 9 HA2 GLY 9 -0.280 9.409 7.274
81 HA3 GLY 9 HA3 GLY 9 -1.974 9.129 7.249
82 H LYS 10 H LYS 10 -1.157 11.638 7.920
83 HA LYS 10 HA LYS 10 -0.897 12.035 10.799
84 HB2 LYS 10 HB2 LYS 10 -1.706 13.834 8.499
85 HB3 LYS 10 HB3 LYS 10 -1.452 14.383 10.168
86 HG2 LYS 10 HG2 LYS 10 0.820 14.159 10.048
87 HG3 LYS 10 HG3 LYS 10 0.739 12.839 8.857
88 HD2 LYS 10 HD2 LYS 10 1.604 14.682 7.668
89 HD3 LYS 10 HD3 LYS 10 -0.115 14.600 7.209
90 HE2 LYS 10 HE2 LYS 10 -0.676 16.408 8.658
91 HE3 LYS 10 HE3 LYS 10 0.924 16.368 9.436
92 HZ1 LYS 10 HZ1 LYS 10 0.239 17.299 6.724
93 HZ2 LYS 10 HZ2 LYS 10 1.798 16.920 7.142
94 HZ3 LYS 10 HZ3 LYS 10 1.000 18.134 7.941
95 H THR 11 H THR 11 -3.445 12.020 8.538
96 HA THR 11 HA THR 11 -5.551 12.266 10.621
97 HB THR 11 HB THR 11 -7.031 13.202 8.945
98 HG1 THR 11 HG1 THR 11 -6.369 13.484 6.977
99 HG21 THR 11 HG21 THR 11 -4.529 14.722 9.640
100 HG22 THR 11 HG22 THR 11 -6.103 14.777 10.433
101 HG23 THR 11 HG23 THR 11 -5.906 15.452 8.816
102 H LEU 12 H LEU 12 -4.514 10.208 8.010
103 HA LEU 12 HA LEU 12 -6.880 8.555 8.637
104 HB2 LEU 12 HB2 LEU 12 -6.906 9.383 6.326
105 HB3 LEU 12 HB3 LEU 12 -5.285 8.721 6.071
106 HG LEU 12 HG LEU 12 -6.173 6.436 6.415
107 HD11 LEU 12 HD11 LEU 12 -8.045 7.037 7.894
108 HD12 LEU 12 HD12 LEU 12 -8.564 6.052 6.526
109 HD13 LEU 12 HD13 LEU 12 -8.874 7.788 6.530
110 HD21 LEU 12 HD21 LEU 12 -7.709 8.003 4.335
111 HD22 LEU 12 HD22 LEU 12 -7.357 6.275 4.309
112 HD23 LEU 12 HD23 LEU 12 -6.045 7.445 4.163
113 H LYS 13 H LYS 13 -6.505 6.674 9.641
114 HA LYS 13 HA LYS 13 -3.873 5.402 9.184
115 HB2 LYS 13 HB2 LYS 13 -3.878 4.611 11.493
116 HB3 LYS 13 HB3 LYS 13 -3.901 6.383 11.411
117 HG2 LYS 13 HG2 LYS 13 -6.481 6.105 11.616
118 HG3 LYS 13 HG3 LYS 13 -6.077 4.482 12.226
119 HD2 LYS 13 HD2 LYS 13 -4.749 5.414 14.006
120 HD3 LYS 13 HD3 LYS 13 -4.917 7.055 13.334
121 HE2 LYS 13 HE2 LYS 13 -7.282 5.388 14.219
122 HE3 LYS 13 HE3 LYS 13 -6.404 6.477 15.318
123 HZ1 LYS 13 HZ1 LYS 13 -6.969 8.314 13.918
124 HZ2 LYS 13 HZ2 LYS 13 -8.365 7.500 14.288
125 HZ3 LYS 13 HZ3 LYS 13 -7.682 7.327 12.787
126 H GLY 14 H GLY 14 -4.019 3.134 8.536
127 HA2 GLY 14 HA2 GLY 14 -5.861 1.373 9.547
128 HA3 GLY 14 HA3 GLY 14 -6.718 1.951 8.139
129 H GLU 15 H GLU 15 -6.667 -0.183 7.502
130 HA GLU 15 HA GLU 15 -4.187 -0.875 6.044
131 HB2 GLU 15 HB2 GLU 15 -4.736 -3.304 6.787
132 HB3 GLU 15 HB3 GLU 15 -3.899 -2.221 7.918
133 HG2 GLU 15 HG2 GLU 15 -6.141 -1.688 8.920
134 HG3 GLU 15 HG3 GLU 15 -6.826 -2.977 7.903
135 H THR 16 H THR 16 -4.486 -2.154 4.107
136 HA THR 16 HA THR 16 -7.202 -3.121 3.619
137 HB THR 16 HB THR 16 -7.277 -0.835 2.610
138 HG1 THR 16 HG1 THR 16 -8.573 -2.130 1.503
139 HG21 THR 16 HG21 THR 16 -4.801 -0.846 1.981
140 HG22 THR 16 HG22 THR 16 -5.943 -0.174 0.818
141 HG23 THR 16 HG23 THR 16 -5.290 -1.794 0.577
142 H THR 17 H THR 17 -7.150 -4.376 1.434
143 HA THR 17 HA THR 17 -4.519 -5.628 1.113
144 HB THR 17 HB THR 17 -5.466 -7.856 1.229
145 HG1 THR 17 HG1 THR 17 -7.877 -6.501 1.896
146 HG21 THR 17 HG21 THR 17 -5.537 -8.088 3.490
147 HG22 THR 17 HG22 THR 17 -6.539 -6.655 3.726
148 HG23 THR 17 HG23 THR 17 -4.818 -6.481 3.385
149 H THR 18 H THR 18 -4.323 -6.844 -0.842
150 HA THR 18 HA THR 18 -6.553 -6.629 -2.738
151 HB THR 18 HB THR 18 -5.093 -4.536 -3.124
152 HG1 THR 18 HG1 THR 18 -6.411 -5.118 -4.773
153 HG21 THR 18 HG21 THR 18 -3.248 -6.149 -4.754
154 HG22 THR 18 HG22 THR 18 -2.961 -6.180 -3.013
155 HG23 THR 18 HG23 THR 18 -2.982 -4.643 -3.877
156 H LYS 19 H LYS 19 -6.177 -8.032 -4.633
157 HA LYS 19 HA LYS 19 -4.243 -10.199 -3.998
158 HB2 LYS 19 HB2 LYS 19 -6.725 -10.223 -5.753
159 HB3 LYS 19 HB3 LYS 19 -5.651 -11.603 -5.463
160 HG2 LYS 19 HG2 LYS 19 -6.682 -10.381 -3.001
161 HG3 LYS 19 HG3 LYS 19 -7.954 -11.017 -4.072
162 HD2 LYS 19 HD2 LYS 19 -5.511 -12.598 -3.221
163 HD3 LYS 19 HD3 LYS 19 -7.074 -12.651 -2.369
164 HE2 LYS 19 HE2 LYS 19 -6.979 -13.146 -5.330
165 HE3 LYS 19 HE3 LYS 19 -6.486 -14.437 -4.208
166 HZ1 LYS 19 HZ1 LYS 19 -8.737 -13.815 -3.089
167 HZ2 LYS 19 HZ2 LYS 19 -8.709 -14.829 -4.402
168 HZ3 LYS 19 HZ3 LYS 19 -9.122 -13.234 -4.597
169 H ALA 20 H ALA 20 -2.533 -10.480 -5.444
170 HA ALA 20 HA ALA 20 -2.805 -9.487 -8.110
171 HB1 ALA 20 HB1 ALA 20 -0.589 -8.213 -7.925
172 HB2 ALA 20 HB2 ALA 20 -0.820 -8.285 -6.178
173 HB3 ALA 20 HB3 ALA 20 -1.993 -7.440 -7.190
174 H VAL 21 H VAL 21 -1.191 -10.238 -9.607
175 HA VAL 21 HA VAL 21 -0.023 -12.646 -8.835
176 HB VAL 21 HB VAL 21 0.969 -12.794 -11.039
177 HG11 VAL 21 HG11 VAL 21 -1.472 -13.260 -10.590
178 HG12 VAL 21 HG12 VAL 21 -1.067 -12.863 -12.259
179 HG13 VAL 21 HG13 VAL 21 -1.817 -11.650 -11.223
180 HG21 VAL 21 HG21 VAL 21 -0.150 -10.032 -11.528
181 HG22 VAL 21 HG22 VAL 21 0.873 -10.999 -12.593
182 HG23 VAL 21 HG23 VAL 21 1.537 -10.325 -11.104
183 H ASP 22 H ASP 22 1.399 -9.438 -8.755
184 HA ASP 22 HA ASP 22 3.754 -10.623 -7.563
185 HB2 ASP 22 HB2 ASP 22 5.356 -9.605 -9.159
186 HB3 ASP 22 HB3 ASP 22 4.325 -10.821 -9.944
187 H ALA 23 H ALA 23 5.351 -8.898 -6.822
188 HA ALA 23 HA ALA 23 3.801 -7.127 -5.231
189 HB1 ALA 23 HB1 ALA 23 5.810 -7.839 -4.286
190 HB2 ALA 23 HB2 ALA 23 6.085 -6.139 -4.666
191 HB3 ALA 23 HB3 ALA 23 6.746 -7.393 -5.714
192 H GLU 24 H GLU 24 5.646 -6.594 -8.252
193 HA GLU 24 HA GLU 24 5.528 -3.685 -8.041
194 HB2 GLU 24 HB2 GLU 24 6.964 -4.983 -9.617
195 HB3 GLU 24 HB3 GLU 24 5.530 -5.536 -10.505
196 HG2 GLU 24 HG2 GLU 24 5.029 -3.069 -10.921
197 HG3 GLU 24 HG3 GLU 24 6.681 -2.754 -10.338
198 H THR 25 H THR 25 3.214 -6.011 -9.536
199 HA THR 25 HA THR 25 1.529 -3.848 -10.628
200 HB THR 25 HB THR 25 0.799 -6.738 -9.909
201 HG1 THR 25 HG1 THR 25 1.901 -7.105 -11.650
202 HG21 THR 25 HG21 THR 25 -0.734 -4.607 -11.361
203 HG22 THR 25 HG22 THR 25 -1.272 -5.686 -10.074
204 HG23 THR 25 HG23 THR 25 -0.986 -6.321 -11.695
205 H ALA 26 H ALA 26 1.606 -5.640 -7.447
206 HA ALA 26 HA ALA 26 -0.792 -4.366 -6.369
207 HB1 ALA 26 HB1 ALA 26 0.505 -6.298 -5.330
208 HB2 ALA 26 HB2 ALA 26 -0.020 -5.037 -4.216
209 HB3 ALA 26 HB3 ALA 26 1.659 -5.095 -4.753
210 H GLU 27 H GLU 27 2.605 -3.229 -6.776
211 HA GLU 27 HA GLU 27 2.253 -0.945 -5.203
212 HB2 GLU 27 HB2 GLU 27 4.444 -1.777 -5.975
213 HB3 GLU 27 HB3 GLU 27 4.065 -1.202 -7.610
214 HG2 GLU 27 HG2 GLU 27 3.763 1.104 -6.562
215 HG3 GLU 27 HG3 GLU 27 4.530 0.421 -5.110
216 H LYS 28 H LYS 28 1.728 -1.284 -8.715
217 HA LYS 28 HA LYS 28 1.012 1.475 -9.141
218 HB2 LYS 28 HB2 LYS 28 -0.041 -0.940 -10.628
219 HB3 LYS 28 HB3 LYS 28 -0.027 0.742 -11.195
220 HG2 LYS 28 HG2 LYS 28 2.386 0.743 -11.284
221 HG3 LYS 28 HG3 LYS 28 2.448 -0.888 -10.570
222 HD2 LYS 28 HD2 LYS 28 1.657 -1.905 -12.503
223 HD3 LYS 28 HD3 LYS 28 0.898 -0.409 -13.103
224 HE2 LYS 28 HE2 LYS 28 3.009 0.522 -13.702
225 HE3 LYS 28 HE3 LYS 28 3.893 -0.748 -12.825
226 HZ1 LYS 28 HZ1 LYS 28 3.025 -2.349 -14.430
227 HZ2 LYS 28 HZ2 LYS 28 3.916 -1.168 -15.182
228 HZ3 LYS 28 HZ3 LYS 28 2.260 -1.133 -15.264
229 H ALA 29 H ALA 29 -1.021 -1.354 -8.136
230 HA ALA 29 HA ALA 29 -3.498 0.222 -8.307
231 HB1 ALA 29 HB1 ALA 29 -4.516 -1.588 -7.054
232 HB2 ALA 29 HB2 ALA 29 -2.944 -2.197 -6.536
233 HB3 ALA 29 HB3 ALA 29 -3.412 -2.297 -8.234
234 H PHE 30 H PHE 30 -1.237 -0.556 -5.532
235 HA PHE 30 HA PHE 30 -2.862 0.855 -3.615
236 HB2 PHE 30 HB2 PHE 30 0.062 0.019 -3.681
237 HB3 PHE 30 HB3 PHE 30 -0.684 0.817 -2.280
238 HD1 PHE 30 HD1 PHE 30 -3.263 -0.442 -2.036
239 HD2 PHE 30 HD2 PHE 30 0.469 -2.171 -3.130
240 HE1 PHE 30 HE1 PHE 30 -4.037 -2.627 -1.206
241 HE2 PHE 30 HE2 PHE 30 -0.298 -4.357 -2.304
242 HZ PHE 30 HZ PHE 30 -2.553 -4.587 -1.338
243 H LYS 31 H LYS 31 -0.189 1.987 -5.774
244 HA LYS 31 HA LYS 31 -0.121 4.615 -4.462
245 HB2 LYS 31 HB2 LYS 31 1.641 3.855 -6.032
246 HB3 LYS 31 HB3 LYS 31 0.472 3.920 -7.365
247 HG2 LYS 31 HG2 LYS 31 0.183 6.420 -6.498
248 HG3 LYS 31 HG3 LYS 31 1.836 6.132 -5.901
249 HD2 LYS 31 HD2 LYS 31 2.446 5.364 -8.215
250 HD3 LYS 31 HD3 LYS 31 0.834 5.898 -8.753
251 HE2 LYS 31 HE2 LYS 31 1.332 8.128 -8.488
252 HE3 LYS 31 HE3 LYS 31 2.548 7.818 -7.226
253 HZ1 LYS 31 HZ1 LYS 31 2.924 7.143 -10.082
254 HZ2 LYS 31 HZ2 LYS 31 4.066 7.073 -8.881
255 HZ3 LYS 31 HZ3 LYS 31 3.478 8.542 -9.380
256 H GLN 32 H GLN 32 -2.270 3.259 -6.939
257 HA GLN 32 HA GLN 32 -3.568 5.802 -7.441
258 HB2 GLN 32 HB2 GLN 32 -3.785 4.000 -9.056
259 HB3 GLN 32 HB3 GLN 32 -4.505 2.933 -7.835
260 HG2 GLN 32 HG2 GLN 32 -6.487 4.296 -7.732
261 HG3 GLN 32 HG3 GLN 32 -5.754 5.514 -8.802
262 HE21 GLN 32 HE21 GLN 32 -7.916 5.003 -9.855
263 HE22 GLN 32 HE22 GLN 32 -7.879 3.716 -11.110
264 H TYR 33 H TYR 33 -4.356 3.117 -5.231
265 HA TYR 33 HA TYR 33 -6.773 4.279 -4.187
266 HB2 TYR 33 HB2 TYR 33 -6.029 1.920 -3.772
267 HB3 TYR 33 HB3 TYR 33 -4.652 2.534 -2.832
268 HD1 TYR 33 HD2 TYR 33 -5.149 3.825 -0.696
269 HD2 TYR 33 HD1 TYR 33 -8.107 1.560 -2.750
270 HE1 TYR 33 HE2 TYR 33 -6.523 3.781 1.343
271 HE2 TYR 33 HE1 TYR 33 -9.490 1.511 -0.716
272 HH TYR 33 HH TYR 33 -8.638 1.846 2.099
273 H ALA 34 H ALA 34 -3.406 4.637 -3.017
274 HA ALA 34 HA ALA 34 -3.970 6.403 -0.879
275 HB1 ALA 34 HB1 ALA 34 -1.740 5.236 -1.562
276 HB2 ALA 34 HB2 ALA 34 -1.695 6.806 -0.760
277 HB3 ALA 34 HB3 ALA 34 -1.485 6.702 -2.508
278 H ASN 35 H ASN 35 -3.265 7.144 -4.297
279 HA ASN 35 HA ASN 35 -3.401 10.030 -3.844
280 HB2 ASN 35 HB2 ASN 35 -3.853 8.278 -6.316
281 HB3 ASN 35 HB3 ASN 35 -3.910 10.053 -6.375
282 HD21 ASN 35 HD21 ASN 35 -2.159 8.876 -7.978
283 HD22 ASN 35 HD22 ASN 35 -0.486 9.062 -7.349
284 H ASP 36 H ASP 36 -6.000 7.657 -4.776
285 HA ASP 36 HA ASP 36 -8.005 9.696 -5.125
286 HB2 ASP 36 HB2 ASP 36 -8.267 6.766 -4.431
287 HB3 ASP 36 HB3 ASP 36 -9.660 7.836 -4.702
288 H ASN 37 H ASN 37 -6.635 8.362 -2.204
289 HA ASN 37 HA ASN 37 -8.823 9.711 -0.652
290 HB2 ASN 37 HB2 ASN 37 -6.852 7.529 0.043
291 HB3 ASN 37 HB3 ASN 37 -7.759 8.411 1.290
292 HD21 ASN 37 HD21 ASN 37 -7.927 6.183 -1.401
293 HD22 ASN 37 HD22 ASN 37 -9.596 5.606 -1.065
294 H GLY 38 H GLY 38 -5.943 10.734 -1.796
295 HA2 GLY 38 HA2 GLY 38 -4.949 12.745 -1.207
296 HA3 GLY 38 HA3 GLY 38 -5.929 12.807 0.242
297 H VAL 39 H VAL 39 -3.843 10.067 -0.241
298 HA VAL 39 HA VAL 39 -2.151 11.057 2.045
299 HB VAL 39 HB VAL 39 -2.630 8.236 1.096
300 HG11 VAL 39 HG11 VAL 39 -1.342 8.887 3.695
301 HG12 VAL 39 HG12 VAL 39 -0.368 9.081 2.238
302 HG13 VAL 39 HG13 VAL 39 -1.091 7.516 2.615
303 HG21 VAL 39 HG21 VAL 39 -3.982 7.944 3.010
304 HG22 VAL 39 HG22 VAL 39 -4.523 9.463 2.294
305 HG23 VAL 39 HG23 VAL 39 -3.473 9.481 3.708
306 H ASP 40 H ASP 40 -0.164 11.454 1.839
307 HA ASP 40 HA ASP 40 1.275 10.370 -0.526
308 HB2 ASP 40 HB2 ASP 40 0.401 12.550 -1.147
309 HB3 ASP 40 HB3 ASP 40 1.083 13.278 0.323
310 H GLY 41 H GLY 41 3.057 9.723 -0.289
311 HA2 GLY 41 HA2 GLY 41 4.987 10.772 1.716
312 HA3 GLY 41 HA3 GLY 41 4.131 9.336 2.225
313 H VAL 42 H VAL 42 6.056 8.530 2.724
314 HA VAL 42 HA VAL 42 7.766 7.796 0.462
315 HB VAL 42 HB VAL 42 8.224 7.701 3.441
316 HG11 VAL 42 HG11 VAL 42 9.234 5.747 2.249
317 HG12 VAL 42 HG12 VAL 42 10.397 6.799 3.056
318 HG13 VAL 42 HG13 VAL 42 10.195 6.887 1.307
319 HG21 VAL 42 HG21 VAL 42 10.228 9.172 2.564
320 HG22 VAL 42 HG22 VAL 42 8.639 9.874 2.865
321 HG23 VAL 42 HG23 VAL 42 9.129 9.471 1.221
322 H TRP 43 H TRP 43 8.042 5.696 -0.237
323 HA TRP 43 HA TRP 43 6.150 3.655 1.044
324 HB2 TRP 43 HB2 TRP 43 7.437 3.981 -1.703
325 HB3 TRP 43 HB3 TRP 43 6.575 2.507 -1.208
326 HD1 TRP 43 HD1 TRP 43 5.939 6.245 -1.918
327 HE1 TRP 43 HE1 TRP 43 3.423 6.592 -2.450
328 HE3 TRP 43 HE3 TRP 43 4.303 1.514 -0.886
329 HZ2 TRP 43 HZ2 TRP 43 1.081 5.002 -2.411
330 HZ3 TRP 43 HZ3 TRP 43 1.913 1.006 -1.159
331 HH2 TRP 43 HH2 TRP 43 0.335 2.715 -1.904
332 H THR 44 H THR 44 6.801 1.769 1.857
333 HA THR 44 HA THR 44 9.551 0.866 1.185
334 HB THR 44 HB THR 44 9.665 -0.141 3.544
335 HG1 THR 44 HG1 THR 44 7.538 1.703 3.895
336 HG21 THR 44 HG21 THR 44 10.945 1.887 2.838
337 HG22 THR 44 HG22 THR 44 10.579 1.793 4.561
338 HG23 THR 44 HG23 THR 44 9.646 2.868 3.519
339 H TYR 45 H TYR 45 9.764 -1.455 1.257
340 HA TYR 45 HA TYR 45 7.308 -2.987 1.392
341 HB2 TYR 45 HB2 TYR 45 7.672 -2.550 -0.962
342 HB3 TYR 45 HB3 TYR 45 9.346 -3.127 -0.815
343 HD1 TYR 45 HD1 TYR 45 6.139 -4.593 0.444
344 HD2 TYR 45 HD2 TYR 45 9.501 -5.032 -2.126
345 HE1 TYR 45 HE1 TYR 45 5.399 -6.866 -0.128
346 HE2 TYR 45 HE2 TYR 45 8.771 -7.309 -2.705
347 HH TYR 45 HH TYR 45 7.354 -9.112 -1.639
348 H ASP 46 H ASP 46 7.375 -4.866 2.454
349 HA ASP 46 HA ASP 46 10.059 -5.946 3.064
350 HB2 ASP 46 HB2 ASP 46 8.867 -5.220 5.112
351 HB3 ASP 46 HB3 ASP 46 7.471 -6.219 4.651
352 H ASP 47 H ASP 47 10.445 -7.548 1.671
353 HA ASP 47 HA ASP 47 8.335 -8.921 0.258
354 HB2 ASP 47 HB2 ASP 47 10.703 -8.632 -0.546
355 HB3 ASP 47 HB3 ASP 47 11.206 -9.849 0.650
356 H ALA 48 H ALA 48 9.933 -9.702 3.381
357 HA ALA 48 HA ALA 48 9.159 -12.540 3.273
358 HB1 ALA 48 HB1 ALA 48 9.708 -10.638 5.607
359 HB2 ALA 48 HB2 ALA 48 10.874 -11.704 4.822
360 HB3 ALA 48 HB3 ALA 48 9.545 -12.386 5.760
361 H THR 49 H THR 49 7.451 -9.629 4.375
362 HA THR 49 HA THR 49 5.113 -11.461 5.157
363 HB THR 49 HB THR 49 4.168 -9.512 6.394
364 HG1 THR 49 HG1 THR 49 6.499 -8.118 5.544
365 HG21 THR 49 HG21 THR 49 5.376 -9.972 8.185
366 HG22 THR 49 HG22 THR 49 6.771 -9.118 7.527
367 HG23 THR 49 HG23 THR 49 6.526 -10.824 7.153
368 H LYS 50 H LYS 50 6.116 -9.766 2.475
369 HA LYS 50 HA LYS 50 5.010 -8.784 0.675
370 HB2 LYS 50 HB2 LYS 50 2.677 -10.524 1.636
371 HB3 LYS 50 HB3 LYS 50 2.796 -9.750 0.044
372 HG2 LYS 50 HG2 LYS 50 4.883 -11.694 1.024
373 HG3 LYS 50 HG3 LYS 50 3.389 -12.236 0.219
374 HD2 LYS 50 HD2 LYS 50 4.004 -10.617 -1.659
375 HD3 LYS 50 HD3 LYS 50 5.605 -10.499 -0.889
376 HE2 LYS 50 HE2 LYS 50 6.190 -12.630 -1.465
377 HE3 LYS 50 HE3 LYS 50 4.517 -13.233 -1.377
378 HZ1 LYS 50 HZ1 LYS 50 4.060 -12.223 -3.477
379 HZ2 LYS 50 HZ2 LYS 50 5.429 -13.144 -3.649
380 HZ3 LYS 50 HZ3 LYS 50 5.550 -11.494 -3.539
381 H THR 51 H THR 51 5.050 -7.196 2.884
382 HA THR 51 HA THR 51 2.480 -5.805 2.746
383 HB THR 51 HB THR 51 4.489 -5.929 4.985
384 HG1 THR 51 HG1 THR 51 1.824 -6.885 4.749
385 HG21 THR 51 HG21 THR 51 3.349 -3.704 4.780
386 HG22 THR 51 HG22 THR 51 3.061 -4.563 6.293
387 HG23 THR 51 HG23 THR 51 1.818 -4.539 5.042
388 H PHE 52 H PHE 52 2.328 -3.797 2.095
389 HA PHE 52 HA PHE 52 4.995 -2.288 1.539
390 HB2 PHE 52 HB2 PHE 52 2.107 -2.042 0.449
391 HB3 PHE 52 HB3 PHE 52 3.373 -0.821 0.191
392 HD1 PHE 52 HD2 PHE 52 5.332 -1.348 -1.184
393 HD2 PHE 52 HD1 PHE 52 2.122 -4.109 -0.743
394 HE1 PHE 52 HE2 PHE 52 6.141 -2.596 -3.146
395 HE2 PHE 52 HE1 PHE 52 2.924 -5.361 -2.704
396 HZ PHE 52 HZ PHE 52 4.936 -4.604 -3.908
397 H THR 53 H THR 53 5.108 -0.339 2.795
398 HA THR 53 HA THR 53 2.824 0.447 4.505
399 HB THR 53 HB THR 53 5.782 0.609 5.228
400 HG1 THR 53 HG1 THR 53 5.337 -1.373 5.809
401 HG21 THR 53 HG21 THR 53 5.301 1.873 7.002
402 HG22 THR 53 HG22 THR 53 3.794 1.019 7.333
403 HG23 THR 53 HG23 THR 53 3.835 2.297 6.119
404 H VAL 54 H VAL 54 2.306 2.600 4.429
405 HA VAL 54 HA VAL 54 4.333 4.345 2.938
406 HB VAL 54 HB VAL 54 2.367 4.027 1.472
407 HG11 VAL 54 HG11 VAL 54 0.142 4.606 2.081
408 HG12 VAL 54 HG12 VAL 54 0.663 5.275 3.628
409 HG13 VAL 54 HG13 VAL 54 0.753 3.537 3.344
410 HG21 VAL 54 HG21 VAL 54 1.640 6.490 1.406
411 HG22 VAL 54 HG22 VAL 54 3.358 6.135 1.231
412 HG23 VAL 54 HG23 VAL 54 2.731 6.716 2.773
413 H THR 55 H THR 55 5.065 5.834 4.333
414 HA THR 55 HA THR 55 3.455 6.495 6.770
415 HB THR 55 HB THR 55 6.469 6.491 6.410
416 HG1 THR 55 HG1 THR 55 4.825 4.760 7.952
417 HG21 THR 55 HG21 THR 55 4.966 6.779 8.990
418 HG22 THR 55 HG22 THR 55 5.619 8.144 8.084
419 HG23 THR 55 HG23 THR 55 6.702 6.903 8.712
420 H GLU 56 H GLU 56 2.802 8.546 6.891
421 HA GLU 56 HA GLU 56 3.886 10.613 4.982
422 HB2 GLU 56 HB2 GLU 56 1.454 10.415 6.791
423 HB3 GLU 56 HB3 GLU 56 1.928 11.916 5.973
424 HG2 GLU 56 HG2 GLU 56 1.709 10.816 3.805
425 HG3 GLU 56 HG3 GLU 56 1.266 9.296 4.617
Start of MODEL 15
1 H1 MET 1 H1 MET 1 -1.060 -13.068 -5.568
2 H2 MET 1 H2 MET 1 -2.124 -14.314 -5.180
3 H3 MET 1 H3 MET 1 -0.502 -14.654 -5.475
4 HA MET 1 HA MET 1 -1.181 -14.666 -3.114
5 HB2 MET 1 HB2 MET 1 0.946 -12.670 -3.956
6 HB3 MET 1 HB3 MET 1 0.868 -13.557 -2.422
7 HG2 MET 1 HG2 MET 1 0.886 -15.654 -4.039
8 HG3 MET 1 HG3 MET 1 1.659 -14.494 -5.144
9 HE1 MET 1 HE1 MET 1 3.247 -16.827 -1.767
10 HE2 MET 1 HE2 MET 1 1.558 -16.455 -2.112
11 HE3 MET 1 HE3 MET 1 2.472 -15.447 -0.991
12 H GLN 2 H GLN 2 -1.591 -13.411 -1.235
13 HA GLN 2 HA GLN 2 -3.069 -10.911 -1.810
14 HB2 GLN 2 HB2 GLN 2 -4.141 -12.579 -0.336
15 HB3 GLN 2 HB3 GLN 2 -2.720 -12.569 0.727
16 HG2 GLN 2 HG2 GLN 2 -3.209 -10.061 1.025
17 HG3 GLN 2 HG3 GLN 2 -4.803 -10.433 0.327
18 HE21 GLN 2 HE21 GLN 2 -3.317 -9.883 3.128
19 HE22 GLN 2 HE22 GLN 2 -4.273 -10.945 4.219
20 H TYR 3 H TYR 3 -2.359 -8.945 -1.287
21 HA TYR 3 HA TYR 3 0.143 -8.588 0.255
22 HB2 TYR 3 HB2 TYR 3 -0.824 -6.904 -2.051
23 HB3 TYR 3 HB3 TYR 3 0.579 -6.528 -1.025
24 HD1 TYR 3 HD1 TYR 3 -0.771 -9.202 -3.266
25 HD2 TYR 3 HD2 TYR 3 2.681 -7.328 -1.624
26 HE1 TYR 3 HE1 TYR 3 0.661 -10.561 -4.732
27 HE2 TYR 3 HE2 TYR 3 4.119 -8.682 -3.089
28 HH TYR 3 HH TYR 3 3.957 -9.913 -5.207
29 H LYS 4 H LYS 4 0.202 -6.809 1.731
30 HA LYS 4 HA LYS 4 -2.416 -5.612 2.301
31 HB2 LYS 4 HB2 LYS 4 -1.652 -7.201 4.021
32 HB3 LYS 4 HB3 LYS 4 -0.157 -6.261 4.206
33 HG2 LYS 4 HG2 LYS 4 -1.556 -4.301 4.885
34 HG3 LYS 4 HG3 LYS 4 -2.976 -5.376 4.865
35 HD2 LYS 4 HD2 LYS 4 -0.485 -5.889 6.516
36 HD3 LYS 4 HD3 LYS 4 -1.929 -5.048 7.131
37 HE2 LYS 4 HE2 LYS 4 -3.291 -6.992 6.797
38 HE3 LYS 4 HE3 LYS 4 -1.983 -7.826 5.925
39 HZ1 LYS 4 HZ1 LYS 4 -0.893 -8.274 7.854
40 HZ2 LYS 4 HZ2 LYS 4 -2.441 -8.276 8.446
41 HZ3 LYS 4 HZ3 LYS 4 -1.475 -6.946 8.663
42 H LEU 5 H LEU 5 -2.561 -3.456 2.830
43 HA LEU 5 HA LEU 5 0.035 -1.872 2.532
44 HB2 LEU 5 HB2 LEU 5 -1.418 -1.403 0.634
45 HB3 LEU 5 HB3 LEU 5 -2.816 -1.152 1.689
46 HG LEU 5 HG LEU 5 -1.555 0.813 2.703
47 HD11 LEU 5 HD11 LEU 5 0.685 0.319 2.050
48 HD12 LEU 5 HD12 LEU 5 0.197 1.784 1.199
49 HD13 LEU 5 HD13 LEU 5 0.240 0.241 0.345
50 HD21 LEU 5 HD21 LEU 5 -2.262 2.307 0.994
51 HD22 LEU 5 HD22 LEU 5 -3.376 0.940 0.966
52 HD23 LEU 5 HD23 LEU 5 -2.109 1.069 -0.253
53 H VAL 6 H VAL 6 0.425 -0.833 4.424
54 HA VAL 6 HA VAL 6 -1.689 -0.321 6.374
55 HB VAL 6 HB VAL 6 1.310 -0.392 6.829
56 HG11 VAL 6 HG11 VAL 6 0.914 0.133 9.081
57 HG12 VAL 6 HG12 VAL 6 -0.816 -0.182 8.951
58 HG13 VAL 6 HG13 VAL 6 -0.120 1.248 8.188
59 HG21 VAL 6 HG21 VAL 6 -0.882 -2.364 7.367
60 HG22 VAL 6 HG22 VAL 6 0.537 -2.306 8.414
61 HG23 VAL 6 HG23 VAL 6 0.725 -2.626 6.689
62 H ILE 7 H ILE 7 -2.336 1.728 6.609
63 HA ILE 7 HA ILE 7 -0.551 3.864 5.261
64 HB ILE 7 HB ILE 7 -3.537 3.981 5.929
65 HG12 ILE 7 HG12 ILE 7 -2.130 3.932 3.232
66 HG13 ILE 7 HG13 ILE 7 -2.912 2.522 3.979
67 HG21 ILE 7 HG21 ILE 7 -3.201 6.097 4.426
68 HG22 ILE 7 HG22 ILE 7 -1.530 5.986 4.978
69 HG23 ILE 7 HG23 ILE 7 -2.836 6.165 6.149
70 HD11 ILE 7 HD11 ILE 7 -4.339 3.571 2.309
71 HD12 ILE 7 HD12 ILE 7 -4.283 5.094 3.197
72 HD13 ILE 7 HD13 ILE 7 -5.056 3.681 3.916
73 H ASN 8 H ASN 8 0.635 4.871 6.749
74 HA ASN 8 HA ASN 8 -0.544 5.355 9.493
75 HB2 ASN 8 HB2 ASN 8 2.359 5.135 8.551
76 HB3 ASN 8 HB3 ASN 8 1.860 5.609 10.190
77 HD21 ASN 8 HD21 ASN 8 2.497 3.966 11.417
78 HD22 ASN 8 HD22 ASN 8 2.010 2.255 11.153
79 H GLY 9 H GLY 9 -1.756 7.135 8.423
80 HA2 GLY 9 HA2 GLY 9 -0.280 9.409 7.274
81 HA3 GLY 9 HA3 GLY 9 -1.974 9.129 7.249
82 H LYS 10 H LYS 10 -1.157 11.638 7.920
83 HA LYS 10 HA LYS 10 -0.897 12.035 10.799
84 HB2 LYS 10 HB2 LYS 10 -0.156 13.601 8.998
85 HB3 LYS 10 HB3 LYS 10 -1.864 13.925 8.638
86 HG2 LYS 10 HG2 LYS 10 -2.181 15.151 10.541
87 HG3 LYS 10 HG3 LYS 10 -0.944 14.257 11.457
88 HD2 LYS 10 HD2 LYS 10 -0.024 16.403 11.120
89 HD3 LYS 10 HD3 LYS 10 0.765 15.365 9.907
90 HE2 LYS 10 HE2 LYS 10 -0.621 16.208 8.159
91 HE3 LYS 10 HE3 LYS 10 -1.694 17.030 9.317
92 HZ1 LYS 10 HZ1 LYS 10 1.058 17.757 8.551
93 HZ2 LYS 10 HZ2 LYS 10 0.359 18.345 9.936
94 HZ3 LYS 10 HZ3 LYS 10 -0.318 18.682 8.460
95 H THR 11 H THR 11 -3.445 12.020 8.538
96 HA THR 11 HA THR 11 -5.551 12.266 10.621
97 HB THR 11 HB THR 11 -7.031 13.201 8.943
98 HG1 THR 11 HG1 THR 11 -6.366 13.485 6.977
99 HG21 THR 11 HG21 THR 11 -4.531 14.723 9.643
100 HG22 THR 11 HG22 THR 11 -6.107 14.776 10.434
101 HG23 THR 11 HG23 THR 11 -5.908 15.452 8.818
102 H LEU 12 H LEU 12 -4.514 10.208 8.010
103 HA LEU 12 HA LEU 12 -6.880 8.555 8.637
104 HB2 LEU 12 HB2 LEU 12 -6.908 9.382 6.326
105 HB3 LEU 12 HB3 LEU 12 -5.285 8.722 6.071
106 HG LEU 12 HG LEU 12 -6.169 6.436 6.414
107 HD11 LEU 12 HD11 LEU 12 -8.042 7.033 7.894
108 HD12 LEU 12 HD12 LEU 12 -8.559 6.048 6.525
109 HD13 LEU 12 HD13 LEU 12 -8.872 7.783 6.530
110 HD21 LEU 12 HD21 LEU 12 -7.708 8.001 4.335
111 HD22 LEU 12 HD22 LEU 12 -7.353 6.274 4.308
112 HD23 LEU 12 HD23 LEU 12 -6.043 7.446 4.163
113 H LYS 13 H LYS 13 -6.505 6.674 9.641
114 HA LYS 13 HA LYS 13 -3.873 5.402 9.184
115 HB2 LYS 13 HB2 LYS 13 -5.415 5.483 11.772
116 HB3 LYS 13 HB3 LYS 13 -3.901 4.599 11.500
117 HG2 LYS 13 HG2 LYS 13 -2.955 6.931 10.834
118 HG3 LYS 13 HG3 LYS 13 -4.372 7.557 11.713
119 HD2 LYS 13 HD2 LYS 13 -3.691 6.434 13.733
120 HD3 LYS 13 HD3 LYS 13 -2.379 5.587 12.875
121 HE2 LYS 13 HE2 LYS 13 -2.547 8.603 13.063
122 HE3 LYS 13 HE3 LYS 13 -1.711 7.606 14.276
123 HZ1 LYS 13 HZ1 LYS 13 -0.245 6.810 12.581
124 HZ2 LYS 13 HZ2 LYS 13 -0.237 8.467 12.533
125 HZ3 LYS 13 HZ3 LYS 13 -1.074 7.612 11.385
126 H GLY 14 H GLY 14 -4.019 3.134 8.536
127 HA2 GLY 14 HA2 GLY 14 -5.861 1.373 9.547
128 HA3 GLY 14 HA3 GLY 14 -6.718 1.951 8.139
129 H GLU 15 H GLU 15 -6.667 -0.183 7.502
130 HA GLU 15 HA GLU 15 -4.187 -0.875 6.044
131 HB2 GLU 15 HB2 GLU 15 -5.704 -2.555 8.025
132 HB3 GLU 15 HB3 GLU 15 -4.675 -3.292 6.781
133 HG2 GLU 15 HG2 GLU 15 -3.205 -3.184 8.524
134 HG3 GLU 15 HG3 GLU 15 -2.875 -1.625 7.733
135 H THR 16 H THR 16 -4.486 -2.154 4.107
136 HA THR 16 HA THR 16 -7.202 -3.121 3.619
137 HB THR 16 HB THR 16 -7.279 -0.836 2.610
138 HG1 THR 16 HG1 THR 16 -8.571 -2.132 1.501
139 HG21 THR 16 HG21 THR 16 -4.802 -0.843 1.984
140 HG22 THR 16 HG22 THR 16 -5.944 -0.173 0.820
141 HG23 THR 16 HG23 THR 16 -5.287 -1.791 0.579
142 H THR 17 H THR 17 -7.150 -4.376 1.434
143 HA THR 17 HA THR 17 -4.519 -5.628 1.113
144 HB THR 17 HB THR 17 -5.466 -7.856 1.230
145 HG1 THR 17 HG1 THR 17 -7.877 -6.501 1.894
146 HG21 THR 17 HG21 THR 17 -5.538 -8.087 3.491
147 HG22 THR 17 HG22 THR 17 -6.541 -6.654 3.725
148 HG23 THR 17 HG23 THR 17 -4.820 -6.480 3.386
149 H THR 18 H THR 18 -4.323 -6.844 -0.842
150 HA THR 18 HA THR 18 -6.553 -6.629 -2.738
151 HB THR 18 HB THR 18 -5.096 -4.535 -3.126
152 HG1 THR 18 HG1 THR 18 -6.409 -5.122 -4.776
153 HG21 THR 18 HG21 THR 18 -3.245 -6.148 -4.750
154 HG22 THR 18 HG22 THR 18 -2.961 -6.177 -3.008
155 HG23 THR 18 HG23 THR 18 -2.983 -4.640 -3.874
156 H LYS 19 H LYS 19 -6.177 -8.032 -4.633
157 HA LYS 19 HA LYS 19 -4.243 -10.199 -3.998
158 HB2 LYS 19 HB2 LYS 19 -6.724 -10.224 -5.754
159 HB3 LYS 19 HB3 LYS 19 -5.650 -11.604 -5.461
160 HG2 LYS 19 HG2 LYS 19 -6.683 -10.379 -3.002
161 HG3 LYS 19 HG3 LYS 19 -7.955 -11.015 -4.073
162 HD2 LYS 19 HD2 LYS 19 -5.513 -12.596 -3.219
163 HD3 LYS 19 HD3 LYS 19 -7.077 -12.648 -2.368
164 HE2 LYS 19 HE2 LYS 19 -6.980 -13.146 -5.328
165 HE3 LYS 19 HE3 LYS 19 -6.488 -14.436 -4.205
166 HZ1 LYS 19 HZ1 LYS 19 -8.739 -13.812 -3.089
167 HZ2 LYS 19 HZ2 LYS 19 -8.710 -14.828 -4.400
168 HZ3 LYS 19 HZ3 LYS 19 -9.123 -13.233 -4.597
169 H ALA 20 H ALA 20 -2.533 -10.480 -5.444
170 HA ALA 20 HA ALA 20 -2.805 -9.487 -8.110
171 HB1 ALA 20 HB1 ALA 20 -0.589 -8.213 -7.925
172 HB2 ALA 20 HB2 ALA 20 -0.820 -8.285 -6.178
173 HB3 ALA 20 HB3 ALA 20 -1.993 -7.440 -7.190
174 H VAL 21 H VAL 21 -1.191 -10.238 -9.607
175 HA VAL 21 HA VAL 21 -0.023 -12.646 -8.835
176 HB VAL 21 HB VAL 21 -0.780 -12.215 -11.110
177 HG11 VAL 21 HG11 VAL 21 0.227 -9.899 -11.166
178 HG12 VAL 21 HG12 VAL 21 0.491 -10.880 -12.607
179 HG13 VAL 21 HG13 VAL 21 1.791 -10.669 -11.434
180 HG21 VAL 21 HG21 VAL 21 2.146 -12.958 -11.079
181 HG22 VAL 21 HG22 VAL 21 0.888 -13.527 -12.177
182 HG23 VAL 21 HG23 VAL 21 0.876 -14.028 -10.485
183 H ASP 22 H ASP 22 1.399 -9.438 -8.755
184 HA ASP 22 HA ASP 22 3.754 -10.623 -7.563
185 HB2 ASP 22 HB2 ASP 22 5.357 -9.606 -9.159
186 HB3 ASP 22 HB3 ASP 22 4.324 -10.820 -9.945
187 H ALA 23 H ALA 23 5.351 -8.898 -6.822
188 HA ALA 23 HA ALA 23 3.801 -7.127 -5.231
189 HB1 ALA 23 HB1 ALA 23 5.810 -7.839 -4.286
190 HB2 ALA 23 HB2 ALA 23 6.085 -6.139 -4.666
191 HB3 ALA 23 HB3 ALA 23 6.746 -7.393 -5.714
192 H GLU 24 H GLU 24 5.646 -6.594 -8.252
193 HA GLU 24 HA GLU 24 5.528 -3.685 -8.041
194 HB2 GLU 24 HB2 GLU 24 6.965 -4.981 -9.617
195 HB3 GLU 24 HB3 GLU 24 5.532 -5.538 -10.504
196 HG2 GLU 24 HG2 GLU 24 5.025 -3.072 -10.923
197 HG3 GLU 24 HG3 GLU 24 6.676 -2.753 -10.341
198 H THR 25 H THR 25 3.214 -6.011 -9.536
199 HA THR 25 HA THR 25 1.529 -3.848 -10.628
200 HB THR 25 HB THR 25 0.798 -6.737 -9.909
201 HG1 THR 25 HG1 THR 25 1.901 -7.106 -11.648
202 HG21 THR 25 HG21 THR 25 -0.733 -4.607 -11.363
203 HG22 THR 25 HG22 THR 25 -1.272 -5.685 -10.076
204 HG23 THR 25 HG23 THR 25 -0.985 -6.321 -11.696
205 H ALA 26 H ALA 26 1.606 -5.640 -7.447
206 HA ALA 26 HA ALA 26 -0.792 -4.366 -6.369
207 HB1 ALA 26 HB1 ALA 26 0.505 -6.298 -5.330
208 HB2 ALA 26 HB2 ALA 26 -0.020 -5.037 -4.216
209 HB3 ALA 26 HB3 ALA 26 1.659 -5.095 -4.753
210 H GLU 27 H GLU 27 2.605 -3.229 -6.776
211 HA GLU 27 HA GLU 27 2.253 -0.945 -5.203
212 HB2 GLU 27 HB2 GLU 27 4.444 -1.774 -5.971
213 HB3 GLU 27 HB3 GLU 27 4.065 -1.206 -7.609
214 HG2 GLU 27 HG2 GLU 27 3.761 1.104 -6.572
215 HG3 GLU 27 HG3 GLU 27 4.528 0.428 -5.116
216 H LYS 28 H LYS 28 1.728 -1.284 -8.715
217 HA LYS 28 HA LYS 28 1.012 1.475 -9.141
218 HB2 LYS 28 HB2 LYS 28 -0.044 -0.939 -10.629
219 HB3 LYS 28 HB3 LYS 28 -0.024 0.743 -11.195
220 HG2 LYS 28 HG2 LYS 28 2.389 0.738 -11.282
221 HG3 LYS 28 HG3 LYS 28 2.446 -0.893 -10.568
222 HD2 LYS 28 HD2 LYS 28 1.654 -1.908 -12.502
223 HD3 LYS 28 HD3 LYS 28 0.900 -0.411 -13.102
224 HE2 LYS 28 HE2 LYS 28 3.013 0.515 -13.700
225 HE3 LYS 28 HE3 LYS 28 3.893 -0.758 -12.822
226 HZ1 LYS 28 HZ1 LYS 28 3.022 -2.356 -14.428
227 HZ2 LYS 28 HZ2 LYS 28 3.917 -1.177 -15.178
228 HZ3 LYS 28 HZ3 LYS 28 2.261 -1.138 -15.263
229 H ALA 29 H ALA 29 -1.021 -1.354 -8.136
230 HA ALA 29 HA ALA 29 -3.498 0.222 -8.307
231 HB1 ALA 29 HB1 ALA 29 -4.516 -1.588 -7.054
232 HB2 ALA 29 HB2 ALA 29 -2.944 -2.197 -6.536
233 HB3 ALA 29 HB3 ALA 29 -3.412 -2.297 -8.234
234 H PHE 30 H PHE 30 -1.237 -0.556 -5.532
235 HA PHE 30 HA PHE 30 -2.862 0.855 -3.615
236 HB2 PHE 30 HB2 PHE 30 0.061 0.016 -3.683
237 HB3 PHE 30 HB3 PHE 30 -0.682 0.818 -2.282
238 HD1 PHE 30 HD1 PHE 30 -3.263 -0.435 -2.031
239 HD2 PHE 30 HD2 PHE 30 0.465 -2.174 -3.127
240 HE1 PHE 30 HE1 PHE 30 -4.039 -2.616 -1.195
241 HE2 PHE 30 HE2 PHE 30 -0.305 -4.356 -2.295
242 HZ PHE 30 HZ PHE 30 -2.560 -4.579 -1.325
243 H LYS 31 H LYS 31 -0.189 1.987 -5.774
244 HA LYS 31 HA LYS 31 -0.121 4.615 -4.462
245 HB2 LYS 31 HB2 LYS 31 0.594 3.711 -7.269
246 HB3 LYS 31 HB3 LYS 31 0.736 5.398 -6.737
247 HG2 LYS 31 HG2 LYS 31 2.105 4.268 -4.754
248 HG3 LYS 31 HG3 LYS 31 2.354 3.008 -5.987
249 HD2 LYS 31 HD2 LYS 31 3.123 4.815 -7.556
250 HD3 LYS 31 HD3 LYS 31 3.051 5.952 -6.187
251 HE2 LYS 31 HE2 LYS 31 4.851 4.995 -5.119
252 HE3 LYS 31 HE3 LYS 31 4.576 3.398 -5.856
253 HZ1 LYS 31 HZ1 LYS 31 5.561 5.757 -7.347
254 HZ2 LYS 31 HZ2 LYS 31 5.465 4.196 -7.899
255 HZ3 LYS 31 HZ3 LYS 31 6.550 4.587 -6.706
256 H GLN 32 H GLN 32 -2.270 3.259 -6.939
257 HA GLN 32 HA GLN 32 -3.568 5.802 -7.441
258 HB2 GLN 32 HB2 GLN 32 -3.785 4.001 -9.057
259 HB3 GLN 32 HB3 GLN 32 -4.505 2.933 -7.836
260 HG2 GLN 32 HG2 GLN 32 -6.310 3.658 -9.127
261 HG3 GLN 32 HG3 GLN 32 -6.374 4.668 -7.664
262 HE21 GLN 32 HE21 GLN 32 -7.616 5.279 -10.133
263 HE22 GLN 32 HE22 GLN 32 -6.838 6.770 -10.767
264 H TYR 33 H TYR 33 -4.356 3.117 -5.231
265 HA TYR 33 HA TYR 33 -6.773 4.279 -4.187
266 HB2 TYR 33 HB2 TYR 33 -6.029 1.920 -3.772
267 HB3 TYR 33 HB3 TYR 33 -4.652 2.534 -2.833
268 HD1 TYR 33 HD2 TYR 33 -5.147 3.825 -0.697
269 HD2 TYR 33 HD1 TYR 33 -8.108 1.561 -2.748
270 HE1 TYR 33 HE2 TYR 33 -6.520 3.782 1.344
271 HE2 TYR 33 HE1 TYR 33 -9.488 1.513 -0.714
272 HH TYR 33 HH TYR 33 -8.635 1.847 2.101
273 H ALA 34 H ALA 34 -3.406 4.637 -3.017
274 HA ALA 34 HA ALA 34 -3.970 6.403 -0.879
275 HB1 ALA 34 HB1 ALA 34 -1.740 5.236 -1.562
276 HB2 ALA 34 HB2 ALA 34 -1.695 6.806 -0.760
277 HB3 ALA 34 HB3 ALA 34 -1.485 6.702 -2.508
278 H ASN 35 H ASN 35 -3.265 7.144 -4.297
279 HA ASN 35 HA ASN 35 -3.401 10.030 -3.844
280 HB2 ASN 35 HB2 ASN 35 -3.855 8.279 -6.317
281 HB3 ASN 35 HB3 ASN 35 -3.908 10.054 -6.374
282 HD21 ASN 35 HD21 ASN 35 -2.160 8.875 -7.978
283 HD22 ASN 35 HD22 ASN 35 -0.486 9.057 -7.349
284 H ASP 36 H ASP 36 -6.000 7.657 -4.776
285 HA ASP 36 HA ASP 36 -8.005 9.696 -5.125
286 HB2 ASP 36 HB2 ASP 36 -8.267 6.766 -4.431
287 HB3 ASP 36 HB3 ASP 36 -9.660 7.836 -4.702
288 H ASN 37 H ASN 37 -6.635 8.362 -2.204
289 HA ASN 37 HA ASN 37 -8.823 9.711 -0.652
290 HB2 ASN 37 HB2 ASN 37 -6.853 7.528 0.042
291 HB3 ASN 37 HB3 ASN 37 -7.759 8.411 1.290
292 HD21 ASN 37 HD21 ASN 37 -7.929 6.183 -1.401
293 HD22 ASN 37 HD22 ASN 37 -9.598 5.607 -1.063
294 H GLY 38 H GLY 38 -5.943 10.734 -1.796
295 HA2 GLY 38 HA2 GLY 38 -4.949 12.745 -1.207
296 HA3 GLY 38 HA3 GLY 38 -5.929 12.807 0.242
297 H VAL 39 H VAL 39 -3.843 10.067 -0.241
298 HA VAL 39 HA VAL 39 -2.151 11.057 2.045
299 HB VAL 39 HB VAL 39 -2.633 8.237 1.096
300 HG11 VAL 39 HG11 VAL 39 -1.338 8.885 3.692
301 HG12 VAL 39 HG12 VAL 39 -0.367 9.078 2.233
302 HG13 VAL 39 HG13 VAL 39 -1.091 7.514 2.611
303 HG21 VAL 39 HG21 VAL 39 -3.980 7.946 3.014
304 HG22 VAL 39 HG22 VAL 39 -4.522 9.465 2.299
305 HG23 VAL 39 HG23 VAL 39 -3.468 9.481 3.711
306 H ASP 40 H ASP 40 -0.164 11.454 1.839
307 HA ASP 40 HA ASP 40 1.275 10.370 -0.526
308 HB2 ASP 40 HB2 ASP 40 0.263 12.992 -0.258
309 HB3 ASP 40 HB3 ASP 40 2.017 13.116 -0.002
310 H GLY 41 H GLY 41 3.057 9.723 -0.289
311 HA2 GLY 41 HA2 GLY 41 4.987 10.772 1.716
312 HA3 GLY 41 HA3 GLY 41 4.131 9.336 2.225
313 H VAL 42 H VAL 42 6.056 8.530 2.724
314 HA VAL 42 HA VAL 42 7.766 7.796 0.462
315 HB VAL 42 HB VAL 42 8.225 7.697 3.441
316 HG11 VAL 42 HG11 VAL 42 9.239 5.749 2.242
317 HG12 VAL 42 HG12 VAL 42 10.400 6.802 3.052
318 HG13 VAL 42 HG13 VAL 42 10.197 6.895 1.303
319 HG21 VAL 42 HG21 VAL 42 10.225 9.176 2.568
320 HG22 VAL 42 HG22 VAL 42 8.634 9.872 2.872
321 HG23 VAL 42 HG23 VAL 42 9.123 9.477 1.227
322 H TRP 43 H TRP 43 8.042 5.696 -0.237
323 HA TRP 43 HA TRP 43 6.150 3.655 1.044
324 HB2 TRP 43 HB2 TRP 43 7.436 3.982 -1.703
325 HB3 TRP 43 HB3 TRP 43 6.576 2.507 -1.208
326 HD1 TRP 43 HD1 TRP 43 5.937 6.244 -1.917
327 HE1 TRP 43 HE1 TRP 43 3.420 6.590 -2.449
328 HE3 TRP 43 HE3 TRP 43 4.305 1.512 -0.886
329 HZ2 TRP 43 HZ2 TRP 43 1.080 4.998 -2.410
330 HZ3 TRP 43 HZ3 TRP 43 1.915 1.002 -1.159
331 HH2 TRP 43 HH2 TRP 43 0.336 2.710 -1.903
332 H THR 44 H THR 44 6.801 1.769 1.857
333 HA THR 44 HA THR 44 9.551 0.866 1.185
334 HB THR 44 HB THR 44 9.666 -0.141 3.544
335 HG1 THR 44 HG1 THR 44 7.538 1.703 3.895
336 HG21 THR 44 HG21 THR 44 10.945 1.887 2.838
337 HG22 THR 44 HG22 THR 44 10.579 1.793 4.561
338 HG23 THR 44 HG23 THR 44 9.646 2.868 3.519
339 H TYR 45 H TYR 45 9.764 -1.455 1.257
340 HA TYR 45 HA TYR 45 7.308 -2.987 1.392
341 HB2 TYR 45 HB2 TYR 45 7.672 -2.550 -0.961
342 HB3 TYR 45 HB3 TYR 45 9.346 -3.127 -0.815
343 HD1 TYR 45 HD1 TYR 45 6.140 -4.594 0.444
344 HD2 TYR 45 HD2 TYR 45 9.502 -5.032 -2.126
345 HE1 TYR 45 HE1 TYR 45 5.401 -6.868 -0.128
346 HE2 TYR 45 HE2 TYR 45 8.773 -7.309 -2.705
347 HH TYR 45 HH TYR 45 7.358 -9.113 -1.639
348 H ASP 46 H ASP 46 7.375 -4.866 2.454
349 HA ASP 46 HA ASP 46 10.059 -5.946 3.064
350 HB2 ASP 46 HB2 ASP 46 8.866 -5.220 5.112
351 HB3 ASP 46 HB3 ASP 46 7.471 -6.219 4.651
352 H ASP 47 H ASP 47 10.445 -7.548 1.671
353 HA ASP 47 HA ASP 47 8.335 -8.921 0.258
354 HB2 ASP 47 HB2 ASP 47 10.704 -8.632 -0.545
355 HB3 ASP 47 HB3 ASP 47 11.205 -9.850 0.650
356 H ALA 48 H ALA 48 9.933 -9.702 3.381
357 HA ALA 48 HA ALA 48 9.159 -12.540 3.273
358 HB1 ALA 48 HB1 ALA 48 9.708 -10.638 5.607
359 HB2 ALA 48 HB2 ALA 48 10.874 -11.704 4.822
360 HB3 ALA 48 HB3 ALA 48 9.545 -12.386 5.760
361 H THR 49 H THR 49 7.451 -9.629 4.375
362 HA THR 49 HA THR 49 5.113 -11.461 5.157
363 HB THR 49 HB THR 49 4.168 -9.513 6.395
364 HG1 THR 49 HG1 THR 49 6.497 -8.117 5.543
365 HG21 THR 49 HG21 THR 49 5.379 -9.972 8.185
366 HG22 THR 49 HG22 THR 49 6.772 -9.116 7.525
367 HG23 THR 49 HG23 THR 49 6.529 -10.822 7.152
368 H LYS 50 H LYS 50 6.116 -9.766 2.475
369 HA LYS 50 HA LYS 50 5.010 -8.784 0.675
370 HB2 LYS 50 HB2 LYS 50 2.678 -10.525 1.637
371 HB3 LYS 50 HB3 LYS 50 2.795 -9.749 0.045
372 HG2 LYS 50 HG2 LYS 50 4.884 -11.693 1.020
373 HG3 LYS 50 HG3 LYS 50 3.390 -12.235 0.216
374 HD2 LYS 50 HD2 LYS 50 4.000 -10.612 -1.661
375 HD3 LYS 50 HD3 LYS 50 5.603 -10.495 -0.893
376 HE2 LYS 50 HE2 LYS 50 6.188 -12.624 -1.474
377 HE3 LYS 50 HE3 LYS 50 4.517 -13.228 -1.384
378 HZ1 LYS 50 HZ1 LYS 50 4.054 -12.216 -3.481
379 HZ2 LYS 50 HZ2 LYS 50 5.424 -13.136 -3.657
380 HZ3 LYS 50 HZ3 LYS 50 5.544 -11.485 -3.545
381 H THR 51 H THR 51 5.050 -7.196 2.884
382 HA THR 51 HA THR 51 2.480 -5.805 2.746
383 HB THR 51 HB THR 51 4.488 -5.930 4.985
384 HG1 THR 51 HG1 THR 51 1.822 -6.883 4.749
385 HG21 THR 51 HG21 THR 51 3.352 -3.703 4.780
386 HG22 THR 51 HG22 THR 51 3.062 -4.562 6.293
387 HG23 THR 51 HG23 THR 51 1.820 -4.537 5.042
388 H PHE 52 H PHE 52 2.328 -3.797 2.095
389 HA PHE 52 HA PHE 52 4.995 -2.288 1.539
390 HB2 PHE 52 HB2 PHE 52 2.107 -2.039 0.450
391 HB3 PHE 52 HB3 PHE 52 3.375 -0.822 0.190
392 HD1 PHE 52 HD2 PHE 52 5.332 -1.355 -1.186
393 HD2 PHE 52 HD1 PHE 52 2.116 -4.108 -0.740
394 HE1 PHE 52 HE2 PHE 52 6.136 -2.607 -3.147
395 HE2 PHE 52 HE1 PHE 52 2.914 -5.364 -2.700
396 HZ PHE 52 HZ PHE 52 4.927 -4.613 -3.906
397 H THR 53 H THR 53 5.108 -0.339 2.795
398 HA THR 53 HA THR 53 2.824 0.447 4.505
399 HB THR 53 HB THR 53 5.781 0.612 5.229
400 HG1 THR 53 HG1 THR 53 5.342 -1.372 5.805
401 HG21 THR 53 HG21 THR 53 5.297 1.871 7.005
402 HG22 THR 53 HG22 THR 53 3.791 1.013 7.333
403 HG23 THR 53 HG23 THR 53 3.829 2.293 6.122
404 H VAL 54 H VAL 54 2.306 2.600 4.429
405 HA VAL 54 HA VAL 54 4.333 4.345 2.938
406 HB VAL 54 HB VAL 54 2.368 4.028 1.471
407 HG11 VAL 54 HG11 VAL 54 0.142 4.604 2.080
408 HG12 VAL 54 HG12 VAL 54 0.662 5.271 3.628
409 HG13 VAL 54 HG13 VAL 54 0.754 3.534 3.341
410 HG21 VAL 54 HG21 VAL 54 1.638 6.490 1.408
411 HG22 VAL 54 HG22 VAL 54 3.357 6.138 1.233
412 HG23 VAL 54 HG23 VAL 54 2.728 6.716 2.776
413 H THR 55 H THR 55 5.065 5.834 4.333
414 HA THR 55 HA THR 55 3.455 6.495 6.770
415 HB THR 55 HB THR 55 6.468 6.488 6.409
416 HG1 THR 55 HG1 THR 55 4.823 4.763 7.956
417 HG21 THR 55 HG21 THR 55 4.968 6.784 8.990
418 HG22 THR 55 HG22 THR 55 5.622 8.146 8.080
419 HG23 THR 55 HG23 THR 55 6.703 6.905 8.710
420 H GLU 56 H GLU 56 2.802 8.546 6.891
421 HA GLU 56 HA GLU 56 3.886 10.613 4.982
422 HB2 GLU 56 HB2 GLU 56 1.454 10.415 6.791
423 HB3 GLU 56 HB3 GLU 56 1.928 11.916 5.973
424 HG2 GLU 56 HG2 GLU 56 1.786 10.700 3.800
425 HG3 GLU 56 HG3 GLU 56 1.146 9.297 4.688
Start of MODEL 16
1 H1 MET 1 H1 MET 1 -1.060 -13.068 -5.568
2 H2 MET 1 H2 MET 1 -2.124 -14.314 -5.180
3 H3 MET 1 H3 MET 1 -0.502 -14.654 -5.475
4 HA MET 1 HA MET 1 -1.181 -14.666 -3.114
5 HB2 MET 1 HB2 MET 1 0.946 -12.670 -3.957
6 HB3 MET 1 HB3 MET 1 0.868 -13.556 -2.422
7 HG2 MET 1 HG2 MET 1 0.886 -15.655 -4.037
8 HG3 MET 1 HG3 MET 1 1.659 -14.496 -5.143
9 HE1 MET 1 HE1 MET 1 3.246 -16.826 -1.763
10 HE2 MET 1 HE2 MET 1 1.557 -16.454 -2.109
11 HE3 MET 1 HE3 MET 1 2.471 -15.444 -0.988
12 H GLN 2 H GLN 2 -1.591 -13.411 -1.235
13 HA GLN 2 HA GLN 2 -3.069 -10.911 -1.810
14 HB2 GLN 2 HB2 GLN 2 -4.141 -12.579 -0.336
15 HB3 GLN 2 HB3 GLN 2 -2.720 -12.570 0.727
16 HG2 GLN 2 HG2 GLN 2 -3.210 -10.467 1.580
17 HG3 GLN 2 HG3 GLN 2 -4.252 -10.038 0.203
18 HE21 GLN 2 HE21 GLN 2 -4.940 -9.733 2.925
19 HE22 GLN 2 HE22 GLN 2 -6.324 -10.832 3.257
20 H TYR 3 H TYR 3 -2.359 -8.945 -1.287
21 HA TYR 3 HA TYR 3 0.143 -8.588 0.255
22 HB2 TYR 3 HB2 TYR 3 -0.824 -6.904 -2.052
23 HB3 TYR 3 HB3 TYR 3 0.578 -6.528 -1.025
24 HD1 TYR 3 HD1 TYR 3 -0.770 -9.202 -3.266
25 HD2 TYR 3 HD2 TYR 3 2.681 -7.327 -1.624
26 HE1 TYR 3 HE1 TYR 3 0.662 -10.561 -4.731
27 HE2 TYR 3 HE2 TYR 3 4.120 -8.682 -3.088
28 HH TYR 3 HH TYR 3 3.958 -9.913 -5.206
29 H LYS 4 H LYS 4 0.202 -6.809 1.731
30 HA LYS 4 HA LYS 4 -2.416 -5.612 2.301
31 HB2 LYS 4 HB2 LYS 4 -0.166 -6.410 4.153
32 HB3 LYS 4 HB3 LYS 4 -1.560 -5.434 4.661
33 HG2 LYS 4 HG2 LYS 4 -3.047 -7.312 3.936
34 HG3 LYS 4 HG3 LYS 4 -1.585 -8.286 3.644
35 HD2 LYS 4 HD2 LYS 4 -2.253 -6.987 6.301
36 HD3 LYS 4 HD3 LYS 4 -2.680 -8.664 5.879
37 HE2 LYS 4 HE2 LYS 4 -0.372 -9.267 5.647
38 HE3 LYS 4 HE3 LYS 4 0.143 -7.570 5.791
39 HZ1 LYS 4 HZ1 LYS 4 -0.182 -7.593 8.029
40 HZ2 LYS 4 HZ2 LYS 4 0.210 -9.191 7.825
41 HZ3 LYS 4 HZ3 LYS 4 -1.378 -8.744 7.991
42 H LEU 5 H LEU 5 -2.561 -3.456 2.830
43 HA LEU 5 HA LEU 5 0.035 -1.872 2.532
44 HB2 LEU 5 HB2 LEU 5 -1.420 -1.404 0.634
45 HB3 LEU 5 HB3 LEU 5 -2.816 -1.150 1.691
46 HG LEU 5 HG LEU 5 -1.551 0.814 2.701
47 HD11 LEU 5 HD11 LEU 5 0.688 0.316 2.046
48 HD12 LEU 5 HD12 LEU 5 0.201 1.780 1.194
49 HD13 LEU 5 HD13 LEU 5 0.241 0.237 0.342
50 HD21 LEU 5 HD21 LEU 5 -2.258 2.307 0.991
51 HD22 LEU 5 HD22 LEU 5 -3.374 0.942 0.966
52 HD23 LEU 5 HD23 LEU 5 -2.108 1.068 -0.254
53 H VAL 6 H VAL 6 0.425 -0.833 4.424
54 HA VAL 6 HA VAL 6 -1.689 -0.321 6.374
55 HB VAL 6 HB VAL 6 1.310 -0.391 6.830
56 HG11 VAL 6 HG11 VAL 6 0.913 0.132 9.082
57 HG12 VAL 6 HG12 VAL 6 -0.817 -0.184 8.950
58 HG13 VAL 6 HG13 VAL 6 -0.122 1.247 8.189
59 HG21 VAL 6 HG21 VAL 6 -0.881 -2.365 7.365
60 HG22 VAL 6 HG22 VAL 6 0.538 -2.306 8.413
61 HG23 VAL 6 HG23 VAL 6 0.727 -2.625 6.688
62 H ILE 7 H ILE 7 -2.336 1.728 6.609
63 HA ILE 7 HA ILE 7 -0.551 3.864 5.261
64 HB ILE 7 HB ILE 7 -3.536 3.986 5.932
65 HG12 ILE 7 HG12 ILE 7 -2.135 3.922 3.232
66 HG13 ILE 7 HG13 ILE 7 -2.918 2.517 3.987
67 HG21 ILE 7 HG21 ILE 7 -3.199 6.094 4.419
68 HG22 ILE 7 HG22 ILE 7 -1.526 5.982 4.967
69 HG23 ILE 7 HG23 ILE 7 -2.829 6.169 6.141
70 HD11 ILE 7 HD11 ILE 7 -4.347 3.561 2.315
71 HD12 ILE 7 HD12 ILE 7 -4.285 5.088 3.197
72 HD13 ILE 7 HD13 ILE 7 -5.060 3.681 3.924
73 H ASN 8 H ASN 8 0.635 4.871 6.749
74 HA ASN 8 HA ASN 8 -0.544 5.355 9.493
75 HB2 ASN 8 HB2 ASN 8 1.546 3.939 9.336
76 HB3 ASN 8 HB3 ASN 8 2.396 5.345 8.656
77 HD21 ASN 8 HD21 ASN 8 3.822 5.052 10.489
78 HD22 ASN 8 HD22 ASN 8 3.348 5.775 12.067
79 H GLY 9 H GLY 9 -1.756 7.135 8.423
80 HA2 GLY 9 HA2 GLY 9 -0.280 9.409 7.274
81 HA3 GLY 9 HA3 GLY 9 -1.974 9.129 7.249
82 H LYS 10 H LYS 10 -1.157 11.638 7.920
83 HA LYS 10 HA LYS 10 -0.897 12.035 10.799
84 HB2 LYS 10 HB2 LYS 10 -1.709 13.835 8.501
85 HB3 LYS 10 HB3 LYS 10 -1.449 14.382 10.170
86 HG2 LYS 10 HG2 LYS 10 0.724 12.858 8.777
87 HG3 LYS 10 HG3 LYS 10 0.456 14.572 8.376
88 HD2 LYS 10 HD2 LYS 10 0.561 15.031 10.878
89 HD3 LYS 10 HD3 LYS 10 1.150 13.359 11.061
90 HE2 LYS 10 HE2 LYS 10 2.530 13.592 10.164
91 HE3 LYS 10 HE3 LYS 10 2.914 14.949 9.078
92 HZ1 LYS 10 HZ1 LYS 10 3.132 14.849 12.016
93 HZ2 LYS 10 HZ2 LYS 10 3.107 16.291 11.197
94 HZ3 LYS 10 HZ3 LYS 10 4.316 15.194 10.904
95 H THR 11 H THR 11 -3.445 12.020 8.538
96 HA THR 11 HA THR 11 -5.551 12.266 10.621
97 HB THR 11 HB THR 11 -5.471 13.463 7.914
98 HG1 THR 11 HG1 THR 11 -5.512 15.223 9.049
99 HG21 THR 11 HG21 THR 11 -7.895 12.758 9.551
100 HG22 THR 11 HG22 THR 11 -7.568 12.388 7.857
101 HG23 THR 11 HG23 THR 11 -7.880 14.051 8.353
102 H LEU 12 H LEU 12 -4.514 10.208 8.010
103 HA LEU 12 HA LEU 12 -6.880 8.555 8.637
104 HB2 LEU 12 HB2 LEU 12 -6.905 9.384 6.325
105 HB3 LEU 12 HB3 LEU 12 -5.285 8.718 6.071
106 HG LEU 12 HG LEU 12 -6.178 6.436 6.415
107 HD11 LEU 12 HD11 LEU 12 -8.048 7.041 7.895
108 HD12 LEU 12 HD12 LEU 12 -8.569 6.057 6.527
109 HD13 LEU 12 HD13 LEU 12 -8.875 7.794 6.530
110 HD21 LEU 12 HD21 LEU 12 -7.710 8.005 4.335
111 HD22 LEU 12 HD22 LEU 12 -7.361 6.277 4.310
112 HD23 LEU 12 HD23 LEU 12 -6.047 7.444 4.164
113 H LYS 13 H LYS 13 -6.505 6.674 9.641
114 HA LYS 13 HA LYS 13 -3.873 5.402 9.184
115 HB2 LYS 13 HB2 LYS 13 -3.878 4.611 11.493
116 HB3 LYS 13 HB3 LYS 13 -3.901 6.383 11.411
117 HG2 LYS 13 HG2 LYS 13 -6.481 6.106 11.616
118 HG3 LYS 13 HG3 LYS 13 -6.078 4.482 12.226
119 HD2 LYS 13 HD2 LYS 13 -4.749 5.414 14.006
120 HD3 LYS 13 HD3 LYS 13 -4.916 7.056 13.334
121 HE2 LYS 13 HE2 LYS 13 -7.282 5.389 14.219
122 HE3 LYS 13 HE3 LYS 13 -6.404 6.478 15.318
123 HZ1 LYS 13 HZ1 LYS 13 -6.968 8.315 13.918
124 HZ2 LYS 13 HZ2 LYS 13 -8.364 7.501 14.288
125 HZ3 LYS 13 HZ3 LYS 13 -7.681 7.329 12.787
126 H GLY 14 H GLY 14 -4.019 3.134 8.536
127 HA2 GLY 14 HA2 GLY 14 -5.861 1.373 9.547
128 HA3 GLY 14 HA3 GLY 14 -6.718 1.951 8.139
129 H GLU 15 H GLU 15 -6.667 -0.183 7.502
130 HA GLU 15 HA GLU 15 -4.187 -0.875 6.044
131 HB2 GLU 15 HB2 GLU 15 -3.938 -2.192 7.970
132 HB3 GLU 15 HB3 GLU 15 -5.681 -2.516 8.065
133 HG2 GLU 15 HG2 GLU 15 -5.451 -3.858 5.952
134 HG3 GLU 15 HG3 GLU 15 -3.690 -3.666 6.103
135 H THR 16 H THR 16 -4.486 -2.154 4.107
136 HA THR 16 HA THR 16 -7.202 -3.121 3.619
137 HB THR 16 HB THR 16 -6.987 -2.183 1.175
138 HG1 THR 16 HG1 THR 16 -5.179 -1.037 1.148
139 HG21 THR 16 HG21 THR 16 -8.737 -1.562 2.931
140 HG22 THR 16 HG22 THR 16 -8.434 -0.414 1.627
141 HG23 THR 16 HG23 THR 16 -7.750 -0.131 3.227
142 H THR 17 H THR 17 -7.150 -4.376 1.434
143 HA THR 17 HA THR 17 -4.519 -5.628 1.113
144 HB THR 17 HB THR 17 -5.922 -6.913 2.780
145 HG1 THR 17 HG1 THR 17 -5.173 -8.180 0.345
146 HG21 THR 17 HG21 THR 17 -7.833 -7.999 2.197
147 HG22 THR 17 HG22 THR 17 -7.436 -8.025 0.478
148 HG23 THR 17 HG23 THR 17 -8.021 -6.539 1.225
149 H THR 18 H THR 18 -4.323 -6.844 -0.842
150 HA THR 18 HA THR 18 -6.553 -6.629 -2.738
151 HB THR 18 HB THR 18 -5.092 -4.536 -3.123
152 HG1 THR 18 HG1 THR 18 -6.412 -5.116 -4.771
153 HG21 THR 18 HG21 THR 18 -3.250 -6.150 -4.756
154 HG22 THR 18 HG22 THR 18 -2.961 -6.182 -3.015
155 HG23 THR 18 HG23 THR 18 -2.982 -4.644 -3.879
156 H LYS 19 H LYS 19 -6.177 -8.032 -4.633
157 HA LYS 19 HA LYS 19 -4.243 -10.199 -3.998
158 HB2 LYS 19 HB2 LYS 19 -6.725 -10.223 -5.754
159 HB3 LYS 19 HB3 LYS 19 -5.650 -11.603 -5.462
160 HG2 LYS 19 HG2 LYS 19 -6.682 -10.380 -3.001
161 HG3 LYS 19 HG3 LYS 19 -7.954 -11.016 -4.072
162 HD2 LYS 19 HD2 LYS 19 -5.511 -12.598 -3.221
163 HD3 LYS 19 HD3 LYS 19 -7.075 -12.650 -2.369
164 HE2 LYS 19 HE2 LYS 19 -6.979 -13.146 -5.329
165 HE3 LYS 19 HE3 LYS 19 -6.487 -14.437 -4.207
166 HZ1 LYS 19 HZ1 LYS 19 -8.738 -13.814 -3.089
167 HZ2 LYS 19 HZ2 LYS 19 -8.709 -14.829 -4.402
168 HZ3 LYS 19 HZ3 LYS 19 -9.122 -13.234 -4.597
169 H ALA 20 H ALA 20 -2.533 -10.480 -5.444
170 HA ALA 20 HA ALA 20 -2.805 -9.487 -8.110
171 HB1 ALA 20 HB1 ALA 20 -0.589 -8.213 -7.925
172 HB2 ALA 20 HB2 ALA 20 -0.820 -8.285 -6.178
173 HB3 ALA 20 HB3 ALA 20 -1.993 -7.440 -7.190
174 H VAL 21 H VAL 21 -1.191 -10.238 -9.607
175 HA VAL 21 HA VAL 21 -0.023 -12.646 -8.835
176 HB VAL 21 HB VAL 21 -0.780 -12.218 -11.110
177 HG11 VAL 21 HG11 VAL 21 0.220 -9.899 -11.166
178 HG12 VAL 21 HG12 VAL 21 0.487 -10.879 -12.607
179 HG13 VAL 21 HG13 VAL 21 1.786 -10.665 -11.435
180 HG21 VAL 21 HG21 VAL 21 2.149 -12.952 -11.080
181 HG22 VAL 21 HG22 VAL 21 0.892 -13.525 -12.177
182 HG23 VAL 21 HG23 VAL 21 0.882 -14.026 -10.486
183 H ASP 22 H ASP 22 1.399 -9.438 -8.755
184 HA ASP 22 HA ASP 22 3.754 -10.623 -7.563
185 HB2 ASP 22 HB2 ASP 22 5.356 -9.602 -9.159
186 HB3 ASP 22 HB3 ASP 22 4.327 -10.821 -9.943
187 H ALA 23 H ALA 23 5.351 -8.898 -6.822
188 HA ALA 23 HA ALA 23 3.801 -7.127 -5.231
189 HB1 ALA 23 HB1 ALA 23 5.810 -7.839 -4.286
190 HB2 ALA 23 HB2 ALA 23 6.085 -6.139 -4.666
191 HB3 ALA 23 HB3 ALA 23 6.746 -7.393 -5.714
192 H GLU 24 H GLU 24 5.646 -6.594 -8.252
193 HA GLU 24 HA GLU 24 5.528 -3.685 -8.041
194 HB2 GLU 24 HB2 GLU 24 5.728 -5.697 -10.345
195 HB3 GLU 24 HB3 GLU 24 5.693 -3.949 -10.651
196 HG2 GLU 24 HG2 GLU 24 7.648 -3.782 -9.019
197 HG3 GLU 24 HG3 GLU 24 7.758 -5.553 -9.149
198 H THR 25 H THR 25 3.214 -6.011 -9.536
199 HA THR 25 HA THR 25 1.529 -3.848 -10.628
200 HB THR 25 HB THR 25 0.798 -6.737 -9.909
201 HG1 THR 25 HG1 THR 25 1.901 -7.106 -11.648
202 HG21 THR 25 HG21 THR 25 -0.733 -4.607 -11.364
203 HG22 THR 25 HG22 THR 25 -1.272 -5.684 -10.076
204 HG23 THR 25 HG23 THR 25 -0.985 -6.321 -11.696
205 H ALA 26 H ALA 26 1.606 -5.640 -7.447
206 HA ALA 26 HA ALA 26 -0.792 -4.366 -6.369
207 HB1 ALA 26 HB1 ALA 26 0.505 -6.298 -5.330
208 HB2 ALA 26 HB2 ALA 26 -0.020 -5.037 -4.216
209 HB3 ALA 26 HB3 ALA 26 1.659 -5.095 -4.753
210 H GLU 27 H GLU 27 2.605 -3.229 -6.776
211 HA GLU 27 HA GLU 27 2.253 -0.945 -5.203
212 HB2 GLU 27 HB2 GLU 27 4.116 -1.499 -7.505
213 HB3 GLU 27 HB3 GLU 27 4.138 0.034 -6.610
214 HG2 GLU 27 HG2 GLU 27 4.414 -1.379 -4.504
215 HG3 GLU 27 HG3 GLU 27 4.749 -2.741 -5.598
216 H LYS 28 H LYS 28 1.728 -1.284 -8.715
217 HA LYS 28 HA LYS 28 1.012 1.475 -9.141
218 HB2 LYS 28 HB2 LYS 28 -0.042 -0.940 -10.628
219 HB3 LYS 28 HB3 LYS 28 -0.026 0.742 -11.195
220 HG2 LYS 28 HG2 LYS 28 2.386 0.742 -11.284
221 HG3 LYS 28 HG3 LYS 28 2.448 -0.889 -10.570
222 HD2 LYS 28 HD2 LYS 28 1.657 -1.905 -12.503
223 HD3 LYS 28 HD3 LYS 28 0.899 -0.409 -13.103
224 HE2 LYS 28 HE2 LYS 28 3.009 0.521 -13.702
225 HE3 LYS 28 HE3 LYS 28 3.893 -0.749 -12.825
226 HZ1 LYS 28 HZ1 LYS 28 3.025 -2.349 -14.430
227 HZ2 LYS 28 HZ2 LYS 28 3.916 -1.169 -15.181
228 HZ3 LYS 28 HZ3 LYS 28 2.260 -1.133 -15.264
229 H ALA 29 H ALA 29 -1.021 -1.354 -8.136
230 HA ALA 29 HA ALA 29 -3.498 0.222 -8.307
231 HB1 ALA 29 HB1 ALA 29 -4.516 -1.588 -7.054
232 HB2 ALA 29 HB2 ALA 29 -2.944 -2.197 -6.536
233 HB3 ALA 29 HB3 ALA 29 -3.412 -2.297 -8.234
234 H PHE 30 H PHE 30 -1.237 -0.556 -5.532
235 HA PHE 30 HA PHE 30 -2.862 0.855 -3.615
236 HB2 PHE 30 HB2 PHE 30 0.061 0.017 -3.682
237 HB3 PHE 30 HB3 PHE 30 -0.682 0.818 -2.282
238 HD1 PHE 30 HD1 PHE 30 -3.263 -0.435 -2.031
239 HD2 PHE 30 HD2 PHE 30 0.465 -2.173 -3.127
240 HE1 PHE 30 HE1 PHE 30 -4.039 -2.617 -1.196
241 HE2 PHE 30 HE2 PHE 30 -0.305 -4.356 -2.296
242 HZ PHE 30 HZ PHE 30 -2.559 -4.580 -1.326
243 H LYS 31 H LYS 31 -0.189 1.987 -5.774
244 HA LYS 31 HA LYS 31 -0.121 4.615 -4.462
245 HB2 LYS 31 HB2 LYS 31 0.593 3.712 -7.270
246 HB3 LYS 31 HB3 LYS 31 0.737 5.398 -6.736
247 HG2 LYS 31 HG2 LYS 31 2.105 4.266 -4.755
248 HG3 LYS 31 HG3 LYS 31 2.353 3.006 -5.989
249 HD2 LYS 31 HD2 LYS 31 3.123 4.814 -7.556
250 HD3 LYS 31 HD3 LYS 31 3.052 5.950 -6.186
251 HE2 LYS 31 HE2 LYS 31 4.851 4.991 -5.119
252 HE3 LYS 31 HE3 LYS 31 4.576 3.395 -5.858
253 HZ1 LYS 31 HZ1 LYS 31 5.562 5.755 -7.346
254 HZ2 LYS 31 HZ2 LYS 31 5.465 4.194 -7.900
255 HZ3 LYS 31 HZ3 LYS 31 6.550 4.583 -6.707
256 H GLN 32 H GLN 32 -2.270 3.259 -6.939
257 HA GLN 32 HA GLN 32 -3.568 5.802 -7.441
258 HB2 GLN 32 HB2 GLN 32 -3.785 4.000 -9.056
259 HB3 GLN 32 HB3 GLN 32 -4.505 2.933 -7.835
260 HG2 GLN 32 HG2 GLN 32 -6.142 3.883 -9.440
261 HG3 GLN 32 HG3 GLN 32 -6.491 4.274 -7.740
262 HE21 GLN 32 HE21 GLN 32 -7.815 5.810 -9.292
263 HE22 GLN 32 HE22 GLN 32 -7.054 7.424 -9.508
264 H TYR 33 H TYR 33 -4.356 3.117 -5.231
265 HA TYR 33 HA TYR 33 -6.773 4.279 -4.187
266 HB2 TYR 33 HB2 TYR 33 -6.026 1.920 -3.773
267 HB3 TYR 33 HB3 TYR 33 -4.652 2.536 -2.830
268 HD1 TYR 33 HD2 TYR 33 -5.155 3.826 -0.695
269 HD2 TYR 33 HD1 TYR 33 -8.107 1.558 -2.755
270 HE1 TYR 33 HE2 TYR 33 -6.533 3.780 1.342
271 HE2 TYR 33 HE1 TYR 33 -9.493 1.507 -0.724
272 HH TYR 33 HH TYR 33 -8.647 1.842 2.093
273 H ALA 34 H ALA 34 -3.406 4.637 -3.017
274 HA ALA 34 HA ALA 34 -3.970 6.403 -0.879
275 HB1 ALA 34 HB1 ALA 34 -1.740 5.236 -1.562
276 HB2 ALA 34 HB2 ALA 34 -1.695 6.806 -0.760
277 HB3 ALA 34 HB3 ALA 34 -1.485 6.702 -2.508
278 H ASN 35 H ASN 35 -3.265 7.144 -4.297
279 HA ASN 35 HA ASN 35 -3.401 10.030 -3.844
280 HB2 ASN 35 HB2 ASN 35 -3.857 8.280 -6.318
281 HB3 ASN 35 HB3 ASN 35 -3.906 10.056 -6.374
282 HD21 ASN 35 HD21 ASN 35 -2.160 8.873 -7.978
283 HD22 ASN 35 HD22 ASN 35 -0.486 9.051 -7.349
284 H ASP 36 H ASP 36 -6.000 7.657 -4.776
285 HA ASP 36 HA ASP 36 -8.005 9.696 -5.125
286 HB2 ASP 36 HB2 ASP 36 -8.266 6.765 -4.432
287 HB3 ASP 36 HB3 ASP 36 -9.660 7.835 -4.701
288 H ASN 37 H ASN 37 -6.635 8.362 -2.204
289 HA ASN 37 HA ASN 37 -8.823 9.711 -0.652
290 HB2 ASN 37 HB2 ASN 37 -6.852 7.529 0.044
291 HB3 ASN 37 HB3 ASN 37 -7.761 8.411 1.290
292 HD21 ASN 37 HD21 ASN 37 -7.924 6.183 -1.401
293 HD22 ASN 37 HD22 ASN 37 -9.593 5.605 -1.067
294 H GLY 38 H GLY 38 -5.943 10.734 -1.796
295 HA2 GLY 38 HA2 GLY 38 -4.949 12.745 -1.207
296 HA3 GLY 38 HA3 GLY 38 -5.929 12.807 0.242
297 H VAL 39 H VAL 39 -3.843 10.067 -0.241
298 HA VAL 39 HA VAL 39 -2.151 11.057 2.045
299 HB VAL 39 HB VAL 39 -2.632 8.237 1.096
300 HG11 VAL 39 HG11 VAL 39 -1.340 8.886 3.693
301 HG12 VAL 39 HG12 VAL 39 -0.368 9.079 2.235
302 HG13 VAL 39 HG13 VAL 39 -1.091 7.515 2.612
303 HG21 VAL 39 HG21 VAL 39 -3.981 7.945 3.012
304 HG22 VAL 39 HG22 VAL 39 -4.522 9.464 2.297
305 HG23 VAL 39 HG23 VAL 39 -3.470 9.481 3.710
306 H ASP 40 H ASP 40 -0.164 11.454 1.839
307 HA ASP 40 HA ASP 40 1.275 10.370 -0.526
308 HB2 ASP 40 HB2 ASP 40 0.399 12.552 -1.144
309 HB3 ASP 40 HB3 ASP 40 1.087 13.278 0.324
310 H GLY 41 H GLY 41 3.057 9.723 -0.289
311 HA2 GLY 41 HA2 GLY 41 4.987 10.772 1.716
312 HA3 GLY 41 HA3 GLY 41 4.131 9.336 2.225
313 H VAL 42 H VAL 42 6.056 8.530 2.724
314 HA VAL 42 HA VAL 42 7.766 7.796 0.462
315 HB VAL 42 HB VAL 42 8.225 7.699 3.441
316 HG11 VAL 42 HG11 VAL 42 9.237 5.748 2.244
317 HG12 VAL 42 HG12 VAL 42 10.399 6.801 3.053
318 HG13 VAL 42 HG13 VAL 42 10.196 6.892 1.305
319 HG21 VAL 42 HG21 VAL 42 10.226 9.174 2.566
320 HG22 VAL 42 HG22 VAL 42 8.636 9.873 2.869
321 HG23 VAL 42 HG23 VAL 42 9.126 9.475 1.225
322 H TRP 43 H TRP 43 8.042 5.696 -0.237
323 HA TRP 43 HA TRP 43 6.150 3.655 1.044
324 HB2 TRP 43 HB2 TRP 43 7.436 3.983 -1.703
325 HB3 TRP 43 HB3 TRP 43 6.576 2.507 -1.208
326 HD1 TRP 43 HD1 TRP 43 5.935 6.244 -1.916
327 HE1 TRP 43 HE1 TRP 43 3.418 6.587 -2.448
328 HE3 TRP 43 HE3 TRP 43 4.307 1.510 -0.887
329 HZ2 TRP 43 HZ2 TRP 43 1.079 4.994 -2.409
330 HZ3 TRP 43 HZ3 TRP 43 1.917 0.998 -1.159
331 HH2 TRP 43 HH2 TRP 43 0.336 2.705 -1.903
332 H THR 44 H THR 44 6.801 1.769 1.857
333 HA THR 44 HA THR 44 9.551 0.866 1.185
334 HB THR 44 HB THR 44 9.668 -0.140 3.543
335 HG1 THR 44 HG1 THR 44 7.536 1.698 3.896
336 HG21 THR 44 HG21 THR 44 10.942 1.892 2.838
337 HG22 THR 44 HG22 THR 44 10.576 1.795 4.561
338 HG23 THR 44 HG23 THR 44 9.641 2.869 3.520
339 H TYR 45 H TYR 45 9.764 -1.455 1.257
340 HA TYR 45 HA TYR 45 7.308 -2.987 1.392
341 HB2 TYR 45 HB2 TYR 45 7.671 -2.551 -0.961
342 HB3 TYR 45 HB3 TYR 45 9.346 -3.126 -0.815
343 HD1 TYR 45 HD1 TYR 45 6.141 -4.596 0.444
344 HD2 TYR 45 HD2 TYR 45 9.503 -5.031 -2.126
345 HE1 TYR 45 HE1 TYR 45 5.404 -6.871 -0.127
346 HE2 TYR 45 HE2 TYR 45 8.776 -7.308 -2.705
347 HH TYR 45 HH TYR 45 7.362 -9.113 -1.639
348 H ASP 46 H ASP 46 7.375 -4.866 2.454
349 HA ASP 46 HA ASP 46 10.059 -5.946 3.064
350 HB2 ASP 46 HB2 ASP 46 8.866 -5.220 5.112
351 HB3 ASP 46 HB3 ASP 46 7.471 -6.219 4.651
352 H ASP 47 H ASP 47 10.445 -7.548 1.671
353 HA ASP 47 HA ASP 47 8.335 -8.921 0.258
354 HB2 ASP 47 HB2 ASP 47 10.704 -8.632 -0.545
355 HB3 ASP 47 HB3 ASP 47 11.205 -9.849 0.650
356 H ALA 48 H ALA 48 9.933 -9.702 3.381
357 HA ALA 48 HA ALA 48 9.159 -12.540 3.273
358 HB1 ALA 48 HB1 ALA 48 9.708 -10.638 5.607
359 HB2 ALA 48 HB2 ALA 48 10.874 -11.704 4.822
360 HB3 ALA 48 HB3 ALA 48 9.545 -12.386 5.760
361 H THR 49 H THR 49 7.451 -9.629 4.375
362 HA THR 49 HA THR 49 5.113 -11.461 5.157
363 HB THR 49 HB THR 49 4.168 -9.513 6.395
364 HG1 THR 49 HG1 THR 49 6.497 -8.117 5.543
365 HG21 THR 49 HG21 THR 49 5.379 -9.972 8.185
366 HG22 THR 49 HG22 THR 49 6.772 -9.116 7.525
367 HG23 THR 49 HG23 THR 49 6.528 -10.822 7.152
368 H LYS 50 H LYS 50 6.116 -9.766 2.475
369 HA LYS 50 HA LYS 50 5.010 -8.784 0.675
370 HB2 LYS 50 HB2 LYS 50 2.676 -10.523 1.636
371 HB3 LYS 50 HB3 LYS 50 2.797 -9.751 0.043
372 HG2 LYS 50 HG2 LYS 50 4.882 -11.695 1.027
373 HG3 LYS 50 HG3 LYS 50 3.389 -12.236 0.221
374 HD2 LYS 50 HD2 LYS 50 4.006 -10.619 -1.658
375 HD3 LYS 50 HD3 LYS 50 5.607 -10.502 -0.887
376 HE2 LYS 50 HE2 LYS 50 6.191 -12.633 -1.461
377 HE3 LYS 50 HE3 LYS 50 4.518 -13.235 -1.374
378 HZ1 LYS 50 HZ1 LYS 50 4.062 -12.227 -3.475
379 HZ2 LYS 50 HZ2 LYS 50 5.431 -13.149 -3.645
380 HZ3 LYS 50 HZ3 LYS 50 5.553 -11.498 -3.536
381 H THR 51 H THR 51 5.050 -7.196 2.884
382 HA THR 51 HA THR 51 2.480 -5.805 2.746
383 HB THR 51 HB THR 51 4.489 -5.927 4.985
384 HG1 THR 51 HG1 THR 51 1.826 -6.889 4.749
385 HG21 THR 51 HG21 THR 51 3.345 -3.704 4.780
386 HG22 THR 51 HG22 THR 51 3.058 -4.564 6.293
387 HG23 THR 51 HG23 THR 51 1.816 -4.543 5.041
388 H PHE 52 H PHE 52 2.328 -3.797 2.095
389 HA PHE 52 HA PHE 52 4.995 -2.288 1.539
390 HB2 PHE 52 HB2 PHE 52 2.107 -2.043 0.448
391 HB3 PHE 52 HB3 PHE 52 3.371 -0.821 0.192
392 HD1 PHE 52 HD2 PHE 52 5.332 -1.344 -1.182
393 HD2 PHE 52 HD1 PHE 52 2.125 -4.110 -0.746
394 HE1 PHE 52 HE2 PHE 52 6.143 -2.589 -3.145
395 HE2 PHE 52 HE1 PHE 52 2.931 -5.359 -2.707
396 HZ PHE 52 HZ PHE 52 4.942 -4.599 -3.909
397 H THR 53 H THR 53 5.108 -0.339 2.795
398 HA THR 53 HA THR 53 2.824 0.447 4.505
399 HB THR 53 HB THR 53 5.782 0.608 5.228
400 HG1 THR 53 HG1 THR 53 5.336 -1.374 5.810
401 HG21 THR 53 HG21 THR 53 5.302 1.873 7.001
402 HG22 THR 53 HG22 THR 53 3.794 1.020 7.332
403 HG23 THR 53 HG23 THR 53 3.836 2.298 6.118
404 H VAL 54 H VAL 54 2.306 2.600 4.429
405 HA VAL 54 HA VAL 54 4.333 4.345 2.938
406 HB VAL 54 HB VAL 54 2.368 4.028 1.471
407 HG11 VAL 54 HG11 VAL 54 0.142 4.604 2.080
408 HG12 VAL 54 HG12 VAL 54 0.662 5.272 3.628
409 HG13 VAL 54 HG13 VAL 54 0.754 3.534 3.342
410 HG21 VAL 54 HG21 VAL 54 1.639 6.490 1.408
411 HG22 VAL 54 HG22 VAL 54 3.357 6.138 1.232
412 HG23 VAL 54 HG23 VAL 54 2.729 6.716 2.775
413 H THR 55 H THR 55 5.065 5.834 4.333
414 HA THR 55 HA THR 55 3.455 6.495 6.770
415 HB THR 55 HB THR 55 6.468 6.487 6.408
416 HG1 THR 55 HG1 THR 55 4.822 4.764 7.958
417 HG21 THR 55 HG21 THR 55 4.969 6.787 8.990
418 HG22 THR 55 HG22 THR 55 5.624 8.147 8.078
419 HG23 THR 55 HG23 THR 55 6.704 6.906 8.709
420 H GLU 56 H GLU 56 2.802 8.546 6.891
421 HA GLU 56 HA GLU 56 3.886 10.613 4.982
422 HB2 GLU 56 HB2 GLU 56 1.431 10.213 5.204
423 HB3 GLU 56 HB3 GLU 56 1.534 10.679 6.912
424 HG2 GLU 56 HG2 GLU 56 2.128 12.915 6.351
425 HG3 GLU 56 HG3 GLU 56 2.353 12.487 4.638
Start of MODEL 17
1 H1 MET 1 H1 MET 1 -1.060 -13.068 -5.568
2 H2 MET 1 H2 MET 1 -2.124 -14.314 -5.180
3 H3 MET 1 H3 MET 1 -0.502 -14.654 -5.475
4 HA MET 1 HA MET 1 -1.181 -14.666 -3.114
5 HB2 MET 1 HB2 MET 1 1.156 -14.252 -4.200
6 HB3 MET 1 HB3 MET 1 0.904 -12.569 -3.698
7 HG2 MET 1 HG2 MET 1 2.204 -13.731 -2.036
8 HG3 MET 1 HG3 MET 1 0.606 -13.329 -1.369
9 HE1 MET 1 HE1 MET 1 2.609 -17.241 -2.173
10 HE2 MET 1 HE2 MET 1 2.808 -15.733 -3.066
11 HE3 MET 1 HE3 MET 1 1.597 -16.908 -3.578
12 H GLN 2 H GLN 2 -1.591 -13.411 -1.235
13 HA GLN 2 HA GLN 2 -3.069 -10.911 -1.810
14 HB2 GLN 2 HB2 GLN 2 -4.140 -12.580 -0.336
15 HB3 GLN 2 HB3 GLN 2 -2.720 -12.569 0.727
16 HG2 GLN 2 HG2 GLN 2 -3.241 -10.022 0.947
17 HG3 GLN 2 HG3 GLN 2 -4.857 -10.495 0.370
18 HE21 GLN 2 HE21 GLN 2 -6.045 -10.221 2.157
19 HE22 GLN 2 HE22 GLN 2 -5.758 -11.102 3.698
20 H TYR 3 H TYR 3 -2.359 -8.945 -1.287
21 HA TYR 3 HA TYR 3 0.143 -8.588 0.255
22 HB2 TYR 3 HB2 TYR 3 -0.824 -6.906 -2.053
23 HB3 TYR 3 HB3 TYR 3 0.577 -6.526 -1.025
24 HD1 TYR 3 HD1 TYR 3 -0.765 -9.205 -3.265
25 HD2 TYR 3 HD2 TYR 3 2.681 -7.323 -1.621
26 HE1 TYR 3 HE1 TYR 3 0.671 -10.563 -4.728
27 HE2 TYR 3 HE2 TYR 3 4.124 -8.676 -3.082
28 HH TYR 3 HH TYR 3 3.966 -9.910 -5.199
29 H LYS 4 H LYS 4 0.202 -6.809 1.731
30 HA LYS 4 HA LYS 4 -2.416 -5.612 2.301
31 HB2 LYS 4 HB2 LYS 4 -0.166 -6.409 4.154
32 HB3 LYS 4 HB3 LYS 4 -1.561 -5.435 4.661
33 HG2 LYS 4 HG2 LYS 4 -3.047 -7.313 3.936
34 HG3 LYS 4 HG3 LYS 4 -1.584 -8.286 3.644
35 HD2 LYS 4 HD2 LYS 4 -2.253 -6.987 6.301
36 HD3 LYS 4 HD3 LYS 4 -2.679 -8.665 5.879
37 HE2 LYS 4 HE2 LYS 4 -0.371 -9.267 5.647
38 HE3 LYS 4 HE3 LYS 4 0.144 -7.569 5.792
39 HZ1 LYS 4 HZ1 LYS 4 -0.182 -7.593 8.029
40 HZ2 LYS 4 HZ2 LYS 4 0.211 -9.191 7.825
41 HZ3 LYS 4 HZ3 LYS 4 -1.378 -8.745 7.990
42 H LEU 5 H LEU 5 -2.561 -3.456 2.830
43 HA LEU 5 HA LEU 5 0.035 -1.872 2.532
44 HB2 LEU 5 HB2 LEU 5 -1.416 -1.401 0.635
45 HB3 LEU 5 HB3 LEU 5 -2.816 -1.153 1.688
46 HG LEU 5 HG LEU 5 -1.559 0.812 2.704
47 HD11 LEU 5 HD11 LEU 5 0.683 0.322 2.054
48 HD12 LEU 5 HD12 LEU 5 0.194 1.787 1.204
49 HD13 LEU 5 HD13 LEU 5 0.240 0.245 0.349
50 HD21 LEU 5 HD21 LEU 5 -2.266 2.307 0.996
51 HD22 LEU 5 HD22 LEU 5 -3.378 0.938 0.966
52 HD23 LEU 5 HD23 LEU 5 -2.110 1.070 -0.251
53 H VAL 6 H VAL 6 0.425 -0.833 4.424
54 HA VAL 6 HA VAL 6 -1.689 -0.321 6.374
55 HB VAL 6 HB VAL 6 1.310 -0.391 6.829
56 HG11 VAL 6 HG11 VAL 6 0.914 0.132 9.081
57 HG12 VAL 6 HG12 VAL 6 -0.817 -0.183 8.951
58 HG13 VAL 6 HG13 VAL 6 -0.121 1.247 8.189
59 HG21 VAL 6 HG21 VAL 6 -0.882 -2.365 7.366
60 HG22 VAL 6 HG22 VAL 6 0.537 -2.306 8.413
61 HG23 VAL 6 HG23 VAL 6 0.726 -2.625 6.688
62 H ILE 7 H ILE 7 -2.336 1.728 6.609
63 HA ILE 7 HA ILE 7 -0.551 3.864 5.261
64 HB ILE 7 HB ILE 7 -3.537 3.984 5.930
65 HG12 ILE 7 HG12 ILE 7 -2.132 3.927 3.232
66 HG13 ILE 7 HG13 ILE 7 -2.915 2.520 3.983
67 HG21 ILE 7 HG21 ILE 7 -3.200 6.096 4.423
68 HG22 ILE 7 HG22 ILE 7 -1.528 5.984 4.973
69 HG23 ILE 7 HG23 ILE 7 -2.833 6.167 6.145
70 HD11 ILE 7 HD11 ILE 7 -4.343 3.567 2.312
71 HD12 ILE 7 HD12 ILE 7 -4.284 5.091 3.197
72 HD13 ILE 7 HD13 ILE 7 -5.058 3.681 3.920
73 H ASN 8 H ASN 8 0.635 4.871 6.749
74 HA ASN 8 HA ASN 8 -0.544 5.355 9.493
75 HB2 ASN 8 HB2 ASN 8 1.547 3.939 9.334
76 HB3 ASN 8 HB3 ASN 8 2.396 5.347 8.658
77 HD21 ASN 8 HD21 ASN 8 3.574 4.445 10.758
78 HD22 ASN 8 HD22 ASN 8 3.196 5.406 12.230
79 H GLY 9 H GLY 9 -1.756 7.135 8.423
80 HA2 GLY 9 HA2 GLY 9 -0.280 9.409 7.274
81 HA3 GLY 9 HA3 GLY 9 -1.974 9.129 7.249
82 H LYS 10 H LYS 10 -1.157 11.638 7.920
83 HA LYS 10 HA LYS 10 -0.897 12.035 10.799
84 HB2 LYS 10 HB2 LYS 10 -1.707 13.834 8.499
85 HB3 LYS 10 HB3 LYS 10 -1.451 14.382 10.169
86 HG2 LYS 10 HG2 LYS 10 0.820 14.159 10.047
87 HG3 LYS 10 HG3 LYS 10 0.738 12.838 8.856
88 HD2 LYS 10 HD2 LYS 10 1.603 14.682 7.666
89 HD3 LYS 10 HD3 LYS 10 -0.117 14.600 7.208
90 HE2 LYS 10 HE2 LYS 10 -0.676 16.408 8.659
91 HE3 LYS 10 HE3 LYS 10 0.925 16.368 9.435
92 HZ1 LYS 10 HZ1 LYS 10 0.238 17.299 6.724
93 HZ2 LYS 10 HZ2 LYS 10 1.798 16.920 7.141
94 HZ3 LYS 10 HZ3 LYS 10 1.000 18.134 7.941
95 H THR 11 H THR 11 -3.445 12.020 8.538
96 HA THR 11 HA THR 11 -5.551 12.266 10.621
97 HB THR 11 HB THR 11 -5.825 14.217 9.492
98 HG1 THR 11 HG1 THR 11 -7.826 13.869 8.982
99 HG21 THR 11 HG21 THR 11 -5.271 12.682 6.964
100 HG22 THR 11 HG22 THR 11 -4.388 14.056 7.631
101 HG23 THR 11 HG23 THR 11 -6.011 14.282 6.981
102 H LEU 12 H LEU 12 -4.514 10.208 8.010
103 HA LEU 12 HA LEU 12 -6.880 8.555 8.637
104 HB2 LEU 12 HB2 LEU 12 -6.905 9.384 6.325
105 HB3 LEU 12 HB3 LEU 12 -5.285 8.718 6.071
106 HG LEU 12 HG LEU 12 -6.178 6.436 6.415
107 HD11 LEU 12 HD11 LEU 12 -8.048 7.041 7.895
108 HD12 LEU 12 HD12 LEU 12 -8.569 6.057 6.527
109 HD13 LEU 12 HD13 LEU 12 -8.875 7.793 6.530
110 HD21 LEU 12 HD21 LEU 12 -7.710 8.005 4.335
111 HD22 LEU 12 HD22 LEU 12 -7.361 6.277 4.310
112 HD23 LEU 12 HD23 LEU 12 -6.047 7.444 4.164
113 H LYS 13 H LYS 13 -6.505 6.674 9.641
114 HA LYS 13 HA LYS 13 -3.873 5.402 9.184
115 HB2 LYS 13 HB2 LYS 13 -3.880 4.609 11.493
116 HB3 LYS 13 HB3 LYS 13 -3.899 6.381 11.410
117 HG2 LYS 13 HG2 LYS 13 -6.480 6.111 11.615
118 HG3 LYS 13 HG3 LYS 13 -6.080 4.487 12.226
119 HD2 LYS 13 HD2 LYS 13 -4.750 5.416 14.006
120 HD3 LYS 13 HD3 LYS 13 -4.913 7.058 13.333
121 HE2 LYS 13 HE2 LYS 13 -7.283 5.398 14.218
122 HE3 LYS 13 HE3 LYS 13 -6.402 6.484 15.317
123 HZ1 LYS 13 HZ1 LYS 13 -6.962 8.322 13.916
124 HZ2 LYS 13 HZ2 LYS 13 -8.360 7.512 14.287
125 HZ3 LYS 13 HZ3 LYS 13 -7.677 7.337 12.786
126 H GLY 14 H GLY 14 -4.019 3.134 8.536
127 HA2 GLY 14 HA2 GLY 14 -5.861 1.373 9.547
128 HA3 GLY 14 HA3 GLY 14 -6.718 1.951 8.139
129 H GLU 15 H GLU 15 -6.667 -0.183 7.502
130 HA GLU 15 HA GLU 15 -4.187 -0.875 6.044
131 HB2 GLU 15 HB2 GLU 15 -3.942 -2.189 7.974
132 HB3 GLU 15 HB3 GLU 15 -5.684 -2.520 8.061
133 HG2 GLU 15 HG2 GLU 15 -5.440 -3.858 5.948
134 HG3 GLU 15 HG3 GLU 15 -3.680 -3.660 6.107
135 H THR 16 H THR 16 -4.486 -2.154 4.107
136 HA THR 16 HA THR 16 -7.202 -3.121 3.619
137 HB THR 16 HB THR 16 -7.281 -0.837 2.610
138 HG1 THR 16 HG1 THR 16 -8.570 -2.134 1.498
139 HG21 THR 16 HG21 THR 16 -4.802 -0.841 1.987
140 HG22 THR 16 HG22 THR 16 -5.944 -0.171 0.822
141 HG23 THR 16 HG23 THR 16 -5.285 -1.788 0.581
142 H THR 17 H THR 17 -7.150 -4.376 1.434
143 HA THR 17 HA THR 17 -4.519 -5.628 1.113
144 HB THR 17 HB THR 17 -5.467 -7.856 1.229
145 HG1 THR 17 HG1 THR 17 -7.877 -6.500 1.896
146 HG21 THR 17 HG21 THR 17 -5.537 -8.088 3.490
147 HG22 THR 17 HG22 THR 17 -6.538 -6.655 3.726
148 HG23 THR 17 HG23 THR 17 -4.818 -6.481 3.385
149 H THR 18 H THR 18 -4.323 -6.844 -0.842
150 HA THR 18 HA THR 18 -6.553 -6.629 -2.738
151 HB THR 18 HB THR 18 -5.093 -4.536 -3.124
152 HG1 THR 18 HG1 THR 18 -6.411 -5.118 -4.772
153 HG21 THR 18 HG21 THR 18 -3.248 -6.150 -4.754
154 HG22 THR 18 HG22 THR 18 -2.961 -6.181 -3.014
155 HG23 THR 18 HG23 THR 18 -2.982 -4.644 -3.878
156 H LYS 19 H LYS 19 -6.177 -8.032 -4.633
157 HA LYS 19 HA LYS 19 -4.243 -10.199 -3.998
158 HB2 LYS 19 HB2 LYS 19 -6.725 -10.223 -5.753
159 HB3 LYS 19 HB3 LYS 19 -5.651 -11.603 -5.463
160 HG2 LYS 19 HG2 LYS 19 -6.682 -10.381 -3.001
161 HG3 LYS 19 HG3 LYS 19 -7.954 -11.017 -4.072
162 HD2 LYS 19 HD2 LYS 19 -5.511 -12.598 -3.221
163 HD3 LYS 19 HD3 LYS 19 -7.074 -12.651 -2.369
164 HE2 LYS 19 HE2 LYS 19 -6.979 -13.146 -5.330
165 HE3 LYS 19 HE3 LYS 19 -6.486 -14.437 -4.208
166 HZ1 LYS 19 HZ1 LYS 19 -8.737 -13.815 -3.090
167 HZ2 LYS 19 HZ2 LYS 19 -8.709 -14.829 -4.402
168 HZ3 LYS 19 HZ3 LYS 19 -9.122 -13.234 -4.597
169 H ALA 20 H ALA 20 -2.533 -10.480 -5.444
170 HA ALA 20 HA ALA 20 -2.805 -9.487 -8.110
171 HB1 ALA 20 HB1 ALA 20 -0.589 -8.213 -7.925
172 HB2 ALA 20 HB2 ALA 20 -0.820 -8.285 -6.178
173 HB3 ALA 20 HB3 ALA 20 -1.993 -7.440 -7.190
174 H VAL 21 H VAL 21 -1.191 -10.238 -9.607
175 HA VAL 21 HA VAL 21 -0.023 -12.646 -8.835
176 HB VAL 21 HB VAL 21 0.970 -12.793 -11.039
177 HG11 VAL 21 HG11 VAL 21 -1.470 -13.263 -10.589
178 HG12 VAL 21 HG12 VAL 21 -1.066 -12.866 -12.259
179 HG13 VAL 21 HG13 VAL 21 -1.817 -11.654 -11.222
180 HG21 VAL 21 HG21 VAL 21 -0.153 -10.033 -11.528
181 HG22 VAL 21 HG22 VAL 21 0.871 -10.998 -12.593
182 HG23 VAL 21 HG23 VAL 21 1.534 -10.323 -11.104
183 H ASP 22 H ASP 22 1.399 -9.438 -8.755
184 HA ASP 22 HA ASP 22 3.754 -10.623 -7.563
185 HB2 ASP 22 HB2 ASP 22 5.356 -9.603 -9.159
186 HB3 ASP 22 HB3 ASP 22 4.326 -10.821 -9.943
187 H ALA 23 H ALA 23 5.351 -8.898 -6.822
188 HA ALA 23 HA ALA 23 3.801 -7.127 -5.231
189 HB1 ALA 23 HB1 ALA 23 5.810 -7.839 -4.286
190 HB2 ALA 23 HB2 ALA 23 6.085 -6.139 -4.666
191 HB3 ALA 23 HB3 ALA 23 6.746 -7.393 -5.714
192 H GLU 24 H GLU 24 5.646 -6.594 -8.252
193 HA GLU 24 HA GLU 24 5.528 -3.685 -8.041
194 HB2 GLU 24 HB2 GLU 24 6.965 -4.980 -9.617
195 HB3 GLU 24 HB3 GLU 24 5.532 -5.538 -10.503
196 HG2 GLU 24 HG2 GLU 24 5.025 -3.073 -10.923
197 HG3 GLU 24 HG3 GLU 24 6.676 -2.753 -10.341
198 H THR 25 H THR 25 3.214 -6.011 -9.536
199 HA THR 25 HA THR 25 1.529 -3.848 -10.628
200 HB THR 25 HB THR 25 0.798 -6.737 -9.909
201 HG1 THR 25 HG1 THR 25 1.901 -7.106 -11.648
202 HG21 THR 25 HG21 THR 25 -0.733 -4.607 -11.363
203 HG22 THR 25 HG22 THR 25 -1.272 -5.684 -10.076
204 HG23 THR 25 HG23 THR 25 -0.985 -6.321 -11.696
205 H ALA 26 H ALA 26 1.606 -5.640 -7.447
206 HA ALA 26 HA ALA 26 -0.792 -4.366 -6.369
207 HB1 ALA 26 HB1 ALA 26 0.505 -6.298 -5.330
208 HB2 ALA 26 HB2 ALA 26 -0.020 -5.037 -4.216
209 HB3 ALA 26 HB3 ALA 26 1.659 -5.095 -4.753
210 H GLU 27 H GLU 27 2.605 -3.229 -6.776
211 HA GLU 27 HA GLU 27 2.253 -0.945 -5.203
212 HB2 GLU 27 HB2 GLU 27 4.444 -1.774 -5.971
213 HB3 GLU 27 HB3 GLU 27 4.065 -1.206 -7.609
214 HG2 GLU 27 HG2 GLU 27 3.761 1.104 -6.571
215 HG3 GLU 27 HG3 GLU 27 4.528 0.428 -5.116
216 H LYS 28 H LYS 28 1.728 -1.284 -8.715
217 HA LYS 28 HA LYS 28 1.012 1.475 -9.141
218 HB2 LYS 28 HB2 LYS 28 -0.038 -0.942 -10.628
219 HB3 LYS 28 HB3 LYS 28 -0.030 0.740 -11.194
220 HG2 LYS 28 HG2 LYS 28 2.383 0.750 -11.286
221 HG3 LYS 28 HG3 LYS 28 2.452 -0.881 -10.572
222 HD2 LYS 28 HD2 LYS 28 1.662 -1.901 -12.504
223 HD3 LYS 28 HD3 LYS 28 0.897 -0.408 -13.103
224 HE2 LYS 28 HE2 LYS 28 3.003 0.531 -13.705
225 HE3 LYS 28 HE3 LYS 28 3.893 -0.736 -12.830
226 HZ1 LYS 28 HZ1 LYS 28 3.029 -2.339 -14.433
227 HZ2 LYS 28 HZ2 LYS 28 3.914 -1.155 -15.186
228 HZ3 LYS 28 HZ3 LYS 28 2.258 -1.126 -15.267
229 H ALA 29 H ALA 29 -1.021 -1.354 -8.136
230 HA ALA 29 HA ALA 29 -3.498 0.222 -8.307
231 HB1 ALA 29 HB1 ALA 29 -4.516 -1.588 -7.054
232 HB2 ALA 29 HB2 ALA 29 -2.944 -2.197 -6.536
233 HB3 ALA 29 HB3 ALA 29 -3.412 -2.297 -8.234
234 H PHE 30 H PHE 30 -1.237 -0.556 -5.532
235 HA PHE 30 HA PHE 30 -2.862 0.855 -3.615
236 HB2 PHE 30 HB2 PHE 30 0.061 0.016 -3.683
237 HB3 PHE 30 HB3 PHE 30 -0.681 0.818 -2.282
238 HD1 PHE 30 HD1 PHE 30 -3.263 -0.434 -2.030
239 HD2 PHE 30 HD2 PHE 30 0.464 -2.174 -3.127
240 HE1 PHE 30 HE1 PHE 30 -4.040 -2.615 -1.194
241 HE2 PHE 30 HE2 PHE 30 -0.306 -4.356 -2.294
242 HZ PHE 30 HZ PHE 30 -2.560 -4.578 -1.324
243 H LYS 31 H LYS 31 -0.189 1.987 -5.774
244 HA LYS 31 HA LYS 31 -0.121 4.615 -4.462
245 HB2 LYS 31 HB2 LYS 31 0.593 3.713 -7.271
246 HB3 LYS 31 HB3 LYS 31 0.738 5.399 -6.735
247 HG2 LYS 31 HG2 LYS 31 2.106 4.262 -4.755
248 HG3 LYS 31 HG3 LYS 31 2.352 3.004 -5.991
249 HD2 LYS 31 HD2 LYS 31 3.123 4.813 -7.556
250 HD3 LYS 31 HD3 LYS 31 3.054 5.947 -6.184
251 HE2 LYS 31 HE2 LYS 31 4.852 4.984 -5.120
252 HE3 LYS 31 HE3 LYS 31 4.575 3.390 -5.860
253 HZ1 LYS 31 HZ1 LYS 31 5.563 5.750 -7.346
254 HZ2 LYS 31 HZ2 LYS 31 5.464 4.190 -7.901
255 HZ3 LYS 31 HZ3 LYS 31 6.550 4.577 -6.708
256 H GLN 32 H GLN 32 -2.270 3.259 -6.939
257 HA GLN 32 HA GLN 32 -3.568 5.802 -7.441
258 HB2 GLN 32 HB2 GLN 32 -3.785 4.000 -9.056
259 HB3 GLN 32 HB3 GLN 32 -4.506 2.933 -7.835
260 HG2 GLN 32 HG2 GLN 32 -6.330 4.790 -7.676
261 HG3 GLN 32 HG3 GLN 32 -5.702 5.283 -9.265
262 HE21 GLN 32 HE21 GLN 32 -8.277 4.009 -8.243
263 HE22 GLN 32 HE22 GLN 32 -8.505 2.605 -9.342
264 H TYR 33 H TYR 33 -4.356 3.117 -5.231
265 HA TYR 33 HA TYR 33 -6.773 4.279 -4.187
266 HB2 TYR 33 HB2 TYR 33 -6.028 1.920 -3.772
267 HB3 TYR 33 HB3 TYR 33 -4.652 2.535 -2.832
268 HD1 TYR 33 HD2 TYR 33 -5.150 3.825 -0.696
269 HD2 TYR 33 HD1 TYR 33 -8.107 1.560 -2.751
270 HE1 TYR 33 HE2 TYR 33 -6.525 3.781 1.343
271 HE2 TYR 33 HE1 TYR 33 -9.490 1.510 -0.718
272 HH TYR 33 HH TYR 33 -8.640 1.845 2.098
273 H ALA 34 H ALA 34 -3.406 4.637 -3.017
274 HA ALA 34 HA ALA 34 -3.970 6.403 -0.879
275 HB1 ALA 34 HB1 ALA 34 -1.740 5.236 -1.562
276 HB2 ALA 34 HB2 ALA 34 -1.695 6.806 -0.760
277 HB3 ALA 34 HB3 ALA 34 -1.485 6.702 -2.508
278 H ASN 35 H ASN 35 -3.265 7.144 -4.297
279 HA ASN 35 HA ASN 35 -3.401 10.030 -3.844
280 HB2 ASN 35 HB2 ASN 35 -2.433 8.930 -5.894
281 HB3 ASN 35 HB3 ASN 35 -4.069 8.441 -6.386
282 HD21 ASN 35 HD21 ASN 35 -4.079 9.567 -8.281
283 HD22 ASN 35 HD22 ASN 35 -4.119 11.363 -8.337
284 H ASP 36 H ASP 36 -6.000 7.657 -4.776
285 HA ASP 36 HA ASP 36 -8.005 9.696 -5.125
286 HB2 ASP 36 HB2 ASP 36 -8.268 6.766 -4.431
287 HB3 ASP 36 HB3 ASP 36 -9.660 7.836 -4.702
288 H ASN 37 H ASN 37 -6.635 8.362 -2.204
289 HA ASN 37 HA ASN 37 -8.823 9.711 -0.652
290 HB2 ASN 37 HB2 ASN 37 -6.853 7.528 0.042
291 HB3 ASN 37 HB3 ASN 37 -7.758 8.412 1.290
292 HD21 ASN 37 HD21 ASN 37 -7.930 6.183 -1.401
293 HD22 ASN 37 HD22 ASN 37 -9.599 5.607 -1.063
294 H GLY 38 H GLY 38 -5.943 10.734 -1.796
295 HA2 GLY 38 HA2 GLY 38 -4.949 12.745 -1.207
296 HA3 GLY 38 HA3 GLY 38 -5.929 12.807 0.242
297 H VAL 39 H VAL 39 -3.843 10.067 -0.241
298 HA VAL 39 HA VAL 39 -2.151 11.057 2.045
299 HB VAL 39 HB VAL 39 -2.630 8.236 1.096
300 HG11 VAL 39 HG11 VAL 39 -1.343 8.888 3.695
301 HG12 VAL 39 HG12 VAL 39 -0.369 9.081 2.239
302 HG13 VAL 39 HG13 VAL 39 -1.091 7.516 2.615
303 HG21 VAL 39 HG21 VAL 39 -3.982 7.944 3.010
304 HG22 VAL 39 HG22 VAL 39 -4.524 9.462 2.293
305 HG23 VAL 39 HG23 VAL 39 -3.474 9.481 3.708
306 H ASP 40 H ASP 40 -0.164 11.454 1.839
307 HA ASP 40 HA ASP 40 1.275 10.370 -0.526
308 HB2 ASP 40 HB2 ASP 40 0.401 12.550 -1.147
309 HB3 ASP 40 HB3 ASP 40 1.083 13.278 0.323
310 H GLY 41 H GLY 41 3.057 9.723 -0.289
311 HA2 GLY 41 HA2 GLY 41 4.987 10.772 1.716
312 HA3 GLY 41 HA3 GLY 41 4.131 9.336 2.225
313 H VAL 42 H VAL 42 6.056 8.530 2.724
314 HA VAL 42 HA VAL 42 7.766 7.796 0.462
315 HB VAL 42 HB VAL 42 8.224 7.700 3.441
316 HG11 VAL 42 HG11 VAL 42 9.235 5.747 2.247
317 HG12 VAL 42 HG12 VAL 42 10.398 6.799 3.055
318 HG13 VAL 42 HG13 VAL 42 10.196 6.889 1.306
319 HG21 VAL 42 HG21 VAL 42 10.228 9.173 2.565
320 HG22 VAL 42 HG22 VAL 42 8.638 9.873 2.866
321 HG23 VAL 42 HG23 VAL 42 9.128 9.472 1.222
322 H TRP 43 H TRP 43 8.042 5.696 -0.237
323 HA TRP 43 HA TRP 43 6.150 3.655 1.044
324 HB2 TRP 43 HB2 TRP 43 7.436 3.983 -1.703
325 HB3 TRP 43 HB3 TRP 43 6.576 2.507 -1.208
326 HD1 TRP 43 HD1 TRP 43 5.934 6.244 -1.916
327 HE1 TRP 43 HE1 TRP 43 3.417 6.587 -2.447
328 HE3 TRP 43 HE3 TRP 43 4.307 1.510 -0.887
329 HZ2 TRP 43 HZ2 TRP 43 1.078 4.993 -2.409
330 HZ3 TRP 43 HZ3 TRP 43 1.917 0.998 -1.159
331 HH2 TRP 43 HH2 TRP 43 0.337 2.705 -1.902
332 H THR 44 H THR 44 6.801 1.769 1.857
333 HA THR 44 HA THR 44 9.551 0.866 1.185
334 HB THR 44 HB THR 44 9.669 -0.140 3.543
335 HG1 THR 44 HG1 THR 44 7.534 1.695 3.897
336 HG21 THR 44 HG21 THR 44 10.941 1.895 2.839
337 HG22 THR 44 HG22 THR 44 10.575 1.797 4.562
338 HG23 THR 44 HG23 THR 44 9.637 2.870 3.522
339 H TYR 45 H TYR 45 9.764 -1.455 1.257
340 HA TYR 45 HA TYR 45 7.308 -2.987 1.392
341 HB2 TYR 45 HB2 TYR 45 7.674 -2.548 -0.962
342 HB3 TYR 45 HB3 TYR 45 9.346 -3.130 -0.814
343 HD1 TYR 45 HD1 TYR 45 6.134 -4.586 0.442
344 HD2 TYR 45 HD2 TYR 45 9.497 -5.036 -2.125
345 HE1 TYR 45 HE1 TYR 45 5.389 -6.858 -0.130
346 HE2 TYR 45 HE2 TYR 45 8.761 -7.310 -2.705
347 HH TYR 45 HH TYR 45 7.338 -9.109 -1.640
348 H ASP 46 H ASP 46 7.375 -4.866 2.454
349 HA ASP 46 HA ASP 46 10.059 -5.946 3.064
350 HB2 ASP 46 HB2 ASP 46 8.865 -5.219 5.112
351 HB3 ASP 46 HB3 ASP 46 7.471 -6.221 4.651
352 H ASP 47 H ASP 47 10.445 -7.548 1.671
353 HA ASP 47 HA ASP 47 8.335 -8.921 0.258
354 HB2 ASP 47 HB2 ASP 47 10.012 -9.865 -0.944
355 HB3 ASP 47 HB3 ASP 47 11.004 -8.627 -0.141
356 H ALA 48 H ALA 48 9.933 -9.702 3.381
357 HA ALA 48 HA ALA 48 9.159 -12.540 3.273
358 HB1 ALA 48 HB1 ALA 48 9.708 -10.638 5.607
359 HB2 ALA 48 HB2 ALA 48 10.874 -11.704 4.822
360 HB3 ALA 48 HB3 ALA 48 9.545 -12.386 5.760
361 H THR 49 H THR 49 7.451 -9.629 4.375
362 HA THR 49 HA THR 49 5.113 -11.461 5.157
363 HB THR 49 HB THR 49 4.168 -9.512 6.394
364 HG1 THR 49 HG1 THR 49 6.499 -8.118 5.544
365 HG21 THR 49 HG21 THR 49 5.377 -9.972 8.185
366 HG22 THR 49 HG22 THR 49 6.771 -9.118 7.527
367 HG23 THR 49 HG23 THR 49 6.527 -10.824 7.153
368 H LYS 50 H LYS 50 6.116 -9.766 2.475
369 HA LYS 50 HA LYS 50 5.010 -8.784 0.675
370 HB2 LYS 50 HB2 LYS 50 2.678 -10.526 1.637
371 HB3 LYS 50 HB3 LYS 50 2.794 -9.749 0.045
372 HG2 LYS 50 HG2 LYS 50 4.885 -11.693 1.019
373 HG3 LYS 50 HG3 LYS 50 3.390 -12.235 0.216
374 HD2 LYS 50 HD2 LYS 50 3.999 -10.612 -1.661
375 HD3 LYS 50 HD3 LYS 50 5.602 -10.494 -0.894
376 HE2 LYS 50 HE2 LYS 50 6.188 -12.623 -1.475
377 HE3 LYS 50 HE3 LYS 50 4.516 -13.227 -1.385
378 HZ1 LYS 50 HZ1 LYS 50 4.053 -12.215 -3.482
379 HZ2 LYS 50 HZ2 LYS 50 5.423 -13.134 -3.658
380 HZ3 LYS 50 HZ3 LYS 50 5.543 -11.484 -3.545
381 H THR 51 H THR 51 5.050 -7.196 2.884
382 HA THR 51 HA THR 51 2.480 -5.805 2.746
383 HB THR 51 HB THR 51 4.489 -5.924 4.985
384 HG1 THR 51 HG1 THR 51 1.829 -6.894 4.749
385 HG21 THR 51 HG21 THR 51 3.339 -3.704 4.780
386 HG22 THR 51 HG22 THR 51 3.054 -4.565 6.293
387 HG23 THR 51 HG23 THR 51 1.812 -4.548 5.041
388 H PHE 52 H PHE 52 2.328 -3.797 2.095
389 HA PHE 52 HA PHE 52 4.995 -2.288 1.539
390 HB2 PHE 52 HB2 PHE 52 2.107 -2.042 0.449
391 HB3 PHE 52 HB3 PHE 52 3.373 -0.821 0.192
392 HD1 PHE 52 HD2 PHE 52 5.332 -1.347 -1.184
393 HD2 PHE 52 HD1 PHE 52 2.122 -4.109 -0.744
394 HE1 PHE 52 HE2 PHE 52 6.141 -2.595 -3.145
395 HE2 PHE 52 HE1 PHE 52 2.925 -5.361 -2.704
396 HZ PHE 52 HZ PHE 52 4.937 -4.603 -3.908
397 H THR 53 H THR 53 5.108 -0.339 2.795
398 HA THR 53 HA THR 53 2.824 0.447 4.505
399 HB THR 53 HB THR 53 5.782 0.607 5.228
400 HG1 THR 53 HG1 THR 53 5.335 -1.374 5.810
401 HG21 THR 53 HG21 THR 53 5.303 1.873 7.001
402 HG22 THR 53 HG22 THR 53 3.794 1.021 7.332
403 HG23 THR 53 HG23 THR 53 3.837 2.299 6.118
404 H VAL 54 H VAL 54 2.306 2.600 4.429
405 HA VAL 54 HA VAL 54 4.333 4.345 2.938
406 HB VAL 54 HB VAL 54 2.368 4.028 1.471
407 HG11 VAL 54 HG11 VAL 54 0.143 4.603 2.080
408 HG12 VAL 54 HG12 VAL 54 0.661 5.270 3.628
409 HG13 VAL 54 HG13 VAL 54 0.754 3.533 3.341
410 HG21 VAL 54 HG21 VAL 54 1.638 6.490 1.409
411 HG22 VAL 54 HG22 VAL 54 3.357 6.139 1.234
412 HG23 VAL 54 HG23 VAL 54 2.727 6.716 2.777
413 H THR 55 H THR 55 5.065 5.834 4.333
414 HA THR 55 HA THR 55 3.455 6.495 6.770
415 HB THR 55 HB THR 55 6.468 6.490 6.409
416 HG1 THR 55 HG1 THR 55 4.824 4.761 7.954
417 HG21 THR 55 HG21 THR 55 4.967 6.781 8.990
418 HG22 THR 55 HG22 THR 55 5.620 8.145 8.082
419 HG23 THR 55 HG23 THR 55 6.702 6.904 8.711
420 H GLU 56 H GLU 56 2.802 8.546 6.891
421 HA GLU 56 HA GLU 56 3.886 10.613 4.982
422 HB2 GLU 56 HB2 GLU 56 1.454 10.416 6.791
423 HB3 GLU 56 HB3 GLU 56 1.928 11.916 5.972
424 HG2 GLU 56 HG2 GLU 56 1.727 10.790 3.803
425 HG3 GLU 56 HG3 GLU 56 1.239 9.294 4.634
Start of MODEL 18
1 H1 MET 1 H1 MET 1 -1.060 -13.068 -5.568
2 H2 MET 1 H2 MET 1 -2.124 -14.314 -5.180
3 H3 MET 1 H3 MET 1 -0.502 -14.654 -5.475
4 HA MET 1 HA MET 1 -1.181 -14.666 -3.114
5 HB2 MET 1 HB2 MET 1 1.156 -14.254 -4.198
6 HB3 MET 1 HB3 MET 1 0.904 -12.570 -3.700
7 HG2 MET 1 HG2 MET 1 2.125 -13.505 -1.953
8 HG3 MET 1 HG3 MET 1 0.447 -13.521 -1.361
9 HE1 MET 1 HE1 MET 1 3.401 -16.750 -1.930
10 HE2 MET 1 HE2 MET 1 3.395 -15.158 -2.690
11 HE3 MET 1 HE3 MET 1 2.685 -16.538 -3.528
12 H GLN 2 H GLN 2 -1.591 -13.411 -1.235
13 HA GLN 2 HA GLN 2 -3.069 -10.911 -1.810
14 HB2 GLN 2 HB2 GLN 2 -2.951 -12.922 0.406
15 HB3 GLN 2 HB3 GLN 2 -3.273 -11.242 0.877
16 HG2 GLN 2 HG2 GLN 2 -5.291 -11.171 -0.270
17 HG3 GLN 2 HG3 GLN 2 -4.862 -12.545 -1.316
18 HE21 GLN 2 HE21 GLN 2 -7.292 -12.266 0.098
19 HE22 GLN 2 HE22 GLN 2 -7.361 -13.587 1.315
20 H TYR 3 H TYR 3 -2.359 -8.945 -1.287
21 HA TYR 3 HA TYR 3 0.143 -8.588 0.255
22 HB2 TYR 3 HB2 TYR 3 -0.824 -6.905 -2.052
23 HB3 TYR 3 HB3 TYR 3 0.577 -6.527 -1.025
24 HD1 TYR 3 HD1 TYR 3 -0.767 -9.204 -3.265
25 HD2 TYR 3 HD2 TYR 3 2.681 -7.325 -1.622
26 HE1 TYR 3 HE1 TYR 3 0.667 -10.562 -4.729
27 HE2 TYR 3 HE2 TYR 3 4.122 -8.679 -3.084
28 HH TYR 3 HH TYR 3 3.963 -9.911 -5.202
29 H LYS 4 H LYS 4 0.202 -6.809 1.731
30 HA LYS 4 HA LYS 4 -2.416 -5.612 2.301
31 HB2 LYS 4 HB2 LYS 4 -0.165 -6.406 4.155
32 HB3 LYS 4 HB3 LYS 4 -1.564 -5.436 4.661
33 HG2 LYS 4 HG2 LYS 4 -3.043 -7.319 3.933
34 HG3 LYS 4 HG3 LYS 4 -1.577 -8.287 3.643
35 HD2 LYS 4 HD2 LYS 4 -2.254 -6.992 6.299
36 HD3 LYS 4 HD3 LYS 4 -2.673 -8.670 5.876
37 HE2 LYS 4 HE2 LYS 4 -0.363 -9.264 5.646
38 HE3 LYS 4 HE3 LYS 4 0.146 -7.566 5.793
39 HZ1 LYS 4 HZ1 LYS 4 -0.183 -7.591 8.029
40 HZ2 LYS 4 HZ2 LYS 4 0.216 -9.187 7.826
41 HZ3 LYS 4 HZ3 LYS 4 -1.374 -8.746 7.989
42 H LEU 5 H LEU 5 -2.561 -3.456 2.830
43 HA LEU 5 HA LEU 5 0.035 -1.872 2.532
44 HB2 LEU 5 HB2 LEU 5 -1.419 -1.403 0.634
45 HB3 LEU 5 HB3 LEU 5 -2.816 -1.151 1.690
46 HG LEU 5 HG LEU 5 -1.554 0.813 2.702
47 HD11 LEU 5 HD11 LEU 5 0.686 0.318 2.048
48 HD12 LEU 5 HD12 LEU 5 0.199 1.782 1.197
49 HD13 LEU 5 HD13 LEU 5 0.240 0.240 0.344
50 HD21 LEU 5 HD21 LEU 5 -2.260 2.307 0.993
51 HD22 LEU 5 HD22 LEU 5 -3.375 0.941 0.966
52 HD23 LEU 5 HD23 LEU 5 -2.109 1.068 -0.253
53 H VAL 6 H VAL 6 0.425 -0.833 4.424
54 HA VAL 6 HA VAL 6 -1.689 -0.321 6.374
55 HB VAL 6 HB VAL 6 1.310 -0.388 6.831
56 HG11 VAL 6 HG11 VAL 6 0.911 0.130 9.083
57 HG12 VAL 6 HG12 VAL 6 -0.819 -0.189 8.950
58 HG13 VAL 6 HG13 VAL 6 -0.126 1.244 8.192
59 HG21 VAL 6 HG21 VAL 6 -0.878 -2.368 7.362
60 HG22 VAL 6 HG22 VAL 6 0.540 -2.308 8.410
61 HG23 VAL 6 HG23 VAL 6 0.731 -2.623 6.685
62 H ILE 7 H ILE 7 -2.336 1.728 6.609
63 HA ILE 7 HA ILE 7 -0.551 3.864 5.261
64 HB ILE 7 HB ILE 7 -3.537 3.983 5.930
65 HG12 ILE 7 HG12 ILE 7 -2.132 3.929 3.232
66 HG13 ILE 7 HG13 ILE 7 -2.914 2.520 3.982
67 HG21 ILE 7 HG21 ILE 7 -3.200 6.096 4.424
68 HG22 ILE 7 HG22 ILE 7 -1.528 5.984 4.974
69 HG23 ILE 7 HG23 ILE 7 -2.834 6.166 6.146
70 HD11 ILE 7 HD11 ILE 7 -4.342 3.568 2.311
71 HD12 ILE 7 HD12 ILE 7 -4.284 5.092 3.197
72 HD13 ILE 7 HD13 ILE 7 -5.057 3.681 3.919
73 H ASN 8 H ASN 8 0.635 4.871 6.749
74 HA ASN 8 HA ASN 8 -0.544 5.355 9.493
75 HB2 ASN 8 HB2 ASN 8 1.547 3.939 9.333
76 HB3 ASN 8 HB3 ASN 8 2.396 5.347 8.658
77 HD21 ASN 8 HD21 ASN 8 3.851 5.281 10.404
78 HD22 ASN 8 HD22 ASN 8 3.363 5.908 12.017
79 H GLY 9 H GLY 9 -1.756 7.135 8.423
80 HA2 GLY 9 HA2 GLY 9 -0.280 9.409 7.274
81 HA3 GLY 9 HA3 GLY 9 -1.974 9.129 7.249
82 H LYS 10 H LYS 10 -1.157 11.638 7.920
83 HA LYS 10 HA LYS 10 -0.897 12.035 10.799
84 HB2 LYS 10 HB2 LYS 10 -1.707 13.834 8.500
85 HB3 LYS 10 HB3 LYS 10 -1.451 14.382 10.169
86 HG2 LYS 10 HG2 LYS 10 0.821 14.158 10.046
87 HG3 LYS 10 HG3 LYS 10 0.738 12.838 8.855
88 HD2 LYS 10 HD2 LYS 10 1.603 14.682 7.665
89 HD3 LYS 10 HD3 LYS 10 -0.117 14.600 7.208
90 HE2 LYS 10 HE2 LYS 10 -0.676 16.408 8.659
91 HE3 LYS 10 HE3 LYS 10 0.925 16.368 9.435
92 HZ1 LYS 10 HZ1 LYS 10 0.237 17.299 6.723
93 HZ2 LYS 10 HZ2 LYS 10 1.797 16.920 7.140
94 HZ3 LYS 10 HZ3 LYS 10 1.000 18.134 7.940
95 H THR 11 H THR 11 -3.445 12.020 8.538
96 HA THR 11 HA THR 11 -5.551 12.266 10.621
97 HB THR 11 HB THR 11 -5.473 13.461 7.912
98 HG1 THR 11 HG1 THR 11 -5.508 15.223 9.045
99 HG21 THR 11 HG21 THR 11 -7.894 12.762 9.557
100 HG22 THR 11 HG22 THR 11 -7.572 12.389 7.863
101 HG23 THR 11 HG23 THR 11 -7.880 14.054 8.357
102 H LEU 12 H LEU 12 -4.514 10.208 8.010
103 HA LEU 12 HA LEU 12 -6.880 8.555 8.637
104 HB2 LEU 12 HB2 LEU 12 -6.905 9.384 6.325
105 HB3 LEU 12 HB3 LEU 12 -5.285 8.719 6.071
106 HG LEU 12 HG LEU 12 -6.176 6.436 6.415
107 HD11 LEU 12 HD11 LEU 12 -8.047 7.040 7.895
108 HD12 LEU 12 HD12 LEU 12 -8.568 6.055 6.526
109 HD13 LEU 12 HD13 LEU 12 -8.875 7.792 6.530
110 HD21 LEU 12 HD21 LEU 12 -7.710 8.004 4.335
111 HD22 LEU 12 HD22 LEU 12 -7.360 6.276 4.309
112 HD23 LEU 12 HD23 LEU 12 -6.047 7.444 4.164
113 H LYS 13 H LYS 13 -6.505 6.674 9.641
114 HA LYS 13 HA LYS 13 -3.873 5.402 9.184
115 HB2 LYS 13 HB2 LYS 13 -5.415 5.481 11.772
116 HB3 LYS 13 HB3 LYS 13 -3.900 4.600 11.500
117 HG2 LYS 13 HG2 LYS 13 -2.957 6.933 10.834
118 HG3 LYS 13 HG3 LYS 13 -4.375 7.557 11.714
119 HD2 LYS 13 HD2 LYS 13 -3.692 6.434 13.733
120 HD3 LYS 13 HD3 LYS 13 -2.379 5.590 12.875
121 HE2 LYS 13 HE2 LYS 13 -2.552 8.605 13.064
122 HE3 LYS 13 HE3 LYS 13 -1.714 7.609 14.276
123 HZ1 LYS 13 HZ1 LYS 13 -0.247 6.816 12.581
124 HZ2 LYS 13 HZ2 LYS 13 -0.241 8.473 12.533
125 HZ3 LYS 13 HZ3 LYS 13 -1.077 7.616 11.385
126 H GLY 14 H GLY 14 -4.019 3.134 8.536
127 HA2 GLY 14 HA2 GLY 14 -5.861 1.373 9.547
128 HA3 GLY 14 HA3 GLY 14 -6.718 1.951 8.139
129 H GLU 15 H GLU 15 -6.667 -0.183 7.502
130 HA GLU 15 HA GLU 15 -4.187 -0.875 6.044
131 HB2 GLU 15 HB2 GLU 15 -3.939 -2.191 7.972
132 HB3 GLU 15 HB3 GLU 15 -5.682 -2.518 8.064
133 HG2 GLU 15 HG2 GLU 15 -5.447 -3.858 5.950
134 HG3 GLU 15 HG3 GLU 15 -3.686 -3.664 6.104
135 H THR 16 H THR 16 -4.486 -2.154 4.107
136 HA THR 16 HA THR 16 -7.202 -3.121 3.619
137 HB THR 16 HB THR 16 -7.279 -0.836 2.610
138 HG1 THR 16 HG1 THR 16 -8.571 -2.132 1.501
139 HG21 THR 16 HG21 THR 16 -4.801 -0.843 1.984
140 HG22 THR 16 HG22 THR 16 -5.944 -0.173 0.820
141 HG23 THR 16 HG23 THR 16 -5.287 -1.791 0.579
142 H THR 17 H THR 17 -7.150 -4.376 1.434
143 HA THR 17 HA THR 17 -4.519 -5.628 1.113
144 HB THR 17 HB THR 17 -5.923 -6.912 2.780
145 HG1 THR 17 HG1 THR 17 -5.172 -8.180 0.346
146 HG21 THR 17 HG21 THR 17 -7.833 -8.000 2.195
147 HG22 THR 17 HG22 THR 17 -7.435 -8.026 0.477
148 HG23 THR 17 HG23 THR 17 -8.021 -6.540 1.223
149 H THR 18 H THR 18 -4.323 -6.844 -0.842
150 HA THR 18 HA THR 18 -6.553 -6.629 -2.738
151 HB THR 18 HB THR 18 -5.090 -4.536 -3.123
152 HG1 THR 18 HG1 THR 18 -6.413 -5.114 -4.769
153 HG21 THR 18 HG21 THR 18 -3.252 -6.151 -4.758
154 HG22 THR 18 HG22 THR 18 -2.961 -6.185 -3.018
155 HG23 THR 18 HG23 THR 18 -2.981 -4.647 -3.881
156 H LYS 19 H LYS 19 -6.177 -8.032 -4.633
157 HA LYS 19 HA LYS 19 -4.243 -10.199 -3.998
158 HB2 LYS 19 HB2 LYS 19 -6.725 -10.223 -5.753
159 HB3 LYS 19 HB3 LYS 19 -5.651 -11.603 -5.463
160 HG2 LYS 19 HG2 LYS 19 -6.681 -10.382 -3.001
161 HG3 LYS 19 HG3 LYS 19 -7.954 -11.017 -4.072
162 HD2 LYS 19 HD2 LYS 19 -5.510 -12.599 -3.222
163 HD3 LYS 19 HD3 LYS 19 -7.073 -12.652 -2.369
164 HE2 LYS 19 HE2 LYS 19 -6.979 -13.146 -5.330
165 HE3 LYS 19 HE3 LYS 19 -6.486 -14.438 -4.210
166 HZ1 LYS 19 HZ1 LYS 19 -8.736 -13.816 -3.090
167 HZ2 LYS 19 HZ2 LYS 19 -8.708 -14.830 -4.403
168 HZ3 LYS 19 HZ3 LYS 19 -9.121 -13.235 -4.597
169 H ALA 20 H ALA 20 -2.533 -10.480 -5.444
170 HA ALA 20 HA ALA 20 -2.805 -9.487 -8.110
171 HB1 ALA 20 HB1 ALA 20 -0.589 -8.213 -7.925
172 HB2 ALA 20 HB2 ALA 20 -0.820 -8.285 -6.178
173 HB3 ALA 20 HB3 ALA 20 -1.993 -7.440 -7.190
174 H VAL 21 H VAL 21 -1.191 -10.238 -9.607
175 HA VAL 21 HA VAL 21 -0.023 -12.646 -8.835
176 HB VAL 21 HB VAL 21 0.967 -12.796 -11.039
177 HG11 VAL 21 HG11 VAL 21 -1.476 -13.255 -10.590
178 HG12 VAL 21 HG12 VAL 21 -1.069 -12.860 -12.260
179 HG13 VAL 21 HG13 VAL 21 -1.815 -11.644 -11.224
180 HG21 VAL 21 HG21 VAL 21 -0.144 -10.031 -11.529
181 HG22 VAL 21 HG22 VAL 21 0.876 -11.001 -12.592
182 HG23 VAL 21 HG23 VAL 21 1.542 -10.329 -11.103
183 H ASP 22 H ASP 22 1.399 -9.438 -8.755
184 HA ASP 22 HA ASP 22 3.754 -10.623 -7.563
185 HB2 ASP 22 HB2 ASP 22 5.357 -9.605 -9.159
186 HB3 ASP 22 HB3 ASP 22 4.325 -10.820 -9.945
187 H ALA 23 H ALA 23 5.351 -8.898 -6.822
188 HA ALA 23 HA ALA 23 3.801 -7.127 -5.231
189 HB1 ALA 23 HB1 ALA 23 5.810 -7.839 -4.286
190 HB2 ALA 23 HB2 ALA 23 6.085 -6.139 -4.666
191 HB3 ALA 23 HB3 ALA 23 6.746 -7.393 -5.714
192 H GLU 24 H GLU 24 5.646 -6.594 -8.252
193 HA GLU 24 HA GLU 24 5.528 -3.685 -8.041
194 HB2 GLU 24 HB2 GLU 24 5.724 -5.694 -10.348
195 HB3 GLU 24 HB3 GLU 24 5.697 -3.946 -10.649
196 HG2 GLU 24 HG2 GLU 24 7.651 -3.791 -9.015
197 HG3 GLU 24 HG3 GLU 24 7.754 -5.562 -9.150
198 H THR 25 H THR 25 3.214 -6.011 -9.536
199 HA THR 25 HA THR 25 1.529 -3.848 -10.628
200 HB THR 25 HB THR 25 0.796 -6.737 -9.908
201 HG1 THR 25 HG1 THR 25 1.902 -7.107 -11.646
202 HG21 THR 25 HG21 THR 25 -0.731 -4.606 -11.366
203 HG22 THR 25 HG22 THR 25 -1.273 -5.683 -10.079
204 HG23 THR 25 HG23 THR 25 -0.984 -6.320 -11.698
205 H ALA 26 H ALA 26 1.606 -5.640 -7.447
206 HA ALA 26 HA ALA 26 -0.792 -4.366 -6.369
207 HB1 ALA 26 HB1 ALA 26 0.505 -6.298 -5.330
208 HB2 ALA 26 HB2 ALA 26 -0.020 -5.037 -4.216
209 HB3 ALA 26 HB3 ALA 26 1.659 -5.095 -4.753
210 H GLU 27 H GLU 27 2.605 -3.229 -6.776
211 HA GLU 27 HA GLU 27 2.253 -0.945 -5.203
212 HB2 GLU 27 HB2 GLU 27 4.444 -1.775 -5.973
213 HB3 GLU 27 HB3 GLU 27 4.065 -1.204 -7.610
214 HG2 GLU 27 HG2 GLU 27 3.762 1.104 -6.567
215 HG3 GLU 27 HG3 GLU 27 4.529 0.424 -5.113
216 H LYS 28 H LYS 28 1.728 -1.284 -8.715
217 HA LYS 28 HA LYS 28 1.012 1.475 -9.141
218 HB2 LYS 28 HB2 LYS 28 -0.042 -0.940 -10.628
219 HB3 LYS 28 HB3 LYS 28 -0.026 0.742 -11.195
220 HG2 LYS 28 HG2 LYS 28 2.387 0.741 -11.284
221 HG3 LYS 28 HG3 LYS 28 2.448 -0.890 -10.569
222 HD2 LYS 28 HD2 LYS 28 1.656 -1.906 -12.502
223 HD3 LYS 28 HD3 LYS 28 0.899 -0.410 -13.102
224 HE2 LYS 28 HE2 LYS 28 3.010 0.520 -13.702
225 HE3 LYS 28 HE3 LYS 28 3.893 -0.751 -12.825
226 HZ1 LYS 28 HZ1 LYS 28 3.024 -2.351 -14.429
227 HZ2 LYS 28 HZ2 LYS 28 3.916 -1.171 -15.181
228 HZ3 LYS 28 HZ3 LYS 28 2.260 -1.134 -15.264
229 H ALA 29 H ALA 29 -1.021 -1.354 -8.136
230 HA ALA 29 HA ALA 29 -3.498 0.222 -8.307
231 HB1 ALA 29 HB1 ALA 29 -4.516 -1.588 -7.054
232 HB2 ALA 29 HB2 ALA 29 -2.944 -2.197 -6.536
233 HB3 ALA 29 HB3 ALA 29 -3.412 -2.297 -8.234
234 H PHE 30 H PHE 30 -1.237 -0.556 -5.532
235 HA PHE 30 HA PHE 30 -2.862 0.855 -3.615
236 HB2 PHE 30 HB2 PHE 30 0.062 0.018 -3.682
237 HB3 PHE 30 HB3 PHE 30 -0.683 0.817 -2.281
238 HD1 PHE 30 HD1 PHE 30 -3.263 -0.440 -2.034
239 HD2 PHE 30 HD2 PHE 30 0.468 -2.172 -3.129
240 HE1 PHE 30 HE1 PHE 30 -4.038 -2.623 -1.202
241 HE2 PHE 30 HE2 PHE 30 -0.300 -4.356 -2.301
242 HZ PHE 30 HZ PHE 30 -2.555 -4.584 -1.333
243 H LYS 31 H LYS 31 -0.189 1.987 -5.774
244 HA LYS 31 HA LYS 31 -0.121 4.615 -4.462
245 HB2 LYS 31 HB2 LYS 31 0.593 3.712 -7.270
246 HB3 LYS 31 HB3 LYS 31 0.737 5.398 -6.736
247 HG2 LYS 31 HG2 LYS 31 2.105 4.266 -4.755
248 HG3 LYS 31 HG3 LYS 31 2.353 3.006 -5.989
249 HD2 LYS 31 HD2 LYS 31 3.123 4.814 -7.556
250 HD3 LYS 31 HD3 LYS 31 3.052 5.950 -6.185
251 HE2 LYS 31 HE2 LYS 31 4.851 4.990 -5.119
252 HE3 LYS 31 HE3 LYS 31 4.576 3.395 -5.858
253 HZ1 LYS 31 HZ1 LYS 31 5.562 5.754 -7.346
254 HZ2 LYS 31 HZ2 LYS 31 5.465 4.194 -7.900
255 HZ3 LYS 31 HZ3 LYS 31 6.550 4.582 -6.707
256 H GLN 32 H GLN 32 -2.270 3.259 -6.939
257 HA GLN 32 HA GLN 32 -3.568 5.802 -7.441
258 HB2 GLN 32 HB2 GLN 32 -3.784 3.999 -9.056
259 HB3 GLN 32 HB3 GLN 32 -4.506 2.933 -7.835
260 HG2 GLN 32 HG2 GLN 32 -6.149 3.871 -9.429
261 HG3 GLN 32 HG3 GLN 32 -6.487 4.292 -7.734
262 HE21 GLN 32 HE21 GLN 32 -7.782 5.777 -9.431
263 HE22 GLN 32 HE22 GLN 32 -7.026 7.396 -9.627
264 H TYR 33 H TYR 33 -4.356 3.117 -5.231
265 HA TYR 33 HA TYR 33 -6.773 4.279 -4.187
266 HB2 TYR 33 HB2 TYR 33 -6.029 1.920 -3.772
267 HB3 TYR 33 HB3 TYR 33 -4.652 2.534 -2.832
268 HD1 TYR 33 HD2 TYR 33 -5.149 3.825 -0.696
269 HD2 TYR 33 HD1 TYR 33 -8.107 1.560 -2.750
270 HE1 TYR 33 HE2 TYR 33 -6.523 3.781 1.343
271 HE2 TYR 33 HE1 TYR 33 -9.490 1.511 -0.716
272 HH TYR 33 HH TYR 33 -8.638 1.846 2.098
273 H ALA 34 H ALA 34 -3.406 4.637 -3.017
274 HA ALA 34 HA ALA 34 -3.970 6.403 -0.879
275 HB1 ALA 34 HB1 ALA 34 -1.740 5.236 -1.562
276 HB2 ALA 34 HB2 ALA 34 -1.695 6.806 -0.760
277 HB3 ALA 34 HB3 ALA 34 -1.485 6.702 -2.508
278 H ASN 35 H ASN 35 -3.265 7.144 -4.297
279 HA ASN 35 HA ASN 35 -3.401 10.030 -3.844
280 HB2 ASN 35 HB2 ASN 35 -2.433 8.930 -5.894
281 HB3 ASN 35 HB3 ASN 35 -4.069 8.441 -6.386
282 HD21 ASN 35 HD21 ASN 35 -3.656 9.595 -8.342
283 HD22 ASN 35 HD22 ASN 35 -3.863 11.380 -8.374
284 H ASP 36 H ASP 36 -6.000 7.657 -4.776
285 HA ASP 36 HA ASP 36 -8.005 9.696 -5.125
286 HB2 ASP 36 HB2 ASP 36 -8.266 6.765 -4.433
287 HB3 ASP 36 HB3 ASP 36 -9.660 7.835 -4.700
288 H ASN 37 H ASN 37 -6.635 8.362 -2.204
289 HA ASN 37 HA ASN 37 -8.823 9.711 -0.652
290 HB2 ASN 37 HB2 ASN 37 -6.853 7.528 0.041
291 HB3 ASN 37 HB3 ASN 37 -7.757 8.412 1.290
292 HD21 ASN 37 HD21 ASN 37 -7.932 6.183 -1.401
293 HD22 ASN 37 HD22 ASN 37 -9.601 5.608 -1.062
294 H GLY 38 H GLY 38 -5.943 10.734 -1.796
295 HA2 GLY 38 HA2 GLY 38 -4.949 12.745 -1.207
296 HA3 GLY 38 HA3 GLY 38 -5.929 12.807 0.242
297 H VAL 39 H VAL 39 -3.843 10.067 -0.241
298 HA VAL 39 HA VAL 39 -2.151 11.057 2.045
299 HB VAL 39 HB VAL 39 -2.629 8.236 1.096
300 HG11 VAL 39 HG11 VAL 39 -1.344 8.888 3.696
301 HG12 VAL 39 HG12 VAL 39 -0.369 9.082 2.240
302 HG13 VAL 39 HG13 VAL 39 -1.091 7.517 2.616
303 HG21 VAL 39 HG21 VAL 39 -3.982 7.944 3.009
304 HG22 VAL 39 HG22 VAL 39 -4.524 9.462 2.292
305 HG23 VAL 39 HG23 VAL 39 -3.475 9.481 3.707
306 H ASP 40 H ASP 40 -0.164 11.454 1.839
307 HA ASP 40 HA ASP 40 1.275 10.370 -0.526
308 HB2 ASP 40 HB2 ASP 40 0.399 12.551 -1.144
309 HB3 ASP 40 HB3 ASP 40 1.086 13.278 0.324
310 H GLY 41 H GLY 41 3.057 9.723 -0.289
311 HA2 GLY 41 HA2 GLY 41 4.987 10.772 1.716
312 HA3 GLY 41 HA3 GLY 41 4.131 9.336 2.225
313 H VAL 42 H VAL 42 6.056 8.530 2.724
314 HA VAL 42 HA VAL 42 7.766 7.796 0.462
315 HB VAL 42 HB VAL 42 8.224 7.701 3.441
316 HG11 VAL 42 HG11 VAL 42 9.234 5.747 2.249
317 HG12 VAL 42 HG12 VAL 42 10.397 6.799 3.056
318 HG13 VAL 42 HG13 VAL 42 10.195 6.887 1.307
319 HG21 VAL 42 HG21 VAL 42 10.228 9.172 2.564
320 HG22 VAL 42 HG22 VAL 42 8.639 9.874 2.865
321 HG23 VAL 42 HG23 VAL 42 9.129 9.471 1.221
322 H TRP 43 H TRP 43 8.042 5.696 -0.237
323 HA TRP 43 HA TRP 43 6.150 3.655 1.044
324 HB2 TRP 43 HB2 TRP 43 7.435 3.985 -1.703
325 HB3 TRP 43 HB3 TRP 43 6.579 2.507 -1.209
326 HD1 TRP 43 HD1 TRP 43 5.929 6.243 -1.915
327 HE1 TRP 43 HE1 TRP 43 3.411 6.581 -2.445
328 HE3 TRP 43 HE3 TRP 43 4.311 1.505 -0.887
329 HZ2 TRP 43 HZ2 TRP 43 1.075 4.983 -2.406
330 HZ3 TRP 43 HZ3 TRP 43 1.922 0.988 -1.158
331 HH2 TRP 43 HH2 TRP 43 0.338 2.692 -1.901
332 H THR 44 H THR 44 6.801 1.769 1.857
333 HA THR 44 HA THR 44 9.551 0.866 1.185
334 HB THR 44 HB THR 44 9.665 -0.141 3.544
335 HG1 THR 44 HG1 THR 44 7.538 1.703 3.895
336 HG21 THR 44 HG21 THR 44 10.945 1.887 2.838
337 HG22 THR 44 HG22 THR 44 10.579 1.793 4.561
338 HG23 THR 44 HG23 THR 44 9.646 2.868 3.519
339 H TYR 45 H TYR 45 9.764 -1.455 1.257
340 HA TYR 45 HA TYR 45 7.308 -2.987 1.392
341 HB2 TYR 45 HB2 TYR 45 7.676 -2.547 -0.962
342 HB3 TYR 45 HB3 TYR 45 9.347 -3.132 -0.814
343 HD1 TYR 45 HD1 TYR 45 6.131 -4.582 0.441
344 HD2 TYR 45 HD2 TYR 45 9.494 -5.038 -2.125
345 HE1 TYR 45 HE1 TYR 45 5.381 -6.852 -0.131
346 HE2 TYR 45 HE2 TYR 45 8.753 -7.311 -2.705
347 HH TYR 45 HH TYR 45 7.326 -9.107 -1.641
348 H ASP 46 H ASP 46 7.375 -4.866 2.454
349 HA ASP 46 HA ASP 46 10.059 -5.946 3.064
350 HB2 ASP 46 HB2 ASP 46 8.865 -5.219 5.112
351 HB3 ASP 46 HB3 ASP 46 7.471 -6.221 4.651
352 H ASP 47 H ASP 47 10.445 -7.548 1.671
353 HA ASP 47 HA ASP 47 8.335 -8.921 0.258
354 HB2 ASP 47 HB2 ASP 47 10.706 -8.631 -0.543
355 HB3 ASP 47 HB3 ASP 47 11.204 -9.852 0.649
356 H ALA 48 H ALA 48 9.933 -9.702 3.381
357 HA ALA 48 HA ALA 48 9.159 -12.540 3.273
358 HB1 ALA 48 HB1 ALA 48 9.708 -10.638 5.607
359 HB2 ALA 48 HB2 ALA 48 10.874 -11.704 4.822
360 HB3 ALA 48 HB3 ALA 48 9.545 -12.386 5.760
361 H THR 49 H THR 49 7.451 -9.629 4.375
362 HA THR 49 HA THR 49 5.113 -11.461 5.157
363 HB THR 49 HB THR 49 4.167 -9.510 6.392
364 HG1 THR 49 HG1 THR 49 6.503 -8.121 5.547
365 HG21 THR 49 HG21 THR 49 5.372 -9.973 8.185
366 HG22 THR 49 HG22 THR 49 6.769 -9.122 7.529
367 HG23 THR 49 HG23 THR 49 6.522 -10.827 7.154
368 H LYS 50 H LYS 50 6.116 -9.766 2.475
369 HA LYS 50 HA LYS 50 5.010 -8.784 0.675
370 HB2 LYS 50 HB2 LYS 50 2.677 -10.524 1.636
371 HB3 LYS 50 HB3 LYS 50 2.796 -9.750 0.044
372 HG2 LYS 50 HG2 LYS 50 4.883 -11.694 1.023
373 HG3 LYS 50 HG3 LYS 50 3.389 -12.236 0.218
374 HD2 LYS 50 HD2 LYS 50 4.003 -10.616 -1.660
375 HD3 LYS 50 HD3 LYS 50 5.605 -10.499 -0.890
376 HE2 LYS 50 HE2 LYS 50 6.189 -12.629 -1.467
377 HE3 LYS 50 HE3 LYS 50 4.517 -13.232 -1.379
378 HZ1 LYS 50 HZ1 LYS 50 4.059 -12.222 -3.478
379 HZ2 LYS 50 HZ2 LYS 50 5.428 -13.143 -3.650
380 HZ3 LYS 50 HZ3 LYS 50 5.549 -11.492 -3.540
381 H THR 51 H THR 51 5.050 -7.196 2.884
382 HA THR 51 HA THR 51 2.480 -5.805 2.746
383 HB THR 51 HB THR 51 4.489 -5.927 4.985
384 HG1 THR 51 HG1 THR 51 1.825 -6.888 4.749
385 HG21 THR 51 HG21 THR 51 3.346 -3.704 4.780
386 HG22 THR 51 HG22 THR 51 3.058 -4.564 6.293
387 HG23 THR 51 HG23 THR 51 1.816 -4.542 5.041
388 H PHE 52 H PHE 52 2.328 -3.797 2.095
389 HA PHE 52 HA PHE 52 4.995 -2.288 1.539
390 HB2 PHE 52 HB2 PHE 52 2.107 -2.045 0.448
391 HB3 PHE 52 HB3 PHE 52 3.370 -0.820 0.193
392 HD1 PHE 52 HD2 PHE 52 5.332 -1.340 -1.181
393 HD2 PHE 52 HD1 PHE 52 2.128 -4.110 -0.747
394 HE1 PHE 52 HE2 PHE 52 6.145 -2.584 -3.144
395 HE2 PHE 52 HE1 PHE 52 2.936 -5.358 -2.709
396 HZ PHE 52 HZ PHE 52 4.947 -4.594 -3.910
397 H THR 53 H THR 53 5.108 -0.339 2.795
398 HA THR 53 HA THR 53 2.824 0.447 4.505
399 HB THR 53 HB THR 53 5.782 0.608 5.228
400 HG1 THR 53 HG1 THR 53 5.336 -1.374 5.809
401 HG21 THR 53 HG21 THR 53 5.302 1.873 7.002
402 HG22 THR 53 HG22 THR 53 3.794 1.020 7.332
403 HG23 THR 53 HG23 THR 53 3.835 2.298 6.119
404 H VAL 54 H VAL 54 2.306 2.600 4.429
405 HA VAL 54 HA VAL 54 4.333 4.345 2.938
406 HB VAL 54 HB VAL 54 2.368 4.028 1.471
407 HG11 VAL 54 HG11 VAL 54 0.142 4.604 2.080
408 HG12 VAL 54 HG12 VAL 54 0.662 5.272 3.628
409 HG13 VAL 54 HG13 VAL 54 0.754 3.535 3.342
410 HG21 VAL 54 HG21 VAL 54 1.639 6.490 1.408
411 HG22 VAL 54 HG22 VAL 54 3.357 6.137 1.232
412 HG23 VAL 54 HG23 VAL 54 2.729 6.716 2.775
413 H THR 55 H THR 55 5.065 5.834 4.333
414 HA THR 55 HA THR 55 3.455 6.495 6.770
415 HB THR 55 HB THR 55 6.469 6.493 6.410
416 HG1 THR 55 HG1 THR 55 4.826 4.757 7.949
417 HG21 THR 55 HG21 THR 55 4.964 6.775 8.991
418 HG22 THR 55 HG22 THR 55 5.616 8.142 8.087
419 HG23 THR 55 HG23 THR 55 6.700 6.901 8.713
420 H GLU 56 H GLU 56 2.802 8.546 6.891
421 HA GLU 56 HA GLU 56 3.886 10.613 4.982
422 HB2 GLU 56 HB2 GLU 56 1.454 10.416 6.791
423 HB3 GLU 56 HB3 GLU 56 1.928 11.916 5.972
424 HG2 GLU 56 HG2 GLU 56 1.739 10.772 3.802
425 HG3 GLU 56 HG3 GLU 56 1.221 9.293 4.646
Start of MODEL 19
1 H1 MET 1 H1 MET 1 -1.060 -13.068 -5.568
2 H2 MET 1 H2 MET 1 -2.124 -14.314 -5.180
3 H3 MET 1 H3 MET 1 -0.502 -14.654 -5.475
4 HA MET 1 HA MET 1 -1.181 -14.666 -3.114
5 HB2 MET 1 HB2 MET 1 1.156 -14.252 -4.200
6 HB3 MET 1 HB3 MET 1 0.904 -12.569 -3.698
7 HG2 MET 1 HG2 MET 1 2.077 -13.424 -1.915
8 HG3 MET 1 HG3 MET 1 0.396 -13.615 -1.364
9 HE1 MET 1 HE1 MET 1 1.220 -16.626 0.324
10 HE2 MET 1 HE2 MET 1 1.398 -14.872 0.359
11 HE3 MET 1 HE3 MET 1 2.803 -15.895 0.059
12 H GLN 2 H GLN 2 -1.591 -13.411 -1.235
13 HA GLN 2 HA GLN 2 -3.069 -10.911 -1.810
14 HB2 GLN 2 HB2 GLN 2 -4.142 -12.578 -0.336
15 HB3 GLN 2 HB3 GLN 2 -2.720 -12.571 0.726
16 HG2 GLN 2 HG2 GLN 2 -3.168 -10.141 1.163
17 HG3 GLN 2 HG3 GLN 2 -4.693 -10.326 0.266
18 HE21 GLN 2 HE21 GLN 2 -4.272 -9.570 3.041
19 HE22 GLN 2 HE22 GLN 2 -5.131 -10.807 4.023
20 H TYR 3 H TYR 3 -2.359 -8.945 -1.287
21 HA TYR 3 HA TYR 3 0.143 -8.588 0.255
22 HB2 TYR 3 HB2 TYR 3 -0.824 -6.902 -2.050
23 HB3 TYR 3 HB3 TYR 3 0.580 -6.529 -1.025
24 HD1 TYR 3 HD1 TYR 3 -0.776 -9.199 -3.267
25 HD2 TYR 3 HD2 TYR 3 2.680 -7.332 -1.627
26 HE1 TYR 3 HE1 TYR 3 0.652 -10.559 -4.735
27 HE2 TYR 3 HE2 TYR 3 4.115 -8.687 -3.094
28 HH TYR 3 HH TYR 3 3.949 -9.916 -5.213
29 H LYS 4 H LYS 4 0.202 -6.809 1.731
30 HA LYS 4 HA LYS 4 -2.416 -5.612 2.301
31 HB2 LYS 4 HB2 LYS 4 -1.652 -7.201 4.021
32 HB3 LYS 4 HB3 LYS 4 -0.157 -6.261 4.206
33 HG2 LYS 4 HG2 LYS 4 -1.557 -4.301 4.886
34 HG3 LYS 4 HG3 LYS 4 -2.976 -5.376 4.865
35 HD2 LYS 4 HD2 LYS 4 -0.485 -5.889 6.516
36 HD3 LYS 4 HD3 LYS 4 -1.930 -5.048 7.131
37 HE2 LYS 4 HE2 LYS 4 -3.291 -6.992 6.797
38 HE3 LYS 4 HE3 LYS 4 -1.983 -7.826 5.925
39 HZ1 LYS 4 HZ1 LYS 4 -0.892 -8.274 7.854
40 HZ2 LYS 4 HZ2 LYS 4 -2.441 -8.276 8.446
41 HZ3 LYS 4 HZ3 LYS 4 -1.476 -6.946 8.663
42 H LEU 5 H LEU 5 -2.561 -3.456 2.830
43 HA LEU 5 HA LEU 5 0.035 -1.872 2.532
44 HB2 LEU 5 HB2 LEU 5 -1.420 -1.404 0.634
45 HB3 LEU 5 HB3 LEU 5 -2.816 -1.150 1.691
46 HG LEU 5 HG LEU 5 -1.552 0.813 2.701
47 HD11 LEU 5 HD11 LEU 5 0.687 0.316 2.046
48 HD12 LEU 5 HD12 LEU 5 0.201 1.781 1.194
49 HD13 LEU 5 HD13 LEU 5 0.240 0.238 0.342
50 HD21 LEU 5 HD21 LEU 5 -2.258 2.307 0.992
51 HD22 LEU 5 HD22 LEU 5 -3.374 0.942 0.966
52 HD23 LEU 5 HD23 LEU 5 -2.109 1.068 -0.254
53 H VAL 6 H VAL 6 0.425 -0.833 4.424
54 HA VAL 6 HA VAL 6 -1.689 -0.321 6.374
55 HB VAL 6 HB VAL 6 1.310 -0.391 6.829
56 HG11 VAL 6 HG11 VAL 6 0.914 0.132 9.081
57 HG12 VAL 6 HG12 VAL 6 -0.816 -0.182 8.951
58 HG13 VAL 6 HG13 VAL 6 -0.120 1.248 8.188
59 HG21 VAL 6 HG21 VAL 6 -0.882 -2.364 7.367
60 HG22 VAL 6 HG22 VAL 6 0.537 -2.306 8.413
61 HG23 VAL 6 HG23 VAL 6 0.725 -2.625 6.689
62 H ILE 7 H ILE 7 -2.336 1.728 6.609
63 HA ILE 7 HA ILE 7 -0.551 3.864 5.261
64 HB ILE 7 HB ILE 7 -3.537 3.984 5.931
65 HG12 ILE 7 HG12 ILE 7 -2.133 3.926 3.232
66 HG13 ILE 7 HG13 ILE 7 -2.916 2.519 3.984
67 HG21 ILE 7 HG21 ILE 7 -3.200 6.095 4.422
68 HG22 ILE 7 HG22 ILE 7 -1.528 5.983 4.971
69 HG23 ILE 7 HG23 ILE 7 -2.832 6.167 6.144
70 HD11 ILE 7 HD11 ILE 7 -4.344 3.565 2.313
71 HD12 ILE 7 HD12 ILE 7 -4.284 5.090 3.197
72 HD13 ILE 7 HD13 ILE 7 -5.059 3.681 3.921
73 H ASN 8 H ASN 8 0.635 4.871 6.749
74 HA ASN 8 HA ASN 8 -0.544 5.355 9.493
75 HB2 ASN 8 HB2 ASN 8 1.547 3.939 9.334
76 HB3 ASN 8 HB3 ASN 8 2.396 5.347 8.657
77 HD21 ASN 8 HD21 ASN 8 1.361 3.725 11.467
78 HD22 ASN 8 HD22 ASN 8 1.866 4.978 12.655
79 H GLY 9 H GLY 9 -1.756 7.135 8.423
80 HA2 GLY 9 HA2 GLY 9 -0.280 9.409 7.274
81 HA3 GLY 9 HA3 GLY 9 -1.974 9.129 7.249
82 H LYS 10 H LYS 10 -1.157 11.638 7.920
83 HA LYS 10 HA LYS 10 -0.897 12.035 10.799
84 HB2 LYS 10 HB2 LYS 10 -1.707 13.834 8.500
85 HB3 LYS 10 HB3 LYS 10 -1.451 14.382 10.169
86 HG2 LYS 10 HG2 LYS 10 0.726 12.859 8.782
87 HG3 LYS 10 HG3 LYS 10 0.457 14.572 8.379
88 HD2 LYS 10 HD2 LYS 10 0.563 15.042 10.874
89 HD3 LYS 10 HD3 LYS 10 1.136 13.367 11.072
90 HE2 LYS 10 HE2 LYS 10 3.052 13.898 9.490
91 HE3 LYS 10 HE3 LYS 10 2.512 15.582 9.454
92 HZ1 LYS 10 HZ1 LYS 10 3.962 15.407 11.331
93 HZ2 LYS 10 HZ2 LYS 10 3.286 13.985 11.854
94 HZ3 LYS 10 HZ3 LYS 10 2.438 15.403 11.994
95 H THR 11 H THR 11 -3.445 12.020 8.538
96 HA THR 11 HA THR 11 -5.551 12.266 10.621
97 HB THR 11 HB THR 11 -7.031 13.199 8.941
98 HG1 THR 11 HG1 THR 11 -6.362 13.487 6.976
99 HG21 THR 11 HG21 THR 11 -4.535 14.724 9.648
100 HG22 THR 11 HG22 THR 11 -6.112 14.774 10.436
101 HG23 THR 11 HG23 THR 11 -5.911 15.452 8.821
102 H LEU 12 H LEU 12 -4.514 10.208 8.010
103 HA LEU 12 HA LEU 12 -6.880 8.555 8.637
104 HB2 LEU 12 HB2 LEU 12 -6.906 9.383 6.326
105 HB3 LEU 12 HB3 LEU 12 -5.285 8.720 6.071
106 HG LEU 12 HG LEU 12 -6.173 6.436 6.415
107 HD11 LEU 12 HD11 LEU 12 -8.045 7.037 7.894
108 HD12 LEU 12 HD12 LEU 12 -8.565 6.052 6.526
109 HD13 LEU 12 HD13 LEU 12 -8.874 7.788 6.530
110 HD21 LEU 12 HD21 LEU 12 -7.709 8.003 4.335
111 HD22 LEU 12 HD22 LEU 12 -7.357 6.275 4.309
112 HD23 LEU 12 HD23 LEU 12 -6.045 7.445 4.163
113 H LYS 13 H LYS 13 -6.505 6.674 9.641
114 HA LYS 13 HA LYS 13 -3.873 5.402 9.184
115 HB2 LYS 13 HB2 LYS 13 -5.415 5.483 11.772
116 HB3 LYS 13 HB3 LYS 13 -3.902 4.599 11.500
117 HG2 LYS 13 HG2 LYS 13 -2.955 6.930 10.834
118 HG3 LYS 13 HG3 LYS 13 -4.371 7.557 11.713
119 HD2 LYS 13 HD2 LYS 13 -3.691 6.434 13.733
120 HD3 LYS 13 HD3 LYS 13 -2.379 5.586 12.875
121 HE2 LYS 13 HE2 LYS 13 -2.546 8.602 13.063
122 HE3 LYS 13 HE3 LYS 13 -1.710 7.605 14.276
123 HZ1 LYS 13 HZ1 LYS 13 -0.244 6.808 12.581
124 HZ2 LYS 13 HZ2 LYS 13 -0.236 8.465 12.533
125 HZ3 LYS 13 HZ3 LYS 13 -1.073 7.610 11.385
126 H GLY 14 H GLY 14 -4.019 3.134 8.536
127 HA2 GLY 14 HA2 GLY 14 -5.861 1.373 9.547
128 HA3 GLY 14 HA3 GLY 14 -6.718 1.951 8.139
129 H GLU 15 H GLU 15 -6.667 -0.183 7.502
130 HA GLU 15 HA GLU 15 -4.187 -0.875 6.044
131 HB2 GLU 15 HB2 GLU 15 -5.704 -2.555 8.026
132 HB3 GLU 15 HB3 GLU 15 -4.676 -3.292 6.781
133 HG2 GLU 15 HG2 GLU 15 -2.840 -1.704 7.705
134 HG3 GLU 15 HG3 GLU 15 -3.902 -1.584 9.127
135 H THR 16 H THR 16 -4.486 -2.154 4.107
136 HA THR 16 HA THR 16 -7.202 -3.121 3.619
137 HB THR 16 HB THR 16 -6.980 -2.182 1.173
138 HG1 THR 16 HG1 THR 16 -5.178 -1.028 1.156
139 HG21 THR 16 HG21 THR 16 -8.741 -1.572 2.923
140 HG22 THR 16 HG22 THR 16 -8.437 -0.420 1.622
141 HG23 THR 16 HG23 THR 16 -7.761 -0.137 3.226
142 H THR 17 H THR 17 -7.150 -4.376 1.434
143 HA THR 17 HA THR 17 -4.519 -5.628 1.113
144 HB THR 17 HB THR 17 -5.466 -7.856 1.229
145 HG1 THR 17 HG1 THR 17 -7.877 -6.501 1.895
146 HG21 THR 17 HG21 THR 17 -5.538 -8.087 3.490
147 HG22 THR 17 HG22 THR 17 -6.540 -6.654 3.726
148 HG23 THR 17 HG23 THR 17 -4.819 -6.480 3.386
149 H THR 18 H THR 18 -4.323 -6.844 -0.842
150 HA THR 18 HA THR 18 -6.553 -6.629 -2.738
151 HB THR 18 HB THR 18 -5.095 -4.536 -3.125
152 HG1 THR 18 HG1 THR 18 -6.410 -5.121 -4.775
153 HG21 THR 18 HG21 THR 18 -3.246 -6.148 -4.751
154 HG22 THR 18 HG22 THR 18 -2.961 -6.178 -3.010
155 HG23 THR 18 HG23 THR 18 -2.983 -4.641 -3.876
156 H LYS 19 H LYS 19 -6.177 -8.032 -4.633
157 HA LYS 19 HA LYS 19 -4.243 -10.199 -3.998
158 HB2 LYS 19 HB2 LYS 19 -6.724 -10.224 -5.754
159 HB3 LYS 19 HB3 LYS 19 -5.650 -11.604 -5.461
160 HG2 LYS 19 HG2 LYS 19 -6.683 -10.379 -3.002
161 HG3 LYS 19 HG3 LYS 19 -7.955 -11.015 -4.073
162 HD2 LYS 19 HD2 LYS 19 -5.513 -12.596 -3.219
163 HD3 LYS 19 HD3 LYS 19 -7.077 -12.648 -2.368
164 HE2 LYS 19 HE2 LYS 19 -6.980 -13.146 -5.328
165 HE3 LYS 19 HE3 LYS 19 -6.488 -14.436 -4.205
166 HZ1 LYS 19 HZ1 LYS 19 -8.740 -13.812 -3.089
167 HZ2 LYS 19 HZ2 LYS 19 -8.710 -14.828 -4.400
168 HZ3 LYS 19 HZ3 LYS 19 -9.123 -13.233 -4.597
169 H ALA 20 H ALA 20 -2.533 -10.480 -5.444
170 HA ALA 20 HA ALA 20 -2.805 -9.487 -8.110
171 HB1 ALA 20 HB1 ALA 20 -0.589 -8.213 -7.925
172 HB2 ALA 20 HB2 ALA 20 -0.820 -8.285 -6.178
173 HB3 ALA 20 HB3 ALA 20 -1.993 -7.440 -7.190
174 H VAL 21 H VAL 21 -1.191 -10.238 -9.607
175 HA VAL 21 HA VAL 21 -0.023 -12.646 -8.835
176 HB VAL 21 HB VAL 21 -0.780 -12.218 -11.110
177 HG11 VAL 21 HG11 VAL 21 0.220 -9.899 -11.166
178 HG12 VAL 21 HG12 VAL 21 0.487 -10.879 -12.607
179 HG13 VAL 21 HG13 VAL 21 1.786 -10.664 -11.435
180 HG21 VAL 21 HG21 VAL 21 2.149 -12.952 -11.080
181 HG22 VAL 21 HG22 VAL 21 0.892 -13.525 -12.178
182 HG23 VAL 21 HG23 VAL 21 0.882 -14.026 -10.486
183 H ASP 22 H ASP 22 1.399 -9.438 -8.755
184 HA ASP 22 HA ASP 22 3.754 -10.623 -7.563
185 HB2 ASP 22 HB2 ASP 22 5.356 -9.603 -9.159
186 HB3 ASP 22 HB3 ASP 22 4.326 -10.821 -9.943
187 H ALA 23 H ALA 23 5.351 -8.898 -6.822
188 HA ALA 23 HA ALA 23 3.801 -7.127 -5.231
189 HB1 ALA 23 HB1 ALA 23 5.810 -7.839 -4.286
190 HB2 ALA 23 HB2 ALA 23 6.085 -6.139 -4.666
191 HB3 ALA 23 HB3 ALA 23 6.746 -7.393 -5.714
192 H GLU 24 H GLU 24 5.646 -6.594 -8.252
193 HA GLU 24 HA GLU 24 5.528 -3.685 -8.041
194 HB2 GLU 24 HB2 GLU 24 6.964 -4.984 -9.617
195 HB3 GLU 24 HB3 GLU 24 5.530 -5.535 -10.505
196 HG2 GLU 24 HG2 GLU 24 5.031 -3.067 -10.920
197 HG3 GLU 24 HG3 GLU 24 6.682 -2.754 -10.336
198 H THR 25 H THR 25 3.214 -6.011 -9.536
199 HA THR 25 HA THR 25 1.529 -3.848 -10.628
200 HB THR 25 HB THR 25 0.797 -6.737 -9.909
201 HG1 THR 25 HG1 THR 25 1.902 -7.106 -11.647
202 HG21 THR 25 HG21 THR 25 -0.732 -4.607 -11.364
203 HG22 THR 25 HG22 THR 25 -1.272 -5.684 -10.077
204 HG23 THR 25 HG23 THR 25 -0.985 -6.320 -11.697
205 H ALA 26 H ALA 26 1.606 -5.640 -7.447
206 HA ALA 26 HA ALA 26 -0.792 -4.366 -6.369
207 HB1 ALA 26 HB1 ALA 26 0.505 -6.298 -5.330
208 HB2 ALA 26 HB2 ALA 26 -0.020 -5.037 -4.216
209 HB3 ALA 26 HB3 ALA 26 1.659 -5.095 -4.753
210 H GLU 27 H GLU 27 2.605 -3.229 -6.776
211 HA GLU 27 HA GLU 27 2.253 -0.945 -5.203
212 HB2 GLU 27 HB2 GLU 27 4.444 -1.774 -5.971
213 HB3 GLU 27 HB3 GLU 27 4.065 -1.206 -7.609
214 HG2 GLU 27 HG2 GLU 27 3.761 1.104 -6.572
215 HG3 GLU 27 HG3 GLU 27 4.528 0.428 -5.116
216 H LYS 28 H LYS 28 1.728 -1.284 -8.715
217 HA LYS 28 HA LYS 28 1.012 1.475 -9.141
218 HB2 LYS 28 HB2 LYS 28 -0.042 -0.940 -10.628
219 HB3 LYS 28 HB3 LYS 28 -0.027 0.742 -11.195
220 HG2 LYS 28 HG2 LYS 28 2.386 0.742 -11.284
221 HG3 LYS 28 HG3 LYS 28 2.448 -0.888 -10.570
222 HD2 LYS 28 HD2 LYS 28 1.657 -1.905 -12.503
223 HD3 LYS 28 HD3 LYS 28 0.898 -0.409 -13.103
224 HE2 LYS 28 HE2 LYS 28 3.009 0.522 -13.702
225 HE3 LYS 28 HE3 LYS 28 3.893 -0.749 -12.825
226 HZ1 LYS 28 HZ1 LYS 28 3.025 -2.349 -14.430
227 HZ2 LYS 28 HZ2 LYS 28 3.916 -1.169 -15.181
228 HZ3 LYS 28 HZ3 LYS 28 2.260 -1.133 -15.264
229 H ALA 29 H ALA 29 -1.021 -1.354 -8.136
230 HA ALA 29 HA ALA 29 -3.498 0.222 -8.307
231 HB1 ALA 29 HB1 ALA 29 -4.516 -1.588 -7.054
232 HB2 ALA 29 HB2 ALA 29 -2.944 -2.197 -6.536
233 HB3 ALA 29 HB3 ALA 29 -3.412 -2.297 -8.234
234 H PHE 30 H PHE 30 -1.237 -0.556 -5.532
235 HA PHE 30 HA PHE 30 -2.862 0.855 -3.615
236 HB2 PHE 30 HB2 PHE 30 0.060 0.015 -3.683
237 HB3 PHE 30 HB3 PHE 30 -0.681 0.819 -2.282
238 HD1 PHE 30 HD1 PHE 30 -3.263 -0.432 -2.029
239 HD2 PHE 30 HD2 PHE 30 0.463 -2.175 -3.126
240 HE1 PHE 30 HE1 PHE 30 -4.040 -2.612 -1.191
241 HE2 PHE 30 HE2 PHE 30 -0.308 -4.356 -2.292
242 HZ PHE 30 HZ PHE 30 -2.562 -4.577 -1.321
243 H LYS 31 H LYS 31 -0.189 1.987 -5.774
244 HA LYS 31 HA LYS 31 -0.121 4.615 -4.462
245 HB2 LYS 31 HB2 LYS 31 1.640 3.853 -6.033
246 HB3 LYS 31 HB3 LYS 31 0.471 3.922 -7.366
247 HG2 LYS 31 HG2 LYS 31 0.186 6.421 -6.494
248 HG3 LYS 31 HG3 LYS 31 1.839 6.129 -5.898
249 HD2 LYS 31 HD2 LYS 31 2.447 5.365 -8.214
250 HD3 LYS 31 HD3 LYS 31 0.835 5.902 -8.750
251 HE2 LYS 31 HE2 LYS 31 1.337 8.131 -8.481
252 HE3 LYS 31 HE3 LYS 31 2.553 7.817 -7.220
253 HZ1 LYS 31 HZ1 LYS 31 2.927 7.146 -10.078
254 HZ2 LYS 31 HZ2 LYS 31 4.069 7.073 -8.877
255 HZ3 LYS 31 HZ3 LYS 31 3.484 8.543 -9.373
256 H GLN 32 H GLN 32 -2.270 3.259 -6.939
257 HA GLN 32 HA GLN 32 -3.568 5.802 -7.441
258 HB2 GLN 32 HB2 GLN 32 -3.785 4.000 -9.057
259 HB3 GLN 32 HB3 GLN 32 -4.505 2.933 -7.835
260 HG2 GLN 32 HG2 GLN 32 -6.419 4.537 -7.671
261 HG3 GLN 32 HG3 GLN 32 -5.716 5.428 -9.041
262 HE21 GLN 32 HE21 GLN 32 -8.252 4.468 -9.225
263 HE22 GLN 32 HE22 GLN 32 -8.290 3.088 -10.376
264 H TYR 33 H TYR 33 -4.356 3.117 -5.231
265 HA TYR 33 HA TYR 33 -6.773 4.279 -4.187
266 HB2 TYR 33 HB2 TYR 33 -6.027 1.920 -3.773
267 HB3 TYR 33 HB3 TYR 33 -4.652 2.535 -2.831
268 HD1 TYR 33 HD2 TYR 33 -5.154 3.826 -0.695
269 HD2 TYR 33 HD1 TYR 33 -8.107 1.558 -2.754
270 HE1 TYR 33 HE2 TYR 33 -6.531 3.780 1.342
271 HE2 TYR 33 HE1 TYR 33 -9.492 1.507 -0.723
272 HH TYR 33 HH TYR 33 -8.646 1.842 2.094
273 H ALA 34 H ALA 34 -3.406 4.637 -3.017
274 HA ALA 34 HA ALA 34 -3.970 6.403 -0.879
275 HB1 ALA 34 HB1 ALA 34 -1.740 5.236 -1.562
276 HB2 ALA 34 HB2 ALA 34 -1.695 6.806 -0.760
277 HB3 ALA 34 HB3 ALA 34 -1.485 6.702 -2.508
278 H ASN 35 H ASN 35 -3.265 7.144 -4.297
279 HA ASN 35 HA ASN 35 -3.401 10.030 -3.844
280 HB2 ASN 35 HB2 ASN 35 -3.857 8.280 -6.317
281 HB3 ASN 35 HB3 ASN 35 -3.906 10.055 -6.374
282 HD21 ASN 35 HD21 ASN 35 -2.160 8.874 -7.978
283 HD22 ASN 35 HD22 ASN 35 -0.486 9.052 -7.349
284 H ASP 36 H ASP 36 -6.000 7.657 -4.776
285 HA ASP 36 HA ASP 36 -8.005 9.696 -5.125
286 HB2 ASP 36 HB2 ASP 36 -8.265 6.765 -4.434
287 HB3 ASP 36 HB3 ASP 36 -9.659 7.834 -4.698
288 H ASN 37 H ASN 37 -6.635 8.362 -2.204
289 HA ASN 37 HA ASN 37 -8.823 9.711 -0.652
290 HB2 ASN 37 HB2 ASN 37 -6.852 7.530 0.044
291 HB3 ASN 37 HB3 ASN 37 -7.761 8.411 1.290
292 HD21 ASN 37 HD21 ASN 37 -7.923 6.183 -1.401
293 HD22 ASN 37 HD22 ASN 37 -9.592 5.604 -1.067
294 H GLY 38 H GLY 38 -5.943 10.734 -1.796
295 HA2 GLY 38 HA2 GLY 38 -4.949 12.745 -1.207
296 HA3 GLY 38 HA3 GLY 38 -5.929 12.807 0.242
297 H VAL 39 H VAL 39 -3.843 10.067 -0.241
298 HA VAL 39 HA VAL 39 -2.151 11.057 2.045
299 HB VAL 39 HB VAL 39 -2.630 8.236 1.096
300 HG11 VAL 39 HG11 VAL 39 -1.343 8.888 3.695
301 HG12 VAL 39 HG12 VAL 39 -0.369 9.081 2.239
302 HG13 VAL 39 HG13 VAL 39 -1.091 7.516 2.615
303 HG21 VAL 39 HG21 VAL 39 -3.982 7.944 3.010
304 HG22 VAL 39 HG22 VAL 39 -4.524 9.462 2.293
305 HG23 VAL 39 HG23 VAL 39 -3.474 9.481 3.708
306 H ASP 40 H ASP 40 -0.164 11.454 1.839
307 HA ASP 40 HA ASP 40 1.275 10.370 -0.526
308 HB2 ASP 40 HB2 ASP 40 0.399 12.551 -1.145
309 HB3 ASP 40 HB3 ASP 40 1.086 13.278 0.324
310 H GLY 41 H GLY 41 3.057 9.723 -0.289
311 HA2 GLY 41 HA2 GLY 41 4.987 10.772 1.716
312 HA3 GLY 41 HA3 GLY 41 4.131 9.336 2.225
313 H VAL 42 H VAL 42 6.056 8.530 2.724
314 HA VAL 42 HA VAL 42 7.766 7.796 0.462
315 HB VAL 42 HB VAL 42 8.224 7.700 3.441
316 HG11 VAL 42 HG11 VAL 42 9.236 5.747 2.247
317 HG12 VAL 42 HG12 VAL 42 10.398 6.800 3.055
318 HG13 VAL 42 HG13 VAL 42 10.196 6.889 1.306
319 HG21 VAL 42 HG21 VAL 42 10.227 9.173 2.565
320 HG22 VAL 42 HG22 VAL 42 8.637 9.873 2.867
321 HG23 VAL 42 HG23 VAL 42 9.127 9.473 1.223
322 H TRP 43 H TRP 43 8.042 5.696 -0.237
323 HA TRP 43 HA TRP 43 6.150 3.655 1.044
324 HB2 TRP 43 HB2 TRP 43 7.436 3.982 -1.703
325 HB3 TRP 43 HB3 TRP 43 6.576 2.507 -1.208
326 HD1 TRP 43 HD1 TRP 43 5.936 6.244 -1.917
327 HE1 TRP 43 HE1 TRP 43 3.419 6.588 -2.448
328 HE3 TRP 43 HE3 TRP 43 4.306 1.511 -0.886
329 HZ2 TRP 43 HZ2 TRP 43 1.079 4.995 -2.409
330 HZ3 TRP 43 HZ3 TRP 43 1.916 1.000 -1.159
331 HH2 TRP 43 HH2 TRP 43 0.336 2.707 -1.903
332 H THR 44 H THR 44 6.801 1.769 1.857
333 HA THR 44 HA THR 44 9.551 0.866 1.185
334 HB THR 44 HB THR 44 9.667 -0.141 3.544
335 HG1 THR 44 HG1 THR 44 7.536 1.700 3.896
336 HG21 THR 44 HG21 THR 44 10.943 1.891 2.838
337 HG22 THR 44 HG22 THR 44 10.577 1.795 4.561
338 HG23 THR 44 HG23 THR 44 9.642 2.869 3.520
339 H TYR 45 H TYR 45 9.764 -1.455 1.257
340 HA TYR 45 HA TYR 45 7.308 -2.987 1.392
341 HB2 TYR 45 HB2 TYR 45 7.674 -2.548 -0.962
342 HB3 TYR 45 HB3 TYR 45 9.346 -3.130 -0.814
343 HD1 TYR 45 HD1 TYR 45 6.135 -4.588 0.443
344 HD2 TYR 45 HD2 TYR 45 9.498 -5.035 -2.126
345 HE1 TYR 45 HE1 TYR 45 5.391 -6.860 -0.129
346 HE2 TYR 45 HE2 TYR 45 8.763 -7.310 -2.705
347 HH TYR 45 HH TYR 45 7.342 -9.110 -1.640
348 H ASP 46 H ASP 46 7.375 -4.866 2.454
349 HA ASP 46 HA ASP 46 10.059 -5.946 3.064
350 HB2 ASP 46 HB2 ASP 46 8.867 -5.220 5.112
351 HB3 ASP 46 HB3 ASP 46 7.471 -6.219 4.651
352 H ASP 47 H ASP 47 10.445 -7.548 1.671
353 HA ASP 47 HA ASP 47 8.335 -8.921 0.258
354 HB2 ASP 47 HB2 ASP 47 10.703 -8.632 -0.545
355 HB3 ASP 47 HB3 ASP 47 11.206 -9.849 0.650
356 H ALA 48 H ALA 48 9.933 -9.702 3.381
357 HA ALA 48 HA ALA 48 9.159 -12.540 3.273
358 HB1 ALA 48 HB1 ALA 48 9.708 -10.638 5.607
359 HB2 ALA 48 HB2 ALA 48 10.874 -11.704 4.822
360 HB3 ALA 48 HB3 ALA 48 9.545 -12.386 5.760
361 H THR 49 H THR 49 7.451 -9.629 4.375
362 HA THR 49 HA THR 49 5.113 -11.461 5.157
363 HB THR 49 HB THR 49 4.167 -9.511 6.393
364 HG1 THR 49 HG1 THR 49 6.501 -8.120 5.546
365 HG21 THR 49 HG21 THR 49 5.374 -9.973 8.185
366 HG22 THR 49 HG22 THR 49 6.770 -9.120 7.528
367 HG23 THR 49 HG23 THR 49 6.524 -10.825 7.154
368 H LYS 50 H LYS 50 6.116 -9.766 2.475
369 HA LYS 50 HA LYS 50 5.010 -8.784 0.675
370 HB2 LYS 50 HB2 LYS 50 2.677 -10.524 1.636
371 HB3 LYS 50 HB3 LYS 50 2.796 -9.750 0.044
372 HG2 LYS 50 HG2 LYS 50 4.883 -11.694 1.022
373 HG3 LYS 50 HG3 LYS 50 3.390 -12.235 0.218
374 HD2 LYS 50 HD2 LYS 50 4.002 -10.615 -1.660
375 HD3 LYS 50 HD3 LYS 50 5.604 -10.498 -0.891
376 HE2 LYS 50 HE2 LYS 50 6.189 -12.628 -1.469
377 HE3 LYS 50 HE3 LYS 50 4.517 -13.231 -1.380
378 HZ1 LYS 50 HZ1 LYS 50 4.057 -12.220 -3.478
379 HZ2 LYS 50 HZ2 LYS 50 5.427 -13.141 -3.652
380 HZ3 LYS 50 HZ3 LYS 50 5.548 -11.490 -3.541
381 H THR 51 H THR 51 5.050 -7.196 2.884
382 HA THR 51 HA THR 51 2.480 -5.805 2.746
383 HB THR 51 HB THR 51 4.488 -5.930 4.985
384 HG1 THR 51 HG1 THR 51 1.823 -6.884 4.749
385 HG21 THR 51 HG21 THR 51 3.351 -3.703 4.780
386 HG22 THR 51 HG22 THR 51 3.062 -4.563 6.293
387 HG23 THR 51 HG23 THR 51 1.820 -4.538 5.042
388 H PHE 52 H PHE 52 2.328 -3.797 2.095
389 HA PHE 52 HA PHE 52 4.995 -2.288 1.539
390 HB2 PHE 52 HB2 PHE 52 2.107 -2.044 0.448
391 HB3 PHE 52 HB3 PHE 52 3.371 -0.821 0.193
392 HD1 PHE 52 HD2 PHE 52 5.332 -1.342 -1.182
393 HD2 PHE 52 HD1 PHE 52 2.127 -4.110 -0.746
394 HE1 PHE 52 HE2 PHE 52 6.145 -2.586 -3.144
395 HE2 PHE 52 HE1 PHE 52 2.934 -5.358 -2.708
396 HZ PHE 52 HZ PHE 52 4.945 -4.596 -3.910
397 H THR 53 H THR 53 5.108 -0.339 2.795
398 HA THR 53 HA THR 53 2.824 0.447 4.505
399 HB THR 53 HB THR 53 5.781 0.610 5.229
400 HG1 THR 53 HG1 THR 53 5.339 -1.373 5.807
401 HG21 THR 53 HG21 THR 53 5.300 1.872 7.003
402 HG22 THR 53 HG22 THR 53 3.793 1.016 7.333
403 HG23 THR 53 HG23 THR 53 3.833 2.296 6.120
404 H VAL 54 H VAL 54 2.306 2.600 4.429
405 HA VAL 54 HA VAL 54 4.333 4.345 2.938
406 HB VAL 54 HB VAL 54 2.367 4.028 1.471
407 HG11 VAL 54 HG11 VAL 54 0.142 4.605 2.080
408 HG12 VAL 54 HG12 VAL 54 0.662 5.272 3.628
409 HG13 VAL 54 HG13 VAL 54 0.753 3.535 3.342
410 HG21 VAL 54 HG21 VAL 54 1.639 6.490 1.408
411 HG22 VAL 54 HG22 VAL 54 3.358 6.137 1.232
412 HG23 VAL 54 HG23 VAL 54 2.729 6.716 2.775
413 H THR 55 H THR 55 5.065 5.834 4.333
414 HA THR 55 HA THR 55 3.455 6.495 6.770
415 HB THR 55 HB THR 55 6.468 6.488 6.409
416 HG1 THR 55 HG1 THR 55 4.823 4.763 7.955
417 HG21 THR 55 HG21 THR 55 4.968 6.784 8.990
418 HG22 THR 55 HG22 THR 55 5.622 8.146 8.080
419 HG23 THR 55 HG23 THR 55 6.703 6.905 8.710
420 H GLU 56 H GLU 56 2.802 8.546 6.891
421 HA GLU 56 HA GLU 56 3.886 10.613 4.982
422 HB2 GLU 56 HB2 GLU 56 1.431 10.212 5.205
423 HB3 GLU 56 HB3 GLU 56 1.535 10.680 6.912
424 HG2 GLU 56 HG2 GLU 56 2.445 12.900 6.131
425 HG3 GLU 56 HG3 GLU 56 2.013 12.398 4.480
Start of MODEL 20
1 H1 MET 1 H1 MET 1 -1.060 -13.068 -5.568
2 H2 MET 1 H2 MET 1 -2.124 -14.314 -5.180
3 H3 MET 1 H3 MET 1 -0.502 -14.654 -5.475
4 HA MET 1 HA MET 1 -1.181 -14.666 -3.114
5 HB2 MET 1 HB2 MET 1 0.946 -12.670 -3.956
6 HB3 MET 1 HB3 MET 1 0.868 -13.557 -2.422
7 HG2 MET 1 HG2 MET 1 0.886 -15.654 -4.039
8 HG3 MET 1 HG3 MET 1 1.659 -14.494 -5.144
9 HE1 MET 1 HE1 MET 1 3.247 -16.827 -1.766
10 HE2 MET 1 HE2 MET 1 1.558 -16.455 -2.112
11 HE3 MET 1 HE3 MET 1 2.472 -15.446 -0.991
12 H GLN 2 H GLN 2 -1.591 -13.411 -1.235
13 HA GLN 2 HA GLN 2 -3.069 -10.911 -1.810
14 HB2 GLN 2 HB2 GLN 2 -2.951 -12.922 0.406
15 HB3 GLN 2 HB3 GLN 2 -3.273 -11.242 0.877
16 HG2 GLN 2 HG2 GLN 2 -5.291 -11.171 -0.270
17 HG3 GLN 2 HG3 GLN 2 -4.862 -12.545 -1.316
18 HE21 GLN 2 HE21 GLN 2 -7.292 -12.267 0.098
19 HE22 GLN 2 HE22 GLN 2 -7.361 -13.588 1.315
20 H TYR 3 H TYR 3 -2.359 -8.945 -1.287
21 HA TYR 3 HA TYR 3 0.143 -8.588 0.255
22 HB2 TYR 3 HB2 TYR 3 -0.824 -6.903 -2.050
23 HB3 TYR 3 HB3 TYR 3 0.580 -6.529 -1.025
24 HD1 TYR 3 HD1 TYR 3 -0.775 -9.200 -3.267
25 HD2 TYR 3 HD2 TYR 3 2.680 -7.331 -1.626
26 HE1 TYR 3 HE1 TYR 3 0.654 -10.559 -4.735
27 HE2 TYR 3 HE2 TYR 3 4.116 -8.687 -3.093
28 HH TYR 3 HH TYR 3 3.950 -9.916 -5.212
29 H LYS 4 H LYS 4 0.202 -6.809 1.731
30 HA LYS 4 HA LYS 4 -2.416 -5.612 2.301
31 HB2 LYS 4 HB2 LYS 4 -0.166 -6.409 4.154
32 HB3 LYS 4 HB3 LYS 4 -1.561 -5.435 4.661
33 HG2 LYS 4 HG2 LYS 4 -3.046 -7.313 3.936
34 HG3 LYS 4 HG3 LYS 4 -1.584 -8.286 3.644
35 HD2 LYS 4 HD2 LYS 4 -2.253 -6.988 6.300
36 HD3 LYS 4 HD3 LYS 4 -2.679 -8.665 5.879
37 HE2 LYS 4 HE2 LYS 4 -0.370 -9.267 5.647
38 HE3 LYS 4 HE3 LYS 4 0.144 -7.569 5.792
39 HZ1 LYS 4 HZ1 LYS 4 -0.182 -7.593 8.029
40 HZ2 LYS 4 HZ2 LYS 4 0.211 -9.190 7.825
41 HZ3 LYS 4 HZ3 LYS 4 -1.377 -8.745 7.990
42 H LEU 5 H LEU 5 -2.561 -3.456 2.830
43 HA LEU 5 HA LEU 5 0.035 -1.872 2.532
44 HB2 LEU 5 HB2 LEU 5 -1.419 -1.404 0.634
45 HB3 LEU 5 HB3 LEU 5 -2.816 -1.150 1.690
46 HG LEU 5 HG LEU 5 -1.552 0.813 2.701
47 HD11 LEU 5 HD11 LEU 5 0.687 0.317 2.046
48 HD12 LEU 5 HD12 LEU 5 0.200 1.781 1.195
49 HD13 LEU 5 HD13 LEU 5 0.240 0.238 0.342
50 HD21 LEU 5 HD21 LEU 5 -2.259 2.307 0.992
51 HD22 LEU 5 HD22 LEU 5 -3.374 0.942 0.966
52 HD23 LEU 5 HD23 LEU 5 -2.109 1.068 -0.254
53 H VAL 6 H VAL 6 0.425 -0.833 4.424
54 HA VAL 6 HA VAL 6 -1.689 -0.321 6.374
55 HB VAL 6 HB VAL 6 1.310 -0.392 6.829
56 HG11 VAL 6 HG11 VAL 6 0.915 0.133 9.080
57 HG12 VAL 6 HG12 VAL 6 -0.816 -0.180 8.951
58 HG13 VAL 6 HG13 VAL 6 -0.119 1.248 8.187
59 HG21 VAL 6 HG21 VAL 6 -0.883 -2.363 7.368
60 HG22 VAL 6 HG22 VAL 6 0.536 -2.305 8.414
61 HG23 VAL 6 HG23 VAL 6 0.724 -2.626 6.690
62 H ILE 7 H ILE 7 -2.336 1.728 6.609
63 HA ILE 7 HA ILE 7 -0.551 3.864 5.261
64 HB ILE 7 HB ILE 7 -3.537 3.984 5.931
65 HG12 ILE 7 HG12 ILE 7 -2.133 3.926 3.232
66 HG13 ILE 7 HG13 ILE 7 -2.916 2.519 3.984
67 HG21 ILE 7 HG21 ILE 7 -3.200 6.095 4.422
68 HG22 ILE 7 HG22 ILE 7 -1.528 5.983 4.972
69 HG23 ILE 7 HG23 ILE 7 -2.832 6.167 6.144
70 HD11 ILE 7 HD11 ILE 7 -4.344 3.565 2.313
71 HD12 ILE 7 HD12 ILE 7 -4.284 5.090 3.197
72 HD13 ILE 7 HD13 ILE 7 -5.058 3.681 3.921
73 H ASN 8 H ASN 8 0.635 4.871 6.749
74 HA ASN 8 HA ASN 8 -0.544 5.355 9.493
75 HB2 ASN 8 HB2 ASN 8 1.547 3.939 9.334
76 HB3 ASN 8 HB3 ASN 8 2.396 5.346 8.657
77 HD21 ASN 8 HD21 ASN 8 0.802 3.997 11.485
78 HD22 ASN 8 HD22 ASN 8 1.530 5.142 12.665
79 H GLY 9 H GLY 9 -1.756 7.135 8.423
80 HA2 GLY 9 HA2 GLY 9 -0.280 9.409 7.274
81 HA3 GLY 9 HA3 GLY 9 -1.974 9.129 7.249
82 H LYS 10 H LYS 10 -1.157 11.638 7.920
83 HA LYS 10 HA LYS 10 -0.897 12.035 10.799
84 HB2 LYS 10 HB2 LYS 10 -1.707 13.834 8.500
85 HB3 LYS 10 HB3 LYS 10 -1.451 14.382 10.169
86 HG2 LYS 10 HG2 LYS 10 0.821 14.158 10.046
87 HG3 LYS 10 HG3 LYS 10 0.738 12.838 8.855
88 HD2 LYS 10 HD2 LYS 10 1.603 14.682 7.665
89 HD3 LYS 10 HD3 LYS 10 -0.117 14.600 7.208
90 HE2 LYS 10 HE2 LYS 10 -0.676 16.408 8.659
91 HE3 LYS 10 HE3 LYS 10 0.925 16.368 9.435
92 HZ1 LYS 10 HZ1 LYS 10 0.237 17.299 6.723
93 HZ2 LYS 10 HZ2 LYS 10 1.797 16.920 7.140
94 HZ3 LYS 10 HZ3 LYS 10 1.000 18.134 7.940
95 H THR 11 H THR 11 -3.445 12.020 8.538
96 HA THR 11 HA THR 11 -5.551 12.266 10.621
97 HB THR 11 HB THR 11 -5.474 13.460 7.912
98 HG1 THR 11 HG1 THR 11 -5.507 15.223 9.043
99 HG21 THR 11 HG21 THR 11 -7.893 12.764 9.560
100 HG22 THR 11 HG22 THR 11 -7.574 12.389 7.866
101 HG23 THR 11 HG23 THR 11 -7.880 14.055 8.358
102 H LEU 12 H LEU 12 -4.514 10.208 8.010
103 HA LEU 12 HA LEU 12 -6.880 8.555 8.637
104 HB2 LEU 12 HB2 LEU 12 -6.905 9.384 6.325
105 HB3 LEU 12 HB3 LEU 12 -5.285 8.719 6.071
106 HG LEU 12 HG LEU 12 -6.176 6.436 6.415
107 HD11 LEU 12 HD11 LEU 12 -8.047 7.040 7.895
108 HD12 LEU 12 HD12 LEU 12 -8.567 6.055 6.526
109 HD13 LEU 12 HD13 LEU 12 -8.875 7.791 6.530
110 HD21 LEU 12 HD21 LEU 12 -7.710 8.004 4.335
111 HD22 LEU 12 HD22 LEU 12 -7.360 6.276 4.309
112 HD23 LEU 12 HD23 LEU 12 -6.046 7.444 4.164
113 H LYS 13 H LYS 13 -6.505 6.674 9.641
114 HA LYS 13 HA LYS 13 -3.873 5.402 9.184
115 HB2 LYS 13 HB2 LYS 13 -5.415 5.481 11.772
116 HB3 LYS 13 HB3 LYS 13 -3.900 4.600 11.500
117 HG2 LYS 13 HG2 LYS 13 -2.958 6.934 10.834
118 HG3 LYS 13 HG3 LYS 13 -4.376 7.557 11.714
119 HD2 LYS 13 HD2 LYS 13 -3.693 6.434 13.733
120 HD3 LYS 13 HD3 LYS 13 -2.379 5.591 12.875
121 HE2 LYS 13 HE2 LYS 13 -2.553 8.606 13.064
122 HE3 LYS 13 HE3 LYS 13 -1.714 7.610 14.276
123 HZ1 LYS 13 HZ1 LYS 13 -0.247 6.817 12.581
124 HZ2 LYS 13 HZ2 LYS 13 -0.242 8.474 12.534
125 HZ3 LYS 13 HZ3 LYS 13 -1.078 7.618 11.386
126 H GLY 14 H GLY 14 -4.019 3.134 8.536
127 HA2 GLY 14 HA2 GLY 14 -5.861 1.373 9.547
128 HA3 GLY 14 HA3 GLY 14 -6.718 1.951 8.139
129 H GLU 15 H GLU 15 -6.667 -0.183 7.502
130 HA GLU 15 HA GLU 15 -4.187 -0.875 6.044
131 HB2 GLU 15 HB2 GLU 15 -5.705 -2.557 8.024
132 HB3 GLU 15 HB3 GLU 15 -4.672 -3.292 6.781
133 HG2 GLU 15 HG2 GLU 15 -2.794 -1.837 7.675
134 HG3 GLU 15 HG3 GLU 15 -3.865 -1.467 9.046
135 H THR 16 H THR 16 -4.486 -2.154 4.107
136 HA THR 16 HA THR 16 -7.202 -3.121 3.619
137 HB THR 16 HB THR 16 -7.279 -0.836 2.610
138 HG1 THR 16 HG1 THR 16 -8.571 -2.132 1.501
139 HG21 THR 16 HG21 THR 16 -4.801 -0.844 1.983
140 HG22 THR 16 HG22 THR 16 -5.944 -0.173 0.820
141 HG23 THR 16 HG23 THR 16 -5.288 -1.792 0.579
142 H THR 17 H THR 17 -7.150 -4.376 1.434
143 HA THR 17 HA THR 17 -4.519 -5.628 1.113
144 HB THR 17 HB THR 17 -5.464 -7.856 1.231
145 HG1 THR 17 HG1 THR 17 -7.878 -6.503 1.891
146 HG21 THR 17 HG21 THR 17 -5.540 -8.086 3.492
147 HG22 THR 17 HG22 THR 17 -6.544 -6.654 3.724
148 HG23 THR 17 HG23 THR 17 -4.823 -6.478 3.388
149 H THR 18 H THR 18 -4.323 -6.844 -0.842
150 HA THR 18 HA THR 18 -6.553 -6.629 -2.738
151 HB THR 18 HB THR 18 -5.092 -4.536 -3.123
152 HG1 THR 18 HG1 THR 18 -6.412 -5.116 -4.771
153 HG21 THR 18 HG21 THR 18 -3.250 -6.150 -4.756
154 HG22 THR 18 HG22 THR 18 -2.961 -6.183 -3.016
155 HG23 THR 18 HG23 THR 18 -2.982 -4.645 -3.879
156 H LYS 19 H LYS 19 -6.177 -8.032 -4.633
157 HA LYS 19 HA LYS 19 -4.243 -10.199 -3.998
158 HB2 LYS 19 HB2 LYS 19 -6.724 -10.224 -5.755
159 HB3 LYS 19 HB3 LYS 19 -5.650 -11.604 -5.460
160 HG2 LYS 19 HG2 LYS 19 -6.685 -10.377 -3.003
161 HG3 LYS 19 HG3 LYS 19 -7.956 -11.014 -4.075
162 HD2 LYS 19 HD2 LYS 19 -5.515 -12.595 -3.216
163 HD3 LYS 19 HD3 LYS 19 -7.080 -12.645 -2.367
164 HE2 LYS 19 HE2 LYS 19 -6.980 -13.147 -5.326
165 HE3 LYS 19 HE3 LYS 19 -6.490 -14.435 -4.201
166 HZ1 LYS 19 HZ1 LYS 19 -8.742 -13.809 -3.088
167 HZ2 LYS 19 HZ2 LYS 19 -8.712 -14.826 -4.398
168 HZ3 LYS 19 HZ3 LYS 19 -9.124 -13.232 -4.597
169 H ALA 20 H ALA 20 -2.533 -10.480 -5.444
170 HA ALA 20 HA ALA 20 -2.805 -9.487 -8.110
171 HB1 ALA 20 HB1 ALA 20 -0.589 -8.213 -7.925
172 HB2 ALA 20 HB2 ALA 20 -0.820 -8.285 -6.178
173 HB3 ALA 20 HB3 ALA 20 -1.993 -7.440 -7.190
174 H VAL 21 H VAL 21 -1.191 -10.238 -9.607
175 HA VAL 21 HA VAL 21 -0.023 -12.646 -8.835
176 HB VAL 21 HB VAL 21 0.970 -12.793 -11.039
177 HG11 VAL 21 HG11 VAL 21 -1.471 -13.262 -10.589
178 HG12 VAL 21 HG12 VAL 21 -1.066 -12.865 -12.259
179 HG13 VAL 21 HG13 VAL 21 -1.817 -11.652 -11.223
180 HG21 VAL 21 HG21 VAL 21 -0.152 -10.032 -11.528
181 HG22 VAL 21 HG22 VAL 21 0.871 -10.998 -12.593
182 HG23 VAL 21 HG23 VAL 21 1.535 -10.324 -11.104
183 H ASP 22 H ASP 22 1.399 -9.438 -8.755
184 HA ASP 22 HA ASP 22 3.754 -10.623 -7.563
185 HB2 ASP 22 HB2 ASP 22 5.356 -9.605 -9.159
186 HB3 ASP 22 HB3 ASP 22 4.325 -10.820 -9.945
187 H ALA 23 H ALA 23 5.351 -8.898 -6.822
188 HA ALA 23 HA ALA 23 3.801 -7.127 -5.231
189 HB1 ALA 23 HB1 ALA 23 5.810 -7.839 -4.286
190 HB2 ALA 23 HB2 ALA 23 6.085 -6.139 -4.666
191 HB3 ALA 23 HB3 ALA 23 6.746 -7.393 -5.714
192 H GLU 24 H GLU 24 5.646 -6.594 -8.252
193 HA GLU 24 HA GLU 24 5.528 -3.685 -8.041
194 HB2 GLU 24 HB2 GLU 24 5.725 -5.695 -10.347
195 HB3 GLU 24 HB3 GLU 24 5.696 -3.947 -10.650
196 HG2 GLU 24 HG2 GLU 24 7.650 -3.789 -9.016
197 HG3 GLU 24 HG3 GLU 24 7.755 -5.561 -9.150
198 H THR 25 H THR 25 3.214 -6.011 -9.536
199 HA THR 25 HA THR 25 1.529 -3.848 -10.628
200 HB THR 25 HB THR 25 0.796 -6.737 -9.909
201 HG1 THR 25 HG1 THR 25 1.902 -7.107 -11.646
202 HG21 THR 25 HG21 THR 25 -0.731 -4.607 -11.366
203 HG22 THR 25 HG22 THR 25 -1.273 -5.683 -10.078
204 HG23 THR 25 HG23 THR 25 -0.984 -6.320 -11.698
205 H ALA 26 H ALA 26 1.606 -5.640 -7.447
206 HA ALA 26 HA ALA 26 -0.792 -4.366 -6.369
207 HB1 ALA 26 HB1 ALA 26 0.505 -6.298 -5.330
208 HB2 ALA 26 HB2 ALA 26 -0.020 -5.037 -4.216
209 HB3 ALA 26 HB3 ALA 26 1.659 -5.095 -4.753
210 H GLU 27 H GLU 27 2.605 -3.229 -6.776
211 HA GLU 27 HA GLU 27 2.253 -0.945 -5.203
212 HB2 GLU 27 HB2 GLU 27 4.444 -1.773 -5.971
213 HB3 GLU 27 HB3 GLU 27 4.065 -1.207 -7.609
214 HG2 GLU 27 HG2 GLU 27 3.761 1.104 -6.573
215 HG3 GLU 27 HG3 GLU 27 4.527 0.429 -5.118
216 H LYS 28 H LYS 28 1.728 -1.284 -8.715
217 HA LYS 28 HA LYS 28 1.012 1.475 -9.141
218 HB2 LYS 28 HB2 LYS 28 -0.041 -0.940 -10.628
219 HB3 LYS 28 HB3 LYS 28 -0.027 0.741 -11.194
220 HG2 LYS 28 HG2 LYS 28 2.386 0.743 -11.284
221 HG3 LYS 28 HG3 LYS 28 2.449 -0.888 -10.570
222 HD2 LYS 28 HD2 LYS 28 1.657 -1.905 -12.503
223 HD3 LYS 28 HD3 LYS 28 0.898 -0.409 -13.103
224 HE2 LYS 28 HE2 LYS 28 3.009 0.523 -13.702
225 HE3 LYS 28 HE3 LYS 28 3.893 -0.748 -12.826
226 HZ1 LYS 28 HZ1 LYS 28 3.025 -2.348 -14.430
227 HZ2 LYS 28 HZ2 LYS 28 3.916 -1.167 -15.182
228 HZ3 LYS 28 HZ3 LYS 28 2.260 -1.132 -15.265
229 H ALA 29 H ALA 29 -1.021 -1.354 -8.136
230 HA ALA 29 HA ALA 29 -3.498 0.222 -8.307
231 HB1 ALA 29 HB1 ALA 29 -4.516 -1.588 -7.054
232 HB2 ALA 29 HB2 ALA 29 -2.944 -2.197 -6.536
233 HB3 ALA 29 HB3 ALA 29 -3.412 -2.297 -8.234
234 H PHE 30 H PHE 30 -1.237 -0.556 -5.532
235 HA PHE 30 HA PHE 30 -2.862 0.855 -3.615
236 HB2 PHE 30 HB2 PHE 30 0.061 0.017 -3.682
237 HB3 PHE 30 HB3 PHE 30 -0.682 0.818 -2.282
238 HD1 PHE 30 HD1 PHE 30 -3.263 -0.436 -2.031
239 HD2 PHE 30 HD2 PHE 30 0.465 -2.173 -3.127
240 HE1 PHE 30 HE1 PHE 30 -4.039 -2.618 -1.197
241 HE2 PHE 30 HE2 PHE 30 -0.304 -4.356 -2.297
242 HZ PHE 30 HZ PHE 30 -2.559 -4.580 -1.327
243 H LYS 31 H LYS 31 -0.189 1.987 -5.774
244 HA LYS 31 HA LYS 31 -0.121 4.615 -4.462
245 HB2 LYS 31 HB2 LYS 31 0.593 3.713 -7.270
246 HB3 LYS 31 HB3 LYS 31 0.738 5.399 -6.735
247 HG2 LYS 31 HG2 LYS 31 2.106 4.263 -4.755
248 HG3 LYS 31 HG3 LYS 31 2.352 3.004 -5.991
249 HD2 LYS 31 HD2 LYS 31 3.123 4.813 -7.556
250 HD3 LYS 31 HD3 LYS 31 3.053 5.947 -6.184
251 HE2 LYS 31 HE2 LYS 31 4.852 4.985 -5.120
252 HE3 LYS 31 HE3 LYS 31 4.575 3.391 -5.860
253 HZ1 LYS 31 HZ1 LYS 31 5.563 5.751 -7.346
254 HZ2 LYS 31 HZ2 LYS 31 5.464 4.191 -7.901
255 HZ3 LYS 31 HZ3 LYS 31 6.550 4.577 -6.708
256 H GLN 32 H GLN 32 -2.270 3.259 -6.939
257 HA GLN 32 HA GLN 32 -3.568 5.802 -7.441
258 HB2 GLN 32 HB2 GLN 32 -3.785 4.000 -9.057
259 HB3 GLN 32 HB3 GLN 32 -4.505 2.933 -7.835
260 HG2 GLN 32 HG2 GLN 32 -6.239 3.739 -9.276
261 HG3 GLN 32 HG3 GLN 32 -6.431 4.495 -7.677
262 HE21 GLN 32 HE21 GLN 32 -7.655 6.178 -8.540
263 HE22 GLN 32 HE22 GLN 32 -6.885 7.493 -9.493
264 H TYR 33 H TYR 33 -4.356 3.117 -5.231
265 HA TYR 33 HA TYR 33 -6.773 4.279 -4.187
266 HB2 TYR 33 HB2 TYR 33 -6.023 1.919 -3.774
267 HB3 TYR 33 HB3 TYR 33 -4.652 2.537 -2.828
268 HD1 TYR 33 HD2 TYR 33 -5.163 3.826 -0.694
269 HD2 TYR 33 HD1 TYR 33 -8.106 1.554 -2.761
270 HE1 TYR 33 HE2 TYR 33 -6.547 3.778 1.339
271 HE2 TYR 33 HE1 TYR 33 -9.498 1.500 -0.734
272 HH TYR 33 HH TYR 33 -8.660 1.836 2.085
273 H ALA 34 H ALA 34 -3.406 4.637 -3.017
274 HA ALA 34 HA ALA 34 -3.970 6.403 -0.879
275 HB1 ALA 34 HB1 ALA 34 -1.740 5.236 -1.562
276 HB2 ALA 34 HB2 ALA 34 -1.695 6.806 -0.760
277 HB3 ALA 34 HB3 ALA 34 -1.485 6.702 -2.508
278 H ASN 35 H ASN 35 -3.265 7.144 -4.297
279 HA ASN 35 HA ASN 35 -3.401 10.030 -3.844
280 HB2 ASN 35 HB2 ASN 35 -3.853 8.278 -6.316
281 HB3 ASN 35 HB3 ASN 35 -3.910 10.053 -6.375
282 HD21 ASN 35 HD21 ASN 35 -2.159 8.877 -7.977
283 HD22 ASN 35 HD22 ASN 35 -0.485 9.063 -7.349
284 H ASP 36 H ASP 36 -6.000 7.657 -4.776
285 HA ASP 36 HA ASP 36 -8.005 9.696 -5.125
286 HB2 ASP 36 HB2 ASP 36 -8.267 6.766 -4.431
287 HB3 ASP 36 HB3 ASP 36 -9.660 7.836 -4.701
288 H ASN 37 H ASN 37 -6.635 8.362 -2.204
289 HA ASN 37 HA ASN 37 -8.823 9.711 -0.652
290 HB2 ASN 37 HB2 ASN 37 -6.853 7.528 0.041
291 HB3 ASN 37 HB3 ASN 37 -7.757 8.412 1.290
292 HD21 ASN 37 HD21 ASN 37 -7.932 6.183 -1.401
293 HD22 ASN 37 HD22 ASN 37 -9.602 5.608 -1.061
294 H GLY 38 H GLY 38 -5.943 10.734 -1.796
295 HA2 GLY 38 HA2 GLY 38 -4.949 12.745 -1.207
296 HA3 GLY 38 HA3 GLY 38 -5.929 12.807 0.242
297 H VAL 39 H VAL 39 -3.843 10.067 -0.241
298 HA VAL 39 HA VAL 39 -2.151 11.057 2.045
299 HB VAL 39 HB VAL 39 -2.630 8.236 1.096
300 HG11 VAL 39 HG11 VAL 39 -1.343 8.888 3.695
301 HG12 VAL 39 HG12 VAL 39 -0.369 9.081 2.239
302 HG13 VAL 39 HG13 VAL 39 -1.091 7.516 2.615
303 HG21 VAL 39 HG21 VAL 39 -3.982 7.944 3.010
304 HG22 VAL 39 HG22 VAL 39 -4.524 9.462 2.293
305 HG23 VAL 39 HG23 VAL 39 -3.474 9.481 3.708
306 H ASP 40 H ASP 40 -0.164 11.454 1.839
307 HA ASP 40 HA ASP 40 1.275 10.370 -0.526
308 HB2 ASP 40 HB2 ASP 40 0.263 12.991 -0.259
309 HB3 ASP 40 HB3 ASP 40 2.016 13.116 -0.001
310 H GLY 41 H GLY 41 3.057 9.723 -0.289
311 HA2 GLY 41 HA2 GLY 41 4.987 10.772 1.716
312 HA3 GLY 41 HA3 GLY 41 4.131 9.336 2.225
313 H VAL 42 H VAL 42 6.056 8.530 2.724
314 HA VAL 42 HA VAL 42 7.766 7.796 0.462
315 HB VAL 42 HB VAL 42 8.225 7.697 3.441
316 HG11 VAL 42 HG11 VAL 42 9.240 5.749 2.241
317 HG12 VAL 42 HG12 VAL 42 10.400 6.802 3.051
318 HG13 VAL 42 HG13 VAL 42 10.197 6.896 1.303
319 HG21 VAL 42 HG21 VAL 42 10.224 9.176 2.568
320 HG22 VAL 42 HG22 VAL 42 8.633 9.872 2.872
321 HG23 VAL 42 HG23 VAL 42 9.123 9.477 1.227
322 H TRP 43 H TRP 43 8.042 5.696 -0.237
323 HA TRP 43 HA TRP 43 6.150 3.655 1.044
324 HB2 TRP 43 HB2 TRP 43 7.435 3.985 -1.703
325 HB3 TRP 43 HB3 TRP 43 6.578 2.507 -1.209
326 HD1 TRP 43 HD1 TRP 43 5.929 6.243 -1.915
327 HE1 TRP 43 HE1 TRP 43 3.412 6.582 -2.445
328 HE3 TRP 43 HE3 TRP 43 4.311 1.505 -0.887
329 HZ2 TRP 43 HZ2 TRP 43 1.075 4.983 -2.406
330 HZ3 TRP 43 HZ3 TRP 43 1.922 0.989 -1.158
331 HH2 TRP 43 HH2 TRP 43 0.338 2.693 -1.901
332 H THR 44 H THR 44 6.801 1.769 1.857
333 HA THR 44 HA THR 44 9.551 0.866 1.185
334 HB THR 44 HB THR 44 9.666 -0.141 3.544
335 HG1 THR 44 HG1 THR 44 7.537 1.701 3.895
336 HG21 THR 44 HG21 THR 44 10.944 1.889 2.838
337 HG22 THR 44 HG22 THR 44 10.578 1.793 4.561
338 HG23 THR 44 HG23 THR 44 9.644 2.869 3.519
339 H TYR 45 H TYR 45 9.764 -1.455 1.257
340 HA TYR 45 HA TYR 45 7.308 -2.987 1.392
341 HB2 TYR 45 HB2 TYR 45 7.672 -2.550 -0.961
342 HB3 TYR 45 HB3 TYR 45 9.346 -3.127 -0.815
343 HD1 TYR 45 HD1 TYR 45 6.139 -4.593 0.444
344 HD2 TYR 45 HD2 TYR 45 9.502 -5.032 -2.126
345 HE1 TYR 45 HE1 TYR 45 5.401 -6.868 -0.128
346 HE2 TYR 45 HE2 TYR 45 8.772 -7.309 -2.705
347 HH TYR 45 HH TYR 45 7.357 -9.112 -1.639
348 H ASP 46 H ASP 46 7.375 -4.866 2.454
349 HA ASP 46 HA ASP 46 10.059 -5.946 3.064
350 HB2 ASP 46 HB2 ASP 46 8.866 -5.220 5.112
351 HB3 ASP 46 HB3 ASP 46 7.471 -6.219 4.651
352 H ASP 47 H ASP 47 10.445 -7.548 1.671
353 HA ASP 47 HA ASP 47 8.335 -8.921 0.258
354 HB2 ASP 47 HB2 ASP 47 10.704 -8.632 -0.545
355 HB3 ASP 47 HB3 ASP 47 11.205 -9.850 0.650
356 H ALA 48 H ALA 48 9.933 -9.702 3.381
357 HA ALA 48 HA ALA 48 9.159 -12.540 3.273
358 HB1 ALA 48 HB1 ALA 48 9.708 -10.638 5.607
359 HB2 ALA 48 HB2 ALA 48 10.874 -11.704 4.822
360 HB3 ALA 48 HB3 ALA 48 9.545 -12.386 5.760
361 H THR 49 H THR 49 7.451 -9.629 4.375
362 HA THR 49 HA THR 49 5.113 -11.461 5.157
363 HB THR 49 HB THR 49 4.168 -9.513 6.394
364 HG1 THR 49 HG1 THR 49 6.498 -8.118 5.544
365 HG21 THR 49 HG21 THR 49 5.377 -9.972 8.185
366 HG22 THR 49 HG22 THR 49 6.771 -9.117 7.526
367 HG23 THR 49 HG23 THR 49 6.527 -10.823 7.152
368 H LYS 50 H LYS 50 6.116 -9.766 2.475
369 HA LYS 50 HA LYS 50 5.010 -8.784 0.675
370 HB2 LYS 50 HB2 LYS 50 2.678 -10.525 1.636
371 HB3 LYS 50 HB3 LYS 50 2.795 -9.750 0.045
372 HG2 LYS 50 HG2 LYS 50 4.884 -11.693 1.021
373 HG3 LYS 50 HG3 LYS 50 3.390 -12.235 0.217
374 HD2 LYS 50 HD2 LYS 50 4.001 -10.614 -1.660
375 HD3 LYS 50 HD3 LYS 50 5.604 -10.496 -0.892
376 HE2 LYS 50 HE2 LYS 50 6.189 -12.626 -1.471
377 HE3 LYS 50 HE3 LYS 50 4.517 -13.229 -1.382
378 HZ1 LYS 50 HZ1 LYS 50 4.056 -12.218 -3.480
379 HZ2 LYS 50 HZ2 LYS 50 5.425 -13.138 -3.654
380 HZ3 LYS 50 HZ3 LYS 50 5.546 -11.488 -3.543
381 H THR 51 H THR 51 5.050 -7.196 2.884
382 HA THR 51 HA THR 51 2.480 -5.805 2.746
383 HB THR 51 HB THR 51 4.489 -5.928 4.985
384 HG1 THR 51 HG1 THR 51 1.824 -6.886 4.749
385 HG21 THR 51 HG21 THR 51 3.348 -3.704 4.780
386 HG22 THR 51 HG22 THR 51 3.060 -4.563 6.293
387 HG23 THR 51 HG23 THR 51 1.818 -4.540 5.041
388 H PHE 52 H PHE 52 2.328 -3.797 2.095
389 HA PHE 52 HA PHE 52 4.995 -2.288 1.539
390 HB2 PHE 52 HB2 PHE 52 2.107 -2.042 0.449
391 HB3 PHE 52 HB3 PHE 52 3.373 -0.821 0.192
392 HD1 PHE 52 HD2 PHE 52 5.332 -1.347 -1.184
393 HD2 PHE 52 HD1 PHE 52 2.122 -4.109 -0.744
394 HE1 PHE 52 HE2 PHE 52 6.141 -2.595 -3.145
395 HE2 PHE 52 HE1 PHE 52 2.925 -5.361 -2.704
396 HZ PHE 52 HZ PHE 52 4.937 -4.603 -3.908
397 H THR 53 H THR 53 5.108 -0.339 2.795
398 HA THR 53 HA THR 53 2.824 0.447 4.505
399 HB THR 53 HB THR 53 5.782 0.607 5.228
400 HG1 THR 53 HG1 THR 53 5.335 -1.374 5.810
401 HG21 THR 53 HG21 THR 53 5.303 1.873 7.001
402 HG22 THR 53 HG22 THR 53 3.794 1.021 7.332
403 HG23 THR 53 HG23 THR 53 3.837 2.299 6.118
404 H VAL 54 H VAL 54 2.306 2.600 4.429
405 HA VAL 54 HA VAL 54 4.333 4.345 2.938
406 HB VAL 54 HB VAL 54 2.368 4.028 1.471
407 HG11 VAL 54 HG11 VAL 54 0.142 4.604 2.080
408 HG12 VAL 54 HG12 VAL 54 0.662 5.271 3.628
409 HG13 VAL 54 HG13 VAL 54 0.754 3.534 3.342
410 HG21 VAL 54 HG21 VAL 54 1.639 6.490 1.408
411 HG22 VAL 54 HG22 VAL 54 3.357 6.138 1.233
412 HG23 VAL 54 HG23 VAL 54 2.728 6.716 2.776
413 H THR 55 H THR 55 5.065 5.834 4.333
414 HA THR 55 HA THR 55 3.455 6.495 6.770
415 HB THR 55 HB THR 55 6.468 6.489 6.409
416 HG1 THR 55 HG1 THR 55 4.824 4.762 7.955
417 HG21 THR 55 HG21 THR 55 4.967 6.783 8.990
418 HG22 THR 55 HG22 THR 55 5.621 8.145 8.081
419 HG23 THR 55 HG23 THR 55 6.703 6.904 8.710
420 H GLU 56 H GLU 56 2.802 8.546 6.891
421 HA GLU 56 HA GLU 56 3.886 10.613 4.982
422 HB2 GLU 56 HB2 GLU 56 1.455 10.419 6.793
423 HB3 GLU 56 HB3 GLU 56 1.928 11.916 5.969
424 HG2 GLU 56 HG2 GLU 56 1.770 10.715 3.801
425 HG3 GLU 56 HG3 GLU 56 1.167 9.291 4.682